data_r5t46sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2016-10-26 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5t46 
_cell.length_a      45.2500 
_cell.length_b      70.3470 
_cell.length_c      79.9130 
_cell.angle_alpha   90.0000 
_cell.angle_beta    99.3650 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97858 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.530 
_diffrn_reflns.pdbx_d_res_low    78.848 
_diffrn_reflns.limit_h_max       29 
_diffrn_reflns.limit_h_min       -29 
_diffrn_reflns.limit_k_max       45 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       52 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            74595 
_diffrn_reflns.pdbx_number_obs   74430 
# 
_entry.id   5t46 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5t46 
_symmetry.space_group_name_H-M   "P 1 21 1" 
_symmetry.Int_Tables_number      4 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"       
2 "-X,  Y+1/2,  -Z" 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.intensity_meas 
_refln.intensity_sigma 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_plus 
_refln.pdbx_F_plus_sigma 
_refln.pdbx_F_minus 
_refln.pdbx_F_minus_sigma 
_refln.pdbx_anom_difference 
_refln.pdbx_anom_difference_sigma 
1 1 1 -29 0  1  o 38.11147 7.211801 21.14548       5.999342 21.14548       5.999342 21.14548       5.999342 38.11147 7.211801 38.11147 7.211801 0.000000       0.000000 
1 1 1 -29 0  2  o 19.34029 8.483497 7.322028       4.173477 7.322028       4.173477 7.322028       4.173477 19.34029 8.483497 19.34029 8.483497 0.000000       0.000000 
1 1 1 -29 0  3  o 17.58777 8.322663 6.235180       4.040980 6.235180       4.040980 6.235180       4.040980 17.58777 8.322663 17.58777 8.322663 -0.000000      0.000000 
1 1 1 -29 0  4  o 36.42099 6.151742 18.53792       4.992288 18.53792       4.992288 18.53792       4.992288 36.42099 6.151742 36.42099 6.151742 0.000000       0.000000 
1 1 1 -29 0  5  o 17.21461 9.438703 6.355031       5.682549 6.355031       5.682549 6.355031       5.682549 17.21461 9.438703 17.21461 9.438703 -0.000000      0.000000 
1 1 1 -29 0  6  o 19.21576 9.560919 7.814860       5.424949 7.814860       5.424949 7.814860       5.424949 19.21576 9.560919 19.21576 9.560919 0.000000       0.000000 
1 1 1 -29 0  7  o 26.56048 7.873158 11.36444       4.432169 11.36444       4.432169 11.36444       4.432169 26.56048 7.873158 26.56048 7.873158 0.000000       0.000000 
1 1 1 -29 0  8  o 17.40129 8.249748 6.033806       3.972199 6.033806       3.972199 6.033806       3.972199 17.40129 8.249748 17.40129 8.249748 -0.000000      0.000000 
1 1 1 -29 0  9  o 70.54914 4.382281 63.52402       7.466678 63.52402       7.466678 63.52402       7.466678 70.54914 4.382281 70.54914 4.382281 0.000000       0.000000 
1 1 1 -29 0  10 o 24.36406 10.08205 11.52513       5.946465 11.52513       5.946465 11.52513       5.946465 24.36406 10.08205 24.36406 10.08205 0.000000       0.000000 
1 1 1 -29 0  11 o 23.27255 8.171156 9.332099       4.199870 9.332099       4.199870 9.332099       4.199870 23.27255 8.171156 23.27255 8.171156 -0.000000      0.000000 
1 1 1 -29 0  12 o 7.142353 5.085144 -4.949478      3.861889 -4.949478      3.861889 -4.949478      3.861889 7.142353 5.085144 7.142353 5.085144 -0.000000      0.000000 
1 1 1 -29 0  13 o 10.98600 7.328008 -0.7013674     5.341125 -0.7013674     5.341125 -0.7013674     5.341125 10.98600 7.328008 10.98600 7.328008 -0.000000      0.000000 
1 1 1 -29 0  14 o 23.79996 9.338444 10.51728       5.186559 10.51728       5.186559 10.51728       5.186559 23.79996 9.338444 23.79996 9.338444 -0.000000      0.000000 
1 1 1 -29 0  15 o 9.816621 6.572434 -0.9085550     4.367412 -0.9085550     4.367412 -0.9085550     4.367412 9.816621 6.572434 9.816621 6.572434 0.000000       0.000000 
1 1 1 -29 0  16 o 25.88129 9.315325 11.94364       5.378462 11.94364       5.378462 11.94364       5.378462 25.88129 9.315325 25.88129 9.315325 -0.000000      0.000000 
1 1 1 -29 0  17 o 8.444213 5.911633 -3.912478      4.548269 -3.912478      4.548269 -3.912478      4.548269 8.444213 5.911633 8.444213 5.911633 -0.000000      0.000000 
1 1 1 -29 0  18 o 12.26604 7.738556 1.704946       4.909758 1.704946       4.909758 1.704946       4.909758 12.26604 7.738556 12.26604 7.738556 -0.000000      0.000000 
1 1 1 -29 1  1  o 19.13307 5.758610 5.270936       2.903778 7.412683       4.140078 3.197167       4.073847 22.02508 6.921675 16.69058 6.655511 5.334503       9.602365 
1 1 1 -29 1  2  o 30.28623 4.456868 12.32994       3.191091 11.29721       4.540008 13.33834       4.486242 27.31326 6.837422 30.20296 6.299527 -2.889698      9.297009 
1 1 1 -29 1  3  o 19.70917 6.087357 5.613559       3.217189 7.009149       4.016209 3.114304       5.374557 21.62076 6.820427 17.75481 7.424271 3.865955       10.08157 
1 1 1 -29 1  4  o 19.73066 6.109158 5.605531       3.237929 2.400012       3.870313 13.08189       5.910743 15.78018 6.418007 28.48061 8.120826 -12.70043      10.35078 
1 1 1 -29 1  5  o 12.73685 5.316827 0.9660584      2.749337 3.867426       3.863549 -2.010404      3.913228 17.47578 6.614441 12.16009 5.620807 5.315683       8.680110 
1 1 1 -29 1  6  o 11.19860 5.113048 -1.329269      3.103753 4.568703       5.144193 -4.705307      3.891971 19.05683 7.517209 10.61900 5.109629 8.437823       9.089375 
1 1 1 -29 1  7  o 17.36059 6.094082 4.033885       3.190594 -0.7451928     5.231053 6.865031       4.026227 14.92316 6.743964 21.57144 6.832010 -6.648273      9.599865 
1 1 1 -29 1  8  o 64.09494 2.965403 51.85226       4.619181 46.94250       5.988094 59.06683       7.258780 60.02232 4.118892 66.97249 4.473302 -6.950172      6.080765 
1 1 1 -29 1  9  o 15.10887 5.925741 2.381728       3.180619 1.995325       3.861268 3.197279       5.609648 15.45016 6.361527 18.22880 7.600870 -2.778642      9.911723 
1 1 1 -29 1  10 o 21.48193 5.548976 6.499367       2.925210 7.366286       4.049119 5.553001       4.230590 22.34582 6.815882 19.85883 7.013457 2.486992       9.779817 
1 1 1 -29 1  11 o 16.13960 5.766662 3.320304       2.867639 2.861732       4.142129 3.742406       3.974001 16.66555 6.688837 17.50913 6.689044 -0.8435841     9.459590 
1 1 1 -29 1  12 o 40.13123 3.781284 20.82563       3.654337 25.02343       5.542937 17.59832       4.860144 42.77882 5.439972 35.52568 5.814972 7.253136       7.962863 
1 1 1 -29 1  13 o 12.95484 5.513108 0.6676936      3.048980 0.4742142E-02  3.701621 2.066552       5.376975 13.37943 5.881045 17.14442 7.309493 -3.764988      9.381651 
1 1 1 -29 1  14 o 31.63447 5.665735 13.93593       4.207294 14.84894       5.660427 12.80884       6.289134 31.23600 7.525846 28.17871 8.473427 3.057287       11.33302 
1 1 1 -29 1  15 f 21.81232 6.225291 6.873063       3.471850 5.993820       4.918997 7.745857       4.900929 20.56324 7.524304 22.65466 7.564320 -2.091419      10.66931 
1 1 1 -29 1  16 o 26.11709 5.942945 9.717784       3.696949 7.122727       5.187463 12.39614       5.270065 21.88201 7.762602 28.44743 7.497715 -6.565416      10.79230 
1 1 1 -29 1  17 f 18.39302 6.704902 4.522777       3.900532 2.680618       6.118932 5.783705       5.062410 18.21881 7.783387 20.34457 7.598793 -2.125755      10.87763 
1 1 1 -29 1  18 f 15.22228 6.085032 2.271488       3.413842 2.838497       4.818755 1.700153       4.837101 17.22377 7.100729 16.24894 6.930428 0.9748287      9.922257 
1 1 1 -29 2  1  o 37.34042 4.326127 18.60161       3.863790 17.66184       4.671475 20.63673       6.874450 35.39179 5.602806 35.81440 8.070666 -0.4226074     9.824821 
1 1 1 -29 2  2  f 29.96333 5.121131 12.41920       3.605085 13.07323       4.465641 11.19530       6.108767 29.85565 6.334333 25.87018 8.436857 3.985470       10.55009 
1 1 1 -29 2  3  o 31.58258 4.818359 13.56236       3.591130 14.69627       4.405822 11.31785       6.198677 32.16228 5.836270 26.06614 8.498580 6.096140       10.30960 
1 1 1 -29 2  4  o 10.11903 4.636982 -1.306819      2.583508 -2.921412      3.529935 0.5557383      3.791317 10.89223 5.133000 13.89011 6.031425 -2.997876      7.919961 
1 1 1 -29 2  5  o 24.28549 5.108356 8.173047       2.927207 8.606372       4.084986 7.715705       4.196663 24.00468 6.719193 22.65338 6.944593 1.351307       9.663070 
1 1 1 -29 2  6  f 33.35485 3.994652 14.57934       3.182435 8.675220       4.311759 21.64464       4.716744 24.00054 6.964912 40.03166 4.939735 -16.03112      8.538793 
1 1 1 -29 2  7  o 19.40177 5.669003 5.318754       2.847820 7.093675       4.017047 3.525371       4.037885 21.89452 6.808753 17.24302 6.701471 4.651495       9.553473 
1 1 1 -29 2  8  o 66.13643 4.890242 58.45473       7.825716 58.17773       10.91991 58.74720       11.22068 62.80103 7.269452 62.80281 7.478414 -0.1781464E-02 10.42936 
1 1 1 -29 2  9  o 36.81758 4.965287 18.29795       4.341422 19.35402       6.059960 17.18441       6.222668 36.13125 7.135847 33.39731 7.789515 2.733940       10.56394 
1 1 1 -29 2  10 o 22.49672 6.067142 7.275528       3.401761 14.62590       4.526182 -2.266210      5.156929 32.18234 5.991791 13.95140 6.450106 18.23094       8.803717 
1 1 1 -29 2  11 o 17.38174 5.752663 4.112010       2.835924 6.858433       4.181499 1.772790       3.859081 21.59917 6.975391 15.23317 6.324113 6.365998       9.415439 
1 1 1 -29 2  12 o 15.52615 5.836671 2.828882       2.996832 7.131732       3.809327 -4.159209      4.854554 22.09125 6.583357 12.52095 5.935983 9.570303       8.864338 
1 1 1 -29 2  13 f 46.81920 5.154046 29.62179       5.783260 8.737432       11.05137 37.49783       6.786716 24.36736 10.43634 52.49665 5.381158 -28.12929      11.74198 
1 1 1 -29 2  14 o 13.22378 5.587742 0.8589267      3.094778 -3.459721      4.820951 3.886059       4.036218 12.81932 6.027943 17.71275 6.747409 -4.893430      9.047853 
1 1 1 -29 2  15 o 21.63396 5.891748 6.682488       3.189350 18.86506       5.601075 0.8372042      3.879758 36.13313 6.604355 14.35678 6.166867 21.77635       9.035915 
1 1 1 -29 2  16 o 10.96445 5.150072 -2.798495      3.502134 4.613044       5.640280 -7.448738      4.467703 19.46122 7.807221 10.47244 5.135904 8.988780       9.345064 
1 1 1 -29 2  17 o 21.89230 6.514252 7.008790       3.731975 6.399496       5.374865 7.575979       5.185830 21.09046 7.839075 22.38601 7.775252 -1.295547      11.04109 
1 1 1 -29 2  18 o 13.03128 5.745182 -0.1008341     3.557202 4.481972       5.128193 -4.350796      4.938456 19.01372 7.503864 12.52856 5.953311 6.485151       9.578616 
1 1 1 -29 3  1  o 15.02979 6.027786 2.314748       3.361215 1.706561       5.404710 2.698330       4.292230 16.53859 7.191194 16.34867 6.716736 0.1899261      9.840113 
1 1 1 -29 3  2  f 61.05590 3.493395 48.00061       5.176009 34.17920       7.008631 64.58336       7.676890 49.02618 5.990656 69.57697 4.552773 -20.55079      7.524341 
1 1 1 -29 3  3  o 12.31497 5.206739 0.7260968      2.689687 5.170704       3.628162 -4.696966      4.007674 19.00574 6.507687 10.77698 5.185486 8.228760       8.321013 
1 1 1 -29 3  4  o 10.30658 4.680048 -1.014291      2.555731 -4.913424      3.387474 4.137860       3.893912 9.543363 4.634031 17.77275 6.659034 -8.229388      8.112766 
1 1 1 -29 3  5  o 16.84962 5.630496 3.864939       2.715305 6.292208       3.701400 1.036645       3.995482 20.72262 6.549038 14.61181 6.266973 6.110806       9.064483 
1 1 1 -29 3  6  o 14.90733 5.564877 2.629053       2.714306 3.679070       3.610721 1.264650       4.115921 17.08465 6.410008 14.99258 6.393708 2.092071       9.053602 
1 1 1 -29 3  7  o 37.57916 4.824559 19.00039       4.316351 22.43745       4.724990 1.668427       10.61039 40.85985 4.839177 20.60933 9.426440 20.25052       10.59601 
1 1 1 -29 3  8  o 29.46515 4.498672 11.60470       3.127965 7.750837       4.217768 16.31487       4.662866 22.78005 6.957955 34.11063 5.818088 -11.33057      9.069911 
1 1 1 -29 3  9  o 31.66426 5.863808 14.11196       4.358060 10.67383       6.751930 16.56720       5.705767 25.51899 8.871461 33.24180 7.248362 -7.722811      11.45607 
1 1 1 -29 3  10 o 27.41311 4.599622 10.09575       2.963946 13.68225       4.285687 6.807624       4.103549 31.18914 5.853664 21.51792 6.906486 9.671217       9.053448 
1 1 1 -29 3  11 o 26.19183 5.440269 9.551518       3.358715 10.45418       4.324457 8.179152       5.332169 26.65094 6.673992 23.12140 7.889946 3.529535       10.33409 
1 1 1 -29 3  12 o 22.87065 5.960281 7.485867       3.354974 10.07243       5.279133 5.733429       4.345328 25.46218 7.785721 20.11021 7.107412 5.351973       10.54195 
1 1 1 -29 3  13 o 14.44846 5.857033 1.805828       3.210942 -1.401828      5.000260 4.056738       4.188686 14.24716 6.499159 18.00897 6.870431 -3.761817      9.457373 
1 1 1 -29 3  14 o 58.53561 4.250629 44.81178       6.021993 0.000000       0.000000 44.81178       6.021993 ?        ?        58.53561 4.250629 0.000000       4.250629 
1 1 1 -29 3  15 o 13.32379 5.790775 0.3199405      3.501394 -5.288587      5.834084 3.477396       4.377407 13.38498 6.391088 17.49100 6.923444 -4.106017      9.422318 
1 1 1 -29 3  16 o 14.61544 6.050458 1.609827       3.518380 -1.591249      5.004528 4.738294       4.947444 14.11992 6.464136 19.17990 7.427950 -5.059987      9.846802 
1 1 1 -29 3  17 o 39.51032 4.462399 20.68099       4.221409 19.44142       6.059189 21.85016       5.884588 36.19356 7.123605 39.07963 6.400535 -2.886070      9.576669 
1 1 1 -29 4  1  o 25.07266 5.334126 8.890021       3.158862 9.361092       4.347136 8.363007       4.598027 24.63265 6.944443 23.08381 7.299799 1.548849       10.07533 
1 1 1 -29 4  2  o 8.827314 4.214080 -2.864642      2.533911 -2.487254      3.371255 -3.354686      3.841625 10.81926 5.072664 11.15405 5.285771 -0.3347864     7.326069 
1 1 1 -29 4  3  o 17.57100 6.163863 4.248781       3.263720 -0.8340837     4.597303 9.413361       4.634111 13.90051 6.298043 24.62232 7.241807 -10.72181      9.597349 
1 1 1 -29 4  4  o 18.99583 5.671100 5.134592       2.824781 -0.5298554     3.721190 12.83736       4.339369 12.86195 5.760513 29.76726 6.184340 -16.90530      8.451602 
1 1 1 -29 4  5  o 11.03622 4.870297 -0.2632301     2.562126 -1.214963      3.390510 1.003764       3.911963 11.79398 5.369119 14.45949 6.201376 -2.665512      8.202713 
1 1 1 -29 4  6  o 15.65290 5.621204 3.116806       2.728488 4.007728       3.611303 1.931749       4.164987 17.49654 6.439585 15.65348 6.539901 1.843059       9.178157 
1 1 1 -29 4  7  o 13.60939 5.428622 1.703188       2.711197 2.915182       3.800933 0.4477979      3.868381 16.32628 6.454921 13.95003 6.074528 2.376250       8.863741 
1 1 1 -29 4  8  o 15.45060 5.975244 2.658751       3.198146 3.762977       4.119525 0.9836392      5.073876 17.57201 6.785346 15.91994 6.944237 1.652067       9.708931 
1 1 1 -29 4  9  o 16.49978 5.956787 3.491627       3.068756 3.335685       3.855191 3.761321       5.069906 16.89234 6.552849 18.27611 7.377327 -1.383768      9.867360 
1 1 1 -29 4  10 o 24.89886 6.436249 9.063774       3.933553 12.57178       5.861469 6.189440       5.305726 28.13715 8.107302 20.84900 7.780846 7.288147       11.23699 
1 1 1 -29 4  11 o 13.22948 5.341405 1.450414       2.658403 0.2226095      3.572541 2.973785       3.979380 13.34593 5.824117 16.60551 6.592145 -3.259580      8.796404 
1 1 1 -29 4  12 o 78.33907 3.506881 78.43976       6.677795 84.70111       11.14181 74.92973       8.342132 78.19242 5.890608 75.35739 4.564108 2.835030       7.451869 
1 1 1 -29 4  13 o 35.24924 4.693651 16.62652       3.931669 15.34134       6.865657 17.25362       4.795918 30.54882 8.765690 35.13264 5.804271 -4.583820      10.51318 
1 1 1 -29 4  14 o 29.37018 5.143948 11.81488       3.547534 7.243765       5.641332 14.80493       4.562574 22.03872 8.058856 32.34389 6.009878 -10.30517      10.05305 
1 1 1 -29 4  15 o 24.06445 6.214281 8.390646       3.669420 3.314154       5.521897 12.40512       4.910441 18.23003 7.566280 28.77316 7.057642 -10.54313      10.34693 
1 1 1 -29 4  16 o 37.72280 4.629407 18.98277       4.166527 13.64601       6.347605 23.02277       5.522831 29.00909 8.460065 40.71181 5.724706 -11.70272      10.21494 
1 1 1 -29 4  17 o 12.28210 5.528488 -0.8378173     3.475413 -0.6770028     4.970762 -0.9916098     4.861027 14.64039 6.598954 14.28928 6.474977 0.3511086      9.245080 
1 1 1 -29 5  1  o 16.44148 5.848549 3.634205       2.946485 1.060377       3.689569 8.165689       4.895602 14.09065 6.032423 22.68174 7.559914 -8.591091      9.671734 
1 1 1 -29 5  2  o 51.06543 3.244126 33.39042       4.016148 27.18916       4.946279 45.38900       6.880236 45.00191 4.573843 57.81156 4.930758 -12.80965      6.725505 
1 1 1 -29 5  3  o 16.76929 5.657883 3.857372       2.741284 0.4573405      3.485188 9.373466       4.439158 13.29800 5.778484 24.68096 7.037766 -11.38296      9.106099 
1 1 1 -29 5  4  o 14.79932 5.816197 2.329634       3.069479 2.416962       4.490098 2.253020       4.205647 16.35998 6.809222 15.92407 6.605677 0.4359083      9.486858 
1 1 1 -29 5  5  o 10.30666 4.742651 -1.488497      2.741400 -0.7844868     3.686592 -2.359316      4.100149 12.61741 5.685420 12.21829 5.684057 0.3991184      8.039434 
1 1 1 -29 5  6  o 9.369425 4.427513 -2.527871      2.659531 -3.760359      3.703996 -1.216271      3.821023 10.74069 5.118458 12.53498 5.703867 -1.794282      7.663727 
1 1 1 -29 5  7  o 10.71080 4.875091 -1.151297      2.793620 -3.060699      3.399411 2.820678       4.902959 10.57733 5.000504 17.20526 7.134298 -6.627934      8.712248 
1 1 1 -29 5  8  o 9.975162 4.674373 -2.295671      2.856066 -5.703502      3.468998 4.874636       5.031922 9.363614 4.578117 19.29452 7.485945 -9.930902      8.774880 
1 1 1 -29 5  9  o 12.05702 5.240337 0.1367674      2.867525 3.587801       3.550674 -6.335175      4.862432 16.94799 6.356955 11.52141 5.584537 5.426577       8.461556 
1 1 1 -29 5  10 o 13.21981 5.360873 1.415500       2.691073 -0.6769747     3.610352 4.031424       4.036751 12.63481 5.665257 17.83494 6.758637 -5.200129      8.818974 
1 1 1 -29 5  11 o 18.20647 6.634218 4.423790       3.818173 2.882573       10.23370 4.673026       4.115334 20.98924 9.463838 18.66262 6.873347 2.326624       11.69646 
1 1 1 -29 5  12 o 16.57928 6.188492 3.401874       3.356599 7.253735       5.999334 1.646666       4.049786 22.07226 8.266428 15.30381 6.425014 6.768448       10.46970 
1 1 1 -29 5  13 f 32.60427 5.465383 14.70679       4.188880 15.70619       5.990894 13.75084       5.859242 31.83122 7.788142 29.56518 7.957856 2.266043       11.13475 
1 1 1 -29 5  14 o 10.22699 4.796705 -2.447018      3.019066 -3.784982      4.806419 -1.575116      3.880014 12.60410 5.954856 12.42766 5.690291 0.1764431      8.236487 
1 1 1 -29 5  15 o 17.98753 6.140303 4.441003       3.229555 7.485190       5.541439 2.875183       3.974274 22.25746 8.008639 16.47200 6.571905 5.785458       10.35993 
1 1 1 -29 5  16 o 13.33751 5.735478 0.5818361      3.363071 -4.491949      5.045096 4.639444       4.511682 12.61238 6.000013 18.81497 7.141667 -6.202594      9.327571 
1 1 1 -29 6  1  o 13.16843 5.457121 1.276165       2.866291 -0.3324304     3.789389 3.427199       4.381970 13.02967 5.825987 17.11276 6.875809 -4.083090      9.012152 
1 1 1 -29 6  2  o 15.15834 5.805148 2.704281       2.997966 -1.606637      3.743954 10.40812       5.004945 12.04733 5.543192 25.55458 7.528644 -13.50725      9.349195 
1 1 1 -29 6  3  o 29.09323 5.150300 11.74926       3.517807 7.361028       4.380867 19.71522       5.902478 21.90235 7.144822 36.23827 6.936483 -14.33592      9.958076 
1 1 1 -29 6  4  o 35.65831 4.127553 16.80532       3.520501 17.37757       4.829433 16.15638       5.142811 34.95764 5.877487 33.06538 6.613688 1.892258       8.847921 
1 1 1 -29 6  5  o 16.40557 6.016773 3.462514       3.148160 7.510514       4.775787 0.3518189      4.186523 22.10525 7.467905 14.23573 6.256020 7.869515       9.742043 
1 1 1 -29 6  6  o 15.27260 5.804646 2.731716       2.982885 5.797250       3.661802 -3.314560      5.142636 19.95964 6.533519 13.25831 6.231687 6.701330       9.028886 
1 1 1 -29 6  7  o 27.49275 5.270597 10.49856       3.402672 11.88946       4.322478 8.232162       5.517614 28.52953 6.377750 22.94116 8.016837 5.588371       10.24428 
1 1 1 -29 6  8  o 29.21759 4.459642 11.42822       3.074815 13.67446       4.249206 8.959154       4.454978 31.10124 5.820411 24.27743 7.089547 6.823814       9.172725 
1 1 1 -29 6  9  o 16.87926 5.656632 3.865809       2.740320 1.689115       3.682366 6.567347       4.102360 14.86203 6.174476 21.09113 6.916053 -6.229095      9.271243 
1 1 1 -29 6  10 o 11.92448 5.310734 -0.4803139     3.116251 0.6361056      4.841290 -1.270110      4.071972 15.37192 6.742260 12.92964 5.885296 2.442280       8.949569 
1 1 1 -29 6  11 o 15.41016 6.418338 1.847947       3.993380 0.000000       0.000000 1.847947       3.993380 ?        ?        15.41016 6.418338 0.000000       6.418338 
1 1 1 -29 6  12 o 18.47151 6.603072 4.658156       3.760293 -2.029946      9.867188 5.794501       4.067215 18.66381 8.727222 20.07053 6.889639 -1.406721      11.11897 
1 1 1 -29 6  13 o 26.22549 5.657355 9.700481       3.509203 7.588679       5.556494 11.10165       4.526045 22.34641 8.022136 27.30970 6.821424 -4.963299      10.53027 
1 1 1 -29 6  14 o 15.56030 6.044871 2.677875       3.284296 1.759190       5.166694 3.300795       4.254471 16.61242 7.125819 17.16428 6.815475 -0.5518646     9.860425 
1 1 1 -29 6  15 f 22.15686 6.812418 7.283243       4.034728 8.390765       5.668562 6.145998       5.744123 23.22788 8.125148 20.88768 8.026288 2.340197       11.42100 
1 1 1 -29 7  2  o 19.73230 6.236782 5.719433       3.356764 4.319339       4.012143 8.986085       6.128431 17.90490 6.748533 23.30531 8.417374 -5.400408      10.78865 
1 1 1 -29 7  3  f 24.47558 5.369411 8.479416       3.114314 6.337329       3.992618 11.80781       4.976873 20.56541 6.826434 27.48250 7.306202 -6.917093      9.999040 
1 1 1 -29 7  4  o 21.46166 6.197619 6.784135       3.421784 9.509218       3.957468 -1.287558      6.810983 25.29036 6.413164 16.16095 7.450593 9.129417       9.830565 
1 1 1 -29 7  5  o 18.91873 6.103465 5.133021       3.201985 5.731797       3.918731 3.930167       5.554183 19.80910 6.763767 18.53629 7.630692 1.272808       10.19686 
1 1 1 -29 7  6  o 12.41784 5.419217 0.1532734      3.093213 -2.582890      4.628856 2.360961       4.157876 12.89687 6.013030 15.99790 6.595654 -3.101032      8.925200 
1 1 1 -29 7  7  o 15.00991 5.582624 2.714804       2.726768 1.041178       3.631865 4.877004       4.128082 14.10829 6.010952 18.80022 6.890690 -4.691933      9.144022 
1 1 1 -29 7  8  o 10.92428 4.865420 -0.4911735     2.615744 -0.3359962     3.603476 -0.6640132     3.803026 12.85435 5.718706 12.91332 5.800353 -0.5896759E-01 8.145409 
1 1 1 -29 7  9  o 15.98865 5.666784 3.318875       2.763937 1.577217       3.691343 5.541339       4.169848 14.74129 6.157664 19.69446 6.962243 -4.953171      9.294603 
1 1 1 -29 7  10 o 11.22902 5.157434 -1.571329      3.220951 -5.162719      5.441177 0.3660244      3.996373 12.84527 6.143931 14.04693 6.144327 -1.201653      8.689111 
1 1 1 -29 7  11 o 8.997939 4.354408 -4.145107      2.926152 -8.443137      4.573073 -1.165396      3.807680 10.26496 5.065564 12.57098 5.709919 -2.306012      7.633028 
1 1 1 -29 7  12 o 12.42465 5.630396 -1.072367      3.676298 6.256484       10.01188 -2.214523      3.952394 22.46445 9.777441 12.10524 5.614058 10.35921       11.27457 
1 1 1 -29 7  13 o 10.53027 4.913248 -2.226654      3.099645 4.530918       5.147374 -6.071200      3.882513 19.01543 7.513722 9.982076 4.872455 9.033355       8.955269 
1 1 1 -29 7  14 o 29.17036 6.160090 12.23044       4.241333 8.953984       5.848374 15.86543       6.160058 23.79652 8.257468 31.75440 7.973096 -7.957876      11.47850 
1 1 1 -29 8  4  o 25.09142 5.291276 8.857838       3.133327 9.010487       4.053853 8.631315       4.938288 24.43512 6.637371 23.35664 7.583404 1.078478       10.07783 
1 1 1 -29 8  5  o 11.36755 5.069041 -0.4724879     2.848273 -2.285668      3.587576 2.619059       4.684556 11.35879 5.295167 16.69341 6.952125 -5.334624      8.739040 
1 1 1 -29 8  6  o 10.58441 4.802783 -0.9974649     2.685669 -4.606227      3.416109 4.842669       4.345742 9.735478 4.709768 18.79083 7.035950 -9.055350      8.466788 
1 1 1 -29 8  7  o 15.36212 5.932545 2.690745       3.149299 -1.345459      4.827859 5.680366       4.155048 13.91543 6.362403 19.79850 6.954058 -5.883079      9.425449 
1 1 1 -29 8  8  f 14.03825 5.490853 2.038364       2.724671 2.561037       3.725818 1.437511       3.994759 15.79223 6.341911 14.94994 6.334238 0.8422871      8.963392 
1 1 1 -29 8  9  o 17.59728 6.378351 4.139322       3.522932 -1.225941      5.765026 7.336934       4.450600 15.19429 6.949177 22.01447 7.202734 -6.820184      10.00852 
1 1 1 -29 8  10 o 17.38715 6.184427 4.059265       3.294568 -0.4854158     5.126286 7.257318       4.300252 14.89306 6.708128 21.96206 7.072078 -7.068995      9.747476 
1 1 1 -29 8  11 o 13.91562 5.743172 1.460879       3.156941 3.712911       5.260092 0.1929991      3.946801 18.27697 7.463805 13.82549 6.075051 4.451477       9.623650 
1 1 1 -29 8  12 o 14.33980 5.835479 1.774062       3.201762 3.131883       5.138680 0.9124319      4.093460 17.68003 7.314965 14.64281 6.312552 3.037214       9.662144 
1 1 1 -29 8  13 f 16.14275 6.831243 1.893826       4.636748 4.197576       9.681047 1.208046       5.281987 21.23148 9.413501 16.27658 7.092743 4.954899       11.78648 
1 1 1 -29 9  8  o 15.27043 5.964139 2.569863       3.210794 0.3960552      4.941007 4.158750       4.224266 15.22642 6.739356 17.97197 6.888830 -2.745546      9.637162 
1 1 1 -29 9  9  o 18.67281 6.288387 4.935186       3.386319 5.802327       5.276731 4.328006       4.415493 20.24319 7.714072 18.29243 7.035004 1.950762       10.44022 
1 1 1 -28 0  1  o 37.24398 5.503362 18.77641       4.675079 18.77641       4.675079 18.77641       4.675079 37.24398 5.503362 37.24398 5.503362 0.000000       0.000000 
1 1 1 -28 0  2  o 47.12440 4.536310 28.72160       5.091322 28.72160       5.091322 28.72160       5.091322 47.12440 4.536310 47.12440 4.536310 -0.000000      0.000000 
1 1 1 -28 0  3  o 63.43664 3.961113 50.86480       6.068055 50.86480       6.068055 50.86480       6.068055 63.43664 3.961113 63.43664 3.961113 -0.000000      0.000000 
1 1 1 -28 0  4  o 9.479640 6.189735 -0.2804510E-01 3.502756 -0.2804510E-01 3.502756 -0.2804510E-01 3.502756 9.479640 6.189735 9.479640 6.189735 -0.000000      0.000000 
1 1 1 -28 0  5  o 101.4323 4.262350 129.5855       10.49325 129.5855       10.49325 129.5855       10.49325 101.4323 4.262350 101.4323 4.262350 -0.000000      0.000000 
1 1 1 -28 0  6  o 50.77950 4.424837 33.04292       5.375749 33.04292       5.375749 33.04292       5.375749 50.77950 4.424837 50.77950 4.424837 -0.000000      0.000000 
1 1 1 -28 0  7  o 10.78577 6.998057 0.2985454      4.378507 0.2985454      4.378507 0.2985454      4.378507 10.78577 6.998057 10.78577 6.998057 -0.000000      0.000000 
1 1 1 -28 0  8  o 21.80508 9.301238 9.007665       5.031389 9.007665       5.031389 9.007665       5.031389 21.80508 9.301238 21.80508 9.301238 -0.000000      0.000000 
1 1 1 -28 0  9  o 16.55311 10.58819 3.257218       9.569919 3.257218       9.569919 3.257218       9.569919 16.55311 10.58819 16.55311 10.58819 -0.000000      0.000000 
1 1 1 -28 0  10 o 27.64028 7.015345 11.43099       4.085331 11.43099       4.085331 11.43099       4.085331 27.64028 7.015345 27.64028 7.015345 -0.000000      0.000000 
1 1 1 -28 0  11 o 13.60690 7.469269 3.512425       3.562987 3.512425       3.562987 3.512425       3.562987 13.60690 7.469269 13.60690 7.469269 0.000000       0.000000 
1 1 1 -28 0  12 o 75.66499 4.195467 72.19239       7.681140 72.19239       7.681140 72.19239       7.681140 75.66499 4.195467 75.66499 4.195467 -0.000000      0.000000 
1 1 1 -28 0  13 f 20.76907 9.743049 8.627741       5.527897 8.627741       5.527897 8.627741       5.527897 20.76907 9.743049 20.76907 9.743049 -0.000000      0.000000 
1 1 1 -28 0  14 o 35.95111 8.352316 19.32976       6.364073 19.32976       6.364073 19.32976       6.364073 35.95111 8.352316 35.95111 8.352316 -0.000000      0.000000 
1 1 1 -28 0  15 o 20.02365 10.32899 8.444499       6.460144 8.444499       6.460144 8.444499       6.460144 20.02365 10.32899 20.02365 10.32899 0.000000       0.000000 
1 1 1 -28 0  16 o 12.83246 8.040204 1.912626       5.201538 1.912626       5.201538 1.912626       5.201538 12.83246 8.040204 12.83246 8.040204 -0.000000      0.000000 
1 1 1 -28 0  17 o 9.830564 6.710818 -2.288888      5.008539 -2.288888      5.008539 -2.288888      5.008539 9.830564 6.710818 9.830564 6.710818 0.000000       0.000000 
1 1 1 -28 0  18 o 50.52654 5.579110 33.73155       6.655948 33.73155       6.655948 33.73155       6.655948 50.52654 5.579110 50.52654 5.579110 0.000000       0.000000 
1 1 1 -28 0  19 o 59.79454 5.296569 46.58434       7.572118 46.58434       7.572118 46.58434       7.572118 59.79454 5.296569 59.79454 5.296569 0.000000       0.000000 
1 1 1 -28 0  20 o 19.41403 9.719891 7.880923       5.623526 7.880923       5.623526 7.880923       5.623526 19.41403 9.719891 19.41403 9.719891 0.000000       0.000000 
1 1 1 -28 0  21 o 45.97110 6.102073 28.62870       6.500093 28.62870       6.500093 28.62870       6.500093 45.97110 6.102073 45.97110 6.102073 0.000000       0.000000 
1 1 1 -28 0  22 o 10.11055 6.887146 -2.066182      5.215110 -2.066182      5.215110 -2.066182      5.215110 10.11055 6.887146 10.11055 6.887146 0.000000       0.000000 
1 1 1 -28 0  23 f 13.76803 9.287794 -1.047962      9.031603 -1.047962      9.031603 -1.047962      9.031603 13.76803 9.287794 13.76803 9.287794 -0.000000      0.000000 
1 1 1 -28 0  24 o 16.63127 9.196602 5.800222       5.445362 5.800222       5.445362 5.800222       5.445362 16.63127 9.196602 16.63127 9.196602 -0.000000      0.000000 
1 1 1 -28 1  1  o 11.40386 5.085046 -0.6008038     2.866017 -3.146731      4.519828 1.111251       3.706446 12.56916 5.886831 14.43458 6.107965 -1.865417      8.483043 
1 1 1 -28 1  2  o 58.05987 2.930631 42.39182       4.133010 45.31735       5.849456 39.47527       5.840473 59.18654 4.080588 54.96825 4.396765 4.218292       5.998562 
1 1 1 -28 1  3  o 35.27083 3.833478 16.05834       3.241981 12.23285       4.509513 20.15060       4.664102 29.24906 6.495849 38.80427 5.052175 -9.555210      8.229248 
1 1 1 -28 1  4  o 20.45683 5.396055 5.777563       2.728252 3.660764       3.790853 8.052088       3.929547 17.46744 6.564926 23.67026 6.577076 -6.202814      9.292803 
1 1 1 -28 1  5  o 66.67535 3.146066 55.97329       5.097329 53.98397       8.214938 57.21871       6.499951 63.58178 5.351576 66.74576 4.014788 -3.163975      6.690134 
1 1 1 -28 1  6  o 62.66169 2.988060 49.26440       4.549613 47.03495       5.973775 52.34357       7.020464 60.47947 4.077087 63.39012 4.575520 -2.910652      6.128460 
1 1 1 -28 1  7  o 20.47354 5.822619 5.808492       3.042540 6.084168       3.867371 5.360742       4.928711 20.86184 6.705649 20.28101 7.512577 0.5808353      10.06998 
1 1 1 -28 1  8  o 17.09436 6.343688 3.476835       3.517221 6.740121       4.668027 -0.8088509     5.349535 21.86200 7.383178 15.37067 6.893711 6.491334       10.10122 
1 1 1 -28 1  9  o 15.01341 5.702353 2.413167       2.877510 2.083976       4.610272 2.623250       3.682962 16.69542 6.920053 16.20620 6.370405 0.4892178      9.405806 
1 1 1 -28 1  10 o 36.16370 4.902913 17.30260       4.209601 1.355040       10.63541 20.26517       4.583962 21.48914 9.672142 39.17187 4.909642 -17.68273      10.84689 
1 1 1 -28 1  11 o 99.98846 2.954409 125.0610       7.190846 129.4226       10.23782 120.8140       10.10232 100.4106 4.193230 96.89526 4.289037 3.515366       5.998250 
1 1 1 -28 1  12 o 30.45945 4.690372 12.26048       3.369932 7.362702       5.564246 15.09767       4.234974 22.77756 8.043394 33.48391 5.371717 -10.70635      9.672204 
1 1 1 -28 1  13 f 13.87944 5.732693 1.219961       3.148722 2.669619       5.349465 0.4514695      3.894906 17.98205 7.453852 14.26118 6.152855 3.720866       9.665275 
1 1 1 -28 1  14 o 33.24480 5.869100 15.17311       4.581002 20.34728       7.608064 12.23024       5.737712 36.34569 8.704743 28.50929 7.957138 7.836403       11.79358 
1 1 1 -28 1  15 o 24.71437 6.551172 8.720618       4.008761 12.02074       5.752687 5.605261       5.589330 28.20238 8.001593 20.85045 7.940766 7.351927       11.27303 
1 1 1 -28 1  16 o 41.37449 4.829862 22.61030       4.778220 19.88432       6.118325 26.87243       7.650411 37.26731 6.993838 42.91293 7.593578 -5.645611      10.32358 
1 1 1 -28 1  17 o 79.96234 3.341167 80.82763       6.496236 81.99494       9.250448 79.69177       9.124969 79.01128 4.827424 77.88584 4.831482 1.125443       6.829878 
1 1 1 -28 1  18 o 46.18319 4.155298 27.65508       4.626564 20.26261       6.390735 35.79632       6.706585 37.23595 7.303970 51.54892 5.419806 -14.31297      9.095180 
1 1 1 -28 1  19 o 26.46555 6.355794 10.02546       4.047392 13.88734       5.770345 6.285528       5.678513 30.23042 7.785729 21.35569 8.033031 8.874731       11.18692 
1 1 1 -28 1  20 o 16.23244 6.317317 2.866759       3.592046 5.117175       5.160803 0.7520944      5.002726 19.88349 7.616097 15.83583 6.901659 4.047657       10.27803 
1 1 1 -28 1  21 o 12.08786 5.475661 -1.159238      3.472976 3.296999       5.044183 -5.175700      4.788820 17.97441 7.320777 11.97952 5.738959 5.994888       9.302120 
1 1 1 -28 1  22 o 48.43853 5.020027 31.46377       5.839808 37.11127       6.920503 17.49724       10.88314 52.14568 5.530281 30.20085 11.16778 21.94483       12.46208 
1 1 1 -28 1  23 o 28.30228 7.245540 12.09173       5.018011 6.013664       10.12477 14.07088       5.777517 22.60756 9.836159 30.12911 7.806415 -7.521553      12.55747 
1 1 1 -28 1  24 o 80.51577 3.361097 82.57316       6.580244 76.89406       9.375759 88.08603       9.237521 75.56712 5.121665 81.54867 4.667889 -5.981544      6.929692 
1 1 1 -28 2  1  o 34.97301 3.914702 15.88777       3.279144 15.45805       4.619685 16.32415       4.655340 33.24592 5.919152 34.28386 5.777361 -1.037937      8.271292 
1 1 1 -28 2  2  f 18.10215 6.164783 4.421583       3.255035 2.852301       5.052967 5.534705       4.255662 17.62214 7.268732 19.98299 7.036210 -2.360853      10.11646 
1 1 1 -28 2  3  o 42.48979 3.809525 23.22741       3.902678 13.80267       6.131191 29.64706       5.060179 29.86080 8.183951 47.62831 4.409849 -17.76751      9.296442 
1 1 1 -28 2  4  o 15.66273 5.879455 2.804044       3.038549 2.845109       3.824921 2.733796       5.002682 16.51472 6.491915 17.57158 7.238616 -1.056860      9.723297 
1 1 1 -28 2  5  o 61.95438 3.366296 48.58065       5.063209 41.44538       5.768212 72.53504       10.56887 56.61630 4.210994 72.92667 6.000140 -16.31036      7.330359 
1 1 1 -28 2  6  o 65.47664 3.314140 54.14639       5.270827 60.03373       7.045310 46.66245       7.943385 68.18040 4.261689 58.88400 5.603148 9.296402       7.039692 
1 1 1 -28 2  7  o 83.56047 2.773166 87.16660       5.639113 81.29082       7.344817 95.60339       8.801099 79.87086 3.784369 86.19453 4.202736 -6.323677      5.655479 
1 1 1 -28 2  8  o 10.36701 4.671211 -0.9350201     2.488347 -2.615999      3.429589 0.9335631      3.615906 11.06891 5.165748 14.28431 6.038088 -3.215403      7.946286 
1 1 1 -28 2  9  o 94.62576 3.437515 113.0900       7.913485 127.6330       14.07502 106.3678       9.569174 97.16408 5.973263 90.82649 4.335925 6.337585       7.381064 
1 1 1 -28 2  10 o 26.08215 5.168567 9.195823       3.168946 3.161205       4.625247 14.53479       4.350494 17.74912 7.086969 32.66552 5.670876 -14.91640      9.076561 
1 1 1 -28 2  11 o 20.08631 5.805847 5.566067       3.001558 4.262477       4.886719 6.355843       3.803634 19.10043 7.386275 21.28394 6.626459 -2.183506      9.923056 
1 1 1 -28 2  12 o 70.27136 3.214078 62.14210       5.489332 70.47206       10.40090 58.92598       6.462717 72.13490 5.970257 67.90051 3.922459 4.234390       7.143505 
1 1 1 -28 2  13 o 14.28505 5.781096 1.608054       3.122252 -2.098014      5.913632 3.040438       3.676439 15.32765 7.020689 16.68275 6.418439 -1.355102      9.512437 
1 1 1 -28 2  14 o 21.40135 6.662116 6.458792       3.844819 8.916212       5.588031 4.249577       5.298319 24.50086 8.073743 19.34787 7.629925 5.152992       11.10860 
1 1 1 -28 2  15 o 13.14682 5.791385 -0.2686376     3.607730 2.178209       5.357952 -2.298182      4.879717 17.52689 7.376197 13.74480 6.325736 3.782089       9.717160 
1 1 1 -28 2  16 o 17.67972 6.766292 3.620943       4.071093 1.595588       5.263425 6.636961       6.422954 16.93003 7.225405 22.15702 8.494113 -5.226999      11.15152 
1 1 1 -28 2  17 o 17.30411 6.743755 3.302371       4.097876 7.499618       5.292648 -2.979763      6.475069 22.70775 7.856622 15.47443 7.179733 7.233318       10.64308 
1 1 1 -28 2  18 o 56.38480 3.849215 40.81096       5.257242 36.03600       7.304931 45.94143       7.571983 51.20542 5.965760 58.47493 5.373829 -7.269512      8.029218 
1 1 1 -28 2  19 o 13.45700 5.846917 0.2462627      3.567390 0.9067150      5.144042 -0.3656893     4.951565 16.14520 7.017935 14.98542 6.682854 1.159776       9.690818 
1 1 1 -28 2  20 o 65.26633 3.531825 54.30821       5.596333 50.82213       8.066840 57.54271       7.770305 61.29337 5.457769 65.89557 4.873378 -4.602200      7.316902 
1 1 1 -28 2  21 o 57.58391 3.656912 42.48762       5.105077 40.78063       7.172297 44.24046       7.267992 54.82668 5.439881 57.30131 5.263679 -2.474628      7.569585 
1 1 1 -28 2  22 o 39.56169 5.818843 21.72121       5.442357 20.08614       6.329367 26.35933       10.66014 36.76315 7.322338 37.80372 10.94575 -1.040573      13.16913 
1 1 1 -28 2  23 o 22.57992 6.620960 7.486710       3.878612 2.258868       5.592613 12.33131       5.383719 17.47266 7.452189 28.27894 7.635233 -10.80627      10.66920 
1 1 1 -28 2  24 o 18.13781 7.060036 4.028224       4.486920 11.59821       9.448120 1.823792       5.098545 25.86171 10.19186 16.61571 7.101840 9.245996       12.42217 
1 1 1 -28 3  1  o 21.15623 5.775935 6.329729       3.060774 3.269631       3.871160 11.43303       4.999185 16.91258 6.564829 27.53019 7.324247 -10.61760      9.835730 
1 1 1 -28 3  2  o 12.96411 5.292163 1.215860       2.643244 -1.078488      3.487030 4.314858       4.052627 12.18654 5.506806 18.34766 6.809304 -6.161117      8.757370 
1 1 1 -28 3  3  o 18.80572 5.996639 4.880823       3.097403 2.428709       3.838496 9.457607       5.244100 16.01529 6.435153 24.97908 7.781277 -8.963791      10.09750 
1 1 1 -28 3  4  o 9.141835 4.453619 -5.152794      3.199268 -8.223831      4.683628 -2.466451      4.380468 10.63083 5.222664 12.80864 5.929825 -2.177811      7.901838 
1 1 1 -28 3  5  o 54.56871 3.083152 37.49974       4.083236 39.60595       5.965891 35.64360       5.600543 55.11290 4.480697 52.30250 4.435919 2.810402       6.305079 
1 1 1 -28 3  6  o 24.97084 5.018292 8.432647       2.947640 12.68167       4.137580 4.053804       4.200314 30.31349 5.812545 18.28860 6.902373 12.02489       9.023770 
1 1 1 -28 3  7  o 15.53282 5.429208 3.001418       2.530653 1.156996       3.468369 5.101200       3.700686 14.27052 5.965469 19.39541 6.573695 -5.124887      8.876952 
1 1 1 -28 3  8  o 12.72479 5.188868 1.103193       2.537737 2.671158       3.448603 -0.7486924     3.747849 15.98014 6.198038 12.99967 5.804561 2.980468       8.491678 
1 1 1 -28 3  9  o 32.34148 3.958490 13.51537       3.054831 14.61349       4.338519 12.43562       4.302079 32.75224 5.639245 29.88933 6.112813 2.862902       8.316704 
1 1 1 -28 3  10 o 73.57034 3.021729 67.86806       5.405914 68.36102       7.522536 67.34161       7.773893 72.83662 4.256722 72.11347 4.445311 0.7231522      6.154711 
1 1 1 -28 3  11 o 97.13779 3.659260 119.7545       8.646502 0.000000       0.000000 119.7545       8.646502 ?        ?        97.13779 3.659260 0.000000       3.659260 
1 1 1 -28 3  12 o 48.31084 3.743087 29.79525       4.372318 22.32547       8.253325 32.70954       5.155156 37.78367 9.077428 50.31017 4.244397 -12.52650      10.02071 
1 1 1 -28 3  13 o 15.10207 5.794570 2.393903       2.990870 4.820562       5.182181 1.181867       3.662401 19.83969 7.623584 14.59128 6.116902 5.248416       9.774227 
1 1 1 -28 3  14 o 25.22432 6.322375 9.009693       3.878294 11.24234       5.604866 6.958700       5.372015 27.30783 7.945652 22.20430 7.897196 5.103527       11.20264 
1 1 1 -28 3  15 o 18.67249 6.559006 4.594706       3.696414 7.386122       5.392116 2.119889       5.077130 22.66207 7.924735 17.17100 7.200464 5.491070       10.70739 
1 1 1 -28 3  16 o 11.02913 5.190872 -3.131029      3.589386 -2.446418      5.103780 -3.801017      5.048979 13.96055 6.440970 13.14229 6.176377 0.8182592      8.923773 
1 1 1 -28 3  17 o 15.08993 6.386849 1.206966       4.054295 0.1471609      5.273686 2.738498       6.339636 15.80824 6.981286 18.77763 7.968802 -2.969394      10.59435 
1 1 1 -28 3  18 o 15.89834 6.295890 2.526366       3.621350 5.507278       5.283186 -0.1153748     4.973551 20.41864 7.733303 15.20932 6.745111 5.209325       10.26160 
1 1 1 -28 3  19 f 28.24645 6.483302 11.46485       4.368051 4.796872       5.811285 20.12476       6.622649 19.96313 7.952820 36.68856 7.655300 -16.72543      11.03861 
1 1 1 -28 3  20 o 16.89293 6.395094 3.398916       3.611970 2.791277       5.289497 3.929803       4.944165 17.76151 7.391390 18.52333 7.349725 -0.7618198     10.42358 
1 1 1 -28 3  21 o 21.05507 7.392273 6.366328       4.694874 7.056825       5.375708 4.146527       9.638551 21.96225 7.889776 21.58261 9.488286 0.3796387      12.34002 
1 1 1 -28 3  22 o 11.63588 5.366868 -1.910589      3.539777 -1.607773      5.147122 -2.182331      4.875884 14.34740 6.563496 13.62838 6.290504 0.7190151      9.091200 
1 1 1 -28 3  23 o 51.63052 4.025773 34.66011       5.025134 37.10418       7.421653 32.59105       6.828561 51.51723 6.025374 48.36728 5.916546 3.149956       8.444564 
1 1 1 -28 3  24 o 13.75607 6.155970 -0.5001605     4.240357 -7.058285      9.215164 1.261441       4.776030 16.40574 7.885940 15.81155 6.817501 0.5941916      10.42432 
1 1 1 -28 4  1  o 38.33645 3.903358 19.07759       3.595778 14.64471       4.306286 29.28609       6.534930 32.48713 5.644163 45.83437 5.994282 -13.34724      8.233347 
1 1 1 -28 4  2  o 25.31009 5.683482 8.974933       3.419443 7.956434       3.876177 12.54886       7.261000 23.39473 6.544032 27.55303 9.207373 -4.158300      11.29602 
1 1 1 -28 4  3  o 31.38231 4.260596 12.93585       3.174227 13.19310       4.032758 12.51693       5.146182 30.96350 5.548407 28.98333 7.293169 1.980173       9.163795 
1 1 1 -28 4  4  o 33.77265 4.356863 14.97430       3.502253 16.51509       4.393954 12.29019       5.799412 34.90044 5.335604 28.26542 8.038888 6.635017       9.648439 
1 1 1 -28 4  5  o 13.56235 5.593093 1.211288       2.991041 0.8799762      4.911211 1.406629       3.771080 15.90837 6.886390 14.90472 6.224717 1.003644       9.282751 
1 1 1 -28 4  6  o 31.97624 4.076142 13.29374       3.104131 10.50803       4.192257 16.67462       4.618429 27.16202 6.433321 34.96625 5.609762 -7.804234      8.535634 
1 1 1 -28 4  7  o 26.36534 4.610470 9.244165       2.854398 8.938620       3.816750 9.631932       4.299728 25.12805 6.257090 25.84509 6.753440 -0.7170429     9.206526 
1 1 1 -28 4  8  o 25.13288 4.794333 8.464865       2.829226 9.087268       3.838474 7.724521       4.186386 25.35942 6.251681 23.16287 6.901196 2.196545       9.311822 
1 1 1 -28 4  9  o 32.41689 3.888055 13.56047       3.010213 9.750879       4.083785 18.09311       4.454501 26.19923 6.442186 36.82636 5.100448 -10.62713      8.216832 
1 1 1 -28 4  10 o 22.59802 6.150948 7.182967       3.477254 -2.421037      6.479332 11.06798       4.120979 15.83900 7.289414 28.10059 6.185840 -12.26159      9.560344 
1 1 1 -28 4  11 o 42.71766 4.003144 23.49548       4.118656 20.44309       7.738771 24.70173       4.864868 36.27741 8.836808 43.39824 4.673646 -7.120823      9.996607 
1 1 1 -28 4  12 o 34.89356 9.283498 19.42665       8.031351 21.06138       11.61776 17.93035       11.11501 33.77645 11.64230 31.56240 11.34414 2.214052       16.25523 
1 1 1 -28 4  13 o 25.83860 6.230003 9.418250       3.876747 7.543033       5.650895 11.08554       5.328403 22.89980 8.104016 27.24765 7.690704 -4.347851      11.17238 
1 1 1 -28 4  14 o 15.95519 5.860067 3.019034       2.988027 -2.195411      5.137105 5.685244       3.673344 14.17388 6.511205 20.22124 6.538455 -6.047369      9.227523 
1 1 1 -28 4  15 o 46.69984 4.243227 28.27929       4.776228 29.18604       6.722155 27.35483       6.787532 45.99847 6.150960 44.23589 6.489386 1.762581       8.941277 
1 1 1 -28 4  16 f 29.50160 5.963274 12.13100       4.139516 14.26272       5.953171 10.13543       5.759931 30.67865 7.911685 25.75896 8.173251 4.919689       11.37527 
1 1 1 -28 4  17 o 22.61212 7.233978 7.460940       4.504647 8.574866       5.882672 5.881813       7.004145 23.87598 8.281832 21.61299 8.689825 2.262995       12.00424 
1 1 1 -28 4  18 o 50.58367 4.362440 33.39760       5.324954 34.52542       6.930183 31.77199       8.320182 50.23748 5.765186 46.39323 7.623992 3.844250       9.558380 
1 1 1 -28 4  19 o 14.78108 6.101762 1.614568       3.564570 2.094673       5.266297 1.208633       4.842458 17.18001 7.275674 16.00269 6.881955 1.177320       10.01483 
1 1 1 -28 4  20 o 48.81030 6.027922 33.08031       7.017746 33.08031       7.017746 0.000000       0.000000 48.81030 6.027922 ?        ?        0.000000       6.027922 
1 1 1 -28 4  21 o 18.85673 6.614238 4.857702       3.758022 2.354964       5.511672 7.032034       5.137343 17.55020 7.438322 21.88550 7.728656 -4.335299      10.72664 
1 1 1 -28 4  22 o 29.77944 5.854420 12.47821       4.096991 9.098704       6.056591 15.32920       5.562882 24.09441 8.400640 31.95514 7.303563 -7.860737      11.13161 
1 1 1 -28 4  23 f 12.73571 5.649024 -0.3244688     3.489880 -0.3017762     5.340759 -0.3413785     4.610292 15.36383 6.889552 14.40555 6.434710 0.9582796      9.427164 
1 1 1 -28 4  24 o 12.32632 5.746528 -2.621739      4.226195 -5.704111      9.422003 -1.845392      4.728557 17.02295 8.126445 13.56257 6.236442 3.460378       10.24365 
1 1 1 -28 5  1  o 12.01558 5.279317 -0.1435440     2.980011 0.9160637      3.719150 -2.043896      4.980675 14.21233 6.069824 13.83751 6.376513 0.3748226      8.803561 
1 1 1 -28 5  2  o 10.92981 4.832327 -0.3761207     2.533587 -0.9660840     3.341902 0.4212711      3.885233 11.99002 5.406982 14.04302 6.101681 -2.053002      8.152667 
1 1 1 -28 5  3  o 26.69446 5.136578 9.728378       3.220140 9.059425       3.895899 11.17088       5.720941 25.07923 6.364961 26.79719 8.086837 -1.717957      10.29124 
1 1 1 -28 5  4  o 21.51629 5.605880 6.469213       2.968364 8.093658       3.786855 3.880486       4.780457 23.72166 6.403013 18.40467 7.250697 5.316988       9.673220 
1 1 1 -28 5  5  o 31.04373 4.158477 12.59779       3.066842 13.94158       4.166643 11.00905       4.530507 31.88641 5.564521 27.52719 6.795338 4.359221       8.782967 
1 1 1 -28 5  6  o 19.03352 6.068117 4.988424       3.171803 -1.068663      5.114096 8.774784       4.043412 14.78815 6.676937 24.67861 6.596705 -9.890452      9.386053 
1 1 1 -28 5  7  o 18.35091 5.534197 4.602435       2.679936 6.233411       3.636181 2.662993       3.965155 21.00784 6.468666 16.47394 6.567118 4.533901       9.217954 
1 1 1 -28 5  8  o 10.54814 4.722989 -0.7509966     2.499696 3.121833       3.496323 -4.800552      3.575206 16.55865 6.286507 10.08955 4.865544 6.469107       7.949445 
1 1 1 -28 5  9  o 29.74351 4.410674 11.63435       3.100219 6.928092       4.259336 16.93687       4.521106 22.00892 7.033537 35.39566 5.413290 -13.38673      8.875492 
1 1 1 -28 5  10 o 13.25957 5.606412 0.7250629      3.118734 0.6347384      6.383343 0.7533842      3.574388 17.45991 7.696968 14.01653 5.967237 3.443388       9.739160 
1 1 1 -28 5  11 o 74.27464 3.397613 69.77388       6.133365 67.89600       8.878319 71.48823       8.482957 71.62978 5.120053 73.92982 4.733463 -2.300041      6.972849 
1 1 1 -28 5  12 f 19.64438 6.647829 5.270413       3.784540 14.32394       5.745298 -1.669185      5.030034 31.02902 7.647913 14.33627 6.531584 16.69276       10.05744 
1 1 1 -28 5  13 o 31.42890 5.714818 13.56307       4.215728 -7.786247      10.70101 17.48524       4.586655 17.94545 8.592174 35.97677 5.398021 -18.03132      10.14712 
1 1 1 -28 5  14 o 34.41048 4.570892 15.59576       3.738193 15.16511       6.126631 15.85118       4.718258 31.67991 7.949771 33.87717 5.931280 -2.197264      9.918615 
1 1 1 -28 5  15 o 54.72311 3.632969 38.19403       4.817289 35.67324       9.054143 39.18938       5.689415 49.19135 7.814062 54.96450 4.281404 -5.773148      8.910106 
1 1 1 -28 5  16 o 22.18943 6.080152 6.967351       3.384552 10.66124       5.981641 5.227804       4.104843 26.24280 8.329344 19.61470 6.910078 6.628098       10.82253 
1 1 1 -28 5  17 o 16.94477 6.532355 3.261502       3.813519 10.12283       5.726340 -2.206686      5.112047 25.63448 8.151236 14.04792 6.468625 11.58656       10.40604 
1 1 1 -28 5  18 o 26.48683 6.749449 10.23471       4.368397 8.093410       5.727735 13.21211       6.754043 23.24386 8.164687 28.64179 8.815465 -5.397928      12.01560 
1 1 1 -28 5  19 o 14.89889 6.429316 0.7818635      4.254496 2.814636       4.979480 -4.714402      8.187917 17.49787 7.216398 16.45556 7.773819 1.042307       10.60701 
1 1 1 -28 5  20 o 17.96255 7.046531 3.742685       4.498412 1.496396       5.160490 10.85068       9.179766 16.53896 7.108351 25.68007 10.06847 -9.141115      12.32488 
1 1 1 -28 5  21 o 18.41519 6.588534 4.549263       3.744575 4.677314       5.645341 4.448664       5.003773 19.60611 7.829195 18.99949 7.438176 0.6066227      10.79920 
1 1 1 -28 5  22 o 39.65962 4.721968 20.99910       4.474089 21.74212       6.374226 20.27757       6.281431 38.43360 7.066124 36.93050 7.238616 1.503098       10.11571 
1 1 1 -28 5  23 o 17.89204 6.445262 4.266381       3.590310 2.642848       5.261550 5.681040       4.911441 17.44290 7.323278 20.16299 7.493672 -2.720085      10.47786 
1 1 1 -28 6  1  o 13.88928 5.439081 1.931758       2.676190 -0.5248550E-01 3.609557 4.354011       3.988101 13.15238 5.793382 18.20708 6.755300 -5.054698      8.899289 
1 1 1 -28 6  2  o 17.68662 5.888006 4.267664       2.969849 4.465224       3.607618 3.852283       5.231112 18.22336 6.472634 18.55274 7.492018 -0.3293839     9.900774 
1 1 1 -28 6  3  o 20.47680 5.596252 5.881990       2.871572 3.627233       3.769146 9.001267       4.433228 17.27470 6.534309 24.60341 7.038710 -7.328709      9.604198 
1 1 1 -28 6  4  o 29.69283 4.441616 11.67897       3.115286 13.02064       4.124063 9.895986       4.754183 30.61867 5.737948 25.72233 7.265987 4.896334       9.258435 
1 1 1 -28 6  5  f 32.78336 4.242902 14.08360       3.310210 10.55084       4.120968 20.50865       5.557510 27.17010 6.340333 38.31463 6.161064 -11.14452      8.840732 
1 1 1 -28 6  6  o 26.04771 4.604743 9.058693       2.815991 8.893129       3.753831 9.271774       4.258580 25.01028 6.192279 25.23916 6.780362 -0.2288799     9.182463 
1 1 1 -28 6  7  o 16.09176 6.064339 2.979077       3.239608 1.579267       6.076536 3.534942       3.829185 17.69465 7.659787 17.32454 6.578562 0.3701115      10.09702 
1 1 1 -28 6  8  o 14.30426 5.460497 2.157517       2.646968 4.677535       3.710292 -0.4544367     3.777366 18.74608 6.572352 13.23936 5.874504 5.506721       8.815079 
1 1 1 -28 6  9  o 20.69416 6.139575 6.010419       3.318915 4.614061       5.380461 6.868064       4.216723 19.66196 7.708471 21.88835 6.998610 -2.226395      10.41158 
1 1 1 -28 6  10 o 10.47548 4.973405 -3.542771      3.431750 -9.606484      4.888563 2.348739       4.818647 10.51244 5.196868 17.06740 7.074514 -6.554956      8.778166 
1 1 1 -28 6  11 o 28.05723 5.284165 10.70369       3.480395 16.25152       6.071212 7.988078       4.247637 33.02920 7.687580 23.47170 6.941115 9.557499       10.35751 
1 1 1 -28 6  12 o 93.59676 3.527062 111.1397       8.030311 100.9749       13.47337 116.7400       10.00071 85.22328 6.537480 94.98193 4.332101 -9.758644      7.842560 
1 1 1 -28 6  13 o 15.87912 6.379522 2.320917       3.771842 -5.934564      9.924348 3.714707       4.077834 17.81969 8.459438 17.76365 6.778407 0.5604553E-01  10.84015 
1 1 1 -28 6  14 o 42.11058 4.119466 22.98382       4.173338 20.94790       7.175352 24.02463       5.130356 37.16230 8.148277 42.43811 5.060426 -5.275810      9.591784 
1 1 1 -28 6  15 o 35.36950 5.330473 16.94183       4.451830 19.12505       6.565591 15.08386       6.056818 35.74387 7.760593 31.50933 7.902873 4.234537       11.07620 
1 1 1 -28 6  16 o 80.48025 3.201962 81.78547       6.267205 72.12472       11.58893 85.77866       7.450706 71.44817 6.735517 81.90273 3.742936 -10.45456      7.705631 
1 1 1 -28 6  17 o 31.16443 4.960639 13.07066       3.641168 8.805904       6.068355 15.46990       4.551569 24.01666 8.406382 33.41297 5.800249 -9.396307      10.21323 
1 1 1 -28 6  18 o 50.72452 5.898310 35.47737       7.155086 35.47737       7.155086 0.000000       0.000000 50.72452 5.898310 ?        ?        0.000000       5.898310 
1 1 1 -28 6  19 o 26.06103 7.361568 10.24519       4.880116 11.87089       5.735233 5.979990       9.289693 27.59390 8.040008 22.47014 9.594699 5.123766       12.51799 
1 1 1 -28 6  20 o 23.84189 6.302573 8.211857       3.716776 9.145551       5.327020 7.326140       5.188353 24.38216 7.872989 22.22162 7.773358 2.160545       11.06386 
1 1 1 -28 6  21 o 27.27881 6.032675 10.60183       3.903694 12.67407       5.690390 8.759638       5.365259 28.48632 7.914436 23.83282 7.913424 4.653505       11.19199 
1 1 1 -28 6  22 o 21.87280 6.676469 7.027677       3.884240 16.59855       6.103605 0.5134509      5.035495 32.81876 7.755542 15.56054 6.848835 17.25822       10.34674 
1 1 1 -28 6  23 o 25.66490 6.865052 9.842190       4.377210 10.10159       5.991163 9.545184       6.410732 25.09102 8.363145 24.37847 8.631270 0.7125492      12.01836 
1 1 1 -28 7  1  o 15.62291 5.942737 2.855885       3.128107 4.583286       3.865691 -0.4207764     5.324102 18.39342 6.679360 15.20948 6.844728 3.183936       9.563689 
1 1 1 -28 7  2  o 14.73335 5.524251 2.511775       2.680869 1.316725       3.454438 4.321456       4.250944 14.22117 5.949772 18.32986 6.938036 -4.108695      9.139811 
1 1 1 -28 7  3  o 18.53868 5.590371 4.785955       2.734696 3.324127       3.537942 6.955735       4.310328 16.67292 6.325222 21.74163 7.086709 -5.068718      9.498941 
1 1 1 -28 7  4  o 39.85006 3.776341 20.49627       3.623457 16.40498       4.425316 28.81924       6.311806 34.61655 5.423965 45.70908 5.796675 -11.09253      7.938566 
1 1 1 -28 7  5  o 20.15194 5.761055 5.699566       2.970913 6.188775       4.051915 5.130798       4.368991 20.80296 6.875911 19.50616 7.098313 1.296801       9.882521 
1 1 1 -28 7  6  o 12.24811 5.199929 0.5208885      2.701297 -1.946889      3.426600 4.572424       4.390564 11.44765 5.280165 18.88973 7.072314 -7.442083      8.825971 
1 1 1 -28 7  7  o 21.20080 5.424444 6.236197       2.813654 6.361557       3.776430 6.079778       4.218363 21.11621 6.607076 20.73537 7.018507 0.3808403      9.639133 
1 1 1 -28 7  8  o 50.35054 4.022722 32.72991       4.894810 27.32935       6.896770 38.21120       6.948129 43.94996 6.646888 53.24344 5.431047 -9.293480      8.583553 
1 1 1 -28 7  9  o 25.61678 6.228973 9.324428       3.850340 10.01172       5.720710 8.755241       5.206015 25.57264 8.149016 24.17868 7.780891 1.393967       11.26715 
1 1 1 -28 7  10 f 15.88044 5.946191 2.919495       3.103816 3.440444       5.315093 2.649915       3.823468 18.47551 7.518558 16.28277 6.462457 2.192739       9.914235 
1 1 1 -28 7  11 o 40.27718 4.132774 21.05482       3.998888 19.75452       6.492958 21.84944       5.075766 36.57768 7.535233 40.27820 5.299707 -3.700520      9.212308 
1 1 1 -28 7  12 o 41.01216 4.131507 21.82756       4.072903 24.73223       6.767051 20.17766       5.100104 41.57246 6.923067 38.47112 5.604750 3.101334       8.907416 
1 1 1 -28 7  13 o 33.79643 4.555211 15.08453       3.656156 13.09301       6.030966 16.24173       4.597267 29.10710 8.170281 34.39103 5.683908 -5.283930      9.952905 
1 1 1 -28 7  14 o 41.40836 4.595590 22.59144       4.559305 8.758056       11.46208 25.19162       4.969357 25.02401 10.67062 43.63907 4.749458 -18.61506      11.67988 
1 1 1 -28 7  15 o 25.47212 5.798841 9.094542       3.518477 6.425840       5.956347 10.52484       4.360575 21.57927 8.202311 26.92826 6.677981 -5.348988      10.57702 
1 1 1 -28 7  16 f 51.93359 4.049101 34.90978       5.083929 13.46235       11.41989 40.21102       5.677575 27.61217 11.09801 55.61733 4.220570 -28.00516      11.87346 
1 1 1 -28 7  17 f 16.12644 6.291637 2.807836       3.569947 5.180293       5.214643 0.7150980      4.897594 19.95261 7.652408 15.66506 6.827970 4.287555       10.25576 
1 1 1 -28 7  18 o 28.52421 5.989562 11.48677       4.030607 10.55865       5.886744 12.30587       5.530223 25.92780 8.266898 28.28920 7.780226 -2.361393      11.35225 
1 1 1 -28 7  19 o 13.37673 5.881543 -0.3171337E-01 3.704684 -0.5933610     4.814130 0.7838936      5.801314 14.56823 6.536273 16.68590 7.347418 -2.117672      9.833993 
1 1 1 -28 7  20 o 13.80218 5.907378 0.7477843      3.536501 0.2370866      5.030073 1.246989       4.973149 15.39809 6.808320 16.08669 6.946558 -0.6885996     9.726659 
1 1 1 -28 7  21 o 9.791218 4.726422 -4.520824      3.394240 -2.785015      5.101325 -5.899746      4.546759 13.57841 6.324657 11.22204 5.430044 2.356378       8.335866 
1 1 1 -28 7  22 o 13.81307 5.983679 0.5209122      3.713392 1.828652       5.773971 -0.4015066     4.849288 17.27276 7.471906 14.66691 6.571899 2.605848       9.950841 
1 1 1 -28 8  1  o 20.68932 6.340654 6.243901       3.498794 8.311407       5.854902 5.095469       4.363639 22.99537 8.237170 19.18352 7.075495 3.811853       10.85880 
1 1 1 -28 8  2  o 8.594408 4.139901 -3.445370      2.571120 -3.473495      3.360622 -3.405669      3.992769 10.26832 4.888307 11.47041 5.421712 -1.202088      7.300035 
1 1 1 -28 8  3  o 12.68737 5.281352 0.9618752      2.701689 1.301035       3.563303 0.5032659      4.143542 14.35446 6.026629 14.41701 6.282238 -0.6255054E-01 8.705560 
1 1 1 -28 8  4  f 36.09874 3.976305 16.98041       3.440032 16.07507       4.743509 17.98476       4.996200 33.81129 5.975577 35.83702 5.928074 -2.025730      8.417220 
1 1 1 -28 8  5  o 40.43917 3.716425 21.07649       3.621458 19.22333       5.044260 23.04770       5.202432 37.26600 5.738423 41.19510 5.305372 -3.929108      7.815144 
1 1 1 -28 8  6  o 18.95039 6.099406 4.995946       3.198965 1.796253       3.564408 18.24375       7.252793 14.95386 6.129732 33.74226 8.748461 -18.78840      10.68219 
1 1 1 -28 8  7  o 90.43047 3.102709 103.1103       6.827288 98.78516       7.862970 116.3610       13.76281 87.91465 3.678323 91.61546 6.201100 -3.700806      7.209972 
1 1 1 -28 8  8  o 35.58536 4.516220 16.71762       3.828272 13.68192       6.059237 18.73453       4.938908 29.69006 8.135237 36.92965 5.668908 -7.239592      9.915573 
1 1 1 -28 8  9  o 16.90366 6.239206 3.513336       3.394149 3.900598       5.733695 3.304423       4.211295 19.13372 7.800546 17.33334 6.812460 1.800386       10.35655 
1 1 1 -28 8  10 o 36.68399 4.391083 17.66864       3.847511 11.04083       6.177298 21.86949       4.917928 26.52540 8.469665 40.36951 5.113667 -13.84411      9.893675 
1 1 1 -28 8  11 o 22.51472 6.167816 7.220317       3.483329 3.704786       5.505002 9.567732       4.498388 18.79757 7.650925 25.47767 7.020896 -6.680096      10.38410 
1 1 1 -28 8  12 o 60.87975 3.728472 47.46172       5.504931 34.99561       7.587358 61.31810       7.999259 49.99114 6.372873 68.11305 4.851045 -18.12191      8.009130 
1 1 1 -28 8  13 o 41.06227 3.959458 21.82084       3.912929 15.88023       6.185539 25.78412       5.052301 32.23634 7.929586 44.09992 4.777482 -11.86358      9.257574 
1 1 1 -28 8  14 o 18.35661 6.575235 4.450931       3.730620 -5.634660      10.20378 6.007108       4.008112 17.97826 8.547055 20.56198 6.840098 -2.583715      10.94710 
1 1 1 -28 8  15 o 29.71729 4.928195 11.90559       3.443923 5.542923       5.529605 15.93772       4.401916 20.47694 7.873305 34.11240 5.480943 -13.63546      9.593210 
1 1 1 -28 8  16 o 24.60744 6.724836 8.868720       4.146676 8.653844       5.779693 9.096653       5.952703 23.79210 8.211174 24.26536 8.334803 -0.4732590     11.70010 
1 1 1 -28 8  17 o 29.83417 7.089829 13.19583       5.078059 8.302403       10.60478 14.65168       5.784333 24.23486 10.29648 30.99593 7.693971 -6.761070      12.85358 
1 1 1 -28 8  18 o 14.10778 5.746270 1.604942       3.107979 0.3805489      5.052494 2.350275       3.942036 15.55488 6.852830 15.95895 6.482201 -0.4040689     9.432932 
1 1 1 -28 8  19 o 16.53420 6.256517 3.269304       3.456228 3.510188       5.547081 3.116446       4.418797 18.48762 7.619785 17.19463 6.906049 1.292995       10.28371 
1 1 1 -28 8  20 o 26.82614 6.277185 10.39634       4.030336 10.73772       5.842033 10.08630       5.567392 25.97135 8.230160 25.32109 8.035625 0.6502552      11.50247 
1 1 1 -28 8  21 o 29.14772 5.957987 12.06605       4.088939 7.761092       5.953070 15.91101       5.626043 22.58393 8.275264 32.50352 7.283730 -9.919592      11.02419 
1 1 1 -28 8  22 o 34.55195 5.285650 16.38003       4.309222 15.09365       6.480964 17.39939       5.769258 30.53972 8.431644 34.11190 7.168428 -3.572180      11.06702 
1 1 1 -28 9  1  o 12.47819 5.224660 0.8874803      2.666910 -1.871927      3.481966 4.803540       4.148024 11.47040 5.302019 18.70049 6.898274 -7.230098      8.700437 
1 1 1 -28 9  2  o 16.91401 6.231671 3.683239       3.383339 1.936615       5.198188 4.967004       4.456510 16.71584 7.158381 19.07720 7.128738 -2.361357      10.10254 
1 1 1 -28 9  3  o 19.74066 5.944420 5.562367       3.093633 10.47677       3.744503 -5.005227      5.490942 27.15384 5.832886 12.99949 6.205167 14.15435       8.516258 
1 1 1 -28 9  4  o 26.67111 5.562688 9.968071       3.498242 11.18267       4.416980 7.924078       5.729912 27.56029 6.652970 22.75240 8.148933 4.807884       10.51985 
1 1 1 -28 9  5  o 24.02400 5.645226 8.137388       3.248590 9.974673       3.969510 4.411274       5.652970 26.27148 6.284835 19.31639 7.792575 6.955086       10.01116 
1 1 1 -28 9  6  o 13.00345 5.290836 1.288594       2.631505 2.036049       3.500812 0.3176461      3.990011 15.09865 6.117483 14.08779 6.151298 1.010858       8.675371 
1 1 1 -28 9  7  o 49.02999 3.335009 30.60114       3.960976 28.69109       4.964414 33.94720       6.570695 46.73108 4.411605 49.90571 5.493638 -3.174629      7.045731 
1 1 1 -28 9  8  o 27.55659 5.681052 10.60105       3.688131 8.309152       5.646047 12.30690       4.870973 23.38540 8.113455 28.85493 6.999709 -5.469521      10.71560 
1 1 1 -28 9  9  o 18.37239 6.134682 4.623214       3.223460 8.195597       5.061046 2.184908       4.181242 23.33691 7.683306 16.08572 6.621193 7.251190       10.14265 
1 1 1 -28 9  10 o 26.72720 5.544367 9.918113       3.492616 11.35173       5.614071 9.012923       4.460993 27.06298 7.973786 24.63923 7.064467 2.423756       10.65307 
1 1 1 -28 9  11 o 41.78391 5.628044 23.92725       5.585048 22.36597       6.642396 27.69413       10.31751 39.02495 7.251543 39.75605 10.49672 -0.7310982     12.75798 
1 1 1 -28 9  12 o 17.65100 6.143636 4.139059       3.238585 4.370937       4.953631 3.965960       4.279967 18.96263 7.407506 18.07189 6.932337 0.8907375      10.14537 
1 1 1 -28 9  13 o 18.19047 6.093474 4.512826       3.179951 0.5133978      5.151953 6.974254       4.041722 15.80861 6.943839 21.88939 6.833144 -6.080777      9.742112 
1 1 1 -28 9  14 o 21.66850 6.212075 6.724236       3.449591 0.5471654      5.484873 10.76650       4.436983 16.21037 7.140884 27.12201 6.742176 -10.91163      9.820853 
1 1 1 -28 9  15 o 19.71559 7.151224 5.321081       4.429451 -0.8659233     10.19665 6.760167       4.917685 19.62030 9.070586 21.56346 7.566048 -1.943163      11.81188 
1 1 1 -28 9  16 o 13.37224 5.667419 0.8147864      3.199517 0.9143140      5.512897 0.7642357      3.928906 16.46915 7.209898 14.40503 6.196941 2.064123       9.507087 
1 1 1 -28 9  17 o 48.49508 4.196547 30.69806       4.910604 22.93858       7.083391 37.87800       6.813740 38.94325 7.736785 52.82988 5.367024 -13.88663      9.416092 
1 1 1 -28 9  18 o 13.88369 5.767403 1.295925       3.212341 0.7992307      5.445294 1.561052       3.978355 16.27049 7.143004 15.17913 6.370093 1.091365       9.570820 
1 1 1 -28 9  19 o 11.77094 5.480627 -2.449240      3.824735 -1.719347      10.31606 -2.565560      4.118239 19.18846 8.956426 12.20010 5.682654 6.988358       10.60708 
1 1 1 -28 9  20 o 27.60318 5.657914 10.70624       3.677892 6.397691       6.232115 13.00873       4.555835 21.31364 8.313587 29.94879 6.434310 -8.635157      10.51266 
1 1 1 -28 9  21 o 12.80387 5.692163 -0.3667986     3.563605 0.3464653      5.467672 -0.8935406     4.698685 15.90502 7.061922 14.11901 6.385013 1.786016       9.520458 
1 1 1 -28 10 1  o 13.44946 5.531782 1.400402       2.915576 0.8985580      3.512079 2.513038       5.229453 13.76629 5.889362 17.10048 7.246449 -3.334187      9.337858 
1 1 1 -28 10 2  o 16.08635 5.916873 3.277233       3.048042 4.277053       3.683479 1.105645       5.428579 17.83359 6.513408 16.27387 7.138636 1.559719       9.663571 
1 1 1 -28 10 3  o 11.32142 5.163978 -1.275390      3.155744 -3.844265      4.759073 0.7405757      4.215920 12.45483 5.896581 14.64034 6.358676 -2.185515      8.671934 
1 1 1 -28 10 4  o 35.32391 3.796960 16.22827       3.217189 17.49603       4.233222 14.49486       4.949984 35.92630 4.968115 31.41499 6.672187 4.511305       8.318668 
1 1 1 -28 10 5  o 22.63829 5.396608 7.188681       2.934919 5.446804       3.693306 10.17353       4.834677 19.55991 6.567108 25.78635 7.341857 -6.226435      9.850369 
1 1 1 -28 10 6  o 14.35970 5.532271 2.209347       2.733985 2.603569       3.508362 1.599764       4.362651 15.72531 6.206450 15.64614 6.623912 0.7916832E-01  9.077236 
1 1 1 -28 10 7  o 18.60852 6.152342 4.819052       3.243927 6.180683       4.935171 3.783219       4.304448 20.79027 7.547368 17.78866 6.917565 3.001614       10.23794 
1 1 1 -28 10 8  o 12.68713 5.587595 -0.1490166     3.356485 -1.457385      4.649431 1.274977       4.850525 13.74063 6.267680 15.97073 6.878160 -2.230101      9.305531 
1 1 1 -28 10 9  o 42.17667 4.442883 23.45141       4.497880 25.59779       6.223927 21.10500       6.507467 42.68168 6.162146 37.66984 7.352950 5.011841       9.593638 
1 1 1 -28 10 10 o 43.58181 3.857365 24.56379       4.054423 16.55263       6.038685 31.13930       5.470909 32.99752 7.657787 48.46030 4.691339 -15.46278      8.980555 
1 1 1 -28 10 11 o 12.92126 5.543622 0.4899300      3.128181 -1.257966      4.904003 1.689061       4.061872 14.25014 6.475520 15.43293 6.453867 -1.182785      9.142470 
1 1 1 -28 10 12 o 15.13308 5.959835 2.324539       3.228868 4.617491       5.191922 0.8783987      4.123214 19.30188 7.570748 14.76887 6.350831 4.533010       9.881764 
1 1 1 -28 10 13 o 14.29993 6.061243 1.059797       3.660286 0.4879631      5.013714 1.712395       5.356083 15.58508 6.847707 16.88721 7.249666 -1.302120      9.972399 
1 1 1 -28 10 14 o 22.64152 6.664818 7.504257       3.923697 7.741276       5.501593 7.258897       5.597543 22.68875 7.999217 22.16553 8.039157 0.5232182      11.34088 
1 1 1 -28 10 15 o 19.14089 6.759788 5.043294       3.930079 9.721943       10.92033 4.347161       4.212322 24.97649 10.52205 18.40211 6.919393 6.574373       12.59331 
1 1 1 -28 10 16 o 32.01099 4.899287 13.82568       3.700411 5.815735       5.612084 19.98665       4.921917 20.64356 7.933239 38.18650 5.443078 -17.54295      9.620987 
1 1 1 -28 10 17 o 14.51160 5.841505 1.903517       3.169083 0.9912635      5.432022 2.374230       3.901948 16.37314 7.162609 15.89671 6.452013 0.4764328      9.640096 
1 1 1 -28 10 18 o 13.03781 5.620359 0.4555653      3.244649 -4.412986      5.631130 2.875318       3.969914 13.49113 6.395122 16.48305 6.570955 -2.991911      9.169244 
1 1 1 -28 10 19 o 14.70287 5.928261 1.982697       3.269769 3.336060       5.772068 1.343178       3.967807 18.41631 7.696903 14.91076 6.315021 3.505549       9.955994 
1 1 1 -28 10 20 o 33.98299 6.266984 16.54699       4.998709 24.43746       12.43842 15.02719       5.458930 33.79218 12.01693 31.54128 7.253677 2.250898       14.03647 
1 1 1 -28 11 1  o 11.95902 5.153990 0.3679046      2.727162 1.103381       3.597409 -0.6259380     4.181808 14.04930 5.983982 13.43268 6.053797 0.6166210      8.512138 
1 1 1 -28 11 2  f 10.13733 4.647241 -1.300897      2.598471 -2.297465      3.326607 0.2587878      4.161657 10.87833 5.080365 14.10935 6.217571 -3.231011      8.029216 
1 1 1 -28 11 3  o 15.04375 5.579035 2.747781       2.719584 2.754162       3.597822 2.739275       4.154001 15.87646 6.279141 16.38351 6.654363 -0.5070524     9.149217 
1 1 1 -28 11 4  o 24.84028 5.855366 8.850335       3.486143 11.16481       5.201522 6.962868       4.697254 26.68251 7.621295 21.50890 7.403305 5.173609       10.62511 
1 1 1 -28 11 5  o 18.23154 5.819113 4.658700       2.916172 2.396264       3.770655 8.025979       4.600111 15.70334 6.353803 22.94508 7.306941 -7.241737      9.683088 
1 1 1 -28 11 6  o 10.47373 4.733902 -0.9132690     2.578604 -2.417032      3.201466 1.864035       4.350817 10.60834 4.963931 15.82817 6.653230 -5.219828      8.300968 
1 1 1 -28 11 7  o 43.52616 3.965812 24.66216       4.160328 23.06794       6.292465 25.90027       5.545296 39.86417 6.715869 43.53156 5.339045 -3.667389      8.579528 
1 1 1 -28 11 8  o 25.62401 6.408782 9.575720       3.991221 8.082417       5.596745 11.12103       5.693374 22.95005 8.070040 26.48522 8.082868 -3.535166      11.42183 
1 1 1 -28 11 9  o 14.96645 6.088299 1.962872       3.483718 2.411029       4.878732 1.496637       4.976155 16.91934 7.074121 16.25430 6.983039 0.6650448      9.940123 
1 1 1 -28 11 10 o 38.18212 4.285207 19.18217       3.918471 21.12848       6.155491 17.85607       5.080942 38.04033 6.893995 35.56518 6.080844 2.475155       9.192596 
1 1 1 -28 11 11 o 31.45978 6.915265 14.59615       5.156709 13.86138       6.179780 16.28081       9.357365 29.50686 8.266159 29.77870 10.43765 -0.2718410     13.31443 
1 1 1 -28 11 12 o 21.25430 6.889081 6.599716       4.076397 -2.160227      5.615070 16.36126       5.927395 14.62545 6.750648 32.80413 7.568730 -18.17867      10.14184 
1 1 1 -28 11 13 o 20.29909 6.348068 5.906957       3.486623 1.738452       5.475491 8.749938       4.521888 16.97696 7.309645 24.11154 7.169607 -7.134583      10.23886 
1 1 1 -28 11 14 o 14.24929 5.892044 1.484466       3.331256 -0.5137382     5.389637 2.719758       4.237642 15.31091 6.888863 16.60109 6.728974 -1.290175      9.629929 
1 1 1 -28 11 15 o 16.68432 6.535059 3.128244       3.864068 -5.749248      10.18820 4.619774       4.176077 17.69863 8.449391 18.66160 6.914763 -0.9629631     10.91816 
1 1 1 -28 11 16 o 22.28617 6.152245 7.178283       3.450720 1.246492       5.860099 10.32685       4.269413 16.96083 7.429092 26.48154 6.631273 -9.520708      9.958172 
1 1 1 -28 11 17 o 24.46403 5.998706 8.594128       3.548327 7.437406       5.963480 9.228097       4.414887 22.23922 8.258852 24.76688 7.003910 -2.527658      10.82882 
1 1 1 -28 11 18 o 15.59049 6.104839 2.633892       3.371231 0.6085367      5.744153 3.698083       4.163756 16.37584 7.256356 17.52465 6.806739 -1.148809      9.949191 
1 1 1 -28 11 19 o 23.80168 6.199678 8.233577       3.631149 4.228120       7.237443 9.581005       4.197705 20.00833 8.503642 25.39948 6.690208 -5.391146      10.81993 
1 1 1 -28 12 1  o 12.03141 5.171137 0.4515759      2.731128 0.5552849      3.524496 0.2957084      4.320823 13.39626 5.816164 14.26674 6.308999 -0.8704758     8.580864 
1 1 1 -28 12 2  o 17.25285 5.727805 4.152445       2.810878 3.335217       3.778561 5.165063       4.206081 16.62490 6.476643 19.04846 6.959666 -2.423559      9.507042 
1 1 1 -28 12 3  o 19.94792 5.784938 5.733974       2.975460 9.597382       3.968418 0.7732407      4.496816 25.43219 6.407175 14.93515 6.525604 10.49703       9.145239 
1 1 1 -28 12 4  o 12.36065 5.500432 -0.3661412     3.335763 -3.075891      5.210771 1.515455       4.342107 13.45512 6.307875 15.40764 6.568762 -1.952518      9.107026 
1 1 1 -28 12 5  o 25.20627 5.035667 8.778509       2.984861 5.095781       3.876496 14.14167       4.678052 19.00836 6.713496 31.17091 6.373812 -12.16255      9.257241 
1 1 1 -28 12 6  o 9.902188 4.718938 -3.350730      3.148570 -1.475499      4.742055 -4.829233      4.210661 13.76013 6.296760 11.09715 5.333271 2.662978       8.251846 
1 1 1 -28 12 7  o 23.05209 6.053027 7.689960       3.443128 7.213440       5.468567 8.002934       4.431870 21.87236 7.944106 22.98033 7.152508 -1.107967      10.68958 
1 1 1 -28 12 8  o 17.85306 6.353660 4.300410       3.477790 3.015980       5.426064 5.195960       4.530794 17.84798 7.461246 19.42759 7.201736 -1.579615      10.36992 
1 1 1 -28 12 9  o 11.49238 5.383179 -2.744225      3.781477 -5.386395      4.773482 1.707742       6.196278 11.78558 5.667837 17.55196 7.664704 -5.766375      9.532683 
1 1 1 -28 12 10 o 38.97291 4.780850 20.37144       4.445505 15.30483       6.161461 25.87271       6.420311 31.13848 8.058434 42.56174 6.387058 -11.42326      10.28265 
1 1 1 -28 12 11 o 37.23671 4.443951 18.38358       3.953020 15.04887       6.114315 20.77848       5.181583 30.89604 8.043589 38.69730 5.662275 -7.801258      9.836700 
1 1 1 -28 12 12 o 16.90794 6.191144 3.656493       3.331213 2.367385       5.188570 4.560496       4.344985 17.14536 7.239473 18.64725 7.024068 -1.501886      10.08700 
1 1 1 -28 12 13 o 39.40349 4.221692 20.41045       3.990636 9.949656       6.213436 27.75517       5.206394 24.86373 8.516186 45.57551 4.757798 -20.71178      9.755104 
1 1 1 -28 12 14 o 32.61151 4.808997 14.34427       3.707181 16.43792       6.182314 13.16878       4.632425 32.46695 7.891985 30.06305 6.511945 2.403896       10.23176 
1 1 1 -28 12 15 o 13.00023 5.589269 0.5216854      3.192525 1.629765       5.430251 -0.6362408E-01 3.946638 16.77216 7.250714 13.64787 6.032744 3.124285       9.432224 
1 1 1 -28 12 16 o 15.29806 6.322513 1.925681       3.833161 -11.85623      10.37837 4.102684       4.124810 16.04015 7.858433 17.95264 6.825270 -1.912493      10.40862 
1 1 1 -28 12 17 o 22.30178 6.369677 7.283143       3.633454 1.581416       5.968127 10.64111       4.580082 17.23065 7.523373 26.58140 6.981956 -9.350758      10.26396 
1 1 1 -28 13 1  o 17.69983 5.912182 4.450408       2.993834 4.368464       3.925922 4.564282       4.628024 17.86978 6.688206 18.41425 7.169466 -0.5444698     9.804762 
1 1 1 -28 13 2  o 18.99812 5.735672 5.205672       2.877484 7.018696       3.778942 2.703926       4.439049 21.56164 6.586104 16.46075 6.803534 5.100895       9.469152 
1 1 1 -28 13 3  o 22.54212 5.651405 7.321854       3.098276 4.136687       4.077596 11.67269       4.765678 17.75032 6.777019 27.51354 7.070149 -9.763214      9.793620 
1 1 1 -28 13 4  o 29.95412 4.522180 12.10391       3.198240 13.12144       4.343226 10.89857       4.727106 30.06231 6.136504 26.54925 7.148563 3.513058       9.421180 
1 1 1 -28 13 5  o 18.18265 6.234829 4.645382       3.330593 6.143221       4.916190 3.374716       4.528054 20.43968 7.515055 17.30175 6.976238 3.137924       10.25397 
1 1 1 -28 13 6  o 11.24790 5.230729 -2.154778      3.467312 -3.406222      5.007206 -1.001879      4.806018 13.00404 6.123643 14.10128 6.408906 -1.097243      8.864146 
1 1 1 -28 13 7  o 10.54410 4.995496 -3.174971      3.427223 -2.642129      4.831698 -3.714538      4.862096 13.17592 6.143211 12.65427 5.981770 0.5216503      8.574416 
1 1 1 -28 13 8  o 14.25840 6.096687 1.001267       3.760117 1.930456       5.185434 -0.2909005E-01 5.460435 16.68379 7.147229 15.57397 6.976381 1.109819       9.987631 
1 1 1 -28 13 9  o 12.08157 5.535286 -1.527792      3.679182 -6.958332      5.091574 4.406284       5.322395 11.59816 5.643091 18.94375 7.589361 -7.345596      9.457425 
1 1 1 -28 13 10 o 33.72430 4.843548 15.38737       3.866477 8.316563       6.045509 20.28149       5.029631 23.02719 8.354224 38.22076 5.563251 -15.19357      10.03707 
1 1 1 -28 13 11 o 14.94913 5.990762 2.173155       3.317358 4.670954       5.422921 0.6795063      4.193520 19.27220 7.680863 14.57581 6.336100 4.696388       9.956999 
1 1 1 -28 13 12 o 16.56981 6.299296 3.336505       3.513484 0.5142671      5.551681 5.222098       4.537866 16.06967 7.126531 19.43221 7.206627 -3.362539      10.13523 
1 1 1 -28 13 13 o 8.913251 4.359801 -5.300536      3.156079 3.453652       5.231635 -10.30934      3.957276 18.04302 7.414409 8.643656 4.335526 9.399366       8.588961 
1 1 1 -28 13 14 o 17.20957 6.262527 3.878963       3.400705 -2.169914      5.628039 7.357525       4.267953 14.54365 6.728973 22.14066 7.036747 -7.597010      9.736267 
1 1 1 -28 13 15 o 33.20334 4.826663 14.90714       3.791107 9.494547       6.077681 18.35452       4.850420 24.28636 8.418315 36.25573 5.676003 -11.96937      10.15308 
1 1 1 -28 14 3  o 9.769241 4.582345 -2.184652      2.756122 -2.956799      3.318908 -0.4690946     4.947066 10.40779 4.926480 14.51306 6.558517 -4.105273      8.202704 
1 1 1 -28 14 4  o 25.88939 5.608253 9.579822       3.435716 9.954460       4.265772 8.888046       5.796605 25.58999 6.746057 23.31902 8.211784 2.270967       10.62745 
1 1 1 -28 14 5  o 21.68684 6.122958 6.918561       3.376927 3.178373       4.090391 14.92427       5.984365 16.70606 6.666578 30.38601 7.980651 -13.67994      10.39875 
1 1 1 -28 14 6  o 29.77293 6.526423 13.12762       4.604245 7.143563       10.81221 14.45312       5.088690 22.72765 10.01834 30.94079 6.922369 -8.213144      12.17728 
1 1 1 -28 14 7  o 20.68469 6.358737 6.295272       3.515406 1.247304       5.480141 9.824957       4.582489 16.38121 7.179465 25.24763 7.134158 -8.866426      10.12131 
1 1 1 -28 14 8  o 15.21609 6.049508 2.411379       3.355967 -0.9526510     5.207533 4.800865       4.388886 14.64215 6.661183 18.77795 7.062448 -4.135794      9.708220 
1 1 1 -28 14 9  o 22.46005 6.320988 7.434663       3.604860 2.035205       5.680157 11.07603       4.664630 17.17991 7.421304 26.97188 7.027434 -9.791969      10.22060 
1 1 1 -28 14 10 o 12.56814 5.678121 -0.8927165     3.705222 4.998878       5.433919 -6.012327      5.065417 19.50628 7.716145 11.91219 5.756060 7.594088       9.626584 
1 1 1 -28 14 11 o 18.17441 6.317134 4.585494       3.423488 8.045521       5.643748 2.571129       4.306228 22.68794 8.091774 16.37968 6.728384 6.308262       10.52369 
1 1 1 -28 14 12 o 21.38045 6.444269 6.728127       3.634536 -1.436390      5.771182 12.09479       4.678983 15.08127 6.918177 28.41414 6.840094 -13.33287      9.728723 
1 1 1 -28 14 13 f 14.61955 5.992770 1.810162       3.406956 -1.224903      5.452682 3.753897       4.363599 14.82714 6.772546 17.65499 6.935859 -2.827845      9.693995 
1 1 1 -27 0  1  o 13.17047 7.465401 3.127365       3.699767 3.127365       3.699767 3.127365       3.699767 13.17047 7.465401 13.17047 7.465401 -0.000000      0.000000 
1 1 1 -27 0  2  o 8.607449 6.022899 -4.262498      4.704104 -4.262498      4.704104 -4.262498      4.704104 8.607449 6.022899 8.607449 6.022899 -0.000000      0.000000 
1 1 1 -27 0  3  o 14.70609 8.323213 3.985073       4.589540 3.985073       4.589540 3.985073       4.589540 14.70609 8.323213 14.70609 8.323213 0.000000       0.000000 
1 1 1 -27 0  4  o 38.60316 4.998372 19.55017       4.485126 19.55017       4.485126 19.55017       4.485126 38.60316 4.998372 38.60316 4.998372 0.000000       0.000000 
1 1 1 -27 0  5  o 30.67154 8.442104 14.49434       5.455770 14.49434       5.455770 14.49434       5.455770 30.67154 8.442104 30.67154 8.442104 -0.000000      0.000000 
1 1 1 -27 0  6  o 62.96696 3.894579 49.69647       5.923020 49.69647       5.923020 49.69647       5.923020 62.96696 3.894579 62.96696 3.894579 0.000000       0.000000 
1 1 1 -27 0  7  o 19.30929 8.120596 6.764778       3.844397 6.764778       3.844397 6.764778       3.844397 19.30929 8.120596 19.30929 8.120596 0.000000       0.000000 
1 1 1 -27 0  8  o 40.19978 4.903606 21.04548       4.613092 21.04548       4.613092 21.04548       4.613092 40.19978 4.903606 40.19978 4.903606 0.000000       0.000000 
1 1 1 -27 0  9  o 7.199339 5.041971 -3.220607      3.317327 -3.220607      3.317327 -3.220607      3.317327 7.199339 5.041971 7.199339 5.041971 -0.000000      0.000000 
1 1 1 -27 0  10 o 10.06917 6.384642 0.6555647      3.390102 0.6555647      3.390102 0.6555647      3.390102 10.06917 6.384642 10.06917 6.384642 -0.000000      0.000000 
1 1 1 -27 0  11 o 73.07635 6.201221 69.16105       10.85306 69.16105       10.85306 69.16105       10.85306 73.07635 6.201221 73.07635 6.201221 -0.000000      0.000000 
1 1 1 -27 0  12 o 12.71906 7.851586 1.952963       4.778286 1.952963       4.778286 1.952963       4.778286 12.71906 7.851586 12.71906 7.851586 -0.000000      0.000000 
1 1 1 -27 0  13 o 77.82941 4.657523 76.37552       8.760399 76.37552       8.760399 76.37552       8.760399 77.82941 4.657523 77.82941 4.657523 -0.000000      0.000000 
1 1 1 -27 0  14 o 34.03124 8.160561 17.12636       5.869750 17.12636       5.869750 17.12636       5.869750 34.03124 8.160561 34.03124 8.160561 -0.000000      0.000000 
1 1 1 -27 0  15 o 8.215318 5.806789 -5.360164      4.726015 -5.360164      4.726015 -5.360164      4.726015 8.215318 5.806789 8.215318 5.806789 -0.000000      0.000000 
1 1 1 -27 0  16 o 58.76294 5.319343 44.45739       7.466501 44.45739       7.466501 44.45739       7.466501 58.76294 5.319343 58.76294 5.319343 -0.000000      0.000000 
1 1 1 -27 0  17 o 9.961567 6.888685 -3.839768      5.687448 -3.839768      5.687448 -3.839768      5.687448 9.961567 6.888685 9.961567 6.888685 -0.000000      0.000000 
1 1 1 -27 0  18 o 107.2997 4.595448 144.7527       11.96580 144.7527       11.96580 144.7527       11.96580 107.2997 4.595448 107.2997 4.595448 0.000000       0.000000 
1 1 1 -27 0  19 o 55.31462 5.538033 39.80393       7.280275 39.80393       7.280275 39.80393       7.280275 55.31462 5.538033 55.31462 5.538033 0.000000       0.000000 
1 1 1 -27 0  20 o 12.56869 8.015298 1.219547       5.433871 1.219547       5.433871 1.219547       5.433871 12.56869 8.015298 12.56869 8.015298 -0.000000      0.000000 
1 1 1 -27 0  21 o 11.61347 7.535189 0.4085252      5.076676 0.4085252      5.076676 0.4085252      5.076676 11.61347 7.535189 11.61347 7.535189 0.000000       0.000000 
1 1 1 -27 0  22 o 33.61956 8.671581 17.39434       6.139469 17.39434       6.139469 17.39434       6.139469 33.61956 8.671581 33.61956 8.671581 -0.000000      0.000000 
1 1 1 -27 0  23 o 21.90997 9.998158 9.586195       5.799278 9.586195       5.799278 9.586195       5.799278 21.90997 9.998158 21.90997 9.998158 0.000000       0.000000 
1 1 1 -27 0  24 o 33.48296 8.662844 17.39361       6.107991 17.39361       6.107991 17.39361       6.107991 33.48296 8.662844 33.48296 8.662844 0.000000       0.000000 
1 1 1 -27 0  25 o 13.88990 9.369837 -1.252728      9.191066 -1.252728      9.191066 -1.252728      9.191066 13.88990 9.369837 13.88990 9.369837 0.000000       0.000000 
1 1 1 -27 0  26 o 27.86893 9.419164 13.44538       5.721335 13.44538       5.721335 13.44538       5.721335 27.86893 9.419164 27.86893 9.419164 0.000000       0.000000 
1 1 1 -27 0  27 o 19.76609 9.871315 8.308670       5.793021 8.308670       5.793021 8.308670       5.793021 19.76609 9.871315 19.76609 9.871315 0.000000       0.000000 
1 1 1 -27 0  28 o 17.16201 9.327924 6.272461       5.500025 6.272461       5.500025 6.272461       5.500025 17.16201 9.327924 17.16201 9.327924 0.000000       0.000000 
1 1 1 -27 1  1  o 24.10407 5.677798 7.953019       3.279776 6.158649       3.777345 13.44994       6.611354 21.12968 6.607370 29.82900 8.615034 -8.699320      10.85708 
1 1 1 -27 1  2  o 20.64617 5.748888 5.816306       2.998794 7.166206       3.817418 3.640762       4.846215 22.68147 6.544972 18.63051 7.312282 4.050962       9.813568 
1 1 1 -27 1  3  o 26.29699 5.203268 9.252503       3.216297 8.295620       5.398438 9.779062       4.004626 24.17922 7.933972 26.58311 6.282069 -2.403891      10.11990 
1 1 1 -27 1  4  o 47.73404 7.638155 32.12999       8.585476 38.61113       12.48813 26.32125       11.82258 49.36306 10.69142 39.52533 11.55114 9.837738       15.73961 
1 1 1 -27 1  5  o 21.42432 5.159185 6.162786       2.661190 4.089314       3.846280 8.066871       3.685828 18.38822 6.664696 24.19845 6.217489 -5.810230      9.114567 
1 1 1 -27 1  6  o 14.94833 5.613515 2.353383       2.770474 1.859455       4.638301 2.627343       3.454391 16.78361 6.947411 16.15465 6.219944 0.6289577      9.324924 
1 1 1 -27 1  7  o 73.84468 2.743621 67.67438       4.928601 75.87433       7.537829 61.55081       6.513927 77.40894 4.009607 69.80920 3.843914 7.599747       5.554513 
1 1 1 -27 1  8  o 69.87400 2.758379 60.60146       4.687610 56.55618       6.171420 66.11822       7.206958 66.94915 3.798300 72.19215 4.113649 -5.242996      5.599034 
1 1 1 -27 1  9  o 33.19635 3.811057 14.02633       3.027140 13.15841       4.181113 14.98247       4.388453 31.35776 5.680657 33.56696 5.559345 -2.209198      7.948345 
1 1 1 -27 1  10 o 74.79109 3.369501 70.01772       6.125405 74.39233       7.488343 61.17157       10.64863 76.66798 4.022141 67.45383 6.560947 9.214142       7.695690 
1 1 1 -27 1  11 o 18.36921 5.831679 4.423347       2.932001 5.251042       4.895760 3.960463       3.661182 20.58624 7.510616 18.12407 6.511121 2.462162       9.940023 
1 1 1 -27 1  12 o 19.21103 6.694079 4.671469       3.845477 5.454013       10.38428 4.547100       4.139794 24.28025 10.24636 19.24019 6.922196 5.040064       12.36546 
1 1 1 -27 1  13 o 25.83425 5.948124 9.084543       3.667177 8.938835       5.269947 9.221341       5.106267 25.13787 7.795570 25.51689 7.626396 -0.3790207     10.90563 
1 1 1 -27 1  14 o 25.34379 6.168694 8.809402       3.773329 10.50331       5.336656 7.115958       5.335930 27.10215 7.712638 22.91162 7.890399 4.190529       11.03373 
1 1 1 -27 1  15 o 72.99368 3.308184 66.69666       5.869225 67.24440       8.300459 66.14893       8.300217 72.29545 4.737558 71.66825 4.779870 0.6271973      6.729904 
1 1 1 -27 1  16 f 37.23447 5.184151 18.24194       4.576522 23.28761       7.456783 15.19283       5.796671 40.39774 7.857536 32.69910 7.442357 7.698635       10.82264 
1 1 1 -27 1  17 f 48.61723 4.331224 30.32310       5.077744 36.08717       8.259910 26.82150       6.437911 51.33049 6.768092 44.65071 6.074055 6.679779       9.094021 
1 1 1 -27 1  18 o 33.51204 5.845893 15.17969       4.600532 18.77838       6.209876 10.80175       6.849289 36.47002 7.242781 26.95599 8.940815 9.514029       11.50635 
1 1 1 -27 1  19 o 36.31072 5.008237 17.36436       4.313657 18.45089       6.204914 16.34804       6.001058 36.02746 7.317519 33.74194 7.493385 2.285519       10.47363 
1 1 1 -27 1  20 o 29.57595 6.048283 12.04459       4.212014 19.17221       6.161617 5.792188       5.770933 36.77393 7.133160 21.35913 8.084011 15.41480       10.78115 
1 1 1 -27 1  21 o 13.37455 5.863122 -0.1643517     3.656766 -0.8393350     5.313107 0.4431556      5.040547 15.35515 6.879745 15.89653 6.927912 -0.5413771     9.763547 
1 1 1 -27 1  22 o 20.48279 6.699147 5.810747       3.850180 8.138228       5.639129 3.778317       5.269589 23.63506 8.112510 18.90325 7.558904 4.731813       11.08827 
1 1 1 -27 1  23 o 38.33881 4.876608 19.48006       4.453132 27.98489       6.503612 11.97318       6.110147 45.11951 6.068736 27.88461 8.344423 17.23491       10.31789 
1 1 1 -27 1  24 o 18.85688 7.339922 4.230206       4.849723 7.387083       5.793418 -3.162277      8.865459 22.57885 8.180080 17.83562 8.317646 4.743227       11.66606 
1 1 1 -27 1  25 o 13.36604 6.102114 -1.600763      4.419397 13.08244       9.579321 -5.570989      4.981177 27.48942 10.41276 12.12017 5.818640 15.36925       11.92821 
1 1 1 -27 1  26 o 21.34946 6.658788 6.605694       3.838984 6.910692       5.530081 6.321991       5.333538 21.80255 7.977962 21.12548 7.816914 0.6770687      11.16924 
1 1 1 -27 1  27 o 15.22970 6.265655 1.916636       3.741767 1.391267       5.336506 2.424707       5.247920 16.55906 7.173195 17.28378 7.288431 -0.7247124     10.22624 
1 1 1 -27 1  28 o 16.52070 6.472154 3.088142       3.790618 5.665493       5.522054 0.7913963      5.212791 20.31676 7.853075 15.91786 6.988500 4.398890       10.51237 
1 1 1 -27 2  1  o 26.26696 5.133026 9.249417       3.167789 6.568953       3.906790 14.39432       5.412571 21.73307 6.707361 31.76534 7.163592 -10.03227      9.813549 
1 1 1 -27 2  2  o 25.55203 5.001466 8.709997       3.002754 8.248152       4.063473 9.265581       4.456801 24.23185 6.671022 25.55611 6.966735 -1.324255      9.645617 
1 1 1 -27 2  3  o 71.01539 3.133072 63.07304       5.408648 60.30418       6.395090 70.02949       10.13654 69.00738 3.817780 72.66565 5.771713 -3.658272      6.920124 
1 1 1 -27 2  4  o 15.24900 5.436811 2.733062       2.547611 0.7487653      3.632829 4.653217       3.573632 14.28192 6.045355 18.95523 6.459363 -4.673314      8.847015 
1 1 1 -27 2  5  o 51.38396 3.306231 33.13408       4.117995 34.01096       6.842224 32.63606       5.156461 50.71032 5.631740 50.53529 4.225827 0.1750336      7.040888 
1 1 1 -27 2  6  o 30.51137 4.060701 11.95964       2.944357 6.819034       4.075950 17.56946       4.257905 22.25924 6.847716 36.69803 4.882217 -14.43879      8.409950 
1 1 1 -27 2  7  f 41.83203 3.213262 21.94719       3.250522 21.03144       4.562144 22.89142       4.632529 40.28505 4.737638 42.12391 4.586873 -1.838860      6.594286 
1 1 1 -27 2  8  o 23.40371 5.714652 7.429397       3.230472 5.366236       3.965277 11.50149       5.570776 20.21143 6.804742 28.30031 7.818661 -8.088882      10.36513 
1 1 1 -27 2  9  o 27.09147 5.181492 9.747999       3.296155 9.691341       4.147799 9.845098       5.429930 26.49082 6.479611 26.26254 7.867933 0.2282734      10.19263 
1 1 1 -27 2  10 o 51.74988 2.919560 33.35578       3.666890 32.44305       5.161767 34.28569       5.210102 50.43453 4.239050 51.90070 4.154083 -1.466164      5.935145 
1 1 1 -27 2  11 o 55.02905 3.126687 37.82208       4.175628 35.47180       6.755735 39.27504       5.311760 52.04668 5.405138 55.68483 3.939840 -3.638145      6.688637 
1 1 1 -27 2  12 o 31.79674 5.130128 13.31717       3.839829 15.84062       11.09194 12.97358       4.092904 31.54324 11.33297 31.16443 5.594950 0.3788090      12.63881 
1 1 1 -27 2  13 o 50.23932 4.819028 32.62397       5.827569 38.90810       11.87479 30.63040       6.688364 50.61842 9.981647 48.04448 5.831969 2.573940       11.56050 
1 1 1 -27 2  14 o 51.60735 4.170776 33.94219       5.200579 34.28730       6.862326 33.47655       7.971035 50.98721 5.615885 49.54868 6.779131 1.438522       8.803112 
1 1 1 -27 2  15 o 14.13293 6.092737 0.2523234      3.813335 -3.791676      6.152215 2.775292       4.859392 15.01828 6.978482 17.89488 7.222861 -2.876600      10.04335 
1 1 1 -27 2  16 o 17.48353 6.630655 3.349588       3.887135 -2.327476      6.359753 6.735175       4.911287 16.03823 7.321332 22.26073 7.572618 -6.222492      10.53311 
1 1 1 -27 2  17 f 55.67865 3.720663 39.21581       5.019328 45.42616       7.580073 34.36637       6.698242 58.83178 5.345495 51.03308 5.471398 7.798698       7.649217 
1 1 1 -27 2  18 o 47.73409 4.496710 29.40237       5.169073 30.48159       6.720695 27.83932       8.088114 47.68111 5.910507 44.12119 7.808193 3.559925       9.792955 
1 1 1 -27 2  19 f 92.67503 3.655048 108.4634       8.238334 104.7753       10.42029 114.6118       13.45415 89.98203 4.769159 92.57939 5.995810 -2.597359      7.661241 
1 1 1 -27 2  20 o 31.94524 5.719975 13.85414       4.289310 13.33510       6.147032 14.34669       5.988091 29.85626 8.199244 31.19298 7.877145 -1.336718      11.37000 
1 1 1 -27 2  21 o 38.01820 4.921395 19.07769       4.452609 14.24552       6.400457 23.60941       6.198288 30.66091 8.344839 41.37020 6.350802 -10.70929      10.48661 
1 1 1 -27 2  22 o 29.85506 6.010502 12.35791       4.221375 18.24982       6.424258 7.880762       5.600097 35.19923 7.703879 23.32420 8.081003 11.87503       11.16478 
1 1 1 -27 2  23 o 10.23094 4.926200 -4.738609      3.631778 -6.996986      5.333408 -2.786021      4.959204 12.14495 5.877683 13.55961 6.288564 -1.414664      8.607739 
1 1 1 -27 2  24 o 37.70733 6.200153 19.86796       5.499394 24.41015       6.718557 10.64575       9.573281 41.24520 6.929967 25.87897 10.24025 15.36623       12.36476 
1 1 1 -27 2  25 o 14.46985 6.169056 0.9473798      3.829866 -0.3648115     5.806206 1.958035       5.095599 16.00462 7.179680 16.87911 7.152895 -0.8744888     10.13468 
1 1 1 -27 2  26 o 28.09053 7.077932 11.75679       4.842299 31.49507       10.69004 6.661281       5.431482 42.49652 10.40700 21.50478 7.900365 20.99174       13.06604 
1 1 1 -27 2  27 o 22.79569 6.811246 7.697368       4.073457 6.637668       5.822643 8.713170       5.700765 21.46766 8.121266 23.66542 8.155453 -2.197758      11.50940 
1 1 1 -27 2  28 o 17.40886 6.615659 3.786113       3.874311 0.2190294      5.574142 7.119884       5.388766 15.92082 7.095886 21.79307 7.890092 -5.872248      10.61156 
1 1 1 -27 3  1  o 22.97905 5.195248 7.139112       2.840677 4.683669       3.889210 9.947026       4.158996 19.06442 6.725277 26.62868 6.473087 -7.564257      9.334356 
1 1 1 -27 3  2  o 47.45058 3.347950 28.36370       3.846445 26.68613       4.786266 31.42288       6.463386 45.50045 4.370311 48.62402 5.554243 -3.123569      7.067478 
1 1 1 -27 3  3  o 56.52226 2.987705 39.90923       4.100606 34.51145       5.314618 47.84992       6.446044 51.90338 4.238728 61.08088 4.359294 -9.177502      6.080318 
1 1 1 -27 3  4  o 40.59764 3.508128 20.82973       3.436643 16.56230       4.519055 26.68253       5.292325 35.29032 5.428482 45.27465 4.873504 -9.984329      7.295166 
1 1 1 -27 3  5  o 11.44593 4.921890 0.6405237E-01  2.476475 1.921734       3.614036 -1.580362      3.400262 15.49412 6.237734 11.84547 5.386425 3.648647       8.241535 
1 1 1 -27 3  6  o 30.61027 4.670176 12.23132       3.373526 6.633018       5.576351 15.46300       4.236777 22.40008 8.037058 34.21114 5.249317 -11.81106      9.599460 
1 1 1 -27 3  7  o 26.05806 6.130141 9.308004       3.827159 8.286124       5.319952 10.40415       5.509884 24.28103 7.870031 26.89558 7.892760 -2.614552      11.14599 
1 1 1 -27 3  8  o 36.45225 6.126635 17.93529       5.249444 23.48982       5.973666 -0.8964493     10.99923 41.87423 6.027476 21.45504 9.729148 20.41919       11.44495 
1 1 1 -27 3  9  o 73.00351 3.349730 66.72966       5.943341 63.22651       10.07958 68.59679       7.358670 69.00429 6.055511 73.51555 4.124095 -4.511261      7.326484 
1 1 1 -27 3  10 o 34.50217 4.238664 15.29164       3.488985 17.73198       5.828701 13.92901       4.355472 35.79286 6.932986 32.23259 5.756267 3.560272       9.011154 
1 1 1 -27 3  11 o 27.23381 5.161871 9.846333       3.300373 11.21773       5.518884 9.082853       4.117821 27.96199 7.803758 25.60188 6.568451 2.360107       10.20016 
1 1 1 -27 3  12 o 22.32500 5.607333 6.745889       3.046081 7.554835       5.260466 6.337824       3.736189 23.41630 7.837206 21.55855 6.541451 1.857746       10.20845 
1 1 1 -27 3  13 o 28.69572 5.852016 11.13828       3.953360 14.81135       10.54599 10.53772       4.264324 30.70349 11.04812 27.63250 6.450655 3.070984       12.79343 
1 1 1 -27 3  14 o 18.80505 7.073189 4.050240       4.402432 2.610897       10.90428 4.330544       4.812052 22.97661 10.09690 19.45136 7.377342 3.525255       12.50490 
1 1 1 -27 3  15 o 16.95765 6.740160 2.619610       4.164947 4.484446       6.453453 1.288394       5.452506 20.85835 8.356761 17.26915 7.361599 3.589191       11.13681 
1 1 1 -27 3  16 o 25.67224 6.160085 9.075333       3.804472 12.16640       5.571051 6.374061       5.207957 29.02277 7.736601 21.91819 7.777675 7.104574       10.97029 
1 1 1 -27 3  17 o 59.54170 3.626467 44.76029       5.236928 41.31719       7.571692 47.91788       7.250982 55.84221 5.641365 60.72433 4.942731 -4.882114      7.500373 
1 1 1 -27 3  18 o 26.54873 6.119270 9.726529       3.877752 10.54420       5.705485 9.024565       5.286402 26.82424 8.071696 25.02601 7.815171 1.798235       11.23518 
1 1 1 -27 3  19 o 39.81419 5.126389 20.92187       4.858468 25.96763       6.533257 14.67914       7.266984 43.59199 6.335504 30.87579 9.065267 12.71620       11.05973 
1 1 1 -27 3  20 o 38.33630 4.752300 19.26280       4.344666 24.29042       6.505340 15.21466       5.837363 41.85620 6.595950 32.34634 7.544576 9.509857       10.02134 
1 1 1 -27 3  21 o 23.46692 6.682145 7.829613       4.004660 9.418882       6.007645 6.558696       5.372347 25.15297 8.374411 21.87159 7.883488 3.281385       11.50131 
1 1 1 -27 3  22 o 30.78168 5.973288 13.11153       4.319005 14.06426       6.641198 12.41326       5.685539 30.10991 8.615332 28.75121 7.881338 1.358690       11.67645 
1 1 1 -27 3  23 o 16.49662 6.973542 1.695693       4.823421 1.653149       5.800362 1.791058       8.684334 17.51517 7.532159 20.10455 8.914703 -2.589380      11.67070 
1 1 1 -27 3  24 o 11.83321 5.449493 -1.947273      3.629711 -0.1748913     5.352916 -3.455828      4.938468 15.63863 6.962918 13.09987 6.141177 2.538761       9.284195 
1 1 1 -27 3  25 o 50.38273 3.970908 32.82576       4.835987 34.68827       7.141675 31.24852       6.572020 50.06222 5.971619 47.67563 5.774278 2.386589       8.306775 
1 1 1 -27 3  26 o 36.73142 6.343282 19.18193       5.472692 1.159483       10.48359 25.93293       6.416340 20.56859 9.393425 42.80563 6.342701 -22.23703      11.33430 
1 1 1 -27 3  27 o 12.15444 5.556228 -1.489571      3.679692 -1.221323      5.154156 -1.768423      5.255053 14.54527 6.620938 14.35023 6.589756 0.1950340      9.341398 
1 1 1 -27 3  28 o 23.73854 6.910235 8.466271       4.238420 5.402027       6.670340 10.54122       5.488955 20.55943 8.401534 25.78051 7.949277 -5.221081      11.56619 
1 1 1 -27 4  1  o 22.31267 5.642965 6.834036       3.069788 7.188179       3.793055 6.161692       5.226324 22.63794 6.521500 21.48081 7.771196 1.157133       10.14502 
1 1 1 -27 4  2  f 33.28315 3.762178 14.15843       2.997977 12.35494       4.049024 16.34691       4.460313 30.17642 5.715318 34.98691 5.405500 -4.810490      7.866656 
1 1 1 -27 4  3  o 32.19737 3.807673 13.26036       2.929813 14.55517       4.080665 11.88278       4.209082 33.10024 5.232719 29.43546 6.069578 3.664776       8.013809 
1 1 1 -27 4  4  o 28.40996 4.386917 10.50902       2.939444 13.81736       4.158591 7.205727       4.155413 32.12292 5.510778 22.73314 6.898866 9.389788       8.829667 
1 1 1 -27 4  5  o 32.17206 4.718271 13.52659       3.589233 14.83499       4.152302 9.659755       7.138325 33.45572 5.267046 25.87510 9.112668 7.580622       10.52533 
1 1 1 -27 4  6  o 17.50344 6.109344 3.807864       3.203754 3.426478       4.056673 4.440004       5.222691 17.73884 6.762768 19.84868 7.646492 -2.109840      10.20803 
1 1 1 -27 4  7  o 14.39883 5.652921 1.838922       2.896965 -0.9474466     5.038166 3.215223       3.540870 15.08072 6.732147 16.98685 6.352978 -1.906128      9.256464 
1 1 1 -27 4  8  o 33.08194 4.274505 14.09994       3.365513 17.14577       5.401547 12.16721       4.302788 35.39301 6.502285 29.88175 6.115125 5.511251       8.926055 
1 1 1 -27 4  9  o 45.19389 3.581567 25.77095       3.912241 23.84169       6.307644 26.97714       4.987473 41.96845 6.367103 45.78687 4.529234 -3.818424      7.813704 
1 1 1 -27 4  10 o 89.42457 3.342330 100.0765       7.270718 86.69894       12.11013 107.6165       9.091666 80.66464 6.208421 92.16523 4.057946 -11.50059      7.416968 
1 1 1 -27 4  11 o 26.72531 5.268805 9.526969       3.309374 5.812879       5.746459 11.37005       4.048057 21.65794 8.094595 28.95805 5.935975 -7.300116      10.03784 
1 1 1 -27 4  12 o 25.82195 5.390738 8.941528       3.282419 8.182117       5.596350 9.339784       4.052727 24.19517 8.083286 25.99276 6.433236 -1.797592      10.33083 
1 1 1 -27 4  13 o 13.71077 5.708923 0.9207871      3.158098 0.5663527      6.302415 1.039623       3.649321 17.75709 7.742608 14.62615 6.116975 3.130938       9.867389 
1 1 1 -27 4  14 o 9.394120 4.566194 -5.321822      3.311398 0.000000       0.000000 -5.321822      3.311398 ?        ?        9.394120 4.566194 0.000000       4.566194 
1 1 1 -27 4  15 o 44.52721 4.264450 25.41344       4.570786 26.17699       6.738403 24.76271       6.220724 43.84110 6.504147 42.86956 6.128858 0.9715424      8.936824 
1 1 1 -27 4  16 f 22.22211 6.862539 6.836217       4.088902 6.362708       5.677361 7.346531       5.893875 22.08261 8.083011 23.21302 8.270210 -1.130409      11.56423 
1 1 1 -27 4  17 o 81.59467 3.301306 83.48438       6.550673 87.68844       9.680504 79.93322       8.897099 82.30020 4.848296 78.74493 4.657294 3.555275       6.722824 
1 1 1 -27 4  18 o 45.62463 4.235821 26.74102       4.655701 28.76460       6.954681 25.09776       6.267170 45.91130 6.389008 43.00919 6.154888 2.902107       8.871418 
1 1 1 -27 4  19 o 74.13024 3.820229 69.76775       6.877863 73.14324       9.019496 65.07774       10.63165 74.87784 4.971175 69.16679 6.379479 5.711044       8.087666 
1 1 1 -27 4  20 o 15.41319 6.328539 1.727596       3.807432 0.3942257      5.696904 2.803944       5.118468 16.68355 7.315796 17.95315 7.350739 -1.269596      10.37084 
1 1 1 -27 4  21 o 22.33979 6.680926 7.070991       3.917749 11.66416       5.927077 3.507079       5.220928 27.77098 8.195860 18.62995 7.498305 9.141029       11.10841 
1 1 1 -27 4  22 o 17.39128 7.178084 2.527733       4.931932 1.838177       5.924170 4.084824       8.902246 17.83304 7.639474 21.64282 9.319512 -3.809778      12.05051 
1 1 1 -27 4  23 o 14.41361 6.491875 -0.9781308     4.800461 1.914874       6.010500 -6.074390      7.977408 17.88562 7.679064 15.85709 7.543945 2.028527       10.76472 
1 1 1 -27 4  24 o 15.96110 6.370509 2.492953       3.735852 2.681360       5.729000 2.353566       4.927671 18.10895 7.624599 17.07784 7.122640 1.031111       10.43391 
1 1 1 -27 4  25 o 14.29796 5.976639 1.287464       3.481104 2.648266       5.023772 0.3060025E-01  4.828105 17.36790 7.213430 15.04861 6.661222 2.319290       9.818628 
1 1 1 -27 4  26 o 33.42849 6.401794 16.00685       5.025167 7.354619       10.36306 18.66678       5.745917 23.49240 10.08468 35.80050 6.835423 -12.30810      12.18293 
1 1 1 -27 4  27 o 49.73812 4.127259 32.31569       4.957495 28.69601       7.096076 35.76676       6.928831 44.49230 6.756984 50.87283 5.686189 -6.380527      8.831170 
1 1 1 -27 4  28 o 17.39267 6.829741 3.562527       4.229463 -4.484775      6.630992 9.081838       5.491560 14.65690 6.945364 23.99528 8.007059 -9.338385      10.59958 
1 1 1 -27 5  1  f 15.69639 5.446480 3.054888       2.544317 2.853190       3.494297 3.282498       3.711974 16.33117 6.264019 17.08396 6.479441 -0.7527885     9.012274 
1 1 1 -27 5  2  f 9.004996 4.248251 -2.459009      2.429892 -3.064013      3.301266 -1.743716      3.589582 10.56919 4.975572 12.03378 5.496014 -1.464588      7.413668 
1 1 1 -27 5  3  o 51.52724 3.339826 33.42049       4.171101 28.95418       5.101715 42.42521       7.243964 47.34553 4.474917 56.76798 5.297615 -9.422447      6.934667 
1 1 1 -27 5  4  o 13.51796 5.494286 1.258315       2.834186 -1.023216      3.472290 5.812437       4.905747 12.39514 5.556984 21.06347 7.540594 -8.668337      9.366997 
1 1 1 -27 5  5  o 14.77643 5.457128 2.406077       2.597208 3.965736       3.697095 0.8864137      3.649382 18.06646 6.536100 14.43114 6.081254 3.635322       8.927612 
1 1 1 -27 5  6  o 52.54496 3.050781 34.51258       3.889614 34.67282       5.147172 34.29927       5.938876 52.15382 4.082431 51.44865 4.792001 0.7051620      6.295198 
1 1 1 -27 5  7  o 18.68074 5.513242 4.666809       2.682019 3.320582       3.765757 6.052629       3.820734 17.32752 6.536473 21.09002 6.652294 -3.762505      9.326225 
1 1 1 -27 5  8  o 49.40605 3.412743 30.69736       4.083599 20.73914       6.661648 36.69195       5.168577 38.39641 7.387749 53.74565 3.974433 -15.34924      8.388979 
1 1 1 -27 5  9  o 38.39941 4.629361 19.09963       4.244633 15.99736       11.45744 19.59314       4.569799 31.43891 11.48666 38.73677 4.954280 -7.297861      12.50953 
1 1 1 -27 5  10 f 16.93863 6.040960 3.446145       3.145480 1.022513       5.547311 4.594666       3.818727 17.18756 7.378267 19.04903 6.668503 -1.861467      9.945238 
1 1 1 -27 5  11 o 67.96584 2.984259 57.56528       4.930641 50.83545       7.926299 61.81325       6.297365 62.41650 5.260073 70.01744 3.703942 -7.600937      6.433316 
1 1 1 -27 5  12 o 31.08169 4.940207 12.69640       3.616769 4.537046       7.112380 15.54222       4.200408 21.40162 8.701798 34.33524 5.181256 -12.93362      10.12752 
1 1 1 -27 5  13 o 49.66628 3.636437 31.15025       4.370722 46.37205       9.030987 26.49437       4.994627 58.63054 6.426002 45.31431 4.586120 13.31623       7.894681 
1 1 1 -27 5  14 o 53.12326 3.969200 35.86847       5.101209 31.28354       7.463825 39.88750       6.988051 47.93516 6.561603 55.20107 5.258290 -7.265907      8.408582 
1 1 1 -27 5  15 o 21.51996 6.597772 6.362474       3.787842 -0.3010864     10.52636 7.353669       4.059797 21.17674 9.568660 22.97438 6.783801 -1.797642      11.72942 
1 1 1 -27 5  16 f 24.03017 6.534562 8.060821       3.926696 10.56129       5.942951 6.123377       5.231254 26.82553 8.271491 21.58522 7.779406 5.240318       11.35503 
1 1 1 -27 5  17 o 16.39958 6.374950 2.705920       3.654561 8.938436       5.812570 -1.368467      4.699672 24.88224 8.235828 14.21445 6.410872 10.66779       10.43686 
1 1 1 -27 5  18 o 17.67007 6.800606 3.398896       4.128262 5.240760       5.672029 1.324121       6.019982 20.80298 7.980348 17.79268 7.662704 3.010305       11.06359 
1 1 1 -27 5  19 o 25.41165 6.420856 9.078708       3.977043 3.801547       5.818161 13.70705       5.448770 19.49511 7.890919 30.78010 7.363285 -11.28499      10.79280 
1 1 1 -27 5  20 o 26.91423 6.862636 10.37599       4.514179 7.731099       5.886616 14.15177       7.033396 23.29725 8.268735 30.14780 8.935964 -6.850546      12.17470 
1 1 1 -27 5  21 o 23.89114 6.468422 8.107918       3.857579 10.16837       5.819921 6.493359       5.151846 25.96208 8.212994 21.65772 7.730358 4.304354       11.27882 
1 1 1 -27 5  22 o 23.90413 7.596663 8.421144       4.974255 13.20076       5.928205 -2.949854      9.143785 29.47271 8.035066 18.29616 8.503649 11.17656       11.69933 
1 1 1 -27 5  23 o 20.80216 6.726555 6.133977       3.887712 3.083776       5.714680 8.761861       5.304332 18.48133 7.686153 24.14905 7.860804 -5.667713      10.99405 
1 1 1 -27 5  24 o 20.66492 6.569973 6.086851       3.720248 4.667491       5.466555 7.311330       5.077421 19.60782 7.744620 22.30474 7.696242 -2.696924      10.91839 
1 1 1 -27 5  25 o 26.98614 6.083436 10.36585       3.904664 4.617512       5.783466 15.18077       5.293116 19.67137 7.900810 32.15744 6.957030 -12.48607      10.52725 
1 1 1 -27 5  26 o 19.90373 7.259015 5.502746       4.572649 8.686422       10.15125 4.692315       5.121690 24.14651 10.15698 19.27384 7.531231 4.872679       12.64451 
1 1 1 -27 5  27 o 8.880197 4.415939 -8.274882      3.732407 -13.59772      6.548592 -5.713792      4.542435 11.61953 5.789709 11.27480 5.448740 0.3447371      7.950440 
1 1 1 -27 5  28 o 27.66670 6.162704 11.05569       4.048408 10.99035       6.006723 11.11007       5.480078 25.99686 8.357103 26.46423 7.898495 -0.4673691     11.49902 
1 1 1 -27 6  1  o 24.55997 6.549810 8.548738       3.991866 1.878177       5.739655 14.79823       5.555547 17.78907 7.567063 31.99148 7.289279 -14.20241      10.50686 
1 1 1 -27 6  2  f 25.00846 5.307938 8.471995       3.134615 7.988692       3.847942 9.425417       5.404569 23.82813 6.464136 25.35231 7.899728 -1.524181      10.20739 
1 1 1 -27 6  3  o 14.85636 5.453434 2.492688       2.587154 3.674476       3.517818 1.100468       3.818189 17.46404 6.367288 14.83958 6.234885 2.624459       8.911574 
1 1 1 -27 6  4  o 20.40513 5.523061 5.664364       2.812872 3.839164       3.980597 7.484812       3.975412 18.08384 6.741366 23.11015 6.682176 -5.026308      9.491970 
1 1 1 -27 6  5  o 29.49369 4.278540 11.28590       2.985440 10.56235       4.122577 12.08376       4.329089 27.62996 6.267380 29.63677 6.193991 -2.006819      8.811673 
1 1 1 -27 6  6  o 20.53287 5.398977 5.707136       2.736794 3.133532       3.910710 8.177324       3.831332 17.21144 6.620316 24.25241 6.393254 -7.040966      9.203383 
1 1 1 -27 6  7  o 49.71003 3.148864 30.95700       3.794864 26.65018       4.956890 37.05571       5.898614 45.44000 4.537051 53.63060 4.556468 -8.190601      6.430104 
1 1 1 -27 6  8  o 33.55796 4.493334 14.60733       3.582259 13.51948       6.162122 15.16264       4.402627 30.37395 8.154559 33.68867 5.556340 -3.314728      9.867611 
1 1 1 -27 6  9  o 62.61174 3.138295 49.01484       4.773082 39.83672       7.842846 54.41401       6.015345 54.62075 5.990401 65.60805 3.778402 -10.98730      7.082459 
1 1 1 -27 6  10 f 52.27792 3.325839 34.31112       4.215004 32.83697       7.315341 35.04375       5.157116 49.39376 6.214779 52.45846 4.065899 -3.064701      7.426642 
1 1 1 -27 6  11 f 23.61954 6.618907 7.757843       3.961568 0.000000       0.000000 7.757843       3.961568 ?        ?        23.61954 6.618907 0.000000       6.618907 
1 1 1 -27 6  12 o 11.57429 5.254891 -1.465544      3.220615 -1.467829      6.622149 -1.464837      3.685886 16.83584 7.600011 12.47684 5.647515 4.358998       9.468611 
1 1 1 -27 6  13 o 29.74224 5.849094 11.99470       4.088202 13.55834       6.254552 10.82833       5.401894 30.35740 8.243738 27.37716 7.749167 2.980242       11.31410 
1 1 1 -27 6  14 o 17.79106 6.131693 4.009152       3.222565 -5.883698      5.605224 8.893549       3.938563 13.19541 6.290556 25.30060 6.388021 -12.10519      8.965372 
1 1 1 -27 6  15 o 64.14165 3.514127 51.83181       5.471814 26.46015       12.05516 58.41533       6.140836 39.21824 11.71721 67.96989 3.721648 -28.75165      12.29405 
1 1 1 -27 6  16 o 29.47272 4.984035 11.50810       3.452141 3.147066       6.035646 15.57312       4.208478 19.25447 7.943301 34.26936 5.202735 -15.01488      9.495498 
1 1 1 -27 6  17 o 64.94401 3.537353 53.23022       5.577132 54.26190       8.368322 52.40581       7.480632 64.12815 5.405202 63.46791 4.873985 0.6602364      7.278183 
1 1 1 -27 6  18 o 53.87627 3.831368 36.95416       4.997403 36.83686       7.514939 37.04716       6.691334 52.20877 6.016617 52.96935 5.252970 -0.7605820     7.987075 
1 1 1 -27 6  19 o 17.94584 6.861198 3.663723       4.183308 4.592207       5.634147 2.522960       6.245092 20.03170 7.877674 18.79230 7.939028 1.239403       11.18418 
1 1 1 -27 6  20 o 36.94663 5.395472 18.33857       4.714536 15.18641       6.097889 23.02271       7.433448 31.93419 7.883892 39.45267 8.005701 -7.518486      11.23597 
1 1 1 -27 6  21 o 24.92948 7.248826 9.097131       4.666277 9.130860       5.638036 9.023787       8.313995 24.71447 8.108047 24.80310 9.622634 -0.8863258E-01 12.58314 
1 1 1 -27 6  22 o 30.05396 5.691766 12.44451       4.015970 12.93507       5.969440 12.03890       5.427973 29.04285 8.119954 28.30046 7.677423 0.7423897      11.17481 
1 1 1 -27 6  23 o 20.37209 6.741660 5.855835       3.894876 9.168027       5.879362 3.265406       5.199461 24.47260 8.285850 18.15722 7.418473 6.315376       11.12156 
1 1 1 -27 6  24 o 31.48753 5.503692 13.64270       4.069418 11.49675       5.871185 15.62684       5.645500 27.08523 8.196341 32.39814 7.323374 -5.312914      10.99144 
1 1 1 -27 6  25 o 17.89051 6.512229 4.178029       3.677676 -1.307522      5.258375 9.430609       5.145502 14.68631 6.686072 24.78579 7.705679 -10.09948      10.20201 
1 1 1 -27 6  26 o 15.99555 6.422638 2.558376       3.820694 -7.507082      5.597359 11.33953       5.228078 12.18355 5.925375 27.09274 7.607792 -14.90920      9.643058 
1 1 1 -27 6  27 o 33.19939 7.272867 16.63109       5.720894 0.000000       0.000000 16.63109       5.720894 ?        ?        33.19939 7.272867 0.000000       7.272867 
1 1 1 -27 7  1  o 16.13310 5.750004 3.192327       2.849338 1.862186       3.933906 4.660208       4.132575 15.67163 6.433517 19.05787 6.908161 -3.386238      9.439959 
1 1 1 -27 7  2  o 10.21893 4.744764 -2.082183      2.835723 -2.669032      4.322379 -1.638732      3.757357 12.69318 5.881253 12.38667 5.644039 0.3065157      8.151339 
1 1 1 -27 7  3  o 30.26670 4.313274 11.93082       3.091411 8.243997       4.295996 15.89028       4.452008 24.05269 6.943875 34.37962 5.499212 -10.32693      8.857694 
1 1 1 -27 7  4  o 17.38775 5.594044 3.976468       2.691027 -0.5559340E-01 3.632122 8.883245       4.006775 13.46785 5.874988 25.14751 6.493505 -11.67967      8.756774 
1 1 1 -27 7  5  o 58.10186 2.997311 42.20628       4.229485 37.70450       5.425560 49.17971       6.752673 54.28793 4.132189 61.75869 4.518111 -7.470757      6.122770 
1 1 1 -27 7  6  o 69.27075 2.857090 59.78808       4.812568 52.85669       6.169820 70.55809       7.690784 64.47947 3.945473 74.27273 4.267141 -9.793259      5.811648 
1 1 1 -27 7  7  o 21.40144 5.395471 6.209623       2.812718 5.320391       3.902106 7.171348       4.058043 20.01110 6.750352 22.67540 6.803730 -2.664305      9.584257 
1 1 1 -27 7  8  o 32.11220 5.055383 13.62192       3.825394 13.08209       5.926135 14.00755       5.008701 29.91022 7.982145 31.71268 6.691875 -1.802456      10.41613 
1 1 1 -27 7  9  o 73.01508 3.568948 67.15500       6.330984 52.16251       10.93131 74.72209       7.766045 61.03377 7.507643 76.56985 4.177866 -15.53608      8.591813 
1 1 1 -27 7  10 o 52.67710 3.678787 35.09467       4.692718 41.36079       9.718932 33.18968       5.358776 54.25557 7.555551 50.84348 4.367354 3.412090       8.726977 
1 1 1 -27 7  11 o 14.14642 6.071889 0.4109910      3.755812 9.156467       5.954212 -5.368165      4.840216 25.21574 8.335155 12.21509 5.829404 13.00065       10.17137 
1 1 1 -27 7  12 o 16.73878 6.821064 2.209305       4.381790 2.383017       9.696732 2.164731       4.911895 21.82398 9.557902 17.31367 7.156456 4.510311       11.94020 
1 1 1 -27 7  13 o 44.83140 3.744601 25.50960       4.053617 24.02993       6.802606 26.32431       5.047684 41.57824 6.959633 45.06205 4.664033 -3.483807      8.377929 
1 1 1 -27 7  14 o 15.41194 5.981215 2.325553       3.212999 1.087068       5.616281 2.928088       3.917368 17.21823 7.408157 16.95739 6.597827 0.2608376      9.920288 
1 1 1 -27 7  15 o 60.14389 3.668405 45.76640       5.350992 38.12217       8.017729 51.90590       7.185394 52.98243 6.335308 63.33987 4.688428 -10.35744      7.881464 
1 1 1 -27 7  16 o 32.45026 5.372374 14.08757       4.099831 7.280084       10.38211 15.34526       4.462513 24.83409 10.34660 33.76006 5.621867 -8.925966      11.77530 
1 1 1 -27 7  17 o 43.92714 4.301277 24.89832       4.545380 29.24841       6.800536 21.38578       6.110902 46.35748 6.173172 39.24668 6.625101 7.110802       9.055386 
1 1 1 -27 7  18 o 29.91964 5.898664 12.29272       4.147832 12.72705       6.067839 11.91175       5.682905 29.09331 8.205391 28.30475 7.925977 0.7885590      11.40831 
1 1 1 -27 7  19 o 25.11320 6.340741 8.892806       3.880462 9.870868       5.795006 8.097754       5.224787 25.68492 8.203627 23.62160 7.807918 2.063314       11.32533 
1 1 1 -27 7  20 o 25.49100 8.166209 9.777333       5.738994 9.777333       5.738994 0.000000       0.000000 25.49100 8.166209 ?        ?        0.000000       8.166209 
1 1 1 -27 7  21 o 14.14450 6.216740 -0.5277678E-01 4.135350 -2.828143      5.373019 3.980280       6.477022 14.13503 6.552051 19.89270 8.219752 -5.757667      10.51160 
1 1 1 -27 7  22 o 13.78513 5.906347 0.6211673      3.542156 1.502571       4.967687 -0.2904481     5.052109 16.44250 7.018472 15.19776 6.765671 1.244739       9.748500 
1 1 1 -27 7  23 o 15.19628 6.167420 1.998349       3.565109 -0.9662131E-01 5.277349 3.757024       4.835259 15.55970 6.921545 18.28793 7.264454 -2.728231      10.03395 
1 1 1 -27 7  24 o 20.37858 6.474824 5.927210       3.613754 9.699049       5.532998 3.121304       4.772220 25.01443 8.018793 17.55562 7.131648 7.458813       10.73133 
1 1 1 -27 7  25 o 42.15426 4.329058 23.35913       4.383913 19.16376       6.589584 26.69040       5.871877 35.34096 7.855092 44.06213 5.594543 -8.721169      9.643723 
1 1 1 -27 7  26 o 25.52687 6.581986 9.602364       4.120731 19.47816       7.495688 5.324960       4.933050 34.40766 8.879933 19.76612 7.475717 14.64154       11.60774 
1 1 1 -27 7  27 o 20.59242 7.100161 6.201480       4.321089 0.8148109      10.06043 7.420020       4.784939 19.86819 9.121486 22.12831 7.475059 -2.260117      11.79313 
1 1 1 -27 8  1  o 33.80492 4.044102 14.79472       3.265462 17.16041       4.502861 12.17043       4.742581 35.71271 5.337551 29.12571 6.805202 6.587000       8.648713 
1 1 1 -27 8  2  o 48.75418 3.492798 30.14355       4.122252 31.78600       5.497682 28.03419       6.230298 49.36176 4.624219 45.54420 5.740856 3.817558       7.371623 
1 1 1 -27 8  3  f 46.88957 3.589272 27.92125       4.070097 30.01574       6.444264 26.53131       5.249657 47.22459 5.715940 44.95124 4.870104 2.273357       7.509320 
1 1 1 -27 8  4  o 43.78844 3.502760 24.29876       3.706570 20.25474       4.679325 31.10967       6.072662 39.17065 5.017193 48.50495 5.219612 -9.334301      7.239929 
1 1 1 -27 8  5  o 66.75098 2.900530 55.62965       4.706882 51.18053       6.017956 62.63972       7.553934 63.39722 3.914406 69.71011 4.470295 -6.312897      5.941895 
1 1 1 -27 8  6  o 60.40979 3.428542 45.99146       5.026507 43.57282       7.428535 48.03405       6.826653 57.44012 5.369247 60.92139 4.633093 -3.481274      7.091852 
1 1 1 -27 8  7  f 34.16011 4.705356 15.26987       3.813007 19.47080       7.134727 13.59032       4.511297 36.33280 8.247572 31.48676 6.099813 4.846039       10.25818 
1 1 1 -27 8  8  o 83.51340 3.490792 87.80366       7.088551 85.96379       12.02191 88.78425       8.776553 79.90647 6.222871 83.25446 4.340934 -3.347984      7.587347 
1 1 1 -27 8  9  o 19.96003 6.670966 5.321737       3.811537 7.647100       5.640616 3.367722       5.170650 23.39502 8.109941 18.65509 7.478110 4.739927       11.03147 
1 1 1 -27 8  10 o 19.92260 6.700854 5.284202       3.845166 2.815433       5.947430 7.057271       5.040247 18.91017 7.850821 22.58170 7.671547 -3.671532      10.97670 
1 1 1 -27 8  11 o 15.05585 5.951612 2.026967       3.230796 3.384311       5.823487 1.423429       3.883204 19.26769 7.859042 15.28684 6.344900 3.980857       10.10061 
1 1 1 -27 8  12 o 26.14453 5.729497 9.323958       3.549317 3.255363       6.377348 12.04722       4.272097 19.64246 8.139997 29.60811 6.123246 -9.965652      10.18596 
1 1 1 -27 8  13 o 14.58515 5.851284 1.720542       3.168289 2.352145       5.650115 1.430853       3.826497 18.21687 7.614470 15.20340 6.303288 3.013474       9.884917 
1 1 1 -27 8  14 o 46.36405 3.745295 27.31711       4.195602 18.47861       6.991067 32.29233       5.245179 35.33625 8.266552 50.09053 4.339806 -14.75429      9.336477 
1 1 1 -27 8  15 o 20.54791 6.050457 5.796496       3.233236 6.665400       5.840374 5.412522       3.882451 22.31325 8.193187 20.06561 6.733130 2.247633       10.60487 
1 1 1 -27 8  16 o 11.39113 5.239699 -1.953807      3.341723 -13.46552      9.482174 -0.3212794     3.570822 15.40662 7.540384 13.11411 5.769898 2.292505       9.494689 
1 1 1 -27 8  17 o 32.97095 4.659681 14.28328       3.639663 8.066627       5.921839 18.05730       4.614027 23.70063 8.303657 36.76814 5.302651 -13.06750      9.852351 
1 1 1 -27 8  18 o 31.24094 5.771265 13.35246       4.231896 11.95514       6.099261 14.64959       5.876559 28.05955 8.322536 31.49149 7.718585 -3.431942      11.35082 
1 1 1 -27 8  19 o 27.02487 7.424312 10.76087       5.038978 8.248583       6.113446 16.08430       8.899121 23.76333 8.427292 30.96556 10.18797 -7.202229      13.22173 
1 1 1 -27 8  20 o 30.13638 5.806523 12.53664       4.109615 19.37923       5.983395 6.426033       5.654304 36.81863 6.922797 21.66356 8.042509 15.15507       10.61165 
1 1 1 -27 8  21 o 15.13508 6.407950 1.221746       4.083238 0.5677092      5.398557 2.096106       6.241968 16.24583 7.122818 18.21302 7.822674 -1.967190      10.57964 
1 1 1 -27 8  22 o 15.05895 6.400579 1.166011       4.100775 3.212392       5.469328 -1.461471      6.197416 18.31796 7.559655 15.84500 7.230890 2.472955       10.46108 
1 1 1 -27 8  23 o 20.53626 6.660127 6.023106       3.809634 5.394902       5.476626 6.612076       5.302847 20.27179 7.824710 21.48305 7.819847 -1.211262      11.06237 
1 1 1 -27 8  24 f 23.27528 6.666566 7.949087       3.974583 11.01049       6.065035 5.644750       5.261943 26.28604 8.392254 20.35797 7.716043 5.928066       11.40032 
1 1 1 -27 8  25 o 13.97364 6.018790 0.6794622      3.715037 -4.707697      6.736691 3.033716       4.453417 14.75602 6.994730 17.09758 6.909735 -2.341563      9.832125 
1 1 1 -27 8  26 o 27.52439 6.241456 10.96452       4.089638 0.7196874E-01  6.261858 19.06652       5.400509 16.55999 7.440246 36.48888 6.301219 -19.92890      9.750007 
1 1 1 -27 9  1  o 40.99810 3.499714 21.41908       3.463090 20.15736       4.811705 22.77504       4.988158 38.75552 5.228041 41.34226 5.056304 -2.586735      7.273144 
1 1 1 -27 9  2  o 79.11637 3.021569 78.51167       5.814816 69.84460       7.555178 91.10593       9.107419 73.61281 4.229482 83.83171 4.474318 -10.21890      6.156951 
1 1 1 -27 9  3  o 16.38202 5.689836 3.387213       2.777078 1.585345       3.680743 5.768466       4.231328 15.05222 6.205719 20.52444 7.027833 -5.472211      9.375574 
1 1 1 -27 9  4  o 46.46599 3.876372 27.61453       4.349364 22.86967       6.090259 32.55328       6.213449 40.69883 6.347752 49.55942 5.223281 -8.860596      8.220500 
1 1 1 -27 9  5  o 41.48907 3.794879 21.98495       3.794345 21.78864       5.027788 22.24469       5.783189 40.50478 5.214561 40.37209 6.065629 0.1326942      7.998970 
1 1 1 -27 9  6  o 50.60864 3.166250 32.18868       3.885299 30.76171       5.611881 33.50234       5.384458 48.52226 4.809248 50.94081 4.379989 -2.418549      6.504858 
1 1 1 -27 9  7  o 44.83102 4.232373 25.87617       4.569068 30.31396       6.928562 22.46114       6.077950 47.21502 6.169224 40.41759 6.382543 6.797432       8.876721 
1 1 1 -27 9  8  o 23.97865 6.496330 8.073812       3.889435 5.436728       5.835655 10.18152       5.217149 21.06886 8.091502 26.42552 7.659198 -5.356665      11.14162 
1 1 1 -27 9  9  o 67.25577 3.897270 57.52274       6.360071 48.98038       7.977160 72.42674       10.53685 60.85477 5.436391 73.54052 5.929841 -12.68575      8.044709 
1 1 1 -27 9  10 o 15.91673 6.078987 2.677542       3.281580 2.789428       5.762771 2.623850       3.992047 18.65355 7.734699 16.65447 6.605506 1.999073       10.17144 
1 1 1 -27 9  11 o 25.05733 5.732994 8.600946       3.424636 12.98683       6.162714 6.641461       4.119214 29.50843 8.250443 21.84551 6.909407 7.662920       10.76149 
1 1 1 -27 9  12 o 10.34608 4.865058 -2.889557      3.140558 -10.72881      5.729525 0.4773736      3.754901 11.55159 5.694705 14.15281 6.072832 -2.601220      8.325200 
1 1 1 -27 9  13 f 18.34840 6.234895 4.389290       3.329255 7.044972       5.877876 3.134876       4.039734 22.70864 8.237738 17.26572 6.705037 5.442928       10.62157 
1 1 1 -27 9  14 o 44.39922 3.772237 25.11510       4.042808 20.95397       6.994155 27.20299       4.954313 37.94327 7.824223 45.81127 4.495709 -7.868004      9.023850 
1 1 1 -27 9  15 o 50.51447 4.033431 32.69305       4.923870 6.492370       11.40255 38.69854       5.459084 24.59570 10.56865 54.93252 4.107810 -30.33683      11.33889 
1 1 1 -27 9  16 o 23.88224 6.389813 8.040034       3.791567 -10.31088      10.32043 10.90335       4.076650 17.03871 8.229033 27.98742 6.145898 -10.94872      10.27079 
1 1 1 -27 9  17 o 32.50866 4.625162 13.90689       3.560803 6.627368       5.804270 18.29995       4.508999 22.05974 8.156032 37.07077 5.128507 -15.01104      9.634440 
1 1 1 -27 9  18 o 63.31411 3.626427 50.95251       5.571796 39.72453       7.814672 62.56222       7.946400 53.93568 6.049790 69.18671 4.741824 -15.25103      7.686667 
1 1 1 -27 9  19 f 16.27987 6.453824 2.620605       3.809086 7.116794       5.537446 -1.417720      5.247929 22.36737 8.010919 14.78976 6.712059 7.577614       10.45115 
1 1 1 -27 9  20 o 17.27438 6.574496 3.490695       3.829835 5.429458       5.715345 1.910643       5.159600 20.60678 7.982781 17.01336 7.203187 3.593412       10.75224 
1 1 1 -27 9  21 o 10.37329 5.020786 -5.403354      3.894210 -5.607454      4.951564 -5.072431      6.304979 12.07539 5.798230 14.22532 6.750078 -2.149934      8.898484 
1 1 1 -27 9  22 f 13.56967 5.899130 0.2845517      3.635563 3.136756       5.499515 -1.929447      4.845323 18.22953 7.557163 13.78386 6.328925 4.445674       9.857282 
1 1 1 -27 9  23 o 17.18559 6.513509 3.582469       3.749569 5.535188       5.509609 1.897827       5.117463 20.37164 7.852207 16.79093 7.143912 3.580708       10.61568 
1 1 1 -27 9  24 o 30.61815 7.285145 14.11331       5.356450 17.92947       7.672690 10.48518       7.481265 32.68879 9.229493 25.25990 9.273357 7.428886       13.08353 
1 1 1 -27 9  25 o 15.79670 6.430267 2.333217       3.889091 3.504463       7.141518 1.839432       4.636979 19.49204 8.369632 16.13043 6.828971 3.361609       10.80211 
1 1 1 -27 9  26 o 20.36056 6.707631 6.037266       3.857070 5.573659       5.991636 6.365342       5.040325 20.38447 8.090035 20.87966 7.620231 -0.4951935     11.11380 
1 1 1 -27 10 1  o 34.99261 3.922849 15.85365       3.287618 14.75118       4.353918 17.31606       5.014544 32.74706 5.660675 35.26027 6.053917 -2.513203      8.288133 
1 1 1 -27 10 2  o 24.33329 5.078989 8.051575       2.914260 5.639130       3.835274 11.34748       4.482855 20.13059 6.690833 28.09763 6.650992 -7.967043      9.434137 
1 1 1 -27 10 3  o 22.96401 5.242531 7.211896       2.869009 7.190863       3.893114 7.236896       4.244389 22.44616 6.647008 22.44844 7.001557 -0.2277374E-02 9.654249 
1 1 1 -27 10 4  o 24.46035 5.711327 8.278652       3.342280 8.144914       5.207181 8.372354       4.358613 23.62099 7.794206 24.07617 7.007246 -0.4551849     10.48099 
1 1 1 -27 10 5  f 64.70909 3.868546 53.43129       6.072422 55.11450       7.625090 50.51290       10.04030 64.89420 4.856965 59.97059 7.001847 4.923607       8.521501 
1 1 1 -27 10 6  o 12.38903 5.560233 -0.9796281     3.486641 -0.6992668     5.015345 -1.241862      4.850496 15.03167 6.713111 14.43042 6.510180 0.6012440      9.351379 
1 1 1 -27 10 7  o 25.70589 6.346519 9.283681       3.951444 7.830571       5.784295 10.55518       5.410759 23.42524 8.206695 26.72053 7.815964 -3.295286      11.33310 
1 1 1 -27 10 8  o 56.98408 3.777429 41.30887       5.215879 38.27716       7.353000 44.37943       7.399958 53.40868 5.739545 57.92120 5.301436 -4.512520      7.813296 
1 1 1 -27 10 9  o 24.77844 6.184650 8.569813       3.722456 11.19430       5.777075 6.706566       4.867666 27.41138 8.091941 21.97886 7.537416 5.432518       11.05858 
1 1 1 -27 10 10 o 21.80443 6.324459 6.625968       3.556052 7.734092       5.771032 5.947688       4.515062 23.36570 8.196421 20.94326 7.256038 2.422443       10.94675 
1 1 1 -27 10 11 o 14.06903 5.780824 1.302223       3.179873 6.732969       5.591634 -1.293574      3.865844 22.22106 8.038314 12.84776 5.802599 9.373299       9.913861 
1 1 1 -27 10 12 o 22.28761 6.096828 6.912551       3.406426 0.3397202      5.873969 10.24312       4.181335 16.86559 7.411077 26.99005 6.446215 -10.12446      9.822309 
1 1 1 -27 10 13 o 24.56022 5.888240 8.355020       3.478412 2.129833       5.826287 11.80278       4.335949 18.08818 7.656161 29.07598 6.301705 -10.98780      9.916062 
1 1 1 -27 10 14 o 41.79538 3.971187 22.42561       3.996149 15.78704       6.675472 26.13329       4.988797 32.24770 8.409117 44.74220 4.642961 -12.49450      9.605744 
1 1 1 -27 10 15 o 29.56226 5.149715 11.73178       3.575108 2.466602       5.984609 16.87292       4.457988 18.45012 7.781894 35.46952 5.321610 -17.01939      9.427482 
1 1 1 -27 10 16 o 20.57418 6.346723 5.894899       3.498456 -1.244015      10.19235 6.848303       3.724747 19.98415 9.177070 22.01690 6.497002 -2.032751      11.24409 
1 1 1 -27 10 17 o 32.82912 6.480464 15.18277       5.000324 6.627138       10.82874 17.50146       5.637327 24.05450 10.31707 35.04290 6.847029 -10.98840      12.38240 
1 1 1 -27 10 18 o 11.88145 5.222126 -0.2696887     2.918018 -1.913039      5.448041 0.3914009      3.455457 14.75497 6.750961 13.46837 5.802967 1.286599       8.902242 
1 1 1 -27 10 19 o 42.01456 3.793963 22.68386       3.842633 14.35984       6.399358 27.37763       4.805418 30.37936 8.374898 45.82120 4.355896 -15.44184      9.439955 
1 1 1 -27 10 20 f 13.23448 5.784586 0.5560353E-01  3.536264 -0.5541366     5.286926 0.5492392      4.757010 15.29185 6.856205 15.40014 6.720586 -0.1082850     9.600720 
1 1 1 -27 10 21 o 24.06267 7.249422 8.640085       4.600232 6.675487       5.942350 11.57838       7.267232 21.73958 8.208756 26.60704 9.206247 -4.867458      12.33445 
1 1 1 -27 10 22 o 14.23793 6.051627 0.9830132      3.665837 5.954200       5.734230 -2.452904      4.767233 20.88600 8.020979 13.33012 6.176414 7.555876       10.12345 
1 1 1 -27 10 23 o 22.98269 6.876176 7.822556       4.149401 -0.5207111     6.707426 12.99504       5.281259 16.77782 7.603940 29.27007 7.400997 -12.49225      10.61106 
1 1 1 -27 10 24 o 11.12294 5.283329 -3.712767      3.881955 3.674174       6.330145 -8.165283      4.914554 19.09098 8.024971 10.92262 5.362764 8.168352       9.651912 
1 1 1 -27 10 25 o 21.74622 7.239904 7.083159       4.490164 6.036310       6.280378 8.177786       6.422095 20.92770 8.290011 22.93676 8.560300 -2.009062      11.91650 
1 1 1 -27 11 1  o 17.69007 5.831645 4.243568       2.915254 5.392433       3.472589 1.501043       5.365305 19.60410 6.358757 16.79440 7.233429 2.809700       9.631006 
1 1 1 -27 11 2  o 14.53607 5.668993 2.121149       2.897427 6.046184       3.529703 -5.987429      5.073279 20.65452 6.375615 12.10625 5.827427 8.548265       8.637556 
1 1 1 -27 11 3  o 17.59576 5.836454 4.142774       2.918692 2.972315       3.484038 6.897338       5.344798 16.31913 6.255975 21.99139 7.871026 -5.672253      10.05437 
1 1 1 -27 11 4  o 20.28808 5.775991 5.724015       2.992429 8.565285       3.582572 -0.8330035     5.442419 24.68360 6.012435 15.39830 6.925827 9.285296       9.171502 
1 1 1 -27 11 5  o 30.91087 4.548877 12.60105       3.324140 8.213429       4.606138 17.36989       4.802068 23.72666 7.275860 35.66634 5.718165 -11.93968      9.253948 
1 1 1 -27 11 6  o 29.85890 5.280641 12.04893       3.701810 8.448667       5.797936 14.52654       4.809754 23.94623 8.225719 32.19305 6.356579 -8.246819      10.39560 
1 1 1 -27 11 7  o 54.90834 3.378286 38.12485       4.498451 35.68511       7.200747 39.68649       5.760976 51.29678 5.865721 55.41046 4.300099 -4.113682      7.273069 
1 1 1 -27 11 8  f 21.82842 6.059005 6.654706       3.336770 2.301217       5.414770 9.320089       4.236831 17.74609 7.438459 25.52335 6.720590 -7.777260      10.02482 
1 1 1 -27 11 9  o 39.42859 4.110927 20.06707       3.891959 13.67868       6.176712 24.27353       5.012103 30.06395 8.204007 42.93367 4.876868 -12.86972      9.544086 
1 1 1 -27 11 10 o 22.50797 6.349163 7.132778       3.632706 2.032179       5.437220 11.24539       4.882308 17.56137 7.412801 27.83889 7.157379 -10.27752      10.30426 
1 1 1 -27 11 11 o 16.94330 6.099719 3.535267       3.215077 2.145612       5.329682 4.330255       4.031141 17.54075 7.367836 18.59013 6.810014 -1.049379      10.03301 
1 1 1 -27 11 12 o 48.42136 4.208817 30.25623       4.917017 26.76142       7.052812 33.56129       6.858675 43.60539 6.863848 49.86247 5.749732 -6.257080      8.953872 
1 1 1 -27 11 13 o 19.94336 6.320139 5.484060       3.445066 0.1560936E-01  5.679670 8.667072       4.333214 16.33146 7.227154 24.52141 6.940304 -8.189955      10.01996 
1 1 1 -27 11 14 o 37.52923 4.085964 18.20754       3.676540 12.91709       6.175668 21.11189       4.575749 29.07338 8.304396 40.03292 4.785043 -10.95954      9.584343 
1 1 1 -27 11 15 o 24.45744 6.626748 8.568697       4.046911 10.44477       6.175996 7.157039       5.357313 26.12894 8.480439 22.41797 7.894492 3.710966       11.58624 
1 1 1 -27 11 16 o 16.48247 6.432013 2.868045       3.731716 -3.392284      5.504391 8.192762       5.076436 14.02831 6.546039 23.59911 7.690660 -9.570793      10.09935 
1 1 1 -27 11 17 o 16.46169 6.362035 2.962639       3.623820 -2.277867      9.991205 3.756468       3.888612 19.21675 8.916931 17.66331 6.646788 1.553442       11.12167 
1 1 1 -27 11 18 o 29.32010 5.857283 11.96941       4.038494 14.21859       10.93362 11.61407       4.345809 28.38471 11.02863 28.53443 6.407059 -0.1497135     12.75465 
1 1 1 -27 11 19 o 18.03229 6.228127 4.349348       3.325376 1.660111       5.810040 5.659479       4.055290 17.40322 7.511668 20.10783 6.880232 -2.704603      10.18640 
1 1 1 -27 11 20 o 22.10969 6.017563 6.957273       3.328230 13.52916       6.067284 4.128516       3.980587 29.40637 8.173191 18.06008 6.739608 11.34628       10.59355 
1 1 1 -27 11 21 o 15.81485 6.569981 1.952849       4.168913 -0.6645610     5.384136 5.871348       6.587794 15.25822 6.873494 21.16171 8.455115 -5.903494      10.89651 
1 1 1 -27 11 22 o 24.16648 6.708920 8.611142       4.090683 7.503641       6.768466 9.248473       5.134528 22.56384 8.701577 24.51670 7.708770 -1.952864      11.62508 
1 1 1 -27 11 23 o 18.24457 6.819499 4.339059       4.078830 3.883645       6.698836 4.607377       5.141875 19.50164 8.229698 19.14358 7.526495 0.3580627      11.15240 
1 1 1 -27 11 24 o 14.93269 6.123402 1.891621       3.558781 -0.7724209     5.459543 3.859915       4.692787 15.15891 6.866237 18.05808 7.161946 -2.899166      9.921627 
1 1 1 -27 12 1  o 15.71637 5.994856 2.824030       3.188771 1.156387       4.804760 4.136753       4.262915 15.82985 6.831759 18.18548 6.932667 -2.355627      9.733181 
1 1 1 -27 12 2  o 13.76291 5.365694 1.875033       2.595001 0.5733631      3.300355 3.982974       4.199905 13.30184 5.700274 18.02069 6.878477 -4.718844      8.933453 
1 1 1 -27 12 3  o 14.79883 5.466712 2.551158       2.606610 1.884184       3.313545 3.633959       4.221946 14.75583 5.961332 17.68690 6.858460 -2.931070      9.087131 
1 1 1 -27 12 4  o 29.82181 4.265352 11.68496       3.011559 12.17654       3.833628 10.89268       4.866921 29.79116 5.482604 27.08935 7.235678 2.701807       9.078215 
1 1 1 -27 12 5  o 22.20464 6.309900 7.018360       3.574518 1.357862       5.248110 11.91662       4.881988 16.66426 7.165410 28.52013 7.062002 -11.85587      10.06057 
1 1 1 -27 12 6  o 34.69076 5.458817 16.33974       4.462448 14.52963       11.13688 16.68595       4.870534 28.78166 11.14504 34.72886 5.970218 -5.947197      12.64339 
1 1 1 -27 12 7  o 24.39347 5.814405 8.300664       3.407225 1.571975       5.260760 13.16265       4.471878 16.89759 7.217904 30.64529 6.201266 -13.74769      9.515978 
1 1 1 -27 12 8  o 14.01168 5.727946 1.426917       3.101900 3.021572       5.041432 0.4554617      3.934885 17.92897 7.312572 14.28356 6.173511 3.645406       9.570054 
1 1 1 -27 12 9  o 60.33003 3.207309 45.88602       4.698368 40.11254       7.348095 49.87875       6.110707 54.56255 5.606086 62.29869 4.047001 -7.736137      6.914218 
1 1 1 -27 12 10 o 21.40174 6.506921 6.467215       3.694320 4.435928       5.249829 8.459856       5.199649 19.46436 7.619249 23.95265 7.781836 -4.488291      10.89082 
1 1 1 -27 12 11 o 33.61848 4.628036 14.90130       3.691000 10.85593       5.981975 17.38824       4.690276 26.64938 8.312114 35.79528 5.557073 -9.145893      9.998614 
1 1 1 -27 12 12 o 43.73723 3.846227 24.54689       4.057708 14.22455       6.503887 31.12531       5.192122 30.31067 8.476107 48.91726 4.402643 -18.60659      9.551316 
1 1 1 -27 12 13 o 60.80546 4.368251 47.96560       6.429581 38.73615       7.730975 68.66949       11.57904 53.13927 6.079406 69.81400 6.896001 -16.67472      9.193150 
1 1 1 -27 12 14 o 32.25703 5.482782 14.16684       4.155752 11.94238       6.074869 16.12351       5.697505 27.81837 8.319290 33.24265 7.238805 -5.424284      11.02773 
1 1 1 -27 12 15 o 44.19648 3.811130 25.07910       4.064607 18.84998       6.680020 28.74121       5.121892 35.39565 7.940397 46.84656 4.543581 -11.45091      9.148444 
1 1 1 -27 12 16 o 36.26886 4.484426 17.30019       3.879139 9.234893       6.445216 21.88118       4.857430 24.57036 8.658476 40.47571 5.033068 -15.90535      10.01504 
1 1 1 -27 12 17 o 16.46331 6.291264 3.095179       3.516047 12.93805       10.77200 1.921462       3.719780 27.40072 10.85610 15.32514 6.269614 12.07558       12.53647 
1 1 1 -27 12 18 o 34.36107 4.500539 15.60839       3.677993 7.195383       5.920347 20.89616       4.693619 22.27527 8.236919 39.49263 4.988096 -17.21736      9.629535 
1 1 1 -27 12 19 o 24.45591 5.912344 8.476811       3.484307 1.703309       5.972629 11.97135       4.289963 17.52326 7.589789 28.95649 6.262097 -11.43323      9.839652 
1 1 1 -27 12 20 o 11.92899 5.342093 -0.7135101     3.199308 -3.065881      5.720683 0.3570625      3.859251 14.31627 6.678087 13.93897 6.068567 0.3772955      9.023544 
1 1 1 -27 12 21 o 19.01898 6.904724 4.908186       4.130588 -0.4459126     6.992534 7.777791       5.119204 17.09445 7.753966 22.69080 7.731031 -5.596354      10.94956 
1 1 1 -27 12 22 o 20.02404 6.925569 5.734234       4.112405 -5.122042      7.035012 11.36968       5.068604 14.91089 7.091106 27.22862 7.432361 -12.31773      10.27248 
1 1 1 -27 12 23 o 16.64639 6.463746 3.225806       3.753866 3.320948       6.030545 3.165620       4.796418 18.55631 7.818370 17.45915 7.128231 1.097162       10.58010 
1 1 1 -27 13 1  o 14.35101 5.550677 2.197004       2.760058 3.069084       3.531355 0.8279440      4.424606 16.27929 6.283335 15.02637 6.520329 1.252924       9.055108 
1 1 1 -27 13 2  o 11.54690 5.020186 0.4633386E-01  2.633356 -1.147055      3.261259 2.282239       4.463967 11.67116 5.294549 16.39967 6.804469 -4.728510      8.621661 
1 1 1 -27 13 3  o 21.54064 5.392712 6.476212       2.824000 4.568591       3.611075 9.479880       4.531233 18.39506 6.481099 25.18682 7.086215 -6.791767      9.603076 
1 1 1 -27 13 4  o 29.02995 4.551005 11.22667       3.113772 9.538387       3.987417 13.86515       4.984775 25.71103 6.391525 30.83833 6.814837 -5.127298      9.343104 
1 1 1 -27 13 5  o 16.51839 6.075516 3.348874       3.213623 1.675744       4.864671 4.644382       4.280641 16.41324 6.973557 18.89218 7.000688 -2.478941      9.881302 
1 1 1 -27 13 6  o 15.38194 6.389888 1.705642       3.943275 -6.914906      10.52737 3.112548       4.252898 17.88305 8.551462 17.16733 6.815012 0.7157192      10.93489 
1 1 1 -27 13 7  o 16.74133 6.120820 3.460006       3.254084 4.476605       5.247281 2.824721       4.148046 19.35929 7.605681 16.78058 6.707676 2.578707       10.14097 
1 1 1 -27 13 8  o 25.03587 5.894631 8.800282       3.536347 10.81167       5.721794 7.557081       4.498369 26.52227 8.104741 22.74524 7.223645 3.777035       10.85670 
1 1 1 -27 13 9  o 15.61531 6.042243 2.591936       3.271593 -4.368932      5.057093 7.602024       4.290342 12.84146 6.079267 22.85969 7.024241 -10.01822      9.289641 
1 1 1 -27 13 10 o 39.35617 4.060916 20.06854       3.838831 10.00843       6.046609 26.86135       4.968613 25.49651 8.398338 45.24245 4.569189 -19.74594      9.560836 
1 1 1 -27 13 11 o 14.87885 6.278762 1.208254       3.899119 -1.910094      5.133607 5.459852       5.994271 14.28619 6.542773 20.77548 8.138883 -6.489291      10.44267 
1 1 1 -27 13 12 o 34.98580 5.085824 16.42824       4.209109 11.74702       6.080386 20.73556       5.832506 27.49018 8.345746 38.36532 6.468305 -10.87514      10.55890 
1 1 1 -27 13 13 o 46.36011 4.207205 27.91683       4.701365 25.92646       6.976557 29.57259       6.363167 42.50656 6.977033 46.54785 5.730493 -4.041290      9.028706 
1 1 1 -27 13 14 o 18.64199 6.187333 4.748947       3.280044 8.288445       5.675159 2.973534       4.019360 23.52031 8.135684 16.80865 6.640256 6.711658       10.50154 
1 1 1 -27 13 15 o 41.96579 4.069799 22.85700       4.109832 20.96382       6.729876 23.98294       5.190009 37.49431 7.625521 42.25177 5.146719 -4.757458      9.199853 
1 1 1 -27 13 16 o 45.50204 3.836458 26.69049       4.214406 23.60392       7.021492 28.42863       5.269072 39.90535 7.495576 46.32551 4.733908 -6.420162      8.865300 
1 1 1 -27 13 17 o 48.29010 4.193491 30.38411       4.885927 16.94184       11.47097 33.36337       5.400293 29.73321 11.36315 50.42187 4.440351 -20.68866      12.19991 
1 1 1 -27 13 18 o 30.29844 5.309432 12.58372       3.777351 11.98148       6.569063 12.88122       4.617007 27.18582 8.739564 29.85151 6.529035 -2.665686      10.90909 
1 1 1 -27 13 19 o 17.84888 6.228131 4.283283       3.329415 5.325621       5.754707 3.758841       4.081950 20.24608 7.961654 17.62202 6.767446 2.624054       10.44922 
1 1 1 -27 13 20 o 35.65604 4.840356 17.08521       4.097276 13.44494       7.958005 18.39824       4.779429 27.87066 9.634323 36.51445 5.545372 -8.643789      11.11626 
1 1 1 -27 13 21 o 16.63054 6.843609 2.574557       4.465295 3.093147       11.42698 2.481097       4.851002 21.64941 9.856145 16.91436 7.061685 4.735048       12.12481 
1 1 1 -27 13 22 f 12.74932 5.598310 0.3587687E-05  3.346395 5.849824       5.464435 -3.510311      4.232987 20.46319 7.837241 11.81724 5.584682 8.645945       9.623462 
1 1 1 -27 14 1  o 11.80457 5.109601 0.2186642      2.703462 1.433591       3.523220 -1.520931      4.215886 14.35603 6.007631 12.94047 5.927482 1.415563       8.439590 
1 1 1 -27 14 2  f 12.72941 5.610503 -0.9524893E-01 3.390121 -5.544627      5.284997 3.714719       4.419080 12.46252 5.985723 17.69156 6.970796 -5.229031      9.188083 
1 1 1 -27 14 3  o 20.95045 5.454939 6.180839       2.811869 4.934370       3.587699 8.165812       4.527437 18.80971 6.470269 23.23143 7.228984 -4.421713      9.701679 
1 1 1 -27 14 4  o 11.32888 4.910685 0.8366691E-01  2.504261 1.151511       3.145349 -1.765307      4.138857 13.61535 5.685454 12.74391 5.850665 0.8714457      8.158105 
1 1 1 -27 14 5  o 37.62061 4.313284 18.61909       3.882877 19.13370       5.933335 18.23362       5.135174 36.13431 6.990981 36.00038 6.069055 0.1339264      9.257821 
1 1 1 -27 14 6  o 21.92948 6.254598 6.913675       3.505754 5.328008       5.448883 8.033693       4.579458 20.15921 7.798527 23.19660 7.278283 -3.037392      10.66726 
1 1 1 -27 14 7  o 24.16064 6.816851 8.582767       4.187124 34.78325       11.81245 4.817685       4.477879 44.03244 11.03243 19.16077 7.148635 24.87167       13.14601 
1 1 1 -27 14 8  o 18.94997 6.237459 4.974031       3.335564 5.681559       5.196607 4.478278       4.349920 20.46992 7.687855 18.71579 7.032743 1.754124       10.41934 
1 1 1 -27 14 9  o 12.64618 5.607369 -0.4066530     3.435656 4.671921       4.941010 -5.160566      4.780468 19.29087 7.435899 11.98914 5.740998 7.301733       9.394236 
1 1 1 -27 14 10 o 19.92369 6.624017 5.576616       3.758994 3.459208       5.425561 7.531257       5.212857 18.47440 7.566544 22.56982 7.797736 -4.095419      10.86542 
1 1 1 -27 14 11 o 48.39598 4.733913 30.99664       5.511656 23.59480       6.743053 45.89721       9.567274 40.24187 7.137438 56.35336 7.125827 -16.11149      10.08566 
1 1 1 -27 14 12 o 30.85430 4.937225 12.82131       3.587121 5.586166       5.619961 17.79540       4.659794 20.55960 7.928924 36.08360 5.470670 -15.52399      9.633072 
1 1 1 -27 14 13 o 32.20977 4.897162 13.94100       3.722964 13.73134       6.087956 14.06624       4.705336 29.63682 8.167961 31.40027 6.367365 -1.763456      10.35659 
1 1 1 -27 14 14 o 20.96206 6.833889 6.328733       4.008174 4.439741       11.10604 6.611619       4.297830 22.45516 10.01164 21.34709 7.082440 1.108072       12.26352 
1 1 1 -27 14 15 o 42.66126 4.049187 23.66424       4.159168 23.75366       6.756979 23.60969       5.277407 40.26893 7.147444 41.70349 5.313422 -1.434559      8.906088 
1 1 1 -27 14 16 o 17.42485 6.364377 3.897375       3.516899 -0.2274879     5.792119 6.306181       4.426228 16.00867 7.177049 20.91136 7.186967 -4.902689      10.15690 
1 1 1 -27 14 17 o 13.81824 6.036030 0.2563078      3.845231 12.52450       11.13356 -1.405270      4.097360 26.62799 10.86459 12.93553 5.894033 13.69245       12.36037 
1 1 1 -27 14 18 o 12.27179 5.479720 -0.5855565     3.340378 1.977672       6.171688 -1.647536      3.972541 17.79539 7.711419 12.55440 5.751848 5.240986       9.620277 
1 1 1 -27 14 19 o 13.23387 5.790602 0.1391650      3.552065 0.5031586      6.940553 0.9993824E-02  4.134567 17.51485 7.854040 14.00146 6.182515 3.513390       9.995471 
1 1 1 -27 14 20 o 28.75898 6.367091 12.00877       4.344278 19.11240       6.834377 7.192522       5.627473 34.76170 8.201370 21.91220 8.043042 12.84950       11.48708 
1 1 1 -27 14 21 o 29.47579 5.536944 12.14598       3.831150 12.50504       6.572751 11.96121       4.714939 27.39822 8.735270 28.26527 6.905229 -0.8670521     11.13495 
1 1 1 -27 15 1  o 15.17338 5.825029 2.661889       3.023494 0.6122001      3.713523 6.692503       5.207482 13.78028 5.976569 21.07420 7.736815 -7.293927      9.776384 
1 1 1 -27 15 2  o 15.60039 5.822053 2.981816       2.970592 3.419438       3.909746 2.384176       4.568969 16.91214 6.588235 16.43071 6.856061 0.4814281      9.508440 
1 1 1 -27 15 3  o 26.07005 6.015881 9.799902       3.744245 -0.5317784     6.067136 16.15527       4.758483 15.93665 7.226367 33.68066 6.018548 -17.74401      9.404430 
1 1 1 -27 15 4  o 27.16716 5.824411 10.49429       3.740158 7.045630       6.237466 12.43041       4.673567 21.81858 8.368997 28.95417 6.748910 -7.135592      10.75118 
1 1 1 -27 15 5  o 15.22162 6.168591 2.141798       3.560398 4.476902       6.008124 0.8779470      4.420115 19.49648 7.971139 15.06241 6.526577 4.434075       10.30220 
1 1 1 -27 15 6  o 11.89854 5.407254 -1.210860      3.420116 -6.003501      4.897311 3.351923       4.778429 11.72703 5.664912 17.67131 7.151730 -5.944283      9.123511 
1 1 1 -27 15 7  o 43.19673 7.275400 27.63433       7.386642 18.08207       11.95444 33.53381       9.394693 29.89564 11.55485 45.98544 8.702133 -16.08980      14.46519 
1 1 1 -27 15 8  o 15.61305 6.250110 2.399358       3.606802 1.738662       5.158647 3.031222       5.044835 16.65878 7.132462 17.64156 7.268410 -0.9827824     10.18341 
1 1 1 -27 15 9  o 32.04039 5.918597 14.43080       4.450988 14.47282       6.330090 14.38972       6.259795 30.13583 8.337866 30.10106 8.277139 0.3477097E-01  11.74866 
1 1 1 -27 15 10 o 42.13700 4.473660 23.44178       4.523585 13.63540       6.203323 34.57852       6.610725 29.26775 8.310841 50.33653 5.477503 -21.06878      9.953547 
1 1 1 -27 15 11 o 31.13197 5.736657 13.52637       4.191816 6.654708       6.058083 19.83845       5.806184 21.62712 8.259655 37.07901 6.671053 -15.45189      10.61720 
1 1 1 -27 15 12 o 19.23901 6.428464 5.188334       3.539492 5.842515       5.815050 4.803326       4.461072 20.76472 8.049877 19.06580 7.130785 1.698921       10.75400 
1 1 1 -27 15 13 o 25.12942 5.844585 8.949655       3.511280 0.2850399      5.799435 13.96397       4.411812 16.31865 7.257697 31.47528 5.970279 -15.15664      9.397787 
1 1 1 -27 15 14 o 35.88715 4.582095 17.13013       3.915903 13.08405       6.379773 19.57596       4.960218 28.44954 8.529585 37.68542 5.568710 -9.235880      10.18648 
1 1 1 -27 15 15 o 14.26990 5.931116 1.416768       3.399970 4.429677       5.841039 -0.1271939     4.181339 19.44849 7.893872 13.98347 6.193916 5.465020       10.03383 
1 1 1 -27 15 16 o 23.36124 6.048553 7.844763       3.470157 2.222098       5.935714 10.76438       4.277254 17.74104 7.624278 27.12659 6.546024 -9.385551      10.04888 
1 1 1 -27 15 17 o 33.55259 5.292844 15.44736       4.184353 5.105080       7.829023 19.58307       4.950788 20.98819 8.878922 37.63309 5.566112 -16.64490      10.47935 
1 1 1 -27 15 18 o 17.30107 7.103781 2.982779       4.797464 0.000000       0.000000 2.982779       4.797464 ?        ?        17.30107 7.103781 0.000000       7.103781 
1 1 1 -27 15 19 o 38.29050 5.050221 19.91660       4.597572 7.722839       6.910916 29.59796       6.157931 22.55884 8.767272 46.27759 5.572454 -23.71875      10.38833 
1 1 1 -27 15 20 o 19.29192 6.355909 5.316395       3.463159 4.789063       5.853459 5.600395       4.295658 19.59998 7.921494 19.80234 7.059850 -0.2023621     10.61092 
1 1 1 -27 16 1  o 14.96042 5.901009 2.421623       3.169826 6.196041       3.616728 -10.08267      6.582947 20.41543 6.476410 12.46520 6.137180 7.950231       8.922380 
1 1 1 -27 16 2  o 17.59995 6.147388 4.286532       3.244111 4.926500       4.016570 3.085661       5.502052 18.72600 6.807246 17.74957 7.472599 0.9764290      10.10833 
1 1 1 -27 16 3  o 16.29799 6.529848 2.872351       3.940339 5.300107       5.903703 0.9220676      5.291403 19.92558 7.989532 15.96244 7.023401 3.963146       10.63771 
1 1 1 -27 16 4  o 31.60006 6.100118 14.35319       4.527319 2.272370       6.676068 24.63912       6.160193 18.17076 7.944971 41.39838 6.305080 -23.22762      10.14281 
1 1 1 -27 16 5  o 29.10703 5.930851 12.10029       4.063835 5.370810       6.770678 15.88978       5.080799 20.48586 8.428267 32.95365 6.557652 -12.46778      10.67888 
1 1 1 -27 16 6  o 42.38210 4.017031 23.48296       4.099288 25.56815       6.542650 22.13539       5.259663 41.98478 6.613338 39.96058 5.550869 2.024200       8.634141 
1 1 1 -27 16 7  o 28.61522 6.192640 11.80875       4.192701 12.59574       6.083284 11.09666       5.786585 27.86761 8.322928 26.27889 8.171901 1.588720       11.66409 
1 1 1 -27 16 8  o 21.60279 6.301389 6.793840       3.521248 -4.717711      5.715671 13.83558       4.470335 13.43872 6.391188 31.11998 6.112929 -17.68126      8.843935 
1 1 1 -27 16 9  o 13.43272 5.740750 0.7328227      3.330859 -1.677520      5.449109 2.170698       4.208688 14.63150 6.715744 15.97617 6.615944 -1.344672      9.427191 
1 1 1 -27 16 10 o 15.11959 6.126256 2.092123       3.511048 -6.634732      5.433067 8.350134       4.600811 12.26351 5.934409 23.45651 7.285454 -11.19300      9.396545 
1 1 1 -27 16 11 o 14.35112 5.901890 1.616466       3.318218 2.565590       5.546950 1.087549       4.140824 17.62729 7.466148 14.90409 6.385890 2.723207       9.824610 
1 1 1 -27 16 12 o 15.40430 6.355172 1.970370       3.863649 -0.9864662     5.478153 4.896897       5.450005 15.08675 6.851130 19.58819 7.734128 -4.501443      10.33222 
1 1 1 -27 16 13 f 20.78372 6.280165 6.243001       3.448684 -1.841084      5.755937 10.77027       4.307436 14.93073 6.871061 27.06821 6.592319 -12.13749      9.522087 
1 1 1 -27 16 14 o 28.03180 5.493073 10.95938       3.618099 7.266739       6.092390 12.97128       4.496993 22.08427 8.317701 29.94947 6.358435 -7.865200      10.46966 
1 1 1 -27 16 15 o 25.11423 6.461017 9.261047       3.976750 -0.8313280     7.680678 12.95750       4.648312 17.42541 7.988863 29.73928 6.587662 -12.31387      10.35467 
1 1 1 -27 16 16 o 18.73369 6.967503 4.718978       4.247393 1.514364       6.923151 6.653170       5.378556 18.01540 7.975424 21.27043 7.853555 -3.255026      11.19311 
1 1 1 -27 16 17 o 12.17456 5.588131 -1.635982      3.773096 0.5946690      5.927774 -3.155249      4.892073 16.51024 7.340551 13.01996 6.106441 3.490281       9.548420 
1 1 1 -27 16 18 o 39.72392 4.965433 21.37978       4.701989 13.99392       12.26231 22.65295       5.091148 26.83551 11.21729 40.66037 5.261400 -13.82486      12.38992 
1 1 1 -27 17 1  o 23.46787 5.662761 7.977591       3.201015 8.879850       4.232531 6.771902       4.892739 23.94604 6.886052 20.92125 7.525617 3.024788       10.20062 
1 1 1 -27 17 2  o 21.31385 5.917367 6.657054       3.182237 4.765591       3.743681 11.58288       6.041425 18.34811 6.584994 26.15838 8.378475 -7.810270      10.65650 
1 1 1 -27 17 3  o 13.80248 5.516849 1.836896       2.805756 0.1996743      3.652594 4.193494       4.382183 13.29104 5.842089 17.97860 6.983014 -4.687561      9.104530 
1 1 1 -27 17 4  o 25.97637 5.998922 9.806420       3.720775 10.04645       6.111325 9.665038       4.690259 24.57190 8.444942 24.88574 7.276355 -0.3138409     11.14730 
1 1 1 -27 17 5  o 31.97744 6.287776 14.87476       4.725073 17.34904       7.113616 12.92120       6.320925 32.01158 8.831886 27.76701 8.524835 4.244568       12.27497 
1 1 1 -27 17 6  o 23.66186 6.349407 8.271118       3.737035 10.88536       6.542441 7.005121       4.552853 25.44507 8.737994 21.50539 7.291364 3.939678       11.38053 
1 1 1 -27 17 7  o 34.90980 4.642979 16.38499       3.852001 13.38054       5.996284 18.49602       5.026287 28.72238 8.175968 36.13696 5.911915 -7.414579      10.08946 
1 1 1 -27 17 8  o 39.69021 5.056271 21.44452       4.779586 16.55349       11.39735 22.48821       5.264904 28.48887 11.20409 40.27795 5.508126 -11.78908      12.48483 
1 1 1 -27 17 9  o 20.83143 6.460661 6.355379       3.619541 8.264313       6.327157 5.426772       4.412951 22.93591 8.508951 19.60042 7.133738 3.335489       11.10371 
1 1 1 -27 17 10 o 24.65584 6.245778 8.876966       3.756330 2.234240       6.197497 12.73429       4.722655 17.83599 7.728275 29.27767 6.756498 -11.44168      10.26531 
1 1 1 -27 17 11 o 12.02028 5.420390 -0.8650901     3.358066 -5.613082      5.613311 1.781189       4.190655 12.88367 6.182991 15.53415 6.529630 -2.650477      8.992522 
1 1 1 -27 17 12 o 21.18166 6.918167 6.655041       4.106715 7.906847       6.037843 5.577381       5.602144 22.59321 8.324656 20.19626 7.880925 2.396948       11.46337 
1 1 1 -27 17 13 o 18.92517 6.678283 5.020564       3.835283 1.547708       7.400095 6.295995       4.484588 18.36263 8.180582 20.69056 7.227705 -2.327934      10.91612 
1 1 1 -27 17 14 o 20.87100 7.069305 6.445572       4.279687 7.671354       7.379638 5.824405       5.253310 22.52199 8.965321 20.30292 7.706350 2.219070       11.82222 
1 1 1 -27 17 15 o 30.45157 6.157191 13.35429       4.411832 10.85449       6.531516 15.45189       5.983047 25.53234 8.731831 31.32342 7.853669 -5.791080      11.74415 
1 1 1 -27 17 16 o 26.97752 6.052495 10.49986       3.880859 6.592327       6.430331 12.73857       4.867228 21.36668 8.411869 29.08987 6.959468 -7.723190      10.91759 
1 1 1 -27 18 2  o 18.51702 5.830887 4.957305       2.936605 4.443369       3.787756 5.731666       4.649420 17.88887 6.593123 19.68811 7.295943 -1.799236      9.833618 
1 1 1 -27 18 3  o 12.15316 5.480211 -0.7168128     3.432420 -5.012475      5.259566 2.469870       4.530063 12.49729 5.994258 16.29764 6.815595 -3.800357      9.076534 
1 1 1 -27 18 4  o 35.76264 5.805078 18.23432       4.885789 15.82545       7.312908 20.17645       6.566327 29.79677 9.173293 35.67484 7.773324 -5.878073      12.02389 
1 1 1 -27 18 5  o 36.93148 5.666250 19.26324       4.936959 25.59875       7.835861 15.09283       6.357495 39.67609 8.368196 30.08750 8.367831 9.588594       11.83416 
1 1 1 -27 18 6  o 24.43618 6.532891 8.961698       3.965190 8.351596       6.653259 9.297767       4.937962 22.73701 8.662579 24.21081 7.552097 -1.473799      11.49236 
1 1 1 -27 18 7  o 20.42859 6.301426 6.136137       3.448759 9.346674       5.398762 3.922806       4.482585 24.07980 7.935873 17.80261 7.018809 6.277197       10.59442 
1 1 1 -27 18 8  o 13.87478 6.084640 0.3476026      3.941534 -5.739417      11.20181 1.207725       4.210814 18.06799 8.687419 14.95587 6.424401 3.112122       10.80482 
1 1 1 -27 18 9  o 28.89854 5.648144 11.82710       3.834926 13.50378       6.236383 10.80757       4.863056 28.53846 8.402951 26.36833 7.312923 2.170128       11.13950 
1 1 1 -27 18 10 o 16.24782 6.291577 3.115831       3.549100 -1.813692      5.909265 5.897357       4.438871 14.98631 6.920067 20.09684 7.175281 -5.110532      9.968550 
1 1 1 -27 18 11 o 34.99684 5.016574 16.73506       4.156126 14.21913       7.547485 17.82998       4.979023 28.32067 9.385182 35.37065 5.990073 -7.049978      11.13385 
1 1 1 -27 18 12 o 17.00789 7.121403 2.639594       4.954921 -2.032650      6.392093 9.673697       7.843045 15.42877 7.149900 24.05444 9.342255 -8.625668      11.76430 
1 1 1 -27 18 13 o 19.01660 6.736010 5.117957       3.904865 4.706288       5.698285 5.482429       5.361699 19.34675 7.816995 19.92014 7.727719 -0.5733814     10.99195 
1 1 1 -26 0  1  o 12.53932 7.193508 2.645289       3.493493 2.645289       3.493493 2.645289       3.493493 12.53932 7.193508 12.53932 7.193508 -0.000000      0.000000 
1 1 1 -26 0  2  o 110.6330 4.057548 151.8906       10.90573 151.8906       10.90573 151.8906       10.90573 110.6330 4.057548 110.6330 4.057548 0.000000       0.000000 
1 1 1 -26 0  3  o 12.25360 7.105655 2.427945       3.464656 2.427945       3.464656 2.427945       3.464656 12.25360 7.105655 12.25360 7.105655 -0.000000      0.000000 
1 1 1 -26 0  4  o 12.34358 7.451234 2.052408       4.095404 2.052408       4.095404 2.052408       4.095404 12.34358 7.451234 12.34358 7.451234 -0.000000      0.000000 
1 1 1 -26 0  5  f 25.78380 8.579461 10.77075       4.798822 10.77075       4.798822 10.77075       4.798822 25.78380 8.579461 25.78380 8.579461 -0.000000      0.000000 
1 1 1 -26 0  6  o 13.84396 7.377431 3.526760       3.377803 3.526760       3.377803 3.526760       3.377803 13.84396 7.377431 13.84396 7.377431 -0.000000      0.000000 
1 1 1 -26 0  7  f 7.091158 4.955326 -3.010825      3.154312 -3.010825      3.154312 -3.010825      3.154312 7.091158 4.955326 7.091158 4.955326 -0.000000      0.000000 
1 1 1 -26 0  8  o 11.71130 6.912963 2.044562       3.377823 2.044562       3.377823 2.044562       3.377823 11.71130 6.912963 11.71130 6.912963 -0.000000      0.000000 
1 1 1 -26 0  9  o 90.06404 3.929082 100.5389       8.585962 100.5389       8.585962 100.5389       8.585962 90.06404 3.929082 90.06404 3.929082 -0.000000      0.000000 
1 1 1 -26 0  10 f 50.70532 4.051963 32.29971       4.930958 32.29971       4.930958 32.29971       4.930958 50.70532 4.051963 50.70532 4.051963 0.000000       0.000000 
1 1 1 -26 0  11 o 90.39937 4.415507 101.7488       9.673921 101.7488       9.673921 101.7488       9.673921 90.39937 4.415507 90.39937 4.415507 -0.000000      0.000000 
1 1 1 -26 0  12 o 171.6681 4.949217 366.7658       20.66543 366.7658       20.66543 366.7658       20.66543 171.6681 4.949217 171.6681 4.949217 0.000000       0.000000 
1 1 1 -26 0  13 o 31.73845 13.95005 19.69874       11.28370 19.69874       11.28370 19.69874       11.28370 31.73845 13.95005 31.73845 13.95005 0.000000       0.000000 
1 1 1 -26 0  14 f 10.88483 7.762698 -12.10291      9.142615 -12.10291      9.142615 -12.10291      9.142615 10.88483 7.762698 10.88483 7.762698 -0.000000      0.000000 
1 1 1 -26 0  15 o 23.44166 9.235437 9.654367       5.065038 9.654367       5.065038 9.654367       5.065038 23.44166 9.235437 23.44166 9.235437 -0.000000      0.000000 
1 1 1 -26 0  16 o 11.29961 7.242392 0.5159185      4.505553 0.5159185      4.505553 0.5159185      4.505553 11.29961 7.242392 11.29961 7.242392 -0.000000      0.000000 
1 1 1 -26 0  17 o 47.71903 5.531037 29.56949       6.207020 29.56949       6.207020 29.56949       6.207020 47.71903 5.531037 47.71903 5.531037 0.000000       0.000000 
1 1 1 -26 0  18 o 10.22852 6.844059 -1.312919      4.723084 -1.312919      4.723084 -1.312919      4.723084 10.22852 6.844059 10.22852 6.844059 0.000000       0.000000 
1 1 1 -26 0  19 o 59.30331 6.424289 46.02716       9.008393 46.02716       9.008393 46.02716       9.008393 59.30331 6.424289 59.30331 6.424289 -0.000000      0.000000 
1 1 1 -26 0  20 o 18.44489 9.418129 6.689696       5.336726 6.689696       5.336726 6.689696       5.336726 18.44489 9.418129 18.44489 9.418129 0.000000       0.000000 
1 1 1 -26 0  21 o 64.61805 4.953162 53.11182       7.691495 53.11182       7.691495 53.11182       7.691495 64.61805 4.953162 64.61805 4.953162 -0.000000      0.000000 
1 1 1 -26 0  22 o 27.87597 9.443433 13.01851       5.741731 13.01851       5.741731 13.01851       5.741731 27.87597 9.443433 27.87597 9.443433 -0.000000      0.000000 
1 1 1 -26 0  23 o 15.04354 8.695141 4.053432       5.161922 4.053432       5.161922 4.053432       5.161922 15.04354 8.695141 15.04354 8.695141 -0.000000      0.000000 
1 1 1 -26 0  24 o 32.67017 8.665924 16.39721       5.960701 16.39721       5.960701 16.39721       5.960701 32.67017 8.665924 32.67017 8.665924 -0.000000      0.000000 
1 1 1 -26 0  25 o 56.42783 5.491110 41.42804       7.375452 41.42804       7.375452 41.42804       7.375452 56.42783 5.491110 56.42783 5.491110 0.000000       0.000000 
1 1 1 -26 0  26 o 8.487985 6.049960 -7.142114      5.523877 -7.142114      5.523877 -7.142114      5.523877 8.487985 6.049960 8.487985 6.049960 0.000000       0.000000 
1 1 1 -26 0  27 o 17.99642 10.82609 6.282329       8.584974 6.282329       8.584974 6.282329       8.584974 17.99642 10.82609 17.99642 10.82609 -0.000000      0.000000 
1 1 1 -26 0  28 o 24.37283 9.921408 11.26883       5.783229 11.26883       5.783229 11.26883       5.783229 24.37283 9.921408 24.37283 9.921408 0.000000       0.000000 
1 1 1 -26 0  29 o 24.01599 10.37975 11.50185       6.255362 11.50185       6.255362 11.50185       6.255362 24.01599 10.37975 24.01599 10.37975 -0.000000      0.000000 
1 1 1 -26 0  30 o 10.86333 7.278244 -0.9323882     5.372400 -0.9323882     5.372400 -0.9323882     5.372400 10.86333 7.278244 10.86333 7.278244 -0.000000      0.000000 
1 1 1 -26 0  31 o 21.39428 11.43770 10.73772       8.141769 10.73772       8.141769 10.73772       8.141769 21.39428 11.43770 21.39428 11.43770 0.000000       0.000000 
1 1 1 -26 0  32 o 9.856189 6.770097 -2.547342      5.276460 -2.547342      5.276460 -2.547342      5.276460 9.856189 6.770097 9.856189 6.770097 -0.000000      0.000000 
1 1 1 -26 1  1  o 18.30778 5.962041 4.282478       3.051136 -1.178364      5.791782 6.380133       3.589628 16.19749 7.225234 21.79394 6.363729 -5.596445      9.628139 
1 1 1 -26 1  2  o 11.16594 4.757890 0.1303260      2.275936 2.656503       3.257930 -2.277619      3.180776 16.12100 6.080126 10.97948 5.072418 5.141520       7.918166 
1 1 1 -26 1  3  o 103.4077 3.378355 132.9541       8.501804 130.0928       10.96748 137.2623       13.45783 101.5499 4.442663 103.5254 5.352652 -1.975502      6.956158 
1 1 1 -26 1  4  o 13.11874 5.290982 1.120622       2.605346 0.7255170      3.206870 1.887717       4.468375 13.73913 5.739234 16.86852 6.882777 -3.129386      8.961664 
1 1 1 -26 1  5  o 61.39516 2.615382 46.50950       3.903996 50.15655       5.618355 43.10453       5.428696 63.39057 3.652507 58.68552 3.816726 4.705055       5.282822 
1 1 1 -26 1  6  o 42.66863 3.479964 22.74240       3.587029 27.83483       6.172931 20.14621       4.407540 46.40461 5.569950 39.76106 4.635716 6.643551       7.246669 
1 1 1 -26 1  7  o 33.90054 3.516256 14.41177       2.862709 11.63351       4.036970 17.22194       4.060092 29.70109 5.785685 36.73312 4.638936 -7.032030      7.415785 
1 1 1 -26 1  8  o 75.50647 2.495998 70.19838       4.586351 68.96210       6.447621 71.46460       6.525236 74.43594 3.564880 75.78703 3.542982 -1.351082      5.026041 
1 1 1 -26 1  9  o 72.86773 2.640929 65.46151       4.681760 61.27160       6.181007 71.10061       7.170701 70.12937 3.629134 75.42534 3.914687 -5.295967      5.338107 
1 1 1 -26 1  10 o 38.69746 3.745109 18.79556       3.487603 11.38213       5.612813 23.45797       4.451189 28.75384 7.809834 43.08329 4.296903 -14.32945      8.913859 
1 1 1 -26 1  11 o 103.0153 2.709322 130.8456       6.795500 139.2319       11.19873 125.9578       8.549441 105.2809 4.374521 100.6811 3.489884 4.599823       5.596045 
1 1 1 -26 1  12 o 35.62286 5.970079 16.68172       4.999365 16.63619       5.650381 16.84584       10.72821 35.19997 6.833639 33.78458 11.18912 1.415386       13.11088 
1 1 1 -26 1  13 o 104.9759 3.745378 137.4281       9.565882 140.8690       11.39453 129.2132       17.60583 105.8024 4.429212 98.59206 7.381466 7.210312       8.608366 
1 1 1 -26 1  14 o 55.48378 4.333161 38.87227       5.812343 35.44891       12.66136 39.78632       6.542450 48.71335 10.93474 55.89142 4.851525 -7.178070      11.96268 
1 1 1 -26 1  15 o 13.04017 5.647346 -0.1305611     3.305879 -0.7530361E-01 4.783426 -0.1810869     4.574038 15.58186 6.770323 15.17661 6.607057 0.4052515      9.459941 
1 1 1 -26 1  16 o 65.84864 3.312543 53.98243       5.298432 61.34780       7.701626 47.36399       7.300672 69.55428 4.569137 60.86227 4.965536 8.692009       6.747856 
1 1 1 -26 1  17 o 19.70385 6.499818 4.991357       3.621361 -0.8868040     5.218030 10.45330       5.029903 15.58081 6.909435 27.45695 7.365648 -11.87614      10.09916 
1 1 1 -26 1  18 o 35.79937 4.696589 16.51761       3.998544 16.99382       5.959995 16.12781       5.392141 35.12307 7.205208 34.47347 6.659671 0.6495934      9.811537 
1 1 1 -26 1  19 o 22.84259 6.755326 7.118019       4.023230 7.596211       6.796585 6.860074       4.991751 24.16604 8.844200 22.66508 7.634881 1.500963       11.68380 
1 1 1 -26 1  20 o 17.55108 6.643275 3.312119       3.897420 1.975067       5.153716 5.098227       5.956625 17.59582 7.306940 21.21440 8.167812 -3.618580      10.95922 
1 1 1 -26 1  21 f 16.93084 6.353973 3.129180       3.548365 -0.6091709     5.004687 6.908016       5.031713 15.31943 6.781479 22.61855 7.665258 -7.299125      10.23448 
1 1 1 -26 1  22 o 43.35299 4.275676 24.06805       4.458365 30.02109       6.574427 18.99959       6.066339 47.55771 5.792171 37.02068 6.980209 10.53703       9.070422 
1 1 1 -26 1  23 o 23.66441 6.529517 7.788593       3.887977 4.395305       5.636611 10.86840       5.369937 20.09680 7.886583 27.43941 7.712156 -7.342611      11.03066 
1 1 1 -26 1  24 o 60.59710 3.585159 46.37569       5.270492 46.43533       7.541976 46.31878       7.368261 59.45615 5.259570 59.48181 5.133473 -0.2566528E-01 7.349532 
1 1 1 -26 1  25 o 13.51593 5.930761 -0.2064830     3.749662 2.399526       5.565077 -2.373256      5.074462 18.08441 7.557872 14.09141 6.472608 3.993007       9.950683 
1 1 1 -26 1  26 o 19.70545 7.292295 4.956130       4.641891 5.572140       5.630736 3.649453       8.200785 20.90666 7.968216 21.04214 9.000663 -0.1354828     12.02100 
1 1 1 -26 1  27 o 16.89708 6.901632 2.516253       4.498620 -1.659048      8.078298 4.393098       5.416142 17.86573 8.191590 19.49464 7.706037 -1.628908      11.24656 
1 1 1 -26 1  28 o 28.53363 6.246425 11.56615       4.222606 11.84460       5.942688 11.28221       6.001072 27.56785 8.224463 26.86548 8.316680 0.7023697      11.69654 
1 1 1 -26 1  29 f 28.47606 6.352731 11.66023       4.296227 13.72680       6.388774 9.954249       5.804701 29.28514 8.472031 25.19450 8.224710 4.090641       11.80767 
1 1 1 -26 1  30 o 36.81982 5.091544 18.39809       4.446299 8.294906       6.104726 29.81280       6.488874 23.16208 8.396194 46.24443 5.891620 -23.08235      10.25706 
1 1 1 -26 1  31 o 26.44814 7.705604 11.00003       5.268241 10.30291       7.219787 11.79393       7.704664 24.83014 9.110808 26.09410 9.436169 -1.263958      13.11671 
1 1 1 -26 1  32 o 14.19876 6.112056 0.8680533      3.826612 2.634867       5.325743 -1.017536      5.501845 17.33000 7.326841 14.97226 6.825086 2.357738       10.01321 
1 1 1 -26 2  1  o 35.88332 3.753357 16.26437       3.233584 17.25426       4.079941 14.59223       5.302710 36.62609 4.677787 32.68021 6.876612 3.945889       8.316819 
1 1 1 -26 2  2  o 60.11222 3.496412 45.13422       5.099679 39.76189       7.354830 50.10868       7.077247 55.40290 5.521004 62.76561 4.660327 -7.362713      7.224966 
1 1 1 -26 2  3  o 30.63706 3.802096 11.88528       2.777729 9.098625       3.972397 14.55155       3.885643 25.96023 6.335827 33.56670 4.894232 -7.606466      8.006011 
1 1 1 -26 2  4  o 65.22224 2.918606 52.66563       4.627066 45.83874       7.346455 57.15454       5.957128 59.87676 5.082801 67.66340 3.626070 -7.786640      6.243657 
1 1 1 -26 2  5  o 68.42637 2.813017 57.87096       4.680636 59.44764       6.686839 56.35630       6.553999 68.85881 4.002221 67.02512 4.031296 1.833687       5.680592 
1 1 1 -26 2  6  o 37.34824 3.319472 17.41919       2.989730 15.91200       4.194672 18.97542       4.262373 35.12787 5.044700 38.57137 4.626963 -3.443497      6.845274 
1 1 1 -26 2  7  o 78.93140 2.770962 76.90567       5.321600 68.71640       8.441129 82.30744       6.855609 73.69743 4.725046 81.36581 3.465483 -7.668373      5.859662 
1 1 1 -26 2  8  o 68.48687 2.863309 57.96663       4.768179 57.18362       7.776294 58.43840       6.036037 67.18615 4.780833 68.47465 3.630284 -1.288498      6.002943 
1 1 1 -26 2  9  o 67.69556 2.542632 56.46640       4.187042 54.49926       5.888550 58.47801       5.954748 66.10670 3.669733 68.52212 3.578526 -2.415421      5.125699 
1 1 1 -26 2  10 o 57.69619 3.225323 41.32936       4.516732 38.05374       6.944323 43.73120       5.946401 54.50207 5.295207 58.99481 4.162958 -4.492744      6.735683 
1 1 1 -26 2  11 o 56.53822 3.590915 39.87595       4.921906 34.47454       6.789429 45.85871       7.145462 51.76111 5.465026 60.05149 4.926079 -8.290382      7.357497 
1 1 1 -26 2  12 o 114.1587 3.779727 162.5266       10.50041 162.9653       12.52278 161.4877       19.27055 113.7477 4.526789 110.5313 7.193472 3.216454       8.499286 
1 1 1 -26 2  13 o 14.12647 5.844850 0.9541958      3.280860 1.843218       4.748254 0.1419759      4.538523 17.20905 7.066762 15.41296 6.645733 1.796096       9.700768 
1 1 1 -26 2  14 o 37.07158 4.573112 17.55480       4.043840 18.89774       6.073977 16.48567       5.419523 37.46197 6.907886 35.08378 6.580641 2.378185       9.540636 
1 1 1 -26 2  15 o 51.50159 4.536747 33.68612       5.635645 18.46601       12.02766 37.96762       6.379254 34.67318 11.84942 54.54424 4.849895 -19.87106      12.80352 
1 1 1 -26 2  16 o 38.74773 4.433419 19.15099       4.110935 17.97286       5.942203 20.23248       5.693264 36.39412 6.953530 39.05952 6.187287 -2.665394      9.307745 
1 1 1 -26 2  17 o 67.35887 3.339979 56.55735       5.465350 61.97999       8.021885 51.85980       7.466328 69.73566 4.748805 63.70599 4.845751 6.029671       6.784722 
1 1 1 -26 2  18 o 15.91180 6.346372 2.057354       3.705000 2.118335       6.363915 2.026087       4.556894 19.16017 8.049729 16.99255 6.944071 2.167614       10.63101 
1 1 1 -26 2  19 o 15.01314 6.063448 1.639296       3.426885 -0.1157125     5.003912 3.189433       4.702786 15.74087 6.880548 18.27652 7.194202 -2.535655      9.954823 
1 1 1 -26 2  20 o 14.04024 6.050768 0.1912476      3.758562 -0.6911687     5.295463 1.087085       5.335581 15.70852 6.963582 17.07435 7.280514 -1.365839      10.07459 
1 1 1 -26 2  21 o 22.56708 6.596355 6.991844       3.855102 9.445036       5.712308 4.939980       5.224206 25.76186 8.135053 20.46638 7.703598 5.295485       11.20377 
1 1 1 -26 2  22 o 43.22409 4.301666 23.94634       4.470966 17.27596       6.480736 30.00430       6.176062 34.70924 7.846912 47.78697 5.397915 -13.07773      9.524260 
1 1 1 -26 2  23 o 27.31025 6.102988 10.24260       3.959288 12.71486       5.926499 8.249788       5.320890 29.49021 8.031465 24.13880 7.874132 5.351418       11.24751 
1 1 1 -26 2  24 o 29.34297 6.000679 11.79679       4.145947 12.93928       5.996785 10.75068       5.738264 29.59963 8.086226 27.03316 8.085771 2.566471       11.43533 
1 1 1 -26 2  25 o 59.38179 3.676095 44.73635       5.293483 38.84711       7.667187 50.10034       7.317296 53.62802 5.967867 61.93491 4.887775 -8.306889      7.713999 
1 1 1 -26 2  26 o 34.72197 6.396056 16.82654       5.212585 15.89594       6.311719 18.82274       9.244175 32.57899 8.007774 33.44397 10.31681 -0.8649826     13.05990 
1 1 1 -26 2  27 o 48.74095 4.948275 31.45487       5.796010 15.17498       10.80509 38.03168       6.867681 29.33249 11.07059 53.27188 5.363163 -23.93939      12.30128 
1 1 1 -26 2  28 o 42.31519 4.596488 23.61803       4.663726 21.95703       6.590065 25.28452       6.600958 38.73191 7.248437 42.16636 6.643616 -3.434452      9.832471 
1 1 1 -26 2  29 o 9.477260 4.624124 -5.600832      3.486466 -0.3299972     4.965230 -10.72717      4.896699 14.94023 6.675380 10.11150 5.033134 4.828727       8.360212 
1 1 1 -26 2  30 o 15.34118 6.386406 1.800269       3.950879 -2.775340      6.102300 5.102502       5.184095 14.87191 6.923872 19.66593 7.606958 -4.794020      10.28620 
1 1 1 -26 2  31 o 15.98163 6.455039 2.563040       3.884103 3.677363       5.582911 1.517753       5.407205 18.46114 7.630086 16.60088 7.205778 1.860254       10.49483 
1 1 1 -26 3  1  o 34.45011 3.540938 14.95124       2.930382 13.75847       4.032357 16.28615       4.265866 32.39376 5.290572 35.38515 5.093644 -2.991394      7.344069 
1 1 1 -26 3  2  o 32.84402 3.733608 13.63647       2.935303 14.47789       4.136577 12.78308       4.165868 33.29076 5.274572 31.06561 5.713344 2.225147       7.775822 
1 1 1 -26 3  3  f 61.95892 3.081228 47.66344       4.637661 45.48324       7.681221 48.91411       5.817719 59.41506 5.362819 62.44924 3.841461 -3.034180      6.596715 
1 1 1 -26 3  4  o 54.21011 2.922300 36.42456       3.846208 35.69456       5.571732 37.08910       5.315996 53.12445 4.341711 54.28685 4.047536 -1.162399      5.935740 
1 1 1 -26 3  5  o 98.69138 2.755526 120.2471       6.620559 122.1298       10.61503 119.0485       8.469802 98.44728 4.436070 97.77166 3.560821 0.6756210      5.688424 
1 1 1 -26 3  6  o 30.23816 3.924068 11.59087       2.823401 12.50732       3.860592 10.53707       4.139799 30.96788 5.306544 28.05835 6.218105 2.909529       8.174609 
1 1 1 -26 3  7  f 68.58016 2.685742 58.04476       4.479798 57.52517       6.004020 58.69731       6.728477 67.91200 3.641248 68.41438 4.054009 -0.5023727     5.449191 
1 1 1 -26 3  8  o 20.44720 5.422606 5.516446       2.745735 5.182132       4.494867 5.715456       3.467981 20.60801 7.233272 20.85480 6.296861 -0.2467880     9.590134 
1 1 1 -26 3  9  o 46.38562 3.311414 26.79250       3.718493 25.75857       6.085464 27.40856       4.697465 44.54095 5.739877 46.62675 4.178461 -2.085793      7.099699 
1 1 1 -26 3  10 o 54.49662 3.708668 37.12312       4.895852 33.57053       6.863693 40.80289       6.985474 50.98605 5.617183 56.51514 5.127947 -5.529091      7.605826 
1 1 1 -26 3  11 o 74.96447 3.354881 69.82023       6.113176 73.18301       8.658664 66.47807       8.632071 76.05866 4.694482 72.34383 4.925786 3.714828       6.804523 
1 1 1 -26 3  12 o 87.52759 2.755296 94.57058       5.869594 90.08467       9.647848 97.20663       7.395761 84.38136 4.710588 88.42284 3.438833 -4.041481      5.832257 
1 1 1 -26 3  13 o 43.48783 4.026657 23.83873       4.218801 22.93934       6.350573 24.54919       5.644260 41.59524 6.475892 43.55954 5.435191 -1.964298      8.454494 
1 1 1 -26 3  14 o 23.82173 6.276991 7.635444       3.694286 5.162504       5.411802 9.793396       5.055406 21.17416 7.866768 26.67893 7.477353 -5.504770      10.85343 
1 1 1 -26 3  15 f 28.32764 6.567296 10.87937       4.445033 8.590883       10.20267 11.41551       4.938350 26.89693 10.59373 28.84403 7.079263 -1.947098      12.74139 
1 1 1 -26 3  16 o 22.38922 7.225227 6.663506       4.486925 19.58091       10.98639 4.077608       4.915563 35.56013 11.28849 19.53743 7.445333 16.02270       13.52268 
1 1 1 -26 3  17 o 13.53323 5.934753 -0.4407244     3.749591 5.839909       6.541914 -3.513471      4.575795 22.49342 8.584945 12.86449 5.991417 9.628934       10.46892 
1 1 1 -26 3  18 o 46.37883 4.027622 27.23254       4.506935 32.08434       6.890496 23.60484       5.958201 49.40327 5.835987 42.23177 5.954556 7.171509       8.337594 
1 1 1 -26 3  19 o 75.72725 3.224873 71.50545       5.937525 65.14854       8.619534 77.24558       8.190723 71.14362 5.003689 78.01176 4.325433 -6.868134      6.614096 
1 1 1 -26 3  20 o 25.07050 6.364588 8.629217       3.894649 7.533541       5.809470 9.523623       5.248832 23.61946 8.227955 25.95414 7.726137 -2.334673      11.28683 
1 1 1 -26 3  21 o 88.11334 3.617816 97.53974       7.751746 98.59835       10.10086 96.02294       12.09079 87.64773 4.746850 85.38972 5.845757 2.258011       7.530303 
1 1 1 -26 3  22 f 38.65854 4.708760 19.39337       4.344560 12.42639       6.506549 24.99880       5.836234 28.99965 8.594548 43.41043 5.650998 -14.41078      10.28591 
1 1 1 -26 3  23 o 16.97985 6.516491 3.048316       3.783099 3.124136       5.746503 2.990321       5.025845 19.01918 7.788106 18.19861 7.345500 0.8205719      10.70565 
1 1 1 -26 3  24 o 38.12825 4.877880 19.06389       4.428584 13.33477       6.530612 23.94143       6.025736 29.76145 8.552072 42.03878 6.056494 -12.27733      10.47946 
1 1 1 -26 3  25 o 18.74013 7.209959 4.033803       4.639091 3.275734       5.722894 5.486520       7.922314 18.93107 7.764319 22.22887 9.128093 -3.297804      11.98360 
1 1 1 -26 3  26 o 14.53637 6.129827 1.047955       3.712023 6.356528       5.467407 -3.491581      5.055897 21.60855 7.928451 13.35966 6.247028 8.248886       10.09384 
1 1 1 -26 3  27 o 25.36914 6.393335 9.185135       3.950390 8.936516       5.658552 9.421514       5.517508 24.37639 8.127747 24.97803 8.007605 -0.6016369     11.40973 
1 1 1 -26 3  28 o 41.31366 5.513901 23.26810       5.412745 27.59591       10.60974 21.74537       6.293339 39.40198 10.75228 38.80735 6.907989 0.5946350      12.78014 
1 1 1 -26 3  29 o 12.66452 5.672843 -0.6956902     3.610082 -5.514862      4.991871 4.588371       5.227103 12.11687 5.819096 19.26921 7.584743 -7.152343      9.559823 
1 1 1 -26 3  30 o 24.23659 6.989311 8.822998       4.354624 -3.552696      6.910192 16.97491       5.608349 15.42665 7.242271 33.82148 7.034168 -18.39483      10.09604 
1 1 1 -26 3  31 o 35.57588 5.105806 17.29821       4.299768 13.41009       6.187773 20.92860       5.979173 28.64569 8.352530 37.76986 6.743658 -9.124170      10.73507 
1 1 1 -26 4  1  o 22.51897 5.142576 6.734734       2.759910 7.927547       3.721786 5.277415       4.113793 24.14525 6.270306 20.30267 6.930114 3.842581       9.345759 
1 1 1 -26 4  2  o 88.88478 2.642346 97.60507       5.717034 87.64315       7.291238 113.5053       9.211528 83.74036 3.581248 95.03651 3.986305 -11.29614      5.358727 
1 1 1 -26 4  3  o 12.91432 5.189730 1.137613       2.496807 1.561942       3.516501 0.7062039      3.545717 15.13125 6.131000 14.26713 6.002172 0.8641176      8.579931 
1 1 1 -26 4  4  o 52.70925 2.829900 34.41581       3.621587 29.43463       5.053630 39.67470       5.192590 48.18985 4.350193 56.23988 3.811331 -8.050022      5.783634 
1 1 1 -26 4  5  o 35.10675 3.576972 15.48802       3.017447 18.52548       4.395844 12.78155       4.149438 37.97309 4.861786 31.14021 5.677148 6.832882       7.474422 
1 1 1 -26 4  6  o 32.64581 3.579497 13.40693       2.801002 9.711801       3.795043 17.82841       4.151319 26.98953 5.932220 37.33168 4.664756 -10.34215      7.546600 
1 1 1 -26 4  7  o 20.12400 5.210387 5.339981       2.575052 6.060217       3.624651 4.606053       3.658939 21.40204 6.432096 19.25361 6.536398 2.148436       9.170406 
1 1 1 -26 4  8  o 48.61882 4.185156 29.80903       4.910309 27.81037       6.244528 33.04694       7.948101 46.31576 5.649435 49.96756 6.695759 -3.651798      8.760668 
1 1 1 -26 4  9  o 85.91629 3.217671 91.55123       6.724890 94.61329       9.522573 88.50475       9.498335 86.60449 4.527816 83.65919 4.677681 2.945297       6.510132 
1 1 1 -26 4  10 o 57.31443 3.085922 40.74825       4.294183 31.74587       6.960327 46.28057       5.456387 49.39420 5.899002 60.86246 3.696340 -11.46826      6.961405 
1 1 1 -26 4  11 o 58.87661 3.045114 42.97900       4.354158 44.98555       7.698964 42.03541       5.279602 59.17315 5.398535 57.96448 3.757944 1.208672       6.577714 
1 1 1 -26 4  12 o 69.16786 2.906731 59.20149       4.888506 54.70156       8.371855 61.52961       6.021736 65.32508 5.304639 70.26418 3.528121 -4.939095      6.370780 
1 1 1 -26 4  13 o 56.76223 3.357528 40.13192       4.623500 54.41412       7.863250 32.58488       5.716004 65.31593 4.977718 50.59526 4.689393 14.72068       6.838720 
1 1 1 -26 4  14 o 63.15295 3.385396 49.69122       5.190978 55.46981       7.951120 45.39859       6.852979 65.90504 4.987809 59.72102 4.747918 6.184013       6.886288 
1 1 1 -26 4  15 o 16.88456 6.322318 3.015868       3.508942 8.037422       5.594198 -0.2412973     4.505455 24.42256 8.079488 14.99009 6.541081 9.432467       10.39538 
1 1 1 -26 4  16 o 21.92957 7.500732 6.227179       4.819633 0.000000       0.000000 6.227179       4.819633 ?        ?        21.92957 7.500732 0.000000       7.500732 
1 1 1 -26 4  17 o 82.88013 3.536576 85.86356       7.126397 91.77124       12.53061 83.03928       8.663978 83.55946 6.197886 80.94033 4.409195 2.619133       7.606234 
1 1 1 -26 4  18 o 35.04406 4.942756 15.95962       4.103954 17.32198       6.429334 15.02284       5.331378 35.10137 7.726119 33.09504 6.836938 2.006332       10.31681 
1 1 1 -26 4  19 o 18.62892 6.468318 4.331547       3.588856 8.381254       5.837358 1.870584       4.550478 24.61984 8.255986 16.76967 6.905520 7.850176       10.76325 
1 1 1 -26 4  20 o 14.78311 6.064575 1.381048       3.492569 -1.789773      5.492661 3.533246       4.525204 15.25313 6.900124 18.39509 7.109345 -3.141963      9.907296 
1 1 1 -26 4  21 o 63.97871 3.917787 51.79548       6.078899 55.02817       8.198370 47.84781       9.059748 65.03983 5.216339 59.75725 6.316926 5.282581       8.192298 
1 1 1 -26 4  22 o 85.02798 3.252457 90.44930       6.726791 92.06124       9.992922 89.11362       9.096394 84.42740 4.877821 83.42006 4.491246 1.007339       6.630569 
1 1 1 -26 4  23 o 66.37754 3.457648 55.44639       5.573630 55.58999       8.236605 55.32508       7.570113 65.15607 5.231418 65.36839 4.785399 -0.2123108     7.089977 
1 1 1 -26 4  24 o 18.03492 6.758059 3.800606       4.010832 4.722130       5.901799 3.009741       5.467419 20.45210 8.056627 18.55555 7.597258 1.896545       11.07373 
1 1 1 -26 4  25 o 18.41762 7.226992 3.675679       4.732853 3.105738       5.699783 4.941252       8.493505 18.74201 7.724225 22.14594 9.301566 -3.403929      12.09061 
1 1 1 -26 4  26 o 19.22827 6.572942 4.978085       3.700945 6.568207       5.477768 3.642628       5.019996 21.80663 7.946247 18.52862 7.388191 3.278019       10.85026 
1 1 1 -26 4  27 o 51.34491 3.883670 33.87701       4.823291 29.46377       6.913522 38.06206       6.732410 45.96905 6.340268 53.33879 5.247408 -7.369743      8.230084 
1 1 1 -26 4  28 o 19.18835 7.148359 4.832387       4.474293 1.715347       9.482237 5.725188       5.074775 20.33154 9.143485 20.45994 7.614717 -0.1283970     11.89904 
1 1 1 -26 4  29 o 14.56098 6.146102 1.240554       3.737557 -3.483925      5.276012 5.999905       5.295448 13.48213 6.329025 20.71571 7.764712 -7.233580      10.01735 
1 1 1 -26 4  30 o 12.90808 5.854779 -1.122056      3.986094 -3.150932      6.310665 0.2247581      5.141634 14.91184 6.974940 15.44782 6.854120 -0.5359774     9.778995 
1 1 1 -26 4  31 o 23.02266 6.658220 7.912877       3.946591 8.456434       5.930341 7.480780       5.287462 23.11674 8.288948 22.08788 7.836924 1.028856       11.40719 
1 1 1 -26 5  1  o 55.53822 3.313150 38.54697       4.463655 37.48042       7.249053 39.19833       5.664996 53.52109 5.642849 55.58376 4.213695 -2.062672      7.042511 
1 1 1 -26 5  2  o 25.36889 5.540359 8.589515       3.328959 4.339872       5.704535 10.78406       4.099362 20.41938 7.957018 28.26842 6.127923 -7.849041      10.04319 
1 1 1 -26 5  3  o 33.08375 3.647793 13.81713       2.892144 13.79151       3.946685 13.84684       4.250401 32.51329 5.152838 32.40230 5.584505 0.1109924      7.598581 
1 1 1 -26 5  4  o 25.64778 4.556333 8.532948       2.743417 8.100220       3.771759 9.019057       3.997643 24.47632 6.289894 25.79781 6.391937 -1.321491      8.967699 
1 1 1 -26 5  5  o 34.84816 3.570676 15.27110       2.989427 12.74732       4.125441 18.06158       4.337936 31.08276 5.654712 37.46435 4.866361 -6.381592      7.460378 
1 1 1 -26 5  6  o 37.69873 3.769532 17.89711       3.416591 28.09262       5.959298 12.90498       4.169977 46.64077 5.339282 31.28635 5.678511 15.35442       7.794448 
1 1 1 -26 5  7  o 47.65086 3.328405 28.30761       3.840641 26.00247       4.635456 33.35473       6.859073 45.33749 4.245010 50.72503 5.644386 -5.387539      7.062521 
1 1 1 -26 5  8  o 76.62622 3.730947 73.35201       6.945848 79.79491       8.947208 63.57967       11.01911 79.39737 4.644575 69.54103 6.580615 9.856339       8.054600 
1 1 1 -26 5  9  o 30.97016 4.508046 12.30199       3.302472 13.53441       5.664708 11.66746       4.064688 31.33525 7.515298 29.67903 5.828150 1.656221       9.510365 
1 1 1 -26 5  10 o 10.12935 4.664404 -1.855984      2.658368 -1.472564      4.965164 -2.010062      3.147502 14.85933 6.654650 11.12287 5.104842 3.736457       8.387120 
1 1 1 -26 5  11 f 51.21917 3.219508 32.63943       3.998119 29.00211       6.866499 34.50513       4.917738 47.00929 6.140635 52.42878 3.876523 -5.419491      7.261875 
1 1 1 -26 5  12 o 60.88650 2.978751 45.95448       4.406271 51.59560       7.858571 43.36782       5.321445 63.49553 5.122277 58.85899 3.729233 4.636539       6.336001 
1 1 1 -26 5  13 o 35.44156 4.089380 15.93719       3.467193 16.87072       6.260461 15.52418       4.164127 34.96278 7.567808 34.60761 5.089484 0.3551712      9.120009 
1 1 1 -26 5  14 o 32.69065 4.693340 13.77100       3.631808 8.029713       6.159971 16.83007       4.496434 24.58344 8.477318 35.95492 5.289814 -11.37148      9.992349 
1 1 1 -26 5  15 o 26.97983 6.117447 9.806946       3.929027 3.720534       6.954513 12.66037       4.761777 21.04900 8.587337 30.53972 6.591830 -9.490719      10.82564 
1 1 1 -26 5  16 o 72.55827 4.449992 66.78946       7.830477 0.000000       0.000000 66.78946       7.830477 ?        ?        72.55827 4.449992 0.000000       4.449992 
1 1 1 -26 5  17 o 17.51003 6.809587 2.981907       4.171298 13.14694       9.731467 0.6938773      4.616947 29.87027 10.62847 15.85341 6.766571 14.01686       12.59964 
1 1 1 -26 5  18 o 46.15350 3.997877 26.99584       4.452154 28.72140       6.970689 25.80693       5.786085 46.33449 6.339627 44.39444 5.463455 1.940052       8.369002 
1 1 1 -26 5  19 f 12.48452 5.591319 -1.087911      3.505549 -0.8542100     5.661396 -1.233233      4.464350 16.09902 7.164758 14.06206 6.302907 2.036962       9.542557 
1 1 1 -26 5  20 o 45.75586 4.071450 26.63858       4.492389 34.35857       7.163116 21.63350       5.767652 50.90977 5.881884 40.16841 6.082349 10.74136       8.461178 
1 1 1 -26 5  21 o 23.56689 7.014852 7.737459       4.327035 16.58645       6.422997 0.3841710      5.855063 33.95378 7.910193 17.10706 7.460908 16.84673       10.87365 
1 1 1 -26 5  22 o 46.64935 4.772619 28.23271       5.349098 36.99786       7.296714 18.04984       7.864712 52.75708 5.769543 34.42332 9.199526 18.33375       10.85905 
1 1 1 -26 5  23 o 20.34627 6.765955 5.573386       3.921767 0.9901943      5.847285 9.320800       5.287325 17.39904 7.522856 25.38473 7.797360 -7.985687      10.83477 
1 1 1 -26 5  24 o 20.75686 7.228386 5.794166       4.483492 5.625144       5.500774 6.128684       7.738584 21.03764 7.907826 22.69090 9.130280 -1.653267      12.07873 
1 1 1 -26 5  25 o 28.84133 5.833151 11.44814       3.958691 15.27491       5.901165 8.316948       5.337973 32.23689 7.631033 23.88608 7.891902 8.350807       10.97792 
1 1 1 -26 5  26 o 19.42141 6.575452 5.131333       3.702603 2.589117       5.482551 7.263068       5.020454 17.96807 7.504876 22.46784 7.656082 -4.499779      10.72095 
1 1 1 -26 5  27 o 20.54977 6.613478 5.970433       3.760990 3.792006       5.520496 7.857290       5.137786 18.91552 7.675440 23.04789 7.745656 -4.132366      10.90447 
1 1 1 -26 5  28 o 15.06860 6.523596 0.7681947      4.408351 -5.522439      9.134324 2.678273       5.033322 17.01993 8.090110 17.39653 7.222368 -0.3765945     10.84493 
1 1 1 -26 5  29 o 20.25332 6.954740 5.871254       4.144541 5.288925       7.086956 6.173931       5.109347 20.82640 8.601089 20.82030 7.660201 0.6095886E-02  11.51770 
1 1 1 -26 5  30 o 46.94947 4.187908 28.91465       4.741170 15.74929       6.642166 42.59046       6.769707 31.07316 8.518929 56.23272 4.992023 -25.15957      9.873826 
1 1 1 -26 5  31 o 12.99580 5.769666 -0.2371195     3.648844 -3.477888      5.573806 2.193297       4.826900 13.75921 6.473533 16.53051 6.981371 -2.771297      9.520828 
1 1 1 -26 6  1  o 34.60260 3.793044 15.19149       3.146044 13.73862       4.396428 16.71625       4.503874 32.04443 5.845348 35.66194 5.347214 -3.617512      7.922171 
1 1 1 -26 6  2  o 44.35806 3.578217 24.73866       3.835101 24.69404       6.336608 24.76445       4.817657 43.03487 6.222714 43.96464 4.563007 -0.9297638     7.716424 
1 1 1 -26 6  3  o 34.02873 4.254007 14.80190       3.450755 14.35537       5.414061 15.10741       4.478250 32.27628 7.078676 33.81919 5.631831 -1.542908      9.045727 
1 1 1 -26 6  4  o 58.00649 2.867398 41.72308       4.040662 36.21344       5.636302 47.54886       5.795752 53.41516 4.368173 61.49584 3.887373 -8.080681      5.847444 
1 1 1 -26 6  5  o 25.34895 5.155990 8.467191       3.076430 6.136391       3.658376 14.09568       5.685015 21.44512 6.465723 31.89214 7.450169 -10.44702      9.864613 
1 1 1 -26 6  6  o 14.09380 5.537239 1.645103       2.781369 1.639919       3.433224 1.655002       4.744376 15.10117 6.079639 16.96048 7.024045 -1.859303      9.289737 
1 1 1 -26 6  7  o 52.37183 3.755424 34.40218       4.761024 24.94483       12.75955 35.93190       5.131644 39.60500 12.10300 53.44104 3.968776 -13.83604      12.73711 
1 1 1 -26 6  8  o 18.28359 5.857909 4.274926       2.953053 6.052536       5.122097 3.389892       3.614178 21.94885 7.720073 17.50743 6.442397 4.441416       10.05505 
1 1 1 -26 6  9  o 16.59742 6.061913 3.048689       3.190516 2.430940       5.186992 3.424660       4.046570 18.23965 7.425601 17.99898 6.778854 0.2406693      10.05447 
1 1 1 -26 6  10 o 47.42908 3.427655 28.10016       3.934941 21.39470       6.723756 31.59302       4.852754 39.69159 7.217260 50.08427 4.009502 -10.39268      8.256207 
1 1 1 -26 6  11 o 24.41474 5.464634 7.911080       3.170000 0.1779113      5.609756 11.53891       3.842278 16.92863 7.343822 29.58366 5.533030 -12.65503      9.194898 
1 1 1 -26 6  12 o 114.8208 2.998917 163.2979       8.383959 170.6917       16.83434 160.8591       9.668280 114.5789 6.050585 113.6282 3.495777 0.9506760      6.987849 
1 1 1 -26 6  13 o 17.06723 5.956758 3.483915       3.045697 -3.287656      5.722189 6.160629       3.597646 14.86711 6.845088 21.47639 6.397271 -6.609278      9.369114 
1 1 1 -26 6  14 o 31.81089 4.636389 13.05126       3.488464 6.397533       7.650745 14.79768       3.919631 23.72388 9.223342 33.80547 4.900713 -10.08159      10.44447 
1 1 1 -26 6  15 o 27.57816 6.121478 10.26162       4.006567 8.750955       7.529963 10.85821       4.732024 25.67046 9.322148 28.07113 6.953788 -2.400671      11.63003 
1 1 1 -26 6  16 o 22.27337 6.579348 6.719789       3.818166 13.94799       6.247076 2.409524       4.824071 31.27708 8.124295 17.67228 7.173509 13.60480       10.83805 
1 1 1 -26 6  17 o 45.44291 4.727790 26.55881       5.159076 23.33128       11.43669 27.38337       5.780646 38.06925 11.42175 45.86677 5.267286 -7.797520      12.57778 
1 1 1 -26 6  18 o 19.85437 6.423471 5.193028       3.544973 6.392994       5.654693 4.416070       4.550128 22.33782 8.083105 19.43939 7.215034 2.898434       10.83482 
1 1 1 -26 6  19 o 103.0364 3.157867 132.3220       7.919680 134.0879       11.89985 130.9180       10.61088 102.2490 4.789108 101.5242 4.298629 0.7248688      6.435353 
1 1 1 -26 6  20 o 42.82418 4.266505 23.47353       4.393254 18.60927       6.660436 27.21978       5.845103 36.13389 7.793365 45.53504 5.370780 -9.401150      9.464767 
1 1 1 -26 6  21 o 22.24183 6.654239 6.824578       3.885933 14.73552       6.274177 1.901446       4.949525 31.80700 8.080056 17.16923 7.147819 14.63777       10.78789 
1 1 1 -26 6  22 o 43.17034 5.191048 24.51524       5.351617 32.46835       7.165126 14.48074       8.048285 49.08840 6.122480 30.51184 9.658903 18.57656       11.43587 
1 1 1 -26 6  23 o 40.36339 5.875900 21.97830       5.610056 23.02454       6.957428 20.03370       9.485233 40.28378 7.358388 35.03191 10.37565 5.251865       12.72006 
1 1 1 -26 6  24 o 17.57738 7.119172 2.809536       4.739149 -1.422667      5.808683 11.23530       8.195946 15.65374 7.087172 26.97255 9.735250 -11.31881      12.04172 
1 1 1 -26 6  25 f 23.95110 6.442405 8.139179       3.841699 0.9130204      5.505863 14.99500       5.362923 16.74634 7.270049 32.30973 7.013011 -15.56340      10.10128 
1 1 1 -26 6  26 o 42.80281 4.354785 23.87711       4.479111 18.83869       6.466507 28.52390       6.210108 35.64558 7.671808 45.82579 5.682691 -10.18021      9.547231 
1 1 1 -26 6  27 f 33.50224 5.306113 15.25574       4.187817 9.226643       6.035712 20.85266       5.815366 24.48654 8.393311 38.39816 6.442832 -13.91162      10.58101 
1 1 1 -26 6  28 o 22.70718 7.374690 7.694273       4.670012 4.435579       9.814732 8.647963       5.309579 21.77483 9.573638 23.78006 7.871439 -2.005228      12.39412 
1 1 1 -26 6  29 o 34.79137 5.842600 16.95457       4.778108 18.87543       8.327372 16.01178       5.834025 32.92974 9.713717 32.42077 7.528962 0.5089760      12.28990 
1 1 1 -26 6  30 o 20.98526 6.841025 6.498359       4.016581 5.331991       5.984766 7.454284       5.418030 20.14673 8.055734 22.11448 7.923631 -1.967747      11.29950 
1 1 1 -26 6  31 o 20.20964 6.845591 5.988324       4.013107 -1.200407      5.860541 12.33530       5.506748 15.28985 6.998016 27.85772 7.802660 -12.56787      10.48111 
1 1 1 -26 7  1  o 54.52294 2.985020 37.03336       3.950961 34.33173       4.987349 41.58591       6.474161 52.05748 3.961169 56.88410 4.712682 -4.826618      6.156317 
1 1 1 -26 7  2  o 33.36905 4.227179 14.27104       3.360387 13.45722       4.090759 15.95968       5.892633 31.88317 5.461448 33.80017 7.362918 -1.917002      9.167332 
1 1 1 -26 7  3  o 61.80269 3.472298 47.81103       5.208473 53.46619       5.849424 26.16548       11.44392 65.25335 3.693611 40.64030 11.19790 24.61305       11.79134 
1 1 1 -26 7  4  o 68.41906 3.869591 58.87642       6.425461 49.95793       7.773609 78.11188       11.41637 62.24473 5.171553 77.09780 6.126805 -14.85307      8.017650 
1 1 1 -26 7  5  o 48.58712 2.937459 29.33628       3.461750 25.61343       4.691859 33.78436       5.128540 44.86443 4.345835 51.68879 4.105263 -6.824360      5.978249 
1 1 1 -26 7  6  o 18.41929 5.398813 4.454734       2.579321 3.591960       3.548625 5.421079       3.755588 17.66592 6.401802 20.38359 6.612878 -2.717667      9.203979 
1 1 1 -26 7  7  o 13.87403 5.646512 1.199552       2.998122 1.120919       5.259345 1.237406       3.649100 17.14861 7.266999 14.97289 6.176597 2.175714       9.537275 
1 1 1 -26 7  8  o 30.71335 5.488208 12.42457       3.956891 -3.612993      11.89179 14.42126       4.195986 21.61930 9.922313 33.19141 5.371040 -11.57211      11.28275 
1 1 1 -26 7  9  o 19.05936 6.162292 4.674896       3.262878 -1.184337      5.448875 7.950468       4.074085 15.73076 7.013146 24.18011 6.688674 -8.449343      9.691366 
1 1 1 -26 7  10 o 83.23292 3.101153 85.99033       6.279055 73.86602       9.237289 96.40447       8.561065 76.00896 5.015072 87.59429 4.021389 -11.58533      6.428260 
1 1 1 -26 7  11 o 45.92745 3.475334 26.40609       3.860734 28.20524       6.957208 25.60552       4.640864 46.10723 6.361313 44.90996 4.292708 1.197266       7.674220 
1 1 1 -26 7  12 o 58.56438 3.096300 42.64185       4.403183 44.16769       7.887055 41.95095       5.307259 58.30780 5.620315 57.80140 3.788756 0.5064049      6.778099 
1 1 1 -26 7  13 o 35.29535 4.410117 15.94712       3.710634 14.74347       8.048535 16.27201       4.181546 31.64118 9.601086 35.43173 4.980204 -3.790556      10.81588 
1 1 1 -26 7  14 o 14.34310 6.008985 0.8395792      3.530834 -0.8214795E-01 6.134081 1.296292       4.317875 17.33544 7.596771 15.98716 6.667536 1.348282       10.10777 
1 1 1 -26 7  15 o 22.77588 6.423598 7.050365       3.718722 2.320992       6.332089 9.540308       4.594517 19.25598 8.055728 26.24306 7.039492 -6.987074      10.69809 
1 1 1 -26 7  16 o 39.64101 4.360613 20.10417       4.142902 22.26368       6.902991 18.88843       5.179408 40.14022 7.326915 37.73220 5.819823 2.408024       9.357031 
1 1 1 -26 7  17 o 37.05452 6.515315 18.62815       5.668525 24.24141       11.25369 16.71978       6.561730 38.80932 11.24915 34.21297 8.012055 4.596352       13.81073 
1 1 1 -26 7  18 o 36.07042 4.740727 16.87149       4.066310 13.34963       6.551993 19.07783       5.185892 30.21777 8.527831 37.85478 5.806727 -7.637016      10.31707 
1 1 1 -26 7  19 o 19.99150 6.513757 5.297690       3.641710 4.776516       6.002610 5.601250       4.581112 20.84795 8.151212 20.80915 7.302455 0.3880310E-01  10.94386 
1 1 1 -26 7  20 o 65.99544 3.461966 54.70027       5.548190 45.98118       8.246752 61.91004       7.499083 58.91021 5.820536 69.55910 4.447326 -10.64889      7.325118 
1 1 1 -26 7  21 o 32.39032 5.502160 14.02782       4.187740 8.535675       6.305227 18.36276       5.601714 24.57980 8.571243 36.55289 6.528304 -11.97310      10.77427 
1 1 1 -26 7  22 o 51.18144 4.632052 33.91549       5.714781 35.84577       7.509500 31.25934       8.808993 51.56290 6.093993 46.52334 8.061938 5.039562       10.10602 
1 1 1 -26 7  23 o 54.04084 4.682685 37.94378       6.105906 36.84212       7.497413 40.11357       10.52195 52.23734 5.998432 52.05931 8.593535 0.1780319      10.47998 
1 1 1 -26 7  24 o 16.06935 6.398889 2.411702       3.760594 -1.437919      5.549299 5.680945       5.113907 15.27154 6.919326 20.79543 7.661455 -5.523892      10.32351 
1 1 1 -26 7  25 o 86.75626 3.237920 94.81512       6.833456 85.70787       10.11968 102.4486       9.264748 80.44268 5.190007 89.10874 4.279059 -8.666061      6.726553 
1 1 1 -26 7  26 o 23.50534 6.600151 7.965143       3.934977 8.153335       6.022699 7.824975       5.197781 23.44347 8.359264 23.04326 7.790839 0.4002094      11.42692 
1 1 1 -26 7  27 o 10.67714 5.057318 -3.369782      3.508564 2.983565       5.497150 -7.736939      4.557595 18.09876 7.533678 10.55973 5.180473 7.539026       9.142954 
1 1 1 -26 7  28 o 13.30581 6.123066 -1.963133      4.570381 0.000000       0.000000 -1.963133      4.570381 ?        ?        13.30581 6.123066 0.000000       6.123066 
1 1 1 -26 7  29 f 19.53389 6.607390 5.425139       3.738619 5.054581       5.646239 5.714447       4.988968 19.82277 7.857790 20.20818 7.544348 -0.3854160     10.89321 
1 1 1 -26 7  30 o 37.99610 4.920626 19.55759       4.449231 21.37945       6.745259 18.15445       5.919607 37.25147 7.685638 34.66695 7.241065 2.584522       10.55945 
1 1 1 -26 8  1  o 14.22647 5.546207 1.837963       2.772455 3.623954       3.430279 -1.526501      4.708122 17.45000 6.298156 14.20514 6.410743 3.244853       8.986901 
1 1 1 -26 8  2  o 53.79410 3.027012 36.07847       3.952112 35.93816       5.061082 36.29773       6.326645 53.28123 3.925482 52.96837 4.959064 0.3128586      6.324691 
1 1 1 -26 8  3  o 27.74472 4.348120 9.957484       2.843292 9.639353       3.814960 10.35502       4.264543 26.65972 6.015596 27.46646 6.477334 -0.8067474     8.839867 
1 1 1 -26 8  4  o 18.32415 5.788676 4.373452       2.892077 3.879895       4.271274 4.791296       3.930032 18.61764 6.974519 19.50744 6.769051 -0.8898087     9.719257 
1 1 1 -26 8  5  o 10.76262 4.843998 -1.089529      2.667270 -4.204714      3.864381 1.744864       3.686108 11.14074 5.285867 15.52330 6.281729 -4.382559      8.209782 
1 1 1 -26 8  6  f 21.89153 5.976887 6.455920       3.277390 11.71033       5.750354 3.927885       3.988634 28.76384 7.942505 18.46601 6.772469 10.29782       10.43790 
1 1 1 -26 8  7  o 32.13112 4.707714 13.35239       3.576822 6.389246       6.203548 16.81999       4.377764 22.78193 8.430290 35.94489 5.144305 -13.16296      9.875914 
1 1 1 -26 8  8  o 11.05531 5.020037 -1.475043      2.940557 -4.155887      5.391099 -0.3396736     3.508408 13.85992 6.471049 13.18012 5.761271 0.6798067      8.664104 
1 1 1 -26 8  9  o 65.86600 2.986995 53.85931       4.781895 50.41813       8.159687 55.65936       5.901513 62.41608 5.418269 66.65927 3.646904 -4.243191      6.531274 
1 1 1 -26 8  10 o 12.09518 5.494338 -1.705408      3.526640 -12.90063      9.406898 0.1253925      3.804089 15.91296 7.725866 14.12158 6.086576 1.791379       9.835416 
1 1 1 -26 8  11 o 59.75983 3.306039 44.54963       4.795763 46.41018       9.891324 43.97786       5.483378 58.68524 7.058053 59.14250 3.825146 -0.4572639     8.027942 
1 1 1 -26 8  12 o 13.74039 5.661030 1.016145       3.060209 7.545582       7.425722 -0.3196369     3.358680 24.49616 9.192086 12.91191 5.640662 11.58425       10.78478 
1 1 1 -26 8  13 o 16.28133 6.266411 2.593773       3.505287 8.546618       5.938797 -0.5888022     4.342358 24.93638 8.326847 14.39601 6.347218 10.54037       10.47013 
1 1 1 -26 8  14 o 23.91190 6.287203 7.792498       3.711471 8.284239       6.230542 7.522031       4.620771 24.67302 8.524955 23.44066 7.304535 1.232359       11.22636 
1 1 1 -26 8  15 o 15.78144 5.780216 2.773099       2.903981 6.955438       5.808390 1.379259       3.353147 23.04794 8.210163 14.59736 5.959958 8.450577       10.14534 
1 1 1 -26 8  16 o 30.50670 4.711892 12.11144       3.390163 5.020368       6.242062 15.07827       4.037553 21.33684 8.320913 33.96507 5.029920 -12.62823      9.723049 
1 1 1 -26 8  17 o 21.56575 6.524656 6.319849       3.720782 2.984917       6.290377 8.114609       4.614625 19.59905 8.099630 24.13963 7.258111 -4.540583      10.87585 
1 1 1 -26 8  18 o 53.94241 5.234731 37.93384       6.794735 26.55967       12.30781 42.92016       8.149120 39.79332 11.82736 56.86458 5.969654 -17.07126      13.24851 
1 1 1 -26 8  19 o 50.16158 4.967542 32.68175       5.992576 41.55370       7.648885 18.58093       9.642964 56.10584 5.672228 34.12030 10.53901 21.98555       11.96849 
1 1 1 -26 8  20 o 31.16489 5.533687 13.01105       4.048644 23.22934       6.295870 5.805934       5.286728 41.25858 6.474833 21.30933 7.799975 19.94924       10.13721 
1 1 1 -26 8  21 o 23.70212 6.553562 7.851144       3.912113 3.672074       6.012397 10.91957       5.151876 19.68868 8.002382 27.52321 7.485086 -7.834528      10.95740 
1 1 1 -26 8  22 o 67.81407 5.277587 60.48041       8.652883 60.48041       8.652883 0.000000       0.000000 67.81407 5.277587 ?        ?        0.000000       5.277587 
1 1 1 -26 8  23 o 40.13922 4.514120 20.98142       4.339027 17.80878       6.501523 23.52942       5.826452 34.78668 7.855847 41.63288 5.908668 -6.846207      9.829887 
1 1 1 -26 8  24 o 18.17772 6.506612 4.220050       3.652481 5.522510       5.644919 3.282070       4.790409 20.83116 7.968744 18.00285 7.204273 2.828314       10.74255 
1 1 1 -26 8  25 o 16.91321 6.522268 3.187241       3.802617 8.349319       6.099281 -0.9502510E-01 4.863548 23.73742 8.417580 15.13676 6.693635 8.600655       10.75455 
1 1 1 -26 8  26 o 63.29296 3.581464 51.09940       5.501441 54.40629       8.487968 48.70385       7.224324 63.38651 5.551007 60.58952 4.935585 2.796982       7.427899 
1 1 1 -26 8  27 o 22.02315 6.823187 7.090547       4.038334 2.014137       6.908991 9.724887       4.977052 18.53947 8.094774 25.28276 7.522760 -6.743294      11.05067 
1 1 1 -26 8  28 o 16.96261 6.613038 3.310605       3.941685 -6.404912      6.550905 8.824220       4.934993 13.86612 6.660981 24.00977 7.558612 -10.14365      10.07478 
1 1 1 -26 8  29 o 35.84906 4.996947 17.44563       4.246875 19.60690       6.552638 15.88022       5.576686 35.63125 7.766320 32.42701 7.240518 3.204247       10.61795 
1 1 1 -26 8  30 o 26.38296 6.465695 10.27679       4.123993 6.265840       6.539544 12.92509       5.313818 21.09128 8.425061 28.83475 7.494422 -7.743464      11.27599 
1 1 1 -26 9  1  o 68.86926 2.964545 59.12583       4.963652 60.74369       6.767496 57.24216       7.302299 69.14985 4.033576 66.77900 4.513806 2.370850       6.053444 
1 1 1 -26 9  2  o 25.76478 4.686988 8.725266       2.834398 9.784226       3.829037 7.441642       4.215687 26.77436 6.015718 23.15488 6.931627 3.619482       9.178034 
1 1 1 -26 9  3  o 12.15287 5.081656 0.5721395      2.517840 0.1239756      3.353528 1.151181       3.811873 13.25191 5.713276 15.01065 6.262821 -1.758741      8.477290 
1 1 1 -26 9  4  o 12.69367 5.172199 0.9892280      2.519120 -0.7295284     3.285029 3.442785       3.924914 12.35723 5.480956 17.71963 6.675627 -5.362403      8.637411 
1 1 1 -26 9  5  o 34.87221 4.108133 15.53082       3.424172 13.95624       5.044436 16.87630       4.663041 31.88110 6.705869 35.74316 5.532075 -3.862064      8.693247 
1 1 1 -26 9  6  o 15.90423 6.006037 2.626858       3.181321 2.618446       5.620497 2.630823       3.858998 18.70350 7.685335 16.72372 6.536547 1.979776       10.08914 
1 1 1 -26 9  7  o 15.95226 6.029054 2.632166       3.207242 2.314517       5.714515 2.778235       3.875119 18.56787 7.700982 16.92591 6.568688 1.641968       10.12190 
1 1 1 -26 9  8  o 40.35296 3.959468 20.64185       3.843501 23.92521       6.815728 19.11089       4.654096 41.94778 6.907804 38.32752 5.110192 3.620262       8.592545 
1 1 1 -26 9  9  o 58.43227 3.380273 42.68673       4.792728 42.46214       9.814365 42.75705       5.492125 55.71957 7.411651 58.24151 3.891986 -2.521935      8.371387 
1 1 1 -26 9  10 o 28.23812 5.365453 10.56181       3.557194 11.52267       7.486351 10.28161       4.042721 28.24428 9.346627 27.53714 6.176956 0.7071419      11.20331 
1 1 1 -26 9  11 o 51.81736 5.558434 35.07783       6.909241 23.11357       12.55694 40.27293       8.274429 37.45429 12.08703 55.06480 6.278382 -17.61051      13.62036 
1 1 1 -26 9  12 o 13.59324 5.837391 0.2099120      3.474590 2.906930       5.815693 -1.287156      4.332917 19.16045 7.839117 13.83606 6.204916 5.324385       9.997637 
1 1 1 -26 9  13 o 62.83892 3.497260 49.48158       5.334284 39.71827       8.048236 57.13066       7.123719 54.71939 6.141515 67.01556 4.386200 -12.29617      7.546983 
1 1 1 -26 9  14 o 31.43094 4.435383 12.75306       3.302905 12.70891       6.541632 12.76817       3.826462 29.54276 8.580547 31.12504 5.230191 -1.582283      10.04891 
1 1 1 -26 9  15 o 32.63618 4.580821 13.79233       3.543005 9.483980       6.805403 15.39426       4.149735 25.92408 8.911534 34.26909 5.126414 -8.345013      10.28084 
1 1 1 -26 9  16 o 36.99172 4.054781 17.46358       3.595346 19.31600       6.860885 16.76229       4.221393 36.83285 7.881927 35.83813 4.966999 0.9947128      9.316429 
1 1 1 -26 9  17 o 49.96656 3.870255 31.62568       4.675827 20.74625       7.101516 39.95175       6.212527 38.14219 7.900384 55.76246 4.613070 -17.62027      9.148579 
1 1 1 -26 9  18 o 15.78349 6.595003 1.355716       4.236216 4.521730       9.987044 0.6611084      4.677893 23.37800 9.964302 15.78093 6.774957 7.597069       12.04937 
1 1 1 -26 9  19 o 14.70050 6.062398 1.334700       3.513994 2.049200       5.555149 0.8580924      4.537071 17.96000 7.531597 15.71801 6.708250 2.241994       10.08591 
1 1 1 -26 9  20 o 31.02295 6.471040 13.33474       4.733529 17.82974       6.571214 8.486680       6.824404 35.06511 7.882363 24.57248 8.881480 10.49262       11.87486 
1 1 1 -26 9  21 o 56.86481 4.434509 41.65994       6.096493 35.37971       7.597320 53.01738       10.21675 51.06172 6.234757 61.95256 6.883397 -10.89083      9.287268 
1 1 1 -26 9  22 o 20.97653 7.133365 6.021629       4.358003 7.191324       6.168183 4.855746       6.158122 22.87630 8.416598 20.66022 8.200958 2.216076       11.75138 
1 1 1 -26 9  23 o 42.54705 4.386366 23.51410       4.482790 29.10204       6.917515 19.46852       5.885932 45.92751 6.350501 37.17244 6.746051 8.755062       9.264884 
1 1 1 -26 9  24 o 55.85496 3.691231 39.78794       4.996057 37.07225       7.578938 41.87495       6.644000 51.97576 6.099659 56.38568 4.883410 -4.409927      7.813676 
1 1 1 -26 9  25 o 32.96062 5.382300 14.77405       4.174082 11.39838       6.347666 17.34573       5.540423 26.93713 8.583965 34.77563 6.781485 -7.838497      10.93952 
1 1 1 -26 9  26 o 14.20602 6.121086 0.6459270      3.845058 3.339473       5.979459 -1.253151      5.020779 18.77813 7.839993 14.44679 6.559877 4.331331       10.22240 
1 1 1 -26 9  27 o 32.92195 5.744728 15.10182       4.441286 11.38965       7.786535 16.89188       5.407097 26.09636 9.479227 34.08270 6.749042 -7.986343      11.63638 
1 1 1 -26 9  28 o 21.84293 6.581541 7.001054       3.791469 3.487593       5.810656 9.606044       5.003348 18.57557 7.739903 24.93832 7.570504 -6.362757      10.82676 
1 1 1 -26 9  29 o 15.25202 6.232267 2.095723       3.670182 1.358544       6.062772 2.522141       4.611076 17.11758 7.525271 16.64945 6.912550 0.4681339      10.21827 
1 1 1 -26 10 1  o 40.43592 3.465490 20.66406       3.381927 18.81598       4.694664 22.65769       4.876024 37.71832 5.249662 41.64126 4.898745 -3.922935      7.180296 
1 1 1 -26 10 2  o 28.90701 4.433465 10.87707       3.023577 13.85359       4.282577 7.918808       4.269422 32.10226 5.682262 23.76844 6.940168 8.333818       8.969618 
1 1 1 -26 10 3  f 22.52441 5.199714 6.812128       2.796311 7.027666       3.732531 6.536400       4.221644 22.57084 6.458971 21.85815 7.004114 0.7126884      9.527640 
1 1 1 -26 10 4  o 30.57825 4.085972 12.01263       2.968565 13.41396       4.087281 10.44817       4.318635 31.73489 5.483449 27.46938 6.545024 4.265503       8.538475 
1 1 1 -26 10 5  o 29.36442 5.073339 11.37221       3.499130 12.04523       5.879941 11.00319       4.354023 28.88237 8.052907 28.27059 6.461469 0.6117744      10.32472 
1 1 1 -26 10 6  o 16.60954 6.489697 2.629387       3.802810 -11.48884      11.81386 4.261356       4.016590 18.57011 8.926977 18.80946 6.811592 -0.2393570     11.22892 
1 1 1 -26 10 7  o 20.73783 6.192179 5.796262       3.367517 8.251265       6.726006 4.974994       3.890216 24.66151 8.829323 19.68585 6.738663 4.975660       11.10705 
1 1 1 -26 10 8  o 44.97873 3.844195 25.59638       4.173201 16.87825       7.889534 28.98327       4.917455 33.57872 9.315282 47.67709 4.277903 -14.09837      10.25061 
1 1 1 -26 10 9  o 25.56449 6.490793 8.989707       4.050287 7.229063       7.273290 9.781113       4.876346 23.94850 9.072868 26.39918 7.323452 -2.450680      11.65975 
1 1 1 -26 10 10 o 30.55303 5.490406 12.40231       3.937597 17.86094       6.571846 9.345205       4.918134 35.50856 7.807798 25.80090 7.423900 9.707664       10.77386 
1 1 1 -26 10 11 o 34.35255 4.801571 15.33302       3.909910 17.32298       6.588290 14.25112       4.857871 34.86724 7.933154 32.36214 6.386752 2.505100       10.18457 
1 1 1 -26 10 12 o 41.08216 3.885330 21.40611       3.843496 17.17936       7.141348 23.12970       4.560307 34.30846 8.567915 42.45292 4.475348 -8.144463      9.666328 
1 1 1 -26 10 13 o 14.77345 5.873338 1.795450       3.163253 0.1741428      6.069383 2.400084       3.706450 17.29256 7.567839 16.22816 6.387144 1.064402       9.902919 
1 1 1 -26 10 14 o 104.6326 2.862565 135.9254       7.292060 124.9375       11.98003 142.3924       9.190759 98.43966 5.010516 106.5691 3.543956 -8.129463      6.137174 
1 1 1 -26 10 15 o 10.44747 4.846582 -2.215580      2.948736 -3.692511      5.891915 -1.722030      3.405979 14.73077 6.839536 11.77551 5.368683 2.955256       8.694942 
1 1 1 -26 10 16 o 54.87783 3.264729 37.72008       4.346232 25.64894       7.225629 44.56344       5.440467 43.03792 7.139583 59.39635 3.778309 -16.35843      8.077702 
1 1 1 -26 10 17 o 47.10212 3.571256 27.99302       4.068638 20.07683       7.002527 32.02740       4.999026 37.39804 7.929988 50.11730 4.129802 -12.71926      8.940916 
1 1 1 -26 10 18 o 67.95477 4.021927 58.67722       6.630459 39.23311       12.87127 65.70084       7.735848 49.38063 10.98024 71.58889 4.456411 -22.20826      11.85012 
1 1 1 -26 10 19 o 61.43638 3.619087 47.66968       5.394269 45.81140       8.123984 49.13503       7.214110 58.68234 5.754937 61.52921 4.850533 -2.846870      7.526418 
1 1 1 -26 10 20 o 45.42100 5.320913 27.29507       5.777998 31.31582       7.468838 21.30204       9.118495 47.73045 6.597516 36.53896 9.966825 11.19149       11.95261 
1 1 1 -26 10 21 o 39.37621 5.530214 20.78340       5.160494 17.96665       6.801402 24.60501       7.922233 34.76834 8.167225 40.80228 8.251490 -6.033939      11.60994 
1 1 1 -26 10 22 o 60.92868 4.074680 47.61452       6.015169 39.80822       7.820435 58.92292       9.412587 54.11417 6.032876 66.05240 5.910075 -11.93822      8.445389 
1 1 1 -26 10 23 o 10.20485 4.968204 -6.173491      3.963098 -6.911213      5.188836 -5.140605      6.139735 11.97312 5.795233 14.09223 6.679360 -2.119110      8.842996 
1 1 1 -26 10 24 o 20.05690 6.634287 5.602681       3.771928 -0.1047520E-01 5.599622 10.26518       5.103458 16.09879 7.147366 26.17633 7.571810 -10.07754      10.41236 
1 1 1 -26 10 25 o 34.82109 5.065081 16.32987       4.172070 18.89257       6.329007 14.36049       5.548191 35.59417 7.531905 30.96843 7.444187 4.625734       10.58988 
1 1 1 -26 10 26 o 16.23348 6.643787 2.370204       4.179037 2.608512       7.410257 2.259065       5.060551 19.28622 8.402678 17.03296 7.168458 2.253256       11.04499 
1 1 1 -26 10 27 o 28.37422 5.919848 11.41031       3.960681 8.914791       6.011812 13.32414       5.264736 23.84635 8.365611 29.66176 7.327103 -5.815405      11.12070 
1 1 1 -26 10 28 o 12.21830 5.543591 -1.117333      3.576922 1.890232       5.617742 -3.167992      4.638751 17.11422 7.386617 12.64309 5.934942 4.471136       9.475529 
1 1 1 -26 10 29 o 10.26883 4.986215 -5.514204      3.921484 -9.260626      9.399472 -4.724688      4.314949 15.77234 7.672515 11.30760 5.425136 4.464746       9.396786 
1 1 1 -26 11 1  o 14.17106 5.864404 1.192316       3.303705 6.684790       5.856202 -1.371661      4.001189 22.36601 8.205654 13.05739 5.899722 9.308621       10.10641 
1 1 1 -26 11 2  o 15.22588 5.519526 2.675423       2.638213 1.182539       3.476805 4.701692       4.050567 14.44839 6.000891 19.24114 6.855952 -4.792747      9.111244 
1 1 1 -26 11 3  f 36.02426 3.690330 16.49925       3.193898 17.85478       4.334351 14.88868       4.724540 36.90889 4.943170 33.06925 6.086945 3.839638       7.841290 
1 1 1 -26 11 4  o 16.49027 5.639251 3.392426       2.724238 5.062716       3.703215 1.422405       4.021780 19.61096 6.575819 15.52505 6.451586 4.085913       9.212185 
1 1 1 -26 11 5  f 19.15662 6.355777 4.809166       3.461150 1.781533       6.668913 5.925334       4.049191 18.96561 8.114620 20.97446 6.870707 -2.008848      10.63267 
1 1 1 -26 11 6  f 27.12639 5.925960 10.00918       3.807457 -3.810667      7.352867 15.07244       4.450616 16.56341 7.673179 33.59453 5.635850 -17.03112      9.520529 
1 1 1 -26 11 7  o 29.03224 6.967977 11.79965       4.866918 21.98607       12.24247 9.887590       5.304062 36.01258 11.95361 26.31675 7.749601 9.695833       14.24588 
1 1 1 -26 11 8  o 13.49046 5.858665 -0.3967768E-01 3.578215 -0.3974581     5.501811 0.2225922      4.710549 16.14111 7.129380 15.49926 6.726611 0.6418543      9.801804 
1 1 1 -26 11 9  o 28.01571 5.294109 10.44170       3.481944 14.89012       6.283139 8.470044       4.183009 32.11498 8.046006 24.68730 6.757307 7.427675       10.50711 
1 1 1 -26 11 10 o 27.65992 5.370009 10.20574       3.489070 13.86298       6.642454 8.812196       4.100270 30.71500 8.557396 25.22064 6.597225 5.494358       10.80520 
1 1 1 -26 11 11 o 49.00367 3.884190 30.42512       4.600452 29.56088       7.292902 30.99632       5.928912 46.69424 6.592348 48.83135 5.055455 -2.137108      8.307628 
1 1 1 -26 11 12 o 33.23732 5.078142 14.51097       3.982769 15.97022       6.712539 13.71815       4.947801 33.09431 8.330491 31.53304 6.648632 1.561264       10.65839 
1 1 1 -26 11 13 o 43.02272 3.820371 23.47112       3.963737 17.49093       7.037470 26.24968       4.796982 34.58222 8.428753 45.23192 4.407834 -10.64970      9.511723 
1 1 1 -26 11 14 o 14.65187 5.965044 1.490512       3.347235 6.918610       9.800882 0.7737895      3.561370 24.76666 10.15960 14.22302 6.001266 10.54363       11.79969 
1 1 1 -26 11 15 o 16.48683 6.092113 3.070992       3.237554 -5.060345      5.794146 6.762172       3.903831 13.88439 6.553201 22.16060 6.678595 -8.276213      9.356712 
1 1 1 -26 11 16 o 30.60356 4.922160 12.32509       3.546369 4.364619       6.151174 16.28850       4.340337 20.48747 8.175332 35.11377 5.231846 -14.62630      9.706095 
1 1 1 -26 11 17 o 33.81675 4.472128 14.83812       3.595127 7.201359       6.199418 18.70770       4.412943 23.14526 8.450495 37.81001 4.904932 -14.66475      9.770835 
1 1 1 -26 11 18 o 23.55320 7.201141 7.839416       4.516316 0.6230242      9.970576 9.702266       5.065812 21.06043 9.431083 25.93850 7.555823 -4.878071      12.08453 
1 1 1 -26 11 19 o 29.37212 6.052344 11.86065       4.187899 11.40354       6.524259 12.18098       5.461589 27.52627 8.694242 28.91221 7.638659 -1.385941      11.57320 
1 1 1 -26 11 20 o 79.45260 3.312649 79.39765       6.399792 79.80263       9.843957 79.10117       8.422683 77.88842 5.216411 78.35000 4.429429 -0.4615784     6.843302 
1 1 1 -26 11 21 o 89.48883 3.736377 101.7238       8.130159 123.9997       18.01775 96.02856       9.110367 92.23904 8.097956 86.32765 4.344583 5.911392       9.189793 
1 1 1 -26 11 22 o 11.12987 5.198267 -2.670535      3.483983 -4.223393      5.622643 -1.702737      4.438814 13.80518 6.497232 13.44125 6.128410 0.3639288      8.931486 
1 1 1 -26 11 23 o 13.97016 6.176890 -0.2615545     4.140212 1.505617       5.322486 -2.969191      6.588254 16.88558 7.237520 15.61569 7.244215 1.269893       10.24013 
1 1 1 -26 11 24 o 28.63619 5.959223 11.50928       4.023036 6.557231       6.054076 15.42524       5.383622 21.73199 8.267207 32.51167 7.002241 -10.77968      10.83412 
1 1 1 -26 11 25 o 17.80677 6.841403 3.824730       4.172921 7.739333       7.174304 1.823225       5.129964 22.97153 8.931344 16.76306 7.143032 6.208473       11.43642 
1 1 1 -26 11 26 o 32.22104 5.695820 14.46678       4.308762 6.824955       6.474645 20.54129       5.772620 21.85981 8.488699 37.85736 6.490798 -15.99756      10.68590 
1 1 1 -26 11 27 o 33.57620 5.505808 15.62751       4.348932 9.345044       6.642961 20.33970       5.753188 24.11943 8.756327 37.53016 6.527488 -13.41073      10.92160 
1 1 1 -26 11 28 o 11.44595 5.351355 -2.557003      3.707715 0.8105469      5.915329 -4.736173      4.758471 16.60702 7.360985 12.01997 5.748209 4.587049       9.339486 
1 1 1 -26 12 1  o 13.40626 5.372038 1.420111       2.667291 0.5113025      3.568320 2.570899       4.015368 13.86207 5.933472 16.58307 6.609247 -2.721004      8.881905 
1 1 1 -26 12 2  o 19.89959 6.403408 5.368509       3.525933 10.72543       6.092731 2.671040       4.323473 26.83828 8.391392 17.06511 6.839008 9.773163       10.82532 
1 1 1 -26 12 3  o 28.10075 4.478126 10.33103       2.963717 6.871604       3.887650 15.13125       4.579469 22.21232 6.658109 33.42344 5.834637 -11.21111      8.852876 
1 1 1 -26 12 4  o 21.82078 6.703709 6.587342       3.907955 8.300021       5.638396 5.003979       5.421357 24.16537 8.114181 20.48010 7.815510 3.685265       11.26597 
1 1 1 -26 12 5  o 21.31840 6.584044 6.236113       3.763665 8.674274       5.509648 4.103021       5.153442 24.64080 8.010823 19.40272 7.562321 5.238079       11.01644 
1 1 1 -26 12 6  o 37.16232 4.822942 18.02339       4.264757 15.22069       6.229974 20.49502       5.850455 32.36323 7.956353 38.74112 6.421764 -6.377888      10.22461 
1 1 1 -26 12 7  o 31.64765 5.544545 13.40307       4.120295 6.966388       10.41175 14.59826       4.486556 24.97952 10.38051 32.92576 5.803651 -7.946243      11.89274 
1 1 1 -26 12 8  o 35.92845 4.239145 16.59680       3.640152 12.18409       6.013862 19.14838       4.573042 28.87032 8.177876 38.23825 5.029438 -9.367935      9.600673 
1 1 1 -26 12 9  o 48.77525 3.591471 30.01990       4.238885 19.23846       6.936541 36.44573       5.355120 36.52486 8.013903 53.47258 4.141892 -16.94772      9.020970 
1 1 1 -26 12 10 o 41.85753 3.948894 22.30767       3.980356 10.06221       6.873198 28.48674       4.882390 26.33740 8.958362 47.16400 4.295083 -20.82660      9.934787 
1 1 1 -26 12 11 o 26.97296 5.267925 9.714463       3.338357 8.458856       5.961072 10.28820       4.029521 24.52067 8.342753 27.37765 6.186038 -2.856977      10.38598 
1 1 1 -26 12 12 o 64.66635 4.085955 53.16197       6.405925 44.66859       8.327574 65.47216       10.02560 57.89550 5.988888 70.25059 5.911095 -12.35509      8.414739 
1 1 1 -26 12 13 o 26.10759 5.397252 9.158135       3.320292 6.550352       6.338608 10.14426       3.897840 22.63052 8.492492 27.23352 6.032381 -4.603006      10.41691 
1 1 1 -26 12 14 o 14.93670 5.965004 1.848155       3.277241 -3.124528      6.047492 3.915685       3.899472 15.17786 7.005672 18.17961 6.691482 -3.001756      9.687898 
1 1 1 -26 12 15 o 30.97405 5.130728 12.71709       3.737236 2.145445       6.249516 18.60216       4.662844 18.72826 7.928330 37.52311 5.242240 -18.79485      9.504709 
1 1 1 -26 12 16 o 10.24430 4.809367 -2.763622      3.047377 -5.529588      5.763421 -1.690257      3.590298 13.56556 6.441834 12.10257 5.515574 1.462989       8.480494 
1 1 1 -26 12 17 o 25.73558 6.462349 9.269967       4.046576 4.905507       6.342455 12.26624       5.255124 20.95275 8.320949 29.17806 7.385366 -8.225304      11.12573 
1 1 1 -26 12 18 o 65.39701 4.185173 54.76781       6.634712 53.70965       13.62800 55.09652       7.595646 58.88603 9.844172 65.08210 4.823532 -6.196068      10.96240 
1 1 1 -26 12 19 o 64.21578 3.090882 51.71406       4.822621 44.60783       8.354568 55.26521       5.905934 57.36695 6.068087 65.99686 3.686881 -8.629910      7.100336 
1 1 1 -26 12 20 o 50.13036 3.525334 31.88235       4.279168 23.34492       7.393845 36.18217       5.247248 39.84565 7.893923 53.06353 4.089407 -13.21788      8.890291 
1 1 1 -26 12 21 o 21.09504 6.701587 6.262401       3.871415 -0.9741146     6.101089 11.14019       5.009038 16.17075 7.297782 27.51597 7.336472 -11.34522      10.34802 
1 1 1 -26 12 22 o 18.37466 6.587145 4.386713       3.744981 13.15759       6.315877 -0.3690777     4.650755 29.08138 8.426681 14.63587 6.504886 14.44550       10.64530 
1 1 1 -26 12 23 f 40.24319 5.600526 22.12074       5.343727 18.67274       6.947131 27.11685       8.362518 34.71828 8.320027 41.93226 8.475600 -7.213974      11.87681 
1 1 1 -26 12 24 o 13.66285 5.976431 0.1484090      3.781099 -2.038185      6.415405 1.312232       4.680404 15.72484 7.242849 15.85585 6.791359 -0.1310120     9.928818 
1 1 1 -26 12 25 o 34.49863 6.308436 16.96543       5.108092 6.885850       6.677873 31.18072       7.930394 21.99607 8.598247 45.92693 7.332267 -23.93085      11.30009 
1 1 1 -26 12 26 o 52.48488 4.014239 35.83498       5.095249 22.16795       7.345375 48.51020       7.073834 37.55031 8.252784 60.24559 4.859497 -22.69528      9.577220 
1 1 1 -26 12 27 o 29.77173 6.155661 12.75879       4.318374 11.73042       6.481000 13.57992       5.791250 26.55208 8.692053 29.26566 7.926339 -2.713579      11.76344 
1 1 1 -26 12 28 o 28.53778 7.267436 12.50686       5.066890 15.80278       6.621136 7.848863       7.871248 30.96703 8.511661 22.68384 9.179416 8.283194       12.51839 
1 1 1 -26 13 1  o 12.86390 5.589940 0.4781292E-01  3.261572 2.205233       3.601346 -9.794341      7.692058 15.63466 6.249898 14.38643 6.985081 1.248234       9.372971 
1 1 1 -26 13 2  o 46.86497 3.611246 27.89868       4.092431 32.52604       5.304694 21.09562       6.431996 50.15258 4.384457 38.54208 7.110050 11.61050       8.353219 
1 1 1 -26 13 3  o 15.96042 6.489355 2.047233       3.955435 4.111815       5.953523 0.4157681      5.292330 19.88891 8.006383 16.23715 7.087200 3.651766       10.69255 
1 1 1 -26 13 4  o 15.53855 5.976689 2.474061       3.187216 0.9282819      5.347857 3.325554       3.969140 16.72170 7.212039 17.42681 6.678143 -0.7051086     9.829095 
1 1 1 -26 13 5  o 32.88584 4.656791 14.14771       3.627644 12.77025       5.932532 14.97035       4.584656 29.41797 8.045307 33.20941 5.880301 -3.791435      9.965184 
1 1 1 -26 13 6  o 11.61888 5.259978 -1.321476      3.198851 -1.158656      5.441602 -1.407452      3.954231 15.43325 6.934775 12.96770 5.861544 2.465551       9.080132 
1 1 1 -26 13 7  f 60.04329 3.223714 45.20404       4.699612 49.59821       7.961890 42.85443       5.822038 61.40700 5.374748 57.92273 4.152222 3.484268       6.791823 
1 1 1 -26 13 8  o 22.32479 6.652427 6.917915       3.889799 13.32613       10.37944 5.870860       4.195563 29.18158 10.88435 20.87491 6.999311 8.306667       12.94061 
1 1 1 -26 13 9  o 13.33810 5.629807 0.6445134      3.135881 3.768923       5.326403 -1.012980      3.879502 19.21810 7.627532 13.15057 5.886370 6.067529       9.634760 
1 1 1 -26 13 10 o 33.41558 4.668733 14.56919       3.698124 9.318672       6.189351 17.48437       4.611873 25.39489 8.501059 36.29073 5.377364 -10.89584      10.05903 
1 1 1 -26 13 11 o 33.52472 4.551373 14.61907       3.622353 9.479079       6.043066 17.50165       4.525495 25.56829 8.394563 36.36869 5.258740 -10.80041      9.905707 
1 1 1 -26 13 12 o 11.34204 5.180762 -1.663738      3.190946 -0.9520646     5.235595 -2.084321      4.024867 15.30136 6.844444 12.62992 5.787628 2.671437       8.963428 
1 1 1 -26 13 13 o 17.23878 6.148293 3.630932       3.258286 -1.412992      5.797488 5.959689       3.939288 15.76294 7.113802 20.91217 6.771758 -5.149227      9.821552 
1 1 1 -26 13 14 o 33.49030 4.501620 14.59459       3.580919 16.96685       6.479777 13.55156       4.296621 34.09047 7.947177 31.62309 5.788793 2.467371       9.831976 
1 1 1 -26 13 15 o 28.06398 5.613039 10.68387       3.704501 11.71185       6.401068 10.16618       4.542513 27.93324 8.579230 26.75110 6.917289 1.182142       11.02053 
1 1 1 -26 13 16 o 45.02363 4.527642 26.27999       4.900251 21.39408       7.262855 30.36267       6.639081 38.21641 8.053140 47.50944 5.858400 -9.293030      9.958610 
1 1 1 -26 13 17 o 25.90158 6.442318 9.435795       4.049464 7.803940       11.48043 9.667675       4.327618 25.38444 10.74593 26.07861 6.755897 -0.6941700     12.69319 
1 1 1 -26 13 18 o 12.73991 5.526622 0.6472911E-01  3.176912 -0.2205088     5.858168 0.1835650      3.781220 16.43535 7.302867 13.87292 6.023679 2.562432       9.466603 
1 1 1 -26 13 19 o 19.56505 6.492342 5.212411       3.611447 0.2440453E-01  10.73664 5.874282       3.834903 20.92624 9.537304 20.57078 6.683004 0.3554573      11.64572 
1 1 1 -26 13 20 o 26.87563 5.405607 9.869123       3.417488 4.689351       6.207238 12.12217       4.093819 20.32309 8.177289 29.58571 5.885364 -9.262617      10.07500 
1 1 1 -26 13 21 o 11.83478 5.261815 -0.5725474     3.045831 -5.283697      5.799108 1.222160       3.579271 13.51136 6.429124 14.45510 6.052585 -0.9437370     8.829916 
1 1 1 -26 13 22 o 13.03250 5.743594 -0.2034993     3.552148 2.991957       5.448181 -2.566212      4.684794 18.12093 7.517831 13.19619 6.117279 4.924741       9.692207 
1 1 1 -26 13 23 o 25.87435 7.669002 10.24308       5.180439 6.721993       7.746078 13.09234       6.968028 22.34634 9.082936 28.24344 8.992903 -5.897102      12.78171 
1 1 1 -26 13 24 o 12.76009 5.776647 -1.103919      3.858204 -3.428334      6.074902 0.4675021      4.994923 14.56943 6.824034 15.52113 6.826708 -0.9516983     9.652533 
1 1 1 -26 13 25 o 24.71197 6.653962 9.024058       4.095572 5.251815       6.533216 11.46622       5.256716 20.46583 8.333025 27.21329 7.623934 -6.747454      11.29441 
1 1 1 -26 13 26 o 23.33273 7.431943 8.363323       4.758646 14.29593       6.235604 0.9003793E-01  7.363680 29.72757 8.294474 17.56467 7.963216 12.16290       11.49831 
1 1 1 -26 13 27 o 12.45743 5.849590 -3.090467      4.512283 -4.747612      5.936168 -0.8225555     6.944468 13.65181 6.498417 16.64296 7.617476 -2.991152      10.01276 
1 1 1 -26 14 1  o 19.32867 5.932261 5.147599       3.061205 4.535554       3.693868 6.489637       5.469811 18.58962 6.554518 21.68434 7.934423 -3.094721      10.29159 
1 1 1 -26 14 2  o 13.44815 5.390381 1.465257       2.686343 -0.5426409     3.449182 4.561105       4.282872 12.65331 5.614040 19.00113 7.009447 -6.347826      8.980523 
1 1 1 -26 14 3  o 23.24746 6.294574 7.606762       3.652862 2.994190       6.073754 10.22056       4.572165 18.94921 7.905750 26.63329 6.966413 -7.684076      10.53716 
1 1 1 -26 14 4  o 50.09776 4.234925 32.33906       5.121731 26.69868       7.820535 36.57510       6.777389 42.88824 7.768724 52.45498 5.378069 -9.566734      9.448635 
1 1 1 -26 14 5  o 35.19719 4.452421 16.13582       3.733611 22.02642       6.020059 12.45379       4.759541 39.96172 6.397610 29.66670 6.737677 10.29502       9.291162 
1 1 1 -26 14 6  o 11.04103 5.020050 -1.373999      2.952378 1.832415       4.869063 -3.238343      3.712775 16.86120 7.059670 11.27516 5.298116 5.586032       8.826606 
1 1 1 -26 14 7  o 11.80880 5.288668 -0.9139416     3.136278 -2.380698      5.163638 -0.5654316E-01 3.947918 14.23974 6.536497 13.98283 6.111836 0.2569160      8.948762 
1 1 1 -26 14 8  o 21.94077 6.740583 6.712411       3.951063 7.891364       10.55734 6.520391       4.260694 25.24028 10.46772 21.68734 7.044137 3.552946       12.61717 
1 1 1 -26 14 9  o 16.15748 6.061154 2.900949       3.228122 -4.715662      5.414300 7.101831       4.020978 13.38983 6.324310 22.51286 6.776577 -9.123024      9.269244 
1 1 1 -26 14 10 o 78.04083 3.351815 76.55283       6.359521 88.16380       15.74643 74.28983       6.951694 77.80425 8.440091 76.59373 3.735710 1.210518       9.229879 
1 1 1 -26 14 11 o 35.44849 4.416063 16.31089       3.732284 17.58990       6.448697 15.66666       4.576716 34.76484 7.803810 34.05842 5.716688 0.7064209      9.673675 
1 1 1 -26 14 12 o 56.30651 3.794442 40.28199       5.176059 32.78157       7.425781 47.36995       7.218715 48.99490 6.370174 60.22778 4.962422 -11.23288      8.074945 
1 1 1 -26 14 13 o 27.37304 5.517581 10.16211       3.553245 14.40721       6.230939 8.116364       4.325496 31.13437 8.127018 23.89548 6.987931 7.238888       10.71819 
1 1 1 -26 14 14 o 33.14885 5.560310 14.81355       4.332728 6.561510       6.347109 22.01431       5.929040 22.37310 8.475648 40.06477 6.278877 -17.69167      10.54803 
1 1 1 -26 14 15 o 15.02995 6.164188 1.615260       3.607017 0.2575010      5.975012 2.393800       4.524471 16.92648 7.454853 16.95660 6.923144 -0.3011513E-01 10.17373 
1 1 1 -26 14 16 o 24.26741 5.852277 8.162217       3.420401 4.668224       6.451819 9.528106       4.033936 20.62654 8.323612 25.98939 6.410001 -5.362854      10.50574 
1 1 1 -26 14 17 o 11.19920 5.089624 -1.335478      3.030449 1.595258       5.917929 -2.377141      3.528134 17.70997 7.611914 11.42473 5.300436 6.285243       9.275552 
1 1 1 -26 14 18 o 31.71239 4.859210 13.37418       3.635703 9.668076       6.767798 14.87760       4.310510 25.22896 8.874017 33.08623 5.542021 -7.857264      10.46242 
1 1 1 -26 14 19 o 19.92137 6.711867 5.471475       3.857755 0.1729021      11.48486 6.145334       4.095725 21.28085 9.761081 20.89887 6.913197 0.3819790      11.96123 
1 1 1 -26 14 20 o 32.45959 4.736437 14.01044       3.636197 10.93688       6.276872 15.56287       4.460969 26.45304 8.546503 33.69155 5.632056 -7.238510      10.23537 
1 1 1 -26 14 21 o 11.43375 5.202106 -1.310565      3.177060 -3.290940      5.707422 -0.4213971     3.824353 14.25286 6.655717 13.28733 5.902510 0.9655285      8.895966 
1 1 1 -26 14 22 o 28.77273 5.818365 11.60623       3.939230 2.019843       7.459431 15.31351       4.638808 18.99414 8.348815 33.04088 5.981428 -14.04674      10.27036 
1 1 1 -26 14 23 o 35.02193 6.309973 17.47501       5.187175 14.57025       6.951849 21.12359       7.791249 29.71364 8.902698 36.03677 8.920329 -6.323126      12.60279 
1 1 1 -26 14 24 o 19.75397 6.755336 5.552574       3.909273 2.979684       6.116271 7.329638       5.083090 18.42609 7.823690 22.09101 7.696343 -3.664927      10.97469 
1 1 1 -26 14 25 o 11.16299 5.266640 -3.133521      3.735543 -2.243422      5.981313 -3.702709      4.783050 14.93705 6.920052 12.57784 5.941821 2.359206       9.120984 
1 1 1 -26 14 26 o 49.34664 4.092928 31.89914       4.877604 32.07582       7.483277 31.76863       6.431522 46.86327 6.746912 47.81985 5.626675 -0.9565849     8.785232 
1 1 1 -26 15 1  o 12.55425 5.189658 0.9503235      2.583354 -2.207353      3.286440 6.056595       4.179206 11.00387 5.108783 20.69984 6.985923 -9.695971      8.654639 
1 1 1 -26 15 2  o 53.02140 4.597329 36.82400       5.881444 32.46445       7.152944 45.92316       10.33392 48.42777 6.203410 55.87901 7.801276 -7.451237      9.967055 
1 1 1 -26 15 3  o 31.78267 5.083146 13.54969       3.804343 10.19094       6.482654 15.31404       4.698484 25.74578 8.700664 33.25288 6.019752 -7.507095      10.58012 
1 1 1 -26 15 4  o 14.35258 6.135499 0.7146640      3.806512 -6.178954      5.375602 7.647498       5.390871 12.57131 6.037671 23.02002 7.930787 -10.44871      9.967490 
1 1 1 -26 15 5  o 26.77847 5.618723 9.837823       3.549423 12.54104       5.493227 7.900294       4.650623 29.10481 7.647115 23.38470 7.334235 5.720116       10.59572 
1 1 1 -26 15 6  o 12.05461 5.351224 -0.5907845     3.137917 1.968072       4.874245 -2.401904      4.100700 16.90808 7.070244 12.46593 5.759235 4.442153       9.119054 
1 1 1 -26 15 7  o 30.16814 5.192457 12.20762       3.679636 11.47596       5.891680 12.67552       4.711522 27.62488 8.176162 29.94881 6.630938 -2.323923      10.52706 
1 1 1 -26 15 8  o 32.17802 5.674556 14.06873       4.287102 5.723509       10.88220 15.60186       4.664307 23.90317 10.29847 33.80272 5.875542 -9.899548      11.85666 
1 1 1 -26 15 9  o 22.44943 6.078351 7.019383       3.406265 -0.6445912     5.748731 11.16586       4.228484 16.05457 7.177355 28.26902 6.299339 -12.21445      9.549665 
1 1 1 -26 15 10 f 31.04877 5.656776 13.10244       4.122415 14.95600       6.241536 11.66818       5.490382 31.66803 8.066700 28.10705 7.760789 3.560982       11.19382 
1 1 1 -26 15 11 o 10.59573 4.997825 -3.185341      3.360313 -6.698802      5.379095 -0.9366837     4.303316 12.41192 5.981112 13.82291 6.192524 -1.410992      8.609359 
1 1 1 -26 15 12 o 36.82257 4.951153 17.92394       4.330317 16.06021       6.444563 19.45804       5.846949 32.77874 8.112277 37.27141 6.683012 -4.492664      10.51055 
1 1 1 -26 15 13 o 45.50077 4.257084 26.75092       4.665470 31.16274       7.227853 23.59982       6.108451 47.53722 6.401940 41.40984 6.247505 6.127380       8.945174 
1 1 1 -26 15 14 o 22.42064 6.060857 7.028626       3.389923 12.09405       6.194546 4.863153       4.050214 28.14954 8.396680 19.27261 6.856871 8.876925       10.84071 
1 1 1 -26 15 15 o 8.966067 4.370714 -5.113091      3.094736 -6.857648      5.829457 -4.428470      3.651831 12.96758 6.243202 10.44786 5.006895 2.519712       8.002910 
1 1 1 -26 15 16 o 14.48115 5.879365 1.649169       3.241260 -6.338175      5.856887 5.175323       3.891493 13.19425 6.327744 19.56159 6.738260 -6.367344      9.243620 
1 1 1 -26 15 17 o 32.53111 4.983214 14.15099       3.824796 8.304367       6.863984 16.78390       4.606188 23.80510 8.856647 35.11438 5.568568 -11.30928      10.46179 
1 1 1 -26 15 18 o 19.79726 6.137364 5.463889       3.266741 5.242451       6.070434 5.554158       3.875801 20.62439 8.156465 20.00307 6.727493 0.6213169      10.57294 
1 1 1 -26 15 19 o 22.47456 6.387447 7.244860       3.662677 21.73260       10.52361 5.248008       3.906946 34.37246 11.06277 19.53319 6.750609 14.83927       12.95977 
1 1 1 -26 15 20 o 16.09301 6.611772 2.210496       4.159184 0.000000       0.000000 2.210496       4.159184 ?        ?        16.09301 6.611772 0.000000       6.611772 
1 1 1 -26 15 21 o 17.13705 6.718043 3.308867       4.086386 2.137537       7.617681 3.782114       4.842022 19.15376 8.427308 18.23700 7.261272 0.9167576      11.12410 
1 1 1 -26 15 22 o 25.87953 6.440142 9.753220       4.045207 11.20076       6.539290 8.855930       5.148499 26.22005 8.737291 23.99737 7.739175 2.222675       11.67198 
1 1 1 -26 15 23 o 55.07955 3.870102 39.27667       5.161499 24.77938       7.380936 53.15106       7.220628 40.25717 7.805502 63.22885 4.720292 -22.97168      9.121788 
1 1 1 -26 15 24 o 25.70777 6.718935 9.850532       4.255329 7.921270       6.784282 11.10184       5.463737 22.69461 8.722222 26.46396 7.883891 -3.769348      11.75725 
1 1 1 -26 15 25 o 30.85599 5.983910 13.59999       4.337050 11.45616       6.688479 15.15541       5.697132 26.07728 8.837562 31.26891 7.560585 -5.191628      11.63035 
1 1 1 -26 16 1  o 30.08346 4.356610 11.97400       3.100978 8.743699       4.066928 16.46035       4.792827 24.43585 6.652442 34.29680 5.950223 -9.860947      8.925254 
1 1 1 -26 16 2  o 35.93934 4.162257 16.86988       3.578002 15.25316       4.284723 20.59462       6.503582 33.38276 5.455252 37.29746 7.416642 -3.914696      9.206863 
1 1 1 -26 16 3  o 16.86325 6.272585 3.447517       3.442593 9.809066       6.018658 0.3541687      4.196939 25.18593 8.381995 14.50424 6.321381 10.68169       10.49846 
1 1 1 -26 16 4  o 45.04869 4.022285 26.21936       4.369211 16.84170       7.170369 31.75761       5.510370 32.57205 8.818889 49.14911 4.656281 -16.57705      9.972651 
1 1 1 -26 16 5  o 15.12897 6.123584 1.938850       3.503770 3.154039       5.790104 1.236783       4.401023 18.66163 7.746845 15.58344 6.627397 3.078189       10.19490 
1 1 1 -26 16 6  o 15.88010 6.121708 2.705269       3.349044 2.956122       5.453022 2.553341       4.243705 18.23182 7.538580 16.66853 6.741940 1.563290       10.11355 
1 1 1 -26 16 7  o 24.56404 5.826035 8.406952       3.434362 6.829568       5.560353 9.379879       4.366907 22.07923 8.011756 25.45164 6.878500 -3.372412      10.55945 
1 1 1 -26 16 8  o 47.30238 4.235289 28.96520       4.830441 35.64268       7.255562 23.64938       6.473658 51.14044 5.931883 40.96607 6.717299 10.17437       8.961548 
1 1 1 -26 16 9  o 22.91808 7.414153 7.596895       4.722817 -5.449447      10.80435 10.67856       5.251062 18.83961 8.909021 26.77580 7.660583 -7.936192      11.74969 
1 1 1 -26 16 10 o 13.98497 5.944907 0.7634599      3.538501 0.9152058      5.527661 0.6581031      4.605896 16.74565 7.276962 15.41701 6.671301 1.328632       9.872205 
1 1 1 -26 16 11 o 43.23667 3.890078 24.00239       4.054928 20.50263       6.781960 25.94959       5.058724 37.31041 7.714094 44.43348 4.745277 -7.123070      9.056760 
1 1 1 -26 16 12 o 12.91008 5.561027 0.2908829      3.171796 -1.620197      5.427998 1.281768       3.908516 14.92906 6.795216 15.01844 6.309005 -0.8938026E-01 9.272459 
1 1 1 -26 16 13 o 19.27986 6.800409 4.951919       3.976496 -7.889449      5.853472 15.95721       5.418869 12.58028 6.104696 33.36029 6.893742 -20.78001      9.208202 
1 1 1 -26 16 14 o 11.84690 5.302723 -0.7979814     3.148148 -0.2479180     5.695248 -1.040005      3.777768 16.09177 7.172287 12.79427 5.761065 3.297501       9.199542 
1 1 1 -26 16 15 o 29.79356 5.351578 12.08091       3.742644 13.71932       6.767731 11.35910       4.492040 29.43138 8.775965 28.10474 6.661198 1.326637       11.01767 
1 1 1 -26 16 16 o 17.36822 6.186823 3.870478       3.298266 5.888626       5.877706 2.942908       3.984784 21.10510 8.116694 16.76588 6.615282 4.339224       10.47104 
1 1 1 -26 16 17 o 18.07067 6.269441 4.352285       3.371241 -1.329572      5.706309 7.398788       4.178409 15.34352 6.977382 22.53819 6.933197 -7.194667      9.836314 
1 1 1 -26 16 18 o 24.94801 6.067117 8.856261       3.652492 9.518884       6.515174 8.552557       4.410807 24.67455 8.704462 24.02689 7.064767 0.6476574      11.21065 
1 1 1 -26 16 19 o 13.64026 5.984663 0.6833384E-01  3.817189 0.000000       0.000000 0.6833384E-01  3.817189 ?        ?        13.64026 5.984663 0.000000       5.984663 
1 1 1 -26 16 20 o 18.80117 6.949848 4.688060       4.214068 11.03623       7.876365 2.142073       4.988038 25.76106 9.505163 16.83287 7.102374 8.928194       11.86557 
1 1 1 -26 16 21 o 24.98395 5.929942 8.907364       3.555901 5.646892       6.218902 10.49117       4.334347 20.68048 8.230813 26.67926 6.681923 -5.998777      10.60162 
1 1 1 -26 16 22 o 15.05016 6.282105 1.666250       3.837906 3.943924       9.922864 1.265587       4.161801 21.29158 9.479960 15.07172 6.428406 6.219856       11.45400 
1 1 1 -26 16 23 o 26.41539 7.697103 10.96293       5.256307 4.213623       6.460192 24.18312       9.041381 19.47308 8.140982 37.09020 9.841727 -17.61713      12.77244 
1 1 1 -26 16 24 o 13.48865 5.741144 0.8774056      3.307292 -2.535957      5.711600 2.599212       4.056567 14.41221 6.706039 16.16715 6.572392 -1.754946      9.389744 
1 1 1 -26 17 1  o 15.45425 5.445862 3.052551       2.549680 4.077603       3.279915 1.487184       4.053197 17.46830 6.174810 15.15296 6.398396 2.315346       8.892006 
1 1 1 -26 17 2  o 18.90195 5.586351 4.998199       2.752029 4.843264       3.452860 5.268041       4.556785 18.69595 6.349626 19.62480 7.231761 -0.9288559     9.623727 
1 1 1 -26 17 3  o 60.57325 4.031869 47.53483       5.917579 38.95337       8.479592 55.68170       8.262088 52.02683 6.854847 64.19219 5.329699 -12.16536      8.683007 
1 1 1 -26 17 4  o 16.04244 6.253896 2.784436       3.524996 7.319660       5.445834 -0.4859021     4.624464 22.29644 7.949009 14.41102 6.440353 7.885417       10.23059 
1 1 1 -26 17 5  o 13.72449 5.862535 0.7089375      3.470587 3.276474       5.459933 -1.031807      4.495693 18.34652 7.560464 13.86734 6.260801 4.479175       9.816223 
1 1 1 -26 17 6  f 8.615230 4.243136 -6.103517      3.155790 -1.407158      4.743835 -9.831792      4.226715 13.99976 6.364547 9.312072 4.641789 4.687693       7.877414 
1 1 1 -26 17 7  o 27.33104 5.987807 10.50153       3.877542 10.10961       5.664614 10.84709       5.319030 25.65468 8.100996 26.73558 7.729023 -1.080896      11.19660 
1 1 1 -26 17 8  o 25.39822 5.763218 9.008678       3.484937 9.619717       5.703657 8.644674       4.402229 25.08507 8.150305 24.26675 7.036260 0.8183212      10.76738 
1 1 1 -26 17 9  o 43.11607 4.555423 24.42040       4.714061 40.98717       12.44876 21.64710       5.093370 49.00622 10.72282 40.03379 5.355048 8.972427       11.98563 
1 1 1 -26 17 10 o 23.24960 6.109540 7.663047       3.505987 7.327820       6.104259 7.828069       4.282858 22.59537 8.362318 23.17016 6.998024 -0.5747948     10.90416 
1 1 1 -26 17 11 o 12.44872 5.412718 0.6427098E-01  3.061801 4.451967       5.385957 -2.030727      3.721658 19.44981 7.685719 11.95677 5.510612 7.493043       9.457120 
1 1 1 -26 17 12 o 16.00361 6.050209 2.930931       3.230329 4.597291       5.587045 2.094142       3.959185 19.70659 7.814970 15.81812 6.469399 3.888477       10.14529 
1 1 1 -26 17 13 o 13.49674 5.905035 0.5104873E-01  3.693037 -6.402201      5.512853 5.304595       4.974088 12.60046 6.067684 20.05446 7.523636 -7.453996      9.665500 
1 1 1 -26 17 14 o 15.16415 5.959345 2.306561       3.222321 0.2942317      5.793281 3.208022       3.877469 16.45389 7.289316 16.92673 6.570216 -0.4728470     9.813352 
1 1 1 -26 17 15 o 18.23193 6.339382 4.461212       3.447797 3.620646       6.275454 4.824638       4.126366 19.25431 8.034714 19.02592 6.902062 0.2283936      10.59222 
1 1 1 -26 17 16 o 57.68717 3.760722 42.75508       5.257903 27.93599       7.647518 56.03963       7.240740 43.41984 7.498655 65.28032 4.580679 -21.86048      8.787062 
1 1 1 -26 17 17 o 15.20184 6.226570 1.925911       3.674339 -0.1530891     7.304503 2.630166       4.251365 17.60278 7.960694 16.56973 6.731196 1.033045       10.42505 
1 1 1 -26 17 18 o 44.01018 4.798252 25.84672       5.062785 17.45741       8.564195 30.35347       6.277038 31.45709 9.964361 47.03105 5.585868 -15.57397      11.42324 
1 1 1 -26 17 19 o 26.28286 7.336068 10.51786       4.876865 -5.684791      10.29062 15.21091       5.538296 17.79995 8.496105 31.78643 7.303488 -13.98648      11.20378 
1 1 1 -26 17 20 f 17.86124 6.336161 4.294229       3.456142 -2.709904      5.825566 8.098459       4.293331 14.55524 6.772600 23.23931 7.003884 -8.684068      9.742818 
1 1 1 -26 17 21 o 16.26008 6.138046 3.211161       3.321974 3.284062       5.613388 3.171868       4.121102 18.19522 7.596390 16.88239 6.706423 1.312834       10.13318 
1 1 1 -26 17 22 o 37.70581 5.116982 19.41221       4.580513 19.05768       6.723430 19.71929       6.257306 34.67387 8.103481 36.04655 7.372280 -1.372681      10.95522 
1 1 1 -26 18 1  o 12.92154 5.285665 1.282087       2.643453 2.325772       3.264295 -0.7063369     4.505670 15.02521 5.968683 13.89682 6.271514 1.128392       8.657776 
1 1 1 -26 18 2  o 27.03046 6.342753 10.67731       4.105645 9.003066       5.984114 12.16632       5.643375 23.73686 8.344812 27.62144 7.953917 -3.884575      11.52826 
1 1 1 -26 18 3  o 18.35008 7.018560 4.315501       4.378549 2.745846       5.513045 6.997109       7.205881 17.70331 7.468071 22.05691 8.832700 -4.353601      11.56670 
1 1 1 -26 18 4  o 30.31998 5.560502 12.79765       3.957103 13.60072       6.569502 12.34037       4.957307 28.79681 8.660453 28.64182 7.130343 0.1549911      11.21808 
1 1 1 -26 18 5  o 18.19551 6.384983 4.485889       3.502269 0.5338119      5.583998 7.048689       4.496658 16.23002 7.174912 21.82367 7.244539 -5.593645      10.19621 
1 1 1 -26 18 6  o 12.30024 5.443772 -0.3311106     3.223259 1.341600       5.545194 -1.184678      3.961187 16.78803 7.291998 12.87823 5.839341 3.909807       9.341903 
1 1 1 -26 18 7  o 18.74007 6.253047 4.861035       3.349147 2.568235       5.381768 6.310203       4.278594 17.60286 7.399441 20.91844 7.068490 -3.315578      10.23305 
1 1 1 -26 18 8  o 11.51853 5.183301 -0.8840196     3.052495 0.9000564      4.947304 -1.980697      3.878835 15.83637 6.883071 12.21057 5.626932 3.625799       8.890389 
1 1 1 -26 18 9  o 14.61070 6.196217 1.119425       3.828505 6.790751       12.12944 0.4918890      4.034762 23.93426 10.57798 14.33319 6.222953 9.601070       12.27268 
1 1 1 -26 18 10 o 42.40653 3.916745 23.27843       4.001854 13.42158       6.247864 30.13549       5.211119 29.10463 8.365375 47.83919 4.523769 -18.73456      9.510204 
1 1 1 -26 18 11 o 28.61549 5.376881 11.26964       3.611825 8.700484       5.891453 12.81669       4.571727 23.80220 8.286168 29.83833 6.473849 -6.036129      10.51529 
1 1 1 -26 18 12 o 16.02895 6.016465 3.042941       3.181685 2.088324       5.367755 3.560002       3.950472 17.21136 7.319434 17.32790 6.656779 -0.1165409     9.893777 
1 1 1 -26 18 13 o 31.15603 5.978640 13.66621       4.374175 6.001726       6.125490 21.64131       6.248375 21.07704 8.236132 38.60076 6.895625 -17.52372      10.74167 
1 1 1 -26 18 14 o 36.23264 4.535319 17.41288       3.916983 11.40520       6.268013 21.26226       5.017322 26.63650 8.534407 39.48897 5.351465 -12.85247      10.07344 
1 1 1 -26 18 15 o 68.66105 3.884355 60.84794       6.472774 41.05986       10.53642 72.84252       8.203207 50.93578 8.807099 74.38318 4.547295 -23.44740      9.911756 
1 1 1 -26 18 16 o 22.95776 7.047216 7.866769       4.319818 16.04109       7.654166 4.046161       5.232852 30.67767 9.373816 18.70418 7.514281 11.97349       12.01386 
1 1 1 -26 18 17 o 23.05705 6.738658 7.870167       4.023467 5.076407       5.862017 10.35855       5.532364 19.98769 7.979210 25.64034 7.993062 -5.652651      11.29411 
1 1 1 -26 18 18 o 13.36607 5.741805 0.6120873      3.363893 -0.6198439     5.264804 1.461979       4.372913 15.04156 6.784511 15.50855 6.601248 -0.4669924     9.466048 
1 1 1 -26 18 19 o 12.61289 5.695947 -0.9229607     3.723939 -9.536945      9.467810 0.6535688      4.050406 15.83316 7.701705 14.37238 6.237521 1.460781       9.910748 
1 1 1 -26 18 20 o 38.27085 4.385644 19.43745       4.016336 16.82523       6.639412 20.94501       5.043852 32.21712 8.379054 38.90451 5.471126 -6.687386      10.00709 
1 1 1 -26 18 21 o 35.98882 5.469340 17.98676       4.645885 20.93672       7.243363 15.92495       6.055577 36.02350 8.405548 31.77290 7.863818 4.250595       11.51055 
1 1 1 -26 19 1  o 10.94400 4.842859 -0.2877758     2.550069 -1.649187      3.240358 1.927108       4.133081 11.14308 5.137886 15.47927 6.494208 -4.336188      8.280858 
1 1 1 -26 19 2  o 18.40524 6.335925 4.785821       3.440470 7.282245       5.518387 3.198471       4.400373 21.73935 7.967152 17.01599 6.871428 4.723368       10.52103 
1 1 1 -26 19 3  o 10.29888 4.872888 -2.966345      3.240665 -3.753750      5.219073 -2.472269      4.134197 13.13080 6.204157 12.19715 5.685418 0.9336500      8.415197 
1 1 1 -26 19 4  o 12.63289 5.577398 -0.1293607     3.363668 2.661629       5.436708 -1.860275      4.281488 17.48490 7.398052 12.82733 5.911376 4.657571       9.469717 
1 1 1 -26 19 5  o 25.23230 6.063129 9.201250       3.681575 10.83555       6.215731 8.318070       4.569311 25.69633 8.517074 23.33253 7.262637 2.363806       11.19314 
1 1 1 -26 19 6  o 13.25831 5.730382 0.4761282      3.390269 -3.103229      5.565238 2.588304       4.275099 13.98879 6.545418 16.42543 6.720723 -2.436638      9.381397 
1 1 1 -26 19 7  o 27.14411 5.872170 10.47941       3.771188 3.259705       6.526803 14.09771       4.620544 18.88973 8.053391 31.30211 6.276031 -12.41238      10.21008 
1 1 1 -26 19 8  o 22.57490 6.117298 7.367901       3.448385 10.14185       5.508574 5.580333       4.422025 25.34671 7.986649 19.88315 7.154172 5.463566       10.72235 
1 1 1 -26 19 9  o 31.40899 5.960511 13.96021       4.395350 10.51895       11.77280 14.51758       4.737945 25.27607 10.79722 31.75911 6.344036 -6.483034      12.52305 
1 1 1 -26 19 10 o 24.67426 6.034268 8.742390       3.597695 9.678501       5.744615 8.138292       4.614772 24.73193 8.187599 23.18955 7.310462 1.542387       10.97632 
1 1 1 -26 19 11 o 39.51308 4.145690 20.45899       3.932474 18.31208       6.415625 21.75104       4.977062 34.45934 7.819887 39.95718 5.237388 -5.497841      9.411740 
1 1 1 -26 19 12 o 13.78597 5.778863 1.155478       3.268414 -2.504018      5.387842 3.286296       4.111284 14.11007 6.547590 17.05556 6.722590 -2.945498      9.384250 
1 1 1 -26 19 13 o 34.32224 6.085770 16.70261       4.903756 17.09771       7.568782 16.41678       6.437641 31.76696 9.230543 32.18655 8.189045 -0.4195824     12.33951 
1 1 1 -26 19 14 o 19.46465 6.922855 5.312544       4.128216 1.604539       6.624668 7.666601       5.278402 17.87281 7.861462 22.45220 7.841461 -4.579388      11.10365 
1 1 1 -26 19 15 o 21.09040 6.776012 6.530347       3.949274 3.325836       5.847238 9.218393       5.355355 18.44437 7.730385 24.25772 7.898685 -5.813347      11.05206 
1 1 1 -26 19 16 o 21.92377 6.288725 7.010898       3.534308 7.586070       5.505913 6.607803       4.609292 22.30305 7.988055 21.13688 7.330926 1.166178       10.84212 
1 1 1 -26 19 17 o 45.26149 3.861996 26.62852       4.219024 20.34544       6.789782 30.58033       5.384769 36.09308 7.936109 47.84638 4.677997 -11.75330      9.212246 
1 1 1 -26 19 18 o 18.80482 6.394830 4.999931       3.502326 -1.652165      5.655597 9.137794       4.460538 14.82805 6.819106 24.48398 7.077786 -9.655931      9.828290 
1 1 1 -26 19 19 o 18.84214 6.885089 4.915560       4.116600 -10.07373      10.07956 7.916282       4.509869 16.12862 7.867908 22.74787 7.233858 -6.619244      10.68797 
1 1 1 -26 20 1  o 13.25754 5.538209 1.215027       2.986275 -0.9873731     4.201214 3.464206       4.245596 13.14236 5.980504 17.02498 6.792531 -3.882624      9.050133 
1 1 1 -26 20 2  o 13.71855 5.821863 1.094026       3.383803 2.459600       5.387393 0.2042969      4.348604 17.07521 7.299291 14.23911 6.311382 2.836108       9.649518 
1 1 1 -26 20 3  o 18.33624 6.489302 4.737391       3.623402 7.875271       5.906342 2.843768       4.588252 22.27297 8.228768 16.77743 6.923973 5.495539       10.75426 
1 1 1 -26 20 4  o 15.00195 6.376225 1.460665       4.069491 -3.316252      5.923224 5.731344       5.600578 14.21257 6.682624 20.16084 7.876146 -5.948277      10.32914 
1 1 1 -26 20 5  o 32.94476 4.975673 14.84373       3.870226 13.06632       6.684294 15.74011       4.746849 27.67120 8.807590 33.07061 6.115355 -5.399418      10.72246 
1 1 1 -26 20 6  o 19.47011 6.586570 5.472323       3.715099 10.57200       6.515209 3.015244       4.522377 25.13744 8.715918 16.97944 6.925676 8.157993       11.13248 
1 1 1 -26 20 7  o 27.78886 5.942692 11.07728       3.902458 6.868423       6.749314 13.19104       4.783042 21.65717 8.589157 29.76706 6.749774 -8.109890      10.92397 
1 1 1 -26 20 8  o 17.06993 6.209836 3.824932       3.343368 2.969975       5.291968 4.392883       4.313208 17.62166 7.367686 18.32748 6.976642 -0.7058182     10.14674 
1 1 1 -26 20 9  o 14.63630 6.368471 0.6946347      4.244941 0.000000       0.000000 0.6946347      4.244941 ?        ?        14.63630 6.368471 0.000000       6.368471 
1 1 1 -26 20 10 o 35.60971 4.962925 17.22166       4.189826 6.250308       7.187624 22.86849       5.156533 21.36596 8.724985 40.81256 5.310572 -19.44660      10.21409 
1 1 1 -26 20 11 o 12.51077 5.721116 -1.459626      3.905807 7.720273       6.653007 -6.287481      4.824764 22.46744 8.636777 11.45709 5.555602 11.01035       10.26931 
1 1 1 -26 20 12 o 13.21224 5.827036 -0.2944239E-01 3.662354 1.802172       5.474083 -1.513615      4.927613 16.88323 7.289260 13.99410 6.409436 2.889132       9.706399 
1 1 1 -26 20 13 o 17.73378 7.004805 3.747480       4.472263 3.061946       5.502643 5.081546       7.676186 17.88286 7.497364 20.71511 8.778896 -2.832258      11.54467 
1 1 1 -26 20 14 o 40.64437 4.142694 21.72763       4.045868 17.30774       6.613567 24.37100       5.114562 32.76831 8.280180 42.33519 5.057520 -9.566875      9.702571 
1 1 1 -26 20 15 o 16.03078 6.265588 2.913440       3.545642 -0.4092053     5.761909 4.938400       4.498136 15.65510 7.076010 19.02420 7.150931 -3.369103      10.06011 
1 1 1 -26 20 16 o 15.72075 6.224096 2.666644       3.538454 5.741315       6.080699 1.092402       4.351008 20.45258 8.139257 15.06983 6.502449 5.382751       10.41774 
1 1 1 -26 20 17 o 70.15816 3.190032 62.66787       5.439658 46.42155       8.527925 73.81242       7.063125 57.03154 6.237706 75.41512 3.856084 -18.38358      7.333373 
1 1 1 -26 21 1  o 47.61388 4.472571 30.51883       5.128751 30.25976       6.768710 30.86809       7.859121 45.44350 6.279883 44.35487 7.540690 1.088638       9.813202 
1 1 1 -26 21 2  o 11.24813 5.201457 -1.722319      3.356282 -0.8887885E-01 5.507366 -2.687371      4.233187 15.31991 6.921851 12.10746 5.679073 3.212453       8.953429 
1 1 1 -26 21 3  o 35.06644 4.917354 16.89265       4.086708 12.56243       6.674090 19.49013       5.169079 26.70894 8.824485 36.77537 5.972665 -10.06643      10.65571 
1 1 1 -26 21 4  o 25.42050 7.229173 10.15473       4.690155 9.618614       6.720770 10.66368       6.548352 23.76210 8.777992 24.85787 8.730126 -1.095764      12.38016 
1 1 1 -26 21 5  f 17.24913 6.371369 3.979200       3.540583 7.789649       6.101116 2.044374       4.347526 22.11993 8.325274 15.78063 6.643007 6.339305       10.65081 
1 1 1 -26 21 6  o 13.42868 5.844012 0.4775542      3.575847 1.541171       6.118508 -0.7418727E-01 4.406773 17.09084 7.534883 14.13589 6.304220 2.954943       9.824340 
1 1 1 -26 21 7  o 12.14720 5.585407 -1.610709      3.792351 2.957976       6.172584 -4.380932      4.806497 18.13566 7.784091 12.18899 5.814767 5.946666       9.716150 
1 1 1 -26 21 8  o 18.41500 6.808925 4.662614       4.045380 1.715018       6.345755 6.680631       5.250634 17.44823 7.683727 21.04404 7.761429 -3.595810      10.92151 
1 1 1 -26 21 9  o 8.977925 4.535089 -14.01645      4.759562 -33.49151      11.46472 -9.961008      5.231705 13.06035 6.643543 10.73961 5.321155 2.320739       8.511836 
1 1 1 -26 21 10 o 18.59981 6.540845 4.881680       3.676697 4.515459       5.373112 5.204149       5.041943 18.94175 7.612727 19.45638 7.508352 -0.5146313     10.69247 
1 1 1 -26 21 11 o 21.01242 6.323368 6.503252       3.501443 3.383634       5.579733 8.529756       4.497140 18.09610 7.565653 23.51139 7.185349 -5.415293      10.43400 
1 1 1 -26 21 12 o 21.86969 6.397526 7.087801       3.624961 7.325328       6.045171 6.954438       4.529698 21.84330 8.272359 21.40836 7.272637 0.4349346      11.01468 
1 1 1 -26 21 13 o 34.86208 5.492410 16.96964       4.511841 10.51286       6.108003 24.72368       6.693535 25.17427 8.445248 40.70362 7.000536 -15.52935      10.96949 
1 1 1 -26 21 14 o 32.82580 4.997652 14.75566       3.871767 16.48629       6.378577 13.74602       4.871953 31.91730 8.167885 30.32020 6.765666 1.597094       10.60606 
1 1 1 -25 0  1  f 110.7759 3.544769 151.0915       9.546853 151.0915       9.546853 151.0915       9.546853 110.7759 3.544769 110.7759 3.544769 0.000000       0.000000 
1 1 1 -25 0  2  o 121.8324 3.631299 182.6877       10.75935 182.6877       10.75935 182.6877       10.75935 121.8324 3.631299 121.8324 3.631299 0.000000       0.000000 
1 1 1 -25 0  3  o 15.59783 7.552832 4.484128       3.349373 4.484128       3.349373 4.484128       3.349373 15.59783 7.552832 15.59783 7.552832 -0.000000      0.000000 
1 1 1 -25 0  4  o 17.35325 7.867613 5.462868       3.589398 5.462868       3.589398 5.462868       3.589398 17.35325 7.867613 17.35325 7.867613 0.000000       0.000000 
1 1 1 -25 0  5  o 44.52951 4.383613 25.08221       4.643487 25.08221       4.643487 25.08221       4.643487 44.52951 4.383613 44.52951 4.383613 0.000000       0.000000 
1 1 1 -25 0  6  o 35.55054 5.044042 16.47716       4.116210 16.47716       4.116210 16.47716       4.116210 35.55054 5.044042 35.55054 5.044042 -0.000000      0.000000 
1 1 1 -25 0  7  o 13.22375 7.868068 2.470477       4.439260 2.470477       4.439260 2.470477       4.439260 13.22375 7.868068 13.22375 7.868068 0.000000       0.000000 
1 1 1 -25 0  8  o 74.94662 4.489525 69.84119       8.131490 69.84119       8.131490 69.84119       8.131490 74.94662 4.489525 74.94662 4.489525 -0.000000      0.000000 
1 1 1 -25 0  9  o 27.96929 6.363197 11.02923       3.780153 11.02923       3.780153 11.02923       3.780153 27.96929 6.363197 27.96929 6.363197 -0.000000      0.000000 
1 1 1 -25 0  10 o 84.76796 4.369462 89.06483       8.970967 89.06483       8.970967 89.06483       8.970967 84.76796 4.369462 84.76796 4.369462 0.000000       0.000000 
1 1 1 -25 0  11 o 131.2530 4.481671 212.7389       14.29667 212.7389       14.29667 212.7389       14.29667 131.2530 4.481671 131.2530 4.481671 -0.000000      0.000000 
1 1 1 -25 0  12 o 152.1681 4.645216 286.0110       17.18889 286.0110       17.18889 286.0110       17.18889 152.1681 4.645216 152.1681 4.645216 0.000000       0.000000 
1 1 1 -25 0  13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -25 0  14 o 46.10405 5.440125 27.34547       5.888769 27.34547       5.888769 27.34547       5.888769 46.10405 5.440125 46.10405 5.440125 -0.000000      0.000000 
1 1 1 -25 0  15 o 20.52381 11.82423 7.407188       9.498607 7.407188       9.498607 7.407188       9.498607 20.52381 11.82423 20.52381 11.82423 -0.000000      0.000000 
1 1 1 -25 0  16 o 115.7045 7.036888 169.5607       19.67131 169.5607       19.67131 169.5607       19.67131 115.7045 7.036888 115.7045 7.036888 -0.000000      0.000000 
1 1 1 -25 0  17 o 63.82547 4.803993 51.16227       7.372259 51.16227       7.372259 51.16227       7.372259 63.82547 4.803993 63.82547 4.803993 0.000000       0.000000 
1 1 1 -25 0  18 o 151.2928 4.690933 283.7042       17.25706 283.7042       17.25706 283.7042       17.25706 151.2928 4.690933 151.2928 4.690933 0.000000       0.000000 
1 1 1 -25 0  19 o 21.96609 9.155281 8.619246       4.895459 8.619246       4.895459 8.619246       4.895459 21.96609 9.155281 21.96609 9.155281 0.000000       0.000000 
1 1 1 -25 0  20 o 15.50627 8.609811 4.338540       4.795240 4.338540       4.795240 4.338540       4.795240 15.50627 8.609811 15.50627 8.609811 -0.000000      0.000000 
1 1 1 -25 0  21 o 62.96996 6.264271 51.17336       9.378093 51.17336       9.378093 51.17336       9.378093 62.96996 6.264271 62.96996 6.264271 -0.000000      0.000000 
1 1 1 -25 0  22 o 8.436206 5.903944 -4.308894      4.524913 -4.308894      4.524913 -4.308894      4.524913 8.436206 5.903944 8.436206 5.903944 0.000000       0.000000 
1 1 1 -25 0  23 o 20.19658 9.345470 7.746792       5.074543 7.746792       5.074543 7.746792       5.074543 20.19658 9.345470 20.19658 9.345470 -0.000000      0.000000 
1 1 1 -25 0  24 o 15.48671 8.734414 4.386048       5.031016 4.386048       5.031016 4.386048       5.031016 15.48671 8.734414 15.48671 8.734414 0.000000       0.000000 
1 1 1 -25 0  25 o 18.82342 9.563712 7.007740       5.486988 7.007740       5.486988 7.007740       5.486988 18.82342 9.563712 18.82342 9.563712 0.000000       0.000000 
1 1 1 -25 0  26 o 14.50990 8.629558 3.422750       5.335793 3.422750       5.335793 3.422750       5.335793 14.50990 8.629558 14.50990 8.629558 0.000000       0.000000 
1 1 1 -25 0  27 o 19.66919 9.635429 7.705758       5.473745 7.705758       5.473745 7.705758       5.473745 19.66919 9.635429 19.66919 9.635429 -0.000000      0.000000 
1 1 1 -25 0  28 o 10.41999 7.342117 -7.152665      7.366948 -7.152665      7.366948 -7.152665      7.366948 10.41999 7.342117 10.41999 7.342117 -0.000000      0.000000 
1 1 1 -25 0  29 o 11.85960 7.826868 -0.2843425     5.830882 -0.2843425     5.830882 -0.2843425     5.830882 11.85960 7.826868 11.85960 7.826868 0.000000       0.000000 
1 1 1 -25 0  30 o 8.538568 6.035027 -5.496406      5.103128 -5.496406      5.103128 -5.496406      5.103128 8.538568 6.035027 8.538568 6.035027 -0.000000      0.000000 
1 1 1 -25 0  31 o 15.84523 9.133753 4.951716       5.672413 4.951716       5.672413 4.951716       5.672413 15.84523 9.133753 15.84523 9.133753 -0.000000      0.000000 
1 1 1 -25 0  32 o 11.10238 7.296172 0.5236894E-01  4.984576 0.5236894E-01  4.984576 0.5236894E-01  4.984576 11.10238 7.296172 11.10238 7.296172 -0.000000      0.000000 
1 1 1 -25 0  33 o 22.79719 10.93053 11.33572       6.993731 11.33572       6.993731 11.33572       6.993731 22.79719 10.93053 22.79719 10.93053 0.000000       0.000000 
1 1 1 -25 0  34 f 19.99363 9.616253 8.457825       5.417935 8.457825       5.417935 8.457825       5.417935 19.99363 9.616253 19.99363 9.616253 0.000000       0.000000 
1 1 1 -25 1  1  f 40.74765 3.116466 20.58035       3.071093 17.14073       4.247441 24.34857       4.445702 36.69890 4.869448 44.05660 4.191319 -7.357700      6.424848 
1 1 1 -25 1  2  o 68.69720 2.538847 58.00233       4.242912 61.35877       6.051489 54.75692       5.950552 70.37686 3.539916 66.42526 3.690613 3.951599       5.113866 
1 1 1 -25 1  3  o 58.21398 2.751804 41.72485       3.892690 42.41922       5.713336 41.12324       5.318080 58.35043 4.042998 57.51739 3.815768 0.8330345      5.559309 
1 1 1 -25 1  4  o 97.14972 2.576457 115.8861       6.094205 116.6702       9.117990 115.2530       8.193034 97.01569 3.864478 96.57680 3.486979 0.4388885      5.205114 
1 1 1 -25 1  5  o 20.75405 4.997715 5.591845       2.497243 6.299273       3.636007 4.960191       3.435764 22.02063 6.397506 19.86916 6.313404 2.151468       8.988168 
1 1 1 -25 1  6  o 101.1140 2.924200 125.7513       7.197773 125.1694       8.680837 127.0317       12.87578 100.6591 3.544466 100.5793 5.271664 0.7981873E-01  6.352455 
1 1 1 -25 1  7  o 22.84489 5.305764 6.787082       2.897046 6.761127       3.581040 6.836245       4.928504 22.75080 6.262200 23.26489 7.577501 -0.5140896     9.830243 
1 1 1 -25 1  8  o 24.16438 5.090909 7.555399       2.903053 -0.5285547     4.682344 12.60327       3.700034 15.32201 6.677377 31.41788 5.000136 -16.09587      8.341986 
1 1 1 -25 1  9  o 37.46201 3.697705 17.49098       3.331694 14.21873       5.445899 19.44827       4.211854 32.80578 7.023981 39.32771 4.474254 -6.521923      8.327980 
1 1 1 -25 1  10 f 71.57432 2.757029 62.98115       4.799785 64.04198       7.906042 62.36193       6.040331 71.63014 4.552821 71.02774 3.500552 0.6024017      5.743000 
1 1 1 -25 1  11 o 13.07646 5.592542 0.3621560E-01  3.165236 -3.115066      4.456859 3.243145       4.496037 13.10895 6.037573 18.59319 7.111962 -5.484237      9.329110 
1 1 1 -25 1  12 o 30.04871 5.124148 11.58550       3.617704 12.76322       5.290924 10.55144       4.957726 30.99227 7.150940 28.16374 7.197561 2.828526       10.14598 
1 1 1 -25 1  13 o 107.9093 3.029588 143.3559       7.958817 146.2281       11.50314 140.7185       11.02314 108.3902 4.363942 106.3778 4.260862 2.012375       6.099093 
1 1 1 -25 1  14 o 85.88235 3.054667 90.88701       6.382807 96.68788       9.191709 85.48486       8.870179 88.10867 4.293893 82.78417 4.412868 5.324501       6.157185 
1 1 1 -25 1  15 o 140.5342 3.818868 244.7424       13.06622 237.9942       15.46113 261.6056       24.44085 138.0600 4.601978 142.4567 7.062422 -4.396622      8.429472 
1 1 1 -25 1  16 o 13.52204 6.045435 -1.425534      4.078971 1.344028       9.828524 -2.001808      4.483296 22.78475 9.801585 13.83972 6.249888 8.945039       11.62464 
1 1 1 -25 1  17 f 34.85676 4.796476 15.48297       3.966322 19.71227       5.931507 12.06238       5.334348 38.77317 6.508018 29.91510 7.366916 8.858068       9.829840 
1 1 1 -25 1  18 o 37.79189 4.448186 18.07887       4.018180 19.88000       5.858654 16.47910       5.521455 38.93153 6.397341 35.26648 6.668984 3.665058       9.241283 
1 1 1 -25 1  19 o 84.69044 3.073375 88.65739       6.332355 96.19511       9.200216 81.87207       8.728962 87.61880 4.322223 80.74818 4.453267 6.870621       6.205900 
1 1 1 -25 1  20 o 88.36754 3.061598 96.58221       6.582949 96.77969       9.390718 96.39140       9.230735 87.76520 4.404847 87.62946 4.336117 0.1357422      6.180986 
1 1 1 -25 1  21 o 20.30618 6.756518 5.238189       3.910712 4.330825       6.530223 5.745570       4.883193 21.35739 8.455498 21.52317 7.540406 -0.1657810     11.32931 
1 1 1 -25 1  22 o 18.32015 6.758391 3.746465       3.981607 3.663668       5.378839 3.846826       5.921944 19.59266 7.699508 20.28265 8.045025 -0.6899891     11.13575 
1 1 1 -25 1  23 o 25.10694 6.002426 8.498336       3.622594 14.43920       5.441321 3.768939       4.854923 32.40250 7.088720 19.11481 7.370098 13.28769       10.22586 
1 1 1 -25 1  24 o 28.16398 5.739738 10.62792       3.805503 15.08688       5.653577 6.933986       5.145780 32.94125 7.240643 22.79487 7.751337 10.14638       10.60708 
1 1 1 -25 1  25 o 13.26792 5.842382 -0.4929316     3.668106 -2.873308      5.144011 1.969651       5.232082 14.08293 6.486217 17.64705 7.348060 -3.564125      9.801275 
1 1 1 -25 1  26 o 23.05438 6.616674 7.353449       3.911507 4.641376       5.497605 10.13387       5.566449 20.29591 7.838174 26.53594 7.969994 -6.240028      11.17845 
1 1 1 -25 1  27 o 17.55225 6.575290 3.509520       3.796250 8.100485       5.533463 -0.5726592     5.217844 23.94418 8.038307 15.53689 6.898572 8.407281       10.59267 
1 1 1 -25 1  28 o 14.87477 6.548962 -0.1960568     4.607395 -2.366495      5.793593 3.538391       7.599542 15.13888 6.939764 20.75461 8.762356 -5.615733      11.17762 
1 1 1 -25 1  29 o 44.56608 5.049054 26.27547       5.386915 33.92841       10.68369 23.66652       6.237916 46.18803 9.796018 41.32489 6.401119 4.863144       11.70198 
1 1 1 -25 1  30 o 33.86359 5.409417 15.55483       4.313822 13.16458       6.238862 17.74444       5.971264 29.15006 8.353350 34.88336 7.260914 -5.733297      11.06794 
1 1 1 -25 1  31 o 11.82043 5.492280 -2.422680      3.810063 -7.629412      5.147035 3.888924       5.666885 11.54460 5.629653 19.02116 7.754849 -7.476561      9.582832 
1 1 1 -25 1  32 o 15.81975 6.356522 2.463439       3.745225 1.230165       5.304316 3.689515       5.288815 16.40210 7.128045 18.40623 7.496368 -2.004133      10.34430 
1 1 1 -25 1  33 o 35.48368 6.745605 18.48500       5.619774 15.95273       7.699797 21.37162       8.220892 30.21687 9.431220 35.32698 9.389472 -5.110115      13.30827 
1 1 1 -25 1  34 o 12.01291 5.481373 -1.273650      3.559735 -3.561634      5.242506 0.6837067      4.848948 13.23250 6.241845 15.29324 6.726354 -2.060738      9.176299 
1 1 1 -25 2  1  o 37.90391 3.344988 17.87361       3.058016 13.63211       4.269505 22.34171       4.382068 32.42679 5.605760 42.14051 4.328680 -9.713722      7.082515 
1 1 1 -25 2  2  o 69.05178 2.671384 58.66093       4.486703 61.59724       6.597652 56.13473       6.119595 70.39812 3.860628 67.23268 3.749992 3.165436       5.382090 
1 1 1 -25 2  3  o 123.8323 2.695162 188.3467       8.133076 195.4283       12.38774 182.9817       10.78243 125.4437 4.057693 121.6028 3.642729 3.840813       5.452921 
1 1 1 -25 2  4  o 27.75088 4.540858 9.821984       2.964688 12.35054       3.809732 5.939774       4.720605 30.99879 5.229146 21.97165 7.424631 9.027145       9.081251 
1 1 1 -25 2  5  o 60.11674 2.864989 44.50957       4.185071 46.02361       5.362576 42.15082       6.693398 60.93927 3.627521 57.94709 4.782549 2.992176       6.002640 
1 1 1 -25 2  6  o 61.01910 2.596483 45.75978       3.852065 48.27362       5.513065 43.36182       5.384494 62.42106 3.640110 59.11694 3.757074 3.304119       5.231252 
1 1 1 -25 2  7  o 48.36111 2.897599 28.83790       3.399182 27.27974       4.570601 30.76632       5.084735 46.76624 4.050452 49.63068 4.244905 -2.864441      5.867314 
1 1 1 -25 2  8  o 48.77227 2.856796 29.31726       3.380512 24.52237       4.469069 35.73005       5.168339 44.28809 4.190741 53.58735 3.986343 -9.299259      5.783877 
1 1 1 -25 2  9  o 65.01670 2.830163 52.01313       4.473330 45.35974       7.250217 56.10279       5.684250 60.07861 4.997371 67.36531 3.474325 -7.286701      6.086432 
1 1 1 -25 2  10 o 86.86630 2.684215 92.69216       5.675228 87.85043       9.217847 95.64785       7.202087 83.94005 4.523047 88.03968 3.363126 -4.099632      5.636362 
1 1 1 -25 2  11 o 83.74678 3.082220 86.39421       6.279519 87.27737       9.095703 85.58992       8.680034 83.67400 4.477068 82.92745 4.310027 0.7465439      6.214537 
1 1 1 -25 2  12 f 96.83104 3.024399 115.4347       7.127824 112.7227       10.26063 117.9640       9.909087 95.12198 4.438706 97.43157 4.183221 -2.309593      6.099299 
1 1 1 -25 2  13 o 29.18958 5.300009 10.99182       3.631182 12.88091       5.384480 9.416036       4.917735 31.08609 7.242814 26.61316 7.343608 4.472933       10.31440 
1 1 1 -25 2  14 o 20.68151 7.146517 5.114692       4.378594 8.238612       5.066121 -4.108700      8.705044 25.04748 7.620752 18.81251 8.579247 6.234970       11.47516 
1 1 1 -25 2  15 o 84.87102 3.090846 88.82807       6.381855 97.79642       9.499295 81.45029       8.615851 88.51440 4.417904 80.77104 4.393846 7.743362       6.230872 
1 1 1 -25 2  16 o 67.58839 3.251468 56.48471       5.339640 70.23845       8.048901 45.67384       7.136027 74.93588 4.427417 60.18779 4.907895 14.74809       6.609799 
1 1 1 -25 2  17 o 69.05472 3.878117 59.37189       6.499827 54.99937       13.14511 60.78695       7.477974 63.82960 8.675294 69.65099 4.428695 -5.821388      9.740332 
1 1 1 -25 2  18 o 15.39835 6.093996 1.841367       3.390806 -2.327945      4.992751 5.410759       4.619605 14.45052 6.553640 21.10131 7.337958 -6.650791      9.838487 
1 1 1 -25 2  19 o 54.35686 3.597458 36.80941       4.738446 28.96213       6.684066 44.73756       6.718416 47.28183 5.931268 59.51915 4.669417 -12.23732      7.548735 
1 1 1 -25 2  20 o 45.30353 4.265830 25.89815       4.654036 25.64955       7.669143 26.04308       5.855497 43.61193 7.485639 44.95264 5.456931 -1.340706      9.263524 
1 1 1 -25 2  21 o 28.84645 5.414045 10.91821       3.666094 10.47875       5.588302 11.25023       4.857459 27.53582 7.910593 28.73610 7.001826 -1.200285      10.56423 
1 1 1 -25 2  22 o 14.85580 6.274364 0.7056405      3.899040 4.089841       5.332833 -3.181187      5.715149 19.95778 7.716537 14.93283 6.862760 5.024959       10.32678 
1 1 1 -25 2  23 o 57.42356 3.569561 41.29713       4.970365 53.05133       7.493321 32.06264       6.641781 64.42883 4.807284 49.58698 5.593952 14.84185       7.375790 
1 1 1 -25 2  24 o 28.09006 5.916086 10.63192       3.921564 5.417665       5.493009 16.05207       5.600409 21.25303 7.919870 34.13760 6.968165 -12.88457      10.54892 
1 1 1 -25 2  25 o 57.67937 3.608541 41.85379       5.046694 44.92698       7.277596 39.00697       7.004445 58.84927 5.125796 54.67964 5.324025 4.169624       7.390469 
1 1 1 -25 2  26 o 64.05408 3.531464 51.60108       5.491030 44.71281       7.613387 59.06869       7.927086 58.39918 5.411309 67.64011 4.841216 -9.240932      7.260829 
1 1 1 -25 2  27 o 36.62675 5.101458 17.68049       4.429931 21.43094       6.398778 14.22835       6.139029 39.22083 6.949255 31.15207 8.034474 8.068758       10.62285 
1 1 1 -25 2  28 o 26.20740 7.372617 9.937272       4.905167 9.327654       6.000153 11.16561       8.517118 25.20703 8.368514 27.05551 9.900734 -1.848486      12.96366 
1 1 1 -25 2  29 f 28.37631 6.982082 11.61057       4.794612 24.04497       9.860162 7.759985       5.486997 37.93830 10.37066 23.20412 8.000892 14.73419       13.09828 
1 1 1 -25 2  30 o 16.22050 6.385571 2.692536       3.705359 4.858903       5.487953 0.8775709      5.023176 19.95032 7.795781 16.05147 6.956348 3.898855       10.44820 
1 1 1 -25 2  31 o 8.717933 4.326066 -7.633319      3.508220 -7.034572      4.858474 -8.285620      5.071096 11.31457 5.506758 11.18576 5.482848 0.1288109      7.770844 
1 1 1 -25 2  32 o 41.75700 5.006082 23.51273       4.992628 12.90117       7.960075 30.39441       6.410246 27.31625 9.622673 46.86381 5.732268 -19.54756      11.20066 
1 1 1 -25 2  33 o 22.72781 7.231967 7.855976       4.506932 8.940811       5.786726 6.183282       7.185535 23.71939 8.214727 21.32446 8.717742 2.394938       11.97835 
1 1 1 -25 2  34 o 10.73502 5.115068 -3.683047      3.696539 -3.854587      5.205550 -3.508556      5.250126 13.03557 6.170177 13.26530 6.253970 -0.2297306     8.785398 
1 1 1 -25 3  1  o 23.84579 5.547987 7.460916       3.163037 14.02801       6.037321 4.976367       3.713481 32.15778 7.787761 19.97748 6.581601 12.18031       10.19641 
1 1 1 -25 3  2  o 60.62946 3.515934 45.58498       5.172416 43.54095       7.481285 47.45676       7.159146 58.60610 5.295458 61.40166 4.823287 -2.795563      7.162818 
1 1 1 -25 3  3  o 66.78750 2.868327 54.95260       4.657430 57.46593       5.962071 51.01757       7.460123 68.08606 3.606239 63.70083 4.842064 4.385227       6.037429 
1 1 1 -25 3  4  o 74.39827 2.530844 67.99089       4.581753 62.80800       6.301377 73.80453       6.673804 71.19286 3.644269 77.21832 3.556187 -6.025467      5.091872 
1 1 1 -25 3  5  o 40.52697 3.122374 20.33526       3.059892 20.73515       4.283330 19.91850       4.372737 40.61498 4.397800 39.74106 4.600051 0.8739204      6.364049 
1 1 1 -25 3  6  o 119.6492 2.517299 175.5824       7.339739 179.7650       10.43951 171.4939       10.32141 120.6231 3.555394 117.7926 3.599938 2.830528       5.059682 
1 1 1 -25 3  7  o 87.70967 2.570175 94.44930       5.487539 96.68938       7.399756 91.71201       8.179853 88.48184 3.438386 86.00026 3.913354 2.481583       5.209303 
1 1 1 -25 3  8  o 24.12926 5.286776 7.563473       3.022537 2.747328       4.698403 10.96390       3.947909 18.29937 7.194602 29.03613 5.782725 -10.73675      9.230503 
1 1 1 -25 3  9  o 76.08784 2.930330 71.25902       5.423197 78.01583       8.544395 66.70065       7.018030 79.10730 4.450239 73.30947 3.942938 5.797829       5.945703 
1 1 1 -25 3  10 f 19.52986 5.460563 4.929610       2.699532 10.67658       4.921112 2.455821       3.228680 28.33854 7.132450 16.03106 6.051321 12.30748       9.353626 
1 1 1 -25 3  11 o 36.30730 3.598962 16.42937       3.142390 19.78906       5.655497 14.92888       3.779515 39.13282 6.131782 34.33539 4.635378 4.797428       7.686707 
1 1 1 -25 3  12 o 47.71624 3.715400 28.30764       4.286213 26.89988       6.337421 29.49449       5.818954 45.85649 5.800787 48.32615 5.013910 -2.469658      7.667361 
1 1 1 -25 3  13 o 74.87993 3.832985 69.57320       6.970938 66.48243       8.293483 77.01298       12.86717 72.86493 4.695704 77.27911 6.905262 -4.414177      8.350585 
1 1 1 -25 3  14 o 71.76587 3.196199 63.58722       5.575667 74.87241       8.346245 54.49158       7.492959 77.42646 4.442139 65.91766 4.695353 11.50880       6.463663 
1 1 1 -25 3  15 o 32.23216 4.889297 13.27419       3.719985 11.98990       5.554359 14.31885       5.009446 29.83066 7.615586 32.99217 6.462073 -3.161505      9.987769 
1 1 1 -25 3  16 o 55.30102 3.499786 37.95991       4.692208 36.30713       6.864750 39.40921       6.428299 53.43169 5.343792 55.92199 4.762393 -2.490303      7.157968 
1 1 1 -25 3  17 o 69.80693 3.811342 60.64626       6.458949 61.05323       12.92640 60.51085       7.456516 67.72952 7.985144 69.47614 4.427203 -1.746628      9.130315 
1 1 1 -25 3  18 o 73.27075 3.204385 66.44257       5.707684 60.23312       8.325712 71.94857       7.839941 68.99802 4.985250 75.80775 4.261032 -6.809731      6.558133 
1 1 1 -25 3  19 o 77.07011 4.032836 74.24832       7.547775 80.25746       11.34613 69.47816       10.10900 78.99760 5.937278 73.64163 5.676904 5.355965       8.214530 
1 1 1 -25 3  20 o 97.09225 3.377170 117.0013       7.978326 118.4037       13.95400 116.3202       9.724666 95.80843 6.006894 96.36096 4.151043 -0.5525360     7.301639 
1 1 1 -25 3  21 o 47.17598 3.892559 27.96829       4.435207 35.33471       6.909641 22.80639       5.784052 52.31629 5.502050 41.77085 5.841812 10.54544       8.024919 
1 1 1 -25 3  22 f 91.77358 3.117635 104.5209       6.962224 101.5255       9.850109 107.5114       9.842040 89.55122 4.528406 92.26271 4.390060 -2.711494      6.307067 
1 1 1 -25 3  23 o 63.90029 3.937778 51.41957       6.102047 46.01136       7.836419 59.74962       9.725559 59.55074 5.460742 67.52670 5.971701 -7.975952      8.092028 
1 1 1 -25 3  24 o 14.27467 6.006583 0.7822577      3.552089 4.255839       5.468268 -1.753370      4.672010 20.03721 7.795479 14.05779 6.361166 5.979418       10.06151 
1 1 1 -25 3  25 o 59.19310 3.633320 44.10354       5.215708 44.26201       7.727674 43.97095       7.068566 58.11074 5.523361 58.26660 5.027359 -0.1558609     7.468725 
1 1 1 -25 3  26 f 65.32906 3.456051 53.61506       5.482451 49.91123       7.990909 56.90902       7.535804 61.73838 5.364550 66.49163 4.680695 -4.753250      7.119501 
1 1 1 -25 3  27 f 12.61951 5.886084 -3.258779      4.442657 -1.336278      5.579924 -6.587750      7.342603 15.51503 6.992544 15.25086 7.250410 0.2641706      10.07294 
1 1 1 -25 3  28 o 55.47169 3.773681 39.12002       5.070832 40.69009       7.520648 37.81124       6.866403 55.18062 5.673590 53.44089 5.344141 1.739731       7.794195 
1 1 1 -25 3  29 o 13.56261 6.069524 -0.8347038     4.122341 -6.823565      8.688299 0.9052165      4.683034 16.46439 7.844146 15.73967 6.768268 0.7247248      10.36051 
1 1 1 -25 3  30 o 10.03648 4.816136 -4.214497      3.403963 -2.500376      4.851428 -5.876630      4.777291 13.53020 6.255641 11.71167 5.641893 1.818526       8.424013 
1 1 1 -25 3  31 f 13.71230 5.937831 0.4220483      3.653978 -1.113579      5.298207 1.814969       5.046023 14.89244 6.752900 16.68195 7.095578 -1.789509      9.795350 
1 1 1 -25 3  32 o 15.29615 6.499430 1.398334       4.226221 2.684283       6.809081 0.5925049      5.390117 18.75444 8.113461 16.01821 7.066659 2.736238       10.75946 
1 1 1 -25 3  33 o 20.56487 7.194217 6.203528       4.444091 2.952980       5.699245 11.24601       7.098413 17.95248 7.584187 25.74404 9.085374 -7.791559      11.83486 
1 1 1 -25 3  34 o 28.63274 6.191994 11.95158       4.194503 16.38704       6.181415 8.166330       5.710392 31.99673 7.960224 22.66934 8.133150 9.327387       11.38039 
1 1 1 -25 4  1  o 76.52538 3.255703 72.43146       6.057494 69.69491       8.639866 75.07710       8.495146 74.42233 4.789381 77.38304 4.524680 -2.960716      6.588695 
1 1 1 -25 4  2  o 36.54163 3.973556 16.76183       3.481460 13.83689       5.430978 18.80223       4.536048 32.16923 7.116678 38.42956 4.959187 -6.260330      8.674136 
1 1 1 -25 4  3  f 51.74512 3.952188 33.39651       4.945891 8.142091       12.90684 37.74319       5.354634 29.05990 11.75632 55.00473 4.022600 -25.94483      12.42548 
1 1 1 -25 4  4  o 38.74185 3.293995 18.63845       3.080389 17.18049       4.254048 20.24557       4.466359 36.77297 4.866552 40.02713 4.666338 -3.254158      6.742258 
1 1 1 -25 4  5  f 45.76407 3.003053 25.87673       3.330561 23.73789       4.626150 28.17823       4.798846 43.46574 4.429363 47.46317 4.192053 -3.997425      6.098571 
1 1 1 -25 4  6  o 79.83367 2.483158 78.24240       4.825010 85.20644       6.898554 71.57303       6.751026 83.04033 3.416342 76.01787 3.655042 7.022461       5.003071 
1 1 1 -25 4  7  o 83.50414 2.732191 85.71928       5.552265 89.72379       9.136096 83.37414       6.991500 84.82890 4.434981 82.11957 3.501755 2.709328       5.650783 
1 1 1 -25 4  8  o 58.58368 2.947534 42.30114       4.194440 39.95252       6.922170 43.66380       5.272656 56.28971 5.101691 59.33939 3.664155 -3.049671      6.281185 
1 1 1 -25 4  9  o 101.5319 2.945637 126.8477       7.280455 122.5872       10.94651 130.2272       9.749393 99.14427 4.542840 102.4965 3.910477 -3.352234      5.994100 
1 1 1 -25 4  10 o 77.59541 2.960282 74.14250       5.587377 71.44781       8.642437 76.07761       7.323770 75.56149 4.717058 78.32098 3.849043 -2.759499      6.088166 
1 1 1 -25 4  11 o 34.57743 3.869489 14.97398       3.204639 16.85751       5.719983 14.11230       3.868836 35.80783 6.803797 33.27872 4.918650 2.529102       8.395520 
1 1 1 -25 4  12 o 52.64487 3.600524 34.39445       4.591299 44.30332       7.044062 27.07533       6.053979 59.34292 4.915046 46.09999 5.497126 13.24293       7.374013 
1 1 1 -25 4  13 o 22.60482 6.037967 6.702365       3.389000 8.450375       5.167639 5.383211       4.489192 25.33218 7.694561 21.09676 7.238346 4.235422       10.56409 
1 1 1 -25 4  14 o 27.35028 5.621401 9.758004       3.621332 5.870394       5.490966 12.75051       4.817534 22.36004 7.980763 31.06696 6.569056 -8.706923      10.33659 
1 1 1 -25 4  15 o 92.91372 3.071833 106.4788       6.945701 114.5260       10.45732 100.1262       9.291173 95.70985 4.496174 89.59147 4.267941 6.118385       6.199266 
1 1 1 -25 4  16 o 30.84333 5.263342 12.28873       3.814172 15.83866       5.843740 9.654025       5.034400 34.40503 7.201465 26.80172 7.443485 7.603310       10.35696 
1 1 1 -25 4  17 o 68.85808 3.172452 58.65401       5.309058 68.46255       8.090851 51.23727       7.035555 73.84885 4.517492 63.83517 4.552629 10.01367       6.413592 
1 1 1 -25 4  18 o 17.70447 6.674398 3.181663       3.924941 5.561578       9.156141 2.645888       4.344334 24.62275 9.923023 17.59102 6.917566 7.031729       12.09624 
1 1 1 -25 4  19 o 17.06990 6.407269 2.987602       3.608473 -0.7656479     6.206862 4.903821       4.434972 17.21909 7.590353 20.26910 7.178782 -3.050009      10.44741 
1 1 1 -25 4  20 o 36.53477 4.530038 17.01533       3.946806 22.32072       6.034637 13.04963       5.217381 41.20152 6.202551 30.99114 7.065829 10.21038       9.401999 
1 1 1 -25 4  21 o 17.53865 6.332536 3.512984       3.468231 3.571594       5.435340 3.472731       4.504415 19.58675 7.726772 18.53982 7.111797 1.046934       10.50146 
1 1 1 -25 4  22 o 25.74266 6.265148 8.967677       3.892550 14.50037       5.945218 4.816322       5.149848 32.23606 7.678353 20.51675 7.663929 11.71931       10.84864 
1 1 1 -25 4  23 o 32.41231 6.100885 14.09838       4.642020 19.20439       6.206752 7.616873       6.992961 37.43311 7.063021 24.31851 8.959175 13.11460       11.40847 
1 1 1 -25 4  24 f 75.74310 3.269621 71.62385       6.020776 63.51315       8.785910 78.80492       8.267081 70.05486 5.183217 78.75753 4.324079 -8.702667      6.750067 
1 1 1 -25 4  25 o 16.00498 6.287841 2.359484       3.586403 7.266261       5.474955 -1.328528      4.746555 23.13779 7.991484 14.41051 6.475865 8.727282       10.28594 
1 1 1 -25 4  26 o 18.09661 6.571567 3.941662       3.741925 6.723785       5.795437 1.952633       4.900254 22.55196 8.179927 17.14569 7.122930 5.406277       10.84654 
1 1 1 -25 4  27 o 30.18283 6.970589 12.89606       5.023586 13.20815       6.335284 12.36743       8.245091 29.74583 8.382476 28.29954 9.805367 1.446291       12.90004 
1 1 1 -25 4  28 o 19.29705 6.592356 4.943210       3.722722 1.863920       5.716147 7.211255       4.905734 17.79510 7.559912 22.60067 7.568412 -4.805567      10.69734 
1 1 1 -25 4  29 f 25.86213 7.074951 9.730853       4.586982 12.52828       9.434502 8.864891       5.249153 27.71041 10.36874 24.47650 7.806624 3.233912       12.97899 
1 1 1 -25 4  30 o 23.77839 6.658100 8.179228       4.010320 9.462422       5.770127 6.980207       5.577665 24.89451 8.204273 22.10588 8.023818 2.788630       11.47570 
1 1 1 -25 4  31 o 47.76086 4.575769 30.11934       5.260591 29.60126       8.893332 30.39818       6.524442 43.31376 8.727574 46.89845 5.834664 -3.584694      10.49828 
1 1 1 -25 4  32 o 17.96750 6.764318 4.142154       4.028352 2.871997       6.059648 5.148005       5.392443 18.28219 7.775920 19.79259 7.729532 -1.510408      10.96406 
1 1 1 -25 4  33 o 20.37106 6.809487 6.085628       3.971448 10.75722       5.864255 2.127859       5.397663 25.70982 8.256690 17.02774 7.293246 8.682083       11.01655 
1 1 1 -25 4  34 o 15.88648 6.487424 2.481051       3.973777 6.067987       5.631923 -1.075087      5.607693 20.48808 7.927703 15.00367 6.858856 5.484406       10.48296 
1 1 1 -25 5  1  o 64.80807 2.635696 51.72179       4.153876 55.74292       5.807283 47.50905       5.944038 66.99378 3.570043 61.69129 3.975019 5.302490       5.342844 
1 1 1 -25 5  2  o 62.27414 2.692243 47.76429       4.075969 44.56305       5.547854 51.51885       6.008212 59.81880 3.825901 64.32603 3.850479 -4.507229      5.428049 
1 1 1 -25 5  3  o 72.49895 2.553455 64.62057       4.504198 65.75735       6.247829 63.39040       6.499412 72.83990 3.530360 71.43774 3.746545 1.402161       5.147819 
1 1 1 -25 5  4  o 20.94822 6.358116 5.661812       3.529345 5.186509       10.84488 5.718115       3.732532 25.93373 10.66792 21.11036 6.562933 4.823374       12.52504 
1 1 1 -25 5  5  o 84.93626 2.472275 88.57973       5.111679 93.21320       7.241509 83.97813       7.216567 86.82645 3.429224 82.34283 3.605144 4.483620       4.975604 
1 1 1 -25 5  6  o 50.39927 2.842552 31.32213       3.477001 32.62150       4.887790 29.99098       4.947191 51.15894 3.951221 48.97297 4.185480 2.185966       5.755900 
1 1 1 -25 5  7  o 46.83167 3.296169 27.16763       3.737683 24.27148       6.160439 28.85483       4.702002 43.43726 5.978258 48.07494 4.051206 -4.637684      7.221622 
1 1 1 -25 5  8  o 58.66156 2.987445 42.43952       4.256545 45.97463       7.170176 40.51571       5.289432 60.46100 4.908707 57.09327 3.823835 3.367725       6.222308 
1 1 1 -25 5  9  o 91.86948 2.716488 103.7444       6.074882 104.0578       10.07670 103.5654       7.614125 91.29584 4.543580 91.55704 3.418657 -0.2612076     5.686065 
1 1 1 -25 5  10 o 87.75220 3.574345 95.27661       7.627473 98.06490       9.796702 90.98480       12.15435 88.61312 4.552014 84.62977 5.931038 3.983353       7.476500 
1 1 1 -25 5  11 o 65.42991 3.469537 52.99304       5.512247 56.12532       7.951417 50.09495       7.648399 66.82323 4.917376 63.07263 5.017476 3.750595       7.025358 
1 1 1 -25 5  12 o 28.48306 4.707402 10.37569       3.153375 6.940431       5.619429 11.95464       3.809757 23.66240 8.099054 30.44079 5.329858 -6.778385      9.695466 
1 1 1 -25 5  13 o 30.23467 4.261235 11.57669       3.052647 7.599891       5.775510 13.11836       3.595994 24.47551 8.212186 32.08575 4.741724 -7.610237      9.482823 
1 1 1 -25 5  14 o 63.07868 3.276196 49.22216       5.018775 45.90485       7.585861 51.80447       6.692945 60.21444 5.221287 64.37531 4.290899 -4.160862      6.758228 
1 1 1 -25 5  15 o 52.56780 3.632226 34.37138       4.624347 28.87627       7.004182 38.61762       6.157040 47.21581 6.240043 55.40409 4.601808 -8.188286      7.753371 
1 1 1 -25 5  16 o 59.54906 3.416065 43.99404       4.936407 43.27677       7.519846 44.53719       6.543756 58.31280 5.351488 59.51134 4.546653 -1.198544      7.022142 
1 1 1 -25 5  17 o 102.0223 3.031208 128.5107       7.527750 130.8328       11.23721 126.6202       10.13898 102.1222 4.526712 100.6983 4.140602 1.423912       6.134795 
1 1 1 -25 5  18 f 78.44911 4.199781 77.07928       7.999540 0.000000       0.000000 77.07928       7.999540 ?        ?        78.44911 4.199781 0.000000       4.199781 
1 1 1 -25 5  19 o 55.61376 3.549940 38.55136       4.785927 29.47568       7.096296 46.12374       6.481990 47.44514 6.292686 60.48605 4.428300 -13.04091      7.694657 
1 1 1 -25 5  20 o 14.57812 5.961308 1.243650       3.361052 7.516664       5.302653 -2.969076      4.345469 23.83803 7.865312 12.84349 5.931878 10.99454       9.851412 
1 1 1 -25 5  21 o 18.73851 6.453459 4.322481       3.569427 11.17944       5.810867 0.1673467      4.523428 28.26491 8.049496 15.36139 6.629154 12.90352       10.42785 
1 1 1 -25 5  22 o 27.22671 5.780962 9.911513       3.716911 10.65741       5.965872 9.438296       4.751876 27.48934 8.249764 26.12699 7.222296 1.362352       10.96450 
1 1 1 -25 5  23 o 58.27153 4.110230 42.98595       5.799138 43.20324       7.638306 42.69026       8.910279 57.57667 5.511144 56.45811 6.600762 1.118557       8.598998 
1 1 1 -25 5  24 o 28.18910 5.856544 10.72244       3.891504 16.51560       6.113123 6.775325       5.045978 34.23371 7.532630 22.48555 7.675237 11.74815       10.75406 
1 1 1 -25 5  25 o 38.05828 4.738021 18.79946       4.299336 9.892890       6.369017 26.25557       5.827382 26.19463 8.618899 44.63820 5.471389 -18.44357      10.20889 
1 1 1 -25 5  26 o 49.44171 4.909797 31.80556       5.837450 34.09952       7.420705 28.08167       9.454778 50.31252 6.182293 43.13834 9.270230 7.174179       11.14262 
1 1 1 -25 5  27 o 23.42753 6.606113 7.705377       3.933437 7.807109       6.229972 7.637941       5.072266 23.64231 8.493533 23.24165 7.693531 0.4006672      11.45995 
1 1 1 -25 5  28 o 14.01653 6.014883 0.5059227      3.684185 4.699158       5.500454 -2.905927      4.961567 20.02677 7.810711 13.57937 6.295073 6.447399       10.03171 
1 1 1 -25 5  29 o 11.49774 5.335010 -2.366813      3.576101 -3.081065      5.303079 -1.771136      4.842928 13.91480 6.470248 14.00194 6.390665 -0.8713722E-01 9.094213 
1 1 1 -25 5  30 o 17.61158 7.074027 3.197556       4.636727 -7.893153      9.090934 7.097114       5.390593 16.30006 7.834486 22.15508 7.907497 -5.855017      11.13138 
1 1 1 -25 5  31 o 16.26040 6.647604 2.415293       4.178218 10.05632       6.989802 -1.832924      5.211854 24.99093 8.994260 14.30269 6.565966 10.68823       11.13592 
1 1 1 -25 5  32 o 30.78730 5.772925 13.34043       4.172080 6.220841       5.867653 20.62026       5.933318 20.98701 8.099645 37.61387 6.719736 -16.62686      10.52421 
1 1 1 -25 5  33 o 24.02423 6.701086 8.662162       4.070644 9.826912       5.858088 7.574653       5.660514 24.59036 8.270859 22.14554 8.076493 2.444828       11.56014 
1 1 1 -25 5  34 o 15.08326 6.878011 -0.8912511     5.593542 -0.8912511     5.593542 0.000000       0.000000 15.08326 6.878011 ?        ?        0.000000       6.878011 
1 1 1 -25 6  1  o 51.41475 2.866608 32.66711       3.577414 33.21432       4.821566 31.99693       5.335896 51.55278 3.866117 50.41323 4.387012 1.139553       5.847456 
1 1 1 -25 6  2  o 60.32000 2.663028 44.82508       3.904822 41.43080       5.226835 49.11221       5.874182 57.67745 3.738894 62.77357 3.858677 -5.096115      5.372962 
1 1 1 -25 6  3  o 31.88652 3.871269 12.79272       2.946581 13.34097       3.974912 12.12393       4.390152 32.16957 5.251451 30.35089 6.146705 1.818682       8.084536 
1 1 1 -25 6  4  o 21.67244 5.707941 6.160180       3.055762 1.943875       4.780921 9.072302       3.973291 17.52390 7.130953 26.17124 6.305136 -8.647337      9.518679 
1 1 1 -25 6  5  o 24.73041 6.250870 8.084173       3.768336 4.825864       11.74332 8.458201       3.978748 26.35797 10.99449 25.26513 6.443152 1.092838       12.74335 
1 1 1 -25 6  6  o 108.0551 2.783738 143.6241       7.323996 132.4429       11.62399 150.9854       9.431656 102.8917 4.647950 110.4860 3.507479 -7.594307      5.822873 
1 1 1 -25 6  7  o 81.01614 2.799545 80.77773       5.518766 86.39777       9.207502 77.62671       6.894435 83.11563 4.563444 79.16701 3.582989 3.948624       5.801968 
1 1 1 -25 6  8  o 29.54956 4.592309 11.12846       3.199539 17.42645       5.753294 8.308542       3.849765 36.40110 6.733795 25.08328 6.305865 11.31782       9.225395 
1 1 1 -25 6  9  o 81.96974 3.256628 82.96869       6.492210 88.46950       9.405691 77.96304       8.972371 84.09666 4.607211 78.89411 4.688017 5.202545       6.572967 
1 1 1 -25 6  10 f 22.91606 6.389387 6.897177       3.701573 8.655057       5.626876 5.556101       4.914727 25.67783 8.069358 21.59628 7.564809 4.081556       11.06078 
1 1 1 -25 6  11 o 45.91404 3.596745 26.21647       3.992209 23.16990       6.637547 27.94323       4.997107 42.10775 6.692268 47.18135 4.396840 -5.073593      8.007413 
1 1 1 -25 6  12 o 94.56686 2.973404 110.1879       6.843670 104.6862       10.46585 114.2977       9.045575 91.40768 4.714387 95.94576 3.876765 -4.538071      6.103668 
1 1 1 -25 6  13 o 62.77925 2.887928 48.59860       4.406295 45.98438       7.731223 49.85630       5.362481 60.21309 5.323706 63.41846 3.483252 -3.205372      6.361988 
1 1 1 -25 6  14 o 79.36729 3.126023 77.79420       6.034198 80.82466       9.234200 75.53577       7.971628 80.20888 4.745544 77.77722 4.221722 2.431656       6.351624 
1 1 1 -25 6  15 o 65.12528 3.243006 52.50038       5.130563 55.84921       7.947399 50.10749       6.717988 66.50207 4.939303 63.20963 4.388591 3.292442       6.607302 
1 1 1 -25 6  16 o 61.95303 3.276716 47.56658       4.929357 51.02924       7.692916 45.15455       6.420637 63.47488 5.014091 59.94226 4.426739 3.532619       6.688582 
1 1 1 -25 6  17 o 16.12536 6.250527 2.323849       3.505628 -1.740111      6.784174 3.804295       4.094667 17.41851 7.791348 18.63831 6.857495 -1.219791      10.37932 
1 1 1 -25 6  18 o 33.46320 5.702684 14.63746       4.483735 10.34852       10.37170 15.62323       4.972383 28.65442 10.83922 34.41764 6.154467 -5.763216      12.46460 
1 1 1 -25 6  19 o 36.85875 5.197314 17.54704       4.538836 17.97870       9.648054 17.42435       5.143556 34.91769 10.49394 36.39582 6.008806 -1.478127      12.09250 
1 1 1 -25 6  20 o 51.44746 3.695909 33.15135       4.602755 30.12697       6.983191 35.47453       6.120370 47.92087 6.119317 52.74157 4.815041 -4.820702      7.786569 
1 1 1 -25 6  21 o 13.95557 5.853395 0.7211946      3.356292 -0.6001586     5.243846 1.638119       4.368247 15.82768 6.976871 16.42446 6.764856 -0.5967741     9.718024 
1 1 1 -25 6  22 o 24.12490 6.348314 7.921344       3.782002 5.186966       6.100865 9.627992       4.819857 21.52550 8.271670 26.32465 7.272553 -4.799149      11.01411 
1 1 1 -25 6  23 o 36.01274 5.630848 17.17142       4.779857 17.40195       6.384211 16.87737       7.210424 35.14322 7.670543 33.99998 8.675323 1.143246       11.58009 
1 1 1 -25 6  24 o 78.88066 3.212782 77.68269       6.162800 74.35257       9.229491 80.36214       8.278833 75.86927 5.020247 79.49129 4.289685 -3.622017      6.603354 
1 1 1 -25 6  25 o 43.93081 4.367865 24.78208       4.614123 17.94753       6.926939 30.23340       6.186387 35.09677 8.240820 47.95467 5.386872 -12.85790      9.845278 
1 1 1 -25 6  26 o 28.06657 7.058198 11.18386       4.822021 8.223549       6.172571 15.81947       7.724144 24.16598 8.476801 32.01831 9.330920 -7.852324      12.60644 
1 1 1 -25 6  27 o 51.54988 3.850324 33.84591       4.801893 28.55993       7.353867 37.77500       6.340144 45.27206 6.882177 53.77993 4.891197 -8.507877      8.443233 
1 1 1 -25 6  28 o 19.32410 6.571555 5.014056       3.698581 1.860960       5.497262 7.621782       4.999295 17.48197 7.419798 23.01903 7.638628 -5.537054      10.64904 
1 1 1 -25 6  29 o 19.45448 6.611912 5.166657       3.744080 5.181668       5.615873 5.154647       5.023386 20.35943 7.905821 20.00681 7.548954 0.3526211      10.93109 
1 1 1 -25 6  30 o 27.24314 7.257564 11.08088       4.904467 -2.940652      9.994345 15.52842       5.628811 18.76500 8.777381 32.34843 7.312840 -13.58344      11.42454 
1 1 1 -25 6  31 o 16.95064 6.673914 3.209023       4.048031 7.607529       7.213418 1.187068       4.890737 22.72610 8.920753 15.92956 6.883766 6.796539       11.26792 
1 1 1 -25 6  32 o 24.05271 6.715142 8.621777       4.085738 5.271261       5.970864 11.57204       5.602887 20.11573 8.045350 26.97478 7.970563 -6.859043      11.32508 
1 1 1 -25 6  33 o 21.63904 6.930052 7.053869       4.133260 10.04531       6.001849 4.355361       5.700418 24.73087 8.371726 19.01726 7.768479 5.713610       11.42082 
1 1 1 -25 7  1  o 17.98965 5.436727 4.160596       2.584417 4.417112       3.313870 3.762382       4.128920 18.81701 6.218194 18.61079 6.879312 0.2062206      9.273127 
1 1 1 -25 7  2  o 37.73444 3.407344 17.76027       3.099490 17.87570       4.157443 17.61584       4.650578 37.49258 4.649952 36.98564 5.312093 0.5069389      7.059772 
1 1 1 -25 7  3  o 81.26995 2.861184 81.43509       5.657621 68.15652       8.745057 90.99332       7.419522 73.49210 4.911176 85.63869 3.563030 -12.14659      6.067523 
1 1 1 -25 7  4  o 34.68339 3.581892 15.04430       2.983899 14.87844       4.059675 15.23919       4.400661 34.07125 5.041509 34.35798 5.436707 -0.2867355     7.414485 
1 1 1 -25 7  5  o 94.53854 2.827503 110.0634       6.506685 121.2811       10.92925 103.9045       8.098234 98.41650 4.569551 91.53549 3.637730 6.881004       5.840709 
1 1 1 -25 7  6  o 13.91419 5.847465 0.5342372      3.359670 -19.34304      12.14491 2.181400       3.496102 17.62186 8.605074 16.00108 6.230933 1.620777       10.62411 
1 1 1 -25 7  7  o 60.43657 3.636335 45.35775       5.330726 50.38780       7.817626 40.98640       7.287800 63.14286 5.124605 56.82723 5.324657 6.315628       7.390098 
1 1 1 -25 7  8  o 85.79128 3.309820 90.96557       6.906662 91.31178       9.962047 90.64513       9.583915 85.28851 4.812687 85.06291 4.641036 0.2255936      6.685894 
1 1 1 -25 7  9  o 54.88952 3.148574 37.25523       4.193857 34.06301       7.250891 38.86000       5.141048 51.54573 5.877371 55.87974 3.797955 -4.334011      6.997711 
1 1 1 -25 7  10 o 105.6920 2.758439 137.4259       7.098559 134.1092       11.87263 139.2711       8.855753 103.4577 4.721656 106.1237 3.428841 -2.666046      5.835322 
1 1 1 -25 7  11 o 121.3359 3.095719 181.5579       9.146022 188.3771       14.08443 176.5856       12.02678 122.6290 4.721958 119.0950 4.150343 3.534035       6.286671 
1 1 1 -25 7  12 o 71.75742 2.835842 63.45227       4.949131 56.52808       8.469007 67.04320       6.098902 66.81374 5.243507 73.58041 3.410644 -6.766678      6.255147 
1 1 1 -25 7  13 o 72.51722 3.079728 64.95068       5.429998 64.52820       8.669423 65.22342       6.965548 71.49716 5.007488 72.35064 3.965892 -0.8534775     6.387741 
1 1 1 -25 7  14 o 56.95699 3.002329 40.09691       4.152454 36.61308       7.318630 41.75088       5.042721 53.43373 5.708887 57.94890 3.588556 -4.515163      6.743079 
1 1 1 -25 7  15 o 72.61757 3.160722 65.23573       5.579853 67.32684       8.866045 63.86425       7.180158 72.95157 5.017791 71.46483 4.140657 1.486740       6.505634 
1 1 1 -25 7  16 o 26.91119 5.840026 9.567421       3.719643 18.40438       8.000242 7.130300       4.201365 36.16070 9.090110 23.18909 6.914627 12.97161       11.42113 
1 1 1 -25 7  17 o 75.15067 3.145781 69.92960       5.748255 77.64189       9.289698 65.14453       7.317338 78.32515 4.891449 72.08739 4.183383 6.237762       6.436378 
1 1 1 -25 7  18 o 31.16514 5.137279 12.59999       3.765736 16.84514       6.251940 10.18291       4.717510 35.10843 7.533102 27.36811 7.035134 7.740322       10.30731 
1 1 1 -25 7  19 o 22.05538 6.932777 6.428814       4.153139 9.500443       8.984020 5.593993       4.683638 27.17735 10.12837 21.19019 7.387416 5.987154       12.53626 
1 1 1 -25 7  20 o 17.98885 6.487080 3.746746       3.638213 7.858162       5.631697 0.8017862      4.766321 24.23529 8.108991 16.24111 6.901650 7.994181       10.64840 
1 1 1 -25 7  21 o 64.19285 3.390263 51.43379       5.284618 52.28771       8.094940 50.79957       6.976351 63.67651 5.263707 63.19194 4.561026 0.4845657      6.964881 
1 1 1 -25 7  22 o 13.29416 5.770080 -0.9701223E-01 3.466694 -1.577721      5.576325 0.8357704      4.425920 15.56738 7.005456 15.68436 6.657278 -0.1169844     9.664148 
1 1 1 -25 7  23 o 37.28386 4.675349 17.97321       4.154716 21.74873       6.762982 15.68457       5.265481 39.59525 7.277133 33.85222 6.620140 5.743023       9.837831 
1 1 1 -25 7  24 o 84.98235 3.772036 91.03105       7.792148 87.12160       10.26278 96.35244       11.97347 81.95216 5.165155 85.55655 5.776759 -3.604385      7.749179 
1 1 1 -25 7  25 o 73.41931 4.076956 68.51914       7.265637 64.28610       9.312799 75.10336       11.61465 69.92909 5.509422 74.62630 6.449973 -4.697205      8.482681 
1 1 1 -25 7  26 o 15.13591 6.155052 1.720484       3.559034 2.118500       5.701436 1.466369       4.555639 18.07991 7.608949 16.20911 6.810370 1.870800       10.21162 
1 1 1 -25 7  27 o 43.26995 4.345813 24.21883       4.520428 19.74431       6.841293 27.68630       6.022416 36.70625 7.883618 45.49982 5.546019 -8.793575      9.638971 
1 1 1 -25 7  28 o 35.70798 5.054469 16.99068       4.275417 12.28129       6.110648 21.50695       5.984047 28.33805 8.310788 39.24342 6.483587 -10.90537      10.54069 
1 1 1 -25 7  29 o 64.61985 3.517184 53.09442       5.517685 41.90291       7.885665 63.82965       7.723240 55.29541 5.945410 69.89865 4.559015 -14.60324      7.492164 
1 1 1 -25 7  30 o 35.49773 6.982724 18.39742       5.825048 0.000000       0.000000 18.39742       5.825048 ?        ?        35.49773 6.982724 0.000000       6.982724 
1 1 1 -25 7  31 o 37.86895 5.882906 20.07125       5.252771 21.13059       6.628536 18.28312       8.611957 37.39612 7.534397 32.05308 9.969540 5.343037       12.49635 
1 1 1 -25 7  32 o 36.33641 5.115354 18.02866       4.404328 25.43001       6.846184 12.80256       5.752836 41.43950 7.030519 28.32704 7.989670 13.11246       10.64251 
1 1 1 -25 7  33 o 20.28406 6.851938 6.082114       4.020443 6.081782       6.002384 6.082385       5.414486 20.64789 8.127674 20.48007 7.811755 0.1678238      11.27309 
1 1 1 -25 8  1  o 22.07492 5.082987 6.400248       2.677813 2.483721       3.438102 12.44003       4.269518 16.20113 6.213622 30.69565 5.922338 -14.49451      8.583890 
1 1 1 -25 8  2  o 31.72329 3.746024 12.67264       2.840118 13.80750       3.779233 11.20005       4.304998 32.78419 4.878902 29.00532 6.273387 3.778866       7.947268 
1 1 1 -25 8  3  o 24.53057 4.649464 7.780089       2.677675 9.475802       3.582438 5.633488       4.030677 26.83926 5.656054 21.01864 6.853094 5.820618       8.885710 
1 1 1 -25 8  4  o 13.42213 5.434237 1.091216       2.760187 0.7672459      3.440630 1.676198       4.623343 14.26731 5.951159 16.99681 6.975696 -2.729493      9.169330 
1 1 1 -25 8  5  o 28.18073 5.699692 10.40975       3.779526 12.35688       5.472260 8.633692       5.226331 30.20072 7.475935 25.43651 7.740555 4.764212       10.76131 
1 1 1 -25 8  6  o 88.72841 4.107582 98.18633       8.857374 112.7591       18.93317 94.10336       10.02167 91.70577 8.571387 86.51279 4.772098 5.192986       9.810281 
1 1 1 -25 8  7  o 34.65904 4.116548 15.14298       3.409013 14.71733       6.062783 15.33978       4.122427 32.95585 7.690333 34.60914 5.035527 -1.653294      9.192266 
1 1 1 -25 8  8  o 20.37351 5.761966 5.415245       2.987870 10.27415       5.701088 3.575278       3.508272 27.57699 8.010553 17.81705 6.376945 9.759937       10.23887 
1 1 1 -25 8  9  o 85.40205 2.784891 89.82006       5.788039 100.5475       10.16791 84.67755       7.039976 89.51477 4.677463 82.66306 3.502750 6.851715       5.843622 
1 1 1 -25 8  10 o 106.4846 2.782053 139.5961       7.213005 138.9878       12.22483 139.9209       8.933820 105.2028 4.780971 106.3137 3.452933 -1.110962      5.897493 
1 1 1 -25 8  11 o 87.53721 2.747788 94.35342       5.854285 104.5000       10.36772 89.60382       7.093349 91.23747 4.678714 85.05508 3.429307 6.182396       5.800906 
1 1 1 -25 8  12 o 97.62469 3.270605 117.8624       7.769809 116.3296       13.88216 118.5616       9.375933 95.34287 6.005439 97.58527 3.950872 -2.242401      7.188511 
1 1 1 -25 8  13 o 45.40155 3.380424 25.63172       3.713215 19.54716       6.884684 28.12775       4.409547 38.02000 7.695218 47.43517 3.847681 -9.415169      8.603547 
1 1 1 -25 8  14 o 41.11393 3.702851 21.14242       3.670183 30.52773       8.689300 19.10445       4.049102 47.66907 7.745843 38.87336 4.348789 8.795704       8.883133 
1 1 1 -25 8  15 o 30.74803 4.874547 12.16784       3.530781 18.10693       7.585129 10.52500       3.989336 36.00111 8.735785 28.20035 5.990214 7.800764       10.59229 
1 1 1 -25 8  16 o 41.92546 4.045744 22.12126       4.082166 16.29219       6.607726 25.71916       5.191312 34.36366 8.035140 44.95176 4.813963 -10.58810      9.366841 
1 1 1 -25 8  17 o 50.46817 3.569031 31.79506       4.361076 30.00619       7.108228 32.87486       5.522621 47.87213 6.241650 50.97271 4.491929 -3.100582      7.689969 
1 1 1 -25 8  18 o 13.29683 5.679364 0.2145354      3.256596 -2.015387      5.487743 1.426702       4.046039 15.32003 6.916867 15.82403 6.513349 -0.5040026     9.500882 
1 1 1 -25 8  19 o 16.08759 6.511381 1.834860       3.961450 12.64423       9.711263 -0.3228846     4.338860 29.84245 10.61755 14.67121 6.410130 15.17125       12.40251 
1 1 1 -25 8  20 o 38.09193 4.583897 18.59856       4.169631 19.93277       6.775308 17.78519       5.290049 37.95637 7.590411 36.54174 6.159445 1.414635       9.775126 
1 1 1 -25 8  21 o 25.87507 6.113495 9.075807       3.793209 8.193779       6.326970 9.570735       4.739424 24.63553 8.586309 26.24299 7.196559 -1.607466      11.20336 
1 1 1 -25 8  22 o 32.86794 5.204973 14.19708       4.030237 13.60743       6.602743 14.54723       5.088026 30.56506 8.537739 32.59181 6.632150 -2.026749      10.81103 
1 1 1 -25 8  23 o 65.01598 3.447875 53.01577       5.443173 54.75116       8.590923 51.85186       7.035575 64.68326 5.502371 63.61889 4.568553 1.064365       7.151766 
1 1 1 -25 8  24 o 40.72431 7.498544 23.34905       7.167484 23.34905       7.167484 0.000000       0.000000 40.72431 7.498544 ?        ?        0.000000       7.498544 
1 1 1 -25 8  25 o 51.94465 3.786931 34.22610       4.760699 34.15755       7.423645 34.27399       6.204483 50.30618 6.185716 51.22321 5.035553 -0.9170341     7.976207 
1 1 1 -25 8  26 o 55.56333 3.755583 39.20454       5.055250 27.57373       7.553785 48.63923       6.803361 44.18243 7.268352 61.32227 4.585913 -17.13985      8.594157 
1 1 1 -25 8  27 o 22.09573 6.680017 6.894557       3.901110 7.199111       6.117757 6.685856       5.064339 22.77146 8.381422 21.91643 7.678931 0.8550301      11.36724 
1 1 1 -25 8  28 o 42.67927 4.316529 23.69357       4.427747 18.90755       6.604025 27.60180       5.967765 35.63099 7.820782 45.22255 5.530207 -9.591568      9.578508 
1 1 1 -25 8  29 o 33.75336 5.807622 15.76357       4.604708 23.37044       8.168170 12.21993       5.575019 38.40246 8.902150 28.28975 7.823914 10.11271       11.85166 
1 1 1 -25 8  30 o 22.39808 9.125339 6.887227       7.840374 0.000000       0.000000 6.887227       7.840374 ?        ?        22.39808 9.125339 0.000000       9.125339 
1 1 1 -25 8  31 o 18.50709 6.627233 4.674653       3.789570 2.972790       5.973840 5.820684       4.902183 18.27085 7.743838 20.28483 7.496263 -2.013975      10.77780 
1 1 1 -25 8  32 f 11.70389 5.413421 -1.948698      3.638388 1.495402       5.704103 -4.311135      4.724216 16.83342 7.352404 12.15334 5.788532 4.680087       9.357615 
1 1 1 -25 8  33 o 32.10345 5.722359 14.61028       4.312562 13.51677       6.437937 15.50037       5.808313 28.29408 8.587173 31.36345 7.665419 -3.069378      11.51079 
1 1 1 -25 9  1  o 32.73693 5.529305 14.01776       4.254133 12.92401       6.095012 15.05675       5.940471 30.44786 8.081176 33.10459 7.533710 -2.656723      11.04818 
1 1 1 -25 9  2  o 55.49360 3.046756 38.16824       4.104376 36.85521       5.054483 40.71012       7.032615 54.25563 3.847893 56.44543 5.170081 -2.189796      6.444844 
1 1 1 -25 9  3  o 33.24508 4.065795 13.98448       3.225423 12.45351       3.876160 17.43100       5.815780 30.93816 5.333854 36.09161 6.863255 -5.153452      8.692195 
1 1 1 -25 9  4  o 45.95411 3.056333 26.18517       3.403188 23.72744       4.499445 29.47081       5.202387 43.35764 4.315755 48.30574 4.470139 -4.948097      6.213524 
1 1 1 -25 9  5  o 57.13617 3.136844 40.43828       4.350815 45.37805       7.266055 37.67716       5.432349 59.79062 5.033587 54.82834 4.095389 4.962273       6.489161 
1 1 1 -25 9  6  o 53.06277 3.299233 34.94449       4.245075 35.07367       7.173497 34.87487       5.266153 52.22513 5.730590 52.73945 4.130456 -0.5143242     7.064016 
1 1 1 -25 9  7  o 85.80409 3.664057 91.48229       7.643729 120.9809       18.95263 85.75209       8.353211 95.11707 8.258405 82.84045 4.151078 12.27662       9.242981 
1 1 1 -25 9  8  o 65.32879 3.044646 52.75436       4.833718 46.91378       8.505671 55.54039       5.874535 60.44394 5.847513 66.84022 3.620123 -6.396282      6.877405 
1 1 1 -25 9  9  o 85.49694 2.821564 90.10607       5.870584 92.81807       10.35464 88.82140       7.126652 85.74343 4.977010 84.63783 3.462605 1.105598       6.063024 
1 1 1 -25 9  10 o 56.50639 3.118415 39.52682       4.277405 37.57024       7.837894 40.35669       5.104556 53.92418 6.069888 56.91731 3.700310 -2.993134      7.108856 
1 1 1 -25 9  11 o 18.49071 5.916887 4.313348       3.013515 2.317450       6.114421 4.953708       3.463363 19.41311 8.000471 19.75110 6.345459 -0.3379879     10.21138 
1 1 1 -25 9  12 o 30.65853 4.835038 12.07866       3.492766 20.43544       6.635776 8.876192       4.107853 39.05898 7.238112 25.75824 6.535005 13.30075       9.751746 
1 1 1 -25 9  13 f 81.61319 2.967252 82.27234       5.891521 72.93764       12.06513 85.19508       6.751141 74.79606 6.689937 82.89920 3.348772 -8.103142      7.481279 
1 1 1 -25 9  14 o 29.49031 5.573129 11.39234       3.858391 12.50552       8.079107 11.06343       4.391571 29.94689 9.697860 28.77112 6.426077 1.175772       11.63370 
1 1 1 -25 9  15 o 71.32478 3.215941 63.06926       5.575273 54.81372       8.714046 68.79070       7.254378 65.39175 5.519908 74.13764 4.030526 -8.745895      6.834802 
1 1 1 -25 9  16 o 30.64365 5.132658 12.19409       3.697402 14.01728       6.611803 11.36453       4.459944 31.62029 8.428019 29.09494 6.458846 2.525345       10.61829 
1 1 1 -25 9  17 o 26.50705 5.807952 9.347784       3.647732 10.48909       6.247511 8.757464       4.493125 27.48619 8.481770 25.36998 7.026701 2.116207       11.01431 
1 1 1 -25 9  18 o 17.61361 6.354743 3.564401       3.491784 9.379500       5.942051 0.4971456      4.315517 26.09119 8.304139 15.32273 6.541064 10.76846       10.57092 
1 1 1 -25 9  19 o 54.38755 4.025752 37.30375       5.297766 28.17358       12.18379 39.43246       5.883028 42.33286 11.51002 55.76291 4.364055 -13.43005      12.30957 
1 1 1 -25 9  20 f 13.18032 5.772846 -0.3846926     3.538005 -0.3141903     6.205106 -0.4186538     4.306645 17.25199 7.597672 14.47474 6.353604 2.777242       9.904185 
1 1 1 -25 9  21 o 21.94774 6.401340 6.542414       3.634008 6.915863       6.227056 6.349542       4.475087 23.18279 8.468513 21.81086 7.226697 1.371931       11.13287 
1 1 1 -25 9  22 o 40.11811 4.517474 20.71494       4.339756 22.71813       6.962728 19.44236       5.549590 40.40764 7.341308 37.98905 6.208967 2.418587       9.614888 
1 1 1 -25 9  23 o 22.52826 7.308763 6.968431       4.587581 9.846029       6.053666 3.086517       7.031148 26.14041 8.388387 20.26923 8.484830 5.871174       11.93136 
1 1 1 -25 9  24 o 29.92876 8.510383 13.31418       6.500251 13.31418       6.500251 0.000000       0.000000 29.92876 8.510383 ?        ?        0.000000       8.510383 
1 1 1 -25 9  25 o 41.57484 4.386898 22.32785       4.377581 17.87131       6.878329 25.36185       5.675340 34.76415 8.244850 43.69616 5.447823 -8.932014      9.882121 
1 1 1 -25 9  26 o 27.53012 6.280570 10.58455       4.120041 7.783253       6.218569 12.77628       5.500518 23.48897 8.479672 29.53470 7.598913 -6.045732      11.38632 
1 1 1 -25 9  27 o 40.26534 4.583824 21.22993       4.417764 13.83982       6.632231 27.12412       5.923066 29.86870 8.629267 44.89627 5.530529 -15.02757      10.24944 
1 1 1 -25 9  28 o 23.52796 6.687851 7.995505       4.014986 10.11016       6.204904 6.472386       5.266015 25.58077 8.510622 21.50511 7.797762 4.075665       11.54278 
1 1 1 -25 9  29 o 43.78208 5.980687 26.61099       6.214292 25.30632       8.807357 27.90444       8.769438 39.36048 9.326112 41.97880 8.851670 -2.618320      12.85801 
1 1 1 -25 9  30 o 17.64697 6.947643 3.607112       4.386656 -4.046968      9.324583 5.782510       4.971098 17.58341 8.303384 20.33522 7.542558 -2.751812      11.21768 
1 1 1 -25 9  31 o 16.98046 6.453492 3.557095       3.686921 4.994954       5.853125 2.611306       4.747081 19.80453 7.950335 16.88511 7.012362 2.919416       10.60099 
1 1 1 -25 9  32 o 16.24184 6.420722 2.956675       3.760326 -0.4568694     5.752081 5.504268       4.969210 15.57499 7.051935 19.77738 7.497800 -4.202387      10.29305 
1 1 1 -25 10 1  o 44.14735 3.369514 24.34110       3.597611 27.98154       5.105559 20.75091       5.070205 46.91238 4.521979 40.00574 5.333522 6.906643       6.992478 
1 1 1 -25 10 2  o 76.95241 3.184108 73.47372       5.958087 90.12132       9.146923 61.20463       7.852451 84.52727 4.456348 69.50301 4.663220 15.02426       6.450168 
1 1 1 -25 10 3  o 53.87544 2.843919 35.91521       3.720516 33.08899       4.991003 39.44989       5.581604 51.31221 4.023612 56.01381 4.117882 -4.701599      5.757292 
1 1 1 -25 10 4  o 47.65802 3.554033 28.35717       4.097844 36.28897       7.087404 24.37399       5.022456 53.08040 5.561677 43.72937 4.791461 9.351025       7.341005 
1 1 1 -25 10 5  o 58.32967 3.186783 42.20395       4.512584 45.82193       7.701495 40.31242       5.568635 59.85775 5.335686 56.69223 4.057611 3.165524       6.703264 
1 1 1 -25 10 6  o 20.39810 6.047686 5.445051       3.221179 2.113304       5.720490 6.991953       3.897882 18.72450 7.729737 22.92295 6.613267 -4.198446      10.17272 
1 1 1 -25 10 7  o 10.97172 5.080883 -2.474954      3.219457 -8.407592      11.19522 -1.940099      3.361450 19.57308 9.198114 11.66586 5.324359 7.907218       10.62799 
1 1 1 -25 10 8  o 113.8776 3.211097 160.4658       8.902132 158.8856       21.54810 160.7910       9.775335 108.8681 8.182038 113.8125 3.528828 -4.944382      8.910577 
1 1 1 -25 10 9  o 88.45776 3.190309 96.84860       6.865827 91.81092       17.62670 97.74963       7.454582 81.88894 8.980164 88.75054 3.453392 -6.861603      9.621291 
1 1 1 -25 10 10 f 88.23363 2.837451 96.05143       6.093033 81.84718       10.42364 103.4239       7.509606 80.15902 5.367114 91.32478 3.380200 -11.16576      6.342843 
1 1 1 -25 10 11 o 17.90870 5.992725 3.943378       3.075764 -1.837551      7.291128 5.194847       3.392391 17.98889 8.059555 20.05573 6.260152 -2.066847      10.20519 
1 1 1 -25 10 12 o 75.29450 3.017717 70.11341       5.525826 60.56428       11.55604 72.94408       6.291761 67.73398 7.106810 76.66010 3.376240 -8.926125      7.868020 
1 1 1 -25 10 13 o 49.41165 4.374116 30.82114       5.212560 22.15460       7.282977 39.92311       7.463691 40.36366 7.684885 55.71579 5.571834 -15.35214      9.492249 
1 1 1 -25 10 14 o 12.90311 5.606897 -0.2566681     3.281295 -2.097782      5.753665 0.6307562      3.994569 15.70048 7.086123 15.00017 6.343808 0.7003078      9.510891 
1 1 1 -25 10 15 o 62.06362 2.992129 47.71518       4.512033 53.09472       8.405847 45.53786       5.347742 64.31646 5.413391 60.38598 3.651170 3.930481       6.529613 
1 1 1 -25 10 16 f 83.79737 2.793341 86.77467       5.696172 77.25040       9.943758 91.42648       6.949366 77.66550 5.285449 85.76466 3.331405 -8.099159      6.247738 
1 1 1 -25 10 17 o 32.93552 4.433932 13.89241       3.468369 15.18712       6.866190 13.44887       4.018787 32.66171 8.533969 32.06309 5.330526 0.5986176      10.06196 
1 1 1 -25 10 18 o 31.41463 6.224385 13.25609       4.596498 20.19071       6.976550 7.936941       6.110134 38.09703 7.778130 24.40323 8.441680 13.69380       11.47873 
1 1 1 -25 10 19 o 24.70323 6.268983 8.300772       3.779526 15.20512       6.901448 5.343001       4.517114 32.44364 8.593778 20.61230 7.249844 11.83134       11.24337 
1 1 1 -25 10 20 o 97.08212 3.566802 118.0360       8.423944 104.7103       17.21469 122.2317       9.659493 86.50072 8.267100 98.42296 4.035935 -11.92223      9.199658 
1 1 1 -25 10 21 o 13.44736 5.841773 -0.7096364E-01 3.559907 3.202481       6.159966 -1.712456      4.362095 19.65418 8.057504 13.54607 6.136401 6.108108       10.12812 
1 1 1 -25 10 22 o 26.02729 7.230362 9.559162       4.749533 11.66511       6.321494 6.829425       7.197073 28.22902 8.496687 23.40003 8.986139 4.828989       12.36707 
1 1 1 -25 10 23 o 29.68769 6.972945 12.39524       4.958186 14.44355       6.699768 9.915100       7.372241 31.17955 8.558867 26.17656 9.257060 5.002995       12.60743 
1 1 1 -25 10 24 o 37.16738 5.571117 18.47051       4.890632 12.60736       6.458093 26.35398       7.488544 29.01095 8.553376 43.20929 7.376448 -14.19834      11.29479 
1 1 1 -25 10 25 o 14.50464 6.071821 1.100734       3.600702 3.116199       5.740780 -0.2063514     4.623121 18.86835 7.761598 14.88080 6.555546 3.987545       10.15961 
1 1 1 -25 10 26 o 65.59428 3.494684 54.45528       5.565955 38.15031       8.224881 68.23061       7.559983 52.44639 6.579872 72.77770 4.281631 -20.33131      7.850292 
1 1 1 -25 10 27 o 22.30795 6.714209 7.123672       3.947453 14.20684       6.204678 2.307190       5.116468 30.46433 8.184360 17.34804 7.248248 13.11629       10.93256 
1 1 1 -25 10 28 o 17.71523 6.782768 3.728802       4.092100 5.382932       7.194911 2.937890       4.975132 21.24489 8.708705 17.65846 7.240508 3.586426       11.32548 
1 1 1 -25 10 29 f 16.48296 6.442412 3.010104       3.748633 -2.915147      5.899426 7.022593       4.854711 14.61445 6.805282 21.82213 7.525740 -7.207680      10.14636 
1 1 1 -25 10 30 o 32.72653 6.218440 15.32221       4.778009 4.515913       10.18349 18.37264       5.410518 21.72034 9.641144 35.70885 6.455194 -13.98851      11.60264 
1 1 1 -25 10 31 o 29.02237 5.882803 12.00921       4.017950 13.39504       6.278451 11.04798       5.228919 28.52181 8.439919 26.49243 7.664636 2.029381       11.40083 
1 1 1 -25 10 32 o 21.40892 6.774281 6.882217       3.959284 6.372791       6.323618 7.210682       5.077734 20.98959 8.317236 21.65699 7.680329 -0.6673946     11.32095 
1 1 1 -25 11 1  o 71.95692 3.020381 64.26167       5.284497 66.90795       7.082830 60.93893       7.936656 72.92939 4.000690 69.15448 4.738198 3.774910       6.201293 
1 1 1 -25 11 2  o 67.52003 3.360195 56.79017       5.511457 55.82147       10.24047 57.18519       6.539347 65.00420 6.553998 67.45175 3.996279 -2.447548      7.676271 
1 1 1 -25 11 3  o 39.95571 3.393826 19.96676       3.273252 17.38468       4.326451 23.42315       5.005619 36.72285 4.961388 42.73830 4.894413 -6.015453      6.969265 
1 1 1 -25 11 4  o 43.33638 3.889350 23.62446       4.063750 27.95017       7.007686 21.43277       4.988104 46.00916 6.425189 40.78997 5.131474 5.219189       8.222839 
1 1 1 -25 11 5  o 13.74383 5.641755 1.008348       3.024963 -8.791739      5.523123 5.207687       3.615432 12.12071 5.892791 20.11406 6.485238 -7.993355      8.762608 
1 1 1 -25 11 6  o 72.76179 2.960269 65.50050       5.237969 70.30106       9.237319 63.22539       6.359172 74.27825 5.134868 71.19225 3.677957 3.086006       6.316188 
1 1 1 -25 11 7  o 54.62570 3.316828 37.10729       4.394451 33.43475       7.782952 38.82604       5.324365 50.43530 6.482181 55.64873 3.951950 -5.213436      7.591876 
1 1 1 -25 11 8  o 105.3167 3.178718 137.3669       8.148696 149.9555       20.25411 134.9357       8.900837 105.7374 7.917972 104.1950 3.510495 1.542351       8.661285 
1 1 1 -25 11 9  o 35.26227 4.489526 15.84372       3.770507 9.285906       7.784336 17.85391       4.309828 26.67317 9.504290 37.33319 4.851945 -10.66002      10.67112 
1 1 1 -25 11 10 o 28.90973 5.627171 10.99683       3.821659 0.000000       0.000000 10.99683       3.821659 ?        ?        28.90973 5.627171 0.000000       5.627171 
1 1 1 -25 11 11 o 16.57442 6.422961 2.521166       3.701005 7.364398       7.567465 0.9985294      4.243077 24.79739 9.284733 15.72982 6.588406 9.067570       11.38479 
1 1 1 -25 11 12 o 22.23985 6.354649 6.592121       3.615589 -0.5234531     6.162555 10.32710       4.464780 17.25555 7.586399 27.63195 6.700549 -10.37640      10.12180 
1 1 1 -25 11 13 o 79.17677 3.168697 77.74779       6.101500 71.53304       9.447010 82.19559       7.991998 74.82907 5.213298 80.96048 4.063844 -6.131409      6.610092 
1 1 1 -25 11 14 o 42.40273 3.696293 22.56588       3.781275 24.02215       7.208191 22.01299       4.441447 42.11621 7.286959 41.60715 4.449462 0.5090561      8.538002 
1 1 1 -25 11 15 o 66.56399 2.971069 54.91945       4.807202 49.67627       8.683469 57.23647       5.772474 61.82195 5.832819 67.73109 3.509307 -5.909142      6.807130 
1 1 1 -25 11 16 o 83.66242 2.822822 86.61163       5.746819 95.19232       10.59622 83.03596       6.840187 86.27628 5.062161 81.60843 3.447277 4.667854       6.124475 
1 1 1 -25 11 17 o 18.55837 5.885888 4.461516       2.987401 8.741133       6.793862 3.435686       3.326228 25.43136 8.895203 17.22825 6.204013 8.203108       10.84502 
1 1 1 -25 11 18 f 14.89149 5.654877 2.207022       2.829440 -0.6587887     6.091270 2.995497       3.195052 16.86948 7.473882 16.44628 6.056404 0.4232025      9.619717 
1 1 1 -25 11 19 o 64.20061 4.024677 52.11342       6.264925 60.88369       8.956226 43.71041       8.766698 68.43380 5.414641 57.21941 6.396499 11.21439       8.380545 
1 1 1 -25 11 20 o 28.93295 6.496768 11.50851       4.468225 8.179393       11.08637 12.15418       4.882327 26.33248 10.80401 29.56031 6.903358 -3.227835      12.82120 
1 1 1 -25 11 21 o 23.27999 7.433334 7.512775       4.758106 3.891311       6.333371 12.20533       7.209374 20.31325 8.228965 28.64419 9.150284 -8.330936      12.30624 
1 1 1 -25 11 22 o 54.83420 4.503490 38.63801       5.964804 34.97567       7.623241 44.42023       9.578729 50.95071 6.271998 56.78236 7.075510 -5.831654      9.455200 
1 1 1 -25 11 23 o 43.61422 4.180308 24.39670       4.388637 22.61394       6.942865 25.58302       5.663630 39.97404 7.399755 43.96522 5.399527 -3.991177      9.160309 
1 1 1 -25 11 24 o 14.65363 6.300084 0.5248823      4.056126 -3.504593      5.403712 5.725217       6.138802 13.97204 6.508474 21.51789 8.289912 -7.545854      10.53959 
1 1 1 -25 11 25 o 16.43288 6.375009 2.825479       3.648946 -2.105458      5.552265 6.574411       4.841269 14.88720 6.812881 21.74660 7.514612 -6.859391      10.14321 
1 1 1 -25 11 26 o 19.12181 7.134081 4.601405       4.459658 4.937136       5.985524 4.182454       6.686326 20.41976 8.091712 20.25375 8.358520 0.1660118      11.63360 
1 1 1 -25 11 27 o 13.14178 5.903665 -0.9001001     3.940996 -9.623462      7.867127 2.022372       4.553542 14.49699 7.044611 16.43378 6.849915 -1.936782      9.825878 
1 1 1 -25 11 28 o 22.33232 7.010520 7.328534       4.248192 10.47709       7.653976 5.926765       5.107044 25.43435 9.372567 20.66212 7.648467 4.772230       12.09728 
1 1 1 -25 11 29 o 30.82155 5.640727 13.24699       4.080603 10.86378       6.438532 14.84692       5.275404 25.85204 8.670720 31.61631 7.029113 -5.764265      11.16198 
1 1 1 -25 11 30 o 27.44195 6.891041 11.28517       4.601155 -6.515472      9.377645 16.92921       5.280454 16.65162 7.991365 34.06609 6.599220 -17.41447      10.36396 
1 1 1 -25 11 31 o 16.46112 6.453683 3.135116       3.771413 9.746926       6.270844 -0.6116439     4.720562 24.32573 8.543147 14.24022 6.423563 10.08551       10.68866 
1 1 1 -25 12 1  o 55.64303 3.245863 38.64809       4.382150 34.96215       5.658358 44.17197       6.926904 52.35062 4.478371 58.63737 4.892155 -6.286751      6.632419 
1 1 1 -25 12 2  o 65.60729 2.839950 53.35455       4.529696 52.73346       6.512551 53.93657       6.304430 64.59972 4.159089 65.43725 3.972236 -0.8375244     5.751233 
1 1 1 -25 12 3  o 70.66060 3.100677 62.03000       5.326124 65.97489       8.984984 59.89284       6.613312 71.66825 5.179578 69.01931 3.948464 2.648941       6.512941 
1 1 1 -25 12 4  o 15.60108 6.041876 2.246327       3.273273 -0.4452728     5.804626 3.501308       3.963579 16.73099 7.359038 17.97955 6.722054 -1.248556      9.967018 
1 1 1 -25 12 5  f 106.0504 2.860610 139.0836       7.386014 140.4892       12.35380 138.3017       9.214202 105.1631 4.833525 105.3032 3.595984 -0.1400757     6.024455 
1 1 1 -25 12 6  o 35.46009 4.230879 15.98893       3.583964 12.56769       6.312940 17.61602       4.353571 29.86716 8.350270 36.97001 4.957181 -7.102846      9.710853 
1 1 1 -25 12 7  o 39.98759 4.248895 20.27744       4.077046 17.46842       8.305217 21.16929       4.679725 34.65876 9.535436 40.64582 4.818246 -5.987061      10.68363 
1 1 1 -25 12 8  o 18.03887 6.490646 3.755573       3.639817 0.000000       0.000000 3.755573       3.639817 ?        ?        18.03887 6.490646 0.000000       6.490646 
1 1 1 -25 12 9  o 76.54055 3.649388 73.12052       6.787267 64.74424       12.18355 76.88982       8.172940 69.59658 7.291856 78.13031 4.309312 -8.533730      8.470026 
1 1 1 -25 12 10 o 45.74393 4.077424 26.39421       4.497634 27.24100       7.340316 25.88519       5.691104 45.13048 6.892593 44.77448 5.319776 0.3560028      8.706771 
1 1 1 -25 12 11 o 24.70556 5.707765 8.131409       3.367234 0.3505424      6.216421 11.36230       4.005785 17.85851 7.739042 29.26219 5.822411 -11.40369      9.684690 
1 1 1 -25 12 12 o 61.29515 3.424834 46.84053       5.095318 40.11257       12.54660 48.16930       5.575823 52.34291 10.20307 62.04232 3.704822 -9.699409      10.85488 
1 1 1 -25 12 13 o 73.21928 3.276615 66.68757       5.831569 71.04903       9.208908 63.76768       7.534863 74.51379 5.102278 71.02930 4.374352 3.484489       6.720729 
1 1 1 -25 12 14 o 61.87132 3.101101 47.57227       4.660738 45.70124       8.512506 48.37328       5.569750 59.09719 5.993717 62.13876 3.694897 -3.041576      7.041088 
1 1 1 -25 12 15 o 54.82486 3.236414 37.46671       4.304685 30.83892       8.071065 40.10156       5.088905 47.68402 7.167324 56.52736 3.714867 -8.843338      8.072842 
1 1 1 -25 12 16 o 39.05172 3.851230 19.28778       3.617364 20.82744       7.595414 18.83610       4.113883 38.23402 8.383496 38.34081 4.487880 -0.1067963     9.509158 
1 1 1 -25 12 17 o 10.06768 4.724663 -2.752771      2.936194 -4.899899      6.485510 -2.199226      3.293000 15.06141 7.053313 11.23191 5.179063 3.829497       8.750539 
1 1 1 -25 12 18 o 18.55825 6.066410 4.460297       3.157424 7.440338       6.871697 3.662759       3.554909 23.95010 8.870823 17.66840 6.406794 6.281694       10.94251 
1 1 1 -25 12 19 o 8.833909 4.285193 -4.559823      2.877419 -11.66396      5.903503 -2.346237      3.295356 11.62396 5.739796 11.10421 5.141606 0.5197458      7.705931 
1 1 1 -25 12 20 o 23.73482 8.455265 7.643040       6.160440 13.34222       11.14119 5.133156       7.393539 29.59111 11.22484 22.10796 8.914306 7.483154       14.33394 
1 1 1 -25 12 21 f 23.71901 8.300052 7.767187       5.915575 7.767187       5.915575 0.000000       0.000000 23.71901 8.300052 ?        ?        0.000000       8.300052 
1 1 1 -25 12 22 o 27.83160 5.784261 10.54212       3.794829 10.11175       6.287580 10.78871       4.759421 26.23423 8.559703 27.55848 7.057044 -1.324249      11.09371 
1 1 1 -25 12 23 o 16.83790 6.392702 3.124027       3.615507 4.293716       5.847617 2.400160       4.600161 20.01902 7.976799 17.10132 6.981352 2.917698       10.60041 
1 1 1 -25 12 24 o 54.87708 4.453804 38.98036       5.904895 35.57706       7.601885 44.15753       9.376006 51.01674 6.244710 56.14144 7.005285 -5.124706      9.384584 
1 1 1 -25 12 25 o 13.83580 6.231720 -1.097120      4.423604 1.567322       5.667660 -5.250229      7.075993 17.38959 7.461310 15.25047 7.211178 2.139123       10.37652 
1 1 1 -25 12 26 o 42.27518 4.661210 23.53786       4.722361 19.78918       7.314947 26.21662       6.183568 35.74411 8.519099 43.65158 5.969240 -7.907478      10.40225 
1 1 1 -25 12 27 f 22.01294 7.186138 7.082535       4.431282 0.2704196      8.600902 9.544190       5.170310 19.02147 8.616717 25.04055 7.714025 -6.019087      11.56521 
1 1 1 -25 12 28 o 40.72930 4.715497 22.10807       4.593902 21.44909       7.342373 22.53198       5.888955 36.94732 8.351824 39.89408 6.263628 -2.946758      10.43964 
1 1 1 -25 12 29 o 27.87728 5.954899 11.08054       3.922483 0.8400085      6.119482 18.22215       5.110360 16.90386 7.490036 35.86300 6.063384 -18.95914      9.636662 
1 1 1 -25 12 30 o 18.42088 6.986705 4.486338       4.316010 -1.654997      10.11628 5.852946       4.772122 18.80339 8.806791 20.16093 7.405544 -1.357540      11.50659 
1 1 1 -25 12 31 o 34.31109 5.227292 16.27073       4.232774 9.538310       6.684619 20.77692       5.468847 23.94469 8.769784 38.07667 6.099714 -14.13198      10.68249 
1 1 1 -25 13 1  o 53.34243 3.117208 35.51970       4.034390 35.00824       5.705399 36.03119       5.705580 52.27491 4.523210 53.07778 4.452130 -0.8028755     6.346722 
1 1 1 -25 13 2  o 45.60144 3.562316 26.15664       3.927258 23.03155       5.081024 30.79411       6.189574 42.11224 5.051881 48.61742 5.310621 -6.505184      7.329679 
1 1 1 -25 13 3  o 25.17565 6.060443 8.595086       3.673154 5.073802       6.840858 10.02157       4.354047 21.91047 8.660633 26.99555 6.660260 -5.085075      10.92546 
1 1 1 -25 13 4  o 27.65917 5.764110 10.23956       3.758965 4.857993       7.183092 12.26910       4.411184 22.04177 8.821406 30.15015 6.210664 -8.108383      10.78840 
1 1 1 -25 13 5  o 40.69387 4.148411 21.03188       4.056367 18.34558       8.287591 21.87815       4.651632 35.24655 9.454358 41.27733 4.708531 -6.030781      10.56197 
1 1 1 -25 13 6  f 66.01199 3.772599 54.67058       6.043484 64.74822       10.82240 50.10395       7.285204 70.02699 6.413064 62.62368 4.810669 7.403313       8.016853 
1 1 1 -25 13 7  o 39.12024 4.607656 19.60802       4.308407 20.39458       6.902765 19.10605       5.514414 38.38450 7.648244 37.89832 6.184001 0.4861832      9.835523 
1 1 1 -25 13 8  o 72.24164 3.366945 65.03937       5.911033 58.09959       9.010496 70.28228       7.831810 66.98534 5.570280 74.56793 4.328574 -7.582596      7.054401 
1 1 1 -25 13 9  o 27.62463 5.838281 10.19595       3.807022 -0.5197573     10.41332 11.84914       4.090161 21.63991 9.668135 29.83336 5.835152 -8.193457      11.29256 
1 1 1 -25 13 10 f 50.70307 3.399032 32.12188       4.175510 27.79377       7.367644 34.16980       5.067985 45.45928 6.864419 52.04505 4.027259 -6.585766      7.958584 
1 1 1 -25 13 11 o 39.45030 3.990132 19.70228       3.783277 20.37190       6.964950 19.42201       4.505987 38.30418 7.728507 38.81779 4.870394 -0.5136032     9.135127 
1 1 1 -25 13 12 o 83.20695 3.248072 86.15791       6.573343 75.27905       10.01212 94.39975       8.714579 76.35891 5.415740 86.54050 4.144336 -10.18159      6.819513 
1 1 1 -25 13 13 o 77.17314 3.812334 74.76051       7.147379 61.53800       14.11172 79.32281       8.289233 65.75620 9.046040 79.17677 4.312439 -13.42057      10.02138 
1 1 1 -25 13 14 o 13.01487 5.573480 0.2012857      3.151194 1.857573       6.164208 -0.3846946     3.666494 18.73018 7.898787 13.41089 5.875206 5.319286       9.844232 
1 1 1 -25 13 15 o 63.37980 3.094851 50.01437       4.765534 45.34649       8.696072 52.01790       5.697185 58.50594 6.193325 64.37508 3.646582 -5.869144      7.187129 
1 1 1 -25 13 16 o 21.47726 5.943587 6.237092       3.216199 14.45699       6.448468 3.515280       3.710670 31.64260 8.271581 17.62429 6.520330 14.01831       10.53251 
1 1 1 -25 13 17 o 12.41620 5.389728 -0.1149459     3.025542 1.764550       6.326299 -0.6723076     3.445066 18.70812 7.950683 12.70895 5.626146 5.999172       9.739964 
1 1 1 -25 13 18 o 15.55892 5.924975 2.473976       3.111593 5.969281       6.397502 1.390907       3.561196 22.22120 8.487556 14.87853 6.115979 7.342675       10.46154 
1 1 1 -25 13 19 o 25.38297 6.336076 8.893518       3.906729 5.059519       6.139578 11.50215       5.064293 21.15674 8.251851 28.49021 7.271060 -7.333464      10.99824 
1 1 1 -25 13 20 o 17.63433 6.593238 3.539917       3.813200 -14.71109      9.116281 7.410324       4.198099 14.84099 7.290078 23.05634 6.920627 -8.215345      10.05188 
1 1 1 -25 13 21 o 20.67653 6.627701 5.820214       3.779848 9.564394       6.116807 3.507266       4.807611 25.61442 8.447398 18.46514 7.272259 7.149284       11.14649 
1 1 1 -25 13 22 f 22.34293 7.277886 6.987415       4.546407 6.101965       6.473033 7.849487       6.387012 22.05420 8.508359 23.69962 8.588534 -1.645418      12.08946 
1 1 1 -25 13 23 o 15.14402 6.196939 1.695710       3.635085 -1.061969      5.595413 3.709522       4.781561 15.59053 7.016522 18.50719 7.263503 -2.916664      10.09901 
1 1 1 -25 13 24 o 21.38661 8.085042 6.031558       5.768509 6.031558       5.768509 0.000000       0.000000 21.38661 8.085042 ?        ?        0.000000       8.085042 
1 1 1 -25 13 25 o 23.39092 6.778815 7.907185       4.086943 12.98363       6.496636 4.582404       5.257630 28.76662 8.603328 19.54122 7.632029 9.225399       11.50066 
1 1 1 -25 13 26 o 49.42045 4.457125 32.00360       5.310192 18.31185       9.178786 38.89153       6.510284 32.23554 10.32757 54.03579 5.000763 -21.80025      11.47459 
1 1 1 -25 13 27 o 16.72821 6.578170 3.079887       3.928448 -4.242004      6.285401 7.773689       5.032500 14.46713 6.827369 22.73471 7.665997 -8.267573      10.26550 
1 1 1 -25 13 28 o 11.32366 5.294920 -2.594254      3.632015 -7.393160      5.748267 0.5947460      4.685900 12.42336 6.033432 15.18276 6.646935 -2.759398      8.976863 
1 1 1 -25 13 29 o 15.76691 6.363068 2.470643       3.770767 -4.617209      5.815283 7.612781       4.953195 13.57375 6.452905 22.30329 7.604532 -8.729536      9.973409 
1 1 1 -25 13 30 o 19.99492 7.112195 5.830894       4.357223 2.308589       10.94293 6.494557       4.750008 20.71109 9.510190 20.84546 7.424675 -0.1343632     12.06522 
1 1 1 -25 14 1  o 34.42928 3.922693 15.14359       3.232520 20.32687       4.554426 9.881981       4.588714 39.51421 4.830105 26.47995 7.004341 13.03427       8.508272 
1 1 1 -25 14 2  o 26.48385 5.950229 9.548078       3.746241 13.01259       4.233322 -2.961802      8.044273 31.10139 5.798813 17.77602 8.159297 13.32537       10.01001 
1 1 1 -25 14 3  o 19.47481 7.189538 4.507450       4.507214 -0.2045144     7.572065 7.093090       5.609154 18.75239 8.319206 23.02986 8.080492 -4.277475      11.59757 
1 1 1 -25 14 4  f 35.13088 5.277508 16.21591       4.378557 21.43015       6.774540 12.47503       5.738142 39.28079 7.347260 29.56574 7.838243 9.715050       10.74338 
1 1 1 -25 14 5  o 44.58622 4.235517 25.32659       4.546763 23.07905       7.063225 26.91692       5.941475 40.83105 7.369781 45.32999 5.490409 -4.498936      9.190118 
1 1 1 -25 14 6  f 21.28976 6.266716 6.110644       3.469002 9.660066       6.320118 4.580233       4.150023 26.17880 8.584279 19.37871 6.935734 6.800097       11.03604 
1 1 1 -25 14 7  o 21.77064 6.107929 6.402894       3.371430 5.836542       6.136898 6.647711       4.034843 22.12451 8.344711 22.16431 6.812116 -0.3980255E-01 10.77215 
1 1 1 -25 14 8  o 15.48916 5.925990 2.359905       3.122031 3.506672       6.001179 1.934367       3.655678 19.88559 8.026576 15.68895 6.288287 4.196636       10.19649 
1 1 1 -25 14 9  o 53.83917 3.708756 36.44606       4.836165 51.02697       12.95499 34.08510       5.213023 59.48540 9.236413 51.85147 4.160540 7.633930       10.13022 
1 1 1 -25 14 10 o 15.73569 6.051636 2.405243       3.267320 0.9693410      6.607437 2.869994       3.759072 18.56565 8.011969 16.91045 6.494256 1.655199       10.31344 
1 1 1 -25 14 11 o 51.35805 3.363333 33.00556       4.186182 34.08650       7.837063 32.57402       4.951784 50.44992 6.527513 50.72801 4.039022 -0.2780952     7.676075 
1 1 1 -25 14 12 o 58.56810 3.266593 42.83788       4.643742 35.38453       8.279589 46.25851       5.609018 51.18401 6.806584 60.60272 3.817427 -9.418713      7.803995 
1 1 1 -25 14 13 o 61.49084 3.168180 47.15948       4.731400 48.05126       8.718510 46.78720       5.633044 60.31789 6.011395 60.93412 3.812662 -0.6162338     7.118515 
1 1 1 -25 14 14 o 46.35642 4.166840 27.35472       4.656919 21.74122       7.663542 30.64116       5.863747 38.89323 8.336292 48.62801 5.020350 -9.734783      9.731274 
1 1 1 -25 14 15 f 40.74673 4.298839 21.25557       4.204287 26.68041       11.39616 20.40091       4.523362 40.68703 11.16017 39.69284 4.772007 0.9941940      12.13761 
1 1 1 -25 14 16 o 22.83458 5.963121 7.109509       3.353617 5.878981       6.598207 7.538113       3.894109 22.25966 8.589540 23.37099 6.566983 -1.111326      10.81228 
1 1 1 -25 14 17 o 20.53482 6.832145 5.605340       3.998762 3.003592       6.392203 7.278116       5.125506 19.63037 8.143517 23.02652 7.736376 -3.396143      11.23247 
1 1 1 -25 14 18 o 28.78035 5.941487 11.26502       4.028886 16.03760       6.631749 8.473189       5.072194 33.09906 8.251219 24.46610 7.657420 8.632963       11.25694 
1 1 1 -25 14 19 o 46.77771 3.528532 27.62687       3.992595 16.95081       6.737767 33.40433       4.956547 33.97799 8.226237 51.21136 4.003500 -17.23337      9.148715 
1 1 1 -25 14 20 o 16.58913 6.257241 3.037998       3.450676 7.520473       9.551614 2.365162       3.700605 24.70284 10.06917 16.04915 6.361610 8.653694       11.91043 
1 1 1 -25 14 21 o 30.80224 4.870834 12.54047       3.534699 3.039199       6.107134 17.32657       4.334488 19.14970 7.953350 36.20387 5.050253 -17.05417      9.421297 
1 1 1 -25 14 22 o 36.40560 5.221583 17.67391       4.499971 9.705814       6.946647 23.43521       5.906881 25.47047 8.987823 41.45325 6.023565 -15.98278      10.81962 
1 1 1 -25 14 23 o 22.09812 6.715530 6.936746       3.935613 -3.795598      5.906149 15.50835       5.278228 14.41815 6.745213 33.00693 6.788909 -18.58878      9.570119 
1 1 1 -25 14 24 o 15.53396 6.604649 1.227799       4.368914 -1.796730      6.035762 4.556540       6.332034 15.55951 7.114044 20.22396 8.215151 -4.664448      10.86730 
1 1 1 -25 14 25 o 61.66857 3.940505 48.97552       5.890792 31.41287       9.942492 58.47564       7.312482 43.93443 9.558945 66.85160 4.515149 -22.91717      10.57166 
1 1 1 -25 14 26 o 22.86783 6.664270 7.657127       3.940087 2.220797       6.283435 11.17986       5.058064 18.12621 7.817638 27.13151 7.432268 -9.005301      10.78675 
1 1 1 -25 14 27 o 32.94732 5.605334 15.08693       4.339450 13.02329       7.045448 16.34832       5.508267 27.84892 9.059135 33.20595 7.026625 -5.357033      11.46479 
1 1 1 -25 14 28 o 14.51497 6.139628 1.269778       3.742600 -2.725460      6.002766 3.810465       4.786914 14.71582 6.856555 18.05115 7.209026 -3.335330      9.948990 
1 1 1 -25 14 29 o 12.79912 5.734003 -0.5455177     3.689861 2.127173       6.110935 -2.079072      4.628955 17.60571 7.650983 13.18979 6.102570 4.415923       9.786670 
1 1 1 -25 15 1  o 33.44382 4.397106 14.50974       3.496868 15.96632       4.320896 11.74490       5.953066 34.66737 5.281264 28.19535 8.184348 6.472015       9.740396 
1 1 1 -25 15 2  o 34.42872 4.918740 15.55699       4.009614 23.30859       7.697528 12.67054       4.697188 40.07251 8.160179 30.19546 6.570658 9.877048       10.47674 
1 1 1 -25 15 3  o 18.95053 6.593158 4.582097       3.729646 5.757442       6.726434 4.060331       4.481672 22.10320 8.632551 18.84008 7.125491 3.263124       11.19346 
1 1 1 -25 15 4  o 27.32050 5.824509 10.12596       3.759253 16.37645       7.755557 8.206400       4.297905 32.83472 9.282131 24.22584 6.930373 8.608873       11.58395 
1 1 1 -25 15 5  o 24.27024 5.851377 8.017615       3.420064 9.612629       6.202812 7.320901       4.099525 25.89745 8.504908 23.00642 6.822975 2.891031       10.90351 
1 1 1 -25 15 6  o 75.27022 3.003402 70.53938       5.497940 63.78711       9.233667 74.24809       6.843236 69.86993 5.466593 76.82832 3.665716 -6.958389      6.581878 
1 1 1 -25 15 7  o 29.49462 5.290864 11.53546       3.663100 4.671216       6.380896 14.90962       4.473719 21.07041 8.353045 33.42769 5.695971 -12.35728      10.11026 
1 1 1 -25 15 8  o 52.60574 3.458418 34.74387       4.408909 26.36527       7.692112 38.84322       5.380429 43.46964 7.534348 55.35639 4.015838 -11.88675      8.537760 
1 1 1 -25 15 9  o 42.95213 4.258010 23.57292       4.398242 14.64961       11.75814 25.02459       4.742527 30.77840 11.56316 44.16490 4.467913 -13.38650      12.39633 
1 1 1 -25 15 10 o 30.08589 4.987863 11.88752       3.528890 13.94402       6.794939 11.12799       4.129447 30.79168 8.682656 28.60922 6.108937 2.182455       10.61638 
1 1 1 -25 15 11 o 43.61995 3.791472 24.08485       3.990227 24.53260       7.278063 23.89243       4.771219 41.98776 7.382430 43.06196 4.618825 -1.074196      8.708261 
1 1 1 -25 15 12 f 31.11089 4.924560 12.68267       3.609340 10.43993       6.660158 13.61521       4.294667 26.86118 8.812413 31.88343 5.738488 -5.022257      10.51612 
1 1 1 -25 15 13 o 30.76326 4.899575 12.40519       3.549964 12.31667       6.956306 12.43636       4.127948 28.84394 8.958302 30.40762 5.782033 -1.563688      10.66223 
1 1 1 -25 15 14 o 13.56662 5.987672 -0.5349272     3.873714 -4.769557      6.487175 1.811773       4.829216 15.01960 7.040311 16.98193 7.064358 -1.962325      9.973521 
1 1 1 -25 15 15 o 24.50632 5.960664 8.210642       3.525010 3.139564       6.525121 10.30048       4.188846 19.84081 8.229012 27.30918 6.405712 -7.468369      10.42832 
1 1 1 -25 15 16 o 21.25641 7.438924 5.961751       4.751833 -8.607215      10.80053 9.458730       5.291480 18.33615 8.738685 25.69265 7.782509 -7.356497      11.70180 
1 1 1 -25 15 17 o 72.14347 3.864888 65.92071       6.769897 52.59555       11.62184 72.76453       8.328902 60.74746 8.048588 75.25011 4.563424 -14.50265      9.252275 
1 1 1 -25 15 18 o 30.65151 6.864496 13.21719       4.999672 7.014323       6.495382 22.23533       7.831897 23.02036 8.605492 38.74500 8.526677 -15.72464      12.11440 
1 1 1 -25 15 19 o 17.35582 6.121681 3.754005       3.222336 7.589188       5.942807 2.156861       3.835047 23.33676 8.305511 15.96096 6.425649 7.375797       10.50098 
1 1 1 -25 15 20 f 19.19232 6.410174 4.916449       3.519437 6.903361       9.949122 4.632255       3.762725 24.26726 10.12091 18.90057 6.619215 5.366684       12.09325 
1 1 1 -25 15 21 o 28.58660 5.870605 11.26509       3.952601 5.975481       6.023307 15.26563       5.238207 21.52598 8.232247 32.82272 6.773681 -11.29674      10.66080 
1 1 1 -25 15 22 o 31.92364 4.873839 13.55612       3.671581 14.16496       6.775579 13.30302       4.368574 30.10868 8.729031 30.98001 6.003407 -0.8713245     10.59419 
1 1 1 -25 15 23 o 27.66124 5.294030 10.42712       3.438621 22.13410       6.804668 6.412410       3.984846 38.87976 7.453183 21.23864 6.804767 17.64112       10.09231 
1 1 1 -25 15 24 o 25.85958 7.651142 10.14082       5.160022 6.321260       7.651196 13.32738       6.988494 22.14570 9.017548 28.64965 8.991383 -6.503942      12.73425 
1 1 1 -25 15 25 o 23.88295 6.720069 8.385620       4.074853 5.051738       6.537640 10.50364       5.210878 20.44794 8.332059 26.14264 7.676648 -5.694698      11.32935 
1 1 1 -25 15 26 o 46.93158 5.075567 29.72394       5.712528 21.29465       7.223614 43.79587       9.333312 36.82393 8.254422 54.58130 7.191898 -17.75737      10.94801 
1 1 1 -25 15 27 o 50.17181 4.059665 32.86287       4.921117 31.80653       7.853416 33.54580       6.314598 46.29510 7.194794 49.55679 5.311628 -3.261688      8.943067 
1 1 1 -25 15 28 o 12.28040 5.586649 -1.179105      3.662763 -1.188977      5.915695 -1.172968      4.664367 15.35975 7.030332 13.80975 6.290926 1.550000       9.434051 
1 1 1 -25 16 1  o 17.07462 5.493030 3.827999       2.594740 4.920534       3.354537 2.200724       4.093976 19.14910 6.252481 16.29393 6.610469 2.855171       9.099001 
1 1 1 -25 16 2  o 36.53766 4.466021 17.33681       3.893912 12.41520       6.891409 19.64508       4.719525 28.54902 8.924190 38.54915 5.152915 -10.00013      10.30503 
1 1 1 -25 16 3  o 32.22890 5.860965 14.09572       4.433590 7.315727       6.903914 18.85420       5.783826 23.44215 8.848821 36.86837 6.683663 -13.42622      11.08932 
1 1 1 -25 16 4  o 17.94140 6.309054 4.031723       3.420703 6.522547       6.707280 3.156120       3.976751 22.68520 8.684223 17.29422 6.669739 5.390976       10.94994 
1 1 1 -25 16 5  o 19.36106 6.142998 5.014984       3.253805 7.623739       5.482191 3.596208       4.042912 23.40754 7.999870 17.89654 6.767921 5.510994       10.47868 
1 1 1 -25 16 6  o 41.87352 3.974259 22.35925       4.006831 20.92110       6.674760 23.16945       5.009929 38.52423 7.378506 42.11655 4.977446 -3.592316      8.900412 
1 1 1 -25 16 7  o 15.13695 5.927805 2.113110       3.178792 5.005654       5.766830 0.8506340      3.809857 20.80271 8.029427 14.66608 6.198610 6.136633       10.14369 
1 1 1 -25 16 8  o 20.31955 6.104570 5.591537       3.265345 5.185166       6.112113 5.753846       3.862796 21.22177 8.245759 20.67367 6.706571 0.5480957      10.62876 
1 1 1 -25 16 9  o 70.52520 3.020248 62.02132       5.178646 48.42090       8.505626 70.03279       6.528096 60.41837 5.850094 74.59407 3.601899 -14.17570      6.870028 
1 1 1 -25 16 10 o 69.42384 3.433861 60.50251       5.791321 52.26297       13.84610 62.24961       6.375819 58.52458 10.07174 70.23132 3.738840 -11.70674      10.74332 
1 1 1 -25 16 11 o 43.30638 3.817545 23.80584       3.987565 23.91181       7.244566 23.75979       4.776173 41.21910 7.488094 42.85935 4.647250 -1.640251      8.812972 
1 1 1 -25 16 12 o 17.93617 6.132944 4.087691       3.222088 2.754413       5.813511 4.678844       3.871045 18.82989 7.784622 19.17489 6.713922 -0.3450089     10.27994 
1 1 1 -25 16 13 o 30.14102 5.211557 12.06385       3.689458 3.414351       6.264745 16.65672       4.565096 19.77868 8.119049 35.39215 5.469193 -15.61346      9.789332 
1 1 1 -25 16 14 o 32.75444 6.433386 14.76490       4.951762 12.51329       6.506742 17.86347       7.633031 29.00297 8.594458 34.37812 9.005468 -5.375145      12.44842 
1 1 1 -25 16 15 o 18.66026 6.639196 4.364551       3.797170 0.6377603      6.335049 6.454230       4.743755 17.74529 7.749576 21.79797 7.441809 -4.052675      10.74414 
1 1 1 -25 16 16 o 15.15113 5.956075 2.117709       3.219652 3.822430       6.514421 1.566708       3.703608 20.21046 8.285881 15.18046 6.238256 5.030001       10.37168 
1 1 1 -25 16 17 o 26.88238 5.427231 9.766634       3.432704 3.187171       6.302872 12.54120       4.092987 19.47672 8.083675 30.39337 5.736431 -10.91664      9.912238 
1 1 1 -25 16 18 f 41.71253 5.260296 23.07599       5.228367 6.503006       10.48154 28.56555       6.032446 24.29668 10.27580 46.33153 5.446874 -22.03485      11.63015 
1 1 1 -25 16 19 o 42.33014 3.923275 22.96047       4.000965 6.372895       6.791006 31.77911       4.951573 22.31243 8.685426 49.72892 4.123026 -27.41649      9.614363 
1 1 1 -25 16 20 o 18.82833 7.037173 4.373339       4.343209 -10.02581      9.698311 7.985578       4.857535 16.45627 7.954924 23.45956 7.512699 -7.003294      10.94173 
1 1 1 -25 16 21 o 22.06826 6.114859 6.856419       3.401850 8.242819       6.232144 6.268008       4.060071 23.68737 8.496805 21.08756 6.878202 2.599806       10.93185 
1 1 1 -25 16 22 o 35.06831 4.842653 16.36963       4.028069 9.044507       8.683391 18.37810       4.546882 24.65357 9.753543 36.96488 5.190439 -12.31131      11.04863 
1 1 1 -25 16 23 o 20.37409 6.969101 5.855406       4.160654 9.790829       8.053402 4.422564       4.859403 24.94681 9.524263 18.98515 7.359090 5.961660       12.03610 
1 1 1 -25 16 24 f 37.31049 5.005059 18.75623       4.436000 12.01727       6.871087 23.57249       5.808773 27.04518 8.954488 41.10354 5.973980 -14.05836      10.76435 
1 1 1 -25 16 25 o 34.95607 5.152546 16.64078       4.257672 13.05780       6.623641 19.16368       5.558069 28.15921 8.740799 36.50295 6.485901 -8.343739      10.88432 
1 1 1 -25 16 26 o 28.95660 5.953034 11.94818       4.060273 3.692142       6.452072 17.36142       5.224472 19.12017 8.073121 34.67409 6.419390 -15.55391      10.31425 
1 1 1 -25 16 27 o 14.94847 6.511118 0.7979220      4.447051 0.1430026      5.873060 1.678008       6.808213 16.10361 7.222740 17.91132 7.920121 -1.807711      10.71897 
1 1 1 -25 16 28 o 12.87493 5.777253 -0.5732678     3.762237 8.088365       6.206531 -5.604762      4.730397 22.59331 8.418703 11.54802 5.575757 11.04529       10.09770 
1 1 1 -25 17 1  o 15.75049 5.406559 3.125051       2.504641 3.465299       3.211412 2.596714       4.001787 16.83755 6.091647 16.53084 6.594868 0.3067169      8.977776 
1 1 1 -25 17 2  o 21.59692 6.115265 6.491339       3.363466 9.080697       5.973718 5.289440       4.069889 24.81496 8.352118 19.88798 6.889115 4.926979       10.82672 
1 1 1 -25 17 3  o 26.11037 5.827898 9.380787       3.614115 -2.137246      5.853435 16.47703       4.594476 15.32233 7.005666 34.97319 5.578202 -19.65086      8.955205 
1 1 1 -25 17 4  o 54.35051 4.242620 37.93637       5.574701 40.50360       8.833493 36.23719       7.186558 54.05410 6.860381 52.01540 5.766358 2.038708       8.961904 
1 1 1 -25 17 5  o 28.62643 5.537933 11.08007       3.723530 6.016289       6.511851 13.54009       4.538746 22.02794 8.524275 31.38529 6.154394 -9.357344      10.51379 
1 1 1 -25 17 6  o 9.018465 4.347704 -4.035268      2.849477 -4.156591      4.708028 -3.965136      3.579544 12.56410 5.923055 10.61576 5.051245 1.948342       7.784450 
1 1 1 -25 17 7  o 18.81419 6.114470 4.698843       3.210018 6.881987       5.330110 3.456395       4.021001 22.44560 7.876822 17.67077 6.733896 4.774828       10.36290 
1 1 1 -25 17 8  o 56.54893 3.327634 40.19052       4.565331 39.54619       7.718999 40.53716       5.661735 54.35299 5.923494 56.31884 4.154586 -1.965855      7.235217 
1 1 1 -25 17 9  o 22.31251 6.071366 6.860479       3.388469 5.324846       6.271623 7.493540       4.026789 21.34269 8.335576 23.14654 6.734817 -1.803852      10.71632 
1 1 1 -25 17 10 o 23.02780 6.603043 7.396568       3.897105 -3.686136      10.42434 9.197154       4.201773 19.61015 9.102459 25.59491 6.670169 -5.984766      11.28477 
1 1 1 -25 17 11 o 29.94945 5.714567 12.14141       4.018569 9.904301       6.429117 13.57588       5.148193 25.98772 8.663460 31.01481 6.980597 -5.027088      11.12584 
1 1 1 -25 17 12 o 38.93171 4.562362 19.67480       4.246404 27.84606       7.118998 15.16173       5.290669 44.95484 6.702967 32.90075 6.822906 12.05410       9.564612 
1 1 1 -25 17 13 o 20.47810 6.611154 5.703313       3.756404 8.167197       6.107965 4.204530       4.763827 24.03119 8.432108 19.13260 7.320100 4.898584       11.16621 
1 1 1 -25 17 14 o 31.72522 5.747261 13.64316       4.279706 12.39110       6.669825 14.51943       5.579827 28.59980 8.752534 31.80363 7.347405 -3.203825      11.42765 
1 1 1 -25 17 15 o 33.04302 4.788218 14.36087       3.743361 10.30059       6.920859 16.03993       4.450558 26.23611 8.987870 34.59234 5.460522 -8.356232      10.51661 
1 1 1 -25 17 16 o 34.54564 4.507049 15.56963       3.703825 13.22760       6.598586 16.64694       4.475335 29.46026 8.635222 35.27085 5.376600 -5.810598      10.17226 
1 1 1 -25 17 17 o 18.28224 6.241393 4.380389       3.336782 1.231594       5.913196 5.851494       4.041773 17.50087 7.566006 20.63667 6.868865 -3.135803      10.21889 
1 1 1 -25 17 18 o 11.64448 5.221681 -0.8913758     3.067876 -1.555334      5.744619 -0.6264582     3.628660 15.42987 7.010418 12.90777 5.740790 2.522102       9.061050 
1 1 1 -25 17 19 o 10.38621 4.980860 -4.437732      3.628129 -2.785476      6.059967 -5.360876      4.529668 15.11044 6.988116 11.56782 5.552212 3.542619       8.925291 
1 1 1 -25 17 20 o 21.10397 6.667284 6.312690       3.836565 0.2011065      9.957979 7.378009       4.157519 20.23136 9.206776 22.60438 6.908815 -2.373026      11.51071 
1 1 1 -25 17 21 o 26.19368 6.487127 9.870720       4.118954 5.867149       7.012267 11.97975       5.089514 21.56345 8.686119 28.37409 7.314258 -6.810642      11.35548 
1 1 1 -25 17 22 o 20.43610 6.589875 5.952309       3.732966 7.495777       5.859064 4.897649       4.843234 22.53563 8.217201 19.44279 7.394859 3.092850       11.05470 
1 1 1 -25 17 23 o 29.16553 5.100531 11.60263       3.493176 9.885521       6.343718 12.34986       4.184770 24.91124 8.602274 29.52270 6.021023 -4.611458      10.50009 
1 1 1 -25 17 24 o 15.06995 6.204267 1.863142       3.672167 0.3783610      5.955183 2.774085       4.664549 16.47792 7.339916 17.02109 6.998456 -0.5431728     10.14163 
1 1 1 -25 17 25 o 15.14517 6.019797 2.328296       3.322278 1.713575       5.941888 2.607876       4.007180 17.28278 7.527113 16.17502 6.548099 1.107761       9.976725 
1 1 1 -25 17 26 o 14.09621 6.017351 1.004911       3.651995 -3.126854      5.663079 3.946482       4.778312 14.04022 6.580181 18.10557 7.211895 -4.065345      9.762695 
1 1 1 -25 17 27 o 16.33325 6.587903 2.823662       4.039437 3.952382       7.449711 2.353604       4.807527 19.70042 8.504523 16.59636 6.985960 3.104063       11.00593 
1 1 1 -25 18 1  o 30.87523 4.253818 12.47208       3.115588 15.58839       4.126025 8.338020       4.752255 34.08286 5.126361 23.81559 7.405583 10.26727       9.006789 
1 1 1 -25 18 2  o 27.79700 5.740285 10.66340       3.759541 2.545796       5.881693 16.27114       4.888578 18.33059 7.722159 34.28489 6.073464 -15.95430      9.824393 
1 1 1 -25 18 3  o 43.12638 4.056485 23.95956       4.213071 18.13501       7.327242 26.83629       5.149431 34.22127 8.752508 45.22680 4.742725 -11.00552      9.954890 
1 1 1 -25 18 4  o 22.08166 6.930098 6.902092       4.151541 4.268223       6.044319 9.254374       5.712089 19.97887 8.058518 24.97397 8.159226 -4.995106      11.46790 
1 1 1 -25 18 5  o 20.09316 6.354073 5.549001       3.483806 6.026955       6.336337 5.341917       4.170788 21.76928 8.412808 19.99112 6.971120 1.778158       10.92574 
1 1 1 -25 18 6  o 33.92258 4.599801 15.07511       3.704574 18.41253       6.037213 13.05952       4.691716 35.93829 7.145229 30.51473 6.508068 5.423557       9.664845 
1 1 1 -25 18 7  o 34.74608 4.589839 15.79034       3.791372 10.35425       6.086620 19.23687       4.846446 26.31324 8.407845 37.93899 5.393855 -11.62575      9.989271 
1 1 1 -25 18 8  o 22.95082 6.408243 7.385370       3.720587 5.517477       5.936944 8.593376       4.774430 21.15557 8.151913 24.41608 7.391807 -3.260517      11.00420 
1 1 1 -25 18 9  o 15.58606 6.209846 2.174627       3.543581 2.334514       5.719143 2.074997       4.514589 18.19202 7.636269 16.66186 6.871414 1.530165       10.27273 
1 1 1 -25 18 10 o 22.01827 7.162250 6.783422       4.403881 -1.898681      11.03437 8.428372       4.802986 20.60037 9.492244 24.19838 7.431411 -3.598005      12.05523 
1 1 1 -25 18 11 f 33.66968 4.434782 14.76873       3.550324 16.93435       6.473389 13.83709       4.245864 33.87957 7.974192 31.95198 5.660110 1.927588       9.778783 
1 1 1 -25 18 12 o 39.42757 4.097136 20.00766       3.879220 11.29173       6.718904 24.36582       4.751091 27.23137 8.845865 43.27473 4.574450 -16.04336      9.958660 
1 1 1 -25 18 13 o 43.39021 3.791923 24.02779       3.969226 27.37363       7.099292 22.50628       4.787396 44.28767 6.794607 41.40990 4.835043 2.877769       8.339324 
1 1 1 -25 18 14 o 19.83394 6.736889 5.303751       3.886894 -3.245753      5.676023 12.85318       5.333728 14.44065 6.707650 29.70234 7.397110 -15.26169      9.985479 
1 1 1 -25 18 15 o 41.05646 3.978066 21.66917       3.930247 11.13572       6.769306 27.02554       4.827185 26.88352 8.887416 45.63561 4.394932 -18.75209      9.914716 
1 1 1 -25 18 16 o 42.53440 3.837466 23.18872       3.934866 12.39904       6.555649 29.26505       4.919622 28.26869 8.682194 47.53463 4.293264 -19.26594      9.685691 
1 1 1 -25 18 17 o 22.25300 6.066131 6.960689       3.379052 10.13636       6.086163 5.545584       4.062750 25.76925 8.422353 20.10621 6.886362 5.663036       10.87925 
1 1 1 -25 18 18 o 38.38245 4.562920 19.36905       4.184441 18.27429       6.973008 19.98514       5.230999 34.44665 8.386592 38.17694 5.805376 -3.730289      10.19987 
1 1 1 -25 18 19 o 18.32018 6.314373 4.494342       3.417457 -1.037647      6.653543 6.476758       3.982994 16.63884 7.553779 21.28392 6.801515 -4.645075      10.16465 
1 1 1 -25 18 20 o 26.82375 7.528854 10.89252       5.121364 0.000000       0.000000 10.89252       5.121364 ?        ?        26.82375 7.528854 0.000000       7.528854 
1 1 1 -25 18 21 o 23.83439 7.115900 8.479967       4.447371 -3.619698      10.44878 11.15700       4.914795 18.72434 8.826151 27.21808 7.271681 -8.493732      11.43583 
1 1 1 -25 18 22 o 13.94861 5.777718 1.365557       3.210871 6.351545       5.812733 -0.8238802     3.851865 21.20574 8.092634 12.94481 5.824063 8.260928       9.970479 
1 1 1 -25 18 23 o 19.30013 6.312572 5.289358       3.418636 9.638951       6.299232 3.473420       4.070181 24.49002 8.565322 17.20944 6.716891 7.280575       10.88491 
1 1 1 -25 18 24 o 16.64488 6.602682 3.075659       3.989195 5.634652       6.316319 1.377609       5.145228 20.54424 8.254898 16.23802 7.038761 4.306229       10.84839 
1 1 1 -25 18 25 o 15.25461 6.023622 2.476711       3.306171 -1.812826      5.916177 4.424663       3.986805 15.01555 6.930197 18.16361 6.751358 -3.148067      9.675147 
1 1 1 -25 19 1  o 17.25085 6.902003 3.106780       4.395985 0.000000       0.000000 3.106780       4.395985 ?        ?        17.25085 6.902003 0.000000       6.902003 
1 1 1 -25 19 2  o 13.97221 5.894899 0.9896562      3.435738 -2.343715      5.113296 3.733309       4.638992 13.96808 6.445345 18.15465 7.145542 -4.186570      9.622954 
1 1 1 -25 19 3  o 19.01405 6.622831 4.871498       3.763856 3.438725       5.634995 6.025648       5.057503 18.73014 7.695648 20.92729 7.633885 -2.197155      10.83970 
1 1 1 -25 19 4  o 32.52636 6.500339 14.97955       4.972070 15.13365       6.573987 14.77359       7.600274 31.24052 8.438130 30.12409 9.365047 1.116430       12.60580 
1 1 1 -25 19 5  o 41.77052 4.497628 22.81163       4.506082 16.94449       7.235086 26.52962       5.759502 32.83419 8.845210 44.41522 5.434360 -11.58103      10.38123 
1 1 1 -25 19 6  o 17.74726 6.457470 3.932488       3.615577 -3.536381      5.670952 9.047721       4.693116 14.21511 6.636881 24.86379 7.280969 -10.64868      9.851939 
1 1 1 -25 19 7  o 25.80076 6.232576 9.373286       3.874316 6.052227       5.830321 11.99942       5.184572 21.43751 8.122805 28.57697 7.390291 -7.139462      10.98164 
1 1 1 -25 19 8  o 23.59612 6.013893 7.788589       3.467715 1.101589       5.742342 11.62695       4.350569 17.15054 7.435143 28.73170 6.379882 -11.58116      9.797155 
1 1 1 -25 19 9  o 17.91008 6.125893 4.202162       3.214736 7.109962       5.736796 2.871087       3.881400 22.51650 8.142423 16.69408 6.546489 5.822424       10.44775 
1 1 1 -25 19 10 o 24.67548 6.391576 8.623530       3.873794 16.91195       11.76435 7.615550       4.102590 30.75154 11.56341 23.07601 6.820923 7.675529       13.42525 
1 1 1 -25 19 11 o 32.15125 4.730514 13.67049       3.595623 15.43355       6.407025 12.85994       4.344218 31.90825 8.196855 30.42954 6.071331 1.478703       10.20047 
1 1 1 -25 19 12 o 30.58669 4.955766 12.49246       3.567562 3.475091       5.658990 18.44005       4.595887 18.91597 7.735200 37.11029 5.226648 -18.19432      9.335480 
1 1 1 -25 19 13 o 19.88238 6.219120 5.475523       3.346224 1.601266       5.514717 7.733194       4.209779 17.23055 7.375824 23.16999 6.924563 -5.939447      10.11693 
1 1 1 -25 19 14 o 27.45020 6.418696 10.70425       4.216507 7.060560       5.946157 14.38962       5.980071 22.40881 8.260427 30.89238 7.910218 -8.483568      11.43705 
1 1 1 -25 19 15 f 10.03930 4.771900 -3.396828      3.177657 -12.00837      5.538340 0.8292759      3.879799 10.79196 5.368702 14.51492 6.199307 -3.722963      8.200877 
1 1 1 -25 19 16 o 47.09251 3.686685 28.38270       4.197114 17.78461       6.896313 34.61759       5.289534 33.89718 8.393380 51.64591 4.240170 -17.74873      9.403609 
1 1 1 -25 19 17 o 21.12100 6.421428 6.352878       3.597906 2.984857       6.709778 7.712104       4.262521 19.18511 8.171962 22.97256 6.990423 -3.787455      10.75393 
1 1 1 -25 19 18 o 33.36999 5.797593 15.45416       4.543554 22.38820       8.071184 12.23742       5.497336 37.34389 8.979852 28.28373 7.748432 9.060162       11.86069 
1 1 1 -25 19 19 o 44.33119 4.363633 25.80158       4.653004 18.10637       7.034419 31.78754       6.204185 33.72343 8.549465 48.40755 5.348476 -14.68412      10.08462 
1 1 1 -25 19 20 o 31.10227 6.758401 14.16180       4.975695 35.55870       12.22682 9.915005       5.447141 43.58152 11.38852 25.20371 7.942044 18.37781       13.88432 
1 1 1 -25 19 21 o 29.64006 5.343790 12.13553       3.717833 14.53561       6.872631 11.14260       4.420482 29.59356 8.848349 27.50041 6.666337 2.093145       11.07851 
1 1 1 -25 19 22 o 32.08889 4.814846 13.91667       3.649015 16.26044       6.347395 12.75971       4.459618 31.99960 8.126029 29.65699 6.361430 2.342604       10.31989 
1 1 1 -25 19 23 o 15.90730 6.402078 2.580792       3.805700 -6.004375      10.11499 3.996509       4.107516 17.34613 8.318065 17.74964 6.795634 -0.4035053     10.74108 
1 1 1 -25 19 24 o 14.12670 5.941541 1.297168       3.473017 1.268876       6.032496 1.311195       4.247567 16.95066 7.477051 15.11738 6.472268 1.833281       9.889214 
1 1 1 -25 20 1  o 15.55396 6.480051 1.864213       4.072203 0.000000       0.000000 1.864213       4.072203 ?        ?        15.55396 6.480051 0.000000       6.480051 
1 1 1 -25 20 2  o 16.10342 6.224747 2.917368       3.469588 -1.215570      5.422270 5.782801       4.514887 14.94035 6.796956 20.24868 7.235678 -5.308335      9.927419 
1 1 1 -25 20 3  o 33.95713 4.975930 15.53430       3.995431 18.64214       6.921511 13.98121       4.892951 34.49714 8.328705 31.05349 6.665249 3.443651       10.66737 
1 1 1 -25 20 4  o 66.14912 3.903606 56.34184       6.264569 59.35341       10.10987 54.46477       7.981571 64.97852 6.470600 63.75525 5.181958 1.223263       8.289834 
1 1 1 -25 20 5  o 13.85817 5.825208 1.036452       3.335297 2.912204       5.704211 0.6202241E-01  4.111337 18.26973 7.644714 14.12595 6.203950 4.143776       9.845336 
1 1 1 -25 20 6  o 36.45442 4.685845 17.61108       4.066532 19.62710       7.202855 16.66784       4.926839 35.54120 8.442361 34.55310 6.072738 0.9880981      10.39960 
1 1 1 -25 20 7  o 13.53705 5.715673 0.8564873      3.234006 2.262240       5.746022 0.2047231      3.912533 17.84808 7.580922 13.97589 6.097064 3.872193       9.728544 
1 1 1 -25 20 8  o 41.51839 4.037514 22.31144       4.033456 21.51327       6.660469 22.77366       5.068535 38.30344 7.403506 41.21519 5.159197 -2.911755      9.023814 
1 1 1 -25 20 9  o 36.26288 4.856087 17.49762       4.183492 18.06754       6.544461 17.10382       5.440129 34.58261 7.934461 34.60922 6.692411 -0.2660370E-01 10.37998 
1 1 1 -25 20 10 o 16.58245 6.425785 3.017736       3.704135 -1.839792      10.09509 3.773470       3.981867 19.41241 8.992266 17.72773 6.713786 1.684683       11.22211 
1 1 1 -25 20 11 o 31.51379 4.870340 13.28018       3.619744 16.07150       6.058706 11.73081       4.513903 32.71103 7.724885 28.55969 6.615802 4.151342       10.17068 
1 1 1 -25 20 12 o 16.80364 6.164840 3.473524       3.305451 3.206408       5.671617 3.610922       4.067690 18.53688 7.678626 17.58618 6.755119 0.9507027      10.22707 
1 1 1 -25 20 13 o 18.82201 6.169435 4.869361       3.264577 4.775902       5.558291 4.918580       4.033608 19.82826 7.816260 19.15339 6.839734 0.6748676      10.38633 
1 1 1 -25 20 14 o 17.36367 6.550104 3.641441       3.781477 1.762215       5.509910 5.314723       5.199235 17.18743 7.365311 20.13700 7.661127 -2.949568      10.62735 
1 1 1 -25 20 15 o 43.79588 4.739495 25.43393       4.977761 13.14202       8.247913 32.47602       6.242884 27.83276 9.795904 49.05297 5.306976 -21.22021      11.14108 
1 1 1 -25 20 16 o 37.50991 5.258963 19.10120       4.675209 15.29119       8.587857 20.70597       5.573505 29.54450 10.01407 38.37789 6.168499 -8.833387      11.76146 
1 1 1 -25 20 17 o 28.71767 6.014960 11.69368       4.074301 5.396550       6.201626 16.47550       5.404198 20.53341 8.203733 33.58779 6.835357 -13.05438      10.67817 
1 1 1 -25 20 18 o 41.48278 4.139149 22.50505       4.128428 9.336453       6.422396 31.77837       5.389457 24.26298 8.634246 49.00382 4.565676 -24.74084      9.767067 
1 1 1 -25 20 19 o 35.87475 4.600335 17.17159       3.929302 17.44883       6.673653 17.02449       4.861225 33.12087 8.289024 34.75887 5.953108 -1.637993      10.20526 
1 1 1 -25 20 20 o 25.73786 5.823181 9.434051       3.566677 9.075223       6.275932 9.605230       4.334729 23.85642 8.530216 25.32167 6.857264 -1.465242      10.94471 
1 1 1 -25 20 21 o 10.50024 4.924964 -2.496398      3.182954 -3.439651      5.582201 -2.041981      3.874526 13.81274 6.492363 12.06413 5.582251 1.748609       8.562261 
1 1 1 -25 20 22 o 36.74994 4.541105 18.07689       3.980386 11.16585       6.639443 21.95436       4.973181 25.72894 8.803554 39.98779 5.228657 -14.25886      10.23921 
1 1 1 -25 20 23 o 69.37427 3.765773 62.36132       6.342454 46.18397       9.003911 78.29430       8.935646 56.20245 6.706323 76.31879 4.829381 -20.11634      8.264241 
1 1 1 -25 21 1  o 13.77573 5.738595 1.321395       3.193126 5.396321       5.248048 -1.073870      4.023599 19.79303 7.654380 12.93477 5.872961 6.858265       9.647861 
1 1 1 -25 21 2  o 16.45492 6.246650 3.297622       3.451970 -0.4817570     5.250473 6.175035       4.581306 15.05093 6.783212 20.55083 7.294528 -5.499892      9.961029 
1 1 1 -25 21 3  o 16.58701 6.144357 3.457712       3.296950 2.038589       5.491651 4.257454       4.122567 17.13023 7.347185 18.13470 6.839538 -1.004471      10.03795 
1 1 1 -25 21 4  o 12.21501 5.401261 -0.2789469     3.166305 2.621581       5.815847 -1.500834      3.774766 17.91644 7.619033 12.30864 5.627034 5.607795       9.471704 
1 1 1 -25 21 5  o 33.21813 4.932510 14.90198       3.871765 11.76576       6.564701 16.57479       4.794399 26.82343 8.745925 34.35011 5.942568 -7.526680      10.57380 
1 1 1 -25 21 6  o 17.69313 6.342266 4.123360       3.471631 3.673346       5.826750 4.371029       4.322648 18.84126 7.791796 18.49184 6.996996 0.3494167      10.47235 
1 1 1 -25 21 7  o 35.91815 4.813014 17.27156       4.106832 15.13590       7.251377 18.28006       4.983031 30.18921 9.103168 36.23993 5.840999 -6.050728      10.81596 
1 1 1 -25 21 8  o 35.08571 4.569528 16.34008       3.814211 12.72686       6.268047 18.46480       4.806570 28.22284 8.452937 36.65058 5.555641 -8.427744      10.11520 
1 1 1 -25 21 9  o 15.80525 6.052409 2.820291       3.258617 1.593368       5.425438 3.512661       4.075635 16.88623 7.273425 17.37351 6.738122 -0.4872761     9.914887 
1 1 1 -25 21 10 o 17.57493 6.685532 3.762173       3.959054 18.97966       11.15848 1.570645       4.234549 31.27266 11.34930 15.54203 6.550109 15.73063       13.10383 
1 1 1 -25 21 11 o 15.34660 6.047644 2.405128       3.326526 2.018678       5.610349 2.614648       4.131014 17.38250 7.440156 16.43940 6.650900 0.9431000      9.979499 
1 1 1 -25 21 12 o 36.86868 4.647175 18.08456       4.082687 10.28340       7.656106 21.18443       4.826146 25.17044 9.355824 39.59835 5.121161 -14.42790      10.66573 
1 1 1 -25 21 13 o 36.59805 4.781444 17.92323       4.162477 11.11182       7.854535 20.58320       4.908398 25.83738 9.499109 38.85662 5.323497 -13.01924      10.88911 
1 1 1 -25 21 14 o 38.27152 9.107034 24.00427       8.369920 24.00427       8.369920 0.000000       0.000000 38.27152 9.107034 ?        ?        0.000000       9.107034 
1 1 1 -25 21 15 o 29.60588 6.004675 12.44345       4.183789 15.81257       6.429881 9.969657       5.509678 31.54199 8.266659 25.19914 7.993498 6.342852       11.49929 
1 1 1 -25 21 16 o 56.95388 3.410928 41.43579       4.712350 24.35627       7.413477 53.01540       6.104236 39.78613 7.924857 63.96658 3.935040 -24.18045      8.848045 
1 1 1 -25 21 17 o 23.92343 6.306601 8.351931       3.728152 7.539609       6.408491 8.767488       4.583607 22.36641 8.506415 24.00217 7.237439 -1.635756      11.16869 
1 1 1 -25 21 18 o 42.35198 4.157182 23.54574       4.235287 18.53309       7.068088 26.35382       5.290207 33.74503 8.578023 44.13989 5.006514 -10.39486      9.932153 
1 1 1 -25 21 19 o 16.16142 6.478724 2.740312       3.881114 1.038715       10.46377 3.011750       4.179223 20.10837 9.257586 16.72398 6.716500 3.384390       11.43741 
1 1 1 -25 21 20 o 9.573187 4.629490 -4.464509      3.292772 -4.976684      5.868126 -4.229131      3.978081 13.44958 6.418561 10.96922 5.248430 2.480361       8.291197 
1 1 1 -25 21 21 o 9.135417 4.445461 -4.804258      3.162748 -5.473702      5.763458 -4.515799      3.783278 13.08429 6.275554 10.46927 5.037631 2.615022       8.047379 
1 1 1 -25 22 1  f 19.97250 6.315874 5.874077       3.442049 14.17894       5.580434 0.7742571      4.372996 29.87083 7.637478 14.73285 6.436216 15.13798       9.987790 
1 1 1 -25 22 2  o 18.83512 7.005516 4.937678       4.293951 0.000000       0.000000 4.937678       4.293951 ?        ?        18.83512 7.005516 0.000000       7.005516 
1 1 1 -25 22 3  o 15.46816 6.115706 2.583338       3.411973 -3.471035      5.607723 6.142155       4.299369 13.76796 6.482471 20.37765 7.079475 -6.609687      9.599031 
1 1 1 -25 22 4  o 16.17299 6.248411 3.077528       3.494695 7.598291       6.184514 0.9568849      4.235781 22.19213 8.375521 14.81068 6.403276 7.381459       10.54283 
1 1 1 -25 22 5  o 14.52901 6.335995 0.6127648      4.221795 -3.488770      5.602503 6.002128       6.422108 13.80323 6.492975 20.85066 8.342292 -7.047438      10.57131 
1 1 1 -25 22 6  o 24.31126 6.135248 8.588510       3.634288 9.042994       6.430343 8.375197       4.405364 23.72247 8.614647 23.47708 7.098842 0.2453880      11.16269 
1 1 1 -25 22 7  o 43.81375 4.234348 25.25763       4.464713 27.18607       8.260907 24.46190       5.306493 41.28819 8.494008 42.29361 5.262177 -1.005424      9.991930 
1 1 1 -25 22 8  o 19.89410 6.515850 5.701976       3.641787 5.947130       6.609012 5.595081       4.364123 20.97886 8.438960 19.84429 7.111216 1.134573       11.03564 
1 1 1 -25 22 9  o 16.27504 6.269085 3.088155       3.510296 7.249234       6.745518 1.542833       4.110758 22.14964 8.646494 15.25330 6.442367 6.896340       10.78267 
1 1 1 -25 22 10 o 14.60472 6.525104 -0.2614924     4.743479 0.000000       0.000000 -0.2614924     4.743479 ?        ?        14.60472 6.525104 0.000000       6.525104 
1 1 1 -25 22 11 o 13.71432 5.993785 0.2894537      3.795932 -8.634319      6.276808 5.435017       4.766296 12.68190 6.191378 19.79487 7.377223 -7.112974      9.631021 
1 1 1 -25 22 12 o 24.77852 6.374690 8.987014       3.871176 4.807216       5.672720 12.63011       5.296011 19.57424 7.837464 28.61738 7.503553 -9.043140      10.85031 
1 1 1 -25 22 13 o 15.72605 6.274886 2.543753       3.623498 4.455898       5.604874 1.170707       4.749500 19.20503 7.755187 15.67231 6.778137 3.532714       10.29981 
1 1 1 -25 22 14 o 37.04584 5.365190 18.89850       4.702679 17.45454       6.663641 20.33121       6.637620 32.99339 8.297307 36.31896 7.736750 -3.325569      11.34472 
1 1 1 -25 22 15 o 25.49117 5.941133 9.332211       3.622052 2.475456       6.197936 12.88845       4.463579 18.01443 7.766812 29.78771 6.343625 -11.77328      10.02821 
1 1 1 -25 22 16 o 33.38899 5.344772 15.41994       4.202167 15.01248       6.593840 15.69860       5.452921 30.13272 8.572441 32.25939 7.126734 -2.126677      11.14796 
1 1 1 -25 22 17 o 52.50497 3.618524 35.57497       4.601546 20.38330       7.569543 44.47969       5.795314 34.93190 8.875681 58.27516 4.107222 -23.34327      9.779927 
1 1 1 -25 22 18 o 39.28076 4.470168 20.58939       4.202938 14.04509       7.312463 23.81785       5.136059 28.29576 9.230911 41.69762 5.164881 -13.40187      10.57761 
1 1 1 -25 22 19 o 34.42155 5.490684 16.55152       4.451042 2.607158       11.36690 19.07690       4.837330 20.99511 9.659647 36.94852 5.543287 -15.95341      11.13718 
1 1 1 -25 23 1  o 28.17786 5.645911 11.40598       3.741642 8.326550       5.998618 13.36707       4.787014 22.46224 8.293850 29.59377 6.783224 -7.131529      10.71448 
1 1 1 -25 23 2  o 38.78120 5.662230 21.31032       5.193356 0.000000       0.000000 21.31032       5.193356 ?        ?        38.78120 5.662230 0.000000       5.662230 
1 1 1 -25 23 3  o 22.79608 6.428214 7.800945       3.724391 4.680050       5.986192 9.771961       4.757251 19.26106 7.924727 24.87504 7.343015 -5.613985      10.80376 
1 1 1 -25 23 4  o 23.76593 6.160256 8.330060       3.596794 3.383136       5.757294 11.49679       4.606342 18.13135 7.639246 27.45405 6.895399 -9.322704      10.29100 
1 1 1 -25 23 5  o 24.50031 7.924566 9.706195       5.395617 3.369938       6.360644 25.96565       10.18914 18.57340 7.935271 36.58564 10.73224 -18.01224      13.34727 
1 1 1 -25 23 6  o 32.16669 5.964272 14.82301       4.503090 21.65509       7.308339 10.64182       5.717319 36.50082 8.392002 25.49430 8.149063 11.00653       11.69756 
1 1 1 -25 23 7  o 22.91934 6.826255 7.951090       4.096518 6.330780       6.656146 8.939039       5.197460 21.08692 8.473670 23.72984 7.784796 -2.642912      11.50679 
1 1 1 -25 23 8  o 17.00400 6.683759 3.415091       4.054065 3.146820       6.717199 3.568799       5.084510 18.74837 8.084449 17.92621 7.331456 0.8221588      10.91369 
1 1 1 -25 23 9  o 18.31671 6.577095 4.632586       3.735237 2.219575       6.934769 5.618740       4.433275 18.31837 8.050881 19.77400 7.156846 -1.455631      10.77205 
1 1 1 -25 23 10 o 16.72538 6.506699 3.323477       3.809510 16.56301       11.15479 1.575459       4.053200 28.44187 11.11425 15.13740 6.395446 13.30446       12.82296 
1 1 1 -25 23 11 o 13.59574 5.795343 0.8923669      3.378832 2.173645       5.812576 0.2384544      4.152472 17.39769 7.511312 14.11070 6.214725 3.286989       9.748981 
1 1 1 -25 23 12 o 17.63989 6.572364 4.094440       3.782531 9.941946       5.901098 0.1636227E-01  4.928051 24.68312 8.301160 14.94031 6.664572 9.742815       10.64546 
1 1 1 -25 23 13 o 12.04453 5.376339 -0.4836803     3.212532 0.7577562      5.441540 -1.147862      3.980185 16.02266 7.083041 12.80609 5.824979 3.216565       9.170597 
1 1 1 -25 23 14 f 15.04744 6.048591 2.241779       3.392580 4.164323       5.768095 1.224941       4.194884 18.88173 7.774919 14.96689 6.420398 3.914839       10.08320 
1 1 1 -25 23 15 o 14.20160 6.087234 0.9894717      3.765229 -3.657320      5.901728 4.179125       4.889611 14.04411 6.624071 18.34719 7.299579 -4.303076      9.857087 
1 1 1 -25 23 16 o 18.19550 6.259584 4.656916       3.357883 -1.195909      5.619372 7.907481       4.187785 14.96088 6.849352 22.78284 6.928095 -7.821968      9.742286 
1 1 1 -25 24 2  o 10.23968 4.952717 -4.765057      3.772984 0.000000       0.000000 -4.765057      3.772984 ?        ?        10.23968 4.952717 0.000000       4.952717 
1 1 1 -25 24 3  o 15.66175 6.140083 2.872816       3.413697 3.572106       5.398315 2.406849       4.406637 17.85486 7.451502 16.06314 6.720140 1.791716       10.03420 
1 1 1 -25 24 4  o 14.22021 5.900948 1.650879       3.357805 -0.2423465     5.376332 2.861641       4.299463 15.09925 6.828962 16.43195 6.733501 -1.332704      9.590347 
1 1 1 -25 24 5  f 28.84582 7.964125 13.66534       5.782115 12.61053       6.874377 16.21632       10.69054 26.64037 8.959610 27.60333 10.85255 -0.9629650     14.07311 
1 1 1 -25 24 6  f 11.04466 5.133258 -1.993375      3.331831 -5.878036      5.327090 0.5026921      4.270135 12.24161 5.912203 14.35491 6.312950 -2.113294      8.649132 
1 1 1 -25 24 7  o 11.16577 5.161593 -1.747919      3.300859 -5.878219      5.641909 0.4016579      4.070163 12.68146 6.114631 14.02895 6.166695 -1.347485      8.684286 
1 1 1 -25 24 8  o 24.80656 6.326129 9.157421       3.835566 1.074726       6.471604 13.53389       4.762070 17.07349 7.625291 30.02551 6.680608 -12.95202      10.13783 
1 1 1 -25 24 9  o 31.51576 5.390578 13.91831       3.991297 15.27099       7.514753 13.38678       4.710654 29.11608 9.346287 29.91120 6.636257 -0.7951221     11.46268 
1 1 1 -25 24 10 o 21.05863 7.281901 6.755938       4.546377 0.000000       0.000000 6.755938       4.546377 ?        ?        21.05863 7.281901 0.000000       7.281901 
1 1 1 -25 24 11 o 17.43902 6.506740 4.035781       3.709952 6.381209       5.636330 2.242788       4.928044 20.74059 7.955503 16.54601 7.023961 4.194576       10.61254 
1 1 1 -25 24 12 o 12.41518 5.492072 -0.1405153     3.276988 0.2919692      5.731953 -0.3505065     3.994091 15.93288 7.141635 13.36215 5.977485 2.570734       9.313070 
1 1 1 -25 24 13 o 15.08962 6.098063 2.244873       3.468486 10.17329       6.321308 -1.170345      4.148803 24.59380 8.581772 13.00451 5.927567 11.58928       10.42990 
1 1 1 -24 0  1  o 76.49689 3.906213 72.26328       7.238188 72.26328       7.238188 72.26328       7.238188 76.49689 3.906213 76.49689 3.906213 0.000000       0.000000 
1 1 1 -24 0  2  o 131.5275 3.599468 212.2372       11.51741 212.2372       11.51741 212.2372       11.51741 131.5275 3.599468 131.5275 3.599468 -0.000000      0.000000 
1 1 1 -24 0  3  o 133.4171 3.629336 218.3488       11.78006 218.3488       11.78006 218.3488       11.78006 133.4171 3.629336 133.4171 3.629336 0.000000       0.000000 
1 1 1 -24 0  4  o 9.677636 6.179527 0.2753786      3.242374 0.2753786      3.242374 0.2753786      3.242374 9.677636 6.179527 9.677636 6.179527 -0.000000      0.000000 
1 1 1 -24 0  5  o 47.15776 4.013787 27.81830       4.532706 27.81830       4.532706 27.81830       4.532706 47.15776 4.013787 47.15776 4.013787 -0.000000      0.000000 
1 1 1 -24 0  6  o 75.68738 3.437480 70.49238       6.310283 70.49238       6.310283 70.49238       6.310283 75.68738 3.437480 75.68738 3.437480 0.000000       0.000000 
1 1 1 -24 0  7  o 13.26591 7.093700 3.126237       3.132356 3.126237       3.132356 3.126237       3.132356 13.26591 7.093700 13.26591 7.093700 0.000000       0.000000 
1 1 1 -24 0  8  o 16.66640 7.970610 5.058462       3.716200 5.058462       3.716200 5.058462       3.716200 16.66640 7.970610 16.66640 7.970610 0.000000       0.000000 
1 1 1 -24 0  9  o 183.7657 6.677376 418.8424       29.81273 418.8424       29.81273 418.8424       29.81273 183.7657 6.677376 183.7657 6.677376 0.000000       0.000000 
1 1 1 -24 0  10 o 194.5674 5.126164 466.0524       24.26704 466.0524       24.26704 466.0524       24.26704 194.5674 5.126164 194.5674 5.126164 -0.000000      0.000000 
1 1 1 -24 0  11 o 25.54100 8.599277 10.39861       4.781310 10.39861       4.781310 10.39861       4.781310 25.54100 8.599277 25.54100 8.599277 -0.000000      0.000000 
1 1 1 -24 0  12 o 55.24757 4.752624 38.27718       6.285212 38.27718       6.285212 38.27718       6.285212 55.24757 4.752624 55.24757 4.752624 -0.000000      0.000000 
1 1 1 -24 0  13 f 18.31302 8.974000 6.169172       4.748638 6.169172       4.748638 6.169172       4.748638 18.31302 8.974000 18.31302 8.974000 -0.000000      0.000000 
1 1 1 -24 0  14 o 143.8626 4.458095 254.6663       15.59507 254.6663       15.59507 254.6663       15.59507 143.8626 4.458095 143.8626 4.458095 -0.000000      0.000000 
1 1 1 -24 0  15 o 49.57387 5.089991 31.15208       5.987833 31.15208       5.987833 31.15208       5.987833 49.57387 5.089991 49.57387 5.089991 -0.000000      0.000000 
1 1 1 -24 0  16 o 7.660826 5.442454 -5.801535      4.337096 -5.801535      4.337096 -5.801535      4.337096 7.660826 5.442454 7.660826 5.442454 0.000000       0.000000 
1 1 1 -24 0  17 o 183.2773 7.333588 420.2284       32.63438 420.2284       32.63438 420.2284       32.63438 183.2773 7.333588 183.2773 7.333588 -0.000000      0.000000 
1 1 1 -24 0  18 o 9.762077 7.004068 -12.56423      7.907830 -12.56423      7.907830 -12.56423      7.907830 9.762077 7.004068 9.762077 7.004068 0.000000       0.000000 
1 1 1 -24 0  19 o 80.38712 4.337575 80.10736       8.440183 80.10736       8.440183 80.10736       8.440183 80.38712 4.337575 80.38712 4.337575 0.000000       0.000000 
1 1 1 -24 0  20 o 86.07871 4.308241 91.79393       8.985261 91.79393       8.985261 91.79393       8.985261 86.07871 4.308241 86.07871 4.308241 -0.000000      0.000000 
1 1 1 -24 0  21 o 14.76648 8.435483 3.644814       4.774845 3.644814       4.774845 3.644814       4.774845 14.76648 8.435483 14.76648 8.435483 -0.000000      0.000000 
1 1 1 -24 0  22 o 17.01918 8.834137 5.411868       4.745551 5.411868       4.745551 5.411868       4.745551 17.01918 8.834137 17.01918 8.834137 0.000000       0.000000 
1 1 1 -24 0  23 o 86.58423 5.794757 94.53230       12.09912 94.53230       12.09912 94.53230       12.09912 86.58423 5.794757 86.58423 5.794757 0.000000       0.000000 
1 1 1 -24 0  24 o 72.72282 4.426738 66.04668       7.777682 66.04668       7.777682 66.04668       7.777682 72.72282 4.426738 72.72282 4.426738 0.000000       0.000000 
1 1 1 -24 0  25 o 23.36208 9.493686 9.723903       5.297933 9.723903       5.297933 9.723903       5.297933 23.36208 9.493686 23.36208 9.493686 0.000000       0.000000 
1 1 1 -24 0  26 o 18.92231 9.475068 6.931095       5.344186 6.931095       5.344186 6.931095       5.344186 18.92231 9.475068 18.92231 9.475068 -0.000000      0.000000 
1 1 1 -24 0  27 o 47.21517 6.176153 29.45054       6.769745 29.45054       6.769745 29.45054       6.769745 47.21517 6.176153 47.21517 6.176153 -0.000000      0.000000 
1 1 1 -24 0  28 o 36.21635 7.635704 18.74454       5.931117 18.74454       5.931117 18.74454       5.931117 36.21635 7.635704 36.21635 7.635704 -0.000000      0.000000 
1 1 1 -24 0  29 o 25.92227 9.810542 11.89611       5.812182 11.89611       5.812182 11.89611       5.812182 25.92227 9.810542 25.92227 9.810542 -0.000000      0.000000 
1 1 1 -24 0  30 o 11.13542 7.711110 -4.678373      7.188662 -4.678373      7.188662 -4.678373      7.188662 11.13542 7.711110 11.13542 7.711110 0.000000       0.000000 
1 1 1 -24 0  31 o 8.567326 6.032921 -5.040468      4.949510 -5.040468      4.949510 -5.040468      4.949510 8.567326 6.032921 8.567326 6.032921 0.000000       0.000000 
1 1 1 -24 0  32 o 8.322807 5.901374 -5.828177      5.013609 -5.828177      5.013609 -5.828177      5.013609 8.322807 5.901374 8.322807 5.901374 0.000000       0.000000 
1 1 1 -24 0  33 o 13.70120 8.224697 3.148258       4.933965 3.148258       4.933965 3.148258       4.933965 13.70120 8.224697 13.70120 8.224697 0.000000       0.000000 
1 1 1 -24 0  34 o 14.21745 9.046681 2.469772       6.876642 2.469772       6.876642 2.469772       6.876642 14.21745 9.046681 14.21745 9.046681 0.000000       0.000000 
1 1 1 -24 0  35 o 26.52979 9.732551 12.88185       5.809650 12.88185       5.809650 12.88185       5.809650 26.52979 9.732551 26.52979 9.732551 0.000000       0.000000 
1 1 1 -24 0  36 o 18.15399 9.517585 7.220648       5.548170 7.220648       5.548170 7.220648       5.548170 18.15399 9.517585 18.15399 9.517585 0.000000       0.000000 
1 1 1 -24 0  37 o 14.73324 8.866968 4.186206       5.764079 4.186206       5.764079 4.186206       5.764079 14.73324 8.866968 14.73324 8.866968 0.000000       0.000000 
1 1 1 -24 1  1  o 27.94761 4.796521 9.941638       3.149087 6.133505       5.415916 11.88671       3.870646 22.86533 7.945630 30.47129 5.410824 -7.605961      9.613014 
1 1 1 -24 1  2  o 66.78313 2.648813 54.70239       4.302213 55.31498       5.838030 53.97435       6.364499 66.97343 3.590194 66.06596 3.971551 0.9074631      5.353756 
1 1 1 -24 1  3  o 74.05864 2.469328 67.18388       4.450234 70.18752       6.350215 64.28503       6.238438 75.50737 3.460342 72.23513 3.554899 3.272240       4.960976 
1 1 1 -24 1  4  o 65.87121 2.515044 53.16907       4.029757 51.56441       5.643437 54.83844       5.756105 64.67685 3.594766 66.71316 3.553453 -2.036308      5.054639 
1 1 1 -24 1  5  o 91.82111 2.426267 103.1957       5.424210 104.8322       7.655770 101.5462       7.686304 92.34447 3.407905 90.86701 3.477583 1.477463       4.869025 
1 1 1 -24 1  6  o 75.13230 2.540605 69.14292       4.644883 70.37514       6.951989 68.14928       6.242803 75.55877 3.787697 74.42455 3.451530 1.134216       5.124423 
1 1 1 -24 1  7  o 36.49942 3.283570 16.47246       2.889389 14.63469       4.204341 18.11727       3.977513 33.98613 5.245051 38.09134 4.363663 -4.105206      6.822912 
1 1 1 -24 1  8  o 75.63665 3.049680 70.22749       5.609592 62.05224       8.022732 78.04758       7.846527 70.72708 4.681133 79.52026 4.062612 -8.793175      6.198211 
1 1 1 -24 1  9  o 157.5860 3.682000 305.1755       14.13961 312.3734       18.07589 293.8274       22.69666 158.9566 4.671502 153.3924 6.083931 5.564163       7.670538 
1 1 1 -24 1  10 o 238.7285 4.115777 701.8962       23.94375 696.0874       33.61273 707.8804       34.11604 236.4698 5.833000 238.4309 5.871646 -1.961090      8.276479 
1 1 1 -24 1  11 f 56.30980 3.296787 39.03622       4.504088 39.99453       6.354681 38.06878       6.384913 56.71770 4.638152 55.29047 4.785882 1.427235       6.664617 
1 1 1 -24 1  12 o 77.97307 2.988481 74.62506       5.667955 72.59727       7.993723 76.67530       8.037858 76.60505 4.299341 78.75945 4.203173 -2.154404      6.012569 
1 1 1 -24 1  13 o 107.5656 2.964261 141.9317       7.762676 147.5147       11.22642 136.8168       10.74553 109.2872 4.223321 105.2525 4.197891 4.034683       5.954723 
1 1 1 -24 1  14 o 15.25753 5.880348 1.964376       3.089654 8.890498       4.562876 -3.900203      4.198672 26.10898 7.020354 12.21065 5.704216 13.89832       9.045631 
1 1 1 -24 1  15 o 53.33931 3.376855 35.09541       4.366775 33.49126       6.126605 36.75186       6.225691 51.74498 4.917692 54.26954 4.755565 -2.524559      6.840986 
1 1 1 -24 1  16 f 129.3889 3.056608 205.4778       9.637686 197.9352       13.50041 213.3166       13.76288 126.4332 4.388423 131.2974 4.307300 -4.864189      6.149073 
1 1 1 -24 1  17 o 62.54298 3.953896 48.46013       5.995305 47.10611       7.053627 51.98427       11.37961 61.43609 4.748255 63.48425 7.500380 -2.048161      8.877028 
1 1 1 -24 1  18 o 64.18327 3.811013 51.00313       5.933879 54.38503       11.69432 49.83047       6.886235 64.84636 7.540866 63.24199 4.497629 1.604374       8.780281 
1 1 1 -24 1  19 o 74.13625 3.049825 67.66457       5.498109 66.87199       7.958357 68.38828       7.604696 73.26632 4.478815 74.18443 4.224074 -0.9181061     6.156507 
1 1 1 -24 1  20 o 32.34855 4.656229 13.27665       3.564907 7.896143       5.092872 18.44557       4.991728 24.66768 7.665722 37.95631 5.561699 -13.28864      9.470786 
1 1 1 -24 1  21 o 40.39448 4.034917 20.42477       3.918760 18.67151       5.656172 22.04323       5.434405 37.87185 6.353517 41.52663 5.505711 -3.654785      8.407142 
1 1 1 -24 1  22 o 87.00165 3.001927 93.32613       6.354957 93.03381       9.140948 93.59956       8.841084 86.30501 4.360422 86.64408 4.199775 -0.3390732     6.054039 
1 1 1 -24 1  23 o 47.20677 4.226065 27.99424       4.810196 31.07929       8.031492 26.26867       6.006654 48.57503 6.985604 45.22285 5.567946 3.352177       8.933123 
1 1 1 -24 1  24 o 45.19170 4.408592 25.80283       4.793401 21.70643       5.920580 33.59657       8.166500 40.72636 6.157633 50.48419 6.811759 -9.757832      9.182402 
1 1 1 -24 1  25 o 78.31231 3.098854 75.98166       5.902132 81.61530       8.694859 71.16756       8.037584 80.47059 4.451276 75.15292 4.408134 5.317673       6.264623 
1 1 1 -24 1  26 o 61.25663 3.496815 46.85563       5.198212 38.64766       7.445227 54.66241       7.260997 54.53022 5.686241 65.63139 4.568442 -11.10117      7.294107 
1 1 1 -24 1  27 o 39.58722 4.640646 20.13874       4.391933 15.49877       6.234097 24.71096       6.188416 33.14111 7.842193 43.17791 6.046974 -10.03679      9.902822 
1 1 1 -24 1  28 o 35.06688 5.071326 16.09296       4.207961 12.35868       5.987344 19.73781       5.915221 29.26492 8.113621 38.05660 6.618477 -8.791683      10.47068 
1 1 1 -24 1  29 o 14.84488 6.217929 1.072569       3.779471 -0.9383263E-01 5.582252 2.059784       5.135599 16.40964 7.217231 17.52989 7.288050 -1.120255      10.25690 
1 1 1 -24 1  30 o 19.62318 7.792449 4.039795       5.562033 4.413820       7.970903 3.684849       7.764946 21.73428 9.061331 21.08542 8.877139 0.6488533      12.68508 
1 1 1 -24 1  31 o 17.31227 6.525216 3.440724       3.751020 2.672218       5.266191 4.232153       5.344155 17.98756 7.420088 19.49398 7.670422 -1.506424      10.67207 
1 1 1 -24 1  32 o 19.93791 6.568403 5.489177       3.698611 8.732838       5.153443 2.043651       5.311383 24.28433 7.733986 17.35244 7.325665 6.931890       10.65270 
1 1 1 -24 1  33 o 12.61751 5.663501 -0.8405831     3.618637 -3.963865      4.948174 2.750136       5.305547 12.83738 6.058090 17.77951 7.401040 -4.942133      9.564301 
1 1 1 -24 1  34 o 41.53040 5.122760 23.35970       5.074728 18.26296       8.227342 26.48958       6.447291 32.42546 9.677942 43.20091 6.310375 -10.77544      11.55350 
1 1 1 -24 1  35 o 9.014221 4.447054 -6.728765      3.515690 -2.373996      5.018650 -10.92509      4.926505 13.59725 6.312939 10.03472 5.003486 3.562534       8.055313 
1 1 1 -24 1  36 o 24.90962 7.363206 9.751500       4.780777 6.756151       5.707530 16.79478       8.752094 21.13851 8.030481 29.63190 10.10837 -8.493391      12.90999 
1 1 1 -24 2  1  o 51.15842 2.750013 32.16499       3.415771 30.71004       4.650594 33.86927       5.033337 49.77469 3.864355 52.25977 3.982311 -2.485081      5.549057 
1 1 1 -24 2  2  o 138.9183 2.932435 236.6197       9.927135 232.0973       16.05438 239.4193       12.63144 136.7756 4.824244 139.4238 3.721072 -2.648178      6.092594 
1 1 1 -24 2  3  o 118.5518 2.838699 172.2161       8.200940 192.1736       13.85429 161.4510       10.17511 124.5958 4.570685 114.5198 3.650712 10.07599       5.849689 
1 1 1 -24 2  4  o 55.49929 2.702578 37.80414       3.644132 35.71209       5.093185 39.99846       5.216177 53.72113 3.917451 56.89754 3.783529 -3.176418      5.446238 
1 1 1 -24 2  5  o 98.06225 2.556823 117.7538       6.104751 123.0002       9.227883 113.6706       8.140789 99.92781 3.796384 96.14158 3.480458 3.786232       5.150352 
1 1 1 -24 2  6  o 37.39529 3.328976 17.29407       3.001960 15.56357       4.314528 18.91796       4.179515 35.07294 5.205784 38.90172 4.491168 -3.828777      6.875374 
1 1 1 -24 2  7  o 82.64974 2.640235 83.68855       5.310832 84.40010       6.885952 82.64389       8.343478 82.84852 3.418037 81.79099 4.200127 1.057526       5.415168 
1 1 1 -24 2  8  o 109.8607 2.997760 148.0110       8.018062 137.9461       11.34613 158.0516       11.33238 105.6574 4.416420 113.2100 4.114560 -7.552567      6.036088 
1 1 1 -24 2  9  f 152.1102 2.876178 283.4081       10.66130 282.6969       17.06075 283.8637       13.65603 151.2176 4.635246 151.9755 3.687353 -0.7578735     5.923012 
1 1 1 -24 2  10 o 99.54731 3.262636 121.6999       7.904005 125.8828       10.33978 115.8193       12.25977 100.9834 4.210944 96.51411 5.232177 4.469269       6.716228 
1 1 1 -24 2  11 o 164.5038 3.309884 332.0982       13.26859 331.2200       18.91226 332.9496       18.62038 163.6041 4.748679 164.0767 4.661718 -0.4725952     6.654440 
1 1 1 -24 2  12 o 94.99574 2.938793 110.6966       6.794955 110.6475       9.794498 110.7422       9.434635 94.62749 4.258366 94.71698 4.097223 -0.8949280E-01 5.909392 
1 1 1 -24 2  13 o 11.96395 5.303891 -0.9836002     3.072440 -2.968532      4.503292 0.7449952      4.202464 13.36828 6.124474 15.72572 6.569610 -2.357437      8.981589 
1 1 1 -24 2  14 o 36.65870 4.270460 16.80340       3.743589 20.65010       5.554420 13.60159       5.067490 40.29500 5.825414 32.34928 6.650569 7.945717       8.841126 
1 1 1 -24 2  15 o 114.8394 2.970425 161.8616       8.305790 163.3652       11.95254 160.4577       11.55011 114.9282 4.275188 113.9419 4.166762 0.9862976      5.969852 
1 1 1 -24 2  16 o 13.27950 5.938338 -1.519760      3.938093 1.509096       4.665116 -9.029798      7.345886 17.12851 7.015902 15.06779 7.188218 2.060723       10.04457 
1 1 1 -24 2  17 o 68.25772 3.150412 57.35678       5.226157 61.73980       7.638394 53.49912       7.166006 70.46431 4.471391 65.56168 4.512824 4.902626       6.352866 
1 1 1 -24 2  18 o 32.94878 4.631608 13.72569       3.616317 17.12293       5.540535 11.20420       4.773291 36.32244 6.498089 29.17365 6.834577 7.148798       9.430620 
1 1 1 -24 2  19 o 69.10956 3.661273 59.09466       6.144040 65.26181       12.10803 56.95599       7.130221 71.21324 7.070402 67.63228 4.349319 3.580963       8.301033 
1 1 1 -24 2  20 o 112.0032 2.990716 154.3574       8.155540 161.9973       11.89736 147.5852       11.20142 114.1617 4.284158 108.9875 4.225556 5.174126       6.017419 
1 1 1 -24 2  21 o 102.0770 2.985172 128.3155       7.417656 127.2322       10.75891 129.2970       10.24057 101.0319 4.380330 101.9770 4.129382 -0.9451065     6.019891 
1 1 1 -24 2  22 o 62.27438 3.635072 48.16104       5.492452 40.42736       9.390208 52.18286       6.771639 55.57296 7.095490 64.58139 4.327773 -9.008427      8.311173 
1 1 1 -24 2  23 o 76.98833 3.075607 73.23996       5.758600 72.87949       8.406813 73.55862       7.904188 76.17323 4.549632 76.67545 4.246827 -0.5022125     6.223720 
1 1 1 -24 2  24 o 48.29572 4.225500 29.36341       4.923008 27.02971       6.166108 33.46642       8.175986 45.74946 5.650797 50.35588 6.839379 -4.606422      8.871788 
1 1 1 -24 2  25 f 71.25254 3.193930 62.99474       5.531674 66.66656       8.028818 59.67673       7.632181 72.63528 4.558939 68.69363 4.585536 3.941658       6.466148 
1 1 1 -24 2  26 o 36.72366 4.830439 17.37194       4.218124 15.20060       6.301428 19.13481       5.677843 32.91957 7.946278 37.86059 6.380650 -4.941017      10.19098 
1 1 1 -24 2  27 o 43.93620 4.193960 24.54123       4.435955 25.79031       6.538585 23.47606       6.038045 43.97406 6.279860 42.04244 6.068957 1.931614       8.733206 
1 1 1 -24 2  28 o 56.35235 3.718034 40.03261       5.077245 35.69704       7.419113 43.85167       6.963172 51.85253 5.980924 58.25500 4.951872 -6.402470      7.764823 
1 1 1 -24 2  29 o 17.62585 6.950221 3.017193       4.396025 4.661912       5.657407 0.5107892      6.983885 20.40242 7.931515 18.43934 8.092480 1.963085       11.33125 
1 1 1 -24 2  30 o 15.75932 6.452283 1.817082       3.943544 10.03489       6.043706 -4.275911      5.204041 26.12024 8.381441 13.30143 6.257208 12.81881       10.45950 
1 1 1 -24 2  31 o 27.02110 6.393185 10.25736       4.143602 5.872172       5.978368 14.31149       5.748278 21.46940 8.203730 31.26022 7.616856 -9.790817      11.19454 
1 1 1 -24 2  32 o 25.19845 6.365405 9.027160       3.909337 9.607828       5.363266 8.368911       5.710314 25.31255 7.866661 23.78620 8.163582 1.526348       11.33704 
1 1 1 -24 2  33 o 39.76976 4.697596 20.96318       4.464888 23.31287       6.187671 18.41078       6.449047 40.59470 6.472075 34.91331 7.779141 5.681396       10.11943 
1 1 1 -24 2  34 f 19.67395 7.152018 5.382791       4.433771 -1.368497      6.884762 10.16690       5.795571 16.45774 7.552047 25.29126 8.215595 -8.833517      11.15928 
1 1 1 -24 2  35 o 20.11470 7.803469 5.600628       5.467473 5.600628       5.467473 0.000000       0.000000 20.11470 7.803469 ?        ?        0.000000       7.803469 
1 1 1 -24 2  36 o 26.07340 6.340766 10.07704       3.989420 12.44917       5.752340 7.878729       5.537572 27.56019 8.058155 22.29540 8.007895 5.264786       11.36047 
1 1 1 -24 3  1  o 107.4606 2.479413 141.3813       6.492831 154.1614       9.299219 129.2246       9.069586 111.9219 3.413527 102.3907 3.640680 9.531151       4.990663 
1 1 1 -24 3  2  o 99.94818 2.459444 122.2690       5.990292 124.1734       8.336307 120.2357       8.613602 100.4589 3.410197 98.80119 3.583493 1.657669       4.946803 
1 1 1 -24 3  3  o 17.24751 5.476662 3.649420       2.585773 0.3629103      3.634603 7.017592       3.679481 14.36512 6.062014 23.28014 6.323397 -8.915019      8.759758 
1 1 1 -24 3  4  o 157.1118 3.330228 303.0748       12.75026 280.6401       24.01513 311.8811       15.04600 149.3842 6.613354 159.1615 3.879244 -9.777237      7.667137 
1 1 1 -24 3  5  o 55.43376 2.819544 37.73803       3.796300 32.44638       5.000884 44.93470       5.831992 51.16801 4.043470 60.27670 3.992879 -9.108692      5.682670 
1 1 1 -24 3  6  o 74.67349 2.712668 68.36153       4.928071 72.18303       6.431246 62.92619       7.669924 76.59089 3.454628 71.26857 4.438312 5.322319       5.624328 
1 1 1 -24 3  7  o 110.3647 2.996701 149.3901       8.052069 156.8438       11.84980 142.9961       10.97513 112.6907 4.323077 107.6373 4.192202 5.053429       6.021922 
1 1 1 -24 3  8  o 123.0675 2.729025 185.4352       8.184404 188.3472       13.27776 183.6507       10.39377 123.4720 4.419994 122.2375 3.492836 1.234497       5.633494 
1 1 1 -24 3  9  o 147.7447 2.861006 267.3875       10.30070 253.9190       16.32075 276.3047       13.27979 143.2663 4.681050 149.9440 3.634343 -6.677689      5.926270 
1 1 1 -24 3  10 o 173.4052 3.044152 368.6151       12.86366 368.3501       20.69235 368.7820       16.42271 172.4296 4.929554 173.1112 3.892993 -0.6815491     6.281393 
1 1 1 -24 3  11 o 119.8157 3.380593 176.3929       9.860713 174.6896       12.60904 179.0749       15.82185 118.9066 4.358885 119.9384 5.427373 -1.031776      6.961053 
1 1 1 -24 3  12 o 38.13130 4.108546 18.12060       3.757554 17.32030       5.665961 18.74891       5.020381 36.65031 6.586023 38.46338 5.513624 -1.813072      8.589281 
1 1 1 -24 3  13 o 51.00874 3.488575 32.12047       4.310291 36.83702       6.435759 28.28398       5.804365 54.31203 4.915762 47.48938 5.095167 6.822647       7.079932 
1 1 1 -24 3  14 o 41.58014 3.803359 21.46110       3.811167 27.79123       5.933732 17.01591       4.972408 47.00555 5.270834 36.51175 5.780836 10.49379       7.823027 
1 1 1 -24 3  15 o 43.00037 4.817605 23.19968       4.961545 22.80626       5.968253 24.07988       8.927015 42.31419 5.952256 42.48724 8.907251 -0.1730423     10.71301 
1 1 1 -24 3  16 o 47.62962 4.502645 28.33009       5.164103 25.92374       6.130306 34.21062       9.583209 45.21278 5.689676 51.19387 7.938592 -5.981083      9.766969 
1 1 1 -24 3  17 o 68.85013 3.092068 58.34072       5.174641 62.26937       7.706702 55.11544       6.982825 70.75011 4.493191 66.59653 4.326137 4.153587       6.237325 
1 1 1 -24 3  18 f 91.87621 2.938941 103.7598       6.571598 102.6404       9.573266 104.7575       9.037173 90.91364 4.333583 91.96032 4.042579 -1.046684      5.926414 
1 1 1 -24 3  19 o 98.47089 3.524674 119.7170       8.444265 111.0108       15.82079 123.1853       9.985585 93.01968 7.031458 99.65049 4.120939 -6.630814      8.150064 
1 1 1 -24 3  20 o 62.09946 3.257164 47.63330       4.911821 54.80273       7.428878 42.06483       6.547105 66.17612 4.635983 57.92341 4.678070 8.252705       6.586097 
1 1 1 -24 3  21 o 68.14827 3.221226 57.37024       5.334345 54.69219       7.859185 59.65786       7.263756 65.93466 4.926960 69.11926 4.334288 -3.184601      6.562087 
1 1 1 -24 3  22 o 103.3544 3.351055 132.0906       8.428924 135.9277       14.69113 130.2077       10.29128 103.3114 5.859425 102.2217 4.139894 1.089676       7.174370 
1 1 1 -24 3  23 o 24.89902 6.081560 8.228596       3.657799 7.982358       5.390721 8.438702       4.979529 24.62348 7.917127 25.11763 7.536777 -0.4941502     10.93087 
1 1 1 -24 3  24 o 17.98775 6.818960 3.277071       4.109998 4.166948       5.366787 2.014981       6.391376 20.23056 7.762166 19.41011 8.104821 0.8204479      11.22227 
1 1 1 -24 3  25 o 27.17379 5.823106 9.814738       3.740056 12.24619       5.711739 7.989711       4.948467 29.71204 7.793427 24.33804 7.555124 5.374002       10.85437 
1 1 1 -24 3  26 o 69.72935 3.270557 60.52571       5.541938 55.38541       8.013884 65.23708       7.672242 65.74506 5.040441 71.78749 4.406924 -6.042435      6.695298 
1 1 1 -24 3  27 o 72.16693 3.258930 64.94897       5.716462 60.00617       8.384658 69.24194       7.814066 68.25340 5.077468 73.85732 4.360986 -5.603928      6.693197 
1 1 1 -24 3  28 o 21.97034 6.561838 6.596458       3.781220 4.261877       5.493611 8.698126       5.212373 19.98231 7.802257 24.85474 7.760041 -4.872429      11.00425 
1 1 1 -24 3  29 o 50.86542 4.719060 33.45374       5.782741 26.39149       7.111632 47.23601       9.934780 43.74306 6.899948 58.52047 7.112355 -14.77741      9.909332 
1 1 1 -24 3  30 o 27.48037 6.269552 10.48061       4.105416 10.47167       6.131022 10.48787       5.527618 26.58515 8.432070 26.75887 7.919438 -0.1737118     11.56794 
1 1 1 -24 3  31 o 35.16385 6.187034 17.05001       5.108196 2.879529       9.230199 23.30622       6.133017 21.38821 9.347073 41.12698 6.321469 -19.73876      11.28400 
1 1 1 -24 3  32 o 14.46529 6.159678 0.8723407      3.810148 -2.168197      5.391244 3.906386       5.385486 14.52737 6.672389 19.01225 7.628245 -4.484877      10.13464 
1 1 1 -24 3  33 o 41.12630 5.438117 23.00689       5.316661 22.94769       6.462367 23.13087       9.352750 39.87902 6.899473 36.61730 10.13635 3.261715       12.26166 
1 1 1 -24 3  34 o 17.88323 7.063231 3.751541       4.546824 15.71511       7.481961 -3.253763      5.725304 30.35714 9.266191 14.15639 6.628702 16.20074       11.39307 
1 1 1 -24 3  35 o 35.00180 5.955107 17.40854       4.897704 19.21873       6.206681 14.42122       7.973312 35.46772 7.419885 28.31190 9.648364 7.155815       12.17151 
1 1 1 -24 3  36 o 15.25685 6.307644 2.061970       3.816935 5.444753       5.445760 -1.204597      5.351398 19.75513 7.752092 14.58491 6.679783 5.170221       10.23301 
1 1 1 -24 4  1  o 117.3983 2.680899 168.9053       7.669700 179.9997       11.64720 160.4112       10.19122 120.7174 3.964651 114.0636 3.671206 6.653763       5.403352 
1 1 1 -24 4  2  o 180.3081 3.111598 399.0782       13.67208 402.5576       20.94346 396.4942       18.04842 180.1328 4.775322 179.2182 4.132577 0.9145813      6.315212 
1 1 1 -24 4  3  o 114.3360 2.516887 160.0297       7.012659 156.5916       9.695056 163.8023       10.15577 112.7932 3.531563 115.3347 3.617882 -2.541542      5.055789 
1 1 1 -24 4  4  o 77.57714 2.747274 73.81460       5.185441 78.38998       6.618164 66.53979       8.345160 79.80789 3.410815 73.17895 4.704563 6.628944       5.810901 
1 1 1 -24 4  5  o 76.57536 3.192687 72.07512       5.944669 74.00822       8.746657 70.41560       8.104126 77.21818 4.670048 75.38329 4.431131 1.834892       6.437722 
1 1 1 -24 4  6  o 86.09066 2.570096 90.79263       5.385858 96.03261       7.269119 84.41487       8.019566 88.37115 3.381717 82.69403 3.991397 5.677124       5.231373 
1 1 1 -24 4  7  o 29.34403 4.352955 10.84627       3.018502 8.789616       5.157734 11.91762       3.722585 26.07467 7.632131 30.60140 5.176302 -4.526730      9.221905 
1 1 1 -24 4  8  o 111.8919 2.681237 153.2818       7.310883 149.2373       11.75855 155.8306       9.334447 109.8761 4.400414 112.6027 3.405676 -2.726532      5.564375 
1 1 1 -24 4  9  o 106.5098 2.668002 138.9708       6.919420 145.6810       11.54988 135.2141       8.641913 108.5649 4.374640 104.8874 3.385477 3.677498       5.531631 
1 1 1 -24 4  10 f 110.2930 2.662546 148.9312       7.156180 161.4592       12.13715 142.2550       8.860076 114.2975 4.365591 107.5826 3.383763 6.714943       5.523426 
1 1 1 -24 4  11 o 12.60857 5.345136 0.1515234      2.847207 -8.564826      4.852746 4.727178       3.515984 11.24784 5.480815 19.69363 6.399165 -8.445794      8.425476 
1 1 1 -24 4  12 o 158.8371 3.723936 310.4130       14.41420 326.4940       18.64970 286.5550       22.71603 162.3587 4.718688 151.2174 6.177461 11.14131       7.773484 
1 1 1 -24 4  13 o 82.94283 2.952956 84.46026       5.959068 91.61137       8.982281 78.83851       7.964082 86.03044 4.298095 79.84814 4.106731 6.182297       5.944649 
1 1 1 -24 4  14 o 101.4513 3.577486 126.7714       8.830622 125.6187       10.71821 129.2073       15.58113 100.7197 4.377338 101.2680 6.345695 -0.5482864     7.709017 
1 1 1 -24 4  15 o 75.04745 3.686260 69.52259       6.720896 65.07629       8.118901 79.20354       11.97998 72.33072 4.630473 79.18417 6.259304 -6.853447      7.785895 
1 1 1 -24 4  16 o 33.28786 4.575987 13.97725       3.613867 16.32417       5.644413 12.34683       4.704564 35.39714 6.790501 30.76644 6.479912 4.630705       9.386168 
1 1 1 -24 4  17 o 71.55364 3.089347 63.01615       5.374153 67.50941       8.164412 59.58085       7.138819 73.63354 4.572582 69.26083 4.250099 4.372711       6.242743 
1 1 1 -24 4  18 o 48.82179 3.578422 29.53967       4.227797 36.41048       6.724393 25.04821       5.436789 53.76269 5.197312 44.53570 5.101509 9.226994       7.282681 
1 1 1 -24 4  19 o 11.91525 5.465008 -2.389481      3.599472 -6.756548      8.745354 -1.498799      3.949515 17.76147 8.275737 13.26768 5.938984 4.493796       10.18623 
1 1 1 -24 4  20 o 53.10409 4.148535 35.19318       5.325997 52.32686       11.41799 30.42850       6.021177 63.26610 7.555133 49.04956 5.112395 14.21654       9.122314 
1 1 1 -24 4  21 o 67.91133 3.604346 57.18990       5.943561 59.16505       10.56592 56.27557       7.188786 67.79859 6.473654 67.07100 4.422987 0.7275925      7.840344 
1 1 1 -24 4  22 o 22.78698 6.213341 6.855363       3.544495 7.963592       5.428551 6.031786       4.679737 24.67685 7.945843 21.95360 7.392407 2.723253       10.85284 
1 1 1 -24 4  23 o 111.7881 3.041891 154.3282       8.278877 153.6728       12.24932 154.8793       11.23281 110.6384 4.553012 111.3516 4.146819 -0.7132111     6.158411 
1 1 1 -24 4  24 o 25.55618 6.091793 8.714712       3.739959 11.10871       5.760139 6.969934       4.917459 28.38472 7.990829 23.10139 7.571839 5.283329       11.00846 
1 1 1 -24 4  25 o 65.14496 3.915263 53.21726       6.186841 50.78468       7.846357 57.21550       10.05930 62.98391 5.157257 66.09943 6.321971 -3.115517      8.158714 
1 1 1 -24 4  26 o 55.58866 3.556422 38.68700       4.792385 44.51562       7.377046 34.43106       6.303725 58.77864 5.203946 51.71989 5.066463 7.058743       7.262927 
1 1 1 -24 4  27 o 19.91699 6.439939 5.215767       3.563494 4.348174       5.457604 5.860536       4.704850 20.13373 7.800385 21.29360 7.405321 -1.159876      10.75569 
1 1 1 -24 4  28 f 27.12524 5.902800 9.986006       3.790715 10.86734       5.583016 9.232204       5.163310 27.49898 7.908983 25.51487 7.678815 1.984108       11.02344 
1 1 1 -24 4  29 o 32.68616 6.362863 14.66824       4.885798 11.65355       6.340633 19.07438       7.665498 28.06757 8.522776 35.67022 8.858840 -7.602654      12.29296 
1 1 1 -24 4  30 o 78.73819 3.714602 78.47821       7.107349 61.39556       12.45132 86.73417       8.656084 65.40261 7.977257 82.23391 4.334819 -16.83130      9.078947 
1 1 1 -24 4  31 f 51.06113 4.587973 33.93666       5.648031 27.06354       10.49155 36.74142       6.702089 40.25644 10.56399 52.59589 5.301301 -12.33945      11.81955 
1 1 1 -24 4  32 o 42.52320 5.420498 24.39447       5.489450 19.00181       6.516670 37.57081       10.18642 35.75044 7.707287 49.43158 8.777847 -13.68114      11.68130 
1 1 1 -24 4  33 o 53.98512 4.290637 38.03011       5.598181 26.15691       8.864047 45.90833       7.220415 40.11870 9.255138 58.55122 5.111662 -18.43252      10.57292 
1 1 1 -24 4  34 o 14.65031 6.198193 1.283821       3.815679 -3.123167      5.369881 5.778224       5.422878 13.73717 6.428274 20.40994 7.809743 -6.672773      10.11508 
1 1 1 -24 4  35 o 17.82087 6.994588 3.904651       4.434306 -0.6497470     5.661477 11.13297       7.132352 15.37527 6.975300 25.49232 9.096041 -10.11705      11.46267 
1 1 1 -24 4  36 o 21.89867 6.901435 7.326709       4.113110 6.061398       5.957662 8.479058       5.685507 20.47685 8.085909 22.88545 8.125895 -2.408600      11.46351 
1 1 1 -24 5  1  f 54.55962 3.038019 36.66066       4.023274 38.01027       4.988374 34.14884       6.805347 55.41369 3.715549 52.03536 5.447434 3.378330       6.593925 
1 1 1 -24 5  2  o 112.7620 2.723344 155.8468       7.483439 156.8970       9.544617 154.1709       12.05645 112.8812 3.473906 111.5245 4.445125 1.356667       5.641557 
1 1 1 -24 5  3  o 82.56828 2.718864 83.62714       5.463163 80.81531       6.855600 88.51968       9.043119 80.99311 3.481583 84.49861 4.406930 -3.505501      5.616267 
1 1 1 -24 5  4  o 40.42392 3.175490 20.17984       3.103038 21.26746       4.249961 18.93804       4.541221 41.28607 4.286523 38.78681 4.914721 2.499260       6.521409 
1 1 1 -24 5  5  o 55.72480 2.706317 38.12403       3.664061 42.61122       5.099094 33.33358       5.268590 58.76011 3.577979 51.80990 4.209201 6.950211       5.524428 
1 1 1 -24 5  6  o 18.16868 6.297967 3.766319       3.401653 8.970121       11.21639 3.239214       3.569778 29.43170 11.23919 17.61619 6.415445 11.81551       12.94130 
1 1 1 -24 5  7  o 92.36965 2.918511 104.6813       6.561172 102.6197       9.746111 106.3902       8.873019 91.05424 4.405404 92.86246 3.929869 -1.808228      5.903512 
1 1 1 -24 5  8  o 70.96484 2.752720 61.77583       4.751349 57.12247       7.829580 64.48844       5.977898 67.77543 4.771049 72.38257 3.398543 -4.607140      5.857730 
1 1 1 -24 5  9  o 179.1396 3.114947 393.6591       13.59810 395.0141       22.05073 392.8276       17.27360 178.3880 5.077655 178.5760 3.969389 -0.1880035     6.445047 
1 1 1 -24 5  10 o 63.85177 2.842702 50.05619       4.412149 46.81220       7.527725 51.75381       5.445590 61.22811 5.091203 64.81055 3.460513 -3.582439      6.155932 
1 1 1 -24 5  11 o 48.85093 3.144620 29.40117       3.723609 23.52042       6.359680 32.46880       4.593246 42.92679 6.264050 51.24097 3.703450 -8.314186      7.276941 
1 1 1 -24 5  12 o 88.88641 2.897658 96.96037       6.268127 90.39598       9.381345 102.2541       8.424582 85.38030 4.525066 91.04970 3.805329 -5.669395      5.912423 
1 1 1 -24 5  13 o 15.59571 6.500088 0.8079586      4.099852 3.149998       4.954593 -4.278717      7.301766 19.15796 7.429514 17.11111 7.823906 2.046848       10.78940 
1 1 1 -24 5  14 o 52.60933 4.321008 34.43599       5.490891 35.22070       6.773050 32.93139       9.378670 52.93125 5.323129 50.24872 7.921180 2.682529       9.543626 
1 1 1 -24 5  15 o 79.73022 2.985845 78.12643       5.791063 77.63177       8.855931 78.49596       7.654423 79.00699 4.619891 79.66197 3.955357 -0.6549835     6.081796 
1 1 1 -24 5  16 o 28.06338 5.323488 10.13081       3.507434 13.26053       5.771576 8.298165       4.416532 31.62378 7.586728 25.18179 6.963477 6.441990       10.29798 
1 1 1 -24 5  17 o 88.97824 2.974040 97.34398       6.439556 106.2523       9.853421 90.70253       8.507846 92.48281 4.384584 85.53951 4.093350 6.943306       5.998341 
1 1 1 -24 5  18 o 58.99814 3.326507 42.99467       4.763214 41.21350       7.171337 44.40078       6.371736 57.20130 5.201503 59.65493 4.414315 -2.453629      6.822156 
1 1 1 -24 5  19 o 22.42351 6.122908 6.571218       3.439232 1.696984       5.412158 9.872687       4.454211 18.22078 7.519844 27.31484 6.734891 -9.094067      10.09489 
1 1 1 -24 5  20 o 59.57565 4.477450 44.43398       6.452770 0.000000       0.000000 44.43398       6.452770 ?        ?        59.57565 4.477450 0.000000       4.477450 
1 1 1 -24 5  21 o 27.95385 6.349214 10.34211       4.226230 8.644183       7.867219 11.03085       5.010598 26.50844 9.541879 28.67615 7.185571 -2.167706      11.94487 
1 1 1 -24 5  22 o 42.20705 4.050350 22.36088       4.114875 18.21978       6.361633 25.33978       5.395589 36.84684 7.342780 44.60864 5.052297 -7.761803      8.913031 
1 1 1 -24 5  23 o 27.44277 5.837357 9.948630       3.783592 8.869743       5.941971 10.68440       4.906971 25.76186 8.314707 28.07824 7.152592 -2.316383      10.96786 
1 1 1 -24 5  24 o 32.31787 5.154420 13.53901       3.923106 17.50227       6.376073 11.12455       4.976639 35.78214 7.549978 28.55750 7.164195 7.224638       10.40807 
1 1 1 -24 5  25 o 19.14499 7.055840 4.155276       4.338014 4.049970       5.805463 4.288409       6.527588 20.36248 7.999934 21.21568 8.436274 -0.8532009     11.62625 
1 1 1 -24 5  26 o 41.40395 4.222466 21.80195       4.200772 23.92362       6.577965 20.34077       5.458893 42.19166 6.615059 39.22297 5.893249 2.968689       8.859424 
1 1 1 -24 5  27 o 44.86960 4.010477 25.55197       4.338964 21.15698       6.518422 29.04866       5.814224 39.19176 7.085892 47.28814 5.127445 -8.096378      8.746460 
1 1 1 -24 5  28 o 20.67138 7.238890 5.544405       4.500170 3.121710       5.803944 9.196515       7.125997 19.17377 7.836308 25.54580 9.094478 -6.372026      12.00488 
1 1 1 -24 5  29 o 32.64469 5.437608 14.22735       4.173614 7.882603       6.122499 19.73517       5.704416 23.82441 8.435014 37.99068 6.388121 -14.16627      10.58100 
1 1 1 -24 5  30 o 11.25499 5.277355 -3.076527      3.649984 1.568895       5.600815 -6.505849      4.812190 17.48143 7.456842 11.61173 5.610745 5.869700       9.331932 
1 1 1 -24 5  31 o 40.93348 6.840379 23.63509       6.582709 13.17852       10.08648 31.39306       8.687986 28.28293 10.69129 46.19239 8.008239 -17.90946      13.35798 
1 1 1 -24 5  32 o 23.32929 6.556035 7.833058       3.880898 7.695755       5.669952 7.954085       5.323274 22.91520 8.116893 23.19330 7.883932 -0.2780991     11.31549 
1 1 1 -24 5  33 o 31.56968 6.579594 14.39394       4.897436 7.639533       7.891742 18.62438       6.245573 23.04380 9.238175 35.23341 7.504200 -12.18960      11.90197 
1 1 1 -24 5  34 o 27.98382 6.276092 11.35137       4.174133 5.494339       5.792939 17.67619       6.019828 20.24737 7.980135 34.07574 7.457020 -13.82837      10.92198 
1 1 1 -24 5  35 o 23.35152 7.382802 8.469170       4.703424 6.910255       5.930101 11.11306       7.722757 21.44661 8.176502 25.25559 9.394736 -3.808973      12.45457 
1 1 1 -24 5  36 o 19.67257 6.822458 5.712376       3.992030 4.181807       5.922414 6.986843       5.404264 18.82160 7.825881 21.26518 7.868579 -2.443581      11.09770 
1 1 1 -24 6  1  o 143.6885 2.664263 253.1291       9.329005 245.8414       12.82272 261.3245       13.59778 141.1389 3.731456 145.4645 3.839325 -4.325516      5.353894 
1 1 1 -24 6  2  o 57.25990 3.080708 40.37889       4.282873 39.88858       6.446811 40.76625       5.730127 56.50652 4.724989 57.29343 4.131906 -0.7869110     6.276796 
1 1 1 -24 6  3  o 39.81452 3.203654 19.59625       3.082083 19.86383       4.139674 19.26345       4.616683 39.85387 4.332070 39.08481 4.958591 0.7690620      6.584411 
1 1 1 -24 6  4  f 11.40774 4.846340 0.8103568E-01  2.349060 -0.4155454     3.158067 0.6960723      3.514607 12.66160 5.501294 14.47106 6.023779 -1.809456      8.157828 
1 1 1 -24 6  5  o 57.30609 3.009169 40.39566       4.187539 34.73214       6.548679 44.31337       5.446607 52.62340 5.173493 59.87548 3.751709 -7.252083      6.390646 
1 1 1 -24 6  6  o 31.85409 4.316128 12.75151       3.264274 8.582472       5.204136 15.45570       4.191301 25.76974 7.698463 34.94360 5.069920 -9.173855      9.217939 
1 1 1 -24 6  7  o 55.92587 3.594986 38.62337       4.873486 24.78997       13.63189 40.65052       5.218364 42.18330 12.42425 57.34642 3.754805 -15.16312      12.97924 
1 1 1 -24 6  8  o 25.17705 5.086659 8.138968       3.013319 11.19597       5.325546 6.699344       3.654607 29.17998 7.461112 22.77550 6.348178 6.404486       9.796304 
1 1 1 -24 6  9  o 54.40612 3.045570 36.42150       4.021753 36.68946       6.857673 36.28103       4.965263 54.08894 5.269471 54.15736 3.786106 -0.6841660E-01 6.488600 
1 1 1 -24 6  10 o 145.8129 2.852142 260.6121       10.13452 264.3552       16.68843 258.4251       12.75603 146.0424 4.695319 144.9395 3.611542 1.102936       5.923619 
1 1 1 -24 6  11 o 54.61295 2.976972 36.68853       3.946946 27.19663       6.671378 41.79997       4.895655 46.25164 6.065050 58.20942 3.466997 -11.95778      6.986051 
1 1 1 -24 6  12 o 58.32899 3.459111 41.97717       4.894749 49.66228       7.269574 35.60347       6.620329 63.12716 4.760679 53.28078 5.163510 9.846382       7.023240 
1 1 1 -24 6  13 o 32.42987 7.530035 13.88411       5.836349 13.88411       5.836349 0.000000       0.000000 32.42987 7.530035 ?        ?        0.000000       7.530035 
1 1 1 -24 6  14 o 19.24410 6.053055 4.615254       3.165500 3.020526       5.290157 5.504731       3.950870 19.39501 7.631544 21.05744 6.778509 -1.662430      10.20728 
1 1 1 -24 6  15 o 53.95869 3.346344 35.94590       4.378502 40.29746       7.157656 33.34381       5.534896 56.62611 5.246680 51.70217 4.435863 4.923943       6.870556 
1 1 1 -24 6  16 f 37.89524 4.059470 17.94764       3.690433 24.10520       6.202852 14.57376       4.591476 43.40954 6.025957 33.64408 5.810247 9.765457       8.370850 
1 1 1 -24 6  17 o 67.48376 3.201798 56.14791       5.250359 53.86069       8.271945 57.69103       6.794442 65.45420 5.229480 68.15041 4.110291 -2.696213      6.651463 
1 1 1 -24 6  18 o 67.88297 3.191869 56.84298       5.265313 59.59970       8.266692 54.96125       6.829901 68.92933 4.954484 66.43672 4.240757 2.492607       6.521575 
1 1 1 -24 6  19 o 15.09344 6.202535 1.125489       3.661343 9.458340       7.262422 -1.714191      4.239546 27.16575 9.208915 13.63059 6.123231 13.53516       11.05885 
1 1 1 -24 6  20 o 26.25316 7.083150 9.185308       4.635322 0.000000       0.000000 9.185308       4.635322 ?        ?        26.25316 7.083150 0.000000       7.083150 
1 1 1 -24 6  21 o 40.29835 4.338353 20.46773       4.193344 24.03627       6.659891 18.12370       5.397633 42.85375 6.587981 37.27118 6.157681 5.582569       9.017678 
1 1 1 -24 6  22 o 23.46480 6.228510 7.312616       3.620449 11.15174       5.883731 4.973218       4.592917 28.55204 8.089319 20.52524 7.301897 8.026802       10.89747 
1 1 1 -24 6  23 o 76.34445 3.199970 72.21581       5.940123 66.28030       8.939011 76.90946       7.949064 72.20761 5.113149 78.33739 4.179125 -6.129776      6.603739 
1 1 1 -24 6  24 o 20.02981 6.406469 5.183642       3.533147 4.425561       5.887512 5.610305       4.416883 20.85865 8.096128 21.06900 7.181100 -0.2103462     10.82199 
1 1 1 -24 6  25 o 50.89925 4.479755 32.93445       5.499870 37.15779       7.478914 27.96085       8.116078 53.33781 5.849834 45.13756 7.651583 8.200256       9.631577 
1 1 1 -24 6  26 o 43.91591 4.091684 24.47093       4.328465 12.82842       6.703012 32.79814       5.668872 29.77261 8.696774 50.61720 4.647649 -20.84459      9.860757 
1 1 1 -24 6  27 o 21.47174 6.427889 6.262766       3.625196 7.082914       5.698168 5.705081       4.698765 23.05582 8.139797 21.02993 7.394388 2.025898       10.99697 
1 1 1 -24 6  28 o 45.89356 4.839762 27.33266       5.331266 22.92752       6.863195 34.03489       8.465568 40.54501 7.210549 49.54898 7.223514 -9.003967      10.20643 
1 1 1 -24 6  29 o 29.40311 6.799696 12.15920       4.774960 8.267333       5.974549 19.04058       7.944456 24.15396 8.347876 35.26651 9.162375 -11.11255      12.39501 
1 1 1 -24 6  30 o 9.866641 4.776626 -5.169040      3.529644 -6.678501      5.313538 -3.976960      4.721998 12.33007 5.942396 12.63606 5.949222 -0.3059845     8.408645 
1 1 1 -24 6  31 o 12.43164 5.782578 -2.790853      4.241414 -4.070435      9.145416 -2.440213      4.787403 17.89647 8.379289 13.52281 6.238699 4.373664       10.44671 
1 1 1 -24 6  32 o 14.86681 6.367146 0.9129097      4.113261 3.599639       7.207841 -0.3845861     5.008945 19.98235 8.489174 15.05903 6.718189 4.923319       10.82590 
1 1 1 -24 6  33 f 41.07600 4.550375 22.35246       4.478518 19.68313       6.590137 24.64312       6.104831 35.93448 7.753560 41.82758 6.174709 -5.893097      9.911847 
1 1 1 -24 6  34 o 39.64520 4.781832 21.13782       4.526579 25.60592       7.011483 17.94465       5.927326 41.41492 7.209053 34.45419 7.287551 6.960735       10.25080 
1 1 1 -24 6  35 o 17.44089 6.941658 3.599502       4.423508 1.049847       5.793082 7.165027       6.850633 16.53499 7.308949 21.79357 8.650128 -5.258572      11.32455 
1 1 1 -24 6  36 o 16.66735 6.580345 3.305405       3.944934 6.158844       6.056735 1.202971       5.198948 20.53643 8.139143 15.93994 6.989266 4.596491       10.72826 
1 1 1 -24 7  1  o 60.10222 2.748718 44.41039       4.015185 43.68695       5.486763 45.24448       5.891473 59.36524 3.812854 60.35916 4.028448 -0.9939156     5.546732 
1 1 1 -24 7  2  f 71.25065 2.612656 62.31028       4.528674 62.78807       6.300742 61.79966       6.513584 71.28092 3.639336 70.67275 3.796020 0.6081696      5.258758 
1 1 1 -24 7  3  o 61.40791 3.013180 46.40775       4.495287 50.13061       7.054273 43.86233       5.833014 63.42221 4.595477 59.45620 4.050050 3.966015       6.125464 
1 1 1 -24 7  4  o 91.18795 2.458557 101.8901       5.458300 101.7137       7.582284 102.0800       7.863815 90.86750 3.430330 90.99516 3.553157 -0.1276627     4.938835 
1 1 1 -24 7  5  o 76.37820 2.771489 71.60690       5.149891 80.23811       8.550469 66.69348       6.451276 80.42379 4.379365 73.51701 3.612046 6.906784       5.676770 
1 1 1 -24 7  6  o 39.88607 3.685650 19.75109       3.541879 28.77783       6.094463 15.14741       4.352342 47.79746 5.322506 34.49665 5.350584 13.30082       7.547040 
1 1 1 -24 7  7  o 110.5297 3.174852 150.1350       8.542562 131.3567       19.93884 154.3569       9.454224 100.9778 8.172628 111.9821 3.468686 -11.00430      8.878268 
1 1 1 -24 7  8  o 35.95478 4.676158 16.26974       4.000177 24.40453       13.03055 15.42336       4.203127 41.81229 12.10026 34.88854 5.093900 6.923752       13.12875 
1 1 1 -24 7  9  o 74.22487 2.788298 67.62331       5.034449 66.75829       8.469612 68.09594       6.260508 73.23389 4.771852 74.33662 3.465513 -1.102730      5.897486 
1 1 1 -24 7  10 o 84.54265 3.688876 88.16957       7.581575 86.88777       9.560040 90.34206       12.44598 83.60214 4.711589 84.70612 6.069688 -1.103973      7.683761 
1 1 1 -24 7  11 o 95.15895 3.113342 111.2929       7.209872 105.9729       10.44286 116.1387       9.966415 92.36214 4.654699 96.85953 4.232630 -4.497383      6.291374 
1 1 1 -24 7  12 f 15.91921 5.757131 2.676120       2.868035 8.323502       5.447488 0.5104191      3.373433 25.46478 7.930448 14.01058 5.871858 11.45420       9.867661 
1 1 1 -24 7  13 o 71.24999 3.041854 62.44061       5.269372 59.92756       8.302904 64.13540       6.818489 69.26409 4.951767 71.99672 3.900897 -2.732628      6.303729 
1 1 1 -24 7  14 o 75.66444 3.031276 70.41558       5.577937 66.88230       8.587626 72.99410       7.336163 73.20821 4.840852 76.79668 3.933140 -3.588470      6.237262 
1 1 1 -24 7  15 o 40.09086 3.988754 20.04872       3.845253 19.55091       6.530139 20.31295       4.757536 38.62622 7.202406 40.10413 4.974666 -1.477917      8.753397 
1 1 1 -24 7  16 o 65.38004 3.173101 52.69568       5.040415 50.47675       8.176261 54.05587       6.401512 63.31104 5.349569 65.99702 3.999126 -2.685986      6.679139 
1 1 1 -24 7  17 o 12.88091 5.528308 -0.5572418E-01 3.113017 3.333341       5.484838 -1.666262      3.781023 19.82083 7.779262 12.81411 5.767329 7.006720       9.683956 
1 1 1 -24 7  18 o 69.48089 3.499828 59.72524       5.906734 75.49604       11.90306 54.57290       6.803526 76.83427 6.415732 66.17223 4.241456 10.66204       7.691006 
1 1 1 -24 7  19 o 30.81232 5.683122 12.32610       4.110069 18.50053       8.565950 10.47948       4.684534 36.48021 9.532055 28.05641 6.900331 8.423800       11.76752 
1 1 1 -24 7  20 f 104.0118 3.506575 133.9242       8.875250 144.9670       18.05312 130.4046       10.19194 105.7516 7.045528 102.3422 4.094903 3.409348       8.149092 
1 1 1 -24 7  21 o 13.79421 5.940658 -0.4033896E-01 3.618218 1.253192       6.000063 -0.7795277     4.535708 18.45956 7.789227 14.77411 6.501478 3.685455       10.14600 
1 1 1 -24 7  22 o 59.08169 3.517503 43.42785       5.041423 33.65297       7.834891 50.33474       6.585950 50.71652 6.487759 63.31042 4.294226 -12.59389      7.780192 
1 1 1 -24 7  23 o 32.48307 5.152593 13.67003       3.942678 11.04338       6.351289 15.31682       5.028964 28.21771 8.521839 33.96500 6.308065 -5.747292      10.60252 
1 1 1 -24 7  24 o 20.46055 6.472548 5.468295       3.614645 3.503775       6.096565 6.533237       4.488696 20.16425 8.107310 22.27038 7.229906 -2.106131      10.86278 
1 1 1 -24 7  25 o 17.83680 6.786190 3.316601       4.079557 2.636885       5.767316 3.997283       5.771417 18.97676 7.789977 20.18714 7.962549 -1.210386      11.13939 
1 1 1 -24 7  26 o 37.95380 4.492496 18.50782       4.074609 19.42398       6.473492 17.90669       5.243640 37.38888 7.367064 36.56397 6.099713 0.8249092      9.564525 
1 1 1 -24 7  27 o 24.78990 7.203564 8.618228       4.609532 4.030274       6.005147 15.19875       7.191910 20.17478 8.068600 31.94803 8.905541 -11.77325      12.01711 
1 1 1 -24 7  28 o 35.10892 5.932123 16.63201       4.894694 18.35015       6.492585 14.36975       7.450059 35.82771 7.667959 30.72306 9.218735 5.104650       11.99094 
1 1 1 -24 7  29 o 37.78335 4.709931 18.64152       4.242713 14.01046       6.408570 22.25509       5.660946 30.61170 8.357833 40.61131 5.891974 -9.999601      10.22589 
1 1 1 -24 7  30 o 14.12104 6.034153 0.6244202      3.679195 3.333175       5.631934 -1.392222      4.859450 18.87868 7.717935 14.34895 6.490743 4.529726       10.08446 
1 1 1 -24 7  31 o 27.81408 6.955235 11.24082       4.701510 12.95282       9.675608 10.71166       5.379261 27.85816 10.48432 26.67806 7.790285 1.180101       13.06176 
1 1 1 -24 7  32 o 21.85713 7.015975 6.944888       4.234622 -3.280389      7.213644 12.32128       5.230733 16.06555 7.495719 28.63206 7.432528 -12.56651      10.55596 
1 1 1 -24 7  33 o 20.96997 6.733096 6.411438       3.899837 5.110644       5.884919 7.429966       5.207421 20.03381 7.995728 22.22054 7.786564 -2.186729      11.16075 
1 1 1 -24 7  34 o 22.02499 6.702521 7.230164       3.918560 -0.3244056E-01 5.799568 13.33076       5.315394 15.93864 7.160770 29.38213 7.422427 -13.44348      10.31354 
1 1 1 -24 7  35 o 25.33373 7.231006 10.00111       4.684018 10.32812       6.186145 9.561723       7.170794 24.82559 8.497625 23.81093 9.011453 1.014652       12.38612 
1 1 1 -24 8  1  o 50.44744 3.333520 31.47491       4.075090 36.04571       6.354169 28.28150       5.311162 53.55457 4.923921 47.46970 4.650937 6.084869       6.773198 
1 1 1 -24 8  2  o 43.16846 3.618872 23.13718       3.771931 25.33321       5.905006 21.62354       4.902438 44.65163 5.546009 41.38148 4.960219 3.270153       7.440563 
1 1 1 -24 8  3  o 65.35480 3.038873 52.58416       4.826537 54.10081       7.812115 51.64782       6.138180 65.75593 4.910720 64.54874 3.920746 1.207184       6.283902 
1 1 1 -24 8  4  o 61.97504 3.017322 47.27877       4.543259 43.56055       7.134914 49.81459       5.892236 58.95221 5.014057 63.42581 3.830068 -4.473602      6.309532 
1 1 1 -24 8  5  o 34.16275 4.204773 14.63983       3.426745 14.08474       5.614927 14.96929       4.325734 32.69082 7.239377 34.25803 5.356906 -1.567215      9.005832 
1 1 1 -24 8  6  o 64.99677 2.947356 51.94975       4.656171 54.15854       7.822110 50.73761       5.794611 65.84181 4.910490 64.05649 3.728260 1.785324       6.165454 
1 1 1 -24 8  7  o 12.01132 5.233051 -0.4507040     2.874053 0.9748661      5.173608 -1.087008      3.456459 17.37673 7.276419 12.66344 5.619169 4.713289       9.193548 
1 1 1 -24 8  8  o 137.9194 3.278447 233.8048       11.01868 260.8915       26.20968 227.9898       12.14398 142.8626 7.555337 135.9970 3.667688 6.865585       8.398515 
1 1 1 -24 8  9  o 42.18105 4.383575 22.24450       4.440266 22.62773       6.487524 21.90677       6.090256 41.91216 6.567445 41.33122 6.241010 0.5809364      9.059886 
1 1 1 -24 8  10 f 137.4792 3.277183 232.3355       10.97927 241.2701       16.05980 224.4954       15.04401 139.3567 4.735958 134.4946 4.596860 4.862045       6.600031 
1 1 1 -24 8  11 o 75.78201 3.087183 70.64616       5.689242 66.93951       9.116434 73.01059       7.281085 73.14526 5.147361 76.82561 3.901921 -3.680359      6.459126 
1 1 1 -24 8  12 f 64.48518 2.874440 51.12298       4.505640 43.15619       8.081532 54.71620       5.427425 58.43852 5.749265 66.61158 3.354347 -8.173058      6.656252 
1 1 1 -24 8  13 o 22.83602 5.811806 6.787988       3.241830 10.10177       5.988000 5.414000       3.855773 27.70969 8.253097 20.84637 6.695099 6.863321       10.62723 
1 1 1 -24 8  14 o 39.45420 4.064825 19.44494       3.852283 14.01582       6.733987 22.08598       4.696716 32.29139 8.458348 41.91633 4.677698 -9.624939      9.665636 
1 1 1 -24 8  15 o 17.92999 6.116601 3.785742       3.204575 -3.549669      5.865009 6.907689       3.826214 15.26848 6.992906 23.02635 6.523191 -7.757867      9.563093 
1 1 1 -24 8  16 o 46.61509 3.701640 26.99887       4.170407 30.08544       7.293159 25.49926       5.083531 48.37183 6.339528 45.02563 4.702318 3.346199       7.893124 
1 1 1 -24 8  17 o 76.40726 3.380659 72.12263       6.279074 70.97775       12.14096 72.54067       7.336429 74.28709 6.781316 76.43773 3.952009 -2.150642      7.848861 
1 1 1 -24 8  18 o 15.71150 6.214373 1.882486       3.524231 9.865681       7.862217 -0.1248908     3.942495 27.75477 9.576993 14.35422 6.191647 13.40055       11.40418 
1 1 1 -24 8  19 o 21.83381 6.316884 6.232228       3.551673 14.15198       6.462119 2.804396       4.251369 32.21677 8.208825 17.73178 6.880536 14.48498       10.71105 
1 1 1 -24 8  20 o 12.34843 5.497024 -1.055099      3.334779 -4.967238      5.972508 0.7170304      4.019733 14.56649 6.804264 15.20618 6.393628 -0.6396894     9.336835 
1 1 1 -24 8  21 o 73.96770 3.641824 68.04592       6.544250 78.56253       13.99268 65.10153       7.403903 77.02470 7.551728 72.08931 4.233205 4.935394       8.657288 
1 1 1 -24 8  22 o 33.50872 5.022675 14.47139       3.975153 18.60688       6.759456 12.28499       4.914896 36.88012 7.766932 30.17883 6.841469 6.701288       10.35041 
1 1 1 -24 8  23 o 75.34425 3.183959 70.43722       5.832753 62.53050       8.993720 76.17688       7.662740 69.85789 5.323170 77.93149 4.048805 -8.073593      6.687971 
1 1 1 -24 8  24 o 26.59099 6.020185 9.498954       3.809949 4.977816       6.099803 12.39107       4.878651 21.43241 8.261815 30.13570 6.804810 -8.703291      10.70341 
1 1 1 -24 8  25 o 56.25429 4.208221 40.10986       5.727058 44.01195       7.885211 35.75325       8.331796 58.07295 5.642963 51.53806 6.799715 6.534889       8.836241 
1 1 1 -24 8  26 o 15.67686 6.576626 1.179618       4.238179 1.938615       6.044637 0.4456812      5.944010 18.54183 7.820712 17.33134 7.538605 1.210491       10.86251 
1 1 1 -24 8  27 o 23.56079 7.250793 7.749554       4.569403 10.18360       5.995155 4.375493       7.058497 26.52107 8.328529 21.24766 8.657727 5.273411       12.01335 
1 1 1 -24 8  28 o 25.23457 6.446655 8.874083       3.978224 5.782724       6.185519 11.05487       5.195271 21.73122 8.334433 27.70664 7.508827 -5.975418      11.21808 
1 1 1 -24 8  29 o 36.95731 4.743572 17.89462       4.173717 14.73085       6.411668 20.22106       5.498134 31.36889 8.271112 38.52412 6.056244 -7.155224      10.25131 
1 1 1 -24 8  30 o 37.31887 4.858857 18.40115       4.313923 7.713808       6.291353 27.88514       5.926591 23.28218 8.510974 45.62569 5.437254 -22.34351      10.09953 
1 1 1 -24 8  31 o 18.73221 7.508239 3.810095       5.211833 0.000000       0.000000 3.810095       5.211833 ?        ?        18.73221 7.508239 0.000000       7.508239 
1 1 1 -24 8  32 o 35.80006 5.643744 17.67669       4.760762 14.90212       8.437613 18.97254       5.766307 29.26869 9.926033 36.22267 6.781709 -6.953978      12.02155 
1 1 1 -24 8  33 o 17.66642 6.637003 3.988018       3.873699 1.570229       6.005104 5.711074       5.069454 17.27794 7.545281 20.21034 7.592613 -2.932398      10.70416 
1 1 1 -24 8  34 o 17.47401 6.589420 3.937958       3.826255 3.938347       5.827111 3.937664       5.073176 18.76987 7.779882 18.27854 7.379208 0.4913330      10.72284 
1 1 1 -24 8  35 o 48.22159 5.164843 31.96549       5.974812 20.37564       7.674978 49.79374       9.519031 34.37391 9.042638 57.88129 6.883339 -23.50739      11.36440 
1 1 1 -24 9  1  o 116.1296 2.547387 165.4315       7.208982 161.5345       9.868209 169.8911       10.55666 114.3416 3.545872 117.1924 3.701143 -2.850731      5.125589 
1 1 1 -24 9  2  o 61.57848 3.108432 46.75994       4.649429 54.74652       7.537627 41.85498       5.907060 66.15220 4.706522 57.95782 4.211103 8.194374       6.315436 
1 1 1 -24 9  3  o 85.71712 2.525737 90.14504       5.270089 89.22220       7.283695 91.15898       7.634755 85.00053 3.524009 85.87601 3.656641 -0.8754807     5.078352 
1 1 1 -24 9  4  f 38.88727 4.724432 19.06173       4.385322 20.45045       12.78742 18.87664       4.668429 38.18836 12.18508 38.59437 5.087539 -0.4060135     13.20451 
1 1 1 -24 9  5  o 71.70884 2.880270 63.22236       5.022933 63.13628       8.158894 63.27490       6.374053 71.12096 4.734537 71.53964 3.668474 -0.4186859     5.989453 
1 1 1 -24 9  6  o 81.84816 2.810795 82.29120       5.597952 95.17809       9.495094 75.42552       6.930538 87.50391 4.467613 78.13646 3.649882 9.367447       5.768986 
1 1 1 -24 9  7  f 22.18832 6.802935 6.284036       4.027029 -1.231857      5.714095 13.70071       5.676253 16.48966 7.275236 32.17505 7.394683 -15.68539      10.37354 
1 1 1 -24 9  8  o 61.85112 4.445368 47.64482       6.655567 38.97623       14.47824 49.96748       7.494357 52.74449 11.58205 63.20195 4.904304 -10.45746      12.57760 
1 1 1 -24 9  9  o 62.14006 3.427739 47.66980       5.170469 46.77353       14.84103 47.79361       5.516052 58.36032 10.83420 62.16515 3.657365 -3.804821      11.43487 
1 1 1 -24 9  10 o 107.8621 2.770958 142.8027       7.277381 151.8903       12.58391 138.2363       8.920348 110.5000 4.683852 105.9050 3.461089 4.594978       5.823883 
1 1 1 -24 9  11 o 216.1394 3.494211 575.3956       18.40429 586.4135       30.34030 568.9813       23.14975 216.1378 5.765555 214.2297 4.434356 1.908081       7.273592 
1 1 1 -24 9  12 o 55.26907 3.145769 37.67261       4.219373 42.41625       7.986483 35.83594       4.969529 57.88332 5.737366 53.74638 3.819165 4.136936       6.892270 
1 1 1 -24 9  13 o 24.12614 5.413949 7.560781       3.104610 6.882869       6.078081 7.800087       3.611243 24.00715 8.412378 24.41295 6.090497 -0.4058018     10.38568 
1 1 1 -24 9  14 o 73.25165 3.138698 66.12233       5.589786 63.86040       9.172647 67.45856       7.050111 71.24010 5.322110 73.75380 3.936877 -2.513695      6.619959 
1 1 1 -24 9  15 o 18.46359 5.766526 4.282672       2.878050 3.742020       6.304050 4.425032       3.234843 21.06225 8.317472 18.92016 6.137250 2.142090       10.33664 
1 1 1 -24 9  16 o 17.62553 6.357149 3.399492       3.494111 10.49085       8.082994 1.769835       3.874856 28.49951 9.714457 16.12547 6.470345 12.37404       11.67202 
1 1 1 -24 9  17 o 67.58909 3.475667 56.55459       5.705449 57.32889       11.19928 56.28320       6.630375 66.48409 7.018312 67.23182 4.065948 -0.7477264     8.111020 
1 1 1 -24 9  18 o 97.15026 3.032528 116.3608       7.170555 119.4978       11.53876 114.3872       9.152326 97.56071 4.868807 95.94516 3.922736 1.615555       6.252451 
1 1 1 -24 9  19 o 76.18339 3.137079 71.71838       5.811548 71.67488       9.641144 71.74321       7.283528 75.20275 5.294725 75.88742 3.952165 -0.6846695     6.607097 
1 1 1 -24 9  20 o 30.78258 5.287443 12.28442       3.823450 10.31730       6.891930 13.15902       4.595479 27.63736 8.957607 31.56784 6.195112 -3.930479      10.89120 
1 1 1 -24 9  21 o 42.12007 4.636445 22.54008       4.680323 3.969837       10.40479 27.25077       5.240434 24.43242 10.28048 46.32793 4.707104 -21.89551      11.30686 
1 1 1 -24 9  22 o 34.82092 4.895890 15.59885       4.039821 9.839802       6.798188 18.74279       5.022900 26.87284 8.907200 37.93838 5.601236 -11.06554      10.52198 
1 1 1 -24 9  23 o 17.70703 6.470813 3.530261       3.636218 -1.153064      5.917083 6.372112       4.609259 16.43844 7.319736 22.08313 7.334810 -5.644693      10.36233 
1 1 1 -24 9  24 o 34.65828 4.842389 15.54073       3.978323 6.066945       6.384304 21.55470       5.086658 22.58640 8.512936 40.72210 5.247720 -18.13571      10.00043 
1 1 1 -24 9  25 o 13.42970 6.113461 -2.006766      4.395066 2.063585       6.082650 -6.453393      6.357586 18.72885 7.869256 14.17568 6.741346 4.553170       10.36199 
1 1 1 -24 9  26 o 32.91687 6.242220 14.72541       4.824015 23.19172       6.740089 5.833658       6.907361 41.01799 6.993650 22.40289 8.748376 18.61510       11.20023 
1 1 1 -24 9  27 o 44.12834 4.208199 24.93752       4.470595 12.40274       6.976640 33.67042       5.823271 28.76412 8.977361 51.01380 4.738451 -22.24968      10.15115 
1 1 1 -24 9  28 o 16.31398 6.282512 2.764960       3.524723 0.4602083      5.568315 4.305848       4.552996 16.67195 7.273447 19.07759 7.189352 -2.405643      10.22692 
1 1 1 -24 9  29 o 23.13716 6.399843 7.527549       3.729934 7.566574       6.202002 7.505435       4.668591 23.23889 8.457184 22.94287 7.366928 0.2960205      11.21586 
1 1 1 -24 9  30 o 17.85947 6.496442 4.007824       3.658985 7.097730       5.680107 1.816184       4.783751 22.40095 8.101893 16.58957 6.975029 5.811378       10.69073 
1 1 1 -24 9  31 o 12.23786 5.830472 -4.734037      4.800012 0.000000       0.000000 -4.734037      4.800012 ?        ?        12.23786 5.830472 0.000000       5.830472 
1 1 1 -24 9  32 o 14.36669 6.044794 1.242022       3.596946 2.249656       5.645490 0.5534663      4.666806 17.53471 7.483250 15.17327 6.638309 2.361439       10.00331 
1 1 1 -24 9  33 o 29.59219 5.892206 12.44832       4.099649 11.05804       6.360272 13.43650       5.362213 25.88497 8.616642 29.53483 7.451757 -3.649857      11.39189 
1 1 1 -24 9  34 o 19.35707 7.118142 5.314463       4.410885 3.015831       7.826025 6.384603       5.339823 19.33562 8.523221 20.77548 7.795079 -1.439861      11.55026 
1 1 1 -24 9  35 o 28.29531 7.027924 12.33179       4.824031 10.84392       6.445380 14.22679       7.273942 25.13319 8.671285 28.14936 9.208054 -3.016169      12.64830 
1 1 1 -24 10 1  o 58.38108 3.104102 42.09120       4.400281 49.47753       5.911242 32.91181       6.589785 63.08635 3.863627 50.89333 5.395515 12.19302       6.636203 
1 1 1 -24 10 2  o 40.47826 3.320673 20.32985       3.246777 24.72736       4.409958 15.12486       4.797791 44.46840 4.116264 34.14016 5.984940 10.32825       7.263824 
1 1 1 -24 10 3  o 130.4765 2.885466 209.2083       9.174542 239.2234       15.48094 192.9597       11.39028 138.5525 4.591420 124.8900 3.746812 13.66247       5.926191 
1 1 1 -24 10 4  o 91.66122 3.242498 103.5687       7.231306 106.0386       10.42248 101.2760       10.04138 92.18882 4.654406 90.12000 4.587408 2.068825       6.535120 
1 1 1 -24 10 5  o 47.10424 4.126425 27.68026       4.688847 21.59127       6.684440 33.57845       6.578882 40.64226 7.001863 51.54485 5.313636 -10.90259      8.789813 
1 1 1 -24 10 6  o 85.78171 3.228889 90.67236       6.737644 83.87701       9.539244 97.43710       9.517727 81.94605 4.797930 88.49933 4.427295 -6.553276      6.528482 
1 1 1 -24 10 7  o 66.74235 2.947925 54.82305       4.782789 65.56177       8.646825 50.08925       5.740974 72.37501 4.932133 63.59970 3.720446 8.775303       6.177998 
1 1 1 -24 10 8  f 81.25983 2.835904 81.15706       5.607086 80.98353       9.714526 81.24375       6.866271 80.45541 4.979247 81.12624 3.481251 -0.6708298     6.075525 
1 1 1 -24 10 9  o 42.90198 4.095407 22.97508       4.229746 17.65697       13.11262 23.59270       4.468614 36.02687 12.37053 43.43345 4.277390 -7.406582      13.08916 
1 1 1 -24 10 10 o 105.7322 2.778909 137.3020       7.153870 141.9795       12.47655 135.0109       8.731837 106.6825 4.811541 104.6292 3.429288 2.053375       5.908548 
1 1 1 -24 10 11 o 102.8997 2.765667 130.0526       6.928772 129.9813       11.99798 130.0883       8.487041 102.0371 4.838974 102.7061 3.395637 -0.6690598     5.911515 
1 1 1 -24 10 12 o 163.0692 3.050106 326.9614       12.12056 315.0910       20.08092 333.7643       15.20205 158.6401 5.201419 164.3495 3.795752 -5.709335      6.439137 
1 1 1 -24 10 13 o 75.10129 2.806165 69.36332       5.126633 64.41115       9.498202 71.39910       6.089890 71.43311 5.498682 76.06537 3.293189 -4.632263      6.409415 
1 1 1 -24 10 14 o 86.58779 3.074303 92.36620       6.476640 102.8230       10.73739 86.38580       8.120153 90.62183 4.880168 83.41367 4.006476 7.208168       6.314103 
1 1 1 -24 10 15 o 60.18493 3.109573 44.71296       4.545164 41.45844       10.07880 45.54379       5.092377 56.21393 7.548045 60.65037 3.459843 -4.436440      8.303222 
1 1 1 -24 10 16 o 82.26950 3.379383 83.67056       6.760625 92.04366       13.41860 80.82207       7.826556 84.65987 6.555228 80.62408 3.995998 4.035782       7.677175 
1 1 1 -24 10 17 o 62.37482 3.322424 48.16223       5.031888 58.43379       8.648315 42.90537       6.186945 67.94924 5.263911 58.52322 4.369767 9.426022       6.841318 
1 1 1 -24 10 18 o 15.75014 6.095856 2.186643       3.330494 6.444771       6.607469 0.7363165      3.856192 23.62222 8.707677 14.95898 6.274217 8.663239       10.73263 
1 1 1 -24 10 19 o 14.10084 5.814828 0.9537562      3.232649 0.6732481      6.380773 1.050613       3.749444 18.47758 7.922256 15.07274 6.243442 3.404831       10.08676 
1 1 1 -24 10 20 o 26.87835 5.691549 9.529747       3.611704 6.306709       6.602760 10.90585       4.314373 23.32644 8.684951 28.57993 6.358716 -5.253489      10.76390 
1 1 1 -24 10 21 o 59.01774 3.934169 43.64997       5.625806 52.06713       13.52533 41.88905       6.186357 60.83549 9.428217 57.59142 4.442304 3.244072       10.42235 
1 1 1 -24 10 22 o 13.93136 5.878746 0.5693533      3.417952 4.094169       5.934512 -1.180232      4.181040 20.53941 8.082623 13.74860 6.135457 6.790812       10.14754 
1 1 1 -24 10 23 f 32.09220 5.174792 13.45337       3.909342 13.93399       6.696962 13.20494       4.814848 31.18413 8.555857 31.21128 6.540101 -0.2714920E-01 10.76920 
1 1 1 -24 10 24 o 22.29138 7.230012 6.683648       4.489422 4.880919       6.200520 8.670021       6.508687 21.25462 8.291936 25.14673 8.711953 -3.892103      12.02723 
1 1 1 -24 10 25 o 19.56203 8.037827 3.115304       6.147614 3.115304       6.147614 0.000000       0.000000 19.56203 8.037827 ?        ?        0.000000       8.037827 
1 1 1 -24 10 26 o 23.69080 6.334795 7.748280       3.727935 12.31304       6.142152 5.085979       4.690728 28.99786 8.281509 20.20084 7.354447 8.797014       11.07571 
1 1 1 -24 10 27 o 41.16247 4.320178 21.81811       4.269002 12.96617       6.600819 28.18275       5.597136 29.41277 8.640871 46.41400 5.028825 -17.00124      9.997686 
1 1 1 -24 10 28 o 12.91855 5.667583 -0.2533498     3.422834 -0.7144098     5.469398 0.4347007E-01  4.388411 15.69191 7.009023 14.73070 6.441146 0.9612083      9.519179 
1 1 1 -24 10 29 o 47.38806 4.061735 28.88534       4.645279 24.89451       7.088040 31.88993       6.150170 41.71465 7.234853 48.98587 5.233010 -7.271221      8.929026 
1 1 1 -24 10 30 o 15.67011 6.444261 1.928434       3.956063 2.666033       7.316351 1.623677       4.702849 19.53209 8.429938 16.27304 6.882759 3.259045       10.88284 
1 1 1 -24 10 31 o 13.95090 6.240557 -0.5858115     4.352821 -11.96167      9.438205 2.487493       4.905690 15.37016 7.522611 17.12205 7.121147 -1.751888      10.35859 
1 1 1 -24 10 32 o 26.13681 6.316122 9.926369       3.977730 8.849936       6.319477 10.63268       5.119019 23.68659 8.548569 26.20532 7.584286 -2.518728      11.42801 
1 1 1 -24 10 33 o 16.19305 6.657170 2.467808       4.220021 -2.350233      8.194416 4.206817       4.923043 17.06933 7.972295 18.47227 7.332548 -1.402939      10.83161 
1 1 1 -24 10 34 o 15.36745 6.288844 2.227744       3.744061 10.00122       6.098212 -2.475218      4.743299 24.49732 8.435247 13.07196 6.092076 11.42536       10.40513 
1 1 1 -24 11 1  o 24.83037 5.459842 8.064541       3.213581 9.313395       3.923546 5.519295       5.601286 26.54267 6.181563 22.01091 8.033092 4.531763       10.13619 
1 1 1 -24 11 2  o 23.46676 5.725684 7.229486       3.244833 5.675368       3.677590 12.69166       6.894522 21.02399 6.510913 30.48874 8.795172 -9.464748      10.94290 
1 1 1 -24 11 3  o 27.17244 6.217321 9.729612       4.027492 2.739934       5.993119 15.48575       5.438634 19.78130 8.007987 34.26553 6.753458 -14.48423      10.47554 
1 1 1 -24 11 4  o 86.76118 2.862562 92.62833       6.043958 95.44036       10.16058 91.08845       7.518845 87.30468 4.794187 85.78998 3.604518 1.514702       5.998065 
1 1 1 -24 11 5  o 41.03885 3.808363 21.00410       3.765186 19.17200       6.626619 21.87758       4.575528 38.01960 7.418778 41.68229 4.579933 -3.662685      8.718604 
1 1 1 -24 11 6  f 51.08438 3.391792 32.31086       4.198429 25.09973       7.329042 35.83305       5.122150 43.78359 7.113001 53.66228 3.944504 -9.878693      8.133504 
1 1 1 -24 11 7  o 25.70692 6.222493 8.687968       3.855768 26.76813       12.88941 6.911036       4.040802 43.07297 11.89029 23.03611 6.758862 20.03686       13.67703 
1 1 1 -24 11 8  o 71.03779 2.935657 62.12848       5.071003 60.34100       8.815688 63.01240       6.199306 69.22109 5.265657 71.36511 3.576079 -2.144020      6.365177 
1 1 1 -24 11 9  o 49.71437 3.771319 30.71688       4.534812 25.74598       13.41914 31.35774       4.818276 42.11745 12.30577 50.17980 3.972669 -8.062351      12.93112 
1 1 1 -24 11 10 o 90.15218 2.826708 99.93547       6.202349 85.95419       10.81577 106.7860       7.570880 82.60189 5.402832 93.02624 3.345126 -10.42435      6.354562 
1 1 1 -24 11 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -24 11 12 o 18.63428 5.980534 4.321024       3.077021 12.07907       6.525421 2.102756       3.489309 29.90339 8.534639 15.93859 6.219648 13.96480       10.56050 
1 1 1 -24 11 13 o 58.36454 3.186635 42.08546       4.515093 46.67142       10.50266 41.04576       5.000788 59.77913 7.365186 57.53174 3.584743 2.247391       8.191236 
1 1 1 -24 11 14 o 18.97036 6.423656 4.340735       3.533632 6.657213       7.787604 3.740139       3.965345 24.77699 9.387844 18.54661 6.760456 6.230379       11.56872 
1 1 1 -24 11 15 o 40.95098 4.328562 21.09622       4.254308 26.48961       7.635695 18.66826       5.123173 44.80862 7.239524 38.05578 5.699537 6.752838       9.213872 
1 1 1 -24 11 16 o 41.71016 3.625506 21.69446       3.648506 26.06218       7.574547 20.37494       4.163310 44.36814 7.256261 40.21967 4.315196 4.148472       8.442408 
1 1 1 -24 11 17 o 61.56005 2.992018 46.81932       4.475038 44.47887       8.629505 47.68022       5.233762 58.73311 6.118918 61.97560 3.479402 -3.242485      7.038991 
1 1 1 -24 11 18 o 46.44843 3.860449 27.00076       4.330172 21.07526       7.514303 29.94673       5.298348 39.25400 8.123364 48.70372 4.515604 -9.449722      9.294069 
1 1 1 -24 11 19 o 24.59017 6.086831 8.057551       3.627704 0.2563823      6.890035 11.04963       4.267053 18.75271 8.136947 28.79985 6.259104 -10.04714      10.26578 
1 1 1 -24 11 20 o 20.36067 6.443781 5.373172       3.582234 5.481024       6.698970 5.329981       4.239260 22.53485 8.665560 20.63130 7.035159 1.903553       11.16178 
1 1 1 -24 11 21 o 25.17321 6.562938 8.582678       4.066668 -2.337374      10.23646 10.62912       4.431367 20.77114 9.405740 28.00839 6.601256 -7.237244      11.49106 
1 1 1 -24 11 22 o 55.34362 3.502931 38.30560       4.700036 45.96778       8.363477 34.76883       5.682159 59.33825 5.860266 52.27768 4.504144 7.060570       7.391213 
1 1 1 -24 11 23 o 25.93459 7.266959 9.354992       4.775534 8.633049       6.882761 10.02519       6.631495 25.24854 8.943005 26.64990 8.795913 -1.401363      12.54374 
1 1 1 -24 11 24 o 13.85761 6.143982 -0.7450912     4.123789 0.5549846E-01  6.149248 -1.399397      5.559137 17.31983 7.597578 15.60057 7.009671 1.719264       10.33725 
1 1 1 -24 11 25 o 22.13574 7.232382 6.682927       4.488038 9.412768       5.919022 2.990707       6.883749 25.64795 8.300385 20.07278 8.398506 5.575167       11.80810 
1 1 1 -24 11 26 o 32.41135 5.153304 13.89993       3.934118 8.672085       6.253528 17.32419       5.061122 24.71974 8.540687 35.78275 6.017464 -11.06301      10.44764 
1 1 1 -24 11 27 o 42.79534 4.190558 23.54524       4.314276 19.41149       6.874022 26.23182       5.541640 36.46035 7.960408 44.59025 5.197226 -8.129906      9.506801 
1 1 1 -24 11 28 o 58.29375 3.626523 43.11000       5.126162 32.80182       8.008803 50.26398       6.671910 48.31005 7.007182 62.37736 4.417801 -14.06731      8.283572 
1 1 1 -24 11 29 f 21.16222 6.760497 6.323468       3.935337 -0.4855295     6.072575 11.25351       5.167216 16.40867 7.353150 27.52935 7.500148 -11.12069      10.50338 
1 1 1 -24 11 30 o 13.28143 5.913394 -0.5198701     3.860832 -2.073353      7.152048 0.1189976      4.586513 16.60021 7.646525 14.84915 6.536025 1.751060       10.05927 
1 1 1 -24 11 31 o 64.71962 4.115535 54.45161       6.457177 34.80166       13.00926 60.87525       7.438106 41.84838 12.08426 68.01691 4.513076 -26.16853      12.89951 
1 1 1 -24 11 32 o 13.75362 6.058902 0.8816598E-01  3.949044 -10.88785      7.358225 4.528553       4.680164 13.29479 6.534351 18.72791 7.232168 -5.433117      9.746897 
1 1 1 -24 11 33 o 28.20834 6.347978 11.67724       4.257909 -0.2779836     6.820675 19.31133       5.450385 16.74841 7.620952 36.49152 6.360213 -19.74310      9.926290 
1 1 1 -24 11 34 o 10.87432 5.139236 -3.022397      3.585202 2.068310       6.296980 -5.464132      4.361065 17.55620 7.695150 10.98190 5.314850 6.574291       9.352163 
1 1 1 -24 12 1  o 51.35003 3.093418 32.64516       3.852980 33.94297       5.296267 31.18612       5.615620 52.01852 4.214125 49.67570 4.694618 2.342827       6.308588 
1 1 1 -24 12 2  o 77.75425 2.969840 74.58592       5.616867 71.03770       7.510324 79.08965       8.461341 75.45763 4.099715 79.49897 4.384566 -4.041344      6.002674 
1 1 1 -24 12 3  o 50.94557 3.857933 32.36815       4.753976 38.69419       7.414769 27.95255       6.194785 55.06327 5.603854 46.74355 5.546345 8.319725       7.884486 
1 1 1 -24 12 4  o 46.50558 3.693802 26.93469       4.151784 31.16141       7.352758 24.95626       5.030479 49.10016 6.289366 44.45008 4.715962 4.650078       7.861070 
1 1 1 -24 12 5  o 44.17251 3.618674 24.28527       3.861156 22.65505       6.862105 25.04053       4.670700 41.47695 7.040611 44.65464 4.347157 -3.177685      8.274537 
1 1 1 -24 12 6  o 23.47812 5.949327 7.245725       3.407446 7.256408       6.435075 7.241563       4.016780 24.45797 8.648743 23.46776 6.695485 0.9902096      10.93756 
1 1 1 -24 12 7  o 68.69668 2.997972 58.18390       5.006711 55.74725       8.805188 59.34813       6.086388 66.32934 5.496813 69.19666 3.622039 -2.867325      6.582865 
1 1 1 -24 12 8  o 41.08954 4.273366 21.19847       4.216518 18.95650       12.50722 21.48595       4.478704 36.51418 12.08083 41.29749 4.524300 -4.783310      12.90022 
1 1 1 -24 12 9  o 37.43767 4.071992 17.58351       3.655158 15.84413       7.044774 18.22424       4.275702 34.08519 8.508428 37.93719 4.727215 -3.852001      9.733442 
1 1 1 -24 12 10 o 48.92082 3.766400 29.78838       4.455559 20.45605       13.73759 30.88547       4.710178 37.68242 12.66560 49.77709 3.914515 -12.09467      13.25673 
1 1 1 -24 12 11 o 68.85307 3.099776 58.50581       5.187697 54.77225       11.67086 59.42513       5.791270 64.64137 7.551022 69.29164 3.440466 -4.650269      8.297875 
1 1 1 -24 12 12 o 69.86868 3.087893 60.24696       5.244531 62.97459       11.75181 59.56863       5.860490 69.64908 7.019605 69.35497 3.478636 0.2941132      7.834269 
1 1 1 -24 12 13 o 22.49102 6.625258 6.619136       3.876093 4.423186       8.216051 7.247805       4.396052 23.27405 9.392612 23.51102 7.087484 -0.2369785     11.76663 
1 1 1 -24 12 14 o 62.78451 4.113475 49.22427       6.258914 42.61922       8.712150 56.26929       8.997635 57.45130 6.327507 66.47607 5.606481 -9.024773      8.453991 
1 1 1 -24 12 15 o 42.26701 3.703781 22.30991       3.776384 26.38938       7.710661 21.02259       4.331429 44.54992 7.359182 40.80755 4.426476 3.742367       8.587855 
1 1 1 -24 12 16 o 55.53527 3.107914 38.18156       4.189265 34.00099       8.186870 39.66451       4.875996 50.92016 6.764899 56.46883 3.561527 -5.548676      7.645152 
1 1 1 -24 12 17 o 38.67666 4.419293 18.95090       4.090543 23.32143       7.357177 16.99531       4.921329 41.60748 7.533386 36.11406 5.787425 5.493427       9.499799 
1 1 1 -24 12 18 o 101.6861 2.718032 127.4659       6.729190 143.5508       12.58462 121.0254       7.963236 106.5810 4.858110 98.80437 3.312010 7.776672       5.879681 
1 1 1 -24 12 19 o 55.07636 3.527512 37.83686       4.709565 47.91464       8.428004 33.26123       5.678945 60.90073 5.746880 51.20692 4.599924 9.693806       7.361109 
1 1 1 -24 12 20 o 18.00056 6.335058 3.859413       3.449467 10.89873       6.543519 1.150398       4.059307 27.89898 8.692210 15.54799 6.473050 12.35099       10.83766 
1 1 1 -24 12 21 o 13.43460 5.844377 -0.2040376     3.573455 -12.69449      10.13016 1.571108       3.818952 16.80325 8.124464 15.57457 6.359890 1.228673       10.31771 
1 1 1 -24 12 22 o 20.75529 7.332994 5.415751       4.625235 0.8319100      6.783625 9.397968       6.322801 18.68170 8.090116 25.94288 8.589805 -7.261187      11.79978 
1 1 1 -24 12 23 o 12.36330 5.721505 -2.749902      4.072411 -6.435873      6.312735 -0.1224698     5.329757 14.10043 6.708961 16.15169 7.079534 -2.051264      9.753459 
1 1 1 -24 12 24 o 24.35177 6.326631 8.169306       3.787872 7.949435       6.416919 8.286892       4.692677 24.14798 8.626513 24.31290 7.321256 -0.1649170     11.31448 
1 1 1 -24 12 25 o 57.29433 4.272590 41.96839       5.922443 33.61487       7.779662 53.48226       9.133484 49.67775 6.588617 63.34175 5.988206 -13.66399      8.903285 
1 1 1 -24 12 26 o 27.36988 6.007900 10.29782       3.896993 4.835887       6.092697 14.07946       5.069631 20.73707 8.180644 31.68913 6.770507 -10.95206      10.61898 
1 1 1 -24 12 27 o 28.57787 5.831592 11.19981       3.923533 10.12187       6.308630 11.87976       5.010437 26.00946 8.578882 28.70876 7.180761 -2.699299      11.18752 
1 1 1 -24 12 28 o 15.72658 6.328854 2.187948       3.718831 7.381197       6.128721 -0.8384543     4.678575 22.86184 8.393274 14.40045 6.453641 8.461382       10.58757 
1 1 1 -24 12 29 o 56.10260 4.131439 40.70068       5.608716 30.71886       9.967681 45.32542       6.784727 43.48506 9.657646 58.64933 4.788805 -15.16426      10.77974 
1 1 1 -24 12 30 o 12.87586 5.706789 -0.3495681     3.554842 4.752419       5.822314 -3.381832      4.488585 19.83327 7.940487 12.38660 5.821954 7.446671       9.846140 
1 1 1 -24 12 31 o 16.71569 6.730156 2.904187       4.207586 -11.40250      9.819059 6.122101       4.656800 15.69903 7.681314 20.59213 7.349619 -4.893098      10.63106 
1 1 1 -24 12 32 o 17.73330 6.649886 4.100306       3.884946 5.537011       6.361528 3.245809       4.906060 20.42069 8.256354 17.54415 7.191453 2.876547       10.94917 
1 1 1 -24 12 33 o 14.54191 6.103578 1.523175       3.653254 -4.540485      6.269502 4.640509       4.495286 14.06314 6.689723 18.56750 7.109071 -4.504361      9.761725 
1 1 1 -24 13 1  o 92.46219 2.708282 105.3636       6.095732 111.1626       9.033221 100.5149       8.259921 94.38464 3.936039 89.82452 3.781967 4.560127       5.458542 
1 1 1 -24 13 2  o 42.92964 4.228674 23.21599       4.366451 22.02738       8.392035 23.65723       5.113072 39.75449 8.886207 43.08028 4.960900 -3.325790      10.17719 
1 1 1 -24 13 3  o 28.33464 6.030477 10.60209       4.036014 9.939848       6.484441 11.02089       5.156610 27.18541 8.677375 28.53411 7.365809 -1.348705      11.38209 
1 1 1 -24 13 4  o 15.27509 5.939778 1.995844       3.173459 1.557907       5.758954 2.186814       3.802947 18.41227 7.691167 16.41082 6.466470 2.001451       10.04835 
1 1 1 -24 13 5  o 62.47891 3.125716 48.26222       4.743922 68.31712       8.707715 39.79756       5.657164 73.63952 4.879934 56.40401 4.144727 17.23550       6.402540 
1 1 1 -24 13 6  o 13.62922 5.688445 0.6405607      3.146369 9.340923       6.295835 -2.255759      3.632519 26.56362 8.557399 12.03304 5.508183 14.53058       10.17689 
1 1 1 -24 13 7  o 16.77641 6.134663 3.005669       3.269023 -5.247036      6.130807 6.284169       3.864178 14.69871 6.875112 21.97301 6.649477 -7.274304      9.564659 
1 1 1 -24 13 8  o 45.90768 3.597672 26.23290       3.992660 33.21406       7.776119 23.73352       4.652806 50.60642 6.452047 43.40245 4.462622 7.203968       7.844992 
1 1 1 -24 13 9  o 41.48925 4.032326 21.57523       4.025512 24.18171       8.978345 20.91943       4.503544 41.85463 9.065493 40.67027 4.626156 1.184368       10.17765 
1 1 1 -24 13 10 o 82.15399 3.439934 83.56548       6.871521 0.000000       0.000000 83.56548       6.871521 ?        ?        82.15399 3.439934 0.000000       3.439934 
1 1 1 -24 13 11 o 21.24764 6.783445 5.770126       3.962593 -0.9730794E-01 7.721262 7.868036       4.616975 19.66713 8.572782 24.37552 7.243730 -4.708393      11.22338 
1 1 1 -24 13 12 o 56.83372 3.654163 40.18157       5.034110 49.19742       8.821575 35.82770       6.130282 61.93400 5.916789 53.26409 4.773471 8.669907       7.602264 
1 1 1 -24 13 13 o 53.29609 3.255778 35.21415       4.208323 42.97874       8.500766 32.69347       4.843481 57.71017 6.138716 51.14878 3.915621 6.561386       7.281204 
1 1 1 -24 13 14 o 48.36197 3.374362 29.07090       3.951834 29.78313       8.114723 28.84946       4.524633 47.35020 7.264120 48.01877 3.900213 -0.6685677     8.244944 
1 1 1 -24 13 15 o 57.27049 3.657388 40.87184       5.077648 35.93589       8.476409 43.63436       6.341317 52.27403 6.816306 58.87242 4.453115 -6.598389      8.142006 
1 1 1 -24 13 16 o 63.25365 3.005398 49.50489       4.619338 51.57121       9.105171 48.78872       5.360408 63.17590 5.985655 62.61392 3.527366 0.5619774      6.947689 
1 1 1 -24 13 17 o 95.59930 2.778764 112.7728       6.466681 94.64815       11.46138 121.2371       7.832439 86.00482 5.497403 98.89568 3.254434 -12.89086      6.388488 
1 1 1 -24 13 18 o 58.27021 3.153977 42.15970       4.461896 35.54464       8.707119 44.51540       5.195975 51.55783 7.120033 59.71880 3.586958 -8.160961      7.972524 
1 1 1 -24 13 19 o 35.18497 4.219789 15.75087       3.546032 23.55582       7.523707 13.52197       4.020603 41.36575 7.748376 32.16835 5.314331 9.197403       9.395715 
1 1 1 -24 13 20 o 16.21688 6.270850 2.496368       3.522102 10.76828       6.996650 -0.3113104     4.076250 27.60526 9.030884 14.21186 6.211195 13.39341       10.96065 
1 1 1 -24 13 21 o 26.59177 6.700690 9.725706       4.339696 18.48030       12.04160 8.418909       4.652328 34.02322 11.84623 24.67356 7.255800 9.349663       13.89172 
1 1 1 -24 13 22 o 39.45557 5.550205 20.53116       5.189155 18.23496       7.346221 22.81781       7.330947 35.36415 8.606950 40.28263 7.749347 -4.918476      11.58154 
1 1 1 -24 13 23 o 52.55042 3.738151 34.87848       4.755808 29.32399       7.923586 38.00629       5.945926 45.96261 7.319506 54.43126 4.523494 -8.468643      8.604486 
1 1 1 -24 13 24 o 16.67355 6.304639 3.010656       3.508106 1.832055       5.962807 3.634567       4.338387 18.24363 7.734680 18.23754 6.983612 0.6088257E-02  10.42095 
1 1 1 -24 13 25 o 13.11704 5.949444 -1.589221      4.115792 -9.399007      5.869122 5.967581       5.773280 12.21283 5.967678 21.64598 8.108696 -9.433143      10.06798 
1 1 1 -24 13 26 o 59.08438 3.557697 44.16035       5.098720 31.80605       7.738786 53.63680       6.777761 47.81097 6.836550 64.57570 4.332124 -16.76473      8.093559 
1 1 1 -24 13 27 o 20.82799 6.584875 6.050972       3.741692 4.608019       6.251711 6.856347       4.670589 20.38354 8.204809 22.01730 7.384954 -1.633757      11.03886 
1 1 1 -24 13 28 o 56.16860 4.118339 40.72861       5.597864 29.63010       10.03127 45.74783       6.745933 42.54688 9.867002 59.02711 4.729339 -16.48024      10.94186 
1 1 1 -24 13 29 o 17.63123 6.815441 3.636873       4.159378 2.757242       7.847995 3.980468       4.904912 19.81439 8.639814 18.56215 7.334620 1.252245       11.33327 
1 1 1 -24 13 30 o 36.71215 5.081197 18.26827       4.424082 9.248272       7.085804 24.03087       5.663637 24.11986 8.993765 41.63293 5.734586 -17.51308      10.66646 
1 1 1 -24 13 31 o 17.91125 7.072370 3.842347       4.557473 -18.59130      10.71146 8.801218       5.036052 14.81327 7.384834 23.77926 7.652867 -8.965985      10.63495 
1 1 1 -24 13 32 o 11.71836 5.381990 -1.557977      3.507117 -2.994472      6.203026 -0.8830235     4.251953 14.71816 6.894317 13.38973 6.062720 1.328430       9.180860 
1 1 1 -24 13 33 o 14.17774 6.084809 1.016702       3.771209 -3.820552      6.343232 3.661202       4.690109 14.42157 6.821729 17.61071 7.100273 -3.189146      9.846313 
1 1 1 -24 14 1  o 13.55576 5.291681 1.535760       2.526504 2.844310       3.368719 -0.1465533     3.819645 16.55567 6.195619 13.98434 6.063237 2.571325       8.668826 
1 1 1 -24 14 2  o 82.33228 3.199387 84.01309       6.406865 76.69711       12.21561 86.78925       7.524902 76.58112 6.610366 83.44217 3.709936 -6.861046      7.580275 
1 1 1 -24 14 3  o 57.52591 4.010818 41.46513       5.587320 38.41401       9.706209 42.97723       6.832965 53.47440 7.667574 58.19981 4.862220 -4.725410      9.079255 
1 1 1 -24 14 4  o 30.18072 5.007301 11.76748       3.553718 11.92468       6.434135 11.69847       4.262941 29.35583 8.504908 29.72662 6.089705 -0.3707867     10.46030 
1 1 1 -24 14 5  f 39.01254 4.089845 19.16891       3.830459 13.38172       6.804079 21.85404       4.634664 31.02308 8.667390 41.48861 4.664824 -10.46553      9.842978 
1 1 1 -24 14 6  o 24.90857 6.027986 8.232604       3.619067 0.4674953      7.771767 10.38268       4.089530 19.97474 8.654669 27.97602 6.165124 -8.001286      10.62601 
1 1 1 -24 14 7  o 36.31264 4.544106 16.74779       3.933287 20.04785       8.814054 15.92720       4.395188 37.60027 9.590409 35.14796 5.295757 2.452312       10.95541 
1 1 1 -24 14 8  f 34.58683 5.479602 15.48601       4.464688 19.85013       8.713393 13.93230       5.199050 37.45234 9.526283 32.28688 6.821876 5.165459       11.71700 
1 1 1 -24 14 9  o 19.47256 6.635983 4.629062       3.771740 9.865004       6.981941 2.471372       4.482015 27.19617 9.027193 17.59481 6.992466 9.601357       11.41862 
1 1 1 -24 14 10 o 37.89492 5.402572 18.50729       4.847938 37.79590       12.45183 15.06111       5.263227 51.49511 10.28296 33.65476 6.653448 17.84035       12.24776 
1 1 1 -24 14 11 o 62.00052 3.406849 47.72446       5.127574 53.15820       14.43606 46.93996       5.485248 61.48754 9.976001 61.39127 3.683456 0.9626770E-01  10.63431 
1 1 1 -24 14 12 o 18.82634 6.074684 4.474017       3.171772 9.712641       7.305476 3.257174       3.520928 27.06679 9.235224 17.34271 6.362606 9.724075       11.21482 
1 1 1 -24 14 13 o 23.72899 5.838854 7.468116       3.352928 9.387115       7.051344 6.907461       3.811382 26.61943 9.073368 22.79833 6.527723 3.821104       11.17753 
1 1 1 -24 14 14 o 43.39527 3.731726 23.58215       3.907995 30.36943       8.065302 21.49968       4.467471 47.73341 7.153754 41.15684 4.529119 6.576569       8.466942 
1 1 1 -24 14 15 o 42.76899 4.323787 23.14021       4.444572 23.08054       7.721071 23.16979       5.435444 41.00165 8.014912 42.37858 5.384642 -1.376934      9.655732 
1 1 1 -24 14 16 o 25.05801 5.497427 8.304772       3.264459 9.277884       7.083329 8.042348       3.678388 26.34017 9.090179 24.49005 6.167922 1.850124       10.98520 
1 1 1 -24 14 17 o 76.16392 2.851150 71.75426       5.282482 62.46901       9.693625 75.67638       6.300126 69.45779 5.779341 78.01391 3.321514 -8.556114      6.665826 
1 1 1 -24 14 18 o 77.44011 2.862692 74.24609       5.392976 56.62624       9.712688 82.09961       6.484412 65.75149 6.132467 81.23772 3.282252 -15.48623      6.955597 
1 1 1 -24 14 19 o 44.65538 4.327675 25.37353       4.650421 13.91563       7.793631 31.70864       5.795148 30.80021 9.467798 49.70707 4.845657 -18.90686      10.63577 
1 1 1 -24 14 20 o 127.8029 3.697397 204.7254       11.50313 183.1441       20.60116 214.5022       13.86605 116.2689 7.307929 130.0938 4.380058 -13.82486      8.520020 
1 1 1 -24 14 21 o 24.75084 7.934135 8.577686       5.416806 22.32248       11.92334 5.003132       6.080509 36.69799 11.77211 21.17705 8.225520 15.52095       14.36112 
1 1 1 -24 14 22 o 55.01764 3.600686 38.12533       4.800983 26.95251       7.573133 45.63278       6.207838 44.02585 7.315440 59.81470 4.287324 -15.78886      8.479198 
1 1 1 -24 14 23 o 48.24027 3.896295 29.56109       4.541398 23.59405       7.377179 33.20226       5.762770 40.74439 7.712307 50.67248 4.721165 -9.928093      9.042625 
1 1 1 -24 14 24 o 20.43450 6.451608 5.682327       3.592899 1.965548       6.021358 7.737319       4.477300 18.32031 7.770104 23.42254 7.171647 -5.102234      10.57388 
1 1 1 -24 14 25 o 10.32757 5.008656 -5.849332      3.925431 -9.026339      5.587512 -2.753155      5.515975 11.88148 5.809397 14.52787 6.700315 -2.646395      8.868107 
1 1 1 -24 14 26 o 15.45708 6.230201 2.035860       3.609956 0.1823073      5.982708 3.097109       4.526931 16.82329 7.432395 17.60604 7.017416 -0.7827511     10.22177 
1 1 1 -24 14 27 o 14.36260 6.144889 0.7381690      3.823929 1.327156       7.412386 0.5245727      4.463772 18.83866 8.299902 15.08139 6.546633 3.757265       10.57104 
1 1 1 -24 14 28 o 48.05829 4.603778 30.39858       5.325767 23.53501       10.06040 33.07096       6.277534 36.39209 10.66115 49.58224 5.276442 -13.19016      11.89541 
1 1 1 -24 14 29 o 18.37899 6.712708 4.470024       3.912368 1.185965       6.502584 6.333385       4.898116 17.60133 7.763539 20.98794 7.532204 -3.386602      10.81696 
1 1 1 -24 14 30 o 46.01679 4.246663 27.83216       4.708429 23.54746       7.529075 30.58404       6.033884 38.66644 8.242489 47.30311 5.326961 -8.636673      9.814028 
1 1 1 -24 14 31 o 11.72938 5.494074 -2.721401      3.938524 -1.394401      9.346362 -3.007922      4.342955 18.34336 8.549705 12.22758 5.740752 6.115775       10.29824 
1 1 1 -24 14 32 o 21.20024 6.675632 6.748545       3.849141 9.175014       6.429454 5.393055       4.805458 23.53591 8.603855 19.50480 7.378060 4.031109       11.33411 
1 1 1 -24 15 1  o 46.09303 3.279882 26.50498       3.660014 27.92237       4.988672 24.85267       5.386244 46.88097 4.418812 43.89502 5.132164 2.985943       6.772371 
1 1 1 -24 15 2  o 32.09139 5.114402 13.38065       3.865492 7.698285       7.487356 15.44557       4.513514 24.91195 9.253589 34.33652 5.585971 -9.424572      10.80888 
1 1 1 -24 15 3  o 38.86311 4.310998 19.17149       4.014142 22.66737       8.418504 18.14278       4.566720 40.01497 8.866676 37.48518 5.134049 2.529789       10.24580 
1 1 1 -24 15 4  o 39.90790 5.097055 20.48870       4.843960 4.684783       8.327771 28.56976       5.954984 23.13898 9.413096 47.13592 5.274669 -23.99694      10.79020 
1 1 1 -24 15 5  o 33.15670 5.900752 14.47251       4.592990 17.91788       8.751912 13.16294       5.395731 35.15247 9.833303 31.06508 7.258948 4.087383       12.22236 
1 1 1 -24 15 6  o 26.31450 6.209394 9.259274       3.917143 5.381351       6.386870 11.59748       4.959409 22.24327 8.484271 29.22550 7.046315 -6.982231      11.02875 
1 1 1 -24 15 7  o 37.12580 4.773796 17.62253       4.219086 18.90717       6.792596 16.81559       5.383495 37.18357 7.748043 35.59705 6.443177 1.586525       10.07704 
1 1 1 -24 15 8  o 14.83045 5.876142 1.708357       3.156149 3.791174       6.606472 1.092414       3.592642 21.04459 8.447062 14.82349 6.123136 6.221094       10.43291 
1 1 1 -24 15 9  o 72.59351 2.947212 65.14999       5.202851 59.95219       9.470543 67.39687       6.226650 68.26781 5.746046 73.62879 3.480179 -5.360985      6.717789 
1 1 1 -24 15 10 o 16.97434 6.318560 3.027817       3.494475 -14.73453      10.79678 5.106241       3.693270 17.15958 8.318401 20.03948 6.561644 -2.879902      10.59486 
1 1 1 -24 15 11 o 18.00724 6.194335 3.914703       3.288223 4.932769       6.993883 3.625800       3.725682 22.32210 8.777382 18.00043 6.554242 4.321663       10.95448 
1 1 1 -24 15 12 o 22.54256 6.000817 6.767215       3.354557 2.647504       7.218818 7.901852       3.788447 20.71037 8.627974 24.27456 6.337325 -3.564192      10.70531 
1 1 1 -24 15 13 o 13.16159 5.561863 0.4194001      3.066537 2.314166       7.200126 -0.4510509E-03 3.389300 20.41777 8.569181 13.34285 5.748000 7.074922       10.31845 
1 1 1 -24 15 14 o 60.97054 3.113242 46.13166       4.610298 38.96229       8.624702 48.99976       5.455073 54.28526 6.658988 62.65790 3.587631 -8.372639      7.563942 
1 1 1 -24 15 15 o 18.68820 6.547904 4.217129       3.682362 6.092659       6.658906 3.390918       4.419635 22.94689 8.683990 18.35114 7.043247 4.595757       11.18119 
1 1 1 -24 15 16 o 14.22756 5.691653 1.494500       2.988993 3.704740       6.318516 0.8573027      3.392597 20.48961 8.248172 14.16557 5.909154 6.324039       10.14645 
1 1 1 -24 15 17 o 40.71014 3.821486 20.91438       3.746822 20.86727       7.509395 20.92999       4.323440 38.42522 8.265121 40.47927 4.456539 -2.054050      9.390046 
1 1 1 -24 15 18 o 44.53923 4.175066 25.19980       4.478676 15.12613       7.372413 31.09190       5.638333 32.13033 9.038470 49.22290 4.759854 -17.09257      10.21519 
1 1 1 -24 15 19 o 56.08792 3.825993 39.67528       5.198061 25.31255       8.440152 48.45209       6.597817 41.96044 8.544851 61.66676 4.419800 -19.70632      9.620245 
1 1 1 -24 15 20 o 11.93345 5.420504 -1.592156      3.431775 -4.668882      6.644167 -0.4726875     4.007764 15.31331 7.160817 13.86734 6.106589 1.445968       9.411042 
1 1 1 -24 15 21 o 55.76768 4.183913 39.62801       5.644475 26.28256       11.88606 43.51389       6.413816 39.69511 11.57686 58.21816 4.557160 -18.52305      12.44152 
1 1 1 -24 15 22 o 15.95376 6.630956 1.550456       4.249628 4.718030       5.854092 -1.978266      6.178810 20.57130 8.047784 15.98128 7.264702 4.590023       10.84171 
1 1 1 -24 15 23 o 32.35088 5.165673 13.89064       3.935493 20.94286       6.737664 10.23859       4.848582 38.34970 7.478329 26.73661 7.257347 11.61309       10.42087 
1 1 1 -24 15 24 o 15.79126 6.210502 2.387864       3.501962 5.199453       5.971192 0.9137917      4.323589 20.89601 8.141405 15.36581 6.552952 5.530203       10.45101 
1 1 1 -24 15 25 o 22.91122 7.318553 7.521317       4.611933 2.242104       6.446825 13.05505       6.600403 18.72455 7.994044 29.10114 8.664204 -10.37659      11.78869 
1 1 1 -24 15 26 o 23.53844 6.906385 8.012816       4.219085 1.220518       7.621303 11.01423       5.066214 18.97318 8.385152 27.26586 7.425710 -8.292681      11.20053 
1 1 1 -24 15 27 o 33.45313 5.909128 15.54434       4.641109 12.66645       9.199400 16.52691       5.375319 27.37254 10.23946 33.91433 6.741578 -6.541788      12.25950 
1 1 1 -24 15 28 o 12.59090 5.675235 -0.9424997     3.676658 -3.338603      6.316573 0.2852678      4.521544 14.93173 6.982276 14.80740 6.504570 0.1243315      9.542621 
1 1 1 -24 15 29 o 12.46494 5.621052 -0.8946553     3.611575 0.9812935      6.183198 -1.866088      4.449477 17.06788 7.547463 13.13384 6.043056 3.934038       9.668647 
1 1 1 -24 15 30 f 10.80483 5.094837 -2.936387      3.487006 -5.667009      5.705013 -1.307868      4.405776 12.96758 6.225882 13.37114 6.099947 -0.4035664     8.716132 
1 1 1 -24 15 31 o 44.58777 4.937471 27.02661       5.275040 13.04981       11.49143 30.75808       5.937585 25.89356 10.84375 47.28981 5.240199 -21.39624      12.04352 
1 1 1 -24 16 1  o 17.41101 6.801472 2.885284       4.176282 0.6111394      6.387195 4.583602       5.519640 18.08311 7.840464 20.47563 7.867906 -2.392521      11.10751 
1 1 1 -24 16 2  o 56.06759 4.259851 39.82334       5.776700 31.18020       9.482889 44.92323       7.284258 46.92414 8.610134 59.08677 5.109080 -12.16262      10.01185 
1 1 1 -24 16 3  o 28.07880 6.713004 10.76451       4.531016 18.90801       8.020191 6.946877       5.491313 36.09783 9.116544 23.09293 8.002065 13.00489       12.13031 
1 1 1 -24 16 4  o 39.78085 6.591477 21.18101       6.166318 19.59344       8.487207 22.95596       8.974133 36.63613 9.445909 39.74419 9.411991 -3.108063      13.33457 
1 1 1 -24 16 5  o 39.75053 4.016599 19.97206       3.837467 28.41158       7.123105 16.52098       4.554991 46.28178 6.494164 35.58663 5.423689 10.69515       8.461121 
1 1 1 -24 16 6  o 57.14704 3.302901 40.65603       4.580059 35.42200       8.078112 43.13563       5.560095 51.74506 6.552989 58.62115 3.914603 -6.876095      7.633203 
1 1 1 -24 16 7  o 44.26690 3.628787 24.55532       3.880174 29.08200       7.520740 22.91332       4.529575 46.69992 6.808850 42.45914 4.443466 4.240780       8.130487 
1 1 1 -24 16 8  f 47.36324 3.551792 28.05423       4.069586 23.08801       7.608190 30.04461       4.816544 40.92415 7.915245 48.82508 4.085573 -7.900932      8.907470 
1 1 1 -24 16 9  o 18.68438 6.202710 4.391124       3.296325 6.457890       6.456839 3.662593       3.833525 23.20352 8.598036 18.09955 6.639247 5.103971       10.86305 
1 1 1 -24 16 10 o 14.63592 5.850455 1.588129       3.155609 -5.917675      6.418098 3.981084       3.623890 14.64416 6.907300 18.32755 6.489408 -3.683396      9.477510 
1 1 1 -24 16 11 o 35.65121 4.971962 16.40421       4.202205 29.94033       12.29696 14.61449       4.471385 44.14881 11.36333 33.32502 5.711403 10.82379       12.71792 
1 1 1 -24 16 12 o 60.53459 3.157104 45.53972       4.641143 36.06853       8.278479 49.88104       5.604785 52.10490 6.672780 63.15372 3.657514 -11.04883      7.609428 
1 1 1 -24 16 13 o 57.73192 3.204386 41.47504       4.490449 37.11366       8.287974 43.28732       5.342557 52.87797 6.573376 58.75963 3.750655 -5.881660      7.568136 
1 1 1 -24 16 14 o 23.07537 6.342792 7.199686       3.676674 -12.31482      10.69144 9.816994       3.915479 17.50523 8.434690 26.99771 6.096160 -9.492489      10.40707 
1 1 1 -24 16 15 o 25.50328 6.281831 8.831540       3.878033 5.526838       6.408170 10.74120       4.871312 22.09268 8.480554 27.84863 7.143810 -5.755949      11.08845 
1 1 1 -24 16 16 o 36.10340 4.099542 16.59915       3.542994 11.77321       6.766660 18.42190       4.158606 28.57697 8.828666 37.85229 4.602873 -9.275328      9.956494 
1 1 1 -24 16 17 o 34.21753 5.210096 15.35102       4.207461 5.743603       6.992449 20.80369       5.267815 22.53468 8.801442 39.73280 5.595346 -17.19812      10.42944 
1 1 1 -24 16 18 o 70.58193 3.439666 62.40973       5.898428 45.71484       9.121321 74.40880       7.732852 58.32785 6.529103 76.60827 4.157753 -18.28042      7.740549 
1 1 1 -24 16 19 o 44.30651 3.816642 24.87597       4.080707 20.32919       7.791915 26.59433       4.790144 37.13990 8.753470 45.55656 4.368267 -8.416656      9.782893 
1 1 1 -24 16 20 o 54.77592 4.002693 38.12451       5.306032 29.21232       10.59651 41.10689       6.129880 43.27773 10.21325 56.59911 4.480867 -13.32138      11.15297 
1 1 1 -24 16 21 o 24.90693 6.104033 8.548024       3.675509 -0.9849834     10.15526 9.985035       3.942814 20.56019 9.333288 26.93491 6.143439 -6.374727      11.17372 
1 1 1 -24 16 22 o 63.05968 3.329639 49.98332       5.098509 53.40632       11.48174 49.14258       5.690300 61.15394 7.888084 62.25962 3.768171 -1.105679      8.741910 
1 1 1 -24 16 23 o 40.37593 4.565256 21.22301       4.413135 18.38595       7.377047 22.80418       5.507275 34.75548 8.724414 41.21476 5.630429 -6.459286      10.38350 
1 1 1 -24 16 24 o 17.10909 6.485236 3.339743       3.717335 -4.650772      6.078311 8.114082       4.698424 14.27816 6.730783 23.67628 7.363721 -9.398117      9.976363 
1 1 1 -24 16 25 o 75.43735 4.545727 74.08582       8.317756 66.22736       11.97061 81.42200       11.56599 67.95131 7.345703 77.00993 6.215885 -9.058617      9.622711 
1 1 1 -24 16 26 o 29.96047 6.266516 12.71312       4.427890 13.46355       8.226433 12.40703       5.253883 28.30448 9.794917 28.79921 7.435326 -0.4947300     12.29734 
1 1 1 -24 16 27 o 18.81491 6.627067 4.823431       3.775359 -0.1004834     6.025238 8.006273       4.844250 16.35757 7.327783 23.08480 7.512004 -6.727232      10.49412 
1 1 1 -24 16 28 o 32.26365 5.326607 14.32568       4.041923 20.40763       6.919841 11.17604       4.979718 36.17817 8.055897 27.03782 7.361403 9.140347       10.91273 
1 1 1 -24 16 29 o 27.49921 6.084184 10.90415       3.969068 10.17545       6.613187 11.31442       4.962149 24.81648 8.768339 27.09772 7.336146 -2.281240      11.43253 
1 1 1 -24 16 30 o 56.47142 3.805098 41.44415       5.205805 35.89504       8.351752 44.97001       6.657314 48.83385 7.236806 57.83094 4.766193 -8.997082      8.665331 
1 1 1 -24 16 31 f 12.00600 5.475046 -1.201297      3.544918 -1.778757      5.870184 -0.8698328     4.447430 14.87132 6.877633 13.62476 6.181616 1.246560       9.247389 
1 1 1 -24 17 1  o 46.35572 4.709244 27.70582       5.245986 0.000000       0.000000 27.70582       5.245986 ?        ?        46.35572 4.709244 0.000000       4.709244 
1 1 1 -24 17 2  o 19.35135 6.323915 4.889493       3.431276 3.247687       6.737782 5.464381       3.987012 20.26779 8.380004 20.42149 6.822751 -0.1536942     10.80622 
1 1 1 -24 17 3  o 14.64926 5.896613 1.583827       3.228978 0.8122904      6.445640 1.842319       3.730881 18.24318 7.893120 15.67310 6.327859 2.570080       10.11648 
1 1 1 -24 17 4  o 23.06093 6.288071 7.227595       3.630260 2.142583       7.111607 9.019605       4.221744 19.91052 8.444414 25.61477 6.691259 -5.704248      10.77409 
1 1 1 -24 17 5  o 80.27826 2.944780 79.95438       5.751092 77.94657       9.478621 81.12418       7.235010 77.95321 5.016335 80.45022 3.700330 -2.497009      6.233463 
1 1 1 -24 17 6  o 14.20527 5.741563 1.385116       3.075326 5.052224       6.088336 0.1289801      3.563322 21.41563 8.254388 13.70527 5.898815 7.710364       10.14549 
1 1 1 -24 17 7  o 47.57400 3.565663 28.38642       4.103693 28.52164       7.521574 28.32911       4.896701 45.96577 6.930086 47.22305 4.302330 -1.257282      8.156968 
1 1 1 -24 17 8  o 34.56260 4.509754 15.33395       3.707847 16.04186       6.878695 15.04402       4.402132 33.50423 8.432566 33.81315 5.533700 -0.3089180     10.08613 
1 1 1 -24 17 9  o 63.25946 3.093488 49.75040       4.754349 50.41057       8.518679 49.45173       5.729734 62.24639 5.678394 62.77090 3.763037 -0.5245094     6.812093 
1 1 1 -24 17 10 o 21.24743 6.216093 6.049164       3.422126 -4.876102      6.257220 10.71157       4.087621 14.80839 6.932640 28.19068 6.125597 -13.38229      9.251185 
1 1 1 -24 17 11 o 78.00149 3.335417 75.84667       6.325362 82.46405       16.49722 74.70618       6.848785 76.18979 9.062819 77.24065 3.648893 -1.050858      9.769806 
1 1 1 -24 17 12 o 34.31279 4.514092 15.13705       3.683066 16.28343       6.979567 14.69463       4.335899 33.64645 8.508484 33.38373 5.522698 0.2627258      10.14369 
1 1 1 -24 17 13 o 41.49502 3.784038 21.74147       3.784317 26.16608       7.442883 20.19882       4.394784 43.70343 7.241986 39.63894 4.637201 4.064499       8.599418 
1 1 1 -24 17 14 o 39.22067 3.840964 19.47746       3.624044 15.59796       6.702552 21.08021       4.308091 32.90057 8.347806 40.57248 4.429148 -7.671909      9.450038 
1 1 1 -24 17 15 o 72.04204 3.501802 65.03038       6.129300 48.54539       9.227220 78.04848       8.199743 60.31573 6.374060 78.39443 4.308759 -18.07870      7.693767 
1 1 1 -24 17 16 o 22.26296 7.048191 6.761549       4.285438 0.9450504      9.718698 8.165445       4.774686 21.37683 9.457165 24.19416 7.405629 -2.817335      12.01172 
1 1 1 -24 17 17 o 36.33204 4.867762 17.19809       4.201441 18.33900       7.034895 16.56553       5.238240 35.55083 8.275761 34.86518 6.401165 0.6856575      10.46246 
1 1 1 -24 17 18 o 13.70980 5.712120 0.9148225      3.164529 3.788749       6.494626 0.2008038E-01  3.623809 20.32184 8.295571 13.60222 5.901614 6.719619       10.18065 
1 1 1 -24 17 19 o 38.72487 4.485389 19.38226       4.154603 10.46344       6.797331 24.70118       5.249239 26.68280 8.908385 43.45584 5.050928 -16.77304      10.24066 
1 1 1 -24 17 20 o 14.13492 5.708143 1.499040       3.036672 -0.4567603     5.825211 2.228863       3.558427 16.39904 7.284769 15.73045 6.237271 0.6685915      9.590173 
1 1 1 -24 17 21 o 70.13713 3.351209 61.86897       5.711201 42.17653       13.41523 66.22812       6.311747 50.47922 11.19867 72.40677 3.588305 -21.92755      11.75951 
1 1 1 -24 17 22 o 10.76679 4.978892 -2.050991      3.075257 4.457776       5.891449 -4.488613      3.605421 20.11321 8.009171 10.35551 4.965904 9.757701       9.423748 
1 1 1 -24 17 23 f 26.10048 5.550667 9.342434       3.421725 -1.435062      6.093379 14.30623       4.135294 15.92902 7.230457 32.54121 5.404277 -16.61219      9.026944 
1 1 1 -24 17 24 o 17.98778 6.687634 3.992923       3.912352 -1.849340      6.821485 6.856696       4.775926 16.46720 7.541791 21.90659 7.467256 -5.439390      10.61313 
1 1 1 -24 17 25 o 22.72548 7.397155 7.596963       4.697083 6.647421       6.255361 8.824444       7.112177 21.90968 8.386756 24.11813 9.007033 -2.208458      12.30708 
1 1 1 -24 17 26 o 21.73605 6.750579 6.886026       3.950139 2.817145       6.277834 9.552787       5.082347 18.55754 7.904594 24.99072 7.638783 -6.433186      10.99243 
1 1 1 -24 17 27 o 32.38323 5.377775 14.45744       4.095045 12.27638       6.865990 15.66165       5.101785 27.12206 8.950005 32.80518 6.610486 -5.683119      11.12659 
1 1 1 -24 17 28 f 35.59900 4.998991 17.23387       4.217343 23.54475       7.001965 13.64104       5.283146 39.27585 7.590429 29.86562 7.317554 9.410231       10.54330 
1 1 1 -24 17 29 o 25.52066 6.388908 9.635893       3.963818 7.392863       6.376431 11.04857       5.060366 21.95107 8.450918 26.51800 7.498228 -4.566929      11.29785 
1 1 1 -24 17 30 o 16.12579 6.746501 2.289603       4.441427 -16.29314      10.06851 6.779184       4.948952 14.53488 7.232025 21.08142 7.570527 -6.546534      10.46972 
1 1 1 -24 18 1  o 66.23459 3.937175 55.68394       6.326181 0.000000       0.000000 55.68394       6.326181 ?        ?        66.23459 3.937175 0.000000       3.937175 
1 1 1 -24 18 2  o 39.69151 4.185640 20.18905       3.987625 12.15643       7.237581 23.69024       4.778284 28.48249 9.175082 42.78651 4.657881 -14.30402      10.28970 
1 1 1 -24 18 3  o 51.83333 3.547937 33.83021       4.454453 26.34472       8.068668 37.11178       5.342357 43.00035 7.994227 54.01884 4.088731 -11.01849      8.979164 
1 1 1 -24 18 4  o 32.65096 4.979446 13.96646       3.836802 19.04122       7.484876 12.15770       4.468552 36.03316 8.636614 29.80293 6.347399 6.230230       10.71824 
1 1 1 -24 18 5  o 58.76951 4.110559 43.82839       5.849814 42.21119       9.886822 44.69951       7.256263 55.19745 7.547732 58.71937 5.122242 -3.521919      9.121713 
1 1 1 -24 18 6  o 72.04470 3.032707 64.60257       5.312466 67.62765       9.325075 63.14900       6.463995 72.15431 5.341267 70.83081 3.758374 1.323502       6.531042 
1 1 1 -24 18 7  o 32.74768 4.758518 13.93420       3.686367 13.97226       6.832590 13.91856       4.378273 30.89167 8.705224 32.27779 5.778446 -1.386120      10.44851 
1 1 1 -24 18 8  o 52.48590 3.423451 34.53223       4.354780 34.91965       7.936453 34.36534       5.208971 50.97639 6.539252 52.02398 4.142974 -1.047581      7.741192 
1 1 1 -24 18 9  o 20.06887 6.306256 5.352275       3.436690 -2.214079      6.435079 8.371423       4.064928 16.32935 7.419355 24.64880 6.625564 -8.319448      9.947106 
1 1 1 -24 18 10 o 40.30821 3.967193 20.63571       3.846397 19.58693       7.043249 21.08143       4.591547 37.09354 8.025387 40.39671 4.755179 -3.303177      9.328374 
1 1 1 -24 18 11 o 25.86087 6.148003 9.122803       3.817336 16.23161       12.20347 8.351772       4.019024 32.00003 11.82714 24.61393 6.575598 7.386106       13.53217 
1 1 1 -24 18 12 o 88.21590 2.866181 96.62156       6.153322 76.02677       10.32306 107.9718       7.663599 76.25835 5.593934 92.91578 3.390283 -16.65742      6.541110 
1 1 1 -24 18 13 o 21.12920 6.136831 6.056715       3.346153 8.802891       6.565025 5.092907       3.889266 25.11481 8.746790 19.81676 6.738832 5.298052       11.04166 
1 1 1 -24 18 14 o 40.07094 4.470691 20.66934       4.291282 16.79647       7.366617 22.65862       5.279572 33.60942 8.867492 41.52264 5.341259 -7.913216      10.35188 
1 1 1 -24 18 15 o 34.45551 6.469927 16.25007       5.232988 20.32620       7.112064 11.43824       7.727283 37.62102 8.003826 27.77840 9.497616 9.842617       12.42038 
1 1 1 -24 18 16 o 78.91048 2.968628 77.56989       5.698380 56.42615       9.784684 88.42158       7.009781 64.85800 6.268850 83.94917 3.433757 -19.09116      7.147669 
1 1 1 -24 18 17 o 29.28203 5.772655 11.60946       3.972713 18.84491       10.60636 10.42871       4.284621 33.72683 11.12359 27.38030 6.516196 6.346529       12.89167 
1 1 1 -24 18 18 o 45.49591 3.810302 26.31041       4.185660 16.05955       7.234197 31.46906       5.131901 32.56074 8.875774 49.51371 4.295671 -16.95297      9.860637 
1 1 1 -24 18 19 o 39.53733 4.110768 20.07996       3.902896 8.014847       6.990254 25.54464       4.704458 24.06558 8.940763 44.48035 4.397644 -20.41478      9.963760 
1 1 1 -24 18 20 o 58.43530 3.251777 42.94154       4.612284 36.09625       8.073602 46.25790       5.619558 51.13808 6.634951 60.28827 3.845055 -9.150185      7.668574 
1 1 1 -24 18 21 o 28.44164 5.641819 11.05336       3.772191 8.863526       10.64122 11.36809       4.034168 25.54630 10.54386 28.68073 5.966578 -3.134432      12.11499 
1 1 1 -24 18 22 o 51.25638 3.587904 33.42247       4.453213 25.45907       9.188108 35.86747       5.091154 39.83906 9.581832 52.85156 3.982252 -13.01250      10.37641 
1 1 1 -24 18 23 o 10.15238 4.898019 -4.875763      3.632812 5.000652       6.952594 -8.584859      4.260703 20.94042 8.569703 9.793761 4.843425 11.14666       9.843708 
1 1 1 -24 18 24 f 12.68584 5.486948 0.2391363      3.112847 -3.009911      5.863878 1.513983       3.673127 14.60994 6.796964 14.82960 6.164346 -0.2196627     9.175941 
1 1 1 -24 18 25 o 19.02755 6.550792 5.013771       3.677806 3.184046       5.641587 6.366100       4.850090 18.30683 7.627085 21.03643 7.501432 -2.729597      10.69785 
1 1 1 -24 18 26 o 11.95887 5.473407 -1.520260      3.585005 -0.8853505     5.946706 -1.882750      4.493330 15.69303 7.131034 13.19648 6.072199 2.496550       9.366069 
1 1 1 -24 18 27 o 49.98389 4.815907 33.53590       5.793495 31.32433       7.679367 36.45742       8.826328 45.99984 7.077162 48.97947 7.644435 -2.979630      10.41747 
1 1 1 -24 18 28 o 36.33548 5.109458 18.10849       4.399397 22.97294       7.223852 15.24062       5.546652 38.11739 8.030825 31.43847 7.369033 6.678925       10.89939 
1 1 1 -24 18 29 o 42.26997 4.578908 23.99604       4.641381 33.02979       7.749567 18.94303       5.795874 47.03102 6.972566 35.47830 6.952508 11.55272       9.846524 
1 1 1 -24 19 1  o 22.04183 6.213805 6.746720       3.480583 6.417193       6.121429 6.904150       4.231089 22.16863 8.340086 22.20242 7.000055 -0.3379250E-01 10.88843 
1 1 1 -24 19 2  o 16.24664 6.139008 2.882181       3.324886 -5.034981      5.843181 6.673049       4.043282 13.88509 6.561779 21.91103 6.833629 -8.025936      9.473934 
1 1 1 -24 19 3  o 35.47358 4.331814 16.26570       3.667063 18.32896       6.872750 15.44453       4.335826 35.36587 8.143050 34.02935 5.409406 1.336517       9.776039 
1 1 1 -24 19 4  f 52.79967 3.602206 35.21146       4.607092 42.57659       8.997506 32.59422       5.363564 55.75744 6.759800 50.34698 4.416317 5.410454       8.074574 
1 1 1 -24 19 5  o 20.84124 6.941154 5.837862       4.127166 0.5934908      6.378367 9.615016       5.413089 17.80120 7.774967 25.83716 7.880671 -8.035965      11.07046 
1 1 1 -24 19 6  o 41.64288 4.115317 22.17517       4.121647 18.92431       7.903768 23.38941       4.830446 35.38886 9.110885 42.45500 4.750323 -7.066135      10.27491 
1 1 1 -24 19 7  o 25.16935 5.735782 8.606902       3.439408 9.300272       6.010528 8.269319       4.193926 25.46591 8.372507 24.32648 6.807810 1.139427       10.79098 
1 1 1 -24 19 8  o 13.88744 5.763008 1.019696       3.202774 -3.269505      5.901829 2.810120       3.813085 14.92872 6.901345 16.77457 6.514249 -1.845854      9.490206 
1 1 1 -24 19 9  o 29.79243 5.107191 11.73985       3.574492 12.24005       6.655675 11.53709       4.237466 28.74092 8.732907 29.03837 6.178232 -0.2974472     10.69739 
1 1 1 -24 19 10 o 44.64068 3.751641 25.24532       4.043477 22.62991       6.991593 26.55972       4.956456 40.13881 7.421137 45.40294 4.540570 -5.264122      8.700003 
1 1 1 -24 19 11 o 54.10649 4.271309 37.41502       5.586142 37.30914       13.08830 37.43861       6.177009 47.78826 11.39915 53.82582 4.758202 -6.037556      12.35238 
1 1 1 -24 19 12 o 33.25161 5.226092 14.62463       4.095187 16.43796       6.705597 13.54603       5.171650 33.50650 8.264660 31.06672 6.999608 2.439781       10.83047 
1 1 1 -24 19 13 f 62.79934 3.500714 49.62019       5.336120 49.66734       8.492610 49.58942       6.859200 61.22302 5.760007 62.10250 4.564284 -0.8794785     7.349175 
1 1 1 -24 19 14 o 24.25701 5.728112 8.020663       3.331484 5.244981       6.273525 9.110844       3.931661 21.32742 8.334743 25.63971 6.330866 -4.312288      10.46651 
1 1 1 -24 19 15 o 27.72546 6.435535 10.68303       4.264187 -1.801439      6.296648 21.25905       5.795428 16.19702 7.351301 39.55347 6.217564 -23.35644      9.628070 
1 1 1 -24 19 16 o 18.18866 6.117027 4.301104       3.204321 -2.860682      6.242759 6.862906       3.733693 15.51735 7.146355 22.22358 6.490452 -6.706229      9.653826 
1 1 1 -24 19 17 o 13.81898 5.700955 1.157517       3.108993 4.051919       6.368900 0.2520322      3.562260 20.21705 8.229120 13.63429 5.883329 6.582765       10.11593 
1 1 1 -24 19 18 o 19.11334 6.218048 4.909558       3.319235 1.680932       6.358133 6.119097       3.891624 18.33912 7.886237 21.03518 6.723157 -2.696064      10.36309 
1 1 1 -24 19 19 o 62.46705 3.533473 49.39080       5.356912 20.07280       12.29606 56.25895       5.951391 33.15429 11.92970 66.57462 3.682723 -33.42033      12.48520 
1 1 1 -24 19 20 o 26.35331 5.695287 9.576169       3.550641 7.813546       6.711314 10.26128       4.184171 23.44812 8.750976 26.89691 6.464154 -3.448795      10.87956 
1 1 1 -24 19 21 o 32.80661 5.732576 14.77265       4.416245 0.000000       0.000000 14.77265       4.416245 ?        ?        32.80661 5.732576 0.000000       5.732576 
1 1 1 -24 19 22 o 24.05896 6.733139 8.405863       4.102365 5.318267       7.351192 9.802302       4.943774 21.33565 8.780465 25.59134 7.466979 -4.255697      11.52616 
1 1 1 -24 19 23 o 29.58018 5.163616 11.90854       3.586783 4.017893       6.238818 15.80423       4.383674 19.51820 8.066307 33.95491 5.484724 -14.43671      9.754358 
1 1 1 -24 19 24 o 16.54125 6.121922 3.392713       3.271603 -3.847684      5.872496 6.651233       3.939596 14.10327 6.638302 21.34930 6.757668 -7.246025      9.472757 
1 1 1 -24 19 25 o 14.55571 5.874209 1.922309       3.213592 9.068164       6.111587 -0.8084347     3.778047 23.90866 8.430875 12.80497 5.763978 11.10369       10.21289 
1 1 1 -24 19 26 o 22.81878 6.105712 7.571999       3.461753 2.336475       6.317267 9.818841       4.138428 17.99296 7.799419 25.73115 6.576061 -7.738182      10.20174 
1 1 1 -24 19 27 o 32.05589 5.023825 14.09570       3.795611 1.717607       6.373359 20.89868       4.724886 17.51609 7.707502 39.08408 5.080996 -21.56799      9.231582 
1 1 1 -24 19 28 o 15.12160 6.292586 1.895196       3.833530 1.240142       6.191523 2.302432       4.881821 16.97828 7.527927 16.56302 7.009288 0.4152584      10.28590 
1 1 1 -24 20 1  o 34.50573 4.635431 15.64022       3.799276 18.35175       6.766500 14.39179       4.591335 35.06594 8.084016 32.28790 6.057754 2.778046       10.10187 
1 1 1 -24 20 2  o 27.33029 6.522778 10.54012       4.283678 0.000000       0.000000 10.54012       4.283678 ?        ?        27.33029 6.522778 0.000000       6.522778 
1 1 1 -24 20 3  o 22.55130 6.136389 7.076492       3.461422 6.410110       5.898600 7.426492       4.274856 22.01762 8.206612 22.90028 7.006855 -0.8826599     10.79095 
1 1 1 -24 20 4  o 12.88231 5.543996 0.2256410      3.146878 -4.467559      5.596870 2.395174       3.805344 13.76799 6.480534 16.17304 6.437943 -2.405055      9.134792 
1 1 1 -24 20 5  o 32.58199 6.226387 14.60618       4.763500 17.89383       7.375303 12.25319       6.239473 34.35295 8.778509 28.61286 8.399721 5.740089       12.14980 
1 1 1 -24 20 6  o 31.78303 5.202495 13.44204       3.890143 18.30144       7.678721 11.76422       4.512020 34.61237 9.015523 29.02090 6.537497 5.591461       11.13636 
1 1 1 -24 20 7  o 58.82743 3.581049 43.70821       5.109332 43.50532       7.961432 43.85028       6.662273 57.10329 5.801750 58.16387 4.741480 -1.060581      7.492793 
1 1 1 -24 20 8  o 34.41412 4.957477 15.58708       4.037742 23.19788       6.699637 11.24579       5.059938 40.77453 6.994281 27.99213 7.331889 12.78240       10.13294 
1 1 1 -24 20 9  o 19.69851 6.405353 5.204007       3.522442 2.182346       5.580164 7.205624       4.541660 18.03051 7.554007 22.70309 7.263695 -4.672588      10.47971 
1 1 1 -24 20 10 o 10.65144 4.987288 -2.769482      3.240316 -2.362921      5.581940 -2.976117      3.979460 14.90275 6.824150 11.96681 5.578033 2.935935       8.813823 
1 1 1 -24 20 11 o 18.14936 6.428252 4.125607       3.556135 17.77644       11.13049 2.573761       3.752829 32.43107 11.38244 16.35863 6.430478 16.07244       13.07330 
1 1 1 -24 20 12 f 46.08363 4.088531 27.18239       4.543851 18.03402       7.091338 33.55484       5.918471 34.79900 8.448240 50.76346 4.842968 -15.96445      9.737922 
1 1 1 -24 20 13 o 25.15528 5.780044 8.673985       3.468699 6.807799       5.918588 9.650328       4.280963 22.51958 8.251331 26.15634 6.690267 -3.636766      10.62281 
1 1 1 -24 20 14 o 25.82464 5.624142 9.097543       3.438892 10.36053       6.350476 8.573519       4.090561 26.36460 8.602419 24.64678 6.655724 1.717813       10.87659 
1 1 1 -24 20 15 o 15.22630 6.619725 0.3296861      4.578590 3.022767       5.756256 -4.308917      7.554556 18.79198 7.755361 16.35326 7.643377 2.438719       10.88884 
1 1 1 -24 20 16 o 9.370869 4.519472 -4.318100      3.086762 -13.62535      5.802996 -0.6455262     3.645246 10.81918 5.400225 12.95693 5.758791 -2.137751      7.894688 
1 1 1 -24 20 17 o 22.81145 6.009327 7.256702       3.386467 2.163000       6.400080 9.237364       3.990928 18.63081 7.959816 25.57412 6.415487 -6.943310      10.22336 
1 1 1 -24 20 18 o 23.66917 5.957010 7.831642       3.432843 10.84466       6.576009 6.702996       4.024765 26.51885 8.759309 21.74787 6.823198 4.770981       11.10322 
1 1 1 -24 20 19 o 14.15483 5.993047 0.9108799      3.571713 -4.308628      8.165041 2.145994       3.971890 16.79195 7.879808 15.94355 6.495248 0.8483934      10.21174 
1 1 1 -24 20 20 o 39.08822 5.865977 21.03057       5.415287 0.000000       0.000000 21.03057       5.415287 ?        ?        39.08822 5.865977 0.000000       5.865977 
1 1 1 -24 20 21 o 54.61248 4.843139 39.52612       6.378712 0.000000       0.000000 39.52612       6.378712 ?        ?        54.61248 4.843139 0.000000       4.843139 
1 1 1 -24 20 22 o 24.14301 5.931127 8.289600       3.463935 8.806620       6.340837 8.069672       4.135567 23.83760 8.568142 23.39034 6.830718 0.4472637      10.95773 
1 1 1 -24 20 23 o 25.78246 5.658368 9.360253       3.457319 8.547954       6.153106 9.735024       4.179456 23.43532 8.438230 25.70920 6.628579 -2.273882      10.73041 
1 1 1 -24 20 24 o 61.52906 4.203173 49.56379       6.264374 37.29776       10.46766 56.40799       7.819131 47.36711 9.400352 64.75179 4.993865 -17.38468      10.64450 
1 1 1 -24 20 25 f 16.71333 6.231664 3.539273       3.401742 -6.676107      6.078108 8.198463       4.104841 13.06130 6.309832 23.34799 6.801597 -10.28669      9.277699 
1 1 1 -24 20 26 o 22.49854 6.226367 7.458628       3.529468 5.164173       6.269907 8.522965       4.270327 19.95131 8.148334 23.62270 6.952806 -3.671394      10.71153 
1 1 1 -24 20 27 o 11.61846 5.286063 -1.115157      3.280282 0.7392625      6.313971 -1.800721      3.839040 16.77952 7.510208 12.09349 5.581936 4.686028       9.357415 
1 1 1 -24 21 1  o 20.41050 6.309876 5.841259       3.455742 6.604851       5.366409 5.300276       4.516950 21.71596 7.872093 19.91725 7.221917 1.798706       10.68297 
1 1 1 -24 21 2  o 22.97505 7.372826 7.659902       4.676570 0.000000       0.000000 7.659902       4.676570 ?        ?        22.97505 7.372826 0.000000       7.372826 
1 1 1 -24 21 3  o 15.81224 6.207540 2.490423       3.493170 -4.800310      5.640496 7.026365       4.449031 13.57000 6.423036 22.19158 7.197398 -8.621573      9.646653 
1 1 1 -24 21 4  o 30.12636 5.714980 12.42455       4.042171 8.802459       6.745779 14.45367       5.049002 24.46390 8.831789 31.93635 6.701657 -7.472448      11.08660 
1 1 1 -24 21 5  o 30.33769 7.284252 13.36034       5.317077 6.804764       6.994550 22.33434       8.183653 22.73163 8.824132 38.01754 8.977835 -15.28591      12.58836 
1 1 1 -24 21 6  o 26.63632 5.806847 9.773736       3.662637 3.582165       6.996193 12.11134       4.298797 20.19844 8.460037 29.52570 6.173566 -9.327259      10.47307 
1 1 1 -24 21 7  o 23.28812 6.114437 7.567888       3.513557 10.04184       6.786309 6.661861       4.106844 25.84700 8.898492 21.79112 6.899882 4.055872       11.26017 
1 1 1 -24 21 8  o 21.78149 6.147274 6.601947       3.404487 13.52365       5.927526 3.194594       4.158872 30.16834 7.951835 17.40400 6.790586 12.76434       10.45676 
1 1 1 -24 21 9  o 22.14545 5.865968 6.785372       3.215518 7.511124       5.992682 6.491935       3.810518 23.14626 8.328347 21.55710 6.619041 1.589161       10.63828 
1 1 1 -24 21 10 o 35.73237 4.453758 16.63189       3.794193 22.40155       6.846021 14.07402       4.558295 39.56157 7.372320 31.97297 6.072359 7.588593       9.551160 
1 1 1 -24 21 11 o 30.43881 6.316007 12.90633       4.531317 11.11663       10.53511 13.31258       5.019328 27.07900 10.73370 30.57474 6.900948 -3.495739      12.76069 
1 1 1 -24 21 12 o 41.52175 3.923391 22.09809       3.922767 19.51191       7.026189 23.26930       4.728306 36.20782 8.159199 42.19126 4.677305 -5.983440      9.404771 
1 1 1 -24 21 13 o 11.68587 5.254364 -1.004555      3.129652 -2.752427      5.755848 -0.2708993     3.729073 14.80399 6.833657 13.39520 5.894866 1.408787       9.024872 
1 1 1 -24 21 14 o 18.74685 6.502207 4.626057       3.626099 2.856832       5.786903 5.769775       4.652798 18.56886 7.729543 20.67672 7.350008 -2.107861      10.66623 
1 1 1 -24 21 15 o 14.66953 5.903912 1.804598       3.236469 0.5801710      5.829949 2.350051       3.891140 16.86272 7.397358 16.10744 6.476715 0.7552719      9.832026 
1 1 1 -24 21 16 o 40.52815 3.945224 21.15552       3.847150 13.25778       6.727681 24.99290       4.689554 29.05370 8.769938 43.76260 4.459612 -14.70890      9.838696 
1 1 1 -24 21 17 o 18.82233 6.444833 4.773281       3.558415 4.852737       7.433198 4.749658       4.053011 21.13525 8.775911 19.01233 6.848104 2.122917       11.13163 
1 1 1 -24 21 18 o 17.06152 6.684443 3.169168       4.043576 7.000560       7.934774 1.825143       4.699590 22.85712 9.228269 16.41050 6.907372 6.446627       11.52704 
1 1 1 -24 21 19 o 21.70514 6.685140 6.798706       3.883313 3.512761       6.582648 8.552704       4.809336 19.41614 8.173838 23.91050 7.452265 -4.494364      11.06110 
1 1 1 -24 21 20 o 18.53648 6.623399 4.612066       3.783058 11.97189       11.15593 3.655763       4.021331 26.42521 10.83949 17.48831 6.716774 8.936901       12.75185 
1 1 1 -24 21 21 f 23.13403 6.005948 7.674896       3.415243 4.083937       5.876004 9.506831       4.196932 19.16678 7.864965 25.38071 6.691646 -6.213936      10.32646 
1 1 1 -24 21 22 o 37.69191 4.445460 18.84697       4.004746 19.23373       6.918705 18.65210       4.911092 34.81445 8.277072 36.59144 5.692646 -1.776989      10.04570 
1 1 1 -24 21 23 o 28.37296 6.179634 11.63288       4.151447 -7.425008      10.00972 15.59206       4.562334 16.87338 8.138029 33.22886 5.847691 -16.35547      10.02113 
1 1 1 -24 21 24 o 30.06305 6.294735 13.15937       4.463447 6.251264       6.320101 20.03333       6.304461 20.96190 8.312156 36.22816 7.391710 -15.26627      11.12337 
1 1 1 -24 21 25 o 35.64984 4.570066 17.09104       3.879036 16.60834       6.889852 17.31505       4.693602 31.37464 8.705621 35.02836 5.693944 -3.653717      10.40235 
1 1 1 -24 22 1  o 25.85160 5.690941 9.361943       3.487864 13.34216       5.697957 6.976893       4.410771 29.45456 7.811666 21.83006 7.172016 7.624496       10.60471 
1 1 1 -24 22 2  o 30.55252 6.474881 13.36707       4.670789 0.000000       0.000000 13.36707       4.670789 ?        ?        30.55252 6.474881 0.000000       6.474881 
1 1 1 -24 22 3  o 15.85589 6.001213 2.866517       3.180338 4.193360       5.598578 2.234358       3.864389 19.31758 7.768359 15.84058 6.423943 3.476993       10.08040 
1 1 1 -24 22 4  o 12.94817 5.545195 0.4585901      3.119578 -6.440673      5.714731 3.387182       3.723264 12.89532 6.201519 17.05166 6.484120 -4.156341      8.972327 
1 1 1 -24 22 5  o 40.47050 5.673879 22.30944       5.442196 15.44768       7.718341 29.09382       7.674700 30.73275 9.417314 44.89808 7.262340 -14.16532      11.89232 
1 1 1 -24 22 6  o 20.73557 6.349394 6.039463       3.509399 4.118383       6.588684 6.800354       4.146552 20.08581 8.294028 21.82046 6.936059 -1.734652      10.81202 
1 1 1 -24 22 7  o 40.48415 4.279550 21.30728       4.158176 15.43591       7.739065 23.69020       4.930294 30.82162 9.427175 42.33258 4.867765 -11.51096      10.60975 
1 1 1 -24 22 8  o 30.08290 5.439273 12.31256       3.840729 13.35804       7.249531 11.90462       4.528473 28.91840 9.168639 28.90881 6.576861 0.9590149E-02  11.28357 
1 1 1 -24 22 9  o 35.03741 4.546234 16.12839       3.790249 13.94955       6.486990 17.25778       4.670389 30.01601 8.490433 35.65738 5.555840 -5.641371      10.14666 
1 1 1 -24 22 10 o 32.49170 5.278365 14.24253       4.036039 11.73550       6.346498 15.94496       5.229842 27.51096 8.558625 33.53509 6.634637 -6.024128      10.82906 
1 1 1 -24 22 11 o 59.23158 3.757638 44.80540       5.395847 31.28563       12.69922 47.78396       5.960668 41.00110 11.96874 60.96375 4.034945 -19.96265      12.63058 
1 1 1 -24 22 12 o 47.43931 3.667070 28.74176       4.206408 23.63701       7.238286 31.34481       5.168793 40.05462 7.695199 49.09268 4.366019 -9.038063      8.847497 
1 1 1 -24 22 13 o 33.85292 5.144228 15.40325       4.110404 6.388656       6.292732 22.11184       5.428521 21.81501 8.396121 40.27512 5.689323 -18.46012      10.14215 
1 1 1 -24 22 14 o 46.47572 3.769774 27.70325       4.232882 11.20626       6.937319 37.48776       5.342675 26.57632 9.000506 53.86494 4.101033 -27.28862      9.890783 
1 1 1 -24 22 15 o 57.20158 3.626758 41.77924       5.029451 38.54917       10.00059 42.87278       5.818865 50.26027 8.465688 57.52213 4.179653 -7.261864      9.441259 
1 1 1 -24 22 16 o 26.80630 6.382482 10.30722       4.109110 8.273705       7.427496 11.20411       4.932735 23.63309 9.114985 27.40949 7.267722 -3.776394      11.65773 
1 1 1 -24 22 17 o 42.81363 4.380770 24.05274       4.506184 22.13152       7.229964 25.27313       5.762305 38.04644 8.049631 42.93213 5.644386 -4.885681      9.831361 
1 1 1 -24 22 18 o 9.589080 4.639404 -4.644764      3.316869 -8.969160      6.487721 -3.114464      3.859382 12.91669 6.303503 11.45323 5.388014 1.463451       8.292458 
1 1 1 -24 22 19 o 29.63416 5.276983 12.08159       3.671064 13.20080       6.816887 11.62443       4.356779 28.21280 8.883913 28.27644 6.464023 -0.6363869E-01 10.98670 
1 1 1 -24 22 20 o 15.03621 6.263443 1.691044       3.803714 3.772465       9.971082 1.336565       4.114884 21.24118 9.477292 15.08091 6.410808 6.160269       11.44192 
1 1 1 -24 22 21 o 19.25727 6.538292 5.276214       3.661070 10.12289       6.786053 3.286384       4.348135 24.76836 8.868522 17.18017 6.867501 7.588192       11.21665 
1 1 1 -24 22 22 o 13.44969 5.758649 0.7601860      3.362947 -1.333197      6.053668 1.694570       4.044425 15.44440 7.085020 15.25041 6.412792 0.1939898      9.556224 
1 1 1 -24 22 23 o 23.77080 6.249190 8.327525       3.667073 15.36342       6.461270 4.984321       4.453893 30.48039 8.420203 18.98740 7.120186 11.49299       11.02710 
1 1 1 -24 22 24 o 39.09037 5.319325 21.17403       4.935795 7.758360       7.095729 33.75070       6.870267 22.26653 8.814461 48.82152 5.893782 -26.55499      10.60337 
1 1 1 -24 23 1  o 32.73632 4.918820 14.52908       3.802764 17.34567       6.264670 12.88573       4.785225 33.40180 7.833018 29.48189 6.799334 3.919905       10.37242 
1 1 1 -24 23 2  o 14.45406 5.791781 1.940201       3.100323 -3.789059      4.823259 5.974071       4.047177 12.63642 5.968666 20.35134 6.874681 -7.714911      9.104186 
1 1 1 -24 23 3  o 41.75543 4.460927 23.02517       4.468912 17.41717       6.695972 27.52946       6.000982 33.20292 8.299076 44.72108 5.631040 -11.51817      10.02912 
1 1 1 -24 23 4  o 13.64111 5.722733 1.059640       3.209184 -3.975394      5.330544 3.922059       4.019175 13.33579 6.291625 17.79042 6.743416 -4.454632      9.222700 
1 1 1 -24 23 5  o 13.77888 6.048521 0.6542403E-01  3.903516 -5.441606      5.431001 5.950614       5.614375 12.82611 6.135691 20.86912 7.955975 -8.043004      10.04710 
1 1 1 -24 23 6  o 49.93849 3.753135 32.05427       4.533947 27.60555       8.245048 33.98263       5.428375 42.39312 8.278191 50.92595 4.417821 -8.532822      9.383261 
1 1 1 -24 23 7  o 20.35727 6.396123 5.879560       3.535439 17.53482       6.915570 1.755576       4.113632 33.36946 8.486273 15.61015 6.508935 17.75930       10.69500 
1 1 1 -24 23 8  o 17.16831 6.319715 3.677278       3.478320 3.265500       6.618250 3.834426       4.088517 19.25797 8.156008 17.81123 6.789526 1.446735       10.61217 
1 1 1 -24 23 9  o 16.38670 6.211854 3.123304       3.410680 3.049233       5.208638 3.178905       4.512724 17.94286 7.388279 17.44875 6.989018 0.4941025      10.17020 
1 1 1 -24 23 10 o 35.03671 4.637376 16.28416       3.862291 8.416067       6.510526 20.55690       4.797715 23.61086 8.653644 39.05856 5.167236 -15.44770      10.07898 
1 1 1 -24 23 11 o 42.45438 4.998412 24.11049       5.072207 0.000000       0.000000 24.11049       5.072207 ?        ?        42.45438 4.998412 0.000000       4.998412 
1 1 1 -24 23 12 o 21.24302 6.812122 6.504856       3.992827 5.763427       7.328914 6.817810       4.761511 21.51400 8.800820 21.66767 7.453932 -0.1536713     11.53324 
1 1 1 -24 23 13 o 42.64651 4.630711 24.06637       4.735303 9.709954       8.035993 31.70300       5.860943 24.79218 9.501856 48.68252 5.011886 -23.89034      10.74264 
1 1 1 -24 23 14 o 51.85567 5.060797 36.05872       6.313864 34.96544       7.894091 37.99991       10.51894 49.41562 6.730180 48.58654 9.221442 0.8290749      11.41623 
1 1 1 -24 23 15 o 49.74883 3.587873 31.74352       4.320449 20.53944       7.219712 37.99430       5.392611 36.12642 8.365753 54.02112 4.127629 -17.89470      9.328620 
1 1 1 -24 23 16 o 65.06376 3.548491 54.20161       5.604952 52.03611       14.01976 54.61357       6.114892 53.81878 11.05985 65.00869 3.877566 -11.18991      11.71989 
1 1 1 -24 23 17 o 22.48926 6.536655 7.432621       3.795111 4.647792       7.795915 8.297546       4.344673 20.64858 8.802379 23.49318 7.037795 -2.844601      11.26998 
1 1 1 -24 23 18 o 54.84720 3.532291 38.61270       4.696040 30.82722       8.079907 42.58410       5.770786 45.10766 7.621819 57.03941 4.180720 -11.93175      8.693131 
1 1 1 -24 23 19 o 14.29156 6.030222 1.253416       3.595858 -8.095636      6.100223 6.231690       4.451448 12.60133 6.141384 20.61047 7.200867 -8.009145      9.464094 
1 1 1 -24 23 20 o 59.16224 4.830894 47.03401       6.904210 18.24228       12.78376 58.89036       8.203518 28.94322 11.70337 65.81306 5.156212 -36.86983      12.78888 
1 1 1 -24 23 21 o 32.06627 5.123547 14.16756       3.868953 18.41234       7.196198 12.44172       4.588551 33.10604 8.778221 28.88730 6.655270 4.218744       11.01589 
1 1 1 -24 23 22 o 33.03866 4.873240 14.89620       3.805861 21.24698       7.026666 12.25963       4.527465 36.39740 8.127810 28.65253 6.617632 7.744877       10.48114 
1 1 1 -24 24 1  o 21.35849 6.188962 6.716483       3.406855 17.47289       5.611571 0.4374762      4.287423 34.02245 7.001940 14.39337 6.327935 19.62908       9.437686 
1 1 1 -24 24 2  o 32.52293 5.004997 14.48697       3.839707 15.15996       6.341501 14.09743       4.824638 30.40600 8.319000 30.85597 6.615054 -0.4499722     10.62849 
1 1 1 -24 24 3  o 16.62938 6.113316 3.556428       3.253079 1.913825       5.196595 4.614936       4.171570 16.65880 7.146076 18.49871 6.900166 -1.839911      9.933714 
1 1 1 -24 24 4  o 19.67354 6.301734 5.571789       3.417633 4.614110       5.677106 6.116132       4.280097 19.33828 7.806424 20.44924 7.065706 -1.110954      10.52922 
1 1 1 -24 24 5  o 39.75964 5.509991 21.84875       5.195314 10.26198       6.718475 39.08291       8.193788 24.96609 8.836324 52.06763 6.606248 -27.10154      11.03282 
1 1 1 -24 24 6  o 30.78224 5.182212 13.00090       3.749389 11.06724       6.579954 13.93063       4.562579 25.90343 8.765664 31.14894 6.228590 -5.245502      10.75324 
1 1 1 -24 24 7  o 12.12501 5.374448 -0.3459530     3.153506 -1.733767      5.367245 0.3857152      3.897112 14.50195 6.659537 13.96024 6.087726 0.5417137      9.022740 
1 1 1 -24 24 8  o 17.21848 6.751455 3.423682       4.127903 5.314425       6.209643 1.926594       5.525532 20.35717 8.183100 17.12117 7.356983 3.235992       11.00401 
1 1 1 -24 24 9  f 31.19522 5.884805 13.72224       4.309600 13.20681       7.474886 13.97887       5.274480 27.79403 9.342716 30.47246 7.215200 -2.678431      11.80447 
1 1 1 -24 24 10 o 22.75620 6.922137 7.713984       4.180148 -5.286096      7.242852 14.20697       5.118689 15.08367 7.179461 30.93482 6.959056 -15.85115      9.998656 
1 1 1 -24 24 11 o 12.01715 5.452244 -1.144594      3.459849 0.1618970      5.540933 -1.979525      4.429504 15.88509 7.077673 13.04218 6.011217 2.842914       9.285913 
1 1 1 -24 24 12 o 18.24823 6.267539 4.591689       3.366009 3.493762       5.948047 5.108942       4.082619 18.66687 7.808326 19.18702 6.877761 -0.5201530     10.40546 
1 1 1 -24 24 13 o 58.46239 3.418186 43.69342       4.848526 25.37878       7.858670 54.94933       6.160844 40.14752 8.306680 65.13034 3.899546 -24.98282      9.176458 
1 1 1 -24 24 14 o 12.06356 5.602518 -2.295019      3.957118 -4.475869      5.757028 -0.3419017     5.448158 13.59070 6.449280 15.41152 6.930820 -1.820818      9.467284 
1 1 1 -24 24 15 o 17.56118 6.278479 4.134372       3.399799 5.687580       6.295084 3.494782       4.039594 20.59832 8.253242 17.16363 6.693733 3.434687       10.62648 
1 1 1 -24 24 16 o 23.77364 6.478246 8.358608       3.854609 4.530437       7.936108 9.540540       4.409689 20.48591 8.810052 25.10363 6.964286 -4.617723      11.23024 
1 1 1 -24 24 17 o 28.93189 5.574019 11.77304       3.787375 5.433510       6.564718 14.93586       4.636878 20.41666 8.337963 32.25237 6.123565 -11.83570      10.34503 
1 1 1 -24 24 18 o 11.54810 5.320247 -1.701724      3.464302 3.274531       6.096340 -4.075036      4.210128 18.40481 7.812646 11.43254 5.450616 6.972271       9.526104 
1 1 1 -24 24 19 o 40.34533 4.258710 21.57373       4.123938 10.84644       6.840556 27.69860       5.168861 25.18706 8.916083 45.32985 4.749671 -20.14279      10.10227 
1 1 1 -24 24 20 f 27.41113 5.763044 10.76255       3.727232 6.452687       6.721791 12.67605       4.478856 21.11383 8.504554 29.27677 6.452028 -8.162941      10.67502 
1 1 1 -24 25 1  o 27.16613 6.205054 10.91631       4.017472 18.50786       6.242141 5.547978       5.249140 34.10053 7.695068 19.66470 7.641297 14.43583       10.84451 
1 1 1 -24 25 2  o 16.96865 6.409463 3.741388       3.623528 6.436657       5.748308 1.964228       4.667693 20.72849 8.012309 16.00936 6.817460 4.719131       10.52021 
1 1 1 -24 25 3  o 11.04094 5.187808 -2.671902      3.559043 0.9693806E-02  5.798987 -4.292360      4.507902 15.80583 7.125609 11.75736 5.615024 4.048477       9.072089 
1 1 1 -24 25 4  o 13.40354 5.774006 0.6842250      3.419879 3.914380       5.179536 -1.812369      4.553581 18.22159 7.419510 13.19093 6.085177 5.030659       9.595755 
1 1 1 -24 25 5  o 23.10627 8.082586 8.549445       5.609329 6.974818       6.556974 12.84674       10.83208 21.56272 8.492692 25.89288 10.65747 -4.330166      13.62745 
1 1 1 -24 25 6  o 35.93054 5.339133 17.88848       4.532988 15.56505       7.315884 19.33633       5.775164 29.85526 9.172237 36.08564 6.817173 -6.230385      11.42820 
1 1 1 -24 25 7  o 15.28545 6.170928 2.293486       3.547857 2.005159       5.664198 2.479641       4.551279 17.12490 7.404235 16.48845 6.858482 0.6364517      10.09264 
1 1 1 -24 25 8  o 32.28390 5.228279 14.39345       3.972658 2.502521       6.744756 20.71000       4.915844 18.36268 8.008136 38.71951 5.352978 -20.35683      9.632477 
1 1 1 -24 25 9  o 51.24087 3.845167 34.13313       4.766378 25.09409       8.514316 38.25872       5.752169 38.54669 9.193575 53.72046 4.433388 -15.17377      10.20670 
1 1 1 -24 25 10 o 12.38755 5.782785 -2.619458      4.302779 0.000000       0.000000 -2.619458      4.302779 ?        ?        12.38755 5.782785 0.000000       5.782785 
1 1 1 -24 25 11 o 17.10041 6.262409 3.834483       3.408509 1.255231       5.746999 5.234087       4.233471 16.69846 7.334320 19.26752 6.990871 -2.569063      10.13235 
1 1 1 -24 25 12 o 28.92758 5.613595 11.80382       3.814445 13.82844       6.302769 10.63368       4.791581 28.94667 8.426787 26.25311 7.250570 2.693558       11.11672 
1 1 1 -24 25 13 o 22.66447 6.232422 7.545118       3.549000 -2.796554      5.881260 13.46758       4.450677 14.46269 6.754564 30.49845 6.199943 -16.03576      9.168612 
1 1 1 -24 25 14 o 25.02821 6.937852 9.539788       4.378191 10.52883       6.245323 8.584005       6.139429 25.15681 8.539626 23.12480 8.414598 2.032013       11.98877 
1 1 1 -24 25 15 o 11.55225 5.324781 -1.709374      3.476286 -5.734755      6.756631 -0.2602050     4.054024 14.18425 6.800918 13.55031 6.044618 0.6339312      9.098895 
1 1 1 -24 25 16 o 18.80663 6.383596 5.067533       3.489855 6.726492       5.955956 4.200171       4.306593 21.19622 8.165642 17.99725 6.940843 3.198965       10.71695 
1 1 1 -24 25 17 o 18.14360 6.265823 4.639956       3.365713 3.544719       5.772367 5.204103       4.142826 18.29643 7.675368 19.09937 6.917633 -0.8029366     10.33271 
1 1 1 -24 26 1  o 12.21355 5.380150 0.5726062E-01  3.113412 4.865789       4.970989 -3.046517      3.993760 18.71386 7.387198 11.47983 5.425030 7.234030       9.165241 
1 1 1 -24 26 2  o 21.75308 6.263603 7.129420       3.499774 13.60583       5.932590 3.672535       4.334305 28.39242 8.148736 17.21516 6.864880 11.17725       10.65497 
1 1 1 -24 26 3  o 11.07340 5.091804 -1.438713      3.151985 -3.325063      5.269621 -0.3878540     3.933149 13.24041 6.249342 13.15233 5.903951 0.8808136E-01  8.597145 
1 1 1 -24 26 4  o 11.61868 5.248627 -0.7878066     3.164936 -0.4523934E-01 5.418416 -1.172359      3.899258 15.27179 6.886069 12.55156 5.730849 2.720225       8.958827 
1 1 1 -24 26 5  o 15.98892 6.645253 2.403264       4.267683 3.252042       5.677335 1.300555       6.471097 17.86584 7.559650 17.13383 7.640433 0.7320042      10.74823 
1 1 1 -24 26 6  o 20.38830 6.274882 6.162416       3.422085 1.547648       5.776304 8.658004       4.247774 16.72687 7.349694 23.67568 6.925203 -6.948812      10.09834 
1 1 1 -24 26 7  o 14.17066 5.909535 1.520401       3.391570 -5.676031      5.790705 5.278028       4.184366 12.95786 6.234415 19.13860 6.949328 -6.180739      9.336010 
1 1 1 -24 26 8  o 40.50500 4.473575 21.99227       4.342215 27.92411       7.976306 19.49390       5.176497 41.76983 8.128754 36.87904 5.963398 4.890789       10.08160 
1 1 1 -24 26 9  o 22.75986 6.803402 7.903780       4.063425 5.038144       6.692224 9.577224       5.114059 19.91780 8.303301 24.41800 7.695518 -4.500204      11.32103 
1 1 1 -24 26 10 o 24.75852 7.025722 9.473011       4.434674 0.000000       0.000000 9.473011       4.434674 ?        ?        24.75852 7.025722 0.000000       7.025722 
1 1 1 -24 26 11 o 14.24037 5.952882 1.493516       3.453758 -3.360569      6.219376 3.657888       4.152973 14.49586 6.825709 17.25166 6.769699 -2.755794      9.613487 
1 1 1 -24 26 12 o 15.64101 6.111601 2.804815       3.372758 9.095782       6.017327 -0.7698055E-01 4.072645 23.49794 8.357991 13.67327 6.081522 9.824667       10.33639 
1 1 1 -24 26 13 o 21.08575 6.299099 6.595714       3.484170 4.656982       5.763448 7.712292       4.373892 19.16769 7.818359 22.33960 7.126227 -3.171911      10.57875 
1 1 1 -24 26 14 o 15.94108 6.580011 2.417468       4.144726 5.166199       5.795285 -0.4606312     5.930095 19.62064 7.898959 15.65811 7.117481 3.962531       10.63260 
1 1 1 -23 0  1  o 25.13332 7.036937 9.365230       3.729583 9.365230       3.729583 9.365230       3.729583 25.13332 7.036937 25.13332 7.036937 0.000000       0.000000 
1 1 1 -23 0  2  o 183.9840 5.200848 415.9963       23.27581 415.9963       23.27581 415.9963       23.27581 183.9840 5.200848 183.9840 5.200848 -0.000000      0.000000 
1 1 1 -23 0  3  o 9.913863 6.732371 -2.592371      4.904113 -2.592371      4.904113 -2.592371      4.904113 9.913863 6.732371 9.913863 6.732371 0.000000       0.000000 
1 1 1 -23 0  4  o 85.31596 3.373893 89.32005       6.989547 89.32005       6.989547 89.32005       6.989547 85.31596 3.373893 85.31596 3.373893 -0.000000      0.000000 
1 1 1 -23 0  5  o 40.21746 4.383832 20.47556       4.166921 20.47556       4.166921 20.47556       4.166921 40.21746 4.383832 40.21746 4.383832 -0.000000      0.000000 
1 1 1 -23 0  6  o 88.73366 3.354864 96.56961       7.230785 96.56961       7.230785 96.56961       7.230785 88.73366 3.354864 88.73366 3.354864 -0.000000      0.000000 
1 1 1 -23 0  7  o 76.44746 3.357706 71.78335       6.227676 71.78335       6.227676 71.78335       6.227676 76.44746 3.357706 76.44746 3.357706 0.000000       0.000000 
1 1 1 -23 0  8  o 59.32003 4.519496 43.79204       6.443821 43.79204       6.443821 43.79204       6.443821 59.32003 4.519496 59.32003 4.519496 0.000000       0.000000 
1 1 1 -23 0  9  o 94.01881 4.128376 108.7008       9.417059 108.7008       9.417059 108.7008       9.417059 94.01881 4.128376 94.01881 4.128376 -0.000000      0.000000 
1 1 1 -23 0  10 o 41.63420 6.728367 22.87566       6.291993 22.87566       6.291993 22.87566       6.291993 41.63420 6.728367 41.63420 6.728367 0.000000       0.000000 
1 1 1 -23 0  11 o 201.0834 7.013283 499.5594       34.27146 499.5594       34.27146 499.5594       34.27146 201.0834 7.013283 201.0834 7.013283 -0.000000      0.000000 
1 1 1 -23 0  12 o 57.72551 4.549059 41.52936       6.305159 41.52936       6.305159 41.52936       6.305159 57.72551 4.549059 57.72551 4.549059 -0.000000      0.000000 
1 1 1 -23 0  13 f 61.46956 4.395126 46.93565       6.504819 46.93565       6.504819 46.93565       6.504819 61.46956 4.395126 61.46956 4.395126 -0.000000      0.000000 
1 1 1 -23 0  14 o 54.05724 4.766367 36.61063       6.161484 36.61063       6.161484 36.61063       6.161484 54.05724 4.766367 54.05724 4.766367 -0.000000      0.000000 
1 1 1 -23 0  15 o 99.82047 4.063178 122.4985       9.846445 122.4985       9.846445 122.4985       9.846445 99.82047 4.063178 99.82047 4.063178 0.000000       0.000000 
1 1 1 -23 0  16 o 26.75818 8.448188 11.10127       4.840958 11.10127       4.840958 11.10127       4.840958 26.75818 8.448188 26.75818 8.448188 -0.000000      0.000000 
1 1 1 -23 0  17 o 12.36183 7.552963 1.668463       4.318073 1.668463       4.318073 1.668463       4.318073 12.36183 7.552963 12.36183 7.552963 -0.000000      0.000000 
1 1 1 -23 0  18 o 35.35331 6.469668 16.82453       5.022340 16.82453       5.022340 16.82453       5.022340 35.35331 6.469668 35.35331 6.469668 0.000000       0.000000 
1 1 1 -23 0  19 o 24.49289 11.69756 11.14065       8.001018 11.14065       8.001018 11.14065       8.001018 24.49289 11.69756 24.49289 11.69756 0.000000       0.000000 
1 1 1 -23 0  20 f 9.513717 6.719705 -7.461562      6.291562 -7.461562      6.291562 -7.461562      6.291562 9.513717 6.719705 9.513717 6.719705 -0.000000      0.000000 
1 1 1 -23 0  21 o 16.17696 8.600780 4.735868       4.581868 4.735868       4.581868 4.735868       4.581868 16.17696 8.600780 16.17696 8.600780 -0.000000      0.000000 
1 1 1 -23 0  22 o 35.65569 6.710807 17.26780       5.227814 17.26780       5.227814 17.26780       5.227814 35.65569 6.710807 35.65569 6.710807 -0.000000      0.000000 
1 1 1 -23 0  23 o 9.631704 6.519598 -2.115016      4.524592 -2.115016      4.524592 -2.115016      4.524592 9.631704 6.519598 9.631704 6.519598 0.000000       0.000000 
1 1 1 -23 0  24 o 79.37303 4.285517 78.12780       8.233621 78.12780       8.233621 78.12780       8.233621 79.37303 4.285517 79.37303 4.285517 0.000000       0.000000 
1 1 1 -23 0  25 o 17.05194 9.864956 4.840646       6.653590 4.840646       6.653590 4.840646       6.653590 17.05194 9.864956 17.05194 9.864956 -0.000000      0.000000 
1 1 1 -23 0  26 o 38.09972 6.796495 19.70378       5.712334 19.70378       5.712334 19.70378       5.712334 38.09972 6.796495 38.09972 6.796495 0.000000       0.000000 
1 1 1 -23 0  27 o 10.60215 6.992302 -0.7046673     4.641441 -0.7046673     4.641441 -0.7046673     4.641441 10.60215 6.992302 10.60215 6.992302 -0.000000      0.000000 
1 1 1 -23 0  28 o 8.977275 6.238512 -3.960747      4.813083 -3.960747      4.813083 -3.960747      4.813083 8.977275 6.238512 8.977275 6.238512 -0.000000      0.000000 
1 1 1 -23 0  29 o 18.34204 9.573436 6.532504       5.594960 6.532504       5.594960 6.532504       5.594960 18.34204 9.573436 18.34204 9.573436 -0.000000      0.000000 
1 1 1 -23 0  30 o 21.04823 9.556973 8.426376       5.296825 8.426376       5.296825 8.426376       5.296825 21.04823 9.556973 21.04823 9.556973 -0.000000      0.000000 
1 1 1 -23 0  31 o 39.58984 7.342653 21.92000       6.367754 21.92000       6.367754 21.92000       6.367754 39.58984 7.342653 39.58984 7.342653 0.000000       0.000000 
1 1 1 -23 0  32 f 8.277347 6.021330 -14.05026      6.924328 -14.05026      6.924328 -14.05026      6.924328 8.277347 6.021330 8.277347 6.021330 0.000000       0.000000 
1 1 1 -23 0  33 o 12.24553 7.846338 0.9916767      5.283424 0.9916767      5.283424 0.9916767      5.283424 12.24553 7.846338 12.24553 7.846338 -0.000000      0.000000 
1 1 1 -23 0  34 o 14.74505 9.492206 1.955860       7.848088 1.955860       7.848088 1.955860       7.848088 14.74505 9.492206 14.74505 9.492206 0.000000       0.000000 
1 1 1 -23 0  35 o 16.38062 9.033935 5.489419       5.238766 5.489419       5.238766 5.489419       5.238766 16.38062 9.033935 16.38062 9.033935 -0.000000      0.000000 
1 1 1 -23 0  36 o 18.25704 10.45296 7.323660       7.355506 7.323660       7.355506 7.323660       7.355506 18.25704 10.45296 18.25704 10.45296 -0.000000      0.000000 
1 1 1 -23 0  37 o 9.735340 6.687440 -2.495445      5.149968 -2.495445      5.149968 -2.495445      5.149968 9.735340 6.687440 9.735340 6.687440 -0.000000      0.000000 
1 1 1 -23 0  38 o 10.13298 6.863505 -1.392871      5.031270 -1.392871      5.031270 -1.392871      5.031270 10.13298 6.863505 10.13298 6.863505 -0.000000      0.000000 
1 1 1 -23 0  39 o 13.52478 8.422607 2.961246       5.618781 2.961246       5.618781 2.961246       5.618781 13.52478 8.422607 13.52478 8.422607 -0.000000      0.000000 
1 1 1 -23 1  1  o 96.21286 2.737990 113.2897       6.412971 115.5620       7.955372 109.0732       10.83721 97.06444 3.368394 93.98766 4.747000 3.076782       5.820661 
1 1 1 -23 1  2  o 66.36557 2.492667 53.89465       4.024117 53.31115       5.618454 54.50928       5.766350 65.86641 3.513101 66.59601 3.566182 -0.7295990     5.005949 
1 1 1 -23 1  3  o 200.1028 3.331942 490.2960       16.24751 485.3304       26.12641 493.4273       20.74735 198.2165 5.413906 200.4322 4.247752 -2.215668      6.881408 
1 1 1 -23 1  4  o 192.5146 3.256968 453.6534       15.27964 449.0669       24.62957 456.5231       19.48181 190.7489 5.303719 192.8492 4.145483 -2.100372      6.731602 
1 1 1 -23 1  5  o 56.74290 2.593092 39.42404       3.576154 33.09279       4.909968 46.57752       5.219062 51.80190 3.918590 61.57172 3.492688 -9.769821      5.249211 
1 1 1 -23 1  6  o 92.62463 2.356154 104.8433       5.313901 101.4672       7.440220 108.3587       7.592063 90.98056 3.361619 94.03057 3.318455 -3.050011      4.723625 
1 1 1 -23 1  7  o 28.75863 4.236341 10.36421       2.880057 6.691555       4.642478 12.66199       3.672096 23.28796 7.331151 31.71869 4.909200 -8.430729      8.823039 
1 1 1 -23 1  8  o 107.8319 2.609375 142.0741       6.856772 148.9003       11.21534 137.9997       8.664748 110.0720 4.188830 106.1255 3.354640 3.946457       5.366554 
1 1 1 -23 1  9  o 51.11505 3.558349 32.15346       4.404669 25.18390       6.749581 37.32316       5.813083 44.66261 6.382810 54.95946 4.376505 -10.29685      7.739125 
1 1 1 -23 1  10 o 80.04046 3.208178 78.51850       6.244868 77.97821       9.898522 78.87573       8.048826 79.40118 5.143402 80.06774 4.139193 -0.6665573     6.602083 
1 1 1 -23 1  11 o 22.19404 6.117432 6.285322       3.414711 4.029928       4.503433 9.335956       5.237542 19.78692 7.205769 26.98158 7.628040 -7.194654      10.49334 
1 1 1 -23 1  12 o 164.4439 3.712329 331.4622       14.87649 322.0983       18.31575 349.6156       25.50201 161.7657 4.651074 167.8655 6.245032 -6.099762      7.786714 
1 1 1 -23 1  13 o 91.00832 2.831466 101.3784       6.271911 95.89197       8.804114 107.0318       8.937022 88.28651 4.103409 93.31835 3.938832 -5.031837      5.687913 
1 1 1 -23 1  14 o 99.45773 2.880943 121.0964       6.975117 127.3102       10.11191 115.4561       9.634045 101.7401 4.086858 96.87927 4.089967 4.860802       5.781888 
1 1 1 -23 1  15 o 114.0798 2.928269 159.3450       8.133858 156.5147       11.58424 162.0973       11.42347 112.7659 4.223008 114.7976 4.090002 -2.031738      5.878937 
1 1 1 -23 1  16 f 96.59472 2.885209 114.2806       6.783903 115.6069       9.740225 113.0312       9.453954 96.89057 4.134767 95.82191 4.057858 1.068657       5.793316 
1 1 1 -23 1  17 o 139.8818 3.047613 239.6326       10.38860 240.9716       14.81674 238.3380       14.56977 139.8365 4.353368 139.0873 4.303801 0.7492218      6.121643 
1 1 1 -23 1  18 o 121.0794 2.945918 179.5383       8.692147 184.5141       12.46339 174.8264       12.12855 122.3604 4.185999 119.1014 4.185347 3.259041       5.919436 
1 1 1 -23 1  19 o 94.06828 3.431523 108.7560       7.853040 111.8279       9.616905 102.6081       13.60488 95.19924 4.155403 90.48242 6.207744 4.716820       7.470171 
1 1 1 -23 1  20 o 27.76188 6.105088 9.986881       4.017653 11.03880       7.797503 9.606679       4.687821 29.41949 9.527369 27.12293 7.033963 2.296564       11.84261 
1 1 1 -23 1  21 o 71.52219 3.000205 62.85592       5.217497 52.43599       7.289049 73.80444       7.471650 64.92395 4.637665 77.27309 3.981244 -12.34914      6.112139 
1 1 1 -23 1  22 o 19.21603 6.123796 4.573167       3.230542 6.783845       4.676147 2.554651       4.468291 23.18553 7.365183 17.89244 7.021742 5.293091       10.17599 
1 1 1 -23 1  23 o 30.84514 5.078251 12.15013       3.684409 10.04731       5.116704 14.41461       5.309738 27.55983 7.444517 33.16113 6.799110 -5.601297      10.08210 
1 1 1 -23 1  24 o 58.19629 3.368966 41.87092       4.757376 33.83588       6.783966 49.64593       6.673291 51.66459 5.471387 63.08855 4.367597 -11.42396      7.000856 
1 1 1 -23 1  25 o 63.73771 4.446402 50.81910       6.862923 60.55614       10.16100 42.65093       9.306478 68.83588 6.121161 57.37207 6.787865 11.46381       9.140226 
1 1 1 -23 1  26 o 25.86495 5.932601 8.823992       3.659607 10.86137       5.376352 7.065012       4.995536 28.34081 7.620517 23.41804 7.628960 4.922768       10.78301 
1 1 1 -23 1  27 o 51.10544 3.654160 32.58003       4.520801 32.59470       6.598865 32.56706       6.205965 50.41205 5.458518 50.54514 5.108453 -0.1330948     7.476076 
1 1 1 -23 1  28 o 37.49979 4.560249 17.93212       4.081717 19.20902       6.072497 16.87974       5.512839 37.85933 6.833394 35.53824 6.608839 2.321091       9.506420 
1 1 1 -23 1  29 o 39.20873 4.532497 19.65495       4.251038 18.31666       6.077258 20.93717       5.948559 36.66947 7.057026 39.62759 6.376252 -2.958115      9.510952 
1 1 1 -23 1  30 o 41.99763 4.278721 22.50255       4.317907 18.38814       6.060062 26.74537       6.153904 36.55189 7.059067 45.06399 5.733467 -8.512100      9.094123 
1 1 1 -23 1  31 o 20.80409 7.080441 5.722454       4.293691 2.445636       5.346324 11.67578       7.206241 18.12373 7.476303 28.05429 9.164367 -9.930557      11.82712 
1 1 1 -23 1  32 o 44.82524 5.113300 26.37155       5.485700 24.46165       9.543489 27.31397       6.703887 39.45295 9.934077 44.82807 6.311266 -5.375122      11.76937 
1 1 1 -23 1  33 o 30.09222 6.698266 12.79336       4.785537 16.10166       5.966992 6.829357       8.011655 33.29320 7.531451 23.29397 9.318412 9.999228       11.98147 
1 1 1 -23 1  34 o 35.20719 5.165112 16.61257       4.299754 14.62511       6.027431 18.67196       6.135552 31.16583 7.920878 35.87886 7.266865 -4.713032      10.74931 
1 1 1 -23 1  35 o 22.06742 6.658676 7.054026       3.878868 6.813444       5.552771 7.283300       5.420709 21.79848 7.991425 22.28883 7.932318 -0.4903488     11.25986 
1 1 1 -23 1  36 o 17.05042 7.191749 2.362399       5.111587 -0.3307129     7.601338 4.585526       6.906294 17.61962 8.028183 20.10510 8.412154 -2.485489      11.62824 
1 1 1 -23 1  37 o 34.73957 5.231696 16.66656       4.291673 15.47384       6.171475 17.78347       5.972117 30.94852 8.092876 33.98396 7.419907 -3.035433      10.97951 
1 1 1 -23 1  38 o 13.20552 5.865973 -0.7926402E-01 3.776842 5.062156       5.466386 -4.775473      5.224352 19.30175 7.705290 12.55278 6.008405 6.748974       9.770999 
1 1 1 -23 2  1  o 101.0772 2.421612 124.8410       5.964770 123.8797       8.298964 125.8683       8.578919 100.4924 3.393735 101.2790 3.481153 -0.7865677     4.861672 
1 1 1 -23 2  2  o 80.78638 2.436232 79.81384       4.790670 79.41064       6.642034 80.25101       6.916351 80.44294 3.395901 80.84711 3.518989 -0.4041672     4.890340 
1 1 1 -23 2  3  o 81.39763 2.437273 81.01727       4.829059 83.73323       6.779199 78.21947       6.880570 82.61859 3.374266 79.81895 3.546238 2.799637       4.895046 
1 1 1 -23 2  4  o 196.9507 2.964045 474.4494       14.22585 470.7953       20.01293 478.1816       20.22555 195.8148 4.194006 197.3407 4.205791 -1.525848      5.939559 
1 1 1 -23 2  5  f 116.0224 2.740212 164.5446       7.747507 160.4613       12.67522 166.9800       9.788992 114.1607 4.565407 116.7193 3.445363 -2.558571      5.719569 
1 1 1 -23 2  6  o 62.86467 2.890504 48.42299       4.416238 55.87335       7.637437 44.68063       5.412919 67.24761 4.689917 60.27035 3.703342 6.977264       5.975790 
1 1 1 -23 2  7  o 97.57828 2.613164 116.4278       6.208189 115.3414       9.948752 117.1206       7.944845 96.84454 4.225752 97.75878 3.339887 -0.9142380     5.386263 
1 1 1 -23 2  8  o 50.74998 3.114125 31.62532       3.832762 33.61283       6.957263 30.75930       4.592494 51.89924 5.588997 49.95248 3.801272 1.946762       6.759183 
1 1 1 -23 2  9  o 68.08942 3.254216 56.86656       5.383977 52.42722       8.542061 59.79256       6.934902 64.97574 5.444826 69.68964 4.101669 -4.713898      6.816877 
1 1 1 -23 2  10 o 126.2473 2.985541 194.9303       9.185041 202.5041       13.45035 188.3120       12.57319 128.3467 4.306538 123.7960 4.173730 4.550743       5.997190 
1 1 1 -23 2  11 o 144.8474 3.112423 256.7023       10.98615 275.3044       16.24331 241.0181       14.91505 149.6132 4.460195 140.0030 4.377089 9.610245       6.249179 
1 1 1 -23 2  12 o 85.97174 3.243018 90.60027       6.782065 89.08969       8.729789 92.90000       10.77135 85.07327 4.224107 86.67349 5.122581 -1.600220      6.639573 
1 1 1 -23 2  13 o 38.42548 3.974309 18.30872       3.667840 22.18204       5.393255 14.97576       5.002929 42.06258 5.384966 34.25357 6.222656 7.809006       8.229174 
1 1 1 -23 2  14 o 113.5279 2.903812 157.7722       8.026947 159.2882       11.55608 156.3588       11.15802 113.7920 4.174450 112.7667 4.067072 1.025322       5.828132 
1 1 1 -23 2  15 f 58.55207 3.172499 42.10374       4.509773 40.35439       6.586329 43.64782       6.187868 57.03126 4.783107 59.42657 4.302041 -2.395306      6.433169 
1 1 1 -23 2  16 o 89.57481 2.900542 98.29825       6.323073 100.6366       9.226705 96.22762       8.682445 90.36749 4.201347 88.39906 4.041183 1.968430       5.829449 
1 1 1 -23 2  17 o 42.45681 3.766173 22.30641       3.856198 17.64257       5.648877 26.37649       5.277063 37.11762 6.480873 45.99781 4.777311 -8.880184      8.051361 
1 1 1 -23 2  18 o 19.38566 6.823695 4.186334       4.002243 4.663800       4.910278 3.241306       6.908086 20.85502 7.534225 21.60225 8.649067 -0.7472363     11.47044 
1 1 1 -23 2  19 o 181.4331 4.006796 405.1802       17.71536 417.3407       22.01015 382.8116       29.85157 183.6006 4.923854 174.3983 7.038530 9.202255       8.589833 
1 1 1 -23 2  20 o 21.28935 6.668007 5.665914       3.845408 -0.6775972     7.906659 7.631266       4.400970 19.95744 8.687551 24.32589 7.029850 -4.368454      11.17552 
1 1 1 -23 2  21 f 68.05494 3.540737 57.11613       5.851851 53.90796       10.85843 58.42929       6.947009 65.00529 6.962955 68.67707 4.170634 -3.671776      8.116461 
1 1 1 -23 2  22 o 25.30676 5.806516 8.326652       3.504725 9.786884       5.153939 7.070614       4.780016 27.26793 7.515411 23.60357 7.440092 3.664364       10.57527 
1 1 1 -23 2  23 o 69.59368 3.107358 59.64870       5.256548 58.04826       7.686502 61.05476       7.204636 68.20205 4.652686 70.09283 4.237755 -1.890778      6.293334 
1 1 1 -23 2  24 o 52.31350 3.910261 34.04207       4.948826 26.12745       8.606283 37.95185       6.048903 44.19923 8.294913 55.05890 4.548853 -10.85967      9.460320 
1 1 1 -23 2  25 o 12.66153 5.566488 -0.6923165     3.317607 3.478412       5.108387 -3.734593      4.362919 19.47166 7.545926 12.53095 5.840864 6.940704       9.542363 
1 1 1 -23 2  26 o 79.21075 3.579952 77.84366       6.892448 76.44513       8.550690 80.43805       11.64617 78.08483 4.512867 79.21258 6.079744 -1.127747      7.571609 
1 1 1 -23 2  27 o 24.55001 6.246663 8.039369       3.745675 2.528381       5.614945 12.45825       5.027907 18.97547 7.725597 30.40320 6.939641 -11.42773      10.38477 
1 1 1 -23 2  28 o 43.72969 4.222268 24.17039       4.443547 21.53700       6.602096 26.35123       6.008073 40.02533 7.024896 45.09472 5.586694 -5.069393      8.975540 
1 1 1 -23 2  29 f 80.09489 3.220787 79.77560       6.273593 80.22141       9.103577 79.37238       8.657613 79.40522 4.726025 79.13295 4.508221 0.2722702      6.531414 
1 1 1 -23 2  30 o 42.03677 4.343797 22.58328       4.385721 18.08165       6.335208 26.72613       6.077507 35.98305 7.469564 45.07651 5.656984 -9.093464      9.369945 
1 1 1 -23 2  31 o 49.89496 4.534624 32.01331       5.453419 27.81096       6.862027 39.21758       8.984650 45.34503 6.386630 53.38732 7.080401 -8.042294      9.535257 
1 1 1 -23 2  32 o 18.70417 7.228151 3.848867       4.677403 6.757242       8.297603 2.494240       5.662880 23.63362 9.473393 18.37223 7.646864 5.261395       12.17455 
1 1 1 -23 2  33 o 31.56716 5.626266 13.51978       4.169316 5.222449       5.814360 22.30192       5.981811 20.75930 8.048954 40.25506 6.304636 -19.49575      10.22419 
1 1 1 -23 2  34 o 29.79429 5.985182 12.34493       4.194561 19.24903       6.113379 6.203429       5.765873 36.53669 7.122202 21.47849 8.091265 15.05820       10.77935 
1 1 1 -23 2  35 o 22.25744 6.952367 7.243551       4.183305 3.199384       6.889241 9.605678       5.265122 19.37742 8.268023 25.06476 7.795105 -5.687336      11.36327 
1 1 1 -23 2  36 o 14.31045 6.232955 0.5223703      4.074837 0.2498902      5.430628 0.8734367      6.164208 15.79136 7.023164 16.96506 7.517244 -1.173699      10.28755 
1 1 1 -23 2  37 o 17.92025 7.007850 4.039706       4.437444 4.166439       8.424779 3.991047       5.220259 20.32013 8.903885 18.36526 7.459518 1.954878       11.61566 
1 1 1 -23 2  38 o 28.11936 6.248106 11.69121       4.170278 6.951739       5.894389 16.44122       5.900942 21.19250 8.133872 32.13034 7.647448 -10.93784      11.16438 
1 1 1 -23 3  1  o 35.55157 3.416559 15.63007       2.923549 18.19876       3.959043 12.54950       4.335616 38.23213 4.325254 31.33420 5.894289 6.897936       7.310982 
1 1 1 -23 3  2  o 152.5987 2.662321 284.6919       9.900277 291.1148       14.02563 278.3137       13.97671 154.0589 3.735936 150.5659 3.812341 3.492981       5.337711 
1 1 1 -23 3  3  o 197.1754 2.983159 475.6497       14.33393 471.7800       20.12695 479.6324       20.41868 195.9740 4.214473 197.5882 4.240631 -1.614197      5.978690 
1 1 1 -23 3  4  o 201.6339 3.010603 497.3788       14.79290 515.9169       21.22953 479.8827       20.62422 204.9473 4.250718 197.6488 4.282007 7.298492       6.033588 
1 1 1 -23 3  5  o 89.85134 2.394506 98.68390       5.238289 97.73512       7.336466 99.67064       7.481790 89.27668 3.378291 90.15192 3.411763 -0.8752365     4.801352 
1 1 1 -23 3  6  o 72.80618 3.182669 64.98966       5.633071 67.43453       14.79486 64.57515       6.091915 72.82874 8.495643 72.53284 3.456484 0.2959061      9.171871 
1 1 1 -23 3  7  o 190.6571 4.088867 446.0561       18.99731 0.000000       0.000000 446.0561       18.99731 ?        ?        190.6571 4.088867 0.000000       4.088867 
1 1 1 -23 3  8  o 148.1615 3.094994 268.5575       11.17458 238.6212       20.18456 281.7879       13.41859 138.7710 5.982821 151.6518 3.630973 -12.88087      6.998436 
1 1 1 -23 3  9  o 72.29403 2.998935 64.03329       5.271831 61.48991       7.729007 66.24603       7.209105 70.59319 4.516572 73.37112 4.047680 -2.777924      6.064911 
1 1 1 -23 3  10 o 211.6075 3.751424 548.8963       19.34476 543.0914       27.53614 554.5530       27.18254 209.7475 5.391759 212.0796 5.259626 -2.332169      7.532247 
1 1 1 -23 3  11 o 79.75214 2.897962 77.88416       5.622747 84.20964       8.449565 72.85694       7.532710 82.71005 4.205988 76.95097 4.031050 5.759087       5.825778 
1 1 1 -23 3  12 o 99.69662 2.903566 121.6669       7.046692 125.5555       10.39712 118.3630       9.583579 101.0191 4.232888 98.12561 4.016318 2.893471       5.835080 
1 1 1 -23 3  13 o 88.29683 3.270959 95.59586       7.025949 101.4359       9.236331 87.57586       10.82381 90.77790 4.186530 84.06829 5.310516 6.709610       6.762294 
1 1 1 -23 3  14 o 25.24182 5.648543 8.186853       3.387583 8.779271       5.219222 7.755608       4.453020 26.21034 7.679048 24.62995 7.056993 1.580393       10.42923 
1 1 1 -23 3  15 o 86.30587 2.898432 91.24888       6.087276 98.68551       9.093249 85.21008       8.194192 89.50272 4.180695 83.18163 4.054646 6.321091       5.823947 
1 1 1 -23 3  16 o 141.3146 3.077151 244.5583       10.59673 244.6083       15.34751 244.5127       14.64896 140.8632 4.476678 140.9090 4.271041 -0.4577637E-01 6.187281 
1 1 1 -23 3  17 o 81.50976 2.928391 81.44946       5.807222 87.40617       8.624515 76.50869       7.854669 84.16994 4.218207 78.76089 4.106615 5.409050       5.887067 
1 1 1 -23 3  18 o 193.6504 4.153604 461.6896       19.60106 468.3766       24.21931 448.9945       33.37065 194.4661 5.115157 188.8467 7.264905 5.619400       8.885026 
1 1 1 -23 3  19 o 87.75179 2.919119 94.44635       6.233600 112.6245       9.586916 81.13161       8.204844 95.52888 4.127950 81.04095 4.168612 14.48793       5.866626 
1 1 1 -23 3  20 o 49.05758 3.528452 29.72966       4.190015 31.06926       6.215233 28.61361       5.672976 49.76882 5.201353 47.80905 4.940363 1.959766       7.173650 
1 1 1 -23 3  21 o 42.31461 4.428775 22.37605       4.499218 29.37553       9.198250 20.17470       5.158433 47.27800 8.285673 39.89519 5.448117 7.382805       9.916368 
1 1 1 -23 3  22 o 45.38433 3.787884 25.57028       4.151107 23.32006       6.281482 27.31491       5.530978 42.65359 6.226790 46.62437 4.943248 -3.970772      7.950385 
1 1 1 -23 3  23 o 35.73742 4.443945 16.07667       3.786786 9.023669       5.791918 21.34249       5.004588 26.32306 8.174061 41.06249 5.111713 -14.73943      9.640793 
1 1 1 -23 3  24 o 137.9060 3.533836 234.8665       11.86609 223.8048       20.58257 240.3733       14.52240 132.6236 6.387359 139.0753 4.290143 -6.451706      7.694393 
1 1 1 -23 3  25 o 48.19679 3.705994 28.91024       4.319304 27.79940       6.654130 29.71912       5.678145 46.47425 6.016528 48.50867 4.869201 -2.034424      7.740008 
1 1 1 -23 3  26 o 33.87672 5.756438 14.93074       4.582293 10.74559       5.890460 21.34508       7.292390 28.11703 8.135166 39.75959 7.805237 -11.64256      11.27398 
1 1 1 -23 3  27 f 140.7586 3.170464 244.9494       10.87512 242.0899       15.84059 247.4988       14.95691 138.6741 4.694252 140.5139 4.373362 -1.839859      6.415785 
1 1 1 -23 3  28 o 86.45854 3.083351 92.61195       6.485913 84.43598       9.378580 100.1067       8.979370 81.63544 4.734671 89.30857 4.137121 -7.673126      6.287518 
1 1 1 -23 3  29 o 17.98970 6.495856 3.766589       3.649514 -0.2711025     5.325720 7.341210       5.011027 16.15729 7.079562 23.37262 7.642519 -7.215332      10.41769 
1 1 1 -23 3  30 o 18.60975 6.968634 3.905185       4.263138 7.302340       5.797629 -0.9406622E-01 6.290455 23.39610 8.214651 17.42183 7.661931 5.974266       11.23324 
1 1 1 -23 3  31 f 71.25821 3.860096 64.21900       6.677972 57.80199       8.394720 75.27822       11.02052 66.59989 5.213988 75.21203 6.064196 -8.612137      7.997509 
1 1 1 -23 3  32 o 54.94661 4.464257 38.89462       5.926139 23.65516       10.52327 45.97206       7.171400 37.78307 10.85565 59.36143 5.004064 -21.57836      11.95348 
1 1 1 -23 3  33 o 21.20156 6.691654 6.265276       3.865520 2.018109       5.503812 10.39970       5.430270 17.66225 7.456861 26.49974 7.851085 -8.837484      10.82794 
1 1 1 -23 3  34 o 27.30865 6.226742 10.53140       4.051526 10.43598       5.824373 10.62085       5.639542 26.13018 8.209504 26.42503 8.040603 -0.2948418     11.49118 
1 1 1 -23 3  35 o 24.28333 7.202650 8.806331       4.568218 13.56325       7.637804 6.156824       5.700177 28.40899 9.442040 21.12160 8.025013 7.287392       12.39165 
1 1 1 -23 3  36 o 29.78169 6.738114 13.11291       4.775503 10.41727       6.060412 17.52823       7.756258 25.34832 8.410270 31.89222 9.365951 -6.543896      12.58784 
1 1 1 -23 3  37 o 25.21778 6.527531 9.504697       4.042224 20.26015       6.272381 1.864902       5.286386 36.40630 7.323986 16.62267 7.169906 19.78363       10.24931 
1 1 1 -23 3  38 o 23.97972 7.362911 9.150620       4.715119 12.19244       9.118988 8.040594       5.508668 25.26614 9.995411 22.30320 7.989824 2.962938       12.79631 
1 1 1 -23 4  1  o 140.6480 2.595465 241.8687       8.895798 252.6419       12.64486 231.3118       12.51723 143.4671 3.619699 137.2373 3.746334 6.229828       5.209342 
1 1 1 -23 4  2  o 82.68781 2.483733 83.63590       4.999078 92.47070       7.050166 74.70219       7.089528 86.81537 3.338696 77.94414 3.743426 8.871231       5.015986 
1 1 1 -23 4  3  o 144.1384 2.803500 254.0838       9.847281 253.4845       12.85083 254.9363       15.32623 143.7320 3.671953 143.9334 4.374637 -0.2014008     5.711452 
1 1 1 -23 4  4  f 132.7428 2.542177 215.3347       8.223430 214.8338       11.65619 215.8310       11.60336 132.3396 3.617748 132.6526 3.592792 -0.3130951     5.098652 
1 1 1 -23 4  5  o 100.6955 2.536788 123.9798       6.219913 129.6402       9.378571 119.5352       8.310527 102.7583 3.751571 98.72343 3.459744 4.034882       5.103343 
1 1 1 -23 4  6  f 130.7812 2.966540 209.2088       9.454352 212.8940       17.75927 207.7513       11.16853 131.1765 5.568294 130.1746 3.523979 1.001831       6.589714 
1 1 1 -23 4  7  o 65.38284 3.847231 52.60175       6.102736 44.19134       14.03811 54.56159       6.776581 58.14552 10.28345 66.53217 4.201129 -8.386658      11.10850 
1 1 1 -23 4  8  o 74.79122 3.001261 68.53270       5.458930 73.18480       8.242990 64.89854       7.285547 77.05267 4.408362 72.59675 4.135318 4.455917       6.044378 
1 1 1 -23 4  9  o 192.8601 3.195081 455.2234       15.01621 471.4041       24.55689 445.5599       18.97772 195.4954 5.159177 190.5329 4.087315 4.962509       6.582040 
1 1 1 -23 4  10 o 80.58817 2.620829 79.45458       5.140059 79.02632       8.537242 79.69810       6.437631 80.07693 4.391775 80.61853 3.283711 -0.5416031     5.483653 
1 1 1 -23 4  11 o 219.7929 3.833152 592.5143       20.53080 638.2471       30.59576 555.0531       27.69094 227.3146 5.523290 211.9993 5.364337 15.31528       7.699535 
1 1 1 -23 4  12 o 99.72008 2.883350 121.7302       6.999385 133.1830       10.59753 112.8685       9.321951 104.0454 4.188265 95.80991 4.001450 8.235512       5.792510 
1 1 1 -23 4  13 o 132.8337 3.473462 216.3829       11.23399 215.9043       14.34369 217.1424       18.06780 132.4138 4.451529 132.3847 5.613299 0.2912903E-01  7.164164 
1 1 1 -23 4  14 o 117.0477 3.369446 168.0144       9.600752 167.1469       12.26745 169.3854       15.42289 116.5007 4.328582 116.9262 5.427558 -0.4254761     6.942262 
1 1 1 -23 4  15 o 35.24526 4.207793 15.48651       3.542719 12.58125       5.448460 17.61454       4.663052 31.10032 7.312829 37.40219 5.261307 -6.301872      9.008819 
1 1 1 -23 4  16 o 54.01357 3.287670 35.88928       4.306906 42.15030       6.710288 31.50315       5.616420 58.26500 4.767695 50.34677 4.629542 7.918224       6.645568 
1 1 1 -23 4  17 o 145.5537 3.684566 260.3487       13.05859 253.9172       15.90012 273.6770       22.88924 143.4220 4.555116 148.0035 6.361189 -4.581543      7.823925 
1 1 1 -23 4  18 o 21.80573 6.136698 6.094114       3.397764 9.579095       5.565532 4.023467       4.290023 27.20755 7.918083 19.45802 7.040573 7.749527       10.59555 
1 1 1 -23 4  19 o 61.49144 3.181379 46.50491       4.751021 55.63960       7.474932 40.31346       6.153985 66.94968 4.609796 56.97348 4.468212 9.976196       6.419902 
1 1 1 -23 4  20 o 89.50359 2.955775 98.33347       6.438015 92.10219       9.423055 103.7885       8.816626 86.19719 4.501635 91.69103 3.955142 -5.493843      5.992317 
1 1 1 -23 4  21 o 120.9973 3.439082 180.2032       10.13010 195.3342       19.45521 174.5751       11.86546 124.4312 6.437984 118.8374 4.103435 5.593857       7.634514 
1 1 1 -23 4  22 o 29.04281 5.199485 10.81359       3.544760 14.37112       5.745556 8.627286       4.504159 32.98778 7.336891 25.64515 7.008835 7.342630       10.14661 
1 1 1 -23 4  23 o 110.8575 3.348331 151.4812       9.035071 152.3976       16.37199 151.0799       10.83425 109.7142 6.148130 110.4252 4.032970 -0.7109299     7.352847 
1 1 1 -23 4  24 o 63.44783 3.209409 49.70850       4.946126 45.65139       7.436418 52.92724       6.623673 60.17986 5.119348 65.17528 4.192661 -4.995419      6.617109 
1 1 1 -23 4  25 o 16.44191 6.111217 2.756186       3.266569 3.139695       5.319485 2.524023       4.138845 19.34354 7.639888 17.28177 6.765090 2.061773       10.20462 
1 1 1 -23 4  26 o 53.89613 4.290576 36.46956       5.588715 28.75147       6.960760 50.46994       9.375010 47.03788 6.225260 62.50190 6.238452 -15.46402      8.813181 
1 1 1 -23 4  27 o 53.21864 3.501033 35.28399       4.515203 34.36699       7.040060 35.92476       5.884986 51.60769 5.692368 53.29409 4.575622 -1.686398      7.303380 
1 1 1 -23 4  28 o 37.28108 4.568214 17.75876       4.063594 16.45380       6.310815 18.68305       5.311182 34.50058 7.701498 37.66014 5.987471 -3.159565      9.755146 
1 1 1 -23 4  29 o 21.77102 7.171317 6.261746       4.408820 0.6533712E-01  5.724940 15.29239       6.911307 16.91791 7.377989 32.59679 8.583761 -15.67888      11.31882 
1 1 1 -23 4  30 o 45.67139 4.790846 26.92258       5.252759 21.71896       6.796450 34.64161       8.277708 39.54242 7.322760 50.45049 6.914746 -10.90807      10.07157 
1 1 1 -23 4  31 o 20.60575 6.761899 5.701203       3.921215 -0.7854438     5.715945 11.46772       5.389328 16.10926 7.182354 28.23402 7.646096 -12.12477      10.49042 
1 1 1 -23 4  32 o 55.52998 4.335328 39.62621       5.820123 21.02951       10.30578 48.33486       7.052419 35.46792 10.88446 61.02536 4.780457 -25.55745      11.88799 
1 1 1 -23 4  33 o 16.82603 6.467283 3.085856       3.730079 6.191772       5.508349 0.4554066      5.069225 21.52608 7.947784 15.92235 6.943243 5.603726       10.55348 
1 1 1 -23 4  34 o 14.69026 6.211517 1.102626       3.828463 -2.309509      5.312230 4.790112       5.522413 14.31422 6.592267 19.89989 7.807188 -5.585667      10.21813 
1 1 1 -23 4  35 o 11.65761 5.524391 -3.826427      4.196255 -3.722100      6.948686 -3.886312      5.264626 15.51016 7.275421 13.29703 6.266989 2.213134       9.602442 
1 1 1 -23 4  36 o 23.43153 7.238075 8.383099       4.548277 7.634260       5.738206 9.648692       7.459833 22.31409 8.132682 24.22876 9.186314 -1.914673      12.26902 
1 1 1 -23 4  37 o 32.18719 5.877260 14.80517       4.440113 3.434104       6.227944 26.55894       6.331881 18.53053 7.882412 42.93280 6.234217 -24.40227      10.04977 
1 1 1 -23 4  38 o 25.51828 7.183936 10.26391       4.655562 10.84886       8.477250 10.01129       5.570839 24.34794 9.635672 24.50798 8.060601 -0.1600361     12.56262 
1 1 1 -23 5  1  o 144.5072 2.637428 255.3894       9.287655 253.6380       12.94349 257.2482       13.33470 143.7062 3.699143 144.6991 3.784899 -0.9929199     5.292364 
1 1 1 -23 5  2  o 52.13018 2.824292 33.34326       3.574457 32.57221       4.841000 34.26754       5.300251 51.36031 3.896949 52.63876 4.165890 -1.278454      5.704459 
1 1 1 -23 5  3  o 86.81566 2.568343 92.21124       5.427619 100.0503       8.050372 85.67844       7.349098 90.24522 3.668273 83.51030 3.619850 6.734924       5.153595 
1 1 1 -23 5  4  o 111.7606 2.814763 152.8586       7.659860 152.2299       10.52821 153.5656       11.16518 111.3096 3.887346 111.7435 4.107210 -0.4339142     5.655142 
1 1 1 -23 5  5  o 142.5557 3.162299 248.7644       10.98559 249.8752       15.81542 247.7288       15.27084 142.4472 4.561954 141.8787 4.422222 0.5685730      6.353540 
1 1 1 -23 5  6  o 47.86490 3.539330 28.22528       4.099124 30.32487       5.987200 26.37276       5.623914 49.35332 5.049277 45.97904 5.105251 3.374279       7.180445 
1 1 1 -23 5  7  o 172.7299 3.036814 365.0474       12.78268 366.5219       20.54321 364.1159       16.32878 172.4404 4.893647 172.2804 3.889392 0.1599884      6.251012 
1 1 1 -23 5  8  o 156.3908 3.293955 299.4672       12.55350 340.7069       29.60549 290.4270       13.86132 165.0516 7.379313 153.9152 3.695618 11.13641       8.252991 
1 1 1 -23 5  9  o 56.48573 2.951529 39.13481       4.048672 38.16267       6.868858 39.65236       5.011827 55.40374 5.146394 56.76175 3.642525 -1.358009      6.305027 
1 1 1 -23 5  10 o 144.6823 3.138749 256.2105       11.06644 253.1595       16.18531 258.8890       15.16508 143.3638 4.638927 145.0904 4.293861 -1.726593      6.321146 
1 1 1 -23 5  11 o 46.67172 3.209609 26.79283       3.628187 28.24264       6.525991 26.14423       4.364950 47.44626 5.762265 45.99142 3.932324 1.454842       6.976164 
1 1 1 -23 5  12 o 70.48772 3.012625 60.91304       5.162878 49.25782       7.580441 70.99730       7.051089 63.01779 4.976596 75.97301 3.820824 -12.95523      6.274169 
1 1 1 -23 5  13 o 125.4934 2.979785 192.7381       9.112596 191.5329       13.35762 193.7873       12.46314 124.7004 4.402581 125.5282 4.079689 -0.8278885     6.002214 
1 1 1 -23 5  14 o 133.7522 3.486868 219.4987       11.35538 230.8384       14.81601 203.3544       17.67838 136.8700 4.447990 127.9994 5.681752 8.870644       7.215741 
1 1 1 -23 5  15 o 152.3363 3.174630 284.3043       11.78509 291.4774       17.38654 278.2074       16.02933 153.7012 4.647282 150.2625 4.382205 3.438644       6.387562 
1 1 1 -23 5  16 o 183.7051 4.058222 415.0621       18.16741 412.4943       22.32111 420.1015       31.26984 182.6196 5.020470 183.0001 7.024987 -0.3805084     8.634556 
1 1 1 -23 5  17 o 68.27367 3.094740 57.23850       5.135502 63.03591       8.026863 53.22092       6.682064 71.31932 4.643770 65.61191 4.201263 5.707413       6.262205 
1 1 1 -23 5  18 o 74.64942 2.983483 68.39349       5.416397 73.41543       8.409640 64.83347       7.080567 76.99717 4.501581 72.46072 4.025684 4.536446       6.039070 
1 1 1 -23 5  19 o 43.83356 3.743996 23.80512       3.960995 24.94710       6.377962 23.08812       5.053736 44.30884 6.065922 42.90475 4.922662 1.404091       7.812042 
1 1 1 -23 5  20 o 94.33727 2.952694 109.2527       6.779580 112.3043       10.31033 106.9283       8.998541 95.19583 4.456826 93.04417 3.977866 2.151665       5.973836 
1 1 1 -23 5  21 o 54.63976 3.937712 37.02337       5.207942 49.98515       11.17501 33.42716       5.886233 62.23248 7.521148 51.70226 4.724020 10.53022       8.881668 
1 1 1 -23 5  22 o 81.21612 3.371793 81.32404       6.658763 80.90394       12.47444 81.49144       7.874459 79.76809 6.472921 81.10797 3.996321 -1.339882      7.607187 
1 1 1 -23 5  23 o 15.99578 6.235528 2.114158       3.504239 8.404489       7.203185 0.1638744      4.010853 26.16981 9.158837 14.76734 6.305017 11.40246       11.11924 
1 1 1 -23 5  24 o 95.18122 3.011015 111.5904       6.975151 106.1328       10.48503 115.9231       9.342277 92.11639 4.686256 96.62791 3.975966 -4.511520      6.145673 
1 1 1 -23 5  25 f 69.98038 3.138355 60.50376       5.338364 73.16524       8.675631 52.78855       6.772247 76.34273 4.685919 64.95934 4.302383 11.38338       6.361474 
1 1 1 -23 5  26 o 55.03513 4.296207 38.05252       5.716217 39.91154       7.496776 35.47058       8.834959 55.80463 5.587832 51.75583 7.199671 4.048801       9.113678 
1 1 1 -23 5  27 o 38.72575 4.350633 19.01683       4.034783 16.68927       6.529638 20.45446       5.131730 34.79734 7.883555 39.76315 5.438339 -4.965816      9.577368 
1 1 1 -23 5  28 o 48.62351 3.760278 29.67653       4.420963 25.41705       6.952850 32.56747       5.728021 43.58214 6.765933 50.54386 4.704523 -6.961723      8.240775 
1 1 1 -23 5  29 o 31.84899 5.469577 13.38818       4.092194 9.157505       6.162425 16.72539       5.473166 25.66887 8.479423 35.10505 6.641019 -9.436180      10.77050 
1 1 1 -23 5  30 o 42.30133 5.092688 23.32927       5.144253 23.23534       6.834928 23.45199       7.812907 41.02653 7.093018 40.44749 8.207427 0.5790367      10.84771 
1 1 1 -23 5  31 o 27.44598 6.065455 10.32585       3.948607 6.183012       6.048436 13.40288       5.212658 22.08984 8.294516 30.81339 7.089509 -8.723553      10.91147 
1 1 1 -23 5  32 o 34.01109 6.079457 15.82081       4.853781 10.67309       9.080024 17.88027       5.743215 26.75600 10.13712 35.70951 6.848959 -8.953510      12.23395 
1 1 1 -23 5  33 o 43.07367 4.297419 24.03737       4.450684 18.98272       6.477301 28.55835       6.125828 36.03992 7.614123 46.10175 5.565166 -10.06183      9.431116 
1 1 1 -23 5  34 o 22.67922 6.780176 7.438224       4.035529 6.462519       5.933332 8.278113       5.504916 21.68195 8.199051 23.55840 8.017166 -1.876455      11.46732 
1 1 1 -23 5  35 f 23.16741 7.162551 8.012087       4.452751 4.441575       7.625218 9.859635       5.485106 20.58599 8.738003 25.17231 7.974514 -4.586321      11.82986 
1 1 1 -23 5  36 o 39.38263 5.808211 21.78449       5.407080 17.82106       6.815565 28.51548       8.881904 33.12061 8.425607 41.52071 9.035488 -8.400101      12.35439 
1 1 1 -23 5  37 o 22.40217 6.904974 7.664534       4.141978 15.55785       6.250884 1.486042       5.530356 30.81709 8.186016 16.53285 7.229937 14.28424       10.92167 
1 1 1 -23 5  38 o 11.62383 5.422381 -2.249913      3.772239 -2.829275      5.612046 -1.772412      5.094878 13.92582 6.534184 13.84046 6.403165 0.8536530E-01  9.148557 
1 1 1 -23 6  1  o 50.92127 3.443311 31.94678       4.247663 34.63786       6.792387 30.21850       5.443355 52.63292 5.370963 49.30523 4.582876 3.327698       7.060453 
1 1 1 -23 6  2  o 122.0227 2.662328 182.1117       7.916596 174.5730       11.53735 188.8194       10.88281 119.1272 3.979873 124.0025 3.605255 -4.875366      5.370033 
1 1 1 -23 6  3  o 82.33267 3.116560 83.12537       6.241644 88.03912       6.933648 62.12904       14.33265 84.69005 3.366351 69.61320 8.633816 15.07685       9.266882 
1 1 1 -23 6  4  o 182.3402 3.125482 407.0845       13.88787 392.2709       17.62063 431.3769       22.56462 178.6989 4.046351 186.9522 4.957293 -8.253372      6.399040 
1 1 1 -23 6  5  o 82.49100 3.370942 83.50778       6.762046 95.69640       9.103979 68.50860       10.09922 88.13580 4.251337 74.21124 5.626396 13.92455       7.051964 
1 1 1 -23 6  6  o 71.57767 2.751017 62.74295       4.789583 57.80000       7.755243 65.79081       6.089759 68.36171 4.683582 73.19802 3.423493 -4.836311      5.801401 
1 1 1 -23 6  7  o 42.22290 3.437024 21.98563       3.505882 26.37877       5.986071 19.69197       4.325327 45.89728 5.458859 39.75621 4.546200 6.141071       7.104019 
1 1 1 -23 6  8  o 193.8432 3.662876 460.7387       17.30250 474.9274       37.97717 457.0221       19.43700 194.3313 8.036778 192.8929 4.135014 1.438400       9.038150 
1 1 1 -23 6  9  o 118.3968 3.062876 171.6742       8.829592 180.0289       21.53126 169.9851       9.681055 119.7879 7.412298 117.7477 3.377403 2.040176       8.145491 
1 1 1 -23 6  10 o 107.3494 2.630868 140.8808       6.882318 144.7618       11.65465 138.8027       8.528045 108.4024 4.421164 106.4045 3.292884 1.997849       5.512692 
1 1 1 -23 6  11 o 152.3055 2.857296 283.7774       10.60491 293.2999       17.59465 278.3442       13.29033 154.2506 4.686209 150.6582 3.619986 3.592407       5.921558 
1 1 1 -23 6  12 o 77.39848 2.652048 73.33557       4.994682 74.28983       8.707007 72.86755       6.097709 77.53173 4.629516 77.05936 3.254499 0.4723663      5.658991 
1 1 1 -23 6  13 o 117.9290 2.955299 170.3305       8.486249 170.5996       12.70126 170.1136       11.40574 117.6427 4.438388 117.6061 3.985523 0.3654480E-01  5.965206 
1 1 1 -23 6  14 f 117.1133 3.428480 168.3216       9.774085 177.0978       12.86773 156.3519       15.02752 119.8506 4.413346 112.2302 5.511523 7.620331       7.060772 
1 1 1 -23 6  15 o 102.4114 3.559551 128.8596       8.869900 122.7815       10.89357 140.8161       15.27875 99.71759 4.494484 106.2991 5.921642 -6.581482      7.434127 
1 1 1 -23 6  16 o 33.46272 4.533954 14.05169       3.602185 21.62353       6.127927 10.05385       4.452729 41.20474 6.302847 27.82069 6.656992 13.38404       9.167411 
1 1 1 -23 6  17 o 111.4931 2.943998 152.3892       7.991741 152.3808       11.95736 152.3960       10.74384 111.0653 4.426819 111.2191 3.970464 -0.1538010     5.946538 
1 1 1 -23 6  18 o 23.61092 6.075394 7.220902       3.515770 6.547585       5.799732 7.612072       4.420596 23.66606 8.222445 24.31359 7.051241 -0.6475372     10.83183 
1 1 1 -23 6  19 o 142.5162 3.131642 249.2413       10.87609 246.1797       15.96888 251.8903       14.85380 140.9630 4.655102 142.7751 4.274036 -1.812057      6.319602 
1 1 1 -23 6  20 o 13.97531 5.834786 0.5808255      3.311925 -1.392549      5.547287 1.673844       4.128475 16.16185 7.147727 16.49832 6.658114 -0.3364697     9.768341 
1 1 1 -23 6  21 o 124.5717 3.052749 190.5854       9.267157 186.1227       13.96056 194.1009       12.39088 122.3641 4.690485 125.2707 4.064355 -2.906624      6.206419 
1 1 1 -23 6  22 o 49.03659 4.544086 30.10582       5.368277 0.000000       0.000000 30.10582       5.368277 ?        ?        49.03659 4.544086 0.000000       4.544086 
1 1 1 -23 6  23 o 35.12575 4.486319 15.57714       3.752648 23.02267       6.643139 12.08780       4.547750 42.05373 6.707525 30.35321 6.352555 11.70053       9.238281 
1 1 1 -23 6  24 o 57.55410 3.476488 41.05909       4.853147 46.03494       7.967416 38.12380       6.119406 60.21730 5.489808 55.09826 4.599512 5.119041       7.161948 
1 1 1 -23 6  25 o 46.62609 3.855404 27.16361       4.341494 29.86208       7.184056 25.61114       5.449080 47.96175 6.298738 44.85980 5.073534 3.101944       8.087945 
1 1 1 -23 6  26 o 15.21446 6.927695 -2.728314      5.648317 -2.728314      5.648317 0.000000       0.000000 15.21446 6.927695 ?        ?        0.000000       6.927695 
1 1 1 -23 6  27 o 14.98377 6.008860 1.620945       3.339869 3.600729       5.689549 0.5800484      4.125465 19.92252 7.890883 15.14807 6.428401 4.774452       10.17793 
1 1 1 -23 6  28 o 25.58322 5.916312 8.781834       3.614873 5.120003       5.738214 11.19124       4.654602 21.29301 8.060591 28.62353 6.778343 -7.330519      10.53181 
1 1 1 -23 6  29 o 18.70028 6.847277 4.085460       4.074669 3.552124       5.699314 4.643103       5.827737 19.61821 7.855560 20.74116 8.053701 -1.122948      11.25042 
1 1 1 -23 6  30 o 53.81343 4.394476 37.06052       5.712669 27.47919       7.325180 51.93341       9.126474 44.71977 6.947129 62.47184 6.071394 -17.75207      9.226290 
1 1 1 -23 6  31 o 33.15872 5.236046 14.58629       4.090674 12.37311       6.423871 16.09590       5.305433 28.82004 8.539375 34.08924 6.625304 -5.269196      10.80813 
1 1 1 -23 6  32 f 22.88251 7.268727 7.422211       4.554495 -8.100383      8.777092 13.14204       5.327950 16.25749 7.783335 30.16936 7.322013 -13.91186      10.68607 
1 1 1 -23 6  33 o 14.12481 6.051290 0.6120989      3.717461 -3.362227      5.412541 4.161011       5.114664 13.95201 6.504037 19.13310 7.511318 -5.181086      9.935914 
1 1 1 -23 6  34 o 53.96607 4.248999 37.85631       5.542791 30.87734       9.353337 41.63366       6.881209 44.27324 8.976976 55.84539 5.113080 -11.57215      10.33101 
1 1 1 -23 6  35 o 30.64561 6.270854 13.45854       4.525127 1.174202       7.195884 21.49406       5.819897 18.16868 8.082218 38.83278 6.370807 -20.66409      10.29123 
1 1 1 -23 6  36 o 29.79630 6.949146 13.37081       4.952710 17.20753       6.614786 8.475774       7.471600 32.58241 8.306956 23.09669 9.075150 9.485723       12.30300 
1 1 1 -23 6  37 o 16.57767 6.482958 3.295961       3.797667 10.95237       5.762203 -2.583628      5.049513 25.69395 8.177479 13.41653 6.263590 12.27742       10.30067 
1 1 1 -23 6  38 o 19.33613 6.810898 5.551408       3.987743 5.325458       5.769063 5.758144       5.518328 19.54997 7.877353 19.86699 7.801298 -0.3170280     11.08661 
1 1 1 -23 7  1  o 20.66386 5.603250 5.474792       2.892020 8.768903       3.489180 -1.755371      5.169260 26.09686 5.650537 15.38082 6.845629 10.71604       8.876441 
1 1 1 -23 7  2  o 90.52191 3.046918 100.4796       6.711679 97.27203       9.319918 103.9350       9.673447 88.77856 4.320899 91.77100 4.337811 -2.992432      6.122645 
1 1 1 -23 7  3  o 51.02539 2.807459 31.95476       3.477435 26.39683       4.522151 39.99679       5.439654 46.16440 4.061129 56.91965 3.946118 -10.75525      5.662562 
1 1 1 -23 7  4  o 84.92801 2.739654 88.32288       5.662577 99.51737       9.218389 81.53925       7.176030 89.85598 4.221705 81.44379 3.624763 8.412193       5.564324 
1 1 1 -23 7  5  o 156.9322 2.953669 301.4257       11.29562 277.0994       17.40815 319.1160       14.84508 149.8533 4.773142 161.2420 3.778055 -11.38867      6.087412 
1 1 1 -23 7  6  o 109.0243 2.991110 145.5928       7.939283 144.6548       11.64910 146.4064       10.84921 108.3359 4.421784 109.0808 4.088678 -0.7449417     6.022413 
1 1 1 -23 7  7  o 170.3150 3.033897 355.0705       12.59186 339.1768       19.85514 365.7634       16.28580 165.7688 4.920566 172.6111 3.871722 -6.842316      6.261166 
1 1 1 -23 7  8  o 59.03119 2.962788 42.75139       4.248422 50.01598       7.379357 39.14979       5.195900 63.52882 4.802194 56.35458 3.805837 7.174244       6.127435 
1 1 1 -23 7  9  o 120.5941 3.083870 178.1607       9.055273 187.3082       22.11268 176.3177       9.925681 122.0750 7.469001 119.8983 3.400558 2.176689       8.206690 
1 1 1 -23 7  10 o 126.0565 2.736313 194.3526       8.405570 188.1227       13.88431 197.9570       10.56081 123.5023 4.621467 127.0407 3.414383 -3.538399      5.745952 
1 1 1 -23 7  11 o 41.42400 3.478503 21.18442       3.478997 13.20485       6.333161 24.63303       4.163445 31.78120 8.141758 44.62681 3.866545 -12.84561      9.013234 
1 1 1 -23 7  12 o 96.28666 2.626546 113.4617       6.157172 117.4869       10.79528 111.5209       7.495982 97.55590 4.553487 95.35152 3.230669 2.204384       5.583142 
1 1 1 -23 7  13 o 21.38278 6.039387 5.836178       3.284739 8.734258       5.669872 4.372139       4.029902 26.24823 8.076679 19.67752 6.852964 6.570707       10.59226 
1 1 1 -23 7  14 o 91.55848 3.569099 103.0350       7.948050 96.65087       9.905154 114.5773       13.31854 88.41353 4.613297 95.92035 5.723868 -7.506821      7.351542 
1 1 1 -23 7  15 o 105.9630 3.428703 137.9072       8.841951 138.8645       11.52280 136.5363       13.78893 106.0367 4.469311 104.8133 5.416942 1.223412       7.022678 
1 1 1 -23 7  16 o 133.8197 3.067290 219.4758       10.00256 219.4253       15.01057 219.5161       13.41503 133.2314 4.630364 133.4544 4.129959 -0.2229462     6.204582 
1 1 1 -23 7  17 o 123.7071 2.990419 187.5690       9.014941 201.2868       13.92250 177.6653       11.82973 127.6072 4.484163 120.0365 4.049933 7.570663       6.042324 
1 1 1 -23 7  18 o 77.55299 3.009029 73.86268       5.675919 69.38036       8.833972 77.01398       7.407137 74.67950 4.880958 78.99476 3.859513 -4.315254      6.222507 
1 1 1 -23 7  19 o 55.75683 3.445708 38.36492       4.658925 39.27943       7.643158 37.82423       5.876961 55.82074 5.698625 55.13916 4.410522 0.6815796      7.206042 
1 1 1 -23 7  20 o 74.04024 3.080328 67.43323       5.545635 67.38212       8.906060 67.46559       7.087294 73.44669 5.005886 73.83286 3.953495 -0.3861694     6.378794 
1 1 1 -23 7  21 o 80.68218 3.318300 80.23171       6.510309 100.2596       13.55275 74.22386       7.422819 88.94351 6.293476 77.41271 3.947816 11.53080       7.429205 
1 1 1 -23 7  22 o 81.33792 3.469936 81.71084       6.862015 64.10761       13.93328 87.34765       7.884496 69.77770 8.360326 83.96746 3.863602 -14.18976      9.209911 
1 1 1 -23 7  23 o 58.93357 3.362572 42.97115       4.809105 38.90035       7.780757 45.48761       6.117538 55.20445 5.873863 60.39365 4.182544 -5.189198      7.210821 
1 1 1 -23 7  24 o 48.08625 3.782465 28.82300       4.396669 35.51528       7.250634 24.93123       5.529206 52.68681 5.739964 44.24020 5.229717 8.446609       7.765123 
1 1 1 -23 7  25 o 24.01788 6.965573 7.676762       4.313808 3.709314       6.099433 11.64737       6.101860 20.59591 8.166162 29.15202 8.230586 -8.556114      11.59434 
1 1 1 -23 7  26 o 16.41532 6.635605 1.869346       4.108173 2.749383       5.857852 1.017585       5.762979 19.40156 7.893970 17.87816 7.592838 1.523399       10.95290 
1 1 1 -23 7  27 o 18.69303 6.437421 4.280200       3.551691 13.28636       5.988773 -0.6059856     4.411163 30.87023 7.921973 14.58799 6.415872 16.28223       10.19417 
1 1 1 -23 7  28 o 14.85384 5.962731 1.639466       3.292245 3.021755       5.731456 0.9587758      4.021982 19.26557 7.819530 15.24642 6.402047 4.019155       10.10600 
1 1 1 -23 7  29 o 33.57724 6.053077 15.15746       4.770707 12.89459       6.674657 17.52087       6.821332 29.71214 8.678150 34.94684 8.158836 -5.234697      11.91121 
1 1 1 -23 7  30 o 13.83801 5.935523 0.3498176      3.584514 -2.859755      5.886985 2.240833       4.518734 15.12662 6.956701 16.98291 6.924471 -1.856296      9.815496 
1 1 1 -23 7  31 o 29.34269 5.729232 11.67911       3.949637 10.34610       6.435348 12.48466       5.002660 26.44932 8.661561 29.67228 7.027544 -3.222961      11.15388 
1 1 1 -23 7  32 o 22.42602 6.679405 7.091636       3.922142 4.554337       6.367923 8.642532       4.978555 20.51850 8.273109 24.39642 7.578840 -3.877926      11.21977 
1 1 1 -23 7  33 f 12.58298 5.647771 -0.9191355     3.598163 -2.887937      5.618715 0.4495684      4.684797 14.45313 6.699735 15.32688 6.679318 -0.8737574     9.460430 
1 1 1 -23 7  34 o 17.22379 6.746122 3.311273       4.117571 -0.3488086     6.712976 5.518859       5.213490 17.00236 7.665679 20.31264 7.684628 -3.310286      10.85431 
1 1 1 -23 7  35 o 24.69613 6.622682 9.015614       4.067239 4.323730       5.841890 13.42927       5.666031 19.28017 7.868684 29.32624 7.795340 -10.04606      11.07626 
1 1 1 -23 7  36 o 30.76629 6.790960 14.14769       4.954964 9.740731       6.342840 21.04810       7.936919 24.27663 8.586359 35.04224 9.184701 -10.76561      12.57316 
1 1 1 -23 7  37 o 16.07980 6.391379 2.927479       3.745132 1.094761       5.721928 4.301057       4.953601 16.37360 7.249492 18.35693 7.332690 -1.983335      10.31133 
1 1 1 -23 7  38 o 21.78018 6.820095 7.338685       4.023072 8.027735       6.367315 6.880826       5.190353 22.07914 8.459008 20.94575 7.718217 1.133390       11.45101 
1 1 1 -23 8  1  o 145.6627 3.250514 260.2384       11.53816 268.0522       16.61554 252.9613       16.03479 147.2632 4.635807 143.0672 4.605252 4.196014       6.534451 
1 1 1 -23 8  2  o 52.88161 2.880434 34.34314       3.697906 42.58290       5.004938 24.43758       5.487581 58.79784 3.508983 44.13737 5.201763 14.66047       6.274656 
1 1 1 -23 8  3  o 134.4930 2.839819 221.4265       9.307360 224.5371       14.84699 219.4127       11.94612 134.8802 4.523441 133.6223 3.672179 1.257980       5.826355 
1 1 1 -23 8  4  o 136.0785 2.843539 226.6502       9.429412 245.2233       15.46693 215.6637       11.89575 140.9927 4.507436 132.4848 3.688181 8.507889       5.824059 
1 1 1 -23 8  5  o 81.94209 2.750628 82.24408       5.484778 90.98969       9.088559 77.23463       6.878527 85.86172 4.357947 79.26058 3.570414 6.601135       5.633787 
1 1 1 -23 8  6  o 110.8900 2.729684 150.4307       7.376338 148.4070       11.91190 151.6893       9.394206 109.6856 4.465854 111.1621 3.472162 -1.476593      5.656833 
1 1 1 -23 8  7  o 158.6757 2.963506 308.2224       11.45915 308.8200       18.62205 307.8582       14.53744 158.1436 4.837832 158.3539 3.767237 -0.2103119     6.131614 
1 1 1 -23 8  8  o 51.84458 3.482205 33.10744       4.373889 31.92131       6.736417 33.97193       5.751025 50.47803 5.568786 52.32251 4.555838 -1.844471      7.194931 
1 1 1 -23 8  9  o 89.89812 2.662584 98.93055       5.826547 97.21303       9.847541 99.85569       7.227384 88.71312 4.570571 90.20718 3.293317 -1.494064      5.633476 
1 1 1 -23 8  10 o 52.49062 3.523021 33.94556       4.480338 23.65936       13.35937 35.24910       4.755761 41.85379 12.29202 53.46827 3.672256 -11.61449      12.82885 
1 1 1 -23 8  11 o 81.09819 2.701688 80.54632       5.331824 80.56327       9.359793 80.53818       6.487303 80.67127 4.782606 80.99404 3.293684 -0.3227692     5.807036 
1 1 1 -23 8  12 o 102.6263 3.071270 129.1245       7.672270 134.3604       11.66889 125.1374       10.18277 104.2915 4.602729 100.7697 4.155590 3.521873       6.201132 
1 1 1 -23 8  13 o 38.04759 4.327337 18.05190       3.941006 13.72090       6.360337 20.75096       5.021028 32.33139 8.092485 40.63867 5.188265 -8.307281      9.612825 
1 1 1 -23 8  14 o 42.26654 3.890235 22.14559       3.961982 24.66364       6.779760 20.83969       4.882432 43.99329 6.521145 40.75481 5.022213 3.238476       8.230914 
1 1 1 -23 8  15 o 70.66301 3.653105 61.50893       6.269219 64.56222       8.589321 58.02787       9.171295 72.08717 4.918976 68.13587 5.572181 3.951302       7.432733 
1 1 1 -23 8  16 o 49.94453 3.548216 30.79721       4.290391 31.56094       7.111951 30.36024       5.379525 49.98380 5.955813 49.38626 4.520006 0.5975418      7.476775 
1 1 1 -23 8  17 o 47.24623 3.610561 27.60325       4.125490 36.50631       7.264623 23.36534       5.012101 53.86967 5.616305 43.17778 4.847064 10.69189       7.418687 
1 1 1 -23 8  18 o 58.94179 3.300125 42.80845       4.721196 32.55111       7.637328 49.15247       6.006294 50.56940 6.336223 63.02950 3.930003 -12.46010      7.456048 
1 1 1 -23 8  19 o 72.33867 3.077577 64.36465       5.412800 67.23976       9.011288 62.74176       6.770250 73.35825 5.072054 71.21199 3.916435 2.146255       6.408134 
1 1 1 -23 8  20 o 116.1277 3.358896 166.0696       9.495372 146.6565       17.47945 174.1967       11.30962 107.4321 6.710135 118.7142 3.914747 -11.28206      7.768601 
1 1 1 -23 8  21 o 19.58216 6.236145 4.788508       3.350638 7.295394       6.633417 3.929810       3.882312 24.77217 8.779016 18.77855 6.709743 5.993616       11.04951 
1 1 1 -23 8  22 o 119.2886 3.462718 175.6951       10.05524 183.6663       20.22409 173.0776       11.58917 119.6068 6.968869 118.1198 4.032095 1.487022       8.051269 
1 1 1 -23 8  23 o 39.02714 4.314857 19.16723       4.035193 18.21855       6.672642 19.71420       5.066631 36.85825 7.678527 39.23029 5.446538 -2.372040      9.414063 
1 1 1 -23 8  24 o 51.91505 4.382078 33.86066       5.492105 29.88652       7.437010 38.62776       8.145237 47.87105 6.546453 54.67509 6.224012 -6.804035      9.032961 
1 1 1 -23 8  25 o 15.29357 6.095890 1.742094       3.416145 4.755504       5.990684 0.2900223      4.158544 21.41047 8.204466 14.99824 6.412258 6.412238       10.41299 
1 1 1 -23 8  26 o 67.19936 3.249837 56.05876       5.306074 59.20795       8.823821 54.27498       6.640919 68.00282 5.368192 65.72926 4.167498 2.273552       6.795993 
1 1 1 -23 8  27 o 14.84444 6.047485 1.399530       3.443149 -0.8276145     5.608258 2.746830       4.362003 16.21113 7.177361 17.56096 6.923694 -1.349836      9.972565 
1 1 1 -23 8  28 f 37.26163 5.540594 18.25941       4.878133 15.31463       6.611517 21.77791       7.226930 32.69442 8.288434 39.46523 7.791208 -6.770805      11.37546 
1 1 1 -23 8  29 o 21.02741 7.048365 5.868908       4.254610 0.8680344      5.925637 11.19028       6.112569 17.58110 7.587221 27.78346 8.353426 -10.20236      11.28475 
1 1 1 -23 8  30 o 27.23499 6.000715 10.14780       3.874946 4.904631       6.198728 13.51092       4.964511 20.98272 8.259518 31.13868 6.738414 -10.15596      10.65954 
1 1 1 -23 8  31 o 42.05280 4.470852 22.90458       4.511504 16.27812       6.918686 27.80645       5.950641 32.87725 8.554820 45.75485 5.443510 -12.87760      10.13986 
1 1 1 -23 8  32 o 40.24671 4.594201 21.17325       4.425236 10.02904       6.755820 29.54805       5.856534 25.74212 8.877816 47.20896 5.175469 -21.46684      10.27624 
1 1 1 -23 8  33 o 35.76413 5.613486 17.46688       4.731404 14.77197       8.580459 18.64430       5.671581 29.54648 10.00980 36.20679 6.673859 -6.660309      12.03065 
1 1 1 -23 8  34 o 16.02774 6.379722 2.604530       3.736611 5.301142       5.912930 0.8116758      4.821321 20.36122 8.050720 15.60958 6.789571 4.751640       10.53149 
1 1 1 -23 8  35 o 17.69028 6.708182 3.983688       3.978252 0.2529023      6.046149 6.832064       5.282961 16.41551 7.348099 21.42415 7.804154 -5.008642      10.71911 
1 1 1 -23 8  36 o 28.58250 6.857907 12.35394       4.715513 11.69212       6.104976 13.33276       7.424479 26.45496 8.416904 27.36397 9.310646 -0.9090023     12.55119 
1 1 1 -23 8  37 o 13.54549 5.910855 0.5045563      3.679276 -4.993814      5.784712 4.240003       4.767998 13.18900 6.315481 18.14958 7.212373 -4.960578      9.586637 
1 1 1 -23 9  1  o 70.43069 3.021617 60.91970       5.173996 63.08558       7.982835 59.35075       6.794292 71.30483 4.618971 69.30123 4.040687 2.003601       6.136940 
1 1 1 -23 9  2  o 86.76134 3.077226 92.38966       6.495812 93.36496       9.310663 91.46473       9.067110 86.88794 4.411728 86.01759 4.339611 0.8703537      6.188342 
1 1 1 -23 9  3  o 42.71748 3.683167 22.58211       3.796690 18.68781       6.007312 25.17225       4.899213 38.11948 6.711967 44.94866 4.534669 -6.829185      8.100230 
1 1 1 -23 9  4  o 154.6924 2.960607 293.1046       11.16055 299.6447       18.00916 289.0269       14.22040 155.6984 4.752059 153.3512 3.805299 2.347290       6.087886 
1 1 1 -23 9  5  o 182.4750 3.170691 408.1018       14.09917 396.5571       22.23289 415.8676       18.23474 178.9734 5.102873 183.8540 4.069962 -4.880615      6.527167 
1 1 1 -23 9  6  o 81.05942 2.783003 80.51087       5.489194 85.96620       9.137421 77.43043       6.866247 83.38974 4.513323 79.34948 3.559972 4.040260       5.748346 
1 1 1 -23 9  7  o 27.58602 5.101145 9.697424       3.302920 12.13402       5.760747 8.504194       4.031338 30.46370 7.744336 25.62510 6.458876 4.838594       10.08424 
1 1 1 -23 9  8  o 91.82899 2.729625 103.2726       6.101498 113.1354       10.55322 98.32021       7.478057 95.69581 4.538322 89.46401 3.436471 6.231796       5.692601 
1 1 1 -23 9  9  o 31.76838 4.971957 12.75589       3.722961 14.49574       6.129957 11.73906       4.686254 33.29797 7.707031 30.11313 6.571157 3.184834       10.12810 
1 1 1 -23 9  10 f 36.56398 4.347600 16.69089       3.798055 25.60417       12.63605 15.80566       3.982196 43.39063 11.68956 35.48995 4.721514 7.900673       12.60708 
1 1 1 -23 9  11 o 14.11745 5.896251 0.5418447      3.383873 -0.8915349     5.782358 1.288399       4.173065 16.96119 7.405547 16.24518 6.642693 0.7160110      9.948240 
1 1 1 -23 9  12 o 69.56530 3.262830 59.47033       5.515837 65.67870       9.003960 55.74086       6.978609 72.67709 5.116633 67.13395 4.288120 5.543144       6.675920 
1 1 1 -23 9  13 o 153.5770 2.901558 288.8792       10.85909 295.0364       18.40701 285.5924       13.44871 154.3921 4.898601 152.4812 3.619332 1.910919       6.090637 
1 1 1 -23 9  14 o 14.21911 5.479395 1.681184       2.682423 -3.405616      5.844033 3.038942       3.019266 15.43924 7.036482 16.69870 5.922329 -1.259460      9.197068 
1 1 1 -23 9  15 o 132.9261 3.616877 217.3442       11.70514 229.0855       15.45787 201.5630       17.92104 136.0465 4.669500 127.0619 5.803098 8.984642       7.448502 
1 1 1 -23 9  16 o 37.76762 4.254968 17.81642       3.848012 18.81892       6.944074 17.37215       4.622674 37.86480 7.785817 37.04841 5.268548 0.8163910      9.400880 
1 1 1 -23 9  17 o 84.82043 2.985690 88.35876       6.161741 93.93369       10.26753 85.22092       7.703038 86.89867 4.868065 83.09111 3.814446 3.807564       6.184501 
1 1 1 -23 9  18 o 34.57377 4.392528 15.01686       3.617388 14.82715       6.689503 15.09526       4.300376 33.34253 8.272730 34.43882 5.293321 -1.096298      9.821268 
1 1 1 -23 9  19 o 70.71075 3.329936 61.63760       5.721839 60.25231       11.67374 62.07565       6.564451 68.53133 7.092512 70.83379 3.817060 -2.302460      8.054420 
1 1 1 -23 9  20 f 57.30849 3.595371 40.65488       4.995798 44.14633       11.21667 39.79088       5.579801 57.94850 8.169434 56.56781 4.075056 1.380692       9.129389 
1 1 1 -23 9  21 o 26.16458 5.713259 8.930181       3.540454 10.51977       6.647274 8.300660       4.183173 28.17394 8.758162 25.09001 6.711119 3.083925       11.03379 
1 1 1 -23 9  22 f 72.13416 4.623884 65.15022       8.085202 66.94852       13.63930 64.17593       10.03925 71.29385 7.987798 71.02293 5.852400 0.2709198      9.902298 
1 1 1 -23 9  23 o 69.52747 3.287510 59.80470       5.554281 55.44487       8.834443 62.65445       7.142467 66.02536 5.541851 70.85235 4.154974 -4.826988      6.926465 
1 1 1 -23 9  24 o 25.26758 5.951260 8.455515       3.603610 3.231557       5.983883 11.42816       4.513931 20.04413 8.041359 29.28148 6.495954 -9.237354      10.33735 
1 1 1 -23 9  25 o 38.95644 4.201839 19.18196       3.925890 19.78001       6.790508 18.88169       4.811523 38.14470 7.572404 38.24920 5.304676 -0.1044998     9.245588 
1 1 1 -23 9  26 o 27.68524 5.845877 10.19505       3.820037 11.35388       6.650882 9.624555       4.666554 28.44551 8.746588 26.53559 7.084002 1.909924       11.25548 
1 1 1 -23 9  27 o 16.58112 6.705460 2.049647       4.197114 5.232883       5.961075 -1.079783      5.910480 21.51863 8.199304 16.41402 7.311830 5.104614       10.98597 
1 1 1 -23 9  28 o 53.77794 4.294104 36.81058       5.580753 31.10420       7.540731 43.72112       8.298302 48.03362 6.617857 57.51183 6.009606 -9.478203      8.939317 
1 1 1 -23 9  29 o 12.81592 5.640375 -0.4497637     3.414649 4.102268       5.625195 -3.105818      4.296882 19.88175 7.855137 12.50804 5.818842 7.373713       9.775587 
1 1 1 -23 9  30 o 43.85253 4.156179 24.64194       4.388442 16.01979       6.657702 31.26625       5.835623 32.91698 8.302254 48.95217 4.960311 -16.03519      9.671200 
1 1 1 -23 9  31 o 46.03871 4.345176 27.37709       4.817245 23.13478       8.698348 29.25385       5.785494 38.54073 9.356669 47.09834 5.123256 -8.557610      10.66747 
1 1 1 -23 9  32 o 20.46783 7.040507 5.750604       4.247941 0.6275094      9.243608 7.122226       4.782912 20.06386 9.025014 22.32615 7.473017 -2.262289      11.71737 
1 1 1 -23 9  33 o 13.99505 6.115112 0.1797937      3.949239 3.314034       7.353529 -1.090627      4.681699 19.88433 8.514631 14.12419 6.381733 5.760144       10.64075 
1 1 1 -23 9  34 o 24.67190 6.548584 8.918756       4.002239 7.332171       6.379784 9.948333       5.139297 22.30821 8.486617 25.39457 7.664983 -3.086359      11.43567 
1 1 1 -23 9  35 o 19.00828 6.730362 5.093020       3.897990 2.044519       6.156742 7.132546       5.035844 17.62715 7.669737 21.67908 7.652268 -4.051929      10.83430 
1 1 1 -23 9  36 o 23.20719 7.315495 8.419175       4.621207 5.495576       6.250007 11.94518       6.863776 20.12544 8.166681 26.17880 8.951216 -6.053366      12.11689 
1 1 1 -23 9  37 o 18.10949 6.617804 4.621464       3.803276 7.394481       6.202094 2.950228       4.814830 21.56339 8.325895 16.92233 7.047848 4.641066       10.90838 
1 1 1 -23 10 1  o 66.40036 2.670085 54.08185       4.311665 58.81787       5.839912 48.40671       6.392750 69.09401 3.479605 62.49503 4.222437 6.598980       5.471437 
1 1 1 -23 10 2  o 104.0770 2.845276 132.8144       7.209538 142.3436       11.55523 126.7405       9.225397 107.2758 4.429716 101.4360 3.738528 5.839836       5.796462 
1 1 1 -23 10 3  o 140.7857 3.248935 243.1959       11.14642 260.6361       16.43167 228.3300       15.17059 145.1459 4.651596 135.8715 4.588404 9.274429       6.533820 
1 1 1 -23 10 4  o 140.5798 2.892710 242.0988       9.909781 241.3085       15.93677 242.5970       12.65356 139.6655 4.689120 140.4371 3.700612 -0.7715759     5.973473 
1 1 1 -23 10 5  o 51.62195 3.284214 32.81976       4.110023 39.38810       7.058545 29.45044       5.055434 56.14653 5.218629 48.69644 4.304430 7.450096       6.764777 
1 1 1 -23 10 6  f 112.6559 2.757888 155.3678       7.571235 157.5183       12.48831 154.1181       9.520428 112.8893 4.548887 111.9899 3.492792 0.8993378      5.735152 
1 1 1 -23 10 7  o 144.0889 2.895103 254.2731       10.16554 251.6538       16.64719 255.8306       12.83684 142.6310 4.796332 144.2651 3.654354 -1.634109      6.029851 
1 1 1 -23 10 8  o 73.04944 2.826201 65.43362       5.021527 66.59822       8.694420 64.85069       6.151194 73.23757 4.899776 72.60281 3.486915 0.6347580      6.013848 
1 1 1 -23 10 9  o 21.28679 6.371638 5.731563       3.562213 6.104899       5.831762 5.509359       4.499095 23.24816 8.232178 21.52763 7.248324 1.720526       10.96845 
1 1 1 -23 10 10 o 123.6659 4.831559 189.3139       14.53238 180.7502       22.19910 195.7362       19.22419 119.4177 7.668886 125.0523 6.328992 -5.634590      9.943236 
1 1 1 -23 10 11 o 75.06998 3.121532 69.20436       5.697989 71.63772       16.02212 68.85204       6.096546 74.33260 9.030153 74.83385 3.351607 -0.5012589     9.632079 
1 1 1 -23 10 12 o 180.7555 3.517003 401.2703       15.49174 400.4748       23.06257 401.9243       20.91220 179.6181 5.274632 180.2481 4.765122 -0.6299591     7.108314 
1 1 1 -23 10 13 o 23.00419 5.432291 6.831576       2.996259 13.01029       6.113019 4.877825       3.437490 31.42525 7.971563 19.87926 6.314798 11.54599       10.16968 
1 1 1 -23 10 14 o 81.88048 2.714478 82.19656       5.408813 83.40736       9.910522 81.68292       6.454905 81.88737 4.990111 81.51379 3.256097 0.3735809      5.958471 
1 1 1 -23 10 15 o 15.41173 6.007142 1.890025       3.251937 -1.066948      6.236063 2.994459       3.811155 17.44630 7.652099 17.58709 6.588218 -0.1407833     10.09749 
1 1 1 -23 10 16 o 76.42290 3.116558 71.81020       5.791922 76.04287       9.716393 69.47720       7.213647 78.05381 5.136836 74.96040 3.963079 3.093407       6.487918 
1 1 1 -23 10 17 o 15.70617 5.959507 2.263457       3.140983 -0.4828596     6.354605 3.151360       3.613232 17.95765 7.802996 17.51289 6.442039 0.4447613      10.11863 
1 1 1 -23 10 18 o 90.39637 3.289433 100.6265       7.234082 93.95271       14.12718 102.9985       8.422057 85.86989 6.806811 91.29890 3.793707 -5.429016      7.792618 
1 1 1 -23 10 19 o 94.90196 3.290318 110.9757       7.597867 103.6508       15.05432 113.4792       8.800991 90.01468 6.915941 95.79867 3.777358 -5.783989      7.880271 
1 1 1 -23 10 20 o 100.9869 3.009793 125.5042       7.398654 114.6415       11.73201 132.6769       9.533404 95.65372 5.050990 103.5394 3.784756 -7.885635      6.311646 
1 1 1 -23 10 21 o 65.80322 3.981874 53.85846       6.355265 52.96638       8.951015 54.76532       9.024843 64.54847 5.750647 65.66835 5.695864 -1.119881      8.093998 
1 1 1 -23 10 22 o 11.30172 5.252804 -2.896284      3.489009 7.648376       9.426171 -4.570291      3.755759 26.58150 10.26407 10.85484 5.167573 15.72666       11.49152 
1 1 1 -23 10 23 o 74.24716 3.208473 68.19932       5.791460 58.12864       9.376825 74.41036       7.363917 67.39963 5.764313 77.27526 3.923339 -9.875633      6.972796 
1 1 1 -23 10 24 o 79.69973 3.112875 78.60055       6.034187 94.89835       10.16764 69.73941       7.497222 86.67179 4.833145 74.62498 4.138896 12.04681       6.363156 
1 1 1 -23 10 25 o 20.46995 6.399584 5.463108       3.543717 3.411578       6.359273 6.387094       4.267772 20.41429 8.254487 22.05619 7.039623 -1.641903      10.84863 
1 1 1 -23 10 26 o 10.36439 4.910662 -3.642283      3.312813 6.974260       6.082170 -8.120466      3.950190 23.41874 8.394726 9.572422 4.720811 13.84632       9.631068 
1 1 1 -23 10 27 o 36.49244 8.035548 18.85099       6.952178 18.85099       6.952178 0.000000       0.000000 36.49244 8.035548 ?        ?        0.000000       8.035548 
1 1 1 -23 10 28 o 29.75181 5.398930 11.77363       3.770212 5.059973       6.531862 15.12789       4.616961 21.50911 8.474929 33.59140 5.852772 -12.08229      10.29948 
1 1 1 -23 10 29 o 15.15231 6.069200 1.880400       3.403064 -1.465812      5.668800 3.765732       4.255085 15.60648 7.039601 18.30298 6.938317 -2.696499      9.884140 
1 1 1 -23 10 30 o 49.09641 4.109567 30.86144       4.871724 15.18341       8.532859 38.44351       5.933934 30.86531 9.964068 54.57406 4.501910 -23.70875      10.93389 
1 1 1 -23 10 31 o 26.94936 6.017871 10.08322       3.852080 11.50467       6.101293 9.141060       4.967259 27.56141 8.358571 25.01226 7.532528 2.549149       11.25187 
1 1 1 -23 10 32 o 23.08104 7.551427 7.797190       4.891969 0.000000       0.000000 7.797190       4.891969 ?        ?        23.08104 7.551427 0.000000       7.551427 
1 1 1 -23 10 33 o 12.50962 5.616318 -0.8238090     3.560778 -1.263387      5.852138 -0.5653995     4.486945 15.50585 7.056957 14.16314 6.335699 1.342709       9.483761 
1 1 1 -23 10 34 o 17.49305 6.504447 3.934215       3.701155 5.894767       6.106275 2.795643       4.653371 20.77338 8.191367 17.00201 6.990280 3.771376       10.76859 
1 1 1 -23 10 35 o 17.21848 6.448275 3.836918       3.650419 -1.298702      5.948711 6.938914       4.623247 15.30486 7.021867 21.39279 7.345434 -6.087934      10.16179 
1 1 1 -23 10 36 o 21.91907 7.419373 7.513666       4.713994 5.547550       6.423037 9.809099       6.940139 20.14335 8.239421 23.91540 8.904103 -3.772045      12.13141 
1 1 1 -23 10 37 o 17.13538 6.597086 3.821291       3.885808 4.854804       6.095454 3.113720       5.043515 19.28632 7.972033 17.21519 7.194829 2.071135       10.73866 
1 1 1 -23 11 1  o 77.98078 2.719298 74.61163       5.159592 64.45580       7.137722 85.72590       7.466936 72.15394 4.075990 83.35802 3.684967 -11.20408      5.494786 
1 1 1 -23 11 2  f 61.29581 3.184390 46.24786       4.740252 46.46518       7.812666 46.12124       5.963326 60.89540 5.318066 61.02589 4.032546 -0.1304893     6.674073 
1 1 1 -23 11 3  o 46.17163 4.160193 26.50268       4.630702 32.42931       7.028285 21.95629       6.155722 50.67614 5.795377 41.43573 6.294013 9.240406       8.555758 
1 1 1 -23 11 4  o 154.8652 3.009027 294.0676       11.35575 304.8277       18.71818 287.8009       14.28479 156.7873 4.905138 152.8594 3.837861 3.927933       6.228127 
1 1 1 -23 11 5  o 94.39276 2.788460 109.2315       6.407120 114.2158       10.80098 106.5253       7.958596 96.01429 4.629915 93.04709 3.516250 2.967201       5.813787 
1 1 1 -23 11 6  o 148.7981 3.341494 271.7916       12.11642 275.2815       17.56288 268.6221       16.73731 149.0691 4.841149 147.3385 4.667472 1.730621       6.724731 
1 1 1 -23 11 7  o 30.05392 5.667375 11.58631       3.998506 13.24232       6.125845 10.35701       5.277907 31.70753 7.945066 28.13926 7.543439 3.568275       10.95571 
1 1 1 -23 11 8  o 33.69081 5.137929 14.37415       4.085003 20.11421       6.556435 10.73205       5.222586 39.43780 7.082393 28.63194 7.423841 10.80586       10.26030 
1 1 1 -23 11 9  o 101.0089 2.761435 125.0370       6.790832 109.3824       11.35593 133.7514       8.472683 93.85166 4.983153 104.3350 3.336673 -10.48334      5.997099 
1 1 1 -23 11 10 o 85.24587 2.757992 89.08721       5.721772 90.80368       10.20980 88.30128       6.908611 85.49934 4.921040 84.74519 3.351946 0.7541428      5.954173 
1 1 1 -23 11 11 o 49.77279 3.734283 30.63929       4.496320 30.36060       13.44923 30.67436       4.770833 46.87009 11.78809 49.75412 3.967705 -2.884029      12.43791 
1 1 1 -23 11 12 o 32.35991 5.239408 13.31629       3.990524 6.247225       6.779701 17.06361       4.936169 24.06696 8.829097 36.59689 5.722172 -12.52994      10.52123 
1 1 1 -23 11 13 o 108.9731 2.735079 145.5695       7.257416 140.1467       12.75739 148.1641       8.824452 106.1992 4.943079 109.7898 3.302050 -3.590523      5.944541 
1 1 1 -23 11 14 o 137.5891 2.832935 232.0637       9.498537 240.5321       16.71207 228.0227       11.54448 139.1407 4.936608 136.1324 3.482840 3.008286       6.041546 
1 1 1 -23 11 15 o 161.6290 3.369060 321.1736       13.26979 319.3754       20.15267 322.5500       17.63162 160.1315 5.171177 161.3586 4.488346 -1.227005      6.847359 
1 1 1 -23 11 16 o 74.44094 3.236976 68.23527       5.857982 55.89629       9.497382 75.81206       7.442297 66.52525 5.920207 78.28680 3.913466 -11.76155      7.096765 
1 1 1 -23 11 17 o 88.52280 3.300323 96.52589       7.107006 85.14771       14.22394 100.3116       8.204556 81.46094 7.240662 90.10518 3.744699 -8.644241      8.151685 
1 1 1 -23 11 18 o 119.3910 3.071214 175.3377       8.928061 198.3252       15.08749 162.9505       11.07535 126.0597 4.920843 114.7302 3.967324 11.32948       6.320946 
1 1 1 -23 11 19 o 109.7654 3.042911 148.2890       8.131514 143.3700       13.01514 151.4384       10.41425 107.0187 5.004464 110.5851 3.870486 -3.566429      6.326557 
1 1 1 -23 11 20 o 83.73566 3.747041 86.90459       7.626643 85.01340       10.57699 88.95278       11.00728 82.12012 5.313912 83.95815 5.408760 -1.838028      7.582371 
1 1 1 -23 11 21 o 49.91747 3.628471 30.98549       4.383660 30.41559       7.985722 31.23129       5.244469 48.17727 7.007242 49.89662 4.356802 -1.719349      8.251253 
1 1 1 -23 11 22 o 100.5840 3.409634 125.2617       8.345352 142.9597       18.36699 120.6574       9.368225 104.6218 7.248924 98.46893 3.911895 6.152878       8.237100 
1 1 1 -23 11 23 o 42.89809 4.130582 23.16100       4.264706 18.80881       7.399242 25.32605       5.218755 36.85044 8.423811 44.60391 4.880884 -7.753471      9.735687 
1 1 1 -23 11 24 o 44.24825 4.038925 24.64761       4.307133 24.46132       7.673353 24.73330       5.204331 42.39108 7.712061 43.98254 4.941016 -1.591461      9.159122 
1 1 1 -23 11 25 o 22.28049 6.341697 6.656669       3.607728 -1.234660      6.610968 10.00349       4.305326 17.31717 7.722352 27.15262 6.577003 -9.835457      10.14355 
1 1 1 -23 11 26 o 36.27650 5.641051 17.33828       4.824798 20.63891       6.940381 14.25134       6.711939 38.53034 7.661522 31.47645 8.536582 7.053896       11.47049 
1 1 1 -23 11 27 o 45.27411 7.208486 28.19982       7.686574 28.19982       7.686574 0.000000       0.000000 45.27411 7.208486 ?        ?        0.000000       7.208486 
1 1 1 -23 11 28 o 24.18360 6.052116 8.018102       3.557806 17.34130       6.468788 3.974793       4.259992 34.77168 7.823888 18.58643 6.964791 16.18525       10.47480 
1 1 1 -23 11 29 o 38.16735 4.788127 19.01779       4.355676 3.535316       8.130189 25.25043       5.158417 21.29591 9.030324 43.98325 4.895617 -22.68734      10.27199 
1 1 1 -23 11 30 o 18.34615 6.498588 4.284529       3.634456 -5.145047      5.901822 10.04517       4.612913 13.86923 6.566288 26.46320 7.033409 -12.59397      9.622108 
1 1 1 -23 11 31 o 30.95646 5.514789 13.03160       4.007667 14.30009       6.510279 12.25760       5.085444 30.48741 8.463550 28.98823 7.224977 1.499176       11.12798 
1 1 1 -23 11 32 o 47.16069 5.266721 29.89060       5.949597 0.000000       0.000000 29.89060       5.949597 ?        ?        47.16069 5.266721 0.000000       5.266721 
1 1 1 -23 11 33 o 10.32544 4.914816 -3.552228      3.394773 -13.22698      5.645554 1.927316       4.248726 10.54252 5.271902 15.85765 6.613760 -5.315129      8.457823 
1 1 1 -23 11 34 o 40.61911 4.442828 21.92122       4.326060 15.65427       6.841693 26.09596       5.584054 30.63937 8.737170 43.55653 5.374792 -12.91716      10.25800 
1 1 1 -23 11 35 o 21.39378 6.652155 6.861528       3.834531 7.643963       6.418551 6.427296       4.781610 22.10828 8.487196 20.70268 7.440578 1.405602       11.28693 
1 1 1 -23 11 36 o 24.61111 7.458657 9.700782       4.859406 4.871272       6.510746 15.77467       7.301509 19.57013 8.176525 29.59745 9.175522 -10.02733      12.29007 
1 1 1 -23 12 1  o 10.76626 4.772933 -0.7958584     2.488086 3.783398       3.126563 -8.703712      4.108648 17.88365 6.042404 9.777713 4.820629 8.105933       7.729754 
1 1 1 -23 12 2  o 66.13937 3.593506 54.01995       5.770059 55.38134       8.434707 52.82247       7.910669 66.47556 5.249389 64.98523 5.034549 1.490334       7.273429 
1 1 1 -23 12 3  o 117.1675 3.284323 168.8282       9.368290 188.7107       14.12696 153.2210       12.51630 123.2863 4.710835 111.1070 4.632897 12.17931       6.607246 
1 1 1 -23 12 4  o 21.88061 7.286551 5.819128       4.548151 7.981843       6.171020 3.247404       6.729294 25.40759 8.488165 21.27382 8.529978 4.133766       12.03368 
1 1 1 -23 12 5  o 75.34016 3.907349 70.13269       7.149214 88.80569       16.25369 65.65343       7.960639 82.99845 8.140714 72.71816 4.514567 10.28029       9.308734 
1 1 1 -23 12 6  o 46.22246 3.606355 26.43644       4.030036 25.80382       7.093168 26.73799       4.897240 44.84333 6.695725 46.31821 4.391184 -1.474876      8.007199 
1 1 1 -23 12 7  o 75.79991 2.847180 70.51900       5.249853 68.75489       9.156316 71.38295       6.407694 74.25520 5.090886 76.13180 3.462886 -1.876602      6.157004 
1 1 1 -23 12 8  o 30.96297 4.624693 12.11017       3.382699 8.834621       6.334940 13.41664       4.000824 26.47191 8.588651 32.47608 5.233145 -6.004171      10.05737 
1 1 1 -23 12 9  o 53.19995 3.182337 34.86125       4.106804 43.31493       7.802690 31.62202       4.829947 58.73292 5.516204 50.50652 3.955810 8.226402       6.788000 
1 1 1 -23 12 10 o 124.8710 2.809975 191.0992       8.550669 188.8183       14.52568 192.3087       10.57752 123.3301 4.842570 125.0266 3.475095 -1.696426      5.960434 
1 1 1 -23 12 11 o 59.74080 3.495920 44.03243       5.067183 43.06255       14.33299 44.17097       5.417001 56.26041 10.84757 59.78233 3.737039 -3.521919      11.47324 
1 1 1 -23 12 12 o 84.28644 2.809260 87.18390       5.762070 87.30048       10.62392 87.13531       6.858453 83.60885 5.240665 84.13591 3.351805 -0.5270615     6.220866 
1 1 1 -23 12 13 o 90.77431 3.166519 101.3241       6.993838 121.5081       11.70696 90.12278       8.721180 98.81349 4.876809 85.30203 4.208454 13.51146       6.441610 
1 1 1 -23 12 14 o 75.14172 2.786841 69.33410       5.094203 84.64580       10.17632 64.21401       5.884611 82.31689 5.098026 72.18330 3.354550 10.13359       6.102694 
1 1 1 -23 12 15 o 56.48950 3.128134 39.32691       4.289337 34.66339       10.15859 40.33873       4.731833 51.23892 8.428552 57.15271 3.413023 -5.913784      9.093361 
1 1 1 -23 12 16 o 27.50636 7.129153 9.996706       4.817483 12.66559       8.907280 8.893227       5.727460 31.01887 10.19199 26.16837 8.128841 4.850500       13.03667 
1 1 1 -23 12 17 o 184.4919 3.586177 419.8757       16.12297 410.4892       24.23340 427.3305       21.59641 180.8434 5.505307 185.1767 4.789869 -4.333313      7.297346 
1 1 1 -23 12 18 o 116.0947 3.061491 165.9182       8.653708 176.9960       14.33526 159.5667       10.85462 118.9348 4.956940 113.4732 3.931348 5.461586       6.326670 
1 1 1 -23 12 19 o 65.06180 4.003659 52.67389       6.316998 55.90465       9.280665 49.88495       8.622742 66.29369 5.803205 62.63940 5.711635 3.654282       8.142480 
1 1 1 -23 12 20 o 27.36780 5.449140 9.749242       3.506379 12.43208       6.848683 8.796198       4.081941 30.17093 8.784431 25.74667 6.504694 4.424259       10.93057 
1 1 1 -23 12 21 o 83.24204 3.087473 85.58010       6.252141 71.56966       10.08293 94.33196       7.969131 74.98025 5.557795 87.11964 3.762564 -12.13940      6.711630 
1 1 1 -23 12 22 o 31.13632 5.687505 12.68404       4.156472 3.383819       11.21972 14.16346       4.474867 24.80639 10.56685 32.90544 5.791975 -8.099051      12.05012 
1 1 1 -23 12 23 o 66.82340 3.315541 55.45480       5.382209 41.81213       8.896777 63.32982       6.759408 56.42182 6.594932 71.16265 3.912867 -14.74083      7.668355 
1 1 1 -23 12 24 o 22.57220 6.425856 6.834076       3.703794 1.756463       6.697038 9.071473       4.445539 19.41728 8.213057 25.79698 6.926447 -6.379698      10.74383 
1 1 1 -23 12 25 o 56.76347 4.293247 40.82596       5.894662 38.52817       8.215853 43.26363       8.462230 53.92115 6.375741 57.32255 6.154168 -3.401398      8.861369 
1 1 1 -23 12 26 o 10.71580 5.189259 -6.243423      4.173675 -0.5639283     6.095448 -11.25658      5.726727 16.89397 7.481005 11.50963 5.677678 5.384334       9.391563 
1 1 1 -23 12 27 o 20.44525 6.488272 5.611378       3.629698 9.131712       6.406303 3.947006       4.404946 25.38674 8.648504 18.70495 7.066509 6.681789       11.16836 
1 1 1 -23 12 28 o 32.12821 5.146165 13.66133       3.893138 5.436477       6.774830 17.71640       4.757005 21.81495 8.620031 36.46543 5.526203 -14.65048      10.23933 
1 1 1 -23 12 29 o 15.70026 6.232059 2.238553       3.556130 -0.1926901     5.810064 3.694948       4.496829 16.49505 7.304097 18.32687 7.085935 -1.831818      10.17646 
1 1 1 -23 12 30 o 33.86314 5.101586 15.28270       4.079286 1.519105       6.278888 25.33517       5.366031 18.05935 7.801923 43.71904 5.134452 -25.65969      9.339839 
1 1 1 -23 12 31 o 46.89062 4.260007 28.54879       4.814719 20.83298       9.025572 31.61786       5.692304 35.17595 10.03664 48.94066 4.836044 -13.76471      11.14098 
1 1 1 -23 12 32 o 13.11111 5.912458 -0.9875005     3.995775 -1.570217      9.656543 -0.8671140     4.389164 18.98873 8.795577 13.80569 6.213714 5.183038       10.76905 
1 1 1 -23 12 33 o 30.47651 5.457441 12.89221       3.904280 11.01767       6.573949 13.91369       4.852825 25.86562 8.761604 30.80702 6.658605 -4.941399      11.00467 
1 1 1 -23 12 34 o 14.53760 6.079260 1.532216       3.603852 -0.5739083     6.023881 2.706229       4.497498 15.80853 7.181018 16.65320 6.862164 -0.8446741     9.932589 
1 1 1 -23 12 35 o 30.08395 6.005613 13.10979       4.248497 20.61320       6.899417 8.526895       5.392035 35.70854 8.113758 22.99394 7.931229 12.71459       11.34625 
1 1 1 -23 12 36 o 17.39786 7.069029 3.569426       4.689924 -7.123175      6.377648 16.16046       6.920692 13.08270 6.353990 30.34659 8.829028 -17.26389      10.87773 
1 1 1 -23 13 1  o 40.57762 5.077134 20.84548       4.910858 18.59073       8.108979 22.15140       6.171253 36.96024 9.071690 41.44685 6.308837 -4.486610      11.04975 
1 1 1 -23 13 2  o 87.18196 3.169556 93.57784       6.722608 72.52428       11.96288 103.2951       8.127265 75.42773 6.573926 91.44881 3.654312 -16.02107      7.521337 
1 1 1 -23 13 3  o 18.57936 6.395373 4.023842       3.505312 3.551301       6.231163 4.242612       4.239786 20.91338 8.265944 19.56075 7.009233 1.352625       10.83767 
1 1 1 -23 13 4  o 132.5708 3.297026 216.1203       10.65139 215.8460       15.67847 216.3555       14.51536 131.6780 4.894527 132.0406 4.517774 -0.3625793     6.660831 
1 1 1 -23 13 5  o 55.60968 3.274404 38.14273       4.417662 34.22281       7.865858 39.94886       5.339261 51.78539 6.366942 56.77806 3.882268 -4.992672      7.457208 
1 1 1 -23 13 6  f 145.3717 3.323105 259.8146       11.77226 296.7496       28.26835 252.0650       12.94850 152.3083 7.640642 142.9794 3.719453 9.328964       8.497867 
1 1 1 -23 13 7  o 37.01817 4.166517 17.13466       3.693387 20.03059       7.048945 16.03876       4.336279 39.02414 7.685926 35.55783 5.154444 3.466309       9.254283 
1 1 1 -23 13 8  o 93.07491 2.791275 106.3098       6.323831 124.6020       11.47797 98.33708       7.577665 100.1256 4.717441 89.33398 3.487529 10.79166       5.866609 
1 1 1 -23 13 9  o 108.1648 2.790859 143.5460       7.350167 143.1127       12.65561 143.7666       9.029042 107.2548 4.854649 108.0567 3.433251 -0.8019180     5.945992 
1 1 1 -23 13 10 o 24.28860 5.695926 7.663357       3.312582 1.168279       6.624262 9.829168       3.825213 19.48357 8.200781 27.52018 5.882229 -8.036608      10.09225 
1 1 1 -23 13 11 o 41.14869 4.175958 21.13570       4.129508 4.786358       13.03487 22.95966       4.353766 27.88011 11.60270 42.89366 4.219775 -15.01355      12.34622 
1 1 1 -23 13 12 f 16.41736 5.887089 2.912831       2.991498 3.349963       7.024490 2.815987       3.306305 21.60637 8.697099 16.67190 6.157179 4.934475       10.65600 
1 1 1 -23 13 13 f 116.5654 2.987994 166.9591       8.480615 176.9862       18.61931 164.3343       9.526114 118.2012 6.488958 115.5064 3.387999 2.694801       7.320185 
1 1 1 -23 13 14 o 62.11200 3.154264 47.55052       4.758668 40.32028       11.12245 49.17057       5.264871 55.20530 8.543375 63.09691 3.437055 -7.891609      9.208833 
1 1 1 -23 13 15 o 24.33218 7.222207 7.714522       4.591767 7.859159       8.658322 7.657925       5.416152 26.57481 9.935249 24.52838 7.940122 2.046429       12.71828 
1 1 1 -23 13 16 o 114.7445 3.232076 162.2303       9.028522 157.8526       14.02837 165.3258       11.79628 112.2325 5.142901 115.3937 4.201967 -3.161194      6.641232 
1 1 1 -23 13 17 o 48.34381 3.329293 28.94267       3.898243 27.75235       8.136666 29.29728       4.441114 45.86807 7.541328 48.52720 3.785454 -2.659126      8.438086 
1 1 1 -23 13 18 o 28.73473 4.692912 10.55546       3.172815 5.099214       6.834979 12.05413       3.582151 22.67577 8.744363 30.67330 4.961659 -7.997530      10.05395 
1 1 1 -23 13 19 o 35.16862 4.408294 15.64444       3.695225 12.55249       7.417639 16.66505       4.261683 30.27721 9.223207 36.14210 4.970211 -5.864887      10.47714 
1 1 1 -23 13 20 o 33.12598 4.787034 14.02497       3.752366 24.48297       7.634550 10.69396       4.308712 42.73155 7.610657 28.36711 6.387246 14.36444       9.935743 
1 1 1 -23 13 21 o 65.68574 4.026167 53.96516       6.413682 53.53418       9.277244 54.35973       8.876645 64.43980 5.975918 65.12605 5.648984 -0.6862488     8.223297 
1 1 1 -23 13 22 o 82.68071 3.455079 84.95818       6.946086 83.98891       15.93734 85.18548       7.717655 78.52000 8.462605 82.59954 3.844720 -4.079536      9.295030 
1 1 1 -23 13 23 o 24.18661 6.084002 7.849788       3.582130 3.252712       6.823883 9.598426       4.208630 20.68164 8.479881 26.63120 6.534828 -5.949553      10.70572 
1 1 1 -23 13 24 o 52.92675 4.620117 35.71759       5.899202 34.10148       8.266144 37.39501       8.421488 50.37321 6.916311 52.94144 6.675777 -2.568226      9.612563 
1 1 1 -23 13 25 o 12.12072 5.616592 -2.791240      3.943654 -5.013147      6.140715 -1.231569      5.144845 14.52203 6.820607 15.16079 6.782977 -0.6387587     9.619223 
1 1 1 -23 13 26 o 34.78180 6.683433 16.61729       5.459048 16.27641       8.997334 16.81590       6.867591 32.34457 10.20914 33.98667 8.352466 -1.642097      13.19053 
1 1 1 -23 13 27 o 40.33222 4.247584 20.88047       4.112143 19.77333       7.062188 21.44839       5.058041 36.95848 8.068198 40.35159 5.269599 -3.393112      9.636623 
1 1 1 -23 13 28 o 26.74036 5.981172 9.830530       3.799782 10.40392       6.606241 9.547048       4.645060 26.47122 8.780773 25.86114 7.137510 0.6100826      11.31574 
1 1 1 -23 13 29 o 14.23976 5.939077 1.125072       3.426177 5.928786       6.055258 -1.137064      4.155310 21.56524 8.252367 13.43979 6.047739 8.125456       10.23116 
1 1 1 -23 13 30 o 49.60408 4.261564 31.86659       5.101488 23.27566       9.216286 35.66158       6.125490 37.59770 9.917862 52.01853 4.889555 -14.42083      11.05765 
1 1 1 -23 13 31 o 38.09250 4.622326 19.18266       4.203083 16.81706       6.858786 20.60521       5.318770 32.69773 8.522472 38.65551 5.827222 -5.957771      10.32420 
1 1 1 -23 13 32 o 17.68550 6.781494 3.818135       4.094661 15.51180       10.99795 1.936368       4.411837 28.56041 11.07095 16.03442 6.717214 12.52600       12.94939 
1 1 1 -23 13 33 o 34.94808 4.787789 16.49050       3.970427 18.56378       6.805906 15.42086       4.888486 34.00393 8.289605 32.60522 6.381055 1.398705       10.46114 
1 1 1 -23 13 34 o 35.29030 5.040623 17.08144       4.211850 11.35537       6.995237 20.33783       5.275239 25.59721 9.020358 37.79919 5.921223 -12.20198      10.79017 
1 1 1 -23 13 35 o 31.60743 5.694327 14.26809       4.224694 9.221379       6.812066 17.42235       5.385473 23.31116 8.791883 34.05180 6.728731 -10.74065      11.07127 
1 1 1 -23 14 1  o 44.20871 4.182535 24.45513       4.452343 20.88087       8.205697 25.94647       5.300430 39.15401 8.813332 45.34177 4.873489 -6.187752      10.07103 
1 1 1 -23 14 2  o 50.04972 3.866647 31.15566       4.679441 27.77846       8.891645 32.44933       5.503185 45.61646 8.304647 50.90986 4.481540 -5.293396      9.436704 
1 1 1 -23 14 3  o 109.7024 2.909035 147.9378       7.769941 127.3098       12.44967 161.0992       9.944404 100.8462 5.082348 114.2263 3.576945 -13.38004      6.214885 
1 1 1 -23 14 4  o 52.58318 3.390767 34.19057       4.321750 33.91363       7.729477 34.31653       5.212688 51.46957 6.293350 52.50238 4.106899 -1.032818      7.514843 
1 1 1 -23 14 5  o 46.10493 4.288507 26.55276       4.763008 33.51239       7.698834 22.23722       6.062474 51.17396 6.306903 41.59791 6.167056 9.576050       8.820975 
1 1 1 -23 14 6  o 45.60612 3.669940 25.81109       4.044256 19.07848       7.381349 28.69920       4.834490 37.77190 8.250648 47.98191 4.176196 -10.21001      9.247368 
1 1 1 -23 14 7  o 82.43735 2.885962 83.52354       5.788691 75.60506       10.03105 87.47718       7.087994 77.61690 5.335860 84.21069 3.461360 -6.593796      6.360221 
1 1 1 -23 14 8  o 69.11230 2.996084 58.77374       5.033992 54.76525       9.047694 60.57099       6.058296 65.87067 5.692304 70.02273 3.562087 -4.152054      6.714967 
1 1 1 -23 14 9  o 85.65091 2.819668 90.11856       5.877244 95.51449       10.66431 87.76478       7.043421 87.41872 5.027217 84.35821 3.433434 3.060509       6.087806 
1 1 1 -23 14 10 o 52.16736 3.357165 33.63110       4.245179 35.11501       8.229002 33.09297       4.955497 52.29928 6.603716 51.60241 3.971297 0.6968689      7.705860 
1 1 1 -23 14 11 o 27.66149 5.690688 9.927831       3.707914 0.000000       0.000000 9.927831       3.707914 ?        ?        27.66149 5.690688 0.000000       5.690688 
1 1 1 -23 14 12 o 76.31986 3.022656 71.69360       5.610514 76.82769       12.85286 70.48501       6.236016 77.42572 6.883745 75.57336 3.394787 1.852356       7.675319 
1 1 1 -23 14 13 f 65.67822 3.542814 53.35136       5.649309 46.71115       11.35889 55.53364       6.511784 59.64468 8.017878 66.87247 4.014400 -7.227787      8.966703 
1 1 1 -23 14 14 o 63.75326 3.330266 50.21120       5.155954 47.73595       9.213183 51.33990       6.221407 61.10289 6.276599 64.27744 3.991556 -3.174545      7.438294 
1 1 1 -23 14 15 o 74.96394 2.838413 69.15131       5.175816 72.05881       10.23901 68.15335       5.998673 75.47047 5.607364 74.28545 3.322121 1.185028       6.517593 
1 1 1 -23 14 16 o 71.49985 4.722242 64.08550       8.181839 73.76815       12.89523 57.56092       10.58542 75.45338 7.096484 66.86887 6.581227 8.584511       9.678463 
1 1 1 -23 14 17 o 32.07224 4.289608 13.01324       3.268621 -1.590637      6.930258 17.19125       3.706808 17.83585 7.933051 36.96363 4.188945 -19.12779      8.971096 
1 1 1 -23 14 18 o 45.67032 3.365876 25.90665       3.719686 18.16142       7.420028 28.50640       4.298866 36.34988 8.525044 47.82136 3.718086 -11.47147      9.300568 
1 1 1 -23 14 19 o 38.04717 4.327620 18.29389       3.941207 9.138555       7.500206 21.78630       4.632322 26.64416 9.344213 41.44596 4.667555 -14.80180      10.44511 
1 1 1 -23 14 20 o 74.37563 3.141108 68.47716       5.680293 71.46666       10.06204 67.07879       6.881743 74.75497 5.563329 73.31575 3.865470 1.439224       6.774400 
1 1 1 -23 14 21 o 98.57071 3.080129 120.2406       7.389577 124.9319       12.45056 117.6893       9.181609 99.10378 5.173313 97.07504 3.889154 2.028740       6.472147 
1 1 1 -23 14 22 o 28.37541 6.075327 10.76458       4.074245 6.394757       11.49578 11.39231       4.357066 26.27284 10.91185 29.11797 6.322016 -2.845125      12.61096 
1 1 1 -23 14 23 o 51.75628 4.588865 34.14472       5.727757 35.09993       8.196729 33.23318       8.007142 51.24020 6.726669 49.81375 6.771324 1.426449       9.544575 
1 1 1 -23 14 24 o 25.95525 7.231008 9.378463       4.742993 7.128339       7.007715 11.28056       6.443020 23.82735 8.932017 28.02544 8.607251 -4.198093      12.40426 
1 1 1 -23 14 25 o 74.47598 3.543271 69.61543       6.412233 46.07737       12.43717 78.13738       7.483518 55.80711 9.484322 78.66041 3.916350 -22.85330      10.26110 
1 1 1 -23 14 26 o 34.86726 5.880275 16.36113       4.818784 21.35804       7.144559 12.19094       6.526837 38.63587 7.856285 28.68952 8.633204 9.946348       11.67276 
1 1 1 -23 14 27 o 32.40415 5.156476 13.92491       3.935525 14.25216       7.044916 13.77646       4.744942 30.63348 8.906590 31.58325 6.384866 -0.9497719     10.95873 
1 1 1 -23 14 28 o 26.82275 6.060541 9.969687       3.867748 7.755299       6.415657 11.23399       4.847736 23.53675 8.596115 27.96069 7.102104 -4.423939      11.15047 
1 1 1 -23 14 29 o 35.96870 4.880984 17.12883       4.167976 15.34803       7.015996 18.10006       5.181375 31.35550 8.816145 36.23737 6.082810 -4.881865      10.71098 
1 1 1 -23 14 30 o 28.44079 6.206802 11.43282       4.180636 10.24966       8.593461 11.79967       4.785056 25.55675 9.818014 28.42500 6.963762 -2.868254      12.03692 
1 1 1 -23 14 31 o 39.89721 4.506124 21.02230       4.304513 19.65839       7.177674 21.78833       5.379171 35.32820 8.451008 39.73487 5.719872 -4.406670      10.20473 
1 1 1 -23 14 32 o 18.40020 6.812674 4.517788       4.052273 -4.991106      9.705191 6.525569       4.459613 17.44298 8.304778 21.02803 7.214470 -3.585045      11.00081 
1 1 1 -23 14 33 o 13.26347 5.778223 0.3605182      3.503609 6.437292       6.019240 -2.753280      4.308741 21.01468 8.177934 12.30224 5.757258 8.712444       10.00123 
1 1 1 -23 14 34 o 28.70681 6.009667 11.97420       4.069009 12.60518       6.528038 11.57329       5.203518 27.00232 8.715117 26.88439 7.604135 0.1179295      11.56616 
1 1 1 -23 15 1  o 91.32021 3.708443 103.4161       8.235505 0.000000       0.000000 103.4161       8.235505 ?        ?        91.32021 3.708443 0.000000       3.708443 
1 1 1 -23 15 2  o 69.48425 3.337115 59.69759       5.634068 47.19572       10.39731 64.89450       6.703573 60.13076 7.241163 72.29157 3.818790 -12.16081      8.186427 
1 1 1 -23 15 3  o 64.00289 3.434602 50.69133       5.337263 35.36055       9.923891 56.93040       6.330823 51.53811 8.174152 67.70633 3.852931 -16.16822      9.036695 
1 1 1 -23 15 4  o 26.92150 5.698866 9.451653       3.622048 11.29535       6.662005 8.677963       4.315620 29.01399 8.720186 25.61212 6.801051 3.401869       11.05875 
1 1 1 -23 15 5  f 19.02366 6.626533 4.214555       3.768091 5.349851       6.197392 3.548712       4.746140 22.44722 8.402816 19.19950 7.316057 3.247721       11.14145 
1 1 1 -23 15 6  o 50.87893 3.411147 32.05162       4.204922 37.49010       7.714442 29.75286       5.015475 54.22084 5.935378 48.79247 4.260864 5.428371       7.306413 
1 1 1 -23 15 7  o 12.12530 5.346271 -0.7663155     3.081067 2.784688       6.296251 -1.884385      3.532978 20.23548 8.202137 12.14544 5.510098 8.090042       9.881104 
1 1 1 -23 15 8  o 48.38684 3.486300 29.01818       4.083259 34.26891       7.917988 27.11591       4.765859 51.62740 6.432749 46.57359 4.245825 5.053814       7.707613 
1 1 1 -23 15 9  o 52.11599 3.845165 33.75923       4.849009 0.000000       0.000000 33.75923       4.849009 ?        ?        52.11599 3.845165 0.000000       3.845165 
1 1 1 -23 15 10 o 58.78736 3.322696 42.71193       4.740664 52.16911       11.11981 40.61124       5.240796 63.37401 7.335584 57.19921 3.781064 6.174805       8.252710 
1 1 1 -23 15 11 o 61.00414 3.750912 46.16898       5.549161 55.87371       11.74805 43.38190       6.295761 65.49249 7.495907 58.92313 4.416703 6.569359       8.700337 
1 1 1 -23 15 12 o 17.98544 6.431767 3.604502       3.568067 1.523335       7.154004 4.293617       4.116627 20.21005 8.515368 19.42856 6.912807 0.7814922      10.96806 
1 1 1 -23 15 13 o 68.41222 2.934348 57.66348       4.880569 59.67950       9.633467 56.96735       5.660825 68.51131 5.825298 67.85885 3.434405 0.6524658      6.762339 
1 1 1 -23 15 14 o 32.04402 4.564757 13.04117       3.463844 26.62980       7.704551 9.598752       3.877851 44.95536 7.281695 27.02185 6.040923 17.93351       9.461280 
1 1 1 -23 15 15 o 40.67641 4.365542 20.82924       4.259670 23.90887       7.991828 19.60715       5.034397 42.14256 8.075826 39.11221 5.428121 3.030354       9.730543 
1 1 1 -23 15 16 o 64.47379 3.481061 51.54937       5.449008 43.11437       8.831733 56.73382       6.923962 57.75387 6.381522 67.36880 4.239035 -9.614929      7.661151 
1 1 1 -23 15 17 o 16.18261 5.783331 2.921670       2.884407 1.044937       6.858987 3.324863       3.179185 19.35296 8.253484 17.10525 6.076087 2.247709       10.24885 
1 1 1 -23 15 18 o 22.39672 7.202146 6.505577       4.460928 3.982396       7.044246 8.194960       5.764004 21.69141 8.716990 24.95834 8.198666 -3.266932      11.96679 
1 1 1 -23 15 19 o 98.07172 2.929477 118.7912       6.993312 124.3109       16.65938 117.6105       7.705070 97.24017 7.078831 97.43161 3.249741 -0.1914368     7.789138 
1 1 1 -23 15 20 o 39.84534 3.749826 19.93977       3.598229 15.03776       7.777303 21.27482       4.058747 32.39907 9.339772 41.04746 4.112950 -8.648396      10.20528 
1 1 1 -23 15 21 o 75.72935 3.224108 71.25155       5.936288 67.18810       10.12013 73.38313       7.329749 71.99136 5.818115 76.49172 3.945561 -4.500366      7.029788 
1 1 1 -23 15 22 o 74.46182 4.700400 70.60434       8.485604 76.20250       15.60777 68.25524       10.11041 73.51054 8.893333 72.42122 5.776690 1.089317       10.60479 
1 1 1 -23 15 23 o 45.46819 5.060153 26.77505       5.511826 24.70095       7.957095 28.68824       7.642234 41.82643 8.099386 45.87349 7.062570 -4.047058      10.74616 
1 1 1 -23 15 24 o 77.31651 3.497279 74.96052       6.572230 58.58200       13.00957 80.57282       7.615460 64.03103 8.551085 79.87333 3.924551 -15.84230      9.408674 
1 1 1 -23 15 25 o 46.89637 4.042036 28.01884       4.574259 27.66039       7.872945 28.20150       5.620198 44.34286 7.556487 46.50182 5.040070 -2.158962      9.083106 
1 1 1 -23 15 26 o 20.96053 7.089462 5.918220       4.304052 6.164544       6.178484 5.685986       5.999172 22.07663 8.362539 21.51737 8.218990 0.5592594      11.72535 
1 1 1 -23 15 27 o 34.01404 5.009120 15.31258       4.027798 11.12471       6.803578 17.57233       4.997705 27.08491 8.907897 35.95590 5.908876 -8.870996      10.68950 
1 1 1 -23 15 28 o 14.32562 5.975679 1.174317       3.469213 -0.8312895     5.987931 2.187687       4.256357 16.18208 7.272639 16.39481 6.706825 -0.2127285     9.893067 
1 1 1 -23 15 29 o 25.50171 6.524296 9.332904       4.070562 13.02248       8.058555 8.069037       4.716499 28.12106 9.696162 23.43578 7.390931 4.685274       12.19186 
1 1 1 -23 15 30 o 43.94636 4.193295 25.17800       4.436322 21.31312       7.345100 27.39759       5.566301 37.04330 8.338481 45.13293 5.153252 -8.089626      9.802361 
1 1 1 -23 15 31 o 27.11797 6.120039 10.56263       3.948009 12.12201       6.482135 9.643054       4.977794 27.15828 8.676600 25.00588 7.542696 2.152401       11.49677 
1 1 1 -23 15 32 o 22.86098 7.181112 7.984697       4.456746 11.65309       11.14691 7.286710       4.862289 25.42861 10.66655 21.86246 7.531948 3.566151       13.05778 
1 1 1 -23 15 33 o 17.20790 6.546756 3.804331       3.796703 6.387351       6.107769 2.177668       4.846938 20.86982 8.203669 16.42397 6.968783 4.445848       10.76402 
1 1 1 -23 15 34 o 40.05011 4.703236 21.77428       4.502878 20.58656       7.249091 22.52047       5.745811 34.97856 8.572365 39.35121 6.196491 -4.372650      10.57743 
1 1 1 -23 16 1  o 39.92126 5.421838 20.48810       5.138370 0.000000       0.000000 20.48810       5.138370 ?        ?        39.92126 5.421838 0.000000       5.421838 
1 1 1 -23 16 2  o 42.90583 4.268617 23.15549       4.403991 13.09278       8.370280 27.00750       5.178765 30.81543 9.861172 46.23588 4.659829 -15.42046      10.90673 
1 1 1 -23 16 3  o 54.60348 3.718573 37.10271       4.918509 38.34434       10.00347 36.70684       5.648424 53.66282 7.884571 54.11444 4.319116 -0.4516220     8.990063 
1 1 1 -23 16 4  o 35.56934 4.609007 16.04421       3.901183 16.87973       6.939832 15.65820       4.717044 35.20024 8.237207 34.76008 5.770979 0.4401665      10.05762 
1 1 1 -23 16 5  o 47.21156 4.573992 28.05595       5.196504 36.76750       9.461758 24.29332       6.218267 52.77998 7.573071 43.38066 6.046225 9.399319       9.690626 
1 1 1 -23 16 6  o 13.72680 5.703663 0.7162681      3.142850 -9.505828      7.476532 2.910239       3.463743 14.93083 7.157607 16.90450 6.291072 -1.973663      9.529371 
1 1 1 -23 16 7  o 53.80197 4.019420 36.10140       5.231759 41.25210       10.25669 34.28996       6.082553 55.90906 7.735153 52.15729 4.840826 3.751770       9.125031 
1 1 1 -23 16 8  o 35.23150 5.282052 15.90704       4.395315 18.32108       9.156385 15.18423       5.010314 36.14684 10.03823 34.08354 6.263043 2.063305       11.83181 
1 1 1 -23 16 9  o 31.27771 5.391204 12.62485       3.960857 15.73127       7.230578 11.29303       4.734389 33.88175 8.709780 29.15188 6.791093 4.729866       11.04442 
1 1 1 -23 16 10 o 15.08468 6.081902 1.461770       3.441259 4.858221       6.657767 0.2235554      4.019887 22.29584 8.621599 14.79221 6.313775 7.503622       10.68624 
1 1 1 -23 16 11 o 58.02460 3.228937 41.64229       4.547699 40.99213       8.932751 41.86975       5.283691 56.25291 6.644430 58.03200 3.756413 -1.779087      7.632764 
1 1 1 -23 16 12 o 74.16862 3.206927 67.96341       5.782530 66.65154       16.37860 68.15022       6.180539 69.55243 9.946219 74.19817 3.427455 -4.645744      10.52021 
1 1 1 -23 16 13 o 35.60930 4.178385 15.97928       3.556939 16.07293       7.520861 15.95230       4.036963 34.07064 8.945892 35.39455 4.804309 -1.323910      10.15433 
1 1 1 -23 16 14 o 40.07462 4.517612 20.30535       4.334995 20.22235       7.925216 20.34078       5.178336 38.29879 8.691451 39.77644 5.488420 -1.477654      10.27930 
1 1 1 -23 16 15 o 46.23383 3.463662 26.59941       3.874033 24.75855       8.337468 27.10630       4.375003 42.58842 8.332069 46.54880 3.892464 -3.960381      9.196448 
1 1 1 -23 16 16 o 55.04686 3.768018 37.81614       5.024058 25.53659       8.383018 44.69873       6.276038 43.21931 8.260541 59.64133 4.348063 -16.42202      9.334998 
1 1 1 -23 16 17 o 32.98198 4.934516 13.99369       3.844348 11.64463       7.621150 14.79541       4.452302 29.02070 9.420642 33.68255 5.622350 -4.661852      10.97084 
1 1 1 -23 16 18 o 34.98105 4.004685 15.46265       3.352332 19.38447       7.713647 14.54943       3.722229 37.14555 8.678770 33.70973 4.655329 3.435818       9.848510 
1 1 1 -23 16 19 o 27.63489 5.245787 10.00933       3.403506 5.229908       7.397749 11.29261       3.833291 22.77251 9.004720 29.27570 5.576725 -6.503183      10.59173 
1 1 1 -23 16 20 o 31.34912 4.609083 12.65846       3.416051 9.097265       7.237883 13.67908       3.874763 26.03128 9.175287 32.43869 5.067325 -6.407402      10.48159 
1 1 1 -23 16 21 o 39.23824 4.534825 19.72607       4.256464 9.336304       7.359925 24.94747       5.217514 26.14923 9.249146 43.98481 4.953758 -17.83558      10.49221 
1 1 1 -23 16 22 o 21.21199 6.682161 6.033744       3.856286 11.51164       12.28472 5.434954       4.061587 29.01237 11.56124 20.43649 6.886906 8.575878       13.45703 
1 1 1 -23 16 23 o 51.70953 3.881952 33.85249       4.855957 40.23099       10.68998 32.19411       5.450787 52.88207 8.589794 50.09216 4.513691 2.789909       9.703503 
1 1 1 -23 16 24 o 42.55222 4.148571 23.15736       4.247303 13.58369       7.128138 28.42745       5.288664 30.04771 9.017653 46.88728 4.691600 -16.83957      10.16510 
1 1 1 -23 16 25 o 40.70221 4.350489 21.35552       4.248273 17.25215       7.338501 23.42381       5.210067 33.81728 8.816067 42.18666 5.176303 -8.369389      10.22336 
1 1 1 -23 16 26 o 21.40799 7.138461 6.318637       4.364886 2.124571       6.111903 10.68435       6.235720 18.43823 7.824551 26.71854 8.507217 -8.280310      11.55839 
1 1 1 -23 16 27 o 47.46655 3.978999 28.89709       4.560222 11.79534       7.114227 40.82473       5.941343 27.52827 9.111433 56.18763 4.373606 -28.65936      10.10676 
1 1 1 -23 16 28 o 27.02602 6.454976 10.41719       4.192621 9.843654       7.962309 10.63722       4.931690 25.30419 9.513511 26.81224 7.336421 -1.508059      12.01374 
1 1 1 -23 16 29 o 98.67194 3.212633 123.0171       7.714567 109.9302       11.65240 133.2298       10.29361 90.53217 5.304977 101.4608 4.172157 -10.92865      6.749051 
1 1 1 -23 16 30 o 15.39499 6.247889 2.162006       3.658625 -0.1458633     5.855742 3.639800       4.685796 16.07273 7.210238 17.91018 7.139206 -1.837444      10.14671 
1 1 1 -23 16 31 o 46.48753 4.202940 28.41493       4.709919 25.97644       7.614319 29.92617       5.994270 40.91272 7.923543 46.67949 5.367106 -5.766762      9.570181 
1 1 1 -23 16 32 o 31.03411 5.730090 13.66730       4.173879 10.72198       6.693973 15.54080       5.338799 25.11361 8.826127 32.03198 7.032596 -6.918365      11.28530 
1 1 1 -23 16 33 o 18.56026 6.726450 4.893289       3.917774 4.963535       6.332541 4.849728       4.986676 19.62130 8.119465 18.91165 7.419027 0.7096539      10.99853 
1 1 1 -23 17 1  o 32.30844 5.302508 13.55156       4.030080 21.48103       8.077512 10.92351       4.650210 39.21329 8.682336 28.44806 6.800367 10.76523       11.02851 
1 1 1 -23 17 2  o 34.41013 6.119307 15.58098       4.943213 10.12782       8.206684 18.68600       6.192643 27.72441 9.770243 37.34607 7.063151 -9.621656      12.05594 
1 1 1 -23 17 3  o 15.48573 6.492366 0.8658683      4.126289 -4.793583      6.910237 4.002042       5.144058 15.98989 7.418263 19.90718 7.609055 -3.917296      10.62677 
1 1 1 -23 17 4  o 55.57000 4.264662 38.74987       5.730987 31.20341       9.900561 42.55271       7.028172 47.60821 8.859756 57.92852 5.028438 -10.32031      10.18727 
1 1 1 -23 17 5  o 50.92665 5.003549 32.91373       6.129456 27.23536       7.641959 43.15593       10.26335 45.34748 7.152118 57.03294 7.571474 -11.68546      10.41537 
1 1 1 -23 17 6  o 83.21465 3.189988 85.59801       6.456838 75.08340       9.889235 93.41109       8.524660 76.95577 5.305811 86.55950 4.052598 -9.603729      6.676465 
1 1 1 -23 17 7  o 75.93958 2.983895 71.16816       5.511144 81.10571       10.17873 67.04671       6.555101 80.04147 5.247399 73.46391 3.673238 6.577560       6.405301 
1 1 1 -23 17 8  o 31.71841 4.651795 12.83689       3.488764 20.35090       6.984062 10.33846       4.027223 38.89761 7.640710 27.98673 6.079289 10.91087       9.764129 
1 1 1 -23 17 9  o 51.36945 3.395144 32.76052       4.226269 37.36497       8.151501 31.06779       4.942434 53.69870 6.352122 49.80397 4.108829 3.894726       7.565178 
1 1 1 -23 17 10 o 67.98470 2.970304 57.06131       4.909065 53.32347       9.299991 58.50507       5.779904 64.43964 5.990958 68.68040 3.464628 -4.240761      6.920638 
1 1 1 -23 17 11 o 86.99117 2.865909 93.29897       6.067091 82.20813       10.82738 98.37527       7.325123 80.35131 5.563969 89.12667 3.378767 -8.775360      6.509518 
1 1 1 -23 17 12 o 15.71773 6.111124 2.144377       3.358859 7.641449       11.72592 1.653014       3.505764 27.72694 11.20973 15.34744 6.155742 12.37950       12.78871 
1 1 1 -23 17 13 o 53.70366 3.737399 35.98378       4.860612 33.76545       8.611939 37.02077       5.888092 50.46062 7.208036 54.19514 4.498916 -3.734528      8.496824 
1 1 1 -23 17 14 o 68.50327 3.017780 58.03373       5.025368 63.46795       10.26054 56.31879       5.764039 70.12369 6.063929 67.30027 3.526894 2.823418       7.014999 
1 1 1 -23 17 15 o 15.03685 5.747997 2.119207       2.935641 7.331450       6.654454 0.8596918      3.271159 24.32708 8.773201 14.03293 5.823867 10.29415       10.53027 
1 1 1 -23 17 16 o 75.80478 3.431007 71.43816       6.321600 69.49983       10.16830 72.65932       8.070903 73.48306 5.723500 75.98090 4.377477 -2.497849      7.205606 
1 1 1 -23 17 17 o 87.15845 2.813699 93.86143       5.968342 81.59564       10.79258 99.26495       7.163342 79.63727 5.596894 89.40688 3.293454 -9.769608      6.494002 
1 1 1 -23 17 18 o 40.80573 3.781673 20.95876       3.717683 22.36846       7.892334 20.55676       4.214550 39.90088 8.383747 40.19558 4.373072 -0.2947006     9.455738 
1 1 1 -23 17 19 o 72.12271 3.385209 64.87029       5.933079 52.84877       9.603373 72.29137       7.545320 63.30167 6.309414 75.74249 4.103237 -12.44081      7.526305 
1 1 1 -23 17 20 o 63.94852 3.591090 51.25697       5.573712 41.50899       9.332172 56.66246       6.949337 55.35230 7.080389 66.85539 4.288118 -11.50309      8.277673 
1 1 1 -23 17 21 o 16.79689 6.353707 2.992650       3.563718 -2.029131      6.988496 4.757420       4.142848 17.11258 7.758032 19.55589 6.937150 -2.443306      10.40726 
1 1 1 -23 17 22 o 21.51406 6.088609 6.305167       3.335095 3.890058       10.84542 6.557401       3.504930 23.63957 10.23324 21.90130 6.256238 1.738277       11.99415 
1 1 1 -23 17 23 o 28.88957 4.980977 11.02761       3.380035 12.17967       6.859532 10.65819       3.884334 28.55548 8.900073 27.99274 5.881491 0.5627403      10.66786 
1 1 1 -23 17 24 o 73.73499 3.278843 68.19008       5.876826 65.91747       9.539639 69.58007       7.460621 70.61459 5.589276 73.84639 4.162665 -3.231796      6.969060 
1 1 1 -23 17 25 o 36.63051 4.689492 17.55867       4.090167 14.36769       6.728756 19.42871       5.151075 30.73243 8.631249 37.93709 5.751996 -7.204666      10.37227 
1 1 1 -23 17 26 o 41.20023 5.297712 22.64975       5.195970 21.69612       7.150274 23.71682       7.563552 38.38447 7.907465 40.07754 8.024530 -1.693073      11.26593 
1 1 1 -23 17 27 o 55.13186 3.934809 39.03362       5.251677 27.02291       9.619256 44.13381       6.268303 40.65478 9.820578 58.22964 4.451169 -17.57486      10.78224 
1 1 1 -23 17 28 o 49.17525 5.129295 32.39246       6.056415 39.26647       8.380672 24.87834       8.762190 52.61422 6.687295 39.14018 9.320785 13.47404       11.47157 
1 1 1 -23 17 29 o 25.49942 6.208657 9.368986       3.821400 9.430773       6.503093 9.336397       4.722845 24.38102 8.687041 24.81730 7.313910 -0.4362812     11.35597 
1 1 1 -23 17 30 o 41.04034 4.575041 22.46031       4.497825 21.41145       7.106927 23.16112       5.809261 36.86233 8.130309 40.42072 6.086306 -3.558392      10.15604 
1 1 1 -23 17 31 o 29.07755 6.692425 12.61845       4.643765 17.95078       11.02134 11.46747       5.120475 29.33426 11.15566 27.02341 7.507524 2.310858       13.44662 
1 1 1 -23 17 32 f 37.59730 4.884807 19.30321       4.369779 22.48601       7.105929 17.36764       5.541414 37.45626 8.026457 33.86580 6.947845 3.590462       10.61586 
1 1 1 -23 18 1  o 25.60612 6.962346 8.941172       4.457933 3.543714       7.091157 12.46830       5.732352 21.14345 8.653954 29.93210 7.786138 -8.788647      11.64108 
1 1 1 -23 18 2  o 18.74836 6.696988 4.126428       3.867277 0.000000       0.000000 4.126428       3.867277 ?        ?        18.74836 6.696988 0.000000       6.696988 
1 1 1 -23 18 3  o 51.04554 3.781374 32.62855       4.670342 31.54132       9.032297 33.02531       5.456375 48.06081 7.992675 51.10565 4.424813 -3.044846      9.135745 
1 1 1 -23 18 4  o 28.16290 5.394576 10.39089       3.567540 7.130538       7.577542 11.31937       4.043740 24.62382 9.275822 29.25725 5.875957 -4.633432      10.98033 
1 1 1 -23 18 5  o 13.36349 5.699546 0.2228911      3.271294 -5.736158      7.460219 1.641467       3.639900 16.24852 7.594778 15.49242 6.251894 0.7561064      9.837013 
1 1 1 -23 18 6  o 24.24951 6.141174 7.843021       3.632260 12.38686       7.049213 6.200518       4.238210 29.78614 8.974000 21.85418 7.019328 7.931965       11.39314 
1 1 1 -23 18 7  o 110.5690 2.834049 150.8058       7.629899 151.5201       13.17583 150.4454       9.358753 109.4691 4.951950 110.0883 3.492937 -0.6191711     6.059902 
1 1 1 -23 18 8  o 58.07169 3.207636 41.82691       4.521633 39.05591       8.407896 42.95440       5.363215 54.68510 6.432178 58.65570 3.772136 -3.970596      7.456670 
1 1 1 -23 18 9  o 94.14223 2.836403 109.3529       6.499694 125.6773       12.08274 102.7055       7.710304 99.65092 4.991519 90.94369 3.485519 8.707237       6.088030 
1 1 1 -23 18 10 o 68.99094 3.016313 58.88025       5.058874 55.48743       9.393788 60.26617       6.003858 65.57038 5.943400 69.59897 3.551647 -4.028587      6.923742 
1 1 1 -23 18 11 o 97.47123 2.864184 117.2791       6.795825 113.6931       12.37648 118.8270       8.131291 94.42219 5.401355 97.84653 3.415423 -3.424347      6.390598 
1 1 1 -23 18 12 o 55.16418 3.597090 37.96233       4.809162 47.24521       13.91577 36.70327       5.124932 57.24392 10.35682 54.12304 3.912107 3.120884       11.07106 
1 1 1 -23 18 13 o 48.93812 3.491401 29.87936       4.136386 33.78115       8.525541 28.67813       4.730452 50.29782 7.157392 47.72611 4.107253 2.571716       8.252138 
1 1 1 -23 18 14 o 42.62880 3.739435 22.80434       3.845286 14.88834       7.888874 25.27120       4.403867 32.17929 9.444441 44.77066 4.081322 -12.59137      10.28857 
1 1 1 -23 18 15 o 25.12601 5.472827 8.360167       3.255899 9.416058       6.960573 8.064426       3.683753 26.37267 9.014200 24.49176 6.174679 1.880911       10.92623 
1 1 1 -23 18 16 o 52.24447 4.817848 34.87722       6.064754 23.56823       8.108374 49.23820       9.137219 40.94175 8.408663 61.26551 6.205639 -20.32376      10.45063 
1 1 1 -23 18 17 o 89.10791 2.839053 98.30036       6.157031 76.80800       10.46003 109.6950       7.616256 76.99107 5.613723 93.85642 3.335280 -16.86536      6.529777 
1 1 1 -23 18 18 o 34.94273 4.990084 15.86903       4.128592 5.413678       7.203813 20.98284       5.038082 22.49844 8.889177 40.12359 5.280699 -17.62515      10.33940 
1 1 1 -23 18 19 o 48.27401 3.997224 29.52501       4.660159 25.10881       7.964040 31.82446       5.746719 42.15077 8.046820 49.71937 4.802773 -7.568604      9.371122 
1 1 1 -23 18 20 o 26.12102 5.450831 9.143024       3.357338 17.72814       9.608992 7.949245       3.583165 33.52231 10.54638 24.11287 6.095673 9.409441       12.18127 
1 1 1 -23 18 21 o 15.20245 5.821277 2.316988       3.014385 1.963285       6.241611 2.424582       3.442461 18.67097 7.914545 15.88072 6.183264 2.790244       10.04354 
1 1 1 -23 18 22 o 35.24440 4.689791 16.18287       3.928033 -3.587618      10.64151 19.30157       4.226508 19.90090 9.223367 38.58694 4.584238 -18.68604      10.29979 
1 1 1 -23 18 23 o 30.79152 5.411672 12.71324       3.912546 6.858227       6.403589 16.20102       4.942353 22.79344 8.539598 34.44861 6.111212 -11.65517      10.50103 
1 1 1 -23 18 24 f 16.78310 6.084832 3.391410       3.206433 2.301375       6.151226 3.798099       3.757273 18.58013 7.865684 17.78564 6.564527 0.7944946      10.24510 
1 1 1 -23 18 25 o 37.07947 4.797612 18.12412       4.233539 15.41056       7.192065 19.56290       5.236967 31.35961 8.963149 37.87547 5.863240 -6.515854      10.71054 
1 1 1 -23 18 26 o 20.98436 7.344533 6.139894       4.632088 6.453456       7.104140 5.908000       6.109353 22.22430 8.812692 21.30165 8.252975 0.9226513      12.07374 
1 1 1 -23 18 27 o 19.31851 6.527147 5.159963       3.648333 -0.9845502     6.311782 8.242920       4.470870 16.23900 7.366306 23.61115 7.153983 -7.372150      10.26849 
1 1 1 -23 18 28 o 19.47894 6.755325 5.312251       3.913855 3.341314       6.776395 6.298854       4.794394 19.25220 8.206864 20.91623 7.458273 -1.664030      11.08957 
1 1 1 -23 18 29 o 64.67573 3.633379 53.81619       5.703460 44.84618       9.125350 59.56658       7.306373 55.39033 6.910408 67.13025 4.492149 -11.73992      8.242156 
1 1 1 -23 18 30 o 36.58510 5.015576 18.27052       4.353996 18.03443       6.779285 18.43628       5.680396 33.27348 8.369695 35.19574 6.869618 -1.922268      10.82790 
1 1 1 -23 18 31 o 35.20418 6.036698 17.83989       4.992484 12.27967       11.05514 19.26435       5.595566 25.30177 10.61854 36.07888 6.607792 -10.77712      12.50665 
1 1 1 -23 19 1  o 36.06116 4.420655 16.65660       3.803584 9.371586       7.067216 19.62727       4.512945 26.10221 9.076109 39.00004 4.853232 -12.89783      10.29221 
1 1 1 -23 19 2  f 50.32959 4.383714 32.17739       5.322935 0.000000       0.000000 32.17739       5.322935 ?        ?        50.32959 4.383714 0.000000       4.383714 
1 1 1 -23 19 3  o 48.27947 3.835726 29.31711       4.475732 26.90145       8.746324 30.17410       5.209501 43.71269 8.517000 48.73217 4.435311 -5.019478      9.602670 
1 1 1 -23 19 4  o 29.41505 5.613910 11.43435       3.877360 8.415587       7.850685 12.40827       4.459168 25.67193 9.486564 30.42975 6.223487 -4.757816      11.34578 
1 1 1 -23 19 5  o 53.42638 3.761965 35.77829       4.866551 33.25756       9.943990 36.57217       5.580513 48.72642 8.693454 53.79489 4.292517 -5.068466      9.695455 
1 1 1 -23 19 6  o 54.33872 4.105384 37.18267       5.396035 42.80919       8.287652 33.04225       7.109422 57.30152 6.025159 50.34325 5.907294 6.958267       8.437930 
1 1 1 -23 19 7  o 62.24268 3.143382 48.09332       4.752404 37.95507       8.281260 53.07171       5.803092 53.68256 6.460013 65.17813 3.668411 -11.49557      7.428930 
1 1 1 -23 19 8  o 80.39021 2.898496 79.93503       5.668922 90.14187       10.59772 75.84380       6.709551 84.01505 5.201813 78.01827 3.538286 5.996773       6.291130 
1 1 1 -23 19 9  o 72.21387 2.985079 64.58450       5.241737 62.10219       9.456096 65.68558       6.297884 69.39053 5.640714 72.57611 3.571915 -3.185577      6.676543 
1 1 1 -23 19 10 o 11.73381 5.239745 -1.009616      3.054591 -2.085269      6.382520 -0.6900463     3.478874 16.54307 7.465153 12.86712 5.676829 3.675947       9.378428 
1 1 1 -23 19 11 o 44.98849 3.608525 25.35732       3.922949 27.94967       7.539223 24.39485       4.593833 45.63429 7.002807 43.84776 4.356813 1.786533       8.247493 
1 1 1 -23 19 12 o 74.64835 3.282371 69.29410       5.956360 61.10586       15.72859 70.66499       6.435684 64.69774 10.32287 75.27206 3.518261 -10.57432      10.90595 
1 1 1 -23 19 13 o 33.45281 5.060593 14.53087       3.996664 3.566637       6.743505 20.46735       4.962049 20.77263 8.463029 39.72398 5.254674 -18.95135      9.961649 
1 1 1 -23 19 14 o 35.21748 4.229316 15.81174       3.557112 12.55018       6.933498 16.97685       4.144037 29.55911 8.898806 36.28520 4.804559 -6.726089      10.11299 
1 1 1 -23 19 15 o 73.08898 3.255470 66.54356       5.783763 53.69972       13.83505 69.26361       6.366815 60.77256 9.665261 74.43397 3.520036 -13.66141      10.28630 
1 1 1 -23 19 16 o 27.97676 7.460034 10.97588       5.178880 8.788041       6.651697 14.34357       8.252604 25.32957 8.805381 31.01096 9.776082 -5.681389      13.15699 
1 1 1 -23 19 17 o 49.15120 3.902012 30.55380       4.635349 36.77864       7.731151 27.06019       5.791841 52.61005 6.145964 45.53120 5.320177 7.078846       8.128786 
1 1 1 -23 19 18 o 69.94323 2.938533 60.85315       4.997396 43.84481       8.693798 69.24638       6.107213 57.22622 6.340416 74.37685 3.378349 -17.15063      7.184298 
1 1 1 -23 19 19 o 23.31555 5.834095 7.406342       3.306414 5.562363       7.940393 7.793142       3.636701 22.77876 9.218989 23.80822 6.205918 -1.029461      11.11320 
1 1 1 -23 19 20 o 25.99131 5.270219 9.048072       3.223686 7.873149       6.320443 9.461186       3.747818 23.92630 8.559813 26.29354 5.984126 -2.367249      10.44415 
1 1 1 -23 19 21 o 28.50203 5.182539 10.83255       3.467044 7.370941       6.820846 12.03852       4.025926 23.50955 8.812281 29.80817 5.750720 -6.298618      10.52269 
1 1 1 -23 19 22 o 21.96299 6.034464 6.668636       3.328713 0.6633602      6.493488 8.809229       3.876847 17.84071 7.817229 25.10954 6.336667 -7.268829      10.06292 
1 1 1 -23 19 23 o 28.59970 5.033575 10.92738       3.380060 4.060131       6.267676 13.74360       4.013734 20.03337 8.160057 31.98783 5.336978 -11.95447      9.750378 
1 1 1 -23 19 24 o 49.64585 4.364491 31.96652       5.226537 32.76535       10.08798 31.67342       6.110602 45.73103 9.367589 48.79723 5.219677 -3.066204      10.72365 
1 1 1 -23 19 25 o 42.46990 6.161426 25.00002       6.190765 25.60071       9.633628 24.57745       8.079988 39.15515 10.04725 39.96420 8.554859 -0.8090439     13.19594 
1 1 1 -23 19 26 o 14.05859 5.704912 1.599094       3.049968 2.369851       5.896040 1.317493       3.563840 17.99176 7.661927 14.46852 6.047538 3.523245       9.761037 
1 1 1 -23 19 27 o 16.62002 6.402131 3.209995       3.660937 2.205516       6.152966 3.760460       4.554904 17.94843 7.738472 17.95275 7.076066 -0.4323959E-02 10.48593 
1 1 1 -23 19 28 o 35.91251 5.083737 17.57277       4.324790 26.58794       7.297937 12.69322       5.369118 42.05613 7.390486 28.58963 7.583193 13.46650       10.58887 
1 1 1 -23 19 29 o 29.81452 5.926242 12.71801       4.153990 14.95897       7.005536 11.50283       5.158742 29.55146 8.955418 27.07301 7.540847 2.478443       11.70743 
1 1 1 -23 19 30 o 12.48612 5.670195 -1.019567      3.752471 2.927516       6.314189 -3.174801      4.665805 18.18062 7.838894 12.56742 5.915919 5.613195       9.820710 
1 1 1 -23 19 31 o 17.20598 6.841257 3.584344       4.292273 2.897607       10.46111 3.723362       4.706711 20.37355 9.334095 17.62641 7.110622 2.747147       11.73398 
1 1 1 -23 20 1  o 25.69915 5.520672 8.870225       3.354226 8.220604       5.988513 9.167192       4.048953 24.38588 8.360377 25.78680 6.458072 -1.400923      10.56421 
1 1 1 -23 20 2  o 39.45131 4.869749 20.17349       4.582436 0.000000       0.000000 20.17349       4.582436 ?        ?        39.45131 4.869749 0.000000       4.869749 
1 1 1 -23 20 3  o 14.05199 5.770051 1.158685       3.165369 0.7932414      6.242700 1.285157       3.672481 17.99280 7.776306 14.99042 6.191318 3.002378       9.939988 
1 1 1 -23 20 4  o 33.40975 4.798377 14.47268       3.794691 11.58027       7.725947 15.39229       4.356364 28.30725 9.498162 34.21066 5.404782 -5.903416      10.92826 
1 1 1 -23 20 5  o 81.58720 3.126658 82.77644       6.204889 67.93264       11.92177 88.29133       7.266685 71.10988 6.969179 84.01722 3.557262 -12.90734      7.824549 
1 1 1 -23 20 6  o 37.52523 5.775643 18.59437       5.112407 13.91665       8.163554 21.61262       6.557528 30.70971 9.728607 39.83563 7.011031 -9.125914      11.99168 
1 1 1 -23 20 7  o 22.41699 5.805744 6.753533       3.196522 12.84033       6.126732 4.476978       3.746912 30.05648 8.157828 19.01652 6.608858 11.03996       10.49891 
1 1 1 -23 20 8  o 93.80347 3.187057 109.4077       7.274677 92.73519       17.01710 113.1359       8.047040 81.26694 8.729505 95.21101 3.474095 -13.94407      9.395402 
1 1 1 -23 20 9  o 17.12086 6.323990 3.244288       3.488122 7.073273       6.293020 1.546200       4.190804 23.52510 8.525131 16.05479 6.620676 7.470314       10.79404 
1 1 1 -23 20 10 o 20.86286 5.995439 5.826878       3.209512 4.189636       6.006226 6.481232       3.797096 20.54265 8.116641 21.93425 6.581342 -1.391600      10.44959 
1 1 1 -23 20 11 o 29.04193 5.096808 11.06590       3.475613 8.829700       6.625499 11.91490       4.082424 25.41369 8.790521 29.86640 5.818429 -4.452705      10.54170 
1 1 1 -23 20 12 o 22.03479 6.487786 6.569931       3.717644 8.866517       6.403710 5.402414       4.565853 25.36819 8.646665 20.69947 7.288161 4.668716       11.30850 
1 1 1 -23 20 13 o 31.15310 5.215750 12.75990       3.819775 14.95018       6.763648 11.73418       4.628562 32.13284 8.505733 29.23836 6.647187 2.894472       10.79503 
1 1 1 -23 20 14 o 56.01014 3.658946 39.45757       4.966776 41.66203       8.248104 38.20345       6.221173 56.02991 6.141364 54.54618 4.726892 1.483727       7.749830 
1 1 1 -23 20 15 o 13.80413 5.782103 0.8046672      3.268307 5.815337       6.217732 -1.108351      3.841879 22.02513 8.378326 13.08265 5.856731 8.942472       10.22241 
1 1 1 -23 20 16 o 9.750748 4.630606 -3.348122      2.979032 0.1414007      6.465491 -4.288606      3.356559 17.69772 7.776054 10.02601 4.803528 7.671704       9.140071 
1 1 1 -23 20 17 o 27.52235 5.730198 10.24277       3.718095 1.029009       10.47712 11.57032       3.976943 21.87122 9.739389 29.27079 5.780621 -7.399569      11.32569 
1 1 1 -23 20 18 o 24.84806 6.069431 8.487393       3.643077 4.316512       8.461969 9.436360       4.036296 22.14689 9.291998 26.08585 6.398809 -3.938959      11.28211 
1 1 1 -23 20 19 o 34.23093 4.364774 15.16466       3.558261 12.47068       6.750802 16.20103       4.187119 28.80069 8.803874 35.06940 5.044436 -6.268709      10.14665 
1 1 1 -23 20 20 o 38.16843 4.099616 18.71978       3.753450 17.31206       6.877424 19.31695       4.479384 34.11137 8.343592 38.36710 4.902846 -4.255726      9.677470 
1 1 1 -23 20 21 o 38.75889 4.419407 19.50050       4.099688 18.81083       10.84276 19.61554       4.428441 32.95950 11.25094 38.66589 4.803112 -5.706394      12.23329 
1 1 1 -23 20 22 o 12.43238 5.417661 -0.6845211E-01 3.081809 1.334747       5.992091 -0.5731151     3.593516 17.63174 7.619437 12.90509 5.727775 4.726657       9.532220 
1 1 1 -23 20 23 o 38.33041 5.160676 19.64477       4.698075 21.33314       9.718028 19.12982       5.366910 35.21562 10.52001 37.16531 6.140069 -1.949688      12.18077 
1 1 1 -23 20 24 o 42.91037 4.303031 24.01082       4.438934 26.76012       7.282424 22.38545       5.599379 42.98421 7.207217 40.33286 5.869032 2.651348       9.294596 
1 1 1 -23 20 25 o 29.90556 5.689522 12.42518       3.994873 5.498444       6.326104 17.01957       5.152123 20.79675 8.293414 34.64310 6.336283 -13.84635      10.43692 
1 1 1 -23 20 26 o 18.61019 6.666295 4.704270       3.834701 5.259157       6.325368 4.381826       4.821821 20.40187 8.238544 18.75489 7.313491 1.646982       11.01639 
1 1 1 -23 20 27 o 27.21617 5.633484 10.44574       3.613100 5.388162       6.600169 12.60992       4.317477 20.48201 8.362041 29.57844 6.188982 -9.096432      10.40323 
1 1 1 -23 20 28 o 21.65014 6.708768 7.004919       3.903840 3.313878       6.212681 9.413202       5.018321 18.52646 7.876425 24.44444 7.611487 -5.917978      10.95321 
1 1 1 -23 20 29 o 43.20094 4.326447 24.82665       4.493487 23.21736       7.259218 25.82632       5.721362 38.10566 8.069021 42.90659 5.605849 -4.800926      9.825205 
1 1 1 -23 21 1  o 39.69822 4.097613 20.20031       3.907143 18.02345       7.057788 21.16224       4.691647 34.89341 8.401408 40.23753 4.884659 -5.344120      9.718207 
1 1 1 -23 21 2  o 16.76126 6.084577 3.303750       3.207510 1.926875       6.044825 3.843350       3.784185 18.38573 7.790996 17.99309 6.597009 0.3926373      10.20883 
1 1 1 -23 21 3  o 55.03876 3.467896 38.09596       4.627618 37.24736       8.909461 38.40948       5.415406 51.85019 7.249072 54.94461 4.073522 -3.094425      8.315204 
1 1 1 -23 21 4  o 43.18797 3.764345 23.62638       3.922213 24.15910       7.629619 23.43502       4.572709 41.22739 7.881360 42.68866 4.461465 -1.461269      9.056518 
1 1 1 -23 21 5  o 33.49084 4.732241 14.58977       3.754661 16.30985       7.539928 14.02259       4.329667 33.00836 9.087121 32.38352 5.694260 0.6248436      10.72382 
1 1 1 -23 21 6  o 40.23267 5.132679 21.14397       4.917784 16.01328       8.000949 24.25925       6.234513 32.51198 9.502822 42.51656 6.199790 -10.00457      11.34641 
1 1 1 -23 21 7  o 14.63556 5.871007 1.651199       3.189397 1.577080       7.133382 1.669719       3.565645 19.40759 8.349544 15.20882 6.169579 4.198776       10.38165 
1 1 1 -23 21 8  o 13.51537 5.734660 0.5046176      3.282244 6.284802       6.046144 -1.910592      3.908274 22.38727 8.315505 12.61281 5.750624 9.774466       10.11026 
1 1 1 -23 21 9  o 60.85138 3.202485 46.25187       4.732189 36.83080       8.210102 50.93886       5.790895 52.24961 6.594679 63.58077 3.754233 -11.33116      7.588416 
1 1 1 -23 21 10 o 33.90580 4.788288 14.95655       3.846311 11.90961       6.635936 16.49809       4.720048 28.52337 8.730486 35.20369 5.696497 -6.680325      10.42456 
1 1 1 -23 21 11 o 58.14871 4.767125 43.53672       6.695863 56.54826       13.66632 39.42658       7.680956 62.05165 9.325996 54.57860 5.867084 7.473049       11.01803 
1 1 1 -23 21 12 o 12.55925 5.535841 -0.5111126     3.300961 0.6997706      6.133221 -1.004907      3.916610 17.68276 7.674847 13.27368 5.929885 4.409081       9.698804 
1 1 1 -23 21 13 o 11.85199 5.262681 -0.7121337     3.036957 -3.035229      6.071319 0.6311437E-01  3.507276 15.30459 7.048071 13.44837 5.820485 1.856212       9.140752 
1 1 1 -23 21 14 o 18.23355 6.074723 4.299117       3.161071 -0.7223396     6.120051 6.126189       3.691628 16.68424 7.435749 21.19821 6.516087 -4.513971      9.886847 
1 1 1 -23 21 15 o 39.77541 4.771123 20.57665       4.532385 13.63671       7.110291 25.32661       5.882397 30.07358 9.001957 43.64872 5.663688 -13.57514      10.63544 
1 1 1 -23 21 16 o 36.35032 4.309629 17.04089       3.743355 1.755890       7.311720 22.47034       4.357778 19.49493 8.420642 41.78293 4.343163 -22.28800      9.474718 
1 1 1 -23 21 17 o 40.89005 4.109920 21.43536       4.039830 19.52607       10.17750 21.79245       4.401426 34.31533 10.86152 41.04920 4.472230 -6.733868      11.74621 
1 1 1 -23 21 18 o 13.40388 5.667615 0.6569618      3.187366 -0.3389429     6.307146 0.9985361      3.693742 17.00510 7.565514 14.56197 6.126192 2.443127       9.734846 
1 1 1 -23 21 19 o 26.45485 6.103005 9.717632       3.854356 -1.840391      10.43711 11.54280       4.147533 20.14542 9.264131 28.90069 6.081903 -8.755268      11.08213 
1 1 1 -23 21 20 o 11.87364 5.293759 -0.7292659     3.104948 6.800740       6.068438 -3.399632      3.613804 22.37941 8.327332 10.96302 5.174668 11.41639       9.804165 
1 1 1 -23 21 21 o 30.08474 7.081357 13.11862       5.104745 0.000000       0.000000 13.11862       5.104745 ?        ?        30.08474 7.081357 0.000000       7.081357 
1 1 1 -23 21 22 o 19.02696 6.917385 4.725553       4.147746 3.873304       8.308611 5.008442       4.786887 21.01216 9.025089 19.70246 7.382964 1.309698       11.66020 
1 1 1 -23 21 23 o 13.57684 5.658429 1.097422       3.106682 3.122743       6.244535 0.4312500      3.581348 18.88919 7.957095 13.64492 5.893543 5.244267       9.901980 
1 1 1 -23 21 24 o 43.28570 3.860514 24.22962       4.029478 19.17334       7.434860 26.33250       4.794730 34.46212 8.817840 44.71758 4.459362 -10.25546      9.881306 
1 1 1 -23 21 25 o 24.81813 6.407631 9.007353       3.901839 11.33352       6.221738 7.499437       5.009330 26.39822 8.507144 22.27695 7.646093 4.121269       11.43828 
1 1 1 -23 21 26 o 20.13905 6.324817 5.878912       3.457418 -4.556707      6.061746 10.91076       4.209228 13.91478 6.607318 27.26256 6.439159 -13.34778      9.226019 
1 1 1 -23 21 27 o 26.01295 5.767106 9.684492       3.559830 5.917298       6.179978 11.55518       4.354899 20.59167 8.201879 27.93005 6.517900 -7.338381      10.47635 
1 1 1 -23 21 28 o 15.09138 6.338922 1.751073       3.944969 0.6991964E-01  6.113383 2.950643       5.164053 16.16623 7.299566 17.33158 7.264426 -1.165350      10.29833 
1 1 1 -23 22 1  o 9.981437 4.696356 -2.743020      2.934135 0.6619218E-01  5.049862 -4.174760      3.605118 15.65793 6.876271 10.52571 5.025330 5.132220       8.516868 
1 1 1 -23 22 2  o 23.33316 5.778344 7.491039       3.268196 5.203542       5.563951 8.696033       4.038272 20.66925 7.910249 24.84521 6.570302 -4.175957      10.28304 
1 1 1 -23 22 3  o 29.79109 5.191041 11.84381       3.631672 11.35403       6.525891 12.06355       4.371052 27.49359 8.696791 29.52538 6.269073 -2.031790      10.72079 
1 1 1 -23 22 4  o 14.78687 6.053800 1.509645       3.471247 4.752335       6.555450 0.2461437      4.092019 20.99976 8.419422 14.49919 6.281113 6.500574       10.50424 
1 1 1 -23 22 5  o 29.38298 5.480144 11.60613       3.779646 9.245442       6.837025 12.64510       4.535754 25.32706 8.918394 30.25111 6.355198 -4.924049      10.95109 
1 1 1 -23 22 6  o 11.65932 5.553254 -4.757706      4.348058 -3.669501      6.170506 -5.830929      6.127881 15.04006 6.988687 13.97520 6.638099 1.064862       9.638781 
1 1 1 -23 22 7  o 13.83550 5.736697 1.045883       3.169916 -0.7970222     6.569642 1.605145       3.619078 17.12817 7.663908 15.13143 6.186538 1.996738       9.849301 
1 1 1 -23 22 8  o 62.40191 3.394647 48.92730       5.142687 47.01826       8.401863 50.07103       6.503235 59.41903 5.879482 62.57041 4.291029 -3.151382      7.278821 
1 1 1 -23 22 9  o 34.71630 4.408663 15.59452       3.645722 14.42452       6.838788 16.05903       4.309082 31.03386 8.696397 34.83804 5.237632 -3.804184      10.15185 
1 1 1 -23 22 10 o 30.91261 5.229302 12.69846       3.798939 12.72174       6.330328 12.68535       4.749195 29.29982 8.420064 30.18737 6.637043 -0.8875523     10.72137 
1 1 1 -23 22 11 o 61.89046 3.499306 48.23208       5.256165 30.99234       13.13982 51.51619       5.734995 42.20407 12.13181 63.84701 3.701884 -21.64294      12.68404 
1 1 1 -23 22 12 o 30.49397 4.896040 12.25328       3.515166 9.612601       6.555944 13.31876       4.164376 25.71012 8.749102 31.45631 5.639760 -5.746183      10.40931 
1 1 1 -23 22 13 o 53.16616 3.384479 35.57488       4.362170 22.00712       7.295060 43.12619       5.442343 39.01671 7.942927 58.28880 3.853076 -19.27209      8.828153 
1 1 1 -23 22 14 o 31.01387 4.755888 12.63575       3.479888 16.63163       6.590213 11.09084       4.097744 33.61386 8.134151 28.38620 6.105231 5.227661       10.17046 
1 1 1 -23 22 15 o 39.68916 5.121275 20.79084       4.837866 7.897579       7.052760 32.24894       6.648659 23.96190 8.965157 49.15895 5.652796 -25.19704      10.59850 
1 1 1 -23 22 16 o 14.49709 5.803622 1.743348       3.110026 5.486988       6.266047 0.5196866      3.582426 21.34086 8.332736 13.90305 5.947966 7.437808       10.23781 
1 1 1 -23 22 17 o 28.37775 5.355363 10.87599       3.567680 11.34116       6.771766 10.69726       4.197465 27.23237 8.883022 27.62519 6.365934 -0.3928185     10.92855 
1 1 1 -23 22 18 o 54.30899 3.400910 37.28416       4.478343 34.80378       8.180489 38.34563       5.351469 49.78399 6.930655 54.67580 4.045092 -4.891815      8.024759 
1 1 1 -23 22 19 o 26.13406 5.854337 9.490360       3.635647 12.35799       8.421227 8.833432       4.030625 27.64204 9.881476 24.86605 6.558562 2.775990       11.85995 
1 1 1 -23 22 20 o 22.48261 7.585809 7.326406       4.927763 0.000000       0.000000 7.326406       4.927763 ?        ?        22.48261 7.585809 0.000000       7.585809 
1 1 1 -23 22 21 o 55.82472 3.663439 39.84900       4.956157 42.24646       12.95943 39.43828       5.363911 49.08268 11.09629 55.28059 4.008980 -6.197906      11.79829 
1 1 1 -23 22 22 o 54.68937 3.399950 38.07497       4.508772 35.27401       8.328135 39.23634       5.362661 49.26198 7.145801 55.05318 4.025069 -5.791206      8.201442 
1 1 1 -23 22 23 o 31.94249 4.928645 13.79816       3.713188 6.175810       6.817153 17.01348       4.427620 21.40187 8.584055 35.25616 5.318796 -13.85429      10.09830 
1 1 1 -23 22 24 o 19.08125 6.291143 5.160975       3.392720 10.35162       6.474524 3.196183       3.983413 25.14297 8.690129 16.80442 6.619179 8.338558       10.92391 
1 1 1 -23 22 25 o 35.50312 5.551921 17.57021       4.646137 10.63896       6.658218 24.14836       6.486411 25.22478 8.807127 40.52404 6.809604 -15.29926      11.13266 
1 1 1 -23 22 26 o 16.75740 6.265701 3.598147       3.443841 3.101086       6.269765 3.812908       4.121202 18.35381 7.860784 17.46476 6.775084 0.8890533      10.37756 
1 1 1 -23 22 27 o 22.88912 6.146963 7.739454       3.500819 10.97082       6.769408 6.559718       4.090252 25.17338 8.873342 20.83888 6.909136 4.334503       11.24599 
1 1 1 -23 23 1  o 32.42145 4.716043 13.90374       3.616871 20.63384       6.492761 10.87557       4.355205 37.75894 7.320542 27.62751 6.566127 10.13143       9.833838 
1 1 1 -23 23 2  o 12.91145 5.502167 0.4883425      3.044168 4.634658       5.678748 -1.183621      3.606075 20.01890 7.897691 12.42609 5.608938 7.592814       9.686780 
1 1 1 -23 23 3  o 29.04744 5.230948 11.35643       3.566591 8.040952       6.225531 12.97625       4.351480 23.67419 8.492270 30.64636 6.041544 -6.972170      10.42204 
1 1 1 -23 23 4  o 51.21255 3.565945 33.25198       4.422477 25.72919       8.214219 36.32268       5.248024 41.54635 8.402363 53.22240 4.077415 -11.67605      9.339433 
1 1 1 -23 23 5  o 17.88301 6.142717 4.132587       3.233296 -1.090159      6.248613 6.042269       3.778459 16.41876 7.399780 20.90097 6.618307 -4.482210      9.927675 
1 1 1 -23 23 6  o 12.54302 5.844768 -3.081589      4.363627 -5.610073      5.698585 0.5026307      6.784755 13.37649 6.367274 18.00646 7.936700 -4.629966      10.17514 
1 1 1 -23 23 7  o 28.21951 5.439745 10.76079       3.605181 8.139217       7.369131 11.58567       4.133641 24.21479 9.141737 28.99691 6.045984 -4.782122      10.96017 
1 1 1 -23 23 8  o 17.36790 6.125353 3.771667       3.226144 0.8720436      6.636446 4.668941       3.691708 18.10911 7.919611 18.93428 6.561110 -0.8251705     10.28438 
1 1 1 -23 23 9  o 11.69344 5.315547 -1.472606      3.307981 5.423341       5.664076 -5.042333      4.075207 20.94703 7.989798 10.98840 5.272066 9.958626       9.572436 
1 1 1 -23 23 10 o 13.66011 5.634649 1.130508       3.036545 6.546012       5.624593 -1.097164      3.607424 22.07634 8.050892 12.55039 5.642293 9.525943       9.831192 
1 1 1 -23 23 11 f 15.60026 6.177309 2.244978       3.485936 -4.973016      10.81230 3.082284       3.682578 19.28686 9.055985 16.83110 6.436869 2.455759       11.11054 
1 1 1 -23 23 12 o 23.92106 5.860455 7.906332       3.388880 8.943519       6.464472 7.513274       3.979540 24.75557 8.675575 23.06961 6.690169 1.685953       10.95555 
1 1 1 -23 23 13 o 13.35365 5.612890 0.7873220      3.096383 -3.643749      5.890824 2.478925       3.639744 14.55177 6.784189 16.03604 6.323913 -1.484270      9.274541 
1 1 1 -23 23 14 o 39.47632 4.357826 20.22387       4.122516 11.36533       8.740110 22.75866       4.675269 27.03290 10.00590 41.71227 4.680080 -14.67937      11.04632 
1 1 1 -23 23 15 o 12.91956 5.797103 -0.9714761     3.787816 -2.118333      5.956520 -0.1928404     4.908007 15.39989 7.050899 15.21964 6.727505 0.1802502      9.745486 
1 1 1 -23 23 16 o 11.12861 5.067734 -1.393719      3.023411 -2.505169      6.005029 -1.016304      3.499290 15.21140 7.006722 12.35153 5.554635 2.859872       8.941372 
1 1 1 -23 23 17 o 44.76536 5.845169 27.34813       6.224240 27.72226       10.00348 27.11180       7.950717 40.92774 10.09400 42.77205 7.919587 -1.844307      12.82999 
1 1 1 -23 23 18 o 34.36114 5.762784 16.23902       4.654746 10.96618       9.245579 18.02930       5.387309 26.19766 10.15190 35.77794 6.414680 -9.580275      12.00871 
1 1 1 -23 23 19 f 77.62321 3.509645 76.64725       6.621647 69.97784       10.07510 81.71872       8.785626 71.58062 5.826214 78.99741 4.583453 -7.416794      7.413016 
1 1 1 -23 23 20 o 17.49518 6.274959 3.975091       3.398876 -7.417491      6.295907 8.661082       4.037829 13.23996 6.402409 24.36294 6.626944 -11.12298      9.214512 
1 1 1 -23 23 21 o 80.75092 4.000540 84.40380       7.847800 61.10334       15.25312 92.79236       9.152086 58.53063 11.10003 84.05057 4.484544 -25.51994      11.97171 
1 1 1 -23 23 22 o 17.54811 6.545566 3.949339       3.753829 15.97766       10.93359 2.342034       3.996773 28.59884 11.05133 15.91657 6.503713 12.68227       12.82303 
1 1 1 -23 23 23 o 22.26005 6.253480 7.247451       3.531577 7.744317       6.415388 7.031418       4.230220 22.44837 8.517210 21.67199 7.017329 0.7763824      11.03566 
1 1 1 -23 23 24 f 22.51862 6.858544 7.655503       4.101955 7.452686       6.429780 7.794702       5.326744 22.06187 8.488116 22.37961 7.872687 -0.3177395     11.57702 
1 1 1 -23 23 25 f 11.58911 5.248958 -0.9482985     3.189938 -6.804005      5.718005 1.697627       3.843649 12.46634 6.045708 14.94340 6.265602 -2.477063      8.706800 
1 1 1 -23 23 26 o 44.02530 3.901584 25.40911       4.142515 19.71782       7.251895 28.16570       5.046993 34.18759 8.687938 45.76846 4.586873 -11.58087      9.824443 
1 1 1 -23 24 1  o 25.49323 5.456798 8.987868       3.287658 4.683817       5.381516 11.55073       4.152683 19.60196 7.701950 28.57184 6.146723 -8.969877      9.854047 
1 1 1 -23 24 2  o 26.81805 5.370940 9.860362       3.387566 14.75413       6.150794 7.729631       4.058576 31.03427 8.061555 23.09818 6.772793 7.936089       10.52898 
1 1 1 -23 24 3  o 11.57675 5.175206 -0.7422321     2.988358 4.455014       5.560971 -2.852472      3.543480 19.62418 7.792072 11.10570 5.204932 8.518483       9.370577 
1 1 1 -23 24 4  o 14.66005 5.814483 1.977798       3.093186 1.786890       5.427005 2.069657       3.764507 17.25207 7.349020 15.61794 6.337915 1.634130       9.704497 
1 1 1 -23 24 5  o 55.06904 3.823831 38.78938       5.099604 27.50947       8.682673 44.72960       6.300888 42.38358 8.698347 58.67933 4.439297 -16.29575      9.765684 
1 1 1 -23 24 6  o 23.18373 7.266192 7.781118       4.565523 7.153618       6.558097 8.371229       6.359722 22.75394 8.616407 23.90026 8.582098 -1.146324      12.16120 
1 1 1 -23 24 7  o 14.34724 5.798592 1.648455       3.136507 6.367596       6.391213 0.1513418      3.599806 21.98329 8.461390 13.51554 5.872877 8.467746       10.29980 
1 1 1 -23 24 8  o 19.17892 6.553280 4.934100       3.678755 12.01031       6.844813 2.059875       4.362360 27.73672 8.921529 16.36759 6.752764 11.36913       11.18899 
1 1 1 -23 24 9  o 21.23847 6.205803 6.312284       3.412644 -1.929075      6.222917 9.856788       4.081054 15.80798 7.226075 26.38647 6.410871 -10.57849      9.659991 
1 1 1 -23 24 10 o 17.23382 6.084086 3.766731       3.183428 13.00991       5.813134 -0.1926514     3.804639 29.43268 7.928348 13.55415 5.959928 15.87853       9.918641 
1 1 1 -23 24 11 o 12.60375 5.570467 -0.4167156     3.363887 -3.996699      10.76915 -0.2964702E-01 3.541073 19.33882 9.066852 13.25334 5.790766 6.085474       10.75829 
1 1 1 -23 24 12 o 16.92766 6.160222 3.514741       3.290556 -1.816067      6.279142 5.532957       3.863559 15.90244 7.265225 20.04896 6.716594 -4.146523      9.894247 
1 1 1 -23 24 13 o 18.36105 6.403798 4.445011       3.519644 4.627003       7.298675 4.389865       4.017654 20.94252 8.696033 18.56509 6.798974 2.377430       11.03843 
1 1 1 -23 24 14 o 11.47170 5.271328 -1.810973      3.370139 0.1327378      6.713345 -2.465841      3.896727 17.43463 7.777851 12.00293 5.569291 5.431701       9.566189 
1 1 1 -23 24 15 o 31.82203 7.997824 15.43185       6.194011 8.926180       8.700912 22.11623       8.819604 24.55882 9.748266 36.52824 9.732971 -11.96942      13.77532 
1 1 1 -23 24 16 o 36.00709 5.494824 17.68781       4.668965 8.436053       8.656994 21.48278       5.544461 24.07456 9.667352 39.38554 5.963169 -15.31098      11.35857 
1 1 1 -23 24 17 o 12.72008 5.479281 0.3446178      3.079337 -0.4990067     5.900034 0.6604536      3.610028 16.03194 7.210950 13.88297 5.955741 2.148972       9.352468 
1 1 1 -23 24 18 o 68.44463 3.122095 59.21856       5.193696 53.85509       9.089277 61.81877       6.328640 62.25344 6.068364 69.37826 3.757288 -7.124817      7.137384 
1 1 1 -23 24 19 o 10.78913 5.007330 -2.044281      3.152987 6.395916       5.848793 -5.501921      3.743517 21.25064 8.115763 9.997402 4.858412 11.25324       9.458846 
1 1 1 -23 24 20 o 22.54940 6.536557 7.486653       3.799618 -0.3373939     10.36137 8.702275       4.084139 19.64830 9.104511 24.20383 6.697570 -4.555531      11.30264 
1 1 1 -23 24 21 o 34.22412 4.692476 15.75475       3.810611 19.05979       7.066227 14.39947       4.524954 34.27070 8.502168 31.73512 6.072256 2.535583       10.44793 
1 1 1 -23 24 22 o 12.22543 5.433270 -0.3493389     3.244188 4.277084       6.034884 -2.229696      3.847391 19.18273 7.931066 11.87643 5.518578 7.306303       9.662117 
1 1 1 -23 24 23 o 16.39509 6.222340 3.336519       3.424622 3.486246       6.531471 3.279748       4.021788 18.79008 8.034823 16.78711 6.638962 2.002966       10.42277 
1 1 1 -23 24 24 o 13.25416 6.116190 -1.796799      4.605098 -5.543220      10.12681 -0.8200996     5.170650 17.25862 8.288354 14.59450 6.638743 2.664116       10.61931 
1 1 1 -23 25 1  o 34.34431 4.478968 15.68080       3.659371 15.43256       6.020196 15.82627       4.608476 31.47952 7.869638 33.57806 5.844212 -2.098532      9.802347 
1 1 1 -23 25 2  o 12.99974 5.492769 0.8009273      2.990199 3.697531       5.072742 -0.7414892     3.701681 18.28312 7.379664 12.77039 5.730438 5.512736       9.343306 
1 1 1 -23 25 3  o 21.08056 6.319281 6.381486       3.501950 3.913332       5.917871 7.711533       4.344229 19.14043 7.877683 22.80925 7.078571 -3.668814      10.59075 
1 1 1 -23 25 4  o 24.31001 6.254756 8.493174       3.726637 1.037993       5.913043 13.40563       4.799891 17.01182 7.456696 30.41598 6.660708 -13.40416      9.998367 
1 1 1 -23 25 5  o 20.95261 6.195540 6.246903       3.384270 3.649823       5.783761 7.599040       4.173283 18.90726 7.785454 22.77673 6.914013 -3.869469      10.41234 
1 1 1 -23 25 6  o 15.96645 6.129400 2.841284       3.347684 3.904300       6.109410 2.385152       4.001977 19.38500 7.993875 16.12829 6.538513 3.256704       10.32735 
1 1 1 -23 25 7  o 33.76518 5.200287 15.42521       4.141758 11.99418       6.760448 17.48677       5.240359 27.33016 8.872811 35.18782 6.344649 -7.857666      10.90786 
1 1 1 -23 25 8  o 24.00372 6.042015 8.169518       3.531175 6.040610       6.626729 9.013732       4.172989 21.50539 8.516587 24.87980 6.724078 -3.374414      10.85106 
1 1 1 -23 25 9  o 14.38171 5.875279 1.606032       3.260832 5.022675       6.267729 0.3380566      3.818262 20.45527 8.221718 13.93233 6.051265 6.522941       10.20855 
1 1 1 -23 25 10 o 13.65729 5.736193 0.9919998      3.230118 -4.048353      5.830321 3.224240       3.880007 14.06593 6.618767 16.95023 6.574293 -2.884299      9.328955 
1 1 1 -23 25 11 o 18.28354 7.032835 4.030766       4.413319 0.000000       0.000000 4.030766       4.413319 ?        ?        18.28354 7.032835 0.000000       7.032835 
1 1 1 -23 25 12 o 17.01685 6.496240 3.397833       3.746441 1.900648       6.216954 4.251559       4.694607 17.94473 7.757900 18.69805 7.237206 -0.7533226     10.60953 
1 1 1 -23 25 13 o 43.57794 4.733435 25.19130       4.946005 12.50985       8.174667 32.51448       6.212055 27.24501 9.736176 49.09481 5.274991 -21.84980      11.07333 
1 1 1 -23 25 14 o 14.02797 5.900614 1.107289       3.425883 2.111552       5.757675 0.5568718      4.262547 17.61196 7.537763 14.69917 6.388896 2.912790       9.881086 
1 1 1 -23 25 15 o 46.28488 3.731962 27.59522       4.173665 26.47692       7.302125 28.13782       5.086398 42.29380 7.351655 46.11980 4.586429 -3.825996      8.664997 
1 1 1 -23 25 16 o 31.96853 4.860582 13.78979       3.667475 3.301818       6.345072 19.05161       4.494267 18.87247 7.989015 37.52956 5.041567 -18.65709      9.446785 
1 1 1 -23 25 17 o 39.89378 4.214995 20.92101       4.035799 17.29415       7.234962 22.55934       4.862627 32.27560 8.907740 40.86846 4.985622 -8.592854      10.20805 
1 1 1 -23 25 18 o 27.03422 5.824300 10.39493       3.723657 5.615201       6.451116 12.78307       4.559981 20.61863 8.322185 29.55989 6.506917 -8.941263      10.56403 
1 1 1 -23 25 19 o 35.04824 4.844176 16.62577       4.026844 5.292623       6.904513 22.46782       4.957245 20.48739 8.478075 40.58118 5.127015 -20.09379      9.907776 
1 1 1 -23 25 20 o 43.21468 4.594223 24.98284       4.764090 7.452061       11.74415 28.43588       5.212206 23.27418 10.34093 46.02091 4.714167 -22.74673      11.36478 
1 1 1 -23 25 21 o 47.61050 3.830017 29.54101       4.406182 17.22342       7.431706 36.21793       5.471591 31.43973 9.149796 52.27894 4.333785 -20.83921      10.12425 
1 1 1 -23 25 22 o 22.48162 6.117903 7.448000       3.440442 10.43099       6.283498 6.170817       4.111515 24.84924 8.562191 20.32564 6.928403 4.523602       11.01426 
1 1 1 -23 26 1  o 20.88555 5.998640 6.352746       3.213786 5.486947       5.359645 6.838813       4.015829 19.85418 7.719523 21.33062 6.830857 -1.476439      10.30784 
1 1 1 -23 26 2  o 44.92633 3.924784 26.34742       4.253777 38.11507       7.748259 21.27048       5.089322 51.59385 6.292725 39.13659 5.486828 12.45726       8.348872 
1 1 1 -23 26 3  o 18.81211 6.478837 4.986775       3.597556 -3.324437      5.824136 10.11435       4.574625 14.17619 6.653202 25.77988 7.070643 -11.60369      9.708713 
1 1 1 -23 26 4  o 14.96364 6.064274 2.053499       3.441146 2.837141       5.449721 1.533873       4.437734 17.70256 7.443960 15.61392 6.648178 2.088646       9.980522 
1 1 1 -23 26 5  o 16.80118 6.412144 3.411229       3.649425 0.7325914      6.021632 4.966250       4.588021 16.74340 7.423851 19.20643 7.221471 -2.463028      10.35679 
1 1 1 -23 26 6  o 16.85029 6.316504 3.522514       3.504520 1.492274       5.533664 4.882112       4.528395 16.80118 7.291156 19.10929 7.176634 -2.308117      10.23059 
1 1 1 -23 26 7  o 41.72664 4.491327 23.05691       4.495097 15.37087       7.123699 28.14195       5.794309 30.34407 8.992895 45.42538 5.336035 -15.08131      10.45684 
1 1 1 -23 26 8  o 20.47648 6.613271 6.055604       3.758572 6.199005       6.346757 5.978149       4.664465 21.21902 8.356020 20.46486 7.349640 0.7541618      11.12835 
1 1 1 -23 26 9  o 17.50886 6.530636 3.894692       3.736641 4.655597       6.731471 3.555807       4.492324 20.13293 8.354839 17.66801 7.007287 2.464918       10.90438 
1 1 1 -23 26 10 f 16.95316 6.325816 3.589832       3.506604 3.591983       6.366777 3.588896       4.201238 19.08573 8.036943 17.47111 6.822685 1.614620       10.54237 
1 1 1 -23 26 11 o 12.28390 5.475232 -0.5071102     3.319211 2.120347       5.959050 -1.688958      3.996593 17.66153 7.615170 12.54686 5.756142 5.114672       9.545888 
1 1 1 -23 26 12 o 15.24969 5.987871 2.454668       3.250863 -0.2153321     5.468387 3.914024       4.042819 15.54424 6.970847 17.69881 6.750315 -2.154570      9.703580 
1 1 1 -23 26 13 o 50.40118 3.718519 32.79840       4.535007 21.24083       7.457387 39.58074       5.712725 36.29842 8.569102 54.87608 4.306406 -18.57766      9.590342 
1 1 1 -23 26 14 o 80.21468 3.586117 82.59533       6.992219 70.97633       9.651682 95.42897       10.14363 71.85183 5.555370 84.31966 4.958493 -12.46783      7.446394 
1 1 1 -23 26 15 o 20.18279 6.256231 5.897730       3.394606 1.523440       5.833824 8.137007       4.174009 17.02009 7.434702 23.25535 6.881608 -6.235262      10.13071 
1 1 1 -23 26 16 o 43.63905 3.922568 24.84389       4.126937 25.64659       7.254131 24.45977       5.018158 41.02571 7.533464 42.50663 4.936222 -1.480927      9.006629 
1 1 1 -23 26 17 o 41.31575 4.118515 22.45787       4.091423 17.87690       7.144773 24.69304       4.990738 32.67303 8.784622 42.72490 4.880915 -10.05188      10.04952 
1 1 1 -23 26 18 f 30.48130 5.273893 12.91161       3.775683 5.808798       6.722152 16.18517       4.563553 20.66759 8.438522 33.83506 5.739685 -13.16747      10.20552 
1 1 1 -23 26 19 o 39.03899 4.485659 20.41148       4.189927 5.130293       7.045046 28.77470       5.211852 20.20680 8.478244 46.22564 4.691636 -26.01884      9.689792 
1 1 1 -23 26 20 o 27.18110 5.823205 10.64633       3.741030 6.148685       6.431399 12.94635       4.599158 20.70675 8.326432 29.44718 6.575541 -8.740433      10.60977 
1 1 1 -23 27 1  o 32.22980 6.144661 15.17715       4.649946 0.000000       0.000000 15.17715       4.649946 ?        ?        32.22980 6.144661 0.000000       6.144661 
1 1 1 -23 27 2  o 12.74137 5.484378 0.5773998      3.080671 5.834978       4.969095 -2.705015      3.926279 19.94385 7.511801 11.64127 5.463242 8.302584       9.288388 
1 1 1 -23 27 3  o 15.87341 6.027801 3.094344       3.214947 1.078600       5.600883 4.084859       3.926173 16.29096 7.194528 17.59796 6.666205 -1.306999      9.808135 
1 1 1 -23 27 4  o 12.87351 5.534683 0.5953663      3.130363 -7.514951      5.154613 5.334202       3.940152 11.41509 5.581029 19.22162 6.770171 -7.806532      8.774001 
1 1 1 -23 27 5  o 29.77036 6.386775 13.02911       4.494574 6.043069       6.892485 18.19761       5.928463 20.87568 8.536651 34.48647 7.283126 -13.61079      11.22133 
1 1 1 -23 27 6  o 35.13932 4.622937 16.62802       3.862725 15.51218       6.978811 17.12085       4.637940 30.10427 8.895647 34.89100 5.647635 -4.786728      10.53700 
1 1 1 -23 27 7  o 18.73952 6.234559 5.007626       3.329844 -1.348781      5.830017 8.085143       4.056619 15.14418 6.949374 23.14668 6.766786 -8.002502      9.699649 
1 1 1 -23 27 8  o 34.68738 4.810508 16.30821       3.956987 13.46062       7.160428 17.56015       4.747811 27.80374 9.138228 35.32387 5.710284 -7.520126      10.77565 
1 1 1 -23 27 9  o 13.14277 5.694216 0.4529792      3.363889 -10.16137      6.276692 4.730203       3.984421 12.13319 5.977390 18.53531 6.773543 -6.402113      9.033830 
1 1 1 -23 27 10 o 15.79344 6.219608 2.755257       3.516331 -0.2373552     6.652370 3.915591       4.142310 16.63603 7.552742 17.63870 6.805950 -1.002670      10.16685 
1 1 1 -23 27 11 o 36.18272 4.829185 17.73832       4.151831 11.43934       7.625223 20.39268       4.949906 25.60503 9.368319 38.32415 5.453911 -12.71912      10.84023 
1 1 1 -23 27 12 o 36.82810 4.655736 18.25123       4.085130 13.17979       6.863177 21.03387       5.083792 27.69653 8.935752 38.86111 5.523686 -11.16458      10.50518 
1 1 1 -23 27 13 o 31.74757 5.081486 13.86132       3.798778 8.189747       6.257416 17.17159       4.780516 22.70925 8.454850 34.79693 5.844645 -12.08768      10.27834 
1 1 1 -23 27 14 o 19.28179 6.989956 5.296516       4.231142 5.889740       5.752780 4.597447       6.244952 20.38527 7.977010 19.47880 8.062050 0.9064693      11.34149 
1 1 1 -23 27 15 o 62.89444 3.671839 51.20119       5.603239 44.36011       8.388632 56.71233       7.529205 55.48551 6.316377 64.89083 4.795223 -9.405319      7.930371 
1 1 1 -23 27 16 o 25.73878 5.835719 9.569037       3.575643 2.957057       6.101975 13.02669       4.412605 18.05993 7.745297 29.81210 6.272858 -11.75216      9.966864 
1 1 1 -23 27 17 o 11.76742 5.346960 -1.048021      3.342895 2.015413       6.121935 -2.349529      3.990320 17.38558 7.604732 11.97707 5.583757 5.408515       9.434526 
1 1 1 -23 27 18 o 33.16627 4.809498 15.02037       3.773884 10.42938       6.193964 17.73088       4.759284 24.81320 8.502712 35.33513 5.722677 -10.52193      10.24915 
1 1 1 -23 28 1  o 10.49481 4.819153 -1.289903      2.810160 -1.273856      4.505799 -1.300118      3.595013 13.28723 6.101729 11.90948 5.462087 1.377749       8.189353 
1 1 1 -23 28 2  o 16.45086 6.050339 3.627457       3.186971 -3.161582      5.189766 7.737562       4.038035 13.17823 6.214451 22.30727 6.807024 -9.129040      9.217103 
1 1 1 -23 28 3  o 8.721313 4.261611 -4.823014      2.993175 -9.815953      5.030568 -2.086682      3.724116 10.40244 5.165106 11.63202 5.413287 -1.229584      7.482111 
1 1 1 -23 28 4  o 17.39362 6.365611 4.159050       3.520891 3.188073       5.498493 4.833887       4.583935 17.63024 7.448802 18.64330 7.168454 -1.013062      10.33786 
1 1 1 -23 28 5  o 15.69764 6.620779 2.039850       4.331764 -2.287725      5.709461 7.909795       6.649513 14.34032 6.683384 22.10401 8.597239 -7.763696      10.88945 
1 1 1 -23 28 6  o 15.35309 6.023450 2.673614       3.287267 0.1380111      5.715520 3.926986       4.018419 15.73234 7.084924 17.40504 6.706667 -1.672705      9.755795 
1 1 1 -23 28 7  o 46.87503 3.925373 28.83619       4.442788 14.70540       7.519944 36.41320       5.506559 28.38675 9.366500 52.27765 4.362154 -23.89090      10.33246 
1 1 1 -23 28 8  o 13.88902 5.826317 1.340244       3.326044 -4.748468      6.013029 4.024427       3.992424 13.60997 6.495719 17.53197 6.702865 -3.921995      9.333958 
1 1 1 -23 28 9  o 23.65162 6.363778 8.368334       3.747809 11.31122       7.071102 7.218657       4.419657 25.32823 9.054726 21.62441 7.182364 3.703814       11.55744 
1 1 1 -23 28 10 o 11.50676 5.402358 -2.715493      3.846126 0.000000       0.000000 -2.715493      3.846126 ?        ?        11.50676 5.402358 0.000000       5.402358 
1 1 1 -23 28 11 o 13.19631 5.769191 0.3375489      3.519181 -4.731610      6.589097 2.360640       4.162610 14.29837 6.817468 15.88249 6.578614 -1.584118      9.473966 
1 1 1 -23 28 12 o 10.81062 5.060163 -2.351732      3.331130 -7.547135      5.999522 -0.3625327E-01 4.005229 12.52674 6.101788 13.58727 6.037842 -1.060530      8.584134 
1 1 1 -23 28 13 o 10.58236 4.965963 -2.442437      3.243118 -5.567485      5.481610 -0.7594740     4.022695 12.58427 6.057493 13.06555 5.908317 -0.4812775     8.461763 
1 1 1 -23 28 14 o 16.63088 6.306183 3.533682       3.515640 -8.283006      5.707218 10.75942       4.462905 11.88485 5.823664 26.48551 6.860368 -14.60067      8.998873 
1 1 1 -22 0  1  o 52.35999 3.819029 34.01201       4.812078 34.01201       4.812078 34.01201       4.812078 52.35999 3.819029 52.35999 3.819029 0.000000       0.000000 
1 1 1 -22 0  2  o 43.69788 4.126210 23.94209       4.298478 23.94209       4.298478 23.94209       4.298478 43.69788 4.126210 43.69788 4.126210 -0.000000      0.000000 
1 1 1 -22 0  3  o 142.5385 3.588581 248.5105       12.44711 248.5105       12.44711 248.5105       12.44711 142.5385 3.588581 142.5385 3.588581 0.000000       0.000000 
1 1 1 -22 0  4  f 34.10220 4.850555 15.04916       3.795625 15.04916       3.795625 15.04916       3.795625 34.10220 4.850555 34.10220 4.850555 -0.000000      0.000000 
1 1 1 -22 0  5  o 109.8892 4.387435 148.2488       11.70639 148.2488       11.70639 148.2488       11.70639 109.8892 4.387435 109.8892 4.387435 0.000000       0.000000 
1 1 1 -22 0  6  o 325.9348 7.340436 1306.410       58.23594 1306.410       58.23594 1306.410       58.23594 325.9348 7.340436 325.9348 7.340436 -0.000000      0.000000 
1 1 1 -22 0  7  o 37.73798 5.856062 18.63305       4.999435 18.63305       4.999435 18.63305       4.999435 37.73798 5.856062 37.73798 5.856062 0.000000       0.000000 
1 1 1 -22 0  8  o 105.9144 4.054421 137.6027       10.42966 137.6027       10.42966 137.6027       10.42966 105.9144 4.054421 105.9144 4.054421 0.000000       0.000000 
1 1 1 -22 0  9  o 14.82367 8.185996 3.733933       4.307783 3.733933       4.307783 3.733933       4.307783 14.82367 8.185996 14.82367 8.185996 -0.000000      0.000000 
1 1 1 -22 0  10 o 139.9467 4.300871 239.9455       14.63608 239.9455       14.63608 239.9455       14.63608 139.9467 4.300871 139.9467 4.300871 -0.000000      0.000000 
1 1 1 -22 0  11 o 7.991820 5.613981 -4.612421      4.206352 -4.612421      4.206352 -4.612421      4.206352 7.991820 5.613981 7.991820 5.613981 -0.000000      0.000000 
1 1 1 -22 0  12 o 233.3052 5.591221 667.4566       31.74705 667.4566       31.74705 667.4566       31.74705 233.3052 5.591221 233.3052 5.591221 0.000000       0.000000 
1 1 1 -22 0  13 o 62.93140 5.465755 49.55172       8.230528 49.55172       8.230528 49.55172       8.230528 62.93140 5.465755 62.93140 5.465755 0.000000       0.000000 
1 1 1 -22 0  14 o 35.27769 6.604196 16.74868       5.095047 16.74868       5.095047 16.74868       5.095047 35.27769 6.604196 35.27769 6.604196 -0.000000      0.000000 
1 1 1 -22 0  15 o 70.14366 4.204105 60.76567       7.126488 60.76567       7.126488 60.76567       7.126488 70.14366 4.204105 70.14366 4.204105 0.000000       0.000000 
1 1 1 -22 0  16 o 76.05435 4.145752 71.31300       7.631048 71.31300       7.631048 71.31300       7.631048 76.05435 4.145752 76.05435 4.145752 -0.000000      0.000000 
1 1 1 -22 0  17 o 37.84279 5.953751 18.79300       5.084740 18.79300       5.084740 18.79300       5.084740 37.84279 5.953751 37.84279 5.953751 0.000000       0.000000 
1 1 1 -22 0  18 o 190.0857 4.906782 443.2273       22.69488 443.2273       22.69488 443.2273       22.69488 190.0857 4.906782 190.0857 4.906782 0.000000       0.000000 
1 1 1 -22 0  19 o 56.14419 4.616076 39.34946       6.214020 39.34946       6.214020 39.34946       6.214020 56.14419 4.616076 56.14419 4.616076 -0.000000      0.000000 
1 1 1 -22 0  20 o 21.32177 8.932759 7.917783       4.655327 7.917783       4.655327 7.917783       4.655327 21.32177 8.932759 21.32177 8.932759 -0.000000      0.000000 
1 1 1 -22 0  21 o 56.93994 7.166110 41.81848       9.516559 41.81848       9.516559 41.81848       9.516559 56.93994 7.166110 56.93994 7.166110 -0.000000      0.000000 
1 1 1 -22 0  22 o 36.57764 9.951452 19.85649       7.666609 19.85649       7.666609 19.85649       7.666609 36.57764 9.951452 36.57764 9.951452 -0.000000      0.000000 
1 1 1 -22 0  23 o 125.3176 4.213439 193.0463       12.83422 193.0463       12.83422 193.0463       12.83422 125.3176 4.213439 125.3176 4.213439 0.000000       0.000000 
1 1 1 -22 0  24 o 40.27385 6.105675 21.29982       5.584961 21.29982       5.584961 21.29982       5.584961 40.27385 6.105675 40.27385 6.105675 0.000000       0.000000 
1 1 1 -22 0  25 o 28.19892 8.532887 12.21645       5.114136 12.21645       5.114136 12.21645       5.114136 28.19892 8.532887 28.19892 8.532887 0.000000       0.000000 
1 1 1 -22 0  26 o 130.7697 4.332112 210.7594       13.77084 210.7594       13.77084 210.7594       13.77084 130.7697 4.332112 130.7697 4.332112 0.000000       0.000000 
1 1 1 -22 0  27 o 30.23538 11.59038 15.81433       8.065792 15.81433       8.065792 15.81433       8.065792 30.23538 11.59038 30.23538 11.59038 0.000000       0.000000 
1 1 1 -22 0  28 o 15.05104 8.630411 3.777001       5.025126 3.777001       5.025126 3.777001       5.025126 15.05104 8.630411 15.05104 8.630411 0.000000       0.000000 
1 1 1 -22 0  29 o 52.28125 5.318401 34.91061       6.601953 34.91061       6.601953 34.91061       6.601953 52.28125 5.318401 52.28125 5.318401 0.000000       0.000000 
1 1 1 -22 0  30 o 11.72150 7.544215 0.3781863      4.954131 0.3781863      4.954131 0.3781863      4.954131 11.72150 7.544215 11.72150 7.544215 -0.000000      0.000000 
1 1 1 -22 0  31 o 54.57710 7.472126 39.85725       9.409995 39.85725       9.409995 39.85725       9.409995 54.57710 7.472126 54.57710 7.472126 -0.000000      0.000000 
1 1 1 -22 0  32 o 56.10363 5.307905 40.41423       7.098650 40.41423       7.098650 40.41423       7.098650 56.10363 5.307905 56.10363 5.307905 -0.000000      0.000000 
1 1 1 -22 0  33 o 61.23661 7.254501 50.17259       10.42635 50.17259       10.42635 50.17259       10.42635 61.23661 7.254501 61.23661 7.254501 -0.000000      0.000000 
1 1 1 -22 0  34 o 56.41181 5.483703 41.30775       7.363829 41.30775       7.363829 41.30775       7.363829 56.41181 5.483703 56.41181 5.483703 0.000000       0.000000 
1 1 1 -22 0  35 o 71.99350 4.892345 66.15967       8.490694 66.15967       8.490694 66.15967       8.490694 71.99350 4.892345 71.99350 4.892345 -0.000000      0.000000 
1 1 1 -22 0  36 o 15.42373 8.971125 4.495877       5.549231 4.495877       5.549231 4.495877       5.549231 15.42373 8.971125 15.42373 8.971125 -0.000000      0.000000 
1 1 1 -22 0  37 o 10.45798 7.279680 -4.512684      6.627213 -4.512684      6.627213 -4.512684      6.627213 10.45798 7.279680 10.45798 7.279680 -0.000000      0.000000 
1 1 1 -22 0  38 o 25.61564 9.539916 12.04997       5.538706 12.04997       5.538706 12.04997       5.538706 25.61564 9.539916 25.61564 9.539916 -0.000000      0.000000 
1 1 1 -22 0  39 o 8.562551 6.054221 -5.210037      5.151442 -5.210037      5.151442 -5.210037      5.151442 8.562551 6.054221 8.562551 6.054221 -0.000000      0.000000 
1 1 1 -22 0  40 o 10.77280 7.504544 -4.116592      7.079354 -4.116592      7.079354 -4.116592      7.079354 10.77280 7.504544 10.77280 7.504544 -0.000000      0.000000 
1 1 1 -22 1  1  o 65.47655 2.510211 52.42078       3.997855 50.59598       5.583294 54.34078       5.727089 64.20693 3.582598 66.55264 3.544062 -2.345703      5.039383 
1 1 1 -22 1  2  o 154.7325 2.634212 292.3605       9.932726 296.9041       14.12092 287.9109       13.97422 155.7611 3.720212 153.3807 3.738702 2.380447       5.274265 
1 1 1 -22 1  3  o 68.59310 2.767196 57.55531       4.615982 59.76517       5.717955 53.42049       7.821436 69.83412 3.369929 65.79207 4.913886 4.042053       5.958414 
1 1 1 -22 1  4  o 120.2476 2.707133 176.5669       7.932718 177.5104       9.998569 174.9641       13.03181 120.4435 3.410012 119.3900 4.487187 1.053474       5.635870 
1 1 1 -22 1  5  o 190.6068 2.868355 443.7419       13.32316 414.9424       18.18839 477.0864       19.57109 184.0966 4.054268 197.3981 4.068516 -13.30153      5.743684 
1 1 1 -22 1  6  o 57.14876 2.864562 39.98815       3.976621 42.09758       6.814966 38.89912       4.896691 58.38676 4.833011 56.28452 3.588771 2.102245       6.019741 
1 1 1 -22 1  7  o 83.27652 2.996402 84.82571       6.070861 61.83633       14.27942 89.89784       6.707214 70.02398 8.544888 85.70853 3.217018 -15.68455      9.130405 
1 1 1 -22 1  8  o 152.1310 3.143587 282.7945       11.65411 279.8773       16.49768 285.7003       16.46518 151.0576 4.486687 152.6346 4.431363 -1.576981      6.306135 
1 1 1 -22 1  9  o 163.1617 3.230445 325.3466       12.84449 318.5711       18.13475 332.1673       18.19510 161.1360 4.623086 164.5611 4.541575 -3.425110      6.480651 
1 1 1 -22 1  10 o 46.19635 3.488096 26.24170       3.897730 20.76583       5.553014 31.55957       5.472318 40.69660 5.760113 50.55045 4.488953 -9.853855      7.302712 
1 1 1 -22 1  11 o 228.0266 3.895343 636.3768       21.64548 619.3668       30.29128 654.1251       30.94175 224.4489 5.538143 230.6734 5.504417 -6.224503      7.808305 
1 1 1 -22 1  12 o 120.0870 3.271797 176.4054       9.565631 170.2372       15.73033 180.0246       12.04952 117.5420 5.507034 121.1807 4.086222 -3.638725      6.857450 
1 1 1 -22 1  13 o 24.55835 6.007618 7.723636       3.565225 9.875275       4.848980 5.191726       5.260049 27.73233 7.134427 21.96242 7.814122 5.769911       10.58114 
1 1 1 -22 1  14 o 143.3466 3.464129 251.3289       12.10090 258.6599       15.26265 238.9210       19.85629 145.2059 4.318095 139.1481 5.868958 6.057846       7.286331 
1 1 1 -22 1  15 o 124.5484 2.906523 189.5407       8.821615 184.2226       12.42198 194.9517       12.53001 122.5382 4.165963 126.0767 4.083701 -3.538498      5.833683 
1 1 1 -22 1  16 o 86.38181 2.822180 91.26841       5.932802 92.34223       8.463416 90.23093       8.318946 86.71954 4.015812 85.72405 3.993232 0.9954910      5.663271 
1 1 1 -22 1  17 o 97.25445 2.831142 115.6858       6.702622 112.0227       9.493739 119.3261       9.464209 95.50295 4.088750 98.59872 3.946894 -3.095772      5.682944 
1 1 1 -22 1  18 o 19.24143 6.064799 4.522538       3.176220 3.337083       4.745877 5.484288       4.274691 19.28791 7.323865 21.44432 7.061279 -2.156406      10.17353 
1 1 1 -22 1  19 o 118.8413 2.891140 172.6992       8.372841 182.3272       12.16214 164.0249       11.54400 121.8220 4.102684 115.5380 4.106641 6.284065       5.804870 
1 1 1 -22 1  20 o 15.74475 5.944101 2.249285       3.115535 0.1879710      4.438202 4.251897       4.374551 15.69110 6.663578 19.90048 7.121069 -4.209379      9.752584 
1 1 1 -22 1  21 o 30.52177 5.720671 11.89932       4.098640 11.99324       5.043696 11.71672       7.032850 30.41507 6.956429 30.12653 8.937118 0.2885361      11.32537 
1 1 1 -22 1  22 o 109.7385 3.362991 147.8040       8.982726 140.2931       15.56232 151.5568       11.00021 106.0536 6.046668 110.9366 4.075953 -4.882919      7.292160 
1 1 1 -22 1  23 o 59.34601 3.242412 43.31968       4.671354 46.33683       6.898518 40.76460       6.348312 61.08423 4.669770 57.29204 4.585276 3.792187       6.544579 
1 1 1 -22 1  24 o 23.27440 5.901289 7.016533       3.351204 9.252732       5.141315 5.364587       4.418928 26.66117 7.564513 21.23828 7.183448 5.422888       10.43186 
1 1 1 -22 1  25 o 88.44667 2.926170 96.05905       6.298236 94.02193       9.008265 98.00712       8.809173 87.12818 4.255613 89.02026 4.071567 -1.892082      5.889644 
1 1 1 -22 1  26 o 39.63171 4.747525 19.77801       4.493939 11.51323       7.895311 23.73884       5.465713 29.67418 9.585036 43.31217 5.287975 -13.63799      10.94694 
1 1 1 -22 1  27 o 67.16260 3.730538 55.89383       6.081706 51.42368       7.476741 64.63518       10.45539 64.05132 4.825629 71.29424 6.075803 -7.242920      7.759000 
1 1 1 -22 1  28 o 53.24821 3.498271 35.17485       4.514218 33.27913       6.515159 36.92532       6.260585 51.20004 5.298248 54.14837 4.794014 -2.948334      7.145208 
1 1 1 -22 1  29 o 36.45758 4.646679 16.89633       4.034567 15.40771       6.027867 18.10443       5.430287 33.74834 7.521784 37.19122 6.210495 -3.442883      9.754357 
1 1 1 -22 1  30 o 65.39082 3.385449 53.13804       5.376356 49.63396       7.743078 56.40007       7.470857 62.40401 5.137178 66.82223 4.616265 -4.418217      6.906556 
1 1 1 -22 1  31 o 29.96808 5.586830 11.84934       3.929944 5.695208       5.539598 18.08495       5.576143 21.79466 7.983255 36.78630 6.455647 -14.99164      10.26683 
1 1 1 -22 1  32 o 19.40821 7.064354 4.489645       4.327650 3.735109       7.391644 4.883190       5.338245 21.29005 8.787468 20.61529 7.781188 0.6747608      11.73740 
1 1 1 -22 1  33 o 64.84925 4.718349 54.13491       7.405422 42.20663       10.17012 67.59729       10.80433 54.74304 7.847773 71.06249 6.304447 -16.31945      10.06646 
1 1 1 -22 1  34 o 58.46600 3.627974 43.22371       5.143499 45.92847       7.376024 40.66359       7.176106 59.19610 5.164873 55.52177 5.370810 3.674324       7.451275 
1 1 1 -22 1  35 f 34.54475 5.343020 16.00843       4.352818 14.74960       6.268557 17.18060       6.048944 31.34221 8.136767 34.43387 7.427240 -3.091661      11.01685 
1 1 1 -22 1  36 o 33.88546 5.261374 15.49938       4.203743 15.80700       6.067623 15.21542       5.829505 32.45856 7.773659 31.96445 7.596467 0.4941120      10.86904 
1 1 1 -22 1  37 o 18.27308 7.318730 3.749729       4.948222 5.833757       7.152599 1.836789       6.852716 21.35317 8.709778 18.34596 8.034796 3.007208       11.84982 
1 1 1 -22 1  38 o 11.18132 5.241439 -2.644917      3.596457 -5.553141      5.304121 -0.1700226     4.893030 12.45323 5.985219 14.79028 6.616221 -2.337049      8.921728 
1 1 1 -22 1  39 o 14.34507 6.288145 0.5828112      4.205496 -6.927426      6.885028 5.052497       5.311502 13.80405 6.680029 19.26484 7.626175 -5.460789      10.13811 
1 1 1 -22 1  40 o 18.85451 6.844315 5.223127       4.058487 12.72426       5.870954 -1.642187      5.616624 27.32304 8.180186 14.47362 6.705502 12.84941       10.57730 
1 1 1 -22 2  1  o 194.4293 3.256132 462.2160       15.42765 448.9465       19.35288 485.3501       25.55316 191.4103 4.149008 198.6028 5.284564 -7.192566      6.718697 
1 1 1 -22 2  2  o 91.13831 2.698834 101.5293       5.987350 98.40076       7.349290 107.7040       10.32471 89.64156 3.370342 93.60392 4.539883 -3.962364      5.654180 
1 1 1 -22 2  3  o 87.55936 2.687693 93.71001       5.728010 95.80484       7.168130 90.00919       9.527532 88.45918 3.331222 85.55065 4.586819 2.908524       5.668858 
1 1 1 -22 2  4  o 145.4752 2.550785 258.3667       9.042717 260.8134       12.79357 255.9240       12.78311 146.0212 3.595338 144.5955 3.630690 1.425690       5.109634 
1 1 1 -22 2  5  o 70.06399 2.381312 59.98232       4.059902 62.87770       5.767599 57.13862       5.715888 71.64438 3.312485 68.27364 3.446686 3.370735       4.780397 
1 1 1 -22 2  6  o 82.33092 2.560669 82.82871       5.131263 84.78118       8.349824 81.64391       6.504416 83.10664 4.135921 81.66460 3.275066 1.442032       5.275595 
1 1 1 -22 2  7  o 105.8415 2.967338 136.9508       7.645933 123.1764       17.39976 140.2471       8.511766 99.54513 7.221885 107.0713 3.266017 -7.526207      7.926064 
1 1 1 -22 2  8  o 104.7670 2.970330 134.1867       7.575771 149.0708       18.27727 131.0991       8.324536 109.6553 6.874418 103.5124 3.304367 6.142937       7.627350 
1 1 1 -22 2  9  o 65.56466 3.020299 52.62695       4.812686 45.23876       6.801346 60.03611       6.810997 60.56910 4.643355 69.91740 4.014383 -9.348293      6.138079 
1 1 1 -22 2  10 o 194.9927 3.532922 464.9743       16.78759 471.8909       24.10948 458.4646       23.38938 196.0012 5.051904 193.2155 4.971662 2.785660       7.087958 
1 1 1 -22 2  11 o 105.5164 3.174847 136.1867       8.154258 143.3116       13.90297 132.4506       10.06773 107.8744 5.305023 103.9415 3.982084 3.932877       6.633269 
1 1 1 -22 2  12 o 38.02479 4.283304 17.93546       3.900037 19.19729       6.449192 17.20796       4.896908 38.82082 7.077878 36.99974 5.606546 1.821075       9.029381 
1 1 1 -22 2  13 o 51.14863 3.289792 32.11512       4.078773 35.71508       6.150691 29.28938       5.449300 53.74769 4.744669 48.64749 4.653330 5.100204       6.645702 
1 1 1 -22 2  14 o 105.7154 3.236614 136.7570       8.328243 136.3870       10.53851 137.3724       13.59133 105.4339 4.109558 105.5745 5.299779 -0.1406021     6.706424 
1 1 1 -22 2  15 o 33.09233 4.466778 13.67063       3.510222 12.61028       5.156787 14.58616       4.791701 31.32189 6.938922 33.90498 6.020000 -2.583090      9.186351 
1 1 1 -22 2  16 o 45.07375 3.581725 25.02157       3.901831 24.24586       5.703941 25.70378       5.349173 44.05722 5.427367 45.47987 4.903917 -1.422649      7.314692 
1 1 1 -22 2  17 o 86.47859 2.858430 91.50057       6.015546 92.40906       8.767796 90.69259       8.268661 86.70762 4.161662 85.93232 3.959235 0.7752991      5.744125 
1 1 1 -22 2  18 o 75.47169 2.899295 69.73855       5.322358 75.94997       7.931966 64.65149       7.178249 78.57132 4.157470 72.48804 4.080118 6.083275       5.825111 
1 1 1 -22 2  19 f 16.04936 5.981156 2.445292       3.132991 4.469897       4.603249 0.6981215      4.276238 20.41459 7.304862 15.89432 6.632560 4.520265       9.866704 
1 1 1 -22 2  20 o 100.7085 3.322898 124.3551       8.143746 125.8509       10.14417 121.6434       13.65833 101.1428 4.124367 99.00831 5.684855 2.134499       7.023388 
1 1 1 -22 2  21 o 19.82924 6.726761 4.577749       3.875099 4.671389       4.840209 4.410576       6.467215 20.83820 7.486435 22.20593 8.520678 -1.367731      11.34234 
1 1 1 -22 2  22 o 108.4149 3.341610 144.2603       8.817836 156.3909       16.32632 139.2643       10.47745 111.9956 6.004014 106.3379 4.050666 5.657738       7.242657 
1 1 1 -22 2  23 o 32.98219 4.689395 13.69406       3.662971 13.30036       5.499841 14.00792       4.910550 31.91730 7.238294 32.97260 6.341650 -1.055294      9.623379 
1 1 1 -22 2  24 o 57.14926 3.313686 40.23360       4.595063 37.40322       6.758476 42.66669       6.266209 54.67421 5.132616 58.61452 4.419515 -3.940319      6.773172 
1 1 1 -22 2  25 o 86.94934 2.954393 92.85901       6.250854 94.08022       9.204407 91.81369       8.515784 87.11633 4.349466 86.15048 4.067796 0.9658432      5.955234 
1 1 1 -22 2  26 o 25.87186 6.318728 8.768193       3.948867 13.18045       8.116091 7.399730       4.519944 31.39511 9.663671 23.91851 7.181375 7.476601       12.03988 
1 1 1 -22 2  27 o 32.03733 5.731199 13.27398       4.310156 13.94863       5.401211 12.09110       7.151890 32.46294 7.031392 29.98534 9.040245 2.477596       11.45280 
1 1 1 -22 2  28 o 43.32954 4.563888 23.66390       4.746692 25.73155       6.125123 20.55525       7.510389 44.78679 5.744230 38.98530 8.167372 5.801487       9.985096 
1 1 1 -22 2  29 o 57.09390 3.480929 40.49905       4.820057 32.01149       7.088265 47.79957       6.573936 49.79243 5.959975 61.70008 4.401135 -11.90765      7.408865 
1 1 1 -22 2  30 o 60.06153 3.428030 44.88152       4.996544 46.36889       7.528745 43.71074       6.679584 60.27144 5.176033 58.73875 4.705805 1.532684       6.995421 
1 1 1 -22 2  31 o 18.46652 6.603020 4.019422       3.760488 -5.665299      5.622412 11.85871       5.058448 13.53056 6.406843 29.37362 7.137862 -15.84306      9.591492 
1 1 1 -22 2  32 o 44.56441 4.239266 25.28381       4.548399 26.52207       6.609861 24.17013       6.268520 44.58208 6.256005 42.54508 6.230811 2.037006       8.829530 
1 1 1 -22 2  33 o 32.52287 7.354899 14.96743       5.692019 18.49583       8.275352 11.79920       7.841612 34.76307 9.499951 28.10316 9.568514 6.659906       13.48353 
1 1 1 -22 2  34 o 55.69280 4.409814 39.92249       5.936064 51.24809       10.77736 34.99040       7.112091 60.31384 7.493758 51.13645 5.810192 9.177387       9.482338 
1 1 1 -22 2  35 o 62.28349 3.549386 49.14207       5.364887 46.74730       7.670283 51.43570       7.506559 59.32063 5.363930 62.61063 4.960413 -3.290001      7.305987 
1 1 1 -22 2  36 o 37.51704 4.963553 18.76542       4.426700 14.95472       6.250056 22.60119       6.270592 31.23888 8.132155 39.93597 6.678971 -8.697086      10.52334 
1 1 1 -22 2  37 o 57.74096 4.260222 43.54668       5.952278 39.20668       10.10099 45.85545       7.367306 50.07962 8.585741 58.27668 5.243753 -8.197060      10.06041 
1 1 1 -22 2  38 o 28.94254 6.079353 12.07747       4.151142 9.943714       5.961092 14.08642       5.784111 24.69092 8.343322 29.79246 7.856133 -5.101543      11.45992 
1 1 1 -22 2  39 o 21.29356 6.799959 6.896911       3.981697 1.539490       5.729485 11.90107       5.537368 16.67951 7.324658 26.95235 7.913235 -10.27284      10.78285 
1 1 1 -22 2  40 o 18.58063 6.711020 5.037785       3.895606 5.221403       5.710807 4.877984       5.327575 19.33337 7.820549 18.87389 7.582151 0.4594803      10.89266 
1 1 1 -22 3  1  o 99.78323 2.724757 121.7085       6.619342 123.6797       8.226431 118.0884       11.14820 100.5044 3.363587 97.97802 4.682729 2.526352       5.765559 
1 1 1 -22 3  2  o 233.8978 3.283256 668.9113       18.71401 678.9406       26.64363 659.1457       26.29112 235.2352 4.647881 231.7782 4.654793 3.456955       6.577985 
1 1 1 -22 3  3  o 72.08585 2.440094 63.50549       4.280222 61.68972       5.942181 65.46352       6.170575 70.93965 3.447650 73.07876 3.474916 -2.139107      4.895031 
1 1 1 -22 3  4  o 127.8265 2.457352 199.4577       7.654633 204.2861       10.88080 194.7266       10.77061 129.2016 3.458977 126.1324 3.507514 3.069183       4.926173 
1 1 1 -22 3  5  o 221.6642 3.462186 600.8436       18.70175 595.1646       29.55236 604.6372       24.15350 219.9389 5.518198 222.0990 4.462696 -2.160126      7.096912 
1 1 1 -22 3  6  o 21.03769 5.279846 5.648926       2.702198 8.328385       4.300660 3.901077       3.473469 25.52386 6.794593 18.58099 6.367289 6.942879       9.311759 
1 1 1 -22 3  7  o 51.58668 2.951573 32.61386       3.694968 31.05009       6.001714 33.56834       4.688939 50.05580 4.986485 52.25282 3.706439 -2.197021      6.213109 
1 1 1 -22 3  8  o 93.44830 2.952605 106.7802       6.715331 102.4314       16.35955 107.6614       7.364368 90.65497 7.471583 93.80133 3.226543 -3.146362      8.138497 
1 1 1 -22 3  9  o 150.0473 3.684278 275.4217       13.47152 300.1893       26.43277 266.7311       15.65763 155.6956 6.984531 147.4797 4.361491 8.215897       8.234456 
1 1 1 -22 3  10 o 113.9505 3.210484 158.8218       8.906144 164.6409       15.15867 155.7541       11.00606 115.6204 5.394979 112.7217 4.013115 2.898651       6.723904 
1 1 1 -22 3  11 o 129.0540 3.294241 203.7274       10.35160 197.0636       17.41549 207.3679       12.87230 126.4397 5.666579 130.0702 4.066082 -3.630470      6.974463 
1 1 1 -22 3  12 o 112.3582 2.867172 154.3103       7.844036 149.2722       11.33414 158.9416       10.86689 110.3019 4.224479 113.8769 3.921771 -3.574997      5.764244 
1 1 1 -22 3  13 o 103.0819 2.824291 129.8945       7.087913 138.1968       10.57604 123.1250       9.549957 106.1393 4.096631 100.2050 3.918448 5.934326       5.668917 
1 1 1 -22 3  14 o 88.05408 2.876055 94.82909       6.163107 100.5373       9.161336 90.11013       8.329784 90.48488 4.165946 85.68040 4.000523 4.804474       5.775750 
1 1 1 -22 3  15 o 107.8298 3.302750 142.3333       8.668387 141.0310       11.04674 144.4203       13.98410 107.1740 4.238047 108.2204 5.318901 -1.046394      6.800864 
1 1 1 -22 3  16 o 138.0197 3.015265 232.8687       10.14151 225.1780       14.48585 240.2619       14.20287 135.4027 4.395988 139.9240 4.169966 -4.521301      6.059152 
1 1 1 -22 3  17 o 50.63574 3.333637 31.50757       4.090619 29.07983       6.124572 33.46278       5.496309 48.31651 5.287946 52.03585 4.374910 -3.719334      6.863105 
1 1 1 -22 3  18 o 71.35098 2.955126 62.35807       5.127091 60.30124       7.539936 64.12711       6.992566 69.92861 4.447677 72.20361 3.989634 -2.275002      5.974865 
1 1 1 -22 3  19 f 116.9640 2.908272 167.3126       8.289401 168.0980       12.11351 166.6208       11.36794 116.9141 4.258861 116.4591 4.011634 0.4549942      5.850735 
1 1 1 -22 3  20 o 45.19428 4.393826 25.34867       4.778069 32.72531       6.228244 14.79750       7.448808 51.27129 5.050383 33.61036 8.939736 17.66093       10.26768 
1 1 1 -22 3  21 o 36.46785 4.357840 16.59225       3.796166 16.04859       5.740511 17.01476       5.060700 35.27380 6.925552 36.60294 5.872097 -1.329136      9.079911 
1 1 1 -22 3  22 o 130.7793 3.436350 209.9676       10.94199 198.2793       19.53043 215.3148       13.20983 125.9302 6.385068 132.2246 4.104641 -6.294426      7.590598 
1 1 1 -22 3  23 o 142.3510 3.528470 248.8703       12.24004 241.1486       21.74942 252.4495       14.80752 138.7088 6.452069 143.0546 4.252326 -4.345795      7.727320 
1 1 1 -22 3  24 o 42.09063 3.930903 22.00846       3.985308 17.63026       5.899294 25.68399       5.405216 36.89641 6.812036 45.25234 4.984015 -8.355934      8.440630 
1 1 1 -22 3  25 o 65.36731 3.541906 52.74094       5.620934 62.26050       11.17696 49.51829       6.503132 69.96673 6.634631 63.15282 4.250406 6.813904       7.879357 
1 1 1 -22 3  26 o 54.58361 3.824491 36.95730       5.054930 48.90590       10.35778 33.22172       5.791453 61.64524 7.019876 51.51132 4.664190 10.13392       8.428126 
1 1 1 -22 3  27 o 93.36259 4.425570 108.5885       10.04015 108.5885       10.04015 0.000000       0.000000 93.36259 4.425570 ?        ?        0.000000       4.425570 
1 1 1 -22 3  28 o 29.80378 5.314064 11.48440       3.717963 7.768201       5.845733 14.00880       4.818022 24.67166 8.261752 32.67266 6.279384 -8.001001      10.37724 
1 1 1 -22 3  29 o 66.12067 3.249782 54.15506       5.220294 49.09443       7.848361 58.17044       6.991016 62.14127 5.231311 68.15339 4.230219 -6.012123      6.727657 
1 1 1 -22 3  30 o 22.81894 6.327933 6.954499       3.641448 5.724395       5.726171 7.789742       4.718454 22.07645 8.111607 24.09291 7.359441 -2.016453      10.95260 
1 1 1 -22 3  31 o 17.79482 6.489336 3.595226       3.654262 -2.913326      5.506326 8.717990       4.885083 14.75642 6.764848 25.19540 7.441911 -10.43898      10.05710 
1 1 1 -22 3  32 o 61.36967 3.987362 47.58014       5.930863 49.77037       7.654060 44.28910       9.382394 62.08122 5.104407 57.27502 6.858418 4.806206       8.549437 
1 1 1 -22 3  33 f 46.75732 4.093109 27.88751       4.616807 31.19911       6.871327 25.16219       6.233479 48.32237 5.961463 43.26624 6.079633 5.056126       8.514751 
1 1 1 -22 3  34 o 25.06891 6.610100 8.842971       4.095003 3.711042       6.067924 13.13498       5.549196 19.71029 8.028780 30.08976 7.574355 -10.37947      11.03776 
1 1 1 -22 3  35 o 32.76926 6.224188 14.90789       4.788639 16.17600       8.602158 14.33844       5.764390 31.34673 9.993140 31.19019 7.644463 0.1565437      12.58176 
1 1 1 -22 3  36 f 34.79906 6.083300 16.87103       4.971018 7.456586       8.485829 21.78962       6.133621 23.41976 9.511368 39.17932 6.662568 -15.75956      11.61275 
1 1 1 -22 3  37 o 21.89249 7.141575 7.085367       4.376888 4.385524       7.350079 8.568776       5.448202 20.34216 8.604215 23.59140 7.976306 -3.249235      11.73260 
1 1 1 -22 3  38 o 37.25998 4.961971 18.89652       4.393499 19.93649       6.496440 18.01993       5.964303 35.84696 7.668726 34.33910 7.349400 1.507858       10.62182 
1 1 1 -22 3  39 o 38.07330 4.956050 19.88689       4.489215 17.57571       6.607794 21.86806       6.117889 32.54682 8.305065 38.16895 6.828106 -5.622124      10.75161 
1 1 1 -22 3  40 o 11.55209 5.405194 -2.354148      3.794942 5.645873       5.714920 -8.664174      5.075515 19.69702 7.873336 10.79636 5.329446 8.900653       9.507493 
1 1 1 -22 4  1  o 189.4811 3.202514 438.9984       14.78744 434.1710       23.22909 442.2876       19.17457 187.8717 5.078475 189.9658 4.142038 -2.094101      6.553425 
1 1 1 -22 4  2  o 19.35247 5.236145 4.757519       2.528787 2.656336       3.290873 7.787132       3.951597 16.59276 6.140118 24.66574 6.488355 -8.072979      8.933073 
1 1 1 -22 4  3  o 92.26760 2.390147 103.9894       5.369627 101.3105       7.439561 106.9025       7.758046 90.95900 3.362123 93.43193 3.413119 -2.472931      4.790955 
1 1 1 -22 4  4  o 103.6932 2.636336 131.3801       6.656329 130.9641       10.57577 131.6530       8.565756 103.3041 4.209872 103.7053 3.394018 -0.4011230     5.407623 
1 1 1 -22 4  5  o 16.66230 5.670208 3.154458       2.753636 5.423966       4.315953 1.596406       3.576035 21.43982 7.096797 15.70212 6.244067 5.737703       9.452666 
1 1 1 -22 4  6  o 197.8753 3.230211 478.5883       15.57610 482.1185       24.89765 476.3181       19.96577 198.0529 5.163111 197.2020 4.154692 0.8509827      6.627155 
1 1 1 -22 4  7  o 68.48596 2.677579 57.35932       4.460076 63.95678       7.405949 53.60491       5.586803 72.13410 4.231709 66.11745 3.479708 6.016655       5.478661 
1 1 1 -22 4  8  o 21.10340 5.541722 5.674953       2.885878 6.610721       5.186839 5.255392       3.473091 23.58633 7.778799 20.62557 6.316605 2.960764       10.02044 
1 1 1 -22 4  9  o 51.77047 5.039603 33.20981       6.277535 0.000000       0.000000 33.20981       6.277535 ?        ?        51.77047 5.039603 0.000000       5.039603 
1 1 1 -22 4  10 o 203.4964 3.649851 506.6125       18.09956 480.4990       25.39601 533.5679       25.80212 197.6796 5.276624 208.4464 5.079547 -10.76674      7.324244 
1 1 1 -22 4  11 o 20.92252 5.930545 5.530436       3.161651 8.312313       5.125891 3.822210       4.016735 25.70225 7.631165 19.04867 6.822764 6.653572       10.23644 
1 1 1 -22 4  12 o 182.2747 3.398788 406.2939       15.09686 410.3591       21.89963 402.6124       20.84013 182.7558 4.921813 181.0797 4.726788 1.676117       6.823984 
1 1 1 -22 4  13 o 64.58964 3.018406 51.09190       4.737768 53.04000       7.346081 49.70453       6.199362 65.59108 4.625610 63.57793 4.021945 2.013145       6.129625 
1 1 1 -22 4  14 o 90.15463 2.837865 99.39942       6.226940 102.4182       9.330701 96.97536       8.361283 91.31603 4.204343 88.90641 3.868517 2.409622       5.713311 
1 1 1 -22 4  15 o 110.0273 3.329666 148.2149       8.917376 140.4538       11.22746 161.4768       14.67651 106.9293 4.317603 114.4424 5.276795 -7.513100      6.818084 
1 1 1 -22 4  16 o 153.7586 3.653408 289.4866       13.68906 277.4778       16.89844 312.4102       23.34738 150.2448 4.620910 158.9445 6.038750 -8.699692      7.603901 
1 1 1 -22 4  17 o 223.9315 3.846807 614.5537       20.99189 615.1006       30.05692 614.0330       29.33045 223.3458 5.522436 223.2136 5.392150 0.1321564      7.718328 
1 1 1 -22 4  18 o 25.63794 5.576659 8.420569       3.384735 4.492634       5.364349 11.01876       4.362848 21.22081 7.841758 29.28567 6.300388 -8.064854      10.05923 
1 1 1 -22 4  19 o 177.8639 3.928310 388.1680       17.02667 381.8990       20.93035 400.4336       29.27676 176.0219 4.884202 179.3397 6.710846 -3.317749      8.300053 
1 1 1 -22 4  20 o 94.84619 2.894799 110.1673       6.682914 110.0238       9.933303 110.2860       9.032870 94.49026 4.325377 94.69723 3.922779 -0.2069626     5.839270 
1 1 1 -22 4  21 o 139.9441 3.062270 239.8438       10.44322 233.4431       15.09828 245.7150       14.46024 137.5849 4.509285 141.2683 4.205120 -3.683411      6.165767 
1 1 1 -22 4  22 o 111.9641 2.932277 153.6331       7.993666 166.5888       12.17710 143.8226       10.59649 116.2078 4.307494 108.0480 4.031546 8.159813       5.899819 
1 1 1 -22 4  23 o 84.91207 3.319181 88.61999       6.854869 98.25070       13.45098 85.24130       7.967068 88.45030 6.281356 83.12604 3.944263 5.324265       7.417051 
1 1 1 -22 4  24 o 38.15874 4.124361 18.16492       3.774317 17.93055       5.935241 18.32405       4.890544 37.20492 6.796765 38.01022 5.434319 -0.8052979     8.702175 
1 1 1 -22 4  25 o 15.18436 6.157170 1.315888       3.549662 -4.456128      7.555128 2.950965       4.021122 17.33058 7.937128 17.75713 6.741749 -0.4265556     10.41389 
1 1 1 -22 4  26 o 63.47010 3.781649 49.90988       5.822547 42.54440       7.520172 60.93392       9.200212 58.08333 5.373922 69.55279 5.472135 -11.46946      7.669635 
1 1 1 -22 4  27 o 28.32295 5.593131 10.42115       3.723343 9.241485       5.927267 11.19005       4.785329 26.50699 8.274984 29.03823 6.870433 -2.531237      10.75538 
1 1 1 -22 4  28 f 35.31079 4.882449 15.89522       4.088977 17.21539       6.263202 14.91454       5.398124 35.85229 7.413695 33.52139 6.840086 2.330894       10.08710 
1 1 1 -22 4  29 o 43.13406 4.080859 23.38575       4.238509 17.58964       6.692200 27.26810       5.477066 35.88921 7.869185 46.29597 4.930541 -10.40675      9.286242 
1 1 1 -22 4  30 o 40.59784 4.254954 20.86501       4.147069 24.82046       6.710279 18.42061       5.275065 43.28559 6.567446 37.44423 5.982281 5.841354       8.883638 
1 1 1 -22 4  31 o 18.16963 6.528603 3.871253       3.681046 6.466482       5.863288 2.182876       4.729205 22.73837 8.230457 17.40531 7.088699 5.333061       10.86232 
1 1 1 -22 4  32 o 61.22324 4.080937 47.46971       6.053767 39.45248       7.738973 60.11043       9.717560 54.67214 5.902165 67.52973 5.966398 -12.85759      8.392465 
1 1 1 -22 4  33 o 52.10782 3.880333 34.46008       4.891918 23.80839       7.012796 44.55591       6.827363 41.26265 7.238071 58.67581 4.817209 -17.41316      8.694549 
1 1 1 -22 4  34 o 38.38746 5.626218 19.77314       5.106933 12.53536       9.441033 22.76694       6.071962 28.28146 10.41151 40.77577 6.314669 -12.49430      12.17681 
1 1 1 -22 4  35 o 12.33586 5.726114 -2.654108      4.125719 -4.081124      7.165421 -1.946391      5.046113 15.88649 7.431309 14.23347 6.506609 1.653021       9.877263 
1 1 1 -22 4  36 f 14.84257 6.473576 0.4059758      4.408354 -11.73707      7.824929 6.052051       5.335681 13.80424 6.775401 21.00339 7.809734 -7.199155      10.33915 
1 1 1 -22 4  37 o 19.22454 6.807265 5.125422       3.987618 0.1213889      5.722328 9.849355       5.559869 16.09312 7.180023 25.04304 8.039259 -8.949919      10.77880 
1 1 1 -22 4  38 o 19.29208 6.775103 5.344019       3.943841 5.468303       5.867216 5.241579       5.326741 20.05770 7.990832 19.62311 7.676774 0.4345894      11.08090 
1 1 1 -22 4  39 o 33.85151 5.341984 16.05479       4.260757 23.88250       6.581487 10.40719       5.590349 39.61832 7.076684 25.01847 8.064072 14.59985       10.72887 
1 1 1 -22 4  40 o 33.35394 5.500880 15.86195       4.315381 12.97118       6.407304 18.26192       5.838077 27.01261 8.625976 34.08395 7.251859 -7.071339      11.26929 
1 1 1 -22 5  1  f 83.41112 2.577677 85.05182       5.233195 81.46268       6.690654 90.70786       8.399030 81.53381 3.374696 85.94421 4.021447 -4.410400      5.249819 
1 1 1 -22 5  2  o 82.84148 2.718067 83.91828       5.479686 78.95896       8.373778 87.63246       7.246725 80.13461 4.303894 84.55533 3.524667 -4.420723      5.562983 
1 1 1 -22 5  3  o 208.5684 3.057070 531.6676       15.53782 508.9388       21.39474 557.0351       22.60255 203.7528 4.308910 213.1502 4.351466 -9.397430      6.123885 
1 1 1 -22 5  4  o 143.8129 2.829026 252.6498       9.914502 260.1068       15.96807 247.9714       12.64777 145.5642 4.506978 142.3076 3.650131 3.256622       5.799682 
1 1 1 -22 5  5  o 130.2407 2.734017 207.1688       8.677288 218.9096       14.17577 200.1335       10.97330 133.5677 4.361054 127.8624 3.525110 5.705269       5.607602 
1 1 1 -22 5  6  o 11.12696 4.937916 -0.9522680     2.669875 -6.565921      4.377734 2.372289       3.368941 11.25925 5.418064 16.33048 6.177555 -5.071228      8.216909 
1 1 1 -22 5  7  o 192.8983 3.489667 455.0900       16.40395 469.6508       32.26415 450.0139       19.04988 194.8231 6.806305 191.6879 4.078134 3.135208       7.934542 
1 1 1 -22 5  8  o 76.36587 3.177728 71.40032       5.900681 63.00294       9.546073 76.59270       7.506476 71.36358 5.532418 79.00314 3.911181 -7.639565      6.775321 
1 1 1 -22 5  9  o 230.4079 3.939407 649.9582       22.11894 684.2795       32.67728 620.9349       30.04949 235.8021 5.686725 224.6995 5.487808 11.10258       7.902840 
1 1 1 -22 5  10 o 27.85373 5.240585 9.839491       3.426612 7.080160       11.48744 10.10899       3.590050 29.04306 11.29886 28.21151 5.418921 0.8315506      12.53112 
1 1 1 -22 5  11 o 103.7581 2.879692 131.6213       7.274178 142.8056       11.12372 123.2652       9.614914 107.8704 4.239927 100.2572 3.943135 7.613197       5.790103 
1 1 1 -22 5  12 o 132.7175 3.004235 215.2463       9.716238 210.7036       14.18832 219.2578       13.33319 131.0066 4.450743 133.7188 4.096547 -2.712158      6.049034 
1 1 1 -22 5  13 o 168.9975 3.291041 349.2533       13.55345 345.8848       19.67034 352.2981       18.70129 167.7671 4.816358 169.3982 4.534374 -1.631149      6.614972 
1 1 1 -22 5  14 o 247.5644 4.128154 751.1925       24.90464 755.8668       35.91454 746.8629       34.56516 247.5465 5.953568 246.1627 5.762094 1.383865       8.285330 
1 1 1 -22 5  15 o 164.8297 3.256353 332.3150       13.07985 331.7085       18.95912 332.8658       18.06842 164.2592 4.741405 164.6161 4.508385 -0.3568268     6.542664 
1 1 1 -22 5  16 o 199.8297 4.155915 489.7730       20.23778 518.4505       26.02490 445.9024       32.18883 205.1473 5.210013 189.4143 6.985557 15.73302       8.714484 
1 1 1 -22 5  17 o 50.31789 3.493320 31.15003       4.256885 36.12601       6.863447 28.03920       5.426768 53.89382 5.294230 47.52307 4.749540 6.370747       7.112454 
1 1 1 -22 5  18 o 20.49453 6.869704 4.931849       4.041653 1.187109       5.358572 9.873167       6.155447 18.01226 7.462727 27.87245 8.383233 -9.860186      11.22368 
1 1 1 -22 5  19 o 107.0836 3.420236 140.6321       8.913697 145.7137       11.44603 132.8010       14.20909 108.7927 4.325994 103.4712 5.656733 5.321457       7.121295 
1 1 1 -22 5  20 o 46.53282 3.544747 26.70511       3.989331 30.34679       6.508012 24.51307       5.049196 49.22644 5.520156 44.35199 4.745342 4.874443       7.279450 
1 1 1 -22 5  21 o 81.83829 2.949548 82.11051       5.872693 81.90774       9.026046 82.25937       7.733459 81.38840 4.569264 81.72647 3.894271 -0.3380661     6.003626 
1 1 1 -22 5  22 o 114.9542 2.949909 161.9812       8.256779 155.0522       12.20344 167.8311       11.21303 112.0288 4.479119 116.7384 3.947283 -4.709541      5.970222 
1 1 1 -22 5  23 o 60.25199 3.623135 44.78700       5.295182 45.89198       10.79120 44.43656       6.077114 59.79037 7.576156 59.89039 4.190376 -0.1000252     8.657793 
1 1 1 -22 5  24 o 24.17227 7.294898 7.502555       4.655262 8.674010       7.739202 6.838384       5.827383 26.96987 9.489268 23.93555 8.245649 3.034315       12.57127 
1 1 1 -22 5  25 o 18.77206 6.428912 4.131294       3.540897 10.15320       7.453800 2.376289       4.023926 28.18316 9.326280 17.08384 6.675503 11.09933       11.46917 
1 1 1 -22 5  26 o 24.52373 5.974211 7.871701       3.536841 8.469998       5.608193 7.476599       4.557419 25.57103 8.058704 23.98755 7.213117 1.583475       10.81535 
1 1 1 -22 5  27 o 81.64423 3.009234 82.13564       5.976871 76.03242       9.090650 86.78268       7.932390 77.87065 4.814083 83.60978 3.904016 -5.739128      6.198124 
1 1 1 -22 5  28 o 40.33556 5.320759 20.83444       5.102529 22.67575       6.683027 18.26078       7.901082 41.49083 6.848476 36.26609 8.986435 5.224735       11.29857 
1 1 1 -22 5  29 o 47.62061 3.817256 28.37880       4.392711 32.90691       7.111794 25.58568       5.585558 50.43084 5.898188 44.68629 5.227976 5.744553       7.881647 
1 1 1 -22 5  30 o 42.78289 4.153710 23.12753       4.276108 10.74416       6.510458 32.52264       5.670783 27.79217 8.671969 50.58410 4.652448 -22.79193      9.841155 
1 1 1 -22 5  31 o 32.50942 5.153877 13.80226       3.946955 14.71804       6.238302 13.19097       5.096796 32.27932 7.977127 31.00470 6.921251 1.274616       10.56117 
1 1 1 -22 5  32 o 72.28761 3.842931 65.89130       6.745267 52.29984       8.604136 87.56456       10.86516 63.14891 5.650865 81.98740 5.469452 -18.83848      7.864298 
1 1 1 -22 5  33 o 26.59867 6.214542 9.764833       3.955155 0.4459251      6.281988 15.88478       5.090829 17.57529 7.695215 34.02387 6.374173 -16.44858      9.992318 
1 1 1 -22 5  34 o 24.00396 7.242090 8.243222       4.588564 11.53692       8.969110 7.075542       5.340347 27.38219 10.13596 22.56598 7.886918 4.816208       12.84294 
1 1 1 -22 5  35 o 31.87354 5.704030 13.89879       4.267776 15.54659       6.400929 12.58001       5.726348 32.02250 8.175502 28.92975 7.901204 3.092741       11.36960 
1 1 1 -22 5  36 o 36.74274 5.783289 18.62912       5.007281 13.32521       8.820938 21.15082       6.082230 27.91210 10.09621 38.43098 6.740138 -10.51888      12.13931 
1 1 1 -22 5  37 o 14.63912 6.169693 1.335130       3.757076 -5.417622      5.440686 7.490540       5.194477 12.77559 6.119467 22.26859 7.778768 -9.493000      9.897328 
1 1 1 -22 5  38 f 12.09558 5.677217 -2.894462      4.242325 1.498150       8.404613 -4.396266      4.914314 18.85620 8.532213 12.35354 5.889470 6.502655       10.36747 
1 1 1 -22 5  39 o 13.79642 5.975352 0.7618084      3.701672 3.939600       5.695031 -1.562856      4.870948 18.39422 7.663280 13.69003 6.307591 4.704194       9.925300 
1 1 1 -22 5  40 o 11.46359 5.362619 -2.304862      3.732021 2.333464       5.918699 -5.366155      4.808372 17.13606 7.486908 11.60412 5.607424 5.531937       9.353983 
1 1 1 -22 6  1  o 41.15067 3.290112 20.84541       3.271851 22.00315       4.201286 19.06108       5.215728 42.16357 4.142338 38.93240 5.663467 3.231174       7.016682 
1 1 1 -22 6  2  o 176.3341 3.046528 380.1019       13.09114 391.5953       17.18135 364.1942       20.21334 178.7829 3.943620 172.1156 4.824035 6.667374       6.230847 
1 1 1 -22 6  3  f 141.3505 3.155939 244.2754       10.87082 252.7561       15.65675 236.3815       15.10538 143.4666 4.483818 138.7395 4.473666 4.727097       6.333901 
1 1 1 -22 6  4  f 208.1708 3.368507 530.0159       17.08809 538.5920       27.40092 524.5578       21.85965 209.1695 5.380112 206.8395 4.336843 2.330002       6.910414 
1 1 1 -22 6  5  o 93.28368 2.857343 106.4096       6.487716 118.0150       12.10301 101.7303       7.685122 97.87224 5.092064 91.12954 3.466955 6.742699       6.160268 
1 1 1 -22 6  6  o 83.45787 2.827988 85.18346       5.743189 77.33811       10.42793 88.59926       6.880791 79.11065 5.442286 85.05691 3.326064 -5.946259      6.378180 
1 1 1 -22 6  7  o 202.4356 3.655918 501.4612       18.03514 512.6251       26.32083 491.5809       24.76159 204.1320 5.295649 199.9699 5.085461 4.162155       7.342058 
1 1 1 -22 6  8  o 89.28506 2.894673 97.49440       6.289845 105.8377       9.623592 91.27256       8.310534 92.83392 4.265368 86.24342 3.964883 6.590500       5.823544 
1 1 1 -22 6  9  o 146.0395 2.798761 260.5191       9.960295 291.2314       17.10083 244.7509       12.25324 154.0216 4.561189 141.3971 3.558932 12.62450       5.785364 
1 1 1 -22 6  10 o 266.3521 4.402430 869.8513       28.57490 899.1546       60.77715 861.5357       32.37649 267.7442 9.329283 264.8286 5.016823 2.915588       10.59264 
1 1 1 -22 6  11 o 130.3223 3.042392 207.5725       9.662067 235.2846       23.38800 201.8696       10.60977 137.6843 6.993545 128.4276 3.393064 9.256699       7.773195 
1 1 1 -22 6  12 o 115.1369 2.931147 162.0967       8.217414 155.4972       12.26635 167.4699       11.06816 112.4995 4.483315 116.8744 3.891578 -4.374954      5.936707 
1 1 1 -22 6  13 o 117.0136 2.939463 167.4394       8.375226 169.6476       12.64278 165.7126       11.18031 117.5150 4.422714 116.2378 3.952780 1.277184       5.931684 
1 1 1 -22 6  14 o 160.1400 3.229824 313.6505       12.60419 320.0570       18.71876 308.3365       17.04816 161.3411 4.766201 158.4572 4.419302 2.883835       6.499762 
1 1 1 -22 6  15 o 209.5633 3.696555 537.8786       18.87767 544.2899       27.55427 532.2073       25.91518 210.1341 5.385355 207.9657 5.113595 2.168381       7.426365 
1 1 1 -22 6  16 o 62.12975 3.686110 47.45282       5.555813 53.61811       7.695004 40.73919       8.029903 65.85770 4.828309 57.14712 5.848466 8.710583       7.584004 
1 1 1 -22 6  17 o 17.51451 6.737158 2.575456       4.050081 4.291478       5.461007 0.4778877      6.037669 21.10586 7.890436 18.42261 7.795578 2.683258       11.09189 
1 1 1 -22 6  18 o 35.00390 5.531155 15.49049       4.561558 20.83997       6.349644 9.785212       6.557407 40.44706 6.674701 27.88866 8.703350 12.55839       10.96813 
1 1 1 -22 6  19 o 104.3132 2.903807 133.2387       7.374294 132.9058       11.28207 133.4870       9.743857 103.8337 4.469225 104.2179 3.843234 -0.3841934     5.894440 
1 1 1 -22 6  20 o 14.47332 5.851335 1.160865       3.194919 -1.207474      5.454454 2.397837       3.941933 16.24915 7.140820 17.11388 6.629625 -0.8647327     9.743882 
1 1 1 -22 6  21 o 58.93447 3.200227 42.69788       4.578822 53.91983       7.536523 36.13210       5.764741 65.92956 4.722156 53.97164 4.421800 11.95792       6.469240 
1 1 1 -22 6  22 o 129.6975 3.021244 206.1620       9.548903 217.3405       14.58344 197.7726       12.63380 132.6161 4.519213 126.6573 4.098640 5.958748       6.100995 
1 1 1 -22 6  23 o 84.37833 4.242671 88.07977       8.695824 100.0678       14.22137 80.92108       10.98965 89.02435 6.602355 80.39822 5.645082 8.626129       8.686659 
1 1 1 -22 6  24 o 27.32516 6.052227 9.710986       3.923784 5.766632       8.164988 10.89543       4.474299 24.67819 9.546428 28.87614 6.513992 -4.197948      11.55709 
1 1 1 -22 6  25 o 54.21767 3.413716 36.32843       4.487394 26.37781       7.198282 42.65362       5.739056 45.18650 6.743155 58.60633 4.043242 -13.41983      7.862439 
1 1 1 -22 6  26 o 54.91628 3.446502 37.32824       4.589024 37.02383       7.412854 37.51739       5.843349 53.96407 5.724153 54.78498 4.414216 -0.8209114     7.228500 
1 1 1 -22 6  27 o 50.17778 3.560024 31.27182       4.324851 27.88024       7.065871 33.30362       5.468965 46.37740 6.424382 51.53942 4.396344 -5.162022      7.784634 
1 1 1 -22 6  28 o 15.95303 6.638969 1.101917       4.267560 -3.499295      5.584588 7.560036       6.616191 14.71949 6.771728 24.70980 8.766564 -9.990307      11.07741 
1 1 1 -22 6  29 o 12.38461 5.459046 -0.6775321     3.210269 -5.579492      5.784753 1.503992       3.859046 13.90685 6.558954 15.67388 6.395936 -1.767030      9.161216 
1 1 1 -22 6  30 o 52.32984 3.619097 34.26366       4.586720 28.24450       7.334754 38.12900       5.877759 46.02326 6.739615 54.86518 4.433957 -8.841923      8.067366 
1 1 1 -22 6  31 o 82.83408 3.697969 86.01832       7.445812 80.43357       9.589540 94.49658       11.81543 79.18532 4.995002 85.19447 5.724400 -6.009155      7.597289 
1 1 1 -22 6  32 o 42.31201 4.739964 23.16162       4.803460 16.39591       9.658596 25.38488       5.536719 32.23294 10.61424 44.02921 5.264523 -11.79626      11.84809 
1 1 1 -22 6  33 o 34.38279 5.037739 15.58545       4.095789 9.813428       6.332497 19.73672       5.370337 25.90012 8.597107 38.22909 5.958835 -12.32897      10.46030 
1 1 1 -22 6  34 o 18.07600 6.928153 3.693444       4.272401 10.56642       8.908050 1.640164       4.868938 26.48885 10.03957 16.66894 7.024260 9.819908       12.25289 
1 1 1 -22 6  35 o 33.39449 5.375534 15.08014       4.226081 15.33637       6.166371 14.85320       5.803303 31.90566 7.958005 31.63962 7.618426 0.2660408      11.01682 
1 1 1 -22 6  36 o 24.20197 7.049047 8.681253       4.409322 8.931772       7.727515 8.560311       5.369181 24.14661 9.301407 23.74620 7.917188 0.4004116      12.21466 
1 1 1 -22 6  37 o 25.26756 6.365420 9.338248       3.916986 8.881831       5.950444 9.687250       5.203335 23.69366 8.321967 24.87826 7.751146 -1.184593      11.37257 
1 1 1 -22 6  38 o 17.92509 6.742836 4.300052       4.001009 -0.6114758     5.831168 8.669403       5.499911 15.49684 7.049522 23.20368 8.009884 -7.706840      10.67024 
1 1 1 -22 6  39 o 16.85800 6.984267 2.999877       4.693271 1.113048       9.024404 3.699400       5.494815 18.73039 8.613762 18.03140 7.520932 0.6989841      11.43509 
1 1 1 -22 6  40 o 12.97233 5.851897 -0.4937400     3.918240 2.665390       6.027063 -2.806292      5.156651 17.42174 7.584345 13.25874 6.234479 4.163004       9.817892 
1 1 1 -22 7  1  o 64.77390 2.636376 51.34275       4.152743 53.63431       5.608899 48.56258       6.177990 66.10033 3.494488 62.80446 4.058373 3.295868       5.355543 
1 1 1 -22 7  2  o 65.82453 2.848671 53.05027       4.558657 51.37157       5.928140 55.47939       7.131084 64.65278 3.779139 67.09979 4.385149 -2.447014      5.788905 
1 1 1 -22 7  3  o 178.8239 3.877192 391.7319       16.89581 406.1764       28.59686 383.9856       20.94181 181.1087 6.490014 176.7095 4.867795 4.399246       8.112688 
1 1 1 -22 7  4  o 170.6785 3.320432 356.3131       13.81051 366.7956       26.50714 352.4074       16.18008 172.1935 6.327749 169.6138 3.914563 2.579681       7.440713 
1 1 1 -22 7  5  o 51.76871 3.480666 32.93570       4.365505 32.50699       6.370102 33.31535       5.994514 51.16343 5.180486 51.87045 4.796713 -0.7070198     7.060163 
1 1 1 -22 7  6  o 78.75992 3.019371 75.92448       5.784326 80.65779       8.698333 72.17188       7.744963 80.97620 4.424824 76.62798 4.163227 4.348221       6.075486 
1 1 1 -22 7  7  o 45.36832 3.296752 25.30157       3.619942 26.88268       6.206360 24.48634       4.456503 46.40282 5.601755 44.51018 4.156715 1.892639       6.975524 
1 1 1 -22 7  8  o 139.9598 2.783474 239.2965       9.493502 251.5791       15.92948 232.5310       11.82245 143.1214 4.573187 137.8155 3.523139 5.305878       5.772914 
1 1 1 -22 7  9  o 190.2313 3.520484 442.7678       16.32001 432.1680       23.49381 452.6523       22.68729 187.4295 5.148622 191.9245 4.854727 -4.495041      7.076488 
1 1 1 -22 7  10 o 72.69371 2.680455 64.63152       4.740206 67.49397       8.472433 63.32724       5.719085 73.99965 4.722969 71.88839 3.273201 2.111259       5.746327 
1 1 1 -22 7  11 o 143.2779 3.133828 250.9796       10.94184 259.5833       25.65931 249.0674       12.09683 144.4549 7.312936 142.6748 3.479270 1.780060       8.098416 
1 1 1 -22 7  12 o 118.2578 2.664403 170.8279       7.678312 184.0269       13.18651 164.0570       9.444601 122.3921 4.428500 115.7579 3.351618 6.634285       5.553823 
1 1 1 -22 7  13 o 226.9017 3.908921 630.8216       21.61378 636.6729       31.48939 625.6093       29.72028 227.1753 5.692580 225.3882 5.411101 1.787125       7.854010 
1 1 1 -22 7  14 o 60.98938 3.206574 45.62424       4.749011 50.72999       7.972350 42.81604       5.912481 64.00100 5.155260 58.94396 4.142559 5.057041       6.613433 
1 1 1 -22 7  15 o 103.6553 2.918093 131.4633       7.363667 128.7485       11.23377 133.5086       9.750611 102.2803 4.518255 104.3001 3.842855 -2.019882      5.931455 
1 1 1 -22 7  16 o 141.7153 4.633462 247.1718       15.97990 247.1718       15.97990 0.000000       0.000000 141.7153 4.633462 ?        ?        0.000000       4.633462 
1 1 1 -22 7  17 o 66.07619 3.696027 53.68774       5.927640 56.33740       7.811253 50.09016       9.101876 67.48923 4.780462 63.34706 5.966413 4.142174       7.645319 
1 1 1 -22 7  18 o 128.2153 2.991872 201.1699       9.348010 216.4768       14.50738 190.3021       12.22409 132.5705 4.497128 124.4202 4.037056 8.150284       6.043343 
1 1 1 -22 7  19 o 32.12037 4.774818 12.98725       3.623921 19.58450       6.484286 9.990681       4.370117 39.02361 7.079287 27.78254 6.560464 11.24107       9.651735 
1 1 1 -22 7  20 o 79.17049 2.945331 76.85194       5.672516 85.96629       9.193024 71.24802       7.208438 83.39104 4.540929 76.04333 3.903007 7.347710       5.987779 
1 1 1 -22 7  21 o 66.58398 3.053035 54.44155       4.940607 67.00525       8.358342 47.69437       6.125233 73.51627 4.689982 62.11937 4.068708 11.39689       6.208890 
1 1 1 -22 7  22 o 103.0475 3.494596 130.6025       8.762778 123.8103       11.29564 140.8680       13.88668 99.96931 4.649426 106.3577 5.375312 -6.388397      7.107120 
1 1 1 -22 7  23 o 99.74168 3.861728 122.7595       9.368567 0.000000       0.000000 122.7595       9.368567 ?        ?        99.74168 3.861728 0.000000       3.861728 
1 1 1 -22 7  24 o 17.16698 6.089094 3.260802       3.191776 11.50493       5.787505 -0.3425646     3.826249 29.44559 7.901691 14.02441 6.074582 15.42117       9.966808 
1 1 1 -22 7  25 o 25.00994 5.714909 8.152444       3.406672 14.24340       6.187474 5.502909       4.080895 32.63727 7.871556 21.07327 6.897227 11.56400       10.46581 
1 1 1 -22 7  26 o 39.30350 4.129169 19.36151       3.895857 17.03635       6.529703 20.64670       4.854579 35.66767 7.735604 40.33335 5.049484 -4.665688      9.237795 
1 1 1 -22 7  27 o 76.37607 3.077276 71.99438       5.715705 72.25961       9.128911 71.82336       7.330321 75.74663 4.973114 75.96338 3.973703 -0.2167511     6.365704 
1 1 1 -22 7  28 o 54.55571 4.319738 37.40616       5.696090 30.14468       7.557478 46.95629       8.667001 47.93739 6.648148 60.36973 5.969390 -12.43234      8.934847 
1 1 1 -22 7  29 o 41.22329 4.086805 21.43696       4.051481 25.13302       7.098143 19.65096       4.934195 43.38744 6.947785 38.99005 5.332689 4.397388       8.758384 
1 1 1 -22 7  30 o 21.60733 6.225958 6.247465       3.456703 2.601242       5.873172 8.179923       4.275690 19.11766 7.855923 24.49630 6.880513 -5.378635      10.44304 
1 1 1 -22 7  31 o 34.40103 6.682490 16.14918       5.400088 17.55493       9.780645 15.53274       6.476752 33.61496 10.64862 32.95258 8.119073 0.6623764      13.39076 
1 1 1 -22 7  32 o 54.03033 3.664890 36.84842       4.796856 27.89286       7.472868 43.12442       6.255795 44.92374 7.058660 57.99798 4.460464 -13.07424      8.349875 
1 1 1 -22 7  33 o 12.94553 5.719347 -0.5008287     3.542865 -5.383398      5.405626 3.175805       4.690801 13.07989 6.219080 17.99358 7.152655 -4.913691      9.478261 
1 1 1 -22 7  34 o 17.06399 6.784523 2.851477       4.221212 -5.302923      8.544001 5.484621       4.855148 16.94745 7.986313 20.46490 7.477370 -3.517452      10.94040 
1 1 1 -22 7  35 o 20.77400 6.999753 6.055676       4.195784 0.5595812      7.649840 8.420468       5.017898 18.57486 8.293495 23.84771 7.635568 -5.272844      11.27315 
1 1 1 -22 7  36 o 10.55906 5.018869 -3.568740      3.514786 -1.462221      5.518821 -5.006205      4.558921 14.93982 6.819999 11.67211 5.593771 3.267704       8.820581 
1 1 1 -22 7  37 o 11.15031 5.246226 -2.903357      3.661144 -6.551591      5.560587 -0.1115985     4.864276 12.42497 6.010394 14.81311 6.613661 -2.388136      8.936742 
1 1 1 -22 7  38 o 19.60844 6.749681 5.655180       3.904469 4.935225       5.932031 6.205500       5.186304 19.47464 7.936276 20.43165 7.678798 -0.9570084     11.04303 
1 1 1 -22 7  39 o 15.12464 6.343110 1.927938       3.940778 2.992486       5.972090 1.106919       5.244698 17.74638 7.637350 15.79293 6.968835 1.953449       10.33894 
1 1 1 -22 8  1  o 43.59164 3.230186 23.37740       3.406983 26.84787       4.570752 19.03848       5.110747 46.61121 4.064645 38.91059 5.546749 7.700623       6.876610 
1 1 1 -22 8  2  o 80.89668 2.707258 80.05599       5.329471 73.61250       6.556512 92.60458       9.149760 77.46630 3.482054 86.75336 4.341800 -9.287064      5.565602 
1 1 1 -22 8  3  o 95.89745 3.421077 112.6894       7.981962 119.9855       10.30295 101.7363       12.62374 98.79968 4.289495 90.63730 5.744941 8.162384       7.169667 
1 1 1 -22 8  4  o 221.0049 3.904186 598.4680       21.02657 605.0453       30.35952 592.4044       29.14950 221.4811 5.629560 219.3006 5.454504 2.180496       7.838594 
1 1 1 -22 8  5  o 113.8078 2.738765 158.2429       7.595616 166.0424       12.55175 153.7365       9.540843 116.2409 4.439233 112.0262 3.499162 4.214722       5.652515 
1 1 1 -22 8  6  o 121.3801 2.716939 179.9868       8.036439 196.5956       13.52337 170.9193       9.992207 126.5150 4.393051 118.1344 3.474730 8.380615       5.601130 
1 1 1 -22 8  7  o 77.88888 2.732299 74.20446       5.178054 78.16978       8.850137 72.14053       6.384980 79.67425 4.577494 76.71196 3.424178 2.962288       5.716506 
1 1 1 -22 8  8  o 35.20461 3.967812 15.37379       3.344755 16.04022       6.091447 15.08613       4.002038 35.32526 7.317070 34.71435 4.864114 0.6109085      8.786303 
1 1 1 -22 8  9  o 123.0558 2.695795 184.9817       8.083976 181.6518       13.54260 186.8250       10.07608 121.5645 4.579693 123.5361 3.350137 -1.971611      5.674241 
1 1 1 -22 8  10 o 249.6119 3.748696 763.0002       22.80245 751.9822       36.55556 770.0177       29.17393 246.7949 6.078285 250.3629 4.781772 -3.568008      7.733749 
1 1 1 -22 8  11 o 82.10171 3.003053 82.51192       5.998172 101.1323       16.81068 79.79550       6.420802 89.80879 7.757190 80.70208 3.271672 9.106712       8.418897 
1 1 1 -22 8  12 o 157.8814 2.902019 304.6766       11.16522 307.1915       18.71692 303.2873       13.91148 158.0081 4.866726 157.3816 3.627300 0.6265564      6.069788 
1 1 1 -22 8  13 o 149.2127 3.161725 272.3322       11.49651 267.0535       17.07113 276.7132       15.55189 147.3243 4.761265 150.1139 4.255638 -2.789612      6.385930 
1 1 1 -22 8  14 o 120.6138 2.967397 177.8869       8.721850 179.6983       13.33615 176.5330       11.52931 120.8572 4.536212 119.9260 3.950453 0.9311829      6.015255 
1 1 1 -22 8  15 f 149.6992 3.748709 274.8448       13.66455 282.1706       17.52727 263.4917       21.81941 151.3824 4.757099 145.7668 6.156406 5.615570       7.780189 
1 1 1 -22 8  16 o 110.0728 4.570261 149.2547       12.23239 149.2547       12.23239 0.000000       0.000000 110.0728 4.570261 ?        ?        0.000000       4.570261 
1 1 1 -22 8  17 o 13.81746 5.991738 -0.4799551     3.731179 1.094512       5.661561 -1.688855      4.960946 18.34597 7.641758 15.11355 6.717685 3.232416       10.17466 
1 1 1 -22 8  18 o 39.93064 3.880373 19.75815       3.728302 21.48783       6.476774 18.90096       4.559488 41.02642 6.710011 38.84499 4.927354 2.181427       8.324846 
1 1 1 -22 8  19 o 112.5805 2.935107 155.2729       8.045496 164.2398       12.64458 149.1731       10.42895 115.3673 4.506315 110.1183 3.892499 5.249031       5.954698 
1 1 1 -22 8  20 o 86.07314 2.943664 90.84409       6.165273 92.91583       9.793200 89.48392       7.935092 86.64288 4.655361 85.23898 3.829908 1.403908       6.028315 
1 1 1 -22 8  21 o 106.8083 2.982142 139.9142       7.754330 139.9904       12.00663 139.8597       10.15662 106.3449 4.644266 106.5354 3.918863 -0.1905136     6.076734 
1 1 1 -22 8  22 o 40.52701 4.251705 20.48600       4.136538 4.735472       8.486143 25.39471       4.737471 24.24248 9.625751 45.14289 4.360686 -20.90042      10.56743 
1 1 1 -22 8  23 o 144.8183 4.226283 259.4134       14.89887 0.000000       0.000000 259.4134       14.89887 ?        ?        144.8183 4.226283 0.000000       4.226283 
1 1 1 -22 8  24 o 101.5440 2.950350 126.7129       7.292947 120.9717       11.41600 130.6714       9.479444 98.54141 4.768151 102.8371 3.789134 -4.295731      6.090385 
1 1 1 -22 8  25 o 15.98026 5.989446 2.492173       3.150747 4.265188       6.086213 1.843041       3.682625 21.32906 8.244444 15.93869 6.336995 5.390372       10.39848 
1 1 1 -22 8  26 o 25.12276 5.854077 8.286535       3.517266 8.808077       6.611963 8.080708       4.153731 26.18118 8.786785 24.71345 6.721004 1.467730       11.06253 
1 1 1 -22 8  27 o 66.98442 3.267902 55.53799       5.318222 47.02029       8.570146 60.87211       6.782016 60.55836 5.881329 69.86758 4.000053 -9.309219      7.112697 
1 1 1 -22 8  28 o 42.59570 5.067937 23.21303       5.157550 29.61683       7.343463 16.97932       7.245283 47.50272 6.515228 34.87875 8.583478 12.62396       10.77610 
1 1 1 -22 8  29 o 76.92609 3.095065 73.35229       5.790179 61.95683       9.176875 80.88938       7.463294 69.43723 5.467412 80.43460 3.818506 -10.99738      6.668851 
1 1 1 -22 8  30 o 38.86095 5.314673 19.67673       4.901261 22.08521       7.162720 17.55603       6.721189 39.94077 7.637363 35.31118 7.997168 4.629589       11.05821 
1 1 1 -22 8  31 o 39.15666 4.429754 19.68729       4.152749 14.03358       6.823856 23.01271       5.233422 30.92474 8.694431 41.96973 5.230155 -11.04498      10.14631 
1 1 1 -22 8  32 o 33.40485 4.948176 14.65847       3.906375 12.36450       6.365301 16.04443       4.947656 28.89117 8.484691 34.35213 6.135462 -5.460955      10.47062 
1 1 1 -22 8  33 o 43.24089 4.280806 24.09978       4.451690 18.10639       6.598007 29.10793       6.031363 35.20457 7.886981 46.85234 5.380117 -11.64777      9.547257 
1 1 1 -22 8  34 o 15.69316 6.455479 1.844647       3.971243 -2.259966      8.166099 3.116054       4.544864 17.79016 8.185935 17.61997 7.028539 0.1701908      10.78934 
1 1 1 -22 8  35 o 21.90365 6.904440 6.927082       4.116489 14.62111       7.636066 3.775089       4.887484 29.73943 9.407532 18.40591 7.306078 11.33352       11.91136 
1 1 1 -22 8  36 o 10.51888 5.000520 -3.530789      3.491750 -4.034567      5.550342 -3.200809      4.492038 13.58195 6.411486 12.45221 5.843752 1.129744       8.675056 
1 1 1 -22 8  37 o 10.09825 4.874968 -4.641890      3.612456 -1.906932      5.327714 -6.969340      4.914800 14.23668 6.572785 11.29484 5.506383 2.941839       8.574483 
1 1 1 -22 8  38 o 15.03659 6.273372 1.875126       3.824481 0.3671903E-01  5.738840 3.343900       5.129565 15.71134 7.085286 17.58100 7.294336 -1.869652      10.16900 
1 1 1 -22 8  39 o 32.20100 5.780029 14.98626       4.368942 13.86208       6.929373 15.72802       5.628684 27.58913 8.984878 31.35765 7.472478 -3.768518      11.68614 
1 1 1 -22 9  1  o 207.2188 3.365374 525.7705       16.99411 537.4214       22.12701 509.0139       26.53592 209.1624 4.341133 203.0558 5.367397 6.106583       6.903215 
1 1 1 -22 9  2  o 72.01552 2.955356 63.52729       5.175452 60.96933       8.139339 65.26347       6.705626 70.24538 4.783371 72.87198 3.789109 -2.626602      6.102293 
1 1 1 -22 9  3  o 186.4857 3.589279 425.9393       16.31131 418.2214       23.13806 433.5641       22.99793 184.2119 5.159425 187.6136 5.034787 -3.401764      7.208935 
1 1 1 -22 9  4  o 98.81017 3.059716 119.5124       7.358601 126.4728       10.93054 113.7431       9.951490 101.3964 4.434398 96.18490 4.256199 5.211479       6.146472 
1 1 1 -22 9  5  o 156.0552 2.943710 297.7196       11.19462 280.4377       17.64156 309.3695       14.48441 150.9683 4.801399 158.9171 3.740194 -7.948807      6.086254 
1 1 1 -22 9  6  o 84.36219 3.091658 87.14647       6.345125 92.84366       9.555896 82.65378       8.485833 86.83868 4.531346 81.97166 4.262745 4.867012       6.221262 
1 1 1 -22 9  7  o 202.8617 3.314662 503.5005       16.38610 503.4392       26.50724 503.5384       20.84636 202.0977 5.387094 202.6096 4.222155 -0.5119476     6.844513 
1 1 1 -22 9  8  o 144.8782 2.832421 256.5197       9.999931 267.6513       16.85768 250.4760       12.42140 147.5283 4.695044 143.0360 3.563600 4.492325       5.894292 
1 1 1 -22 9  9  o 132.3837 2.754246 214.1506       8.885327 202.3305       14.49333 221.2684       11.24677 128.2586 4.644759 134.4155 3.436359 -6.156876      5.777746 
1 1 1 -22 9  10 o 58.92691 2.947112 42.55478       4.218576 45.85324       7.906397 41.24200       4.987916 60.77691 5.394284 57.93229 3.550202 2.844616       6.457726 
1 1 1 -22 9  11 o 69.53401 2.770854 59.18109       4.685723 64.73662       8.960978 57.09040       5.497145 72.34685 5.115752 68.22491 3.316356 4.121941       6.096650 
1 1 1 -22 9  12 o 219.6410 4.468007 592.5128       23.91461 598.9368       45.09858 589.9998       28.20697 218.4250 8.488911 218.8258 5.289586 -0.4008179     10.00207 
1 1 1 -22 9  13 o 145.5201 2.830160 258.8766       10.03622 253.1156       16.85969 262.0385       12.49032 143.3586 4.832935 146.2770 3.503979 -2.918396      5.969517 
1 1 1 -22 9  14 o 128.7563 3.630447 203.3037       11.37970 194.8817       14.46781 216.9673       18.42799 125.7766 4.728689 132.3904 5.725497 -6.613838      7.425754 
1 1 1 -22 9  15 o 116.0595 3.563733 165.2199       10.06717 162.3407       13.03083 169.4825       15.85542 114.7700 4.668904 116.9902 5.577569 -2.220123      7.273785 
1 1 1 -22 9  16 o 46.33776 3.631269 26.48663       4.067700 22.19370       6.898064 28.77522       5.036578 41.65062 7.047347 48.18972 4.335182 -6.539097      8.273989 
1 1 1 -22 9  17 o 63.74430 3.775146 50.04341       5.837970 49.67424       8.109277 50.44058       8.411276 63.17868 5.316425 63.62678 5.478111 -0.4480972     7.633746 
1 1 1 -22 9  18 o 56.63086 3.276049 39.43608       4.501755 34.06787       7.643177 42.28757       5.570511 51.99998 6.150548 58.53544 3.927907 -6.535458      7.297787 
1 1 1 -22 9  19 o 79.24940 3.615517 77.27319       6.963971 76.11871       9.436377 78.65399       10.31991 78.31738 4.970009 79.50002 5.358171 -1.182640      7.308281 
1 1 1 -22 9  20 o 95.59258 2.922611 112.0506       6.800187 121.7013       11.15833 106.3486       8.576972 99.16124 4.630439 92.92323 3.795672 6.238007       5.987327 
1 1 1 -22 9  21 o 21.72617 5.954886 6.082603       3.246006 9.000598       6.118017 4.939370       3.829444 26.59934 8.421470 20.22376 6.684486 6.375574       10.75191 
1 1 1 -22 9  22 o 17.34970 6.291367 3.182701       3.427996 2.848162       8.254056 3.252430       3.768355 22.58720 9.300678 17.84440 6.576307 4.742800       11.39080 
1 1 1 -22 9  23 o 55.72688 3.726610 38.45302       5.031663 49.53014       11.91626 36.04946       5.550780 61.59592 8.137630 53.81421 4.267656 7.781712       9.188792 
1 1 1 -22 9  24 o 50.93155 3.484899 32.11658       4.299209 35.03787       7.672796 30.77970       5.190543 52.37848 6.126875 49.63940 4.334347 2.739079       7.505009 
1 1 1 -22 9  25 o 81.51403 3.005492 81.84823       5.959912 94.55389       10.16464 75.19165       7.357308 86.89783 4.818937 77.83736 3.891115 9.060463       6.193781 
1 1 1 -22 9  26 o 57.22389 3.422073 40.59449       4.750226 36.57537       8.118986 42.68637       5.857403 53.18272 6.392632 58.45702 4.138559 -5.274300      7.615341 
1 1 1 -22 9  27 o 38.12389 4.258841 18.35182       3.889113 21.35895       7.113678 17.06985       4.644701 39.79739 7.612349 36.36856 5.404858 3.428829       9.335970 
1 1 1 -22 9  28 o 53.69173 5.210713 36.89140       6.732118 36.97879       10.66377 36.83350       8.680641 51.62049 8.792021 52.71918 6.924108 -1.098694      11.19120 
1 1 1 -22 9  29 o 40.61765 4.078931 20.87435       3.982765 19.47273       6.909093 21.57189       4.874087 37.47890 7.818156 40.93326 4.989266 -3.454361      9.274500 
1 1 1 -22 9  30 o 81.54878 3.738135 83.46185       7.408870 74.31953       9.925264 94.96665       11.13406 75.74297 5.412974 85.70897 5.357583 -9.966003      7.616034 
1 1 1 -22 9  31 o 33.52094 4.972410 14.71823       3.938867 13.45801       6.629886 15.40569       4.896740 30.21576 8.595764 33.70322 6.190147 -3.487459      10.59269 
1 1 1 -22 9  32 o 28.15861 5.877760 10.81884       3.902790 16.19564       6.484068 7.764233       4.887236 33.23856 8.083988 23.46258 7.537816 9.775980       11.05303 
1 1 1 -22 9  33 o 14.85168 6.065776 1.616507       3.474661 4.193986       5.669465 0.6597038E-01  4.397294 19.72083 7.855547 14.74343 6.447164 4.977408       10.16246 
1 1 1 -22 9  34 o 52.70153 4.394969 36.07199       5.593031 19.72424       10.82696 42.02246       6.532109 33.06762 11.24359 56.59221 4.781225 -23.52459      12.21795 
1 1 1 -22 9  35 o 52.17286 4.234972 35.43520       5.338068 30.60403       9.694468 37.53734       6.394816 43.39540 9.436814 53.04888 5.005894 -9.653484      10.68234 
1 1 1 -22 9  36 f 13.09784 5.788605 -0.1520201     3.632146 -7.785367      5.735888 4.957742       4.692924 12.25831 5.969960 19.25373 7.289330 -6.995420      9.422035 
1 1 1 -22 9  37 o 29.37203 7.062259 13.17458       4.992491 12.20407       6.589197 14.48267       7.649824 26.71198 8.765444 28.36418 9.450076 -1.652193      12.88941 
1 1 1 -22 9  38 o 26.66491 6.208217 10.53557       3.958398 14.42321       6.356428 8.072888       5.059113 29.08578 8.461228 22.43871 7.684545 6.647074       11.42999 
1 1 1 -22 9  39 o 16.75599 6.559999 3.566648       3.892064 5.882715       6.084428 1.962587       5.063543 19.98580 8.076684 16.18704 6.999694 3.798758       10.68778 
1 1 1 -22 10 1  o 64.00495 2.658053 50.16570       4.136825 49.75279       5.505204 50.70127       6.269792 63.61366 3.565567 64.13972 4.031741 -0.5260620     5.382211 
1 1 1 -22 10 2  o 114.8420 2.819087 161.2711       7.889423 170.2314       12.94586 155.9772       9.950710 117.5747 4.526819 112.7529 3.626230 4.821823       5.800141 
1 1 1 -22 10 3  o 83.38147 2.841437 85.10677       5.765125 86.42032       9.501860 84.34148       7.252614 83.69422 4.677441 82.88915 3.599126 0.8050690      5.901877 
1 1 1 -22 10 4  o 142.2538 3.261853 247.6734       11.30744 251.8958       16.50361 243.9375       15.52361 143.0297 4.741518 140.8141 4.529768 2.215622       6.557498 
1 1 1 -22 10 5  o 118.2137 2.753733 170.8049       7.932782 186.0708       13.51263 162.7768       9.799120 122.9784 4.516618 115.2404 3.493397 7.737999       5.709961 
1 1 1 -22 10 6  o 97.24350 2.699007 115.6501       6.389700 126.2132       11.03655 110.3242       7.836688 101.2662 4.483436 94.87267 3.395128 6.393478       5.623886 
1 1 1 -22 10 7  o 137.5572 3.205606 231.5126       10.74557 225.6860       15.69300 236.6562       14.74438 135.3956 4.763681 138.7646 4.365687 -3.369034      6.461569 
1 1 1 -22 10 8  o 113.6791 2.714315 157.9279       7.519293 156.7589       12.78380 158.5463       9.297731 112.8385 4.659097 113.7632 3.357489 -0.9246597     5.742814 
1 1 1 -22 10 9  o 30.47886 4.499572 11.65110       3.241630 6.572323       6.134438 13.61874       3.818283 24.15035 8.452112 32.92208 4.909158 -8.771723      9.774356 
1 1 1 -22 10 10 o 112.0244 2.683273 153.3629       7.325100 143.4946       12.31528 158.7655       9.112232 107.9324 4.693491 113.8492 3.287865 -5.916817      5.730525 
1 1 1 -22 10 11 o 120.4569 2.694204 177.3347       7.908572 188.6457       13.88369 171.9016       9.622293 123.7927 4.610341 118.4548 3.336744 5.337982       5.691143 
1 1 1 -22 10 12 o 57.75860 3.288860 40.96821       4.609984 36.80311       13.62322 41.50683       4.899000 52.73929 10.95839 58.11197 3.475316 -5.372681      11.49626 
1 1 1 -22 10 13 o 57.78926 3.489558 41.05881       4.891312 34.68747       8.020607 44.83144       6.171830 52.51242 6.399739 60.27325 4.228807 -7.760830      7.670689 
1 1 1 -22 10 14 o 176.1645 3.491380 380.2841       14.98827 352.0664       21.36670 407.6209       21.03053 168.8450 5.199131 181.8895 4.748738 -13.04448      7.041412 
1 1 1 -22 10 15 o 70.99654 3.053465 61.81033       5.270475 67.92688       9.037165 58.65766       6.488108 74.03862 5.038875 69.02324 3.872862 5.015381       6.355259 
1 1 1 -22 10 16 o 123.2523 3.008845 185.9714       9.037142 189.2903       14.13092 183.6745       11.75538 123.8454 4.690726 122.2182 3.952177 1.627235       6.133728 
1 1 1 -22 10 17 o 46.79878 4.453032 27.21369       5.017264 21.31313       7.132983 32.99178       7.058568 40.60892 7.483639 51.26495 5.749083 -10.65602      9.436992 
1 1 1 -22 10 18 o 110.5238 3.585569 150.1274       9.644396 148.4228       12.71024 152.4407       14.80710 109.5321 4.773315 110.7336 5.504502 -1.201462      7.285882 
1 1 1 -22 10 19 o 88.70045 2.940098 96.49433       6.346337 91.98923       10.31615 99.23743       8.049815 86.09060 4.938004 89.78720 3.686890 -3.696602      6.162552 
1 1 1 -22 10 20 o 36.16387 4.232535 16.34335       3.659546 10.50036       6.701561 18.82603       4.368370 28.50043 8.782790 38.73699 4.725295 -10.23656      9.973255 
1 1 1 -22 10 21 o 73.48432 3.338332 66.48470       5.962448 73.32265       13.01024 64.66669       6.708400 75.83325 7.123700 72.35487 3.818168 3.478378       8.082419 
1 1 1 -22 10 22 o 68.91289 3.143322 58.46004       5.264781 57.66233       8.886333 58.89148       6.535219 67.76238 5.426758 68.97763 3.903841 -1.215248      6.685034 
1 1 1 -22 10 23 o 12.09813 5.410733 -1.274051      3.270497 -21.29961      9.508766 1.412790       3.482995 14.37744 7.132334 15.15895 6.116252 -0.7815161     9.395677 
1 1 1 -22 10 24 o 61.75161 3.260738 47.09531       4.889431 45.72284       8.483945 47.77787       5.982951 59.94655 5.883308 61.99615 3.981221 -2.049599      7.103762 
1 1 1 -22 10 25 o 38.28336 4.166009 18.41236       3.823958 19.36824       6.901066 17.98883       4.593660 38.01620 7.713228 37.53978 5.157667 0.4764214      9.278761 
1 1 1 -22 10 26 o 29.46201 5.307893 11.25746       3.670694 10.73425       6.611263 11.49063       4.413458 28.13871 8.732332 29.44959 6.337778 -1.310883      10.78986 
1 1 1 -22 10 27 o 68.14782 3.579845 57.79296       5.924156 52.77966       12.08212 59.37974       6.797342 62.50745 8.123869 68.87182 4.068182 -6.364368      9.085557 
1 1 1 -22 10 28 o 66.95551 3.937881 56.19260       6.396807 55.73838       8.725369 56.72044       9.405805 65.83050 5.488922 66.14722 5.896861 -0.3167267     8.056130 
1 1 1 -22 10 29 f 42.49182 4.908878 23.25226       4.989690 20.15224       7.092902 26.28943       7.020629 37.95675 7.924575 44.23956 6.723575 -6.282810      10.39256 
1 1 1 -22 10 30 o 25.74630 5.702142 8.928103       3.483183 7.181354       6.477890 9.638535       4.131232 23.53220 8.630763 26.48560 6.459544 -2.953396      10.78034 
1 1 1 -22 10 31 o 15.96686 6.145528 2.576852       3.371412 -0.1270133     6.225130 3.699084       4.010489 17.17027 7.583772 18.01746 6.756471 -0.8471870     10.15694 
1 1 1 -22 10 32 o 9.557191 4.629691 -4.999331      3.328993 -1.749112      5.965119 -6.469489      4.011852 15.74643 7.150092 10.23321 4.985737 5.513217       8.716730 
1 1 1 -22 10 33 o 49.56030 3.782460 31.33653       4.533681 24.10431       7.200441 36.08703       5.835699 40.86239 7.507590 52.65702 4.593732 -11.79464      8.801494 
1 1 1 -22 10 34 o 30.48878 6.084191 13.00500       4.361930 9.692393       8.564113 14.16534       5.068633 25.18048 9.767060 31.35122 6.828181 -6.170740      11.91719 
1 1 1 -22 10 35 o 28.35118 5.802935 11.28306       3.874024 13.21072       6.160707 10.02227       4.982381 28.84986 8.311369 25.65281 7.499218 3.197046       11.19451 
1 1 1 -22 10 36 o 16.62220 6.471514 3.229342       3.770695 5.730230       6.199651 1.761068       4.750329 20.55486 8.205729 16.11533 6.870544 4.439526       10.70226 
1 1 1 -22 10 37 o 10.85752 5.236946 -4.963298      4.146902 -0.6653970     5.708527 -9.765623      6.034227 15.31079 6.968822 11.87641 5.852793 3.434372       9.100532 
1 1 1 -22 10 38 o 32.67488 5.536679 15.17991       4.251334 14.79130       6.781111 15.43157       5.456939 28.89970 8.821570 31.33855 7.284310 -2.438843      11.44034 
1 1 1 -22 11 1  o 101.1760 3.032266 125.4228       7.467767 117.0234       13.48917 129.1347       8.967332 97.03220 5.730217 102.5493 3.593903 -5.517090      6.763988 
1 1 1 -22 11 2  o 77.68864 2.935016 73.95246       5.546544 67.74255       8.914907 77.87439       7.084740 73.95750 4.975457 79.60307 3.662040 -5.645569      6.177840 
1 1 1 -22 11 3  o 63.19814 3.152370 49.01217       4.839544 46.36639       8.054068 50.50727       6.054442 61.02430 5.474066 64.03872 3.898140 -3.014416      6.720186 
1 1 1 -22 11 4  o 140.9172 2.899252 242.8869       9.956023 253.3253       16.55064 236.9677       12.46317 143.3768 4.743490 138.9781 3.683231 4.398788       6.005571 
1 1 1 -22 11 5  o 114.8496 3.156564 161.5568       8.826089 162.6312       13.01429 160.6417       12.01005 114.8816 4.658388 114.2651 4.320940 0.6164932      6.353826 
1 1 1 -22 11 6  o 108.2420 2.736228 143.3203       7.211669 142.1209       12.20532 143.9637       8.938918 107.3838 4.675375 108.3713 3.388977 -0.9875336     5.774452 
1 1 1 -22 11 7  o 174.9928 3.094745 374.6878       13.19718 392.6069       22.09482 364.7491       16.45493 178.4238 5.086806 172.4395 3.915825 5.984314       6.419446 
1 1 1 -22 11 8  o 183.4652 3.162040 411.9220       14.13700 412.8793       23.19535 411.3562       17.83162 182.9235 5.208800 183.1004 3.996368 -0.1768951     6.565254 
1 1 1 -22 11 9  o 85.96738 2.742149 90.43798       5.737265 98.59331       10.32422 86.79430       6.900922 89.38554 4.756862 84.12219 3.373199 5.263344       5.831484 
1 1 1 -22 11 10 o 29.78378 4.760891 11.18159       3.339140 19.08598       6.715737 8.585729       3.848579 38.49539 7.428048 25.81811 6.196075 12.67729       9.673017 
1 1 1 -22 11 11 o 68.68501 3.243379 57.88466       5.413363 63.65960       8.743643 54.29519       6.893401 71.69704 5.036475 66.34126 4.286917 5.355782       6.613905 
1 1 1 -22 11 12 o 53.02426 4.017433 34.71064       5.152472 41.22496       13.72905 33.64270       5.558794 55.96459 10.45104 52.12577 4.417714 3.838821       11.34638 
1 1 1 -22 11 13 f 116.9112 3.038010 167.4040       8.647956 177.6161       13.93728 161.0108       11.02755 119.9761 4.776569 114.4486 3.959929 5.527519       6.204567 
1 1 1 -22 11 14 o 60.47413 2.896177 44.85236       4.255658 52.95074       8.778149 42.36417       4.865698 65.17844 5.580302 58.69268 3.416701 6.485760       6.543211 
1 1 1 -22 11 15 o 19.82339 5.671670 4.988768       2.878317 -5.642005      6.121390 8.006335       3.261341 14.74662 6.888453 24.95768 5.509939 -10.21106      8.821010 
1 1 1 -22 11 16 f 91.19533 2.951347 101.9377       6.550231 108.8187       11.00215 98.15948       8.152534 93.76669 4.831250 89.32336 3.753708 4.443321       6.118113 
1 1 1 -22 11 17 o 89.98209 4.885104 100.3511       10.67171 100.3511       10.67171 0.000000       0.000000 89.98209 4.885104 ?        ?        0.000000       4.885104 
1 1 1 -22 11 18 o 24.23697 5.653530 7.587725       3.277635 10.02883       6.395232 6.718100       3.817063 27.93342 8.574588 22.87734 6.526870 5.056078       10.77607 
1 1 1 -22 11 19 o 19.73069 6.115284 4.862842       3.243496 -7.855775      6.253644 9.543274       3.793641 13.91207 6.635612 27.16028 5.900823 -13.24820      8.879812 
1 1 1 -22 11 20 o 134.5484 3.467000 222.7216       11.35812 218.6068       21.94220 224.2278       13.27504 131.4635 6.873057 134.7685 4.046725 -3.305008      7.975894 
1 1 1 -22 11 21 o 103.8896 2.975111 132.5756       7.524263 140.3994       12.62659 128.2676       9.369561 106.1930 4.892406 101.9346 3.778451 4.258400       6.181612 
1 1 1 -22 11 22 o 65.89044 3.122034 53.48054       4.998724 61.22805       9.000518 50.02495       6.011005 69.81156 5.330907 63.52592 3.901758 6.285645       6.606231 
1 1 1 -22 11 23 o 33.96228 5.027258 14.69311       4.035177 21.84246       10.94807 13.56921       4.340775 39.34077 10.99559 32.41624 5.703158 6.924522       12.38665 
1 1 1 -22 11 24 o 13.14163 5.663246 -0.1284118     3.292254 5.453233       6.827517 -1.819462      3.758027 23.00288 8.772535 12.62789 5.710502 10.37499       10.46744 
1 1 1 -22 11 25 o 35.69006 4.675620 16.18522       3.968821 10.43174       6.913297 19.01357       4.847144 27.90555 8.965120 38.51746 5.304802 -10.61191      10.41702 
1 1 1 -22 11 26 o 112.4279 3.425245 156.6712       9.373352 138.6946       17.76781 163.6035       11.03363 102.9077 7.129234 114.5661 3.958027 -11.65839      8.154260 
1 1 1 -22 11 27 o 17.21435 6.235627 3.322316       3.366344 2.924895       6.279963 3.482558       3.987665 19.95546 8.153026 18.06883 6.745054 1.886625       10.58147 
1 1 1 -22 11 28 o 26.38010 8.781699 9.575568       6.606267 9.575568       6.606267 0.000000       0.000000 26.38010 8.781699 ?        ?        0.000000       8.781699 
1 1 1 -22 11 29 o 37.93707 5.329182 18.83126       4.791098 8.638389       6.449841 31.37956       7.156377 25.11583 8.673882 48.61185 6.180631 -23.49602      10.65065 
1 1 1 -22 11 30 f 34.61816 4.587433 15.52669       3.774826 13.16458       6.555101 16.69864       4.617255 29.90876 8.559793 35.47315 5.520871 -5.564390      10.18578 
1 1 1 -22 11 31 o 14.41221 5.921684 1.337404       3.336622 -2.566253      5.764868 3.303843       4.091606 15.05801 6.910057 17.57963 6.769160 -2.521620      9.673180 
1 1 1 -22 11 32 o 34.38280 4.841429 15.57178       3.944314 9.427469       6.431265 19.27634       4.993766 25.27456 8.663958 37.88124 5.576309 -12.60668      10.30337 
1 1 1 -22 11 33 o 27.06446 6.585905 10.44734       4.301795 0.1062442      9.767325 12.93601       4.791546 20.20733 9.165257 30.11967 6.701018 -9.912340      11.35366 
1 1 1 -22 11 34 o 23.32921 6.894485 7.961932       4.191876 0.6705574      8.314124 10.44720       4.853988 19.05110 8.565210 26.45284 7.294488 -7.401735      11.25044 
1 1 1 -22 11 35 o 19.00405 6.621867 5.017619       3.762952 8.059811       6.178427 3.223734       4.744407 22.94418 8.426618 17.53812 7.115873 5.406059       11.02921 
1 1 1 -22 11 36 o 12.46654 5.626257 -0.8289666     3.626615 0.1308471      5.855343 -1.426325      4.619301 16.03690 7.200812 13.56314 6.209665 2.473756       9.508503 
1 1 1 -22 11 37 o 36.79079 6.188919 19.66836       5.351917 19.17201       7.035419 20.35010       8.245245 33.80370 8.539277 33.40322 9.612771 0.4004707      12.85786 
1 1 1 -22 11 38 o 19.28281 6.781813 5.557223       3.952670 -1.720320      6.268955 10.35957       5.092484 15.14310 7.039169 25.10864 7.640797 -9.965538      10.38902 
1 1 1 -22 12 1  o 92.03851 3.065109 103.8749       6.865077 88.85820       12.44455 110.4438       8.230783 84.31273 6.098100 94.80142 3.569163 -10.48869      7.065815 
1 1 1 -22 12 2  o 64.04323 3.181841 50.36941       4.950234 53.04090       8.350798 48.92207       6.146609 65.28259 5.294623 62.96510 4.027003 2.317482       6.652051 
1 1 1 -22 12 3  o 90.73469 2.823629 100.8236       6.235742 104.7655       10.38762 98.60270       7.796911 92.09966 4.643282 89.59083 3.578471 2.508827       5.862212 
1 1 1 -22 12 4  f 61.25102 3.108430 46.05110       4.624537 56.08920       8.214738 41.39386       5.595415 67.23521 5.050647 57.92058 3.988624 9.314636       6.435694 
1 1 1 -22 12 5  o 146.8270 3.316087 264.0982       11.86500 270.5662       17.45275 258.5400       16.17887 148.0863 4.842806 144.8465 4.589363 3.239853       6.671958 
1 1 1 -22 12 6  o 66.26200 3.001776 53.84042       4.834478 52.82172       8.505227 54.32665       5.876044 65.16750 5.404290 66.46188 3.641995 -1.294388      6.516937 
1 1 1 -22 12 7  o 69.91151 2.901575 59.89627       4.932573 47.56253       8.441091 66.29167       6.078341 61.75361 5.672511 73.47850 3.403849 -11.72489      6.615404 
1 1 1 -22 12 8  o 115.9944 3.139383 164.8361       8.865796 162.9737       13.22371 166.3568       11.94919 114.9396 4.731261 116.2729 4.224220 -1.333237      6.342622 
1 1 1 -22 12 9  o 106.0993 3.107442 137.9214       8.025714 151.4006       12.52076 128.5206       10.45632 110.7962 4.647670 102.1798 4.208314 8.616386       6.269828 
1 1 1 -22 12 10 o 82.31577 3.858090 83.34560       7.717587 87.19514       10.15131 78.07327       11.88008 83.93853 4.985229 79.06680 6.215741 4.871727       7.967932 
1 1 1 -22 12 11 o 35.11612 4.074074 15.34876       3.421728 11.57344       6.716280 16.67217       3.976489 29.91272 8.696177 36.52423 4.567245 -6.611513      9.822587 
1 1 1 -22 12 12 o 149.4442 3.226324 273.5972       11.74960 283.4128       27.78671 271.4601       12.96580 150.0839 7.622393 148.7677 3.576469 1.316223       8.419739 
1 1 1 -22 12 13 o 29.66765 4.615114 11.09513       3.228134 13.87134       7.271204 10.41360       3.602644 32.51859 8.912385 28.56675 5.372310 3.951841       10.40636 
1 1 1 -22 12 14 o 42.12652 3.466520 21.91262       3.527192 18.18965       7.465293 22.98257       4.002069 37.21248 8.428576 43.08430 3.852401 -5.871819      9.267248 
1 1 1 -22 12 15 o 100.9530 2.667982 124.7824       6.557788 139.1308       12.35610 119.1560       7.737446 106.0418 4.793939 98.53820 3.226583 7.503639       5.778641 
1 1 1 -22 12 16 o 105.9276 3.063288 137.6225       7.899080 134.0090       12.44889 140.0578       10.21998 103.9852 4.926741 106.6333 3.939749 -2.648094      6.308280 
1 1 1 -22 12 17 o 30.56956 6.241910 12.07487       4.492456 22.13982       6.849176 4.475177       5.951555 41.44330 7.032999 21.64384 8.205482 19.79946       10.80708 
1 1 1 -22 12 18 o 36.45649 4.407732 16.64312       3.836445 14.11245       8.809456 17.23539       4.261804 32.70262 10.06833 37.00848 4.841576 -4.305862      11.17194 
1 1 1 -22 12 19 o 117.6176 3.314689 170.0995       9.491133 172.5520       18.76466 169.2563       11.00228 116.9040 6.613786 117.1371 3.859627 -0.2330856     7.657603 
1 1 1 -22 12 20 o 90.95005 2.975463 101.6337       6.585802 108.7802       11.25775 97.91554       8.120271 93.41510 4.963180 89.05093 3.750329 4.364174       6.220781 
1 1 1 -22 12 21 o 43.69949 3.775727 23.73344       3.981403 23.37814       7.732732 23.86161       4.644312 42.08422 7.828143 43.65995 4.426275 -1.575733      8.992871 
1 1 1 -22 12 22 o 88.21178 2.970310 95.74323       6.375945 107.7960       11.02610 89.68833       7.815065 92.84769 4.890450 85.11720 3.777132 7.730499       6.179258 
1 1 1 -22 12 23 o 57.79107 3.708936 41.46547       5.195741 31.80357       12.80490 43.36976       5.684750 47.11052 11.29939 59.02777 3.975198 -11.91724      11.97825 
1 1 1 -22 12 24 o 54.12241 3.577046 36.39087       4.691327 33.51928       8.163683 37.80672       5.732361 50.69539 6.777843 54.93260 4.316864 -4.237206      8.035825 
1 1 1 -22 12 25 o 30.46874 5.538633 12.09988       3.960944 20.67823       9.026446 10.05411       4.408018 38.14726 9.692052 27.39939 6.666298 10.74787       11.76331 
1 1 1 -22 12 26 o 59.83346 3.438428 44.54095       4.992377 42.41595       8.406043 45.69893       6.205285 57.12226 6.134816 60.28369 4.251282 -3.161423      7.463871 
1 1 1 -22 12 27 o 80.48811 3.127670 80.36304       6.122959 70.70039       9.923444 86.30325       7.780641 74.09254 5.536085 83.03455 3.855741 -8.942009      6.746478 
1 1 1 -22 12 28 f 63.87033 5.658980 53.10332       8.716866 53.10332       8.716866 0.000000       0.000000 63.87033 5.658980 ?        ?        0.000000       5.658980 
1 1 1 -22 12 29 o 14.83408 5.913326 1.780499       3.214904 -1.296606      6.138134 2.943721       3.773953 16.44496 7.379252 16.95554 6.508241 -0.5105762     9.839235 
1 1 1 -22 12 30 o 23.37651 6.131414 7.523823       3.535432 0.8172975      6.042017 11.01563       4.359716 17.58109 7.624218 28.18402 6.482914 -10.60293      10.00784 
1 1 1 -22 12 31 o 13.75430 5.828874 0.6744368      3.383952 4.457264       5.532685 -1.586464      4.277287 19.95500 7.818712 13.37232 6.065156 6.582675       9.895370 
1 1 1 -22 12 32 o 18.84924 6.387432 4.729110       3.493932 -3.548014      5.988645 9.000422       4.301991 14.69711 6.848056 25.05485 6.850641 -10.35773      9.686441 
1 1 1 -22 12 33 o 12.66005 5.792321 -1.762128      4.010342 0.000000       0.000000 -1.762128      4.010342 ?        ?        12.66005 5.792321 0.000000       5.792321 
1 1 1 -22 12 34 o 17.22779 6.450359 3.664240       3.652369 3.847218       5.943245 3.553202       4.629787 19.11996 7.884481 17.86006 7.103897 1.259899       10.61275 
1 1 1 -22 12 35 o 41.99276 4.574049 23.50388       4.605142 17.76801       7.214989 27.44707       5.982187 32.67789 8.845750 44.45895 5.648966 -11.78106      10.49562 
1 1 1 -22 12 36 f 24.67375 6.603683 9.165730       4.048831 13.52684       6.686169 6.640574       5.087720 28.03826 8.794070 20.95317 7.654587 7.085083       11.65883 
1 1 1 -22 12 37 o 30.10473 7.380043 14.32277       5.371623 8.809340       7.029315 22.06158       8.327975 22.83634 8.851201 34.82434 9.535553 -11.98800      13.01040 
1 1 1 -22 12 38 o 22.85177 6.686932 8.104229       3.959800 5.040790       6.613249 9.816392       4.944048 19.50516 8.200971 24.46807 7.544354 -4.962914      11.14330 
1 1 1 -22 13 1  o 91.98017 3.615880 104.0800       8.089047 0.000000       0.000000 104.0800       8.089047 ?        ?        91.98017 3.615880 0.000000       3.615880 
1 1 1 -22 13 2  o 107.8034 3.051595 142.5021       8.008633 126.3824       14.98192 148.9510       9.476159 100.5432 6.144087 110.0993 3.536515 -9.556076      7.089199 
1 1 1 -22 13 3  o 122.8606 3.263863 185.1805       9.763284 192.1561       23.17541 183.6754       10.76518 123.2398 7.756193 122.2652 3.617098 0.9746246      8.558149 
1 1 1 -22 13 4  o 14.75932 5.939720 1.286917       3.275652 5.375879       6.077014 -0.3876540     3.888979 22.73052 8.355658 14.17765 6.132576 8.552869       10.36463 
1 1 1 -22 13 5  o 26.95588 7.043600 9.425733       4.677180 13.76331       6.497535 4.761037       6.738084 32.40070 8.218149 22.77406 8.707641 9.626633       11.97334 
1 1 1 -22 13 6  o 90.96016 3.172710 101.4818       7.021860 107.2181       10.76633 97.23538       9.263150 93.11927 4.760314 88.78954 4.293883 4.329727       6.410774 
1 1 1 -22 13 7  o 112.3597 3.600524 155.0527       9.845806 157.0072       12.93054 152.3558       15.18858 112.7484 4.716612 110.7399 5.646941 2.008545       7.357606 
1 1 1 -22 13 8  o 14.05445 5.898533 0.4199377      3.411519 5.170438       5.860444 -2.014999      4.195703 22.34009 8.206550 13.47202 6.068365 8.868071       10.20649 
1 1 1 -22 13 9  o 148.3809 2.916009 269.4991       10.54394 271.5958       17.78868 268.3635       13.09158 148.2481 4.930865 147.8810 3.632817 0.3671112      6.124605 
1 1 1 -22 13 10 o 117.8679 2.768495 169.9880       7.951979 171.5867       13.92127 169.2138       9.688045 117.8129 4.859407 117.4288 3.389065 0.3840256      5.924491 
1 1 1 -22 13 11 o 119.3569 3.229015 174.7173       9.383275 163.1200       14.02928 184.1044       12.62193 114.7912 5.027420 122.2368 4.243722 -7.445526      6.579067 
1 1 1 -22 13 12 o 85.67728 3.029599 90.02245       6.315429 93.38885       17.51663 89.51947       6.770806 85.41335 8.529617 85.39387 3.259686 0.1947784E-01  9.131261 
1 1 1 -22 13 13 o 64.88845 2.928542 51.66684       4.618854 40.37632       9.026041 55.67228       5.376080 56.45945 6.690180 67.30122 3.287934 -10.84176      7.454463 
1 1 1 -22 13 14 f 151.9675 2.928371 282.8760       10.84459 296.4627       19.08588 276.3982       13.17864 154.6854 5.070068 150.0143 3.604971 4.671082       6.221046 
1 1 1 -22 13 15 o 59.77946 2.968601 43.89474       4.311011 41.00156       8.688475 44.83964       4.965333 56.94526 6.370106 60.34801 3.389992 -3.402756      7.215976 
1 1 1 -22 13 16 o 22.90454 5.322284 6.768949       2.913918 8.442146       6.470117 6.343227       3.263635 26.14416 8.690390 22.16822 5.926984 3.975943       10.51913 
1 1 1 -22 13 17 o 68.81310 4.398379 58.73388       7.337030 67.44377       12.35680 53.99102       9.118417 72.79296 7.054271 65.54568 5.767485 7.247284       9.111895 
1 1 1 -22 13 18 o 60.91457 3.486258 45.78402       5.153464 51.54327       11.89023 44.45188       5.718498 63.10610 7.904779 59.91525 3.938432 3.190845       8.831578 
1 1 1 -22 13 19 o 85.56433 2.970851 89.97342       6.185152 91.38171       10.74223 89.27499       7.564961 85.49586 5.180312 85.04408 3.658843 0.4517899      6.342141 
1 1 1 -22 13 20 o 66.57954 3.152636 54.61657       5.100529 68.46033       9.572732 49.12830       6.027359 73.82477 5.357510 62.93646 3.949882 10.88831       6.656161 
1 1 1 -22 13 21 o 80.75359 3.071016 80.31180       6.032368 70.60374       10.38960 85.24890       7.409154 74.70787 5.751085 83.01440 3.671596 -8.306526      6.823166 
1 1 1 -22 13 22 o 60.58992 3.314290 45.39462       4.874948 44.30103       8.899561 45.86343       5.826911 58.74542 6.315762 60.71468 3.959906 -1.969261      7.454509 
1 1 1 -22 13 23 o 26.32644 6.024966 9.134480       3.781497 12.33724       11.51750 8.747516       4.003430 31.07874 11.48933 25.68465 6.415518 5.394087       13.15916 
1 1 1 -22 13 24 o 29.46963 5.132169 11.23386       3.551782 11.65055       7.043122 11.09176       4.113078 29.14289 9.007853 29.00056 6.017381 0.1423359      10.83283 
1 1 1 -22 13 25 o 56.64696 3.477224 39.94047       4.776916 42.59472       8.365397 38.65620       5.818926 57.30590 6.083151 55.39947 4.344980 1.906437       7.475532 
1 1 1 -22 13 26 o 13.86398 5.804145 0.7056686      3.290669 10.27143       6.309372 -2.868657      3.856768 27.23498 8.542763 11.98280 5.553271 15.25218       10.18909 
1 1 1 -22 13 27 o 23.36826 7.355243 7.389287       4.673223 15.48603       6.908502 0.5590127      6.345236 32.87941 8.545100 18.06648 7.824018 14.81293       11.58594 
1 1 1 -22 13 28 o 53.87178 3.784660 36.58281       4.936875 29.57117       7.924654 41.02998       6.311200 46.41035 7.243440 56.61883 4.614170 -10.20847      8.588246 
1 1 1 -22 13 29 o 21.87611 6.298275 6.559755       3.538827 11.86075       6.342779 4.163801       4.264223 28.40269 8.502334 18.81483 6.984406 9.587868       11.00325 
1 1 1 -22 13 30 o 17.37060 6.335398 3.595018       3.483101 -6.533751      5.968524 8.825983       4.289232 13.43339 6.427807 25.00644 6.841720 -11.57305      9.387536 
1 1 1 -22 13 31 o 13.98320 5.885093 0.8933620      3.410913 3.554583       5.885049 -0.4528213     4.185638 19.32609 7.893798 14.01181 6.202251 5.314284       10.03892 
1 1 1 -22 13 32 o 26.60006 6.753621 10.17253       4.384986 7.860120       8.576934 10.99084       5.102202 23.99701 9.627253 27.26527 7.462896 -3.268259      12.18108 
1 1 1 -22 13 33 o 12.72049 5.810640 -1.616021      4.014559 -14.76858      11.13730 0.3481218      4.303890 16.28640 8.011506 14.63222 6.388850 1.654181       10.24703 
1 1 1 -22 13 34 o 29.38050 5.822710 12.16021       4.021492 11.77200       6.607157 12.38866       5.068469 26.76509 8.777079 28.62421 7.257307 -1.859119      11.38884 
1 1 1 -22 13 35 o 30.96041 5.740544 13.57681       4.171637 14.25643       6.733440 13.15346       5.314424 28.99697 8.778177 29.06419 7.464801 -0.6721497E-01 11.52301 
1 1 1 -22 13 36 o 27.61813 6.017846 11.11673       3.935403 20.53580       6.596904 5.912740       4.903479 36.03644 7.742962 20.02975 7.479091 16.00670       10.76523 
1 1 1 -22 13 37 o 12.81713 5.870400 -1.242507      4.133706 -5.083153      5.658245 3.153675       6.053651 12.92860 6.205375 17.91119 7.698557 -4.982592      9.888097 
1 1 1 -22 14 1  o 99.62047 4.353225 122.7236       10.54256 0.000000       0.000000 122.7236       10.54256 ?        ?        99.62047 4.353225 0.000000       4.353225 
1 1 1 -22 14 2  o 54.15845 4.094000 36.33426       5.363175 30.71851       9.160078 39.26352       6.615679 48.63059 8.008035 56.12203 4.885974 -7.491444      9.380904 
1 1 1 -22 14 3  o 60.16900 3.657586 44.64889       5.337614 36.34155       8.156114 50.87199       7.059200 53.57510 6.371868 64.03653 4.553381 -10.46143      7.831601 
1 1 1 -22 14 4  o 20.92603 7.302637 4.989342       4.577395 8.067299       12.39629 4.503407       4.925489 29.76995 11.69176 20.66930 7.534539 9.100647       13.90923 
1 1 1 -22 14 5  o 45.84201 3.631474 25.96886       4.023670 29.44764       7.382100 24.49854       4.799233 48.15934 6.452385 44.34747 4.503236 3.811878       7.868443 
1 1 1 -22 14 6  o 85.58695 3.295817 89.96606       6.861109 94.44460       10.40428 86.51974       9.126877 87.27802 4.911644 83.64357 4.494187 3.634453       6.657474 
1 1 1 -22 14 7  o 83.41902 2.814994 85.28500       5.714209 95.46900       10.25554 80.69990       6.881356 87.78604 4.812396 81.01457 3.493791 6.771469       5.946909 
1 1 1 -22 14 8  o 86.89079 2.804979 92.51939       5.931576 75.95414       10.11609 101.1986       7.322414 78.11706 5.346343 90.77818 3.315637 -12.66113      6.291012 
1 1 1 -22 14 9  f 90.38750 2.753456 100.0901       6.057814 107.3882       11.13764 97.02410       7.219015 93.07991 4.927779 88.87696 3.339070 4.202950       5.952512 
1 1 1 -22 14 10 o 20.77980 5.986938 5.499768       3.196531 5.326236       6.581401 5.553342       3.656813 23.10118 8.656840 21.05980 6.487407 2.041388       10.81792 
1 1 1 -22 14 11 o 65.75759 2.945820 53.07423       4.708518 48.08136       8.832170 55.05665       5.565321 61.88282 5.929255 66.89178 3.425548 -5.008961      6.847660 
1 1 1 -22 14 12 o 70.95889 2.922039 61.78595       5.041952 51.19880       9.881066 65.51290       5.862612 63.68596 6.455936 73.00064 3.304119 -9.314686      7.252331 
1 1 1 -22 14 13 o 41.83286 5.752814 22.16188       5.709405 19.66637       7.795605 25.04917       8.385235 38.57889 8.519938 43.77413 8.160855 -5.195244      11.79783 
1 1 1 -22 14 14 o 36.31458 3.901189 16.41560       3.398275 18.62436       7.787752 15.89611       3.776820 37.44455 8.700930 35.61515 4.448394 1.829407       9.772122 
1 1 1 -22 14 15 o 140.2967 3.092371 241.4771       10.57244 223.1574       22.24047 246.8255       12.01705 132.9240 6.889521 141.7132 3.479779 -8.789200      7.718443 
1 1 1 -22 14 16 o 110.9259 3.323209 151.3172       8.972978 142.8897       17.33845 154.3999       10.48647 106.2841 6.728851 111.8748 3.852205 -5.590706      7.753510 
1 1 1 -22 14 17 o 65.05595 4.177905 52.50306       6.588398 38.69408       9.287210 66.49306       9.347888 54.83906 7.117322 72.86806 5.300540 -18.02900      8.874232 
1 1 1 -22 14 18 o 63.54550 2.843294 49.64230       4.391788 47.90572       9.239620 50.14916       4.991733 61.38412 6.264499 63.78971 3.221610 -2.405586      7.044340 
1 1 1 -22 14 19 o 93.68802 2.993535 107.9464       6.825692 115.1259       11.80836 104.3438       8.364723 95.94051 5.068684 91.87008 3.744142 4.070427       6.301599 
1 1 1 -22 14 20 o 48.46718 3.605519 29.15063       4.227946 23.33813       8.206630 31.25079       4.932976 41.69514 8.368040 50.06817 4.078363 -8.373028      9.308982 
1 1 1 -22 14 21 o 39.95611 4.063867 19.99671       3.901932 6.325442       7.574818 24.93460       4.552383 24.36702 9.252642 44.61090 4.238420 -20.24388      10.17721 
1 1 1 -22 14 22 o 50.84533 3.816717 32.21870       4.694568 27.22865       10.89739 33.35583       5.202034 43.79169 10.37236 51.62970 4.170093 -7.838001      11.17924 
1 1 1 -22 14 23 o 64.04297 3.618893 50.99498       5.624871 36.42287       13.08241 54.29974       6.230131 50.08325 11.01891 65.98985 3.891493 -15.90660      11.68589 
1 1 1 -22 14 24 o 22.83494 6.161731 6.936880       3.507499 -6.858381      6.756264 12.02667       4.103852 14.80810 7.015143 30.24179 5.779250 -15.43370      9.089112 
1 1 1 -22 14 25 o 44.58083 3.936888 25.00282       4.233074 20.08084       7.644392 27.17956       5.083652 37.82759 8.500448 46.24940 4.570273 -8.421810      9.651167 
1 1 1 -22 14 26 o 13.97272 6.156944 -0.6279747     4.080244 -4.109512      6.015993 2.337778       5.552508 14.86289 6.904402 18.52326 7.627870 -3.660371      10.28859 
1 1 1 -22 14 27 o 20.68876 7.059469 5.535642       4.268733 8.125486       6.445951 3.512668       5.696988 24.55798 8.658552 19.58142 7.849479 4.976563       11.68695 
1 1 1 -22 14 28 o 27.70253 5.782106 10.37144       3.777069 11.48295       6.889524 9.893801       4.516268 27.93022 8.947386 26.59200 6.907970 1.338217       11.30379 
1 1 1 -22 14 29 o 43.01802 4.110186 23.68273       4.256391 16.80673       7.187644 27.39626       5.282162 33.47398 8.724195 45.91391 4.791404 -12.43993      9.953347 
1 1 1 -22 14 30 o 42.07059 4.350567 22.87131       4.395986 19.06347       7.499702 24.86436       5.425808 35.46258 8.736299 43.34493 5.243207 -7.882347      10.18892 
1 1 1 -22 14 31 o 45.67855 4.014196 26.81745       4.422949 26.58024       7.379435 26.95044       5.525382 43.08591 7.287924 45.08027 5.120277 -1.994358      8.906799 
1 1 1 -22 14 32 f 37.80533 5.055534 19.12902       4.540895 8.079732       8.531016 23.49711       5.363888 23.88812 9.595277 41.69536 5.406204 -17.80724      11.01346 
1 1 1 -22 14 33 o 30.52186 6.330321 13.33825       4.553821 14.66948       10.49765 13.02968       5.054119 28.23790 10.85053 29.59591 7.099094 -1.358013      12.96654 
1 1 1 -22 14 34 o 32.96164 5.445380 15.08345       4.221346 18.65882       6.783266 12.82359       5.392866 34.17245 8.241829 28.68996 7.595370 5.482489       11.20792 
1 1 1 -22 14 35 f 18.36205 6.512555 4.743257       3.651099 5.830975       5.816859 4.036131       4.690065 20.28620 7.996238 18.02768 7.156660 2.258522       10.73115 
1 1 1 -22 14 36 f 10.43374 4.977005 -3.525232      3.519730 -4.457548      5.752371 -2.967296      4.449977 13.35766 6.369211 12.29068 5.783106 1.066985       8.602974 
1 1 1 -22 15 1  o 82.89288 3.141296 84.47835       6.333965 83.42660       12.09188 84.87607       7.435723 81.35727 6.144454 82.94820 3.687799 -1.590927      7.166183 
1 1 1 -22 15 2  o 115.0047 3.601985 162.8527       10.08226 0.000000       0.000000 162.8527       10.08226 ?        ?        115.0047 3.601985 0.000000       3.601985 
1 1 1 -22 15 3  o 36.77584 4.765614 17.00960       4.170551 4.446528       8.491929 21.00299       4.787725 24.04172 9.601676 40.89282 4.902059 -16.85110      10.78065 
1 1 1 -22 15 4  o 102.0266 2.861056 127.6512       7.106354 134.5534       12.35530 124.2390       8.687088 104.1201 4.883080 100.4779 3.553465 3.642281       6.039171 
1 1 1 -22 15 5  o 55.00843 3.348013 37.28421       4.466743 35.55802       8.263905 37.99667       5.309107 52.88882 6.551873 55.41224 3.957751 -2.523415      7.654465 
1 1 1 -22 15 6  o 17.33320 6.713278 2.510766       4.041450 1.239452       6.757740 3.218647       5.042604 19.80540 8.306292 19.37832 7.500609 0.4270821      11.19168 
1 1 1 -22 15 7  o 91.61819 2.820188 102.9121       6.288955 92.56575       10.93026 108.0324       7.689218 86.23108 5.226059 93.74843 3.371240 -7.517349      6.219080 
1 1 1 -22 15 8  o 33.14412 4.232018 13.75510       3.340274 17.12748       6.781825 12.67496       3.838100 36.09641 7.927258 31.58691 5.164546 4.509491       9.461182 
1 1 1 -22 15 9  o 68.74304 2.927185 58.01130       4.892375 75.60158       9.663203 51.94828       5.673216 77.93311 5.116486 64.91788 3.600254 13.01522       6.256217 
1 1 1 -22 15 10 o 111.8266 2.758747 153.1543       7.517839 156.2820       13.35256 151.7026       9.096664 112.2454 4.893329 111.1072 3.363600 1.138252       5.937884 
1 1 1 -22 15 11 o 55.55185 3.153747 37.97932       4.251810 49.97882       8.723720 34.24086       4.869299 63.08893 5.736980 52.61124 3.824080 10.47769       6.894674 
1 1 1 -22 15 12 o 77.61185 3.271503 74.08254       6.173570 71.87165       10.30372 75.32074       7.710892 75.75951 5.621162 78.06240 4.067498 -2.302895      6.938444 
1 1 1 -22 15 13 o 46.59475 3.943034 26.94086       4.435177 0.000000       0.000000 26.94086       4.435177 ?        ?        46.59475 3.943034 0.000000       3.943034 
1 1 1 -22 15 14 o 113.0004 3.610571 157.3041       9.929660 164.5480       18.52414 154.3834       11.76231 114.0797 6.692766 111.6783 4.330235 2.401398       7.971452 
1 1 1 -22 15 15 o 64.69866 3.408155 51.62095       5.354467 45.15910       11.02973 53.61336       6.124570 58.98003 7.870291 65.83540 3.834101 -6.855362      8.754530 
1 1 1 -22 15 16 o 41.32232 3.515691 21.17152       3.506648 20.01380       7.456398 21.50029       3.973478 38.80280 8.145448 41.54597 3.973035 -2.743172      9.062744 
1 1 1 -22 15 17 o 89.90398 3.203317 99.51780       7.006809 77.07902       10.67459 116.5049       9.287771 78.23718 5.636673 97.03178 3.936078 -18.79460      6.874939 
1 1 1 -22 15 18 o 45.41889 3.373519 25.54700       3.707180 18.80347       7.993602 27.39484       4.184381 37.19011 8.932584 46.97004 3.685221 -9.779922      9.662914 
1 1 1 -22 15 19 o 56.70712 3.011070 39.65961       4.146054 22.52234       8.336815 45.29086       4.778940 40.77856 8.657372 60.55122 3.250628 -19.77266      9.247522 
1 1 1 -22 15 20 f 115.8509 3.092677 165.4054       8.723316 166.1947       14.55834 164.9632       10.89595 114.9407 5.211144 115.3209 3.882762 -0.3802490     6.498605 
1 1 1 -22 15 21 o 23.51462 6.298682 7.307466       3.681581 -3.076677      9.646076 9.078030       3.983101 20.27383 9.160337 26.16996 6.318028 -5.896128      11.12786 
1 1 1 -22 15 22 o 58.20736 3.318109 42.02111       4.687075 43.66358       8.829049 41.37659       5.530776 58.02691 6.347207 57.54111 3.968625 0.4857941      7.485788 
1 1 1 -22 15 23 o 44.61928 4.254315 25.11137       4.569888 24.75830       11.80393 25.17362       4.956404 40.53376 11.44878 44.53593 4.634598 -4.002171      12.35128 
1 1 1 -22 15 24 o 30.50399 5.229897 12.12692       3.747784 14.48935       7.220998 11.25592       4.384568 31.91398 8.933611 28.95101 6.386483 2.962978       10.98165 
1 1 1 -22 15 25 o 29.77946 7.125762 12.20716       5.101868 18.07338       7.767018 7.755169       6.766316 35.37438 8.992115 24.51632 8.845950 10.85807       12.61384 
1 1 1 -22 15 26 o 23.73429 6.098523 7.644392       3.546011 8.177880       6.726001 7.439029       4.173077 24.72809 8.832041 23.31684 6.875931 1.411247       11.19301 
1 1 1 -22 15 27 o 19.03247 6.772518 4.485590       3.951325 2.658228       5.888445 5.982405       5.329329 18.91336 7.828334 21.65035 7.845336 -2.736988      11.08296 
1 1 1 -22 15 28 o 29.83810 5.278160 11.86079       3.697482 12.96567       6.531682 11.33976       4.485344 29.51729 8.574273 28.54194 6.583036 0.9753532      10.80993 
1 1 1 -22 15 29 f 20.82366 6.418471 5.961097       3.578871 5.616173       6.235962 6.130502       4.370236 21.50763 8.336609 21.20259 7.143787 0.3050385      10.97874 
1 1 1 -22 15 30 o 42.60126 4.304385 23.49714       4.407351 23.91413       7.632459 23.28853       5.398339 40.24329 8.063978 41.70338 5.441602 -1.460087      9.728247 
1 1 1 -22 15 31 o 15.73569 6.351987 2.194943       3.758639 5.014067       7.559540 1.269154       4.332060 21.35640 8.857424 15.53524 6.589830 5.821163       11.03992 
1 1 1 -22 15 32 o 11.29685 5.253050 -2.333786      3.495823 -3.211153      5.763655 -1.823183      4.396922 14.34466 6.695235 13.17638 6.042201 1.168289       9.018557 
1 1 1 -22 15 33 o 22.00348 7.222055 7.243254       4.472968 4.412374       10.63945 7.851027       4.929800 21.87091 9.771859 22.70738 7.586659 -0.8364639     12.37120 
1 1 1 -22 15 34 o 16.98978 6.429111 3.661122       3.649616 0.7598263      5.578489 5.832174       4.825648 16.14933 7.153727 20.08053 7.434478 -3.931196      10.31733 
1 1 1 -22 15 35 o 10.71894 5.091134 -3.333020      3.603613 -9.590526      5.772186 0.6636213      4.613040 11.56025 5.702179 14.90598 6.558194 -3.345732      8.690497 
1 1 1 -22 15 36 o 15.08357 6.534923 1.288453       4.430295 11.33497       6.429410 -7.794457      6.113303 25.34812 8.663452 12.49950 6.104036 12.84862       10.59786 
1 1 1 -22 16 1  o 72.63931 3.235607 65.00580       5.713107 54.16792       10.66577 69.36659       6.765549 65.04614 6.830542 74.91075 3.717765 -9.864609      7.776765 
1 1 1 -22 16 2  o 55.51773 4.121096 38.29113       5.535699 0.000000       0.000000 38.29113       5.535699 ?        ?        55.51773 4.121096 0.000000       4.121096 
1 1 1 -22 16 3  o 114.7291 3.102607 161.7483       8.666382 129.7254       16.15933 174.6779       10.26795 101.2264 6.586554 119.0781 3.542413 -17.85167      7.478728 
1 1 1 -22 16 4  o 59.98617 3.280317 44.34391       4.776908 46.62669       8.870687 43.41156       5.669098 60.70722 6.077909 59.19959 3.952337 1.507629       7.249962 
1 1 1 -22 16 5  o 100.6427 2.862817 124.2940       7.014077 110.9787       11.91432 131.3566       8.677087 94.32302 5.203574 103.3005 3.451801 -8.977486      6.244366 
1 1 1 -22 16 6  o 28.22183 6.569152 10.40316       4.432903 10.38697       7.287970 10.41266       5.584788 28.48192 9.209767 28.14657 7.848352 0.3353481      12.10027 
1 1 1 -22 16 7  o 27.65660 5.638340 9.869631       3.671008 19.43035       11.76018 8.837446       3.864093 37.73856 11.63548 26.05521 6.179849 11.68335       13.17478 
1 1 1 -22 16 8  o 34.10307 4.330451 14.59047       3.517802 16.98653       7.293866 13.86419       4.015718 35.70686 8.504594 33.03329 5.156987 2.673569       9.945986 
1 1 1 -22 16 9  o 38.55560 4.015486 18.52455       3.717563 14.52390       7.542212 19.80843       4.272641 32.96104 9.094141 39.77729 4.485988 -6.816246      10.14039 
1 1 1 -22 16 10 o 106.3356 2.766292 138.6781       7.162157 144.3767       12.97385 136.1801       8.589635 107.7312 4.955141 105.2114 3.354527 2.519814       5.983834 
1 1 1 -22 16 11 o 59.91667 3.711826 44.38021       5.393041 54.22861       11.68991 41.71737       6.078565 64.90526 7.530467 57.93098 4.337289 6.974281       8.690225 
1 1 1 -22 16 12 o 62.72849 3.650242 48.61887       5.555744 33.95948       11.33259 53.25677       6.374300 50.27114 9.600714 65.57025 4.008388 -15.29911      10.40389 
1 1 1 -22 16 13 o 53.10660 4.315160 35.11864       5.536386 0.000000       0.000000 35.11864       5.536386 ?        ?        53.10660 4.315160 0.000000       4.315160 
1 1 1 -22 16 14 o 83.31832 3.124192 85.41891       6.332050 76.05302       10.59361 90.62514       7.898258 77.75344 5.629096 85.62659 3.794605 -7.873154      6.788648 
1 1 1 -22 16 15 o 32.09738 4.370534 12.99156       3.329817 16.39172       7.899846 12.25696       3.671945 34.73898 9.190962 30.99269 5.034449 3.746281       10.47948 
1 1 1 -22 16 16 o 30.95149 5.387558 12.31501       3.916053 33.11682       8.290018 6.339877       4.443022 50.58722 6.904824 22.40350 7.186068 28.18372       9.965750 
1 1 1 -22 16 17 o 47.28786 4.000511 27.87809       4.566790 31.24816       8.260771 26.39481       5.480401 48.95681 7.133853 45.71233 5.001272 3.244476       8.712323 
1 1 1 -22 16 18 o 62.05104 2.894106 47.44194       4.364168 51.97326       9.282021 46.15594       4.944821 63.80433 6.041724 61.09117 3.334152 2.713161       6.900652 
1 1 1 -22 16 19 o 76.79195 2.803311 72.60390       5.237134 55.39550       10.08730 78.95409       6.127710 65.61815 6.389147 79.97646 3.150289 -14.35831      7.123589 
1 1 1 -22 16 20 o 9.383984 4.450242 -3.189547      2.732839 -7.680629      8.791663 -2.709185      2.875278 17.28242 8.130858 10.05084 4.703452 7.231579       9.393259 
1 1 1 -22 16 21 o 14.22729 5.428043 1.869906       2.614647 -1.639278      7.251462 2.394311       2.803211 18.09771 8.077947 15.27269 5.664121 2.825021       9.865874 
1 1 1 -22 16 22 o 42.79653 3.882217 22.99508       4.004777 31.99423       7.891605 19.87369       4.647706 49.21949 6.757698 39.39372 4.950504 9.825775       8.376990 
1 1 1 -22 16 23 o 55.65298 3.855984 38.83064       5.197159 52.65042       13.45753 36.40823       5.634270 61.10432 9.333264 53.67802 4.344393 7.426292       10.29483 
1 1 1 -22 16 24 o 58.61704 4.343918 43.51054       6.160902 42.19817       8.509652 44.95618       8.931293 56.58870 6.276279 58.35023 6.385229 -1.761528      8.953369 
1 1 1 -22 16 25 o 22.11106 6.293716 6.621621       3.553275 15.84593       7.035418 3.462965       4.116937 33.05466 8.639402 17.99697 6.824193 15.05769       11.00949 
1 1 1 -22 16 26 o 14.21456 5.842275 1.217037       3.249028 4.395041       6.291508 0.6129479E-01  3.794093 20.75465 8.272666 13.95967 6.047763 6.794986       10.24756 
1 1 1 -22 16 27 o 21.99083 6.904783 6.660879       4.120794 10.92139       6.383864 3.617587       5.395411 27.23629 8.599870 19.17230 7.654606 8.063988       11.51307 
1 1 1 -22 16 28 o 31.39826 5.229181 13.13625       3.860410 8.301906       6.592958 15.65846       4.762135 24.26542 8.734943 33.92625 5.978443 -9.660835      10.58494 
1 1 1 -22 16 29 o 20.47663 6.531180 5.780602       3.674025 -5.988317      6.182537 12.20569       4.568126 13.86992 6.610562 29.44672 6.536537 -15.57680      9.296551 
1 1 1 -22 16 30 o 16.75076 6.511889 3.013420       3.813447 3.465245       7.555153 2.858955       4.417459 20.34978 8.669888 17.18293 6.903738 3.166851       11.08280 
1 1 1 -22 16 31 o 69.21384 3.402595 60.83025       5.721451 50.19325       8.933678 68.22691       7.449697 60.14328 6.183460 72.51845 4.233963 -12.37516      7.494106 
1 1 1 -22 16 32 o 14.44854 6.136650 1.100235       3.764838 0.3929617      6.057609 1.545379       4.805707 16.63232 7.406100 16.11675 6.891884 0.5155640      10.11674 
1 1 1 -22 16 33 o 47.34978 4.239259 29.55078       4.839820 31.60842       7.788392 28.25636       6.177323 45.99210 7.183892 44.90437 5.778984 1.087723       9.219813 
1 1 1 -22 16 34 o 13.23068 5.768941 0.3866342      3.498820 3.767188       5.849021 -1.497078      4.366128 18.49179 7.739633 13.10020 6.012361 5.391588       9.800530 
1 1 1 -22 16 35 o 19.69936 6.678931 5.806564       3.820144 2.336543       6.126462 8.014048       4.886439 17.45531 7.621973 22.36783 7.553929 -4.912521      10.73109 
1 1 1 -22 17 1  o 68.50084 3.300146 57.92164       5.492696 53.68554       10.68708 59.44230       6.403117 64.55514 6.900370 69.24905 3.809057 -4.693909      7.881879 
1 1 1 -22 17 2  o 57.90322 4.112950 41.71082       5.765754 0.000000       0.000000 41.71082       5.765754 ?        ?        57.90322 4.112950 0.000000       4.112950 
1 1 1 -22 17 3  f 104.6448 3.586871 135.1688       9.133284 0.000000       0.000000 135.1688       9.133284 ?        ?        104.6448 3.586871 0.000000       3.586871 
1 1 1 -22 17 4  o 59.39675 3.426424 43.58113       4.938474 30.78891       9.866800 47.85692       5.704415 48.02758 8.752813 62.16051 3.783750 -14.13293      9.535644 
1 1 1 -22 17 5  o 78.64692 2.972517 76.05896       5.686693 67.98652       10.02121 79.89308       6.906382 73.47471 5.640004 80.45821 3.531043 -6.983498      6.654165 
1 1 1 -22 17 6  o 88.49792 3.358322 96.49857       7.229408 101.9496       11.00975 92.36666       9.585444 90.35606 5.019893 86.16819 4.581344 4.187874       6.796178 
1 1 1 -22 17 7  o 17.63419 6.123918 3.563380       3.216920 10.74014       6.981313 1.628790       3.624661 28.65257 8.985972 15.64795 6.265061 13.00462       10.95439 
1 1 1 -22 17 8  f 61.19121 3.250002 46.16536       4.828902 39.78430       11.09771 47.65569       5.363245 54.89526 8.576251 62.10191 3.558844 -7.206650      9.285336 
1 1 1 -22 17 9  o 58.19167 3.305951 41.78203       4.668776 30.11794       10.19310 44.87876       5.252098 47.35866 9.163571 60.24918 3.593547 -12.89052      9.842999 
1 1 1 -22 17 10 o 23.34797 6.863939 7.056573       4.163909 6.637167       8.027064 7.210977       4.870435 25.20346 9.535256 23.79331 7.511480 1.410154       12.13851 
1 1 1 -22 17 11 o 90.39574 3.125378 100.5504       6.874370 103.9782       11.62499 98.70718       8.524561 91.11774 5.257771 89.30947 3.926460 1.808273       6.562107 
1 1 1 -22 17 12 o 35.96841 4.200839 16.22355       3.612827 21.66208       7.427416 14.53797       4.134964 40.45781 7.816475 33.76700 5.191026 6.690804       9.383178 
1 1 1 -22 17 13 o 117.2273 2.829476 168.7138       8.082972 167.0541       14.67151 169.4371       9.685407 115.4953 5.226381 117.2374 3.393697 -1.742050      6.231552 
1 1 1 -22 17 14 o 47.32775 3.330219 27.72275       3.816308 22.80010       7.652394 29.35236       4.402906 41.43075 7.867087 48.60752 3.745939 -7.176777      8.713387 
1 1 1 -22 17 15 f 85.27262 2.796952 89.40942       5.804204 81.91691       10.88226 92.38828       6.861687 80.53212 5.579657 86.54330 3.259404 -6.011177      6.461910 
1 1 1 -22 17 16 o 16.98288 5.786352 3.406247       2.867725 9.766078       7.333868 2.258305       3.115805 27.48380 9.254259 15.58890 5.930745 11.89491       10.99159 
1 1 1 -22 17 17 o 70.93702 3.382738 62.25723       5.830748 56.48560       9.678904 65.54492       7.305048 66.46311 6.041951 72.51530 4.151219 -6.052193      7.330606 
1 1 1 -22 17 18 o 58.63160 3.059743 42.47837       4.356596 42.44965       9.576313 42.48587       4.892167 56.96168 7.049184 58.52802 3.445297 -1.566338      7.846086 
1 1 1 -22 17 19 o 15.63829 5.706498 2.610681       2.826430 4.118551       6.980787 2.315022       3.091133 21.80297 8.706224 15.56836 5.910909 6.234617       10.52317 
1 1 1 -22 17 20 o 39.08573 3.732127 19.14641       3.511651 11.42165       7.618263 21.23058       3.957123 28.83774 9.422869 41.09291 4.002286 -12.25518      10.23761 
1 1 1 -22 17 21 o 14.18533 5.511964 1.736147       2.731220 1.907629       6.682949 1.701763       2.992542 19.60939 8.244390 14.55395 5.735795 5.055443       10.04337 
1 1 1 -22 17 22 o 39.69567 3.771230 19.82251       3.604297 15.55917       7.638823 21.04350       4.087966 32.87777 9.182995 40.76999 4.173459 -7.892216      10.08688 
1 1 1 -22 17 23 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -22 17 24 o 12.80223 5.625335 -0.4715219     3.383973 -7.613243      6.315210 2.405020       4.007945 13.66607 6.558394 16.66225 6.615410 -2.996182      9.315373 
1 1 1 -22 17 25 o 41.08369 4.174814 21.55964       4.121691 25.41349       7.807243 20.07048       4.853120 42.40202 7.844566 39.12962 5.219617 3.272396       9.422400 
1 1 1 -22 17 26 o 25.36397 6.100451 8.846441       3.724336 11.71712       7.050949 7.735602       4.386124 28.00530 9.059027 23.50398 7.078176 4.501320       11.49637 
1 1 1 -22 17 27 f 17.54709 6.799419 3.254684       4.147342 5.757214       6.168736 1.190477       5.602518 21.63360 8.316435 17.25683 7.411556 4.376776       11.13976 
1 1 1 -22 17 28 o 14.10606 5.896610 1.049363       3.388667 6.813356       6.035744 -1.603778      4.094957 22.43610 8.313075 13.01087 5.914307 9.425226       10.20227 
1 1 1 -22 17 29 o 12.52538 5.631375 -1.006955      3.594057 -1.021523      7.258609 -1.002223      4.136754 17.44244 7.907164 13.44914 6.044569 3.993301       9.952892 
1 1 1 -22 17 30 o 60.67471 3.664508 47.04356       5.392999 46.24577       8.823523 47.51933       6.813895 57.53146 6.401926 60.10701 4.689019 -2.575554      7.935462 
1 1 1 -22 17 31 f 25.31324 6.604778 9.387326       4.116488 7.335290       6.562087 10.71882       5.285906 22.39582 8.585629 26.34173 7.730796 -3.945906      11.55328 
1 1 1 -22 17 32 o 18.02333 7.074256 3.977745       4.536004 -3.730850      11.30655 5.456422       4.951982 18.93340 8.999974 19.81453 7.490943 -0.8811359     11.70956 
1 1 1 -22 17 33 o 22.89783 6.737566 7.938041       4.010497 15.39209       6.735529 3.843843       4.991835 30.13175 8.693466 18.04841 7.307751 12.08334       11.35692 
1 1 1 -22 17 34 o 19.32864 6.644068 5.508281       3.782820 1.139864       6.124676 8.202491       4.809909 16.72610 7.447478 22.69717 7.491056 -5.971066      10.56318 
1 1 1 -22 17 35 o 17.25177 6.511891 4.010314       3.738786 0.8168650      6.178286 5.855485       4.696307 16.46375 7.394255 19.74177 7.329496 -3.278021      10.41136 
1 1 1 -22 18 1  o 54.09764 3.613864 36.34306       4.736835 38.36184       9.690626 35.70928       5.429706 53.95168 7.579454 53.44527 4.202782 0.5064125      8.666689 
1 1 1 -22 18 2  o 87.36649 3.140670 94.12471       6.675691 79.69948       12.99239 99.29914       7.781425 78.63054 6.848768 89.58346 3.571631 -10.95292      7.724129 
1 1 1 -22 18 3  o 71.20829 3.209034 62.57926       5.554226 58.44146       11.51114 63.83494       6.341229 67.14764 7.144356 71.79163 3.636472 -4.643997      8.016592 
1 1 1 -22 18 4  o 42.61370 4.013790 22.68083       4.119027 27.58049       8.965735 21.37001       4.637395 45.36359 8.420331 41.16346 4.707588 4.200134       9.646935 
1 1 1 -22 18 5  o 21.57038 6.451503 5.998328       3.653152 4.057519       7.714025 6.559436       4.147752 22.71697 9.124465 22.56325 6.901552 0.1537170      11.44060 
1 1 1 -22 18 6  o 131.2323 4.667789 214.6295       14.90376 207.5111       20.89880 221.9962       21.26003 127.4954 6.750580 131.9850 6.631270 -4.489563      9.462773 
1 1 1 -22 18 7  o 59.47682 3.759702 43.86904       5.421371 49.10436       11.09779 42.22808       6.213186 61.38620 7.579551 58.15624 4.417152 3.229954       8.772732 
1 1 1 -22 18 8  o 123.0989 3.187557 186.6053       9.553940 191.8690       15.18391 183.1555       12.29227 123.8501 5.041501 121.5062 4.157553 2.343918       6.534675 
1 1 1 -22 18 9  o 46.07374 3.980721 26.45723       4.425627 20.38399       7.578199 29.60052       5.451908 38.97545 8.237049 48.55820 4.664646 -9.582752      9.466145 
1 1 1 -22 18 10 o 80.86214 3.133285 80.57376       6.162522 97.72491       17.35560 78.09943       6.592074 86.25722 8.361482 79.52689 3.409431 6.730331       9.029873 
1 1 1 -22 18 11 o 52.44457 3.623220 34.11794       4.602075 37.42014       8.364403 32.68432       5.511240 53.92775 6.495469 51.08847 4.471845 2.839279       7.885969 
1 1 1 -22 18 12 o 86.84725 2.818068 92.76339       5.956186 105.2169       11.86139 88.56438       6.887507 91.41889 5.347662 84.69587 3.343628 6.723022       6.306928 
1 1 1 -22 18 13 o 58.90475 3.119810 42.83983       4.462344 50.94661       9.605124 40.60852       5.039171 63.02583 6.339902 57.21140 3.633204 5.814426       7.307156 
1 1 1 -22 18 14 o 96.06419 2.799020 113.5294       6.545461 106.1540       12.19915 116.5111       7.756496 91.64814 5.487359 97.14525 3.281192 -5.497108      6.393538 
1 1 1 -22 18 15 o 32.85049 4.440289 13.67822       3.463657 9.296112       7.847236 14.73851       3.860012 27.12866 9.554426 34.01856 4.788602 -6.889898      10.68727 
1 1 1 -22 18 16 o 29.86180 4.626594 11.39191       3.257951 23.19278       7.799656 8.897754       3.585750 41.44695 8.012198 26.01058 5.804496 15.43636       9.893811 
1 1 1 -22 18 17 o 38.41970 4.657352 18.74290       4.271502 18.72560       8.311210 18.74910       4.979465 36.50008 9.314442 38.12437 5.520194 -1.624294      10.82734 
1 1 1 -22 18 18 o 37.35535 3.871717 17.53392       3.473417 8.536908       7.502474 19.98845       3.918679 25.99684 9.322956 39.84076 4.094445 -13.84391      10.18244 
1 1 1 -22 18 19 o 59.21513 3.591071 43.70398       5.157586 40.44633       8.826409 45.39302       6.355525 55.47384 6.662356 60.03163 4.374475 -4.557793      7.970134 
1 1 1 -22 18 20 o 43.52200 3.526492 23.68651       3.708127 20.61873       8.084874 24.50377       4.172919 38.15305 8.865214 44.14005 3.920190 -5.987003      9.693293 
1 1 1 -22 18 21 o 14.79321 6.099695 1.184257       3.556639 3.808080       6.668400 0.1411169      4.204611 20.92813 8.456150 14.83824 6.397248 6.089890       10.60336 
1 1 1 -22 18 22 o 42.91264 4.367767 23.46715       4.503933 26.57064       8.037507 22.04655       5.437916 43.75079 7.826075 41.02391 5.584346 2.726875       9.614175 
1 1 1 -22 18 23 o 32.01061 4.713712 13.29752       3.567029 11.50340       11.24814 13.49812       3.761162 28.73300 11.17990 32.15471 4.959274 -3.421717      12.23048 
1 1 1 -22 18 24 o 26.18511 6.019802 9.352706       3.760807 1.040344       6.798765 13.01757       4.514369 18.65279 8.088289 30.91526 6.208062 -12.26247      10.19610 
1 1 1 -22 18 25 o 15.33240 6.140956 1.943332       3.483787 -1.922426      6.509230 3.495191       4.124187 16.42862 7.463486 17.86466 6.816855 -1.436039      10.10807 
1 1 1 -22 18 26 o 29.91981 5.564871 12.07806       3.908126 10.74146       6.890911 12.71183       4.745060 26.80173 8.969892 30.14166 6.639734 -3.339930      11.15997 
1 1 1 -22 18 27 o 12.81426 5.687226 -0.6002305     3.542450 5.437345       5.937481 -3.937211      4.414156 21.04400 8.140704 12.13519 5.725242 8.908809       9.952359 
1 1 1 -22 18 28 o 11.47012 5.330024 -2.468848      3.589609 -6.424380      7.085250 -1.102975      4.163493 14.79356 7.057990 13.42303 6.045773 1.370526       9.293363 
1 1 1 -22 18 29 o 39.27817 4.724413 20.42337       4.431370 19.89801       7.406046 20.71636       5.530649 35.65815 8.619252 38.61151 6.078657 -2.953354      10.54711 
1 1 1 -22 18 30 o 13.75731 5.922915 0.5909240      3.594476 2.388895       5.900376 -0.4701001     4.532638 17.91711 7.648490 14.26272 6.374942 3.654385       9.956872 
1 1 1 -22 18 31 o 12.83459 5.723382 -0.4401170     3.631337 2.344084       5.946125 -2.096162      4.585849 17.73128 7.625667 13.17044 6.086727 4.560839       9.756999 
1 1 1 -22 18 32 o 20.97112 7.285528 6.620057       4.553273 8.097096       10.64340 6.289182       5.037519 23.22453 10.09498 20.61719 7.602585 2.607340       12.63756 
1 1 1 -22 18 33 o 43.24628 4.444302 25.05101       4.617107 28.08553       7.463393 23.16968       5.876578 42.63853 7.454113 39.92891 6.243878 2.709621       9.723673 
1 1 1 -22 18 34 o 26.79739 6.138057 10.64428       3.921953 15.63258       6.804932 8.163198       4.799198 29.81109 8.777621 22.54831 7.484257 7.262783       11.53520 
1 1 1 -22 19 1  o 12.84278 5.813588 -1.860783      3.906723 -3.827335      6.444009 -0.7179302     4.912454 15.84313 7.283357 15.43456 6.779999 0.4085674      9.950662 
1 1 1 -22 19 2  o 62.49643 3.855844 48.65254       5.843741 49.36588       10.37256 48.32084       7.073081 61.43193 7.056759 61.94778 4.720957 -0.5158539     8.490306 
1 1 1 -22 19 3  f 43.81006 5.557031 24.60187       5.799417 0.000000       0.000000 24.60187       5.799417 ?        ?        43.81006 5.557031 0.000000       5.557031 
1 1 1 -22 19 4  o 85.53120 3.580652 90.64161       7.446652 91.03282       13.58390 90.47353       8.903760 84.01228 6.690295 85.13818 4.305515 -1.125900      7.955973 
1 1 1 -22 19 5  o 100.1094 3.120929 123.6087       7.604386 123.5025       15.71863 123.6411       8.688854 98.02452 6.619082 99.93475 3.573630 -1.910233      7.522172 
1 1 1 -22 19 6  o 71.17661 3.715646 62.86589       6.422458 63.58667       9.663342 62.29561       8.595588 70.75682 5.651255 70.31805 5.049799 0.4387665      7.578730 
1 1 1 -22 19 7  o 45.14200 3.728060 25.38444       4.064565 19.16594       7.654131 27.82670       4.796774 37.47376 8.568665 47.13700 4.220527 -9.663239      9.551694 
1 1 1 -22 19 8  o 71.59946 2.952209 63.18559       5.139966 70.57034       9.642551 60.25439       6.075011 74.73625 5.329469 69.72584 3.587399 5.010414       6.424381 
1 1 1 -22 19 9  o 54.64104 3.212656 36.92945       4.258913 42.55164       8.513254 35.05270       4.918649 57.57468 6.163551 53.06241 3.829608 4.512268       7.256394 
1 1 1 -22 19 10 o 76.01466 3.203449 71.36101       5.920748 74.34093       10.20077 69.84708       7.270824 76.60604 5.500911 74.92395 3.996696 1.682091       6.799530 
1 1 1 -22 19 11 o 123.2985 2.870648 187.0304       8.625295 167.6083       14.91475 196.7898       10.57255 115.2686 5.324065 126.1649 3.442000 -10.89630      6.339797 
1 1 1 -22 19 12 o 90.09787 3.106854 100.1724       6.811161 115.5306       18.55724 97.78128       7.322198 93.35821 8.241434 88.90968 3.385717 4.448532       8.909787 
1 1 1 -22 19 13 o 98.78179 2.832056 120.1746       6.810301 120.0450       12.75426 120.2262       8.054688 97.37919 5.395778 98.59064 3.357461 -1.211456      6.355074 
1 1 1 -22 19 14 o 15.03552 5.897087 1.837480       3.149985 5.233207       7.126381 1.012924       3.511663 22.88969 8.900920 14.66172 6.054773 8.227967       10.76507 
1 1 1 -22 19 15 o 49.12518 3.391607 29.99835       4.035263 21.35291       8.047835 32.90191       4.663912 39.28876 8.641153 51.34681 3.753280 -12.05806      9.421075 
1 1 1 -22 19 16 o 21.03068 6.054288 5.818027       3.270107 6.408805       8.809304 5.723608       3.521740 24.93879 9.837227 20.93355 6.350765 4.005241       11.70911 
1 1 1 -22 19 17 o 36.01584 4.196630 16.42479       3.614316 16.56963       7.833423 16.38562       4.073874 34.12783 9.208015 35.77176 4.793957 -1.643929      10.38121 
1 1 1 -22 19 18 o 82.68423 2.827007 84.45961       5.687827 83.08909       10.81057 84.98421       6.688408 80.46075 5.547471 82.72452 3.324589 -2.263771      6.467405 
1 1 1 -22 19 19 o 56.66751 3.212792 39.93879       4.418451 37.98238       8.494156 40.66454       5.173471 53.52466 6.655592 56.97509 3.746952 -3.450424      7.637837 
1 1 1 -22 19 20 o 29.66200 5.777876 11.70584       4.026210 1.618761       7.103464 16.48017       4.887015 19.64844 8.389963 35.27698 5.892508 -15.62854      10.25247 
1 1 1 -22 19 21 o 40.56510 4.595963 21.12319       4.463280 19.68977       7.682480 21.85350       5.483644 36.91122 8.686556 40.74794 5.676264 -3.836720      10.37672 
1 1 1 -22 19 22 o 13.20611 5.632080 0.3503180      3.193964 -2.758909      10.78568 0.6491839      3.343948 20.63783 9.463598 13.77633 5.814116 6.861495       11.10692 
1 1 1 -22 19 23 o 63.95196 3.007754 50.98968       4.674269 40.91191       8.687337 55.09604       5.545399 54.92817 6.623721 66.24975 3.446740 -11.32158      7.466840 
1 1 1 -22 19 24 o 20.47588 5.856568 5.705632       3.069499 5.247944       6.212752 5.853431       3.530492 21.27674 8.300241 20.72058 6.372838 0.5561543      10.46456 
1 1 1 -22 19 25 o 33.14273 4.971094 14.50220       3.891230 17.52161       6.798651 13.03119       4.745360 34.41815 8.219381 30.54929 6.569594 3.868858       10.52225 
1 1 1 -22 19 26 o 28.95091 6.669875 11.86510       4.608741 6.302849       6.354490 18.03807       6.694264 22.05709 8.450503 34.87825 8.040751 -12.82116      11.66468 
1 1 1 -22 19 27 o 19.42857 6.737987 5.066066       3.893798 8.149852       7.455899 3.909580       4.565919 23.91129 9.155429 18.43885 7.137203 5.472446       11.60868 
1 1 1 -22 19 28 o 25.47683 6.326544 9.275899       3.909817 12.67954       6.676121 7.499147       4.823541 28.20188 8.778783 22.62110 7.503042 5.580780       11.54828 
1 1 1 -22 19 29 o 38.26779 4.797415 19.55850       4.375753 14.92279       7.092529 22.40735       5.560039 30.10213 8.986034 40.18567 5.849226 -10.08354      10.72204 
1 1 1 -22 19 30 o 13.49486 5.883029 0.3189105      3.637120 -0.7729936     6.256257 0.8763489      4.470136 16.05507 7.302875 15.10499 6.554123 0.9500771      9.812671 
1 1 1 -22 19 31 o 23.99571 6.568386 8.610261       3.952250 7.639888       6.381199 9.214158       5.034018 22.19436 8.476873 24.15658 7.637925 -1.962221      11.41031 
1 1 1 -22 19 32 o 28.95539 6.680506 12.62248       4.617943 17.09206       10.78385 11.61880       5.110205 28.39372 10.97450 27.04713 7.494649 1.346592       13.28945 
1 1 1 -22 19 33 o 13.12084 5.818060 0.1978371E-02  3.699041 2.963791       6.150889 -1.676088      4.629817 17.90357 7.728254 13.27721 6.128878 4.626366       9.863522 
1 1 1 -22 20 1  o 60.94310 3.399236 46.18278       5.028259 43.48052       9.155768 47.34978       6.016842 57.53087 6.653132 61.45843 4.039856 -3.927555      7.783612 
1 1 1 -22 20 2  f 35.07666 4.610497 15.69258       3.845639 17.32101       7.693117 15.15012       4.440207 35.05836 8.969300 34.13327 5.526960 0.9250908      10.53545 
1 1 1 -22 20 3  o 89.47057 3.700004 99.57657       8.049713 0.000000       0.000000 99.57657       8.049713 ?        ?        89.47057 3.700004 0.000000       3.700004 
1 1 1 -22 20 4  o 24.35135 6.093849 7.875312       3.607148 6.592012       7.284414 8.292221       4.151939 24.12824 9.093440 24.89715 6.697753 -0.7689133     11.29383 
1 1 1 -22 20 5  o 36.47448 4.637266 16.91794       4.028749 14.83466       8.640055 17.49674       4.554145 32.42618 9.968865 36.90818 5.208055 -4.482002      11.24732 
1 1 1 -22 20 6  o 47.85725 6.001841 29.61485       6.845996 15.76838       9.294658 46.03446       10.12150 33.32468 10.35590 59.15168 7.167751 -25.82700      12.59450 
1 1 1 -22 20 7  o 20.77106 5.958192 5.644373       3.172518 16.37453       6.928933 2.798229       3.568549 34.49527 8.336264 16.83235 6.360057 17.66292       10.48540 
1 1 1 -22 20 8  f 91.15164 3.154214 102.6736       6.995791 102.6426       11.28522 102.6930       8.915529 90.09039 5.161988 90.75460 4.041411 -0.6642075     6.555847 
1 1 1 -22 20 9  o 67.68575 3.320545 56.76359       5.460284 52.52495       9.102576 59.14611       6.824468 63.96618 5.906191 68.80361 4.088692 -4.837437      7.183348 
1 1 1 -22 20 10 o 31.97820 4.432215 13.00869       3.361168 16.37790       7.267210 12.09182       3.791019 34.33838 8.681261 30.54707 5.283883 3.791311       10.16286 
1 1 1 -22 20 11 o 69.56913 2.993129 59.79792       5.062451 52.61938       9.497944 62.64659       5.983192 63.82002 6.184549 71.04385 3.466437 -7.223827      7.089769 
1 1 1 -22 20 12 o 41.45383 4.187040 21.65237       4.171769 17.05047       13.27624 22.15654       4.394354 34.40723 12.39409 41.87754 4.370284 -7.470306      13.14202 
1 1 1 -22 20 13 o 28.30820 5.450794 10.48635       3.623757 21.10583       12.42682 9.499395       3.788408 37.36757 12.02110 26.76189 5.961808 10.60568       13.41827 
1 1 1 -22 20 14 o 104.8878 2.824007 135.7453       7.211601 132.7095       13.18784 137.0403       8.613551 102.0975 5.318907 105.1110 3.367121 -3.013435      6.295100 
1 1 1 -22 20 15 o 60.78236 3.244490 45.87928       4.788326 44.84908       11.66749 46.08793       5.250898 56.99197 8.674200 60.80502 3.559273 -3.813053      9.376042 
1 1 1 -22 20 16 o 42.68221 4.434493 23.13103       4.545249 24.08900       8.057366 22.68390       5.504729 41.67620 8.225733 41.80353 5.539888 -0.1273308     9.917311 
1 1 1 -22 20 17 o 23.98461 5.692242 7.674099       3.276771 3.487461       6.470478 9.118144       3.800090 20.49654 8.312329 26.05383 6.094413 -5.557283      10.30712 
1 1 1 -22 20 18 o 15.65526 6.217395 2.001127       3.541150 6.641681       6.526906 0.6533630E-01  4.215526 23.27766 8.641006 14.76263 6.385231 8.515037       10.74421 
1 1 1 -22 20 19 o 81.61633 3.315273 83.04784       6.580026 69.58402       10.24128 92.51313       8.586911 73.00111 5.804664 85.62132 4.127624 -12.62021      7.122598 
1 1 1 -22 20 20 o 35.47532 4.161306 16.08378       3.529120 12.64605       6.885942 17.30844       4.109933 29.40091 8.871998 36.58314 4.720067 -7.182224      10.04945 
1 1 1 -22 20 21 o 18.14020 6.016548 4.238590       3.101609 1.952264       6.382424 4.945456       3.548832 18.86012 7.999390 19.43636 6.435331 -0.5762367     10.26663 
1 1 1 -22 20 22 o 47.00384 4.658876 28.55327       5.266285 0.1206614      11.23641 36.55691       5.961600 21.96137 9.908088 53.24257 4.641150 -31.28120      10.94123 
1 1 1 -22 20 23 o 15.11296 5.891260 2.173556       3.127927 3.002203       6.137566 1.882820       3.635476 19.25803 7.983528 15.44192 6.242166 3.816107       10.13417 
1 1 1 -22 20 24 o 16.59464 5.986119 3.309314       3.098276 5.618207       6.013235 2.474825       3.615071 21.34334 8.209372 16.04131 6.309649 5.302032       10.35401 
1 1 1 -22 20 25 o 40.16857 4.139291 20.81593       3.993857 12.07505       8.941735 22.99432       4.463872 27.60790 10.13772 42.07760 4.419236 -14.46969      11.05906 
1 1 1 -22 20 26 o 22.48299 7.592297 7.270292       4.936202 1.453195       8.208490 10.56555       6.178104 19.62527 8.686381 26.24565 8.478953 -6.620382      12.13861 
1 1 1 -22 20 27 o 37.14067 4.844875 18.36638       4.280561 14.67273       6.773391 20.82248       5.523340 30.36341 8.704729 38.71554 6.052408 -8.352125      10.60207 
1 1 1 -22 20 28 o 46.38827 4.378074 28.25138       4.890573 18.42861       8.094529 33.89843       6.137412 32.96075 9.536427 50.23751 5.083134 -17.27676      10.80656 
1 1 1 -22 20 29 o 21.82231 6.723655 7.047930       3.927759 -0.2868258     6.592309 11.08469       4.890589 16.67215 7.548993 26.92175 7.280739 -10.24961      10.48792 
1 1 1 -22 20 30 o 20.10925 6.675322 5.931490       3.817800 2.644258       6.485786 7.674439       4.722694 18.23958 7.904555 22.31833 7.424858 -4.078749      10.84484 
1 1 1 -22 20 31 o 10.20161 4.956542 -5.428854      3.890418 1.235637       10.05114 -6.603258      4.219298 19.60649 9.043328 10.27932 5.030732 9.327171       10.34843 
1 1 1 -22 20 32 o 24.16467 6.432847 8.823278       3.854883 3.647715       6.269643 11.96908       4.887984 18.49436 7.889238 27.59719 7.195374 -9.102827      10.67771 
1 1 1 -22 21 1  o 80.66098 3.086787 80.71336       6.056252 96.36536       12.13204 75.51838       6.989410 86.25254 5.805816 77.71504 3.701257 8.537498       6.885260 
1 1 1 -22 21 2  o 34.65736 4.643404 15.40616       3.823060 16.62569       7.337564 14.95174       4.479058 34.15013 8.771487 33.74641 5.645850 0.4037170      10.43142 
1 1 1 -22 21 3  o 34.15617 5.567025 15.25869       4.474258 0.000000       0.000000 15.25869       4.474258 ?        ?        34.15617 5.567025 0.000000       5.567025 
1 1 1 -22 21 4  o 37.79425 4.481943 18.18689       4.047625 13.82479       8.049358 19.66318       4.682728 31.08271 9.633634 39.10814 5.029885 -8.025431      10.86769 
1 1 1 -22 21 5  o 65.42792 3.597700 53.36816       5.714119 60.83833       11.28139 50.79033       6.627103 67.88994 6.915447 63.51274 4.307286 4.377197       8.147154 
1 1 1 -22 21 6  o 53.03498 4.651475 35.65952       5.950784 38.43891       10.16150 34.20879       7.341343 53.11054 8.107850 51.29617 5.985264 1.814369       10.07773 
1 1 1 -22 21 7  o 80.52061 2.867834 80.09393       5.618276 86.57446       10.38985 77.41591       6.678997 82.45631 5.197137 78.90585 3.482064 3.550461       6.255798 
1 1 1 -22 21 8  o 36.32932 4.456281 16.79266       3.862640 15.05751       7.098685 17.52250       4.603873 32.69163 8.741509 36.81891 5.282250 -4.127285      10.21353 
1 1 1 -22 21 9  o 11.34192 5.037541 -0.8182440     2.784540 -4.190114      6.261459 0.1299616E-01  3.108876 15.29119 7.082774 12.83212 5.516257 2.459072       8.977460 
1 1 1 -22 21 10 o 26.07131 5.321693 8.927103       3.266488 10.20293       6.892839 8.557599       3.709470 27.31535 8.965225 25.30527 6.089490 2.010071       10.83777 
1 1 1 -22 21 11 o 29.64237 4.769728 11.33805       3.328548 21.50011       7.255775 8.629468       3.745968 39.61045 7.794600 25.39221 6.125061 14.21824       9.913232 
1 1 1 -22 21 12 o 48.35393 3.772265 29.30697       4.409832 33.22597       12.68605 28.76833       4.703126 46.90328 11.24500 47.79358 4.077027 -0.8903046     11.96128 
1 1 1 -22 21 13 o 40.25938 3.881253 20.41663       3.760664 26.08994       7.833010 18.71721       4.287068 43.73794 7.626235 38.24186 4.698956 5.496078       8.957659 
1 1 1 -22 21 14 o 32.87346 4.660277 13.89778       3.628779 10.85086       8.515285 14.57390       4.011239 28.08355 9.947214 33.52379 5.068138 -5.440241      11.16392 
1 1 1 -22 21 15 o 50.47703 4.457203 32.37955       5.426399 22.23331       12.63466 34.67440       6.008809 37.29514 12.13146 52.08591 4.787558 -14.79077      13.04197 
1 1 1 -22 21 16 o 21.88066 7.431676 6.243585       4.729954 7.186217       6.825830 5.372839       6.560393 23.90681 8.843654 22.06798 8.551564 1.838831       12.30201 
1 1 1 -22 21 17 o 68.31158 3.477914 58.37352       5.770556 57.51423       9.344316 58.90325       7.336692 66.27047 5.846052 68.06661 4.447493 -1.796143      7.345510 
1 1 1 -22 21 18 o 58.59989 3.153253 42.83649       4.486310 29.52846       7.808465 49.39420       5.481314 46.43146 7.128531 62.71964 3.601429 -16.28817      7.986629 
1 1 1 -22 21 19 o 21.14255 6.010526 6.064845       3.242719 4.712481       6.617796 6.492142       3.719899 21.26264 8.481381 21.80613 6.507366 -0.5434895     10.69017 
1 1 1 -22 21 20 o 54.35477 3.230011 37.00860       4.259072 35.98956       7.988017 37.41336       5.034363 51.54113 6.504451 54.35688 3.825037 -2.815746      7.545779 
1 1 1 -22 21 21 o 34.96337 4.281904 15.77001       3.572204 6.706853       6.537461 19.62793       4.265263 22.80550 8.610271 38.90464 4.586995 -16.09914      9.755885 
1 1 1 -22 21 22 f 15.75697 6.116225 2.468689       3.360154 16.86310       10.48448 0.8209553      3.547264 31.79088 11.05472 14.17238 5.985122 17.61850       12.57094 
1 1 1 -22 21 23 f 16.62067 6.142760 3.221494       3.291889 10.07642       6.615806 0.9658526      3.795041 25.94505 8.789446 14.64674 6.188299 11.29831       10.74939 
1 1 1 -22 21 24 o 48.64272 5.588837 31.78324       6.504620 23.55119       10.53878 36.84896       8.267183 36.89837 10.93879 51.35577 6.770679 -14.45740      12.86465 
1 1 1 -22 21 25 o 19.12821 6.794030 4.858356       3.974783 -0.2846422     7.291495 7.032834       4.741175 17.79048 8.007874 22.12096 7.440734 -4.330481      10.93117 
1 1 1 -22 21 26 o 14.11239 6.017888 0.8266853      3.645787 -5.428136      5.899719 4.690868       4.637167 13.53140 6.451557 19.16353 7.247999 -5.632131      9.703405 
1 1 1 -22 21 27 o 14.71768 5.905033 1.996200       3.227095 3.552291       5.956141 1.349576       3.839489 18.84209 7.842392 14.81176 6.239419 4.030329       10.02165 
1 1 1 -22 21 28 o 55.81534 3.856436 40.38466       5.213120 28.72349       8.126560 48.53896       6.795613 43.00394 8.050461 60.40696 4.652238 -17.40302      9.298023 
1 1 1 -22 21 29 o 30.92125 5.662219 13.49834       4.109398 12.78455       6.806667 13.90773       5.154868 27.30364 8.905858 30.22030 7.117901 -2.916666      11.40083 
1 1 1 -22 21 30 o 11.99239 5.471268 -1.217793      3.545076 -0.8256597     6.224951 -1.406017      4.312771 15.76303 7.213728 13.07513 5.991423 2.687901       9.377367 
1 1 1 -22 21 31 o 18.03235 7.022602 4.312420       4.441272 13.04123       11.15107 2.666728       4.841875 25.37522 10.65789 16.71098 7.021137 8.664242       12.76272 
1 1 1 -22 22 1  o 30.20754 4.852668 11.90090       3.451225 12.89306       6.367077 11.48811       4.106885 29.89868 8.395714 29.20980 5.971375 0.6888847      10.30269 
1 1 1 -22 22 2  o 13.78481 5.591999 1.247925       2.929330 4.135810       5.628970 0.1753610      3.430446 20.13820 7.887647 13.50064 5.798950 6.637553       9.789933 
1 1 1 -22 22 3  o 27.73477 5.880568 10.31105       3.851009 0.000000       0.000000 10.31105       3.851009 ?        ?        27.73477 5.880568 0.000000       5.880568 
1 1 1 -22 22 4  o 29.19608 5.497753 11.26954       3.768046 3.333731       6.619032 15.07437       4.583175 20.42219 8.360073 33.75246 5.779937 -13.33027      10.16359 
1 1 1 -22 22 5  o 17.46382 6.161463 3.623629       3.264524 -3.683728      6.877620 5.748785       3.708971 16.27774 7.498133 20.86615 6.550542 -4.588406      9.956485 
1 1 1 -22 22 6  o 36.54195 6.185860 17.76272       5.312097 4.991858       8.425859 26.18723       6.843471 23.22201 9.460337 44.32964 6.530428 -21.10763      11.49541 
1 1 1 -22 22 7  o 44.94816 4.240744 25.60753       4.590142 26.92628       9.174209 25.16718       5.301410 43.43761 8.964357 44.22632 5.006942 -0.7887077     10.26787 
1 1 1 -22 22 8  o 50.23775 3.420799 31.52768       4.162894 40.86667       8.447649 28.53244       4.784112 55.67491 6.339228 47.49307 4.176147 8.181835       7.591180 
1 1 1 -22 22 9  o 27.95572 5.041356 10.21791       3.308100 3.310646       6.446381 12.68717       3.854310 20.28702 8.270989 31.13863 5.266996 -10.85161      9.805636 
1 1 1 -22 22 10 o 47.62806 3.440430 28.36826       3.966201 23.93890       7.604948 30.02313       4.648436 41.61571 7.785099 48.81221 3.941380 -7.196503      8.725952 
1 1 1 -22 22 11 o 35.08881 4.303339 15.71873       3.602734 10.97533       6.882772 17.50887       4.228258 27.84550 8.945255 36.85385 4.823741 -9.008356      10.16298 
1 1 1 -22 22 12 o 48.74615 4.263093 30.14944       5.013176 14.30529       12.61095 33.12316       5.463410 31.27620 11.92377 51.02646 4.437814 -19.75026      12.72283 
1 1 1 -22 22 13 o 34.47542 5.262461 15.54862       4.281263 16.48681       8.704887 15.24928       4.917062 33.11675 9.971214 33.70246 6.215933 -0.5857086     11.75002 
1 1 1 -22 22 14 o 45.44101 4.101660 26.19969       4.493119 23.98088       7.623963 27.38044       5.561590 41.39839 7.844260 46.00769 5.043129 -4.609299      9.325533 
1 1 1 -22 22 15 o 17.49789 6.071381 3.761760       3.161642 12.20838       6.505687 1.150021       3.617567 29.01474 8.592700 14.75765 6.124542 14.25709       10.55199 
1 1 1 -22 22 16 o 73.07790 3.544066 67.00440       6.292557 51.16422       9.654409 78.70364       8.297066 61.74533 6.514387 78.65259 4.345770 -16.90726      7.830897 
1 1 1 -22 22 17 o 40.71925 3.942804 21.09658       3.863484 13.06498       7.451702 24.04928       4.518188 29.49981 9.288247 43.31106 4.339221 -13.81125      10.25185 
1 1 1 -22 22 18 o 28.81403 5.356687 11.08773       3.622877 8.643224       6.907150 12.01547       4.255181 24.88379 8.942779 29.67581 6.088430 -4.792025      10.81861 
1 1 1 -22 22 19 o 73.38115 2.979823 67.16434       5.317492 50.56712       9.264112 75.31924       6.493746 61.24068 6.297300 77.41295 3.450950 -16.17226      7.180880 
1 1 1 -22 22 20 o 26.46882 5.444011 9.465894       3.394187 10.60449       6.551682 9.048203       3.968222 26.70209 8.739213 25.46271 6.402646 1.239380       10.83364 
1 1 1 -22 22 21 f 28.77534 5.105514 11.06015       3.449004 5.906415       6.505071 13.07547       4.067841 21.85516 8.502534 31.10199 5.571740 -9.246828      10.16550 
1 1 1 -22 22 22 o 19.68283 6.177737 5.304701       3.298989 -1.574428      6.162188 8.068450       3.905867 15.98622 7.262228 23.87083 6.527920 -7.884610      9.764922 
1 1 1 -22 22 23 o 45.92421 4.618963 27.59898       5.099057 37.73501       10.69574 24.61769       5.800672 49.23980 9.253347 42.58245 5.735718 6.657341       10.88682 
1 1 1 -22 22 24 o 36.20039 4.533860 17.25488       3.912132 6.876887       7.361556 21.33927       4.618243 22.59646 8.967509 40.11840 4.820296 -17.52194      10.18094 
1 1 1 -22 22 25 o 12.73578 5.665316 -0.4963152     3.535491 -5.314324      5.756327 2.422121       4.480090 13.35724 6.369675 16.64699 6.853132 -3.289747      9.356184 
1 1 1 -22 22 26 o 21.35559 6.555043 6.636842       3.737566 3.919123       5.883357 8.475826       4.839628 19.03903 7.847231 23.60185 7.492275 -4.562819      10.84957 
1 1 1 -22 22 27 o 18.12465 6.373101 4.514602       3.490469 -0.3759239     6.423711 6.563492       4.157836 16.41478 7.440195 21.05081 6.965495 -4.636028      10.19189 
1 1 1 -22 22 28 o 17.63416 6.227686 4.263979       3.335715 -1.161670      6.047750 6.636286       3.999019 15.48360 7.095011 21.07013 6.822904 -5.586534      9.843333 
1 1 1 -22 22 29 o 56.34107 3.969005 41.60018       5.414456 32.93777       8.201885 48.29107       7.208359 46.18822 7.547372 59.50550 5.017705 -13.31728      9.063122 
1 1 1 -22 22 30 o 19.55112 6.721156 5.680315       3.871136 13.92659       6.581883 1.319138       4.786558 28.26067 8.703145 15.55267 6.764932 12.70800       11.02311 
1 1 1 -22 23 1  o 33.14134 4.441688 14.22224       3.496955 18.34272       6.625089 12.63086       4.117228 35.75747 7.821254 30.62382 5.727586 5.133650       9.694187 
1 1 1 -22 23 2  o 15.75110 5.876929 2.694273       3.026506 7.091136       5.898232 1.122869       3.526096 23.06730 8.267044 14.53074 6.039879 8.536560       10.23837 
1 1 1 -22 23 3  o 43.53762 4.847204 24.55307       5.055610 0.000000       0.000000 24.55307       5.055610 ?        ?        43.53762 4.847204 0.000000       4.847204 
1 1 1 -22 23 4  o 41.25690 3.898848 21.59541       3.873350 10.82225       7.461699 25.56914       4.531745 27.34397 9.333364 44.78290 4.201646 -17.43893      10.23550 
1 1 1 -22 23 5  o 41.64254 3.942746 22.00429       3.953382 18.16146       7.801307 23.33215       4.585824 35.00716 9.071647 42.65112 4.478901 -7.643959      10.11708 
1 1 1 -22 23 6  o 20.40865 7.928714 4.489064       5.650524 8.283353       7.112307 -2.004418      9.304310 24.87333 9.055909 19.65785 8.927624 5.215477       12.71660 
1 1 1 -22 23 7  o 18.05081 6.008776 4.151301       3.092941 1.156493       6.826233 4.924952       3.469517 18.87731 8.144987 19.43566 6.359525 -0.5583458     10.33365 
1 1 1 -22 23 8  o 12.04732 5.387456 -1.008628      3.241531 1.443398       7.270356 -1.616997      3.621399 19.53209 8.416474 12.30848 5.581906 7.223615       10.09924 
1 1 1 -22 23 9  o 34.50886 4.621819 15.38741       3.789053 10.72934       6.381236 17.92410       4.709080 27.33680 8.593611 36.93103 5.391412 -9.594229      10.14482 
1 1 1 -22 23 10 o 9.395996 4.504976 -3.915232      2.964259 -8.762938      6.051188 -2.384657      3.400163 12.82144 6.218256 11.31078 5.232160 1.510653       8.126636 
1 1 1 -22 23 11 o 10.39622 4.851521 -2.542816      3.024308 -4.359241      5.544200 -1.773363      3.608455 13.91611 6.518393 12.15520 5.535669 1.760910       8.551787 
1 1 1 -22 23 12 o 12.59167 5.587471 -0.7467220     3.417795 11.24727       11.30850 -1.952443      3.585472 28.36631 11.15898 11.97099 5.477000 16.39532       12.43062 
1 1 1 -22 23 13 o 19.01496 6.180001 4.741802       3.279173 1.876592       6.317832 5.798297       3.836398 18.74040 7.954129 20.78610 6.678499 -2.045696      10.38607 
1 1 1 -22 23 14 f 43.55196 3.752182 24.02670       3.943454 26.52301       7.640486 23.12025       4.604081 43.51688 7.474075 42.35275 4.531263 1.164135       8.740375 
1 1 1 -22 23 15 o 10.49025 4.901785 -2.612106      3.103733 3.346859       6.360665 -4.474356      3.555789 19.82771 8.164493 10.32226 4.945081 9.505450       9.545300 
1 1 1 -22 23 16 o 57.19426 3.957156 41.56757       5.481330 37.64352       8.597462 44.25492       7.114848 52.29745 6.915434 58.27871 5.059886 -5.981258      8.568878 
1 1 1 -22 23 17 o 87.75976 2.900113 95.94316       6.193692 81.06879       10.70983 103.4179       7.592067 78.30103 5.650803 90.71590 3.440554 -12.41487      6.615813 
1 1 1 -22 23 18 o 57.17355 3.613663 41.34138       5.009004 47.82329       12.85552 40.18117       5.438847 55.68541 9.832968 56.13154 4.002420 -0.4461365     10.61634 
1 1 1 -22 23 19 o 17.71574 6.186427 3.989525       3.285337 6.869682       6.750834 3.095721       3.760716 22.83202 8.719296 16.92424 6.496666 5.907785       10.87349 
1 1 1 -22 23 20 o 81.65375 3.313257 83.93352       6.579070 66.95113       10.11531 96.38484       8.661391 70.44418 5.948006 86.77084 4.107831 -16.32666      7.228627 
1 1 1 -22 23 21 o 57.58780 4.771420 43.42408       6.635930 0.000000       0.000000 43.42408       6.635930 ?        ?        57.58780 4.771420 0.000000       4.771420 
1 1 1 -22 23 22 o 19.49783 6.870933 5.122549       4.058690 -2.849520      7.852808 8.028350       4.741025 17.06466 7.913829 23.38770 7.414505 -6.323034      10.84452 
1 1 1 -22 23 23 o 24.02646 6.026591 8.185412       3.522021 10.42015       6.780144 7.359538       4.121762 25.65519 8.891581 22.48654 6.880242 3.168652       11.24268 
1 1 1 -22 23 24 o 18.28361 6.299839 4.543788       3.401654 9.120116       6.346105 2.698823       4.029422 24.17671 8.584936 16.42481 6.595485 7.751907       10.82597 
1 1 1 -22 23 25 o 18.35202 6.653673 4.535722       3.833965 8.822659       6.291317 2.003109       4.835624 23.64804 8.530182 16.48289 6.975741 7.165154       11.01930 
1 1 1 -22 23 26 o 23.34649 6.120164 7.939588       3.523737 2.192413       6.170268 10.72110       4.292570 17.75117 7.701304 26.87766 6.602302 -9.126492      10.14399 
1 1 1 -22 23 27 o 19.95475 6.273910 5.814779       3.401061 6.436482       6.176098 5.544193       4.074514 21.00617 8.251795 19.55969 6.885024 1.446484       10.74689 
1 1 1 -22 23 28 o 45.15808 4.509412 27.34903       4.896111 12.14992       7.014126 41.79248       6.837542 26.19526 9.045420 55.16071 5.146054 -28.96545      10.40680 
1 1 1 -22 23 29 o 13.55945 5.760524 1.065728       3.318946 1.581709       6.198196 0.8583087      3.929819 17.04708 7.546550 14.18042 6.149145 2.866668       9.734598 
1 1 1 -22 24 1  o 17.38201 6.065665 3.814605       3.158012 6.213693       5.431123 2.589134       3.881668 21.64285 7.908360 16.47416 6.520048 5.168694       10.24955 
1 1 1 -22 24 2  o 18.65396 6.048157 4.626721       3.141811 6.460807       5.689619 3.822118       3.768464 22.06826 8.089468 17.87682 6.578444 4.191435       10.42667 
1 1 1 -22 24 3  o 29.01857 6.001258 11.53322       4.103616 0.000000       0.000000 11.53322       4.103616 ?        ?        29.01857 6.001258 0.000000       6.001258 
1 1 1 -22 24 4  o 49.36148 3.685139 30.85812       4.400811 19.68453       7.708269 36.26133       5.360272 36.19394 8.821157 53.25774 4.163232 -17.06380      9.754246 
1 1 1 -22 24 5  f 18.74040 6.511085 4.489004       3.636743 1.022883       6.514580 6.058210       4.383335 18.21386 7.907575 21.19580 7.154499 -2.981943      10.66380 
1 1 1 -22 24 6  o 53.48641 5.328605 37.56977       6.853028 31.46448       9.247125 45.00851       10.20712 46.48596 8.475149 56.61829 7.588865 -10.13232      11.37625 
1 1 1 -22 24 7  o 11.79254 5.178683 -0.3785591     2.864161 1.771186       6.420250 -0.9126989     3.200265 18.66345 7.973018 11.98398 5.356523 6.679470       9.605277 
1 1 1 -22 24 8  o 38.52507 4.072762 18.99281       3.765748 14.08002       7.645808 20.56624       4.326961 30.35159 9.386014 39.88470 4.532125 -9.533106      10.42293 
1 1 1 -22 24 9  o 38.54071 3.941761 18.95243       3.649998 18.06766       6.675547 19.32973       4.359342 35.36309 7.941216 38.55108 4.739987 -3.187988      9.248264 
1 1 1 -22 24 10 o 26.83135 5.431748 9.679630       3.429558 11.44418       7.424306 9.200961       3.866848 27.66753 9.311121 25.82176 6.219577 1.845770       11.19733 
1 1 1 -22 24 11 o 17.70488 6.152634 3.936447       3.247428 1.421826       6.567228 4.750335       3.736182 18.55357 7.997019 19.16968 6.602463 -0.6161156     10.37038 
1 1 1 -22 24 12 o 40.06751 4.025202 20.52797       3.877027 20.08183       7.116960 20.71624       4.623254 37.16672 8.088159 39.83430 4.863437 -2.667583      9.437761 
1 1 1 -22 24 13 o 46.16764 3.730599 27.04058       4.161411 29.44180       7.936820 26.13019       4.887021 45.76449 7.366760 44.96882 4.520884 0.7956734      8.643353 
1 1 1 -22 24 14 o 37.37474 4.175342 17.97196       3.737932 22.21674       7.026328 16.29645       4.414441 39.44749 7.584682 34.99459 5.345861 4.452900       9.279312 
1 1 1 -22 24 15 o 42.22542 4.645265 23.18517       4.701057 11.93736       6.957643 32.63354       6.376857 28.03176 8.992674 49.68717 5.350802 -21.65541      10.46419 
1 1 1 -22 24 16 o 45.38248 3.641032 26.14886       3.992936 19.42266       7.027017 29.35622       4.852437 36.25876 8.151505 47.78497 4.210095 -11.52621      9.174526 
1 1 1 -22 24 17 o 14.27743 5.855372 1.394462       3.254524 4.231078       6.705437 0.5203157      3.722364 20.50634 8.406754 14.10348 6.048969 6.402863       10.35681 
1 1 1 -22 24 18 f 77.32442 2.987108 74.85984       5.618055 66.49903       10.00997 78.70454       6.787967 70.19907 5.906200 78.86256 3.541131 -8.663483      6.886422 
1 1 1 -22 24 19 o 44.11921 4.881370 25.68212       5.160465 5.855375       9.868602 33.14400       6.054160 23.24113 9.905474 50.05693 5.031268 -26.81579      11.11000 
1 1 1 -22 24 20 o 18.70055 7.210642 4.169251       4.647243 0.000000       0.000000 4.169251       4.647243 ?        ?        18.70055 7.210642 0.000000       7.210642 
1 1 1 -22 24 21 o 66.50399 3.487915 56.25782       5.632860 36.81625       13.34710 60.47091       6.213290 44.02491 12.07853 68.75592 3.722183 -24.73101      12.63904 
1 1 1 -22 24 22 o 12.56731 5.484208 0.4618029E-01  3.167554 0.7595052      5.990920 -0.2306065     3.731835 16.89458 7.451821 13.26655 5.865135 3.628030       9.483114 
1 1 1 -22 24 23 o 17.81062 6.282629 4.259918       3.394059 4.212403       6.466046 4.277988       3.987564 19.63707 8.172066 18.14130 6.750285 1.495762       10.59948 
1 1 1 -22 24 24 o 20.48334 6.297349 6.088018       3.447771 1.557897       6.300284 8.024621       4.119321 17.48692 7.679988 23.14048 6.833482 -5.653563      10.28001 
1 1 1 -22 24 25 o 31.73568 5.997992 14.41385       4.468708 8.532697       6.618608 19.34084       6.057957 23.08351 8.674749 35.76856 7.199531 -12.68505      11.27318 
1 1 1 -22 24 26 o 11.97870 5.407617 -0.8253946     3.352981 -3.694492      6.012035 0.4699092      4.039566 14.12721 6.670074 14.08749 6.169371 0.3972244E-01  9.085760 
1 1 1 -22 24 27 o 25.54207 5.972888 9.538094       3.650951 -1.198645      6.282816 15.01212       4.486126 15.57293 7.170972 32.28023 5.921075 -16.70730      9.299568 
1 1 1 -22 25 1  o 21.84108 6.020179 6.666679       3.306991 1.961413       5.763547 8.976034       4.037784 17.80650 7.578928 25.10691 6.536587 -7.300407      10.00835 
1 1 1 -22 25 2  o 12.76710 5.393614 0.6104385      2.882464 -1.511788      5.372962 1.468057       3.415584 14.98326 6.796577 14.56853 5.989209 0.4147310      9.058923 
1 1 1 -22 25 3  o 35.42212 5.173926 16.71356       4.334360 0.000000       0.000000 16.71356       4.334360 ?        ?        35.42212 5.173926 0.000000       5.173926 
1 1 1 -22 25 4  o 17.79966 6.328037 3.985470       3.448961 5.824392       5.815429 2.987717       4.283625 21.36353 8.108348 17.30810 6.849565 4.055431       10.61423 
1 1 1 -22 25 5  o 15.52083 5.795370 2.681112       2.944187 3.772030       6.204680 2.364102       3.344718 19.79814 8.098179 15.56632 6.085060 4.231818       10.12958 
1 1 1 -22 25 6  o 14.14598 6.161049 0.8157287E-01  3.980993 2.479944       5.946071 -1.866919      5.359462 18.54865 7.786151 14.82154 6.748568 3.727113       10.30375 
1 1 1 -22 25 7  o 12.47570 5.424347 -0.5231339E-01 3.074849 -2.666610      6.015786 0.8722194      3.577471 15.27320 7.027131 14.24711 6.013300 1.026088       9.248803 
1 1 1 -22 25 8  o 35.55365 4.445357 16.42819       3.767538 2.211398       7.189598 21.81005       4.423540 19.53201 8.392442 40.99787 4.501603 -21.46586      9.523523 
1 1 1 -22 25 9  o 37.68247 4.257986 18.33930       3.841616 14.52665       7.962790 19.49592       4.385779 30.34938 9.607463 38.60069 4.763406 -8.251310      10.72350 
1 1 1 -22 25 10 o 19.13168 6.072820 4.931744       3.179595 9.002317       5.914008 3.276739       3.770975 24.85605 8.309632 17.17024 6.526400 7.685810       10.56617 
1 1 1 -22 25 11 f 15.88869 6.194606 2.508122       3.458766 18.39911       10.95341 0.7481216      3.645274 32.67421 11.30260 14.22418 6.039774 18.45003       12.81514 
1 1 1 -22 25 12 o 75.54047 3.353636 71.82494       6.158115 63.99511       9.462661 77.57714       8.110616 69.29544 5.652738 77.72419 4.298891 -8.428749      7.101683 
1 1 1 -22 25 13 f 41.44267 3.921515 22.00163       3.913280 19.66782       7.042076 23.04428       4.706952 36.40807 8.141652 42.00026 4.678188 -5.592194      9.389991 
1 1 1 -22 25 14 o 51.21573 4.519685 34.05604       5.583066 37.25380       7.923557 30.90294       7.868032 52.07286 6.377083 46.74422 7.132759 5.328636       9.567833 
1 1 1 -22 25 15 o 24.61592 6.690884 8.652216       4.117886 6.818274       6.129697 10.16065       5.559158 22.37286 8.360488 26.08387 7.992161 -3.711008      11.56600 
1 1 1 -22 25 16 o 20.07850 6.413643 5.577244       3.541953 11.05559       8.187920 4.316098       3.928545 26.55650 9.709198 18.46819 6.729447 8.088306       11.81330 
1 1 1 -22 25 17 o 80.55283 3.737390 82.73115       7.316442 64.63055       13.51716 90.23159       8.701263 65.17804 8.729666 83.55190 4.287903 -18.37386      9.725902 
1 1 1 -22 25 18 o 34.81635 5.670820 16.61904       4.645889 25.52719       9.918257 14.11504       5.258463 38.66249 10.33034 31.07145 7.100429 7.591034       12.53523 
1 1 1 -22 25 19 o 33.35092 4.881188 14.89273       3.849627 7.474421       6.640277 18.64820       4.724616 22.75174 8.657479 37.03447 5.393417 -14.28273      10.20004 
1 1 1 -22 25 20 f 39.35471 4.234347 20.27493       3.997056 9.881137       7.254414 24.80579       4.789666 24.89778 9.133124 43.30036 4.609975 -18.40257      10.23063 
1 1 1 -22 25 21 o 12.88219 5.589777 0.2721605      3.251641 4.712265       6.483033 -1.220246      3.758593 20.04683 8.247429 12.49294 5.673891 7.553898       10.01065 
1 1 1 -22 25 22 o 10.59910 5.035235 -3.453934      3.528460 1.824269       10.93592 -4.067254      3.727828 20.78516 9.530459 10.63657 5.086940 10.14859       10.80308 
1 1 1 -22 25 23 o 31.58862 5.071307 13.68451       3.771718 11.54759       6.856189 14.61185       4.516561 26.06733 8.945284 31.96971 6.018170 -5.902378      10.78130 
1 1 1 -22 25 24 o 40.48313 5.051498 22.39541       4.875315 20.02597       7.433783 24.18373       6.458169 34.55194 8.804665 40.43896 6.794186 -5.887012      11.12129 
1 1 1 -22 25 25 o 25.73278 5.873085 9.600305       3.601453 1.746260       6.531915 13.03082       4.316914 17.53719 7.756073 29.90122 6.130472 -12.36403      9.886321 
1 1 1 -22 25 26 o 29.06919 5.714904 12.12300       3.903973 10.04732       7.155746 13.00266       4.658323 24.01241 9.020723 29.34670 6.666122 -5.334295      11.21653 
1 1 1 -22 26 1  o 11.89956 5.177060 0.5285002E-02  2.804526 2.895050       4.795795 -1.496542      3.457317 17.46828 7.129355 11.84008 5.402294 5.628206       8.944970 
1 1 1 -22 26 2  o 33.24746 4.500390 14.56784       3.552697 13.05810       6.417177 15.23508       4.266133 28.84653 8.531792 33.47711 5.414103 -4.630581      10.10465 
1 1 1 -22 26 3  o 25.75221 6.956495 9.667230       4.467747 0.000000       0.000000 9.667230       4.467747 ?        ?        25.75221 6.956495 0.000000       6.956495 
1 1 1 -22 26 4  o 25.81382 5.392101 9.122261       3.282363 6.906560       6.254988 9.964270       3.855930 22.35111 8.425837 26.65032 6.073090 -4.299212      10.38639 
1 1 1 -22 26 5  o 24.37424 5.871145 8.287416       3.445625 -3.194641      6.383419 13.00830       4.093125 15.31238 7.112836 30.82011 5.658304 -15.50774      9.088941 
1 1 1 -22 26 6  o 23.52773 7.140261 8.016604       4.451246 7.044405       6.546232 8.852678       6.070660 22.64920 8.601249 24.39181 8.415448 -1.742609      12.03334 
1 1 1 -22 26 7  o 45.97419 3.791890 27.03632       4.210473 21.65823       8.124653 29.01104       4.923154 37.19434 9.050926 47.30800 4.317992 -10.11366      10.02818 
1 1 1 -22 26 8  f 31.53131 4.953184 13.25109       3.680614 11.88077       7.383554 13.70419       4.245737 27.44299 9.285523 31.64991 5.715101 -4.206926      10.90336 
1 1 1 -22 26 9  o 42.83997 3.934065 23.57694       4.061201 28.32345       8.532413 22.18664       4.617836 43.45648 8.360633 41.10876 4.693664 2.347725       9.588048 
1 1 1 -22 26 10 o 30.27689 5.281403 12.37670       3.755061 14.77481       7.566572 11.59310       4.325269 30.34743 9.328907 28.68698 6.354681 1.660452       11.28762 
1 1 1 -22 26 11 o 36.51748 4.884592 17.66958       4.237841 26.58267       12.22966 16.45327       4.517752 37.80850 11.89837 34.85817 5.500610 2.950329       13.10831 
1 1 1 -22 26 12 o 43.87049 3.889934 24.71768       4.115574 22.68847       7.251117 25.68205       4.998756 39.12775 7.877601 44.20925 4.712504 -5.081497      9.179558 
1 1 1 -22 26 13 o 63.98856 3.861859 52.42261       5.993888 40.51736       10.50060 58.17644       7.300011 51.57845 8.660966 66.84380 4.507893 -15.26535      9.763884 
1 1 1 -22 26 14 o 30.69604 5.959932 13.11517       4.297428 12.58137       7.937319 13.33654       5.111411 27.71305 9.619622 30.22766 7.066370 -2.514612      11.93611 
1 1 1 -22 26 15 o 28.41586 7.930447 12.35290       5.699520 1.550639       7.248448 29.84969       9.225012 18.71607 8.228130 43.56967 8.987000 -24.85360      12.18476 
1 1 1 -22 26 16 o 14.67007 6.036459 1.616377       3.473814 7.721223       6.592190 -0.7305657     4.087366 22.96869 8.651863 13.46988 6.034699 9.498814       10.54857 
1 1 1 -22 26 17 o 42.31627 3.905451 23.16860       3.981894 15.01186       6.875527 27.28508       4.884394 30.45850 8.782009 45.55959 4.456337 -15.10108      9.847976 
1 1 1 -22 26 18 o 60.65793 3.311750 46.77678       4.876750 36.63654       8.052881 52.64931       6.128294 50.56258 6.700374 63.80056 3.961197 -13.23798      7.783707 
1 1 1 -22 26 19 o 17.06010 6.309288 3.697613       3.473788 13.38608       6.701056 0.1372140      4.062237 28.43744 8.785799 13.99579 6.156103 14.44166       10.72790 
1 1 1 -22 26 20 o 11.20338 5.248853 -2.648593      3.598131 -8.952670      10.24277 -1.761153      3.843054 16.64603 8.077126 12.20861 5.616918 4.437424       9.838177 
1 1 1 -22 26 21 o 25.37123 6.115024 9.356703       3.736056 11.88041       6.915006 8.316330       4.439843 26.38117 8.985355 23.32340 7.141641 3.057770       11.47779 
1 1 1 -22 26 22 o 18.44256 6.459425 4.782560       3.583305 -2.529469      6.800910 7.592512       4.215970 15.58928 7.275034 22.34125 6.979596 -6.751971      10.08171 
1 1 1 -22 26 23 o 31.11819 5.258690 13.48805       3.845810 10.54073       6.709755 14.93003       4.693225 24.79753 8.825209 31.98849 6.244809 -7.190952      10.81120 
1 1 1 -22 26 24 f 12.43340 5.900312 -3.813830      4.819521 2.350433       10.22431 -5.574798      5.464737 20.05839 9.203877 12.55241 6.043683 7.505981       11.01079 
1 1 1 -22 27 1  o 38.78598 4.053909 19.66254       3.775124 27.76811       6.653843 15.81480       4.584410 44.15829 6.367077 33.59158 5.810585 10.56671       8.619894 
1 1 1 -22 27 2  o 11.13226 5.090482 -1.426642      3.091701 -2.556159      4.995072 -0.7252044     3.936314 13.57388 6.300716 13.16300 5.907728 0.4108753      8.637144 
1 1 1 -22 27 3  f 16.41677 6.022130 3.346718       3.154026 -1.665071      5.429653 5.899117       3.874806 14.70455 6.732277 20.32260 6.724229 -5.618046      9.515189 
1 1 1 -22 27 4  o 10.90480 5.017579 -1.694068      3.067786 -0.9461920     5.527021 -2.027067      3.688061 15.28424 6.917205 11.84827 5.469576 3.435977       8.818389 
1 1 1 -22 27 5  o 51.25839 3.711516 33.71871       4.604695 20.39646       8.145308 39.97606       5.582310 35.15416 9.347433 55.48150 4.159127 -20.32734      10.23098 
1 1 1 -22 27 6  o 10.90112 5.020617 -1.756162      3.081683 5.453074       6.166463 -4.156024      3.557825 20.72171 8.212550 10.34391 4.953059 10.37780       9.590556 
1 1 1 -22 27 7  o 16.09649 6.158362 2.923610       3.371680 -3.899477      5.992218 6.084625       4.078594 14.33734 6.735050 20.68762 6.900435 -6.350286      9.642453 
1 1 1 -22 27 8  o 23.45195 6.549481 7.958691       3.885980 1.606945       6.301932 11.85560       4.936141 17.84542 7.762236 28.28877 7.156311 -10.44335      10.55770 
1 1 1 -22 27 9  o 23.69274 6.626435 8.149570       3.974716 8.499620       6.616740 7.951942       4.971688 23.72399 8.719161 23.11953 7.615339 0.6044655      11.57658 
1 1 1 -22 27 10 o 54.16567 4.096802 38.00464       5.367514 33.90829       9.319155 40.03814       6.565977 46.98429 8.449950 54.85747 4.965365 -7.873177      9.800842 
1 1 1 -22 27 11 f 12.06216 5.678804 -3.454862      4.301737 0.000000       0.000000 -3.454862      4.301737 ?        ?        12.06216 5.678804 0.000000       5.678804 
1 1 1 -22 27 12 o 23.46486 6.533984 7.994672       3.873704 7.577085       6.234516 8.257254       4.943804 22.68932 8.440924 23.44664 7.585668 -0.7573185     11.34864 
1 1 1 -22 27 13 o 31.76152 4.960297 13.60843       3.713787 10.97302       6.515315 14.87681       4.519977 26.14380 8.721478 32.61536 5.904242 -6.471554      10.53206 
1 1 1 -22 27 14 o 69.87057 3.741698 62.69841       6.347641 51.91999       8.842983 74.15549       9.117131 61.15625 6.011249 74.46509 5.054180 -13.30884      7.853652 
1 1 1 -22 27 15 o 18.32954 6.328540 4.599079       3.433350 -5.177510      5.706448 10.14621       4.298397 13.27703 6.334365 26.24147 6.699549 -12.96443      9.219986 
1 1 1 -22 27 16 o 38.22653 4.247461 19.23716       3.889954 17.27632       6.909609 20.14701       4.706697 32.63813 8.577007 38.48874 5.147090 -5.850613      10.00288 
1 1 1 -22 27 17 o 16.37733 6.150352 3.298845       3.325769 0.4492305      5.827952 4.674956       4.049951 16.32357 7.266752 18.58188 6.822776 -2.258305      9.967746 
1 1 1 -22 27 18 o 21.71815 6.249381 6.899503       3.484994 5.766901       6.044897 7.463362       4.265160 20.51161 8.130586 22.24044 7.030289 -1.728832      10.74855 
1 1 1 -22 27 19 o 54.10376 4.665505 39.16124       6.091204 31.97947       8.235260 47.83611       9.050922 45.63984 7.676733 57.42311 6.587118 -11.78328      10.11545 
1 1 1 -22 27 20 o 39.85344 4.894368 21.57855       4.653643 16.18040       11.73400 22.58609       5.069362 27.75773 11.21667 40.46753 5.265291 -12.70979      12.39100 
1 1 1 -22 27 21 o 59.46475 3.347422 45.37977       4.831135 42.22977       8.301764 46.99279       5.940667 53.86273 6.453084 59.76702 4.103753 -5.904293      7.647423 
1 1 1 -22 27 22 o 12.14484 5.463634 -0.6479324     3.388971 -1.126928      6.229775 -0.4466030     4.038874 15.55954 7.156008 13.31486 5.979372 2.244671       9.325306 
1 1 1 -22 28 1  o 14.20298 5.734524 1.873867       3.064151 5.975965       4.649948 -1.274559      4.073726 20.16672 7.325299 12.83504 5.859278 7.331687       9.380360 
1 1 1 -22 28 2  o 21.25049 6.181171 6.610850       3.392428 4.832526       5.404009 7.767463       4.358174 19.29061 7.674266 22.55729 7.103396 -3.266682      10.45718 
1 1 1 -22 28 3  o 26.33830 6.086700 10.04266       3.828280 14.10151       6.234197 7.585544       4.850554 29.38995 8.326770 22.24804 7.526098 7.141907       11.22396 
1 1 1 -22 28 4  o 45.41807 4.284976 27.18971       4.686509 26.78477       7.786779 27.41969       5.868365 41.52926 7.984228 44.54387 5.524551 -3.014603      9.709200 
1 1 1 -22 28 5  o 21.08760 7.932972 6.443579       5.538233 4.815207       6.322220 11.81496       11.48248 19.91509 8.163528 25.79194 10.82288 -5.876842      13.55647 
1 1 1 -22 28 6  o 16.26035 6.162982 3.173772       3.356906 10.85148       6.145094 -0.9190501E-01 4.007738 25.84696 8.463957 13.71474 6.069970 12.13222       10.41552 
1 1 1 -22 28 7  o 13.57778 5.747478 0.9458433      3.283813 1.380503       6.100711 0.7685375      3.896433 17.25497 7.568376 14.28886 6.159353 2.966105       9.757968 
1 1 1 -22 28 8  o 32.76870 5.030029 14.59987       3.888541 7.379275       7.258827 17.50595       4.605042 22.43511 8.904320 35.60286 5.483543 -13.16775      10.45735 
1 1 1 -22 28 9  o 15.15795 6.034424 2.293180       3.343570 -7.488790      6.364110 6.022649       3.929597 13.20234 6.396845 20.39057 6.772469 -7.188225      9.315899 
1 1 1 -22 28 10 o 28.80032 5.662061 11.64608       3.832100 1.342155       7.282220 15.59210       4.506528 18.24972 8.123664 33.36505 5.750166 -15.11533      9.952805 
1 1 1 -22 28 11 o 28.55159 5.745485 11.50489       3.858975 19.48214       8.105331 9.166630       4.388244 33.61497 9.484455 24.66122 6.985719 8.953747       11.77944 
1 1 1 -22 28 12 o 20.17566 6.455909 5.896490       3.587596 6.931796       7.326494 5.569944       4.114662 21.99308 8.871737 19.74565 6.921357 2.247433       11.25224 
1 1 1 -22 28 13 o 49.47869 3.730777 31.66918       4.465215 24.82183       7.587857 35.29652       5.522701 39.79224 8.100716 51.64794 4.430727 -11.85570      9.233252 
1 1 1 -22 28 14 f 13.88617 6.153464 -0.3733716E-01 4.131262 -2.043719      5.549480 2.456843       6.187417 14.47954 6.693154 17.95388 7.750574 -3.474340      10.24059 
1 1 1 -22 28 15 f 31.68393 4.916158 13.68494       3.672843 11.79503       6.323933 14.64692       4.511775 26.59016 8.577415 32.00743 6.004945 -5.417267      10.47050 
1 1 1 -22 28 16 o 15.51452 6.127387 2.608156       3.421632 -2.075110      5.840990 5.054861       4.221850 14.76665 6.840166 19.00833 6.968258 -4.241681      9.764450 
1 1 1 -22 28 17 o 12.84039 5.603355 0.2518637      3.306656 2.707862       6.162646 -0.7410956     3.918492 17.99155 7.750703 12.98232 5.854635 5.009224       9.713400 
1 1 1 -22 28 18 o 17.04700 6.335934 3.815919       3.511168 9.591843       6.296617 1.209414       4.229858 23.98035 8.547619 14.94016 6.428560 9.040188       10.69524 
1 1 1 -22 28 19 o 28.81344 6.443706 12.34441       4.410878 14.62393       11.59549 11.95876       4.769426 26.49103 10.97693 27.85598 7.027599 -1.364956      13.03381 
1 1 1 -22 28 20 o 15.61821 6.158450 2.763260       3.451425 0.6405160      6.119378 3.753563       4.179674 16.44005 7.373222 17.31447 6.792300 -0.8744183     10.02496 
1 1 1 -22 29 1  o 9.279860 4.412037 -2.763685      2.719886 -1.537481      4.632580 -3.408723      3.359962 13.37146 6.157378 10.19614 4.863407 3.175315       7.846402 
1 1 1 -22 29 2  o 36.40174 4.480583 17.85093       3.890828 14.76455       6.956891 19.25572       4.693508 28.87855 8.956985 37.11478 5.343123 -8.236229      10.42960 
1 1 1 -22 29 3  o 15.39107 5.943606 2.781074       3.161008 -2.393574      5.297516 5.642171       3.939111 13.81888 6.439495 19.56098 6.777441 -5.742106      9.348840 
1 1 1 -22 29 4  o 15.55066 5.894098 2.944134       3.070413 -1.778141      5.112431 5.608423       3.840099 13.94394 6.437985 19.54374 6.694968 -5.599794      9.288177 
1 1 1 -22 29 5  o 11.33834 5.352993 -3.113066      3.871056 -1.048396      4.936030 -6.411730      6.239093 14.17187 6.461918 13.27113 6.406677 0.9007416      9.099555 
1 1 1 -22 29 6  o 11.07656 5.070951 -1.339134      3.079931 -3.214385      5.409912 -0.4398647     3.746323 13.59987 6.392019 12.93011 5.786306 0.6697617      8.622021 
1 1 1 -22 29 7  o 18.25618 6.381862 4.684120       3.496731 0.6616538      6.306767 6.469472       4.201675 16.75571 7.502264 20.76849 7.004677 -4.012781      10.26399 
1 1 1 -22 29 8  o 10.88179 5.062496 -2.074803      3.252937 -2.433354      5.952467 -1.922127      3.884249 14.68181 6.836365 12.10531 5.597064 2.576494       8.835327 
1 1 1 -22 29 9  o 26.13976 6.029873 9.927014       3.762764 5.342687       6.863452 11.89695       4.499157 20.33950 8.438087 28.20791 6.653751 -7.868414      10.74587 
1 1 1 -22 29 10 o 12.03400 5.542129 -1.704904      3.754562 0.000000       0.000000 -1.704904      3.754562 ?        ?        12.03400 5.542129 0.000000       5.542129 
1 1 1 -22 29 11 o 47.11169 3.871744 28.96780       4.405807 21.91010       8.733017 31.37742       5.102789 34.73882 9.859676 48.62634 4.352229 -13.88752      10.77753 
1 1 1 -22 29 12 o 32.01245 5.328090 14.27341       4.010456 15.27335       7.956107 13.93278       4.643552 28.89528 9.637648 30.79644 6.396794 -1.901159      11.56733 
1 1 1 -22 29 13 o 21.70286 6.514097 7.042194       3.719435 13.00875       7.267330 4.924626       4.329438 27.08008 9.211622 18.82277 7.027831 8.257311       11.58639 
1 1 1 -22 29 14 o 15.82966 6.168919 2.912162       3.428952 -4.300806      5.714815 6.969686       4.286233 13.46522 6.400053 21.37686 7.072182 -7.911634      9.538157 
1 1 1 -22 29 15 o 11.84838 5.345698 -0.7794992     3.271150 0.8945272      5.557649 -1.666840      4.046273 16.10906 7.137891 12.49167 5.753085 3.617385       9.167741 
1 1 1 -22 29 16 o 27.85756 5.592146 11.06845       3.664226 9.884707       6.428566 11.63811       4.459590 24.11153 8.631949 27.73758 6.678172 -3.626057      10.91369 
1 1 1 -22 29 17 o 23.67676 6.096592 8.290651       3.538661 8.903614       6.311419 8.009616       4.273563 23.10548 8.511552 22.71384 7.016031 0.3916340      11.03047 
1 1 1 -22 30 1  o 20.19721 6.010910 6.101238       3.177315 12.59905       5.340275 2.540645       3.953131 27.61370 7.665247 15.66230 6.441546 11.95141       10.01247 
1 1 1 -22 30 2  o 13.99409 6.006614 1.110233       3.675620 0.000000       0.000000 1.110233       3.675620 ?        ?        13.99409 6.006614 0.000000       6.006614 
1 1 1 -22 30 3  o 29.68943 5.253595 12.43861       3.661919 15.73773       6.963099 11.17731       4.305383 29.61363 8.918351 27.04976 6.592544 2.563875       11.09047 
1 1 1 -22 30 4  o 15.41434 5.880350 2.921238       3.068352 -1.974131      5.081291 5.730722       3.849414 13.67527 6.350209 19.54737 6.702872 -5.872097      9.233290 
1 1 1 -22 30 5  o 21.78135 7.286651 7.481327       4.547410 6.868076       5.947296 8.344509       7.055895 21.00177 8.141139 22.37655 8.810900 -1.374775      11.99625 
1 1 1 -22 30 6  o 11.95711 5.334090 -0.3587038     3.157242 0.6258777      5.480191 -0.8478548     3.862704 15.74754 7.026114 12.71442 5.765554 3.033124       9.088889 
1 1 1 -22 30 7  o 13.58968 5.793978 1.017053       3.378491 -5.671016      6.314402 3.699617       3.999050 13.54935 6.516752 17.09419 6.661942 -3.544841      9.319309 
1 1 1 -22 30 8  o 10.58977 4.964351 -2.354163      3.226840 -2.749697      6.067019 -2.198137      3.810499 14.51967 6.806781 11.73216 5.465204 2.787504       8.729302 
1 1 1 -22 30 9  o 29.38848 5.544974 12.29250       3.825556 9.934930       7.223547 13.21148       4.509937 23.85595 9.040876 29.79686 6.401937 -5.940914      11.07801 
1 1 1 -22 30 10 o 43.21731 5.080689 25.74498       5.248680 0.000000       0.000000 25.74498       5.248680 ?        ?        43.21731 5.080689 0.000000       5.080689 
1 1 1 -22 30 11 o 22.80336 6.160501 7.738587       3.503604 2.896063       6.779266 9.503358       4.092521 18.33379 8.011418 24.98578 6.617467 -6.651993      10.39104 
1 1 1 -22 30 12 o 17.66866 6.448037 4.322073       3.608857 3.586110       7.735441 4.526825       4.080098 19.31704 8.495919 18.11693 6.810404 1.200109       10.88863 
1 1 1 -22 30 13 o 19.01415 7.438128 5.007981       5.000476 2.196734       7.177603 7.659283       6.970429 18.15735 8.074874 21.89191 8.713633 -3.734552      11.87986 
1 1 1 -21 0  1  o 101.8392 3.370769 126.9574       8.344489 126.9574       8.344489 126.9574       8.344489 101.8392 3.370769 101.8392 3.370769 0.000000       0.000000 
1 1 1 -21 0  2  o 35.78202 4.738203 16.43954       3.929813 16.43954       3.929813 16.43954       3.929813 35.78202 4.738203 35.78202 4.738203 -0.000000      0.000000 
1 1 1 -21 0  3  o 57.05353 4.296854 40.41547       5.894269 40.41547       5.894269 40.41547       5.894269 57.05353 4.296854 57.05353 4.296854 0.000000       0.000000 
1 1 1 -21 0  4  o 15.93809 8.683971 4.388034       4.778667 4.388034       4.778667 4.388034       4.778667 15.93809 8.683971 15.93809 8.683971 0.000000       0.000000 
1 1 1 -21 0  5  o 206.4897 4.222530 521.2083       21.22742 521.2083       21.22742 521.2083       21.22742 206.4897 4.222530 206.4897 4.222530 0.000000       0.000000 
1 1 1 -21 0  6  o 75.57099 3.305420 70.06725       6.060636 70.06725       6.060636 70.06725       6.060636 75.57099 3.305420 75.57099 3.305420 0.000000       0.000000 
1 1 1 -21 0  7  o 196.9596 4.995469 474.8807       23.94186 474.8807       23.94186 474.8807       23.94186 196.9596 4.995469 196.9596 4.995469 0.000000       0.000000 
1 1 1 -21 0  8  f 180.9751 7.148746 403.1608       31.41519 403.1608       31.41519 403.1608       31.41519 180.9751 7.148746 180.9751 7.148746 0.000000       0.000000 
1 1 1 -21 0  9  o 47.25384 4.974529 28.17047       5.569216 28.17047       5.569216 28.17047       5.569216 47.25384 4.974529 47.25384 4.974529 -0.000000      0.000000 
1 1 1 -21 0  10 o 180.8628 4.759554 400.4031       20.94457 400.4031       20.94457 400.4031       20.94457 180.8628 4.759554 180.8628 4.759554 -0.000000      0.000000 
1 1 1 -21 0  11 o 8.373093 5.755618 -2.734226      3.829921 -2.734226      3.829921 -2.734226      3.829921 8.373093 5.755618 8.373093 5.755618 0.000000       0.000000 
1 1 1 -21 0  12 o 7.491718 5.281135 -4.498747      3.824903 -4.498747      3.824903 -4.498747      3.824903 7.491718 5.281135 7.491718 5.281135 -0.000000      0.000000 
1 1 1 -21 0  13 o 217.1040 5.283899 577.1766       27.91752 577.1766       27.91752 577.1766       27.91752 217.1040 5.283899 217.1040 5.283899 0.000000       0.000000 
1 1 1 -21 0  14 o 170.5634 4.607377 356.1306       19.11871 356.1306       19.11871 356.1306       19.11871 170.5634 4.607377 170.5634 4.607377 -0.000000      0.000000 
1 1 1 -21 0  15 o 133.6863 5.713573 219.8127       18.53607 219.8127       18.53607 219.8127       18.53607 133.6863 5.713573 133.6863 5.713573 0.000000       0.000000 
1 1 1 -21 0  16 o 127.3895 4.123777 198.7787       12.77121 198.7787       12.77121 198.7787       12.77121 127.3895 4.123777 127.3895 4.123777 -0.000000      0.000000 
1 1 1 -21 0  17 o 131.5110 4.151251 211.8506       13.27380 211.8506       13.27380 211.8506       13.27380 131.5110 4.151251 131.5110 4.151251 0.000000       0.000000 
1 1 1 -21 0  18 o 130.1512 4.134540 207.5243       13.08329 207.5243       13.08329 207.5243       13.08329 130.1512 4.134540 130.1512 4.134540 -0.000000      0.000000 
1 1 1 -21 0  19 o 59.57483 4.450777 44.09131       6.376672 44.09131       6.376672 44.09131       6.376672 59.57483 4.450777 59.57483 4.450777 -0.000000      0.000000 
1 1 1 -21 0  20 o 29.75045 8.048908 12.97519       5.042793 12.97519       5.042793 12.97519       5.042793 29.75045 8.048908 29.75045 8.048908 -0.000000      0.000000 
1 1 1 -21 0  21 o 11.32960 7.221302 0.4080201      4.403664 0.4080201      4.403664 0.4080201      4.403664 11.32960 7.221302 11.32960 7.221302 -0.000000      0.000000 
1 1 1 -21 0  22 o 17.80897 9.070734 5.759887       4.942971 5.759887       4.942971 5.759887       4.942971 17.80897 9.070734 17.80897 9.070734 0.000000       0.000000 
1 1 1 -21 0  23 f 17.82199 9.946561 5.404505       6.438991 5.404505       6.438991 5.404505       6.438991 17.82199 9.946561 17.82199 9.946561 0.000000       0.000000 
1 1 1 -21 0  24 f 103.4572 4.063476 131.5386       10.20862 131.5386       10.20862 131.5386       10.20862 103.4572 4.063476 103.4572 4.063476 -0.000000      0.000000 
1 1 1 -21 0  25 o 9.228646 6.293902 -2.558486      4.382999 -2.558486      4.382999 -2.558486      4.382999 9.228646 6.293902 9.228646 6.293902 -0.000000      0.000000 
1 1 1 -21 0  26 o 21.11687 9.235429 7.947253       4.947017 7.947253       4.947017 7.947253       4.947017 21.11687 9.235429 21.11687 9.235429 -0.000000      0.000000 
1 1 1 -21 0  27 o 72.54865 4.325959 65.23112       7.585138 65.23112       7.585138 65.23112       7.585138 72.54865 4.325959 72.54865 4.325959 0.000000       0.000000 
1 1 1 -21 0  28 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -21 0  29 o 37.43710 6.636351 18.89417       5.487040 18.89417       5.487040 18.89417       5.487040 37.43710 6.636351 37.43710 6.636351 0.000000       0.000000 
1 1 1 -21 0  30 o 14.99829 8.555809 3.782342       4.902252 3.782342       4.902252 3.782342       4.902252 14.99829 8.555809 14.99829 8.555809 -0.000000      0.000000 
1 1 1 -21 0  31 o 54.02267 5.132524 37.08331       6.608127 37.08331       6.608127 37.08331       6.608127 54.02267 5.132524 54.02267 5.132524 -0.000000      0.000000 
1 1 1 -21 0  32 o 26.44001 9.313404 11.63873       5.445274 11.63873       5.445274 11.63873       5.445274 26.44001 9.313404 26.44001 9.313404 0.000000       0.000000 
1 1 1 -21 0  33 o 47.03064 5.929261 28.96898       6.502426 28.96898       6.502426 28.96898       6.502426 47.03064 5.929261 47.03064 5.929261 0.000000       0.000000 
1 1 1 -21 0  34 f 56.23264 5.314511 40.62766       7.124198 40.62766       7.124198 40.62766       7.124198 56.23264 5.314511 56.23264 5.314511 -0.000000      0.000000 
1 1 1 -21 0  35 o 28.02155 9.421580 13.14756       5.744891 13.14756       5.744891 13.14756       5.744891 28.02155 9.421580 28.02155 9.421580 -0.000000      0.000000 
1 1 1 -21 0  36 o 14.57733 8.667578 3.584252       5.380517 3.584252       5.380517 3.584252       5.380517 14.57733 8.667578 14.57733 8.667578 -0.000000      0.000000 
1 1 1 -21 0  37 o 15.84147 9.809234 3.879699       7.513736 3.879699       7.513736 3.879699       7.513736 15.84147 9.809234 15.84147 9.809234 0.000000       0.000000 
1 1 1 -21 0  38 o 10.83195 7.216113 -0.7112430     5.151162 -0.7112430     5.151162 -0.7112430     5.151162 10.83195 7.216113 10.83195 7.216113 0.000000       0.000000 
1 1 1 -21 0  39 o 14.11215 8.676558 3.243028       5.780098 3.243028       5.780098 3.243028       5.780098 14.11215 8.676558 14.11215 8.676558 0.000000       0.000000 
1 1 1 -21 0  40 o 11.53369 7.535988 0.5879261      5.204769 0.5879261      5.204769 0.5879261      5.204769 11.53369 7.535988 11.53369 7.535988 -0.000000      0.000000 
1 1 1 -21 0  41 o 9.464931 6.525746 -2.566081      5.011705 -2.566081      5.011705 -2.566081      5.011705 9.464931 6.525746 9.464931 6.525746 0.000000       0.000000 
1 1 1 -21 0  42 o 10.58528 7.186833 -1.317789      5.582659 -1.317789      5.582659 -1.317789      5.582659 10.58528 7.186833 10.58528 7.186833 0.000000       0.000000 
1 1 1 -21 1  1  o 38.47165 3.102123 18.19288       2.883638 18.72453       4.035985 17.63846       4.121520 38.87484 4.333967 37.67787 4.583004 1.196972       6.307709 
1 1 1 -21 1  2  o 193.4657 2.900217 456.9696       13.67321 452.2274       19.18513 461.8648       19.49221 192.2675 4.094706 194.3012 4.116702 -2.033722      5.806363 
1 1 1 -21 1  3  o 92.28931 2.319282 103.9745       5.211909 102.5207       7.290681 105.4939       7.453521 91.55573 3.272998 92.87280 3.298580 -1.317062      4.646843 
1 1 1 -21 1  4  o 186.9994 2.823932 426.8521       12.86858 432.6018       18.31009 421.2399       18.08975 188.0834 3.994880 185.5962 3.999698 2.487183       5.653022 
1 1 1 -21 1  5  o 86.60550 2.284106 91.56023       4.816355 101.3914       7.004306 82.74236       6.633519 91.06487 3.161092 82.23839 3.316845 8.826477       4.581918 
1 1 1 -21 1  6  o 83.44172 2.898460 85.09487       5.884732 81.88239       7.956600 88.97419       8.743480 81.73416 4.006946 85.18094 4.225358 -3.446777      5.823166 
1 1 1 -21 1  7  o 112.1831 3.393896 153.8718       9.267491 155.7077       11.01754 149.4300       17.13695 112.7737 4.015455 110.0612 6.417279 2.712425       7.570029 
1 1 1 -21 1  8  o 133.4098 2.943600 217.2763       9.569792 214.8570       13.57415 219.6669       13.49366 132.4666 4.210390 133.9536 4.138670 -1.486984      5.903895 
1 1 1 -21 1  9  o 151.8726 3.627843 281.8594       13.42654 319.9201       26.14008 268.2195       15.64852 161.1099 6.672515 147.9960 4.343676 13.11388       7.961782 
1 1 1 -21 1  10 o 103.7783 2.809862 131.5536       7.099502 128.9337       10.12282 134.0898       9.959588 102.5998 4.056729 104.6531 3.912175 -2.053329      5.635794 
1 1 1 -21 1  11 o 62.88468 2.950809 48.38342       4.509301 46.59063       6.380862 50.17200       6.373373 61.56292 4.279930 63.91677 4.113680 -2.353855      5.936343 
1 1 1 -21 1  12 o 114.5609 2.847022 160.2072       7.948102 169.9252       11.60170 151.6122       10.91072 117.8047 4.047328 111.2703 4.030477 6.534401       5.711883 
1 1 1 -21 1  13 o 142.6689 3.003961 248.5272       10.44383 245.0107       14.76984 252.0437       14.76977 141.4381 4.290180 143.4659 4.229248 -2.027817      6.024299 
1 1 1 -21 1  14 o 107.1967 3.168175 140.4677       8.267035 142.1207       14.12600 139.6067       10.19535 107.4951 5.409941 106.7749 3.924970 0.7202148      6.683775 
1 1 1 -21 1  15 o 30.93029 5.793672 12.12653       4.206473 10.58175       6.110809 13.51775       5.799125 28.87990 8.264391 32.45138 7.485715 -3.571476      11.15061 
1 1 1 -21 1  16 o 53.12604 3.583632 34.65748       4.612310 39.03491       5.989291 28.27841       7.230098 56.29220 4.401033 47.51175 6.407843 8.780449       7.773644 
1 1 1 -21 1  17 o 172.7918 3.265963 364.8457       13.75215 363.7906       19.52710 365.8840       19.37079 172.2231 4.657032 172.7306 4.606061 -0.5075073     6.550095 
1 1 1 -21 1  18 o 55.24233 3.184155 37.41448       4.268333 38.56765       6.211010 36.38250       5.875613 55.90604 4.599625 54.30651 4.479620 1.599522       6.420556 
1 1 1 -21 1  19 o 36.59292 4.137648 16.60634       3.625013 23.72125       5.297267 10.34006       4.971327 43.66579 5.072518 28.36670 7.184918 15.29908       8.795083 
1 1 1 -21 1  20 o 48.40613 3.462986 28.80695       4.057968 28.88055       5.835370 28.73802       5.646933 48.22950 5.039281 48.13675 4.881344 0.9274292E-01  7.015830 
1 1 1 -21 1  21 o 21.04246 6.178293 5.563216       3.375406 6.520256       4.855966 4.668504       4.695181 23.22163 7.518395 20.78498 7.383927 2.436655       10.53796 
1 1 1 -21 1  22 o 94.85103 2.860595 110.0704       6.604469 112.4574       9.587283 107.9146       9.111156 95.66581 4.122142 93.73366 3.997978 1.932152       5.742464 
1 1 1 -21 1  23 o 139.4129 4.244223 238.8862       14.40227 232.4005       20.27382 245.4937       20.46328 136.8776 6.093365 140.7330 5.980456 -3.855377      8.537854 
1 1 1 -21 1  24 o 74.35617 3.363086 67.87476       6.078066 63.64350       10.28263 70.14713       7.535433 71.41866 5.962576 75.45441 4.113706 -4.035759      7.243956 
1 1 1 -21 1  25 o 53.94303 3.335684 35.80697       4.363415 41.87048       6.453791 30.70148       5.922043 58.10685 4.595143 49.62219 4.963891 8.484657       6.764285 
1 1 1 -21 1  26 o 29.86210 5.242917 11.35962       3.676188 5.125828       5.160789 17.78109       5.237899 21.59641 7.733802 37.35824 5.953158 -15.76183      9.759702 
1 1 1 -21 1  27 o 40.29005 3.975544 20.18856       3.852477 25.38423       5.636538 15.63354       5.277608 44.91829 5.248151 34.79321 6.462369 10.12508       8.324981 
1 1 1 -21 1  28 o 65.23477 4.695086 53.04879       7.413855 54.32531       10.71875 51.87796       10.26548 65.21071 6.847125 63.77049 6.706007 1.440220       9.584031 
1 1 1 -21 1  29 o 21.11871 6.656210 5.633626       3.825925 4.793869       6.512710 6.076144       4.727703 22.26334 8.548584 22.22107 7.429625 0.4226875E-01  11.32597 
1 1 1 -21 1  30 o 18.74977 6.274894 4.270145       3.372217 7.892823       4.998698 1.244355       4.568371 24.57564 7.587409 16.61133 6.887165 7.964304       10.24704 
1 1 1 -21 1  31 o 52.46012 3.621463 34.24713       4.601252 32.30773       6.716046 35.96270       6.316613 50.23332 5.580439 53.30576 4.918078 -3.072433      7.438333 
1 1 1 -21 1  32 o 37.66498 4.612356 18.07634       4.145227 15.70900       5.915229 20.36070       5.810644 33.99197 7.354992 39.32769 6.273675 -5.335720      9.667208 
1 1 1 -21 1  33 o 25.14687 6.259468 8.536647       3.820683 7.788597       5.406042 9.283159       5.400485 24.10004 7.941161 25.93874 7.863354 -1.838701      11.17562 
1 1 1 -21 1  34 o 42.42145 4.972561 23.31132       5.043001 23.22537       6.341076 23.45922       8.318655 41.52443 6.477829 40.25291 8.732124 1.271523       10.87255 
1 1 1 -21 1  35 o 34.08865 5.842489 15.65047       4.678818 12.09876       8.027137 17.47805       5.758108 28.28833 9.679918 35.43132 6.917246 -7.142990      11.89744 
1 1 1 -21 1  36 o 21.65410 7.138861 6.508685       4.368674 7.910763       7.961054 5.904547       5.225794 24.19643 9.408116 21.19935 7.755667 2.997084       12.19275 
1 1 1 -21 1  37 o 36.33259 4.925575 17.52132       4.248820 16.03167       5.955982 19.06495       6.062924 32.98010 7.571136 36.44173 7.082484 -3.461624      10.36743 
1 1 1 -21 1  38 o 26.77900 7.208216 10.69574       4.807221 9.881184       6.188467 11.93515       7.633621 25.13549 8.500925 26.89535 9.427358 -1.759861      12.69413 
1 1 1 -21 1  39 o 18.26644 7.022723 4.244751       4.399091 2.196124       5.696559 7.271370       6.924047 17.41785 7.476990 22.18054 8.729881 -4.762690      11.49418 
1 1 1 -21 1  40 o 14.08536 5.992045 1.167013       3.599471 6.273789       5.405269 -2.901952      4.824872 20.52686 7.810974 12.92396 6.062355 7.602897       9.887541 
1 1 1 -21 1  41 o 34.12154 5.381357 16.45837       4.326513 14.52075       6.170197 18.33253       6.068302 29.15066 8.292298 33.88406 7.543123 -4.733397      11.20986 
1 1 1 -21 1  42 o 20.55660 6.738752 6.620839       3.894843 8.709079       5.642928 4.720851       5.382571 22.48914 8.082943 18.52689 7.556125 3.962246       11.06476 
1 1 1 -21 2  1  o 178.6383 3.059468 389.7225       13.31854 380.4660       20.72832 396.2310       17.38119 176.1361 4.833821 179.9835 3.962878 -3.847412      6.250618 
1 1 1 -21 2  2  o 168.1379 2.690344 345.0590       11.02325 340.7607       15.43526 349.5332       15.74790 166.9439 3.794087 169.0748 3.822148 -2.130905      5.385528 
1 1 1 -21 2  3  o 255.8350 3.458166 799.7371       21.55966 837.8371       31.29189 765.3069       29.74670 261.4852 4.910758 249.9185 4.884323 11.56676       6.926193 
1 1 1 -21 2  4  o 74.48072 2.343583 67.74405       4.248342 72.66047       6.000547 62.80293       6.015606 77.06584 3.202137 71.61249 3.457319 5.453354       4.712403 
1 1 1 -21 2  5  f 174.4895 3.377423 371.9353       14.36121 385.6635       20.38511 358.4082       20.23534 177.4008 4.719624 170.9828 4.861420 6.417999       6.775563 
1 1 1 -21 2  6  o 155.2542 3.210588 294.3717       12.14686 283.9059       16.69855 306.1328       17.70183 152.2334 4.506207 158.0674 4.600467 -5.834045      6.439736 
1 1 1 -21 2  7  o 74.81231 2.560714 68.37433       4.661541 72.13790       7.670359 66.17022       5.869920 76.69035 4.119415 73.53215 3.284098 3.158195       5.268290 
1 1 1 -21 2  8  o 63.59870 2.957657 49.48578       4.571314 50.61820       6.681143 48.48902       6.268225 64.18027 4.296571 62.83220 4.116467 1.348080       5.950279 
1 1 1 -21 2  9  o 130.1721 2.931468 206.8602       9.299060 215.9885       13.56027 198.7567       12.77642 132.8142 4.195007 127.4118 4.120356 5.402367       5.880087 
1 1 1 -21 2  10 o 29.91282 5.475941 11.31474       3.844596 19.17989       9.209617 9.654820       4.230886 38.52977 9.790255 27.47846 6.432585 11.05131       11.71440 
1 1 1 -21 2  11 o 190.4206 3.447853 442.9993       15.99922 450.1494       23.07263 436.3769       22.20493 191.6164 4.945286 188.6865 4.833148 2.929886       6.914852 
1 1 1 -21 2  12 o 46.05757 3.439553 26.06021       3.832584 25.85983       5.682171 26.22745       5.191225 45.63802 5.201947 46.04457 4.692019 -0.4065552     7.005376 
1 1 1 -21 2  13 o 159.2663 3.575910 309.9909       13.87863 307.0245       23.58813 311.5616       17.16401 157.9289 6.140791 159.4836 4.420645 -1.554703      7.566466 
1 1 1 -21 2  14 f 84.95235 3.116964 88.25578       6.441787 87.28484       11.06853 88.75310       7.921576 84.17189 5.425076 85.11298 3.829069 -0.9410934     6.640272 
1 1 1 -21 2  15 o 75.11271 2.856468 68.98101       5.218993 70.63268       7.653317 67.54531       7.135410 75.86400 4.155657 74.20734 3.960150 1.656654       5.740407 
1 1 1 -21 2  16 o 116.8950 3.268794 167.0840       9.302354 170.5424       11.76196 161.3076       15.20079 117.9812 4.097229 114.4907 5.464057 3.490517       6.829584 
1 1 1 -21 2  17 o 59.97961 3.051920 44.05907       4.446139 38.40392       6.430976 49.23719       6.153761 55.76672 4.778234 63.30403 4.009688 -7.537308      6.237718 
1 1 1 -21 2  18 o 104.3748 2.813051 133.1392       7.148471 128.5063       10.28879 137.4626       9.939197 102.3619 4.133179 105.9182 3.857183 -3.556366      5.653409 
1 1 1 -21 2  19 o 33.81926 4.355920 14.24441       3.506604 15.81868       5.327484 13.04101       4.657871 35.27734 6.434119 31.99891 6.197249 3.278431       8.933296 
1 1 1 -21 2  20 o 61.12400 3.068233 45.77869       4.555597 40.93857       6.669325 50.01233       6.237505 57.55040 4.799159 63.77000 4.034507 -6.219597      6.269703 
1 1 1 -21 2  21 o 66.92434 2.985262 54.85587       4.856330 53.13989       7.127340 56.34290       6.634853 65.65296 4.481766 67.68357 4.041046 -2.030609      6.034591 
1 1 1 -21 2  22 o 108.7757 3.351384 144.9452       8.873070 149.0133       11.14563 137.9050       14.66232 110.1345 4.160321 105.5555 5.721532 4.579041       7.074193 
1 1 1 -21 2  23 o 61.15977 3.190568 45.90274       4.738770 40.84348       6.908190 50.39911       6.512559 57.37479 4.990510 63.93184 4.203533 -6.557045      6.524943 
1 1 1 -21 2  24 o 35.59608 4.926382 15.90919       4.158906 19.16121       7.586049 14.51177       4.972822 38.30223 8.362516 33.66630 6.292687 4.635929       10.46564 
1 1 1 -21 2  25 o 100.7468 3.361075 124.5897       8.240187 130.3855       10.43938 115.0099       13.42136 102.8625 4.173347 96.10357 5.757267 6.758888       7.110763 
1 1 1 -21 2  26 o 54.31367 3.391400 36.34285       4.466338 31.23797       6.362158 41.30333       6.271529 49.92436 5.310858 57.68643 4.496826 -7.762070      6.958927 
1 1 1 -21 2  27 o 10.21527 4.810153 -3.304101      3.088825 3.835197       4.948306 -7.861841      3.953698 19.89396 7.495405 9.808175 4.814470 10.08578       8.908435 
1 1 1 -21 2  28 o 23.17757 6.764798 6.941594       4.057130 3.599851       7.790174 8.185330       4.752530 22.60548 9.137665 25.08189 7.321919 -2.476410      11.70929 
1 1 1 -21 2  29 o 25.44451 6.717674 8.522285       4.225923 8.238984       5.294708 9.019488       7.014321 25.20115 7.813642 26.73654 9.050350 -1.535383      11.95667 
1 1 1 -21 2  30 o 54.41468 3.545213 36.73150       4.675450 32.95260       6.971159 39.82106       6.303333 50.79643 5.731617 56.32072 4.633623 -5.524288      7.370339 
1 1 1 -21 2  31 o 17.81903 6.525214 3.440103       3.700512 -3.475951      5.752884 8.321432       4.833097 15.00140 6.891004 24.98577 7.407900 -9.984377      10.11746 
1 1 1 -21 2  32 o 45.71451 4.024702 26.27663       4.437839 25.99466       6.565102 26.51389       6.022100 44.54577 6.216937 45.29812 5.572783 -0.7523499     8.349025 
1 1 1 -21 2  33 o 12.53842 5.603529 -1.106651      3.500865 -1.155268      5.174780 -1.065620      4.753896 15.35546 6.840878 14.76665 6.569008 0.5888052      9.484170 
1 1 1 -21 2  34 o 28.38552 6.801314 11.14179       4.642981 20.42660       6.424970 0.9934703      6.717099 38.51287 7.107660 18.64771 8.062872 19.86517       10.74843 
1 1 1 -21 2  35 o 45.21440 4.714743 26.49744       5.118590 18.84207       9.319353 29.80444       6.125188 34.33393 10.31253 47.56414 5.378765 -13.23022      11.63096 
1 1 1 -21 2  36 o 29.42620 5.871274 11.86144       4.062554 15.33825       5.901846 8.730491       5.600621 32.47042 7.594788 24.50355 8.083205 7.966873       11.09139 
1 1 1 -21 2  37 o 40.14400 4.670222 21.18182       4.483518 22.41311       6.368367 19.97173       6.313296 39.78290 6.813900 37.19019 7.226575 2.592709       9.932404 
1 1 1 -21 2  38 o 13.46988 6.011716 -0.5554545     4.015210 -1.196266      7.566658 -0.3042873     4.737185 17.38572 7.955163 14.70359 6.548188 2.682125       10.30356 
1 1 1 -21 2  39 o 15.90498 6.527632 2.307652       4.048511 0.4129879      5.283884 5.001244       6.300181 15.70708 6.959816 20.03417 8.173357 -4.327091      10.73512 
1 1 1 -21 2  40 o 15.79045 6.515674 2.369980       4.062264 1.876707       5.410441 3.007367       6.150216 16.64662 7.216876 18.06253 7.761605 -1.415916      10.59839 
1 1 1 -21 2  41 f 20.40925 6.748568 6.386254       3.903095 10.18815       5.901596 3.430421       5.203667 24.31963 8.300510 17.51875 7.313934 6.800871       11.06310 
1 1 1 -21 2  42 o 26.00741 6.588570 10.52214       4.179782 8.465857       6.115648 12.32461       5.725800 22.09377 8.330881 26.60903 8.102921 -4.515259      11.62157 
1 1 1 -21 3  1  o 113.3225 2.640894 156.7442       7.292947 167.3603       11.55747 149.7204       9.400913 116.8890 4.063629 110.6281 3.491504 6.260941       5.357582 
1 1 1 -21 3  2  o 165.8378 2.940024 335.8022       11.88148 339.0302       18.77261 333.6450       15.34637 166.3107 4.636523 165.1864 3.812371 1.124252       6.002625 
1 1 1 -21 3  3  o 215.3670 3.397962 566.7034       17.83338 571.3282       22.89528 559.5692       28.43628 216.0553 4.348555 213.4734 5.470801 2.581894       6.988533 
1 1 1 -21 3  4  o 245.4657 3.696775 736.4999       22.11312 757.1213       28.79468 706.8547       34.52478 248.6201 4.752696 239.8826 5.906036 8.737488       7.580856 
1 1 1 -21 3  5  o 141.6710 2.752054 244.9764       9.501100 248.7845       15.16183 242.5140       12.19178 142.5131 4.370934 140.8308 3.555336 1.682343       5.634313 
1 1 1 -21 3  6  o 163.7463 2.888801 327.3208       11.52724 335.3963       18.56187 322.2513       14.70691 165.4487 4.608352 162.3725 3.716833 3.076157       5.920453 
1 1 1 -21 3  7  o 169.6857 2.932331 351.5128       12.12535 355.9295       19.48466 348.7215       15.49018 170.4260 4.696077 168.9046 3.763387 1.521423       6.017992 
1 1 1 -21 3  8  o 42.60852 3.078395 22.28294       3.174819 20.49188       5.354990 23.25371       3.942417 40.49622 5.574062 43.45595 3.759816 -2.959728      6.723569 
1 1 1 -21 3  9  o 20.01263 5.818076 5.012927       3.006282 2.712495       4.461818 6.925577       4.068412 18.31776 7.064723 23.45943 6.752809 -5.141674      9.772960 
1 1 1 -21 3  10 o 176.6248 3.870828 381.4041       16.66064 434.8848       32.68031 362.6230       19.36633 187.7017 7.157779 172.0356 4.623670 15.66614       8.521275 
1 1 1 -21 3  11 o 70.22707 3.383764 60.38801       5.773787 60.30192       12.09190 60.41343       6.571306 69.57220 7.237871 70.19049 3.856644 -0.6182938     8.201248 
1 1 1 -21 3  12 o 135.3432 3.317251 223.7625       10.94085 221.6236       18.61974 224.8905       13.52132 134.2422 5.704790 135.5319 4.098649 -1.289688      7.024496 
1 1 1 -21 3  13 o 20.25457 6.128139 5.075056       3.282251 6.152555       5.982824 4.611123       3.925777 23.71595 8.343388 20.04322 6.770788 3.672729       10.74503 
1 1 1 -21 3  14 o 229.6973 3.889022 645.2158       21.76870 654.2397       31.39865 636.8639       30.20708 230.8523 5.581370 227.8083 5.441307 3.043961       7.794838 
1 1 1 -21 3  15 o 122.7721 2.893443 184.0405       8.656665 188.8878       12.75163 179.8970       11.78963 124.1615 4.220603 121.2022 3.997129 2.959343       5.812962 
1 1 1 -21 3  16 o 18.73534 6.427964 3.952730       3.540263 5.016734       4.974299 2.860555       5.039719 21.52013 7.604537 19.22528 7.482600 2.294859       10.66857 
1 1 1 -21 3  17 o 64.43333 3.491232 50.90476       5.461352 46.47368       7.018524 57.70560       8.695060 61.38975 4.727921 68.35819 5.260128 -6.968441      7.072636 
1 1 1 -21 3  18 o 66.51270 2.958326 54.14817       4.782980 57.64238       7.186178 51.36914       6.408701 68.45768 4.329826 64.64414 4.089179 3.813538       5.955567 
1 1 1 -21 3  19 o 44.94312 3.588636 24.86585       3.897703 26.13977       5.925037 23.89401       5.175125 45.79855 5.413398 43.84741 4.928533 1.951138       7.320882 
1 1 1 -21 3  20 o 63.89587 3.083851 50.01976       4.787602 49.21468       7.023494 50.71853       6.543360 63.16654 4.594191 64.19151 4.206165 -1.024967      6.228837 
1 1 1 -21 3  21 o 112.6776 2.880674 155.2689       7.903358 152.2700       11.46598 157.9834       10.90889 111.3454 4.233450 113.4757 3.950979 -2.130295      5.790711 
1 1 1 -21 3  22 o 71.11179 3.487010 62.06485       6.024273 61.54044       7.760127 62.86024       9.557029 70.63399 4.532281 71.17564 5.553991 -0.5416489     7.168569 
1 1 1 -21 3  23 o 26.39118 5.532973 8.915962       3.444472 8.243443       5.362669 9.388268       4.494066 25.60317 7.850546 26.96371 6.832302 -1.360538      10.40728 
1 1 1 -21 3  24 o 98.77008 4.036332 120.0418       9.694657 123.6766       14.47809 117.0874       13.05301 99.67736 5.988056 97.12605 5.537868 2.551315       8.156273 
1 1 1 -21 3  25 o 57.06561 3.287010 40.05322       4.551662 40.91765       6.934823 39.39898       6.033027 57.33001 5.014255 56.38174 4.426440 0.9482689      6.688507 
1 1 1 -21 3  26 o 40.97260 3.957320 20.84673       3.902101 19.65600       6.074018 21.68350       5.091810 39.12706 6.605255 41.53416 5.140336 -2.407093      8.369734 
1 1 1 -21 3  27 o 20.52068 6.581383 5.202305       3.726826 -5.407213      7.683295 8.466499       4.261747 17.10695 7.896242 25.48169 6.754799 -8.374741      10.39124 
1 1 1 -21 3  28 o 39.20593 4.240871 19.22572       3.987332 19.22340       6.165390 19.22738       5.227777 38.45414 6.829505 38.81573 5.696174 -0.3615837     8.893174 
1 1 1 -21 3  29 o 36.52290 5.390850 17.03900       4.653932 13.64106       5.888081 22.69571       7.597107 31.95557 7.660734 41.36205 7.823709 -9.406481      10.94976 
1 1 1 -21 3  30 o 27.80704 5.727856 10.09884       3.752093 11.08995       5.849387 9.405936       4.890860 28.67665 8.045237 26.54932 7.322550 2.127331       10.87868 
1 1 1 -21 3  31 o 57.05844 3.417183 40.41588       4.729658 43.17523       7.273941 38.39477       6.225311 58.30303 5.173326 55.16555 4.674785 3.137482       6.972583 
1 1 1 -21 3  32 o 22.25272 6.808012 6.552043       4.035807 6.243154       7.382802 6.683685       4.819672 23.71114 9.102437 22.67979 7.499209 1.031345       11.79375 
1 1 1 -21 3  33 o 38.96039 5.138363 19.65733       4.759662 18.22781       9.232689 20.17476       5.554669 34.87219 10.21242 39.06258 6.029104 -4.190395      11.85932 
1 1 1 -21 3  34 o 48.16238 4.579138 29.75200       5.309789 29.06967       6.932885 30.72011       8.258116 46.62814 6.259363 47.13924 7.435025 -0.5110970     9.719013 
1 1 1 -21 3  35 o 25.80837 6.885873 9.391256       4.410761 7.049101       7.652220 10.55658       5.397633 23.62762 9.213357 26.99903 7.780080 -3.371410      12.05884 
1 1 1 -21 3  36 o 35.67279 4.931748 16.79627       4.172640 17.23426       6.129924 16.41810       5.695953 34.51887 7.501939 33.93621 7.115331 0.5826530      10.33959 
1 1 1 -21 3  37 o 15.35305 6.177436 2.071306       3.542337 4.109742       5.259815 0.3793199      4.792039 19.13544 7.584517 15.41882 6.736680 3.716629       10.14435 
1 1 1 -21 3  38 o 43.37736 4.908213 25.13345       5.097221 29.42782       9.332935 23.30801       6.084893 42.63564 9.249284 40.61210 6.356725 2.023537       11.22307 
1 1 1 -21 3  39 o 13.24108 5.963290 -0.7527402     4.049634 -2.895029      5.426274 1.940458       6.084107 13.88891 6.487065 17.53982 7.628135 -3.650909      10.01351 
1 1 1 -21 3  40 o 14.04117 5.943745 1.255664       3.512025 1.019562       5.401463 1.428579       4.622520 16.00821 7.067663 15.51018 6.697403 0.4980392      9.736893 
1 1 1 -21 3  41 o 20.18292 7.265738 6.289678       4.561696 13.37555       5.984389 -3.537830      7.047658 27.94571 8.232229 15.08030 7.150175 12.86540       10.90388 
1 1 1 -21 3  42 o 19.07310 6.848966 5.556410       4.050464 7.282975       5.925372 4.041931       5.549524 20.96496 8.126325 18.00536 7.537654 2.959599       11.08392 
1 1 1 -21 4  1  o 32.12047 4.140460 12.83145       3.165599 12.44118       3.536891 14.40299       7.097445 31.51852 4.752507 33.44527 8.645557 -1.926744      9.865698 
1 1 1 -21 4  2  o 146.1704 2.851528 260.8515       10.15718 258.5462       12.81766 264.7423       16.65235 145.4347 3.616635 146.9396 4.656387 -1.504898      5.895930 
1 1 1 -21 4  3  o 203.1231 3.702034 504.3777       18.32466 490.2674       25.30150 519.9447       26.57536 199.8761 5.198982 205.8111 5.303177 -5.935043      7.426513 
1 1 1 -21 4  4  o 68.33334 2.648032 57.07423       4.401181 56.10522       6.892413 57.74138       5.718965 67.58712 4.205605 68.65955 3.428916 -1.072426      5.426286 
1 1 1 -21 4  5  o 91.97685 2.555332 103.3139       5.721909 98.07538       9.034984 106.8220       7.393588 89.44165 4.156624 93.46113 3.251248 -4.019478      5.277133 
1 1 1 -21 4  6  o 73.53845 2.621224 66.08051       4.689856 60.54622       7.559911 69.54280       5.979530 70.19350 4.442396 75.38516 3.262681 -5.191658      5.511803 
1 1 1 -21 4  7  o 47.03394 3.017456 27.12113       3.440261 30.48683       5.841912 25.33423       4.256637 49.64840 4.892001 45.35513 3.888767 4.293262       6.249334 
1 1 1 -21 4  8  o 21.04658 5.276605 5.643675       2.700898 1.342368       4.550952 7.982426       3.355783 17.03145 6.947283 25.01549 5.640028 -7.984037      8.948444 
1 1 1 -21 4  9  o 89.28353 2.773810 97.39359       6.027774 94.58938       8.839176 99.83129       8.241311 87.83972 4.141037 90.29414 3.753607 -2.454414      5.589075 
1 1 1 -21 4  10 o 123.0709 2.890738 184.9063       8.669621 190.6332       12.79624 180.0470       11.78721 124.7571 4.215075 121.2722 3.993987 3.484901       5.806788 
1 1 1 -21 4  11 o 107.6813 3.852876 141.9489       10.09395 0.000000       0.000000 141.9489       10.09395 ?        ?        107.6813 3.852876 0.000000       3.852876 
1 1 1 -21 4  12 o 71.85866 3.151135 63.18378       5.504590 62.92377       9.601875 63.31107       6.718178 71.39171 5.563035 71.85635 3.850696 -0.4646454     6.765738 
1 1 1 -21 4  13 o 113.0364 2.863985 156.0892       7.882701 151.8398       11.57925 159.7595       10.76128 111.3073 4.276905 114.2365 3.871248 -2.929237      5.768750 
1 1 1 -21 4  14 o 213.9095 3.702507 559.4125       19.30021 579.9800       28.27787 541.4760       26.40728 217.4118 5.337373 210.1196 5.157282 7.292114       7.421935 
1 1 1 -21 4  15 f 156.6983 3.142873 299.9407       12.00127 309.6755       17.69753 291.6527       16.32960 158.9314 4.574240 154.2795 4.347749 4.651810       6.310831 
1 1 1 -21 4  16 o 112.4177 2.840361 154.4180       7.774925 151.6427       11.42923 156.8086       10.60750 111.2123 4.224922 113.1522 3.852547 -1.939880      5.717700 
1 1 1 -21 4  17 o 81.69928 3.318973 81.71708       6.594063 84.75150       8.574058 77.32381       10.31672 83.08041 4.249096 79.15839 5.380185 3.922012       6.855743 
1 1 1 -21 4  18 o 65.48621 3.019354 52.50604       4.805401 53.29555       7.404932 51.93167       6.315960 65.76199 4.650724 65.00657 4.006464 0.7554169      6.138485 
1 1 1 -21 4  19 o 62.68984 3.054719 48.14135       4.652593 48.88821       7.141212 47.59052       6.132829 62.95075 4.688838 62.20097 4.068345 0.7497826      6.207788 
1 1 1 -21 4  20 o 94.35995 2.859917 108.8939       6.568643 104.8635       9.752133 112.2409       8.886956 92.36906 4.344660 95.66193 3.819900 -3.292870      5.785128 
1 1 1 -21 4  21 o 90.19548 3.342311 99.67573       7.333578 105.8838       9.436068 90.20616       11.65408 92.82246 4.182335 85.35423 5.634470 7.468239       7.017064 
1 1 1 -21 4  22 o 23.42056 6.034620 7.038724       3.465521 12.82054       5.484009 3.194801       4.471503 31.48244 7.291654 18.78218 7.114268 12.70026       10.18730 
1 1 1 -21 4  23 o 26.84164 5.524426 9.219153       3.492999 19.36779       5.668712 3.007220       4.435002 39.08090 6.155707 18.50352 7.067005 20.57739       9.372048 
1 1 1 -21 4  24 o 96.28212 3.239405 113.6980       7.589761 127.0781       14.37579 108.5272       8.936776 101.0614 5.862442 93.92271 3.913151 7.138718       7.048473 
1 1 1 -21 4  25 o 69.04551 3.063517 58.51944       5.141728 59.46040       7.980465 57.85163       6.723129 69.24186 4.758521 68.46115 4.047939 0.7807083      6.247346 
1 1 1 -21 4  26 o 17.00089 6.079578 3.111331       3.187992 0.6295544      5.222002 4.585844       4.025130 17.23353 7.268997 19.90926 6.853184 -2.675734      9.990217 
1 1 1 -21 4  27 o 12.87453 5.663637 -0.8173546     3.439317 -9.072886      8.085670 1.006276       3.800248 16.11050 7.644461 15.29361 6.305490 0.8168859      9.909439 
1 1 1 -21 4  28 o 24.71457 5.921927 7.965523       3.519868 4.930525       5.711896 9.823670       4.469318 21.71695 8.079352 27.33210 6.750544 -5.615145      10.52833 
1 1 1 -21 4  29 o 52.03606 4.327498 33.83244       5.437917 39.94409       7.068571 24.97056       8.511687 56.26950 5.214231 43.15207 8.396548 13.11744       9.883837 
1 1 1 -21 4  30 o 70.17078 3.107028 60.78524       5.299798 60.53740       8.160830 60.96599       6.969469 69.38318 4.857314 69.93800 4.107395 -0.5548248     6.361147 
1 1 1 -21 4  31 o 24.84974 6.121853 8.201804       3.682579 8.784266       5.889695 7.827926       4.718726 25.71381 8.276155 24.26799 7.348896 1.445816       11.06802 
1 1 1 -21 4  32 o 16.13730 6.492315 1.895761       3.912227 3.147127       8.498386 1.559257       4.406963 22.22442 9.317426 16.48755 6.793207 5.736877       11.53092 
1 1 1 -21 4  33 o 18.88209 6.964255 4.060694       4.227493 9.546407       7.831134 1.804588       5.022129 26.56092 9.525005 17.41376 7.220593 9.147156       11.95252 
1 1 1 -21 4  34 o 43.94066 4.895083 25.00452       5.152692 22.45922       6.765354 28.52061       7.951527 40.33115 7.145079 45.32673 7.457956 -4.995586      10.32827 
1 1 1 -21 4  35 o 51.35606 4.231842 33.78833       5.249158 40.30969       9.821272 31.18053       6.210636 53.25296 7.799263 48.64035 5.326672 4.612617       9.444678 
1 1 1 -21 4  36 o 26.01594 6.254759 9.469851       3.916347 10.13699       5.885113 8.939583       5.246788 26.07283 8.260219 24.73897 7.794485 1.333862       11.35717 
1 1 1 -21 4  37 o 37.01883 4.784568 18.14001       4.215352 23.37996       6.451207 14.23585       5.568532 40.62915 6.752733 31.02867 7.457282 9.600475       10.06034 
1 1 1 -21 4  38 o 12.81206 5.814081 -1.239889      3.936757 -1.453298      7.533549 -1.159721      4.617353 17.16881 7.886279 13.91488 6.307425 3.253934       10.09837 
1 1 1 -21 4  39 o 21.73706 7.120187 7.112245       4.348610 8.831929       5.938382 5.123742       6.385676 23.52568 8.309247 20.10747 8.218986 3.418207       11.68740 
1 1 1 -21 4  40 o 16.89622 6.491095 3.635071       3.756332 -0.1168229     5.701838 6.512063       4.992970 15.55981 7.035402 20.65982 7.577258 -5.100003      10.33981 
1 1 1 -21 4  41 o 18.80713 6.745874 5.235876       3.928225 -0.1256057     5.724421 10.00762       5.400424 15.40199 6.997881 24.34831 7.932106 -8.946325      10.57774 
1 1 1 -21 4  42 o 40.35439 5.791389 23.70972       5.532220 23.44393       7.073204 24.12850       8.878463 37.49338 7.986279 34.92146 9.951397 2.571922       12.75974 
1 1 1 -21 5  1  o 114.1747 2.413241 159.0727       6.714391 162.6650       9.403668 155.3363       9.590245 115.3286 3.349535 112.6795 3.496831 2.649124       4.842232 
1 1 1 -21 5  2  o 81.43940 2.536277 81.02034       5.027333 87.61958       6.606561 71.94213       7.748687 84.63074 3.209215 76.56160 4.168912 8.069138       5.261073 
1 1 1 -21 5  3  o 67.09624 2.452851 55.00721       4.003814 58.31844       5.495416 51.26098       5.845261 69.01515 3.276893 64.64587 3.726243 4.369286       4.962148 
1 1 1 -21 5  4  o 80.90446 2.616893 79.96845       5.152557 80.22015       8.242377 79.80699       6.601435 80.86176 4.197225 80.75217 3.362010 0.1095886      5.377714 
1 1 1 -21 5  5  o 55.97825 2.842222 38.35200       3.864468 38.36103       6.242096 38.34638       4.920921 55.77899 4.634043 55.89520 3.632406 -0.1162109     5.888015 
1 1 1 -21 5  6  o 85.11539 2.555293 88.48665       5.294107 94.72384       8.766051 84.90559       6.642251 87.90271 4.103609 83.30748 3.278264 4.595230       5.252296 
1 1 1 -21 5  7  o 91.34604 2.545306 101.9008       5.660336 94.43162       9.006868 106.7763       7.276873 87.75195 4.224336 93.44649 3.200274 -5.694534      5.299695 
1 1 1 -21 5  8  o 238.0294 3.586150 692.4164       20.80152 706.5612       33.59498 683.6215       26.49049 239.8868 5.746877 236.2849 4.600636 3.601883       7.361552 
1 1 1 -21 5  9  o 127.4988 2.647351 198.3936       8.225338 199.6136       13.55906 197.6833       10.34654 127.6376 4.365707 127.1652 3.341699 0.4723740      5.497849 
1 1 1 -21 5  10 o 31.71554 4.728994 12.58626       3.543365 21.66719       6.460357 8.679064       4.237640 41.45884 6.616741 26.05980 6.651426 15.39904       9.382043 
1 1 1 -21 5  11 o 148.2141 4.210781 268.9982       15.19316 0.000000       0.000000 268.9982       15.19316 ?        ?        148.2141 4.210781 0.000000       4.210781 
1 1 1 -21 5  12 o 42.14581 4.298983 21.96142       4.353500 41.93988       11.55001 18.65298       4.700169 57.59176 8.483599 38.67665 5.111918 18.91511       9.904704 
1 1 1 -21 5  13 o 141.5840 3.019764 244.7974       10.41893 250.8893       15.50205 239.7784       14.07089 143.0792 4.451486 139.9287 4.130993 3.150528       6.072959 
1 1 1 -21 5  14 o 184.6529 3.404654 416.6699       15.32023 403.3129       21.87383 429.5312       21.46412 181.3060 4.955460 187.1727 4.709551 -5.866669      6.836407 
1 1 1 -21 5  15 o 146.8174 3.064738 263.2958       10.96496 275.6383       16.46252 253.4543       14.70026 149.9349 4.510779 143.8301 4.198598 6.104813       6.162414 
1 1 1 -21 5  16 o 89.42164 2.833615 97.74506       6.166958 110.0132       9.762245 89.59814       7.955306 94.69031 4.241426 85.49337 3.828171 9.196938       5.713543 
1 1 1 -21 5  17 o 119.2251 3.408621 173.9274       9.893195 161.1949       12.24575 197.8543       16.78701 114.6136 4.392560 126.7658 5.446903 -12.15218      6.997380 
1 1 1 -21 5  18 o 133.2180 2.976580 216.8314       9.663106 214.0365       14.09120 219.3125       13.27654 132.0742 4.384261 133.7566 4.077945 -1.682404      5.987601 
1 1 1 -21 5  19 o 41.21703 3.863696 20.98129       3.835510 27.09622       6.302347 17.38420       4.833726 46.57876 5.668981 37.19920 5.497672 9.379559       7.896945 
1 1 1 -21 5  20 o 158.2751 3.179263 306.3382       12.26239 342.6482       18.77551 279.3300       16.19296 166.9963 4.618127 150.8227 4.410525 16.17363       6.385909 
1 1 1 -21 5  21 o 71.13163 3.471604 62.08509       5.999504 59.86176       7.806068 65.29378       9.377643 69.65265 4.625149 72.61166 5.336986 -2.959015      7.062253 
1 1 1 -21 5  22 o 20.34741 6.184166 5.157722       3.337322 2.120129       5.483380 6.944956       4.206048 19.01192 7.673000 23.43250 6.901197 -4.420586      10.31995 
1 1 1 -21 5  23 o 81.40345 2.938026 81.17934       5.818642 74.25605       8.723344 86.72855       7.809838 77.53240 4.638244 83.98812 3.825869 -6.455719      6.012535 
1 1 1 -21 5  24 o 50.99781 3.778837 32.10470       4.662826 27.41609       9.230058 33.71127       5.402950 45.86758 8.572890 52.17020 4.287642 -6.302616      9.585318 
1 1 1 -21 5  25 o 82.92306 2.922086 84.32069       5.895559 88.23677       9.269055 81.66001       7.640199 84.45933 4.519979 81.40833 3.862246 3.050995       5.945348 
1 1 1 -21 5  26 o 22.83413 6.214107 6.735031       3.549402 7.277372       8.353909 6.615559       3.920908 26.21453 9.767282 22.72995 6.654768 3.484573       11.81887 
1 1 1 -21 5  27 f 66.23422 3.185667 54.00127       5.126768 55.03665       8.429907 53.39355       6.458422 66.29498 5.261138 65.65308 4.056594 0.6419067      6.643457 
1 1 1 -21 5  28 o 63.76586 3.194916 50.12137       4.948780 49.41529       7.939136 50.57005       6.328759 62.70742 5.243346 63.81774 4.091046 -1.110325      6.650514 
1 1 1 -21 5  29 o 14.07062 6.217766 -1.019946      4.189442 4.645464       5.478775 -8.996816      6.501058 21.09784 7.900032 13.73275 6.606858 7.365085       10.29860 
1 1 1 -21 5  30 o 27.13283 5.568258 9.613926       3.558218 12.82160       6.088055 7.949733       4.385157 30.70268 8.042579 24.48683 6.998865 6.215845       10.66148 
1 1 1 -21 5  31 o 23.98734 6.173356 7.656492       3.629621 9.867089       6.157620 6.479443       4.493197 26.98293 8.435860 22.36931 7.231260 4.613621       11.11102 
1 1 1 -21 5  32 o 46.66754 3.876592 27.36201       4.368836 29.82108       7.126616 25.88147       5.529761 47.61868 6.295517 44.86744 5.150839 2.751240       8.134167 
1 1 1 -21 5  33 o 73.58208 3.761476 67.92042       6.722380 60.32578       8.661001 79.42863       10.66151 68.42149 5.234185 78.23184 5.630064 -9.810356      7.687282 
1 1 1 -21 5  34 f 12.19131 5.529680 -1.564633      3.555732 -2.243359      5.640481 -1.117034      4.580509 15.17542 6.914936 14.30616 6.400421 0.8692617      9.422405 
1 1 1 -21 5  35 o 19.38611 6.887772 4.806213       4.085512 18.87365       8.305775 0.3161556      4.692439 34.78945 9.521556 15.43415 6.705887 19.35530       11.64598 
1 1 1 -21 5  36 o 21.07874 6.544415 6.189536       3.712867 7.189384       5.648014 5.428645       4.927083 22.66728 8.093681 20.44468 7.522274 2.222599       11.04954 
1 1 1 -21 5  37 o 18.24428 6.630112 4.263829       3.809858 8.376586       5.824113 1.187514       5.037078 23.71851 8.239765 16.30781 7.016099 7.410698       10.82217 
1 1 1 -21 5  38 o 33.29511 5.905565 15.53977       4.616126 15.32726       8.347517 15.63339       5.540336 29.56982 9.872071 32.38926 7.205354 -2.819437      12.22190 
1 1 1 -21 5  39 o 26.37508 7.085072 10.63804       4.650122 9.577522       6.141078 12.06336       7.119373 24.21080 8.457847 26.42519 9.113550 -2.214390      12.43350 
1 1 1 -21 5  40 o 21.65502 6.716209 7.165672       3.911523 7.972828       6.065200 6.590920       5.118076 22.15706 8.308886 20.71778 7.658962 1.439280       11.30032 
1 1 1 -21 5  41 o 30.50947 6.024475 13.72978       4.320084 11.94888       6.455865 15.17392       5.813537 25.75350 8.682682 30.25498 7.826499 -4.501484      11.68944 
1 1 1 -21 6  1  o 66.57623 2.507647 54.17225       4.061110 49.91444       5.420068 59.62237       6.132185 63.80648 3.499207 69.73875 3.620719 -5.932270      5.035281 
1 1 1 -21 6  2  o 97.45278 2.383479 115.8849       5.660329 121.0812       7.930135 110.4879       8.081848 99.49605 3.275148 95.01319 3.496488 4.482857       4.790827 
1 1 1 -21 6  3  f 90.70133 2.896896 100.5510       6.394777 99.69278       9.209289 101.3501       8.886507 90.15801 4.203225 90.93106 4.020293 -0.7730484     5.816343 
1 1 1 -21 6  4  o 45.53469 3.238118 25.45559       3.569671 28.16463       5.669479 23.67625       4.594789 47.68291 4.951142 43.76434 4.366551 3.918571       6.601559 
1 1 1 -21 6  5  o 110.1158 2.615948 147.9882       7.019638 146.6197       11.29467 148.8495       8.960317 109.3759 4.245622 110.3283 3.336565 -0.9524155     5.399812 
1 1 1 -21 6  6  o 63.72653 2.760667 49.66510       4.276997 46.40591       6.924704 51.67528       5.438301 61.37938 4.664518 64.94000 3.448855 -3.560619      5.801063 
1 1 1 -21 6  7  o 139.1942 2.731280 236.4951       9.264529 243.7891       15.24543 232.2243       11.66564 141.0493 4.440932 137.8121 3.476416 3.237137       5.639800 
1 1 1 -21 6  8  o 60.64970 2.763010 44.99335       4.072911 50.37625       7.223372 42.48426       4.931625 63.96669 4.666027 58.86480 3.453106 5.101883       5.804803 
1 1 1 -21 6  9  o 140.8000 2.965407 242.0595       10.17474 248.1192       20.26485 240.0170       11.76520 142.0003 5.868878 140.1534 3.444763 1.846848       6.805154 
1 1 1 -21 6  10 o 75.44186 3.100028 69.62383       5.687061 76.83764       10.26193 66.42620       6.832206 78.96120 5.364954 73.60876 3.821953 5.352448       6.587113 
1 1 1 -21 6  11 f 14.71769 5.704804 1.682311       2.920178 6.445857       5.062427 -0.6930766     3.574874 23.33636 7.684412 13.37532 5.831669 9.961042       9.646686 
1 1 1 -21 6  12 o 106.2252 3.296105 137.9877       8.521948 158.0788       18.35298 132.4653       9.622153 113.0875 6.689606 104.0127 3.802607 9.074806       7.694845 
1 1 1 -21 6  13 o 105.2010 2.845166 135.2233       7.287266 141.1712       11.19619 130.8515       9.598751 107.3045 4.290349 103.3698 3.817082 3.934677       5.742579 
1 1 1 -21 6  14 o 153.9505 3.134226 289.5304       11.75838 296.7560       17.51441 283.6014       15.86535 155.5552 4.625489 152.1359 4.283653 3.419266       6.304350 
1 1 1 -21 6  15 o 66.12901 3.025533 53.52867       4.862703 59.76616       7.886340 49.70256       6.176603 69.67332 4.671864 63.60343 4.005383 6.069885       6.153812 
1 1 1 -21 6  16 o 132.1958 2.980934 213.4784       9.602983 205.8029       14.19257 219.9595       13.04165 129.5084 4.503896 133.9919 3.998564 -4.483459      6.022757 
1 1 1 -21 6  17 f 167.9414 3.812549 345.1673       15.60304 338.6548       19.44338 356.9477       26.15016 166.0663 4.809633 170.0192 6.322627 -3.952881      7.944066 
1 1 1 -21 6  18 o 39.55510 4.746319 19.47078       4.483781 20.08838       6.175088 18.78203       6.521099 39.82124 6.594014 38.33777 7.245460 1.483475       9.796822 
1 1 1 -21 6  19 o 33.69679 4.438645 14.16397       3.556267 14.75356       5.958132 13.83768       4.432406 33.84137 7.428905 33.05954 5.708100 0.7818298      9.368620 
1 1 1 -21 6  20 o 134.9861 3.537274 223.2025       11.62571 211.1075       14.43259 245.5524       19.61910 131.0523 4.526013 140.9912 5.722083 -9.938889      7.295685 
1 1 1 -21 6  21 o 74.16257 2.928505 67.35375       5.282168 77.93319       8.579538 60.89568       6.703228 79.53470 4.444285 70.36710 3.924663 9.167603       5.929135 
1 1 1 -21 6  22 o 109.7610 2.887659 147.4423       7.717072 145.4944       11.62537 148.9769       10.31834 108.7172 4.397131 110.1429 3.850223 -1.425667      5.844569 
1 1 1 -21 6  23 o 53.53585 3.311648 35.24659       4.299261 37.47960       7.035131 33.91557       5.431492 54.82287 5.333249 52.34507 4.295777 2.477798       6.848156 
1 1 1 -21 6  24 o 77.14319 3.314640 73.09240       6.216638 66.83827       11.94123 75.41765       7.281149 72.82540 6.807570 78.25957 3.829544 -5.434166      7.810789 
1 1 1 -21 6  25 o 94.62819 3.269551 109.9718       7.528211 100.2592       14.16286 113.7967       8.887780 89.28449 6.555058 96.12942 3.801527 -6.844925      7.577624 
1 1 1 -21 6  26 o 30.03339 5.600171 11.57676       3.947919 9.486900       8.754735 12.11022       4.423187 28.34154 10.08136 30.60370 6.144639 -2.262157      11.80637 
1 1 1 -21 6  27 o 90.31567 2.962157 100.2098       6.510576 83.30112       9.921317 112.9981       8.628207 81.70238 5.007137 95.69280 3.707041 -13.99042      6.230054 
1 1 1 -21 6  28 o 141.4572 3.133886 246.0628       10.80300 239.7719       16.10097 251.2136       14.56913 138.7283 4.769768 142.3517 4.204469 -3.623352      6.358321 
1 1 1 -21 6  29 o 20.21869 7.676386 4.073686       5.213366 8.798746       8.736084 1.460269       6.497069 27.23555 10.01718 19.36746 8.134956 7.868088       12.90432 
1 1 1 -21 6  30 o 21.50856 6.106235 6.063816       3.349103 8.623900       5.738861 4.741635       4.124240 25.57176 8.163390 19.92953 6.933203 5.642229       10.71029 
1 1 1 -21 6  31 o 23.96153 6.037241 7.642720       3.523157 12.44668       6.065586 5.196740       4.328122 30.01130 8.104926 20.56493 7.105256 9.446371       10.77843 
1 1 1 -21 6  32 o 13.97904 5.850636 0.7397056      3.342144 1.077812       5.868455 0.5774018      4.065946 17.95080 7.644216 15.02032 6.378330 2.930483       9.955759 
1 1 1 -21 6  33 o 18.09964 6.861892 3.506805       4.162102 0.3359720      5.720103 7.074413       6.067443 17.06583 7.409437 23.35585 8.383065 -6.290020      11.18819 
1 1 1 -21 6  34 f 60.46067 3.494875 45.94662       5.127267 44.44555       8.003990 46.99127       6.677137 57.99368 5.738726 60.50453 4.562235 -2.510845      7.331232 
1 1 1 -21 6  35 o 46.49155 4.605803 28.03848       5.149623 32.82933       9.522807 26.05848       6.121961 47.10920 8.612397 44.01180 5.852978 3.097397       10.41301 
1 1 1 -21 6  36 o 27.91204 6.724945 11.11585       4.519788 8.609818       8.673349 12.05008       5.295666 24.72852 9.758933 28.62377 7.502379 -3.895256      12.30945 
1 1 1 -21 6  37 o 14.17464 6.137053 0.4463929      3.902022 5.551764       7.409169 -1.513104      4.590163 21.55980 8.837566 13.73170 6.249670 7.828109       10.82409 
1 1 1 -21 6  38 o 24.74385 6.501469 8.965965       3.970525 5.733533       6.040294 11.42539       5.268783 20.69036 8.150572 27.19033 7.638117 -6.499969      11.17017 
1 1 1 -21 6  39 o 18.38019 7.116183 4.412380       4.539866 9.075286       5.882592 -2.454910      7.138930 23.64035 8.276567 15.95532 7.448423 7.685026       11.13466 
1 1 1 -21 6  40 o 11.95510 5.486693 -1.400916      3.635767 -6.634504      5.695454 2.198668       4.723399 12.40160 6.018862 16.17911 6.872719 -3.777512      9.135697 
1 1 1 -21 6  41 o 20.47278 6.778561 6.514520       3.937479 5.231589       5.986255 7.492816       5.227435 19.29679 7.930540 21.38895 7.767210 -2.092167      11.10059 
1 1 1 -21 7  1  o 56.63632 2.732391 39.25393       3.760026 44.83961       5.050178 32.30640       5.632280 60.46896 3.441397 51.14684 4.566858 9.322121       5.718340 
1 1 1 -21 7  2  o 84.29214 2.387657 86.77261       4.899563 88.48417       6.797771 84.92218       7.068194 85.03305 3.286709 83.27800 3.490649 1.755051       4.794485 
1 1 1 -21 7  3  o 87.49443 2.673369 93.53440       5.693320 95.64247       9.230639 92.24003       7.232996 88.28324 4.303560 86.80893 3.425874 1.474312       5.500658 
1 1 1 -21 7  4  o 120.3982 2.992770 177.0232       8.780708 179.6640       12.71581 174.6163       12.13980 121.0692 4.316878 119.3765 4.179527 1.692726       6.008651 
1 1 1 -21 7  5  o 65.08837 2.772715 51.81169       4.387819 47.08767       7.089796 54.74445       5.586191 61.81379 4.742885 66.84322 3.441014 -5.029434      5.859653 
1 1 1 -21 7  6  o 146.4984 2.805165 262.0084       10.01445 265.7414       16.34040 259.7627       12.67351 147.2345 4.559748 145.7819 3.567444 1.452560       5.789470 
1 1 1 -21 7  7  o 93.74608 2.747406 107.3710       6.269650 127.1198       12.60432 100.8780       7.227183 101.6918 5.102546 90.81270 3.271120 10.87914       6.061040 
1 1 1 -21 7  8  o 102.7215 3.138180 128.9963       7.846318 135.7342       13.74472 125.7391       9.556478 105.0381 5.387737 101.3258 3.877428 3.712242       6.637933 
1 1 1 -21 7  9  o 54.34842 3.251476 36.21139       4.286605 36.03975       6.880193 36.32028       5.480236 53.94562 5.302130 54.32338 4.171696 -0.3777580     6.746528 
1 1 1 -21 7  10 o 38.52268 3.897277 18.33302       3.608321 23.32768       6.143188 15.70221       4.458466 43.16151 6.002884 35.38721 5.335881 7.774296       8.031578 
1 1 1 -21 7  11 o 60.31876 2.765172 44.50922       4.053721 54.97530       7.704523 40.50275       4.766881 66.81406 4.763207 57.47024 3.419186 9.343826       5.863359 
1 1 1 -21 7  12 o 179.6218 3.898164 394.6561       17.06299 443.6678       33.91160 378.0414       19.74443 189.3677 7.362657 175.6027 4.618005 13.76508       8.691070 
1 1 1 -21 7  13 o 39.55256 4.457801 19.40090       4.221912 20.34758       10.87511 19.23291       4.581229 39.61392 10.91644 39.30905 4.887752 0.3048744      11.96072 
1 1 1 -21 7  14 o 120.0570 2.935313 176.0413       8.587722 192.2415       13.42919 164.8330       11.17020 125.1965 4.408590 115.9930 3.957582 9.203590       5.924367 
1 1 1 -21 7  15 o 216.3728 3.768200 572.7723       19.86885 604.5084       29.69123 547.0356       26.73786 221.7792 5.493779 211.0684 5.198372 10.71085       7.563378 
1 1 1 -21 7  16 o 180.1752 3.391148 396.9105       14.88942 394.7383       21.81391 398.8052       20.37346 179.2523 4.998698 180.2757 4.641442 -1.023376      6.821288 
1 1 1 -21 7  17 o 125.3061 2.947189 191.8416       8.999458 210.0296       14.05438 179.2012       11.71654 130.8158 4.415077 120.9064 3.982050 9.909340       5.945555 
1 1 1 -21 7  18 o 80.75310 3.464254 79.92094       6.801329 83.39256       9.248407 75.83209       10.03697 82.30621 4.629696 78.34969 5.287869 3.956520       7.028203 
1 1 1 -21 7  19 o 76.90107 3.550868 72.53674       6.636347 72.32954       8.900100 72.79620       9.959412 76.58311 4.793015 76.71590 5.361103 -0.1327896     7.191273 
1 1 1 -21 7  20 o 98.28217 2.868464 118.1733       6.862705 135.8388       11.02442 106.9969       8.768888 105.1177 4.312881 93.35821 3.862736 11.75945       5.789790 
1 1 1 -21 7  21 f 94.20045 2.851768 108.5967       6.538873 123.9941       10.50791 98.86649       8.353251 100.3900 4.305269 89.71679 3.829533 10.67322       5.762002 
1 1 1 -21 7  22 f 78.20677 2.921558 74.92877       5.558157 70.36982       8.703421 78.06858       7.222848 75.44643 4.758090 79.69693 3.729381 -4.250496      6.045470 
1 1 1 -21 7  23 o 68.64632 3.065573 57.81750       5.115263 59.33651       8.278718 56.87946       6.505721 69.16595 4.944344 67.93125 3.946974 1.234695       6.326542 
1 1 1 -21 7  24 o 65.81872 3.126035 53.20781       4.999613 65.98412       8.478581 46.39705       6.190397 72.94228 4.796500 61.25504 4.171962 11.68723       6.357018 
1 1 1 -21 7  25 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -21 7  26 f 35.61374 4.493853 15.92557       3.813410 13.34592       6.610171 17.21239       4.668637 31.69006 8.418024 36.82903 5.359013 -5.138962      9.979085 
1 1 1 -21 7  27 o 105.2135 2.947813 136.0014       7.550558 133.4266       11.77177 137.8012       9.841756 103.5672 4.676328 105.6095 3.830483 -2.042252      6.044886 
1 1 1 -21 7  28 o 65.13897 3.570485 52.50363       5.645991 57.99873       12.46514 51.08529       6.332855 66.62854 7.826203 64.10211 4.075167 2.526428       8.823629 
1 1 1 -21 7  29 f 91.69842 3.604330 104.1260       8.038513 103.7589       10.39261 104.6727       12.68271 91.02723 4.701009 90.82011 5.760199 0.2071228      7.435010 
1 1 1 -21 7  30 f 24.44021 5.977480 7.906311       3.530098 -0.9660648     5.902610 12.84679       4.404620 16.74059 7.389754 31.27757 5.996973 -14.53698      9.516940 
1 1 1 -21 7  31 o 44.65551 3.838535 25.01687       4.136625 21.40366       6.592423 27.36342       5.312688 39.96019 7.026257 46.36697 4.769818 -6.406773      8.492317 
1 1 1 -21 7  32 o 49.23701 3.802180 30.46408       4.526736 33.79172       7.437078 28.50572       5.705329 50.69117 6.145900 47.07756 5.052080 3.613613       7.955853 
1 1 1 -21 7  33 o 35.33130 5.680088 16.55275       4.724747 14.02589       6.598310 19.21169       6.768545 31.09415 8.477009 36.92870 7.767930 -5.834553      11.49784 
1 1 1 -21 7  34 o 26.37383 6.018762 9.528654       3.782664 10.24960       6.170481 9.094609       4.787801 26.50426 8.465213 25.30412 7.338190 1.200148       11.20307 
1 1 1 -21 7  35 o 29.77544 6.262037 12.29395       4.399392 17.25825       8.822145 10.65084       5.075508 32.62390 10.08112 27.08326 7.455458 5.540638       12.53846 
1 1 1 -21 7  36 o 25.40619 6.335483 9.132477       3.908867 6.168123       5.895586 11.45774       5.221531 21.57046 8.169292 27.82988 7.521643 -6.259426      11.10461 
1 1 1 -21 7  37 o 14.26124 6.276063 0.1988149E-01  4.227069 0.9582716      8.149025 -0.3255610     4.944266 19.06104 8.531663 14.99539 6.683220 4.065644       10.83765 
1 1 1 -21 7  38 o 26.55749 6.268771 10.22812       3.991376 13.46207       6.139058 7.860124       5.253218 28.91760 8.286117 22.66542 7.827999 6.252186       11.39900 
1 1 1 -21 7  39 o 12.62377 5.860402 -2.171489      4.323318 1.759792       5.574429 -8.105337      6.848596 16.76717 7.296757 13.41142 6.529703 3.355750       9.791818 
1 1 1 -21 7  40 o 16.85628 6.504025 3.654580       3.782930 4.070714       5.800756 3.346634       4.990049 18.47429 7.718197 17.35635 7.197203 1.117945       10.55321 
1 1 1 -21 7  41 o 19.65752 6.860604 5.956850       4.040075 8.023539       6.243912 4.468474       5.298778 21.74309 8.364775 18.32216 7.487797 3.420925       11.22660 
1 1 1 -21 8  1  o 116.0929 2.657290 164.5506       7.517625 169.4861       9.716967 157.1920       11.86491 117.6976 3.391408 113.1998 4.309000 4.497856       5.483533 
1 1 1 -21 8  2  o 43.71424 3.537911 23.51564       3.736646 22.22273       5.752952 24.45911       4.914401 42.13590 5.752844 44.44013 4.604585 -2.304230      7.368678 
1 1 1 -21 8  3  o 61.58249 3.012750 46.43105       4.507506 45.93520       7.194225 46.75149       5.783413 61.01429 4.879190 61.70000 3.865904 -0.6857071     6.225087 
1 1 1 -21 8  4  o 165.1517 3.716366 333.5419       14.95676 331.4162       24.81744 334.7543       18.74305 163.9750 6.222026 165.2157 4.660012 -1.240692      7.773630 
1 1 1 -21 8  5  o 69.40678 3.350749 59.00307       5.650605 63.60578       9.341360 56.34706       7.096074 71.78548 5.379069 67.70374 4.323593 4.081749       6.901292 
1 1 1 -21 8  6  o 19.55200 6.308531 4.573656       3.420695 6.197006       5.909121 3.755487       4.195062 23.68612 8.295018 19.18826 6.959517 4.497860       10.82784 
1 1 1 -21 8  7  o 131.7388 3.037474 211.9607       9.751296 205.3816       14.38626 217.5524       13.26296 129.4070 4.569156 133.2763 4.088514 -3.869293      6.131324 
1 1 1 -21 8  8  o 79.73712 2.933006 77.74304       5.689433 82.43698       8.970320 74.58398       7.358985 81.91979 4.510894 77.99297 3.884142 3.926826       5.952707 
1 1 1 -21 8  9  o 61.62932 2.812041 46.46813       4.212105 44.09288       7.521287 47.55347       5.084160 59.72576 5.220076 62.29256 3.361700 -2.566803      6.208882 
1 1 1 -21 8  10 o 116.2327 2.624013 164.9063       7.432424 164.1222       12.65502 165.3193       9.183067 115.6705 4.498139 116.2786 3.243968 -0.6081238     5.545862 
1 1 1 -21 8  11 o 35.01019 3.757174 15.16073       3.155381 18.33566       6.235592 14.06791       3.658339 37.96754 6.997263 33.58000 4.590678 4.387547       8.368752 
1 1 1 -21 8  12 o 56.29984 2.938421 38.81606       4.017459 38.92102       7.667717 38.77635       4.716699 55.99010 5.699126 56.21634 3.459780 -0.2262383     6.667092 
1 1 1 -21 8  13 o 247.3257 4.768686 750.0742       28.74114 785.6183       53.58232 735.7166       34.05474 251.0874 8.770572 244.6102 5.713037 6.477249       10.46717 
1 1 1 -21 8  14 o 209.4651 3.709694 536.7336       18.93590 511.5793       27.00059 561.0803       26.56357 203.9627 5.437182 213.7859 5.098839 -9.823181      7.453933 
1 1 1 -21 8  15 o 60.42300 3.246466 44.75317       4.762684 40.17730       7.920379 47.34485       5.960745 56.85086 5.798139 62.06430 3.961831 -5.213444      7.022430 
1 1 1 -21 8  16 o 250.6234 4.164737 769.5170       25.43579 815.5521       38.05064 732.3278       34.19998 257.2256 6.070321 243.8901 5.754340 13.33549       8.364283 
1 1 1 -21 8  17 o 102.6464 2.875147 128.8320       7.184751 136.8484       11.36878 123.5014       9.270750 105.5429 4.430120 100.3663 3.797301 5.176674       5.834849 
1 1 1 -21 8  18 o 78.87398 4.699674 76.65942       8.992157 76.65942       8.992157 0.000000       0.000000 78.87398 4.699674 ?        ?        0.000000       4.699674 
1 1 1 -21 8  19 o 40.93641 4.664533 20.84762       4.570304 21.42092       6.504324 20.28853       6.423211 41.06799 6.732307 39.91602 6.849996 1.151970       9.604499 
1 1 1 -21 8  20 o 49.02574 3.444419 29.57283       4.088875 25.50762       6.888382 31.78448       5.080814 44.92829 6.478564 50.72811 4.146202 -5.799820      7.691735 
1 1 1 -21 8  21 o 71.03664 2.975850 61.83992       5.140041 57.02235       8.267275 64.87562       6.562628 67.83926 5.036800 72.64716 3.719384 -4.807907      6.261243 
1 1 1 -21 8  22 o 86.80998 2.927484 92.32420       6.184129 97.29169       9.942270 89.18958       7.897849 88.76480 4.612123 85.15929 3.815443 3.605507       5.985756 
1 1 1 -21 8  23 o 134.6200 3.045179 221.9688       9.989837 215.4926       14.99538 227.1365       13.39518 132.1000 4.665529 135.8476 4.050848 -3.747620      6.178716 
1 1 1 -21 8  24 f 143.1205 3.117731 251.1037       10.87368 260.4184       16.80143 244.3903       14.26373 145.0923 4.758318 140.8014 4.161662 4.290939       6.321473 
1 1 1 -21 8  25 o 11.66281 5.391167 -2.834615      3.600548 0.000000       0.000000 -2.834615      3.600548 ?        ?        11.66281 5.391167 0.000000       5.391167 
1 1 1 -21 8  26 o 36.97394 4.259650 17.11239       3.767946 22.29096       6.650352 14.66407       4.572706 41.52516 6.807687 33.81070 5.755907 7.714458       8.914879 
1 1 1 -21 8  27 o 99.21355 3.329090 121.2825       8.037430 125.6790       16.52696 119.9205       9.198466 99.23149 6.877053 98.47374 3.840541 0.7577515      7.876777 
1 1 1 -21 8  28 o 94.02106 2.961387 108.8068       6.776641 106.2660       10.64042 110.5406       8.789810 92.18768 4.752460 94.45077 3.826821 -2.263092      6.101674 
1 1 1 -21 8  29 o 52.05655 4.277863 33.95722       5.378893 28.97306       7.193881 40.27657       8.100349 47.24183 6.414402 55.99977 6.030793 -8.757946      8.804261 
1 1 1 -21 8  30 o 48.92231 3.695114 29.87668       4.372686 30.01337       7.128784 29.79424       5.536557 48.00843 6.241009 48.48311 4.746878 -0.4746819     7.841113 
1 1 1 -21 8  31 o 35.34167 4.466338 15.93254       3.760832 12.76138       6.221553 17.75850       4.721004 30.20402 8.230242 36.98184 5.397573 -6.777822      9.842290 
1 1 1 -21 8  32 o 41.42801 4.953773 22.13851       4.902095 16.07364       6.712374 29.07022       7.176049 33.63293 8.252739 46.69987 6.480079 -13.06694      10.49281 
1 1 1 -21 8  33 o 24.16592 6.155445 7.984107       3.634391 6.390837       6.010133 8.902594       4.563264 22.47281 8.301085 25.24044 7.114697 -2.767624      10.93284 
1 1 1 -21 8  34 o 22.48643 6.414055 7.011914       3.686614 2.531616       5.877344 9.918183       4.733643 18.63487 7.775911 26.38153 7.174930 -7.746664      10.58038 
1 1 1 -21 8  35 o 19.55516 6.984075 4.965429       4.205781 0.9037045      8.423518 6.314221       4.854124 19.74237 8.765552 21.48690 7.518638 -1.744534      11.54837 
1 1 1 -21 8  36 o 23.70756 6.405292 8.005684       3.787387 8.775346       5.968231 7.486765       4.900560 24.23469 8.344864 22.72644 7.563458 1.508249       11.26244 
1 1 1 -21 8  37 o 41.02000 5.229146 22.75805       5.108449 17.91866       9.197217 24.91712       6.143207 31.64445 10.35424 42.17938 6.158218 -10.53492      12.04715 
1 1 1 -21 8  38 o 22.47592 6.761471 7.535210       4.003934 8.672040       6.230701 6.735519       5.225769 23.38169 8.481447 21.30194 7.761471 2.079741       11.49675 
1 1 1 -21 8  39 o 21.09859 7.511209 6.851304       4.860817 13.54838       9.374635 4.388734       5.684680 26.36959 10.22141 18.85199 7.735836 7.517601       12.81875 
1 1 1 -21 8  40 o 22.50932 6.718291 7.850379       3.964709 3.165416       6.104524 11.26825       5.214069 17.91931 7.716773 26.16805 7.677611 -8.248743      10.88551 
1 1 1 -21 8  41 o 13.38188 5.925121 0.2794072      3.822630 1.904881       6.305615 -0.6650801     4.806573 17.00120 7.564139 13.96233 6.370306 3.038878       9.889236 
1 1 1 -21 9  1  o 88.64470 2.538199 96.01075       5.477308 90.63549       7.714719 101.4743       7.777833 85.99041 3.690166 91.02024 3.513183 -5.029831      5.095074 
1 1 1 -21 9  2  o 133.6585 3.068290 218.2757       9.993766 237.8087       19.13847 210.9527       11.71830 138.9357 5.664594 131.2689 3.666844 7.666794       6.747842 
1 1 1 -21 9  3  f 141.0289 3.545471 243.3629       12.17513 250.7019       20.27789 239.2258       15.22482 142.6288 5.846567 139.6488 4.479620 2.980011       7.365415 
1 1 1 -21 9  4  o 282.1935 5.223503 977.6851       35.92070 932.5554       59.90261 1003.025       44.88623 273.4351 9.002183 285.2575 6.457137 -11.82242      11.07853 
1 1 1 -21 9  5  o 90.52396 3.485764 100.3263       7.675122 98.08644       9.777650 103.9221       12.38844 89.36252 4.504492 91.79971 5.563949 -2.437195      7.158769 
1 1 1 -21 9  6  o 131.0851 3.056347 209.8997       9.763196 203.5995       14.38525 215.2800       13.29374 128.8184 4.589848 132.5545 4.120446 -3.736160      6.168045 
1 1 1 -21 9  7  o 43.76562 3.385421 23.54918       3.582569 22.53787       6.457023 23.99896       4.306171 42.30213 6.468965 44.09977 4.052263 -1.797638      7.633370 
1 1 1 -21 9  8  o 46.75727 3.258930 26.84307       3.690058 33.30065       7.031039 24.38823       4.335071 51.75356 5.667554 44.45974 4.045485 7.293823       6.963269 
1 1 1 -21 9  9  f 62.58346 2.777742 47.91656       4.225753 51.33791       7.782697 46.48621       5.032135 64.50354 4.989974 61.58132 3.366059 2.922218       6.019153 
1 1 1 -21 9  10 o 145.0715 2.797289 256.9850       9.889071 264.5929       16.72410 252.8949       12.26252 146.8456 4.679512 143.8249 3.498724 3.020721       5.842850 
1 1 1 -21 9  11 o 183.4744 3.089876 411.2652       13.81506 423.5022       23.10255 404.4536       17.23640 185.6843 5.110482 181.8062 3.890467 3.878052       6.422832 
1 1 1 -21 9  12 o 94.29146 2.609072 108.6251       5.989311 104.6524       10.44616 110.5706       7.310186 92.27377 4.660699 95.07296 3.159651 -2.799194      5.630764 
1 1 1 -21 9  13 o 214.0298 4.349205 561.2740       22.68402 555.8151       41.83347 563.5477       26.99772 211.3759 8.136619 214.2165 5.171757 -2.840530      9.641143 
1 1 1 -21 9  14 o 139.5843 3.072883 238.0834       10.45246 244.0724       15.98476 233.6096       13.81542 140.9909 4.658818 138.0498 4.111274 2.941040       6.213466 
1 1 1 -21 9  15 o 137.0403 3.044111 229.4993       10.16588 233.7555       15.55385 226.3253       13.43189 137.9624 4.632950 135.8740 4.061180 2.088379       6.160958 
1 1 1 -21 9  16 o 26.65834 6.596211 9.128003       4.261503 7.868811       6.322453 10.17634       5.768869 25.75218 8.591439 28.22826 8.014151 -2.476076      11.74902 
1 1 1 -21 9  17 o 72.06271 3.640714 63.73096       6.372707 64.05307       8.751980 63.36744       9.297474 72.01440 5.018536 71.55603 5.371106 0.4583664      7.350815 
1 1 1 -21 9  18 o 20.98036 8.163086 3.529323       5.996544 3.529323       5.996544 0.000000       0.000000 20.98036 8.163086 ?        ?        0.000000       8.163086 
1 1 1 -21 9  19 o 12.75000 5.471457 -0.1671003     3.048629 -6.308730      6.018729 1.952435       3.535765 14.30655 6.729771 16.02705 6.258967 -1.720498      9.190456 
1 1 1 -21 9  20 o 96.13208 2.886597 113.1182       6.754580 112.1858       10.74951 113.7265       8.682855 95.39079 4.638205 96.24775 3.708937 -0.8569565     5.938784 
1 1 1 -21 9  21 o 31.46059 4.600319 12.43347       3.422635 5.011024       6.416297 15.38548       4.046408 22.74342 8.542372 35.00757 4.875290 -12.26415      9.835678 
1 1 1 -21 9  22 o 74.52361 3.014021 68.11330       5.462349 67.46143       9.009648 68.49216       6.868693 73.73527 5.044528 74.59016 3.791257 -0.8548889     6.310380 
1 1 1 -21 9  23 o 122.3467 2.979321 183.3608       8.882711 179.3110       13.64095 186.3423       11.70436 120.4406 4.656445 123.0415 3.908510 -2.600861      6.079385 
1 1 1 -21 9  24 o 52.84701 3.672595 34.49625       4.700229 17.84355       10.47690 38.69244       5.259181 36.46253 10.93021 55.94056 3.882020 -19.47802      11.59912 
1 1 1 -21 9  25 o 23.88893 5.940046 7.413228       3.443365 12.95556       9.411409 6.556659       3.699895 31.66678 10.47968 22.55010 6.423431 9.116676       12.29163 
1 1 1 -21 9  26 o 33.10621 4.589019 13.83966       3.602819 17.46429       6.940027 12.50243       4.215344 36.21144 8.070933 31.13059 5.768994 5.080845       9.920749 
1 1 1 -21 9  27 o 72.37504 3.072729 64.52594       5.407043 66.75581       9.128870 63.32090       6.710850 72.90204 5.172142 71.46815 3.867676 1.433884       6.458325 
1 1 1 -21 9  28 o 35.52366 4.454344 15.94445       3.771458 14.49158       6.368934 16.72903       4.680291 32.71174 8.046132 36.08061 5.496466 -3.368870      9.744300 
1 1 1 -21 9  29 o 59.96700 4.009964 44.90458       5.826206 50.97195       8.139629 38.53003       8.343140 63.34038 5.322555 54.50667 6.403193 8.833710       8.326492 
1 1 1 -21 9  30 o 26.98219 5.521338 9.573871       3.507987 0.7362801      5.981618 14.20692       4.330968 17.94849 7.682403 32.99456 5.585589 -15.04607      9.498322 
1 1 1 -21 9  31 o 50.29355 3.634429 31.66992       4.424306 23.72818       7.281673 36.31755       5.570439 41.73254 7.432648 53.59564 4.301128 -11.86309      8.587430 
1 1 1 -21 9  32 o 42.24676 4.943991 23.06957       4.993723 27.04860       6.984399 18.90820       7.142641 44.85913 6.585048 36.42230 8.240615 8.436832       10.54849 
1 1 1 -21 9  33 o 47.98896 3.769887 29.14486       4.373281 24.88998       7.354781 31.47209       5.439345 42.17112 7.428031 49.46109 4.564260 -7.289970      8.718264 
1 1 1 -21 9  34 o 36.20464 4.631159 17.09212       3.992489 24.86433       6.657187 12.72649       4.989331 42.43607 6.656302 29.96614 6.965164 12.46993       9.634307 
1 1 1 -21 9  35 o 30.51350 6.078855 12.88753       4.361299 14.73532       9.167257 12.34695       4.958376 29.83151 10.33902 29.28948 7.035334 0.5420246      12.50565 
1 1 1 -21 9  36 o 19.08067 6.933593 4.771122       4.166521 5.054505       7.857228 4.660263       4.914374 21.48888 8.980552 19.38306 7.430121 2.105822       11.65577 
1 1 1 -21 9  37 o 23.14997 6.635781 7.863473       3.936499 7.906376       5.983184 7.830727       5.227187 22.85268 8.308127 22.76695 7.810711 0.8572388E-01  11.40317 
1 1 1 -21 9  38 o 36.72543 5.244329 18.56881       4.560323 24.53291       6.930681 14.01511       6.055997 40.26310 7.333817 29.39915 8.163480 10.86396       10.97394 
1 1 1 -21 9  39 o 19.83643 6.870161 5.878911       4.047454 4.125514       6.480392 7.000345       5.182602 19.00812 8.061288 21.19164 7.728119 -2.183527      11.16728 
1 1 1 -21 9  40 o 11.17365 5.370180 -4.484151      4.269798 -3.328835      8.471289 -4.877615      4.943697 16.36947 7.783793 12.00693 5.772671 4.362544       9.690777 
1 1 1 -21 10 1  o 97.81733 3.081581 117.0575       7.336406 122.7912       10.73779 112.0377       10.04711 99.97601 4.418317 95.50539 4.328200 4.470619       6.185050 
1 1 1 -21 10 2  o 98.39291 3.107674 118.4343       7.442013 114.4495       10.84076 121.9858       10.23457 96.48599 4.624080 99.69140 4.222411 -3.205406      6.261858 
1 1 1 -21 10 3  o 176.4813 3.461410 380.8806       14.88634 397.7332       22.09297 366.8669       20.14635 179.9065 5.044290 172.8522 4.787446 7.054306       6.954459 
1 1 1 -21 10 4  o 42.06007 4.328268 21.90027       4.373036 22.59845       6.561792 21.34242       5.865444 42.31371 6.577180 41.21159 6.017904 1.102116       8.914845 
1 1 1 -21 10 5  o 166.8041 3.349085 340.1320       13.61348 315.4628       19.34086 364.3548       19.16508 160.2531 4.958566 172.3391 4.567447 -12.08604      6.741583 
1 1 1 -21 10 6  o 133.4482 3.158638 217.6146       10.27185 223.3226       15.24752 212.8714       13.89911 134.8822 4.645763 131.7478 4.335103 3.134460       6.354229 
1 1 1 -21 10 7  o 129.2638 2.732041 204.0304       8.605979 210.3969       14.64140 200.6698       10.63756 130.9286 4.596065 128.0729 3.411423 2.855667       5.723777 
1 1 1 -21 10 8  f 136.3798 2.765910 227.1245       9.192300 227.3732       15.33288 226.9850       11.48516 136.1073 4.629549 136.2092 3.462955 -0.1018982     5.781416 
1 1 1 -21 10 9  o 107.7171 2.661937 141.6668       6.987449 148.4493       12.21721 138.3696       8.518172 109.9529 4.569585 106.3482 3.290812 3.604729       5.631213 
1 1 1 -21 10 10 o 58.74109 2.923010 42.25161       4.171018 44.41308       7.936188 41.42670       4.902749 59.86351 5.501665 58.10313 3.478540 1.760387       6.509114 
1 1 1 -21 10 11 o 96.65679 2.605795 114.1466       6.132144 117.3586       10.93154 112.6717       7.407369 97.72726 4.603116 95.96640 3.171800 1.760857       5.590079 
1 1 1 -21 10 12 o 53.36599 3.025624 34.90802       3.918617 26.09891       7.396949 38.34479       4.620211 45.46387 6.892365 55.89683 3.408062 -10.43296      7.688926 
1 1 1 -21 10 13 o 76.32876 2.945970 71.28577       5.469358 90.08414       15.76443 68.71339       5.831580 84.86915 7.706343 74.90810 3.202023 9.961052       8.345098 
1 1 1 -21 10 14 o 166.7065 3.308504 339.8240       13.44065 344.9759       20.36940 335.8511       17.88744 167.5132 4.995496 165.4358 4.440948 2.077408       6.684085 
1 1 1 -21 10 15 o 149.2166 3.744168 272.7545       13.60396 269.1370       17.46871 278.3293       21.68584 147.9544 4.851594 150.1291 5.939270 -2.174759      7.668957 
1 1 1 -21 10 16 o 45.42716 4.510065 25.57043       4.926829 29.29164       7.419366 22.63519       6.589415 48.26023 6.471699 42.29090 6.610099 5.969330       9.250747 
1 1 1 -21 10 17 o 79.74915 2.996643 77.86550       5.813316 83.11787       9.698771 74.92046       7.262475 82.08311 4.870614 78.10513 3.827308 3.977982       6.194447 
1 1 1 -21 10 18 o 126.5137 3.559992 196.1822       10.96455 191.6224       14.13958 203.0596       17.36523 124.7705 4.658562 128.1684 5.573179 -3.397903      7.263782 
1 1 1 -21 10 19 f 168.7166 3.308116 348.5036       13.60112 361.6718       20.81599 338.6935       17.96677 171.2810 4.992471 165.9467 4.446897 5.334290       6.685780 
1 1 1 -21 10 20 o 87.21223 2.890482 93.14832       6.134559 92.43945       10.05090 93.56918       7.744360 86.49754 4.786985 87.27789 3.649257 -0.7803497     6.019327 
1 1 1 -21 10 21 o 76.83595 2.998128 72.38628       5.602946 67.02675       9.409756 75.33029       6.974045 73.44164 5.293260 78.26544 3.666803 -4.823799      6.439258 
1 1 1 -21 10 22 o 109.2368 2.934477 146.2289       7.804444 150.5480       12.52695 143.4889       9.977402 110.3603 4.668512 107.9997 3.796951 2.360649       6.017627 
1 1 1 -21 10 23 o 76.70426 3.223346 72.29336       6.011647 79.32827       13.01709 70.38614       6.777735 79.24629 6.806473 75.58523 3.690852 3.661064       7.742768 
1 1 1 -21 10 24 o 58.93769 3.440217 42.82846       4.919522 48.69713       11.08813 41.39009       5.489386 61.56092 7.549065 57.83468 3.918056 3.726246       8.505266 
1 1 1 -21 10 25 o 21.79785 6.164564 6.133414       3.420056 4.178110       8.646917 6.496026       3.723702 23.87289 9.635228 22.43560 6.461111 1.437296       11.60102 
1 1 1 -21 10 26 o 79.00179 3.011791 76.79081       5.787644 82.05596       9.877564 74.03808       7.142104 80.97963 5.030227 77.34854 3.800755 3.631088       6.304675 
1 1 1 -21 10 27 o 72.50547 3.054656 64.79479       5.385117 69.19917       9.170025 62.47631       6.653188 74.18940 5.103243 70.95132 3.862550 3.238075       6.400186 
1 1 1 -21 10 28 o 35.70927 4.303595 16.09441       3.669554 11.40874       6.535721 18.25152       4.434491 28.98756 8.619503 37.86799 4.921803 -8.880430      9.925723 
1 1 1 -21 10 29 f 58.80726 4.210299 43.37275       5.993725 45.21276       8.433308 41.49463       8.520175 59.24543 5.920475 56.54142 6.290009 2.704018       8.638069 
1 1 1 -21 10 30 o 11.50455 5.199122 -1.432103      3.109115 -2.932251      6.043532 -0.8921710     3.625713 15.62074 7.133132 12.99347 5.760921 2.627268       9.168958 
1 1 1 -21 10 31 o 71.74004 3.797971 64.53590       6.616057 62.67341       9.065661 66.65816       9.677295 69.71622 5.377706 71.76145 5.577607 -2.045227      7.747865 
1 1 1 -21 10 32 o 43.92308 3.936345 24.45672       4.168671 17.42911       6.975853 28.36037       5.199108 34.73868 8.345092 47.00286 4.597826 -12.26418      9.527884 
1 1 1 -21 10 33 f 15.78090 6.099433 2.480606       3.331039 -5.314337      5.986477 5.976320       4.008971 14.01555 6.628912 20.99121 6.833962 -6.975660      9.520794 
1 1 1 -21 10 34 o 19.50641 6.437949 5.113094       3.552597 -0.4223901     5.655304 8.721438       4.565960 16.12622 7.169836 24.66612 7.169973 -8.539898      10.13978 
1 1 1 -21 10 35 o 38.03008 5.340692 19.41928       4.813291 17.45588       9.288881 20.13998       5.627783 32.03236 10.40061 38.10070 6.279936 -6.068340      12.14950 
1 1 1 -21 10 36 o 40.01698 5.133470 21.52304       4.890850 19.51384       8.938158 22.38173       5.843239 33.60872 10.10048 40.01310 6.192438 -6.404377      11.84762 
1 1 1 -21 10 37 o 23.93477 6.748815 8.512571       4.105312 2.470451       5.944913 14.02042       5.675994 17.89091 7.658301 30.07267 7.709722 -12.18176      10.86689 
1 1 1 -21 10 38 o 17.89301 7.059041 3.987636       4.536760 1.451644       6.030055 7.295520       6.886878 16.98945 7.485595 21.85654 8.673671 -4.867098      11.45717 
1 1 1 -21 10 39 o 26.63470 6.403235 10.66669       4.104631 4.760743       6.422977 14.74358       5.336500 19.36992 8.109057 30.65578 7.256760 -11.28586      10.88198 
1 1 1 -21 10 40 o 12.50052 5.716822 -1.092174      3.900826 -4.459388      5.921030 1.490057       5.185128 13.41828 6.415593 15.87678 6.970214 -2.458504      9.473316 
1 1 1 -21 11 1  o 80.71905 3.381339 79.84113       6.636481 79.53889       17.43205 79.89236       7.176931 79.15657 9.208748 80.70599 3.658708 -1.549423      9.908945 
1 1 1 -21 11 2  o 98.31740 2.765479 118.1728       6.619194 102.5747       10.49525 128.4750       8.529460 91.29070 4.733867 102.4278 3.421982 -11.13712      5.841187 
1 1 1 -21 11 3  f 109.6554 2.776273 146.9706       7.412745 144.8679       12.14335 148.2196       9.358759 108.5706 4.600187 110.0201 3.495116 -1.449501      5.777331 
1 1 1 -21 11 4  o 224.4863 3.536779 616.4716       19.34790 634.7272       31.69106 605.6238       24.42905 226.9836 5.733952 222.2262 4.511025 4.757385       7.295722 
1 1 1 -21 11 5  o 85.97141 3.151048 90.45650       6.590371 88.17863       9.805696 92.33317       8.900330 84.63725 4.773585 86.70817 4.224928 -2.070923      6.374726 
1 1 1 -21 11 6  o 113.4198 3.147398 157.3421       8.690731 137.6088       12.30193 177.0027       12.27921 105.7920 4.784201 120.1275 4.201079 -14.33544      6.366918 
1 1 1 -21 11 7  o 157.6147 2.937449 303.4955       11.28244 323.3015       19.19558 293.0419       13.94557 162.2317 4.860932 154.7565 3.697868 7.475204       6.107609 
1 1 1 -21 11 8  o 37.37250 3.991633 17.29318       3.579072 28.64092       7.187708 13.55189       4.127113 47.78991 6.327195 32.79413 5.348502 14.99577       8.284918 
1 1 1 -21 11 9  o 174.9841 3.059729 374.1625       13.04721 384.1722       21.88636 368.6443       16.25042 176.7884 5.085518 173.5443 3.842537 3.244080       6.373977 
1 1 1 -21 11 10 o 138.9561 2.800750 235.8448       9.483925 247.7901       16.36206 229.8010       11.63843 142.0319 4.733946 137.0278 3.488211 5.004089       5.880294 
1 1 1 -21 11 11 o 91.68177 2.659060 102.7335       5.934555 96.47062       10.49200 105.6798       7.196352 88.51321 4.883153 92.92688 3.182558 -4.413673      5.828711 
1 1 1 -21 11 12 f 62.80983 2.846312 48.29380       4.345263 52.19841       8.503476 46.91391       5.055091 64.92173 5.424433 61.84595 3.366841 3.075783       6.384363 
1 1 1 -21 11 13 o 98.90577 2.916170 119.6369       7.020953 105.1504       17.20648 122.5306       7.690289 91.65965 7.776652 100.0640 3.157714 -8.404312      8.393300 
1 1 1 -21 11 14 o 189.7104 3.600152 440.5096       16.64363 426.5107       24.14870 453.1760       22.97075 186.0972 5.330469 191.9835 4.913970 -5.886230      7.249897 
1 1 1 -21 11 15 o 51.03663 4.229470 32.16012       5.213027 31.39522       7.789033 32.78074       7.016071 49.96251 6.555378 51.25695 5.714062 -1.294449      8.696177 
1 1 1 -21 11 16 o 26.90295 5.385453 9.226959       3.407396 9.742617       6.824502 9.055725       3.932658 28.01989 8.897260 26.54503 6.193303 1.474863       10.84058 
1 1 1 -21 11 17 o 83.96428 2.916762 86.30511       5.958976 95.89387       10.18550 81.31513       7.347682 88.17800 4.757701 81.37759 3.714980 6.800407       6.036290 
1 1 1 -21 11 18 o 93.12414 3.545492 106.4033       8.031210 111.0036       11.08814 101.3266       11.64824 94.84478 4.813173 90.48123 5.306107 4.363548       7.163896 
1 1 1 -21 11 19 o 81.35412 2.931840 81.07970       5.802902 85.26031       9.865935 78.86843       7.175297 83.03408 4.897549 80.10992 3.685382 2.924156       6.129277 
1 1 1 -21 11 20 o 73.29066 2.994921 65.86662       5.337701 58.98444       8.912331 69.71598       6.665336 68.86046 5.353132 75.29266 3.643547 -6.432205      6.475451 
1 1 1 -21 11 21 o 24.52135 5.460646 7.736828       3.179277 9.701573       6.332643 7.074733       3.676141 27.59794 8.543333 23.42987 6.301995 4.168077       10.61620 
1 1 1 -21 11 22 o 141.2328 3.491337 244.9146       12.01610 252.1591       23.59572 242.3780       13.96216 141.6150 6.857735 140.2424 4.089792 1.372635       7.984668 
1 1 1 -21 11 23 o 114.4336 3.308235 160.9140       9.215732 145.1267       18.00507 166.5182       10.72744 107.1404 6.933361 116.2578 3.791571 -9.117393      7.902373 
1 1 1 -21 11 24 o 41.64975 3.814758 21.55128       3.828869 11.21990       7.003816 25.95507       4.572660 29.26443 8.971472 45.66299 4.154754 -16.39856      9.886824 
1 1 1 -21 11 25 o 91.33612 3.291200 102.7527       7.313450 102.2479       15.43764 102.8988       8.304473 89.35430 7.149323 91.25765 3.742217 -1.903351      8.069511 
1 1 1 -21 11 26 o 30.81263 4.861861 12.10792       3.529715 11.61067       6.618430 12.30556       4.172655 29.42309 8.654671 30.81364 5.768878 -1.390549      10.40112 
1 1 1 -21 11 27 o 37.90670 4.174709 18.05688       3.792590 14.98638       6.685935 19.51361       4.605193 33.17726 8.292962 39.19854 4.929831 -6.021275      9.647614 
1 1 1 -21 11 28 o 38.16261 4.273390 18.37371       3.906006 17.55262       6.882877 18.76376       4.743890 35.85757 8.072060 38.25743 5.224797 -2.399860      9.615438 
1 1 1 -21 11 29 o 65.70538 3.946318 54.00849       6.289598 55.26463       8.766168 52.67580       9.029341 65.65981 5.530007 63.89930 5.863933 1.760513       8.060192 
1 1 1 -21 11 30 o 45.64685 4.749780 26.61544       5.206306 15.78072       7.353870 37.50312       7.371821 33.19066 8.907168 53.74505 5.716183 -20.55439      10.58359 
1 1 1 -21 11 31 o 33.62767 5.915947 15.07571       4.671009 14.03469       6.701759 16.05918       6.513855 31.17020 8.561667 33.62136 8.055915 -2.451153      11.75585 
1 1 1 -21 11 32 o 43.59314 3.980272 24.16991       4.181715 17.92136       7.162324 27.40149       5.150769 34.98136 8.489121 46.09693 4.648695 -11.11557      9.678613 
1 1 1 -21 11 33 o 52.81553 3.681202 35.33134       4.708258 37.70498       7.848453 33.99689       5.884750 52.79404 6.219687 51.15023 4.776335 1.643810       7.842058 
1 1 1 -21 11 34 o 15.49596 6.191171 2.134468       3.532092 -4.467475      5.874112 5.873255       4.420504 14.11598 6.642709 20.77701 7.180584 -6.661029      9.781941 
1 1 1 -21 11 35 f 31.34412 6.007070 13.65891       4.421381 11.77076       8.300388 14.40688       5.224231 26.99009 9.789433 31.55856 6.978611 -4.568468      12.02223 
1 1 1 -21 11 36 o 32.59074 5.489854 14.61394       4.205256 11.88800       6.365653 16.72478       5.601606 27.20906 8.587115 33.73690 7.041398 -6.527836      11.10495 
1 1 1 -21 11 37 o 26.53557 6.583384 10.42317       4.236588 9.330011       6.728871 11.14111       5.453136 23.97367 8.795761 26.49105 7.872387 -2.517385      11.80423 
1 1 1 -21 11 38 o 13.01079 5.985811 -1.598950      4.363978 -0.9434069     5.784727 -2.464792      6.648162 15.20459 6.956587 15.34777 7.172367 -0.1431780     9.991844 
1 1 1 -21 11 39 o 36.01973 5.196391 18.13944       4.429457 16.44339       6.807056 19.38501       5.833439 30.63033 8.708586 35.51695 6.988905 -4.886620      11.16621 
1 1 1 -21 11 40 o 9.715948 4.750504 -5.670570      3.735866 -14.59249      6.024104 -0.9497579E-01 4.762213 10.45859 5.259887 14.29692 6.450242 -3.838326      8.322982 
1 1 1 -21 12 1  o 62.32780 3.951182 47.79812       5.970403 0.000000       0.000000 47.79812       5.970403 ?        ?        62.32780 3.951182 0.000000       3.951182 
1 1 1 -21 12 2  o 22.03486 6.234733 6.156955       3.497459 3.759650       6.272388 7.238610       4.213236 21.51999 8.355527 23.89412 6.870095 -2.374138      10.81726 
1 1 1 -21 12 3  o 140.0032 2.883687 239.5237       9.838348 237.8793       16.18696 240.4871       12.38939 139.0876 4.782858 140.1187 3.631483 -1.031097      6.005281 
1 1 1 -21 12 4  o 12.93640 5.533911 -0.1047966     3.100509 0.4418303      5.910646 -0.3123115     3.641782 18.25840 7.718996 13.83027 5.958117 4.428132       9.751002 
1 1 1 -21 12 5  o 67.16359 3.141417 55.26567       5.127322 39.73705       9.957524 60.86850       5.981207 56.11919 7.466290 70.44891 3.494914 -14.32971      8.243780 
1 1 1 -21 12 6  o 129.3567 3.212355 204.5861       10.12624 212.0507       15.06361 198.4318       13.67783 131.3533 4.713641 127.1259 4.421896 4.227371       6.463094 
1 1 1 -21 12 7  o 60.20923 3.096584 44.42690       4.528148 43.62737       7.982302 44.80627       5.498465 59.27652 5.592065 60.38492 3.755186 -1.108395      6.735919 
1 1 1 -21 12 8  o 31.88433 4.600491 12.72493       3.471252 -1.065185      6.543703 18.12508       4.094895 18.11497 7.894189 38.18471 4.486126 -20.06973      9.079844 
1 1 1 -21 12 9  o 192.7878 3.230906 454.4400       15.17889 455.9142       25.03704 453.5832       19.08649 192.4490 5.343820 192.4098 4.070641 0.3921509E-01  6.717628 
1 1 1 -21 12 10 o 78.44452 2.740705 75.25896       5.231103 78.14707       9.806266 74.11022       6.184545 79.58057 5.083198 77.78098 3.270154 1.799583       6.044238 
1 1 1 -21 12 11 o 95.63966 2.661948 111.8087       6.197993 114.5259       11.22737 110.6177       7.433291 96.45298 4.791683 95.05880 3.213494 1.394180       5.769469 
1 1 1 -21 12 12 o 17.02611 5.786648 3.308834       2.867776 4.836850       6.541464 2.945286       3.190743 22.81268 8.612923 16.85677 6.075559 5.955906       10.54015 
1 1 1 -21 12 13 o 85.29128 3.499396 89.18285       7.257893 79.36515       16.45094 91.55565       8.087541 79.19179 8.665931 86.36481 3.852458 -7.173027      9.483660 
1 1 1 -21 12 14 o 94.91672 3.067000 110.2798       7.084709 109.3120       11.56707 110.8608       8.962557 94.12650 5.061456 95.03612 3.878112 -0.9096222     6.376370 
1 1 1 -21 12 15 f 16.92181 6.033832 3.045413       3.137918 7.606326       6.712195 1.769840       3.549698 25.66271 8.849162 15.83367 6.244861 9.829041       10.83079 
1 1 1 -21 12 16 o 23.92948 5.720420 7.353230       3.290425 6.889990       6.720470 7.499291       3.773682 24.91303 8.835704 24.16565 6.332825 0.7473793      10.87080 
1 1 1 -21 12 17 o 52.81413 3.361317 34.29577       4.303642 35.13396       8.151217 33.97182       5.067523 52.83189 6.465868 52.46572 3.993550 0.3661652      7.599730 
1 1 1 -21 12 18 f 61.38426 4.030960 46.46957       5.996415 39.61946       8.605154 52.93580       8.360559 56.12238 6.406590 65.26058 5.302779 -9.138203      8.316481 
1 1 1 -21 12 19 o 79.85328 3.011793 78.17820       5.850257 73.26531       9.854492 80.85204       7.269993 76.79910 5.297995 81.08513 3.688890 -4.286026      6.455746 
1 1 1 -21 12 20 o 114.6721 2.967183 161.1404       8.284629 162.1279       13.35939 160.5233       10.56046 114.4986 4.798597 114.2445 3.798533 0.2541199      6.120080 
1 1 1 -21 12 21 o 105.0121 3.267427 135.3944       8.351274 122.2080       16.40303 140.0085       9.703004 98.47678 6.878493 106.6635 3.738750 -8.186684      7.828916 
1 1 1 -21 12 22 o 118.7626 3.318222 173.2974       9.593903 186.3039       19.66719 169.2358       10.99023 121.6354 6.660499 117.1917 3.853585 4.443787       7.694957 
1 1 1 -21 12 23 o 39.89605 3.845320 19.79044       3.692247 20.89616       7.106928 19.38166       4.321180 39.95089 7.577109 39.30951 4.597706 0.6413803      8.862927 
1 1 1 -21 12 24 o 27.84787 5.047012 9.936032       3.298935 9.242607       6.847620 10.14562       3.764613 26.99504 8.939231 27.98700 5.713372 -0.9919567     10.60908 
1 1 1 -21 12 25 o 38.49321 4.368552 18.60892       4.025483 10.42210       10.05157 20.17281       4.393173 29.41091 10.75680 40.03854 4.585218 -10.62763      11.69328 
1 1 1 -21 12 26 o 23.13215 5.789204 7.015118       3.255319 6.536536       6.249126 7.193353       3.813621 23.62565 8.504190 23.39318 6.471464 0.2324715      10.68649 
1 1 1 -21 12 27 o 62.58251 3.246006 48.46758       4.933460 48.57959       8.428608 48.40920       6.084682 61.69967 5.669111 62.28677 4.030359 -0.5871010     6.955761 
1 1 1 -21 12 28 o 110.4259 3.025948 150.6173       8.135025 149.8056       12.79127 151.1687       10.54165 108.9949 4.827815 110.1146 3.934833 -1.119698      6.228219 
1 1 1 -21 12 29 f 57.12409 4.168643 41.07772       5.763022 43.06649       8.186580 39.12395       8.114192 57.58761 5.917728 54.70491 6.195660 2.882694       8.567713 
1 1 1 -21 12 30 o 19.87427 6.971932 4.886733       4.175554 3.607332       6.391273 5.839475       5.515334 20.42965 8.269984 21.85244 7.971842 -1.422794      11.48664 
1 1 1 -21 12 31 o 36.77171 4.511045 17.41219       3.957703 9.927197       6.809554 21.23027       4.863466 26.41661 8.917357 40.39199 5.051113 -13.97539      10.24856 
1 1 1 -21 12 32 o 53.55716 3.628098 36.22837       4.707189 22.19782       7.643039 44.80247       5.974799 39.00698 8.296013 59.26037 4.163858 -20.25339      9.282325 
1 1 1 -21 12 33 o 19.31250 6.457485 4.971742       3.571432 2.853632       6.188097 6.029670       4.373317 19.07707 7.970998 21.03787 7.146006 -1.960802      10.70524 
1 1 1 -21 12 34 o 21.98207 7.051831 6.861478       4.278477 -0.3639368     8.726401 9.148011       4.908994 19.18976 8.687508 24.95948 7.481802 -5.769722      11.46517 
1 1 1 -21 12 35 o 48.38466 4.434577 30.62126       5.170638 10.58544       8.983511 40.54691       6.322985 25.76468 10.00067 55.47578 4.722001 -29.71110      11.05942 
1 1 1 -21 12 36 o 40.29688 4.630372 21.61244       4.464453 20.91925       6.902851 22.11089       5.853500 36.83986 7.924451 39.43124 6.303928 -2.591377      10.12603 
1 1 1 -21 12 37 o 31.01426 5.850281 13.71301       4.259460 6.089247       6.477623 19.52064       5.653669 20.81797 8.361455 36.44987 6.608271 -15.63190      10.65754 
1 1 1 -21 12 38 o 21.61434 7.331812 7.311318       4.603550 3.761838       6.168337 11.77408       6.916516 18.54311 7.864472 25.70713 8.976279 -7.164028      11.93413 
1 1 1 -21 12 39 o 11.90609 5.503713 -1.662280      3.752668 -7.535223      5.943166 2.231827       4.839427 12.32013 6.016890 16.18258 6.917925 -3.862444      9.168460 
1 1 1 -21 13 1  o 43.54898 3.952934 23.44373       4.149361 13.15823       7.515881 27.95307       4.976496 31.91725 9.175473 47.51963 4.345535 -15.60237      10.15249 
1 1 1 -21 13 2  o 114.2805 3.214836 159.9063       8.944070 219.7480       24.60336 150.7937       9.600944 132.5603 7.648793 110.9129 3.556783 21.64735       8.435328 
1 1 1 -21 13 3  o 90.27495 2.799881 99.69180       6.152018 90.81203       10.33721 104.5617       7.655314 85.78654 4.966021 92.36913 3.406785 -6.582596      6.022254 
1 1 1 -21 13 4  o 126.0932 2.835814 194.3104       8.713762 180.8515       14.31252 202.2373       10.98409 121.2023 4.855669 128.4894 3.511299 -7.287140      5.992224 
1 1 1 -21 13 5  o 113.7353 2.788133 158.0656       7.727605 171.0291       13.46391 151.6973       9.436677 117.9080 4.695275 111.2778 3.484255 6.630173       5.846848 
1 1 1 -21 13 6  o 36.96034 4.225543 16.96652       3.737558 17.90259       7.007119 16.59430       4.418614 37.22722 7.964797 36.38461 5.125315 0.8426132      9.471370 
1 1 1 -21 13 7  o 135.3768 3.263652 224.1636       10.76674 224.7927       15.71941 223.6076       14.77716 135.1878 4.779103 134.9020 4.501375 0.2857666      6.565227 
1 1 1 -21 13 8  o 103.7604 3.207414 131.7937       8.100301 137.3145       12.32067 127.5905       10.75033 105.6125 4.799762 101.8933 4.339460 3.719185       6.470597 
1 1 1 -21 13 9  o 95.47195 2.735418 111.4540       6.357520 103.0045       11.21263 115.4575       7.718057 91.38321 5.054755 97.10046 3.266399 -5.717255      6.018298 
1 1 1 -21 13 10 o 166.1109 3.026061 337.3456       12.24932 318.1278       20.08754 348.7222       15.45543 160.7200 5.135451 168.7337 3.758747 -8.013718      6.364043 
1 1 1 -21 13 11 o 138.8705 3.221395 235.9001       10.90160 245.8482       16.85830 228.7502       14.29197 141.3226 4.902573 136.4745 4.302764 4.848160       6.522960 
1 1 1 -21 13 12 o 17.32960 6.252244 3.118550       3.380044 2.594510       6.673218 3.299387       3.920097 20.95842 8.462486 18.23529 6.709637 2.723127       10.79967 
1 1 1 -21 13 13 o 122.0923 2.718576 182.1687       8.088461 185.6169       14.53886 180.6231       9.733890 122.7469 4.870198 121.4453 3.292081 1.301636       5.878489 
1 1 1 -21 13 14 o 15.48610 6.087314 1.737568       3.362890 -11.33307      11.87261 2.877686       3.506493 20.25959 9.505398 17.15337 6.339794 3.106222       11.42565 
1 1 1 -21 13 15 o 41.34606 3.434034 21.07955       3.428789 24.92071       7.570758 20.08834       3.845823 44.16914 7.287644 40.27307 3.970247 3.896069       8.298953 
1 1 1 -21 13 16 o 24.74822 5.148088 7.828964       3.003487 1.090942       6.914297 9.396086       3.334519 20.03764 8.402710 27.15306 5.229087 -7.115419      9.896914 
1 1 1 -21 13 17 o 52.94724 3.349007 34.48571       4.298971 41.25654       8.345858 32.04039       5.015549 57.35992 6.062335 50.90826 4.076962 6.451664       7.305718 
1 1 1 -21 13 18 o 70.99553 3.836210 62.07989       6.612311 60.48528       9.492360 63.58307       9.216194 69.64214 5.641533 71.50126 5.327635 -1.859116      7.759549 
1 1 1 -21 13 19 o 143.3646 3.157245 251.8907       11.03027 260.2478       17.52063 246.4037       14.19684 145.0251 4.964909 141.4477 4.123095 3.577393       6.453699 
1 1 1 -21 13 20 o 53.19935 3.639688 34.93121       4.690103 31.81534       11.01285 35.62154       5.183683 48.97540 9.570807 53.65570 3.993110 -4.680302      10.37040 
1 1 1 -21 13 21 o 91.86429 3.211809 103.6833       7.178998 109.0132       15.53743 102.2366       8.094884 92.83037 6.918100 91.10963 3.653354 1.720734       7.823497 
1 1 1 -21 13 22 o 86.81647 2.959623 92.55866       6.252291 101.5109       10.98099 88.26428       7.605466 90.27738 5.011109 84.58997 3.698467 5.687408       6.228152 
1 1 1 -21 13 23 o 123.8663 3.027618 188.4108       9.138824 194.4146       14.72908 184.6528       11.65314 124.9793 4.845346 122.2446 3.916859 2.734718       6.230503 
1 1 1 -21 13 24 o 12.44316 5.415135 -0.4170780     3.070272 2.649337       9.284952 -0.7935348     3.253283 23.29810 9.751370 12.47426 5.497153 10.82384       11.19410 
1 1 1 -21 13 25 f 19.35273 6.254683 4.662620       3.361658 8.251589       6.772099 3.489086       3.872454 25.72045 8.887689 18.15234 6.670497 7.568113       11.11245 
1 1 1 -21 13 26 o 89.57183 3.038678 98.95041       6.623125 95.53805       10.74052 101.0441       8.413112 87.07407 5.083858 90.19448 3.836487 -3.120415      6.369006 
1 1 1 -21 13 27 o 46.82755 3.790985 27.40895       4.289072 31.63375       7.737499 25.53494       5.153265 49.13980 6.630500 44.85186 4.788829 4.287945       8.179024 
1 1 1 -21 13 28 o 33.95440 4.831515 14.81242       3.885065 6.938984       6.834792 18.57071       4.722133 23.99049 8.853956 37.92382 5.250309 -13.93334      10.29360 
1 1 1 -21 13 29 o 25.66591 8.632083 8.957280       6.380963 8.957280       6.380963 0.000000       0.000000 25.66591 8.632083 ?        ?        0.000000       8.632083 
1 1 1 -21 13 30 o 52.51530 3.600139 34.63802       4.579374 25.42726       7.423369 40.29648       5.818387 42.95927 7.355370 56.32722 4.270675 -13.36796      8.505301 
1 1 1 -21 13 31 o 27.02940 5.633103 9.852115       3.589899 10.13273       6.430088 9.725038       4.327051 26.44454 8.657904 26.41364 6.710248 0.3089523E-01  10.95385 
1 1 1 -21 13 32 o 17.13156 6.358173 3.393127       3.533477 -0.3348616     5.878416 5.502097       4.421384 16.52133 7.329691 20.43683 7.173848 -3.915508      10.25614 
1 1 1 -21 13 33 o 31.23350 5.552372 13.21850       4.071196 14.34296       6.965274 12.63498       5.017530 30.43307 8.858350 29.66381 7.046202 0.7692604      11.31898 
1 1 1 -21 13 34 o 22.52376 7.361875 7.341518       4.649987 0.000000       0.000000 7.341518       4.649987 ?        ?        22.52376 7.361875 0.000000       7.361875 
1 1 1 -21 13 35 o 21.78661 6.733295 6.900881       3.935435 1.992806       6.193798 10.22385       5.096414 17.92728 7.746884 25.89395 7.588665 -7.966667      10.84445 
1 1 1 -21 13 36 o 17.87277 6.637100 4.190329       3.851329 4.800991       5.980083 3.757536       5.034394 19.69526 7.989754 18.17430 7.346001 1.520967       10.85357 
1 1 1 -21 13 37 o 13.53083 5.896451 0.4798864      3.650752 -1.038335      5.955687 1.393744       4.620656 15.36138 7.039679 15.51932 6.698677 -0.1579361     9.717477 
1 1 1 -21 13 38 o 28.83599 7.154492 13.04934       5.003322 9.678534       6.605158 17.58726       7.663813 23.61389 8.705884 30.90441 9.366993 -7.290524      12.78800 
1 1 1 -21 13 39 o 30.05377 5.885816 13.26088       4.156337 9.634987       6.653089 15.58179       5.322860 23.22636 8.703837 31.42045 7.117409 -8.194082      11.24341 
1 1 1 -21 14 1  o 116.4617 3.562772 166.3735       10.09942 0.000000       0.000000 166.3735       10.09942 ?        ?        116.4617 3.562772 0.000000       3.562772 
1 1 1 -21 14 2  o 77.94479 3.576952 74.59498       6.776057 0.000000       0.000000 74.59498       6.776057 ?        ?        77.94479 3.576952 0.000000       3.576952 
1 1 1 -21 14 3  o 43.33944 3.769552 23.19488       3.941591 24.13684       7.223967 22.79557       4.703412 43.53111 7.050865 42.82608 4.577716 0.7050247      8.406555 
1 1 1 -21 14 4  o 20.88437 6.227790 5.468883       3.408084 2.366732       6.577795 6.607238       3.984627 20.63702 8.376695 22.86746 6.712352 -2.230446      10.73428 
1 1 1 -21 14 5  o 142.0540 2.913703 246.7244       10.08637 241.6435       16.77507 249.6014       12.62303 140.0531 4.922792 142.6981 3.632977 -2.645004      6.118203 
1 1 1 -21 14 6  o 82.63361 2.804648 83.55779       5.639510 98.80792       10.34226 77.10453       6.727728 89.52208 4.757861 79.27950 3.490901 10.24258       5.901155 
1 1 1 -21 14 7  o 122.2563 3.245772 183.0117       9.661423 193.9384       14.47428 174.2314       12.97498 125.5113 4.740884 119.0204 4.481523 6.490929       6.523805 
1 1 1 -21 14 8  o 48.63784 3.811382 29.16635       4.481388 27.88272       7.633007 29.84154       5.535928 46.92651 6.879034 49.05576 4.687840 -2.129242      8.324479 
1 1 1 -21 14 9  o 241.0719 4.930789 715.0711       28.96671 700.4812       35.29585 745.1699       50.69576 237.9162 6.092858 243.5853 8.553798 -5.669128      10.50192 
1 1 1 -21 14 10 o 43.32216 4.024389 23.21383       4.200026 24.00867       7.527337 22.85450       5.061117 43.34151 7.391852 42.82054 4.940672 0.5209694      8.890991 
1 1 1 -21 14 11 o 70.17101 2.838854 60.29654       4.844394 76.92464       9.631118 54.66471       5.605056 78.88158 5.036625 66.72498 3.458919 12.15660       6.109968 
1 1 1 -21 14 12 o 62.41146 2.947748 47.74388       4.470558 44.30042       8.736623 48.96535       5.203392 59.52252 6.109826 63.14625 3.393919 -3.623726      6.989182 
1 1 1 -21 14 13 o 71.50451 3.097327 62.68101       5.384252 72.02174       9.773033 58.61033       6.451669 76.22942 5.293919 69.02207 3.850999 7.207352       6.546432 
1 1 1 -21 14 14 o 142.2697 3.141636 247.7623       10.89192 226.7922       24.88739 252.7304       12.11362 134.4104 7.629527 143.6183 3.461211 -9.207901      8.377927 
1 1 1 -21 14 15 o 39.79344 3.572136 19.56930       3.427163 16.85903       7.637192 20.25270       3.834977 35.82801 8.809869 40.42705 3.942780 -4.599041      9.651907 
1 1 1 -21 14 16 o 181.2742 3.144236 402.4728       13.88952 391.0522       23.33113 408.7423       17.28653 177.7127 5.393667 182.4303 3.888435 -4.717606      6.649178 
1 1 1 -21 14 17 o 87.33954 2.681272 93.40732       5.699978 82.99464       10.81515 97.41199       6.707098 81.67651 5.465193 89.12168 3.092957 -7.445175      6.279707 
1 1 1 -21 14 18 o 72.56078 3.875895 64.91050       6.828595 76.41440       10.26579 55.78093       9.145236 78.32902 5.411420 66.79183 5.672297 11.53719       7.839542 
1 1 1 -21 14 19 o 64.21526 3.416367 50.76238       5.326883 41.02712       11.65465 53.33317       5.989061 56.06074 8.822287 65.75728 3.753065 -9.696537      9.587399 
1 1 1 -21 14 20 o 119.7530 3.085379 176.0205       8.996406 161.7591       14.71185 184.5388       11.37003 113.9774 5.311391 122.3825 3.817134 -8.405090      6.540748 
1 1 1 -21 14 21 o 68.56525 3.095508 57.82165       5.158823 68.15961       9.541837 53.55165       6.132362 73.80084 5.341753 65.81207 3.840407 7.988777       6.578986 
1 1 1 -21 14 22 o 52.65828 3.441325 34.26974       4.391798 27.92182       8.061009 36.94938       5.237352 46.30567 7.392042 54.56353 3.965960 -8.257854      8.388750 
1 1 1 -21 14 23 o 26.49030 5.454623 9.091334       3.403828 13.89071       6.940958 7.571671       3.905717 32.08279 8.672512 24.04360 6.508213 8.039192       10.84294 
1 1 1 -21 14 24 o 49.25122 3.849481 30.19134       4.583463 52.30878       12.12410 26.50325       4.950883 62.97949 8.086112 45.95140 4.478023 17.02809       9.243262 
1 1 1 -21 14 25 o 67.84666 3.233011 56.90218       5.329916 51.33256       9.218933 59.69857       6.532310 63.30482 6.049454 69.27984 3.884784 -5.975021      7.189398 
1 1 1 -21 14 26 o 41.33488 4.056189 21.46283       4.033187 24.31423       7.290568 20.20537       4.841504 42.72423 7.262118 39.74413 5.117503 2.980099       8.884098 
1 1 1 -21 14 27 o 49.12744 3.710324 30.17786       4.409099 30.99203       7.679334 29.77749       5.385165 48.46697 6.679331 48.46420 4.615418 0.2769470E-02  8.118839 
1 1 1 -21 14 28 o 32.73520 8.810607 15.30532       7.182506 15.30532       7.182506 0.000000       0.000000 32.73520 8.810607 ?        ?        0.000000       8.810607 
1 1 1 -21 14 29 o 17.74714 7.002654 2.885070       4.465236 -0.6753896     6.187273 6.754976       6.450546 17.00311 7.532844 23.25296 8.597952 -6.249849      11.43103 
1 1 1 -21 14 30 o 14.32214 5.928584 1.127460       3.377708 -1.698991      5.851307 2.540002       4.136497 15.79947 7.136979 16.89332 6.716285 -1.093857      9.800252 
1 1 1 -21 14 31 o 11.87392 5.370872 -1.334852      3.326738 -0.1406884     5.876083 -1.898167      4.035820 16.68993 7.370011 12.77911 5.833061 3.910826       9.399024 
1 1 1 -21 14 32 o 65.07777 3.434854 53.40987       5.427957 37.57021       8.348007 65.01116       7.144356 52.10844 6.731236 71.28813 4.130221 -19.17969      7.897358 
1 1 1 -21 14 33 o 31.46787 5.361755 13.38886       3.964326 13.46714       6.901524 13.35032       4.843017 29.28157 8.891820 30.63220 6.676786 -1.350624      11.11953 
1 1 1 -21 14 34 f 33.96931 6.874079 16.69276       5.494747 0.000000       0.000000 16.69276       5.494747 ?        ?        33.96931 6.874079 0.000000       6.874079 
1 1 1 -21 14 35 o 9.335571 4.584088 -6.379861      3.594269 -8.281252      5.821073 -5.208275      4.569351 12.22324 5.966351 11.56114 5.556142 0.6620922      8.152794 
1 1 1 -21 14 36 o 42.57619 4.518745 24.21919       4.616852 22.03142       7.257590 25.70635       5.983690 37.03710 8.252432 42.60536 5.923233 -5.568256      10.15812 
1 1 1 -21 14 37 o 15.10603 6.165816 2.210723       3.587486 0.3917645      5.672904 3.422942       4.631104 15.83336 7.100292 17.26150 7.020506 -1.428140      9.985071 
1 1 1 -21 14 38 o 16.43698 6.464666 3.345850       3.794570 1.286906       5.967687 4.743301       4.916453 16.50144 7.349180 18.54014 7.337790 -2.038702      10.38526 
1 1 1 -21 15 1  o 107.3725 3.041842 141.2504       7.951112 126.2546       15.09744 147.0061       9.353366 100.6326 6.186321 109.4404 3.511693 -8.807793      7.113547 
1 1 1 -21 15 2  o 67.13097 3.778797 55.46653       6.156811 0.000000       0.000000 55.46653       6.156811 ?        ?        67.13097 3.778797 0.000000       3.778797 
1 1 1 -21 15 3  f 60.11082 3.621499 44.45850       5.280295 64.57497       16.99819 42.31002       5.555118 70.46164 10.19551 58.58662 3.913417 11.87502       10.92077 
1 1 1 -21 15 4  o 122.6946 3.181460 184.4084       9.504327 197.0436       14.78264 175.5049       12.40907 126.4030 4.807850 119.4377 4.270329 6.965347       6.430485 
1 1 1 -21 15 5  o 62.32508 3.553628 47.75347       5.374863 47.29078       8.830691 48.02575       6.774182 61.52907 5.964211 62.33933 4.489282 -0.8102570     7.464949 
1 1 1 -21 15 6  f 173.6360 3.510911 369.3945       14.85579 374.9792       22.16686 364.8410       20.01593 174.2849 5.225155 172.0943 4.777421 2.190552       7.079971 
1 1 1 -21 15 7  o 87.43412 3.939474 93.98035       8.372176 91.76146       10.56759 97.72080       13.72046 86.14636 5.056110 88.52721 6.403257 -2.380844      8.158795 
1 1 1 -21 15 8  f 92.82546 2.748647 105.4356       6.210744 101.0565       10.97512 107.4985       7.532934 90.43127 4.999749 93.64167 3.306290 -3.210396      5.994084 
1 1 1 -21 15 9  o 58.88733 3.490064 42.63169       4.985850 41.45368       8.430044 43.26545       6.183230 57.53870 6.105272 59.18680 4.316688 -1.648106      7.477175 
1 1 1 -21 15 10 o 44.72038 3.426263 24.64039       3.705460 27.32132       7.937435 23.89331       4.190061 46.27583 7.278754 43.95155 3.954334 2.324284       8.283539 
1 1 1 -21 15 11 o 100.1128 3.245881 122.8525       7.908312 114.6829       12.10499 128.9359       10.44566 96.27650 5.178561 102.3612 4.196491 -6.084732      6.665436 
1 1 1 -21 15 12 o 48.87756 3.681187 29.46317       4.352411 22.63262       7.966418 32.36959       5.196535 41.77748 8.117575 51.15472 4.205729 -9.377235      9.142384 
1 1 1 -21 15 13 o 115.1982 2.757836 162.3191       7.741948 143.7350       13.42876 171.5712       9.475104 107.7788 5.127598 118.2947 3.290065 -10.51598      6.092355 
1 1 1 -21 15 14 o 83.90857 3.009159 86.30836       6.143045 70.02457       16.13459 89.06908       6.643405 73.68695 9.184078 85.20728 3.205183 -11.52032      9.727306 
1 1 1 -21 15 15 o 102.9033 3.044683 129.8015       7.626575 119.0581       12.65393 135.9305       9.557535 97.94104 5.321808 105.1486 3.735917 -7.207520      6.502208 
1 1 1 -21 15 16 o 41.25385 3.522927 21.03660       3.507778 14.93497       7.905704 22.53230       3.914170 33.62326 9.323755 42.65641 3.805387 -9.033150      10.07042 
1 1 1 -21 15 17 o 78.68369 2.892493 75.93170       5.536729 79.56763       13.69512 75.22131       6.053497 79.25198 7.168638 78.26077 3.180768 0.9912109      7.842618 
1 1 1 -21 15 18 o 182.7995 4.969929 414.1746       22.11863 435.0453       33.90508 398.7115       29.18405 185.3431 7.522384 178.0931 6.736681 7.250015       10.09798 
1 1 1 -21 15 19 o 37.06160 4.179754 17.15414       3.709179 13.59577       7.657622 18.24494       4.239745 32.00329 9.280271 38.12731 4.659905 -6.124016      10.38451 
1 1 1 -21 15 20 o 49.32776 3.560511 30.09622       4.251161 23.21899       8.283749 32.55502       4.953155 41.84337 8.415832 51.21590 4.000347 -9.372532      9.318208 
1 1 1 -21 15 21 o 76.11941 3.059486 71.28519       5.663622 71.55253       10.06404 71.16129       6.851529 75.45683 5.511159 75.87997 3.716615 -0.4231339     6.647263 
1 1 1 -21 15 22 o 58.92748 3.260567 42.86523       4.663917 48.91844       8.887816 40.56496       5.478879 62.06872 5.948786 57.14314 3.958995 4.925583       7.145747 
1 1 1 -21 15 23 o 61.95269 3.301662 47.43439       4.966582 56.41114       9.274225 43.82478       5.880959 66.65683 5.766131 59.31563 4.093688 7.341202       7.071531 
1 1 1 -21 15 24 o 67.39955 3.491959 56.28667       5.715824 75.59272       14.08152 52.47828       6.254230 75.84138 7.726972 64.91375 3.972702 10.92764       8.688409 
1 1 1 -21 15 25 o 66.08613 3.280899 54.09450       5.267192 42.90392       8.857477 60.21665       6.551422 57.49741 6.431643 69.51171 3.883034 -12.01431      7.512920 
1 1 1 -21 15 26 o 53.66026 3.505007 35.86781       4.558209 39.67223       8.193069 34.16237       5.485549 55.22242 6.194970 52.05157 4.364803 3.170849       7.578203 
1 1 1 -21 15 27 o 30.50816 6.708241 12.59141       4.851209 10.96676       6.708123 14.37270       7.024069 28.01952 8.811350 31.79335 8.777850 -3.773825      12.43746 
1 1 1 -21 15 28 o 68.37276 5.581013 60.64655       9.218088 60.64655       9.218088 0.000000       0.000000 68.37276 5.581013 ?        ?        0.000000       5.581013 
1 1 1 -21 15 29 o 56.64667 3.496457 40.26646       4.803048 35.88357       7.800460 42.94289       6.095624 51.81298 6.307798 58.05862 4.339792 -6.245644      7.656507 
1 1 1 -21 15 30 f 45.54916 3.994970 26.43797       4.389499 25.87153       7.435484 26.74098       5.438260 42.94065 7.371042 45.25570 5.015262 -2.315048      8.915442 
1 1 1 -21 15 31 o 21.20902 6.422992 6.216755       3.604503 4.186961       5.988768 7.369735       4.513592 20.04072 8.043040 22.86218 7.232812 -2.821461      10.81684 
1 1 1 -21 15 32 o 17.15526 6.510657 3.349149       3.749275 2.240288       6.367904 3.937502       4.638495 18.64508 7.952094 18.58566 7.193792 0.5942535E-01  10.72317 
1 1 1 -21 15 33 o 13.75867 5.975850 0.2603473      3.723696 -5.541162      7.950234 1.890722       4.214569 16.03531 7.600421 15.94753 6.613804 0.8778477E-01  10.07516 
1 1 1 -21 15 34 o 38.37015 5.512527 20.19134       5.006635 16.80600       10.61080 21.16089       5.678502 29.80379 11.02604 38.72641 6.228299 -8.922615      12.66354 
1 1 1 -21 15 35 o 17.04881 6.503251 3.591624       3.752608 2.438962       6.018114 4.324915       4.800071 17.82946 7.669839 18.55365 7.278800 -0.7241898     10.57390 
1 1 1 -21 15 36 o 14.95564 6.287115 1.690937       3.885780 8.993120       6.250528 -2.908921      4.960923 23.32288 8.489839 13.12043 6.152191 10.20245       10.48460 
1 1 1 -21 15 37 o 34.21710 6.228965 17.22587       5.002631 9.357341       6.736538 26.90034       7.469708 23.27866 8.750924 41.13561 7.735469 -17.85695      11.67973 
1 1 1 -21 15 38 o 14.00299 5.980744 1.246287       3.611137 7.206893       6.250370 -1.740178      4.424245 21.07236 8.294142 12.84793 5.951980 8.224434       10.20876 
1 1 1 -21 16 1  o 17.31986 6.455105 2.905839       3.649311 -1.740909      6.623438 4.931304       4.372917 17.65304 7.808625 20.69699 7.142336 -3.043949      10.58242 
1 1 1 -21 16 2  o 78.19383 3.484765 75.15325       6.623533 60.68056       11.66854 82.03349       8.045329 69.29755 7.005873 81.57732 4.059803 -12.27977      8.097177 
1 1 1 -21 16 3  o 17.82216 6.703261 2.981055       3.953907 0.000000       0.000000 2.981055       3.953907 ?        ?        17.82216 6.703261 0.000000       6.703261 
1 1 1 -21 16 4  o 122.9750 3.216841 185.3969       9.631845 222.0395       25.07221 179.0529       10.43237 132.6740 7.789064 120.7710 3.548590 11.90309       8.559323 
1 1 1 -21 16 5  o 28.60454 5.025263 10.38523       3.375154 20.07738       6.895864 7.331971       3.870440 39.43097 7.449471 23.87709 6.485352 15.55387       9.876964 
1 1 1 -21 16 6  o 51.44881 3.415909 32.58476       4.258447 18.42084       7.776520 38.65123       5.089342 37.45689 8.688303 55.99790 3.751163 -18.54100      9.463500 
1 1 1 -21 16 7  o 85.42854 3.409794 89.58926       7.084249 86.80235       10.64707 91.80325       9.489789 83.66089 5.248865 86.23573 4.531689 -2.574837      6.934464 
1 1 1 -21 16 8  o 108.9920 3.131653 145.5863       8.309095 146.7237       13.13871 144.8282       10.72652 108.9429 4.962032 108.4928 4.064344 0.4500961      6.414098 
1 1 1 -21 16 9  o 110.3287 2.765049 148.9924       7.428225 150.9997       13.12471 148.0463       9.010197 110.5400 4.884360 109.8565 3.369662 0.6835709      5.933936 
1 1 1 -21 16 10 o 74.34804 2.871705 67.74255       5.193117 53.20992       9.120070 74.71537       6.317281 65.26733 5.794266 78.01025 3.330758 -12.74292      6.683372 
1 1 1 -21 16 11 o 14.00088 5.625823 1.163526       2.933746 5.705146       6.760862 0.1099792      3.256294 23.68133 8.793819 13.43335 5.706382 10.24798       10.48304 
1 1 1 -21 16 12 o 89.49025 3.308151 98.30309       7.201931 94.82861       11.13237 100.8039       9.444610 87.40359 5.250845 90.39539 4.299802 -2.991791      6.786728 
1 1 1 -21 16 13 o 180.4057 3.172105 398.8525       13.94549 417.7917       24.19074 389.4256       17.06683 183.5563 5.414005 177.9854 3.934890 5.570923       6.692892 
1 1 1 -21 16 14 o 103.1490 2.769773 130.3273       6.955879 104.9235       12.53847 141.6216       8.360347 91.76556 5.634139 107.4356 3.196858 -15.67004      6.477918 
1 1 1 -21 16 15 o 148.7842 3.160128 271.4163       11.45770 264.4281       24.93711 273.2863       12.89996 144.8930 7.084039 149.1745 3.548605 -4.281540      7.923144 
1 1 1 -21 16 16 o 59.42532 3.511467 43.52574       5.062393 66.07143       12.30319 38.93060       5.554381 72.13723 7.090298 56.07135 4.093176 16.06588       8.186966 
1 1 1 -21 16 17 o 79.39391 3.248356 77.50340       6.271463 88.80964       13.88535 74.60587       7.029292 83.73619 6.864892 77.78361 3.719182 5.952583       7.807628 
1 1 1 -21 16 18 o 101.3303 3.164740 126.1831       7.805138 109.3805       12.19849 137.8305       10.15627 93.57947 5.371779 105.6595 3.951440 -12.08001      6.668575 
1 1 1 -21 16 19 o 35.67076 3.892574 15.87589       3.328805 11.58611       7.344481 16.98495       3.734403 29.68961 9.202216 36.83260 4.237700 -7.142982      10.13109 
1 1 1 -21 16 20 o 22.39984 5.424389 6.517157       2.929116 15.55003       7.189917 4.719657       3.207342 33.97013 8.660454 19.41114 6.091161 14.55899       10.58800 
1 1 1 -21 16 21 o 74.90504 3.080220 69.11246       5.610498 68.32095       9.816127 69.49649       6.837395 73.60616 5.512595 74.91634 3.757218 -1.310173      6.671237 
1 1 1 -21 16 22 o 80.09991 3.062837 79.07699       5.967482 82.11780       10.35794 77.56622       7.300914 80.72707 5.294462 79.08762 3.799311 1.639458       6.516601 
1 1 1 -21 16 23 o 22.56251 6.123796 6.695490       3.452415 7.105505       7.003211 6.563855       3.968097 24.59704 8.981464 22.42883 6.727483 2.168205       11.22166 
1 1 1 -21 16 24 o 108.4877 3.456268 145.8100       9.125770 159.7678       19.41903 141.8539       10.33849 110.5465 7.248511 106.7166 3.982460 3.829918       8.270484 
1 1 1 -21 16 25 o 16.94725 6.200733 3.129369       3.340551 8.089622       6.571306 1.400823       3.879183 25.07053 8.749711 15.60110 6.394813 9.469431       10.83748 
1 1 1 -21 16 26 o 18.99604 7.301581 3.638929       4.754641 0.2663372      6.912678 6.667021       6.550116 18.67089 8.125382 23.47982 8.667232 -4.808935      11.88035 
1 1 1 -21 16 27 o 86.22827 3.794604 93.19432       7.954033 100.9763       10.79387 83.94693       11.76635 88.85919 5.004925 80.10944 6.072519 8.749756       7.869229 
1 1 1 -21 16 28 o 21.08006 6.971678 5.885190       4.165377 10.14058       6.327927 2.631551       5.533203 26.66124 8.578293 18.59895 7.632046 8.062286       11.48195 
1 1 1 -21 16 29 o 11.10192 5.135411 -2.255819      3.275263 -1.379413      5.937962 -2.639052      3.926601 16.04162 7.223080 12.11747 5.611375 3.924155       9.146606 
1 1 1 -21 16 30 o 39.42742 4.394372 20.09934       4.150447 24.11564       7.126358 18.03772       5.105750 41.28405 7.353139 36.48554 5.947185 4.798512       9.457150 
1 1 1 -21 16 31 o 24.30671 6.415590 8.328471       3.855052 8.986307       6.771016 8.012954       4.689286 24.75862 8.859427 23.60272 7.359026 1.155897       11.51715 
1 1 1 -21 16 32 o 19.86298 6.884952 5.369901       4.065264 -1.916637      7.876832 8.015441       4.746223 17.56837 8.067655 23.41999 7.417809 -5.851622      10.95951 
1 1 1 -21 16 33 o 13.28574 5.894612 -0.3654567     3.802512 -6.059403      6.687126 2.355406       4.622598 14.26558 6.819976 16.73415 6.932086 -2.468565      9.724500 
1 1 1 -21 16 34 o 13.51395 5.895148 0.2866217      3.657155 4.545878       5.674199 -2.740014      4.783192 19.36990 7.809662 13.11784 6.114851 6.252064       9.918781 
1 1 1 -21 16 35 o 22.31167 6.764797 7.526093       3.996727 6.446387       6.283652 8.259683       5.179480 21.01871 8.302840 22.85659 7.776608 -1.837881      11.37597 
1 1 1 -21 16 36 o 12.92740 5.686774 0.1589689      3.467301 7.210067       5.936100 -3.492514      4.271766 21.41831 8.177011 11.74424 5.567912 9.674068       9.892682 
1 1 1 -21 16 37 o 14.01034 6.243855 0.1576010      4.314938 -5.152090      5.949662 6.049182       6.267200 13.21708 6.348874 20.16972 8.180376 -6.952634      10.35503 
1 1 1 -21 17 1  o 102.2525 3.067618 128.3066       7.635188 116.5531       14.62718 132.7085       8.951468 96.36671 6.262621 103.8711 3.541596 -7.504433      7.194674 
1 1 1 -21 17 2  f 18.06871 6.182076 3.768036       3.274030 12.34068       7.888384 1.983970       3.598621 30.83148 9.533630 16.08950 6.305260 14.74198       11.43007 
1 1 1 -21 17 3  o 72.41270 3.529457 64.53349       6.209386 0.000000       0.000000 64.53349       6.209386 ?        ?        72.41270 3.529457 0.000000       3.529457 
1 1 1 -21 17 4  o 61.20364 3.224157 46.05338       4.791759 40.50212       8.752747 48.42920       5.726061 56.60626 6.460726 62.66629 3.766999 -6.060028      7.478721 
1 1 1 -21 17 5  o 144.2698 3.327336 255.2726       11.69791 220.6739       25.98106 264.0699       13.10097 131.7942 8.129113 146.5862 3.670423 -14.79199      8.919333 
1 1 1 -21 17 6  o 69.56985 3.041371 59.40377       5.143703 58.61147       9.628624 59.72018       6.084688 68.44496 5.828187 69.65485 3.596867 -1.209885      6.848738 
1 1 1 -21 17 7  o 64.84752 5.246907 52.38358       8.220740 49.71609       11.12525 55.59177       12.20082 62.47390 7.454513 66.00237 7.732055 -3.528477      10.74032 
1 1 1 -21 17 8  f 30.90605 4.782249 12.05889       3.485529 11.25469       7.168926 12.30785       3.988715 29.57134 9.078660 31.07836 5.466175 -1.507025      10.59722 
1 1 1 -21 17 9  o 74.04232 2.886142 67.22723       5.197580 61.06171       9.344349 69.98933       6.254381 69.95769 5.526073 75.45609 3.410184 -5.498405      6.493600 
1 1 1 -21 17 10 o 78.54896 2.800151 75.62477       5.351341 79.14658       10.06502 74.23690       6.318388 79.78997 5.204840 77.72588 3.343655 2.064087       6.186306 
1 1 1 -21 17 11 o 99.02658 2.763617 120.1347       6.662556 122.2620       12.31143 119.2537       7.922990 99.25671 5.107111 98.54807 3.303842 0.7086334      6.082594 
1 1 1 -21 17 12 o 97.21832 2.764329 115.8066       6.542335 128.6834       12.38475 110.8224       7.705165 101.8503 5.005193 94.98045 3.334155 6.869865       6.014029 
1 1 1 -21 17 13 o 116.9738 3.356778 168.0753       9.558683 0.000000       0.000000 168.0753       9.558683 ?        ?        116.9738 3.356778 0.000000       3.356778 
1 1 1 -21 17 14 o 94.18577 4.387775 109.7248       10.04316 118.7233       16.34358 104.2653       12.73035 96.90444 6.967485 91.31947 5.749776 5.584976       9.033591 
1 1 1 -21 17 15 o 91.69363 3.316304 103.3809       7.397990 102.8170       15.57725 103.5452       8.406545 89.97059 7.163958 91.64478 3.772272 -1.674194      8.096439 
1 1 1 -21 17 16 o 19.71633 5.836781 4.938472       3.002251 7.834535       8.915748 4.568086       3.188460 26.98122 10.08294 19.20224 6.079580 7.778982       11.77399 
1 1 1 -21 17 17 o 72.04437 2.795942 63.73633       4.899356 72.93305       10.15276 60.94460       5.593762 76.25530 5.500552 70.34515 3.272090 5.910156       6.400207 
1 1 1 -21 17 18 o 28.29744 5.844030 10.39014       3.896415 12.44297       7.285180 9.567630       4.611401 30.55247 9.104082 26.95841 6.968854 3.594061       11.46513 
1 1 1 -21 17 19 o 86.75166 2.728685 92.42486       5.761385 98.67622       11.41511 90.28809       6.673788 88.68793 5.306031 85.61439 3.204474 3.073547       6.198598 
1 1 1 -21 17 20 o 71.03088 2.804103 62.06079       4.844213 72.87904       10.06107 58.79601       5.527042 76.01347 5.468009 69.00949 3.296136 7.003983       6.384640 
1 1 1 -21 17 21 o 97.78980 2.905870 117.7109       6.917097 153.2636       18.59675 112.0025       7.451745 109.0069 7.038411 95.27906 3.214005 13.72784       7.737510 
1 1 1 -21 17 22 o 19.55871 6.330356 4.799194       3.442733 7.852102       7.250060 3.910384       3.911914 25.42845 9.159095 18.67679 6.727768 6.751661       11.36450 
1 1 1 -21 17 23 o 62.88192 3.330132 49.02868       5.084781 50.93275       9.150014 48.17794       6.116115 62.87836 6.045946 62.06990 4.065895 0.8084602      7.285943 
1 1 1 -21 17 24 o 35.49211 4.993959 16.19301       4.200009 13.18103       11.26882 16.67891       4.526127 31.02695 11.38276 35.90278 5.335184 -4.875834      12.57105 
1 1 1 -21 17 25 o 34.48842 6.406543 15.87514       5.186188 25.88737       7.795263 7.924226       6.946630 43.58237 7.616921 24.90367 8.965983 18.67870       11.76462 
1 1 1 -21 17 26 o 55.57922 4.533214 39.30488       6.086527 40.79559       8.440233 37.68973       8.785439 55.53700 6.350467 52.93876 6.980004 2.598244       9.436572 
1 1 1 -21 17 27 f 23.31145 6.298820 7.417272       3.662332 1.316515       6.557271 10.18310       4.415136 18.69737 8.024049 27.16018 6.710336 -8.462811      10.46011 
1 1 1 -21 17 28 o 52.10880 4.453833 34.83928       5.601460 25.45232       7.792425 44.87586       8.057546 42.32040 7.844707 58.24994 5.751345 -15.92953      9.727148 
1 1 1 -21 17 29 o 35.98024 4.843197 16.96341       4.138766 18.24915       7.262452 16.34499       5.036686 34.93342 8.591678 34.56753 6.207279 0.3658943      10.59940 
1 1 1 -21 17 30 o 53.43014 3.666047 36.23950       4.744392 36.39991       7.804777 36.14548       5.975105 51.57804 6.342967 52.69011 4.702891 -1.112068      7.896228 
1 1 1 -21 17 31 o 30.00885 6.119973 12.55705       4.323578 16.78228       8.597782 11.12693       5.002050 31.74181 9.974626 27.51126 7.329599 4.230547       12.37805 
1 1 1 -21 17 32 o 46.45933 4.607552 28.42598       5.147850 30.85946       10.32533 27.62100       5.938555 42.91380 10.05105 45.08305 5.520504 -2.169243      11.46733 
1 1 1 -21 17 33 o 13.95655 6.199109 -0.2231420     4.217185 -5.103926      9.285219 1.045340       4.733578 17.17556 8.161958 15.62471 6.762156 1.550855       10.59926 
1 1 1 -21 17 34 o 45.91149 4.231564 27.80792       4.681097 39.16238       7.919481 21.71055       5.803432 52.21021 6.355281 38.75313 6.366148 13.45708       8.995412 
1 1 1 -21 17 35 o 12.03636 5.510917 -1.352159      3.638791 -7.251283      6.118696 1.875806       4.526156 12.77879 6.210361 15.79351 6.718997 -3.014726      9.149508 
1 1 1 -21 17 36 o 22.24390 6.607488 7.604977       3.842187 -0.2440692     6.480591 11.85935       4.771162 16.12308 7.371647 27.46605 7.082645 -11.34297      10.22277 
1 1 1 -21 18 1  o 10.40449 4.883245 -3.180524      3.138046 -13.22711      6.527417 -0.1606046     3.578737 12.44361 6.123564 13.74576 5.913846 -1.302145      8.513026 
1 1 1 -21 18 2  o 122.8318 3.109926 185.2478       9.301381 165.1802       17.88539 192.6873       10.88985 114.5522 6.432907 125.1227 3.575157 -10.57056      7.359622 
1 1 1 -21 18 3  o 44.98025 4.411482 25.21965       4.773388 0.000000       0.000000 25.21965       4.773388 ?        ?        44.98025 4.411482 0.000000       4.411482 
1 1 1 -21 18 4  o 128.9358 3.123630 203.9243       9.814522 197.9170       20.17845 205.7859       11.23272 125.4036 6.626526 129.3437 3.567128 -3.940094      7.525640 
1 1 1 -21 18 5  o 13.12158 5.576892 0.1155494      3.113010 -1.753844      6.832317 0.6053064      3.497100 17.89075 7.921453 14.37035 5.997397 3.520403       9.935702 
1 1 1 -21 18 6  f 41.59269 4.212970 21.53870       4.211306 22.88086       7.735809 20.97340       5.020443 41.86551 7.871384 40.81986 5.162262 1.045654       9.413162 
1 1 1 -21 18 7  o 96.38277 3.402670 114.2014       7.979460 123.3405       12.33426 107.6235       10.46424 99.62908 5.097259 93.21230 4.621201 6.416779       6.880228 
1 1 1 -21 18 8  o 70.20026 3.190165 60.57583       5.443165 61.93726       9.369262 59.88223       6.687491 70.38667 5.506131 69.63258 3.957366 0.7540894      6.780724 
1 1 1 -21 18 9  o 13.21213 5.469358 0.6292241      2.874891 3.757917       6.285258 -0.1985311     3.232902 21.30393 8.337570 13.04781 5.617285 8.256126       10.05331 
1 1 1 -21 18 10 o 78.95028 2.831500 76.45919       5.438792 85.41521       10.67762 73.32145       6.320124 82.77010 5.321973 77.20362 3.367423 5.566475       6.297852 
1 1 1 -21 18 11 o 77.31174 3.019687 73.40131       5.678157 79.00898       13.26154 72.14249       6.283236 78.92303 6.966772 76.57020 3.375640 2.352837       7.741502 
1 1 1 -21 18 12 o 96.19058 3.340879 113.7796       7.819332 121.0663       15.89273 111.4524       8.981632 97.89913 6.702105 95.04711 3.885948 2.852020       7.747180 
1 1 1 -21 18 13 o 26.30070 6.291833 9.012139       3.978351 10.87314       13.38543 8.831815       4.166639 31.89231 12.25300 26.01115 6.572008 5.881161       13.90422 
1 1 1 -21 18 14 o 81.43262 2.833687 81.40376       5.614668 85.16451       11.03214 80.08916       6.522589 82.45182 5.522489 80.65849 3.325572 1.793335       6.446496 
1 1 1 -21 18 15 o 138.4239 3.381565 235.6714       11.40683 245.9296       18.14904 228.9733       14.66545 140.3494 5.316096 135.9182 4.433671 4.431213       6.922306 
1 1 1 -21 18 16 o 59.04496 3.034274 42.93018       4.351256 50.38823       9.407755 40.90054       4.907746 62.98201 6.210338 57.52378 3.517875 5.458225       7.137488 
1 1 1 -21 18 17 o 17.83486 5.855991 3.864115       2.940753 11.79712       6.859077 2.077481       3.255104 29.73660 8.827160 15.60092 6.029606 14.13568       10.68994 
1 1 1 -21 18 18 o 77.79864 2.853830 74.44282       5.401316 77.78922       10.60159 73.26967       6.277086 78.51671 5.577105 77.04623 3.351279 1.470474       6.506548 
1 1 1 -21 18 19 o 78.85119 2.790766 76.48272       5.354051 69.38528       10.65989 78.87722       6.191689 73.84878 5.974398 79.96384 3.183819 -6.115059      6.769795 
1 1 1 -21 18 20 o 56.92130 3.005257 39.99851       4.153852 46.79931       8.867693 38.08679       4.701570 60.41606 6.106882 55.41165 3.499693 5.004410       7.038597 
1 1 1 -21 18 21 o 71.14425 2.827628 62.38828       4.892516 61.62907       9.776595 62.64194       5.651017 69.43395 5.831871 71.15237 3.267851 -1.718422      6.685026 
1 1 1 -21 18 22 o 116.8090 2.768727 168.0214       7.881204 163.7373       14.34803 169.8725       9.431418 113.7062 5.191816 117.1430 3.307193 -3.436760      6.155687 
1 1 1 -21 18 23 o 78.46632 3.184691 76.30498       6.076917 84.04327       10.87159 72.78839       7.328771 81.00378 5.540828 76.28564 3.955837 4.718140       6.808041 
1 1 1 -21 18 24 o 45.58963 5.203779 26.77234       5.677825 28.04984       7.932610 25.43035       8.130357 45.48992 7.410789 42.87600 8.077672 2.613922       10.96214 
1 1 1 -21 18 25 o 15.23051 6.563368 0.2527039      4.421891 0.2015930      6.264547 0.3034557      6.242507 17.71252 7.721307 17.75460 7.724111 -0.4208183E-01 10.92156 
1 1 1 -21 18 26 o 24.75580 6.039209 8.328999       3.610369 1.651012       6.453911 11.37063       4.355655 18.81733 8.014948 28.86540 6.363679 -10.04807      10.23405 
1 1 1 -21 18 27 o 64.36004 3.775409 52.31697       5.895286 59.39568       12.77621 50.40211       6.644985 64.50443 8.321550 62.79396 4.369766 1.710472       9.399098 
1 1 1 -21 18 28 o 21.99763 6.389724 6.697955       3.627449 3.896505       5.958575 8.347564       4.572372 19.83397 8.000772 24.25302 7.208984 -4.419044      10.76949 
1 1 1 -21 18 29 o 24.23670 6.136050 8.182920       3.626987 2.997725       6.018324 11.14025       4.545097 19.00428 7.894333 28.03992 6.736123 -9.035639      10.37766 
1 1 1 -21 18 30 o 42.86484 4.271286 23.81847       4.402332 28.22797       7.433142 21.43609       5.463653 44.55009 7.083700 39.65933 5.826909 4.890766       9.172332 
1 1 1 -21 18 31 o 23.11690 6.962938 7.799994       4.244173 2.288249       8.056777 9.916965       4.993146 19.78958 8.688259 25.70829 7.505038 -5.918715      11.48092 
1 1 1 -21 18 32 o 14.30970 6.055364 1.109858       3.643121 5.921531       6.038010 -1.644572      4.568374 20.92565 8.177070 13.50518 6.180198 7.420474       10.24985 
1 1 1 -21 18 33 o 33.42398 6.313738 16.14108       4.954157 19.24154       11.67080 15.45960       5.471595 30.21280 11.48203 31.93640 7.202827 -1.723600      13.55425 
1 1 1 -21 18 34 o 20.07303 6.732203 5.978845       3.881427 6.880709       6.558601 5.492723       4.815191 21.37625 8.470388 19.59526 7.391482 1.780987       11.24195 
1 1 1 -21 18 35 o 36.64602 5.025862 18.56404       4.370102 11.72212       6.952131 23.03364       5.619051 25.54428 8.993299 39.97877 5.948571 -14.43449      10.78262 
1 1 1 -21 18 36 o 22.63677 6.716125 7.985249       3.971471 8.401695       6.856345 7.774970       4.872034 22.19432 8.701587 21.88447 7.539494 0.3098545      11.51354 
1 1 1 -21 19 1  o 75.20209 3.142837 69.62782       5.746846 71.79237       11.60556 68.92464       6.614769 75.16895 6.396349 74.68757 3.645391 0.4813766      7.362212 
1 1 1 -21 19 2  o 107.9643 3.773494 143.9164       9.912692 132.3466       15.92152 151.2400       12.66729 102.2597 6.421581 110.2726 4.724848 -8.012817      7.972508 
1 1 1 -21 19 3  o 55.59807 3.923470 38.32244       5.281631 0.000000       0.000000 38.32244       5.281631 ?        ?        55.59807 3.923470 0.000000       3.923470 
1 1 1 -21 19 4  o 47.43544 3.676013 27.87355       4.216147 15.56480       9.197831 31.14780       4.743887 34.00022 10.25240 50.10625 3.916225 -16.10603      10.97491 
1 1 1 -21 19 5  o 49.95779 3.995623 30.97966       4.823822 21.32442       9.414042 34.41736       5.617307 39.62713 9.803249 52.56733 4.426144 -12.94020      10.75614 
1 1 1 -21 19 6  o 159.1997 3.091911 311.1032       11.99514 307.3929       20.41508 313.0595       14.82385 157.0174 5.343188 159.3921 3.816436 -2.374756      6.566189 
1 1 1 -21 19 7  o 39.57389 7.347320 20.43627       6.824761 24.99244       10.09911 16.60670       9.258877 42.94323 9.859198 35.05991 10.21555 7.883327       14.19723 
1 1 1 -21 19 8  o 37.41922 5.173722 17.72071       4.591647 0.000000       0.000000 17.72071       4.591647 ?        ?        37.41922 5.173722 0.000000       5.173722 
1 1 1 -21 19 9  o 103.2698 3.364654 131.2285       8.456089 140.6951       17.07602 128.1529       9.733318 105.4436 6.679876 101.8700 3.928195 3.573601       7.749288 
1 1 1 -21 19 10 o 44.96966 4.200146 25.19345       4.549537 20.16801       9.578311 26.65754       5.169959 38.45035 10.09555 46.15481 4.660336 -7.704460      11.11930 
1 1 1 -21 19 11 o 161.6753 3.416789 321.5154       13.46164 317.1009       20.70193 324.7496       17.71941 159.4021 5.336956 161.8707 4.496408 -2.468628      6.978595 
1 1 1 -21 19 12 o 16.40842 5.934631 2.857532       3.047706 15.16358       7.206039 0.1767418      3.363325 33.60024 8.724536 13.64159 5.797298 19.95865       10.47503 
1 1 1 -21 19 13 o 10.43631 4.877327 -2.894328      3.074773 -12.74819      13.62329 -2.365427      3.156213 21.18804 10.01488 10.99663 5.070495 10.19140       11.22532 
1 1 1 -21 19 14 o 22.89586 5.845632 6.831469       3.272401 9.142439       7.704130 6.322736       3.614689 27.23803 9.475956 22.10526 6.365788 5.132767       11.41565 
1 1 1 -21 19 15 o 33.40860 4.305726 14.05318       3.424002 13.32056       7.589087 14.24042       3.836692 31.42266 9.274166 33.49567 4.840599 -2.073004      10.46143 
1 1 1 -21 19 16 o 68.07657 2.960169 57.06993       4.899039 59.04924       10.22883 56.48075       5.580754 68.04523 6.238020 67.61049 3.398108 0.4347458      7.103522 
1 1 1 -21 19 17 o 39.87327 4.349964 19.98223       4.158253 22.53385       7.714424 18.93725       4.936837 41.03404 8.002311 38.48526 5.413448 2.548782       9.661387 
1 1 1 -21 19 18 o 78.32285 2.792785 75.50452       5.321898 74.66376       10.52759 75.79314       6.168060 76.69584 5.672915 78.33745 3.238026 -1.641609      6.531981 
1 1 1 -21 19 19 o 11.76989 5.116808 -0.3226069     2.735335 -4.373995      6.473872 0.5578358      3.017955 15.64199 7.230018 13.29742 5.562098 2.344568       9.121956 
1 1 1 -21 19 20 o 61.63719 2.984635 46.94635       4.469689 35.72116       8.658102 51.02491       5.218905 52.09942 6.996190 64.15015 3.350065 -12.05073      7.756907 
1 1 1 -21 19 21 o 15.96124 5.760399 2.812374       2.869446 10.26275       7.104533 1.360117       3.136665 27.52637 9.105009 14.38511 5.804144 13.14126       10.79765 
1 1 1 -21 19 22 o 43.20215 3.486343 23.32131       3.639236 34.38374       8.177752 20.58951       4.063814 50.96589 6.750247 40.34890 4.194132 10.61699       7.947112 
1 1 1 -21 19 23 o 49.50643 4.323961 31.04457       5.164204 26.91585       12.09822 31.96446       5.710597 41.57855 11.53566 50.05181 4.738356 -8.473255      12.47091 
1 1 1 -21 19 24 o 72.67789 2.924225 65.52370       5.168465 67.79647       9.897053 64.67146       6.060517 72.20067 5.670552 71.94464 3.467012 0.2560272      6.646452 
1 1 1 -21 19 25 o 22.24637 6.455209 6.747134       3.703937 6.427855       6.920357 6.875315       4.384860 23.04834 8.821621 22.47469 7.131232 0.5736542      11.34352 
1 1 1 -21 19 26 o 58.58506 3.522154 43.18893       5.005197 38.63531       8.385499 45.70916       6.238363 53.35610 6.589092 59.81267 4.308854 -6.456570      7.872888 
1 1 1 -21 19 27 o 11.36472 5.383004 -4.003219      3.975032 -6.444272      5.938354 -2.021487      5.350569 13.42639 6.420964 14.77485 6.733364 -1.348456      9.304137 
1 1 1 -21 19 28 o 28.53125 5.901331 11.18007       3.967561 8.236792       6.737853 12.74232       4.908860 24.10356 8.808351 29.95907 6.870481 -5.855503      11.17097 
1 1 1 -21 19 29 o 40.05548 4.452629 20.92236       4.272887 14.29748       6.967288 24.91615       5.409631 30.20708 8.878377 43.22721 5.242414 -13.02013      10.31060 
1 1 1 -21 19 30 o 25.38769 6.655333 9.326616       4.166904 2.377558       8.085974 11.83927       4.862228 19.89281 8.719648 28.40863 7.055472 -8.515825      11.21659 
1 1 1 -21 19 31 f 15.22397 6.228333 1.951718       3.671041 3.760251       6.099245 0.9243819      4.596942 19.13620 7.948018 15.41174 6.666917 3.724461       10.37395 
1 1 1 -21 19 32 o 31.46880 5.686819 13.90428       4.200529 12.02597       6.877162 15.02201       5.305108 26.68727 8.961313 31.64333 7.059351 -4.956062      11.40787 
1 1 1 -21 19 33 f 27.22717 6.309348 10.92550       4.104218 5.559777       6.674919 14.18727       5.204255 20.38183 8.375146 30.41829 7.143428 -10.03647      11.00780 
1 1 1 -21 19 34 o 55.27702 3.894804 40.05177       5.212873 35.04187       8.402304 43.18684       6.646719 47.52270 7.504182 56.29074 4.894046 -8.768044      8.959043 
1 1 1 -21 19 35 o 23.22496 6.601864 8.321369       3.912364 9.853318       6.586870 7.486302       4.863152 23.64907 8.698132 21.58725 7.527539 2.061821       11.50310 
1 1 1 -21 20 1  o 98.82999 3.387523 120.5488       8.146379 98.17069       13.81214 132.4857       10.08776 87.66177 6.512202 103.3498 4.013058 -15.68800      7.649406 
1 1 1 -21 20 2  o 104.2656 3.523502 134.2346       8.939789 153.3258       16.73669 126.6133       10.57470 109.8984 6.275541 100.9282 4.309433 8.970169       7.612728 
1 1 1 -21 20 3  o 74.94082 4.319954 69.87326       7.855780 0.000000       0.000000 69.87326       7.855780 ?        ?        74.94082 4.319954 0.000000       4.319954 
1 1 1 -21 20 4  o 30.59630 5.645542 12.08700       4.054271 27.23971       8.808799 8.014476       4.566710 45.25840 8.292454 24.75144 7.163451 20.50697       10.95809 
1 1 1 -21 20 5  o 9.858301 4.743167 -4.897248      3.351963 2.397964       7.720687 -6.591704      3.720935 21.57104 8.949319 9.835769 4.794199 11.73528       10.15257 
1 1 1 -21 20 6  o 36.09470 4.695971 16.44650       4.032689 20.78561       7.817402 14.87312       4.707386 39.40241 8.398380 33.95871 5.902566 5.443699       10.26514 
1 1 1 -21 20 7  o 146.4462 4.141201 265.5765       14.76400 254.8419       18.32104 285.4592       24.93415 142.7416 5.276080 149.7741 6.849720 -7.032532      8.646137 
1 1 1 -21 20 8  o 72.43685 2.961759 64.54642       5.217091 50.45979       9.846857 70.04394       6.151444 62.85443 6.523496 75.36285 3.357961 -12.50843      7.337023 
1 1 1 -21 20 9  o 119.5584 2.851213 175.4604       8.307030 168.7398       14.65373 178.6429       10.08386 116.1531 5.190143 120.3881 3.440749 -4.234962      6.227065 
1 1 1 -21 20 10 o 98.90640 2.798105 120.1513       6.737331 125.4134       12.68545 118.0837       7.951485 100.0747 5.219748 97.88611 3.338313 2.188553       6.195975 
1 1 1 -21 20 11 o 129.2092 2.867273 204.9990       9.028147 197.0419       15.73618 208.9031       11.02268 125.5039 5.156224 130.1528 3.478460 -4.648895      6.219833 
1 1 1 -21 20 12 o 39.76077 4.187397 19.79535       3.996437 28.67824       10.26449 18.20820       4.338805 45.85336 9.498728 37.95420 4.798133 7.899158       10.64180 
1 1 1 -21 20 13 o 99.17302 3.090139 121.1078       7.458944 162.5561       21.14247 115.2157       7.971504 111.8906 7.802900 96.62451 3.390709 15.26614       8.507771 
1 1 1 -21 20 14 o 65.06405 3.049925 52.19693       4.822320 51.09795       9.637330 52.56400       5.569745 63.15540 6.347962 65.16581 3.520423 -2.010414      7.258788 
1 1 1 -21 20 15 o 44.76059 3.643865 24.92550       3.940253 36.50338       8.676058 21.91700       4.422659 52.99593 6.880315 41.74787 4.413999 11.24806       8.174479 
1 1 1 -21 20 16 o 47.00538 3.486388 27.44535       3.965122 30.61514       8.477204 26.55765       4.486110 48.13288 7.469226 46.08567 4.035220 2.047203       8.489543 
1 1 1 -21 20 17 o 37.14052 4.746817 17.52736       4.198154 20.12315       7.571510 16.37508       5.044611 38.40667 8.330072 35.43536 6.059503 2.971310       10.30086 
1 1 1 -21 20 18 o 59.85291 3.084777 44.31145       4.484122 44.95684       9.355368 44.11896       5.109263 58.73917 6.652765 59.58374 3.534682 -0.8445740     7.533476 
1 1 1 -21 20 19 o 20.58776 6.565460 5.448852       3.712826 -0.5285308     6.779886 8.009266       4.437332 18.13863 7.966552 24.44779 7.056944 -6.309164      10.64267 
1 1 1 -21 20 20 o 40.04322 3.730593 20.11657       3.598467 18.57948       7.801085 20.53203       4.055727 36.25249 8.897694 40.30919 4.189907 -4.056698      9.834850 
1 1 1 -21 20 21 o 11.77994 5.402349 -2.165182      3.516087 -5.123830      6.711434 -1.045940      4.127915 15.42902 7.209051 13.76929 6.123533 1.659726       9.458756 
1 1 1 -21 20 22 o 24.10895 6.190046 7.851673       3.655161 6.448765       6.524515 8.493361       4.412611 23.10763 8.627449 24.90804 6.987548 -1.800409      11.10219 
1 1 1 -21 20 23 o 25.45340 5.480667 8.647940       3.298876 22.17309       10.89993 7.284148       3.461201 37.44202 11.13082 23.18544 6.059618 14.25658       12.67336 
1 1 1 -21 20 24 o 24.53336 5.453855 8.080585       3.176135 5.072220       6.366727 9.077317       3.664716 21.42814 8.389887 25.85021 5.942107 -4.422066      10.28099 
1 1 1 -21 20 25 o 19.50253 5.899786 5.114867       3.042344 1.102532       6.170706 6.403392       3.496897 17.93688 7.741652 21.60998 6.272685 -3.673103      9.963923 
1 1 1 -21 20 26 o 65.16534 3.406974 53.42510       5.391511 58.14884       8.990510 50.77229       6.737427 66.24831 5.621996 62.84685 4.427542 3.401463       7.156114 
1 1 1 -21 20 27 o 16.62198 6.732821 2.368232       4.239163 -2.289892      5.804916 7.691001       6.205250 15.16846 6.950796 23.41262 8.468090 -8.244153      10.95546 
1 1 1 -21 20 28 f 21.99952 6.618387 6.853388       3.836218 -2.909511      6.246041 12.76686       4.861122 15.31512 7.086926 29.85745 6.829700 -14.54233      9.842221 
1 1 1 -21 20 29 o 18.86913 6.787060 4.696672       3.979460 6.755578       7.818259 3.976741       4.623144 22.65359 9.155194 18.43399 7.168920 4.219597       11.62803 
1 1 1 -21 20 30 o 12.39515 5.622452 -1.209823      3.676667 -2.368449      6.293089 -0.6093963     4.530248 15.39268 7.119565 14.16623 6.349454 1.226449       9.539590 
1 1 1 -21 20 31 o 26.33437 6.369119 10.13265       4.042189 11.84855       6.558466 9.081572       5.133024 26.70326 8.743982 24.13428 7.722182 2.568985       11.66573 
1 1 1 -21 20 32 o 28.75693 6.960678 12.56896       4.824912 28.90763       11.78673 9.279997       5.288287 37.04538 11.68397 24.06178 7.850034 12.98360       14.07615 
1 1 1 -21 20 33 o 39.56554 4.793978 21.31604       4.528037 27.31171       7.454552 17.81049       5.700078 41.83966 7.590813 34.10276 7.090422 7.736904       10.38723 
1 1 1 -21 20 34 o 33.34047 5.483851 15.79433       4.300699 15.20857       7.242442 16.11340       5.345148 28.75261 9.169758 32.27826 6.997543 -3.525646      11.53473 
1 1 1 -21 21 1  o 43.07410 3.849020 23.18323       3.997668 31.26397       8.305149 20.74634       4.560791 48.72477 7.212103 40.47465 4.712043 8.250122       8.614974 
1 1 1 -21 21 2  o 59.27798 3.380242 43.51754       4.862654 57.52197       10.06272 39.25098       5.554203 66.96208 6.238437 56.07403 4.092842 10.88805       7.461195 
1 1 1 -21 21 3  o 44.16927 4.330547 24.48832       4.601371 0.000000       0.000000 24.48832       4.601371 ?        ?        44.16927 4.330547 0.000000       4.330547 
1 1 1 -21 21 4  o 27.29889 5.525245 9.693466       3.549339 -0.7213343     8.077957 12.18520       3.951179 19.82411 8.701662 30.70217 5.482240 -10.87806      10.28464 
1 1 1 -21 21 5  o 16.95501 6.465560 2.691034       3.708537 -5.292267      7.903020 4.945371       4.199632 17.26130 7.981949 20.33604 7.000158 -3.074741      10.61667 
1 1 1 -21 21 6  o 114.6903 3.091246 162.0166       8.631774 150.1627       17.97121 165.5713       9.841287 108.1580 6.853649 115.7709 3.492312 -7.612900      7.692122 
1 1 1 -21 21 7  o 99.61015 3.434398 122.5462       8.324156 144.5604       13.17229 107.9095       10.74066 107.3747 5.048248 92.88632 4.760959 14.48838       6.939131 
1 1 1 -21 21 8  o 62.49268 3.074529 48.17384       4.667761 42.72385       9.175469 50.07676       5.421760 57.54643 6.666106 63.60063 3.511817 -6.054195      7.534575 
1 1 1 -21 21 9  o 33.24626 4.364333 13.96060       3.450572 5.945389       7.614548 16.03185       3.870821 24.09987 9.246098 35.60834 4.565752 -11.50846      10.31195 
1 1 1 -21 21 10 o 34.62501 4.204223 15.09213       3.474811 7.432959       7.154688 17.45641       3.975106 25.10211 9.090981 37.19899 4.474876 -12.09688      10.13264 
1 1 1 -21 21 11 o 43.66416 4.222295 23.89603       4.436736 0.000000       0.000000 23.89603       4.436736 ?        ?        43.66416 4.222295 0.000000       4.222295 
1 1 1 -21 21 12 o 57.96396 3.163216 41.52302       4.451168 44.74483       9.038009 40.49133       5.114429 58.94545 6.394266 57.09038 3.696055 1.855076       7.385625 
1 1 1 -21 21 13 o 91.33135 3.132155 102.9264       6.960750 106.4373       18.02654 102.3111       7.546014 89.56001 8.356099 90.95195 3.410669 -1.391937      9.025356 
1 1 1 -21 21 14 o 66.85205 3.043831 55.18169       4.945730 47.87444       9.460452 57.92981       5.801661 60.85024 6.479429 68.35818 3.494372 -7.507938      7.361632 
1 1 1 -21 21 15 o 42.30924 3.722911 22.36017       3.799327 24.65473       8.102200 21.71339       4.301590 42.67302 8.087288 41.51429 4.314896 1.158737       9.166382 
1 1 1 -21 21 16 o 39.02281 3.948715 19.12701       3.703384 21.36147       8.028026 18.52296       4.174047 39.30454 8.619496 38.20195 4.574542 1.102592       9.758183 
1 1 1 -21 21 17 o 13.46644 5.832808 -0.1795561     3.527622 -6.947597      6.849193 2.263985       4.115454 14.91286 7.064319 16.86259 6.700767 -1.949727      9.736779 
1 1 1 -21 21 18 o 99.66954 2.816700 122.6157       6.834448 124.4398       12.81637 121.8909       8.079002 98.78119 5.344105 99.11118 3.349836 -0.3299942     6.307207 
1 1 1 -21 21 19 o 17.44347 6.164518 3.567822       3.268828 -2.887508      6.805130 5.504035       3.726953 16.68158 7.598968 20.58438 6.579409 -3.902794      10.05151 
1 1 1 -21 21 20 o 37.77643 6.073601 18.89281       5.401691 15.06522       7.658570 22.68180       7.619868 32.22190 9.261884 40.37035 8.028191 -8.148449      12.25701 
1 1 1 -21 21 21 o 36.22540 4.116683 16.70214       3.569718 15.28190       7.111485 17.18054       4.127378 32.47064 8.778846 36.49571 4.753700 -4.025074      9.983275 
1 1 1 -21 21 22 o 32.12237 4.502128 13.32472       3.427581 12.22426       6.913058 13.68342       3.946873 28.93496 8.920941 32.27193 5.195021 -3.336971      10.32334 
1 1 1 -21 21 23 o 29.92575 5.197973 11.85590       3.653197 -5.579455      9.227436 15.09672       3.978256 17.92595 8.400707 33.96434 4.952220 -16.03839      9.751737 
1 1 1 -21 21 24 o 21.37090 5.872276 6.239675       3.152036 13.50302       6.526381 4.030014       3.599704 30.13020 8.513922 18.08710 6.461115 12.04309       10.68798 
1 1 1 -21 21 25 o 61.73903 3.134270 47.75480       4.700121 33.16162       8.263565 54.73343       5.714487 48.66423 7.183946 65.83868 3.575135 -17.17446      8.024380 
1 1 1 -21 21 26 o 13.16410 5.597733 0.5411874      3.138994 -3.867730      5.915651 2.269090       3.703362 14.47255 6.764126 15.86915 6.339759 -1.396604      9.270703 
1 1 1 -21 21 27 o 34.42521 5.871890 16.26092       4.749382 11.94721       9.267612 17.79731       5.530869 27.26880 10.26124 35.52566 6.632606 -8.256865      12.21821 
1 1 1 -21 21 28 o 35.19838 5.574232 16.93720       4.622178 8.173219       8.694304 20.39010       5.457279 23.96280 9.665116 38.33306 6.041900 -14.37025      11.39820 
1 1 1 -21 21 29 o 10.03249 4.856668 -5.076872      3.647736 -10.39910      6.213335 -2.277714      4.506005 12.11785 5.965432 13.03503 6.027451 -0.9171782     8.480363 
1 1 1 -21 21 30 o 15.20749 6.272286 1.927026       3.762170 0.7390729      6.307541 2.583032       4.687210 16.99636 7.563438 16.81429 6.974171 0.1820641      10.28808 
1 1 1 -21 21 31 o 13.57883 5.853540 0.6937497      3.519417 2.356494       5.807702 -0.2712104     4.424317 17.46316 7.523643 14.05725 6.289610 3.405918       9.806344 
1 1 1 -21 21 32 o 20.63494 7.102010 6.464692       4.322678 3.981882       10.32135 6.992813       4.760270 20.81675 9.433684 21.25733 7.445069 -0.4405842     12.01763 
1 1 1 -21 21 33 o 18.00349 6.594716 4.585528       3.780194 2.004918       6.580482 5.856570       4.618238 17.51698 7.764094 19.73911 7.279232 -2.222130      10.64276 
1 1 1 -21 22 1  o 72.25590 3.352708 64.75520       5.887347 91.53367       11.32067 54.82796       6.892767 84.71828 5.513464 66.09341 4.302956 18.62487       6.993834 
1 1 1 -21 22 2  o 68.11176 3.171441 57.41668       5.249534 57.06103       10.47168 57.53606       6.066939 66.25053 6.572777 68.00301 3.674698 -1.752480      7.530260 
1 1 1 -21 22 3  o 89.35423 3.567275 99.06179       7.752005 0.000000       0.000000 99.06179       7.752005 ?        ?        89.35423 3.567275 0.000000       3.567275 
1 1 1 -21 22 4  o 16.61300 6.226975 2.778887       3.405713 -2.153819      6.695970 4.500271       3.955577 17.12679 7.694456 19.46210 6.788738 -2.335300      10.26117 
1 1 1 -21 22 5  f 16.37240 6.017974 2.826746       3.152217 -3.447560      7.480971 4.181223       3.475849 17.48590 7.966137 18.64188 6.369985 -1.155983      10.19981 
1 1 1 -21 22 6  o 92.85377 3.470200 106.7754       7.838362 0.000000       0.000000 106.7754       7.838362 ?        ?        92.85377 3.470200 0.000000       3.470200 
1 1 1 -21 22 7  o 35.00487 6.235353 16.05134       5.123910 25.23075       9.323074 12.07871       6.133249 42.63662 9.240315 29.75846 8.197036 12.87815       12.35212 
1 1 1 -21 22 8  o 35.03733 4.265872 15.50431       3.567311 8.635066       7.332420 17.63440       4.083116 26.19086 9.234714 37.30030 4.588627 -11.10944      10.31191 
1 1 1 -21 22 9  o 81.31152 2.859195 81.48009       5.656601 80.71496       10.43812 81.79823       6.730592 79.78397 5.400541 81.27850 3.405689 -1.494530      6.384713 
1 1 1 -21 22 10 o 26.65165 5.597969 9.305004       3.519872 15.51844       8.929426 8.161918       3.829987 33.18895 10.12140 24.79559 6.320561 8.393356       11.93282 
1 1 1 -21 22 11 o 35.65917 4.261421 16.06556       3.629849 13.39340       7.122682 17.00301       4.218790 31.09808 8.929820 36.50999 4.862555 -5.411917      10.16790 
1 1 1 -21 22 12 o 46.08893 3.674369 26.50664       4.092675 15.08234       8.208923 30.28568       4.721304 32.71730 9.642636 49.18915 3.972499 -16.47186      10.42886 
1 1 1 -21 22 13 o 58.85342 3.509209 43.06783       5.010033 38.28876       13.52195 43.82829       5.393930 51.11821 11.16800 59.28779 3.752651 -8.169579      11.78162 
1 1 1 -21 22 14 o 18.78123 6.103373 4.443390       3.198406 0.5887440      6.813560 5.532835       3.622301 18.89702 8.145341 20.66833 6.471416 -1.771309      10.40316 
1 1 1 -21 22 15 o 68.40151 2.974780 57.87613       4.946716 57.70589       9.385948 57.94160       5.820734 66.91523 5.813589 68.23976 3.512106 -1.324532      6.792106 
1 1 1 -21 22 16 o 33.20385 4.506182 14.09191       3.552127 12.88557       7.294968 14.46682       4.066815 30.17873 9.137073 33.41775 5.159895 -3.239017      10.49336 
1 1 1 -21 22 17 o 44.63727 4.251770 25.21784       4.569115 23.78008       7.843068 25.95647       5.621572 41.45263 8.054513 44.87063 5.239655 -3.418003      9.608807 
1 1 1 -21 22 18 o 16.71634 6.390160 2.775422       3.628276 1.363715       6.274397 3.484645       4.447246 18.59632 7.911126 18.45002 7.069253 0.1463051      10.60944 
1 1 1 -21 22 19 o 38.94690 4.582594 19.45729       4.266171 23.95389       7.169549 16.99242       5.308191 41.80973 7.302452 35.56327 6.358450 6.246460       9.682752 
1 1 1 -21 22 20 o 9.690366 4.586526 -3.108553      2.875579 -6.684874      6.097061 -2.085470      3.261052 13.71133 6.543226 11.24424 5.173567 2.467085       8.341439 
1 1 1 -21 22 21 o 56.17941 3.193565 39.44840       4.354081 35.97989       8.106254 40.85485       5.161910 51.59864 6.597560 56.91084 3.742800 -5.312206      7.585272 
1 1 1 -21 22 22 o 55.09241 4.307108 38.82806       5.736543 24.12023       11.92837 43.25312       6.542839 37.65474 11.73651 57.92269 4.675026 -20.26794      12.63335 
1 1 1 -21 22 23 o 26.63471 5.435009 9.567251       3.408068 4.841229       6.498770 11.36000       4.002610 21.06559 8.404104 28.86379 5.890179 -7.798201      10.26271 
1 1 1 -21 22 24 o 23.82465 5.915199 7.837458       3.418374 0.2531587E-01  6.345632 11.03135       4.057420 17.25940 7.638392 28.27849 6.069470 -11.01909      9.756204 
1 1 1 -21 22 25 o 18.87912 6.282708 4.773712       3.381426 3.057598       6.436671 5.427855       3.973969 19.33474 8.107581 20.02171 6.811767 -0.6869698     10.58929 
1 1 1 -21 22 26 o 25.38811 7.809932 9.629746       5.301974 22.92538       8.565046 1.369856       6.750910 37.93771 9.330334 18.30687 7.997255 19.63084       12.28866 
1 1 1 -21 22 27 o 17.09736 6.198910 3.684516       3.327813 4.077145       6.279932 3.531216       3.924064 19.68391 8.109640 17.35672 6.642908 2.327194       10.48306 
1 1 1 -21 22 28 o 32.42736 4.904064 14.17140       3.754372 15.27578       7.020162 13.72900       4.443151 30.50231 8.897381 31.14922 6.071652 -0.6469097     10.77165 
1 1 1 -21 22 29 o 16.57744 6.525280 3.096971       3.868848 -0.4205161     6.505857 5.021428       4.812186 16.49240 7.480240 19.32124 7.365740 -2.828831      10.49800 
1 1 1 -21 22 30 o 29.48904 5.888308 12.46017       4.083188 7.394086       6.954897 15.12481       5.043975 22.00978 8.722186 31.88546 6.704530 -9.875685      11.00124 
1 1 1 -21 22 31 o 12.71249 5.710868 -0.5491078     3.687888 5.751638       6.468038 -3.584116      4.489071 20.32467 8.285423 12.06115 5.715113 8.263518       10.06532 
1 1 1 -21 22 32 f 26.60086 6.478037 10.70978       4.159613 10.61031       6.837750 10.76821       5.240894 24.43336 8.881815 25.57259 7.745025 -1.139236      11.78440 
1 1 1 -21 23 1  o 24.56672 5.456821 7.993560       3.181837 7.443755       5.978055 8.210882       3.758436 23.96564 8.346614 24.70225 6.242050 -0.7366161     10.42253 
1 1 1 -21 23 2  o 48.85841 3.514448 29.81013       4.156436 30.16669       7.949387 29.67598       4.876060 47.47538 7.087905 48.51213 4.164876 -1.036747      8.220984 
1 1 1 -21 23 3  o 66.36114 4.370582 55.48160       7.028533 0.000000       0.000000 55.48160       7.028533 ?        ?        66.36114 4.370582 0.000000       4.370582 
1 1 1 -21 23 4  o 43.84331 3.770654 24.09431       3.989523 20.05824       8.289480 25.31098       4.551292 37.58180 9.140465 44.78996 4.219542 -7.208164      10.06740 
1 1 1 -21 23 5  o 57.21001 3.400958 40.70758       4.720033 37.81799       10.18630 41.49765       5.326362 52.67742 8.202085 57.61440 3.815193 -4.936981      9.045988 
1 1 1 -21 23 6  o 13.13330 5.551064 0.3908702      3.055683 -5.572489      6.770094 1.916505       3.424322 15.38304 7.204727 15.49341 6.126427 -0.1103764     9.457336 
1 1 1 -21 23 7  f 13.83895 6.119524 -0.8786836     4.064711 -0.6832938     6.478763 -1.005516      5.219833 17.62544 7.762720 15.64068 6.924599 1.984756       10.40240 
1 1 1 -21 23 8  o 64.44514 3.046098 51.40805       4.770229 50.05921       8.919868 51.94833       5.645329 62.24768 5.952725 64.58419 3.601224 -2.336514      6.957281 
1 1 1 -21 23 9  o 42.66095 3.999908 22.88730       4.109810 27.94155       9.497845 21.72294       4.558689 44.65560 9.038523 41.34534 4.602497 3.310253       10.14287 
1 1 1 -21 23 10 o 12.62378 5.435362 -0.3921521E-01 3.027558 3.559545       6.266433 -1.135041      3.457918 20.51228 8.229073 12.48438 5.574929 8.027900       9.939692 
1 1 1 -21 23 11 o 35.33606 4.280019 15.84965       3.610501 13.56539       7.242987 16.60492       4.164843 30.98463 9.037315 35.97267 4.876517 -4.988035      10.26906 
1 1 1 -21 23 12 o 27.83307 5.676012 10.23434       3.719185 5.936194       11.78778 10.70951       3.919380 26.35707 11.00629 28.42620 5.853067 -2.069130      12.46583 
1 1 1 -21 23 13 o 27.77113 5.210296 10.09067       3.396594 11.98589       7.068161 9.521605       3.873110 29.17460 9.024909 26.67747 6.091909 2.497128       10.88854 
1 1 1 -21 23 14 o 7.874545 3.916151 -7.108601      2.937635 -16.29749      6.530678 -4.777702      3.289187 11.41857 5.703926 9.692329 4.672206 1.726240       7.373213 
1 1 1 -21 23 15 o 41.66996 4.525697 22.14923       4.521907 11.77799       7.575086 27.89099       5.636304 28.78993 9.395414 46.57125 5.046956 -17.78132      10.66516 
1 1 1 -21 23 16 f 71.32963 4.358661 64.40188       7.540163 53.32644       9.524711 82.99523       12.34099 63.66188 6.218754 79.31892 6.440005 -15.65703      8.952461 
1 1 1 -21 23 17 o 92.39515 2.873085 105.8123       6.461088 81.96154       10.89963 118.7336       8.022568 79.36446 5.673137 97.56443 3.379418 -18.19997      6.603405 
1 1 1 -21 23 18 o 29.69479 5.017346 11.56816       3.501485 6.796798       6.801244 13.28888       4.084354 23.35604 8.790096 31.66694 5.491723 -8.310898      10.36459 
1 1 1 -21 23 19 o 21.36388 5.883558 6.189045       3.160136 2.157068       6.492462 7.440853       3.617589 19.14107 8.090967 23.29814 6.245036 -4.157068      10.22077 
1 1 1 -21 23 20 o 34.12662 4.397214 15.04955       3.571950 13.25332       6.743945 15.74994       4.211140 29.83480 8.725624 34.57053 5.156140 -4.735731      10.13520 
1 1 1 -21 23 21 o 21.88596 6.061529 6.584284       3.343628 -1.213684      6.526098 9.359827       3.893470 16.81893 7.572777 26.01486 6.224931 -9.195927      9.802894 
1 1 1 -21 23 22 o 17.62788 6.442608 3.732284       3.604738 6.811182       10.38503 3.310506       3.843723 24.56832 10.29996 17.30458 6.586307 7.263744       12.22574 
1 1 1 -21 23 23 f 29.21725 5.203996 11.44966       3.569347 12.35845       6.677698 11.08615       4.223292 28.40556 8.769526 28.17605 6.308241 0.2295113      10.80271 
1 1 1 -21 23 24 o 18.70712 7.589387 3.447777       5.396178 -9.386764      8.539059 11.98095       6.962659 15.45961 7.471003 27.69638 9.005482 -12.23676      11.70105 
1 1 1 -21 23 25 o 14.72554 6.342318 0.6765710      4.124738 5.543787       7.721316 -1.267044      4.879284 21.80117 8.988154 14.34585 6.495217 7.455317       11.08940 
1 1 1 -21 23 26 o 26.67314 7.537857 10.76640       5.115468 2.021868       6.605002 23.87366       8.086500 18.37554 7.970112 38.91447 8.741394 -20.53893      11.82940 
1 1 1 -21 23 27 o 9.720924 4.658412 -3.776575      3.160759 -6.239851      6.066665 -2.858804      3.703057 13.32641 6.403878 11.31190 5.307715 2.014510       8.317541 
1 1 1 -21 23 28 o 32.41349 4.962409 14.30890       3.795159 -0.9138216     6.635143 21.71074       4.626727 16.32288 7.461495 40.13464 4.827427 -23.81175      8.886955 
1 1 1 -21 23 29 o 18.48904 6.396779 4.840847       3.508508 6.636979       6.518359 4.108237       4.162992 21.25507 8.437308 17.81939 6.836574 3.435682       10.85942 
1 1 1 -21 23 30 o 25.43621 5.974130 9.458881       3.639602 17.35373       7.008303 6.543299       4.258960 31.79860 8.763591 20.74536 7.051884 11.05324       11.24854 
1 1 1 -21 23 31 o 17.92261 6.903727 4.346797       4.256991 3.116961       10.36755 4.596194       4.668714 20.20783 9.270847 18.38243 7.188276 1.825405       11.73115 
1 1 1 -21 24 1  o 57.75389 3.202235 41.58393       4.489181 46.86746       8.686378 39.65849       5.243745 59.65358 6.059377 56.11061 3.858446 3.542965       7.183568 
1 1 1 -21 24 2  o 58.67575 3.662614 43.17493       5.210923 48.75429       9.232170 40.56641       6.312595 60.72559 6.331626 56.39088 4.634568 4.334702       7.846573 
1 1 1 -21 24 3  o 25.72473 6.043403 8.915379       3.723747 0.000000       0.000000 8.915379       3.723747 ?        ?        25.72473 6.043403 0.000000       6.043403 
1 1 1 -21 24 4  o 14.74434 5.803557 1.816941       3.060278 4.856993       6.662457 1.004018       3.445232 21.76582 8.564381 14.40673 5.977717 7.359089       10.44422 
1 1 1 -21 24 5  o 87.15898 3.067041 94.21343       6.504149 102.5969       13.56400 91.71021       7.411855 88.49577 6.331522 85.73410 3.555336 2.761673       7.261445 
1 1 1 -21 24 6  o 24.23588 5.701477 7.839903       3.310627 10.30585       7.389448 7.220628       3.703066 27.30399 9.288680 23.14675 6.366745 4.157232       11.26122 
1 1 1 -21 24 7  o 26.19427 5.584895 9.107926       3.456038 0.6113361      7.704292 11.24842       3.866940 19.70948 8.577684 29.15783 5.646256 -9.448347      10.26922 
1 1 1 -21 24 8  o 16.21360 6.078006 2.731187       3.244917 8.658418       7.311642 1.277429       3.621054 25.67353 9.204029 14.99558 6.165957 10.67795       11.07850 
1 1 1 -21 24 9  f 59.07876 3.131068 43.37463       4.491656 45.78358       8.530589 42.45060       5.283348 59.21285 5.994380 58.20077 3.745032 1.012085       7.068088 
1 1 1 -21 24 10 o 23.19438 5.884379 7.214943       3.330679 5.617612       6.197791 7.863566       3.949442 22.13202 8.377399 24.08020 6.555662 -1.948175      10.63755 
1 1 1 -21 24 11 o 49.90156 3.748144 31.27613       4.524609 30.79276       7.451252 31.55847       5.694715 48.11275 6.523127 49.67999 4.762097 -1.567234      8.076432 
1 1 1 -21 24 12 o 27.99055 6.340597 10.61242       4.224290 14.79557       11.13496 9.909157       4.565594 31.50838 11.35056 26.84307 6.931664 4.665304       13.29975 
1 1 1 -21 24 13 o 29.35908 5.591443 11.44301       3.854339 13.32398       6.863401 10.57655       4.658243 30.36053 8.780478 27.69816 6.921398 2.662367       11.18045 
1 1 1 -21 24 14 o 42.99168 4.362571 23.58889       4.507279 22.67633       7.610914 24.08182       5.593673 40.09158 8.069799 42.90402 5.474660 -2.812439      9.751594 
1 1 1 -21 24 15 o 21.56831 6.074450 6.292123       3.327881 0.9348423      6.903626 7.913835       3.798324 18.81728 8.155057 24.04787 6.378019 -5.230589      10.35297 
1 1 1 -21 24 16 o 15.59384 6.528729 1.205801       4.163926 17.38915       11.61370 -1.181404      4.460476 32.82734 11.61783 14.08365 6.307316 18.74368       13.21954 
1 1 1 -21 24 17 o 88.72900 2.863662 97.83559       6.183783 88.65639       10.84057 102.2631       7.528836 82.40345 5.428710 90.33847 3.426153 -7.935020      6.419456 
1 1 1 -21 24 18 o 54.45233 3.397428 37.26623       4.485735 23.83620       7.909323 43.63439       5.446380 40.51258 8.291052 58.70052 3.828299 -18.18794      9.132218 
1 1 1 -21 24 19 o 43.91986 3.717426 24.47597       3.941350 16.75783       7.033785 28.00855       4.758595 33.49937 8.579447 46.74021 4.223363 -13.24084      9.562620 
1 1 1 -21 24 20 o 29.62779 5.165112 11.70570       3.593689 5.666984       6.441429 14.43469       4.330234 21.68428 8.453797 32.72479 5.633165 -11.04051      10.15870 
1 1 1 -21 24 21 o 32.09306 4.866765 13.60964       3.686915 10.63375       6.933145 14.78301       4.353518 26.51319 8.997625 33.07923 5.600310 -6.566034      10.59815 
1 1 1 -21 24 22 o 25.43013 6.361732 9.123709       3.932187 3.049255       10.46222 10.12294       4.243297 22.19797 9.816739 26.70362 6.567146 -4.505651      11.81083 
1 1 1 -21 24 23 o 16.74230 6.673291 2.755686       4.093916 -4.325536      7.821070 5.428171       4.804738 16.45188 7.717623 20.25063 7.432087 -3.798750      10.71437 
1 1 1 -21 24 24 o 10.09362 4.774537 -3.038653      3.107382 -9.690816      5.949469 -0.5432678     3.643893 12.04538 5.911263 12.91827 5.748700 -0.8728933     8.245641 
1 1 1 -21 24 25 o 36.12506 5.020291 17.57865       4.300240 13.94073       6.756151 20.05614       5.575439 29.30149 8.775865 37.65961 6.297477 -8.358130      10.80157 
1 1 1 -21 24 26 o 21.87178 6.883298 7.076504       4.092884 12.43580       6.714058 3.907168       5.163156 27.38143 8.838498 18.48389 7.450654 8.897543       11.55990 
1 1 1 -21 24 27 o 23.90477 6.179856 8.352948       3.626175 12.38049       6.614539 6.622437       4.335773 27.07941 8.775390 21.06223 7.115568 6.017183       11.29773 
1 1 1 -21 24 28 o 27.43665 5.641464 10.71717       3.645833 11.00108       6.704337 10.59796       4.344346 25.33319 8.838067 26.49605 6.719558 -1.162865      11.10243 
1 1 1 -21 24 29 o 18.21027 6.360608 4.726117       3.473060 0.9344909      6.429955 6.287994       4.126849 16.88818 7.567352 20.39823 6.941527 -3.510044      10.26887 
1 1 1 -21 24 30 o 13.11810 5.709763 0.4997916      3.414588 -0.2367863     6.497952 0.7807782      4.013377 16.17402 7.389842 14.18100 6.181032 1.993019       9.634050 
1 1 1 -21 25 1  o 56.30584 3.676452 40.00454       5.016914 48.53688       8.474161 35.40022       6.225079 60.54878 5.814607 52.22879 4.950095 8.319988       7.636301 
1 1 1 -21 25 2  o 60.11549 3.152471 45.13847       4.602069 49.24247       8.895242 43.63849       5.377718 60.84929 6.080153 58.79575 3.773241 2.053535       7.155808 
1 1 1 -21 25 3  o 19.68602 6.264623 5.136372       3.381818 0.000000       0.000000 5.136372       3.381818 ?        ?        19.68602 6.264623 0.000000       6.264623 
1 1 1 -21 25 4  o 66.89902 3.410433 56.03075       5.541534 46.10021       10.09213 60.31726       6.630533 57.97094 7.305825 69.10267 3.953977 -11.13173      8.307166 
1 1 1 -21 25 5  f 14.68360 5.845997 1.736850       3.138238 6.827796       6.547125 0.2182554      3.575792 23.23749 8.648971 13.76175 5.915950 9.475738       10.47870 
1 1 1 -21 25 6  o 57.44314 5.001580 42.57319       6.931609 36.34113       9.762693 48.90866       9.843356 50.80796 8.161294 60.21576 6.828469 -9.407803      10.64118 
1 1 1 -21 25 7  o 35.74599 4.821066 16.56663       4.092620 12.29009       8.132440 18.01700       4.736044 28.91327 9.745113 37.02777 5.408257 -8.114502      11.14524 
1 1 1 -21 25 8  o 61.31691 3.724663 47.29170       5.539238 35.85575       10.33126 51.90554       6.562188 49.93982 8.811244 63.96040 4.234018 -14.02058      9.775732 
1 1 1 -21 25 9  o 33.76763 5.168012 14.94334       4.117585 14.24169       7.938544 15.20158       4.816075 30.86424 9.567285 33.62431 6.102326 -2.760065      11.34775 
1 1 1 -21 25 10 o 56.56797 3.555944 40.17750       4.877068 46.91608       8.287660 36.60770       6.032119 59.76827 5.761486 53.41091 4.681807 6.357357       7.423883 
1 1 1 -21 25 11 o 24.74644 5.612472 8.244411       3.306431 4.749595       5.877193 9.862741       3.999369 20.80450 8.085152 26.87391 6.228756 -6.069418      10.20623 
1 1 1 -21 25 12 o 10.98534 5.131350 -2.835479      3.396441 19.39446       10.98152 -5.186893      3.571559 34.55957 11.31449 10.01642 4.838373 24.54315       12.30559 
1 1 1 -21 25 13 o 120.3851 3.241838 180.9287       9.501770 169.0459       14.32778 190.2574       12.69496 114.2822 5.158043 122.3881 4.263044 -8.105881      6.691708 
1 1 1 -21 25 14 o 58.02507 3.290828 42.19234       4.634181 50.48853       8.669538 38.87363       5.483293 61.74120 5.831233 55.26775 4.100516 6.473457       7.128640 
1 1 1 -21 25 15 o 43.78646 3.800290 24.33952       4.014901 22.00795       7.345324 25.33290       4.794492 39.11061 7.977510 44.32713 4.500841 -5.216518      9.159597 
1 1 1 -21 25 16 o 53.27320 3.476279 35.76229       4.488289 36.30976       8.553622 35.55429       5.272447 51.20619 7.040961 52.76059 4.133764 -1.554398      8.164749 
1 1 1 -21 25 17 o 33.39006 4.676779 14.57632       3.701187 18.17042       7.409043 13.38116       4.272481 34.71630 8.759377 31.42021 5.793401 3.296091       10.50191 
1 1 1 -21 25 18 o 64.23849 3.545378 52.11366       5.528490 38.90413       12.77982 55.15479       6.131946 48.59299 11.04379 65.89603 3.835163 -17.30305      11.69076 
1 1 1 -21 25 19 o 38.89613 4.259952 19.56379       3.971852 6.708892       6.852201 26.06838       4.874227 22.68307 8.753202 44.79581 4.527175 -22.11274      9.854637 
1 1 1 -21 25 20 o 12.82978 5.623505 -0.1840946     3.362906 -4.889379      6.774609 1.354458       3.873892 15.08027 7.107965 15.08926 6.305921 -0.8988380E-02 9.501989 
1 1 1 -21 25 21 o 22.08291 7.502004 6.946954       4.819926 0.000000       0.000000 6.946954       4.819926 ?        ?        22.08291 7.502004 0.000000       7.502004 
1 1 1 -21 25 22 o 18.59931 6.954719 4.353843       4.242999 9.565067       8.003296 2.316525       5.004128 24.95163 9.502193 17.18041 7.172480 7.771214       11.90530 
1 1 1 -21 25 23 o 29.65299 5.226038 11.99145       3.638463 13.35298       6.730784 11.42933       4.324817 28.74516 8.791565 28.19248 6.436983 0.5526829      10.89616 
1 1 1 -21 25 24 o 24.88796 5.971024 8.836715       3.574935 5.124757       6.742122 10.28852       4.216480 20.55424 8.428430 26.53191 6.559124 -5.977663      10.67991 
1 1 1 -21 25 25 o 57.16995 3.944829 42.48542       5.462120 28.33187       7.781461 56.23273       7.668975 43.09495 7.691889 64.73933 4.897407 -21.64439      9.118649 
1 1 1 -21 25 26 o 13.84591 5.826019 1.203492       3.341609 -7.232305      5.976745 5.039640       4.030411 12.69273 6.161446 18.93064 6.827644 -6.237917      9.196746 
1 1 1 -21 25 27 o 22.05058 6.271738 7.215372       3.529833 1.193045       6.158204 10.16217       4.307716 16.90045 7.499763 25.86846 6.759790 -8.968014      10.09659 
1 1 1 -21 25 28 o 10.63701 5.119290 -4.500486      3.911142 3.958189       6.147523 -10.25254      5.069448 18.68341 7.884058 10.35472 5.148736 8.328692       9.416362 
1 1 1 -21 25 29 o 32.43773 5.097592 14.66283       3.896742 5.767038       6.828426 18.95886       4.745278 20.24254 8.408805 36.60398 5.488848 -16.36143      10.04169 
1 1 1 -21 26 1  o 11.12320 4.899594 -0.4102882     2.581762 1.198017       4.754795 -1.082711      3.074459 16.18661 6.886434 11.53901 5.196402 4.647597       8.627026 
1 1 1 -21 26 2  o 21.09588 5.539783 6.071759       2.883847 9.044522       5.629666 5.014153       3.357874 24.95854 8.096365 19.32840 6.251526 5.630133       10.22901 
1 1 1 -21 26 3  o 19.23403 6.277005 4.934051       3.381114 0.000000       0.000000 4.934051       3.381114 ?        ?        19.23403 6.277005 0.000000       6.277005 
1 1 1 -21 26 4  o 18.82622 5.914461 4.735266       3.023091 6.768581       6.321897 4.132468       3.442159 22.72784 8.491071 18.09572 6.331436 4.632118       10.59176 
1 1 1 -21 26 5  o 33.42879 4.468910 14.50405       3.549363 5.724931       7.503953 17.03427       4.028502 22.47580 9.009067 36.16519 4.680738 -13.68939      10.15247 
1 1 1 -21 26 6  o 33.27443 6.351245 15.19127       4.962171 8.706168       7.847724 19.51128       6.405131 25.12133 9.444799 37.17760 7.330496 -12.05626      11.95577 
1 1 1 -21 26 7  o 51.43670 3.587265 33.39964       4.468299 22.49191       8.981130 36.98775       5.151062 38.15453 9.653453 53.94774 3.945490 -15.79321      10.42862 
1 1 1 -21 26 8  o 105.9944 3.094622 140.2193       7.984749 132.7481       16.32289 142.5694       9.154874 98.72404 6.826856 106.4981 3.532447 -7.774078      7.686621 
1 1 1 -21 26 9  o 30.63029 5.138107 12.43571       3.699539 6.181633       7.612640 14.36942       4.233010 22.92978 9.112892 32.79807 5.490079 -9.868294      10.63888 
1 1 1 -21 26 10 o 27.79449 5.381166 10.36332       3.513051 13.70984       7.685067 9.479280       3.949904 29.89064 9.435397 26.17579 6.274033 3.714857       11.33094 
1 1 1 -21 26 11 o 36.91024 4.212491 17.52774       3.721221 10.58350       6.709176 20.61321       4.472158 26.75308 8.847996 39.81581 4.699657 -13.06273      10.01867 
1 1 1 -21 26 12 o 39.96655 4.035856 20.44493       3.876895 11.98961       6.893416 24.35661       4.688687 28.20943 8.940213 43.41273 4.497033 -15.20330      10.00753 
1 1 1 -21 26 13 o 42.33133 3.986512 22.90389       4.063942 22.55259       7.633848 23.04283       4.800769 39.22820 8.247767 42.04815 4.769338 -2.819950      9.527447 
1 1 1 -21 26 14 o 50.40363 3.490987 32.08557       4.261422 32.99865       7.686738 31.68042       5.120305 49.01555 6.603155 49.65314 4.273209 -0.6375885     7.865238 
1 1 1 -21 26 15 o 68.94159 3.652220 60.14756       6.113954 54.49016       9.161426 64.69042       8.209551 63.67419 5.974005 70.56513 4.802742 -6.890938      7.665185 
1 1 1 -21 26 16 o 35.12659 4.516243 16.10077       3.776541 18.89342       7.146589 15.01879       4.448376 35.48390 8.396515 33.28933 5.687652 2.194569       10.14154 
1 1 1 -21 26 17 o 60.73190 3.249541 46.43644       4.791715 47.08632       8.878255 46.16934       5.691895 58.64682 6.311455 60.13013 3.905573 -1.483315      7.422127 
1 1 1 -21 26 18 o 14.27441 6.186301 0.3392057      3.972743 6.236207       8.175121 -1.483922      4.545557 22.72908 9.296117 13.77197 6.248816 8.957103       11.20114 
1 1 1 -21 26 19 o 60.56869 4.237339 47.42319       6.214831 40.25391       11.91835 50.10062       7.283449 49.56441 10.20763 61.68973 4.884782 -12.12532      11.31622 
1 1 1 -21 26 20 o 17.46642 6.782352 3.453549       4.133142 0.000000       0.000000 3.453549       4.133142 ?        ?        17.46642 6.782352 0.000000       6.782352 
1 1 1 -21 26 21 o 54.64009 3.855561 38.44095       5.100791 34.02926       12.31240 39.35500       5.604346 42.79371 11.54327 55.00599 4.213052 -12.21228      12.28808 
1 1 1 -21 26 22 o 17.41934 6.201560 3.989989       3.313558 5.937624       6.004765 3.137258       3.973271 20.92989 8.161501 16.82661 6.615978 4.103279       10.50625 
1 1 1 -21 26 23 o 43.49405 3.920771 24.61233       4.111069 16.73723       7.321483 28.23861       4.968230 31.52582 9.053876 46.18182 4.470470 -14.65600      10.09741 
1 1 1 -21 26 24 o 28.51659 5.800166 11.57302       3.893251 6.458825       6.738740 14.13533       4.769857 21.30344 8.537977 31.03542 6.514749 -9.731979      10.73960 
1 1 1 -21 26 25 o 38.65297 4.556530 20.05171       4.209558 17.82593       7.345361 21.14023       5.136789 32.18633 9.010344 38.84765 5.586597 -6.661327      10.60172 
1 1 1 -21 26 26 o 12.37089 5.521266 -0.3754902     3.386859 -2.047800      6.181273 0.3419623      4.048705 15.04713 6.992927 13.94881 6.140261 1.098321       9.306118 
1 1 1 -21 26 27 o 31.81727 5.049368 14.05033       3.784422 7.014832       6.463604 17.72021       4.668239 21.24901 8.412362 35.31665 5.611737 -14.06764      10.11234 
1 1 1 -21 27 1  o 15.76365 5.692301 2.990918       2.802488 -2.191236      5.149911 5.171179       3.340402 14.22108 6.527884 19.42510 6.230928 -5.204021      9.024285 
1 1 1 -21 27 2  o 30.34128 4.560715 12.11705       3.267887 9.614754       6.131867 13.10967       3.862038 25.31886 8.461246 31.21932 5.263406 -5.900463      9.964745 
1 1 1 -21 27 3  o 37.43980 4.761985 18.42771       4.246506 0.000000       0.000000 18.42771       4.246506 ?        ?        37.43980 4.761985 0.000000       4.761985 
1 1 1 -21 27 4  o 43.51843 3.739763 24.14760       3.927584 8.656976       7.148865 30.84476       4.700542 24.51055 9.053464 49.08962 3.963024 -24.57907      9.882853 
1 1 1 -21 27 5  o 24.65947 5.724427 8.364030       3.373620 8.825188       6.674171 8.205765       3.909894 24.63275 8.797951 24.11880 6.504474 0.5139408      10.94130 
1 1 1 -21 27 6  o 57.12810 4.429570 42.13840       6.118477 35.83167       9.109240 47.32251       8.258802 49.93610 7.735662 59.42550 5.775837 -9.489403      9.654054 
1 1 1 -21 27 7  o 23.91034 5.835034 7.888618       3.369466 0.7028570      6.541165 10.48400       3.931149 17.87292 7.838199 27.54700 6.024291 -9.674078      9.885819 
1 1 1 -21 27 8  o 24.67547 5.826969 8.390923       3.447447 4.773715       6.776026 9.654236       4.004461 21.04179 8.516180 26.26973 6.330423 -5.227936      10.61129 
1 1 1 -21 27 9  o 50.88956 3.694520 32.89265       4.550457 26.90834       9.043304 34.92157       5.265645 41.95245 9.107483 52.15222 4.178189 -10.19977      10.02015 
1 1 1 -21 27 10 o 33.74933 4.827115 15.00685       3.857049 12.35243       7.903904 15.83654       4.418925 28.11423 9.605720 34.34039 5.463339 -6.226152      11.05070 
1 1 1 -21 27 11 o 22.73457 6.712831 7.294879       3.975337 0.000000       0.000000 7.294879       3.975337 ?        ?        22.73457 6.712831 0.000000       6.712831 
1 1 1 -21 27 12 o 32.05766 4.864903 13.59994       3.681310 7.665223       6.779415 16.08162       4.383951 23.48899 8.789404 34.62854 5.368813 -11.13955      10.29941 
1 1 1 -21 27 13 o 11.19680 5.127262 -1.668381      3.151301 -7.534050      5.981839 0.5848629      3.707491 12.95795 6.259846 14.11912 6.045887 -1.161164      8.702783 
1 1 1 -21 27 14 o 13.99504 5.844852 1.073091       3.324905 1.716655       6.190173 0.8121324      3.941788 18.07759 7.777668 14.66131 6.254852 3.416283       9.980746 
1 1 1 -21 27 15 o 47.99319 6.065361 31.52686       6.935550 18.11719       9.274368 48.54071       10.44664 32.65572 10.37233 58.01197 7.570037 -25.35625      12.84098 
1 1 1 -21 27 16 o 15.12791 6.399369 1.188910       4.066461 7.836609       8.141653 -1.020660      4.693868 23.76079 9.430331 14.26475 6.422584 9.496042       11.40968 
1 1 1 -21 27 17 o 13.07488 5.888845 -1.018339      3.949929 -1.619832      7.392223 -0.7779768     4.672967 17.13980 7.850255 14.35746 6.440874 2.782339       10.15438 
1 1 1 -21 27 18 o 61.57190 3.690704 48.50064       5.512263 38.57050       8.321769 56.26376       7.357939 52.15357 6.702573 65.44342 4.643918 -13.28985      8.154168 
1 1 1 -21 27 19 o 20.05179 6.431315 5.701341       3.558776 5.170028       6.461628 5.932675       4.263708 20.55766 8.317699 20.44627 7.052728 0.1113873      10.90528 
1 1 1 -21 27 20 o 64.48089 3.674317 53.37648       5.749663 25.20297       12.71964 60.61157       6.445792 34.58218 12.16547 68.52943 3.875581 -33.94724      12.76788 
1 1 1 -21 27 21 o 32.95393 4.915351 14.71828       3.826743 17.40974       7.024157 13.58227       4.563427 32.58003 8.688231 30.66601 6.316933 1.914024       10.74193 
1 1 1 -21 27 22 o 14.94548 6.267848 1.615394       3.847698 1.035701       10.19598 1.711658       4.154909 19.91241 9.156798 15.39798 6.488745 4.514432       11.22278 
1 1 1 -21 27 23 o 21.86720 6.288234 7.062114       3.529535 16.37218       6.543608 3.242067       4.191556 31.54984 8.373118 16.89327 6.746101 14.65657       10.75263 
1 1 1 -21 27 24 o 52.58334 4.236455 36.59208       5.382675 30.10356       7.685267 42.83974       7.541278 44.37283 7.365448 55.23917 5.683236 -10.86634      9.303171 
1 1 1 -21 27 25 o 39.05995 4.427233 20.48730       4.139826 12.10924       7.143482 24.72393       5.079825 25.94443 9.117693 42.41499 5.011319 -16.47056      10.40412 
1 1 1 -21 27 26 o 17.30627 6.304855 4.128507       3.448208 5.970620       5.854625 3.150105       4.266772 20.16037 7.998319 16.66272 6.752752 3.497643       10.46770 
1 1 1 -21 28 1  o 13.03076 5.377289 1.096286       2.767037 1.390234       5.007089 0.9670473      3.320056 16.35134 7.014382 13.76171 5.799835 2.589627       9.101628 
1 1 1 -21 28 2  o 105.1590 3.350418 139.9513       8.574855 139.3211       14.89377 140.2638       10.48736 100.7018 6.097773 104.2675 4.135650 -3.565651      7.367933 
1 1 1 -21 28 3  o 36.73709 4.179502 17.56864       3.675221 4.328302       6.141586 24.95514       4.587227 19.87112 8.083681 43.73252 4.362513 -23.86140      9.185719 
1 1 1 -21 28 4  f 21.81692 5.946939 6.684244       3.247668 5.179154       5.648639 7.427450       3.969329 20.36608 7.923123 22.72910 6.706856 -2.363020      10.38065 
1 1 1 -21 28 5  o 24.75339 5.922866 8.579308       3.524878 20.04789       6.644209 4.087156       4.158298 36.84939 7.649693 18.28349 6.874858 18.56591       10.28501 
1 1 1 -21 28 6  o 27.29376 5.471468 10.20043       3.512353 10.22315       6.830863 10.19226       4.095192 25.72551 8.924302 26.80325 6.365057 -1.077740      10.96162 
1 1 1 -21 28 7  o 19.20600 6.059792 5.067078       3.170224 1.056280       6.062743 6.576438       3.719207 17.40290 7.590968 21.55438 6.523714 -4.151476      10.00908 
1 1 1 -21 28 8  o 27.95593 5.432557 10.66643       3.567584 11.12508       6.983929 10.50449       4.149883 26.65908 9.030676 27.23128 6.367974 -0.5722027     11.05008 
1 1 1 -21 28 9  o 15.05714 5.975279 2.108893       3.268342 -1.870659      6.169901 3.661161       3.853403 15.72807 7.191698 17.56017 6.614755 -1.832095      9.771156 
1 1 1 -21 28 10 o 17.30739 6.344085 3.685033       3.499254 6.880535       6.918898 2.586740       4.056268 22.57083 8.772222 16.51325 6.622090 6.057583       10.99109 
1 1 1 -21 28 11 o 19.81667 7.328084 5.125421       4.686043 0.000000       0.000000 5.125421       4.686043 ?        ?        19.81667 7.328084 0.000000       7.328084 
1 1 1 -21 28 12 o 19.99306 6.835699 5.511682       4.002795 -4.689725      7.219776 10.03905       4.809685 15.57276 7.339386 26.05317 7.290265 -10.48042      10.34478 
1 1 1 -21 28 13 o 34.92122 5.476325 16.60499       4.507188 9.656481       7.730174 20.18395       5.547814 24.99817 9.379014 38.03375 6.199035 -13.03558      11.24251 
1 1 1 -21 28 14 o 16.76098 7.214506 1.426804       5.330843 -2.591074      6.925771 7.267667       8.350419 16.11418 7.458754 23.15302 9.423247 -7.038834      12.01793 
1 1 1 -21 28 15 o 20.53303 6.320443 5.987695       3.471789 0.4856291      5.890025 8.917064       4.297750 16.65491 7.365534 24.62228 6.891914 -7.967373      10.08710 
1 1 1 -21 28 16 o 34.87306 4.870847 16.30823       4.026568 10.91138       6.819631 19.19660       4.989038 25.98049 8.921203 37.31306 5.664577 -11.33258      10.56765 
1 1 1 -21 28 17 o 41.81253 4.111915 22.81847       4.135593 13.25552       7.050152 27.83531       5.106430 28.22705 9.051955 45.81489 4.637572 -17.58784      10.17079 
1 1 1 -21 28 18 o 11.11572 5.162764 -2.140347      3.361383 -5.660983      5.717389 -0.2806006     4.155411 13.05517 6.258635 13.79883 6.139847 -0.7436571     8.767453 
1 1 1 -21 28 19 f 47.08834 3.852284 28.79994       4.381860 30.60319       7.613912 27.90691       5.358128 45.44091 7.108631 45.49303 4.910902 -0.5212402E-01 8.639999 
1 1 1 -21 28 20 o 18.79075 6.699886 4.950012       3.868872 10.16965       10.39375 4.110479       4.168414 24.49678 10.28932 17.88902 6.846616 6.607759       12.35905 
1 1 1 -21 28 21 f 39.46494 4.443435 20.79400       4.199149 18.12865       7.472154 22.02431       5.076613 32.40026 9.094090 39.87267 5.360384 -7.472401      10.55633 
1 1 1 -21 28 22 o 16.43058 6.235459 3.387752       3.438961 8.130980       6.396152 1.459030       4.078651 22.48446 8.510494 14.97036 6.373826 7.514104       10.63269 
1 1 1 -21 28 23 f 16.48139 6.245434 3.466447       3.446893 2.692030       6.216642 3.810206       4.141860 17.83839 7.734714 17.34285 6.773807 0.4955444      10.28155 
1 1 1 -21 28 24 o 14.12992 6.182910 0.6351432      4.050006 -1.372776      10.51394 0.9849927      4.388672 18.65070 8.810306 14.82898 6.463517 3.821718       10.92696 
1 1 1 -21 29 1  o 78.00521 3.455670 77.79554       6.552585 66.95244       10.41453 84.90055       8.430345 68.75842 6.284948 80.45181 4.315845 -11.69338      7.624113 
1 1 1 -21 29 2  o 17.69537 6.755285 3.891095       4.051193 0.000000       0.000000 3.891095       4.051193 ?        ?        17.69537 6.755285 0.000000       6.755285 
1 1 1 -21 29 3  o 30.82544 5.419576 13.11508       3.922552 11.31617       6.220824 14.30238       5.053877 26.48667 8.503794 31.18996 6.838167 -4.703289      10.91215 
1 1 1 -21 29 4  o 15.98589 6.196823 2.838255       3.445795 7.124152       5.592396 0.2153181      4.374928 22.00323 8.027266 14.54471 6.393405 7.458517       10.26219 
1 1 1 -21 29 5  o 11.54986 5.473724 -3.777195      4.121069 -2.914633      4.554523 -7.672748      9.679034 12.73891 5.947711 16.76747 8.065508 -4.028556      10.02136 
1 1 1 -21 29 6  o 18.26321 6.516586 4.443649       3.660736 -0.2481861     5.887769 7.400418       4.673993 16.12864 7.233044 22.35102 7.384782 -6.222383      10.33692 
1 1 1 -21 29 7  o 46.68333 4.399920 28.59613       4.946411 11.28405       7.858918 39.95334       6.365377 26.13891 9.518967 54.86729 4.809324 -28.72837      10.66491 
1 1 1 -21 29 8  o 12.49784 5.595942 -0.7177937     3.509064 -7.120496      5.622384 3.367666       4.491168 12.42331 6.017754 17.57395 6.994568 -5.150644      9.226990 
1 1 1 -21 29 9  o 26.27939 6.606376 10.06350       4.225521 3.491812       7.316599 13.35233       5.175969 19.83523 8.493405 29.95307 7.183773 -10.11785      11.12405 
1 1 1 -21 29 10 f 28.40892 6.509083 11.67603       4.409349 0.000000       0.000000 11.67603       4.409349 ?        ?        28.40892 6.509083 0.000000       6.509083 
1 1 1 -21 29 11 f 23.41179 6.377692 7.943180       3.736545 5.198494       7.288324 8.921798       4.351993 20.96086 8.695556 24.50685 6.961801 -3.545988      11.13909 
1 1 1 -21 29 12 o 62.11242 3.531189 49.31835       5.322831 52.46984       10.83231 48.31517       6.111574 59.27441 7.679585 60.94701 4.139515 -1.672607      8.724196 
1 1 1 -21 29 13 o 21.92571 6.245173 6.945976       3.497503 10.37592       6.164232 5.317548       4.247369 25.45573 8.483040 19.56937 7.015121 5.886362       11.00790 
1 1 1 -21 29 14 o 19.32600 7.032497 5.143385       4.288294 3.689964       5.909331 6.760230       6.232708 18.82737 7.821826 21.66528 8.351400 -2.837910      11.44233 
1 1 1 -21 29 15 o 25.23085 6.014293 9.157164       3.645381 9.749682       6.417951 8.874959       4.429219 24.52806 8.640434 24.21617 7.068278 0.3118877      11.16323 
1 1 1 -21 29 16 o 29.35416 5.513428 12.05944       3.799133 8.224022       6.590033 13.96867       4.649536 22.90263 8.645292 31.00747 6.366645 -8.104832      10.73663 
1 1 1 -21 29 17 o 14.80676 6.037432 1.967527       3.435340 -3.018528      6.087775 4.297081       4.161180 14.61022 6.839302 18.10357 6.861650 -3.493350      9.688048 
1 1 1 -21 29 18 o 68.34927 3.272889 59.67018       5.435473 52.10209       9.084093 63.89082       6.783875 60.30347 6.273216 69.94933 3.996403 -9.645859      7.438042 
1 1 1 -21 29 19 o 27.26408 6.419910 11.02248       4.194344 11.35808       10.81388 10.96305       4.550584 24.90941 10.48088 26.79961 6.920167 -1.890203      12.55936 
1 1 1 -21 29 20 o 31.88407 5.148572 14.10281       3.864088 15.42778       7.064793 13.53726       4.615682 29.64549 8.995153 30.19807 6.467120 -0.5525742     11.07865 
1 1 1 -21 29 21 o 20.62408 6.338442 6.350077       3.493284 6.018622       6.161672 6.507075       4.240654 20.38445 8.166080 20.65932 7.036479 -0.2748699     10.77947 
1 1 1 -21 29 22 o 23.98033 6.073927 8.524169       3.552767 12.04934       6.158670 6.765956       4.349434 26.44513 8.458254 20.93136 7.126211 5.513771       11.06006 
1 1 1 -21 30 1  o 15.03449 5.757923 2.646949       2.949457 2.744559       5.221035 2.601198       3.574463 17.18471 7.259392 15.57748 6.226699 1.607228       9.564025 
1 1 1 -21 30 2  o 48.49193 4.937986 31.95778       5.753873 0.000000       0.000000 31.95778       5.753873 ?        ?        48.49193 4.937986 0.000000       4.937986 
1 1 1 -21 30 3  f 11.62939 5.170120 -0.3821428     2.940056 0.7700317      4.988440 -0.9953781     3.639312 15.51339 6.822828 12.35233 5.599367 3.161063       8.826318 
1 1 1 -21 30 4  o 13.14218 5.530419 0.9912934      3.011558 1.068598       5.049325 0.9486109      3.751941 15.83158 6.916131 14.16528 6.074167 1.666306       9.204802 
1 1 1 -21 30 5  o 34.99045 5.981839 17.41660       4.917462 11.64261       6.807848 23.71577       7.110718 26.17763 8.915475 39.19075 7.720264 -13.01312      11.79356 
1 1 1 -21 30 6  o 57.06017 3.510109 41.82702       4.857163 32.20053       8.506803 46.48340       5.916384 45.57578 7.948292 59.61475 4.097471 -14.03897      8.942293 
1 1 1 -21 30 7  o 29.14942 5.340629 11.80847       3.653901 4.997983       6.363491 15.15838       4.462961 20.00494 8.194083 32.76892 5.801142 -12.76399      10.03973 
1 1 1 -21 30 8  o 12.56097 5.537482 -0.1059347     3.304158 -0.7269403     5.974462 0.1677013      3.965863 15.72675 7.146866 13.82130 6.080881 1.905441       9.383753 
1 1 1 -21 30 9  o 18.27283 6.349605 4.636731       3.458657 -3.766312      6.234590 8.372442       4.156963 14.46851 6.819361 23.58815 6.836835 -9.119647      9.656397 
1 1 1 -21 30 10 o 22.02690 7.072373 7.322030       4.302770 0.000000       0.000000 7.322030       4.302770 ?        ?        22.02690 7.072373 0.000000       7.072373 
1 1 1 -21 30 11 f 13.03693 5.695413 0.2221971      3.424374 -1.808932      6.927552 0.8789719      3.939302 16.12309 7.461769 14.37182 6.194112 1.751274       9.697680 
1 1 1 -21 30 12 o 37.57695 4.580982 18.92320       4.108249 16.98220       7.913438 19.63935       4.806746 30.87502 9.549041 37.66434 5.390548 -6.789322      10.96550 
1 1 1 -21 30 13 o 11.29813 5.247386 -2.085941      3.472230 1.334191       7.164091 -3.136023      3.969641 17.94411 8.017899 11.52958 5.436404 6.414529       9.687166 
1 1 1 -21 30 14 o 17.74110 6.424300 4.278696       3.572753 9.700982       6.270817 1.672641       4.347351 24.21502 8.539902 15.52356 6.593827 8.691455       10.78928 
1 1 1 -21 30 15 o 12.38083 5.496315 -0.2590694     3.310802 -5.058220      5.617668 2.294993       4.098166 13.03414 6.236565 15.81790 6.537389 -2.783757      9.035053 
1 1 1 -21 30 16 o 10.87349 5.043375 -1.893339      3.191051 -2.476445      5.238819 -1.549375      4.023613 13.74111 6.403412 12.55238 5.764913 1.188727       8.616142 
1 1 1 -21 30 17 o 23.40010 6.320869 8.172318       3.688683 5.525696       6.325604 9.536013       4.540615 20.10851 8.195047 24.72104 7.139443 -4.612524      10.86878 
1 1 1 -21 30 18 o 26.80154 5.896249 10.44632       3.746179 13.79923       6.433152 8.725968       4.608092 28.32791 8.581173 23.50150 7.289876 4.826406       11.25961 
1 1 1 -21 30 19 o 45.96851 4.503143 28.42154       4.979786 26.60785       12.77173 28.74670       5.407790 33.11895 12.12329 45.82743 4.919284 -12.70849      13.08333 
1 1 1 -21 31 1  o 32.91464 4.592648 14.76388       3.583569 17.38622       6.233062 13.46910       4.379804 32.55212 7.931479 30.19411 6.161304 2.358019       10.04341 
1 1 1 -21 31 2  o 14.88036 6.173429 1.952615       3.673843 0.000000       0.000000 1.952615       3.673843 ?        ?        14.88036 6.173429 0.000000       6.173429 
1 1 1 -21 31 3  o 18.02037 6.225920 4.641123       3.323118 -0.1363692     5.627703 7.198742       4.117647 15.43037 6.981964 21.59698 6.916988 -6.166617      9.828151 
1 1 1 -21 31 4  o 23.12929 5.926052 7.855381       3.354880 1.239192       5.658946 11.44095       4.165916 16.37202 7.230962 27.75569 6.303410 -11.38367      9.592694 
1 1 1 -21 31 5  o 20.78643 6.217288 6.412894       3.392666 -1.143345      5.819289 10.30365       4.175744 15.10293 6.935072 26.12026 6.567896 -11.01733      9.551571 
1 1 1 -21 31 6  o 21.82536 6.129352 7.049400       3.393352 14.77571       6.181504 3.716814       4.059745 29.82240 8.234910 17.21519 6.711390 12.60721       10.62339 
1 1 1 -21 31 7  o 17.92699 6.229812 4.530193       3.329409 -1.079458      5.824306 7.253022       4.057761 15.17341 6.956540 21.79690 6.852871 -6.623489      9.765004 
1 1 1 -21 31 8  o 18.87852 6.325565 5.160960       3.426779 2.106907       6.019038 6.625600       4.168254 17.35016 7.565835 20.90060 6.975965 -3.550444      10.29106 
1 1 1 -21 31 9  o 24.25981 6.177553 8.699075       3.661292 9.743684       7.132965 8.325402       4.266175 23.87432 8.998268 23.22986 6.977379 0.6444607      11.38651 
1 1 1 -21 31 10 f 20.55939 6.440586 6.290617       3.587403 -0.5234322     6.743371 8.980294       4.236669 16.41265 7.509919 24.18608 6.868360 -7.773432      10.17709 
1 1 1 -21 31 11 o 15.82061 6.247081 2.831981       3.556000 -8.582545      6.494349 7.719594       4.249669 12.80703 6.262189 22.37546 7.009975 -9.568429      9.399722 
1 1 1 -21 31 12 o 15.73376 6.228496 2.777931       3.543063 5.250397       6.727275 1.828855       4.167971 20.03219 8.335923 15.37657 6.490356 4.655622       10.56467 
1 1 1 -21 31 13 o 15.42737 6.784242 0.9064820      4.930918 10.47164       7.396901 -6.743691      6.615147 24.36442 9.167513 13.54176 6.551824 10.82266       11.26808 
1 1 1 -21 31 14 o 21.93443 6.592257 7.309630       3.807375 -7.047550      7.074177 13.16436       4.517464 13.93456 6.749872 29.73154 6.423007 -15.79699      9.317499 
1 1 1 -21 31 15 o 23.35860 6.321114 8.196552       3.684966 5.188200       6.386425 9.697991       4.511774 19.73358 8.158801 24.85977 7.097161 -5.126194      10.81368 
1 1 1 -21 31 16 o 16.46528 6.209788 3.509654       3.398309 3.056901       6.081794 3.715183       4.097683 17.92982 7.711628 17.15872 6.727091 0.7711048      10.23342 
1 1 1 -21 32 1  o 21.79656 5.802632 7.069819       3.136503 3.370823       5.343412 9.014280       3.874149 17.41180 7.349067 24.17644 6.454766 -6.764635      9.781247 
1 1 1 -21 32 2  o 14.63084 5.845739 2.320105       3.149063 1.046185       5.610950 2.905882       3.804795 15.96331 7.116762 15.89861 6.400358 0.6470108E-01  9.571462 
1 1 1 -21 32 3  o 10.45809 4.855433 -1.734443      2.968658 2.582155       5.343692 -3.661384      3.570300 16.86138 7.239970 10.39587 4.973575 6.465512       8.783713 
1 1 1 -21 32 4  o 13.92759 6.101234 0.6393269      3.953551 1.884440       5.282225 -0.9466313     5.961538 16.31325 7.101032 15.18163 6.988769 1.131617       9.963310 
1 1 1 -21 32 5  o 22.76227 6.018418 7.730030       3.388739 -2.682479      5.996869 12.61475       4.107399 14.36288 6.744084 29.33117 5.950179 -14.96830      8.993737 
1 1 1 -21 32 6  o 16.71802 6.118093 3.800908       3.252351 1.518703       5.975840 4.761431       3.876817 16.69898 7.400308 18.22935 6.678302 -1.530373      9.968163 
1 1 1 -21 32 7  o 32.41166 5.134615 14.68427       3.920503 18.65293       7.630529 13.26086       4.569804 31.98272 9.260742 29.64551 6.504693 2.337206       11.31691 
1 1 1 -21 32 8  o 35.28870 4.757976 17.06285       3.987453 19.93884       7.706477 16.01140       4.659687 33.28968 9.195679 33.15354 5.987848 0.1361427      10.97337 
1 1 1 -21 32 9  o 8.878896 4.407504 -7.584891      3.654035 0.000000       0.000000 -7.584891      3.654035 ?        ?        8.878896 4.407504 0.000000       4.407504 
1 1 1 -21 32 10 f 14.32374 5.945948 1.723919       3.410858 -4.407929      5.873864 4.843412       4.189578 13.48579 6.431921 18.45950 6.909095 -4.973714      9.439555 
1 1 1 -21 32 11 o 14.01077 5.965769 1.217916       3.573653 -4.849700      6.959146 3.391004       4.164717 14.52873 6.948904 16.81125 6.720736 -2.282521      9.667241 
1 1 1 -20 0  1  o 65.09918 3.374096 52.10800       5.319643 52.10800       5.319643 52.10800       5.319643 65.09918 3.374096 65.09918 3.374096 -0.000000      0.000000 
1 1 1 -20 0  2  o 49.71505 3.702770 30.65116       4.427384 30.65116       4.427384 30.65116       4.427384 49.71505 3.702770 49.71505 3.702770 0.000000       0.000000 
1 1 1 -20 0  3  o 59.43853 3.376990 43.50720       4.855005 43.50720       4.855005 43.50720       4.855005 59.43853 3.376990 59.43853 3.376990 -0.000000      0.000000 
1 1 1 -20 0  4  o 100.4625 3.198195 123.4619       7.811712 123.4619       7.811712 123.4619       7.811712 100.4625 3.198195 100.4625 3.198195 -0.000000      0.000000 
1 1 1 -20 0  5  o 55.61413 3.441382 38.15639       4.622580 38.15639       4.622580 38.15639       4.622580 55.61413 3.441382 55.61413 3.441382 0.000000       0.000000 
1 1 1 -20 0  6  o 177.2520 4.694455 384.3707       20.24525 384.3707       20.24525 384.3707       20.24525 177.2520 4.694455 177.2520 4.694455 -0.000000      0.000000 
1 1 1 -20 0  7  o 170.9120 4.587348 357.3515       19.07492 357.3515       19.07492 357.3515       19.07492 170.9120 4.587348 170.9120 4.587348 -0.000000      0.000000 
1 1 1 -20 0  8  o 189.1040 4.815660 437.4615       22.15929 437.4615       22.15929 437.4615       22.15929 189.1040 4.815660 189.1040 4.815660 -0.000000      0.000000 
1 1 1 -20 0  9  o 12.26024 7.196063 2.131292       3.624341 2.131292       3.624341 2.131292       3.624341 12.26024 7.196063 12.26024 7.196063 0.000000       0.000000 
1 1 1 -20 0  10 o 148.7772 6.371169 272.1540       23.00231 272.1540       23.00231 272.1540       23.00231 148.7772 6.371169 148.7772 6.371169 -0.000000      0.000000 
1 1 1 -20 0  11 o 136.9974 6.191211 230.8704       20.57282 230.8704       20.57282 230.8704       20.57282 136.9974 6.191211 136.9974 6.191211 0.000000       0.000000 
1 1 1 -20 0  12 o 101.6925 3.850828 126.7171       9.511763 126.7171       9.511763 126.7171       9.511763 101.6925 3.850828 101.6925 3.850828 0.000000       0.000000 
1 1 1 -20 0  13 o 158.9748 4.408646 309.2101       17.04959 309.2101       17.04959 309.2101       17.04959 158.9748 4.408646 158.9748 4.408646 -0.000000      0.000000 
1 1 1 -20 0  14 o 17.36984 8.454989 5.441803       4.204815 5.441803       4.204815 5.441803       4.204815 17.36984 8.454989 17.36984 8.454989 0.000000       0.000000 
1 1 1 -20 0  15 o 227.3086 5.418055 632.4708       29.97352 632.4708       29.97352 632.4708       29.97352 227.3086 5.418055 227.3086 5.418055 0.000000       0.000000 
1 1 1 -20 0  16 o 117.2546 3.996480 168.3776       11.38931 168.3776       11.38931 168.3776       11.38931 117.2546 3.996480 117.2546 3.996480 -0.000000      0.000000 
1 1 1 -20 0  17 f 28.45690 10.03598 13.04742       6.318319 13.04742       6.318319 13.04742       6.318319 28.45690 10.03598 28.45690 10.03598 0.000000       0.000000 
1 1 1 -20 0  18 o 44.92335 5.131671 25.60531       5.428329 25.60531       5.428329 25.60531       5.428329 44.92335 5.131671 44.92335 5.131671 0.000000       0.000000 
1 1 1 -20 0  19 o 251.5054 5.836636 775.0510       35.72873 775.0510       35.72873 775.0510       35.72873 251.5054 5.836636 251.5054 5.836636 0.000000       0.000000 
1 1 1 -20 0  20 o 216.4765 5.266825 573.9575       27.74691 573.9575       27.74691 573.9575       27.74691 216.4765 5.266825 216.4765 5.266825 -0.000000      0.000000 
1 1 1 -20 0  21 o 63.46744 4.421558 49.91693       6.760952 49.91693       6.760952 49.91693       6.760952 63.46744 4.421558 63.46744 4.421558 0.000000       0.000000 
1 1 1 -20 0  22 o 57.60645 4.725336 41.37189       6.527300 41.37189       6.527300 41.37189       6.527300 57.60645 4.725336 57.60645 4.725336 -0.000000      0.000000 
1 1 1 -20 0  23 o 9.906981 6.633789 -1.625257      4.451902 -1.625257      4.451902 -1.625257      4.451902 9.906981 6.633789 9.906981 6.633789 0.000000       0.000000 
1 1 1 -20 0  24 o 142.1467 4.340800 247.6925       15.00459 247.6925       15.00459 247.6925       15.00459 142.1467 4.340800 142.1467 4.340800 0.000000       0.000000 
1 1 1 -20 0  25 o 197.8973 7.085130 483.6970       34.06886 483.6970       34.06886 483.6970       34.06886 197.8973 7.085130 197.8973 7.085130 0.000000       0.000000 
1 1 1 -20 0  26 o 9.942835 6.654738 -1.582326      4.470880 -1.582326      4.470880 -1.582326      4.470880 9.942835 6.654738 9.942835 6.654738 -0.000000      0.000000 
1 1 1 -20 0  27 o 27.36973 8.629987 11.61349       5.056790 11.61349       5.056790 11.61349       5.056790 27.36973 8.629987 27.36973 8.629987 -0.000000      0.000000 
1 1 1 -20 0  28 o 66.97906 4.359923 55.65663       7.046182 55.65663       7.046182 55.65663       7.046182 66.97906 4.359923 66.97906 4.359923 -0.000000      0.000000 
1 1 1 -20 0  29 o 53.49631 4.917064 36.02251       6.278961 36.02251       6.278961 36.02251       6.278961 53.49631 4.917064 53.49631 4.917064 0.000000       0.000000 
1 1 1 -20 0  30 o 12.61821 8.541975 -3.468194      7.770810 -3.468194      7.770810 -3.468194      7.770810 12.61821 8.541975 12.61821 8.541975 0.000000       0.000000 
1 1 1 -20 0  31 o 63.66874 4.604833 50.64611       7.056939 50.64611       7.056939 50.64611       7.056939 63.66874 4.604833 63.66874 4.604833 -0.000000      0.000000 
1 1 1 -20 0  32 o 31.39306 8.155360 14.51728       5.390897 14.51728       5.390897 14.51728       5.390897 31.39306 8.155360 31.39306 8.155360 -0.000000      0.000000 
1 1 1 -20 0  33 f 10.75292 7.101317 -0.8067979     4.812838 -0.8067979     4.812838 -0.8067979     4.812838 10.75292 7.101317 10.75292 7.101317 -0.000000      0.000000 
1 1 1 -20 0  34 o 26.48203 12.10081 13.59013       8.495964 13.59013       8.495964 13.59013       8.495964 26.48203 12.10081 26.48203 12.10081 -0.000000      0.000000 
1 1 1 -20 0  35 o 60.83481 4.920979 46.95718       7.181933 46.95718       7.181933 46.95718       7.181933 60.83481 4.920979 60.83481 4.920979 0.000000       0.000000 
1 1 1 -20 0  36 o 27.31640 11.01114 13.79382       7.144200 13.79382       7.144200 13.79382       7.144200 27.31640 11.01114 27.31640 11.01114 -0.000000      0.000000 
1 1 1 -20 0  37 o 58.51313 5.075426 44.01680       7.106539 44.01680       7.106539 44.01680       7.106539 58.51313 5.075426 58.51313 5.075426 0.000000       0.000000 
1 1 1 -20 0  38 o 41.73634 6.358908 23.75720       6.022766 23.75720       6.022766 23.75720       6.022766 41.73634 6.358908 41.73634 6.358908 -0.000000      0.000000 
1 1 1 -20 0  39 o 12.64626 7.946600 1.837399       5.120811 1.837399       5.120811 1.837399       5.120811 12.64626 7.946600 12.64626 7.946600 0.000000       0.000000 
1 1 1 -20 0  40 o 22.75345 11.10320 11.39187       7.257830 11.39187       7.257830 11.39187       7.257830 22.75345 11.10320 22.75345 11.10320 0.000000       0.000000 
1 1 1 -20 0  41 o 9.895479 6.699249 -1.392744      4.781296 -1.392744      4.781296 -1.392744      4.781296 9.895479 6.699249 9.895479 6.699249 -0.000000      0.000000 
1 1 1 -20 0  42 o 9.015926 6.321142 -4.181935      5.256242 -4.181935      5.256242 -4.181935      5.256242 9.015926 6.321142 9.015926 6.321142 -0.000000      0.000000 
1 1 1 -20 0  43 o 15.26094 8.966228 5.071030       5.636333 5.071030       5.636333 5.071030       5.636333 15.26094 8.966228 15.26094 8.966228 0.000000       0.000000 
1 1 1 -20 1  1  o 9.234990 4.247015 -1.673283      2.193840 -4.433327      3.238153 0.6684408      2.982684 9.942573 4.751239 13.57165 5.589915 -3.629073      7.336308 
1 1 1 -20 1  2  o 29.66008 3.768882 10.91931       2.662657 12.47892       4.064831 9.747144       3.523953 31.46232 5.501943 27.73767 5.407794 3.724649       7.714636 
1 1 1 -20 1  3  o 127.5473 2.377165 198.4284       7.388676 200.6714       10.46661 196.2002       10.43181 128.1561 3.354319 126.7165 3.381261 1.439598       4.762812 
1 1 1 -20 1  4  f 82.63165 2.233079 83.33180       4.492503 83.88503       6.372646 82.78523       6.334245 82.83773 3.162671 82.29195 3.164547 0.5457764      4.474019 
1 1 1 -20 1  5  o 163.7734 2.846108 327.2861       11.35875 321.5195       17.83094 331.2244       14.73549 162.0820 4.518845 164.6759 3.671966 -2.593887      5.822653 
1 1 1 -20 1  6  o 173.4876 3.275465 367.4314       13.84769 354.6567       19.34621 380.8528       19.82993 170.2136 4.668485 176.4012 4.616968 -6.187653      6.565908 
1 1 1 -20 1  7  o 278.0217 4.444003 945.1235       30.10850 922.4973       42.03453 968.9633       43.14696 274.1915 6.290947 281.0091 6.300771 -6.817596      8.903691 
1 1 1 -20 1  8  o 81.16242 2.701086 80.45587       5.334874 77.57014       7.612663 83.24074       7.478430 79.58305 3.937591 82.46848 3.730891 -2.885429      5.424405 
1 1 1 -20 1  9  o 47.82012 3.886380 28.12063       4.489886 28.74947       5.192576 26.25744       8.938057 48.28577 4.463436 45.44380 8.379749 2.841972       9.494338 
1 1 1 -20 1  10 o 110.7011 3.266333 149.7333       8.801836 153.9383       10.69660 140.9156       15.48963 112.1782 3.918942 107.0371 5.961976 5.141136       7.134653 
1 1 1 -20 1  11 o 278.2552 5.155486 947.9705       34.95819 1008.443       63.81927 922.0474       41.78453 285.3561 9.189569 274.1118 6.255351 11.24429       11.11655 
1 1 1 -20 1  12 o 27.56088 4.900490 9.572460       3.170693 6.388632       4.595129 12.46599       4.380631 22.98911 7.300901 31.37461 5.947171 -8.385502      9.416582 
1 1 1 -20 1  13 o 71.06213 2.783565 61.71353       4.810995 53.59592       6.719541 70.25133       6.891256 66.08141 4.194414 75.73978 3.745307 -9.658379      5.623205 
1 1 1 -20 1  14 o 308.0126 4.814239 1161.147       36.13534 1166.598       51.37793 1155.812       50.83261 308.0328 6.844529 306.6222 6.803037 1.410614       9.650331 
1 1 1 -20 1  15 o 96.48771 2.736789 113.6965       6.428511 105.1225       9.047868 122.4370       9.135339 92.64940 4.016990 100.0323 3.754220 -7.382881      5.498216 
1 1 1 -20 1  16 o 124.6822 3.255267 189.9590       9.882243 188.1154       16.96309 190.9061       12.15860 123.7211 5.641172 124.9020 3.999801 -1.180908      6.915289 
1 1 1 -20 1  17 o 181.1257 4.656259 401.8664       20.53492 391.5621       28.83890 412.4644       29.24691 178.2942 6.649162 183.0212 6.568215 -4.726929      9.346272 
1 1 1 -20 1  18 o 195.4462 4.007689 467.1269       19.08787 447.2462       22.99402 511.1928       34.23343 190.9988 4.944398 203.6187 6.909174 -12.61989      8.496102 
1 1 1 -20 1  19 o 93.52744 2.761853 106.8661       6.287814 98.20813       8.846709 115.7049       8.938626 89.51280 4.066269 97.21177 3.780459 -7.698967      5.552154 
1 1 1 -20 1  20 o 169.1884 3.222964 349.6757       13.28807 328.5430       18.35554 372.9460       19.26152 163.7133 4.605521 174.4497 4.534743 -10.73634      6.463336 
1 1 1 -20 1  21 o 220.9402 3.777177 597.0591       20.33659 604.3406       29.03840 590.0502       28.49000 221.8508 5.371254 219.2241 5.332958 2.626663       7.569069 
1 1 1 -20 1  22 o 39.33905 4.064601 19.14601       3.840480 17.86772       5.502198 20.36044       5.362996 37.60098 6.222267 40.31774 5.610296 -2.716759      8.378068 
1 1 1 -20 1  23 o 63.95245 3.504797 50.17636       5.441177 53.45316       6.862070 44.62687       8.930124 65.90377 4.296181 59.84367 6.213903 6.060104       7.554453 
1 1 1 -20 1  24 o 58.10461 3.642895 41.48822       5.132187 42.57042       6.577651 39.80416       8.205297 58.70884 4.635180 56.48243 6.055788 2.226418       7.626104 
1 1 1 -20 1  25 o 14.02695 6.162150 -0.9976186     4.058641 3.219250       6.104387 -4.338619      5.433570 20.81080 8.195024 14.31821 6.620100 6.492592       10.53490 
1 1 1 -20 1  26 f 144.2913 3.500443 255.0709       12.30833 263.6372       21.47509 250.8804       15.02016 145.7840 6.058101 142.8340 4.320225 2.950012       7.440762 
1 1 1 -20 1  27 o 133.7924 3.011695 219.1286       9.819256 234.2041       14.49704 206.3497       13.34717 137.9134 4.318894 129.4704 4.236112 8.442947       6.049586 
1 1 1 -20 1  28 o 27.40006 5.656769 9.650839       3.651868 3.955757       5.293681 14.82214       5.044377 20.46949 7.743608 33.96313 6.327613 -13.49364      10.00011 
1 1 1 -20 1  29 o 34.43094 5.361269 15.05617       4.351944 15.67633       8.275612 14.81911       5.116555 34.26556 9.553489 33.87764 6.432858 0.3879204      11.51741 
1 1 1 -20 1  30 o 22.02418 7.121702 6.030275       4.357889 6.846369       5.303034 4.332911       7.647899 23.59682 7.868289 23.05968 9.143807 0.5371361      12.06313 
1 1 1 -20 1  31 o 75.43224 3.064472 70.05926       5.621390 77.14442       8.173306 63.69925       7.743767 78.78080 4.273367 71.49948 4.466714 7.281319       6.181683 
1 1 1 -20 1  32 o 57.40189 3.451043 40.82314       4.805099 44.53220       6.936547 37.40125       6.662602 59.50480 4.824963 54.40614 5.084150 5.098663       7.009198 
1 1 1 -20 1  33 o 21.34433 6.902102 5.821074       4.093258 15.74493       8.337163 2.669212       4.698526 33.40862 9.681959 18.08028 7.167741 15.32834       12.04645 
1 1 1 -20 1  34 o 73.00851 3.192049 66.11061       5.665370 70.18010       8.335516 62.61674       7.723523 74.52311 4.612529 70.42662 4.524242 4.096489       6.460974 
1 1 1 -20 1  35 o 54.65444 4.336238 37.88304       5.727998 37.75819       6.858490 38.17094       10.41467 54.06571 5.272510 52.16514 8.483998 1.900570       9.988873 
1 1 1 -20 1  36 o 13.24536 6.129285 -2.989042      4.672399 2.529246       6.653656 -8.357684      6.562819 19.57547 8.227985 13.67218 6.592946 5.903298       10.54356 
1 1 1 -20 1  37 o 19.07833 6.481496 4.784031       3.597797 -0.1761059     5.057153 9.867278       5.119528 15.54551 6.852057 26.08946 7.594625 -10.54395      10.22883 
1 1 1 -20 1  38 o 25.43538 6.255135 9.104373       3.849723 7.156413       5.442084 11.05555       5.446579 22.51260 7.954178 27.23538 7.805033 -4.722776      11.14394 
1 1 1 -20 1  39 o 30.46371 5.568188 12.76882       3.981364 13.31682       5.654909 12.23018       5.606403 29.62636 7.746605 28.29422 7.853834 1.332138       11.03144 
1 1 1 -20 1  40 o 14.42985 6.360206 0.1798747      4.357037 -0.8859843     6.606562 1.000299       5.796219 16.39513 7.475727 16.70412 7.350230 -0.3089943     10.48391 
1 1 1 -20 1  41 o 16.15154 6.317782 3.053889       3.607309 0.4324223      4.935104 6.061347       5.285960 15.15004 6.718897 20.32748 7.726845 -5.177441      10.23952 
1 1 1 -20 1  42 o 27.47483 6.164331 11.25389       4.025457 8.968697       5.697223 13.53208       5.688499 23.02224 8.138111 28.46615 7.914732 -5.443907      11.35217 
1 1 1 -20 1  43 o 16.19269 6.541442 3.154623       3.989563 0.9710472      5.610587 5.387947       5.674139 15.77402 7.068393 19.13788 7.775679 -3.363860      10.50825 
1 1 1 -20 2  1  o 96.30306 2.471275 113.2119       5.794799 118.9051       7.696604 105.7610       8.804933 98.63501 3.206339 92.94707 3.895995 5.687943       5.045729 
1 1 1 -20 2  2  o 52.79156 2.755654 34.09894       3.532801 36.28478       5.403918 32.46747       4.668618 54.32905 4.112232 51.41565 3.751945 2.913399       5.566646 
1 1 1 -20 2  3  o 114.4190 2.562218 159.7108       7.144145 161.9933       11.30815 158.1946       9.216396 115.0590 4.039327 113.7785 3.327605 1.280510       5.233461 
1 1 1 -20 2  4  o 282.2355 3.694412 973.0100       25.40933 996.0444       36.42753 951.1825       35.46041 285.1957 5.241441 278.7045 5.221121 6.491180       7.398163 
1 1 1 -20 2  5  o 198.7630 3.166120 482.2444       15.33554 469.8735       23.93282 490.8621       19.97520 195.8648 5.018331 200.4094 4.090129 -4.544571      6.474009 
1 1 1 -20 2  6  o 67.11958 2.523638 55.03174       4.120388 54.68179       6.620064 55.25304       5.264378 66.76698 4.088384 67.20058 3.224086 -0.4336014     5.206689 
1 1 1 -20 2  7  o 157.4323 3.106992 302.5128       11.91983 322.2451       17.49904 285.4317       16.28114 162.2814 4.429102 152.7311 4.378949 9.550369       6.228333 
1 1 1 -20 2  8  o 219.0414 4.368764 586.5933       23.31959 592.2613       28.55309 575.2395       40.41180 219.9151 5.327974 216.0103 7.689376 3.904800       9.354881 
1 1 1 -20 2  9  o 84.54977 3.266621 87.39874       6.717836 87.27468       8.087360 87.67487       12.06547 84.42443 3.941878 84.36086 5.906357 0.6356812E-01  7.100947 
1 1 1 -20 2  10 o 186.3669 3.368073 424.0687       15.29630 429.1526       21.93094 419.2526       21.34541 187.2200 4.810929 185.0601 4.737102 2.159851       6.751679 
1 1 1 -20 2  11 o 270.8343 4.350987 896.8533       28.71624 903.2657       41.02662 890.6944       40.20756 271.3151 6.205197 269.4452 6.123520 1.869904       8.717911 
1 1 1 -20 2  12 o 194.0861 4.019208 460.3662       19.00952 444.1314       33.45729 468.1055       23.10038 189.8582 7.244741 195.5772 4.846909 -5.718994      8.716582 
1 1 1 -20 2  13 o 118.2496 2.801368 170.6289       8.072460 172.7423       11.61233 168.6525       11.22965 118.8192 4.016258 117.4130 3.930304 1.406120       5.619397 
1 1 1 -20 2  14 o 12.47849 5.272017 0.1347192      2.754245 6.018914       4.189234 -4.345159      3.655310 22.22740 6.959423 10.92470 5.170851 11.30270       8.670136 
1 1 1 -20 2  15 o 37.45798 3.754760 17.31500       3.381222 17.38537       5.086555 17.25929       4.525933 37.21543 5.797532 37.19344 5.129983 0.2198792E-01  7.741324 
1 1 1 -20 2  16 o 154.1506 3.507269 290.2747       13.17499 306.5865       23.42814 282.7303       15.93310 157.8990 6.100142 151.9752 4.306551 5.923828       7.467136 
1 1 1 -20 2  17 o 17.96743 5.905407 3.791938       2.990296 1.715075       4.669686 5.235571       3.893250 17.58186 7.086155 20.90527 6.728840 -3.323412      9.771943 
1 1 1 -20 2  18 o 73.58621 3.265692 66.26705       5.841502 66.69594       7.330250 65.52072       9.669651 73.73272 4.095740 72.88026 5.484832 0.8524628      6.845325 
1 1 1 -20 2  19 o 88.47849 2.794870 95.65651       6.018528 92.70408       8.671472 98.40067       8.360036 86.95721 4.103724 89.62881 3.836456 -2.671600      5.617734 
1 1 1 -20 2  20 o 156.0008 3.104368 297.2390       11.80147 280.0029       16.44759 315.5291       16.94304 151.1502 4.470282 160.4877 4.336225 -9.337463      6.227862 
1 1 1 -20 2  21 o 100.6799 2.802257 123.8657       6.868536 123.5291       10.01276 124.1648       9.439702 100.3771 4.102034 100.6717 3.854942 -0.2946777     5.629144 
1 1 1 -20 2  22 o 121.0405 3.365520 179.2455       9.917383 182.6060       12.49055 173.5132       16.31337 122.0310 4.206542 118.6434 5.658714 3.387642       7.050960 
1 1 1 -20 2  23 o 75.30696 2.905389 69.38946       5.321818 71.51345       7.907350 67.63076       7.195315 76.27011 4.271488 74.20641 3.993699 2.063705       5.847669 
1 1 1 -20 2  24 o 68.21252 3.455044 57.07817       5.724495 56.96626       7.316774 57.25478       9.191521 67.99673 4.439944 67.94887 5.600656 0.4785919E-01  7.147058 
1 1 1 -20 2  25 o 66.64250 3.389143 54.50033       5.485914 67.82286       10.06327 48.86704       6.543754 73.93646 5.627547 62.95560 4.291018 10.98086       7.076872 
1 1 1 -20 2  26 o 86.05290 2.923990 90.67966       6.122746 91.81310       9.057840 89.72604       8.308364 86.33679 4.318907 85.41259 4.002831 0.9242020      5.888600 
1 1 1 -20 2  27 o 91.44507 3.287761 102.5950       7.314578 98.32777       12.95736 104.5910       8.861587 88.80146 6.023352 92.19074 3.953654 -3.389282      7.205009 
1 1 1 -20 2  28 o 123.8897 2.984868 188.0208       9.011490 215.3911       13.77326 167.5347       11.91590 132.1604 4.282259 116.5672 4.201705 15.59326       5.999340 
1 1 1 -20 2  29 o 37.79495 4.872436 17.96731       4.383319 19.28057       8.948145 17.55269       5.027882 37.86480 9.665860 37.12874 5.742104 0.7360611      11.24280 
1 1 1 -20 2  30 o 40.35181 4.822808 20.48552       4.648614 24.86369       5.870908 13.12738       7.611022 44.29719 5.560903 31.38294 9.294041 12.91425       10.83064 
1 1 1 -20 2  31 o 63.57794 3.248023 49.87449       5.015568 57.35659       7.667609 44.27878       6.630952 67.75452 4.672544 59.51359 4.608056 8.240925       6.562533 
1 1 1 -20 2  32 o 45.84363 3.844289 26.20819       4.255166 19.52337       6.177329 32.24412       5.869864 38.53636 6.827911 50.57042 4.821448 -12.03405      8.358632 
1 1 1 -20 2  33 o 109.1426 3.025032 147.0206       8.037873 153.5288       11.83601 141.4502       10.95014 110.7550 4.394087 106.4052 4.231436 4.349808       6.100250 
1 1 1 -20 2  34 o 14.71000 6.020696 1.252212       3.432222 0.3141398      5.048066 2.058662       4.680535 16.31582 7.021694 17.33021 7.054364 -1.014389      9.953302 
1 1 1 -20 2  35 o 28.80951 5.710663 11.05029       3.867487 14.11235       5.821838 8.631630       5.174174 31.77499 7.617568 25.01605 7.718749 6.758938       10.84465 
1 1 1 -20 2  36 o 31.46135 6.955351 13.78462       5.190610 18.17407       7.569816 9.889241       7.131076 35.01609 8.864313 26.29725 9.118537 8.718843       12.71707 
1 1 1 -20 2  37 o 52.94517 4.375831 36.10063       5.595398 35.99815       6.791917 36.31712       9.871315 52.13424 5.425318 49.74269 8.445156 2.391552       10.03767 
1 1 1 -20 2  38 o 27.92909 5.874686 10.78741       3.871383 8.447671       5.509407 13.06955       5.441157 23.99233 8.020340 29.80294 7.499202 -5.810614      10.98016 
1 1 1 -20 2  39 f 20.93416 6.520342 6.243794       3.682359 4.165318       5.262862 8.237270       5.154126 19.03978 7.573740 23.47314 7.754780 -4.433355      10.83966 
1 1 1 -20 2  40 o 25.25588 7.558820 9.879029       5.013538 11.17767       7.337816 8.741992       6.866094 25.76561 9.222436 23.53119 8.837045 2.234421       12.77289 
1 1 1 -20 2  41 o 26.91704 6.112557 10.60769       3.917678 13.04270       5.837379 8.611996       5.284634 28.16302 8.083140 23.14891 7.855440 5.014112       11.27143 
1 1 1 -20 2  42 o 16.84811 6.552246 3.665137       3.862016 3.600588       5.423566 3.731534       5.500682 17.76624 7.445540 17.92109 7.503534 -0.1548519     10.57067 
1 1 1 -20 2  43 o 29.47964 6.259367 13.18249       4.357523 15.30708       6.536130 11.48267       5.846341 29.01832 8.617575 25.36386 8.252401 3.654461       11.93167 
1 1 1 -20 3  1  o 58.86109 2.495769 42.34254       3.571758 41.80575       4.883697 42.95987       5.237276 58.40555 3.446620 59.18865 3.648776 -0.7831039     5.019239 
1 1 1 -20 3  2  o 105.0128 2.497638 134.5286       6.391572 127.1288       8.164653 146.2413       10.27204 101.9859 3.289500 109.3296 3.861584 -7.343689      5.072734 
1 1 1 -20 3  3  o 201.3189 3.185981 494.7762       15.63017 491.3163       20.15958 499.9902       24.74829 200.4836 4.126354 202.0888 5.025355 -1.605194      6.502383 
1 1 1 -20 3  4  o 38.47123 3.327528 18.20469       3.088925 14.44888       4.797606 20.86401       4.036997 33.82185 6.042688 41.11668 4.082948 -7.294834      7.292773 
1 1 1 -20 3  5  o 17.99579 5.294951 4.028288       2.476986 1.445278       3.879658 5.805705       3.218289 16.07441 6.465856 21.44421 5.949746 -5.369795      8.786738 
1 1 1 -20 3  6  o 257.9443 3.772575 812.7904       23.71374 776.6159       36.54152 839.1085       31.16831 251.6547 5.958617 261.8591 4.884381 -10.20438      7.704693 
1 1 1 -20 3  7  o 67.03904 2.906739 54.94595       4.737361 60.09907       6.770841 50.00402       6.630641 70.01863 3.984643 63.81337 4.288813 6.205265       5.854169 
1 1 1 -20 3  8  o 131.3398 3.423588 210.7713       10.94822 207.5151       13.27255 217.7041       19.36667 130.2303 4.187656 133.1063 5.985949 -2.875961      7.305344 
1 1 1 -20 3  9  o 118.3387 2.815881 170.8777       8.120393 172.7889       11.85050 169.1859       11.14947 118.8330 4.098396 117.6101 3.895590 1.222916       5.654420 
1 1 1 -20 3  10 o 130.4669 2.887496 207.7166       9.180317 201.5859       13.16028 213.5276       12.81256 128.3479 4.213367 132.1285 3.983818 -3.780579      5.798557 
1 1 1 -20 3  11 f 87.91067 2.723156 94.38484       5.826746 84.43543       8.312570 103.9954       8.169813 83.01287 4.122060 92.20042 3.643334 -9.187546      5.501388 
1 1 1 -20 3  12 o 265.1829 4.960649 860.8135       32.05680 941.1329       59.91714 828.6021       37.94422 275.7172 8.929439 259.8988 5.991082 15.81845       10.75304 
1 1 1 -20 3  13 o 220.3915 4.343778 593.9728       23.32913 610.0219       42.29173 586.9532       27.96946 222.3197 7.818400 218.9048 5.243154 3.414932       9.413716 
1 1 1 -20 3  14 o 106.7098 2.768259 139.0470       7.192503 138.2090       10.47484 139.7945       9.893508 106.2552 4.052826 106.8933 3.804142 -0.6381149     5.558498 
1 1 1 -20 3  15 o 55.71447 3.411605 38.05246       4.609731 41.86348       8.381273 36.39961       5.519563 58.10021 6.006144 54.39964 4.196041 3.700573       7.326700 
1 1 1 -20 3  16 o 108.2339 2.778684 143.0623       7.322837 142.9155       10.71768 143.1909       10.02872 108.0362 4.078269 108.1741 3.810353 -0.1378479     5.581315 
1 1 1 -20 3  17 o 84.11994 2.747843 86.45509       5.625275 90.07980       8.378113 83.47967       7.590722 85.73592 4.021231 82.55612 3.783150 3.179794       5.521098 
1 1 1 -20 3  18 o 88.11389 3.221319 94.95197       6.905302 94.82909       8.731012 95.15720       11.28403 87.95808 4.084512 87.93454 5.290316 0.2353668E-01  6.683613 
1 1 1 -20 3  19 o 49.18759 3.440241 29.70597       4.097640 24.13442       6.138848 34.18316       5.503026 43.94417 5.880004 52.67408 4.325213 -8.729912      7.299447 
1 1 1 -20 3  20 o 53.34884 3.297421 34.90523       4.265871 35.00067       6.301460 34.82449       5.795905 53.21156 4.915105 53.13528 4.518956 0.7628632E-01  6.676767 
1 1 1 -20 3  21 o 53.54499 3.777586 35.24358       4.897482 37.93696       6.395163 31.42389       7.615825 55.42244 4.781827 50.11343 6.380802 5.309002       7.973739 
1 1 1 -20 3  22 o 71.37679 2.912244 62.33590       5.054846 70.41911       7.733449 56.30644       6.679142 75.70692 4.208369 67.69133 4.067803 8.015594       5.852981 
1 1 1 -20 3  23 o 67.89153 3.031546 56.44118       5.002868 57.06730       7.474551 55.93305       6.733570 68.06109 4.532438 67.44342 4.116644 0.6176682      6.122888 
1 1 1 -20 3  24 o 89.94794 3.320641 99.10667       7.266129 101.6957       9.395559 95.25406       11.46132 90.96394 4.250302 87.79848 5.382747 3.165459       6.858500 
1 1 1 -20 3  25 o 21.42653 6.520639 5.721900       3.708730 13.43574       7.385943 3.121217       4.288589 32.20733 9.042025 18.47188 6.973867 13.73545       11.41898 
1 1 1 -20 3  26 o 49.27090 3.523631 29.89775       4.202817 25.91029       6.312663 33.07241       5.632655 45.40361 5.840528 51.66464 4.519329 -6.261036      7.384857 
1 1 1 -20 3  27 o 127.5391 2.991915 199.1431       9.298842 206.7370       13.86027 192.9272       12.53976 129.5187 4.397779 125.2017 4.115602 4.316971       6.023176 
1 1 1 -20 3  28 o 20.84755 6.128877 5.515737       3.319827 3.672872       5.481184 6.583477       4.172154 20.37735 7.837789 22.80584 6.911044 -2.428492      10.44957 
1 1 1 -20 3  29 o 66.12094 4.145828 54.12188       6.646533 0.000000       0.000000 54.12188       6.646533 ?        ?        66.12094 4.145828 0.000000       4.145828 
1 1 1 -20 3  30 o 28.86914 7.843151 11.03336       5.659951 3.588994       8.479579 17.01509       7.601049 23.27537 9.487301 35.56717 8.814693 -12.29180      12.95020 
1 1 1 -20 3  31 o 103.7790 2.955127 132.4490       7.465848 135.6167       11.16726 129.8888       10.03921 104.4328 4.397914 102.3644 4.032412 2.068420       5.966740 
1 1 1 -20 3  32 o 14.66868 5.956300 1.265721       3.327163 1.227136       5.212075 1.292259       4.322445 17.48813 7.311859 16.27239 6.718461 1.215738       9.929804 
1 1 1 -20 3  33 o 77.45771 3.072559 74.15227       5.788133 68.79113       8.483840 78.82077       7.916853 73.88271 4.737047 79.42720 4.104144 -5.544495      6.267664 
1 1 1 -20 3  34 o 26.47981 5.826921 9.326063       3.657805 8.839671       5.340905 9.755735       5.019845 25.47839 7.838706 26.67631 7.441706 -1.197922      10.80853 
1 1 1 -20 3  35 o 37.95516 5.037275 18.67559       4.544186 19.82238       5.971289 17.09758       7.004578 38.32932 6.632971 34.58753 8.396091 3.741783       10.70003 
1 1 1 -20 3  36 o 16.85217 6.609567 2.713583       3.957107 3.429230       7.076736 2.388028       4.773050 20.58434 8.556364 17.45222 7.116343 3.132126       11.12896 
1 1 1 -20 3  37 o 41.14671 4.287097 21.84488       4.235703 25.75283       6.325586 18.66830       5.703044 43.52681 6.133434 36.64608 6.630219 6.880730       9.032100 
1 1 1 -20 3  38 o 15.17313 6.438364 1.088694       4.137531 -2.456481      4.999040 8.799101       7.372358 13.85049 6.384573 24.50380 9.166415 -10.65331      11.17076 
1 1 1 -20 3  39 o 15.81331 6.297339 2.455411       3.642408 8.033115       5.465096 -2.002394      4.885743 23.18270 7.985265 13.82586 6.350809 9.356841       10.20281 
1 1 1 -20 3  40 o 10.90793 5.228222 -4.450100      3.985413 -6.274418      5.207166 -1.870061      6.192477 12.05792 5.828809 15.39232 7.099113 -3.334406      9.185446 
1 1 1 -20 3  41 o 39.92340 4.542931 21.44544       4.341246 19.48019       6.276379 23.24808       6.011106 35.30870 7.524706 39.85926 6.405519 -4.550564      9.881896 
1 1 1 -20 3  42 o 13.42940 5.898886 0.4273682      3.718170 0.8158438      5.377933 0.7163787E-01  5.146286 15.63952 6.970234 14.91124 6.718328 0.7282782      9.680915 
1 1 1 -20 3  43 o 16.01507 6.472606 3.059806       3.908006 6.647331       5.943490 0.3274614      5.186946 20.27229 8.053607 14.93992 6.736820 5.332376       10.49978 
1 1 1 -20 4  1  o 41.61985 2.869995 21.24111       2.893013 22.68891       3.892546 19.45452       4.324071 42.92826 3.758841 39.61690 4.562151 3.311359       5.911185 
1 1 1 -20 4  2  o 171.7597 2.701696 359.9751       11.30821 354.1565       15.81407 366.0635       16.17654 170.2449 3.811829 173.0801 3.835328 -2.835175      5.407382 
1 1 1 -20 4  3  o 43.28970 3.321701 23.01590       3.477368 24.47345       5.023351 21.67479       4.818522 44.47749 4.705944 41.81096 4.817144 2.666523       6.734299 
1 1 1 -20 4  4  o 78.10958 2.767740 74.53940       5.259915 73.51979       7.572329 75.49004       7.311798 77.45598 4.025607 78.51036 3.833327 -1.054382      5.558769 
1 1 1 -20 4  5  o 181.5338 3.406678 402.4025       15.07040 408.5813       21.34436 396.2601       21.28129 182.6658 4.799172 179.8773 4.859411 2.788498       6.829783 
1 1 1 -20 4  6  o 183.1635 3.945420 409.9515       17.61036 401.0548       21.27701 429.3019       31.37904 180.9722 4.828929 186.7596 6.906680 -5.787399      8.427383 
1 1 1 -20 4  7  o 212.7280 3.305512 552.4951       17.13561 547.4695       27.12388 555.8331       22.10563 211.4324 5.264343 213.2292 4.254223 -1.796799      6.768435 
1 1 1 -20 4  8  o 102.9997 2.475557 129.4102       6.213626 130.2535       10.23706 128.9183       7.818618 103.1551 4.080432 102.7220 3.127062 0.4330826      5.140860 
1 1 1 -20 4  9  o 131.5374 2.903070 211.1454       9.305565 214.9533       13.60606 207.7988       12.75522 132.5371 4.218054 130.3362 4.020744 2.200928       5.827380 
1 1 1 -20 4  10 o 236.0603 3.935447 680.9348       22.63879 694.8204       32.73045 668.1987       31.34653 238.0934 5.641161 233.5197 5.508457 4.573715       7.884529 
1 1 1 -20 4  11 o 103.6978 2.750410 131.3012       6.944157 133.6282       10.30685 129.3668       9.397119 104.4840 4.055696 102.8358 3.756163 1.648193       5.527878 
1 1 1 -20 4  12 o 240.6766 3.986886 707.9323       23.38319 744.9678       34.41881 676.1865       31.86616 246.4942 5.729980 234.8805 5.567326 11.61366       7.989229 
1 1 1 -20 4  13 o 86.52923 3.209462 91.53729       6.755818 76.71117       13.19799 96.80141       7.864238 78.67730 6.955269 88.94430 3.635959 -10.26700      7.848310 
1 1 1 -20 4  14 o 92.62935 3.028065 104.8487       6.825993 111.9479       12.51641 101.8434       8.143636 95.42318 5.404669 91.22813 3.670634 4.195045       6.533300 
1 1 1 -20 4  15 o 68.22208 3.210978 56.95555       5.323264 61.03251       9.927239 55.31013       6.306638 70.28851 5.848676 67.16068 3.869809 3.127831       7.013019 
1 1 1 -20 4  16 o 263.1047 4.261012 846.7578       27.31980 870.3311       39.62201 825.3932       37.72017 266.1954 6.108012 259.2783 5.969960 6.917114       8.540974 
1 1 1 -20 4  17 o 85.26244 2.788714 88.82640       5.786463 90.43221       8.684237 87.54417       7.760109 85.88393 4.161772 84.54490 3.776083 1.339035       5.619534 
1 1 1 -20 4  18 o 100.4237 3.281623 123.3179       8.020054 124.9961       10.22338 120.6325       12.93241 100.9966 4.162780 99.02499 5.379381 1.971581       6.801947 
1 1 1 -20 4  19 o 132.7713 3.424428 215.5459       11.07047 223.4541       14.07845 202.7339       17.91940 135.0541 4.283119 128.3511 5.743670 6.703064       7.164834 
1 1 1 -20 4  20 o 111.1954 2.848853 151.0701       7.713212 133.8524       10.93658 168.1097       10.87990 104.4729 4.304999 117.1780 3.815242 -12.70502      5.752312 
1 1 1 -20 4  21 o 70.62822 2.953020 61.03582       5.071326 56.10494       7.571521 65.04771       6.829601 67.49718 4.631282 72.81097 3.862952 -5.313782      6.030852 
1 1 1 -20 4  22 o 63.75588 3.087096 49.78720       4.782046 43.00625       7.225556 55.07224       6.378961 58.96537 5.077912 66.95890 3.926592 -7.993526      6.418981 
1 1 1 -20 4  23 o 67.42243 3.531072 55.76934       5.781369 54.28341       7.524707 57.91040       9.032428 66.34215 4.684525 68.38831 5.465286 -2.046165      7.198203 
1 1 1 -20 4  24 o 67.93556 2.990196 56.52940       4.938189 62.28226       7.727880 52.55912       6.419911 71.09202 4.483540 65.35574 4.050878 5.736275       6.042495 
1 1 1 -20 4  25 o 34.33062 4.473145 14.71842       3.653323 12.88285       6.019496 15.78882       4.596725 31.50547 7.865221 35.36957 5.512788 -3.864098      9.604817 
1 1 1 -20 4  26 o 139.3890 3.463239 238.0842       11.76378 241.6331       21.33419 236.5338       14.10124 139.3825 6.297307 138.6947 4.176922 0.6877899      7.556636 
1 1 1 -20 4  27 o 17.00844 6.197960 2.967618       3.332582 4.164205       5.428440 2.243867       4.221800 20.85960 7.852492 17.33370 6.818420 3.525904       10.39964 
1 1 1 -20 4  28 o 119.8163 3.416338 176.3499       9.964817 189.2173       19.38280 171.7272       11.61771 122.8297 6.498682 118.0419 4.044737 4.787842       7.654591 
1 1 1 -20 4  29 o 48.53550 3.991204 29.22478       4.678952 23.35596       10.13379 30.81491       5.274871 41.49136 10.11546 49.75456 4.395704 -8.263199      11.02927 
1 1 1 -20 4  30 o 101.1243 4.136019 126.6284       10.17083 128.6008       14.77511 124.8519       14.02189 101.0093 6.029963 99.64563 5.799535 1.363663       8.366305 
1 1 1 -20 4  31 o 56.16460 3.425905 39.02631       4.666628 38.98631       7.266483 39.05440       6.088020 55.50614 5.442004 55.87814 4.509198 -0.3720016     7.067409 
1 1 1 -20 4  32 o 76.49769 3.040360 72.19289       5.656445 76.08124       8.689375 69.33356       7.451406 77.92496 4.596306 74.58266 4.115772 3.342308       6.169734 
1 1 1 -20 4  33 o 30.72304 5.120261 12.20354       3.698626 12.89900       5.837482 11.73710       4.780680 30.69201 7.792157 29.56895 6.779594 1.123064       10.32863 
1 1 1 -20 4  34 o 57.51447 3.449538 41.24170       4.812533 43.07163       7.316550 39.84623       6.389215 57.94279 5.238201 55.97669 4.728033 1.966106       7.056418 
1 1 1 -20 4  35 o 38.80917 5.071082 19.55033       4.681300 20.58825       6.270598 18.24355       7.036037 38.91300 6.863455 35.79628 8.237135 3.116722       10.72182 
1 1 1 -20 4  36 o 16.09832 6.507697 2.049733       3.951480 6.167050       7.020771 0.1407591      4.780548 22.69246 8.831762 15.50803 6.752904 7.184427       11.11763 
1 1 1 -20 4  37 o 11.82080 5.359497 -1.373755      3.336203 -3.077578      5.174783 -0.1618543     4.364288 13.84896 6.423113 14.53325 6.387088 -0.6842842     9.058216 
1 1 1 -20 4  38 o 23.16574 6.445712 7.625407       3.771328 9.437755       5.501295 6.018502       5.180111 25.12097 7.989633 21.09978 7.721300 4.021193       11.11093 
1 1 1 -20 4  39 o 17.30524 7.217110 2.496748       5.058869 3.877531       7.632704 1.414975       6.755909 20.36780 8.697006 18.10460 7.952003 2.263197       11.78441 
1 1 1 -20 4  40 o 14.50332 6.311460 0.6341396      4.170459 -0.5539803     5.464336 2.291789       6.454366 15.27194 6.897977 18.09818 7.864034 -2.826241      10.46065 
1 1 1 -20 4  41 o 41.01921 4.584426 22.69804       4.504292 29.26166       6.803227 17.57530       6.010277 44.68904 6.432110 33.37966 7.564388 11.30938       9.929351 
1 1 1 -20 4  42 o 12.67019 5.694613 -0.4098252     3.671857 3.256201       5.424590 -3.509954      4.988374 17.44425 7.385742 12.68485 6.014724 4.759408       9.525024 
1 1 1 -20 4  43 o 22.87216 6.796908 8.378535       4.064971 10.08663       6.087135 7.003685       5.461150 23.57766 8.404215 20.58058 7.846493 2.997080       11.49775 
1 1 1 -20 5  1  o 189.2901 2.851352 437.3083       13.15270 438.2502       18.53516 436.3531       18.66699 189.3383 4.017185 188.9222 4.054667 0.4161072      5.707723 
1 1 1 -20 5  2  o 76.60638 2.348515 71.65113       4.379063 67.29148       5.930043 76.87975       6.494195 74.16213 3.289437 79.27197 3.369468 -5.109833      4.708897 
1 1 1 -20 5  3  o 87.80575 2.916654 94.20078       6.232192 92.60820       8.556554 96.00027       9.095406 86.94746 4.049491 88.50770 4.229249 -1.560234      5.855333 
1 1 1 -20 5  4  o 160.8108 3.769202 315.9572       14.77069 305.5911       17.78017 339.0440       26.53442 157.9749 4.623590 165.9923 6.572717 -8.017426      8.036056 
1 1 1 -20 5  5  o 248.3731 4.132225 754.0983       25.01063 768.6219       35.95977 740.4894       34.80903 250.3331 5.894711 245.7314 5.812930 4.601669       8.278754 
1 1 1 -20 5  6  o 150.8124 2.766991 277.5293       10.16906 291.7050       16.66352 269.1172       12.83645 154.3782 4.433991 148.4400 3.548607 5.938217       5.679163 
1 1 1 -20 5  7  o 241.3242 3.602258 711.3241       21.18419 726.1099       34.16632 702.0899       27.00078 243.3579 5.761248 239.5635 4.625083 3.794449       7.388056 
1 1 1 -20 5  8  o 89.13728 2.484033 96.99847       5.390501 97.22163       8.893703 96.86889       6.777214 89.09095 4.107553 89.02723 3.128728 0.6372070E-01  5.163423 
1 1 1 -20 5  9  o 99.38315 2.760875 120.6119       6.679972 125.8467       10.01416 116.4153       8.966275 101.3906 4.061258 97.54254 3.779240 3.848053       5.547654 
1 1 1 -20 5  10 o 170.7734 3.240890 356.0517       13.48716 356.2242       19.57658 355.8958       18.60773 170.5608 4.714528 170.5228 4.481790 0.3799438E-01  6.504860 
1 1 1 -20 5  11 o 161.0059 3.145794 316.4564       12.34264 335.6611       18.46565 300.9471       16.59421 165.5810 4.580737 156.8163 4.346587 8.764771       6.314743 
1 1 1 -20 5  12 o 9.920862 4.582837 -2.127929      2.595356 2.920219       4.514866 -4.619378      3.171793 18.63255 7.126884 9.685222 4.647951 8.947330       8.508579 
1 1 1 -20 5  13 o 187.6337 4.712337 431.1425       21.52978 0.000000       0.000000 431.1425       21.52978 ?        ?        187.6337 4.712337 0.000000       4.712337 
1 1 1 -20 5  14 o 136.7018 3.331159 228.2142       11.09701 217.5212       19.46406 233.3638       13.50731 132.9856 6.021726 138.1064 4.017729 -5.120850      7.239014 
1 1 1 -20 5  15 f 259.2090 4.221642 821.7590       26.66660 801.3439       37.67949 842.2453       37.74512 255.4618 6.052613 261.9463 5.913064 -6.484421      8.461587 
1 1 1 -20 5  16 o 84.17848 2.798026 86.58379       5.731720 91.57677       8.844003 82.96784       7.526262 86.42331 4.212033 82.30468 3.762434 4.118629       5.647755 
1 1 1 -20 5  17 o 70.96020 2.893166 61.57189       4.992437 57.96902       7.573700 64.34035       6.639015 68.66454 4.551958 72.45221 3.773246 -3.787666      5.912504 
1 1 1 -20 5  18 o 81.12295 3.383966 80.54153       6.674997 77.56189       8.537699 85.22661       10.70575 79.47911 4.425579 83.19086 5.308567 -3.711746      6.911340 
1 1 1 -20 5  19 o 67.14568 3.527052 55.25506       5.750960 53.39779       7.424049 58.04173       9.093817 65.86055 4.655727 68.54701 5.489902 -2.686462      7.198251 
1 1 1 -20 5  20 o 96.48198 2.809644 113.7589       6.598889 107.5345       9.798391 118.9252       8.926856 93.61359 4.306703 98.54153 3.724135 -4.927940      5.693581 
1 1 1 -20 5  21 o 53.26582 3.236323 34.80236       4.181022 32.43916       6.480999 36.48698       5.471961 51.12626 5.277662 54.42970 4.156894 -3.303440      6.718146 
1 1 1 -20 5  22 o 80.66399 2.920115 79.59644       5.730579 81.92712       8.808852 77.88631       7.545544 81.62719 4.445191 79.66730 3.898478 1.959892       5.912517 
1 1 1 -20 5  23 o 59.90159 3.682210 44.08829       5.349080 43.64605       7.137611 44.65490       8.079045 59.39444 4.977138 59.96373 5.593379 -0.5692902     7.487175 
1 1 1 -20 5  24 o 104.4837 2.885347 133.5422       7.339504 116.2818       10.65565 149.1232       10.12400 97.20901 4.510483 110.2642 3.773302 -13.05524      5.880668 
1 1 1 -20 5  25 o 105.5478 2.888499 136.3306       7.422483 135.7164       11.20223 136.8112       9.910087 105.0127 4.387167 105.5546 3.859186 -0.5419083     5.842992 
1 1 1 -20 5  26 o 67.56520 3.389591 56.07638       5.563105 52.28410       10.31724 57.63092       6.605642 64.48361 6.661439 68.39396 3.980541 -3.910347      7.760121 
1 1 1 -20 5  27 o 164.7621 3.283571 332.7988       13.18378 327.0585       19.30195 337.8188       18.05027 162.6679 4.874761 165.5070 4.479514 -2.839035      6.620374 
1 1 1 -20 5  28 o 50.12439 3.905160 31.09908       4.732446 27.54146       10.18977 32.07749       5.343719 45.47825 9.501204 50.81573 4.357303 -5.337482      10.45270 
1 1 1 -20 5  29 o 68.78570 3.035631 58.16359       5.075891 62.07493       8.130769 55.66575       6.497563 70.62289 4.752100 67.07254 3.993376 3.550354       6.207213 
1 1 1 -20 5  30 o 88.24310 3.556116 96.09721       7.631368 97.49040       9.815686 93.96819       12.13400 88.52010 4.565755 86.35738 5.799544 2.162720       7.381113 
1 1 1 -20 5  31 o 135.3105 3.470553 226.0256       11.43425 244.9168       21.23110 218.3077       13.57042 138.8179 6.292475 132.5751 4.205765 6.242844       7.568599 
1 1 1 -20 5  32 o 16.20853 6.095245 2.591707       3.268840 -0.8938217     5.351048 4.666767       4.128761 16.01990 7.055249 19.84737 6.934912 -3.827469      9.892903 
1 1 1 -20 5  33 o 52.16456 3.614019 33.93504       4.565715 32.83773       7.034752 34.73366       6.001448 50.39998 5.835418 52.34568 4.756666 -1.945705      7.528478 
1 1 1 -20 5  34 o 29.18220 5.401551 11.19235       3.699812 16.11393       5.934776 8.063672       4.731864 34.28269 7.326151 24.36294 7.355156 9.919750       10.38127 
1 1 1 -20 5  35 o 23.10899 6.870660 7.302964       4.152857 9.848778       5.659238 4.332500       6.113033 26.41110 8.058276 20.68920 8.184109 5.721897       11.48545 
1 1 1 -20 5  36 o 20.72308 6.826317 5.772329       3.994812 4.558180       7.388909 6.273813       4.748676 21.57179 8.832040 21.62962 7.443762 -0.5782509E-01 11.55052 
1 1 1 -20 5  37 o 13.11212 5.738891 -0.1576459     3.491005 -1.898699      5.335028 1.146064       4.616589 14.74476 6.721164 15.93875 6.783462 -1.193992      9.549314 
1 1 1 -20 5  38 o 16.36382 6.375010 2.825837       3.660938 -1.427669      5.304509 6.694592       5.058914 14.86343 6.746543 21.78985 7.671635 -6.926414      10.21616 
1 1 1 -20 5  39 f 34.83445 5.617144 16.72302       4.606120 16.22789       8.433270 16.93353       5.498761 30.57232 9.908759 34.13583 6.848664 -3.563515      12.04524 
1 1 1 -20 5  40 o 17.52073 6.921634 3.633147       4.367254 3.369646       5.730572 3.998216       6.745185 18.28468 7.657450 19.43594 8.232726 -1.151257      11.24341 
1 1 1 -20 5  41 o 16.74960 6.849612 3.064640       4.437626 -0.5246401     5.779937 8.218213       6.925859 15.37157 7.002605 22.36295 8.752115 -6.991383      11.20875 
1 1 1 -20 5  42 o 13.07335 5.791792 0.1351189      3.657601 -6.007641      5.562807 4.813164       4.854498 12.35989 5.986736 18.51081 7.302275 -6.150926      9.442681 
1 1 1 -20 5  43 o 12.04434 5.539782 -1.245790      3.734553 5.910911       5.830977 -6.223181      4.862793 19.54828 7.904232 11.22466 5.473274 8.323624       9.614240 
1 1 1 -20 6  1  o 142.0423 2.772974 246.2317       9.598413 238.3689       12.02661 260.0271       15.93025 139.6408 3.537076 145.7076 4.491830 -6.066803      5.717293 
1 1 1 -20 6  2  o 208.1477 3.737400 529.4103       18.95733 547.0834       27.18631 512.6837       26.44835 211.2929 5.279943 204.4674 5.312594 6.825562       7.490090 
1 1 1 -20 6  3  o 143.7367 2.768914 252.1223       9.698696 245.2111       15.28975 256.7755       12.54577 141.5131 4.439205 144.9851 3.550894 -3.471970      5.684663 
1 1 1 -20 6  4  o 232.7374 3.540731 661.6302       20.08146 670.7061       32.17408 655.8382       25.70248 233.8822 5.645116 231.5287 4.555479 2.353516       7.253945 
1 1 1 -20 6  5  o 159.2351 3.196591 309.5640       12.40401 306.3511       17.65145 312.6984       17.43440 158.1746 4.584226 159.8236 4.480834 -1.649002      6.410382 
1 1 1 -20 6  6  o 49.83515 2.946797 30.41689       3.562699 35.71741       5.950869 27.45569       4.447902 53.84113 4.578951 47.24070 3.898362 6.600433       6.013652 
1 1 1 -20 6  7  o 211.7771 3.683797 547.8970       19.01125 571.8776       27.95968 527.2763       25.92716 216.0582 5.310377 207.4999 5.127445 8.558304       7.381788 
1 1 1 -20 6  8  o 110.2341 2.532671 148.2430       6.803473 165.2571       11.65307 139.4444       8.379981 116.1976 4.121882 106.8236 3.222825 9.374031       5.232257 
1 1 1 -20 6  9  o 46.45175 3.009091 26.44699       3.387898 28.15408       5.949492 25.62781       4.121376 47.66594 5.206522 45.64896 3.737585 2.016972       6.409167 
1 1 1 -20 6  10 o 173.7401 3.279640 368.5643       13.88553 370.9861       20.20547 366.3970       19.11415 174.0435 4.768531 173.0049 4.537698 1.038589       6.582522 
1 1 1 -20 6  11 o 77.54111 2.806453 73.46989       5.294306 70.04492       8.145985 75.97465       6.966233 75.54422 4.444566 78.77833 3.638561 -3.234108      5.743978 
1 1 1 -20 6  12 o 104.7480 3.082494 134.0597       7.859794 142.1630       14.38976 130.6142       9.383148 107.5510 5.508739 103.3249 3.732686 4.226051       6.654259 
1 1 1 -20 6  13 o 241.5685 4.586027 714.0981       26.99684 754.5876       48.88127 696.3268       32.38393 247.0591 8.130130 238.2986 5.576633 8.760483       9.858897 
1 1 1 -20 6  14 o 73.15144 3.268167 65.47689       5.811192 83.48232       13.02631 61.00319       6.493117 82.14760 6.561652 70.54998 3.790687 11.59762       7.577901 
1 1 1 -20 6  15 o 128.8479 2.923503 202.6619       9.179455 209.3891       13.86496 197.4121       12.24826 130.7482 4.357665 127.0077 3.962232 3.740471       5.889696 
1 1 1 -20 6  16 o 173.0227 3.277369 365.6512       13.81862 359.2580       20.06550 371.4188       19.05833 171.1967 4.814487 174.1389 4.494859 -2.942215      6.586580 
1 1 1 -20 6  17 o 126.4367 3.446609 195.4687       10.60953 192.3260       13.47551 200.5934       17.20801 125.2735 4.421110 127.7329 5.541484 -2.459412      7.089024 
1 1 1 -20 6  18 o 15.89595 5.887407 2.409442       3.026745 3.899024       5.336609 1.703044       3.675004 20.67219 7.784956 16.00718 6.341290 4.665012       10.04079 
1 1 1 -20 6  19 o 147.1908 3.594025 264.8578       12.89133 243.3079       15.66008 310.1613       22.70578 140.8590 4.568231 158.7351 5.880017 -17.87611      7.446028 
1 1 1 -20 6  20 o 46.28603 3.518513 26.34379       3.938938 32.87960       6.705890 22.90095       4.867045 51.45712 5.429559 42.96547 4.726437 8.491650       7.198563 
1 1 1 -20 6  21 o 58.78434 3.143061 42.34925       4.486098 38.90786       7.085144 44.65216       5.795895 56.03782 5.249485 60.26530 3.968633 -4.227482      6.580816 
1 1 1 -20 6  22 o 80.39278 3.428360 79.19234       6.701026 76.19171       8.736385 83.48061       10.44396 78.67818 4.576358 82.24326 5.238320 -3.565079      6.955792 
1 1 1 -20 6  23 o 70.75130 2.936123 61.28556       5.051263 55.42690       7.902703 65.33254       6.568137 66.98815 4.874426 72.95272 3.706724 -5.964569      6.123711 
1 1 1 -20 6  24 o 76.40829 2.899032 71.47701       5.388168 77.47575       8.630013 67.64471       6.897801 79.29785 4.484225 74.19518 3.827981 5.102676       5.895906 
1 1 1 -20 6  25 o 112.3462 2.902845 154.4758       7.940619 147.0713       11.91064 160.3999       10.65366 109.2809 4.482060 114.2944 3.830467 -5.013557      5.895875 
1 1 1 -20 6  26 f 63.22839 3.932178 49.28652       6.028741 0.000000       0.000000 49.28652       6.028741 ?        ?        63.22839 3.932178 0.000000       3.932178 
1 1 1 -20 6  27 o 54.53704 3.347339 36.61596       4.427208 32.83459       7.156532 38.96021       5.634828 51.08025 5.854979 56.11139 4.150292 -5.031132      7.176747 
1 1 1 -20 6  28 o 123.5527 3.419988 187.6185       10.28715 196.7074       20.41792 184.5264       11.90914 124.9854 6.728530 122.3354 4.000149 2.649948       7.827791 
1 1 1 -20 6  29 o 99.41623 2.935181 121.3520       7.103176 126.5524       11.19583 117.8484       9.189512 100.9862 4.561217 97.69499 3.867614 3.291214       5.980228 
1 1 1 -20 6  30 o 125.9616 3.584541 195.7787       10.99173 200.6750       14.12635 188.2656       17.49888 127.0320 4.570767 122.2221 5.892586 4.809944       7.457512 
1 1 1 -20 6  31 o 13.79403 5.688612 0.8448008      3.094057 -0.4682811     5.181873 1.572312       3.857097 16.12579 7.026147 15.87653 6.425374 0.2492628      9.521144 
1 1 1 -20 6  32 o 28.12826 5.496176 10.31991       3.632244 6.053569       5.782558 13.10022       4.668082 22.66674 8.177771 31.51011 6.299628 -8.843378      10.32285 
1 1 1 -20 6  33 o 27.58163 6.136278 10.13807       4.017991 17.00496       7.966938 7.795664       4.653096 34.54406 9.271302 24.12013 7.296229 10.42393       11.79797 
1 1 1 -20 6  34 o 22.47586 6.244799 6.791514       3.542655 6.255238       5.656632 7.137606       4.544222 22.44125 8.089310 23.05715 7.252427 -0.6158962     10.86437 
1 1 1 -20 6  35 o 31.63767 6.139921 13.52226       4.562955 17.47041       6.314851 9.208696       6.600617 35.25928 7.575343 25.65359 8.777774 9.605692       11.59462 
1 1 1 -20 6  36 o 27.12151 6.422330 10.22358       4.178668 18.14973       7.956998 7.205197       4.910270 34.39071 9.280972 22.77738 7.570681 11.61333       11.97713 
1 1 1 -20 6  37 o 10.20307 4.865389 -3.839437      3.357949 -5.472587      5.285436 -2.734090      4.348276 12.78851 6.099885 12.69877 5.889038 0.8974171E-01  8.478760 
1 1 1 -20 6  38 o 33.14031 5.444892 14.92876       4.244681 13.80987       6.128022 15.96070       5.885115 30.00043 8.165405 32.83415 7.517622 -2.833725      11.09903 
1 1 1 -20 6  39 o 17.66556 6.864110 3.688906       4.235500 3.209458       7.608959 3.904164       5.098409 19.77312 8.565435 18.52494 7.425773 1.248175       11.33617 
1 1 1 -20 6  40 o 11.92929 5.594887 -2.847613      4.106688 -2.229748      5.369524 -3.718366      6.374361 14.11410 6.544969 14.60843 6.888393 -0.4943266     9.501925 
1 1 1 -20 6  41 o 18.15318 6.606257 4.675430       3.784327 12.87030       5.988292 -0.7734066     4.882968 27.52016 8.266673 14.15904 6.444847 13.36113       10.48208 
1 1 1 -20 6  42 o 41.94806 5.434922 25.01591       5.425263 31.89520       7.118030 15.47969       8.380624 46.05386 6.524946 27.55328 9.856724 18.50059       11.82074 
1 1 1 -20 6  43 o 31.95611 5.927655 15.19106       4.446154 22.29210       7.061406 10.52667       5.723047 35.93830 8.239285 24.22711 8.175054 11.71119       11.60678 
1 1 1 -20 7  1  o 82.65850 2.370416 83.41943       4.769793 82.95140       6.527970 83.95549       6.986347 82.35128 3.259345 82.82790 3.468965 -0.4766159     4.759942 
1 1 1 -20 7  2  f 239.8726 3.638886 703.0459       21.27087 719.7888       34.27515 692.5586       27.12657 242.1886 5.807505 237.8593 4.679923 4.329300       7.458471 
1 1 1 -20 7  3  o 228.9904 3.524502 640.5553       19.66759 636.3905       31.19003 643.3044       25.34059 227.7946 5.618704 229.2884 4.535223 -1.493744      7.220670 
1 1 1 -20 7  4  o 99.88421 2.588376 121.8095       6.294978 128.1629       10.28859 118.0081       7.958443 102.2996 4.135635 98.24644 3.328916 4.053131       5.308970 
1 1 1 -20 7  5  o 287.0834 4.131883 1007.643       28.90628 976.4489       45.17342 1029.272       37.61577 281.8684 6.576585 289.8213 5.326030 -7.952850      8.462746 
1 1 1 -20 7  6  o 141.9747 3.072154 246.0606       10.62894 247.8763       15.35604 244.3906       14.72687 142.2851 4.434189 141.3034 4.281770 0.9817505      6.164056 
1 1 1 -20 7  7  f 58.74925 2.789228 42.21351       3.981808 42.22867       6.800996 42.20560       4.911623 58.54259 4.809587 58.68516 3.449692 -0.1425743     5.918826 
1 1 1 -20 7  8  o 163.1355 2.877609 324.7986       11.43974 324.1461       18.60378 325.1954       14.50652 162.6832 4.697616 163.1540 3.648626 -0.4708252     5.948114 
1 1 1 -20 7  9  o 145.5793 2.743561 258.6159       9.733079 250.5619       15.75552 263.5863       12.37724 143.0399 4.525707 146.9070 3.457365 -3.867142      5.695208 
1 1 1 -20 7  10 o 96.62553 2.712846 114.0176       6.381504 119.6727       13.02747 112.2322       7.319860 98.66492 5.439325 95.82863 3.138757 2.836296       6.279972 
1 1 1 -20 7  11 o 238.0405 4.531088 693.2963       26.28388 705.2822       46.28796 687.5925       31.93112 238.9268 7.961115 236.8174 5.533048 2.109451       9.695049 
1 1 1 -20 7  12 o 111.2379 2.847337 151.1204       7.712063 153.3355       11.78815 149.4629       10.19706 111.8807 4.331874 110.5262 3.791552 1.354469       5.756822 
1 1 1 -20 7  13 o 179.4821 3.345233 393.4388       14.63132 394.3988       21.44330 392.6026       20.01417 179.3900 4.909822 179.0462 4.590869 0.3438416      6.721788 
1 1 1 -20 7  14 o 58.34702 3.479512 41.73687       4.924884 40.84805       10.90572 41.96455       5.519766 56.95319 8.084682 58.46104 3.896768 -1.507847      8.974792 
1 1 1 -20 7  15 o 36.64684 4.019056 16.61816       3.530378 13.33123       6.024102 18.33756       4.356981 32.22465 7.763721 38.40797 4.756667 -6.183323      9.105012 
1 1 1 -20 7  16 o 100.4932 3.354083 123.5070       8.202339 122.8378       10.69994 124.4607       12.77322 100.0871 4.397733 100.6161 5.227437 -0.5290070     6.831263 
1 1 1 -20 7  17 o 158.6958 3.167533 307.5973       12.24963 312.1407       18.29880 303.9081       16.48933 159.5629 4.711189 157.5240 4.299583 2.038834       6.378222 
1 1 1 -20 7  18 o 85.46227 2.808337 89.26530       5.840762 91.30148       9.337646 87.95657       7.486059 86.23454 4.458587 84.74532 3.633385 1.489220       5.751564 
1 1 1 -20 7  19 f 82.37455 3.413386 83.08041       6.837111 79.67382       8.960138 87.82860       10.57837 80.50644 4.586150 84.44218 5.165427 -3.935738      6.907562 
1 1 1 -20 7  20 o 55.07014 3.193437 37.18518       4.267207 37.58596       6.963163 36.94414       5.400038 55.07609 5.251588 54.78288 4.074142 0.2932129      6.646639 
1 1 1 -20 7  21 o 29.06292 6.033760 10.78611       4.133317 6.339391       5.856435 15.19945       5.834413 23.75556 8.262014 34.42279 7.187664 -10.66724      10.95095 
1 1 1 -20 7  22 o 40.27583 4.546158 20.15139       4.384071 23.50634       6.329600 17.05779       6.078072 43.22209 6.185592 36.50838 7.087453 6.713711       9.407100 
1 1 1 -20 7  23 o 121.5727 2.931889 180.6698       8.685997 194.0414       13.50727 171.2413       11.34216 125.6575 4.417934 118.1386 3.945278 7.518913       5.923120 
1 1 1 -20 7  24 o 92.06107 2.874299 103.7264       6.440382 106.4655       10.13558 101.8716       8.340692 92.97630 4.486668 91.08844 3.765652 1.887856       5.857502 
1 1 1 -20 7  25 o 62.22844 3.509591 47.60764       5.300510 60.49789       11.79964 44.34896       5.932789 69.30521 7.086251 59.95717 4.084917 9.348042       8.179334 
1 1 1 -20 7  26 o 81.70752 3.229743 81.93533       6.418149 81.63170       12.63362 82.04095       7.451315 80.68660 6.479689 81.65718 3.754623 -0.9705811     7.488896 
1 1 1 -20 7  27 o 80.49838 3.327746 79.63451       6.513823 91.88774       14.18749 76.36169       7.332314 85.33505 6.880768 78.71354 3.834105 6.621513       7.876886 
1 1 1 -20 7  28 o 46.23642 3.663683 26.45794       4.094265 24.37800       6.902470 27.58698       5.085505 43.57523 6.715683 47.03984 4.490860 -3.464611      8.078876 
1 1 1 -20 7  29 o 37.24480 4.180848 17.35352       3.729165 8.021102       6.143137 22.79938       4.692739 25.37781 8.468777 42.65134 4.587014 -17.27353      9.631245 
1 1 1 -20 7  30 o 59.84785 3.943779 44.48304       5.719656 40.23267       7.494714 50.41103       8.851064 56.38801 5.525052 63.04993 5.826576 -6.661922      8.029644 
1 1 1 -20 7  31 o 41.00543 4.039540 21.05849       3.984181 23.73723       6.549017 19.48455       5.020019 42.70750 6.497229 39.00396 5.428441 3.703541       8.466519 
1 1 1 -20 7  32 o 72.79245 3.074250 65.48805       5.441050 66.72902       8.545095 64.64180       7.056455 72.72525 4.849356 71.95166 4.040714 0.7735901      6.312181 
1 1 1 -20 7  33 o 15.42868 6.060782 1.998133       3.331758 5.310011       5.800382 0.3673591      4.070205 21.68328 8.126664 14.87041 6.350328 6.812874       10.31355 
1 1 1 -20 7  34 o 30.32836 7.102956 12.67909       5.156782 13.97062       8.049229 11.77996       6.716058 30.87065 9.643999 28.71950 8.781601 2.151152       13.04313 
1 1 1 -20 7  35 o 29.30496 5.677300 11.51816       3.907871 12.43559       6.353644 10.95992       4.956206 29.20117 8.448996 27.90261 7.230673 1.298561       11.12062 
1 1 1 -20 7  36 f 28.82792 6.223456 11.48347       4.243765 5.248922       8.040177 13.89114       4.996449 22.33976 9.187056 31.50003 6.714356 -9.160273      11.37913 
1 1 1 -20 7  37 o 16.96608 6.403690 3.293053       3.615454 0.6160117      5.411197 5.451843       4.859269 16.45543 7.174692 20.40845 7.476741 -3.953020      10.36233 
1 1 1 -20 7  38 o 10.16816 4.888473 -4.485365      3.544569 -8.283692      5.267224 -1.341552      4.791969 11.53016 5.638220 14.14182 6.416360 -2.611658      8.541616 
1 1 1 -20 7  39 o 19.96104 7.048666 5.638657       4.273068 5.999260       8.005561 5.494988       5.053092 21.72597 9.071193 20.04584 7.569567 1.680126       11.81460 
1 1 1 -20 7  40 o 14.72764 6.503300 0.3817420      4.574974 -4.103502      5.676459 8.695560       7.728312 13.54198 6.419689 23.14101 9.186708 -9.599027      11.20750 
1 1 1 -20 7  41 o 15.81678 6.341511 2.807377       3.719034 4.308193       5.873065 1.802709       4.805208 18.68129 7.782451 15.87998 6.842578 2.801309       10.36279 
1 1 1 -20 7  42 o 13.51853 5.972705 0.3862142      3.864017 -3.838426      6.130654 3.170522       4.977034 13.86387 6.600675 16.95878 7.121432 -3.094911      9.709980 
1 1 1 -20 8  1  o 229.4601 3.555680 643.3647       19.88227 635.9023       31.41677 648.3500       25.67873 227.6286 5.663680 230.1321 4.578890 -2.503571      7.283097 
1 1 1 -20 8  2  o 180.2365 3.094723 396.6475       13.59253 432.7512       22.55935 376.0704       17.03109 187.8935 4.931220 175.3779 3.985028 12.51561       6.340140 
1 1 1 -20 8  3  o 64.51241 2.821541 50.89320       4.425008 56.04955       7.250548 47.83270       5.585929 67.53846 4.429835 62.45667 3.686518 5.081787       5.763147 
1 1 1 -20 8  4  o 252.5096 3.767874 779.2224       23.18517 804.6658       37.69289 763.7365       29.40626 255.9988 6.042066 249.7476 4.831728 6.251190       7.736417 
1 1 1 -20 8  5  o 156.5084 2.864884 298.9669       10.92649 289.5482       17.49270 304.9929       13.99182 153.7354 4.674681 157.9957 3.634067 -4.260345      5.921072 
1 1 1 -20 8  6  o 95.75418 2.916957 112.0171       6.798563 122.2213       10.21090 103.8912       9.111919 99.88491 4.204363 92.09290 4.070257 7.792007       5.851808 
1 1 1 -20 8  7  o 112.3250 2.599106 153.9434       7.114369 163.6925       12.07023 148.7535       8.806757 115.6101 4.291788 110.3217 3.279454 5.288429       5.401320 
1 1 1 -20 8  8  o 123.7577 2.644668 186.8850       7.975896 188.1406       13.42465 186.2001       9.915654 123.9307 4.452403 123.4376 3.299341 0.4930496      5.541619 
1 1 1 -20 8  9  o 60.95481 2.922853 45.45471       4.328960 47.43641       9.005888 44.85925       4.936689 61.87392 6.050093 60.51369 3.360898 1.360222       6.920929 
1 1 1 -20 8  10 o 277.9943 5.107230 946.7407       34.59851 915.6765       59.10279 962.9359       42.67480 271.7463 8.937157 279.9841 6.254637 -8.237762      10.90840 
1 1 1 -20 8  11 o 65.94360 3.039930 53.20020       4.871945 52.28649       7.819645 53.77992       6.228590 65.15280 4.962464 66.21931 3.876794 -1.066505      6.297268 
1 1 1 -20 8  12 o 46.07452 3.430630 26.07393       3.824219 32.09125       6.384906 22.70769       4.775566 50.90924 5.220485 42.82245 4.650937 8.086792       6.991758 
1 1 1 -20 8  13 o 67.64069 2.922050 55.95593       4.805141 57.87855       7.864763 54.81078       6.069756 68.59109 4.734283 66.86333 3.740086 1.727760       6.033381 
1 1 1 -20 8  14 f 83.51838 3.225487 85.31710       6.552339 98.21832       14.53720 82.02792       7.340234 89.07687 6.747170 81.84117 3.689949 7.235695       7.690256 
1 1 1 -20 8  15 o 91.40184 2.850233 102.0832       6.340745 104.9126       10.13451 100.2632       8.128150 92.46526 4.511292 90.49467 3.693569 1.970581       5.830455 
1 1 1 -20 8  16 o 25.26050 5.404511 8.125322       3.226284 14.79827       6.175445 5.620271       3.783710 33.95705 7.647294 21.38716 6.600905 12.56989       10.10213 
1 1 1 -20 8  17 o 92.52779 2.836585 104.6232       6.388383 99.99235       9.974200 107.8443       8.318577 90.24399 4.550166 93.85400 3.644065 -3.610016      5.829513 
1 1 1 -20 8  18 o 52.60342 3.306564 33.94608       4.217202 33.93802       7.197474 33.95030       5.204090 52.24096 5.748600 52.51126 4.099294 -0.2702942     7.060496 
1 1 1 -20 8  19 o 128.9182 3.502783 203.3607       10.99413 201.7081       14.21858 205.8176       17.33723 128.2059 4.558308 129.2949 5.515197 -1.088959      7.155108 
1 1 1 -20 8  20 o 102.9436 3.399303 129.7179       8.515879 123.7507       11.01324 138.5907       13.42958 100.3683 4.514353 106.0879 5.210643 -5.719612      6.894214 
1 1 1 -20 8  21 o 103.0168 3.385070 129.9335       8.486362 135.2406       11.26373 122.9657       12.90631 104.9264 4.415025 99.85616 5.323084 5.070244       6.915756 
1 1 1 -20 8  22 o 103.1712 2.883987 130.1848       7.243721 121.9256       11.18629 136.1490       9.505946 99.54526 4.623999 105.3819 3.707406 -5.836670      5.926738 
1 1 1 -20 8  23 o 52.14633 3.321565 33.41152       4.198936 26.55011       7.086376 37.12401       5.212548 45.85721 6.525259 54.89220 3.922611 -9.034988      7.613533 
1 1 1 -20 8  24 o 45.88245 4.019766 26.02938       4.449166 35.80057       10.33537 23.80678       4.929276 52.81967 8.303299 43.74339 4.697700 9.076283       9.540081 
1 1 1 -20 8  25 o 118.4782 2.949986 171.7923       8.517152 164.3255       12.81637 177.6980       11.39812 115.4329 4.565166 120.2389 3.895164 -4.805939      6.001087 
1 1 1 -20 8  26 o 77.61005 3.266580 73.97379       6.164178 83.11530       12.58692 71.08961       7.070027 81.39730 6.396979 75.96627 3.831498 5.431030       7.456656 
1 1 1 -20 8  27 o 51.53808 3.754088 32.83306       4.682529 41.32430       11.35857 31.09454       5.139579 56.35551 8.537989 50.04484 4.254663 6.310669       9.539361 
1 1 1 -20 8  28 o 20.45125 6.023058 5.331854       3.203782 2.171153       5.725865 6.772363       3.865515 19.18342 7.804785 22.91444 6.578019 -3.731026      10.20711 
1 1 1 -20 8  29 o 100.7807 2.936435 124.8072       7.203948 121.4539       11.22997 127.1521       9.390791 98.77771 4.678641 101.4344 3.805849 -2.656731      6.031100 
1 1 1 -20 8  30 o 54.85033 4.030427 37.46225       5.349624 39.96350       7.262678 34.49548       7.909685 56.20763 5.367420 51.78105 6.404735 4.426586       8.356424 
1 1 1 -20 8  31 o 39.79090 3.975176 19.84272       3.803036 26.23301       6.515203 16.54010       4.683790 45.05223 6.090209 35.81280 5.546035 9.239433       8.237060 
1 1 1 -20 8  32 o 30.29056 5.065835 11.86170       3.607392 19.42620       6.073015 7.737445       4.484225 38.24383 6.763780 24.07616 7.134849 14.16767       9.831316 
1 1 1 -20 8  33 o 39.91407 4.256834 20.20334       4.076637 11.42177       6.760974 25.21990       5.110061 28.51541 8.827568 44.42057 4.796670 -15.90516      10.04659 
1 1 1 -20 8  34 o 30.10218 6.542956 12.35051       4.662336 23.00881       6.525164 1.233462       6.664110 41.26730 6.719557 18.83266 8.085748 22.43464       10.51341 
1 1 1 -20 8  35 o 11.34862 5.257819 -2.436404      3.453480 4.651901       5.717010 -6.509061      4.333478 20.47791 7.969715 10.85399 5.263626 9.623915       9.551026 
1 1 1 -20 8  36 o 40.42913 5.207032 21.63881       5.011046 22.05046       9.659120 21.48722       5.861542 36.73374 10.34998 39.60139 6.283450 -2.867653      12.10800 
1 1 1 -20 8  37 o 40.16150 4.590364 21.11926       4.411953 20.24886       6.723888 21.77735       5.846581 37.14718 7.681559 39.68035 6.253077 -2.533169      9.904914 
1 1 1 -20 8  38 o 20.44947 7.179416 5.845927       4.428369 -5.409602      8.056396 10.71900       5.301017 16.10575 7.638831 26.53739 7.728945 -10.43164      10.86685 
1 1 1 -20 8  39 o 16.97636 6.628395 3.352470       3.964840 0.1614003E-01  5.741303 6.394175       5.481944 15.98495 7.157535 21.04962 7.898091 -5.064675      10.65881 
1 1 1 -20 8  40 o 13.32630 6.133580 -1.633352      4.588937 0.9580513      5.648988 -6.661645      7.868888 16.25533 7.199830 14.96345 7.216520 1.291879       10.19391 
1 1 1 -20 8  41 o 32.01807 5.855192 14.89609       4.400189 13.39072       6.578449 16.11487       5.919237 27.35489 8.740973 31.38006 7.779593 -4.025166      11.70157 
1 1 1 -20 8  42 o 13.43037 5.907794 0.5077822      3.741714 2.735665       6.002991 -0.9077212     4.784946 17.26414 7.541510 13.74553 6.303186 3.518618       9.828760 
1 1 1 -20 9  1  o 72.45306 3.376476 64.27164       5.945117 81.60509       16.87108 61.81409       6.352605 80.67440 8.720078 71.01826 3.683259 9.656136       9.466054 
1 1 1 -20 9  2  o 63.87978 2.906881 49.91896       4.513227 54.15879       7.373185 47.37851       5.707382 66.35416 4.588104 62.14117 3.786939 4.212994       5.949085 
1 1 1 -20 9  3  o 81.00169 2.695092 80.16373       5.312496 77.79265       8.700676 81.57316       6.708110 79.59739 4.503952 81.64844 3.378747 -2.051048      5.630410 
1 1 1 -20 9  4  o 33.92897 4.156033 14.28781       3.364588 13.16852       5.720366 14.87984       4.160325 32.04902 7.464016 34.48167 5.105152 -2.432659      9.042904 
1 1 1 -20 9  5  o 177.6196 3.051829 385.1807       13.20952 390.3100       21.49118 382.0662       16.74632 178.4382 4.947155 176.7891 3.887120 1.649124       6.291584 
1 1 1 -20 9  6  o 48.60432 3.244033 28.97694       3.820348 28.16940       6.804739 29.34863       4.616579 47.52981 6.009091 48.84340 3.911291 -1.313595      7.169894 
1 1 1 -20 9  7  o 123.8360 3.359190 187.4409       10.12782 169.1222       16.54709 198.4143       12.80688 117.2505 5.809322 127.3106 4.133508 -10.06010      7.129805 
1 1 1 -20 9  8  o 199.5141 4.046546 486.7130       19.67407 433.4298       32.43306 517.7346       24.74716 187.4635 7.112522 205.5982 4.939351 -18.13472      8.659397 
1 1 1 -20 9  9  o 69.04356 2.962668 58.29962       4.973138 63.31439       8.074463 55.23460       6.312555 71.77153 4.641523 67.10986 3.876456 4.661674       6.047368 
1 1 1 -20 9  10 o 80.69550 2.594372 79.54020       5.095102 65.42561       8.658778 87.01587       6.301555 72.92538 4.900842 84.36572 3.070227 -11.44033      5.783125 
1 1 1 -20 9  11 o 115.2994 2.593883 162.2206       7.288085 166.8528       12.61932 159.9023       8.927465 116.6825 4.446203 114.3831 3.205965 2.299438       5.481508 
1 1 1 -20 9  12 o 195.4465 3.175042 466.4981       15.12215 459.8073       24.60295 470.5606       19.17104 193.5966 5.219748 196.1630 4.010445 -2.566345      6.582510 
1 1 1 -20 9  13 o 93.11144 3.416476 106.0603       7.738923 96.54002       10.08270 119.7107       12.07330 88.66791 4.682920 98.70759 5.035897 -10.03968      6.876772 
1 1 1 -20 9  14 o 102.0288 3.254005 127.2822       8.080192 157.9684       18.26440 119.8148       9.009853 113.0868 6.657065 98.93087 3.743986 14.15589       7.637667 
1 1 1 -20 9  15 o 138.1267 3.030216 232.9810       10.19970 231.8255       15.51661 233.8603       13.53475 137.5035 4.637338 138.2132 4.022789 -0.7096558     6.139034 
1 1 1 -20 9  16 o 67.78294 3.041751 56.22350       5.011553 45.40708       8.305441 62.41667       6.284599 60.54024 5.696615 71.36427 3.625651 -10.82403      6.752538 
1 1 1 -20 9  17 o 69.61752 2.979888 59.29935       5.043695 62.12093       8.540329 57.78819       6.250059 71.00162 4.967278 68.63906 3.750855 2.362556       6.224369 
1 1 1 -20 9  18 o 25.31015 5.406572 8.166054       3.233354 16.77167       6.494856 5.330500       3.728185 36.15054 7.613488 20.90309 6.568239 15.24746       10.05520 
1 1 1 -20 9  19 o 128.6048 3.566069 202.4442       11.16512 209.9034       14.66278 192.1511       17.22451 130.7561 4.608906 124.8515 5.676157 5.904579       7.311688 
1 1 1 -20 9  20 o 99.50478 3.435658 121.2422       8.318365 120.6573       10.99096 122.0263       12.72692 99.07655 4.564542 99.49501 5.267888 -0.4184570     6.970343 
1 1 1 -20 9  21 o 189.3987 3.488473 438.9389       16.10084 449.2349       24.15644 430.7085       21.59784 191.0471 5.193491 187.2216 4.737696 3.825455       7.029802 
1 1 1 -20 9  22 o 96.15037 2.879053 113.1031       6.738252 112.9053       10.76238 113.2306       8.641574 95.75993 4.625672 96.07824 3.697798 -0.3183060     5.922040 
1 1 1 -20 9  23 o 48.22141 3.839046 28.68768       4.474058 13.21538       9.689874 32.87997       5.043902 32.55466 10.62643 51.61266 4.042510 -19.05800      11.36938 
1 1 1 -20 9  24 f 113.3096 2.930189 157.1849       8.084146 162.3562       12.61482 153.5811       10.53076 114.7864 4.518596 111.8040 3.870989 2.982483       5.949980 
1 1 1 -20 9  25 o 125.4138 2.982071 192.5778       9.113799 189.1424       13.95449 195.1332       12.03517 123.7830 4.634300 125.9602 3.925665 -2.177162      6.073515 
1 1 1 -20 9  26 o 73.17247 3.754724 65.97652       6.672787 0.000000       0.000000 65.97652       6.672787 ?        ?        73.17247 3.754724 0.000000       3.754724 
1 1 1 -20 9  27 o 66.21189 3.088425 53.89027       4.969481 46.34892       8.203830 58.26136       6.245780 60.76715 5.603079 68.71160 3.744249 -7.944454      6.738983 
1 1 1 -20 9  28 o 64.42959 3.105397 51.09418       4.861362 46.92778       8.170746 53.37724       6.048375 61.06227 5.551643 65.69584 3.794166 -4.633564      6.724317 
1 1 1 -20 9  29 o 34.93491 4.368227 15.35945       3.637731 15.90287       6.256521 15.08192       4.471174 34.57846 7.629781 34.29210 5.539195 0.2863617      9.428480 
1 1 1 -20 9  30 o 101.5293 3.512303 127.4539       8.676904 126.2724       11.34297 129.1205       13.47180 100.5130 4.643479 101.1432 5.486325 -0.6302261     7.187604 
1 1 1 -20 9  31 o 40.06566 4.038002 20.15582       3.888802 15.44804       6.426754 22.87521       4.884493 33.65731 7.961189 42.45935 4.805093 -8.802036      9.298895 
1 1 1 -20 9  32 o 23.60067 6.061522 7.426467       3.504168 11.70667       5.812593 4.982735       4.392021 29.11801 7.963684 20.31194 7.148380 8.806061       10.70138 
1 1 1 -20 9  33 o 41.17162 4.994293 21.83218       4.908473 19.01384       6.600867 25.31824       7.341275 37.15305 7.548495 43.20450 7.227900 -6.051453      10.45095 
1 1 1 -20 9  34 o 32.87205 5.026119 14.12436       3.898504 12.60989       6.168163 15.13178       5.030726 29.59058 8.247006 33.38639 6.416440 -3.795818      10.44911 
1 1 1 -20 9  35 o 24.87370 6.260005 8.560617       3.791006 6.379486       6.049062 9.971393       4.864924 22.27637 8.309129 26.44239 7.307014 -4.166019      11.06499 
1 1 1 -20 9  36 o 36.15858 5.735725 17.69929       4.885486 24.84077       9.903533 15.40245       5.616437 38.98977 10.27907 32.75041 7.230936 6.239357       12.56764 
1 1 1 -20 9  37 f 37.68519 5.400318 19.15999       4.817808 27.19041       9.686014 16.52010       5.553527 40.81473 9.851688 33.90490 6.955055 6.909828       12.05938 
1 1 1 -20 9  38 o 20.20118 7.126681 5.719815       4.367374 12.95560       8.505262 3.128740       5.089615 27.50193 9.918450 17.85643 7.322696 9.645504       12.32873 
1 1 1 -20 9  39 o 20.88316 6.946081 6.454387       4.133308 5.680680       6.085559 7.116959       5.631564 20.45749 8.142083 21.72245 8.033333 -1.264963      11.43800 
1 1 1 -20 9  40 o 11.26511 5.305281 -2.839384      3.759910 -0.6279556     5.689183 -4.554306      5.009975 15.23479 6.943043 12.34366 5.901690 2.891121       9.112398 
1 1 1 -20 9  41 o 18.39664 6.739274 4.932490       3.947859 9.836575       6.186716 1.563888       5.127503 23.68090 8.469149 15.91111 6.959753 7.769792       10.96196 
1 1 1 -20 9  42 o 21.29830 6.875115 7.265501       4.062432 9.831752       6.279669 5.418571       5.327364 23.25106 8.502519 19.04248 7.605044 4.208584       11.40743 
1 1 1 -20 10 1  o 20.89431 7.583365 4.461593       4.981970 -19.16895      12.80254 8.678514       5.408255 19.13726 9.223298 26.31890 7.844507 -7.181646      12.10808 
1 1 1 -20 10 2  o 145.4269 3.267852 258.3548       11.58093 279.1802       27.50561 253.8675       12.76779 150.1590 7.540947 144.0684 3.639642 6.090637       8.373343 
1 1 1 -20 10 3  o 101.4023 2.858183 125.6265       7.055707 108.7226       12.94420 132.7721       8.415881 93.93697 5.681166 104.2001 3.318558 -10.26314      6.579398 
1 1 1 -20 10 4  o 116.9711 2.877293 167.0303       8.201604 138.5922       14.95331 179.2664       9.808618 106.0830 5.806503 121.0955 3.327020 -15.01254      6.692125 
1 1 1 -20 10 5  o 199.2760 4.068073 485.6839       19.75513 507.1399       34.94283 475.6042       23.95005 202.7372 7.083639 196.9474 4.994255 5.789825       8.667210 
1 1 1 -20 10 6  o 139.1572 3.408438 236.5688       11.55839 239.2518       20.45460 235.3102       14.00950 139.4275 6.034423 138.6374 4.151411 0.7901154      7.324512 
1 1 1 -20 10 7  o 72.75259 3.573017 64.83153       6.315230 75.69206       8.578847 51.98420       9.330605 78.51102 4.502851 64.78947 5.977090 13.72155       7.483399 
1 1 1 -20 10 8  o 179.6319 3.393592 394.1855       14.85522 397.2193       21.92921 391.6125       20.19472 179.9795 5.004786 178.7842 4.639164 1.195374       6.824202 
1 1 1 -20 10 9  o 118.2908 2.649014 170.7653       7.636095 180.0848       13.17714 166.0534       9.369724 121.2167 4.468551 116.5496 3.302311 4.667099       5.556366 
1 1 1 -20 10 10 o 80.73997 2.619773 79.63795       5.147696 75.69740       9.092797 81.49661       6.244804 78.47225 4.777582 81.63108 3.145144 -3.158829      5.719896 
1 1 1 -20 10 11 o 58.55057 2.836306 41.94556       4.034841 33.42390       7.560530 45.33907       4.771053 51.80397 6.106156 60.84220 3.229473 -9.038227      6.907578 
1 1 1 -20 10 12 o 81.04952 3.493655 80.41644       6.884073 73.14044       9.238192 89.50152       10.32298 77.10173 4.942883 85.31503 4.987023 -8.213295      7.021573 
1 1 1 -20 10 13 o 88.05398 2.586816 94.70424       5.544718 98.13998       10.12090 93.23081       6.627857 89.39595 4.661960 87.31688 3.119877 2.079071       5.609590 
1 1 1 -20 10 14 f 212.6832 4.286765 553.6302       22.21769 583.1840       42.24579 542.3308       26.12195 216.9423 8.004762 210.3071 5.097012 6.635208       9.489770 
1 1 1 -20 10 15 o 206.7572 4.213737 523.2071       21.23069 601.6443       42.45893 497.0574       24.51556 220.3347 7.920585 201.3414 4.996577 18.99323       9.364905 
1 1 1 -20 10 16 o 94.62293 2.891546 109.4381       6.659669 116.9076       11.13929 105.2832       8.307918 97.55509 4.699492 92.71571 3.684414 4.839378       5.971610 
1 1 1 -20 10 17 o 44.18876 3.553106 24.02926       3.793872 22.29535       7.028946 24.74207       4.506721 41.91749 7.136586 44.76027 4.180067 -2.842781      8.270660 
1 1 1 -20 10 18 o 105.7890 2.886757 136.8009       7.434992 139.6655       11.80473 134.9174       9.572148 106.6379 4.553122 104.9413 3.749084 1.696548       5.898012 
1 1 1 -20 10 19 o 110.4934 4.653730 150.0444       12.50259 150.0444       12.50259 0.000000       0.000000 110.4934 4.653730 ?        ?        0.000000       4.653730 
1 1 1 -20 10 20 o 31.45457 4.728762 12.41171       3.512596 18.28781       6.797436 10.27093       4.102856 37.71372 7.657980 28.32032 6.123608 9.393396       9.805265 
1 1 1 -20 10 21 o 52.76553 3.618034 34.24817       4.624054 44.43273       11.00976 32.06687       5.095231 59.23749 7.817477 50.97308 4.137460 8.264408       8.844858 
1 1 1 -20 10 22 o 146.0165 3.115777 260.8268       11.08675 253.9060       16.72427 266.2525       14.80809 143.5987 4.785946 147.2476 4.130896 -3.648880      6.322150 
1 1 1 -20 10 23 o 77.08905 2.955730 72.80511       5.542276 78.73382       9.291069 69.53016       6.905396 79.82449 4.798474 75.20137 3.780260 4.623123       6.108660 
1 1 1 -20 10 24 o 123.4665 2.991500 186.6062       9.000662 173.0281       13.64575 197.0629       11.97499 118.3841 4.739654 126.6188 3.885574 -8.234695      6.128785 
1 1 1 -20 10 25 o 25.66745 5.851725 8.504662       3.578611 11.80167       9.446136 7.952170       3.866844 30.91894 10.50231 24.78792 6.368015 6.131020       12.28211 
1 1 1 -20 10 26 o 49.25539 4.212316 30.11913       5.007557 0.000000       0.000000 30.11913       5.007557 ?        ?        49.25539 4.212316 0.000000       4.212316 
1 1 1 -20 10 27 o 39.95256 3.962454 19.86713       3.807070 18.23786       6.642575 20.66410       4.645810 37.27549 7.571356 40.56167 4.792577 -3.286182      8.960704 
1 1 1 -20 10 28 o 34.44117 4.350721 14.91478       3.570204 16.50328       6.462850 14.21712       4.283048 35.26165 7.734406 33.32241 5.463675 1.939240       9.469572 
1 1 1 -20 10 29 o 70.09473 3.118945 60.57459       5.314229 49.95202       8.472651 67.46387       6.823255 62.81056 5.593886 73.77316 3.808285 -10.96260      6.767171 
1 1 1 -20 10 30 o 53.04325 4.167749 35.18779       5.344018 32.91610       7.296731 37.81607       7.848571 50.58492 6.038421 54.26146 6.037710 -3.676544      8.539113 
1 1 1 -20 10 31 o 67.21006 3.169303 55.92009       5.176178 49.24658       8.218325 60.30807       6.664064 62.08683 5.488311 69.50428 3.950788 -7.417450      6.762417 
1 1 1 -20 10 32 o 21.41769 6.323917 6.081404       3.528069 7.066996       6.164878 5.601409       4.302236 23.69470 8.456425 21.00001 7.088006 2.694687       11.03408 
1 1 1 -20 10 33 o 31.00219 6.237115 12.93794       4.548683 14.60912       6.265770 11.07587       6.613961 32.13833 8.025239 27.90884 8.745444 4.229492       11.86959 
1 1 1 -20 10 34 o 45.81406 4.004717 26.66863       4.426118 25.27599       6.934658 27.62594       5.749546 42.98036 6.850718 45.99519 5.221933 -3.014835      8.613997 
1 1 1 -20 10 35 o 13.76492 5.949216 0.2119725      3.653995 6.210431       6.083981 -3.172596      4.570036 22.01754 8.307711 12.87177 5.992402 9.145761       10.24339 
1 1 1 -20 10 36 o 26.22530 7.032477 9.925528       4.586265 21.87954       9.378998 6.168887       5.257743 36.42091 10.17635 21.39689 7.786812 15.02402       12.81376 
1 1 1 -20 10 37 o 53.21656 3.794938 36.29921       4.889091 33.39810       7.350396 38.60113       6.547485 49.00390 6.300870 53.89399 5.043979 -4.890083      8.071102 
1 1 1 -20 10 38 o 14.25492 6.083238 0.9386870      3.730371 1.034311       5.849170 0.8731276      4.843161 16.85078 7.400290 15.63252 6.802179 1.218256       10.05156 
1 1 1 -20 10 39 o 40.30098 6.019307 23.11353       5.730603 20.37154       7.367042 27.31473       9.118995 35.08991 8.667115 39.72521 9.540169 -4.635296      12.88929 
1 1 1 -20 10 40 o 10.76965 5.118396 -3.335586      3.653549 -5.486386      5.623099 -1.764239      4.806308 12.74175 6.133774 13.45606 6.223168 -0.7143126     8.737906 
1 1 1 -20 10 41 o 18.92194 6.854723 5.379120       4.068079 10.05628       6.386167 2.185094       5.277381 23.70388 8.588264 16.44600 7.128751 7.257881       11.16142 
1 1 1 -20 10 42 o 25.86150 6.591534 10.50040       4.165744 16.25109       6.356691 6.171714       5.515052 30.27584 8.347156 19.74727 7.785347 10.52858       11.41432 
1 1 1 -20 11 1  o 98.22775 2.927580 117.9282       6.999938 111.3167       12.94534 120.6600       8.321410 95.03445 5.614823 99.30159 3.443995 -4.267136      6.586907 
1 1 1 -20 11 2  o 174.2690 6.806541 374.9041       28.85007 0.000000       0.000000 374.9041       28.85007 ?        ?        174.2690 6.806541 0.000000       6.806541 
1 1 1 -20 11 3  o 39.11823 4.500327 18.98168       4.211950 12.98065       7.048612 22.31460       5.252947 31.84671 8.793401 42.34275 5.199869 -10.49604      10.21580 
1 1 1 -20 11 4  o 23.96548 6.142205 7.329946       3.603310 5.907725       5.730733 8.259867       4.633935 23.22931 8.166245 25.52328 7.160821 -2.293978      10.86117 
1 1 1 -20 11 5  o 130.5054 3.052754 207.9857       9.708597 213.5304       14.76223 203.7596       12.88791 131.9682 4.597377 128.9920 4.105223 2.976242       6.163500 
1 1 1 -20 11 6  o 212.8979 3.393728 553.7800       17.60697 583.9437       29.35859 536.8375       22.00296 218.0582 5.529388 209.4403 4.311066 8.617920       7.011378 
1 1 1 -20 11 7  o 150.0452 3.764500 275.4068       13.75379 291.0672       17.76659 251.9856       21.72737 154.0784 4.737424 143.0164 6.249349 11.06198       7.842037 
1 1 1 -20 11 8  o 274.2772 4.004222 920.0853       26.76357 896.0468       42.39043 936.0186       34.51177 269.8610 6.446021 276.3090 5.125498 -6.448029      8.235406 
1 1 1 -20 11 9  o 88.43821 2.649192 95.54221       5.702950 102.1845       10.19700 92.51890       6.879472 91.23475 4.601299 86.96967 3.251746 4.265083       5.634342 
1 1 1 -20 11 10 o 36.47900 3.837070 16.44874       3.359962 17.83302       6.666160 15.97729       3.890264 37.34823 7.583589 35.83941 4.557247 1.508823       8.847560 
1 1 1 -20 11 11 o 44.39127 3.856365 24.27609       4.130335 34.10273       7.623375 20.19292       4.914093 52.32758 6.092132 40.26471 5.124132 12.06287       7.960578 
1 1 1 -20 11 12 o 119.8343 2.662978 175.2758       7.776513 179.0912       13.76373 173.4867       9.425040 120.8233 4.683522 119.1267 3.249705 1.696640       5.700522 
1 1 1 -20 11 13 o 95.02222 2.888240 110.3477       6.680211 119.0814       11.11680 105.4117       8.357412 98.48547 4.645121 92.77969 3.703876 5.705788       5.941031 
1 1 1 -20 11 14 o 213.5881 3.390448 557.5118       17.64697 583.2887       29.61454 543.3193       21.97447 217.8463 5.583117 210.6659 4.280437 7.180435       7.035150 
1 1 1 -20 11 15 o 92.29913 3.257035 104.2297       7.314336 117.6564       16.80405 101.0912       8.124342 97.34296 7.133446 90.84540 3.677458 6.497559       8.025569 
1 1 1 -20 11 16 o 46.93075 3.555964 27.08610       4.036518 26.91155       7.561124 27.15567       4.773677 46.19048 6.931005 46.90302 4.221664 -0.7125359     8.115496 
1 1 1 -20 11 17 o 95.85756 3.457082 112.5070       8.062325 111.1475       10.94699 114.1185       11.91857 95.07218 4.739984 96.26910 5.098620 -1.196922      6.961564 
1 1 1 -20 11 18 o 36.52460 5.268387 16.72656       4.553810 24.81413       7.293280 11.55895       5.829866 44.27022 6.992332 29.96406 7.880380 14.30616       10.53533 
1 1 1 -20 11 19 o 210.5413 4.387773 543.6709       22.51217 548.7355       28.56143 535.3630       36.58036 211.0311 5.558732 207.6384 7.240515 3.392731       9.128229 
1 1 1 -20 11 20 o 97.66130 3.191769 116.7754       7.585886 134.0648       15.93622 111.7100       8.625844 103.9418 6.321457 95.43491 3.716114 8.506905       7.332825 
1 1 1 -20 11 21 o 48.76659 3.481266 29.26535       4.109888 31.78409       7.481983 28.17695       4.918356 50.31320 6.235746 47.72534 4.274178 2.587860       7.559968 
1 1 1 -20 11 22 o 64.73763 3.111195 51.40321       4.893809 55.10033       8.842155 49.77060       5.875813 66.57938 5.498806 63.59357 3.809023 2.985817       6.689209 
1 1 1 -20 11 23 o 109.8285 2.932992 147.7134       7.842836 156.2441       12.73314 142.4987       9.955441 112.5344 4.653203 107.6874 3.799624 4.847008       6.007449 
1 1 1 -20 11 24 f 108.4296 3.256098 144.2414       8.593872 143.3156       17.41916 144.5393       9.879983 106.8972 6.720913 108.4218 3.745037 -1.524567      7.693892 
1 1 1 -20 11 25 o 50.21517 3.823126 31.18454       4.643152 35.93243       10.73204 30.09116       5.150103 52.45467 8.700505 49.21668 4.338421 3.237988       9.722176 
1 1 1 -20 11 26 o 27.42783 5.599711 9.696383       3.616020 8.168808       8.665097 10.01850       3.979050 27.13944 9.977317 27.79902 6.046255 -0.6595764     11.66636 
1 1 1 -20 11 27 o 102.1078 2.944045 128.0544       7.317885 119.9748       11.34809 133.8060       9.574576 98.20178 4.756205 104.1107 3.780156 -5.908897      6.075448 
1 1 1 -20 11 28 o 79.91235 3.004894 78.58672       5.841238 81.70458       9.605392 76.75708       7.358164 80.83081 4.899437 78.72694 3.847042 2.103867       6.229303 
1 1 1 -20 11 29 o 56.96231 3.415300 40.18222       4.719038 37.04508       7.974278 41.87299       5.854176 53.69773 6.208160 57.92544 4.175266 -4.227707      7.481584 
1 1 1 -20 11 30 o 43.26720 4.871643 23.76636       5.047365 19.98055       7.054206 27.73768       7.224961 38.45877 7.794168 46.05017 6.628986 -7.591393      10.23194 
1 1 1 -20 11 31 o 10.22517 4.826560 -3.331632      3.144435 -10.14435      5.656672 -0.2850836     3.782724 11.88184 5.817097 13.82465 6.013577 -1.942812      8.366703 
1 1 1 -20 11 32 f 34.96949 5.875130 16.14055       4.829243 20.86512       6.811584 11.36572       6.847720 39.05753 7.427985 28.38251 8.899338 10.67501       11.59194 
1 1 1 -20 11 33 o 21.06947 6.553977 5.946578       3.721764 13.03935       5.991523 1.490349       4.749119 30.23041 8.007100 16.70316 6.981322 13.52725       10.62321 
1 1 1 -20 11 34 o 21.31049 6.549354 6.206491       3.729637 -2.927674      5.928441 12.18957       4.798091 15.13553 6.968198 29.53364 6.806491 -14.39811      9.740848 
1 1 1 -20 11 35 o 57.68639 3.611266 42.13915       5.051087 38.62275       7.727786 44.76202       6.674119 53.45987 6.037362 58.70363 4.704800 -5.243759      7.654076 
1 1 1 -20 11 36 o 37.05393 4.897668 18.18870       4.314229 21.78358       6.825457 15.79687       5.567439 38.68324 7.511434 33.08315 7.117095 5.600094       10.34769 
1 1 1 -20 11 37 o 25.72979 7.073524 9.793854       4.572223 10.61942       9.003782 9.506987       5.307477 25.71051 10.00291 24.98988 7.834705 0.7206287      12.70594 
1 1 1 -20 11 38 o 40.08511 4.675674 21.47652       4.481675 16.00643       6.683625 25.94539       6.041065 31.36600 8.523566 43.02468 5.918473 -11.65868      10.37687 
1 1 1 -20 11 39 o 13.05342 5.983270 -1.425590      4.305379 1.524553       5.714485 -5.298708      6.547657 16.70963 7.327159 14.05252 6.726310 2.657115       9.946382 
1 1 1 -20 11 40 o 28.50801 6.982615 12.68127       4.811771 16.37186       9.302086 11.33298       5.622430 28.03349 10.33212 25.86773 8.056914 2.165764       13.10216 
1 1 1 -20 11 41 o 11.76916 5.505008 -2.230256      3.931186 -11.66661      5.921197 5.207725       5.256962 11.00186 5.485668 18.91533 7.554505 -7.913474      9.336118 
1 1 1 -20 12 1  o 86.71098 3.103507 91.96951       6.547296 81.32954       9.600902 101.2192       8.951698 81.29481 4.868638 90.85168 4.053511 -9.556870      6.335186 
1 1 1 -20 12 2  o 177.3582 3.128077 384.2670       13.51963 390.6327       22.28874 380.5616       17.00514 178.3589 5.133420 176.3642 3.956705 1.994644       6.481320 
1 1 1 -20 12 3  o 141.3769 3.277077 244.2132       11.29019 237.6802       26.18985 245.7044       12.51256 138.3726 7.798444 141.7180 3.626118 -3.345398      8.600260 
1 1 1 -20 12 4  o 51.20854 3.300197 32.17181       4.096376 31.86592       7.402841 32.30682       4.917929 50.53884 6.136453 51.23820 3.969634 -0.6993637     7.308492 
1 1 1 -20 12 5  o 158.5216 2.945422 306.8524       11.37816 305.4864       18.75715 307.6477       14.31208 157.7941 4.883858 158.6268 3.702457 -0.8326721     6.128643 
1 1 1 -20 12 6  o 181.3510 3.119131 401.6962       13.78445 417.9457       23.02991 392.6248       17.20715 184.5336 5.126272 179.1623 3.941179 5.371277       6.466186 
1 1 1 -20 12 7  o 38.53754 3.929865 18.35120       3.639013 19.84097       6.982645 17.79571       4.263814 39.44171 7.539609 37.82320 4.729038 1.618507       8.899973 
1 1 1 -20 12 8  o 53.32376 3.736705 34.93406       4.824896 46.08206       7.800968 28.02739       6.140224 61.06232 5.294787 47.49058 5.401549 13.57174       7.563828 
1 1 1 -20 12 9  o 62.07953 2.865398 47.15273       4.323112 45.78254       8.113008 47.69606       5.108840 60.82144 5.534350 62.38740 3.372929 -1.565964      6.481179 
1 1 1 -20 12 10 f 264.8273 4.410807 858.7182       28.46538 873.0941       41.40097 845.8294       39.20128 266.3283 6.379066 262.2368 6.134377 4.091492       8.850032 
1 1 1 -20 12 11 o 51.81102 3.112600 32.90592       3.911779 27.03064       7.800090 34.88012       4.521478 46.28136 7.145892 53.30700 3.500009 -7.025639      7.956999 
1 1 1 -20 12 12 o 80.05105 2.967054 78.36636       5.777986 89.05208       9.969373 72.96141       7.090250 85.09771 4.827237 77.14686 3.782976 7.950851       6.132954 
1 1 1 -20 12 13 o 43.32324 3.369644 23.07670       3.529512 21.52762       7.500105 23.51734       4.000130 41.04955 7.782336 43.68524 3.795160 -2.635693      8.658405 
1 1 1 -20 12 14 o 169.6108 2.985774 351.4022       12.34089 369.4350       21.39977 342.4170       15.10573 173.4267 5.069011 167.3150 3.704850 6.111710       6.278598 
1 1 1 -20 12 15 o 134.4386 3.467694 221.1428       11.35110 224.8443       23.46885 220.0125       12.96895 134.6438 7.178634 134.0063 3.975796 0.6375580      8.206079 
1 1 1 -20 12 16 o 67.08242 3.692403 55.22501       6.012784 57.82766       8.765649 52.91212       8.263292 68.39677 5.300448 65.42095 5.226662 2.975822       7.443974 
1 1 1 -20 12 17 o 103.4396 3.491526 131.0340       8.788507 135.4893       12.03880 125.9506       12.85939 104.9680 4.718478 101.0895 5.237959 3.878555       7.049840 
1 1 1 -20 12 18 o 91.13332 2.921699 101.5976       6.480183 103.7611       10.85421 100.3994       8.077749 91.77942 4.870512 90.49004 3.670759 1.289383       6.098882 
1 1 1 -20 12 19 o 49.80518 4.904531 30.78178       5.875470 32.84841       10.43702 29.82301       7.108907 50.52892 8.795520 48.76981 6.115688 1.759109       10.71274 
1 1 1 -20 12 20 o 73.13443 2.983065 65.51286       5.305280 81.72096       9.487017 58.13796       6.399437 81.37846 4.805312 68.76649 3.833996 12.61196       6.147402 
1 1 1 -20 12 21 o 162.2468 3.254249 322.2556       12.86658 342.2611       20.10093 308.3693       16.74697 166.6211 4.956017 158.3646 4.343626 8.256516       6.590083 
1 1 1 -20 12 22 o 76.86830 2.981083 72.41830       5.573568 58.84128       9.278280 80.08372       6.971614 68.74802 5.586331 80.74349 3.551843 -11.99547      6.619871 
1 1 1 -20 12 23 o 74.43034 3.009485 67.94873       5.447306 61.73166       9.331432 71.16252       6.709106 70.39146 5.483139 76.06035 3.630159 -5.668892      6.575931 
1 1 1 -20 12 24 o 41.51595 4.135745 21.42611       4.128526 22.38334       10.04418 21.23151       4.528785 40.81242 10.14332 41.23192 4.584688 -0.4194946     11.13133 
1 1 1 -20 12 25 o 49.89779 3.472379 30.73471       4.195911 39.45751       7.835642 27.22786       4.968273 55.96872 5.830420 46.75767 4.412482 9.211056       7.311894 
1 1 1 -20 12 26 o 127.6768 3.425996 200.6187       10.64982 191.2731       20.05559 204.2888       12.56820 122.9381 6.719971 128.6020 4.015332 -5.663902      7.828212 
1 1 1 -20 12 27 o 58.63799 3.335185 42.45172       4.746140 32.88822       7.933078 47.78300       5.923102 50.58958 6.591541 62.06714 3.936359 -11.47757      7.677456 
1 1 1 -20 12 28 o 42.34225 3.887859 22.36681       3.966884 26.98686       7.114673 20.28261       4.778607 45.63611 6.587988 39.99159 5.013251 5.644524       8.278543 
1 1 1 -20 12 29 o 23.45306 6.092674 7.256612       3.513085 5.810965       6.455318 7.864939       4.187502 22.96257 8.579915 24.35619 6.797663 -1.393614      10.94638 
1 1 1 -20 12 30 o 63.79878 3.972269 50.86847       6.145075 42.68151       8.313086 60.73133       9.124356 57.48168 6.024047 68.98256 5.472656 -11.50088      8.138741 
1 1 1 -20 12 31 o 33.96869 4.792675 14.83499       3.857164 14.33054       6.648038 15.09097       4.735756 31.91206 8.425908 33.80826 5.966210 -1.896202      10.32432 
1 1 1 -20 12 32 o 33.70631 6.023181 15.14483       4.765773 23.00311       6.615270 6.665546       6.871684 41.27087 6.815280 23.45370 8.833627 17.81717       11.15711 
1 1 1 -20 12 33 o 45.63501 4.026961 26.46594       4.432384 16.87622       6.923424 33.12606       5.769777 34.05681 8.396296 50.71628 4.722762 -16.65947      9.633393 
1 1 1 -20 12 34 o 11.14604 5.187956 -2.584816      3.422695 2.739584       6.048262 -5.093180      4.151360 18.94002 7.894541 11.12590 5.333560 7.814125       9.527362 
1 1 1 -20 12 35 o 40.31481 5.196915 21.59565       4.986950 -0.5745353     9.654894 29.66276       5.824006 19.98295 9.082726 47.37437 5.126352 -27.39143      10.42954 
1 1 1 -20 12 36 o 12.74074 5.721382 -0.9194875     3.697574 -11.23924      5.556619 7.281657       4.953513 11.03633 5.470934 22.43030 7.605423 -11.39397      9.368755 
1 1 1 -20 12 37 o 18.16388 6.877906 4.150517       4.178542 -2.447458      7.770370 6.834725       4.956151 16.91398 7.853654 21.61760 7.594757 -4.703625      10.92521 
1 1 1 -20 12 38 o 17.73279 6.650082 4.102388       3.885294 5.432713       5.969940 3.124912       5.117339 20.15858 8.050689 17.59973 7.292403 2.558842       10.86245 
1 1 1 -20 12 39 o 23.52584 7.439589 8.838017       4.775815 4.675838       6.093245 15.46775       7.690177 19.21903 7.959854 28.89358 9.468811 -9.674551      12.37003 
1 1 1 -20 12 40 o 16.51871 6.497228 3.413627       3.833108 -2.222808      5.686496 8.107390       5.189232 14.20041 6.635257 22.16500 7.772514 -7.964593      10.21952 
1 1 1 -20 12 41 o 36.47052 5.069660 18.72936       4.383995 13.27518       6.546578 23.16396       5.903050 26.72817 8.735078 39.14070 6.410600 -12.41253      10.83501 
1 1 1 -20 13 1  o 110.4591 2.965607 149.1589       7.975502 147.3104       15.34001 149.8437       9.336612 109.2666 5.781636 110.6455 3.467016 -1.378899      6.741477 
1 1 1 -20 13 2  o 12.40316 5.451721 -0.8424408     3.180640 -0.1950195     6.171759 -1.076572      3.711462 18.19709 7.796496 13.30945 5.868101 4.887638       9.758072 
1 1 1 -20 13 3  o 201.8942 3.768000 498.6117       18.53834 537.8494       42.17366 489.2143       20.63926 207.9450 8.339469 199.8788 4.237321 8.066223       9.354231 
1 1 1 -20 13 4  o 129.4729 2.823801 204.6926       8.909408 210.4659       15.11527 201.6189       11.02897 130.9443 4.744732 128.3713 3.528930 2.573013       5.913191 
1 1 1 -20 13 5  o 130.3194 3.254490 207.5172       10.33542 221.2618       15.44876 196.3812       13.90571 134.2736 4.728740 126.5298 4.517120 7.743835       6.539522 
1 1 1 -20 13 6  o 92.88248 2.731055 105.4156       6.174880 110.4405       10.98601 103.0950       7.465778 94.80175 4.770738 91.78842 3.343315 3.013329       5.825607 
1 1 1 -20 13 7  o 24.13266 5.635142 7.440285       3.253552 8.369878       6.463322 7.124779       3.765420 26.45288 8.681365 23.65880 6.384356 2.794079       10.77618 
1 1 1 -20 13 8  o 94.73895 3.201074 109.7820       7.379656 111.0109       10.99182 108.7734       9.957490 95.04904 4.760698 94.14921 4.351846 0.8998337      6.450024 
1 1 1 -20 13 9  f 172.0847 3.060318 361.7246       12.83350 382.1812       21.87078 350.9821       15.84888 176.4221 5.092488 169.3886 3.839533 7.033463       6.377730 
1 1 1 -20 13 10 o 217.8695 3.445634 580.2305       18.29371 597.9073       30.48444 570.2822       22.86928 220.4836 5.678418 215.7876 4.349004 4.695984       7.152501 
1 1 1 -20 13 11 o 61.70039 3.244833 46.64886       4.861689 56.32718       8.720349 42.28397       5.856259 67.51772 5.343593 58.62775 4.125364 8.889973       6.750749 
1 1 1 -20 13 12 o 163.7419 2.966608 327.5049       11.83740 334.6092       20.23167 323.8069       14.59665 165.0438 5.036224 162.7046 3.681436 2.339188       6.238311 
1 1 1 -20 13 13 o 201.5575 3.278351 496.5669       16.10239 519.9507       27.27576 484.0573       19.94986 205.6071 5.448610 198.8212 4.117570 6.785858       6.829475 
1 1 1 -20 13 14 o 187.6419 3.161281 430.3160       14.45536 421.2206       23.90181 435.5612       18.15107 185.0641 5.305434 188.6215 3.948889 -3.557312      6.613725 
1 1 1 -20 13 15 o 125.3431 3.547912 192.3460       10.82611 150.6701       20.61213 208.2229       12.72222 109.9022 7.745890 130.3325 4.010433 -20.43031      8.722522 
1 1 1 -20 13 16 o 72.96221 3.166455 65.20212       5.616583 73.33414       9.803300 61.22848       6.852785 77.05206 5.252383 70.58835 4.000176 6.463715       6.602191 
1 1 1 -20 13 17 o 171.5866 3.364884 360.1742       14.06985 369.9784       21.64187 352.9968       18.51711 173.3750 5.128022 169.5472 4.485677 3.827744       6.813069 
1 1 1 -20 13 18 o 71.61583 3.304240 62.88272       5.751018 61.17084       12.60301 63.33293       6.463160 69.72818 7.536654 71.81504 3.705652 -2.086861      8.398393 
1 1 1 -20 13 19 o 186.6029 4.150880 427.2722       18.87534 444.7047       24.56954 402.1663       29.48532 189.8738 5.315247 179.8888 6.738045 9.985016       8.582138 
1 1 1 -20 13 20 o 97.50190 2.921147 116.3781       6.932862 119.9203       11.59123 114.4051       8.650810 98.57709 4.840020 96.53748 3.684024 2.039612       6.082584 
1 1 1 -20 13 21 o 33.19922 4.641917 13.82602       3.652936 6.819581       7.027491 16.42006       4.276021 25.01199 9.016334 36.16177 4.984842 -11.14977      10.30257 
1 1 1 -20 13 22 o 34.90797 4.381438 15.23130       3.645262 24.89887       7.522579 12.26459       4.167210 44.04149 7.262095 30.97895 5.731080 13.06254       9.251124 
1 1 1 -20 13 23 o 36.25364 4.450131 16.44109       3.849149 25.81231       10.12503 14.85793       4.161602 44.00742 9.702817 34.28520 5.139175 9.722218       10.97979 
1 1 1 -20 13 24 o 17.05508 6.024428 3.204709       3.121655 2.380958       6.381969 3.463779       3.579030 20.22411 8.235480 17.94084 6.438591 2.283272       10.45364 
1 1 1 -20 13 25 f 77.08775 3.034709 73.03104       5.689697 69.81243       9.608867 74.76886       7.060556 74.70914 5.312575 77.83129 3.733506 -3.122147      6.493268 
1 1 1 -20 13 26 o 43.64606 3.818716 23.68117       4.020742 24.80989       7.184086 23.16635       4.851789 43.72478 6.976604 42.94356 4.713645 0.7812157      8.419707 
1 1 1 -20 13 27 o 44.61904 3.915539 24.80923       4.214321 28.89761       7.479353 22.90742       5.101200 47.25425 6.681283 42.55624 5.015154 4.698002       8.354119 
1 1 1 -20 13 28 f 14.34704 5.850337 1.134691       3.225958 4.211370       6.119273 -0.4947831E-01 3.796345 21.20470 8.247374 14.15100 6.089625 7.053699       10.25196 
1 1 1 -20 13 29 o 34.43189 4.771860 15.13218       3.896422 6.992078       6.844742 19.03462       4.739255 24.26684 8.876373 38.54391 5.176405 -14.27707      10.27546 
1 1 1 -20 13 30 o 28.16826 6.564219 10.67585       4.422098 16.65158       6.700501 6.064683       5.885958 34.66589 8.081451 22.55298 8.234110 12.11291       11.53735 
1 1 1 -20 13 31 o 12.85587 5.865915 -2.141312      4.076509 -3.346546      6.001427 -1.108873      5.554577 15.25994 7.020195 15.94631 7.096816 -0.6863680     9.982381 
1 1 1 -20 13 32 o 19.65889 6.470647 5.034092       3.589634 8.516324       6.222188 3.296967       4.394706 24.88186 8.522187 18.06275 6.999249 6.819109       11.02802 
1 1 1 -20 13 33 o 11.42829 5.281943 -2.302871      3.454177 -1.973230      6.086778 -2.459457      4.195113 15.87650 7.214455 12.71095 5.855472 3.165552       9.291657 
1 1 1 -20 13 34 o 19.32814 6.574648 4.949552       3.702095 5.634593       6.146559 4.559563       4.637665 21.41635 8.283321 19.37354 7.265467 2.042816       11.01819 
1 1 1 -20 13 35 o 36.18463 5.624719 17.76704       4.798724 17.53505       9.622982 17.84382       5.536201 31.95748 10.59757 35.59222 6.626728 -3.634737      12.49888 
1 1 1 -20 13 36 o 22.89515 7.086499 7.678654       4.357243 17.97079       8.283899 3.742064       5.123209 32.68179 9.700588 18.54061 7.439775 14.14118       12.22504 
1 1 1 -20 13 37 o 30.63186 5.933872 13.28125       4.269409 14.36745       6.374618 12.39767       5.749383 29.82418 8.409819 27.98483 8.018823 1.839355       11.62009 
1 1 1 -20 13 38 o 20.70835 6.790464 6.411030       3.954727 5.587000       6.151286 6.991599       5.163226 20.20410 8.136516 21.36479 7.724836 -1.160685      11.21945 
1 1 1 -20 13 39 o 16.07108 6.737925 2.403702       4.444480 3.774308       6.034238 0.7784715      6.570884 18.37466 7.785143 16.79365 7.576709 1.581007       10.86347 
1 1 1 -20 13 40 o 31.25884 5.851583 14.32452       4.293622 14.64766       6.865905 14.11700       5.502238 28.13464 8.923068 29.21749 7.642112 -1.082846      11.74832 
1 1 1 -20 14 1  o 80.62349 3.041126 79.54976       5.964209 70.62193       11.24544 83.04393       7.035187 75.42558 6.172102 82.31780 3.515174 -6.892227      7.102907 
1 1 1 -20 14 2  o 117.8236 2.811520 169.5690       8.072528 183.4441       13.94007 162.5685       9.901722 122.1922 4.690214 115.2303 3.530372 6.961845       5.870403 
1 1 1 -20 14 3  o 171.7951 3.501199 360.9544       14.65763 360.6171       33.12528 361.0365       16.34485 170.1981 8.009193 171.7363 3.905555 -1.538269      8.910698 
1 1 1 -20 14 4  o 183.1562 3.186840 409.9861       14.22388 406.3249       23.22529 412.1835       17.99297 181.7913 5.248157 183.4810 4.024163 -1.689682      6.613399 
1 1 1 -20 14 5  o 166.3562 3.050978 338.1236       12.36842 344.8172       20.69181 334.4024       15.42800 167.5149 5.074696 165.3079 3.829834 2.206970       6.357686 
1 1 1 -20 14 6  o 90.62418 3.281395 100.5130       7.234709 97.64965       10.77639 102.8624       9.761566 89.06319 4.985122 91.52003 4.389705 -2.456848      6.642360 
1 1 1 -20 14 7  o 104.4157 2.753042 133.2279       6.998992 128.9244       12.06724 135.4094       8.591758 102.4015 4.849547 105.1941 3.355911 -2.792587      5.897478 
1 1 1 -20 14 8  o 91.06274 3.298875 101.4914       7.308435 93.19655       10.73264 108.6633       9.979758 86.98437 5.085428 94.07522 4.365100 -7.090851      6.701916 
1 1 1 -20 14 9  o 78.66540 2.775067 75.66457       5.311443 75.17581       9.745251 75.87111       6.335083 78.07831 5.150616 78.71489 3.310013 -0.6365814     6.122502 
1 1 1 -20 14 10 f 149.6547 3.207416 273.7270       11.69720 271.5332       17.82961 275.3847       15.49886 148.6649 4.928311 149.8753 4.247877 -1.210419      6.506359 
1 1 1 -20 14 11 o 226.3017 3.547366 626.3799       19.56275 630.5449       32.31628 623.9708       24.57763 226.2335 5.866715 225.6138 4.470318 0.6197510      7.375777 
1 1 1 -20 14 12 o 92.63324 2.701438 104.8793       6.091633 102.6452       11.17870 105.8230       7.265088 91.28761 5.044702 92.99006 3.210852 -1.702446      5.979848 
1 1 1 -20 14 13 o 93.31331 3.033222 106.5186       6.888212 134.1140       11.97682 92.87930       8.420150 104.4381 4.718123 86.99804 3.982241 17.44007       6.174053 
1 1 1 -20 14 14 o 138.9591 3.187219 236.0730       10.79282 239.6537       16.72036 233.5156       14.13100 139.5988 4.922753 137.9688 4.207887 1.630035       6.476095 
1 1 1 -20 14 15 o 169.9358 3.869269 353.7011       16.02322 315.8861       30.37079 368.2867       18.86192 159.1296 7.856224 173.1968 4.472739 -14.06721      9.040224 
1 1 1 -20 14 16 o 109.9686 2.682999 147.7391       7.189942 148.8231       13.36770 147.2979       8.528644 109.9006 5.004512 109.6979 3.193805 0.2027664      5.936795 
1 1 1 -20 14 17 o 71.92310 2.733166 63.30451       4.781670 65.01510       9.674942 62.75162       5.500409 72.41212 5.524486 71.55516 3.162219 0.8569641      6.365499 
1 1 1 -20 14 18 o 94.55727 2.993469 109.4624       6.889033 108.1357       11.57561 110.1899       8.572426 93.56111 5.096304 94.74921 3.719947 -1.188103      6.309542 
1 1 1 -20 14 19 o 73.91866 3.808025 67.18933       6.836339 71.83351       9.881860 62.92642       9.467531 76.10371 5.362735 71.17164 5.501433 4.932076       7.682753 
1 1 1 -20 14 20 o 78.27658 3.011721 75.10567       5.734185 74.83974       9.966038 75.23727       7.010937 77.65498 5.298175 78.22884 3.688056 -0.5738602     6.455417 
1 1 1 -20 14 21 o 87.73661 2.975954 94.35911       6.353516 104.3221       11.06447 89.45782       7.760529 91.77718 4.965697 85.27469 3.743645 6.502495       6.218764 
1 1 1 -20 14 22 o 22.88812 6.233234 6.747953       3.569798 2.688568       9.334589 7.443340       3.863477 23.75827 9.847077 24.00285 6.462521 -0.2445736     11.77833 
1 1 1 -20 14 23 o 44.66460 3.704275 24.69515       3.995603 35.32555       7.899159 21.04007       4.631856 52.81312 6.259210 40.98942 4.723376 11.82370       7.841428 
1 1 1 -20 14 24 o 56.50733 3.247040 39.34348       4.452419 47.84426       8.239275 35.83715       5.291585 61.71817 5.537004 53.74773 4.070334 7.970444       6.872119 
1 1 1 -20 14 25 o 23.82559 5.993181 7.401240       3.475985 6.389468       9.090100 7.574523       3.761889 25.83247 10.05064 24.08445 6.328417 1.748020       11.87704 
1 1 1 -20 14 26 o 63.03890 3.207696 49.02605       4.911430 51.44901       8.566915 47.83979       5.994344 63.80809 5.565132 62.06155 3.984590 1.746548       6.844534 
1 1 1 -20 14 27 o 25.73147 5.679714 8.660091       3.465980 18.14794       7.001124 5.579841       3.989119 36.67019 8.055298 21.05011 6.814294 15.62008       10.55094 
1 1 1 -20 14 28 o 41.00375 4.158758 21.13294       4.098088 24.77302       7.596593 19.63876       4.867037 43.08126 7.508736 39.16624 5.229970 3.915024       9.150613 
1 1 1 -20 14 29 o 63.60059 3.998406 50.62551       6.165679 41.90077       8.374156 60.95459       9.111625 56.81442 6.146225 69.04906 5.459439 -12.23465      8.220800 
1 1 1 -20 14 30 o 34.36290 5.936726 15.59652       4.791615 19.40981       6.765103 11.75772       6.787688 37.56594 7.650213 28.87358 8.828228 8.692360       11.68175 
1 1 1 -20 14 31 o 18.61469 6.937527 3.884824       4.215109 -1.275831      6.035524 8.798442       5.889295 16.42612 7.348062 25.23500 8.287174 -8.808882      11.07571 
1 1 1 -20 14 32 o 17.47131 6.283424 3.641636       3.410646 -3.784483      5.810934 7.544349       4.212581 14.56641 6.773153 23.33480 6.915421 -8.768387      9.679806 
1 1 1 -20 14 33 o 18.15288 6.445785 4.124733       3.577524 1.660662       6.315328 5.289113       4.341268 18.37819 7.880619 20.13111 7.105052 -1.752920      10.61065 
1 1 1 -20 14 34 o 9.727448 4.704845 -4.912814      3.404255 -5.678359      5.703191 -4.489082      4.243052 13.31525 6.347017 11.53668 5.492289 1.778570       8.393441 
1 1 1 -20 14 35 o 22.38565 7.038655 7.233903       4.280657 8.237284       9.521507 6.979725       4.792274 24.38316 10.00928 22.04381 7.480555 2.339346       12.49578 
1 1 1 -20 14 36 o 16.64879 6.709100 2.770865       4.185283 0.2668991      7.456923 3.922401       5.056897 17.96581 8.091507 18.53232 7.406734 -0.5665035     10.96960 
1 1 1 -20 14 37 o 32.41109 5.589128 14.70296       4.255020 12.78133       6.450905 16.18288       5.661158 27.68262 8.631359 32.59639 7.307840 -4.913773      11.30950 
1 1 1 -20 14 38 o 34.75574 5.151224 16.75647       4.231007 23.75977       6.676454 12.05636       5.469512 39.36797 7.225507 27.17319 7.832155 12.19478       10.65601 
1 1 1 -20 14 39 o 12.76092 5.691850 -0.1734051     3.593602 -0.8929570     5.727268 0.2938341      4.615153 14.97480 6.877631 14.47836 6.454602 0.4964390      9.432057 
1 1 1 -20 14 40 o 27.97352 6.180037 11.81639       4.100359 8.209640       6.566954 14.12104       5.249397 21.74607 8.518896 29.46684 7.338364 -7.720768      11.24381 
1 1 1 -20 15 1  o 63.58572 3.301056 49.58553       5.097521 47.04650       10.08035 50.45790       5.908690 61.26385 6.870263 64.07693 3.801100 -2.813080      7.851680 
1 1 1 -20 15 2  o 59.73406 3.337631 43.77672       4.839116 31.12596       9.637589 48.04130       5.595618 49.33480 8.311501 62.53906 3.688017 -13.20427      9.092993 
1 1 1 -20 15 3  o 106.4232 2.829508 138.4661       7.331583 137.6790       12.78741 138.8515       8.948433 105.7485 4.976133 106.4838 3.453044 -0.7352524     6.056849 
1 1 1 -20 15 4  o 314.2277 4.516620 1211.124       34.58551 1234.965       56.26145 1196.641       43.84912 315.6093 7.315180 311.6883 5.773037 3.921051       9.318789 
1 1 1 -20 15 5  o 181.8918 3.189573 404.4427       14.13780 401.2723       23.24645 406.3036       17.81013 180.5859 5.288162 182.1361 4.012684 -1.550156      6.638245 
1 1 1 -20 15 6  o 171.9967 3.477367 361.8460       14.57494 382.3493       22.05341 345.9457       19.42080 176.3280 5.137855 167.8288 4.753378 8.499191       6.999440 
1 1 1 -20 15 7  o 162.9537 3.013190 324.4813       11.96539 333.8421       20.32763 319.5184       14.80123 164.7773 5.068391 161.5731 3.759177 3.204193       6.310309 
1 1 1 -20 15 8  o 133.3960 3.285973 217.5643       10.68176 231.1817       16.07621 206.8001       14.29311 137.1540 4.817413 129.7769 4.526460 7.377136       6.610319 
1 1 1 -20 15 9  o 103.3203 3.030403 130.5656       7.621712 128.2235       12.26926 132.0373       9.725927 102.0660 4.947625 103.7807 3.852413 -1.714699      6.270573 
1 1 1 -20 15 10 o 209.6287 3.817752 537.9838       19.50270 550.4097       28.96392 527.6768       26.37892 211.3771 5.627945 207.1171 5.230612 4.259979       7.683298 
1 1 1 -20 15 11 o 67.42403 3.758430 55.82129       6.150850 50.51175       9.180784 60.14549       8.285221 63.73799 5.980654 69.81197 4.901246 -6.073986      7.732427 
1 1 1 -20 15 12 o 158.9710 3.346389 309.1031       12.96375 319.3723       19.87391 301.4974       17.10345 161.1153 5.068166 156.7027 4.483505 4.412582       6.766692 
1 1 1 -20 15 13 o 113.8551 2.696402 158.3536       7.481236 163.4525       13.66671 156.1720       8.939572 115.2375 4.877726 112.9561 3.251044 2.281311       5.861867 
1 1 1 -20 15 14 o 151.9985 2.910709 282.3864       10.78137 285.7650       18.93721 280.7661       13.11420 152.3277 5.108765 151.4458 3.553436 0.8818665      6.223053 
1 1 1 -20 15 15 o 110.6966 3.210611 150.0272       8.651651 0.000000       0.000000 150.0272       8.651651 ?        ?        110.6966 3.210611 0.000000       3.210611 
1 1 1 -20 15 16 o 52.68237 3.056968 34.05994       3.907715 43.27124       8.546835 31.62548       4.393861 58.85728 6.044758 50.68887 3.580146 8.168411       7.025421 
1 1 1 -20 15 17 o 52.04177 3.132545 33.26015       3.954306 25.91088       7.988914 35.64501       4.550893 44.98896 7.554441 53.83281 3.487848 -8.843853      8.320737 
1 1 1 -20 15 18 o 57.02845 2.976250 39.89971       4.121843 37.76552       8.619748 40.53239       4.693200 54.74325 6.594060 57.42532 3.368534 -2.682068      7.404637 
1 1 1 -20 15 19 o 19.15021 6.963892 3.810820       4.204061 3.641564       7.140904 3.900604       5.200921 22.24939 8.831347 20.35738 7.681201 1.892004       11.70442 
1 1 1 -20 15 20 f 75.76827 3.351574 70.52753       6.173000 79.76411       14.30125 68.41260       6.843335 79.34583 7.484723 74.53790 3.779850 4.807922       8.385008 
1 1 1 -20 15 21 o 96.67149 3.296868 114.7647       7.755328 114.9316       16.54408 114.7177       8.779734 95.37240 7.170940 96.54405 3.738879 -1.171654      8.087126 
1 1 1 -20 15 22 o 98.03361 2.967602 117.9059       7.081355 119.4684       11.90867 117.0511       8.807730 98.07040 4.999477 97.48886 3.714223 0.5815353      6.228180 
1 1 1 -20 15 23 o 105.4242 2.954007 136.4243       7.581575 160.2150       12.94458 124.0019       9.353833 113.6337 4.684649 100.2512 3.835889 13.38248       6.054749 
1 1 1 -20 15 24 o 107.6254 3.008237 142.3371       7.882004 144.8727       12.93797 140.8406       9.939412 107.8156 4.937451 106.7799 3.825936 1.035728       6.246295 
1 1 1 -20 15 25 o 25.43198 5.877629 8.449541       3.569614 12.22441       9.623046 7.847243       3.843853 30.75113 10.59596 24.45630 6.382873 6.294832       12.36994 
1 1 1 -20 15 26 o 87.52384 2.974378 94.34353       6.334717 104.2299       10.80435 89.16467       7.819814 91.19328 4.879595 84.80122 3.793666 6.392059       6.180805 
1 1 1 -20 15 27 o 37.79890 4.302412 18.01867       3.892573 32.84552       7.617156 12.77809       4.528541 50.34448 6.349717 31.17090 6.180139 19.17357       8.860758 
1 1 1 -20 15 28 o 50.81740 3.656667 32.21711       4.498010 38.56343       8.167136 29.45405       5.388945 54.46412 6.267650 48.23294 4.642102 6.231178       7.799522 
1 1 1 -20 15 29 o 24.75776 6.985857 8.309508       4.397142 13.44811       6.659589 4.337771       5.854844 30.88304 8.554997 20.74753 8.067872 10.13552       11.75919 
1 1 1 -20 15 30 o 12.03292 5.615502 -3.320702      4.052378 -0.2188022     5.659804 -6.583570      5.804801 16.65395 7.297679 13.37404 6.382877 3.279909       9.695217 
1 1 1 -20 15 31 o 18.67219 6.344301 4.437328       3.447110 -1.202083      6.032954 7.170901       4.200282 16.37112 7.333268 22.85400 6.936109 -6.482880      10.09388 
1 1 1 -20 15 32 o 13.16807 5.678213 0.1668797      3.313720 11.70014       6.319836 -4.206240      3.891575 28.08995 8.504454 11.10934 5.280598 16.98061       10.01052 
1 1 1 -20 15 33 f 31.49156 5.496945 13.37638       4.065055 14.50075       6.791702 12.74874       5.074351 30.81759 8.677314 29.83508 7.085397 0.9825115      11.20262 
1 1 1 -20 15 34 o 36.66719 5.081776 17.92985       4.418858 17.89711       7.506223 17.94720       5.466469 33.71453 8.977175 35.74658 6.515302 -2.032051      11.09229 
1 1 1 -20 15 35 o 25.71923 6.906522 9.717578       4.419627 4.235256       8.965265 11.47763       5.079769 21.43189 9.290719 27.66754 7.393146 -6.235655      11.87333 
1 1 1 -20 15 36 o 18.60129 6.690960 4.716594       3.867605 5.112645       5.920554 4.421775       5.108164 20.00973 8.008532 18.91968 7.482173 1.090046       10.95990 
1 1 1 -20 15 37 o 20.55385 6.732204 6.297735       3.887632 -0.6718402     6.119258 11.01463       5.034122 15.77829 7.194571 26.41139 7.482403 -10.63310      10.38018 
1 1 1 -20 15 38 o 15.06150 6.536702 1.217495       4.448428 -0.7408914     6.164398 3.345492       6.425796 15.59001 7.150965 18.31622 7.902682 -2.726207      10.65780 
1 1 1 -20 15 39 o 9.546676 4.662985 -5.394229      3.572745 -6.503098      5.906938 -4.754563      4.486413 12.59373 6.116164 11.35456 5.469247 1.239173       8.204884 
1 1 1 -20 16 1  f 66.62587 3.185753 54.42646       5.157402 43.47271       9.897264 58.50955       6.042655 58.76148 7.052476 69.02653 3.604818 -10.26505      7.920362 
1 1 1 -20 16 2  o 84.07215 3.411727 86.64436       6.975245 75.88078       11.90434 92.27186       8.607656 78.08144 6.310067 86.65191 4.087867 -8.570465      7.518484 
1 1 1 -20 16 3  o 105.9488 2.957228 137.3221       7.627669 140.0264       15.55918 136.4665       8.751444 106.3225 6.029891 105.5488 3.406901 0.7736740      6.925790 
1 1 1 -20 16 4  o 92.22626 3.189289 104.1429       7.156992 97.47684       18.78052 105.2755       7.741142 87.77830 8.902795 92.69141 3.433053 -4.913109      9.541782 
1 1 1 -20 16 5  o 198.6487 3.734879 483.2144       18.08000 512.2916       27.40970 460.8185       24.05538 203.8665 5.522333 193.5083 5.105710 10.35814       7.520933 
1 1 1 -20 16 6  o 127.6784 2.858852 199.2038       8.894988 203.7280       15.35058 196.9169       10.91405 128.6686 4.904695 126.7979 3.535590 1.870636       6.046191 
1 1 1 -20 16 7  o 224.2180 4.011708 616.0411       21.91976 612.6975       31.96675 619.0085       30.11454 222.8057 5.892742 224.1952 5.512059 -1.389481      8.068903 
1 1 1 -20 16 8  o 60.70660 4.525864 45.47411       6.647176 46.75663       8.604208 43.57552       10.46874 61.31271 5.828722 58.78001 7.477530 2.532700       9.480899 
1 1 1 -20 16 9  o 155.3438 4.058165 295.9613       15.34926 284.2253       18.68889 320.2851       26.90536 151.9570 5.053956 160.6326 6.889375 -8.675583      8.544353 
1 1 1 -20 16 10 o 53.71569 3.149725 35.40333       4.104877 34.31489       8.221293 35.76479       4.737689 52.26244 6.602338 53.92947 3.626067 -1.667023      7.532545 
1 1 1 -20 16 11 o 72.60078 2.835290 64.51216       5.006557 60.31633       9.545823 66.10429       5.880208 69.72100 5.667243 73.43545 3.294260 -3.714447      6.555134 
1 1 1 -20 16 12 o 128.8249 2.802618 202.8205       8.798324 213.9428       15.78304 197.8059       10.59774 131.8089 4.922359 127.0828 3.425205 4.726158       5.996803 
1 1 1 -20 16 13 o 171.9615 3.070297 361.6553       12.86612 383.3062       22.46891 351.0927       15.69380 176.3316 5.234761 169.2623 3.804798 7.069321       6.471415 
1 1 1 -20 16 14 o 107.7881 3.239542 142.3074       8.499579 0.000000       0.000000 142.3074       8.499579 ?        ?        107.7881 3.239542 0.000000       3.239542 
1 1 1 -20 16 15 o 108.3593 2.708294 143.5263       7.151515 132.2917       12.80922 148.6142       8.620098 103.4912 5.094717 110.1448 3.214970 -6.653610      6.024299 
1 1 1 -20 16 16 o 59.88943 2.988682 43.99160       4.348020 44.33482       9.142147 43.89127       4.942836 59.43152 6.413875 59.76205 3.408152 -0.3305321     7.263146 
1 1 1 -20 16 17 o 189.3280 3.210586 439.0037       14.81273 472.6039       26.13256 423.0975       17.98023 195.4029 5.493462 185.6130 3.975126 9.789917       6.780837 
1 1 1 -20 16 18 o 27.77883 4.809819 9.782708       3.138097 7.791382       7.220267 10.24647       3.484403 26.04981 9.165602 28.35790 5.234986 -2.308086      10.55525 
1 1 1 -20 16 19 o 82.27740 4.178703 83.53395       8.350907 86.44197       14.19108 81.99351       10.32857 82.73694 7.107297 81.21982 5.246524 1.517120       8.834007 
1 1 1 -20 16 20 o 107.4751 3.321047 141.8612       8.687553 148.6882       18.64484 139.9679       9.818537 108.5374 7.088035 106.6292 3.784632 1.908157       8.035152 
1 1 1 -20 16 21 o 97.99513 2.972916 117.8331       7.091217 134.4896       12.33706 109.6150       8.665779 104.0950 4.877026 94.30839 3.778341 9.786591       6.169379 
1 1 1 -20 16 22 o 84.03759 3.004769 86.75888       6.143577 89.61120       10.71875 85.36343       7.497264 84.72213 5.217024 83.18079 3.707974 1.541344       6.400501 
1 1 1 -20 16 23 o 46.46195 3.753946 26.78935       4.214157 19.94186       7.901932 29.51096       4.981734 38.55669 8.626107 48.66099 4.243510 -10.10429      9.613381 
1 1 1 -20 16 24 o 37.36353 4.334024 17.53432       3.873045 15.16108       7.528446 18.38850       4.516579 33.40173 9.033380 38.09713 4.984409 -4.695404      10.31728 
1 1 1 -20 16 25 o 24.46198 6.235868 7.880961       3.727890 13.47900       10.24476 7.026593       4.002266 31.78807 10.93369 23.16842 6.706409 8.619648       12.82659 
1 1 1 -20 16 26 o 28.74032 5.333152 10.71350       3.597693 5.227817       6.911980 12.75195       4.213442 22.77293 8.790391 31.28967 5.737222 -8.516745      10.49698 
1 1 1 -20 16 27 o 31.91889 4.995420 13.11680       3.758255 11.45449       7.031572 13.78159       4.446695 28.85746 9.013567 32.43957 5.839773 -3.582108      10.73999 
1 1 1 -20 16 28 o 22.83368 6.115098 6.964242       3.470513 1.228958       6.431392 9.320392       4.122199 18.80052 8.004140 26.30141 6.475465 -7.500889      10.29553 
1 1 1 -20 16 29 o 55.73454 6.021436 40.70435       8.048570 40.70435       8.048570 0.000000       0.000000 55.73454 6.021436 ?        ?        0.000000       6.021436 
1 1 1 -20 16 30 o 41.18096 4.221257 21.62977       4.176289 16.68086       6.881835 24.51483       5.254443 33.99789 8.364655 43.46345 5.055190 -9.465561      9.773556 
1 1 1 -20 16 31 o 57.92798 3.458809 42.19566       4.860366 45.01466       8.152770 40.64134       6.053779 58.24041 5.822363 56.28155 4.450110 1.958862       7.328260 
1 1 1 -20 16 32 o 29.60674 5.586094 11.86399       3.882546 10.61006       6.388580 12.59834       4.888982 26.64613 8.623332 29.83266 6.867298 -3.186533      11.02369 
1 1 1 -20 16 33 o 29.50728 5.790276 11.95831       4.014801 22.82821       7.031793 6.701150       4.890224 39.67842 7.548092 21.87593 7.552823 17.80250       10.67796 
1 1 1 -20 16 34 o 16.17180 6.777482 1.798209       4.494109 0.000000       0.000000 1.798209       4.494109 ?        ?        16.17180 6.777482 0.000000       6.777482 
1 1 1 -20 16 35 o 52.55749 3.977028 35.81039       5.055851 35.80283       8.126688 35.81517       6.457730 49.75359 6.887241 51.47465 5.220248 -1.721062      8.642053 
1 1 1 -20 16 36 o 18.31911 6.635287 4.600555       3.811593 8.986684       6.074492 1.752129       4.895215 23.61988 8.397987 16.22372 6.947115 7.396166       10.89902 
1 1 1 -20 16 37 o 24.58393 6.513993 9.139313       3.964393 8.795803       6.382555 9.355084       5.058509 22.97273 8.541666 24.05138 7.662715 -1.078655      11.47507 
1 1 1 -20 16 38 o 28.39140 6.939047 12.58258       4.759673 11.70846       6.537819 13.56835       6.942811 25.53220 8.735928 27.18771 9.001080 -1.655512      12.54336 
1 1 1 -20 16 39 o 12.06838 5.541062 -1.235463      3.713622 -4.413873      6.078215 0.6576858      4.690978 13.55109 6.484794 14.70095 6.533431 -1.149852      9.205339 
1 1 1 -20 17 1  o 45.25767 4.009740 25.32895       4.376549 29.44310       8.672988 23.92342       5.069308 47.97818 7.676726 43.82637 4.826347 4.151814       9.067842 
1 1 1 -20 17 2  o 61.43944 4.231484 46.56399       6.296737 0.000000       0.000000 46.56399       6.296737 ?        ?        61.43944 4.231484 0.000000       4.231484 
1 1 1 -20 17 3  f 91.00813 3.343236 101.5258       7.401923 114.0904       14.20782 96.84517       8.671706 95.83026 6.115911 88.76327 4.019421 7.066994       7.318477 
1 1 1 -20 17 4  o 89.44040 3.582128 98.13810       7.791687 146.2793       21.10675 90.54250       8.383861 107.8523 8.089700 85.82690 4.019691 22.02537       9.033337 
1 1 1 -20 17 5  o 91.66119 3.081834 102.8783       6.874053 119.9272       11.60484 93.66296       8.531934 98.62859 4.843175 87.30069 4.021256 11.32790       6.294986 
1 1 1 -20 17 6  f 71.93284 3.277125 63.44677       5.729464 67.68709       9.820913 61.25896       7.054346 73.89209 5.493331 70.54871 4.121230 3.343384       6.867404 
1 1 1 -20 17 7  o 95.12762 2.813765 110.7043       6.515579 128.1314       12.30868 103.9200       7.679801 101.9288 4.970380 92.07348 3.428772 9.855362       6.038308 
1 1 1 -20 17 8  o 72.25269 3.477895 64.06209       6.105615 60.99124       9.319387 66.37138       8.081585 70.12030 5.497837 73.36575 4.542579 -3.245445      7.131706 
1 1 1 -20 17 9  o 39.98210 3.779290 19.76171       3.638538 30.88193       7.717582 16.58352       4.125856 49.50777 6.558076 36.42530 4.762012 13.08247       8.104635 
1 1 1 -20 17 10 o 148.5057 2.937516 269.6701       10.63064 274.8839       18.36809 267.0441       13.03572 149.3341 5.054701 147.6446 3.623107 1.689438       6.219076 
1 1 1 -20 17 11 f 124.0248 2.795392 188.0421       8.448651 201.5544       15.23960 182.0464       10.15148 127.8775 4.899451 121.8845 3.421168 5.993019       5.975701 
1 1 1 -20 17 12 o 112.6951 2.743574 155.2525       7.534560 160.6333       13.72490 152.9314       9.014336 114.1084 4.947530 111.7172 3.314806 2.391243       5.955333 
1 1 1 -20 17 13 o 77.07857 2.919626 72.77125       5.474080 63.11766       12.32012 75.14586       6.110365 70.79578 7.243188 78.28537 3.209759 -7.489586      7.922520 
1 1 1 -20 17 14 o 92.63344 3.005458 105.1108       6.775468 102.0752       17.97720 105.6134       7.314889 89.72379 8.316664 92.81528 3.239055 -3.091492      8.925154 
1 1 1 -20 17 15 o 89.42861 2.725380 97.89838       5.932428 103.0427       11.38286 95.98001       6.951101 91.21835 5.141559 88.46423 3.229828 2.754120       6.071855 
1 1 1 -20 17 16 o 66.52882 2.882086 54.26976       4.661454 54.61373       9.430058 54.15853       5.362427 66.08254 5.918474 66.39172 3.325032 -0.3091736     6.788532 
1 1 1 -20 17 17 f 52.73473 3.275545 34.22120       4.188582 26.19441       11.48167 35.45342       4.498610 44.09920 10.77694 53.64930 3.459388 -9.550102      11.31856 
1 1 1 -20 17 18 o 51.04507 3.874515 32.21935       4.783561 37.33729       11.66793 31.18533       5.244576 53.29246 9.323870 50.12141 4.336509 3.171051       10.28299 
1 1 1 -20 17 19 o 41.10223 5.081596 21.23584       4.981521 17.71573       7.871103 23.58792       6.434045 36.48987 8.926418 43.01228 6.327314 -6.522408      10.94147 
1 1 1 -20 17 20 o 85.64316 2.678656 89.92020       5.583562 85.81631       10.71051 91.45174       6.543004 82.91518 5.328999 86.27705 3.117168 -3.361877      6.173732 
1 1 1 -20 17 21 o 28.47099 5.196713 10.38445       3.472704 16.46985       7.267534 8.583843       3.953227 35.09042 8.573256 25.63947 6.358448 9.450951       10.67383 
1 1 1 -20 17 22 o 82.92806 3.044883 84.59068       6.142855 94.50362       10.99841 80.09641       7.405582 86.88366 5.218699 80.48402 3.786454 6.399643       6.447640 
1 1 1 -20 17 23 o 34.71205 4.549318 15.21564       3.755716 19.55784       7.350982 13.68180       4.368981 38.21331 8.143206 32.56127 5.714406 5.652035       9.948177 
1 1 1 -20 17 24 o 21.92455 6.141417 6.279065       3.411343 5.746646       7.136670 6.436741       3.883770 23.52848 8.969923 22.26213 6.650517 1.266352       11.16642 
1 1 1 -20 17 25 o 52.74402 3.946357 34.72362       5.035537 39.53994       12.66095 33.81861       5.488287 53.09755 10.15482 51.90583 4.379780 1.191723       11.05906 
1 1 1 -20 17 26 o 37.87502 4.394845 18.16538       3.981106 23.19882       7.660292 16.30280       4.659835 41.34504 7.890792 35.44947 5.578279 5.895573       9.663426 
1 1 1 -20 17 27 o 27.81472 5.480511 10.17228       3.582591 13.14830       6.869997 9.060669       4.198703 30.55048 8.769181 25.90656 6.625307 4.643923       10.99060 
1 1 1 -20 17 28 o 14.71513 6.471117 -0.5553029     4.486386 8.819077       6.711286 -8.128821      6.032306 25.59362 8.847512 13.12226 6.326038 12.47136       10.87645 
1 1 1 -20 17 29 o 41.88274 4.960593 22.70849       4.964783 20.41213       6.900754 25.17257       7.148316 38.19115 7.681231 42.90627 7.083683 -4.715126      10.44892 
1 1 1 -20 17 30 o 18.58184 6.358873 4.410249       3.464010 3.385725       6.025459 4.916019       4.233557 19.59482 7.993526 19.72781 7.011224 -0.1329937     10.63267 
1 1 1 -20 17 31 o 40.43383 4.310392 21.08696       4.181745 16.60633       6.845287 23.75466       5.281899 33.35749 8.421193 42.41751 5.219810 -9.060024      9.907720 
1 1 1 -20 17 32 o 42.36583 4.353654 23.25739       4.430856 20.71281       7.175613 24.82554       5.633064 37.36911 8.112836 43.05651 5.493667 -5.687405      9.797881 
1 1 1 -20 17 33 o 32.06893 5.434724 13.98042       4.095645 10.64981       6.521569 16.14953       5.262966 26.17938 8.725486 33.70835 6.643356 -7.528971      10.96669 
1 1 1 -20 17 34 o 46.07326 5.509577 28.94892       6.063418 0.000000       0.000000 28.94892       6.063418 ?        ?        46.07326 5.509577 0.000000       5.509577 
1 1 1 -20 17 35 o 20.28710 6.764881 5.986337       3.919977 6.168982       6.372552 5.875156       4.971927 21.05697 8.347625 20.31620 7.541746 0.7407665      11.24992 
1 1 1 -20 17 36 o 30.41729 5.821672 13.25919       4.158099 12.16433       6.673330 13.95403       5.316253 26.46985 8.826523 29.90095 7.349026 -3.431103      11.48546 
1 1 1 -20 17 37 o 41.63949 4.489062 23.40249       4.483197 25.82285       7.427960 22.01557       5.622833 40.06826 7.888265 38.82713 6.147176 1.241127       10.00063 
1 1 1 -20 17 38 o 10.72689 5.109131 -3.367768      3.680345 -5.842541      6.153979 -1.989821      4.592029 13.12827 6.343876 12.91150 6.009516 0.2167788      8.738366 
1 1 1 -20 18 1  o 107.2009 3.437332 141.0176       8.967973 143.2905       15.68181 139.9130       10.93197 107.2878 6.022219 106.5905 4.216984 0.6972733      7.351875 
1 1 1 -20 18 2  o 28.83904 5.289685 10.58479       3.580511 3.054234       7.858382 12.55770       4.022280 22.58574 9.160194 31.44219 5.446789 -8.856457      10.65724 
1 1 1 -20 18 3  o 101.1137 3.988071 125.7176       9.807460 0.000000       0.000000 125.7176       9.807460 ?        ?        101.1137 3.988071 0.000000       3.988071 
1 1 1 -20 18 4  o 152.3478 3.745265 284.6639       13.90448 0.000000       0.000000 284.6639       13.90448 ?        ?        152.3478 3.745265 0.000000       3.745265 
1 1 1 -20 18 5  o 169.2660 3.489360 351.0625       14.39301 338.6928       21.48731 361.1295       19.38433 165.5569 5.332927 171.2433 4.649467 -5.686432      7.075143 
1 1 1 -20 18 6  o 38.27951 4.072044 18.18768       3.740299 16.10423       7.593400 18.85513       4.297853 35.06348 8.879097 38.88224 4.626532 -3.818760      10.01215 
1 1 1 -20 18 7  o 72.08450 2.911214 63.65997       5.103378 80.15045       10.16880 58.10818       5.900233 80.44463 5.215351 68.77341 3.532401 11.67122       6.299027 
1 1 1 -20 18 8  o 135.8510 3.374074 226.0453       11.17001 226.1152       16.46172 225.9856       15.20641 135.3634 4.999017 135.4512 4.613624 -0.8784485E-01 6.802624 
1 1 1 -20 18 9  o 104.0856 2.777336 132.5695       7.038287 113.4249       12.36067 141.7549       8.561834 95.71497 5.320323 107.5459 3.270708 -11.83096      6.245268 
1 1 1 -20 18 10 o 120.5807 2.797267 177.8131       8.219549 179.4998       14.66086 177.0399       9.926324 120.5650 5.000874 120.1670 3.393142 0.3979950      6.043356 
1 1 1 -20 18 11 o 83.12129 2.796300 84.59809       5.656053 85.15648       10.67142 84.37995       6.669983 82.87127 5.312212 82.93320 3.306983 -0.6192780E-01 6.257453 
1 1 1 -20 18 12 o 70.48613 3.777231 61.14109       6.464341 75.03886       12.97607 56.55343       7.455324 77.24890 6.967929 67.62880 4.550235 9.620102       8.322060 
1 1 1 -20 18 13 o 94.14406 2.725173 108.5029       6.245481 128.3148       12.25636 101.5541       7.258568 101.8511 4.952947 90.98012 3.279286 10.87099       5.940152 
1 1 1 -20 18 14 o 121.4660 3.076081 180.8209       9.097851 204.1707       23.28160 176.6127       9.883740 127.2655 7.540799 119.9698 3.384132 7.295654       8.265349 
1 1 1 -20 18 15 o 91.78649 2.943839 103.2714       6.576077 113.9422       16.23821 101.1780       7.192255 95.10030 7.057101 90.78947 3.256097 4.310829       7.772055 
1 1 1 -20 18 16 o 115.1009 3.390270 162.6998       9.498954 175.7147       19.71556 158.7653       10.84007 118.2026 6.874231 113.5482 3.923456 4.654343       7.915085 
1 1 1 -20 18 17 o 41.40755 4.139687 21.32779       4.121242 18.19719       8.566785 22.27048       4.700960 36.89150 9.478897 42.21224 4.646727 -5.320740      10.55659 
1 1 1 -20 18 18 o 86.44190 3.172847 91.80850       6.672246 91.98978       11.19169 91.70855       8.310679 85.86516 5.375603 86.19345 3.967276 -0.3282928     6.681047 
1 1 1 -20 18 19 o 156.6995 2.984375 301.2201       11.39612 283.6186       19.42868 310.4523       14.07094 150.8770 5.292458 158.8234 3.635571 -7.946442      6.420863 
1 1 1 -20 18 20 o 17.59244 5.918116 3.666161       2.999305 4.453281       6.827023 3.477903       3.338770 22.34702 8.705721 17.64488 6.230621 4.702141       10.70562 
1 1 1 -20 18 21 o 34.95118 3.939807 15.27729       3.297222 17.60990       7.552698 14.72805       3.664907 36.12243 8.686954 34.17290 4.511000 1.949528       9.788376 
1 1 1 -20 18 22 o 50.37491 3.721766 31.51502       4.536507 38.72055       9.116794 29.14377       5.229962 54.65771 7.005568 48.21899 4.502933 6.438717       8.327928 
1 1 1 -20 18 23 o 65.21134 3.313898 52.58170       5.248947 52.00767       9.490982 52.83464       6.300116 63.71905 6.190232 65.15722 3.986888 -1.438168      7.363033 
1 1 1 -20 18 24 o 23.06100 6.502537 7.019450       3.811127 -6.036229      10.76431 8.890566       4.075088 20.18347 9.326952 25.85767 6.480613 -5.674204      11.35739 
1 1 1 -20 18 25 o 54.09561 3.566521 36.43887       4.675339 33.13363       8.237841 38.00938       5.678484 50.11462 6.930812 55.00203 4.270026 -4.887417      8.140594 
1 1 1 -20 18 26 o 16.33689 6.143956 2.717055       3.321425 8.502896       6.708228 0.8379981      3.822913 25.46096 8.843200 14.91461 6.250782 10.54635       10.82933 
1 1 1 -20 18 27 f 57.03456 4.486827 41.27671       6.185925 48.63164       8.626920 33.49306       8.874785 61.10675 5.865295 49.55955 7.589711 11.54721       9.591945 
1 1 1 -20 18 28 o 47.34355 4.501952 28.65298       5.131514 24.83406       7.383651 32.22078       7.136759 42.41840 7.412683 49.33301 6.063876 -6.914608      9.576975 
1 1 1 -20 18 29 o 23.40995 6.331437 7.543458       3.698258 21.59027       6.895089 1.870368       4.381882 39.19492 7.491958 16.48373 6.780893 22.71119       10.10495 
1 1 1 -20 18 30 o 15.90462 6.217074 2.451072       3.491313 3.858411       6.232290 1.807431       4.214735 20.01383 8.142628 16.10749 6.640693 3.906343       10.50720 
1 1 1 -20 18 31 o 12.21297 5.509861 -1.190445      3.474541 -3.758079      5.799644 0.2470621      4.339501 14.37025 6.710122 14.79858 6.439048 -0.4283314     9.299843 
1 1 1 -20 18 32 f 15.27221 6.202901 1.917547       3.609405 7.121687       6.116822 -0.8624802     4.470704 22.54578 8.365930 14.05518 6.303021 8.490600       10.47458 
1 1 1 -20 18 33 o 16.98405 6.719791 3.078213       4.121977 -11.11406      8.055945 8.111587       4.797556 14.20609 6.952266 23.33338 7.465542 -9.127289      10.20139 
1 1 1 -20 18 34 o 22.89531 7.291894 7.925533       4.581082 5.436526       10.47019 8.514837       5.094614 22.31601 9.846846 23.50715 7.707147 -1.191145      12.50442 
1 1 1 -20 18 35 o 51.12189 4.020163 34.25227       4.967988 26.20937       7.619739 40.19921       6.552102 40.82235 7.945567 54.39179 4.999106 -13.56944      9.387390 
1 1 1 -20 18 36 o 26.23773 6.211759 10.22782       3.909794 3.363991       6.259275 14.61940       5.006698 18.28463 7.843129 30.98539 6.816241 -12.70075      10.39114 
1 1 1 -20 18 37 o 15.86220 6.750958 2.146739       4.572539 0.8444180      6.264295 3.631966       6.689746 16.44486 7.410522 18.48904 8.020200 -2.044176      10.91968 
1 1 1 -20 19 1  o 100.8498 3.011805 124.7119       7.393514 141.5693       15.43709 119.6940       8.422346 106.4935 5.972413 98.68670 3.507758 7.806778       6.926332 
1 1 1 -20 19 2  o 67.13292 3.426415 55.42860       5.586925 55.80216       10.94804 55.29707       6.496509 66.44849 6.859547 66.94034 4.000755 -0.4918518     7.940997 
1 1 1 -20 19 3  o 25.47938 5.638039 8.357013       3.407927 -2.866415      7.732787 11.06235       3.796503 18.56587 8.310406 29.42898 5.495922 -10.86310      9.963333 
1 1 1 -20 19 4  o 55.55650 4.383182 38.23242       5.886136 0.000000       0.000000 38.23242       5.886136 ?        ?        55.55650 4.383182 0.000000       4.383182 
1 1 1 -20 19 5  o 136.9847 3.274825 229.9631       10.93191 262.9888       27.66043 223.8496       11.90079 144.3116 7.895496 135.0179 3.620265 9.293686       8.685918 
1 1 1 -20 19 6  o 54.83123 3.263540 36.96873       4.340940 29.37469       8.067340 40.06358       5.150075 47.97979 7.115037 57.01143 3.727380 -9.031635      8.032254 
1 1 1 -20 19 7  o 177.4779 3.193415 385.8799       13.81134 395.9208       23.47716 380.5658       17.07948 178.8000 5.394347 175.9873 3.982512 2.812683       6.705176 
1 1 1 -20 19 8  o 46.04704 4.527125 26.36168       5.014350 33.09667       8.141547 22.24553       6.364786 51.10400 6.698681 41.80963 6.454575 9.294369       9.302358 
1 1 1 -20 19 9  o 118.7008 2.794045 172.4055       8.082081 176.1424       14.40432 170.6885       9.763837 119.3395 4.963885 117.9405 3.400755 1.399055       6.017083 
1 1 1 -20 19 10 o 125.9463 2.821271 194.1283       8.658975 188.0063       15.05378 197.1553       10.58540 123.2610 5.022201 126.7460 3.430335 -3.484940      6.081915 
1 1 1 -20 19 11 o 41.73682 3.779491 21.56741       3.802423 18.53909       7.657913 22.55834       4.380587 37.53456 8.562289 42.59991 4.277586 -5.065342      9.571340 
1 1 1 -20 19 12 o 101.4433 2.786009 126.0508       6.880670 137.0456       12.92968 121.7070       8.126999 105.1525 5.060680 99.56055 3.354497 5.591988       6.071502 
1 1 1 -20 19 13 o 39.19305 4.202582 19.12635       3.951244 29.96293       9.715538 16.97878       4.325084 47.87174 8.646327 36.74017 4.957143 11.13158       9.966557 
1 1 1 -20 19 14 o 64.26690 4.081403 51.05509       6.358920 0.000000       0.000000 51.05509       6.358920 ?        ?        64.26690 4.081403 0.000000       4.081403 
1 1 1 -20 19 15 o 187.1967 3.663046 430.7934       16.71001 430.1364       25.82898 431.2663       21.91379 185.7976 5.711460 186.6350 4.822279 -0.8373871     7.474968 
1 1 1 -20 19 16 o 51.05607 3.271127 32.12964       4.048463 39.73487       8.956787 30.17692       4.538543 55.86181 6.714038 49.37305 3.801410 6.488766       7.715506 
1 1 1 -20 19 17 o 145.5953 2.924198 259.9601       10.37505 303.6829       19.42927 242.5196       12.27105 156.2558 5.109385 140.3529 3.590717 15.90289       6.244923 
1 1 1 -20 19 18 o 78.96203 3.247276 76.75064       6.235135 84.26375       10.69344 72.88055       7.674820 82.03252 5.378955 76.70313 4.121132 5.329391       6.776200 
1 1 1 -20 19 19 o 21.95778 5.602650 6.265021       3.007307 1.468531       7.003875 7.349214       3.329890 20.12153 8.448648 23.74853 5.803792 -3.626999      10.25006 
1 1 1 -20 19 20 o 14.37801 5.587176 1.694471       2.806399 5.637169       7.076585 0.9586748      3.057072 23.50698 8.939152 13.88639 5.682698 9.620592       10.59252 
1 1 1 -20 19 21 o 75.42192 2.830251 69.99220       5.192632 65.21898       10.39305 71.58009       5.994437 71.58602 6.013232 76.16023 3.237247 -4.574211      6.829255 
1 1 1 -20 19 22 o 11.02923 4.930338 -1.035344      2.712095 -17.12769      6.893733 1.911437       2.949978 11.85066 5.910498 14.85643 5.740540 -3.005768      8.239405 
1 1 1 -20 19 23 o 21.68625 5.549534 6.177307       2.944594 2.963179       7.081121 6.849297       3.237814 21.02067 8.630695 22.79349 5.812080 -1.772823      10.40525 
1 1 1 -20 19 24 o 79.45784 3.500846 78.42297       6.762052 78.05447       15.46835 78.51002       7.518515 75.86390 8.513793 79.31972 3.901661 -3.455818      9.365235 
1 1 1 -20 19 25 o 29.36386 5.500546 11.32292       3.791399 19.11088       7.487839 8.637828       4.396675 36.90448 8.501269 25.23909 6.935523 11.66539       10.97147 
1 1 1 -20 19 26 o 33.76283 6.558996 15.36552       5.201974 21.64897       7.399637 9.225821       7.314507 39.42924 7.975468 26.16706 9.223677 13.26218       12.19362 
1 1 1 -20 19 27 o 46.27187 3.920195 27.07534       4.378831 24.80986       7.593552 28.20397       5.359709 42.22818 7.661210 46.83685 4.762028 -4.608665      9.020590 
1 1 1 -20 19 28 o 48.27015 4.600910 29.99261       5.346622 29.12145       7.817275 30.75832       7.328865 45.85485 7.235388 47.69977 6.471774 -1.844913      9.707456 
1 1 1 -20 19 29 o 51.14866 3.793175 33.20819       4.694304 27.25663       7.642512 36.81408       5.948765 43.95996 7.396499 53.36371 4.619977 -9.403751      8.720801 
1 1 1 -20 19 30 o 34.62440 4.980717 15.85988       4.081758 8.809131       6.496948 20.45763       5.246439 24.61394 8.691463 38.95767 5.694530 -14.34373      10.39082 
1 1 1 -20 19 31 o 11.84111 5.442396 -1.932460      3.595438 -0.2598952     6.298380 -2.740971      4.379054 16.83883 7.521376 12.69640 5.895470 4.142430       9.556551 
1 1 1 -20 19 32 o 25.78851 6.827016 9.716578       4.357050 6.249671       8.411778 10.98778       5.093590 22.46571 9.332673 27.04382 7.478140 -4.578114      11.95915 
1 1 1 -20 19 33 o 10.99551 5.285450 -4.889266      4.140119 -3.793014      10.29698 -5.100663      4.521714 18.44472 8.714786 11.53881 5.540649 6.905911       10.32697 
1 1 1 -20 19 34 o 11.02320 5.215695 -3.246525      3.712982 -6.254506      5.917891 -1.293695      4.768279 12.98968 6.263031 13.86623 6.333494 -0.8765535     8.907228 
1 1 1 -20 19 35 o 31.71302 5.685995 14.34367       4.232779 14.06047       7.045805 14.50360       5.294708 28.07550 9.053493 30.53415 7.228503 -2.458643      11.58521 
1 1 1 -20 19 36 o 11.84576 5.441757 -1.388336      3.588276 -1.359376      6.243664 -1.402618      4.384719 15.28408 7.077115 13.05220 6.003098 2.231874       9.280233 
1 1 1 -20 19 37 f 25.90321 7.145020 10.81501       4.656337 17.98039       6.643025 3.894393       6.528577 32.21073 8.383296 18.46131 7.965461 13.74942       11.56409 
1 1 1 -20 20 1  o 61.78936 3.477678 47.05779       5.215342 48.49619       9.811833 46.49137       6.157168 61.82886 6.614795 61.26730 4.148438 0.5615578      7.808012 
1 1 1 -20 20 2  o 62.12007 3.303492 47.49623       4.982840 48.39132       10.65469 47.24566       5.637302 61.56166 7.240509 61.86452 3.757040 -0.3028641     8.157225 
1 1 1 -20 20 3  o 128.4038 3.550311 202.7043       11.09848 195.7298       19.96561 205.8231       13.35135 124.8193 6.587263 129.1401 4.248339 -4.320831      7.838394 
1 1 1 -20 20 4  o 108.0374 3.466647 143.4579       9.115010 0.000000       0.000000 143.4579       9.115010 ?        ?        108.0374 3.466647 0.000000       3.466647 
1 1 1 -20 20 5  o 20.76991 6.014043 5.494275       3.218070 16.28978       8.529336 3.702456       3.474887 34.97572 9.679081 18.17798 6.361375 16.79774       11.58239 
1 1 1 -20 20 6  o 89.86938 3.195203 99.15853       6.986420 121.5968       20.17864 96.10241       7.447016 97.34985 8.594069 88.41322 3.463138 8.936630       9.265601 
1 1 1 -20 20 7  o 77.42047 2.900093 73.51696       5.461795 71.50130       10.22925 74.32076       6.459663 75.67789 5.586128 77.74403 3.417980 -2.066139      6.548848 
1 1 1 -20 20 8  o 133.0258 3.406377 217.3195       11.03335 207.5845       15.99081 226.1653       15.24306 129.3888 5.081395 135.2605 4.631333 -5.871750      6.875305 
1 1 1 -20 20 9  o 64.30817 3.164342 50.82882       4.943676 48.08461       11.26887 51.48284       5.501332 61.24915 7.721174 64.65864 3.504544 -3.409492      8.479290 
1 1 1 -20 20 10 o 17.94577 6.155534 3.704895       3.246481 -3.533325      8.723754 4.868460       3.497702 19.45270 8.757337 19.91214 6.374816 -0.4594345     10.83186 
1 1 1 -20 20 11 o 72.33133 3.479010 64.39946       6.114246 63.59031       12.39749 64.65952       7.028477 70.67674 7.303227 72.35975 4.001496 -1.683006      8.327610 
1 1 1 -20 20 12 o 90.68410 3.388207 101.1166       7.474339 112.8821       15.47044 97.53400       8.536786 94.58194 6.756599 88.91598 3.949696 5.665962       7.826349 
1 1 1 -20 20 13 o 50.87183 3.791143 32.02267       4.666055 34.00731       8.303936 31.10689       5.640789 51.60936 6.765414 49.93225 4.690712 1.677109       8.232473 
1 1 1 -20 20 14 o 123.4407 3.104933 187.1020       9.332582 216.5859       23.61064 181.6425       10.15996 130.4806 7.456544 121.5207 3.434325 8.959930       8.209423 
1 1 1 -20 20 15 o 21.75156 6.751607 5.974325       3.951962 5.995476       7.173918 5.965109       4.735241 24.07689 9.034863 22.18170 7.435840 1.895191       11.70130 
1 1 1 -20 20 16 o 52.09281 3.260821 33.48297       4.118670 35.03123       8.397935 32.99262       4.726086 52.25875 6.752088 51.59663 3.785096 0.6621246      7.740649 
1 1 1 -20 20 17 o 47.11838 3.440145 27.47572       3.922838 22.64368       7.927227 29.04274       4.514328 41.28333 8.169047 48.35493 3.863139 -7.071598      9.036436 
1 1 1 -20 20 18 o 82.53886 3.303312 83.99718       6.630802 71.20195       10.74967 91.85569       8.424445 74.99297 5.930428 86.07665 4.027408 -11.08369      7.168681 
1 1 1 -20 20 19 o 21.49904 5.782287 6.024381       3.094939 8.057566       7.034207 5.536299       3.446458 25.69877 9.046352 20.77299 6.278399 4.925785       11.01158 
1 1 1 -20 20 20 o 74.29629 2.846195 67.96343       5.143562 76.45316       10.73911 65.43614       5.859345 77.61884 5.717737 72.76543 3.313056 4.853416       6.608242 
1 1 1 -20 20 21 o 66.09988 2.999964 53.92703       4.819692 47.19995       9.870992 56.03284       5.522777 60.22337 6.847492 67.26565 3.380041 -7.042274      7.636283 
1 1 1 -20 20 22 o 88.89339 2.763705 97.36001       5.979561 86.59039       11.28385 101.5652       7.050985 82.38189 5.654986 90.62565 3.197744 -8.243759      6.496494 
1 1 1 -20 20 23 o 35.64795 4.042787 16.04737       3.450037 8.837302       7.362823 18.07580       3.905304 26.13342 9.250274 37.76921 4.320744 -11.63578      10.20962 
1 1 1 -20 20 24 o 22.92741 6.702820 7.050067       3.980253 0.3516086      9.627748 8.430915       4.371296 21.55008 9.478162 24.92279 6.941341 -3.372707      11.74810 
1 1 1 -20 20 25 o 39.90243 5.815125 20.94534       5.488317 30.55415       7.766155 11.35878       7.757158 47.68492 6.882186 28.29723 9.517523 19.38769       11.74512 
1 1 1 -20 20 26 o 25.48125 6.171259 8.839960       3.790933 10.55336       6.928244 8.107757       4.529078 27.16115 8.991609 24.21428 7.169088 2.946869       11.49978 
1 1 1 -20 20 27 o 15.99020 6.229511 2.451646       3.495760 1.589528       6.432593 2.812967       4.164371 18.62004 7.968220 17.18722 6.768503 1.432817       10.45491 
1 1 1 -20 20 28 o 71.54838 3.987599 65.08677       6.925098 61.37229       9.395644 69.50468       10.24675 67.99749 5.723264 72.23098 5.871993 -4.233490      8.199759 
1 1 1 -20 20 29 o 57.61994 3.600526 42.05289       5.030358 30.70966       7.836045 50.00420       6.560663 46.72665 7.105232 62.31974 4.347281 -15.59309      8.329657 
1 1 1 -20 20 30 o 12.31514 5.585130 -1.361336      3.625987 0.3992183      5.908241 -2.425118      4.592612 16.83126 7.412993 13.23866 6.108628 3.592598       9.605614 
1 1 1 -20 20 31 o 19.35165 6.946909 5.016260       4.166790 7.684317       8.444840 4.157678       4.790541 23.53074 9.513084 18.73136 7.293886 4.799374       11.98747 
1 1 1 -20 20 32 o 24.23229 6.535984 8.591954       3.947538 16.17994       6.621624 4.408227       4.916803 31.85767 8.408023 18.88016 7.378574 12.97752       11.18652 
1 1 1 -20 20 33 o 12.80178 5.903694 -1.898022      4.280929 2.538609       10.46401 -2.789851      4.691505 20.71093 9.429984 12.89712 6.026477 7.813803       11.19120 
1 1 1 -20 20 34 o 36.66018 5.063326 18.50804       4.402764 22.84923       7.175899 15.88726       5.575541 37.72910 8.050284 31.98466 7.312992 5.744432       10.87598 
1 1 1 -20 20 35 o 18.29307 6.690082 4.781187       3.887940 1.095354       6.379714 6.958871       4.903779 16.81586 7.536125 21.03465 7.538045 -4.218792      10.65905 
1 1 1 -20 20 36 o 27.13826 6.365360 11.19118       4.136375 8.232394       6.796632 12.93174       5.212932 21.93928 8.644815 28.13742 7.476160 -6.198139      11.42916 
1 1 1 -20 21 1  o 97.22928 2.998287 116.1462       7.095566 135.0254       14.66203 110.3725       8.108290 103.6812 5.826514 94.63039 3.522257 9.050812       6.808419 
1 1 1 -20 21 2  o 87.01749 3.379251 93.23294       7.152153 100.5110       13.26106 90.24746       8.493321 89.31201 6.130193 85.40293 4.092933 3.909081       7.370982 
1 1 1 -20 21 3  o 25.84381 5.440936 8.620149       3.318089 2.312320       7.565102 10.12265       3.692181 21.47191 8.878893 28.01901 5.603383 -6.547100      10.49917 
1 1 1 -20 21 4  o 61.93045 3.631864 47.35096       5.457070 0.000000       0.000000 47.35096       5.457070 ?        ?        61.93045 3.631864 0.000000       3.631864 
1 1 1 -20 21 5  o 45.82309 3.672934 25.99905       4.067095 23.79557       9.957095 26.44030       4.455746 41.93647 9.902714 46.14467 4.001970 -4.208199      10.68080 
1 1 1 -20 21 6  o 57.72899 3.725854 41.18283       5.213512 43.62433       11.32793 40.52671       5.872414 57.91979 8.259501 57.14582 4.247294 0.7739677      9.287566 
1 1 1 -20 21 7  o 66.47253 3.613969 54.50601       5.832116 41.29325       11.87033 58.71042       6.696041 56.00621 9.002429 68.90134 4.005260 -12.89513      9.853214 
1 1 1 -20 21 8  o 43.83710 4.904758 24.10624       5.149860 0.000000       0.000000 24.10624       5.149860 ?        ?        43.83710 4.904758 0.000000       4.904758 
1 1 1 -20 21 9  o 61.57046 3.502726 46.75661       5.233826 45.06709       9.339953 47.53000       6.319194 59.55661 6.543079 61.91325 4.213447 -2.356640      7.782353 
1 1 1 -20 21 10 o 143.0154 2.958394 250.8627       10.31038 279.8825       18.67538 238.1396       12.36571 150.0006 5.116541 139.0557 3.652331 10.94489       6.286376 
1 1 1 -20 21 11 f 41.40572 3.847817 21.30429       3.838067 24.27207       7.984008 20.41234       4.376986 43.01169 7.908594 40.37032 4.527040 2.641376       9.112626 
1 1 1 -20 21 12 o 54.78724 3.275925 37.01637       4.353730 31.85424       8.513574 38.84442       5.066303 49.64048 7.251858 56.03038 3.731762 -6.389900      8.155703 
1 1 1 -20 21 13 o 48.41399 3.532470 29.00464       4.138916 33.08761       8.440531 27.71206       4.749084 50.65880 7.026107 47.17271 4.174304 3.486092       8.172576 
1 1 1 -20 21 14 o 71.23441 2.988311 62.41827       5.175902 50.21309       9.891641 67.02003       6.073769 62.71866 6.569304 73.71946 3.390035 -11.00080      7.392435 
1 1 1 -20 21 15 o 124.8795 2.860338 191.4418       8.704515 188.1845       15.46538 192.9522       10.53093 122.6709 5.185179 125.1104 3.457434 -2.439484      6.232169 
1 1 1 -20 21 16 o 74.84258 2.932038 68.92200       5.337198 81.46104       10.66663 64.73421       6.164362 80.43491 5.474475 72.37730 3.505444 8.057610       6.500617 
1 1 1 -20 21 17 o 144.5796 3.389036 257.7315       11.94041 281.2541       19.01546 242.4189       15.34227 149.7454 5.218933 139.5129 4.518689 10.23251       6.903318 
1 1 1 -20 21 18 o 21.39753 5.964471 5.975029       3.226055 -3.617588      6.881740 8.676843       3.652224 16.66920 7.611844 25.69891 5.949414 -9.029707      9.661040 
1 1 1 -20 21 19 o 39.59842 3.770890 19.59681       3.594921 16.27651       7.711550 20.51872       4.063466 34.26690 9.087613 40.41219 4.186759 -6.145294      10.00568 
1 1 1 -20 21 20 o 27.76511 4.994076 9.963644       3.254796 3.908776       7.693130 11.28372       3.592120 22.31381 9.058431 29.53232 5.180141 -7.218515      10.43499 
1 1 1 -20 21 21 o 81.87554 2.808896 82.69282       5.596059 81.82545       10.86141 83.00627       6.529402 80.00401 5.606555 81.84903 3.280230 -1.845024      6.495642 
1 1 1 -20 21 22 o 54.25127 3.094044 36.51141       4.073503 37.83147       8.313656 36.09437       4.672868 53.66988 6.488141 53.77594 3.586316 -0.1060638     7.413342 
1 1 1 -20 21 23 o 52.12163 4.277295 34.34723       5.385042 24.82813       11.91299 36.79179       6.037028 39.94290 11.57286 53.78087 4.652073 -13.83797      12.47289 
1 1 1 -20 21 24 o 35.13745 5.032554 16.03658       4.186297 8.398478       6.829259 20.63436       5.298524 25.08304 8.905847 39.64304 5.643921 -14.55999      10.54362 
1 1 1 -20 21 25 o 12.03031 5.230785 -0.1810930     2.859421 1.400308       6.134611 -0.6200349     3.231987 18.27053 7.799080 12.35956 5.461463 5.910969       9.521199 
1 1 1 -20 21 26 o 21.78583 6.532762 6.511003       3.742112 1.676692       6.605542 8.795758       4.541100 18.83123 8.066963 24.99512 7.115085 -6.163897      10.75641 
1 1 1 -20 21 27 o 49.35122 4.737420 31.62917       5.627498 25.04698       7.563594 39.79111       8.422475 41.84335 7.701334 53.98336 6.535311 -12.14000      10.10054 
1 1 1 -20 21 28 o 24.65063 6.437854 8.550619       3.908653 4.979909       6.473380 10.59935       4.903390 20.98798 8.382823 27.06007 7.278253 -6.072090      11.10156 
1 1 1 -20 21 29 o 43.57010 4.332509 24.64983       4.539178 24.57515       7.230740 24.69840       5.831377 41.17323 7.482139 42.65175 5.757345 -1.478527      9.440838 
1 1 1 -20 21 30 o 17.18579 6.634641 3.359338       3.937889 3.484425       7.703013 3.315082       4.581852 20.28152 8.700249 17.70138 7.058386 2.580143       11.20335 
1 1 1 -20 21 31 o 17.00765 6.487542 3.462761       3.734498 -0.4101802     6.250515 5.612783       4.657114 16.38409 7.391017 20.08957 7.325911 -3.705486      10.40654 
1 1 1 -20 21 32 o 14.34618 6.148033 0.9735145      3.839468 0.8993827      6.085204 1.022546       4.948902 16.83458 7.463677 15.74361 6.862902 1.090977       10.13932 
1 1 1 -20 21 33 o 25.12719 7.115627 9.809346       4.553648 12.58753       10.62283 9.183917       5.040215 25.53307 10.53621 23.96168 7.650472 1.571386       13.02081 
1 1 1 -20 21 34 o 53.83294 3.924201 38.09841       5.112607 36.01088       8.253537 39.39814       6.512540 48.45427 7.209176 53.49408 5.055824 -5.039810      8.805315 
1 1 1 -20 21 35 o 15.64342 6.365785 2.648463       3.809994 8.895408       6.363768 -0.8417531     4.756710 22.66274 8.508331 13.85343 6.326945 8.809313       10.60292 
1 1 1 -20 22 1  o 19.78130 6.160762 4.942669       3.287485 12.01706       6.422921 2.431468       3.826739 29.91660 8.443615 16.83418 6.529083 13.08242       10.67350 
1 1 1 -20 22 2  o 17.36806 5.997302 3.492091       3.083386 4.589251       6.237580 3.137297       3.547067 21.81805 8.369002 17.37069 6.383960 4.447357       10.52593 
1 1 1 -20 22 3  o 57.21665 3.593014 40.51366       4.984474 46.60747       9.786985 38.37946       5.791918 60.25964 6.782437 55.49254 4.316974 4.767101       8.039759 
1 1 1 -20 22 4  o 57.65388 4.332551 41.39983       6.042541 0.000000       0.000000 41.39983       6.042541 ?        ?        57.65388 4.332551 0.000000       4.332551 
1 1 1 -20 22 5  o 54.51820 3.373560 36.71292       4.459984 26.93192       9.733600 39.31218       5.017721 44.67216 9.246179 56.35254 3.673933 -11.68038      9.949352 
1 1 1 -20 22 6  o 72.44476 3.117581 64.60472       5.490895 66.63390       12.42400 64.11216       6.121157 72.04672 7.171516 72.07339 3.495581 -0.2667236E-01 7.978079 
1 1 1 -20 22 7  o 92.69858 3.871747 106.2428       8.726879 101.0593       15.47560 108.6597       10.56734 88.83368 7.210756 93.44897 4.655054 -4.615288      8.582804 
1 1 1 -20 22 8  o 22.35142 5.930412 6.495715       3.283086 7.903017       7.097588 6.112636       3.703065 25.73810 9.084706 21.81807 6.488187 3.920033       11.16371 
1 1 1 -20 22 9  o 51.57391 3.768548 32.98391       4.703620 43.39331       14.39476 31.73963       4.976809 56.06921 10.92809 50.51117 4.077857 5.558041       11.66413 
1 1 1 -20 22 10 o 12.29363 5.361918 -0.4802326     3.024401 3.931057       6.644923 -1.632828      3.396610 21.65963 8.543727 12.07547 5.447785 9.584163       10.13280 
1 1 1 -20 22 11 o 22.08932 5.932621 6.348174       3.260782 7.735734       6.956564 5.957468       3.691427 25.44271 8.992780 21.55763 6.493810 3.885073       11.09232 
1 1 1 -20 22 12 o 46.98265 3.638036 27.38831       4.132815 15.23850       7.943577 31.89765       4.839356 33.45758 9.371460 50.64560 3.952394 -17.18801      10.17083 
1 1 1 -20 22 13 o 54.61288 3.569572 36.94656       4.724552 59.24854       14.25587 34.19483       5.007546 66.67310 9.004133 52.43398 3.948005 14.23911       9.831641 
1 1 1 -20 22 14 o 51.19743 3.475260 32.47766       4.310125 35.46571       8.795525 31.53337       4.944493 52.21378 7.096056 50.28921 4.069431 1.924568       8.180115 
1 1 1 -20 22 15 o 47.75066 3.605560 28.32630       4.164544 29.06352       8.480775 28.09204       4.780637 46.86437 7.692706 47.39566 4.182006 -0.5312881     8.755963 
1 1 1 -20 22 16 f 123.2347 2.859601 186.7782       8.587659 198.2466       15.61061 181.8015       10.28354 125.5934 5.111228 121.2617 3.483639 4.331718       6.185498 
1 1 1 -20 22 17 o 47.53159 4.269490 28.34827       4.892685 19.20898       8.323464 33.17341       6.047872 37.14438 9.234844 51.22009 4.905231 -14.07571      10.45675 
1 1 1 -20 22 18 o 20.49176 6.555451 5.353311       3.699252 1.980341       7.331592 6.505291       4.284643 20.54425 8.636197 22.38201 7.042540 -1.837753      11.14366 
1 1 1 -20 22 19 o 40.79770 3.800766 20.86078       3.735234 23.33636       8.337979 20.23923       4.177906 41.06388 8.607965 40.00732 4.355554 1.056553       9.647171 
1 1 1 -20 22 20 o 74.27457 2.906204 68.18798       5.250049 67.06087       10.26523 68.58723       6.109545 72.09050 5.894675 74.30530 3.382936 -2.214798      6.796429 
1 1 1 -20 22 21 o 19.47945 6.627144 4.729144       3.761469 6.984135       6.756469 3.716324       4.528074 23.89641 8.805908 18.85078 7.154776 5.045628       11.34614 
1 1 1 -20 22 22 o 34.30901 5.198713 15.32978       4.210488 15.89583       7.179786 15.03306       5.198164 33.26431 8.743817 33.33908 6.631685 -0.7477951E-01 10.97422 
1 1 1 -20 22 23 o 41.88450 4.173897 22.31623       4.203559 5.371526       11.20131 25.09372       4.535005 25.03816 10.60760 44.40593 4.242346 -19.36777      11.42448 
1 1 1 -20 22 24 o 13.97060 5.726681 1.194856       3.111073 -6.800665      6.473594 3.596037       3.547599 14.15653 6.751957 17.54777 6.394736 -3.391232      9.299546 
1 1 1 -20 22 25 o 33.30141 4.546812 14.41028       3.593559 6.793169       6.768876 17.39973       4.240498 23.03504 8.746639 36.47199 4.894576 -13.43695      10.02300 
1 1 1 -20 22 26 f 62.61587 3.233332 49.20370       4.916969 34.92659       8.567035 56.21689       6.004380 49.89262 7.258992 66.63654 3.712270 -16.74392      8.153154 
1 1 1 -20 22 27 o 33.36437 5.313161 14.91262       4.175144 7.197357       6.428662 20.54084       5.490737 22.95128 8.564883 38.81708 5.997710 -15.86580      10.45609 
1 1 1 -20 22 28 o 35.85198 5.166461 17.20015       4.383686 12.49483       6.974215 20.27327       5.636265 28.15279 9.000504 38.21767 6.269064 -10.06488      10.96860 
1 1 1 -20 22 29 o 15.19465 6.380638 1.433796       3.995446 -2.936434      7.834986 2.969667       4.644763 16.92452 7.867990 17.40088 7.047837 -0.4763584     10.56301 
1 1 1 -20 22 30 o 15.12131 6.284354 1.697569       3.816459 1.783744       6.335796 1.648495       4.781206 17.84354 7.771956 16.20287 6.899861 1.640675       10.39285 
1 1 1 -20 22 31 o 17.10602 6.531056 3.619296       3.786997 -3.136081      6.217016 7.604547       4.775127 14.75017 6.906980 22.32151 7.466859 -7.571341      10.17155 
1 1 1 -20 22 32 o 20.31563 7.257530 6.154799       4.541869 8.885609       11.06819 5.601847       4.980521 23.50994 10.25564 19.76855 7.503580 3.741390       12.70755 
1 1 1 -20 22 33 o 25.93117 6.563340 10.20914       4.150474 15.19302       7.234090 7.763540       5.067494 28.95667 9.156146 22.02486 7.683805 6.931808       11.95307 
1 1 1 -20 22 34 o 32.11071 5.639776 14.84225       4.252199 14.18364       6.892905 15.24688       5.402736 27.83896 8.952665 30.97942 7.280515 -3.140457      11.53933 
1 1 1 -20 23 1  o 61.79383 3.147032 47.17944       4.723347 58.83873       9.740846 43.59525       5.400771 67.87984 5.948774 59.21678 3.762063 8.663055       7.038539 
1 1 1 -20 23 2  o 47.31537 3.482063 27.79160       3.986779 21.34286       8.010005 29.91524       4.596585 39.61710 8.548079 48.99183 3.881839 -9.374737      9.388202 
1 1 1 -20 23 3  o 72.94704 3.031853 65.59621       5.377794 61.63688       11.14835 66.79693       6.139318 69.17698 6.696877 73.49203 3.437549 -4.315048      7.527610 
1 1 1 -20 23 4  o 49.93736 3.465775 30.91501       4.191399 17.64363       8.684449 34.94512       4.785669 35.66691 9.725801 53.03827 3.726403 -17.37136      10.41524 
1 1 1 -20 23 5  o 55.65792 3.319983 38.31102       4.482505 33.28739       9.758948 39.65430       5.046334 49.96950 8.305680 56.53347 3.683028 -6.563969      9.085649 
1 1 1 -20 23 6  o 25.04888 6.109417 8.242591       3.695393 13.48729       8.298481 6.945313       4.127194 31.52223 9.783507 23.09772 6.844930 8.424509       11.94027 
1 1 1 -20 23 7  o 44.72450 4.926095 25.25976       5.280076 25.06531       9.189871 25.35559       6.451179 42.89424 9.075363 44.39715 6.125853 -1.502911      10.94935 
1 1 1 -20 23 8  o 43.28756 3.739572 23.32734       3.906121 13.60597       7.694499 26.70243       4.533762 31.61217 9.340500 46.24937 4.063975 -14.63720      10.18631 
1 1 1 -20 23 9  o 41.68080 3.716475 21.63715       3.735328 25.44803       7.552378 20.40305       4.297795 43.99730 7.299755 40.27392 4.453416 3.723377       8.550984 
1 1 1 -20 23 10 f 29.90220 4.896076 11.43979       3.444333 24.04511       7.282399 7.807469       3.909216 42.74485 7.250044 24.34139 6.477169 18.40346       9.721978 
1 1 1 -20 23 11 o 17.88175 6.423408 3.541916       3.563102 -11.68472      11.80690 5.067582       3.737348 19.44197 9.228814 20.18044 6.600255 -0.7384701     11.34612 
1 1 1 -20 23 12 o 34.13663 4.544675 14.76462       3.686752 16.35309       7.556238 14.26834       4.223592 34.48085 8.924360 33.29705 5.389269 1.183800       10.42537 
1 1 1 -20 23 13 o 46.73466 3.842236 27.24401       4.337208 25.50697       12.32092 27.48970       4.633807 41.77490 11.66051 46.87237 4.097985 -5.097466      12.35965 
1 1 1 -20 23 14 o 61.01502 3.207937 46.05148       4.753026 39.73464       9.285913 48.29398       5.532740 55.08092 7.081780 62.34836 3.657554 -7.267441      7.970528 
1 1 1 -20 23 15 o 57.11922 3.232878 40.40684       4.481579 40.93091       8.952276 40.23158       5.176981 56.05540 6.685200 56.83392 3.759066 -0.7785149     7.669581 
1 1 1 -20 23 16 f 77.14622 2.975918 73.49264       5.584143 60.24195       10.36409 78.91285       6.628571 68.25633 6.302040 79.77724 3.417529 -11.52090      7.169046 
1 1 1 -20 23 17 o 58.55516 3.694240 42.76048       5.244536 40.57233       8.810156 43.96144       6.526984 55.64773 6.626844 59.01852 4.573923 -3.370785      8.052070 
1 1 1 -20 23 18 o 40.77679 3.821795 20.88524       3.753408 23.31142       8.075993 20.21679       4.239050 41.00627 8.365509 39.90886 4.433490 1.097412       9.467712 
1 1 1 -20 23 19 o 45.13409 4.233041 25.75859       4.601454 26.66494       8.134727 25.33214       5.579943 44.10339 7.857055 44.32236 5.269210 -0.2189713     9.460332 
1 1 1 -20 23 20 o 33.26742 6.620314 14.95036       5.178196 8.677529       7.152055 21.86122       7.506981 25.58549 9.110828 39.58307 8.056805 -13.99758      12.16221 
1 1 1 -20 23 21 f 61.84791 3.117110 47.60630       4.682857 37.77240       8.212172 52.34473       5.700495 53.25544 6.459793 64.62000 3.634658 -11.36456      7.412130 
1 1 1 -20 23 22 o 10.66366 4.901045 -1.854782      2.915385 -6.352976      6.277746 -0.6179173     3.291893 14.09253 6.700973 12.47686 5.512636 1.615678       8.677108 
1 1 1 -20 23 23 o 32.20242 4.984583 13.61910       3.785326 11.16415       10.70097 13.97023       4.046983 27.94734 10.89595 32.47866 5.295544 -4.531324      12.11464 
1 1 1 -20 23 24 f 70.32989 3.035809 61.77342       5.190707 49.69032       9.063866 67.67016       6.331844 60.75331 6.209434 73.28723 3.556018 -12.53392      7.155581 
1 1 1 -20 23 25 o 47.41556 3.674775 28.53775       4.212956 16.75397       7.401085 34.18633       5.124160 33.03439 8.966231 51.67157 4.103111 -18.63718      9.860468 
1 1 1 -20 23 26 o 26.37087 5.786830 9.584763       3.616454 11.67840       6.663999 8.710776       4.305630 27.56005 8.796667 24.64889 6.897819 2.911160       11.17861 
1 1 1 -20 23 27 o 40.82736 5.361288 22.40403       5.205274 23.57047       10.19672 21.99293       6.053442 36.87097 10.71389 39.62590 6.493558 -2.754929      12.52812 
1 1 1 -20 23 28 o 27.76351 6.803754 11.24232       4.566652 -1.553695      9.127120 15.51537       5.274307 18.66241 8.611366 32.73665 6.832554 -14.07425      10.99270 
1 1 1 -20 23 29 o 16.98067 6.159436 3.702351       3.286065 15.34099       7.215025 0.6562643      3.691119 30.33086 9.065440 13.93681 6.001122 16.39405       10.87178 
1 1 1 -20 23 30 o 17.04624 6.574210 3.532814       3.863697 1.757661       6.487162 4.508680       4.809855 17.73570 7.791030 18.73142 7.304391 -0.9957199     10.67962 
1 1 1 -20 23 31 o 27.71573 6.300170 11.32609       4.158382 9.286936       6.810843 12.53801       5.250648 23.56266 8.811222 28.16462 7.512187 -4.601963      11.57889 
1 1 1 -20 23 32 f 20.78222 7.235812 6.653614       4.492594 -0.9397135E-02 10.92723 8.008995       4.928396 19.37789 9.100389 22.37396 7.586119 -2.996073      11.84763 
1 1 1 -20 23 33 o 10.93580 5.174716 -2.982237      3.656123 -0.3622368     6.293506 -4.316873      4.491831 15.82539 7.246427 11.60449 5.558990 4.220907       9.133076 
1 1 1 -20 24 1  f 55.97755 3.227817 38.85217       4.384433 47.33362       9.074700 36.26942       5.007700 60.44776 6.250566 53.88477 3.838750 6.562992       7.335229 
1 1 1 -20 24 2  o 16.34010 5.769415 3.043997       2.862730 0.5871031      6.127020 3.730134       3.237885 18.11170 7.764214 17.75237 6.144967 0.3593216      9.901699 
1 1 1 -20 24 3  o 57.97231 3.747934 41.86004       5.266413 0.000000       0.000000 41.86004       5.266413 ?        ?        57.97231 3.747934 0.000000       3.747934 
1 1 1 -20 24 4  o 31.65051 4.583375 12.76716       3.432330 18.70521       7.583885 11.23755       3.849099 36.84013 8.604126 29.35579 5.584583 7.484341       10.25761 
1 1 1 -20 24 5  o 69.43837 3.244839 59.64798       5.475530 73.25848       11.75667 55.87793       6.187581 75.36118 6.464159 67.01359 3.804606 8.347588       7.500692 
1 1 1 -20 24 6  o 40.25323 4.183814 20.37218       4.044216 13.80067       8.418124 22.34399       4.611211 31.55212 9.863359 42.05349 4.573195 -10.50137      10.87198 
1 1 1 -20 24 7  o 58.94722 4.265871 43.49973       6.086379 42.83089       10.27277 43.86152       7.555205 56.90272 7.598014 58.75788 5.334559 -1.855164      9.283713 
1 1 1 -20 24 8  o 37.72477 4.302708 17.94984       3.884893 29.12110       9.437647 15.67074       4.262801 46.19224 8.703320 34.95439 5.159359 11.23785       10.11765 
1 1 1 -20 24 9  o 56.68457 3.217345 39.77988       4.426003 40.07842       8.413133 39.66563       5.204408 55.67949 6.311702 56.42527 3.807252 -0.7457809     7.371075 
1 1 1 -20 24 10 o 86.28285 2.864468 91.75298       6.014535 88.84530       10.70351 93.09477       7.271040 83.77837 5.269432 86.69170 3.448660 -2.913330      6.297632 
1 1 1 -20 24 11 o 36.43833 4.255877 16.76531       3.707975 13.14744       6.823363 18.28142       4.417101 30.85800 8.700603 37.86406 4.902053 -7.006063      9.986522 
1 1 1 -20 24 12 o 47.04068 3.559546 27.56825       4.050132 29.07517       8.118814 27.06899       4.673136 46.73148 7.373512 46.41982 4.175712 0.3116608      8.473798 
1 1 1 -20 24 13 o 102.9590 2.871778 130.7473       7.198249 112.2558       12.56196 139.7873       8.783261 93.86950 5.515884 106.2055 3.398067 -12.33601      6.478568 
1 1 1 -20 24 14 o 30.66534 5.096109 12.16995       3.674616 9.087747       7.627289 13.10157       4.193348 26.51394 9.412025 31.65004 5.643911 -5.136105      10.97451 
1 1 1 -20 24 15 o 49.68573 3.528808 30.79767       4.244831 36.59645       8.370647 28.79023       4.925072 52.71017 6.665499 47.77018 4.275945 4.939983       7.919128 
1 1 1 -20 24 16 o 86.75765 2.892258 93.04931       6.106234 104.5564       11.48874 88.51888       7.208738 90.52394 5.230290 84.32749 3.515666 6.196449       6.302051 
1 1 1 -20 24 17 o 28.09284 6.032660 10.54979       4.006542 6.820538       7.018662 12.35240       4.879716 23.84847 8.939188 30.14939 6.803817 -6.300919      11.23392 
1 1 1 -20 24 18 o 28.74398 5.926035 11.04336       4.012955 6.684052       6.738029 13.43955       4.995556 23.45390 8.765320 31.43678 6.724370 -7.982882      11.04753 
1 1 1 -20 24 19 o 26.98422 5.561786 9.705396       3.535651 18.95179       6.775671 6.245611       4.144677 36.76577 7.804275 21.64111 6.940515 15.12466       10.44402 
1 1 1 -20 24 20 o 57.50149 3.249145 41.30792       4.534335 31.20615       8.042375 46.01545       5.490124 47.75402 7.128946 60.45809 3.744800 -12.70407      8.052665 
1 1 1 -20 24 21 o 46.15117 3.732105 26.93515       4.161549 14.82399       7.630653 32.06239       4.964901 31.31985 9.313709 50.19596 4.094412 -18.87610      10.17396 
1 1 1 -20 24 22 o 10.69895 5.129154 -4.813146      3.840354 -3.936998      9.088437 -5.003588      4.237222 18.32563 8.503816 11.34611 5.425491 6.979524       10.08716 
1 1 1 -20 24 23 o 13.00016 5.590558 0.2382806      3.195426 4.391418       6.067986 -1.355373      3.758836 20.31353 8.115204 12.64938 5.716540 7.664150       9.926498 
1 1 1 -20 24 24 o 45.34418 3.790183 26.21014       4.149831 20.35072       7.113798 29.23262       5.109238 37.13888 8.089748 47.50764 4.465594 -10.36876      9.240431 
1 1 1 -20 24 25 o 32.68348 5.142372 14.29670       3.960543 3.035419       7.115809 19.35105       4.767193 19.81522 8.427107 38.02191 5.287997 -18.20669      9.948821 
1 1 1 -20 24 26 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -20 24 27 o 12.27803 5.455339 -0.4871566     3.268622 -0.2810546     6.039392 -0.5725362     3.887130 16.32019 7.321745 13.25781 5.916195 3.062380       9.413253 
1 1 1 -20 24 28 o 20.48061 6.332081 6.037882       3.480022 -3.309858      6.807665 9.344745       4.049048 15.44932 7.232193 25.24196 6.532657 -9.792644      9.745779 
1 1 1 -20 24 29 o 10.75081 5.016314 -2.244363      3.231486 -5.563185      6.184314 -0.9978613     3.790060 13.61691 6.522942 12.62711 5.720029 0.9897966      8.675685 
1 1 1 -20 24 30 o 12.55495 5.560974 -0.1473937     3.370160 1.644529       6.246882 -0.8830603     4.002618 17.25748 7.610722 12.97215 5.877094 4.285326       9.615785 
1 1 1 -20 24 31 o 39.82569 5.392632 22.23127       5.099248 16.98029       11.73781 23.45283       5.661391 27.50028 11.17979 40.39495 5.927454 -12.89468      12.65395 
1 1 1 -20 24 32 f 30.38239 6.204015 13.71596       4.437856 10.38157       7.611564 15.43319       5.462364 23.81079 9.215505 31.17187 7.317091 -7.361084      11.76713 
1 1 1 -20 25 1  o 13.97640 5.497298 1.587016       2.744068 -8.474671      5.883840 4.383787       3.102087 12.79407 6.187411 18.55849 6.009212 -5.764416      8.625235 
1 1 1 -20 25 2  o 73.05580 4.107923 66.99364       7.283834 64.79934       11.08364 68.66170       9.663561 70.29447 6.545531 73.15359 5.460212 -2.859116      8.523960 
1 1 1 -20 25 3  o 54.99231 3.878894 37.88865       5.164767 0.000000       0.000000 37.88865       5.164767 ?        ?        54.99231 3.878894 0.000000       3.878894 
1 1 1 -20 25 4  o 8.348236 4.116050 -6.287400      2.996525 -2.925798      6.057097 -7.376723      3.448021 15.67087 7.150329 8.880186 4.385252 6.790689       8.387946 
1 1 1 -20 25 5  o 77.44396 3.145759 74.28278       5.924398 66.67936       11.55995 76.99117       6.899336 71.33112 6.729836 78.64472 3.609618 -7.313599      7.636755 
1 1 1 -20 25 6  o 36.72391 4.440387 17.13679       3.893205 20.34152       8.507909 16.28800       4.378525 37.82014 9.297809 35.51967 5.213600 2.300468       10.65978 
1 1 1 -20 25 7  o 44.60569 3.867399 24.95457       4.162334 28.29890       9.269613 24.10996       4.658373 45.13545 8.743545 43.64176 4.442066 1.493687       9.807218 
1 1 1 -20 25 8  o 114.4764 3.096895 162.0785       8.631363 153.6776       17.81948 164.6537       9.866008 108.4756 6.774860 115.1342 3.520560 -6.658546      7.634990 
1 1 1 -20 25 9  o 43.72256 3.953708 24.02123       4.167084 13.29155       8.978678 26.96685       4.704432 30.69528 10.23828 46.25049 4.220476 -15.55521      11.07406 
1 1 1 -20 25 10 o 68.82970 3.041713 58.65351       5.089280 63.77830       9.334727 56.48592       6.070902 70.56197 5.471410 67.28087 3.717206 3.281097       6.614677 
1 1 1 -20 25 11 o 57.76013 3.221908 41.43380       4.517028 58.04633       8.881684 35.63780       5.246160 67.27248 5.464809 53.24953 4.073800 14.02295       6.816156 
1 1 1 -20 25 12 f 40.37047 4.370070 20.68375       4.230742 11.74243       11.30777 22.13913       4.562084 29.76659 11.30448 41.70820 4.562916 -11.94161      12.19063 
1 1 1 -20 25 13 o 84.68211 2.895706 88.69399       5.966819 90.02288       10.84420 88.11697       7.145784 83.84595 5.335044 84.12216 3.493410 -0.2762070     6.377037 
1 1 1 -20 25 14 o 70.29539 3.890778 61.96200       6.638989 48.08212       13.62092 66.28690       7.603295 57.50473 10.08770 72.47559 4.324676 -14.97086      10.97563 
1 1 1 -20 25 15 o 55.65788 3.850826 38.93043       5.190760 46.82585       8.623403 34.44417       6.500294 59.82936 5.995330 51.67380 5.234214 8.155556       7.958704 
1 1 1 -20 25 16 o 40.38931 5.581542 21.38075       5.346909 21.48057       7.105745 21.25046       8.118367 39.31856 7.691720 38.36131 8.862638 0.9572487      11.73494 
1 1 1 -20 25 17 o 46.23417 3.753472 26.95271       4.192606 28.46449       7.719770 26.32024       4.993170 45.61536 7.181967 45.31563 4.584599 0.2997322      8.520515 
1 1 1 -20 25 18 o 75.20468 2.997029 70.35567       5.481524 64.15260       9.501825 73.44982       6.710805 70.03288 5.614612 76.49197 3.610357 -6.459091      6.675219 
1 1 1 -20 25 19 o 44.68939 3.928484 25.37367       4.234747 25.68523       7.775493 25.24228       5.049312 42.60765 7.775060 44.15411 4.768264 -1.546459      9.120740 
1 1 1 -20 25 20 f 20.68749 6.234899 5.832874       3.402304 9.990453       7.101255 4.594158       3.876152 26.18251 9.098296 19.03749 6.714134 7.145021       11.30746 
1 1 1 -20 25 21 o 12.65748 5.516785 -0.1229942     3.196890 -1.352839      6.148140 0.3327478      3.742640 16.23216 7.325649 14.02393 6.040788 2.208228       9.495065 
1 1 1 -20 25 22 o 9.650478 4.702052 -5.822166      3.569521 -0.5239675     10.05955 -6.585361      3.817967 20.44891 9.285308 9.806196 4.796287 10.64271       10.45090 
1 1 1 -20 25 23 o 31.11441 5.310753 13.02993       3.882332 4.047198       6.772192 17.42720       4.738234 20.34586 8.405784 35.90459 5.597900 -15.55873      10.09919 
1 1 1 -20 25 24 o 30.71907 7.927742 14.21334       5.974480 16.29691       9.110068 12.64096       7.914001 30.95678 10.31262 27.96707 9.610143 2.989702       14.09628 
1 1 1 -20 25 25 o 16.66212 6.721124 2.661427       4.204852 5.790287       8.126694 1.517549       4.913725 22.04313 9.166489 16.38098 6.985874 5.662157       11.52506 
1 1 1 -20 25 26 o 65.64530 3.597861 55.12311       5.733509 39.60404       8.307621 69.23798       7.922866 52.75508 6.606606 72.64235 4.497712 -19.88727      7.992287 
1 1 1 -20 25 27 o 28.01880 5.614011 11.01379       3.699497 4.030280       6.575691 14.24787       4.474867 19.49461 8.185925 31.67239 6.017752 -12.17778      10.15986 
1 1 1 -20 25 28 o 31.64985 5.175639 13.82896       3.853986 9.633809       7.097077 15.58346       4.589674 24.03268 8.992945 33.07294 5.911725 -9.040260      10.76204 
1 1 1 -20 25 29 o 15.95351 6.250566 2.954590       3.535794 0.9603356      6.519349 3.785650       4.208525 17.03969 7.628665 17.40992 6.819870 -0.3702335     10.23265 
1 1 1 -20 25 30 o 45.76469 4.629190 28.34905       5.091725 17.95658       7.774776 36.15380       6.737646 31.24601 9.426882 50.66844 5.547319 -19.42242      10.93795 
1 1 1 -20 25 31 o 39.57417 4.705715 21.41826       4.449332 0.5486769      11.15277 25.36850       4.852183 19.41295 9.140839 43.10814 4.694693 -23.69520      10.27595 
1 1 1 -20 26 1  o 36.14429 3.906587 16.57345       3.386297 13.03413       6.399856 17.94964       3.990703 30.10908 8.403774 37.41259 4.465236 -7.303513      9.516394 
1 1 1 -20 26 2  o 23.98549 5.243498 7.636016       2.979135 1.204449       5.873870 9.863412       3.456724 17.92921 7.641794 27.28467 5.390138 -9.355467      9.351502 
1 1 1 -20 26 3  f 40.83446 4.552204 21.33234       4.452918 0.000000       0.000000 21.33234       4.452918 ?        ?        40.83446 4.552204 0.000000       4.552204 
1 1 1 -20 26 4  o 57.40381 3.432964 41.15426       4.780326 30.25673       9.270917 45.10088       5.579190 46.36124 8.519867 59.92128 3.841024 -13.56004      9.345673 
1 1 1 -20 26 5  o 64.78449 3.280446 52.25636       5.162074 41.13775       9.916760 56.38882       6.045736 54.95213 7.609372 67.10497 3.711533 -12.15284      8.466288 
1 1 1 -20 26 6  o 61.71026 4.303829 48.14313       6.431584 50.42331       10.42175 46.74055       8.173728 61.32644 7.104893 60.02502 5.654559 1.301422       9.080393 
1 1 1 -20 26 7  o 59.19296 3.358807 43.68119       4.825089 25.61700       9.706117 49.61067       5.560891 41.82016 9.710847 62.97255 3.639242 -21.15238      10.37037 
1 1 1 -20 26 8  o 39.82640 4.344851 20.18829       4.148484 11.46906       8.794967 22.68336       4.704748 28.61116 10.11157 42.10950 4.662836 -13.49834      11.13489 
1 1 1 -20 26 9  o 63.68857 3.667717 50.77799       5.668299 46.68006       10.95082 52.27774       6.624833 58.34358 7.905450 64.33459 4.249456 -5.991013      8.975189 
1 1 1 -20 26 10 o 29.26875 5.436834 11.30006       3.735093 12.17022       6.341104 10.83775       4.621999 29.26648 8.432417 28.13520 6.814335 1.131281       10.84162 
1 1 1 -20 26 11 o 37.42077 4.680136 17.99943       4.174767 11.42698       6.599527 22.38408       5.390341 28.32524 8.713324 41.41769 5.474587 -13.09244      10.29044 
1 1 1 -20 26 12 o 63.80005 4.036124 51.33981       6.242950 61.13986       13.92721 48.87549       6.983904 65.62841 8.940602 61.89376 4.664696 3.734653       10.08433 
1 1 1 -20 26 13 o 23.16980 6.050181 7.272007       3.452436 3.876045       6.380414 8.677947       4.105357 20.54539 8.282187 25.14833 6.612466 -4.602940      10.59808 
1 1 1 -20 26 14 o 21.97264 6.206333 6.548265       3.468749 8.111895       7.010661 6.041385       3.991577 24.70062 8.991274 21.25641 6.810518 3.444206       11.27946 
1 1 1 -20 26 15 o 57.22443 3.363953 41.00951       4.670331 38.74108       8.223542 42.08949       5.674197 53.77047 6.401480 57.62002 4.067189 -3.849552      7.584258 
1 1 1 -20 26 16 o 38.08890 6.209164 19.58645       5.564898 12.74365       11.78519 21.54997       6.313026 29.31237 11.43277 39.63635 6.779422 -10.32398      13.29168 
1 1 1 -20 26 17 o 66.31616 3.247664 55.06470       5.232434 46.50524       9.179145 59.18479       6.368433 58.58987 6.540423 68.39911 3.836098 -9.809235      7.582400 
1 1 1 -20 26 18 f 34.11785 4.673538 15.18616       3.783631 16.76462       7.163350 14.57540       4.455921 33.42788 8.708081 32.86818 5.773796 0.5597076      10.44832 
1 1 1 -20 26 19 o 28.04088 5.689098 10.68769       3.754443 12.71960       6.931448 9.844032       4.466375 28.91175 8.936110 26.34920 6.882042 2.562551       11.27903 
1 1 1 -20 26 20 o 50.15719 3.648096 31.91819       4.428498 25.89872       7.681679 34.91468       5.419799 42.38988 7.720675 52.07051 4.309820 -9.680637      8.842136 
1 1 1 -20 26 21 o 19.42145 6.689544 5.027228       3.835405 18.76496       10.27103 2.801204       4.134483 32.94769 10.94932 16.91685 6.718210 16.03084       12.84609 
1 1 1 -20 26 22 o 54.84077 4.374935 38.99972       5.798265 34.62411       10.86324 40.74290       6.856646 46.34365 9.918602 55.44364 5.133129 -9.099991      11.16815 
1 1 1 -20 26 23 o 20.71122 7.145568 6.002731       4.376780 -0.3555766     8.532292 8.273282       5.098714 18.82696 8.549860 23.61170 7.708364 -4.784748      11.51169 
1 1 1 -20 26 24 o 16.22686 6.135108 3.075980       3.321780 1.097971       5.941292 3.975466       4.006490 17.10279 7.486104 17.90098 6.744492 -0.7981968     10.07621 
1 1 1 -20 26 25 o 21.02448 6.884119 6.440928       4.065209 4.032830       6.554382 7.946415       5.182428 19.57756 8.193480 22.86948 7.778856 -3.291916      11.29795 
1 1 1 -20 26 26 o 23.25010 6.297352 7.926028       3.655373 6.806383       6.728901 8.394766       4.353808 21.66622 8.581448 23.52316 7.044821 -1.856936      11.10274 
1 1 1 -20 26 27 o 13.35022 5.780712 0.5464581      3.462766 4.313492       6.226552 -1.140282      4.166505 19.21962 8.010487 13.06990 5.950725 6.149719       9.978929 
1 1 1 -20 26 28 o 37.26560 4.477190 18.66957       3.984507 16.59350       6.964533 19.67974       4.858123 31.00066 8.807034 37.43950 5.487643 -6.438841      10.37680 
1 1 1 -20 26 29 o 25.43393 6.076198 9.585297       3.714301 8.292826       6.769296 10.14204       4.442834 22.31282 8.675488 25.47878 6.959978 -3.165956      11.12229 
1 1 1 -20 26 30 o 13.35272 5.914077 0.1657059      3.811332 8.191644       10.17280 -1.144853      4.110748 22.31594 9.781094 12.81368 5.863279 9.502260       11.40385 
1 1 1 -20 27 1  o 46.91331 3.558959 27.77325       4.038340 28.28370       7.426899 27.55898       4.811842 45.28587 6.951661 46.36517 4.308044 -1.079300      8.178314 
1 1 1 -20 27 2  o 27.16267 5.243695 9.830013       3.345225 11.77734       5.568135 8.730182       4.184595 28.61488 7.781446 25.03333 6.719509 3.581558       10.28118 
1 1 1 -20 27 3  o 48.64460 4.543426 30.39951       5.323548 0.000000       0.000000 30.39951       5.323548 ?        ?        48.64460 4.543426 0.000000       4.543426 
1 1 1 -20 27 4  o 19.39579 6.113907 4.985566       3.227810 9.789225       6.433308 3.369478       3.731478 26.17206 8.664501 17.42330 6.520603 8.748755       10.84398 
1 1 1 -20 27 5  o 57.15186 3.620587 41.08662       5.016574 38.11055       9.026570 42.41662       6.034285 52.68811 7.220000 57.69332 4.323491 -5.005207      8.415520 
1 1 1 -20 27 6  o 43.21630 6.062850 24.91510       6.209618 16.64896       8.285896 35.50552       9.378744 33.11935 9.667811 50.31638 7.909608 -17.19703      12.49114 
1 1 1 -20 27 7  o 98.18958 3.472001 120.6651       8.294635 106.5175       15.06455 126.8202       9.936489 88.70313 7.026534 100.1650 4.079346 -11.46186      8.124853 
1 1 1 -20 27 8  o 36.94671 4.441931 17.55410       3.919182 18.93003       8.459363 17.17805       4.422437 35.38101 9.578566 36.22455 5.155164 -0.8435364     10.87771 
1 1 1 -20 27 9  o 52.58321 3.631074 34.80614       4.624271 27.63387       9.669805 36.93272       5.265376 43.03550 9.477264 53.97405 4.032351 -10.93856      10.29944 
1 1 1 -20 27 10 o 39.55746 4.181725 19.99355       3.970116 9.846559       8.415950 22.89795       4.502596 26.56130 9.820905 42.23917 4.440670 -15.67787      10.77821 
1 1 1 -20 27 11 o 85.95286 2.943330 91.87606       6.155936 84.98044       10.92682 95.08237       7.450913 80.55945 5.600852 87.06561 3.519026 -6.506165      6.614612 
1 1 1 -20 27 12 o 33.98236 4.747596 15.03837       3.824392 16.06160       6.935277 14.59127       4.584424 33.01437 8.552340 32.89735 5.936979 0.1170120      10.41106 
1 1 1 -20 27 13 o 21.50827 6.208591 6.329798       3.434550 4.281696       6.588641 7.094005       4.024627 20.78190 8.402427 22.63656 6.771857 -1.854660      10.79161 
1 1 1 -20 27 14 o 70.18650 3.135438 61.58784       5.349216 46.64631       8.989513 69.77866       6.655835 58.75846 6.380426 74.36124 3.684465 -15.60278      7.367844 
1 1 1 -20 27 15 o 56.77406 4.067236 41.10044       5.589831 33.63649       8.305761 47.28019       7.557536 49.14827 7.143842 60.07854 5.213645 -10.93027      8.844013 
1 1 1 -20 27 16 o 25.66104 5.992377 9.073684       3.678967 12.49087       6.979017 7.758686       4.329346 28.65443 8.984200 23.44211 7.026036 5.212313       11.40531 
1 1 1 -20 27 17 o 13.41132 5.779405 0.2612158      3.428623 -1.626823      6.421113 1.014213       4.055099 16.36281 7.425384 15.09379 6.387937 1.269019       9.795002 
1 1 1 -20 27 18 o 15.96387 6.309357 2.423426       3.630236 6.663286       8.634416 1.513024       4.001049 23.45725 9.568972 15.45983 6.430580 7.997422       11.52899 
1 1 1 -20 27 19 o 37.74099 4.420815 18.55737       3.988889 12.97066       6.974972 21.27253       4.862524 28.81037 8.973892 40.02908 5.100515 -11.21871      10.32211 
1 1 1 -20 27 20 o 22.85430 7.298657 7.548792       4.587100 3.065549       8.232891 9.567108       5.523964 20.59557 8.915724 25.25904 8.002800 -4.663471      11.98061 
1 1 1 -20 27 21 o 16.82071 7.125660 1.817484       5.053917 0.000000       0.000000 1.817484       5.053917 ?        ?        16.82071 7.125660 0.000000       7.125660 
1 1 1 -20 27 22 o 17.23479 6.341206 3.719421       3.501337 5.332931       6.293192 2.996047       4.213730 20.67237 8.262456 16.97404 6.768722 3.698330       10.68100 
1 1 1 -20 27 23 o 10.37925 4.894630 -2.877347      3.219735 -4.666771      5.806045 -2.082675      3.869171 13.65077 6.477462 12.10258 5.592401 1.548192       8.557597 
1 1 1 -20 27 24 o 18.23957 6.316850 4.588554       3.421742 -1.472985      5.820941 7.789019       4.229688 15.18003 6.957695 22.78529 6.969370 -7.605255      9.847926 
1 1 1 -20 27 25 o 12.35620 5.613602 -1.105398      3.682804 1.456648       5.754099 -2.883156      4.793141 16.81339 7.363130 12.96560 6.069177 3.847797       9.542044 
1 1 1 -20 27 26 o 38.69104 4.295416 19.92558       3.981802 18.95239       6.948829 20.40134       4.858563 33.84016 8.452020 38.30660 5.350496 -4.466434      10.00322 
1 1 1 -20 27 27 o 40.28027 5.007253 22.31259       4.809250 15.69799       6.979252 28.29312       6.636313 29.87227 8.913165 43.95310 6.382273 -14.08084      10.96257 
1 1 1 -20 27 28 o 12.83779 5.690409 -0.9937979E-02 3.535218 -5.357444      6.178818 2.592547       4.310463 13.45416 6.464630 16.11179 6.685862 -2.657628      9.300118 
1 1 1 -20 28 1  o 47.11116 3.486270 28.09978       3.974044 27.57092       7.438680 28.31102       4.701161 44.17482 7.154612 46.92447 4.154079 -2.749641      8.273140 
1 1 1 -20 28 2  o 31.44305 4.570985 12.94741       3.399935 13.31238       6.233510 12.79285       4.056441 29.80026 8.285043 30.73092 5.623865 -0.9306564     10.01348 
1 1 1 -20 28 3  o 10.21679 4.717392 -1.849016      2.745466 -6.047306      5.180525 -0.2094020     3.237489 12.41680 5.953907 12.63574 5.528579 -0.2189398     8.124912 
1 1 1 -20 28 4  f 37.17601 4.150639 17.78671       3.696144 5.743905       6.724844 22.99938       4.424340 21.91996 8.610633 42.21209 4.363909 -20.29214      9.653326 
1 1 1 -20 28 5  o 38.53786 4.085247 19.05997       3.778199 9.753506       7.250598 22.52891       4.426696 25.82131 9.175605 41.75856 4.416957 -15.93725      10.18338 
1 1 1 -20 28 6  o 83.96843 3.106861 88.15416       6.346355 73.92313       12.37424 93.23342       7.392658 73.16946 7.026143 86.03723 3.533485 -12.86777      7.864617 
1 1 1 -20 28 7  o 33.25580 4.811779 14.50903       3.786301 12.70211       7.721284 15.08110       4.344513 28.75160 9.491243 33.56748 5.501538 -4.815878      10.97044 
1 1 1 -20 28 8  o 74.56197 3.213214 69.64757       5.824687 53.37661       11.47047 75.30096       6.761289 61.25047 7.866235 77.26579 3.600827 -16.01531      8.651220 
1 1 1 -20 28 9  f 17.97367 6.424371 3.995105       3.559410 1.390087       7.213991 4.833360       4.092215 19.11010 8.308731 19.43321 6.894530 -0.3231030     10.79674 
1 1 1 -20 28 10 o 10.21481 4.835630 -3.314494      3.199186 -6.739137      6.478271 -2.209958      3.679100 14.05592 6.717805 11.89656 5.481476 2.159357       8.670380 
1 1 1 -20 28 11 o 12.35634 5.619866 -1.615574      3.703709 0.000000       0.000000 -1.615574      3.703709 ?        ?        12.35634 5.619866 0.000000       5.619866 
1 1 1 -20 28 12 o 30.48109 5.042504 12.33486       3.614680 18.63489       6.703254 9.751816       4.292202 35.74549 7.905365 26.29011 6.685498 9.455378       10.35329 
1 1 1 -20 28 13 o 56.55620 3.415078 40.33305       4.684774 39.70945       8.149342 40.64085       5.725371 54.00739 6.310862 56.28964 4.204238 -2.282249      7.583047 
1 1 1 -20 28 14 o 36.40442 4.561751 17.29025       3.958287 15.05338       6.917971 18.37900       4.826403 31.37368 8.730148 37.01001 5.519953 -5.636326      10.32886 
1 1 1 -20 28 15 o 44.03093 4.835475 25.43219       5.103120 20.44766       7.496134 29.73750       6.966716 36.78939 8.527980 46.55917 6.301907 -9.769779      10.60380 
1 1 1 -20 28 16 o 11.71210 5.326253 -1.438444      3.325636 -5.167784      6.305435 -0.1234628E-02 3.914344 14.35322 6.792961 13.91025 6.082825 0.4429722      9.118392 
1 1 1 -20 28 17 o 15.60192 6.598959 1.303677       4.323074 5.133398       8.134162 -0.2039076     5.103524 21.89035 9.142087 15.43013 6.838402 6.460214       11.41672 
1 1 1 -20 28 18 o 15.43859 6.571469 1.153880       4.333549 4.273935       8.270055 -0.2710456E-01 5.088027 21.28963 9.070572 15.48694 6.847526 5.802684       11.36503 
1 1 1 -20 28 19 o 20.51348 7.343939 5.817980       4.653245 -2.640090      8.841105 9.058681       5.472558 18.00744 8.366821 24.44875 7.986237 -6.441305      11.56649 
1 1 1 -20 28 20 f 54.95075 4.011761 39.06076       5.335096 14.68694       11.78869 45.33855       5.982836 28.23739 11.30096 59.07281 4.183132 -30.83542      12.05032 
1 1 1 -20 28 21 o 20.92824 6.339693 6.307408       3.511282 -1.042535      5.939486 10.25619       4.353499 15.65905 7.119947 26.37360 6.747168 -10.71455      9.809073 
1 1 1 -20 28 22 o 19.66570 6.333213 5.539359       3.448588 2.973962       6.291647 6.641106       4.123139 18.50122 7.897933 21.21388 6.932196 -2.712656      10.50870 
1 1 1 -20 28 23 o 13.98609 5.875147 1.262858       3.389272 -2.872272      5.967490 3.231908       4.117898 14.53372 6.793036 16.86918 6.702960 -2.335461      9.543323 
1 1 1 -20 28 24 o 12.44017 5.665805 -1.167588      3.780864 -2.819868      5.550278 0.2629569      5.164445 13.97944 6.539604 15.32104 6.829249 -1.341601      9.455425 
1 1 1 -20 28 25 o 16.50585 6.281828 3.441226       3.496389 6.379724       6.116264 2.014826       4.261319 20.75563 8.193816 15.64496 6.580825 5.110666       10.50932 
1 1 1 -20 28 26 o 19.96450 6.448921 5.970555       3.573993 2.811547       6.124915 7.601496       4.400923 17.76857 7.691003 22.00283 7.160031 -4.234261      10.50798 
1 1 1 -20 28 27 o 21.75893 6.400460 7.203450       3.619690 9.575939       6.511523 6.142458       4.354483 23.44208 8.643709 20.03206 7.111531 3.410019       11.19319 
1 1 1 -20 29 1  o 31.61947 4.541507 13.18400       3.399085 25.24148       6.489724 8.625855       3.990177 42.48674 6.472277 24.53493 6.550815 17.95181       9.208884 
1 1 1 -20 29 2  o 16.08793 6.185323 2.797108       3.412589 0.000000       0.000000 2.797108       3.412589 ?        ?        16.08793 6.185323 0.000000       6.185323 
1 1 1 -20 29 3  o 14.57388 5.708663 2.032798       2.948695 -1.813917      4.906741 4.207283       3.689150 14.10297 6.435191 18.18352 6.535514 -4.080546      9.171947 
1 1 1 -20 29 4  o 14.25182 5.686762 1.743879       2.976152 2.707084       5.510303 1.347172       3.536317 18.18057 7.553121 14.60173 6.057213 3.578842       9.681914 
1 1 1 -20 29 5  o 29.74980 6.544834 12.48979       4.615678 11.00403       6.559920 13.94659       6.495664 26.81510 8.742708 30.19593 8.480384 -3.380833      12.17998 
1 1 1 -20 29 6  o 55.60493 3.500706 39.15012       4.719494 33.78321       9.094756 41.12793       5.521039 48.01075 8.058755 56.65804 4.024946 -8.647297      9.007980 
1 1 1 -20 29 7  o 42.72697 3.974146 23.42951       4.090479 15.67466       7.570320 26.62718       4.861212 31.49459 9.254041 45.28015 4.463533 -13.78556      10.27426 
1 1 1 -20 29 8  o 13.97559 5.853699 0.9987890      3.349553 2.389756       6.670490 0.5298022      3.873286 19.05999 8.134229 14.32729 6.158068 4.732699       10.20233 
1 1 1 -20 29 9  o 18.75992 6.457425 4.638293       3.573659 -1.850294      6.954667 6.966228       4.165688 16.76591 7.654504 22.18802 6.938767 -5.422106      10.33140 
1 1 1 -20 29 10 f 15.80228 6.256912 2.371303       3.576149 -1.535122      7.026408 3.736981       4.154490 16.99705 7.734457 17.97374 6.845860 -0.9766903     10.32897 
1 1 1 -20 29 11 o 37.95681 4.640615 18.89305       4.203249 18.13054       8.434400 19.14499       4.848159 33.36777 9.757917 37.74215 5.427106 -4.374386      11.16559 
1 1 1 -20 29 12 o 38.37514 4.711540 19.36683       4.313690 14.25959       8.126287 21.37058       5.090035 29.59127 9.735531 39.91764 5.368613 -10.32637      11.11767 
1 1 1 -20 29 13 o 44.67977 4.137910 25.78684       4.454165 19.76938       7.211799 29.49782       5.663454 36.05651 8.369267 47.21752 4.997781 -11.16101      9.747946 
1 1 1 -20 29 14 o 18.55994 7.620235 3.255077       5.519980 -1.346817      6.845862 11.80738       9.332574 16.78348 7.636168 27.02562 10.26835 -10.24214      12.79648 
1 1 1 -20 29 15 o 42.71206 5.087249 24.34493       5.191103 23.49540       9.263092 24.73388       6.267804 37.52206 9.964132 42.13272 6.297583 -4.610661      11.78743 
1 1 1 -20 29 16 o 35.67788 5.975298 17.67983       5.011569 18.71402       8.940063 17.20592       6.051859 32.91242 10.14443 34.01893 7.502118 -1.106510      12.61710 
1 1 1 -20 29 17 o 48.39220 3.872144 30.19750       4.528215 17.58555       7.419021 37.68523       5.716503 32.90500 8.996155 53.66290 4.410282 -20.75790      10.01905 
1 1 1 -20 29 18 o 51.17068 3.745028 33.69749       4.637612 26.07081       7.577494 38.26519       5.864169 41.56871 7.765861 53.91949 4.504085 -12.35078      8.977492 
1 1 1 -20 29 19 o 14.34368 6.014820 1.310782       3.542730 4.184181       6.245641 -0.5232358E-01 4.301738 19.47196 8.061159 14.20045 6.286620 5.271513       10.22271 
1 1 1 -20 29 20 o 40.97137 4.744873 22.52164       4.649939 14.06470       11.26603 24.25814       5.105061 27.07749 10.97302 42.28371 5.054404 -15.20622      12.08115 
1 1 1 -20 29 21 o 37.72592 4.549752 19.05584       4.098408 11.51701       6.820200 23.31684       5.127447 25.98711 8.921640 41.21372 5.222403 -15.22661      10.33775 
1 1 1 -20 29 22 o 20.96118 6.862175 6.601841       4.039414 -0.8352457     10.41203 7.919523       4.382675 19.10206 8.942779 22.67564 7.120949 -3.573572      11.43159 
1 1 1 -20 29 23 o 19.22186 6.475044 5.397547       3.590326 6.454585       6.063561 4.826870       4.455308 20.83359 8.178592 18.68962 7.096252 2.143967       10.82803 
1 1 1 -20 29 24 o 52.69384 3.718208 36.21179       4.743863 39.48551       8.333561 34.64242       5.769959 51.32224 6.832909 50.51897 4.742312 0.8032608      8.317342 
1 1 1 -20 29 25 o 26.90343 5.956088 10.63515       3.801631 6.953933       6.452213 12.59266       4.705054 21.08509 8.386420 28.56706 6.847794 -7.481976      10.82702 
1 1 1 -20 30 1  o 21.53793 5.760346 6.560897       3.082079 6.959422       5.667324 6.393534       3.672669 21.87670 8.064398 21.06020 6.503904 0.8165054      10.36027 
1 1 1 -20 30 2  o 23.75761 6.548771 8.201518       3.913106 0.000000       0.000000 8.201518       3.913106 ?        ?        23.75761 6.548771 0.000000       6.548771 
1 1 1 -20 30 3  o 11.66384 5.151186 -0.3541476     2.871382 -4.549669      4.827093 1.943368       3.572086 12.35891 5.876445 15.15355 6.164804 -2.794641      8.516890 
1 1 1 -20 30 4  o 41.98960 3.945200 22.78255       3.989596 12.58194       6.871771 27.96910       4.899989 27.95502 8.933825 46.24570 4.400972 -18.29069      9.959005 
1 1 1 -20 30 5  o 34.40362 6.175764 16.57394       4.987369 13.81637       6.869919 19.64676       7.251988 29.36610 8.861709 35.55865 8.487214 -6.192554      12.27040 
1 1 1 -20 30 6  o 15.96937 6.271119 2.624934       3.566015 -1.714077      5.769862 5.306698       4.536077 15.23870 6.962892 19.88514 7.233284 -4.646444      10.04003 
1 1 1 -20 30 7  o 13.25911 5.776705 0.1138784      3.502257 3.095533       5.673466 -1.721862      4.451696 18.47175 7.668255 13.38957 6.117241 5.082181       9.809321 
1 1 1 -20 30 8  o 36.05055 5.148714 17.46928       4.394871 13.88427       7.257262 19.54539       5.522704 29.25443 9.159982 37.35812 6.289589 -8.103689      11.11144 
1 1 1 -20 30 9  o 14.76848 6.167908 1.380544       3.702642 0.2543578      6.159963 2.017604       4.633008 16.87665 7.494371 16.51583 6.898685 0.3608170      10.18614 
1 1 1 -20 30 10 o 14.40217 6.431672 -0.5411915     4.603055 0.000000       0.000000 -0.5411915     4.603055 ?        ?        14.40217 6.431672 0.000000       6.431672 
1 1 1 -20 30 11 o 23.09831 6.988284 7.813987       4.268360 8.891325       7.561623 7.310182       5.170955 24.21250 9.232534 22.35339 7.764084 1.859112       12.06320 
1 1 1 -20 30 12 o 25.74800 6.405784 9.542592       4.002904 8.852354       8.227876 9.756620       4.581672 24.22540 9.521946 25.65186 7.092086 -1.426468      11.87287 
1 1 1 -20 30 13 o 29.49812 5.743686 12.12422       3.980224 16.15119       7.952393 10.77827       4.597520 30.87516 9.576447 27.02348 6.944331 3.851675       11.82929 
1 1 1 -20 30 14 o 42.21164 5.070635 23.98079       5.111621 20.24589       7.167327 27.84689       7.292136 35.96641 8.339993 43.69662 7.090961 -7.730209      10.94702 
1 1 1 -20 30 15 o 44.76284 3.985018 26.03203       4.301547 26.17182       7.327691 25.95852       5.313386 41.90283 7.449052 43.89188 5.060165 -1.989048      9.005201 
1 1 1 -20 30 16 o 21.05037 6.578246 6.455101       3.744759 3.147852       6.129820 8.424333       4.730016 18.56361 7.855027 23.52669 7.399076 -4.963078      10.79110 
1 1 1 -20 30 17 o 42.53700 4.250640 23.82970       4.347185 21.79583       7.160617 25.01687       5.470715 37.23594 8.120638 42.67448 5.379973 -5.438545      9.741092 
1 1 1 -20 30 18 o 39.30405 4.537893 20.63967       4.266661 11.53714       7.062820 25.87046       5.354025 25.95374 9.070151 43.52406 5.147449 -17.57033      10.42899 
1 1 1 -20 30 19 o 56.16602 3.964049 41.21025       5.390760 49.11780       14.10622 39.85792       5.833536 49.80121 11.80460 54.80613 4.404907 -5.004917      12.59967 
1 1 1 -20 30 20 o 13.42931 5.780281 0.7167906      3.421824 0.1030781      6.036507 1.007358       4.153619 16.12356 7.269349 14.67393 6.342506 1.449630       9.647322 
1 1 1 -20 30 21 o 12.85722 5.650610 0.1398774      3.415988 4.607354       6.316272 -1.707012      4.061160 19.34753 8.066222 12.47686 5.752528 6.870665       9.907347 
1 1 1 -20 30 22 o 23.08678 6.247387 7.982933       3.599566 7.628013       6.412272 8.146235       4.349536 21.79489 8.452075 22.80034 7.084046 -1.005457      11.02820 
1 1 1 -20 30 23 f 16.35539 6.716815 2.850471       4.290126 1.337884       6.395720 4.087775       5.784525 16.97322 7.580484 18.47159 7.711511 -1.498377      10.81347 
1 1 1 -20 31 1  o 13.49413 5.512137 1.470093       2.869848 -4.162316      5.095802 4.086315       3.472983 12.76943 6.061894 17.47807 6.333277 -4.708634      8.766810 
1 1 1 -20 31 2  f 29.30558 5.745551 12.14670       3.956433 26.88232       6.750427 4.436101       4.883051 42.98573 6.659451 18.70939 7.340983 24.27633       9.911525 
1 1 1 -20 31 3  f 28.25077 5.431528 11.12497       3.603491 5.782808       6.185014 13.87016       4.433716 20.65719 8.212659 31.17533 6.054370 -10.51814      10.20310 
1 1 1 -20 31 4  o 17.41577 6.761540 3.640175       4.107280 -2.372885      5.369186 12.12281       6.377141 14.13025 6.549792 27.16197 8.597758 -13.03172      10.80839 
1 1 1 -20 31 5  o 25.98116 5.618430 9.499802       3.453499 7.459190       6.143732 10.44244       4.175646 22.28859 8.361606 26.71475 6.481092 -4.426161      10.57927 
1 1 1 -20 31 6  o 19.32990 6.248960 5.297516       3.355370 9.066957       6.048757 3.622031       4.032719 23.97133 8.392632 17.37144 6.711983 6.599895       10.74649 
1 1 1 -20 31 7  o 32.38361 5.004006 14.23262       3.821766 9.372362       6.482977 16.82125       4.731298 24.24822 8.669842 34.67984 5.803321 -10.43162      10.43287 
1 1 1 -20 31 8  o 22.40697 6.472480 7.341384       3.731519 1.363749       6.457448 10.33817       4.572190 17.61075 7.753333 26.25265 7.013606 -8.641907      10.45490 
1 1 1 -20 31 9  o 28.41004 6.004044 11.49247       4.026411 8.392615       6.907200 13.08799       4.955444 23.29206 8.837575 29.64814 6.975986 -6.356077      11.25909 
1 1 1 -20 31 10 o 42.75594 5.237788 24.88471       5.343485 0.000000       0.000000 24.88471       5.343485 ?        ?        42.75594 5.237788 0.000000       5.237788 
1 1 1 -20 31 11 o 18.74520 6.470335 4.893268       3.588836 4.493929       6.567012 5.063320       4.285369 19.84545 8.245270 19.19960 7.023365 0.6458549      10.83107 
1 1 1 -20 31 12 o 32.72937 5.340208 14.77852       4.112508 9.503918       8.004557 16.67011       4.793539 24.16805 9.423368 34.34405 5.942575 -10.17600      11.14065 
1 1 1 -20 31 13 o 22.64669 7.514584 7.870891       4.838266 4.476889       7.403906 10.40041       6.391805 20.18366 8.590333 25.12932 8.636559 -4.945663      12.18130 
1 1 1 -20 31 14 o 55.04764 4.338076 40.01340       5.772319 22.74408       9.814136 49.14722       7.137406 34.51381 10.62714 60.41970 4.889323 -25.90589      11.69793 
1 1 1 -20 31 15 o 46.77099 3.989527 28.62987       4.503727 31.94312       7.776250 26.95756       5.524616 46.21038 7.134999 44.33055 5.213583 1.879826       8.836835 
1 1 1 -20 31 16 o 17.49839 6.430364 4.098399       3.598701 -1.346926      6.147553 6.937187       4.438712 15.46178 7.110165 21.36467 7.199540 -5.902894      10.11869 
1 1 1 -20 31 17 o 19.79450 6.610533 5.768832       3.742902 8.180485       6.467528 4.554378       4.589563 22.55593 8.553199 18.49723 7.156782 4.058704       11.15243 
1 1 1 -20 31 18 o 14.82086 6.052712 2.045191       3.459379 -0.9473464     5.818080 3.681758       4.302559 15.24000 6.974230 17.34966 6.865106 -2.109662      9.786192 
1 1 1 -20 31 19 o 19.98203 6.887345 5.992254       4.065814 -10.04402      11.07562 8.489867       4.370982 16.59088 8.126138 23.30224 7.076369 -6.711357      10.77539 
1 1 1 -20 31 20 o 18.09378 6.579998 4.634975       3.753380 12.37449       6.851130 1.315864       4.486588 26.25945 8.943762 15.19749 6.580309 11.06196       11.10366 
1 1 1 -20 31 21 o 22.00747 6.458950 7.372156       3.689689 6.055319       6.388660 8.031214       4.519660 20.32552 8.253499 22.47808 7.251328 -2.152561      10.98645 
1 1 1 -20 32 1  o 12.91563 5.684989 0.1518634      3.469913 0.000000       0.000000 0.1518634      3.469913 ?        ?        12.91563 5.684989 0.000000       5.684989 
1 1 1 -20 32 2  o 27.64365 5.200230 10.71150       3.374573 5.432630       5.571143 13.77077       4.241146 19.68145 7.804212 30.93050 5.840813 -11.24905      9.747863 
1 1 1 -20 32 3  o 25.79157 5.580814 9.515336       3.405571 6.585382       6.408442 10.66841       4.020228 21.01276 8.357838 26.85496 6.259309 -5.842194      10.44186 
1 1 1 -20 32 4  o 14.73526 6.308491 1.265125       4.035110 1.775663       5.201056 0.4932109      6.395311 16.40381 7.093769 16.66502 7.500597 -0.2612076     10.32378 
1 1 1 -20 32 5  o 18.26882 6.270888 4.735285       3.369465 1.002577       5.786425 6.650317       4.144635 16.43753 7.283386 20.97561 6.954930 -4.538074      10.07069 
1 1 1 -20 32 6  f 50.26298 3.894939 33.01015       4.733530 27.85477       8.285347 35.50823       5.767448 41.34188 8.507882 51.41656 4.653366 -10.07468      9.697312 
1 1 1 -20 32 7  o 16.34600 6.242165 3.288331       3.459842 -3.500962      5.920586 6.809187       4.263601 14.10761 6.648081 21.19999 7.054801 -7.092380      9.693667 
1 1 1 -20 32 8  o 36.28682 4.753091 17.84089       4.102072 12.98057       7.283399 20.09883       4.964297 27.06202 9.221513 37.89598 5.539245 -10.83396      10.75730 
1 1 1 -20 32 9  o 21.43178 7.237364 7.009691       4.485466 0.000000       0.000000 7.009691       4.485466 ?        ?        21.43178 7.237364 0.000000       7.237364 
1 1 1 -20 32 10 o 28.37197 5.736747 11.49627       3.829852 9.733928       6.994122 12.25101       4.577044 24.00337 8.938314 28.57018 6.692201 -4.566803      11.16598 
1 1 1 -20 32 11 o 31.46687 5.593015 13.98779       4.131647 1.915917       7.442791 19.36483       4.967295 18.36992 8.192672 37.04569 5.683477 -18.67577      9.971047 
1 1 1 -20 32 12 o 18.04871 6.598568 4.490882       3.781838 0.7858976      7.111457 5.951843       4.465650 17.46487 7.880630 20.05605 7.192699 -2.591179      10.66955 
1 1 1 -20 32 13 o 27.31126 7.662414 11.95931       5.305872 12.76722       8.058101 11.34093       7.049844 26.30768 9.629739 25.41090 9.045827 0.8967800      13.21207 
1 1 1 -20 32 14 o 11.44840 5.328510 -2.148292      3.610184 7.142951       7.262116 -5.198212      4.160738 21.65314 8.797042 10.75890 5.203159 10.89423       10.22061 
1 1 1 -20 32 15 o 11.24536 5.261548 -2.402893      3.595548 -0.9426814     6.706294 -2.991962      4.259493 16.09876 7.411509 12.00401 5.651247 4.094754       9.320250 
1 1 1 -20 32 16 o 17.21392 6.416708 3.986303       3.606325 2.348980       6.102835 4.864818       4.470324 17.46717 7.617564 18.64550 7.101410 -1.178328      10.41428 
1 1 1 -20 32 17 o 13.54361 5.873155 0.6886629      3.585165 -7.895903      5.932324 5.628036       4.499887 12.25571 5.991006 19.49218 7.185846 -7.236465      9.355669 
1 1 1 -20 32 18 o 24.91943 6.932880 9.708587       4.363215 18.06020       11.91882 8.416162       4.688683 27.82525 11.28266 22.90232 7.385451 4.922934       13.48493 
1 1 1 -20 33 1  o 22.41952 6.734190 7.870227       3.973927 0.000000       0.000000 7.870227       3.973927 ?        ?        22.41952 6.734190 0.000000       6.734190 
1 1 1 -20 33 2  o 11.21871 5.031491 -0.5119612     2.849610 -4.754083      4.686949 1.975703       3.589174 11.68979 5.620345 14.73467 6.106440 -3.044877      8.299210 
1 1 1 -20 33 3  o 13.82697 5.710491 1.619622       3.123986 -5.674406      5.478493 5.134111       3.802844 12.42813 6.000646 18.68503 6.644555 -6.256896      8.953093 
1 1 1 -20 33 4  o 18.02991 6.281556 4.686073       3.386056 5.488571       5.917944 4.295485       4.128648 19.67193 7.959812 17.76970 6.810639 1.902233       10.47585 
1 1 1 -20 33 5  o 12.74086 5.534073 0.4571760      3.193834 -4.427806      5.627557 2.778198       3.879074 13.17297 6.286295 15.93374 6.445412 -2.760772      9.003380 
1 1 1 -20 33 6  o 27.22984 5.805587 10.77724       3.734631 4.657331       6.796976 13.42387       4.469810 19.44202 8.251011 30.05755 6.304008 -10.61553      10.38363 
1 1 1 -20 33 7  o 11.13759 5.157121 -1.765705      3.315420 12.85584       6.811193 -6.305776      3.795404 26.78765 8.916850 9.621655 4.721735 17.16599       10.08985 
1 1 1 -20 33 8  o 18.71471 6.523530 5.108697       3.652208 2.767504       6.509134 6.184414       4.412185 18.00620 7.859582 20.16751 7.158607 -2.161318      10.63102 
1 1 1 -20 33 9  o 17.22840 6.806587 3.716029       4.223530 0.000000       0.000000 3.716029       4.223530 ?        ?        17.22840 6.806587 0.000000       6.806587 
1 1 1 -20 33 10 o 13.05950 5.682429 0.4825189      3.379689 -5.634408      6.332402 2.918943       3.996486 13.55769 6.522115 16.20394 6.546711 -2.646248      9.241073 
1 1 1 -20 33 11 o 10.88624 5.116807 -2.561236      3.467285 -4.455292      6.433196 -1.785779      4.116321 14.13225 6.737727 12.45325 5.759313 1.679005       8.863783 
1 1 1 -20 33 12 o 12.43777 5.805300 -2.344102      4.333543 2.158210       5.814285 -7.971004      6.499998 17.04796 7.435012 12.91722 6.305007 4.130741       9.748463 
1 1 1 -20 33 13 o 13.63979 5.913145 0.7433909      3.632003 -7.932650      7.011466 3.925266       4.246094 13.50275 6.581460 17.43279 6.843859 -3.930037      9.494947 
1 1 1 -20 33 14 o 21.49837 6.871776 7.176087       4.065512 11.50719       7.767407 5.541857       4.771263 24.84793 9.384468 19.39716 7.348485 5.450775       11.91925 
1 1 1 -19 0  1  o 23.60192 7.281797 8.491323       3.664290 8.491323       3.664290 8.491323       3.664290 23.60192 7.281797 23.60192 7.281797 0.000000       0.000000 
1 1 1 -19 0  2  o 11.91068 7.023310 1.961988       3.480111 1.961988       3.480111 1.961988       3.480111 11.91068 7.023310 11.91068 7.023310 0.000000       0.000000 
1 1 1 -19 0  3  o 272.7861 6.209358 910.8005       41.22842 910.8005       41.22842 910.8005       41.22842 272.7861 6.209358 272.7861 6.209358 -0.000000      0.000000 
1 1 1 -19 0  4  o 36.90186 4.039165 17.19968       3.521703 17.19968       3.521703 17.19968       3.521703 36.90186 4.039165 36.90186 4.039165 -0.000000      0.000000 
1 1 1 -19 0  5  o 32.38562 5.557025 13.87862       3.998445 13.87862       3.998445 13.87862       3.998445 32.38562 5.557025 32.38562 5.557025 -0.000000      0.000000 
1 1 1 -19 0  6  o 157.3102 4.376554 302.6557       16.74806 302.6557       16.74806 302.6557       16.74806 157.3102 4.376554 157.3102 4.376554 0.000000       0.000000 
1 1 1 -19 0  7  o 74.36449 3.745202 67.96252       6.747512 67.96252       6.747512 67.96252       6.747512 74.36449 3.745202 74.36449 3.745202 -0.000000      0.000000 
1 1 1 -19 0  8  o 89.78799 3.718761 98.83563       8.104978 98.83563       8.104978 98.83563       8.104978 89.78799 3.718761 89.78799 3.718761 0.000000       0.000000 
1 1 1 -19 0  9  o 96.50877 3.756338 114.1203       8.803756 114.1203       8.803756 114.1203       8.803756 96.50877 3.756338 96.50877 3.756338 -0.000000      0.000000 
1 1 1 -19 0  10 o 250.7932 5.775893 769.5264       35.25742 769.5264       35.25742 769.5264       35.25742 250.7932 5.775893 250.7932 5.775893 0.000000       0.000000 
1 1 1 -19 0  11 o 240.7640 5.611330 709.1563       32.88217 709.1563       32.88217 709.1563       32.88217 240.7640 5.611330 240.7640 5.611330 0.000000       0.000000 
1 1 1 -19 0  12 o 69.68166 6.007267 60.63193       10.01918 60.63193       10.01918 60.63193       10.01918 69.68166 6.007267 69.68166 6.007267 -0.000000      0.000000 
1 1 1 -19 0  13 o 20.71657 10.37795 7.752662       6.412562 7.752662       6.412562 7.752662       6.412562 20.71657 10.37795 20.71657 10.37795 0.000000       0.000000 
1 1 1 -19 0  14 o 63.35835 3.976046 49.54939       6.082837 49.54939       6.082837 49.54939       6.082837 63.35835 3.976046 63.35835 3.976046 -0.000000      0.000000 
1 1 1 -19 0  15 o 57.50216 4.170197 40.97739       5.771465 40.97739       5.771465 40.97739       5.771465 57.50216 4.170197 57.50216 4.170197 0.000000       0.000000 
1 1 1 -19 0  16 o 206.8735 5.068558 523.5453       25.51738 523.5453       25.51738 523.5453       25.51738 206.8735 5.068558 206.8735 5.068558 0.000000       0.000000 
1 1 1 -19 0  17 o 71.39047 3.972144 62.76016       6.861099 62.76016       6.861099 62.76016       6.861099 71.39047 3.972144 71.39047 3.972144 -0.000000      0.000000 
1 1 1 -19 0  18 o 212.2660 5.170028 551.3359       26.70712 551.3359       26.70712 551.3359       26.70712 212.2660 5.170028 212.2660 5.170028 -0.000000      0.000000 
1 1 1 -19 0  19 o 38.36362 9.657785 21.12291       7.808493 21.12291       7.808493 21.12291       7.808493 38.36362 9.657785 38.36362 9.657785 -0.000000      0.000000 
1 1 1 -19 0  20 o 25.27992 8.721266 10.18590       4.838084 10.18590       4.838084 10.18590       4.838084 25.27992 8.721266 25.27992 8.721266 -0.000000      0.000000 
1 1 1 -19 0  21 o 188.8705 4.825170 436.6016       22.17542 436.6016       22.17542 436.6016       22.17542 188.8705 4.825170 188.8705 4.825170 -0.000000      0.000000 
1 1 1 -19 0  22 f 13.56394 8.547093 1.046051       5.969356 1.046051       5.969356 1.046051       5.969356 13.56394 8.547093 13.56394 8.547093 0.000000       0.000000 
1 1 1 -19 0  23 o 221.1871 5.347432 599.2588       28.78508 599.2588       28.78508 599.2588       28.78508 221.1871 5.347432 221.1871 5.347432 0.000000       0.000000 
1 1 1 -19 0  24 o 134.5833 4.179007 221.8498       13.67573 221.8498       13.67573 221.8498       13.67573 134.5833 4.179007 134.5833 4.179007 0.000000       0.000000 
1 1 1 -19 0  25 o 123.7745 4.149681 187.7779       12.48456 187.7779       12.48456 187.7779       12.48456 123.7745 4.149681 123.7745 4.149681 -0.000000      0.000000 
1 1 1 -19 0  26 o 109.7215 5.648231 148.6222       15.01035 148.6222       15.01035 148.6222       15.01035 109.7215 5.648231 109.7215 5.648231 -0.000000      0.000000 
1 1 1 -19 0  27 o 93.55347 4.113585 107.5967       9.336762 107.5967       9.336762 107.5967       9.336762 93.55347 4.113585 93.55347 4.113585 0.000000       0.000000 
1 1 1 -19 0  28 o 53.47102 4.859697 35.86435       6.205925 35.86435       6.205925 35.86435       6.205925 53.47102 4.859697 53.47102 4.859697 0.000000       0.000000 
1 1 1 -19 0  29 o 12.88614 7.885733 1.781187       4.723585 1.781187       4.723585 1.781187       4.723585 12.88614 7.885733 12.88614 7.885733 -0.000000      0.000000 
1 1 1 -19 0  30 o 18.74080 9.000141 6.424640       4.743813 6.424640       4.743813 6.424640       4.743813 18.74080 9.000141 18.74080 9.000141 0.000000       0.000000 
1 1 1 -19 0  31 o 15.23586 9.566817 1.770205       7.407156 1.770205       7.407156 1.770205       7.407156 15.23586 9.566817 15.23586 9.566817 -0.000000      0.000000 
1 1 1 -19 0  32 o 42.64712 5.640425 23.56251       5.576519 23.56251       5.576519 23.56251       5.576519 42.64712 5.640425 42.64712 5.640425 -0.000000      0.000000 
1 1 1 -19 0  33 o 64.87260 4.557176 52.55121       7.121172 52.55121       7.121172 52.55121       7.121172 64.87260 4.557176 64.87260 4.557176 -0.000000      0.000000 
1 1 1 -19 0  34 o 14.55949 8.205830 3.654221       4.436560 3.654221       4.436560 3.654221       4.436560 14.55949 8.205830 14.55949 8.205830 -0.000000      0.000000 
1 1 1 -19 0  35 o 99.19303 4.220483 122.0493       10.15975 122.0493       10.15975 122.0493       10.15975 99.19303 4.220483 99.19303 4.220483 -0.000000      0.000000 
1 1 1 -19 0  36 o 84.39430 4.339424 88.86814       8.870298 88.86814       8.870298 88.86814       8.870298 84.39430 4.339424 84.39430 4.339424 -0.000000      0.000000 
1 1 1 -19 0  37 o 74.78598 5.976118 71.89992       10.72635 71.89992       10.72635 71.89992       10.72635 74.78598 5.976118 74.78598 5.976118 -0.000000      0.000000 
1 1 1 -19 0  38 o 45.54612 5.681739 27.37294       6.041463 27.37294       6.041463 27.37294       6.041463 45.54612 5.681739 45.54612 5.681739 -0.000000      0.000000 
1 1 1 -19 0  39 o 57.96918 4.984166 43.29296       6.916265 43.29296       6.916265 43.29296       6.916265 57.96918 4.984166 57.96918 4.984166 -0.000000      0.000000 
1 1 1 -19 0  40 o 14.23816 8.455873 3.562557       5.109682 3.562557       5.109682 3.562557       5.109682 14.23816 8.455873 14.23816 8.455873 0.000000       0.000000 
1 1 1 -19 0  41 o 14.51197 9.197630 2.798373       7.026428 2.798373       7.026428 2.798373       7.026428 14.51197 9.197630 14.51197 9.197630 0.000000       0.000000 
1 1 1 -19 0  42 o 14.32863 8.457919 3.975473       5.056325 3.975473       5.056325 3.975473       5.056325 14.32863 8.457919 14.32863 8.457919 -0.000000      0.000000 
1 1 1 -19 0  43 o 32.18285 9.116023 17.33997       6.191218 17.33997       6.191218 17.33997       6.191218 32.18285 9.116023 32.18285 9.116023 -0.000000      0.000000 
1 1 1 -19 0  44 o 20.57457 9.924884 9.545830       5.776497 9.545830       5.776497 9.545830       5.776497 20.57457 9.924884 20.57457 9.924884 0.000000       0.000000 
1 1 1 -19 1  1  o 176.6726 2.970247 380.8617       12.78786 386.7234       16.67260 372.4859       19.92969 177.9409 3.844957 174.4700 4.691783 3.470840       6.066014 
1 1 1 -19 1  2  o 296.7477 4.189148 1075.950       30.29348 1058.667       38.81472 1102.884       48.45399 294.0798 5.416206 299.8107 6.632027 -5.730957      8.562655 
1 1 1 -19 1  3  o 156.8512 2.752944 300.1205       10.52256 296.3472       13.64895 305.6491       16.52140 155.7971 3.595041 158.0978 4.292268 -2.300751      5.598918 
1 1 1 -19 1  4  o 59.90826 2.531542 43.85102       3.687465 43.80738       5.788647 43.88082       4.783635 59.75518 3.998265 59.87165 3.291354 -0.1164703     5.178720 
1 1 1 -19 1  5  o 173.1527 3.238046 365.8949       13.66307 374.5564       19.54110 357.6105       19.11107 174.9905 4.586409 170.9828 4.590813 4.007736       6.489277 
1 1 1 -19 1  6  o 144.1554 2.955915 253.5366       10.38387 255.5034       14.72273 251.5898       14.64757 144.5580 4.183765 143.4444 4.194815 1.113632       5.924556 
1 1 1 -19 1  7  o 184.0507 3.330543 413.4338       14.93787 393.4358       20.70274 435.1522       21.57493 179.3288 4.741577 188.6682 4.692609 -9.339417      6.671067 
1 1 1 -19 1  8  o 100.6362 2.683645 123.6213       6.575482 118.9327       9.277656 128.3536       9.320766 98.61140 3.868284 102.4606 3.739276 -3.849228      5.380131 
1 1 1 -19 1  9  o 46.22164 3.058434 26.18175       3.425558 23.94798       4.912796 28.29544       4.778921 44.01913 4.650048 47.95189 4.129865 -3.932762      6.219223 
1 1 1 -19 1  10 o 246.2334 4.018459 740.5722       24.11253 744.7830       34.31762 736.4664       33.88698 246.6242 5.710121 245.2519 5.670017 1.372330       8.047023 
1 1 1 -19 1  11 o 195.2044 3.434577 465.1297       16.33800 465.3719       23.10389 464.8875       23.10695 195.0778 4.860054 194.9758 4.863242 0.1020050      6.875408 
1 1 1 -19 1  12 o 61.23921 3.266221 45.90063       4.856658 41.11926       5.759661 57.66491       9.034472 57.87104 4.110892 68.41944 5.463970 -10.54840      6.837719 
1 1 1 -19 1  13 o 205.0550 4.108703 513.7139       20.53105 519.3440       36.42533 511.0923       24.85553 205.4556 7.286813 204.4001 4.990062 1.055527       8.831668 
1 1 1 -19 1  14 f 126.0855 2.805866 193.9530       8.621209 208.4423       12.70270 181.5794       11.73874 130.5631 3.997157 121.8558 3.958363 8.707253       5.625469 
1 1 1 -19 1  15 o 183.8099 3.318594 412.4272       14.86480 430.5813       21.57446 396.0204       20.50992 187.5752 4.723610 179.8918 4.682586 7.683395       6.651248 
1 1 1 -19 1  16 o 117.4827 2.768777 168.3949       7.926798 163.1735       11.16026 173.7107       11.26078 115.4985 3.971078 119.1837 3.882356 -3.685188      5.553570 
1 1 1 -19 1  17 o 417.3668 7.231514 2142.289       73.55009 2204.511       129.6125 2112.736       89.32487 419.1850 12.70300 413.5180 8.864246 5.666992       15.49004 
1 1 1 -19 1  18 o 214.5006 4.227396 562.4881       22.09722 532.8003       37.29538 578.5475       27.43032 207.9306 7.372051 217.3598 5.178639 -9.429214      9.009186 
1 1 1 -19 1  19 o 79.76698 3.252920 77.81540       6.309872 71.98764       7.754291 89.23722       10.85573 76.62244 4.168586 85.19087 5.254710 -8.568428      6.707390 
1 1 1 -19 1  20 o 219.7978 4.319127 590.9138       23.13425 594.7055       28.50734 583.6003       39.59134 220.2854 5.310492 217.4754 7.481716 2.810074       9.174825 
1 1 1 -19 1  21 o 109.4726 2.798957 146.3682       7.460731 147.9268       10.70358 144.8954       10.40490 109.9189 4.002638 108.7946 3.931053 1.124260       5.610196 
1 1 1 -19 1  22 o 102.8800 2.787991 129.2927       6.983253 123.0704       9.880453 135.5033       9.871177 100.2282 4.053663 105.2032 3.856910 -4.974998      5.595350 
1 1 1 -19 1  23 o 67.83654 3.355875 56.36338       5.530384 60.02510       9.580978 54.53372       6.772576 69.68211 5.691795 66.62527 4.192629 3.056839       7.069276 
1 1 1 -19 1  24 o 75.56533 2.891971 69.83401       5.315576 66.00578       7.560461 73.57616       7.474986 73.30080 4.250799 77.44149 3.974253 -4.140686      5.819276 
1 1 1 -19 1  25 o 193.1992 3.480363 456.4610       16.38574 470.6422       23.69199 443.4579       22.68656 195.7449 4.970802 190.0247 4.903264 5.720169       6.982183 
1 1 1 -19 1  26 o 86.37486 3.337270 91.37768       7.011273 91.12614       8.898825 91.78941       11.38528 86.11648 4.253597 86.19976 5.447896 -0.8328247E-01 6.911777 
1 1 1 -19 1  27 o 136.2141 3.439871 227.2310       11.40913 218.0124       19.25896 232.2156       14.16159 132.7407 5.969051 137.5221 4.230777 -4.781448      7.316355 
1 1 1 -19 1  28 o 95.11017 2.892616 110.7234       6.696513 104.9612       9.492764 116.4313       9.447993 92.35934 4.228923 97.33549 3.991671 -4.976151      5.815258 
1 1 1 -19 1  29 o 38.98519 4.195347 18.89332       3.923032 17.14640       5.607111 20.56847       5.490728 36.60339 6.525446 40.36727 5.743543 -3.763882      8.693085 
1 1 1 -19 1  30 o 75.47768 3.527971 70.08097       6.471073 64.92974       11.84179 72.27415       7.726797 71.69395 6.861586 76.51140 4.159813 -4.817451      8.024052 
1 1 1 -19 1  31 o 38.72684 6.873247 19.38607       6.248937 27.61702       9.208642 12.36064       8.507594 45.80156 8.565286 30.92659 9.946190 14.87497       13.12596 
1 1 1 -19 1  32 o 16.55297 6.145499 2.729608       3.301561 4.266563       4.793119 1.342021       4.554257 20.14979 7.418359 16.78846 6.910318 3.361332       10.13827 
1 1 1 -19 1  33 f 76.78970 3.000711 72.60147       5.604365 67.51610       7.884222 77.79547       7.967981 73.60047 4.416154 79.12489 4.146843 -5.524414      6.057948 
1 1 1 -19 1  34 o 41.42814 3.929797 21.47868       3.919920 22.07851       5.649448 20.92179       5.443495 41.40714 5.754061 40.30981 5.700432 1.097332       8.099639 
1 1 1 -19 1  35 o 49.33094 3.596947 30.35176       4.294326 33.10758       6.258471 27.89988       5.903270 50.95576 5.108939 46.66589 5.283938 4.289871       7.349916 
1 1 1 -19 1  36 o 50.96416 3.585544 32.50265       4.424616 33.61718       6.354441 31.45372       6.164583 51.12725 5.171238 49.42823 5.195494 1.699024       7.330407 
1 1 1 -19 1  37 o 90.82454 4.032297 104.1066       8.902414 108.8286       12.81180 99.69823       12.37917 91.21751 5.793566 87.22898 5.857599 3.988533       8.238743 
1 1 1 -19 1  38 o 26.88370 5.755043 9.836960       3.656505 10.98357       5.336442 8.822227       5.020192 27.54672 7.668448 24.83598 7.592015 2.710741       10.79091 
1 1 1 -19 1  39 f 41.39929 4.227571 22.17295       4.205205 23.61168       6.208103 20.95310       5.716395 41.30404 6.372560 38.97451 6.228308 2.329536       8.910743 
1 1 1 -19 1  40 o 36.96696 4.774218 18.14630       4.200499 21.68306       6.009799 14.76831       5.873355 39.15972 6.527375 31.26847 7.747895 7.891243       10.13097 
1 1 1 -19 1  41 o 15.56104 6.761568 0.9446979      4.771492 5.119535       6.991056 -2.695951      6.528485 20.58033 8.525123 15.40220 7.167661 5.178135       11.13791 
1 1 1 -19 1  42 o 11.55222 5.357465 -1.983501      3.599061 -4.952044      5.087363 0.9908310      5.092322 12.32104 5.905910 15.71865 6.903955 -3.397604      9.085393 
1 1 1 -19 1  43 o 22.08718 6.601164 7.562765       3.825694 5.106915       5.366751 10.10007       5.455027 19.01081 7.619318 24.36538 7.974327 -5.354568      11.02923 
1 1 1 -19 1  44 o 12.24627 5.616015 -1.091922      3.799271 -1.594300      5.393611 -0.5971584     5.352583 14.00427 6.516381 14.51268 6.659280 -0.5084171     9.317147 
1 1 1 -19 2  1  o 191.0125 2.838847 445.1448       13.21417 460.7544       18.97319 430.4407       18.41464 194.2056 4.009058 187.7063 4.025762 6.499283       5.681488 
1 1 1 -19 2  2  o 90.39309 2.224329 99.63694       4.899709 102.9930       6.881853 96.18678       6.977611 91.81815 3.080037 88.71667 3.232900 3.101486       4.465229 
1 1 1 -19 2  3  o 120.0024 2.497401 175.6351       7.303217 175.4682       9.503946 175.8756       11.41268 119.8602 3.256833 119.9361 3.910052 -0.7585144E-01 5.088759 
1 1 1 -19 2  4  o 130.7335 2.845986 208.5088       9.066833 202.7894       12.86524 214.1526       12.78007 128.7760 4.104892 132.3539 3.966895 -3.577835      5.708449 
1 1 1 -19 2  5  o 253.7487 3.706026 786.1881       22.91651 778.3806       36.06335 791.4761       29.67918 252.0867 5.870568 254.4223 4.786970 -2.335617      7.574870 
1 1 1 -19 2  6  o 166.1801 3.167117 336.9968       12.82564 321.0303       17.85590 354.0145       18.43431 162.0043 4.527361 170.1405 4.449960 -8.136200      6.348160 
1 1 1 -19 2  7  o 181.2801 3.310501 401.0766       14.62447 426.9956       21.47642 378.6664       19.96989 186.8269 4.721004 175.9384 4.661889 10.88852       6.634840 
1 1 1 -19 2  8  o 142.7390 2.933338 248.5749       10.20330 250.2649       14.67097 246.9917       14.19985 143.0629 4.212782 142.1363 4.103907 0.9265747      5.881292 
1 1 1 -19 2  9  o 244.9062 4.011078 732.6004       23.93850 763.2438       34.75670 704.9454       33.01845 249.6624 5.712803 239.9518 5.646724 9.710632       8.032535 
1 1 1 -19 2  10 o 143.4990 2.927408 251.2312       10.23689 258.4203       14.79797 244.6335       14.17634 145.3790 4.181343 141.4522 4.116997 3.926804       5.867989 
1 1 1 -19 2  11 o 161.8365 3.613224 319.7702       14.24976 313.3595       17.28691 333.3608       25.17003 160.0631 4.436177 164.7863 6.279453 -4.723221      7.688380 
1 1 1 -19 2  12 o 221.7389 3.730613 600.4064       20.15850 595.1279       28.52808 605.6703       28.48881 220.5138 5.308851 222.4684 5.254965 -1.954559      7.469843 
1 1 1 -19 2  13 o 108.1908 2.708791 142.8800       7.136089 150.0713       10.56745 136.8517       9.675360 110.7742 3.920858 105.7928 3.758943 4.981400       5.431646 
1 1 1 -19 2  14 o 113.1773 3.183145 156.4556       8.770417 149.8170       16.01390 159.3001       10.48227 110.4031 5.974491 114.1459 3.773602 -3.742821      7.066443 
1 1 1 -19 2  15 o 59.19336 2.885484 42.85369       4.149705 44.48854       6.225062 41.54620       5.567053 60.18285 4.272358 58.18378 3.949749 1.999077       5.818381 
1 1 1 -19 2  16 o 138.6799 2.905843 234.6765       9.820234 231.4416       13.99050 237.8182       13.78754 137.5505 4.178678 139.4492 4.061604 -1.898758      5.827347 
1 1 1 -19 2  17 o 147.5320 2.994194 265.6312       10.76471 258.9112       15.24924 272.3062       15.19809 145.4657 4.306556 149.2016 4.184161 -3.735931      6.004467 
1 1 1 -19 2  18 o 184.6697 3.849191 416.6844       17.32212 405.9962       29.74699 422.1681       21.30739 181.6451 6.731864 185.6931 4.712479 -4.048035      8.217387 
1 1 1 -19 2  19 o 56.76887 4.523639 39.67189       6.206256 39.67189       6.206256 0.000000       0.000000 56.76887 4.523639 ?        ?        0.000000       4.523639 
1 1 1 -19 2  20 o 38.41956 4.617752 18.32133       4.236781 17.79102       5.470367 19.11629       6.697639 37.58099 6.188488 38.76986 7.358184 -1.188866      9.614585 
1 1 1 -19 2  21 o 56.11525 3.106814 38.56704       4.231886 43.05705       6.344445 34.96814       5.680095 59.15294 4.433559 53.27618 4.414686 5.876762       6.256669 
1 1 1 -19 2  22 o 147.1075 3.025665 264.2477       10.84655 274.8344       15.85213 254.9280       14.87330 149.7918 4.347338 144.2800 4.234823 5.511780       6.069026 
1 1 1 -19 2  23 o 12.21261 5.354544 -0.7481564     3.050897 -1.843115      4.663897 0.7086236E-01  4.033639 14.55356 6.488333 14.94764 6.350415 -0.3940725     9.078890 
1 1 1 -19 2  24 o 112.5121 3.251680 154.8184       8.906098 159.7743       15.63785 152.4393       10.83498 113.8769 5.652818 111.5381 3.992731 2.338814       6.920712 
1 1 1 -19 2  25 o 63.05803 3.104470 48.70819       4.755835 52.46037       7.118440 45.68309       6.391643 65.26264 4.503553 60.90585 4.334762 4.356796       6.250772 
1 1 1 -19 2  26 o 35.54979 4.946345 15.81611       4.169164 11.68635       5.555140 21.14220       6.308657 30.10089 7.579110 40.87008 6.555830 -10.76919      10.02107 
1 1 1 -19 2  27 o 54.54811 3.679563 36.60604       4.862543 36.89773       8.513915 36.46483       5.923715 54.20450 6.580124 54.31063 4.516667 -0.1061325     7.981122 
1 1 1 -19 2  28 o 39.31141 4.130761 19.17529       3.898119 19.12747       5.788469 19.21497       5.273056 38.80290 6.340335 39.03807 5.711924 -0.2351646     8.533811 
1 1 1 -19 2  29 o 54.35826 3.431192 36.36218       4.521943 36.65696       6.941803 36.14490       5.959898 54.20711 5.323687 53.98880 4.572985 0.2183151      7.018107 
1 1 1 -19 2  30 o 50.61009 3.464949 31.58020       4.247585 37.71189       6.414788 26.79267       5.668233 55.04222 4.831414 46.25918 5.113468 8.783043       7.034922 
1 1 1 -19 2  31 o 18.19102 7.387163 1.923059       5.118200 -0.2042163     7.747762 3.570207       6.817588 20.03609 8.661276 21.68277 8.621757 -1.646673      12.22098 
1 1 1 -19 2  32 o 49.98896 3.511159 30.91259       4.250008 29.19493       6.248209 32.39157       5.797863 48.07072 5.428687 50.87226 4.731045 -2.801544      7.200933 
1 1 1 -19 2  33 f 40.91864 3.959918 20.90698       3.899313 15.02885       5.520472 26.75958       5.508470 33.75601 6.942923 46.04034 4.989364 -12.28434      8.549733 
1 1 1 -19 2  34 o 64.21754 3.821198 51.30809       5.952798 50.91737       7.219053 52.13822       10.52246 63.64238 4.687660 63.28173 6.936997 0.3606453      8.372340 
1 1 1 -19 2  35 o 37.95773 4.280089 18.22902       3.890084 16.73984       5.652174 19.56927       5.362099 35.40225 6.798691 38.75392 5.860693 -3.351669      8.976075 
1 1 1 -19 2  36 o 68.41661 3.195614 58.17649       5.313129 53.03079       7.564158 63.18766       7.464630 64.49319 4.848439 70.72454 4.352219 -6.231346      6.515303 
1 1 1 -19 2  37 o 46.28952 5.119485 27.82544       5.678514 23.15394       8.080446 32.38349       7.981727 40.07897 8.535142 48.82300 6.900834 -8.744030      10.97589 
1 1 1 -19 2  38 o 23.99281 6.767989 8.086738       4.127788 7.537010       5.297166 8.936599       6.586335 23.22281 7.864894 24.97404 8.756604 -1.751226      11.77007 
1 1 1 -19 2  39 o 25.11879 6.032442 8.809383       3.646008 8.023466       5.248549 9.542341       5.068624 23.50887 7.827487 25.45354 7.596038 -1.944672      10.90731 
1 1 1 -19 2  40 o 44.00793 4.037558 25.07061       4.281768 25.90086       6.074043 24.25051       6.036798 43.36544 5.900678 41.77740 6.110332 1.588036       8.494360 
1 1 1 -19 2  41 o 15.67181 6.795012 1.063656       4.797468 1.031975       6.604187 1.099052       6.980753 17.49473 7.764865 17.86629 7.953313 -0.3715553     11.11523 
1 1 1 -19 2  42 o 18.85944 6.678581 5.106874       3.838353 8.430723       5.526119 2.008488       5.335404 22.86357 8.020588 16.70271 7.203742 6.160864       10.78071 
1 1 1 -19 2  43 o 16.84430 6.576639 3.675894       3.903071 1.087058       5.498102 6.305960       5.541709 15.90325 7.070163 20.18157 7.848776 -4.278326      10.56364 
1 1 1 -19 2  44 o 18.19553 6.657951 4.974127       3.851461 0.8000119      5.452385 9.131149       5.441209 15.45035 6.942119 22.82462 7.962143 -7.374268      10.56356 
1 1 1 -19 3  1  o 217.9740 3.077898 579.8218       16.34914 574.0762       22.97178 585.7193       23.27353 216.7225 4.349653 218.9072 4.362809 -2.184631      6.160648 
1 1 1 -19 3  2  o 133.8575 2.391484 218.5208       7.800927 212.5810       10.84657 224.8852       11.22765 131.9223 3.376721 135.6867 3.398266 -3.764435      4.790664 
1 1 1 -19 3  3  o 27.01379 4.008012 9.106724       2.558574 9.738141       3.768308 8.566674       3.485015 27.68852 5.772162 25.95094 5.669728 1.737581       8.090962 
1 1 1 -19 3  4  o 192.5571 3.441641 452.6150       16.14958 458.9393       23.11527 446.5842       22.57231 193.6523 4.902184 191.0346 4.852657 2.617661       6.897803 
1 1 1 -19 3  5  o 143.2616 2.960922 250.4114       10.33696 236.0712       14.42877 265.5322       14.81626 138.9329 4.266811 147.3718 4.129679 -8.438965      5.938007 
1 1 1 -19 3  6  o 268.1375 3.860801 878.0403       25.22732 872.2905       39.79092 881.9047       32.62144 266.7975 6.120207 268.5224 4.985246 -1.724823      7.893643 
1 1 1 -19 3  7  o 238.4420 3.941768 694.3895       22.90393 696.3515       32.61519 692.4805       32.17146 238.4883 5.611988 237.8369 5.550799 0.6514282      7.893401 
1 1 1 -19 3  8  o 122.3242 2.794909 182.5366       8.331368 184.6940       12.06033 180.5672       11.52272 122.9000 4.032361 121.5322 3.895728 1.367813       5.606838 
1 1 1 -19 3  9  o 123.6309 2.806497 186.4597       8.455272 183.0266       12.09254 189.7437       11.82700 122.3397 4.061782 124.5842 3.900416 -2.244476      5.631280 
1 1 1 -19 3  10 o 219.1734 4.311854 586.9893       23.02969 569.1746       27.76141 626.3032       41.24070 215.6670 5.282284 225.6147 7.511529 -9.947739      9.182897 
1 1 1 -19 3  11 f 168.0226 3.157537 344.5254       12.92862 351.7221       18.73338 337.9803       17.86517 169.5672 4.537627 166.2370 4.413956 3.330215       6.330329 
1 1 1 -19 3  12 o 141.3393 2.921534 243.7385       10.06259 246.2468       14.62855 241.4857       13.86355 141.8956 4.235286 140.5382 4.052264 1.357376       5.861612 
1 1 1 -19 3  13 o 231.7671 3.850901 656.0799       21.74955 683.5510       31.76100 631.8227       29.84532 236.2705 5.516308 227.1798 5.391013 9.090698       7.713150 
1 1 1 -19 3  14 o 135.2327 3.336101 223.2404       10.99403 204.1970       19.39978 232.2498       13.34359 128.8992 6.194176 137.8240 3.977099 -8.924805      7.361055 
1 1 1 -19 3  15 f 70.16518 2.758102 60.15608       4.706751 67.28886       7.189309 54.80553       6.226688 74.10612 3.995822 66.87405 3.836986 7.232071       5.539770 
1 1 1 -19 3  16 o 111.4434 2.755888 151.5277       7.484311 148.2319       10.83049 154.5401       10.35439 110.0667 4.044781 112.4163 3.785114 -2.349533      5.539616 
1 1 1 -19 3  17 o 152.1615 3.461254 282.7246       12.83436 325.6503       24.02443 265.5814       15.18240 162.8271 6.065270 147.3365 4.232965 15.49062       7.396316 
1 1 1 -19 3  18 o 130.4793 3.351378 208.0178       10.64735 217.5694       13.50663 192.3391       17.30477 133.3437 4.161696 125.1292 5.689958 8.214561       7.049492 
1 1 1 -19 3  19 o 38.72416 3.790393 18.49738       3.531106 14.17714       5.391670 21.74216       4.672633 33.35593 6.862162 41.89777 4.654995 -8.541843      8.292059 
1 1 1 -19 3  20 o 101.1975 3.236296 125.1824       7.970683 125.0005       9.996385 125.5000       13.20724 101.0298 4.068614 101.0405 5.383331 -0.1065063E-01 6.747879 
1 1 1 -19 3  21 o 128.9442 2.891359 202.9675       9.085311 185.3921       12.78042 220.9228       12.91782 123.0256 4.269454 134.3601 3.949613 -11.33456      5.816157 
1 1 1 -19 3  22 o 140.4789 2.987576 240.9624       10.22742 241.8098       14.83041 240.1938       14.12301 140.4950 4.336871 140.0574 4.142501 0.4376373      5.997396 
1 1 1 -19 3  23 o 53.48003 3.266215 35.07231       4.236394 40.64219       6.542266 31.05035       5.559358 57.40237 4.718567 50.13966 4.601212 7.262703       6.590601 
1 1 1 -19 3  24 o 95.20446 2.837100 110.7848       6.574811 104.0184       9.633697 116.6843       8.995455 92.05816 4.306255 97.59102 3.789688 -5.532860      5.736338 
1 1 1 -19 3  25 o 66.44514 3.483992 54.14244       5.621555 56.07201       7.368396 51.45517       8.695588 67.47828 4.506815 64.43852 5.592879 3.039757       7.182735 
1 1 1 -19 3  26 o 91.37688 2.916076 102.1379       6.485073 93.94017       9.463271 109.3965       8.904747 87.39568 4.458127 94.43156 3.877871 -7.035873      5.908703 
1 1 1 -19 3  27 o 66.03972 4.140853 53.70114       6.630401 0.000000       0.000000 53.70114       6.630401 ?        ?        66.03972 4.140853 0.000000       4.140853 
1 1 1 -19 3  28 o 39.59256 4.023198 19.43251       3.827843 15.88661       5.803782 22.16251       5.092474 35.13076 7.024987 42.11461 5.063481 -6.983849      8.659635 
1 1 1 -19 3  29 o 58.23822 3.305163 41.69460       4.671438 37.76778       7.012844 44.82690       6.263331 55.02777 5.294983 60.21463 4.296654 -5.186863      6.818950 
1 1 1 -19 3  30 o 45.25195 4.378113 25.47319       4.767691 33.86194       10.20308 23.12983       5.392647 50.99114 8.510865 42.89774 5.269147 8.093399       10.00993 
1 1 1 -19 3  31 o 22.00551 6.881605 6.083668       4.097350 6.716819       5.182558 5.028170       6.691431 23.42830 7.777471 22.82695 8.689651 0.6013508      11.66186 
1 1 1 -19 3  32 o 48.39619 3.551805 28.99965       4.159690 33.34161       6.281015 25.60753       5.551654 51.50866 5.069585 45.05757 5.148439 6.451092       7.225449 
1 1 1 -19 3  33 o 26.25167 5.706508 8.990068       3.546200 8.079196       5.356015 9.701040       4.731936 24.96916 7.876289 27.03321 7.094893 -2.064053      10.60063 
1 1 1 -19 3  34 o 70.29689 3.113420 61.04754       5.320240 66.10804       7.936131 56.91696       7.169980 72.62341 4.506519 67.41647 4.388158 5.206932       6.290043 
1 1 1 -19 3  35 o 55.77111 4.196837 39.08804       5.661997 36.93665       6.956234 43.31128       9.746256 53.68105 5.390498 57.15316 7.154084 -3.472115      8.957588 
1 1 1 -19 3  36 o 30.09518 5.276197 11.87125       3.728496 20.68562       5.652869 5.083849       4.960493 39.56219 6.055828 20.69347 7.558498 18.86872       9.685244 
1 1 1 -19 3  37 o 42.45805 5.503371 23.69839       5.560262 20.30319       7.822329 27.16582       7.905119 37.26105 8.762826 44.12581 7.627386 -6.864761      11.61741 
1 1 1 -19 3  38 o 25.40386 6.343204 8.988571       3.914664 -0.2792885     5.660172 17.48654       5.419979 16.28939 7.211333 35.59837 6.486783 -19.30898      9.699571 
1 1 1 -19 3  39 o 47.79017 3.928344 29.28414       4.534574 34.88197       6.574111 24.20374       6.262913 51.14117 5.354367 41.81073 6.345932 9.330441       8.303018 
1 1 1 -19 3  40 o 18.26200 6.463128 4.414295       3.594242 4.999766       5.098858 3.836039       5.067341 19.76506 7.570373 18.57750 7.417866 1.187559       10.59883 
1 1 1 -19 3  41 o 13.32991 6.142948 -1.946571      4.623395 -3.579020      6.410959 -0.1774673     6.673900 14.81472 6.961536 16.82135 7.608112 -2.006630      10.31244 
1 1 1 -19 3  42 o 21.70647 6.561079 7.104338       3.763682 5.528387       5.346682 8.652270       5.298939 19.75191 7.701547 23.15114 7.865943 -3.399233      11.00849 
1 1 1 -19 3  43 o 38.74216 4.937636 20.82598       4.555859 15.80047       6.526242 25.60290       6.362782 29.96289 8.529796 41.23596 6.550739 -11.27307      10.75498 
1 1 1 -19 3  44 o 17.30096 6.702413 4.213640       4.029110 10.56367       6.182662 -0.4738235     5.311980 23.91588 8.475498 14.51689 6.651064 9.398989       10.77361 
1 1 1 -19 4  1  o 96.84306 2.256822 114.3706       5.326008 103.9499       7.191135 127.0321       7.926702 92.23051 3.204402 101.9695 3.193904 -9.739021      4.524292 
1 1 1 -19 4  2  o 226.0687 3.455573 623.9301       19.03691 650.1263       30.81894 607.7681       24.20729 230.4233 5.488520 222.9774 4.455017 7.445984       7.069018 
1 1 1 -19 4  3  f 182.3787 3.022495 405.8741       13.43308 413.4813       21.42448 400.9463       17.24353 183.8152 4.786990 181.1792 3.905545 2.635941       6.178071 
1 1 1 -19 4  4  f 276.5349 3.971644 934.0939       26.76433 961.8658       43.06050 916.6106       34.16549 280.0841 6.308911 273.7084 5.122281 6.375702       8.126508 
1 1 1 -19 4  5  o 146.8890 2.997030 263.2665       10.72794 257.2912       15.18762 269.2167       15.15563 145.0412 4.301723 148.3808 4.195623 -3.339600      6.009000 
1 1 1 -19 4  6  o 19.69549 5.274901 4.910027       2.582279 3.394590       3.882162 6.112593       3.458273 18.40320 6.692016 22.03305 6.187716 -3.629858      9.114325 
1 1 1 -19 4  7  o 178.2263 2.945050 387.5550       12.79088 394.7713       20.60720 383.0323       16.31389 179.6287 4.711750 177.1063 3.779961 2.522430       6.040587 
1 1 1 -19 4  8  o 261.3221 4.900670 835.1641       31.20813 820.4432       37.89835 866.1745       55.00579 258.7671 6.010008 265.0022 8.528817 -6.235077      10.43364 
1 1 1 -19 4  9  o 333.8970 5.962020 1365.933       48.51120 1365.239       59.47015 1367.314       83.86531 333.3464 7.320945 332.0619 10.37673 1.284485       12.69932 
1 1 1 -19 4  10 o 233.2103 3.883798 664.2492       22.07193 668.6459       31.67809 660.1008       30.77054 233.6900 5.562663 232.2170 5.437571 1.473022       7.778842 
1 1 1 -19 4  11 o 124.8958 2.799013 190.3025       8.519002 195.3744       12.55160 185.9705       11.59997 126.3951 4.080393 123.3363 3.864260 3.058884       5.619797 
1 1 1 -19 4  12 o 136.2765 2.887065 226.5865       9.587679 226.8864       14.02245 226.3232       13.13870 136.1963 4.230089 136.0585 3.966932 0.1377716      5.799155 
1 1 1 -19 4  13 o 155.4419 3.055564 294.8567       11.57432 291.3732       16.70783 298.0710       16.04914 154.3248 4.447353 156.1210 4.222341 -1.796265      6.132463 
1 1 1 -19 4  14 o 199.1497 4.032526 484.5682       19.57009 507.9772       35.91451 474.6821       23.33952 203.1537 7.266232 196.9855 4.862074 6.168198       8.742877 
1 1 1 -19 4  15 o 105.8539 3.140032 136.8796       8.090896 154.6187       15.91569 130.6978       9.395511 112.1693 5.842718 103.3777 3.735702 8.791641       6.934898 
1 1 1 -19 4  16 o 148.8319 3.432395 270.4613       12.44886 243.9919       21.09913 284.5967       15.41863 140.9038 6.159657 152.5421 4.151682 -11.63829      7.428178 
1 1 1 -19 4  17 o 156.7787 3.533755 300.1820       13.50080 283.4498       23.22214 308.7250       16.59320 151.8396 6.289591 158.8497 4.290476 -7.010086      7.613616 
1 1 1 -19 4  18 o 34.80780 4.101810 15.01345       3.412542 11.58093       5.441635 17.23840       4.381091 30.08187 7.459949 37.20301 4.955595 -7.121140      8.955935 
1 1 1 -19 4  19 o 96.45452 2.735972 113.6207       6.424381 116.0360       9.657296 111.7034       8.604469 97.33849 4.080366 95.54422 3.702597 1.794266       5.509865 
1 1 1 -19 4  20 o 105.0788 3.268611 134.9728       8.359608 135.4154       10.52084 134.2148       13.76827 105.1519 4.113733 104.4863 5.425931 0.6655655      6.809077 
1 1 1 -19 4  21 o 77.12366 2.837727 72.70530       5.324185 71.58691       8.089314 73.56005       7.071901 76.36066 4.365351 77.48412 3.756499 -1.123459      5.759130 
1 1 1 -19 4  22 o 149.8875 3.063913 274.3597       11.19123 272.0841       16.25902 276.4084       15.42729 149.0061 4.482790 150.2356 4.218042 -1.229507      6.155265 
1 1 1 -19 4  23 o 149.7296 3.080182 273.8322       11.23880 271.1526       16.41559 276.1965       15.41929 148.7151 4.534956 150.1556 4.218104 -1.440536      6.193402 
1 1 1 -19 4  24 o 12.53343 5.416979 -0.3635553     3.029459 -0.5750194     5.090405 -0.2475839     3.769725 16.22670 7.017540 14.15214 6.078873 2.074558       9.284318 
1 1 1 -19 4  25 o 87.78024 3.355973 94.35607       7.165569 92.35374       9.219912 97.41031       11.38705 86.69026 4.378535 88.86899 5.281881 -2.178726      6.860746 
1 1 1 -19 4  26 o 102.1290 3.301479 127.7083       8.205829 135.4667       16.11158 124.9908       9.535213 104.5146 6.355987 100.9411 3.883626 3.573547       7.448565 
1 1 1 -19 4  27 o 81.85691 3.215496 82.10590       6.401676 83.00311       11.75572 81.72768       7.632648 81.75302 5.941326 81.56808 3.850762 0.1849365      7.080093 
1 1 1 -19 4  28 o 56.04668 3.300214 38.59779       4.487471 47.15002       7.205755 33.17961       5.735437 61.69231 4.831572 51.73373 4.597251 9.958576       6.669243 
1 1 1 -19 4  29 o 129.0371 2.993634 203.8646       9.413459 195.7333       13.67771 211.1822       12.97533 125.9894 4.461998 131.0027 4.069387 -5.013306      6.038984 
1 1 1 -19 4  30 o 79.98576 3.448517 78.68452       6.705939 96.01620       14.17324 73.68552       7.611850 87.29250 6.714343 77.25919 4.057222 10.03331       7.844964 
1 1 1 -19 4  31 o 18.78082 6.858172 3.700164       4.083480 0.1434640      5.153632 9.699821       6.693497 16.69768 7.138571 27.55453 8.818371 -10.85685      11.34561 
1 1 1 -19 4  32 f 45.55719 3.680164 25.75319       4.050894 30.57867       6.192264 22.14311       5.355964 49.24102 5.240862 41.77733 5.386105 7.463688       7.515102 
1 1 1 -19 4  33 o 40.65110 3.959526 20.65162       3.872747 20.70930       5.871137 20.60719       5.152705 40.00079 6.225542 40.18591 5.398091 -0.1851196     8.239949 
1 1 1 -19 4  34 o 60.10672 3.303020 44.75794       4.819452 49.47727       7.320450 41.14761       6.402818 62.63230 4.833639 57.16605 4.635927 5.466248       6.697453 
1 1 1 -19 4  35 o 51.30186 3.600658 32.85196       4.472851 33.70701       6.738539 32.17851       5.980266 51.18276 5.488245 50.24567 4.948255 0.9370918      7.389591 
1 1 1 -19 4  36 o 46.52855 4.710400 27.69113       5.267393 31.10299       6.493280 21.12517       9.007796 48.90701 5.546044 37.80594 9.722919 11.10106       11.19347 
1 1 1 -19 4  37 o 20.05326 7.349104 4.887453       4.695395 0.9547856      6.780070 8.511741       6.508815 18.62051 8.075712 24.82568 8.704894 -6.205172      11.87402 
1 1 1 -19 4  38 o 24.51783 6.271630 8.374185       3.761780 5.769499       5.612090 10.49928       5.069165 21.30811 7.992087 26.93835 7.464489 -5.630243      10.93581 
1 1 1 -19 4  39 o 19.25768 6.418722 5.030163       3.529144 4.267821       5.035853 5.765916       4.947254 19.17855 7.475376 20.74174 7.552645 -1.563190      10.62656 
1 1 1 -19 4  40 o 13.81543 5.902909 0.7227648      3.520190 -1.478441      5.050940 2.801747       4.908708 14.37142 6.546651 17.44445 7.176617 -3.073025      9.714035 
1 1 1 -19 4  41 o 30.20241 7.523250 14.07732       5.516329 13.89893       7.845247 14.25177       7.758018 28.07072 9.570478 28.46870 9.517354 -0.3979740     13.49719 
1 1 1 -19 4  42 o 25.32403 6.271660 9.541737       3.849921 10.92183       5.502815 8.218523       5.388215 25.73671 7.963381 22.57214 7.919762 3.164576       11.23112 
1 1 1 -19 4  43 o 12.38689 5.614751 -0.7213315     3.658779 -4.247948      5.244820 2.621779       5.106540 12.65341 6.046690 16.65073 7.111855 -3.997317      9.334931 
1 1 1 -19 4  44 o 36.00397 5.226002 18.51631       4.451338 22.22509       6.686944 15.56511       5.965015 36.47116 7.762362 29.90713 8.020368 6.564035       11.16157 
1 1 1 -19 5  1  o 266.1503 3.538037 864.9507       22.94698 872.0401       32.53804 857.9357       32.36649 266.9535 5.001725 264.7825 5.016145 2.170929       7.083712 
1 1 1 -19 5  2  o 169.2071 2.927856 349.3542       12.07270 348.3415       19.10199 350.0278       15.57852 168.7143 4.650558 169.2896 3.776241 -0.5753784     5.990633 
1 1 1 -19 5  3  o 106.1246 2.499739 137.3672       6.464678 146.9603       10.43289 131.3882       8.236485 109.6172 3.911891 103.7009 3.263354 5.916306       5.094347 
1 1 1 -19 5  4  o 122.5502 2.850254 183.2329       8.512041 193.9346       12.52094 174.0369       11.60667 125.9256 4.085659 119.2934 3.998243 6.632187       5.716516 
1 1 1 -19 5  5  o 112.8195 2.510359 155.2426       6.901698 161.1445       11.20084 151.6302       8.762861 114.7851 4.010483 111.4158 3.230888 3.369263       5.150011 
1 1 1 -19 5  6  o 151.5647 3.055643 280.3138       11.28592 279.7647       16.15060 280.8378       15.77734 151.2347 4.386925 151.5392 4.276683 -0.3045197     6.126592 
1 1 1 -19 5  7  o 21.38402 5.632796 5.801281       2.975556 7.905991       4.257250 3.791092       4.160558 24.98070 6.808615 19.23746 6.937175 5.743242       9.720166 
1 1 1 -19 5  8  o 146.1991 3.489468 260.9344       12.43197 262.3996       15.41903 258.2122       21.01621 146.4704 4.324612 145.0475 5.958454 1.422852       7.362434 
1 1 1 -19 5  9  o 48.52005 3.064568 28.84145       3.604974 25.15837       5.503806 31.60883       4.770807 45.06276 5.101610 50.72442 3.889233 -5.661663      6.415026 
1 1 1 -19 5  10 o 202.3833 4.128087 500.4300       20.35915 482.7549       24.70553 537.8337       35.93947 198.5680 5.109869 209.1448 7.061741 -10.57678      8.716590 
1 1 1 -19 5  11 o 117.1764 2.785668 167.5074       7.954370 161.4678       11.58261 172.8983       10.94298 114.8829 4.144070 118.9244 3.780774 -4.041534      5.609596 
1 1 1 -19 5  12 o 143.6552 2.951800 251.8097       10.33343 250.7794       15.08362 252.7209       14.18508 143.1782 4.328042 143.7670 4.052939 -0.5888062     5.929440 
1 1 1 -19 5  13 o 82.53625 2.714190 83.19555       5.451675 78.11067       8.146223 87.32016       7.336813 79.83892 4.201817 84.48986 3.571473 -4.650940      5.514588 
1 1 1 -19 5  14 o 199.4964 3.505942 485.9483       17.04418 484.2964       24.53911 487.4881       23.69145 198.8659 5.067763 199.6173 4.870318 -0.7514038     7.028671 
1 1 1 -19 5  15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -19 5  16 o 78.04084 3.050060 74.44625       5.789345 81.18275       11.08278 71.91820       6.789292 81.20004 5.635854 76.64890 3.645262 4.551132       6.711988 
1 1 1 -19 5  17 o 23.12406 5.469600 6.814556       3.033559 11.67252       5.266690 4.402687       3.710971 30.20459 7.247968 19.57402 6.582883 10.63057       9.791189 
1 1 1 -19 5  18 o 198.5894 3.510237 481.6941       16.98746 488.0514       24.76907 476.0482       23.34217 199.5638 5.097387 197.2038 4.857244 2.360001       7.041035 
1 1 1 -19 5  19 o 212.6384 3.675309 552.4648       19.04459 535.4135       27.07237 569.1697       26.79600 208.9451 5.321224 215.5505 5.101347 -6.605392      7.371511 
1 1 1 -19 5  20 o 85.08802 3.262352 88.55032       6.751963 86.31741       8.648703 92.03516       10.80457 83.89597 4.244112 86.50889 5.148486 -2.612923      6.672286 
1 1 1 -19 5  21 o 61.71331 3.002966 46.61164       4.502562 46.14051       7.029766 46.93936       5.863027 61.19543 4.751155 61.83543 3.910921 -0.6399994     6.153761 
1 1 1 -19 5  22 o 55.23795 3.155710 37.38921       4.230190 31.37340       6.551405 41.69067       5.539813 50.27499 5.433680 58.25385 3.925341 -7.978859      6.703221 
1 1 1 -19 5  23 o 83.54916 2.856507 85.33648       5.807301 73.09542       8.653180 95.36803       7.833402 77.09829 4.626983 88.23960 3.650815 -11.14131      5.893846 
1 1 1 -19 5  24 o 75.65591 3.421129 70.12382       6.291052 67.00816       8.253242 74.44460       9.719211 73.78584 4.613110 77.69304 5.162780 -3.907196      6.923516 
1 1 1 -19 5  25 o 71.19775 4.264123 62.34801       7.364403 42.90415       11.70325 75.09437       9.475633 58.08781 8.520924 78.03105 5.009623 -19.94324      9.884456 
1 1 1 -19 5  26 o 68.56293 2.992774 57.57276       4.988293 70.40086       8.133188 49.83747       6.315652 75.61535 4.433270 63.63182 4.094672 11.98353       6.034917 
1 1 1 -19 5  27 o 44.26539 4.078223 24.23845       4.349756 23.40651       7.989951 24.58887       5.185543 42.62584 7.985284 44.44723 4.867037 -1.821388      9.351621 
1 1 1 -19 5  28 o 102.7682 3.230855 129.4520       8.081134 113.1254       14.27340 137.1543       9.803747 95.29982 6.179413 105.6622 3.813723 -10.36243      7.261517 
1 1 1 -19 5  29 o 103.8885 2.903823 132.2314       7.344251 137.7531       11.20593 128.0739       9.723741 105.6758 4.360839 102.0103 3.918876 3.665489       5.862978 
1 1 1 -19 5  30 o 17.43663 6.494761 2.973106       3.693218 -7.228115      8.705580 5.212033       4.078416 17.73354 8.260770 20.80400 6.899186 -3.070457      10.76286 
1 1 1 -19 5  31 o 18.47688 6.784255 3.536829       4.004356 0.6278949      5.167016 7.911168       6.336204 17.09829 7.222256 25.41112 8.601756 -8.312824      11.23170 
1 1 1 -19 5  32 o 74.92222 3.029461 69.08530       5.519702 81.56690       8.551888 60.17273       7.226501 81.00346 4.348274 69.56164 4.283848 11.44183       6.104002 
1 1 1 -19 5  33 o 26.30733 5.634976 9.034606       3.503668 7.668428       5.469898 9.985109       4.562495 24.45687 7.984001 27.41008 6.850172 -2.953209      10.51994 
1 1 1 -19 5  34 o 32.23596 4.895793 13.32315       3.725147 7.085286       5.629748 18.18139       4.968336 23.68928 8.106535 37.50451 5.608080 -13.81524      9.857306 
1 1 1 -19 5  35 o 64.98346 3.235963 52.42513       5.108272 54.42975       7.689383 50.84153       6.834346 65.47180 4.854017 63.47311 4.446590 1.998695       6.582829 
1 1 1 -19 5  36 o 23.49659 6.783173 7.514972       4.099498 7.576974       5.264895 7.419493       6.533466 23.71889 7.837738 24.01110 8.688525 -0.2922096     11.70131 
1 1 1 -19 5  37 o 13.48293 5.945285 -0.5125818     3.810794 -1.765726      6.494812 0.1453380      4.706007 16.57800 7.500982 15.42800 6.709270 1.149995       10.06375 
1 1 1 -19 5  38 o 21.37103 7.271607 6.257502       4.528635 7.826183       5.547373 3.123361       7.841140 23.47461 8.046600 20.65260 8.816684 2.822008       11.93657 
1 1 1 -19 5  39 o 21.11530 6.522326 6.275566       3.693268 10.42624       5.333790 2.452494       5.118969 26.39617 7.770836 17.51422 7.278444 8.881947       10.64714 
1 1 1 -19 5  40 o 36.50261 4.962942 17.88375       4.300443 26.01367       6.570366 11.79063       5.688087 42.83346 6.498365 27.55781 8.000372 15.27564       10.30702 
1 1 1 -19 5  41 o 17.84589 6.950753 3.937247       4.351240 8.135600       5.632864 -2.274801      6.851840 22.81273 8.089364 15.84866 7.364419 6.964071       10.93949 
1 1 1 -19 5  42 o 24.08025 6.349704 8.713894       3.778612 3.402848       5.370002 13.92239       5.317908 17.73883 7.419608 29.68229 7.382679 -11.94346      10.46683 
1 1 1 -19 5  43 o 14.44536 6.145609 1.533694       3.786775 1.298324       5.701773 1.719441       5.065187 16.15251 7.189308 15.88743 6.934020 0.2650795      9.988332 
1 1 1 -19 5  44 o 12.52349 5.690569 -0.6152003     3.786475 -3.173627      5.996832 1.081071       4.882957 13.84017 6.571875 15.04566 6.677374 -1.205492      9.368930 
1 1 1 -19 6  1  o 174.3978 2.710555 371.0619       11.51954 386.3622       16.49195 356.4850       16.09739 177.8460 3.805326 170.8243 3.866961 7.021759       5.425301 
1 1 1 -19 6  2  o 225.0679 3.453068 618.4726       18.93890 609.7109       29.75731 624.4380       24.55383 223.1241 5.472818 225.9970 4.458415 -2.872910      7.058980 
1 1 1 -19 6  3  o 148.2602 2.763247 268.1716       9.983441 260.3285       15.71977 273.4735       12.92456 145.8629 4.427598 149.6567 3.543918 -3.793747      5.671242 
1 1 1 -19 6  4  o 140.4015 2.684880 240.4739       9.186129 237.2905       14.57671 242.5711       11.83110 139.2733 4.300078 140.9580 3.444284 -1.684753      5.509425 
1 1 1 -19 6  5  o 148.5152 3.094301 269.1711       11.19875 280.8302       16.15559 258.3873       15.53734 151.5159 4.380106 145.3287 4.392258 6.187195       6.203004 
1 1 1 -19 6  6  o 218.3978 3.772138 582.5140       20.07576 593.7078       28.73795 571.8444       28.05711 220.2283 5.354841 216.1405 5.326852 4.087769       7.553123 
1 1 1 -19 6  7  o 156.8954 3.128808 300.4110       11.96259 333.5535       17.95231 273.9418       16.04348 165.1283 4.465414 149.6435 4.404307 15.48477       6.271988 
1 1 1 -19 6  8  o 201.7618 3.186892 496.8205       15.66904 505.0139       25.36718 491.7658       19.92447 203.0891 5.129762 200.6280 4.075297 2.461090       6.551527 
1 1 1 -19 6  9  o 44.54763 3.289900 24.35388       3.546241 22.95615       5.538235 25.32523       4.616848 42.96995 5.408505 45.32943 4.228323 -2.359482      6.865176 
1 1 1 -19 6  10 o 109.2206 2.758440 145.6239       7.335951 147.7715       10.98749 143.8965       9.854018 109.8982 4.109961 108.4854 3.732962 1.412834       5.552187 
1 1 1 -19 6  11 o 101.5653 2.724379 125.9338       6.736844 117.8383       9.968808 132.7388       9.139759 98.11195 4.179084 104.2006 3.604815 -6.088646      5.519007 
1 1 1 -19 6  12 o 140.2511 2.955715 240.0257       10.10195 254.5199       15.22163 228.6171       13.50461 144.2372 4.335521 136.7289 4.057572 7.508240       5.938066 
1 1 1 -19 6  13 o 106.4389 2.758516 138.3129       7.149009 136.5258       10.76426 139.7233       9.562546 105.6123 4.190797 106.8993 3.676286 -1.287056      5.574752 
1 1 1 -19 6  14 o 320.7408 5.787221 1260.809       45.23351 1299.865       56.86788 1193.538       74.63460 325.1620 7.176805 310.1909 9.886211 14.97107       12.21653 
1 1 1 -19 6  15 o 257.2306 5.843151 811.1635       36.62738 0.000000       0.000000 811.1635       36.62738 ?        ?        257.2306 5.843151 0.000000       5.843151 
1 1 1 -19 6  16 o 71.65823 2.843020 62.75846       4.954721 65.96451       7.977103 60.74474       6.322079 73.30547 4.487023 70.42159 3.696934 2.883881       5.813838 
1 1 1 -19 6  17 o 181.5345 3.332909 402.3977       14.74412 410.7236       21.69851 395.2561       20.09621 183.1174 4.866868 179.6856 4.593261 3.431793       6.692118 
1 1 1 -19 6  18 o 133.0851 2.930707 216.1820       9.504691 208.4064       13.97729 222.8703       12.96324 130.4543 4.403028 134.9760 3.945365 -4.521759      5.912069 
1 1 1 -19 6  19 o 90.35269 2.750427 99.72118       6.048829 109.8711       9.546111 92.91203       7.818810 94.69661 4.146773 87.12008 3.691234 7.576530       5.551660 
1 1 1 -19 6  20 o 72.14510 3.448223 63.73404       6.044761 56.23484       7.782012 75.14153       9.597969 67.59843 4.754424 78.14165 5.067682 -10.54322      6.948809 
1 1 1 -19 6  21 o 77.57568 2.842903 73.56508       5.365232 73.86973       8.332398 73.34930       7.012371 77.55750 4.427085 77.37096 3.730201 0.1865463      5.789083 
1 1 1 -19 6  22 o 71.56985 2.884698 62.64397       5.020834 59.28466       7.813381 65.00680       6.552846 69.41190 4.645976 72.82314 3.704706 -3.411247      5.942217 
1 1 1 -19 6  23 o 92.68955 2.828583 105.0100       6.381567 110.2912       10.07469 101.4712       8.247015 94.79082 4.373216 91.00710 3.726533 3.783722       5.745613 
1 1 1 -19 6  24 o 97.19538 3.383820 115.6466       8.002506 108.9852       10.37694 125.4218       12.57039 94.17361 4.535055 100.9259 5.127855 -6.752281      6.845555 
1 1 1 -19 6  25 f 43.40747 3.682677 23.22641       3.858776 29.45148       6.518999 19.86887       4.787616 48.59576 5.607588 39.90395 5.035316 8.691807       7.536541 
1 1 1 -19 6  26 o 58.35719 3.215034 41.78247       4.554436 39.57278       7.304129 43.18814       5.825656 56.43395 5.376066 59.21424 4.061822 -2.780293      6.737988 
1 1 1 -19 6  27 o 115.3581 3.911201 163.4042       10.97908 0.000000       0.000000 163.4042       10.97908 ?        ?        115.3581 3.911201 0.000000       3.911201 
1 1 1 -19 6  28 o 78.02893 2.976455 74.62141       5.649293 76.46442       8.791041 73.32493       7.373269 78.67098 4.605676 77.17866 3.933338 1.492325       6.056682 
1 1 1 -19 6  29 o 107.3861 3.364851 141.5816       8.794553 127.0549       17.14919 146.7652       10.24418 100.4293 7.052068 109.2075 3.855411 -8.778206      8.037155 
1 1 1 -19 6  30 o 82.04624 3.291598 82.75977       6.567789 74.18736       12.41512 86.09112       7.739446 76.58656 6.720191 83.55804 3.810925 -6.971474      7.725549 
1 1 1 -19 6  31 f 141.7099 3.653717 247.4861       12.60691 252.8275       15.97038 238.6538       20.53619 142.7631 4.596523 137.7476 6.133242 5.015503       7.664508 
1 1 1 -19 6  32 o 82.10753 3.022491 82.97556       6.037293 82.51629       9.278436 83.31278       7.950585 81.30428 4.703084 81.96997 3.992237 -0.6656876     6.169032 
1 1 1 -19 6  33 o 16.78965 6.170296 2.960997       3.313581 1.660247       5.377780 3.757065       4.207083 18.08448 7.482843 18.80797 6.945565 -0.7234879     10.20950 
1 1 1 -19 6  34 o 57.64768 3.360598 41.24707       4.700535 38.53416       7.167700 43.29420       6.226370 54.91163 5.427383 58.69495 4.384779 -3.783321      6.977305 
1 1 1 -19 6  35 o 15.92890 6.192373 2.285900       3.448395 0.2481208      5.323457 3.759176       4.526445 16.63291 7.184758 18.90352 7.158386 -2.270609      10.14215 
1 1 1 -19 6  36 o 13.87724 6.084637 -0.4039289     3.939961 -4.379496      5.207109 4.920506       6.026066 13.43365 6.300314 21.21134 8.202350 -7.777698      10.34275 
1 1 1 -19 6  37 o 40.30568 4.894956 21.16268       4.709412 25.13726       8.372493 19.32314       5.695905 41.47076 8.568288 37.63746 6.441669 3.833302       10.71964 
1 1 1 -19 6  38 o 19.61209 6.673060 5.142635       3.813787 -1.570712      5.707088 10.55959       5.126521 15.44432 7.005323 26.87999 7.528341 -11.43567      10.28350 
1 1 1 -19 6  39 o 15.87989 6.650403 1.650714       4.322462 2.624247       5.460306 0.1665187E-01  7.074175 17.95951 7.494594 17.76475 7.950454 0.1947536      10.92605 
1 1 1 -19 6  40 o 13.85874 6.121666 -0.1064145     4.057017 8.269753       7.576159 -3.474040      4.803837 23.48024 9.164129 12.82358 6.025958 10.65666       10.96784 
1 1 1 -19 6  41 o 34.65216 6.032193 17.14889       4.908852 21.70288       6.617629 11.57742       7.319667 37.66744 7.473309 25.85405 9.215844 11.81339       11.86516 
1 1 1 -19 6  42 o 24.92673 6.466146 9.427670       3.960808 17.09825       6.130265 3.930902       5.189420 32.42597 7.844208 18.01497 7.391642 14.41100       10.77812 
1 1 1 -19 6  43 f 29.08753 6.205243 12.74663       4.264285 11.89958       6.364270 13.43672       5.744466 25.51720 8.620859 27.95218 8.017270 -2.434984      11.77267 
1 1 1 -19 6  44 o 11.67814 5.446868 -1.891320      3.803997 -7.150096      5.808904 2.057037       5.033384 12.07886 5.909610 15.86839 6.919200 -3.789533      9.099385 
1 1 1 -19 7  1  o 266.9150 5.144013 872.1914       33.45886 968.0015       63.42142 835.2410       39.38583 279.5386 9.323223 260.9223 6.194307 18.61636       11.19339 
1 1 1 -19 7  2  o 35.05630 4.228729 15.23695       3.539643 11.36223       4.706770 20.28095       5.370204 29.84322 6.642968 40.30537 5.620167 -10.46216      8.701453 
1 1 1 -19 7  3  o 296.5674 4.733280 1075.793       34.20753 1138.022       50.05407 1021.258       46.85749 304.4200 6.747300 288.4068 6.667109 16.01328       9.485589 
1 1 1 -19 7  4  o 65.70928 2.986263 52.79697       4.769296 51.44512       6.760951 54.13599       6.728769 64.73424 4.310413 66.42752 4.177886 -1.693283      6.002865 
1 1 1 -19 7  5  o 292.6424 4.162012 1046.513       29.68087 1059.865       47.56041 1037.997       37.98563 293.8434 6.641919 291.1724 5.353442 2.671021       8.530793 
1 1 1 -19 7  6  o 111.1806 2.524354 150.7740       6.839359 156.9869       11.36578 147.2472       8.563279 113.2733 4.124405 109.7905 3.204086 3.482849       5.222728 
1 1 1 -19 7  7  o 235.9663 3.978734 680.2190       22.87868 647.9579       31.70980 715.2476       33.04199 229.9941 5.657711 241.6520 5.610993 -11.65791      7.968245 
1 1 1 -19 7  8  o 57.55322 3.013128 40.53064       4.211220 39.46631       6.374505 41.35490       5.609669 56.62117 4.661129 58.04594 3.990058 -1.424770      6.135689 
1 1 1 -19 7  9  o 75.75208 2.498811 70.06783       4.606482 67.68526       7.850832 71.31875       5.688647 74.28819 4.355816 76.38570 3.062259 -2.097504      5.324525 
1 1 1 -19 7  10 o 65.69617 2.865753 52.76033       4.576872 49.94817       7.248658 54.62481       5.902218 63.73661 4.700004 66.78346 3.640454 -3.046852      5.944993 
1 1 1 -19 7  11 o 136.7668 2.939982 228.2475       9.798545 238.8514       14.76505 219.9022       13.09860 139.7198 4.341785 134.0988 4.012850 5.621017       5.912196 
1 1 1 -19 7  12 o 146.2713 3.014861 261.0987       10.74639 267.4307       16.07921 255.9870       14.44689 147.8293 4.468555 144.6786 4.101779 3.150650       6.065689 
1 1 1 -19 7  13 o 172.7875 4.540134 365.3367       19.10032 386.3702       28.23755 347.5961       25.93318 177.2901 6.547159 168.1936 6.338524 9.096558       9.112748 
1 1 1 -19 7  14 o 108.5003 3.090440 143.8010       8.162905 144.7617       14.97016 143.3945       9.737974 108.5398 5.679564 108.2882 3.695628 0.2515793      6.776070 
1 1 1 -19 7  15 o 69.87410 3.160603 59.72074       5.367802 95.85970       13.10356 52.43343       5.884165 88.18188 6.136088 65.41210 3.706564 22.76978       7.168695 
1 1 1 -19 7  16 o 116.5947 2.832529 165.8943       8.048024 168.4087       12.35794 164.0424       10.60528 117.2755 4.331614 115.8136 3.762733 1.461884       5.737686 
1 1 1 -19 7  17 o 36.66322 3.906078 16.61245       3.436183 16.24229       5.982118 16.79472       4.197796 35.71469 7.123326 36.73447 4.804364 -1.019779      8.592071 
1 1 1 -19 7  18 o 183.8759 3.370612 412.9380       15.10323 414.9268       22.21803 411.2296       20.59282 183.9989 4.959642 183.2483 4.615147 0.7506561      6.774779 
1 1 1 -19 7  19 o 101.7152 2.791312 126.3714       6.912253 122.2205       10.51753 129.5276       9.171030 99.85479 4.332549 102.8878 3.663634 -3.032967      5.673905 
1 1 1 -19 7  20 o 194.9692 4.092130 464.9718       19.44247 463.0331       24.26001 468.4525       32.50700 194.2810 5.128666 194.8995 6.854990 -0.6184998     8.561197 
1 1 1 -19 7  21 o 65.70789 2.969882 52.82708       4.743171 58.99738       7.700747 49.05527       6.020813 69.25705 4.588688 63.21150 3.928025 6.045551       6.040318 
1 1 1 -19 7  22 f 50.26463 3.735369 31.06535       4.542727 34.47034       9.938004 30.16597       5.107562 52.16477 8.078793 49.45654 4.280015 2.708233       9.142507 
1 1 1 -19 7  23 o 75.11801 3.447876 69.13400       6.294657 64.60628       8.248570 75.44732       9.740197 72.43658 4.698226 78.22643 5.137939 -5.789856      6.962165 
1 1 1 -19 7  24 o 51.21325 4.071833 32.32501       5.039886 33.70105       6.995069 30.83961       7.267698 52.04148 5.603996 49.65042 6.137249 2.391064       8.310872 
1 1 1 -19 7  25 o 82.30456 2.910925 82.88722       5.829169 79.49490       9.081479 85.26419       7.601846 80.33419 4.658944 83.36291 3.751668 -3.028717      5.981703 
1 1 1 -19 7  26 o 15.22916 5.934582 1.776372       3.173255 -2.071759      5.607026 3.589680       3.848960 15.97127 7.117680 18.52043 6.673161 -2.549165      9.756660 
1 1 1 -19 7  27 f 105.5354 3.222599 136.4749       8.278116 131.9500       15.26935 138.3584       9.851516 103.0195 6.109700 106.1425 3.814911 -3.123039      7.202914 
1 1 1 -19 7  28 f 70.61970 3.007555 61.16640       5.163925 53.56010       8.018895 66.55560       6.749777 65.67166 5.049465 73.53439 3.779394 -7.862732      6.307211 
1 1 1 -19 7  29 o 63.22339 3.526502 49.22760       5.411699 55.70090       12.15293 47.62652       6.044015 66.01582 7.698678 62.08493 4.016428 3.930897       8.683394 
1 1 1 -19 7  30 o 55.79495 3.251663 38.34563       4.402003 43.24736       7.177199 35.38982       5.573387 58.83462 5.054894 53.36891 4.322394 5.465714       6.650943 
1 1 1 -19 7  31 o 33.27835 6.440909 14.40049       5.034480 18.24112       7.658834 11.47827       6.680646 36.84724 8.674307 29.43216 8.705219 7.415081       12.28920 
1 1 1 -19 7  32 o 71.20071 3.120629 62.49184       5.401401 70.62964       8.547237 57.08115       6.969445 75.17092 4.689302 67.70713 4.245405 7.463791       6.325584 
1 1 1 -19 7  33 o 131.4995 3.094404 213.1263       9.916013 212.3853       14.75205 213.7372       13.39298 130.2594 4.654854 130.9966 4.200905 -0.7372284     6.270189 
1 1 1 -19 7  34 o 28.55828 5.627927 10.70499       3.777328 6.459623       5.804697 13.82312       4.974727 23.00093 8.206021 32.20118 6.562532 -9.200251      10.50741 
1 1 1 -19 7  35 o 75.29045 3.156414 70.37157       5.778373 77.20009       8.989866 65.56425       7.542945 77.96662 4.754204 72.09192 4.313290 5.874702       6.419262 
1 1 1 -19 7  36 o 69.75792 3.903582 61.32036       6.609325 70.70601       8.689813 48.43946       10.18009 74.28449 4.826518 59.71381 7.137011 14.57069       8.615811 
1 1 1 -19 7  37 o 33.26170 5.706166 14.86879       4.458687 13.18958       7.844568 15.67015       5.419137 29.33468 9.560266 33.50726 6.867670 -4.172577      11.77130 
1 1 1 -19 7  38 o 18.89603 6.589212 4.678747       3.726316 4.405082       5.573565 4.899942       5.010849 19.78925 7.818875 19.90524 7.533056 -0.1159916     10.85734 
1 1 1 -19 7  39 o 44.43980 4.289462 25.70127       4.587607 21.46054       6.524601 29.84779       6.451725 38.44439 7.229722 46.76214 5.784925 -8.317753      9.259278 
1 1 1 -19 7  40 o 18.28594 7.609753 3.227198       5.606780 11.64247       8.241978 -4.021686      7.649498 26.21038 9.713798 16.07816 7.570506 10.13222       12.31545 
1 1 1 -19 7  41 o 28.57708 6.949625 12.40698       4.792360 25.19080       6.544163 -2.377096      7.037541 41.33393 6.728174 15.87963 7.407211 25.45429       10.00675 
1 1 1 -19 7  42 o 58.80910 3.747365 45.25566       5.342463 48.09023       8.228174 43.18973       7.024548 57.77961 5.927726 55.67241 5.239361 2.107204       7.911311 
1 1 1 -19 7  43 o 45.68192 4.313666 28.22358       4.745189 23.67541       7.223604 31.67596       6.293542 37.41089 8.154282 46.87328 5.621806 -9.462391      9.904393 
1 1 1 -19 7  44 o 28.19308 6.251419 12.25009       4.182268 15.94585       6.674553 9.861026       5.366409 29.08105 8.725680 23.51387 7.916199 5.567181       11.78150 
1 1 1 -19 8  1  o 274.2363 4.485382 919.7405       29.97508 944.0433       43.09760 896.9683       41.71837 277.3123 6.377461 270.3238 6.332963 6.988525       8.987682 
1 1 1 -19 8  2  o 108.0907 3.010125 142.7016       7.921105 141.0726       18.72187 143.0567       8.742112 106.8596 7.232123 108.1971 3.319546 -1.337524      7.957574 
1 1 1 -19 8  3  o 92.04725 2.569144 103.4365       5.757187 106.3332       9.428762 101.7145       7.269723 93.18272 4.162756 91.22139 3.275599 1.961334       5.296988 
1 1 1 -19 8  4  o 309.9079 4.372308 1174.147       33.02019 1217.448       53.66051 1147.758       41.89043 314.7527 6.995991 306.0739 5.616328 8.678772       8.971457 
1 1 1 -19 8  5  f 117.6601 2.867527 168.9205       8.221908 166.1428       12.03317 171.3529       11.26033 116.5134 4.245168 118.3679 3.909103 -1.854546      5.770834 
1 1 1 -19 8  6  o 50.39380 2.899225 31.08961       3.545342 40.49332       6.376037 26.88089       4.265563 57.36224 4.599823 46.76152 3.775346 10.60072       5.950766 
1 1 1 -19 8  7  o 201.3320 3.207120 494.7619       15.73490 523.8787       26.11401 478.1650       19.71585 206.8140 5.185614 197.8174 4.089921 8.996643       6.604396 
1 1 1 -19 8  8  o 51.58629 3.276339 32.61446       4.097409 32.97579       6.301207 32.34974       5.393359 51.66443 5.070132 51.26015 4.358912 0.4042740      6.686281 
1 1 1 -19 8  9  o 149.7876 3.066031 273.8163       11.19150 267.5025       16.36964 279.3574       15.33530 147.8381 4.549186 151.1353 4.167782 -3.297195      6.169724 
1 1 1 -19 8  10 o 293.8018 4.174315 1054.924       29.88655 1089.499       48.64936 1033.967       37.87650 297.8727 6.702092 290.5888 5.348781 7.283905       8.574818 
1 1 1 -19 8  11 o 188.6666 3.434321 434.6020       15.78964 428.4102       22.89785 440.2155       21.80225 187.0310 5.028508 189.7082 4.716057 -2.677200      6.893989 
1 1 1 -19 8  12 o 186.0955 4.739950 423.9169       21.47791 423.0463       30.91091 424.7296       29.86479 185.4404 6.852024 185.8725 6.603875 -0.4321594     9.516375 
1 1 1 -19 8  13 o 15.20008 5.881466 1.804301       3.099762 14.71352       7.088098 -1.248384      3.446837 33.87709 8.578535 12.63916 5.609707 21.23793       10.24988 
1 1 1 -19 8  14 o 117.3688 2.850068 168.1003       8.151623 154.8370       12.18639 178.8405       10.96618 112.4335 4.456612 120.9386 3.725398 -8.505135      5.808612 
1 1 1 -19 8  15 o 47.45908 3.564148 27.66445       4.091916 33.80479       9.970846 26.42087       4.487188 51.73589 8.180342 46.32269 4.014665 5.413200       9.112383 
1 1 1 -19 8  16 o 112.2544 3.200085 153.9729       8.744952 153.5883       17.25859 154.1057       10.14353 111.6477 6.369795 112.2478 3.713412 -0.6001587     7.373176 
1 1 1 -19 8  17 o 197.3981 3.528255 476.0029       16.97223 475.1829       24.88655 476.7159       23.20618 196.8661 5.192025 197.3251 4.825975 -0.4589996     7.088523 
1 1 1 -19 8  18 o 51.58720 3.302221 32.63457       4.129502 21.06273       6.858891 39.21415       5.171921 40.77179 7.164671 56.51843 3.776811 -15.74664      8.099186 
1 1 1 -19 8  19 o 121.0156 2.867482 178.7754       8.456256 191.7570       13.22770 169.8032       10.99685 125.1053 4.345427 117.7905 3.836203 7.314819       5.796481 
1 1 1 -19 8  20 o 138.7602 3.528845 235.4560       11.92287 242.3131       15.37248 225.1036       18.88842 140.6107 4.492076 135.2681 5.743195 5.342621       7.291299 
1 1 1 -19 8  21 o 162.3671 4.561012 323.1680       18.02871 328.5390       26.98041 318.8350       24.23318 163.1133 6.802638 160.8654 6.193323 2.247955       9.199627 
1 1 1 -19 8  22 o 127.8523 2.952756 199.6513       9.199667 192.4228       13.69632 205.5934       12.41800 125.2384 4.495057 129.5604 3.937746 -4.321953      5.975900 
1 1 1 -19 8  23 o 138.7044 3.571609 235.4782       12.06227 242.9362       15.66578 224.6182       18.90418 140.6830 4.575647 134.9770 5.760522 5.705994       7.356641 
1 1 1 -19 8  24 o 226.6402 3.887345 629.0217       21.46971 643.4072       31.62197 616.7193       29.24291 228.5682 5.677237 223.9073 5.359399 4.660843       7.807316 
1 1 1 -19 8  25 o 89.52512 2.878318 98.05689       6.271264 94.92349       9.882364 100.1695       8.114488 87.79401 4.635554 90.36675 3.692599 -2.572739      5.926520 
1 1 1 -19 8  26 o 117.9670 2.938371 170.1794       8.447018 169.5855       12.89672 170.6255       11.17846 117.3865 4.516857 117.8964 3.896209 -0.5099182     5.965102 
1 1 1 -19 8  27 f 45.71136 3.981545 25.84426       4.390977 14.36463       8.697751 29.77072       5.086784 33.27291 9.955490 49.02818 4.301093 -15.75527      10.84487 
1 1 1 -19 8  28 o 56.64837 3.660720 39.55714       5.026418 57.03078       12.10060 35.91343       5.525690 66.96333 7.546661 53.85493 4.244706 13.10839       8.658500 
1 1 1 -19 8  29 o 36.71230 4.768476 16.93231       4.165363 34.03659       10.53400 13.76227       4.534961 50.95334 8.801860 32.76871 5.895845 18.18463       10.59404 
1 1 1 -19 8  30 o 32.54447 4.551462 13.34988       3.511069 16.52088       5.815954 11.53151       4.404171 35.61370 6.951017 29.79572 6.264708 5.817982       9.357521 
1 1 1 -19 8  31 o 130.6449 3.628435 210.6074       11.54056 218.0591       14.91914 199.5057       18.21006 132.4185 4.630501 125.8220 5.955980 6.596481       7.544219 
1 1 1 -19 8  32 o 84.29140 3.064078 87.55391       6.283418 84.07877       9.970122 89.84361       8.092884 81.82787 5.024144 85.08862 3.913454 -3.260750      6.368449 
1 1 1 -19 8  33 o 10.42272 4.916802 -3.452145      3.254003 -4.074724      5.643469 -3.142073      3.982724 14.51048 6.722205 12.13067 5.629198 2.379808       8.767891 
1 1 1 -19 8  34 o 24.52384 6.184381 8.039907       3.694651 11.91514       6.007094 5.682016       4.685732 29.32866 8.125353 21.37440 7.392584 7.954260       10.98507 
1 1 1 -19 8  35 o 29.46000 6.487755 11.75588       4.531435 15.46814       6.011560 6.871074       6.895913 33.38321 7.565198 23.72717 8.867426 9.656046       11.65605 
1 1 1 -19 8  36 o 46.37835 4.131280 27.36832       4.620309 24.87834       6.815125 29.48613       6.285205 42.74100 6.768452 47.37704 5.548981 -4.636040      8.752321 
1 1 1 -19 8  37 o 80.95633 3.615749 82.71067       7.115213 75.64587       12.50112 86.09599       8.653634 74.00209 7.015960 81.97523 4.347459 -7.973145      8.253733 
1 1 1 -19 8  38 o 12.48493 5.603982 -0.9632865     3.542961 -0.4722557     5.488019 -1.314179      4.639255 15.77591 7.035454 14.03755 6.346694 1.738352       9.475133 
1 1 1 -19 8  39 o 11.90767 5.486797 -1.991767      3.686732 3.508394       5.452182 -6.625260      5.004227 18.59580 7.597019 11.73769 5.683658 6.858109       9.487817 
1 1 1 -19 8  40 o 52.23048 4.583890 36.17862       5.775263 29.70446       10.64496 38.87913       6.875042 40.38890 10.66113 53.38653 5.356851 -12.99763      11.93128 
1 1 1 -19 8  41 o 43.41439 5.347370 26.14823       5.537909 20.90096       6.830724 36.21213       9.459832 36.19175 7.961713 47.15982 8.546016 -10.96807      11.68004 
1 1 1 -19 8  42 o 16.24709 6.816281 2.593924       4.553135 1.845435       6.101322 3.534624       6.840014 16.94111 7.494085 18.52269 8.071419 -1.581581      11.01404 
1 1 1 -19 8  43 o 21.96832 6.864019 7.758432       4.077356 2.257010       6.127641 12.12968       5.462083 16.96183 7.506404 26.48990 7.880520 -9.528070      10.88341 
1 1 1 -19 9  1  o 258.2047 3.833845 814.6083       24.12319 840.5907       39.07898 798.6124       30.66249 261.7229 6.127246 255.4250 4.926153 6.297913       7.861942 
1 1 1 -19 9  2  o 218.6742 3.878296 584.2769       20.66687 585.4354       44.00911 583.9490       23.40855 217.6464 8.312929 218.5258 4.395776 -0.8794250     9.403597 
1 1 1 -19 9  3  o 210.0946 3.767287 539.2175       19.28767 584.2888       42.90623 527.8030       21.59233 217.5313 8.108179 207.7832 4.264351 9.748001       9.161182 
1 1 1 -19 9  4  f 147.7843 2.803601 266.4886       10.09672 263.6948       16.28069 268.2347       12.87074 146.7668 4.557592 148.2029 3.563778 -1.436111      5.785513 
1 1 1 -19 9  5  o 239.9224 3.618052 703.0110       21.15347 745.9928       35.02310 678.3263       26.54155 246.6900 5.825951 235.4985 4.624897 11.19154       7.438506 
1 1 1 -19 9  6  o 127.8164 2.646518 199.3050       8.243231 204.8658       13.71657 196.1613       10.31342 129.3775 4.356833 126.7137 3.342891 2.663742       5.491531 
1 1 1 -19 9  7  o 165.8427 2.914091 335.6217       11.77702 365.2908       19.99055 319.8507       14.57483 172.7383 4.753493 161.8255 3.695901 10.91284       6.021245 
1 1 1 -19 9  8  o 270.1772 4.414992 892.4767       29.06797 886.6708       41.23705 898.2108       40.98079 268.8208 6.294897 270.5882 6.214917 -1.767426      8.845955 
1 1 1 -19 9  9  o 43.06237 3.152397 22.75482       3.285152 18.80844       6.145715 24.33355       3.887105 38.57881 6.784715 44.49165 3.616341 -5.912846      7.688321 
1 1 1 -19 9  10 o 134.5675 3.508266 221.2749       11.49471 229.4630       15.05548 209.8313       17.79865 136.9084 4.518810 130.7466 5.599219 6.161758       7.195199 
1 1 1 -19 9  11 o 292.1319 5.307071 1045.118       37.78070 1088.904       67.74930 1025.356       45.51490 296.4554 9.389824 289.0043 6.462689 7.451111       11.39891 
1 1 1 -19 9  12 o 237.5994 4.536911 690.4653       26.26889 692.9946       46.45392 689.2763       31.85034 236.9395 8.057142 237.1817 5.510573 -0.2421570     9.761350 
1 1 1 -19 9  13 o 199.3153 3.551197 485.1989       17.24851 490.8501       25.44960 480.3976       23.45808 200.1296 5.222819 198.1217 4.858747 2.007858       7.133390 
1 1 1 -19 9  14 o 120.1348 2.875537 176.1311       8.418287 180.0982       13.07533 173.3224       11.00187 121.2674 4.432040 119.0425 3.797380 2.224884       5.836359 
1 1 1 -19 9  15 o 267.3900 4.330386 874.4114       28.21681 900.2200       41.49765 852.2175       38.48196 270.7489 6.289566 263.5266 5.992344 7.222382       8.687164 
1 1 1 -19 9  16 o 136.1034 3.376202 226.2389       11.19782 220.4057       21.52298 228.4039       13.11220 133.7303 6.625071 136.6385 3.942039 -2.908127      7.709166 
1 1 1 -19 9  17 o 71.21510 2.870441 62.00441       4.971254 66.62494       8.430654 59.54146       6.155220 73.61978 4.724205 69.71142 3.635860 3.908363       5.961341 
1 1 1 -19 9  18 o 163.4341 3.204410 326.2167       12.76224 325.8237       19.07945 326.5350       17.16850 163.0282 4.807748 163.3022 4.318027 -0.2740021     6.462183 
1 1 1 -19 9  19 o 86.22027 2.822653 90.84614       5.922667 104.6371       10.04574 83.49852       7.332597 92.34404 4.477478 82.57156 3.653151 9.772476       5.778695 
1 1 1 -19 9  20 o 164.7607 3.682458 331.8778       14.78521 334.6957       27.41896 330.7225       17.55636 164.6412 6.848979 164.2997 4.388851 0.3414612      8.134527 
1 1 1 -19 9  21 o 156.6735 3.734892 300.2054       14.25968 284.2956       17.74066 329.2476       23.96908 152.2091 4.788878 163.4816 6.026850 -11.27248      7.697810 
1 1 1 -19 9  22 o 110.1573 3.422358 148.5039       9.175879 150.2312       12.01887 146.0903       14.20723 110.6271 4.467455 108.9094 5.369687 1.717743       6.985105 
1 1 1 -19 9  23 o 79.81451 2.950912 77.94091       5.729620 73.14214       9.184251 80.99858       7.331175 77.02774 4.918531 81.27096 3.711504 -4.243217      6.161754 
1 1 1 -19 9  24 o 88.85999 2.905926 96.59902       6.284090 97.46743       10.08579 96.04797       8.034162 88.97735 4.667841 88.48984 3.734121 0.4875107      5.977658 
1 1 1 -19 9  25 o 242.7951 4.084128 723.0234       24.16436 736.5207       35.50138 711.3723       32.98440 244.1413 5.967163 240.1172 5.637016 4.024155       8.208714 
1 1 1 -19 9  26 o 155.0623 3.180192 294.3041       12.01698 306.3016       18.30346 285.2146       15.93152 157.6748 4.769078 152.3046 4.296772 5.370193       6.419218 
1 1 1 -19 9  27 o 46.09583 3.874380 26.27143       4.311871 21.44247       8.547543 27.91975       4.993847 40.38956 8.922596 47.43905 4.368832 -7.049492      9.934757 
1 1 1 -19 9  28 o 100.3369 3.362313 123.6410       8.209580 130.6920       17.12687 121.5377       9.354264 101.8784 6.940015 99.35145 3.871072 2.526985       7.946635 
1 1 1 -19 9  29 o 18.27406 6.173092 3.923670       3.263268 0.6551874      5.431669 5.769728       4.082094 17.54519 7.407653 21.56475 6.885002 -4.019562      10.11319 
1 1 1 -19 9  30 o 62.42236 3.185238 47.99378       4.829253 40.50304       7.514621 53.26400       6.303174 56.70773 5.507134 65.58086 3.962572 -8.873123      6.784578 
1 1 1 -19 9  31 o 35.14550 5.328575 15.78056       4.420758 18.27896       6.084836 12.98762       6.433517 37.34621 6.941438 31.07030 8.328088 6.275915       10.84161 
1 1 1 -19 9  32 o 66.59142 3.203153 54.78722       5.182707 50.60038       8.190556 57.58302       6.693039 63.20326 5.368625 67.99319 4.057907 -4.789925      6.729691 
1 1 1 -19 9  33 o 73.08641 3.188156 66.09856       5.664562 63.11180       8.735357 68.26588       7.441175 70.56802 5.114389 73.88806 4.149345 -3.320038      6.585897 
1 1 1 -19 9  34 o 48.46355 4.311064 29.68951       5.038301 30.25578       9.346315 29.45755       5.981869 46.64534 8.536846 47.88214 5.210512 -1.236805      10.00136 
1 1 1 -19 9  35 o 38.77166 5.517881 19.69858       5.066428 18.58399       6.576123 21.32629       7.946999 36.53550 7.632631 38.55220 8.669885 -2.016701      11.55093 
1 1 1 -19 9  36 o 18.58140 6.609098 4.263907       3.762549 0.8375672      5.800444 6.752874       4.943740 17.37388 7.502261 22.34724 7.597664 -4.973358      10.67747 
1 1 1 -19 9  37 o 68.87605 3.777010 60.21501       6.315197 79.11800       12.06952 53.08888       7.410566 76.01832 6.580044 63.88306 4.795245 12.13525       8.141950 
1 1 1 -19 9  38 o 42.75919 4.375267 23.79136       4.494799 23.73842       6.713792 23.83435       6.050966 40.82261 7.000759 41.56995 6.159307 -0.7473412     9.324574 
1 1 1 -19 9  39 o 45.92751 4.775445 27.98642       5.266747 29.90840       9.865514 27.22031       6.228587 42.47273 9.739750 44.37109 5.907019 -1.898361      11.39103 
1 1 1 -19 9  40 o 39.91327 4.873648 21.50177       4.642120 17.54962       6.910340 24.75195       6.266659 32.75936 8.562281 41.49102 6.403790 -8.731663      10.69211 
1 1 1 -19 9  41 o 15.10151 6.337650 1.827300       3.938058 1.530833       5.634285 2.110464       5.506426 16.56313 7.268862 16.86600 7.296345 -0.3028660     10.29918 
1 1 1 -19 9  42 o 19.55157 6.900205 5.860021       4.094513 4.522379       6.280401 6.848875       5.399872 18.84480 7.961336 20.67209 7.820746 -1.827295      11.16006 
1 1 1 -19 9  43 o 15.50860 6.626391 2.147515       4.436012 2.275702       5.854331 1.974683       6.797795 16.71718 7.370274 17.16334 7.728245 -0.4461594     10.67927 
1 1 1 -19 10 1  o 80.97417 2.705035 80.09644       5.330224 84.87127       8.890752 77.41725       6.659812 83.18451 4.401578 79.54271 3.443942 3.641800       5.588794 
1 1 1 -19 10 2  o 78.27541 2.701699 74.84898       5.145728 80.01817       8.614297 71.98119       6.416259 80.76939 4.393139 76.69635 3.441747 4.073036       5.580797 
1 1 1 -19 10 3  o 162.5912 3.334195 322.7863       13.21065 334.7376       30.04037 319.9208       14.70932 164.7055 7.504186 161.8251 3.730017 2.880432       8.380086 
1 1 1 -19 10 4  o 59.42330 2.864023 43.19039       4.135127 41.22907       7.097061 44.19845       5.088004 57.80991 5.089706 60.05920 3.491470 -2.249290      6.172153 
1 1 1 -19 10 5  o 257.4001 3.813381 809.4498       23.91966 843.4185       39.19304 789.2877       30.19520 262.1877 6.134237 253.9572 4.879117 8.230515       7.838026 
1 1 1 -19 10 6  o 26.95164 4.759243 9.148493       3.011527 10.88902       5.532588 8.415660       3.589962 29.21032 7.674284 25.69388 5.863348 3.516443       9.657820 
1 1 1 -19 10 7  o 73.54102 2.627015 66.06395       4.700349 80.09516       8.580462 60.04824       5.618318 80.81929 4.373007 70.05465 3.300319 10.76464       5.478622 
1 1 1 -19 10 8  o 151.6033 3.215208 280.5721       11.87829 294.4150       17.63408 269.0740       16.07134 155.0661 4.671919 148.2699 4.453029 6.796265       6.454169 
1 1 1 -19 10 9  o 111.9669 3.244917 153.1757       8.844451 152.3916       15.53776 153.5516       10.75728 111.3510 5.745516 112.0300 3.946486 -0.6790085     6.970345 
1 1 1 -19 10 10 o 123.2198 3.218559 185.4813       9.656199 195.6252       17.88672 181.3089       11.47145 126.1775 5.832964 121.7539 3.871253 4.423599       7.000719 
1 1 1 -19 10 11 o 245.5108 4.089709 736.7494       24.46804 739.8320       35.63717 734.0004       33.65398 245.5904 5.954644 244.7035 5.643651 0.8868713      8.204181 
1 1 1 -19 10 12 o 143.5635 2.737507 251.4893       9.577127 270.7730       16.59886 241.8662       11.72573 148.7029 4.586084 140.7333 3.419062 7.969589       5.720328 
1 1 1 -19 10 13 o 22.37317 5.684741 6.373722       3.105168 -3.691799      5.881557 10.26350       3.656256 15.51676 7.066868 28.46844 5.469026 -12.95169      8.935932 
1 1 1 -19 10 14 o 122.6099 2.899628 183.4823       8.663713 189.0425       13.60265 179.6872       11.23793 124.2251 4.500869 121.2015 3.809622 3.023659       5.896697 
1 1 1 -19 10 15 o 138.2440 3.022378 233.3060       10.18196 227.8827       15.46493 237.4557       13.52766 136.3708 4.660465 139.3133 3.988791 -2.942551      6.134361 
1 1 1 -19 10 16 o 110.6282 3.240379 149.5876       8.726290 133.3752       17.39328 155.0411       10.08774 103.8656 6.911166 112.5778 3.682049 -8.712280      7.830818 
1 1 1 -19 10 17 o 56.19769 3.149615 38.68783       4.296064 37.81392       7.500602 39.11449       5.240884 55.22608 5.653022 56.43548 3.833556 -1.209400      6.830286 
1 1 1 -19 10 18 o 51.45347 3.304727 32.47323       4.121772 29.39931       7.159098 33.99737       5.041100 48.51950 6.196077 52.57765 3.963675 -4.058151      7.355412 
1 1 1 -19 10 19 o 159.3814 3.211656 310.3023       12.47391 300.4874       18.64993 318.2472       16.77950 156.5026 4.896142 161.1951 4.275379 -4.692505      6.500083 
1 1 1 -19 10 20 o 117.1058 2.923974 167.4700       8.344259 171.8290       13.03240 164.4416       10.86280 118.3498 4.527124 115.8834 3.852019 2.466362       5.944149 
1 1 1 -19 10 21 o 116.0399 3.497428 164.7909       9.878623 158.0416       12.58308 175.6334       15.94858 113.4610 4.560262 119.4210 5.495043 -5.959923      7.140832 
1 1 1 -19 10 22 o 78.24599 2.918123 74.89941       5.554440 70.15929       8.923053 77.89806       7.097108 75.44891 4.879323 79.70821 3.663576 -4.259300      6.101605 
1 1 1 -19 10 23 o 142.3922 3.069561 247.8398       10.65120 248.7222       16.22452 247.1716       14.11996 142.2673 4.686231 141.9671 4.085652 0.3002167      6.217179 
1 1 1 -19 10 24 o 85.56763 2.936015 89.60851       6.113080 90.83386       9.756545 88.81657       7.843601 85.86113 4.680680 85.06240 3.793461 0.7987289      6.024874 
1 1 1 -19 10 25 o 145.3204 3.103931 258.3716       10.99195 259.6529       16.65796 257.3834       14.62889 145.2177 4.713479 144.7502 4.151501 0.4675751      6.281071 
1 1 1 -19 10 26 o 151.0925 3.155788 279.5058       11.61948 284.6576       17.66632 275.5779       15.42553 151.9338 4.777447 149.6808 4.233255 2.253006       6.383138 
1 1 1 -19 10 27 o 15.47779 6.322035 1.166305       3.774843 0.000000       0.000000 1.166305       3.774843 ?        ?        15.47779 6.322035 0.000000       6.322035 
1 1 1 -19 10 28 o 26.18411 5.646866 8.840948       3.497067 2.163558       6.406303 11.67529       4.173789 20.09577 8.225332 30.12559 5.896554 -10.02981      10.12055 
1 1 1 -19 10 29 o 51.19390 3.456089 32.36263       4.286337 39.50390       7.320199 28.63657       5.287618 56.07834 5.424268 47.89324 4.586514 8.185097       7.103436 
1 1 1 -19 10 30 o 60.88588 3.287170 45.73016       4.859163 40.73786       7.852542 48.82799       6.185702 56.72890 5.760054 62.71923 4.069142 -5.990334      7.052385 
1 1 1 -19 10 31 o 71.97921 3.695849 64.18434       6.461017 55.41397       8.438464 76.61071       10.04445 66.29909 5.266235 77.99192 5.316739 -11.69283      7.483378 
1 1 1 -19 10 32 o 17.31965 6.203953 3.353319       3.321226 8.732624       5.848086 0.7923461      4.035089 25.74696 8.242973 15.31981 6.421339 10.42716       10.44893 
1 1 1 -19 10 33 f 47.50131 3.925766 28.28638       4.503751 23.43642       7.041878 31.64342       5.858647 41.86190 7.160087 49.89045 4.881240 -8.028542      8.665642 
1 1 1 -19 10 34 o 9.164803 4.469603 -5.653050      3.246659 -1.263349      5.321967 -8.255094      4.097434 15.51823 6.923862 9.809629 4.832077 5.708600       8.443272 
1 1 1 -19 10 35 o 33.86876 7.141821 15.88576       5.708554 8.940238       8.014456 23.03841       8.133080 25.83576 9.578074 39.99170 8.601044 -14.15594      12.87313 
1 1 1 -19 10 36 o 76.60744 3.326497 73.57384       6.195235 69.53972       9.401730 76.66981       8.236265 72.89478 5.329503 77.41410 4.383819 -4.519318      6.900832 
1 1 1 -19 10 37 o 72.38588 3.795407 66.63036       6.671574 66.01112       12.15703 66.89722       7.980687 68.19543 7.435674 71.85162 4.581801 -3.656181      8.733965 
1 1 1 -19 10 38 f 29.15418 5.979710 11.85300       4.105659 9.738290       6.281378 13.43033       5.424886 25.21181 8.564166 30.10684 7.438103 -4.895033      11.34329 
1 1 1 -19 10 39 o 46.94108 4.853104 29.39116       5.471516 37.05468       10.54443 26.56736       6.400673 47.68120 9.409118 43.45780 6.221220 4.223400       11.27985 
1 1 1 -19 10 40 o 15.75444 6.785279 1.432801       4.720771 4.520065       5.908128 -4.018874      7.851055 19.27994 7.896103 16.02594 7.583221 3.253998       10.94777 
1 1 1 -19 10 41 o 13.93810 6.055673 0.7764827      3.826311 -7.107876      5.885752 6.547682       5.035607 12.45892 6.063107 20.57808 7.598850 -8.119154      9.721306 
1 1 1 -19 10 42 o 18.99980 6.723052 5.481275       3.889009 9.297740       5.844360 2.448425       5.209929 23.06189 8.233320 16.54531 7.127049 6.516581       10.88955 
1 1 1 -19 10 43 o 45.02446 4.423732 27.73897       4.791106 25.99123       7.287246 29.06964       6.358590 39.31962 7.880056 44.09313 6.079325 -4.773514      9.952561 
1 1 1 -19 11 1  o 167.1554 3.006997 341.0866       12.24869 354.0075       20.12145 333.4799       15.43878 169.9656 4.863052 165.1837 3.835392 4.781906       6.193505 
1 1 1 -19 11 2  o 65.42632 2.834389 52.33966       4.508338 52.24792       7.693340 52.38763       5.563739 65.14558 4.881618 65.39610 3.504027 -0.2505188     6.009027 
1 1 1 -19 11 3  o 55.71705 3.470804 38.06231       4.689129 34.31760       14.33865 38.51075       4.961963 51.39250 11.71099 56.02678 3.654249 -4.634277      12.26788 
1 1 1 -19 11 4  o 110.4477 2.654490 148.8408       7.144535 162.1104       12.41074 142.2635       8.737573 115.0389 4.435386 107.8862 3.327425 7.152649       5.544764 
1 1 1 -19 11 5  o 104.5965 2.638148 133.5683       6.719020 131.0078       11.35501 134.9479       8.334792 103.3895 4.517775 105.0811 3.258813 -1.691582      5.570471 
1 1 1 -19 11 6  o 115.8714 2.846520 163.8469       8.037606 167.7919       16.12879 162.5435       9.270785 116.8507 5.681172 115.3316 3.302019 1.519112       6.571076 
1 1 1 -19 11 7  o 183.8544 3.399080 412.7811       15.22900 369.3365       28.92636 429.4405       17.91245 173.1861 6.867624 187.4589 3.921145 -14.27280      7.908201 
1 1 1 -19 11 8  o 142.8948 4.171027 249.8386       14.50877 258.5843       21.57690 242.6207       19.60197 145.0303 6.118871 140.5510 5.735123 4.479248       8.386431 
1 1 1 -19 11 9  o 113.4074 3.512530 157.2309       9.695572 160.7653       12.57036 152.0404       15.23343 114.5531 4.511855 111.2239 5.638749 3.329185       7.221656 
1 1 1 -19 11 10 o 144.4428 3.079783 254.6837       10.84057 250.4818       16.32002 258.0017       14.50222 142.9963 4.689728 145.2195 4.102126 -2.223190      6.230649 
1 1 1 -19 11 11 o 33.00521 3.912492 13.49809       3.085684 12.51886       6.298578 13.80733       3.539531 31.27752 8.174263 33.30259 4.474579 -2.025061      9.318821 
1 1 1 -19 11 12 o 79.87261 2.582845 77.91793       5.020662 76.69206       9.082526 78.45735       6.024850 79.01766 4.738558 80.10773 3.092089 -1.090073      5.658175 
1 1 1 -19 11 13 o 17.28649 5.593693 3.549699       2.688183 6.745228       6.306925 2.840290       2.971628 24.63857 8.573607 16.46051 5.871513 8.178061       10.39141 
1 1 1 -19 11 14 o 108.1279 2.860984 142.8032       7.531952 149.3790       12.19895 138.7520       9.574978 110.3899 4.544504 106.4950 3.695141 3.894920       5.857182 
1 1 1 -19 11 15 o 27.21464 5.035821 9.360582       3.216737 8.846981       6.078737 9.560346       3.791039 26.83116 8.380636 27.39394 5.856427 -0.5627785     10.22413 
1 1 1 -19 11 16 o 27.44360 5.566195 9.571616       3.595027 7.420528       9.935094 9.895708       3.856350 28.17657 10.61967 27.87422 5.863373 0.3023491      12.13081 
1 1 1 -19 11 17 o 47.37979 3.773048 27.61650       4.320379 29.56876       10.21084 27.19077       4.768235 48.05226 9.051889 46.95503 4.211849 1.097229       9.983806 
1 1 1 -19 11 18 o 97.66425 2.869060 116.5550       6.820879 113.8421       11.02684 118.2363       8.680951 96.28324 4.713967 98.28204 3.630816 -1.998802      5.950152 
1 1 1 -19 11 19 o 129.7154 2.981265 205.4925       9.423845 226.2685       15.19417 192.5038       12.01375 135.8220 4.597241 125.3801 3.936882 10.44189       6.052575 
1 1 1 -19 11 20 o 103.7881 4.726405 132.3507       11.92266 132.3507       11.92266 0.000000       0.000000 103.7881 4.726405 ?        ?        0.000000       4.726405 
1 1 1 -19 11 21 o 41.85072 4.850696 21.77570       4.855505 29.50105       7.286694 15.60590       6.511888 48.51839 6.312461 34.79187 7.865863 13.72652       10.08558 
1 1 1 -19 11 22 o 104.6656 2.885993 133.9506       7.353950 139.6182       11.81043 130.3618       9.398164 106.5817 4.557751 103.1282 3.745860 3.453506       5.899539 
1 1 1 -19 11 23 o 21.25289 5.983028 5.727736       3.229190 4.965168       6.035915 6.033520       3.822183 22.42445 8.312372 21.96819 6.605665 0.4562569      10.61745 
1 1 1 -19 11 24 o 145.9776 3.138346 260.6944       11.16409 239.7650       16.43279 278.6351       15.21432 139.5269 4.840336 150.6346 4.148637 -11.10768      6.374954 
1 1 1 -19 11 25 o 45.48359 3.681228 25.52757       4.045380 26.59849       7.082476 25.00900       4.928440 45.84206 6.523863 44.86263 4.571870 0.9794312      7.966353 
1 1 1 -19 11 26 o 38.03461 4.198221 18.00137       3.826501 18.11305       6.877944 17.95130       4.604959 37.30373 7.816640 37.78878 5.133255 -0.4850464     9.351480 
1 1 1 -19 11 27 o 46.86995 4.399801 27.31299       4.966558 0.000000       0.000000 27.31299       4.966558 ?        ?        46.86995 4.399801 0.000000       4.399801 
1 1 1 -19 11 28 o 23.24677 5.912562 7.001314       3.356709 1.980300       5.769053 9.571180       4.127281 19.10928 7.811661 27.12245 6.356123 -8.013176      10.07087 
1 1 1 -19 11 29 o 26.90837 5.564154 9.360373       3.528019 15.47772       6.559228 6.870160       4.184942 34.11290 8.025393 23.11509 6.903145 10.99781       10.58586 
1 1 1 -19 11 30 o 64.62724 3.228983 51.52497       5.069202 51.88308       8.312469 51.31293       6.396216 64.16684 5.365041 64.25094 4.106643 -0.8409882E-01 6.756344 
1 1 1 -19 11 31 f 28.39599 6.590607 10.68532       4.472482 3.367467       6.076788 19.33443       6.606446 20.41170 8.132153 38.13100 7.376493 -17.71930      10.97928 
1 1 1 -19 11 32 o 32.17520 5.060628 13.32159       3.837033 12.36787       6.449997 13.84397       4.773569 29.97948 8.461406 32.39268 6.273964 -2.413206      10.53366 
1 1 1 -19 11 33 o 32.11439 4.921778 13.30838       3.729164 9.154556       6.024704 15.88833       4.748063 25.98362 8.371159 34.80342 5.802509 -8.819798      10.18555 
1 1 1 -19 11 34 o 27.58399 6.915318 10.45734       4.639128 6.438412       6.122826 15.87419       7.108371 22.83514 8.388274 33.22442 8.684231 -10.38928      12.07390 
1 1 1 -19 11 35 o 21.25268 6.586109 6.115325       3.762312 0.3402734E-01  5.963378 10.13649       4.849204 17.05132 7.480769 26.83000 7.247277 -9.778687      10.41561 
1 1 1 -19 11 36 o 31.60135 5.619977 13.47237       4.169277 9.350470       6.451549 16.42830       5.463385 25.31891 8.677658 34.27379 6.781502 -8.954878      11.01320 
1 1 1 -19 11 37 o 24.15684 7.015262 8.417084       4.372914 7.711157       7.989093 8.719053       5.225153 23.79252 9.373317 24.35550 7.790987 -0.5629711     12.18846 
1 1 1 -19 11 38 o 13.46032 5.932630 -0.1711411     3.790550 -2.600091      5.779755 1.662092       5.021217 14.73870 6.819165 16.61557 7.073106 -1.876870      9.824961 
1 1 1 -19 11 39 o 21.59003 7.231456 6.920016       4.478611 5.990634       8.199688 7.315157       5.346577 21.73000 9.133825 22.06297 7.875090 -0.3329754     12.06001 
1 1 1 -19 11 40 o 20.07058 7.375144 5.913513       4.733745 4.032492       6.060797 8.855978       7.580337 18.85379 7.883928 23.17200 9.129910 -4.318203      12.06282 
1 1 1 -19 11 41 o 20.32701 6.785090 6.351454       3.943259 12.60376       5.991012 1.572454       5.237797 26.99693 8.301392 16.05755 7.028755 10.93938       10.87734 
1 1 1 -19 11 42 o 16.53888 6.489201 3.568802       3.815551 2.326650       5.803867 4.514287       5.063579 16.82782 7.381459 18.13827 7.354275 -1.310446      10.41975 
1 1 1 -19 12 1  o 196.6904 3.287199 472.5012       15.75597 450.5862       25.15383 486.6518       20.21256 191.6171 5.392196 199.4722 4.158176 -7.855057      6.809273 
1 1 1 -19 12 2  o 164.9022 3.256548 332.0822       13.08640 349.7521       26.18119 326.1973       15.10926 168.5720 6.384891 163.3682 3.795242 5.203796       7.427698 
1 1 1 -19 12 3  o 109.8002 2.869974 147.2507       7.672635 137.1210       14.64761 151.0811       9.007215 105.5711 5.714888 111.1743 3.328429 -5.603249      6.613501 
1 1 1 -19 12 4  o 72.81460 3.977839 65.00388       7.031519 0.000000       0.000000 65.00388       7.031519 ?        ?        72.81460 3.977839 0.000000       3.977839 
1 1 1 -19 12 5  o 108.7655 3.196447 144.5655       8.462977 154.0298       15.26753 140.3676       10.16807 111.9370 5.614975 107.0956 3.902634 4.841408       6.838018 
1 1 1 -19 12 6  o 89.36371 2.930956 97.57703       6.374097 108.9984       10.45450 90.81923       8.041675 94.27398 4.564232 86.12132 3.841440 8.152657       5.965641 
1 1 1 -19 12 7  o 82.40968 3.441870 83.09055       6.896865 86.13075       9.695213 79.97595       9.813137 83.75059 4.770161 80.65868 5.017374 3.091911       6.923039 
1 1 1 -19 12 8  o 50.96221 3.087928 31.82155       3.816883 38.13389       7.332303 29.47523       4.470324 55.50866 5.492479 48.96954 3.775203 6.539120       6.664794 
1 1 1 -19 12 9  o 161.7834 3.837509 319.8717       15.12932 318.3151       19.06476 322.5196       24.86444 161.1716 4.859630 161.9187 6.313624 -0.7470398     7.967299 
1 1 1 -19 12 10 o 214.3696 3.373342 561.2411       17.62218 564.9177       28.91108 559.0676       22.22882 214.5768 5.533602 213.8042 4.266423 0.7725983      6.987354 
1 1 1 -19 12 11 o 115.0198 2.617988 161.4261       7.337977 181.1381       13.33254 152.8601       8.788907 121.5869 4.507568 111.8386 3.228211 9.748352       5.544322 
1 1 1 -19 12 12 o 115.5986 2.644295 163.0641       7.449011 169.9396       13.27568 159.9048       8.999145 117.7391 4.636067 114.3860 3.231676 3.353073       5.651269 
1 1 1 -19 12 13 o 68.28368 2.674993 56.98779       4.442573 52.91813       8.170802 58.69580       5.293370 65.51228 5.159685 69.26078 3.144438 -3.748505      6.042337 
1 1 1 -19 12 14 o 156.8754 3.193949 300.5509       12.21009 299.9741       18.52259 300.9942       16.23752 156.4126 4.865444 156.7944 4.253578 -0.3818207     6.462621 
1 1 1 -19 12 15 o 188.1848 3.490398 432.7184       16.00647 422.2557       23.61561 441.6096       21.77000 185.4975 5.229482 189.8892 4.704595 -4.391708      7.034252 
1 1 1 -19 12 16 o 159.7309 4.288554 312.4688       16.67795 0.000000       0.000000 312.4688       16.67795 ?        ?        159.7309 4.288554 0.000000       4.288554 
1 1 1 -19 12 17 f 149.2065 3.138113 271.9241       11.41018 282.9507       17.82101 264.2634       14.85403 151.8735 4.821306 146.8966 4.153677 4.976959       6.363806 
1 1 1 -19 12 18 o 179.5382 3.409589 393.9558       14.91746 414.4592       22.96905 378.9986       19.61800 183.7254 5.135278 175.8220 4.582641 7.903397       6.882709 
1 1 1 -19 12 19 o 15.41712 6.405882 0.7039473      3.964250 -4.179110      6.457180 3.657716       5.022098 16.14044 7.371501 20.02715 7.549885 -3.886711      10.55177 
1 1 1 -19 12 20 o 113.8745 4.689959 159.3249       12.98678 159.3249       12.98678 0.000000       0.000000 113.8745 4.689959 ?        ?        0.000000       4.689959 
1 1 1 -19 12 21 o 47.22565 3.579727 27.44382       4.089001 32.46263       7.610013 25.40668       4.848353 50.92041 6.264675 45.30256 4.449052 5.617851       7.683764 
1 1 1 -19 12 22 o 46.11875 3.653524 26.20103       4.072536 23.77414       7.514374 27.21034       4.845949 43.17344 7.409036 46.91010 4.286442 -3.736664      8.559638 
1 1 1 -19 12 23 o 55.32073 3.331002 37.58850       4.469741 33.17632       8.045938 39.55793       5.375528 51.34120 6.582165 56.67240 3.916451 -5.331200      7.659210 
1 1 1 -19 12 24 o 40.29426 3.911457 20.10198       3.792504 18.25843       6.931075 20.88982       4.530965 37.53980 7.830347 40.95847 4.620052 -3.418671      9.091711 
1 1 1 -19 12 25 o 52.30480 3.405162 33.67066       4.316662 32.29286       7.598885 34.32711       5.245137 50.60690 6.297617 52.69418 4.117347 -2.087276      7.524130 
1 1 1 -19 12 26 o 144.2157 3.579503 255.3169       12.57973 259.4630       24.95440 253.9043       14.56594 143.6281 7.152207 143.5677 4.167790 0.6044006E-01  8.277955 
1 1 1 -19 12 27 o 44.40693 4.031368 24.48102       4.315046 27.31069       9.471705 23.73992       4.847283 45.48440 8.864036 43.59404 4.633747 1.890366       10.00214 
1 1 1 -19 12 28 o 56.09929 3.344996 38.81086       4.552109 31.38829       7.669720 42.84752       5.656048 49.57151 6.505971 58.81495 3.969545 -9.243443      7.621348 
1 1 1 -19 12 29 o 22.11857 6.073711 6.356225       3.373259 7.335656       6.066676 5.917896       4.058486 24.52196 8.414513 21.66360 6.859093 2.858356       10.85593 
1 1 1 -19 12 30 o 24.61510 5.828790 7.936684       3.442002 13.05972       6.541014 5.974840       4.047750 31.05843 8.428856 21.66866 6.848666 9.389774       10.86047 
1 1 1 -19 12 31 o 92.86238 3.581613 106.8833       8.089834 112.1445       10.96896 100.6083       11.97918 94.50560 4.778408 89.04182 5.548307 5.463783       7.322356 
1 1 1 -19 12 32 o 56.11244 3.474566 39.17583       4.727811 32.32092       7.657722 43.39817       6.010010 49.67505 6.480285 58.78583 4.223481 -9.110779      7.735107 
1 1 1 -19 12 33 o 30.20486 5.394017 11.96920       3.824620 9.616826       6.569798 13.17511       4.703867 26.47123 8.755641 31.32740 6.378648 -4.856174      10.83275 
1 1 1 -19 12 34 o 29.85496 6.823915 12.27625       4.855994 14.66646       6.538105 9.335499       7.252082 31.94064 8.318732 26.01624 9.183034 5.924402       12.39070 
1 1 1 -19 12 35 o 53.35867 3.727727 36.00268       4.816649 30.36009       7.464446 40.02843       6.304952 47.13912 6.685313 55.70071 4.688475 -8.561588      8.165488 
1 1 1 -19 12 36 o 22.25576 6.891010 6.972962       4.119744 11.05429       8.279885 5.630119       4.749371 26.86514 9.772502 20.64055 7.415800 6.224590       12.26768 
1 1 1 -19 12 37 o 17.03621 6.553469 3.244938       3.832361 2.512790       5.889657 3.782561       5.046958 18.29346 7.718083 18.65937 7.418604 -0.3659039     10.70535 
1 1 1 -19 12 38 o 37.67252 6.493720 20.20124       5.746271 0.000000       0.000000 20.20124       5.746271 ?        ?        37.67252 6.493720 0.000000       6.493720 
1 1 1 -19 12 39 o 37.75007 4.940517 19.31922       4.435956 15.08678       6.424343 23.17598       6.132598 30.41093 8.394205 40.00556 6.514491 -9.594624      10.62550 
1 1 1 -19 12 40 o 15.46483 6.622181 1.628597       4.448036 2.529851       5.667542 0.1831257      7.177544 17.29696 7.441958 17.08038 7.789683 0.2165833      10.77320 
1 1 1 -19 12 41 o 13.09780 5.843907 -0.6643326E-01 3.791215 7.066162       5.850870 -5.228682      4.977556 20.91169 8.083378 11.87867 5.731481 9.033022       9.909131 
1 1 1 -19 12 42 o 48.80073 4.252104 32.20770       5.006248 34.37173       7.878695 30.74231       6.483348 46.54519 7.176519 45.59156 5.979494 0.9536209      9.341133 
1 1 1 -19 13 1  o 116.6195 3.350295 166.2805       9.511302 163.0930       16.16780 167.9675       11.76192 115.1044 5.782506 117.1064 4.128015 -2.002014      7.104779 
1 1 1 -19 13 2  o 20.26540 7.343872 4.196437       4.669896 4.475272       5.704508 3.629912       8.131207 21.68671 8.072961 23.58132 9.402941 -1.894613      12.39306 
1 1 1 -19 13 3  o 225.0280 3.918967 619.1062       21.49039 628.8500       31.54770 610.6699       29.35467 226.2831 5.725697 223.1479 5.398193 3.135284       7.869186 
1 1 1 -19 13 4  o 57.35593 3.958797 40.41056       5.499271 31.56019       14.47709 41.90296       5.944876 49.15740 12.15453 58.38042 4.206895 -9.223019      12.86198 
1 1 1 -19 13 5  o 186.3852 3.161513 424.2004       14.35961 427.5530       23.64272 422.2409       18.07541 186.7043 5.201520 185.8347 3.991399 0.8695984      6.556453 
1 1 1 -19 13 6  o 172.7093 3.414835 364.3581       14.37215 376.7467       21.51787 354.3800       19.31127 175.2903 5.042628 170.0806 4.663695 5.209702       6.868635 
1 1 1 -19 13 7  o 152.8546 2.873623 285.1897       10.70396 306.8034       18.52039 274.3488       13.11650 158.2168 4.809124 149.8466 3.591990 8.370209       6.002505 
1 1 1 -19 13 8  o 145.5419 3.144777 258.6459       11.15357 248.2766       16.71069 266.9766       14.97821 142.3095 4.825618 147.6908 4.165856 -5.381287      6.375025 
1 1 1 -19 13 9  o 30.85413 5.650591 12.04001       4.092058 11.36916       6.538682 12.47191       5.246464 29.94044 8.542686 31.21764 7.062238 -1.277206      11.08389 
1 1 1 -19 13 10 o 176.0513 3.044935 378.4128       13.06332 386.5506       21.94082 373.9439       16.25928 177.5430 5.076439 174.9077 3.814662 2.635330       6.349952 
1 1 1 -19 13 11 o 274.0461 4.002063 918.3368       26.72660 885.5603       42.33012 940.0649       34.46505 268.3405 6.473322 276.9598 5.106533 -8.619293      8.245033 
1 1 1 -19 13 12 o 43.47099 3.387863 23.22458       3.560581 24.25169       7.352583 22.90992       4.069596 43.81664 7.130950 43.11087 3.916420 0.7057724      8.135650 
1 1 1 -19 13 13 f 86.68194 2.630573 91.78268       5.550245 80.14369       9.990426 96.97868       6.675148 80.69877 5.106389 89.06312 3.080216 -8.364349      5.963467 
1 1 1 -19 13 14 o 192.0142 3.167865 450.3088       14.82300 467.9635       25.17149 440.9363       18.34030 195.2544 5.295088 189.8774 3.963666 5.376953       6.614273 
1 1 1 -19 13 15 o 113.4179 2.857109 157.1485       7.890391 139.8601       17.23955 161.7298       8.874470 106.3545 6.685544 115.0258 3.169021 -8.671265      7.398595 
1 1 1 -19 13 16 o 46.43421 4.004886 26.57206       4.487490 22.58513       11.89285 27.23394       4.845682 41.68654 11.38725 46.97600 4.279895 -5.289455      12.16499 
1 1 1 -19 13 17 o 72.84918 3.009248 64.93039       5.330681 77.05381       9.449362 59.27117       6.456070 79.11490 4.925699 69.50494 3.826444 9.609955       6.237321 
1 1 1 -19 13 18 o 146.3395 3.731119 262.1485       13.29482 279.2365       17.83921 240.8010       19.93896 150.7955 4.860924 139.7695 5.867065 11.02602       7.619123 
1 1 1 -19 13 19 o 139.2928 3.101710 237.1081       10.52849 240.1737       16.38216 234.9509       13.74235 139.8189 4.815236 138.4501 4.077605 1.368820       6.309783 
1 1 1 -19 13 20 o 136.7610 3.655777 229.0607       12.17274 236.0730       16.04917 219.5629       18.67805 138.5961 4.758940 133.3886 5.759721 5.207520       7.471405 
1 1 1 -19 13 21 o 167.4453 3.329714 342.9884       13.58676 337.5331       20.47914 347.2775       18.15864 165.5967 5.080869 168.1738 4.434739 -2.577103      6.744044 
1 1 1 -19 13 22 o 16.24690 6.004945 2.566540       3.145910 4.520768       6.395539 1.942777       3.613261 22.33294 8.496838 16.14059 6.320202 6.192345       10.58967 
1 1 1 -19 13 23 o 64.67132 3.122225 51.29686       4.905994 51.02499       8.587380 51.42859       5.977530 64.04683 5.557021 64.65093 3.811023 -0.6041031     6.738277 
1 1 1 -19 13 24 o 124.3531 3.002822 189.2611       9.099597 187.6516       14.23974 190.3721       11.83021 123.3232 4.747150 124.4659 3.905203 -1.142708      6.147035 
1 1 1 -19 13 25 o 151.0736 3.624459 280.1657       13.34344 299.9927       26.72464 273.5815       15.40044 154.5527 7.114852 149.0243 4.245048 5.528427       8.285020 
1 1 1 -19 13 26 f 27.05512 5.860534 9.452234       3.751910 8.295511       9.175546 9.684471       4.111332 27.68930 10.25152 27.31950 6.303663 0.3698063      12.03453 
1 1 1 -19 13 27 o 66.33197 3.173359 54.12849       5.114659 58.63726       8.803987 51.83157       6.283824 68.46983 5.318149 64.72202 4.003753 3.747803       6.656782 
1 1 1 -19 13 28 o 32.72158 4.704445 13.54672       3.643577 13.89437       6.646348 13.39735       4.356561 32.22097 8.385110 32.26000 5.752718 -0.3902435E-01 10.16877 
1 1 1 -19 13 29 o 60.37074 3.338812 45.02927       4.892828 39.08279       8.287203 48.21129       6.062193 55.26320 6.264041 62.28545 4.015385 -7.022247      7.440532 
1 1 1 -19 13 30 o 28.82483 5.340952 10.75951       3.613522 7.353833       6.517101 12.27131       4.342104 24.57845 8.702534 30.61773 6.034229 -6.039276      10.58990 
1 1 1 -19 13 31 o 29.26200 5.393128 11.14536       3.704092 10.04839       6.135951 11.77433       4.646180 27.24338 8.405500 29.70498 6.590826 -2.461603      10.68136 
1 1 1 -19 13 32 o 21.09907 6.333000 5.872862       3.515476 2.736129       5.854638 7.641507       4.396242 19.32685 7.881217 23.83313 7.064931 -4.506287      10.58427 
1 1 1 -19 13 33 o 31.81351 6.394471 13.65506       4.785256 14.73690       6.694678 12.52492       6.842491 32.10802 8.444881 29.53100 8.828755 2.577019       12.21732 
1 1 1 -19 13 34 o 40.74408 4.281159 21.24879       4.187288 13.89539       6.817663 25.70276       5.305979 30.71243 8.709828 44.49136 4.979181 -13.77893      10.03261 
1 1 1 -19 13 35 o 11.83444 5.352688 -1.305723      3.303646 10.79764       5.594263 -7.786881      4.093701 27.14359 7.949526 9.865635 4.853852 17.27795       9.314228 
1 1 1 -19 13 36 o 28.02188 6.730226 11.19923       4.537964 3.609607       8.569083 14.15732       5.349709 21.28940 9.155113 31.31173 7.166396 -10.02233      11.62641 
1 1 1 -19 13 37 o 33.74630 5.337310 15.44543       4.243382 16.42210       6.508802 14.72344       5.596165 32.68789 8.189037 31.50919 7.412853 1.178701       11.04585 
1 1 1 -19 13 38 o 40.62103 5.183225 22.39675       5.014105 30.32149       9.960415 19.70685       5.803016 42.19311 9.864750 36.86356 6.706813 5.329544       11.92873 
1 1 1 -19 13 39 o 24.40077 6.527603 8.901533       3.957206 10.40370       6.220834 7.880531       5.128646 24.97118 8.522074 22.43831 7.735283 2.532867       11.50914 
1 1 1 -19 13 40 o 17.15081 7.425653 2.451149       5.712727 -1.966433      8.714907 5.779582       7.564676 17.16836 8.082810 20.45625 8.693875 -3.287889      11.87077 
1 1 1 -19 13 41 o 13.21728 5.877661 0.1152799      3.802456 -2.809858      6.083866 1.990433       4.871075 14.26614 6.727789 15.90426 6.871364 -1.638117      9.616590 
1 1 1 -19 13 42 o 28.33648 6.334165 12.37756       4.263850 13.77534       6.647392 11.40044       5.557823 26.87179 8.803289 25.31277 8.028202 1.559017       11.91427 
1 1 1 -19 14 1  o 179.9142 3.443214 395.5733       15.09612 412.0696       30.10271 390.0308       17.44884 182.7307 6.771890 178.5549 4.010130 4.175797       7.870174 
1 1 1 -19 14 2  o 200.1539 3.322828 489.4517       16.20720 465.5251       25.74552 505.1577       20.85901 194.6868 5.431922 203.1732 4.212998 -8.486328      6.874237 
1 1 1 -19 14 3  o 211.2542 3.901396 545.7590       20.08452 526.2692       28.20031 565.8215       28.61177 206.9760 5.596242 214.6557 5.474200 -7.679749      7.828461 
1 1 1 -19 14 4  o 171.8349 3.475647 360.7984       14.55402 328.4857       31.93762 369.2672       16.35040 162.7541 8.077811 173.7821 3.860888 -11.02797      8.953072 
1 1 1 -19 14 5  o 160.7698 2.998518 315.5903       11.74755 312.3556       19.44915 317.4483       14.74019 159.5685 5.007895 161.1469 3.753575 -1.578354      6.258461 
1 1 1 -19 14 6  o 133.2441 2.795389 216.7136       9.076664 221.5391       15.57307 214.2310       11.17012 134.4060 4.762184 132.3696 3.465830 2.036407       5.889853 
1 1 1 -19 14 7  o 96.43195 2.973600 113.6432       6.979434 112.4218       11.24069 114.4096       8.903663 95.67721 4.836816 96.66763 3.786976 -0.9904251     6.142962 
1 1 1 -19 14 8  o 155.0063 2.920426 293.3337       11.03143 299.7242       18.81061 289.9838       13.61926 156.3216 4.944178 154.0362 3.628228 2.285431       6.132612 
1 1 1 -19 14 9  o 43.38424 4.332454 23.25998       4.519197 27.46552       7.350263 20.70397       5.730250 46.78868 6.632174 40.63293 5.964522 6.155754       8.919711 
1 1 1 -19 14 10 o 81.61693 2.708791 81.39359       5.380092 85.20997       10.18772 79.91763       6.335596 83.22729 5.046857 80.82515 3.223121 2.402145       5.988262 
1 1 1 -19 14 11 o 139.1766 2.792068 236.4516       9.469528 233.5329       16.10677 237.9933       11.70642 137.9843 4.797375 139.5626 3.442064 -1.578278      5.904457 
1 1 1 -19 14 12 o 114.4220 2.977746 159.9726       8.295910 164.5707       13.32465 157.0621       10.60124 115.8104 4.731375 113.2691 3.846270 2.541321       6.097516 
1 1 1 -19 14 13 o 92.03382 2.631159 103.4648       5.895011 103.9973       10.91587 103.2456       7.004203 91.98907 4.887055 91.88805 3.132557 0.1010208      5.804845 
1 1 1 -19 14 14 o 246.6063 4.106219 744.1602       24.67644 693.5187       49.00879 761.3593       28.56105 236.2638 8.526158 249.2749 4.701750 -13.01112      9.736623 
1 1 1 -19 14 15 o 75.24781 2.711361 69.21399       4.963714 73.97878       9.719732 67.53292       5.773316 77.47804 5.177731 74.28014 3.196940 3.197906       6.085172 
1 1 1 -19 14 16 o 144.7826 3.656951 256.5261       12.89210 278.5315       26.23888 249.5231       14.80200 149.9461 7.201876 142.6800 4.261950 7.266144       8.368466 
1 1 1 -19 14 17 o 162.6276 3.880924 323.6858       15.38033 303.9850       19.28371 358.1283       25.49741 157.2837 5.037689 170.3845 6.150964 -13.10078      7.950640 
1 1 1 -19 14 18 o 51.14510 3.542888 32.14907       4.388389 38.63876       8.361868 29.68221       5.155413 55.63158 6.277522 49.02074 4.361141 6.610836       7.643745 
1 1 1 -19 14 19 o 109.5011 2.983813 146.6415       7.954651 158.9575       13.33434 139.8370       9.911436 113.6759 4.824534 106.8018 3.814342 6.874092       6.150230 
1 1 1 -19 14 20 o 138.7309 3.700334 235.8358       12.49862 265.6404       17.25096 202.9037       18.13349 146.9569 4.823651 128.1316 5.822716 18.82536       7.561193 
1 1 1 -19 14 21 o 215.8198 3.815622 570.8167       20.06747 585.6457       30.13314 558.9987       26.90056 217.7716 5.683010 213.0570 5.181189 4.714569       7.690340 
1 1 1 -19 14 22 o 35.32907 4.410077 15.56929       3.714315 12.56782       6.955318 16.76676       4.393203 31.14942 8.784872 36.55405 5.068010 -5.404623      10.14193 
1 1 1 -19 14 23 o 173.1464 3.387549 367.3480       14.29338 371.8662       21.75534 363.9164       18.95962 173.4967 5.151334 171.8981 4.530030 1.598602       6.859840 
1 1 1 -19 14 24 o 50.76582 3.795884 31.82618       4.661920 49.13428       11.98105 28.73809       5.060746 61.89775 8.140081 48.11907 4.363177 13.77868       9.235704 
1 1 1 -19 14 25 o 69.41776 3.442714 59.29506       5.805645 72.07509       13.87152 56.58101       6.392453 75.18067 7.679235 67.71410 3.890310 7.466576       8.608436 
1 1 1 -19 14 26 o 26.60354 5.961776 9.174842       3.769083 18.24469       9.623631 7.531570       4.096318 36.74194 10.32344 24.11375 6.720755 12.62819       12.31836 
1 1 1 -19 14 27 o 142.0823 3.160115 247.9967       10.94155 255.0930       16.98260 242.9607       14.30661 143.2197 4.873022 140.1376 4.194066 3.082153       6.429349 
1 1 1 -19 14 28 o 44.53418 3.855167 24.68118       4.142654 19.31652       7.112846 27.43509       5.096211 38.07926 7.923369 46.79306 4.525620 -8.713802      9.124747 
1 1 1 -19 14 29 o 56.78183 3.420523 39.92903       4.711071 42.34797       8.062226 38.67483       5.805315 57.62916 5.820544 55.61435 4.317333 2.014816       7.246937 
1 1 1 -19 14 30 o 34.36304 5.624465 15.30622       4.547079 21.55716       7.021397 10.79100       5.967468 40.13871 7.452640 28.18295 8.198171 11.95577       11.07934 
1 1 1 -19 14 31 o 36.58910 4.633252 17.07483       4.038693 16.98496       7.100015 17.11781       4.910528 34.89584 8.441993 36.21488 5.756680 -1.319035      10.21796 
1 1 1 -19 14 32 o 16.49067 6.827854 1.521363       4.481574 -3.063795      6.384352 5.975469       6.292452 15.96238 7.305162 22.56201 8.462618 -6.599630      11.17950 
1 1 1 -19 14 33 o 19.84999 7.168407 4.798597       4.444501 6.237799       6.184074 3.260973       6.392030 22.51358 8.400603 20.00869 8.205921 2.504892       11.74339 
1 1 1 -19 14 34 o 26.03270 5.871747 9.245278       3.635936 2.489534       6.053069 13.05880       4.547807 18.83774 7.878179 30.86465 6.260872 -12.02691      10.06301 
1 1 1 -19 14 35 o 37.72505 4.814161 18.69478       4.325047 20.48407       7.064970 17.62227       5.469778 37.31758 8.008643 35.57028 6.551580 1.747299       10.34706 
1 1 1 -19 14 36 o 34.19956 5.932436 16.11680       4.764967 16.52439       9.545904 15.98154       5.499047 30.95367 10.55689 33.32803 6.994185 -2.374367      12.66359 
1 1 1 -19 14 37 o 9.844303 4.819496 -6.544070      3.882443 -7.565857      7.564832 -6.178694      4.523645 14.74723 7.103053 11.11887 5.388726 3.628358       8.915813 
1 1 1 -19 14 38 o 21.67106 6.801773 6.977390       3.999137 10.66862       6.269631 4.445385       5.192649 25.49719 8.556286 18.92219 7.524325 6.575003       11.39410 
1 1 1 -19 14 39 o 17.31301 6.990396 3.495608       4.553357 1.237513       5.786515 7.167347       7.378734 16.52821 7.305431 21.67333 8.844113 -5.145117      11.47117 
1 1 1 -19 14 40 o 25.08501 6.607269 9.721152       4.094316 6.753657       6.691833 11.49668       5.176235 20.79289 8.445670 26.38597 7.623550 -5.593084      11.37752 
1 1 1 -19 14 41 o 18.08531 6.918357 4.775830       4.254850 -1.629024      9.082472 6.576673       4.816010 17.11820 8.116594 20.18851 7.435460 -3.070316      11.00751 
1 1 1 -19 15 1  o 92.30775 2.947158 104.1652       6.620957 109.1551       13.13757 102.4663       7.665625 94.06464 5.758893 91.49554 3.444194 2.569107       6.710240 
1 1 1 -19 15 2  o 170.7483 3.357935 356.2794       13.97220 317.2468       26.17163 371.8390       16.52405 160.2871 6.715203 174.3500 3.889184 -14.06285      7.760136 
1 1 1 -19 15 3  o 258.7653 3.909080 819.0459       24.64999 835.4409       40.13258 809.1138       31.23654 260.5266 6.321338 256.8777 4.989997 3.648834       8.053533 
1 1 1 -19 15 4  o 349.8817 6.445020 1507.151       54.95176 1528.249       98.18370 1497.528       66.31026 348.1577 11.58865 347.9148 7.821169 0.2428284      13.98097 
1 1 1 -19 15 5  o 127.4583 2.808392 198.3318       8.722919 214.9050       15.31440 190.3727       10.61273 132.3515 4.755998 124.7594 3.494185 7.592102       5.901597 
1 1 1 -19 15 6  o 218.6917 3.876177 584.8937       20.65722 569.6111       29.98495 598.6992       28.49911 215.2739 5.720854 220.9050 5.294070 -5.631012      7.794572 
1 1 1 -19 15 7  o 52.67395 3.188727 34.01392       4.073900 32.68021       7.984602 34.48331       4.736850 51.11508 6.561282 52.98290 3.691843 -1.867821      7.528621 
1 1 1 -19 15 8  o 135.0845 2.811331 222.7722       9.254513 237.8313       16.42702 215.7703       11.20125 139.2261 4.849150 132.8332 3.463332 6.392838       5.958937 
1 1 1 -19 15 9  o 103.2708 3.216538 130.4029       8.084855 133.5531       12.25594 127.9760       10.75747 104.2834 4.835923 102.1582 4.330994 2.125252       6.491815 
1 1 1 -19 15 10 o 126.8591 2.742047 196.4544       8.476813 185.7846       14.36998 202.1487       10.49789 123.0367 4.801978 128.5817 3.353184 -5.545029      5.856862 
1 1 1 -19 15 11 o 104.7325 2.682857 133.9806       6.841595 131.3710       12.17805 135.1841       8.270038 103.4177 4.845696 105.1439 3.231493 -1.726204      5.824373 
1 1 1 -19 15 12 o 125.9361 2.746392 193.6211       8.428476 182.1065       14.50975 199.4851       10.35456 121.7792 4.899347 127.7276 3.329517 -5.948441      5.923621 
1 1 1 -19 15 13 o 245.7429 3.726453 738.5379       22.31581 798.0746       38.28469 707.9000       27.46392 254.6397 6.169684 240.3331 4.689352 14.30663       7.749518 
1 1 1 -19 15 14 o 47.28881 3.475515 27.48501       3.977125 21.51655       7.753561 29.61607       4.633058 40.97477 8.052410 49.04363 3.908906 -8.068859      8.951025 
1 1 1 -19 15 15 o 104.3298 3.443946 133.2268       8.743898 100.1115       17.04687 145.0502       10.18593 89.50444 7.896532 108.8058 3.847662 -19.30132      8.784060 
1 1 1 -19 15 16 o 61.60896 3.360896 46.54460       5.026748 43.97879       8.991621 47.71107       6.062640 59.39613 6.308548 62.29482 4.015066 -2.898689      7.477870 
1 1 1 -19 15 17 f 74.43617 3.072540 67.83117       5.561386 76.79410       9.970243 63.78287       6.700655 78.87515 5.216447 72.08099 3.828431 6.794159       6.470564 
1 1 1 -19 15 18 o 124.3873 3.057410 189.1282       9.267569 185.3481       14.76905 191.5833       11.90260 122.7219 4.948642 125.0040 3.912163 -2.282059      6.308255 
1 1 1 -19 15 19 o 124.5978 3.045661 189.8116       9.247579 191.0611       14.80147 189.0117       11.84364 124.5777 4.885073 124.1341 3.920150 0.4436035      6.263506 
1 1 1 -19 15 20 o 76.08049 3.733078 71.09213       6.899989 73.91885       9.881744 68.40265       9.638903 77.27978 5.278948 74.30897 5.358919 2.970810       7.522320 
1 1 1 -19 15 21 o 34.05524 4.537672 14.50442       3.672134 17.18585       7.177654 13.55375       4.273800 36.31579 8.293203 32.69202 5.563694 3.623772       9.986587 
1 1 1 -19 15 22 o 68.84921 3.125936 58.15376       5.230953 55.19820       8.969514 59.67709       6.439411 66.57363 5.580091 69.63294 3.809366 -3.059311      6.756382 
1 1 1 -19 15 23 o 59.16899 3.553199 43.10892       5.099695 44.35783       11.90717 42.82837       5.643489 58.60128 8.593276 58.90197 3.954629 -0.3006859     9.459571 
1 1 1 -19 15 24 o 31.43034 5.123487 12.53303       3.789144 7.145852       9.661841 13.51219       4.119127 27.16248 10.41667 32.60378 5.371315 -5.441301      11.71998 
1 1 1 -19 15 25 o 63.33268 3.143243 49.32901       4.835959 55.45240       8.609635 46.50665       5.845142 66.59531 5.350224 61.32769 3.931844 5.267616       6.639600 
1 1 1 -19 15 26 o 26.24924 5.712038 8.931182       3.549736 6.847083       9.090087 9.306183       3.855893 26.25848 10.09512 26.73944 6.058268 -0.4809685     11.77345 
1 1 1 -19 15 27 o 71.62263 3.092851 63.17126       5.385432 59.29815       9.038599 65.30305       6.705691 68.62695 5.449397 72.62911 3.801996 -4.002159      6.644630 
1 1 1 -19 15 28 o 64.83519 3.201588 51.89901       5.042745 54.88068       8.690766 50.38560       6.191638 65.87027 5.463280 63.64277 4.012701 2.227501       6.778584 
1 1 1 -19 15 29 o 43.64678 4.081595 23.87921       4.290936 15.46735       7.099187 28.72128       5.386151 33.50666 8.639046 47.69825 4.694604 -14.19159      9.832213 
1 1 1 -19 15 30 o 53.60370 4.278995 36.13265       5.543125 35.44635       8.013303 36.76237       7.675903 52.08970 6.450545 53.28640 6.016293 -1.196701      8.820732 
1 1 1 -19 15 31 o 46.87011 3.849020 27.59791       4.357550 25.72532       7.756022 28.46162       5.267487 43.43716 7.604149 47.29110 4.630016 -3.853943      8.902816 
1 1 1 -19 15 32 o 28.60616 7.057267 11.32080       4.888778 18.10630       7.028207 4.959910       6.804758 35.68009 8.248218 21.85454 8.637993 13.82555       11.94353 
1 1 1 -19 15 33 f 38.32819 4.456203 18.92288       4.084652 27.77072       7.127835 14.59657       4.984226 45.16323 6.677476 32.62817 6.496995 12.53507       9.316632 
1 1 1 -19 15 34 o 10.70708 5.036575 -3.083513      3.371093 0.6769011E-01  5.985065 -4.547777      4.079814 16.88758 7.448479 11.25287 5.365133 5.634708       9.179569 
1 1 1 -19 15 35 o 11.17427 5.196134 -2.443427      3.420695 0.6929035      5.411857 -4.530116      4.414324 16.49802 7.184466 11.79864 5.612760 4.699378       9.116997 
1 1 1 -19 15 36 o 27.22384 6.077910 10.44893       3.930026 13.31638       6.345883 8.664925       5.005435 29.14741 8.446929 24.08904 7.616163 5.058363       11.37350 
1 1 1 -19 15 37 o 21.61298 7.049255 6.888767       4.264545 0.6188040      8.485842 9.007329       4.932682 18.88601 8.556767 24.24761 7.545641 -5.361597      11.40855 
1 1 1 -19 15 38 o 22.82978 6.734885 7.863721       4.002989 1.690367       6.212967 12.24522       5.234196 17.35064 7.623148 27.91360 7.524954 -10.56296      10.71155 
1 1 1 -19 15 39 o 12.65537 5.878512 -2.037917      4.359873 -0.7804579     5.915273 -3.533503      6.451097 15.30444 7.014393 14.52771 6.874184 0.7767353      9.821207 
1 1 1 -19 15 40 o 42.73238 4.334351 24.66132       4.451172 26.37206       7.302844 23.65010       5.614660 40.34089 7.709626 40.26748 5.896512 0.7341766E-01  9.706038 
1 1 1 -19 15 41 o 20.85600 6.761421 6.957813       3.926598 6.960428       6.334908 6.956182       5.003744 20.45228 8.249784 20.50024 7.573939 -0.4796410E-01 11.19926 
1 1 1 -19 16 1  o 102.7355 2.944643 129.0302       7.364462 144.9034       14.96112 123.9541       8.460430 108.4015 5.683457 100.6292 3.455229 7.772217       6.651338 
1 1 1 -19 16 2  o 149.1412 3.609098 272.0094       13.11693 258.2755       22.39944 279.1768       16.18164 144.6365 6.370740 150.8958 4.405290 -6.259262      7.745509 
1 1 1 -19 16 3  o 143.8597 2.934553 252.7611       10.28768 249.7421       17.27559 254.4199       12.80593 142.5974 4.979114 144.1929 3.647372 -1.595459      6.172106 
1 1 1 -19 16 4  o 85.18002 3.195926 88.77340       6.622159 111.9811       18.93834 85.54055       7.068363 94.64983 8.294559 83.58021 3.477998 11.06963       8.994231 
1 1 1 -19 16 5  o 435.2113 5.917928 2329.407       62.76332 2286.029       98.99554 2358.562       81.15963 428.0371 9.490697 436.5916 7.628314 -8.554504      12.17639 
1 1 1 -19 16 6  o 119.4429 3.348536 174.4826       9.736940 166.5768       14.18141 181.5334       13.39264 116.4322 5.009884 121.6482 4.525664 -5.216011      6.751338 
1 1 1 -19 16 7  o 49.64678 3.377485 30.26074       4.061879 27.43784       8.172858 31.18674       4.680918 46.55834 7.454877 50.34901 3.844148 -3.790668      8.387650 
1 1 1 -19 16 8  o 180.3607 3.143406 397.3970       13.81588 382.9814       22.67942 405.9034       17.42161 176.5638 5.276935 182.1480 3.924893 -5.584183      6.576536 
1 1 1 -19 16 9  o 147.3068 3.360652 265.1902       12.06376 267.1222       17.86849 263.5720       16.35346 147.4960 4.978453 146.5973 4.583335 0.8987427      6.766975 
1 1 1 -19 16 10 o 119.8259 2.730995 175.3023       7.974577 193.6448       14.47077 167.3023       9.556673 125.5963 4.736500 116.9517 3.356709 8.644608       5.805336 
1 1 1 -19 16 11 f 204.4025 3.664672 510.9794       18.25398 497.4025       37.27801 515.2616       20.93569 200.2774 7.652165 205.1401 4.187943 -4.862671      8.723216 
1 1 1 -19 16 12 o 94.01691 3.096156 108.1135       7.083897 105.0588       11.36110 110.0566       9.060942 92.38063 5.066044 94.74866 3.932868 -2.368027      6.413444 
1 1 1 -19 16 13 o 264.8015 4.434378 859.3625       28.61470 860.0297       41.54815 858.7605       39.46662 264.0466 6.457064 264.0091 6.134441 0.3750610E-01  8.906461 
1 1 1 -19 16 14 o 151.0346 3.288712 278.8714       12.10426 270.6692       18.14970 285.4420       16.24436 148.3849 5.026563 152.5472 4.374326 -4.162292      6.663412 
1 1 1 -19 16 15 o 132.7086 3.056854 215.2322       9.885756 232.7115       24.00677 211.6629       10.84823 136.8751 7.222927 131.5156 3.387717 5.359497       7.977925 
1 1 1 -19 16 16 o 65.46065 2.850394 52.45355       4.536062 60.81376       9.231795 49.79279       5.208111 70.09143 5.447612 63.71642 3.366172 6.375008       6.403718 
1 1 1 -19 16 17 o 112.6365 2.708778 154.9921       7.435130 163.1445       13.94642 151.7550       8.788165 115.0949 4.984265 111.3440 3.242337 3.750938       5.946062 
1 1 1 -19 16 18 o 89.43246 2.662772 97.80611       5.796707 110.3382       11.27914 93.30800       6.757399 94.59789 4.909610 87.28180 3.182346 7.316093       5.850778 
1 1 1 -19 16 19 o 46.15525 3.689998 26.26796       4.115796 24.44968       7.635837 27.01256       4.886383 43.72815 7.431379 46.70421 4.343111 -2.976059      8.607438 
1 1 1 -19 16 20 o 108.5648 3.573171 144.6014       9.440321 148.3246       12.82292 140.1954       13.94936 109.6518 4.810534 106.4290 5.396070 3.222763       7.229025 
1 1 1 -19 16 21 o 91.86473 2.971434 103.3918       6.643230 122.4717       11.66181 94.22569       8.082942 99.56100 4.820960 87.53968 3.798071 12.02132       6.137345 
1 1 1 -19 16 22 o 29.70376 5.453427 11.25896       3.802029 12.35190       10.24815 11.08452       4.094215 31.78201 10.93535 29.36967 5.925134 2.412340       12.43741 
1 1 1 -19 16 23 o 36.68740 4.732406 16.89250       4.132469 12.54429       11.26026 17.56929       4.442451 32.26600 11.43772 37.36414 5.004755 -5.098145      12.48475 
1 1 1 -19 16 24 o 56.21302 3.358680 38.94074       4.579908 45.41468       8.747836 36.49615       5.375502 60.00140 6.066005 54.26264 4.095431 5.738758       7.319083 
1 1 1 -19 16 25 o 44.81864 3.788449 24.92500       4.098957 19.08610       7.678801 27.25176       4.847339 37.81551 8.535815 46.76023 4.302121 -8.944725      9.558681 
1 1 1 -19 16 26 o 57.50576 3.674712 40.94912       5.122622 22.04826       11.13036 46.02863       5.770050 39.68556 11.08485 60.91953 3.907355 -21.23397      11.75335 
1 1 1 -19 16 27 o 48.70687 3.578256 29.44173       4.217508 31.31821       7.637378 28.61844       5.058791 49.25108 6.523729 47.79777 4.392200 1.453312       7.864506 
1 1 1 -19 16 28 o 16.21239 6.141752 2.524597       3.332834 -0.5380434     6.477316 3.627403       3.886838 17.87424 7.820320 18.29370 6.689321 -0.4194679     10.29099 
1 1 1 -19 16 29 o 37.57906 4.346470 17.86762       3.907037 20.43903       6.924287 16.66654       4.732342 38.91183 7.574852 35.84854 5.600184 3.063293       9.420216 
1 1 1 -19 16 30 o 28.86909 6.365390 11.18131       4.357460 18.54766       6.909412 6.316761       5.614829 36.61540 7.970280 22.60602 8.070085 14.00938       11.34247 
1 1 1 -19 16 31 o 21.16089 7.182026 5.771363       4.417428 4.543638       6.289666 6.966473       6.205557 21.15060 8.321624 23.42001 8.468637 -2.269415      11.87296 
1 1 1 -19 16 32 f 24.77327 6.095032 8.372639       3.653951 12.35215       6.125834 6.174787       4.552494 29.22393 8.245303 21.56922 7.291220 7.654711       11.00668 
1 1 1 -19 16 33 o 25.95601 6.060851 9.275451       3.763731 12.49276       6.374048 7.553213       4.663542 28.95999 8.486603 23.19009 7.353887 5.769899       11.22952 
1 1 1 -19 16 34 o 52.70028 3.807222 35.39641       4.856458 29.20944       7.652085 39.56924       6.284292 45.45298 7.143874 55.09609 4.726193 -9.643105      8.565736 
1 1 1 -19 16 35 o 18.00129 6.813179 3.885278       4.099146 -3.257766      8.338408 6.161659       4.707214 17.40029 8.098520 21.04835 7.401020 -3.648060      10.97092 
1 1 1 -19 16 36 o 37.19205 5.551624 18.97497       4.877771 25.86690       9.263309 16.33087       5.737660 39.29150 9.726935 33.14180 7.301743 6.149704       12.16259 
1 1 1 -19 16 37 o 31.38304 5.578497 13.78197       4.109940 12.01733       6.438361 14.99559       5.339354 26.86825 8.653553 31.53143 7.118039 -4.663185      11.20493 
1 1 1 -19 16 38 o 28.36662 6.154844 11.81609       4.132094 7.114841       6.356816 15.25601       5.437594 21.43273 8.385801 31.31886 7.265594 -9.886137      11.09552 
1 1 1 -19 16 39 o 45.56602 5.088418 28.87221       5.553820 28.28809       7.442060 29.60641       8.343600 42.28270 7.497088 41.98457 8.447937 0.2981300      11.29486 
1 1 1 -19 16 40 o 27.13275 6.193264 11.17907       4.004475 15.44331       6.661527 8.766210       5.010931 29.00645 8.720313 22.74405 7.649477 6.262409       11.59993 
1 1 1 -19 17 1  o 23.00275 6.101701 6.755758       3.476026 5.059114       7.239429 7.264111       3.962704 23.73310 9.037549 23.88346 6.592748 -0.1503601     11.18667 
1 1 1 -19 17 2  o 124.9197 3.059741 190.6990       9.314331 188.9155       18.68330 191.2889       10.74481 123.6144 6.222247 125.0025 3.530848 -1.388130      7.154247 
1 1 1 -19 17 3  o 93.23634 3.008304 106.3245       6.826125 93.37268       13.27010 110.9847       7.960021 86.78708 6.317826 95.20522 3.436611 -8.418144      7.192025 
1 1 1 -19 17 4  o 109.3305 2.821684 146.0897       7.511432 147.9870       13.33990 145.2088       9.089316 109.6811 5.004151 108.9208 3.428669 0.7602844      6.066078 
1 1 1 -19 17 5  o 122.0030 2.838981 181.7985       8.440520 203.8038       15.35492 172.2702       10.10398 128.7792 4.901842 118.6381 3.498703 10.14108       6.022374 
1 1 1 -19 17 6  o 192.7235 3.257371 453.9812       15.29811 484.3907       26.15231 438.1630       18.86186 198.4550 5.412745 189.1650 4.091737 9.290085       6.785287 
1 1 1 -19 17 7  o 274.3362 4.621559 922.8011       30.89639 927.6254       44.37359 918.2615       43.04488 274.1367 6.642344 272.8375 6.474131 1.299194       9.275511 
1 1 1 -19 17 8  o 83.36086 2.809403 84.96438       5.698905 85.69324       10.44208 84.65519       6.801095 83.37717 5.164649 83.14649 3.363536 0.2306824      6.163358 
1 1 1 -19 17 9  o 163.7950 3.523962 328.1122       14.06592 348.6106       20.99440 311.4167       18.94717 168.4108 5.121562 159.2271 4.888844 9.183746       7.080338 
1 1 1 -19 17 10 f 197.9271 4.178823 479.8676       20.15558 479.8177       36.07545 479.8903       24.30240 196.6082 7.543634 197.6281 5.050337 -1.019974      9.078123 
1 1 1 -19 17 11 o 104.4384 3.093390 133.4114       7.864156 144.7312       12.80168 126.5505       9.966393 108.4852 4.854696 101.5775 4.034309 6.907700       6.312189 
1 1 1 -19 17 12 o 240.8251 4.168557 710.5744       24.46378 740.2439       36.61301 686.6449       32.88112 244.9401 6.138778 236.1644 5.713419 8.775696       8.386165 
1 1 1 -19 17 13 o 121.7947 2.747260 181.1931       8.153879 207.0033       15.09050 170.5503       9.690250 129.7688 4.780133 118.0419 3.372158 11.72682       5.849882 
1 1 1 -19 17 14 o 70.74459 2.813672 61.24208       4.841006 72.84718       9.972483 57.66424       5.537186 76.76254 5.364884 68.58469 3.322922 8.177849       6.310609 
1 1 1 -19 17 15 o 87.27306 2.963447 93.20358       6.293366 76.15505       16.08064 96.28710       6.838859 77.57911 8.653086 88.67947 3.169739 -11.10036      9.215375 
1 1 1 -19 17 16 o 119.8420 2.759593 175.5035       8.059167 167.5799       14.40304 179.1151       9.723909 116.5946 5.081402 120.9486 3.302254 -4.353996      6.060160 
1 1 1 -19 17 17 o 83.97092 2.713948 86.26101       5.546203 92.47862       10.75885 84.01074       6.472490 86.51099 5.126368 82.79992 3.213889 3.711075       6.050515 
1 1 1 -19 17 18 o 89.51560 2.727004 98.04333       5.941743 92.04742       11.21411 100.3836       7.005992 86.21316 5.364289 90.51097 3.181326 -4.297813      6.236701 
1 1 1 -19 17 19 f 62.33974 3.426745 47.75770       5.185721 44.89042       9.281560 49.05894       6.252666 59.77627 6.474974 63.07346 4.090070 -3.297188      7.658587 
1 1 1 -19 17 20 f 72.76359 3.182665 64.97644       5.629754 71.50160       10.06677 62.00700       6.790977 75.81849 5.485622 70.94109 3.943764 4.877396       6.756132 
1 1 1 -19 17 21 o 26.95694 6.031496 9.384285       3.862957 -8.971952      9.768240 12.78718       4.205802 18.45844 8.648042 31.64984 5.660898 -13.19140      10.33607 
1 1 1 -19 17 22 o 29.09184 5.286554 10.80543       3.609824 14.97043       7.381575 9.496282       4.138444 33.60633 8.881114 27.04223 6.383233 6.564093       10.93709 
1 1 1 -19 17 23 o 106.7454 3.024630 139.8496       7.859943 138.7415       12.84157 140.5133       9.939189 105.6611 5.001512 106.7672 3.826306 -1.106094      6.297280 
1 1 1 -19 17 24 o 79.78537 3.088131 78.27149       5.992861 66.76836       10.18197 84.36859       7.412853 72.84190 5.783513 82.68166 3.688372 -9.839752      6.859527 
1 1 1 -19 17 25 o 30.57002 5.156640 11.95776       3.704946 10.84435       7.537788 12.31244       4.254313 28.85643 9.369102 30.83512 5.876180 -1.978689      11.05937 
1 1 1 -19 17 26 o 75.89132 3.112499 70.99399       5.744005 76.29123       10.09569 68.45843       6.984715 77.81561 5.356620 74.28731 3.871679 3.528305       6.609333 
1 1 1 -19 17 27 o 55.51285 3.384783 38.19143       4.557129 49.72704       8.281967 33.18208       5.457629 62.56715 5.487391 51.42699 4.397032 11.14016       7.031738 
1 1 1 -19 17 28 o 17.61432 6.158921 3.627786       3.256806 10.14934       6.306014 1.255527       3.803298 27.37970 8.533405 15.37553 6.320383 12.00417       10.61915 
1 1 1 -19 17 29 o 21.37557 6.390197 6.033564       3.584703 9.108915       6.408201 4.632938       4.324638 26.02579 8.648639 19.79834 7.080810 6.227448       11.17751 
1 1 1 -19 17 30 o 14.58579 6.325936 -0.5555207E-01 4.160387 0.3853287      5.564310 -0.6144975     6.265207 16.99443 7.343220 17.22338 7.607648 -0.2289486     10.57351 
1 1 1 -19 17 31 o 10.00667 4.774968 -3.940472      3.245740 -7.715062      5.428358 -1.840105      4.049311 12.26203 5.933243 12.93927 5.881561 -0.6772470     8.354407 
1 1 1 -19 17 32 o 25.50001 5.980133 8.907296       3.651343 8.557035       6.100657 9.102801       4.557851 24.60439 8.438200 25.38176 7.094824 -0.7773743     11.02451 
1 1 1 -19 17 33 o 43.89810 4.160848 24.78526       4.397926 26.76229       7.248569 23.63349       5.532624 43.63159 7.058232 42.03489 5.535543 1.596699       8.969999 
1 1 1 -19 17 34 o 39.37268 4.645436 20.34883       4.371439 23.39650       7.299935 18.64490       5.458334 39.88644 7.789855 36.58149 6.353363 3.304947       10.05222 
1 1 1 -19 17 35 o 42.02555 5.094727 23.67392       5.111176 21.85609       11.27518 24.14408       5.734186 33.87050 11.47445 41.93525 5.763500 -8.064747      12.84060 
1 1 1 -19 17 36 o 45.10009 4.657137 27.08486       5.044849 27.12235       9.404083 27.06971       5.977804 39.77147 9.773868 44.21203 5.679388 -4.440556      11.30416 
1 1 1 -19 17 37 o 47.32148 4.215384 29.59216       4.810236 35.52978       7.649806 25.70912       6.186295 49.39323 6.514098 42.28752 6.186178 7.105705       8.983444 
1 1 1 -19 17 38 o 36.35964 5.092236 18.37584       4.388411 20.43306       7.055693 17.07794       5.604303 34.83724 8.407935 33.12957 7.151593 1.707664       11.03805 
1 1 1 -19 17 39 o 15.78472 6.313347 2.931625       3.676892 6.349506       6.227331 1.102332       4.555805 20.22449 8.171755 14.92150 6.542699 5.302985       10.46826 
1 1 1 -19 17 40 o 19.44604 6.816139 5.935349       3.990493 5.282307       6.302123 6.372418       5.155744 19.12740 8.021631 19.88852 7.613780 -0.7611217     11.05967 
1 1 1 -19 18 1  o 155.2505 3.270756 294.8187       12.37421 297.5931       24.55562 293.8744       14.32619 154.9613 6.517218 154.8979 3.795326 0.6341553E-01  7.541792 
1 1 1 -19 18 2  f 185.9659 3.556037 423.2539       16.11520 483.6324       34.19027 406.0090       18.27220 197.3556 7.120809 182.0002 4.119864 15.35545       8.226737 
1 1 1 -19 18 3  o 138.5957 3.158301 234.8499       10.66693 258.2022       22.37587 227.9822       12.13451 144.4335 6.373035 136.4274 3.653217 8.006134       7.345854 
1 1 1 -19 18 4  o 56.77456 3.376181 39.56311       4.649968 43.14331       10.49938 38.68954       5.186334 58.49398 7.541012 56.08464 3.817482 2.409332       8.452221 
1 1 1 -19 18 5  o 90.54393 3.130298 100.3347       6.896479 100.9799       11.48937 99.97140       8.622610 90.47787 5.233291 90.26479 3.929398 0.2130814      6.544272 
1 1 1 -19 18 6  o 46.86626 3.756179 27.05708       4.253969 35.80906       8.044217 23.65937       5.012146 53.51059 6.288811 43.64445 4.791263 9.866138       7.906033 
1 1 1 -19 18 7  o 192.9905 4.235200 456.4978       19.91801 453.0753       25.71496 461.6305       31.49143 191.8000 5.507458 193.1096 6.702106 -1.309616      8.674694 
1 1 1 -19 18 8  o 192.3419 3.673054 452.7831       17.21619 469.7004       26.02638 439.6216       22.95634 195.2981 5.474044 189.1077 4.985818 6.190430       7.404292 
1 1 1 -19 18 9  o 142.6940 4.711986 250.2040       16.36251 269.2195       23.91375 233.4646       22.43695 147.4057 6.674602 137.2291 6.729892 10.17665       9.478490 
1 1 1 -19 18 10 o 61.15900 3.102820 45.84066       4.609265 43.43327       8.811150 46.74765       5.408281 59.00383 6.221510 61.69968 3.612807 -2.695843      7.194412 
1 1 1 -19 18 11 o 97.27407 2.771712 115.6935       6.563542 118.1746       12.05149 114.6472       7.826041 97.91842 5.067812 96.75930 3.323982 1.159119       6.060658 
1 1 1 -19 18 12 o 57.43509 3.147639 40.45640       4.388689 47.90020       9.088003 38.19256       5.011807 62.00195 6.093519 55.72777 3.711668 6.274181       7.134946 
1 1 1 -19 18 13 o 127.4428 2.799036 198.4736       8.692805 196.5847       15.41999 199.3536       10.52455 126.3316 5.018814 127.5944 3.387820 -1.262779      6.055230 
1 1 1 -19 18 14 o 109.0618 2.744133 145.4442       7.287339 156.2161       13.66135 141.1600       8.615446 112.5768 4.992178 107.3577 3.297036 5.219093       5.982666 
1 1 1 -19 18 15 o 35.71239 4.310525 15.87990       3.675536 35.97068       13.08132 14.15783       3.829821 52.28767 10.62901 33.59724 4.815251 18.69042       11.66886 
1 1 1 -19 18 16 o 83.34569 2.760705 85.01327       5.599374 97.19718       11.00101 80.75314       6.505044 88.66775 5.113010 81.15146 3.296269 7.516289       6.083441 
1 1 1 -19 18 17 o 106.6060 2.735737 139.0488       7.101225 125.6705       12.73160 145.0903       8.555696 100.7944 5.200937 108.8110 3.230187 -8.016609      6.122406 
1 1 1 -19 18 18 o 62.00197 2.931870 47.14769       4.417274 58.55194       9.354674 43.87518       5.011136 68.54808 5.650246 59.72876 3.457618 8.819324       6.624228 
1 1 1 -19 18 19 o 168.6266 4.830785 351.2225       19.83043 371.4869       31.07725 337.3041       25.75540 171.8473 7.438639 164.3846 6.441882 7.462708       9.840284 
1 1 1 -19 18 20 o 56.72712 3.729143 39.70464       5.126496 51.85792       12.22207 37.10996       5.647287 63.55223 8.073819 54.72651 4.268271 8.825714       9.132617 
1 1 1 -19 18 21 o 74.20100 3.119076 67.63414       5.627327 75.34553       10.08635 64.14900       6.780746 77.72717 5.357847 72.10072 3.873459 5.626450       6.611370 
1 1 1 -19 18 22 o 32.89388 4.705810 13.65392       3.664771 5.748742       7.190396 16.42808       4.259546 23.91353 9.029707 36.07200 4.978297 -12.15846      10.31111 
1 1 1 -19 18 23 o 35.06189 4.482515 15.45982       3.742471 24.31172       7.580145 12.60658       4.303567 43.14938 7.479805 31.25621 5.865479 11.89316       9.505331 
1 1 1 -19 18 24 o 100.5073 3.044737 124.2496       7.448734 138.6265       12.71765 116.7423       9.189984 105.3603 4.967274 97.13190 3.890418 8.228416       6.309450 
1 1 1 -19 18 25 o 27.81703 5.851170 10.10102       3.840419 32.51202       11.13084 7.072655       4.091674 48.64185 9.730431 23.27247 6.793829 25.36937       11.86749 
1 1 1 -19 18 26 o 25.26064 5.846306 8.390491       3.527547 16.09577       7.236165 5.988562       4.040120 34.22405 8.668371 21.62215 6.843254 12.60190       11.04404 
1 1 1 -19 18 27 o 26.46893 5.523260 9.184095       3.447251 17.44441       6.852364 6.385180       3.988752 35.70293 8.066693 22.09985 6.769533 13.60308       10.53082 
1 1 1 -19 18 28 o 68.66912 3.185406 58.47562       5.315908 68.56145       9.367615 53.68494       6.456132 73.28375 5.280894 65.42854 4.069342 7.855217       6.666887 
1 1 1 -19 18 29 o 28.21361 8.559071 11.21668       6.396813 11.21668       6.396813 0.000000       0.000000 28.21361 8.559071 ?        ?        0.000000       8.559071 
1 1 1 -19 18 30 o 23.24327 7.270097 7.385172       4.572799 5.851942       5.923913 9.645785       7.193133 21.99049 8.218680 26.28905 9.155664 -4.298559      12.30337 
1 1 1 -19 18 31 o 43.26808 4.024489 23.85855       4.194754 25.10722       6.828438 23.10174       5.316091 42.78535 6.774608 41.89960 5.326751 0.8857498      8.617981 
1 1 1 -19 18 32 o 29.38364 5.609945 11.69849       3.870513 8.090819       6.083267 14.15231       5.017009 23.88576 8.412299 31.77205 6.691561 -7.886290      10.74913 
1 1 1 -19 18 33 o 40.82001 4.444628 21.69410       4.349930 17.33180       6.823989 24.67992       5.645636 33.82821 8.333315 42.84667 5.536326 -9.018459      10.00475 
1 1 1 -19 18 34 f 42.45953 4.415418 23.58274       4.501952 20.62582       7.389598 25.32800       5.677151 36.52427 8.467607 43.22470 5.515118 -6.700428      10.10529 
1 1 1 -19 18 35 o 30.58807 6.414109 13.47913       4.628078 8.829406       8.709007 15.30895       5.463353 23.99327 9.674746 32.04692 7.174815 -8.053646      12.04486 
1 1 1 -19 18 36 o 30.55483 5.991900 13.37537       4.301995 17.60711       6.916726 10.70552       5.493958 32.65319 8.581641 25.81120 7.951866 6.841999       11.69943 
1 1 1 -19 18 37 o 13.82480 5.983023 0.7922703      3.705419 -2.189404      6.025880 2.605236       4.698781 14.73891 6.868126 16.53267 6.929500 -1.793756      9.756491 
1 1 1 -19 18 38 o 17.22749 6.874637 3.773099       4.349681 0.1737988      5.775641 8.489563       6.611492 15.60136 7.064871 22.25344 8.595240 -6.652080      11.12612 
1 1 1 -19 18 39 o 19.65676 6.655622 6.013282       3.793445 8.015368       6.519947 4.988709       4.664167 21.49779 8.468201 18.44848 7.193244 3.049314       11.11095 
1 1 1 -19 19 1  o 40.08792 4.728743 20.02798       4.530713 23.28876       8.994976 18.91945       5.244596 42.26444 9.009027 38.74323 5.727332 3.521217       10.67543 
1 1 1 -19 19 2  o 105.9395 3.333389 137.4912       8.594865 122.6732       15.58197 143.9711       10.30417 99.30860 6.474010 108.3005 3.910751 -8.991905      7.563516 
1 1 1 -19 19 3  o 99.69395 3.270356 121.7342       7.934359 136.8739       15.32519 116.1899       9.274071 105.0859 6.009521 97.28326 3.920003 7.802628       7.175010 
1 1 1 -19 19 4  o 19.09038 6.401015 4.247658       3.508950 0.000000       0.000000 4.247658       3.508950 ?        ?        19.09038 6.401015 0.000000       6.401015 
1 1 1 -19 19 5  o 122.0146 2.835067 181.9469       8.429683 204.9599       15.49354 172.2701       10.04688 129.0137 4.937201 118.5844 3.480467 10.42925       6.040662 
1 1 1 -19 19 6  o 104.3708 2.799761 133.2130       7.114487 112.3130       12.22053 143.9283       8.750221 95.37114 5.278791 108.4120 3.316016 -13.04082      6.233908 
1 1 1 -19 19 7  o 28.14101 5.041107 10.02848       3.330050 16.84305       7.383739 8.288496       3.731043 35.99395 8.546264 25.40512 6.103135 10.58883       10.50176 
1 1 1 -19 19 8  o 85.87740 3.000340 90.27280       6.269280 75.16051       13.41674 94.49419       7.091040 77.47745 7.188135 87.82031 3.319413 -10.34286      7.917562 
1 1 1 -19 19 9  o 150.7654 2.952847 277.8759       10.84872 297.5120       19.11761 268.5492       13.17565 155.4255 5.054205 148.0839 3.651138 7.341675       6.235046 
1 1 1 -19 19 10 o 67.03645 3.721013 55.21688       6.054816 49.98323       9.419204 58.90238       7.904249 63.29159 6.185942 69.07224 4.724367 -5.780651      7.783669 
1 1 1 -19 19 11 o 85.97635 2.787098 90.43947       5.831671 104.5474       11.23957 85.24243       6.821751 92.03416 5.030591 83.38731 3.363970 8.646851       6.051706 
1 1 1 -19 19 12 o 89.43135 2.800163 97.86054       6.095001 101.5727       11.44738 96.39182       7.200491 90.65446 5.203666 88.67877 3.337969 1.975685       6.182246 
1 1 1 -19 19 13 o 142.4064 2.898191 247.9870       10.05756 257.5470       17.74137 243.4598       12.20892 144.5138 5.045551 140.9281 3.557878 3.585724       6.173823 
1 1 1 -19 19 14 o 50.58920 3.282622 31.46402       4.024977 30.83343       8.233089 31.66207       4.613935 49.29280 7.054915 50.67824 3.762910 -1.385437      7.995707 
1 1 1 -19 19 15 o 69.44037 3.119261 59.14164       5.264894 77.66644       15.25408 56.63641       5.609612 78.24489 8.117896 67.90820 3.400624 10.33669       8.801391 
1 1 1 -19 19 16 f 90.27972 2.755390 99.78333       6.054813 93.99471       11.34045 102.0914       7.160887 87.03667 5.372970 91.23888 3.225780 -4.202209      6.266934 
1 1 1 -19 19 17 o 40.67859 4.469134 20.61900       4.357343 25.58990       10.45346 19.57368       4.793644 43.84221 10.00569 39.48764 5.100626 4.354565       11.23077 
1 1 1 -19 19 18 o 98.06705 3.359550 118.0957       8.016754 128.8073       17.26122 115.1497       9.052280 101.1215 7.048870 96.71748 3.848441 4.404053       8.031006 
1 1 1 -19 19 19 f 93.13449 3.179074 106.4929       7.204605 120.9554       12.23560 98.81732       8.913700 98.68981 5.104997 89.48587 4.098474 9.203941       6.546639 
1 1 1 -19 19 20 o 37.99689 3.834791 17.94525       3.502264 7.478406       7.698570 20.67671       3.932784 25.91429 9.423710 40.77782 4.009469 -14.86352      10.24120 
1 1 1 -19 19 21 o 29.35619 4.591187 10.91208       3.176908 7.958329       7.115629 11.64744       3.550416 25.91274 9.100429 30.25526 4.989266 -4.342518      10.37837 
1 1 1 -19 19 22 f 57.49412 3.082632 40.71674       4.303189 34.67447       9.051314 42.48127       4.891331 51.70795 7.393412 58.65413 3.437161 -6.946178      8.153318 
1 1 1 -19 19 23 o 58.27303 3.429913 41.97637       4.849110 51.89665       9.240335 38.20614       5.696524 63.92825 6.001610 55.36878 4.254507 8.559471       7.356640 
1 1 1 -19 19 24 o 19.94964 6.269930 5.033727       3.397060 0.9737348E-01  6.963511 6.575402       3.891541 19.00009 8.212320 22.48433 6.642422 -3.484245      10.56238 
1 1 1 -19 19 25 o 13.90295 5.860465 0.4674443      3.390858 7.256395       10.01552 -0.4114714     3.603675 26.65685 10.49705 13.45736 5.861463 13.19949       12.02268 
1 1 1 -19 19 26 o 17.77572 6.272889 3.657607       3.383809 -3.663598      6.404687 6.492555       3.985466 15.85241 7.277864 22.25006 6.757156 -6.397653      9.931086 
1 1 1 -19 19 27 o 48.65389 3.767140 29.64086       4.431711 29.23713       8.052817 29.81626       5.307775 46.66343 7.322455 48.50636 4.543193 -1.842930      8.617364 
1 1 1 -19 19 28 o 26.79787 7.169839 9.872495       4.773794 11.42032       6.645940 8.222608       6.861550 28.43535 8.743315 25.06636 8.924098 3.368988       12.49340 
1 1 1 -19 19 29 o 55.77385 6.012941 41.02435       8.043485 41.02435       8.043485 0.000000       0.000000 55.77385 6.012941 ?        ?        0.000000       6.012941 
1 1 1 -19 19 30 o 18.13162 6.427301 4.045568       3.555712 2.810572       5.829017 4.777448       4.487270 18.93879 7.808916 19.72894 7.191590 -0.7901478     10.61594 
1 1 1 -19 19 31 o 34.08670 4.971600 15.32505       4.008149 15.01375       6.532740 15.51298       5.075807 31.72177 8.341558 33.47509 6.456222 -1.753325      10.54819 
1 1 1 -19 19 32 o 15.90483 6.317029 2.369974       3.655838 2.355750       6.205660 2.377534       4.524271 18.60202 7.888792 16.90540 6.915072 1.696623       10.49053 
1 1 1 -19 19 33 o 17.85815 6.596578 3.964355       3.795367 -4.887275      6.179527 9.325863       4.809359 14.21210 6.725763 25.09698 7.376410 -10.88488      9.982350 
1 1 1 -19 19 34 o 44.69140 5.481215 27.24449       5.844643 0.000000       0.000000 27.24449       5.844643 ?        ?        44.69140 5.481215 0.000000       5.481215 
1 1 1 -19 19 35 o 24.28260 6.723203 8.816534       4.114159 15.95968       6.832795 4.753906       5.152966 31.01882 8.692731 19.18372 7.536924 11.83510       11.50516 
1 1 1 -19 19 36 o 14.80532 6.227850 1.638944       3.816651 -0.8690427E-01 6.437272 2.574507       4.739551 16.34179 7.423284 16.60972 6.960493 -0.2679291     10.17613 
1 1 1 -19 19 37 o 21.26767 6.719955 6.988186       3.897296 6.692177       6.622802 7.144992       4.820274 20.82284 8.422308 21.19534 7.486230 -0.3725071     11.26849 
1 1 1 -19 19 38 o 40.94894 5.504937 24.01915       5.354248 23.31490       7.476069 24.76076       7.671824 36.66025 8.529440 37.84688 8.523818 -1.186630      12.05847 
1 1 1 -19 20 1  o 73.61671 3.028467 66.43495       5.421345 50.60259       10.59410 72.05189       6.310165 63.35068 6.977843 76.61360 3.388241 -13.26292      7.756962 
1 1 1 -19 20 2  o 64.44435 3.140825 50.95431       4.917618 56.11430       10.26660 49.41794       5.602085 66.94877 6.369509 63.38717 3.642037 3.561600       7.337239 
1 1 1 -19 20 3  o 69.35641 3.477946 59.07756       5.859459 0.000000       0.000000 59.07756       5.859459 ?        ?        69.35641 3.477946 0.000000       3.477946 
1 1 1 -19 20 4  o 47.25483 3.968153 27.58636       4.527352 0.000000       0.000000 27.58636       4.527352 ?        ?        47.25483 3.968153 0.000000       3.968153 
1 1 1 -19 20 5  o 84.92835 3.030006 88.34767       6.260887 80.86694       13.17429 90.53008       7.115787 80.39340 6.788033 85.91338 3.405550 -5.519974      7.594417 
1 1 1 -19 20 6  o 121.1071 2.852924 179.3397       8.419689 191.5105       15.21555 173.9681       10.10838 124.5923 5.021703 119.1263 3.485822 5.466019       6.112974 
1 1 1 -19 20 7  o 65.37330 3.104043 52.40616       4.930851 49.95835       9.552896 53.29517       5.757042 63.19795 6.286176 65.85474 3.601075 -2.656792      7.244567 
1 1 1 -19 20 8  o 90.03948 3.441988 99.43486       7.538377 110.6003       11.80127 91.73865       9.797833 94.59498 5.138762 86.23556 4.679916 8.359421       6.950431 
1 1 1 -19 20 9  o 77.90357 2.890972 74.32183       5.478773 73.82568       10.25204 74.52017       6.482017 77.13904 5.489684 77.92908 3.421642 -0.7900391     6.468714 
1 1 1 -19 20 10 f 133.4846 2.862323 217.9078       9.310774 213.1391       15.99890 220.3500       11.44934 131.4265 5.004553 134.0615 3.507628 -2.635010      6.111383 
1 1 1 -19 20 11 o 44.09739 3.686171 24.00591       3.924973 34.95361       8.066175 20.60959       4.492734 52.69490 6.413422 40.67438 4.614090 12.02052       7.900747 
1 1 1 -19 20 12 o 41.65887 4.885171 21.66943       4.865229 26.17115       8.040668 19.06932       6.110819 45.16641 7.573163 38.61756 6.738462 6.548847       10.13704 
1 1 1 -19 20 13 o 65.58661 2.989766 52.75557       4.765899 48.87037       9.095356 54.22607       5.595599 62.48484 6.048781 66.42234 3.468998 -3.937496      6.972927 
1 1 1 -19 20 14 o 75.00603 3.093858 69.01150       5.642860 75.17918       15.36318 68.04967       6.066917 76.74456 8.349236 74.43697 3.353202 2.307587       8.997427 
1 1 1 -19 20 15 o 19.63175 6.563250 4.560840       3.689400 -0.2096118E-02 9.382526 5.395415       4.012641 22.21531 9.566834 21.05920 6.835703 1.156113       11.75803 
1 1 1 -19 20 16 o 64.61319 3.594325 51.41490       5.637152 71.44891       13.31202 47.03739       6.222619 75.04333 7.374552 61.67815 4.164465 13.36518       8.469167 
1 1 1 -19 20 17 o 83.81641 2.861412 86.14342       5.835906 79.73410       10.90938 88.71282       6.907316 79.90208 5.639031 84.96129 3.342724 -5.059204      6.555339 
1 1 1 -19 20 18 o 45.44439 3.465621 25.51286       3.808986 28.16686       8.090940 24.75719       4.317330 46.72633 7.347911 44.65820 4.009785 2.068127       8.370793 
1 1 1 -19 20 19 o 59.96811 3.408257 44.33456       4.960176 52.95921       9.043726 40.62392       5.931997 64.88897 5.779691 57.19800 4.287018 7.690968       7.196065 
1 1 1 -19 20 20 o 63.15110 2.962924 49.04576       4.547000 64.84399       9.712946 44.61181       5.145672 71.83904 5.592251 60.10413 3.528715 11.73491       6.612496 
1 1 1 -19 20 21 o 28.54333 4.674800 10.36888       3.139188 18.52375       7.621715 8.702858       3.444960 37.10232 8.598139 25.88671 5.622298 11.21561       10.27318 
1 1 1 -19 20 22 o 61.58535 2.987075 46.72705       4.469536 44.58738       9.113056 47.40475       5.128749 58.98667 6.444506 61.92830 3.411674 -2.941624      7.291857 
1 1 1 -19 20 23 o 55.22232 3.079031 37.65833       4.127070 28.77577       8.427251 40.46081       4.733559 46.60387 7.688267 57.16060 3.413799 -10.55673      8.412103 
1 1 1 -19 20 24 o 35.11110 4.758945 15.69392       3.967117 14.99108       7.659394 15.95159       4.637647 32.84792 9.202880 35.12416 5.606597 -2.276237      10.77622 
1 1 1 -19 20 25 o 61.02339 3.409915 46.24051       5.050627 45.50053       8.811427 46.60260       6.163645 59.28499 6.190200 60.98067 4.172866 -1.695683      7.465346 
1 1 1 -19 20 26 o 74.76772 3.225857 69.35066       5.863709 60.70273       9.800319 74.17271       7.318123 68.50042 5.929311 77.00819 3.912481 -8.507774      7.103818 
1 1 1 -19 20 27 o 20.57391 7.352723 5.150928       4.662269 0.7300922E-01  6.134389 12.09553       7.173850 17.52363 7.639791 29.12790 9.105242 -11.60427      11.88578 
1 1 1 -19 20 28 o 12.59591 5.697161 -1.558208      3.742665 -1.189727      6.245136 -1.764716      4.675233 16.72228 7.477988 14.07834 6.367604 2.643936       9.821746 
1 1 1 -19 20 29 o 30.94945 5.369698 12.72956       3.903078 9.396708       6.569399 14.54788       4.852348 25.67574 8.757682 32.64885 6.327360 -6.973106      10.80428 
1 1 1 -19 20 30 o 56.00234 3.696920 39.72995       5.017025 32.82735       8.133662 43.96902       6.374043 48.50956 7.089939 58.39026 4.514633 -9.880695      8.405304 
1 1 1 -19 20 31 o 44.06329 4.213374 25.04704       4.469175 29.56192       7.418635 22.47513       5.599242 45.98484 6.827160 40.74181 5.803558 5.243031       8.960546 
1 1 1 -19 20 32 o 18.56208 6.637928 4.484881       3.800463 8.454461       6.513309 2.435725       4.679688 23.91579 8.672163 17.01584 7.004467 6.899950       11.14760 
1 1 1 -19 20 33 o 12.96430 5.874012 -1.205204      3.999398 9.673805       8.058670 -4.760312      4.606754 24.80626 9.513234 11.89061 5.678003 12.91565       11.07887 
1 1 1 -19 20 34 o 14.70233 6.440692 0.4699568      4.405821 -0.2210863     9.779531 0.6459291      4.935006 19.29280 8.906378 15.49044 6.800330 3.802358       11.20572 
1 1 1 -19 20 35 o 30.27604 6.196881 13.36710       4.417896 8.723515       6.963037 16.49602       5.715699 23.05513 8.842606 32.64515 7.361053 -9.590019      11.50551 
1 1 1 -19 20 36 o 11.92922 5.504309 -1.637531      3.728607 -8.882581      6.004900 2.908549       4.756677 12.01652 5.905460 16.79155 7.000195 -4.775030      9.158449 
1 1 1 -19 20 37 f 49.61245 5.061868 34.28267       6.034156 35.30740       8.272790 33.11771       8.820709 47.21730 7.435396 44.20155 8.497589 3.015751       11.29133 
1 1 1 -19 21 1  o 64.62980 3.102179 51.29006       4.871534 60.61101       10.20881 48.54178       5.543390 69.54970 6.084646 62.77820 3.639117 6.771496       7.089859 
1 1 1 -19 21 2  o 101.4710 3.010231 126.1904       7.435283 132.2080       15.32997 124.3394       8.502274 102.9321 6.139493 100.6265 3.472465 2.305557       7.053467 
1 1 1 -19 21 3  o 42.45530 3.787638 22.30144       3.877542 11.27461       8.500103 25.19907       4.357328 30.11873 9.959077 45.11117 4.005285 -14.99243      10.73431 
1 1 1 -19 21 4  o 26.80932 5.729748 9.235553       3.629774 0.000000       0.000000 9.235553       3.629774 ?        ?        26.80932 5.729748 0.000000       5.729748 
1 1 1 -19 21 5  o 135.7355 3.149713 225.6347       10.41839 217.3198       21.32154 228.2426       11.94099 131.8992 6.654963 136.3661 3.596473 -4.466904      7.564599 
1 1 1 -19 21 6  o 50.08755 3.513709 30.90883       4.261553 21.68818       8.091758 34.44792       5.013121 40.76554 8.424133 52.82217 3.922532 -12.05663      9.292592 
1 1 1 -19 21 7  o 75.68614 2.958088 70.21512       5.445358 80.78127       10.63888 66.46446       6.338567 80.63948 5.445864 73.53686 3.547586 7.102623       6.499446 
1 1 1 -19 21 8  o 89.13595 3.491355 97.56255       7.569065 89.21222       11.26610 104.4327       10.21890 84.74407 5.484882 91.97511 4.573644 -7.231041      7.141579 
1 1 1 -19 21 9  o 116.8446 2.845774 167.0561       8.102989 184.3548       14.80572 159.6591       9.681634 122.1151 4.985840 114.0555 3.487440 8.059555       6.084476 
1 1 1 -19 21 10 o 28.16122 5.292543 10.11496       3.498742 0.6419108E-01  6.877413 13.62443       4.063927 19.21628 8.231593 32.80471 5.261430 -13.58843      9.769430 
1 1 1 -19 21 11 o 57.18932 3.265517 40.21333       4.532043 27.74470       8.386076 45.35722       5.386362 46.41350 7.683000 60.68097 3.659570 -14.26747      8.510050 
1 1 1 -19 21 12 o 110.1520 3.049171 148.7381       8.176970 139.8444       17.69687 151.1523       9.220241 105.4872 6.922568 110.9584 3.413997 -5.471138      7.718634 
1 1 1 -19 21 13 o 51.68721 5.609111 33.52519       6.951888 33.73305       11.25004 33.39678       8.842137 50.57698 9.475887 51.08279 7.311320 -0.5058098     11.96862 
1 1 1 -19 21 14 o 34.69764 5.944886 15.38486       4.845913 0.000000       0.000000 15.38486       4.845913 ?        ?        34.69764 5.944886 0.000000       5.944886 
1 1 1 -19 21 15 o 99.56647 2.798116 121.5056       6.782410 121.6271       12.58619 121.4559       8.051444 98.89135 5.241476 99.42506 3.327777 -0.5337143     6.208637 
1 1 1 -19 21 16 o 86.39308 2.811652 91.53627       5.911503 100.9921       11.57342 88.19842       6.876161 90.02138 5.299136 84.68856 3.338388 5.332817       6.263041 
1 1 1 -19 21 17 o 86.75572 2.806219 92.34148       5.924942 87.32203       11.16632 94.30849       6.990116 83.54195 5.515769 87.56583 3.281577 -4.023880      6.418135 
1 1 1 -19 21 18 o 43.56313 4.407536 23.71324       4.614676 28.42154       8.404974 21.68147       5.521300 46.68207 7.653376 41.30741 5.631506 5.374660       9.502001 
1 1 1 -19 21 19 o 49.72802 3.285953 30.54547       3.959657 28.85373       8.316850 31.04134       4.502728 47.01262 7.512275 50.03722 3.719318 -3.024597      8.382577 
1 1 1 -19 21 20 o 35.18821 4.034740 15.51124       3.397279 18.61173       7.847531 14.79615       3.768737 37.05400 8.818874 34.20607 4.640820 2.847931       9.965428 
1 1 1 -19 21 21 o 53.85144 3.212447 35.84054       4.196537 33.94715       8.967266 36.37149       4.748626 50.87779 7.453635 54.14816 3.619506 -3.270370      8.285982 
1 1 1 -19 21 22 o 66.03093 2.939674 53.76134       4.718377 47.91478       9.228966 55.83035       5.490138 61.04232 6.294345 67.16988 3.364788 -6.127560      7.137267 
1 1 1 -19 21 23 o 36.63408 3.947211 16.85878       3.468256 18.47781       7.633367 16.43760       3.893325 36.55869 8.695559 35.99623 4.539134 0.5624580      9.809000 
1 1 1 -19 21 24 o 67.22042 3.190537 55.98327       5.211465 33.97848       12.84136 60.32211       5.702155 47.91492 11.19980 69.71757 3.366247 -21.80265      11.69475 
1 1 1 -19 21 25 o 41.17023 3.696704 21.26611       3.669363 24.12147       7.759712 20.44374       4.164382 41.92620 7.884261 40.14837 4.324568 1.777832       8.992411 
1 1 1 -19 21 26 o 26.99359 7.476398 10.10341       5.086630 12.42668       7.034266 7.557072       7.364235 29.45372 8.983556 24.60192 9.169699 4.851801       12.83696 
1 1 1 -19 21 27 o 18.46568 6.495522 4.181536       3.626102 3.363051       6.265468 4.593753       4.446426 19.97531 8.150254 19.60549 7.156909 0.3698196      10.84657 
1 1 1 -19 21 28 o 32.73227 6.079875 14.51796       4.671129 18.03395       7.307887 12.08912       6.073904 34.95749 8.630971 28.78724 8.239885 6.170254       11.93270 
1 1 1 -19 21 29 o 57.41619 3.721018 41.77349       5.178296 43.35863       8.793140 40.93189       6.407159 56.35464 6.523241 56.18230 4.723529 0.1723442      8.053843 
1 1 1 -19 21 30 o 40.87045 4.466315 21.71577       4.375983 26.02732       7.096514 19.07048       5.558593 42.96845 7.019474 37.11694 6.375104 5.851509       9.482350 
1 1 1 -19 21 31 f 32.77990 5.419674 14.56736       4.178136 11.21004       6.706606 16.69688       5.341305 26.79259 8.845696 34.33732 6.623306 -7.544729      11.05054 
1 1 1 -19 21 32 o 23.39938 7.113807 8.085221       4.415678 -5.040235      8.306811 13.25487       5.213238 16.47600 7.797384 29.87197 7.238363 -13.39597      10.63923 
1 1 1 -19 21 33 o 9.861665 4.859345 -7.640337      4.155533 -1.621027      10.29533 -8.811863      4.541958 19.14502 8.939870 10.10560 4.998203 9.039426       10.24223 
1 1 1 -19 21 34 o 15.20651 6.311316 1.943655       3.841995 6.391273       6.433327 -0.5219438     4.789974 21.02561 8.370414 14.35833 6.474291 6.667274       10.58207 
1 1 1 -19 21 35 o 36.98125 5.110573 18.96591       4.482634 10.48198       7.123043 24.52907       5.768037 24.29859 9.025673 41.33812 5.892479 -17.03953      10.77887 
1 1 1 -19 21 36 o 17.53406 6.643765 4.255273       3.900400 -1.921588      6.422918 7.863821       4.909245 15.11911 7.060354 21.94625 7.567919 -6.827138      10.34998 
1 1 1 -19 21 37 o 15.05796 6.459691 1.728460       4.246663 1.291464       5.863461 2.210586       6.158792 16.20715 7.246877 17.01642 7.528257 -0.8092766     10.44949 
1 1 1 -19 22 1  o 113.2652 3.012031 157.3843       8.306274 153.0160       16.44561 158.8803       9.624045 110.5081 6.130917 113.6740 3.478337 -3.165947      7.048898 
1 1 1 -19 22 2  o 57.93823 3.216825 41.30246       4.523980 39.76777       9.505135 41.75194       5.143974 55.79441 7.155376 58.17356 3.646931 -2.379150      8.031159 
1 1 1 -19 22 3  f 109.2316 3.331471 146.5418       8.857526 142.9221       16.47450 148.0136       10.50506 106.7602 6.361220 109.6067 3.939420 -2.846474      7.482255 
1 1 1 -19 22 4  o 40.09818 4.334865 20.04265       4.168548 0.000000       0.000000 20.04265       4.168548 ?        ?        40.09818 4.334865 0.000000       4.334865 
1 1 1 -19 22 5  o 55.18262 3.489911 37.52715       4.668983 27.50014       10.31282 40.11225       5.236372 45.47468 9.607634 57.00229 3.791207 -11.52760      10.32860 
1 1 1 -19 22 6  o 144.5436 3.716221 256.8837       13.07905 0.000000       0.000000 256.8837       13.07905 ?        ?        144.5436 3.716221 0.000000       3.716221 
1 1 1 -19 22 7  o 137.4429 2.983422 231.4240       9.992473 241.0578       17.71629 226.9293       12.10100 139.4040 5.224327 135.8686 3.658148 3.535385       6.377746 
1 1 1 -19 22 8  o 90.59009 3.810351 101.0595       8.392878 79.29631       14.01088 113.2393       10.48153 79.05879 7.356852 95.70532 4.506863 -16.64653      8.627577 
1 1 1 -19 22 9  o 178.9370 4.012008 394.0416       17.49436 393.6601       31.96222 394.2048       20.90359 176.5805 7.444464 178.5254 4.809285 -1.944870      8.862803 
1 1 1 -19 22 10 o 84.33423 3.470855 87.46667       7.117827 95.28220       14.32236 84.90325       8.202474 86.91326 6.816779 82.94315 4.070584 3.970108       7.939656 
1 1 1 -19 22 11 o 73.96503 3.588070 67.37320       6.448013 66.47030       13.11720 67.66090       7.404373 72.17155 7.570849 73.99825 4.122406 -1.826706      8.620440 
1 1 1 -19 22 12 o 32.07592 4.968915 13.02770       3.758468 7.459749       7.387551 14.97216       4.365691 25.70428 9.247178 34.33010 5.396305 -8.625828      10.70656 
1 1 1 -19 22 13 o 98.67059 2.833402 119.3882       6.805846 114.5996       12.10886 121.5996       8.228567 95.94727 5.198277 99.44183 3.400623 -3.494568      6.211789 
1 1 1 -19 22 14 o 18.19054 6.479121 3.631057       3.617200 3.151016       10.81118 3.691568       3.838418 25.29162 10.54936 18.50840 6.664634 6.783218       12.47824 
1 1 1 -19 22 15 o 22.09986 6.770356 6.201550       3.989568 10.46707       7.290745 4.378350       4.766535 28.54550 9.209910 20.28358 7.409181 8.261915       11.82025 
1 1 1 -19 22 16 o 64.74838 3.491334 51.74332       5.488418 56.57036       9.869091 49.58202       6.603795 66.85132 6.126061 63.16384 4.316250 3.687477       7.493906 
1 1 1 -19 22 17 f 24.89588 5.604724 8.055068       3.318104 14.29499       7.696572 6.630559       3.677396 32.53924 9.263041 22.60205 6.392379 9.937187       11.25462 
1 1 1 -19 22 18 o 94.00201 3.250118 108.8761       7.433933 116.3256       12.41902 104.7163       9.280193 96.28725 5.313362 91.86256 4.156318 4.424690       6.745872 
1 1 1 -19 22 19 o 63.62515 3.052683 49.91263       4.719302 54.03252       9.607045 48.60225       5.418083 65.08151 6.129724 62.64861 3.563633 2.432903       7.090345 
1 1 1 -19 22 20 o 50.04160 3.343960 31.02959       4.054421 39.27747       9.050894 28.95902       4.534870 54.95302 6.911208 48.19107 3.894710 6.761951       7.933067 
1 1 1 -19 22 21 o 54.72895 3.183322 37.07214       4.227223 29.23071       8.397398 39.73367       4.892306 46.85729 7.615374 56.55509 3.568002 -9.697796      8.409790 
1 1 1 -19 22 22 o 19.51760 5.985171 4.907914       3.116884 3.950322       7.341763 5.118452       3.442517 21.96854 8.874155 19.99289 6.315532 1.975657       10.89204 
1 1 1 -19 22 23 o 32.65420 4.331084 13.57213       3.361545 23.78114       7.667428 11.14292       3.740158 41.76743 7.820481 29.17139 5.462032 12.59604       9.539063 
1 1 1 -19 22 24 o 50.54955 4.564156 32.45728       5.561796 18.50287       11.50207 36.71579       6.354028 34.82732 11.58730 53.61559 4.917929 -18.78827      12.58775 
1 1 1 -19 22 25 o 32.93713 5.331117 14.21570       4.132853 14.17757       6.959135 14.23648       5.136801 31.35291 8.767801 32.33689 6.737586 -0.9839821     11.05755 
1 1 1 -19 22 26 o 46.58176 3.588447 27.30607       4.042037 10.71920       7.143497 35.11772       4.902297 27.28901 9.132805 52.74121 3.840608 -25.45220      9.907492 
1 1 1 -19 22 27 o 29.49181 5.732768 11.73272       3.971602 9.573455       6.823081 12.83923       4.884343 25.81798 8.921096 30.35703 6.774551 -4.539051      11.20181 
1 1 1 -19 22 28 o 59.56062 4.254115 45.47816       6.133885 51.09930       8.700860 39.92432       8.648623 61.83710 5.843302 53.84693 6.738076 7.990177       8.918848 
1 1 1 -19 22 29 o 15.60840 6.261910 2.127990       3.628646 -2.484009      5.977455 4.819422       4.566290 15.25947 7.014930 19.55794 7.233583 -4.298471      10.07641 
1 1 1 -19 22 30 o 48.54877 4.111031 30.42390       4.818001 27.69281       7.750762 32.14380       6.150730 43.58029 7.572933 49.09464 5.221088 -5.514355      9.198319 
1 1 1 -19 22 31 o 13.63403 6.083859 -0.5551220     4.110181 -0.7593325     7.892313 -0.4791257     4.814611 17.94416 8.177733 14.70677 6.572052 3.237391       10.49129 
1 1 1 -19 22 32 o 9.229494 4.555295 -7.161903      3.703192 -8.542310      6.343457 -6.448245      4.561082 12.82183 6.251896 11.00844 5.352722 1.813392       8.230300 
1 1 1 -19 22 33 o 20.03802 7.162757 5.864830       4.424717 6.043262       10.61228 5.827285       4.868036 22.21151 9.851523 20.08260 7.461115 2.128908       12.35802 
1 1 1 -19 22 34 o 19.64977 6.811877 5.751318       3.979480 6.048703       6.615490 5.582692       4.981555 20.51390 8.372999 19.60648 7.489431 0.9074268      11.23382 
1 1 1 -19 22 35 o 17.18884 6.650937 3.909034       3.963877 -5.056569      6.536237 9.124513       4.985229 13.92918 6.681379 23.53181 7.617723 -9.602634      10.13265 
1 1 1 -19 22 36 o 48.67535 4.266387 31.91099       5.009522 29.38780       8.200913 33.41290       6.327177 41.58148 8.383100 48.40624 5.458895 -6.824757      10.00379 
1 1 1 -19 23 1  o 61.89193 3.432981 47.25787       5.157471 51.35634       9.549685 45.57022       6.128014 63.65616 6.236122 60.59348 4.175624 3.062679       7.505002 
1 1 1 -19 23 2  o 17.89088 6.065998 3.756805       3.151162 -5.409111      6.709217 6.351049       3.569352 15.67879 7.286128 22.19226 6.304991 -6.513465      9.635381 
1 1 1 -19 23 3  o 15.72700 6.050382 2.124981       3.266756 -0.3659303     7.152844 2.781471       3.672092 19.14639 8.299305 17.13211 6.456444 2.014273       10.51495 
1 1 1 -19 23 4  o 39.59659 5.120246 19.77598       4.825102 0.000000       0.000000 19.77598       4.825102 ?        ?        39.59659 5.120246 0.000000       5.120246 
1 1 1 -19 23 5  f 77.84083 3.478816 74.62340       6.582281 79.21072       12.91853 73.01487       7.649746 79.05878 6.770553 76.83634 4.100339 2.222435       7.915376 
1 1 1 -19 23 6  o 86.65836 3.522276 92.47056       7.422735 100.2553       14.66882 89.79115       8.605860 88.99120 6.816007 85.21609 4.156701 3.775108       7.983490 
1 1 1 -19 23 7  o 74.43194 3.643103 68.30958       6.587878 59.41987       12.87002 71.46585       7.668720 67.91167 7.925583 76.00242 4.156384 -8.090752      8.949324 
1 1 1 -19 23 8  o 53.99872 3.462541 35.98158       4.532312 38.64854       8.692488 34.98581       5.311456 55.09602 6.605768 53.09983 4.137360 1.996189       7.794480 
1 1 1 -19 23 9  o 64.24059 3.110257 50.75916       4.854554 48.35588       9.117085 51.71018       5.735192 61.86695 6.127715 64.72733 3.650801 -2.860378      7.132828 
1 1 1 -19 23 10 o 129.8563 2.904289 206.7743       9.190498 216.8376       16.34035 202.1178       11.11525 132.0227 5.088509 128.1327 3.563241 3.890030       6.212053 
1 1 1 -19 23 11 o 125.1736 2.873921 192.1388       8.766451 198.7796       15.49219 189.0108       10.63245 126.3890 5.040098 123.9025 3.524997 2.486488       6.150462 
1 1 1 -19 23 12 o 43.54609 3.894400 23.56671       4.089046 25.21608       8.079332 22.99874       4.741099 43.84295 7.850343 42.84510 4.613525 0.9978523      9.105631 
1 1 1 -19 23 13 o 39.98289 4.407535 20.02310       4.223265 8.084563       11.69856 21.81216       4.528664 28.89457 11.35495 41.72061 4.526800 -12.82604      12.22403 
1 1 1 -19 23 14 o 67.46537 3.068444 56.03313       5.031493 54.46730       9.478119 56.64753       5.937120 65.57676 5.997439 67.70200 3.611709 -2.125244      7.000979 
1 1 1 -19 23 15 o 69.59048 3.052479 59.63058       5.163937 62.62872       10.11464 58.57360       6.005600 70.31387 5.959073 68.83131 3.592861 1.482567       6.958391 
1 1 1 -19 23 16 o 32.81893 5.033010 13.73539       3.896984 16.28174       8.003439 12.94409       4.461599 34.49838 9.307150 31.55723 6.021332 2.941153       11.08510 
1 1 1 -19 23 17 o 136.9969 2.966298 230.8079       9.902882 244.5350       17.90083 224.7542       11.88760 139.5381 5.273835 134.8376 3.621099 4.700531       6.397319 
1 1 1 -19 23 18 o 34.17152 4.542782 14.79636       3.689254 19.19892       7.953408 13.58939       4.164369 37.38843 8.864850 32.45255 5.459407 4.935875       10.41109 
1 1 1 -19 23 19 o 32.23843 4.714540 13.25740       3.594318 16.41785       7.617862 12.35232       4.076620 34.40863 8.988256 30.81405 5.636590 3.594580       10.60942 
1 1 1 -19 23 20 o 111.7977 3.092384 154.3437       8.416757 123.3653       18.28500 162.6722       9.480906 96.50379 7.842801 114.6190 3.398105 -18.11525      8.547318 
1 1 1 -19 23 21 o 15.35111 5.850994 2.239308       3.036063 6.556388       7.441619 1.377232       3.325411 24.10333 9.166601 14.71225 5.961776 9.391076       10.93478 
1 1 1 -19 23 22 o 62.70389 3.066527 48.74414       4.671520 44.56567       9.142647 50.22050       5.434497 58.20033 6.560472 63.47395 3.527272 -5.273624      7.448586 
1 1 1 -19 23 23 o 30.81929 6.190407 12.72336       4.487615 17.46804       10.58829 11.68445       4.954626 33.89345 11.11086 29.17587 7.048324 4.717583       13.15789 
1 1 1 -19 23 24 o 10.70562 5.076971 -3.889151      3.556637 -2.554423      6.115708 -4.571265      4.371990 15.77334 7.192381 11.90316 5.640201 3.870187       9.140142 
1 1 1 -19 23 25 o 49.16669 3.490953 30.38250       4.155442 22.07193       7.606435 33.91796       4.961215 39.22976 8.220147 51.73743 3.965241 -12.50767      9.126552 
1 1 1 -19 23 26 o 42.46249 3.794986 22.90499       3.885567 18.81575       7.316034 24.51162       4.585783 35.66068 8.533060 43.65458 4.369355 -7.993900      9.586678 
1 1 1 -19 23 27 o 32.49973 5.881279 14.37492       4.486446 0.1625313      8.920976 19.18640       5.190609 19.88634 8.911917 37.67601 5.842580 -17.78967      10.65636 
1 1 1 -19 23 28 o 23.26815 5.977757 7.536920       3.407348 4.736442       6.302669 8.693427       4.050257 20.59211 8.255665 24.74315 6.597033 -4.151045      10.56773 
1 1 1 -19 23 29 o 24.97257 6.599007 8.952358       4.075595 12.35167       6.732621 6.986175       5.120358 27.99936 8.830457 22.12830 7.723523 5.871054       11.73157 
1 1 1 -19 23 30 o 16.01547 6.559759 2.206229       4.078039 7.779347       8.124851 0.3293982      4.714969 23.35624 9.370127 15.15282 6.649713 8.203422       11.48991 
1 1 1 -19 23 31 o 24.84981 6.657247 9.129758       4.112327 1.039366       6.829085 13.73254       5.150957 17.72070 7.878793 30.27294 7.105038 -12.55224      10.60929 
1 1 1 -19 23 32 o 14.08938 6.080741 0.7964728      3.806598 -7.276853      6.576025 4.864928       4.668227 13.42389 6.503782 18.95767 7.247986 -5.533785      9.738196 
1 1 1 -19 23 33 o 31.94812 5.928576 14.74732       4.445744 9.813433       7.296046 17.66107       5.606855 23.75776 9.066573 34.01946 6.996965 -10.26170      11.45252 
1 1 1 -19 23 34 o 18.98504 6.777514 5.347380       3.960249 3.556338       6.624634 6.343399       4.940180 18.48087 7.998959 20.25952 7.518208 -1.778646      10.97756 
1 1 1 -19 23 35 o 23.08722 6.868152 8.479186       4.148879 12.10641       7.132969 6.624616       5.100410 25.24109 9.085699 20.36656 7.623151 4.874533       11.86012 
1 1 1 -19 24 1  o 26.87008 4.706671 9.232761       2.969650 13.64025       6.257132 7.951353       3.373834 31.86604 8.054937 24.68269 5.720983 7.183357       9.879862 
1 1 1 -19 24 2  f 71.19410 3.041643 62.40803       5.264854 68.57550       10.70645 60.44099       6.046422 73.54916 6.026340 69.92623 3.560031 3.622925       6.999328 
1 1 1 -19 24 3  o 33.30750 4.550135 14.01204       3.596740 16.43355       7.699321 13.33608       4.067892 34.80963 9.007954 32.26459 5.361889 2.545044       10.48299 
1 1 1 -19 24 4  o 22.37715 6.017957 6.514675       3.352533 5.784606       7.488506 6.697679       3.749246 24.03394 9.182098 22.71564 6.464659 1.318304       11.22955 
1 1 1 -19 24 5  o 40.19782 4.106147 20.17962       3.965850 11.80729       8.434687 22.55583       4.493531 30.11053 9.919135 42.44590 4.408392 -12.33538      10.85464 
1 1 1 -19 24 6  o 65.44820 3.230999 52.79501       5.137196 54.21893       11.53669 52.44284       5.737412 64.78741 7.442254 65.13192 3.629165 -0.3445053     8.279974 
1 1 1 -19 24 7  o 30.92459 6.489956 12.49707       4.734643 16.53229       8.890837 10.89973       5.593790 34.81919 9.970029 28.66583 7.801037 6.153360       12.65929 
1 1 1 -19 24 8  o 70.83948 3.193327 61.81775       5.498405 74.68517       12.68438 58.84047       6.101449 76.43517 6.883556 68.99557 3.641802 7.439598       7.787559 
1 1 1 -19 24 9  o 75.05675 3.258924 69.42281       5.946534 74.19987       15.93072 68.64945       6.409831 75.01110 8.887617 74.56196 3.537803 0.4491425      9.565866 
1 1 1 -19 24 10 o 51.75744 3.502896 33.15273       4.392078 34.36016       8.177974 32.66330       5.206705 51.69717 6.644958 51.19693 4.210510 0.5002480      7.866629 
1 1 1 -19 24 11 o 44.09618 3.793697 24.18180       4.037026 24.71471       7.953916 23.99688       4.685384 43.24624 7.835825 43.75945 4.455863 -0.5132065     9.014148 
1 1 1 -19 24 12 o 83.03532 2.933121 84.81179       5.925790 82.51425       10.68325 85.83282       7.121800 80.97260 5.445807 83.36369 3.513594 -2.391090      6.480907 
1 1 1 -19 24 13 o 36.26707 4.707433 16.63722       4.062309 22.86866       12.50906 15.90257       4.295103 39.94476 11.93611 35.32133 5.140748 4.623421       12.99608 
1 1 1 -19 24 14 o 107.3631 2.871899 141.7730       7.507066 132.3390       13.25993 146.2232       9.107154 102.5646 5.323491 108.8168 3.438714 -6.252258      6.337532 
1 1 1 -19 24 15 o 25.33769 5.844744 8.424274       3.535316 10.07046       7.129393 7.887492       4.071108 27.70178 9.119088 24.43370 6.657516 3.268082       11.29072 
1 1 1 -19 24 16 o 52.23473 3.524901 33.87946       4.460584 23.68670       8.726846 37.48415       5.189734 41.54230 8.889090 54.84003 3.909023 -13.29773      9.710632 
1 1 1 -19 24 17 o 46.02322 4.275154 26.61139       4.739920 34.70063       8.374732 22.79887       5.749401 51.50307 6.841781 42.04745 5.762519 9.455616       8.945199 
1 1 1 -19 24 18 o 37.17062 4.857428 17.63353       4.294727 4.779299       7.583179 23.70349       5.211002 22.84101 9.089492 43.10416 5.057019 -20.26315      10.40155 
1 1 1 -19 24 19 o 47.14755 3.553602 27.73388       4.052802 25.96222       8.266620 28.29445       4.649971 43.59502 8.078777 47.45716 4.059756 -3.862144      9.041474 
1 1 1 -19 24 20 o 55.52121 3.295249 38.33688       4.438390 27.69778       8.546734 42.26552       5.193608 44.88532 8.112256 58.16175 3.683258 -13.27643      8.909270 
1 1 1 -19 24 21 o 23.54254 6.463814 7.480194       3.820798 9.994704       6.920745 6.377790       4.582437 26.92413 8.988891 22.09014 7.312629 4.833990       11.58770 
1 1 1 -19 24 22 o 36.00049 4.963580 16.79198       4.238750 18.76096       6.986604 15.64509       5.332209 36.47879 8.073169 33.94850 6.683425 2.530293       10.48066 
1 1 1 -19 24 23 o 53.64800 3.763084 36.27301       4.888440 10.65865       11.59101 41.81468       5.391375 28.23217 11.23673 57.56570 3.865669 -29.33353      11.88307 
1 1 1 -19 24 24 o 25.65774 5.890725 8.962914       3.605242 5.105179       6.803359 10.46922       4.251228 21.67356 8.614491 27.53138 6.450114 -5.857819      10.76166 
1 1 1 -19 24 25 f 57.66894 3.330853 41.79278       4.661028 25.43559       8.108074 49.86633       5.696338 41.76102 8.259983 62.76471 3.741273 -21.00369      9.067769 
1 1 1 -19 24 26 o 27.10253 5.629851 10.01221       3.596633 -1.180578      6.326012 15.35834       4.372003 16.48381 7.435805 33.80457 5.495843 -17.32076      9.246377 
1 1 1 -19 24 27 o 41.84001 4.496957 22.81503       4.513190 16.23165       6.870287 27.81267       5.985940 32.53072 8.554380 45.53571 5.506095 -13.00499      10.17323 
1 1 1 -19 24 28 o 11.97077 5.493893 -1.836651      3.645335 -4.708367      5.882896 -0.4674930E-01 4.644458 13.89482 6.571663 14.86813 6.559467 -0.9733086     9.285115 
1 1 1 -19 24 29 o 29.55163 6.587864 12.62660       4.623058 15.69762       9.066653 11.54762       5.374177 29.74620 10.28350 27.46052 7.714176 2.285681       12.85530 
1 1 1 -19 24 30 o 10.95749 5.212306 -3.758316      3.805762 -5.050903      6.388319 -3.047193      4.738373 14.16761 6.743215 12.88291 6.031743 1.284699       9.047257 
1 1 1 -19 24 31 o 23.52676 6.798604 8.383343       4.116281 10.59233       6.949178 7.189347       5.109028 24.93293 8.968756 21.64804 7.701248 3.284897       11.82150 
1 1 1 -19 24 32 o 18.22242 6.989779 4.499086       4.351062 21.30795       11.25052 1.542808       4.718197 30.88530 11.36632 15.67946 6.768412 15.20583       13.22894 
1 1 1 -19 24 33 o 34.56789 5.372736 16.88400       4.378968 19.68764       7.532724 15.45292       5.381743 33.17435 9.062811 31.36019 7.195228 1.814156       11.57177 
1 1 1 -19 24 34 f 23.27789 6.881964 8.610441       4.176006 7.873162       6.924507 9.031861       5.235167 21.57071 8.651515 23.10498 7.818773 -1.534264      11.66113 
1 1 1 -19 25 1  o 58.98164 3.181883 43.01294       4.556448 43.38898       8.606234 42.86648       5.370952 58.10302 6.172588 58.70819 3.774186 -0.6051636     7.235007 
1 1 1 -19 25 2  o 82.74720 2.996834 84.38815       6.033013 96.10097       12.14095 80.54766       6.952082 87.01337 5.758114 80.65622 3.545712 6.357147       6.762245 
1 1 1 -19 25 3  o 47.23537 4.110557 27.89130       4.684484 0.000000       0.000000 27.89130       4.684484 ?        ?        47.23537 4.110557 0.000000       4.110557 
1 1 1 -19 25 4  o 45.02765 3.756519 25.24755       4.084414 10.71088       8.209373 30.02966       4.708548 28.71975 9.790093 49.07412 3.971196 -20.35437      10.56486 
1 1 1 -19 25 5  o 43.09016 3.966710 23.18788       4.118572 37.97883       9.227489 19.50822       4.602452 53.96177 7.196399 39.22610 4.922940 14.73566       8.719145 
1 1 1 -19 25 6  o 76.09592 3.170491 71.42812       5.866397 51.59658       11.63563 78.18727       6.792945 62.70426 7.781678 79.51121 3.514537 -16.80695      8.538529 
1 1 1 -19 25 7  o 29.32741 6.618922 11.36406       4.617748 27.64445       8.509629 4.569088       5.497586 45.59129 7.948172 21.02266 7.904822 24.56864       11.20980 
1 1 1 -19 25 8  o 12.68560 5.544171 -0.5233797     3.247778 1.841874       7.740561 -1.028742      3.577956 21.07681 8.867751 12.90368 5.721891 8.173133       10.55353 
1 1 1 -19 25 9  o 68.99078 3.072453 58.69996       5.152542 67.71729       9.579217 55.02892       6.112030 73.21891 5.406863 66.58717 3.782234 6.631737       6.598444 
1 1 1 -19 25 10 o 14.16927 5.834134 0.9351399      3.247583 -4.930169      6.446322 2.930098       3.759529 15.37586 7.144194 17.30492 6.530378 -1.929059      9.679119 
1 1 1 -19 25 11 o 98.86399 3.198462 120.5959       7.695619 132.5589       19.37136 118.3540       8.385744 100.4911 7.975734 97.80949 3.523992 2.681648       8.719567 
1 1 1 -19 25 12 o 78.10609 2.980941 75.21143       5.663390 67.23545       10.17011 78.79650       6.818413 72.66711 5.791048 79.76760 3.516327 -7.100494      6.775012 
1 1 1 -19 25 13 o 78.71929 3.250626 76.59901       6.222270 86.15479       16.28034 74.96440       6.733464 80.35296 8.440145 77.76166 3.562808 2.591301       9.161312 
1 1 1 -19 25 14 o 52.66648 3.469819 34.45413       4.428442 28.20952       8.481782 36.79437       5.192359 45.84385 7.875956 54.28201 3.952379 -8.438156      8.812036 
1 1 1 -19 25 15 o 52.97557 3.434671 34.87167       4.410111 32.15664       8.407047 35.90243       5.180045 49.27946 7.214365 53.57437 3.996507 -4.294914      8.247372 
1 1 1 -19 25 16 o 35.64654 4.394936 16.12535       3.736990 27.45994       7.564725 12.46634       4.298055 45.47007 7.055552 30.76510 5.948133 14.70497       9.228278 
1 1 1 -19 25 17 o 58.84801 3.657901 43.20957       5.219721 44.54672       8.896886 42.50774       6.445604 58.41963 6.351593 57.97467 4.600041 0.4449577      7.842391 
1 1 1 -19 25 18 o 13.34208 5.563363 0.6937138      3.005360 -5.214950      6.073648 2.609503       3.458428 14.47782 6.794590 16.35290 6.241843 -1.875075      9.226433 
1 1 1 -19 25 19 o 50.54198 4.105423 32.23015       5.012954 32.97389       8.402566 31.81914       6.246359 49.47345 7.178976 49.69292 5.236822 -0.2194748     8.886056 
1 1 1 -19 25 20 o 28.92776 7.094500 11.56087       4.962423 11.02387       6.872267 12.14594       7.173259 27.84766 8.937696 29.04377 9.108667 -1.196114      12.76128 
1 1 1 -19 25 21 f 40.70208 4.072927 21.06214       3.985588 18.53413       7.130591 22.21078       4.806508 35.94175 8.307638 41.45916 4.848918 -5.517406      9.619192 
1 1 1 -19 25 22 o 61.60508 3.485549 47.64557       5.211329 37.23016       11.45484 50.36394       5.852012 49.70872 9.804761 63.15818 3.820100 -13.44946      10.52267 
1 1 1 -19 25 23 f 16.98785 6.156774 3.421533       3.282300 -4.447306      5.889811 6.966170       3.953046 14.28084 6.698591 22.41377 6.712806 -8.132926      9.483294 
1 1 1 -19 25 24 o 30.59966 5.123640 12.45714       3.685644 8.556787       6.519620 14.28907       4.468127 24.48180 8.700674 32.42085 5.871541 -7.939051      10.49651 
1 1 1 -19 25 25 o 31.04963 5.162307 12.88640       3.768938 4.166102       6.440274 17.42842       4.647967 20.25947 8.264312 36.02821 5.465322 -15.76874      9.908007 
1 1 1 -19 25 26 o 18.83857 6.583460 4.686108       3.720971 7.914546       6.121887 2.794607       4.685894 23.40557 8.418155 17.41186 7.069208 5.993708       10.99268 
1 1 1 -19 25 27 f 59.29902 5.536566 47.46251       7.908154 32.08228       11.12573 63.16821       11.24283 43.23191 10.63496 66.56444 7.037454 -23.33252      12.75257 
1 1 1 -19 25 28 o 21.20274 6.707114 6.505895       3.881410 -1.226243      8.429726 8.586215       4.372488 18.08645 8.320357 24.03192 7.025217 -5.945475      10.88954 
1 1 1 -19 25 29 o 57.00347 3.510152 41.66659       4.852348 23.35490       8.444653 50.69280       5.928848 37.20296 9.331912 62.52497 3.910758 -25.32200      10.11823 
1 1 1 -19 25 30 o 31.27486 5.158279 13.52708       3.794366 9.171638       6.743570 15.54475       4.589855 23.55602 8.775775 32.97102 5.930585 -9.414999      10.59179 
1 1 1 -19 25 31 o 28.49035 5.601217 11.59710       3.750123 1.821613       7.112281 15.36142       4.413492 17.91885 7.998950 32.78002 5.733758 -14.86117      9.841706 
1 1 1 -19 25 32 o 34.77758 5.387217 17.10174       4.418091 11.99825       7.339337 20.00213       5.532881 25.40432 9.206546 36.63973 6.431209 -11.23541      11.23036 
1 1 1 -19 25 33 o 27.66750 6.397537 11.65997       4.227273 6.243914       6.935461 14.86147       5.332255 20.32214 8.460846 30.44288 7.285112 -10.12074      11.16507 
1 1 1 -19 26 1  o 23.39928 5.818954 7.253824       3.304130 5.147950       6.432871 8.008484       3.850920 22.14590 8.497927 24.48791 6.387562 -2.342005      10.63089 
1 1 1 -19 26 2  f 25.59750 5.510864 8.606537       3.335778 5.945471       6.188613 9.696310       3.960349 22.76224 8.420658 27.02181 6.152615 -4.259571      10.42891 
1 1 1 -19 26 3  o 44.11321 4.509549 24.58669       4.779591 0.000000       0.000000 24.58669       4.779591 ?        ?        44.11321 4.509549 0.000000       4.509549 
1 1 1 -19 26 4  o 52.48808 3.649300 34.31112       4.638668 31.94062       9.489160 35.05545       5.317291 48.53017 8.323288 52.88801 4.159138 -4.357845      9.304598 
1 1 1 -19 26 5  o 31.14278 5.206124 12.52469       3.811647 1.338573       7.555892 16.34302       4.414515 20.35324 8.670802 35.65889 5.236035 -15.30565      10.12911 
1 1 1 -19 26 6  o 62.27647 3.354478 48.07253       5.072000 46.92854       10.39223 48.43023       5.811103 59.70039 7.294569 62.34381 3.843668 -2.643421      8.245273 
1 1 1 -19 26 7  o 63.28380 3.301027 49.60936       5.073103 49.18310       10.55581 49.73738       5.785000 61.17926 7.219157 63.20801 3.772906 -2.028748      8.145616 
1 1 1 -19 26 8  o 44.41636 4.014440 24.72428       4.298283 21.05723       9.202067 25.74765       4.861186 38.55112 9.781130 45.18493 4.473469 -6.633808      10.75558 
1 1 1 -19 26 9  o 74.29469 3.144395 68.24049       5.679994 72.24818       12.61662 67.22173       6.361088 74.36008 7.046608 73.58846 3.557740 0.7716217      7.893807 
1 1 1 -19 26 10 o 40.44630 4.140056 20.58392       4.023061 18.59586       7.336760 21.43871       4.810814 36.75798 8.377707 41.03048 4.908741 -4.272495      9.709877 
1 1 1 -19 26 11 o 78.78107 2.993024 76.65566       5.735583 82.26801       10.47790 74.25444       6.853593 80.43529 5.376411 77.28240 3.649473 3.152885       6.498034 
1 1 1 -19 26 12 o 64.80148 3.482314 52.18758       5.478867 49.60600       13.52767 52.69414       5.992342 59.51934 9.657415 64.99546 3.799933 -5.476124      10.37811 
1 1 1 -19 26 13 o 38.43465 4.205254 18.66947       3.874474 22.11037       7.433440 17.38598       4.539933 40.26217 7.858451 36.72268 5.220027 3.539486       9.434190 
1 1 1 -19 26 14 o 17.85552 6.165152 3.832783       3.258370 1.738356       6.021605 4.699947       3.874631 18.73017 7.847124 19.56202 6.724215 -0.8318462     10.33404 
1 1 1 -19 26 15 o 55.03184 3.411886 37.73278       4.553061 34.77183       8.586600 38.89094       5.370189 51.01105 7.099632 55.65202 3.986193 -4.640972      8.142144 
1 1 1 -19 26 16 o 31.19300 6.765851 13.19039       4.994698 10.47672       6.761267 16.45016       7.410419 27.44333 8.870461 33.91386 8.867979 -6.470535      12.54297 
1 1 1 -19 26 17 o 62.50753 3.673543 48.92933       5.571021 43.43817       8.910181 52.45378       7.138391 57.26890 6.499372 64.24863 4.589550 -6.979729      7.956494 
1 1 1 -19 26 18 o 27.35824 6.246866 10.14912       4.072927 12.68774       6.720640 8.675539       5.120346 29.66051 8.720369 25.03028 7.670418 4.630224       11.61379 
1 1 1 -19 26 19 o 17.90960 6.350100 3.878409       3.470983 3.054884       6.230917 4.248941       4.179523 19.66469 8.087343 18.96352 6.936234 0.7011700      10.65441 
1 1 1 -19 26 20 o 42.19962 3.958667 22.63941       4.023398 28.23187       7.333055 20.23082       4.812438 45.45692 6.830914 39.31735 5.146196 6.139565       8.552468 
1 1 1 -19 26 21 o 43.63940 3.965996 24.26772       4.171596 21.45874       7.234473 25.66694       5.105948 38.60921 7.953992 44.45655 4.788508 -5.847336      9.284170 
1 1 1 -19 26 22 o 32.13908 6.584229 14.37713       4.983188 -7.715451      9.912593 21.84855       5.764553 17.63507 8.395334 40.13357 6.084732 -22.49850      10.36849 
1 1 1 -19 26 23 o 12.73453 5.622650 -0.4497777     3.419017 -13.41706      6.222495 5.158239       4.092085 11.48232 5.708567 19.77099 6.904327 -8.288669      8.958653 
1 1 1 -19 26 24 o 11.64869 5.329285 -1.697184      3.394141 -0.5829939     6.216428 -2.170410      4.051311 16.60466 7.440451 12.52283 5.763527 4.081830       9.411618 
1 1 1 -19 26 25 o 40.32539 4.850227 21.52325       4.670680 10.98157       6.872663 30.57066       6.366963 26.47598 8.958517 47.54535 5.602709 -21.06937      10.56624 
1 1 1 -19 26 26 o 49.45215 5.788303 33.53314       6.843629 29.24075       10.25290 36.98221       9.190694 41.45208 10.21653 49.82345 7.827494 -8.371368      12.87040 
1 1 1 -19 26 27 o 35.80022 4.694956 17.11743       3.997324 6.992752       6.918918 22.18999       4.897349 22.14844 8.723770 40.54143 5.067443 -18.39299      10.08876 
1 1 1 -19 26 28 o 34.96997 4.773865 16.49305       3.962088 5.925462       6.796917 21.93213       4.876256 20.96792 8.513581 40.13002 5.101476 -19.16210      9.925025 
1 1 1 -19 26 29 o 18.02651 6.423002 4.526955       3.555115 1.573918       6.632750 5.717308       4.211116 17.55248 7.786549 19.74904 6.995198 -2.196562      10.46724 
1 1 1 -19 26 30 o 16.46378 6.219109 3.487895       3.411602 2.132780       5.628508 4.274890       4.289347 16.95008 7.354589 17.91612 6.922302 -0.9660397     10.09991 
1 1 1 -19 26 31 o 20.08675 6.833419 6.180514       3.999264 1.344515       9.935892 7.115478       4.368790 19.13892 8.884729 21.25085 7.142514 -2.111938      11.39973 
1 1 1 -19 26 32 o 24.57197 6.304117 9.208416       3.793103 7.806463       6.869967 9.823215       4.549399 21.54835 8.625956 24.67480 7.152414 -3.126455      11.20554 
1 1 1 -19 27 1  o 21.32872 5.812920 6.064465       3.103235 12.07669       6.144400 4.005761       3.595495 29.29187 8.255464 18.31675 6.465919 10.97512       10.48622 
1 1 1 -19 27 2  o 31.11010 4.680861 12.46558       3.438795 11.34305       6.566237 12.88981       4.036630 28.42434 8.681503 31.34999 5.483368 -2.925650      10.26819 
1 1 1 -19 27 3  o 10.43570 4.984907 -4.461421      3.556981 0.000000       0.000000 -4.461421      3.556981 ?        ?        10.43570 4.984907 0.000000       4.984907 
1 1 1 -19 27 4  o 64.49190 3.311223 51.70047       5.186488 46.97466       10.26777 53.31929       6.009505 59.30139 7.256177 65.29658 3.793026 -5.995186      8.187744 
1 1 1 -19 27 5  o 108.6465 3.137704 146.1905       8.298673 134.1322       16.64809 150.1774       9.572776 101.0986 6.796953 109.8517 3.580765 -8.753090      7.682476 
1 1 1 -19 27 6  o 47.28473 4.837673 28.50514       5.495859 13.89433       8.914792 37.46232       6.980067 31.15192 10.19408 54.00285 5.375345 -22.85093      11.52448 
1 1 1 -19 27 7  o 10.17663 4.813065 -3.432442      3.155465 2.389017       6.991963 -4.921349      3.536038 20.27327 8.472025 10.15834 4.883449 10.11493       9.778715 
1 1 1 -19 27 8  o 19.84649 6.291733 5.085882       3.413896 -6.127372      7.044002 8.528339       3.902904 15.47639 7.280179 25.18974 6.358490 -9.713346      9.665992 
1 1 1 -19 27 9  o 30.41966 5.320646 12.08075       3.800606 10.34616       8.237299 12.54988       4.283832 27.71910 9.786694 30.79337 5.923770 -3.074274      11.43986 
1 1 1 -19 27 10 o 16.82785 6.208319 3.060800       3.359953 0.5592393      7.196895 3.758001       3.799431 19.19942 8.323546 18.20534 6.620288 0.9940739      10.63530 
1 1 1 -19 27 11 o 72.63076 3.055212 65.38834       5.395442 65.07523       9.552964 65.53500       6.538084 71.08411 5.558979 72.41811 3.717259 -1.334000      6.687321 
1 1 1 -19 27 12 o 31.65853 6.454330 13.47343       4.810363 13.01917       11.14902 13.57734       5.332218 30.46285 11.29627 31.50406 7.114331 -1.041208      13.34988 
1 1 1 -19 27 13 o 76.71191 3.401638 73.31351       6.343160 84.57143       10.34354 66.52775       8.030435 81.19361 5.255947 72.42729 4.573238 8.766319       6.967029 
1 1 1 -19 27 14 o 38.24614 5.560677 19.16214       5.030934 33.05804       11.86345 16.11522       5.555180 46.74255 10.65303 34.40608 6.866349 12.33647       12.67414 
1 1 1 -19 27 15 o 72.63724 3.525338 65.99160       6.221533 59.79591       9.469904 70.69656       8.252372 67.66568 5.798885 74.54608 4.564624 -6.880402      7.379896 
1 1 1 -19 27 16 o 32.37815 5.662972 13.93521       4.305573 13.41667       6.822678 14.27839       5.550367 30.32841 8.749320 31.99069 7.283546 -1.662283      11.38423 
1 1 1 -19 27 17 o 38.95760 4.353078 19.46392       4.062061 25.25405       7.795989 17.30616       4.759136 42.32072 7.848217 36.14088 5.583472 6.179840       9.631701 
1 1 1 -19 27 18 o 51.47713 3.651417 33.44118       4.550758 24.55156       7.860730 37.92247       5.581135 41.38649 8.084206 54.51677 4.234210 -13.13028      9.125947 
1 1 1 -19 27 19 o 22.66954 6.308387 7.107009       3.612114 3.497889       6.583384 8.661448       4.320514 20.07665 8.290512 24.79946 6.898636 -4.722811      10.78535 
1 1 1 -19 27 20 o 73.06166 3.125129 66.81455       5.551229 53.32643       9.298666 74.28371       6.919599 62.91083 6.143598 76.62739 3.716704 -13.71656      7.180367 
1 1 1 -19 27 21 o 47.33678 4.188077 28.80646       4.781346 31.99196       11.22072 28.09972       5.285195 44.30689 10.54537 46.41505 4.739112 -2.108154      11.56132 
1 1 1 -19 27 22 o 12.87402 5.618841 -0.7046764E-01 3.325993 -2.356261      6.071470 0.9095886      3.975583 15.42684 7.083784 14.81623 6.299941 0.6106062      9.479939 
1 1 1 -19 27 23 o 23.62875 6.406505 7.940563       3.780875 11.34591       6.699636 6.349213       4.579869 26.96727 8.838002 21.28588 7.310818 5.681385       11.46989 
1 1 1 -19 27 24 o 14.70263 6.419259 0.3226659      4.344469 -5.978576      7.994509 2.963388       5.175354 15.87387 7.551955 17.90215 7.367360 -2.028276      10.55036 
1 1 1 -19 27 25 o 44.00565 4.955712 25.92111       5.222061 28.14088       9.334776 24.91001       6.300108 41.34337 9.469403 41.98050 6.357092 -0.6371269     11.40536 
1 1 1 -19 27 26 o 15.61027 6.151851 2.581548       3.442302 8.382779       6.245574 0.5036100E-01  4.125480 23.20995 8.480679 14.00936 6.181300 9.200587       10.49430 
1 1 1 -19 27 27 o 48.89359 3.731741 30.99352       4.412714 23.98315       7.360775 34.92640       5.513260 39.04959 8.004292 51.27713 4.456344 -12.22754      9.161205 
1 1 1 -19 27 28 o 26.64638 5.920484 10.30374       3.744581 -0.6464069     6.386750 16.03961       4.622423 16.00791 7.318645 33.45912 5.883863 -17.45121      9.390549 
1 1 1 -19 27 29 o 13.12656 5.711805 0.4882033      3.414973 -3.665947      5.984131 2.494428       4.158625 13.97639 6.615511 15.92976 6.584701 -1.953369      9.333985 
1 1 1 -19 27 30 o 42.25139 4.703410 24.40051       4.760730 2.754589       11.44643 28.92812       5.235000 20.27999 9.455441 45.99552 4.738234 -25.71552      10.57621 
1 1 1 -19 28 1  o 35.83067 4.419761 16.49900       3.777426 17.32303       6.843769 16.13797       4.529959 34.73252 8.215358 34.95361 5.499710 -0.2210960     9.886299 
1 1 1 -19 28 2  o 32.36771 5.921371 14.01635       4.498514 0.000000       0.000000 14.01635       4.498514 ?        ?        32.36771 5.921371 0.000000       5.921371 
1 1 1 -19 28 3  o 56.36793 3.562966 39.83729       4.869136 28.15765       8.232774 46.12061       6.038459 45.00432 7.788678 60.38143 4.128646 -15.37711      8.815284 
1 1 1 -19 28 4  o 68.96882 3.495454 59.47929       5.855636 55.48546       10.32824 61.37117       7.108513 64.48918 6.668164 69.66437 4.206885 -5.175186      7.884307 
1 1 1 -19 28 5  o 13.96096 5.907218 0.5680717      3.466488 2.608523       6.393113 -0.2816548     4.125616 19.58335 8.135784 14.30179 6.249636 5.281551       10.25909 
1 1 1 -19 28 6  o 20.27396 7.431551 4.876049       4.801732 -0.1720366E-01 7.169513 8.856318       6.466170 18.62119 8.184921 25.44875 8.688417 -6.827562      11.93656 
1 1 1 -19 28 7  o 64.51327 3.705907 52.19747       5.801609 54.92789       11.02365 51.15148       6.822960 63.75798 7.222076 63.47186 4.439174 0.2861214      8.477302 
1 1 1 -19 28 8  o 17.94537 6.477409 3.761543       3.628396 -1.907113      7.155864 5.723348       4.209689 17.50748 7.902037 20.97014 7.010777 -3.462662      10.56377 
1 1 1 -19 28 9  o 73.83821 3.621918 68.27476       6.497237 63.78554       11.93709 70.16454       7.744974 68.67277 7.242013 74.45625 4.286694 -5.783485      8.415610 
1 1 1 -19 28 10 o 62.16445 3.837460 48.62527       5.784953 40.40877       10.29177 52.42033       6.994492 53.83612 8.095125 64.17788 4.500875 -10.34175      9.262231 
1 1 1 -19 28 11 o 19.96479 6.931878 5.041963       4.121667 0.000000       0.000000 5.041963       4.121667 ?        ?        19.96479 6.931878 0.000000       6.931878 
1 1 1 -19 28 12 o 26.82116 5.781548 9.682866       3.667404 12.46871       6.844865 8.561110       4.343454 29.22782 8.851028 24.86580 6.916865 4.362019       11.23315 
1 1 1 -19 28 13 o 16.01571 6.208216 2.472535       3.458408 6.709108       6.557297 0.8399358      4.070590 23.08845 8.643258 15.12341 6.400283 7.965036       10.75498 
1 1 1 -19 28 14 o 51.57006 3.520514 33.44794       4.397720 25.52899       7.568059 37.48510       5.403669 42.70622 7.548065 54.30401 4.113995 -11.59779      8.596409 
1 1 1 -19 28 15 o 19.12434 6.945197 4.471144       4.179605 4.990200       6.755308 4.149204       5.320161 21.51412 8.573230 19.66009 7.677619 1.854029       11.50852 
1 1 1 -19 28 16 o 89.98339 3.370447 101.5583       7.377645 87.95699       16.58927 104.9116       8.237035 77.41004 8.959358 91.18053 3.714865 -13.77048      9.698985 
1 1 1 -19 28 17 o 20.97424 6.452487 6.037980       3.619012 1.065540       5.957606 8.945902       4.555944 17.58470 7.598290 25.07599 7.122921 -7.491287      10.41489 
1 1 1 -19 28 18 o 17.60199 6.404318 3.752321       3.556243 0.2847835      6.129795 5.511559       4.366141 17.18970 7.561520 20.38585 7.130897 -3.196146      10.39357 
1 1 1 -19 28 19 o 25.30591 6.187835 8.936692       3.783562 -2.819908      6.531062 14.87541       4.641829 15.81704 7.293423 32.94572 6.002774 -17.12868      9.446021 
1 1 1 -19 28 20 o 30.87303 5.432759 12.89596       3.938106 10.27235       6.854334 14.18876       4.811517 25.97428 8.942953 31.82548 6.425621 -5.851200      11.01204 
1 1 1 -19 28 21 f 48.40210 5.069106 31.08016       5.890466 30.33694       12.05239 31.31340       6.751790 41.01696 11.56289 47.91143 5.907863 -6.894466      12.98473 
1 1 1 -19 28 22 o 42.94781 5.244244 24.77512       5.374878 23.76031       10.17409 25.16799       6.330361 36.71723 10.71141 42.45398 6.310550 -5.736748      12.43211 
1 1 1 -19 28 23 o 14.27168 6.010476 1.144339       3.561540 8.233187       7.952770 -0.6340517     3.983310 23.60139 9.335167 13.35398 5.971940 10.24741       11.08194 
1 1 1 -19 28 24 o 18.73407 6.404642 4.871303       3.513865 -0.7309251     5.948640 7.873685       4.354820 15.81931 7.166099 22.94375 7.081615 -7.124434      10.07483 
1 1 1 -19 28 25 o 17.74956 6.678822 4.075932       3.926048 -1.133360      5.979768 8.022853       5.205042 15.50616 7.086358 22.75484 7.794534 -7.248682      10.53429 
1 1 1 -19 28 26 o 12.83935 5.638505 0.1079870      3.395524 -0.9302471     5.789616 0.6523420      4.192212 15.28371 6.980164 14.44216 6.305648 0.8415518      9.406588 
1 1 1 -19 28 27 o 15.74377 6.147569 2.896994       3.410678 6.286350       6.201517 1.427251       4.083758 20.65975 8.220367 14.89977 6.361825 5.759982       10.39458 
1 1 1 -19 28 28 o 18.25619 6.451663 4.807735       3.580440 10.54502       6.354751 2.139353       4.333803 24.56416 8.602141 15.72418 6.626626 8.839980       10.85859 
1 1 1 -19 28 29 o 32.10091 5.130985 14.46482       3.878695 22.93827       7.143479 10.92231       4.618858 37.20929 8.107815 26.22495 7.068410 10.98435       10.75635 
1 1 1 -19 29 1  o 45.65333 3.644263 26.40754       4.020689 26.28223       7.480385 26.45844       4.768000 43.16101 7.376884 45.32348 4.371111 -2.162472      8.574674 
1 1 1 -19 29 2  o 24.26629 6.437060 8.192912       3.868549 0.000000       0.000000 8.192912       3.868549 ?        ?        24.26629 6.437060 0.000000       6.437060 
1 1 1 -19 29 3  o 27.94068 5.395046 10.46086       3.540381 12.60987       6.742542 9.642804       4.160005 29.06257 8.781136 26.32774 6.518813 2.734825       10.93633 
1 1 1 -19 29 4  o 19.63244 6.024020 5.176294       3.156879 7.447343       6.142822 4.361229       3.680024 23.46974 8.433622 18.63078 6.544441 4.838964       10.67500 
1 1 1 -19 29 5  f 47.62107 4.664737 29.27222       5.343942 29.61380       8.379853 29.03810       6.937715 45.76196 7.793471 46.40483 6.297394 -0.6428719     10.01975 
1 1 1 -19 29 6  o 22.28569 6.027119 6.789003       3.351374 7.656813       6.835270 6.514357       3.845302 23.96804 8.852739 21.80797 6.640196 2.160072       11.06631 
1 1 1 -19 29 7  o 29.24999 5.470369 11.43844       3.755918 9.868876       7.061955 12.05754       4.435230 26.19469 9.074697 29.64230 6.332355 -3.447607      11.06566 
1 1 1 -19 29 8  o 10.03191 4.780194 -3.781062      3.228880 -3.589118      6.972557 -3.833461      3.643041 16.19570 7.492070 10.85663 5.145565 5.339069       9.088891 
1 1 1 -19 29 9  o 23.15741 6.366361 7.401433       3.703712 9.202595       7.937942 6.900202       4.187459 25.69219 9.530866 22.36670 6.951047 3.325487       11.79637 
1 1 1 -19 29 10 o 23.97040 6.434096 7.965578       3.836698 14.94301       8.098195 5.946142       4.356678 31.11527 9.665947 21.08220 7.132661 10.03307       12.01272 
1 1 1 -19 29 11 o 60.51937 4.150874 46.70055       6.084602 0.000000       0.000000 46.70055       6.084602 ?        ?        60.51937 4.150874 0.000000       4.150874 
1 1 1 -19 29 12 o 35.89186 5.095909 16.97933       4.331982 11.52634       8.850508 18.69729       4.967728 27.66325 10.09744 37.39925 5.624796 -9.736002      11.55840 
1 1 1 -19 29 13 o 48.25406 3.866813 29.62551       4.508954 23.20527       7.851703 32.78457       5.507659 39.72021 8.375939 50.38663 4.533988 -10.66642      9.524359 
1 1 1 -19 29 14 o 67.62452 3.295367 57.43983       5.414204 56.82121       9.479894 57.73930       6.595745 65.01888 6.052639 67.29884 4.040403 -2.279953      7.277314 
1 1 1 -19 29 15 o 18.15397 6.879990 3.791962       4.183179 1.538870       6.578958 5.321100       5.419896 18.49573 7.988296 20.70019 7.834360 -2.204460      11.18884 
1 1 1 -19 29 16 o 39.00831 4.592751 19.84962       4.282251 21.14919       7.501099 19.22130       5.215698 37.61024 8.397018 37.62145 5.881515 -0.1120377E-01 10.25193 
1 1 1 -19 29 17 o 37.48839 4.717977 18.45645       4.214872 22.81003       7.534575 16.47356       5.084929 39.19242 8.154784 34.46611 6.285726 4.726315       10.29616 
1 1 1 -19 29 18 o 19.91660 6.977608 5.340900       4.181461 6.244656       10.12249 5.154953       4.591521 23.60689 10.04573 19.87234 7.269845 3.734550       12.40030 
1 1 1 -19 29 19 o 21.66345 7.429205 6.658950       4.728901 1.681813       8.302361 9.049096       5.753394 19.77535 8.745168 24.53618 8.195891 -4.760830      11.98543 
1 1 1 -19 29 20 o 35.97272 7.167172 18.87668       6.062129 0.000000       0.000000 18.87668       6.062129 ?        ?        35.97272 7.167172 0.000000       7.167172 
1 1 1 -19 29 21 o 10.28636 4.926370 -4.112823      3.522985 -4.721462      7.072086 -3.911933      4.063004 15.24106 7.207463 11.39034 5.408839 3.850718       9.011274 
1 1 1 -19 29 22 o 63.06018 3.321684 50.60899       5.086457 43.08516       8.543033 54.74084       6.330887 55.00662 6.498581 64.95721 4.019142 -9.950596      7.641012 
1 1 1 -19 29 23 o 25.51184 5.943473 9.344177       3.626139 5.774088       6.321075 11.09531       4.427009 20.67931 8.275505 27.33050 6.699696 -6.651184      10.64753 
1 1 1 -19 29 24 o 21.57644 7.208565 7.087484       4.450679 12.94088       6.798881 2.698248       5.887463 27.40917 8.897962 17.78098 7.616442 9.628189       11.71255 
1 1 1 -19 29 25 o 14.54101 6.038690 1.716561       3.520191 -1.295162      5.876257 3.402323       4.396341 15.11666 6.951478 17.13029 6.885609 -2.013625      9.784409 
1 1 1 -19 29 26 o 32.34265 5.158591 14.57764       3.929283 13.13592       6.842220 15.28706       4.799617 27.13574 8.933579 32.13740 6.353835 -5.001657      10.96267 
1 1 1 -19 29 27 o 29.75234 6.451458 13.33853       4.542493 9.218386       6.472852 17.33674       6.376345 23.08403 8.598234 32.20966 8.125529 -9.125622      11.83021 
1 1 1 -19 30 1  o 32.76563 4.305718 13.99009       3.354839 12.99726       6.168797 14.40705       3.997716 29.24761 8.281802 32.80947 5.171099 -3.561859      9.763632 
1 1 1 -19 30 2  o 35.58428 4.380564 16.48339       3.718527 16.38356       6.557104 16.53071       4.514694 33.04006 8.186234 35.04199 5.465183 -2.001926      9.842899 
1 1 1 -19 30 3  o 53.05685 3.426524 35.57486       4.406591 29.61602       7.772846 38.39709       5.349285 45.72059 7.215449 54.75479 4.037409 -9.034195      8.268214 
1 1 1 -19 30 4  o 10.54865 4.905415 -2.280344      3.049111 -2.522563      5.508683 -2.173357      3.661090 14.62501 6.727273 11.84846 5.462455 2.776548       8.665715 
1 1 1 -19 30 5  f 42.84148 5.222148 24.31457       5.339403 21.12381       8.001459 26.87598       7.169045 37.14254 8.947049 43.80399 6.947639 -6.661457      11.32781 
1 1 1 -19 30 6  o 43.67765 4.038056 24.46165       4.249370 26.55532       7.995853 23.63758       5.016422 42.71081 7.975525 42.41537 4.945979 0.2954445      9.384653 
1 1 1 -19 30 7  o 26.06044 6.085034 9.418580       3.793928 11.99514       7.107882 8.392045       4.486491 27.95112 9.099669 24.22789 7.125456 3.723228       11.55751 
1 1 1 -19 30 8  o 47.87593 3.966364 29.30240       4.586002 27.34935       8.883706 30.01196       5.354650 42.57383 8.851804 48.05594 4.629673 -5.482109      9.989409 
1 1 1 -19 30 9  o 30.31068 5.572817 12.43740       3.964656 4.929362       7.991470 14.88864       4.566214 21.95203 9.105924 33.05054 5.885236 -11.09852      10.84223 
1 1 1 -19 30 10 o 19.76136 6.953529 5.132849       4.155733 0.000000       0.000000 5.132849       4.155733 ?        ?        19.76136 6.953529 0.000000       6.953529 
1 1 1 -19 30 11 f 33.20581 5.239467 14.73148       4.099298 9.803065       8.290692 16.32625       4.716128 25.77255 9.703811 34.67368 5.785191 -8.901129      11.29745 
1 1 1 -19 30 12 o 40.88623 4.532392 21.77228       4.440100 24.84215       9.219462 20.84525       5.066348 39.59443 9.645481 39.47676 5.408487 0.1176682      11.05835 
1 1 1 -19 30 13 o 23.25499 6.677162 7.684999       3.982519 11.54076       8.132188 6.468533       4.567748 27.14402 9.709620 21.54216 7.303287 5.601866       12.14968 
1 1 1 -19 30 14 o 54.60417 4.269055 38.50829       5.635470 28.07956       7.961744 48.97911       7.977795 43.89649 7.724867 60.56476 5.464087 -16.66827      9.462020 
1 1 1 -19 30 15 o 28.88300 5.797080 11.51560       3.938298 8.478760       6.380943 13.38427       5.005408 23.98989 8.598561 30.50489 6.895946 -6.514997      11.02222 
1 1 1 -19 30 16 o 35.60400 6.224545 17.67641       5.204084 6.127377       9.191470 23.12542       6.313511 22.93996 9.658075 40.50049 6.625877 -17.56053      11.71241 
1 1 1 -19 30 17 o 59.17785 4.329593 45.53736       6.200496 28.78839       10.82384 53.71852       7.564751 40.55610 10.77140 63.73640 4.908251 -23.18030      11.83697 
1 1 1 -19 30 18 o 39.17160 4.859052 20.46742       4.538912 27.87152       9.842484 18.46753       5.115307 40.60751 10.01091 36.41692 5.970852 4.190590       11.65630 
1 1 1 -19 30 19 o 18.02188 6.313521 4.365235       3.423380 5.370229       6.464426 3.973537       4.035743 20.66214 8.333955 17.85811 6.759989 2.804024       10.73090 
1 1 1 -19 30 20 o 35.03033 5.399947 16.88517       4.461737 10.50399       11.76589 17.95689       4.821878 25.27973 10.79629 35.91841 5.698958 -10.63868      12.20811 
1 1 1 -19 30 21 o 49.30566 3.738593 31.46435       4.458535 25.73843       7.822371 34.21963       5.426227 40.37393 8.230097 50.84800 4.423097 -10.47407      9.343355 
1 1 1 -19 30 22 o 10.76704 5.054752 -2.581880      3.366208 0.6073059      6.236502 -3.892998      3.998729 16.68100 7.465209 11.15658 5.317081 5.524426       9.165189 
1 1 1 -19 30 23 o 15.01790 6.213200 1.957183       3.707029 1.947032       6.470589 1.962143       4.522851 17.61808 7.758714 15.89205 6.736950 1.726031       10.27541 
1 1 1 -19 30 24 o 33.67897 4.880996 15.57484       3.889310 14.44678       6.853456 16.11072       4.723613 28.60859 8.892899 33.32024 6.039752 -4.711645      10.74999 
1 1 1 -19 30 25 o 16.05044 6.201620 3.195092       3.442776 4.094412       6.143322 2.783338       4.156859 18.65384 7.876978 16.16508 6.622148 2.488766       10.29075 
1 1 1 -19 30 26 o 22.68321 6.242471 7.792974       3.558874 1.926117       6.074144 10.85976       4.391615 16.98753 7.497663 26.42432 6.785317 -9.436790      10.11215 
1 1 1 -19 31 1  o 30.62206 5.869491 13.05383       4.220611 0.000000       0.000000 13.05383       4.220611 ?        ?        30.62206 5.869491 0.000000       5.869491 
1 1 1 -19 31 2  o 31.23527 4.690808 12.96799       3.460292 8.560601       5.720197 15.51160       4.345560 23.87855 8.171394 33.73835 5.472850 -9.859800      9.834825 
1 1 1 -19 31 3  o 18.32242 6.117647 4.527462       3.205590 6.878944       5.478403 3.303200       3.952942 22.02791 7.958129 17.17018 6.642287 4.857735       10.36590 
1 1 1 -19 31 4  o 23.42108 7.054985 7.976031       4.357032 5.500227       6.038893 10.66413       6.292474 20.89723 8.174252 26.24995 8.562915 -5.352718      11.83815 
1 1 1 -19 31 5  o 14.35880 5.849802 1.580249       3.221834 -4.555500      5.681520 4.488559       3.911570 13.70593 6.475084 18.63159 6.725379 -4.925659      9.335814 
1 1 1 -19 31 6  f 24.96094 5.965877 8.724316       3.579387 7.456628       6.067698 9.400910       4.432842 22.85606 8.357831 25.43828 6.953463 -2.582216      10.87217 
1 1 1 -19 31 7  f 21.80330 6.491482 6.739312       3.705098 14.79456       7.308786 3.953252       4.298343 30.41242 9.132140 18.25142 6.960544 12.16100       11.48238 
1 1 1 -19 31 8  o 53.06509 3.795580 36.01675       4.875798 28.97174       9.018708 38.92630       5.795832 43.34820 8.837655 54.75422 4.380225 -11.40602      9.863596 
1 1 1 -19 31 9  o 17.20256 6.404478 3.553322       3.590416 4.621193       6.484562 3.081211       4.311646 20.43282 8.308504 17.29511 6.863150 3.137703       10.77655 
1 1 1 -19 31 10 o 24.40209 8.221068 8.934663       5.787681 0.000000       0.000000 8.934663       5.787681 ?        ?        24.40209 8.221068 0.000000       8.221068 
1 1 1 -19 31 11 o 17.20834 6.966619 2.811224       4.535935 23.59764       8.606358 -5.183485      5.337414 38.40805 9.296240 12.90247 6.147418 25.50558       11.14499 
1 1 1 -19 31 12 o 64.10601 4.164306 53.10001       6.470246 49.73027       11.08597 54.84087       7.968180 57.77401 8.096089 64.21877 5.134415 -6.444759      9.586911 
1 1 1 -19 31 13 o 27.04696 6.918729 10.70520       4.578030 11.06819       7.904217 10.52196       5.615879 26.19712 9.545425 26.18056 8.034896 0.1655579E-01  12.47697 
1 1 1 -19 31 14 o 17.36420 6.458288 3.731467       3.649280 1.350528       7.467853 4.478378       4.182693 18.70055 8.280762 18.64075 6.917779 0.5980301E-01  10.79012 
1 1 1 -19 31 15 o 26.79420 5.832717 10.09790       3.700137 6.426767       6.830173 11.62281       4.402043 21.78058 8.639698 28.36131 6.507634 -6.580732      10.81636 
1 1 1 -19 31 16 f 31.60747 4.977123 13.51888       3.706939 6.924331       6.376225 16.88573       4.555994 21.96670 8.452383 35.01077 5.522917 -13.04407      10.09680 
1 1 1 -19 31 17 o 13.73404 5.883597 0.7437122      3.513974 -1.411885      5.959193 1.892796       4.350905 15.42431 7.058471 15.89089 6.664776 -0.4665785     9.707793 
1 1 1 -19 31 18 o 58.45626 3.505250 43.82817       4.970346 36.79426       8.457419 47.53930       6.143164 49.83314 7.170559 60.23134 4.211911 -10.39820      8.316076 
1 1 1 -19 31 19 o 23.44072 6.707957 8.255146       4.025830 19.00321       11.34187 6.705773       4.306234 30.02736 11.34016 21.14973 7.091019 8.877632       13.37467 
1 1 1 -19 31 20 o 36.43464 4.713480 17.95433       4.086998 23.80269       7.371189 15.35837       4.910998 38.65570 8.085394 32.31501 6.462288 6.340694       10.35059 
1 1 1 -19 31 21 o 46.85393 3.978082 28.83910       4.499192 23.69693       7.657938 31.54973       5.559984 37.89919 8.501575 48.25472 4.791443 -10.35553      9.758827 
1 1 1 -19 31 22 f 21.44634 7.073388 7.114456       4.288751 2.269902       10.47321 8.090501       4.700973 20.05493 9.243370 22.58756 7.403285 -2.532633      11.84266 
1 1 1 -19 31 23 o 23.26418 7.265226 8.639812       4.568542 8.044484       6.779420 9.135066       6.183423 22.06035 8.651571 23.15738 8.441945 -1.097033      12.08785 
1 1 1 -19 31 24 o 21.75944 6.472990 7.250471       3.685236 4.202847       6.573457 8.647384       4.450387 18.88081 8.066777 23.26990 7.154743 -4.389082      10.78254 
1 1 1 -19 32 1  o 20.40182 7.260103 6.002085       4.540799 0.000000       0.000000 6.002085       4.540799 ?        ?        20.40182 7.260103 0.000000       7.260103 
1 1 1 -19 32 2  o 10.13586 4.763681 -2.542135      3.004039 -6.303073      4.412476 0.7070199      4.101279 10.82495 5.263799 14.53045 6.291451 -3.705499      8.203044 
1 1 1 -19 32 3  o 19.53716 6.468223 5.404317       3.585221 3.136674       5.488789 7.091799       4.734877 18.09750 7.530127 21.85931 7.435383 -3.761803      10.58243 
1 1 1 -19 32 4  o 16.47444 6.941008 2.002896       4.752794 3.949806       5.466455 -4.027319      9.620536 18.81635 7.636832 17.89176 8.444488 0.9245872      11.38554 
1 1 1 -19 32 5  o 15.61631 6.250953 2.377937       3.607501 5.176197       5.707541 0.5163277      4.655317 20.10908 7.922489 15.15679 6.630640 4.952286       10.33108 
1 1 1 -19 32 6  o 34.35735 5.376613 16.15257       4.354080 19.37659       7.028838 14.14509       5.546397 35.15527 8.332559 30.56183 7.503388 4.593439       11.21305 
1 1 1 -19 32 7  f 28.79178 5.965194 11.70329       4.047611 2.171187       6.669291 17.26152       5.092768 18.43653 8.002608 34.93751 6.209229 -16.50098      10.12898 
1 1 1 -19 32 8  o 34.97268 5.043114 16.51603       4.173935 -0.1553749     6.795196 26.61742       5.289401 17.12333 7.717041 44.58630 4.951612 -27.46297      9.169034 
1 1 1 -19 32 9  o 28.46114 6.960021 11.99216       4.786446 0.000000       0.000000 11.99216       4.786446 ?        ?        28.46114 6.960021 0.000000       6.960021 
1 1 1 -19 32 10 o 18.40997 6.488707 4.588096       3.619803 8.789582       6.874395 2.976237       4.257911 23.79091 8.861036 16.91480 6.784152 6.876108       11.15987 
1 1 1 -19 32 11 o 43.92138 4.325357 25.34593       4.569491 22.55980       8.948357 26.32873       5.314673 36.09654 9.884521 44.23312 5.019146 -8.136585      11.08583 
1 1 1 -19 32 12 o 10.81194 5.087084 -2.863767      3.442585 -8.566693      6.921964 -0.9895710     3.968149 13.55032 6.589913 13.00040 5.874515 0.5499201      8.828187 
1 1 1 -19 32 13 o 21.24610 7.339612 6.657557       4.618282 -1.782770      7.079228 12.91108       6.093525 16.42080 7.579511 28.31955 8.297432 -11.89876      11.23817 
1 1 1 -19 32 14 o 11.49364 5.325505 -2.055650      3.544201 -4.084113      7.069711 -1.374714      4.096107 15.32175 7.233757 12.88884 5.880590 2.432915       9.322477 
1 1 1 -19 32 15 o 31.48326 5.663226 13.93857       4.185164 2.560357       8.059727 18.13927       4.897158 19.35728 8.585487 35.89346 5.796195 -16.53617      10.35888 
1 1 1 -19 32 16 f 15.73264 6.288660 2.607156       3.645920 -1.244071      6.046495 4.807375       4.570220 15.44308 7.083080 18.85412 7.180449 -3.411038      10.08607 
1 1 1 -19 32 17 o 60.39290 3.415023 46.84830       5.005441 50.67579       8.680475 44.94169       6.126582 59.69231 6.050955 58.23178 4.348802 1.460529       7.451586 
1 1 1 -19 32 18 o 23.17575 6.576546 8.111030       3.885766 11.97719       6.856111 6.281468       4.716404 26.15643 8.946147 20.45656 7.384830 5.699871       11.60040 
1 1 1 -19 32 19 o 27.01776 5.937870 10.62634       3.802588 7.010891       6.646113 12.38589       4.636468 21.38216 8.509238 28.54683 6.768399 -7.164673      10.87283 
1 1 1 -19 32 20 o 11.76909 5.332847 -0.8776565     3.297122 0.5214281      5.790344 -1.548947      4.010861 15.98311 7.169960 12.45657 5.733630 3.526540       9.180569 
1 1 1 -19 32 21 o 12.20397 5.559437 -1.030325      3.642737 -12.82483      6.311940 4.859832       4.460529 11.29835 5.638253 18.55059 7.086742 -7.252234      9.056037 
1 1 1 -19 33 1  o 20.50867 6.030537 6.175870       3.213857 5.120154       5.175928 6.838293       4.099983 19.28397 7.560461 21.19205 6.911903 -1.908077      10.24378 
1 1 1 -19 33 2  o 9.418073 4.516714 -3.522478      2.983964 -7.210068      4.667921 -0.9742980     3.880318 10.78186 5.279770 12.72342 5.773221 -1.941560      7.823430 
1 1 1 -19 33 3  o 24.06147 7.272223 9.019652       4.623930 5.334720       5.993436 14.43806       7.267696 19.93564 8.030371 28.59237 9.192637 -8.656734      12.20621 
1 1 1 -19 33 4  o 19.29930 6.394684 5.384710       3.503961 1.361228       5.582393 8.000455       4.501083 16.55709 7.251621 22.78513 7.224564 -6.228046      10.23623 
1 1 1 -19 33 5  o 27.15315 6.389091 10.86134       4.156627 7.700667       6.209737 13.42714       5.594933 22.25026 8.393660 29.10631 7.750575 -6.856050      11.42475 
1 1 1 -19 33 6  o 40.82611 4.427359 22.18232       4.334301 23.10312       7.743886 21.76227       5.230298 37.56285 8.640062 39.49189 5.590932 -1.929039      10.29122 
1 1 1 -19 33 7  o 47.86782 4.086225 30.05696       4.720991 20.48573       8.441875 34.41246       5.694739 33.88256 9.719231 50.71000 4.660415 -16.82744      10.77882 
1 1 1 -19 33 8  o 26.86113 6.052640 10.44311       3.866655 4.799371       6.877726 13.05127       4.675512 20.02653 8.388074 29.66581 6.634085 -9.639278      10.69443 
1 1 1 -19 33 9  o 17.43265 6.723445 3.801162       4.041189 0.000000       0.000000 3.801162       4.041189 ?        ?        17.43265 6.723445 0.000000       6.723445 
1 1 1 -19 33 10 o 20.25702 6.451212 6.023786       3.585714 5.908651       6.679961 6.070389       4.249897 20.74854 8.434286 20.28291 7.039073 0.4656315      10.98571 
1 1 1 -19 33 11 o 14.05779 5.967959 1.139423       3.557921 -1.671544      6.503070 2.340305       4.250506 15.67858 7.246709 16.03084 6.644576 -0.3522615     9.831845 
1 1 1 -19 33 12 o 37.52777 5.968034 20.10331       5.275272 14.65624       7.521515 25.37676       7.400675 28.59889 9.363944 40.25143 7.826828 -11.65254      12.20421 
1 1 1 -19 33 13 o 18.39536 6.525918 4.772971       3.666287 -2.286893      7.068837 7.370963       4.288137 15.90253 7.419806 21.93006 7.062138 -6.027531      10.24340 
1 1 1 -19 33 14 o 37.44599 5.740933 19.87883       5.071894 20.09391       9.056730 19.78056       6.121902 32.28973 10.24917 35.91814 7.244441 -3.628418      12.55100 
1 1 1 -19 33 15 o 20.22544 6.779367 6.130196       3.936058 11.57672       8.018524 4.401233       4.517804 25.19917 9.530962 18.22924 7.087482 6.969933       11.87736 
1 1 1 -19 33 16 o 13.05171 5.920702 -0.8609090     4.077994 -3.680556      7.096807 0.5290810      4.982778 15.21899 7.203873 15.19519 6.744424 0.2379799E-01  9.868284 
1 1 1 -19 33 17 o 26.42799 6.283975 10.43294       3.987477 9.942204       6.754610 10.69544       4.940139 23.87771 8.803706 25.79235 7.446336 -1.914648      11.53053 
1 1 1 -19 33 18 o 14.92474 6.443431 1.305945       4.277051 12.32027       11.57434 -0.4359325     4.602843 24.66152 10.62302 13.99952 6.326359 10.66199       12.36412 
1 1 1 -19 33 19 o 17.88039 6.569201 4.525301       3.755421 4.696412       6.616959 4.443996       4.561190 19.28464 8.160701 18.10931 7.098080 1.175333       10.81572 
1 1 1 -19 34 1  o 15.57223 5.978740 3.002154       3.185384 2.029570       5.446484 3.507776       3.927044 16.57210 7.212192 16.71565 6.575851 -0.1435490     9.759996 
1 1 1 -19 34 2  o 13.36925 5.596869 1.275651       3.059701 2.898590       5.170685 0.4011616      3.795547 17.06474 7.217270 13.54880 5.955353 3.515938       9.357095 
1 1 1 -19 34 3  o 21.31367 7.266984 7.137624       4.523228 5.470038       5.914022 9.487994       7.021129 19.68867 7.960563 23.31869 8.895305 -3.630022      11.93721 
1 1 1 -19 34 4  o 31.87654 5.071277 14.13494       3.807520 6.297088       6.332314 18.57333       4.765146 20.56082 8.264029 36.16084 5.587481 -15.60002      9.975677 
1 1 1 -19 34 5  o 17.85079 6.378118 4.500238       3.508015 11.51331       6.305118 1.356002       4.221789 25.72977 8.579555 14.94727 6.426907 10.78250       10.71979 
1 1 1 -19 34 6  o 20.48583 6.383844 6.288127       3.529329 -0.5795217     5.839510 10.24052       4.429990 15.39203 7.022189 25.69582 6.920908 -10.30379      9.859518 
1 1 1 -19 34 7  o 22.66198 6.585443 7.823884       3.852346 -0.6712301     6.746404 11.93404       4.692635 16.24056 7.461009 27.79457 6.947707 -11.55401      10.19496 
1 1 1 -19 34 8  o 23.96737 6.830480 8.869881       4.182662 0.000000       0.000000 8.869881       4.182662 ?        ?        23.96737 6.830480 0.000000       6.830480 
1 1 1 -19 34 9  o 38.67182 4.685295 20.31305       4.325437 16.14422       7.962223 22.05842       5.151941 29.29328 9.636717 39.59875 5.486109 -10.30547      11.08890 
1 1 1 -19 34 10 o 21.94225 6.620256 7.338838       3.834371 3.272114       7.123400 8.997825       4.549739 18.76702 8.206230 23.86271 7.213966 -5.095690      10.92628 
1 1 1 -19 34 11 o 24.25008 6.678817 9.016630       4.072020 7.030365       7.333695 9.901937       4.896109 21.41356 8.786678 24.80171 7.480431 -3.388149      11.53961 
1 1 1 -19 34 12 o 24.48238 6.496711 9.107550       3.939686 7.393362       7.356589 9.796858       4.665027 21.64584 8.831613 24.81342 7.257188 -3.167587      11.43084 
1 1 1 -19 34 13 o 12.50008 5.644170 -0.6735704     3.654980 2.175286       7.183914 -1.668545      4.245530 18.05144 8.049896 12.71286 5.868598 5.338586       9.961991 
1 1 1 -19 34 14 o 28.80009 6.137396 12.27298       4.175555 12.32581       8.642878 12.25690       4.769045 25.20358 9.801877 28.01027 7.005419 -2.806688      12.04793 
1 1 1 -19 34 15 f 25.59583 6.765902 10.16007       4.283465 -0.5126154     7.727152 14.89459       5.146597 17.00104 7.872473 30.98171 6.984251 -13.98067      10.52405 
1 1 1 -19 35 1  o 20.60184 6.094256 6.449388       3.273988 9.397648       5.645513 4.955384       4.018800 23.21603 8.109471 18.31060 6.783563 4.905428       10.57262 
1 1 1 -19 35 2  o 14.19916 6.175443 1.013877       3.987691 -0.3005735     5.149613 2.982634       6.302293 14.57946 6.629292 17.68504 7.726262 -3.105582      10.18050 
1 1 1 -19 35 3  f 23.54335 6.114758 8.384192       3.539128 6.958589       5.967108 9.157828       4.395753 20.74740 8.122622 23.86480 7.062056 -3.117405      10.76335 
1 1 1 -19 35 4  o 12.05299 5.404319 -0.3941978     3.285333 -1.435702      5.555836 0.1658025      4.073924 14.41562 6.675312 13.65282 6.076840 0.7628031      9.027058 
1 1 1 -19 35 5  o 25.96263 5.881090 9.966871       3.634270 13.30668       7.011458 8.739927       4.249720 26.68386 9.048375 23.45718 6.944353 3.226675       11.40601 
1 1 1 -19 35 6  o 23.38459 6.223549 8.290962       3.608715 13.90833       6.531295 5.822463       4.329617 27.82766 8.686262 19.53613 7.072415 8.291527       11.20135 
1 1 1 -19 35 7  o 22.73189 6.471065 7.950355       3.756166 2.994298       6.620809 10.30261       4.561263 18.02454 7.895752 25.40819 7.095750 -7.383652      10.61568 
1 1 1 -19 35 8  o 31.69292 5.587412 14.43669       4.157646 6.468816       7.173061 18.46788       5.102112 20.66530 8.604201 35.39417 6.137749 -14.72887      10.56902 
1 1 1 -19 35 9  o 14.91045 6.116900 2.181670       3.553158 -0.2744831     6.222634 3.369916       4.328124 15.78248 7.218765 16.81191 6.805513 -1.029433      9.920967 
1 1 1 -19 35 10 o 19.79386 6.612544 5.961308       3.745130 8.210505       7.208109 5.129603       4.383207 22.02619 8.829402 18.75298 7.056842 3.273209       11.30298 
1 1 1 -18 0  1  o 93.22635 3.111695 106.3189       7.051361 106.3189       7.051361 106.3189       7.051361 93.22635 3.111695 93.22635 3.111695 0.000000       0.000000 
1 1 1 -18 0  2  o 22.14256 6.505493 7.341673       3.049914 7.341673       3.049914 7.341673       3.049914 22.14256 6.505493 22.14256 6.505493 0.000000       0.000000 
1 1 1 -18 0  3  o 66.35084 3.567953 54.14853       5.730656 54.14853       5.730656 54.14853       5.730656 66.35084 3.567953 66.35084 3.567953 -0.000000      0.000000 
1 1 1 -18 0  4  o 73.81335 4.687856 67.27659       8.353335 67.27659       8.353335 67.27659       8.353335 73.81335 4.687856 73.81335 4.687856 -0.000000      0.000000 
1 1 1 -18 0  5  o 70.50587 3.833455 61.16053       6.541663 61.16053       6.541663 61.16053       6.541663 70.50587 3.833455 70.50587 3.833455 -0.000000      0.000000 
1 1 1 -18 0  6  o 62.32476 3.782956 47.89165       5.696520 47.89165       5.696520 47.89165       5.696520 62.32476 3.782956 62.32476 3.782956 0.000000       0.000000 
1 1 1 -18 0  7  f 178.3552 4.597707 388.8762       19.95311 388.8762       19.95311 388.8762       19.95311 178.3552 4.597707 178.3552 4.597707 -0.000000      0.000000 
1 1 1 -18 0  8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -18 0  9  o 509.0444 10.60653 3183.763       131.4435 3183.763       131.4435 3183.763       131.4435 509.0444 10.60653 509.0444 10.60653 0.000000       0.000000 
1 1 1 -18 0  10 o 38.66505 4.817281 19.07177       4.349010 19.07177       4.349010 19.07177       4.349010 38.66505 4.817281 38.66505 4.817281 -0.000000      0.000000 
1 1 1 -18 0  11 o 86.19399 3.647692 91.08587       7.630524 91.08587       7.630524 91.08587       7.630524 86.19399 3.647692 86.19399 3.647692 0.000000       0.000000 
1 1 1 -18 0  12 o 72.33978 3.644506 64.30123       6.387293 64.30123       6.387293 64.30123       6.387293 72.33978 3.644506 72.33978 3.644506 0.000000       0.000000 
1 1 1 -18 0  13 o 39.93245 4.711685 20.25422       4.417542 20.25422       4.417542 20.25422       4.417542 39.93245 4.711685 39.93245 4.711685 0.000000       0.000000 
1 1 1 -18 0  14 o 81.56393 5.407243 82.28483       10.63759 82.28483       10.63759 82.28483       10.63759 81.56393 5.407243 81.56393 5.407243 -0.000000      0.000000 
1 1 1 -18 0  15 o 147.1754 5.994876 265.9092       21.41939 265.9092       21.41939 265.9092       21.41939 147.1754 5.994876 147.1754 5.994876 0.000000       0.000000 
1 1 1 -18 0  16 o 107.9075 3.805151 142.5567       9.977727 142.5567       9.977727 142.5567       9.977727 107.9075 3.805151 107.9075 3.805151 0.000000       0.000000 
1 1 1 -18 0  17 o 152.3863 4.233741 283.9862       15.69451 283.9862       15.69451 283.9862       15.69451 152.3863 4.233741 152.3863 4.233741 -0.000000      0.000000 
1 1 1 -18 0  18 o 260.1238 5.946611 828.0906       37.65070 828.0906       37.65070 828.0906       37.65070 260.1238 5.946611 260.1238 5.946611 0.000000       0.000000 
1 1 1 -18 0  19 o 165.6349 6.341513 336.8699       25.51118 336.8699       25.51118 336.8699       25.51118 165.6349 6.341513 165.6349 6.341513 0.000000       0.000000 
1 1 1 -18 0  20 o 374.2311 11.46522 1730.819       104.3360 1730.819       104.3360 1730.819       104.3360 374.2311 11.46522 374.2311 11.46522 0.000000       0.000000 
1 1 1 -18 0  21 o 90.59089 5.597860 101.4195       12.24853 101.4195       12.24853 101.4195       12.24853 90.59089 5.597860 90.59089 5.597860 0.000000       0.000000 
1 1 1 -18 0  22 o 37.75882 5.791993 18.60345       4.957303 18.60345       4.957303 18.60345       4.957303 37.75882 5.791993 37.75882 5.791993 -0.000000      0.000000 
1 1 1 -18 0  23 f 15.74727 8.518755 4.311854       4.565994 4.311854       4.565994 4.311854       4.565994 15.74727 8.518755 15.74727 8.518755 -0.000000      0.000000 
1 1 1 -18 0  24 o 115.6855 4.007398 163.9483       11.26661 163.9483       11.26661 163.9483       11.26661 115.6855 4.007398 115.6855 4.007398 0.000000       0.000000 
1 1 1 -18 0  25 o 54.60601 4.812141 37.27034       6.283947 37.27034       6.283947 37.27034       6.283947 54.60601 4.812141 54.60601 4.812141 0.000000       0.000000 
1 1 1 -18 0  26 o 85.57064 4.038680 90.00424       8.378813 90.00424       8.378813 90.00424       8.378813 85.57064 4.038680 85.57064 4.038680 -0.000000      0.000000 
1 1 1 -18 0  27 o 20.90536 9.109584 7.696354       4.814419 7.696354       4.814419 7.696354       4.814419 20.90536 9.109584 20.90536 9.109584 -0.000000      0.000000 
1 1 1 -18 0  28 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -18 0  29 o 41.65097 6.057175 22.56820       5.769125 22.56820       5.769125 22.56820       5.769125 41.65097 6.057175 41.65097 6.057175 -0.000000      0.000000 
1 1 1 -18 0  30 o 37.02993 6.648565 18.37135       5.424692 18.37135       5.424692 18.37135       5.424692 37.02993 6.648565 37.02993 6.648565 -0.000000      0.000000 
1 1 1 -18 0  31 f 46.74549 5.395437 27.86287       5.933527 27.86287       5.933527 27.86287       5.933527 46.74549 5.395437 46.74549 5.395437 -0.000000      0.000000 
1 1 1 -18 0  32 o 54.89775 8.037560 39.67058       10.07926 39.67058       10.07926 39.67058       10.07926 54.89775 8.037560 54.89775 8.037560 0.000000       0.000000 
1 1 1 -18 0  33 o 11.95009 7.518357 0.9548678      4.599051 0.9548678      4.599051 0.9548678      4.599051 11.95009 7.518357 11.95009 7.518357 -0.000000      0.000000 
1 1 1 -18 0  34 o 177.7316 4.829304 389.8463       20.88141 389.8463       20.88141 389.8463       20.88141 177.7316 4.829304 177.7316 4.829304 0.000000       0.000000 
1 1 1 -18 0  35 o 11.97821 7.370162 1.531975       4.177968 1.531975       4.177968 1.531975       4.177968 11.97821 7.370162 11.97821 7.370162 0.000000       0.000000 
1 1 1 -18 0  36 o 28.65507 8.024531 12.41057       4.849005 12.41057       4.849005 12.41057       4.849005 28.65507 8.024531 28.65507 8.024531 -0.000000      0.000000 
1 1 1 -18 0  37 o 32.35161 7.523671 15.08780       5.158213 15.08780       5.158213 15.08780       5.158213 32.35161 7.523671 32.35161 7.523671 -0.000000      0.000000 
1 1 1 -18 0  38 o 48.00538 6.864337 30.92063       7.555212 30.92063       7.555212 30.92063       7.555212 48.00538 6.864337 48.00538 6.864337 0.000000       0.000000 
1 1 1 -18 0  39 o 37.85048 6.774837 19.84940       5.653404 19.84940       5.653404 19.84940       5.653404 37.85048 6.774837 37.85048 6.774837 0.000000       0.000000 
1 1 1 -18 0  40 o 48.82524 5.459184 31.31961       6.287426 31.31961       6.287426 31.31961       6.287426 48.82524 5.459184 48.82524 5.459184 0.000000       0.000000 
1 1 1 -18 0  41 o 52.59546 5.550012 36.47403       6.914782 36.47403       6.914782 36.47403       6.914782 52.59546 5.550012 52.59546 5.550012 -0.000000      0.000000 
1 1 1 -18 0  42 o 9.801684 6.933409 -6.731973      6.781079 -6.731973      6.781079 -6.731973      6.781079 9.801684 6.933409 9.801684 6.933409 0.000000       0.000000 
1 1 1 -18 0  43 o 13.01505 8.123556 2.496377       5.257260 2.496377       5.257260 2.496377       5.257260 13.01505 8.123556 13.01505 8.123556 -0.000000      0.000000 
1 1 1 -18 0  44 o 35.82835 8.111918 19.93768       6.176383 19.93768       6.176383 19.93768       6.176383 35.82835 8.111918 35.82835 8.111918 -0.000000      0.000000 
1 1 1 -18 0  45 o 8.790872 6.173957 -4.031411      5.079060 -4.031411      5.079060 -4.031411      5.079060 8.790872 6.173957 8.790872 6.173957 -0.000000      0.000000 
1 1 1 -18 0  46 o 12.32430 7.893851 2.120449       5.341362 2.120449       5.341362 2.120449       5.341362 12.32430 7.893851 12.32430 7.893851 -0.000000      0.000000 
1 1 1 -18 1  1  o 179.2753 2.944023 392.0602       12.86168 426.1270       20.87729 371.2220       16.32818 186.7468 4.587592 174.3746 3.842539 12.37216       5.984238 
1 1 1 -18 1  2  o 252.9008 3.679290 780.6891       22.67515 798.3593       36.00497 769.0738       29.19141 255.4134 5.784725 250.8600 4.775156 4.553360       7.501010 
1 1 1 -18 1  3  o 84.11574 2.568896 86.36416       5.259574 84.07642       7.125772 89.10222       7.795603 82.92640 3.534273 85.35497 3.757077 -2.428574      5.158169 
1 1 1 -18 1  4  o 236.2967 3.913126 681.6567       22.53292 704.0480       32.44249 660.7881       31.31989 239.9109 5.549172 232.4266 5.529658 7.484268       7.833928 
1 1 1 -18 1  5  o 142.5404 3.313676 247.9028       11.51023 252.6915       14.50416 239.7570       18.91686 143.7953 4.143476 139.8948 5.560033 3.900574       6.934144 
1 1 1 -18 1  6  o 372.9127 5.642977 1701.169       51.28043 1694.976       72.32292 1707.432       72.72167 371.4937 7.988927 372.8506 8.003738 -1.356964      11.30853 
1 1 1 -18 1  7  o 136.3647 2.834151 226.8013       9.418049 216.3134       13.10980 237.9870       13.53882 133.0439 4.048283 139.5620 3.984945 -6.518173      5.680526 
1 1 1 -18 1  8  o 154.5447 2.998105 291.3423       11.29112 283.6737       15.86418 299.2151       16.07401 152.3489 4.277327 156.4761 4.219262 -4.127243      6.008135 
1 1 1 -18 1  9  o 117.7992 2.705756 169.2359       7.767248 169.4893       11.11048 168.9935       10.86280 117.7667 3.876737 117.6014 3.795441 0.1653137      5.425354 
1 1 1 -18 1  10 o 370.7696 5.599563 1681.700       50.59345 1696.686       72.04042 1667.116       71.06936 371.6649 7.954054 368.4262 7.915818 3.238770       11.22173 
1 1 1 -18 1  11 o 88.85727 2.553628 96.36423       5.523776 101.7526       8.004093 91.46430       7.632730 91.23618 3.607162 86.49146 3.629417 4.744728       5.117059 
1 1 1 -18 1  12 o 160.8511 3.047049 315.6362       11.94372 306.9277       16.75103 324.6419       17.03446 158.4575 4.342126 162.9751 4.292885 -4.517670      6.105974 
1 1 1 -18 1  13 o 173.4384 3.174624 367.0230       13.41756 360.9611       18.90542 373.1754       19.04596 171.8203 4.519111 174.7106 4.477189 -2.890366      6.361414 
1 1 1 -18 1  14 o 113.7471 3.124093 157.9807       8.651449 151.4323       10.40442 172.6535       15.57418 111.3019 3.841765 118.6752 5.399437 -7.373291      6.626694 
1 1 1 -18 1  15 o 273.1160 5.017080 912.1586       33.39137 907.4294       58.05570 914.4965       40.81874 271.2571 8.794314 273.2228 6.130651 -1.965637      10.72030 
1 1 1 -18 1  16 o 118.7551 2.736516 172.0265       7.919290 170.4131       11.23409 173.6203       11.16536 118.0640 3.910063 119.1771 3.849584 -1.113106      5.487066 
1 1 1 -18 1  17 o 62.52470 3.290552 47.84414       4.996030 47.75253       6.258246 48.00510       8.295680 62.38441 4.140040 62.38250 5.513696 0.1914978E-02  6.894982 
1 1 1 -18 1  18 o 91.89748 2.678524 103.1060       5.991997 105.3397       8.522539 100.9224       8.426210 92.79759 3.776631 90.82405 3.815609 1.973541       5.368595 
1 1 1 -18 1  19 o 77.12839 2.698111 72.66005       5.063384 68.40085       7.179286 76.87544       7.142269 74.72285 3.956786 79.25329 3.708419 -4.530434      5.422963 
1 1 1 -18 1  20 o 78.79827 3.778303 76.01807       7.234064 0.000000       0.000000 76.01807       7.234064 ?        ?        78.79827 3.778303 0.000000       3.778303 
1 1 1 -18 1  21 o 32.77113 5.084851 13.45447       3.929227 12.21572       4.816950 15.91769       6.792526 30.96143 6.586945 35.24215 8.081764 -4.280725      10.42606 
1 1 1 -18 1  22 o 117.6799 2.805594 168.9985       8.045686 170.4916       11.55993 167.5957       11.20500 118.0341 4.024830 117.0375 3.934310 0.9966125      5.628325 
1 1 1 -18 1  23 o 149.4883 3.035627 272.8113       11.05838 285.9427       16.12494 261.1518       15.19435 152.8294 4.334051 146.0584 4.273529 6.771027       6.086628 
1 1 1 -18 1  24 o 97.03399 2.789942 115.0217       6.590284 114.0548       9.424013 115.9471       9.219490 96.49085 4.016654 97.30473 3.895972 -0.8138733     5.595722 
1 1 1 -18 1  25 o 74.79237 2.887505 68.39913       5.252905 68.64017       7.565345 68.17475       7.299258 74.78236 4.167878 74.54490 4.033155 0.2374649      5.799788 
1 1 1 -18 1  26 o 56.18043 3.256774 38.69370       4.439593 38.46087       6.447792 38.90360       6.121939 55.81260 4.786887 56.17642 4.509829 -0.3638153     6.576690 
1 1 1 -18 1  27 o 165.3361 3.776001 334.4975       15.21373 385.5901       28.74815 314.6222       17.93031 176.5907 6.692564 160.1194 4.600003 16.47130       8.120988 
1 1 1 -18 1  28 o 104.7511 3.869678 134.5513       9.861032 138.5701       14.13113 130.7367       13.76720 105.9689 5.490935 102.9177 5.509408 3.051186       7.778428 
1 1 1 -18 1  29 o 131.9770 3.027196 212.9765       9.735875 214.5436       13.92069 211.4761       13.62140 132.1501 4.328561 131.2165 4.265544 0.9335785      6.077114 
1 1 1 -18 1  30 o 105.8309 2.928453 137.0968       7.545173 141.7531       10.83709 132.7163       10.51133 107.3683 4.149723 103.8819 4.160650 3.486374       5.876326 
1 1 1 -18 1  31 o 35.40718 4.398437 15.66114       3.713551 14.46724       5.343319 16.77656       5.164740 33.48232 6.781528 36.29625 6.052150 -2.813934      9.089424 
1 1 1 -18 1  32 o 29.16033 6.266392 11.00563       4.320233 5.335849       8.347853 13.07969       5.048964 24.67469 9.622631 31.74233 6.735956 -7.067635      11.74598 
1 1 1 -18 1  33 o 65.89460 3.092917 53.40368       4.952684 49.89605       6.846612 57.25380       7.173095 63.36707 4.462332 67.92901 4.356225 -4.561935      6.236113 
1 1 1 -18 1  34 o 24.17115 5.688251 7.611809       3.294352 8.984428       4.651958 6.230944       4.665909 26.11389 7.117156 22.39884 7.377411 3.715044       10.25086 
1 1 1 -18 1  35 o 94.42869 2.920221 109.7784       6.711714 105.0914       9.430499 114.5893       9.554307 91.87254 4.223537 96.00391 4.093286 -4.131363      5.881603 
1 1 1 -18 1  36 o 32.13872 4.680642 13.20193       3.558192 10.75919       5.077447 15.55920       4.987836 28.18973 7.325376 34.40973 6.175231 -6.220005      9.580950 
1 1 1 -18 1  37 o 29.89221 5.017100 11.60642       3.525304 18.60715       5.133349 5.357747       4.849791 37.69465 5.771819 21.01147 7.500248 16.68319       9.464017 
1 1 1 -18 1  38 o 50.19574 4.500907 32.16806       5.447199 26.28168       7.566564 38.50072       7.848156 43.71553 7.364210 53.99023 6.070121 -10.27470      9.543477 
1 1 1 -18 1  39 o 26.37645 5.798036 9.474572       3.624989 13.55385       5.193176 5.598241       5.062345 31.01591 7.033400 20.94696 7.638077 10.06895       10.38311 
1 1 1 -18 1  40 o 34.76439 4.824908 15.97061       3.977483 15.30052       5.494959 16.70813       5.764755 32.60890 7.115453 34.07806 7.169272 -1.469158      10.10090 
1 1 1 -18 1  41 o 43.22895 4.167005 24.28674       4.335366 23.23317       6.127177 25.34303       6.135099 40.65155 6.396180 42.76569 6.056177 -2.114136      8.808428 
1 1 1 -18 1  42 o 22.45786 8.016211 7.677886       5.539944 -4.998787      7.462361 23.24284       8.268897 15.41246 7.322091 37.41884 9.146488 -22.00638      11.71628 
1 1 1 -18 1  43 o 22.15844 6.715645 7.475475       3.939407 12.49365       5.584244 2.504045       5.558172 27.66420 7.895082 17.23713 7.392264 10.42707       10.81563 
1 1 1 -18 1  44 o 24.22567 6.624723 9.158247       4.022650 8.876981       5.825064 9.414667       5.561833 22.66911 8.203835 23.37503 8.055460 -0.7059193     11.49754 
1 1 1 -18 1  45 o 18.58837 6.738940 5.337650       3.932778 7.178716       5.752625 3.722119       5.388763 20.55255 7.995704 17.42000 7.367728 3.132544       10.87266 
1 1 1 -18 1  46 o 29.21172 6.100922 13.15912       4.202653 12.10432       6.009670 14.16867       5.879370 25.14929 8.375891 27.75192 8.155554 -2.602631      11.69053 
1 1 1 -18 2  1  o 57.59249 2.670163 40.54019       3.737284 39.43236       4.903748 42.07534       5.772525 56.72826 3.565287 58.55799 4.070573 -1.829735      5.411177 
1 1 1 -18 2  2  o 154.6623 2.737199 291.7462       10.31637 286.9444       13.25194 299.1326       16.43600 153.3327 3.546569 156.4338 4.315632 -3.101120      5.585949 
1 1 1 -18 2  3  o 324.5587 5.017890 1287.686       39.68721 1245.184       55.04272 1333.708       57.27626 318.6410 7.088627 329.7614 7.127525 -11.12039      10.05238 
1 1 1 -18 2  4  o 193.1434 3.070289 455.0819       14.45091 473.8831       23.28671 443.3070       18.42864 196.9151 4.852805 190.5513 3.968673 6.363800       6.268978 
1 1 1 -18 2  5  o 258.3631 3.738740 814.7713       23.53921 818.8151       37.35595 812.1082       30.31499 258.6577 5.926500 257.7888 4.825666 0.8689270      7.642673 
1 1 1 -18 2  6  o 189.8729 3.869607 440.0995       17.90466 434.8737       22.04100 450.2386       30.70110 188.5861 4.799971 191.5946 6.585377 -3.008499      8.149043 
1 1 1 -18 2  7  o 206.8870 3.556282 522.3519       17.92939 541.2477       25.97819 505.1639       24.77644 210.4237 5.066151 203.2969 5.001176 7.126877       7.118824 
1 1 1 -18 2  8  o 154.8967 3.005671 292.6751       11.34540 300.5458       16.39991 285.4510       15.71183 156.8141 4.295655 152.8304 4.222771 3.983719       6.023657 
1 1 1 -18 2  9  o 189.2767 3.346431 437.1382       15.43530 450.8462       22.31586 424.5648       21.37233 192.0809 4.767528 186.3458 4.710255 5.735123       6.701927 
1 1 1 -18 2  10 f 64.29324 2.607272 50.49253       4.076486 51.37225       5.944238 49.71145       5.601096 64.76311 3.782921 63.71816 3.622148 1.044956       5.237409 
1 1 1 -18 2  11 o 192.6826 3.376189 453.0385       15.85278 501.3233       23.83582 414.7396       21.22845 202.5338 4.829438 184.1662 4.734044 18.36755       6.762739 
1 1 1 -18 2  12 o 173.0657 3.175547 365.4363       13.39262 377.7685       19.40377 354.2165       18.50802 175.7812 4.533569 170.2184 4.465731 5.562759       6.363647 
1 1 1 -18 2  13 o 142.2868 3.356925 247.0627       11.63971 250.7943       14.39163 240.0052       19.79184 143.2417 4.127219 139.9042 5.817927 3.337524       7.133177 
1 1 1 -18 2  14 o 295.0595 4.614924 1063.957       33.18259 1039.082       46.37263 1090.058       47.50229 291.1530 6.535885 298.2092 6.536683 -7.056213      9.243701 
1 1 1 -18 2  15 o 19.11137 6.063379 4.392286       3.170052 4.670290       6.293310 4.297765       3.669600 22.56703 8.463467 19.40286 6.546156 3.164164       10.69965 
1 1 1 -18 2  16 o 137.5721 4.116487 231.3955       13.78492 230.5268       19.78638 232.2148       19.21579 137.0603 5.938134 137.5935 5.743548 -0.5331421     8.261342 
1 1 1 -18 2  17 o 112.0595 2.715751 153.1797       7.416089 149.7256       10.62994 156.4553       10.35147 110.6485 3.948627 113.1300 3.760038 -2.481506      5.452480 
1 1 1 -18 2  18 o 79.87822 2.669630 77.91990       5.189254 77.07491       7.520983 78.68767       7.169084 79.34086 3.901897 80.19003 3.678455 -0.8491745     5.362446 
1 1 1 -18 2  19 o 103.6014 2.729209 131.0342       6.884306 135.5312       10.11890 127.1590       9.393299 105.2543 3.952112 101.9640 3.786956 3.290298       5.473594 
1 1 1 -18 2  20 o 48.44548 3.720354 28.83409       4.358502 38.16615       8.885035 25.87688       5.001631 55.35023 6.725071 45.77845 4.543359 9.571785       8.115952 
1 1 1 -18 2  21 o 153.0222 4.284989 286.5082       15.96292 295.0891       22.97406 278.4987       22.19599 154.9691 6.095432 150.5499 6.062436 4.419250       8.596942 
1 1 1 -18 2  22 o 139.7527 2.952786 238.3830       10.05607 242.6994       14.59412 234.4811       13.87591 140.8178 4.257780 138.4310 4.117893 2.386765       5.923321 
1 1 1 -18 2  23 o 31.03843 4.542202 12.03603       3.333912 10.70838       5.030545 13.07587       4.452012 28.92383 7.172556 32.14540 5.900693 -3.221569      9.287827 
1 1 1 -18 2  24 o 177.7747 3.304117 386.0417       14.31402 375.4834       20.19924 396.6923       20.28721 175.0321 4.740029 179.9348 4.630543 -4.902710      6.626447 
1 1 1 -18 2  25 o 51.82215 3.339879 32.94687       4.195305 29.80304       6.328345 35.41189       5.603650 48.99280 5.389469 53.61483 4.325633 -4.622028      6.910678 
1 1 1 -18 2  26 o 94.75533 3.278387 109.8437       7.558669 96.15376       13.68962 115.8477       9.065896 88.12403 6.418729 97.24244 3.833279 -9.118408      7.476236 
1 1 1 -18 2  27 o 146.4338 3.518210 262.2482       12.55449 280.9500       16.11127 233.3373       20.03174 151.3494 4.372889 137.5136 5.992121 13.83583       7.418063 
1 1 1 -18 2  28 o 148.3422 3.524289 269.2558       12.74008 281.2925       22.28878 263.4149       15.52650 150.8805 6.074434 146.4991 4.353961 4.381393       7.473669 
1 1 1 -18 2  29 o 65.27637 3.125986 52.23332       4.958098 55.35899       7.198963 49.41280       6.838533 67.00596 4.433733 63.28380 4.463019 3.722160       6.290988 
1 1 1 -18 2  30 o 12.74339 5.559398 -0.6064082     3.252929 -0.2080293     4.766781 -0.9536273     4.450192 15.91303 6.835462 14.76754 6.471047 1.145494       9.412651 
1 1 1 -18 2  31 f 149.3920 3.689592 273.9251       13.43203 278.7811       16.53715 264.5104       23.02640 150.3720 4.518044 145.5535 6.508292 4.818451       7.922790 
1 1 1 -18 2  32 o 55.89877 3.924392 38.63406       5.311810 41.30061       10.36867 37.68521       6.185081 56.68781 7.705073 55.04191 4.654819 1.645901       9.001971 
1 1 1 -18 2  33 o 85.89352 3.414572 90.83544       7.132905 94.57845       8.716114 83.24594       12.41135 87.44908 4.101505 81.19942 6.322135 6.249664       7.536029 
1 1 1 -18 2  34 o 120.9737 2.964164 179.7759       8.738348 180.1829       12.47786 179.3842       12.24131 120.5212 4.255228 120.2896 4.182393 0.2315292      5.966521 
1 1 1 -18 2  35 o 33.74278 4.517595 14.42431       3.621457 12.89221       5.280892 15.78447       4.975745 31.08444 7.124299 34.82749 6.084035 -3.743050      9.368624 
1 1 1 -18 2  36 o 10.05035 4.732536 -3.084542      2.990059 2.674772       4.392824 -8.056405      4.081483 17.68917 6.956095 9.900686 4.866245 7.788486       8.489264 
1 1 1 -18 2  37 o 57.42453 3.315852 41.04603       4.620383 43.92076       6.661686 38.38128       6.413779 58.80172 4.687767 54.86917 4.846554 3.932549       6.742718 
1 1 1 -18 2  38 o 20.12265 6.859242 5.197832       4.029841 7.358364       5.746737 3.107544       5.652544 23.50744 8.183752 19.18243 7.772920 4.325010       11.28681 
1 1 1 -18 2  39 o 27.63710 5.653860 10.33908       3.679313 4.204681       5.062374 17.20770       5.356765 19.43456 7.517214 35.39687 6.447616 -15.96231      9.903548 
1 1 1 -18 2  40 o 64.54099 3.371706 52.60361       5.284608 50.48328       7.375626 54.84043       7.575511 62.01303 4.920996 64.72251 4.838093 -2.709476      6.900967 
1 1 1 -18 2  41 o 46.84861 3.993936 28.36381       4.516237 23.88777       6.289226 33.12920       6.489321 41.13390 6.489110 49.46902 5.474575 -8.335125      8.489965 
1 1 1 -18 2  42 o 38.17503 6.786764 21.28522       6.082255 16.07636       8.312657 27.28699       8.922950 30.01040 9.845130 40.55463 9.236168 -10.54423      13.49938 
1 1 1 -18 2  43 o 10.07901 4.873250 -4.699551      3.644687 -9.779461      5.313518 -0.1857421     5.008708 10.86258 5.378616 14.76040 6.641082 -3.897829      8.545962 
1 1 1 -18 2  44 o 14.78182 6.211230 1.883350       3.789855 2.042496       5.596945 1.748596       5.150209 16.56346 7.257562 15.97979 6.982795 0.5836716      10.07133 
1 1 1 -18 2  45 o 54.57442 3.968786 39.86405       5.242094 44.18340       7.737117 36.19879       7.127257 54.65014 5.903247 49.20264 6.073014 5.447495       8.469346 
1 1 1 -18 2  46 o 7.998166 4.023201 -9.261733      3.532680 -13.44147      5.076855 -5.338168      4.918819 9.317655 4.703941 11.49224 5.581219 -2.174584      7.299114 
1 1 1 -18 3  1  o 93.99122 2.407598 107.7975       5.509975 109.7292       7.105251 104.8833       8.726975 94.78697 3.080149 92.60352 3.875800 2.183449       4.950671 
1 1 1 -18 3  2  f 194.5216 3.095425 461.6346       14.67318 480.6891       19.38185 436.0508       22.45844 198.4096 4.008636 188.8120 4.885163 9.597641       6.319334 
1 1 1 -18 3  3  o 68.16300 2.432039 56.72728       4.033283 52.56381       6.214559 59.75718       5.301485 65.49934 3.911288 69.91730 3.119404 -4.417969      5.002885 
1 1 1 -18 3  4  o 58.42496 2.496808 41.70075       3.546641 43.65298       5.608694 40.40001       4.578170 59.67223 3.878040 57.44862 3.283894 2.223610       5.081649 
1 1 1 -18 3  5  o 106.3347 2.420258 137.8740       6.271519 138.9620       10.06479 137.1834       8.018508 106.6205 3.880190 105.9969 3.107660 0.6235657      4.971260 
1 1 1 -18 3  6  o 133.9472 2.868116 218.8411       9.361953 222.0611       13.45813 215.8219       13.03177 134.7933 4.101909 132.8916 4.028761 1.901657       5.749485 
1 1 1 -18 3  7  o 131.8939 3.238464 212.2441       10.40878 223.6958       13.29797 194.1296       16.72483 135.2955 4.037867 125.8677 5.465726 9.427811       6.795478 
1 1 1 -18 3  8  o 327.0161 5.033070 1307.217       40.10867 1339.581       57.80587 1277.171       55.69731 330.4889 7.177595 322.7263 7.082129 7.762634       10.08337 
1 1 1 -18 3  9  o 84.34750 2.574500 86.84071       5.285578 87.10060       7.710118 86.61026       7.260041 84.38906 3.758632 84.16811 3.547565 0.2209549      5.168417 
1 1 1 -18 3  10 o 145.4521 2.912949 258.0620       10.32498 262.0246       14.93990 254.4390       14.28551 146.4188 4.191427 144.2953 4.066688 2.123581       5.840035 
1 1 1 -18 3  11 o 196.0999 3.427416 469.2815       16.37873 466.8545       23.33692 471.6375       22.99296 195.3728 4.905540 196.4452 4.803054 -1.072327      6.865396 
1 1 1 -18 3  12 o 123.3179 3.204396 185.6751       9.621448 184.3446       11.83481 188.2688       16.52336 122.8083 3.959730 123.9324 5.484723 -1.124069      6.764736 
1 1 1 -18 3  13 o 196.6792 3.981596 472.3636       19.08323 464.9379       23.30251 487.4846       33.25257 194.9550 4.908829 199.2576 6.858388 -4.302658      8.434103 
1 1 1 -18 3  14 o 168.2350 3.138795 345.3394       12.86812 348.7257       18.55698 342.2028       17.85960 168.8721 4.513390 167.3011 4.384412 1.571014       6.292357 
1 1 1 -18 3  15 o 70.35492 3.155954 60.51970       5.397023 56.05542       6.791799 68.16851       8.890085 67.61683 4.141737 74.50482 4.924107 -6.887993      6.434347 
1 1 1 -18 3  16 o 213.7295 4.195342 558.0742       21.85083 575.2951       39.18646 550.3036       26.32307 216.2596 7.446858 212.1028 5.092770 4.156769       9.021751 
1 1 1 -18 3  17 o 172.5920 3.195159 363.5332       13.43845 354.0617       19.02477 372.9652       18.98499 170.1222 4.593247 174.6270 4.464978 -4.504761      6.405775 
1 1 1 -18 3  18 o 112.4295 2.735563 154.2052       7.494851 150.7778       10.82729 157.3584       10.38517 111.0233 4.008511 113.4493 3.761633 -2.426064      5.497094 
1 1 1 -18 3  19 o 222.6516 4.324037 605.9606       23.46125 592.4426       40.77840 612.6492       28.68413 219.2839 7.642788 223.7056 5.261732 -4.421753      9.278903 
1 1 1 -18 3  20 o 81.59293 2.723040 81.31419       5.406718 76.71511       8.006874 85.16893       7.330346 79.11713 4.167646 83.43120 3.614026 -4.314072      5.516380 
1 1 1 -18 3  21 o 111.0431 3.238023 150.6660       8.752728 159.0887       11.12863 137.0056       14.17255 114.0228 4.011353 105.5928 5.527039 8.430016       6.829284 
1 1 1 -18 3  22 o 54.01036 3.171545 35.73695       4.155932 37.12399       6.403173 34.72736       5.462925 54.85985 4.839219 53.12225 4.255568 1.737598       6.444214 
1 1 1 -18 3  23 o 45.55009 3.566298 25.50337       3.927074 27.73829       6.084084 23.90726       5.141572 47.26767 5.377453 43.91664 4.886986 3.351028       7.266335 
1 1 1 -18 3  24 o 59.63822 3.091552 43.54903       4.477672 42.66151       6.929778 44.18518       5.866887 58.81024 4.879258 59.97113 4.038019 -1.160892      6.333463 
1 1 1 -18 3  25 o 30.53436 4.937211 11.71518       3.548411 8.236792       5.518211 14.16751       4.633385 25.81181 7.972444 33.47382 5.895374 -7.662003      9.915407 
1 1 1 -18 3  26 o 121.4479 2.900651 180.1256       8.584631 180.1893       12.45399 180.0679       11.84956 121.2430 4.221618 121.2365 4.016360 0.6484985E-02  5.826938 
1 1 1 -18 3  27 o 108.7654 3.278162 144.7470       8.678832 146.5227       11.04858 141.8859       14.02431 109.2929 4.155954 107.3037 5.380449 1.989182       6.798616 
1 1 1 -18 3  28 o 114.0108 3.260022 159.0891       9.048079 142.8111       15.11922 168.1719       11.29371 107.4903 5.793377 117.0992 3.963444 -9.608902      7.019410 
1 1 1 -18 3  29 o 94.62258 2.897793 109.5574       6.673998 110.0395       9.704827 109.1249       9.192883 94.60674 4.220113 94.25259 4.011591 0.3541412      5.822561 
1 1 1 -18 3  30 o 41.37042 3.975790 21.19551       3.958912 20.53878       5.843452 21.75271       5.382415 40.26992 6.149264 41.63159 5.435047 -1.361664      8.206900 
1 1 1 -18 3  31 o 84.29659 2.964525 87.10646       6.080295 87.63416       8.859370 86.63657       8.360011 84.26610 4.328843 83.83775 4.104432 0.4283524      5.965337 
1 1 1 -18 3  32 o 65.47466 4.813002 53.30124       7.625700 54.64302       11.72440 52.31743       10.03935 65.39280 7.492548 64.34261 6.491475 1.050186       9.913502 
1 1 1 -18 3  33 o 94.81857 3.433313 110.6965       7.920002 110.0583       9.694899 111.9770       13.73225 94.29129 4.230023 94.36876 6.002530 -0.7746887E-01 7.343260 
1 1 1 -18 3  34 o 45.50431 3.701166 25.71971       4.068778 21.73119       5.854071 29.44701       5.659122 41.14255 6.016775 48.39211 4.864795 -7.249557      7.737429 
1 1 1 -18 3  35 o 34.26292 4.488821 14.86504       3.657892 16.54008       5.360194 13.40510       5.004214 35.53394 6.426654 31.83407 6.664811 3.699863       9.258595 
1 1 1 -18 3  36 o 55.94384 3.341174 38.85781       4.534238 41.00506       6.654169 36.99658       6.195170 56.90313 4.844702 54.07158 4.749845 2.831551       6.784701 
1 1 1 -18 3  37 o 25.10155 5.651113 8.381926       3.373214 3.318410       4.841272 13.15959       4.702637 18.72186 7.320233 31.31559 6.379206 -12.59372      9.709793 
1 1 1 -18 3  38 o 36.99419 5.689845 18.11018       4.965355 21.53170       7.204667 15.01481       6.852692 39.13605 7.828043 32.14106 8.586210 6.994987       11.61900 
1 1 1 -18 3  39 o 22.48306 6.429200 7.009639       3.699502 4.231166       5.427528 9.420726       5.055981 19.72996 7.740034 25.60702 7.572896 -5.877056      10.82852 
1 1 1 -18 3  40 o 11.89884 5.373579 -1.158385      3.314517 0.2436478      4.784881 -2.451751      4.595711 15.35054 6.718670 13.23545 6.108412 2.115088       9.080377 
1 1 1 -18 3  41 o 9.723072 4.690891 -4.497345      3.332019 -4.216980      4.488258 -4.841592      4.973367 11.98157 5.688221 12.45146 5.932963 -0.4698963     8.219240 
1 1 1 -18 3  42 o 13.50783 6.254007 -2.248842      4.873929 -2.533479      6.410369 -1.858846      7.503554 15.30099 7.114450 16.75303 7.757667 -1.452043      10.52601 
1 1 1 -18 3  43 o 28.42549 5.850181 11.68689       3.917223 8.833858       5.819621 14.05032       5.296795 23.12600 8.220174 29.92597 7.323769 -6.799965      11.00949 
1 1 1 -18 3  44 o 44.49195 4.394422 26.82533       4.702371 31.08093       6.850627 23.03381       6.466313 45.61357 6.333776 38.19391 7.211744 7.419662       9.598228 
1 1 1 -18 3  45 o 11.61934 5.422716 -1.913843      3.779536 -2.378826      5.612892 -1.528108      5.112258 13.75663 6.479709 13.62957 6.342743 0.1270618      9.067360 
1 1 1 -18 4  1  o 94.36552 2.213963 108.5745       5.091197 104.3706       6.969412 113.3849       7.455190 92.43887 3.098273 96.34632 3.179675 -3.907455      4.439553 
1 1 1 -18 4  2  o 177.0823 2.947956 382.5325       12.72132 380.0363       20.00465 384.2273       16.48359 176.2869 4.660752 177.4038 3.812878 -1.116943      6.021682 
1 1 1 -18 4  3  o 84.77022 2.411185 87.69594       4.975863 87.07085       7.845900 88.11652       6.435666 84.36585 3.826237 84.92866 3.114867 -0.5628052     4.933810 
1 1 1 -18 4  4  o 14.95139 5.062719 2.530128       2.194949 2.324160       3.285866 2.696091       2.949551 16.19695 6.106716 16.23456 5.842686 -0.3761101E-01 8.451565 
1 1 1 -18 4  5  o 172.1947 2.880864 361.6725       12.08868 367.7122       19.37131 357.8200       15.47085 173.4225 4.587742 171.2144 3.707984 2.208115       5.898857 
1 1 1 -18 4  6  o 271.9444 3.895633 902.8591       25.81631 916.0524       41.35497 894.4345       33.04634 273.5119 6.204624 270.4985 5.013284 3.013336       7.976865 
1 1 1 -18 4  7  o 215.9702 4.235949 569.6400       22.29362 575.3105       27.72995 559.2766       37.48777 216.9084 5.246099 213.4071 7.218887 3.501297       8.923782 
1 1 1 -18 4  8  o 173.5323 3.703348 367.5684       15.66070 363.0244       19.35995 376.1708       26.63767 172.3107 4.614738 175.1544 6.250804 -2.843781      7.769708 
1 1 1 -18 4  9  o 198.3392 3.459050 480.0652       16.71866 483.6499       24.04863 476.7121       23.25867 198.9146 4.961209 197.4989 4.832636 1.415665       6.925891 
1 1 1 -18 4  10 o 139.8238 2.870510 238.4735       9.780845 254.6915       14.50569 224.9530       13.24458 144.3579 4.127697 135.6733 4.010370 8.684616       5.755080 
1 1 1 -18 4  11 o 206.6030 4.129405 521.2845       20.79028 511.6226       25.38608 540.9636       36.22975 204.5574 5.092655 209.8811 7.093824 -5.323700      8.732553 
1 1 1 -18 4  12 o 54.73932 3.402593 36.70818       4.516404 33.27901       5.686932 42.56485       7.432055 51.99234 4.533816 58.76256 5.245141 -6.770222      6.933036 
1 1 1 -18 4  13 o 202.2064 3.500256 499.0484       17.24768 500.4401       24.73655 497.7317       24.06128 202.3048 5.017607 201.7740 4.893476 0.5308228      7.008743 
1 1 1 -18 4  14 o 153.7585 3.502981 288.5706       13.12541 279.0612       16.08502 307.5203       22.70642 151.0666 4.373958 158.3630 5.894099 -7.296402      7.339749 
1 1 1 -18 4  15 o 51.37812 2.905168 32.30636       3.622534 37.25345       5.815674 29.17005       4.630570 55.04425 4.371508 48.71536 3.934045 6.328888       5.881054 
1 1 1 -18 4  16 o 198.9021 4.011303 483.2329       19.44290 458.4620       33.72435 495.5653       23.79559 193.0835 7.179918 201.3096 4.850604 -8.226105      8.664847 
1 1 1 -18 4  17 o 191.9750 3.410801 449.8865       15.95648 449.7879       22.93276 449.9791       22.21605 191.7005 4.913092 191.8271 4.752486 -0.1265717     6.835539 
1 1 1 -18 4  18 o 166.6636 3.614618 339.1794       14.68044 317.7828       25.33294 349.9980       18.01343 160.8087 6.477833 169.1597 4.373486 -8.351074      7.815990 
1 1 1 -18 4  19 o 232.8843 4.455713 663.0953       25.28678 668.9741       44.72670 660.3336       30.65647 232.9349 7.890848 232.2087 5.417608 0.7261963      9.571623 
1 1 1 -18 4  20 f 115.1370 2.790407 161.7508       7.829226 161.5490       11.61095 161.9191       10.60209 114.8928 4.153883 115.0673 3.786127 -0.1744537     5.620454 
1 1 1 -18 4  21 o 44.70478 4.294075 24.65965       4.620531 21.31335       5.877810 30.07212       7.475347 41.25594 6.024094 49.08252 6.402284 -7.826572      8.790845 
1 1 1 -18 4  22 o 124.5580 2.889773 189.3596       8.771454 187.5023       12.80843 191.0000       12.03691 123.7510 4.253606 124.9414 3.958408 -1.190468      5.810521 
1 1 1 -18 4  23 o 83.02596 3.185954 84.30035       6.434025 82.14934       12.53091 85.07045       7.497832 81.51056 6.358878 83.35178 3.700572 -1.841225      7.357279 
1 1 1 -18 4  24 o 48.74578 3.696478 29.21103       4.358245 27.89317       8.128916 29.74267       5.163013 47.00943 7.335384 49.10579 4.359808 -2.096363      8.533216 
1 1 1 -18 4  25 o 39.96840 3.981735 19.73352       3.826616 22.50331       6.040674 17.87704       4.945462 42.37123 6.019480 37.76732 5.537925 4.603909       8.179410 
1 1 1 -18 4  26 o 215.5295 3.732865 568.1981       19.60583 570.6104       28.21255 565.9451       27.26535 215.5416 5.371247 214.7089 5.211047 0.8327332      7.483669 
1 1 1 -18 4  27 o 97.30321 3.278872 115.8812       7.763667 125.5539       10.16201 102.3201       12.03242 101.1568 4.131076 91.05641 5.447490 10.10039       6.836734 
1 1 1 -18 4  28 o 113.3395 3.250483 157.2323       8.968434 154.1258       15.58812 158.7694       10.96498 111.6762 5.747251 113.7680 3.961090 -2.091812      6.980052 
1 1 1 -18 4  29 o 168.5518 3.290613 347.6837       13.51595 347.9693       19.51931 347.4207       18.73376 168.1499 4.768374 168.0826 4.577945 0.6733704E-01  6.610217 
1 1 1 -18 4  30 o 56.94875 3.281666 39.84821       4.534940 48.48327       6.971323 33.51347       5.970996 62.60173 4.601915 51.95368 4.769394 10.64804       6.627574 
1 1 1 -18 4  31 f 105.5886 2.917470 136.6029       7.499684 136.6355       11.00051 136.5746       10.25138 105.2603 4.297603 105.3206 4.001508 -0.6023407E-01 5.872091 
1 1 1 -18 4  32 f 131.0996 3.524551 211.3221       11.24986 217.0551       21.38058 209.1272       13.22925 131.3351 6.702566 130.1799 4.175583 1.155151       7.896828 
1 1 1 -18 4  33 o 22.92942 6.709717 6.776326       3.986814 2.910068       4.806900 15.29774       7.136339 18.70379 7.299695 33.80077 8.633911 -15.09698      11.30619 
1 1 1 -18 4  34 o 20.76975 6.126645 5.551607       3.312721 4.821111       4.873727 6.178925       4.516438 20.78407 7.506461 22.21593 7.255015 -1.431864      10.43945 
1 1 1 -18 4  35 o 21.32874 6.171002 5.932302       3.389461 10.47544       5.177089 2.524031       4.484094 27.91916 7.465088 17.72412 7.009961 10.19504       10.24046 
1 1 1 -18 4  36 o 11.13815 5.100963 -1.957406      3.120196 -3.011024      4.743900 -1.154080      4.142281 13.57366 6.243370 13.77602 6.129893 -0.2023668     8.749586 
1 1 1 -18 4  37 f 47.45959 3.744429 28.27835       4.295516 31.45709       6.429108 25.71509       5.773238 49.29722 5.442182 44.52735 5.432912 4.769875       7.689856 
1 1 1 -18 4  38 o 32.64762 6.072645 14.34876       4.653549 13.69856       6.703864 14.95343       6.464864 30.64089 8.618718 32.21964 8.211110 -1.578751      11.90398 
1 1 1 -18 4  39 f 11.96116 5.453582 -1.681155      3.515085 -2.910491      5.295297 -0.7127080     4.699947 14.17090 6.546089 14.67152 6.528859 -0.5006227     9.245393 
1 1 1 -18 4  40 o 47.23372 3.957905 28.65742       4.513832 35.09338       6.636347 23.11664       6.157553 51.21990 5.397917 40.75416 6.411676 10.46574       8.381354 
1 1 1 -18 4  41 o 32.35175 5.206878 14.20953       3.965696 14.96568       5.687962 13.49429       5.531972 31.56891 7.504474 29.86609 7.587161 1.702822       10.67156 
1 1 1 -18 4  42 f 39.67820 6.716008 22.99706       6.262372 26.57837       8.944782 19.55399       8.770453 39.60187 9.408677 32.80814 10.03590 6.793728       13.75654 
1 1 1 -18 4  43 o 28.85006 5.913784 12.09268       4.017880 12.32005       5.831848 11.88725       5.543401 27.08555 8.162872 26.82222 7.928823 0.2633286      11.37975 
1 1 1 -18 4  44 o 18.95941 6.741621 5.473555       3.914693 1.779866       5.633328 8.923076       5.443952 16.36531 7.221868 22.77659 7.962879 -6.411283      10.75001 
1 1 1 -18 4  45 o 25.74850 6.530528 10.50461       4.103115 6.006581       5.882103 14.76764       5.726392 19.40917 7.905352 29.09241 7.882852 -9.683235      11.16396 
1 1 1 -18 5  1  f 146.1666 2.755719 260.5976       9.815654 268.1005       16.02427 256.0917       12.41808 148.0620 4.446218 144.8484 3.518074 3.213623       5.669718 
1 1 1 -18 5  2  o 60.72473 2.598332 45.05415       3.836112 39.82013       5.818714 49.07797       5.101858 56.94189 4.223397 63.33122 3.317350 -6.389332      5.370465 
1 1 1 -18 5  3  o 213.1624 3.288008 554.4530       17.07967 557.7741       27.17007 552.2832       21.96143 213.5617 5.220732 212.6417 4.238147 0.9199524      6.724428 
1 1 1 -18 5  4  o 104.1147 2.448017 132.1842       6.211018 132.4015       9.958405 132.0458       7.945863 104.0603 3.934154 103.9862 3.139258 0.7415009E-01  5.033141 
1 1 1 -18 5  5  o 115.3467 2.475532 162.2443       6.958404 171.9879       11.43082 156.5080       8.770699 118.6189 3.960014 113.2147 3.182193 5.404266       5.080163 
1 1 1 -18 5  6  o 100.1260 2.400560 122.2448       5.857275 119.8117       9.412428 123.7825       7.482606 98.98572 3.909742 100.6840 3.053221 -1.698326      4.960670 
1 1 1 -18 5  7  o 123.4338 2.506328 185.7948       7.538898 188.0788       12.22550 184.3933       9.576432 124.0419 4.049903 122.8938 3.200423 1.148041       5.161823 
1 1 1 -18 5  8  o 264.7726 4.917806 856.9140       31.73076 845.6775       38.83356 879.4863       55.04021 262.8133 6.063507 267.2743 8.461245 -4.461029      10.40955 
1 1 1 -18 5  9  o 104.3474 2.675054 132.8824       6.796604 141.3409       10.20784 126.1464       9.109379 107.5244 3.902219 101.5916 3.685658 5.932747       5.367624 
1 1 1 -18 5  10 o 162.6341 3.616919 322.8474       14.33463 329.3775       17.95161 311.3571       23.81267 164.1310 4.492470 159.3320 6.144463 4.799042       7.611617 
1 1 1 -18 5  11 o 297.6169 5.397164 1083.589       39.14347 1099.530       48.58586 1054.102       66.07784 299.4856 6.657296 292.2510 9.290001 7.234558       11.42907 
1 1 1 -18 5  12 o 53.62490 3.464170 35.24247       4.502688 35.82087       5.881224 34.42327       6.999226 53.95690 4.514188 52.75496 5.526321 1.201939       7.135694 
1 1 1 -18 5  13 o 172.6520 3.193994 363.7336       13.43822 363.0957       19.45225 364.3159       18.58634 172.2997 4.637078 172.6187 4.422091 -0.3189850     6.407604 
1 1 1 -18 5  14 o 208.5541 3.585211 530.9625       18.22088 531.9395       26.26710 530.0564       25.29673 208.5337 5.168920 208.1926 4.986124 0.3411102      7.181863 
1 1 1 -18 5  15 o 58.50957 2.814384 41.85818       4.001022 42.56334       6.310553 41.38419       5.173852 58.85095 4.432840 58.10467 3.672779 0.7462807      5.756681 
1 1 1 -18 5  16 o 233.6357 4.464737 667.1718       25.41975 703.9958       46.53804 651.5138       30.34667 239.0466 8.000218 230.7122 5.397645 8.334320       9.650806 
1 1 1 -18 5  17 o 43.06392 3.397486 22.77855       3.536530 15.89914       5.695798 27.09461       4.511523 35.39840 6.850567 46.92821 3.982635 -11.52981      7.924119 
1 1 1 -18 5  18 o 128.3080 3.246601 201.0776       10.14308 185.9414       17.99655 208.1241       12.27918 123.0123 6.021798 130.4731 3.866265 -7.460762      7.156120 
1 1 1 -18 5  19 o 99.68263 2.726144 121.3211       6.616014 115.2617       9.746847 126.4985       9.009506 97.02827 4.131665 101.7085 3.640900 -4.680260      5.506978 
1 1 1 -18 5  20 o 147.0908 3.005005 264.0590       10.77127 268.6490       15.90890 260.1740       14.63631 148.1565 4.411307 145.8401 4.122441 2.316376       6.037728 
1 1 1 -18 5  21 o 256.0828 4.181447 801.7703       26.09414 805.8528       37.47189 797.9268       36.35867 256.2716 6.000244 255.0524 5.849819 1.219238       8.379934 
1 1 1 -18 5  22 o 170.8473 4.662413 357.5211       19.39317 348.6089       28.03157 365.7027       26.85820 168.1919 6.853572 172.3948 6.404311 -4.202896      9.380119 
1 1 1 -18 5  23 o 67.72532 2.933254 56.09856       4.829540 62.79037       7.792077 51.92433       6.154171 71.48590 4.495744 65.05418 3.899930 6.431725       5.951568 
1 1 1 -18 5  24 o 153.0816 3.100174 286.1915       11.56499 292.3097       17.14312 281.0815       15.66709 154.4355 4.560185 151.4966 4.247940 2.938919       6.232197 
1 1 1 -18 5  25 o 85.71734 3.144065 89.87321       6.556315 84.96806       11.65449 92.14426       7.930145 82.94998 5.802138 86.72328 3.761346 -3.773300      6.914660 
1 1 1 -18 5  26 o 156.8756 3.656524 301.0124       13.97848 298.8024       17.45244 304.9673       23.34667 156.0594 4.594128 157.2508 6.104101 -1.191376      7.639768 
1 1 1 -18 5  27 o 206.6284 3.658049 522.4667       18.41940 526.8548       26.69865 518.4813       25.44452 206.9401 5.298657 205.4279 5.082751 1.512238       7.342351 
1 1 1 -18 5  28 o 85.53968 3.214157 89.61481       6.688020 86.05228       11.98806 91.22468       8.058682 83.29966 5.944751 86.21071 3.845574 -2.911049      7.080148 
1 1 1 -18 5  29 o 124.8432 2.957581 190.6041       8.997824 200.5982       13.51891 182.6558       12.05605 127.7300 4.349573 121.9480 4.062570 5.781967       5.951744 
1 1 1 -18 5  30 o 17.88548 6.060786 3.698716       3.145717 1.222258       4.868271 5.473921       4.121769 17.29281 7.133947 21.27513 6.929648 -3.982321      9.945513 
1 1 1 -18 5  31 o 88.18623 3.449874 95.56419       7.399485 94.97513       14.85492 95.75858       8.533502 86.74812 7.088829 88.15243 3.982723 -1.404305      8.131025 
1 1 1 -18 5  32 o 40.66855 4.005632 20.56839       3.918301 13.08417       5.946633 26.31099       5.208975 31.50591 7.789833 45.88080 4.726469 -14.37488      9.111587 
1 1 1 -18 5  33 o 11.50487 5.350529 -3.127608      3.628747 -0.5447526E-01 4.517510 -8.716817      6.092334 15.48557 6.653130 13.26460 6.385240 2.220975       9.221465 
1 1 1 -18 5  34 o 18.67687 6.242223 4.218739       3.337344 4.058433       4.903693 4.357057       4.555006 19.93266 7.471819 19.93341 7.248727 -0.7514954E-03 10.41019 
1 1 1 -18 5  35 o 30.79014 5.969567 12.41607       4.317389 14.17876       5.403169 9.303027       7.180479 32.59451 7.010773 26.81240 9.155706 5.782106       11.53160 
1 1 1 -18 5  36 o 85.54339 3.024352 90.47298       6.294642 81.85383       9.093131 98.40359       8.722375 80.56543 4.651348 88.71719 4.045154 -8.151756      6.164277 
1 1 1 -18 5  37 o 16.38770 6.213640 2.723615       3.413103 2.961845       5.015718 2.518167       4.657840 18.50169 7.382523 17.65887 7.091119 0.8428211      10.23648 
1 1 1 -18 5  38 o 27.64478 7.406282 10.79500       5.089665 14.85387       7.215933 6.776521       7.179948 31.64885 8.955614 23.44962 8.982966 8.199224       12.68451 
1 1 1 -18 5  39 o 35.88273 4.872729 16.91764       4.150832 17.63690       6.148053 16.31517       5.626839 35.08786 7.422351 33.97239 7.028729 1.115471       10.22225 
1 1 1 -18 5  40 o 38.44380 4.596714 19.40864       4.221106 21.33130       6.077028 17.61623       5.867571 38.90357 6.648773 34.92365 7.135807 3.979919       9.753251 
1 1 1 -18 5  41 o 14.42859 6.008280 1.389236       3.498378 4.622929       4.899973 -1.972902      4.996342 19.17379 7.401199 13.96319 6.416975 5.210601       9.795679 
1 1 1 -18 5  42 o 43.91475 6.237821 27.58658       6.487868 30.14074       9.210499 25.07117       9.140366 42.48917 9.165093 37.63617 9.852516 4.853001       13.45626 
1 1 1 -18 5  43 o 37.15660 4.945266 19.01691       4.366692 23.07181       6.375649 15.43417       5.992970 38.92647 6.977452 30.63325 7.957493 8.293219       10.58331 
1 1 1 -18 5  44 o 22.96523 6.697032 8.351684       3.977770 5.076041       5.777516 11.30374       5.484730 18.91275 7.783811 25.52106 7.958994 -6.608309      11.13253 
1 1 1 -18 5  45 o 20.66564 6.911711 7.007319       4.091503 8.515702       6.140129 5.802645       5.487273 21.59603 8.298380 19.12445 7.690731 2.471577       11.31417 
1 1 1 -18 6  1  o 129.9892 2.623641 206.0907       8.310893 221.1888       13.48204 196.8369       10.55485 134.5048 4.118069 126.9473 3.414972 7.557579       5.349815 
1 1 1 -18 6  2  o 176.1085 3.381082 378.5078       14.51016 439.0310       33.54113 364.5730       16.09410 188.9665 7.297497 172.7972 3.822028 16.16924       8.237801 
1 1 1 -18 6  3  o 49.21399 2.768798 29.63574       3.307204 23.97423       5.065196 33.84289       4.366405 44.02892 4.798427 52.54811 3.428537 -8.519192      5.897437 
1 1 1 -18 6  4  o 233.1489 3.493275 663.4402       19.84734 666.9731       31.56379 661.1299       25.52494 233.4711 5.547789 232.6136 4.502913 0.8574524      7.145221 
1 1 1 -18 6  5  o 121.9146 2.514471 181.2554       7.470304 171.8211       11.81911 187.5317       9.640034 118.5446 4.097510 123.9336 3.194593 -5.388969      5.195673 
1 1 1 -18 6  6  o 105.2464 2.433307 135.0732       6.240802 131.5511       10.08238 137.2607       7.945959 103.7182 3.996550 106.0252 3.078655 -2.307007      5.044852 
1 1 1 -18 6  7  o 199.7423 3.141807 486.7732       15.29275 500.4312       24.87214 478.4713       19.39129 202.3120 5.044934 197.9475 4.019949 4.364517       6.450686 
1 1 1 -18 6  8  o 98.15546 3.244109 117.6870       7.749058 109.4199       9.384667 135.4011       13.73732 94.56976 4.081824 105.0732 5.382995 -10.50343      6.755584 
1 1 1 -18 6  9  o 156.1837 4.471167 298.2792       16.99987 298.2792       16.99987 0.000000       0.000000 156.1837 4.471167 ?        ?        0.000000       4.471167 
1 1 1 -18 6  10 o 218.6219 4.306775 583.8667       22.94468 573.5757       28.14009 604.2798       39.63254 216.5380 5.332798 221.7478 7.344395 -5.209793      9.076280 
1 1 1 -18 6  11 o 53.67052 3.525334 35.30979       4.585228 41.28650       6.230823 28.24999       6.771901 57.96111 4.445287 47.66734 5.959664 10.29377       7.434929 
1 1 1 -18 6  12 o 170.0904 3.186774 353.0190       13.20892 367.7559       19.63347 340.8329       17.85358 173.4003 4.650541 166.9625 4.391850 6.437729       6.396552 
1 1 1 -18 6  13 o 289.1900 4.559513 1022.105       32.13201 1061.973       47.03688 987.2209       43.99821 294.2982 6.558656 283.8040 6.361804 10.49417       9.137205 
1 1 1 -18 6  14 o 82.58472 2.699471 83.28065       5.425385 78.68321       8.304561 86.70392       7.166030 80.13711 4.267917 84.20610 3.499828 -4.068993      5.519413 
1 1 1 -18 6  15 o 307.1497 4.790334 1153.576       35.85519 1196.525       52.32764 1115.565       49.22799 312.2294 6.877351 301.5373 6.699386 10.69214       9.601027 
1 1 1 -18 6  16 o 254.3078 4.754561 790.8600       29.46498 794.1826       52.39552 789.3234       35.63329 253.7031 8.486800 253.8458 5.760364 -0.1426544     10.25707 
1 1 1 -18 6  17 o 141.7627 3.988020 245.7072       13.76334 0.000000       0.000000 245.7072       13.76334 ?        ?        141.7627 3.988020 0.000000       3.988020 
1 1 1 -18 6  18 o 138.1895 2.940565 233.0258       9.902434 231.9853       14.76254 233.8769       13.35180 137.6833 4.405579 138.3009 3.965770 -0.6176147     5.927601 
1 1 1 -18 6  19 f 218.3983 3.722504 582.6175       19.81164 582.2869       28.64346 582.9208       27.43159 218.0396 5.390809 218.2060 5.158795 -0.1663361     7.461500 
1 1 1 -18 6  20 o 201.1245 3.538184 494.0449       17.34130 518.2393       25.80375 474.1175       23.41805 205.6539 5.152904 196.8157 4.882640 8.838150       7.098774 
1 1 1 -18 6  21 o 181.3481 3.823061 401.8835       16.89508 440.2559       31.99723 387.0494       19.89450 189.0482 6.957371 177.7958 4.595572 11.25240       8.338122 
1 1 1 -18 6  22 o 173.3859 3.820749 367.4411       16.14353 388.1072       20.71418 335.4706       25.76399 177.9755 4.780407 165.0831 6.416561 12.89240       8.001534 
1 1 1 -18 6  23 o 113.9992 2.848658 158.6436       7.913674 146.2975       11.63062 169.2870       10.79886 109.2481 4.377573 117.6185 3.772489 -8.370445      5.778825 
1 1 1 -18 6  24 o 99.18164 2.819789 120.1898       6.808367 119.5426       10.29237 120.6934       9.078448 98.73551 4.287880 99.28329 3.759105 -0.5477829     5.702349 
1 1 1 -18 6  25 o 78.39780 2.931875 75.16373       5.591387 79.58704       8.745638 72.10579       7.271657 80.48309 4.476776 76.67403 3.904643 3.809067       5.940350 
1 1 1 -18 6  26 o 87.27995 3.366744 93.27023       7.147357 90.24717       9.324342 97.57691       11.12927 85.69059 4.480852 88.99080 5.154041 -3.300209      6.829507 
1 1 1 -18 6  27 o 31.20230 4.925542 12.24285       3.621099 8.483305       5.923878 14.48564       4.575442 26.23217 8.284434 33.83904 5.754352 -7.606873      10.08684 
1 1 1 -18 6  28 o 44.15966 4.002785 24.09712       4.260748 21.74732       7.841930 25.08135       5.075221 41.06165 8.124792 44.94325 4.703557 -3.881596      9.388062 
1 1 1 -18 6  29 o 74.12019 2.991142 67.30989       5.391588 60.89212       8.124469 72.36053       7.207360 70.18462 4.778759 76.71627 3.867728 -6.531654      6.147834 
1 1 1 -18 6  30 o 55.58139 3.329956 37.98957       4.489604 28.52489       6.672259 45.82028       6.069042 47.62336 5.873647 60.92355 4.111975 -13.30018      7.169942 
1 1 1 -18 6  31 o 28.52465 6.066899 10.50492       4.087363 0.7779114      9.237473 12.87294       4.557820 22.45607 9.577577 31.63178 6.134282 -9.175711      11.37363 
1 1 1 -18 6  32 o 66.19616 3.122479 53.88723       5.022762 57.07027       7.646426 51.47137       6.661510 67.75282 4.659589 64.43386 4.266533 3.318962       6.317838 
1 1 1 -18 6  33 o 35.62776 4.536732 15.98304       3.849617 18.40827       5.716321 13.97031       5.207541 37.71492 6.451389 32.66164 6.765443 5.053280       9.348350 
1 1 1 -18 6  34 o 74.05035 3.084856 67.59516       5.554513 65.41797       8.292221 69.36713       7.480826 72.28199 4.733704 74.67839 4.126771 -2.396400      6.279984 
1 1 1 -18 6  35 o 65.70808 3.159857 53.39541       5.044841 56.73327       7.688484 50.87183       6.685222 67.13218 4.730018 63.72042 4.331018 3.411762       6.413329 
1 1 1 -18 6  36 o 29.32862 6.480528 11.53795       4.508118 17.48591       5.816079 2.586208       7.135099 36.10689 6.860798 20.58990 8.577791 15.51699       10.98404 
1 1 1 -18 6  37 o 19.66887 6.395126 5.014047       3.511247 2.210175       4.986027 7.772554       4.945528 17.72294 7.255581 23.90062 7.572189 -6.177677      10.48721 
1 1 1 -18 6  38 o 39.01794 5.198555 19.96529       4.820033 26.25080       8.373969 16.85103       5.894382 42.68225 8.350157 34.70631 7.205403 7.975945       11.02919 
1 1 1 -18 6  39 o 51.45665 3.760552 33.67682       4.682957 37.08531       7.030063 30.95788       6.278828 52.75411 5.551598 48.24825 5.434672 4.505867       7.768906 
1 1 1 -18 6  40 o 40.39528 4.454563 21.34433       4.312296 20.69566       6.228164 21.94165       5.976626 37.99713 6.983519 39.60061 6.412323 -1.603485      9.480898 
1 1 1 -18 6  41 o 16.39162 6.380450 2.991689       3.664738 2.931174       5.259376 3.048801       5.109325 17.78426 7.383006 17.75746 7.315293 0.2679825E-01  10.39338 
1 1 1 -18 6  42 o 21.41430 7.464077 6.966930       4.781220 10.67596       6.156823 1.331778       7.588903 25.34899 8.478576 18.25708 8.197727 7.091908       11.79360 
1 1 1 -18 6  43 o 31.41686 5.662335 14.17759       4.175618 11.36711       5.963014 16.88169       5.849067 25.66391 8.333190 32.49721 7.533062 -6.833300      11.23339 
1 1 1 -18 6  44 o 37.70709 5.018358 19.98353       4.496891 20.85777       6.628577 19.23809       6.120852 35.25096 7.911130 34.27591 7.533863 0.9750481      10.92452 
1 1 1 -18 6  45 o 15.99464 6.500437 3.202941       3.966921 10.33599       6.239103 -1.637476      5.139558 23.27062 8.480378 13.53475 6.318915 9.735872       10.57570 
1 1 1 -18 7  1  o 33.69189 3.649009 14.02013       2.948198 13.19846       4.334416 14.72756       4.021868 32.36299 5.704347 34.35591 4.946204 -1.992920      7.550133 
1 1 1 -18 7  2  o 328.6855 4.566243 1320.381       36.57427 1332.437       58.26571 1312.542       46.98388 329.4136 7.258308 327.3760 5.889330 2.037628       9.347045 
1 1 1 -18 7  3  o 229.9226 3.936847 645.5714       22.05801 705.9103       48.21342 629.5983       24.80643 239.3727 8.277731 226.9846 4.484682 12.38803       9.414520 
1 1 1 -18 7  4  o 90.86198 2.443187 100.7520       5.404812 103.6199       8.791899 99.00978       6.852614 92.03385 3.929158 90.02678 3.128304 2.007072       5.022406 
1 1 1 -18 7  5  o 178.5830 2.966455 389.0689       12.90963 381.2562       20.50562 394.1987       16.61584 176.5431 4.770725 179.6854 3.794664 -3.142273      6.095842 
1 1 1 -18 7  6  o 194.5418 3.492904 461.9305       16.55906 480.3979       24.07238 445.3429       22.81433 198.1539 4.989142 190.7948 4.910958 7.359024       7.000646 
1 1 1 -18 7  7  o 102.3393 2.761730 127.8414       6.881173 134.4741       10.20780 122.3168       9.316110 104.8610 4.002025 100.0177 3.829345 4.843315       5.538961 
1 1 1 -18 7  8  o 95.43147 2.752281 111.1762       6.393910 113.0405       9.459918 109.6083       8.675614 96.12408 4.047548 94.67686 3.767806 1.447227       5.529829 
1 1 1 -18 7  9  o 68.31655 2.864240 57.03230       4.757808 56.11428       7.132500 57.76829       6.386289 67.63403 4.350608 68.67870 3.831026 -1.044662      5.796943 
1 1 1 -18 7  10 o 160.2536 3.623536 313.4983       14.15065 315.0502       17.79276 310.8270       23.34279 160.4988 4.553806 159.1941 6.028022 1.304688       7.554747 
1 1 1 -18 7  11 o 99.54946 2.695510 120.9643       6.533051 124.9469       10.00070 117.9996       8.628657 101.0628 4.069038 98.25106 3.610014 2.811752       5.439602 
1 1 1 -18 7  12 o 179.8293 3.298668 394.6604       14.45556 396.6831       21.15670 392.8892       19.79744 180.0611 4.825959 179.2405 4.536133 0.8205719      6.623170 
1 1 1 -18 7  13 o 169.9149 3.203590 352.3231       13.26491 352.3521       19.43658 352.2979       18.14844 169.7057 4.704425 169.7372 4.391279 -0.3153992E-01 6.435445 
1 1 1 -18 7  14 o 271.3594 4.345716 899.8293       28.73706 904.3231       41.41730 895.6577       39.90552 271.6127 6.257424 270.3595 6.056968 1.253235       8.708744 
1 1 1 -18 7  15 f 187.2279 3.369570 427.8913       15.37379 453.6180       23.12237 407.5064       20.58229 192.5129 4.932808 182.5089 4.631531 10.00406       6.766364 
1 1 1 -18 7  16 o 68.20892 3.085089 56.89206       5.114690 53.78848       10.12349 57.95579       5.926744 65.91930 6.381776 68.80560 3.546700 -2.886299      7.301106 
1 1 1 -18 7  17 o 202.4076 4.882067 501.2137       24.08057 0.000000       0.000000 501.2137       24.08057 ?        ?        202.4076 4.882067 0.000000       4.882067 
1 1 1 -18 7  18 o 138.2439 2.929256 233.2150       9.868230 238.0538       14.86369 229.4009       13.19621 139.4723 4.378655 136.9665 3.957806 2.505859       5.902275 
1 1 1 -18 7  19 o 157.7404 3.129552 303.7234       12.02988 311.7862       18.15075 297.4071       16.06516 159.5757 4.672611 155.9180 4.232087 3.657654       6.304273 
1 1 1 -18 7  20 o 201.7849 3.564424 497.3461       17.52726 504.9443       25.78182 490.8168       23.89964 202.9681 5.216866 200.2362 4.897931 2.731934       7.155796 
1 1 1 -18 7  21 o 89.61961 2.759198 98.10796       6.018724 111.9896       9.648177 89.26443       7.700830 95.61150 4.150830 85.39140 3.709579 10.22011       5.566899 
1 1 1 -18 7  22 o 96.66971 3.319082 114.2745       7.807281 124.6537       10.25424 99.95973       12.04240 100.8661 4.180848 90.10875 5.510509 10.75739       6.917022 
1 1 1 -18 7  23 o 161.9913 3.168267 320.4982       12.50690 343.3971       18.99106 302.9603       16.61998 167.3827 4.660424 157.2735 4.340645 10.10916       6.368732 
1 1 1 -18 7  24 o 183.6034 3.390605 411.9360       15.17029 433.7275       22.72606 394.4214       20.37419 188.0212 4.964336 179.3660 4.665229 8.655243       6.812415 
1 1 1 -18 7  25 o 126.2902 3.457086 195.1214       10.62936 206.9735       13.95044 178.7173       16.41217 129.9087 4.413110 120.4588 5.606401 9.449814       7.134933 
1 1 1 -18 7  26 o 30.40810 4.940116 11.63694       3.535161 17.67675       5.903254 8.259838       4.414196 37.27452 6.747288 25.43509 6.933196 11.83943       9.674456 
1 1 1 -18 7  27 o 97.43685 2.871082 116.1108       6.809747 125.4536       10.76581 109.8797       8.792078 101.0391 4.382835 94.64685 3.819816 6.392288       5.813797 
1 1 1 -18 7  28 o 165.9529 3.686621 337.3826       14.90903 359.9768       27.23157 327.7110       17.81647 170.3024 6.574035 163.2870 4.481721 7.015396       7.956366 
1 1 1 -18 7  29 o 120.8045 2.955516 178.5349       8.700666 182.8025       13.10761 175.1734       11.63313 121.8589 4.421306 119.3959 4.003925 2.462982       5.964843 
1 1 1 -18 7  30 o 40.04971 4.031364 19.91026       3.881008 23.03416       6.157659 17.85147       4.998895 42.64574 6.098657 37.55961 5.635243 5.086132       8.303589 
1 1 1 -18 7  31 o 25.73660 6.427216 8.603942       4.018623 3.094925       9.438987 9.823585       4.441243 24.08230 9.934089 27.46670 6.696729 -3.384401      11.98050 
1 1 1 -18 7  32 o 46.45564 3.778854 26.75173       4.241025 26.02571       6.548173 27.27632       5.566199 45.20721 6.099441 46.62590 4.975665 -1.418686      7.871494 
1 1 1 -18 7  33 o 31.34737 5.032778 12.53687       3.714470 11.21162       5.779280 13.46964       4.848547 29.01367 7.943132 32.12556 6.418038 -3.111887      10.21198 
1 1 1 -18 7  34 o 121.8952 3.080348 183.0578       9.142697 180.7863       13.49485 184.9851       12.43013 120.3179 4.611118 121.9681 4.188304 -1.650208      6.229310 
1 1 1 -18 7  35 o 66.89545 3.224891 55.40680       5.241632 57.75412       7.892424 53.55441       7.011156 67.64867 4.819127 65.30585 4.431817 2.342819       6.547135 
1 1 1 -18 7  36 o 57.91176 3.473435 41.80356       4.879345 46.94071       7.402489 37.85680       6.488385 60.64006 5.055303 54.47495 4.941392 6.165112       7.069190 
1 1 1 -18 7  37 o 45.57981 4.933269 26.77808       5.392297 30.84040       6.763468 19.69131       8.933185 48.43678 5.848293 36.20535 9.860583 12.23143       11.46445 
1 1 1 -18 7  38 o 21.72188 7.048234 6.437371       4.266256 -0.5063246     7.164139 10.25279       5.310555 18.02519 8.038459 26.71192 7.723067 -8.686726      11.14731 
1 1 1 -18 7  39 o 25.44901 6.192029 9.061569       3.802996 5.376112       5.407522 12.66829       5.349447 20.64835 7.822980 29.45193 7.449523 -8.803576      10.80252 
1 1 1 -18 7  40 o 26.28279 6.176021 9.776444       3.888201 5.211628       5.500379 14.33584       5.497116 20.28114 7.838093 31.14700 7.359921 -10.86586      10.75194 
1 1 1 -18 7  41 o 30.67767 6.468771 13.60606       4.683398 23.14001       8.631919 9.628578       5.575392 37.04062 9.513641 24.79435 8.058310 12.24626       12.46779 
1 1 1 -18 7  42 o 13.36165 6.023970 -0.6632335     4.145012 -3.006544      5.376862 2.769194       6.507507 13.66111 6.405460 18.24929 7.913234 -4.588181      10.18082 
1 1 1 -18 7  43 o 55.18795 3.873938 40.11998       5.176851 41.37618       7.612724 39.03935       7.060742 53.46785 5.942959 52.35306 5.622418 1.114792       8.181097 
1 1 1 -18 7  44 o 19.64398 6.795798 6.077037       3.959834 6.433908       5.895131 5.783636       5.345263 19.99715 7.995431 19.32365 7.650084 0.6734982      11.06574 
1 1 1 -18 7  45 o 12.29308 5.612305 -0.7195172     3.738474 -1.859147      5.761724 0.1091314      4.913102 14.06428 6.605980 14.28240 6.486776 -0.2181234     9.258361 
1 1 1 -18 8  1  o 212.6141 3.328986 551.7418       17.24805 558.1913       27.55916 547.5889       22.11462 213.5729 5.295217 211.6929 4.286839 1.880035       6.812951 
1 1 1 -18 8  2  o 253.2595 3.742958 783.1786       23.10026 796.9325       37.11026 774.4781       29.51587 255.0558 5.970665 251.6744 4.812607 3.381424       7.668770 
1 1 1 -18 8  3  o 326.9827 5.124757 1307.839       40.83515 1199.326       79.37980 1346.890       47.61928 311.0264 10.48814 331.6200 5.892587 -20.59363      12.03011 
1 1 1 -18 8  4  o 81.43789 3.415397 81.08915       6.762990 66.99819       13.94683 85.42112       7.732996 73.40086 7.922558 83.55442 3.807898 -10.15356      8.790165 
1 1 1 -18 8  5  o 115.9573 2.848736 164.0270       8.049820 164.1951       11.69215 163.8755       11.09930 115.8664 4.147646 115.7748 3.939842 0.9165955E-01  5.720605 
1 1 1 -18 8  6  o 217.1965 3.761237 575.9717       19.90763 604.6492       29.10064 550.7455       27.29346 222.3015 5.371850 212.1765 5.278678 10.12505       7.531349 
1 1 1 -18 8  7  o 147.0245 2.711184 263.6619       9.713705 264.2921       15.87382 263.2847       12.28168 147.0028 4.436259 146.8723 3.431481 0.1304779      5.608517 
1 1 1 -18 8  8  o 218.5538 3.353751 582.9489       17.86180 589.3914       28.88208 578.9588       22.72977 219.4737 5.400200 217.6925 4.284652 1.781204       6.893504 
1 1 1 -18 8  9  o 55.01081 3.793851 37.12427       5.054713 30.93015       6.312465 48.19370       8.438626 50.01063 5.258223 62.50205 5.599676 -12.49142      7.681489 
1 1 1 -18 8  10 o 186.4945 3.381979 424.4930       15.36998 430.6586       22.56591 419.1574       20.99217 187.6006 4.940382 185.1211 4.657042 2.479492       6.789361 
1 1 1 -18 8  11 o 181.0838 3.320940 400.2040       14.65469 398.6064       21.37061 401.6222       20.13432 180.4870 4.863298 181.2149 4.563022 -0.7278748     6.668796 
1 1 1 -18 8  12 o 68.97572 2.789241 58.13258       4.678663 62.82282       7.608653 55.28081       5.932912 71.56754 4.383734 67.19180 3.636951 4.375748       5.696011 
1 1 1 -18 8  13 o 129.3482 2.876010 204.1195       9.065397 217.1987       14.01429 194.7089       11.88746 133.2510 4.321547 126.2068 3.869754 7.044159       5.800928 
1 1 1 -18 8  14 o 158.1318 3.099907 305.1486       11.94549 313.8401       17.92245 298.2013       16.02354 160.1555 4.596941 156.1634 4.214445 3.992111       6.236458 
1 1 1 -18 8  15 o 112.9679 3.099388 155.8572       8.524258 181.5124       16.93017 147.1448       9.866061 121.5928 5.729814 109.7079 3.695646 11.88499       6.818252 
1 1 1 -18 8  16 f 258.9096 4.816721 819.9899       30.39035 834.5235       54.36452 813.3839       36.65195 259.9473 8.593926 257.6278 5.838057 2.319519       10.38934 
1 1 1 -18 8  17 o 299.2252 5.423780 1096.568       39.54908 1108.693       70.59256 1091.021       47.74570 299.0447 9.699773 298.1096 6.572373 0.9350891      11.71673 
1 1 1 -18 8  18 f 212.1314 4.200493 550.0557       21.71407 549.3987       39.06013 550.3496       26.12251 211.1049 7.605182 212.0361 5.055558 -0.9311981     9.132220 
1 1 1 -18 8  19 o 85.48399 2.754272 89.25974       5.730078 98.61427       9.332952 83.60020       7.259368 89.70494 4.281758 82.65070 3.612989 7.054237       5.602423 
1 1 1 -18 8  20 o 134.4169 2.948050 220.5335       9.656616 209.7610       14.31377 229.5320       13.08221 130.8652 4.495098 136.9839 3.923041 -6.118774      5.966252 
1 1 1 -18 8  21 o 82.00117 2.825266 82.16761       5.637237 85.62906       8.948780 79.89030       7.258494 83.54264 4.411247 80.77163 3.697474 2.771011       5.755902 
1 1 1 -18 8  22 o 325.8454 5.888434 1304.025       46.75710 1270.947       56.76217 1373.848       82.46806 321.0272 7.255728 331.6782 10.21529 -10.65103      12.52987 
1 1 1 -18 8  23 o 184.7476 3.405606 417.0578       15.33237 417.9139       22.42305 416.3060       21.01214 184.5713 4.989914 184.2902 4.682568 0.2811432      6.842929 
1 1 1 -18 8  24 o 31.57606 4.677641 12.47836       3.490619 16.34263       5.971710 10.47281       4.302103 35.77884 7.099799 28.61698 6.336460 7.161854       9.516190 
1 1 1 -18 8  25 o 127.6099 3.492003 199.2720       10.84892 193.8790       13.78027 208.0641       17.59485 125.6896 4.506356 129.9703 5.568179 -4.280624      7.163229 
1 1 1 -18 8  26 o 69.68748 3.033472 59.46078       5.139126 63.64111       8.304276 56.86609       6.542433 71.85062 4.769808 68.02853 3.963668 3.822083       6.201753 
1 1 1 -18 8  27 o 79.60860 2.938226 77.56840       5.690305 84.34295       9.123969 73.25605       7.279479 82.76533 4.541158 77.22981 3.880367 5.535515       5.973221 
1 1 1 -18 8  28 o 68.88535 3.312750 58.21712       5.544682 50.61140       10.03638 61.55819       6.651965 63.55353 6.575247 70.75160 3.872906 -7.198071      7.631073 
1 1 1 -18 8  29 o 22.71600 6.479201 6.577894       3.761979 9.460085       7.719886 5.680305       4.308125 28.04779 9.494626 21.68563 7.085975 6.362158       11.84732 
1 1 1 -18 8  30 o 14.08657 6.045901 -0.1380786     3.723388 -8.112423      9.223264 1.414528       4.069750 18.09924 8.454849 16.21230 6.585904 1.886936       10.71721 
1 1 1 -18 8  31 o 15.62136 6.031398 2.042248       3.254631 -0.9460813     5.383017 3.764063       4.086059 16.25786 7.120747 18.88859 6.865948 -2.630728      9.891727 
1 1 1 -18 8  32 f 39.29845 4.954240 19.47587       4.639260 23.06554       6.303974 15.23489       6.852048 42.41836 6.288687 33.77271 8.368649 8.645645       10.46814 
1 1 1 -18 8  33 o 108.2048 3.029692 144.0545       7.980926 142.4648       12.00109 145.3150       10.68643 106.9242 4.616714 108.2631 4.057751 -1.338844      6.146494 
1 1 1 -18 8  34 o 54.43448 3.480008 36.76050       4.592085 35.84045       7.039014 37.44220       6.058997 53.03561 5.527404 54.58090 4.598094 -1.545284      7.189900 
1 1 1 -18 8  35 o 22.98148 6.341989 7.018822       3.667564 6.555865       5.658235 7.354258       4.816327 23.03420 8.113039 23.62767 7.470985 -0.5934734     11.02892 
1 1 1 -18 8  36 o 94.70103 3.072665 111.1593       7.081589 113.8377       10.73696 109.0972       9.421283 94.80014 4.661980 93.16267 4.160341 1.637466       6.248399 
1 1 1 -18 8  37 o 23.74218 7.192581 7.765916       4.519483 5.770841       5.830141 10.77007       7.154197 21.83079 8.154503 27.39488 9.139094 -5.564091      12.24822 
1 1 1 -18 8  38 o 39.54995 5.110798 20.56810       4.810684 31.42927       8.487325 15.42705       5.839272 47.09311 7.658572 32.84462 7.465418 14.24849       10.69515 
1 1 1 -18 8  39 o 35.42843 5.968072 17.22540       4.969618 12.75249       5.910048 28.02216       9.182123 29.09071 8.059461 42.50383 9.136974 -13.41312      12.18356 
1 1 1 -18 8  40 o 13.47688 5.903623 0.1752298E-01  3.701357 0.5016980      5.306154 -0.4413577     5.165692 16.05272 7.049157 15.22591 6.805506 0.8268137      9.798241 
1 1 1 -18 8  41 o 23.89606 7.137365 8.632185       4.473507 7.147521       8.734774 9.160070       5.208435 22.67076 9.471214 24.26690 7.780139 -1.596140      12.25702 
1 1 1 -18 8  42 o 11.59469 5.400126 -2.214782      3.717460 -2.170488      5.518145 -2.251588      5.030231 14.22266 6.608888 13.55591 6.302768 0.6667509      9.132485 
1 1 1 -18 8  43 o 16.50961 6.457780 3.484290       3.768923 6.548324       5.682983 1.078526       5.035657 20.37756 7.941616 15.42204 6.815817 4.955521       10.46540 
1 1 1 -18 8  44 o 17.14853 6.621621 4.138520       3.923036 4.723552       5.944302 3.687080       5.221694 18.51164 7.778699 17.34451 7.289565 1.167130       10.66048 
1 1 1 -18 8  45 o 17.98285 6.610838 5.008269       3.804109 6.515551       5.898767 3.935054       4.977456 19.65500 7.949088 17.18342 7.161969 2.471584       10.69962 
1 1 1 -18 9  1  o 253.8026 4.219920 787.1236       26.09975 816.7986       37.82928 760.1657       36.05580 258.1622 6.013113 249.0689 5.940453 9.093307       8.452603 
1 1 1 -18 9  2  o 174.4888 3.353966 371.6295       14.26140 367.5523       20.31069 375.5946       20.02960 173.3004 4.814041 175.2063 4.695461 -1.905807      6.724756 
1 1 1 -18 9  3  o 325.3301 5.863657 1296.462       46.48672 1255.473       56.21106 1385.158       82.68757 319.7113 7.214856 334.3605 10.15999 -14.64926      12.46112 
1 1 1 -18 9  4  o 196.4721 4.122125 471.5563       19.73596 470.2880       36.70966 472.0719       23.40643 195.4256 7.723587 196.4762 4.888652 -1.050613      9.140718 
1 1 1 -18 9  5  o 227.9784 3.470191 634.4297       19.27894 646.4952       31.18739 626.9677       24.52638 229.8072 5.569027 226.5021 4.443501 3.305099       7.124518 
1 1 1 -18 9  6  o 127.6385 2.620302 198.7089       8.150213 202.9499       13.53865 196.2984       10.20692 128.8076 4.319292 126.7803 3.306568 2.027260       5.439639 
1 1 1 -18 9  7  f 27.21398 4.371840 9.276091       2.801131 10.14187       4.986892 8.877024       3.385699 28.20745 7.223974 26.45386 5.433936 1.753588       9.039550 
1 1 1 -18 9  8  o 292.6386 4.641373 1046.826       33.09895 1050.879       47.54424 1043.015       46.10680 292.7025 6.665540 291.6564 6.487201 1.046143       9.301248 
1 1 1 -18 9  9  o 103.6327 2.873751 131.1220       7.250414 141.4041       10.96268 123.1277       9.666479 107.5037 4.192670 100.3283 3.961533 7.175346       5.768208 
1 1 1 -18 9  10 o 210.7538 3.711656 542.3397       19.06247 563.5432       27.88196 523.7300       26.12094 214.5943 5.331742 206.8351 5.186461 7.759140       7.438202 
1 1 1 -18 9  11 o 156.8428 3.110690 300.1826       11.88933 296.3200       17.56060 303.4517       16.15528 155.6200 4.635772 157.5405 4.211880 -1.920502      6.263411 
1 1 1 -18 9  12 o 274.8126 4.409023 923.0141       29.52671 934.4041       42.83742 912.7048       40.75455 276.0453 6.368055 272.8852 6.128582 3.160065       8.838079 
1 1 1 -18 9  13 o 390.2654 5.904358 1866.234       56.15247 1923.868       81.73903 1814.727       77.27228 395.0661 8.490312 383.8138 8.261655 11.25229       11.84653 
1 1 1 -18 9  14 o 180.5396 3.771866 398.0817       16.59453 407.5335       30.21974 394.0011       19.85614 182.0605 6.823514 179.4600 4.544024 2.600510       8.198079 
1 1 1 -18 9  15 o 225.4241 4.356274 621.1638       23.93049 627.5102       43.02391 618.3208       28.79587 225.6311 7.836727 224.7426 5.257855 0.8884735      9.437125 
1 1 1 -18 9  16 o 171.2996 3.253759 358.1975       13.58244 343.4295       19.76257 371.4181       18.69851 167.4733 4.847515 174.2427 4.407224 -6.769394      6.551490 
1 1 1 -18 9  17 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -18 9  18 o 166.6616 3.213269 339.1001       13.05025 334.3666       19.32064 343.0718       17.69766 165.2260 4.803617 167.4441 4.340864 -2.218094      6.474398 
1 1 1 -18 9  19 o 175.7689 3.301209 377.2484       14.14006 378.7037       20.93500 376.0276       19.17485 175.8142 4.891084 175.2664 4.493197 0.5478210      6.641651 
1 1 1 -18 9  20 o 126.3936 2.909011 194.9970       8.959967 208.0916       13.97929 185.8668       11.67291 130.3451 4.407370 123.2520 3.891291 7.093170       5.879375 
1 1 1 -18 9  21 o 176.2115 3.323326 379.2691       14.27063 372.8907       20.94232 384.7983       19.49840 174.3963 4.932737 177.2493 4.517859 -2.852951      6.689016 
1 1 1 -18 9  22 o 104.9880 3.372382 134.8056       8.616851 138.7716       11.31196 129.3228       13.30019 106.3889 4.372519 102.5379 5.341180 3.851059       6.902690 
1 1 1 -18 9  23 o 48.60773 3.482289 29.02353       4.097503 33.53719       6.786673 26.43441       5.140073 51.99246 5.436767 46.22594 4.625008 5.766518       7.137866 
1 1 1 -18 9  24 o 198.5429 4.175312 482.6279       20.20130 465.8003       24.88745 515.1290       34.58739 194.7097 5.249927 204.1314 6.963189 -9.421753      8.720535 
1 1 1 -18 9  25 o 110.7891 2.937511 150.0591       7.923726 143.8865       12.16866 154.6031       10.44049 108.2144 4.625134 112.3258 3.819777 -4.111359      5.998547 
1 1 1 -18 9  26 o 68.71869 3.054019 57.83589       5.101483 52.06034       8.209603 61.46897       6.511229 64.85451 5.239084 70.75230 3.790306 -5.897789      6.466407 
1 1 1 -18 9  27 o 91.29734 2.920230 102.0013       6.488620 96.99453       10.05103 105.5789       8.496261 88.72592 4.665009 92.75436 3.766706 -4.028442      5.995863 
1 1 1 -18 9  28 o 17.53099 6.342535 3.188931       3.481388 -0.2047916     6.582336 4.506969       4.102097 18.68189 8.028726 19.96807 6.916349 -1.286180      10.59700 
1 1 1 -18 9  29 o 68.92052 3.120166 58.29004       5.226783 52.68736       8.279064 62.00299       6.739730 65.08241 5.265046 70.94470 3.913562 -5.862289      6.560234 
1 1 1 -18 9  30 o 18.18377 6.662985 3.388545       3.859365 14.98101       9.850524 1.286399       4.194719 33.85827 10.68161 16.26491 6.656397 17.59336       12.58588 
1 1 1 -18 9  31 o 47.48014 4.070950 27.99631       4.664833 8.507077       8.586494 36.15720       5.556320 27.36959 9.952418 53.95697 4.260293 -26.58738      10.82593 
1 1 1 -18 9  32 o 36.41302 5.483168 16.91654       4.714656 23.16849       6.473012 9.852248       6.880709 42.40842 6.467898 27.65129 8.949365 14.75713       11.04196 
1 1 1 -18 9  33 o 117.1398 3.049490 168.9232       8.697581 167.2041       13.10809 170.2755       11.62543 115.7560 4.656364 117.1364 4.078912 -1.380417      6.190254 
1 1 1 -18 9  34 o 30.61500 5.152828 12.08822       3.707901 10.92441       5.917648 12.84048       4.757659 28.36636 8.137589 31.13875 6.480944 -2.772390      10.40303 
1 1 1 -18 9  35 o 29.13828 5.345737 11.08553       3.655997 17.33706       6.015273 7.423383       4.603945 35.85314 7.135834 23.61278 7.280172 12.24035       10.19417 
1 1 1 -18 9  36 o 12.12460 5.486454 -1.552316      3.475582 -5.037556      5.420897 0.8803332      4.528919 13.48768 6.357604 15.94826 6.750254 -2.460581      9.272813 
1 1 1 -18 9  37 o 72.71866 3.855751 66.70626       6.808256 68.45401       8.917285 64.26360       10.54203 72.78578 5.058961 69.44481 6.297843 3.340973       8.078114 
1 1 1 -18 9  38 o 40.18282 5.166113 21.32955       4.941812 16.41402       8.381370 23.94913       6.118513 32.12334 9.807732 41.95661 6.168216 -9.833271      11.58613 
1 1 1 -18 9  39 o 12.06324 5.536953 -1.894102      3.704115 -2.200636      5.673674 -1.666394      4.890058 14.92445 6.851139 14.14801 6.443589 0.7764368      9.405208 
1 1 1 -18 9  40 o 23.24806 7.437151 8.064482       4.761269 4.813458       5.807146 14.73216       8.316491 19.92322 7.945665 29.26988 9.854736 -9.346664      12.65897 
1 1 1 -18 9  41 o 16.13237 6.788636 2.038806       4.537642 1.335862       9.072648 2.273303       5.240124 19.41319 8.816224 17.01610 7.233979 2.397091       11.40422 
1 1 1 -18 9  42 o 47.80530 4.130661 30.26569       4.764907 36.71055       7.233279 25.32490       6.333249 50.58403 5.983657 41.42879 6.485807 9.155243       8.824389 
1 1 1 -18 9  43 o 21.04077 6.744689 6.965910       3.914439 4.284750       5.978146 8.978263       5.179134 18.42840 7.775476 23.01019 7.776862 -4.581785      10.99716 
1 1 1 -18 9  44 o 32.45851 5.403714 15.29230       4.124017 13.02226       6.284400 17.00926       5.465458 26.31476 8.555571 32.41296 7.114973 -6.098204      11.12747 
1 1 1 -18 10 1  o 54.89166 2.969701 36.87411       3.957628 32.76785       6.429869 39.37858       5.021533 51.48471 5.195945 56.66925 3.655746 -5.184544      6.353135 
1 1 1 -18 10 2  o 109.5664 2.602976 146.4342       6.949980 152.3855       11.60762 143.1085       8.677267 111.5844 4.276691 108.2291 3.293885 3.355309       5.398127 
1 1 1 -18 10 3  o 128.8142 2.675919 202.4111       8.399875 200.0937       13.72524 203.7989       10.62124 127.8729 4.411193 129.1671 3.377226 -1.294159      5.555563 
1 1 1 -18 10 4  o 126.1725 3.008145 194.2495       9.249100 198.3846       21.92773 193.3546       10.20096 126.8949 7.119648 125.8173 3.330016 1.077591       7.859924 
1 1 1 -18 10 5  o 90.73881 2.552373 100.5032       5.638215 96.21599       9.534524 102.8086       6.991687 88.61650 4.429219 91.73280 3.132267 -3.116295      5.424858 
1 1 1 -18 10 6  o 194.7288 3.539073 462.9325       16.79406 498.0470       25.13326 434.6071       22.57325 201.6998 5.117503 188.4420 4.919850 13.25783       7.098856 
1 1 1 -18 10 7  o 226.2861 3.464097 625.0800       19.10223 654.1279       31.57076 608.3038       23.99237 231.1345 5.605110 223.0988 4.413058 8.035660       7.133887 
1 1 1 -18 10 8  o 139.3273 2.992424 236.8571       10.16004 231.7020       15.06944 241.1534       13.75701 137.6085 4.499870 140.4487 4.023632 -2.840149      6.036427 
1 1 1 -18 10 9  o 134.0812 2.949043 219.3487       9.635740 219.7608       14.49354 219.0223       12.89934 134.0179 4.444026 133.8500 3.959046 0.1679077      5.951757 
1 1 1 -18 10 10 o 102.0342 2.899237 127.1238       7.201537 133.2336       10.89875 122.3888       9.594491 104.3286 4.296028 100.0223 3.944037 4.306305       5.831920 
1 1 1 -18 10 11 o 178.1610 2.985130 387.3081       12.96021 382.5611       21.16254 390.1569       16.39416 176.7806 4.917215 178.7392 3.763858 -1.958649      6.192385 
1 1 1 -18 10 12 o 171.1466 3.659726 357.6832       15.26346 383.0022       28.29790 347.2946       18.12635 176.5459 6.589057 168.5009 4.418216 8.044968       7.933240 
1 1 1 -18 10 13 o 134.1732 3.293835 219.7491       10.76970 225.0230       20.10592 217.6270       12.75364 135.3385 6.112075 133.4154 3.927037 1.923065       7.264921 
1 1 1 -18 10 14 f 178.5805 3.338398 389.3181       14.52808 395.1713       21.82230 384.6587       19.46996 179.6380 4.989845 177.3124 4.509646 2.325653       6.725731 
1 1 1 -18 10 15 o 166.0706 3.220976 336.6547       13.03516 335.7082       19.45220 337.4261       17.56146 165.5798 4.826018 166.0809 4.342880 -0.5010529     6.492384 
1 1 1 -18 10 16 o 223.6553 4.347924 611.5734       23.69721 641.5273       43.71096 599.1050       28.20117 228.0498 7.877294 221.1948 5.231859 6.855011       9.456432 
1 1 1 -18 10 17 o 115.7768 3.224987 163.7718       9.089970 168.3100       18.50534 162.3286       10.43574 116.8831 6.522820 115.2128 3.721831 1.670319       7.509940 
1 1 1 -18 10 18 o 154.0253 3.121415 289.6172       11.71601 283.0478       17.45566 295.0030       15.80493 152.0090 4.717991 155.2770 4.180659 -3.268005      6.303757 
1 1 1 -18 10 19 o 179.8046 3.364122 394.8470       14.74038 395.6024       21.93768 394.2251       19.90267 179.6499 5.015947 179.4304 4.555442 0.2194672      6.775823 
1 1 1 -18 10 20 o 117.7430 2.889416 169.2288       8.290512 169.8734       12.84132 168.7681       10.85621 117.7308 4.484127 117.4434 3.798262 0.2873993      5.876579 
1 1 1 -18 10 21 o 149.8006 3.095100 274.0391       11.29859 272.2815       16.90095 275.4593       15.19249 149.0355 4.659284 149.9951 4.160402 -0.9596405     6.246428 
1 1 1 -18 10 22 o 17.58625 6.599174 2.833327       3.827277 6.410347       5.837499 0.1364233      5.068727 23.86941 8.251477 16.77364 7.122169 7.095762       10.90010 
1 1 1 -18 10 23 o 33.44226 5.854901 14.14282       4.597711 8.201894       6.421020 20.39377       6.586425 26.24045 8.654957 40.09137 6.995929 -13.85092      11.12885 
1 1 1 -18 10 24 o 30.45114 6.262219 11.83924       4.491693 8.942777       6.235860 14.96245       6.475334 26.94686 8.498430 34.06034 7.947408 -7.113482      11.63549 
1 1 1 -18 10 25 o 82.07342 2.929912 82.41029       5.850538 81.49794       9.389208 82.98936       7.480247 81.34677 4.757207 82.25656 3.741518 -0.9097900     6.052270 
1 1 1 -18 10 26 o 65.40523 3.141760 52.43158       4.992863 49.54713       8.221727 54.11681       6.284359 63.21010 5.388871 66.34576 3.904232 -3.135666      6.654544 
1 1 1 -18 10 27 o 63.95038 3.114100 50.14993       4.838427 53.43206       8.009281 48.26384       6.071510 65.68488 5.042264 62.60224 4.000826 3.082638       6.436695 
1 1 1 -18 10 28 o 77.29778 3.264937 73.30585       6.136189 73.58795       11.57130 73.19549       7.237660 76.75453 6.240247 77.13367 3.862802 -0.3791428     7.339068 
1 1 1 -18 10 29 o 25.59248 6.245889 8.475453       3.860507 10.62950       9.992151 8.097505       4.185510 30.21237 10.76779 25.02843 6.721145 5.183933       12.69327 
1 1 1 -18 10 30 o 83.95621 3.000173 86.50986       6.128251 87.28297       9.801820 86.01372       7.852181 83.85624 4.816886 83.51508 3.868752 0.3411636      6.178158 
1 1 1 -18 10 31 o 23.34450 6.019115 7.083034       3.446142 13.25603       6.006257 4.053607       4.207618 31.62771 7.833985 19.33359 6.975712 12.29412       10.48961 
1 1 1 -18 10 32 o 67.32917 4.313058 56.42147       7.039385 46.25783       10.34201 65.19502       9.608768 59.78223 7.246775 71.92596 5.524377 -12.14374      9.112327 
1 1 1 -18 10 33 o 31.63667 4.975636 12.80956       3.709457 10.99673       6.014935 13.92221       4.712263 28.56767 8.206995 32.64046 6.149837 -4.072790      10.25550 
1 1 1 -18 10 34 o 61.65885 3.333230 47.14619       4.989755 50.02996       7.830182 45.17445       6.474651 62.77237 5.164424 59.93805 4.464868 2.834324       6.826883 
1 1 1 -18 10 35 o 53.67705 3.662816 36.02498       4.762443 39.94533       7.523483 33.40376       6.151888 55.60559 5.629668 51.11789 5.002518 4.487698       7.531158 
1 1 1 -18 10 36 o 73.87695 3.840183 68.57327       6.889750 63.69820       8.720695 76.66978       11.23853 70.37521 5.120073 76.43280 6.084011 -6.057587      7.951751 
1 1 1 -18 10 37 f 42.04987 4.351843 22.71029       4.394999 24.28598       6.949721 21.66015       5.673584 41.86850 7.062536 40.17996 5.976106 1.688545       9.251662 
1 1 1 -18 10 38 o 28.93465 6.655738 11.83441       4.595167 23.65536       8.706812 7.270646       5.409966 38.98484 9.296170 22.74499 7.938928 16.23985       12.22478 
1 1 1 -18 10 39 o 24.77993 6.553742 8.814038       4.017667 18.72172       6.161824 1.486851       5.298975 35.83088 7.304930 16.85591 7.223094 18.97496       10.27303 
1 1 1 -18 10 40 o 32.48939 5.454338 14.52809       4.165490 13.24762       6.478428 15.43056       5.438797 28.63134 8.597847 32.27033 7.108481 -3.638988      11.15587 
1 1 1 -18 10 41 o 21.56993 8.026608 7.082848       5.638216 5.936490       8.280528 8.073724       7.698529 21.36672 9.088930 22.71800 9.118605 -1.351284      12.87469 
1 1 1 -18 10 42 o 35.55986 5.354849 17.81220       4.496436 16.60025       6.490656 18.93052       6.234895 31.25020 8.359955 34.37768 7.640594 -3.127476      11.32553 
1 1 1 -18 10 43 o 11.78136 5.469862 -1.756467      3.767717 -5.645794      5.730491 1.205083       5.000509 12.61938 6.103733 15.36590 6.791452 -2.746515      9.131231 
1 1 1 -18 10 44 o 17.89590 6.644787 4.863410       3.860011 5.328562       5.860426 4.506987       5.129970 18.79408 7.797081 17.86570 7.341829 0.9283810      10.70967 
1 1 1 -18 11 1  o 224.7977 3.501559 617.0537       19.18180 660.8879       31.90044 592.2291       24.00661 232.2492 5.636459 220.0797 4.476254 12.16946       7.197675 
1 1 1 -18 11 2  o 163.6842 2.936622 326.9354       11.71361 335.9253       19.28682 321.6814       14.74442 165.6489 4.782895 162.2902 3.728200 3.358688       6.064286 
1 1 1 -18 11 3  o 183.5561 3.090350 411.1900       13.82333 410.3003       22.41143 411.7363       17.56188 183.0470 5.029010 183.5875 3.925470 -0.5405273     6.379675 
1 1 1 -18 11 4  f 96.60506 2.591578 113.9204       6.095479 120.7651       10.46087 110.4017       7.500352 99.30763 4.333071 95.05054 3.242854 4.257088       5.412172 
1 1 1 -18 11 5  o 118.5806 3.509853 171.8264       10.13119 170.8926       21.07046 172.1072       11.55450 117.6774 7.384824 118.6261 4.002741 -0.9487076     8.399855 
1 1 1 -18 11 6  o 175.5210 3.000921 375.9269       12.83570 383.2740       21.22609 371.6915       16.11628 176.9395 4.927564 174.4529 3.790970 2.486557       6.217100 
1 1 1 -18 11 7  o 54.03233 3.133197 35.74865       4.107813 36.46511       6.865134 35.34906       5.126895 54.33432 5.250204 53.65006 3.949138 0.6842537      6.569653 
1 1 1 -18 11 8  o 296.7869 4.223651 1076.377       30.54702 1073.749       48.90111 1078.059       39.11825 295.7432 6.785281 296.7416 5.409596 -0.9983521     8.677774 
1 1 1 -18 11 9  o 108.6873 2.551364 144.0886       6.757518 168.6313       12.18570 133.1896       8.120515 117.3900 4.266841 104.4154 3.195172 12.97461       5.330578 
1 1 1 -18 11 10 o 107.6057 2.988200 141.4016       7.828170 140.3754       11.79256 142.2101       10.46701 107.0578 4.530401 107.8184 3.990650 -0.7606506     6.037369 
1 1 1 -18 11 11 o 144.3284 3.382491 254.2998       11.89665 245.2931       21.29518 258.3861       14.34367 141.2960 6.199748 145.3665 4.053069 -4.070511      7.407040 
1 1 1 -18 11 12 o 124.0559 3.230618 187.9789       9.758191 172.1822       17.69913 194.8778       11.69651 118.3343 6.158886 126.2538 3.806026 -7.919464      7.240008 
1 1 1 -18 11 13 o 40.87606 3.560675 20.55698       3.511446 23.61472       6.640980 19.37034       4.137074 43.40085 6.477064 39.56898 4.362778 3.831863       7.809366 
1 1 1 -18 11 14 f 131.1859 2.960744 210.0188       9.465073 208.8221       14.56875 210.8928       12.45068 130.5897 4.585130 131.3265 3.894796 -0.7367859     6.016049 
1 1 1 -18 11 15 o 42.45415 3.642013 22.17476       3.731515 19.06863       6.857368 23.48145       4.447677 38.71271 7.540107 43.62452 4.237063 -4.911808      8.649041 
1 1 1 -18 11 16 o 87.97295 2.822015 94.53845       6.042023 101.4720       10.11170 90.68822       7.535121 90.96249 4.576391 86.09144 3.599593 4.871048       5.822407 
1 1 1 -18 11 17 o 184.2826 3.892499 415.0249       17.48030 416.4803       32.64114 414.4397       20.69860 183.7746 7.303136 183.9831 4.620305 -0.2084808     8.641933 
1 1 1 -18 11 18 o 102.0560 2.857816 127.2207       7.100373 126.5479       11.24339 127.6671       9.157480 101.5926 4.553065 102.1516 3.684739 -0.5589981     5.857278 
1 1 1 -18 11 19 o 71.90680 3.604500 63.33714       6.295991 72.36494       8.918827 54.36962       8.889001 76.72558 4.794101 66.34983 5.548404 10.37575       7.332680 
1 1 1 -18 11 20 o 91.70490 2.859463 102.7636       6.382370 119.3198       10.66199 93.51788       7.967598 98.63207 4.447362 87.38499 3.750304 11.24708       5.817544 
1 1 1 -18 11 21 o 159.0064 3.220893 308.8448       12.48036 297.2704       18.36514 318.7767       17.01219 155.6745 4.846967 161.3200 4.331408 -5.645462      6.500321 
1 1 1 -18 11 22 o 73.17395 3.717153 65.64338       6.606599 75.26309       8.917730 53.94082       9.835889 78.22955 4.699530 65.92442 6.195141 12.30514       7.775947 
1 1 1 -18 11 23 o 123.2406 3.509624 185.8659       10.52951 182.5793       13.52431 190.9244       16.77827 121.9635 4.558415 124.5079 5.543764 -2.544365      7.177218 
1 1 1 -18 11 24 o 28.14153 5.231095 10.03893       3.455361 11.47651       6.314064 9.424340       4.128415 29.92138 8.345736 27.10444 6.360456 2.816938       10.49317 
1 1 1 -18 11 25 o 195.5740 3.577462 468.1444       17.04991 486.9464       25.60216 453.1603       22.85538 198.8672 5.287652 191.9849 4.889211 6.882278       7.201642 
1 1 1 -18 11 26 f 40.00697 4.018807 19.82067       3.865028 23.10394       6.805691 18.25763       4.695755 42.66298 6.772138 38.16936 5.182129 4.493622       8.527386 
1 1 1 -18 11 27 o 37.42010 4.349862 17.43359       3.892741 18.12396       6.804245 17.09769       4.746201 37.41635 7.718747 36.83069 5.452614 0.5856590      9.450399 
1 1 1 -18 11 28 o 79.30367 3.301236 77.20156       6.365832 69.64655       12.42007 79.89343       7.413674 74.36751 6.933265 80.58350 3.785882 -6.215996      7.899561 
1 1 1 -18 11 29 o 31.91905 5.504774 12.98649       4.127169 10.02882       10.58104 13.51722       4.482193 29.97980 11.02468 32.49098 5.877273 -2.511177      12.49343 
1 1 1 -18 11 30 o 86.26233 3.005512 91.36819       6.308291 74.40902       9.696227 103.8148       8.306643 77.23589 5.181644 91.77291 3.722005 -14.53702      6.379871 
1 1 1 -18 11 31 o 34.72634 4.642617 15.21418       3.830443 7.593590       6.263797 19.76623       4.841136 24.95115 8.550494 39.52034 5.149109 -14.56920      9.981196 
1 1 1 -18 11 32 o 30.36838 6.307995 12.08431       4.515450 22.17397       6.538405 2.884505       6.243423 41.25599 6.735723 20.24959 8.182158 21.00641       10.59800 
1 1 1 -18 11 33 o 18.70228 6.469848 4.147065       3.589079 -2.600940      5.812727 8.304870       4.562725 15.62441 7.080184 24.98660 7.138338 -9.362196      10.05410 
1 1 1 -18 11 34 o 33.99281 4.904541 14.83399       3.945398 15.04164       6.287181 14.69911       5.067350 33.07052 7.908440 33.24618 6.487637 -0.1756630     10.22902 
1 1 1 -18 11 35 o 61.60110 3.382104 47.29702       5.057570 41.38404       7.745731 51.69155       6.677526 56.44914 5.709181 63.96903 4.308743 -7.519890      7.152623 
1 1 1 -18 11 36 o 61.18189 4.155707 47.45350       6.159120 40.38318       7.917198 58.29149       9.802265 55.29099 5.970563 66.38424 6.128487 -11.09325      8.556049 
1 1 1 -18 11 37 o 43.70396 4.633651 24.75862       4.859824 28.01921       8.702843 23.28114       5.858318 43.72355 8.473907 41.58778 5.949922 2.135777       10.35416 
1 1 1 -18 11 38 o 13.77465 5.998113 0.1109160      3.771605 1.559894       5.534875 -1.145144      5.153260 17.28346 7.393669 14.89690 6.716391 2.386564       9.988806 
1 1 1 -18 11 39 o 24.21538 6.563157 8.468827       3.968898 14.13205       5.978921 4.007390       5.306746 30.38628 7.975238 18.94901 7.582702 11.43727       11.00463 
1 1 1 -18 11 40 o 29.89335 6.887963 13.24352       4.914486 1.508740       8.606311 18.92142       5.986507 19.37701 8.712851 35.69318 7.132232 -16.31617      11.25977 
1 1 1 -18 11 41 o 22.06841 7.472775 7.599455       4.782123 3.648214       5.888113 15.25629       8.196608 18.41481 7.740163 28.55126 9.781231 -10.13645      12.47328 
1 1 1 -18 11 42 o 16.65211 6.592464 3.463574       3.969481 7.442782       6.069577 0.4896374      5.247180 21.31269 8.234497 15.26937 6.839450 6.043329       10.70444 
1 1 1 -18 11 43 o 29.67358 7.034966 14.13206       5.009195 13.81906       6.445062 14.60960       7.960760 27.28873 8.644113 26.57703 9.594282 0.7117081      12.91398 
1 1 1 -18 11 44 o 28.66628 6.130550 12.63089       4.152949 12.47014       6.465646 12.74378       5.418457 25.27997 8.686375 26.84620 7.812713 -1.566229      11.68296 
1 1 1 -18 12 1  o 125.0974 2.716408 190.9367       8.280933 184.5840       13.49976 194.7691       10.48535 122.7699 4.520017 126.2516 3.411208 -3.481728      5.662764 
1 1 1 -18 12 2  o 112.3300 2.663033 153.9398       7.289680 157.9744       12.26970 151.7387       9.062526 113.5780 4.441624 111.4336 3.341086 2.144363       5.557956 
1 1 1 -18 12 3  o 101.5562 2.644614 125.9066       6.539360 121.0109       10.98374 128.5947       8.139065 99.37317 4.547762 102.5850 3.259916 -3.211792      5.595461 
1 1 1 -18 12 4  o 136.9010 3.082033 228.7375       10.28206 228.8119       15.26896 228.6758       13.90816 136.7096 4.589766 136.7246 4.179240 -0.1493835E-01 6.207415 
1 1 1 -18 12 5  o 225.7095 3.928453 622.3879       21.60765 607.3118       45.59595 626.7542       24.53792 221.7371 8.453722 226.4151 4.447297 -4.678009      9.552166 
1 1 1 -18 12 6  o 125.3159 2.966041 191.6346       9.057732 190.4939       13.72833 192.5139       12.05358 124.7367 4.523842 125.4687 3.947165 -0.7320023     6.003771 
1 1 1 -18 12 7  o 125.4118 2.668908 191.8724       8.156582 190.8148       13.79071 192.4414       10.11559 124.8401 4.540673 125.5131 3.310130 -0.6729813     5.619134 
1 1 1 -18 12 8  o 172.8035 3.265808 364.5067       13.75243 364.6551       27.88470 364.4590       15.80880 172.2175 6.656889 172.7414 3.755489 -0.5238647     7.643158 
1 1 1 -18 12 9  o 134.1942 3.302788 219.8315       10.80067 214.2729       19.60202 222.2547       12.94258 132.0488 6.108130 134.8208 3.943617 -2.772003      7.270583 
1 1 1 -18 12 10 o 78.23341 3.995143 74.97478       7.591373 65.62510       11.09535 83.20370       10.40913 72.87029 6.310323 82.27818 5.218395 -9.407890      8.188518 
1 1 1 -18 12 11 o 98.69467 2.838959 118.9504       6.820832 110.5052       10.74387 124.6523       8.828082 94.93939 4.658071 100.9676 3.593698 -6.028175      5.883221 
1 1 1 -18 12 12 o 81.95477 2.552154 82.01224       5.090817 81.76116       9.236916 82.12178       6.101069 81.62650 4.663053 81.97150 3.059637 -0.3450012     5.577225 
1 1 1 -18 12 13 o 92.03894 2.729903 103.4468       6.116102 113.9561       14.07721 101.0014       6.790485 96.20567 6.034943 90.91666 3.069335 5.289001       6.770624 
1 1 1 -18 12 14 o 199.5696 3.578110 486.4493       17.40140 486.7023       25.79864 486.2381       23.57059 199.2631 5.317680 199.3257 4.852561 -0.6260681E-01 7.198963 
1 1 1 -18 12 15 o 286.5485 4.590320 1004.549       32.05363 994.9479       46.13131 1013.512       44.57034 284.5401 6.652980 287.2852 6.366438 -2.745178      9.208348 
1 1 1 -18 12 16 o 203.8575 3.632244 507.6983       18.04421 492.7888       26.26746 521.0205       24.82991 200.4554 5.382168 206.2841 4.939389 -5.828720      7.305155 
1 1 1 -18 12 17 o 122.4430 3.319253 183.2277       9.894857 184.3157       19.78343 182.8647       11.42681 122.2484 6.666054 122.2589 3.840141 -0.1055145E-01 7.693046 
1 1 1 -18 12 18 o 62.50023 3.114959 47.81496       4.729325 52.49268       8.247493 45.52331       5.772696 65.23511 5.231884 60.89789 3.910586 4.337219       6.531867 
1 1 1 -18 12 19 o 161.3951 3.219443 318.1531       12.66214 322.8945       19.13948 314.4627       16.88551 162.2746 4.845407 160.2426 4.328106 2.031982       6.496959 
1 1 1 -18 12 20 o 248.6476 4.145065 756.4744       25.11607 762.3542       36.76622 751.3296       34.39156 249.0212 6.058660 247.3384 5.705902 1.682816       8.322539 
1 1 1 -18 12 21 o 131.0496 3.635707 210.1314       11.59954 211.4205       14.91883 208.1608       18.44505 131.2739 4.671033 130.0069 5.836955 1.267044       7.475867 
1 1 1 -18 12 22 o 38.10232 5.449122 18.18873       4.915672 17.28462       7.125664 19.00969       6.790090 36.62051 8.190334 38.56143 7.495873 -1.940922      11.10269 
1 1 1 -18 12 23 o 38.72086 4.000458 18.55136       3.720483 21.94029       7.022271 17.22886       4.386766 41.53417 7.198764 37.13889 4.971857 4.395287       8.748803 
1 1 1 -18 12 24 o 105.2152 2.921399 135.3812       7.483155 130.3691       11.70026 138.8505       9.734421 102.9515 4.675863 106.4287 3.759220 -3.477203      5.999619 
1 1 1 -18 12 25 o 26.31319 5.619060 8.856220       3.493496 12.75116       6.441397 7.233119       4.158171 31.37974 8.297949 23.85924 6.813973 7.520496       10.73714 
1 1 1 -18 12 26 o 20.59102 6.316223 5.266973       3.470896 11.96373       6.459836 2.548973       4.115417 30.40162 8.427274 17.57136 6.782797 12.83026       10.81782 
1 1 1 -18 12 27 o 105.6924 2.946807 136.8045       7.582410 141.2398       12.08756 133.9270       9.736198 106.9936 4.647097 104.3906 3.833807 2.603004       6.024416 
1 1 1 -18 12 28 o 127.2302 4.017923 199.2894       12.44179 0.000000       0.000000 199.2894       12.44179 ?        ?        127.2302 4.017923 0.000000       4.017923 
1 1 1 -18 12 29 o 20.89217 6.152584 5.552536       3.343134 8.228940       6.135806 4.422533       3.986902 25.74386 8.459076 19.64785 6.817846 6.096014       10.86457 
1 1 1 -18 12 30 o 96.33055 2.984887 113.9736       6.998479 106.1705       10.89118 119.4617       9.133810 92.36511 4.855782 98.37804 3.817180 -6.012932      6.176526 
1 1 1 -18 12 31 o 77.53709 3.073793 74.01937       5.796405 80.10593       9.375624 70.25357       7.374676 80.07049 4.827401 75.25304 4.036219 4.817451       6.292445 
1 1 1 -18 12 32 o 45.98479 4.494734 26.57880       4.972556 29.26518       7.070220 23.94935       6.994897 47.63234 6.241075 42.73347 6.956056 4.898861       9.345466 
1 1 1 -18 12 33 o 26.16468 5.705975 9.008508       3.535425 10.76659       5.845825 7.994657       4.439290 28.11357 8.095235 24.48334 7.055848 3.630239       10.73861 
1 1 1 -18 12 34 o 48.20427 3.722900 29.09564       4.339372 23.61694       6.829493 32.80502       5.619537 42.03430 6.906966 50.86063 4.583124 -8.826336      8.289222 
1 1 1 -18 12 35 o 16.58817 6.986529 1.191803       4.812706 0.9926178      6.528724 1.428857       7.122342 18.56019 7.986439 19.50667 8.366844 -0.9464798     11.56665 
1 1 1 -18 12 36 o 39.38881 4.520690 20.00416       4.260684 17.58428       6.458420 21.86889       5.669420 35.12748 7.752676 40.45089 5.927222 -5.323402      9.758890 
1 1 1 -18 12 37 o 17.39521 6.725251 3.245855       4.050484 -5.578363      7.196657 7.337193       4.900331 15.40513 7.280740 22.80658 7.562461 -7.401445      10.49762 
1 1 1 -18 12 38 o 11.86254 5.489735 -2.305285      3.749087 1.636320       5.581698 -5.545213      5.060547 17.32042 7.417526 12.34356 5.909660 4.976855       9.483869 
1 1 1 -18 12 39 o 19.95955 6.824192 5.593039       3.989328 1.837026       6.212715 8.228303       5.203912 17.86021 7.738266 23.36156 7.794510 -5.501354      10.98340 
1 1 1 -18 12 40 o 12.16307 5.686273 -2.711259      4.185242 0.3545266      7.396914 -4.154910      5.075874 17.68694 8.003640 12.76540 6.057093 4.921536       10.03726 
1 1 1 -18 12 41 o 25.07625 7.411647 10.04452       4.844105 11.52282       6.109461 7.541761       7.949364 25.94629 8.435640 21.95611 9.092442 3.990175       12.40292 
1 1 1 -18 12 42 o 13.40826 5.917588 0.3726197      3.783271 3.464293       6.097945 -1.562146      4.823928 17.90972 7.712627 13.44483 6.223792 4.464890       9.910611 
1 1 1 -18 12 43 o 28.78393 6.126376 12.60769       4.165229 12.32979       6.694111 12.78325       5.320664 25.23822 8.829517 27.28892 7.679108 -2.050697      11.70167 
1 1 1 -18 13 1  o 179.7897 3.388628 394.7215       14.84652 394.8420       29.00729 394.6788       17.28163 179.1350 6.656510 179.7096 3.946184 -0.5745850     7.738314 
1 1 1 -18 13 2  o 111.9558 2.684726 152.9283       7.324577 159.7353       12.52781 149.3930       9.028481 114.1914 4.510878 110.5616 3.354881 3.629807       5.621676 
1 1 1 -18 13 3  o 54.87985 3.265950 36.89885       4.348003 36.10912       7.159649 37.36028       5.472780 54.01048 5.517147 55.13676 4.102552 -1.126282      6.875307 
1 1 1 -18 13 4  f 150.9733 2.861644 278.1347       10.52814 262.8743       17.08690 287.4738       13.36692 146.4986 4.792682 153.4229 3.575241 -6.924210      5.979311 
1 1 1 -18 13 5  o 111.2168 3.854284 151.2963       10.43021 0.000000       0.000000 151.2963       10.43021 ?        ?        111.2168 3.854284 0.000000       3.854284 
1 1 1 -18 13 6  o 126.9909 2.920310 196.7961       9.037275 188.4535       18.14801 199.5470       10.42132 123.8169 6.032845 127.8010 3.349091 -3.984077      6.900119 
1 1 1 -18 13 7  o 76.76479 3.114481 72.04362       5.814083 61.70914       10.71522 76.35583       6.921601 70.64216 6.290168 78.98849 3.605399 -8.346336      7.250180 
1 1 1 -18 13 8  o 228.2916 4.422282 637.2492       24.60211 625.6749       43.11871 642.8359       29.95687 225.2239 7.868334 229.1008 5.365792 -3.876892      9.523781 
1 1 1 -18 13 9  o 247.8260 4.141680 750.6591       25.01263 720.1500       35.62002 780.3370       35.13145 242.3184 6.032144 252.3259 5.713446 -10.00752      8.308443 
1 1 1 -18 13 10 o 92.10776 3.065858 103.6618       6.871929 104.9940       10.51924 102.6700       9.076367 92.52695 4.680510 91.56656 4.077837 0.9603882      6.207731 
1 1 1 -18 13 11 o 103.3609 2.575196 130.3315       6.486382 133.3675       11.55357 128.9341       7.838221 104.3241 4.555583 102.7275 3.134751 1.596527       5.529919 
1 1 1 -18 13 12 o 105.4361 2.790168 135.7453       7.162652 122.3573       15.28359 139.5133       8.108198 99.63837 6.327203 106.8621 3.116945 -7.223686      7.053286 
1 1 1 -18 13 13 o 146.8819 2.787269 263.2656       9.976611 275.5095       17.30830 257.1736       12.20883 149.9718 4.741927 145.1144 3.452452 4.857483       5.865603 
1 1 1 -18 13 14 o 116.2477 2.627898 164.8800       7.444386 162.1025       12.93231 166.2565       9.104037 115.0083 4.623777 116.6493 3.205735 -1.641006      5.626371 
1 1 1 -18 13 15 o 139.8769 3.059921 238.8529       10.43019 259.7230       16.66932 225.4246       13.37112 145.5951 4.704412 135.7311 4.047040 9.863998       6.205645 
1 1 1 -18 13 16 o 138.3948 3.053758 233.8340       10.29889 239.8760       16.01096 229.5697       13.45092 139.9034 4.702954 136.9672 4.034343 2.936203       6.196265 
1 1 1 -18 13 17 o 236.8903 4.595605 686.9763       26.52932 705.6908       48.95635 679.1960       31.56582 238.6336 8.431879 235.3053 5.504898 3.328339       10.06978 
1 1 1 -18 13 18 o 114.4877 2.930435 160.1334       8.169021 165.9506       13.03405 156.3701       10.48352 116.3246 4.607143 113.0290 3.811561 3.295609       5.979445 
1 1 1 -18 13 19 o 184.8657 3.460737 417.6305       15.59053 426.6688       23.52342 410.5503       20.81996 186.4461 5.182420 183.0131 4.672152 3.432983       6.977570 
1 1 1 -18 13 20 o 142.1248 3.671432 247.1406       12.70509 249.2934       16.48742 243.9934       19.93493 142.5445 4.753068 140.7761 5.823559 1.768356       7.517014 
1 1 1 -18 13 21 o 141.8414 4.809073 247.0077       16.59862 247.0077       16.59862 0.000000       0.000000 141.8414 4.809073 ?        ?        0.000000       4.809073 
1 1 1 -18 13 22 o 121.4714 2.988668 180.2785       8.846837 181.7291       13.90882 179.2929       11.46498 121.6252 4.701639 120.9618 3.894533 0.6634521      6.105145 
1 1 1 -18 13 23 o 44.32717 3.738698 24.22168       4.000944 18.91094       7.046255 26.74863       4.860478 38.34399 7.806589 46.50960 4.338498 -8.165604      8.931148 
1 1 1 -18 13 24 o 53.26821 3.388009 34.85950       4.375143 34.28383       7.495278 35.15703       5.388404 52.37139 5.980021 53.38318 4.175285 -1.011791      7.293399 
1 1 1 -18 13 25 f 102.6355 2.942975 128.9228       7.353117 124.4620       11.57477 131.9412       9.521197 100.4869 4.740155 103.6837 3.774595 -3.196747      6.059425 
1 1 1 -18 13 26 o 141.2186 3.116866 244.1204       10.72620 252.4973       16.64584 238.1725       14.02654 143.0971 4.780231 139.1818 4.140142 3.915314       6.323875 
1 1 1 -18 13 27 o 63.43015 3.963725 49.63796       6.096200 0.000000       0.000000 49.63796       6.096200 ?        ?        63.43015 3.963725 0.000000       3.963725 
1 1 1 -18 13 28 o 53.60603 3.533219 35.44365       4.589781 36.64322       8.313793 34.91777       5.504663 53.76380 6.475861 53.05165 4.294588 0.7121506      7.770474 
1 1 1 -18 13 29 o 31.09966 5.098577 12.30614       3.730253 9.242327       6.439507 13.85345       4.576260 26.95501 8.651758 32.82286 5.939961 -5.867844      10.49457 
1 1 1 -18 13 30 o 52.68977 3.469773 34.32813       4.430365 35.88891       7.475804 33.48324       5.500299 53.18033 5.865948 51.80540 4.398417 1.374931       7.331809 
1 1 1 -18 13 31 o 71.39624 3.133114 62.85646       5.437870 69.44406       8.740153 58.69587       6.945969 74.45059 4.843719 68.67208 4.170313 5.778511       6.391645 
1 1 1 -18 13 32 o 30.27641 5.119260 11.81326       3.642507 12.90389       6.200130 11.23845       4.501188 30.75324 8.145166 29.09743 6.510937 1.655811       10.42766 
1 1 1 -18 13 33 f 70.97755 3.189604 62.41076       5.502789 65.82316       8.859909 60.26777       7.021189 72.00073 5.082247 69.34045 4.174494 2.660286       6.576901 
1 1 1 -18 13 34 o 48.98818 3.707504 30.09962       4.393118 29.60893       7.084527 30.40619       5.599736 47.36012 6.294180 48.79076 4.770594 -1.430645      7.897801 
1 1 1 -18 13 35 o 38.85155 5.443698 19.82081       5.012695 20.67509       6.724713 18.75260       7.519773 38.57787 7.422609 35.90990 8.688361 2.667973       11.42728 
1 1 1 -18 13 36 o 12.66750 5.638386 -0.7871654     3.507419 4.935434       5.827357 -4.037951      4.392068 20.72759 8.052046 12.11563 5.714451 8.611964       9.873722 
1 1 1 -18 13 37 o 18.05264 6.871967 3.777044       4.184731 6.557461       7.852683 2.674265       4.945465 22.91376 9.205205 17.62371 7.221742 5.290051       11.69997 
1 1 1 -18 13 38 o 42.05146 4.438395 23.14112       4.479702 20.58465       6.771794 25.13040       5.973539 37.19641 7.723702 42.78144 5.885624 -5.585026      9.710620 
1 1 1 -18 13 39 o 32.10829 6.276234 14.72712       4.734709 7.307047       8.374036 18.21380       5.740332 22.82444 9.379993 35.25233 6.929262 -12.42789      11.66186 
1 1 1 -18 13 40 o 13.97373 6.069732 0.6319030      3.842234 -1.421717      5.688849 2.354443       5.210135 14.91009 6.850343 16.94036 7.207927 -2.030268      9.943913 
1 1 1 -18 13 41 o 30.65184 5.727469 13.57221       4.120876 14.04325       6.088336 13.17398       5.598079 28.66284 8.263914 28.16924 7.858797 0.4936008      11.40408 
1 1 1 -18 13 42 o 13.84921 5.973192 1.103937       3.668466 1.156735       5.638737 1.065189       4.830519 15.91521 7.112178 15.10281 6.675102 0.8123999      9.753977 
1 1 1 -18 13 43 o 15.95729 6.430630 3.199565       3.845185 -0.7930747     6.012332 5.962934       5.001869 14.91256 6.918828 19.26011 7.466045 -4.347555      10.17900 
1 1 1 -18 14 1  f 174.8811 3.385304 373.5124       14.42702 406.8794       29.23453 362.7704       16.58755 181.8139 6.609311 172.2753 3.951145 9.538620       7.700294 
1 1 1 -18 14 2  o 277.7596 6.246293 947.3429       42.27927 970.3757       61.48710 926.6860       58.22962 279.8043 9.029477 273.5702 8.745759 6.234100       12.57059 
1 1 1 -18 14 3  o 204.9377 4.152040 513.4641       20.73573 516.2047       36.42020 512.1495       25.22296 204.6360 7.315153 204.5085 5.061144 0.1275787      8.895315 
1 1 1 -18 14 4  o 90.56321 3.148967 100.2441       6.938965 101.0028       12.79525 99.92801       8.258906 90.56741 5.828440 90.36061 3.758865 0.2068024      6.935400 
1 1 1 -18 14 5  o 101.1304 3.444501 125.0400       8.476366 87.74353       17.98048 135.6971       9.611388 83.77089 8.946205 105.3243 3.750725 -21.55342      9.700645 
1 1 1 -18 14 6  o 141.3576 3.111267 243.9158       10.71748 226.3607       15.92490 258.4500       14.49010 135.9182 4.815593 145.3537 4.094889 -9.435577      6.321239 
1 1 1 -18 14 7  o 54.41883 3.000738 36.25393       3.963958 37.80179       7.972781 35.74566       4.568646 55.18951 6.025914 53.98949 3.491218 1.200016       6.964211 
1 1 1 -18 14 8  o 96.62595 2.637681 113.9960       6.205056 108.7004       11.00530 116.4641       7.513133 94.12378 4.814057 97.62349 3.162307 -3.499710      5.759803 
1 1 1 -18 14 9  f 183.5392 3.446792 411.3883       15.41629 419.0303       23.17428 405.3218       20.64767 184.9072 5.148007 181.9509 4.660564 2.956314       6.944267 
1 1 1 -18 14 10 o 218.1118 3.894701 581.3531       20.70091 585.9175       29.93860 577.1718       28.65463 218.5475 5.626143 217.0287 5.418031 1.518814       7.810797 
1 1 1 -18 14 11 o 236.3744 3.977652 682.8975       22.91202 695.6011       47.47958 679.0411       26.15946 237.2245 8.225624 235.5921 4.556507 1.632385       9.403331 
1 1 1 -18 14 12 o 87.76846 2.612716 94.07138       5.581913 92.04693       10.27692 94.91854       6.648021 86.57378 4.891144 88.12298 3.100590 -1.549194      5.791110 
1 1 1 -18 14 13 o 46.94805 3.133390 27.02909       3.564306 31.82037       7.545362 25.65283       4.043947 50.52438 6.262303 45.67605 3.663833 4.848328       7.255351 
1 1 1 -18 14 14 o 139.4670 2.766813 237.3840       9.403450 252.0216       16.55236 230.4086       11.42641 143.4008 4.743187 137.3446 3.413990 6.056137       5.844070 
1 1 1 -18 14 15 o 97.19717 2.604007 115.3633       6.162266 106.1624       11.00801 119.5625       7.436703 92.97581 4.875543 98.90794 3.089200 -5.932129      5.771834 
1 1 1 -18 14 16 o 121.4519 3.005316 180.0993       8.894680 175.1789       14.00399 183.4266       11.51585 119.4921 4.819125 122.4257 3.864840 -2.933578      6.177455 
1 1 1 -18 14 17 o 110.2209 3.296801 148.5391       8.845133 150.6917       18.24997 147.8782       10.11220 110.3974 6.816960 109.9152 3.780931 0.4821777      7.795280 
1 1 1 -18 14 18 o 161.3385 3.257874 317.9968       12.80880 336.2682       19.97163 305.2298       16.69445 165.5510 4.956041 157.8467 4.344238 7.704300       6.590505 
1 1 1 -18 14 19 o 67.60501 3.832009 56.07920       6.287233 64.17019       9.097177 48.68072       8.699154 72.13175 5.210520 62.68042 5.759538 9.451332       7.766711 
1 1 1 -18 14 20 o 84.20419 3.661482 86.88145       7.495271 96.80980       10.57460 76.85744       10.62541 88.70152 4.911287 78.88660 5.562888 9.814919       7.420678 
1 1 1 -18 14 21 o 72.36043 3.644140 64.21870       6.405191 63.10528       9.000092 65.36140       9.117669 71.48553 5.202056 72.76341 5.175821 -1.277885      7.338291 
1 1 1 -18 14 22 o 97.34068 2.938348 115.8873       6.962034 117.5580       11.28645 114.8611       8.845377 97.74470 4.752605 96.79243 3.757202 0.9522705      6.058368 
1 1 1 -18 14 23 o 36.81441 4.277937 16.84363       3.766462 16.26175       6.981854 17.08247       4.473188 35.40842 8.245811 36.92716 5.107503 -1.518738      9.699484 
1 1 1 -18 14 24 o 87.89531 2.955573 94.57635       6.321575 104.2828       10.51397 89.08067       7.911291 91.97729 4.706483 85.16441 3.821738 6.812881       6.062727 
1 1 1 -18 14 25 o 45.94598 3.670780 26.04484       4.075845 25.32619       7.364065 26.36221       4.893770 44.58366 7.009119 46.10153 4.409725 -1.517868      8.280908 
1 1 1 -18 14 26 o 65.29912 3.475518 52.43555       5.510561 51.14147       12.10778 52.77364       6.188670 63.24851 8.036808 65.43268 3.898884 -2.184166      8.932613 
1 1 1 -18 14 27 o 108.2662 3.897760 144.3457       10.26679 0.000000       0.000000 144.3457       10.26679 ?        ?        108.2662 3.897760 0.000000       3.897760 
1 1 1 -18 14 28 o 82.67713 3.036528 83.94436       6.107458 76.32932       9.914099 88.60178       7.753367 78.22562 5.230836 84.76706 3.762797 -6.541443      6.443624 
1 1 1 -18 14 29 o 104.1013 3.021771 133.1575       7.657626 144.1772       12.50069 126.5387       9.688151 107.6608 4.776641 101.1835 3.936631 6.477379       6.189778 
1 1 1 -18 14 30 f 77.01264 3.084378 73.05231       5.776785 77.33418       9.583797 70.60880       7.239821 78.54959 5.033254 75.45114 3.951320 3.098450       6.398951 
1 1 1 -18 14 31 o 24.51563 6.698542 7.955433       4.114740 4.288525       6.050313 11.11092       5.612556 21.20863 8.214075 28.70883 7.814680 -7.500204      11.33756 
1 1 1 -18 14 32 o 25.02596 6.022574 8.305738       3.628253 19.12405       6.447780 3.292847       4.389092 37.76238 7.270511 18.36759 7.026572 19.39479       10.11104 
1 1 1 -18 14 33 o 13.74776 5.806608 0.5041179      3.339571 -0.2392154     5.776940 0.8772091      4.092735 16.91523 7.393430 15.36626 6.455597 1.548974       9.815169 
1 1 1 -18 14 34 o 41.56956 5.309691 22.48139       5.256122 22.26190       6.950319 22.77461       8.033294 40.25686 7.355790 40.00276 8.503003 0.2541008      11.24316 
1 1 1 -18 14 35 o 19.31606 6.364092 4.893074       3.472072 8.002522       5.887828 3.235258       4.299140 24.06402 8.288368 17.80502 6.916271 6.258995       10.79499 
1 1 1 -18 14 36 o 37.22426 4.741599 18.14054       4.203681 16.07863       6.517176 19.60957       5.500982 32.90284 8.166553 37.86711 6.173830 -4.964275      10.23761 
1 1 1 -18 14 37 o 41.16526 4.666964 22.25312       4.599168 28.67149       7.110171 17.63565       6.030726 45.23722 6.647980 34.81710 7.339571 10.42012       9.902774 
1 1 1 -18 14 38 o 33.00714 6.063247 15.28448       4.697296 24.27828       9.472189 12.35142       5.409279 37.61027 10.11589 28.51088 7.633939 9.099386       12.67313 
1 1 1 -18 14 39 o 25.08738 7.016563 9.528613       4.456487 17.59423       9.439118 7.215023       5.055406 30.45765 10.49423 21.85080 7.670920 8.606848       12.99892 
1 1 1 -18 14 40 o 26.26013 7.311429 10.87732       4.850702 9.269822       6.382963 13.07471       7.462766 23.49547 8.575249 26.80459 9.326267 -3.309120      12.66942 
1 1 1 -18 14 41 o 28.17452 6.249480 11.94760       4.178410 13.87780       6.695172 10.71618       5.347680 27.55949 8.819424 25.14136 7.861710 2.418125       11.81477 
1 1 1 -18 14 42 o 15.25454 6.294925 2.475016       3.791981 4.359319       6.128911 1.306361       4.826710 18.34624 7.812289 15.19997 6.697158 3.146272       10.28998 
1 1 1 -18 15 1  o 104.7264 3.646073 134.1811       9.290835 124.3256       14.26806 141.4363       12.24189 100.4735 5.852773 107.3831 4.689482 -6.909630      7.499747 
1 1 1 -18 15 2  o 96.36185 2.909639 113.4457       6.824684 111.7398       13.55962 114.0244       7.897969 95.23979 5.870959 96.56415 3.361447 -1.324356      6.765167 
1 1 1 -18 15 3  o 230.8854 4.005983 651.7018       22.53937 652.9641       32.98742 650.5964       30.86890 230.5941 5.875138 230.3504 5.499157 0.2436829      8.047234 
1 1 1 -18 15 4  f 76.55022 2.760398 71.60454       5.140940 71.14877       9.348374 71.80213       6.155255 76.04794 5.073452 76.60863 3.304875 -0.5606918     6.054925 
1 1 1 -18 15 5  o 235.3168 4.061340 676.9706       23.28941 712.1644       51.24435 667.8090       26.14560 239.7291 8.786674 233.6100 4.592731 6.119125       9.914576 
1 1 1 -18 15 6  o 68.22377 2.807003 56.89850       4.656785 52.89085       8.684951 58.51563       5.516881 65.45923 5.495210 69.14706 3.283419 -3.687828      6.401420 
1 1 1 -18 15 7  o 89.94847 2.673603 98.81033       5.853889 89.50978       10.48573 103.0215       7.055785 85.34138 5.064779 91.80542 3.158554 -6.464043      5.968957 
1 1 1 -18 15 8  o 57.30363 2.939816 40.18501       4.091517 48.79345       8.021561 37.15780       4.756827 62.88656 5.283177 55.03798 3.565848 7.848583       6.373949 
1 1 1 -18 15 9  o 93.44214 2.660937 106.6273       6.053004 103.3941       10.82575 108.0978       7.300871 91.77090 4.858103 94.03883 3.190515 -2.267921      5.812104 
1 1 1 -18 15 10 o 49.16764 4.359513 29.80025       5.169319 31.77951       9.831654 29.04404       6.077128 50.06789 8.352118 48.40915 5.234682 1.658737       9.856965 
1 1 1 -18 15 11 o 147.5285 2.857690 265.6457       10.27371 257.8060       17.36934 269.8643       12.74154 145.0090 4.922463 148.6297 3.517872 -3.620743      6.050295 
1 1 1 -18 15 12 o 73.39356 2.740604 65.82988       4.893019 69.29372       9.225372 64.47406       5.771733 75.03701 5.074985 72.58624 3.271398 2.450775       6.038006 
1 1 1 -18 15 13 o 51.77000 3.059226 32.83669       3.842247 37.03717       7.668363 31.42866       4.439762 54.62286 5.852031 50.58608 3.625619 4.036781       6.884140 
1 1 1 -18 15 14 o 160.3925 2.917517 314.0630       11.40338 318.3446       19.38017 311.7956       14.10319 161.1160 4.941930 159.7285 3.623255 1.387512       6.127859 
1 1 1 -18 15 15 o 60.65155 2.847310 45.00594       4.196611 48.21424       8.249697 43.88587       4.874426 62.44986 5.476257 59.84216 3.356014 2.607704       6.422790 
1 1 1 -18 15 16 o 104.2317 2.884660 132.7442       7.320029 136.7604       17.63878 131.9086       8.045552 105.1123 6.924766 103.8715 3.182261 1.240723       7.620969 
1 1 1 -18 15 17 o 35.01502 4.466290 15.25346       3.724357 21.08167       7.035541 12.98440       4.389885 40.71630 7.361666 32.01973 5.841152 8.696564       9.397509 
1 1 1 -18 15 18 o 39.27328 5.260851 19.26123       4.908360 18.38708       7.286575 19.98738       6.641170 37.81297 8.148188 39.65231 7.135236 -1.839348      10.83072 
1 1 1 -18 15 19 o 123.8983 3.613577 187.9040       10.89869 197.9305       14.64406 175.4550       16.31756 126.9555 4.741738 119.3261 5.627413 7.629425       7.358794 
1 1 1 -18 15 20 o 71.64935 3.097717 62.85313       5.395886 66.83017       9.304920 60.83813       6.623235 73.56799 5.224230 70.39249 3.876031 3.175491       6.505090 
1 1 1 -18 15 21 o 100.8483 3.555102 124.5997       8.723218 129.0181       11.96955 119.5947       12.73940 102.3935 4.810440 98.46319 5.329181 3.930351       7.179171 
1 1 1 -18 15 22 o 33.18014 4.724513 13.78873       3.712265 16.26955       7.049554 12.83682       4.366775 35.40759 8.313188 31.77274 5.855571 3.634853       10.16842 
1 1 1 -18 15 23 o 128.3249 3.050949 201.4111       9.540739 204.1028       14.95825 199.5651       12.38765 128.7388 4.776269 127.5018 3.991829 1.237007       6.224745 
1 1 1 -18 15 24 o 35.24582 4.468189 15.51244       3.751618 14.85617       6.699780 15.81222       4.528103 33.74446 8.223721 35.39494 5.422209 -1.650478      9.850377 
1 1 1 -18 15 25 o 31.48895 4.928022 12.51698       3.657613 8.287101       7.063203 14.06687       4.275524 26.46168 9.079368 33.30558 5.456679 -6.843897      10.59293 
1 1 1 -18 15 26 o 46.72308 4.046611 27.05684       4.562054 28.06319       11.42752 26.86604       4.975755 45.67570 10.48835 46.47543 4.447586 -0.7997246     11.39239 
1 1 1 -18 15 27 o 40.85698 4.354989 20.82903       4.269244 14.62140       9.738556 22.30585       4.750008 33.38226 10.63171 42.21803 4.696401 -8.835773      11.62280 
1 1 1 -18 15 28 o 88.70846 3.005810 96.68349       6.488360 105.6021       10.78887 91.63021       8.121081 92.12358 4.822632 86.11782 3.879729 6.005760       6.189513 
1 1 1 -18 15 29 o 51.84105 3.588581 33.29356       4.505511 31.28002       8.084212 34.20077       5.426389 49.15247 6.942327 52.36377 4.290074 -3.211304      8.160921 
1 1 1 -18 15 30 o 14.33401 5.850376 1.106150       3.229590 1.170429       6.268392 1.082921       3.768224 18.86280 7.960547 15.21755 6.276971 3.645254       10.13759 
1 1 1 -18 15 31 o 35.85593 5.466676 16.58887       4.625756 23.21819       6.904649 11.19046       6.230747 41.88829 7.011754 28.64980 8.389276 13.23849       10.93365 
1 1 1 -18 15 32 o 21.22821 6.198824 5.947494       3.405932 1.269880       6.027829 8.141287       4.128066 18.39142 7.786120 24.60067 6.704304 -6.209246      10.27479 
1 1 1 -18 15 33 o 14.97107 6.054237 1.548535       3.421396 9.451336       6.142080 -2.006909      4.119759 26.15070 8.454698 13.02093 5.924078 13.12977       10.32360 
1 1 1 -18 15 34 o 53.71867 4.580148 36.95495       5.938580 36.46162       7.723325 37.66848       9.288450 52.35256 6.172337 52.21568 7.515941 0.1368790      9.725591 
1 1 1 -18 15 35 o 34.45805 4.846304 15.56202       3.957171 17.55652       6.421897 14.34113       5.024405 34.89319 7.753688 32.11623 6.639322 2.776958       10.20785 
1 1 1 -18 15 36 o 40.22827 4.855667 21.31079       4.663924 13.35091       8.649986 24.57337       5.537861 28.71040 10.03739 42.85257 5.424434 -14.14217      11.40937 
1 1 1 -18 15 37 o 43.46584 4.283126 24.59564       4.477868 22.32640       6.974331 26.18714       5.840725 38.86283 7.636784 43.92359 5.582693 -5.060760      9.459753 
1 1 1 -18 15 38 o 26.21697 7.121758 10.31677       4.666987 22.78378       9.590144 6.448122       5.342245 35.62552 10.40133 21.21338 7.827972 14.41214       13.01787 
1 1 1 -18 15 39 o 19.54949 6.915660 5.522683       4.114800 9.616428       6.629201 2.956912       5.248192 24.05255 8.745037 17.48674 7.326005 6.565809       11.40816 
1 1 1 -18 15 40 o 32.83684 6.679354 16.32909       5.162642 19.55896       7.073222 12.64669       7.552477 33.81131 8.573703 25.97896 9.349344 7.832346       12.68537 
1 1 1 -18 15 41 o 38.63686 4.852760 20.73413       4.468524 23.17925       7.340661 19.29466       5.632312 36.71453 8.388710 35.30883 6.792447 1.405697       10.79388 
1 1 1 -18 15 42 o 18.44544 6.784465 5.243893       4.007415 2.353395       6.346282 7.160797       5.168127 16.99076 7.572174 20.57127 7.678872 -3.580505      10.78438 
1 1 1 -18 16 1  o 145.6339 3.127258 259.0147       11.09845 249.1332       21.43038 262.6363       12.97380 142.2227 6.198248 146.5901 3.631838 -4.367416      7.183908 
1 1 1 -18 16 2  o 39.05821 4.238596 18.88075       3.969723 14.99573       7.438341 20.42795       4.694097 34.14562 8.862993 40.55373 4.845692 -6.408112      10.10116 
1 1 1 -18 16 3  o 140.1684 3.356261 239.9959       11.46415 252.8715       16.84726 228.8925       15.64493 143.6071 4.820958 136.6414 4.705478 6.965683       6.736702 
1 1 1 -18 16 4  o 210.7880 3.791065 543.0969       19.47346 544.7247       28.78788 541.7236       26.44084 210.6326 5.613522 210.2370 5.160954 0.3955536      7.625422 
1 1 1 -18 16 5  o 117.4855 3.095121 168.6494       8.853595 161.7786       22.00315 169.9767       9.671056 114.1729 7.958165 117.9170 3.369044 -3.744110      8.641924 
1 1 1 -18 16 6  f 150.4585 2.904067 276.3358       10.64779 270.5876       17.81489 279.5305       13.28106 148.5491 4.928090 151.2509 3.603287 -2.701767      6.104895 
1 1 1 -18 16 7  o 110.5869 2.705396 149.2468       7.290725 134.0154       12.33969 157.4155       9.036682 104.4961 4.859133 113.4845 3.271070 -8.988373      5.857565 
1 1 1 -18 16 8  o 138.8409 2.834948 235.2895       9.591767 239.9882       16.67154 232.9646       11.72708 139.8931 4.897943 138.0474 3.488782 1.845718       6.013439 
1 1 1 -18 16 9  o 182.0500 3.143333 404.6976       13.94496 420.8692       23.84727 396.2944       17.19042 185.2103 5.289108 180.0420 3.918109 5.168289       6.582267 
1 1 1 -18 16 10 o 154.4083 3.368836 291.2356       12.67613 291.0717       18.57486 291.3785       17.34207 154.0608 4.954072 154.2067 4.620101 -0.1459351     6.774081 
1 1 1 -18 16 11 o 60.11682 2.965337 44.22963       4.330757 47.47139       8.473201 43.08330       5.038611 61.93828 5.676808 59.27840 3.503640 2.659878       6.670955 
1 1 1 -18 16 12 o 116.6105 2.687667 165.9635       7.637462 156.8658       13.06997 170.6809       9.411531 113.0687 4.754079 118.1634 3.271595 -5.094666      5.771014 
1 1 1 -18 16 13 o 236.0085 3.623882 680.7968       20.84192 644.9607       33.16860 704.1783       26.79185 229.0338 5.947839 239.8026 4.584719 -10.76883      7.509757 
1 1 1 -18 16 14 o 120.3981 2.719331 176.9411       7.978436 168.6846       13.89258 181.0043       9.745862 117.2227 4.873978 121.6778 3.289816 -4.455093      5.880353 
1 1 1 -18 16 15 o 150.1876 2.870085 275.4053       10.50425 260.8352       17.60553 283.4591       13.08932 145.7787 4.963095 152.2876 3.527091 -6.508835      6.088734 
1 1 1 -18 16 16 f 201.7246 4.259478 498.1768       20.93878 523.6561       39.67464 488.3402       24.65148 205.4746 7.938463 199.4619 5.075747 6.012741       9.422441 
1 1 1 -18 16 17 o 56.69977 3.603968 39.46985       4.953872 47.30435       8.770477 35.79929       6.003210 61.73698 5.901380 53.85048 4.619230 7.886494       7.494236 
1 1 1 -18 16 18 o 83.51774 3.062729 85.34016       6.222820 102.5157       10.96607 77.18262       7.557467 91.26234 4.949390 79.31252 3.922364 11.94981       6.315172 
1 1 1 -18 16 19 o 74.12397 3.110097 67.26898       5.605350 79.10961       9.906604 61.69304       6.798243 80.08745 5.102568 70.87210 3.951924 9.215347       6.453983 
1 1 1 -18 16 20 o 48.10458 3.735625 28.49843       4.344809 29.42127       7.934208 28.10318       5.192561 48.27395 6.944123 47.64877 4.526203 0.6251831      8.288990 
1 1 1 -18 16 21 o 114.7348 3.641143 161.3536       10.16761 149.2617       13.34795 178.0686       15.69346 110.0583 4.989845 120.1253 5.374641 -10.06700      7.333848 
1 1 1 -18 16 22 o 27.56330 5.484216 9.693412       3.554046 15.20501       7.314677 7.990138       4.066292 34.14720 8.751035 24.93987 6.591990 9.207333       10.95605 
1 1 1 -18 16 23 f 27.90702 5.440856 9.938413       3.567145 23.28125       7.265823 5.701048       4.094573 42.64722 7.250581 21.58934 6.895805 21.05788       10.00615 
1 1 1 -18 16 24 o 70.34072 3.118285 60.71063       5.331850 62.80328       9.430805 59.72749       6.464097 71.03334 5.490762 69.64515 3.823404 1.388191       6.690806 
1 1 1 -18 16 25 o 57.80342 3.659138 41.19709       5.127831 48.87580       12.24458 39.56398       5.646855 61.56544 8.378746 56.55027 4.126050 5.015167       9.339576 
1 1 1 -18 16 26 o 68.68930 3.107594 57.98256       5.188277 67.82442       9.357871 53.61457       6.234179 73.74700 5.241265 65.88231 3.900518 7.864693       6.533368 
1 1 1 -18 16 27 o 80.72939 3.320726 80.22454       6.518876 88.97632       14.13569 77.86052       7.346746 83.60933 7.002125 79.40175 3.807997 4.207581       7.970608 
1 1 1 -18 16 28 f 33.71658 4.761211 14.39570       3.803232 15.81609       6.916537 13.78009       4.553422 34.31538 8.351288 32.64814 5.942098 1.667240       10.24951 
1 1 1 -18 16 29 o 87.95723 3.036170 95.28835       6.498035 108.2040       10.83495 88.03355       8.120481 93.00290 4.796941 84.21712 3.967968 8.785774       6.225385 
1 1 1 -18 16 30 o 15.98397 6.203197 2.220967       3.455908 -1.942955      6.385973 3.945500       4.109714 16.84969 7.546419 18.90447 6.883703 -2.054781      10.21439 
1 1 1 -18 16 31 o 53.37396 4.193785 35.78959       5.410927 38.99732       7.909134 32.96727       7.418793 54.88958 6.011126 50.34075 6.176824 4.548836       8.618978 
1 1 1 -18 16 32 o 15.72750 6.148714 2.172908       3.415358 -6.103953      6.009521 6.121705       4.150873 13.94711 6.609866 21.59876 6.947517 -7.651645      9.589491 
1 1 1 -18 16 33 o 32.35654 6.294086 14.13660       4.784142 12.81341       6.172907 16.12686       7.570637 29.92408 8.215931 33.11477 9.101343 -3.190687      12.26116 
1 1 1 -18 16 34 o 34.38382 4.891284 15.46669       3.982924 9.438027       6.123771 19.88678       5.243529 25.63303 8.452146 38.59541 5.750375 -12.96238      10.22280 
1 1 1 -18 16 35 o 56.01377 3.736770 39.86739       5.071500 38.49604       8.075167 40.76060       6.517099 53.04114 6.375077 55.88363 4.833026 -2.842487      7.999984 
1 1 1 -18 16 36 o 26.79119 7.055027 10.45550       4.668742 11.05518       9.597766 10.26962       5.343560 26.51431 10.32421 26.18046 7.796040 0.3338509      12.93706 
1 1 1 -18 16 37 o 23.65077 6.617075 8.143496       3.962736 2.336286       5.989515 12.66445       5.284731 18.02941 7.701504 29.00075 7.441522 -10.97135      10.70931 
1 1 1 -18 16 38 o 54.71271 4.368895 39.48309       5.776643 35.39179       10.87376 41.09175       6.818369 44.90476 10.17342 55.03211 5.143862 -10.12735      11.39990 
1 1 1 -18 16 39 o 13.79495 5.986108 0.6814274      3.729436 1.771572       5.995813 -0.6491246E-02 4.762936 17.07020 7.494699 14.59326 6.527910 2.476941       9.939021 
1 1 1 -18 16 40 o 26.42980 6.552855 10.74684       4.199411 17.47147       6.812502 6.625600       5.333181 31.50937 8.623023 20.46882 7.765781 11.04054       11.60448 
1 1 1 -18 16 41 o 26.85011 7.018445 11.65326       4.642752 12.41070       10.18237 11.45446       5.216573 23.86221 10.11170 25.86394 7.703107 -2.001726      12.71159 
1 1 1 -18 17 1  o 134.4871 3.084939 220.9121       10.11028 208.1365       19.44589 225.6450       11.83575 129.9303 6.159132 135.8166 3.579197 -5.886322      7.123592 
1 1 1 -18 17 2  o 113.6581 2.965559 157.8535       8.206765 164.6336       16.70615 155.6969       9.421985 115.5806 5.951414 112.8237 3.430923 2.756912       6.869539 
1 1 1 -18 17 3  o 68.65603 3.088845 57.68324       5.154628 41.65063       10.49847 62.77590       5.916929 57.56801 7.674579 71.59679 3.401027 -14.02878      8.394412 
1 1 1 -18 17 4  o 237.4971 4.217807 690.2147       24.41075 657.9213       33.94974 724.7810       35.12423 231.2829 6.028750 242.8630 5.934845 -11.58009      8.459801 
1 1 1 -18 17 5  o 110.4404 3.110406 149.0756       8.362737 116.8856       20.17579 155.7533       9.189294 96.71784 8.651547 112.8618 3.344866 -16.14391      9.275635 
1 1 1 -18 17 6  o 125.4756 2.777259 192.1852       8.492032 193.0461       14.67514 191.7518       10.41247 125.4365 4.809809 125.2292 3.415213 0.2072449      5.898978 
1 1 1 -18 17 7  o 134.1454 3.051315 219.7443       9.974679 216.2131       20.76123 220.8040       11.37333 132.4040 6.453959 134.3798 3.476021 -1.975754      7.330506 
1 1 1 -18 17 8  o 221.0205 3.510158 596.9620       18.90581 595.9731       31.06725 597.5436       23.82527 220.2068 5.794467 220.9373 4.425197 -0.7304993     7.290968 
1 1 1 -18 17 9  o 50.99747 3.321416 31.90602       4.105242 35.40413       7.984957 30.64920       4.786242 53.29774 6.267572 49.90420 3.968353 3.393536       7.418240 
1 1 1 -18 17 10 o 185.5699 3.166429 420.6035       14.31902 446.8680       24.49605 406.9710       17.64814 190.7961 5.273601 182.4117 3.970179 8.384354       6.600999 
1 1 1 -18 17 11 o 182.1124 3.129615 405.0663       13.88886 410.7626       23.25306 401.9071       17.31726 182.9253 5.221736 181.2774 3.920121 1.647919       6.529462 
1 1 1 -18 17 12 o 245.2814 3.733491 735.6007       22.31598 733.5975       36.35506 736.8118       28.26829 244.1626 6.114932 245.2263 4.730382 -1.063782      7.731035 
1 1 1 -18 17 13 o 58.74723 3.055049 42.26468       4.358600 40.43111       8.463807 42.92642       5.084642 57.00095 6.192631 59.15552 3.543432 -2.154568      7.134746 
1 1 1 -18 17 14 o 83.58810 3.108855 85.46648       6.321551 87.08253       10.24364 84.47248       8.033802 84.11421 5.020293 82.99557 3.983824 1.118645       6.408915 
1 1 1 -18 17 15 o 108.6941 3.082297 144.4463       8.156012 165.3591       13.41477 132.1828       10.27275 116.0375 4.754114 103.8396 4.067507 12.19788       6.256693 
1 1 1 -18 17 16 o 148.1477 3.747056 268.6936       13.51675 270.5701       26.51995 268.0351       15.71053 147.6602 7.393619 147.8409 4.365521 -0.1807556     8.586231 
1 1 1 -18 17 17 o 127.8030 2.761739 199.4876       8.601216 180.8220       14.73907 209.1268       10.59177 121.2509 4.998981 130.7427 3.327116 -9.491867      6.004957 
1 1 1 -18 17 18 o 115.9466 2.734313 164.2075       7.725782 148.0070       13.43749 172.2071       9.442485 109.6421 5.042768 118.6301 3.269413 -8.987938      6.009873 
1 1 1 -18 17 19 o 154.9074 2.945146 293.2823       11.11771 322.2771       19.95710 280.2350       13.38743 161.8211 5.067125 151.3018 3.630921 10.51930       6.233727 
1 1 1 -18 17 20 o 158.1309 3.902482 306.4719       15.03813 314.6494       19.75658 295.2078       23.18724 159.8242 5.079077 154.4017 6.175013 5.422577       7.995487 
1 1 1 -18 17 21 o 33.32543 4.846618 13.94302       3.820688 24.51425       7.900442 10.71597       4.365070 43.71091 7.698029 28.86104 6.376627 14.84987       9.996050 
1 1 1 -18 17 22 f 31.48961 4.950186 12.50610       3.673404 5.598935       7.068609 15.06165       4.299588 23.91887 8.969823 34.55449 5.272809 -10.63562      10.40482 
1 1 1 -18 17 23 o 11.92898 5.368658 -1.577202      3.275846 11.84134       9.260829 -3.496344      3.502279 30.96905 10.39901 11.04879 5.177081 19.92026       11.61643 
1 1 1 -18 17 24 o 16.02192 6.207457 2.096446       3.456233 3.600808       9.212332 1.850011       3.728591 24.25494 9.887921 16.14537 6.390107 8.109570       11.77304 
1 1 1 -18 17 25 o 120.7100 3.052580 178.7733       8.972175 203.1751       14.93944 165.0064       11.22122 128.0500 4.796086 115.6829 3.986430 12.36707       6.236510 
1 1 1 -18 17 26 o 48.43224 3.915812 29.10111       4.582225 28.85055       10.81548 29.15593       5.058675 46.18491 9.906714 48.38100 4.336627 -2.196095      10.81431 
1 1 1 -18 17 27 o 11.37042 5.147871 -1.613976      3.064617 -3.312834      6.479846 -1.124492      3.478206 16.36277 7.438688 12.66117 5.626434 3.701608       9.326887 
1 1 1 -18 17 28 o 14.83247 5.876550 1.613180       3.156390 -4.878561      6.170849 3.913456       3.673282 15.01330 6.980545 18.52455 6.535823 -3.511250      9.562688 
1 1 1 -18 17 29 o 33.88921 4.760382 14.62777       3.823094 17.12757       6.838833 13.49143       4.610863 35.50579 8.085607 32.09048 6.119442 3.415310       10.14025 
1 1 1 -18 17 30 o 56.59482 4.089039 40.12363       5.601389 36.02937       7.977451 44.10513       7.866829 52.61145 6.350580 58.68698 5.567332 -6.075531      8.445415 
1 1 1 -18 17 31 o 61.25336 3.390123 46.71031       5.040624 55.20105       8.731585 42.46635       6.173136 65.49436 5.522227 57.97172 4.402641 7.522644       7.062453 
1 1 1 -18 17 32 o 18.67591 7.170173 3.618191       4.581358 10.42442       6.352108 -3.760508      6.613853 27.16783 8.578480 15.84514 7.318190 11.32270       11.27591 
1 1 1 -18 17 33 o 22.29691 6.544140 6.817678       3.787601 2.342828       6.147791 9.555309       4.808586 18.91890 7.927740 26.03300 7.291173 -7.114103      10.77081 
1 1 1 -18 17 34 o 32.74727 5.307895 14.30943       4.090903 9.030869       6.543206 17.69692       5.241699 24.97787 8.730061 35.95954 6.205861 -10.98167      10.71105 
1 1 1 -18 17 35 o 40.86487 4.365993 21.70465       4.280516 21.74892       6.726695 21.67453       5.549004 38.81483 7.381290 39.86635 5.888813 -1.051517      9.442539 
1 1 1 -18 17 36 o 27.36621 6.913375 10.94827       4.611208 10.42189       9.323867 11.11870       5.305462 25.69433 10.12502 27.10530 7.682228 -1.410969      12.70955 
1 1 1 -18 17 37 o 29.96240 6.443569 12.99636       4.564927 4.357741       8.631794 16.35054       5.378633 20.98095 9.105647 33.38568 6.841258 -12.40473      11.38928 
1 1 1 -18 17 38 o 17.49443 6.559192 4.021893       3.779359 1.591887       5.825502 5.787997       4.966357 16.91939 7.409134 20.02545 7.516730 -3.106060      10.55445 
1 1 1 -18 17 39 o 43.37776 5.378402 26.44911       5.563631 20.61765       7.303019 34.51464       8.588747 34.59462 8.678556 46.39589 7.877961 -11.80127      11.72090 
1 1 1 -18 17 40 o 17.73409 6.610521 4.527946       3.827444 -0.5709370     6.440197 7.312297       4.759086 15.67982 7.234574 21.15594 7.441455 -5.476122      10.37855 
1 1 1 -18 17 41 f 18.28152 7.279165 4.937436       4.866022 11.12814       6.496915 -2.972475      7.343838 24.14818 8.673798 15.18224 7.227216 8.965940       11.29015 
1 1 1 -18 18 1  o 217.6901 3.844806 579.7499       20.39620 587.4062       40.59534 577.1646       23.58979 217.6914 7.664377 217.0528 4.459875 0.6386719      8.867535 
1 1 1 -18 18 2  o 120.9379 3.014225 178.6434       8.883301 167.2015       17.56216 182.5774       10.29782 116.3820 6.214897 122.1664 3.462548 -5.784424      7.114365 
1 1 1 -18 18 3  o 96.74566 2.959330 114.4121       6.968673 133.6496       14.88914 109.0159       7.885713 104.0954 5.893589 94.38097 3.434355 9.714378       6.821230 
1 1 1 -18 18 4  o 78.55512 2.865017 75.44897       5.475323 74.81464       9.941861 75.72512       6.559782 77.90494 5.267783 78.64030 3.431268 -0.7353668     6.286743 
1 1 1 -18 18 5  o 53.43903 3.582845 35.06559       4.638804 47.34332       15.38082 33.83705       4.865356 60.59480 10.81288 52.46064 3.832226 8.134163       11.47189 
1 1 1 -18 18 6  o 193.1851 3.576623 456.2184       16.83771 458.1891       34.52275 455.6033       19.28727 192.4484 7.374956 192.9556 4.101827 -0.5071869     8.438895 
1 1 1 -18 18 7  o 84.76157 2.779038 87.80573       5.732473 101.1509       10.88666 82.68611       6.742988 90.69859 4.944286 82.19044 3.373799 8.508156       5.985690 
1 1 1 -18 18 8  o 187.9428 3.224920 431.5303       14.77001 436.3785       24.61849 428.8038       18.46175 188.4796 5.365412 187.2055 4.046860 1.274094       6.720470 
1 1 1 -18 18 9  o 192.2867 3.720200 452.1159       17.43217 447.4707       25.13895 456.4184       24.19383 190.8438 5.410928 192.8176 5.153608 -1.973862      7.472471 
1 1 1 -18 18 10 o 154.2955 2.942987 290.7328       11.06567 310.6324       19.31522 281.0105       13.50088 159.0761 4.988800 151.6010 3.654466 7.475037       6.184112 
1 1 1 -18 18 11 o 182.9686 3.160465 408.9890       14.09171 436.2359       24.23047 395.0635       17.32240 188.4456 5.281632 179.6918 3.955884 8.753815       6.598837 
1 1 1 -18 18 12 o 113.8569 3.129599 158.4946       8.675052 145.5461       13.15929 168.4472       11.53693 108.8141 4.975787 117.2474 4.043909 -8.433266      6.411837 
1 1 1 -18 18 13 o 51.37290 3.797795 32.46329       4.720848 33.84137       8.307729 31.80609       5.737139 51.95337 6.719147 50.71986 4.695024 1.233505       8.196962 
1 1 1 -18 18 14 o 118.7688 3.161610 172.5070       9.142399 189.6483       14.68815 161.6660       11.68100 124.2292 4.861235 114.8140 4.181913 9.415154       6.412488 
1 1 1 -18 18 15 o 215.2343 3.446055 566.5427       18.07464 594.0471       30.76000 552.0380       22.33781 219.6019 5.752918 212.2380 4.318983 7.363953       7.193725 
1 1 1 -18 18 16 o 125.2123 3.033145 191.6049       9.255001 218.2881       22.80260 186.3423       10.12661 132.5838 7.083324 123.3919 3.370922 9.191902       7.844526 
1 1 1 -18 18 17 o 121.8414 2.785789 181.3701       8.271401 168.8772       14.51924 187.3727       10.06421 117.0924 5.100606 123.7237 3.341093 -6.631287      6.097466 
1 1 1 -18 18 18 o 24.35212 5.686217 7.601751       3.312878 -0.5207058     7.081358 9.877580       3.748372 19.20931 8.292055 27.80701 5.722542 -8.597702      10.07500 
1 1 1 -18 18 19 f 156.9145 3.325824 301.3480       12.71740 318.4252       20.14237 290.0278       16.39946 160.7211 5.149471 153.6260 4.385036 7.095062       6.763549 
1 1 1 -18 18 20 o 131.9240 3.228009 213.0353       10.37755 222.5265       16.43486 206.7418       13.38299 134.3004 5.030613 129.6775 4.240694 4.622940       6.579556 
1 1 1 -18 18 21 o 70.86198 3.195867 61.61055       5.504513 60.61668       9.644697 62.09068       6.703517 69.75565 5.724096 71.02052 3.888147 -1.264870      6.919752 
1 1 1 -18 18 22 o 41.84467 4.362579 21.78219       4.383304 29.28377       10.77608 20.29494       4.798183 47.05453 9.719597 40.24253 5.000311 6.812000       10.93040 
1 1 1 -18 18 23 o 61.16785 3.637389 46.11576       5.397386 37.38735       12.39102 48.15968       5.996123 53.08366 9.944105 62.44804 3.960582 -9.364376      10.70380 
1 1 1 -18 18 24 o 93.89326 3.012628 108.1954       6.884202 117.2592       11.74765 103.4550       8.495801 97.15656 4.978441 91.61210 3.813873 5.544464       6.271403 
1 1 1 -18 18 25 o 58.64421 3.382124 42.41375       4.812876 36.10737       8.562087 45.32685       5.819264 53.11760 6.768129 60.49689 3.969213 -7.379292      7.846160 
1 1 1 -18 18 26 o 56.92054 3.691215 40.11798       5.092442 58.50211       12.29304 36.30961       5.595098 67.19987 7.642414 53.98656 4.288113 13.21330       8.763242 
1 1 1 -18 18 27 o 37.28043 4.391437 17.48975       3.913098 11.87795       7.390379 19.67596       4.612767 29.77764 9.231161 39.42369 4.907340 -9.646044      10.45449 
1 1 1 -18 18 28 o 40.18718 4.086936 20.25909       3.946789 21.82566       7.223064 19.59227       4.712501 40.41852 7.612609 39.22197 5.047312 1.196545       9.133847 
1 1 1 -18 18 29 o 18.28370 6.213420 4.052217       3.306369 -1.414822      6.264235 6.163455       3.892786 16.93856 7.537591 21.73852 6.692908 -4.799955      10.08019 
1 1 1 -18 18 30 o 15.86245 6.429174 1.698866       3.868171 6.760014       6.491741 -1.087329      4.816621 23.58627 8.641717 14.91273 6.624362 8.673548       10.88859 
1 1 1 -18 18 31 o 16.13904 6.693082 1.427095       4.316082 0.2567944E-01  6.063102 2.866841       6.145456 17.36215 7.581852 19.58920 8.041334 -2.227041      11.05204 
1 1 1 -18 18 32 o 58.59547 4.321247 43.73339       6.126931 40.64854       7.886995 48.42836       9.729948 55.44033 5.929790 59.85440 6.790672 -4.414074      9.015301 
1 1 1 -18 18 33 o 19.00596 6.583727 4.660555       3.717066 5.912409       6.200914 3.958445       4.643888 21.84863 8.353454 18.80609 7.219249 3.042543       11.04073 
1 1 1 -18 18 34 o 24.33753 6.534243 8.391167       3.956470 2.256367       6.630875 11.78275       4.930281 18.93035 8.095293 28.57220 7.109651 -9.641848      10.77409 
1 1 1 -18 18 35 o 28.75825 6.731480 11.90460       4.633592 11.75560       9.688998 11.94879       5.276037 26.88670 10.39967 28.30786 7.521197 -1.421160      12.83439 
1 1 1 -18 18 36 o 19.45578 6.716056 5.267434       3.866620 3.747690       6.113409 6.280737       4.991923 19.15827 7.957217 21.00431 7.595459 -1.846046      11.00038 
1 1 1 -18 18 37 o 34.89853 5.919693 17.26649       4.854620 14.78857       8.970730 18.29269       5.772999 28.12712 10.18053 34.98057 7.016665 -6.853443      12.36434 
1 1 1 -18 18 38 o 37.38152 5.044774 19.28519       4.478327 19.77985       7.182204 18.97054       5.728236 34.15152 8.628315 35.38175 6.891517 -1.230228      11.04268 
1 1 1 -18 18 39 o 11.87924 5.626415 -3.233184      4.341566 4.871097       6.342927 -10.37696      5.955201 19.14085 8.038708 11.43048 5.665870 7.710376       9.834780 
1 1 1 -18 18 40 o 20.31606 7.477839 6.750373       4.869822 7.212137       6.640753 6.213159       7.162771 20.70823 8.412603 20.02494 8.483047 0.6832924      11.94713 
1 1 1 -18 19 1  o 187.2262 3.541637 428.7659       16.15871 488.6795       34.03190 411.3271       18.36034 198.6310 7.041914 183.2563 4.111362 15.37469       8.154254 
1 1 1 -18 19 2  o 182.9591 3.504776 409.3649       15.62609 447.2404       32.66026 398.1210       17.79497 190.0455 7.064516 180.3181 4.049690 9.727448       8.142934 
1 1 1 -18 19 3  f 191.5464 3.572606 448.7169       16.67612 454.6777       33.88328 446.8115       19.15689 191.5667 7.271408 191.0231 4.115314 0.5435638      8.355188 
1 1 1 -18 19 4  o 68.89484 3.139995 58.11662       5.257854 63.30545       11.73206 56.81252       5.881580 71.28994 6.836903 68.06841 3.558139 3.221535       7.707372 
1 1 1 -18 19 5  o 86.23847 3.414550 91.05765       7.161621 0.000000       0.000000 91.05765       7.161621 ?        ?        86.23847 3.414550 0.000000       3.414550 
1 1 1 -18 19 6  o 135.7138 2.883603 224.9437       9.536648 228.4447       16.52311 223.1949       11.67814 136.3602 4.980792 135.0573 3.551374 1.302887       6.117234 
1 1 1 -18 19 7  o 246.1103 4.993328 743.2274       29.94718 784.5176       38.29395 678.2150       48.05116 252.3636 6.226834 233.4300 8.461166 18.93364       10.50547 
1 1 1 -18 19 8  o 69.78954 3.265613 59.65500       5.538411 61.85192       9.382112 58.47997       6.861498 70.73813 5.485496 68.99356 4.099556 1.744568       6.848140 
1 1 1 -18 19 9  o 113.5411 3.897540 157.9513       10.76801 155.6023       13.56690 161.9502       17.70141 112.4995 4.960932 114.4467 6.372162 -1.947174      8.075599 
1 1 1 -18 19 10 o 285.1846 4.696743 997.4229       32.64066 962.0130       46.21315 1032.673       46.10876 279.0908 6.794914 289.3020 6.540274 -10.21121      9.431121 
1 1 1 -18 19 11 o 126.7767 3.685829 196.8009       11.37495 207.2272       15.61565 185.0145       16.60292 129.8418 4.944286 122.5277 5.575110 7.314133       7.451699 
1 1 1 -18 19 12 o 113.9195 2.801564 158.5118       7.777408 172.2261       14.26900 152.7154       9.276494 118.3371 4.959069 111.7001 3.411958 6.637001       6.019454 
1 1 1 -18 19 13 o 175.8849 3.122643 378.1132       13.38404 396.0182       23.07553 369.0360       16.43001 179.4044 5.283916 173.6128 3.883470 5.791580       6.557523 
1 1 1 -18 19 14 o 106.4322 2.749435 138.4639       7.125066 145.8241       13.10972 135.3784       8.488157 108.8424 4.955644 105.1625 3.316344 3.679863       5.962931 
1 1 1 -18 19 15 o 102.3857 3.004363 128.2415       7.487865 182.7114       20.55326 119.9055       8.040439 121.2309 6.986743 98.95197 3.339195 22.27890       7.743694 
1 1 1 -18 19 16 o 124.7744 2.820791 190.2572       8.576946 190.5549       15.27489 190.1201       10.36523 124.3684 5.050524 124.5974 3.416995 -0.2289810     6.097839 
1 1 1 -18 19 17 o 224.6123 3.564270 617.8205       19.50924 606.6997       32.13528 624.3116       24.55142 221.5078 5.958702 225.4653 4.468490 -3.957550      7.448056 
1 1 1 -18 19 18 o 63.56524 3.046534 49.53977       4.705391 47.42575       9.324505 50.26202       5.450232 61.56095 6.304576 63.96336 3.510068 -2.402409      7.215834 
1 1 1 -18 19 19 o 75.58072 2.845810 69.96381       5.232108 75.23143       10.21238 68.08906       6.092427 77.86588 5.415751 74.48288 3.365279 3.382996       6.376164 
1 1 1 -18 19 20 o 92.10915 3.164425 104.0260       7.092318 110.8942       11.97070 100.3110       8.803879 94.60563 5.212523 90.27511 4.011956 4.330521       6.577704 
1 1 1 -18 19 21 o 39.86959 4.673891 19.86709       4.454943 13.64381       10.52258 21.22617       4.917389 32.97132 11.08492 41.15518 5.005982 -8.183857      12.16286 
1 1 1 -18 19 22 o 115.8945 3.112351 164.7756       8.782016 180.9593       14.94991 156.2485       10.85170 120.7788 5.090808 112.6161 3.960387 8.162643       6.449883 
1 1 1 -18 19 23 o 48.89032 3.785129 29.58761       4.474517 24.86833       8.075471 31.67838       5.375064 43.64496 7.882750 50.45967 4.415676 -6.814709      9.035261 
1 1 1 -18 19 24 o 46.34032 3.741611 26.62215       4.189364 36.64577       8.452197 23.35761       4.823566 53.55536 6.616942 43.17578 4.658141 10.37958       8.092107 
1 1 1 -18 19 25 o 14.86520 5.884981 1.605492       3.163184 -0.9423836     6.948318 2.271578       3.552677 18.41318 8.076696 16.28473 6.297760 2.128443       10.24182 
1 1 1 -18 19 26 o 28.81168 5.791123 10.80305       3.924826 14.64252       10.58262 10.19071       4.226228 32.95398 11.11664 27.82701 6.370148 5.126966       12.81243 
1 1 1 -18 19 27 o 21.81710 6.026907 6.238970       3.310277 5.522377       6.617720 6.478107       3.822924 22.83558 8.653621 22.26977 6.584780 0.5658073      10.87403 
1 1 1 -18 19 28 o 25.05976 6.066508 8.331903       3.664572 23.30470       7.331410 3.345084       4.231048 41.67942 7.493680 18.25569 6.919081 23.42373       10.19946 
1 1 1 -18 19 29 o 35.17065 4.591164 15.80408       3.841104 16.76126       6.947085 15.38262       4.609830 34.63319 8.333040 34.26984 5.721555 0.3633499      10.10820 
1 1 1 -18 19 30 o 29.50570 5.831439 11.58949       4.044225 20.90067       6.754262 6.385500       5.049450 39.06133 7.365741 22.25115 7.675132 16.81018       10.63775 
1 1 1 -18 19 31 o 12.08321 5.670342 -3.708255      4.228624 -1.809176      5.714889 -6.006018      6.286210 15.59097 7.047048 14.25918 6.758512 1.331792       9.764136 
1 1 1 -18 19 32 o 43.60892 4.183572 24.35760       4.391424 23.93840       7.014468 24.62781       5.631611 41.36388 7.221445 43.12709 5.482270 -1.763210      9.066672 
1 1 1 -18 19 33 o 17.22172 6.565918 3.308832       3.824057 -5.673294      6.161546 8.936184       4.876993 13.98835 6.647780 24.82290 7.461151 -10.83455      9.993085 
1 1 1 -18 19 34 f 44.29977 4.304343 25.48435       4.588189 27.86202       7.769177 24.21100       5.685549 43.75760 7.559195 42.25277 5.664366 1.504833       9.445976 
1 1 1 -18 19 35 o 21.46264 7.151433 6.665240       4.380915 2.583063       9.433722 7.787644       4.946657 20.76129 9.243634 22.88124 7.598481 -2.119953      11.96585 
1 1 1 -18 19 36 o 14.25703 6.232924 0.4174250      4.107677 2.741129       7.566537 -0.5535607     4.891174 19.24444 8.435204 14.58557 6.562537 4.658869       10.68735 
1 1 1 -18 19 37 o 35.29245 5.136189 17.20052       4.287800 20.02785       6.717747 15.25679       5.569983 35.35822 7.985775 31.24907 7.424791 4.109150       10.90413 
1 1 1 -18 19 38 o 62.39342 3.753088 50.97647       5.680038 48.42702       8.904432 52.72554       7.375443 57.02542 6.525038 61.93918 4.926946 -4.913757      8.176241 
1 1 1 -18 19 39 o 21.87632 7.672322 8.030925       5.056422 11.26898       6.796023 4.015672       7.567794 24.49123 8.861507 18.91538 8.357816 5.575855       12.18111 
1 1 1 -18 19 40 o 17.96976 6.709301 4.847498       3.945862 3.692988       6.468025 5.531876       4.979899 17.94266 7.833232 18.90464 7.414668 -0.9619770     10.78595 
1 1 1 -18 20 1  o 139.8989 4.081337 240.0589       13.89916 228.2116       20.74369 249.7115       18.72388 135.7828 6.286156 142.3330 5.408102 -6.550232      8.292365 
1 1 1 -18 20 2  o 120.6172 3.360110 178.0829       9.866778 199.1702       18.58054 169.8011       11.64422 126.9336 6.024022 117.6505 4.067561 9.283119       7.268692 
1 1 1 -18 20 3  o 134.8456 3.501263 222.6059       11.49555 230.0973       21.03691 219.4166       13.72614 136.3676 6.347870 133.7330 4.217130 2.634583       7.621000 
1 1 1 -18 20 4  o 89.70454 3.318017 98.53367       7.240691 95.51340       13.72942 99.69738       8.522206 87.71047 6.468914 90.15076 3.888382 -2.440285      7.547606 
1 1 1 -18 20 5  o 128.8007 4.180974 203.4909       13.10557 0.000000       0.000000 203.4909       13.10557 ?        ?        128.8007 4.180974 0.000000       4.180974 
1 1 1 -18 20 6  o 54.69974 3.629351 36.77023       4.810467 40.60876       8.741004 35.10260       5.761418 57.01201 6.402056 53.31866 4.475451 3.693344       7.811273 
1 1 1 -18 20 7  o 107.5279 3.138318 141.4461       8.214653 135.6853       13.02044 145.2555       10.58780 104.9657 5.105598 108.8325 3.998988 -3.866768      6.485294 
1 1 1 -18 20 8  o 79.73936 4.222143 78.13523       8.175064 0.000000       0.000000 78.13523       8.175064 ?        ?        79.73936 4.222143 0.000000       4.222143 
1 1 1 -18 20 9  o 117.3723 3.327902 168.5996       9.508972 169.0511       14.26612 168.2386       12.75572 117.2043 5.006425 117.0372 4.480723 0.1671371      6.718718 
1 1 1 -18 20 10 o 67.32625 3.020000 55.50836       4.942203 65.16434       9.676766 52.10083       5.748473 72.56123 5.513828 65.14771 3.635324 7.413521       6.604383 
1 1 1 -18 20 11 o 178.8748 3.172536 391.1984       13.82903 388.3760       23.18515 392.7569       17.22939 177.5845 5.363728 179.0621 3.948480 -1.477600      6.660336 
1 1 1 -18 20 12 o 66.39390 3.051255 53.99965       4.923571 45.06485       9.237472 57.54517       5.819031 60.05676 6.410844 68.48724 3.498211 -8.430477      7.303178 
1 1 1 -18 20 13 o 67.90448 2.993305 56.47540       4.941024 64.40482       9.693914 53.69231       5.743040 72.08975 5.561057 66.13234 3.576936 5.957413       6.612097 
1 1 1 -18 20 14 o 115.0850 2.779887 161.8567       7.796181 184.6448       14.59191 152.7530       9.222899 122.4433 4.900259 111.6699 3.393120 10.77340       5.960353 
1 1 1 -18 20 15 o 64.15096 3.265033 50.48835       5.087404 61.26312       14.30024 48.92707       5.443526 69.38119 8.644980 63.10846 3.553981 6.272732       9.347003 
1 1 1 -18 20 16 o 121.7183 2.799805 181.1277       8.304617 170.5915       14.34345 186.4406       10.18547 117.5841 5.017282 123.3475 3.391777 -5.763382      6.056176 
1 1 1 -18 20 17 o 92.78530 2.796584 105.3714       6.316074 108.4270       11.68683 104.1107       7.506803 93.62653 5.142003 92.13807 3.348905 1.488457       6.136396 
1 1 1 -18 20 18 o 129.5494 2.825684 205.3109       8.920621 230.5264       16.56675 195.0144       10.58642 136.6132 4.984680 126.0899 3.448583 10.52325       6.061333 
1 1 1 -18 20 19 o 37.39840 6.205876 17.83442       5.457620 25.80031       10.85536 15.13981       6.313569 43.93431 10.31649 34.04438 7.780544 9.889923       12.92156 
1 1 1 -18 20 20 o 64.94373 3.648815 51.96206       5.751420 45.32951       12.20033 53.85719       6.521540 59.10527 8.733144 66.03292 4.072601 -6.927654      9.636071 
1 1 1 -18 20 21 o 102.0954 2.737079 127.7265       6.803580 128.9622       12.74122 127.2336       8.046851 101.8628 5.149565 101.7806 3.248489 0.8216858E-01  6.088571 
1 1 1 -18 20 22 o 52.88728 3.175928 34.45361       4.074296 25.58401       8.640679 36.98945       4.620154 44.07813 8.349899 54.74750 3.481058 -10.66937      9.046468 
1 1 1 -18 20 23 o 19.23201 6.324560 4.495763       3.429665 13.39615       7.106484 1.793311       3.915880 31.64887 8.863610 16.29230 6.515654 15.35657       11.00079 
1 1 1 -18 20 24 o 40.93941 4.084910 20.93442       4.020963 20.56615       7.582597 21.07849       4.742723 39.23851 8.194751 40.87838 4.855760 -1.639870      9.525352 
1 1 1 -18 20 25 o 38.65405 4.811395 18.91110       4.434297 23.81409       11.28972 18.01674       4.821799 40.90712 11.06169 37.52647 5.430407 3.380653       12.32276 
1 1 1 -18 20 26 o 69.70391 3.226911 60.06045       5.466384 73.53898       10.01023 54.33323       6.525210 76.18449 5.427436 66.00606 4.076608 10.17844       6.787916 
1 1 1 -18 20 27 o 47.15226 3.817383 27.79515       4.348884 34.31055       8.161405 25.21160       5.139289 51.17220 6.705988 44.55986 4.808928 6.612335       8.252034 
1 1 1 -18 20 28 o 23.50893 6.170911 7.392304       3.579326 6.469936       6.834193 7.740943       4.201682 23.53473 8.821069 23.98296 6.849604 -0.4482231     11.16818 
1 1 1 -18 20 29 o 42.81382 4.943144 23.57910       5.062720 18.82203       7.278833 28.03715       7.046360 36.47638 8.366977 45.92141 6.476323 -9.445030      10.58060 
1 1 1 -18 20 30 o 55.80220 4.481526 39.74927       6.042953 32.57835       7.546536 52.56500       10.08862 49.31884 6.432240 62.53971 6.725284 -13.22087      9.306082 
1 1 1 -18 20 31 o 23.36476 6.369715 7.551497       3.725551 8.609347       6.264806 6.972710       4.633984 24.69971 8.547680 22.49173 7.349057 2.207979       11.27260 
1 1 1 -18 20 32 o 9.441879 4.602748 -5.666359      3.432518 -14.60750      6.009672 -1.337180      4.181740 10.88227 5.441415 13.35999 6.034383 -2.477724      8.125440 
1 1 1 -18 20 33 o 75.23076 3.409333 71.53600       6.234058 53.52526       9.640665 84.47930       8.172666 62.23745 6.449904 81.07257 4.150510 -18.83512      7.669941 
1 1 1 -18 20 34 o 38.57859 4.992962 19.91158       4.583989 6.667796       7.411900 28.11513       5.833431 22.34440 8.954582 45.63942 5.346240 -23.29501      10.42913 
1 1 1 -18 20 35 o 47.63138 4.715337 30.23360       5.401457 49.47377       11.34479 24.59354       6.142336 56.10928 8.568348 41.63771 6.246009 14.47157       10.60326 
1 1 1 -18 20 36 o 15.79239 6.417943 2.486284       3.866662 3.959852       6.026103 1.454988       5.041308 18.82874 7.866513 16.06935 6.966475 2.759394       10.50780 
1 1 1 -18 20 37 o 55.99448 3.863927 41.16645       5.240095 44.33758       8.213536 38.98977       6.804870 55.12959 6.222370 52.78436 5.364731 2.345230       8.215731 
1 1 1 -18 20 38 o 34.78384 6.500327 18.33195       5.307419 17.56157       7.232404 19.23092       7.812800 30.85186 9.039700 31.81219 9.415228 -0.9603233     13.05231 
1 1 1 -18 20 39 o 11.51036 5.329492 -1.551006      3.540167 -6.383484      5.727176 1.437206       4.503615 12.28706 5.979789 14.98225 6.538663 -2.695182      8.860700 
1 1 1 -18 21 1  o 87.64277 3.376612 94.15851       7.198137 0.000000       0.000000 94.15851       7.198137 ?        ?        87.64277 3.376612 0.000000       3.376612 
1 1 1 -18 21 2  o 68.34053 3.107243 57.23751       5.161216 54.57413       10.53385 58.07888       5.920575 66.04603 6.634698 68.78261 3.544183 -2.736580      7.521998 
1 1 1 -18 21 3  o 54.69378 3.351179 36.73999       4.445101 35.88142       9.518888 36.97942       5.026862 53.19755 7.554948 54.81256 3.786677 -1.615005      8.450809 
1 1 1 -18 21 4  o 115.8234 3.046924 164.1356       8.592443 200.2035       18.91241 154.7543       9.645390 127.1535 6.121531 112.3826 3.526324 14.77092       7.064567 
1 1 1 -18 21 5  o 123.7916 3.088198 187.3784       9.316063 226.5753       20.72924 177.4579       10.42856 135.2319 6.307632 120.3486 3.559792 14.88329       7.242813 
1 1 1 -18 21 6  o 39.72001 4.071420 19.53926       3.885151 15.11370       7.655488 21.07449       4.508953 34.10379 9.059214 41.18407 4.569546 -7.080276      10.14643 
1 1 1 -18 21 7  o 133.1447 2.912289 216.6757       9.449184 207.4820       16.08690 221.5186       11.67562 129.7755 5.096697 134.4732 3.566086 -4.697632      6.220393 
1 1 1 -18 21 8  f 163.6192 3.091596 327.3517       12.32688 335.2542       21.17842 323.3028       15.15934 164.9434 5.275715 162.4506 3.829331 2.492844       6.518968 
1 1 1 -18 21 9  o 44.11846 3.938323 24.04107       4.189692 26.54319       8.371933 23.20505       4.839275 45.55153 7.823793 43.21821 4.668941 2.333317       9.111024 
1 1 1 -18 21 10 o 68.69407 3.700396 57.96475       6.171597 57.18080       9.646605 58.50796       8.030002 67.80714 5.896560 68.82455 4.818238 -1.017403      7.614778 
1 1 1 -18 21 11 o 59.26599 3.247908 43.10341       4.672852 42.30746       9.029564 43.39455       5.460983 58.10133 6.488023 59.39009 3.793120 -1.288765      7.515464 
1 1 1 -18 21 12 o 68.94307 3.043742 58.24628       5.101088 67.94950       10.01216 54.84449       5.928208 74.00164 5.593428 66.80990 3.655141 7.191742       6.681803 
1 1 1 -18 21 13 o 25.21963 5.810341 8.169325       3.497389 13.17149       7.490467 6.774803       3.954963 31.90779 9.155941 23.10013 6.660638 8.807665       11.32234 
1 1 1 -18 21 14 o 60.58714 3.143018 45.04436       4.624621 35.05518       8.659328 49.03042       5.470043 52.65506 6.915511 63.15556 3.568731 -10.50051      7.782039 
1 1 1 -18 21 15 o 62.21331 3.374830 47.55193       5.097323 50.91839       14.83293 47.10113       5.427892 62.47718 10.08589 61.87918 3.615317 0.5979958      10.71428 
1 1 1 -18 21 16 o 47.55616 3.530495 27.88037       4.062278 20.30105       8.021440 30.49473       4.711076 39.37360 8.601295 49.68251 3.922986 -10.30891      9.453681 
1 1 1 -18 21 17 o 70.05215 3.545691 60.35685       6.033146 53.43652       12.48311 62.46599       6.891464 64.61935 8.105103 71.18138 3.988869 -6.562035      9.033482 
1 1 1 -18 21 18 o 69.36660 3.612878 59.23972       6.086118 51.35863       13.22739 61.35628       6.854822 62.94014 8.869678 70.51575 4.005564 -7.575619      9.732201 
1 1 1 -18 21 19 f 70.94699 3.348574 61.90887       5.773015 61.66320       9.909958 62.03506       7.102652 70.14027 5.851119 70.84726 4.131905 -0.7069931     7.162976 
1 1 1 -18 21 20 o 35.12217 4.118423 15.40944       3.458035 10.62055       7.325755 16.78243       3.922550 28.80511 9.226165 36.59200 4.493125 -7.786896      10.26208 
1 1 1 -18 21 21 f 51.73956 3.251733 33.01256       4.079170 32.64798       8.548550 33.12005       4.641712 50.32293 7.173799 51.73199 3.706556 -1.409058      8.074772 
1 1 1 -18 21 22 o 28.01384 4.852780 10.01970       3.192878 6.164902       7.018414 11.02569       3.585378 24.02494 8.952364 29.32976 5.207102 -5.304825      10.35658 
1 1 1 -18 21 23 o 56.62100 3.133659 39.55094       4.306934 31.26549       8.985416 42.02236       4.907418 48.72606 7.832695 58.28826 3.470617 -9.562199      8.567164 
1 1 1 -18 21 24 o 30.28624 4.648257 11.68262       3.321205 11.76319       7.525789 11.66314       3.701105 29.59311 9.336535 30.09570 5.236590 -0.5025940     10.70480 
1 1 1 -18 21 25 o 72.81744 3.589146 65.78081       6.349248 61.69029       14.85248 66.69549       7.023339 67.22937 9.315775 73.18496 3.952760 -5.955589      10.11968 
1 1 1 -18 21 26 o 34.42618 4.778447 15.15129       3.900840 9.330398       7.192760 17.57670       4.642937 26.66744 9.161839 36.93371 5.311159 -10.26627      10.58998 
1 1 1 -18 21 27 o 31.30875 5.198837 12.74404       3.827448 -0.8178650     6.755125 19.15650       4.644997 17.82800 7.885950 38.58249 5.062371 -20.75449      9.371009 
1 1 1 -18 21 28 o 32.40340 6.922544 14.32998       5.300265 12.39324       7.064515 16.82412       8.016906 29.41519 9.008865 33.91820 9.382827 -4.503008      13.00758 
1 1 1 -18 21 29 o 21.50342 8.378329 5.095822       6.323947 5.095822       6.323947 0.000000       0.000000 21.50342 8.378329 ?        ?        0.000000       8.378329 
1 1 1 -18 21 30 o 58.90083 3.559945 43.69925       5.085909 32.50686       7.862198 51.75285       6.669252 48.70349 6.810347 63.63210 4.326689 -14.92861      8.068522 
1 1 1 -18 21 31 o 30.45049 5.439869 12.48803       3.888483 11.77314       6.569567 12.87354       4.824323 27.86416 8.713787 30.22068 6.724210 -2.356520      11.00659 
1 1 1 -18 21 32 o 25.60380 6.601486 9.350520       4.145326 3.336373       6.713343 13.05662       5.269995 19.70050 8.271695 29.91490 7.295576 -10.21439      11.02934 
1 1 1 -18 21 33 o 16.53769 6.561845 2.788859       3.940958 -1.385349      6.674408 5.023109       4.883054 16.47244 7.512149 19.71247 7.441688 -3.240028      10.57408 
1 1 1 -18 21 34 o 20.43288 7.578638 5.843036       5.018728 0.000000       0.000000 5.843036       5.018728 ?        ?        20.43288 7.578638 0.000000       7.578638 
1 1 1 -18 21 35 f 34.31709 6.067588 16.86432       4.888571 12.42901       9.227809 18.59474       5.763843 26.02050 10.12572 35.27503 6.952457 -9.254530      12.28279 
1 1 1 -18 21 36 f 28.61436 6.184339 12.08916       4.186359 7.919521       6.232716 15.51652       5.650782 22.05997 8.389164 31.24258 7.514359 -9.182610      11.26249 
1 1 1 -18 21 37 o 37.08115 5.144345 19.27774       4.523529 17.58791       7.204440 20.37749       5.811992 31.07680 8.998479 36.48140 6.787315 -5.404596      11.27121 
1 1 1 -18 21 38 f 12.81064 5.779053 -0.3671366     3.821486 -0.2459392     6.389080 -0.4346488     4.768509 15.71380 7.234216 13.98014 6.365532 1.733659       9.636072 
1 1 1 -18 22 1  o 54.43147 3.253594 36.40860       4.295987 39.86771       8.894180 35.35603       4.906254 56.25899 6.613688 53.55538 3.783690 2.703606       7.619527 
1 1 1 -18 22 2  o 116.5708 3.054069 166.3931       8.668235 155.5545       16.96078 170.2249       10.08478 111.8267 6.248778 117.8120 3.516635 -5.985344      7.170352 
1 1 1 -18 22 3  o 37.95980 4.816668 18.01362       4.355429 0.000000       0.000000 18.01362       4.355429 ?        ?        37.95980 4.816668 0.000000       4.816668 
1 1 1 -18 22 4  o 128.2525 3.599035 201.7152       11.23720 0.000000       0.000000 201.7152       11.23720 ?        ?        128.2525 3.599035 0.000000       3.599035 
1 1 1 -18 22 5  o 162.9087 3.360591 324.9536       13.34124 359.3764       28.45421 315.2539       15.10439 169.8666 6.888175 160.3324 3.865857 9.534195       7.898849 
1 1 1 -18 22 6  o 85.95802 3.120265 90.52474       6.525185 88.16064       13.69476 91.21909       7.421822 83.98434 6.748203 86.21986 3.539906 -2.235519      7.620313 
1 1 1 -18 22 7  o 147.2104 2.998624 265.0767       10.75713 272.4659       18.63359 261.3831       13.17414 148.5998 5.153476 145.9857 3.706187 2.614075       6.347766 
1 1 1 -18 22 8  o 177.9597 3.690507 388.1729       16.00456 384.3968       23.34447 391.5218       21.98443 176.4022 5.437043 178.1901 5.068004 -1.787949      7.432772 
1 1 1 -18 22 9  o 176.7224 3.196223 382.2581       13.76464 370.1285       22.83291 389.1828       17.25193 173.0824 5.420107 178.0959 3.975095 -5.013504      6.721528 
1 1 1 -18 22 10 o 139.1343 2.955645 236.8071       10.02127 231.9686       17.25444 239.2701       12.31037 137.0530 5.175557 139.6721 3.619859 -2.619034      6.315835 
1 1 1 -18 22 11 o 45.60442 3.938489 25.70995       4.334111 30.28757       8.491127 24.09710       5.040131 48.73573 7.380350 43.98707 4.778681 4.748657       8.792346 
1 1 1 -18 22 12 o 141.3483 3.312728 244.7315       11.41070 248.7902       17.79886 241.8994       14.86805 141.8929 5.156061 140.1919 4.357352 1.701019       6.750665 
1 1 1 -18 22 13 o 104.1794 2.820088 132.8723       7.152883 147.9499       13.40236 126.8671       8.458223 109.3775 5.041815 101.6825 3.418335 7.695038       6.091381 
1 1 1 -18 22 14 o 58.46615 4.414797 42.31719       6.243533 0.000000       0.000000 42.31719       6.243533 ?        ?        58.46615 4.414797 0.000000       4.414797 
1 1 1 -18 22 15 o 124.9711 3.558730 191.8227       10.82675 229.9817       22.69737 180.5827       12.31852 135.3945 6.901981 121.0671 4.181659 14.32733       8.069921 
1 1 1 -18 22 16 o 22.51027 6.852835 6.397107       4.095762 12.81357       9.758354 5.025053       4.512469 31.90727 10.67417 20.92312 7.253696 10.98414       12.90558 
1 1 1 -18 22 17 f 65.45573 3.066229 52.63628       4.877303 51.86726       9.579062 52.90542       5.666866 64.16921 6.203009 65.52953 3.562097 -1.360321      7.153031 
1 1 1 -18 22 18 o 57.21925 3.232945 40.30898       4.489586 45.29527       8.919685 38.61708       5.195729 59.87741 6.202669 55.88246 3.838672 3.994953       7.294415 
1 1 1 -18 22 19 o 101.0243 2.812477 125.2001       6.917165 133.3114       13.04773 122.0291       8.157919 103.4169 5.193974 99.59003 3.366294 3.826843       6.189451 
1 1 1 -18 22 20 o 11.19932 5.018466 -1.194937      2.828211 -1.583631      6.975524 -1.118470      3.093923 18.09587 8.008561 11.86520 5.287537 6.230678       9.596620 
1 1 1 -18 22 21 o 96.02979 2.798079 113.2723       6.540917 111.8747       12.51431 113.7976       7.672343 94.37676 5.464709 96.10802 3.280722 -1.731262      6.373867 
1 1 1 -18 22 22 o 17.74404 5.943030 3.782801       3.024881 -7.302611      7.135728 6.211185       3.339804 15.35254 7.254071 21.83271 6.062350 -6.480171      9.453763 
1 1 1 -18 22 23 o 40.33046 3.858397 20.32972       3.745888 19.23041       8.285123 20.61217       4.199633 37.28766 9.180265 40.48417 4.323721 -3.196503      10.14750 
1 1 1 -18 22 24 o 34.67638 4.396793 15.23288       3.631998 16.79839       11.09667 15.04505       3.843714 34.31195 11.38021 34.36265 4.714307 -0.5070114E-01 12.31803 
1 1 1 -18 22 25 o 22.74794 5.583444 6.837073       3.071773 15.46955       7.230160 4.935688       3.393245 33.21421 8.795202 19.65610 6.277438 13.55811       10.80564 
1 1 1 -18 22 26 o 17.52252 6.379721 3.442933       3.529817 2.493126       6.536047 3.834013       4.194022 19.83184 8.231524 18.67182 6.927547 1.160025       10.75867 
1 1 1 -18 22 27 o 69.37788 4.322630 60.88649       7.271805 53.53717       9.442719 71.59661       11.39911 63.85746 6.143786 73.68363 6.412189 -9.826168      8.880444 
1 1 1 -18 22 28 o 17.53729 7.764775 -0.4307871     6.564354 -0.4307871     6.564354 0.000000       0.000000 17.53729 7.764775 ?        ?        0.000000       7.764775 
1 1 1 -18 22 29 o 34.37215 5.135584 15.57595       4.169914 11.79103       6.863384 17.79054       5.249969 28.13083 8.921378 36.20898 6.170888 -8.078156      10.84762 
1 1 1 -18 22 30 o 40.52828 4.467658 21.30988       4.339269 15.13409       7.073332 25.03665       5.494701 31.41132 8.859210 43.45282 5.298512 -12.04150      10.32278 
1 1 1 -18 22 31 o 19.79480 6.710727 5.318773       3.856598 11.47885       6.491289 1.958202       4.794514 27.30184 8.678287 16.78208 7.014481 10.51975       11.15866 
1 1 1 -18 22 32 f 40.26759 4.611516 21.36251       4.443642 9.612168       6.843200 29.92943       5.843141 24.94329 8.908685 47.31530 5.150716 -22.37201      10.29051 
1 1 1 -18 22 33 o 29.25707 6.474192 12.38638       4.493573 8.677737       8.739329 13.71926       5.239198 23.91583 9.674380 30.27526 7.205892 -6.359423      12.06311 
1 1 1 -18 22 34 o 16.37740 6.818859 2.374982       4.505094 2.799204       8.801789 2.224394       5.244080 19.91043 8.892502 16.94807 7.221962 2.962358       11.45571 
1 1 1 -18 22 35 f 22.51615 7.686723 8.116552       5.061124 15.66649       6.799008 -1.266134      7.579445 30.06406 8.752285 16.72022 7.761243 13.34384       11.69784 
1 1 1 -18 22 36 o 35.92030 5.462540 18.34303       4.631125 28.61901       8.056758 13.27235       5.659550 41.54014 8.249929 28.12634 7.921684 13.41380       11.43741 
1 1 1 -18 22 37 o 13.31314 6.116132 -1.085890      4.533478 -4.257496      6.418390 2.071751       6.404244 13.95795 6.675246 17.09319 7.612954 -3.135244      10.12502 
1 1 1 -18 23 1  o 8.766232 4.206487 -3.729688      2.596365 -8.503413      5.716055 -2.488749      2.914357 12.80487 6.169242 10.38731 4.818525 2.417560       7.828009 
1 1 1 -18 23 2  o 38.79710 4.177958 18.72368       3.887829 17.55163       8.315207 19.05158       4.398180 36.41077 9.329954 39.03072 4.719884 -2.619946      10.45588 
1 1 1 -18 23 3  o 54.87255 3.452227 37.06454       4.592869 35.52605       9.971880 37.47879       5.174381 52.55586 8.041408 55.10670 3.877928 -2.550846      8.927629 
1 1 1 -18 23 4  o 84.97477 3.530750 88.70624       7.295346 0.000000       0.000000 88.70624       7.295346 ?        ?        84.97477 3.530750 0.000000       3.530750 
1 1 1 -18 23 5  o 52.28218 3.580627 33.68060       4.534392 34.36652       9.743662 33.49099       5.122930 51.71646 7.988498 52.04939 4.071306 -0.3329315     8.966138 
1 1 1 -18 23 6  o 64.11881 3.357389 50.52021       5.227661 46.07091       11.00053 51.81812       5.941419 60.14045 7.681117 64.86777 3.774902 -4.727318      8.558588 
1 1 1 -18 23 7  o 50.14283 3.851421 31.04815       4.670123 34.82513       10.33370 30.07874       5.235255 51.91377 8.459425 49.24682 4.408979 2.666950       9.539443 
1 1 1 -18 23 8  o 88.19434 3.497704 95.52762       7.502357 100.0648       11.50523 92.17113       9.895636 89.82130 5.279578 86.34808 4.720740 3.473228       7.082325 
1 1 1 -18 23 9  o 209.5984 3.477053 538.7354       17.75969 545.3094       29.65644 535.0596       22.17568 209.5953 5.811934 208.4977 4.364552 1.097641       7.268281 
1 1 1 -18 23 10 o 122.7858 2.903927 184.5457       8.689005 184.7481       15.11564 184.4459       10.61876 122.1719 5.088279 122.5607 3.559154 -0.3888550     6.209522 
1 1 1 -18 23 11 o 161.4328 3.856195 320.2044       15.17005 307.5435       27.53973 325.7194       18.17622 156.4153 7.244786 162.4702 4.595473 -6.054947      8.579353 
1 1 1 -18 23 12 o 129.4264 3.606766 205.8177       11.36457 199.6192       21.46991 208.2304       13.39501 126.0091 7.019595 129.9792 4.234605 -3.970108      8.197963 
1 1 1 -18 23 13 o 22.83267 8.103456 5.851274       5.653580 1.047052       9.427057 8.549688       7.065110 22.82740 9.703562 26.64011 9.082184 -3.812704      13.29079 
1 1 1 -18 23 14 o 53.96366 3.640998 35.94231       4.760013 37.84005       13.86554 35.68877       5.068014 52.83697 11.12116 53.72204 3.897743 -0.8850708     11.78442 
1 1 1 -18 23 15 o 93.54931 2.862106 107.3224       6.517053 115.4143       12.17156 104.0702       7.716344 96.31235 5.205291 91.98574 3.448455 4.326607       6.243949 
1 1 1 -18 23 16 o 121.6511 2.873870 181.3900       8.519603 175.5254       14.95671 184.2067       10.36561 118.7756 5.179865 122.3757 3.479404 -3.600098      6.239973 
1 1 1 -18 23 17 o 69.29241 2.978779 59.01217       5.018160 65.70830       9.785991 56.62321       5.845170 72.36237 5.592904 67.74863 3.552885 4.613747       6.625977 
1 1 1 -18 23 18 o 61.25420 3.547713 46.35080       5.273005 50.52150       9.264583 44.35238       6.413064 63.14669 6.096297 59.68275 4.441246 3.463940       7.542512 
1 1 1 -18 23 19 o 51.11153 3.445325 32.31815       4.266192 25.17710       8.405155 34.79630       4.951410 43.52390 8.226018 52.94283 3.864444 -9.418934      9.088526 
1 1 1 -18 23 20 o 47.36971 3.545932 27.83197       4.063537 24.37603       8.561293 28.83694       4.616713 42.56998 8.549958 48.11537 3.972802 -5.545391      9.427881 
1 1 1 -18 23 21 o 118.8025 3.225983 174.0672       9.330860 167.4448       14.96491 178.2794       11.93494 115.3188 5.339721 119.7941 4.094373 -4.475342      6.728782 
1 1 1 -18 23 22 o 43.26554 3.763095 23.36662       3.928132 8.231717       8.396238 27.60757       4.444538 26.40002 9.800506 47.00986 3.915242 -20.60984      10.55363 
1 1 1 -18 23 23 o 68.48528 2.990688 57.94336       4.979159 60.07685       9.898804 57.22071       5.761030 68.35132 6.003858 67.88650 3.494173 0.4648209      6.946621 
1 1 1 -18 23 24 o 27.40970 5.380808 9.848632       3.465721 4.977237       10.29401 10.47139       3.680588 24.89305 10.33114 28.22822 5.548454 -3.335175      11.72680 
1 1 1 -18 23 25 o 17.41571 5.955004 3.695872       3.037831 -4.348741      6.393563 6.041555       3.452431 15.33419 7.121435 21.31151 6.245964 -5.977323      9.472428 
1 1 1 -18 23 26 o 18.86590 6.551633 4.401816       3.681972 0.1775735      6.467111 6.427800       4.478720 17.92443 7.828826 22.01449 7.226753 -4.090063      10.65441 
1 1 1 -18 23 27 o 20.85847 6.076262 5.877332       3.276053 2.672952       6.162127 7.139887       3.867975 19.23870 7.989589 22.81237 6.589816 -3.573673      10.35660 
1 1 1 -18 23 28 f 17.92509 6.962188 3.360798       4.356064 2.193317       6.699736 4.215768       5.733350 19.22325 8.176247 19.99382 7.920538 -0.7705650     11.38358 
1 1 1 -18 23 29 o 48.03580 4.061287 29.56604       4.709557 27.32788       7.761038 30.87056       5.925172 43.69444 7.562512 48.42740 5.097149 -4.732964      9.119897 
1 1 1 -18 23 30 o 38.87221 4.802102 19.91058       4.452283 13.91083       6.722981 24.59744       5.942047 29.94548 8.699008 42.49717 5.896368 -12.55169      10.50904 
1 1 1 -18 23 31 o 23.35165 6.678968 7.881687       3.992125 12.01908       6.597326 5.491563       5.014352 27.54429 8.748118 20.30982 7.567224 7.234470       11.56687 
1 1 1 -18 23 32 o 23.22978 6.808370 7.963274       4.102106 4.535809       6.780246 9.942205       5.151982 20.15336 8.376041 25.42337 7.674603 -5.270014      11.36035 
1 1 1 -18 23 33 o 36.97325 6.749948 20.09626       5.857661 0.000000       0.000000 20.09626       5.857661 ?        ?        36.97325 6.749948 0.000000       6.749948 
1 1 1 -18 23 34 o 23.86000 7.778559 9.226004       5.192896 2.345979       6.670652 19.80859       8.273119 17.96808 7.896534 32.81445 9.682630 -14.84637      12.49434 
1 1 1 -18 23 35 o 24.89346 6.764515 9.637026       4.209680 10.85523       6.883162 8.909083       5.320800 24.50399 8.910706 23.11996 7.881698 1.384037       11.89629 
1 1 1 -18 23 36 o 22.78869 6.965572 8.338408       4.226026 7.313150       6.873984 8.961371       5.358256 21.02648 8.552694 22.87864 7.905676 -1.852165      11.64681 
1 1 1 -18 24 1  o 61.45478 3.203135 46.46468       4.780413 56.21016       9.621890 43.27076       5.508341 66.86056 5.968147 59.17252 3.840763 7.688042       7.097199 
1 1 1 -18 24 2  o 55.29021 3.375338 37.66710       4.526133 47.93687       9.458797 34.61729       5.154567 61.58643 6.395544 52.86788 4.031360 8.718552       7.560082 
1 1 1 -18 24 3  o 78.28744 3.399277 75.37739       6.469615 86.46520       12.68722 71.48106       7.520928 82.94527 6.324492 76.07891 4.071513 6.866364       7.521730 
1 1 1 -18 24 4  o 61.59429 4.494447 47.06099       6.699673 0.000000       0.000000 47.06099       6.699673 ?        ?        61.59429 4.494447 0.000000       4.494447 
1 1 1 -18 24 5  o 110.3612 3.507719 149.7023       9.421617 156.7037       17.72596 146.9456       11.12287 111.7314 6.538841 109.1371 4.190020 2.594284       7.766126 
1 1 1 -18 24 6  o 19.00369 7.265766 3.243153       4.691236 0.000000       0.000000 3.243153       4.691236 ?        ?        19.00369 7.265766 0.000000       7.265766 
1 1 1 -18 24 7  o 88.61017 3.568253 96.58907       7.689288 87.89881       13.96888 100.3670       9.210245 83.41978 6.934216 90.16435 4.203365 -6.744576      8.108738 
1 1 1 -18 24 8  o 115.1485 3.539100 162.9905       9.919081 166.1912       18.56059 161.7110       11.73548 115.0086 6.650924 114.4853 4.213634 0.5233307      7.873341 
1 1 1 -18 24 9  o 149.6293 3.738778 275.2553       13.63272 289.2158       25.62604 269.7448       16.10001 151.5757 6.956251 147.7735 4.476044 3.802200       8.271904 
1 1 1 -18 24 10 o 50.57693 3.719496 31.61713       4.552231 32.57959       8.511262 31.23149       5.387585 50.42759 7.124338 50.11099 4.458393 0.3165932      8.404371 
1 1 1 -18 24 11 o 16.73210 6.288985 2.649043       3.479000 1.755763       6.983899 2.943871       4.012256 20.46234 8.502381 17.79917 6.739695 2.663172       10.84961 
1 1 1 -18 24 12 o 87.83828 2.939875 94.68290       6.284003 94.46999       11.39595 94.77592       7.532743 87.01110 5.401153 87.74409 3.530097 -0.7329865     6.452444 
1 1 1 -18 24 13 o 124.0407 2.940449 188.6563       8.888202 189.4804       15.82626 188.2767       10.74231 123.3481 5.277336 123.6826 3.567854 -0.3345337     6.370232 
1 1 1 -18 24 14 o 32.22172 4.904879 13.16021       3.729997 8.125515       7.373896 14.89141       4.323990 26.22717 9.259627 34.19882 5.364791 -7.971653      10.70148 
1 1 1 -18 24 15 f 69.78170 3.516157 60.07979       5.959972 55.00785       9.580265 63.28208       7.612390 65.96706 6.026039 71.37494 4.397982 -5.407883      7.460254 
1 1 1 -18 24 16 o 30.45336 5.050009 11.83680       3.616468 13.06289       7.405054 11.45277       4.144322 31.23001 9.145987 29.71807 5.930571 1.511932       10.90049 
1 1 1 -18 24 17 o 33.99641 4.558662 14.59551       3.681551 16.14615       7.588768 14.11823       4.210177 34.49346 8.951602 33.20146 5.388185 1.292000       10.44814 
1 1 1 -18 24 18 o 49.88044 4.054534 31.00936       4.885951 26.15960       8.647502 33.28364       5.921776 44.22289 8.329817 51.47187 4.775590 -7.248985      9.601672 
1 1 1 -18 24 19 o 69.52106 3.032605 59.59331       5.125335 45.38786       9.668590 65.14530       6.044497 59.20892 6.825787 72.57625 3.427348 -13.36733      7.637937 
1 1 1 -18 24 20 o 53.40062 3.308964 35.33032       4.284851 26.62835       8.672010 38.14096       4.928489 44.37545 8.325105 55.38772 3.672176 -11.01227      9.099024 
1 1 1 -18 24 21 o 25.63916 5.464683 8.611346       3.309876 11.36538       7.591460 7.964936       3.677858 28.92566 9.403204 24.50227 6.165516 4.423388       11.24428 
1 1 1 -18 24 22 o 33.18408 4.490160 14.03573       3.537932 13.86200       7.728928 14.08178       3.979318 31.34580 9.386016 33.03354 5.107950 -1.687737      10.68590 
1 1 1 -18 24 23 o 56.30481 3.440006 39.50422       4.697459 40.86096       12.52114 39.28198       5.067601 53.22697 10.02090 56.03613 3.732337 -2.809162      10.69340 
1 1 1 -18 24 24 o 33.71496 5.268868 14.82716       4.187309 15.77700       6.942243 14.28400       5.249771 33.27473 8.524236 32.39076 6.864479 0.8839684      10.94457 
1 1 1 -18 24 25 f 53.39843 3.955177 36.01223       5.110182 31.93411       7.816291 39.05666       6.753430 48.66249 6.774726 54.99829 5.096920 -6.335800      8.477943 
1 1 1 -18 24 26 o 15.45232 5.970664 2.316560       3.191183 3.405411       6.244871 1.931740       3.712510 19.85728 8.123599 15.68333 6.319247 4.173948       10.29202 
1 1 1 -18 24 27 o 37.79214 4.651289 18.58305       4.193361 19.17675       7.237282 18.28300       5.145003 36.01657 8.400705 36.77814 5.943225 -0.7615738     10.29047 
1 1 1 -18 24 28 o 36.44608 4.463832 17.28951       3.881891 2.798367       6.975367 23.79113       4.672259 19.68226 8.356004 42.77098 4.552597 -23.08872      9.515720 
1 1 1 -18 24 29 o 31.72564 5.752714 13.78678       4.283803 10.21444       6.790744 16.14803       5.520923 25.83816 8.901160 33.57834 6.975284 -7.740183      11.30864 
1 1 1 -18 24 30 o 40.87286 4.692814 22.06877       4.589478 19.92589       7.376546 23.42217       5.862296 35.74008 8.578710 41.14318 6.025582 -5.403107      10.48341 
1 1 1 -18 24 31 o 23.41103 7.174118 8.206814       4.479194 10.00898       9.026561 7.618084       5.159205 24.91341 9.916002 22.52420 7.758568 2.389210       12.59057 
1 1 1 -18 24 32 o 18.02488 6.945494 4.126439       4.309703 -3.025057      8.298425 6.767674       5.043138 16.89880 7.934371 21.27402 7.641914 -4.375217      11.01604 
1 1 1 -18 24 33 o 21.61717 8.243635 7.315423       6.028861 10.83588       10.40571 5.536534       7.396852 24.37547 10.27012 20.50803 8.650769 3.867441       13.42800 
1 1 1 -18 24 34 o 17.80324 6.693320 4.404468       3.941281 8.437737       6.549151 2.114377       4.934950 22.35427 8.575274 16.22540 6.962071 6.128868       11.04562 
1 1 1 -18 24 35 o 29.01878 6.280484 12.72440       4.312182 11.07060       7.304888 13.60893       5.342325 24.18805 9.108336 28.75071 7.535216 -4.562662      11.82122 
1 1 1 -18 25 1  o 51.10867 3.449017 32.28379       4.270465 40.58401       8.352872 29.34648       4.968963 56.52333 6.163940 48.53715 4.243665 7.986179       7.483505 
1 1 1 -18 25 2  o 27.52557 5.261950 9.733700       3.400939 19.87539       7.518295 7.124561       3.813405 38.69349 8.226954 23.42075 6.468269 15.27274       10.46524 
1 1 1 -18 25 3  o 48.70721 3.753405 29.39248       4.420733 37.92823       9.698772 27.15408       4.966667 54.14585 7.555979 46.65246 4.421493 7.493389       8.754565 
1 1 1 -18 25 4  o 48.99808 3.729852 29.73069       4.420091 20.47543       8.799792 32.85374       5.111726 38.97166 9.379685 51.43520 4.112455 -12.46354      10.24162 
1 1 1 -18 25 5  o 72.83901 3.251282 65.29087       5.756505 67.85197       12.34196 64.57881       6.507725 72.96734 7.027792 72.33347 3.704269 0.6338654      7.944273 
1 1 1 -18 25 6  o 110.8454 3.139323 150.9419       8.471340 145.9229       17.90281 152.3899       9.615998 107.3317 6.880990 111.2492 3.551552 -3.917511      7.743484 
1 1 1 -18 25 7  f 55.30042 5.703749 38.55196       7.576292 0.000000       0.000000 38.55196       7.576292 ?        ?        55.30042 5.703749 0.000000       5.703749 
1 1 1 -18 25 8  o 95.25612 3.120490 111.5003       7.233779 111.4768       15.46298 111.5069       8.184605 93.77608 6.812981 95.14501 3.536160 -1.368935      7.676010 
1 1 1 -18 25 9  o 58.56806 3.266659 42.27067       4.643832 31.18667       8.225755 47.45591       5.626157 49.20447 7.062329 61.96109 3.743582 -12.75663      7.993178 
1 1 1 -18 25 10 o 50.02546 3.561340 30.95147       4.313116 29.42418       7.907798 31.59822       5.145938 47.77259 7.000326 50.39674 4.229086 -2.624157      8.178615 
1 1 1 -18 25 11 o 136.4817 2.971876 228.6149       9.884192 222.1658       16.80056 232.0287       12.22346 133.4730 5.175090 137.1943 3.659403 -3.721222      6.338200 
1 1 1 -18 25 12 o 77.61433 3.013452 74.07780       5.688742 74.18965       10.20908 74.02744       6.850913 76.86736 5.486221 77.42527 3.641229 -0.5579147     6.584616 
1 1 1 -18 25 13 o 75.24254 3.394967 69.83010       6.208903 66.07719       15.82344 70.51308       6.750272 70.40133 9.462645 75.53086 3.678483 -5.129532      10.15248 
1 1 1 -18 25 14 f 67.08841 3.148771 55.46936       5.133473 59.57953       9.556187 53.80218       6.086192 68.64435 5.765973 65.89795 3.806181 2.746399       6.908940 
1 1 1 -18 25 15 o 29.05507 5.348280 10.88330       3.647304 6.926395       7.153822 12.27310       4.239723 24.71935 9.069266 30.75006 5.871991 -6.030714      10.80425 
1 1 1 -18 25 16 o 39.72484 4.779620 19.95218       4.534072 17.26686       7.518406 21.48697       5.683977 35.57829 8.736669 40.88600 5.873173 -5.307709      10.52728 
1 1 1 -18 25 17 o 42.14779 4.366704 22.33097       4.420125 26.52401       7.840536 20.37751       5.351607 44.78617 7.445286 39.82238 5.675085 4.963783       9.361564 
1 1 1 -18 25 18 o 51.39410 3.326423 32.74736       4.143694 34.23230       8.071898 32.21602       4.828465 51.30555 6.609568 50.80115 3.930872 0.5044060      7.690133 
1 1 1 -18 25 19 o 10.93874 5.025394 -2.068481      3.060831 -2.269517      6.313065 -2.006701      3.499682 16.51342 7.440550 11.92660 5.439284 4.586818       9.216702 
1 1 1 -18 25 20 o 78.92611 2.927405 76.93970       5.620648 68.24084       10.21601 80.71589       6.730947 72.89516 5.798800 80.63961 3.433100 -7.744446      6.738862 
1 1 1 -18 25 21 o 73.19156 2.978661 66.29342       5.301636 61.45850       9.958572 68.20568       6.262916 68.87430 5.993012 74.03419 3.481177 -5.159889      6.930714 
1 1 1 -18 25 22 o 75.88390 3.006512 71.36832       5.548662 60.78333       10.10399 75.93878       6.639378 68.21048 6.144423 78.04765 3.499754 -9.837173      7.071224 
1 1 1 -18 25 23 o 58.61631 4.313245 43.56505       6.117960 37.29758       11.92689 45.80303       7.127040 50.10382 10.11723 59.75417 4.938519 -9.650349      11.25821 
1 1 1 -18 25 24 f 53.52984 3.456825 35.94404       4.485194 37.64973       7.669128 35.05736       5.529424 53.30699 6.008259 52.41947 4.368306 0.8875237      7.428410 
1 1 1 -18 25 25 o 66.96193 3.108547 56.00147       5.058652 44.81496       8.592217 61.93605       6.258257 57.82515 6.193896 70.09055 3.676879 -12.26540      7.203040 
1 1 1 -18 25 26 o 65.12386 3.214035 53.19885       5.084908 30.76340       8.713517 64.78479       6.261693 46.10804 8.047578 71.62509 3.599020 -25.51705      8.815694 
1 1 1 -18 25 27 o 21.43640 6.704221 6.420156       3.888753 8.270479       6.406785 5.340816       4.893227 23.99430 8.614048 20.34656 7.494630 3.647741       11.41803 
1 1 1 -18 25 28 o 15.04745 6.072051 1.914730       3.433324 -1.523755      6.302850 3.365499       4.094044 16.09241 7.323814 17.42613 6.754754 -1.333729      9.963180 
1 1 1 -18 25 29 o 31.64506 5.142384 13.53740       3.829560 4.586275       6.744510 17.79634       4.652246 20.39948 8.404332 36.16037 5.448558 -15.76089      10.01597 
1 1 1 -18 25 30 o 33.06766 6.136602 15.50769       4.762996 23.12149       9.452183 12.91643       5.514262 36.04591 10.26660 28.94017 7.689087 7.105742       12.82673 
1 1 1 -18 25 31 o 18.56585 6.927947 4.652219       4.206051 8.493181       7.995313 3.182527       4.945709 23.20462 9.299981 17.51554 7.204503 5.689072       11.76412 
1 1 1 -18 25 32 o 16.02216 6.773674 2.114437       4.551671 2.665670       10.38379 1.983328       5.064122 20.28021 9.294394 16.40054 7.045158 3.879671       11.66276 
1 1 1 -18 25 33 o 34.95780 5.469261 17.33127       4.506564 16.19398       7.522017 17.96806       5.628548 29.48131 9.338408 34.13309 7.001883 -4.651787      11.67185 
1 1 1 -18 25 34 o 11.45430 5.393223 -2.663195      3.881868 -5.675684      6.369278 -0.8829188     4.896335 13.42364 6.478539 13.94736 6.388416 -0.5237246     9.098535 
1 1 1 -18 26 1  o 13.50101 5.546181 0.8498948      2.926122 -2.463725      5.071406 2.503558       3.582619 14.59700 6.614091 16.57560 6.346481 -1.978608      9.166462 
1 1 1 -18 26 2  o 65.08781 3.173631 52.25371       5.018582 64.30293       10.08159 48.28426       5.786484 71.22767 5.860019 62.38775 3.824471 8.839916       6.997600 
1 1 1 -18 26 3  o 38.10383 5.060134 18.41902       4.582544 0.000000       0.000000 18.41902       4.582544 ?        ?        38.10383 5.060134 0.000000       5.060134 
1 1 1 -18 26 4  o 17.46903 6.264252 3.344170       3.387089 -5.062126      6.436937 6.562943       3.983108 15.36160 7.138053 22.54451 6.735071 -7.182904      9.813918 
1 1 1 -18 26 5  o 83.85733 3.151033 86.59888       6.427720 86.78763       13.19244 86.54013       7.360475 82.48483 6.618698 83.68829 3.617696 -1.203461      7.542870 
1 1 1 -18 26 6  f 106.3256 3.131387 139.1263       8.104705 150.3447       17.04815 135.8505       9.212305 108.8108 6.458436 104.8945 3.609332 3.916283       7.398559 
1 1 1 -18 26 7  o 79.00596 4.003050 77.38468       7.681913 66.54716       12.70698 83.62682       9.643708 71.78104 7.368862 81.81086 4.859122 -10.02982      8.826732 
1 1 1 -18 26 8  o 41.00439 4.232923 21.04179       4.168949 19.17014       9.105688 21.53817       4.689299 37.30580 9.866327 41.35495 4.738601 -4.049149      10.94526 
1 1 1 -18 26 9  o 43.47726 4.609001 23.74512       4.808918 0.000000       0.000000 23.74512       4.808918 ?        ?        43.47726 4.609001 0.000000       4.609001 
1 1 1 -18 26 10 o 23.57529 6.228451 7.278511       3.631224 1.886279       6.687516 9.533027       4.324214 19.99179 8.314536 26.88587 6.639891 -6.894079      10.64047 
1 1 1 -18 26 11 o 13.76123 5.802041 0.4030174      3.324795 -7.960374      6.353541 3.556924       3.901656 13.92272 6.653784 18.29613 6.700164 -4.373412      9.442724 
1 1 1 -18 26 12 o 62.98875 3.284367 49.01419       5.023980 37.75062       8.849289 54.37125       6.102863 53.97645 6.884174 66.20065 3.798943 -12.22420      7.862812 
1 1 1 -18 26 13 o 45.28675 3.937391 25.59121       4.302114 34.87510       8.284148 22.16280       5.034181 51.88007 6.709535 41.79787 5.044292 10.08220       8.394209 
1 1 1 -18 26 14 o 67.98506 3.124898 57.06040       5.163241 59.04300       9.466409 56.22083       6.160225 68.11852 5.756583 67.28201 3.772282 0.8365173      6.882468 
1 1 1 -18 26 15 o 34.03652 4.697464 14.73911       3.792456 14.93919       7.028800 14.65694       4.504385 32.95731 8.645755 33.61949 5.701550 -0.6621780     10.35648 
1 1 1 -18 26 16 o 43.90472 3.785845 24.08359       4.010990 30.07006       7.729508 21.87753       4.692185 47.88676 6.815911 41.54378 4.718303 6.342979       8.289694 
1 1 1 -18 26 17 o 36.84219 4.897621 17.34519       4.288287 11.64677       7.221997 20.44846       5.329538 29.10985 9.141003 39.76302 5.659761 -10.65317      10.75132 
1 1 1 -18 26 18 o 35.32026 5.092041 16.06282       4.256368 20.95337       7.333331 13.57830       5.226888 39.11589 7.964282 31.73243 6.951977 7.383461       10.57165 
1 1 1 -18 26 19 o 36.08656 4.352618 16.55947       3.750431 26.21059       7.675522 13.53257       4.298510 44.03563 7.415884 32.09116 5.705721 11.94446       9.356848 
1 1 1 -18 26 20 o 79.99030 3.412484 79.66695       6.636591 86.76500       10.58875 75.07468       8.517040 82.25634 5.310879 77.00256 4.559275 5.253784       6.999459 
1 1 1 -18 26 21 o 27.48888 6.206585 10.21447       4.058881 17.08469       6.845829 6.490204       5.040351 34.70202 8.222200 22.32330 7.669464 12.37872       11.24390 
1 1 1 -18 26 22 o 16.89362 6.878640 2.116051       4.451791 8.003319       9.199724 0.3159464      5.087059 25.53514 10.05889 16.17129 7.004381 9.363859       12.25735 
1 1 1 -18 26 23 o 13.59484 5.722192 0.6984399      3.225185 1.321909       5.890736 0.4315473      3.854167 17.84456 7.630529 14.37502 6.160079 3.469542       9.806709 
1 1 1 -18 26 24 f 65.57124 3.149869 53.81577       5.018455 52.21865       8.785136 54.58938       6.114248 62.63481 5.822348 65.62244 3.840226 -2.987629      6.974745 
1 1 1 -18 26 25 o 53.40957 3.507786 36.06316       4.540228 40.09229       8.345672 34.36943       5.411018 54.11285 6.456047 51.64457 4.339605 2.468277       7.778992 
1 1 1 -18 26 26 o 25.52784 6.635382 9.279597       4.165262 9.786090       6.687028 8.958504       5.324299 25.49665 8.830641 24.67604 7.861418 0.8206100      11.82295 
1 1 1 -18 26 27 o 16.50530 6.358752 2.996590       3.611820 -5.816618      6.177642 7.573801       4.452011 13.82273 6.593600 22.84826 7.177322 -9.025524      9.746257 
1 1 1 -18 26 28 o 37.09409 5.122065 18.53700       4.506610 12.20581       6.906468 23.23159       5.947190 27.44168 8.972197 40.75775 6.181481 -13.31607      10.89546 
1 1 1 -18 26 29 o 31.07774 6.572366 14.05396       4.821701 1.218319       8.216381 20.79622       5.954901 18.96024 8.520334 37.86691 6.698264 -18.90667      10.83803 
1 1 1 -18 26 30 o 12.27191 5.404063 -0.8902990E-01 3.138716 -5.432941      5.795227 2.129210       3.733748 13.16063 6.307042 15.31905 6.275885 -2.158427      8.897499 
1 1 1 -18 26 31 o 25.31674 5.848640 9.320955       3.535664 8.303479       6.411680 9.765553       4.238318 22.52152 8.521658 25.26518 6.753973 -2.743654      10.87358 
1 1 1 -18 26 32 o 12.45375 5.542459 -0.1826680     3.387866 1.192688       6.168428 -0.7767487     4.054055 16.65834 7.441887 13.00616 5.901331 3.652186       9.497758 
1 1 1 -18 26 33 f 17.78793 6.644077 4.522108       3.870294 11.83376       6.180381 -0.1950445     4.964180 25.68891 8.492002 14.46176 6.549211 11.22715       10.72410 
1 1 1 -18 27 1  o 53.01439 3.431392 34.88815       4.409211 36.38494       8.166945 34.27238       5.238218 52.94961 6.463160 52.32329 4.141975 0.6263199      7.676483 
1 1 1 -18 27 2  o 13.53040 5.605775 0.7528788      3.023567 3.841934       5.587042 -0.5265082     3.595589 20.28652 7.883273 13.33651 5.830963 6.950006       9.805412 
1 1 1 -18 27 3  o 21.24559 6.295434 5.865834       3.491287 -2.582732      6.694724 9.021811       4.091740 16.93435 7.643285 26.07776 6.469898 -9.143404      10.01396 
1 1 1 -18 27 4  o 48.07291 3.832108 28.81016       4.452121 22.60368       8.378469 31.25215       5.255497 40.66802 8.716280 49.91784 4.364227 -9.249821      9.747821 
1 1 1 -18 27 5  o 15.79176 6.196915 2.014473       3.479980 10.07705       7.020536 -0.6118326     4.006877 27.64276 9.046475 14.04131 6.146874 13.60146       10.93722 
1 1 1 -18 27 6  o 46.81911 5.006288 27.75621       5.623277 40.31803       9.603092 21.20121       6.936989 55.48409 7.277708 39.95070 7.397802 15.53339       10.37750 
1 1 1 -18 27 7  o 34.00306 4.884522 14.74002       3.931376 14.56150       8.320753 14.79133       4.460670 32.45167 9.743727 33.83728 5.605742 -1.385605      11.24120 
1 1 1 -18 27 8  o 73.10052 3.253112 66.03136       5.780513 58.56297       11.93321 68.32110       6.607482 66.88586 7.447439 74.22144 3.664506 -7.335571      8.300178 
1 1 1 -18 27 9  o 99.26319 3.154918 121.5768       7.621853 133.8348       16.72517 118.3639       8.562653 101.9066 6.773357 97.75668 3.600547 4.149956       7.670874 
1 1 1 -18 27 10 o 16.50136 6.378899 2.423381       3.643700 -1.710199      8.207177 3.438146       4.066430 19.34516 8.616921 18.24872 6.811515 1.096443       10.98399 
1 1 1 -18 27 11 o 42.66338 4.544697 22.97651       4.652293 25.26339       12.58029 22.61421       5.007268 41.32359 11.86820 42.18192 4.966288 -0.8583298     12.86538 
1 1 1 -18 27 12 o 37.73317 4.963018 18.16574       4.453042 25.07971       11.67585 16.98886       4.817148 41.36602 11.27600 36.23861 5.638133 5.127411       12.60701 
1 1 1 -18 27 13 o 61.19310 3.255062 46.39011       4.836515 43.11100       8.456387 47.98418       5.896048 57.80741 6.094568 62.01046 3.921845 -4.203053      7.247387 
1 1 1 -18 27 14 o 91.83179 2.911349 104.0636       6.506902 107.5265       11.46879 102.4198       7.901791 92.14465 5.127761 90.81182 3.577648 1.332825       6.252480 
1 1 1 -18 27 15 o 25.98864 5.818788 8.947086       3.593204 3.437891       6.785483 11.09397       4.235854 20.94908 8.506238 28.87570 6.204625 -7.926619      10.52870 
1 1 1 -18 27 16 o 78.35194 3.386755 76.27831       6.451233 72.05192       9.743791 79.57697       8.608217 75.06128 5.362236 79.47080 4.462909 -4.409523      6.976470 
1 1 1 -18 27 17 o 104.7917 2.905895 135.7864       7.413500 132.6327       12.60764 137.4530       9.165496 102.0427 5.086119 105.0334 3.586162 -2.990669      6.223276 
1 1 1 -18 27 18 o 43.14306 4.471226 23.70740       4.632752 24.74876       7.472532 23.05724       5.904418 42.54534 7.480349 41.86283 5.955592 0.6825104      9.561626 
1 1 1 -18 27 19 o 54.30006 3.894957 37.14563       5.119701 39.57301       8.099326 35.53028       6.607131 54.74556 6.178884 52.41256 5.243302 2.333000       8.103753 
1 1 1 -18 27 20 o 12.66570 5.710385 -1.401725      3.725032 -2.916272      6.229317 -0.5586882     4.647530 15.67961 7.190747 14.86493 6.559694 0.8146725      9.733264 
1 1 1 -18 27 21 o 21.67455 6.214383 6.408233       3.452001 -2.128747      6.010345 10.61054       4.216881 15.74257 7.159628 27.77835 6.366032 -12.03579      9.580534 
1 1 1 -18 27 22 o 48.65283 4.035201 30.18567       4.741204 14.72162       10.48225 34.16304       5.316074 30.30822 10.99992 51.64754 4.261711 -21.33932      11.79663 
1 1 1 -18 27 23 f 23.87680 6.042930 7.895362       3.518563 1.969623       6.289051 10.59530       4.245126 18.53316 7.903481 27.52862 6.442771 -8.995462      10.19678 
1 1 1 -18 27 24 o 28.48675 5.416950 10.98468       3.623006 7.836931       6.524912 12.38774       4.356257 23.58769 8.660224 29.87383 6.187652 -6.286144      10.64361 
1 1 1 -18 27 25 o 18.37888 6.359113 4.448961       3.467337 13.54481       6.469818 0.7838005      4.106927 29.60636 8.513626 14.84496 6.360108 14.76140       10.62698 
1 1 1 -18 27 26 o 25.91314 6.464643 9.630901       4.068611 5.041233       6.311084 12.89499       5.322237 20.56394 8.255396 29.43388 7.422623 -8.869938      11.10166 
1 1 1 -18 27 27 o 52.82449 4.319339 36.49437       5.511674 27.30755       10.03475 40.46323       6.595653 39.57707 10.30501 55.04290 4.970740 -15.46583      11.44122 
1 1 1 -18 27 28 o 27.74286 6.044611 11.03000       3.970727 14.34964       9.215818 10.27326       4.400094 27.92470 10.28547 26.23036 6.820803 1.694340       12.34157 
1 1 1 -18 27 29 o 17.83554 6.510964 4.317739       3.680058 0.9326797      5.699409 6.738132       4.819362 16.36733 7.241525 21.10617 7.482633 -4.738838      10.41295 
1 1 1 -18 27 30 o 10.79260 5.019956 -1.970419      3.195893 -6.262296      5.910677 -0.1972852     3.799132 12.84528 6.209585 13.13268 5.855359 -0.2873964     8.534880 
1 1 1 -18 27 31 o 40.27087 4.776010 22.21861       4.595819 19.30064       11.18970 22.81073       5.040590 28.87168 11.17374 40.36492 5.248546 -11.49324      12.34503 
1 1 1 -18 27 32 o 18.39861 6.691736 5.005108       3.882117 8.017023       6.330854 3.190071       4.914550 21.70839 8.403790 16.96092 7.096378 4.747467       10.99920 
1 1 1 -18 28 1  o 34.23059 4.434939 14.92855       3.612585 15.36411       6.201918 14.70487       4.444430 33.40830 7.765793 33.53808 5.637846 -0.1297760     9.596502 
1 1 1 -18 28 2  o 55.93679 4.156326 39.30166       5.625080 0.000000       0.000000 39.30166       5.625080 ?        ?        55.93679 4.156326 0.000000       4.156326 
1 1 1 -18 28 3  o 23.20328 6.072372 7.159386       3.472746 0.7915882      6.360708 9.863580       4.145050 18.48680 7.917663 27.16081 6.372969 -8.674004      10.16386 
1 1 1 -18 28 4  o 24.44214 5.851456 7.918924       3.438981 5.611084       6.596643 8.780226       4.029932 22.69931 8.631009 25.61316 6.458795 -2.913851      10.78009 
1 1 1 -18 28 5  o 15.54468 6.139279 1.927582       3.434918 7.787397       6.500193 -0.3426717     4.045959 24.79269 8.698686 14.26365 6.211725 10.52904       10.68890 
1 1 1 -18 28 6  o 38.29456 5.618727 18.99383       5.087504 24.11636       8.607928 16.24389       6.306931 41.69761 8.750768 34.52476 7.693241 7.172848       11.65169 
1 1 1 -18 28 7  o 54.20414 3.601873 36.60170       4.730709 41.19861       10.55065 35.44495       5.292552 55.25795 8.073477 53.15879 4.117663 2.099155       9.062901 
1 1 1 -18 28 8  o 26.96361 6.109183 9.660383       3.920908 3.487884       8.506375 11.32561       4.418260 22.63136 9.391821 29.14688 6.396433 -6.515514      11.36313 
1 1 1 -18 28 9  o 13.08482 5.684113 -0.2716087     3.370147 -2.349758      7.659645 0.2272764      3.752931 18.17521 8.191963 14.25075 6.092072 3.924452       10.20890 
1 1 1 -18 28 10 o 100.9824 3.172984 126.2124       7.798489 109.8920       15.79031 131.4774       8.968614 91.37316 7.148323 102.8498 3.583849 -11.47668      7.996405 
1 1 1 -18 28 11 o 37.51073 4.680865 17.95659       4.185900 10.79289       8.259184 20.43272       4.855731 28.24722 9.812292 39.88198 5.113744 -11.63477      11.06487 
1 1 1 -18 28 12 o 67.47540 3.590431 56.74824       5.882500 61.61088       14.42730 55.77865       6.442334 66.49953 9.144778 66.72434 3.980165 -0.2248077     9.973398 
1 1 1 -18 28 13 o 9.841294 4.685351 -3.725610      3.088475 -9.480697      5.959558 -1.612412      3.611255 12.55456 6.107692 12.38495 5.599525 0.1696129      8.286048 
1 1 1 -18 28 14 o 61.65511 3.672108 47.53779       5.492230 50.16383       8.541524 45.68671       7.171294 62.24934 5.693710 59.80942 4.965029 2.439922       7.554459 
1 1 1 -18 28 15 o 68.59608 3.645450 58.84946       6.071895 60.34364       9.145302 57.67159       8.119793 68.33471 5.539327 67.15228 4.997735 1.182434       7.460663 
1 1 1 -18 28 16 o 48.23343 4.344658 29.57051       5.052018 27.67139       7.783006 30.95334       6.641315 44.99665 7.351532 48.65023 5.710454 -3.653576      9.308830 
1 1 1 -18 28 17 o 19.18803 6.886148 4.455005       4.093887 11.16518       6.539546 0.1305017      5.249872 27.88449 8.689862 16.27946 7.082877 11.60503       11.21075 
1 1 1 -18 28 18 o 43.88743 3.921760 24.42312       4.150127 24.86523       7.494285 24.22758       4.984130 42.20253 7.565006 43.29558 4.804804 -1.093048      8.961889 
1 1 1 -18 28 19 o 19.72490 6.459744 5.148403       3.579384 4.821158       6.455926 5.293643       4.300966 21.17869 8.400078 20.25035 7.077897 0.9283447      10.98444 
1 1 1 -18 28 20 o 35.82483 4.474884 16.63314       3.821666 10.00872       6.483553 20.16015       4.730885 26.14005 8.699701 39.17054 5.075379 -13.03050      10.07195 
1 1 1 -18 28 21 o 30.30715 5.860255 12.52675       4.171534 7.702122       10.07743 13.52442       4.582591 24.95085 10.27564 31.31873 6.223764 -6.367876      12.01349 
1 1 1 -18 28 22 o 36.33104 5.084484 17.50433       4.378452 14.13823       6.697990 20.01603       5.785811 30.41033 8.636037 37.99170 6.481801 -7.581366      10.79791 
1 1 1 -18 28 23 o 34.81955 4.728524 15.98735       3.908638 13.64910       6.889249 17.09728       4.746520 29.53983 8.865265 35.45920 5.685041 -5.919367      10.53151 
1 1 1 -18 28 24 o 13.10171 5.666771 0.2527618      3.320165 1.663908       6.112798 -0.3377508     3.954291 17.82477 7.699304 13.62421 6.029658 4.200561       9.779368 
1 1 1 -18 28 25 o 16.37290 7.037265 1.364166       5.058178 0.1385757      7.474013 2.399879       6.870697 18.01811 8.109153 18.85018 8.152480 -0.8320694     11.49875 
1 1 1 -18 28 26 o 33.64122 5.421448 15.57619       4.293469 22.24748       9.148553 13.69183       4.862170 35.49948 10.09685 30.59078 6.707544 4.908699       12.12178 
1 1 1 -18 28 27 o 37.32403 4.296914 18.44139       3.837008 14.76827       6.781715 20.17083       4.653450 29.68730 8.768276 38.46597 5.089082 -8.778667      10.13812 
1 1 1 -18 28 28 o 11.64266 5.384863 -1.854133      3.599514 -5.051323      6.143458 -0.1828225     4.441783 13.67784 6.538416 14.10053 6.305997 -0.4226856     9.083859 
1 1 1 -18 28 29 o 12.03712 5.375047 -0.3811331     3.214158 -6.272080      5.715301 2.343801       3.887089 12.56901 6.083287 15.52408 6.386402 -2.955070      8.820006 
1 1 1 -18 28 30 o 15.65845 6.348212 2.664252       3.772534 6.637498       10.24756 2.041350       4.057489 21.54118 9.609690 15.29928 6.427618 6.241899       11.56116 
1 1 1 -18 28 31 o 28.68156 6.164819 12.34607       4.180516 8.465587       6.623472 14.91556       5.389715 22.06594 8.580961 30.38070 7.358751 -8.314758      11.30416 
1 1 1 -18 29 1  o 21.31998 5.767438 6.086110       3.068330 2.679098       4.984457 8.164884       3.893451 18.15597 7.319836 24.49830 6.438590 -6.342333      9.748611 
1 1 1 -18 29 2  o 37.04871 5.334823 17.89338       4.677820 0.000000       0.000000 17.89338       4.677820 ?        ?        37.04871 5.334823 0.000000       5.334823 
1 1 1 -18 29 3  o 24.11530 6.107762 7.837085       3.592605 2.848804       6.158432 10.41039       4.423240 19.61843 8.051190 27.64656 6.647495 -8.028137      10.44083 
1 1 1 -18 29 4  o 48.95964 3.852296 30.14144       4.559148 31.05350       8.678123 29.79375       5.358161 47.60031 7.747550 48.35888 4.602192 -0.7585678     9.011365 
1 1 1 -18 29 5  o 22.63202 7.007986 6.855602       4.260714 13.95427       7.349986 3.262851       5.228915 31.14300 9.109538 19.05053 7.558570 12.09248       11.83705 
1 1 1 -18 29 6  o 61.78601 3.425526 47.59922       5.137481 49.40582       10.33424 47.00618       5.920975 60.75703 7.114417 61.14926 3.995314 -0.3922348     8.159501 
1 1 1 -18 29 7  o 17.54347 6.412749 3.453594       3.571609 11.27296       8.286211 1.669369       3.958174 28.40791 9.830454 15.91144 6.483327 12.49646       11.77588 
1 1 1 -18 29 8  o 23.86458 6.852809 7.723774       4.194621 19.56283       8.251179 3.597845       4.871004 36.76545 9.225647 19.01877 7.369034 17.74668       11.80742 
1 1 1 -18 29 9  o 40.51206 4.917541 21.11318       4.755474 27.75001       9.156846 18.66209       5.564753 44.24939 8.801704 37.42421 6.327073 6.825180       10.83983 
1 1 1 -18 29 10 o 15.39230 6.351800 1.324107       3.860836 3.694981       7.806829 0.5565147      4.442074 21.79902 9.017409 15.54655 6.636437 6.252474       11.19625 
1 1 1 -18 29 11 o 18.07035 7.086686 3.062962       4.548665 0.000000       0.000000 3.062962       4.548665 ?        ?        18.07035 7.086686 0.000000       7.086686 
1 1 1 -18 29 12 o 20.99402 7.064426 5.718759       4.273721 0.4841115      8.007352 7.803884       5.053721 19.81433 8.681425 23.93272 7.662775 -4.118385      11.57952 
1 1 1 -18 29 13 o 58.10125 4.014211 42.63495       5.648640 36.44106       8.564968 47.40267       7.514485 51.92418 6.942758 60.61543 5.135499 -8.691250      8.635695 
1 1 1 -18 29 14 o 26.53263 6.679131 9.712300       4.314888 14.65829       10.47607 8.701811       4.735194 30.96030 11.02641 24.99397 7.311998 5.966331       13.23053 
1 1 1 -18 29 15 o 21.02835 6.854830 5.908526       4.032826 4.164765       5.987341 7.356605       5.456152 20.32934 8.080993 23.29259 7.980290 -2.963255      11.35727 
1 1 1 -18 29 16 o 59.12532 3.504880 43.94411       5.027242 36.28095       8.371877 48.26569       6.286952 51.55551 6.831620 61.55851 4.216445 -10.00299      8.028041 
1 1 1 -18 29 17 f 40.14555 4.313503 20.73201       4.153797 23.36143       7.545886 19.58884       4.975479 40.31094 7.964158 38.41542 5.469182 1.895519       9.661251 
1 1 1 -18 29 18 o 21.97769 6.445842 6.697023       3.675794 14.65146       6.932043 3.585542       4.335510 31.10879 8.769029 18.10334 6.968734 13.00545       11.20085 
1 1 1 -18 29 19 o 27.85682 5.779562 10.61005       3.794695 7.829659       6.455544 12.07797       4.690645 23.67606 8.626511 29.26150 6.719985 -5.585440      10.93503 
1 1 1 -18 29 20 o 45.50866 3.880638 26.47937       4.262595 22.32890       7.346737 28.58559       5.233566 38.95778 8.006463 46.83115 4.647160 -7.873363      9.257404 
1 1 1 -18 29 21 o 40.04834 4.728431 21.08256       4.525763 19.87795       10.83564 21.33711       4.981046 33.37250 11.24873 39.97155 5.239718 -6.599049      12.40922 
1 1 1 -18 29 22 o 40.35616 4.260421 21.18683       4.126684 21.06620       7.099573 21.24838       5.071384 37.44830 8.021325 39.69872 5.380584 -2.250420      9.658796 
1 1 1 -18 29 23 o 48.71656 4.717302 31.34529       5.530241 44.33585       10.99047 26.94099       6.399418 53.52815 8.725857 44.00717 6.133791 9.520985       10.66602 
1 1 1 -18 29 24 o 17.31857 6.892250 3.276377       4.360315 18.48386       8.717339 -1.797889      5.035491 32.37657 10.02385 14.08417 6.461305 18.29241       11.92585 
1 1 1 -18 29 25 o 9.840771 4.680032 -3.181646      3.064653 -2.887591      5.513230 -3.313137      3.686722 14.03281 6.549180 10.97663 5.194715 3.056183       8.359236 
1 1 1 -18 29 26 o 29.00028 5.326805 11.73934       3.625799 10.76522       6.610278 12.15854       4.336330 25.21758 8.777236 28.77837 6.353467 -3.560791      10.83542 
1 1 1 -18 29 27 o 21.49809 6.802838 7.045397       3.992690 7.941397       6.034639 6.347792       5.324782 22.21017 8.296269 20.54789 7.767885 1.662273       11.36522 
1 1 1 -18 29 28 o 20.59241 6.361832 6.384139       3.513579 4.649924       6.343443 7.151661       4.220065 19.21121 8.051744 21.43438 7.013754 -2.223171      10.67817 
1 1 1 -18 29 29 o 19.83109 6.420490 5.968110       3.541305 4.452058       6.070735 6.750102       4.359989 18.74765 7.868368 20.70960 7.132401 -1.961948      10.61990 
1 1 1 -18 30 1  o 39.84528 5.155113 20.81302       4.888341 0.000000       0.000000 20.81302       4.888341 ?        ?        39.84528 5.155113 0.000000       5.155113 
1 1 1 -18 30 2  o 26.70245 5.807304 9.654595       3.671009 3.604425       6.244701 12.84950       4.537921 20.01686 8.148169 30.67951 6.281402 -10.66265      10.28828 
1 1 1 -18 30 3  o 14.87652 5.923745 1.813955       3.222766 2.301369       5.755162 1.591292       3.889847 18.49891 7.705004 15.57846 6.396559 2.920450       10.01414 
1 1 1 -18 30 4  f 35.18445 4.815202 16.08801       4.020383 9.137280       7.187521 19.25302       4.850102 25.64582 9.133277 38.27998 5.344787 -12.63416      10.58223 
1 1 1 -18 30 5  o 26.12708 6.893499 9.492408       4.451847 18.62572       7.609451 4.739529       5.489309 35.61017 8.816177 20.50095 7.854217 15.10922       11.80736 
1 1 1 -18 30 6  o 32.50260 5.114140 13.86028       3.916993 4.789729       6.774281 18.41599       4.800918 21.52701 8.582981 37.40294 5.425413 -15.87593      10.15395 
1 1 1 -18 30 7  o 54.06713 3.666286 36.79799       4.801970 29.78065       9.437868 39.24915       5.577940 45.28418 8.869926 55.60169 4.146561 -10.31752      9.791301 
1 1 1 -18 30 8  o 18.28088 6.261972 4.207816       3.359433 2.883148       6.669483 4.658166       3.888785 19.90501 8.292886 19.25507 6.730190 0.6499481      10.68023 
1 1 1 -18 30 9  o 44.11065 4.218666 24.82722       4.479576 23.51946       8.933968 25.26644       5.177443 39.64946 9.391796 44.16771 4.892258 -4.518250      10.58962 
1 1 1 -18 30 10 o 64.62940 4.070918 52.95729       6.378911 0.000000       0.000000 52.95729       6.378911 ?        ?        64.62940 4.070918 0.000000       4.070918 
1 1 1 -18 30 11 o 15.36644 6.216242 1.779868       3.608335 -10.46917      6.870337 6.445655       4.240232 13.35691 6.511374 21.78314 7.023281 -8.426232      9.577289 
1 1 1 -18 30 12 o 33.17928 5.445035 14.63762       4.249961 10.86883       8.258368 15.99531       4.956712 27.24906 9.780217 34.34385 6.148324 -7.094795      11.55225 
1 1 1 -18 30 13 o 36.03296 5.051425 17.06042       4.313908 14.17715       8.762309 17.98287       4.956172 30.13930 10.11519 36.64181 5.738749 -6.502506      11.62972 
1 1 1 -18 30 14 o 39.08636 5.247739 20.18404       4.872253 20.22794       7.584444 20.15319       6.357584 36.87303 8.599389 37.86852 7.151391 -0.9954872     11.18445 
1 1 1 -18 30 15 o 24.36804 6.414001 8.297348       3.860010 14.04580       7.105091 5.890272       4.597682 30.30593 8.981028 20.98678 7.319132 9.319155       11.58570 
1 1 1 -18 30 16 o 25.13404 6.660312 8.926446       4.144272 8.263751       10.51058 9.048441       4.509625 25.40419 10.48145 25.15345 7.066638 0.2507420      12.64113 
1 1 1 -18 30 17 o 61.97908 3.480572 48.53437       5.235805 44.61188       8.863755 50.63651       6.488850 56.98419 6.499082 62.75566 4.268461 -5.771473      7.775463 
1 1 1 -18 30 18 o 22.86893 6.382087 7.372784       3.691299 7.491596       6.241260 7.308867       4.577772 23.09630 8.471533 22.62896 7.297602 0.4673347      11.18132 
1 1 1 -18 30 19 o 23.08401 6.276446 7.535943       3.622893 10.93287       6.391494 5.927848       4.397597 26.62558 8.625995 20.72064 7.161916 5.904940       11.21164 
1 1 1 -18 30 20 o 21.89809 7.353713 6.884749       4.631041 5.723729       10.43089 7.169786       5.168344 23.20015 10.03940 22.29989 7.761142 0.9002628      12.68955 
1 1 1 -18 30 21 o 49.37640 4.635597 32.13427       5.512542 37.23509       10.52810 30.20762       6.470406 48.25179 9.290726 46.91306 5.782010 1.338734       10.94300 
1 1 1 -18 30 22 f 16.67649 6.439651 3.202009       3.710505 -4.741067      8.015308 5.368508       4.186057 16.18561 7.659772 19.64912 6.972935 -3.463518      10.35828 
1 1 1 -18 30 23 o 25.45609 5.963998 9.287404       3.634539 10.22699       6.760407 8.905423       4.310482 24.96797 8.861253 24.34867 6.932391 0.6192932      11.25077 
1 1 1 -18 30 24 o 16.40209 6.557148 2.929937       3.964430 12.34290       6.309604 -3.210111      5.095946 27.18146 8.545305 13.22893 6.213296 13.95254       10.56538 
1 1 1 -18 30 25 o 15.38043 6.135377 2.523340       3.463268 7.116613       6.166049 0.4065002      4.185909 21.49210 8.300785 14.19825 6.246992 7.293848       10.38884 
1 1 1 -18 30 26 o 11.21516 5.189110 -1.753479      3.347256 -3.076385      5.542458 -0.9939495     4.199623 13.72856 6.457925 13.11934 5.973659 0.6092167      8.797124 
1 1 1 -18 30 27 o 24.37909 6.026510 8.841092       3.559685 12.13748       6.398161 7.363308       4.283921 26.14302 8.640251 21.62672 7.065999 4.516302       11.16164 
1 1 1 -18 30 28 o 24.86862 6.307603 9.415790       3.827668 14.67949       6.877317 7.053550       4.607181 28.24574 8.927017 20.99437 7.326367 7.251373       11.54848 
1 1 1 -18 31 1  o 14.85154 6.265946 1.055152       3.881921 0.000000       0.000000 1.055152       3.881921 ?        ?        14.85154 6.265946 0.000000       6.265946 
1 1 1 -18 31 2  o 23.11753 5.957847 7.401413       3.377402 7.346563       5.658133 7.431774       4.209610 22.93689 8.109941 22.92380 6.940988 0.1308632E-01  10.67466 
1 1 1 -18 31 3  o 23.46190 6.098732 7.642368       3.518627 8.665021       6.019877 7.111683       4.336529 24.48792 8.382633 22.49342 7.086065 1.994507       10.97638 
1 1 1 -18 31 4  f 19.94426 7.095775 5.164061       4.337355 0.6381944      6.199597 9.503170       6.070338 17.51451 7.657160 25.45877 8.416066 -7.944258      11.37815 
1 1 1 -18 31 5  o 58.58846 3.573729 43.37242       5.078074 25.44296       9.343036 50.88954       6.049648 40.43751 9.621522 63.23642 3.945444 -22.79892      10.39905 
1 1 1 -18 31 6  o 26.29707 5.838214 9.473021       3.643754 6.046669       6.857912 10.82076       4.301087 22.26615 8.710589 27.84266 6.463724 -5.576506      10.84685 
1 1 1 -18 31 7  o 43.12015 4.267859 23.92894       4.425863 15.25547       8.262944 27.41848       5.241094 31.07251 9.780420 45.89788 4.754685 -14.82537      10.87491 
1 1 1 -18 31 8  o 46.46493 3.917401 27.53351       4.394394 25.02928       8.482900 28.45201       5.137463 40.88340 8.776957 46.87918 4.554432 -5.995781      9.888267 
1 1 1 -18 31 9  o 54.30246 3.768098 37.43364       4.955365 45.52667       10.08935 34.86073       5.688785 56.81328 7.468144 51.92710 4.541272 4.886173       8.740499 
1 1 1 -18 31 10 o 40.07343 5.351466 21.33867       5.095436 0.000000       0.000000 21.33867       5.095436 ?        ?        40.07343 5.351466 0.000000       5.351466 
1 1 1 -18 31 11 o 11.76921 5.418509 -2.102433      3.585038 -3.578482      6.839929 -1.543348      4.209590 15.86139 7.366124 13.27311 6.018890 2.588285       9.512456 
1 1 1 -18 31 12 o 15.40446 6.361945 1.606431       3.877377 -3.267416      7.579395 3.334046       4.512551 16.84740 7.799762 17.91772 7.048952 -1.070318      10.51304 
1 1 1 -18 31 13 o 44.83921 4.207599 25.90631       4.543854 8.945951       8.448994 32.80780       5.389629 25.09495 9.710118 50.35012 4.437984 -25.25518      10.67624 
1 1 1 -18 31 14 o 16.69690 6.961089 1.930950       4.704030 -8.814977      8.083453 7.433405       5.784332 15.18658 7.321661 22.95865 8.191540 -7.772067      10.98672 
1 1 1 -18 31 15 f 27.44200 6.042060 10.48601       3.930953 3.541490       6.858265 13.88367       4.797142 19.97655 8.372278 31.41426 6.481556 -11.43771      10.58799 
1 1 1 -18 31 16 o 41.26338 4.391356 22.18594       4.347950 20.24710       7.323620 23.24129       5.403227 36.43613 8.417524 41.53151 5.471728 -5.095383      10.03965 
1 1 1 -18 31 17 f 38.11279 5.498974 19.69528       4.959729 15.00352       7.656174 23.08795       6.510506 30.30584 9.395825 40.23066 6.888397 -9.924822      11.65039 
1 1 1 -18 31 18 o 53.39334 5.513313 38.58002       7.070530 0.000000       0.000000 38.58002       7.070530 ?        ?        53.39334 5.513313 0.000000       5.513313 
1 1 1 -18 31 19 o 38.51760 6.735346 21.33424       6.091935 0.000000       0.000000 21.33424       6.091935 ?        ?        38.51760 6.735346 0.000000       6.735346 
1 1 1 -18 31 20 o 57.65990 4.322077 43.55816       6.028796 33.44868       10.64427 48.33299       7.315272 44.10307 10.11919 60.00299 5.049711 -15.89993      11.30918 
1 1 1 -18 31 21 o 27.05729 5.615239 10.30504       3.581061 11.24079       6.602062 9.914956       4.262609 26.03213 8.780449 25.81993 6.713056 0.2122002      11.05266 
1 1 1 -18 31 22 o 12.53118 5.523731 -0.7369935E-01 3.286906 -4.048352      5.910903 1.705506       3.954734 13.89684 6.576983 15.13232 6.350847 -1.235475      9.142755 
1 1 1 -18 31 23 o 11.74630 5.488565 -2.465186      3.890893 -1.858565      6.098188 -2.881701      5.053092 15.08497 6.988148 13.26783 6.217388 1.817146       9.353616 
1 1 1 -18 31 24 o 33.72231 5.591286 16.13322       4.433924 19.93560       7.339887 13.94835       5.563832 34.10695 8.779364 29.43469 7.677828 4.672253       11.66303 
1 1 1 -18 31 25 o 13.74111 5.877075 1.051731       3.495800 4.533912       6.353879 -0.4599084     4.186368 19.09754 8.034596 13.43141 6.054815 5.666137       10.06059 
1 1 1 -18 31 26 o 19.75044 6.442988 5.913633       3.562465 8.207098       6.502806 4.930142       4.258336 22.01395 8.518490 18.46993 6.954458 3.544018       10.99678 
1 1 1 -18 32 1  o 12.99758 5.461503 0.7939717      2.930164 1.807265       4.816790 0.1987181      3.691825 16.57850 6.986369 13.66126 5.941713 2.917243       9.171331 
1 1 1 -18 32 2  o 35.56803 4.664125 16.68482       3.945335 16.69003       6.781657 16.68216       4.850684 32.92852 8.419547 34.78963 5.934319 -1.861115      10.30072 
1 1 1 -18 32 3  o 18.50683 6.309775 4.560634       3.410101 2.634769       5.650389 5.663961       4.276789 18.19038 7.609829 20.34639 7.061297 -2.156010      10.38130 
1 1 1 -18 32 4  o 19.53726 6.418351 5.218060       3.532495 4.597517       6.332747 5.498365       4.256193 20.38814 8.239644 20.14713 7.041018 0.2410107      10.83825 
1 1 1 -18 32 5  o 12.40067 5.406847 -0.6672419E-01 3.073164 1.433710       5.450715 -0.7659559     3.720965 17.07399 7.321344 12.94901 5.782702 4.124983       9.329616 
1 1 1 -18 32 6  o 30.33992 5.344281 12.44061       3.807013 3.907856       6.488628 16.91988       4.701239 19.96996 8.236980 35.29382 5.657135 -15.32386      9.992549 
1 1 1 -18 32 7  f 15.26852 6.170292 1.948985       3.551092 0.9998847      6.469636 2.358217       4.248240 17.85819 7.814433 16.54184 6.725442 1.316349       10.31004 
1 1 1 -18 32 8  o 37.44915 4.580130 18.37641       4.092916 13.65313       7.484604 20.39143       4.888616 29.26015 9.320704 39.05001 5.271757 -9.789852      10.70826 
1 1 1 -18 32 9  o 20.15398 7.026031 5.503670       4.236596 0.000000       0.000000 5.503670       4.236596 ?        ?        20.15398 7.026031 0.000000       7.026031 
1 1 1 -18 32 10 o 24.73804 6.357639 8.674042       3.853241 15.79609       7.742685 6.329468       4.442437 31.29332 9.399909 21.26196 7.202462 10.03136       11.84203 
1 1 1 -18 32 11 o 45.77295 4.292539 27.18450       4.732189 49.72999       10.28167 21.12497       5.330320 58.93487 7.316070 39.39843 5.718789 19.53644       9.285980 
1 1 1 -18 32 12 o 14.24460 6.070639 0.7965820      3.706077 1.743497       6.863544 0.4068720      4.403152 18.61402 8.098595 14.90468 6.485645 3.709344       10.37549 
1 1 1 -18 32 13 o 27.76616 8.608516 12.08771       6.426839 8.207305       8.150686 18.46578       10.44962 23.95416 9.458152 31.95141 11.04024 -7.997250      14.53766 
1 1 1 -18 32 14 o 30.80417 6.523887 13.54496       4.744618 13.22252       8.449931 13.69343       5.733829 28.08148 9.912419 30.08151 7.768093 -2.000029      12.59362 
1 1 1 -18 32 15 o 33.45542 6.127307 15.72249       4.811390 17.99463       8.689584 14.71792       5.777930 32.26698 10.01087 31.19639 7.657931 1.070591       12.60402 
1 1 1 -18 32 16 o 24.32446 6.758415 8.695045       4.149367 2.382629       7.785772 11.19919       4.903811 19.46110 8.542563 27.31978 7.247516 -7.858681      11.20276 
1 1 1 -18 32 17 o 25.29359 6.339843 9.277744       3.899706 5.192520       7.063271 11.06907       4.677191 20.76087 8.581584 27.23053 7.007725 -6.469662      11.07934 
1 1 1 -18 32 18 o 25.34814 6.192098 9.304125       3.791585 0.7357791      6.579906 13.56358       4.639257 17.28429 7.706167 30.57924 6.429975 -13.29495      10.03641 
1 1 1 -18 32 19 o 16.22962 6.535975 2.728603       3.969292 -6.820941      11.14947 4.114583       4.247580 17.87681 8.613668 17.97584 6.903365 -0.9902954E-01 11.03865 
1 1 1 -18 32 20 o 20.51882 7.017325 6.272079       4.218392 0.7984056      11.27500 7.162982       4.548752 20.22354 9.414109 21.64661 7.288214 -1.423065      11.90561 
1 1 1 -18 32 21 o 18.03170 6.428298 4.551905       3.561442 3.310573       6.372592 5.115711       4.294744 18.45581 7.915131 18.98241 7.016199 -0.5265942     10.57716 
1 1 1 -18 32 22 o 12.50792 5.581713 -0.3210655     3.460266 -4.328162      5.957439 1.719051       4.250815 13.68014 6.511379 15.32467 6.515184 -1.644529      9.211171 
1 1 1 -18 32 23 o 41.64559 4.939689 23.87688       4.915560 18.76200       7.572115 27.60235       6.462342 32.22836 9.192210 43.34482 6.302627 -11.11646      11.14540 
1 1 1 -18 32 24 o 40.45723 4.480262 22.17667       4.343144 13.08503       7.141654 27.51249       5.471142 26.47963 9.127993 44.41242 5.150583 -17.93279      10.48088 
1 1 1 -18 33 1  o 16.28788 6.253409 3.066684       3.484750 2.768593       5.002005 3.347803       4.857531 17.36893 7.204421 17.77630 7.204702 -0.4073696     10.18879 
1 1 1 -18 33 2  o 10.65714 4.970214 -2.299986      3.166211 -2.788513      4.745949 -1.908164      4.250332 13.10008 6.101361 12.85961 5.913010 0.2404699      8.496487 
1 1 1 -18 33 3  o 13.64546 6.282736 -2.076596      4.820917 -1.207799      5.434968 -5.282866      10.44090 15.00657 6.818398 18.20589 8.652559 -3.199318      11.01623 
1 1 1 -18 33 4  o 10.43701 4.926163 -3.001909      3.274361 -4.800429      5.147316 -1.779427      4.243698 12.71177 6.051031 12.96418 5.941576 -0.2524109     8.480407 
1 1 1 -18 33 5  o 34.56194 5.444341 16.32439       4.433878 14.86652       6.884081 17.35790       5.796218 30.36646 8.797131 34.37879 7.151817 -4.012329      11.33746 
1 1 1 -18 33 6  o 19.61139 6.703288 5.339181       3.849166 2.427385       5.671216 7.826203       5.241258 17.83552 7.551601 22.92463 7.822405 -5.089117      10.87275 
1 1 1 -18 33 7  o 12.81208 5.782369 -1.048377      3.830990 7.750188       6.082694 -6.833166      4.932122 22.89112 8.368547 11.52182 5.594004 11.36930       10.06606 
1 1 1 -18 33 8  o 27.06084 6.799744 10.71461       4.477958 10.59111       7.424323 10.78524       5.614079 25.66218 9.265206 26.39977 8.020298 -0.7375908     12.25436 
1 1 1 -18 33 9  o 26.40600 6.831562 10.24175       4.429083 5.121552       7.413360 13.08382       5.523173 21.06790 8.757446 29.32524 7.649942 -8.257345      11.62818 
1 1 1 -18 33 10 o 12.50763 5.719615 -1.611743      3.903613 0.6086550      6.633303 -2.788096      4.828177 17.44591 7.760325 13.24681 6.164409 4.199097       9.910730 
1 1 1 -18 33 11 o 10.58579 5.010486 -3.249995      3.432239 5.573083       6.530363 -6.617463      4.034400 20.89444 8.394299 10.07562 4.928549 10.81883       9.734210 
1 1 1 -18 33 12 o 23.82274 7.516741 8.616481       4.877865 9.301295       7.131682 8.014495       6.686504 24.26469 9.027689 23.04439 8.706220 1.220295       12.54183 
1 1 1 -18 33 13 o 38.11115 4.762929 19.43804       4.327156 18.76377       8.812549 19.65225       4.967193 32.40901 10.08573 37.73300 5.569176 -5.323990      11.52118 
1 1 1 -18 33 14 o 44.81093 4.410805 26.51881       4.754204 25.61988       9.450597 26.82338       5.500944 38.21990 10.02463 44.44341 5.175931 -6.223511      11.28200 
1 1 1 -18 33 15 o 19.16854 6.647460 5.190804       3.789851 -11.38082      6.938687 12.23642       4.524328 12.66131 6.246526 28.84146 6.582789 -16.18015      9.074812 
1 1 1 -18 33 16 o 14.84299 6.263525 1.476408       3.880115 -2.205724      7.253186 2.952586       4.592494 16.25159 7.560260 16.99477 6.961095 -0.7431850     10.27689 
1 1 1 -18 33 17 o 46.61927 4.112584 28.60134       4.624289 24.58795       7.753704 30.81692       5.760995 38.95388 8.414430 47.53821 5.050187 -8.584328      9.813614 
1 1 1 -18 33 18 f 16.05964 6.617095 2.495354       4.181589 6.973204       10.86983 1.717563       4.530221 22.50047 9.975513 15.69711 6.701367 6.803368       12.01745 
1 1 1 -18 33 19 o 25.00167 6.410102 9.377993       3.923506 16.71079       6.974755 5.983429       4.745543 31.07710 8.808372 20.04721 7.381303 11.02988       11.49222 
1 1 1 -18 33 20 o 28.14883 5.950811 11.56236       3.954137 11.17344       7.139628 11.73443       4.748972 24.95443 9.075091 27.42678 7.062880 -2.472355      11.49963 
1 1 1 -18 33 21 o 13.06612 5.696438 0.4718105      3.410465 -4.087465      6.259099 2.397028       4.067277 14.05076 6.683930 15.68883 6.501025 -1.638063      9.324068 
1 1 1 -18 33 22 f 16.21903 6.990956 2.077055       5.019037 12.08525       11.10994 -0.4892488     5.625847 24.31546 10.43994 15.07969 6.884600 9.235766       12.50560 
1 1 1 -18 34 1  o 26.56575 5.570686 10.02159       3.490947 13.13860       5.840640 8.289155       4.354320 28.39544 8.064597 23.21392 7.065585 5.181522       10.72195 
1 1 1 -18 34 2  o 18.80614 6.934802 4.901986       4.191441 3.096369       5.419247 7.590224       6.612413 17.75366 7.441576 22.17276 8.587252 -4.419104      11.36301 
1 1 1 -18 34 3  o 22.88314 6.078444 7.632967       3.446543 18.12838       6.334857 3.220091       4.107692 34.00361 7.809753 16.84929 6.694780 17.15433       10.28651 
1 1 1 -18 34 4  o 15.08050 5.921996 2.431246       3.179986 -1.832051      5.523065 4.545404       3.889342 14.55463 6.709769 18.29332 6.691111 -3.738694      9.475863 
1 1 1 -18 34 5  o 19.95066 6.402507 5.768392       3.526605 -1.201658      6.568513 8.591269       4.180182 16.09286 7.381626 23.89111 6.834858 -7.798250      10.06000 
1 1 1 -18 34 6  o 34.35514 4.912321 16.01554       3.995650 19.13935       7.251036 14.65337       4.788218 34.10607 8.698295 31.74791 6.410122 2.358166       10.80509 
1 1 1 -18 34 7  o 34.75272 4.849982 16.34108       3.995660 16.04913       7.534297 16.45532       4.713021 30.42649 9.300717 34.12039 5.880521 -3.693903      11.00381 
1 1 1 -18 34 8  o 15.12198 6.507429 1.135418       4.335090 0.000000       0.000000 1.135418       4.335090 ?        ?        15.12198 6.507429 0.000000       6.507429 
1 1 1 -18 34 9  o 31.29065 5.455781 13.63848       4.008961 13.09185       7.358584 13.86921       4.780736 27.44527 9.269871 30.70952 6.585893 -3.264254      11.37121 
1 1 1 -18 34 10 o 37.67518 4.846187 19.19834       4.346367 20.64385       8.729438 18.72188       5.011749 33.78581 9.939964 36.42161 5.844302 -2.635803      11.53077 
1 1 1 -18 34 11 o 16.55503 6.328080 3.351990       3.557970 -3.138179      5.941922 6.979799       4.442436 14.36375 6.734504 21.48541 7.202271 -7.121661      9.860337 
1 1 1 -18 34 12 o 36.48645 6.280827 19.25948       5.383073 8.876123       7.723111 29.07017       7.507115 23.31422 9.206338 43.85377 7.279888 -20.53955      11.73684 
1 1 1 -18 34 13 o 35.94204 5.031351 17.71580       4.286247 19.75052       8.490215 17.01983       4.965476 32.78738 9.841974 34.30706 6.166026 -1.519684      11.61397 
1 1 1 -18 34 14 o 54.86298 4.031988 39.52371       5.352918 37.85408       10.60345 40.09475       6.201105 46.60501 9.654159 54.55701 4.710343 -7.952000      10.74198 
1 1 1 -18 34 15 o 46.93104 4.416596 29.42794       4.991697 18.66689       9.354823 33.71152       5.902170 30.57471 10.45016 49.72252 4.936152 -19.14781      11.55731 
1 1 1 -18 34 16 f 67.41373 4.177234 60.08800       6.828646 55.97550       11.97781 62.06830       8.311704 58.15518 8.720407 67.23505 5.111221 -9.079872      10.10792 
1 1 1 -18 34 17 o 15.57413 6.681514 1.684121       4.543824 0.000000       0.000000 1.684121       4.543824 ?        ?        15.57413 6.681514 0.000000       6.681514 
1 1 1 -18 34 18 o 13.76956 5.955276 0.8437070      3.666399 -3.023112      6.575773 2.588090       4.416628 14.86344 7.004877 16.19702 6.748291 -1.333587      9.726650 
1 1 1 -18 34 19 o 11.34792 5.259903 -1.784761      3.462166 6.227671       6.724212 -4.675109      4.038632 20.44140 8.403503 10.71681 5.168844 9.724588       9.865891 
1 1 1 -18 35 1  o 29.60207 5.247021 12.36334       3.646487 5.642847       6.114281 16.07320       4.542801 19.84930 8.069073 33.35912 5.798582 -13.50981      9.936472 
1 1 1 -18 35 2  o 49.86990 4.992242 34.22261       5.985473 34.31096       8.376410 34.13042       8.555920 46.66814 7.628817 46.20311 7.881591 0.4650345      10.96897 
1 1 1 -18 35 3  o 12.31473 5.481367 -0.2436043     3.314792 7.591205       5.872387 -3.907366      4.015726 21.71367 8.168725 11.09211 5.297956 10.62156       9.736344 
1 1 1 -18 35 4  o 14.26169 5.894731 1.722054       3.332419 1.352043       5.554125 1.930174       4.165484 16.31824 7.187213 15.40839 6.495278 0.9098568      9.687346 
1 1 1 -18 35 5  o 19.81111 6.486711 5.845356       3.609409 9.294565       6.780118 4.481276       4.263805 23.34340 8.778346 18.14195 6.929178 5.201452       11.18360 
1 1 1 -18 35 6  o 32.56083 5.323905 14.86491       4.078517 13.78524       7.296807 15.35549       4.918591 27.52974 9.230527 32.10297 6.510235 -4.573227      11.29539 
1 1 1 -18 35 7  o 12.37123 5.733753 -1.969343      4.112795 0.000000       0.000000 -1.969343      4.112795 ?        ?        12.37123 5.733753 0.000000       5.733753 
1 1 1 -18 35 8  o 16.10916 6.217644 3.170560       3.457892 6.240625       6.535779 1.977142       4.074928 20.68140 8.366181 15.38608 6.451293 5.295319       10.56467 
1 1 1 -18 35 9  o 28.14908 6.189691 11.68501       4.130095 14.56046       7.695831 10.52184       4.894670 28.00090 9.479815 25.68377 7.411079 2.317133       12.03291 
1 1 1 -18 35 10 o 41.10052 4.672467 22.90370       4.596851 8.386945       7.868439 30.42563       5.663939 22.55247 9.158946 47.07310 5.014636 -24.52063      10.44188 
1 1 1 -18 35 11 o 25.92329 7.463581 10.78137       4.969446 9.181400       6.877088 12.52978       7.189000 23.19943 8.814590 26.27630 9.152920 -3.076864      12.70720 
1 1 1 -18 35 12 o 19.68483 6.624419 5.791537       3.757921 6.449742       6.741772 5.494848       4.526315 20.81885 8.469375 19.36300 7.194343 1.455847       11.11255 
1 1 1 -18 35 13 o 20.98554 6.789649 6.761126       3.960647 0.1229655      7.338647 9.489280       4.704642 17.07814 7.821918 24.34158 7.330738 -7.263437      10.72017 
1 1 1 -18 35 14 o 27.96566 6.183757 11.62542       4.102141 4.553023       7.067725 15.21819       5.037455 19.42430 8.333165 31.58766 6.749120 -12.16335      10.72344 
1 1 1 -18 35 15 o 21.13235 6.918732 6.958045       4.106238 6.861829       7.608791 6.997582       4.877483 21.13111 8.834695 21.00400 7.518894 0.1271057      11.60110 
1 1 1 -18 35 16 o 32.81712 5.882997 15.68418       4.531909 21.63658       9.182829 13.76759       5.210682 32.64603 10.31508 29.34894 7.312551 3.297098       12.64414 
1 1 1 -18 36 1  o 13.02872 5.944422 -0.8405583     4.185536 0.2081268      5.718183 -2.050898      6.143121 15.44412 7.007965 14.66191 6.865702 0.7822170      9.810680 
1 1 1 -18 36 2  o 18.32761 6.255536 4.992413       3.351887 10.22800       6.117935 2.746758       4.006762 23.93391 8.435642 15.84412 6.497296 8.089794       10.64777 
1 1 1 -18 36 3  o 28.92891 5.624732 12.15119       3.822409 14.27519       6.858391 11.19416       4.603709 27.75984 8.930506 26.51223 7.017128 1.247606       11.35755 
1 1 1 -18 36 4  o 12.20879 5.435812 -0.1695302     3.262381 -8.960410      5.430885 4.793631       4.080690 11.15929 5.509397 18.21376 6.818392 -7.054464      8.766068 
1 1 1 -18 36 5  o 10.21217 4.846242 -2.926759      3.251420 -6.175686      5.969676 -1.556466      3.876925 12.81003 6.204068 12.15524 5.610071 0.6547899      8.364410 
1 1 1 -18 36 6  o 29.55348 5.667363 12.65585       3.933097 5.718853       6.694517 16.31241       4.860376 19.95361 8.310410 33.09401 6.255917 -13.14040      10.40189 
1 1 1 -18 36 7  o 22.19524 6.341680 7.522422       3.600908 5.677126       6.183712 8.469214       4.429386 19.78096 8.087034 22.97897 7.150253 -3.198006      10.79473 
1 1 1 -18 36 8  o 14.68335 6.091640 1.949438       3.577099 -3.576406      6.330659 4.541173       4.335557 14.28243 6.773285 18.05354 6.963723 -3.771105      9.714464 
1 1 1 -18 36 9  o 18.65725 6.718351 5.142710       3.900562 9.254883       7.267786 3.479048       4.622734 22.84505 8.958228 17.11002 6.993300 5.735033       11.36469 
1 1 1 -18 36 10 o 28.27562 7.681509 13.19715       5.429224 -2.858800      7.343017 32.55913       8.063644 15.58017 7.360739 45.25668 7.579371 -29.67651      10.56538 
1 1 1 -18 36 11 o 27.21443 6.163321 11.08717       3.992183 1.752906       7.310480 15.05364       4.765498 17.72657 7.995211 31.62522 6.403450 -13.89865      10.24342 
1 1 1 -17 0  1  o 170.7622 3.715916 356.0648       15.44647 356.0648       15.44647 356.0648       15.44647 170.7622 3.715916 170.7622 3.715916 0.000000       0.000000 
1 1 1 -17 0  2  o 43.13927 3.615427 23.16457       3.737067 23.16457       3.737067 23.16457       3.737067 43.13927 3.615427 43.13927 3.615427 0.000000       0.000000 
1 1 1 -17 0  3  f 240.5991 4.577814 706.8655       26.81844 706.8655       26.81844 706.8655       26.81844 240.5991 4.577814 240.5991 4.577814 0.000000       0.000000 
1 1 1 -17 0  4  o 60.84407 3.849322 45.67987       5.654391 45.67987       5.654391 45.67987       5.654391 60.84407 3.849322 60.84407 3.849322 0.000000       0.000000 
1 1 1 -17 0  5  f 32.11951 5.403351 13.60409       3.869921 13.60409       3.869921 13.60409       3.869921 32.11951 5.403351 32.11951 5.403351 0.000000       0.000000 
1 1 1 -17 0  6  o 365.1472 11.02514 1638.985       97.90173 1638.985       97.90173 1638.985       97.90173 365.1472 11.02514 365.1472 11.02514 0.000000       0.000000 
1 1 1 -17 0  7  o 35.21645 6.061260 16.41218       4.739819 16.41218       4.739819 16.41218       4.739819 35.21645 6.061260 35.21645 6.061260 0.000000       0.000000 
1 1 1 -17 0  8  o 45.29735 4.193395 25.65888       4.532658 25.65888       4.532658 25.65888       4.532658 45.29735 4.193395 45.29735 4.193395 0.000000       0.000000 
1 1 1 -17 0  9  o 46.12719 3.991342 26.52321       4.406055 26.52321       4.406055 26.52321       4.406055 46.12719 3.991342 46.12719 3.991342 0.000000       0.000000 
1 1 1 -17 0  10 o 111.9086 3.727858 153.2099       10.14061 153.2099       10.14061 153.2099       10.14061 111.9086 3.727858 111.9086 3.727858 0.000000       0.000000 
1 1 1 -17 0  11 o 144.3122 4.075788 254.5836       14.30760 254.5836       14.30760 254.5836       14.30760 144.3122 4.075788 144.3122 4.075788 0.000000       0.000000 
1 1 1 -17 0  12 o 15.44911 7.499595 4.288660       3.305103 4.288660       3.305103 4.288660       3.305103 15.44911 7.499595 15.44911 7.499595 0.000000       0.000000 
1 1 1 -17 0  13 o 20.45258 7.700600 6.893276       3.589691 6.893276       3.589691 6.893276       3.589691 20.45258 7.700600 20.45258 7.700600 0.000000       0.000000 
1 1 1 -17 0  14 o 287.8529 6.387112 1013.498       44.75364 1013.498       44.75364 1013.498       44.75364 287.8529 6.387112 287.8529 6.387112 0.000000       0.000000 
1 1 1 -17 0  15 o 168.3293 4.405555 346.3595       18.04362 346.3595       18.04362 346.3595       18.04362 168.3293 4.405555 168.3293 4.405555 0.000000       0.000000 
1 1 1 -17 0  16 f 101.4726 5.239615 126.6761       12.87711 126.6761       12.87711 126.6761       12.87711 101.4726 5.239615 101.4726 5.239615 0.000000       0.000000 
1 1 1 -17 0  17 o 75.79492 3.731009 70.56927       6.853065 70.56927       6.853065 70.56927       6.853065 75.79492 3.731009 75.79492 3.731009 0.000000       0.000000 
1 1 1 -17 0  18 o 47.75418 4.418441 28.52939       5.035073 28.52939       5.035073 28.52939       5.035073 47.75418 4.418441 47.75418 4.418441 0.000000       0.000000 
1 1 1 -17 0  19 o 103.2396 3.792850 130.5276       9.512925 130.5276       9.512925 130.5276       9.512925 103.2396 3.792850 103.2396 3.792850 0.000000       0.000000 
1 1 1 -17 0  20 o 73.06824 3.792555 65.64780       6.711231 65.64780       6.711231 65.64780       6.711231 73.06824 3.792555 73.06824 3.792555 0.000000       0.000000 
1 1 1 -17 0  21 o 36.59293 5.612228 17.46156       4.655258 17.46156       4.655258 17.46156       4.655258 36.59293 5.612228 36.59293 5.612228 0.000000       0.000000 
1 1 1 -17 0  22 o 23.04288 10.66243 9.515347       6.605511 9.515347       6.605511 9.515347       6.605511 23.04288 10.66243 23.04288 10.66243 0.000000       0.000000 
1 1 1 -17 0  23 o 16.00895 8.380092 4.561157       4.296271 4.561157       4.296271 4.561157       4.296271 16.00895 8.380092 16.00895 8.380092 0.000000       0.000000 
1 1 1 -17 0  24 o 65.81413 4.134541 53.48542       6.570350 53.48542       6.570350 53.48542       6.570350 65.81413 4.134541 65.81413 4.134541 0.000000       0.000000 
1 1 1 -17 0  25 o 9.988891 6.697852 -1.760296      4.566530 -1.760296      4.566530 -1.760296      4.566530 9.988891 6.697852 9.988891 6.697852 0.000000       0.000000 
1 1 1 -17 0  26 o 73.10543 4.145332 65.87028       7.330168 65.87028       7.330168 65.87028       7.330168 73.10543 4.145332 73.10543 4.145332 0.000000       0.000000 
1 1 1 -17 0  27 o 9.271242 6.282418 -2.163429      4.224149 -2.163429      4.224149 -2.163429      4.224149 9.271242 6.282418 9.271242 6.282418 0.000000       0.000000 
1 1 1 -17 0  28 o 51.72098 4.870881 33.55352       6.006668 33.55352       6.006668 33.55352       6.006668 51.72098 4.870881 51.72098 4.870881 0.000000       0.000000 
1 1 1 -17 0  29 o 84.55702 5.367354 88.54778       10.95633 88.54778       10.95633 88.54778       10.95633 84.55702 5.367354 84.55702 5.367354 0.000000       0.000000 
1 1 1 -17 0  30 o 47.57742 5.224436 28.68931       5.871494 28.68931       5.871494 28.68931       5.871494 47.57742 5.224436 47.57742 5.224436 0.000000       0.000000 
1 1 1 -17 0  31 o 94.83630 4.111118 110.5792       9.460305 110.5792       9.460305 110.5792       9.460305 94.83630 4.111118 94.83630 4.111118 0.000000       0.000000 
1 1 1 -17 0  32 o 7.721750 5.474362 -5.592478      4.308674 -5.592478      4.308674 -5.592478      4.308674 7.721750 5.474362 7.721750 5.474362 0.000000       0.000000 
1 1 1 -17 0  33 o 109.8094 4.127552 148.2757       11.00958 148.2757       11.00958 148.2757       11.00958 109.8094 4.127552 109.8094 4.127552 0.000000       0.000000 
1 1 1 -17 0  34 o 70.94059 6.871350 64.01265       11.60590 64.01265       11.60590 64.01265       11.60590 70.94059 6.871350 70.94059 6.871350 0.000000       0.000000 
1 1 1 -17 0  35 o 74.24279 4.178517 68.29729       7.504654 68.29729       7.504654 68.29729       7.504654 74.24279 4.178517 74.24279 4.178517 0.000000       0.000000 
1 1 1 -17 0  36 o 69.25041 4.350061 59.69942       7.273787 59.69942       7.273787 59.69942       7.273787 69.25041 4.350061 69.25041 4.350061 0.000000       0.000000 
1 1 1 -17 0  37 o 19.35902 9.015313 6.971632       4.726828 6.971632       4.726828 6.971632       4.726828 19.35902 9.015313 19.35902 9.015313 0.000000       0.000000 
1 1 1 -17 0  38 o 12.58514 7.728545 1.858803       4.573463 1.858803       4.573463 1.858803       4.573463 12.58514 7.728545 12.58514 7.728545 0.000000       0.000000 
1 1 1 -17 0  39 o 27.75662 8.810690 12.39485       5.242999 12.39485       5.242999 12.39485       5.242999 27.75662 8.810690 27.75662 8.810690 0.000000       0.000000 
1 1 1 -17 0  40 f 14.90377 8.441830 4.094550       4.726320 4.094550       4.726320 4.094550       4.726320 14.90377 8.441830 14.90377 8.441830 0.000000       0.000000 
1 1 1 -17 0  41 o 33.10818 8.398882 16.72882       5.858689 16.72882       5.858689 16.72882       5.858689 33.10818 8.398882 33.10818 8.398882 0.000000       0.000000 
1 1 1 -17 0  42 o 11.53537 7.448703 0.7163745      4.881279 0.7163745      4.881279 0.7163745      4.881279 11.53537 7.448703 11.53537 7.448703 0.000000       0.000000 
1 1 1 -17 0  43 o 12.89178 8.589343 -0.1541961     7.301864 -0.1541961     7.301864 -0.1541961     7.301864 12.89178 8.589343 12.89178 8.589343 0.000000       0.000000 
1 1 1 -17 0  44 o 22.30540 9.748550 10.17921       5.512264 10.17921       5.512264 10.17921       5.512264 22.30540 9.748550 22.30540 9.748550 0.000000       0.000000 
1 1 1 -17 0  45 o 16.68818 9.174791 6.361469       5.384841 6.361469       5.384841 6.361469       5.384841 16.68818 9.174791 16.68818 9.174791 0.000000       0.000000 
1 1 1 -17 0  46 o 9.008651 6.332841 -4.184992      5.382052 -4.184992      5.382052 -4.184992      5.382052 9.008651 6.332841 9.008651 6.332841 0.000000       0.000000 
1 1 1 -17 0  47 o 9.889936 6.811543 -1.997369      5.425807 -1.997369      5.425807 -1.997369      5.425807 9.889936 6.811543 9.889936 6.811543 0.000000       0.000000 
1 1 1 -17 1  1  o 276.9022 3.605814 935.5585       24.33132 949.0151       34.67008 922.4987       34.15507 278.6894 5.105030 274.7690 5.100953 3.920380       7.216720 
1 1 1 -17 1  2  o 321.9448 4.064224 1265.112       31.88564 1226.760       44.19720 1306.738       46.04581 316.7549 5.725789 326.9065 5.780035 -10.15161      8.135937 
1 1 1 -17 1  3  o 127.9514 2.502775 199.6088       7.803745 191.6571       12.13926 205.2094       10.18778 125.2515 3.982221 129.7062 3.223168 -4.454712      5.123172 
1 1 1 -17 1  4  o 141.4839 2.898962 244.1156       9.995068 233.6835       13.92507 255.2018       14.35506 138.3045 4.136312 144.5425 4.079508 -6.238007      5.809600 
1 1 1 -17 1  5  o 183.4534 3.740593 410.6547       16.72254 396.2935       27.84313 418.7581       20.91492 179.8636 6.362432 185.1259 4.639759 -5.262253      7.874510 
1 1 1 -17 1  6  o 205.2805 4.024695 514.2989       20.13339 525.2092       34.66090 508.7432       24.73395 207.0072 6.880532 204.0804 4.973430 2.926849       8.489802 
1 1 1 -17 1  7  o 353.4596 6.181245 1528.161       53.24168 1560.263       66.29777 1469.856       89.34876 356.7928 7.625121 345.1869 10.63449 11.60590       13.08567 
1 1 1 -17 1  8  o 83.09410 2.863833 84.29940       5.790344 83.12748       7.311618 86.27074       9.483004 82.46159 3.647553 83.92405 4.655091 -1.462456      5.913926 
1 1 1 -17 1  9  o 71.17036 2.531863 61.83580       4.384127 63.29152       6.313227 60.47995       6.092829 71.93372 3.613062 70.31724 3.567322 1.616486       5.077402 
1 1 1 -17 1  10 o 40.44183 2.969082 20.05373       2.905704 23.40866       4.247401 17.10227       3.983824 43.60808 4.042902 37.15728 4.490654 6.450802       6.042435 
1 1 1 -17 1  11 o 70.87684 2.512211 61.32684       4.332206 65.07449       6.278781 57.92159       5.985094 72.94625 3.542720 68.80750 3.581763 4.138748       5.037846 
1 1 1 -17 1  12 o 272.4400 4.310271 906.2120       28.61618 856.8802       39.20994 962.4335       41.85855 264.6553 6.079663 280.4742 6.124281 -15.81897      8.629549 
1 1 1 -17 1  13 f 204.3150 3.487383 509.3357       17.36345 494.6912       24.25559 524.7280       24.86707 201.2163 4.946665 207.2377 4.924020 -6.021347      6.979647 
1 1 1 -17 1  14 o 181.1108 3.240667 400.1580       14.30260 419.6712       20.81077 382.6906       19.68962 185.3572 4.607258 176.9473 4.570049 8.409897       6.489389 
1 1 1 -17 1  15 o 93.05305 2.561311 105.6680       5.802509 110.4966       8.350196 101.1591       8.069001 95.08562 3.610234 90.97037 3.647245 4.115250       5.131879 
1 1 1 -17 1  16 o 110.1872 3.065122 148.2250       8.222295 149.6292       10.16677 145.5701       13.97961 110.6524 3.775919 108.9839 5.279471 1.668503       6.490792 
1 1 1 -17 1  17 o 241.8627 4.555943 714.7179       26.85242 706.3774       46.31324 718.9416       32.95750 239.6516 7.941251 242.4106 5.579131 -2.759033      9.705162 
1 1 1 -17 1  18 o 61.26372 2.755959 45.87210       4.103920 47.81525       6.020873 44.18591       5.608666 62.44941 3.977017 60.03461 3.854091 2.414803       5.538112 
1 1 1 -17 1  19 o 85.54207 2.633539 89.33372       5.483249 91.08817       7.888765 87.69385       7.626835 86.29205 3.760505 84.67085 3.705333 1.621208       5.279289 
1 1 1 -17 1  20 o 134.4777 2.850916 220.6229       9.342669 214.7992       13.20083 226.4673       13.22426 132.5405 4.092012 136.1075 3.991375 -3.567032      5.716261 
1 1 1 -17 1  21 f 175.1839 3.228500 374.5681       13.78260 367.0983       19.43567 382.1244       19.54789 173.2156 4.608531 176.7378 4.542494 -3.522263      6.470921 
1 1 1 -17 1  22 o 121.1473 4.041744 179.5280       11.91544 191.7046       17.55148 169.1183       16.22817 124.9430 5.780213 117.3501 5.691767 7.592949       8.112156 
1 1 1 -17 1  23 o 99.91090 2.722817 121.8819       6.623116 129.6614       9.657965 114.9754       9.099927 102.9468 3.856605 96.93256 3.860126 6.014236       5.456553 
1 1 1 -17 1  24 o 252.0848 4.767054 777.7148       29.28417 762.7789       50.67841 785.2020       35.88095 248.3721 8.385082 253.0218 5.819289 -4.649750      10.20655 
1 1 1 -17 1  25 o 182.3047 3.347017 405.9016       14.86935 409.8436       21.21309 402.0940       20.84851 182.9071 4.763289 181.1760 4.726168 1.731094       6.710111 
1 1 1 -17 1  26 o 60.28848 3.148315 44.50720       4.609365 42.40163       6.519612 46.61150       6.517640 58.67281 4.596498 61.56318 4.372899 -2.890369      6.344292 
1 1 1 -17 1  27 o 139.1822 3.508892 236.9100       11.89168 238.3994       14.51035 233.8638       20.75211 139.4948 4.273624 137.7447 6.198196 1.750153       7.528712 
1 1 1 -17 1  28 o 35.96956 4.238869 16.05747       3.644267 14.48825       5.133540 17.65169       5.174246 33.74027 6.479027 37.45148 5.861549 -3.711212      8.737021 
1 1 1 -17 1  29 o 141.1420 4.121541 244.2138       14.16077 268.3940       20.84380 223.4868       19.29810 147.5342 5.808951 134.5815 5.898606 12.95274       8.278735 
1 1 1 -17 1  30 o 53.16476 3.376032 34.71570       4.351284 30.32978       6.058545 39.38824       6.253367 49.40918 5.105256 56.46531 4.583998 -7.056129      6.861245 
1 1 1 -17 1  31 f 69.47063 3.016626 59.13437       5.094744 62.30849       7.369868 56.22912       7.050829 71.11864 4.272155 67.54119 4.306290 3.577454       6.065924 
1 1 1 -17 1  32 o 82.03862 2.903768 82.44505       5.796035 82.55743       8.232000 82.33456       8.162109 81.87023 4.139566 81.76572 4.109504 0.1045074      5.833012 
1 1 1 -17 1  33 o 67.83156 3.029672 56.47680       4.995353 53.81054       7.020361 59.21116       7.109475 65.93887 4.394072 69.21915 4.235054 -3.280281      6.102749 
1 1 1 -17 1  34 o 149.4233 4.706304 276.6209       17.11561 270.8748       24.12947 282.4397       24.28151 146.5711 6.773907 149.7490 6.670636 -3.177841      9.507008 
1 1 1 -17 1  35 o 128.8340 3.019440 203.8439       9.479667 206.0497       13.51490 201.7076       13.30023 128.9371 4.307338 127.5815 4.284023 1.355576       6.075032 
1 1 1 -17 1  36 o 42.58010 3.797315 22.60054       3.898909 21.05029       5.574481 24.08519       5.455232 40.47253 5.819157 43.53837 5.247360 -3.065838      7.835648 
1 1 1 -17 1  37 o 48.22534 3.574024 28.96133       4.170337 25.83735       5.907952 32.06382       5.887594 44.86543 5.519895 50.31155 4.862666 -5.446121      7.356274 
1 1 1 -17 1  38 o 28.39015 5.263057 10.54279       3.507131 10.98998       4.961753 10.09630       4.957913 28.35474 7.175869 27.15417 7.325147 1.200571       10.25431 
1 1 1 -17 1  39 o 40.88658 4.071897 21.22684       4.003202 20.63975       5.653184 21.81734       5.669617 39.37072 6.088568 40.59586 5.903983 -1.225132      8.481018 
1 1 1 -17 1  40 o 21.84271 6.328668 6.567194       3.562555 4.809771       5.005614 8.371155       5.071457 20.04515 7.541643 24.29365 7.664337 -4.248493      10.75260 
1 1 1 -17 1  41 o 16.93295 6.340692 3.346905       3.529440 9.625575       5.159400 -2.175655      4.838778 25.50779 7.675734 13.78367 6.327291 11.72412       9.947437 
1 1 1 -17 1  42 o 18.43036 6.560964 4.512170       3.708682 6.559314       5.205896 2.402558       5.284728 21.46073 7.757076 17.45429 7.334429 4.006437       10.67549 
1 1 1 -17 1  43 o 16.86063 7.192095 2.082870       5.210253 2.700553       7.160366 1.387794       7.595710 18.89877 8.246391 18.44593 8.248034 0.4528465      11.66332 
1 1 1 -17 1  44 o 12.70123 5.687656 -0.3920439     3.626146 0.8911456      5.215010 -1.593162      5.045482 15.66826 6.929848 13.88763 6.406162 1.780635       9.437251 
1 1 1 -17 1  45 o 17.33170 6.556650 4.248724       3.795227 8.428313       5.561644 0.6063451      5.191931 22.10405 8.013836 15.13988 6.790709 6.964170       10.50406 
1 1 1 -17 1  46 f 12.49549 5.698925 -0.6617229     3.842183 -10.05367      5.439406 8.690693       5.427945 10.67213 5.310974 21.98934 7.924404 -11.31720      9.539529 
1 1 1 -17 1  47 o 12.54849 5.703997 -0.3375552     3.808646 -0.2536327     5.484609 -0.4157156     5.292978 14.44120 6.667796 14.17144 6.545743 0.2697535      9.343781 
1 1 1 -17 2  1  o 85.85915 2.173205 89.92510       4.543328 95.20312       6.430797 84.66531       6.419691 88.30019 2.992920 83.25264 3.170109 5.047554       4.359721 
1 1 1 -17 2  2  o 313.4862 3.975963 1199.433       30.37364 1203.387       43.03191 1195.507       42.87814 313.7369 5.628451 312.7083 5.626785 1.028595       7.958653 
1 1 1 -17 2  3  o 241.9518 3.950029 714.4545       23.28978 697.9551       44.95335 720.5081       27.22907 238.4643 7.746030 242.9040 4.600046 -4.439667      9.008963 
1 1 1 -17 2  4  o 250.8052 4.054789 767.7471       24.78225 795.3431       49.54903 758.5407       28.61906 254.5249 7.998493 249.2226 4.712288 5.302322       9.283402 
1 1 1 -17 2  5  o 209.8835 4.078966 537.6558       20.86241 546.9177       35.85548 532.9153       25.65161 211.2236 6.975462 208.8623 5.039859 2.361343       8.605652 
1 1 1 -17 2  6  o 303.4274 4.714718 1124.353       34.86155 1121.259       49.32696 1127.440       49.27643 302.6621 6.687906 303.5005 6.662600 -0.8383484     9.440250 
1 1 1 -17 2  7  o 363.8944 5.502838 1618.460       48.79756 1693.635       71.13366 1551.636       67.06616 371.6540 7.854168 355.7662 7.735754 15.88779       11.02406 
1 1 1 -17 2  8  o 222.0278 4.266353 601.7760       23.08342 597.4697       28.38120 610.1918       39.67615 221.1235 5.266958 223.0535 7.309224 -1.929993      9.009195 
1 1 1 -17 2  9  o 324.4167 4.979202 1285.675       39.36399 1285.533       55.84670 1285.816       55.49315 323.9746 7.073762 324.0211 7.027972 -0.4647827E-01 9.971484 
1 1 1 -17 2  10 o 269.2100 4.269186 884.7534       28.00737 923.1448       40.72525 850.3023       38.57869 274.7175 6.083330 263.6695 6.004149 11.04800       8.547322 
1 1 1 -17 2  11 o 284.2573 4.457037 986.6288       30.87407 983.3844       43.74213 989.8497       43.58337 283.4828 6.331945 284.4215 6.288140 -0.9387817     8.923801 
1 1 1 -17 2  12 o 248.5452 4.013518 754.0305       24.30897 795.3620       35.60916 717.9586       33.26645 255.0312 5.729707 242.3185 5.633570 12.71263       8.035337 
1 1 1 -17 2  13 o 84.31475 2.966620 86.81311       6.085895 88.02190       7.570457 84.60478       10.23246 84.85054 3.669945 83.05242 5.080122 1.798119       6.267068 
1 1 1 -17 2  14 o 75.43950 2.549927 69.47576       4.680993 66.97839       6.758573 71.77821       6.489472 73.98486 3.760999 76.61855 3.484799 -2.633698      5.127274 
1 1 1 -17 2  15 o 96.81301 3.010483 114.4394       7.093782 111.3151       8.717174 120.5648       12.20570 95.42524 3.755999 99.18886 5.066464 -3.763618      6.306868 
1 1 1 -17 2  16 o 222.5408 3.713789 604.4929       20.14017 622.4970       29.10934 587.9603       27.89448 225.6255 5.294293 219.2882 5.219956 6.337341       7.434883 
1 1 1 -17 2  17 o 138.4385 3.264860 233.8493       11.01431 257.7113       20.26392 223.8435       13.12194 145.0022 5.746105 135.3393 3.983006 9.662949       6.991570 
1 1 1 -17 2  18 o 211.0279 4.135358 543.9122       21.26616 596.5982       39.04244 521.6866       25.35806 220.3407 7.281201 206.5515 5.037924 13.78915       8.854184 
1 1 1 -17 2  19 o 157.4573 3.041699 302.4979       11.67119 310.3286       16.92558 295.3990       16.11533 159.3086 4.363928 155.4396 4.258442 3.868988       6.097393 
1 1 1 -17 2  20 o 149.3005 2.974109 271.9718       10.82067 282.3097       15.78263 262.8022       14.86413 151.9422 4.266727 146.6071 4.164750 5.335190       5.962391 
1 1 1 -17 2  21 o 175.0379 3.733373 374.1631       15.92464 346.5374       27.28501 388.4349       19.61133 167.9013 6.681933 178.1936 4.519905 -10.29237      8.067080 
1 1 1 -17 2  22 o 74.26186 3.292204 67.45280       5.943028 72.64839       7.512393 58.76259       9.715730 77.00502 4.017238 69.00131 5.832637 8.003708       7.082222 
1 1 1 -17 2  23 o 171.0581 4.599397 358.1643       19.15519 349.3307       27.12894 366.9467       27.05029 168.5213 6.618923 172.7684 6.436228 -4.247025      9.232289 
1 1 1 -17 2  24 o 154.8899 3.072500 292.8577       11.59715 291.4368       16.62706 294.2037       16.18362 154.2976 4.426589 155.0512 4.287277 -0.7535400     6.162421 
1 1 1 -17 2  25 o 70.84004 2.868970 61.35154       4.942441 65.42751       7.315396 57.92851       6.703903 73.03208 4.127235 68.71786 4.020904 4.314217       5.762095 
1 1 1 -17 2  26 o 34.79562 4.277011 15.03437       3.550405 7.185212       5.087843 22.48434       4.956782 24.28966 7.678477 42.56925 4.865528 -18.27959      9.090235 
1 1 1 -17 2  27 o 141.5740 3.019135 244.7763       10.41603 236.4313       14.71152 253.1644       14.74953 138.9014 4.351619 143.7623 4.214695 -4.860931      6.058073 
1 1 1 -17 2  28 o 94.79148 3.363772 109.9597       7.757880 109.5544       9.388355 110.8324       13.77499 94.51900 4.085650 94.72288 5.998416 -0.2038803     7.257654 
1 1 1 -17 2  29 o 36.91126 5.279946 17.07533       4.614113 15.54739       6.519698 18.60856       6.531000 34.71566 7.886715 38.15360 7.290089 -3.437946      10.73991 
1 1 1 -17 2  30 o 28.47542 5.341182 10.29683       3.570213 10.10942       5.173016 10.46729       4.933577 28.03394 7.446939 28.50224 7.123404 -0.4683037     10.30533 
1 1 1 -17 2  31 o 122.0935 2.948747 182.2896       8.773367 204.1036       13.10884 164.5909       11.80774 128.8919 4.179043 115.7276 4.193848 13.16434       5.920537 
1 1 1 -17 2  32 o 47.50758 3.550297 27.82245       4.080485 24.30399       5.758509 31.37080       5.782922 44.01109 5.488154 50.23898 4.781144 -6.227886      7.278680 
1 1 1 -17 2  33 o 55.49795 3.972555 38.07100       5.337048 45.97746       10.82467 35.53171       6.134510 59.98239 7.574054 53.43689 4.760679 6.545494       8.945970 
1 1 1 -17 2  34 o 109.2573 3.444594 146.8399       9.159713 143.0254       10.99349 155.4996       16.56426 107.5789 4.201536 111.3093 6.130346 -3.730347      7.431961 
1 1 1 -17 2  35 o 25.67973 5.322928 8.522192       3.221524 10.86972       4.562224 6.187591       4.549649 28.77259 6.641314 22.30111 7.281565 6.471489       9.855366 
1 1 1 -17 2  36 o 26.35198 5.474410 9.034146       3.400500 9.181368       4.900669 8.897443       4.722352 26.28324 7.360436 25.89508 7.215631 0.3881588      10.30734 
1 1 1 -17 2  37 o 37.81331 4.179804 18.02577       3.787346 20.59066       5.562609 15.80927       5.171035 39.82564 5.910701 34.63557 6.360928 5.190075       8.683190 
1 1 1 -17 2  38 o 16.17682 6.019884 2.744711       3.171462 0.6696218      4.505275 4.783088       4.465243 15.80173 6.712272 20.06069 7.192610 -4.258965      9.838101 
1 1 1 -17 2  39 o 36.98624 4.716209 17.65167       4.154225 15.33347       5.390572 21.04185       6.518855 33.44815 6.844268 39.18298 7.087973 -5.734825      9.853089 
1 1 1 -17 2  40 o 25.68793 5.910604 9.033319       3.623005 9.113098       5.282758 8.962472       4.978200 25.19759 7.803535 25.05030 7.540115 0.1472855      10.85120 
1 1 1 -17 2  41 o 36.11335 4.744958 17.19782       4.074843 15.39074       5.954834 18.78914       5.588037 32.24847 7.686682 36.63726 6.496795 -4.388786      10.06446 
1 1 1 -17 2  42 o 18.26781 6.432071 4.452615       3.556220 5.296324       5.120582 3.666525       4.942644 20.04174 7.608104 18.27734 7.316586 1.764393       10.55536 
1 1 1 -17 2  43 o 20.12998 7.801724 5.566220       5.460952 2.571169       7.212564 9.589736       8.359697 18.83852 8.246979 24.15761 9.566005 -5.319084      12.63017 
1 1 1 -17 2  44 o 30.73401 5.567072 13.46265       4.016009 12.65334       5.880646 14.16998       5.497666 27.39073 8.183759 29.72209 7.570619 -2.331362      11.14846 
1 1 1 -17 2  45 o 12.41733 5.644597 -0.7345294     3.730178 -5.041071      5.142302 4.048136       5.419114 12.09909 5.834774 17.86455 7.461463 -5.765464      9.471960 
1 1 1 -17 2  46 o 19.64937 6.766490 6.245969       3.924069 6.053551       5.636041 6.427003       5.466773 19.30245 7.783042 19.63821 7.748459 -0.3357677     10.98246 
1 1 1 -17 3  1  o 223.1819 4.338922 608.1729       23.59810 696.1048       44.08567 572.8605       27.93746 238.1406 7.606508 216.4957 5.295434 21.64484       9.268256 
1 1 1 -17 3  2  o 91.21014 3.088035 101.5865       6.853851 0.000000       0.000000 101.5865       6.853851 ?        ?        91.21014 3.088035 0.000000       3.088035 
1 1 1 -17 3  3  o 220.5993 4.240910 594.0795       22.79813 599.0067       38.83442 591.4883       28.16172 220.9960 7.220706 220.0055 5.252783 0.9904938      8.929184 
1 1 1 -17 3  4  o 140.6750 2.880002 241.3335       9.872922 241.0146       14.06902 241.6428       13.85820 140.4585 4.114795 140.6476 4.047534 -0.1890411     5.771835 
1 1 1 -17 3  5  o 162.0995 2.763063 320.4161       10.91462 351.2192       18.10020 302.8154       13.68205 169.5540 4.384334 157.5430 3.563821 12.01100       5.650062 
1 1 1 -17 3  6  o 371.1681 5.602744 1684.064       50.67661 1671.364       71.51440 1696.874       71.82168 369.1597 7.949561 371.9743 7.923308 -2.814606      11.22383 
1 1 1 -17 3  7  o 81.96493 2.559092 81.99352       5.105258 86.65019       7.548337 78.06742       6.930957 84.19009 3.688156 79.91248 3.568117 4.277618       5.131662 
1 1 1 -17 3  8  f 405.5594 6.058520 2011.754       59.87660 2062.604       86.22070 1964.387       83.21582 409.8482 8.632813 400.0052 8.536977 9.842987       12.14106 
1 1 1 -17 3  9  o 258.8055 4.791871 818.0909       30.22141 827.4761       37.48455 800.6600       51.08475 260.1218 5.913430 255.3065 8.221668 4.815338       10.12741 
1 1 1 -17 3  10 o 235.6543 3.863692 677.7161       22.18778 691.6484       31.97125 664.7715       30.81710 237.8680 5.515533 233.2131 5.422538 4.654861       7.734664 
1 1 1 -17 3  11 o 51.87714 2.743558 32.90967       3.456046 34.19617       5.194582 31.88794       4.629290 52.77330 4.070686 50.98125 3.752509 1.792053       5.536407 
1 1 1 -17 3  12 o 228.0761 4.372027 635.1772       24.29958 637.0098       29.91403 631.6220       41.66446 228.2798 5.377388 226.8343 7.547901 1.445541       9.267529 
1 1 1 -17 3  13 o 181.7456 3.251076 402.9638       14.39883 412.1361       20.84605 394.5949       19.91207 183.6250 4.662377 179.6857 4.551102 3.939270       6.515388 
1 1 1 -17 3  14 o 201.0050 4.024027 493.2482       19.71078 484.7873       24.04438 510.5841       34.41743 199.1736 4.953881 204.0007 6.933334 -4.827103      8.521271 
1 1 1 -17 3  15 o 290.4866 5.261500 1031.698       37.24533 1043.899       46.07989 1008.706       63.25614 291.9409 6.477096 286.1205 9.083816 5.820496       11.15654 
1 1 1 -17 3  16 o 214.7290 3.623794 562.7607       18.96227 578.9910       27.51253 548.0745       26.17112 217.6100 5.188187 211.7366 5.072129 5.873367       7.255604 
1 1 1 -17 3  17 o 166.8499 3.585707 339.7914       14.57931 322.7487       25.20206 348.3637       17.87371 162.1825 6.389201 168.8171 4.348346 -6.634583      7.728519 
1 1 1 -17 3  18 o 125.6302 2.795758 192.5198       8.559133 192.4873       12.46176 192.5488       11.77619 125.4752 4.080969 125.5183 3.854577 -0.4308319E-01 5.613562 
1 1 1 -17 3  19 o 110.6979 2.695989 149.4701       7.272666 144.5143       10.52083 154.0055       10.06454 108.7059 3.978266 112.2521 3.684276 -3.546234      5.422222 
1 1 1 -17 3  20 o 193.3529 3.428466 456.3578       16.15424 476.3357       23.73648 439.1210       22.04795 197.2837 4.941185 189.4426 4.779707 7.841034       6.874657 
1 1 1 -17 3  21 o 166.6037 3.637935 338.9431       14.76983 330.0691       26.05496 343.1451       17.92878 163.8815 6.537275 167.4917 4.396398 -3.610245      7.878089 
1 1 1 -17 3  22 o 40.36733 4.173956 20.12588       4.046796 33.69007       9.280021 16.94080       4.496891 51.79484 7.576434 36.85152 5.147767 14.94331       9.159796 
1 1 1 -17 3  23 o 65.22234 3.410556 52.08443       5.401893 52.85668       6.738003 50.69513       9.037507 65.61992 4.236295 64.03859 5.855974 1.581329       7.227630 
1 1 1 -17 3  24 o 216.7975 3.711775 574.2512       19.60975 601.8989       28.75605 550.2175       26.81078 221.6354 5.324195 211.9359 5.191212 9.699524       7.436110 
1 1 1 -17 3  25 o 198.9626 3.529467 483.6201       17.11263 487.1408       24.58803 480.3127       23.83152 199.3418 5.065720 198.0293 4.938398 1.312515       7.074553 
1 1 1 -17 3  26 o 113.5372 2.851312 157.4627       7.882706 155.8416       11.38596 158.9550       10.92404 112.7920 4.149506 113.9443 3.940113 -1.152298      5.722140 
1 1 1 -17 3  27 o 132.2608 2.953093 213.6147       9.517970 211.9144       13.61934 215.2378       13.30698 131.5089 4.255364 132.5596 4.124403 -1.050705      5.926114 
1 1 1 -17 3  28 f 32.88378 5.047264 13.56941       3.915583 10.26266       5.008073 18.76976       6.280393 28.28247 7.237250 38.42009 6.964365 -10.13761      10.04391 
1 1 1 -17 3  29 o 65.76796 5.674980 53.62627       9.006373 53.62627       9.006373 0.000000       0.000000 65.76796 5.674980 ?        ?        0.000000       5.674980 
1 1 1 -17 3  30 o 101.9088 2.890217 127.0261       7.170334 132.1907       10.57517 122.6315       9.755159 103.7450 4.191594 99.95083 4.013246 3.794189       5.803068 
1 1 1 -17 3  31 o 135.9518 3.041347 226.0883       10.07597 225.9453       14.47582 226.2226       14.03362 135.5531 4.388035 135.6747 4.249821 -0.1215515     6.108669 
1 1 1 -17 3  32 o 121.6142 2.960348 181.0038       8.773305 179.9473       12.65837 181.9805       12.17065 120.8891 4.303760 121.6262 4.112214 -0.7370758     5.952534 
1 1 1 -17 3  33 o 120.0175 3.474632 176.9483       10.15154 189.5647       19.47879 172.2438       11.89458 122.9814 6.522927 118.2094 4.135522 4.771912       7.723414 
1 1 1 -17 3  34 o 39.05170 4.967374 19.20557       4.620356 18.57597       5.541948 20.64070       8.367051 38.06499 6.186730 39.30548 8.938138 -1.240486      10.87042 
1 1 1 -17 3  35 o 50.26113 3.379014 31.23129       4.114598 31.06770       5.921558 31.38401       5.721441 49.72132 4.952979 50.03671 4.749102 -0.3153877     6.861922 
1 1 1 -17 3  36 o 27.31403 5.355278 9.673809       3.437084 12.22087       5.073763 7.513660       4.672530 30.30275 7.010255 23.99171 7.322566 6.311039       10.13724 
1 1 1 -17 3  37 o 40.66238 3.851826 20.72178       3.771263 21.74479       5.530912 19.83289       5.155588 41.02131 5.685537 39.19825 5.552522 1.823067       7.947064 
1 1 1 -17 3  38 f 14.11001 5.731267 1.247593       3.081648 3.668766       4.478231 -0.9301689     4.247161 18.74574 7.115201 14.06564 6.235765 4.680102       9.461018 
1 1 1 -17 3  39 o 22.30639 6.600098 6.760964       3.839663 12.03960       5.068244 -0.3499918     5.882484 29.40948 7.143651 16.77815 7.392928 12.63133       10.28043 
1 1 1 -17 3  40 o 16.30998 6.251196 2.779316       3.478240 3.222235       5.026744 2.372444       4.817851 18.40424 7.374762 17.38366 7.126183 1.020580       10.25522 
1 1 1 -17 3  41 o 27.33972 5.939437 10.39682       3.843666 19.42667       5.691971 2.827643       5.211306 37.22377 6.511929 17.94334 7.389500 19.28043       9.849361 
1 1 1 -17 3  42 o 51.56812 3.914350 34.32023       4.882259 35.34256       6.958453 33.32896       6.851894 50.78560 5.722067 49.20866 5.826838 1.576942       8.166645 
1 1 1 -17 3  43 o 21.18085 8.013202 6.585413       5.668899 6.911399       8.026414 6.260945       8.007686 22.09241 9.141486 21.63578 9.055748 0.4566326      12.86753 
1 1 1 -17 3  44 o 19.08901 6.812026 5.367949       4.000303 6.704892       5.886828 4.220943       5.452653 20.83038 8.092734 18.42592 7.570327 2.404457       11.08162 
1 1 1 -17 3  45 o 17.98464 6.691983 4.775882       3.918977 1.057598       5.584763 8.383117       5.500734 15.76185 7.058337 22.01342 7.971395 -6.251577      10.64722 
1 1 1 -17 3  46 o 17.68197 6.670436 4.737613       3.921779 4.632065       5.548119 4.843016       5.544350 18.03497 7.542435 18.20845 7.571543 -0.1734734     10.68722 
1 1 1 -17 4  1  o 235.0931 3.501481 674.3482       20.05985 669.4121       25.89392 681.7570       31.72336 234.1215 4.538584 236.1408 5.512798 -2.019241      7.140706 
1 1 1 -17 4  2  o 150.1671 3.552344 275.1428       12.99948 249.0151       22.96171 287.4671       15.77011 142.4621 6.632272 153.3918 4.222892 -10.92966      7.862560 
1 1 1 -17 4  3  o 108.2903 2.802007 143.1012       7.388048 123.5096       15.86115 148.5297       8.349091 100.2408 6.528656 110.3074 3.109079 -10.06668      7.231163 
1 1 1 -17 4  4  o 275.2186 3.920584 924.4301       26.29448 917.5690       41.43751 929.0552       34.02161 273.8570 6.209173 275.7553 5.062848 -1.898346      8.011632 
1 1 1 -17 4  5  o 174.6786 2.879856 372.1062       12.25876 385.5821       19.83636 363.7793       15.59277 177.6350 4.586282 172.6634 3.705842 4.971573       5.896376 
1 1 1 -17 4  6  o 248.5408 3.618552 753.7043       21.91637 762.9435       35.04556 747.7703       28.08602 249.7957 5.757208 247.4483 4.657680 2.347382       7.405365 
1 1 1 -17 4  7  o 233.8462 3.861215 667.3438       22.00343 641.9714       30.71288 694.0988       31.53865 229.1726 5.499479 238.3048 5.430931 -9.132141      7.729119 
1 1 1 -17 4  8  o 88.25021 2.582804 95.04201       5.548502 94.72179       8.156115 95.31786       7.570144 88.02035 3.811490 88.31904 3.524412 -0.2986908     5.191236 
1 1 1 -17 4  9  o 94.69996 2.988250 109.4842       6.887457 111.9257       8.763838 105.5404       11.13827 95.69704 3.765374 92.81757 4.942194 2.879478       6.213157 
1 1 1 -17 4  10 o 365.8134 5.536623 1635.948       49.35609 1548.247       67.55523 1736.358       72.28462 355.2920 7.802567 376.2312 7.884152 -20.93924      11.09234 
1 1 1 -17 4  11 o 75.01561 3.075366 68.75317       5.609998 61.78529       6.943254 81.85575       9.521180 71.03220 4.027680 81.71903 4.802309 -10.68683      6.267725 
1 1 1 -17 4  12 o 284.3344 4.467604 987.3169       30.95567 971.9716       43.62313 1002.882       43.93439 281.7880 6.352700 286.2448 6.298410 -4.456848      8.945768 
1 1 1 -17 4  13 f 232.8563 3.841882 661.8207       21.80058 631.8305       30.30235 693.9976       31.38765 227.3156 5.470296 238.2461 5.406260 -10.93050      7.691020 
1 1 1 -17 4  14 f 40.58216 3.780482 20.27511       3.695677 19.75230       4.877144 20.98009       5.663525 39.87294 5.138750 41.00569 5.831931 -1.132748      7.772913 
1 1 1 -17 4  15 o 54.82542 2.768816 36.75309       3.687262 34.38092       5.695086 38.46515       4.838221 52.86660 4.462243 56.02879 3.561991 -3.162193      5.709588 
1 1 1 -17 4  16 o 224.5618 3.745655 615.5678       20.49744 612.6711       29.26934 618.3556       28.71416 223.8166 5.366418 224.8722 5.239914 -1.055603      7.500343 
1 1 1 -17 4  17 o 179.2329 3.738725 392.1736       16.32967 345.6100       27.35047 417.9668       20.35605 167.7678 6.703403 184.9513 4.516479 -17.18347      8.082957 
1 1 1 -17 4  18 o 115.1217 3.098774 161.8205       8.685364 158.7954       15.74429 163.1438       10.41317 113.7544 5.697752 115.5400 3.703188 -1.785622      6.795438 
1 1 1 -17 4  19 o 119.8499 2.751361 175.2178       8.035659 166.5427       11.58321 183.2662       11.15704 116.6948 4.079528 122.4553 3.743221 -5.760521      5.536628 
1 1 1 -17 4  20 o 209.8976 4.156297 538.2811       21.25935 542.2115       37.91734 536.4791       25.67446 209.9075 7.424348 209.4128 5.031087 0.4946289      8.968432 
1 1 1 -17 4  21 o 85.01376 3.662813 88.42223       7.570420 0.000000       0.000000 88.42223       7.570420 ?        ?        85.01376 3.662813 0.000000       3.662813 
1 1 1 -17 4  22 o 93.87312 2.730457 107.6038       6.239516 105.3562       9.282678 109.4563       8.427235 92.75832 4.116875 94.59737 3.662615 -1.839058      5.510300 
1 1 1 -17 4  23 o 235.1130 4.555666 676.1471       26.10146 673.4454       32.12241 681.3976       44.78058 234.4057 5.623461 235.0127 7.830133 -0.6069489     9.640244 
1 1 1 -17 4  24 o 119.2264 2.832800 173.4812       8.230464 173.2281       12.11160 173.6984       11.21887 118.9532 4.184720 119.1556 3.868784 -0.2024536     5.699068 
1 1 1 -17 4  25 o 136.5775 2.957028 227.7141       9.841715 226.3919       14.26204 228.9161       13.59825 135.9680 4.309804 136.7594 4.084857 -0.7913666     5.938053 
1 1 1 -17 4  26 o 98.70621 2.810462 119.0312       6.753300 122.7470       10.02559 115.9446       9.137313 100.0839 4.119445 97.30055 3.861271 2.783386       5.646171 
1 1 1 -17 4  27 o 63.57737 3.087264 49.48722       4.768833 52.88068       7.134523 46.74666       6.411556 65.55671 4.493094 61.64621 4.294826 3.910500       6.215579 
1 1 1 -17 4  28 o 114.5345 3.324867 160.4730       9.270151 171.3404       11.99433 144.3513       14.60891 118.2202 4.169930 108.2322 5.557530 9.988029       6.947982 
1 1 1 -17 4  29 o 155.3773 3.572756 295.3835       13.52779 316.1544       24.14179 285.8765       16.33283 159.9644 6.204895 152.6319 4.395748 7.332504       7.604165 
1 1 1 -17 4  30 o 88.53600 2.941753 95.92173       6.338095 97.28833       9.242235 94.70844       8.708404 88.95382 4.276123 87.79910 4.081336 1.154724       5.911221 
1 1 1 -17 4  31 o 219.6793 3.838036 591.7803       20.54633 585.9295       29.16151 597.5479       28.95340 217.7948 5.498875 220.0619 5.399065 -2.267044      7.706331 
1 1 1 -17 4  32 o 13.23200 5.657127 -0.5443717E-01 3.236758 -9.968407      4.798397 8.222947       4.384489 10.66872 5.250159 25.26133 6.919625 -14.59261      8.685930 
1 1 1 -17 4  33 o 33.00764 5.497839 13.86853       4.266767 16.50261       9.171941 13.14106       4.820079 35.19850 10.14142 31.89238 6.424345 3.306114       12.00502 
1 1 1 -17 4  34 o 52.16714 4.092838 33.77684       5.161413 31.27201       6.209446 39.37633       9.284045 49.90540 5.181176 55.42947 7.031205 -5.524075      8.733981 
1 1 1 -17 4  35 f 59.57028 3.219672 43.77609       4.656509 39.17675       6.695607 48.08435       6.480268 55.86344 4.970266 62.14801 4.305490 -6.284576      6.575773 
1 1 1 -17 4  36 o 74.65885 3.067123 68.74763       5.568302 67.61333       8.087711 69.76987       7.677806 73.51414 4.536695 74.80836 4.228857 -1.294220      6.202002 
1 1 1 -17 4  37 o 20.23224 6.057494 5.327740       3.219309 8.219103       4.628100 2.617204       4.481042 24.77074 7.223833 17.72886 7.008916 7.041880       10.06522 
1 1 1 -17 4  38 o 33.01313 4.706007 14.02196       3.678896 6.409238       5.191713 21.69973       5.213847 22.41392 7.779959 40.91574 5.357755 -18.50182      9.446338 
1 1 1 -17 4  39 o 21.55121 6.775539 6.253928       3.966709 2.878728       5.105176 11.39604       6.301326 18.37623 7.408192 28.12172 8.487256 -9.745489      11.26565 
1 1 1 -17 4  40 o 12.97890 5.639938 -0.2193749E-01 3.320209 -3.172252      4.904192 2.643878       4.511340 13.42100 6.234335 17.28123 6.964980 -3.860227      9.347613 
1 1 1 -17 4  41 o 53.93375 3.737190 37.14430       4.881438 41.54840       7.032250 33.04883       6.781374 55.87315 5.225433 49.36427 5.744461 6.508884       7.765564 
1 1 1 -17 4  42 f 54.24451 3.745409 37.81163       4.920585 35.79778       6.886120 39.91274       7.033744 51.17645 5.613674 54.28417 5.388171 -3.107727      7.781113 
1 1 1 -17 4  43 o 48.02703 6.184981 32.87350       7.070825 22.16195       9.643819 45.32599       10.39803 34.15456 10.53771 53.75723 8.196280 -19.60266      13.35000 
1 1 1 -17 4  44 o 28.91744 6.245711 12.43951       4.272380 13.45969       6.223810 11.53037       5.875352 27.88929 8.438725 25.94366 8.257425 1.945627       11.80666 
1 1 1 -17 4  45 o 15.26200 6.375657 2.320901       3.957780 9.324809       5.945566 -3.252136      5.303578 22.78954 8.282439 13.06451 6.196817 9.725037       10.34405 
1 1 1 -17 4  46 o 24.12091 6.747489 9.529142       4.120841 15.79523       6.226214 4.644619       5.497143 29.25036 8.332892 17.99062 7.514618 11.25974       11.22081 
1 1 1 -17 5  1  o 289.6212 4.105494 1024.019       28.97556 1022.714       45.78276 1024.890       37.42453 289.0156 6.500468 289.5570 5.303787 -0.5414429     8.389650 
1 1 1 -17 5  2  o 65.71919 2.491923 52.73706       3.983598 50.94496       6.130605 54.04668       5.240785 64.48775 3.919636 66.48296 3.244617 -1.995209      5.088329 
1 1 1 -17 5  3  o 314.8567 4.925382 1211.142       37.79105 1218.202       77.24595 1208.921       43.33067 314.2726 10.09944 314.4341 5.654963 -0.1614380     11.57486 
1 1 1 -17 5  4  o 181.8354 3.294171 403.3453       14.59690 416.1841       21.25364 391.8826       20.08239 184.5307 4.730279 179.0731 4.605848 5.457626       6.602226 
1 1 1 -17 5  5  o 83.69897 2.328030 85.47441       4.743761 90.91226       7.807414 82.29206       5.972664 86.23431 3.724054 82.08783 2.990747 4.146484       4.776311 
1 1 1 -17 5  6  o 28.65430 3.535764 10.16938       2.416621 10.32917       3.976461 10.07581       3.043058 28.53935 5.912223 28.37127 4.555604 0.1680756      7.463773 
1 1 1 -17 5  7  o 224.9024 3.760674 617.2432       20.61085 601.5947       29.07772 633.0442       29.21907 221.8566 5.378384 227.5961 5.268239 -5.739487      7.528702 
1 1 1 -17 5  8  o 116.4628 2.710337 165.3964       7.692132 167.4964       11.33688 163.6048       10.47125 117.0789 3.979336 115.7304 3.717738 1.348480       5.445796 
1 1 1 -17 5  9  o 249.5548 4.048705 760.1823       24.62170 794.7316       36.10838 730.1577       33.66100 254.9203 5.812561 244.3689 5.652558 10.55135       8.107853 
1 1 1 -17 5  10 o 197.8529 4.002208 477.8232       19.29649 479.0532       23.91094 475.5258       32.67650 197.9511 4.960723 196.9263 6.819485 1.024780       8.432920 
1 1 1 -17 5  11 o 246.9579 4.009539 744.4734       24.12978 770.0374       35.16618 721.7287       33.17052 250.9189 5.751164 242.9439 5.602864 7.974960       8.029195 
1 1 1 -17 5  12 o 134.6183 2.819545 221.0140       9.249521 232.7286       13.80215 211.4641       12.46188 138.0068 4.108602 131.5650 3.891209 6.441757       5.658809 
1 1 1 -17 5  13 o 87.90729 3.050887 94.37701       6.525718 99.74347       8.483300 86.59892       10.21309 90.31341 3.863502 84.02938 5.010328 6.284027       6.326929 
1 1 1 -17 5  14 o 74.66653 2.595373 68.06847       4.715210 68.25760       7.261179 67.93056       6.200385 74.66522 4.005393 74.53445 3.422838 0.1307678      5.268681 
1 1 1 -17 5  15 o 163.3335 3.082053 325.4531       12.26737 343.8700       18.28613 310.3817       16.54204 167.7180 4.478111 159.3611 4.263449 8.356903       6.183080 
1 1 1 -17 5  16 o 175.6336 3.207732 376.3752       13.72909 403.5755       20.59811 354.6319       18.41631 181.6716 4.656530 170.3199 4.440907 11.35165       6.434666 
1 1 1 -17 5  17 o 34.95991 3.653166 15.08153       3.066375 12.92039       5.041306 16.35060       3.863173 31.87311 6.703452 36.31140 4.459336 -4.438293      8.051208 
1 1 1 -17 5  18 o 86.89199 2.962978 92.22032       6.264817 73.86982       11.19512 100.5869       7.559257 77.43341 5.979142 90.71662 3.425603 -13.28321      6.890928 
1 1 1 -17 5  19 o 81.91557 3.005491 81.98309       5.989369 91.41103       11.82990 78.73345       6.945301 86.22012 5.661690 80.22842 3.561315 5.991707       6.688625 
1 1 1 -17 5  20 o 34.39602 4.327031 14.68492       3.546814 15.32654       8.243675 14.53917       3.929067 34.66310 9.485457 34.14046 4.859696 0.5226364      10.65789 
1 1 1 -17 5  21 o 163.5124 3.137956 326.3153       12.50355 329.7385       18.26239 323.2947       17.15491 164.1505 4.569853 162.5728 4.334033 1.577698       6.298205 
1 1 1 -17 5  22 o 191.7530 3.924107 449.2550       18.33661 451.1072       32.43897 448.3853       22.22864 191.4566 6.964417 191.4418 4.764748 0.1480103E-01  8.438360 
1 1 1 -17 5  23 o 116.0860 3.304659 164.6727       9.338997 171.0166       11.88103 154.4154       15.10744 118.2078 4.130855 112.1107 5.547002 6.097054       6.916155 
1 1 1 -17 5  24 o 138.4507 2.960850 233.9786       9.989584 226.2452       14.39946 241.1540       13.87021 135.9331 4.352563 140.3889 4.058545 -4.455780      5.951184 
1 1 1 -17 5  25 o 142.7530 3.006305 248.7987       10.45814 255.3795       15.47241 243.2632       14.19065 144.3968 4.402220 140.9700 4.135321 3.426788       6.039903 
1 1 1 -17 5  26 o 138.2139 2.981090 233.2658       10.04067 248.0111       15.04835 221.4337       13.48005 142.2768 4.345381 134.4684 4.118579 7.808380       5.987072 
1 1 1 -17 5  27 o 63.91174 3.066098 50.00680       4.761395 52.76263       7.387772 48.04878       6.227244 65.45552 4.662120 62.52512 4.109792 2.930397       6.214962 
1 1 1 -17 5  28 o 50.70078 3.993879 31.65982       4.894710 33.11514       6.555008 29.82567       7.358848 51.65910 5.281270 48.79496 6.338330 2.864132       8.250226 
1 1 1 -17 5  29 o 191.0631 3.967991 447.1425       18.47496 464.7007       32.76280 438.9561       22.37104 193.6091 6.955453 188.9967 4.861346 4.612396       8.485930 
1 1 1 -17 5  30 o 168.5798 3.289354 347.7108       13.51301 358.9889       19.85019 337.9703       18.44740 170.8369 4.772795 165.8217 4.569532 5.015121       6.607586 
1 1 1 -17 5  31 o 57.14279 3.339027 40.11998       4.629363 43.64214       6.939432 37.29549       6.214248 59.34475 4.840509 54.85947 4.693418 4.485271       6.742306 
1 1 1 -17 5  32 o 69.23360 3.692518 58.99428       6.207288 56.77285       7.695186 63.13208       10.50240 67.70435 4.693131 71.02164 6.128106 -3.317284      7.718754 
1 1 1 -17 5  33 o 93.72918 3.452900 108.0177       7.873212 96.93307       14.98920 112.2411       9.252345 87.51170 7.089369 95.40359 3.988504 -7.891884      8.134330 
1 1 1 -17 5  34 o 64.65588 3.803033 51.68283       5.965573 56.33332       7.377676 42.89918       10.13929 67.31454 4.523802 57.71580 7.377479 9.598736       8.654015 
1 1 1 -17 5  35 o 40.85719 4.056607 20.85281       3.985656 14.22626       5.798758 26.78657       5.487269 32.71548 7.441960 46.09941 4.962629 -13.38393      8.944857 
1 1 1 -17 5  36 o 12.87258 5.568531 -0.2186358     3.207035 -1.112236      4.556443 0.6586691      4.514709 14.60429 6.467499 15.97461 6.749475 -1.370318      9.347938 
1 1 1 -17 5  37 o 13.21304 5.620525 0.2553612      3.166539 0.9731755      4.567846 -0.4087224     4.393562 16.23474 6.820210 14.79029 6.456519 1.444446       9.391587 
1 1 1 -17 5  38 o 13.95737 5.810295 0.8517647      3.270184 -0.1937773E-01 4.621861 1.725080       4.627622 15.35365 6.663204 16.87254 6.957460 -1.518888      9.633512 
1 1 1 -17 5  39 o 35.10400 6.118044 16.58199       5.043514 17.91737       7.103988 15.22487       7.161573 35.16546 8.404571 32.11701 8.861854 3.048454       12.21349 
1 1 1 -17 5  40 o 38.86095 4.530514 19.61910       4.210013 16.30133       5.877082 23.11609       6.033723 33.74100 7.355708 41.18065 6.205032 -7.439644      9.623349 
1 1 1 -17 5  41 o 35.30815 4.794240 16.52837       4.018595 16.38569       5.759900 16.66369       5.609392 33.50330 7.264626 33.99096 7.005048 -0.4876518     10.09185 
1 1 1 -17 5  42 o 36.79717 4.841847 18.13900       4.236472 11.10835       5.817704 26.07610       6.181373 26.54150 8.183859 43.20837 6.034985 -16.66687      10.16841 
1 1 1 -17 5  43 o 23.71459 8.108323 9.055538       5.631968 7.048843       7.886750 11.14369       8.045224 21.98369 9.075702 25.18084 9.541632 -3.197151      13.16856 
1 1 1 -17 5  44 o 17.67083 6.670434 4.312290       3.923179 11.11943       5.948513 -0.9279672     5.219182 25.33001 8.329272 14.40606 6.597450 10.92396       10.62559 
1 1 1 -17 5  45 o 13.45316 5.921848 0.5840344      3.765460 -2.597923      5.579764 3.244946       5.102511 13.67653 6.447686 16.92372 7.164138 -3.247188      9.638336 
1 1 1 -17 5  46 o 14.31728 6.193460 1.532081       3.967206 2.024042       5.775036 1.092456       5.459227 16.18046 7.216397 15.35174 6.917943 0.8287210      9.996716 
1 1 1 -17 6  1  o 138.8771 2.644067 235.1950       8.948272 223.1998       13.78087 243.9393       11.76614 135.1400 4.189684 141.3960 3.414766 -6.255905      5.405005 
1 1 1 -17 6  2  o 245.0766 3.618603 732.9410       21.61120 772.1131       35.25599 709.3631       27.35253 251.2487 5.758284 240.9825 4.657747 10.26619       7.406243 
1 1 1 -17 6  3  o 154.9468 3.056747 292.8416       11.54193 291.0200       16.54695 294.5677       16.10742 154.3136 4.404761 155.2670 4.261097 -0.9534454     6.128529 
1 1 1 -17 6  4  o 281.4898 4.505414 967.6519       30.90534 1068.542       67.17711 940.5651       34.80766 294.5455 9.370997 277.4257 5.148634 17.11975       10.69224 
1 1 1 -17 6  5  o 293.9931 4.137907 1055.131       29.64517 1102.783       48.34024 1026.406       37.53121 300.1166 6.609715 289.7849 5.314723 10.33163       8.481427 
1 1 1 -17 6  6  o 66.41833 2.398806 53.85471       3.876192 59.62804       6.620245 50.84308       4.781478 69.78772 3.908387 64.49191 3.051083 5.295807       4.958286 
1 1 1 -17 6  7  o 105.4942 2.399638 135.6878       6.168939 129.9486       9.940026 139.2832       7.867393 103.1064 3.963468 106.8199 3.025382 -3.713509      4.986182 
1 1 1 -17 6  8  o 60.48853 3.198447 44.75657       4.697880 50.19192       6.277949 37.83956       7.082116 63.99641 4.046274 55.38855 5.311983 8.607864       6.677536 
1 1 1 -17 6  9  o 236.6821 3.904846 683.7324       22.52192 681.7923       32.28882 685.5708       31.43014 236.1293 5.611334 236.8071 5.446475 -0.6777802     7.819921 
1 1 1 -17 6  10 o 156.8615 3.538510 300.2382       13.52611 304.9921       16.99393 292.0203       22.34324 157.9734 4.418760 154.3833 5.950089 3.590088       7.411410 
1 1 1 -17 6  11 o 65.85107 3.168341 53.02077       5.069379 53.46683       6.654037 52.40374       7.826097 66.04582 4.155378 65.30040 4.955040 0.7454224      6.466807 
1 1 1 -17 6  12 o 297.5941 5.389668 1082.881       39.08610 1126.481       49.32776 1009.320       64.07199 303.2422 6.675222 286.2069 9.198485 17.03525       11.36533 
1 1 1 -17 6  13 o 126.5280 2.767061 195.2506       8.531816 212.5115       13.05446 182.3807       11.27237 131.8674 4.067288 122.1776 3.790649 9.689804       5.559843 
1 1 1 -17 6  14 o 75.26074 2.609710 69.15795       4.779023 72.09653       7.495532 67.14516       6.203448 76.73848 4.022278 74.09828 3.444920 2.640198       5.295866 
1 1 1 -17 6  15 o 26.24228 4.530888 8.652802       2.792777 9.071328       4.874795 8.448321       3.407387 26.76007 7.282465 25.78590 5.584483 0.9741669      9.177186 
1 1 1 -17 6  16 o 103.9386 2.653781 131.8455       6.716184 133.7403       10.18694 130.3886       8.932452 104.5756 4.004801 103.2956 3.553859 1.279991       5.354283 
1 1 1 -17 6  17 o 186.2950 3.343138 423.5515       15.17719 405.1620       21.59764 441.4921       21.33241 181.9770 4.874669 190.0627 4.605819 -8.085709      6.706412 
1 1 1 -17 6  18 o 24.53305 5.811559 7.666203       3.420650 0.000000       0.000000 7.666203       3.420650 ?        ?        24.53305 5.811559 0.000000       5.811559 
1 1 1 -17 6  19 o 82.58166 3.049363 83.32906       6.126077 84.64748       12.10352 82.87498       7.103099 82.89749 6.032770 82.31490 3.549402 0.5825882      6.999469 
1 1 1 -17 6  20 o 20.50447 5.690087 5.301775       2.943209 3.424160       5.120964 6.227922       3.596568 19.96435 7.601385 22.25984 6.330578 -2.295490      9.892283 
1 1 1 -17 6  21 o 47.79224 3.265810 28.01165       3.780652 29.36077       6.119396 27.17881       4.808010 48.69530 5.239190 46.96574 4.246799 1.729557       6.744213 
1 1 1 -17 6  22 o 102.0183 2.751320 127.0807       6.833739 126.6051       10.31855 127.4523       9.120664 101.6875 4.172904 102.0834 3.672345 -0.3958740     5.558709 
1 1 1 -17 6  23 o 133.5027 3.467148 217.8223       11.27018 214.6313       14.10893 223.4481       18.73368 132.4012 4.378891 134.8700 5.712897 -2.468781      7.198047 
1 1 1 -17 6  24 o 142.7773 3.020243 248.8619       10.50842 248.0289       15.43122 249.5822       14.34992 142.3090 4.455198 142.8061 4.127838 -0.4970245     6.073535 
1 1 1 -17 6  25 o 225.7703 3.830896 623.1513       21.07674 620.0776       30.25594 626.0492       29.37749 224.8082 5.522840 225.9402 5.335622 -1.132004      7.679233 
1 1 1 -17 6  26 o 44.64014 3.626242 24.51891       3.910798 19.15827       6.121851 28.21490       5.083241 38.90240 6.699285 47.80509 4.413248 -8.902683      8.022292 
1 1 1 -17 6  27 o 135.6777 3.500238 225.1871       11.56323 230.7798       14.74611 216.2570       18.63338 137.1936 4.416453 132.5036 5.784632 4.690063       7.277844 
1 1 1 -17 6  28 o 111.7436 3.388718 152.8163       9.217054 140.9778       11.47084 174.3864       15.48364 107.1592 4.402051 118.9957 5.353272 -11.83643      6.930770 
1 1 1 -17 6  29 o 92.61656 3.255338 105.0281       7.335759 105.8359       12.94322 104.6458       8.903919 92.49341 5.771183 92.33879 3.966201 0.1546173      7.002665 
1 1 1 -17 6  30 o 33.17511 4.690970 13.78812       3.686692 14.65085       5.603178 13.12950       4.895687 33.74174 7.042367 32.00152 6.499869 1.740219       9.583488 
1 1 1 -17 6  31 o 56.21909 3.324677 38.84332       4.534463 41.53265       6.958846 36.85883       5.977779 57.83950 4.985771 54.55410 4.537560 3.285397       6.741466 
1 1 1 -17 6  32 o 52.90860 3.512573 34.49290       4.503205 38.47589       7.026535 31.71664       5.866325 55.52779 5.255251 50.46862 4.828709 5.059170       7.136813 
1 1 1 -17 6  33 o 126.8108 4.483013 198.8560       13.83180 199.0074       21.10516 198.7420       18.31291 125.5954 6.922479 126.0588 5.978435 -0.4633408     9.146715 
1 1 1 -17 6  34 o 45.56465 4.397056 25.92223       4.821743 27.92010       6.082875 22.54467       7.909106 47.02427 5.406497 41.28160 8.151415 5.742676       9.781399 
1 1 1 -17 6  35 o 96.57413 2.956893 114.7405       6.950572 121.4762       10.27632 109.0607       9.436484 98.85850 4.275782 93.71845 4.142125 5.140045       5.953109 
1 1 1 -17 6  36 o 64.49584 3.197994 51.43867       5.010589 51.36248       7.297856 51.50663       6.891664 63.90157 4.719801 64.10685 4.438883 -0.2052803     6.479213 
1 1 1 -17 6  37 o 32.92109 4.794185 13.90976       3.733242 12.70751       5.439156 14.98061       5.133312 30.51477 7.393175 33.53474 6.516394 -3.019966      9.855071 
1 1 1 -17 6  38 o 27.72160 5.617648 10.21211       3.664828 10.99130       5.196899 9.441279       5.168912 28.11272 7.462380 26.09032 7.641415 2.022402       10.68075 
1 1 1 -17 6  39 o 23.84977 7.412041 7.924041       4.761286 10.76727       6.274449 4.064167       7.310657 27.24767 8.515044 21.28076 8.756878 5.966917       12.21429 
1 1 1 -17 6  40 o 32.18982 5.082182 13.77658       3.854479 10.60085       5.536939 16.76264       5.369050 26.79317 7.925221 34.66196 6.597291 -7.868793      10.31181 
1 1 1 -17 6  41 o 31.36673 5.380270 13.38447       3.964543 16.69156       5.641821 10.15845       5.572246 33.92988 7.053768 25.82945 8.017027 8.100431       10.67841 
1 1 1 -17 6  42 o 18.04058 6.543024 4.303453       3.707935 2.406113       5.152386 6.341702       5.340284 17.19515 7.234758 21.07303 7.817360 -3.877880      10.65142 
1 1 1 -17 6  43 o 33.10172 7.460865 17.02333       5.873858 20.67042       8.671053 13.93048       7.985064 33.47906 9.921529 27.53797 9.642718 5.941086       13.83542 
1 1 1 -17 6  44 o 21.77439 6.863175 7.441900       4.067504 17.65581       6.035677 -1.056289      5.505456 32.98241 7.656992 14.61533 6.723723 18.36708       10.19009 
1 1 1 -17 6  45 o 47.55731 4.323455 30.78141       4.955827 34.77430       7.536122 27.73899       6.578310 47.33348 6.722284 42.43523 6.573824 4.898247       9.402354 
1 1 1 -17 6  46 o 26.57716 6.740077 11.53344       4.370941 10.52576       6.521534 12.35528       5.889552 23.00612 8.618172 25.51373 8.281494 -2.507601      11.95224 
1 1 1 -17 7  1  o 151.5943 2.750922 280.2707       10.16242 280.6765       16.13798 280.0040       13.08205 151.5331 4.374822 151.4754 3.544031 0.5763245E-01  5.630207 
1 1 1 -17 7  2  o 92.30132 2.445297 103.9535       5.495317 104.1706       8.746817 103.8119       7.063395 92.29697 3.897671 92.19534 3.148518 0.1016388      5.010489 
1 1 1 -17 7  3  o 238.4760 3.548589 693.9716       20.62228 696.7864       32.85240 692.1412       26.49197 238.6873 5.648090 238.0453 4.566870 0.6420593      7.263417 
1 1 1 -17 7  4  o 147.2662 3.052804 264.5353       10.95565 286.8857       24.69205 259.0569       12.22483 152.9098 6.642367 145.7118 3.442803 7.198044       7.481573 
1 1 1 -17 7  5  o 107.0366 2.800494 139.8171       7.298435 114.1004       15.92012 146.6601       8.212255 96.27274 6.830242 109.6087 3.077595 -13.33593      7.491582 
1 1 1 -17 7  6  o 205.2524 3.548000 514.0578       17.74631 521.6376       25.71519 507.1654       24.52148 206.5998 5.107681 203.7335 4.939104 2.866257       7.105150 
1 1 1 -17 7  7  o 70.66576 2.737191 60.98861       4.704659 57.78617       6.939588 63.71233       6.399917 68.67236 4.166426 72.16434 3.651145 -3.491974      5.539853 
1 1 1 -17 7  8  o 240.7320 3.554605 707.1504       20.85265 713.5892       33.49934 703.0771       26.64412 241.5485 5.691095 239.9244 4.557126 1.624130       7.290813 
1 1 1 -17 7  9  o 277.2428 4.402874 938.6789       29.74628 969.6082       43.40107 911.2787       40.84993 281.4318 6.328360 272.8723 6.143215 8.559479       8.819707 
1 1 1 -17 7  10 o 170.0402 4.642028 353.4679       19.21715 353.4679       19.21715 0.000000       0.000000 170.0402 4.642028 ?        ?        0.000000       4.642028 
1 1 1 -17 7  11 o 226.1444 4.421166 624.6161       24.36457 581.4153       28.91766 730.3273       45.23535 218.0501 5.442153 243.8450 7.621871 -25.79494      9.365358 
1 1 1 -17 7  12 o 212.9510 3.629958 553.4505       18.83724 574.7315       27.77169 535.3167       25.63605 216.8114 5.256349 209.2757 5.026855 7.535721       7.273133 
1 1 1 -17 7  13 o 113.3359 2.706608 156.6565       7.475305 168.4335       11.55425 148.1781       9.803530 117.3817 4.045336 110.1232 3.658227 7.258514       5.454115 
1 1 1 -17 7  14 o 89.44987 2.641026 97.66547       5.750594 98.65531       8.985348 96.97877       7.484072 89.78854 4.117518 89.07796 3.454264 0.7105789      5.374560 
1 1 1 -17 7  15 o 236.1829 4.546682 681.6047       26.16852 682.3800       32.54436 680.1863       44.01687 236.1346 5.655618 235.1968 7.690171 0.9378357      9.545928 
1 1 1 -17 7  16 o 138.8414 2.898253 235.1592       9.805984 239.5565       14.67119 231.6085       13.18333 139.9671 4.306460 137.6643 3.933810 2.302780       5.832706 
1 1 1 -17 7  17 o 112.7967 3.070184 155.3546       8.431267 157.7788       15.98894 154.4209       9.923017 113.3657 5.806996 112.4096 3.627214 0.9560852      6.846743 
1 1 1 -17 7  18 o 69.05908 3.536326 58.37351       5.931448 0.000000       0.000000 58.37351       5.931448 ?        ?        69.05908 3.536326 0.000000       3.536326 
1 1 1 -17 7  19 o 98.77103 3.065403 119.1631       7.369315 108.5065       13.99737 123.2496       8.667861 93.88300 6.152092 100.4103 3.547976 -6.527290      7.101857 
1 1 1 -17 7  20 o 251.0271 4.103161 769.9978       25.10009 760.1758       35.87819 779.4131       35.12749 249.0385 5.911912 252.2187 5.715230 -3.180252      8.222807 
1 1 1 -17 7  21 o 118.0434 2.806547 170.0202       8.073283 175.9721       12.29757 165.5121       10.70257 119.9128 4.214960 116.3405 3.780054 3.572266       5.661687 
1 1 1 -17 7  22 f 62.59917 2.952832 47.93106       4.491770 49.78668       7.326164 46.81337       5.685822 63.61099 4.760691 61.78496 3.794675 1.826027       6.087999 
1 1 1 -17 7  23 o 215.4469 4.322092 567.7053       22.69187 592.4944       28.85570 527.5314       36.73438 219.8721 5.385492 206.8404 7.299321 13.03163       9.071032 
1 1 1 -17 7  24 o 62.74013 3.068086 48.17425       4.676599 45.08448       7.221088 50.40640       6.137636 60.47007 4.943444 64.09019 3.949005 -3.620121      6.327106 
1 1 1 -17 7  25 o 108.5454 3.184617 144.0264       8.414628 134.0977       15.00802 148.5786       10.16216 104.3101 5.928607 110.1750 3.790654 -5.864899      7.036863 
1 1 1 -17 7  26 o 216.9774 3.753402 575.7032       19.84612 588.7969       29.02981 564.2137       27.19342 218.9984 5.439603 214.4463 5.203663 4.552078       7.527775 
1 1 1 -17 7  27 o 15.34867 6.344010 0.8163224      3.859752 0.5299052      5.348034 1.127693       5.576137 17.52172 7.371421 18.35857 7.610048 -0.8368473     10.59484 
1 1 1 -17 7  28 o 9.695783 4.646389 -4.461118      3.144555 -8.552790      5.220703 -2.131517      3.939303 11.98840 5.805112 12.93697 5.848793 -0.9485683     8.240614 
1 1 1 -17 7  29 o 30.87847 5.337993 12.06300       3.871443 24.23010       7.428757 7.526466       4.536123 43.63442 7.239998 24.40665 7.161184 19.22777       10.18333 
1 1 1 -17 7  30 o 53.68857 3.468778 35.44342       4.514024 40.67435       7.034445 31.78149       5.885656 57.24734 5.095609 50.60160 4.831630 6.645741       7.022099 
1 1 1 -17 7  31 o 92.77603 2.953520 105.4343       6.668962 101.2832       9.950883 108.8190       8.985500 90.60648 4.521061 94.06516 3.928570 -3.458679      5.989462 
1 1 1 -17 7  32 o 13.54997 5.970184 -0.9925289     3.835744 -13.03562      8.962270 1.708142       4.244092 16.00661 7.715098 16.77990 6.758136 -0.7732849     10.25647 
1 1 1 -17 7  33 o 70.22009 3.122347 60.61589       5.329558 61.78970       7.972394 59.66748       7.166172 70.51807 4.665528 69.40446 4.257540 1.113609       6.316154 
1 1 1 -17 7  34 o 138.2536 3.156600 234.8985       10.63486 251.4594       15.66537 220.7414       14.48395 142.3389 4.522019 133.3853 4.462260 8.953629       6.352986 
1 1 1 -17 7  35 o 57.65586 3.435119 41.14708       4.804499 52.02184       7.353798 33.04826       6.346189 64.42973 4.716377 51.12826 5.164205 13.30147       6.993799 
1 1 1 -17 7  36 o 39.70381 4.182751 19.83988       3.986241 16.88200       5.870028 22.37129       5.430396 35.58686 7.018327 41.74136 5.470121 -6.154499      8.898266 
1 1 1 -17 7  37 f 91.16486 3.017164 102.8151       6.693662 102.7070       9.803489 102.9096       9.161611 90.31103 4.468426 90.59492 4.160956 -0.2838974     6.105766 
1 1 1 -17 7  38 o 16.67617 6.354073 2.826216       3.579901 3.654484       5.044748 1.986024       5.080935 19.15427 7.477361 17.61106 7.278889 1.543213       10.43519 
1 1 1 -17 7  39 o 28.22303 7.128520 11.24832       4.903317 5.553333       6.640461 18.07625       7.271036 21.91790 8.572249 34.99146 8.591244 -13.07355      12.13643 
1 1 1 -17 7  40 o 32.73175 5.491576 14.46741       4.225296 12.03142       5.826651 17.16920       6.136310 28.33687 8.057259 34.34795 7.538430 -6.011080      11.03392 
1 1 1 -17 7  41 o 23.34254 6.266788 7.778914       3.639324 11.72928       5.350314 4.377265       4.964839 27.86493 7.648296 19.07566 7.426115 8.789274       10.66038 
1 1 1 -17 7  42 o 50.86878 3.899817 33.55165       4.797414 36.69512       7.009165 30.78111       6.580264 51.55143 5.673090 46.99018 5.874439 4.561256       8.166577 
1 1 1 -17 7  43 o 19.89910 7.638646 5.709411       5.199041 -2.581398      7.733884 12.54531       7.022584 16.34636 7.670149 26.60926 9.055121 -10.26290      11.86703 
1 1 1 -17 7  44 o 19.32873 6.747190 5.699342       3.907714 7.001423       5.788808 4.609266       5.296619 20.79798 8.040132 18.45192 7.506775 2.346058       10.99979 
1 1 1 -17 7  45 o 23.21926 6.835705 8.783561       4.127277 14.47748       6.306681 4.518239       5.458473 27.94052 8.503136 18.06763 7.512805 9.872894       11.34661 
1 1 1 -17 7  46 o 34.53999 5.407781 17.55221       4.402506 23.24299       6.878121 13.60258       5.730093 36.35461 7.982852 27.15165 8.070104 9.202967       11.35132 
1 1 1 -17 8  1  o 161.6138 2.844803 318.5780       11.20384 332.1760       18.16580 310.2300       14.23332 164.8337 4.526721 159.4276 3.663587 5.406113       5.823493 
1 1 1 -17 8  2  o 103.1065 2.470435 129.6318       6.207196 141.6371       10.24264 122.6638       7.803346 107.6423 3.911251 100.2202 3.199235 7.422066       5.053018 
1 1 1 -17 8  3  o 67.74974 2.519492 56.04807       4.152403 56.82845       6.775172 55.57858       5.255064 68.10016 4.101604 67.41954 3.207773 0.6806183      5.207011 
1 1 1 -17 8  4  o 235.9500 3.919717 679.6083       22.53776 661.5904       31.79574 697.8028       31.95125 232.5734 5.610127 238.8732 5.488889 -6.299713      7.848658 
1 1 1 -17 8  5  o 198.5414 3.546891 481.0255       17.16071 502.0198       37.11145 475.3155       19.35419 202.1496 7.546786 197.3164 4.025090 4.833191       8.553088 
1 1 1 -17 8  6  o 92.70521 2.719245 104.8995       6.136476 102.5403       9.071961 106.8894       8.331782 91.55521 4.076358 93.51525 3.663197 -1.960045      5.480484 
1 1 1 -17 8  7  o 296.7683 4.178940 1075.364       30.22176 1054.161       47.61214 1089.672       39.11097 293.3532 6.660252 298.5303 5.376182 -5.177094      8.559340 
1 1 1 -17 8  8  o 117.6984 3.232209 169.1312       9.261785 166.9504       11.83449 172.5779       14.87806 116.8587 4.162429 118.7094 5.155392 -1.850739      6.626001 
1 1 1 -17 8  9  o 343.7449 6.098633 1446.293       51.08635 1503.397       64.56474 1350.685       83.54233 350.0359 7.569143 330.6103 10.38228 19.42557       12.84849 
1 1 1 -17 8  10 o 164.6776 3.661759 330.9770       14.69468 313.7066       18.02586 365.1911       25.37157 160.1784 4.622857 172.6289 6.040426 -12.45050      7.606415 
1 1 1 -17 8  11 o 169.0213 3.733107 348.7016       15.37616 343.2912       19.12614 358.5883       25.85455 167.5548 4.688799 171.0233 6.213956 -3.468521      7.784477 
1 1 1 -17 8  12 o 290.4912 4.581569 1030.973       32.43272 1025.073       46.37918 1036.620       45.37102 289.2439 6.579954 290.9119 6.400013 -1.668060      9.179105 
1 1 1 -17 8  13 o 91.56532 2.664202 102.3391       5.938438 102.8755       9.317062 101.9721       7.706692 91.68628 4.181028 91.34431 3.468488 0.3419647      5.432439 
1 1 1 -17 8  14 o 141.2852 2.925161 243.5056       10.07123 254.5246       15.31473 235.1093       13.36856 144.2778 4.360863 138.7043 3.959161 5.573563       5.889998 
1 1 1 -17 8  15 o 129.1513 2.874898 203.4754       9.048100 211.3046       14.08599 197.9758       11.80577 131.4360 4.404034 127.2810 3.810516 4.154961       5.823706 
1 1 1 -17 8  16 o 162.2716 3.121794 321.3006       12.34476 339.5703       18.75238 307.3278       16.39950 166.6161 4.622994 158.5511 4.248315 8.064926       6.278556 
1 1 1 -17 8  17 o 137.5950 2.936188 230.9848       9.845153 235.0823       15.00630 227.8883       13.04509 138.6212 4.448057 136.5429 3.924575 2.078323       5.931905 
1 1 1 -17 8  18 o 247.5589 5.637851 750.5080       34.01169 0.000000       0.000000 750.5080       34.01169 ?        ?        247.5589 5.637851 0.000000       5.637851 
1 1 1 -17 8  19 o 137.8045 2.932623 231.7167       9.848176 239.0718       15.00249 226.1475       13.05464 139.7791 4.409897 136.0029 3.943115 3.776291       5.915687 
1 1 1 -17 8  20 o 118.1997 2.825671 170.4693       8.139057 172.4280       12.47554 169.0179       10.73933 118.6881 4.320572 117.5733 3.753093 1.114868       5.723028 
1 1 1 -17 8  21 o 234.1388 3.920990 669.8505       22.37202 683.1157       32.70728 658.1873       30.66867 236.0797 5.685252 231.7923 5.429500 4.287384       7.861396 
1 1 1 -17 8  22 o 28.34718 4.833383 10.10761       3.219201 12.78882       5.578741 8.769106       3.941669 31.60615 7.378041 26.20706 6.258447 5.399097       9.674897 
1 1 1 -17 8  23 o 104.9837 3.345531 134.7416       8.548075 135.6329       11.11404 133.4508       13.37519 105.2107 4.344211 104.2194 5.283656 0.9913254      6.840262 
1 1 1 -17 8  24 o 108.6266 2.838344 144.1323       7.506977 141.2104       11.35294 146.4025       10.00693 107.3383 4.349283 109.3771 3.759974 -2.038750      5.749232 
1 1 1 -17 8  25 o 161.3091 3.200037 317.8453       12.57911 299.7715       18.04601 334.9271       17.54372 156.3504 4.741855 165.3531 4.357646 -9.002640      6.440053 
1 1 1 -17 8  26 o 173.7621 3.772895 369.2708       15.97592 356.4223       27.63357 375.7213       19.57973 169.9060 6.687152 175.0560 4.593770 -5.150024      8.112997 
1 1 1 -17 8  27 o 80.34437 3.512687 79.08900       6.860886 75.46482       8.889774 84.42741       10.78928 78.30909 4.679809 82.71777 5.381728 -4.408676      7.131873 
1 1 1 -17 8  28 o 172.1723 3.325638 362.5229       13.95321 376.5949       20.88034 351.1689       18.75583 175.0381 4.900004 169.1220 4.555078 5.916122       6.690200 
1 1 1 -17 8  29 o 183.1784 3.877171 411.1823       17.30714 420.3038       30.69362 406.9301       20.95637 183.9666 6.858576 181.9159 4.731274 2.050766       8.332169 
1 1 1 -17 8  30 o 49.04728 3.602742 29.63614       4.276055 27.40540       6.542830 31.29934       5.649544 46.71938 5.876595 50.23069 4.668835 -3.511314      7.505491 
1 1 1 -17 8  31 o 49.00469 3.640924 29.62267       4.316895 24.82930       6.659291 33.09700       5.669484 44.25440 6.357221 51.64503 4.551355 -7.390629      7.818510 
1 1 1 -17 8  32 o 60.26675 3.850802 44.84782       5.625837 50.32522       12.65083 43.49760       6.281086 62.34056 8.552668 59.23299 4.382501 3.107567       9.610122 
1 1 1 -17 8  33 o 93.06114 3.488541 106.6382       7.897302 113.5315       10.29019 96.75967       12.31841 95.72509 4.423204 87.83202 5.787523 7.893074       7.284240 
1 1 1 -17 8  34 o 30.15172 5.137570 11.63780       3.639693 15.78129       5.597888 8.603333       4.790511 34.70190 6.862870 25.60039 7.314568 9.101519       10.03005 
1 1 1 -17 8  35 o 48.03292 3.688604 28.69616       4.284508 29.36978       6.645585 28.21700       5.604892 47.89530 5.812663 47.25016 4.940689 0.6451340      7.628726 
1 1 1 -17 8  36 o 70.21216 3.687765 61.33572       6.287620 65.67458       8.136643 54.90423       9.906346 72.22695 4.647517 65.12500 6.321511 7.101952       7.846076 
1 1 1 -17 8  37 o 68.51038 3.211723 58.29161       5.347122 55.19870       7.898264 60.90863       7.265275 65.80923 4.961570 69.51556 4.309979 -3.706329      6.572146 
1 1 1 -17 8  38 o 21.65027 6.991350 6.262702       4.200707 7.618834       5.358697 4.100923       6.765716 23.69334 7.909675 21.04420 8.512388 2.649143       11.61997 
1 1 1 -17 8  39 o 36.18949 5.454262 17.42770       4.660811 22.20750       7.445489 14.34772       5.976700 39.15295 8.071906 31.43926 7.830631 7.713686       11.24609 
1 1 1 -17 8  40 o 49.42673 3.937179 31.32746       4.703068 27.68167       6.725245 34.81687       6.579436 44.73925 6.346443 51.07169 5.366639 -6.332439      8.311326 
1 1 1 -17 8  41 o 45.24615 4.064580 26.54474       4.433896 26.77508       6.296023 26.31811       6.245236 43.92690 6.041511 43.53982 6.049251 0.3870850      8.549461 
1 1 1 -17 8  42 o 23.70925 6.778369 8.401813       4.112686 2.005190       6.042445 13.92275       5.613631 17.57887 7.623865 29.91959 7.665557 -12.34072      10.81129 
1 1 1 -17 8  43 o 30.01868 5.679318 12.89889       4.002421 15.80176       6.011961 10.58815       5.363874 31.16521 7.905286 25.37380 7.864071 5.791409       11.15066 
1 1 1 -17 8  44 o 23.97725 6.580434 8.999907       3.960850 16.93249       5.684885 1.516316       5.521656 32.35866 7.374149 16.08611 7.121885 16.27255       10.25180 
1 1 1 -17 8  45 o 27.77652 6.306410 11.98124       4.170849 4.013944       6.081525 19.05659       5.731011 17.87695 7.700411 34.33357 7.084866 -16.45662      10.46383 
1 1 1 -17 8  46 o 10.93764 5.168362 -2.428491      3.623348 4.937464       5.701327 -7.419339      4.692979 18.11062 7.614603 10.38178 5.124770 7.728843       9.178532 
1 1 1 -17 9  1  o 141.1795 2.708483 243.0949       9.318234 240.7298       14.90864 244.6112       11.93717 140.3136 4.365469 141.5751 3.460017 -1.261566      5.570372 
1 1 1 -17 9  2  o 225.2480 3.439127 619.1579       18.87753 601.4572       29.62990 631.2518       24.49171 221.7402 5.483398 227.3223 4.421209 -5.582169      7.043774 
1 1 1 -17 9  3  f 123.2783 2.577684 185.3325       7.743771 189.0326       12.70712 183.1467       9.766888 124.3444 4.199604 122.4734 3.275431 1.871033       5.325892 
1 1 1 -17 9  4  f 424.4783 5.692914 2204.476       58.88793 2086.640       90.06168 2292.480       77.83091 411.7224 8.976342 432.2607 7.388738 -20.53827      11.62619 
1 1 1 -17 9  5  o 233.8436 4.587329 668.0505       26.14096 695.2228       48.16827 656.7065       31.12292 237.6880 8.328933 231.7135 5.511793 5.974487       9.987541 
1 1 1 -17 9  6  o 289.0480 4.608363 1020.715       32.46032 990.5616       45.41387 1052.212       46.41412 284.3595 6.553670 293.0880 6.498542 -8.728516      9.229390 
1 1 1 -17 9  7  o 189.3261 3.448214 437.3979       15.90893 444.5262       23.06865 430.9331       21.96886 190.6452 4.969706 187.7287 4.806159 2.916473       6.913548 
1 1 1 -17 9  8  o 27.45464 4.412184 9.437538       2.851935 7.745291       5.015237 10.24627       3.467074 25.04365 7.574675 28.51341 5.180499 -3.469753      9.176779 
1 1 1 -17 9  9  o 192.4050 3.089813 451.6145       14.48721 440.3672       23.22825 458.7748       18.53361 189.7379 5.028163 193.8521 3.923316 -4.114227      6.377683 
1 1 1 -17 9  10 o 262.8258 3.811161 843.2513       24.40965 889.3161       40.42583 816.8199       30.62207 269.5031 6.155439 258.5222 4.860720 10.98099       7.843216 
1 1 1 -17 9  11 o 76.37918 3.333706 71.32004       6.190007 78.50867       8.283872 62.23148       9.314461 80.06259 4.261227 71.12631 5.414612 8.936279       6.890289 
1 1 1 -17 9  12 o 323.9283 5.018536 1282.829       39.61522 1301.883       57.31311 1265.398       54.81884 325.7386 7.220189 321.2079 7.003376 4.530731       10.05875 
1 1 1 -17 9  13 o 326.7708 5.061619 1305.668       40.30592 1260.344       56.54469 1352.486       57.46891 320.4561 7.240810 332.0086 7.103092 -11.55255      10.14314 
1 1 1 -17 9  14 f 95.15693 3.015971 110.5816       6.984816 118.1558       13.78293 107.9642       8.102287 98.07235 5.792921 93.98151 3.544116 4.090843       6.791075 
1 1 1 -17 9  15 o 292.2115 4.617200 1043.657       32.87851 1013.885       46.41433 1073.643       46.58059 287.5393 6.623976 295.9382 6.459039 -8.398926      9.251823 
1 1 1 -17 9  16 o 130.1882 2.896870 206.7780       9.190446 216.8558       14.32384 199.7262       11.98196 133.1372 4.421061 127.8288 3.850868 5.308456       5.863017 
1 1 1 -17 9  17 o 258.3220 4.818641 816.0549       30.33347 743.0846       51.20963 855.4963       37.64912 245.3873 8.576926 264.2631 5.846317 -18.87573      10.37994 
1 1 1 -17 9  18 f 169.4317 3.656030 350.5541       15.09525 336.2538       27.17554 356.9354       18.15348 165.3645 6.757961 170.8316 4.364268 -5.467041      8.044680 
1 1 1 -17 9  19 o 80.64291 2.772262 79.43745       5.439892 78.68248       8.612192 79.93864       7.016919 80.10253 4.429200 80.83087 3.571136 -0.7283401     5.689537 
1 1 1 -17 9  20 o 215.3459 3.708695 566.4457       19.46228 582.2581       28.76042 553.0878       26.43415 218.0253 5.413176 212.5561 5.103354 5.469254       7.439536 
1 1 1 -17 9  21 o 80.28474 2.831288 78.75413       5.530607 76.30602       8.716968 80.40359       7.155175 78.85036 4.555949 81.05067 3.631886 -2.200317      5.826428 
1 1 1 -17 9  22 o 139.8522 3.013301 238.7503       10.26947 229.3938       15.17272 246.6602       13.95057 136.8480 4.556116 141.9897 4.035895 -5.141754      6.086595 
1 1 1 -17 9  23 o 52.68312 4.029453 34.13378       5.133878 38.62949       7.077045 29.13998       7.458785 55.89609 5.257315 48.25903 6.508134 7.637058       8.366312 
1 1 1 -17 9  24 o 203.1898 3.603379 504.5929       17.84218 519.4600       26.47572 492.2233       24.14969 205.7327 5.285281 200.4131 4.944808 5.319611       7.237770 
1 1 1 -17 9  25 f 90.94350 2.887907 101.0890       6.392048 92.83397       9.921366 106.9471       8.357834 86.91837 4.701575 93.45543 3.677067 -6.537056      5.968721 
1 1 1 -17 9  26 o 123.6321 3.499011 187.0156       10.53114 182.9705       13.42136 193.4961       16.98758 122.1169 4.517871 125.3607 5.574702 -3.243790      7.175546 
1 1 1 -17 9  27 o 37.80178 4.239880 17.72496       3.838495 12.39169       6.312186 20.85445       4.835266 31.01434 8.220358 40.92378 4.948915 -9.909443      9.595105 
1 1 1 -17 9  28 o 155.9693 3.219731 297.4879       12.23756 293.9824       18.15895 300.4046       16.56388 154.6240 4.825138 156.4382 4.349154 -1.814224      6.495929 
1 1 1 -17 9  29 o 111.0866 3.272633 151.1408       8.849552 157.4958       16.53649 148.5903       10.47588 112.7067 6.042939 110.0221 3.913514 2.684616       7.199493 
1 1 1 -17 9  30 o 11.87434 5.348885 -1.614217      3.260098 -10.67731      5.279240 3.972372       4.144829 11.28588 5.544541 19.30730 6.928870 -8.021423      8.874187 
1 1 1 -17 9  31 o 70.58343 3.656477 61.32158       6.267850 64.87920       13.91272 60.41566       7.020674 71.23178 8.162226 69.96005 4.136522 1.271729       9.150559 
1 1 1 -17 9  32 o 74.80013 3.567072 68.91177       6.483314 78.30701       14.15686 66.41837       7.293052 78.37066 7.504276 73.30502 4.098949 5.065636       8.550763 
1 1 1 -17 9  33 o 21.24094 6.924931 5.561749       4.115671 6.204241       5.525863 4.761315       6.167777 22.98997 8.023576 22.01964 8.351994 0.9703369      11.58160 
1 1 1 -17 9  34 o 12.96800 5.619594 -0.3064316     3.277598 7.775708       5.262723 -5.427680      4.189240 24.59229 7.813653 11.31267 5.405463 13.27962       9.501168 
1 1 1 -17 9  35 o 41.13747 4.121864 21.23374       4.076466 16.45165       6.260472 24.75371       5.371158 34.98373 7.564177 44.13284 5.087225 -9.149109      9.115735 
1 1 1 -17 9  36 o 30.32030 5.236670 11.93616       3.729383 14.22162       5.635212 10.15512       4.974628 32.37027 7.316422 27.33940 7.321055 5.030870       10.35026 
1 1 1 -17 9  37 o 64.76528 3.926315 52.68137       6.167634 51.70951       8.058223 54.05592       9.583411 63.42025 5.261362 64.21453 6.201279 -0.7942848     8.132515 
1 1 1 -17 9  38 o 100.8520 3.645321 127.6315       8.944199 122.0310       11.15474 137.7156       14.96804 97.67973 4.699972 102.2375 6.034684 -4.557755      7.648996 
1 1 1 -17 9  39 o 14.95159 6.349108 0.8791540      4.028734 -0.2276700     6.627810 1.527759       5.073655 17.45473 7.761103 16.88941 7.146464 0.5653152      10.55020 
1 1 1 -17 9  40 o 23.05265 6.568024 7.595675       3.867921 9.077208       5.736187 6.360380       5.237850 24.60039 8.182821 21.45800 7.777419 3.142387       11.28923 
1 1 1 -17 9  41 o 34.32446 5.122864 15.94939       4.154041 16.81585       5.909215 15.10289       5.840785 33.51820 7.429796 31.50220 7.679178 2.015991       10.68511 
1 1 1 -17 9  42 o 16.33660 6.904272 2.089616       4.726246 0.1765270      6.762415 3.916389       6.608100 16.99246 7.674524 19.26241 8.153449 -2.269949      11.19719 
1 1 1 -17 9  43 o 19.48812 6.725246 5.683225       3.877103 3.982908       5.655936 7.190450       5.325110 18.32017 7.635036 21.27177 7.821295 -2.951593      10.93007 
1 1 1 -17 9  44 o 10.07533 4.850869 -3.971128      3.519827 -6.699007      5.246915 -1.739020      4.746233 11.58845 5.658232 13.16691 6.122026 -1.578465      8.336354 
1 1 1 -17 9  45 o 30.72244 5.992062 14.32991       4.324914 10.12664       6.722332 17.29846       5.649350 22.76003 8.698644 32.21103 7.358709 -9.451000      11.39373 
1 1 1 -17 10 1  o 349.4945 4.824040 1493.126       41.08539 1537.179       66.45090 1465.864       52.27439 353.7235 7.709050 345.9238 6.201153 7.799744       9.893622 
1 1 1 -17 10 2  o 98.96015 2.554600 119.5097       6.155397 118.1034       10.04508 120.3552       7.789121 98.24463 4.205469 99.26421 3.224306 -1.019577      5.299256 
1 1 1 -17 10 3  f 132.1567 2.970680 213.0594       9.567116 208.9705       13.78888 216.8549       13.28507 130.7235 4.334512 133.1947 4.097866 -2.471161      5.964940 
1 1 1 -17 10 4  o 298.6109 4.739135 1089.719       34.48584 1092.340       49.20781 1087.190       48.34436 298.5082 6.764593 297.8312 6.661001 0.6770020      9.493610 
1 1 1 -17 10 5  o 166.9979 3.268639 340.2835       13.30191 327.9702       18.80101 352.6249       18.82250 163.7566 4.716275 169.8264 4.552268 -6.069839      6.554875 
1 1 1 -17 10 6  o 153.7797 3.664811 288.6496       13.73368 290.0972       26.02142 288.0907       16.16908 153.6562 6.967487 153.5170 4.326393 0.1392059      8.201436 
1 1 1 -17 10 7  o 125.9490 2.579834 193.4529       7.918127 218.1965       13.80389 181.3190       9.666574 133.5948 4.245488 121.8600 3.258105 11.73473       5.351580 
1 1 1 -17 10 8  o 113.9342 2.529383 158.3000       7.022711 158.5862       11.92333 158.1479       8.689958 113.8654 4.304796 113.8107 3.136266 0.5474091E-01  5.326108 
1 1 1 -17 10 9  o 73.36066 2.475349 65.70205       4.418891 64.43478       7.946375 66.26936       5.316773 72.48241 4.521355 73.64581 2.968622 -1.163399      5.408823 
1 1 1 -17 10 10 o 160.8369 2.811109 315.5295       11.01792 329.0071       18.55541 308.1897       13.69325 164.0196 4.647043 158.9060 3.536145 5.113617       5.839463 
1 1 1 -17 10 11 o 153.1971 3.183961 286.3609       11.88651 274.0533       16.91740 298.3610       16.70474 149.6797 4.643659 156.2143 4.392524 -6.534607      6.392013 
1 1 1 -17 10 12 o 238.3758 3.969775 693.8970       23.06026 692.5138       33.43983 695.1514       31.84300 237.8448 5.769448 238.3514 5.482265 -0.5065918     7.958754 
1 1 1 -17 10 13 o 182.6229 3.789202 407.2063       16.86316 400.3085       30.08924 410.3650       20.36131 180.5195 6.852361 183.2450 4.559713 -2.725525      8.230785 
1 1 1 -17 10 14 o 110.3002 2.772930 148.5001       7.447436 156.4412       11.75682 143.1780       9.624772 113.0780 4.274232 108.2330 3.654415 4.844948       5.623505 
1 1 1 -17 10 15 o 157.7053 3.513055 303.6120       13.50104 332.0612       25.87524 292.9692       15.82617 164.4333 6.470042 154.7975 4.199303 9.635788       7.713338 
1 1 1 -17 10 16 o 213.7960 4.202122 558.4913       21.89295 562.6796       39.52896 556.6382       26.29407 213.7900 7.599470 213.3076 5.058426 0.4824066      9.129053 
1 1 1 -17 10 17 o 166.6798 3.207159 339.0854       13.02686 326.1444       18.98822 350.5921       17.90498 163.2304 4.778756 169.3095 4.343253 -6.079117      6.457581 
1 1 1 -17 10 18 o 148.8701 3.468064 270.5937       12.58146 271.1215       23.64850 270.3854       14.85883 148.4814 6.551884 148.6953 4.104564 -0.2139282     7.731405 
1 1 1 -17 10 19 o 100.7489 2.790637 123.9432       6.844807 129.0166       10.82568 120.5642       8.834929 102.6377 4.338029 99.28757 3.657758 3.350136       5.674301 
1 1 1 -17 10 20 o 222.0788 3.798117 602.5511       20.55472 621.2101       30.43087 586.8954       27.87459 225.1473 5.546403 218.9112 5.225216 6.236099       7.620070 
1 1 1 -17 10 21 f 218.5276 3.757192 583.4973       20.00809 591.2321       29.37550 576.8037       27.32688 219.6221 5.488747 216.9992 5.167681 2.622818       7.538652 
1 1 1 -17 10 22 o 134.3801 2.971224 220.4395       9.729858 220.6227       14.72528 220.2975       12.96280 134.1978 4.509200 134.1804 3.968727 0.1737976E-01  6.006969 
1 1 1 -17 10 23 o 108.8509 3.370459 144.8799       8.929633 149.3759       11.76025 138.7583       13.72243 110.3955 4.380179 106.2424 5.317158 4.153114       6.888987 
1 1 1 -17 10 24 o 140.8242 3.041717 242.1872       10.43836 253.2747       16.00534 233.9807       13.76975 143.7336 4.575349 138.2306 4.092271 5.502991       6.138444 
1 1 1 -17 10 25 o 106.7594 3.468989 139.4613       9.012975 130.7023       11.51950 153.2867       14.47255 103.1828 4.592826 111.6182 5.336220 -8.435379      7.040546 
1 1 1 -17 10 26 o 59.49456 3.936703 43.51223       5.675405 34.81591       7.406143 55.88420       8.833720 52.87677 5.845119 67.21685 5.439419 -14.34008      7.984529 
1 1 1 -17 10 27 o 140.9811 3.078692 242.9369       10.57702 254.7010       16.18627 234.1701       13.97295 143.9996 4.618614 138.1748 4.154480 5.824753       6.212189 
1 1 1 -17 10 28 o 50.21698 3.588320 31.02985       4.362208 30.77572       7.159383 31.17990       5.501308 49.56553 6.052748 50.19106 4.547120 -0.6255264     7.570473 
1 1 1 -17 10 29 o 106.7058 3.248831 139.4984       8.438107 135.1968       15.10562 141.4495       10.17335 104.3695 5.964043 107.3217 3.896384 -2.952255      7.124016 
1 1 1 -17 10 30 o 75.16861 3.015547 69.27519       5.512598 64.39297       8.495576 72.82578       7.244915 72.10509 4.863387 76.92061 3.877551 -4.815521      6.219963 
1 1 1 -17 10 31 o 53.06577 4.056344 34.85262       5.205724 50.22618       12.60180 31.68938       5.716250 62.33666 8.518302 50.44731 4.704053 11.88935       9.730857 
1 1 1 -17 10 32 o 75.85003 3.091586 70.70254       5.702457 68.06377       8.709358 72.68263       7.544478 73.95559 4.859505 76.67420 4.052178 -2.718613      6.327317 
1 1 1 -17 10 33 o 89.04383 3.517139 97.79900       7.616832 98.38144       9.851829 96.93352       12.00945 88.94228 4.560632 87.81491 5.641861 1.127365       7.254651 
1 1 1 -17 10 34 o 42.65409 4.124318 22.76457       4.233539 22.70542       6.623932 22.80542       5.504531 41.72238 6.744973 42.28240 5.470334 -0.5600243     8.684424 
1 1 1 -17 10 35 f 37.68903 4.326664 17.93640       3.901804 13.73590       6.070462 20.89337       5.093248 31.74484 7.883192 40.38115 5.303934 -8.636309      9.501390 
1 1 1 -17 10 36 o 25.29118 6.049702 8.539147       3.678340 4.675097       5.715119 11.27175       4.806096 21.00560 8.022408 28.83084 6.927280 -7.825249      10.59935 
1 1 1 -17 10 37 o 80.70881 3.141757 80.97255       6.167361 86.68817       9.525861 76.84773       8.092354 82.47102 4.760098 77.96850 4.275481 4.502525       6.398303 
1 1 1 -17 10 38 o 17.89967 6.910816 3.351197       4.272811 4.858764       5.311039 0.5850759      7.194107 20.39687 7.747045 18.75919 8.223679 1.637682       11.29804 
1 1 1 -17 10 39 o 41.25180 4.422790 22.07742       4.376729 24.84155       6.579672 19.88367       5.861628 42.32111 6.594699 37.78135 6.607014 4.539768       9.335025 
1 1 1 -17 10 40 o 41.86095 4.370479 22.88281       4.392746 18.50562       6.459875 26.64781       5.991136 35.20626 7.740742 44.23158 5.689933 -9.025322      9.606998 
1 1 1 -17 10 41 o 13.40762 5.918667 -0.1141469     3.786716 3.675966       5.744962 -3.025809      5.035372 18.75280 7.744308 13.37026 6.246205 5.382542       9.949341 
1 1 1 -17 10 42 f 36.37856 7.364963 20.30534       6.304834 15.61942       8.761662 25.33751       9.079598 28.62920 10.09467 37.62033 9.805678 -8.991125      14.07315 
1 1 1 -17 10 43 o 29.09495 5.955832 12.44355       4.080437 13.95808       5.979274 11.12341       5.582370 28.60451 8.171547 25.56300 8.037952 3.041512       11.46224 
1 1 1 -17 10 44 o 31.63033 5.533825 14.57866       4.110184 7.924760       6.147493 19.95755       5.527214 21.28908 8.270237 36.00174 6.540942 -14.71266      10.54423 
1 1 1 -17 10 45 o 28.50024 6.193414 12.61155       4.178300 14.42116       6.428469 11.28787       5.498043 27.28656 8.631673 24.79289 7.997740 2.493668       11.76731 
1 1 1 -17 11 1  o 58.88361 3.021011 42.41471       4.320447 40.54493       6.610175 43.80921       5.708570 57.39317 4.769304 59.76499 3.941629 -2.371826      6.187302 
1 1 1 -17 11 2  o 186.3412 3.465777 423.8140       15.73785 401.6079       22.11846 446.5840       22.39754 181.1539 5.015212 191.0679 4.814180 -9.914063      6.951883 
1 1 1 -17 11 3  o 191.9283 3.148710 449.4621       14.72678 454.2849       23.91413 446.5157       18.69147 192.6700 5.097839 191.2148 4.011308 1.455170       6.486798 
1 1 1 -17 11 4  o 152.1570 3.090024 282.4676       11.45750 297.5069       17.32113 270.7679       15.27735 155.9666 4.562211 148.8280 4.216629 7.138657       6.212385 
1 1 1 -17 11 5  o 105.4033 2.537556 135.4881       6.517871 138.4979       11.03917 133.8773       8.075786 106.3963 4.266341 104.7010 3.168822 1.695236       5.314424 
1 1 1 -17 11 6  o 97.94463 3.190580 117.1750       7.605128 142.1502       17.21794 111.1214       8.476856 107.4898 6.605114 95.34087 3.655315 12.14889       7.549097 
1 1 1 -17 11 7  o 96.41971 2.502818 113.4501       5.875757 111.4064       10.04148 114.5142       7.245736 95.39978 4.330601 96.83349 3.074479 -1.433708      5.310982 
1 1 1 -17 11 8  o 22.08743 4.799484 6.194132       2.509327 7.519580       5.199897 5.791765       2.864999 24.83787 7.750135 21.35502 5.478879 3.482853       9.491191 
1 1 1 -17 11 9  o 208.2107 3.263041 529.0087       16.55624 545.3057       27.39297 519.6292       20.78146 211.0637 5.330122 206.2632 4.134455 4.800522       6.745660 
1 1 1 -17 11 10 f 79.66091 2.504959 77.46620       4.856706 75.87560       8.780026 78.16747       5.829826 78.66133 4.600428 79.98888 2.996113 -1.327545      5.490048 
1 1 1 -17 11 11 o 99.08694 2.890141 119.8755       6.971196 117.9654       10.47286 121.3951       9.341393 98.16159 4.389220 99.63450 3.854658 -1.472908      5.841545 
1 1 1 -17 11 12 o 189.4822 3.880965 438.4335       17.92026 429.8184       31.83920 442.4281       21.68031 187.0186 6.998550 190.2485 4.676363 -3.229858      8.417130 
1 1 1 -17 11 13 o 151.5844 3.075983 280.3719       11.36252 278.1771       17.04242 282.1284       15.24539 150.7818 4.643700 151.9169 4.121904 -1.135132      6.209190 
1 1 1 -17 11 14 o 61.76033 3.178655 46.67106       4.767884 40.24321       9.891897 48.61633       5.441722 56.77861 7.319313 63.00504 3.558723 -6.226429      8.138603 
1 1 1 -17 11 15 o 104.9457 3.116554 134.5207       7.961481 123.5668       15.06208 138.7678       9.378752 100.2093 6.198286 106.5466 3.617426 -6.337257      7.176665 
1 1 1 -17 11 16 o 127.4327 2.902253 198.1409       9.012646 194.2077       13.66049 201.1727       11.99326 125.9642 4.457260 128.2796 3.840897 -2.315453      5.883847 
1 1 1 -17 11 17 o 254.8545 4.180334 793.7681       25.96207 812.2488       38.13158 777.7980       35.44706 257.3746 6.079712 251.9354 5.773708 5.439194       8.384426 
1 1 1 -17 11 18 o 183.1105 3.855853 409.6222       17.20560 420.8014       32.07844 405.1072       20.38605 184.8670 7.134008 181.9390 4.601715 2.927948       8.489396 
1 1 1 -17 11 19 o 111.2271 2.855452 151.0674       7.733257 146.1990       12.00916 154.5163       10.10790 109.2392 4.521037 112.4089 3.695001 -3.169762      5.838904 
1 1 1 -17 11 20 o 89.85811 2.814626 98.63309       6.155709 110.3766       10.14149 91.78249       7.745808 94.89622 4.397430 86.59839 3.678844 8.297829       5.733348 
1 1 1 -17 11 21 o 233.5588 3.948911 666.8237       22.47552 651.5834       32.32913 681.0798       31.26779 230.4538 5.756707 235.6979 5.443841 -5.244156      7.923072 
1 1 1 -17 11 22 o 83.82455 2.910758 85.87952       5.936822 86.70212       9.488840 85.35037       7.610404 84.02551 4.652265 83.48056 3.750565 0.5449448      5.975810 
1 1 1 -17 11 23 o 210.6726 3.712124 542.5851       19.05753 556.7405       28.17031 530.6395       25.87817 212.9314 5.433389 208.0328 5.104648 4.898636       7.455142 
1 1 1 -17 11 24 o 13.68129 5.691404 0.5109082      3.134584 2.167854       5.597040 -0.2462813     3.783612 19.30609 7.766053 14.18776 6.092053 5.118326       9.870395 
1 1 1 -17 11 25 o 99.09971 3.512789 120.2245       8.469799 112.9916       10.85823 131.4643       13.53574 95.89530 4.660453 103.3136 5.395054 -7.418289      7.129266 
1 1 1 -17 11 26 o 107.0326 2.923289 140.0663       7.617585 140.0954       11.81451 140.0456       9.965696 106.7834 4.550642 106.8930 3.831999 -0.1096268     5.949164 
1 1 1 -17 11 27 o 118.9606 2.993373 173.0872       8.670721 162.6418       13.08581 181.2626       11.57687 114.9954 4.679420 121.5773 3.912628 -6.581902      6.099641 
1 1 1 -17 11 28 o 107.6973 2.968665 141.9364       7.783731 149.4683       12.29096 136.8931       10.05760 110.1941 4.587140 105.5960 3.915285 4.598061       6.030863 
1 1 1 -17 11 29 o 117.7343 3.307889 169.8986       9.481114 165.6192       17.02619 171.8219       11.41464 115.4338 6.074063 118.2466 3.966914 -2.812782      7.254698 
1 1 1 -17 11 30 o 100.9550 3.925406 125.4352       9.638734 0.000000       0.000000 125.4352       9.638734 ?        ?        100.9550 3.925406 0.000000       3.925406 
1 1 1 -17 11 31 o 95.55747 3.441485 112.2777       8.000863 123.9703       17.81140 109.3220       8.955205 98.80940 7.452061 94.16504 3.911075 4.644363       8.416039 
1 1 1 -17 11 32 o 96.17667 2.975865 113.5968       6.966204 106.6738       10.60266 118.8554       9.240599 92.64876 4.711587 98.11503 3.872418 -5.466270      6.098744 
1 1 1 -17 11 33 o 35.85304 5.380699 16.41707       4.556160 17.58013       6.405416 15.22602       6.482034 36.44352 7.463907 33.70872 8.009923 2.734802       10.94846 
1 1 1 -17 11 34 o 53.48300 3.561466 35.50824       4.615292 38.85597       7.389528 33.36707       5.909713 55.25068 5.564060 51.46235 4.766542 3.788330       7.326575 
1 1 1 -17 11 35 o 32.70515 4.920786 13.73561       3.800407 15.86296       6.063975 12.35955       4.877033 34.20720 7.483151 30.36790 6.763796 3.839296       10.08695 
1 1 1 -17 11 36 f 28.19701 5.827766 10.56640       3.871991 9.532712       5.979127 11.31299       5.081396 26.32646 8.324103 28.69099 7.262365 -2.364531      11.04684 
1 1 1 -17 11 37 o 35.40642 5.803454 16.65131       4.833986 16.68784       6.404061 16.60293       7.369792 34.37347 7.821916 33.69352 8.859776 0.6799507      11.81855 
1 1 1 -17 11 38 o 25.89752 6.735906 9.416817       4.290541 19.91369       7.373128 4.042370       5.275803 36.76716 8.411925 19.44205 7.629887 17.32512       11.35674 
1 1 1 -17 11 39 o 14.06161 6.011437 0.6368133      3.654483 8.758079       5.644240 -5.225273      4.795343 24.35138 8.117415 12.09306 5.779700 12.25832       9.964807 
1 1 1 -17 11 40 o 40.01554 5.407463 21.71946       5.138182 19.98459       6.445844 24.74310       8.509652 36.76350 7.450417 39.38091 9.056435 -2.617409      11.72722 
1 1 1 -17 11 41 o 33.36325 5.664839 15.53963       4.441124 15.62276       6.641177 15.47238       5.973193 30.97548 8.528700 31.51257 7.816443 -0.5370827     11.56873 
1 1 1 -17 11 42 o 19.34212 7.715978 5.073150       5.477715 9.063527       8.176161 1.823450       7.378432 23.17780 9.364066 18.16186 8.124522 5.015942       12.39732 
1 1 1 -17 11 43 o 36.45747 5.088021 18.64524       4.397384 17.85443       6.488045 19.31717       5.980584 32.30168 8.222495 34.86262 7.275131 -2.560944      10.97893 
1 1 1 -17 11 44 f 23.35934 6.608247 8.727466       3.929445 1.461519       5.978292 14.25423       5.213944 16.19564 7.273735 29.32483 7.319603 -13.12919      10.31910 
1 1 1 -17 11 45 o 18.05468 6.673434 5.123724       3.885405 -1.758513      6.104214 9.811138       5.037692 14.35148 6.759113 23.36744 7.664117 -9.015959      10.21882 
1 1 1 -17 12 1  o 260.2827 4.316267 827.8442       27.37724 844.4412       39.72836 812.8354       37.77964 262.4746 6.211224 257.5624 6.019207 4.912231       8.649287 
1 1 1 -17 12 2  o 140.0373 2.757557 239.2187       9.410318 260.3412       15.98787 228.0221       11.64023 145.8800 4.502761 136.6282 3.498988 9.251785       5.702435 
1 1 1 -17 12 3  o 211.0885 3.705948 544.0335       19.06338 541.6202       27.65824 546.2175       26.31154 210.3094 5.401186 211.3169 5.109471 -1.007462      7.435019 
1 1 1 -17 12 4  f 195.7600 3.186928 467.6331       15.20311 483.6441       25.08588 458.3388       19.11301 198.7715 5.183341 193.7158 4.048815 5.055740       6.577228 
1 1 1 -17 12 5  o 85.11275 2.565613 88.43153       5.315275 89.97028       9.268963 87.67759       6.488044 85.69119 4.454019 84.70865 3.148519 0.9825439      5.454490 
1 1 1 -17 12 6  o 239.5626 4.648820 701.4739       27.13925 629.3091       46.86445 737.8861       33.28925 225.9119 8.528030 245.5349 5.563585 -19.62297      10.18238 
1 1 1 -17 12 7  o 99.34039 2.538202 120.4337       6.139488 120.2385       10.66910 120.5303       7.506955 99.09907 4.429156 99.34114 3.104789 -0.2420731     5.408987 
1 1 1 -17 12 8  o 120.3897 2.589500 176.7711       7.596990 165.9874       12.61688 182.9046       9.515283 116.4637 4.453756 122.3879 3.193143 -5.924141      5.480155 
1 1 1 -17 12 9  o 94.82484 2.534330 109.7415       5.851023 99.09390       10.05200 115.1976       7.195639 89.92513 4.602376 97.12024 3.044109 -7.195114      5.518013 
1 1 1 -17 12 10 o 167.2185 2.909484 341.1326       11.85595 355.6342       20.12784 333.4279       14.67122 170.4762 4.849967 165.2601 3.643023 5.216125       6.065790 
1 1 1 -17 12 11 o 61.47299 3.270577 46.24871       4.881789 43.72992       7.792513 47.87584       6.263167 59.53135 5.431256 62.46690 4.137733 -2.935551      6.827839 
1 1 1 -17 12 12 o 229.3968 4.418654 643.1190       24.70094 614.7977       42.92993 657.1353       30.20090 223.4162 7.897562 231.7208 5.348337 -8.304611      9.538144 
1 1 1 -17 12 13 o 108.1663 3.123520 142.8956       8.224646 135.6363       15.45559 145.7634       9.714316 105.0314 6.064304 109.1998 3.655670 -4.168411      7.080939 
1 1 1 -17 12 14 o 263.9720 4.918381 852.3724       31.63851 789.2750       53.77457 885.7780       39.12737 252.7997 8.742150 268.8448 5.972319 -16.04503      10.58743 
1 1 1 -17 12 15 o 290.4359 4.628551 1031.491       32.75906 1015.707       46.86706 1046.570       45.80773 287.6458 6.686112 292.0630 6.436149 -4.417267      9.280523 
1 1 1 -17 12 16 o 272.5706 4.412070 908.2966       29.30607 890.4618       41.97301 925.2614       40.93651 269.3834 6.393863 274.6790 6.115743 -5.295624      8.847814 
1 1 1 -17 12 17 o 162.3619 3.199813 321.7890       12.66033 330.4572       19.23198 315.1599       16.81855 164.2753 4.809316 160.5048 4.303846 3.770538       6.453883 
1 1 1 -17 12 18 o 203.8314 4.119179 507.8323       20.46057 531.0839       38.19719 498.4763       24.22987 207.5368 7.565323 201.8080 4.926932 5.728882       9.028221 
1 1 1 -17 12 19 o 104.8302 2.872496 134.2170       7.331152 130.4219       11.57824 136.7569       9.471755 103.1416 4.618228 105.7383 3.681504 -2.596703      5.906056 
1 1 1 -17 12 20 o 139.6465 3.067528 238.0746       10.43890 220.6470       15.51900 252.4760       14.10742 134.1722 4.753922 143.6502 4.033995 -9.477982      6.234812 
1 1 1 -17 12 21 o 120.8558 2.938465 178.3070       8.654144 182.6383       13.48296 175.2725       11.28570 122.0706 4.540418 119.6768 3.874853 2.393761       5.969077 
1 1 1 -17 12 22 o 117.6932 3.464842 169.4033       9.926539 175.3104       13.22407 161.7786       15.02407 119.5709 4.546690 114.7077 5.389832 4.863251       7.051432 
1 1 1 -17 12 23 o 61.80249 3.175174 46.77993       4.765971 45.53074       7.925799 47.48746       5.964879 60.66841 5.417940 62.18164 3.956966 -1.513229      6.709072 
1 1 1 -17 12 24 o 35.60766 5.524539 15.93546       4.638510 10.34461       6.167907 23.21381       7.037449 28.58565 8.340271 42.83509 6.982134 -14.24944      10.87705 
1 1 1 -17 12 25 o 34.09990 4.639546 14.51791       3.755456 11.16216       6.696439 16.05758       4.535893 29.64941 8.701294 35.75961 5.370975 -6.110199      10.22545 
1 1 1 -17 12 26 o 42.31312 3.978425 22.12258       4.054119 23.89216       7.079302 21.25904       4.945347 43.41847 6.923154 41.29910 5.016588 2.119373       8.549632 
1 1 1 -17 12 27 o 72.20963 3.066290 63.87571       5.383377 65.20231       8.785937 63.07827       6.811857 72.63855 4.993850 71.63493 3.917062 1.003616       6.346803 
1 1 1 -17 12 28 o 66.23454 3.184097 53.81563       5.124281 50.01558       8.327668 56.13122       6.500685 63.43131 5.439933 67.52417 3.968097 -4.092861      6.733399 
1 1 1 -17 12 29 o 98.36750 2.971931 118.5432       7.115870 120.8707       11.23733 116.9852       9.194112 98.93613 4.674139 97.53261 3.876052 1.403519       6.072179 
1 1 1 -17 12 30 o 100.8478 3.418913 124.9522       8.390006 156.4761       19.01605 117.3323       9.349179 111.4331 7.038739 97.58797 3.939441 13.84510       8.066167 
1 1 1 -17 12 31 f 63.45519 3.214415 49.55302       4.954368 58.88825       8.081684 43.93241       6.270920 68.77245 4.853439 59.48575 4.356161 9.286705       6.521657 
1 1 1 -17 12 32 o 48.49580 3.891519 29.20990       4.560385 27.60299       8.545890 29.84968       5.392344 45.80721 7.943543 48.85096 4.583216 -3.043747      9.170918 
1 1 1 -17 12 33 o 73.09400 3.712849 66.19522       6.591741 62.50647       8.622740 71.38218       10.22497 70.52692 5.050551 75.12228 5.626310 -4.595360      7.560650 
1 1 1 -17 12 34 o 34.98816 4.553970 15.53788       3.790773 15.92277       6.154859 15.30264       4.811694 34.35575 7.557378 34.24448 5.983636 0.1112709      9.639392 
1 1 1 -17 12 35 o 21.89152 6.174382 6.356167       3.435710 6.905570       5.573617 6.019468       4.363280 23.31365 8.062652 21.64595 7.134373 1.667692       10.76595 
1 1 1 -17 12 36 o 37.91337 4.435922 18.36324       4.020995 13.94407       6.239761 21.50171       5.258430 31.41183 8.099430 40.61448 5.450455 -9.202644      9.762593 
1 1 1 -17 12 37 o 26.22719 7.254615 9.674712       4.792802 20.77392       6.556488 -3.062697      7.023698 38.67721 7.221853 16.58102 7.615716 22.09619       10.49544 
1 1 1 -17 12 38 f 21.80428 6.992707 6.611647       4.207261 2.864398       7.622976 8.253130       5.045294 20.34178 8.688831 23.99343 7.653640 -3.651648      11.57903 
1 1 1 -17 12 39 o 18.81472 6.630034 4.678350       3.779060 5.937746       6.102955 3.895159       4.812747 21.36485 8.256448 18.57268 7.287766 2.792173       11.01274 
1 1 1 -17 12 40 o 43.90885 4.407681 25.33219       4.652549 20.66213       6.805617 29.42981       6.374879 36.90775 7.810765 46.20321 5.788616 -9.295460      9.721940 
1 1 1 -17 12 41 o 31.72677 8.335995 16.37270       6.527516 14.32851       9.521705 18.18523       8.965946 27.48158 10.38782 31.13556 10.22524 -3.653978      14.57609 
1 1 1 -17 12 42 o 19.25898 6.955746 5.479526       4.184851 4.432726       6.110561 6.404200       5.743066 18.94895 7.919434 20.52765 7.988200 -1.578699      11.24850 
1 1 1 -17 12 43 o 9.586791 4.705947 -6.093181      3.778392 -6.422946      5.677040 -5.830944      5.062513 12.26350 5.964974 11.67958 5.669872 0.5839167      8.229724 
1 1 1 -17 12 44 o 11.44028 5.363959 -2.128006      3.769936 6.643019       5.889778 -8.215670      4.906807 19.89299 7.978854 10.50816 5.196903 9.384828       9.522075 
1 1 1 -17 13 1  o 151.7225 2.851666 280.8563       10.54350 289.2314       17.43617 276.0287       13.23796 153.7277 4.659769 150.3524 3.613053 3.375290       5.896406 
1 1 1 -17 13 2  o 17.78624 5.804035 3.727435       2.890809 7.895859       5.334049 1.993966       3.439767 25.36623 7.838878 16.00258 6.194646 9.363646       9.991078 
1 1 1 -17 13 3  o 81.18873 2.619964 80.48555       5.176762 82.94609       9.097863 79.30746       6.295225 82.24827 4.556983 80.54843 3.213591 1.699837       5.576133 
1 1 1 -17 13 4  o 91.44549 2.575035 102.0757       5.732565 94.42637       9.735362 106.1356       7.092564 87.77250 4.567243 93.20818 3.127004 -5.435677      5.535148 
1 1 1 -17 13 5  o 129.9351 2.685795 205.9413       8.504242 218.6396       14.55646 199.3612       10.47847 133.6748 4.474895 127.7576 3.368636 5.917236       5.601106 
1 1 1 -17 13 6  o 99.04855 3.260331 119.8616       7.858756 116.2178       17.38904 120.7968       8.809773 96.97863 7.414276 99.40132 3.643106 -2.422691      8.260975 
1 1 1 -17 13 7  o 269.2220 3.928570 885.2329       25.77396 896.5767       41.86282 878.3080       32.70811 270.4245 6.352524 267.9683 5.008827 2.456238       8.089679 
1 1 1 -17 13 8  o 76.20539 2.587966 70.91300       4.798988 73.65020       8.858921 69.77615       5.709249 77.47218 4.714766 75.55467 3.107488 1.917503       5.646724 
1 1 1 -17 13 9  o 244.5128 3.678296 730.0016       21.91716 748.8651       36.26237 719.1445       27.51073 247.2159 6.019268 242.5344 4.654711 4.681534       7.609068 
1 1 1 -17 13 10 o 110.9568 2.777920 150.2838       7.505301 148.2437       15.90186 150.8685       8.513165 109.8365 5.963445 111.1438 3.146350 -1.307312      6.742566 
1 1 1 -17 13 11 o 271.1551 6.208905 901.3761       41.02691 982.0898       61.68511 837.3480       54.94046 281.9542 8.989199 260.4536 8.668248 21.50064       12.48776 
1 1 1 -17 13 12 o 198.5694 4.040083 481.7102       19.54963 453.9902       34.23922 495.1184       23.81286 192.0519 7.329376 201.1950 4.856889 -9.143143      8.792561 
1 1 1 -17 13 13 o 50.21453 2.915475 30.86993       3.552248 46.94917       7.291431 25.86592       4.067610 61.76069 4.884415 45.87750 3.668894 15.88319       6.108870 
1 1 1 -17 13 14 o 153.1656 3.142872 286.3273       11.73070 298.4763       18.14923 277.6103       15.37356 156.1366 4.775603 150.6593 4.191454 5.477356       6.354107 
1 1 1 -17 13 15 o 78.55405 2.912055 75.40226       5.564830 68.20380       9.130514 79.65648       7.019171 74.48009 5.060647 80.68542 3.578794 -6.205330      6.198218 
1 1 1 -17 13 16 o 222.4920 3.838635 604.7755       20.81265 583.4105       29.95533 624.7142       28.93808 218.1184 5.640403 225.8664 5.257534 -7.747986      7.710760 
1 1 1 -17 13 17 o 78.98862 2.931625 76.24894       5.633195 85.71646       9.711622 71.44838       6.915433 83.55822 4.789494 76.38589 3.726341 7.172325       6.068350 
1 1 1 -17 13 18 o 215.6745 4.308511 568.8480       22.64447 549.9380       40.79190 577.2709       27.22447 210.9899 7.947916 217.0960 5.146020 -6.106110      9.468415 
1 1 1 -17 13 19 o 19.26477 6.101474 4.481668       3.211222 14.80838       6.581093 1.254628       3.678910 33.96368 8.071150 15.52028 6.277364 18.44341       10.22491 
1 1 1 -17 13 20 o 185.8272 3.459280 421.8602       15.66503 416.9952       23.10602 425.9984       21.31017 184.3879 5.147327 186.4722 4.693341 -2.084290      6.965804 
1 1 1 -17 13 21 o 71.51151 3.050811 62.56000       5.304302 60.54776       8.922769 63.65976       6.596414 70.07024 5.264009 72.06337 3.769378 -1.993126      6.474411 
1 1 1 -17 13 22 o 146.6410 3.682384 263.0636       13.14852 261.7823       16.91662 265.0189       20.89766 146.0874 4.758218 146.7378 5.855887 -0.6503754     7.545333 
1 1 1 -17 13 23 o 52.90503 4.366203 34.50721       5.579006 26.13214       7.476295 45.03123       8.380752 45.51509 6.961442 60.25505 5.778331 -14.73996      9.047142 
1 1 1 -17 13 24 o 95.22047 2.930354 110.8622       6.791557 110.8159       10.75331 110.8930       8.759770 94.94800 4.661761 95.12283 3.786522 -0.1748352     6.005811 
1 1 1 -17 13 25 o 122.7466 2.986058 184.1205       8.931896 178.3960       13.60257 188.4595       11.84271 120.4857 4.641544 123.9911 3.924387 -3.505402      6.078219 
1 1 1 -17 13 26 f 53.83134 3.456085 35.60810       4.509779 32.01362       7.318861 37.80823       5.725972 50.57045 6.059468 55.35591 4.277891 -4.785458      7.417378 
1 1 1 -17 13 27 o 107.2306 2.949592 140.7211       7.700239 143.0336       12.08027 139.1385       9.993638 107.7686 4.610550 106.4589 3.858554 1.309746       6.012122 
1 1 1 -17 13 28 o 103.6225 3.260312 131.6388       8.222590 141.7381       15.72794 127.8403       9.645782 106.7355 6.071862 101.9827 3.888402 4.752808       7.210214 
1 1 1 -17 13 29 o 140.5533 3.589013 242.6475       12.28278 284.4764       25.99018 230.6187       13.93742 150.4706 7.108061 136.8256 4.184943 13.64493       8.248531 
1 1 1 -17 13 30 o 52.10264 3.513514 33.50107       4.434969 32.94613       7.429652 33.80827       5.527856 51.02720 6.095307 52.15878 4.389739 -1.131577      7.511496 
1 1 1 -17 13 31 o 37.34369 4.227278 17.44360       3.779357 19.59407       6.365784 16.27299       4.696676 38.82442 6.985197 35.71065 5.579476 3.113770       8.939996 
1 1 1 -17 13 32 o 93.41543 3.525198 107.7408       8.010476 105.1993       10.42734 111.4004       12.51270 91.85037 4.673979 94.12765 5.478716 -2.277275      7.201556 
1 1 1 -17 13 33 o 42.58374 4.290282 22.77297       4.391483 20.12267       8.085238 23.88201       5.230217 38.29018 8.843363 43.37988 5.041409 -5.089695      10.17943 
1 1 1 -17 13 34 o 16.04215 6.113107 2.454649       3.313738 6.503965       5.798694 0.4909953      4.038051 23.08541 8.205419 14.99548 6.361635 8.089936       10.38264 
1 1 1 -17 13 35 o 30.21111 5.273687 11.92336       3.741378 13.46838       6.027626 10.95502       4.771897 31.08862 7.931630 28.34138 6.960759 2.747240       10.55286 
1 1 1 -17 13 36 o 36.44916 4.819815 17.18456       4.176264 16.13486       6.420834 17.95426       5.498184 33.75618 7.939475 36.50342 6.414875 -2.747242      10.20715 
1 1 1 -17 13 37 o 28.87848 6.822782 11.68467       4.724625 8.924385       6.032595 16.06383       7.598410 25.00266 8.393011 32.48726 9.188881 -7.484591      12.44501 
1 1 1 -17 13 38 f 28.14483 6.318213 11.10382       4.226902 12.52555       7.930202 10.53962       4.995708 28.10496 9.621178 26.84728 7.399018 1.257681       12.13724 
1 1 1 -17 13 39 o 15.88820 6.371852 2.372595       3.755759 1.773675       5.377649 2.942903       5.247626 17.11463 7.303765 17.95789 7.407339 -0.8432522     10.40258 
1 1 1 -17 13 40 o 39.97365 4.825025 21.41753       4.605155 19.88494       6.917478 22.63740       6.171516 35.67362 8.137867 39.62211 6.625482 -3.948486      10.49390 
1 1 1 -17 13 41 o 14.32519 6.582508 -1.475410      5.255159 -5.171946      7.711875 1.729170       7.180392 15.36274 7.338875 18.07391 8.054693 -2.711174      10.89666 
1 1 1 -17 13 42 o 12.38132 5.672452 -1.214746      3.863409 -2.955976      5.528796 0.4468093      5.400822 13.65457 6.431434 15.41394 6.918824 -1.759369      9.446346 
1 1 1 -17 13 43 o 15.32441 6.369958 2.435730       3.922187 5.478963       6.028445 0.2020048      5.164789 19.17295 7.926908 14.77390 6.686419 4.399051       10.37035 
1 1 1 -17 13 44 f 30.30782 6.384099 14.36965       4.565958 23.43980       7.271181 8.464544       5.866943 36.03183 8.431394 21.46623 8.144911 14.56560       11.72297 
1 1 1 -17 14 1  f 136.5432 3.389592 227.6198       11.27856 233.2674       19.72451 224.8762       13.74781 137.8279 5.886189 135.5858 4.165802 2.242111       7.211181 
1 1 1 -17 14 2  o 357.5275 5.526033 1565.550       48.14587 1593.032       69.71204 1540.487       66.57344 359.6609 7.953867 353.7875 7.721869 5.873444       11.08563 
1 1 1 -17 14 3  o 203.3214 3.300799 504.6154       16.35454 497.1970       26.35916 509.2585       20.85384 201.4496 5.374243 204.1413 4.191978 -2.691772      6.815803 
1 1 1 -17 14 4  o 148.4587 2.839791 268.9016       10.27373 281.5566       17.43452 262.1696       12.71607 151.6617 4.723105 146.5330 3.561077 5.128784       5.915150 
1 1 1 -17 14 5  o 10.36304 4.618551 -0.9630446     2.361116 -3.452872      5.520781 -0.4056896     2.612052 15.05769 6.853484 11.56447 5.014020 3.493219       8.491799 
1 1 1 -17 14 6  o 195.3071 3.589236 465.7480       17.08269 482.2057       37.93703 461.5623       19.13207 197.7856 7.886861 194.3734 4.039142 3.412231       8.860995 
1 1 1 -17 14 7  o 123.1284 2.700722 184.9429       8.103532 199.1641       14.61944 178.6356       9.736100 127.5343 4.712103 120.9299 3.306915 6.604424       5.756701 
1 1 1 -17 14 8  o 172.1529 3.279796 361.7405       13.75933 338.8098       27.26100 369.5789       15.93843 166.0020 6.753051 173.9601 3.759758 -7.958115      7.729131 
1 1 1 -17 14 9  o 136.0286 3.342716 225.8738       11.08066 232.5534       20.72163 223.1989       13.11294 137.5807 6.196501 135.1099 3.987053 2.470749       7.368393 
1 1 1 -17 14 10 o 132.7893 3.340374 215.3842       10.80063 223.6985       20.28774 212.0957       12.75901 134.9270 6.186657 131.7021 3.980035 3.224884       7.356318 
1 1 1 -17 14 11 o 91.15011 3.514407 101.5939       7.791676 103.6472       10.29757 98.84394       11.91719 91.95129 4.610294 89.67607 5.479479 2.275215       7.160971 
1 1 1 -17 14 12 o 237.3130 3.587195 687.7192       20.74496 708.3221       34.34059 675.8802       26.03165 240.3975 5.861945 235.1042 4.543653 5.293243       7.416683 
1 1 1 -17 14 13 f 17.67642 5.683411 3.725437       2.777988 4.940690       6.099405 3.407370       3.120422 22.60872 8.360493 17.51015 6.033783 5.098577       10.31040 
1 1 1 -17 14 14 o 204.5503 3.268009 510.7886       16.28994 524.2668       27.18005 503.2333       20.34973 206.8193 5.397521 202.9178 4.115310 3.901581       6.787416 
1 1 1 -17 14 15 f 61.03767 3.165115 45.59986       4.691778 39.11060       7.951269 49.06619       5.811297 56.17334 5.896369 63.26219 3.786912 -7.088844      7.007700 
1 1 1 -17 14 16 o 93.78798 2.891465 107.4509       6.600581 107.1902       10.66937 107.6126       8.401227 93.47865 4.698781 93.78423 3.683173 -0.3055725     5.970285 
1 1 1 -17 14 17 o 52.61187 3.736493 33.98995       4.759361 33.65568       11.61934 34.05734       5.217098 51.28399 9.651531 52.62265 4.100720 -1.338665      10.48656 
1 1 1 -17 14 18 o 139.3006 3.093094 236.9111       10.49983 228.9277       15.95082 243.0155       13.94791 136.6578 4.797187 140.9229 4.065798 -4.265106      6.288380 
1 1 1 -17 14 19 o 142.0057 3.122730 246.2392       10.80628 242.2126       16.57627 249.2153       14.25078 140.5439 4.847183 142.6912 4.102576 -2.147324      6.350300 
1 1 1 -17 14 20 o 176.4749 3.385020 380.4977       14.55728 377.0262       21.66828 383.3535       19.65314 175.2989 5.077701 176.8820 4.563259 -1.583145      6.826886 
1 1 1 -17 14 21 o 93.39463 2.923357 106.6104       6.645149 116.1221       11.03692 101.2017       8.322738 97.24823 4.670914 90.89799 3.765453 6.350243       5.999673 
1 1 1 -17 14 22 o 104.1617 4.650505 133.2191       11.77464 133.2191       11.77464 0.000000       0.000000 104.1617 4.650505 ?        ?        0.000000       4.650505 
1 1 1 -17 14 23 o 166.4155 3.315234 338.5274       13.44448 347.3048       20.38265 331.7674       17.88750 168.1474 4.979813 164.4702 4.467129 3.677185       6.689826 
1 1 1 -17 14 24 f 27.36650 5.491909 9.536301       3.535057 8.649227       6.407397 9.924471       4.238511 26.67478 8.636300 27.81273 6.388363 -1.137943      10.74229 
1 1 1 -17 14 25 o 48.25175 3.614904 28.65917       4.219660 30.94710       7.380284 27.54803       5.143233 49.67905 6.233108 47.16278 4.530749 2.516266       7.705798 
1 1 1 -17 14 26 f 71.95923 3.083804 63.45254       5.395121 61.52572       8.843120 64.59495       6.809182 70.49010 5.184300 72.48835 3.868712 -1.998253      6.468687 
1 1 1 -17 14 27 o 57.96909 3.334812 41.29201       4.691020 46.34867       7.895205 38.53280       5.832088 61.04060 5.362164 55.82954 4.320300 5.211056       6.886058 
1 1 1 -17 14 28 o 102.3251 3.303839 128.4678       8.227494 130.0560       16.45374 127.9383       9.500532 101.8853 6.663568 101.9925 3.829265 -0.1072388     7.685468 
1 1 1 -17 14 29 o 97.69183 3.418255 117.2973       8.125107 125.7245       17.92803 115.1190       9.114941 99.57565 7.442107 96.65971 3.877524 2.915939       8.391671 
1 1 1 -17 14 30 o 17.07612 6.155465 3.110637       3.275360 6.509300       6.122377 1.747898       3.876791 23.79312 8.433875 16.20916 6.482834 7.583961       10.63755 
1 1 1 -17 14 31 o 69.73681 3.135697 59.89392       5.315203 61.00665       8.720717 59.23626       6.704406 69.75453 5.166997 69.12276 3.997234 0.6317749      6.532667 
1 1 1 -17 14 32 o 38.57741 5.171942 18.94741       4.739705 17.86706       6.767550 19.98748       6.640173 36.51036 7.840580 38.88777 7.274312 -2.377403      10.69534 
1 1 1 -17 14 33 o 72.51182 3.131673 64.98141       5.520725 69.30290       8.851556 62.23005       7.062794 74.13153 4.927801 70.59276 4.123589 3.538773       6.425512 
1 1 1 -17 14 34 o 36.75274 4.535955 17.20140       3.976398 16.83717       6.490912 17.42020       5.030962 35.00625 7.807768 36.48827 5.856031 -1.482021      9.759832 
1 1 1 -17 14 35 o 54.34531 3.915293 37.17285       5.150408 26.67626       9.110351 42.10345       6.243973 43.16148 8.955431 57.57360 4.485805 -14.41212      10.01610 
1 1 1 -17 14 36 o 28.13621 7.141824 11.10669       4.904456 13.44832       6.244421 7.336392       7.923567 30.46440 8.221926 24.28352 9.401390 6.180883       12.48944 
1 1 1 -17 14 37 o 31.68482 5.371855 13.44323       3.999730 9.717074       6.101748 16.25061       5.296320 25.70542 8.434986 34.18392 6.596913 -8.478495      10.70833 
1 1 1 -17 14 38 o 15.78956 6.350357 2.236453       3.741712 3.911080       5.825189 1.060205       4.882029 19.39869 7.879658 16.07890 6.912310 3.319790       10.48184 
1 1 1 -17 14 39 o 37.55433 4.995035 18.93028       4.457994 16.42612       6.567678 21.06982       6.070719 32.41570 8.284185 38.28888 6.752982 -5.873180      10.68787 
1 1 1 -17 14 40 o 15.78015 6.463629 2.291386       3.959589 -1.643081      5.901893 5.511913       5.339639 15.14576 6.965503 20.03106 7.727706 -4.885304      10.40364 
1 1 1 -17 14 41 o 16.92819 6.893455 3.213608       4.471559 4.187624       5.667276 1.607157       7.278217 18.59240 7.686232 17.90375 8.034493 0.6886444      11.11896 
1 1 1 -17 14 42 o 41.39178 5.570210 24.61519       5.476033 25.60751       6.979190 23.02580       8.832695 40.02108 7.429621 33.97683 9.999224 6.044250       12.45728 
1 1 1 -17 14 43 o 27.12433 6.675874 11.70294       4.382381 19.03619       6.866190 6.662122       5.692698 32.33741 8.574657 20.02629 7.905280 12.31113       11.66268 
1 1 1 -17 14 44 o 20.48235 7.671080 7.369092       5.166344 5.707047       6.920416 9.461526       7.764916 19.07910 8.216260 21.67140 8.981507 -2.592297      12.17269 
1 1 1 -17 15 1  o 137.7165 3.024648 231.4768       10.15072 223.3714       19.54523 234.4704       11.87824 134.8285 5.963466 138.5184 3.521769 -3.689896      6.925734 
1 1 1 -17 15 2  o 114.3106 2.881461 159.5522       8.020270 162.7473       15.94049 158.4692       9.280507 115.0972 5.701046 113.8794 3.347821 1.217857       6.611341 
1 1 1 -17 15 3  o 191.3272 3.501106 446.9953       16.32368 432.7920       31.98694 451.9969       18.98140 187.5238 7.012064 192.3241 4.050033 -4.800293      8.097642 
1 1 1 -17 15 4  o 286.5393 4.595379 1004.107       32.08793 1044.950       65.68111 991.3026       36.77528 290.5180 9.289449 284.5323 5.303814 5.985718       10.69693 
1 1 1 -17 15 5  o 49.92307 3.472254 30.57728       4.197916 34.81522       8.741687 29.30705       4.785863 52.78788 6.965359 48.80659 4.060636 3.981297       8.062567 
1 1 1 -17 15 6  o 94.65858 3.672259 109.5941       8.454828 0.000000       0.000000 109.5941       8.454828 ?        ?        94.65858 3.672259 0.000000       3.672259 
1 1 1 -17 15 7  o 158.4398 3.578455 306.5462       13.81643 277.0774       23.87128 321.3911       16.94275 150.1045 6.541691 162.0958 4.292975 -11.99129      7.824536 
1 1 1 -17 15 8  o 63.22513 3.086436 48.90250       4.740987 53.11695       8.086007 46.69472       5.852496 65.68382 5.091452 61.70086 3.912518 3.982952       6.421112 
1 1 1 -17 15 9  o 163.1795 2.929690 324.9288       11.64993 348.0467       20.05873 313.1613       14.31103 168.5897 4.887590 160.1294 3.667446 8.460327       6.110540 
1 1 1 -17 15 10 o 130.3129 2.722126 207.1805       8.644336 211.5787       14.84108 204.9222       10.63448 131.4442 4.640553 129.5118 3.372409 1.932404       5.736539 
1 1 1 -17 15 11 o 173.0606 3.434689 365.6933       14.48511 369.6404       21.15936 362.2121       19.87133 173.7162 5.003557 172.0060 4.745286 1.710175       6.895891 
1 1 1 -17 15 12 o 131.8290 2.718485 212.0366       8.733210 207.8380       14.84564 214.2585       10.79952 130.2621 4.684382 132.4298 3.349124 -2.167709      5.758478 
1 1 1 -17 15 13 o 207.8115 3.340325 527.2806       16.91587 528.7713       28.26932 526.4491       21.11289 207.6456 5.591805 207.5273 4.174807 0.1182404      6.978345 
1 1 1 -17 15 14 o 30.95900 4.331633 11.94554       3.178630 10.10419       6.317703 12.56964       3.678074 28.42584 8.479893 31.67584 4.924880 -3.250004      9.806274 
1 1 1 -17 15 15 f 150.2579 2.844714 275.5345       10.41626 291.1915       18.09399 267.7739       12.73883 154.1628 4.822288 148.0627 3.530595 6.100067       5.976584 
1 1 1 -17 15 16 o 46.35674 3.306447 26.37498       3.710649 22.90087       7.623620 27.45354       4.247771 42.47308 7.646832 47.25561 3.718627 -4.782532      8.503072 
1 1 1 -17 15 17 o 89.02482 3.286716 96.92200       7.118084 111.8418       16.16906 93.33543       7.927606 95.05259 7.030229 87.31271 3.734503 7.739883       7.960567 
1 1 1 -17 15 18 o 161.2094 3.271398 317.4218       12.85168 335.5973       19.95819 304.5468       16.79773 165.4292 4.956361 157.6963 4.375353 7.732956       6.611296 
1 1 1 -17 15 19 o 186.2245 3.497397 423.7920       15.87149 437.4979       24.06412 413.2395       21.11524 188.7982 5.235469 183.6104 4.723059 5.187805       7.051058 
1 1 1 -17 15 20 o 111.6112 3.001713 152.2361       8.156779 154.0907       13.03523 151.0425       10.45708 112.0337 4.785592 111.0630 3.869624 0.9707031      6.154338 
1 1 1 -17 15 21 o 163.0756 3.900974 325.3490       15.50237 330.5508       19.92970 317.3798       24.66777 164.0883 4.989902 160.4172 6.322578 3.671066       8.054447 
1 1 1 -17 15 22 o 102.3452 3.532420 128.2451       8.796794 125.3472       11.77102 131.9109       13.23906 100.9748 4.797436 103.4974 5.266495 -2.522652      7.123999 
1 1 1 -17 15 23 o 32.55373 4.869149 13.29108       3.744216 13.65981       6.774625 13.12891       4.492743 32.51169 8.468063 32.14563 5.954497 0.3660622      10.35201 
1 1 1 -17 15 24 o 181.7398 3.477398 404.1781       15.40071 397.4688       22.87551 409.7401       20.82797 179.6657 5.230365 182.6088 4.684335 -2.943115      7.021376 
1 1 1 -17 15 25 o 74.51533 3.083989 68.02708       5.587980 72.39822       9.384384 65.62580       6.955514 76.53008 5.060366 73.06179 3.920998 3.468285       6.401682 
1 1 1 -17 15 26 o 99.83849 2.955849 122.0411       7.183529 135.2344       11.79494 114.2619       9.057034 104.7402 4.632570 96.43501 3.861841 8.305229       6.031130 
1 1 1 -17 15 27 o 68.99489 3.169639 58.42900       5.314972 60.78098       8.956524 57.15057       6.603322 69.92336 5.295684 68.08695 3.997397 1.836411       6.635017 
1 1 1 -17 15 28 o 51.23513 4.311850 32.57160       5.333624 0.000000       0.000000 32.57160       5.333624 ?        ?        51.23513 4.311850 0.000000       4.311850 
1 1 1 -17 15 29 o 88.53933 3.014911 96.24828       6.495503 95.83919       10.49742 96.50209       8.268512 87.79700 4.926198 88.44617 3.845487 -0.6491623     6.249416 
1 1 1 -17 15 30 o 36.97231 4.354833 17.14296       3.848420 17.35819       6.848903 17.04364       4.652328 36.14351 7.988781 36.59761 5.376709 -0.4541016     9.629622 
1 1 1 -17 15 31 f 19.98653 6.265946 5.043735       3.394833 2.826429       6.404570 5.910167       4.003541 20.39240 8.269961 21.57796 6.810021 -1.185562      10.71301 
1 1 1 -17 15 32 o 76.24577 3.681763 72.13511       6.820593 68.44664       9.404684 76.22763       9.906413 73.56828 5.281003 77.66354 5.265487 -4.095261      7.457503 
1 1 1 -17 15 33 o 13.68601 5.813532 0.3248300      3.379551 1.149601       5.946478 -0.6866698E-01 4.107369 18.25685 7.731467 14.60040 6.308901 3.656453       9.978868 
1 1 1 -17 15 34 o 20.90036 6.428079 5.759983       3.591971 1.659335       5.941479 8.122044       4.509349 18.48369 7.772501 24.44812 7.130783 -5.964428      10.54798 
1 1 1 -17 15 35 o 20.64708 7.252627 5.395891       4.519553 7.280731       5.741056 2.324058       7.329146 23.41899 8.177979 20.22303 8.574591 3.195953       11.84918 
1 1 1 -17 15 36 o 34.04098 7.452924 16.48864       6.010724 18.85971       8.729403 14.35098       8.288610 34.70104 9.860544 30.40173 9.820942 4.299313       13.91694 
1 1 1 -17 15 37 o 25.46423 7.106912 9.375503       4.577176 -2.627883      8.227039 14.75658       5.508411 17.73426 8.180460 31.95810 7.241282 -14.22385      10.92502 
1 1 1 -17 15 38 o 11.06395 5.242507 -3.651597      3.777031 -3.106054      5.778665 -4.058492      4.990620 14.50392 6.747557 12.89391 6.084542 1.610003       9.085768 
1 1 1 -17 15 39 o 9.275751 4.551543 -6.212002      3.524046 -2.217437      5.317539 -9.340406      4.705842 14.20237 6.560343 10.21733 5.059587 3.985038       8.284777 
1 1 1 -17 15 40 o 27.89997 6.896699 11.81759       4.661981 13.36073       8.760550 11.20794       5.506410 26.72288 9.993097 26.30075 7.933050 0.4221382      12.75912 
1 1 1 -17 15 41 o 19.35456 7.886198 5.199457       5.856382 5.199457       5.856382 0.000000       0.000000 19.35456 7.886198 ?        ?        0.000000       7.886198 
1 1 1 -17 15 42 o 25.97539 6.678967 10.65117       4.251135 12.05656       6.456821 9.575816       5.648049 25.39309 8.681822 23.25757 8.112139 2.135519       11.88195 
1 1 1 -17 15 43 o 22.72087 6.887846 8.534646       4.143661 1.526775       6.615820 13.05827       5.315375 16.55441 7.522091 27.40646 7.662117 -10.85205      10.73731 
1 1 1 -17 16 1  o 103.3639 3.185151 130.5595       8.013391 140.0634       14.29579 126.2052       9.676537 106.7612 5.513563 101.5475 3.917692 5.213753       6.763703 
1 1 1 -17 16 2  o 192.3451 4.000618 452.1629       18.75186 481.1903       33.80221 439.2583       22.53788 197.6741 7.028312 189.3762 4.887814 8.297852       8.560835 
1 1 1 -17 16 3  o 224.5897 3.916746 616.3630       21.43637 619.3975       31.51462 613.7501       29.24380 224.6940 5.760268 223.8320 5.361365 0.8619995      7.869239 
1 1 1 -17 16 4  o 89.90630 2.944204 98.75258       6.441811 97.21669       10.40821 99.70621       8.201354 89.00356 4.816748 90.26654 3.736480 -1.262985      6.096092 
1 1 1 -17 16 5  o 50.22688 3.059905 30.90486       3.727475 39.07293       7.294499 28.01829       4.336382 56.22465 5.389859 47.74467 3.757318 8.479973       6.570237 
1 1 1 -17 16 6  o 107.1461 3.780094 140.4210       9.854489 0.000000       0.000000 140.4210       9.854489 ?        ?        107.1461 3.780094 0.000000       3.780094 
1 1 1 -17 16 7  o 105.3049 2.643839 135.3730       6.779163 150.2444       12.26402 128.8297       8.134980 110.7412 4.554232 102.6754 3.255390 8.065811       5.598088 
1 1 1 -17 16 8  o 88.02806 2.664742 94.62625       5.709685 89.83457       10.09660 96.87906       6.922976 85.54317 4.863474 89.02790 3.196214 -3.484726      5.819722 
1 1 1 -17 16 9  o 76.39650 2.702001 71.29836       5.022393 61.85999       9.033463 75.52116       6.042354 70.87871 5.267667 78.59255 3.161373 -7.713844      6.143500 
1 1 1 -17 16 10 o 10.41089 4.957973 -4.509541      3.463474 0.1539992E-01  5.834501 -6.971676      4.303811 17.90382 7.623068 10.95294 5.295753 6.950877       9.282035 
1 1 1 -17 16 11 o 32.70102 4.281158 13.29566       3.329754 11.34967       6.803724 13.90855       3.818269 30.01462 8.760288 33.37083 4.836076 -3.356213      10.00651 
1 1 1 -17 16 12 o 87.61875 2.681042 93.75888       5.717754 100.4728       10.48618 90.91814       6.820952 90.48275 4.772589 86.23210 3.251762 4.250648       5.775081 
1 1 1 -17 16 13 o 26.13614 5.210007 8.661667       3.201798 10.81680       6.554979 7.986366       3.669303 29.32289 8.609828 25.01542 6.079552 4.307468       10.53993 
1 1 1 -17 16 14 o 36.09627 3.907230 16.10972       3.382176 17.98219       7.231175 15.58539       3.826529 37.45621 8.154107 35.40472 4.539456 2.051495       9.332531 
1 1 1 -17 16 15 o 34.51213 4.142124 14.77254       3.414095 8.660498       7.170423 16.56440       3.882425 27.24197 9.150413 36.52741 4.453587 -9.285442      10.17666 
1 1 1 -17 16 16 o 226.7263 3.513927 628.0521       19.41470 670.2612       33.07868 605.8709       23.97938 233.6696 5.809112 222.5095 4.422352 11.16014       7.300889 
1 1 1 -17 16 17 o 188.9535 3.502356 436.2712       16.12692 444.3901       34.86894 434.0619       18.18923 189.5711 7.563156 188.3993 3.961859 1.171799       8.538012 
1 1 1 -17 16 18 o 163.6738 3.325637 327.2907       13.26447 330.4183       20.31216 324.9653       17.51477 164.0817 5.086097 162.8651 4.417143 1.216553       6.736434 
1 1 1 -17 16 19 o 92.89523 3.653000 105.6652       8.253377 110.2250       11.20929 100.2661       12.19727 94.70290 4.873509 90.18874 5.577045 4.514168       7.406384 
1 1 1 -17 16 20 o 39.46206 5.855434 19.55399       5.460351 17.26939       7.744042 21.81288       7.700346 36.55185 8.800174 41.29467 7.940427 -4.742817      11.85299 
1 1 1 -17 16 21 o 96.96743 3.561040 115.1519       8.400411 122.2508       11.66459 107.5034       12.10775 99.70948 4.814848 93.38625 5.342695 6.323235       7.192159 
1 1 1 -17 16 22 f 69.73563 3.212559 59.57673       5.444695 56.17227       9.253109 61.37975       6.733843 67.31248 5.694371 70.69215 3.924310 -3.379669      6.915639 
1 1 1 -17 16 23 o 129.4874 3.082536 204.9885       9.726842 204.0742       15.18680 205.6244       12.66558 128.7899 4.847569 129.4741 4.019131 -0.6841888     6.297011 
1 1 1 -17 16 24 o 64.60667 3.228593 51.19496       5.066970 60.35817       8.906154 46.80952       6.161300 69.80466 5.274670 61.63816 4.125670 8.166500       6.696514 
1 1 1 -17 16 25 o 156.3916 3.265233 299.4434       12.44411 305.1220       19.07033 295.2323       16.42230 157.2930 4.981504 154.9407 4.353747 2.352356       6.615928 
1 1 1 -17 16 26 o 120.4597 3.044080 177.7590       8.928650 187.3925       14.31368 171.6229       11.42361 123.2031 4.776579 118.1370 3.973743 5.066109       6.213400 
1 1 1 -17 16 27 o 103.8904 3.858314 132.8649       9.751108 0.000000       0.000000 132.8649       9.751108 ?        ?        103.8904 3.858314 0.000000       3.858314 
1 1 1 -17 16 28 o 61.58765 3.266314 46.68676       4.884633 46.15145       8.482140 46.95237       5.974798 60.57710 5.817361 61.60863 4.001301 -1.031540      7.060602 
1 1 1 -17 16 29 f 95.90570 3.054177 113.0298       7.128870 124.2316       11.78854 106.5716       8.951017 99.91371 4.856254 92.85204 3.965024 7.061676       6.269340 
1 1 1 -17 16 30 o 48.99963 3.731646 29.80881       4.422325 22.31147       7.583562 33.67210       5.443751 41.00375 7.875691 51.93111 4.341332 -10.92736      8.992980 
1 1 1 -17 16 31 o 40.02843 4.427764 20.17956       4.246940 27.79141       7.289393 16.26800       5.225425 46.21416 6.665015 35.29003 6.307752 10.92414       9.176609 
1 1 1 -17 16 32 o 42.04053 4.130259 22.22173       4.176811 30.81114       7.309351 18.05706       5.089649 48.66799 6.311615 37.29071 5.788388 11.37728       8.563990 
1 1 1 -17 16 33 o 27.07240 5.897561 9.746969       3.780433 10.95664       6.475972 9.121638       4.656141 28.07716 8.630352 25.88888 7.146348 2.188278       11.20506 
1 1 1 -17 16 34 o 65.08493 3.394768 52.87774       5.365655 55.37843       8.619722 51.29575       6.855919 65.40089 5.458180 63.55756 4.454728 1.843327       7.045306 
1 1 1 -17 16 35 o 40.43123 5.340511 21.49289       5.133270 19.03046       6.519871 25.50854       8.325990 36.73478 7.536215 42.01096 8.426188 -5.276180      11.30465 
1 1 1 -17 16 36 o 19.60048 6.606472 5.126999       3.737544 -3.717997      5.824727 11.31783       4.873053 14.46305 6.743892 28.10219 7.111156 -13.63914      9.800440 
1 1 1 -17 16 37 o 20.59014 7.117787 5.851272       4.343631 -1.025874      8.254361 8.484902       5.108070 18.37199 8.369033 23.98424 7.706315 -5.612253      11.37664 
1 1 1 -17 16 38 o 27.03481 6.965065 10.79330       4.616934 13.83269       8.860155 9.660371       5.409401 28.21758 10.13000 25.07254 7.916302 3.145046       12.85631 
1 1 1 -17 16 39 o 19.22710 6.747473 5.228052       3.911269 8.489888       6.124214 2.981128       5.082923 23.18791 8.409014 17.48685 7.258694 5.701059       11.10856 
1 1 1 -17 16 40 o 32.88091 10.64612 21.87757       9.736556 21.87757       9.736556 0.000000       0.000000 32.88091 10.64612 ?        ?        0.000000       10.64612 
1 1 1 -17 16 41 o 14.80963 6.268438 1.785926       3.905594 0.3595021      6.004717 2.831844       5.141822 15.83617 7.184095 16.80988 7.156744 -0.9737062     10.14052 
1 1 1 -17 16 42 o 25.62226 6.449415 10.28902       4.023431 12.51654       6.583434 8.961054       5.083177 25.54836 8.765600 22.72431 7.704329 2.824045       11.67015 
1 1 1 -17 16 43 o 15.32037 6.290061 2.752359       3.760993 2.996012       5.890819 2.584702       4.886543 16.92077 7.428948 15.98864 6.894906 0.9321260      10.13553 
1 1 1 -17 17 1  o 74.65337 4.638782 68.47099       8.397275 67.67861       10.88461 69.63599       13.19804 73.99723 6.090020 74.83253 7.331380 -0.8352966     9.530869 
1 1 1 -17 17 2  o 99.63496 2.872159 121.2615       6.966311 136.8935       14.61925 116.6692       7.923774 105.4924 5.708063 97.68539 3.333520 7.806969       6.610169 
1 1 1 -17 17 3  o 175.3503 3.373763 375.5055       14.41642 381.9203       29.09603 373.4182       16.59690 176.0992 6.792905 174.7955 3.896374 1.303711       7.831047 
1 1 1 -17 17 4  o 177.7787 3.124808 385.8423       13.53752 381.3613       22.39495 388.4225       16.99385 176.3618 5.216596 178.2740 3.911720 -1.912201      6.520308 
1 1 1 -17 17 5  o 74.01725 2.956182 66.97449       5.321398 61.24494       11.30306 68.60605       6.031663 70.28046 6.679933 74.88347 3.313537 -4.603004      7.456610 
1 1 1 -17 17 6  o 100.1697 3.040027 122.5931       7.412201 99.13182       18.09318 127.3247       8.125323 89.19887 8.423524 102.0646 3.271077 -12.86569      9.036354 
1 1 1 -17 17 7  o 131.5544 2.780323 211.1921       8.913263 243.8092       16.09296 196.7589       10.70522 141.0743 4.687651 126.8792 3.465581 14.19516       5.829607 
1 1 1 -17 17 8  o 89.90665 2.707835 98.72137       5.925906 97.70916       10.53756 99.18955       7.166478 89.21034 4.865596 90.07137 3.270427 -0.8610229     5.862569 
1 1 1 -17 17 9  o 110.6797 2.702212 149.4771       7.288257 155.2923       12.90473 146.7534       8.831623 112.5474 4.715638 109.5771 3.311182 2.970322       5.762046 
1 1 1 -17 17 10 o 195.5607 3.711388 467.2770       17.68700 483.1698       25.97921 453.5463       24.14750 198.4854 5.376026 192.3505 5.156259 6.134949       7.449071 
1 1 1 -17 17 11 o 182.1704 3.125557 405.1619       13.87527 393.0561       22.75689 412.3253       17.50559 179.0339 5.221627 183.6701 3.911129 -4.636200      6.523981 
1 1 1 -17 17 12 o 156.0899 2.929622 297.3966       11.14353 295.9620       18.81151 298.1722       13.83155 155.3723 4.974783 156.2179 3.633322 -0.8456421     6.160316 
1 1 1 -17 17 13 o 98.83224 2.682191 119.2872       6.453907 109.7446       11.31660 123.8870       7.856884 94.53136 4.929548 100.6725 3.206696 -6.141129      5.880760 
1 1 1 -17 17 14 o 138.9022 2.793415 235.4926       9.455417 280.6584       17.42200 216.6338       11.25768 151.3213 4.730375 133.1166 3.473377 18.20476       5.868628 
1 1 1 -17 17 15 o 196.8972 3.249202 473.5281       15.59022 491.2933       26.39023 464.0045       19.32235 200.0509 5.418345 194.7719 4.070967 5.279053       6.777259 
1 1 1 -17 17 16 o 254.8822 3.817717 794.3441       23.71261 814.1129       39.26494 782.9952       29.75046 257.2736 6.262873 252.7893 4.829463 4.484283       7.908684 
1 1 1 -17 17 17 o 100.9050 3.381687 124.5535       8.303638 144.3709       18.04050 119.2265       9.353314 108.0005 6.890609 98.65627 3.898167 9.344269       7.916830 
1 1 1 -17 17 18 o 142.9170 3.680853 249.9179       12.80875 279.0569       25.53227 240.1181       14.80678 150.2202 6.993888 139.9689 4.346301 10.25136       8.234367 
1 1 1 -17 17 19 o 158.1289 3.922031 305.9835       15.11327 314.2792       19.68933 294.0857       23.57967 159.9526 5.057662 154.3831 6.280719 5.569427       8.063955 
1 1 1 -17 17 20 o 113.6064 3.058504 157.8191       8.459652 160.2903       13.53182 156.2336       10.83889 114.1822 4.874412 112.9004 3.945675 1.281746       6.271223 
1 1 1 -17 17 21 o 60.14061 4.112441 44.51883       5.990764 33.17878       8.523183 55.59164       8.422159 51.32165 6.997023 67.05311 5.194773 -15.73146      8.714584 
1 1 1 -17 17 22 o 90.98902 3.046906 101.3253       6.746385 113.9575       11.45663 94.61980       8.347079 96.17100 4.904710 87.79504 3.911291 8.375954       6.273307 
1 1 1 -17 17 23 o 54.26411 3.499425 36.20213       4.602818 41.17817       8.234622 33.94098       5.550947 57.42850 5.971180 52.39750 4.387557 5.031002       7.409834 
1 1 1 -17 17 24 o 32.65257 4.806641 13.39762       3.710360 11.80626       6.968520 14.02728       4.383365 30.28261 8.873350 33.25890 5.607563 -2.976290      10.49672 
1 1 1 -17 17 25 o 36.41362 4.505758 16.56431       3.913009 23.07486       7.425503 14.06127       4.604165 42.34195 7.469381 33.20360 5.906725 9.138351       9.522659 
1 1 1 -17 17 26 o 124.8432 3.484424 191.4214       10.59027 209.7776       22.28391 186.0660       12.03639 129.1083 7.110191 122.9206 4.023657 6.187630       8.169739 
1 1 1 -17 17 27 o 134.9025 3.504445 223.7479       11.51085 212.7841       21.76126 228.0073       13.56378 129.8892 6.899790 135.9578 4.098609 -6.068649      8.025315 
1 1 1 -17 17 28 o 26.01499 5.725486 8.772741       3.531104 13.40127       7.003529 7.195088       4.088850 31.69977 8.770028 23.57916 6.764289 8.120607       11.07560 
1 1 1 -17 17 29 o 50.84649 3.616467 32.03756       4.451820 41.40510       8.275889 28.22318       5.280977 57.05038 6.044632 47.44887 4.625895 9.601509       7.611602 
1 1 1 -17 17 30 o 74.94530 3.196938 69.31659       5.825267 78.32703       9.827750 64.43625       7.232795 78.90371 5.139136 71.94289 4.143075 6.960815       6.601197 
1 1 1 -17 17 31 o 27.98094 6.467605 10.41572       4.321704 11.64934       6.874799 9.609704       5.556999 29.18613 8.876989 26.71958 7.948659 2.466555       11.91562 
1 1 1 -17 17 32 o 24.29473 6.131515 7.880624       3.629683 5.334955       6.277892 9.158885       4.448593 22.12862 8.418509 26.02628 6.902268 -3.897655      10.88635 
1 1 1 -17 17 33 o 55.25454 3.625333 38.23178       4.854521 36.29565       8.237672 39.26191       6.008748 52.24066 6.619196 55.61198 4.471495 -3.371323      7.987993 
1 1 1 -17 17 34 o 49.10354 5.043056 31.23845       5.948847 29.77547       7.687435 33.42225       9.392211 46.72572 6.963696 48.58438 8.226208 -1.858665      10.77792 
1 1 1 -17 17 35 o 52.07641 3.746422 34.37787       4.722606 28.65451       7.349911 38.40232       6.163248 45.54456 6.832885 54.47175 4.688617 -8.927197      8.286823 
1 1 1 -17 17 36 o 41.18207 5.167408 22.55915       5.071946 28.63376       10.39617 20.66169       5.810333 41.70609 10.29273 38.55807 6.408587 3.148026       12.12478 
1 1 1 -17 17 37 o 32.35951 5.589698 14.36469       4.248514 14.97325       6.943492 14.00051       5.371349 30.61799 8.824486 30.79094 7.274879 -0.1729488     11.43658 
1 1 1 -17 17 38 o 30.07738 5.838167 12.73428       4.124752 14.49253       6.414286 11.49454       5.386072 30.01107 8.426606 27.19154 7.751619 2.819525       11.44969 
1 1 1 -17 17 39 f 23.86938 9.234018 9.655490       7.639617 0.000000       0.000000 9.655490       7.639617 ?        ?        23.86938 9.234018 0.000000       9.234018 
1 1 1 -17 17 40 o 58.36929 4.579195 46.11665       6.461317 47.50022       8.384596 44.09367       10.13861 57.09561 6.121663 51.69210 8.331740 5.403507       10.33889 
1 1 1 -17 17 41 o 14.33608 6.167238 1.374542       3.891280 12.62390       6.168418 -6.061442      5.015094 26.31975 8.469585 11.51263 5.601268 14.80711       10.15421 
1 1 1 -17 17 42 o 13.30750 5.891109 0.5018522      3.777180 -4.497299      6.229447 3.408391       4.749954 13.45356 6.471215 16.68771 6.978908 -3.234152      9.517447 
1 1 1 -17 18 1  f 69.15963 2.966972 58.50198       4.988740 62.06863       10.33976 57.41978       5.695518 70.82849 6.048370 68.47212 3.424236 2.356369       6.950408 
1 1 1 -17 18 2  o 229.5030 3.965368 644.0135       22.17727 660.9745       44.77187 638.4989       25.52927 231.1607 7.959825 228.3841 4.587081 2.776611       9.186954 
1 1 1 -17 18 3  o 102.1044 2.900802 127.3617       7.210379 132.6978       14.95646 125.7461       8.229889 103.7948 5.937905 101.4111 3.334750 2.383659       6.810233 
1 1 1 -17 18 4  o 159.9451 3.011792 312.3170       11.73903 315.8182       19.93336 310.4579       14.52498 160.4670 5.104008 159.3843 3.739675 1.082733       6.327406 
1 1 1 -17 18 5  o 52.62371 3.226079 33.94294       4.117184 31.08941       8.028168 34.96127       4.795884 49.82441 6.788466 53.35999 3.711351 -3.535583      7.736756 
1 1 1 -17 18 6  o 166.1997 3.408031 337.3946       13.80289 342.1268       31.56674 336.2759       15.34789 166.3163 7.810404 165.8747 3.796928 0.4416504      8.684416 
1 1 1 -17 18 7  o 117.5133 3.046505 168.7045       8.716831 197.9980       22.32347 163.4345       9.468517 126.5648 7.268471 115.6284 3.363902 10.93639       8.009151 
1 1 1 -17 18 8  o 65.41656 3.009447 52.35207       4.784596 57.39935       9.035493 50.38528       5.640290 68.20120 5.482713 64.11406 3.624805 4.087143       6.572621 
1 1 1 -17 18 9  o 136.8519 2.845274 228.5948       9.488796 217.1006       15.90154 234.9509       11.82481 133.0479 4.912939 138.6352 3.502939 -5.587296      6.033867 
1 1 1 -17 18 10 o 91.62120 3.256228 102.6478       7.258649 99.94236       10.95483 104.7652       9.691442 90.18387 5.004340 92.43917 4.314156 -2.255302      6.607221 
1 1 1 -17 18 11 o 84.40647 2.769263 87.04900       5.688368 96.70823       10.51658 83.05430       6.763092 88.72237 4.882959 82.38841 3.375700 6.333961       5.936214 
1 1 1 -17 18 12 o 162.6614 2.977959 323.0391       11.80427 350.2714       20.59581 309.7176       14.40498 168.9941 5.006687 159.1828 3.713474 9.811234       6.233522 
1 1 1 -17 18 13 o 96.39109 2.743439 113.5014       6.437635 116.0438       11.70541 112.3989       7.708046 97.18436 4.958980 95.86562 3.304419 1.318733       5.959083 
1 1 1 -17 18 14 o 133.3536 2.815451 217.0953       9.149323 218.2263       15.89006 216.5343       11.19049 133.3531 4.898068 133.0724 3.453760 0.2807312      5.993290 
1 1 1 -17 18 15 o 159.1979 2.960215 309.4796       11.48410 302.5775       19.32645 313.2469       14.27828 157.0036 5.057939 160.0713 3.660380 -3.067749      6.243486 
1 1 1 -17 18 16 o 22.35096 6.879561 6.159619       4.113286 6.813312       9.865972 6.022089       4.525342 27.61308 10.54184 22.41406 7.258015 5.199011       12.79880 
1 1 1 -17 18 17 o 274.0185 4.555058 920.0589       30.41654 911.4540       43.81055 928.0663       42.26219 271.8887 6.612283 274.4960 6.318004 -2.607300      9.145461 
1 1 1 -17 18 18 o 24.49096 5.694263 7.670659       3.333859 8.438529       7.044213 7.449018       3.784545 26.84739 9.069693 24.14800 6.348562 2.699387       11.07084 
1 1 1 -17 18 19 o 76.08358 2.786975 70.79929       5.158526 70.94920       9.916821 70.74368       6.040026 75.77219 5.406161 75.99988 3.268936 -0.2276840     6.317636 
1 1 1 -17 18 20 o 22.08257 6.477942 6.132643       3.712168 4.616650       7.143103 6.693561       4.344981 23.23491 8.944715 23.18177 7.058446 0.5313873E-01  11.39428 
1 1 1 -17 18 21 o 24.91946 6.966557 7.923881       4.394216 8.724239       7.092990 7.425379       5.597837 27.09059 9.100883 24.77692 8.076061 2.313675       12.16753 
1 1 1 -17 18 22 o 126.3668 3.112401 195.3418       9.584394 210.3659       15.59999 186.2321       12.14742 130.6631 4.908039 123.1503 4.053261 7.512772       6.365357 
1 1 1 -17 18 23 o 43.25056 4.049692 23.15995       4.218613 21.65357       7.731751 23.79850       5.033956 40.89410 8.045276 43.70920 4.805234 -2.815098      9.371058 
1 1 1 -17 18 24 f 36.32526 4.472219 16.48113       3.875364 17.17680       7.470327 16.22498       4.533038 36.16696 8.602067 35.85100 5.352298 0.3159599      10.13127 
1 1 1 -17 18 25 o 69.18190 3.485304 58.88460       5.856903 64.77326       13.64816 57.55538       6.484324 71.16665 8.008626 68.30890 3.911749 2.857750       8.912905 
1 1 1 -17 18 26 f 97.68049 3.069114 117.1161       7.296552 114.2185       12.04047 118.7978       9.172712 95.81829 5.175756 98.17709 3.841409 -2.358795      6.445531 
1 1 1 -17 18 27 o 121.5860 3.415528 181.9032       10.10990 195.2372       20.03506 177.3480       11.71013 124.3061 6.638039 119.8289 4.015853 4.477158       7.758262 
1 1 1 -17 18 28 o 29.06300 5.151925 10.83116       3.515192 20.50624       7.016526 7.589114       4.061672 39.43001 7.577549 24.09479 6.683601 15.33522       10.10395 
1 1 1 -17 18 29 o 22.55438 6.122080 6.658872       3.450317 -3.497073      6.755582 10.24298       4.013221 16.58302 7.560697 27.95557 6.065671 -11.37255      9.693116 
1 1 1 -17 18 30 o 24.81907 5.985721 8.135079       3.577975 0.9431606      6.585473 11.14721       4.261879 18.99636 8.093880 29.05739 6.207344 -10.06103      10.20010 
1 1 1 -17 18 31 o 74.40269 3.816749 69.04742       6.897069 72.56709       9.630899 65.34197       9.881796 75.50346 5.267398 71.34911 5.731620 4.154350       7.784405 
1 1 1 -17 18 32 o 19.39179 6.519801 4.740503       3.640202 5.663391       6.488432 4.316593       4.397464 22.41962 8.551479 19.39315 7.111320 3.026470       11.12199 
1 1 1 -17 18 33 o 49.53871 4.913353 31.62642       5.853348 26.85448       7.664365 38.30490       9.067084 44.15605 7.383264 53.01215 7.205002 -8.856102      10.31623 
1 1 1 -17 18 34 o 27.52541 7.368618 10.81024       5.040423 7.585852       6.478619 15.75501       8.022915 23.69148 8.640423 31.95778 9.561362 -8.266300      12.88707 
1 1 1 -17 18 35 o 40.88566 4.501769 21.75171       4.411147 18.15759       6.917368 24.21493       5.726591 34.81068 8.276335 42.40155 5.685287 -7.590874      10.04093 
1 1 1 -17 18 36 f 13.95885 6.108414 0.6277257E-01  3.953515 6.671293       8.498428 -1.762418      4.466226 22.99535 9.449728 13.41461 6.128125 9.580735       11.26283 
1 1 1 -17 18 37 o 30.48575 5.949299 13.07054       4.261045 10.34894       6.530579 15.08813       5.622845 25.44803 8.730370 31.68871 7.413886 -6.240675      11.45360 
1 1 1 -17 18 38 f 26.16486 8.363689 11.24394       6.022406 8.288126       9.185370 13.47267       7.976027 23.23466 9.710028 27.42887 9.634768 -4.194216      13.67894 
1 1 1 -17 18 39 o 23.65930 7.070570 8.771439       4.389234 6.288858       6.831269 10.51693       5.728066 20.75169 8.493781 25.00776 8.170653 -4.256071      11.78575 
1 1 1 -17 18 40 o 32.98323 5.792673 15.88522       4.486156 10.65317       6.848954 19.81681       5.937073 23.99435 8.861751 35.48869 7.113041 -11.49434      11.36336 
1 1 1 -17 18 41 o 25.69802 7.021451 10.80075       4.521072 18.01089       10.00058 8.948629       5.068597 27.35777 10.56995 22.71397 7.693335 4.643793       13.07330 
1 1 1 -17 19 1  o 159.8084 3.269032 312.0058       12.73078 342.8630       26.02018 302.2945       14.59726 166.7740 6.414404 157.2267 3.809858 9.547211       7.460536 
1 1 1 -17 19 2  o 150.9245 3.187671 278.2271       11.72383 268.7115       22.86612 281.6206       13.65525 147.6434 6.370382 151.7782 3.691938 -4.134796      7.362892 
1 1 1 -17 19 3  o 102.0616 2.949360 127.2897       7.327748 127.9290       15.28832 127.0990       8.349292 101.8180 6.190934 101.9404 3.365604 -0.1223679     7.046628 
1 1 1 -17 19 4  o 45.95394 5.155011 26.21025       5.673420 35.41265       9.484008 21.08194       7.079917 53.04712 7.549439 40.72480 7.406763 12.32232       10.57611 
1 1 1 -17 19 5  o 61.20163 3.071290 45.85357       4.565935 48.74821       8.880643 44.81344       5.323442 62.73149 5.877738 60.44479 3.630816 2.286694       6.908736 
1 1 1 -17 19 6  o 57.02225 3.255708 39.84443       4.505233 27.35154       8.449732 44.80657       5.325326 46.46083 7.734934 60.44030 3.632388 -13.97948      8.545376 
1 1 1 -17 19 7  o 166.9496 3.065826 340.3521       12.47294 332.0412       20.64971 345.1261       15.65054 164.4902 5.157923 168.0144 3.822494 -3.524231      6.419940 
1 1 1 -17 19 8  o 165.0986 3.046277 332.8427       12.25601 311.2917       19.97510 345.8542       15.52091 159.2602 5.153682 168.1950 3.786763 -8.934753      6.395312 
1 1 1 -17 19 9  o 88.29031 2.790165 95.25032       5.995611 105.9722       11.31015 91.05968       7.070882 92.84885 5.017325 86.26729 3.369982 6.581566       6.044032 
1 1 1 -17 19 10 o 201.3886 3.805555 495.8983       18.67623 507.7476       27.35900 485.5582       25.55729 203.3144 5.527122 198.8897 5.277771 4.424728       7.642247 
1 1 1 -17 19 11 o 72.80103 2.878990 64.80888       5.097492 60.30167       9.281143 66.75580       6.099883 69.88136 5.494253 73.83691 3.399215 -3.955551      6.460764 
1 1 1 -17 19 12 o 173.1580 3.084329 366.2010       13.01486 372.5659       22.05151 362.7987       16.12236 174.2012 5.200408 172.2396 3.841135 1.961639       6.465181 
1 1 1 -17 19 13 f 145.9138 2.913090 259.9783       10.35825 260.9316       17.76497 259.4873       12.74986 145.7896 5.007801 145.6943 3.591095 0.9535217E-01  6.162307 
1 1 1 -17 19 14 o 145.9689 3.292408 260.3537       11.71143 269.3968       17.95791 253.6611       15.44878 148.1289 4.981938 143.8513 4.412229 4.277588       6.654883 
1 1 1 -17 19 15 o 138.0182 3.260898 232.7793       10.96755 235.8365       16.81889 230.5175       14.46648 138.5636 4.989092 137.1257 4.334647 1.437927       6.609100 
1 1 1 -17 19 16 o 109.6073 3.032973 146.8862       8.093318 153.6518       19.46890 145.4727       8.898650 111.2283 7.221784 109.0366 3.352988 2.191650       7.962204 
1 1 1 -17 19 17 f 60.37144 3.067678 44.65240       4.498332 50.63662       9.044785 42.68578       5.185064 63.86325 5.877690 58.95837 3.626428 4.904873       6.906390 
1 1 1 -17 19 18 o 76.34628 2.856287 71.31036       5.304683 89.37321       10.52240 65.15541       6.142336 85.13198 5.095393 72.89998 3.467503 12.23200       6.163328 
1 1 1 -17 19 19 o 30.94122 4.642545 12.00862       3.392599 12.93103       7.594932 11.77869       3.791937 31.75769 9.251854 30.51536 5.290929 1.242332       10.65790 
1 1 1 -17 19 20 o 59.25402 3.474294 43.12524       4.994716 44.64836       8.870955 42.41826       6.043735 59.79076 6.177197 58.64649 4.257899 1.144264       7.502497 
1 1 1 -17 19 21 o 44.16005 4.172213 24.14525       4.436625 22.89135       8.104943 24.68172       5.301432 42.07576 8.199443 44.50592 4.972988 -2.430157      9.589655 
1 1 1 -17 19 22 o 129.2072 3.124772 204.3540       9.838781 235.9178       16.31387 186.3109       12.33439 138.2985 4.848145 123.0959 4.117650 15.20261       6.360783 
1 1 1 -17 19 23 o 111.4909 3.092603 152.3439       8.394213 148.9516       13.51292 154.4756       10.71165 109.7035 5.068364 112.0691 3.928315 -2.365654      6.412485 
1 1 1 -17 19 24 o 51.21963 3.959606 32.45598       4.903899 23.43734       11.15772 34.61516       5.459458 41.62420 10.88031 52.84092 4.276285 -11.21671      11.69049 
1 1 1 -17 19 25 o 69.21909 3.190051 58.90993       5.366490 59.44555       9.370286 58.64849       6.546452 68.88625 5.631020 68.90852 3.914597 -0.2227783E-01 6.858021 
1 1 1 -17 19 26 o 66.19295 3.512048 54.04943       5.644834 54.53126       12.61032 53.92869       6.312607 64.79813 8.167003 66.01397 3.942025 -1.215843      9.068600 
1 1 1 -17 19 27 o 89.91788 3.074042 99.47288       6.725937 100.6809       11.31396 98.81261       8.364454 89.66657 5.200143 89.37461 3.849522 0.2919617      6.469954 
1 1 1 -17 19 28 o 23.25949 5.904586 7.088664       3.352119 13.16463       6.739062 5.091084       3.864060 31.16078 8.595869 20.31364 6.714648 10.84714       10.90759 
1 1 1 -17 19 29 o 58.97002 3.414367 43.11309       4.885584 38.95985       8.349425 45.27551       6.024652 54.89302 6.359208 60.19868 4.131909 -5.305656      7.583680 
1 1 1 -17 19 30 o 45.27613 4.574247 25.95530       4.977763 22.19595       7.399954 29.06224       6.727269 40.43297 7.792846 47.34218 5.963160 -6.909206      9.812631 
1 1 1 -17 19 31 o 14.84503 6.021631 1.444027       3.396442 10.53341       6.577586 -1.860650      3.966101 27.51586 8.734536 12.86899 5.838250 14.64687       10.50606 
1 1 1 -17 19 32 o 41.56807 4.318872 22.03071       4.311184 34.09775       7.815468 16.75290       5.168702 50.53791 6.496081 35.34680 6.228062 15.19112       8.999324 
1 1 1 -17 19 33 o 39.00717 5.986122 20.41961       5.508739 21.63705       7.218017 18.72128       8.525207 38.94276 7.876907 34.87502 9.686460 4.067749       12.48492 
1 1 1 -17 19 34 o 26.97847 6.092107 10.07957       3.910115 7.657276       6.321854 11.58035       4.976101 23.45285 8.537992 28.37772 7.188728 -4.924864      11.16132 
1 1 1 -17 19 35 o 56.01191 3.793694 40.08438       5.147646 44.23654       8.329043 37.51818       6.547919 56.84890 6.107937 53.19422 5.114243 3.654675       7.966328 
1 1 1 -17 19 36 o 16.40526 6.536813 2.722640       3.926909 12.32661       6.540960 -2.689640      4.910279 27.75045 8.697225 13.45289 6.245397 14.29757       10.70732 
1 1 1 -17 19 37 o 42.81921 4.644008 24.45642       4.768332 26.33440       7.417139 23.13350       6.225246 41.70090 7.577900 39.95749 6.625205 1.743412       10.06568 
1 1 1 -17 19 38 o 14.48475 6.409032 0.3187512      4.465045 -3.677242      8.622035 1.783135       5.219450 16.68955 7.911838 16.42097 7.103747 0.2685757      10.63299 
1 1 1 -17 19 39 o 69.32228 4.313791 64.38428       7.251212 61.08108       9.480476 69.04071       11.25615 64.72886 6.081542 67.15095 6.980370 -2.422089      9.258009 
1 1 1 -17 19 40 o 20.91029 6.906526 7.016001       4.088304 7.286431       6.806746 6.863389       5.113380 20.82699 8.496050 20.45156 7.637312 0.3754311      11.42416 
1 1 1 -17 19 41 o 13.07124 5.844512 0.1451306      3.813421 8.016248       6.535896 -3.917340      4.695502 21.05166 8.418180 11.86006 5.682006 9.191604       10.15633 
1 1 1 -17 20 1  o 32.91889 4.080792 13.46352       3.203551 17.25649       7.054559 12.47815       3.595677 36.61251 8.119699 31.54631 4.830874 5.066196       9.448113 
1 1 1 -17 20 2  o 121.4793 3.002221 180.2399       8.887530 198.1376       18.31400 174.7265       10.16466 126.7908 5.943876 119.5057 3.494095 7.285103       6.894807 
1 1 1 -17 20 3  o 102.5856 2.961237 128.6275       7.395049 129.1309       14.76748 128.4590       8.543434 102.3058 5.949049 102.4644 3.426374 -0.1585693     6.865219 
1 1 1 -17 20 4  o 301.6606 4.837598 1115.483       35.56186 1152.780       72.86255 1103.820       40.74430 303.6483 9.859924 299.7828 5.577300 3.865479       11.32804 
1 1 1 -17 20 5  o 95.01353 4.695082 110.8824       10.83721 0.000000       0.000000 110.8824       10.83721 ?        ?        95.01353 4.695082 0.000000       4.695082 
1 1 1 -17 20 6  o 117.4950 2.834276 168.5525       8.115174 164.3176       13.81478 170.7839       10.02768 115.6703 4.912197 118.1573 3.486417 -2.486908      6.023685 
1 1 1 -17 20 7  o 153.8006 2.988696 288.8761       11.20149 308.0540       19.36224 279.2286       13.73293 158.4174 5.021870 151.1148 3.729239 7.302628       6.255110 
1 1 1 -17 20 8  o 80.28226 2.889038 78.80095       5.642872 80.01305       10.39606 78.29469       6.718753 80.57171 5.324660 79.96468 3.456057 0.6070251      6.347940 
1 1 1 -17 20 9  o 23.73097 7.268275 6.970249       4.598320 2.211977       7.314577 10.07953       5.912816 21.53699 8.799088 28.20945 8.147189 -6.672459      11.99169 
1 1 1 -17 20 10 o 355.3880 6.371365 1555.230       55.17867 1650.234       100.7089 1514.475       65.96041 361.7228 11.43938 349.8300 7.737314 11.89285       13.81034 
1 1 1 -17 20 11 o 73.18774 3.407690 65.60792       6.060948 58.95507       9.716895 69.84476       7.754330 69.00806 5.832757 75.41435 4.236466 -6.406288      7.208932 
1 1 1 -17 20 12 o 223.0660 3.998513 608.9308       21.73542 600.7415       31.58321 616.2990       29.95819 220.9299 5.871523 223.9808 5.488688 -3.050873      8.037442 
1 1 1 -17 20 13 o 83.15275 3.284032 84.63811       6.641484 76.03831       10.39697 90.56631       8.632248 78.47691 5.470875 85.90668 4.135599 -7.429779      6.858109 
1 1 1 -17 20 14 o 80.50528 2.877939 79.26496       5.636931 97.95420       10.70700 72.09846       6.630181 89.20188 4.944932 76.69689 3.557099 12.50499       6.091413 
1 1 1 -17 20 15 o 35.65907 4.393068 15.81833       3.736850 15.96570       7.685755 15.77271       4.276330 35.09631 8.957591 35.48342 5.091134 -0.3871117     10.30330 
1 1 1 -17 20 16 o 105.0493 3.036261 134.9810       7.764482 123.9192       18.27108 137.4189       8.577528 99.63419 7.582166 105.9538 3.326197 -6.319572      8.279663 
1 1 1 -17 20 17 f 173.0913 3.110823 366.2950       13.12159 400.5845       23.27094 350.3110       15.88822 180.3556 5.300536 169.1191 3.855197 11.23650       6.554253 
1 1 1 -17 20 18 o 124.6999 2.826514 190.0402       8.589211 188.0417       15.14501 190.9878       10.42852 123.5385 5.041324 124.8753 3.430217 -1.336823      6.097650 
1 1 1 -17 20 19 o 32.57541 4.548536 13.28417       3.512441 16.19239       7.589292 12.49143       3.962347 35.22184 8.853268 31.40914 5.369571 3.812696       10.35435 
1 1 1 -17 20 20 o 90.25118 3.128357 99.80040       6.869866 111.0235       11.52919 93.62177       8.554367 94.79542 5.008632 87.24692 4.034400 7.548500       6.431391 
1 1 1 -17 20 21 o 137.8801 2.855296 232.5744       9.593757 247.1142       17.20187 226.0100       11.55830 141.4530 4.998165 135.7395 3.497143 5.713440       6.100136 
1 1 1 -17 20 22 o 35.89434 5.046987 16.21836       4.292869 3.066926       10.51577 18.84838       4.702564 25.21703 10.45160 38.73127 5.106681 -13.51424      11.63246 
1 1 1 -17 20 23 o 40.00592 4.580338 20.00391       4.384965 24.14580       10.79655 19.18573       4.798559 42.28212 10.52086 39.03339 5.171884 3.248730       11.72335 
1 1 1 -17 20 24 o 29.52532 5.286333 11.13925       3.663840 20.44136       7.561935 8.285699       4.188274 39.39693 8.145718 25.23410 6.699627 14.16283       10.54693 
1 1 1 -17 20 25 o 64.47562 3.266315 51.21221       5.115316 49.72297       8.879509 51.95193       6.258089 62.76925 5.873249 64.76939 3.984215 -2.000134      7.097114 
1 1 1 -17 20 26 o 49.66309 4.000139 30.68208       4.800189 24.85609       11.19085 31.99568       5.313861 42.16958 10.83313 50.62872 4.349123 -8.459137      11.67355 
1 1 1 -17 20 27 o 27.54939 5.736428 9.894526       3.725823 3.959384       6.944840 12.29314       4.414964 21.85941 8.698631 30.67177 6.121394 -8.812359      10.63662 
1 1 1 -17 20 28 o 60.25809 3.399901 45.00356       4.972244 35.73753       8.467804 49.87975       6.142774 52.33736 6.799917 63.24514 4.006259 -10.90778      7.892337 
1 1 1 -17 20 29 o 23.72534 6.149895 7.487006       3.584642 0.4104050      6.602174 10.44520       4.268621 18.54245 8.005400 27.97315 6.400880 -9.430702      10.24977 
1 1 1 -17 20 30 o 18.32721 6.704838 3.782452       3.905610 6.144618       6.510322 2.454354       4.881602 22.94734 8.607724 17.93174 7.238775 5.015604       11.24690 
1 1 1 -17 20 31 o 37.49245 4.557523 18.03640       4.078554 22.37830       7.408808 16.14843       4.885463 40.03555 7.874626 34.83832 5.969208 5.197224       9.881355 
1 1 1 -17 20 32 o 14.73693 6.517666 -0.5833234     4.612638 -0.6652079     5.944033 -0.4593675     7.313306 16.54653 7.354003 18.29217 8.141868 -1.745638      10.97139 
1 1 1 -17 20 33 o 46.98612 4.141601 28.30535       4.693644 32.48137       7.587494 25.71672       5.973807 48.64278 6.568663 43.80299 5.733970 4.839790       8.719274 
1 1 1 -17 20 34 o 62.19921 3.665183 49.19195       5.530792 44.23041       8.696305 52.56196       7.167074 56.61690 6.416047 63.49532 4.664506 -6.878414      7.932419 
1 1 1 -17 20 35 o 10.66250 5.163481 -5.738427      4.132474 2.085253       8.833873 -7.930155      4.675617 20.23514 8.980863 10.71299 5.253910 9.522147       10.40478 
1 1 1 -17 20 36 o 35.50362 5.209451 17.17790       4.373142 17.71809       6.897303 16.81475       5.655146 33.27238 8.482298 33.64793 7.119308 -0.3755417     11.07402 
1 1 1 -17 20 37 o 11.17273 5.310435 -3.644812      3.934582 -1.943121      6.778563 -4.509449      4.831860 15.82284 7.342997 12.18110 5.816266 3.641741       9.367419 
1 1 1 -17 20 38 o 41.95479 4.669841 23.96034       4.693591 23.15758       7.149961 24.56823       6.221871 37.65705 8.036388 40.62960 6.503336 -2.972549      10.33813 
1 1 1 -17 20 39 o 21.27275 7.503978 7.440996       4.841953 17.08850       6.845968 -2.215455      6.849143 30.72472 8.732781 15.26125 7.178912 15.46348       11.30479 
1 1 1 -17 20 40 o 37.03012 5.160649 19.57088       4.530545 24.00562       7.380332 16.88917       5.739160 36.90891 8.395612 31.79130 7.525558 5.117613       11.27477 
1 1 1 -17 21 1  o 85.37267 3.191849 89.20608       6.628753 86.60569       11.91929 90.37048       7.975965 83.66676 5.883547 85.84583 3.822243 -2.179062      7.016100 
1 1 1 -17 21 2  o 76.38125 3.056767 71.39559       5.678153 81.32214       11.76891 68.38385       6.482559 81.04916 6.001279 74.69008 3.571972 6.359077       6.983863 
1 1 1 -17 21 3  o 229.9860 3.994925 647.4658       22.38959 663.0759       45.14464 642.3738       25.78407 230.9953 8.032086 228.9011 4.622400 2.094193       9.267200 
1 1 1 -17 21 4  f 79.68091 3.088813 77.68606       5.986303 94.44237       12.89146 73.07955       6.759254 87.37251 6.092860 77.21923 3.601932 10.15328       7.077913 
1 1 1 -17 21 5  o 96.27117 4.021737 113.6391       9.414308 0.000000       0.000000 113.6391       9.414308 ?        ?        96.27117 4.021737 0.000000       4.021737 
1 1 1 -17 21 6  o 225.2478 4.031312 621.0356       22.12805 628.1506       32.60607 614.9610       30.12819 225.8596 5.929246 223.6944 5.526903 2.165268       8.105716 
1 1 1 -17 21 7  o 74.79385 4.222021 68.72034       7.663997 59.65971       9.308372 87.78925       13.50385 69.45676 5.545523 84.10587 6.642521 -14.64911      8.653087 
1 1 1 -17 21 8  o 101.6541 3.172769 126.3939       7.849957 124.9657       12.33444 127.3662       10.17707 100.7835 5.038176 101.9132 4.106257 -1.129730      6.499582 
1 1 1 -17 21 9  o 113.6432 3.971557 158.2735       10.98177 169.0395       14.08739 141.5968       17.53311 117.2668 4.940760 106.8846 6.766161 10.38211       8.378070 
1 1 1 -17 21 10 o 76.91926 3.323199 72.46113       6.214436 75.51683       10.33346 70.72980       7.778196 78.19452 5.457173 75.87288 4.223510 2.321640       6.900636 
1 1 1 -17 21 11 o 221.0960 3.554671 597.9214       19.15210 647.2505       32.91419 572.6695       23.54936 229.1896 5.898114 216.1347 4.471143 13.05496       7.401275 
1 1 1 -17 21 12 o 39.28223 4.307160 19.13427       4.055562 19.64941       8.181857 18.96648       4.669581 38.94007 8.826722 38.98388 5.032682 -0.4381180E-01 10.16066 
1 1 1 -17 21 13 o 307.4824 4.445680 1159.421       33.31152 1296.028       57.63638 1090.901       40.81968 323.3267 7.315079 297.6839 5.627017 25.64282       9.228960 
1 1 1 -17 21 14 o 51.51792 3.441249 32.61194       4.295494 30.29382       8.390935 33.43517       5.000384 48.92562 7.257479 52.09600 3.968658 -3.170383      8.271714 
1 1 1 -17 21 15 o 125.6937 3.138035 193.1801       9.611860 224.6859       23.78980 187.0336       10.50770 134.3347 7.294556 123.5775 3.492754 10.75727       8.087637 
1 1 1 -17 21 16 o 86.31024 2.851816 91.14675       5.989951 102.8807       11.44943 86.72485       7.028554 91.28479 5.168053 84.10831 3.436423 7.176483       6.206269 
1 1 1 -17 21 17 o 59.28665 3.254407 43.13978       4.683774 48.31003       9.401880 41.43307       5.401798 62.16597 6.292773 58.01456 3.842549 4.151413       7.373207 
1 1 1 -17 21 18 o 145.5191 2.942867 259.0012       10.43582 251.2039       17.97549 262.9653       12.81698 142.6532 5.179464 146.4924 3.590332 -3.839203      6.302168 
1 1 1 -17 21 19 o 36.27139 4.295551 16.39138       3.723201 5.662863       7.413074 20.01066       4.305655 24.27815 9.168221 40.09004 4.483952 -15.81189      10.20598 
1 1 1 -17 21 20 o 65.02485 3.764491 52.07554       5.939653 38.06965       12.06119 56.55968       6.824558 53.92348 9.526910 67.69823 4.156811 -13.77475      10.39428 
1 1 1 -17 21 21 o 45.03893 4.435155 25.23615       4.804715 24.42031       11.47717 25.40951       5.290628 42.48859 10.99961 45.09523 4.892689 -2.606647      12.03868 
1 1 1 -17 21 22 o 96.51044 2.781613 114.1588       6.535124 101.7705       12.12372 119.2326       7.758825 90.32923 5.534283 98.53229 3.235718 -8.203056      6.410784 
1 1 1 -17 21 23 o 48.70994 3.322177 29.27420       3.919848 30.67922       8.400908 28.88318       4.431863 48.76988 7.292228 48.29008 3.796617 0.4798012      8.221368 
1 1 1 -17 21 24 f 96.68914 3.127461 114.9509       7.359257 114.5112       12.33811 115.1938       9.168830 95.69362 5.311740 96.54776 3.905105 -0.8541412     6.592756 
1 1 1 -17 21 25 o 69.96222 3.616364 60.53311       6.144625 53.58103       14.11670 62.15816       6.825099 63.17288 9.460680 70.79049 3.972314 -7.617611      10.26079 
1 1 1 -17 21 26 o 82.89478 3.172540 84.75269       6.396878 85.47090       10.96543 84.38216       7.875909 82.25854 5.501903 82.44678 3.931370 -0.1882401     6.762146 
1 1 1 -17 21 27 o 57.66984 3.533345 41.29544       4.941755 37.15296       8.527836 43.38979       6.063631 53.41182 6.698818 58.87567 4.255012 -5.463848      7.935949 
1 1 1 -17 21 28 o 69.36604 3.289729 59.65411       5.545028 52.39083       9.283126 63.68316       6.913996 63.69699 6.053189 71.38960 3.990155 -7.692612      7.249995 
1 1 1 -17 21 29 o 11.83166 5.456033 -2.496403      3.655654 7.434834       6.814681 -6.508944      4.331653 24.36514 8.865372 10.96262 5.303438 13.40252       10.33060 
1 1 1 -17 21 30 o 32.49833 5.042645 13.75833       3.864171 14.30696       7.024704 13.52030       4.627141 31.44279 8.814827 31.71487 6.209388 -0.2720776     10.78228 
1 1 1 -17 21 31 o 18.98719 7.241292 3.984786       4.652138 0.7005071      6.103515 8.538109       7.186612 17.67267 7.663431 25.01428 9.103709 -7.341610      11.89982 
1 1 1 -17 21 32 o 22.29749 6.548638 6.919369       3.791741 1.044088       6.374896 10.13583       4.716805 18.01333 7.821414 26.64535 7.125967 -8.632017      10.58083 
1 1 1 -17 21 33 o 77.20296 3.783503 75.84811       7.096421 51.90965       13.54812 84.89909       8.330647 57.00901 10.12293 81.27089 4.220835 -24.26188      10.96764 
1 1 1 -17 21 34 o 42.61138 5.719316 24.77848       5.789069 21.65193       7.427392 29.61763       9.240336 37.63083 8.320719 43.45312 9.021807 -5.822289      12.27303 
1 1 1 -17 21 35 o 61.03635 4.255591 48.61224       6.290072 45.84959       12.76258 49.49859       7.229032 51.49961 10.52524 60.93614 4.909738 -9.436527      11.61406 
1 1 1 -17 21 36 o 16.10319 6.620699 2.442616       4.174295 -0.3210927     7.207061 3.837782       5.120649 17.11240 7.804824 18.21930 7.392500 -1.106899      10.75009 
1 1 1 -17 21 37 o 34.82656 5.692988 17.29904       4.664783 22.82873       7.541127 13.87174       5.936933 36.88736 8.555518 28.85032 8.109229 8.037031       11.78798 
1 1 1 -17 21 38 o 34.71719 6.289092 18.02249       5.124846 16.68952       7.260392 19.34613       7.234928 29.90416 9.127962 32.86423 8.841552 -2.960070      12.70798 
1 1 1 -17 21 39 o 25.07333 6.680059 9.997705       4.154789 12.92783       7.095032 8.468536       5.125533 25.62893 9.079660 22.17982 7.728337 3.449108       11.92340 
1 1 1 -17 22 1  o 80.99644 3.213263 80.34971       6.329736 73.71757       11.43062 83.28281       7.601632 77.04002 6.139349 82.38069 3.796774 -5.340675      7.218524 
1 1 1 -17 22 2  o 93.67905 3.285835 107.4537       7.489472 113.8145       14.00592 104.9065       8.863082 95.87229 6.025375 92.46083 3.942657 3.411461       7.200673 
1 1 1 -17 22 3  o 303.1068 5.610404 1131.266       41.44059 1238.254       76.39232 1086.654       49.32964 313.4084 10.01523 296.3230 6.831348 17.08533       12.12321 
1 1 1 -17 22 4  o 73.82608 3.165354 66.75024       5.681435 78.94813       11.98547 63.21498       6.452435 79.75375 6.215969 71.77218 3.701700 7.981567       7.234698 
1 1 1 -17 22 5  o 182.8807 4.074474 409.7348       18.15832 0.000000       0.000000 409.7348       18.15832 ?        ?        182.8807 4.074474 0.000000       4.074474 
1 1 1 -17 22 6  o 179.1678 3.525496 392.7254       15.39275 409.3036       31.63110 387.5813       17.61979 181.6306 7.160461 177.8719 4.064968 3.758682       8.233843 
1 1 1 -17 22 7  f 128.0497 2.932867 200.3486       9.151809 173.5799       14.99961 216.2233       11.55099 118.7214 5.197192 132.8887 3.570167 -14.16737      6.305307 
1 1 1 -17 22 8  o 124.0581 3.385119 188.3723       10.22419 191.4443       15.15820 185.8081       13.84875 124.7370 4.996845 122.9692 4.629717 1.767830       6.811956 
1 1 1 -17 22 9  o 103.6330 3.380441 131.4974       8.525625 133.8653       12.88372 129.6527       11.37149 104.2453 5.087005 102.6993 4.555076 1.545952       6.828348 
1 1 1 -17 22 10 f 32.86604 4.854617 13.54552       3.771238 16.58933       7.099974 12.34925       4.451046 35.78853 8.302086 31.12032 6.087385 4.668211       10.29470 
1 1 1 -17 22 11 o 251.6617 3.864421 775.7266       23.69942 807.5546       39.57576 757.9315       29.59205 255.6415 6.352750 248.3701 4.889221 7.271439       8.016353 
1 1 1 -17 22 12 o 112.0977 2.863174 153.6627       7.814929 170.4340       14.28585 146.5005       9.335644 117.6364 4.994796 109.3529 3.507841 8.283478       6.103518 
1 1 1 -17 22 13 o 159.6615 3.061069 311.7023       11.90993 321.6000       20.61254 306.7419       14.59233 161.5446 5.242984 158.2386 3.784216 3.305939       6.466001 
1 1 1 -17 22 14 o 136.0912 2.928153 226.4347       9.710911 234.8402       17.19813 222.5004       11.76608 138.0206 5.122187 134.7425 3.586555 3.278076       6.253013 
1 1 1 -17 22 15 o 87.45853 3.132823 93.70141       6.666102 94.84649       17.28078 93.50122       7.225325 86.62743 8.286903 87.32303 3.401920 -0.6955948     8.958003 
1 1 1 -17 22 16 o 46.84954 3.682519 27.06879       4.170457 15.42438       8.108159 31.25761       4.863061 34.34197 9.411039 50.31404 3.999171 -15.97207      10.22551 
1 1 1 -17 22 17 o 71.66775 2.972835 62.95549       5.180679 69.13097       10.07827 60.73762       6.039752 74.56620 5.586980 70.30472 3.536678 4.261482       6.612295 
1 1 1 -17 22 18 o 50.84053 3.965849 31.94123       4.874557 28.53351       8.810281 33.44462       5.851844 47.02923 7.971949 51.89154 4.677813 -4.862312      9.243046 
1 1 1 -17 22 19 o 129.1643 4.491219 205.8826       14.11502 219.4729       22.89727 197.5528       17.92624 132.1067 7.139029 125.9643 5.855930 6.142441       9.233507 
1 1 1 -17 22 20 o 76.65585 3.115281 72.15318       5.807281 63.60451       14.05008 73.91454       6.377545 70.28465 8.367251 77.53409 3.383543 -7.249435      9.025478 
1 1 1 -17 22 21 o 29.21103 4.892205 10.84107       3.359438 15.59090       7.685071 9.719015       3.735223 34.19116 9.074066 27.43696 5.769845 6.754196       10.75313 
1 1 1 -17 22 22 o 47.47276 3.446838 27.85383       3.960345 15.76095       8.161224 31.57857       4.529381 34.23012 9.466054 50.50944 3.705642 -16.27932      10.16553 
1 1 1 -17 22 23 o 90.72519 2.799765 101.0714       6.182520 109.8276       12.26153 98.08627       7.159218 93.61371 5.397772 89.24052 3.297729 4.373184       6.325422 
1 1 1 -17 22 24 f 86.53843 2.821087 92.05806       5.941291 87.20220       11.29558 93.91530       6.985689 83.14989 5.607353 87.27015 3.290684 -4.120255      6.501616 
1 1 1 -17 22 25 o 48.94511 3.570065 29.75421       4.228874 27.47931       11.81910 30.08821       4.528680 43.79533 11.07056 49.15615 3.810305 -5.360821      11.70793 
1 1 1 -17 22 26 f 38.61307 4.500383 18.86341       4.155385 24.58682       7.719018 16.52796       4.930840 42.83015 7.677683 35.64795 5.881001 7.182209       9.671246 
1 1 1 -17 22 27 o 44.69428 4.021814 25.09480       4.333563 24.20183       7.853839 25.48568       5.196169 42.15767 7.935982 44.74741 4.842235 -2.589745      9.296616 
1 1 1 -17 22 28 o 26.20061 5.964077 9.176808       3.722168 17.97802       7.367957 6.160980       4.312996 35.64967 8.584373 21.72614 7.089387 13.92354       11.13332 
1 1 1 -17 22 29 o 57.48561 4.144005 41.78653       5.766218 40.24698       8.501368 43.09825       7.847189 55.02014 6.463750 57.49290 5.674901 -2.472767      8.601428 
1 1 1 -17 22 30 o 24.31594 7.639055 8.271921       5.043140 8.737865       6.479224 7.555755       8.032732 25.03133 8.691117 24.47904 9.468956 0.5522900      12.85289 
1 1 1 -17 22 31 o 79.36938 3.291464 79.02611       6.352355 69.10545       9.798162 86.21947       8.343352 72.26804 5.607529 82.19489 4.179144 -9.926857      6.993541 
1 1 1 -17 22 32 o 24.04464 6.558459 8.203199       3.948418 14.19662       6.681272 4.986696       4.894560 30.37996 8.624529 19.91395 7.464847 10.46601       11.40642 
1 1 1 -17 22 33 o 20.30161 7.614316 5.402958       5.093991 3.629617       6.811885 7.652796       7.672673 19.83975 8.331299 23.39990 9.195800 -3.560150      12.40860 
1 1 1 -17 22 34 o 23.38864 7.282799 8.176211       4.594254 7.388951       10.04657 8.384375       5.166061 23.54118 10.01253 23.51561 7.763541 0.2556992E-01  12.66978 
1 1 1 -17 22 35 o 19.84270 6.934127 5.675767       4.127902 5.580016       6.573373 5.738112       5.304183 20.57376 8.365432 20.22171 7.727240 0.3520508      11.38818 
1 1 1 -17 22 36 o 28.68275 6.885758 12.58096       4.751845 10.30568       9.346968 13.37397       5.518146 24.02224 9.895023 28.82314 7.707176 -4.800900      12.54241 
1 1 1 -17 22 37 o 9.055152 4.478573 -6.978653      3.646053 -1.401398      6.308730 -9.775806      4.467760 15.25509 7.081041 9.517801 4.748744 5.737292       8.525944 
1 1 1 -17 22 38 o 47.58929 5.045999 31.77277       5.762774 29.83921       7.953501 33.90972       8.361374 42.24690 8.018738 45.33716 7.852404 -3.090260      11.22321 
1 1 1 -17 22 39 o 27.85582 6.348824 12.05804       4.213445 13.38638       7.209420 11.36896       5.192554 25.71208 9.148199 25.53378 7.704072 0.1782932      11.96003 
1 1 1 -17 23 1  o 72.97683 3.526397 65.36986       6.252661 0.000000       0.000000 65.36986       6.252661 ?        ?        72.97683 3.526397 0.000000       3.526397 
1 1 1 -17 23 2  o 189.9172 3.602877 441.7469       16.67439 476.2289       34.49327 431.2318       19.04786 195.5367 7.251420 187.4798 4.169227 8.056824       8.364540 
1 1 1 -17 23 3  o 54.25621 3.511038 36.18848       4.617245 42.94588       9.556005 34.13041       5.273703 58.46375 6.836308 52.58976 4.148658 5.873981       7.996654 
1 1 1 -17 23 4  o 92.45232 3.545013 104.7993       7.971981 0.000000       0.000000 104.7993       7.971981 ?        ?        92.45232 3.545013 0.000000       3.545013 
1 1 1 -17 23 5  o 97.59157 3.110740 116.5900       7.388513 116.0983       14.99873 116.7475       8.490099 96.66093 6.403575 97.58447 3.576277 -0.9235458     7.334544 
1 1 1 -17 23 6  o 24.00654 6.395192 7.380163       3.808231 1.764275       8.075223 8.986365       4.318625 22.01061 9.143880 26.42925 6.698015 -4.418642      11.33463 
1 1 1 -17 23 7  o 138.0766 3.220113 233.2150       10.83496 260.9255       23.13778 225.4317       12.26256 145.0119 6.564620 135.6150 3.714040 9.396942       7.542435 
1 1 1 -17 23 8  o 81.32977 3.597785 81.15125       7.112868 82.13545       10.62038 80.35071       9.578362 81.48038 5.378817 80.69189 4.894091 0.7884979      7.272125 
1 1 1 -17 23 9  o 111.2871 2.897831 151.4991       7.852073 158.4894       13.98248 148.2793       9.489684 113.3713 5.073956 109.9895 3.545129 3.381790       6.189747 
1 1 1 -17 23 10 o 219.0392 4.063901 588.4574       21.69208 582.6207       31.34750 593.8203       30.04820 217.0677 5.931696 219.3055 5.627192 -2.237808      8.176204 
1 1 1 -17 23 11 o 134.5068 2.958650 221.2381       9.697819 209.2926       16.36639 227.7017       12.03894 130.2470 5.166678 136.2867 3.628150 -6.039642      6.313323 
1 1 1 -17 23 12 o 65.91388 3.189572 53.29036       5.108041 52.52095       9.570983 53.59679       6.040206 64.86029 6.128035 66.01706 3.770241 -1.156769      7.194965 
1 1 1 -17 23 13 o 100.2704 2.861046 123.0530       6.983761 112.7974       12.23692 128.0070       8.504853 95.48036 5.279785 102.1735 3.420623 -6.693123      6.291008 
1 1 1 -17 23 14 o 68.87913 3.318923 58.24001       5.554448 76.08323       15.24947 55.51065       5.964152 77.40894 8.209007 67.18800 3.656459 10.22094       8.986517 
1 1 1 -17 23 15 o 35.12008 4.601131 15.43777       3.843210 12.42343       7.556493 16.48956       4.463634 31.02275 9.278720 36.18763 5.211732 -5.164873      10.64222 
1 1 1 -17 23 16 o 109.4127 3.557573 147.0097       9.472836 141.6308       18.70935 148.8640       10.98493 106.0791 7.281735 109.9591 4.106707 -3.880005      8.359947 
1 1 1 -17 23 17 o 95.41604 3.543272 111.8930       8.224451 97.54788       16.38810 116.7222       9.508567 87.64616 7.752769 97.33755 4.017288 -9.691383      8.731783 
1 1 1 -17 23 18 o 102.4623 3.086540 128.8017       7.697981 111.5634       17.63119 132.8618       8.556639 93.62309 7.798676 103.9953 3.380888 -10.37225      8.499986 
1 1 1 -17 23 19 o 30.57762 5.538043 11.96812       3.974741 20.57061       7.631117 8.765433       4.656213 39.53173 8.190952 25.95575 7.139207 13.57597       10.86554 
1 1 1 -17 23 20 o 44.70801 3.740746 24.77598       4.038163 22.36424       8.557570 25.46685       4.580172 40.96173 8.833175 45.23193 4.203382 -4.270199      9.782300 
1 1 1 -17 23 21 o 99.06089 2.841143 120.4682       6.851452 115.9019       12.74572 122.3239       8.125223 96.19971 5.459350 99.67661 3.349835 -3.476898      6.405147 
1 1 1 -17 23 22 o 149.4618 3.004008 274.4775       10.94126 272.0296       19.11027 275.6711       13.34493 147.3903 5.329388 149.4827 3.663440 -2.092438      6.467083 
1 1 1 -17 23 23 o 98.71906 2.841427 119.8330       6.828440 109.7615       12.60244 124.0187       8.124404 93.27433 5.569791 100.2604 3.329883 -6.986061      6.489275 
1 1 1 -17 23 24 o 59.93981 3.181071 44.41428       4.629849 40.71326       9.307947 45.63100       5.336900 55.87325 6.988612 60.62753 3.628902 -4.754272      7.874619 
1 1 1 -17 23 25 o 32.33567 4.594792 13.33121       3.518828 -3.745939      7.450304 18.23445       3.992162 17.26342 7.897151 37.97078 4.395505 -20.70737      9.038001 
1 1 1 -17 23 26 o 60.77314 3.103942 45.76756       4.581636 33.57916       8.400857 50.92763       5.466102 50.27452 7.050621 63.96548 3.520251 -13.69096      7.880573 
1 1 1 -17 23 27 o 42.56360 4.187800 22.93659       4.287514 26.76976       7.762009 21.25350       5.143384 44.37099 7.441824 40.48701 5.343437 3.883980       9.161499 
1 1 1 -17 23 28 o 52.02883 4.040225 34.22218       5.082424 22.50682       8.076072 41.90446       6.539847 39.62827 8.609650 57.23168 4.731395 -17.60341      9.824060 
1 1 1 -17 23 29 o 34.54528 6.878443 16.50800       5.586895 18.19256       7.187109 13.93571       8.881212 35.29642 8.465035 30.15457 10.18387 5.141846       13.24266 
1 1 1 -17 23 30 f 72.82076 3.413318 66.69766       6.040291 51.59684       9.184391 78.20757       8.018367 61.86924 6.174067 78.22896 4.221767 -16.35972      7.479466 
1 1 1 -17 23 31 o 14.71068 6.161056 1.193192       3.710040 3.715999       6.511888 -0.1925770E-01 4.514368 19.89813 8.233793 14.81053 6.502884 5.087603       10.49204 
1 1 1 -17 23 32 o 36.30537 6.500042 18.56893       5.539552 18.79160       7.103384 18.22333       8.849544 34.93604 8.439151 32.79461 10.09024 2.141430       13.15417 
1 1 1 -17 23 33 o 58.04865 3.829465 43.37002       5.386833 38.08226       8.411980 47.04581       7.013546 51.49017 6.875762 59.50146 4.879812 -8.011292      8.431410 
1 1 1 -17 23 34 o 19.29911 7.351098 5.019684       4.790514 -2.743710      10.24113 7.194205       5.420057 18.58380 8.753161 21.82973 7.911624 -3.245926      11.79880 
1 1 1 -17 23 35 o 21.80483 7.251843 7.358654       4.505236 6.941223       8.582394 7.517436       5.293180 21.85923 9.273997 21.86486 7.832087 -0.5624771E-02 12.13872 
1 1 1 -17 23 36 o 31.70728 5.961614 14.71631       4.437324 18.70902       7.354118 12.43052       5.564361 32.26429 9.009727 27.20681 7.917072 5.057478       11.99397 
1 1 1 -17 23 37 o 17.54209 7.075765 4.062475       4.660070 5.704655       6.534388 2.362826       6.647742 19.66938 8.202662 17.44847 7.764672 2.220915       11.29486 
1 1 1 -17 23 38 o 18.42233 6.879530 5.199787       4.149011 10.52443       6.973410 2.281996       5.162109 23.30268 8.870830 16.14688 7.024330 7.155798       11.31516 
1 1 1 -17 24 1  o 15.08917 5.872318 1.775270       3.103790 9.564214       6.485181 -0.5389026     3.534929 27.57851 8.662446 13.37585 5.815871 14.20266       10.43371 
1 1 1 -17 24 2  o 134.7122 3.185801 222.1860       10.45832 219.2396       20.71191 223.1943       12.11641 132.6941 6.424287 134.8572 3.690387 -2.163162      7.408807 
1 1 1 -17 24 3  o 50.41540 3.825741 31.35572       4.665097 41.34256       10.69129 29.00707       5.184713 56.92939 7.920727 48.37138 4.448228 8.558002       9.084308 
1 1 1 -17 24 4  o 66.88865 3.850526 55.06210       6.249846 0.000000       0.000000 55.06210       6.249846 ?        ?        66.88865 3.850526 0.000000       3.850526 
1 1 1 -17 24 5  o 130.2218 3.162020 207.5579       10.03424 208.5259       20.41536 207.2495       11.52202 129.4354 6.493172 129.9794 3.641213 -0.5440369     7.444441 
1 1 1 -17 24 6  o 58.87877 3.647482 42.65402       5.207753 40.96142       10.73065 43.17551       5.956217 56.66074 7.993363 59.15361 4.158427 -2.492870      9.010347 
1 1 1 -17 24 7  o 25.37015 6.580195 8.292616       4.102167 5.941378       8.420509 9.024276       4.697260 25.43403 9.731859 26.46067 7.126503 -1.026636      12.06218 
1 1 1 -17 24 8  o 80.40811 3.553800 79.38778       6.946319 83.38348       10.33761 76.09855       9.379313 82.05844 5.196335 78.44124 4.931670 3.617203       7.164026 
1 1 1 -17 24 9  o 157.3267 3.095194 302.9390       11.86660 289.4751       19.73470 310.5642       14.85147 153.0441 5.299484 159.1057 3.830433 -6.061523      6.538864 
1 1 1 -17 24 10 o 13.45982 5.824942 -0.4003264     3.512051 0.8133604E-02  7.056935 -0.5347997     4.049108 19.45582 8.336355 14.37110 6.236744 5.084723       10.41114 
1 1 1 -17 24 11 o 62.61734 3.909070 48.31843       5.935160 62.02211       9.785529 40.34347       7.465000 70.55119 5.741310 56.87592 5.452691 13.67527       7.917984 
1 1 1 -17 24 12 o 112.8786 2.907643 156.0289       7.991477 149.2777       13.86632 159.3866       9.778831 109.8055 5.196787 113.9541 3.525685 -4.148605      6.279892 
1 1 1 -17 24 13 f 30.00283 6.455868 11.62661       4.580078 9.172241       8.564303 12.60972       5.420294 28.19019 9.976672 31.12593 7.277014 -2.935745      12.34864 
1 1 1 -17 24 14 o 115.8818 4.213339 165.5031       11.87830 0.000000       0.000000 165.5031       11.87830 ?        ?        115.8818 4.213339 0.000000       4.213339 
1 1 1 -17 24 15 o 64.28535 4.008761 51.03831       6.248725 50.76464       12.78097 51.12427       7.163217 62.64838 8.598377 64.20187 4.609183 -1.553493      9.755853 
1 1 1 -17 24 16 o 59.08784 3.254402 42.96053       4.667937 58.96286       9.362661 37.66698       5.384944 68.63824 5.647450 55.16650 4.033494 13.47174       6.939940 
1 1 1 -17 24 17 o 76.91205 2.945047 72.61672       5.509593 69.79271       10.20157 73.77961       6.546427 74.65846 5.649199 77.41314 3.479082 -2.754677      6.634566 
1 1 1 -17 24 18 o 72.19524 3.390090 64.19489       5.947593 67.35542       10.03120 62.48150       7.385845 73.26714 5.662239 70.99482 4.289117 2.272316       7.103343 
1 1 1 -17 24 19 o 23.57566 5.737263 7.225125       3.264445 4.492580       7.065741 7.966685       3.680842 22.61717 8.843437 24.71365 6.139349 -2.096481      10.76559 
1 1 1 -17 24 20 o 90.54979 2.870875 100.7523       6.326868 95.00361       11.43054 103.2915       7.596690 86.99011 5.419047 91.52667 3.411941 -4.536560      6.403703 
1 1 1 -17 24 21 o 48.77604 3.565281 29.50649       4.208490 24.50657       8.453431 31.15407       4.852592 42.74174 8.415714 50.01077 4.015471 -7.269024      9.324605 
1 1 1 -17 24 22 o 24.41592 5.780407 7.819729       3.385665 4.673738       7.453741 8.637537       3.800327 22.86575 9.039629 25.59959 6.165712 -2.733839      10.94216 
1 1 1 -17 24 23 o 54.16540 3.350463 36.37915       4.400801 48.26231       8.982779 32.62622       5.048122 61.27569 6.096493 51.06421 4.090934 10.21149       7.341864 
1 1 1 -17 24 24 o 37.16276 4.457017 17.51593       3.955915 15.83222       11.09802 17.76100       4.234034 33.28580 11.38210 37.32355 4.763586 -4.037743      12.33872 
1 1 1 -17 24 25 o 78.03564 2.921801 75.29961       5.546411 64.47614       9.934775 80.20061       6.685234 70.67606 5.819847 80.32146 3.423308 -9.645393      6.752011 
1 1 1 -17 24 26 o 19.89097 6.016270 5.211695       3.163853 5.457811       6.563029 5.137183       3.611163 22.23904 8.570563 19.93443 6.485766 2.304615       10.74801 
1 1 1 -17 24 27 o 17.73500 6.650194 3.441017       3.885204 -0.6577370     6.209958 6.077282       4.980321 17.00779 7.540169 21.71930 7.614585 -4.711508      10.71616 
1 1 1 -17 24 28 o 81.90728 4.084479 85.08865       8.126862 78.38887       10.56024 94.81959       12.72685 77.24084 5.649428 84.32464 6.237579 -7.083801      8.415666 
1 1 1 -17 24 29 o 55.04706 3.767030 38.46011       5.022777 30.60346       8.177419 43.21997       6.364948 46.47356 7.473991 57.84786 4.551787 -11.37429      8.750960 
1 1 1 -17 24 30 o 25.81759 6.232777 9.350568       3.876423 6.217982       6.614481 10.98931       4.784089 22.04198 8.574154 27.57324 7.082908 -5.531261      11.12132 
1 1 1 -17 24 31 o 24.27769 6.614152 8.478582       4.018550 7.606131       6.412677 9.042736       5.156649 23.02338 8.561549 24.61561 7.723326 -1.592228      11.53039 
1 1 1 -17 24 32 o 39.67624 4.691568 20.89972       4.448470 25.81670       7.253990 17.93606       5.631736 41.83401 7.385540 35.19601 6.812438 6.638004       10.04766 
1 1 1 -17 24 33 o 32.32873 6.398665 15.13893       4.862475 15.98469       10.95026 14.93121       5.426861 28.44580 11.04129 31.39808 7.240561 -2.952274      13.20363 
1 1 1 -17 24 34 o 32.00233 6.293766 14.98568       4.733288 10.86944       8.495732 16.83848       5.699869 24.65841 9.680648 33.05388 7.273989 -8.395468      12.10892 
1 1 1 -17 24 35 o 16.35518 6.625414 3.040379       4.105455 0.1334268      6.570893 4.901796       5.258081 16.37229 7.461539 18.86316 7.548019 -2.490862      10.61354 
1 1 1 -17 24 36 o 20.16733 7.000630 6.402192       4.203720 7.646744       7.270431 5.777181       5.152254 21.32836 8.749873 19.46003 7.568016 1.868330       11.56871 
1 1 1 -17 24 37 o 12.87260 5.984792 -1.684570      4.534672 0.2981686      6.671110 -3.387609      6.182693 16.13652 7.415430 13.96139 6.641867 2.175131       9.955049 
1 1 1 -17 25 1  o 19.21333 6.108816 4.530558       3.216279 -0.5776774     5.629710 7.005681       3.918763 16.94484 7.353826 23.35318 6.596773 -6.408342      9.879077 
1 1 1 -17 25 2  o 105.2477 3.068619 135.8225       7.861903 145.0071       15.72555 132.7619       9.077809 107.8054 6.009684 103.9336 3.589562 3.871780       7.000090 
1 1 1 -17 25 3  o 142.9665 3.256868 250.5471       11.34672 255.1572       22.99216 249.0629       13.04606 142.7952 6.625453 142.3506 3.764135 0.4445801      7.620062 
1 1 1 -17 25 4  f 70.88400 3.775570 61.87970       6.498263 0.000000       0.000000 61.87970       6.498263 ?        ?        70.88400 3.775570 0.000000       3.775570 
1 1 1 -17 25 5  f 92.34015 3.161545 104.5887       7.103706 110.7112       14.63334 102.7010       8.125335 94.04896 6.423447 91.39964 3.655422 2.649315       7.390722 
1 1 1 -17 25 6  o 38.53714 4.607089 18.55786       4.240937 13.67898       8.375270 20.24018       4.918057 32.42134 9.784745 40.15219 5.144327 -7.730843      11.05465 
1 1 1 -17 25 7  o 107.1751 3.849207 141.2871       10.03681 133.8302       16.91562 145.3388       12.46889 103.2957 6.757100 108.4445 4.729656 -5.148834      8.247911 
1 1 1 -17 25 8  o 94.79353 3.585397 110.4341       8.267393 121.7435       15.61071 106.0256       9.746422 98.57874 6.535248 92.69768 4.326533 5.881058       7.837624 
1 1 1 -17 25 9  o 57.92897 4.122859 41.48928       5.782061 32.73857       10.34634 45.46344       6.972486 50.09306 8.796419 60.51050 4.766943 -10.41744      10.00504 
1 1 1 -17 25 10 o 43.47065 4.932338 23.64043       5.132737 17.28569       9.335498 26.39368       6.144852 36.03697 10.18257 45.79332 5.624460 -9.756351      11.63268 
1 1 1 -17 25 11 o 50.25962 4.589754 31.42101       5.559430 47.11448       11.21791 26.31176       6.400750 60.64242 7.769241 45.63762 5.892756 15.00480       9.751188 
1 1 1 -17 25 12 o 65.30286 4.048528 52.69302       6.410980 42.94864       11.71714 56.85664       7.659131 57.48943 8.629878 67.69082 4.671815 -10.20139      9.813290 
1 1 1 -17 25 13 o 48.39659 5.040388 29.31368       5.857490 17.33848       13.41108 32.13663       6.511392 36.60013 12.51223 50.61205 5.360794 -14.01191      13.61227 
1 1 1 -17 25 14 o 59.87998 3.325195 44.15608       4.833103 35.13608       8.787167 48.06836       5.787090 52.38033 7.063952 62.38014 3.825352 -9.999817      8.033227 
1 1 1 -17 25 15 o 22.86023 6.381443 6.751537       3.689999 14.71020       7.609429 4.304654       4.219283 33.19390 9.125240 19.68605 6.999085 13.50785       11.50031 
1 1 1 -17 25 16 o 60.24666 3.320414 44.74110       4.855999 47.80791       9.085946 43.51483       5.745391 61.45153 6.149922 59.25801 4.002132 2.193523       7.337480 
1 1 1 -17 25 17 o 104.9418 2.852873 135.2115       7.288936 137.6256       12.98353 134.1005       8.807899 105.0132 5.088709 104.3201 3.469548 0.6930771      6.158955 
1 1 1 -17 25 18 o 43.32110 3.920640 23.37188       4.094210 27.05061       8.225113 22.16015       4.720588 45.35696 7.717676 41.97628 4.695168 3.380680       9.033667 
1 1 1 -17 25 19 f 42.05007 3.968107 22.06749       4.018093 24.24775       8.017453 21.33620       4.643316 42.68830 8.001004 41.14102 4.716637 1.547283       9.287773 
1 1 1 -17 25 20 o 26.93107 5.592399 9.451808       3.550017 9.688229       7.423495 9.381710       4.042178 27.42809 9.310345 26.66392 6.318292 0.7641735      11.25181 
1 1 1 -17 25 21 o 85.87274 2.918627 90.87819       6.098715 76.24918       10.81401 97.70110       7.385228 77.36875 5.777394 88.85686 3.417016 -11.48811      6.712248 
1 1 1 -17 25 22 o 31.25731 4.861379 12.53980       3.582624 11.45581       7.105694 12.90929       4.148513 28.92884 9.064667 31.47656 5.614357 -2.547718      10.66251 
1 1 1 -17 25 23 o 97.23116 3.148631 117.0159       7.450583 111.2539       17.39813 118.3100       8.244853 91.13381 7.912396 97.60402 3.471934 -6.470207      8.640621 
1 1 1 -17 25 24 o 46.60543 3.655395 27.21226       4.118320 23.81351       8.021927 28.42863       4.799014 41.37131 8.246441 47.43956 4.194385 -6.068245      9.251845 
1 1 1 -17 25 25 o 36.31231 4.413504 16.86738       3.825369 26.64471       7.759420 13.72804       4.396818 44.06868 7.493416 32.14690 5.827099 11.92178       9.492437 
1 1 1 -17 25 26 o 34.71187 5.470400 15.91298       4.474339 21.11054       7.207658 12.65425       5.707150 38.62047 7.924351 29.81750 7.775299 8.802973       11.10183 
1 1 1 -17 25 27 o 58.16372 3.683835 42.71519       5.194591 37.65617       8.200446 46.10563       6.713250 52.68783 6.526333 59.83464 4.640337 -7.146805      8.007855 
1 1 1 -17 25 28 o 42.19423 3.840130 22.72031       3.905311 21.51130       7.331007 23.19934       4.614587 38.26631 8.113645 42.26247 4.552378 -3.996159      9.303514 
1 1 1 -17 25 29 o 17.47143 6.216224 3.847559       3.328758 3.036996       5.781411 4.249524       4.071316 18.71234 7.752068 18.51417 6.833373 0.1981735      10.33390 
1 1 1 -17 25 30 o 42.34480 4.487380 23.48157       4.560122 22.04450       7.291182 24.40485       5.844207 38.23963 8.077899 42.21197 5.837453 -3.972340      9.966359 
1 1 1 -17 25 31 o 26.67820 6.401849 10.26637       4.108769 10.87586       6.825961 9.920073       5.145307 25.96510 8.925009 25.48202 7.664631 0.4830856      11.76445 
1 1 1 -17 25 32 o 36.80684 5.070675 18.44260       4.427381 18.98842       7.202993 18.11117       5.612852 34.07032 8.658844 35.06950 6.813355 -0.9991798     11.01805 
1 1 1 -17 25 33 o 23.77535 6.880700 8.662540       4.213389 13.95002       8.020487 6.647176       4.951688 27.45820 9.660250 20.91754 7.564691 6.540665       12.26968 
1 1 1 -17 25 34 o 34.20659 5.372496 16.52745       4.330950 26.23395       7.377865 11.42409       5.349672 40.48777 7.760093 26.23941 7.797283 14.24836       11.00076 
1 1 1 -17 25 35 o 29.44033 6.063416 12.91087       4.205161 16.67459       7.271323 11.01950       5.154589 29.81183 9.141555 25.62480 7.663281 4.187031       11.92870 
1 1 1 -17 25 36 f 42.87303 5.771277 26.92392       5.876650 23.95772       7.877630 30.64595       8.824398 36.14414 8.982928 41.05629 9.062901 -4.912155      12.76045 
1 1 1 -17 26 1  o 122.0965 3.555282 183.4746       10.56697 184.1889       17.95917 183.0963       13.06858 121.1658 6.101974 121.6413 4.416034 -0.4755554     7.532293 
1 1 1 -17 26 2  o 33.11100 5.656841 14.01830       4.400586 21.54749       7.967455 10.71323       5.278811 40.38931 8.370264 28.56595 7.491982 11.82335       11.23348 
1 1 1 -17 26 3  o 72.20000 4.479097 64.64008       7.841874 0.000000       0.000000 64.64008       7.841874 ?        ?        72.20000 4.479097 0.000000       4.479097 
1 1 1 -17 26 4  o 45.41591 4.659871 25.76034       5.084181 25.88223       8.982726 25.70289       6.167066 44.30676 8.630007 45.08415 5.743524 -0.7773857     10.36654 
1 1 1 -17 26 5  o 113.8984 3.610678 159.6239       10.00907 173.4098       18.30758 153.7465       11.95373 117.5033 6.417957 111.5131 4.407554 5.990128       7.785673 
1 1 1 -17 26 6  o 43.83010 5.095663 24.12069       5.341285 0.000000       0.000000 24.12069       5.341285 ?        ?        43.83010 5.095663 0.000000       5.095663 
1 1 1 -17 26 7  o 123.2952 3.822548 187.2424       11.47124 179.1690       19.43741 191.5571       14.20967 119.2732 6.714546 124.3691 4.696955 -5.095924      8.194298 
1 1 1 -17 26 8  o 27.90561 6.176867 10.09992       4.089320 2.002090       8.074313 12.89362       4.742542 21.88766 9.122181 31.55880 6.386229 -9.671143      11.13544 
1 1 1 -17 26 9  o 88.48779 3.212491 96.21770       6.915761 109.2244       15.31162 92.88427       7.751477 92.96073 6.806217 86.82687 3.671772 6.133858       7.733466 
1 1 1 -17 26 10 o 82.50045 3.016928 83.58080       6.055158 100.1472       11.32362 76.94682       7.165709 89.65259 5.205451 78.98941 3.733231 10.66318       6.405757 
1 1 1 -17 26 11 o 123.6134 2.950483 187.3773       8.887811 181.9463       15.16934 190.2163       10.96747 120.9141 5.160045 124.2934 3.624822 -3.379303      6.305981 
1 1 1 -17 26 12 o 38.16470 4.538051 18.26825       4.137985 19.06230       7.450995 17.91413       4.975872 37.89718 8.298528 37.50948 5.616213 0.3877068      10.02035 
1 1 1 -17 26 13 o 17.68896 6.745540 2.867657       4.036712 -7.000518      11.19536 4.342352       4.327836 20.69029 9.543575 19.80274 7.083308 0.8875542      11.88499 
1 1 1 -17 26 14 o 25.31270 5.794804 8.335139       3.497172 9.662116       6.836449 7.864821       4.070006 27.45331 8.923272 24.53303 6.644951 2.920279       11.12565 
1 1 1 -17 26 15 o 56.78699 3.403093 39.84182       4.687720 34.99818       8.430050 42.00999       5.640152 52.13218 6.797454 58.16566 4.003549 -6.033482      7.888840 
1 1 1 -17 26 16 o 82.71674 3.008228 84.20336       6.053638 74.57545       10.40266 89.13331       7.443873 76.89778 5.589456 84.92467 3.605107 -8.026886      6.651227 
1 1 1 -17 26 17 o 18.08530 6.669585 3.421585       3.877121 1.441207       6.509222 4.510520       4.826761 19.40283 8.145731 20.35398 7.452514 -0.9511566     11.04051 
1 1 1 -17 26 18 o 50.38054 3.460077 31.48272       4.222207 26.21956       7.855289 33.62104       5.006978 44.50502 7.509975 51.92384 3.987579 -7.418816      8.502971 
1 1 1 -17 26 19 o 39.56357 3.993611 19.62721       3.797676 20.66618       7.554734 19.27589       4.393080 39.00316 8.208686 38.98867 4.719716 0.1448441E-01  9.468803 
1 1 1 -17 26 20 o 57.89703 3.342340 41.57967       4.695621 37.80532       8.746501 43.10797       5.565687 53.71304 6.836915 58.76593 3.908702 -5.052895      7.875364 
1 1 1 -17 26 21 o 56.34392 3.377446 39.46194       4.616081 38.99554       8.892810 39.63395       5.400659 54.38691 6.862245 56.25848 3.964722 -1.871578      7.925240 
1 1 1 -17 26 22 o 10.68006 4.976792 -2.681373      3.164136 1.799036       6.309896 -4.186481      3.657187 19.06134 8.012295 10.79611 5.128090 8.265226       9.512843 
1 1 1 -17 26 23 f 24.74621 6.177520 8.263873       3.713477 9.304605       11.08627 8.132347       3.941151 27.69933 11.00083 24.48127 6.498611 3.218060       12.77694 
1 1 1 -17 26 24 o 32.95640 5.729370 14.42730       4.434380 14.52789       7.038965 14.36110       5.709885 31.57412 8.813668 32.04708 7.452763 -0.4729595     11.54229 
1 1 1 -17 26 25 o 48.85232 4.297308 30.49039       5.063765 18.67284       7.476905 40.50354       6.882460 35.62652 8.690769 55.84032 5.114519 -20.21380      10.08404 
1 1 1 -17 26 26 o 18.55749 6.234087 4.488140       3.328191 5.341877       6.346173 4.164247       3.908865 21.41711 8.379045 18.47039 6.715206 2.946720       10.73790 
1 1 1 -17 26 27 o 78.82124 3.360917 78.20822       6.440791 72.34929       9.864674 82.56178       8.503464 73.82975 5.522985 80.11034 4.372409 -6.280586      7.044241 
1 1 1 -17 26 28 o 28.80725 6.221301 11.61837       4.239422 10.86585       6.549092 12.16116       5.562012 26.57823 8.739633 28.54127 7.783688 -1.963032      11.70329 
1 1 1 -17 26 29 o 16.82127 6.189036 3.461618       3.335306 6.093791       6.340490 2.454621       3.921748 21.49928 8.385687 16.16430 6.501245 5.334984       10.61065 
1 1 1 -17 26 30 o 13.22297 5.673616 0.5478827      3.277201 -7.429354      6.090832 3.798328       3.887961 12.93701 6.265837 17.55262 6.637161 -4.615603      9.127575 
1 1 1 -17 26 31 o 48.06903 4.467052 30.63953       5.172781 15.78928       9.215751 37.47023       6.250236 28.96938 10.33923 52.74784 4.919171 -23.77847      11.44980 
1 1 1 -17 26 32 o 31.45351 7.232617 15.27819       5.427824 0.000000       0.000000 15.27819       5.427824 ?        ?        31.45351 7.232617 0.000000       7.232617 
1 1 1 -17 26 33 o 14.38397 6.093376 1.467106       3.695651 3.673358       6.486879 0.4069103      4.496777 18.51636 7.964109 14.45190 6.411198 4.064465       10.22402 
1 1 1 -17 26 34 o 10.65562 5.058199 -3.067113      3.547256 -1.370459      5.635403 -4.180507      4.565126 14.51660 6.722376 11.72637 5.613838 2.790236       8.758169 
1 1 1 -17 26 35 o 30.59544 6.170796 14.15203       4.441863 11.95873       7.557132 15.30971       5.490374 24.49705 9.255540 30.44203 7.460232 -5.944977      11.88781 
1 1 1 -17 27 1  o 95.04154 3.080669 111.1221       7.125584 117.9853       13.54467 108.4958       8.378752 96.79668 5.768278 93.72104 3.675777 3.075645       6.839909 
1 1 1 -17 27 2  o 46.59663 3.872345 26.98055       4.357384 23.03033       7.988073 28.65385       5.198998 41.65646 8.161105 47.86781 4.510129 -6.211353      9.324426 
1 1 1 -17 27 3  o 78.09100 3.241453 75.09876       6.155050 71.72678       11.85879 76.34209       7.200936 75.10372 6.544824 78.58967 3.771000 -3.485947      7.553486 
1 1 1 -17 27 4  o 66.62208 3.340759 54.72310       5.406439 48.11280       10.19837 57.30700       6.376137 61.25732 6.954776 68.04832 3.860910 -6.791004      7.954592 
1 1 1 -17 27 5  o 33.12732 5.192288 13.97663       4.053987 5.769972       7.733740 17.08607       4.760444 24.28592 9.318003 36.61117 5.506114 -12.32525      10.82324 
1 1 1 -17 27 6  o 40.86030 5.531633 21.20756       5.366627 16.24038       8.768010 24.18315       6.786288 34.60360 9.898563 43.31877 6.640027 -8.715168      11.91938 
1 1 1 -17 27 7  o 15.03773 6.333060 0.5099456      3.954058 0.000000       0.000000 0.5099456      3.954058 ?        ?        15.03773 6.333060 0.000000       6.333060 
1 1 1 -17 27 8  o 71.42397 3.345325 62.88158       5.806441 58.82142       11.64676 64.22450       6.698217 67.69148 7.169343 72.05680 3.828332 -4.365318      8.127460 
1 1 1 -17 27 9  o 90.28588 3.199039 100.3246       7.027302 108.7391       15.08808 97.99368       7.941215 92.44895 6.743618 89.09026 3.665635 3.358688       7.675497 
1 1 1 -17 27 10 o 22.62973 6.680650 6.609312       3.937610 5.139767       8.180591 7.052450       4.492238 24.09942 9.487816 23.43454 7.185163 0.6648731      11.90148 
1 1 1 -17 27 11 o 18.84352 6.437801 4.190238       3.550223 -3.906610      6.125753 8.285351       4.356467 15.49187 7.114285 25.12332 6.903749 -9.631454      9.913364 
1 1 1 -17 27 12 o 34.04975 5.710901 14.92108       4.571028 -8.474135      12.38852 18.60808       4.918044 21.24736 9.883039 38.19629 5.437011 -16.94893      11.27987 
1 1 1 -17 27 13 o 18.97523 6.452714 4.291742       3.566016 1.110620       6.620606 5.591802       4.232426 19.32253 8.169182 21.26254 7.027386 -1.940014      10.77588 
1 1 1 -17 27 14 o 31.24952 5.154634 12.52201       3.788598 11.82119       7.015967 12.81048       4.501302 29.64356 8.957571 31.33151 6.115073 -1.687950      10.84584 
1 1 1 -17 27 15 o 97.53373 2.922478 117.1100       6.938283 123.8732       12.25403 113.9187       8.417541 99.29633 5.081079 95.93723 3.606916 3.359100       6.231148 
1 1 1 -17 27 16 f 32.21850 5.587094 13.44806       4.227664 19.91531       7.131207 9.943301       5.249668 38.45198 7.875576 27.21416 7.616887 11.23782       10.95635 
1 1 1 -17 27 17 o 30.91708 5.071259 12.30630       3.688413 13.79824       7.152268 11.76578       4.305021 31.57955 8.909148 29.88654 6.117245 1.693007       10.80711 
1 1 1 -17 27 18 o 41.83431 4.012189 21.97677       4.040174 26.79147       7.947007 20.29864       4.691727 44.70430 7.564405 39.88889 4.931560 4.815411       9.029978 
1 1 1 -17 27 19 o 74.75696 3.053628 69.14854       5.551224 62.48071       9.789920 72.30843       6.739425 69.66981 5.819423 76.20647 3.639586 -6.536659      6.863838 
1 1 1 -17 27 20 o 61.03474 3.250273 46.29364       4.816862 38.02737       8.519135 50.17822       5.839998 53.64452 6.659746 63.32675 3.801840 -9.682232      7.668520 
1 1 1 -17 27 21 o 20.52790 6.274824 5.564874       3.429378 9.271738       6.843398 4.321839       3.962873 26.10688 8.937611 19.02437 6.781049 7.082510       11.21889 
1 1 1 -17 27 22 o 15.81445 6.692724 0.9093559      4.451066 10.73761       10.12217 -1.446675      4.955938 28.09151 10.68905 14.75938 6.626157 13.33213       12.57624 
1 1 1 -17 27 23 o 38.51521 4.985334 19.30943       4.569440 11.29758       6.733855 26.14718       6.220911 27.86061 8.836928 44.37794 5.898340 -16.51733      10.62458 
1 1 1 -17 27 24 o 12.71708 5.547560 -0.1816139     3.238643 -4.878542      5.934954 1.810116       3.864787 14.16004 6.667649 15.71017 6.404483 -1.550138      9.245266 
1 1 1 -17 27 25 o 42.08739 3.916634 22.63284       3.970889 28.49864       7.273098 20.14182       4.739634 45.33960 6.791512 39.06673 5.100195 6.272869       8.493328 
1 1 1 -17 27 26 o 38.53668 4.729438 19.48447       4.348386 27.53792       7.235930 14.93208       5.440302 44.25867 6.936783 32.26330 7.111432 11.99537       9.934356 
1 1 1 -17 27 27 o 44.87502 4.540752 26.32367       4.897308 35.75419       7.724475 19.98528       6.332721 50.79533 6.380795 37.17007 7.251825 13.62526       9.659373 
1 1 1 -17 27 28 o 36.25412 4.581754 17.36673       3.957618 8.353906       6.716731 22.15984       4.898198 23.63233 8.767055 40.68642 5.048523 -17.05409      10.11676 
1 1 1 -17 27 29 o 12.29905 5.582537 -1.199779      3.631945 -0.1042290     5.860916 -1.882761      4.627581 16.11867 7.223478 13.42922 6.173065 2.689445       9.501862 
1 1 1 -17 27 30 o 16.89135 6.748900 3.172581       4.197268 -5.871512      7.599804 7.141950       5.034781 15.11942 7.239568 21.68844 7.651824 -6.569023      10.53384 
1 1 1 -17 27 31 o 49.51451 3.670046 31.86516       4.396848 19.98368       7.689251 37.63752       5.359520 33.80750 9.123448 53.37362 4.153296 -19.56613      10.02433 
1 1 1 -17 27 32 o 33.69619 4.762269 15.59622       3.801612 18.96150       7.071492 14.22827       4.508543 33.07635 8.669547 31.01359 6.182570 2.062761       10.64825 
1 1 1 -17 27 33 o 14.43275 5.935519 1.989005       3.356185 1.323155       6.183236 2.267112       3.996077 16.56857 7.422702 15.36766 6.412110 1.200913       9.808755 
1 1 1 -17 27 34 o 51.88218 4.425146 36.64834       5.541414 21.64107       9.883236 43.52940       6.692310 30.71195 10.72964 55.81606 4.972172 -25.10411      11.82572 
1 1 1 -17 28 1  o 46.31565 3.213356 26.56237       3.604305 23.19075       5.140327 29.82331       5.055253 42.75599 5.029625 48.79445 4.295239 -6.038452      6.614092 
1 1 1 -17 28 2  o 62.58974 3.995194 48.74679       6.061832 0.000000       0.000000 48.74679       6.061832 ?        ?        62.58974 3.995194 0.000000       3.995194 
1 1 1 -17 28 3  o 16.65351 6.286991 2.677769       3.485284 3.429940       6.448730 2.367405       4.142395 20.90565 8.361161 17.15787 6.752551 3.747780       10.74737 
1 1 1 -17 28 4  o 56.67596 3.669357 39.84784       5.040625 37.07872       9.724425 40.86520       5.894292 53.07555 7.746812 57.22375 4.257377 -4.148197      8.839590 
1 1 1 -17 28 5  o 94.63627 3.171331 110.3811       7.303337 113.2365       14.51255 109.4127       8.451518 94.26313 6.354937 94.02858 3.695603 0.2345505      7.351375 
1 1 1 -17 28 6  o 58.25564 4.388852 42.39672       6.184712 46.09310       10.23183 40.26863       7.763528 59.57324 7.193468 56.27633 5.741395 3.296913       9.203782 
1 1 1 -17 28 7  o 159.7525 3.435537 314.7710       13.37453 334.7117       27.87358 308.8068       15.24401 161.4333 7.102773 157.8672 3.965658 3.566071       8.134852 
1 1 1 -17 28 8  o 122.6347 3.222470 185.3671       9.621922 191.8886       19.83661 183.3607       11.00300 122.5077 6.669744 121.7407 3.713190 0.7669830      7.633692 
1 1 1 -17 28 9  o 29.81160 6.552844 11.72645       4.630439 0.000000       0.000000 11.72645       4.630439 ?        ?        29.81160 6.552844 0.000000       6.552844 
1 1 1 -17 28 10 o 21.39812 6.676607 5.860130       3.859151 5.417614       8.081153 5.990861       4.392363 24.00803 9.436618 21.83513 7.156125 2.172901       11.84314 
1 1 1 -17 28 11 o 50.89177 3.928586 32.28915       4.834451 26.15621       9.908967 34.20504       5.538334 43.41250 9.619689 52.24393 4.390771 -8.831429      10.57437 
1 1 1 -17 28 12 o 55.87375 3.857012 38.87818       5.219413 53.60796       14.29315 36.61177       5.606597 62.46287 9.705005 54.07425 4.289869 8.388622       10.61085 
1 1 1 -17 28 13 o 49.19330 3.703596 30.14309       4.407219 25.42921       7.680372 32.45729       5.381383 43.71458 7.478368 50.83947 4.386530 -7.124886      8.669927 
1 1 1 -17 28 14 o 48.87793 3.785120 29.81333       4.473355 36.91721       8.122580 26.72067       5.359347 53.34780 6.373981 45.90177 4.865211 7.446030       8.018597 
1 1 1 -17 28 15 o 80.63081 3.013480 80.30074       5.910722 76.44392       10.11491 82.30067       7.283731 77.52763 5.387404 81.36021 3.683269 -3.832581      6.526147 
1 1 1 -17 28 16 o 59.94093 3.734085 44.82776       5.427271 42.25427       8.318494 46.73513       7.161449 57.10814 6.070267 60.71270 4.881557 -3.604568      7.789592 
1 1 1 -17 28 17 o 34.96251 4.650680 15.63556       3.864187 19.72159       6.884054 13.75584       4.669172 37.96573 7.704362 32.19521 6.175903 5.770527       9.874157 
1 1 1 -17 28 18 o 23.39672 6.768911 7.377216       4.078206 12.91581       6.887981 4.387632       5.060548 30.16747 8.817028 20.06761 7.575735 10.09985       11.62462 
1 1 1 -17 28 19 o 66.02898 3.232505 54.24698       5.185469 58.75215       9.237447 52.17414       6.265849 67.30348 5.685328 64.39239 4.013039 2.911095       6.958983 
1 1 1 -17 28 20 o 52.47798 4.267155 34.96139       5.409919 27.14003       8.303389 40.73041       7.131248 44.01776 8.036951 56.08973 5.279390 -12.07197      9.615849 
1 1 1 -17 28 21 o 17.48316 6.729699 3.140690       4.043057 -0.7861336     6.268845 5.937343       5.290370 16.93126 7.536985 21.63033 7.819571 -4.699068      10.86056 
1 1 1 -17 28 22 o 57.47577 3.765266 41.76069       5.244675 35.89962       12.08611 43.12041       5.821333 47.67722 10.66942 58.19543 4.131720 -10.51822      11.44149 
1 1 1 -17 28 23 o 54.56240 3.514278 37.57796       4.647827 39.52500       8.216155 36.66167       5.636357 53.92004 6.376130 53.39050 4.370310 0.5295410      7.730113 
1 1 1 -17 28 24 o 12.97092 5.669185 -0.1288191     3.396307 -1.282488      6.241806 0.3564076      4.048015 16.29516 7.365104 14.46475 6.256736 1.830416       9.663928 
1 1 1 -17 28 25 o 34.27724 4.772650 15.51697       3.878618 22.19757       7.075012 12.64652       4.637619 38.92941 7.730534 29.90508 6.545830 9.024326       10.12961 
1 1 1 -17 28 26 o 67.57250 3.281886 57.70648       5.388016 42.97742       8.628053 67.12227       6.898482 55.46639 6.506900 72.33494 3.928277 -16.86855      7.600730 
1 1 1 -17 28 27 o 34.30166 4.766245 15.70349       3.876589 13.83377       6.836229 16.58970       4.706468 29.20558 8.845686 34.59727 5.786548 -5.391685      10.57026 
1 1 1 -17 28 28 o 31.59192 5.874777 14.07394       4.356338 11.80828       6.833057 15.62545       5.654510 26.62409 8.932453 32.10437 7.381978 -5.480278      11.58803 
1 1 1 -17 28 29 o 15.86191 6.275226 2.759723       3.594307 2.550676       7.541131 2.821173       4.088595 18.92146 8.352557 16.38757 6.621429 2.533888       10.65873 
1 1 1 -17 28 30 o 14.40861 5.940512 1.794425       3.372975 -3.002029      5.940681 4.076243       4.097477 14.26628 6.703040 17.60719 6.775515 -3.340908      9.530914 
1 1 1 -17 28 31 o 31.74116 5.697335 14.52418       4.244940 14.09761       11.17126 14.59617       4.589167 25.53179 10.69189 31.35988 6.224826 -5.828091      12.37194 
1 1 1 -17 28 32 o 15.01904 6.004573 2.538060       3.324602 3.303818       6.216393 2.231293       3.934575 17.85596 7.738477 15.26100 6.364707 2.594954       10.01966 
1 1 1 -17 28 33 o 20.93385 6.617314 6.918835       3.778781 3.766662       8.154623 7.780796       4.264250 18.92270 8.497096 21.86615 7.042522 -2.943457      11.03620 
1 1 1 -17 29 1  o 8.897560 4.253026 -3.412480      2.598457 -7.506498      3.431992 2.086822       3.977638 8.809877 4.355046 16.50429 6.578031 -7.694408      7.889038 
1 1 1 -17 29 2  o 59.73448 3.528532 44.35453       5.113477 53.42908       9.532296 40.68813       6.059050 64.34316 6.154289 56.88821 4.404945 7.454952       7.568277 
1 1 1 -17 29 3  o 81.41583 3.290501 82.05106       6.514954 103.2133       12.97961 74.92375       7.532576 89.77396 5.966877 77.50161 4.001935 12.27235       7.184644 
1 1 1 -17 29 4  o 85.77753 3.232711 90.99593       6.745260 94.93768       12.82276 89.48789       7.931297 85.97964 6.160811 84.80222 3.847991 1.177429       7.263789 
1 1 1 -17 29 5  o 127.7227 3.830204 202.7065       11.90789 227.9404       20.79813 190.4006       14.52408 133.1327 6.429681 123.0596 4.852766 10.07309       8.055441 
1 1 1 -17 29 6  o 42.80371 4.341226 23.08109       4.465686 24.13303       9.093348 22.74675       5.126451 41.62452 9.208972 42.23724 5.082663 -0.6127167     10.51849 
1 1 1 -17 29 7  o 51.57608 3.853185 33.20661       4.807888 29.09943       9.230005 34.73601       5.632357 46.20079 8.511694 52.55463 4.439357 -6.353844      9.599834 
1 1 1 -17 29 8  o 36.32792 5.035736 16.89221       4.338264 14.29176       8.433698 17.82789       5.058890 31.94465 9.854157 37.06567 5.790020 -5.121012      11.42929 
1 1 1 -17 29 9  o 80.26913 3.329035 79.79150       6.497696 67.18018       13.33614 83.71718       7.440592 71.09586 7.826833 82.05544 3.730797 -10.95958      8.670534 
1 1 1 -17 29 10 o 34.40619 5.425244 15.31499       4.398221 21.80111       9.422299 13.50799       4.973287 39.07602 9.888318 31.84501 6.624675 7.231007       11.90232 
1 1 1 -17 29 11 f 32.28503 6.367426 13.81668       4.831508 0.000000       0.000000 13.81668       4.831508 ?        ?        32.28503 6.367426 0.000000       6.367426 
1 1 1 -17 29 12 o 67.06999 3.556579 55.96784       5.792173 39.18668       11.63799 61.49318       6.677997 52.91418 9.368258 70.15707 3.921666 -17.24289      10.15597 
1 1 1 -17 29 13 o 24.45545 6.145987 7.991085       3.657899 3.216638       6.232280 10.50013       4.517936 20.17946 8.167280 27.89314 6.725578 -7.713676      10.58007 
1 1 1 -17 29 14 o 29.02998 5.451539 11.05919       3.714992 7.868164       6.376969 12.69852       4.570695 24.64937 8.618226 30.83683 6.295628 -6.187460      10.67280 
1 1 1 -17 29 15 o 22.04906 6.695772 6.474454       3.913453 11.44261       6.510608 3.663971       4.896821 28.53646 8.630204 19.14450 7.396434 9.391962       11.36607 
1 1 1 -17 29 16 o 27.28223 5.799512 9.927578       3.736848 10.09598       6.556517 9.846554       4.547795 26.92948 8.737597 26.81094 6.915461 0.1185398      11.14312 
1 1 1 -17 29 17 o 41.78403 4.643247 22.38223       4.648154 19.06722       6.960172 25.05085       6.244822 36.82723 7.986062 43.52111 6.051713 -6.693878      10.02000 
1 1 1 -17 29 18 f 13.02466 5.818673 -1.058923      3.771146 0.4440535      6.084150 -1.996599      4.805630 17.56610 7.633979 14.12770 6.416090 3.438401       9.972154 
1 1 1 -17 29 19 o 31.64829 5.240704 13.22336       3.900482 11.27979       7.126755 14.05449       4.660431 27.76175 9.116312 32.20634 6.162551 -4.444590      11.00383 
1 1 1 -17 29 20 o 25.63488 6.499555 9.132175       4.065236 6.693771       6.679175 10.56700       5.123533 22.93423 8.693088 27.17892 7.494121 -4.244692      11.47744 
1 1 1 -17 29 21 o 37.88685 4.975295 18.86483       4.482600 33.34489       11.69184 16.36959       4.853483 45.31939 10.75013 34.72736 5.949054 10.59204       12.28644 
1 1 1 -17 29 22 o 30.78369 5.215478 12.67734       3.772928 1.970496       6.563025 17.96238       4.611027 18.73984 8.034648 36.70012 5.309911 -17.96029      9.630717 
1 1 1 -17 29 23 o 16.39891 6.209671 3.010370       3.406065 8.191406       6.418088 0.9790933      4.018666 23.83061 8.613070 14.93354 6.341296 8.897070       10.69565 
1 1 1 -17 29 24 o 13.15316 5.639287 0.4437571      3.233005 0.5526834      5.890331 0.3967951      3.867646 16.85497 7.413383 14.12282 6.112295 2.732148       9.608246 
1 1 1 -17 29 25 o 64.77155 4.436472 54.75328       6.960297 46.29404       8.470645 72.33730       12.21264 57.87516 6.097559 70.90546 7.166208 -13.03029      9.409292 
1 1 1 -17 29 26 o 51.76320 4.102790 34.87396       5.133010 23.72072       7.669970 43.92129       6.908018 38.96095 8.330776 57.26437 5.000426 -18.30342      9.716280 
1 1 1 -17 29 27 o 21.47322 7.207606 6.900517       4.448888 12.45740       8.852321 5.022705       5.145971 26.36155 10.00424 19.45555 7.564206 6.906004       12.54201 
1 1 1 -17 29 28 o 25.08356 6.256580 9.294746       3.811421 -4.388289      7.583400 13.91940       4.408719 15.53494 7.380552 31.04081 6.045791 -15.50587      9.540657 
1 1 1 -17 29 29 o 37.39622 4.481995 18.86883       4.003193 19.02758       6.829370 18.78573       4.941081 33.73288 8.352454 36.20409 5.795958 -2.471218      10.16645 
1 1 1 -17 29 30 o 22.22325 6.750454 7.701675       3.977275 -10.84017      10.38119 10.89153       4.305821 15.67186 7.714206 26.57045 6.662854 -10.89859      10.19326 
1 1 1 -17 29 31 o 32.12637 5.117712 14.57286       3.872282 5.768085       6.713037 18.96337       4.740423 19.81362 8.292149 36.31804 5.530591 -16.50441      9.967305 
1 1 1 -17 30 1  f 60.89232 3.353199 46.19388       4.956534 24.59573       8.135798 58.94150       6.250381 41.98528 8.246195 68.62003 3.752107 -26.63474      9.059693 
1 1 1 -17 30 2  o 21.73555 6.331044 6.300694       3.556726 -0.6383737     6.035999 9.991621       4.402166 16.95754 7.479689 27.11838 6.700747 -10.16084      10.04220 
1 1 1 -17 30 3  o 17.05071 6.322709 3.123535       3.492781 4.988703       5.777891 2.049441       4.384616 21.29587 8.082260 16.91245 6.848488 4.383429       10.59362 
1 1 1 -17 30 4  o 35.81057 4.946281 16.51293       4.201301 19.07303       7.540510 15.36042       5.059355 36.80264 8.568578 33.95243 6.348214 2.850201       10.66397 
1 1 1 -17 30 5  o 36.70294 4.496459 17.17417       3.937775 13.86390       7.330663 18.51672       4.668501 31.20733 9.088881 37.86124 5.196939 -6.653910      10.46976 
1 1 1 -17 30 6  o 38.70845 4.609506 19.11640       4.262751 16.08040       8.341113 20.18963       4.959287 33.32125 9.692342 39.52740 5.280526 -6.206154      11.03746 
1 1 1 -17 30 7  o 41.88505 4.393566 22.25976       4.417815 26.99702       8.762830 20.64535       5.115498 44.04946 8.470917 39.92492 5.395843 4.124538       10.04348 
1 1 1 -17 30 8  o 79.93757 3.373635 79.44119       6.557036 82.19483       13.03365 78.50810       7.587083 78.93607 6.843242 79.17768 3.944625 -0.2416153     7.898736 
1 1 1 -17 30 9  o 57.28426 3.801199 41.10870       5.276288 38.73502       10.25449 41.96340       6.153322 53.09029 8.189216 57.60653 4.416999 -4.516235      9.304468 
1 1 1 -17 30 10 o 14.12771 6.053156 0.2296356      3.720459 6.870323       7.967763 -1.621952      4.207286 24.45991 9.438871 13.47338 6.072169 10.98653       11.22335 
1 1 1 -17 30 11 o 20.49766 6.691045 5.441697       3.841754 3.209694       8.325643 6.045509       4.330332 21.96457 9.216261 21.54126 7.107724 0.4233131      11.63869 
1 1 1 -17 30 12 o 56.36247 4.538062 40.36853       6.180345 53.07072       12.00188 35.78479       7.209743 62.07238 8.129610 52.40615 5.739242 9.666225       9.951354 
1 1 1 -17 30 13 o 32.04412 6.362863 13.84078       4.793357 11.77789       8.986255 14.66114       5.666865 28.78799 10.21646 32.54762 7.322470 -3.759621      12.56959 
1 1 1 -17 30 14 o 56.05662 4.034725 39.69750       5.474719 25.19997       7.848145 53.43931       7.640859 42.49587 7.868221 64.56204 4.892991 -22.06617      9.265541 
1 1 1 -17 30 15 o 42.91480 4.601569 23.65715       4.737202 30.80946       7.565084 19.04352       6.075920 47.78510 6.678759 37.26068 6.947028 10.52442       9.636754 
1 1 1 -17 30 16 f 24.24455 6.159837 8.041552       3.646044 8.402525       6.515559 7.876983       4.399346 24.71489 8.705920 23.82307 7.068803 0.8918133      11.21432 
1 1 1 -17 30 17 o 29.23365 5.851742 11.56446       4.023163 10.94410       6.750770 11.90614       5.010059 27.30100 8.866693 29.05652 7.129912 -1.755516      11.37778 
1 1 1 -17 30 18 o 51.76746 3.699164 33.92462       4.635802 32.53195       8.208284 34.57689       5.617469 48.31569 7.190301 51.81133 4.493566 -3.495640      8.478949 
1 1 1 -17 30 19 o 22.64675 6.429798 7.155538       3.713311 6.569708       6.534678 7.434918       4.512699 22.53742 8.585395 22.95532 7.228160 -0.4179001     11.22298 
1 1 1 -17 30 20 o 52.81301 3.990627 35.67437       5.097917 21.54437       11.65627 39.01640       5.668827 34.74401 11.66667 55.06607 4.257522 -20.32207      12.41925 
1 1 1 -17 30 21 o 48.87585 3.842792 30.53658       4.540176 32.23956       7.851260 29.68099       5.565012 47.86976 6.931935 47.51946 4.874755 0.3502998      8.474372 
1 1 1 -17 30 22 o 19.72094 6.927388 5.247220       4.123297 6.592493       6.343574 4.263037       5.425836 22.08386 8.447609 19.39452 7.698125 2.689344       11.42905 
1 1 1 -17 30 23 o 13.50539 6.015529 -0.5331027     3.999477 7.000108       6.124847 -6.133077      5.280781 22.23748 8.347420 12.36859 5.951589 9.868888       10.25187 
1 1 1 -17 30 24 o 13.39731 6.157911 -1.927828      4.603637 -2.412558      5.931457 -1.193443      7.300854 14.92900 6.907515 17.06247 7.809864 -2.133474      10.42630 
1 1 1 -17 30 25 o 27.55137 6.730416 11.24814       4.479438 7.308246       7.739890 13.23244       5.492826 22.45799 9.097253 29.21754 7.632367 -6.759544      11.87489 
1 1 1 -17 30 26 o 59.95591 4.249321 47.35375       6.168286 35.61981       10.74025 53.12892       7.534849 44.87185 10.07003 62.66833 4.974691 -17.79648      11.23179 
1 1 1 -17 30 27 o 37.78616 4.474891 19.19738       4.040628 17.23141       7.431026 20.02265       4.814590 31.11656 9.175316 37.85832 5.369126 -6.741758      10.63080 
1 1 1 -17 30 28 o 13.63477 5.894722 0.8024863      3.589483 -2.249270      6.480587 2.153057       4.311200 15.12796 7.073483 15.70823 6.614017 -0.5802708     9.683975 
1 1 1 -17 30 29 o 12.10550 5.396154 -0.2284620     3.224707 1.740764       6.109064 -0.9890865     3.796750 16.83753 7.470925 12.41947 5.664592 4.418059       9.375624 
1 1 1 -17 30 30 o 32.07223 5.273981 14.65741       3.978810 13.71356       7.078855 15.09331       4.810615 26.76605 9.091582 31.41322 6.498737 -4.647173      11.17544 
1 1 1 -17 31 1  o 19.75692 6.358157 5.151705       3.476215 0.7923346      5.524076 8.009823       4.472887 17.07490 7.346798 24.03003 7.126995 -6.955135      10.23570 
1 1 1 -17 31 2  o 44.60258 4.326874 25.39690       4.643935 17.29797       7.398660 30.66195       5.965407 34.36496 8.798124 48.62646 5.110502 -14.26151      10.17469 
1 1 1 -17 31 3  o 34.41926 5.067738 15.46164       4.123521 12.63737       6.453025 17.41075       5.360780 29.56760 8.502598 35.92986 6.355058 -6.362253      10.61513 
1 1 1 -17 31 4  o 24.47303 7.647385 8.282382       5.060997 11.37455       7.112900 5.111731       7.202604 28.08062 9.099980 22.20805 8.851604 5.872570       12.69490 
1 1 1 -17 31 5  o 24.64095 6.458889 8.301611       3.924820 3.851460       6.590806 10.74685       4.885532 20.70876 8.392593 27.79020 7.167443 -7.081436      11.03666 
1 1 1 -17 31 6  o 39.32662 4.943598 20.02212       4.633248 10.28856       7.805529 25.31745       5.757226 27.07815 9.529640 44.00219 5.488091 -16.92404      10.99696 
1 1 1 -17 31 7  o 51.91181 4.248493 34.22327       5.327518 38.95736       9.634463 32.13817       6.394008 53.15533 7.658494 49.70678 5.363447 3.448551       9.349817 
1 1 1 -17 31 8  o 41.49655 4.707838 22.16090       4.676656 19.72299       8.259317 23.31139       5.673841 36.52558 9.266200 42.08546 5.676985 -5.559875      10.86695 
1 1 1 -17 31 9  o 21.85178 6.989331 6.419742       4.205273 3.260560       6.778280 8.396617       5.361938 20.36630 8.411442 24.61183 7.894277 -4.245533      11.53568 
1 1 1 -17 31 10 o 17.72717 7.307145 2.183852       5.101951 0.000000       0.000000 2.183852       5.101951 ?        ?        17.72717 7.307145 0.000000       7.307145 
1 1 1 -17 31 11 o 37.74939 4.814364 18.47962       4.328148 22.30959       8.139788 16.96991       5.110483 39.08765 8.762557 35.51228 6.126667 3.575375       10.69198 
1 1 1 -17 31 12 o 36.39138 5.096996 17.34024       4.396333 12.82196       8.674600 18.90188       5.099796 29.18229 10.06004 37.69175 5.732673 -8.509462      11.57877 
1 1 1 -17 31 13 o 39.40479 4.708676 20.12655       4.432127 14.59030       8.702704 22.06533       5.150043 30.70632 10.07346 40.97864 5.279801 -10.27233      11.37325 
1 1 1 -17 31 14 o 27.88938 8.253996 11.40157       6.004520 0.000000       0.000000 11.40157       6.004520 ?        ?        27.88938 8.253996 0.000000       8.253996 
1 1 1 -17 31 15 o 56.87378 3.627183 40.88026       5.000904 39.61797       8.381390 41.57809       6.231745 53.92288 6.509918 56.78995 4.540802 -2.867069      7.937122 
1 1 1 -17 31 16 o 19.98554 6.654606 5.368674       3.793485 -9.521528      6.397186 13.44443       4.711187 12.90628 6.289804 31.11365 6.426435 -18.20737      8.992257 
1 1 1 -17 31 17 o 44.62358 4.343602 25.72855       4.663651 18.31074       7.858507 29.76126       5.794298 34.27641 9.211745 47.54092 5.080106 -13.26451      10.51968 
1 1 1 -17 31 18 f 11.05408 5.134218 -2.356194      3.324520 -7.241850      6.065860 -0.2585349     3.974644 13.19411 6.356382 13.81000 6.081324 -0.6158867     8.796937 
1 1 1 -17 31 19 o 68.52004 3.218395 59.12167       5.358927 54.65542       8.883158 61.67708       6.719334 63.62830 5.792462 69.39111 3.990448 -5.762817      7.033939 
1 1 1 -17 31 20 o 42.63940 4.736845 23.96933       4.838977 18.26033       11.33387 25.24197       5.351216 31.46309 11.43528 43.47701 5.150695 -12.01392      12.54174 
1 1 1 -17 31 21 f 30.90412 5.274580 12.98639       3.829833 12.45020       6.788082 13.23676       4.638631 27.85440 8.876814 30.46188 6.449954 -2.607483      10.97268 
1 1 1 -17 31 22 o 20.96428 7.368289 6.315149       4.665318 7.932096       6.560570 4.661015       6.635583 22.99721 8.637838 20.20059 8.330684 2.796619       12.00052 
1 1 1 -17 31 23 o 31.08029 6.554102 14.07657       4.807483 8.663381       8.485046 16.63586       5.834290 23.65039 9.544904 33.11932 7.413989 -9.468929      12.08604 
1 1 1 -17 31 24 o 14.90492 6.386761 1.193148       4.142566 6.087818       7.807303 -0.7248853     4.887282 21.37887 8.944517 14.40219 6.512600 6.976677       11.06428 
1 1 1 -17 31 25 o 46.04252 4.491146 28.37956       4.975109 20.49914       7.355509 35.02493       6.754573 34.93847 8.678311 49.94127 5.649188 -15.00280      10.35502 
1 1 1 -17 31 26 o 10.67583 5.043944 -2.867935      3.448759 -3.388492      5.937150 -2.602841      4.236853 14.04884 6.631657 12.16191 5.697214 1.886930       8.742833 
1 1 1 -17 31 27 f 14.37989 5.945549 1.830964       3.391645 -1.594982      5.955106 3.475768       4.126257 14.85156 6.888905 16.82013 6.701154 -1.968568      9.610540 
1 1 1 -17 31 28 o 17.85553 6.382345 4.641667       3.513022 3.716721       6.278638 5.063200       4.238599 18.21420 7.834704 18.54350 6.947575 -0.3293018     10.47146 
1 1 1 -17 32 1  o 75.75174 2.832937 71.51088       5.220353 72.59642       7.776017 70.62020       7.043591 75.28491 4.255840 74.54839 3.890679 0.7365265      5.766243 
1 1 1 -17 32 2  o 20.79455 6.389166 5.931988       3.549704 5.979912       5.841524 5.903932       4.469581 21.67108 8.148404 20.96328 7.221415 0.7078075      10.88785 
1 1 1 -17 32 3  o 25.60923 7.030929 9.309786       4.520775 6.145356       6.078704 13.22620       6.762510 21.99346 8.302895 29.61452 8.758196 -7.621059      12.06831 
1 1 1 -17 32 4  o 18.32392 6.477121 4.210717       3.608922 2.844946       6.590158 4.795743       4.313151 19.56227 8.203379 19.54103 7.061035 0.2124596E-01  10.82375 
1 1 1 -17 32 5  o 72.70107 3.403560 66.39233       6.013165 81.50502       11.81135 61.10498       6.986308 77.87011 6.277491 69.22883 4.160381 8.641281       7.530980 
1 1 1 -17 32 6  o 20.15847 6.631669 5.444637       3.770695 -1.970894      6.585357 9.061772       4.599288 16.47577 7.493555 25.27470 7.149082 -8.798929      10.35677 
1 1 1 -17 32 7  o 17.19969 6.431203 3.348990       3.628212 6.027898       7.066129 2.389824       4.228142 22.47049 8.826565 16.74082 6.744359 5.729666       11.10831 
1 1 1 -17 32 8  o 51.27645 3.889732 33.42150       4.824162 34.06843       9.377305 33.18866       5.625713 48.56239 8.216704 50.68150 4.605272 -2.119106      9.419276 
1 1 1 -17 32 9  o 63.13725 4.142274 50.88016       6.338044 0.000000       0.000000 50.88016       6.338044 ?        ?        63.13725 4.142274 0.000000       4.142274 
1 1 1 -17 32 10 o 42.70393 4.362468 23.51924       4.476085 20.01383       8.868268 24.71752       5.184993 35.52985 9.883599 43.42998 4.989709 -7.900131      11.07171 
1 1 1 -17 32 11 o 49.21961 4.020432 30.95598       4.780244 24.42236       9.384785 33.24501       5.554852 39.37536 9.815445 50.69767 4.544382 -11.32231      10.81639 
1 1 1 -17 32 12 o 45.11182 4.783908 26.56336       5.179008 32.61887       9.736588 24.17407       6.115977 46.60901 8.896811 42.14655 6.134736 4.462460       10.80686 
1 1 1 -17 32 13 o 20.51176 7.220272 5.609519       4.480984 6.993329       7.559230 4.859822       5.563936 23.26597 9.132257 20.29162 7.872033 2.974354       12.05682 
1 1 1 -17 32 14 o 39.06384 4.961298 20.13630       4.616484 15.54709       10.15059 21.33310       5.183602 30.39050 10.85047 39.90382 5.474844 -9.513323      12.15346 
1 1 1 -17 32 15 o 23.04373 6.942299 7.582539       4.218741 11.52832       9.066130 6.492020       4.766200 27.10985 10.16012 21.61075 7.456647 5.499104       12.60277 
1 1 1 -17 32 16 o 45.85977 4.658377 27.53979       5.133817 15.13087       12.01895 30.30908       5.677846 29.42321 11.52529 47.93288 4.931135 -18.50967      12.53588 
1 1 1 -17 32 17 o 12.32809 5.594635 -1.353996      3.645541 2.314760       6.400511 -3.115690      4.435274 18.58181 7.950009 12.54421 5.860923 6.037594       9.876896 
1 1 1 -17 32 18 o 15.17335 6.122561 2.017164       3.490497 0.8291960      6.255963 2.554152       4.206045 17.34869 7.634928 16.57157 6.708621 0.7771225      10.16355 
1 1 1 -17 32 19 o 16.54823 6.973808 1.936545       4.799706 -0.1973888E-01 10.08974 2.508713       5.456650 19.97206 9.156402 17.68313 7.442997 2.288927       11.79991 
1 1 1 -17 32 20 o 32.98943 6.395787 15.60050       4.956042 15.30629       9.157731 15.72236       5.893719 29.09720 10.31473 32.09301 7.645511 -2.995810      12.83929 
1 1 1 -17 32 21 o 15.68571 6.264985 2.507744       3.615654 8.264700       7.723717 0.8921185      4.091667 23.17926 9.189726 14.64551 6.312422 8.533755       11.14889 
1 1 1 -17 32 22 o 20.40873 6.367156 6.091536       3.509817 12.74045       6.664897 3.540084       4.128685 27.40605 8.802386 17.21560 6.751568 10.19045       11.09350 
1 1 1 -17 32 23 o 26.63824 6.687794 10.72615       4.334404 17.36521       6.962987 6.525995       5.538283 31.99096 8.702579 20.84015 7.912065 11.15080       11.76162 
1 1 1 -17 32 24 o 33.81663 5.260034 15.98186       4.193792 1.130719       6.894159 24.70554       5.283859 17.33841 7.797016 42.14760 5.258569 -24.80919      9.404574 
1 1 1 -17 32 25 o 14.88049 6.209128 1.907182       3.747338 5.117966       6.497516 0.3069248      4.587086 19.58185 8.173835 14.48949 6.448795 5.092352       10.41146 
1 1 1 -17 32 26 o 38.66895 4.749391 20.56431       4.381562 32.37641       7.777530 15.07245       5.303203 45.49853 7.258409 30.81725 7.193289 14.68128       10.21900 
1 1 1 -17 32 27 o 20.66345 6.597819 6.647830       3.748593 5.273796       6.790372 7.250123       4.495718 19.49656 8.259412 21.18786 7.244369 -1.691303      10.98630 
1 1 1 -17 33 1  o 20.13470 5.656210 5.604936       2.889244 5.337583       4.112447 5.865521       4.060072 19.85686 6.922328 20.55006 6.885301 -0.6931992     9.763503 
1 1 1 -17 33 2  o 50.39762 3.720666 32.40246       4.537262 38.82382       8.412718 29.76842       5.388083 52.71243 6.700390 47.66756 4.699538 5.044865       8.184185 
1 1 1 -17 33 3  o 27.74307 6.990824 11.11706       4.723631 5.517385       6.653893 16.80626       6.706870 21.39667 8.514477 33.29299 8.296818 -11.89632      11.88838 
1 1 1 -17 33 4  o 65.30066 3.490762 53.96790       5.534684 51.08715       10.06356 55.21709       6.626917 60.32203 6.974352 65.53773 4.171032 -5.215698      8.126445 
1 1 1 -17 33 5  o 13.96716 5.860975 0.9754625      3.367394 -8.394204      5.491738 6.620880       4.262808 11.91395 5.810942 21.69237 7.045894 -9.778414      9.132998 
1 1 1 -17 33 6  o 57.22647 3.773752 41.72104       5.233300 35.38084       9.476898 44.50269       6.277192 48.94114 8.238453 58.63946 4.425441 -9.698318      9.351825 
1 1 1 -17 33 7  o 37.82692 4.762076 18.81586       4.292620 23.71298       8.456831 17.11620       4.982164 39.14353 9.047004 35.32285 6.002544 3.820679       10.85720 
1 1 1 -17 33 8  o 43.00959 4.347446 23.98567       4.494052 21.99467       9.021106 24.64289       5.182980 36.82758 9.857421 43.18022 5.019011 -6.352638      11.06161 
1 1 1 -17 33 9  o 37.31933 4.925354 18.42353       4.370025 17.41423       8.549816 18.78046       5.084343 32.58411 9.897283 37.14027 5.807737 -4.556160      11.47545 
1 1 1 -17 33 10 o 41.01782 4.647727 22.04202       4.563903 19.04030       8.715302 23.17619       5.357172 34.03986 9.909087 41.57158 5.416846 -7.531723      11.29302 
1 1 1 -17 33 11 o 18.67881 6.620811 4.547034       3.772985 10.21145       7.545944 2.658878       4.356673 25.79126 9.336843 16.94424 6.839088 8.847025       11.57367 
1 1 1 -17 33 12 o 17.51384 7.140931 2.804856       4.805651 6.222127       7.631573 0.5594229      6.186206 22.36430 9.042733 17.20957 7.582268 5.154722       11.80092 
1 1 1 -17 33 13 o 14.91037 6.258752 1.293045       3.841872 4.774612       7.101322 -0.1476495     4.568124 20.90859 8.619913 14.69559 6.493374 6.213001       10.79198 
1 1 1 -17 33 14 o 12.93262 5.748195 -0.5218464     3.632182 -5.771539      7.390643 1.149883       4.170598 15.30886 7.276871 15.18861 6.455231 0.1202555      9.727428 
1 1 1 -17 33 15 o 13.25579 6.120807 -2.321530      4.622585 7.869874       9.331561 -5.635695      5.321380 23.88398 9.867294 12.63359 6.051596 11.25040       11.57520 
1 1 1 -17 33 16 o 32.25200 6.854597 15.15639       5.221130 10.57666       9.061995 17.43210       6.387959 25.52669 10.00506 33.75274 7.905919 -8.226046      12.75166 
1 1 1 -17 33 17 o 16.55266 6.762587 2.566638       4.320464 1.975938       7.574872 2.851463       5.259946 18.98582 8.376510 17.69378 7.367565 1.292046       11.15558 
1 1 1 -17 33 18 o 22.40890 7.399033 7.576219       4.692298 0.000000       0.000000 7.576219       4.692298 ?        ?        22.40890 7.399033 0.000000       7.399033 
1 1 1 -17 33 19 o 24.03596 6.845911 8.691920       4.202831 6.259206       6.744931 10.23595       5.373539 21.21280 8.528001 25.39705 7.871132 -4.184256      11.60524 
1 1 1 -17 33 20 o 53.87347 4.468234 38.61621       5.813344 33.21076       8.128049 44.27707       8.317857 46.79132 7.371975 55.58067 6.249333 -8.789349      9.664376 
1 1 1 -17 33 21 o 15.93473 6.252007 2.939287       3.541644 -0.3405086     6.175069 4.547029       4.323412 15.95804 7.257411 18.31891 6.982131 -2.360864      10.07076 
1 1 1 -17 33 22 o 29.86389 7.401189 14.11049       5.358758 11.89113       6.618263 18.33529       9.131325 25.97523 8.791137 30.22393 10.32471 -4.248703      13.56037 
1 1 1 -17 33 23 o 13.61886 5.874887 0.8503401      3.549940 8.791841       6.400087 -2.678670      4.266395 22.74599 8.534049 12.13138 5.693790 10.61462       10.25911 
1 1 1 -17 33 24 o 23.61256 6.455524 8.568251       3.820318 8.342622       6.652921 8.679252       4.666364 22.10400 8.598821 23.09486 7.359906 -0.9908543     11.31848 
1 1 1 -17 33 25 o 17.62655 6.514810 4.440364       3.702796 -5.326901      6.382091 9.396477       4.546185 13.56670 6.531845 24.05313 7.197668 -10.48644      9.719642 
1 1 1 -17 34 1  o 41.44820 3.947328 22.27287       3.938906 26.43201       5.412823 17.59132       5.742712 44.32765 5.103922 34.62957 7.045139 9.698082       8.699656 
1 1 1 -17 34 2  o 29.80973 7.785676 13.60187       5.716378 15.05804       6.623296 9.349988       11.31772 30.76370 8.535353 25.07786 10.64510 5.685835       13.64443 
1 1 1 -17 34 3  o 18.85932 6.720072 4.771216       3.891622 7.176663       6.215332 3.220062       4.991073 22.34542 8.404408 17.90299 7.285703 4.442432       11.12275 
1 1 1 -17 34 4  o 17.48182 6.632131 3.670845       3.889616 0.9716344      6.007348 5.619240       5.103909 17.12870 7.511698 20.41519 7.628929 -3.286482      10.70636 
1 1 1 -17 34 5  o 12.92710 5.800210 -0.8303389     3.791385 0.5071226      5.607353 -1.956756      5.145967 16.39428 7.221102 14.23572 6.531189 2.158561       9.736567 
1 1 1 -17 34 6  o 30.10088 6.362782 12.88753       4.521027 8.265508       7.154501 15.96009       5.833292 23.62600 8.987326 32.73795 7.476439 -9.111954      11.69056 
1 1 1 -17 34 7  f 36.48000 5.633123 18.23581       4.846621 30.76539       8.382809 11.94454       5.940053 45.42016 7.857952 27.71870 8.211117 17.70146       11.36529 
1 1 1 -17 34 8  o 45.39071 6.303714 28.81186       6.784750 0.000000       0.000000 28.81186       6.784750 ?        ?        45.39071 6.303714 0.000000       6.303714 
1 1 1 -17 34 9  o 20.59872 7.216066 5.957776       4.472094 0.4582423      6.914853 9.911985       5.863405 17.70868 7.897332 25.30652 8.266510 -7.597841      11.43254 
1 1 1 -17 34 10 o 15.61752 6.586160 1.538859       4.285717 11.77669       7.221396 -4.027613      5.324848 26.86467 9.181556 13.35096 6.295570 13.51371       11.13262 
1 1 1 -17 34 11 o 15.58619 6.543340 1.647418       4.200099 5.829530       7.172161 -0.5353635     5.181521 21.44627 8.731461 15.11396 6.781111 6.332314       11.05540 
1 1 1 -17 34 12 o 27.47285 8.887051 12.35158       6.785750 13.56520       8.579379 10.32385       11.08969 27.91618 9.974471 25.41595 10.64872 2.500233       14.59059 
1 1 1 -17 34 13 o 44.56735 4.409459 26.16092       4.726224 30.82138       9.275082 24.52642       5.492836 43.75209 8.999808 42.33559 5.450537 1.416500       10.52164 
1 1 1 -17 34 14 o 20.13050 6.782256 5.824819       3.939093 6.827955       6.899139 5.339647       4.798028 21.90805 8.685467 19.74623 7.393160 2.161821       11.40597 
1 1 1 -17 34 15 o 41.39681 4.465291 22.73835       4.433383 19.96982       8.681506 23.71505       5.156435 33.42982 9.932666 41.71555 5.183931 -8.285732      11.20406 
1 1 1 -17 34 16 o 23.95160 6.924776 8.684067       4.269509 -1.469663      8.397625 12.22364       4.958146 17.62364 8.176746 28.28997 7.180785 -10.66633      10.88223 
1 1 1 -17 34 17 o 10.89368 5.184015 -3.640242      3.772130 -12.53521      7.704330 -0.8356186     4.326133 13.14417 6.502634 13.52199 6.119703 -0.3778143     8.929446 
1 1 1 -17 34 18 o 14.88340 6.277176 1.604542       3.893634 3.084248       6.332364 0.7050108      4.937264 18.28300 7.866271 15.33668 6.764756 2.946321       10.37498 
1 1 1 -17 34 19 o 14.75090 6.183614 1.696484       3.742535 2.754251       6.295793 1.118434       4.654127 17.93892 7.781023 15.27864 6.657870 2.660275       10.24068 
1 1 1 -17 34 20 o 16.34574 6.671580 2.887636       4.199976 2.958326       11.23206 2.876145       4.528481 20.53810 9.503715 16.60562 6.868356 3.932486       11.72582 
1 1 1 -17 34 21 o 17.24512 7.288224 3.052811       5.266509 2.166718       6.626346 4.572492       8.677817 17.59500 7.795280 20.07925 8.907000 -2.484255      11.83643 
1 1 1 -17 34 22 o 11.49551 5.362928 -2.120821      3.691097 1.067474       6.486528 -3.647593      4.488696 16.73668 7.541532 11.90059 5.660857 4.836094       9.429741 
1 1 1 -17 35 1  o 28.68668 5.663970 11.66029       3.818896 9.374751       4.525428 17.31412       7.117640 24.68423 7.127094 32.01606 8.834875 -7.331829      11.35123 
1 1 1 -17 35 2  o 12.28000 5.424628 -0.1770343     3.186174 14.25421       5.776356 -6.487797      3.819821 30.01365 7.820248 9.670947 4.744082 20.34271       9.146726 
1 1 1 -17 35 3  o 14.08335 5.787984 1.582736       3.188664 5.268435       5.244336 -0.5789945     4.016348 19.71716 7.644411 13.30659 5.970198 6.410578       9.699499 
1 1 1 -17 35 4  o 8.644430 4.251750 -5.793699      3.133398 -2.878376      5.169832 -7.486479      3.939430 13.55185 6.330385 9.517632 4.697665 4.034214       7.883009 
1 1 1 -17 35 5  o 12.67825 5.600782 -0.1643083     3.396794 4.133381       5.856236 -2.343287      4.169918 19.05473 7.838867 12.37427 5.748312 6.680461       9.720644 
1 1 1 -17 35 6  o 31.06923 5.609972 13.50793       4.091175 17.00591       7.356703 11.94177       4.922571 31.70987 9.065772 28.03035 7.176507 3.679512       11.56246 
1 1 1 -17 35 7  o 17.62916 7.013121 3.586389       4.512884 0.000000       0.000000 3.586389       4.512884 ?        ?        17.62916 7.013121 0.000000       7.013121 
1 1 1 -17 35 8  o 31.28639 5.746342 13.78200       4.219700 16.28584       7.933909 12.79436       4.982910 30.38295 9.586433 29.10323 7.091903 1.279718       11.92455 
1 1 1 -17 35 9  o 48.26801 4.860914 31.33473       5.639810 39.19981       9.811088 27.45314       6.892395 49.88737 8.366227 43.38698 6.737352 6.500393       10.74177 
1 1 1 -17 35 10 o 16.48212 6.469376 3.096403       3.793495 2.371706       6.920617 3.407670       4.535590 18.47438 8.083183 17.42535 6.997409 1.049038       10.69119 
1 1 1 -17 35 11 o 52.74729 4.834076 37.43181       6.144670 20.09786       8.766035 54.17619       8.615666 33.17538 10.00999 62.36690 5.732994 -29.19152      11.53547 
1 1 1 -17 35 12 o 11.20241 5.152610 -1.580634      3.230945 -3.698049      5.786386 -0.6214072     3.894620 13.89230 6.554463 13.05057 5.865253 0.8417292      8.795578 
1 1 1 -17 35 13 o 20.83712 6.829098 6.503846       4.000080 10.60555       8.543370 5.352211       4.526934 24.56738 9.688571 19.40125 7.197419 5.166130       12.06943 
1 1 1 -17 35 14 o 17.62935 6.536786 4.188095       3.733176 1.820924       6.671500 5.267187       4.504409 17.70485 7.833966 19.23944 7.171399 -1.534588      10.62073 
1 1 1 -17 35 15 o 21.77515 6.959316 7.284213       4.169861 5.868533       7.514699 7.914040       5.012327 20.76955 8.737885 22.33084 7.648890 -1.561281      11.61276 
1 1 1 -17 35 16 o 46.00168 4.525084 28.47042       5.007076 21.30483       8.933482 31.75247       6.045989 33.29519 10.11766 47.81799 5.276092 -14.52280      11.41070 
1 1 1 -17 35 17 o 36.16980 7.268694 20.32305       6.184253 0.000000       0.000000 20.32305       6.184253 ?        ?        36.16980 7.268694 0.000000       7.268694 
1 1 1 -17 35 18 o 15.78093 6.547326 2.432160       4.132582 3.243152       8.099704 2.146746       4.805063 19.12760 8.537512 16.14106 6.896570 2.986536       10.97505 
1 1 1 -17 35 19 o 24.90367 6.621535 9.589027       4.087453 21.23125       7.207252 4.069017       4.962743 35.23587 8.493729 17.88479 7.269935 17.35108       11.18013 
1 1 1 -17 35 20 o 35.67744 5.792202 18.46736       4.863307 10.11655       7.426678 24.73681       6.434947 23.45403 9.095923 40.22082 6.807986 -16.76679      11.36154 
1 1 1 -17 36 1  o 11.22853 5.046594 -0.6041218     2.883628 2.982509       4.119916 -4.048632      4.037465 16.33750 6.630193 11.03859 5.283193 5.298915       8.477712 
1 1 1 -17 36 2  o 12.16069 5.424582 -0.3212953     3.264758 -0.4849033E-01 5.464114 -0.4727562     4.071402 15.27631 6.899092 13.28107 5.980474 1.995237       9.130363 
1 1 1 -17 36 3  o 23.26379 6.425006 8.188046       3.762536 4.946282       6.483240 9.834375       4.620189 19.56252 8.165239 24.93354 7.202008 -5.371017      10.88761 
1 1 1 -17 36 4  f 16.01684 6.269400 3.046355       3.554299 -0.4433941     6.007266 4.926023       4.408800 15.65241 7.133805 18.70445 7.068867 -3.052033      10.04291 
1 1 1 -17 36 5  f 39.57733 4.727541 21.29121       4.469441 24.74687       8.048893 19.75066       5.374125 38.17730 8.827803 36.79832 6.214048 1.378979       10.79558 
1 1 1 -17 36 6  f 22.94518 7.216529 8.273291       4.499450 0.000000       0.000000 8.273291       4.499450 ?        ?        22.94518 7.216529 0.000000       7.216529 
1 1 1 -17 36 7  o 29.78459 5.962317 12.87338       4.176449 5.921803       7.279459 16.28440       5.099175 20.67614 8.642709 33.05423 6.562029 -12.37809      10.85157 
1 1 1 -17 36 8  o 35.33712 5.055864 17.24723       4.229816 15.21775       7.518961 18.18686       5.116129 28.83902 9.356934 35.34556 6.163787 -6.506540      11.20466 
1 1 1 -17 36 9  o 20.13699 6.756429 6.092796       3.909375 9.217231       6.724111 4.497384       4.804914 23.30965 8.747017 18.43167 7.266792 4.877983       11.37174 
1 1 1 -17 36 10 o 23.10070 7.561697 8.566985       4.905002 1.716036       6.595795 17.04337       7.336637 17.45571 7.753043 30.90544 9.117853 -13.44973      11.96850 
1 1 1 -17 36 11 o 48.69860 4.263743 31.58477       5.008928 26.61721       9.501251 33.49677       5.894592 37.53912 10.14641 49.43805 4.959705 -11.89893      11.29372 
1 1 1 -17 36 12 o 28.84502 6.242981 12.33683       4.260774 17.25506       8.345208 10.60273       4.955316 29.88167 9.867394 25.65112 7.473210 4.230553       12.37798 
1 1 1 -17 36 13 o 33.68163 5.549688 16.13530       4.396591 17.54735       8.560150 15.62934       5.124095 29.85517 9.997544 32.04040 6.774804 -2.185232      12.07679 
1 1 1 -17 36 14 o 13.38659 5.882170 0.3680033      3.700128 -1.930192      6.484313 1.477651       4.505709 15.25515 7.113987 15.29556 6.608511 -0.4040623E-01 9.709852 
1 1 1 -17 36 15 o 35.04031 5.690084 17.65465       4.692206 14.42770       8.189431 19.23172       5.725105 27.02854 9.734522 35.39891 6.884724 -8.370371      11.92310 
1 1 1 -17 36 16 o 15.08773 6.648336 0.9562742      4.757654 0.000000       0.000000 0.9562742      4.757654 ?        ?        15.08773 6.648336 0.000000       6.648336 
1 1 1 -17 36 17 o 16.19390 6.495703 3.109206       3.903966 5.666819       7.213153 2.049627       4.642741 20.03271 8.500705 15.81105 6.767892 4.221666       10.86583 
1 1 1 -17 37 1  o 19.48551 5.890849 5.686962       3.033820 7.407078       4.468559 4.216122       4.132105 21.37634 7.223701 17.47624 6.782796 3.900095       9.908995 
1 1 1 -17 37 2  o 15.15051 6.107381 2.533509       3.469493 2.815726       5.604494 2.358153       4.417783 17.12324 7.384126 15.82625 6.681193 1.296988       9.958095 
1 1 1 -17 37 3  o 26.75406 6.104861 10.73158       3.892021 13.37146       7.008123 9.554266       4.680097 26.66772 9.046189 24.17554 7.318300 2.492182       11.63577 
1 1 1 -17 37 4  o 26.48728 6.228037 10.58752       3.951943 11.24803       7.304176 10.31414       4.699162 24.47415 9.130226 25.22524 7.256281 -0.7510929     11.66253 
1 1 1 -17 37 5  o 16.80624 6.423585 3.764113       3.665980 -0.6422255     6.636907 5.698785       4.397749 15.92972 7.347855 19.37907 7.110662 -3.449356      10.22509 
1 1 1 -17 37 6  o 12.00849 5.481473 -1.057758      3.564303 -4.552981      6.265254 0.6147700      4.333992 13.79054 6.595170 14.34756 6.332838 -0.5570250     9.143363 
1 1 1 -17 37 7  o 21.46236 6.859963 7.228015       4.051581 5.370016       6.892904 8.208812       5.008051 19.76421 8.344670 22.32423 7.645657 -2.560020      11.31767 
1 1 1 -17 37 8  o 28.48516 6.096419 12.06680       4.104042 26.69192       8.155120 7.106690       4.749266 39.32185 8.737444 21.07011 7.431869 18.25174       11.47064 
1 1 1 -17 37 9  o 13.54681 6.224424 -1.207848      4.697877 -7.207062      6.498304 5.360441       6.799531 13.07845 6.365999 19.71697 8.304337 -6.638522      10.46365 
1 1 1 -17 37 10 o 17.92426 6.766371 4.546865       4.036931 5.748842       7.560527 4.067518       4.774511 20.21887 8.645185 17.74349 7.160303 2.475382       11.22538 
1 1 1 -17 37 11 o 29.69115 6.072010 13.08153       4.245015 17.96445       8.334664 11.37119       4.932755 30.00413 9.858962 26.42164 7.379151 3.582489       12.31467 
1 1 1 -17 37 12 f 29.93549 6.218517 13.41681       4.387970 17.56101       8.412911 11.86811       5.142925 29.49083 9.911594 26.82186 7.550488 2.668972       12.45992 
1 1 1 -16 0  1  o 451.6927 7.734273 2494.575       85.07687 2494.575       85.07687 2494.575       85.07687 451.6927 7.734273 451.6927 7.734273 -0.000000      0.000000 
1 1 1 -16 0  2  f 113.4440 3.113054 157.2263       8.591408 157.2263       8.591408 157.2263       8.591408 113.4440 3.113054 113.4440 3.113054 -0.000000      0.000000 
1 1 1 -16 0  3  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -16 0  4  o 301.0919 6.637784 1108.187       48.64986 1108.187       48.64986 1108.187       48.64986 301.0919 6.637784 301.0919 6.637784 0.000000       0.000000 
1 1 1 -16 0  5  o 110.2133 3.736448 148.5972       10.00910 148.5972       10.00910 148.5972       10.00910 110.2133 3.736448 110.2133 3.736448 0.000000       0.000000 
1 1 1 -16 0  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -16 0  7  o 79.50639 3.571010 77.52602       6.886907 77.52602       6.886907 77.52602       6.886907 79.50639 3.571010 79.50639 3.571010 -0.000000      0.000000 
1 1 1 -16 0  8  o 278.9177 8.722780 953.6361       59.15664 953.6361       59.15664 953.6361       59.15664 278.9177 8.722780 278.9177 8.722780 -0.000000      0.000000 
1 1 1 -16 0  9  o 9.998290 6.417472 0.8861817E-01  3.553531 0.8861817E-01  3.553531 0.8861817E-01  3.553531 9.998290 6.417472 9.998290 6.417472 -0.000000      0.000000 
1 1 1 -16 0  10 o 10.13993 6.241173 0.9587333      2.998370 0.9587333      2.998370 0.9587333      2.998370 10.13993 6.241173 10.13993 6.241173 0.000000       0.000000 
1 1 1 -16 0  11 o 227.2522 5.308082 631.0630       29.35934 631.0630       29.35934 631.0630       29.35934 227.2522 5.308082 227.2522 5.308082 0.000000       0.000000 
1 1 1 -16 0  12 o 182.5861 4.590793 407.3619       20.39721 407.3619       20.39721 407.3619       20.39721 182.5861 4.590793 182.5861 4.590793 0.000000       0.000000 
1 1 1 -16 0  13 o 210.3655 7.189791 542.4059       36.75988 542.4059       36.75988 542.4059       36.75988 210.3655 7.189791 210.3655 7.189791 -0.000000      0.000000 
1 1 1 -16 0  14 o 63.88510 3.629786 50.24003       5.608829 50.24003       5.608829 50.24003       5.608829 63.88510 3.629786 63.88510 3.629786 0.000000       0.000000 
1 1 1 -16 0  15 o 61.34618 3.707925 46.38657       5.496274 46.38657       5.496274 46.38657       5.496274 61.34618 3.707925 61.34618 3.707925 -0.000000      0.000000 
1 1 1 -16 0  16 o 200.5279 4.877105 491.4398       23.80084 491.4398       23.80084 491.4398       23.80084 200.5279 4.877105 200.5279 4.877105 0.000000       0.000000 
1 1 1 -16 0  17 o 325.2000 7.059511 1293.965       55.88548 1293.965       55.88548 1293.965       55.88548 325.2000 7.059511 325.2000 7.059511 -0.000000      0.000000 
1 1 1 -16 0  18 o 42.63412 6.452757 23.66420       6.250105 23.66420       6.250105 23.66420       6.250105 42.63412 6.452757 42.63412 6.452757 -0.000000      0.000000 
1 1 1 -16 0  19 o 100.6395 3.699684 124.0133       9.045520 124.0133       9.045520 124.0133       9.045520 100.6395 3.699684 100.6395 3.699684 -0.000000      0.000000 
1 1 1 -16 0  20 o 125.2040 3.908066 191.7551       11.89752 191.7551       11.89752 191.7551       11.89752 125.2040 3.908066 125.2040 3.908066 -0.000000      0.000000 
1 1 1 -16 0  21 o 55.83029 4.034252 38.61388       5.421498 38.61388       5.421498 38.61388       5.421498 55.83029 4.034252 55.83029 4.034252 0.000000       0.000000 
1 1 1 -16 0  22 o 153.8977 4.300333 289.6600       16.09915 289.6600       16.09915 289.6600       16.09915 153.8977 4.300333 153.8977 4.300333 -0.000000      0.000000 
1 1 1 -16 0  23 o 73.50908 5.829671 67.24889       10.28737 67.24889       10.28737 67.24889       10.28737 73.50908 5.829671 73.50908 5.829671 0.000000       0.000000 
1 1 1 -16 0  24 o 8.773385 6.259869 -8.837256      5.972521 -8.837256      5.972521 -8.837256      5.972521 8.773385 6.259869 8.773385 6.259869 0.000000       0.000000 
1 1 1 -16 0  25 o 18.04239 8.531742 5.847474       4.245881 5.847474       4.245881 5.847474       4.245881 18.04239 8.531742 18.04239 8.531742 0.000000       0.000000 
1 1 1 -16 0  26 o 9.611716 6.396872 -1.225651      4.030910 -1.225651      4.030910 -1.225651      4.030910 9.611716 6.396872 9.611716 6.396872 -0.000000      0.000000 
1 1 1 -16 0  27 o 20.51291 8.642201 7.290844       4.352663 7.290844       4.352663 7.290844       4.352663 20.51291 8.642201 20.51291 8.642201 -0.000000      0.000000 
1 1 1 -16 0  28 o 127.2763 4.127399 198.3988       12.77095 198.3988       12.77095 198.3988       12.77095 127.2763 4.127399 127.2763 4.127399 0.000000       0.000000 
1 1 1 -16 0  29 o 41.61791 5.631469 22.31337       5.416800 22.31337       5.416800 22.31337       5.416800 41.61791 5.631469 41.61791 5.631469 0.000000       0.000000 
1 1 1 -16 0  30 o 159.3094 6.130784 312.2827       23.72074 312.2827       23.72074 312.2827       23.72074 159.3094 6.130784 159.3094 6.130784 -0.000000      0.000000 
1 1 1 -16 0  31 o 12.36299 7.700635 1.206553       4.699185 1.206553       4.699185 1.206553       4.699185 12.36299 7.700635 12.36299 7.700635 -0.000000      0.000000 
1 1 1 -16 0  32 o 17.22253 8.804956 5.377062       4.667955 5.377062       4.667955 5.377062       4.667955 17.22253 8.804956 17.22253 8.804956 -0.000000      0.000000 
1 1 1 -16 0  33 o 135.0753 4.334792 223.9581       14.23526 223.9581       14.23526 223.9581       14.23526 135.0753 4.334792 135.0753 4.334792 0.000000       0.000000 
1 1 1 -16 0  34 o 242.5031 5.821881 724.5579       34.35983 724.5579       34.35983 724.5579       34.35983 242.5031 5.821881 242.5031 5.821881 -0.000000      0.000000 
1 1 1 -16 0  35 o 44.22761 10.07839 27.86404       9.465876 27.86404       9.465876 27.86404       9.465876 44.22761 10.07839 44.22761 10.07839 0.000000       0.000000 
1 1 1 -16 0  36 o 81.95086 4.180140 83.06171       8.298132 83.06171       8.298132 83.06171       8.298132 81.95086 4.180140 81.95086 4.180140 -0.000000      0.000000 
1 1 1 -16 0  37 o 24.92924 8.963986 10.29238       4.983156 10.29238       4.983156 10.29238       4.983156 24.92924 8.963986 24.92924 8.963986 0.000000       0.000000 
1 1 1 -16 0  38 o 26.63038 8.743931 11.37101       5.032818 11.37101       5.032818 11.37101       5.032818 26.63038 8.743931 26.63038 8.743931 0.000000       0.000000 
1 1 1 -16 0  39 o 95.23960 4.226335 112.7476       9.764751 112.7476       9.764751 112.7476       9.764751 95.23960 4.226335 95.23960 4.226335 -0.000000      0.000000 
1 1 1 -16 0  40 o 61.27199 4.742228 47.57013       6.980607 47.57013       6.980607 47.57013       6.980607 61.27199 4.742228 61.27199 4.742228 -0.000000      0.000000 
1 1 1 -16 0  41 o 11.86317 7.748549 0.7747563E-01  5.495536 0.7747563E-01  5.495536 0.7747563E-01  5.495536 11.86317 7.748549 11.86317 7.748549 -0.000000      0.000000 
1 1 1 -16 0  42 o 25.44688 9.368095 11.46736       5.372722 11.46736       5.372722 11.46736       5.372722 25.44688 9.368095 25.44688 9.368095 -0.000000      0.000000 
1 1 1 -16 0  43 o 12.70673 7.805079 2.351542       4.667065 2.351542       4.667065 2.351542       4.667065 12.70673 7.805079 12.70673 7.805079 0.000000       0.000000 
1 1 1 -16 0  44 o 8.599485 6.237312 -12.56103      7.134265 -12.56103      7.134265 -12.56103      7.134265 8.599485 6.237312 8.599485 6.237312 -0.000000      0.000000 
1 1 1 -16 0  45 o 11.73374 7.586177 1.148304       5.083984 1.148304       5.083984 1.148304       5.083984 11.73374 7.586177 11.73374 7.586177 -0.000000      0.000000 
1 1 1 -16 0  46 o 7.779001 5.560392 -5.994512      4.796072 -5.994512      4.796072 -5.994512      4.796072 7.779001 5.560392 7.779001 5.560392 0.000000       0.000000 
1 1 1 -16 0  47 o 10.35485 7.033077 -0.9951071     5.356812 -0.9951071     5.356812 -0.9951071     5.356812 10.35485 7.033077 10.35485 7.033077 0.000000       0.000000 
1 1 1 -16 1  1  o 375.6006 5.084984 1722.802       46.54275 1718.054       73.71097 1725.951       60.02116 374.4423 8.078135 375.6642 6.556445 -1.221924      10.40400 
1 1 1 -16 1  2  o 410.7793 6.158615 2062.611       61.64923 1872.528       116.4813 2136.575       72.66034 389.3506 12.29204 417.8504 7.135765 -28.49982      14.21314 
1 1 1 -16 1  3  o 333.8329 4.574362 1360.247       37.21309 1384.973       59.44633 1344.315       47.71965 336.4124 7.251318 331.6806 5.903928 4.731750       9.350828 
1 1 1 -16 1  4  o 67.97064 2.572925 56.40333       4.254023 54.99980       5.990868 57.83076       6.041648 67.04803 3.680754 68.76156 3.618301 -1.713531      5.161401 
1 1 1 -16 1  5  o 443.5098 6.564108 2405.087       70.94389 2365.740       99.31968 2446.076       101.3714 439.1020 9.281835 446.4834 9.316957 -7.381439      13.15135 
1 1 1 -16 1  6  f 116.0648 2.647815 164.2307       7.489005 162.7946       10.60812 165.6575       10.57407 115.4608 3.775307 116.4757 3.730190 -1.014954      5.307283 
1 1 1 -16 1  7  o 176.9686 3.191108 381.9094       13.76175 372.2979       19.34017 391.7672       19.58628 174.5935 4.549528 179.1088 4.490985 -4.515350      6.392743 
1 1 1 -16 1  8  o 105.9020 2.926198 136.8527       7.544446 139.7670       12.77410 135.2916       9.349209 106.8829 4.917582 105.2525 3.650601 1.630363       6.124500 
1 1 1 -16 1  9  o 377.6569 6.541912 1744.092       60.20579 1748.350       73.99746 1735.754       103.5536 377.7706 8.038084 375.2349 11.33768 2.535736       13.89798 
1 1 1 -16 1  10 o 199.1334 3.930265 483.8098       19.07226 478.3291       23.36722 494.7472       33.00991 197.9336 4.844526 200.9985 6.748881 -3.064865      8.307637 
1 1 1 -16 1  11 o 291.4602 4.536029 1036.955       32.21745 1080.239       46.76434 997.8529       44.44854 297.2021 6.456943 285.6558 6.385258 11.54630       9.080949 
1 1 1 -16 1  12 o 623.3786 10.48600 4782.664       159.2935 4748.584       194.1638 4852.826       278.5930 619.5963 12.85948 621.2471 18.42255 -1.650818      22.46679 
1 1 1 -16 1  13 o 462.9753 6.829183 2623.245       77.04822 2582.737       108.0143 2665.207       109.9364 458.3733 9.669984 465.6261 9.688760 -7.252747      13.68871 
1 1 1 -16 1  14 o 397.6690 6.867498 1935.761       66.55128 1957.887       116.3402 1924.998       81.13779 397.8819 12.01260 396.1085 8.405681 1.773407       14.66145 
1 1 1 -16 1  15 o 427.5797 6.345799 2236.754       66.12102 2215.925       92.97196 2258.073       94.05595 424.7141 8.982954 428.7266 9.002637 -4.012451      12.71774 
1 1 1 -16 1  16 o 16.33169 5.303377 3.144957       2.415147 3.446018       3.591531 2.896439       3.263108 18.13776 6.456539 16.95730 6.139721 1.180456       8.909718 
1 1 1 -16 1  17 o 245.6812 4.598073 737.1854       27.52858 738.4668       33.82644 734.6724       47.37165 245.7469 5.648487 244.5596 7.959332 1.187302       9.759936 
1 1 1 -16 1  18 o 50.69322 3.981754 31.56300       4.879362 26.07891       6.896644 37.05924       6.904281 45.72221 6.361849 54.81408 5.232218 -9.091869      8.237064 
1 1 1 -16 1  19 o 79.93810 2.614592 78.01018       5.086385 79.07360       7.347908 77.03180       7.047935 80.39958 3.760789 79.36137 3.654128 1.038216       5.243680 
1 1 1 -16 1  20 o 21.20188 5.304374 5.713388       2.733555 7.129175       4.038941 4.516743       3.713226 23.79650 6.688501 19.76195 6.583927 4.034554       9.385315 
1 1 1 -16 1  21 o 268.7366 4.962631 883.0553       32.49937 979.3749       60.25648 843.5414       38.59410 281.8276 8.784453 262.4347 6.034810 19.39294       10.65765 
1 1 1 -16 1  22 o 171.2188 3.178477 357.7447       13.26192 356.7806       18.84784 358.6900       18.66389 170.7935 4.532503 171.2583 4.475966 -0.4647522     6.370075 
1 1 1 -16 1  23 o 54.40990 3.524390 36.29433       4.647882 34.37244       8.794434 37.03920       5.474977 52.44281 7.060773 54.90647 4.121970 -2.463657      8.175889 
1 1 1 -16 1  24 f 190.2018 3.948038 441.9855       18.29920 438.9105       22.32800 448.2764       31.93638 189.3491 4.842916 190.9074 6.876013 -1.558289      8.410315 
1 1 1 -16 1  25 o 164.8663 3.155467 331.7944       12.67744 327.1952       17.84389 336.4820       18.01455 163.5060 4.482597 165.8152 4.462291 -2.309174      6.325007 
1 1 1 -16 1  26 o 120.3363 2.855658 176.7274       8.374120 165.8605       11.69594 188.1578       11.99532 116.4026 4.129761 124.0098 3.974485 -7.607193      5.731619 
1 1 1 -16 1  27 o 13.87723 5.634053 0.9396954      2.976351 0.6112302      4.251198 1.255493       4.168415 15.84609 6.612824 16.33852 6.654806 -0.4924335     9.381679 
1 1 1 -16 1  28 o 106.5645 2.838200 138.7297       7.363845 132.1889       10.29294 145.5878       10.53954 103.8743 4.074162 109.0334 3.973313 -5.159164      5.690871 
1 1 1 -16 1  29 o 233.8641 3.939738 669.1222       22.45262 668.7607       31.86978 669.4783       31.63708 233.3147 5.605326 233.4550 5.561056 -0.1402283     7.895886 
1 1 1 -16 1  30 o 155.5403 3.635572 295.9096       13.78009 285.2467       17.00574 316.2994       23.51597 152.4730 4.582048 160.1620 6.035941 -7.689041      7.578110 
1 1 1 -16 1  31 o 142.7359 3.079618 249.0358       10.71189 252.1822       15.33149 246.0349       14.97268 143.3318 4.394597 141.5842 4.344729 1.747528       6.179737 
1 1 1 -16 1  32 o 101.7296 2.912458 126.6165       7.212666 120.3338       10.08286 133.2005       10.32184 98.95208 4.190898 104.1406 4.075119 -5.188477      5.845530 
1 1 1 -16 1  33 o 200.4444 3.621747 492.5305       17.69083 503.9160       25.38190 481.7743       24.67049 202.0558 5.159078 197.5791 5.128234 4.476669       7.274261 
1 1 1 -16 1  34 o 88.76884 2.909606 96.57116       6.285555 90.20504       8.815306 103.1551       8.964815 85.50864 4.243756 91.50854 4.030047 -5.999893      5.852414 
1 1 1 -16 1  35 o 33.34098 7.748808 14.63487       6.175691 9.504691       8.704439 19.83472       8.763350 28.36225 10.05601 38.45632 9.425635 -10.09407      13.78281 
1 1 1 -16 1  36 o 40.56814 3.829144 20.47416       3.740711 18.66827       5.333307 22.22279       5.248052 38.17158 5.925546 41.91787 5.252638 -3.746288      7.918478 
1 1 1 -16 1  37 o 20.31203 6.117911 5.293205       3.276567 3.762879       4.599562 6.869912       4.668743 19.26701 7.233453 23.15730 7.359720 -3.890295      10.31932 
1 1 1 -16 1  38 o 119.9373 3.020330 177.4713       8.820620 186.8288       12.66654 168.6613       12.29044 122.3192 4.255880 116.1499 4.349910 6.169289       6.085576 
1 1 1 -16 1  39 o 89.87974 2.986347 99.95420       6.531827 103.1862       9.329166 96.84628       9.148288 90.63018 4.235815 87.76177 4.290586 2.868408       6.029200 
1 1 1 -16 1  40 o 38.42856 4.205706 18.83326       3.874239 19.62530       5.529676 18.06960       5.429696 38.33423 6.125477 36.66141 6.304844 1.672817       8.790480 
1 1 1 -16 1  41 o 20.38779 7.163443 5.432625       4.409285 2.339452       6.306856 8.389985       6.166843 18.91821 7.984483 24.35951 8.477777 -5.441307      11.64580 
1 1 1 -16 1  42 o 20.29975 6.401845 5.740659       3.538612 3.059612       5.093657 8.241592       4.919588 18.02590 7.351013 23.71148 7.557025 -5.685583      10.54258 
1 1 1 -16 1  43 o 14.10162 5.931718 1.136703       3.462210 2.468439       4.784471 -0.3272558     5.016367 16.95328 7.040234 15.02064 6.710601 1.932646       9.726102 
1 1 1 -16 1  44 o 9.865212 4.912498 -10.15470      4.683925 -14.43780      6.440238 -5.345091      6.824599 11.21339 5.610849 14.43845 6.899101 -3.225060      8.892650 
1 1 1 -16 1  45 o 14.01416 6.025182 1.077696       3.709908 0.1420811      5.281163 1.989214       5.212710 15.12935 6.812143 16.35143 7.086358 -1.222078      9.829638 
1 1 1 -16 1  46 o 11.05817 5.202229 -2.373526      3.598024 -2.407141      5.285944 -2.344505      4.911422 13.39701 6.303444 12.97466 6.095729 0.4223566      8.768769 
1 1 1 -16 1  47 o 12.11126 5.567940 -0.9398460     3.766461 -4.630301      5.204919 3.117017       5.457191 12.11090 5.847826 16.65557 7.234188 -4.544676      9.302179 
1 1 1 -16 2  1  o 156.1568 2.487462 297.2791       9.465716 292.4321       13.25471 302.3239       13.52239 154.8366 3.512857 157.4330 3.524696 -2.596390      4.976308 
1 1 1 -16 2  2  o 390.1270 5.881349 1859.961       55.91380 1909.656       114.5732 1844.426       64.06010 393.3076 11.96797 388.3079 6.769792 4.999664       13.74999 
1 1 1 -16 2  3  o 121.9323 3.270495 181.4450       9.709035 164.7434       17.44040 188.9456       11.68756 115.9283 6.196003 124.3900 3.860365 -8.461746      7.300197 
1 1 1 -16 2  4  o 179.5557 3.212884 393.1657       14.05822 376.8122       26.65055 399.4706       16.54777 175.4639 6.242734 180.9615 3.752469 -5.497574      7.283732 
1 1 1 -16 2  5  o 194.8552 3.391374 463.0640       16.10363 484.4961       23.42752 443.8671       22.17224 199.2170 4.825738 190.6254 4.776778 8.591629       6.790092 
1 1 1 -16 2  6  f 214.5425 4.121966 561.6164       21.55033 569.2893       37.17331 557.7324       26.44824 215.5943 7.085135 213.7221 5.078217 1.872147       8.717076 
1 1 1 -16 2  7  o 226.8100 4.289933 627.7573       23.71094 629.3323       40.78683 626.9532       29.14101 226.6357 7.394985 226.5761 5.277817 0.5958557E-01  9.085217 
1 1 1 -16 2  8  o 369.4968 5.561931 1667.839       50.08093 1724.446       72.48699 1616.141       69.27257 375.2139 7.927662 363.2645 7.825322 11.94937       11.13928 
1 1 1 -16 2  9  o 215.5683 3.610772 566.8381       18.96798 533.1542       26.01780 605.0510       27.71180 208.9488 5.109692 222.5920 5.108802 -13.64320      7.225566 
1 1 1 -16 2  10 o 109.0808 3.694448 145.3172       9.806337 145.3172       9.806337 0.000000       0.000000 109.0808 3.694448 ?        ?        0.000000       3.694448 
1 1 1 -16 2  11 o 286.5191 4.475811 1002.062       31.25082 1051.040       45.64589 958.8494       42.87482 293.1644 6.389316 280.0290 6.282945 13.13544       8.960958 
1 1 1 -16 2  12 o 148.6985 2.891985 269.6221       10.47945 278.5981       15.19164 261.4734       14.47471 151.0364 4.131380 146.3230 4.063330 4.713425       5.794734 
1 1 1 -16 2  13 o 26.90160 4.119202 9.035273       2.614566 10.93886       3.859176 7.420229       3.554674 29.43679 5.584069 24.16551 6.050507 5.271284       8.233496 
1 1 1 -16 2  14 o 131.8666 2.760164 212.0322       8.869637 208.3126       12.64429 215.6355       12.44520 130.5918 3.977857 132.8799 3.847369 -2.288086      5.534040 
1 1 1 -16 2  15 o 190.0544 3.837751 440.7764       17.77423 397.0061       29.60701 465.4406       22.22485 179.9602 6.763249 195.2284 4.671536 -15.26817      8.219781 
1 1 1 -16 2  16 o 344.2105 5.232670 1447.859       43.89182 1418.150       61.34625 1479.018       62.82497 340.1637 7.400550 347.3812 7.421470 -7.217499      10.48076 
1 1 1 -16 2  17 o 200.1603 3.988745 489.0370       19.45585 502.1009       24.27385 465.5663       32.53624 202.7220 4.913620 194.8367 6.863400 7.885284       8.440967 
1 1 1 -16 2  18 o 185.5793 3.788310 420.3527       17.13212 413.8776       29.66631 423.5927       20.98510 183.6994 6.637955 186.2146 4.624462 -2.515198      8.089999 
1 1 1 -16 2  19 o 85.51225 2.933132 89.29890       6.103130 85.60600       10.68361 91.08783       7.435874 83.50785 5.276929 86.32124 3.542435 -2.813393      6.355693 
1 1 1 -16 2  20 o 242.5687 4.570875 718.9391       27.01906 745.5431       48.29269 706.8170       32.59864 246.1622 8.061392 240.3529 5.565627 5.809341       9.796032 
1 1 1 -16 2  21 f 144.0487 2.921677 253.1385       10.25599 259.4288       14.87958 247.4453       14.15579 145.6726 4.195943 142.2778 4.087061 3.394714       5.857474 
1 1 1 -16 2  22 o 128.3104 2.811244 200.8416       8.790158 213.3768       12.94474 190.1155       11.97423 132.1096 4.025592 124.7024 3.945331 7.407135       5.636580 
1 1 1 -16 2  23 o 97.64565 3.147006 116.4820       7.478579 121.6947       13.90156 114.3590       8.871743 99.50704 5.757477 96.69473 3.772281 2.812317       6.883215 
1 1 1 -16 2  24 o 216.0686 4.281900 570.6577       22.54573 564.0358       27.48004 584.2938       39.43406 214.6385 5.253801 217.8120 7.440322 -3.173477      9.108283 
1 1 1 -16 2  25 o 120.7978 3.334119 178.2992       9.805293 175.1265       11.91556 184.9540       17.25709 119.6316 4.093293 122.6895 5.788290 -3.057922      7.089383 
1 1 1 -16 2  26 o 82.79506 2.803444 83.75177       5.648142 85.84555       8.142961 81.81042       7.840955 83.70824 4.003489 81.71880 3.949103 1.989441       5.623463 
1 1 1 -16 2  27 o 33.78810 4.299701 14.18871       3.460203 16.82344       5.081738 11.91122       4.724679 36.56691 5.903845 30.55168 6.543186 6.015232       8.812983 
1 1 1 -16 2  28 o 150.0527 3.082891 274.9691       11.27296 276.9542       16.19020 273.1009       15.70559 150.3481 4.423751 149.3166 4.320830 1.031479       6.183781 
1 1 1 -16 2  29 o 114.1485 2.866558 159.2072       7.967521 165.0758       11.64310 154.0388       10.92655 116.0627 4.123161 112.1290 4.005229 3.933769       5.748245 
1 1 1 -16 2  30 o 136.1265 3.456171 226.7182       11.45573 234.5207       14.61760 214.2976       18.44286 138.2866 4.343088 131.8588 5.753467 6.427750       7.208661 
1 1 1 -16 2  31 o 96.76675 3.207304 114.6176       7.552696 119.9330       12.71285 111.7182       9.389325 98.60036 5.310480 95.40369 4.047820 3.196678       6.677278 
1 1 1 -16 2  32 o 21.77313 6.077247 6.029531       3.346804 7.719927       4.819572 4.455239       4.651114 24.75210 7.411886 20.46479 7.340390 4.287313       10.43156 
1 1 1 -16 2  33 o 108.9297 2.921864 145.2601       7.749080 151.6419       11.32019 139.6328       10.63005 111.0248 4.191585 106.5534 4.101508 4.471382       5.864448 
1 1 1 -16 2  34 o 146.5551 3.119205 263.1525       11.13989 272.4012       16.15377 254.7656       15.38287 148.6146 4.465491 143.7457 4.396601 4.868851       6.266634 
1 1 1 -16 2  35 o 88.99384 4.525149 98.12810       9.781401 96.09126       14.22183 99.95647       13.47439 87.18735 6.746136 89.16224 6.240842 -1.974892      9.190128 
1 1 1 -16 2  36 o 22.24490 5.790216 6.429286       3.168783 8.683165       4.580837 4.361127       4.388050 25.73236 7.082537 19.85916 7.128982 5.873198       10.04912 
1 1 1 -16 2  37 o 98.97946 2.949228 120.5839       7.105666 117.6937       10.07452 123.4449       10.02353 97.25451 4.261221 99.66618 4.136009 -2.411674      5.938398 
1 1 1 -16 2  38 o 16.91031 6.013361 3.240549       3.114652 12.88057       4.459596 -5.939684      4.351944 31.29240 6.067217 11.31667 5.434416 19.97573       8.145183 
1 1 1 -16 2  39 o 22.32098 6.125265 6.654110       3.432052 3.626155       4.730188 10.02021       4.987323 18.96571 7.284615 27.02851 7.370389 -8.062803      10.36283 
1 1 1 -16 2  40 o 31.84039 4.972647 13.23501       3.732278 13.92185       5.149461 12.47490       5.417186 31.81056 6.845858 29.79409 7.474654 2.016464       10.13589 
1 1 1 -16 2  41 o 16.91577 6.351625 3.202518       3.546729 1.892499       4.963112 4.569715       5.070268 17.10987 7.143028 19.78728 7.556478 -2.677408      10.39823 
1 1 1 -16 2  42 o 12.31947 5.498234 -0.7167450     3.358527 -2.416922      4.603650 1.217663       4.910540 13.23641 6.110577 16.22815 6.953686 -2.991741      9.257045 
1 1 1 -16 2  43 o 55.12587 3.729631 39.06403       4.980731 33.56637       6.926491 44.95063       7.167317 49.23148 5.890194 57.83912 5.138521 -8.607632      7.816571 
1 1 1 -16 2  44 o 19.25037 7.687762 4.784867       5.443664 5.442985       7.695380 4.125680       7.701630 20.81588 8.804266 19.96172 8.632297 0.8541527      12.33011 
1 1 1 -16 2  45 o 12.99476 5.799037 -0.1412782     3.735080 3.480174       5.312962 -3.680058      5.251967 17.59755 7.371659 12.97720 6.158656 4.620351       9.605748 
1 1 1 -16 2  46 o 27.77524 6.355274 11.96022       4.208188 12.20456       6.025213 11.72751       5.879997 25.70006 8.378798 25.29848 8.279083 0.4015846      11.77911 
1 1 1 -16 2  47 o 11.78832 5.463830 -1.345628      3.735294 -1.937006      5.163257 -0.6962787     5.410414 13.27755 6.241805 14.18782 6.575929 -0.9102783     9.066586 
1 1 1 -16 3  1  o 246.0450 3.289947 738.3392       19.72603 759.0886       28.28300 718.6856       27.52603 249.3575 4.654436 242.6305 4.655454 6.726959       6.583086 
1 1 1 -16 3  2  o 188.7804 3.016768 434.5753       13.87825 427.6669       21.75032 439.3195       18.02424 187.1015 4.774272 189.7576 3.897820 -2.656067      6.163333 
1 1 1 -16 3  3  o 167.7014 3.182359 342.9700       13.00535 381.5563       28.68201 332.9834       14.59159 176.4985 6.680626 165.2206 3.624119 11.27797       7.600329 
1 1 1 -16 3  4  o 222.3893 3.758860 603.3256       20.37070 609.0858       42.11054 601.5659       23.27523 222.8816 7.765051 222.0237 4.301882 0.8579407      8.877060 
1 1 1 -16 3  5  o 198.3491 3.908098 479.9796       18.88999 482.4186       32.32856 478.7152       23.27705 198.4956 6.693000 198.0214 4.823694 0.4742279      8.250107 
1 1 1 -16 3  6  o 254.5970 4.685193 791.2465       29.06812 776.0873       49.39743 799.2765       35.95179 251.5652 8.068255 255.7645 5.768251 -4.199219      9.918139 
1 1 1 -16 3  7  o 153.8665 2.966969 288.6801       11.12482 287.5536       15.92437 289.7539       15.54813 153.4464 4.262753 154.0424 4.145689 -0.5959473     5.946243 
1 1 1 -16 3  8  o 254.3385 4.679798 789.6630       29.00516 818.6180       51.04805 775.8583       35.24770 258.3503 8.118459 251.9870 5.740062 6.363235       9.942720 
1 1 1 -16 3  9  o 160.6410 3.507943 314.7626       13.73235 317.2759       16.95244 309.9659       23.41973 161.1790 4.319956 159.1307 6.050395 2.048370       7.434332 
1 1 1 -16 3  10 o 298.0906 5.350987 1085.444       38.87034 1069.644       47.37374 1117.995       67.99783 295.7219 6.573825 301.6249 9.262041 -5.903046      11.35784 
1 1 1 -16 3  11 o 174.9916 3.650696 373.5663       15.56786 364.1876       19.00734 392.6801       27.13449 172.6662 4.521178 179.0982 6.226665 -6.431931      7.694960 
1 1 1 -16 3  12 o 314.3000 5.567974 1207.142       42.64594 1147.079       71.65825 1240.082       53.06664 305.3476 9.642294 318.3238 6.840950 -12.97620      11.82254 
1 1 1 -16 3  13 o 184.1349 3.257212 413.5454       14.61565 429.3573       21.30880 399.4979       20.08478 187.5213 4.663074 180.8343 4.561386 6.686966       6.523074 
1 1 1 -16 3  14 o 237.1615 3.867711 686.3460       22.35292 687.7822       31.85699 684.9532       31.37219 237.2272 5.510667 236.7483 5.437785 0.4789734      7.741896 
1 1 1 -16 3  15 o 71.53481 3.007547 62.51925       5.231136 69.25739       6.730883 52.24123       8.312981 75.25018 3.681702 65.17331 5.279368 10.07687       6.436355 
1 1 1 -16 3  16 o 100.4137 3.023202 123.0873       7.389263 132.9514       9.510143 108.0603       11.73801 104.3122 3.747333 93.89920 5.149464 10.41296       6.368632 
1 1 1 -16 3  17 o 195.7591 3.973842 467.7732       18.95696 489.3539       24.05532 432.4079       30.79415 200.1261 4.932548 187.7766 6.740556 12.34955       8.352551 
1 1 1 -16 3  18 o 115.7188 2.685283 163.3034       7.572337 167.1656       11.12558 159.9700       10.33579 116.9568 3.909053 114.4261 3.711568 2.530769       5.390402 
1 1 1 -16 3  19 o 128.6639 3.848859 202.2706       12.05415 0.000000       0.000000 202.2706       12.05415 ?        ?        128.6639 3.848859 0.000000       3.848859 
1 1 1 -16 3  20 o 159.4826 3.055788 310.3011       11.87607 314.6479       17.16115 306.3061       16.45188 160.4277 4.393798 158.3002 4.268690 2.127487       6.125943 
1 1 1 -16 3  21 o 237.7107 3.915567 690.0328       22.68191 687.2801       32.32159 692.7039       31.83800 236.9616 5.597301 237.9150 5.491461 -0.9533691     7.841296 
1 1 1 -16 3  22 o 94.68058 2.673786 109.4338       6.162948 115.6722       9.260489 104.4742       8.257020 97.24097 3.915956 92.42931 3.673189 4.811668       5.369081 
1 1 1 -16 3  23 o 129.2678 3.308209 204.1032       10.41268 190.8705       18.63483 210.1104       12.55570 124.6240 6.155078 131.0918 3.934787 -6.467773      7.305308 
1 1 1 -16 3  24 o 96.38445 3.237835 113.5292       7.594179 110.8244       9.278611 119.0175       13.21733 95.15228 4.010538 98.41532 5.533470 -3.263039      6.834011 
1 1 1 -16 3  25 o 137.3921 2.928185 230.3712       9.803840 245.3876       14.50328 217.7360       13.30371 141.6163 4.207253 133.4062 4.097090 8.210068       5.872574 
1 1 1 -16 3  26 o 236.4567 4.582753 684.1582       26.40670 717.4541       33.27312 627.5002       43.40392 241.8768 5.644990 225.3743 7.915226 16.50252       9.721971 
1 1 1 -16 3  27 o 77.59320 2.888752 73.59534       5.452693 76.18182       8.045294 71.39786       7.415675 78.80762 4.204481 76.31051 4.001756 2.497108       5.804456 
1 1 1 -16 3  28 o 38.27840 3.980376 18.11302       3.658749 19.22810       5.416976 17.17758       4.961482 39.14182 5.859026 36.98380 5.686943 2.158024       8.165140 
1 1 1 -16 3  29 o 172.0554 3.288785 361.7424       13.78923 365.2092       19.86352 358.5176       19.15747 172.5487 4.728444 170.9896 4.601795 1.559036       6.598083 
1 1 1 -16 3  30 o 81.02570 3.336385 80.39297       6.573627 81.79242       8.477750 78.28292       10.40998 81.59936 4.278363 79.63216 5.396327 1.967194       6.886562 
1 1 1 -16 3  31 o 146.1040 3.486037 261.1891       12.41167 259.0982       20.95328 262.3193       15.40520 144.8211 5.949903 146.1911 4.329014 -1.370041      7.358104 
1 1 1 -16 3  32 o 36.44302 4.360256 16.53242       3.795480 16.44415       5.385970 16.61950       5.349456 35.93202 6.384943 36.14577 6.302191 -0.2137527     8.971350 
1 1 1 -16 3  33 f 158.8560 3.212861 308.9982       12.43746 331.3411       18.33200 289.9421       16.93000 164.0170 4.591054 153.4415 4.532672 10.57545       6.451581 
1 1 1 -16 3  34 o 19.33017 6.184163 4.567161       3.292050 -1.115784      4.527832 10.94046       4.794969 14.73970 6.490731 29.00593 6.886988 -14.26623      9.463624 
1 1 1 -16 3  35 f 35.78134 7.412930 16.75558       6.251012 15.16280       9.457532 17.99120       8.329966 33.79073 10.43718 36.62106 9.314050 -2.830326      13.98879 
1 1 1 -16 3  36 o 25.72174 5.415134 8.560740       3.286752 14.21474       4.726029 3.264569       4.574035 33.15158 6.073762 18.76933 7.174858 14.38224       9.400488 
1 1 1 -16 3  37 o 23.83470 5.702616 7.440609       3.267790 7.511707       4.655629 7.371566       4.587823 23.99002 7.306790 23.78235 7.255342 0.2076778      10.29705 
1 1 1 -16 3  38 f 57.37747 3.334297 40.84500       4.642017 36.57233       6.504332 45.28035       6.626993 53.66719 5.032147 59.96361 4.569575 -6.296417      6.797317 
1 1 1 -16 3  39 o 72.34776 3.139240 64.93862       5.521420 63.25895       7.803009 66.62301       7.813937 70.71165 4.552488 72.64162 4.435302 -1.929977      6.355867 
1 1 1 -16 3  40 o 44.22454 3.872068 24.74365       4.130889 26.30434       5.983488 23.32235       5.710021 44.73936 5.611279 42.03479 5.722807 2.704567       8.014798 
1 1 1 -16 3  41 o 29.57158 5.501948 11.77560       3.818973 16.55613       5.387070 6.945870       5.414722 34.51919 6.645192 22.53318 7.936542 11.98601       10.35120 
1 1 1 -16 3  42 o 38.42760 4.603514 19.41978       4.225216 25.45797       6.048857 13.66639       5.904475 43.10311 5.914559 30.03475 7.945666 13.06836       9.905333 
1 1 1 -16 3  43 o 15.04632 6.210484 1.769167       3.692115 0.6805928      5.175011 2.897702       5.269138 15.90121 6.972695 17.75059 7.381199 -1.849377      10.15385 
1 1 1 -16 3  44 o 18.67098 7.636861 4.124928       5.517670 -4.398075      8.141169 11.36611       7.504040 16.11410 7.653245 25.48090 9.298176 -9.366798      12.04277 
1 1 1 -16 3  45 o 22.54959 6.682178 7.913003       3.933338 7.288997       5.678104 8.488688       5.453831 21.19881 8.019772 22.51633 7.962094 -1.317520      11.30096 
1 1 1 -16 3  46 o 17.38899 6.691106 4.376710       3.995835 2.473953       5.771148 6.128826       5.537988 16.68825 7.339099 19.51334 7.766871 -2.825089      10.68582 
1 1 1 -16 3  47 o 21.28785 6.907585 7.663906       4.097672 6.914469       5.997395 8.320065       5.611773 19.77585 8.009008 21.18107 7.981714 -1.405224      11.30717 
1 1 1 -16 4  1  o 250.8422 3.662091 767.6115       22.38545 774.5375       35.48191 763.0320       28.85221 251.7402 5.783868 249.9895 4.736104 1.750671       7.475548 
1 1 1 -16 4  2  o 197.0438 3.102602 473.4844       14.89789 451.0568       22.93705 489.8499       19.59343 192.1346 4.902877 200.3621 4.012904 -8.227570      6.335740 
1 1 1 -16 4  3  f 237.5155 3.889562 688.2819       22.51276 721.4999       45.17197 677.3046       25.96749 242.5996 7.650434 235.5587 4.523709 7.040924       8.887806 
1 1 1 -16 4  4  o 127.9003 3.866877 199.7592       12.03840 0.000000       0.000000 199.7592       12.03840 ?        ?        127.9003 3.866877 0.000000       3.866877 
1 1 1 -16 4  5  o 290.0497 5.287386 1027.532       37.37228 1167.298       71.80510 975.6048       43.76755 308.1605 9.573470 282.4745 6.358240 25.68594       11.49254 
1 1 1 -16 4  6  o 192.3250 3.369433 451.1301       15.79170 440.9640       22.33493 461.2924       22.33073 189.9872 4.828099 194.3884 4.714076 -4.401230      6.747818 
1 1 1 -16 4  7  o 133.6290 2.792727 217.7210       9.094216 225.8393       13.32215 210.6366       12.44495 135.9889 4.024507 131.3378 3.892663 4.651123       5.599061 
1 1 1 -16 4  8  o 170.0453 3.635031 352.7258       15.06291 338.9012       18.22963 382.4778       26.74290 166.5685 4.495170 176.7671 6.217959 -10.19864      7.672651 
1 1 1 -16 4  9  o 345.0176 5.240555 1453.949       44.06103 1470.890       63.02527 1437.754       61.62185 346.5878 7.462174 342.6804 7.379201 3.907410       10.49460 
1 1 1 -16 4  10 o 99.83380 2.572232 121.5933       6.252619 116.4314       9.116041 126.1792       8.592262 97.61291 3.839821 101.6484 3.473838 -4.035477      5.178009 
1 1 1 -16 4  11 o 261.7976 4.831617 836.9128       30.82438 834.3653       37.89497 841.8943       52.99178 261.2523 5.952307 261.8903 8.313877 -0.6379700     10.22499 
1 1 1 -16 4  12 o 170.4328 3.120341 354.2551       12.95959 351.8682       18.59359 356.5101       18.07277 169.7132 4.499815 170.8450 4.344491 -1.131729      6.254833 
1 1 1 -16 4  13 o 169.1877 3.106003 349.1042       12.80580 349.1617       18.41126 349.0504       17.82333 169.0569 4.472972 169.0440 4.330226 0.1287842E-01  6.225620 
1 1 1 -16 4  14 o 37.20088 3.241296 17.00781       2.909071 17.78291       4.605945 16.49342       3.752177 37.81009 5.131206 36.50685 4.300061 1.303238       6.694759 
1 1 1 -16 4  15 o 260.6381 4.164104 829.2343       26.44816 869.5623       38.78146 794.1693       36.16242 266.6436 5.968387 254.8452 5.822975 11.79831       8.338386 
1 1 1 -16 4  16 o 138.2113 3.314479 233.0343       11.16335 231.4235       13.94172 235.9124       18.63527 137.6221 4.161898 138.8043 5.520311 -1.182236      6.913409 
1 1 1 -16 4  17 o 363.4416 5.501953 1615.146       48.72900 1595.945       68.82873 1634.441       68.99802 360.6219 7.832160 364.9698 7.757889 -4.347961      11.02395 
1 1 1 -16 4  18 o 98.13356 2.989400 117.5772       7.140538 122.1377       13.54060 115.8204       8.404069 99.77244 5.591550 97.35636 3.548267 2.416077       6.622358 
1 1 1 -16 4  19 o 246.0236 4.600570 739.5367       27.58192 784.3116       49.91076 719.8508       33.09445 252.4984 8.122035 242.5661 5.598723 9.932281       9.864743 
1 1 1 -16 4  20 o 105.6530 2.664270 136.2297       6.854089 145.2442       10.30847 129.0866       9.176305 108.9980 3.887187 102.7680 3.670047 6.229988       5.345977 
1 1 1 -16 4  21 o 100.1093 2.679469 122.3275       6.530834 126.5893       9.718044 118.8176       8.819226 101.7377 3.927148 98.58375 3.677486 3.153938       5.380185 
1 1 1 -16 4  22 o 84.38307 3.085996 87.00459       6.335118 81.10406       12.12457 89.22044       7.430023 81.11315 6.180467 85.41139 3.577676 -4.298241      7.141284 
1 1 1 -16 4  23 o 57.88264 2.976854 40.99075       4.184858 45.14804       6.406323 37.89627       5.527103 60.61999 4.365920 55.54018 4.112887 5.079811       5.998091 
1 1 1 -16 4  24 o 169.1419 3.729747 349.4507       15.37329 355.5520       19.15887 338.4202       25.76073 170.4380 4.617083 165.9352 6.382548 4.502792       7.877460 
1 1 1 -16 4  25 o 14.38791 5.656886 1.445898       2.904690 4.979510       4.496870 -1.083998      3.804979 21.07223 7.244025 13.51440 5.950672 7.557832       9.374775 
1 1 1 -16 4  26 o 171.7719 3.253599 360.2948       13.61922 370.1624       19.87965 351.5675       18.69578 173.8404 4.696994 169.4454 4.531769 4.394958       6.526767 
1 1 1 -16 4  27 o 156.1276 3.139996 297.6637       11.94661 289.5828       17.01567 305.5195       16.77698 153.7414 4.546736 157.9527 4.362814 -4.211304      6.301345 
1 1 1 -16 4  28 o 98.94262 3.366233 119.7546       8.104587 110.6544       9.744311 140.1780       14.59791 94.99500 4.219875 106.6944 5.634500 -11.69940      7.039526 
1 1 1 -16 4  29 o 27.85432 5.353067 9.842491       3.501564 9.353433       5.125921 10.27037       4.794585 27.09241 7.505772 28.29352 6.994163 -1.201115      10.25938 
1 1 1 -16 4  30 o 115.8302 3.380399 164.1844       9.531494 155.5910       11.79547 180.3535       16.17990 112.6026 4.306575 120.9821 5.502460 -8.379509      6.987393 
1 1 1 -16 4  31 o 135.0771 3.399898 223.3643       11.18249 257.2362       20.10994 208.2025       13.45445 144.3538 5.728086 130.2369 4.244986 14.11688       7.129577 
1 1 1 -16 4  32 o 200.4558 3.618110 492.2428       17.67406 519.2415       25.97669 468.9722       24.11663 205.2313 5.198209 195.0899 5.077091 10.14136       7.266239 
1 1 1 -16 4  33 o 48.71840 3.631670 29.26552       4.280553 27.77281       6.145292 30.67237       5.965925 47.09866 5.454984 49.62652 5.001339 -2.527866      7.400692 
1 1 1 -16 4  34 o 18.06437 6.843776 3.005872       4.138445 0.6434574      8.438988 3.753896       4.748648 21.48978 9.159518 19.64875 7.355356 1.841034       11.74726 
1 1 1 -16 4  35 o 69.43597 3.661773 59.48392       6.174106 58.86737       7.516676 60.76256       10.82474 68.85578 4.504436 69.28029 6.487121 -0.4245071     7.897638 
1 1 1 -16 4  36 o 63.36432 3.137112 49.47203       4.829014 42.22146       6.706272 57.27998       6.959266 58.08707 4.779935 67.89492 4.227171 -9.807850      6.380969 
1 1 1 -16 4  37 o 77.41728 2.994186 73.86540       5.638105 66.61907       7.915859 81.32665       8.032387 73.00377 4.471000 80.84793 4.090279 -7.844162      6.059721 
1 1 1 -16 4  38 o 58.62494 3.292505 42.63274       4.684855 44.26744       6.630087 41.00266       6.620695 59.23755 4.629638 56.91789 4.818532 2.319656       6.682200 
1 1 1 -16 4  39 o 16.69220 6.116309 3.067500       3.252023 3.735681       4.454153 2.304700       4.759085 18.77381 7.102870 17.61286 7.133917 1.160952       10.06695 
1 1 1 -16 4  40 o 51.84660 4.694067 34.52682       5.866503 41.32809       8.075302 26.92577       8.536905 55.86957 6.026497 43.40397 8.374553 12.46560       10.31755 
1 1 1 -16 4  41 o 14.00490 5.903179 0.8335957      3.440225 1.375138       4.784877 0.2540942      4.949736 16.40050 6.939872 15.71266 6.856201 0.6878376      9.755476 
1 1 1 -16 4  42 o 39.78296 4.432405 20.71603       4.224178 18.36635       5.939537 23.12086       6.008847 35.61910 7.092156 40.75524 6.249259 -5.136135      9.452614 
1 1 1 -16 4  43 o 42.47308 4.246849 23.65249       4.336703 20.41866       6.148124 26.85474       6.118035 37.28796 7.023698 43.96096 5.856514 -6.673008      9.145004 
1 1 1 -16 4  44 o 17.79941 7.480887 3.152524       5.499545 -5.994648      7.683729 12.76041       7.874855 15.05657 7.227921 26.53725 9.547235 -11.48068      11.97466 
1 1 1 -16 4  45 o 23.69123 6.577186 8.698725       3.931547 10.12510       5.627527 7.338771       5.494939 24.25175 8.105839 21.21146 7.917922 3.040281       11.33129 
1 1 1 -16 4  46 o 22.09640 6.671842 7.886370       3.893299 7.738450       5.752387 8.011406       5.288705 20.99895 8.041421 21.41383 7.807182 -0.4148865     11.20788 
1 1 1 -16 4  47 o 22.48622 6.969211 8.620359       4.212592 12.45813       6.236706 5.400359       5.712729 25.01695 8.533043 18.44436 7.678955 6.572590       11.47951 
1 1 1 -16 5  1  o 188.7522 3.348198 434.5603       15.40066 426.4474       29.20661 437.6848       18.12527 186.6070 6.432310 189.3919 3.927236 -2.784866      7.536431 
1 1 1 -16 5  2  o 208.1120 4.056639 528.5181       20.57310 501.6916       33.92032 544.1291       25.87570 202.3570 6.888731 211.0771 5.030543 -8.720062      8.530005 
1 1 1 -16 5  3  o 229.8345 3.824692 644.4836       21.42140 643.0851       30.51570 645.8422       30.07792 229.4277 5.458097 229.9291 5.368063 -0.5014038     7.655517 
1 1 1 -16 5  4  o 425.9364 6.339955 2218.471       65.80624 2265.795       94.61114 2174.121       91.59051 429.6626 9.036049 420.9166 8.929317 8.746002       12.70366 
1 1 1 -16 5  5  o 219.0690 3.723736 585.4669       19.87906 564.6306       40.35207 592.1442       22.84337 214.5622 7.730130 220.2732 4.255616 -5.710968      8.824124 
1 1 1 -16 5  6  o 202.0217 3.127112 497.7128       15.39492 491.1616       24.35110 502.0745       19.86954 200.5539 4.982546 202.8476 4.019592 -2.293655      6.401788 
1 1 1 -16 5  7  o 166.4214 3.607415 337.8536       14.62990 337.1363       18.12436 339.1950       24.78451 166.1322 4.480941 166.4589 6.120365 -0.3266144     7.585361 
1 1 1 -16 5  8  o 98.00859 2.579947 117.1912       6.156492 118.0764       9.128659 116.4527       8.338132 98.30318 3.817946 97.64533 3.509847 0.6578522      5.186110 
1 1 1 -16 5  9  o 122.3475 2.723130 182.5115       8.118941 173.3165       11.68564 191.0921       11.28849 119.1097 4.031768 125.0996 3.707006 -5.989899      5.476956 
1 1 1 -16 5  10 o 177.1409 3.201160 382.6998       13.81854 387.5112       20.02483 378.3257       19.09318 178.0996 4.617814 175.9909 4.455551 2.108719       6.416863 
1 1 1 -16 5  11 o 231.6228 4.422824 654.9043       24.96417 671.6464       31.25017 625.3771       41.50100 234.4492 5.469750 225.8147 7.552341 8.634506       9.325022 
1 1 1 -16 5  12 o 371.4594 5.597044 1686.377       50.66478 1694.417       72.11537 1678.541       71.19512 371.7648 7.960192 370.0375 7.895296 1.727295       11.21162 
1 1 1 -16 5  13 o 218.8666 3.661879 584.4536       19.53078 596.6136       28.32338 573.4296       26.96785 220.9737 5.259790 216.6548 5.107893 4.318878       7.331847 
1 1 1 -16 5  14 o 250.7905 4.047873 767.6588       24.73854 763.7189       35.28610 771.4672       34.69260 249.9230 5.793770 251.2065 5.667217 -1.283493      8.104635 
1 1 1 -16 5  15 o 130.2378 3.245731 206.9065       10.30115 215.3242       13.15495 193.5623       16.56286 132.7555 4.071124 125.7250 5.418743 7.030464       6.777671 
1 1 1 -16 5  16 o 145.8824 3.331514 259.6324       11.84351 264.0078       21.40214 257.7011       14.21912 146.7789 5.996153 145.2417 4.021270 1.537186       7.219728 
1 1 1 -16 5  17 o 186.6283 3.324677 424.9499       15.12039 421.6846       21.83700 427.9573       20.95706 185.7109 4.829344 187.1745 4.594598 -1.463608      6.665800 
1 1 1 -16 5  18 o 289.0320 4.540877 1020.539       31.98319 999.3251       45.09295 1042.015       45.37044 285.6275 6.478473 291.6871 6.382925 -6.059601      9.094632 
1 1 1 -16 5  19 o 75.67931 2.981697 69.97540       5.488151 67.28777       10.26283 71.05179       6.494822 73.93129 5.741404 76.22068 3.506091 -2.289391      6.727287 
1 1 1 -16 5  20 o 104.2888 2.691214 132.7445       6.833749 137.0833       10.35073 129.3919       9.098646 105.8719 4.019236 102.8902 3.634538 2.981720       5.418867 
1 1 1 -16 5  21 o 81.46750 2.676989 81.04168       5.307339 83.60262       8.103367 79.11787       7.023375 82.63495 4.036282 80.42372 3.592720 2.211227       5.403629 
1 1 1 -16 5  22 o 102.6410 3.118966 128.6829       7.792262 140.3274       15.45197 124.7117       9.023681 106.8515 5.957861 100.9947 3.672593 5.856750       6.998861 
1 1 1 -16 5  23 o 101.9671 2.725503 126.9360       6.766331 128.8779       10.10899 125.3598       9.107287 102.6231 4.050235 101.2473 3.697426 1.375793       5.484101 
1 1 1 -16 5  24 o 102.9239 3.262132 129.4525       8.171559 126.6826       10.20598 134.3994       13.63942 101.7260 4.125612 104.6168 5.368006 -2.890747      6.770241 
1 1 1 -16 5  25 o 169.7747 3.221392 351.9018       13.32762 354.2045       19.36661 349.8303       18.36912 170.0773 4.677174 169.0607 4.462615 1.016678       6.464587 
1 1 1 -16 5  26 o 13.14542 5.548882 0.1750377      3.046733 -1.141749      4.660619 1.157704       4.026141 15.07952 6.614599 16.00536 6.532281 -0.9258413     9.296431 
1 1 1 -16 5  27 o 199.2996 3.551974 485.3729       17.25092 488.9507       24.90019 482.0706       23.92216 199.6573 5.122006 198.3509 4.949144 1.306412       7.122427 
1 1 1 -16 5  28 o 200.1034 3.575735 489.4713       17.43637 466.0728       24.40127 513.8841       24.92454 194.8579 5.143258 204.7167 4.996177 -9.858841      7.170417 
1 1 1 -16 5  29 o 195.2035 5.107020 467.9453       24.27270 467.9453       24.27270 0.000000       0.000000 195.2035 5.107020 ?        ?        0.000000       5.107020 
1 1 1 -16 5  30 o 135.7135 3.080042 225.0894       10.18629 235.5260       14.94163 216.0267       13.92338 138.5329 4.431678 132.6941 4.311553 5.838715       6.182982 
1 1 1 -16 5  31 o 32.15179 4.854565 12.98074       3.685186 15.90396       5.533297 10.65053       4.940259 35.28722 6.679262 28.74434 7.096089 6.542873       9.745102 
1 1 1 -16 5  32 o 158.0547 3.224318 305.7314       12.41885 318.1720       18.19611 294.8834       16.99151 160.7912 4.648752 154.8359 4.508030 5.955246       6.475588 
1 1 1 -16 5  33 o 187.2714 3.494756 429.9790       15.94867 418.8741       22.61119 440.9739       22.49888 184.1548 5.043283 189.0308 4.888288 -4.876038      7.023536 
1 1 1 -16 5  34 o 138.2220 3.621983 234.8510       12.18948 225.1259       22.58774 238.8468       14.47872 133.7600 6.953511 139.1543 4.274770 -5.394302      8.162412 
1 1 1 -16 5  35 o 78.96420 3.546266 76.85170       6.806566 79.10960       8.402545 72.54218       11.60843 79.89571 4.331903 75.76623 6.345497 4.129478       7.683145 
1 1 1 -16 5  36 o 30.96475 4.909160 12.21671       3.580907 13.43967       5.109098 11.03586       5.020401 31.98405 6.766548 28.86262 7.169949 3.121429       9.858719 
1 1 1 -16 5  37 o 22.01515 6.038458 6.352632       3.336374 7.659344       4.843760 5.173005       4.602192 24.19719 7.468605 20.88914 7.320092 3.308052       10.45772 
1 1 1 -16 5  38 o 27.34090 5.505184 9.805305       3.540898 10.93347       5.034534 8.700976       4.981065 28.37795 7.253522 25.41037 7.517055 2.967583       10.44604 
1 1 1 -16 5  39 o 64.66740 3.226583 52.01782       5.068628 51.68509       7.211553 52.34265       7.125466 63.75221 4.674411 64.20938 4.584002 -0.4571686     6.546999 
1 1 1 -16 5  40 o 18.17401 6.839279 3.675779       4.117206 0.3696093      5.439144 8.112144       6.300596 16.63575 7.223925 24.36605 8.562906 -7.730299      11.20306 
1 1 1 -16 5  41 o 27.38882 5.922148 10.32244       3.837363 18.89461       5.559469 2.522075       5.303292 36.99805 6.397614 17.93771 7.427282 19.06034       9.802754 
1 1 1 -16 5  42 o 17.21822 6.459429 3.563740       3.666404 7.427756       5.177450 -0.3231338     5.192741 22.56023 7.772222 15.36638 6.848795 7.193851       10.35922 
1 1 1 -16 5  43 o 42.79295 4.386153 24.15264       4.509303 24.05643       6.323725 24.25217       6.431885 40.90179 6.566628 40.97374 6.670921 -0.7194901E-01 9.360651 
1 1 1 -16 5  44 o 16.65494 7.189804 1.951155       5.324421 8.617783       7.765778 -3.962740      7.314230 22.92397 9.172987 15.40084 7.296867 7.523137       11.72126 
1 1 1 -16 5  45 o 16.63268 6.564385 3.515150       3.924598 6.642143       5.802376 0.8782416      5.328316 20.45809 8.009612 15.55670 6.935362 4.901394       10.59496 
1 1 1 -16 5  46 o 31.79072 5.761911 15.05020       4.299462 18.25986       6.689695 12.79138       5.612006 31.58211 8.504161 26.72395 7.997033 4.858158       11.67361 
1 1 1 -16 5  47 o 10.86974 5.169343 -2.828497      3.738838 -0.4184179     5.580120 -4.791934      5.036588 14.42673 6.683742 11.78185 5.704312 2.644888       8.787012 
1 1 1 -16 6  1  o 458.3377 6.792605 2571.156       75.86790 2556.437       107.0808 2585.992       107.5072 455.9901 9.636518 458.6258 9.619292 -2.635681      13.61592 
1 1 1 -16 6  2  o 68.16546 2.464273 56.72211       4.086711 60.71518       6.461587 54.05997       5.275960 70.44163 3.778031 66.49557 3.265903 3.946053       4.993961 
1 1 1 -16 6  3  o 174.3132 2.898554 370.5177       12.31254 361.6827       19.37716 376.5004       15.94537 172.0559 4.625711 175.6699 3.724785 -3.613953      5.938959 
1 1 1 -16 6  4  o 167.5371 2.828977 342.2553       11.54986 337.0576       18.28465 345.7061       14.89847 166.1032 4.521437 168.3391 3.631788 -2.235901      5.799420 
1 1 1 -16 6  5  o 285.6857 4.532583 996.3318       31.55516 940.2776       62.29555 1015.678       36.59771 276.5553 9.256598 288.3589 5.208162 -11.80362      10.62119 
1 1 1 -16 6  6  o 77.18311 2.692159 72.72215       5.055842 60.54553       11.91975 75.39342       5.582933 69.97751 7.087554 78.57682 2.920710 -8.599312      7.665766 
1 1 1 -16 6  7  f 134.3631 3.159378 220.1739       10.34470 234.5393       18.36042 213.4928       12.52130 138.4448 5.452806 132.2205 3.890335 6.224350       6.698343 
1 1 1 -16 6  8  o 205.4007 3.531484 514.6519       17.67645 492.7903       24.83298 537.1055       25.16692 200.8027 5.078927 209.7187 4.924439 -8.916000      7.074292 
1 1 1 -16 6  9  o 389.5115 5.845639 1854.582       55.48662 1864.445       79.15155 1845.052       77.80563 389.8998 8.330484 387.8967 8.231118 2.003143       11.71103 
1 1 1 -16 6  10 o 204.7300 3.512535 511.3082       17.52420 516.8074       25.36953 506.2897       24.23529 205.6972 5.061136 203.6104 4.884409 2.086731       7.033672 
1 1 1 -16 6  11 o 146.3230 3.401620 261.1695       12.12926 260.0426       15.15804 263.1754       20.22384 145.8975 4.268015 146.6279 5.670620 -0.7303467     7.097315 
1 1 1 -16 6  12 o 118.6814 3.169944 171.9165       9.159703 179.3697       11.74776 160.3600       14.62848 121.1694 3.983976 114.4432 5.259395 6.726196       6.597977 
1 1 1 -16 6  13 o 200.1551 3.454844 488.7371       16.85122 517.1735       25.04751 465.2236       22.77648 205.7574 4.995434 195.1702 4.788915 10.58720       6.920120 
1 1 1 -16 6  14 o 42.63591 3.685395 22.34616       3.791533 22.98143       5.229647 21.64224       5.505021 43.07450 5.079722 41.71338 5.553460 1.361130       7.526254 
1 1 1 -16 6  15 o 68.29820 3.646851 57.08183       6.047641 63.13132       9.706587 53.24353       7.731717 71.63943 5.604626 65.84090 4.852962 5.798538       7.413708 
1 1 1 -16 6  16 o 261.8601 4.199384 837.2258       26.79729 839.5106       38.49922 835.0785       37.32236 261.9298 6.031579 261.2682 5.862009 0.6615601      8.410891 
1 1 1 -16 6  17 o 149.0434 2.952197 270.9565       10.72246 273.3393       15.79393 268.9194       14.60360 149.5416 4.338620 148.3575 4.043147 1.184113       5.930486 
1 1 1 -16 6  18 o 159.9996 3.062517 312.3007       11.94080 319.7944       17.61463 305.9291       16.24241 161.7350 4.473533 158.2172 4.216460 3.517883       6.147441 
1 1 1 -16 6  19 o 243.6182 4.575935 725.2150       27.16600 835.0816       51.87469 683.6989       31.88828 260.4810 8.182432 236.3860 5.535708 24.09497       9.879082 
1 1 1 -16 6  20 o 134.0553 2.878746 219.2284       9.404237 217.1049       13.86789 221.0363       12.79590 133.2399 4.276642 134.4824 3.908681 -1.242538      5.793743 
1 1 1 -16 6  21 o 92.40201 3.107079 104.3041       6.986371 112.0551       14.07182 101.7686       8.048366 95.43734 6.082214 91.22717 3.627556 4.210175       7.081843 
1 1 1 -16 6  22 o 137.8520 2.935317 231.8685       9.860617 245.7654       14.87467 220.9737       13.17038 141.7430 4.311366 134.4317 4.024852 7.311249       5.898077 
1 1 1 -16 6  23 o 135.3259 2.924054 223.4674       9.642784 236.1224       14.48579 213.3977       12.92175 138.9212 4.284072 132.0939 4.018906 6.827240       5.874086 
1 1 1 -16 6  24 o 21.55464 6.496611 5.749067       3.693850 9.549399       4.895908 0.7271048      5.628067 27.37596 7.232020 18.15380 7.594672 9.222168       10.48719 
1 1 1 -16 6  25 o 112.1602 2.825685 153.6194       7.717072 147.8790       11.26636 158.6932       10.59200 109.8929 4.214867 113.8950 3.821666 -4.002151      5.689485 
1 1 1 -16 6  26 o 256.5837 4.197836 805.2050       26.24767 805.3727       37.54152 805.0445       36.71199 256.1019 6.015379 256.0929 5.882668 0.9033203E-02  8.413713 
1 1 1 -16 6  27 o 57.60969 3.191748 40.65921       4.463336 42.66795       6.839297 39.16908       5.890626 58.82256 4.813295 56.41147 4.317889 2.411091       6.466218 
1 1 1 -16 6  28 o 136.9972 3.016282 229.2212       10.06977 235.6541       14.87804 223.7833       13.67902 138.6516 4.408968 135.1560 4.158153 3.495621       6.060465 
1 1 1 -16 6  29 o 183.8868 3.972240 413.8631       17.80009 431.5031       22.64309 385.3279       28.79904 187.4658 4.960886 176.5825 6.704771 10.88335       8.340525 
1 1 1 -16 6  30 o 150.1644 4.350484 276.6866       15.90313 278.3904       22.44699 274.9694       22.53409 150.1048 6.149615 149.1568 6.213168 0.9480743      8.741923 
1 1 1 -16 6  31 o 171.1616 3.327258 358.4510       13.87806 369.3799       20.36529 348.9756       18.96277 173.2880 4.827355 168.4966 4.622587 4.791397       6.683687 
1 1 1 -16 6  32 o 147.8331 3.161812 267.4683       11.39052 269.1234       16.52620 265.9705       15.72120 147.8587 4.592159 147.0531 4.391999 0.8055420      6.354336 
1 1 1 -16 6  33 o 114.9716 2.964513 161.9197       8.298845 169.9285       12.26751 155.1619       11.26868 117.4433 4.293622 112.2653 4.126018 5.177994       5.954764 
1 1 1 -16 6  34 o 53.32793 4.095110 35.22964       5.281052 37.51043       11.22832 34.58179       5.984270 53.50002 8.926755 52.69304 4.709996 0.8069801      10.09312 
1 1 1 -16 6  35 o 48.49155 4.285515 29.28311       5.012062 28.82468       6.073614 30.26171       8.873846 47.83717 5.298842 48.15216 7.831256 -0.3149910     9.455491 
1 1 1 -16 6  36 f 34.20575 4.573466 14.78774       3.716803 12.25509       5.373279 17.11135       5.146742 30.34991 7.345166 36.40768 6.010561 -6.057774      9.490958 
1 1 1 -16 6  37 f 19.16434 6.161049 4.609748       3.264606 7.352560       4.854655 2.345466       4.410885 23.76752 7.498773 17.43434 6.934134 6.333179       10.21341 
1 1 1 -16 6  38 o 40.08757 4.084836 20.25763       3.934745 24.25988       5.678359 16.56085       5.457357 43.35775 5.497697 35.26842 6.592118 8.089333       8.583746 
1 1 1 -16 6  39 o 34.58736 4.595057 15.37578       3.777245 14.61050       5.227074 16.21216       5.464495 32.76944 6.769774 34.58358 6.726247 -1.814140      9.543178 
1 1 1 -16 6  40 o 16.80267 6.790155 2.289871       4.300330 4.099998       5.890591 0.2243455      6.292449 20.12905 8.010847 17.54326 7.690850 2.585791       11.10508 
1 1 1 -16 6  41 o 12.52002 5.558799 -0.6142442     3.387556 -0.4523074     4.808645 -0.7737896     4.773009 14.93250 6.626804 14.65333 6.546203 0.2791681      9.314897 
1 1 1 -16 6  42 o 19.12919 6.570839 5.000301       3.699699 4.452293       5.208157 5.558531       5.256507 19.28747 7.577332 20.43862 7.719858 -1.151155      10.81722 
1 1 1 -16 6  43 o 20.28600 6.633820 5.959565       3.775519 3.486582       5.163054 8.801815       5.535124 18.06239 7.387592 23.70930 8.039521 -5.646904      10.91835 
1 1 1 -16 6  44 o 39.71179 6.872486 23.70071       6.410058 20.05924       9.179653 27.16606       8.954906 31.92388 10.33724 39.21462 9.477075 -7.290745      14.02403 
1 1 1 -16 6  45 o 28.62122 6.287725 12.41665       4.265396 8.903688       6.357893 15.29184       5.751890 22.45796 8.488487 30.25365 7.763702 -7.795689      11.50346 
1 1 1 -16 6  46 o 16.82895 6.554454 4.013883       3.869110 8.429096       5.794135 0.4607261      5.197804 21.54559 8.112257 14.80407 6.703156 6.741520       10.52336 
1 1 1 -16 6  47 o 20.17143 6.753049 6.842649       3.905691 4.682148       5.657085 8.810456       5.398916 17.76728 7.533301 21.65040 7.888918 -3.883116      10.90805 
1 1 1 -16 7  1  o 317.0308 4.415602 1227.053       34.11359 1258.385       54.75382 1207.175       43.61274 320.5744 7.008894 314.2475 5.695153 6.326874       9.031022 
1 1 1 -16 7  2  o 337.8282 4.647527 1393.563       38.26079 1427.350       61.48641 1372.213       48.87638 341.3419 7.391854 334.9945 5.987221 6.347443       9.512430 
1 1 1 -16 7  3  o 167.1642 2.844786 340.7494       11.58855 333.2481       18.35562 345.7207       14.94312 165.1488 4.565352 168.3368 3.642724 -3.187958      5.840538 
1 1 1 -16 7  4  o 205.7736 3.588270 516.5634       17.99331 485.3206       24.77397 551.4443       26.17669 199.2625 5.106130 212.4781 5.055504 -13.21555      7.185450 
1 1 1 -16 7  5  o 151.5797 2.706223 280.1510       9.996330 275.5838       15.97368 283.0910       12.81608 150.1915 4.369033 152.3395 3.452285 -2.148056      5.568368 
1 1 1 -16 7  6  o 115.8952 3.194757 163.9415       9.014152 165.0306       17.95888 163.5747       10.42211 115.9819 6.378643 115.7312 3.700220 0.2506866      7.374193 
1 1 1 -16 7  7  o 316.4759 4.386743 1222.610       33.83132 1210.190       53.44989 1230.912       43.69902 314.4220 6.975861 317.3560 5.650525 -2.934021      8.977253 
1 1 1 -16 7  8  o 280.0621 4.429081 957.4929       30.22763 967.6149       43.50632 948.0468       42.02861 281.2588 6.347608 278.4261 6.194398 2.832764       8.869200 
1 1 1 -16 7  9  o 221.6710 3.720590 599.5276       20.09818 619.8875       29.48738 581.8630       27.46636 225.2390 5.372254 218.2447 5.164416 6.994278       7.452001 
1 1 1 -16 7  10 o 240.9549 3.944635 708.5098       23.16214 740.2870       34.13037 681.3805       31.53571 246.0947 5.691184 236.1280 5.480484 9.966705       7.900967 
1 1 1 -16 7  11 o 102.5983 2.632392 128.4325       6.576090 133.5446       10.12517 124.7029       8.648437 104.5320 3.982095 101.0421 3.517728 3.489975       5.313332 
1 1 1 -16 7  12 o 189.8097 3.916467 439.6765       18.11545 455.0239       22.91243 414.0856       29.58670 192.9486 4.876875 183.8154 6.615877 9.133179       8.219108 
1 1 1 -16 7  13 o 100.9955 3.125697 124.5307       7.683546 113.3820       9.696295 143.3460       12.59649 96.28820 4.142033 108.2277 4.787969 -11.93952      6.330963 
1 1 1 -16 7  14 o 130.7703 3.919592 208.9050       12.47658 210.9020       18.44165 207.2194       16.94261 131.1959 5.782445 130.0952 5.355654 1.100723       7.881606 
1 1 1 -16 7  15 o 68.83841 2.667080 57.87289       4.465608 55.70721       7.134431 59.26789       5.725986 67.40167 4.367137 69.61581 3.385403 -2.214142      5.525653 
1 1 1 -16 7  16 o 135.6077 2.849967 224.2870       9.418032 227.2995       14.05851 221.8343       12.68530 136.3686 4.235610 134.7530 3.867014 1.615585       5.735345 
1 1 1 -16 7  17 o 263.5824 4.228511 848.4517       27.16063 886.9630       40.03521 815.6124       36.96956 269.1667 6.103579 258.1579 5.876554 11.00882       8.472754 
1 1 1 -16 7  18 o 45.17794 3.100759 25.01771       3.393040 27.90005       5.700792 23.43652       4.222369 47.51337 4.998384 43.62724 4.016626 3.886124       6.412264 
1 1 1 -16 7  19 o 96.78598 2.994005 114.3923       7.053075 132.8604       13.80032 107.8628       8.205707 104.0613 5.461182 93.93352 3.591369 10.12778       6.536241 
1 1 1 -16 7  20 o 178.9635 3.782007 391.0763       16.49389 395.2142       30.29288 389.3327       19.66430 179.3239 6.945258 178.4252 4.526233 0.8986664      8.289957 
1 1 1 -16 7  21 o 85.92586 3.094370 90.21342       6.468781 96.28367       13.22925 88.30597       7.415798 88.41588 6.178897 84.96996 3.589515 3.445923       7.145865 
1 1 1 -16 7  22 o 156.1321 3.502424 297.6356       13.32591 259.3384       22.35027 318.7591       16.59901 145.2685 6.328760 161.4476 4.222675 -16.17908      7.608166 
1 1 1 -16 7  23 o 186.1155 3.388863 422.9231       15.36996 439.7477       22.83031 408.9766       20.78604 189.4983 4.948141 182.7940 4.670135 6.704269       6.803988 
1 1 1 -16 7  24 o 79.97537 3.331034 78.23096       6.477682 78.17976       8.342299 78.30870       10.27985 79.84743 4.303247 79.78039 5.317911 0.6703949E-01  6.840914 
1 1 1 -16 7  25 o 102.6663 2.832853 128.7373       7.080642 131.6895       10.63332 126.3855       9.490866 103.6878 4.217081 101.6210 3.839440 2.066795       5.703076 
1 1 1 -16 7  26 o 78.43324 2.854815 75.19054       5.447399 82.96559       8.504894 69.78212       7.093366 82.24325 4.258080 75.45425 3.870671 6.788994       5.754419 
1 1 1 -16 7  27 o 219.2878 3.777754 587.9582       20.18758 584.0398       28.96956 591.6572       28.14729 218.1467 5.449507 219.6189 5.259336 -1.472214      7.573489 
1 1 1 -16 7  28 o 127.0378 2.976168 197.1050       9.213538 189.3543       13.45231 203.9533       12.64495 124.2558 4.449858 129.0377 4.026209 -4.781921      6.000966 
1 1 1 -16 7  29 o 48.67602 4.304621 29.25027       5.053487 29.17416       6.564998 29.36095       7.916721 48.38051 5.676194 48.27813 6.927316 0.1023827      8.955830 
1 1 1 -16 7  30 o 71.96258 3.365466 63.47974       5.885501 67.99410       10.29610 61.28873       7.172931 74.06935 5.749231 70.58957 4.188678 3.479782       7.113276 
1 1 1 -16 7  31 o 39.58117 4.145831 19.42398       3.939603 24.74428       6.091649 15.59895       5.165162 44.41864 5.763494 35.00004 6.286969 9.418598       8.528999 
1 1 1 -16 7  32 o 22.30967 6.403867 6.326626       3.663694 10.44618       5.335455 2.651153       5.039678 28.40494 7.570948 18.90837 7.446050 9.496567       10.61899 
1 1 1 -16 7  33 o 94.05477 2.958110 108.4218       6.771595 102.7384       9.877657 113.4612       9.301275 91.21342 4.457344 95.99147 3.984916 -4.778053      5.978919 
1 1 1 -16 7  34 o 35.30416 5.629797 15.87440       4.680896 22.21947       9.955856 14.07374       5.303660 40.54455 10.11127 32.89349 6.839789 7.651066       12.20739 
1 1 1 -16 7  35 o 88.44257 2.932930 96.09237       6.312451 89.92343       9.115998 101.7754       8.749578 85.11401 4.410123 90.71922 3.967374 -5.605209      5.932053 
1 1 1 -16 7  36 o 26.75446 5.642113 9.321165       3.562532 6.263250       5.315552 11.81482       4.800142 22.76231 7.873697 29.89890 6.748725 -7.136593      10.37017 
1 1 1 -16 7  37 o 32.12524 4.840063 13.20838       3.671536 15.23191       5.372446 11.43516       5.029206 33.87526 6.745235 29.16023 7.136379 4.715033       9.819679 
1 1 1 -16 7  38 o 65.53589 3.177364 53.27443       5.059251 44.58548       7.207988 61.71186       7.102893 59.13665 5.050022 70.10527 4.176588 -10.96862      6.553366 
1 1 1 -16 7  39 o 32.61701 4.925843 13.82957       3.793361 5.856365       5.337673 21.96586       5.391984 21.70854 7.853549 40.94919 5.545817 -19.24065      9.614277 
1 1 1 -16 7  40 o 28.48605 6.883057 11.38333       4.724269 13.01466       6.476021 9.527621       6.907040 29.65640 8.514489 25.76258 8.971777 3.893818       12.36889 
1 1 1 -16 7  41 o 37.58323 4.561948 18.48259       4.092666 18.19976       5.801248 18.76284       5.774651 35.80588 6.898796 36.48037 6.744122 -0.6744919     9.647620 
1 1 1 -16 7  42 o 10.50582 4.972217 -3.240974      3.378664 -6.358887      4.920509 -0.4594778     4.647477 11.69208 5.655392 14.48255 6.465437 -2.790469      8.589839 
1 1 1 -16 7  43 o 20.46046 6.614376 6.113958       3.759270 3.761314       5.385054 8.350356       5.250327 18.40809 7.538685 23.15643 7.830116 -4.748337      10.86934 
1 1 1 -16 7  44 o 24.97942 7.173151 9.851840       4.595885 3.702970       7.149886 14.18127       5.999527 19.02805 8.272408 29.13574 8.138372 -10.10769      11.60456 
1 1 1 -16 7  45 o 26.91738 6.465321 11.21782       4.187573 4.548604       5.943610 17.79146       5.900866 18.50749 7.777679 32.94267 7.517042 -14.43518      10.81657 
1 1 1 -16 7  46 o 12.43804 5.637557 -0.4044299     3.687811 0.3353250      5.693172 -0.9392214     4.840638 15.13476 6.915804 13.54456 6.257469 1.590198       9.326535 
1 1 1 -16 7  47 o 27.62957 6.397964 12.27999       4.222830 14.24781       6.353883 10.72314       5.651586 26.61782 8.598690 23.51200 8.119431 3.105825       11.82635 
1 1 1 -16 8  1  o 215.7173 3.320414 567.6445       17.45474 564.3538       27.66128 569.8218       22.49991 214.9017 5.281974 216.0489 4.273588 -1.147171      6.794322 
1 1 1 -16 8  2  o 42.66067 2.930497 22.29883       3.028020 15.00369       4.760209 27.25695       3.924351 34.55754 5.861843 47.14376 3.439584 -12.58623      6.796466 
1 1 1 -16 8  3  o 300.6833 4.730865 1104.093       34.66458 1103.274       49.17263 1104.902       48.87496 300.2270 6.721057 300.4578 6.675238 -0.2308350     9.472667 
1 1 1 -16 8  4  o 219.8671 3.352659 589.6768       17.96328 570.7538       28.21443 602.5759       23.29456 216.1222 5.357174 222.1782 4.302461 -6.055984      6.870988 
1 1 1 -16 8  5  o 298.6938 4.676609 1089.433       34.04029 1106.257       49.05085 1073.802       47.27855 300.6497 6.694986 296.2350 6.549250 4.414673       9.365656 
1 1 1 -16 8  6  o 348.6581 5.349011 1485.369       45.44743 1455.404       91.32724 1495.232       52.39575 343.4198 10.92677 349.6549 6.149224 -6.235077      12.53823 
1 1 1 -16 8  7  o 109.4554 2.448870 146.0626       6.531894 146.9281       10.97939 145.5885       8.126445 109.6428 4.116554 109.2169 3.056342 0.4259567      5.127109 
1 1 1 -16 8  8  o 372.7717 5.049517 1697.447       45.87001 1620.676       70.78753 1753.017       60.22499 363.5507 7.990163 378.5013 6.529399 -14.95062      10.31871 
1 1 1 -16 8  9  o 476.2498 7.032177 2777.416       81.61327 2814.420       116.9905 2742.335       113.9084 478.1792 10.03977 472.0808 9.901554 6.098358       14.10098 
1 1 1 -16 8  10 o 184.2614 3.324405 414.1596       14.92741 426.5111       22.11201 403.8172       20.23388 186.8055 4.861515 181.7973 4.570884 5.008179       6.672878 
1 1 1 -16 8  11 o 309.6405 4.810799 1171.049       36.30037 1182.821       52.28115 1160.090       50.44121 310.7945 6.902966 307.8329 6.724103 2.961609       9.636622 
1 1 1 -16 8  12 o 219.1421 5.359799 586.9441       28.62269 586.9441       28.62269 0.000000       0.000000 219.1421 5.359799 ?        ?        0.000000       5.359799 
1 1 1 -16 8  13 o 153.4127 4.203272 287.5428       15.69912 289.2096       23.05140 286.1009       21.43991 153.6185 6.170244 152.8454 5.766525 0.7730865      8.445396 
1 1 1 -16 8  14 o 173.3041 3.206482 366.3867       13.54171 390.8377       20.50833 347.4849       18.03160 178.8089 4.710678 168.6300 4.391704 10.17889       6.440306 
1 1 1 -16 8  15 o 266.7780 4.274981 869.0914       27.79203 852.5085       39.51175 885.3298       39.09923 263.9105 6.143749 268.9778 5.965072 -5.067322      8.563162 
1 1 1 -16 8  16 f 208.4626 3.584119 530.3539       18.20735 522.1967       26.21444 537.9566       25.30766 206.6021 5.210943 209.7974 4.950119 -3.195313      7.187323 
1 1 1 -16 8  17 o 89.21362 2.646253 97.15150       5.746696 102.0274       9.115540 93.93542       7.403177 91.31413 4.106966 87.66545 3.472270 3.648682       5.378088 
1 1 1 -16 8  18 o 64.65025 2.770940 51.07436       4.355369 53.81717       7.008024 49.34830       5.559377 66.22939 4.366551 63.48118 3.608589 2.748203       5.664688 
1 1 1 -16 8  19 f 67.35812 3.037540 55.46890       4.973124 45.55368       9.417693 59.30285       5.856205 60.62107 6.475219 69.61794 3.462775 -8.996872      7.342974 
1 1 1 -16 8  20 o 124.7652 3.239428 190.1018       9.840796 196.4478       18.86827 187.7305       11.53373 126.4620 6.140960 123.9282 3.823694 2.533775       7.234087 
1 1 1 -16 8  21 o 195.4647 3.480658 466.4432       16.57928 477.0533       24.40371 457.3484       22.59402 197.3918 5.077518 193.3789 4.794556 4.012878       6.983478 
1 1 1 -16 8  22 o 57.15155 3.085540 39.97926       4.281362 34.81344       6.803104 43.36682       5.509109 53.05890 5.333823 59.46198 3.822188 -6.403080      6.561920 
1 1 1 -16 8  23 o 180.8497 3.792381 399.5640       16.71344 370.5627       28.62312 414.5677       20.58773 173.5327 6.781667 184.1015 4.588969 -10.56874      8.188385 
1 1 1 -16 8  24 o 158.5136 3.680058 306.9657       14.21534 315.1264       18.10790 293.8589       22.94831 160.4161 4.637030 154.6175 6.102527 5.798584       7.664391 
1 1 1 -16 8  25 o 84.78621 2.852360 87.83958       5.885006 84.88872       9.000312 90.04345       7.778128 83.17634 4.456668 85.75894 3.730782 -2.582603      5.812110 
1 1 1 -16 8  26 o 112.8690 2.882636 155.6205       7.922186 166.2908       12.09282 147.5981       10.48561 116.5027 4.266676 109.7980 3.925206 6.704681       5.797566 
1 1 1 -16 8  27 o 14.92873 5.990551 1.293357       3.321730 -9.397947      5.436427 7.662755       4.196115 12.05851 5.858836 24.56197 6.785718 -12.50346      8.965039 
1 1 1 -16 8  28 o 222.9988 4.474843 609.2562       24.31736 597.7032       29.91029 631.7814       41.76449 220.4736 5.571550 225.7978 7.601001 -5.324249      9.424297 
1 1 1 -16 8  29 o 156.2385 3.191070 298.3774       12.14956 313.2025       18.17396 286.3983       16.33667 159.7152 4.674497 152.7910 4.392184 6.924194       6.414219 
1 1 1 -16 8  30 o 128.4652 3.368816 202.0380       10.53717 210.4425       18.71295 198.1359       12.75081 130.4813 5.900423 127.0681 4.123258 3.413177       7.198350 
1 1 1 -16 8  31 o 153.4474 3.195745 288.1157       11.95000 287.9972       17.43776 288.2206       16.40883 152.9754 4.683223 153.1233 4.402012 -0.1479492     6.427308 
1 1 1 -16 8  32 o 87.64333 2.957379 94.10372       6.307240 99.58073       9.589000 89.92714       8.373599 89.87122 4.391710 85.47385 4.031516 4.397362       5.961563 
1 1 1 -16 8  33 o 100.0161 4.369583 123.5046       10.62421 148.3902       17.98158 110.1582       13.16850 108.6540 6.825679 93.98122 5.777815 14.67281       8.942764 
1 1 1 -16 8  34 o 51.34476 4.187222 32.73832       5.193667 31.70939       6.714463 34.27088       8.194608 50.15920 5.587964 51.82961 6.640401 -1.670410      8.678724 
1 1 1 -16 8  35 o 11.57126 5.236574 -1.648397      3.167117 1.298696       4.764726 -3.981198      4.239159 17.03846 7.046108 12.20511 5.711407 4.833351       9.070160 
1 1 1 -16 8  36 o 25.81095 5.664149 8.705873       3.464641 9.104440       5.096286 8.363364       4.724314 26.18065 7.564513 25.15653 7.287598 1.024118       10.50385 
1 1 1 -16 8  37 o 67.26949 3.112487 55.96921       5.088420 59.17107       7.565458 53.32429       6.876066 68.60009 4.551318 65.19527 4.352943 3.404816       6.297825 
1 1 1 -16 8  38 o 30.66278 5.208553 12.25285       3.752842 17.86121       5.773612 8.149789       4.938372 36.47669 6.743589 24.53758 7.535391 11.93911       10.11228 
1 1 1 -16 8  39 o 44.91726 3.963228 25.55094       4.293634 21.95741       6.056976 29.18063       6.087371 40.44153 6.355389 47.30629 5.375723 -6.864761      8.324023 
1 1 1 -16 8  40 o 27.87342 7.329056 11.13227       5.043335 11.17662       7.035419 11.08539       7.233407 27.32320 9.061446 27.21214 9.190688 0.1110516      12.90653 
1 1 1 -16 8  41 o 13.69543 5.917705 0.3422290      3.613605 2.253471       5.163709 -1.492089      5.058726 17.38558 7.274046 14.49719 6.583494 2.888387       9.810919 
1 1 1 -16 8  42 o 44.40409 4.214137 25.74407       4.505445 23.54923       6.393312 27.90942       6.350230 40.50238 6.712422 44.83355 5.959813 -4.331169      8.976413 
1 1 1 -16 8  43 o 25.89374 7.208430 10.32204       4.715348 6.826399       5.658587 18.26513       8.529802 21.36802 8.022906 31.59304 9.936118 -10.22503      12.77081 
1 1 1 -16 8  44 o 12.77141 5.847689 -1.219982      4.097639 -0.7508984     7.361112 -1.430602      4.932515 16.62702 7.693841 13.78269 6.349217 2.844330       9.975358 
1 1 1 -16 8  45 o 17.18154 6.542325 4.193330       3.793594 0.9582991      5.562290 7.006799       5.187229 15.62491 7.016862 20.52076 7.686342 -4.895853      10.40751 
1 1 1 -16 8  46 o 19.16020 6.696148 5.938614       3.849469 8.456635       6.173050 4.336379       4.924173 21.28119 8.281728 17.47018 7.187633 3.811012       10.96581 
1 1 1 -16 8  47 o 13.18798 6.073041 -0.5651962     4.506942 -4.220677      6.019269 4.099147       6.799340 13.06461 6.303466 17.65763 7.855536 -4.593024      10.07190 
1 1 1 -16 9  1  o 164.1510 2.867366 328.6119       11.46998 333.2551       18.45036 325.6871       14.64350 165.1275 4.589557 163.3714 3.678177 1.756027       5.881583 
1 1 1 -16 9  2  o 248.5821 4.107689 754.2747       24.88304 789.8655       36.30494 722.7434       34.17174 254.1418 5.862103 243.1179 5.767851 11.02386       8.223889 
1 1 1 -16 9  3  o 198.6008 3.160268 481.0887       15.29471 472.6399       24.29239 486.6374       19.68654 196.6213 5.074188 199.6758 4.045832 -3.054489      6.489695 
1 1 1 -16 9  4  o 104.3448 2.482231 132.7475       6.311741 147.4070       10.64526 124.8001       7.838097 109.8280 3.984071 101.1021 3.185344 8.725883       5.100906 
1 1 1 -16 9  5  o 284.3219 4.046603 986.6481       28.03736 1066.954       46.79148 941.6641       35.02039 295.2715 6.502931 277.6154 5.176562 17.65613       8.311733 
1 1 1 -16 9  6  o 254.7503 3.719464 791.8730       23.09038 808.8721       37.34129 781.3490       29.38102 257.1829 5.958145 252.9359 4.766727 4.247040       7.630280 
1 1 1 -16 9  7  o 311.1317 4.865698 1182.383       36.89143 1108.677       72.45049 1208.182       42.86456 299.9623 9.925146 314.3840 5.595022 -14.42169      11.39354 
1 1 1 -16 9  8  o 201.9753 3.164682 497.5721       15.57630 482.5684       24.80748 507.3370       20.01313 198.6727 5.128279 203.8815 4.028107 -5.208862      6.521111 
1 1 1 -16 9  9  o 39.97419 2.979473 19.59612       2.881512 20.61939       5.554545 19.21934       3.370522 40.66604 5.766596 39.53282 3.535969 1.133221       6.764370 
1 1 1 -16 9  10 o 287.9240 5.267572 1013.096       36.95935 1004.534       45.59410 1029.502       63.11617 286.4768 6.531050 289.2995 8.963573 -2.822693      11.09055 
1 1 1 -16 9  11 o 195.4834 4.032322 466.4402       19.20884 475.1492       24.44921 452.3944       31.04936 197.1307 5.093761 192.1132 6.642219 5.017502       8.370512 
1 1 1 -16 9  12 o 172.9281 3.795195 364.9566       15.99321 351.4833       19.69219 391.0647       27.41217 169.5598 4.770532 178.6423 6.306741 -9.082443      7.907779 
1 1 1 -16 9  13 o 172.1899 3.206565 361.6949       13.45500 378.4971       20.24568 348.4031       18.00695 175.9574 4.725874 168.8524 4.379894 7.105011       6.443397 
1 1 1 -16 9  14 o 281.2297 4.460728 966.0001       30.57053 965.1190       43.91368 966.8287       42.58353 280.7392 6.418901 281.0309 6.218011 -0.2916870     8.936775 
1 1 1 -16 9  15 f 42.34666 3.307204 22.01257       3.385794 28.58556       6.026249 18.98063       4.092854 48.07314 5.228205 39.18174 4.360313 8.891399       6.807823 
1 1 1 -16 9  16 o 97.97720 2.669654 117.1610       6.368119 135.3772       10.32033 105.9609       8.092387 105.2182 4.032472 93.10838 3.573210 12.10981       5.387825 
1 1 1 -16 9  17 o 17.91462 5.512105 3.919549       2.640886 4.852186       4.758776 3.504503       3.174587 21.19047 7.442206 17.73016 6.086815 3.460306       9.614351 
1 1 1 -16 9  18 o 124.2220 2.817952 188.2351       8.530373 193.7060       13.01650 184.1166       11.29365 125.8512 4.250346 122.7415 3.780288 3.109749       5.688235 
1 1 1 -16 9  19 o 172.9860 4.426922 365.9304       18.64627 0.000000       0.000000 365.9304       18.64627 ?        ?        172.9860 4.426922 0.000000       4.426922 
1 1 1 -16 9  20 o 30.78307 4.409157 11.81514       3.213199 9.478242       5.653934 12.92997       3.905138 27.47567 7.976258 32.10840 5.166165 -4.632732      9.503155 
1 1 1 -16 9  21 o 123.3509 2.855922 185.6482       8.584695 191.0162       13.14468 181.6557       11.33625 124.9361 4.323954 121.8915 3.821174 3.044662       5.770437 
1 1 1 -16 9  22 o 152.9460 3.084315 285.5104       11.49563 287.2625       17.06629 284.0552       15.55339 153.1906 4.576763 152.3889 4.192263 0.8016510      6.206595 
1 1 1 -16 9  23 o 137.2581 2.989480 229.9413       9.999308 212.0039       14.47923 246.2960       13.82571 131.5759 4.522506 141.9048 4.002103 -10.32890      6.039030 
1 1 1 -16 9  24 o 101.6511 3.363547 126.3292       8.320460 123.9322       10.82372 129.7920       13.00927 100.5558 4.427917 102.7956 5.210276 -2.239853      6.837647 
1 1 1 -16 9  25 o 132.9340 2.993553 215.7416       9.697483 220.9220       14.73333 211.7818       12.88115 134.2783 4.508950 131.5432 4.023099 2.735092       6.042843 
1 1 1 -16 9  26 o 189.6126 3.474852 439.3401       16.05608 452.1805       23.76710 428.5603       21.77670 191.9803 5.084706 186.9696 4.783456 5.010788       6.981095 
1 1 1 -16 9  27 o 103.1283 2.917010 129.9798       7.323447 122.5392       10.87437 136.1553       9.906936 99.92346 4.477185 105.4334 3.862420 -5.509972      5.912992 
1 1 1 -16 9  28 o 122.3716 3.504240 183.2537       10.43910 192.6183       13.50593 169.3571       16.45263 125.3013 4.430133 117.1952 5.778706 8.106033       7.281451 
1 1 1 -16 9  29 o 27.69653 5.488417 9.763947       3.573334 7.375379       5.524312 11.48226       4.685555 24.70412 8.020741 29.91316 6.604623 -5.209034      10.39006 
1 1 1 -16 9  30 o 178.4097 3.844552 390.0028       16.71477 407.1006       29.88463 382.2193       20.16357 181.0962 6.783767 176.3180 4.697013 4.778168       8.251146 
1 1 1 -16 9  31 o 97.53473 2.975427 116.4728       7.063770 123.0935       10.72647 111.4029       9.386457 99.98562 4.413210 95.18826 4.055820 4.797356       5.993839 
1 1 1 -16 9  32 o 75.57535 3.050174 70.04725       5.605930 73.35757       8.567817 67.56918       7.412953 77.03401 4.584802 74.02431 4.125745 3.009705       6.167835 
1 1 1 -16 9  33 o 99.49973 3.477814 121.7134       8.419688 126.9047       17.50314 120.1505       9.603848 100.1531 7.220051 98.71600 4.000574 1.437080       8.254315 
1 1 1 -16 9  34 o 15.57482 6.327305 1.346609       3.756678 2.313185       5.060658 0.1601972      5.606693 18.44800 7.397101 17.37419 7.437190 1.073816       10.48947 
1 1 1 -16 9  35 o 29.44971 5.246043 11.14320       3.626808 11.45815       5.442540 10.89163       4.864210 29.33398 7.564695 28.68868 7.016738 0.6453018      10.31791 
1 1 1 -16 9  36 o 39.91938 4.112998 19.99337       3.943889 17.70344       5.879481 21.86663       5.317732 36.62948 6.838195 41.35416 5.406120 -4.724682      8.717055 
1 1 1 -16 9  37 o 82.82256 3.026237 84.78506       6.097571 92.79010       9.315724 78.78472       8.065334 85.94241 4.463378 79.31889 4.187463 6.623528       6.120179 
1 1 1 -16 9  38 o 71.22657 3.166411 63.02639       5.482246 64.08044       8.282572 62.20453       7.313651 70.93531 4.820077 70.19691 4.296008 0.7384033      6.456688 
1 1 1 -16 9  39 o 71.49909 3.744010 64.33992       6.500664 65.40568       8.327614 62.67743       10.40087 71.35439 4.817447 68.62479 6.289324 2.729599       7.922335 
1 1 1 -16 9  40 o 23.80075 6.576712 7.965548       3.941173 9.729136       5.759008 6.412037       5.405129 25.72875 8.173662 21.86967 7.904222 3.859074       11.37038 
1 1 1 -16 9  41 o 28.96206 5.855612 11.65407       3.990494 8.026230       5.731180 15.06788       5.559556 23.32823 8.169207 32.03284 7.286979 -8.704609      10.94696 
1 1 1 -16 9  42 o 22.74829 6.476099 7.544474       3.761907 10.35566       5.377144 4.849413       5.264910 25.80449 7.851222 19.52551 7.633990 6.278984       10.95078 
1 1 1 -16 9  43 o 19.51707 7.138757 5.464325       4.427166 8.601848       5.544156 -0.5691460E-01 7.354620 23.16778 8.039804 17.28693 7.884383 5.880850       11.26064 
1 1 1 -16 9  44 o 18.28213 6.663308 4.855235       3.852045 5.203789       5.786223 4.577802       5.162246 19.26576 7.843006 18.45285 7.445794 0.8129101      10.81446 
1 1 1 -16 9  45 f 16.15503 6.441937 3.355454       3.816574 5.468800       5.572565 1.488344       5.237871 18.94536 7.702691 15.62697 6.926618 3.318384       10.35903 
1 1 1 -16 9  46 o 32.93573 5.969815 16.56565       4.615038 13.05525       6.882517 19.43352       6.220828 25.08034 8.936802 33.34526 7.795904 -8.264921      11.85928 
1 1 1 -16 10 1  o 105.2009 2.796267 135.0639       7.162243 142.8970       10.71317 128.7334       9.630927 108.1162 4.073509 102.6286 3.857778 5.487564       5.610341 
1 1 1 -16 10 2  o 95.14597 2.484006 110.4543       5.754498 111.8554       9.471282 109.6344       7.245073 95.63802 4.073219 94.75287 3.142067 0.8851471      5.144288 
1 1 1 -16 10 3  o 138.6015 2.672496 234.2528       9.026539 240.3128       14.88380 230.7271       11.35259 140.2236 4.360988 137.5217 3.387564 2.701965       5.522120 
1 1 1 -16 10 4  o 351.2717 5.373380 1508.204       45.99672 1510.855       65.65374 1505.649       64.46103 351.0066 7.675525 350.4381 7.548310 0.5684814      10.76525 
1 1 1 -16 10 5  o 50.61089 2.767666 31.32910       3.400460 24.15706       5.846059 34.99646       4.180412 44.10745 5.562399 53.46623 3.223482 -9.358784      6.428929 
1 1 1 -16 10 6  o 73.91533 2.454276 66.68618       4.414600 69.19987       7.668077 65.44000       5.399112 75.17294 4.202631 73.18646 3.033879 1.986481       5.183293 
1 1 1 -16 10 7  o 209.2944 3.650751 534.5015       18.61984 506.1295       38.20866 543.3378       21.32311 203.0082 7.737627 210.9731 4.147510 -7.964828      8.779106 
1 1 1 -16 10 8  o 66.68779 2.755208 54.32468       4.467869 59.86827       7.303832 51.00991       5.647827 69.89361 4.309173 64.55708 3.604368 5.336525       5.617868 
1 1 1 -16 10 9  f 161.8564 3.160652 319.5543       12.46644 318.2896       18.22386 320.6667       17.09104 161.3670 4.639174 162.0018 4.333139 -0.6348267     6.348073 
1 1 1 -16 10 10 f 129.5500 3.246826 204.8655       10.24213 210.0261       18.45378 202.5681       12.31262 130.9157 5.798778 128.7669 3.928426 2.148880       7.004167 
1 1 1 -16 10 11 o 40.17480 3.353855 19.82805       3.253549 16.99275       5.839002 21.10475       3.918183 36.67234 6.783565 41.39640 3.931182 -4.724064      7.840341 
1 1 1 -16 10 12 o 60.91412 3.454377 45.41993       5.106698 47.72104       6.897969 42.62926       7.596363 62.33858 4.572569 58.80782 5.359548 3.530762       7.045079 
1 1 1 -16 10 13 o 52.56533 2.953507 33.80922       3.768107 39.56785       6.664078 31.10280       4.568552 56.69629 4.870508 50.34145 3.751021 6.354836       6.147521 
1 1 1 -16 10 14 f 120.3693 2.814348 176.7155       8.255239 167.7374       12.36196 183.9419       11.09059 117.1110 4.339156 122.7042 3.713291 -5.593277      5.711112 
1 1 1 -16 10 15 o 101.2800 2.724900 125.1960       6.719167 125.4302       10.38019 125.0271       8.815147 101.2553 4.216020 101.1491 3.581932 0.1061783      5.532185 
1 1 1 -16 10 16 o 42.06535 3.399736 21.73473       3.455354 17.32034       6.034379 23.88825       4.214737 36.98898 6.949693 44.05338 3.968543 -7.064400      8.002973 
1 1 1 -16 10 17 o 38.34929 3.527124 18.10223       3.259310 21.07906       5.828019 16.74749       3.931616 41.06143 6.001666 36.75152 4.482589 4.309910       7.490901 
1 1 1 -16 10 18 o 79.20267 3.050619 76.65378       5.876938 78.18607       12.29819 76.20032       6.690272 79.60979 6.392961 78.93294 3.486763 0.6768494      7.281996 
1 1 1 -16 10 19 o 111.1421 3.667266 150.9921       9.918869 0.000000       0.000000 150.9921       9.918869 ?        ?        111.1421 3.667266 0.000000       3.667266 
1 1 1 -16 10 20 o 207.0555 3.618001 523.5101       18.25540 523.1055       26.59638 523.8705       25.10242 206.6541 5.285657 206.9258 4.978114 -0.2717438     7.260839 
1 1 1 -16 10 21 o 80.57373 2.817910 79.30987       5.524433 79.69804       8.784194 79.05589       7.105550 80.60992 4.489483 80.37463 3.637219 0.2352982      5.777960 
1 1 1 -16 10 22 o 110.4479 2.850714 148.9576       7.666269 144.4590       11.65200 152.3914       10.17997 108.6008 4.412010 111.6272 3.747629 -3.026352      5.788831 
1 1 1 -16 10 23 f 57.22403 3.194579 40.10340       4.437117 45.64994       7.430953 37.03003       5.531479 60.84893 5.057021 54.87763 4.167438 5.971294       6.552938 
1 1 1 -16 10 24 o 231.0562 4.573338 653.3774       25.75058 638.5024       31.72507 682.1016       44.08566 228.0589 5.712965 235.0055 7.708523 -6.946640      9.594752 
1 1 1 -16 10 25 o 138.0644 3.036561 232.7509       10.21645 240.2415       15.53488 227.0424       13.56176 140.0093 4.559261 136.1824 4.091208 3.826859       6.125752 
1 1 1 -16 10 26 o 204.2022 4.127828 510.2650       20.54084 485.2465       35.37515 522.9910       25.22985 198.0855 7.341106 206.5225 5.013156 -8.436996      8.889521 
1 1 1 -16 10 27 o 123.9221 3.516446 187.8944       10.60839 191.4279       13.56595 182.3326       17.01985 124.9250 4.463375 121.6469 5.757751 3.278114       7.285151 
1 1 1 -16 10 28 o 152.0900 3.172882 282.7191       11.75955 279.9946       17.33828 285.0401       16.00290 151.0004 4.717641 152.4533 4.311834 -1.452927      6.391248 
1 1 1 -16 10 29 o 94.12322 2.968885 108.3850       6.801156 115.4422       10.50290 103.2888       8.925138 96.89903 4.459845 91.72771 4.002441 5.171318       5.992474 
1 1 1 -16 10 30 o 19.78715 6.547130 4.633695       3.673386 9.780490       7.125412 2.770663       4.286983 28.17689 9.106085 18.06877 6.936267 10.10812       11.44695 
1 1 1 -16 10 31 o 78.04932 3.028080 74.65884       5.748411 69.91460       8.657248 78.40003       7.687788 75.20185 4.748300 79.82028 3.964729 -4.618431      6.185905 
1 1 1 -16 10 32 o 58.31855 3.382717 41.84812       4.786747 37.05464       7.238228 45.57391       6.381405 54.40645 5.536455 60.68167 4.344155 -6.275227      7.037331 
1 1 1 -16 10 33 o 82.23838 3.573256 83.28783       7.143929 84.50242       15.45628 82.95786       8.056082 81.19975 7.911342 81.95277 4.046403 -0.7530136     8.886097 
1 1 1 -16 10 34 o 25.39341 6.493208 8.436240       4.033314 9.004320       5.447465 7.746964       6.000489 26.29451 7.881350 25.00082 8.370371 1.293694       11.49690 
1 1 1 -16 10 35 o 29.58420 5.363881 11.28780       3.724650 12.80711       5.668467 10.13341       4.941041 30.93913 7.579178 27.60121 7.252847 3.337921       10.49036 
1 1 1 -16 10 36 o 39.63633 4.413687 19.83219       4.190921 19.42110       6.134574 20.19196       5.738905 38.34141 6.815428 39.36891 6.185656 -1.027504      9.203934 
1 1 1 -16 10 37 o 31.49765 5.121994 12.85434       3.796505 13.11472       5.752282 12.65338       5.053478 30.87226 7.678056 30.57794 6.941135 0.2943172      10.35045 
1 1 1 -16 10 38 o 39.82244 4.331319 20.21797       4.135600 17.15021       6.212943 22.65865       5.541689 35.16591 7.480231 41.59289 5.610418 -6.426979      9.350435 
1 1 1 -16 10 39 o 20.49662 7.463586 5.249395       4.831314 11.14039       7.060659 0.6273416E-01  6.625137 27.50696 9.075952 17.80389 7.845283 9.703077       11.99672 
1 1 1 -16 10 40 o 24.74991 6.228180 8.582438       3.752847 7.540207       5.595156 9.434761       5.059789 23.05888 8.071914 25.39422 7.592051 -2.335340      11.08129 
1 1 1 -16 10 41 o 18.36506 6.553042 4.441066       3.701824 -0.8592848     5.278506 9.570862       5.192885 15.09744 6.802989 25.15147 7.727721 -10.05403      10.29555 
1 1 1 -16 10 42 o 25.79277 6.357775 9.697124       3.970204 9.795308       5.725949 9.606215       5.509725 24.83248 8.172281 24.69008 8.009683 0.1423988      11.44295 
1 1 1 -16 10 43 o 29.92060 7.626955 14.27029       5.576844 18.76168       8.670989 11.10168       7.283035 31.33308 10.03776 25.02442 9.155730 6.308659       13.58617 
1 1 1 -16 10 44 o 25.56245 6.476615 10.07378       4.038602 9.043741       5.756482 11.07221       5.667450 22.85739 8.169965 25.22190 8.118567 -2.364508      11.51779 
1 1 1 -16 10 45 o 24.46881 6.569572 9.574568       3.999339 15.23883       6.225215 5.593733       5.218790 28.82668 8.369840 18.89527 7.533500 9.931417       11.26090 
1 1 1 -16 10 46 o 24.51919 6.791307 10.03004       4.197043 2.696468       6.436912 15.45361       5.535570 16.82242 7.552023 29.65736 7.619253 -12.83495      10.72782 
1 1 1 -16 11 1  o 123.0979 2.898143 184.8206       8.693738 178.8552       12.74220 190.0159       11.89144 120.9421 4.330445 124.7023 3.917988 -3.760201      5.839810 
1 1 1 -16 11 2  o 130.7738 2.654325 208.5504       8.458839 216.4514       14.07363 204.0818       10.58390 133.0640 4.346029 129.2890 3.362148 3.774994       5.494725 
1 1 1 -16 11 3  f 248.1571 3.679379 751.5289       22.25037 789.9243       36.59002 729.0001       28.02804 254.1007 5.909092 244.2863 4.708228 9.814316       7.555448 
1 1 1 -16 11 4  o 108.5199 2.516678 143.5960       6.655386 135.7515       10.91408 148.2398       8.397362 105.3569 4.259752 110.1944 3.130311 -4.837479      5.286240 
1 1 1 -16 11 5  o 135.9532 3.377268 225.5031       11.18900 222.0344       14.37055 230.8431       17.83071 134.7729 4.381394 137.3167 5.338723 -2.543808      6.906416 
1 1 1 -16 11 6  o 169.8082 3.248565 351.7610       13.44269 354.2058       19.67063 349.6187       18.41328 170.2151 4.746880 169.1404 4.471248 1.074677       6.521113 
1 1 1 -16 11 7  o 231.0316 4.522945 651.8817       25.46413 660.8777       46.47968 648.0236       30.43861 231.8479 8.239766 230.2285 5.425375 1.619431       9.865518 
1 1 1 -16 11 8  o 176.4728 3.828859 380.1009       16.46581 357.9287       20.33685 422.2964       28.05521 171.0885 4.882826 185.6514 6.209990 -14.56284      7.899745 
1 1 1 -16 11 9  o 111.9185 2.710690 152.7514       7.392950 156.5535       15.53047 151.6373       8.406527 112.9992 5.657924 111.4520 3.098234 1.547180       6.450671 
1 1 1 -16 11 10 o 306.3641 4.302158 1146.159       32.11887 1131.503       51.08493 1155.740       41.30409 303.8707 6.898710 307.4233 5.513409 -3.552612      8.831187 
1 1 1 -16 11 11 o 11.87912 4.848177 0.6117662      2.217737 2.651374       4.715365 0.3245545E-01  2.513031 18.64655 7.243289 11.82692 5.018051 6.819633       8.811702 
1 1 1 -16 11 12 o 63.54049 3.607352 49.43182       5.562724 50.23194       7.492566 48.44911       8.303552 63.93172 4.845335 62.70226 5.489630 1.229454       7.322111 
1 1 1 -16 11 13 o 22.16223 5.318742 6.247551       2.835845 5.890771       5.525080 6.375161       3.304300 23.11592 8.025729 22.42864 5.948912 0.6872730      9.990089 
1 1 1 -16 11 14 o 166.2435 3.194297 337.1980       12.94065 340.3223       19.28352 334.6383       17.45455 166.8081 4.748704 165.4608 4.332626 1.347290       6.428207 
1 1 1 -16 11 15 o 66.01263 2.830422 53.25207       4.542596 49.94675       7.467735 55.19349       5.723245 63.73967 4.844036 67.15557 3.509407 -3.415901      5.981691 
1 1 1 -16 11 16 o 117.9645 2.814945 169.7481       8.092027 173.1399       12.48991 167.2945       10.62311 118.9680 4.315321 116.9993 3.730680 1.968727       5.704382 
1 1 1 -16 11 17 o 101.7973 3.079326 126.5587       7.630066 144.8185       15.78258 120.9893       8.716363 108.5661 5.988707 99.48673 3.601233 9.079414       6.988096 
1 1 1 -16 11 18 o 164.1138 3.620296 328.8447       14.47855 331.9592       26.93904 327.5797       17.16910 164.3373 6.741131 163.6716 4.308399 0.6657562      8.000321 
1 1 1 -16 11 19 o 25.21846 5.588354 8.093465       3.343932 3.502538       7.806342 9.125181       3.700646 23.18974 9.224230 26.77820 5.836205 -3.588453      10.91548 
1 1 1 -16 11 20 o 142.2533 3.021357 246.9557       10.47371 256.9350       15.97181 239.4268       13.87306 144.8860 4.529239 139.9189 4.073075 4.967178       6.091301 
1 1 1 -16 11 21 o 113.6689 2.868761 157.7674       7.940084 154.6237       12.11502 160.1344       10.51264 112.3630 4.433206 114.4302 3.775114 -2.067215      5.822783 
1 1 1 -16 11 22 o 240.1948 4.020030 705.1602       23.53038 739.8340       35.08989 676.8286       31.71885 245.5987 5.862999 234.9916 5.538971 10.60710       8.065665 
1 1 1 -16 11 23 o 149.2443 3.656016 272.1466       13.29664 282.0402       17.32988 257.9858       20.73299 151.7258 4.692694 144.8749 5.884881 6.850922       7.526832 
1 1 1 -16 11 24 o 171.1406 3.315306 357.7484       13.82651 365.6844       20.65636 351.3064       18.61055 172.7068 4.913034 169.3565 4.513451 3.350327       6.671517 
1 1 1 -16 11 25 o 216.3317 3.779006 572.2133       19.92204 542.8022       28.29533 601.1254       28.05425 210.2118 5.528390 221.3862 5.200105 -11.17439      7.589742 
1 1 1 -16 11 26 o 137.8486 3.070920 232.1080       10.31590 226.2109       15.28910 237.0362       13.97683 135.7950 4.626970 139.1049 4.127726 -3.309845      6.200562 
1 1 1 -16 11 27 f 157.8836 4.506680 305.7516       17.32149 276.0145       23.91922 338.5423       25.11726 149.4362 6.584496 165.6468 6.233452 -16.21056      9.067056 
1 1 1 -16 11 28 o 43.71171 3.958184 23.58999       4.170631 32.10147       7.203027 19.29737       5.115332 50.69922 5.942784 39.23106 5.501672 11.46816       8.098462 
1 1 1 -16 11 29 o 50.93188 3.573991 31.91273       4.407717 28.85678       7.154853 33.78186       5.595606 47.92267 6.277435 52.27853 4.434044 -4.355862      7.685502 
1 1 1 -16 11 30 o 118.2043 3.324164 171.2003       9.565779 146.9335       16.42775 183.6494       11.76634 108.7268 6.226229 122.2898 3.953538 -13.56310      7.375391 
1 1 1 -16 11 31 o 40.75219 4.188946 20.62767       4.100815 15.65987       6.346670 24.18817       5.373031 34.67606 7.710204 43.97619 5.108758 -9.300133      9.249144 
1 1 1 -16 11 32 o 20.99894 6.683352 5.446019       3.848900 7.188593       9.979216 5.141497       4.171671 27.43090 10.56912 20.79217 6.979442 6.638739       12.66566 
1 1 1 -16 11 33 o 12.50747 5.515917 -0.8648028     3.281301 -1.785907      5.399829 -0.3255523     4.131625 15.67785 6.986050 14.62001 6.322456 1.057836       9.422226 
1 1 1 -16 11 34 o 41.38157 4.708300 21.54127       4.663627 21.53859       6.425640 21.54425       6.779290 40.75083 6.703474 40.61176 7.108937 0.1390724      9.771057 
1 1 1 -16 11 35 o 64.37498 3.285071 51.22731       5.136409 40.88733       7.679111 59.59888       6.909628 56.68840 5.633252 69.17412 4.117604 -12.48572      6.977692 
1 1 1 -16 11 36 o 85.67542 3.059861 90.68732       6.378170 91.51890       9.588727 90.02740       8.541943 85.31692 4.629346 84.87836 4.142257 0.4385605      6.212016 
1 1 1 -16 11 37 o 28.50231 6.386995 10.93121       4.326079 4.927909       5.520888 20.48065       6.963102 21.02782 7.918370 38.62983 7.667415 -17.60201      11.02224 
1 1 1 -16 11 38 o 50.46688 3.829777 32.12901       4.674785 28.67173       7.124934 34.74234       6.194560 46.21791 6.505889 51.90909 4.957145 -5.691177      8.179235 
1 1 1 -16 11 39 o 17.77461 7.284476 2.535115       5.032543 0.6988127      7.172407 4.315841       7.063034 18.67408 8.198069 21.07129 8.632012 -2.397213      11.90462 
1 1 1 -16 11 40 o 20.28356 6.595180 5.702528       3.734347 2.262824       5.526451 8.592800       5.065884 17.78404 7.488245 24.17103 7.664500 -6.386993      10.71533 
1 1 1 -16 11 41 o 18.56183 6.643977 4.591278       3.808311 3.279270       5.508378 5.792638       5.270990 18.36284 7.583210 20.61160 7.742339 -2.248758      10.83738 
1 1 1 -16 11 42 o 41.32659 4.609530 22.82480       4.563242 23.69412       6.741817 22.08981       6.199089 39.75782 7.224576 38.76271 6.811068 0.9951019      9.929005 
1 1 1 -16 11 43 o 25.09636 8.119715 10.60312       5.664382 8.125297       8.291663 12.77135       7.756391 22.31023 9.266747 26.11588 9.464497 -3.805645      13.24573 
1 1 1 -16 11 44 o 14.32963 6.112182 1.520084       3.762742 1.705738       5.486636 1.355234       5.170100 16.12598 7.121260 15.61026 6.902270 0.5157194      9.917342 
1 1 1 -16 11 45 o 27.86636 6.284572 12.10681       4.165603 10.65815       6.344266 13.20464       5.522879 23.45655 8.551031 27.23547 7.876396 -3.778919      11.62574 
1 1 1 -16 11 46 o 13.55877 5.919603 1.139460       3.694149 -2.731901      5.748849 3.862373       4.821321 13.44422 6.398320 16.79897 7.028692 -3.354747      9.504788 
1 1 1 -16 12 1  o 189.8156 3.488873 439.6999       16.13813 470.2054       24.07404 414.8039       21.74828 196.0569 5.043028 184.1647 4.850210 11.89217       6.996904 
1 1 1 -16 12 2  o 94.74646 2.810478 109.5844       6.481850 104.5754       9.796254 113.4851       8.644789 92.42896 4.361568 96.35516 3.688468 -3.926193      5.712099 
1 1 1 -16 12 3  o 199.2010 3.582466 484.2675       17.39040 476.7055       24.97726 491.3822       24.22736 197.3973 5.196912 200.5119 4.958265 -3.114594      7.182777 
1 1 1 -16 12 4  o 49.80754 3.141960 30.38384       3.794138 27.79539       6.296803 31.85932       4.754075 47.35015 5.563108 50.94276 3.858233 -3.592613      6.770092 
1 1 1 -16 12 5  f 143.8409 3.041618 252.3848       10.66162 247.2362       15.63866 256.8558       14.57326 142.1977 4.518794 144.9817 4.129048 -2.784012      6.121154 
1 1 1 -16 12 6  o 57.25820 2.691618 40.07028       3.745156 42.55000       6.971970 39.06453       4.440167 58.80491 4.910029 56.49370 3.238822 2.311214       5.882037 
1 1 1 -16 12 7  o 277.7903 4.475143 942.5589       30.29424 1011.295       65.45245 923.8195       34.17517 286.3971 9.390934 274.9138 5.101266 11.48328       10.68703 
1 1 1 -16 12 8  o 113.4493 2.746048 156.9697       7.591825 160.0266       15.87161 156.0628       8.644938 114.2294 5.719934 113.0614 3.140743 1.167938       6.525482 
1 1 1 -16 12 9  o 66.09595 2.566092 53.35389       4.125318 55.50934       7.611992 52.45755       4.908692 67.24345 4.674383 65.50339 3.083805 1.740059       5.599974 
1 1 1 -16 12 10 o 47.20046 2.854044 27.27265       3.267450 33.28463       6.502055 25.24150       3.779312 51.91858 5.209471 45.35070 3.445522 6.567879       6.245815 
1 1 1 -16 12 11 o 120.8753 2.564224 178.1770       7.553177 193.1704       13.27824 171.0046       9.183762 125.6841 4.341871 118.3473 3.187291 7.336807       5.386155 
1 1 1 -16 12 12 o 88.64161 2.885111 95.94402       6.223825 84.55350       9.147657 105.7613       8.492455 83.06755 4.536216 93.00449 3.754801 -9.936943      5.888615 
1 1 1 -16 12 13 o 151.0888 3.071308 278.5016       11.30816 281.7107       17.03656 275.9742       15.11892 151.7654 4.611873 150.2673 4.132689 1.498108       6.192616 
1 1 1 -16 12 14 o 170.1714 3.250564 353.3691       13.47974 343.0966       19.77730 362.2812       18.42131 167.4568 4.851614 172.1420 4.394940 -4.685196      6.546271 
1 1 1 -16 12 15 o 120.3133 2.860346 176.5843       8.386261 181.2228       13.05478 173.3252       10.94272 121.7043 4.409058 119.0857 3.775536 2.618553       5.804693 
1 1 1 -16 12 16 o 111.0038 3.174090 150.4866       8.577229 154.9553       16.98392 148.9566       9.937617 112.2719 6.232156 110.3913 3.699348 1.880577       7.247409 
1 1 1 -16 12 17 o 96.89330 2.826693 114.6328       6.667208 127.1523       11.12995 107.6260       8.326470 101.8945 4.493406 93.81530 3.649053 8.079208       5.788462 
1 1 1 -16 12 18 o 67.52217 2.928377 55.73467       4.807017 61.07496       8.155835 52.89202       5.950426 70.50698 4.774960 65.70519 3.731654 4.801788       6.060156 
1 1 1 -16 12 19 o 236.0458 4.540831 681.3121       26.11967 653.8749       45.83088 694.5107       31.78720 230.1857 8.183429 238.1286 5.477781 -7.942841      9.847568 
1 1 1 -16 12 20 o 60.83587 3.079230 45.28729       4.550125 51.75230       7.950688 42.13863       5.548601 64.82560 5.073329 58.59793 3.907999 6.227673       6.403993 
1 1 1 -16 12 21 o 150.4448 3.120237 276.2902       11.43934 266.6305       16.92949 284.4060       15.51786 147.5420 4.714655 152.4696 4.180445 -4.927551      6.301118 
1 1 1 -16 12 22 o 28.53207 5.037926 10.26222       3.374809 15.04682       6.143441 8.194351       4.038775 34.28703 7.556674 25.34670 6.506210 8.940329       9.971664 
1 1 1 -16 12 23 o 154.4175 3.716137 291.4126       13.98378 287.9620       17.84906 296.8965       22.50150 153.2756 4.784521 155.3867 5.953409 -2.111115      7.637717 
1 1 1 -16 12 24 o 161.2708 3.235633 317.6822       12.71602 300.4807       18.55797 332.9061       17.45866 156.5246 4.871255 164.8689 4.349262 -8.344315      6.530330 
1 1 1 -16 12 25 o 58.48030 3.240800 41.90960       4.600407 37.47456       7.523521 44.55810       5.813970 54.94202 5.702098 60.22025 3.984214 -5.278229      6.956140 
1 1 1 -16 12 26 o 209.7751 4.369978 539.0323       22.33929 547.7704       28.19707 524.3018       36.61041 211.0782 5.486469 205.7890 7.312016 5.289154       9.141495 
1 1 1 -16 12 27 o 42.43287 4.022271 22.24489       4.109541 26.56871       6.936858 19.90681       5.101037 45.98654 6.360162 39.88847 5.385212 6.098072       8.333797 
1 1 1 -16 12 28 o 63.43214 3.223977 49.33216       4.967190 47.27191       7.933616 50.66045       6.370254 61.75536 5.323740 64.16201 4.095585 -2.406651      6.716846 
1 1 1 -16 12 29 o 80.32598 3.302148 79.09827       6.450030 81.35898       11.99464 78.17861       7.650293 80.87571 6.131702 79.75259 3.948660 1.123116       7.293126 
1 1 1 -16 12 30 o 98.97480 2.978325 119.9723       7.175272 118.5466       10.98740 121.0323       9.474577 98.03495 4.612082 99.22522 3.926086 -1.190269      6.056851 
1 1 1 -16 12 31 o 46.04804 3.852806 26.23133       4.283795 30.85835       7.205411 23.70176       5.327591 49.45265 6.108798 43.49477 5.124659 5.957874       7.973678 
1 1 1 -16 12 32 o 74.05070 3.570552 67.54997       6.424198 68.31859       14.05320 67.34692       7.223088 72.89788 8.044498 73.82920 4.030033 -0.9313202     8.997506 
1 1 1 -16 12 33 o 57.40241 3.396328 40.66435       4.729666 38.81749       7.391138 41.94504       6.154817 55.49651 5.539157 58.06117 4.382393 -2.564659      7.063118 
1 1 1 -16 12 34 o 16.22131 6.122339 2.515636       3.304663 4.937691       5.435657 1.095504       4.162214 21.39456 7.895885 15.89176 6.579998 5.502798       10.27820 
1 1 1 -16 12 35 o 89.89661 3.032440 99.67719       6.633603 104.3656       10.29585 96.34953       8.673940 91.25173 4.645327 87.96071 4.057543 3.291023       6.167878 
1 1 1 -16 12 36 o 23.39050 6.288740 7.299047       3.661637 6.772680       5.861991 7.635825       4.688922 23.33511 8.254376 23.93003 7.341461 -0.5949192     11.04680 
1 1 1 -16 12 37 o 22.63000 6.439754 6.906736       3.720566 6.740921       5.696762 7.030070       4.913129 22.96247 8.135828 22.98689 7.570296 -0.2441978E-01 11.11310 
1 1 1 -16 12 38 o 41.99669 6.909317 24.17360       6.825399 24.17360       6.825399 0.000000       0.000000 41.99669 6.909317 ?        ?        0.000000       6.909317 
1 1 1 -16 12 39 o 37.45292 5.889143 19.01116       5.197719 26.89492       9.081586 15.17066       6.338534 41.97106 9.138877 31.96787 8.121644 10.00319       12.22621 
1 1 1 -16 12 40 o 21.54073 6.721845 6.617514       3.911509 4.392919       5.836900 8.430886       5.269874 19.74484 7.934830 23.81233 7.840235 -4.067497      11.15486 
1 1 1 -16 12 41 o 85.88402 3.304825 93.65520       6.903759 91.08624       9.942764 96.04679       9.593388 82.64305 4.959840 85.34074 4.630301 -2.697685      6.785256 
1 1 1 -16 12 42 o 13.94637 6.315047 -0.7996025     4.613880 0.9883611      5.393818 -5.675969      8.907691 16.09900 7.086989 16.34306 7.828771 -0.2440529     10.56007 
1 1 1 -16 12 43 o 24.62069 7.415366 9.858981       4.813758 4.977471       8.177857 12.44714       5.954672 20.06224 8.782133 26.83533 8.280544 -6.773088      12.07035 
1 1 1 -16 12 44 o 18.07379 6.705003 4.910186       3.928708 6.171196       5.768388 3.819164       5.365526 19.66473 7.893141 17.51891 7.377615 2.145824       10.80421 
1 1 1 -16 12 45 o 26.50747 6.488282 11.23884       4.156682 6.308687       6.365029 14.90490       5.488710 19.42023 8.096972 29.28131 7.619882 -9.861084      11.11861 
1 1 1 -16 13 1  o 71.77440 2.625015 62.91232       4.583585 57.62125       7.735694 65.77496       5.689987 68.50893 4.661336 73.35244 3.190809 -4.843506      5.648833 
1 1 1 -16 13 2  o 213.3098 3.353505 555.2480       17.43195 585.6121       28.92886 537.9371       21.84295 218.7964 5.425690 209.8593 4.271170 8.937073       6.905144 
1 1 1 -16 13 3  o 189.2197 3.475566 436.9542       16.02611 451.4491       23.86545 425.0496       21.62805 192.0877 5.102921 186.4327 4.764477 5.654984       6.981407 
1 1 1 -16 13 4  o 131.2990 2.675097 210.2508       8.559278 209.7854       14.29684 210.5108       10.68593 130.9659 4.486290 131.3032 3.342366 -0.3372955     5.594481 
1 1 1 -16 13 5  o 159.9259 2.866333 311.9677       11.17073 332.1699       19.00498 301.3041       13.80770 164.8025 4.737163 157.1198 3.606239 7.682770       5.953627 
1 1 1 -16 13 6  o 349.5753 4.825569 1493.495       41.10791 1484.976       65.46159 1499.041       52.82180 347.7560 7.724598 349.8809 6.195221 -2.124969      9.902029 
1 1 1 -16 13 7  o 170.6302 3.856310 355.4358       16.03482 335.7468       31.42184 362.3684       18.64532 165.1569 7.829554 172.1742 4.447638 -7.017258      9.004632 
1 1 1 -16 13 8  o 265.0915 3.867465 857.9274       24.98378 840.6361       39.73093 869.2367       32.13153 261.9983 6.222919 266.6670 4.944541 -4.668701      7.948157 
1 1 1 -16 13 9  o 148.4575 2.768461 268.8138       10.01559 287.5409       17.18023 259.1727       12.32700 153.3358 4.603001 145.7286 3.471174 7.607254       5.765125 
1 1 1 -16 13 10 o 118.7110 2.576325 171.8602       7.452942 188.1437       13.15429 164.1618       9.044748 124.0288 4.358979 115.9494 3.204117 8.079330       5.409904 
1 1 1 -16 13 11 o 238.1243 3.574098 692.1077       20.73989 716.5735       34.27782 677.9786       26.04906 241.9487 5.813716 235.5551 4.537989 6.393509       7.375137 
1 1 1 -16 13 12 o 97.76999 2.908618 116.7128       6.922217 123.5066       10.63060 111.7116       9.120894 100.4519 4.353070 95.56767 3.924781 4.884193       5.861155 
1 1 1 -16 13 13 o 161.5660 2.858769 318.4340       11.25551 321.0162       18.71223 316.9700       14.08932 161.9832 4.745565 161.1395 3.587995 0.8436890      5.949295 
1 1 1 -16 13 14 o 185.1273 3.870091 418.5181       17.45934 412.0367       31.48157 421.3970       20.98165 183.0798 7.069631 185.6730 4.637188 -2.593201      8.454774 
1 1 1 -16 13 15 o 151.4838 3.507009 280.1310       12.94611 278.1540       24.09601 280.9332       15.34974 150.4476 6.588369 151.5858 4.159270 -1.138123      7.791415 
1 1 1 -16 13 16 o 92.85598 2.839703 105.2904       6.418125 95.74948       10.07243 111.8121       8.327645 88.36871 4.694191 95.63036 3.579791 -7.261658      5.903417 
1 1 1 -16 13 17 o 211.2492 3.693143 544.9828       19.01198 568.5915       28.51262 526.0831       25.51108 215.4241 5.435678 207.3496 5.048816 8.074478       7.418702 
1 1 1 -16 13 18 o 95.78216 2.873314 112.0435       6.699038 128.6297       11.31999 103.1040       8.310499 102.4633 4.544894 91.80340 3.722493 10.65987       5.874778 
1 1 1 -16 13 19 o 112.4565 2.902439 154.4278       7.947316 160.8620       12.63364 150.2143       10.22351 114.5991 4.532822 110.8245 3.791123 3.774612       5.909238 
1 1 1 -16 13 20 o 97.59020 2.907218 116.3316       6.906140 109.9136       10.88505 120.6558       8.934728 94.66003 4.733779 99.31387 3.698236 -4.653831      6.007130 
1 1 1 -16 13 21 o 92.26380 2.928693 104.0058       6.576439 94.60462       10.45831 110.1545       8.457926 87.76648 4.909432 94.88278 3.664863 -7.116302      6.126479 
1 1 1 -16 13 22 o 93.90192 2.923168 107.7390       6.680902 108.8170       10.62028 107.0331       8.594474 94.17150 4.642169 93.50546 3.779567 0.6660385      5.986223 
1 1 1 -16 13 23 o 168.1184 3.851322 345.5661       15.77834 341.2253       19.96312 352.7913       25.75533 166.8078 4.916432 169.2794 6.254234 -2.471603      7.955297 
1 1 1 -16 13 24 o 106.2538 2.922250 137.9605       7.559368 125.0152       11.39636 148.1312       10.10151 100.9134 4.646740 109.9993 3.774016 -9.085915      5.986267 
1 1 1 -16 13 25 o 100.5800 3.580622 123.8445       8.762196 143.1774       11.83521 100.3942       13.03468 108.0126 4.506304 90.14733 5.967087 17.86527       7.477493 
1 1 1 -16 13 26 o 163.9046 3.326329 328.4257       13.28595 331.3201       19.83262 326.0693       17.89478 164.2175 4.961613 163.0274 4.508655 1.190155       6.704146 
1 1 1 -16 13 27 o 74.67722 3.088400 68.28478       5.608149 79.11755       9.273135 62.03787       7.041898 80.13282 4.770348 71.03835 4.085037 9.094475       6.280426 
1 1 1 -16 13 28 o 138.0165 3.102679 232.9592       10.43528 241.7295       16.01379 226.4864       13.75731 140.1797 4.694464 135.8224 4.161390 4.357269       6.273369 
1 1 1 -16 13 29 o 61.35316 3.558114 46.27702       5.296946 47.22439       9.817655 45.88800       6.291174 61.30630 6.679418 60.97621 4.260655 0.3300972      7.922614 
1 1 1 -16 13 30 o 64.16183 3.497053 50.62986       5.447161 59.52396       10.57519 47.41792       6.355065 68.88732 6.371782 61.95097 4.235021 6.936348       7.650818 
1 1 1 -16 13 31 o 31.63411 5.641765 12.79079       4.189636 25.27989       10.91473 10.63264       4.537210 43.26772 10.46679 28.59418 6.639186 14.67354       12.39485 
1 1 1 -16 13 32 o 24.05185 6.092986 7.520068       3.574707 6.467138       6.078874 8.076650       4.419648 23.71375 8.404040 24.92409 6.993500 -1.210339      10.93329 
1 1 1 -16 13 33 o 64.85104 3.720537 52.05122       5.855071 51.55353       8.019006 52.61951       8.568969 64.07733 5.179578 64.62267 5.493379 -0.5453339     7.550181 
1 1 1 -16 13 34 o 41.51997 4.076614 21.58182       4.071585 23.00128       6.537482 20.68233       5.204127 42.01992 6.601831 40.21976 5.449820 1.800159       8.560649 
1 1 1 -16 13 35 o 46.25745 3.844423 26.75858       4.294470 19.57121       6.513015 32.28694       5.712093 38.23448 7.255560 50.53960 4.691525 -12.30512      8.640229 
1 1 1 -16 13 36 o 48.92839 3.797021 30.01699       4.491897 34.28225       6.945941 26.95094       5.889084 51.47886 5.628510 45.69534 5.392322 5.783520       7.794694 
1 1 1 -16 13 37 o 42.32738 4.246676 22.81222       4.321219 21.02330       6.846419 23.99676       5.571103 38.94638 7.485631 42.84442 5.459803 -3.898033      9.265210 
1 1 1 -16 13 38 o 38.57066 5.855123 19.95331       5.330683 20.43828       6.699241 19.11625       8.801273 37.99125 7.502437 34.95147 9.890729 3.039780       12.41423 
1 1 1 -16 13 39 o 15.13359 6.226724 1.635940       3.695889 5.646992       5.491908 -1.684333      4.996673 20.92486 7.893632 14.33889 6.523884 6.585971       10.24063 
1 1 1 -16 13 40 o 22.78053 6.747152 7.535697       4.011034 7.812491       5.539970 7.230745       5.814929 22.95366 8.032228 22.35614 8.180799 0.5975189      11.46482 
1 1 1 -16 13 41 o 24.53953 7.526103 9.299792       4.928228 19.36766       6.304258 -6.520534      7.902653 35.73121 7.480512 15.29533 7.339294 20.43589       10.47966 
1 1 1 -16 13 42 o 15.62481 6.913222 0.7708501      5.194736 4.248232       7.608305 -2.265880      7.109922 19.73635 8.557227 15.87751 7.419059 3.858834       11.32557 
1 1 1 -16 13 43 o 23.83068 6.890872 9.036037       4.227506 4.329313       6.097743 13.39206       5.866172 18.55559 7.842207 27.81546 8.138804 -9.259872      11.30223 
1 1 1 -16 13 44 o 10.99614 5.197361 -2.630624      3.668577 -5.630559      5.564627 -0.3243821     4.879019 12.29261 5.962072 14.04272 6.411250 -1.750113      8.755024 
1 1 1 -16 13 45 o 23.80763 6.859352 9.506145       4.195983 -0.7188745     6.442863 17.03722       5.529367 15.06638 7.047354 31.74718 7.299825 -16.68079      10.14656 
1 1 1 -16 14 1  o 83.33708 2.783284 84.81216       5.644457 84.38056       11.04108 84.96487       6.567537 82.85473 5.499501 83.37910 3.238439 -0.5243759     6.382163 
1 1 1 -16 14 2  o 69.81272 2.638787 59.52876       4.481182 56.26317       7.811084 61.13084       5.471069 67.67684 4.766747 70.70892 3.183296 -3.032074      5.731950 
1 1 1 -16 14 3  o 332.0070 4.638129 1347.154       37.52547 1401.030       61.48973 1315.182       47.36917 337.7665 7.470504 327.7284 5.931242 10.03815       9.538766 
1 1 1 -16 14 4  o 54.84285 2.840351 36.78694       3.783083 36.45506       7.062880 36.92046       4.479918 54.32282 5.407078 54.90072 3.364705 -0.5778961     6.368495 
1 1 1 -16 14 5  o 157.4773 3.200215 302.5926       12.28098 317.0720       18.97219 292.1497       16.11207 160.9819 4.841702 154.5908 4.281047 6.391144       6.462929 
1 1 1 -16 14 6  o 132.9902 2.716751 215.7193       8.804523 199.3753       14.57612 225.1083       11.04769 127.6383 4.694239 135.8183 3.337930 -8.179947      5.760005 
1 1 1 -16 14 7  o 113.9089 2.911831 158.3851       8.076137 173.3195       19.72023 155.3755       8.852558 118.6882 6.847242 112.7974 3.223885 5.890877       7.568233 
1 1 1 -16 14 8  o 45.99928 3.089342 25.93182       3.442925 30.91523       6.798335 24.21280       3.992828 49.94036 5.687407 44.37955 3.726381 5.560802       6.799450 
1 1 1 -16 14 9  o 90.08727 2.539344 99.05453       5.569134 98.85959       9.754945 99.14878       6.783213 89.83789 4.469874 90.09295 3.094237 -0.2550583     5.436367 
1 1 1 -16 14 10 o 126.7740 2.640852 196.0211       8.158501 205.8738       14.14696 191.1114       9.986431 129.7219 4.481947 125.0995 3.278634 4.622314       5.553133 
1 1 1 -16 14 11 o 157.9646 2.859076 304.3998       11.00579 302.0803       18.29741 305.7147       13.77658 157.1207 4.784388 158.2523 3.572361 -1.131607      5.970940 
1 1 1 -16 14 12 o 164.4899 4.554900 330.9458       18.24046 353.9711       27.47890 312.8082       24.38853 169.7554 6.655521 159.6362 6.281547 10.11917       9.151711 
1 1 1 -16 14 13 o 140.6961 3.401592 241.6239       11.66273 248.5294       21.89291 238.8876       13.78095 142.2442 6.331735 139.7873 4.049798 2.456833       7.516098 
1 1 1 -16 14 14 o 146.8868 3.111199 263.2901       11.13644 267.6970       17.09555 260.0414       14.67805 147.8856 4.749905 145.8345 4.134379 2.051025       6.297197 
1 1 1 -16 14 15 o 81.31029 2.890536 80.76692       5.718322 88.08891       9.604100 76.74567       7.117419 84.74979 4.668344 79.19019 3.698421 5.559608       5.955817 
1 1 1 -16 14 16 o 166.6404 3.267799 338.9623       13.27002 336.3701       19.79556 341.0778       17.88311 165.7427 4.906545 166.9799 4.398668 -1.237198      6.589572 
1 1 1 -16 14 17 o 91.27427 2.909412 101.7624       6.463007 94.45055       10.33707 106.4550       8.281198 87.72990 4.854113 93.29166 3.649664 -5.561760      6.073092 
1 1 1 -16 14 18 o 31.25092 5.142469 12.26721       3.780152 20.30279       9.586478 10.78772       4.113454 39.69812 9.934354 29.13338 5.994091 10.56473       11.60261 
1 1 1 -16 14 19 o 108.4405 2.906990 143.6151       7.675014 154.6193       12.37606 136.7383       9.783526 112.3391 4.530093 105.7217 3.803675 6.617363       5.915208 
1 1 1 -16 14 20 o 151.5658 3.181942 280.4779       11.75248 263.0863       17.37147 295.1567       15.95924 146.5103 4.872330 155.3040 4.220815 -8.793671      6.446307 
1 1 1 -16 14 21 o 85.50294 2.962869 89.35219       6.164145 91.53242       10.04989 88.03732       7.804615 86.32873 4.796012 84.78785 3.786858 1.540878       6.110812 
1 1 1 -16 14 22 o 144.8404 3.125940 256.1905       11.03333 259.1209       16.79542 253.9657       14.63391 145.3770 4.747247 144.0238 4.173962 1.353149       6.321259 
1 1 1 -16 14 23 o 159.2426 3.791846 310.0843       14.71452 289.4947       18.32143 347.4970       24.69699 153.6043 4.900902 168.0087 6.042044 -14.40437      7.779790 
1 1 1 -16 14 24 o 137.4261 3.666800 231.1007       12.26887 246.0529       15.95357 209.4577       19.19392 141.6281 4.628670 130.3409 6.059505 11.28720       7.625103 
1 1 1 -16 14 25 o 171.0124 3.970942 357.9849       16.54845 360.0942       20.92204 354.4602       27.04566 171.2082 5.020104 169.3721 6.565122 1.836044       8.264518 
1 1 1 -16 14 26 o 49.72213 3.657625 30.41780       4.400834 29.35500       7.569408 30.96050       5.408956 48.31063 6.602139 50.04612 4.482557 -1.735485      7.980073 
1 1 1 -16 14 27 o 28.67685 5.420336 10.45336       3.649106 10.35519       6.353020 10.50169       4.457836 28.55755 8.499778 28.57644 6.542843 -0.1889038E-01 10.72637 
1 1 1 -16 14 28 o 89.34600 3.011109 97.75067       6.546613 99.09459       10.33140 96.84901       8.462416 89.63054 4.746994 88.77912 3.921210 0.8514175      6.157097 
1 1 1 -16 14 29 o 47.74879 4.019959 28.19612       4.634167 21.27122       8.957842 30.72669       5.415104 40.16653 9.330518 49.76788 4.514049 -9.601353      10.36510 
1 1 1 -16 14 30 o 27.11191 6.183044 9.509701       3.994229 7.622186       9.949899 9.872306       4.361046 27.78407 10.59156 27.57804 6.581102 0.2060356      12.46965 
1 1 1 -16 14 31 o 36.06519 5.243818 16.46967       4.473713 25.64871       12.22517 15.05041       4.807150 43.15114 11.44138 34.25759 5.975495 8.893547       12.90781 
1 1 1 -16 14 32 o 68.54328 3.188744 57.85289       5.311642 59.67995       8.526171 56.69404       6.790322 69.06236 5.102159 67.60830 4.141361 1.454063       6.571369 
1 1 1 -16 14 33 o 68.37586 3.690791 57.91315       6.126969 53.48781       8.256381 63.33713       9.140617 65.16014 5.243867 70.90135 5.329362 -5.741211      7.476647 
1 1 1 -16 14 34 o 40.19827 4.252265 20.33203       4.102395 27.65108       6.679258 15.89846       5.198492 46.26675 6.070402 34.79836 6.364783 11.46839       8.795467 
1 1 1 -16 14 35 o 19.24188 6.340613 4.653013       3.446453 2.218323       5.383526 6.343777       4.486280 18.40565 7.537642 22.14584 7.230665 -3.740194      10.44503 
1 1 1 -16 14 36 o 49.16819 3.820374 30.39751       4.541581 31.24473       7.133570 29.82005       5.889334 48.70266 6.147286 48.12480 5.099318 0.5778580      7.987000 
1 1 1 -16 14 37 o 19.38314 6.566026 4.838999       3.692024 6.377442       5.913157 3.856051       4.726547 22.41606 8.241872 18.93884 7.279879 3.477224       10.99659 
1 1 1 -16 14 38 o 25.81106 8.110379 9.769428       5.684376 9.653792       7.742471 9.904640       8.372259 25.72278 9.435415 26.04601 9.763138 -0.3232327     13.57740 
1 1 1 -16 14 39 f 20.76133 6.662344 6.059194       3.818692 4.008792       5.698223 7.730755       5.144951 19.34848 7.817218 23.01652 7.751147 -3.668034      11.00860 
1 1 1 -16 14 40 o 15.56258 6.746726 0.8929654      4.728205 3.862373       5.950696 -4.192021      7.787137 19.13963 7.890688 16.21154 7.634854 2.928083       10.97971 
1 1 1 -16 14 41 f 32.92881 6.928047 16.20745       5.382955 14.65042       6.818454 18.78333       8.770013 29.43144 8.816572 31.87629 10.08166 -2.444849      13.39298 
1 1 1 -16 14 42 o 50.99712 5.878150 37.31247       7.171540 27.76465       10.12848 46.91178       10.15575 37.32809 10.62614 54.14169 7.932665 -16.81360      13.26054 
1 1 1 -16 14 43 o 33.04137 5.862197 16.13094       4.547288 20.48059       6.866104 12.73252       6.069073 34.33352 8.299141 26.50517 8.387223 7.828346       11.79921 
1 1 1 -16 14 44 o 14.28596 6.194829 1.415307       3.988317 -1.888385      6.005277 4.022422       5.334741 14.29383 6.723307 17.45581 7.354035 -3.161979      9.964170 
1 1 1 -16 15 1  o 167.5241 3.253851 342.5155       13.28345 350.7789       26.34599 339.6989       15.38164 169.0115 6.408400 166.7851 3.784507 2.226349       7.442451 
1 1 1 -16 15 2  o 77.16897 2.641470 72.72169       4.960023 77.66356       8.866389 70.47068       5.983968 79.57726 4.591660 75.92016 3.241881 3.657104       5.620777 
1 1 1 -16 15 3  o 44.07952 3.128154 23.82833       3.338338 35.35329       6.837951 20.22179       3.825177 53.49129 5.316018 40.50312 3.924617 12.98817       6.607773 
1 1 1 -16 15 4  o 140.8313 3.008370 241.9880       10.32444 218.0340       19.83136 250.8943       12.09244 133.2578 6.123312 143.3681 3.461188 -10.11037      7.033830 
1 1 1 -16 15 5  f 168.5678 2.983547 346.6816       12.25585 344.3334       20.27831 348.0329       15.38338 167.7266 4.966750 168.8322 3.739042 -1.105576      6.216835 
1 1 1 -16 15 6  o 155.1533 2.870827 293.6699       10.85436 308.4169       18.39069 285.7867       13.44609 158.7611 4.758921 153.0026 3.606292 5.758438       5.970985 
1 1 1 -16 15 7  o 158.1898 3.711045 305.5286       14.30575 254.0362       25.86089 328.2336       17.17251 143.6199 7.414220 163.8484 4.304589 -20.22855      8.573222 
1 1 1 -16 15 8  o 215.0720 3.375433 564.5641       17.69088 580.0692       29.22884 555.6004       22.22383 217.6275 5.515843 213.2480 4.276591 4.379440       6.979524 
1 1 1 -16 15 9  o 135.2758 2.720788 223.2187       8.969140 225.6512       15.16890 221.9111       11.12158 135.7943 4.590512 134.7952 3.388444 0.9990997      5.705643 
1 1 1 -16 15 10 o 96.10435 3.129054 112.8237       7.318345 109.6767       13.67949 114.0856       8.662191 94.43208 5.975125 96.59334 3.686739 -2.161255      7.020981 
1 1 1 -16 15 11 o 110.9867 4.138727 150.6969       11.17410 139.5947       16.11638 160.9745       15.50639 106.5351 6.235070 114.5308 5.572600 -7.995674      8.362414 
1 1 1 -16 15 12 f 131.8712 3.352953 212.4028       10.76617 214.2467       20.19677 211.6709       12.72484 132.0409 6.294912 131.5792 3.973075 0.4617462      7.443873 
1 1 1 -16 15 13 o 99.25258 2.589077 120.2424       6.256794 124.0870       11.07163 118.4384       7.583910 100.6478 4.525680 98.46155 3.164863 2.186203       5.522512 
1 1 1 -16 15 14 o 73.15183 2.991793 65.40809       5.322008 62.34605       8.717921 67.22712       6.719356 71.20226 5.057302 74.09948 3.733169 -2.897217      6.285925 
1 1 1 -16 15 15 o 136.1942 2.725062 226.2983       9.044219 225.0948       15.35992 226.9370       11.18968 135.5857 4.655686 136.3401 3.367890 -0.7543945     5.746138 
1 1 1 -16 15 16 o 150.8275 3.155393 277.6774       11.59765 263.7183       17.19672 289.3233       15.70739 146.7361 4.815720 153.7963 4.194959 -7.060196      6.386614 
1 1 1 -16 15 17 o 239.9825 4.060428 703.8660       23.74584 694.1821       34.44289 712.6385       32.78201 237.9130 5.940806 241.1476 5.578487 -3.234650      8.149399 
1 1 1 -16 15 18 o 78.26173 3.346351 74.92658       6.367271 86.75208       14.10531 71.90021       7.135662 83.70252 6.978691 76.61346 3.834207 7.089066       7.962617 
1 1 1 -16 15 19 o 275.2195 4.488695 926.7214       30.10477 979.7709       45.16861 884.3206       40.38161 282.3286 6.565168 268.3590 6.174920 13.96951       9.012828 
1 1 1 -16 15 20 o 154.2583 3.217194 290.5863       12.09378 306.2437       18.79616 279.5253       15.79821 158.0549 4.885928 151.1018 4.294803 6.953094       6.505200 
1 1 1 -16 15 21 o 196.0576 3.599094 469.7546       17.19543 473.0349       25.54310 467.0359       23.25381 196.3173 5.344207 195.1825 4.892824 1.134796       7.245708 
1 1 1 -16 15 22 o 74.26838 3.576354 67.57528       6.453603 76.53460       9.313778 59.30105       8.950598 78.87518 4.869360 69.31724 5.339897 9.557945       7.226699 
1 1 1 -16 15 23 o 166.0757 3.948403 337.4453       15.97951 346.9783       20.40495 322.3277       25.69584 168.1280 4.985855 161.6090 6.538206 6.518921       8.222341 
1 1 1 -16 15 24 o 110.3595 3.631573 149.1212       9.753237 148.6387       12.58086 149.8480       15.44059 109.9999 4.704204 110.2231 5.768587 -0.2231903     7.443529 
1 1 1 -16 15 25 o 116.5460 3.022540 166.1014       8.577069 176.9515       13.70860 159.1218       10.99501 119.9923 4.697249 113.9198 3.966645 6.072456       6.148042 
1 1 1 -16 15 26 o 175.5168 3.418785 376.9438       14.62267 387.4935       22.12205 368.7578       19.48686 177.4200 5.122025 173.2393 4.620054 4.180603       6.897829 
1 1 1 -16 15 27 o 46.98816 3.840312 27.24214       4.359027 21.64172       7.159466 30.54110       5.494893 41.09072 7.423035 49.64391 4.594210 -8.553196      8.729733 
1 1 1 -16 15 28 o 100.5817 3.016564 123.9112       7.385447 125.1391       11.76524 123.1127       9.487649 100.6779 4.809370 100.0828 3.897573 0.5951080      6.190404 
1 1 1 -16 15 29 o 57.67054 3.433789 40.93292       4.803889 36.36249       8.185136 43.33446       5.933243 53.66981 6.383262 59.21340 4.137879 -5.543591      7.607107 
1 1 1 -16 15 30 o 76.45303 3.525756 71.95652       6.551068 58.68171       14.28452 75.49220       7.372049 67.13751 8.954053 78.22924 3.879178 -11.09173      9.758232 
1 1 1 -16 15 31 o 81.65946 3.080158 81.96637       6.118380 73.24957       9.742698 87.64275       7.862056 76.54358 5.255058 84.24209 3.839851 -7.698509      6.508463 
1 1 1 -16 15 32 o 55.83556 3.497341 38.56970       4.734764 52.43394       8.181450 31.58809       5.805774 64.57101 5.244553 50.15749 4.808773 14.41352       7.115450 
1 1 1 -16 15 33 o 12.35354 5.571094 -1.621891      3.548177 -10.41054      7.160874 1.238006       4.084887 14.16909 6.845936 15.86719 6.539204 -1.698102      9.467208 
1 1 1 -16 15 34 o 39.70830 4.267986 19.89697       4.065153 19.14577       6.534631 20.37122       5.192146 37.73186 7.371298 39.74512 5.508679 -2.013260      9.202260 
1 1 1 -16 15 35 o 36.26061 4.782241 16.87410       4.122825 14.61635       6.501077 18.39298       5.332234 32.28121 8.237963 37.34360 6.067533 -5.062389      10.23127 
1 1 1 -16 15 36 o 38.05615 4.608879 18.62492       4.187225 26.38671       6.897997 14.09618       5.269030 44.29730 6.590569 31.99044 6.957448 12.30686       9.583406 
1 1 1 -16 15 37 o 26.46879 7.259991 9.959900       4.822765 7.996354       5.915732 13.85109       8.327780 23.95605 8.305314 29.93562 9.855815 -5.979563      12.88857 
1 1 1 -16 15 38 o 11.38240 5.382494 -3.746736      3.943368 5.565229       7.096450 -7.906597      4.743073 21.73845 8.744586 10.90680 5.336986 10.83165       10.24457 
1 1 1 -16 15 39 o 20.65766 7.429740 5.912056       4.768670 6.351804       5.932991 5.109503       8.015100 21.53307 8.185867 21.51940 9.036947 0.1366615E-01  12.19323 
1 1 1 -16 15 40 o 32.57723 5.543502 14.72952       4.243351 21.98355       6.439537 9.162283       5.641371 38.53798 7.119112 24.14728 8.116391 14.39070       10.79618 
1 1 1 -16 15 41 o 8.069526 4.068728 -10.81287      3.731011 -14.70547      5.501731 -7.498425      5.076747 9.872221 4.972984 11.28969 5.523750 -1.417473      7.432522 
1 1 1 -16 15 42 f 14.59075 6.707289 -0.9702451     5.464039 10.57074       8.454812 -9.247446      7.160185 23.61492 9.528844 13.16638 6.466142 10.44853       11.51564 
1 1 1 -16 15 43 o 41.40593 4.768261 23.90628       4.723511 23.86340       7.185406 23.93891       6.268236 37.20021 8.151939 39.03783 6.838130 -1.837624      10.64021 
1 1 1 -16 15 44 o 40.53486 4.931727 23.41228       4.771377 24.31023       7.705834 22.85395       6.076320 35.79815 8.877176 37.66974 6.872444 -1.871597      11.22652 
1 1 1 -16 16 1  o 165.9928 3.244965 336.3175       13.12609 350.4148       26.33386 331.6571       15.14108 168.8862 6.410225 164.7879 3.770469 4.098312       7.436896 
1 1 1 -16 16 2  o 53.79790 3.066073 35.43305       4.002966 48.02853       8.901041 32.23983       4.481751 62.32696 5.931858 51.25793 3.611094 11.06902       6.944562 
1 1 1 -16 16 3  o 67.11495 2.885239 55.05905       4.707839 48.79358       9.795966 56.94078       5.368450 62.73837 6.501467 68.22665 3.238173 -5.488281      7.263253 
1 1 1 -16 16 4  o 75.01149 2.711713 68.72877       4.948714 62.07476       8.713277 71.89716       6.012563 71.05219 5.065542 76.68482 3.224663 -5.632629      6.004845 
1 1 1 -16 16 5  o 49.60775 3.077020 30.14525       3.701458 36.02975       7.333466 28.13366       4.287695 53.94933 5.662398 47.85724 3.705391 6.092091       6.767028 
1 1 1 -16 16 6  o 131.7041 2.974633 211.6485       9.547041 223.0988       20.04752 208.2900       10.85723 134.7778 6.119850 130.5815 3.414870 4.196381       7.008131 
1 1 1 -16 16 7  o 119.5610 3.871922 174.7722       11.26625 0.000000       0.000000 174.7722       11.26625 ?        ?        119.5610 3.871922 0.000000       3.871922 
1 1 1 -16 16 8  o 128.2304 3.322279 200.8370       10.37283 216.2093       19.56927 194.8303       12.23266 132.6829 6.068412 126.2297 3.981686 6.453217       7.258061 
1 1 1 -16 16 9  o 66.52644 3.328090 54.15617       5.378289 50.87124       10.73783 55.25626       6.213934 63.99069 7.000014 67.15627 3.812693 -3.165581      7.970999 
1 1 1 -16 16 10 o 129.2398 3.006865 203.8162       9.469917 206.9138       14.54749 201.5383       12.47507 130.0096 4.598977 128.3819 3.992375 1.627686       6.090127 
1 1 1 -16 16 11 o 50.84267 3.708596 31.73519       4.563278 24.16279       6.830933 37.83794       6.132342 43.89838 6.588691 55.44295 4.579639 -11.54457      8.023960 
1 1 1 -16 16 12 o 88.76600 2.611531 96.20039       5.642940 101.1352       10.14392 93.98893       6.790628 90.82813 4.597949 87.69555 3.182858 3.132584       5.592113 
1 1 1 -16 16 13 o 128.1899 2.700871 200.4768       8.437114 217.9230       14.95164 192.3260       10.21969 133.4117 4.605859 125.4703 3.345404 7.941490       5.692597 
1 1 1 -16 16 14 o 73.34274 2.753132 65.72282       4.911890 59.24122       9.010081 68.46368       5.859099 69.34521 5.373734 74.82141 3.220974 -5.476204      6.265117 
1 1 1 -16 16 15 o 86.47401 2.644557 91.31432       5.566267 91.63194       9.982224 91.17101       6.705556 86.41143 4.758828 86.36247 3.191695 0.4895782E-01  5.730041 
1 1 1 -16 16 16 o 170.9246 3.356378 356.7314       13.98014 346.2163       20.67875 365.5832       18.97300 168.0850 5.054204 172.8261 4.508808 -4.741043      6.773059 
1 1 1 -16 16 17 o 205.4826 3.701041 515.8671       18.53255 514.1116       27.38712 517.3500       25.17088 204.7259 5.494528 205.5423 5.025289 -0.8164825     7.446030 
1 1 1 -16 16 18 o 200.4410 4.160318 491.2895       20.32119 504.5760       38.25881 486.0680       23.98411 202.0866 7.783422 199.2267 4.940147 2.859833       9.218824 
1 1 1 -16 16 19 o 60.70268 3.362121 45.14590       4.954017 49.71311       8.536218 42.82640       6.083287 63.41866 5.580325 59.01698 4.258489 4.401680       7.019598 
1 1 1 -16 16 20 o 248.2195 4.178379 753.7861       25.27434 786.6382       37.78734 727.1915       33.99871 252.9788 6.129515 243.3650 5.732819 9.613800       8.392625 
1 1 1 -16 16 21 o 116.9960 3.036620 167.2770       8.650279 169.6095       13.65345 165.7129       11.18050 117.5543 4.776097 116.3281 3.949762 1.226204       6.197719 
1 1 1 -16 16 22 o 148.8779 4.864396 272.0388       17.62430 272.0388       17.62430 0.000000       0.000000 148.8779 4.864396 ?        ?        0.000000       4.864396 
1 1 1 -16 16 23 o 72.40598 3.995843 64.36486       7.023147 63.83553       9.294719 65.06924       10.72193 71.89297 5.343555 72.43575 6.131677 -0.5427856     8.133328 
1 1 1 -16 16 24 o 14.57633 5.964074 0.9312761      3.366626 1.403000       6.272435 0.7403891      3.990067 19.53104 8.081357 15.48611 6.429957 4.044926       10.32728 
1 1 1 -16 16 25 o 27.14529 5.843069 9.428878       3.750658 9.511654       7.014443 9.395736       4.438445 27.89056 9.036652 27.02758 6.757446 0.8629799      11.28380 
1 1 1 -16 16 26 o 61.11220 3.276372 45.83157       4.861460 51.50881       8.306887 42.87427       5.995396 64.43665 5.338022 58.96378 4.199999 5.472878       6.792236 
1 1 1 -16 16 27 o 19.83600 6.288059 4.812498       3.409952 8.085796       6.650136 3.644853       3.971852 26.06641 8.812327 18.70548 6.773605 7.360929       11.11480 
1 1 1 -16 16 28 o 57.04964 3.706196 40.11406       5.124605 42.56676       10.53664 39.35412       5.865014 57.74048 7.678503 56.39282 4.300281 1.347660       8.800672 
1 1 1 -16 16 29 o 56.78249 3.836051 39.83005       5.276894 34.25872       11.84606 41.20925       5.893969 50.70551 9.942489 57.67941 4.222508 -6.973900      10.80197 
1 1 1 -16 16 30 o 19.41964 6.283958 4.617920       3.392564 4.088557       6.270734 4.836983       4.033904 21.53353 8.356188 20.21606 6.863153 1.317469       10.81336 
1 1 1 -16 16 31 f 92.77686 3.084375 105.8798       6.963679 90.58567       10.68470 117.1735       9.181581 85.06813 5.178714 97.34082 3.878436 -12.27269      6.470035 
1 1 1 -16 16 32 o 92.57945 3.588749 106.0171       8.081100 115.1577       11.22704 96.18995       11.64100 95.92611 4.818203 87.29879 5.499951 8.627319       7.311946 
1 1 1 -16 16 33 o 35.05803 4.861723 15.69037       4.041856 16.48483       6.790381 15.25444       5.029978 34.71328 8.164867 34.06487 6.291003 0.6484108      10.30737 
1 1 1 -16 16 34 o 16.34392 6.288357 2.505139       3.529037 1.404926       5.962360 3.098418       4.378339 18.41045 7.766409 18.06485 6.989974 0.3456059      10.44877 
1 1 1 -16 16 35 o 10.28026 4.889921 -3.902151      3.348720 -4.943209      5.418713 -3.258884      4.259459 13.52180 6.368339 12.45678 5.794474 1.065021       8.609975 
1 1 1 -16 16 36 o 41.87519 4.375981 22.48421       4.399642 33.13923       7.175969 16.06659       5.569171 49.90297 6.022545 34.05481 6.946443 15.84816       9.193700 
1 1 1 -16 16 37 o 25.66084 7.498608 9.533061       4.982428 7.067542       6.127190 14.34562       8.560424 22.82527 8.390150 29.97622 9.996943 -7.150949      13.05119 
1 1 1 -16 16 38 o 16.17738 6.863238 1.476084       4.700171 2.182977       5.961249 0.3145709      7.641387 18.08316 7.702625 18.46621 8.263813 -0.3830528     11.29695 
1 1 1 -16 16 39 o 42.33443 4.419493 23.57376       4.492268 20.98536       6.623553 25.77862       6.113150 37.47653 7.514431 43.03707 5.991093 -5.560535      9.610404 
1 1 1 -16 16 40 o 22.90539 6.862773 7.908682       4.131025 13.38127       6.295050 3.769399       5.474764 28.46730 8.457954 18.42423 7.579350 10.04307       11.35709 
1 1 1 -16 16 41 o 14.31470 6.528687 -0.8298426     5.042627 -0.4145811     7.486471 -1.174702      6.822404 16.94564 7.811986 16.00654 7.406809 0.9391041      10.76513 
1 1 1 -16 16 42 o 17.83193 6.746946 4.606610       4.019093 8.253388       6.418493 2.254474       5.154775 21.71743 8.446661 16.26753 7.048443 5.449902       11.00121 
1 1 1 -16 16 43 o 12.08364 5.537875 -0.9438974     3.686284 -1.743120      5.604803 -0.3346235     4.893649 14.00124 6.556866 14.02251 6.409181 -0.2126884E-01 9.168974 
1 1 1 -16 16 44 o 14.44091 6.456477 0.9397343      4.652948 -5.516478      6.217980 9.155435       7.014274 12.89892 6.266860 21.43085 8.667862 -8.531923      10.69604 
1 1 1 -16 17 1  o 102.8399 3.164675 129.2167       7.921539 106.6692       13.47135 141.1337       9.793701 93.08041 5.970531 107.4245 3.746906 -14.34411      7.048869 
1 1 1 -16 17 2  o 126.5262 3.317273 195.5716       10.21934 195.2543       18.22450 195.7171       12.34239 126.0586 5.949416 126.4971 4.008958 -0.4384842     7.174071 
1 1 1 -16 17 3  o 145.8852 3.501867 259.8688       12.44936 257.5748       22.02975 260.9451       15.08992 144.7698 6.259259 146.0532 4.244249 -1.283340      7.562538 
1 1 1 -16 17 4  o 174.6647 3.802652 372.6449       16.18556 366.8576       28.46148 375.4111       19.67714 172.7083 6.775660 175.1492 4.614198 -2.440857      8.197584 
1 1 1 -16 17 5  o 143.6865 3.476062 252.0771       12.17137 243.5421       21.61660 256.0391       14.72786 140.7608 6.317976 144.6848 4.181541 -3.924072      7.576418 
1 1 1 -16 17 6  o 77.36193 3.427069 73.21074       6.444765 82.99481       16.35450 71.41207       7.012177 81.64094 8.337323 76.37091 3.779550 5.270027       9.154013 
1 1 1 -16 17 7  o 229.5600 3.559848 643.4832       19.91424 660.0602       32.83094 633.8337       25.04840 232.0100 5.811421 227.6829 4.514541 4.327164       7.358919 
1 1 1 -16 17 8  o 119.7685 2.702678 174.9988       7.888111 198.0667       14.09270 164.4744       9.518945 127.1910 4.554107 116.0223 3.370325 11.16876       5.665596 
1 1 1 -16 17 9  f 192.3980 3.213050 451.8370       15.06448 434.4678       24.39027 462.5497       19.15483 188.2977 5.320731 194.5647 4.039968 -6.267090      6.680683 
1 1 1 -16 17 10 o 98.36761 2.672909 118.1332       6.401323 115.0449       11.14470 119.6538       7.819969 96.86547 4.735669 98.95270 3.247356 -2.087227      5.742115 
1 1 1 -16 17 11 o 259.5328 4.358349 823.4818       27.56452 879.5411       41.00252 777.2545       37.23368 267.7358 6.284459 251.7456 6.069291 15.99022       8.736745 
1 1 1 -16 17 12 o 76.51807 2.760019 71.53090       5.138071 63.98755       9.164104 74.98938       6.205122 72.10009 5.251778 78.30817 3.258797 -6.208084      6.180690 
1 1 1 -16 17 13 o 146.0154 2.837392 260.1650       10.09611 259.2979       17.06562 260.6320       12.52265 145.4894 4.820082 146.0881 3.517591 -0.5986633     5.967129 
1 1 1 -16 17 14 o 99.81581 2.654887 121.6439       6.452021 125.2468       11.61360 120.0354       7.759700 101.0634 4.728707 99.10577 3.217257 1.957657       5.719389 
1 1 1 -16 17 15 o 180.3696 3.096417 397.1489       13.61003 433.9438       23.69342 379.0293       16.62680 188.1525 5.172422 176.1130 3.874193 12.03946       6.462454 
1 1 1 -16 17 16 o 167.3655 2.993840 341.9268       12.21042 339.8697       20.50426 343.0573       15.19937 166.5033 5.059286 167.5583 3.722404 -1.054977      6.281136 
1 1 1 -16 17 17 f 260.3317 4.302761 829.0435       27.29671 874.8658       58.66919 816.3839       30.83776 265.4787 9.082057 258.1848 4.901354 7.293915       10.32022 
1 1 1 -16 17 18 o 213.1820 3.806207 555.5478       19.77329 562.9052       29.39713 549.4688       26.72131 214.1009 5.639346 211.7195 5.179177 2.381332       7.656768 
1 1 1 -16 17 19 o 131.8931 3.099384 212.4463       9.961700 211.5925       15.32507 213.0710       13.10903 131.3314 4.796537 131.9131 4.082909 -0.5816650     6.298961 
1 1 1 -16 17 20 o 102.0563 3.041654 127.3159       7.556154 140.8540       12.50745 119.5349       9.482125 107.1003 4.804507 98.77549 3.947261 8.324852       6.218051 
1 1 1 -16 17 21 o 273.3349 5.260387 917.0712       35.03878 967.9008       45.01929 838.9702       55.80443 280.2201 6.592699 259.5636 8.835321 20.65649       11.02391 
1 1 1 -16 17 22 o 55.02140 6.494393 37.83729       8.540155 37.83729       8.540155 0.000000       0.000000 55.02140 6.494393 ?        ?        0.000000       6.494393 
1 1 1 -16 17 23 o 189.4038 3.581026 438.9141       16.52846 459.7081       25.25407 423.3325       21.86092 193.2699 5.367250 185.6346 4.836637 7.635208       7.224986 
1 1 1 -16 17 24 o 47.59932 3.826038 27.92633       4.400635 27.77201       7.868256 27.99658       5.308543 46.81920 7.120389 47.53162 4.642174 -0.7124138     8.499983 
1 1 1 -16 17 25 o 121.0768 3.071461 179.4077       9.055059 182.3863       14.16753 177.3506       11.77375 121.6985 4.786528 120.1907 4.025509 1.507774       6.254244 
1 1 1 -16 17 26 o 22.70424 6.140320 6.602263       3.478446 7.348000       6.630576 6.319097       4.085825 25.28555 8.791312 22.46845 6.845402 2.817093       11.14211 
1 1 1 -16 17 27 o 58.33091 3.412446 41.85179       4.829473 43.68306       8.567102 40.99876       5.847076 59.02096 6.041669 57.59242 4.194937 1.428543       7.355220 
1 1 1 -16 17 28 o 60.91269 4.067740 45.87009       6.003451 0.000000       0.000000 45.87009       6.003451 ?        ?        60.91269 4.067740 0.000000       4.067740 
1 1 1 -16 17 29 o 54.04734 3.635010 36.09043       4.759738 36.58749       8.665896 35.87570       5.695794 53.52497 6.796932 53.71668 4.389439 -0.1917076     8.091072 
1 1 1 -16 17 30 o 26.67063 5.896793 9.253308       3.730581 6.194442       6.881607 10.52639       4.439539 23.96011 8.876722 28.34030 6.558353 -4.380186      11.03668 
1 1 1 -16 17 31 o 34.96027 4.656585 15.46869       3.868583 12.33134       6.677434 17.05376       4.746275 30.23580 8.634764 36.48199 5.510333 -6.246197      10.24319 
1 1 1 -16 17 32 f 49.89992 4.324397 31.24041       5.206638 37.12361       7.550642 25.90691       7.189240 53.81787 5.851418 44.43526 6.859861 9.382610       9.016473 
1 1 1 -16 17 33 o 20.30285 6.401228 5.313560       3.538136 4.670858       6.176811 5.627418       4.316440 21.47208 8.304003 21.13258 7.099566 0.3395004      10.92521 
1 1 1 -16 17 34 o 47.89955 3.895849 28.86602       4.508238 31.66894       7.663361 27.38261       5.574990 48.82133 6.611022 46.16182 5.037589 2.659519       8.311613 
1 1 1 -16 17 35 o 73.08537 3.378310 66.75708       6.000530 70.85345       9.551751 64.08649       7.712349 73.94150 5.336920 70.93274 4.484694 3.008759       6.971026 
1 1 1 -16 17 36 o 20.14575 7.972635 4.352666       5.803549 0.4376543      7.949254 8.821139       8.492576 19.28384 8.541047 25.36355 9.755979 -6.079712      12.96644 
1 1 1 -16 17 37 o 20.76402 7.055121 5.951715       4.262817 5.302786       8.001811 6.208862       5.037098 21.99339 9.116445 21.31198 7.639543 0.6814117      11.89421 
1 1 1 -16 17 38 o 11.32905 5.325318 -3.097152      3.756794 -4.425141      5.705219 -2.080525      4.991788 13.72480 6.485373 13.94752 6.411340 -0.2227249     9.119504 
1 1 1 -16 17 39 f 69.71362 3.559647 62.28374       6.027269 50.97450       8.802074 72.26810       8.270435 60.30605 6.072040 73.88989 4.616174 -13.58385      7.627498 
1 1 1 -16 17 40 o 22.28120 6.932001 7.612514       4.163297 11.02020       6.408406 5.123930       5.476414 25.38306 8.649872 19.44114 7.728322 5.941919       11.59945 
1 1 1 -16 17 41 o 40.44888 6.862689 25.06597       6.522995 27.08598       10.02608 23.58337       8.589467 36.26505 10.64814 35.29609 9.691877 0.9689598      14.39845 
1 1 1 -16 17 42 o 19.39571 6.773826 5.936946       3.938902 -0.6598654     6.292529 10.18716       5.050838 15.32118 7.097939 24.29629 7.646543 -8.975109      10.43314 
1 1 1 -16 17 43 f 17.20720 6.621918 4.396081       3.913943 3.552234       6.063264 4.998894       5.124668 17.35437 7.580132 18.14161 7.382658 -0.7872410     10.58121 
1 1 1 -16 18 1  o 164.2151 3.249871 329.2389       13.00515 346.2263       26.26941 323.7237       14.96816 167.7829 6.436844 162.7766 3.773465 5.006271       7.461367 
1 1 1 -16 18 2  o 106.3289 2.899361 138.0760       7.505575 139.8637       15.15824 137.4953       8.638928 106.6374 5.855627 106.0639 3.346569 0.5734482      6.744471 
1 1 1 -16 18 3  o 159.4819 3.224652 310.5057       12.53229 296.3716       24.61795 315.4500       14.56016 155.2129 6.523148 160.6954 3.718148 -5.482559      7.508400 
1 1 1 -16 18 4  o 100.1522 2.725537 122.4733       6.645757 111.8763       11.31927 128.0477       8.209697 95.48961 4.880556 102.3587 3.295586 -6.869102      5.889033 
1 1 1 -16 18 5  o 26.89323 5.102646 9.144901       3.221761 11.97216       6.683347 8.289013       3.677224 30.70460 8.594422 25.49180 6.016879 5.212803       10.49128 
1 1 1 -16 18 6  o 245.8857 4.198978 739.0423       25.16014 759.9890       54.02904 733.2421       28.43101 247.7806 8.962722 244.8056 4.765788 2.974976       10.15102 
1 1 1 -16 18 7  o 50.21492 3.267850 30.91298       3.977091 25.03539       7.242912 33.45013       4.758675 44.63049 6.880391 52.19345 3.766737 -7.562954      7.843984 
1 1 1 -16 18 8  o 190.2584 3.208005 441.8875       14.87356 445.7621       24.61023 439.6580       18.66878 190.7080 5.300687 189.6734 4.038997 1.034622       6.664141 
1 1 1 -16 18 9  o 68.35345 2.877087 57.11563       4.781645 56.00788       8.744587 57.58813       5.711094 67.40975 5.367591 68.58913 3.427728 -1.179375      6.368701 
1 1 1 -16 18 10 o 117.6783 3.035210 169.1344       8.696780 191.5250       14.11936 155.4465       11.03950 125.0384 4.641838 112.7088 4.025815 12.32963       6.144416 
1 1 1 -16 18 11 f 163.0576 3.405665 324.6687       13.53253 329.4451       19.84578 320.5179       18.50072 163.9754 4.972280 161.7849 4.697586 2.190491       6.840386 
1 1 1 -16 18 12 o 119.3885 2.718020 173.9218       7.907719 184.9579       13.92278 168.6662       9.607830 122.8604 4.658706 117.4787 3.359513 5.381752       5.743681 
1 1 1 -16 18 13 o 118.0304 2.745419 169.9996       7.896575 165.8178       13.52751 172.1611       9.725574 116.2948 4.783543 118.6861 3.366030 -2.391365      5.849140 
1 1 1 -16 18 14 o 118.8239 2.747585 172.3003       7.955930 175.6097       13.90742 170.6905       9.699877 119.6783 4.778253 118.1735 3.371741 1.504814       5.848105 
1 1 1 -16 18 15 o 39.41708 3.818980 19.16615       3.622421 20.58468       7.252057 18.69456       4.181426 40.20149 7.682566 38.82985 4.502340 1.371647       8.904655 
1 1 1 -16 18 16 o 86.88413 2.737562 92.22283       5.788930 90.76973       10.59151 92.84184       6.912833 85.91749 5.081409 87.12730 3.261618 -1.209808      6.038118 
1 1 1 -16 18 17 o 105.7503 2.969578 136.6480       7.645082 154.8447       18.71049 133.0011       8.376206 111.9065 6.894575 104.2935 3.299901 7.612968       7.643592 
1 1 1 -16 18 18 o 112.6862 2.710233 155.0003       7.442405 177.5645       13.73494 145.6215       8.855059 120.3026 4.694075 109.1227 3.333880 11.17992       5.757524 
1 1 1 -16 18 19 o 43.59010 4.466973 23.51064       4.677967 24.12600       7.999908 23.19090       5.766642 43.52103 7.831014 43.09629 5.625064 0.4247360      9.641894 
1 1 1 -16 18 20 o 208.8778 4.470947 534.5190       22.75768 531.3491       28.58422 540.0072       37.61084 207.8457 5.648745 208.8344 7.402224 -0.9886932     9.311350 
1 1 1 -16 18 21 o 17.27950 6.929130 1.791193       4.440974 0.1473490      7.211322 2.795511       5.636638 19.88361 8.470761 19.90943 7.864043 -0.2581787E-01 11.55842 
1 1 1 -16 18 22 o 54.56825 3.642254 36.59934       4.815627 47.17052       8.817344 32.10576       5.748733 61.58751 5.948977 50.93900 4.683502 10.64851       7.571362 
1 1 1 -16 18 23 o 43.80302 4.167737 23.73303       4.395230 21.18019       7.845167 24.90087       5.306161 40.51011 8.228111 44.74440 4.948999 -4.234287      9.601791 
1 1 1 -16 18 24 o 49.95665 3.680413 30.73721       4.449039 30.59579       7.841571 30.80434       5.402821 49.23844 6.709645 49.88139 4.492833 -0.6429482     8.074954 
1 1 1 -16 18 25 o 46.31295 3.806255 26.48088       4.257849 32.58529       7.787172 23.87758       5.085347 50.85670 6.426657 43.77516 4.848308 7.081543       8.050342 
1 1 1 -16 18 26 o 106.7274 3.045300 139.5762       7.912207 153.2128       12.96051 131.4745       9.989818 111.3699 4.786668 103.3754 3.972954 7.994514       6.220655 
1 1 1 -16 18 27 o 57.37098 4.167533 40.73755       5.786767 0.000000       0.000000 40.73755       5.786767 ?        ?        57.37098 4.167533 0.000000       4.167533 
1 1 1 -16 18 28 o 48.91938 4.059708 29.69533       4.796077 35.16308       12.46315 28.74488       5.196232 51.03647 10.37497 48.02722 4.491930 3.009251       11.30563 
1 1 1 -16 18 29 f 14.96603 5.961794 1.533523       3.265594 2.542302       6.459026 1.187113       3.784984 20.34279 8.284585 15.43456 6.320499 4.908233       10.42032 
1 1 1 -16 18 30 o 113.7923 3.104510 159.3851       8.600744 167.0311       13.97834 154.7270       10.91049 115.5842 4.974380 111.7371 4.013443 3.847145       6.391571 
1 1 1 -16 18 31 o 11.36657 5.326468 -3.521147      3.708745 -1.548002      6.452659 -4.494542      4.532143 17.21810 7.656759 12.41187 5.838925 4.806221       9.629071 
1 1 1 -16 18 32 o 24.43181 6.246397 7.946681       3.732906 7.705145       6.520043 8.064460       4.552961 24.74160 8.709455 24.55725 7.165910 0.1843586      11.27851 
1 1 1 -16 18 33 o 72.85938 3.278755 65.95318       5.806527 74.01099       9.485551 61.12425       7.343099 76.14354 5.142189 69.62669 4.349529 6.516846       6.735021 
1 1 1 -16 18 34 o 22.59010 6.513328 6.925886       3.782024 6.240503       6.398256 7.293969       4.688868 22.71378 8.530540 23.18100 7.376529 -0.4672279     11.27756 
1 1 1 -16 18 35 o 23.69173 7.752394 7.836638       5.155725 6.736258       6.514844 9.680687       8.433718 22.93015 8.608731 26.23749 9.806266 -3.307343      13.04887 
1 1 1 -16 18 36 o 47.02396 4.271808 28.52100       4.841795 27.75569       7.464388 29.07689       6.361704 44.31019 7.156618 46.49110 5.736784 -2.180912      9.172125 
1 1 1 -16 18 37 o 12.86287 5.874838 -1.690025      4.101846 2.169201       8.410975 -2.894268      4.698436 20.07946 8.844150 13.07811 6.084253 7.001356       10.73485 
1 1 1 -16 18 38 o 28.16846 6.271840 11.38459       4.194585 6.612319       6.717022 14.43526       5.370457 21.81618 8.594735 31.08630 7.226829 -9.270128      11.22927 
1 1 1 -16 18 39 o 19.91206 6.726883 5.791557       3.875031 9.627706       6.058512 3.135776       5.040973 24.25363 8.405131 17.50223 7.243590 6.751398       11.09576 
1 1 1 -16 18 40 o 11.30140 5.504061 -6.477374      4.876366 -10.69372      7.942543 -3.926549      6.177771 13.68734 6.739347 14.05497 6.672836 -0.3676319     9.483962 
1 1 1 -16 18 41 o 14.85438 6.230682 2.011168       3.803181 0.5364198      6.138680 2.929848       4.845051 15.95534 7.248262 16.58002 6.997980 -0.6246834     10.07517 
1 1 1 -16 18 42 o 19.02973 6.710759 5.744587       3.872186 2.967227       6.118714 7.599946       5.001015 17.15578 7.550347 21.00141 7.601279 -3.845631      10.71388 
1 1 1 -16 19 1  o 88.08170 3.691408 94.96392       7.905877 94.55469       12.15543 95.26395       10.40804 87.61198 5.724745 88.07339 4.868342 -0.4614029     7.514883 
1 1 1 -16 19 2  f 164.3304 3.273496 329.7515       13.10889 356.8789       26.96738 321.3581       15.00040 170.2891 6.510533 162.1648 3.795861 8.124329       7.536286 
1 1 1 -16 19 3  o 234.6129 4.017117 672.8369       22.96691 709.2318       47.15228 661.5166       26.29725 239.5693 8.088324 232.5056 4.641313 7.063705       9.325383 
1 1 1 -16 19 4  o 99.95866 2.943779 122.0575       7.162891 123.4587       14.69219 121.6207       8.203921 100.1200 6.050078 99.73861 3.380260 0.3813477      6.930339 
1 1 1 -16 19 5  o 207.4556 3.395941 525.5802       17.16807 526.4279       28.19787 525.0809       21.64158 207.1489 5.591070 207.2183 4.285728 -0.6941223E-01 7.044681 
1 1 1 -16 19 6  o 61.03287 3.457897 45.63846       5.121907 23.26724       14.27732 48.94284       5.487154 42.70729 12.74956 63.19879 3.577498 -20.49150      13.24197 
1 1 1 -16 19 7  o 39.49512 4.004323 19.25973       3.800769 23.41232       7.221983 17.66902       4.469848 43.06666 7.130753 37.66498 4.992737 5.401676       8.704886 
1 1 1 -16 19 8  o 23.25210 5.925232 6.887457       3.366611 5.229408       6.495241 7.496532       3.936695 23.27213 8.623546 24.28900 6.516429 -1.016874      10.80876 
1 1 1 -16 19 9  o 47.12910 3.531965 27.28214       4.026902 28.84553       7.702109 26.69402       4.723991 47.97646 6.776329 46.53566 4.211228 1.440800       7.978288 
1 1 1 -16 19 10 o 89.88743 3.303615 98.79751       7.224123 103.7177       11.15097 95.23889       9.483333 91.89585 4.998256 88.12540 4.430155 3.770454       6.678985 
1 1 1 -16 19 11 o 96.81522 2.768976 114.4806       6.526083 104.0243       11.47615 119.4781       7.933778 92.00738 5.138857 98.85882 3.297896 -6.851440      6.106060 
1 1 1 -16 19 12 o 91.14871 2.779505 101.4883       6.166608 113.2360       11.60503 96.86608       7.279348 96.02536 4.976319 88.99348 3.362638 7.031883       6.005921 
1 1 1 -16 19 13 o 99.34872 2.782784 120.5589       6.730539 130.5062       12.19121 116.1978       8.072221 103.1156 4.865333 97.47379 3.403581 5.641838       5.937662 
1 1 1 -16 19 14 f 63.11857 3.092572 48.76244       4.742300 48.30189       9.000313 48.93945       5.579670 62.43176 5.989202 63.17857 3.639524 -0.7468033     7.008329 
1 1 1 -16 19 15 o 223.7721 3.528527 611.9018       19.24135 622.6916       31.87247 605.7145       24.13577 225.1027 5.815174 222.4466 4.452453 2.656128       7.323974 
1 1 1 -16 19 16 o 49.46039 3.539387 30.05009       4.237810 26.60322       8.113892 31.34306       4.969479 45.83666 7.524966 50.45370 4.076549 -4.617039      8.558234 
1 1 1 -16 19 17 o 253.9713 4.910817 790.7357       30.39307 794.6141       55.28675 789.0559       36.38411 252.6367 8.994604 253.3619 5.892972 -0.7251282     10.75314 
1 1 1 -16 19 18 o 134.5414 3.247464 221.1753       10.64722 233.3793       16.48703 212.4445       13.94507 137.8685 4.915151 131.6415 4.353007 6.226990       6.565621 
1 1 1 -16 19 19 o 122.7604 3.220907 184.2899       9.627138 186.2008       14.93227 182.9305       12.59407 123.0848 4.988685 122.1446 4.237542 0.9401855      6.545513 
1 1 1 -16 19 20 o 78.63611 2.841227 75.63113       5.435627 71.30042       10.36067 77.27586       6.384910 75.91924 5.640452 79.43485 3.305657 -3.515617      6.537742 
1 1 1 -16 19 21 o 78.19543 3.756628 75.02646       7.137455 81.74941       10.44384 69.13474       9.776904 81.35940 5.296436 74.77009 5.402263 6.589310       7.565493 
1 1 1 -16 19 22 o 105.6568 3.074423 136.6089       7.907423 151.3190       13.01588 128.0035       9.955169 110.8613 4.829480 102.1162 4.008319 8.745140       6.276185 
1 1 1 -16 19 23 o 60.43321 3.412748 44.85367       5.005501 49.63527       8.756646 42.53297       6.100429 63.14503 5.753794 58.70667 4.293889 4.438354       7.179389 
1 1 1 -16 19 24 o 76.39674 3.167301 71.56670       5.883792 76.26234       10.06844 69.13153       7.250692 78.43160 5.298973 74.94465 3.984431 3.486954       6.629841 
1 1 1 -16 19 25 o 66.36844 3.322085 54.11592       5.355814 56.66614       9.488785 52.92358       6.488148 67.35203 5.838903 65.49271 4.085641 1.859314       7.126377 
1 1 1 -16 19 26 o 58.60939 3.698780 42.36969       5.255828 43.94712       12.31559 42.01843       5.811631 58.05132 8.996666 58.28017 4.118579 -0.2288513     9.894579 
1 1 1 -16 19 27 o 20.91935 6.812899 5.357455       3.984119 0.000000       0.000000 5.357455       3.984119 ?        ?        20.91935 6.812899 0.000000       6.812899 
1 1 1 -16 19 28 o 47.36261 3.734973 27.81009       4.275950 22.59472       7.619099 30.20798       5.166248 41.44069 7.831571 49.22825 4.351259 -7.787556      8.959183 
1 1 1 -16 19 29 o 36.31895 4.545506 16.63042       3.935158 23.51435       7.444119 13.96069       4.635844 42.26193 7.502978 32.81372 6.019202 9.448208       9.619017 
1 1 1 -16 19 30 o 55.11248 3.576184 37.69480       4.776991 41.39436       8.528327 36.00339       5.766506 56.73893 6.272642 53.58741 4.456132 3.151520       7.694358 
1 1 1 -16 19 31 o 103.3463 3.658945 132.6250       9.200282 135.7853       12.60531 129.0223       13.45893 103.7339 5.001243 100.7483 5.502864 2.985626       7.435990 
1 1 1 -16 19 32 o 29.57943 5.631643 11.51521       3.911163 11.88682       6.886489 11.33827       4.751950 29.12203 8.889931 28.92099 6.848907 0.2010479      11.22223 
1 1 1 -16 19 33 o 15.28120 6.189274 1.633414       3.582025 0.8970583      6.288414 1.987100       4.358192 18.21789 7.838599 16.72403 6.807304 1.493862       10.38186 
1 1 1 -16 19 34 o 34.75071 6.510089 16.49444       5.310452 16.18869       6.786025 16.97751       8.529768 33.33009 8.368211 33.22602 9.838799 0.1040688      12.91623 
1 1 1 -16 19 35 o 15.09573 6.634451 -0.1134915     4.709142 -5.328980      5.710094 10.97644       8.326458 13.54204 6.425244 26.94745 9.800316 -13.40541      11.71879 
1 1 1 -16 19 36 o 56.70609 4.288756 41.61675       5.882549 47.25022       11.28570 39.51524       6.892986 56.01406 8.537423 54.46193 5.259058 1.552128       10.02723 
1 1 1 -16 19 37 o 46.62797 4.310308 28.40798       4.842270 35.44626       7.870882 24.12182       6.142200 49.98787 6.624238 41.44308 6.278252 8.544788       9.126718 
1 1 1 -16 19 38 f 49.19599 4.126668 31.67201       4.901717 35.54906       7.984815 29.32738       6.209425 49.40849 6.812885 45.98702 5.660175 3.421474       8.857369 
1 1 1 -16 19 39 o 16.16028 6.765043 2.368936       4.469974 8.726460       9.355373 0.4882262      5.088362 23.00932 9.718554 15.30457 6.802949 7.704749       11.86298 
1 1 1 -16 19 40 f 17.27221 7.208355 3.429391       5.051777 -0.5247154     8.014366 6.036253       6.507347 17.02573 7.929372 20.05342 8.257834 -3.027693      11.44844 
1 1 1 -16 19 41 o 13.83652 6.023643 1.006061       3.801900 -3.253082      6.232142 3.530692       4.798166 14.05448 6.681081 16.94718 7.045066 -2.892696      9.709264 
1 1 1 -16 19 42 f 12.32762 5.606210 -0.5231017     3.684513 2.780801       5.814997 -2.739296      4.762552 16.71171 7.357532 12.45098 5.895936 4.260732       9.428432 
1 1 1 -16 20 1  o 56.64146 3.099341 39.29221       4.261689 37.92201       8.364634 39.77258       4.952704 55.18648 6.334533 56.93845 3.587684 -1.751972      7.279958 
1 1 1 -16 20 2  o 175.7718 4.094412 377.8474       17.53787 404.3275       29.91930 363.9863       21.64672 181.1171 6.790875 172.2536 5.162712 8.863419       8.530509 
1 1 1 -16 20 3  o 111.3182 2.967987 151.3836       8.044080 129.0338       15.37576 159.8061       9.438853 102.2972 6.196954 114.3299 3.391593 -12.03263      7.064357 
1 1 1 -16 20 4  o 106.4032 2.995259 138.3240       7.758772 136.4499       15.67247 138.9324       8.929828 105.2223 6.138806 106.5908 3.442367 -1.368538      7.038098 
1 1 1 -16 20 5  o 113.3665 2.805122 156.8583       7.749477 160.8802       13.28225 154.7825       9.541906 114.5307 4.769415 112.5089 3.484463 2.021744       5.906674 
1 1 1 -16 20 6  o 169.5438 3.465382 351.1432       14.31756 364.2883       32.43757 347.9626       15.95599 171.6342 7.775669 168.7193 3.880814 2.914917       8.690325 
1 1 1 -16 20 7  o 95.61980 2.838387 111.6946       6.606547 102.9592       11.31624 116.2114       8.137251 91.53046 5.093502 97.47810 3.430933 -5.947639      6.141259 
1 1 1 -16 20 8  o 179.3081 3.168005 392.5966       13.84274 388.8501       22.94002 394.7421       17.35952 178.0286 5.293594 179.6874 3.964459 -1.658829      6.613553 
1 1 1 -16 20 9  o 96.77740 2.829810 114.4148       6.666543 113.6385       11.86513 114.7729       8.058854 96.17117 5.080833 96.87119 3.419197 -0.7000198     6.124196 
1 1 1 -16 20 10 o 93.65675 3.309302 107.2695       7.540994 108.7667       11.42217 106.1128       10.04015 94.08983 4.999558 93.01311 4.442394 1.076714       6.688082 
1 1 1 -16 20 11 o 103.4562 2.806092 130.7403       7.067945 127.9000       12.46978 132.0848       8.579152 102.0413 5.030223 103.9273 3.392039 -1.885986      6.067048 
1 1 1 -16 20 12 o 76.99669 2.930907 72.48385       5.489294 73.86794       9.939237 71.87640       6.584610 77.43197 5.299350 76.61292 3.536429 0.8190460      6.370985 
1 1 1 -16 20 13 o 78.87386 2.901126 76.05617       5.566668 79.93459       10.38171 74.49111       6.594866 80.55057 5.318648 77.99928 3.478348 2.551285       6.355071 
1 1 1 -16 20 14 o 117.1688 2.804716 167.6004       8.008239 172.2801       14.08211 165.3636       9.735779 118.4600 4.888707 116.2770 3.439683 2.183006       5.977530 
1 1 1 -16 20 15 o 19.25611 6.481943 4.272593       3.598001 -0.7390671     7.322640 5.867634       4.131073 19.47880 8.420334 21.94813 6.916419 -2.469324      10.89674 
1 1 1 -16 20 16 o 88.57390 3.690726 96.10149       7.948790 109.1876       16.73516 92.28918       9.032725 93.70885 7.388192 86.71478 4.287840 6.994064       8.542303 
1 1 1 -16 20 17 o 108.1148 3.222260 142.9619       8.480020 134.8842       12.91762 149.0793       11.24145 104.7169 5.077221 110.2632 4.191282 -5.546333      6.583693 
1 1 1 -16 20 18 o 312.7289 4.486910 1198.896       34.19412 1229.317       56.32367 1181.139       43.03176 315.0788 7.335599 309.8290 5.699423 5.249786       9.289480 
1 1 1 -16 20 19 o 70.11440 2.968046 60.17735       5.059767 59.08073       9.733130 60.58344       5.922998 69.01333 5.842237 70.29185 3.468517 -1.278526      6.794287 
1 1 1 -16 20 20 o 150.5501 2.946074 277.0074       10.80839 271.6057       18.52246 279.7964       13.30931 148.5323 5.124987 151.1904 3.612395 -2.658142      6.270158 
1 1 1 -16 20 21 f 91.43362 3.139424 102.3684       6.984693 103.5685       11.53615 101.6738       8.776122 91.58018 5.190448 90.98864 3.967570 0.5915451      6.533174 
1 1 1 -16 20 22 o 60.25548 3.484072 44.61352       5.094057 55.93746       9.189772 39.59066       6.120422 67.06695 5.676149 56.58915 4.474647 10.47779       7.227803 
1 1 1 -16 20 23 o 38.99248 4.450376 18.93618       4.153136 23.85849       7.752357 16.95481       4.918492 43.05362 7.670312 36.60628 5.699103 6.447342       9.555808 
1 1 1 -16 20 24 o 47.34730 3.831620 27.70793       4.383191 25.27417       7.736715 28.85835       5.319205 44.33971 7.422357 48.18219 4.585490 -3.842476      8.724568 
1 1 1 -16 20 25 o 52.98841 3.902854 34.71793       5.004275 41.34401       11.93270 33.30386       5.512452 56.24733 9.009641 51.78684 4.409979 4.460487       10.03103 
1 1 1 -16 20 26 o 41.44341 4.592951 21.48948       4.560786 29.43786       11.39809 19.97427       4.976548 46.62394 10.30639 39.77290 5.263675 6.851044       11.57273 
1 1 1 -16 20 27 o 70.02740 3.258672 60.39957       5.545648 59.26527       9.452771 60.99487       6.847942 68.61160 5.705179 70.17664 4.021179 -1.565041      6.979896 
1 1 1 -16 20 28 o 38.80730 4.440179 18.92586       4.123534 22.21959       7.709541 17.60602       4.880269 40.85171 8.030720 37.08968 5.571559 3.762024       9.774187 
1 1 1 -16 20 29 o 36.00947 4.721374 16.44601       4.043355 11.97321       7.636069 18.18869       4.766392 29.79127 9.405432 37.70440 5.336515 -7.913128      10.81390 
1 1 1 -16 20 30 o 22.75581 6.193082 6.848857       3.525327 9.913962       6.779339 5.712823       4.127245 27.23227 8.888317 21.21082 6.935924 6.021448       11.27427 
1 1 1 -16 20 31 o 55.36947 3.650911 38.27855       4.898661 35.98120       8.181514 39.56240       6.116156 52.30424 6.563013 55.93817 4.525379 -3.633930      7.971963 
1 1 1 -16 20 32 o 31.26713 5.544519 12.89352       4.069950 15.36434       7.059454 11.66339       4.981093 32.70159 8.705214 29.09461 7.091106 3.606981       11.22785 
1 1 1 -16 20 33 o 38.19536 6.289825 19.66433       5.650833 21.56886       7.332423 16.87880       8.867642 38.96353 7.990802 33.11018 10.08413 5.853352       12.86633 
1 1 1 -16 20 34 o 36.39366 6.429482 18.21123       5.493668 17.72208       6.824955 19.11141       9.258598 34.70062 8.201561 34.42379 10.26471 0.2768250      13.13887 
1 1 1 -16 20 35 o 54.47216 3.800015 37.88084       5.012611 36.69398       7.901753 38.68010       6.484352 51.51575 6.434198 54.19298 4.965189 -2.677227      8.127238 
1 1 1 -16 20 36 o 33.28952 6.053823 15.47380       4.730186 13.20085       9.699148 16.18311       5.418210 27.75976 10.48613 33.46598 6.873990 -5.706224      12.53837 
1 1 1 -16 20 37 o 16.08064 6.471925 2.572603       3.889248 10.99860       6.693717 -1.721717      4.778636 25.88701 8.839925 13.72963 6.297060 12.15738       10.85344 
1 1 1 -16 20 38 o 22.67949 6.885841 7.845451       4.139067 9.614439       6.547977 6.668248       5.341590 23.97337 8.694903 21.01411 7.813993 2.959265       11.69016 
1 1 1 -16 20 39 o 13.87384 6.404979 -1.496147      5.058327 -7.419132      8.163778 2.194727       6.444444 14.77371 7.178417 17.46354 7.714625 -2.689821      10.53779 
1 1 1 -16 20 40 o 19.40192 6.771941 5.872946       3.936371 3.718298       6.627340 7.047419       4.892971 18.19551 7.936629 20.68920 7.514400 -2.493689      10.92961 
1 1 1 -16 20 41 o 16.22224 6.522756 3.428410       3.946581 -4.714826      6.571997 8.021276       4.935609 13.70706 6.606708 21.48150 7.576327 -7.774436      10.05233 
1 1 1 -16 21 1  o 47.39597 3.499905 27.60329       4.013832 23.13163       8.135798 29.04182       4.614510 42.53646 8.145308 48.56986 3.932326 -6.033398      9.044847 
1 1 1 -16 21 2  o 141.1355 3.150564 243.2975       10.83580 257.0219       22.02277 238.9136       12.44664 144.4094 6.273034 139.7517 3.657904 4.657684       7.261627 
1 1 1 -16 21 3  o 143.7838 3.167220 252.5100       11.09748 263.5786       22.52649 248.9628       12.75232 146.2380 6.336203 142.6643 3.671119 3.573669       7.322881 
1 1 1 -16 21 4  o 37.91625 6.002359 18.08898       5.361589 17.29794       8.039405 18.72266       7.195461 36.61070 9.060615 38.22058 7.983373 -1.609879      12.07597 
1 1 1 -16 21 5  o 39.17620 5.002434 19.11095       4.666926 0.000000       0.000000 19.11095       4.666926 ?        ?        39.17620 5.002434 0.000000       5.002434 
1 1 1 -16 21 6  o 118.7092 2.859845 172.0347       8.273001 168.4269       14.06267 173.9443       10.23068 117.1314 4.937799 119.2548 3.524269 -2.123405      6.066493 
1 1 1 -16 21 7  o 131.6924 3.234684 211.8391       10.38074 196.9832       15.45044 224.0636       14.01542 126.6730 5.015104 135.2499 4.257696 -8.576920      6.578696 
1 1 1 -16 21 8  o 198.7960 3.345398 482.8209       16.20659 529.5748       27.91681 459.0543       19.90400 207.6483 5.521881 193.6888 4.216962 13.95949       6.947945 
1 1 1 -16 21 9  o 203.5187 3.390496 506.0900       16.81526 538.9079       28.51422 488.5919       20.82098 209.4390 5.591865 199.8048 4.276211 9.634171       7.039526 
1 1 1 -16 21 10 o 139.5486 2.933238 237.7816       9.974906 244.5664       17.10650 234.2862       12.27838 141.1579 4.980821 138.3920 3.643947 2.765900       6.171461 
1 1 1 -16 21 11 o 165.0268 3.425064 332.8042       13.77398 353.1248       21.29711 318.1924       18.05951 169.5987 5.159021 161.1083 4.604660 8.490372       6.915084 
1 1 1 -16 21 12 o 189.9239 3.266872 440.7058       15.11987 440.9200       25.20792 440.5854       18.89640 189.4298 5.466471 189.7522 4.086543 -0.3224182     6.825111 
1 1 1 -16 21 13 o 119.4679 3.240472 174.5087       9.425279 186.8429       14.86399 166.2141       12.18918 123.3392 4.955449 116.4365 4.303253 6.902702       6.563113 
1 1 1 -16 21 14 o 55.27032 3.993186 37.57441       5.342071 35.97421       8.868244 38.48576       6.692581 53.55536 6.959592 55.79766 4.974094 -2.242302      8.554386 
1 1 1 -16 21 15 o 159.5710 4.010542 311.8690       15.58292 316.7195       20.17586 304.6974       24.53264 160.5351 5.164060 157.0882 6.422163 3.446915       8.240855 
1 1 1 -16 21 16 o 194.9965 3.663659 465.1865       17.40917 472.4503       37.88223 463.2417       19.60168 194.8763 7.993988 194.4801 4.136014 0.3961792      9.000581 
1 1 1 -16 21 17 o 43.73157 3.959681 23.60856       4.174112 19.92810       8.486917 24.78292       4.794017 39.17218 9.069715 44.73960 4.456354 -5.567417      10.10539 
1 1 1 -16 21 18 o 38.96963 4.103063 18.81287       3.838063 19.25929       7.659394 18.66320       4.435047 38.58163 8.386477 38.69415 4.806771 -0.1125259     9.666336 
1 1 1 -16 21 19 o 108.5962 2.818195 144.2132       7.451685 133.4809       13.15116 149.2882       9.043521 104.0175 5.204793 110.4075 3.365193 -6.390030      6.197935 
1 1 1 -16 21 20 o 103.2539 3.126969 130.5378       7.858962 144.5927       12.99137 122.4258       9.869680 108.2910 4.935940 99.82191 4.065846 8.469093       6.394889 
1 1 1 -16 21 21 o 66.03239 2.959468 53.44209       4.750090 59.27989       9.667455 51.58417       5.453835 68.99922 5.803256 64.80053 3.466336 4.198692       6.759679 
1 1 1 -16 21 22 o 28.27114 5.175653 10.16694       3.434337 8.982309       7.387007 10.49360       3.879052 27.37926 9.287505 28.61833 5.761760 -1.239063      10.92958 
1 1 1 -16 21 23 o 52.79299 3.699977 34.38683       4.729911 29.18431       8.431381 36.77599       5.713672 47.66367 7.507027 54.48133 4.339430 -6.817665      8.670993 
1 1 1 -16 21 24 o 63.21494 3.704188 49.28474       5.681220 52.56905       12.94821 48.50171       6.322289 63.71392 8.555516 62.60881 4.167564 1.105106       9.516588 
1 1 1 -16 21 25 o 49.44714 3.750280 30.26390       4.485287 14.72066       7.747065 38.10104       5.501046 33.20667 9.237847 55.43468 4.101231 -22.22801      10.10732 
1 1 1 -16 21 26 o 40.28831 4.658135 20.38828       4.489134 15.88301       11.08783 21.27157       4.909516 34.47694 11.37337 41.06922 5.009042 -6.592281      12.42755 
1 1 1 -16 21 27 o 70.80880 3.353573 61.89428       5.770258 56.86960       9.900237 64.47932       7.101099 66.84882 6.146112 72.06036 4.060256 -5.211540      7.366164 
1 1 1 -16 21 28 f 15.17218 6.056563 1.621468       3.377231 -0.6398566     6.933100 2.324971       3.867043 18.44698 8.080339 16.71372 6.540223 1.733263       10.39550 
1 1 1 -16 21 29 o 67.93870 3.328684 57.18751       5.494167 60.54370       9.437970 55.46717       6.757123 68.84611 5.675900 66.58701 4.185416 2.259094       7.052202 
1 1 1 -16 21 30 f 58.93749 4.120109 43.61742       5.880207 38.69414       8.661586 47.82625       8.008495 54.19773 6.700700 61.07573 5.437585 -6.877998      8.629410 
1 1 1 -16 21 31 o 28.34629 5.884107 10.72952       3.931366 2.628999       6.918430 14.59260       4.777691 20.20689 8.434564 33.05649 6.157467 -12.84960      10.44300 
1 1 1 -16 21 32 o 66.73490 4.329278 56.62303       7.002522 48.99935       8.736998 70.31652       11.70946 60.94042 5.959379 72.36672 6.716558 -11.42630      8.979218 
1 1 1 -16 21 33 o 65.69521 4.456246 55.41225       7.091871 46.82520       8.743291 71.92753       12.12539 59.01376 6.170857 72.35202 6.963045 -13.33826      9.303949 
1 1 1 -16 21 34 o 78.24922 3.388050 77.24303       6.445188 75.10002       10.12084 78.70501       8.359412 75.01245 5.576541 78.07082 4.411862 -3.058365      7.110720 
1 1 1 -16 21 35 o 22.23805 7.126855 7.152359       4.370788 3.806587       10.10336 7.922682       4.847907 22.00242 9.692072 23.20647 7.512046 -1.204056      12.26243 
1 1 1 -16 21 36 o 51.98473 4.100331 35.15722       5.152317 34.77888       8.076009 35.41690       6.690847 48.96779 6.963935 50.95589 5.474016 -1.988102      8.857836 
1 1 1 -16 21 37 o 20.15381 6.849381 5.963705       4.017847 0.4474914      6.218478 9.916793       5.264193 16.60535 7.441149 24.94086 7.800262 -8.335516      10.78030 
1 1 1 -16 21 38 o 22.92085 7.435824 8.418140       4.748503 3.793068       9.170210 10.11265       5.550619 20.04094 9.004031 24.57759 8.043900 -4.536652      12.07381 
1 1 1 -16 21 39 o 30.18055 7.874370 15.37792       5.851354 15.27987       10.04274 15.42831       7.199657 26.05529 10.42959 28.44233 9.149987 -2.387045      13.87439 
1 1 1 -16 21 40 o 10.75572 5.133742 -3.354244      3.756951 4.770698       6.444457 -7.537184      4.623992 18.63547 7.975212 10.35304 5.106127 8.282433       9.469769 
1 1 1 -16 22 1  o 54.68173 3.499989 36.70364       4.639369 48.74065       9.091509 32.46555       5.394627 62.65394 6.028929 51.30322 4.356148 11.35072       7.438011 
1 1 1 -16 22 2  o 115.8750 3.071912 164.1334       8.666656 175.6800       17.53596 160.4016       9.969287 119.3378 6.049709 114.4828 3.577843 4.855003       7.028510 
1 1 1 -16 22 3  o 114.8011 3.072679 161.1017       8.588327 190.3910       18.14800 152.6493       9.749110 124.2636 6.010891 111.6807 3.586859 12.58286       6.999741 
1 1 1 -16 22 4  o 263.6951 4.401366 851.5857       28.28301 892.9979       58.26081 838.8170       32.35075 267.7670 8.941139 261.4907 5.076822 6.276337       10.28193 
1 1 1 -16 22 5  o 90.30681 4.785839 100.2406       10.49449 0.000000       0.000000 100.2406       10.49449 ?        ?        90.30681 4.785839 0.000000       4.785839 
1 1 1 -16 22 6  o 82.56077 3.150763 83.38875       6.327435 93.89532       13.16202 80.23080       7.215962 87.12527 6.240628 80.92133 3.668819 6.203934       7.239176 
1 1 1 -16 22 7  o 207.9744 3.444489 528.6577       17.45705 546.4561       29.03282 518.5787       21.84771 210.8187 5.656353 205.7911 4.356556 5.027603       7.139602 
1 1 1 -16 22 8  o 15.49685 6.202935 1.441327       3.552174 -0.2364150     6.517980 2.150146       4.236604 18.68372 8.008739 17.36789 6.830822 1.315830       10.52616 
1 1 1 -16 22 9  o 106.0953 3.964013 137.9130       10.23064 142.4143       12.80307 129.9617       17.01622 107.6610 4.892787 102.4186 6.857374 5.242401       8.423950 
1 1 1 -16 22 10 o 207.0205 3.862495 524.3024       19.48576 544.3033       29.13194 508.1091       26.21270 210.3640 5.688013 203.3726 5.293617 6.991394       7.770191 
1 1 1 -16 22 11 o 60.44468 3.734099 44.85645       5.473366 46.39373       8.910383 43.92490       6.936238 61.10553 6.063743 59.66109 4.811644 1.444439       7.740859 
1 1 1 -16 22 12 o 123.5454 3.257055 186.6711       9.797356 183.8397       14.85235 188.8522       13.03580 122.2972 4.994101 124.0917 4.317388 -1.794495      6.601582 
1 1 1 -16 22 13 f 133.5081 2.913043 217.7336       9.477435 224.6549       16.44768 214.2934       11.59608 135.1895 5.001210 132.3124 3.599798 2.877075       6.162033 
1 1 1 -16 22 14 o 21.61018 6.315635 5.867915       3.534210 13.53037       7.556257 3.722280       3.998533 32.44991 9.158210 18.89749 6.802539 13.55242       11.40821 
1 1 1 -16 22 15 o 107.9573 3.140289 142.5871       8.252696 144.2630       19.63620 142.2276       9.094936 107.5611 7.539197 107.7729 3.467524 -0.2118149     8.298387 
1 1 1 -16 22 16 f 120.3059 2.861796 176.8541       8.389998 182.8115       14.97610 174.1292       10.12869 121.8474 5.054643 119.2428 3.489412 2.604607       6.142102 
1 1 1 -16 22 17 o 171.1078 3.129367 358.0312       13.04855 359.8495       22.17553 357.0682       16.13812 170.8736 5.332059 170.7117 3.879301 0.1618500      6.593924 
1 1 1 -16 22 18 o 91.62565 2.863744 102.7271       6.386365 95.98826       11.62848 105.6375       7.642019 88.07382 5.444633 92.83847 3.383538 -4.764648      6.410332 
1 1 1 -16 22 19 o 30.30063 5.052113 11.60507       3.599172 17.60917       7.913653 10.03925       4.041330 36.67659 8.937361 27.95237 6.104339 8.724220       10.82309 
1 1 1 -16 22 20 o 130.0086 3.246291 206.9856       10.28480 211.4239       16.17712 203.9747       13.32426 130.8232 5.084025 128.7598 4.252289 2.063385       6.627916 
1 1 1 -16 22 21 o 49.51226 3.434119 30.19910       4.117795 26.59404       8.596253 31.27267       4.691024 45.32185 8.079673 50.31867 3.854980 -4.996822      8.952206 
1 1 1 -16 22 22 o 70.14431 3.671200 60.59726       6.253486 63.13034       14.01292 59.96734       6.987913 70.08739 8.369742 69.67825 4.134001 0.4091415      9.335018 
1 1 1 -16 22 23 o 45.71825 3.745123 25.87483       4.135918 14.05438       11.14713 27.76184       4.453827 33.32964 11.40698 47.33690 3.895418 -14.00726      12.05378 
1 1 1 -16 22 24 o 17.22513 5.962230 3.385684       3.048162 -5.739303      6.434859 6.025569       3.461110 15.11136 7.060077 21.65886 6.226567 -6.547499      9.413545 
1 1 1 -16 22 25 o 102.6001 3.167547 129.4991       7.910177 130.8941       13.05271 128.6894       9.944270 102.3044 5.253233 101.9864 4.009051 0.3180542      6.608249 
1 1 1 -16 22 26 o 33.37227 5.108147 14.21521       4.022212 12.44578       7.809629 14.85401       4.692428 30.45818 9.496975 33.89240 5.895413 -3.434216      11.17803 
1 1 1 -16 22 27 o 43.74607 4.094654 23.96082       4.314357 37.18859       8.546555 19.43725       4.997908 53.53477 6.697299 38.95858 5.410205 14.57618       8.609538 
1 1 1 -16 22 28 o 54.99837 3.694112 37.68175       4.922319 48.77408       8.870192 32.74597       5.916973 61.57367 5.987059 50.85205 4.832820 10.72161       7.694221 
1 1 1 -16 22 29 o 18.35919 6.561389 3.908016       3.712746 7.700304       6.808464 2.303055       4.429257 24.73051 8.879776 17.27467 6.922448 7.455843       11.25925 
1 1 1 -16 22 30 o 39.54130 4.372356 19.91863       4.142811 15.82320       7.464546 21.74164       4.980230 33.08040 9.015379 41.02629 5.090542 -7.945885      10.35329 
1 1 1 -16 22 31 o 30.86840 7.176456 13.28702       5.295679 15.27591       7.116805 10.81953       7.926972 32.27179 8.806119 27.47778 9.608584 4.794010       13.03352 
1 1 1 -16 22 32 o 43.84692 5.588364 25.53000       5.835670 27.95946       7.597846 22.03496       9.113009 44.76425 7.209877 37.57125 9.838850 7.192993       12.19776 
1 1 1 -16 22 33 o 54.16265 3.787882 37.37645       4.968053 32.76066       7.940737 40.34527       6.368395 48.32475 6.942044 55.60711 4.744918 -7.282360      8.408699 
1 1 1 -16 22 34 o 45.98160 4.226201 27.42510       4.682620 20.20033       7.629035 31.79218       5.931347 35.93261 8.786862 48.92219 5.047593 -12.98958      10.13347 
1 1 1 -16 22 35 o 19.70720 7.152436 5.317568       4.431833 4.532784       10.13076 5.503300       4.928441 22.01956 9.702195 20.11553 7.500687 1.904030       12.26348 
1 1 1 -16 22 36 o 23.64840 6.853874 8.429110       4.177827 10.28166       6.645662 7.218545       5.372137 24.88273 8.790014 21.79945 7.879896 3.083281       11.80496 
1 1 1 -16 22 37 o 26.00000 6.677839 10.29350       4.252946 -0.9823824     6.695781 17.91907       5.506331 16.06345 7.399034 34.48280 6.794507 -18.41934      10.04545 
1 1 1 -16 22 38 o 26.29990 8.276225 12.14248       5.917102 1.555461       9.431587 19.01410       7.598492 18.75955 8.690502 31.94467 9.238759 -13.18512      12.68383 
1 1 1 -16 22 39 o 10.76063 5.082751 -2.616896      3.498013 0.8321598      6.094783 -4.311095      4.271598 15.99309 7.248317 11.13410 5.356343 4.858990       9.012686 
1 1 1 -16 22 40 o 14.66166 6.212365 1.990375       3.842798 -0.9996694     6.510864 3.588762       4.760372 15.16639 7.090974 16.80208 7.003618 -1.635691      9.966573 
1 1 1 -16 23 1  o 101.6708 3.277549 126.5087       8.109871 116.5329       14.02912 131.5154       9.938758 97.07494 5.959164 103.5637 3.945332 -6.488724      7.146837 
1 1 1 -16 23 2  o 59.19171 3.668840 43.02980       5.266059 39.62035       9.414327 44.58237       6.352913 56.18078 7.029926 60.15762 4.363230 -3.976833      8.273913 
1 1 1 -16 23 3  o 179.3254 3.973779 393.6945       17.36527 384.5355       30.27769 398.1840       21.19831 176.1891 7.066259 180.0760 4.835065 -3.886978      8.562119 
1 1 1 -16 23 4  o 176.4432 4.006172 381.1463       17.22546 405.6822       31.91345 371.0594       20.46211 180.9158 7.253414 173.8381 4.834944 7.077713       8.717150 
1 1 1 -16 23 5  o 88.52197 3.580462 95.99664       7.707776 87.43333       13.67695 99.98214       9.330596 83.88622 6.747434 90.24493 4.254760 -6.358719      7.976894 
1 1 1 -16 23 6  o 213.5888 4.452546 559.1223       23.17517 608.2618       42.51045 538.3417       27.64447 221.2624 7.896760 209.2173 5.426768 12.04509       9.581681 
1 1 1 -16 23 7  o 86.20187 3.659062 91.06287       7.668910 76.21957       13.09242 98.81575       9.462061 78.23830 6.938842 89.70042 4.341569 -11.46213      8.185154 
1 1 1 -16 23 8  o 44.71328 4.538242 24.75840       4.876507 25.80653       7.918258 24.11797       6.189571 45.07552 7.470029 43.87177 5.942092 1.203758       9.545145 
1 1 1 -16 23 9  o 37.83049 5.511236 17.95826       4.931508 12.69010       7.254403 22.48442       6.724153 31.48733 9.002636 42.15425 6.775290 -10.66692      11.26730 
1 1 1 -16 23 10 o 116.5792 3.237776 166.2671       9.189316 154.2866       13.79230 175.8307       12.32281 111.9657 5.068076 119.7187 4.230532 -7.752975      6.601727 
1 1 1 -16 23 11 o 54.70364 3.494308 36.75269       4.633796 40.43477       8.652622 35.27202       5.486951 56.89992 6.348237 53.48336 4.244735 3.416561       7.636615 
1 1 1 -16 23 12 o 16.63993 6.361380 2.358275       3.595826 0.5052412      6.926255 3.041996       4.207230 19.72803 8.348834 18.30722 6.908352 1.420811       10.83644 
1 1 1 -16 23 13 o 163.3363 3.095402 326.1419       12.32071 316.4415       20.47142 331.6512       15.42771 160.3109 5.247280 164.5623 3.847114 -4.251373      6.506476 
1 1 1 -16 23 14 o 175.4813 3.183256 376.5805       13.61252 401.2331       23.53125 364.1812       16.68831 180.4540 5.357020 172.3927 3.972441 8.061386       6.669179 
1 1 1 -16 23 15 o 56.02322 3.765310 38.61986       5.110642 50.20332       14.02592 36.84652       5.487916 62.48385 9.511113 54.65738 4.151287 7.826466       10.37759 
1 1 1 -16 23 16 o 44.17261 3.937658 24.11086       4.194256 40.68832       8.476044 18.73539       4.826610 57.02219 6.199435 38.65298 5.260555 18.36922       8.130586 
1 1 1 -16 23 17 o 89.88928 2.897003 98.91534       6.337609 89.92974       11.43118 102.9030       7.615116 85.16721 5.537883 91.60184 3.417420 -6.434631      6.507450 
1 1 1 -16 23 18 o 50.59413 3.504134 31.51905       4.293637 26.32358       8.365108 33.37743       5.002946 45.21910 7.877378 51.99469 3.978710 -6.775585      8.825147 
1 1 1 -16 23 19 o 100.9266 3.225861 124.9117       7.923718 118.0812       12.38087 129.6504       10.31227 97.61764 5.223614 102.6166 4.132283 -4.998917      6.660473 
1 1 1 -16 23 20 o 162.3498 3.911131 323.9984       15.47357 310.8181       29.00860 329.2399       18.29340 156.9405 7.607662 163.3204 4.600986 -6.379898      8.890759 
1 1 1 -16 23 21 f 35.00874 5.423263 15.55100       4.477206 16.45401       10.99444 15.37149       4.902079 35.35848 11.30034 34.65104 6.023899 0.7074356      12.80567 
1 1 1 -16 23 22 f 86.59469 2.865895 92.00108       6.039333 86.24250       11.39585 94.25005       7.121659 83.00515 5.667862 87.53925 3.344582 -4.534103      6.581101 
1 1 1 -16 23 23 o 28.34868 5.014327 10.26781       3.337323 8.791710       7.869348 10.59151       3.685127 27.11261 9.566231 28.69340 5.469894 -1.580790      11.01964 
1 1 1 -16 23 24 o 21.21683 5.867731 5.832068       3.135751 12.23513       7.498634 4.475052       3.452079 30.30401 9.281627 19.18624 6.346792 11.11778       11.24413 
1 1 1 -16 23 25 o 47.61473 3.650711 28.16147       4.203681 23.40862       12.00204 28.82605       4.487961 40.42017 11.58703 48.12313 3.859334 -7.702957      12.21285 
1 1 1 -16 23 26 o 30.33119 5.519332 11.93548       3.929307 11.12041       7.715699 12.22089       4.565713 28.85285 9.486083 30.43861 6.360547 -1.585754      11.42113 
1 1 1 -16 23 27 o 66.71023 3.416410 55.22014       5.535409 48.09570       9.213271 59.24454       6.924513 60.93856 6.294691 68.81435 4.148545 -7.875786      7.538804 
1 1 1 -16 23 28 o 42.96553 4.220483 23.32390       4.361979 17.60153       7.472814 26.28127       5.372159 35.31401 8.733031 45.34435 4.941579 -10.03033      10.03419 
1 1 1 -16 23 29 o 63.33519 4.058527 50.52975       6.231006 50.05603       8.975620 50.97044       8.656963 61.84138 6.032531 62.61097 5.737589 -0.7695847     8.325345 
1 1 1 -16 23 30 o 39.59574 4.613070 20.18828       4.367906 14.17548       7.542470 23.22226       5.357745 30.88503 9.277650 42.13601 5.337433 -11.25098      10.70341 
1 1 1 -16 23 31 o 28.94434 7.475287 12.01636       5.309312 9.277082       6.976144 15.78712       8.184875 25.45638 9.004706 31.85968 9.685083 -6.403294      13.22443 
1 1 1 -16 23 32 o 19.61173 6.666502 5.158523       3.806180 -4.166190      6.411291 10.23362       4.729878 14.98228 7.015152 26.61255 7.144126 -11.63027      10.01254 
1 1 1 -16 23 33 f 74.00074 3.801306 69.94001       6.831989 58.87809       13.68809 73.61004       7.884278 61.17038 9.489887 75.43490 4.306873 -14.26451      10.42147 
1 1 1 -16 23 34 o 45.83395 4.649172 27.77733       5.121008 26.56890       11.73923 28.06134       5.691053 37.05987 11.65661 45.62377 5.212178 -8.563900      12.76884 
1 1 1 -16 23 35 o 24.02609 6.506504 8.528618       3.902582 7.263786       6.751648 9.163235       4.782440 22.10740 8.644489 24.37858 7.401678 -2.271181      11.38034 
1 1 1 -16 23 36 o 47.29171 4.147365 29.56569       4.731286 34.78382       7.942161 26.69520       5.890590 48.16244 6.969322 43.48204 5.696032 4.680397       9.000901 
1 1 1 -16 23 37 o 31.44996 6.344195 14.83967       4.694267 22.23109       10.17102 12.83904       5.291564 31.77928 10.89552 27.97569 7.576549 3.803587       13.27089 
1 1 1 -16 23 38 o 37.45489 5.865410 20.64460       5.177993 13.94855       7.033623 28.56737       7.650825 26.85794 9.062886 41.53347 7.846650 -14.67553      11.98774 
1 1 1 -16 23 39 o 16.65073 6.529872 3.832799       3.861911 -1.286450      6.571061 6.534081       4.773284 15.14351 7.094310 19.85165 7.385689 -4.708141      10.24098 
1 1 1 -16 24 1  o 58.21708 2.919201 41.52824       4.128218 51.46998       6.330160 34.17095       5.445555 64.67721 4.036432 52.60951 4.284648 12.06770       5.886510 
1 1 1 -16 24 2  o 98.88564 3.073888 119.6621       7.398261 131.4598       14.83185 115.7545       8.536009 103.0586 5.930797 97.17573 3.610913 5.882866       6.943561 
1 1 1 -16 24 3  o 120.2956 3.130826 177.0491       9.170132 201.6207       19.11280 169.7013       10.45168 127.6425 6.162799 117.6841 3.648861 9.958450       7.162002 
1 1 1 -16 24 4  o 128.2666 3.705978 201.5866       11.57170 0.000000       0.000000 201.5866       11.57170 ?        ?        128.2666 3.705978 0.000000       3.705978 
1 1 1 -16 24 5  o 73.74444 3.358692 66.65659       6.019965 83.76270       12.58709 61.58335       6.854769 82.11033 6.339653 70.78825 3.989855 11.32208       7.490671 
1 1 1 -16 24 6  o 143.8296 3.291218 253.0023       11.53563 246.9905       23.10624 254.9982       13.31348 141.1207 6.738436 144.2592 3.790430 -3.138519      7.731357 
1 1 1 -16 24 7  o 136.8842 3.251271 229.1403       10.84532 258.6286       23.05705 220.7625       12.28974 144.4735 6.566232 134.2238 3.761017 10.24966       7.567077 
1 1 1 -16 24 8  o 183.7541 3.765136 413.4588       16.85986 420.0484       24.60318 407.6246       23.15000 184.6267 5.474452 181.9642 5.226116 2.662476       7.568481 
1 1 1 -16 24 9  o 195.5963 3.376008 468.0468       16.09164 472.1249       26.67262 465.7131       20.17727 195.6770 5.599336 194.8779 4.248776 0.7991486      7.028845 
1 1 1 -16 24 10 o 129.2904 2.962387 204.3274       9.333496 207.6440       16.06548 202.6377       11.46723 129.8358 5.087504 128.5950 3.663035 1.240784       6.269013 
1 1 1 -16 24 11 o 71.38194 3.623352 62.54864       6.282205 72.08619       10.25909 56.82664       7.946293 76.28091 5.557074 67.82697 4.839368 8.453949       7.368891 
1 1 1 -16 24 12 o 39.69390 4.440898 19.58085       4.222131 21.50886       8.108379 18.86362       4.945498 40.74498 8.443954 38.77243 5.378889 1.972557       10.01163 
1 1 1 -16 24 13 f 134.4211 2.949652 220.9438       9.662159 226.7251       16.92090 218.1468       11.76968 135.5891 5.130346 133.3988 3.623922 2.190292       6.281183 
1 1 1 -16 24 14 o 175.8080 3.536118 378.6301       15.14961 376.5247       33.28004 379.1805       17.01475 173.3110 7.900699 175.8128 3.971359 -2.501831      8.842665 
1 1 1 -16 24 15 o 170.3453 3.541730 355.5935       14.70218 393.6107       23.09007 329.6704       19.06686 178.5077 5.313933 163.5646 4.788743 14.94307       7.153317 
1 1 1 -16 24 16 o 66.67175 3.159177 54.54604       5.118170 48.74310       9.211007 57.13802       6.156005 62.39266 6.137475 68.14941 3.720931 -5.756756      7.177320 
1 1 1 -16 24 17 o 80.32650 2.974815 79.09351       5.813049 98.72231       11.17243 71.80717       6.806994 89.24308 5.159320 76.41046 3.666363 12.83262       6.329360 
1 1 1 -16 24 18 f 140.7845 3.754646 243.6422       12.86980 294.2575       26.67633 228.2877       14.69277 152.9824 7.175633 136.0346 4.438130 16.94785       8.437222 
1 1 1 -16 24 19 o 120.6170 3.724132 178.9904       10.93325 173.0830       20.99726 181.1878       12.80629 116.9585 7.405091 121.1457 4.344932 -4.187263      8.585674 
1 1 1 -16 24 20 o 14.93873 5.912666 1.582384       3.192302 -9.060499      7.066923 4.310880       3.578182 14.68525 7.017983 19.12523 6.464084 -4.439983      9.541304 
1 1 1 -16 24 21 o 26.37497 5.480578 8.976088       3.407366 12.03272       7.346692 8.138390       3.846037 30.23708 9.172486 24.98928 6.314262 5.247799       11.13573 
1 1 1 -16 24 22 o 35.63419 4.165840 15.90609       3.549292 15.53999       7.601850 16.00815       4.013624 33.92915 9.034112 35.60872 4.743206 -1.679569      10.20359 
1 1 1 -16 24 23 f 76.61175 2.929723 72.21430       5.459551 80.73196       10.70496 69.22002       6.347037 80.04785 5.521643 74.85227 3.489206 5.195580       6.531699 
1 1 1 -16 24 24 o 37.15574 4.421317 17.40461       3.924835 7.761774       11.35987 18.71170       4.182393 28.02131 11.13346 38.50817 4.544358 -10.48686      12.02519 
1 1 1 -16 24 25 o 10.71526 4.902527 -1.819889      2.872874 -8.017483      6.646929 -0.3961844     3.185807 14.26158 6.812982 12.64487 5.509313 1.616717       8.761806 
1 1 1 -16 24 26 o 35.58057 4.182895 16.00420       3.557621 12.01727       7.314047 17.23983       4.071758 29.46027 9.191461 36.79716 4.644023 -7.336897      10.29805 
1 1 1 -16 24 27 o 35.43033 4.207201 15.93417       3.561653 11.16382       7.228567 17.46358       4.092968 28.30171 9.173834 36.95688 4.647229 -8.655170      10.28377 
1 1 1 -16 24 28 o 58.66291 6.300589 45.42215       8.866018 45.42215       8.866018 0.000000       0.000000 58.66291 6.300589 ?        ?        0.000000       6.300589 
1 1 1 -16 24 29 o 37.91434 4.623619 18.54763       4.183654 23.53286       7.229182 16.03724       5.129993 41.09947 7.494032 34.39541 6.354425 6.704060       9.825438 
1 1 1 -16 24 30 o 20.07251 7.597226 4.790967       5.096924 16.65211       6.885606 -9.585804      7.580705 33.52876 8.435719 14.49927 7.014756 19.02949       10.97124 
1 1 1 -16 24 31 o 52.51271 3.938968 35.25687       5.003875 35.51051       8.361483 35.11535       6.245749 50.28926 7.013473 51.66247 5.024438 -1.373203      8.627501 
1 1 1 -16 24 32 o 18.10732 6.603393 4.142524       3.783867 8.427794       6.590854 2.035676       4.621353 23.91074 8.715776 16.58901 6.906569 7.321733       11.12050 
1 1 1 -16 24 33 o 18.96379 6.718825 4.866799       3.885153 7.584233       6.800832 3.550299       4.733616 22.82712 8.743070 17.98439 7.173305 4.842724       11.30918 
1 1 1 -16 24 34 o 36.60365 5.668663 18.67133       4.893064 14.34942       10.91618 19.75802       5.473756 27.41101 10.90642 37.17786 6.264221 -9.766848      12.57738 
1 1 1 -16 24 35 o 16.48722 6.581203 3.075789       3.987480 2.042344       6.826368 3.611037       4.912743 17.96320 7.937438 17.72688 7.222966 0.2363167      10.73192 
1 1 1 -16 24 36 o 42.31628 5.295542 25.14590       5.341542 21.46009       10.62238 26.39335       6.179698 30.82866 11.08871 42.43227 6.155860 -11.60361      12.68283 
1 1 1 -16 24 37 o 19.80165 7.428057 6.200356       4.848257 -2.304543      6.682675 15.65135       7.044571 15.03568 7.078494 28.77066 9.027104 -13.73498      11.47143 
1 1 1 -16 24 38 o 15.93200 6.439672 3.143195       3.868769 -2.036166      6.517465 5.961133       4.807357 14.80679 6.976817 19.28297 7.359403 -4.476181      10.14085 
1 1 1 -16 25 1  f 18.05729 6.055274 3.802033       3.140119 1.085871       4.869479 5.735566       4.108473 17.19534 7.118196 21.65862 6.906363 -4.463276      9.917993 
1 1 1 -16 25 2  o 24.36963 6.264566 7.633495       3.740590 1.861611       6.852713 10.08318       4.464354 20.56847 8.472463 27.95733 6.650116 -7.388863      10.77064 
1 1 1 -16 25 3  o 16.91690 6.398530 2.581341       3.613988 7.634759       7.005429 0.7487162      4.218703 25.87515 9.033868 15.85102 6.599039 10.02413       11.18741 
1 1 1 -16 25 4  o 77.23412 3.345578 73.15189       6.281815 88.84411       13.00326 68.37471       7.174562 84.46104 6.364535 74.56666 3.962569 9.894379       7.497283 
1 1 1 -16 25 5  o 39.47462 4.678706 19.41664       4.413285 14.77139       8.563862 21.09640       5.149769 33.77174 9.820190 41.05378 5.268842 -7.282040      11.14436 
1 1 1 -16 25 6  o 66.25426 3.542892 53.91119       5.699355 59.51900       11.68649 52.16122       6.528335 68.85271 7.065210 65.07255 4.138324 3.780159       8.187974 
1 1 1 -16 25 7  o 123.0960 3.241863 185.5536       9.716204 203.1677       20.25318 180.2878       11.07370 127.8550 6.521934 121.2324 3.752853 6.622665       7.524595 
1 1 1 -16 25 8  o 129.4802 3.230929 205.1635       10.19452 200.7863       20.45011 206.6110       11.75994 127.0478 6.628222 129.7918 3.721947 -2.744034      7.601725 
1 1 1 -16 25 9  o 40.68300 4.451552 20.57247       4.341312 22.39748       8.040612 19.82154       5.157702 41.60415 8.222409 39.72280 5.473543 1.881351       9.877636 
1 1 1 -16 25 10 f 133.4687 3.438503 218.3160       11.17437 221.6575       16.75488 215.6389       14.99676 134.0107 5.140104 132.3280 4.657873 1.682693       6.936602 
1 1 1 -16 25 11 o 87.29670 2.978801 93.33373       6.327595 105.8779       11.50531 87.89423       7.576295 92.53421 5.122213 84.59532 3.683977 7.938889       6.309418 
1 1 1 -16 25 12 o 13.85631 5.917933 -0.3208284E-01 3.535511 4.024015       6.761526 -1.558363      4.147703 22.20643 8.660172 13.73512 6.121402 8.471306       10.60519 
1 1 1 -16 25 13 o 66.68875 3.157482 54.57541       5.116753 65.48113       9.889593 50.58891       5.979253 72.53365 5.639313 64.08932 3.846166 8.444336       6.826042 
1 1 1 -16 25 14 o 100.6665 3.221241 124.2687       7.891960 96.85283       17.88558 130.8970       8.794390 87.14641 8.531215 103.2600 3.499982 -16.11356      9.221252 
1 1 1 -16 25 15 o 164.8987 3.963379 334.2293       15.92644 330.4862       29.54919 335.7620       18.90787 161.9992 7.505482 164.9158 4.709658 -2.916595      8.860764 
1 1 1 -16 25 16 o 43.51805 4.915658 23.69373       5.121857 30.68403       11.20235 21.84625       5.759053 48.01528 9.902960 41.53630 5.851644 6.478981       11.50262 
1 1 1 -16 25 17 o 89.94539 3.204190 99.35287       7.011950 115.3706       16.46960 95.80664       7.749379 95.50917 7.127624 88.22967 3.611897 7.279503       7.990545 
1 1 1 -16 25 18 o 47.83004 4.045551 28.38778       4.671176 31.83939       8.197016 26.72783       5.684496 49.85928 6.933787 46.14123 5.142848 3.718052       8.632861 
1 1 1 -16 25 19 o 78.67341 2.961450 76.02621       5.667512 91.41689       10.81106 70.19363       6.655331 85.58754 5.208134 75.43697 3.631001 10.15057       6.348924 
1 1 1 -16 25 20 o 28.10783 5.288778 10.15419       3.489675 9.680386       7.283742 10.29535       3.975669 27.65189 9.221390 28.14526 5.981131 -0.4933701     10.99127 
1 1 1 -16 25 21 o 51.55442 3.457772 32.89020       4.318966 27.15832       8.542575 34.85845       5.005878 45.29684 8.033119 52.97127 3.905425 -7.674427      8.932153 
1 1 1 -16 25 22 o 30.11246 4.933514 11.59858       3.494996 16.86530       7.494684 10.13498       3.950885 35.16892 8.774179 27.82813 6.002641 7.340794       10.63099 
1 1 1 -16 25 23 o 17.66079 6.113348 3.654023       3.204654 5.273584       6.679798 3.169812       3.652430 22.66524 8.668940 17.45782 6.467089 5.207415       10.81544 
1 1 1 -16 25 24 o 58.41013 3.484434 42.37698       4.937171 38.14436       13.23794 43.06084       5.321093 51.38981 10.90855 58.79916 3.732859 -7.409351      11.52956 
1 1 1 -16 25 25 o 30.77003 4.761152 12.17320       3.454882 9.827429       7.069553 12.90921       3.959965 27.03148 9.085873 31.50352 5.349288 -4.472042      10.54362 
1 1 1 -16 25 26 o 17.33557 6.008399 3.611332       3.095997 8.362217       6.420133 2.171750       3.534068 25.09908 8.654510 15.88963 6.242013 9.209446       10.67067 
1 1 1 -16 25 27 o 60.75998 3.794564 46.39619       5.590391 45.69197       8.680935 46.89518       7.307335 58.88322 6.139866 60.41542 5.008318 -1.532192      7.923460 
1 1 1 -16 25 28 o 17.39596 6.440918 3.431926       3.622105 2.546999       6.459311 3.837824       4.374627 19.40915 8.129166 18.58517 7.037433 0.8239841      10.75215 
1 1 1 -16 25 29 o 62.44635 3.844405 49.46402       5.821861 42.96242       8.853473 54.41718       7.727602 56.09326 6.603252 64.69756 4.938734 -8.604294      8.245850 
1 1 1 -16 25 30 o 17.40159 6.479232 3.579935       3.674899 2.729136       6.489068 3.981638       4.458832 19.14871 8.091259 18.51965 7.082812 0.6290531      10.75336 
1 1 1 -16 25 31 f 27.58716 6.191836 10.71607       4.060166 8.072789       6.381695 12.51360       5.262642 23.51512 8.575632 29.09242 7.405312 -5.577297      11.33049 
1 1 1 -16 25 32 o 14.14834 6.064517 0.7468441      3.737303 -2.331697      6.425873 2.320503       4.594253 15.61465 7.212342 16.67050 6.908719 -1.055857      9.987406 
1 1 1 -16 25 33 o 19.13734 7.191125 4.939714       4.548047 19.92569       11.21307 1.988873       4.975711 31.26224 11.37243 16.58560 7.049964 14.67664       13.38036 
1 1 1 -16 25 34 o 18.28342 6.744640 4.611453       3.965371 4.335998       6.982435 4.742584       4.817647 19.58455 8.339032 18.80628 7.316912 0.7782745      11.09399 
1 1 1 -16 25 35 o 29.84614 6.548242 13.49876       4.631493 12.28697       9.085693 13.92420       5.383462 24.95526 9.943242 29.38670 7.494990 -4.431438      12.45162 
1 1 1 -16 25 36 o 14.66131 6.194589 1.778673       3.802896 -1.383835      6.147786 3.738805       4.840003 14.98590 6.967697 17.34494 7.129944 -2.359042      9.969197 
1 1 1 -16 25 37 f 14.33217 6.358716 0.7623894      4.424552 -2.212802      6.095242 4.076376       6.432930 14.35987 6.760305 18.18070 7.875679 -3.820826      10.37921 
1 1 1 -16 26 1  o 85.56794 2.720656 89.65463       5.665895 88.67905       8.384970 90.47437       7.686133 84.84304 4.067391 85.78308 3.685398 -0.9400406     5.488700 
1 1 1 -16 26 2  o 44.79126 4.146416 24.86776       4.474507 26.87132       8.622725 24.12942       5.234428 45.58990 8.055950 43.95072 4.974637 1.639175       9.468122 
1 1 1 -16 26 3  o 101.3391 3.635901 126.1299       8.964393 0.000000       0.000000 126.1299       8.964393 ?        ?        101.3391 3.635901 0.000000       3.635901 
1 1 1 -16 26 4  o 39.85866 4.666079 19.82634       4.446538 14.00898       8.271267 22.19094       5.273362 32.81317 9.681361 42.07301 5.257834 -9.259842      11.01697 
1 1 1 -16 26 5  o 26.73146 6.486426 9.235798       4.181890 11.50763       8.086914 8.406528       4.885876 30.23417 9.694614 25.62486 7.407548 4.609316       12.20071 
1 1 1 -16 26 6  o 92.62334 3.198977 105.1877       7.209669 112.7494       14.77609 102.8250       8.259596 95.02151 6.418856 91.47670 3.712920 3.544807       7.415355 
1 1 1 -16 26 7  o 68.03638 4.091024 57.07403       6.751473 44.34209       10.82605 65.17712       8.636712 58.99917 7.714494 72.54016 4.914798 -13.54099      9.147058 
1 1 1 -16 26 8  f 18.97558 6.598850 4.050415       3.735871 1.902556       7.512603 4.756050       4.306034 21.33449 8.837448 20.45190 7.086071 0.8825912      11.32753 
1 1 1 -16 26 9  o 55.59546 3.754741 38.10486       5.057087 30.74272       10.09395 40.57205       5.843330 48.57981 8.852523 57.29026 4.214972 -8.710445      9.804751 
1 1 1 -16 26 10 o 62.32985 3.946251 47.91732       5.963229 48.27525       9.502136 47.68476       7.659281 61.96641 6.383826 61.92273 5.121530 0.4368210E-01  8.184332 
1 1 1 -16 26 11 o 106.3022 4.616127 139.5726       11.92943 143.5959       17.82032 136.3057       16.05842 106.9579 6.873394 104.4257 6.340312 2.532257       9.351102 
1 1 1 -16 26 12 o 168.4829 4.012883 349.1187       16.47587 325.5315       29.06552 360.2862       19.99938 160.7259 7.441086 170.7448 4.811342 -10.01895      8.861082 
1 1 1 -16 26 13 o 90.58465 4.336060 101.3524       9.543838 0.000000       0.000000 101.3524       9.543838 ?        ?        90.58465 4.336060 0.000000       4.336060 
1 1 1 -16 26 14 o 119.5601 3.201006 175.4459       9.317900 177.1601       20.26948 174.9866       10.49226 118.5071 7.050660 119.2847 3.613676 -0.7776260     7.922781 
1 1 1 -16 26 15 o 54.09558 3.549908 36.11395       4.653808 37.49640       8.969401 35.60468       5.443923 54.18731 6.952496 53.57478 4.203439 0.6125259      8.124413 
1 1 1 -16 26 16 o 90.13763 2.961355 99.73428       6.495952 110.7288       11.89054 95.05687       7.755608 94.27155 5.195982 87.83195 3.631323 6.439606       6.339143 
1 1 1 -16 26 17 f 52.54351 4.064248 34.27200       5.163551 35.20429       8.773328 33.77792       6.386896 52.31928 7.061348 51.88274 5.118213 0.4365425      8.721166 
1 1 1 -16 26 18 o 30.09492 5.389228 11.62776       3.807206 5.051066       6.852421 14.56447       4.578999 22.87737 8.772679 33.65453 5.792195 -10.77716      10.51235 
1 1 1 -16 26 19 o 101.5543 2.884077 126.7470       7.130191 123.9649       12.49761 128.0896       8.681794 99.49449 5.172323 101.8850 3.501945 -2.390472      6.246322 
1 1 1 -16 26 20 o 47.85543 3.626858 28.43662       4.198095 25.70094       8.233512 29.39769       4.880109 43.95021 7.981433 48.51876 4.167813 -4.568554      9.004107 
1 1 1 -16 26 21 o 87.86919 2.935967 95.10538       6.277889 92.49359       11.50196 96.21361       7.492330 85.47318 5.552167 88.18264 3.493478 -2.709465      6.559798 
1 1 1 -16 26 22 o 40.65849 4.045643 20.74933       3.955304 24.74350       7.700048 19.31767       4.609985 42.99365 7.628791 38.92679 4.973186 4.066856       9.106647 
1 1 1 -16 26 23 o 79.61313 3.263876 78.51493       6.318771 61.99189       14.86273 82.16028       6.981091 66.89537 9.374251 81.33060 3.530767 -14.43523      10.01713 
1 1 1 -16 26 24 o 12.34862 5.385921 -0.3496693     3.051561 -5.967359      6.447484 1.272007       3.464125 14.69630 6.929205 14.78242 6.049274 -0.8611584E-01 9.198238 
1 1 1 -16 26 25 o 8.782207 4.270916 -4.864275      2.906866 -0.1554788     6.219848 -6.180187      3.288048 17.46118 7.650845 9.009700 4.415957 8.451484       8.833805 
1 1 1 -16 26 26 o 14.00475 6.043446 0.1196648      3.759112 -1.615225      6.257408 1.099339       4.702181 16.47914 7.417908 16.30321 6.888243 0.1759243      10.12291 
1 1 1 -16 26 27 o 40.41018 5.859385 21.80876       5.601923 27.25355       7.710318 15.72108       8.152819 44.16538 7.427300 31.99864 9.653218 12.16674       12.17988 
1 1 1 -16 26 28 o 46.88541 4.511105 28.43427       5.090604 31.13525       7.833511 26.45981       6.697609 47.26682 7.013220 43.94585 6.445611 3.320965       9.525291 
1 1 1 -16 26 29 o 11.90783 5.305579 -0.7025993     3.113618 -2.178058      6.089867 -0.1804000     3.622951 15.54244 7.121114 13.28652 5.829905 2.255919       9.203155 
1 1 1 -16 26 30 o 23.74765 5.980284 7.928000       3.458261 1.414646       6.005188 11.15987       4.230107 17.55194 7.606303 28.06555 6.335673 -10.51361      9.899323 
1 1 1 -16 26 31 o 25.97302 6.551479 9.798653       4.145546 2.876873       6.707725 14.07636       5.273173 18.99703 8.133362 30.81941 7.158504 -11.82238      10.83493 
1 1 1 -16 26 32 o 21.54821 6.820134 6.877674       4.012830 11.17655       6.749771 4.527643       4.990551 25.89643 8.875943 18.91268 7.421169 6.983751       11.56962 
1 1 1 -16 26 33 o 18.60124 6.925249 4.797572       4.198067 4.552778       7.315456 4.917770       5.126149 19.90112 8.506480 19.12456 7.516199 0.7765522      11.35136 
1 1 1 -16 26 34 o 20.85264 7.087737 6.779020       4.302366 8.484185       8.690173 6.225365       4.951822 22.40904 9.410141 20.14784 7.517326 2.261200       12.04412 
1 1 1 -16 26 35 o 22.59514 6.690938 8.045497       3.944788 16.54736       7.073369 4.207494       4.752497 29.85933 8.987879 17.76593 7.152803 12.09339       11.48671 
1 1 1 -16 26 36 o 17.70360 7.065858 4.416739       4.595820 4.174166       6.576611 4.648255       6.424985 18.35146 7.956347 18.61801 7.965340 -0.2665558     11.25834 
1 1 1 -16 27 1  o 98.40852 2.959105 118.7905       7.088193 121.8707       9.737849 115.3192       10.33743 99.39598 4.028645 96.56706 4.404459 2.828918       5.969024 
1 1 1 -16 27 2  o 109.2920 3.718363 147.0092       9.888790 137.2665       16.90418 152.0779       12.19273 104.4471 6.676388 110.8990 4.521149 -6.451874      8.063185 
1 1 1 -16 27 3  o 82.28598 3.702578 83.38273       7.405464 95.17729       12.88547 77.56568       9.049216 87.15758 6.105408 79.09547 4.716283 8.062103       7.714877 
1 1 1 -16 27 4  o 107.8514 4.468892 143.7393       11.71979 0.000000       0.000000 143.7393       11.71979 ?        ?        107.8514 4.468892 0.000000       4.468892 
1 1 1 -16 27 5  f 50.76782 4.538106 32.04914       5.555205 32.37504       9.402411 31.87437       6.885499 50.01885 7.981934 50.33507 5.714449 -0.3162193     9.816628 
1 1 1 -16 27 6  o 40.08662 7.226664 20.77332       6.799842 27.63228       8.772185 10.44742       10.76323 46.09026 8.106006 30.40383 11.12930 15.68642       13.76840 
1 1 1 -16 27 7  o 58.82993 4.331988 42.88728       6.166875 44.26404       10.74567 42.21115       7.530409 58.75411 7.689508 58.09987 5.379813 0.6542397      9.384611 
1 1 1 -16 27 8  o 40.93843 5.349290 21.12190       5.209056 11.92934       8.846763 26.00022       6.444682 30.72638 10.16013 45.31887 5.981514 -14.59249      11.79011 
1 1 1 -16 27 9  o 43.34566 4.610319 23.45726       4.795194 27.89918       9.624066 21.99038       5.530577 46.00192 8.907017 41.71789 5.579967 4.284035       10.51052 
1 1 1 -16 27 10 o 76.46048 3.367366 71.90520       6.258884 73.16064       13.06106 71.53097       7.130970 75.91078 7.144562 76.15049 3.855272 -0.2397079     8.118367 
1 1 1 -16 27 11 o 92.95335 3.044075 106.0599       6.886054 114.7764       12.21658 102.0009       8.336590 96.01843 5.240933 90.97625 3.768475 5.042183       6.455136 
1 1 1 -16 27 12 o 124.1042 3.003193 188.8713       9.082509 179.0009       15.23104 194.3179       11.31424 119.9366 5.223775 125.6203 3.700012 -5.683678      6.401400 
1 1 1 -16 27 13 o 83.87999 3.561178 86.69055       7.262713 75.07414       11.22318 95.05974       9.526237 77.24637 6.009378 87.56467 4.479214 -10.31830      7.495064 
1 1 1 -16 27 14 o 88.01810 3.006848 95.17941       6.439934 114.2492       12.26328 87.91804       7.567346 95.64594 5.281943 84.41334 3.687614 11.23260       6.441849 
1 1 1 -16 27 15 o 90.34210 2.951692 100.2814       6.489540 116.4196       11.93065 93.50022       7.733699 96.57407 5.087470 87.03652 3.654408 9.537552       6.263948 
1 1 1 -16 27 16 o 31.56822 5.196096 12.73981       3.858316 4.892223       6.819971 16.43381       4.679099 22.66714 8.736412 35.84908 5.534053 -13.18193      10.34169 
1 1 1 -16 27 17 o 84.59704 3.330076 88.27628       6.851665 94.52229       10.98299 84.29665       8.766774 86.78662 5.217248 82.29624 4.387287 4.490379       6.816741 
1 1 1 -16 27 18 o 17.14391 6.304620 3.071569       3.460344 2.200686       6.644273 3.395696       4.053452 20.12810 8.321892 18.24216 6.802307 1.885946       10.74827 
1 1 1 -16 27 19 o 32.98218 4.874158 13.88328       3.799704 14.87920       7.477489 13.53660       4.411759 32.85769 9.050900 32.26448 5.825459 0.5932083      10.76359 
1 1 1 -16 27 20 o 45.56684 3.851222 25.94576       4.236446 22.73804       7.954446 27.21590       5.005405 40.87402 8.270263 46.47845 4.474511 -5.604427      9.403111 
1 1 1 -16 27 21 o 51.60006 3.531973 33.14934       4.414454 29.75666       8.301991 34.48673       5.212417 47.18238 7.468877 52.43975 4.111754 -5.257370      8.525881 
1 1 1 -16 27 22 o 65.33009 3.189005 52.94210       5.061630 61.51688       9.530038 49.57275       5.973876 69.13176 5.707743 62.92904 3.914942 6.202724       6.921351 
1 1 1 -16 27 23 o 43.15406 4.188944 23.57629       4.349815 30.10535       12.55464 22.68561       4.637029 44.05449 11.55387 42.16832 4.586298 1.886169       12.43085 
1 1 1 -16 27 24 o 55.35867 3.363132 38.28468       4.515563 37.57461       8.282431 38.58502       5.386524 53.08828 6.540205 55.28412 4.025861 -2.195843      7.679963 
1 1 1 -16 27 25 f 18.31495 6.695205 3.942864       3.893268 3.715990       6.110303 4.097920       5.051417 20.05533 8.097750 19.48364 7.516322 0.5716858      11.04847 
1 1 1 -16 27 26 o 42.47891 4.694843 23.40116       4.778937 35.93900       7.781105 15.80735       6.055633 51.57737 6.322892 33.19439 7.644090 18.38299       9.920236 
1 1 1 -16 27 27 o 25.57293 6.548114 9.221652       4.097915 13.60048       6.845654 6.776257       5.115766 29.78609 8.812626 22.14699 7.720710 7.639093       11.71630 
1 1 1 -16 27 28 o 33.24407 4.678497 14.56780       3.685444 14.11431       6.832503 14.75389       4.376750 30.10359 8.776685 32.91132 5.661312 -2.807734      10.44417 
1 1 1 -16 27 29 o 14.22055 5.873408 1.379380       3.305062 -1.685037      6.114274 2.644414       3.928458 15.69388 7.169665 16.38852 6.535469 -0.6946363     9.701363 
1 1 1 -16 27 30 o 68.77022 3.167381 59.83149       5.293818 58.95319       9.196019 60.26681       6.474142 65.48408 5.823402 68.37452 3.901741 -2.890442      7.009679 
1 1 1 -16 27 31 o 43.04528 3.921628 24.14311       4.068535 23.54239       7.619878 24.38267       4.811849 38.43655 8.372677 42.66914 4.705727 -4.232594      9.604456 
1 1 1 -16 27 32 o 41.63885 5.985700 24.77928       5.899320 0.000000       0.000000 24.77928       5.899320 ?        ?        41.63885 5.985700 0.000000       5.985700 
1 1 1 -16 27 33 o 36.37765 5.670103 18.95233       4.862642 21.27499       9.617131 18.15458       5.636183 31.91123 10.59475 34.31718 6.977627 -2.405951      12.68605 
1 1 1 -16 27 34 o 16.90272 6.578943 3.798730       3.896089 2.394090       6.598622 4.550493       4.827379 17.49235 7.762821 18.14715 7.242079 -0.6548023     10.61645 
1 1 1 -16 27 35 o 19.98445 6.954110 6.401079       4.149289 7.435605       6.763448 5.776736       5.254229 20.82141 8.478292 19.24820 7.595792 1.573215       11.38321 
1 1 1 -16 28 1  o 126.0162 2.795606 194.7332       8.584961 182.2135       12.75917 205.0897       11.60471 121.2870 4.323819 128.9651 3.696359 -7.678085      5.688451 
1 1 1 -16 28 2  o 85.44457 3.085181 89.74626       6.413390 82.43993       11.11179 93.39600       7.853539 81.04197 5.662116 86.99656 3.713018 -5.954590      6.770972 
1 1 1 -16 28 3  o 43.48307 4.329976 23.59529       4.527278 22.47421       8.374698 24.05820       5.381377 41.08819 8.638620 43.70177 5.152004 -2.613579      10.05828 
1 1 1 -16 28 4  o 22.09339 6.756340 6.198590       3.975329 20.04818       7.728483 1.215953       4.635595 38.84796 8.408129 16.81908 6.952165 22.02888       10.91005 
1 1 1 -16 28 5  o 16.85933 6.589112 2.274206       3.921100 0.4083779      7.288075 3.034311       4.651724 19.81996 8.481622 18.66362 7.209407 1.156340       11.13164 
1 1 1 -16 28 6  o 56.45087 5.933110 40.27267       8.040004 0.000000       0.000000 40.27267       8.040004 ?        ?        56.45087 5.933110 0.000000       5.933110 
1 1 1 -16 28 7  o 67.58517 3.409517 56.29325       5.597258 71.78731       11.78627 51.78138       6.360219 75.29366 6.486835 64.65888 4.056973 10.63478       7.651016 
1 1 1 -16 28 8  o 67.01304 3.509950 55.39163       5.711888 58.46456       11.40295 54.36232       6.599543 67.65779 7.017942 66.23667 4.108875 1.421120       8.132303 
1 1 1 -16 28 9  o 103.8094 3.229133 132.5259       8.158877 115.1242       15.98971 138.6515       9.486832 95.15932 6.943075 106.0398 3.676833 -10.88046      7.856551 
1 1 1 -16 28 10 o 55.50769 3.762083 38.14668       5.058759 36.49498       10.56991 38.63742       5.761468 52.62100 8.534972 55.73790 4.274379 -3.116898      9.545473 
1 1 1 -16 28 11 o 120.5428 3.278018 178.8012       9.620230 195.6858       20.42722 173.9889       10.90532 124.1521 6.777498 118.7188 3.774288 5.433273       7.757559 
1 1 1 -16 28 12 o 59.35545 3.942002 43.70384       5.669511 61.59204       14.84882 40.65099       6.134251 68.11796 9.178650 57.09708 4.443675 11.02088       10.19774 
1 1 1 -16 28 13 o 37.32892 4.661746 17.57402       4.148446 16.52693       7.437588 18.04689       4.998145 34.94291 8.753761 37.55365 5.635342 -2.610741      10.41083 
1 1 1 -16 28 14 o 65.81355 3.369638 53.50193       5.386250 56.24495       9.609901 52.24552       6.503865 66.53366 5.991192 64.81078 4.139658 1.722885       7.282249 
1 1 1 -16 28 15 o 14.79345 6.097861 1.006654       3.553003 -2.032516      6.331288 2.403741       4.292660 16.81187 7.522901 17.40530 6.866548 -0.5934277     10.18546 
1 1 1 -16 28 16 o 33.72171 5.466415 14.64451       4.338425 15.70669       7.076726 14.00492       5.491401 33.90751 8.563651 32.41986 7.143827 1.487648       11.15215 
1 1 1 -16 28 17 o 24.62692 5.973885 7.998816       3.547967 10.06986       6.742071 7.205616       4.172438 27.50506 8.854998 23.39632 6.869027 4.108734       11.20690 
1 1 1 -16 28 18 f 56.83156 3.438217 40.09777       4.739394 42.30431       8.385027 39.06191       5.745141 57.27663 6.101264 55.81576 4.255933 1.460869       7.438978 
1 1 1 -16 28 19 o 111.4801 2.949522 153.3915       8.005773 150.3839       13.79166 154.9199       9.831780 108.9138 5.211461 111.6750 3.617541 -2.761223      6.343968 
1 1 1 -16 28 20 o 24.23232 6.062961 7.843954       3.571144 17.83801       7.341992 4.746765       4.087210 35.65613 8.558617 19.77018 6.900470 15.88595       10.99393 
1 1 1 -16 28 21 o 72.15652 3.109506 64.60370       5.454846 65.08960       9.871884 64.39013       6.544737 70.90445 5.762991 71.74142 3.756661 -0.8369751     6.879285 
1 1 1 -16 28 22 o 78.06510 3.386232 75.99155       6.426514 84.52639       15.57143 74.23934       7.055423 78.09153 8.310021 76.94577 3.774239 1.145760       9.126956 
1 1 1 -16 28 23 o 41.80381 4.912404 22.62519       4.908938 12.57420       7.215898 31.28421       6.697613 29.26240 9.129559 48.74315 5.749063 -19.48075      10.78891 
1 1 1 -16 28 24 o 40.93811 4.739556 21.72928       4.641018 23.02078       7.051502 20.74230       6.164371 40.51419 7.415488 38.84062 6.758090 1.673573       10.03301 
1 1 1 -16 28 25 o 62.93413 3.318135 49.77204       5.070831 41.42349       8.555016 54.29377       6.296043 55.09452 6.496794 65.31257 3.974621 -10.21805      7.616164 
1 1 1 -16 28 26 o 71.45048 4.125279 65.41760       7.152276 59.65427       9.331673 73.62422       11.13538 66.64996 5.803245 73.51859 6.275375 -6.868629      8.547397 
1 1 1 -16 28 27 o 30.10828 5.018896 12.14534       3.552837 6.766106       6.468283 14.46942       4.251612 22.34094 8.534113 32.61199 5.548346 -10.27105      10.17916 
1 1 1 -16 28 28 o 23.59002 6.032209 7.884959       3.480882 7.861217       6.117686 7.896326       4.232864 23.08025 8.399492 23.24292 6.942852 -0.1626701     10.89746 
1 1 1 -16 28 29 o 37.37410 4.428194 18.45847       3.954779 22.83634       7.440452 16.73463       4.668922 38.32673 8.213397 34.70276 5.720107 3.623974       10.00897 
1 1 1 -16 28 30 o 19.65313 6.837599 5.558094       4.011325 7.266926       6.499816 4.506885       5.097954 21.96973 8.512403 18.87395 7.471343 3.095774       11.32616 
1 1 1 -16 28 31 o 20.70374 7.685494 6.492485       5.163232 0.000000       0.000000 6.492485       5.163232 ?        ?        20.70374 7.685494 0.000000       7.685494 
1 1 1 -16 28 32 f 16.79189 6.280313 3.792360       3.460403 0.8309715      7.500734 4.593072       3.900266 17.45576 7.961742 18.00166 6.680231 -0.5459061     10.39302 
1 1 1 -16 28 33 f 12.32353 5.503960 -0.2040503     3.371827 -0.1841822     6.515523 -0.2113174     3.940527 15.96712 7.334225 13.15223 5.906246 2.814892       9.416718 
1 1 1 -16 28 34 o 22.65354 6.247058 7.963536       3.560005 1.026853       6.499532 10.93655       4.255054 16.41551 7.457685 26.30921 6.638090 -9.893700      9.984053 
1 1 1 -16 29 1  o 68.85361 3.284343 58.53753       5.494869 62.19487       9.624486 56.76891       6.692886 70.07519 5.684860 67.55960 4.084355 2.515587       6.999970 
1 1 1 -16 29 2  o 150.5221 2.968118 278.5189       10.88723 257.7708       16.04135 296.2382       14.82431 143.8644 4.581477 154.6721 3.936222 -10.80766      6.040180 
1 1 1 -16 29 3  o 31.13600 5.540246 12.50167       4.049575 6.255959       6.498981 16.46579       5.177593 23.60863 8.647081 35.63577 6.186468 -12.02714      10.63223 
1 1 1 -16 29 4  o 91.92592 3.270807 104.1656       7.315371 104.4009       13.78149 104.0732       8.631808 90.64606 6.277724 91.67325 3.872598 -1.027184      7.376099 
1 1 1 -16 29 5  o 58.45125 4.438475 42.65211       6.274872 35.02876       9.796511 47.95556       8.171039 51.51843 8.067787 61.61610 5.499605 -10.09768      9.763956 
1 1 1 -16 29 6  o 102.9553 3.213379 130.5687       8.052205 141.0795       16.48254 127.2738       9.228387 105.3250 6.452767 101.4521 3.739144 3.872887       7.457842 
1 1 1 -16 29 7  o 87.72508 4.830869 96.17168       10.28739 0.000000       0.000000 96.17168       10.28739 ?        ?        87.72508 4.830869 0.000000       4.830869 
1 1 1 -16 29 8  f 106.8242 3.242372 140.6100       8.430733 165.2779       17.52510 133.1822       9.616611 114.0783 6.328883 103.7410 3.810430 10.33727       7.387432 
1 1 1 -16 29 9  o 104.4095 3.225066 134.3396       8.195844 112.6824       15.79021 142.3258       9.588627 93.68732 6.966105 107.2928 3.672742 -13.60552      7.875001 
1 1 1 -16 29 10 o 66.95831 3.566366 55.49293       5.798253 26.21670       10.81854 67.29162       6.867962 43.28009 10.38953 73.66309 3.839223 -30.38300      11.07619 
1 1 1 -16 29 11 o 79.12831 3.937033 77.73161       7.567822 0.000000       0.000000 77.73161       7.567822 ?        ?        79.12831 3.937033 0.000000       3.937033 
1 1 1 -16 29 12 o 57.62543 3.814596 41.28631       5.326569 35.85420       10.72984 43.06278       6.136040 51.48732 8.871999 58.69392 4.320291 -7.206604      9.867992 
1 1 1 -16 29 13 o 37.61505 4.796523 17.96119       4.296793 10.09105       7.246856 22.22794       5.335889 27.70401 9.196893 41.70800 5.374717 -14.00399      10.65225 
1 1 1 -16 29 14 o 12.84966 5.745176 -1.309425      3.684446 10.32009       6.656751 -6.445622      4.423871 27.74133 8.784607 11.23718 5.417305 16.50415       10.32068 
1 1 1 -16 29 15 f 29.13620 6.326734 11.25478       4.363107 9.893621       6.886296 12.16767       5.639517 27.25375 8.961807 29.91669 7.692840 -2.662943      11.81075 
1 1 1 -16 29 16 o 19.62046 6.900090 4.570338       4.091693 5.602597       6.272930 3.805907       5.398155 22.48012 8.445778 19.95865 7.750818 2.521469       11.46326 
1 1 1 -16 29 17 o 36.07701 4.618239 16.60098       3.967173 14.26033       7.157834 17.63879       4.766201 31.82745 8.889021 36.88960 5.467141 -5.062151      10.43572 
1 1 1 -16 29 18 o 78.47164 3.049529 76.26813       5.820416 70.04226       9.815397 79.64468       7.228436 73.86242 5.492472 79.87652 3.723797 -6.014099      6.635805 
1 1 1 -16 29 19 o 44.22686 3.959504 24.66594       4.222296 32.43372       7.827224 21.47788       5.014450 49.35976 6.678444 40.76512 5.163413 8.594639       8.441709 
1 1 1 -16 29 20 o 76.39631 3.090482 72.51944       5.741658 67.42156       9.839322 75.15172       7.070286 72.04608 5.649420 77.41573 3.758994 -5.369652      6.785719 
1 1 1 -16 29 21 o 15.03291 6.488796 0.2571432      4.335737 12.10822       10.10044 -2.419898      4.800525 28.90856 10.74589 13.83995 6.334105 15.06861       12.47377 
1 1 1 -16 29 22 o 22.40246 6.838496 6.908604       4.074987 5.772165       6.198609 7.773570       5.407799 21.88269 8.355478 23.68702 7.946450 -1.804333      11.53083 
1 1 1 -16 29 23 o 43.47819 4.111702 24.20822       4.304661 23.53732       7.355857 24.55764       5.308579 40.55065 7.725892 43.22141 5.140756 -2.670753      9.279913 
1 1 1 -16 29 24 o 25.68172 6.062653 9.156398       3.732920 8.338419       6.536492 9.552295       4.547417 24.14562 8.696735 25.80451 7.038336 -1.658888      11.18800 
1 1 1 -16 29 25 o 73.36722 4.038942 68.95642       7.193281 62.11442       9.257482 79.38197       11.42749 68.08076 5.630273 76.28632 6.200486 -8.205559      8.375320 
1 1 1 -16 29 26 o 51.48732 3.606092 33.80294       4.495920 28.91710       7.784768 36.24812       5.507202 44.59761 7.423917 52.82796 4.315474 -8.230354      8.587075 
1 1 1 -16 29 27 o 29.10073 5.368824 11.62131       3.667086 12.40322       6.590108 11.27061       4.413502 27.76853 8.733646 27.88949 6.597765 -0.1209621     10.94564 
1 1 1 -16 29 28 o 28.73392 5.606378 11.55450       3.784670 13.37068       6.784709 10.73408       4.560066 28.34590 8.853952 26.78611 6.932827 1.559793       11.24529 
1 1 1 -16 29 29 o 16.03821 6.409051 2.759825       3.785805 2.445234       6.111502 2.955705       4.822487 17.80360 7.694346 17.15385 7.090769 0.6497536      10.46336 
1 1 1 -16 29 30 o 12.86805 5.659407 0.1525522      3.432250 5.100020       8.041739 -0.9494275     3.795293 20.37555 8.816051 12.55365 5.701487 7.821899       10.49903 
1 1 1 -16 29 31 o 23.46811 6.802588 8.623198       4.115271 23.02600       11.71913 6.597345       4.395172 30.86490 11.55473 20.54482 7.156693 10.32008       13.59154 
1 1 1 -16 29 32 o 38.49445 4.411187 20.15402       4.063334 15.37345       7.168760 22.41691       4.932142 28.43444 9.128700 39.84526 5.203745 -11.41082      10.50772 
1 1 1 -16 29 33 o 14.72580 6.053144 2.244472       3.488358 4.504889       6.575751 1.359226       4.115123 18.61997 8.013690 14.51831 6.294075 4.101659       10.18993 
1 1 1 -16 30 1  o 47.28756 3.996317 27.99480       4.562068 44.86481       8.102230 20.16348       5.520319 59.21408 5.684667 39.41372 5.931180 19.80037       8.215494 
1 1 1 -16 30 2  o 27.48097 4.872497 9.734188       3.143559 4.832872       4.037628 17.27797       5.009154 19.98011 6.864328 36.48640 5.829875 -16.50629      9.005911 
1 1 1 -16 30 3  f 65.20242 3.570458 52.76801       5.651491 66.07672       10.87204 47.84032       6.615530 71.67137 6.288512 61.76910 4.424284 9.902271       7.688932 
1 1 1 -16 30 4  o 57.54291 4.585303 41.62102       6.376634 50.79474       10.33603 35.98395       8.102291 62.45972 6.905954 52.69390 6.443644 9.765816       9.445251 
1 1 1 -16 30 5  o 39.36828 4.785395 19.66671       4.496745 35.08246       8.821822 14.25531       5.226740 51.65792 7.203504 32.77494 6.768385 18.88298       9.884407 
1 1 1 -16 30 6  o 53.69926 3.812215 35.92418       4.956200 47.57012       10.14929 32.27737       5.679422 60.36694 7.030655 50.61057 4.657154 9.756363       8.433220 
1 1 1 -16 30 7  o 171.1988 3.575304 362.6950       14.91591 335.7177       28.85079 372.5363       17.42545 160.5767 7.392751 173.0597 4.131921 -12.48303      8.469093 
1 1 1 -16 30 8  o 28.71469 6.059803 10.85669       4.106866 4.487068       8.055514 13.09370       4.773867 23.12909 9.312293 31.47516 6.441159 -8.346077      11.32287 
1 1 1 -16 30 9  o 33.59972 6.559788 14.92628       5.178273 0.000000       0.000000 14.92628       5.178273 ?        ?        33.59972 6.559788 0.000000       6.559788 
1 1 1 -16 30 10 o 108.3716 3.304112 145.2478       8.715631 152.4011       18.14472 143.1024       9.937072 108.3658 6.906983 107.3086 3.806063 1.057152       7.886225 
1 1 1 -16 30 11 o 19.82453 6.983341 4.649301       4.192273 4.507007       8.357913 4.697136       4.845977 23.30276 9.448369 20.41989 7.468823 2.882872       12.04388 
1 1 1 -16 30 12 o 16.81281 6.601762 2.392987       3.951667 4.156679       8.037645 1.830784       4.537996 22.72507 9.246571 17.01192 6.938114 5.713144       11.56013 
1 1 1 -16 30 13 o 36.13461 4.801426 16.69604       4.123411 17.59412       7.418551 16.29455       4.960196 35.48096 8.657725 35.24897 5.988564 0.2319870      10.52707 
1 1 1 -16 30 14 o 81.82402 3.104485 82.89541       6.178997 80.54962       10.32217 84.20543       7.713744 79.41663 5.365123 82.11171 3.865851 -2.695076      6.612817 
1 1 1 -16 30 15 o 41.38609 4.879702 21.93834       4.826844 14.33702       7.295284 27.85687       6.437315 31.71929 9.014583 46.24396 5.842501 -14.52466      10.74232 
1 1 1 -16 30 16 o 26.99002 5.938950 9.738665       3.799943 13.91451       6.685841 7.746079       4.618407 31.30767 8.532156 23.91789 7.276055 7.389774       11.21333 
1 1 1 -16 30 17 o 62.50673 3.282805 48.67601       4.982908 40.08307       8.441573 53.27118       6.173099 55.02160 6.416114 65.10386 3.908996 -10.08226      7.513106 
1 1 1 -16 30 18 o 20.58974 7.395560 5.229629       4.723125 7.205446       6.734301 3.316832       6.626031 23.80091 8.787805 20.32082 8.346637 3.480099       12.11989 
1 1 1 -16 30 19 o 52.73314 4.177050 35.35332       5.323898 35.85360       8.134502 34.97846       7.041484 51.55191 6.628362 51.55183 5.700210 0.8773804E-04  8.742286 
1 1 1 -16 30 20 o 47.66818 4.351105 29.11942       4.998672 39.37162       8.100470 22.81463       6.352382 54.15750 6.252505 40.87038 6.603141 13.28712       9.093695 
1 1 1 -16 30 21 o 19.56230 7.483261 4.428171       4.978013 2.035163       9.761893 5.269142       5.786987 21.62473 9.526243 20.97062 8.056687 0.6541100      12.47636 
1 1 1 -16 30 22 o 49.99516 3.773043 31.80731       4.562877 23.01652       7.665888 36.63055       5.678299 39.46436 8.237686 53.26392 4.414318 -13.79956      9.345891 
1 1 1 -16 30 23 o 20.46589 6.445783 5.803426       3.588461 3.218501       6.225638 7.089526       4.391342 19.25430 8.016221 22.33261 7.142197 -3.078316      10.73642 
1 1 1 -16 30 24 o 44.76441 4.023144 25.83600       4.341922 23.64010       7.332367 27.02181       5.388192 39.98162 7.805918 45.14822 4.980053 -5.166599      9.259227 
1 1 1 -16 30 25 o 81.04378 3.464680 83.44443       6.826775 72.18238       9.942112 93.49149       9.390519 72.96066 5.635477 84.52425 4.576091 -11.56360      7.259422 
1 1 1 -16 30 26 f 19.84966 6.519946 5.600372       3.645269 8.291101       6.456964 4.341611       4.416366 23.26868 8.602505 18.50674 7.056051 4.761938       11.12614 
1 1 1 -16 30 27 o 18.62918 6.785793 4.749262       3.994123 5.920726       6.569562 4.062344       5.030654 20.88002 8.408642 18.44054 7.381601 2.439478       11.18898 
1 1 1 -16 30 28 o 38.10925 5.582325 20.38520       5.030511 28.26372       9.751942 17.52860       5.872096 39.33850 10.11630 33.69682 7.357745 5.641685       12.50904 
1 1 1 -16 30 29 o 15.31307 6.240985 2.370489       3.668837 -1.851713      7.969645 3.505891       4.132798 16.68843 7.816399 16.92830 6.718750 -0.2398663     10.30717 
1 1 1 -16 30 30 o 12.46630 5.648809 -0.7280073     3.699475 -0.8647870     9.964073 -0.7061375     3.984269 18.21542 8.596242 12.90618 5.853727 5.309240       10.40007 
1 1 1 -16 30 31 o 32.46032 5.099720 14.89088       3.901132 22.73920       7.296485 11.74931       4.616353 36.24052 8.422627 27.13118 6.951507 9.109348       10.92081 
1 1 1 -16 31 1  o 47.24945 3.373627 27.83943       3.858896 29.94079       5.346196 25.55383       5.575638 48.55732 4.571885 44.54632 5.236128 4.010998       6.951199 
1 1 1 -16 31 2  o 60.88747 3.093070 45.97033       4.574342 46.65697       6.543437 45.31403       6.397235 60.78498 4.448267 59.91643 4.412323 0.8685493      6.265435 
1 1 1 -16 31 3  o 39.79385 4.718510 20.20992       4.486744 23.58895       8.115477 18.72243       5.384487 41.24532 8.360853 37.74239 6.059359 3.502926       10.32568 
1 1 1 -16 31 4  o 46.93632 4.838521 28.06618       5.455024 30.13855       8.361352 26.53042       7.197867 47.30019 7.504272 44.69145 6.825212 2.608742       10.14385 
1 1 1 -16 31 5  o 52.05135 3.875999 33.94103       4.881161 34.25032       9.056180 33.81439       5.794940 50.42821 7.605785 51.64530 4.654385 -1.217087      8.916909 
1 1 1 -16 31 6  o 40.71508 4.477607 21.04083       4.369359 15.40403       7.963468 23.46864       5.226285 32.83337 9.446563 42.77529 5.115043 -9.941917      10.74250 
1 1 1 -16 31 7  o 48.68034 4.104024 29.81293       4.823247 31.95874       8.717861 28.86637       5.790154 48.67742 7.597348 47.50341 5.080638 1.174007       9.139616 
1 1 1 -16 31 8  o 51.43539 4.004191 33.22192       4.979435 25.15703       9.550704 36.23251       5.835287 41.89511 9.565747 53.51704 4.516512 -11.62193      10.57839 
1 1 1 -16 31 9  o 102.9554 3.249316 131.4427       8.142041 137.4754       16.35444 129.4548       9.388195 102.5867 6.576612 101.8549 3.788974 0.7317276      7.590003 
1 1 1 -16 31 10 o 27.14532 7.135367 10.06894       4.781264 0.000000       0.000000 10.06894       4.781264 ?        ?        27.14532 7.135367 0.000000       7.135367 
1 1 1 -16 31 11 o 26.87112 7.351494 9.921053       4.952378 0.000000       0.000000 9.921053       4.952378 ?        ?        26.87112 7.351494 0.000000       7.351494 
1 1 1 -16 31 12 o 31.39518 5.979870 13.10752       4.407976 -0.3518178     8.710373 17.74105       5.110709 20.19845 8.943643 36.67429 5.920074 -16.47585      10.72548 
1 1 1 -16 31 13 o 35.35076 5.267361 16.28092       4.399284 21.11516       9.064026 14.79117       5.031684 37.79587 9.770178 33.14613 6.461627 4.649738       11.71362 
1 1 1 -16 31 14 o 20.07408 7.366980 4.751886       4.720846 5.931711       6.591814 3.509588       6.764087 22.59464 8.619069 20.66034 8.453632 1.934298       12.07279 
1 1 1 -16 31 15 o 43.46581 4.684897 24.27427       4.884027 24.35234       7.438180 24.21511       6.475555 41.91150 7.560912 42.47054 6.460143 -0.5590401     9.944890 
1 1 1 -16 31 16 o 67.76773 3.768219 57.82530       6.198431 42.73684       8.703707 73.35290       8.829456 56.49497 6.436733 75.59511 4.818040 -19.10014      8.040215 
1 1 1 -16 31 17 o 12.90103 5.811088 -1.328705      3.847332 3.812208       6.113698 -4.699446      4.950471 20.06249 8.100228 12.76544 6.034789 7.297051       10.10111 
1 1 1 -16 31 18 o 21.85176 6.636372 6.582768       3.844224 12.27253       6.827742 3.941949       4.651567 28.62485 8.872656 18.83160 7.226190 9.793245       11.44298 
1 1 1 -16 31 19 o 37.40072 4.730923 18.27915       4.215525 27.45228       7.485314 14.01842       5.101447 44.19561 7.197624 31.55992 6.831634 12.63569       9.923558 
1 1 1 -16 31 20 o 36.54168 6.408981 18.48444       5.499078 24.05895       11.12043 16.68006       6.326769 37.23313 11.28298 33.68351 7.853117 3.549618       13.74689 
1 1 1 -16 31 21 o 12.96009 5.648037 -0.1594959E-01 3.350004 -1.166612      6.159725 0.4673395      3.992004 16.19273 7.317880 14.43298 6.228039 1.759744       9.609362 
1 1 1 -16 31 22 o 35.86316 4.862838 17.06713       4.140465 5.545678       6.747005 24.02721       5.244022 21.35202 8.548056 42.41661 5.180706 -21.06459      9.995447 
1 1 1 -16 31 23 o 55.77963 3.561907 39.67328       4.816363 32.98860       8.175653 43.22628       5.960457 47.69678 7.262878 57.68237 4.270627 -9.985588      8.425417 
1 1 1 -16 31 24 o 49.12468 4.249185 31.52392       5.036797 35.51463       7.653214 28.47469       6.689811 50.13684 6.410436 44.97451 6.274523 5.162331       8.970136 
1 1 1 -16 31 25 o 19.77279 6.919919 5.570338       4.111923 4.524386       6.123408 6.429318       5.549181 19.58948 8.032559 21.09868 7.940020 -1.509197      11.29451 
1 1 1 -16 31 26 o 17.48315 6.959918 3.600247       4.447709 -13.41356      8.092341 10.96437       5.323951 13.35861 6.618638 26.20316 7.776526 -12.84454      10.21179 
1 1 1 -16 31 27 o 39.66923 4.703869 21.35554       4.458809 23.50707       10.07888 20.83200       4.971787 33.95808 10.81597 38.53727 5.445721 -4.579193      12.10954 
1 1 1 -16 31 28 o 12.64792 5.596360 0.1632611E-01  3.404583 0.9507510      6.519915 -0.3339894     3.992081 16.80040 7.566396 13.23664 5.944406 3.563759       9.622178 
1 1 1 -16 31 29 f 13.24778 5.870581 0.1912223      3.760169 -10.81876      9.528445 2.222063       4.092291 14.92439 7.354823 15.43437 6.467848 -0.5099869     9.794207 
1 1 1 -16 31 30 o 22.66467 6.512068 8.056078       3.786795 6.377166       6.971381 8.758794       4.510190 20.20253 8.452224 23.06129 7.221184 -2.858761      11.11691 
1 1 1 -16 32 1  o 45.16500 4.507145 26.10766       4.894494 34.09483       7.930112 21.19273       6.220732 50.37763 6.619608 39.53031 6.696469 10.84732       9.416045 
1 1 1 -16 32 2  o 64.34528 3.838472 52.09445       5.991461 56.41381       10.22209 49.83397       7.394875 65.09025 6.532701 62.30885 4.909825 2.781403       8.172060 
1 1 1 -16 32 3  f 75.94564 4.718143 73.57491       8.688803 66.46033       11.33449 83.71394       13.53085 70.62120 6.664966 78.85068 7.118377 -8.229477      9.751567 
1 1 1 -16 32 4  o 29.42044 6.027990 11.62439       4.176322 14.42490       7.258913 10.23870       5.106050 31.47038 9.007887 27.08828 7.486066 4.382109       11.71252 
1 1 1 -16 32 5  o 45.47801 4.651490 26.47831       5.082479 32.29125       8.563094 23.31677       6.315131 48.56771 7.474450 41.76864 6.408638 6.799072       9.845712 
1 1 1 -16 32 6  o 13.56446 5.981332 -0.6234424     3.857287 2.489954       6.316831 -2.474615      4.870858 19.42029 8.079160 13.97473 6.389956 5.445559       10.30070 
1 1 1 -16 32 7  o 24.73640 6.947001 8.407066       4.359037 16.00301       7.403066 4.375913       5.393061 33.15288 8.954319 20.19899 7.773142 12.95389       11.85755 
1 1 1 -16 32 8  o 14.90284 6.335316 0.6144511      4.018767 2.434920       6.834072 -0.3478261     4.968646 19.87981 8.346283 15.55657 6.826595 4.323245       10.78252 
1 1 1 -16 32 9  o 82.84060 4.644987 87.42947       9.339440 0.000000       0.000000 87.42947       9.339440 ?        ?        82.84060 4.644987 0.000000       4.644987 
1 1 1 -16 32 10 o 52.37382 4.535983 35.04446       5.732226 45.65318       10.62851 30.69295       6.807082 57.43947 7.794126 48.22142 5.916597 9.218044       9.785423 
1 1 1 -16 32 11 o 47.27508 4.706692 28.73479       5.350346 32.66608       9.754224 27.04297       6.398862 47.67505 8.716986 45.15786 5.960158 2.517197       10.55980 
1 1 1 -16 32 12 o 28.82236 6.714816 11.48990       4.628359 16.94089       8.736805 9.363342       5.456997 33.19794 9.988098 25.71688 7.925474 7.481068       12.75050 
1 1 1 -16 32 13 o 13.89795 6.266177 -1.470249      4.485893 -7.110847      7.156279 2.180776       5.757476 14.93152 7.115295 18.37319 7.683620 -3.441676      10.47213 
1 1 1 -16 32 14 o 14.16142 6.062748 0.4464927      3.726790 9.881204       7.267007 -2.920335      4.341119 26.18180 9.196578 12.68754 5.883955 13.49427       10.91778 
1 1 1 -16 32 15 o 29.87343 5.655782 12.04293       3.966591 11.38884       6.694891 12.39673       4.923864 27.63376 8.816688 29.65875 6.936985 -2.024986      11.21854 
1 1 1 -16 32 16 o 26.71784 6.260210 9.918683       4.004225 14.17155       6.985901 7.837759       4.886629 30.47887 8.871393 23.49435 7.536306 6.984514       11.64034 
1 1 1 -16 32 17 o 35.32153 4.738055 16.36983       3.975502 14.24305       7.107767 17.33807       4.795809 30.35927 8.979125 35.83725 5.680754 -5.477987      10.62524 
1 1 1 -16 32 18 o 31.51058 6.016966 13.67790       4.451842 3.727602       6.732414 21.40942       5.934512 20.09509 8.348679 39.31718 6.414919 -19.22210      10.52861 
1 1 1 -16 32 19 o 12.34483 5.631621 -1.645018      3.754975 6.842327       10.13953 -2.994019      4.042388 23.98740 10.12394 11.97766 5.595923 12.00974       11.56756 
1 1 1 -16 32 20 o 35.24796 4.929457 16.55010       4.118555 25.32025       7.213684 12.30876       5.016545 41.77367 7.354795 28.99350 7.146560 12.78016       10.25506 
1 1 1 -16 32 21 o 18.25174 6.714205 4.261717       3.925081 5.331332       6.013419 3.467749       5.180947 20.59059 8.125885 18.33081 7.436576 2.259773       11.01511 
1 1 1 -16 32 22 o 18.39811 6.897691 4.344357       4.179405 2.006771       6.372001 6.109287       5.536763 18.05992 7.830768 20.95859 7.921478 -2.898670      11.13871 
1 1 1 -16 32 23 o 12.47716 5.873280 -3.396498      4.598260 2.030039       5.850811 -12.16321      7.436577 17.46986 7.539190 13.06441 6.449403 4.405444       9.921401 
1 1 1 -16 32 24 o 55.69412 4.448433 41.14592       5.987288 39.50487       10.75179 41.88353       7.208359 48.34904 9.464433 55.11663 5.437582 -6.767597      10.91525 
1 1 1 -16 32 25 o 50.35223 4.058370 33.38274       4.937584 23.24227       10.27926 36.42421       5.629570 33.67979 10.94144 52.20243 4.468288 -18.52264      11.81866 
1 1 1 -16 32 26 o 16.15691 6.537231 2.886835       3.991446 10.36010       8.282630 0.6263340      4.555285 23.87619 9.500095 14.71993 6.495049 9.156260       11.50815 
1 1 1 -16 32 27 o 13.74909 5.872088 1.132624       3.480889 -1.915110      6.208374 2.529971       4.203794 14.92140 6.959220 15.88539 6.598188 -0.9639874     9.589933 
1 1 1 -16 32 28 o 14.03527 5.965055 1.403061       3.561258 -3.752021      6.389452 3.726221       4.289290 14.16824 6.743600 17.03092 6.816469 -2.862674      9.588554 
1 1 1 -16 33 1  o 50.88837 3.269136 32.53875       4.032592 33.07076       5.791640 32.03813       5.618207 50.46445 4.766012 49.71057 4.693369 0.7538834      6.688990 
1 1 1 -16 33 2  o 27.29269 5.737779 10.11988       3.694838 8.877528       4.392287 13.12684       6.833335 25.07722 6.948088 29.53293 8.821311 -4.455708      11.22904 
1 1 1 -16 33 3  o 63.99649 3.696198 51.72793       5.739788 41.19322       10.03050 56.85707       6.998965 53.88353 7.871157 66.67160 4.331256 -12.78807      8.984146 
1 1 1 -16 33 4  o 68.94376 3.544615 59.82049       5.935260 83.03813       11.61976 51.62445       6.903831 78.91116 6.089660 63.42062 4.496230 15.49054       7.569680 
1 1 1 -16 33 5  o 22.60102 6.695788 7.073898       3.949765 -3.959527      6.867446 12.52771       4.828253 15.85458 7.369087 29.96245 6.772439 -14.10788      10.00847 
1 1 1 -16 33 6  o 13.89115 5.950256 0.3999875      3.593330 -4.242667      6.345933 2.591091       4.359571 15.03719 7.020719 17.13480 6.867307 -2.097613      9.820916 
1 1 1 -16 33 7  o 37.92604 4.910755 18.79313       4.432155 9.067354       7.783461 23.46000       5.391665 25.47801 9.440220 42.17042 5.368121 -16.69241      10.85976 
1 1 1 -16 33 8  o 53.34998 4.861711 36.92805       6.251249 0.000000       0.000000 36.92805       6.251249 ?        ?        53.34998 4.861711 0.000000       4.861711 
1 1 1 -16 33 9  o 38.36636 4.796212 19.19739       4.386512 13.20494       8.154332 21.63759       5.203545 29.26084 9.756909 40.41173 5.420484 -11.15090      11.16149 
1 1 1 -16 33 10 o 17.38771 6.625422 3.310169       3.892274 -1.783705      7.305830 5.329017       4.599358 17.39304 7.903733 20.34270 7.299093 -2.949661      10.75852 
1 1 1 -16 33 11 o 18.50280 6.767232 4.176354       3.978228 4.415275       7.733432 4.090378       4.639124 21.54741 8.949593 18.91124 7.226558 2.636173       11.50297 
1 1 1 -16 33 12 o 33.13116 6.756148 15.39305       5.269605 9.606762       8.762805 18.67099       6.595433 25.85535 9.918983 35.85764 7.772549 -10.00229      12.60154 
1 1 1 -16 33 13 o 43.03329 4.586112 24.08816       4.735322 23.36308       9.478639 24.32931       5.466343 38.06312 10.06623 42.77099 5.362113 -4.707867      11.40531 
1 1 1 -16 33 14 o 39.25760 4.950218 20.32478       4.630624 29.05109       9.908628 17.88642       5.237778 42.91194 9.703732 36.05560 6.183770 6.856342       11.50658 
1 1 1 -16 33 15 o 20.15775 6.774793 5.543467       3.930532 13.99613       8.722529 3.389772       4.402888 29.27743 10.08801 17.80420 6.975202 11.47323       12.26464 
1 1 1 -16 33 16 o 37.63353 5.080770 18.85568       4.540596 23.04898       9.909548 17.74134       5.108412 36.84315 10.51806 35.87428 6.058980 0.9688759      12.13841 
1 1 1 -16 33 17 o 66.86684 3.813048 57.15662       6.187500 55.32285       9.586429 58.46609       8.100859 63.30996 6.297074 66.49255 5.036911 -3.182590      8.063723 
1 1 1 -16 33 18 o 18.29569 6.884978 4.144454       4.172380 13.14428       10.45619 2.440035       4.550350 27.69408 10.77817 16.81575 6.912954 10.87833       12.80460 
1 1 1 -16 33 19 o 71.21568 3.309011 64.29714       5.726919 48.28951       9.448863 73.59211       7.200127 58.20701 6.788741 75.61248 3.920999 -17.40547      7.839721 
1 1 1 -16 33 20 f 13.35534 6.038533 -1.026432      4.200257 11.74435       6.514616 -10.11198      5.494850 26.85102 8.709440 11.18365 5.525190 15.66737       10.31417 
1 1 1 -16 33 21 o 33.00064 5.945585 15.41731       4.605540 0.4915859      6.851695 27.71934       6.220407 17.35719 7.791865 44.49765 5.880270 -27.14046      9.761698 
1 1 1 -16 33 22 f 30.85093 7.368830 14.66716       5.463609 16.16566       9.522203 13.93170       6.670971 28.86759 10.48308 28.70005 8.747470 0.1675396      13.65332 
1 1 1 -16 33 23 o 17.78517 6.722408 4.226567       3.987551 5.405673       8.270503 3.869459       4.551513 20.79339 8.968479 17.71472 7.044405 3.078671       11.40426 
1 1 1 -16 33 24 o 14.68045 6.362235 1.076358       4.201870 -1.001707      6.283150 2.757655       5.651583 15.59287 7.176892 17.39403 7.456734 -1.801158      10.34943 
1 1 1 -16 33 25 o 33.53349 5.181482 15.77305       4.097836 24.13621       7.418546 12.10079       4.915864 38.13135 8.225569 27.54866 7.232089 10.58268       10.95277 
1 1 1 -16 33 26 o 20.31896 6.659602 6.401617       3.803962 10.14917       6.700975 4.619748       4.620641 23.63109 8.758595 18.17192 7.137735 5.459177       11.29868 
1 1 1 -16 33 27 o 26.20344 6.163095 10.41775       3.869047 13.46276       6.622533 8.839870       4.767231 26.88489 8.785562 23.01789 7.449138 3.866999       11.51850 
1 1 1 -16 34 1  o 35.24081 4.835096 16.43932       4.042930 10.62143       4.864666 29.43098       7.269471 26.93761 7.251263 45.81724 6.709678 -18.87963      9.879301 
1 1 1 -16 34 2  o 11.11595 4.988211 -0.8796079     2.805130 4.592296       4.056725 -5.893089      3.883077 18.91677 6.846220 10.19195 4.951851 8.724819       8.449352 
1 1 1 -16 34 3  o 48.78832 3.933490 30.49541       4.636987 34.91466       8.245363 28.45125       5.607796 49.78425 6.988620 46.40142 5.040223 3.382832       8.616533 
1 1 1 -16 34 4  o 15.29856 6.175427 1.955395       3.552525 -5.269900      5.862154 6.148951       4.466019 13.70997 6.506461 21.10827 7.220315 -7.398301      9.719413 
1 1 1 -16 34 5  o 14.91815 6.030672 1.801307       3.393443 -3.571939      5.646252 4.839671       4.245822 14.21973 6.633535 19.37543 7.005095 -5.155698      9.647547 
1 1 1 -16 34 6  o 20.04656 6.643764 5.484296       3.782185 7.441722       6.944276 4.658752       4.509769 23.29510 8.855990 19.31895 7.180571 3.976152       11.40128 
1 1 1 -16 34 7  o 18.98962 6.689070 4.705536       3.846383 9.804658       7.297763 2.744159       4.526083 25.55656 9.191217 17.26642 6.970198 8.290136       11.53526 
1 1 1 -16 34 8  o 25.57747 6.401978 9.232506       3.980569 12.79269       7.543207 7.858476       4.686169 28.46158 9.380517 23.36407 7.366971 5.097509       11.92755 
1 1 1 -16 34 9  o 32.66973 5.516374 14.44540       4.235508 11.33261       8.126250 15.60644       4.962945 26.93578 9.697438 33.49580 6.311592 -6.560020      11.57050 
1 1 1 -16 34 10 o 25.48123 6.420962 9.190847       3.984880 8.170537       7.727079 9.560511       4.651064 24.09310 9.295775 25.64732 7.166257 -1.554228      11.73740 
1 1 1 -16 34 11 o 10.95919 5.151826 -3.058754      3.517088 -5.078702      6.454299 -2.205623      4.194565 14.56040 6.885548 12.72945 5.860769 1.830957       9.042089 
1 1 1 -16 34 12 o 25.10687 7.321261 9.256639       4.753952 5.788995       7.568433 11.51634       6.109620 22.01613 8.967199 27.38502 8.376169 -5.368893      12.27073 
1 1 1 -16 34 13 f 27.68937 6.336404 10.86330       4.182806 14.16237       9.083711 9.975540       4.712099 28.94447 10.27174 26.05538 7.187940 2.889088       12.53695 
1 1 1 -16 34 14 o 14.89488 6.264307 1.280025       3.860284 6.242985       7.694263 -0.3894365     4.462569 22.24780 9.048937 14.33535 6.371585 7.912455       11.06708 
1 1 1 -16 34 15 o 13.15379 5.855387 -0.5283936     3.783505 8.125961       8.489408 -2.673421      4.226457 23.81615 9.569949 12.40707 5.771564 11.40907       11.17564 
1 1 1 -16 34 16 o 31.33604 8.210722 15.34210       6.344148 0.000000       0.000000 15.34210       6.344148 ?        ?        31.33604 8.210722 0.000000       8.210722 
1 1 1 -16 34 17 o 37.77973 5.887105 19.91645       5.243395 23.67099       9.375785 18.20779       6.324964 36.72369 10.14229 34.56783 7.705290 2.155865       12.73725 
1 1 1 -16 34 18 o 24.83715 8.142912 9.792059       5.687025 0.000000       0.000000 9.792059       5.687025 ?        ?        24.83715 8.142912 0.000000       8.142912 
1 1 1 -16 34 19 o 17.50096 6.682328 3.859929       3.964642 -0.9338090     7.326594 5.844878       4.714543 16.95821 7.784991 20.15904 7.367880 -3.200829      10.71876 
1 1 1 -16 34 20 o 39.38282 4.804502 21.01003       4.515628 19.72848       9.378664 21.39677       5.152134 31.87821 10.45733 39.11157 5.562248 -7.233358      11.84459 
1 1 1 -16 34 21 o 16.61385 6.447371 3.400154       3.733208 4.459220       6.646943 2.912139       4.512085 19.38687 8.190354 16.70858 6.877928 2.678284       10.69522 
1 1 1 -16 34 22 o 27.67255 6.149984 11.32429       4.039663 10.69544       6.856066 11.65870       4.999708 24.56136 8.898664 27.01194 7.385129 -2.450577      11.56401 
1 1 1 -16 34 23 o 13.24006 5.820137 0.3332067      3.625847 -2.886225      6.322157 1.911154       4.426107 14.62260 6.884300 15.56361 6.633523 -0.9410048     9.560189 
1 1 1 -16 34 24 o 29.06392 5.772758 12.35369       3.944407 10.56408       6.980479 13.19314       4.780820 23.95367 8.927680 29.05357 6.862630 -5.099903      11.26051 
1 1 1 -16 34 25 o 33.56179 5.465061 16.18429       4.316027 11.74493       7.287626 18.58259       5.356459 24.71553 9.138801 34.91852 6.534997 -10.20300      11.23494 
1 1 1 -16 35 1  o 20.84323 6.801383 6.233065       3.969680 6.284494       4.325973 5.958869       9.988729 20.93172 7.107255 22.78192 9.841298 -1.850201      12.13937 
1 1 1 -16 35 2  o 10.33902 4.834596 -2.384948      3.028188 -1.123711      4.009955 -4.058719      4.619438 13.04921 5.900132 12.26522 5.807587 0.7839947      8.278867 
1 1 1 -16 35 3  o 18.06507 6.181524 4.382957       3.273467 5.238720       5.674551 3.956146       4.007490 20.30041 7.928766 17.91304 6.746138 2.387371       10.41037 
1 1 1 -16 35 4  o 16.07530 6.303747 2.707226       3.598850 6.962276       6.747931 1.015839       4.254415 22.36278 8.670975 15.14203 6.480031 7.220749       10.82481 
1 1 1 -16 35 5  o 42.71852 4.400761 23.88758       4.515734 18.16816       8.369040 26.23667       5.363507 32.84456 9.750664 44.31380 5.057190 -11.46924      10.98411 
1 1 1 -16 35 6  o 47.65474 4.108492 29.42362       4.724627 37.72655       8.918320 26.18424       5.570550 50.88528 7.409543 44.09630 5.289373 6.788982       9.103780 
1 1 1 -16 35 7  o 16.82407 6.848958 2.613326       4.412406 0.000000       0.000000 2.613326       4.412406 ?        ?        16.82407 6.848958 0.000000       6.848958 
1 1 1 -16 35 8  o 66.87936 3.729499 57.22664       6.054178 76.22247       12.17011 50.97988       6.978998 73.21018 6.903105 62.31864 4.628613 10.89154       8.311253 
1 1 1 -16 35 9  o 37.68160 5.636611 19.45663       5.017099 15.80415       8.067803 21.75978       6.406527 30.60706 9.668268 38.75256 7.043370 -8.145493      11.96179 
1 1 1 -16 35 10 o 31.13614 6.529731 13.89986       4.795966 8.353581       7.704856 17.40809       6.127843 23.73379 9.247779 34.09869 7.571759 -10.36489      11.95211 
1 1 1 -16 35 11 f 21.34137 8.293035 6.184781       6.182867 10.56200       7.735111 -1.560582      10.28936 25.54535 9.420604 19.45574 9.035089 6.089611       13.05299 
1 1 1 -16 35 12 o 18.71644 7.158067 4.427754       4.554082 -2.903315      7.837980 8.164004       5.595494 16.78327 7.824858 23.17526 8.074894 -6.391996      11.24421 
1 1 1 -16 35 13 o 18.80726 7.167072 4.550480       4.555000 -0.7069106E-01 7.970525 6.791654       5.550712 18.16803 8.255725 21.60612 7.978118 -3.438091      11.48074 
1 1 1 -16 35 14 o 18.47027 7.499537 3.812313       5.274255 -1.337195      7.705272 8.352161       7.234787 17.24522 7.941144 23.26225 8.989561 -6.017036      11.99475 
1 1 1 -16 35 15 o 18.35781 6.913212 4.427835       4.208301 13.68790       8.935410 1.788382       4.770506 27.39988 10.12152 16.18913 6.893012 11.21075       12.24577 
1 1 1 -16 35 16 o 35.35783 5.430878 17.34699       4.530015 21.05462       9.103743 16.12685       5.222478 33.74769 10.20495 33.04199 6.715168 0.7057037      12.21615 
1 1 1 -16 35 17 o 16.07494 7.014487 1.279209       5.181245 0.000000       0.000000 1.279209       5.181245 ?        ?        16.07494 7.014487 0.000000       7.014487 
1 1 1 -16 35 18 o 14.73067 6.524731 0.3771201      4.639645 0.000000       0.000000 0.3771201      4.639645 ?        ?        14.73067 6.524731 0.000000       6.524731 
1 1 1 -16 35 19 o 16.12500 6.376056 3.031579       3.709003 4.279280       6.491854 2.426937       4.519211 19.09906 8.082726 16.21888 6.796744 2.880180       10.56060 
1 1 1 -16 35 20 o 13.23978 5.811463 0.3370385      3.602958 1.489874       6.535172 -0.1663838     4.318565 17.17159 7.666319 13.82565 6.197873 3.345946       9.858300 
1 1 1 -16 35 21 o 20.13124 7.323272 6.273804       4.649748 -2.536358      6.712289 14.40181       6.447192 15.15305 7.121381 28.57662 8.576109 -13.42357      11.14736 
1 1 1 -16 35 22 o 12.98629 5.837795 -0.3193817     3.860880 4.302608       8.371376 -1.568118      4.351286 19.57783 8.712728 12.83005 5.929276 6.747775       10.53888 
1 1 1 -16 35 23 o 13.23103 5.825231 0.4018275      3.645281 -0.5176062     6.723365 0.7846346      4.338269 15.96483 7.375268 14.40995 6.349158 1.554888       9.731720 
1 1 1 -16 36 1  o 15.00458 5.669812 2.649512       2.836112 1.912373       3.920720 3.458570       4.107535 15.30377 6.365685 17.10366 6.726249 -1.799891      9.260905 
1 1 1 -16 36 2  o 11.14617 4.978676 -0.5605915     2.759748 -0.7569672     3.770680 -0.3340423     4.050019 12.78419 5.756168 13.53569 6.039629 -0.7515020     8.343296 
1 1 1 -16 36 3  o 32.81257 5.170509 14.77948       3.997675 23.59225       7.134676 10.74650       4.826485 39.13575 7.755313 26.45641 7.265265 12.67934       10.62680 
1 1 1 -16 36 4  o 9.448553 4.595169 -5.058182      3.365999 5.662084       6.258205 -9.421725      3.992700 20.56285 8.232433 8.966543 4.476111 11.59630       9.370621 
1 1 1 -16 36 5  o 11.97931 5.470551 -1.388775      3.555164 -5.876001      5.743992 1.397615       4.526326 12.96950 6.232080 15.59684 6.679490 -2.627334      9.135339 
1 1 1 -16 36 6  f 35.61037 7.447556 19.25066       6.254737 0.000000       0.000000 19.25066       6.254737 ?        ?        35.61037 7.447556 0.000000       7.447556 
1 1 1 -16 36 7  o 26.65125 6.444469 10.41526       4.139034 10.32434       7.350997 10.45747       5.008404 24.89137 9.182965 25.97429 7.497228 -1.082922      11.85476 
1 1 1 -16 36 8  o 12.47201 5.665476 -1.162378      3.749671 15.17527       7.100467 -7.480568      4.415587 29.93118 9.004088 10.34363 5.079451 19.58755       10.33801 
1 1 1 -16 36 9  o 15.25578 6.241677 2.077878       3.687029 3.664936       6.146907 1.186001       4.608003 18.84668 7.914238 15.49268 6.688351 3.353998       10.36191 
1 1 1 -16 36 10 o 22.01493 7.372519 7.366587       4.655065 1.332873       6.254790 14.85814       6.969574 17.25455 7.612230 29.59299 8.924783 -12.33845      11.73021 
1 1 1 -16 36 11 o 11.69642 5.441880 -2.278283      3.759830 -0.9998237     6.779171 -2.846235      4.518445 16.37056 7.505304 12.59217 5.893834 3.778385       9.542896 
1 1 1 -16 36 12 o 28.55755 6.505741 12.06620       4.426024 12.05987       8.418110 12.06862       5.203266 25.85912 9.768917 27.73011 7.514353 -1.870991      12.32466 
1 1 1 -16 36 13 o 14.03636 6.157155 0.4122998      4.038488 0.6809642      7.464523 0.3011153      4.801968 17.72610 8.028881 14.92124 6.621984 2.804856       10.40738 
1 1 1 -16 36 14 o 59.59665 4.111336 46.78069       5.934325 57.26237       11.64795 43.10629       6.896478 59.91513 8.191992 56.09081 5.101192 3.824326       9.650434 
1 1 1 -16 36 15 o 18.48505 6.860926 4.799861       4.114483 6.589196       8.078883 4.173218       4.780970 21.37974 9.030793 18.10651 7.213365 3.273224       11.55802 
1 1 1 -16 36 16 o 25.21176 8.461226 10.93978       6.131084 0.000000       0.000000 10.93978       6.131084 ?        ?        25.21176 8.461226 0.000000       8.461226 
1 1 1 -16 36 17 o 19.96298 6.880490 6.048872       4.057709 2.496862       7.896969 7.323110       4.729864 18.66273 8.372549 21.49171 7.427595 -2.828976      11.19235 
1 1 1 -16 36 18 o 11.37951 5.360223 -2.766700      3.841616 0.5558281      8.134770 -3.720362      4.358210 17.74805 8.167891 11.69319 5.566663 6.054867       9.884441 
1 1 1 -16 36 19 o 26.71965 6.530955 10.96424       4.216052 25.85847       8.780959 6.501989       4.806293 37.25030 9.609898 20.32491 7.437525 16.92539       12.15183 
1 1 1 -16 36 20 o 38.40336 5.675990 21.29105       5.152037 28.29009       7.855996 16.00922       6.824554 41.26486 8.101719 29.67794 8.803708 11.58691       11.96424 
1 1 1 -16 37 1  o 27.67707 5.167279 10.78131       3.356982 16.49782       4.936798 5.864659       4.578413 33.37789 6.300371 19.73766 7.253078 13.64022       9.607383 
1 1 1 -16 37 2  o 28.71202 5.034363 11.49202       3.394086 16.18929       4.878807 7.086572       4.724823 33.11994 6.274513 21.23725 7.418764 11.88269       9.716355 
1 1 1 -16 37 3  o 14.61981 6.065473 1.825079       3.546591 -0.6495668     6.285701 2.980848       4.295689 15.79171 7.235095 16.53118 6.747208 -0.7394657     9.892998 
1 1 1 -16 37 4  o 45.84429 5.356661 29.32802       5.871663 33.45240       8.469022 25.51051       8.147858 45.94101 7.846299 38.73965 8.828149 7.201359       11.81104 
1 1 1 -16 37 5  o 13.26349 6.050294 -1.081245      4.333092 0.000000       0.000000 -1.081245      4.333092 ?        ?        13.26349 6.050294 0.000000       6.050294 
1 1 1 -16 37 6  o 24.27958 6.905022 9.129198       4.278884 13.22756       7.317278 6.999525       5.274738 26.95046 9.241414 21.18743 7.785239 5.763023       12.08361 
1 1 1 -16 37 7  o 31.70042 5.858985 14.47545       4.359413 17.22516       7.936962 13.28754       5.216761 30.45109 9.585654 29.01404 7.366277 1.437054       12.08912 
1 1 1 -16 37 8  o 25.60733 6.496214 9.898379       4.059453 3.774895       7.196787 12.75583       4.916194 19.15100 8.312895 28.66534 7.080084 -9.514341      10.91933 
1 1 1 -16 37 9  o 60.18150 4.712941 48.98767       6.856705 43.54245       10.43635 53.12323       9.095115 51.27154 8.661071 60.48393 6.261097 -9.212395      10.68716 
1 1 1 -16 37 10 o 15.97995 6.382596 2.882298       3.752734 -0.7590653     6.273405 4.911427       4.683022 15.72795 7.214117 18.77078 7.238183 -3.042833      10.21933 
1 1 1 -16 37 11 o 26.56726 6.695737 10.80374       4.332719 18.11052       8.192783 7.966747       5.105016 30.88229 9.741258 22.22682 7.714742 8.655468       12.42616 
1 1 1 -16 37 12 o 14.78427 6.243897 1.658602       3.861007 0.6182327      6.680759 2.180354       4.731123 16.79646 7.602951 16.13768 6.867575 0.6587753      10.24541 
1 1 1 -16 37 13 o 29.45885 6.214643 12.88352       4.320822 10.86199       8.060637 13.69858       5.118289 24.20750 9.451265 29.48969 7.188529 -5.282188      11.87440 
1 1 1 -16 37 14 o 15.38357 6.448823 2.109376       4.070436 -6.793979      6.969768 6.717885       5.014431 13.78235 6.681762 20.65958 7.590806 -6.877231      10.11268 
1 1 1 -16 37 15 o 11.78687 5.754029 -7.078910      5.418723 0.000000       0.000000 -7.078910      5.418723 ?        ?        11.78687 5.754029 0.000000       5.754029 
1 1 1 -16 37 16 o 16.19930 6.653299 2.895982       4.209848 -0.3814866     7.996626 4.152623       4.951572 17.10497 7.950811 17.88996 7.265547 -0.7849827     10.77050 
1 1 1 -16 37 17 o 22.74330 7.003635 8.288241       4.262379 14.40293       8.074397 5.926012       5.018614 26.76241 9.662342 19.63511 7.513069 7.127298       12.23957 
1 1 1 -16 38 1  o 17.84640 6.043920 4.692295       3.128203 1.382371       4.395455 8.089454       4.453001 14.93484 6.489566 22.27212 7.198757 -7.337286      9.692088 
1 1 1 -16 38 2  o 14.78146 5.904478 2.429370       3.211874 6.789297       4.667673 -1.491597      4.426469 20.57945 7.356724 12.95599 5.984927 7.623459       9.483709 
1 1 1 -16 38 3  o 18.09675 6.555304 4.792315       3.720359 9.617040       6.352480 2.273569       4.589858 23.23959 8.542912 15.91803 6.768829 7.321563       10.89947 
1 1 1 -16 38 4  o 20.52596 7.267854 6.677806       4.545459 0.000000       0.000000 6.677806       4.545459 ?        ?        20.52596 7.267854 0.000000       7.267854 
1 1 1 -16 38 5  o 14.06811 5.931445 1.491433       3.474771 5.741360       6.277614 -0.3858271     4.172210 19.80203 8.127871 13.38038 6.037032 6.421654       10.12463 
1 1 1 -16 38 6  o 17.74074 6.579277 4.475600       3.782181 11.31233       6.779841 1.386703       4.557189 24.81807 8.866967 15.18842 6.603737 9.629651       11.05588 
1 1 1 -16 38 7  o 15.63557 6.375680 2.640200       3.831272 5.782273       6.811272 1.185945       4.633832 20.00224 8.360522 15.11110 6.612874 4.891132       10.65966 
1 1 1 -16 38 8  o 13.27087 6.077891 -1.064719      4.430283 -2.059477      5.886399 0.2349841      6.728419 14.46969 6.757730 16.44946 7.517233 -1.979767      10.10820 
1 1 1 -16 38 9  o 21.30880 6.829653 7.133229       4.013786 7.685720       7.271725 6.891144       4.813484 21.49881 8.777154 20.75853 7.464752 0.7402802      11.52219 
1 1 1 -16 38 10 o 20.74252 7.292828 6.856253       4.570522 5.029621       7.635412 7.876245       5.705654 19.72672 8.562637 21.69247 8.074030 -1.965757      11.76897 
1 1 1 -16 38 11 o 38.18825 5.142583 20.47619       4.664191 17.21906       8.414319 21.92090       5.603935 29.09038 9.911640 38.45658 6.189840 -9.366199      11.68566 
1 1 1 -16 38 12 o 28.38811 6.520072 12.36648       4.415338 5.075036       7.462908 16.29325       5.476700 19.64388 8.496155 32.00968 7.196410 -12.36580      11.13431 
1 1 1 -15 0  1  o 315.0085 5.631447 1211.372       43.19817 1211.372       43.19817 1211.372       43.19817 315.0085 5.631447 315.0085 5.631447 -0.000000      0.000000 
1 1 1 -15 0  2  o 351.9908 7.616326 1514.274       65.26100 1514.274       65.26100 1514.274       65.26100 351.9908 7.616326 351.9908 7.616326 -0.000000      0.000000 
1 1 1 -15 0  3  o 382.4556 11.62468 1793.970       108.1156 1793.970       108.1156 1793.970       108.1156 382.4556 11.62468 382.4556 11.62468 0.000000       0.000000 
1 1 1 -15 0  4  o 495.8011 10.29608 3007.885       124.2775 3007.885       124.2775 3007.885       124.2775 495.8011 10.29608 495.8011 10.29608 -0.000000      0.000000 
1 1 1 -15 0  5  o 498.3805 10.34450 3039.309       125.5117 3039.309       125.5117 3039.309       125.5117 498.3805 10.34450 498.3805 10.34450 -0.000000      0.000000 
1 1 1 -15 0  6  o 324.5107 7.027118 1286.683       55.51144 1286.683       55.51144 1286.683       55.51144 324.5107 7.027118 324.5107 7.027118 0.000000       0.000000 
1 1 1 -15 0  7  o 23.97671 6.876347 8.532673       3.482616 8.532673       3.482616 8.532673       3.482616 23.97671 6.876347 23.97671 6.876347 0.000000       0.000000 
1 1 1 -15 0  8  o 133.0225 3.886537 216.2499       12.57430 216.2499       12.57430 216.2499       12.57430 133.0225 3.886537 133.0225 3.886537 0.000000       0.000000 
1 1 1 -15 0  9  o 343.1274 7.365106 1438.877       61.52032 1438.877       61.52032 1438.877       61.52032 343.1274 7.365106 343.1274 7.365106 -0.000000      0.000000 
1 1 1 -15 0  10 o 572.5852 16.81971 4040.542       234.2316 4040.542       234.2316 4040.542       234.2316 572.5852 16.81971 572.5852 16.81971 -0.000000      0.000000 
1 1 1 -15 0  11 o 19.32801 8.678832 6.597531       4.366044 6.597531       4.366044 6.597531       4.366044 19.32801 8.678832 19.32801 8.678832 0.000000       0.000000 
1 1 1 -15 0  12 o 371.9439 7.905552 1691.615       71.58182 1691.615       71.58182 1691.615       71.58182 371.9439 7.905552 371.9439 7.905552 0.000000       0.000000 
1 1 1 -15 0  13 o 302.1904 6.612609 1116.088       48.64295 1116.088       48.64295 1116.088       48.64295 302.1904 6.612609 302.1904 6.612609 -0.000000      0.000000 
1 1 1 -15 0  14 o 517.2428 10.71887 3278.949       134.9765 3278.949       134.9765 3278.949       134.9765 517.2428 10.71887 517.2428 10.71887 -0.000000      0.000000 
1 1 1 -15 0  15 o 256.4097 5.795432 803.4470       36.17056 803.4470       36.17056 803.4470       36.17056 256.4097 5.795432 256.4097 5.795432 0.000000       0.000000 
1 1 1 -15 0  16 o 147.0443 4.077085 264.2571       14.58407 264.2571       14.58407 264.2571       14.58407 147.0443 4.077085 147.0443 4.077085 -0.000000      0.000000 
1 1 1 -15 0  17 o 134.6126 3.923696 221.5134       12.84638 221.5134       12.84638 221.5134       12.84638 134.6126 3.923696 134.6126 3.923696 0.000000       0.000000 
1 1 1 -15 0  18 o 121.4762 3.807371 180.4595       11.24565 180.4595       11.24565 180.4595       11.24565 121.4762 3.807371 121.4762 3.807371 -0.000000      0.000000 
1 1 1 -15 0  19 f 216.7877 7.289617 576.1918       38.41138 576.1918       38.41138 576.1918       38.41138 216.7877 7.289617 216.7877 7.289617 -0.000000      0.000000 
1 1 1 -15 0  20 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -15 0  21 o 89.62271 3.690559 98.44717       8.029071 98.44717       8.029071 98.44717       8.029071 89.62271 3.690559 89.62271 3.690559 -0.000000      0.000000 
1 1 1 -15 0  22 o 152.2247 4.246027 283.3379       15.72314 283.3379       15.72314 283.3379       15.72314 152.2247 4.246027 152.2247 4.246027 0.000000       0.000000 
1 1 1 -15 0  23 o 102.4615 3.838917 128.5881       9.554702 128.5881       9.554702 128.5881       9.554702 102.4615 3.838917 102.4615 3.838917 0.000000       0.000000 
1 1 1 -15 0  24 o 56.89380 4.191297 40.13033       5.736889 40.13033       5.736889 40.13033       5.736889 56.89380 4.191297 56.89380 4.191297 -0.000000      0.000000 
1 1 1 -15 0  25 o 71.50057 6.176572 63.86430       10.56962 63.86430       10.56962 63.86430       10.56962 71.50057 6.176572 71.50057 6.176572 0.000000       0.000000 
1 1 1 -15 0  26 o 92.57001 3.862683 105.0942       8.678979 105.0942       8.678979 105.0942       8.678979 92.57001 3.862683 92.57001 3.862683 -0.000000      0.000000 
1 1 1 -15 0  27 o 163.4226 4.480276 326.7708       17.81207 326.7708       17.81207 326.7708       17.81207 163.4226 4.480276 163.4226 4.480276 0.000000       0.000000 
1 1 1 -15 0  28 o 170.6298 4.605632 356.3082       19.11896 356.3082       19.11896 356.3082       19.11896 170.6298 4.605632 170.6298 4.605632 -0.000000      0.000000 
1 1 1 -15 0  29 o 99.64622 3.997766 121.7889       9.672079 121.7889       9.672079 121.7889       9.672079 99.64622 3.997766 99.64622 3.997766 0.000000       0.000000 
1 1 1 -15 0  30 o 24.90396 8.665407 9.930801       4.750103 9.930801       4.750103 9.930801       4.750103 24.90396 8.665407 24.90396 8.665407 -0.000000      0.000000 
1 1 1 -15 0  31 o 21.51521 8.966512 8.004856       4.695762 8.004856       4.695762 8.004856       4.695762 21.51521 8.966512 21.51521 8.966512 -0.000000      0.000000 
1 1 1 -15 0  32 o 255.2748 8.335695 805.5383       51.72906 805.5383       51.72906 805.5383       51.72906 255.2748 8.335695 255.2748 8.335695 0.000000       0.000000 
1 1 1 -15 0  33 o 175.8416 4.771140 379.2107       20.41063 379.2107       20.41063 379.2107       20.41063 175.8416 4.771140 175.8416 4.771140 0.000000       0.000000 
1 1 1 -15 0  34 o 114.8911 4.190148 162.1138       11.69601 162.1138       11.69601 162.1138       11.69601 114.8911 4.190148 114.8911 4.190148 -0.000000      0.000000 
1 1 1 -15 0  35 f 46.91935 5.448513 28.09560       6.010944 28.09560       6.010944 28.09560       6.010944 46.91935 5.448513 46.91935 5.448513 -0.000000      0.000000 
1 1 1 -15 0  36 o 103.9836 6.357533 135.0246       15.97037 135.0246       15.97037 135.0246       15.97037 103.9836 6.357533 103.9836 6.357533 -0.000000      0.000000 
1 1 1 -15 0  37 o 26.26279 8.737191 11.00034       4.977564 11.00034       4.977564 11.00034       4.977564 26.26279 8.737191 26.26279 8.737191 0.000000       0.000000 
1 1 1 -15 0  38 o 56.32977 4.762486 39.93629       6.425838 39.93629       6.425838 39.93629       6.425838 56.32977 4.762486 56.32977 4.762486 0.000000       0.000000 
1 1 1 -15 0  39 o 119.4521 4.283354 176.6489       12.43207 176.6489       12.43207 176.6489       12.43207 119.4521 4.283354 119.4521 4.283354 -0.000000      0.000000 
1 1 1 -15 0  40 o 95.43902 4.218303 113.2651       9.766958 113.2651       9.766958 113.2651       9.766958 95.43902 4.218303 95.43902 4.218303 -0.000000      0.000000 
1 1 1 -15 0  41 o 6.804390 4.894449 -6.588110      3.970075 -6.588110      3.970075 -6.588110      3.970075 6.804390 4.894449 6.804390 4.894449 -0.000000      0.000000 
1 1 1 -15 0  42 f 27.42619 10.44887 13.60126       6.573165 13.60126       6.573165 13.60126       6.573165 27.42619 10.44887 27.42619 10.44887 -0.000000      0.000000 
1 1 1 -15 0  43 f 34.70324 7.692437 17.75305       5.687171 17.75305       5.687171 17.75305       5.687171 34.70324 7.692437 34.70324 7.692437 -0.000000      0.000000 
1 1 1 -15 0  44 o 14.25194 8.430121 3.742750       5.041709 3.742750       5.041709 3.742750       5.041709 14.25194 8.430121 14.25194 8.430121 -0.000000      0.000000 
1 1 1 -15 0  45 o 12.16127 8.250575 -1.436641      7.329165 -1.436641      7.329165 -1.436641      7.329165 12.16127 8.250575 12.16127 8.250575 0.000000       0.000000 
1 1 1 -15 0  46 o 20.87408 9.691075 9.417554       5.459395 9.417554       5.459395 9.417554       5.459395 20.87408 9.691075 20.87408 9.691075 -0.000000      0.000000 
1 1 1 -15 0  47 o 13.53226 8.341308 3.557032       5.374137 3.557032       5.374137 3.557032       5.374137 13.53226 8.341308 13.53226 8.341308 0.000000       0.000000 
1 1 1 -15 0  48 o 11.66214 7.641193 1.322020       5.406168 1.322020       5.406168 1.322020       5.406168 11.66214 7.641193 11.66214 7.641193 -0.000000      0.000000 
1 1 1 -15 1  1  o 468.2628 7.985425 2681.938       91.12212 2721.183       112.5284 2607.188       155.3003 471.2211 9.799443 459.7176 13.87851 11.50351       16.98947 
1 1 1 -15 1  2  o 291.6893 5.279325 1038.369       37.52624 1025.797       45.53753 1064.973       66.24413 289.8027 6.448088 294.7686 9.233495 -4.965881      11.26212 
1 1 1 -15 1  3  o 195.3948 3.969342 465.6089       18.90025 412.4908       31.65791 495.0271       23.55965 183.5961 7.089238 201.4312 4.799609 -17.83513      8.561164 
1 1 1 -15 1  4  o 351.6134 6.166210 1509.605       52.83477 1596.764       95.59372 1471.269       63.39822 360.6475 10.88951 346.9432 7.498641 13.70425       13.22161 
1 1 1 -15 1  5  o 401.6554 5.984434 1969.619       58.57506 2006.481       83.93100 1934.618       81.78593 404.9839 8.504495 397.6777 8.439394 7.306244       11.98123 
1 1 1 -15 1  6  o 240.7794 3.902910 706.9953       22.90044 695.7680       32.15349 718.5535       32.62386 238.7572 5.526314 242.6359 5.517524 -3.878693      7.809175 
1 1 1 -15 1  7  o 523.7333 7.643866 3353.301       97.55720 3299.145       136.4174 3409.988       139.5700 518.6307 10.79383 527.2487 10.86276 -8.617981      15.31360 
1 1 1 -15 1  8  o 398.5498 5.935567 1939.399       57.64756 1933.440       81.44041 1945.383       81.61176 397.5251 8.406965 398.7526 8.398720 -1.227478      11.88341 
1 1 1 -15 1  9  o 741.1956 12.38821 6756.100       223.7575 7145.975       284.5269 6124.141       362.2473 760.4035 15.35476 699.1151 21.28760 61.28845       26.24749 
1 1 1 -15 1  10 o 124.0809 3.040741 187.7028       9.194341 189.2886       15.79257 186.8896       11.30846 124.4242 5.220088 123.7361 3.754686 0.6881256      6.430162 
1 1 1 -15 1  11 o 214.5578 5.087994 561.8825       26.60277 575.2728       38.64734 549.8246       36.67416 216.7760 7.326506 211.9507 7.110572 4.825287       10.20970 
1 1 1 -15 1  12 o 241.6743 4.512480 712.6780       26.57553 668.2651       31.41487 824.4496       49.83632 233.9400 5.510546 259.4327 7.892061 -25.49274      9.625525 
1 1 1 -15 1  13 o 342.0157 5.185388 1428.158       43.21788 1518.760       63.61889 1350.517       58.89297 352.3272 7.409755 332.2646 7.273498 20.06259       10.38307 
1 1 1 -15 1  14 o 215.3284 3.589367 565.5317       18.83455 576.0938       26.95376 555.4532       26.32937 217.2164 5.092026 213.2919 5.065589 3.924454       7.182543 
1 1 1 -15 1  15 o 208.8409 3.523243 531.9821       17.93058 533.2902       25.47354 530.6976       25.24337 208.9853 5.001928 208.4796 4.968756 0.5056458      7.050378 
1 1 1 -15 1  16 o 143.1202 2.839240 249.7615       9.902371 248.0042       14.04495 251.4985       13.96354 142.5049 4.048505 143.5102 3.996683 -1.005356      5.688925 
1 1 1 -15 1  17 o 135.0887 2.781305 222.5188       9.155956 234.0487       13.35421 212.2910       12.57761 138.4350 3.962628 131.8414 3.919158 6.593597       5.573349 
1 1 1 -15 1  18 o 111.7266 2.617349 152.2019       7.126141 149.3321       10.14520 154.9967       10.01189 110.5632 3.770944 112.6520 3.651870 -2.088783      5.249398 
1 1 1 -15 1  19 f 73.20685 3.014581 65.47358       5.366419 65.25274       6.736027 65.85728       8.878787 73.02592 3.798271 73.25122 5.004015 -0.2253036     6.282279 
1 1 1 -15 1  20 o 188.9220 3.831890 435.6130       17.64134 408.1502       29.56453 450.7982       21.98409 182.4409 6.661044 192.1057 4.696043 -9.664795      8.149989 
1 1 1 -15 1  21 o 36.89631 4.139354 16.82995       3.657687 15.45822       4.456065 19.66298       6.403877 35.15756 5.371278 39.49045 6.905818 -4.332890      8.748769 
1 1 1 -15 1  22 o 171.3778 3.173014 358.3415       13.25143 361.5496       18.88229 355.2280       18.60156 171.9673 4.509701 170.4597 4.481964 1.507507       6.358098 
1 1 1 -15 1  23 o 248.6377 4.655260 755.5851       28.20636 732.0057       47.78216 768.1964       34.94452 243.8496 8.051997 250.5061 5.724330 -6.656540      9.879403 
1 1 1 -15 1  24 o 41.96422 3.450824 21.64058       3.497738 20.28022       5.013228 22.93089       4.882461 40.38255 5.216053 43.05116 4.731822 -2.668613      7.042538 
1 1 1 -15 1  25 o 110.8623 4.077097 150.3670       10.99589 149.0755       15.70370 151.6094       15.40177 110.1427 5.871954 111.1031 5.707769 -0.9604111     8.188924 
1 1 1 -15 1  26 o 90.94431 2.740473 101.0033       6.066543 94.34966       8.470795 108.0094       8.692267 87.78358 3.970088 93.95303 3.804392 -6.169449      5.498636 
1 1 1 -15 1  27 o 200.0508 3.527567 488.7992       17.19696 495.5571       24.58057 482.3203       24.06788 201.1827 5.013779 198.4223 4.981437 2.760376       7.067722 
1 1 1 -15 1  28 o 109.9296 2.812611 147.5848       7.528416 145.8531       10.69117 149.2880       10.60295 109.1496 4.026352 110.4394 3.946076 -1.289749      5.637643 
1 1 1 -15 1  29 o 67.64150 2.944688 55.96550       4.842247 54.03215       6.962756 57.77641       6.738682 66.30865 4.332716 68.61280 4.048257 -2.304153      5.929656 
1 1 1 -15 1  30 f 75.69205 2.884933 70.05961       5.311612 60.96661       7.329488 80.11688       7.708329 70.44003 4.290249 80.83321 3.924952 -10.39319      5.814764 
1 1 1 -15 1  31 o 99.27283 2.862520 120.4594       6.917693 123.0376       9.946169 118.0437       9.627789 100.1680 4.083212 98.11807 4.035239 2.049942       5.740712 
1 1 1 -15 1  32 o 115.2647 3.836336 162.8432       10.76078 178.5500       15.72203 149.0005       14.75960 120.3665 5.373573 109.8976 5.529016 10.46894       7.710078 
1 1 1 -15 1  33 o 145.7497 3.108861 259.7929       11.04193 276.9261       16.14141 244.7234       15.13813 150.1337 4.416717 141.1295 4.407080 9.004211       6.239370 
1 1 1 -15 1  34 o 227.3842 3.916405 634.3932       21.70121 641.5671       30.95210 627.4570       30.43473 227.8545 5.574377 225.3532 5.542039 2.501297       7.860526 
1 1 1 -15 1  35 o 142.1910 3.104828 247.6679       10.75836 236.8275       14.91632 259.4209       15.53155 138.5972 4.422086 145.0730 4.398394 -6.475739      6.237043 
1 1 1 -15 1  36 o 41.70796 6.727448 22.35603       6.605032 20.96540       9.442227 23.68854       9.242816 39.43604 9.853960 42.12558 9.256921 -2.689545      13.52003 
1 1 1 -15 1  37 o 72.12245 3.008791 63.97654       5.276474 61.12643       7.412687 66.90386       7.512434 70.13469 4.358714 73.43110 4.215934 -3.296410      6.064033 
1 1 1 -15 1  38 o 78.33515 3.027738 75.61176       5.768894 80.14326       8.222127 71.21796       8.096226 80.23561 4.219981 75.54628 4.417048 4.689331       6.108891 
1 1 1 -15 1  39 o 40.05985 4.062493 20.17618       3.911090 16.87209       5.403089 23.81310       5.668698 35.76877 6.435315 43.02462 5.534738 -7.255848      8.488027 
1 1 1 -15 1  40 o 37.88672 4.306222 18.23942       3.905295 20.94608       5.531126 15.54877       5.514752 39.98618 5.849342 33.88647 6.912700 6.099705       9.055398 
1 1 1 -15 1  41 o 36.84342 4.343360 17.40521       3.824762 12.29435       5.233012 23.26662       5.604096 29.60380 7.300385 42.02491 5.612392 -12.42111      9.208396 
1 1 1 -15 1  42 o 43.97807 4.989896 25.37050       5.253246 26.27917       7.205929 24.33978       7.674624 43.31376 7.070682 40.94642 7.978283 2.367336       10.66056 
1 1 1 -15 1  43 o 15.52973 6.185136 2.296017       3.514173 4.575820       4.923270 -0.7203743E-01 5.017655 19.28504 7.425450 15.32186 6.786022 3.963179       10.05920 
1 1 1 -15 1  44 o 20.70622 6.457550 6.211659       3.610542 6.877249       4.982774 5.475852       5.239012 21.54984 7.611377 20.06812 7.676886 1.481712       10.81053 
1 1 1 -15 1  45 o 14.40287 6.594749 -1.189604      5.211645 -6.375421      7.354631 4.040867       7.386228 14.52250 6.997045 19.53902 8.451599 -5.016522      10.97215 
1 1 1 -15 1  46 o 14.34284 6.129834 1.432309       3.797804 -5.510736      5.273621 8.912405       5.473782 12.12540 5.862515 22.78015 7.983181 -10.65475      9.904558 
1 1 1 -15 1  47 o 18.91621 6.757445 5.735169       3.937489 7.570782       5.523050 3.837934       5.614990 20.68272 7.889530 17.40198 7.445740 3.280748       10.84821 
1 1 1 -15 1  48 o 12.20087 5.607718 -0.7530505     3.817124 -7.012101      5.307132 5.954980       5.494184 11.25346 5.534677 18.68703 7.629287 -7.433566      9.425426 
1 1 1 -15 2  1  o 294.3676 4.117117 1056.908       29.53379 1101.148       39.08333 998.0176       45.09241 300.3589 5.339677 285.8306 6.473789 14.52826       8.391788 
1 1 1 -15 2  2  o 557.0196 7.260747 3792.287       98.55709 3693.274       153.1204 3862.324       128.7800 548.4294 11.45714 561.5457 9.410815 -13.11627      14.82665 
1 1 1 -15 2  3  o 100.0843 2.588766 122.1789       6.308555 123.0357       9.017990 121.3578       8.828321 100.3802 3.692890 99.69554 3.639954 0.6846924      5.185239 
1 1 1 -15 2  4  o 242.2489 4.574793 715.8938       27.00657 719.0847       47.77846 714.3956       32.73831 242.3456 8.101621 241.9269 5.553105 0.4186401      9.822079 
1 1 1 -15 2  5  o 192.8685 3.911698 453.6349       18.38496 445.0351       32.58408 457.6513       22.26815 190.7192 7.022913 193.6821 4.718005 -2.962952      8.460548 
1 1 1 -15 2  6  o 207.7848 3.514637 526.4297       17.79633 534.4963       25.46571 518.7299       24.88012 209.2955 4.992980 206.1879 4.951687 3.107574       7.032001 
1 1 1 -15 2  7  o 233.9269 3.822504 667.3206       21.79034 655.8086       30.61509 679.1400       31.02133 231.8011 5.419807 235.8902 5.396528 -4.089005      7.648322 
1 1 1 -15 2  8  o 594.0176 8.622129 4318.420       124.8102 4161.757       172.1786 4491.895       181.1819 581.8827 12.14248 604.4528 12.30031 -22.57007      17.28403 
1 1 1 -15 2  9  o 102.9743 2.874555 129.3669       7.206270 124.8299       12.14716 131.8308       8.951665 101.0207 4.949396 103.9169 3.540104 -2.896217      6.085134 
1 1 1 -15 2  10 o 328.2588 5.765846 1315.736       46.12278 1376.448       82.07478 1287.714       55.76014 334.8653 10.06925 324.5727 7.049784 10.29260       12.29184 
1 1 1 -15 2  11 o 267.3258 4.222903 871.7930       27.50984 854.3694       38.58596 889.8046       39.23164 264.4794 5.986891 269.9108 5.964584 -5.431396      8.450983 
1 1 1 -15 2  12 o 268.0173 4.892209 876.7545       31.95243 858.8425       38.83747 914.2755       56.21030 265.1495 6.010686 273.0979 8.456392 -7.948364      10.37492 
1 1 1 -15 2  13 o 414.1230 6.152884 2095.644       62.09322 2022.829       85.98573 2174.996       89.76211 406.2845 8.684803 421.2724 8.743673 -14.98792      12.32386 
1 1 1 -15 2  14 o 322.9010 4.940649 1272.930       38.87670 1282.392       55.37618 1263.733       54.59212 323.7732 7.018527 321.4180 6.969855 2.355225       9.891340 
1 1 1 -15 2  15 o 375.6170 5.638209 1723.793       51.60865 1719.868       73.02569 1727.709       72.94569 374.6714 7.998141 375.5313 7.971084 -0.8599548     11.29196 
1 1 1 -15 2  16 o 122.4349 2.682718 182.7690       8.004172 180.7343       11.46881 184.7012       11.17609 121.6467 3.873787 122.9861 3.733367 -1.339386      5.379987 
1 1 1 -15 2  17 o 195.8864 3.910134 468.2269       18.66517 492.7698       33.58549 457.2591       22.45168 200.5279 6.883116 193.5096 4.761130 7.018250       8.369328 
1 1 1 -15 2  18 o 17.06379 5.383193 3.503263       2.501886 6.687627       3.841397 1.157429       3.297057 23.08390 6.534974 14.76509 5.953089 8.318817       8.839974 
1 1 1 -15 2  19 o 245.6615 4.600473 737.0081       27.54075 751.1064       34.25593 711.2393       46.31269 247.8531 5.671596 240.6656 7.907512 7.187469       9.731174 
1 1 1 -15 2  20 o 132.5368 3.202772 214.2858       10.34424 223.1015       18.25664 210.1174       12.55381 134.9612 5.562984 131.1433 3.932639 3.817825       6.812668 
1 1 1 -15 2  21 o 57.21362 2.807042 40.01965       3.901725 41.66190       5.813992 38.67401       5.262830 58.26802 4.121157 56.15369 3.869622 2.114326       5.653132 
1 1 1 -15 2  22 f 114.6872 3.180110 160.6041       8.879202 155.6772       10.77499 171.0293       15.67357 112.8499 3.924110 118.1161 5.460081 -5.266243      6.723921 
1 1 1 -15 2  23 f 140.1904 2.904114 239.7565       9.921288 229.0304       13.91594 250.8443       14.14860 136.8666 4.177221 143.2556 4.056982 -6.389023      5.823081 
1 1 1 -15 2  24 o 142.8200 3.432601 248.9874       11.94671 245.3860       21.33787 250.6318       14.41844 141.3568 6.209540 143.1725 4.136932 -1.815735      7.461407 
1 1 1 -15 2  25 o 49.97061 3.963300 30.69529       4.786724 34.20101       5.879743 23.80550       8.242757 52.68591 4.626535 43.28223 8.112964 9.403679       9.339433 
1 1 1 -15 2  26 o 201.5403 3.534326 496.0318       17.35820 489.4465       24.55524 502.6095       24.54117 199.9019 5.044734 202.6493 4.969515 -2.747421      7.081344 
1 1 1 -15 2  27 o 27.73956 5.051707 9.712379       3.289096 7.323749       4.644967 12.11446       4.658029 24.27073 7.278390 30.84763 6.406182 -6.576899      9.696089 
1 1 1 -15 2  28 o 64.41754 2.984015 50.76441       4.671537 49.54835       6.800921 51.85074       6.427947 63.48557 4.423664 64.99287 4.079118 -1.507301      6.017309 
1 1 1 -15 2  29 o 158.2679 3.150466 305.9117       12.15077 297.1255       17.11296 314.8449       17.25549 155.7247 4.514295 160.3227 4.420902 -4.597977      6.318483 
1 1 1 -15 2  30 o 117.9710 2.888749 169.9426       8.304644 173.2676       11.91598 166.8022       11.58030 118.9157 4.118226 116.6795 4.079035 2.236191       5.796404 
1 1 1 -15 2  31 o 155.3689 3.597751 295.2217       13.62170 290.7445       16.83967 303.6966       23.16856 153.9622 4.493120 156.9333 6.069701 -2.971100      7.551781 
1 1 1 -15 2  32 f 145.9353 3.511304 260.5578       12.48719 245.1451       20.48184 269.6759       15.75365 140.8857 5.979360 148.2387 4.365728 -7.353043      7.403534 
1 1 1 -15 2  33 o 161.2033 3.239510 317.9178       12.72593 313.9974       18.00541 321.8311       17.98895 159.8048 4.628443 161.8068 4.566753 -2.002045      6.502132 
1 1 1 -15 2  34 o 163.9781 3.279593 329.2531       13.10514 346.1687       18.99188 313.8775       18.10673 167.6559 4.653004 159.6364 4.659475 8.019485       6.584918 
1 1 1 -15 2  35 o 53.62577 3.372672 35.39948       4.385091 41.88424       6.341116 29.45613       6.070634 58.13004 4.511699 48.53295 5.214578 9.597088       6.895452 
1 1 1 -15 2  36 f 61.16490 5.192168 46.75850       7.665975 53.84963       11.41980 40.94194       10.34270 64.89529 7.350474 56.33943 7.737465 8.555862       10.67229 
1 1 1 -15 2  37 o 54.60216 3.334651 36.80672       4.415911 39.62387       6.326808 34.13065       6.166365 56.32338 4.650982 52.17219 4.907781 4.151188       6.761505 
1 1 1 -15 2  38 o 54.46580 3.397094 36.73372       4.486420 29.08148       6.078272 45.89231       6.649673 47.86705 5.299497 60.54040 4.540403 -12.67335      6.978534 
1 1 1 -15 2  39 o 11.11766 5.069140 -1.762666      3.037247 -3.282862      4.460594 -0.4486140     4.147145 12.92535 5.983842 14.36517 6.271854 -1.439816      8.668479 
1 1 1 -15 2  40 o 29.96147 5.075024 11.68511       3.573285 12.08417       5.002540 11.26941       5.105819 29.74277 7.016315 28.61933 7.299102 1.123444       10.12450 
1 1 1 -15 2  41 o 79.88684 3.093412 79.46426       6.010735 78.16061       8.340225 80.87313       8.670307 78.38817 4.383536 79.66293 4.484345 -1.274757      6.270944 
1 1 1 -15 2  42 o 34.84472 5.432644 16.24344       4.462618 20.82319       5.688564 8.914636       7.196119 39.05570 6.182607 24.92601 9.103897 14.12969       11.00480 
1 1 1 -15 2  43 o 46.07234 3.998304 27.41021       4.444625 31.44754       6.359028 23.55400       6.214752 48.20214 5.512657 40.93129 6.443403 7.270844       8.479789 
1 1 1 -15 2  44 o 47.94246 3.939682 29.86118       4.562179 26.94958       6.607226 32.51421       6.307027 43.40334 6.441995 48.76467 5.397678 -5.361332      8.404417 
1 1 1 -15 2  45 o 25.39845 8.047845 10.64994       5.586190 15.36407       8.285111 6.720540       7.564152 28.48122 9.831027 21.41401 8.868809 7.067217       13.24027 
1 1 1 -15 2  46 o 18.85248 6.653326 5.389739       3.806748 3.625278       5.402493 7.129672       5.364813 17.58276 7.403658 20.84081 7.814612 -3.258055      10.76486 
1 1 1 -15 2  47 o 12.15914 5.576607 -0.9009963     3.747391 -3.962272      5.417116 1.908357       5.189435 12.70331 6.090511 15.70897 6.931894 -3.005662      9.227431 
1 1 1 -15 2  48 o 16.44121 6.550667 3.947375       3.943295 5.894884       5.547606 1.958527       5.606176 18.61883 7.641284 15.71255 7.051293 2.906281       10.39759 
1 1 1 -15 3  1  o 353.1034 4.802357 1521.392       41.32306 1514.810       65.10079 1525.833       53.47785 351.9560 7.590350 353.4461 6.208900 -1.490112      9.806316 
1 1 1 -15 3  2  o 85.62368 2.360903 89.42754       4.921453 88.49128       7.674743 90.08141       6.413742 85.10477 3.709524 85.90400 3.068741 -0.7992249     4.814327 
1 1 1 -15 3  3  o 499.8763 6.555943 3052.401       79.86084 3085.924       127.1612 3030.568       102.6238 501.6428 10.40217 497.6623 8.462079 3.980469       13.40940 
1 1 1 -15 3  4  o 408.6034 5.447212 2037.822       54.23909 2054.224       86.19682 2027.070       69.78732 409.7061 8.633417 407.2881 7.031350 2.417969       11.13444 
1 1 1 -15 3  5  o 269.8621 4.958156 888.6154       32.60605 912.1383       58.44682 877.9865       39.28796 272.8495 8.801773 268.1527 6.012308 4.696838       10.65922 
1 1 1 -15 3  6  o 50.91349 4.535423 31.87244       5.568284 48.71827       9.662812 23.49715       6.813298 62.83453 6.399808 43.35992 6.660818 19.47461       9.237101 
1 1 1 -15 3  7  o 75.16574 2.500336 68.94265       4.573509 66.00537       6.576599 71.69349       6.364453 73.47957 3.684568 76.60452 3.417950 -3.124947      5.025776 
1 1 1 -15 3  8  o 270.1988 4.898054 890.8645       32.25099 916.3871       56.62033 878.6069       39.23853 273.5068 8.505430 268.2346 6.002911 5.272278       10.41044 
1 1 1 -15 3  9  o 307.7721 5.454327 1156.336       40.90784 1071.998       67.58836 1205.093       51.38946 295.6420 9.393364 314.0410 6.715086 -18.39905      11.54676 
1 1 1 -15 3  10 o 229.5540 3.763656 642.6638       21.05382 644.8807       30.08020 640.5347       29.47813 229.8379 5.370602 229.0694 5.280765 0.7685089      7.531922 
1 1 1 -15 3  11 o 117.8849 2.638692 169.4078       7.580242 165.0059       10.91020 173.5157       10.53957 116.2475 3.856688 119.2247 3.631844 -2.977142      5.297578 
1 1 1 -15 3  12 o 306.2347 5.461258 1145.162       40.75521 1134.183       49.82478 1167.362       70.84663 304.5927 6.712584 308.3769 9.438715 -3.784180      11.58223 
1 1 1 -15 3  13 o 57.31731 2.632409 40.13521       3.667027 37.32158       5.523383 42.35290       4.903670 55.15349 4.139777 58.83044 3.435397 -3.676952      5.379563 
1 1 1 -15 3  14 o 188.4988 3.803730 433.4539       17.47247 466.7817       32.09586 419.4172       20.82941 195.2445 6.755991 185.3695 4.611080 9.874954       8.179577 
1 1 1 -15 3  15 o 99.42645 2.551098 120.5988       6.175987 125.3302       9.105824 116.5681       8.404589 101.2925 3.695169 97.69347 3.536160 3.599037       5.114557 
1 1 1 -15 3  16 o 244.5822 4.562206 730.2872       27.19166 726.1649       47.45652 732.3021       33.17801 243.2726 8.016045 244.8047 5.561531 -1.532166      9.756413 
1 1 1 -15 3  17 o 77.36496 2.531778 73.05176       4.766733 78.89137       7.263616 68.63454       6.317358 80.32573 3.720862 74.92898 3.469204 5.396751       5.087258 
1 1 1 -15 3  18 o 56.70742 3.143477 39.34196       4.326967 37.52798       5.581197 42.07489       6.850552 55.29162 4.173011 58.49352 4.849527 -3.201893      6.397807 
1 1 1 -15 3  19 o 183.1084 3.775554 409.1656       16.84710 411.6050       20.90971 404.6521       28.44283 183.5177 4.679380 181.7145 6.433287 1.803207       7.955110 
1 1 1 -15 3  20 o 229.8382 4.366843 645.0903       24.45828 691.3638       44.24900 624.7330       29.34927 237.2682 7.662983 226.0595 5.327684 11.20868       9.333035 
1 1 1 -15 3  21 o 180.2296 3.260450 396.3178       14.31990 412.0850       20.86918 382.2886       19.68541 183.5913 4.668417 176.8374 4.571919 6.753906       6.534260 
1 1 1 -15 3  22 o 89.66297 2.631804 98.13242       5.744240 96.45521       8.331503 99.65208       7.930489 88.80045 3.859315 90.28416 3.611850 -1.483711      5.285809 
1 1 1 -15 3  23 o 111.2614 2.729831 150.9971       7.401444 156.4144       10.83030 146.2498       10.13837 113.1053 3.935349 109.3761 3.809545 3.729195       5.477190 
1 1 1 -15 3  24 o 272.3370 6.218972 909.1712       41.27255 931.3542       59.77315 888.9578       57.05789 274.6168 8.943812 268.3696 8.736256 6.247131       12.50256 
1 1 1 -15 3  25 o 98.22226 3.223399 117.8828       7.704979 114.9475       9.401293 123.8881       13.44709 96.91721 3.989146 100.4289 5.515746 -3.511703      6.807109 
1 1 1 -15 3  26 f 185.9312 3.372252 422.0954       15.27947 395.8448       21.15579 450.7194       22.09143 179.7966 4.832877 191.9411 4.723020 -12.14453      6.757486 
1 1 1 -15 3  27 o 137.5410 2.953447 230.8947       9.899138 223.2402       14.01686 238.5113       13.98220 135.0502 4.264461 139.6190 4.114042 -4.568787      5.925451 
1 1 1 -15 3  28 o 97.27866 2.810010 115.5945       6.654359 118.8648       9.687564 112.6730       9.156265 98.51476 4.043910 95.92471 3.925276 2.590050       5.635690 
1 1 1 -15 3  29 o 82.15825 2.884031 82.50720       5.765183 85.67326       8.400975 79.68893       7.926132 83.58332 4.137385 80.61542 4.047610 2.967903       5.788013 
1 1 1 -15 3  30 o 140.9088 3.016896 242.5094       10.35940 240.8846       14.81157 244.0653       14.49440 140.1895 4.340831 141.1359 4.219048 -0.9463501     6.053361 
1 1 1 -15 3  31 o 163.0260 3.714944 325.1331       14.75860 326.8857       18.45320 322.0221       24.58597 163.2164 4.644228 161.5346 6.257601 1.681763       7.792716 
1 1 1 -15 3  32 o 82.29536 3.272045 82.94768       6.548838 78.96967       10.48556 85.49177       8.385425 79.93265 5.415051 83.42234 4.137749 -3.489693      6.814964 
1 1 1 -15 3  33 o 70.72189 3.068936 61.28131       5.276461 67.91373       7.595745 55.09617       7.335162 74.28180 4.213436 66.82536 4.531149 7.456444       6.187435 
1 1 1 -15 3  34 o 25.81986 5.694886 8.560667       3.486839 8.009932       4.991042 9.085732       4.873335 25.14913 7.545313 26.55630 7.303516 -1.407173      10.50110 
1 1 1 -15 3  35 o 135.0282 3.058032 223.3442       10.06242 227.9182       14.41152 218.9932       14.05597 135.9646 4.355203 133.2811 4.333450 2.683594       6.143825 
1 1 1 -15 3  36 o 79.17123 4.627152 77.79287       8.888330 76.17794       12.94386 79.23383       12.22677 77.47488 6.929006 79.25996 6.384233 -1.785080      9.421760 
1 1 1 -15 3  37 o 21.70183 5.944417 6.106854       3.235788 1.405584       4.466470 11.29977       4.694211 16.70220 6.855726 29.32931 6.713244 -12.62711      9.595241 
1 1 1 -15 3  38 o 43.67318 3.876431 23.80179       4.082747 21.33054       5.626139 26.55079       5.933900 40.71565 5.837133 45.64890 5.441246 -4.933247      7.979930 
1 1 1 -15 3  39 o 43.87815 3.819945 24.10054       4.043854 19.93056       5.560972 28.78022       5.891036 39.08752 6.032053 47.48083 5.175058 -8.393318      7.947761 
1 1 1 -15 3  40 f 63.09571 3.264884 49.52350       5.002926 45.96477       6.964823 53.31713       7.191010 60.06987 4.797770 64.84245 4.580344 -4.772579      6.633110 
1 1 1 -15 3  41 o 18.27930 6.320156 4.181140       3.424734 2.678885       4.554461 6.135771       5.195142 17.53772 7.022417 21.79664 7.764638 -4.258915      10.46919 
1 1 1 -15 3  42 o 22.99535 6.893018 7.471406       4.166769 11.67522       5.158027 -0.4247743     7.069197 28.38799 7.386459 17.76587 7.949546 10.62211       10.85150 
1 1 1 -15 3  43 o 26.74526 5.974863 10.06390       3.795814 12.57904       5.308199 7.431965       5.430056 28.98041 7.469328 22.54328 7.947117 6.437126       10.90631 
1 1 1 -15 3  44 o 10.33231 4.940135 -3.892733      3.510828 -14.46081      4.835101 7.893174       5.106096 9.036095 4.565241 22.71781 7.721446 -13.68172      8.970069 
1 1 1 -15 3  45 o 13.67741 6.417962 -2.936710      5.415401 -2.278430      7.925297 -3.513262      7.417013 16.59656 7.780186 15.62767 7.387550 0.9688921      10.72880 
1 1 1 -15 3  46 o 13.92928 6.042228 1.004355       3.796893 4.524590       5.468606 -2.272051      5.275817 18.33964 7.562939 13.57359 6.358181 4.766051       9.880511 
1 1 1 -15 3  47 o 16.24178 6.528701 3.516779       3.952543 5.020319       5.806582 2.218588       5.395507 18.35330 7.698579 16.05706 7.077550 2.296238       10.45753 
1 1 1 -15 3  48 f 16.15829 6.541511 3.680275       3.999249 2.483587       5.631930 4.897462       5.679960 16.04591 7.143299 17.79285 7.546514 -1.746941      10.39118 
1 1 1 -15 4  1  o 245.5867 3.594458 735.5021       21.51168 754.3407       34.44449 723.4557       27.54379 248.5536 5.686744 243.4983 4.641856 5.055328       7.340700 
1 1 1 -15 4  2  o 407.1614 5.441257 2023.744       53.98859 2050.196       86.02831 2006.557       69.34399 409.2326 8.626508 405.1755 7.023110 4.057068       11.12388 
1 1 1 -15 4  3  o 74.66135 2.621074 68.03257       4.761426 67.57193       6.644735 68.51873       6.826281 74.34784 3.678953 74.86317 3.753770 -0.5153351     5.255995 
1 1 1 -15 4  4  o 105.2735 2.355414 135.0802       6.042580 126.1042       9.441397 141.3077       7.864182 101.6160 3.819544 107.6197 3.001581 -6.003639      4.857820 
1 1 1 -15 4  5  o 269.2534 4.303226 884.3378       28.23523 833.7043       38.47028 943.4625       41.57104 261.2886 6.041834 277.9466 6.137527 -16.65802      8.612375 
1 1 1 -15 4  6  o 64.98708 3.145853 51.61048       4.967175 50.13438       10.69070 52.01687       5.609413 63.66900 7.006016 65.21746 3.542837 -1.548462      7.850857 
1 1 1 -15 4  7  o 268.7883 4.879448 881.5974       31.96076 913.8160       56.42338 866.3757       38.78266 273.1164 8.487949 266.3593 5.974943 6.757111       10.38004 
1 1 1 -15 4  8  o 354.7240 6.168570 1536.882       53.32258 1451.386       88.93269 1584.870       66.62724 343.7367 10.62972 359.9945 7.594861 -16.25775      13.06418 
1 1 1 -15 4  9  o 264.1229 4.193527 850.9860       26.99116 867.0404       38.84867 836.0045       37.52811 266.4426 5.983240 261.6404 5.885939 4.802185       8.393059 
1 1 1 -15 4  10 o 196.2742 3.383747 469.7581       16.18442 451.2695       22.70380 488.8600       23.07722 192.2323 4.850463 200.1497 4.731429 -7.917480      6.775943 
1 1 1 -15 4  11 o 55.36460 2.662841 37.45367       3.582106 35.97279       5.501343 38.54364       4.719734 54.13881 4.202779 56.11246 3.468568 -1.973656      5.449249 
1 1 1 -15 4  12 o 423.6110 7.273608 2195.252       75.08501 2323.063       95.53901 1988.781       121.4296 435.3034 9.006427 401.4725 12.42671 33.83093       15.34727 
1 1 1 -15 4  13 o 253.5196 4.706559 784.5156       29.07711 771.1646       35.47641 811.8409       50.75336 251.2381 5.794528 257.3228 8.103863 -6.084747      9.962386 
1 1 1 -15 4  14 o 203.4729 3.472643 504.9684       17.21880 498.9134       24.57506 510.8077       24.13308 202.1393 4.988935 204.5472 4.841534 -2.407928      6.951972 
1 1 1 -15 4  15 o 302.1654 6.588945 1116.827       48.51731 0.000000       0.000000 1116.827       48.51731 ?        ?        302.1654 6.588945 0.000000       6.588945 
1 1 1 -15 4  16 o 114.3629 2.660147 159.4657       7.413561 157.4975       10.85128 161.1886       10.15231 113.5424 3.927726 114.8887 3.630754 -1.346252      5.348776 
1 1 1 -15 4  17 o 319.2857 4.912405 1245.106       38.22168 1226.578       53.88323 1263.871       54.22562 316.5140 6.985937 321.3029 6.925542 -4.788971      9.836993 
1 1 1 -15 4  18 o 263.6143 4.872562 848.8401       31.30131 823.0571       37.87436 904.3971       55.59651 259.4147 5.991210 271.3076 8.419291 -11.89282      10.33340 
1 1 1 -15 4  19 o 114.3126 2.673764 159.3453       7.448236 151.0863       10.72078 167.0511       10.35551 111.1877 3.963040 116.9482 3.638063 -5.760468      5.379701 
1 1 1 -15 4  20 o 93.76861 2.926873 107.3465       6.679829 103.5282       11.88466 109.1097       8.076204 91.86854 5.331554 94.49513 3.513328 -2.626595      6.385056 
1 1 1 -15 4  21 o 231.4145 3.835608 653.7457       21.63021 676.1193       31.50504 633.7957       29.74984 235.1067 5.498940 227.6508 5.362648 7.455887       7.680908 
1 1 1 -15 4  22 o 120.0670 2.756955 175.8357       8.066578 181.1365       11.89936 171.3284       10.97264 121.7262 4.016970 118.4012 3.807886 3.325012       5.534984 
1 1 1 -15 4  23 o 128.3867 2.819435 201.0757       8.821010 211.6089       13.05391 192.2243       11.96649 131.5592 4.076691 125.3992 3.920758 6.160004       5.656125 
1 1 1 -15 4  24 o 84.77853 3.173258 87.83720       6.544255 80.35674       12.36522 90.74773       7.713027 80.70837 6.337865 86.12958 3.683328 -5.421204      7.330446 
1 1 1 -15 4  25 f 130.2087 3.361083 207.1155       10.65595 206.7605       13.18454 207.7842       18.09506 130.0066 4.167012 130.1002 5.721493 -0.9361267E-01 7.078098 
1 1 1 -15 4  26 o 154.9162 3.086450 292.9307       11.65178 316.5996       17.34165 273.4520       15.73192 160.8433 4.428583 149.4887 4.323083 11.35457       6.188812 
1 1 1 -15 4  27 o 92.30067 2.805159 104.0623       6.302227 97.49109       9.066477 110.2058       8.766482 89.19785 4.182724 94.89275 3.798698 -5.694901      5.650247 
1 1 1 -15 4  28 o 181.6552 3.371920 403.0656       14.92661 395.5461       21.23044 410.4160       20.99043 179.6505 4.853920 183.0295 4.710045 -3.378983      6.763509 
1 1 1 -15 4  29 o 92.61131 2.858860 104.8086       6.444252 107.1024       9.407620 102.7807       8.845436 93.47266 4.140360 91.58583 3.972730 1.886826       5.738045 
1 1 1 -15 4  30 o 148.6354 3.103619 269.8811       11.24156 270.0008       16.22947 269.7707       15.58599 148.3919 4.493229 148.3647 4.315484 0.2717590E-01  6.229969 
1 1 1 -15 4  31 f 91.22222 3.338334 101.8627       7.408553 100.4541       9.383161 104.1944       12.07243 90.45580 4.268778 91.92020 5.413456 -1.464401      6.894054 
1 1 1 -15 4  32 o 116.1449 3.287032 165.1084       9.294006 143.9975       14.95840 178.3825       11.86135 107.9595 5.706019 120.5898 4.042050 -12.63027      6.992627 
1 1 1 -15 4  33 o 61.62207 3.238863 46.58986       4.846603 51.04032       6.977026 42.43971       6.737510 64.31065 4.479973 58.56290 4.762138 5.747742       6.538204 
1 1 1 -15 4  34 o 84.92302 2.942488 88.34505       6.080225 88.50562       8.730056 88.19378       8.473172 84.75771 4.240169 84.63372 4.120727 0.1239853      5.912649 
1 1 1 -15 4  35 o 34.83959 4.379506 15.18285       3.636254 15.89433       5.371676 14.58107       4.940250 35.15860 6.509305 33.70366 6.244917 1.454945       9.020535 
1 1 1 -15 4  36 o 14.41113 6.608170 -3.445108      5.258556 -6.746675      8.279029 -1.212372      6.808288 17.32268 8.064834 18.15859 7.979011 -0.8359108     11.34487 
1 1 1 -15 4  37 o 108.3192 2.939183 144.1808       7.751158 141.3774       10.95377 146.9925       10.96984 106.7829 4.217748 108.9199 4.140457 -2.136971      5.910396 
1 1 1 -15 4  38 o 63.18375 3.873399 49.64915       5.935284 33.35854       10.97429 56.38424       7.056334 49.23499 9.490820 67.18051 4.333336 -17.94552      10.43329 
1 1 1 -15 4  39 o 18.36127 6.205304 4.122165       3.297421 0.5484029E-01  4.371922 9.488681       5.021855 15.14035 6.525360 26.46109 7.465335 -11.32074      9.915217 
1 1 1 -15 4  40 o 40.43052 4.037170 20.67635       3.924485 22.04997       5.536848 19.28954       5.563366 41.05959 5.686086 38.11906 6.202084 2.940521       8.414121 
1 1 1 -15 4  41 f 20.27096 6.516132 5.473586       3.651819 1.019178       5.178564 9.879767       5.150454 16.78269 7.164848 26.39022 7.598379 -9.607531      10.44368 
1 1 1 -15 4  42 o 40.13645 4.445096 20.91909       4.274876 22.55341       5.925303 19.14498       6.173508 40.59131 6.185405 36.67244 7.165094 3.918873       9.465611 
1 1 1 -15 4  43 o 12.76027 5.664709 -0.4511271     3.516697 2.610875       4.984386 -3.486186      4.962408 17.36086 7.195563 13.10685 6.148149 4.254003       9.464452 
1 1 1 -15 4  44 o 34.87939 4.963551 16.50452       4.099947 10.51338       5.737411 22.75647       5.860965 25.60340 8.161136 39.97052 6.219398 -14.36712      10.26085 
1 1 1 -15 4  45 o 24.46761 8.188636 10.04308       5.742825 5.667161       8.176533 14.30331       8.067720 20.76683 8.936824 27.45172 9.686039 -6.684889      13.17900 
1 1 1 -15 4  46 o 16.44334 6.433703 3.536114       3.741760 2.148581       5.427244 4.793152       5.165731 16.40252 7.167817 18.41675 7.442208 -2.014229      10.33267 
1 1 1 -15 4  47 o 15.64555 6.384905 3.037105       3.846134 1.610844       5.480372 4.421351       5.399050 15.68132 7.009347 17.70282 7.424470 -2.021504      10.21047 
1 1 1 -15 4  48 o 12.06568 5.558064 -0.8348621     3.779410 0.8081174      5.750754 -2.084020      5.014382 15.08384 6.914358 12.86578 6.079640 2.218063       9.207082 
1 1 1 -15 5  1  o 157.3143 2.746505 301.6956       10.52894 322.0330       17.13930 289.3685       13.34365 162.4096 4.334448 154.0398 3.554721 8.369720       5.605665 
1 1 1 -15 5  2  o 229.0652 3.419662 639.8284       19.08879 624.9155       29.82754 650.1730       24.84231 226.2473 5.410010 230.8493 4.415981 -4.602081      6.983488 
1 1 1 -15 5  3  o 258.2146 3.724532 813.1322       23.43628 824.8212       37.38739 805.5661       30.07967 259.8861 5.903450 256.9333 4.804151 2.952820       7.611215 
1 1 1 -15 5  4  o 241.3496 3.967011 710.4597       23.33168 692.1979       32.57752 729.6908       33.43099 238.1066 5.614492 244.4703 5.611605 -6.363708      7.938050 
1 1 1 -15 5  5  f 157.3244 3.387985 301.7990       12.98893 312.9772       22.52840 296.2329       15.89724 159.9945 5.787691 155.7802 4.191486 4.214264       7.146043 
1 1 1 -15 5  6  o 173.0819 3.570835 365.3142       15.06113 375.9841       26.25542 360.0811       18.38723 175.3423 6.154178 171.7453 4.396962 3.597031       7.563542 
1 1 1 -15 5  7  o 119.6596 3.140550 174.6949       9.149845 208.6170       18.94568 164.3760       10.44924 130.5615 5.970490 116.0383 3.700007 14.52317       7.024015 
1 1 1 -15 5  8  o 217.7192 3.646642 578.0790       19.34755 562.4404       27.32162 593.8096       27.40170 214.6534 5.223149 220.5677 5.097996 -5.914291      7.298688 
1 1 1 -15 5  9  o 275.3188 4.337156 924.7902       29.09893 930.0231       41.62265 919.7874       40.69715 275.9105 6.190495 274.4002 6.086162 1.510345       8.681221 
1 1 1 -15 5  10 o 125.3092 2.723087 191.4272       8.315348 187.3924       12.11299 195.0233       11.43558 123.8777 4.017879 126.3971 3.716695 -2.519402      5.473315 
1 1 1 -15 5  11 o 204.8195 3.494178 511.6203       17.44024 513.0809       25.08159 510.2530       24.26701 205.0115 5.020430 204.4571 4.870550 0.5543671      6.994782 
1 1 1 -15 5  12 o 217.0636 3.634405 574.6894       19.22456 552.8652       27.00370 597.1185       27.37539 212.7854 5.207694 221.1490 5.079714 -8.363602      7.274859 
1 1 1 -15 5  13 o 86.74480 3.009316 91.86316       6.351688 93.94431       8.210369 88.76108       10.02393 87.66918 3.852489 85.13020 4.851997 2.538986       6.195446 
1 1 1 -15 5  14 o 65.59355 2.604018 52.53744       4.154104 52.95631       6.516566 52.25071       5.391603 65.75140 4.087244 65.36423 3.396519 0.3871689      5.314311 
1 1 1 -15 5  15 o 234.4417 3.841059 670.6044       21.94431 684.1802       31.80896 658.2755       30.31295 236.6321 5.516196 232.1274 5.358776 4.504669       7.690571 
1 1 1 -15 5  16 o 151.8622 3.369656 281.3087       12.47014 289.8569       22.69484 277.6117       14.92512 153.8448 6.065411 150.7687 4.066000 3.076080       7.302162 
1 1 1 -15 5  17 o 147.0422 4.256588 264.1500       15.23640 264.1500       15.23640 0.000000       0.000000 147.0422 4.256588 ?        ?        0.000000       4.256588 
1 1 1 -15 5  18 o 98.78453 3.006400 119.1258       7.228798 112.8785       13.39151 121.6948       8.587407 95.90923 5.756206 99.80919 3.536244 -3.899956      6.755659 
1 1 1 -15 5  19 o 255.8473 4.121857 799.1146       25.69862 810.4145       37.06787 788.6569       35.65969 257.3871 5.909828 253.9333 5.762645 3.453812       8.254341 
1 1 1 -15 5  20 o 355.1140 6.212987 1543.827       53.76559 1599.851       95.65018 1517.950       65.00770 359.5669 10.92885 351.7181 7.584622 7.848785       13.30287 
1 1 1 -15 5  21 o 45.06300 3.160015 24.89640       3.448130 26.97092       5.506921 23.55856       4.422341 46.71967 4.910275 43.72073 4.202471 2.998947       6.463092 
1 1 1 -15 5  22 o 241.0847 3.964790 709.7446       23.29302 711.8524       33.39442 707.7473       32.50615 241.1628 5.682342 240.4921 5.546623 0.6707611      7.940657 
1 1 1 -15 5  23 o 88.49383 3.113015 95.67586       6.702754 115.0517       13.68498 89.56075       7.688048 96.75123 5.831390 85.56694 3.695721 11.18429       6.903873 
1 1 1 -15 5  24 o 109.8753 3.214748 147.4702       8.598362 154.6437       16.50455 144.7980       10.07335 112.1632 6.060851 108.8190 3.804534 3.344147       7.156004 
1 1 1 -15 5  25 o 96.59966 3.234072 114.0342       7.602365 117.9959       9.625173 107.4635       12.39562 98.18647 4.031302 93.51250 5.463340 4.673965       6.789660 
1 1 1 -15 5  26 o 159.5313 3.676193 310.8863       14.29158 309.2481       17.65234 314.0030       24.34835 158.9368 4.562378 159.8235 6.263752 -0.8866882     7.749187 
1 1 1 -15 5  27 o 116.5323 2.859637 165.7359       8.120697 167.4094       11.81983 164.2398       11.17600 116.9390 4.154379 115.8498 3.964563 1.089165       5.742528 
1 1 1 -15 5  28 o 111.2772 2.868783 151.2504       7.772805 148.7538       11.30139 153.4915       10.70746 110.1956 4.216318 111.9781 3.929983 -1.782562      5.763862 
1 1 1 -15 5  29 o 188.1372 3.449305 432.5363       15.81402 442.9420       22.95918 423.1432       21.81358 190.0274 4.962219 185.7635 4.822785 4.263901       6.919745 
1 1 1 -15 5  30 o 99.33541 2.853591 120.5965       6.900517 125.0244       10.20512 116.8666       9.366355 100.9742 4.156240 97.65007 3.944178 3.324142       5.729823 
1 1 1 -15 5  31 o 178.5440 3.905413 390.2145       16.99215 396.7378       21.39422 379.0681       27.96586 179.7305 4.889249 175.1222 6.564782 4.608231       8.185421 
1 1 1 -15 5  32 o 82.99432 3.245699 84.36912       6.551709 90.90131       11.22517 80.99411       8.068643 85.76567 5.398235 81.18843 4.091403 4.577240       6.773516 
1 1 1 -15 5  33 o 171.4498 3.331094 359.8145       13.91746 368.7633       20.24001 351.7883       19.16821 173.0758 4.803508 169.0947 4.656172 3.981064       6.689815 
1 1 1 -15 5  34 o 103.9837 2.944614 132.4211       7.454053 142.8875       11.02061 123.5954       10.12011 107.7365 4.205734 100.2011 4.153547 7.535339       5.911019 
1 1 1 -15 5  35 o 37.02643 4.285100 17.10923       3.795134 24.23608       5.648032 11.24268       5.124361 43.89876 5.392877 29.34594 7.216706 14.55282       9.009105 
1 1 1 -15 5  36 o 86.24022 3.555385 91.64143       7.455904 94.48851       9.311098 86.55333       12.44740 87.31891 4.389871 82.86555 6.209236 4.453354       7.604313 
1 1 1 -15 5  37 o 69.88257 3.033167 60.12784       5.153067 63.55850       7.502147 57.06346       7.090352 71.47417 4.327528 67.71320 4.319451 3.760963       6.114341 
1 1 1 -15 5  38 o 46.92955 3.639468 27.40781       4.129666 31.21759       5.914089 23.78258       5.769071 49.68193 4.950701 43.06155 5.632579 6.620384       7.499026 
1 1 1 -15 5  39 o 73.99993 3.076870 67.76276       5.536408 64.28032       7.772989 71.34864       7.887596 71.45457 4.486624 75.38539 4.311579 -3.930824      6.222500 
1 1 1 -15 5  40 o 41.84617 4.005125 22.14691       4.034423 24.36386       5.646674 19.83506       5.766279 43.25134 5.480282 38.54003 6.361456 4.711315       8.396524 
1 1 1 -15 5  41 o 61.79383 3.738799 48.17442       5.603724 42.88718       8.437516 52.34704       7.495570 56.62305 6.216975 63.68275 4.866868 -7.059700      7.895390 
1 1 1 -15 5  42 o 20.05499 6.553406 5.502019       3.684862 10.84117       5.226461 0.2248496      5.196035 27.14420 7.601018 15.92535 6.984960 11.21885       10.32304 
1 1 1 -15 5  43 o 35.07887 5.004537 16.54401       4.156899 17.46068       5.855226 15.61247       5.902546 34.42669 7.210700 32.14255 7.647266 2.284138       10.51070 
1 1 1 -15 5  44 o 27.92922 6.079136 11.23537       4.019771 12.79140       5.636722 9.625082       5.734161 28.40191 7.871749 24.49031 8.182213 3.911606       11.35399 
1 1 1 -15 5  45 o 16.18215 7.056992 1.624176       5.237415 3.787990       7.909823 -0.6516229E-01 6.989000 19.42919 8.566425 16.70783 7.645168 2.721359       11.48182 
1 1 1 -15 5  46 o 11.25045 5.293175 -2.467771      3.726441 -8.372902      5.269037 3.441602       5.270929 11.03967 5.445889 17.23395 7.287773 -6.194281      9.097766 
1 1 1 -15 5  47 o 23.40768 6.871601 9.165483       4.175763 8.672992       6.044229 9.615195       5.775756 21.44186 8.234813 22.52661 8.166694 -1.084751      11.59772 
1 1 1 -15 5  48 o 13.19328 6.038761 -0.1946956     4.364765 4.102648       5.790374 -5.849733      6.642390 17.16645 7.453954 13.02509 6.361139 4.141357       9.799261 
1 1 1 -15 6  1  o 130.8760 2.565245 208.8022       8.181349 209.2768       12.95205 208.4872       10.55328 130.9142 4.064830 130.7142 3.315732 0.2000122      5.245658 
1 1 1 -15 6  2  o 216.9756 3.648844 574.1672       19.29312 558.2513       36.89977 580.1551       22.63325 213.5498 7.100563 218.0668 4.259134 -4.517029      8.279988 
1 1 1 -15 6  3  o 235.9949 4.463494 679.5353       25.66928 661.2300       42.86453 689.7703       32.05199 232.3702 7.579891 237.6773 5.533899 -5.307053      9.385030 
1 1 1 -15 6  4  o 159.4156 3.426316 309.8968       13.31050 312.1120       22.70976 308.7376       16.42807 159.7558 5.843219 159.0267 4.242958 0.7290955      7.221211 
1 1 1 -15 6  5  o 313.8759 4.845533 1202.313       37.06258 1251.362       54.05044 1158.783       50.91845 319.9464 6.932437 307.9048 6.786138 12.04163       9.701050 
1 1 1 -15 6  6  o 411.9499 5.498801 2072.024       55.20119 1975.368       84.80612 2143.082       72.71403 401.6106 8.665347 418.6594 7.127239 -17.04880      11.21988 
1 1 1 -15 6  7  o 145.3463 3.375881 257.6072       11.95714 262.6031       22.60290 255.6659       14.09016 146.4657 6.347817 144.7195 3.999166 1.746262       7.502541 
1 1 1 -15 6  8  o 263.2818 4.197475 845.6526       26.93055 867.3435       39.06389 826.0064       37.17721 266.4613 6.015965 260.0504 5.866555 6.410828       8.402874 
1 1 1 -15 6  9  o 384.7237 5.767273 1807.841       54.06990 1830.609       77.51503 1786.264       75.45918 386.6532 8.226748 381.9685 8.106780 4.684692       11.54986 
1 1 1 -15 6  10 o 155.9284 2.996395 296.4505       11.38571 286.1201       16.35411 306.1672       15.86088 153.0652 4.388975 158.3623 4.113459 -5.297119      6.015284 
1 1 1 -15 6  11 o 94.76945 2.582651 109.5704       5.958886 109.7290       9.041608 109.4487       7.923021 94.75961 3.923982 94.67028 3.440042 0.8933258E-01  5.218383 
1 1 1 -15 6  12 o 477.9887 8.119826 2799.000       94.58025 2928.319       169.2041 2740.233       114.0639 485.9431 14.30416 472.3176 9.910094 13.62549       17.40169 
1 1 1 -15 6  13 o 99.20934 3.064473 120.1372       7.399859 120.0480       9.425582 120.2804       11.94699 99.11764 3.909976 99.12716 4.961493 -0.9521484E-02 6.316987 
1 1 1 -15 6  14 o 251.2319 4.699385 770.5955       28.77080 788.9717       36.05943 738.4042       47.72644 254.0735 5.824028 245.3359 7.993592 8.737625       9.890238 
1 1 1 -15 6  15 o 189.4787 3.338817 437.9130       15.41662 437.6516       22.28832 438.1528       21.34691 189.2505 4.836825 189.4383 4.624143 -0.1878052     6.691605 
1 1 1 -15 6  16 o 299.6138 5.402386 1096.955       39.44423 1107.339       48.90872 1077.635       66.71303 300.7998 6.672254 295.9933 9.260350 4.806580       11.41372 
1 1 1 -15 6  17 o 156.8868 3.516051 300.2894       13.44243 305.8078       16.99767 291.0753       21.96389 158.2019 4.413329 154.1747 5.856667 4.027222       7.333350 
1 1 1 -15 6  18 o 82.72291 2.628164 83.52664       5.291306 91.02827       8.360694 78.51438       6.834097 86.26691 3.987848 80.14265 3.507798 6.124252       5.311080 
1 1 1 -15 6  19 o 37.86912 3.478248 17.64515       3.174005 9.036180       4.933241 23.72606       4.146113 26.73485 7.346547 43.91465 3.915339 -17.17981      8.324759 
1 1 1 -15 6  20 o 190.5313 3.863654 443.1584       17.93910 431.1543       31.23294 449.0681       21.91437 187.4316 6.849597 191.7117 4.690772 -4.280121      8.301826 
1 1 1 -15 6  21 o 294.6186 4.628075 1060.667       33.22742 1089.977       48.22125 1034.169       45.84974 298.2086 6.635630 290.5147 6.476386 7.693909       9.272279 
1 1 1 -15 6  22 o 98.38275 2.684790 118.1461       6.430714 115.8757       9.536040 120.0398       8.708941 97.32267 4.029567 99.09756 3.612381 -1.774895      5.411720 
1 1 1 -15 6  23 o 116.1491 3.217485 164.7646       9.098082 177.4133       17.72492 160.2400       10.60119 120.1744 6.072196 114.4876 3.805079 5.686783       7.165905 
1 1 1 -15 6  24 o 177.8150 3.293262 385.9442       14.27023 384.0687       20.59052 387.6778       19.79526 177.1435 4.774217 178.0083 4.567133 -0.8647614     6.606955 
1 1 1 -15 6  25 o 145.9075 3.508095 259.9662       12.47340 256.8217       15.50987 265.7242       20.98744 144.8652 4.398568 147.1096 5.866162 -2.244370      7.332070 
1 1 1 -15 6  26 f 123.1432 2.877777 185.0619       8.635825 189.8167       12.79024 181.0782       11.70729 124.5308 4.220792 121.6613 3.954076 2.869446       5.783580 
1 1 1 -15 6  27 o 215.9228 3.745057 569.7313       19.70575 593.2103       28.84260 549.1774       26.98621 219.9864 5.380251 211.6991 5.231024 8.287277       7.504046 
1 1 1 -15 6  28 o 212.1195 3.701107 549.9465       19.13147 547.8779       27.43298 551.9052       26.69412 211.3012 5.331900 212.1851 5.162555 -0.8838501     7.421666 
1 1 1 -15 6  29 o 62.31480 3.170017 47.55579       4.797995 47.48573       7.114850 47.61423       6.497830 62.07429 4.739297 62.21902 4.312256 -0.1447334     6.407534 
1 1 1 -15 6  30 o 69.56720 3.103975 59.24324       5.248845 65.95133       7.768338 53.60820       7.119947 73.24768 4.371986 66.00023 4.452919 7.247452       6.240413 
1 1 1 -15 6  31 o 31.92532 6.244346 12.99249       4.683907 13.80229       6.418792 12.07014       6.850335 32.68658 8.099895 30.70695 8.738169 1.979631       11.91486 
1 1 1 -15 6  32 o 114.6117 2.996149 160.6904       8.360957 156.5345       12.08979 164.5002       11.57534 112.8587 4.404354 115.7622 4.109797 -2.903557      6.024016 
1 1 1 -15 6  33 o 123.4266 3.005659 186.3445       9.040335 183.4195       13.04865 189.0445       12.53664 122.1078 4.392322 124.0304 4.153653 -1.922607      6.045272 
1 1 1 -15 6  34 o 55.61388 3.352329 38.04145       4.522148 41.14712       6.621302 35.32638       6.190935 57.58285 4.761124 53.31398 4.817091 4.268871       6.772937 
1 1 1 -15 6  35 o 53.77048 4.097995 35.80828       5.329270 35.40222       10.73311 35.94115       6.139557 52.01891 8.779131 53.72560 4.737923 -1.706684      9.976024 
1 1 1 -15 6  36 o 18.44083 6.769568 3.530372       3.986696 5.799922       4.929995 -0.7582033     6.776931 22.10201 7.585329 18.36948 8.018863 3.732529       11.03809 
1 1 1 -15 6  37 o 26.35488 5.496855 9.016179       3.415861 6.730898       4.983188 11.04176       4.691509 23.16671 7.623817 28.91341 6.777246 -5.746698      10.20067 
1 1 1 -15 6  38 o 56.66080 3.373450 39.79544       4.636846 31.07297       6.572655 48.43789       6.542431 49.29798 5.568460 62.19653 4.343856 -12.89855      7.062353 
1 1 1 -15 6  39 o 23.41703 5.989348 7.307433       3.431047 3.101001       4.704887 12.08542       5.014351 18.43224 7.213634 29.84895 7.013346 -11.41671      10.06099 
1 1 1 -15 6  40 o 9.500015 4.571745 -4.384139      3.117879 -4.829908      4.267087 -3.873538      4.566853 11.58869 5.514438 12.63769 5.918426 -1.048996      8.089301 
1 1 1 -15 6  41 o 18.61305 6.994621 3.980695       4.303051 -0.1381133     5.752353 9.213881       6.483997 16.59135 7.310655 25.39355 8.699568 -8.802208      11.36346 
1 1 1 -15 6  42 o 30.67892 5.634508 12.84107       4.057241 14.80768       5.892107 11.06777       5.595023 31.62947 7.714461 27.17278 7.947849 4.456696       11.07616 
1 1 1 -15 6  43 o 17.46138 6.464226 3.841281       3.648135 3.483088       5.309868 4.161529       5.020749 18.34693 7.496502 18.77087 7.419586 -0.4239388     10.54741 
1 1 1 -15 6  44 o 41.83422 4.470496 23.30466       4.486908 18.18917       6.291471 28.59956       6.400836 34.14370 7.740628 44.95865 5.991355 -10.81495      9.788445 
1 1 1 -15 6  45 o 17.44701 6.976462 3.825687       4.488708 -2.815376      7.162981 8.119919       5.759937 15.52117 7.313656 22.15954 8.136600 -6.638370      10.94047 
1 1 1 -15 6  46 o 37.73426 5.015409 20.10571       4.497787 25.63818       6.763875 15.72001       6.022195 40.00086 7.203794 29.98624 8.066258 10.01462       10.81477 
1 1 1 -15 6  47 o 17.98902 7.133041 5.054623       4.654053 11.71841       5.909634 -5.827757      7.551998 24.63698 8.307245 14.06278 6.849076 10.57420       10.76662 
1 1 1 -15 6  48 o 20.81721 6.761559 7.467116       3.925708 9.339077       5.916313 5.994589       5.247282 21.53988 8.177655 18.56973 7.501905 2.970144       11.09742 
1 1 1 -15 7  1  o 163.6387 3.504836 326.5832       13.97622 347.6932       24.08573 315.8668       17.16086 168.5976 5.871318 160.8287 4.382727 7.768906       7.326709 
1 1 1 -15 7  2  o 199.6287 3.513509 486.0245       17.09229 487.6186       24.69887 484.5596       23.67774 199.7901 5.077138 199.2413 4.876684 0.5487671      7.039843 
1 1 1 -15 7  3  o 337.5798 5.165195 1391.292       42.49123 1382.713       60.17966 1399.822       60.00409 336.1979 7.345454 338.2836 7.278867 -2.085724      10.34106 
1 1 1 -15 7  4  o 254.3473 3.693380 789.0318       22.89218 842.8573       37.78637 757.8206       28.77374 262.6756 5.903089 249.1856 4.738461 13.49004       7.569641 
1 1 1 -15 7  5  o 262.2417 3.767980 838.8025       24.07945 846.6193       38.51696 833.7874       30.85159 263.2511 6.004069 261.3683 4.843826 1.882813       7.714370 
1 1 1 -15 7  6  o 40.38618 2.901226 19.98803       2.836266 22.73076       5.145035 18.79067       3.399447 42.86126 5.020981 39.08616 3.609785 3.775097       6.183914 
1 1 1 -15 7  7  o 178.3057 3.742488 387.7820       16.26154 440.9602       32.00743 369.2799       18.87970 189.7744 6.932784 173.9053 4.458661 15.86913       8.242764 
1 1 1 -15 7  8  f 191.8571 3.910094 449.0182       18.28105 463.1962       33.95342 443.2302       21.69395 194.4658 7.177114 190.5695 4.671423 3.896317       8.563478 
1 1 1 -15 7  9  o 102.8711 2.920333 129.1308       7.313450 129.9134       13.16619 128.7816       8.795117 103.0138 5.262231 102.6977 3.519548 0.3160477      6.330742 
1 1 1 -15 7  10 o 286.1290 4.498621 999.1598       31.36732 982.2891       44.47908 1015.851       44.24204 283.4621 6.439093 288.2847 6.297634 -4.822662      9.006782 
1 1 1 -15 7  11 o 292.2679 5.245573 1043.189       37.36028 1135.402       68.74595 1004.539       44.50625 304.0313 9.289719 286.6468 6.371443 17.38452       11.26473 
1 1 1 -15 7  12 o 297.5495 5.372606 1081.459       38.95654 1084.466       48.20139 1075.796       66.15102 297.7664 6.642747 295.9211 9.184399 1.845398       11.33487 
1 1 1 -15 7  13 o 60.63974 3.257010 44.97635       4.795302 45.66233       6.425357 44.11390       7.204486 61.01128 4.350205 59.89818 4.980779 1.113098       6.613051 
1 1 1 -15 7  14 o 252.1512 4.071435 775.9026       25.01755 789.7050       36.27041 763.3769       34.55239 254.1720 5.855832 249.9239 5.673280 4.248108       8.153335 
1 1 1 -15 7  15 o 253.1716 4.738288 782.6965       29.23295 789.7473       36.36073 769.8093       49.15829 254.1597 5.870698 250.4289 8.065717 3.730804       9.976016 
1 1 1 -15 7  16 o 142.5302 3.373171 247.8147       11.71605 264.3896       15.19068 223.4791       18.40660 147.1088 4.241858 135.0974 5.603175 12.01141       7.027725 
1 1 1 -15 7  17 o 177.9050 3.776294 386.2341       16.37156 381.4664       20.28602 395.1396       27.72484 176.6651 4.716268 179.5823 6.345304 -2.917175      7.906078 
1 1 1 -15 7  18 o 261.3112 4.199395 833.6760       26.74120 835.2769       38.41206 832.1704       37.25023 261.2824 6.032834 260.8265 5.860587 0.4559021      8.410800 
1 1 1 -15 7  19 o 140.5445 3.290752 240.9960       11.27055 265.5347       21.11998 231.2257       13.32674 147.1939 5.899952 137.5668 3.979524 9.627121       7.116603 
1 1 1 -15 7  20 o 52.95085 3.247569 34.33775       4.170357 36.32370       7.985666 33.59303       4.890168 54.12159 6.164629 52.31503 3.863098 1.806553       7.275038 
1 1 1 -15 7  21 o 117.8856 2.774366 169.5081       7.970041 177.1488       12.05631 163.5772       10.62210 120.3663 4.116355 115.6915 3.772717 4.674873       5.583706 
1 1 1 -15 7  22 o 162.1274 3.617409 320.8969       14.29191 307.5551       25.86149 326.7630       17.14840 158.2039 6.723442 163.4797 4.308264 -5.275879      7.985349 
1 1 1 -15 7  23 f 65.10524 3.282709 51.86555       5.191355 53.33909       10.93193 51.43649       5.898929 65.55370 6.948971 64.79253 3.752095 0.7611771      7.897241 
1 1 1 -15 7  24 f 119.9110 2.830462 175.4354       8.270895 192.2066       12.66865 162.9768       10.91902 125.3450 4.153243 115.4402 3.886962 9.904869       5.688401 
1 1 1 -15 7  25 o 177.9825 3.858624 387.0317       16.73578 389.3644       20.87123 382.8306       28.00904 178.3200 4.807375 176.4496 6.525146 1.870468       8.104837 
1 1 1 -15 7  26 o 87.88375 2.818588 94.35065       6.028570 101.8855       9.204649 88.69061       7.977742 91.19560 4.152776 85.10616 3.856674 6.089439       5.667406 
1 1 1 -15 7  27 o 39.42983 3.958794 19.19620       3.752444 20.50447       6.044228 18.37572       4.786619 40.37293 6.353168 38.37090 5.257144 2.002029       8.246230 
1 1 1 -15 7  28 o 216.6745 3.761617 573.9375       19.86180 570.2751       28.45840 577.4156       27.73328 215.5304 5.422642 216.9906 5.244743 -1.460236      7.544029 
1 1 1 -15 7  29 o 149.2278 3.623027 272.2703       13.17521 272.5254       16.42536 271.8099       22.06330 149.0867 4.526298 148.5104 6.109501 0.5763397      7.603511 
1 1 1 -15 7  30 o 93.60413 3.441379 107.2630       7.836527 102.4629       9.787871 115.8343       13.07940 91.34304 4.410236 96.91805 5.561274 -5.575012      7.097742 
1 1 1 -15 7  31 o 125.1972 3.343668 191.8255       10.19213 196.6673       17.68030 189.4157       12.47324 126.2270 5.763002 124.2654 4.124727 1.961586       7.087000 
1 1 1 -15 7  32 o 61.99240 3.245532 47.14162       4.885906 48.83754       7.355726 45.80259       6.536094 62.84774 4.840118 60.92521 4.432679 1.922527       6.563184 
1 1 1 -15 7  33 f 44.41245 3.927221 24.38631       4.206608 23.49727       6.158714 25.16381       5.759425 43.16709 6.018027 44.84371 5.377501 -1.676617      8.070575 
1 1 1 -15 7  34 o 92.70259 2.939290 105.3110       6.631643 119.5970       10.01479 94.15485       8.849975 98.51575 4.181082 87.39390 4.167523 11.12186       5.903363 
1 1 1 -15 7  35 o 42.50777 6.490836 23.11491       6.510810 24.18873       10.27650 22.39483       8.415259 42.32928 10.10318 41.14127 8.667725 1.188004       13.31179 
1 1 1 -15 7  36 o 67.88475 3.105534 56.71564       5.123806 57.93290       7.476339 55.63755       7.036004 68.23434 4.521752 66.91875 4.337992 1.315582       6.266132 
1 1 1 -15 7  37 o 74.35723 3.024087 68.11561       5.468228 60.18938       7.836762 75.63644       7.633719 69.36016 4.663608 78.03596 4.027888 -8.675804      6.162233 
1 1 1 -15 7  38 o 64.78658 3.141125 51.90889       4.944362 60.28053       7.374001 45.07076       6.664477 69.35430 4.385543 59.84464 4.605274 9.509663       6.359366 
1 1 1 -15 7  39 o 42.57162 3.927768 22.80521       4.028845 15.94808       5.594431 30.19282       5.806796 34.37509 6.918220 48.60109 4.972950 -14.22601      8.520094 
1 1 1 -15 7  40 o 20.97861 6.297171 5.905431       3.475744 6.563407       5.053484 5.314740       4.788130 22.33735 7.679263 20.71661 7.445642 1.620745       10.69620 
1 1 1 -15 7  41 o 50.47106 4.922485 33.16862       5.977433 39.61651       8.510036 26.88966       8.397815 53.87246 6.621404 42.96780 8.320909 10.90466       10.63393 
1 1 1 -15 7  42 o 20.24277 6.492135 5.701160       3.626446 4.035863       5.192400 7.287014       5.067037 19.02378 7.537190 22.51153 7.691068 -3.487747      10.76855 
1 1 1 -15 7  43 o 16.87066 6.452151 3.368790       3.700142 3.391515       5.231410 3.346040       5.234173 18.15341 7.431912 18.11499 7.427034 0.3841972E-01  10.50686 
1 1 1 -15 7  44 o 10.80148 5.125512 -3.363802      3.635600 -3.809744      5.260246 -2.955966      5.030476 13.13385 6.212473 13.24565 6.205859 -0.1118011     8.781089 
1 1 1 -15 7  45 o 17.42921 6.927496 3.920830       4.399626 10.54265       7.945949 0.9931797      5.283440 23.80507 9.357191 15.66658 6.949762 8.138486       11.65574 
1 1 1 -15 7  46 o 21.56119 6.887745 7.610479       4.084899 4.482466       5.798898 10.69152       5.755190 18.15640 7.659221 24.15995 8.197726 -6.003553      11.21902 
1 1 1 -15 7  47 o 12.22336 5.610451 -0.7986094     3.803111 -5.104336      5.711450 2.631281       5.097571 12.48052 6.050148 16.00402 6.970989 -3.523499      9.230330 
1 1 1 -15 7  48 o 29.98082 6.100102 14.23612       4.304909 15.60289       6.529410 13.18516       5.725597 27.40895 8.702717 25.92919 8.138643 1.479757       11.91532 
1 1 1 -15 8  1  o 124.4776 2.558640 188.8970       7.761334 198.3207       12.63645 183.1884       9.835073 127.4266 4.074624 122.5160 3.297189 4.910599       5.241566 
1 1 1 -15 8  2  o 33.81862 3.689926 14.11613       2.991678 19.13557       4.616313 10.48151       3.928232 39.28484 4.930387 28.77851 5.801913 10.50632       7.613863 
1 1 1 -15 8  3  o 186.9092 3.020808 425.9737       13.75909 417.9320       21.81703 431.2843       17.72941 184.9679 4.844367 188.0269 3.869350 -3.059006      6.199981 
1 1 1 -15 8  4  o 222.9464 3.737757 606.2953       20.30709 620.1830       29.51344 593.8091       27.98463 225.3533 5.374275 220.5249 5.207459 4.828445       7.483346 
1 1 1 -15 8  5  o 197.8378 3.114222 477.2596       15.01395 502.7507       24.76026 462.4366       18.88120 202.9305 5.006933 194.6946 3.979602 8.235901       6.395827 
1 1 1 -15 8  6  o 170.9741 2.850823 356.4052       11.87782 390.9943       20.06964 337.7589       14.73560 178.9276 4.606676 166.4083 3.633764 12.51923       5.867342 
1 1 1 -15 8  7  o 244.2894 3.584923 727.8768       21.34128 689.4333       33.18589 754.9867       27.86809 237.5623 5.732443 248.7154 4.597994 -11.15302      7.348636 
1 1 1 -15 8  8  o 340.1528 6.009347 1413.904       49.81239 1402.379       87.48275 1419.433       60.59438 337.5511 10.64855 340.5814 7.300882 -3.030243      12.91102 
1 1 1 -15 8  9  o 311.5910 4.826937 1185.258       36.65158 1184.057       52.35895 1186.412       51.32290 311.1197 6.906011 311.4541 6.762090 -0.3344116     9.665342 
1 1 1 -15 8  10 o 390.7920 6.750810 1868.013       64.28914 1809.301       109.6494 1898.770       79.36118 382.9225 11.76454 393.6140 8.273732 -10.69156      14.38260 
1 1 1 -15 8  11 o 270.0412 4.303593 889.9644       28.32026 873.8915       40.20592 905.7916       39.89766 267.3622 6.170976 272.2211 6.014363 -4.858856      8.617047 
1 1 1 -15 8  12 o 37.12128 3.390702 16.94734       3.033417 10.22935       5.207880 20.39684       3.731807 28.38908 7.439486 40.71099 3.805693 -12.32191      8.356389 
1 1 1 -15 8  13 o 177.0972 3.775999 382.6612       16.29595 401.8586       20.84051 352.4541       26.14216 181.3556 4.719659 169.6397 6.334926 11.71590       7.899776 
1 1 1 -15 8  14 o 104.8226 3.099613 134.1230       7.908997 143.9557       10.39364 120.5981       12.18990 108.5421 3.935984 99.23509 5.057468 9.306976       6.408585 
1 1 1 -15 8  15 o 61.84431 3.244749 46.78007       4.872984 45.99546       6.439353 47.83154       7.454424 61.22860 4.343912 62.38299 4.943964 -1.154392      6.581212 
1 1 1 -15 8  16 o 123.4585 2.773919 185.8679       8.345469 185.6360       12.47785 186.0556       11.22575 123.2485 4.160495 123.4233 3.736652 -0.1748123     5.592164 
1 1 1 -15 8  17 o 54.07816 2.877168 35.76649       3.777960 37.60384       6.235909 34.70105       4.748645 55.29058 4.671886 53.19902 3.685728 2.091557       5.950724 
1 1 1 -15 8  18 o 304.4918 4.748216 1132.730       35.23238 1144.936       50.75637 1121.380       48.94520 305.6929 6.813482 302.5744 6.638071 3.118561       9.512493 
1 1 1 -15 8  19 o 354.2842 5.398223 1535.031       46.60567 1537.977       66.58548 1532.200       65.25538 353.9415 7.719905 353.3243 7.578910 0.6172180      10.81835 
1 1 1 -15 8  20 o 242.4351 4.565326 718.1525       26.97139 702.3951       46.83740 725.9700       32.99033 238.9214 8.056071 243.5864 5.557732 -4.665039      9.787169 
1 1 1 -15 8  21 o 258.3530 4.197020 815.3378       26.42352 795.0346       37.42820 835.5119       37.30909 254.7723 6.028519 261.2147 5.861123 -6.442413      8.408079 
1 1 1 -15 8  22 o 183.6063 3.864735 411.6971       17.29193 422.6061       32.14788 407.2560       20.51197 185.3796 7.129591 182.4663 4.616761 2.913239       8.493854 
1 1 1 -15 8  23 o 33.00397 4.217276 13.52550       3.314443 12.08765       5.229263 14.49101       4.285128 30.76190 7.117146 34.00150 5.348065 -3.239599      8.902559 
1 1 1 -15 8  24 o 145.4330 3.022010 258.1260       10.71014 274.0162       16.12232 245.5748       14.32867 149.6400 4.426101 141.6915 4.154277 7.948547       6.070287 
1 1 1 -15 8  25 o 26.91120 6.388535 9.247005       4.126565 11.15373       5.504784 6.800983       6.234853 29.54126 7.602510 24.65694 8.527499 4.884319       11.42438 
1 1 1 -15 8  26 f 41.71947 3.783867 21.44198       3.805103 20.40313       5.889350 22.18640       4.985372 40.30912 6.193365 42.28571 4.930419 -1.976585      7.916236 
1 1 1 -15 8  27 f 235.3650 3.968343 677.3275       22.76078 646.4681       31.89100 709.3663       32.49469 229.5176 5.701855 240.4704 5.545168 -10.95284      7.953618 
1 1 1 -15 8  28 o 56.38249 3.362918 38.97787       4.599587 40.98428       6.960315 37.42242       6.128409 57.60796 5.007750 55.08786 4.607317 2.520107       6.804772 
1 1 1 -15 8  29 o 135.5124 3.039063 224.3088       10.03586 220.2091       14.66276 227.9221       13.76541 133.9960 4.496801 136.3913 4.146399 -2.395294      6.116686 
1 1 1 -15 8  30 o 90.37897 4.451946 100.3543       9.774957 100.3543       9.774957 0.000000       0.000000 90.37897 4.451946 ?        ?        0.000000       4.451946 
1 1 1 -15 8  31 o 104.2957 3.254119 133.1531       8.260456 137.9576       14.41758 130.8053       10.07870 105.6844 5.618352 103.2466 4.013480 2.437805       6.904629 
1 1 1 -15 8  32 o 35.89209 4.608042 16.08305       3.937557 17.18876       5.940875 15.21678       5.258458 36.63966 6.906950 34.50994 6.491035 2.129723       9.478370 
1 1 1 -15 8  33 o 30.76199 5.176265 11.98472       3.742678 10.15130       5.589203 13.47511       5.039299 28.04327 7.863102 32.35621 6.614589 -4.312944      10.27527 
1 1 1 -15 8  34 o 118.4691 2.984473 172.0028       8.609204 184.7355       12.89962 161.7762       11.56064 122.3908 4.331888 114.5815 4.147139 7.809380       5.997000 
1 1 1 -15 8  35 f 63.38564 4.861389 50.06340       7.451781 49.57225       12.19915 50.35575       9.411774 61.79748 8.311224 63.14142 6.196470 -1.343941      10.36690 
1 1 1 -15 8  36 o 65.65015 3.160429 53.09520       5.041275 54.85440       7.373288 51.55089       6.908286 66.33487 4.589538 64.34635 4.432738 1.988518       6.380676 
1 1 1 -15 8  37 o 19.63520 6.193801 4.869826       3.312166 8.054976       4.853889 2.094361       4.530986 24.75565 7.444024 17.37943 6.988687 7.376226       10.21055 
1 1 1 -15 8  38 o 53.43232 3.470822 35.50028       4.494857 31.79102       6.502512 38.89450       6.220254 49.82135 5.444383 55.51154 4.640632 -5.690197      7.153794 
1 1 1 -15 8  39 o 50.78687 3.588730 32.26130       4.412884 29.78878       6.362636 34.55305       6.125630 47.94316 5.548240 52.00825 4.890687 -4.065094      7.396065 
1 1 1 -15 8  40 o 29.71358 5.418716 11.71856       3.779102 11.29245       5.299258 12.15952       5.390833 28.25881 7.551198 29.34090 7.509058 -1.082088      10.64925 
1 1 1 -15 8  41 o 26.89260 7.306716 10.40899       4.911982 9.907140       6.822089 10.94923       7.078167 25.89707 8.921670 26.96289 9.091534 -1.065817      12.73782 
1 1 1 -15 8  42 o 51.23137 3.807451 33.65292       4.719440 34.44889       6.868508 32.94101       6.495680 50.34586 5.698451 49.40420 5.487897 0.9416542      7.911344 
1 1 1 -15 8  43 o 16.41570 6.491311 2.908309       3.844471 2.643495       5.479937 3.164965       5.394866 17.66718 7.448833 18.02771 7.480214 -0.3605213     10.55645 
1 1 1 -15 8  44 o 34.26598 6.111332 16.95832       4.915918 14.08282       5.912336 23.39885       8.848378 29.40866 8.027057 35.91429 9.826938 -6.505632      12.68867 
1 1 1 -15 8  45 f 15.98924 6.750099 2.420516       4.509484 3.071648       8.211164 2.139317       5.396069 18.85666 8.491961 16.50318 7.180508 2.353479       11.12084 
1 1 1 -15 8  46 o 21.83790 6.625027 7.721538       3.832505 8.740872       5.845161 6.952864       5.075855 21.86783 8.165668 20.23163 7.598084 1.636194       11.15388 
1 1 1 -15 8  47 o 14.22304 6.149545 1.653399       3.907158 -0.6386095     6.001170 3.339791       5.147628 14.64936 6.835578 16.51116 7.097989 -1.861805      9.854267 
1 1 1 -15 9  1  o 159.0478 3.102750 308.4853       12.02571 313.6781       17.55330 303.8922       16.50858 160.2423 4.499618 157.7389 4.298727 2.503372       6.222991 
1 1 1 -15 9  2  o 358.0980 4.888540 1565.714       42.65964 1578.094       67.96442 1557.666       54.79901 358.9427 7.769989 356.9317 6.300159 2.010986       10.00324 
1 1 1 -15 9  3  o 363.8363 4.951353 1616.321       43.90015 1605.264       69.41365 1623.692       56.67407 362.0125 7.868377 364.4129 6.381967 -2.400391      10.13118 
1 1 1 -15 9  4  o 74.85838 2.430156 68.38494       4.427257 78.50276       7.710798 63.40911       5.407397 80.11678 3.961766 72.04446 3.087163 8.072319       5.022566 
1 1 1 -15 9  5  o 179.1758 2.952197 391.4564       12.89024 393.3618       20.88375 390.2837       16.38360 179.4415 4.780094 178.8665 3.758757 0.5749359      6.080917 
1 1 1 -15 9  6  o 143.7458 2.653545 251.9150       9.295177 265.6180       15.58042 244.3425       11.58214 147.4667 4.340322 141.5435 3.357861 5.923172       5.487588 
1 1 1 -15 9  7  o 538.6552 7.889236 3554.039       103.5576 3509.830       145.7881 3599.062       147.1262 533.8652 11.20609 540.6286 11.16747 -6.763428      15.82052 
1 1 1 -15 9  8  o 127.1456 3.258742 197.2836       10.08856 197.7630       20.16816 197.1236       11.65100 126.9996 6.538713 127.0605 3.767006 -0.6085968E-01 7.546198 
1 1 1 -15 9  9  o 498.5134 7.336436 3042.374       89.12469 3145.053       182.1360 3010.048       102.1957 502.9723 14.87623 495.4713 8.464046 7.501038       17.11556 
1 1 1 -15 9  10 o 170.4647 3.187201 354.3831       13.23976 342.2040       19.13192 365.5758       18.34081 167.3547 4.695848 173.0126 4.353613 -5.657913      6.403510 
1 1 1 -15 9  11 o 296.4341 4.642631 1072.826       33.53733 1103.714       48.92209 1045.441       46.06467 300.3501 6.684073 292.3524 6.465843 7.997650       9.299675 
1 1 1 -15 9  12 o 202.9819 3.530316 502.6191       17.46252 465.7649       24.42641 541.1447       24.97418 195.2012 5.139477 210.5045 4.868485 -15.30322      7.079291 
1 1 1 -15 9  13 o 249.5681 5.844022 761.4549       35.54160 761.4549       35.54160 0.000000       0.000000 249.5681 5.844022 ?        ?        0.000000       5.844022 
1 1 1 -15 9  14 o 256.4578 4.812186 803.2745       30.07422 774.4335       36.47615 864.5005       53.14622 251.6551 5.947949 265.3253 8.229682 -13.67023      10.15410 
1 1 1 -15 9  15 o 40.81847 3.271329 20.45423       3.226777 18.20919       5.494828 21.63595       3.986561 38.10924 6.124249 41.91965 3.949043 -3.810410      7.287069 
1 1 1 -15 9  16 o 270.2742 4.319809 891.8969       28.45151 894.6400       40.93497 889.3333       39.57262 270.3909 6.212497 269.6224 6.022859 0.7685242      8.652742 
1 1 1 -15 9  17 o 125.1137 2.795296 190.9045       8.522536 214.8952       13.40979 174.6478       11.03865 132.6041 4.154944 119.5620 3.793473 13.04211       5.626189 
1 1 1 -15 9  18 o 136.1914 2.894218 226.2361       9.605437 237.3387       14.67771 217.9194       12.70345 139.3361 4.327982 133.5502 3.907585 5.785889       5.831008 
1 1 1 -15 9  19 o 136.3141 2.895817 226.6576       9.619403 234.2269       14.52676 220.7466       12.83716 138.4115 4.312120 134.4057 3.923558 4.005753       5.829982 
1 1 1 -15 9  20 o 62.48463 3.121051 47.75545       4.737326 42.11406       9.076529 49.86762       5.553804 58.26332 6.503538 63.81675 3.585668 -5.553429      7.426508 
1 1 1 -15 9  21 o 60.95680 3.337470 45.48486       4.938732 39.54495       10.91695 47.01332       5.537815 56.10992 8.228500 61.94474 3.685236 -5.834816      9.016051 
1 1 1 -15 9  22 o 80.71225 2.811697 79.57146       5.521796 71.66043       8.540425 85.25385       7.238158 76.42290 4.607247 83.48732 3.565931 -7.064415      5.826027 
1 1 1 -15 9  23 o 149.6902 3.064479 273.4555       11.17857 275.7156       16.52803 271.5501       15.17611 150.0989 4.523802 149.0069 4.183579 1.091965       6.161747 
1 1 1 -15 9  24 o 186.9229 3.422080 426.6368       15.58794 437.5228       23.10513 417.5427       21.11800 188.9948 5.021199 184.6872 4.696045 4.307510       6.874975 
1 1 1 -15 9  25 o 58.84970 3.654486 42.46960       5.215050 41.82836       6.922221 43.31128       7.930579 58.24938 4.922651 59.18670 5.563757 -0.9373131     7.428854 
1 1 1 -15 9  26 o 130.9391 2.966523 209.2920       9.465711 216.1516       14.21668 203.8295       12.68667 132.8481 4.397498 129.0542 4.039004 3.793839       5.970891 
1 1 1 -15 9  27 o 111.5379 2.915560 151.9834       7.917861 163.0697       12.07011 143.6090       10.49042 115.3618 4.301048 108.2943 3.981910 7.067497       5.861281 
1 1 1 -15 9  28 o 141.5734 3.060527 244.7984       10.55878 262.7216       16.02132 231.0360       14.03901 146.3942 4.496282 137.3281 4.200025 9.066086       6.152784 
1 1 1 -15 9  29 o 92.55876 3.503914 104.8925       7.889005 101.3295       9.895037 111.1082       13.06939 90.82989 4.484327 94.90081 5.677267 -4.070923      7.234677 
1 1 1 -15 9  30 o 110.1960 3.477358 148.6704       9.326257 148.2133       11.74639 149.4500       15.34025 109.8690 4.396132 110.0325 5.740905 -0.1634598     7.230765 
1 1 1 -15 9  31 o 64.53364 4.436776 51.34459       6.934880 61.47644       10.08245 42.24756       9.553699 70.33861 5.937553 57.99585 6.894661 12.34276       9.098950 
1 1 1 -15 9  32 o 45.43480 3.847487 25.48939       4.219911 23.84580       6.337399 26.79866       5.656232 43.47958 6.152932 46.37305 5.088742 -2.893478      7.984601 
1 1 1 -15 9  33 o 64.08598 3.187371 50.42500       4.962113 52.66565       7.524017 48.70028       6.601172 65.19706 4.768698 62.77240 4.342110 2.424664       6.449372 
1 1 1 -15 9  34 o 59.32182 3.347478 43.31405       4.819506 42.63148       7.398986 43.81710       6.351845 58.42363 5.252963 59.44707 4.416177 -1.023438      6.862669 
1 1 1 -15 9  35 o 71.30212 4.615436 63.21020       7.976488 62.55480       13.39114 63.57061       9.930380 69.54669 8.049879 71.10627 5.780709 -1.559578      9.910457 
1 1 1 -15 9  36 o 44.31570 3.873868 24.44448       4.141470 22.69031       6.089379 25.95420       5.649206 42.02319 6.126488 45.30041 5.212281 -3.277222      8.043739 
1 1 1 -15 9  37 f 74.87106 3.118447 69.19709       5.677232 63.43269       8.251125 74.37957       7.823565 71.05242 4.793441 77.24014 4.171962 -6.187714      6.354711 
1 1 1 -15 9  38 o 76.09772 3.074404 71.64281       5.689495 69.69761       8.363323 73.31859       7.762545 74.34256 4.639547 76.49741 4.179985 -2.154854      6.244812 
1 1 1 -15 9  39 o 22.66506 6.098380 6.911860       3.441710 5.970421       5.073253 7.714571       4.684575 21.77028 7.680975 23.83186 7.342924 -2.061583      10.62619 
1 1 1 -15 9  40 o 16.90427 6.503504 2.920464       3.774469 8.318788       6.129731 -0.3764828     4.790358 24.50009 8.456139 15.16453 6.677085 9.335567       10.77450 
1 1 1 -15 9  41 o 13.45457 5.944086 -0.4210782     3.826520 -3.322601      4.644875 5.707188       6.750404 12.86092 6.005250 21.75799 8.602297 -8.897065      10.49107 
1 1 1 -15 9  42 o 17.65658 6.419018 3.978731       3.571593 -2.579458      5.141764 10.09344       4.964869 13.86906 6.422055 25.92013 7.459363 -12.05107      9.843012 
1 1 1 -15 9  43 o 13.84219 5.961109 0.6855698      3.642920 1.346476       5.167590 0.3264665E-01  5.136286 16.28069 7.055662 15.29800 6.815327 0.9826889      9.809742 
1 1 1 -15 9  44 o 14.51497 6.321023 0.8403350      4.189382 3.732092       5.123030 -4.997022      7.278706 17.90007 7.344320 14.89859 7.120597 3.001479       10.22946 
1 1 1 -15 9  45 o 38.97388 5.726624 22.06203       5.276796 32.06732       10.19557 18.40139       6.167015 40.05028 10.36676 33.33654 7.740303 6.713741       12.93762 
1 1 1 -15 9  46 o 13.00685 5.811908 0.2065412      3.764422 -8.478765      5.771883 6.635707       4.965949 11.51888 5.685578 19.81687 7.499316 -8.297992      9.410927 
1 1 1 -15 9  47 o 15.73464 6.325395 3.377660       3.710552 3.847045       5.611418 3.012950       4.946311 17.03071 7.366588 16.07479 6.934531 0.9559212      10.11703 
1 1 1 -15 10 1  o 154.7017 2.785001 291.8211       10.49921 319.5535       17.61839 276.5492       13.07431 161.7300 4.474630 150.5639 3.563375 11.16602       5.720137 
1 1 1 -15 10 2  o 256.3769 3.754550 801.9244       23.45702 823.5648       38.02131 788.6260       29.80536 259.5473 6.011383 254.1352 4.812752 5.412170       7.700604 
1 1 1 -15 10 3  o 217.8796 3.346685 579.0076       17.76919 578.9119       28.54750 579.0682       22.70343 217.6850 5.381503 217.8204 4.277173 -0.1354218     6.874211 
1 1 1 -15 10 4  o 351.3775 4.810112 1507.519       41.18748 1516.596       65.76329 1501.661       52.83271 351.8671 7.669531 350.4547 6.186357 1.412384       9.853564 
1 1 1 -15 10 5  o 269.5359 3.877514 886.3951       25.46866 884.7937       40.69139 887.4266       32.65612 269.0081 6.207275 269.5754 4.971051 -0.5672607     7.952460 
1 1 1 -15 10 6  o 313.4890 4.873181 1199.998       37.22811 1219.597       53.78889 1181.977       51.57770 315.6815 6.992095 310.8097 6.809752 4.871826       9.760231 
1 1 1 -15 10 7  o 62.52744 2.514017 47.74159       3.822861 60.33801       7.097647 42.59407       4.537223 70.19232 4.168201 59.01349 3.166620 11.17883       5.234633 
1 1 1 -15 10 8  o 262.3686 4.247435 840.1368       27.15656 889.2300       58.03682 826.3747       30.72805 269.0360 8.864422 260.1457 4.847102 8.890320       10.10309 
1 1 1 -15 10 9  f 330.4671 4.557413 1333.228       36.70140 1344.037       58.86310 1326.353       46.94355 331.3042 7.290883 329.4078 5.847981 1.896393       9.346436 
1 1 1 -15 10 10 o 177.9749 3.272095 386.3381       14.19125 386.0061       20.85982 386.6241       19.36263 177.7273 4.820827 177.9064 4.469726 -0.1790314     6.574103 
1 1 1 -15 10 11 o 242.3867 3.991389 716.9656       23.57593 710.1241       33.86322 723.4012       32.84299 241.0243 5.765424 243.2973 5.539484 -2.272964      7.995374 
1 1 1 -15 10 12 o 173.0188 3.760566 365.2643       15.85560 351.6183       19.63595 390.8333       26.87855 169.6182 4.755239 178.6515 6.183271 -9.033310      7.800329 
1 1 1 -15 10 13 o 194.8494 5.028634 464.1135       23.85735 464.1135       23.85735 0.000000       0.000000 194.8494 5.028634 ?        ?        0.000000       5.028634 
1 1 1 -15 10 14 o 172.6941 3.215394 363.7826       13.53156 371.7987       20.08413 357.1190       18.31151 174.4106 4.729825 170.9666 4.398835 3.444031       6.459179 
1 1 1 -15 10 15 o 45.10858 3.175514 24.94311       3.468369 19.50404       5.837100 27.91151       4.312167 39.44113 6.283775 47.67871 3.741323 -8.237583      7.313230 
1 1 1 -15 10 16 o 133.1020 2.875751 216.0717       9.327644 217.1700       14.04760 215.2057       12.47461 133.2879 4.330640 132.7274 3.860932 0.5605011      5.801831 
1 1 1 -15 10 17 o 88.10631 2.703559 94.75955       5.797822 99.26772       9.265145 91.85804       7.433008 90.06187 4.233429 86.68867 3.525928 3.373207       5.509455 
1 1 1 -15 10 18 o 193.1668 3.440302 455.3495       16.19441 462.8272       23.81054 448.9131       22.09075 194.5111 5.027511 191.6646 4.729688 2.846497       6.902595 
1 1 1 -15 10 19 o 83.19241 2.735488 84.50638       5.538137 77.00351       8.561976 89.90365       7.261847 79.26516 4.450444 85.75643 3.482157 -6.491272      5.650829 
1 1 1 -15 10 20 o 191.4331 4.720503 447.9860       22.02122 0.000000       0.000000 447.9860       22.02122 ?        ?        191.4331 4.720503 0.000000       4.720503 
1 1 1 -15 10 21 o 93.79803 3.129864 107.4826       7.144085 115.9041       14.81301 104.9300       8.155212 97.03133 6.298663 92.63480 3.619610 4.396530       7.264622 
1 1 1 -15 10 22 o 143.1056 3.020564 249.9055       10.53370 237.2301       15.39240 261.0706       14.44636 139.2233 4.542974 146.1225 4.060940 -6.899216      6.093426 
1 1 1 -15 10 23 o 90.26473 3.129718 99.56697       6.873879 96.49963       12.70257 100.8371       8.174119 88.52455 5.922394 90.78660 3.702502 -2.262047      6.984502 
1 1 1 -15 10 24 o 63.64528 3.077559 49.55898       4.759042 49.59634       7.462697 49.53337       6.178360 63.47532 4.861525 63.53793 4.010752 -0.6260681E-01 6.302424 
1 1 1 -15 10 25 o 195.3751 4.110701 466.6923       19.57137 468.0251       24.59391 464.3908       32.31816 195.3927 5.169692 194.1902 6.840091 1.202515       8.573946 
1 1 1 -15 10 26 o 34.84858 4.435982 15.09765       3.681867 21.97446       6.064762 11.08379       4.633425 41.86462 6.125997 29.44683 6.618484 12.41779       9.018435 
1 1 1 -15 10 27 o 190.7314 3.498844 444.5624       16.26234 451.5247       23.86367 438.5256       22.22093 191.8326 5.109348 189.1203 4.825506 2.712280       7.027870 
1 1 1 -15 10 28 o 19.61609 6.393670 4.572173       3.508515 2.411741       5.845517 5.788721       4.386491 19.84851 7.952990 22.00260 7.147432 -2.154089      10.69279 
1 1 1 -15 10 29 o 132.2243 3.577123 213.9774       11.51548 221.8941       14.64982 201.1766       18.62853 134.4815 4.476507 127.6856 6.003692 6.795898       7.488887 
1 1 1 -15 10 30 o 38.95148 4.320550 18.82675       4.032193 24.28041       6.549125 15.49739       5.117041 43.91905 6.299284 34.92756 6.241000 8.991493       8.867416 
1 1 1 -15 10 31 o 127.0893 3.395788 197.8228       10.50743 204.9053       18.54253 194.4728       12.75255 128.6708 5.929553 125.8439 4.164159 2.826942       7.245676 
1 1 1 -15 10 32 o 62.71294 3.306360 48.29264       5.035080 49.24743       7.662704 47.56715       6.679483 63.01644 5.031668 62.04531 4.447212 0.9711342      6.715309 
1 1 1 -15 10 33 o 50.06533 4.326763 31.07853       5.227057 30.39629       6.920475 31.98467       7.975669 49.14663 5.895940 50.21275 6.683892 -1.066120      8.912717 
1 1 1 -15 10 34 o 46.06444 4.445642 26.43466       4.928484 35.85963       11.47050 24.30075       5.457973 52.04518 9.389504 43.96922 5.193999 8.075962       10.73035 
1 1 1 -15 10 35 o 60.02466 3.839009 44.60833       5.586019 53.75701       7.454114 32.88955       8.436414 65.67107 4.688700 50.50677 7.045964 15.16431       8.463422 
1 1 1 -15 10 36 o 43.42453 3.842896 23.49607       4.024651 21.28607       6.107563 25.19226       5.350674 40.52806 6.395983 44.64539 5.004093 -4.117336      8.120933 
1 1 1 -15 10 37 o 47.03399 3.754316 27.59787       4.267379 23.71689       6.358269 30.77897       5.756478 42.67511 6.303514 49.31618 4.852746 -6.641075      7.955088 
1 1 1 -15 10 38 o 23.32529 6.154862 7.271067       3.548707 10.78124       5.364519 4.539805       4.732036 28.00301 7.647264 20.02000 7.370875 7.983002       10.62123 
1 1 1 -15 10 39 o 15.07622 6.139530 1.510651       3.547111 -1.963117      5.117980 4.721632       4.920587 14.67542 6.647538 20.16694 7.499593 -5.491516      10.02166 
1 1 1 -15 10 40 o 14.40832 6.126830 0.6615351      3.760456 3.975168       6.133271 -1.334469      4.760151 20.14253 8.120053 14.38484 6.472976 5.757694       10.38435 
1 1 1 -15 10 41 o 14.67293 6.123879 1.268014       3.646337 0.8209504E-01  5.189810 2.424145       5.124215 15.77354 6.947392 17.54815 7.286471 -1.774606      10.06772 
1 1 1 -15 10 42 o 11.13122 5.197042 -2.527220      3.477280 -3.473219      5.011587 -1.648990      4.828741 13.15403 6.172903 13.92571 6.365544 -0.7716846     8.867067 
1 1 1 -15 10 43 o 14.84584 6.181957 1.686458       3.703489 0.4726313      5.189555 2.946224       5.286848 15.59429 6.904253 17.58994 7.359960 -1.995647      10.09147 
1 1 1 -15 10 44 o 35.83072 5.966653 18.60891       5.026690 22.34049       6.317914 12.17215       8.297753 38.17075 7.051850 25.27789 9.663497 12.89285       11.96293 
1 1 1 -15 10 45 o 12.67208 5.718429 -0.3841332     3.745297 3.707960       5.831339 -3.257440      4.886373 17.74321 7.589692 12.52933 5.944458 5.213882       9.640540 
1 1 1 -15 10 46 o 13.80645 6.025534 1.142781       3.824527 -0.5426384     5.964328 2.319731       4.984098 14.82226 6.881816 15.79599 6.886475 -0.9737358     9.735653 
1 1 1 -15 10 47 o 19.20004 6.868619 6.287816       4.069604 5.856795       6.086051 6.636399       5.473189 18.57895 7.842497 19.23785 7.699879 -0.6589012     10.99058 
1 1 1 -15 11 1  o 169.2198 3.351451 349.3023       13.82039 379.0945       20.27968 323.4677       18.88475 176.1266 4.729261 162.6779 4.768870 13.44867       6.716252 
1 1 1 -15 11 2  o 376.5220 5.126852 1731.876       47.04108 1791.857       76.45056 1695.330       59.67541 382.2112 8.208073 372.2155 6.579075 9.995667       10.51935 
1 1 1 -15 11 3  o 329.9327 4.577153 1329.058       36.80077 1340.275       58.95149 1321.896       47.10677 330.7984 7.312994 328.8247 5.878721 1.973755       9.382923 
1 1 1 -15 11 4  o 415.1653 5.574107 2106.444       56.39394 2069.198       88.49303 2131.913       73.17799 410.5469 8.845252 417.2514 7.196918 -6.704498      11.40325 
1 1 1 -15 11 5  o 228.4314 3.454335 636.5252       19.22898 634.3952       30.87797 637.8746       24.57605 227.8411 5.561355 228.5907 4.411816 -0.7496185     7.098787 
1 1 1 -15 11 6  o 230.9938 3.842371 651.0634       21.62897 623.9769       42.28915 660.6588       25.17014 225.5257 7.706112 232.6345 4.439923 -7.108856      8.893654 
1 1 1 -15 11 7  o 261.3707 3.798005 833.5385       24.19071 826.1642       38.66756 838.2807       31.00824 259.9253 6.104669 261.9972 4.856734 -2.071899      7.800951 
1 1 1 -15 11 8  o 194.3915 3.484535 460.9725       16.50662 402.3559       32.93358 480.6378       19.07561 181.0742 7.479666 198.4616 3.944263 -17.38737      8.455922 
1 1 1 -15 11 9  o 168.3670 2.874453 345.6798       11.79365 367.1443       19.95624 334.1600       14.61981 173.3309 4.729037 165.4979 3.625043 7.832947       5.958585 
1 1 1 -15 11 10 o 112.0024 2.796028 152.9684       7.631412 154.1472       11.52553 152.0481       10.18353 112.2981 4.219154 111.5672 3.750968 0.7308807      5.645443 
1 1 1 -15 11 11 o 192.0984 4.001589 450.3677       18.73235 448.2281       23.57823 454.0295       30.84556 191.4814 5.057418 192.4969 6.585257 -1.015472      8.303197 
1 1 1 -15 11 12 o 163.6407 3.153537 326.6214       12.57550 340.1716       18.91845 315.8944       16.83262 166.8326 4.657937 160.8015 4.299474 6.031097       6.338916 
1 1 1 -15 11 13 o 91.30014 3.278502 101.8156       7.282448 102.2195       9.576497 101.2617       11.21418 91.39986 4.311725 90.89465 5.083076 0.5052109      6.665481 
1 1 1 -15 11 14 o 270.0168 4.340690 890.2490       28.56180 864.9557       40.46160 915.3701       40.32371 265.8511 6.245518 273.5261 6.049585 -7.674957      8.695055 
1 1 1 -15 11 15 o 211.4562 3.654487 545.6762       18.83141 522.4989       26.82800 568.1871       26.43952 206.6642 5.331504 215.6209 5.031839 -8.956680      7.331053 
1 1 1 -15 11 16 o 172.2845 3.242855 362.1339       13.61475 368.9307       20.27198 356.5493       18.37572 173.6931 4.793945 170.7982 4.418654 2.894913       6.519694 
1 1 1 -15 11 17 o 119.8588 2.832046 175.2272       8.271918 183.6772       12.82207 169.2032       10.82610 122.5560 4.299923 117.6719 3.780308 4.884125       5.725388 
1 1 1 -15 11 18 o 248.8553 4.093337 756.3041       24.82335 750.6491       35.77465 761.5550       34.47258 247.6117 5.928818 249.4549 5.670817 -1.843185      8.204209 
1 1 1 -15 11 19 o 182.7066 3.851433 407.6201       17.14797 409.9917       31.59786 406.6301       20.41594 182.6262 7.113607 182.3433 4.598223 0.2828674      8.470364 
1 1 1 -15 11 20 o 131.8546 3.912186 212.5185       12.55655 0.000000       0.000000 212.5185       12.55655 ?        ?        131.8546 3.912186 0.000000       3.912186 
1 1 1 -15 11 21 o 230.9258 3.900283 651.3701       21.94849 669.4214       32.38626 636.0370       29.84851 233.7785 5.684867 227.9383 5.373650 5.840195       7.822648 
1 1 1 -15 11 22 o 235.0756 3.959116 675.1554       22.67994 655.4265       32.39847 694.1140       31.75961 231.2672 5.748762 238.0582 5.474646 -6.790939      7.938514 
1 1 1 -15 11 23 o 207.0267 3.648277 523.5117       18.40561 522.0958       26.83225 524.7699       25.29467 206.3895 5.339471 207.0497 5.013238 -0.6601410     7.324105 
1 1 1 -15 11 24 o 131.4794 4.104871 211.5308       13.13593 199.2233       19.01448 222.7674       18.16842 127.2529 6.149905 134.6961 5.546974 -7.443245      8.281922 
1 1 1 -15 11 25 o 90.69580 2.879739 100.5035       6.356611 104.9476       9.863597 97.34677       8.313151 92.51549 4.387570 89.16248 3.834988 3.353004       5.827342 
1 1 1 -15 11 26 o 68.45666 3.067537 57.33867       5.104310 55.95751       8.063207 58.26227       6.593682 67.39979 4.943618 68.91432 3.942744 -1.514534      6.323337 
1 1 1 -15 11 27 o 121.5442 2.976902 180.4093       8.817280 188.9184       13.48106 174.0480       11.65611 124.1232 4.464191 119.2044 4.018336 4.918762       6.006332 
1 1 1 -15 11 28 o 198.9692 4.228562 484.7676       20.50287 493.2668       25.76655 470.0977       33.85160 200.3603 5.281866 194.9199 7.138733 5.440399       8.880294 
1 1 1 -15 11 29 o 56.62086 4.141817 39.47887       5.675298 40.84311       7.291201 37.38172       9.040008 57.41248 5.270173 54.55686 6.957700 2.855614       8.728362 
1 1 1 -15 11 30 o 21.08218 6.504384 5.493782       3.674266 5.986631       5.982154 5.195227       4.655998 23.43888 8.333886 21.39258 7.370423 2.046301       11.12550 
1 1 1 -15 11 31 o 69.75799 3.196554 59.66857       5.419464 65.87131       8.383423 55.21555       7.103242 73.03552 4.735863 66.90942 4.380546 6.126106       6.451169 
1 1 1 -15 11 32 o 103.6772 2.998908 131.6654       7.568783 143.9232       11.64443 122.6980       9.959694 108.0678 4.431063 99.84995 4.101925 8.217896       6.038221 
1 1 1 -15 11 33 o 47.86698 3.761520 28.32456       4.352458 24.07435       6.630716 31.54229       5.769386 43.47278 6.454691 50.32132 4.761434 -6.848534      8.020865 
1 1 1 -15 11 34 o 35.64030 6.732257 16.46933       5.632833 18.08688       9.652474 15.63402       6.936410 36.54413 10.36360 34.29536 8.373637 2.248772       13.32374 
1 1 1 -15 11 35 o 83.86883 3.047226 86.53033       6.217544 91.66680       9.282284 82.35029       8.373625 85.86739 4.451184 81.45385 4.233099 4.413544       6.142652 
1 1 1 -15 11 36 o 51.36007 3.631310 32.76765       4.515604 29.03533       6.772647 35.75470       6.058862 47.55263 5.976171 53.32339 4.711108 -5.770763      7.609807 
1 1 1 -15 11 37 o 62.68549 3.313610 48.72795       5.043815 51.15781       7.677314 46.88276       6.690198 63.54163 4.998309 61.02356 4.531224 2.518066       6.746487 
1 1 1 -15 11 38 o 42.54385 4.069793 22.85698       4.167972 25.50093       6.416202 20.92677       5.482188 44.02610 6.147829 39.98437 5.795081 4.041737       8.448596 
1 1 1 -15 11 39 o 14.88733 6.099455 1.404843       3.527089 7.871953       5.442950 -3.276656      4.630967 23.95853 7.970968 13.04152 6.058101 10.91701       10.01184 
1 1 1 -15 11 40 o 10.57140 5.183239 -8.037969      4.542318 -8.595767      6.277574 -7.424990      6.580762 13.07410 6.339080 13.92429 6.685595 -0.8501863     9.213095 
1 1 1 -15 11 41 o 29.48845 6.690211 12.46886       4.696854 15.91575       5.838543 6.147025       7.907007 32.85110 7.463540 22.35984 9.143438 10.49126       11.80283 
1 1 1 -15 11 42 o 20.17741 6.678520 5.817493       3.822207 5.255633       5.470320 6.353457       5.342771 20.04112 7.796959 21.11744 7.821896 -1.076319      11.04421 
1 1 1 -15 11 43 o 32.73336 5.550607 15.04566       4.269568 16.70012       5.980309 13.32570       6.097562 32.64219 7.652021 28.41106 8.293490 4.231129       11.28430 
1 1 1 -15 11 44 o 12.03771 5.615719 -2.191445      4.046803 -0.7087616     6.744487 -3.025526      5.058583 16.03256 7.399536 13.02760 6.140962 3.004962       9.615849 
1 1 1 -15 11 45 o 19.17219 6.595145 5.779922       3.727529 2.417687       5.482460 8.670274       5.083196 16.45077 7.196196 22.30721 7.700461 -5.856440      10.53956 
1 1 1 -15 11 46 o 35.91651 5.275559 18.85176       4.479899 13.82512       6.578543 23.19867       6.117607 26.14989 8.764412 37.82833 6.890104 -11.67843      11.14847 
1 1 1 -15 12 1  o 61.45161 3.287407 46.19653       4.905005 43.38117       6.774946 49.29784       7.110676 59.41262 4.718129 63.36696 4.636912 -3.954346      6.615263 
1 1 1 -15 12 2  o 166.6577 2.897595 338.7182       11.76790 338.9859       19.10823 338.5546       14.93655 166.5369 4.713145 166.5726 3.679687 -0.3564453E-01 5.979450 
1 1 1 -15 12 3  o 230.0308 3.490122 645.5422       19.56423 646.2166       31.46354 645.1170       24.98079 229.9213 5.615550 229.8636 4.459641 0.5775452E-01  7.170969 
1 1 1 -15 12 4  o 77.87618 2.731915 74.04231       5.176483 80.14140       8.398154 70.30531       6.573760 80.91299 4.274377 75.82811 3.567524 5.084885       5.567542 
1 1 1 -15 12 5  o 157.1028 3.491713 301.1018       13.36776 291.3102       23.33272 305.8861       16.30986 154.1954 6.222298 158.2437 4.233291 -4.048294      7.525805 
1 1 1 -15 12 6  o 355.7274 5.440375 1546.492       47.16092 1517.395       66.64296 1575.680       66.74838 351.8149 7.773273 358.5455 7.639419 -6.730591      10.89883 
1 1 1 -15 12 7  o 287.1460 4.098310 1006.367       28.67766 953.6328       44.49464 1043.839       37.50734 279.1519 6.540802 292.2802 5.265999 -13.12836      8.397192 
1 1 1 -15 12 8  o 200.4722 4.121145 490.5397       20.13298 525.8759       38.06840 476.8186       23.72195 207.0043 7.559257 197.5744 4.927012 9.429901       9.023182 
1 1 1 -15 12 9  o 379.4145 5.770217 1760.123       53.35096 1669.657       73.31442 1861.952       77.78300 368.8978 8.155438 389.5493 8.193813 -20.65158      11.56070 
1 1 1 -15 12 10 o 196.4476 3.524835 470.8402       16.87413 458.6472       24.20554 482.3679       23.53581 193.6765 5.133160 198.7196 4.860180 -5.043076      7.068995 
1 1 1 -15 12 11 o 145.4873 2.705968 258.1082       9.593648 251.5886       15.79119 261.9223       12.07819 143.4650 4.522468 146.5255 3.382614 -3.060471      5.647547 
1 1 1 -15 12 12 o 224.0231 3.805018 612.4821       20.77235 618.5263       30.39010 607.1820       28.45807 224.9219 5.544523 222.8906 5.239353 2.031357       7.628405 
1 1 1 -15 12 13 o 75.82120 3.428361 70.28486       6.318127 70.68523       8.426810 69.77083       9.548263 75.93723 4.575002 75.37273 5.230906 0.5644989      6.949317 
1 1 1 -15 12 14 o 106.7095 2.780497 138.9672       7.224229 148.3593       11.45402 132.7630       9.309407 110.1412 4.275604 104.2351 3.670713 5.906143       5.635151 
1 1 1 -15 12 15 o 109.0592 2.803194 145.1602       7.443746 155.5412       11.88948 138.4679       9.546198 112.7683 4.334601 106.4488 3.685608 6.319527       5.689682 
1 1 1 -15 12 16 o 229.9355 3.876696 645.4722       21.72220 646.8907       31.58489 644.1991       29.92216 229.9348 5.636877 229.5034 5.350172 0.4313965      7.771661 
1 1 1 -15 12 17 o 321.5728 5.002952 1264.324       39.20503 1245.684       55.72154 1282.598       55.17113 318.6156 7.176620 323.3568 7.001543 -4.741211      10.02624 
1 1 1 -15 12 18 o 61.93398 3.295001 46.94317       4.955128 38.72873       10.34508 49.38888       5.644787 55.59572 7.854363 63.49946 3.663439 -7.903740      8.666706 
1 1 1 -15 12 19 o 279.9454 5.164598 958.7833       35.23271 896.3950       60.45904 990.8657       43.35538 269.3372 9.225085 284.3205 6.257469 -14.98334      11.14711 
1 1 1 -15 12 20 o 211.8028 4.204436 548.1632       21.70080 552.9477       38.99927 546.0174       26.11762 211.9194 7.563914 211.2505 5.073407 0.6688995      9.107813 
1 1 1 -15 12 21 o 137.1693 2.999974 229.6096       10.02791 237.4750       15.29766 223.6832       13.27886 139.2911 4.512726 135.2437 4.033604 4.047409       6.052657 
1 1 1 -15 12 22 o 105.3619 2.860518 135.5619       7.337741 141.6795       11.46375 131.3158       9.550541 107.5566 4.382924 103.6100 3.788979 3.946648       5.793651 
1 1 1 -15 12 23 f 180.3490 3.397623 397.1899       14.93224 407.4835       22.40898 388.9691       20.02612 182.3583 5.047523 178.2471 4.614277 4.111206       6.838789 
1 1 1 -15 12 24 o 60.10798 3.810122 44.33025       5.552214 43.83821       7.669176 44.87219       8.048590 59.57188 5.339456 60.24410 5.544528 -0.6722221     7.697505 
1 1 1 -15 12 25 o 124.2939 3.000513 188.6171       9.088273 195.9181       14.04175 183.3538       11.92229 126.4283 4.565144 122.3867 4.002891 4.041542       6.071547 
1 1 1 -15 12 26 o 162.5641 3.656585 323.0561       14.48559 307.8170       25.20536 330.5715       17.70071 157.9794 6.561496 164.2605 4.426061 -6.281158      7.914748 
1 1 1 -15 12 27 o 157.1313 3.210573 301.6693       12.29366 325.5360       18.77069 283.7420       16.26832 162.8978 4.733581 152.1457 4.392398 10.75208       6.457550 
1 1 1 -15 12 28 o 65.62244 3.922611 52.89331       6.244205 53.39653       7.967097 52.09196       10.05382 65.77045 5.008544 64.67843 6.465305 1.092018       8.178367 
1 1 1 -15 12 29 o 84.93140 3.017946 88.27258       6.236271 85.72620       9.461173 90.22884       8.292726 83.44278 4.671513 85.73260 3.980174 -2.289825      6.137167 
1 1 1 -15 12 30 o 87.82255 3.297291 94.50468       7.044132 94.29541       12.65461 94.59863       8.479241 87.16762 5.993898 87.75529 3.975363 -0.5876694     7.192380 
1 1 1 -15 12 31 f 121.2146 3.030364 179.7759       8.951293 177.2607       13.29667 181.8606       12.10514 119.9646 4.556633 121.6401 4.089541 -1.675522      6.122684 
1 1 1 -15 12 32 o 112.1261 3.031176 154.0638       8.274760 146.5047       12.29218 160.3279       11.18990 108.9206 4.641725 114.1370 4.029445 -5.216415      6.146709 
1 1 1 -15 12 33 o 34.14778 5.688601 14.87647       4.567286 24.19913       11.25105 13.03708       4.997585 42.15373 10.87942 31.68281 6.683498 10.47092       12.76835 
1 1 1 -15 12 34 o 34.90861 5.533206 15.55598       4.550214 16.54687       6.364456 14.51991       6.507890 35.42236 7.600690 33.02733 8.139207 2.395031       11.13630 
1 1 1 -15 12 35 o 41.73969 4.750359 21.95933       4.745955 16.55692       6.218214 29.49765       7.345296 35.31389 7.459916 47.84865 6.464694 -12.53476      9.871302 
1 1 1 -15 12 36 o 75.71099 3.140131 70.79317       5.780948 84.44350       9.113283 61.60193       7.478087 82.09908 4.573200 70.16045 4.395922 11.93862       6.343366 
1 1 1 -15 12 37 o 53.51092 3.580331 35.70624       4.641898 33.54700       6.934733 37.45905       6.248098 50.99007 5.677107 54.34472 4.766165 -3.354652      7.412548 
1 1 1 -15 12 38 f 12.47755 5.553928 -0.9329897     3.403278 -5.902251      5.249769 2.669234       4.469712 12.79802 6.097394 17.57238 6.983086 -4.774357      9.270474 
1 1 1 -15 12 39 o 21.44346 6.520064 6.260566       3.709172 6.650710       5.476327 5.929892       5.041707 22.44006 7.974276 21.42610 7.647325 1.013958       11.04856 
1 1 1 -15 12 40 o 61.10037 4.138791 47.86501       6.126082 49.79691       7.673350 44.46936       10.17313 61.48954 5.168717 55.67552 7.704399 5.814026       9.277575 
1 1 1 -15 12 41 o 11.45461 5.312913 -2.263416      3.541255 -2.860604      4.766981 -1.528017      5.289926 13.16366 6.125547 14.69476 6.696182 -1.531099      9.075306 
1 1 1 -15 12 42 o 43.49472 4.440922 25.02691       4.641037 29.14391       6.701670 21.23294       6.433383 45.34455 6.229335 37.68824 7.268245 7.656307       9.572461 
1 1 1 -15 12 43 o 9.867346 4.856503 -7.171689      4.110734 -9.776674      4.957536 -1.439268      7.354146 10.34924 5.136774 16.49093 7.651443 -6.141688      9.215803 
1 1 1 -15 12 44 o 21.64656 7.171117 7.565340       4.406565 10.56708       7.627454 6.061552       5.398666 23.62945 9.202890 19.80215 7.733779 3.827301       12.02100 
1 1 1 -15 12 45 f 37.50847 4.942658 19.94946       4.407950 27.43162       6.616350 13.97813       5.910724 41.74695 6.732636 27.68604 8.188111 14.06092       10.60064 
1 1 1 -15 12 46 o 14.08041 6.052655 1.671961       3.742632 1.973698       5.785223 1.454788       4.908050 15.93367 7.155762 14.95219 6.661666 0.9814806      9.776642 
1 1 1 -15 13 1  o 151.8482 3.263897 281.2879       12.07765 278.7088       17.00460 283.9135       17.15716 150.9880 4.627012 152.3928 4.625384 -1.404785      6.542432 
1 1 1 -15 13 2  o 260.6911 3.824416 829.4053       24.29559 850.5394       39.50645 816.5510       30.81068 263.6512 6.148967 258.5293 4.890524 5.121918       7.856655 
1 1 1 -15 13 3  o 88.20774 2.558622 94.95039       5.494014 87.30280       9.216573 99.16573       6.842635 84.43423 4.495552 90.11265 3.120739 -5.678413      5.472568 
1 1 1 -15 13 4  o 203.0889 4.084491 503.4634       20.21437 497.1628       34.97567 506.6236       24.77042 201.3140 7.140758 203.6340 4.991683 -2.319946      8.712481 
1 1 1 -15 13 5  o 323.0265 5.049200 1274.919       39.74632 1235.338       55.70972 1315.953       56.72355 317.5204 7.199847 327.7417 7.102245 -10.22131      10.11334 
1 1 1 -15 13 6  o 98.14280 2.825614 117.5595       6.750797 121.7058       10.56791 114.7011       8.774432 99.74577 4.358208 96.88032 3.723545 2.865448       5.732257 
1 1 1 -15 13 7  o 49.72666 3.127081 30.27988       3.770162 31.33649       6.435653 29.72780       4.652005 50.35771 5.324898 49.19900 3.912342 1.158710       6.607644 
1 1 1 -15 13 8  o 228.7797 3.884296 638.7922       21.65539 629.4659       44.96361 641.6089       24.71004 226.3209 8.166067 229.2273 4.423552 -2.906433      9.287221 
1 1 1 -15 13 9  o 129.0488 2.626124 203.0702       8.258577 214.4299       14.16742 197.2234       10.16410 132.4454 4.395616 127.1077 3.284165 5.337730       5.487000 
1 1 1 -15 13 10 o 302.2192 4.263000 1115.177       31.39594 1149.905       51.25311 1094.319       39.72062 306.3875 6.864565 299.1848 5.448041 7.202728       8.763755 
1 1 1 -15 13 11 o 291.1769 4.142559 1035.112       29.39421 980.4675       45.69349 1073.689       38.39259 282.9473 6.626934 296.3620 5.316047 -13.41467      8.495682 
1 1 1 -15 13 12 o 87.16171 2.499992 92.71295       5.304587 101.7001       9.639688 88.80949       6.352980 91.15332 4.352219 85.27130 3.062276 5.882019       5.321592 
1 1 1 -15 13 13 o 189.2806 4.052545 437.4288       18.69261 441.2012       23.58901 431.0619       30.64541 189.9137 5.101653 187.4447 6.719849 2.469025       8.437016 
1 1 1 -15 13 14 o 128.9741 2.939912 202.9060       9.240020 198.5660       14.08429 206.1854       12.24304 127.4086 4.543556 129.9017 3.871893 -2.493149      5.969544 
1 1 1 -15 13 15 o 161.0099 3.180283 316.2995       12.47827 332.6821       19.03325 303.9499       16.52521 164.9234 4.740731 157.6886 4.304446 7.234894       6.403342 
1 1 1 -15 13 16 o 84.85133 2.825007 87.91969       5.833220 89.89918       9.482602 86.71461       7.398709 85.65201 4.559545 84.20748 3.613943 1.444527       5.818079 
1 1 1 -15 13 17 o 184.7005 3.888375 416.5859       17.50138 440.6131       33.07677 407.2438       20.62502 189.3146 7.182759 182.4735 4.642066 6.841064       8.552240 
1 1 1 -15 13 18 o 196.9992 4.045553 474.0508       19.42131 486.6158       36.10515 468.9349       23.03825 198.8585 7.463808 195.8293 4.827651 3.029190       8.889018 
1 1 1 -15 13 19 o 58.10111 3.431315 41.35254       4.836632 34.16056       10.26791 43.40335       5.483026 52.02037 8.384749 59.49419 3.801790 -7.473816      9.206390 
1 1 1 -15 13 20 o 68.65223 2.968264 57.62018       4.954113 67.46426       8.413180 52.39496       6.129498 74.12597 4.681421 65.37904 3.864487 8.746925       6.070417 
1 1 1 -15 13 21 o 109.2872 2.879983 145.8457       7.663313 148.8956       11.91459 143.6938       10.00813 110.2600 4.443402 108.3900 3.794881 1.870018       5.843368 
1 1 1 -15 13 22 f 48.50581 3.491473 28.88199       4.099427 31.89055       6.987052 27.30267       5.062323 50.68021 5.759471 47.03801 4.470023 3.642200       7.290584 
1 1 1 -15 13 23 o 96.00538 2.881194 112.5953       6.733059 102.7066       10.30429 119.9633       8.894476 91.49512 4.636629 99.01919 3.692550 -7.524063      5.927330 
1 1 1 -15 13 24 o 124.5848 3.499953 189.7750       10.61532 191.8736       13.95336 186.8916       16.35591 125.1184 4.584124 123.3294 5.455673 1.789032       7.125907 
1 1 1 -15 13 25 o 215.3746 3.785670 567.1204       19.86887 587.9454       29.59422 550.0303       26.80939 218.7956 5.554995 211.7867 5.194601 7.008850       7.605382 
1 1 1 -15 13 26 o 107.2274 2.962737 140.5210       7.734257 142.9895       12.03280 138.7831       10.09610 107.9384 4.585060 106.4431 3.898830 1.495255       6.018609 
1 1 1 -15 13 27 o 92.58294 4.222350 105.1828       9.501158 94.88063       13.37500 115.6771       13.49919 87.53139 6.312788 96.81825 5.747422 -9.286865      8.537221 
1 1 1 -15 13 28 o 227.8261 3.948171 635.6094       21.91975 648.1919       32.11626 624.6370       29.99115 229.3582 5.750653 225.3369 5.461661 4.021286       7.930936 
1 1 1 -15 13 29 o 196.2755 3.612869 471.6408       17.28042 488.3561       25.84834 458.1331       23.23624 199.0964 5.332420 192.9820 4.945053 6.114410       7.272431 
1 1 1 -15 13 30 o 111.0820 3.321240 151.1836       8.980326 149.9018       16.33813 151.7386       10.74983 109.8832 6.125727 111.1532 3.975059 -1.269989      7.302440 
1 1 1 -15 13 31 o 15.35546 6.075716 1.639630       3.369827 6.789783       5.474932 -1.501424      4.275692 23.85030 7.995554 14.01127 6.231601 9.839029       10.13715 
1 1 1 -15 13 32 o 102.4498 3.016681 128.7019       7.523216 118.8426       11.27418 136.6163       10.10109 97.98751 4.735501 105.3220 3.942577 -7.334511      6.161890 
1 1 1 -15 13 33 o 80.35126 3.538220 79.53834       6.911104 73.48377       14.59324 81.28886       7.846845 75.51804 8.053998 81.11471 3.981884 -5.596664      8.984558 
1 1 1 -15 13 34 o 54.06139 4.084119 36.33305       5.340693 31.55117       7.187687 42.22738       7.980065 49.75628 6.052305 57.77159 5.744367 -8.015308      8.344348 
1 1 1 -15 13 35 o 94.09321 3.089558 109.1152       7.074594 127.4495       11.30383 97.30930       9.070725 101.0120 4.604260 88.41354 4.222251 12.59850       6.247129 
1 1 1 -15 13 36 o 22.29265 6.508934 6.547343       3.755416 -1.362252      5.630299 12.88646       5.040443 16.07430 7.149930 31.02309 6.850558 -14.94879      9.902102 
1 1 1 -15 13 37 o 49.27963 4.404206 30.74417       5.233279 28.52042       6.837232 33.88987       8.131967 46.62778 6.168435 50.53425 6.773946 -3.906467      9.161656 
1 1 1 -15 13 38 o 43.91156 4.116997 24.48971       4.354127 24.16022       6.561298 24.74899       5.820395 42.34774 6.570863 43.40287 5.635942 -1.055130      8.656795 
1 1 1 -15 13 39 o 17.12562 7.268137 1.446006       5.274318 -0.5927224     7.122521 3.921326       7.848194 17.87021 7.989057 21.38761 8.959400 -3.517395      12.00399 
1 1 1 -15 13 40 f 46.38162 5.011441 28.46872       5.574442 26.76675       7.001584 31.41547       9.212818 43.57154 6.817453 45.52111 8.620614 -1.949566      10.99057 
1 1 1 -15 13 41 o 54.14765 3.851662 37.78147       5.049162 42.65287       7.402299 33.54284       6.904817 56.03098 5.491743 49.30113 5.861873 6.729851       8.032483 
1 1 1 -15 13 42 o 25.71447 6.483435 9.779839       4.061145 15.01439       6.004167 5.365439       5.513772 30.72809 7.956269 19.90661 7.803681 10.82148       11.14449 
1 1 1 -15 13 43 o 26.91266 7.103535 11.38813       4.726083 10.53109       5.718803 13.23433       8.393461 24.92525 8.165278 26.12643 9.779157 -1.201181      12.73985 
1 1 1 -15 13 44 o 16.03506 6.599646 2.936299       4.153498 -7.860279      6.650435 9.840680       5.318257 12.88507 6.308079 23.75762 7.878366 -10.87255      10.09260 
1 1 1 -15 13 45 o 19.66082 6.747560 6.314338       3.901138 2.604664       6.300808 8.620468       4.967870 16.87225 7.530480 22.02931 7.612236 -5.157063      10.70767 
1 1 1 -15 13 46 o 23.37064 7.232940 9.673735       4.539319 15.77634       9.165436 7.690342       5.225164 24.73301 9.941840 20.41618 7.700030 4.316828       12.57500 
1 1 1 -15 14 1  o 135.7606 4.305345 225.3048       14.22553 233.0148       19.35722 216.2513       20.97602 137.8892 5.773493 132.7222 6.505319 5.166992       8.697839 
1 1 1 -15 14 2  o 173.1714 3.337555 365.8794       14.08448 359.0093       20.55856 371.9558       19.33465 171.3328 4.929101 174.4445 4.552124 -3.111755      6.709536 
1 1 1 -15 14 3  o 51.07287 3.211373 31.94634       3.976611 37.72321       7.733191 29.86963       4.636611 55.22763 5.834083 49.31585 3.889609 5.911781       7.011817 
1 1 1 -15 14 4  o 350.0500 4.838588 1497.104       41.27478 1418.993       63.81005 1553.296       54.12183 340.0862 7.699526 356.2384 6.234415 -16.15222      9.907100 
1 1 1 -15 14 5  o 174.2934 2.988723 370.5258       12.69412 348.6164       20.17138 384.8924       16.33416 168.8427 4.907703 177.5854 3.774447 -8.742752      6.191285 
1 1 1 -15 14 6  o 97.84223 2.527048 116.8073       6.020219 129.8587       10.63076 110.6458       7.304338 103.0417 4.242726 95.18668 3.153323 7.855019       5.286225 
1 1 1 -15 14 7  o 68.31665 2.603539 56.99439       4.326445 67.34322       8.055957 52.79973       5.128849 74.12228 4.480901 65.71045 3.212682 8.411827       5.513601 
1 1 1 -15 14 8  o 189.8135 3.478091 439.6238       16.08808 449.6762       34.48616 436.8276       18.18855 191.3478 7.409808 189.1701 3.945567 2.177643       8.394805 
1 1 1 -15 14 9  o 81.08168 2.569595 80.24742       5.070781 78.55237       8.953507 81.04784       6.152607 80.05908 4.608778 81.45201 3.105399 -1.392929      5.557368 
1 1 1 -15 14 10 o 121.2138 2.597472 179.1719       7.672535 193.5024       13.32759 172.0683       9.383421 125.7989 4.354053 118.7148 3.246596 7.084167       5.431221 
1 1 1 -15 14 11 o 177.2180 3.000545 383.1013       12.95818 375.3006       21.15038 387.7890       16.39571 175.1633 4.959943 178.2401 3.774754 -3.076889      6.232961 
1 1 1 -15 14 12 o 137.1228 3.083771 229.3811       10.30452 236.7159       15.35128 223.3661       13.90187 139.1257 4.534001 135.1748 4.225471 3.950897       6.197723 
1 1 1 -15 14 13 o 88.80489 2.552048 96.25267       5.517104 84.85005       9.476182 102.0997       6.785769 83.19667 4.693057 91.43251 3.049794 -8.235840      5.596965 
1 1 1 -15 14 14 o 314.2743 4.931216 1207.443       37.76583 1245.624       55.31948 1174.117       51.68361 318.6305 7.124505 309.4289 6.854185 9.201538       9.886274 
1 1 1 -15 14 15 o 56.33363 3.186070 38.84655       4.355974 28.02569       7.114949 45.33419       5.509142 47.41455 6.314627 60.82258 3.734931 -13.40803      7.336499 
1 1 1 -15 14 16 o 104.4367 3.199077 133.2227       8.132080 118.0940       15.33886 139.1375       9.590890 97.93606 6.463219 106.6891 3.694525 -8.753052      7.444643 
1 1 1 -15 14 17 o 149.5460 3.528857 273.0203       12.86012 283.5154       24.61098 269.0783       15.08311 151.8743 6.666039 148.3469 4.176464 3.527374       7.866316 
1 1 1 -15 14 18 o 39.93661 3.805309 19.65446       3.658659 16.84741       6.361332 21.04196       4.472390 36.37415 7.428047 41.24332 4.524063 -4.869171      8.697301 
1 1 1 -15 14 19 o 97.51749 3.184105 116.1942       7.556547 108.3478       14.65300 119.0370       8.819814 93.74823 6.453346 98.65919 3.674899 -4.910957      7.426342 
1 1 1 -15 14 20 o 65.28812 3.083029 52.14097       4.891244 48.65385       8.017765 54.20803       6.172990 62.81443 5.286934 66.50381 3.825155 -3.689381      6.525602 
1 1 1 -15 14 21 o 129.9315 2.996917 206.0508       9.489104 199.3978       14.33801 211.2358       12.65775 127.5850 4.619240 131.4141 3.957069 -3.829117      6.082415 
1 1 1 -15 14 22 o 167.8634 3.294155 344.0878       13.47523 349.2008       20.20571 339.9922       18.08404 168.8091 4.917057 166.6513 4.456980 2.157730       6.636423 
1 1 1 -15 14 23 o 120.6129 3.002111 177.5977       8.823818 174.6842       13.39386 179.8318       11.72878 119.3741 4.612939 121.2160 3.975987 -1.841904      6.089965 
1 1 1 -15 14 24 o 119.0217 3.474662 173.2403       10.06722 166.6916       13.07117 182.7890       15.78379 116.5854 4.609897 121.9648 5.323386 -5.379341      7.041987 
1 1 1 -15 14 25 o 22.33669 6.199448 6.320650       3.493448 2.606461       6.369421 7.918677       4.177920 20.69224 8.298082 24.93100 6.723814 -4.238760      10.68025 
1 1 1 -15 14 26 o 73.34851 3.902010 66.01128       6.949448 64.33961       8.946148 68.55493       11.03549 72.22964 5.115684 74.37822 6.143222 -2.148575      7.994336 
1 1 1 -15 14 27 o 54.61641 4.440593 36.80320       5.859225 35.29001       7.565605 39.07092       9.261718 53.21048 5.935544 55.80001 6.962215 -2.589527      9.148941 
1 1 1 -15 14 28 o 59.78441 3.370092 43.86002       4.889943 46.18736       8.148024 42.54994       6.113223 60.99766 5.541981 58.75004 4.299757 2.247623       7.014375 
1 1 1 -15 14 29 o 136.9787 3.142868 229.5257       10.49096 223.5771       15.80288 234.2131       14.02810 134.7489 4.820310 138.1007 4.173162 -3.351776      6.375787 
1 1 1 -15 14 30 o 163.8309 3.726707 329.1738       14.87843 328.1656       26.54946 329.6354       17.96437 162.2641 6.728847 163.6394 4.509229 -1.375351      8.100032 
1 1 1 -15 14 31 o 73.96318 3.125819 67.13689       5.621282 69.17064       9.007963 65.83980       7.193890 74.67161 4.978781 73.06477 4.056276 1.606834       6.421965 
1 1 1 -15 14 32 o 49.29751 4.306869 30.20221       5.122053 29.36110       12.08818 30.38627       5.654782 46.42947 10.87581 49.34237 4.761926 -2.912891      11.87263 
1 1 1 -15 14 33 o 21.98993 6.347893 6.227840       3.590330 5.169385       6.060751 6.800101       4.456433 22.31816 8.318643 23.11837 7.168563 -0.8002090     10.98126 
1 1 1 -15 14 34 o 47.19700 4.446815 27.90266       5.054183 34.39690       7.084507 21.17145       7.212602 52.02768 5.679926 39.95506 7.686745 12.07262       9.557594 
1 1 1 -15 14 35 o 70.43590 3.271295 61.35594       5.599666 59.13883       8.613345 62.97898       7.369576 68.38017 5.208168 70.99432 4.279608 -2.614151      6.740924 
1 1 1 -15 14 36 o 16.97046 6.342474 2.986982       3.527937 1.790214       5.494038 3.826721       4.602129 18.17091 7.544925 19.13408 7.224206 -0.9631653     10.44581 
1 1 1 -15 14 37 o 46.11661 3.972851 26.83479       4.421255 26.63475       6.627317 26.99521       5.935008 44.86475 6.229571 45.58506 5.450627 -0.7203102     8.277493 
1 1 1 -15 14 38 o 59.43823 5.527044 46.27485       7.913887 46.27485       7.913887 0.000000       0.000000 59.43823 5.527044 ?        ?        0.000000       5.527044 
1 1 1 -15 14 39 o 46.83467 6.111733 29.78781       6.809135 27.25952       9.256214 32.76956       10.05209 42.09487 9.274121 46.33287 9.227237 -4.238003      13.08248 
1 1 1 -15 14 40 f 22.22620 6.721496 7.108042       3.949285 7.978843       5.716594 6.312978       5.462343 23.23509 8.157125 21.37820 7.910684 1.856888       11.36299 
1 1 1 -15 14 41 o 39.29090 4.702047 20.59641       4.412807 26.93283       6.712793 15.77443       5.855903 43.35646 6.558188 32.14898 7.596059 11.20749       10.03543 
1 1 1 -15 14 42 o 67.50959 3.577949 58.80707       5.865190 49.37687       8.253566 68.42731       8.336316 59.26116 5.788990 71.24149 4.830375 -11.98034      7.539558 
1 1 1 -15 14 43 o 31.16422 6.716581 14.91458       4.950326 15.69736       8.362992 14.49238       6.141938 27.90744 9.860370 28.96359 8.284476 -1.056150      12.87864 
1 1 1 -15 14 44 o 25.93703 6.561469 10.66201       4.149609 12.40589       6.158215 9.211670       5.616053 25.73067 8.475492 22.61049 8.071043 3.120188       11.70366 
1 1 1 -15 14 45 o 15.08823 6.527294 2.058503       4.406850 9.303583       8.405741 -0.6876412     5.175068 21.26783 9.105173 13.94469 6.452079 7.323145       11.15946 
1 1 1 -15 15 1  o 116.5611 3.481501 165.9573       9.878005 181.4877       16.14374 156.6631       12.48876 121.6840 5.458100 113.1467 4.538615 8.537300       7.098583 
1 1 1 -15 15 2  o 192.0811 3.187966 450.1431       14.92225 429.3935       23.93254 463.3408       19.08673 187.3172 5.248114 194.8004 4.020738 -7.483185      6.611280 
1 1 1 -15 15 3  o 236.2980 3.997096 681.7374       23.01658 696.6547       33.81163 668.8553       31.42046 238.5965 5.815216 233.8386 5.513916 4.757889       8.013739 
1 1 1 -15 15 4  o 47.76491 2.970120 27.93706       3.440051 30.81491       6.412852 26.77435       4.076159 49.91534 5.355724 46.69934 3.609828 3.216007       6.458687 
1 1 1 -15 15 5  o 58.68092 2.767103 42.09031       3.945784 39.97256       6.973563 43.08760       4.785503 56.96028 5.077124 59.33255 3.323054 -2.372269      6.067938 
1 1 1 -15 15 6  o 159.6799 3.203874 311.0790       12.46699 309.7780       18.48343 312.1649       16.88657 159.1490 4.771261 159.8133 4.340049 -0.6642609     6.449880 
1 1 1 -15 15 7  o 92.64819 2.589119 104.7583       5.839814 116.4664       10.47146 99.47302       7.035494 97.54798 4.416526 90.23888 3.204459 7.309105       5.456580 
1 1 1 -15 15 8  o 279.1105 4.510612 951.6735       30.67946 958.1599       63.63686 949.7094       35.01761 278.7058 9.383101 278.7114 5.155796 -0.5584717E-02 10.70630 
1 1 1 -15 15 9  o 228.7769 3.507929 638.7384       19.55686 649.0706       31.92889 632.5345       24.74110 230.3210 5.688716 227.5512 4.461734 2.769745       7.229700 
1 1 1 -15 15 10 o 255.4481 3.780817 796.5805       23.53556 848.3808       39.40217 767.8472       29.34587 263.2172 6.142848 250.6538 4.804372 12.56343       7.798498 
1 1 1 -15 15 11 o 79.51018 2.607591 77.18157       5.045574 83.42300       9.113051 74.42252       6.059004 82.50562 4.550186 78.03516 3.192957 4.470459       5.558702 
1 1 1 -15 15 12 o 312.0180 4.950644 1190.220       37.64242 1212.094       54.30444 1169.989       52.22526 314.3177 7.089743 308.8548 6.938893 5.462921       9.920317 
1 1 1 -15 15 13 o 265.6435 4.341189 862.1241       28.10244 865.0919       40.80234 859.4457       38.76183 265.7065 6.301542 264.9066 6.004478 0.7998352      8.704206 
1 1 1 -15 15 14 o 168.8160 3.724810 347.9517       15.32336 366.2604       28.95959 340.8325       18.05847 172.6394 6.897499 166.9498 4.442681 5.689606       8.204445 
1 1 1 -15 15 15 o 101.5062 3.206240 125.8637       7.920995 150.2455       16.28709 118.3103       9.065289 110.5721 6.067780 98.35922 3.789165 12.21285       7.153721 
1 1 1 -15 15 16 o 179.1807 3.400242 391.9075       14.84695 395.4506       22.24421 389.0610       19.93808 179.7148 5.084330 178.3361 4.591658 1.378769       6.850820 
1 1 1 -15 15 17 o 202.8367 3.633164 502.3924       17.95840 497.8301       26.33610 506.3573       24.55172 201.5850 5.365910 203.4462 4.952178 -1.861160      7.301853 
1 1 1 -15 15 18 o 197.7540 3.591722 477.5573       17.30868 476.3932       25.53421 478.5468       23.54317 197.1803 5.318875 197.7715 4.885006 -0.5912781     7.221753 
1 1 1 -15 15 19 o 67.78442 3.435133 56.24698       5.655766 42.66063       11.96757 60.15399       6.417659 58.15862 8.711988 70.07243 3.772221 -11.91382      9.493598 
1 1 1 -15 15 20 o 110.9171 2.945132 150.2526       7.953438 150.6207       12.38972 149.9946       10.37284 110.8670 4.595849 110.7298 3.849978 0.1371765      5.995344 
1 1 1 -15 15 21 o 90.23602 2.949917 99.49237       6.478014 107.1463       10.50390 94.79427       8.229402 93.45994 4.626378 87.98919 3.847281 5.470749       6.017054 
1 1 1 -15 15 22 o 25.43707 5.879898 8.258221       3.571823 7.730642       6.310264 8.506943       4.332728 25.69967 8.583348 25.83084 6.793679 -0.1311646     10.94660 
1 1 1 -15 15 23 o 186.2787 4.067796 424.4186       18.46539 428.7504       23.59051 417.5662       29.67086 186.9339 5.183613 184.0733 6.625401 2.860580       8.412240 
1 1 1 -15 15 24 o 108.3336 2.990744 143.4311       7.887924 149.0272       12.44864 139.6770       10.19599 110.1965 4.646154 106.7886 3.924713 3.407860       6.081950 
1 1 1 -15 15 25 o 41.23501 4.190370 21.02751       4.152282 9.860834       6.780007 27.72955       5.252564 28.25204 8.854768 47.34919 4.610537 -19.09716      9.983184 
1 1 1 -15 15 26 o 76.87326 3.907060 72.51665       7.295161 59.73325       9.130772 95.08010       12.13073 69.50461 5.434022 87.73096 5.705056 -18.22635      7.878849 
1 1 1 -15 15 27 o 111.4145 3.029139 151.8311       8.216629 160.9193       13.02638 145.8260       10.58883 114.4017 4.682459 109.0321 3.992009 5.369629       6.153174 
1 1 1 -15 15 28 o 90.02201 3.043025 99.20666       6.666005 99.61749       10.62106 98.93965       8.562421 89.88251 4.867208 89.76171 3.923918 0.1208038      6.251947 
1 1 1 -15 15 29 o 127.1746 3.428415 198.2400       10.61533 201.1304       19.56118 197.0334       12.63814 127.1974 6.330641 126.6251 4.101102 0.5723724      7.542947 
1 1 1 -15 15 30 o 80.89042 3.348919 80.33131       6.587149 92.60526       12.68193 75.79647       7.708562 86.14382 6.080289 78.43282 4.046787 7.710999       7.303862 
1 1 1 -15 15 31 o 56.45297 3.518739 39.28346       4.816651 36.46354       7.973300 40.90390       6.044157 53.72472 6.203982 57.43836 4.350499 -3.713642      7.577350 
1 1 1 -15 15 32 o 18.34133 6.867852 3.292513       4.140637 5.064275       10.90335 2.993936       4.475950 26.50761 10.77550 18.40600 7.081883 8.101614       12.89436 
1 1 1 -15 15 33 o 110.7318 3.574760 151.2936       9.633538 151.9677       12.72473 150.3886       14.74525 110.4579 4.738349 109.4428 5.546861 1.015091       7.295178 
1 1 1 -15 15 34 o 48.18081 3.921431 28.94772       4.564428 29.28768       7.257836 28.72529       5.870730 47.58044 6.423469 47.60824 5.141745 -0.2780151E-01 8.227909 
1 1 1 -15 15 35 o 49.56092 3.657099 30.62548       4.385734 30.82797       6.764757 30.47866       5.760341 48.91169 5.787485 49.00954 4.888288 -0.9785843E-01 7.575642 
1 1 1 -15 15 36 o 42.18975 4.270208 22.54251       4.329895 24.99340       6.807212 20.87709       5.611379 43.35066 6.656134 39.88939 5.954740 3.461277       8.931016 
1 1 1 -15 15 37 o 30.63766 6.656801 12.85130       4.827632 10.42697       5.932159 17.60553       8.307241 27.09463 8.247011 34.30148 9.574760 -7.206858      12.63682 
1 1 1 -15 15 38 o 44.43830 4.215588 25.30900       4.510520 22.08753       6.978736 27.62018       5.911067 39.47011 7.530265 45.74145 5.407408 -6.271343      9.270650 
1 1 1 -15 15 39 o 18.08864 7.648503 2.270197       5.804778 2.270197       5.804778 0.000000       0.000000 18.08864 7.648503 ?        ?        0.000000       7.648503 
1 1 1 -15 15 40 o 31.36409 5.753477 13.66184       4.235430 13.14049       6.301576 14.09143       5.720151 28.79879 8.437905 30.43729 7.705816 -1.638508      11.42707 
1 1 1 -15 15 41 o 19.06402 6.820260 5.079953       4.012546 0.4069386E-01  5.648303 10.21415       5.701262 15.85166 7.098480 25.21828 8.145009 -9.366623      10.80415 
1 1 1 -15 15 42 o 15.10962 6.633809 0.8751997      4.697334 1.805147       5.879316 -0.7661557     7.810860 16.92434 7.426375 17.09643 7.916070 -0.1720905     10.85427 
1 1 1 -15 15 43 o 29.03188 6.907880 13.33182       4.815950 4.260442       8.048364 18.39151       6.010807 19.25053 8.556454 33.55759 7.535236 -14.30706      11.40143 
1 1 1 -15 15 44 o 12.70129 5.829866 -0.8711122     4.106510 3.729788       7.602820 -2.766274      4.879513 18.24586 8.197939 12.62478 5.975169 5.621081       10.14440 
1 1 1 -15 15 45 o 22.51285 7.015071 8.741312       4.261859 7.673404       6.563908 9.519633       5.603702 20.18050 8.300176 22.27764 8.048585 -2.097136      11.56169 
1 1 1 -15 16 1  o 98.95838 3.500622 119.6763       8.428481 111.6263       12.91812 125.6432       11.12189 95.34245 5.584477 101.3001 4.516751 -5.957642      7.182439 
1 1 1 -15 16 2  f 272.1942 4.409322 905.1985       29.24738 856.5339       56.25436 923.2260       34.23872 263.5806 8.770247 274.7628 5.113562 -11.18222      10.15213 
1 1 1 -15 16 3  o 77.86587 2.643255 74.03174       5.008323 74.35886       8.762832 73.87304       6.103446 77.86768 4.638998 77.74188 3.228719 0.1258011      5.651984 
1 1 1 -15 16 4  o 178.9299 3.388445 390.7097       14.77472 406.8009       22.24007 377.9980       19.76710 182.3395 5.009923 175.8167 4.617668 6.522781       6.813383 
1 1 1 -15 16 5  o 34.77645 5.053600 15.09302       4.157488 18.01134       6.018803 12.42993       5.749584 37.76463 6.789756 31.20138 7.627029 6.563244       10.21138 
1 1 1 -15 16 6  o 124.2181 2.687128 188.1925       8.134097 192.5787       13.77459 185.8441       10.07909 125.4649 4.512616 123.3614 3.355905 2.103539       5.623682 
1 1 1 -15 16 7  o 199.4628 3.623366 485.6319       17.61207 480.0309       37.39423 487.2285       19.96511 197.5226 7.784000 199.7402 4.101759 -2.217606      8.798585 
1 1 1 -15 16 8  o 46.11922 3.217975 26.07869       3.593911 27.38736       6.716025 25.55356       4.254292 46.91706 6.012147 45.58612 3.866074 1.330944       7.147897 
1 1 1 -15 16 9  o 33.87686 4.034551 14.21202       3.265324 16.44845       6.229363 13.36470       3.834313 35.96290 7.356355 32.69616 4.968472 3.266739       8.877031 
1 1 1 -15 16 10 o 222.1192 3.454661 602.1614       18.69940 610.9362       30.71178 596.9921       23.57249 223.3461 5.647277 221.0509 4.375998 2.295181       7.144306 
1 1 1 -15 16 11 f 129.8201 2.708428 205.5670       8.568315 204.4857       14.43385 206.1553       10.64730 129.2687 4.589254 129.9247 3.365716 -0.6559753     5.691160 
1 1 1 -15 16 12 o 102.6568 4.055436 128.9172       10.12525 132.6906       15.20438 125.9102       13.57269 103.9041 6.030737 101.2778 5.520270 2.626228       8.175767 
1 1 1 -15 16 13 o 91.72988 3.216244 102.8115       7.178330 99.24332       13.69857 104.1622       8.428183 89.76228 6.302517 92.28471 3.755574 -2.522430      7.336625 
1 1 1 -15 16 14 o 181.5419 3.081646 402.1689       13.63314 422.9096       23.05097 391.0108       16.90716 185.8554 5.094338 178.9280 3.877540 6.927399       6.402155 
1 1 1 -15 16 15 f 48.33674 3.143498 28.63387       3.682684 30.55859       7.085193 27.92139       4.310736 49.58294 5.984780 47.67054 3.740723 1.912392       7.057662 
1 1 1 -15 16 16 o 65.06993 3.201040 51.80387       5.060256 52.00789       8.573888 51.69482       6.268422 64.94257 5.468422 64.92802 3.980914 0.1455688E-01  6.763972 
1 1 1 -15 16 17 o 111.0259 2.965234 150.5340       8.015493 143.4723       12.30372 155.7409       10.56512 108.2047 4.677147 112.8452 3.847609 -4.640450      6.056386 
1 1 1 -15 16 18 o 129.2109 3.458485 204.0167       10.88004 182.8323       20.55197 212.2655       12.82452 121.7637 6.955201 131.7352 3.999508 -9.971512      8.023147 
1 1 1 -15 16 19 o 98.86317 2.966955 119.3978       7.139864 127.5684       11.62941 114.4548       9.045292 102.0005 4.691201 96.70731 3.845865 5.293144       6.066140 
1 1 1 -15 16 20 o 67.89084 3.168937 56.39680       5.228306 64.54243       8.896101 52.09875       6.462090 72.41703 5.073164 65.15195 4.090788 7.265076       6.517019 
1 1 1 -15 16 21 o 41.68616 4.060215 21.44772       4.072348 19.54821       7.101042 22.37859       4.971035 39.14316 7.718824 42.47040 4.892422 -3.327236      9.138711 
1 1 1 -15 16 22 o 90.78322 2.993648 100.7365       6.613754 112.6429       10.87185 93.74168       8.333039 95.79588 4.671236 87.47047 3.919316 8.325409       6.097662 
1 1 1 -15 16 23 o 27.25323 6.314135 9.502656       4.111119 14.90325       6.622529 6.116577       5.243865 34.02503 8.103592 23.06292 7.825093 10.96211       11.26500 
1 1 1 -15 16 24 o 127.2140 3.064827 197.6845       9.501163 206.2777       14.78313 191.6368       12.40174 129.6477 4.686846 125.0665 4.074605 4.581154       6.210389 
1 1 1 -15 16 25 o 107.4037 3.677261 141.2767       9.610342 146.7129       12.44063 133.2318       15.13394 109.2813 4.682398 103.8511 6.005664 5.430191       7.615304 
1 1 1 -15 16 26 o 45.01169 3.980718 25.00708       4.321431 20.72943       7.495848 27.13659       5.288805 40.16109 7.940619 46.79045 4.702032 -6.629353      9.228354 
1 1 1 -15 16 27 o 133.1054 3.127131 216.6647       10.14327 218.5486       15.63238 215.2948       13.33052 133.2630 4.821653 132.4396 4.135479 0.8233795      6.352206 
1 1 1 -15 16 28 o 72.28326 3.159334 64.05659       5.551612 70.90320       9.118192 60.02350       6.998254 75.72364 4.968750 69.81107 4.132153 5.912567       6.462442 
1 1 1 -15 16 29 o 93.78928 3.322144 107.9083       7.580909 102.4892       14.00294 110.1552       9.016539 90.57776 6.384887 94.63772 3.918139 -4.059959      7.491235 
1 1 1 -15 16 30 o 62.03312 3.329748 47.33168       5.015066 55.38469       8.473650 42.99015       6.221753 66.67354 5.257843 58.90781 4.365166 7.765732       6.833709 
1 1 1 -15 16 31 o 111.4223 4.027331 153.2172       10.91719 0.000000       0.000000 153.2172       10.91719 ?        ?        111.4223 4.027331 0.000000       4.027331 
1 1 1 -15 16 32 o 93.77306 3.085030 108.1254       7.040153 105.6281       11.00348 109.8562       9.160521 92.03837 4.923894 94.23196 3.998287 -2.193596      6.342793 
1 1 1 -15 16 33 o 55.08712 4.167830 37.84234       5.553440 42.92765       8.110894 33.35442       7.619608 58.09136 5.807316 50.95956 6.267671 7.131794       8.544508 
1 1 1 -15 16 34 o 52.14525 3.709465 33.86311       4.682925 34.77061       7.625268 33.31358       5.933740 51.89495 6.149026 51.34903 4.797517 0.5459251      7.799147 
1 1 1 -15 16 35 o 20.83810 6.514433 5.652798       3.672089 6.921262       5.737407 4.772660       4.779167 23.40355 8.175190 20.35132 7.421299 3.052235       11.04126 
1 1 1 -15 16 36 o 35.08992 4.968277 15.95148       4.129713 18.89394       6.446527 13.90349       5.378170 37.03645 7.401686 31.78686 7.120220 5.249594       10.27047 
1 1 1 -15 16 37 o 20.37219 6.530360 5.544425       3.669612 3.593582       5.584505 7.026886       4.868164 19.42503 7.776772 22.70264 7.537915 -3.277605      10.83044 
1 1 1 -15 16 38 o 13.30519 6.276601 -4.489804      5.302851 -2.044158      7.085146 -7.604614      7.995909 16.89425 7.718001 15.56559 7.445831 1.328660       10.72418 
1 1 1 -15 16 39 o 21.93852 6.808228 6.913363       4.018759 1.313523       5.956804 11.59134       5.444458 17.39081 7.555770 27.68084 7.760308 -10.29003      10.83107 
1 1 1 -15 16 40 f 22.44907 6.748797 7.414976       3.989934 2.754226       6.124146 10.85232       5.259316 18.32786 7.807016 26.49681 7.693098 -8.168957      10.96053 
1 1 1 -15 16 41 o 38.26816 6.161835 21.05427       5.551163 9.834714       7.039284 39.50716       9.027609 24.15132 8.972170 50.87213 7.507426 -26.72081      11.69877 
1 1 1 -15 16 42 o 33.53460 6.697214 17.12324       5.281275 7.569911       6.567442 34.60817       8.884863 21.49670 8.489321 45.76688 8.270753 -24.27018      11.85217 
1 1 1 -15 16 43 o 22.15435 7.211584 8.185966       4.464342 7.187479       8.448631 8.572760       5.258420 20.71429 8.999070 22.16621 7.819960 -1.451925      11.92204 
1 1 1 -15 16 44 o 11.98792 5.505072 -0.9352941     3.667701 3.515540       5.922593 -3.703968      4.671185 17.22083 7.507281 11.84345 5.672241 5.377384       9.409228 
1 1 1 -15 17 1  o 131.2620 4.397609 210.7955       14.04683 229.7537       19.39182 189.8659       20.37507 136.8377 5.828711 124.2137 6.756651 12.62398       8.923351 
1 1 1 -15 17 2  o 73.88486 2.839699 66.69414       5.103341 73.99454       10.36514 64.35813       5.863255 77.55564 5.520449 72.54050 3.325670 5.015144       6.444799 
1 1 1 -15 17 3  o 164.3435 3.233731 329.6043       12.95068 283.6589       24.22629 347.9871       15.32401 151.9505 6.558016 168.8210 3.724858 -16.87053      7.542025 
1 1 1 -15 17 4  o 232.6712 3.587834 660.8790       20.34282 629.2711       32.08561 682.1251       26.30585 226.6139 5.814960 236.2414 4.569412 -9.627502      7.395491 
1 1 1 -15 17 5  o 101.9508 2.637489 126.8596       6.547152 123.3580       11.30357 128.6275       8.031565 100.3538 4.634679 102.6171 3.215738 -2.263283      5.641030 
1 1 1 -15 17 6  o 64.09471 2.846125 50.21373       4.434328 45.77749       7.829164 52.30899       5.380550 60.93775 5.325676 65.37888 3.388737 -4.441124      6.312398 
1 1 1 -15 17 7  o 218.2588 3.853747 581.7068       20.49704 508.4338       40.48028 606.9703       23.76936 203.1061 8.195534 222.8771 4.376390 -19.77098      9.290833 
1 1 1 -15 17 8  o 143.6527 2.842833 251.7421       9.951792 247.5543       16.68962 254.0527       12.39679 142.2116 4.822854 144.2637 3.526273 -2.052170      5.974489 
1 1 1 -15 17 9  o 232.4513 4.523949 660.3980       25.62630 705.6286       47.13179 641.4146       30.53405 239.3403 8.092581 228.9231 5.473419 10.41722       9.769758 
1 1 1 -15 17 10 o 148.3012 3.537588 268.4872       12.78462 274.3043       23.45824 266.0295       15.24812 149.4309 6.457217 147.4983 4.246640 1.932556       7.728493 
1 1 1 -15 17 11 o 38.87635 4.469563 18.71377       4.157403 18.61092       8.201464 18.74934       4.822978 38.09325 8.982181 38.79927 5.234405 -0.7060204     10.39608 
1 1 1 -15 17 12 o 163.7323 3.364130 327.2335       13.42281 328.0848       19.58932 326.4799       18.42919 163.7050 4.916018 163.3467 4.634457 0.3583221      6.756140 
1 1 1 -15 17 13 o 229.0339 3.532075 640.4554       19.71360 639.5270       32.00582 641.0228       25.02377 228.4132 5.754634 228.9931 4.484295 -0.5799713     7.295527 
1 1 1 -15 17 14 o 175.3853 3.041051 375.3784       12.99730 374.8836       21.60032 375.6593       16.27288 174.9547 5.071741 175.3734 3.807717 -0.4187012     6.342024 
1 1 1 -15 17 15 o 254.4449 3.799008 790.8339       23.55592 783.4149       38.09576 795.4263       29.97261 252.7254 6.185739 254.9868 4.823594 -2.261414      7.844133 
1 1 1 -15 17 16 o 212.0397 3.369685 548.9473       17.41175 547.1999       28.52160 549.9854       21.98358 211.2615 5.544893 212.1114 4.253029 -0.8498993     6.988139 
1 1 1 -15 17 17 o 210.2217 3.360434 539.6099       17.21508 581.2628       29.49100 518.0803       21.20238 217.7147 5.563160 205.8587 4.226484 11.85596       6.986553 
1 1 1 -15 17 18 o 62.95790 3.708078 48.59195       5.663799 35.91810       12.52660 51.84867       6.349934 52.93681 10.07847 65.00605 4.028267 -12.06924      10.85369 
1 1 1 -15 17 19 o 63.51920 3.301789 49.40342       5.093273 56.00055       8.729261 45.99826       6.271470 67.38538 5.360025 61.18451 4.232298 6.200863       6.829511 
1 1 1 -15 17 20 o 83.56985 3.099732 85.39079       6.301684 73.06764       9.919601 93.72935       8.159788 77.02089 5.317698 87.48288 3.836872 -10.46199      6.557400 
1 1 1 -15 17 21 o 57.03497 3.506498 39.89872       4.850052 42.52216       8.228534 38.50209       6.003820 58.55778 5.844336 55.91047 4.443062 2.647312       7.341462 
1 1 1 -15 17 22 o 234.0906 4.060483 670.4752       23.16316 635.0137       32.75388 705.9532       32.76144 227.2101 5.920650 239.7528 5.607422 -12.54271      8.154586 
1 1 1 -15 17 23 o 118.5698 3.098518 171.8577       8.945237 161.9693       13.38964 179.8288       12.02160 114.8427 4.794968 121.1475 4.077848 -6.304825      6.294487 
1 1 1 -15 17 24 f 74.66087 4.023544 68.43661       7.293408 70.69559       9.479841 65.16005       11.41708 75.70329 5.169688 72.39198 6.542392 3.311310       8.338379 
1 1 1 -15 17 25 o 31.95690 5.195605 12.86817       3.907247 9.887627       7.085119 14.17076       4.683864 28.35427 9.072505 33.42021 5.970320 -5.065937      10.86071 
1 1 1 -15 17 26 o 111.2565 3.044611 151.4480       8.246789 166.6849       13.35751 142.0628       10.48333 116.3907 4.719247 107.5867 4.005560 8.804008       6.189976 
1 1 1 -15 17 27 o 14.23779 5.918914 0.6105567      3.386927 1.724739       6.399381 0.1770172      3.991850 19.88937 8.189534 14.91798 6.326796 4.971393       10.34876 
1 1 1 -15 17 28 o 16.19586 6.199301 2.253878       3.417723 -4.971930      6.415121 5.117639       4.038592 15.56762 7.196170 20.72338 6.865173 -5.155762      9.945625 
1 1 1 -15 17 29 o 85.76494 3.116254 90.24200       6.502138 87.16266       10.30365 92.27976       8.381845 83.81519 5.068350 86.54234 3.985128 -2.727150      6.447435 
1 1 1 -15 17 30 o 24.46578 6.643626 7.763147       4.062245 9.368126       10.52904 7.482462       4.403151 29.33327 10.95821 24.11962 7.049514 5.213652       13.02989 
1 1 1 -15 17 31 o 80.06747 3.164999 78.86442       6.163243 72.24700       9.952344 82.98089       7.849527 75.92923 5.414264 81.92029 3.943605 -5.991058      6.698229 
1 1 1 -15 17 32 o 17.55451 6.416218 3.258797       3.575357 -3.332161      6.277778 6.422967       4.349723 16.01216 7.295794 22.46577 7.099400 -6.453606      10.17989 
1 1 1 -15 17 33 o 22.62366 6.770696 6.682660       4.022638 11.83492       8.119556 5.006693       4.630906 29.66775 9.729963 20.69746 7.335151 8.970293       12.18510 
1 1 1 -15 17 34 o 14.38477 6.012692 0.7625835      3.523026 4.271544       6.000266 -1.083515      4.352199 20.95944 8.162599 14.19982 6.302895 6.759624       10.31283 
1 1 1 -15 17 35 o 48.92761 4.059315 30.18232       4.796445 34.63774       7.578723 27.20534       6.194977 51.36177 6.179039 45.70778 5.684239 5.653984       8.395898 
1 1 1 -15 17 36 o 27.48593 5.856026 10.17669       3.802246 8.661968       6.120484 11.12866       4.852119 25.01144 8.454123 28.26938 7.063866 -3.257936      11.01682 
1 1 1 -15 17 37 o 12.75779 5.681440 -0.7923235     3.565806 -1.719912      5.651930 -0.1789763     4.595919 15.38661 6.976065 14.92703 6.557461 0.4595804      9.574225 
1 1 1 -15 17 38 o 30.41711 8.244645 14.10921       6.262805 18.32823       8.603972 9.354765       9.133627 33.29992 9.886756 25.26783 10.00111 8.032091       14.06308 
1 1 1 -15 17 39 o 11.33774 5.289242 -2.549034      3.590130 -2.379256      5.546640 -2.671447      4.709804 14.50345 6.699685 13.15085 6.109078 1.352597       9.066786 
1 1 1 -15 17 40 f 48.45059 4.267785 30.90021       4.987471 30.74332       7.631004 31.01720       6.589709 45.54805 7.106996 47.05058 5.874988 -1.502529      9.220893 
1 1 1 -15 17 41 o 12.90529 5.977788 -1.931614      4.460566 -5.569536      5.905749 2.899933       6.805990 13.09939 6.300852 18.34430 8.021353 -5.244911      10.20014 
1 1 1 -15 17 42 o 18.62175 7.548605 4.884319       5.333337 11.29290       8.360144 0.4862593      6.925697 23.88420 9.530846 16.61108 7.604496 7.273125       12.19284 
1 1 1 -15 17 43 o 13.40309 5.919335 0.6031736      3.791643 2.529872       6.280314 -0.5018904     4.756288 16.95003 7.544697 13.75991 6.300247 3.190114       9.829321 
1 1 1 -15 17 44 o 20.98714 6.872746 7.465229       4.051733 5.139400       6.435838 8.992300       5.214899 18.37089 7.917436 22.05120 7.786811 -3.680309      11.10496 
1 1 1 -15 18 1  o 115.9065 2.879493 163.9158       8.133173 181.2992       16.43292 158.2762       9.359966 121.5439 5.562865 113.8158 3.378443 7.728065       6.508406 
1 1 1 -15 18 2  o 156.4330 3.170330 298.6590       12.08562 282.4930       23.19944 304.6802       14.15856 151.6475 6.291447 157.9572 3.678270 -6.309662      7.287796 
1 1 1 -15 18 3  f 143.0013 3.487863 249.6536       12.15446 258.7445       21.76538 245.5340       14.65185 145.1512 6.167376 141.6864 4.248338 3.464813       7.488985 
1 1 1 -15 18 4  o 42.88293 4.046386 22.66334       4.178521 11.20474       7.933376 27.06251       4.915616 30.31563 9.588813 46.85722 4.354763 -16.54159      10.53135 
1 1 1 -15 18 5  o 185.3643 3.936619 419.6891       17.78220 402.8904       30.94157 427.9737       21.72901 180.9975 7.028458 187.0169 4.771752 -6.019440      8.495224 
1 1 1 -15 18 6  o 100.9708 3.275841 124.5638       8.049695 116.3989       14.63477 128.1056       9.638750 97.24817 6.207859 102.3425 3.871794 -5.094376      7.316304 
1 1 1 -15 18 7  o 102.1310 3.901231 127.5857       9.691617 0.000000       0.000000 127.5857       9.691617 ?        ?        102.1310 3.901231 0.000000       3.901231 
1 1 1 -15 18 8  o 79.67345 3.322887 77.61634       6.437407 78.14941       12.30828 77.41561       7.552772 79.57323 6.401349 79.51678 3.909714 0.5645752E-01  7.500875 
1 1 1 -15 18 9  f 100.5413 2.703132 123.4020       6.616888 116.8144       11.25896 126.8778       8.178294 97.62179 4.747002 101.9016 3.297750 -4.279861      5.780067 
1 1 1 -15 18 10 o 106.8327 2.694561 139.3178       7.009410 144.6606       12.21170 136.6926       8.559948 108.6737 4.621770 105.7700 3.325158 2.903648       5.693631 
1 1 1 -15 18 11 o 141.9967 3.230288 246.1055       11.17778 243.3369       16.31336 248.5555       15.34645 140.9731 4.755468 142.5251 4.423914 -1.551987      6.495036 
1 1 1 -15 18 12 o 113.0117 2.693265 155.8095       7.417179 153.2028       12.70072 157.1587       9.137201 111.8264 4.670951 113.4160 3.309539 -1.589607      5.724581 
1 1 1 -15 18 13 o 217.0958 3.439669 575.4553       18.19718 592.2312       30.24891 565.9407       22.78032 219.7785 5.652610 215.1606 4.344712 4.617844       7.129413 
1 1 1 -15 18 14 o 185.8167 3.155764 421.4608       14.28977 402.3824       23.22233 433.0872       18.12831 181.1966 5.264781 188.2661 3.951382 -7.069458      6.582655 
1 1 1 -15 18 15 o 36.98132 4.144639 16.92443       3.670939 17.69463       7.261219 16.65999       4.254707 37.16243 8.234792 36.57502 4.896534 0.5874023      9.580598 
1 1 1 -15 18 16 o 264.1218 3.914736 852.4974       25.19665 833.2294       40.38098 864.7823       32.24363 260.4925 6.361295 265.7770 4.978407 -5.284485      8.077785 
1 1 1 -15 18 17 o 85.46192 2.756094 89.22112       5.732375 79.73820       10.23945 93.54986       6.918095 80.50455 5.248001 87.46955 3.251247 -6.964996      6.173501 
1 1 1 -15 18 18 o 104.7246 3.417760 134.1016       8.710526 135.5369       17.52910 133.6309       10.03751 104.7215 6.907483 104.4789 3.949516 0.2425690      7.956883 
1 1 1 -15 18 19 o 68.41396 3.300833 57.30033       5.486823 63.61374       9.145892 53.75047       6.858028 71.84438 5.260388 66.14627 4.277527 5.698112       6.780038 
1 1 1 -15 18 20 o 41.71920 4.252330 21.51644       4.262764 30.58391       7.792442 17.64422       5.092253 49.41330 6.639172 37.48243 5.758967 11.93087       8.788874 
1 1 1 -15 18 21 o 198.5786 3.682896 482.1402       17.82207 466.8172       26.04414 495.6344       24.44063 194.9118 5.488686 201.0489 4.988554 -6.137039      7.416963 
1 1 1 -15 18 22 o 35.76778 8.677724 16.52719       7.485592 16.52719       7.485592 0.000000       0.000000 35.76778 8.677724 ?        ?        0.000000       8.677724 
1 1 1 -15 18 23 o 80.04066 4.050682 78.63752       7.875184 81.84988       10.25108 74.01147       12.30163 81.47449 5.190100 77.16844 6.605096 4.306046       8.400264 
1 1 1 -15 18 24 o 16.50637 6.260616 2.403261       3.465563 2.947337       6.692008 2.203876       4.051103 21.31697 8.520191 17.12770 6.696445 4.189270       10.83679 
1 1 1 -15 18 25 o 101.0601 3.081213 124.9921       7.579316 131.3698       12.28652 121.0742       9.629949 103.2667 4.896338 99.31399 3.987137 3.952667       6.314380 
1 1 1 -15 18 26 f 55.03669 3.515050 37.24636       4.689688 40.53905       8.043849 35.55082       5.772200 56.98268 5.876956 53.61332 4.458379 3.369366       7.376704 
1 1 1 -15 18 27 f 42.13769 4.198658 22.02831       4.254071 16.15135       7.206186 25.17197       5.270433 35.12472 8.509580 44.93813 4.891625 -9.813412      9.815343 
1 1 1 -15 18 28 o 48.75714 4.065332 29.43139       4.786344 28.12234       10.29624 29.79226       5.405962 46.14136 9.474457 48.95302 4.585015 -2.811661      10.52557 
1 1 1 -15 18 29 o 18.35106 6.591197 3.623372       3.751553 6.840241       10.32210 3.133766       4.026937 27.37631 10.69325 18.05050 6.770010 9.325806       12.65617 
1 1 1 -15 18 30 o 56.55398 4.050426 39.66385       5.545167 32.86799       12.81928 41.22814       6.150343 48.84184 11.03191 57.56994 4.417723 -8.728104      11.88357 
1 1 1 -15 18 31 o 55.62494 3.693645 38.34217       4.978446 42.95002       8.417487 35.86317       6.174063 58.11213 6.031636 53.48270 4.787792 4.629429       7.700882 
1 1 1 -15 18 32 o 84.44936 3.685085 88.37422       7.565423 84.63056       10.32535 92.71371       11.11667 81.96379 5.196225 85.71996 5.348427 -3.756172      7.456971 
1 1 1 -15 18 33 o 25.32777 7.709730 8.576690       5.184278 12.05935       6.639351 3.136024       8.298431 29.58358 8.659235 22.27279 9.262483 7.310797       12.67975 
1 1 1 -15 18 34 o 72.15079 3.641689 64.93867       6.382246 74.26245       12.38581 61.56804       7.447041 75.04188 6.848451 69.87882 4.395494 5.163055       8.137669 
1 1 1 -15 18 35 o 36.93076 4.908398 17.65760       4.308098 20.53347       7.107100 15.98707       5.416698 38.26448 7.884261 34.26659 6.727002 3.997890       10.36408 
1 1 1 -15 18 36 o 22.70926 6.701787 7.133297       3.963139 10.51309       6.260606 4.873294       5.119482 26.85527 8.521071 20.24637 7.624867 6.608894       11.43448 
1 1 1 -15 18 37 o 24.85480 8.558112 9.109525       6.277141 17.42458       8.878558 0.7994900      8.875877 32.55313 10.12230 20.02862 8.938615 12.52451       13.50406 
1 1 1 -15 18 38 o 26.04774 6.481288 9.746350       4.097391 10.35502       6.419501 9.327914       5.322598 25.74845 8.658099 24.83756 7.853870 0.9108849      11.68957 
1 1 1 -15 18 39 f 16.49383 6.573319 2.869633       3.971617 2.126673       6.298039 3.360152       5.117413 17.99375 7.793686 17.97753 7.354107 0.1621437E-01  10.71562 
1 1 1 -15 18 40 o 39.80158 5.124428 21.76291       4.855086 16.76254       7.194879 25.94347       6.578681 31.14011 8.985206 41.98959 6.650597 -10.84948      11.17875 
1 1 1 -15 18 41 o 20.73630 7.419105 6.796146       4.748212 -1.800775      5.860899 23.21532       8.099690 14.61834 6.798965 35.89643 9.213546 -21.27809      11.45056 
1 1 1 -15 18 42 o 25.67022 7.334624 11.03350       4.816785 8.704660       8.952912 11.98221       5.714292 21.66430 9.337532 25.84126 8.133325 -4.176956      12.38307 
1 1 1 -15 18 43 o 43.55959 4.702117 26.63980       4.912295 25.31815       7.774864 27.51793       6.337488 36.80664 8.789655 42.12104 6.373220 -5.314400      10.85707 
1 1 1 -15 19 1  o 107.9018 2.787797 142.1539       7.324227 132.1079       10.09582 153.3159       10.64177 103.9012 3.994797 111.9522 3.906710 -8.051018      5.587556 
1 1 1 -15 19 2  o 117.8015 3.298872 169.5436       9.460731 167.6194       16.34844 170.5125       11.60050 116.8075 5.761180 118.0587 4.038147 -1.251221      7.035469 
1 1 1 -15 19 3  o 79.16767 2.964649 76.59017       5.709385 78.05831       11.42769 76.10181       6.590916 79.57862 5.935611 78.87474 3.437286 0.7038803      6.859039 
1 1 1 -15 19 4  o 54.00669 3.293074 35.73680       4.313361 44.92587       9.095098 33.07031       4.899378 60.19521 6.293126 51.88365 3.903652 8.311565       7.405534 
1 1 1 -15 19 5  o 135.6126 2.841522 224.3928       9.390465 217.5849       15.60469 228.2578       11.75766 133.2812 4.812421 136.6784 3.533044 -3.397232      5.970075 
1 1 1 -15 19 6  o 115.1184 3.116947 161.8591       8.735957 142.0965       20.37045 166.3129       9.670370 107.1459 7.856313 116.6659 3.405086 -9.520004      8.562491 
1 1 1 -15 19 7  o 238.8694 3.680622 696.8539       21.42486 679.9839       34.32982 707.6163       27.42019 235.4337 5.988520 240.5343 4.677968 -5.100647      7.599062 
1 1 1 -15 19 8  o 71.99232 2.900431 63.34518       5.078026 53.27358       8.834877 68.31393       6.205468 65.71452 5.569405 74.72417 3.416868 -9.009659      6.534008 
1 1 1 -15 19 9  o 84.79581 2.780794 87.82295       5.738410 97.43990       10.36248 83.56946       6.891569 89.12025 4.789049 82.66144 3.428648 6.458817       5.889874 
1 1 1 -15 19 10 o 49.53329 3.440540 30.10146       4.127169 32.14990       7.754795 29.29196       4.874917 50.78977 6.407875 48.78315 4.139789 2.006615       7.628808 
1 1 1 -15 19 11 o 46.77893 4.284379 26.97299       4.829806 18.83321       7.533975 32.65219       6.293051 38.35610 8.301629 51.39898 5.091063 -13.04288      9.738376 
1 1 1 -15 19 12 o 126.9054 2.780743 196.5096       8.599574 192.1387       14.53743 198.8624       10.66587 125.2233 4.772675 127.5693 3.434069 -2.346016      5.879732 
1 1 1 -15 19 13 o 234.3955 3.623118 671.0843       20.69511 670.2548       33.70582 671.5862       26.21918 233.6954 5.923369 234.3080 4.591937 -0.6125336     7.494811 
1 1 1 -15 19 14 o 175.8936 3.098015 377.6706       13.27913 419.1481       23.17764 357.4030       16.20185 184.9281 5.148173 171.0176 3.887654 13.91046       6.451166 
1 1 1 -15 19 15 o 44.43473 3.628765 24.28084       3.895133 14.36847       7.423898 28.04605       4.575496 33.48875 8.932695 47.73802 3.968993 -14.24927      9.774761 
1 1 1 -15 19 16 o 134.9732 2.809362 222.3404       9.240411 228.1348       16.03579 219.4599       11.30626 136.4162 4.831417 133.9939 3.465472 2.422302       5.945762 
1 1 1 -15 19 17 o 176.8757 3.430187 382.1767       14.78503 437.3874       34.12098 369.4141       16.40513 188.1771 7.455537 173.8357 3.872618 14.34140       8.401321 
1 1 1 -15 19 18 o 101.3271 2.728542 125.4063       6.731271 139.9121       12.61538 119.6327       7.958922 106.7571 4.861932 98.90807 3.306720 7.848991       5.879863 
1 1 1 -15 19 19 o 33.48032 4.477946 13.96600       3.561934 14.69799       7.387076 13.74426       4.065812 33.79222 8.862680 33.08155 5.216017 0.7106667      10.28367 
1 1 1 -15 19 20 f 110.6196 3.123610 149.5945       8.411819 151.2806       13.45789 148.5134       10.77628 110.9572 4.989970 110.0983 4.023305 0.8589630      6.409897 
1 1 1 -15 19 21 o 43.12236 5.672242 23.24098       5.816254 30.38404       8.108665 15.67114       8.347380 49.13992 6.966458 34.86413 9.546739 14.27579       11.81828 
1 1 1 -15 19 22 o 105.1977 4.959251 136.1440       12.67751 136.1440       12.67751 0.000000       0.000000 105.1977 4.959251 ?        ?        0.000000       4.959251 
1 1 1 -15 19 23 o 72.32761 3.310032 64.10743       5.818614 74.31840       10.05314 58.96373       7.135203 77.54714 5.352697 69.22691 4.250047 8.320236       6.834784 
1 1 1 -15 19 24 o 13.10899 5.698788 -0.5446458     3.392730 -2.279852      6.685868 0.5713646E-01  3.937332 17.53355 7.795652 14.72265 6.265190 2.810903       10.00124 
1 1 1 -15 19 25 o 32.13728 5.034636 13.01353       3.813503 28.42611       7.471590 7.583965       4.434632 47.42860 6.646730 24.42076 7.056509 23.00784       9.693984 
1 1 1 -15 19 26 o 38.34343 4.430185 18.31615       4.063466 19.68880       7.260232 17.69003       4.903403 38.95824 7.917667 37.44224 5.541102 1.516003       9.664019 
1 1 1 -15 19 27 o 19.86240 6.377765 4.813519       3.499052 -0.3340546     6.611520 6.816250       4.123931 18.56747 8.013608 23.15201 6.837413 -4.584538      10.53414 
1 1 1 -15 19 28 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -15 19 29 o 23.58319 6.388244 7.222256       3.761418 19.73237       11.04969 5.582603       4.000328 37.95883 11.18734 21.22057 6.819846 16.73826       13.10217 
1 1 1 -15 19 30 o 75.42158 3.246197 70.09923       5.952351 78.77864       10.10361 65.48550       7.366432 79.25665 5.261019 72.62232 4.180130 6.634331       6.719509 
1 1 1 -15 19 31 o 78.34125 3.242164 75.75594       6.176209 85.15723       10.32625 70.51956       7.706625 82.26632 5.177167 75.24327 4.219919 7.023048       6.679130 
1 1 1 -15 19 32 o 51.26522 5.334780 33.51268       6.567254 28.54440       7.951841 44.17162       11.64720 46.40120 7.271039 57.06247 8.646548 -10.66127      11.29738 
1 1 1 -15 19 33 o 32.07418 5.559380 13.45061       4.187894 21.96438       7.247448 9.182790       5.131297 40.15144 7.686962 25.97190 7.615436 14.17953       10.82055 
1 1 1 -15 19 34 o 27.61968 6.014459 10.24976       3.933130 13.45435       6.642325 8.519508       4.880774 30.65095 8.563862 24.88360 7.460545 5.767357       11.35779 
1 1 1 -15 19 35 o 68.08260 3.533745 58.19219       5.842767 50.69631       8.943242 63.77407       7.717453 61.84038 6.010256 70.64036 4.506670 -8.799976      7.512207 
1 1 1 -15 19 36 o 49.25790 6.200415 32.95241       7.278205 26.33194       9.988158 40.44748       10.62744 40.55572 10.13545 52.30482 8.639122 -11.74911      13.31772 
1 1 1 -15 19 37 o 27.78477 8.469225 11.97725       6.253154 13.09237       9.232555 11.03219       8.499453 28.01824 10.29910 26.36218 9.846109 1.656052       14.24841 
1 1 1 -15 19 38 o 26.54628 6.425837 10.18446       4.111805 11.46073       6.713881 9.418450       5.201379 26.59840 8.852898 24.80370 7.753022 1.794703       11.76789 
1 1 1 -15 19 39 o 18.57778 6.902356 4.671177       4.166297 -2.104443      6.411793 9.622601       5.481129 15.45266 7.160949 24.55227 7.990640 -9.099609      10.72984 
1 1 1 -15 19 40 o 28.69532 6.504746 12.39435       4.443240 7.517661       6.711503 16.19950       5.928475 21.68331 8.575995 31.67069 7.746612 -9.987377      11.55672 
1 1 1 -15 19 41 o 31.93274 6.840566 15.96407       5.162813 26.16460       10.08147 12.33796       6.010816 34.64328 10.78845 26.22037 8.352823 8.422913       13.64406 
1 1 1 -15 19 42 o 13.48005 6.009784 0.3741023      4.001378 -9.150612      6.286435 6.861211       5.188048 11.96661 5.911595 20.13000 7.654201 -8.163385      9.671285 
1 1 1 -15 19 43 o 13.00350 5.854177 0.1097730      3.898787 -4.925053      6.208580 3.387950       5.009753 13.08503 6.334797 16.55202 7.056156 -3.466995      9.482562 
1 1 1 -15 20 1  o 168.9608 2.972905 348.4346       12.24061 331.5387       18.67894 361.1516       16.20512 164.5430 4.663104 171.9147 3.868148 -7.371765      6.058639 
1 1 1 -15 20 2  o 53.82073 3.321641 35.50243       4.335279 37.08337       8.567027 34.95823       5.026361 54.55896 6.576053 53.34607 3.893279 1.212891       7.642126 
1 1 1 -15 20 3  o 146.2202 3.162019 260.9996       11.26699 253.9056       22.09487 263.4925       13.09793 143.6778 6.326038 146.8699 3.659601 -3.192139      7.308313 
1 1 1 -15 20 4  o 126.3237 3.053019 194.7748       9.398328 209.4501       19.27886 190.2000       10.76400 130.5216 6.077951 124.7437 3.544536 5.777893       7.035995 
1 1 1 -15 20 5  o 90.28548 2.773745 99.55688       6.095442 109.1432       10.68622 94.93369       7.421106 94.34001 4.662728 88.10289 3.463293 6.237122       5.808221 
1 1 1 -15 20 6  o 136.9131 3.236718 228.8447       10.79906 205.3842       24.33876 234.5954       12.05015 128.8808 7.785823 138.5477 3.572066 -9.666946      8.566136 
1 1 1 -15 20 7  o 183.4256 3.195481 410.7244       14.28343 415.9735       23.71145 407.7348       17.89442 184.2161 5.287420 182.6560 4.020201 1.560181       6.642200 
1 1 1 -15 20 8  o 59.30220 3.177004 43.05296       4.574426 41.57321       8.180960 43.72606       5.517585 57.93434 5.875895 59.70390 3.812283 -1.769562      7.004259 
1 1 1 -15 20 9  o 93.21448 2.795084 106.1210       6.341960 105.6659       11.09584 106.3419       7.728830 92.78348 4.925064 93.25805 3.406605 -0.4745712     5.988423 
1 1 1 -15 20 10 o 133.7963 3.300405 218.5731       10.76087 213.4132       15.90751 222.9264       14.61132 131.9442 4.956197 134.9352 4.449614 -2.991058      6.660552 
1 1 1 -15 20 11 o 173.1076 3.101403 365.8049       13.08309 375.1251       22.07284 360.7572       16.24409 174.9309 5.183640 171.8185 3.879622 3.112381       6.474688 
1 1 1 -15 20 12 o 42.61608 3.882457 22.37746       3.987736 19.00264       7.730841 23.60095       4.654786 38.48505 8.473060 43.70395 4.431824 -5.218895      9.562102 
1 1 1 -15 20 13 o 142.9342 2.901748 249.3612       10.10722 238.0077       16.81543 255.7831       12.64671 139.3244 4.960648 144.6971 3.586590 -5.372711      6.121409 
1 1 1 -15 20 14 o 83.44258 2.838414 85.07868       5.763242 78.53966       10.12679 88.21112       7.009005 79.88728 5.230623 84.91534 3.393985 -5.028061      6.235267 
1 1 1 -15 20 15 o 53.36431 3.366292 34.92214       4.355320 27.78495       8.133011 37.79184       5.157106 46.93219 7.352480 55.47104 3.838758 -8.538845      8.294276 
1 1 1 -15 20 16 o 44.84446 3.702175 24.74620       4.009767 25.84752       7.883909 24.36190       4.657093 45.20678 7.413249 44.40733 4.359655 0.7994461      8.600166 
1 1 1 -15 20 17 o 135.3865 3.109808 223.8606       10.25995 251.8205       23.60149 217.3456       11.39276 142.8036 6.801650 133.3133 3.509919 9.490295       7.653886 
1 1 1 -15 20 18 o 123.3331 2.813265 185.7123       8.455246 196.5407       15.00620 180.6755       10.23452 126.5305 4.875879 121.5377 3.459092 4.992813       5.978253 
1 1 1 -15 20 19 o 86.62276 3.287031 91.82129       6.926013 99.09023       11.14252 87.24449       8.841558 89.72370 5.117347 84.29955 4.318342 5.424156       6.695918 
1 1 1 -15 20 20 o 40.21872 4.732212 20.10329       4.549320 26.34888       8.011333 17.13076       5.526890 45.57498 7.472152 36.76805 6.400831 8.806931       9.838886 
1 1 1 -15 20 21 o 51.18779 4.605507 32.39340       5.683507 35.08249       8.991711 30.60419       7.334497 52.77248 7.177838 49.44105 6.225312 3.331425       9.501361 
1 1 1 -15 20 22 o 71.66785 3.307405 62.95099       5.760702 68.61760       10.07158 60.19572       7.022928 74.44028 5.592953 69.96137 4.137783 4.478912       6.957181 
1 1 1 -15 20 23 o 119.2818 3.132032 174.1292       9.096209 182.3311       14.57259 168.8936       11.64293 121.6700 4.925107 117.2932 4.079577 4.376801       6.395282 
1 1 1 -15 20 24 o 76.56401 3.248294 71.87616       6.046836 78.71860       10.56341 68.54126       7.374623 79.68712 5.472994 74.62881 4.070469 5.058311       6.820732 
1 1 1 -15 20 25 o 43.84940 4.090343 23.81885       4.320364 22.49051       7.861238 24.39368       5.171349 41.66334 8.034039 44.22932 4.878946 -2.565975      9.399463 
1 1 1 -15 20 26 o 64.94547 3.370141 51.85801       5.315508 55.88356       9.143728 49.80320       6.532763 66.89601 5.662150 63.47362 4.247905 3.422390       7.078463 
1 1 1 -15 20 27 f 42.48951 5.057532 22.66459       5.134032 0.000000       0.000000 22.66459       5.134032 ?        ?        42.48951 5.057532 0.000000       5.057532 
1 1 1 -15 20 28 o 56.29282 4.022221 39.27811       5.481305 23.27603       13.14539 42.64592       6.030584 40.90328 12.23910 58.61122 4.251131 -17.70794      12.95638 
1 1 1 -15 20 29 o 53.32664 3.696162 35.23497       4.773486 37.18739       8.659332 34.38268       5.721285 53.78889 6.754844 52.45950 4.519433 1.329395       8.127312 
1 1 1 -15 20 30 o 47.28484 4.008716 27.89520       4.575673 37.19302       8.459280 24.04976       5.440214 53.67286 6.606851 43.51354 5.235507 10.15932       8.429770 
1 1 1 -15 20 31 o 139.0702 5.145875 243.8027       17.40924 243.8027       17.40924 0.000000       0.000000 139.0702 5.145875 ?        ?        0.000000       5.145875 
1 1 1 -15 20 32 o 41.49444 4.353378 21.78563       4.336556 24.36706       7.551460 20.51542       5.297089 42.44931 7.578083 39.77204 5.621996 2.677277       9.435793 
1 1 1 -15 20 33 o 26.84587 6.242183 9.726179       4.006110 6.084672       6.726192 11.72812       4.987175 22.91807 8.715074 29.20882 7.080938 -6.290749      11.22908 
1 1 1 -15 20 34 o 64.93304 3.563536 52.90940       5.617135 47.42860       9.021072 56.38000       7.178576 59.66967 6.298898 66.49960 4.455499 -6.829926      7.715412 
1 1 1 -15 20 35 o 53.74218 3.882603 36.71910       5.050525 33.63298       8.087642 38.69192       6.466366 49.29276 6.923491 54.50204 4.921659 -5.209290      8.494555 
1 1 1 -15 20 36 o 46.55720 5.433278 29.06025       6.048573 32.23769       7.727823 24.03529       9.718171 47.88380 6.814810 37.94472 10.26394 9.939075       12.32032 
1 1 1 -15 20 37 o 16.36390 6.819053 2.051870       4.510928 7.255125       9.100813 0.3571754      5.193837 23.34160 9.702874 15.78926 6.952362 7.552341       11.93655 
1 1 1 -15 20 38 o 19.47182 6.914474 5.335204       4.116749 6.079159       6.806045 4.905981       5.169672 21.19380 8.550288 19.41411 7.572084 1.779694       11.42120 
1 1 1 -15 20 39 o 17.69753 6.709914 4.162115       3.979944 5.943761       6.459092 3.071647       5.053207 20.49949 8.308117 17.31126 7.215837 3.188223       11.00423 
1 1 1 -15 20 40 o 22.90639 7.537076 8.657883       4.870504 9.646883       6.765837 7.594127       7.016886 23.21347 8.760465 21.42261 8.667692 1.790867       12.32374 
1 1 1 -15 20 41 o 14.47745 6.379039 1.012662       4.379418 5.187079       8.848202 -0.3417715     5.040063 19.68467 8.844202 14.25607 6.511531 5.428597       10.98271 
1 1 1 -15 20 42 o 45.28466 4.555870 28.57115       4.959325 32.01521       8.053276 26.46718       6.294430 42.97575 7.983583 41.11281 6.498363 1.862938       10.29399 
1 1 1 -15 21 1  o 72.40829 3.950169 64.28194       6.943718 55.06436       10.13447 72.43774       9.532911 66.65418 6.314627 76.72310 5.128190 -10.06892      8.134669 
1 1 1 -15 21 2  o 61.20950 3.194070 45.87072       4.747818 46.30676       9.416628 45.72210       5.497771 61.05878 6.424817 61.05846 3.712461 0.3242493E-03  7.420285 
1 1 1 -15 21 3  o 138.8195 3.135956 235.2780       10.60857 221.5870       20.49210 240.2906       12.39944 134.1704 6.284956 140.1958 3.632429 -6.025360      7.259146 
1 1 1 -15 21 4  o 199.9474 3.676248 488.4570       17.91251 510.3120       36.58039 481.5636       20.54412 203.3974 7.392473 198.4405 4.248357 4.956940       8.526265 
1 1 1 -15 21 5  o 37.52966 4.550315 17.48244       4.076618 19.18430       8.163535 16.91705       4.705295 38.62355 8.861867 36.76738 5.413416 1.856167       10.38450 
1 1 1 -15 21 6  f 183.9732 3.236636 413.2688       14.51057 434.3675       24.59406 402.0023       17.97196 188.1885 5.368402 181.3375 4.066977 6.851074       6.734986 
1 1 1 -15 21 7  o 77.76987 2.965300 73.93143       5.609443 67.69479       9.696632 77.06833       6.876958 74.12505 5.405240 79.34910 3.565571 -5.224052      6.475331 
1 1 1 -15 21 8  o 68.52257 3.078032 57.43577       5.126638 61.48096       9.012118 55.50047       6.233495 70.64070 5.273277 67.28362 3.817435 3.357086       6.510013 
1 1 1 -15 21 9  o 166.6465 3.081212 339.0385       12.51278 351.2683       21.11814 332.4221       15.53301 169.2569 5.125947 164.9200 3.864972 4.336945       6.419762 
1 1 1 -15 21 10 o 137.2270 3.323324 229.9789       11.11344 223.7397       16.21912 235.5009       15.25839 135.0765 4.935626 138.6560 4.521839 -3.579514      6.693836 
1 1 1 -15 21 11 o 110.4518 2.808279 148.9913       7.552606 152.9993       13.22134 147.0499       9.201735 111.6710 4.870173 109.6647 3.447519 2.006325       5.966906 
1 1 1 -15 21 12 o 105.5418 2.815099 136.0555       7.233799 145.7208       12.77518 131.4940       8.776313 108.9774 4.822489 103.6890 3.478230 5.288361       5.945963 
1 1 1 -15 21 13 o 107.1976 2.819197 140.3634       7.358161 136.9943       12.68336 142.0726       9.033798 105.6302 4.941006 107.7832 3.443823 -2.153084      6.022745 
1 1 1 -15 21 14 o 196.5585 3.307693 471.9563       15.84357 472.2407       26.24802 471.7933       19.87204 196.1008 5.498067 196.3799 4.152495 -0.2791595     6.889989 
1 1 1 -15 21 15 o 114.2462 2.806831 159.3414       7.814371 179.3680       14.18055 150.6078       9.364541 120.8911 4.823200 110.9611 3.467471 9.929939       5.940254 
1 1 1 -15 21 16 o 203.8564 3.740518 508.1582       18.58199 483.5876       38.59253 515.5737       21.20142 197.4482 8.037530 205.2349 4.239138 -7.786667      9.086924 
1 1 1 -15 21 17 o 75.68322 3.482251 70.16285       6.405165 57.29270       10.03117 79.02238       8.322717 67.96850 6.121842 80.22675 4.272467 -12.25826      7.465315 
1 1 1 -15 21 18 o 257.8132 4.404297 814.2741       27.67056 823.9760       40.43423 805.7286       37.94814 258.5609 6.417268 255.8283 6.087036 2.732666       8.844961 
1 1 1 -15 21 19 o 127.8999 3.296801 200.1087       10.26684 191.1773       15.44877 207.1736       13.73999 124.6674 5.095902 129.9518 4.344894 -5.284363      6.696740 
1 1 1 -15 21 20 o 41.13508 3.952206 20.91129       3.913066 15.71227       8.181987 22.45310       4.455670 34.81668 9.417852 42.57648 4.355766 -7.759804      10.37635 
1 1 1 -15 21 21 o 16.24183 6.262209 2.153981       3.504962 -1.927191      7.380583 3.342374       3.982706 18.75261 8.271221 18.37797 6.762857 0.3746452      10.68407 
1 1 1 -15 21 22 o 56.84792 3.174256 39.65508       4.379903 38.03944       8.876379 40.17505       5.035625 54.98765 6.766760 57.15865 3.634043 -2.170998      7.680841 
1 1 1 -15 21 23 o 130.4332 3.242442 208.2595       10.30615 202.7901       16.22795 211.9568       13.34231 128.1380 5.207814 131.3208 4.174587 -3.182831      6.674467 
1 1 1 -15 21 24 o 77.27934 3.272843 73.28705       6.149506 76.47952       10.38676 71.56405       7.630612 78.45800 5.466785 76.20447 4.124434 2.253532       6.848116 
1 1 1 -15 21 25 o 38.11312 4.525558 18.15032       4.121266 19.64432       7.645905 17.53850       4.892899 38.69340 8.353773 37.22152 5.564878 1.471882       10.03760 
1 1 1 -15 21 26 o 84.13715 3.506281 87.10954       7.173280 84.18988       15.52944 87.90147       8.087815 81.08604 7.961655 84.41033 3.942767 -3.324295      8.884444 
1 1 1 -15 21 27 o 13.97403 6.070539 -0.4608787     3.844147 0.000000       0.000000 -0.4608787     3.844147 ?        ?        13.97403 6.070539 0.000000       6.070539 
1 1 1 -15 21 28 o 70.17296 3.390148 60.75534       5.780132 57.21419       9.877111 62.59968       7.128172 67.16251 6.101375 71.01873 4.136693 -3.856216      7.371499 
1 1 1 -15 21 29 o 58.76738 3.549761 42.78925       5.059899 46.14373       9.159385 41.31592       6.070222 59.97693 6.363804 57.49969 4.364751 2.477242       7.716804 
1 1 1 -15 21 30 o 11.32928 5.289378 -3.203187      3.601558 1.660209       6.884458 -5.035723      4.225967 19.86531 8.360806 11.53413 5.488284 8.331182       10.00122 
1 1 1 -15 21 31 o 15.03089 6.152436 1.289593       3.584361 -0.5805449     6.738568 2.027504       4.232849 18.03099 7.929977 16.76272 6.749894 1.268274       10.41372 
1 1 1 -15 21 32 o 60.94664 3.616368 46.44430       5.346894 49.68625       8.699389 44.47605       6.778374 61.81263 5.844723 59.09640 4.746720 2.716232       7.529418 
1 1 1 -15 21 33 o 39.50471 4.648491 20.09472       4.389487 16.32882       7.220123 22.30269       5.528504 33.43670 8.758334 41.13631 5.665294 -7.699604      10.43091 
1 1 1 -15 21 34 o 25.35027 6.340096 8.913814       3.906225 8.503929       6.224251 9.180148       5.017302 24.52538 8.518227 25.33427 7.556773 -0.8088970     11.38705 
1 1 1 -15 21 35 o 53.99531 4.911366 38.27705       6.391764 45.15825       8.310365 28.31059       10.00135 57.69773 5.997944 41.93064 9.940230 15.76709       11.60963 
1 1 1 -15 21 36 o 28.42774 6.914217 11.78666       4.743174 10.32031       10.00771 12.21147       5.386600 25.72530 10.37179 28.47463 7.615103 -2.749332      12.86716 
1 1 1 -15 21 37 o 53.31907 4.510929 37.51757       5.806230 46.43423       11.86079 34.70733       6.658629 53.14345 9.507650 50.34034 5.518241 2.803112       10.99302 
1 1 1 -15 21 38 o 13.53417 5.952897 0.1973665      3.798247 1.266985       6.479447 -0.3626109     4.688228 17.27961 7.679046 14.32878 6.437809 2.950830       10.02064 
1 1 1 -15 21 39 o 38.54936 5.856531 21.44691       5.328814 33.99461       11.64437 18.12299       5.993204 40.04932 11.39124 33.74035 7.484997 6.308964       13.63031 
1 1 1 -15 21 40 o 17.58697 6.942721 4.311180       4.390994 9.695870       9.381130 2.800498       4.968912 22.41254 9.607588 16.51340 7.033112 5.899141       11.90674 
1 1 1 -15 21 41 o 43.98577 4.621945 26.92693       4.880265 27.41521       7.672107 26.59509       6.324843 39.54875 8.228831 41.41325 6.479453 -1.864502      10.47363 
1 1 1 -15 22 1  o 194.4514 3.218197 461.8230       15.24965 441.9146       23.32393 476.6880       20.15416 189.8149 5.046854 197.3909 4.189878 -7.576019      6.559406 
1 1 1 -15 22 2  f 178.0247 4.189742 387.7109       18.17623 375.3878       29.31302 395.4088       23.16789 174.4415 6.909306 179.4907 5.302550 -5.049194      8.709509 
1 1 1 -15 22 3  o 104.6611 3.027979 133.8552       7.714674 139.9855       15.43367 131.8133       8.907308 106.5962 5.965230 103.8054 3.526316 2.790817       6.929565 
1 1 1 -15 22 4  o 95.24507 3.077366 110.8816       7.133247 130.1545       15.02962 105.2780       8.104169 102.7650 6.028069 92.75085 3.592331 10.01411       7.017298 
1 1 1 -15 22 5  o 178.7274 4.027515 390.6183       17.54141 0.000000       0.000000 390.6183       17.54141 ?        ?        178.7274 4.027515 0.000000       4.027515 
1 1 1 -15 22 6  o 79.64458 3.142073 77.57845       6.086331 67.99384       12.05070 80.86057       7.051841 74.02962 6.754226 81.27122 3.569358 -7.241600      7.639364 
1 1 1 -15 22 7  o 99.75069 2.871431 121.5609       6.972656 123.3783       12.18205 120.6755       8.503295 100.2250 5.003615 99.32011 3.518849 0.9048996      6.117064 
1 1 1 -15 22 8  o 108.0124 2.889395 142.5205       7.598471 133.6555       12.67364 147.4953       9.494079 104.3238 4.999746 109.8108 3.552578 -5.486992      6.133374 
1 1 1 -15 22 9  o 97.83357 3.404413 117.0708       8.104084 112.9212       12.01486 120.5346       10.97712 95.84135 5.163406 99.12350 4.556580 -3.282150      6.886449 
1 1 1 -15 22 10 o 99.83617 2.872428 121.7781       6.981061 125.4505       12.23461 120.0053       8.500751 101.0576 4.983413 99.03721 3.527907 2.020363       6.105778 
1 1 1 -15 22 11 o 147.3614 2.959642 265.1408       10.62818 290.2474       18.46437 252.7009       12.99721 153.8193 4.932301 143.7297 3.713912 10.08958       6.174199 
1 1 1 -15 22 12 o 58.17712 3.362577 41.49040       4.746856 38.53788       8.665617 42.75615       5.673835 55.58184 6.521708 58.99166 3.969960 -3.409817      7.635002 
1 1 1 -15 22 13 o 69.72802 3.085391 59.49804       5.229702 54.24344       9.444729 61.82148       6.280376 66.17405 5.919317 71.01987 3.641008 -4.845825      6.949479 
1 1 1 -15 22 14 o 146.1809 2.951608 260.9557       10.51442 269.3025       18.04237 256.6632       12.93856 148.1047 5.006261 144.8388 3.668720 3.265854       6.206622 
1 1 1 -15 22 15 o 178.9875 3.601549 391.7052       15.70899 382.8310       22.88634 399.6107       21.60105 176.5070 5.326911 180.4492 4.916873 -3.942108      7.249249 
1 1 1 -15 22 16 o 115.3037 3.671094 162.7682       10.30199 195.9977       21.47140 152.8308       11.74179 125.7699 7.033656 111.6203 4.324913 14.14960       8.256948 
1 1 1 -15 22 17 o 63.28172 3.836510 49.18812       5.888513 47.37138       9.621489 50.27614       7.445852 61.63114 6.504267 63.83384 4.822267 -2.202702      8.096897 
1 1 1 -15 22 18 o 42.12474 3.936778 21.91636       3.994431 24.92321       8.263806 20.99966       4.562879 44.13509 7.977046 41.11718 4.634500 3.017902       9.225609 
1 1 1 -15 22 19 o 92.55553 2.846595 104.7713       6.412799 96.75985       11.80999 108.1212       7.636702 88.48207 5.504455 93.95905 3.340587 -5.476974      6.438831 
1 1 1 -15 22 20 o 117.1459 3.173909 167.9697       9.052263 181.8938       14.81814 159.6796       11.43374 121.5027 5.015408 114.0381 4.121136 7.464622       6.491385 
1 1 1 -15 22 21 o 77.10828 2.943072 72.81233       5.520011 62.65128       10.39629 76.80154       6.514078 70.91384 6.074505 79.13184 3.385873 -8.217995      6.954405 
1 1 1 -15 22 22 o 101.3478 2.789573 125.6998       6.882957 134.4735       12.92707 122.2283       8.131419 104.3029 5.101372 99.84145 3.346830 4.461464       6.101252 
1 1 1 -15 22 23 o 91.52796 2.835240 102.6013       6.316197 92.29669       11.67469 106.8655       7.510233 86.15814 5.590678 93.32659 3.307494 -7.168449      6.495783 
1 1 1 -15 22 24 o 10.37014 4.924594 -4.112754      3.368762 -3.305277      7.054240 -4.351307      3.834222 17.35509 7.838329 11.23443 5.311014 6.120662       9.468171 
1 1 1 -15 22 25 o 10.91558 5.109286 -3.301978      3.396105 -4.886450      9.812626 -3.086360      3.619811 20.10796 9.146221 11.53925 5.358817 8.568706       10.60048 
1 1 1 -15 22 26 f 63.86039 4.246867 50.60451       6.571455 0.000000       0.000000 50.60451       6.571455 ?        ?        63.86039 4.246867 0.000000       4.246867 
1 1 1 -15 22 27 o 27.65227 5.701271 9.921548       3.714131 12.68058       7.195821 8.919571       4.336418 30.75203 9.018552 26.03592 6.771781 4.716106       11.27791 
1 1 1 -15 22 28 o 47.72271 4.054550 28.42694       4.670643 27.86427       8.599867 28.66235       5.562516 45.74618 8.005848 47.67876 4.855181 -1.932579      9.363032 
1 1 1 -15 22 29 o 45.70028 4.166742 26.19774       4.589375 30.80002       8.521341 24.31737       5.446826 48.16560 7.504402 43.66030 5.222920 4.505302       9.143027 
1 1 1 -15 22 30 o 61.74981 4.016552 47.73781       6.011211 54.10145       9.149196 42.90424       7.973775 64.80972 5.856163 57.72395 5.744724 7.085770       8.203444 
1 1 1 -15 22 31 o 18.20185 6.474586 3.910177       3.611017 -5.519997      6.765196 7.667283       4.270190 15.29625 7.176239 23.79296 6.938947 -8.496707      9.982354 
1 1 1 -15 22 32 o 37.49963 4.837946 18.19543       4.318125 25.00234       7.553860 14.89141       5.262790 42.45292 7.579861 32.97419 6.776178 9.478729       10.16715 
1 1 1 -15 22 33 o 31.39878 5.550128 13.20171       4.091409 8.290517       6.743124 16.06322       5.147133 24.47136 8.830639 34.23718 6.404610 -9.765825      10.90868 
1 1 1 -15 22 34 o 22.87899 7.660219 7.451184       5.025499 1.240046       6.096870 20.61532       8.876004 17.71195 7.669925 35.70833 9.870746 -17.99638      12.50037 
1 1 1 -15 22 35 o 10.43180 5.051828 -5.577805      3.956038 -5.230307      6.764826 -5.758408      4.876886 14.79796 7.013059 11.92787 5.734370 2.870087       9.059029 
1 1 1 -15 22 36 o 56.65362 5.295146 43.39255       7.225722 48.22794       12.12408 40.72896       8.998424 54.41168 9.488502 52.81536 7.177021 1.596321       11.89711 
1 1 1 -15 22 37 o 20.90195 6.894412 6.493094       4.074432 8.167703       6.857555 5.579368       5.065481 22.78322 8.765856 19.92645 7.566424 2.856777       11.57977 
1 1 1 -15 22 38 f 17.92425 6.597223 4.492008       3.790323 -2.698355      6.633262 7.977940       4.618608 15.11936 7.097270 22.41604 7.337623 -7.296679      10.20843 
1 1 1 -15 22 39 o 15.11864 6.768469 0.6248377      5.131725 -1.064144      9.122473 1.406744       6.206939 17.42442 8.223636 16.56192 7.426995 0.8624992      11.08099 
1 1 1 -15 22 40 o 28.75553 6.634604 13.07960       4.554582 9.393950       10.39886 13.95446       5.066386 21.83165 9.713511 29.11405 7.185357 -7.282394      12.08229 
1 1 1 -15 22 41 o 14.99102 6.270988 2.428465       3.836701 -3.482297      6.505328 5.581043       4.750949 13.98263 6.695988 18.59126 7.256709 -4.608626      9.874010 
1 1 1 -15 23 1  o 112.9435 2.699372 155.7245       7.429509 155.1775       11.44175 156.1233       9.769193 112.5187 4.180106 112.9539 3.553547 -0.4351807     5.486436 
1 1 1 -15 23 2  o 94.36010 2.668569 108.7737       6.130086 102.5619       9.224240 113.6870       8.203721 91.45110 4.149910 96.37978 3.498728 -4.928673      5.427969 
1 1 1 -15 23 3  o 97.99903 3.095539 117.4178       7.383276 112.3767       14.34913 119.2330       8.610602 95.37530 6.207543 98.69716 3.586042 -3.321861      7.168911 
1 1 1 -15 23 4  o 77.84879 3.236163 74.16409       6.125905 77.99774       12.28393 72.89509       7.067437 79.35073 6.407019 77.11857 3.772128 2.232162       7.434974 
1 1 1 -15 23 5  o 160.2887 3.898384 314.2378       15.22732 0.000000       0.000000 314.2378       15.22732 ?        ?        160.2887 3.898384 0.000000       3.898384 
1 1 1 -15 23 6  o 125.8460 3.182684 193.5793       9.752601 205.2257       20.09913 189.9929       11.15361 128.9649 6.415569 124.6080 3.677130 4.356972       7.394648 
1 1 1 -15 23 7  o 64.11271 3.457534 50.37843       5.381916 57.30676       11.65059 48.49891       6.068169 67.78316 7.161410 62.84065 3.983103 4.942505       8.194566 
1 1 1 -15 23 8  o 79.72380 3.047515 77.73726       5.909756 83.93773       10.57886 74.92442       7.125241 82.54294 5.287035 78.18891 3.750477 4.354027       6.482193 
1 1 1 -15 23 9  o 252.2583 4.386278 779.1495       26.96359 769.6079       38.40786 788.4220       37.86253 249.9807 6.309935 253.1642 6.137215 -3.183502      8.802311 
1 1 1 -15 23 10 o 44.35938 4.123544 24.28610       4.406467 19.33643       7.704926 26.69186       5.371634 38.76415 8.399572 46.42069 4.818540 -7.656540      9.683550 
1 1 1 -15 23 11 o 101.0782 2.922317 124.8695       7.190597 117.9879       12.05939 128.6658       8.957037 97.94559 5.069731 102.5251 3.590618 -4.579475      6.212464 
1 1 1 -15 23 12 o 95.87762 3.262197 112.4557       7.610804 118.4632       11.98779 108.3992       9.850756 98.14273 5.029162 93.98879 4.312372 4.153938       6.624879 
1 1 1 -15 23 13 o 181.8008 3.647524 404.2076       16.15958 389.8791       23.36394 417.3480       22.37436 178.0812 5.390041 184.3713 4.984478 -6.290115      7.341496 
1 1 1 -15 23 14 o 40.25787 5.120209 20.21095       4.909640 20.21304       7.784935 20.20958       6.326367 39.61866 8.328248 39.93636 6.740211 -0.3176994     10.71402 
1 1 1 -15 23 15 o 147.3549 3.313806 265.4680       11.89948 273.9268       26.88471 263.4072       13.27010 148.4878 7.453661 146.6715 3.715714 1.816269       8.328481 
1 1 1 -15 23 16 o 101.1827 2.876955 125.1828       7.086544 136.5945       12.80723 120.1472       8.507600 105.3321 5.003821 99.03648 3.530784 6.295631       6.124105 
1 1 1 -15 23 17 o 54.50046 3.474509 36.48941       4.590525 41.28611       8.710961 34.64515       5.401404 57.47931 6.323292 52.99496 4.217261 4.484356       7.600613 
1 1 1 -15 23 18 o 40.26041 4.184385 20.08904       4.045494 21.11663       8.039133 19.74057       4.681442 40.38418 8.441102 39.77395 4.935834 0.6102295      9.778275 
1 1 1 -15 23 19 o 20.79143 6.232813 5.409215       3.406728 9.758434       7.330589 4.211160       3.847438 28.24652 9.244081 19.34640 6.698368 8.900124       11.41583 
1 1 1 -15 23 20 o 32.22082 4.940052 13.07286       3.755343 26.89093       7.767951 8.858386       4.289971 45.94321 7.172489 26.20622 6.694271 19.73699       9.811109 
1 1 1 -15 23 21 o 39.83016 3.980546 19.67138       3.811890 26.64256       8.210040 17.75561       4.303914 45.53093 7.671941 37.66596 4.797721 7.864975       9.048580 
1 1 1 -15 23 22 o 81.23321 2.884713 80.87821       5.701411 97.47980       11.29624 75.20355       6.604325 88.61352 5.254750 78.22327 3.473287 10.39024       6.298899 
1 1 1 -15 23 23 o 107.8005 3.538273 142.8705       9.282384 161.0418       19.37403 137.4565       10.57518 112.9843 7.072115 105.5685 4.118616 7.415802       8.183997 
1 1 1 -15 23 24 o 26.85424 6.488410 9.400836       4.198236 17.53490       11.45979 8.139953       4.511908 36.19188 11.53378 25.04701 7.079530 11.14487       13.53321 
1 1 1 -15 23 25 o 64.72361 3.040509 51.53839       4.782220 50.53547       9.529738 51.87596       5.528759 63.11250 6.279481 64.83185 3.512596 -1.719353      7.195152 
1 1 1 -15 23 26 o 51.11330 3.944321 32.48282       4.874970 33.44485       8.996066 32.08287       5.800478 50.59744 7.524750 50.56579 4.763407 0.3165436E-01  8.905724 
1 1 1 -15 23 27 o 32.19358 7.473894 13.87590       5.750451 10.48108       7.601383 18.41835       8.792832 28.29823 9.419903 36.39157 9.727966 -8.093340      13.54134 
1 1 1 -15 23 28 o 58.41045 3.639863 42.42353       5.155230 41.29271       9.121861 42.95421       6.248858 56.26025 6.790631 58.50174 4.415849 -2.241482      8.100147 
1 1 1 -15 23 29 f 17.18124 6.464324 3.012992       3.677717 -3.505283      6.999360 5.498896       4.322491 16.70656 7.646938 20.95301 7.104505 -4.246445      10.43789 
1 1 1 -15 23 30 o 24.85828 6.163383 8.319335       3.714987 15.66628       7.387031 5.832131       4.298058 33.02510 8.955192 21.24842 7.083565 11.77668       11.41807 
1 1 1 -15 23 31 o 29.21473 5.605861 11.36508       3.845877 6.339540       7.224739 13.35224       4.543039 23.25017 8.983738 31.48391 6.141991 -8.233744      10.88263 
1 1 1 -15 23 32 o 54.99304 3.766968 38.25874       5.017704 37.64413       8.320858 38.60996       6.290053 52.59529 6.639785 54.64855 4.771025 -2.053253      8.176150 
1 1 1 -15 23 33 o 50.50554 5.314489 33.81749       6.442980 32.73744       8.273888 35.48141       10.26964 48.06642 7.292320 48.33948 9.050553 -0.2730637     11.62284 
1 1 1 -15 23 34 o 15.39173 6.347668 1.761227       3.852652 2.657993       6.137037 1.177946       4.949461 18.58882 7.862384 16.21807 6.965831 2.370743       10.50428 
1 1 1 -15 23 35 o 43.23043 5.954954 25.95521       6.106932 0.000000       0.000000 25.95521       6.106932 ?        ?        43.23043 5.954954 0.000000       5.954954 
1 1 1 -15 23 36 o 16.98620 6.684536 3.333374       4.059126 11.71308       6.690847 -1.546928      5.106108 26.41632 8.838686 14.21336 6.515322 12.20295       10.98052 
1 1 1 -15 23 37 o 28.52977 6.028401 11.88144       4.059727 3.270919       6.671108 16.94574       5.116145 18.53588 8.024862 33.84796 6.437797 -15.31208      10.28803 
1 1 1 -15 23 38 o 15.50316 6.732311 1.615919       4.724327 0.4799073      6.845242 2.649208       6.528425 16.62724 7.592283 17.65173 7.782639 -1.024488      10.87254 
1 1 1 -15 23 39 o 48.54577 4.645191 32.56464       5.428347 34.49039       11.61426 32.02637       6.140294 38.35640 11.51058 47.13994 5.445175 -8.783535      12.73355 
1 1 1 -15 23 40 o 11.21281 5.259995 -2.074003      3.633141 1.272452       6.438361 -3.637469      4.400753 16.20553 7.385680 11.52623 5.516365 4.679292       9.218381 
1 1 1 -15 24 1  o 156.6674 3.720392 300.2638       14.20377 327.3728       25.50950 288.0827       17.09969 162.8154 6.442116 153.2308 4.584529 9.584579       7.906881 
1 1 1 -15 24 2  o 36.89698 5.051868 17.01166       4.423181 22.73074       7.935358 14.43385       5.327573 42.14253 8.019890 33.62264 6.737154 8.519894       10.47415 
1 1 1 -15 24 3  o 91.71706 3.519368 103.0013       7.851350 87.73405       13.23607 111.2895       9.752367 84.11572 6.507802 95.24232 4.212304 -11.12660      7.752096 
1 1 1 -15 24 4  o 59.34304 4.776679 43.45388       6.849365 0.000000       0.000000 43.45388       6.849365 ?        ?        59.34304 4.776679 0.000000       4.776679 
1 1 1 -15 24 5  o 67.99426 4.937737 57.00264       8.125813 61.44043       11.61620 52.75022       11.37100 70.23179 6.875230 64.92836 7.313763 5.303429       10.03792 
1 1 1 -15 24 6  o 85.05331 3.631802 88.62344       7.510150 83.51235       13.20754 91.06572       9.129815 82.02724 6.664728 86.11685 4.364718 -4.089607      7.966766 
1 1 1 -15 24 7  o 219.3937 4.549288 589.8488       24.32225 589.2110       42.54720 590.1584       29.64337 217.8244 8.029200 219.0753 5.557109 -1.250885      9.764707 
1 1 1 -15 24 8  o 215.3873 4.692224 568.7443       24.62833 576.9422       30.67961 553.8871       41.30168 216.5012 5.820330 211.1613 8.041029 5.339890       9.926449 
1 1 1 -15 24 9  o 106.7017 3.294676 139.2818       8.556563 131.7406       12.84600 145.2961       11.47187 103.4755 5.110224 108.8255 4.334481 -5.350075      6.700904 
1 1 1 -15 24 10 o 113.6831 3.288652 158.0980       9.101087 144.0897       13.53374 169.6626       12.29676 108.2088 5.147140 117.6082 4.297815 -9.399391      6.705540 
1 1 1 -15 24 11 o 91.90025 2.981174 103.2898       6.667532 122.1122       12.26304 95.39020       7.944408 99.59773 5.069247 88.22129 3.703558 11.37644       6.278026 
1 1 1 -15 24 12 o 13.31756 5.876815 -1.104056      3.730192 -3.440525      6.904834 -0.1411387     4.432694 17.22005 7.768174 15.44981 6.613139 1.770234       10.20187 
1 1 1 -15 24 13 f 213.6971 3.519673 558.6720       18.32893 543.9570       29.70478 567.7189       23.29154 210.0584 5.808546 215.1636 4.442153 -5.105194      7.312449 
1 1 1 -15 24 14 o 189.6842 3.693204 440.4384       17.07146 453.7737       25.70957 429.9218       22.83129 191.9165 5.502943 186.9754 5.015363 4.941162       7.445552 
1 1 1 -15 24 15 o 144.6723 3.336048 256.0431       11.76126 251.5034       26.54428 257.1520       13.11935 141.9683 7.701454 144.8681 3.719312 -2.899857      8.552525 
1 1 1 -15 24 16 o 119.2020 2.904839 173.6894       8.438042 172.4721       14.72528 174.2845       10.29615 118.2757 5.121090 119.2600 3.546719 -0.9843292     6.229348 
1 1 1 -15 24 17 o 34.14161 4.715900 14.59594       3.818930 16.40468       7.575812 13.97973       4.421858 35.45011 8.808426 33.20774 5.667473 2.242374       10.47419 
1 1 1 -15 24 18 o 94.42109 2.899296 109.1378       6.663198 124.2680       12.55159 103.2006       7.862586 100.2690 5.154136 91.71122 3.524650 8.557739       6.244059 
1 1 1 -15 24 19 o 54.09493 3.845797 36.08947       5.036602 39.26460       8.903281 34.59517       6.107860 55.79129 6.681297 52.77815 4.801470 3.013145       8.227627 
1 1 1 -15 24 20 o 119.8516 2.871785 175.8036       8.387489 186.2764       15.11077 171.1401       10.08347 122.6961 5.064710 118.0712 3.508422 4.624817       6.161194 
1 1 1 -15 24 21 o 95.94907 3.236721 113.0120       7.557184 105.7040       11.99173 117.8265       9.733206 92.19291 5.360751 97.75784 4.094783 -5.564926      6.745732 
1 1 1 -15 24 22 o 107.0047 3.605242 140.8954       9.387557 146.2796       19.66121 139.3055       10.68407 107.2711 7.569887 106.2343 4.134909 1.036797       8.625582 
1 1 1 -15 24 23 o 18.77157 6.429739 4.103901       3.541841 0.7431844      10.32363 4.552246       3.770701 23.41584 10.05886 19.60645 6.635659 3.809395       12.05042 
1 1 1 -15 24 24 o 33.53020 4.528950 14.17819       3.606046 -3.612958      7.344567 19.82924       4.139314 17.45093 7.927925 39.79551 4.338505 -22.34458      9.037401 
1 1 1 -15 24 25 o 99.36620 3.083728 121.5528       7.458042 116.7263       17.97471 122.5565       8.196925 94.75537 7.854862 99.67339 3.379592 -4.918022      8.551052 
1 1 1 -15 24 26 o 32.55555 6.002936 13.81471       4.586973 19.05570       7.473738 10.64746       5.809943 37.43765 8.399206 28.13660 8.060509 9.301046       11.64124 
1 1 1 -15 24 27 o 13.85676 5.834553 0.5109462      3.355022 -2.530007      6.660789 1.544760       3.883667 16.85376 7.613812 15.81524 6.430257 1.038520       9.965858 
1 1 1 -15 24 28 o 43.11269 4.357322 23.50860       4.515076 9.940317       7.676699 30.68453       5.582787 27.29292 9.461104 49.16330 4.717700 -21.87037      10.57209 
1 1 1 -15 24 29 o 77.76152 3.858238 75.78355       7.288387 62.36678       9.898710 91.66955       10.77114 69.22498 5.924770 84.56310 5.252841 -15.33813      7.918032 
1 1 1 -15 24 30 o 18.05097 6.549016 3.818416       3.715148 -0.2258806     6.470025 5.807828       4.537815 17.59448 7.752956 21.16537 7.276898 -3.570898      10.63304 
1 1 1 -15 24 31 o 33.41751 5.133314 14.73065       4.046820 7.997729       6.963723 18.16386       4.972674 24.27082 8.940630 36.85735 5.721884 -12.58652      10.61484 
1 1 1 -15 24 32 o 16.72194 7.096653 1.476906       5.028172 5.185341       6.576486 -3.741280      7.801145 21.21948 8.457947 16.85623 7.841236 4.363251       11.53351 
1 1 1 -15 24 33 o 39.17812 4.993627 20.41859       4.659350 21.74161       7.470727 19.57636       5.960694 37.81364 8.332451 37.05197 6.853991 0.7616730      10.78920 
1 1 1 -15 24 34 o 30.18398 6.987269 13.39670       5.037875 18.79649       11.01991 11.96999       5.664455 31.35695 11.29232 27.80411 7.956935 3.552834       13.81410 
1 1 1 -15 24 35 o 49.78910 4.187965 32.49763       5.034226 33.57026       8.052286 31.80935       6.450243 47.62228 7.160016 47.94632 5.627576 -0.3240395     9.106890 
1 1 1 -15 24 36 o 28.65679 5.880158 11.85721       3.968537 10.45301       6.663399 12.62907       4.940283 24.63842 8.791862 28.56146 7.122554 -3.923042      11.31493 
1 1 1 -15 24 37 o 11.21713 5.248502 -2.259115      3.578201 -2.659536      6.018980 -2.040251      4.449913 14.34164 6.741153 12.71218 5.916424 1.629457       8.969237 
1 1 1 -15 24 38 o 31.93139 7.454695 16.78014       5.694808 18.21813       9.269446 15.90832       7.217542 28.45004 10.34133 28.60860 9.157209 -0.1585617     13.81295 
1 1 1 -15 24 39 o 28.96218 5.737797 12.56495       3.906367 20.16316       7.237136 9.441099       4.640412 32.58815 8.875239 23.46471 7.321282 9.123436       11.50526 
1 1 1 -15 25 1  o 77.34440 2.734993 73.16596       5.146798 81.14197       7.885916 67.24743       6.793075 81.28822 3.993186 74.01563 3.778735 7.272598       5.497670 
1 1 1 -15 25 2  o 23.98142 5.608661 7.361710       3.218920 5.445490       4.543357 9.292989       4.561176 21.63153 7.283894 26.89869 6.919201 -5.267168      10.04641 
1 1 1 -15 25 3  o 92.19078 3.228657 104.0380       7.242268 136.3328       15.18407 94.52748       8.239940 105.0048 5.958389 87.78133 3.861444 17.22346       7.100222 
1 1 1 -15 25 4  o 33.31178 5.539672 14.00998       4.339077 10.16332       8.162165 15.52533       5.122938 29.17666 9.762247 34.96791 6.240900 -5.791254      11.58664 
1 1 1 -15 25 5  o 178.5844 3.577696 390.2012       15.56980 390.1617       31.01184 390.2146       18.00325 177.3284 7.191428 178.4627 4.139684 -1.134369      8.297809 
1 1 1 -15 25 6  o 117.5464 3.227160 169.0484       9.235381 170.7955       18.50448 168.4688       10.65763 117.4247 6.491944 117.2631 3.734371 0.1615829      7.489384 
1 1 1 -15 25 7  o 79.67957 3.377947 77.78255       6.544094 79.21857       13.16677 77.31144       7.541525 79.74736 6.841312 79.36352 3.911490 0.3838425      7.880565 
1 1 1 -15 25 8  o 49.95614 5.052210 30.96790       6.065997 30.69279       10.21429 31.11779       7.539537 48.84836 8.908834 49.81945 6.354712 -0.9710922     10.94302 
1 1 1 -15 25 9  o 156.5425 3.122126 299.5633       11.91019 302.2071       20.00978 298.1127       14.82171 156.6809 5.248116 156.0209 3.898338 0.6600189      6.537565 
1 1 1 -15 25 10 o 46.51683 3.995868 26.70114       4.485727 33.02526       8.517952 24.27422       5.276701 51.18119 7.013790 44.17298 4.989165 7.008213       8.607265 
1 1 1 -15 25 11 o 31.31622 5.328394 12.39515       3.920825 17.90863       7.938277 10.61614       4.509231 37.10400 8.895042 28.73952 6.580647 8.364479       11.06466 
1 1 1 -15 25 12 f 147.7115 3.050133 266.7556       10.97917 270.4839       18.78889 264.8224       13.52936 148.1689 5.211766 146.9938 3.780096 1.175095       6.438294 
1 1 1 -15 25 13 o 176.0309 3.226175 379.0638       13.83926 374.0235       22.99042 381.9281       17.33097 174.1447 5.424135 176.4986 4.029449 -2.353912      6.757048 
1 1 1 -15 25 14 o 174.8155 3.571103 374.2814       15.21312 400.0827       34.31761 367.9709       16.97189 178.8065 7.895323 173.2167 4.020726 5.589798       8.860156 
1 1 1 -15 25 15 o 107.6115 2.902637 141.7111       7.604851 156.7638       13.81421 135.1655       9.109471 112.7052 5.042513 104.9788 3.566041 7.726418       6.176050 
1 1 1 -15 25 16 o 68.99227 3.154161 58.38290       5.288957 57.31675       9.730262 58.83000       6.301089 67.78798 5.950595 69.16206 3.752679 -1.374084      7.035068 
1 1 1 -15 25 17 o 92.94338 2.950974 105.8160       6.675277 107.5653       11.84339 105.0015       8.081173 93.18348 5.236631 92.46647 3.593201 0.7170105      6.350858 
1 1 1 -15 25 18 o 61.63683 3.655958 46.78597       5.466662 53.52376       9.493103 43.44314       6.686632 65.37595 6.026517 59.18360 4.674205 6.192356       7.626736 
1 1 1 -15 25 19 o 156.2731 3.462776 299.7045       13.18696 298.5769       19.96250 300.5775       17.56505 155.1562 5.287432 155.9976 4.625678 -0.8414459     7.025229 
1 1 1 -15 25 20 o 128.9206 3.681941 204.4904       11.55554 193.7821       21.90303 208.6206       13.60264 123.7584 7.294977 129.9890 4.300098 -6.230644      8.468031 
1 1 1 -15 25 21 o 84.07156 3.172235 86.87463       6.487401 91.65763       15.79373 85.90383       7.115373 84.58764 7.747958 83.52013 3.503775 1.067513       8.503369 
1 1 1 -15 25 22 o 59.33481 3.228082 43.38733       4.649984 36.30911       8.820653 46.11148       5.472116 53.14122 6.979931 61.06953 3.694286 -7.928310      7.897290 
1 1 1 -15 25 23 o 70.16787 3.034948 60.61226       5.177229 66.74168       10.19526 58.48247       6.009757 72.67567 5.804914 68.77840 3.598170 3.897270       6.829630 
1 1 1 -15 25 24 o 54.40622 3.624249 36.71712       4.777706 48.83437       13.90478 35.09502       5.087454 59.76274 9.893525 53.09395 3.960586 6.668797       10.65683 
1 1 1 -15 25 25 o 37.73516 5.181153 18.20330       4.638752 11.20998       7.535220 22.47092       5.886357 28.89409 9.366443 41.70367 5.961527 -12.80957      11.10271 
1 1 1 -15 25 26 o 59.17953 3.205229 43.39176       4.605139 36.64574       8.673032 46.04041       5.434503 52.79267 6.907066 60.80420 3.684967 -8.011528      7.828572 
1 1 1 -15 25 27 o 40.54264 3.845009 20.66144       3.753388 18.68870       7.353203 21.35655       4.364851 36.56529 8.425455 41.02116 4.436955 -4.455864      9.522335 
1 1 1 -15 25 28 o 71.32520 3.250238 63.29794       5.634449 73.44057       9.830700 58.33616       6.875876 75.51698 5.377177 68.01275 4.168626 7.504234       6.803784 
1 1 1 -15 25 29 o 72.39203 3.417504 65.54999       6.011849 55.78582       9.675009 71.69128       7.672970 64.88304 6.194141 75.22264 4.202511 -10.33960      7.485218 
1 1 1 -15 25 30 o 24.58320 6.208227 8.343852       3.719406 4.406869       6.106711 10.66563       4.689603 20.47460 8.153816 27.48956 6.986864 -7.014954      10.73783 
1 1 1 -15 25 31 o 22.85069 7.869532 7.378927       5.307751 9.076510       7.071305 5.188262       8.032892 24.91950 9.036020 22.09400 9.143942 2.825495       12.85540 
1 1 1 -15 25 32 o 28.26644 6.232980 11.25314       4.177787 10.89350       7.060821 11.44687       5.182274 26.36414 9.076677 27.75830 7.489460 -1.394165      11.76767 
1 1 1 -15 25 33 o 15.28264 6.396050 1.574803       3.994147 5.755863       6.598679 -0.8428434     5.017764 21.16535 8.460241 14.71710 6.632113 6.448251       10.74991 
1 1 1 -15 25 34 o 18.88525 7.156995 4.716842       4.526758 9.015836       10.35150 3.700331       5.033570 24.13881 10.21058 18.15639 7.343013 5.982428       12.57679 
1 1 1 -15 25 35 o 11.25461 5.205309 -1.798432      3.363290 -2.113925      5.517487 -1.611888      4.242653 14.27134 6.623620 12.83666 5.904358 1.434678       8.873206 
1 1 1 -15 25 36 o 33.24360 5.677992 15.91377       4.434758 12.72750       6.823406 18.24403       5.835274 26.36619 8.926327 34.04198 7.256061 -7.675793      11.50347 
1 1 1 -15 25 37 o 14.35173 6.537448 -0.3334237     5.036181 2.123419       8.057894 -1.908321      6.451474 18.06459 8.244309 14.96108 7.015446 3.103518       10.82521 
1 1 1 -15 25 38 o 11.45290 5.366968 -2.103305      3.765496 -6.818889      6.274476 0.5509963      4.707440 12.68056 6.190615 14.41249 6.465150 -1.731928      8.951083 
1 1 1 -15 26 1  o 63.20101 2.947007 48.94432       4.526306 53.04796       6.613039 45.32747       6.208428 65.62625 4.156468 60.63073 4.228470 4.995525       5.929265 
1 1 1 -15 26 2  o 152.3971 2.959553 283.9577       10.99104 294.8560       17.11117 276.3029       14.34062 154.8700 4.538841 150.0833 3.924392 4.786743       6.000161 
1 1 1 -15 26 3  o 75.03673 4.025554 69.22901       7.334035 0.000000       0.000000 69.22901       7.334035 ?        ?        75.03673 4.025554 0.000000       4.025554 
1 1 1 -15 26 4  o 126.4738 3.238309 195.8064       9.972349 190.1897       19.34589 197.8389       11.63765 123.8008 6.434611 127.0258 3.763713 -3.224998      7.454513 
1 1 1 -15 26 5  o 69.20699 3.539233 58.78793       5.949090 72.85247       11.62832 53.80159       6.923814 76.50368 6.292913 66.07688 4.323664 10.42680       7.635105 
1 1 1 -15 26 6  o 118.8422 3.250789 172.9080       9.405622 179.7981       19.07305 170.6940       10.81166 120.3331 6.528728 117.9826 3.765257 2.350449       7.536674 
1 1 1 -15 26 7  o 145.6559 3.937899 260.2281       13.96465 269.4131       24.20041 255.6430       17.09858 147.2629 6.761665 144.1112 4.875868 3.151703       8.336319 
1 1 1 -15 26 8  o 94.95750 3.859556 110.6832       8.912442 97.61645       15.18923 117.5440       11.00627 88.37140 7.113273 97.70380 4.635890 -9.332397      8.490590 
1 1 1 -15 26 9  o 84.42667 3.277219 87.34993       6.729699 90.26190       14.16607 86.50122       7.647779 85.00495 6.897848 83.94076 3.748203 1.064194       7.850435 
1 1 1 -15 26 10 o 99.50300 2.987113 121.1852       7.234890 126.7123       12.76030 118.5667       8.783099 101.2929 5.186739 98.30696 3.672753 2.985909       6.355421 
1 1 1 -15 26 11 o 81.82413 3.041414 82.00863       6.053919 79.31323       10.63403 83.30109       7.363683 79.99094 5.488590 82.36774 3.677888 -2.376793      6.606927 
1 1 1 -15 26 12 o 95.99300 3.015710 112.8367       7.045732 104.6180       12.26902 116.8808       8.606358 91.89025 5.504269 97.59267 3.625113 -5.702415      6.590783 
1 1 1 -15 26 13 o 176.6947 3.624429 382.7352       15.60627 480.7255       38.61966 363.6106       17.06137 195.4990 8.124098 172.0877 4.068439 23.41129       9.085877 
1 1 1 -15 26 14 o 171.7544 3.213503 361.2611       13.45001 366.7861       22.76592 358.2987       16.67038 172.1749 5.432794 170.8103 4.004933 1.364624       6.749425 
1 1 1 -15 26 15 o 182.9853 3.287555 410.2940       14.65971 394.6245       24.04878 419.5596       18.49286 178.4538 5.536776 184.7478 4.107604 -6.294067      6.894076 
1 1 1 -15 26 16 o 101.4674 3.305868 126.3560       8.163342 136.2148       13.11752 120.1245       10.42892 104.8254 5.150872 98.67094 4.347922 6.154488       6.740617 
1 1 1 -15 26 17 o 94.06123 3.751942 108.9056       8.582833 106.8700       16.46246 109.6655       10.05795 91.83993 7.418845 94.21308 4.392984 -2.373154      8.621923 
1 1 1 -15 26 18 o 60.84454 5.106325 46.19780       7.501442 49.84423       12.71546 44.25122       9.290376 61.91887 8.663806 59.08865 6.562536 2.830223       10.86869 
1 1 1 -15 26 19 o 35.58753 4.792387 15.95597       4.050559 18.81564       10.09485 15.40721       4.422159 37.22993 10.61187 34.81186 5.386591 2.418076       11.90072 
1 1 1 -15 26 20 o 99.41455 2.911314 121.3460       7.045423 132.7241       13.14693 116.7619       8.344866 103.1057 5.249732 97.34447 3.523620 5.761276       6.322625 
1 1 1 -15 26 21 o 31.92275 4.917534 12.96043       3.702813 11.37352       7.440414 13.48284       4.269008 29.39695 9.284573 32.38299 5.613019 -2.986042      10.84939 
1 1 1 -15 26 22 o 32.35433 4.677719 13.28437       3.581178 6.904136       7.399449 15.23598       4.092402 24.84913 9.204917 34.60121 4.998131 -9.752085      10.47434 
1 1 1 -15 26 23 o 45.86346 3.734097 26.19603       4.137305 25.79499       8.173309 26.33418       4.797332 43.93718 7.925121 45.81055 4.349434 -1.873379      9.040195 
1 1 1 -15 26 24 o 48.11209 3.969664 28.95371       4.612814 39.62851       12.55325 27.28732       4.959804 53.10096 10.06939 46.55151 4.425308 6.549450       10.99891 
1 1 1 -15 26 25 o 15.36002 5.927939 2.127186       3.142950 -7.883224      6.107092 5.733671       3.665647 13.43341 6.447444 20.98940 6.500354 -7.555988      9.155552 
1 1 1 -15 26 26 o 23.83057 6.452502 7.648658       3.838444 10.88340       6.780272 6.122986       4.656479 27.93841 8.868022 21.83491 7.374040 6.103504       11.53335 
1 1 1 -15 26 27 o 24.25216 5.692675 7.881066       3.306315 -0.4626066     6.471340 10.82843       3.846206 17.52920 7.737734 28.49997 5.736759 -10.97077      9.632390 
1 1 1 -15 26 28 o 82.53414 3.259645 85.03725       6.543123 79.28661       10.23129 89.01675       8.511119 78.06978 5.411368 83.80472 4.180764 -5.734940      6.838252 
1 1 1 -15 26 29 o 14.76644 5.854429 1.886239       3.134699 -4.792609      6.568839 3.855690       3.567060 15.03937 7.060672 17.81198 6.423328 -2.772601      9.545274 
1 1 1 -15 26 30 o 18.53447 6.769009 4.289069       3.978165 6.106764       6.404638 3.147253       5.076124 21.87628 8.456988 18.20657 7.370131 3.669704       11.21782 
1 1 1 -15 26 31 o 15.70186 6.509828 1.778393       4.081264 7.659298       7.894230 -0.3668531     4.767890 23.52036 9.301492 14.81945 6.586394 8.700913       11.39729 
1 1 1 -15 26 32 o 13.78195 6.041575 0.8888368E-01  3.882549 -3.756768      6.569703 2.152844       4.812951 15.09352 7.078154 16.74376 7.015256 -1.650234      9.965645 
1 1 1 -15 26 33 o 41.53641 5.229041 23.53702       5.175787 30.60928       11.58402 21.77300       5.785382 39.73803 11.38092 39.04279 6.294739 0.6952477      13.00573 
1 1 1 -15 26 34 o 15.38615 6.345969 2.153293       3.851078 -0.8666908     6.483522 3.799620       4.787037 16.00745 7.339202 17.82486 7.177969 -1.817408      10.26582 
1 1 1 -15 26 35 o 36.10577 5.399734 18.44642       4.605309 40.62978       7.945718 7.224537       5.651353 52.48081 6.341356 21.18891 8.004259 31.29190       10.21181 
1 1 1 -15 26 36 o 23.79150 6.929204 9.111161       4.260747 17.78734       9.272968 6.789213       4.797124 28.35737 10.33796 20.46375 7.439281 7.893621       12.73641 
1 1 1 -15 26 37 o 19.06710 7.337295 5.770545       4.805107 8.289526       6.544352 2.824123       7.077856 21.36756 8.463017 17.64876 7.921351 3.718807       11.59183 
1 1 1 -15 27 1  o 96.62003 3.122932 114.4112       7.343362 114.8550       13.47318 114.2236       8.758647 96.13710 5.777656 96.42060 3.734678 -0.2835007     6.879617 
1 1 1 -15 27 2  f 160.6807 3.395174 316.3239       13.29419 312.9024       25.34249 317.6229       15.61523 158.4856 6.576095 160.8435 3.983903 -2.357941      7.688726 
1 1 1 -15 27 3  o 59.67529 3.991436 43.90665       5.771058 47.64238       9.903238 41.98570       7.101482 61.54045 6.712275 58.13944 5.062797 3.401009       8.407529 
1 1 1 -15 27 4  o 28.66448 6.047663 10.55179       4.091381 -1.898264      7.110467 16.71413       5.002481 18.32295 8.098456 36.31263 5.852030 -17.98968      9.991559 
1 1 1 -15 27 5  o 132.3834 3.285094 214.6054       10.59784 209.8607       20.48712 216.3389       12.38342 129.8219 6.496492 132.7437 3.832175 -2.921814      7.542545 
1 1 1 -15 27 6  o 39.98652 5.895159 20.19790       5.572277 17.24495       8.924972 22.08434       7.133451 36.20346 9.854384 41.48997 7.323012 -5.286503      12.27744 
1 1 1 -15 27 7  o 70.84354 3.511131 61.65355       6.042657 49.14034       11.56081 66.35718       7.087944 62.18147 7.800618 73.42003 3.976431 -11.23856      8.755664 
1 1 1 -15 27 8  f 36.54816 5.255737 16.81222       4.546525 16.09024       9.099410 17.05243       5.248653 35.04683 10.10232 36.62345 6.095150 -1.576618      11.79863 
1 1 1 -15 27 9  o 36.80273 5.297246 17.05568       4.614129 12.42433       9.121053 18.64852       5.349059 31.51720 10.31120 38.37428 5.909439 -6.857084      11.88454 
1 1 1 -15 27 10 o 33.12281 5.805181 13.97111       4.515033 10.32867       9.404448 15.06213       5.147001 29.75004 10.46104 34.28701 6.395301 -4.536966      12.26105 
1 1 1 -15 27 11 o 54.86612 3.678741 37.09940       4.890155 39.31523       8.948591 36.15593       5.839150 55.77881 6.718519 54.01312 4.476399 1.765686       8.073205 
1 1 1 -15 27 12 o 29.55250 5.836562 11.20035       4.054083 9.622205       7.623093 11.82272       4.787195 28.09011 9.434821 30.21807 6.678910 -2.127956      11.55957 
1 1 1 -15 27 13 o 63.26863 4.480679 49.57714       6.863564 43.66998       16.35787 50.83934       7.561367 56.56107 12.22497 63.97577 4.887067 -7.414703      13.16561 
1 1 1 -15 27 14 o 105.5037 3.764236 136.9754       9.662384 127.4369       17.99712 140.8382       11.45300 100.3438 7.412302 106.7879 4.410589 -6.444115      8.625284 
1 1 1 -15 27 15 o 114.1188 3.741470 160.2980       10.39078 156.8573       19.41998 161.6781       12.29945 111.3853 7.193053 114.3816 4.420912 -2.996300      8.443013 
1 1 1 -15 27 16 o 55.99727 3.653694 38.72295       4.958574 54.53195       11.92946 35.42115       5.451851 65.18424 7.655804 53.42447 4.221920 11.75978       8.742765 
1 1 1 -15 27 17 o 73.35136 3.485880 66.30090       6.213156 73.95305       10.23429 61.83445       7.818917 76.85461 5.500892 70.54484 4.572900 6.309769       7.153407 
1 1 1 -15 27 18 o 93.65212 2.943749 107.7321       6.709880 102.3822       11.84048 110.2629       8.143740 90.43951 5.397030 94.57828 3.539675 -4.138763      6.454241 
1 1 1 -15 27 19 o 72.40574 3.041070 64.52287       5.353866 71.30782       10.10802 61.87714       6.311982 75.27221 5.549575 70.74017 3.674130 4.532043       6.655601 
1 1 1 -15 27 20 f 30.90047 5.209920 12.24805       3.783743 21.50435       7.454123 9.035243       4.391579 40.18707 7.893327 26.15060 6.821225 14.03647       10.43234 
1 1 1 -15 27 21 o 19.97599 6.354698 5.032004       3.480015 6.263386       7.103534 4.643144       3.991854 23.95902 8.990475 19.76199 6.823852 4.197035       11.28688 
1 1 1 -15 27 22 o 16.61430 6.585332 2.151067       3.965299 -0.2320782     6.476110 3.580387       5.015377 18.05358 7.860574 19.41918 7.489989 -1.365606      10.85765 
1 1 1 -15 27 23 o 48.92369 3.951194 29.97114       4.670638 36.78846       12.49421 28.86370       5.035730 50.61088 10.47585 47.86404 4.365340 2.746834       11.34899 
1 1 1 -15 27 24 o 51.43808 3.588388 33.03430       4.469801 39.77209       8.602289 30.54236       5.231472 55.01972 6.543996 49.14621 4.415158 5.873505       7.894144 
1 1 1 -15 27 25 o 12.31821 5.565139 -1.530635      3.559103 0.9201630      5.784064 -3.024021      4.515079 17.69101 7.562903 13.07677 6.042070 4.614246       9.680089 
1 1 1 -15 27 26 f 66.32158 3.145465 54.76795       5.069165 46.75611       8.879753 58.64117       6.174063 59.44196 6.222240 68.34240 3.721228 -8.900444      7.250091 
1 1 1 -15 27 27 f 29.64419 5.601769 11.77567       3.898450 14.21857       7.106732 10.72415       4.662588 30.87594 8.936338 27.68018 6.929019 3.195753       11.30794 
1 1 1 -15 27 28 o 47.38390 4.517308 29.02620       5.153062 35.52402       8.124987 24.65374       6.665028 50.79861 6.728814 42.24075 6.698163 8.557865       9.494330 
1 1 1 -15 27 29 o 12.03317 5.535687 -2.054905      3.731486 0.9749007E-01  6.299512 -3.218339      4.631450 17.12824 7.593915 12.86568 6.003869 4.262558       9.680598 
1 1 1 -15 27 30 o 26.56216 6.095236 9.930765       3.861569 11.21777       8.334031 9.578916       4.357566 26.46984 9.775517 25.68729 6.839990 0.7825413      11.93089 
1 1 1 -15 27 31 o 17.98840 6.134831 4.375733       3.223666 2.520548       5.666155 5.263628       3.919906 17.85219 7.552960 19.48452 6.760366 -1.632328      10.13656 
1 1 1 -15 27 32 o 36.60157 5.732616 18.73735       4.945432 22.51610       11.19918 17.82200       5.511964 33.21503 11.43138 34.85984 6.732264 -1.644802      13.26649 
1 1 1 -15 27 33 o 22.28552 6.737137 7.543664       3.968164 6.824543       6.547696 7.961107       4.988676 21.30861 8.457010 22.45641 7.632154 -1.147800      11.39170 
1 1 1 -15 27 34 o 28.69916 6.247965 12.30569       4.245398 16.90769       7.058134 9.696899       5.314185 30.71590 8.910391 24.05779 7.870532 6.658112       11.88866 
1 1 1 -15 27 35 o 38.01719 5.596375 20.87957       5.029720 8.909203       9.310747 25.81225       5.976855 22.13682 9.531571 41.79903 6.042908 -19.66221      11.28573 
1 1 1 -15 27 36 o 10.11296 4.978136 -6.926868      4.324573 -3.988110      6.203877 -9.704591      6.031504 13.68556 6.549773 11.55524 5.723174 2.130319       8.697946 
1 1 1 -15 28 1  o 89.65316 3.045151 98.60756       6.643238 97.93225       8.929212 99.44477       9.942116 89.09252 4.123970 89.65422 4.565668 -0.5616989     6.152435 
1 1 1 -15 28 2  o 18.91312 6.746803 3.890090       3.923715 6.736752       5.419303 0.7536900      5.688415 23.68058 7.955004 18.04253 7.597140 5.638056       10.99994 
1 1 1 -15 28 3  o 100.3226 3.155159 123.4726       7.703993 123.7085       10.58723 123.2072       11.23148 100.1127 4.350053 99.82446 4.629650 0.2882767      6.352686 
1 1 1 -15 28 4  o 18.15747 7.212603 2.321556       4.766461 8.166516       7.591242 -1.482538      6.124175 26.60874 9.395034 17.08233 7.534455 9.526409       12.04303 
1 1 1 -15 28 5  o 73.97988 4.098776 67.53642       7.360428 78.76221       12.67005 61.81809       9.042823 79.13983 6.630621 70.46533 5.305098 8.674500       8.491714 
1 1 1 -15 28 6  o 81.38345 4.954632 82.14423       9.779597 81.42725       13.02799 83.06979       14.80214 80.44404 6.706765 80.90015 7.597162 -0.4561081     10.13398 
1 1 1 -15 28 7  o 162.4620 3.993708 324.6162       15.81117 341.7396       28.12373 316.7029       19.11869 164.9654 7.011901 160.0180 4.908706 4.947388       8.559331 
1 1 1 -15 28 8  o 53.36310 4.516057 35.36157       5.817594 29.72242       9.265264 39.03179       7.474748 47.82470 8.247888 55.82097 5.569189 -7.996269      9.952061 
1 1 1 -15 28 9  o 86.90163 3.826128 93.01751       8.082722 88.76154       14.31620 95.00890       9.792793 83.80172 7.076406 87.61942 4.602520 -3.817703      8.441488 
1 1 1 -15 28 10 o 47.50977 4.950656 28.21472       5.647693 20.96712       9.619478 32.02707       6.976707 39.51589 9.986648 50.43116 5.781355 -10.91527      11.53938 
1 1 1 -15 28 11 o 33.49036 7.959159 14.76927       6.399417 4.471247       8.825125 26.18891       9.293299 24.43561 9.778381 44.53611 8.874638 -20.10051      13.20515 
1 1 1 -15 28 12 o 50.15269 4.745852 31.38249       5.731225 0.000000       0.000000 31.38249       5.731225 ?        ?        50.15269 4.745852 0.000000       4.745852 
1 1 1 -15 28 13 o 74.64202 3.180845 68.49792       5.772516 69.17352       10.55464 68.20958       6.895137 74.21716 5.883952 74.33804 3.819036 -0.1208801     7.014694 
1 1 1 -15 28 14 o 87.32432 3.076641 93.69048       6.536858 93.65097       11.66182 93.70857       7.893511 86.49977 5.561894 87.16488 3.724731 -0.6651077     6.693900 
1 1 1 -15 28 15 o 12.18451 5.498208 -1.691244      3.462021 -6.079823      6.361450 0.1554955      4.126644 14.81731 6.953849 15.01580 6.402772 -0.1984930     9.452593 
1 1 1 -15 28 16 o 79.81814 3.512853 78.60762       6.816049 76.35211       10.77688 80.11141       8.799614 77.86636 5.719362 80.25471 4.517664 -2.388351      7.288373 
1 1 1 -15 28 17 o 40.72847 4.245682 20.76521       4.152077 26.37941       7.850692 18.58500       4.892300 44.86834 7.440657 38.18603 5.408601 6.682308       9.198714 
1 1 1 -15 28 18 o 92.36545 3.006856 105.0188       6.758950 92.02639       11.43674 111.9921       8.378703 85.42270 5.523667 95.17043 3.619353 -9.747726      6.603833 
1 1 1 -15 28 19 o 52.64889 3.623666 34.42511       4.620793 40.70739       8.685620 31.94514       5.457150 56.18563 6.461128 50.45271 4.485294 5.732922       7.865369 
1 1 1 -15 28 20 o 52.82777 3.504350 34.66300       4.485842 46.19976       8.699158 30.48404       5.235631 59.98417 6.033049 49.24934 4.409067 10.73483       7.472452 
1 1 1 -15 28 21 o 78.88068 3.595996 77.29763       6.894172 73.20779       10.32661 80.58626       9.260021 75.71172 5.637506 79.96669 4.773621 -4.254967      7.387078 
1 1 1 -15 28 22 o 55.21657 3.883624 38.16994       5.192350 40.89767       13.59393 37.70401       5.618341 52.74163 10.93604 54.73528 4.245325 -1.993645      11.73115 
1 1 1 -15 28 23 o 25.08596 6.012038 8.436682       3.627274 12.42333       6.989594 6.967304       4.243405 29.58126 8.941145 22.81067 6.981338 6.770586       11.34386 
1 1 1 -15 28 24 f 10.83360 5.158419 -4.369406      3.745999 -9.573211      6.360625 -1.606027      4.635105 13.05333 6.341063 14.15912 6.378009 -1.105790      8.993780 
1 1 1 -15 28 25 o 56.84015 3.397038 40.47113       4.683880 26.45686       7.840748 48.24721       5.840536 43.51023 7.675302 61.81755 3.896910 -18.30732      8.607914 
1 1 1 -15 28 26 o 14.12073 6.000691 0.6283404      3.603228 -2.853588      6.058313 2.534198       4.482156 15.34216 7.056332 17.20612 6.939689 -1.863958      9.897025 
1 1 1 -15 28 27 o 13.61715 6.005259 -0.3702277     3.889270 -0.1611527     5.878227 -0.5330184     5.186926 16.56923 7.341380 15.43400 6.864029 1.135230       10.05041 
1 1 1 -15 28 28 o 19.97643 6.335880 5.511038       3.461623 3.275753       6.137621 6.553762       4.191972 19.17490 7.969290 21.55264 6.986080 -2.377741      10.59787 
1 1 1 -15 28 29 o 19.29449 6.536495 5.097480       3.658893 8.639097       8.427356 4.274799       4.061684 24.29403 9.609502 18.39435 6.818722 5.899687       11.78293 
1 1 1 -15 28 30 o 51.06464 3.563096 33.38499       4.406062 29.72519       7.710314 35.15965       5.369078 44.95785 7.286928 51.86074 4.286647 -6.902885      8.454268 
1 1 1 -15 28 31 o 15.41445 6.053244 2.566505       3.322554 3.250441       6.274068 2.299944       3.916874 18.61156 7.914021 15.73556 6.435082 2.876000       10.20010 
1 1 1 -15 28 32 o 13.69955 5.888242 0.8467823      3.541273 -8.075803      9.409245 2.319212       3.822317 15.90826 7.724339 15.50719 6.351071 0.4010706      10.00008 
1 1 1 -15 28 33 o 20.53054 6.794598 6.508674       3.956263 4.457713       6.374626 7.793571       5.045570 18.94944 8.013936 21.87386 7.664638 -2.924421      11.08918 
1 1 1 -15 28 34 f 15.60811 6.187289 2.942757       3.500842 7.655815       8.441360 1.963738       3.847304 21.34517 9.131039 14.87358 6.254462 6.471584       11.06771 
1 1 1 -15 28 35 o 32.65131 8.964071 20.05301       7.348601 20.05301       7.348601 0.000000       0.000000 32.65131 8.964071 ?        ?        0.000000       8.964071 
1 1 1 -15 29 1  o 95.61672 3.149678 112.3663       7.328972 99.49895       12.71916 118.7622       8.967319 89.00320 5.897567 98.12580 3.757045 -9.122597      6.992617 
1 1 1 -15 29 2  o 74.39620 2.928484 67.97598       5.298837 74.66756       7.736651 62.06360       7.272264 77.68861 4.101102 70.77280 4.236031 6.915810       5.896016 
1 1 1 -15 29 3  o 55.52054 3.170336 37.95802       4.271555 36.71936       6.015731 39.21761       6.066371 54.29119 4.589943 56.15061 4.470294 -1.859425      6.407114 
1 1 1 -15 29 4  o 67.24261 4.241058 56.02898       6.914122 0.000000       0.000000 56.02898       6.914122 ?        ?        67.24261 4.241058 0.000000       4.241058 
1 1 1 -15 29 5  o 81.87312 3.983296 82.80536       7.923458 79.26260       12.73184 85.04480       10.12257 79.13428 6.664093 82.63620 5.050841 -3.501915      8.361885 
1 1 1 -15 29 6  o 54.72552 3.893175 37.07341       5.158041 58.35419       10.67777 30.59604       5.890963 67.87209 6.536599 49.43607 4.956768 18.43602       8.203455 
1 1 1 -15 29 7  o 67.03622 3.490342 55.39015       5.682182 54.12737       10.58357 55.90155       6.735203 65.25486 6.753017 67.19191 4.133374 -1.937050      7.917576 
1 1 1 -15 29 8  o 167.2745 3.511323 344.0630       14.31319 365.6142       29.62288 337.4992       16.34820 169.8641 7.172459 165.4199 4.055517 4.444260       8.239623 
1 1 1 -15 29 9  o 55.17173 3.912513 37.70141       5.226150 31.76663       10.34942 39.73273       6.054834 48.92472 9.012624 56.51835 4.431610 -7.593624      10.04323 
1 1 1 -15 29 10 o 28.83282 6.478032 10.85121       4.440292 5.392719       8.399771 12.96807       5.230899 24.59856 9.635137 31.44609 7.005600 -6.847523      11.91278 
1 1 1 -15 29 11 o 94.34322 3.783751 109.8880       8.681353 0.000000       0.000000 109.8880       8.681353 ?        ?        94.34322 3.783751 0.000000       3.783751 
1 1 1 -15 29 12 o 80.71739 3.435109 80.32624       6.741392 94.77872       14.64066 76.43754       7.594376 86.14291 7.035599 78.57804 3.978970 7.564865       8.082813 
1 1 1 -15 29 13 o 99.94175 3.431763 123.1336       8.345560 124.3328       12.86241 122.2617       10.96757 99.62404 5.317387 99.15155 4.551292 0.4724884      6.999204 
1 1 1 -15 29 14 o 68.09584 3.306796 57.22050       5.470963 65.60754       9.785373 53.40664       6.598654 72.10263 5.613365 65.54235 4.152752 6.560280       6.982494 
1 1 1 -15 29 15 o 14.37429 5.974931 0.7717491      3.450740 4.530601       6.477615 -0.7176386     4.077476 21.93771 8.498439 14.11856 6.190193 7.819156       10.51389 
1 1 1 -15 29 16 o 13.23001 5.876879 -1.132214      3.790941 -5.083347      6.703690 0.7253565      4.596484 15.69025 7.288610 16.19081 6.823956 -0.5005617     9.984498 
1 1 1 -15 29 17 o 34.63597 4.899157 15.29732       4.019787 19.12989       7.467062 13.73338       4.769956 37.46788 8.387551 32.34402 6.278252 5.123856       10.47700 
1 1 1 -15 29 18 o 29.20047 5.482952 11.09929       3.758338 4.643150       7.207193 13.51064       4.404633 22.48066 8.888405 32.17217 5.832876 -9.691513      10.63138 
1 1 1 -15 29 19 o 18.02853 6.466404 3.691688       3.609457 -4.171123      6.574577 7.084029       4.318457 15.82057 7.303135 23.15672 7.034041 -7.336154      10.13970 
1 1 1 -15 29 20 o 26.99824 6.656466 9.828772       4.351256 8.619925       6.720392 10.70134       5.709631 25.63687 8.853930 27.87626 7.992113 -2.239389      11.92753 
1 1 1 -15 29 21 o 16.43274 6.246239 2.691431       3.454226 7.777719       6.487692 0.6791288      4.080715 24.52519 8.682952 15.13985 6.407786 9.385341       10.79136 
1 1 1 -15 29 22 f 53.31834 3.967914 35.83177       5.118589 24.33206       12.20229 38.28736       5.638668 39.02610 11.81756 54.99633 4.240045 -15.97023      12.55518 
1 1 1 -15 29 23 o 44.46357 4.102818 25.11675       4.395415 36.00454       8.368895 20.96939       5.165161 51.61123 6.820894 39.97768 5.443123 11.63355       8.726522 
1 1 1 -15 29 24 o 44.49039 3.932433 25.15841       4.219623 25.55149       7.404791 24.96939       5.134932 42.77116 7.370395 43.83841 4.889822 -1.067245      8.844947 
1 1 1 -15 29 25 o 49.31385 4.368589 31.30768       5.195587 28.53678       7.698472 33.62539       7.040830 45.05824 7.257720 50.07419 5.882002 -5.015957      9.341972 
1 1 1 -15 29 26 o 27.35632 7.276814 10.87858       4.935144 5.465637       6.225965 20.02938       8.095054 21.19515 8.297223 35.74455 9.229758 -14.54940      12.41098 
1 1 1 -15 29 27 o 63.32657 3.276747 50.62244       5.039476 53.11349       8.806233 49.40942       6.145173 62.58422 5.841646 61.96443 4.092551 0.6197853      7.132587 
1 1 1 -15 29 28 o 22.39962 6.222764 7.161313       3.517962 9.512544       6.354928 6.122400       4.224278 24.77977 8.607147 20.77213 7.023464 4.007641       11.10910 
1 1 1 -15 29 29 o 33.33000 4.483916 14.75392       3.549607 8.368703       6.037839 18.12635       4.387982 23.31068 8.363106 36.60680 5.053559 -13.29612      9.771386 
1 1 1 -15 29 30 o 15.31910 6.011792 2.552533       3.275333 3.714034       6.065835 2.074511       3.891386 18.75500 7.867918 15.44189 6.375027 3.313110       10.12646 
1 1 1 -15 29 31 o 28.80645 7.141751 12.89258       4.988301 9.335320       11.31718 13.75033       5.557259 23.53947 10.31700 29.24295 7.695456 -5.703484      12.87092 
1 1 1 -15 29 32 o 13.77580 6.149805 0.5705941E-01  4.204576 1.760449       8.022581 -0.5879949     4.936910 18.19930 8.274911 14.24206 6.481745 3.957239       10.51129 
1 1 1 -15 29 33 o 17.64337 6.449537 4.523789       3.612761 12.81707       8.778554 2.832761       3.964013 24.81496 9.810163 15.84563 6.476134 8.969337       11.75498 
1 1 1 -15 29 34 o 35.92900 4.572824 17.86822       3.913146 6.064349       6.721301 23.92079       4.812950 19.67481 8.269720 41.29677 4.876492 -21.62196      9.600440 
1 1 1 -15 30 1  o 46.46135 3.447691 26.74817       3.875701 23.97371       5.311616 29.90725       5.667849 43.53257 5.103786 48.76787 4.832725 -5.235294      7.028788 
1 1 1 -15 30 2  o 89.62082 2.836362 98.71077       6.186707 106.4727       9.288522 92.52155       8.294298 92.64403 4.124614 86.41409 3.949195 6.229942       5.710392 
1 1 1 -15 30 3  o 122.2288 2.867407 183.4351       8.540811 201.1491       13.35199 171.1674       11.11140 127.3151 4.309793 117.6366 3.881370 9.678474       5.799943 
1 1 1 -15 30 4  o 71.39427 4.100596 63.26913       7.104208 61.25760       11.50697 64.50810       9.030820 69.08812 6.928123 71.69455 5.204416 -2.606430      8.665151 
1 1 1 -15 30 5  o 64.06968 3.652998 50.78864       5.679820 54.05304       10.94253 49.58479       6.645098 64.81438 7.041042 63.10394 4.347820 1.710445       8.275253 
1 1 1 -15 30 6  o 130.1418 3.826498 209.3282       12.12223 0.000000       0.000000 209.3282       12.12223 ?        ?        130.1418 3.826498 0.000000       3.826498 
1 1 1 -15 30 7  o 26.16294 6.213293 8.968719       3.902089 13.59313       7.174636 7.026249       4.649951 31.74298 8.911773 23.43098 7.331521 8.312000       11.53997 
1 1 1 -15 30 8  o 74.74117 3.461338 68.98015       6.287227 73.43680       12.52242 67.47806       7.269962 75.69457 6.863232 73.73724 4.061532 1.957336       7.974960 
1 1 1 -15 30 9  o 85.82634 3.344172 90.86047       6.980931 86.19373       13.58837 92.53382       8.136814 82.00529 6.862568 86.43546 3.872851 -4.430176      7.879962 
1 1 1 -15 30 10 o 53.43772 4.054678 35.55677       5.240671 34.79256       10.35948 35.81960       6.075415 51.01759 8.640729 53.43689 4.713784 -2.419300      9.842863 
1 1 1 -15 30 11 o 75.83417 3.503885 71.10214       6.457664 53.32832       12.52978 77.53088       7.535562 63.52672 8.291454 79.05149 3.924001 -15.52477      9.173113 
1 1 1 -15 30 12 o 45.71904 4.425669 26.22989       4.869153 13.84706       9.405726 30.76331       5.691091 31.95223 10.47189 49.42954 4.784433 -17.47731      11.51309 
1 1 1 -15 30 13 o 46.27369 4.110518 26.78532       4.587001 20.48407       7.923524 29.96157       5.625516 38.75259 8.613653 48.73970 4.798506 -9.987110      9.860055 
1 1 1 -15 30 14 o 15.98295 6.218798 2.183447       3.480258 13.91024       6.684562 -2.177382      4.076315 31.87045 8.464947 12.96592 5.896592 18.90453       10.31626 
1 1 1 -15 30 15 o 44.65007 4.663120 25.20897       4.999106 19.74314       7.847510 28.94191       6.485286 37.82461 8.695837 47.45970 5.722869 -9.635086      10.41003 
1 1 1 -15 30 16 o 44.25085 4.115241 24.60152       4.386789 25.63857       7.824104 24.12605       5.297830 43.68514 7.626966 43.47291 5.097557 0.2122269      9.173641 
1 1 1 -15 30 17 o 52.78558 3.703441 34.78888       4.733607 30.83556       8.130682 36.81589       5.822021 48.13951 7.147556 54.02038 4.462393 -5.880863      8.426180 
1 1 1 -15 30 18 o 45.52965 4.041934 26.09994       4.438003 20.33394       7.499071 29.20792       5.505662 38.22590 8.289539 47.88575 4.781981 -9.659851      9.569943 
1 1 1 -15 30 19 o 21.99196 6.423138 6.470500       3.656567 7.797019       6.660719 5.898266       4.374726 24.58006 8.787955 21.37165 7.146915 3.208403       11.32725 
1 1 1 -15 30 20 o 52.61180 3.592881 34.69442       4.578761 45.60176       8.331072 29.97383       5.480739 59.05911 5.866115 48.39985 4.706206 10.65926       7.520617 
1 1 1 -15 30 21 o 48.20506 5.161379 30.15686       5.968826 21.92709       11.60568 33.11655       6.959846 36.74696 11.59441 50.14765 5.802167 -13.40069      12.96517 
1 1 1 -15 30 22 o 19.27122 6.650978 4.755367       3.791975 9.768835       6.726967 2.420349       4.590874 26.08413 8.862695 17.26875 7.002274 8.815378       11.29510 
1 1 1 -15 30 23 o 21.32847 7.122143 6.190784       4.344687 4.025842       6.752871 7.719921       5.675296 20.58534 8.437485 23.50610 8.135535 -2.920763      11.72084 
1 1 1 -15 30 24 o 42.17272 4.871619 23.34916       4.914648 36.67554       8.003621 15.28279       6.226868 51.62654 6.505930 32.10027 7.991431 19.52626       10.30486 
1 1 1 -15 30 25 o 13.38943 5.903265 -0.2957497     3.755927 8.577435       6.230333 -5.361454      4.707512 24.14167 8.512442 11.88126 5.691392 12.26041       10.23981 
1 1 1 -15 30 26 o 30.14563 5.323927 12.35722       3.768073 3.442203       6.869465 16.19397       4.506540 19.71368 8.327268 34.44970 5.557168 -14.73602      10.01127 
1 1 1 -15 30 27 o 25.33795 6.110355 9.158206       3.728765 13.55682       6.705424 7.189147       4.486394 28.94576 8.759307 22.11802 7.231337 6.827734       11.35859 
1 1 1 -15 30 28 o 12.11875 5.440738 -0.7344612     3.341455 -3.047472      6.161195 0.2293562      3.977165 14.77746 6.905469 13.92950 6.110256 0.8479624      9.220669 
1 1 1 -15 30 29 o 17.30179 6.341162 3.987128       3.495845 3.966810       6.557125 3.995196       4.132062 19.15987 8.116529 17.67497 6.803411 1.484903       10.59077 
1 1 1 -15 30 30 f 26.77952 7.173795 11.29212       4.775422 18.98180       10.47517 9.274726       5.365395 29.53654 10.95017 23.70357 7.914649 5.832975       13.51102 
1 1 1 -15 30 31 o 21.45555 6.714995 7.180938       3.900545 6.870109       8.051006 7.276273       4.458771 21.06693 8.961768 21.34091 7.215770 -0.2739754     11.50568 
1 1 1 -15 30 32 o 27.78737 5.888326 11.48911       3.863199 1.307283       7.065506 15.83110       4.613967 17.08566 7.767420 32.61327 6.027534 -15.52761      9.831784 
1 1 1 -15 30 33 o 35.12268 4.929161 17.39842       4.102920 8.871695       7.176177 21.53933       5.000917 21.83068 8.789408 38.53769 5.479325 -16.70701      10.35745 
1 1 1 -15 31 1  o 93.34586 2.836069 107.3210       6.443827 102.4873       9.279127 111.8233       8.955388 90.63185 4.212889 94.84369 3.882927 -4.211838      5.729359 
1 1 1 -15 31 2  o 73.24741 3.002474 66.19020       5.347934 74.37868       7.806358 58.94834       7.341289 77.22144 4.163740 68.62169 4.413506 8.599747       6.067600 
1 1 1 -15 31 3  o 123.5501 3.837621 189.4109       11.54023 205.8079       19.51747 180.5969       14.30959 126.8474 6.334056 119.9541 4.905613 6.893364       8.011573 
1 1 1 -15 31 4  o 57.73619 3.880337 41.50897       5.427807 39.68595       9.841250 42.30596       6.506985 54.85283 7.563427 58.02552 4.640411 -3.172695      8.873491 
1 1 1 -15 31 5  o 27.25350 6.365983 9.828680       4.151092 11.06116       7.490312 9.282349       4.986974 28.76440 9.339576 26.36116 7.440133 2.403234       11.94082 
1 1 1 -15 31 6  o 47.31662 4.176680 28.03719       4.766545 26.75632       8.743184 28.57888       5.685805 44.49991 8.369710 47.50772 4.985427 -3.007816      9.741998 
1 1 1 -15 31 7  o 57.24566 3.906208 40.82553       5.416567 27.46803       10.21077 46.05639       6.389722 44.38363 9.711148 60.66189 4.351355 -16.27826      10.64146 
1 1 1 -15 31 8  o 65.89114 3.732829 53.94676       5.969269 47.33735       11.26415 56.52769       7.038914 59.71679 7.936779 67.23582 4.318886 -7.519028      9.035776 
1 1 1 -15 31 9  o 41.44258 4.726257 21.75167       4.687881 21.79464       8.951900 21.73543       5.502735 39.49925 9.430826 41.10514 5.642183 -1.605896      10.98976 
1 1 1 -15 31 10 o 28.98184 7.112498 11.28653       4.985137 0.000000       0.000000 11.28653       4.985137 ?        ?        28.98184 7.112498 0.000000       7.112498 
1 1 1 -15 31 11 o 70.83878 3.604504 62.33052       6.201872 48.67203       12.34412 66.94232       7.172891 59.87192 8.716316 73.24502 4.034229 -13.37310      9.604643 
1 1 1 -15 31 12 o 22.99753 6.853166 6.987590       4.128028 3.877882       7.330415 8.431718       4.995414 21.90610 8.860699 25.10866 7.552125 -3.202553      11.64245 
1 1 1 -15 31 13 o 30.23599 5.948425 12.04972       4.226710 5.932182       7.981574 14.43386       4.982721 24.00475 9.395263 32.97903 6.431105 -8.974285      11.38552 
1 1 1 -15 31 14 o 99.07957 3.417082 121.8506       8.238063 109.2056       11.91228 133.4416       11.40503 92.60042 5.301077 102.9624 4.556789 -10.36195      6.990404 
1 1 1 -15 31 15 o 48.96361 3.964684 30.12675       4.690189 18.45144       7.574834 37.38594       5.972870 36.14810 8.703838 54.32550 4.553593 -18.17741      9.823035 
1 1 1 -15 31 16 o 51.67043 4.287824 33.76004       5.350443 30.24382       7.893695 36.74848       7.277186 47.47091 7.036357 53.20563 5.701482 -5.734715      9.056335 
1 1 1 -15 31 17 o 57.50634 4.095954 41.71972       5.702359 45.06676       8.478815 38.95553       7.705277 58.65883 6.016698 54.58441 5.885664 4.074421       8.416751 
1 1 1 -15 31 18 f 56.49373 3.608633 40.03687       4.941997 36.78482       8.435670 41.73627       6.098046 52.30850 6.776891 57.29014 4.401638 -4.981640      8.080883 
1 1 1 -15 31 19 o 27.22186 6.110099 10.07889       3.953537 11.92348       6.617772 9.055198       4.930001 28.60524 8.711314 25.40265 7.468920 3.202587       11.47483 
1 1 1 -15 31 20 o 66.60340 6.028026 59.00148       9.677980 63.65612       14.17114 54.93300       13.24883 65.94962 9.056655 61.08687 9.184039 4.862755       12.89843 
1 1 1 -15 31 21 o 27.45259 6.738116 10.60292       4.473685 11.34554       6.515551 9.940553       6.153458 27.56286 8.686158 26.03247 8.466126 1.530392       12.12949 
1 1 1 -15 31 22 o 37.52581 5.333663 18.78673       4.740238 22.59364       7.710626 16.47382       6.010125 38.94575 8.373543 33.72639 7.506007 5.219364       11.24528 
1 1 1 -15 31 23 o 48.77793 3.833200 30.41830       4.519807 20.24419       7.569142 36.05653       5.634686 36.34032 8.668886 52.72879 4.425972 -16.38846      9.733387 
1 1 1 -15 31 24 o 15.60424 6.433827 1.839290       3.956738 -2.796662      5.934371 5.549708       5.309049 14.90772 6.901712 20.58120 7.761741 -5.673474      10.38645 
1 1 1 -15 31 25 o 20.43482 6.597982 5.922202       3.741378 4.376109       7.890102 6.370688       4.249516 20.88637 8.877875 21.08675 7.043750 -0.2003765     11.33274 
1 1 1 -15 31 26 o 15.99584 6.167343 2.898517       3.399563 -3.242366      6.060565 5.717777       4.106437 14.62519 6.839060 20.04870 6.921175 -5.423506      9.730129 
1 1 1 -15 31 27 o 16.57237 6.201267 3.446717       3.374696 1.251383       6.168366 4.384510       4.031561 17.11535 7.554770 18.16388 6.781770 -1.048531      10.15219 
1 1 1 -15 31 28 o 10.86140 5.174158 -3.662859      3.778207 -9.308755      6.028133 -0.1003182E-01 4.848763 12.00038 5.901363 14.72294 6.586152 -2.722558      8.843273 
1 1 1 -15 31 29 o 13.60243 6.147954 -0.5160527     4.349063 17.60009       8.657802 -6.630177      5.029699 29.69327 10.05484 11.45221 5.580276 18.24106       11.49954 
1 1 1 -15 31 30 o 12.69372 5.801091 -1.016062      4.007406 0.000000       0.000000 -1.016062      4.007406 ?        ?        12.69372 5.801091 0.000000       5.801091 
1 1 1 -15 31 31 o 21.39611 6.506231 7.193870       3.693341 15.87597       6.827477 3.602198       4.391330 29.16490 8.841419 16.86696 6.845089 12.29794       11.18150 
1 1 1 -15 32 1  o 59.22308 3.119547 43.50073       4.486259 43.98465       6.366870 43.02354       6.322419 59.01781 4.459981 58.35693 4.480113 0.6608887      6.321617 
1 1 1 -15 32 2  o 117.4216 3.203685 170.7481       9.158571 167.8317       12.14352 174.5952       13.94739 115.6578 4.316144 117.4977 4.881739 -1.839844      6.516170 
1 1 1 -15 32 3  o 87.32888 3.884815 95.19646       8.246619 89.29036       12.84801 99.33447       10.75428 82.89029 6.410350 88.52009 5.005838 -5.629799      8.133327 
1 1 1 -15 32 4  o 73.47681 3.440306 67.07308       6.142937 68.54486       11.55277 66.49294       7.253311 72.44925 6.616545 72.86383 4.101522 -0.4145813     7.784674 
1 1 1 -15 32 5  o 88.84113 3.326300 97.86699       7.188593 95.50707       13.27079 98.84700       8.551930 85.79205 6.393629 88.96809 3.954398 -3.176048      7.517696 
1 1 1 -15 32 6  o 17.50352 6.586690 3.143831       3.818623 6.453391       6.919484 1.694479       4.579051 23.65967 8.874267 16.89828 6.939488 6.761389       11.26539 
1 1 1 -15 32 7  o 11.69606 5.440947 -3.054788      3.756469 -2.832594      6.532323 -3.164569      4.591630 16.41629 7.465258 13.19731 6.096104 3.218975       9.638079 
1 1 1 -15 32 8  o 72.27145 3.465999 64.94126       6.086443 66.23534       11.82024 64.47436       7.100047 70.92966 6.926691 71.73608 4.078310 -0.8064270     8.038138 
1 1 1 -15 32 9  o 37.16706 6.325295 18.27469       5.523929 0.000000       0.000000 18.27469       5.523929 ?        ?        37.16706 6.325295 0.000000       6.325295 
1 1 1 -15 32 10 o 27.76451 6.493615 10.38307       4.314744 27.38237       8.663229 4.775224       4.975794 44.50895 8.292254 20.46730 7.554358 24.04166       11.21739 
1 1 1 -15 32 11 o 27.47515 6.400256 10.17073       4.205253 -3.391837      8.002746 15.34423       4.942657 17.92585 8.194323 33.98451 6.196436 -16.05867      10.27340 
1 1 1 -15 32 12 o 51.46245 4.142136 33.41532       5.150741 37.80304       10.21664 31.92004       5.964164 52.27211 8.297414 49.91915 4.968731 2.352966       9.671369 
1 1 1 -15 32 13 o 39.78497 5.601960 20.69677       5.281001 27.54081       9.701414 17.81473       6.295482 43.60279 9.406868 35.96994 7.428226 7.632847       11.98615 
1 1 1 -15 32 14 o 16.93621 6.586123 2.714977       3.901875 1.459303       8.103306 3.093994       4.451975 20.51852 8.863767 17.98421 7.023251 2.534307       11.30895 
1 1 1 -15 32 15 o 38.25166 4.659038 18.83569       4.253446 11.39064       7.094885 23.01283       5.314362 28.12043 9.086449 42.01589 5.308698 -13.89546      10.52358 
1 1 1 -15 32 16 o 17.65463 6.866303 3.097305       4.241304 11.42515       6.636614 -2.652111      5.514323 28.05223 8.755963 14.79350 6.777333 13.25873       11.07245 
1 1 1 -15 32 17 o 62.90513 3.881442 50.04891       5.921000 50.27253       8.897257 49.87115       7.932633 61.51337 6.012072 61.81877 5.317376 -0.3054047     8.026175 
1 1 1 -15 32 18 o 15.64703 6.770462 0.4377727      4.743313 -5.291650      6.223774 8.377144       7.326414 14.36215 6.782665 24.68030 9.156219 -10.31816      11.39478 
1 1 1 -15 32 19 o 47.91785 5.412871 30.43325       6.210129 38.42104       12.56032 27.84881       7.144480 48.52398 10.89011 44.86174 6.743655 3.662239       12.80903 
1 1 1 -15 32 20 o 10.36847 4.921885 -3.561833      3.358616 -1.865608      5.981700 -4.342796      4.058805 15.62247 7.119561 11.29096 5.374294 4.331514       8.920268 
1 1 1 -15 32 21 o 13.90335 5.905748 0.7405071      3.487513 5.552936       6.536862 -1.174328      4.123375 21.36523 8.459416 13.32104 6.006714 8.044192       10.37508 
1 1 1 -15 32 22 o 31.88999 5.295667 13.75679       3.971106 14.93152       7.041828 13.20900       4.808672 30.67228 8.900784 30.38781 6.676417 0.2844772      11.12648 
1 1 1 -15 32 23 o 32.44761 6.087012 14.76269       4.636326 6.336058       7.046363 21.19601       6.156810 21.91986 8.748983 38.41930 6.826225 -16.49944      11.09694 
1 1 1 -15 32 24 o 10.86083 5.130175 -3.197167      3.563892 -1.386897      7.981224 -3.648019      3.983042 17.58038 8.090620 11.37033 5.386474 6.210048       9.719683 
1 1 1 -15 32 25 o 24.95926 6.210160 9.063361       3.761882 11.87993       7.039274 7.937378       4.450756 26.47036 9.064544 22.87846 7.174825 3.591904       11.56045 
1 1 1 -15 32 26 o 30.46791 6.269779 13.55052       4.499793 15.44208       7.211381 12.34442       5.758362 29.72828 9.101511 27.50102 8.068314 2.227261       12.16286 
1 1 1 -15 32 27 f 13.16372 5.904217 -0.3735935     3.924622 -4.224749      6.347114 2.010265       4.993683 14.16169 6.735006 16.28638 6.996051 -2.124688      9.711078 
1 1 1 -15 32 28 o 8.844596 4.378377 -6.912307      3.513376 -10.26839      7.229528 -5.874620      4.020008 12.98750 6.401485 10.15120 4.955655 2.836299       8.095525 
1 1 1 -15 32 29 f 11.61485 5.402188 -1.891151      3.700521 13.94370       10.77659 -4.007885      3.940100 24.98725 10.48506 10.81529 5.187676 14.17196       11.69822 
1 1 1 -15 32 30 o 22.51266 6.539552 8.009406       3.799499 4.505341       6.416292 9.901678       4.715087 18.58428 7.955637 24.33156 7.341327 -5.747276      10.82531 
1 1 1 -15 33 1  o 67.93053 3.882508 58.07352       6.400310 64.27354       10.66968 54.58856       7.999335 69.67888 6.353498 65.12324 5.080778 4.555641       8.135185 
1 1 1 -15 33 2  o 12.89546 5.957771 -2.887827      4.388542 -5.984057      5.428088 2.955599       7.456998 13.02704 6.204704 20.85715 8.734954 -7.830112      10.71437 
1 1 1 -15 33 3  o 66.11305 3.892243 54.96475       6.243062 44.76834       10.48335 60.56806       7.771388 57.11639 7.730124 68.96119 4.651640 -11.84480      9.021783 
1 1 1 -15 33 4  o 31.41413 5.804260 13.11754       4.279687 7.957164       7.338732 15.77687       5.268252 24.88314 9.176114 34.16333 6.566562 -9.280190      11.28365 
1 1 1 -15 33 5  o 13.97087 6.019720 0.1128798      3.718710 3.661686       6.340236 -1.748180      4.591393 20.41814 8.247111 13.99600 6.322220 6.422143       10.39160 
1 1 1 -15 33 6  o 14.68824 6.044366 1.226512       3.483246 -2.966959      6.267137 3.100937       4.190023 15.79909 7.233198 17.71084 6.842035 -1.911757      9.956535 
1 1 1 -15 33 7  o 77.24866 3.507046 74.53998       6.584675 88.32295       12.65488 69.42300       7.710689 81.84312 6.395877 74.09507 4.288720 7.748055       7.700673 
1 1 1 -15 33 8  o 14.58892 6.433061 -0.6130436     4.461894 0.000000       0.000000 -0.6130436     4.461894 ?        ?        14.58892 6.433061 0.000000       6.433061 
1 1 1 -15 33 9  o 37.18432 5.216231 18.02661       4.596834 28.70166       9.135663 14.40756       5.319273 44.84805 8.672834 32.38205 6.948862 12.46600       11.11327 
1 1 1 -15 33 10 o 46.45341 4.812387 27.76518       5.368897 45.58660       10.62386 21.65267       6.221870 57.43235 7.791602 40.04250 6.606411 17.38985       10.21537 
1 1 1 -15 33 11 o 43.11201 6.441846 24.98539       6.560511 0.000000       0.000000 24.98539       6.560511 ?        ?        43.11201 6.441846 0.000000       6.441846 
1 1 1 -15 33 12 o 47.52511 6.107547 30.09793       6.910042 34.84259       10.20839 26.08551       9.387667 49.03768 8.869009 41.82367 9.436007 7.214008       12.94981 
1 1 1 -15 33 13 f 40.27092 5.447539 21.38365       5.209023 23.50632       9.096990 20.34813       6.353798 39.37876 9.573973 38.32659 7.063116 1.052170       11.89742 
1 1 1 -15 33 14 o 46.65677 4.940042 28.31239       5.531482 34.87504       9.659521 25.11032       6.747331 49.20907 8.353547 42.83444 6.682032 6.374630       10.69726 
1 1 1 -15 33 15 o 42.39702 5.441368 23.81588       5.492401 21.90093       9.329967 24.83145       6.794469 37.19551 10.05496 42.39562 6.806870 -5.200108      12.14231 
1 1 1 -15 33 16 o 46.96589 4.472889 28.51387       5.057515 21.75716       9.537152 31.15733       5.965370 36.63695 10.27089 48.70294 5.101898 -12.06599      11.46824 
1 1 1 -15 33 17 o 29.90169 5.724864 12.18661       4.019671 11.75576       6.925343 12.40552       4.936286 27.68672 8.979740 29.47116 6.981336 -1.784441      11.37430 
1 1 1 -15 33 18 o 38.52838 4.594339 19.41662       4.228709 21.94254       7.245381 18.11168       5.207698 38.56323 7.973448 36.28800 6.105625 2.275234       10.04264 
1 1 1 -15 33 19 o 27.46183 5.840954 10.44401       3.788525 13.60425       6.958938 9.112826       4.516503 29.38989 8.929554 25.03380 7.085649 4.356091       11.39927 
1 1 1 -15 33 20 o 27.83473 6.781830 11.20857       4.557202 9.723508       6.931733 12.33911       6.047994 25.11179 8.966433 28.25533 8.262989 -3.143538      12.19319 
1 1 1 -15 33 21 o 40.68200 4.379863 21.69839       4.273763 19.38658       7.427577 22.84258       5.225426 34.94235 8.744609 41.07069 5.347888 -6.128338      10.25027 
1 1 1 -15 33 22 o 29.96938 5.609616 12.49252       3.946282 9.827169       7.036621 13.71546       4.766402 24.75051 9.008134 30.76784 6.557695 -6.017330      11.14225 
1 1 1 -15 33 23 o 28.94295 6.452502 12.23263       4.434833 15.80467       7.074159 9.919816       5.692289 30.68196 8.926321 24.91703 8.145352 5.764931       12.08412 
1 1 1 -15 33 24 o 18.35293 6.774375 4.606173       4.001448 6.914496       6.491817 3.191824       5.081551 21.52574 8.458817 17.55740 7.270130 3.968338       11.15376 
1 1 1 -15 33 25 o 26.44581 6.943212 10.80508       4.530718 13.75368       7.524613 9.128081       5.674706 27.36628 9.371809 23.49966 8.135021 3.866619       12.41005 
1 1 1 -15 33 26 o 13.15825 5.838999 0.3888915E-01  3.732617 2.906402       8.274461 -0.6937038     4.182331 19.03621 8.552770 13.24548 6.003581 5.790722       10.44954 
1 1 1 -15 33 27 o 17.39849 6.480122 4.245883       3.676470 2.330858       6.738203 5.057635       4.387010 17.62590 7.832025 18.60308 7.046663 -0.9771824     10.53547 
1 1 1 -15 33 28 o 16.20545 6.477836 3.252453       3.868684 14.88175       10.27103 1.329803       4.176259 25.52146 10.42685 14.62483 6.340453 10.89663       12.20330 
1 1 1 -15 34 1  o 51.56398 3.875899 33.78336       4.834644 32.97361       6.080183 35.17556       7.972493 50.24553 5.033430 50.74194 6.604032 -0.4964104     8.303533 
1 1 1 -15 34 2  o 29.36191 4.972451 11.38918       3.431025 8.617755       4.730298 14.46591       4.984045 24.65424 7.333456 32.35014 6.547213 -7.695900      9.830848 
1 1 1 -15 34 3  o 39.18910 4.079032 19.64622       3.838518 22.29679       5.700998 17.44810       5.191651 40.77969 5.908765 35.85623 6.163742 4.923462       8.538455 
1 1 1 -15 34 4  o 24.67298 6.511394 8.457722       3.971386 6.879986       6.729447 9.300857       4.919385 23.13912 8.735885 25.57177 7.444914 -2.432650      11.47791 
1 1 1 -15 34 5  o 24.71050 6.575824 8.493683       4.029039 3.566441       6.947282 10.99074       4.945695 20.51107 8.497588 27.83974 7.227347 -7.328671      11.15543 
1 1 1 -15 34 6  f 12.04413 5.452465 -1.422733      3.437209 -0.9266379E-01 5.974045 -2.080916      4.202469 16.90269 7.448926 12.97685 5.934312 3.925840       9.523789 
1 1 1 -15 34 7  o 15.83967 6.768148 0.8372555      4.628215 0.000000       0.000000 0.8372555      4.628215 ?        ?        15.83967 6.768148 0.000000       6.768148 
1 1 1 -15 34 8  o 41.55852 4.879306 22.50508       4.847434 17.76770       8.786370 24.57793       5.811971 33.60755 9.994205 42.97301 5.689647 -9.365463      11.50027 
1 1 1 -15 34 9  o 42.39878 4.627173 23.28828       4.703345 20.96638       8.372831 24.35874       5.685075 37.07226 9.288205 42.81711 5.581292 -5.744846      10.83612 
1 1 1 -15 34 10 o 36.48669 5.284933 17.64324       4.562383 18.77096       8.871655 17.23776       5.319749 34.37957 9.994577 35.42530 6.397662 -1.045731      11.86683 
1 1 1 -15 34 11 o 18.63712 6.791369 4.270810       4.001253 -0.2753929     7.860266 5.860908       4.648629 18.73377 8.382602 20.97441 7.356406 -2.240646      11.15279 
1 1 1 -15 34 12 o 38.02683 5.940830 19.61380       5.325231 18.88007       8.937571 20.01765       6.630728 34.18549 10.05782 37.31475 7.551494 -3.129253      12.57715 
1 1 1 -15 34 13 f 23.59644 8.261998 7.928582       5.861991 0.000000       0.000000 7.928582       5.861991 ?        ?        23.59644 8.261998 0.000000       8.261998 
1 1 1 -15 34 14 o 10.28698 4.945103 -4.683518      3.625088 -1.724942      6.907160 -5.808255      4.258763 16.79714 7.653200 10.93694 5.283114 5.860201       9.299611 
1 1 1 -15 34 15 o 19.14384 6.723482 4.825119       3.884016 6.146214       7.381675 4.319339       4.567391 22.32391 8.939733 18.94009 7.186445 3.383816       11.47013 
1 1 1 -15 34 16 o 41.79031 5.288500 23.37139       5.265318 16.37147       9.209838 26.77018       6.417531 31.03420 10.36962 44.11379 6.135604 -13.07959      12.04884 
1 1 1 -15 34 17 o 20.07590 6.802706 5.575520       3.963007 10.89758       8.802998 4.222732       4.438189 26.19767 9.968270 18.61599 7.079244 7.581680       12.22629 
1 1 1 -15 34 18 o 13.82504 6.109467 -0.2084091     4.045129 -1.443921      10.02184 0.3205432E-01  4.421284 19.44567 8.990788 14.56404 6.413621 4.881637       11.04395 
1 1 1 -15 34 19 o 43.47199 4.422114 24.83275       4.619495 26.62513       7.945708 23.91758       5.677633 41.76711 8.098969 41.66147 5.745167 0.1056366      9.929766 
1 1 1 -15 34 20 o 19.19199 6.585383 5.160904       3.715816 6.167566       6.797843 4.731959       4.437417 21.36204 8.570580 18.92024 7.104485 2.441799       11.13232 
1 1 1 -15 34 21 o 13.68827 6.195110 -0.9198238     4.433726 -10.55177      8.507243 2.672001       5.195047 14.60464 7.146683 17.31563 7.273784 -2.710995      10.19721 
1 1 1 -15 34 22 o 12.40835 5.899016 -4.128345      4.860377 -5.101833      6.161227 -2.524365      7.908629 13.72610 6.557768 16.64307 7.792335 -2.916967      10.18454 
1 1 1 -15 34 23 o 21.24438 7.286726 6.983601       4.549306 5.028165       8.147927 7.869305       5.483650 20.42018 8.854598 22.15140 7.967239 -1.731224      11.91137 
1 1 1 -15 34 24 o 30.68378 6.052925 13.81196       4.365113 16.30571       8.928971 13.02880       5.003819 28.34105 10.16987 28.76867 7.164750 -0.4276237     12.44026 
1 1 1 -15 34 25 o 29.30544 5.962363 12.65553       4.112905 -1.405083      6.882837 20.46475       5.129432 15.79289 7.352889 37.62563 5.778833 -21.83274      9.351999 
1 1 1 -15 34 26 o 15.49607 6.275659 2.701869       3.682285 2.685790       6.429154 2.709719       4.492062 17.52943 7.726199 16.16834 6.775980 1.361090       10.27658 
1 1 1 -15 34 27 o 13.38785 6.007059 -0.2777468E-01 4.066842 -19.20466      10.67556 3.227643       4.398506 13.97718 7.025806 16.49955 6.791234 -2.522366      9.771531 
1 1 1 -15 35 1  o 23.48524 5.579957 7.609638       3.145981 8.730376       4.412704 6.451159       4.486388 24.55534 7.021576 21.44101 7.238111 3.114336       10.08428 
1 1 1 -15 35 2  o 41.37777 3.823951 21.93094       3.812206 25.46986       5.346066 18.26974       5.437648 43.82290 5.101332 36.21452 6.395362 7.608379       8.180724 
1 1 1 -15 35 3  f 45.29990 3.787075 26.21724       4.142367 39.23981       6.451511 17.08267       5.403275 54.67811 4.893538 34.87937 6.598629 19.79874       8.215145 
1 1 1 -15 35 4  o 26.44952 6.248118 9.811078       3.962665 13.11249       7.272638 8.417069       4.725793 28.87348 9.186663 24.09577 7.366101 4.777704       11.77515 
1 1 1 -15 35 5  o 17.01023 6.427218 3.300764       3.644297 -1.820941      6.394942 5.764005       4.434888 16.12643 7.353906 20.61686 7.188499 -4.490435      10.28370 
1 1 1 -15 35 6  o 27.97572 7.052715 11.28606       4.806050 0.000000       0.000000 11.28606       4.806050 ?        ?        27.97572 7.052715 0.000000       7.052715 
1 1 1 -15 35 7  o 25.50380 6.628180 9.253496       4.156622 12.08067       7.702471 8.091884       4.937246 27.71338 9.482169 23.64501 7.574294 4.068361       12.13596 
1 1 1 -15 35 8  o 29.00778 6.225175 11.74552       4.268774 11.75929       8.109719 11.74024       5.020605 27.33034 9.704791 28.42211 7.232118 -1.091772      12.10316 
1 1 1 -15 35 9  o 17.62697 6.547883 3.731669       3.749037 1.763252       6.270557 4.826743       4.677022 18.19862 7.828852 19.58299 7.305924 -1.384367      10.70829 
1 1 1 -15 35 10 o 32.27421 5.630287 14.18413       4.267189 16.32274       7.891166 13.30032       5.072861 31.83308 9.472600 30.40072 6.993253 1.432360       11.77437 
1 1 1 -15 35 11 o 20.66006 7.359215 5.794849       4.666706 2.579283       7.154444 8.176149       6.156788 19.49411 8.373964 23.68364 8.451051 -4.189529      11.89721 
1 1 1 -15 35 12 o 13.76634 6.061264 -0.1780148     3.947200 3.436072       7.453183 -1.586809      4.653356 20.24006 8.616760 13.83436 6.294897 6.405692       10.67119 
1 1 1 -15 35 13 o 28.04601 6.248903 11.11381       4.161468 16.64706       8.518068 9.379125       4.769382 31.43573 9.934962 25.18441 7.330067 6.251316       12.34639 
1 1 1 -15 35 14 o 25.63149 6.614741 9.493117       4.159378 6.916098       7.771828 10.52752       4.923891 22.74522 9.150661 26.58134 7.353381 -3.836123      11.73911 
1 1 1 -15 35 15 o 14.24823 6.658305 -3.370116      5.728540 0.000000       0.000000 -3.370116      5.728540 ?        ?        14.24823 6.658305 0.000000       6.658305 
1 1 1 -15 35 16 o 32.68554 5.754941 14.85325       4.416520 15.65553       9.350028 14.62284       5.010748 29.48568 10.42529 31.75969 6.686062 -2.274008      12.38508 
1 1 1 -15 35 17 o 27.10213 7.033127 11.00114       4.684672 0.000000       0.000000 11.00114       4.684672 ?        ?        27.10213 7.033127 0.000000       7.033127 
1 1 1 -15 35 18 o 20.45375 7.362281 6.046485       4.683550 2.893127       7.448127 8.108891       6.023480 19.24638 8.404027 22.85097 8.331773 -3.604595      11.83411 
1 1 1 -15 35 19 o 12.32258 5.671672 -1.733819      3.923949 1.157237       6.013871 -3.877113      5.178057 16.87288 7.453132 13.01597 6.158810 3.856912       9.668510 
1 1 1 -15 35 20 o 28.66330 7.071009 12.62650       4.908017 13.95582       8.631813 11.99140       5.966347 27.14800 9.961866 26.81380 8.291210 0.3342056      12.96082 
1 1 1 -15 35 21 o 17.35401 6.971348 3.625644       4.503635 8.766736       7.717875 0.9711688      5.545738 22.82100 9.140282 16.06572 7.123857 6.755283       11.58853 
1 1 1 -15 35 22 f 18.43355 6.689053 4.910136       3.875968 8.061873       8.115547 3.978785       4.411634 22.11613 9.175375 17.56759 6.951504 4.548532       11.51134 
1 1 1 -15 35 23 o 26.22708 6.380771 10.45681       4.038648 12.65786       7.072160 9.391666       4.919742 26.04189 9.077795 23.86158 7.551503 2.180311       11.80811 
1 1 1 -15 35 24 o 13.38444 6.038926 -0.3204174     4.174947 4.501915       6.366069 -3.959651      5.530288 18.76396 7.975069 13.10528 6.247805 5.658685       10.13098 
1 1 1 -15 35 25 o 16.86532 6.522191 3.869454       3.810357 -0.7564430     6.419989 6.385148       4.734402 15.49823 7.176300 19.98025 7.369851 -4.482024      10.28659 
1 1 1 -15 36 1  f 27.82397 4.882401 10.45426       3.189783 12.70303       4.308296 7.726060       4.745382 29.97340 6.105967 22.79775 7.436078 7.175648       9.621750 
1 1 1 -15 36 2  o 12.84262 5.285459 1.088128       2.663857 -2.751598      3.447908 6.774182       4.195764 10.94295 5.130452 21.62131 6.987683 -10.67836      8.668866 
1 1 1 -15 36 3  o 14.81263 5.750041 2.270126       2.969995 3.315989       4.215260 1.239070       4.185314 17.33983 6.815469 15.23633 6.470717 2.103503       9.397915 
1 1 1 -15 36 4  o 53.49891 3.778944 36.72942       4.894947 48.67077       9.632175 32.57178       5.683559 58.41595 6.899363 49.64381 4.756166 8.772137       8.379876 
1 1 1 -15 36 5  o 32.22959 5.580517 14.26769       4.224281 10.46335       7.804848 15.84385       5.023706 25.62716 9.460823 33.43616 6.398565 -7.809004      11.42142 
1 1 1 -15 36 6  o 20.00249 7.122479 5.487119       4.370926 0.000000       0.000000 5.487119       4.370926 ?        ?        20.00249 7.122479 0.000000       7.122479 
1 1 1 -15 36 7  o 17.92117 6.716579 3.977692       3.962099 -6.019062      7.106200 8.487233       4.772810 14.83138 7.073920 23.87687 7.421092 -9.045499      10.25246 
1 1 1 -15 36 8  o 23.68791 6.726578 8.169498       4.063656 11.57797       7.518117 6.762680       4.830013 26.66107 9.354964 21.66022 7.504826 5.000845       11.99324 
1 1 1 -15 36 9  o 33.89732 5.477466 15.71904       4.370383 20.18570       8.074264 13.86814       5.197598 35.09462 9.295049 30.69490 7.091300 4.399715       11.69121 
1 1 1 -15 36 10 o 13.73788 6.176263 -0.8360516     4.322739 2.828025       6.809326 -3.309501      5.594656 19.07111 8.180490 14.07839 6.579295 4.992723       10.49798 
1 1 1 -15 36 11 o 13.90160 6.083766 0.1815779      3.922249 -5.232260      7.227536 2.441534       4.669685 15.19810 7.216132 16.82840 6.968866 -1.630295      10.03183 
1 1 1 -15 36 12 o 13.66556 6.217114 -1.323016      4.536846 -10.59014      7.669108 3.666095       5.627091 13.83407 6.772954 18.68323 7.684789 -4.849163      10.24348 
1 1 1 -15 36 13 o 17.68973 7.055954 3.512615       4.580122 2.893699       7.489330 3.882377       5.788804 19.40062 8.450030 18.92201 7.789910 0.4786148      11.49286 
1 1 1 -15 36 14 o 13.79135 6.254369 -1.054147      4.546465 5.343359       7.596812 -4.624189      5.674958 20.97151 8.801859 13.42364 6.379545 7.547873       10.87066 
1 1 1 -15 36 15 o 17.77714 7.005254 3.798662       4.463294 4.368100       7.430676 3.477254       5.582563 20.10567 8.582996 18.28135 7.599368 1.824327       11.46378 
1 1 1 -15 36 16 o 17.68933 7.428268 3.013007       5.415227 0.000000       0.000000 3.013007       5.415227 ?        ?        17.68933 7.428268 0.000000       7.428268 
1 1 1 -15 36 17 o 41.87049 5.782762 24.80469       5.743004 0.000000       0.000000 24.80469       5.743004 ?        ?        41.87049 5.782762 0.000000       5.782762 
1 1 1 -15 36 18 o 12.51748 5.689522 -0.9941368     3.788556 -1.866832      7.151875 -0.6537227     4.466757 16.06338 7.484321 13.74419 6.219503 2.319196       9.731253 
1 1 1 -15 36 19 o 14.87878 6.212069 1.867468       3.754147 -2.290330      7.257617 3.386374       4.386597 15.88763 7.447017 16.98099 6.859460 -1.093358      10.12473 
1 1 1 -15 36 20 o 10.97785 5.275780 -4.414971      4.119676 -8.242933      5.812107 -0.5499173     5.840197 11.93962 5.855944 15.29784 6.995706 -3.358218      9.123156 
1 1 1 -15 36 21 o 17.40769 6.558997 4.210739       3.789254 -2.156223      6.392478 7.659843       4.704964 14.95073 7.001824 21.72741 7.411462 -6.776677      10.19585 
1 1 1 -15 36 22 o 21.50449 6.800033 7.323325       3.990034 16.09858       7.078660 3.236827       4.830553 29.34813 9.023374 16.90236 7.050981 12.44577       11.45153 
1 1 1 -15 37 1  o 15.31743 5.822253 2.764091       3.001189 1.094933       4.239249 4.441264       4.249413 14.92241 6.428456 18.30208 6.934674 -3.379672      9.455937 
1 1 1 -15 37 2  o 13.10681 5.473196 1.078300       2.914954 0.9035056      3.948555 1.287660       4.321359 14.40926 6.205734 15.21194 6.520821 -0.8026876     9.001791 
1 1 1 -15 37 3  o 11.85910 5.203186 -0.6819288E-01 2.885389 1.639805       3.959529 -2.002239      4.213406 15.12020 6.350792 12.63917 5.838764 2.481037       8.626919 
1 1 1 -15 37 4  o 28.11629 6.297739 11.49603       4.207591 20.98533       7.362954 6.894547       5.127244 36.02472 8.521463 21.46210 7.705878 14.56262       11.48895 
1 1 1 -15 37 5  o 31.39689 8.250982 15.84811       6.394222 0.000000       0.000000 15.84811       6.394222 ?        ?        31.39689 8.250982 0.000000       8.250982 
1 1 1 -15 37 6  o 30.88449 6.118986 13.67419       4.442399 13.59109       7.970048 13.71164       5.350656 27.69507 9.637917 29.90504 7.386324 -2.209970      12.14279 
1 1 1 -15 37 7  o 13.95757 6.048105 0.5981902      3.796112 1.536750       6.625607 0.1395292      4.631701 17.74468 7.831284 14.71447 6.518269 3.030213       10.18905 
1 1 1 -15 37 8  o 23.16823 6.696454 8.014078       3.993111 7.425116       6.585986 8.356436       5.021311 22.17251 8.574704 23.20204 7.653741 -1.029530      11.49371 
1 1 1 -15 37 9  o 25.16164 8.109555 10.19804       5.653666 1.277342       7.310988 23.46866       8.917069 18.10479 8.093984 36.42154 9.823178 -18.31675      12.72821 
1 1 1 -15 37 10 o 23.66634 6.748466 8.424163       4.081695 11.27574       7.170337 7.057168       4.964560 25.64090 9.123318 21.56542 7.599153 4.075483       11.87359 
1 1 1 -15 37 11 o 47.80725 4.534777 30.49365       5.219893 37.51020       10.27636 28.05374       6.059881 47.31790 9.243690 44.78021 5.680846 2.537693       10.84978 
1 1 1 -15 37 12 o 37.36249 6.187747 20.12949       5.436818 19.00731       8.764922 20.83130       6.931442 31.79333 10.08163 36.08447 8.083590 -4.291142      12.92222 
1 1 1 -15 37 13 o 43.90206 4.867428 26.21112       5.120003 28.50692       9.688893 25.32163       6.030838 39.52892 10.04049 41.99984 6.068138 -2.470913      11.73174 
1 1 1 -15 37 14 o 25.13131 6.775044 9.679530       4.242883 6.504672       7.433407 11.21372       5.167322 21.15390 8.779184 26.37994 7.615525 -5.226048      11.62197 
1 1 1 -15 37 15 o 15.14470 6.612761 1.056726       4.611079 0.000000       0.000000 1.056726       4.611079 ?        ?        15.14470 6.612761 0.000000       6.612761 
1 1 1 -15 37 16 o 22.86883 6.891889 8.160233       4.157199 0.6825203      8.271887 10.68717       4.808586 18.00080 8.266695 25.85033 7.309265 -7.849539      11.03465 
1 1 1 -15 37 17 o 23.25850 6.891870 8.492393       4.184168 15.28829       8.559428 6.358516       4.796296 27.59193 9.950105 20.26643 7.427579 7.325506       12.41666 
1 1 1 -15 37 18 f 16.75031 6.652841 3.509898       4.054863 11.33252       7.999803 0.8052615      4.703896 24.33992 9.440129 14.90841 6.588205 9.431518       11.51175 
1 1 1 -15 37 19 o 15.35308 7.038960 -0.4323397     5.963264 0.000000       0.000000 -0.4323397     5.963264 ?        ?        15.35308 7.038960 0.000000       7.038960 
1 1 1 -15 37 20 o 42.81346 4.834338 25.40103       4.955640 19.26220       9.469750 27.71621       5.815517 29.52860 10.48686 43.92505 5.557173 -14.39645      11.86830 
1 1 1 -15 38 1  o 18.27949 6.003609 4.864698       3.090798 7.318443       4.343632 2.348012       4.398989 21.56833 7.118717 15.94967 6.696239 5.618656       9.773216 
1 1 1 -15 38 2  o 19.05894 6.025520 5.339409       3.133019 8.086169       4.552653 2.868319       4.318157 22.54061 7.278291 16.39717 6.736862 6.143440       9.917602 
1 1 1 -15 38 3  o 15.19213 5.811677 2.785758       3.002514 3.109399       4.077459 2.402390       4.437780 16.46863 6.627164 16.08163 6.736959 0.3869972      9.450181 
1 1 1 -15 38 4  o 12.69034 5.863701 -1.755743      4.252903 0.000000       0.000000 -1.755743      4.252903 ?        ?        12.69034 5.863701 0.000000       5.863701 
1 1 1 -15 38 5  o 60.97308 4.695785 50.28779       6.923508 56.06824       10.53511 45.89335       9.185658 60.42554 7.302495 55.09669 6.999205 5.328854       10.11510 
1 1 1 -15 38 6  o 32.46737 5.966465 15.28323       4.546729 12.81429       7.769857 16.56894       5.606968 26.20354 9.475971 32.62104 7.242172 -6.417498      11.92657 
1 1 1 -15 38 7  o 19.20047 6.802167 5.427201       3.982072 1.692178       6.506801 7.663695       5.035061 17.34577 7.702594 21.91928 7.658356 -4.573502      10.86188 
1 1 1 -15 38 8  o 17.54743 7.443379 3.062126       5.526967 4.578737       6.931149 0.4137983      9.159129 19.49498 8.304869 18.52576 8.575864 0.9692135      11.93802 
1 1 1 -15 38 9  o 11.65863 5.373144 -1.584153      3.538142 -5.258360      5.835485 0.5517469      4.449237 13.10816 6.294236 14.55017 6.419619 -1.442011      8.990491 
1 1 1 -15 38 10 o 31.45790 5.893093 14.35194       4.351649 8.911613       7.271033 17.38818       5.431892 22.82212 8.956946 33.80403 6.829300 -10.98190      11.26349 
1 1 1 -15 38 11 o 17.16973 6.858732 3.634076       4.334104 3.830883       6.316617 3.458992       5.957805 18.55712 7.917455 18.06941 7.698702 0.4877167      11.04337 
1 1 1 -15 38 12 o 21.13863 6.834582 6.924332       4.013656 7.807576       7.239814 6.532420       4.822603 21.81557 8.812338 20.48900 7.457448 1.326565       11.54430 
1 1 1 -15 38 13 o 12.66445 5.745148 -0.7831634     3.839983 -0.7283036     6.608176 -0.8111325     4.718380 15.92768 7.341534 13.85601 6.317879 2.071671       9.685748 
1 1 1 -15 38 14 o 18.72932 7.342400 4.999783       4.881321 0.000000       0.000000 4.999783       4.881321 ?        ?        18.72932 7.342400 0.000000       7.342400 
1 1 1 -15 38 15 o 25.36700 6.858109 10.15980       4.340113 13.98084       8.677206 8.884937       5.012112 26.06756 9.901966 23.07473 7.648119 2.992826       12.51170 
1 1 1 -15 38 16 o 12.20169 5.622901 -1.421881      3.873431 -8.159229      6.708881 1.946942       4.743999 12.94864 6.338474 15.76077 6.795094 -2.812129      9.292446 
1 1 1 -15 39 1  o 34.72141 4.504093 16.52054       3.721295 23.77348       5.926446 11.79950       4.781414 39.77472 6.325986 26.98056 7.156020 12.79416       9.551269 
1 1 1 -15 39 2  o 11.33191 5.117292 -0.6454774     3.005449 1.385175       4.435046 -2.369880      4.086954 14.98051 6.513975 11.92369 5.588797 3.056822       8.582921 
1 1 1 -15 39 3  f 37.06149 6.334269 20.60526       5.515426 22.92475       8.053482 18.55645       7.569020 35.24080 9.259217 31.37137 9.262645 3.869425       13.09693 
1 1 1 -15 39 4  o 13.67954 5.883214 1.041381       3.539303 -3.839122      6.052577 3.577423       4.363010 13.78996 6.563513 16.95186 6.843386 -3.161904      9.482175 
1 1 1 -15 39 5  o 15.09015 6.203822 2.301325       3.664881 3.403681       6.268026 1.728705       4.517554 17.98566 7.782656 15.38989 6.633033 2.595771       10.22579 
1 1 1 -15 39 6  o 12.96410 5.821700 -0.2789499     3.828403 -1.482832      6.220151 0.4552257      4.857457 15.06904 7.007111 14.78097 6.603498 0.2880688      9.628385 
1 1 1 -15 39 7  o 25.67946 7.831529 11.18927       5.346025 13.88909       7.795444 8.792145       7.345448 26.52467 9.504314 22.29994 8.921960 4.224722       13.03585 
1 1 1 -15 39 8  o 13.00843 5.862401 -0.3907155     3.921183 -7.279972      6.876250 2.929136       4.773367 13.42703 6.538553 16.63332 6.978806 -3.206288      9.563285 
1 1 1 -15 39 9  o 12.89460 5.822295 -0.4762788     3.889284 -5.318388      7.016155 1.671655       4.672963 14.23700 6.853063 15.48508 6.710185 -1.248081      9.591197 
1 1 1 -15 39 10 o 13.29416 5.980288 -0.2454243     4.059456 -4.722562      6.880745 2.144935       5.027671 14.30919 6.861426 16.16566 6.982610 -1.856462      9.789587 
1 1 1 -15 39 11 o 21.10917 6.769837 7.024316       3.943344 4.813200       7.057218 8.028064       4.754887 19.26731 8.297189 22.06044 7.451549 -2.793129      11.15208 
1 1 1 -15 39 12 f 12.43128 5.694990 -1.107221      3.893364 1.343847       6.711708 -2.350297      4.779739 16.92964 7.645966 12.92463 6.053448 4.005014       9.752181 
1 1 1 -14 0  1  o 534.7960 9.018327 3493.316       117.4550 3493.316       117.4550 3493.316       117.4550 534.7960 9.018327 534.7960 9.018327 -0.000000      0.000000 
1 1 1 -14 0  2  f 297.5148 6.545560 1080.939       47.40418 1080.939       47.40418 1080.939       47.40418 297.5148 6.545560 297.5148 6.545560 0.000000       0.000000 
1 1 1 -14 0  3  o 98.99650 3.661426 119.9299       8.805498 119.9299       8.805498 119.9299       8.805498 98.99650 3.661426 98.99650 3.661426 0.000000       0.000000 
1 1 1 -14 0  4  o 454.9551 9.485630 2529.381       105.0617 2529.381       105.0617 2529.381       105.0617 454.9551 9.485630 454.9551 9.485630 0.000000       0.000000 
1 1 1 -14 0  5  o 429.7515 12.82275 2262.989       134.0165 2262.989       134.0165 2262.989       134.0165 429.7515 12.82275 429.7515 12.82275 0.000000       0.000000 
1 1 1 -14 0  6  o 350.0584 10.67519 1500.365       90.87333 1500.365       90.87333 1500.365       90.87333 350.0584 10.67519 350.0584 10.67519 -0.000000      0.000000 
1 1 1 -14 0  7  o 403.0341 12.09509 1989.965       118.5497 1989.965       118.5497 1989.965       118.5497 403.0341 12.09509 403.0341 12.09509 0.000000       0.000000 
1 1 1 -14 0  8  o 543.0005 11.18807 3605.896       147.9025 3605.896       147.9025 3605.896       147.9025 543.0005 11.18807 543.0005 11.18807 0.000000       0.000000 
1 1 1 -14 0  9  o 264.5474 5.918976 854.6205       38.11493 854.6205       38.11493 854.6205       38.11493 264.5474 5.918976 264.5474 5.918976 -0.000000      0.000000 
1 1 1 -14 0  10 o 342.9345 7.352139 1436.579       61.37765 1436.579       61.37765 1436.579       61.37765 342.9345 7.352139 342.9345 7.352139 -0.000000      0.000000 
1 1 1 -14 0  11 o 8.573573 5.674045 -0.7818837     3.098714 -0.7818837     3.098714 -0.7818837     3.098714 8.573573 5.674045 8.573573 5.674045 0.000000       0.000000 
1 1 1 -14 0  12 o 285.3078 8.900197 996.6353       61.74341 996.6353       61.74341 996.6353       61.74341 285.3078 8.900197 285.3078 8.900197 0.000000       0.000000 
1 1 1 -14 0  13 o 142.4753 5.636443 248.7016       19.49983 248.7016       19.49983 248.7016       19.49983 142.4753 5.636443 142.4753 5.636443 0.000000       0.000000 
1 1 1 -14 0  14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -14 0  15 o 9.834895 6.187423 0.5427585      3.114656 0.5427585      3.114656 0.5427585      3.114656 9.834895 6.187423 9.834895 6.187423 0.000000       0.000000 
1 1 1 -14 0  16 o 136.2053 3.935113 226.7333       13.03665 226.7333       13.03665 226.7333       13.03665 136.2053 3.935113 136.2053 3.935113 0.000000       0.000000 
1 1 1 -14 0  17 o 67.70560 5.427736 56.98573       8.818821 56.98573       8.818821 56.98573       8.818821 67.70560 5.427736 67.70560 5.427736 0.000000       0.000000 
1 1 1 -14 0  18 o 38.83602 4.720527 19.19263       4.291770 19.19263       4.291770 19.19263       4.291770 38.83602 4.720527 38.83602 4.720527 -0.000000      0.000000 
1 1 1 -14 0  19 o 12.26527 7.096297 2.253744       3.443348 2.253744       3.443348 2.253744       3.443348 12.26527 7.096297 12.26527 7.096297 -0.000000      0.000000 
1 1 1 -14 0  20 o 25.71057 6.911738 9.623036       3.741853 9.623036       3.741853 9.623036       3.741853 25.71057 6.911738 25.71057 6.911738 -0.000000      0.000000 
1 1 1 -14 0  21 o 65.62008 5.057415 53.46481       7.973873 53.46481       7.973873 53.46481       7.973873 65.62008 5.057415 65.62008 5.057415 -0.000000      0.000000 
1 1 1 -14 0  22 o 97.80010 3.736413 117.1448       8.875364 117.1448       8.875364 117.1448       8.875364 97.80010 3.736413 97.80010 3.736413 -0.000000      0.000000 
1 1 1 -14 0  23 o 230.5751 5.436272 650.0652       30.50732 650.0652       30.50732 650.0652       30.50732 230.5751 5.436272 230.5751 5.436272 -0.000000      0.000000 
1 1 1 -14 0  24 o 128.7843 3.998714 202.8878       12.52188 202.8878       12.52188 202.8878       12.52188 128.7843 3.998714 128.7843 3.998714 -0.000000      0.000000 
1 1 1 -14 0  25 o 279.5295 6.291090 956.2900       42.80482 956.2900       42.80482 956.2900       42.80482 279.5295 6.291090 279.5295 6.291090 0.000000       0.000000 
1 1 1 -14 0  26 o 87.80892 5.934924 95.48994       12.56433 95.48994       12.56433 95.48994       12.56433 87.80892 5.934924 87.80892 5.934924 -0.000000      0.000000 
1 1 1 -14 0  27 o 178.5751 4.687130 390.0995       20.36514 390.0995       20.36514 390.0995       20.36514 178.5751 4.687130 178.5751 4.687130 0.000000       0.000000 
1 1 1 -14 0  28 o 188.0086 4.838669 432.5043       22.13550 432.5043       22.13550 432.5043       22.13550 188.0086 4.838669 188.0086 4.838669 -0.000000      0.000000 
1 1 1 -14 0  29 o 37.94160 5.910486 18.82409       5.069724 18.82409       5.069724 18.82409       5.069724 37.94160 5.910486 37.94160 5.910486 0.000000       0.000000 
1 1 1 -14 0  30 o 138.0824 4.260034 233.4621       14.30375 233.4621       14.30375 233.4621       14.30375 138.0824 4.260034 138.0824 4.260034 -0.000000      0.000000 
1 1 1 -14 0  31 o 35.89756 6.420287 17.19566       5.081837 17.19566       5.081837 17.19566       5.081837 35.89756 6.420287 35.89756 6.420287 -0.000000      0.000000 
1 1 1 -14 0  32 o 71.82162 4.354352 63.71060       7.556233 63.71060       7.556233 63.71060       7.556233 71.82162 4.354352 71.82162 4.354352 0.000000       0.000000 
1 1 1 -14 0  33 o 60.04098 5.749600 45.34592       8.224010 45.34592       8.224010 45.34592       8.224010 60.04098 5.749600 60.04098 5.749600 -0.000000      0.000000 
1 1 1 -14 0  34 o 144.1292 4.432539 254.7827       15.53492 254.7827       15.53492 254.7827       15.53492 144.1292 4.432539 144.1292 4.432539 0.000000       0.000000 
1 1 1 -14 0  35 o 129.0078 4.271094 204.2981       13.39400 204.2981       13.39400 204.2981       13.39400 129.0078 4.271094 129.0078 4.271094 0.000000       0.000000 
1 1 1 -14 0  36 o 15.09809 8.445288 3.855432       4.654683 3.855432       4.654683 3.855432       4.654683 15.09809 8.445288 15.09809 8.445288 -0.000000      0.000000 
1 1 1 -14 0  37 o 11.28057 7.854495 -6.803401      7.729852 -6.803401      7.729852 -6.803401      7.729852 11.28057 7.854495 11.28057 7.854495 0.000000       0.000000 
1 1 1 -14 0  38 o 75.97644 4.363649 71.60912       8.017656 71.60912       8.017656 71.60912       8.017656 75.97644 4.363649 75.97644 4.363649 0.000000       0.000000 
1 1 1 -14 0  39 o 89.39157 4.243638 98.99052       9.196570 98.99052       9.196570 98.99052       9.196570 89.39157 4.243638 89.39157 4.243638 0.000000       0.000000 
1 1 1 -14 0  40 f 26.20154 8.956779 11.23140       5.133798 11.23140       5.133798 11.23140       5.133798 26.20154 8.956779 26.20154 8.956779 -0.000000      0.000000 
1 1 1 -14 0  41 o 14.01004 8.200412 3.188568       4.684773 3.188568       4.684773 3.188568       4.684773 14.01004 8.200412 14.01004 8.200412 0.000000       0.000000 
1 1 1 -14 0  42 o 22.47838 9.429165 9.315443       5.185802 9.315443       5.185802 9.315443       5.185802 22.47838 9.429165 22.47838 9.429165 0.000000       0.000000 
1 1 1 -14 0  43 o 11.13552 7.451749 -1.163532      5.601723 -1.163532      5.601723 -1.163532      5.601723 11.13552 7.451749 11.13552 7.451749 0.000000       0.000000 
1 1 1 -14 0  44 o 16.47737 8.968147 5.591586       5.090979 5.591586       5.090979 5.591586       5.090979 16.47737 8.968147 16.47737 8.968147 -0.000000      0.000000 
1 1 1 -14 0  45 o 13.09563 8.017185 2.737892       4.886846 2.737892       4.886846 2.737892       4.886846 13.09563 8.017185 13.09563 8.017185 0.000000       0.000000 
1 1 1 -14 0  46 f 21.38487 11.55404 11.47848       8.389344 11.47848       8.389344 11.47848       8.389344 21.38487 11.55404 21.38487 11.55404 0.000000       0.000000 
1 1 1 -14 0  47 o 10.24855 6.964939 -1.259121      5.269297 -1.259121      5.269297 -1.259121      5.269297 10.24855 6.964939 10.24855 6.964939 -0.000000      0.000000 
1 1 1 -14 0  48 o 17.92344 9.689763 8.026939       5.903920 8.026939       5.903920 8.026939       5.903920 17.92344 9.689763 17.92344 9.689763 0.000000       0.000000 
1 1 1 -14 0  49 o 8.710814 6.159647 -4.413122      5.336701 -4.413122      5.336701 -4.413122      5.336701 8.710814 6.159647 8.710814 6.159647 0.000000       0.000000 
1 1 1 -14 1  1  o 394.6406 5.275174 1899.691       50.73114 1945.697       66.57650 1835.992       78.33961 399.2422 6.843030 387.6573 8.292727 11.58487       10.75158 
1 1 1 -14 1  2  o 253.6983 3.647850 784.6205       22.55229 772.3350       35.27405 793.1143       29.32983 251.6102 5.752955 255.0246 4.719450 -3.414398      7.441082 
1 1 1 -14 1  3  o 444.3319 7.583236 2410.699       82.11041 2428.434       100.9810 2376.092       141.0623 445.7258 9.296852 439.9983 13.17083 5.727448       16.12148 
1 1 1 -14 1  4  o 143.0312 3.327616 249.3694       11.59845 257.5873       14.27397 233.3991       19.89858 145.2991 4.035214 138.1885 5.922740 7.110657       7.166715 
1 1 1 -14 1  5  o 207.4158 4.060997 524.5073       20.52630 491.5957       24.21221 608.5974       38.70189 200.7737 4.948704 223.1721 7.125464 -22.39838      8.675363 
1 1 1 -14 1  6  o 555.8749 11.46949 3783.264       155.3664 3770.965       219.5080 3795.611       219.9353 553.3764 16.29547 555.1912 16.27366 -1.814758      23.02986 
1 1 1 -14 1  7  o 78.72522 2.477622 75.60741       4.747270 74.78419       6.866315 76.36129       6.570740 78.24082 3.610996 79.07383 3.418002 -0.8330078     4.972125 
1 1 1 -14 1  8  o 294.0869 4.557598 1054.657       32.66238 1096.965       47.39692 1016.395       45.07375 299.8022 6.487527 288.5881 6.409278 11.21411       9.119586 
1 1 1 -14 1  9  o 183.4821 3.220859 410.3727       14.40130 401.3220       20.19066 419.7457       20.54704 181.3509 4.572369 185.5266 4.544718 -4.175674      6.446784 
1 1 1 -14 1  10 o 92.53289 2.473749 104.4295       5.573116 110.3090       8.090152 99.11961       7.688344 95.05916 3.498389 90.10164 3.508284 4.957520       4.954471 
1 1 1 -14 1  11 o 585.6741 8.492737 4193.315       121.2104 4085.266       168.6660 4308.712       174.3079 577.1310 11.99270 592.6793 12.06872 -15.54834      17.01408 
1 1 1 -14 1  12 o 101.1579 2.889290 124.8355       7.115111 115.9091       12.12644 129.5220       8.786554 97.33607 5.130499 103.0116 3.505335 -5.675514      6.213646 
1 1 1 -14 1  13 o 210.1129 4.066502 538.3882       20.82140 549.9913       25.88556 517.1215       35.04472 212.3167 5.003078 205.6244 7.004003 6.692352       8.607371 
1 1 1 -14 1  14 o 36.07605 3.216521 15.99327       2.798128 19.91217       4.180389 12.81240       3.766236 40.17070 4.339208 32.02570 4.988249 8.144997       6.611456 
1 1 1 -14 1  15 o 138.0648 2.777573 232.3739       9.345115 230.9893       13.29098 233.7277       13.14225 137.5603 3.969007 138.3783 3.901211 -0.8179474     5.565290 
1 1 1 -14 1  16 o 159.8988 3.451901 311.7913       13.45054 333.2742       24.27914 302.2784       16.15643 165.0618 6.046238 157.3516 4.217254 7.710129       7.371717 
1 1 1 -14 1  17 o 187.1795 3.275609 427.2547       14.94124 447.3142       21.72061 409.2375       20.58527 191.4413 4.655865 183.0566 4.618298 8.384644       6.557877 
1 1 1 -14 1  18 o 168.5277 3.579648 346.4375       14.70103 333.7537       17.71348 374.5103       26.35249 165.3092 4.401059 174.9235 6.191885 -9.614288      7.596628 
1 1 1 -14 1  19 o 67.94313 2.587113 56.36314       4.275658 61.91668       6.318698 51.67259       5.807039 71.14768 3.656707 64.97710 3.682474 6.170578       5.189616 
1 1 1 -14 1  20 o 127.3187 2.746689 197.6594       8.521925 203.3850       12.30418 192.3806       11.81438 129.0401 3.917373 125.5013 3.867631 3.538803       5.504941 
1 1 1 -14 1  21 o 189.1970 4.654044 437.1588       21.45759 443.8401       30.62555 430.7163       30.07322 190.3002 6.614079 187.4656 6.593239 2.834518       9.338995 
1 1 1 -14 1  22 o 136.7633 2.841615 228.1119       9.470457 241.9321       13.78647 215.7632       13.03186 140.7226 4.024385 132.8871 4.028926 7.835434       5.694552 
1 1 1 -14 1  23 o 165.5128 3.125532 334.1978       12.60641 332.6102       17.89809 335.7609       17.75904 164.9546 4.456606 165.7413 4.400855 -0.7866211     6.263295 
1 1 1 -14 1  24 o 158.3220 3.071778 305.8090       11.85134 304.8580       16.80621 306.7498       16.71481 157.9111 4.371586 158.4052 4.334152 -0.4941101     6.155943 
1 1 1 -14 1  25 o 159.4169 3.088449 310.0924       11.99806 311.1951       17.05495 309.0120       16.88200 159.5247 4.391369 158.9675 4.362044 0.5571289      6.189632 
1 1 1 -14 1  26 o 130.5169 4.255359 208.3851       13.51631 204.3238       19.05708 212.4960       19.17336 128.9703 6.080723 131.5441 5.997009 -2.573792      8.540452 
1 1 1 -14 1  27 o 216.9839 3.707491 575.0538       19.60395 603.0167       28.50317 549.9518       27.00575 221.9241 5.270508 211.9429 5.228792 9.981262       7.424184 
1 1 1 -14 1  28 o 134.4666 2.930939 220.6735       9.604118 205.7949       13.32596 236.7545       13.85397 129.6718 4.222763 139.1119 4.091153 -9.440186      5.879563 
1 1 1 -14 1  29 o 32.65836 4.404035 13.28089       3.415696 16.91594       4.954401 9.987954       4.715497 36.70781 5.725309 27.94664 6.952528 8.761169       9.006487 
1 1 1 -14 1  30 o 77.62050 2.888917 73.65257       5.454931 77.62676       7.845113 69.93257       7.590081 79.56557 4.059529 75.49872 4.141304 4.066856       5.799153 
1 1 1 -14 1  31 o 51.10004 3.395118 32.04982       4.203801 24.48446       5.931998 39.68225       5.958234 44.30247 5.620964 56.76795 4.339937 -12.46548      7.101429 
1 1 1 -14 1  32 o 16.50978 6.088556 2.647281       3.231025 9.022351       4.667586 -3.218031      4.477085 26.55848 7.082379 13.26652 6.088538 13.29196       9.339721 
1 1 1 -14 1  33 o 254.3886 5.851042 797.3203       36.27162 728.3251       48.57132 884.3051       54.53707 241.6787 8.259315 266.2124 8.417315 -24.53371      11.79269 
1 1 1 -14 1  34 o 177.9677 3.397900 387.6358       14.73628 381.7653       20.73602 393.6259       20.94605 176.1496 4.835249 178.8760 4.809592 -2.726456      6.819957 
1 1 1 -14 1  35 o 62.22769 3.231534 47.53467       4.883578 47.55486       6.777556 47.51287       7.042930 62.02291 4.515122 61.95842 4.699681 0.6449127E-01  6.517157 
1 1 1 -14 1  36 o 84.13983 2.929696 86.78259       5.997872 83.85611       8.347962 89.90527       8.623281 82.45233 4.168239 85.38438 4.156857 -2.932045      5.886737 
1 1 1 -14 1  37 o 61.24715 5.242203 46.91951       7.748962 54.01258       11.47955 40.98208       10.50284 64.96346 7.382129 56.29770 7.870389 8.665760       10.79068 
1 1 1 -14 1  38 o 43.16708 3.839640 23.17429       3.996947 18.92792       5.495360 27.94377       5.824020 38.36841 6.079875 47.07648 5.161230 -8.708076      7.975160 
1 1 1 -14 1  39 o 63.51979 3.155637 49.82867       4.869342 52.89584       6.997595 46.94917       6.780134 65.03069 4.442324 61.19935 4.579477 3.831337       6.380114 
1 1 1 -14 1  40 o 36.04427 4.339237 16.46511       3.734837 19.78150       5.155148 12.80137       5.418393 39.10542 5.566653 30.69905 7.341980 8.406364       9.213701 
1 1 1 -14 1  41 o 23.46071 5.951838 7.391384       3.407527 5.424008       4.632938 9.709863       5.029379 20.87950 7.342336 26.50406 7.468651 -5.624565      10.47333 
1 1 1 -14 1  42 o 37.56625 4.233164 18.09050       3.807851 16.00232       5.326753 20.27278       5.445437 34.12253 6.645031 38.92896 5.926966 -4.806435      8.904233 
1 1 1 -14 1  43 o 9.874048 4.768193 -4.857200      3.462415 -8.701430      4.565393 0.3476008      5.312213 10.33126 5.091240 16.16367 7.076775 -5.832410      8.717882 
1 1 1 -14 1  44 o 14.96743 6.064978 1.953897       3.441405 3.097896       4.861023 0.8043672      4.872760 17.62743 7.183944 15.68203 6.823336 1.945400       9.907925 
1 1 1 -14 1  45 o 10.48304 4.953582 -2.954802      3.328549 -1.688444      4.878231 -4.057993      4.553126 13.78574 6.337348 12.00806 5.708943 1.777682       8.529596 
1 1 1 -14 1  46 o 24.11267 8.192365 9.907533       5.747852 17.72566       8.418690 3.080959       7.866734 30.04590 9.910269 18.91876 8.431056 11.12714       13.01138 
1 1 1 -14 1  47 o 27.22897 6.318316 11.46879       4.111318 5.412708       5.646463 18.30244       5.998010 18.93894 7.733473 33.11116 7.595360 -14.17222      10.83956 
1 1 1 -14 1  48 o 23.46671 6.889348 9.341616       4.197251 12.26399       5.841635 6.222888       6.034691 25.16058 8.253077 19.07693 7.913093 6.083658       11.43374 
1 1 1 -14 1  49 o 16.77569 6.585063 4.437320       3.930617 6.242868       5.733572 2.836360       5.398970 18.58789 7.711947 15.92814 7.047602 2.659754       10.44714 
1 1 1 -14 2  1  o 391.6414 5.874055 1871.467       56.06125 1931.341       80.68538 1815.583       77.95049 397.5804 8.327867 385.4854 8.298027 12.09506       11.75630 
1 1 1 -14 2  2  o 271.1433 4.309785 896.4281       28.47676 896.3004       40.07395 896.5583       40.47346 271.0285 6.067517 271.0637 6.127211 -0.3518677E-01 8.623078 
1 1 1 -14 2  3  o 340.2158 5.183656 1411.742       42.97607 1425.997       61.00571 1397.698       60.55153 341.7567 7.325164 338.3468 7.343903 3.409943       10.37261 
1 1 1 -14 2  4  o 241.3858 3.912636 710.3583       23.01534 721.0176       32.91739 700.1637       32.19193 243.1196 5.556089 239.5801 5.513917 3.539566       7.827733 
1 1 1 -14 2  5  o 257.8485 4.759108 810.7781       29.90379 789.1524       36.07528 858.2708       53.46108 254.3332 5.820638 264.9368 8.290757 -10.60361      10.12998 
1 1 1 -14 2  6  o 185.9278 3.254119 421.3748       14.74395 407.2884       20.62640 436.0922       21.08331 182.6973 4.636670 189.1100 4.574970 -6.412643      6.513759 
1 1 1 -14 2  7  o 357.9047 6.232057 1563.120       54.35443 1597.798       96.11507 1546.815       65.90504 361.1281 10.93439 355.9034 7.598894 5.224609       13.31556 
1 1 1 -14 2  8  o 300.2859 4.631057 1099.635       33.88841 1133.929       48.92595 1068.009       46.98392 304.7987 6.587036 295.8118 6.517748 8.986877       9.266611 
1 1 1 -14 2  9  o 238.2172 3.854467 691.8664       22.37554 682.3362       31.53846 701.5249       31.75019 236.4963 5.472429 239.8008 5.433250 -3.304474      7.711530 
1 1 1 -14 2  10 o 517.1544 8.717863 3269.646       109.8668 3408.548       196.1542 3206.150       132.6217 525.9769 15.31997 511.6908 10.63582 14.28610       18.64999 
1 1 1 -14 2  11 o 66.52293 2.816315 54.03645       4.555174 57.33842       8.179215 52.55185       5.484424 68.38255 4.941624 65.56513 3.444675 2.817413       6.023739 
1 1 1 -14 2  12 o 407.3256 6.977297 2026.525       69.25720 1975.924       118.1020 2053.046       85.50183 401.0480 12.09823 409.7289 8.563331 -8.680939      14.82221 
1 1 1 -14 2  13 o 168.5172 3.553281 346.2524       14.59183 340.8839       17.86784 357.0018       25.28351 167.1179 4.391262 170.8923 6.080950 -3.774414      7.500742 
1 1 1 -14 2  14 o 491.3199 8.319890 2953.361       99.61347 3082.921       125.5521 2733.241       163.6506 501.4424 10.27464 470.5737 14.28753 30.86871       17.59835 
1 1 1 -14 2  15 o 52.77201 2.772619 34.04290       3.553069 37.29304       5.379766 31.52838       4.731939 55.14775 4.030969 50.69748 3.859154 4.450268       5.580482 
1 1 1 -14 2  16 o 91.86601 2.502592 102.9518       5.597270 98.82988       8.044134 106.8206       7.793296 89.94307 3.677838 93.52991 3.425063 -3.586845      5.025689 
1 1 1 -14 2  17 o 387.8918 5.803352 1838.163       54.85618 1987.593       81.70921 1715.546       74.01668 402.7840 8.324588 374.2557 8.115683 28.52826       11.62597 
1 1 1 -14 2  18 o 73.10275 2.556826 65.23028       4.547804 62.25667       6.638600 67.85986       6.242768 71.33300 3.833080 74.51048 3.447486 -3.177475      5.155353 
1 1 1 -14 2  19 f 370.3447 5.582037 1676.044       50.37731 1712.211       72.46623 1642.218       70.08211 373.7580 7.956263 366.0659 7.856187 7.692108       11.18132 
1 1 1 -14 2  20 o 172.9454 3.654471 364.9277       15.40173 348.3732       18.57102 401.4000       27.56508 168.8574 4.517207 181.0409 6.257485 -12.18350      7.717596 
1 1 1 -14 2  21 o 145.2480 4.031742 257.7024       14.25668 264.1041       20.47635 251.6792       19.86169 146.8556 5.732721 143.3588 5.696674 3.496826       8.081843 
1 1 1 -14 2  22 o 123.0080 2.758442 184.5251       8.268623 173.7477       11.63137 195.5362       11.75683 119.2364 4.008706 126.5166 3.817719 -7.280258      5.535766 
1 1 1 -14 2  23 o 135.1926 2.851889 222.9263       9.395541 231.4545       13.62907 215.2029       12.97002 137.6210 4.068388 132.7024 4.015370 4.918610       5.716203 
1 1 1 -14 2  24 o 66.46865 2.744149 53.97940       4.435328 54.62115       6.468830 53.41005       6.093028 66.76205 3.994389 66.03308 3.802560 0.7289658      5.514944 
1 1 1 -14 2  25 o 37.59698 3.749095 17.42980       3.389169 20.38897       4.985272 14.88684       4.621400 40.50180 5.168620 34.41899 5.709841 6.082809       7.701748 
1 1 1 -14 2  26 o 249.2409 5.858821 761.1451       35.58489 773.5580       51.17741 749.5266       49.51311 250.3955 8.399060 246.5239 8.253494 3.871628       11.77558 
1 1 1 -14 2  27 o 70.33558 3.389663 60.53942       5.792784 60.34307       10.91115 60.61649       6.835697 69.82062 6.487042 70.32027 4.005587 -0.4996567     7.624070 
1 1 1 -14 2  28 o 167.7735 3.210765 343.6498       13.12708 333.4665       18.41040 354.1814       18.72251 165.0365 4.582133 170.0998 4.520739 -5.063324      6.436849 
1 1 1 -14 2  29 o 240.9760 4.012000 709.9230       23.55975 736.1384       34.13297 686.0686       32.55972 244.9621 5.717935 236.5037 5.649456 8.458374       8.038105 
1 1 1 -14 2  30 o 33.87815 4.432078 14.28375       3.571350 15.32428       5.087361 13.27272       5.014726 34.79581 6.228410 32.26854 6.600006 2.527267       9.074864 
1 1 1 -14 2  31 o 29.64931 4.942800 11.06343       3.445621 9.083752       4.904864 12.99224       4.841442 26.69881 7.320900 31.92479 6.445483 -5.225979      9.753965 
1 1 1 -14 2  32 f 21.72002 6.103758 5.969642       3.363919 7.410366       4.726520 4.490767       4.788691 24.36517 7.349950 20.70360 7.445439 3.661572       10.46214 
1 1 1 -14 2  33 o 48.30531 4.567707 28.87691       5.313004 22.36782       7.237299 36.48500       7.824449 41.89025 7.358045 54.07236 6.041132 -12.18210      9.520300 
1 1 1 -14 2  34 o 87.60108 2.964547 93.92970       6.319427 94.81130       8.974539 93.06268       8.899968 87.81070 4.206233 86.99451 4.210680 0.8161850      5.951656 
1 1 1 -14 2  35 o 119.5715 2.976560 174.9256       8.673182 169.0670       12.13650 181.0405       12.39918 117.2254 4.255563 121.3255 4.200107 -4.100128      5.979190 
1 1 1 -14 2  36 o 83.95605 2.981732 86.42772       6.090692 85.64619       8.638756 87.20019       8.588540 83.30035 4.269920 84.07061 4.205525 -0.7702637     5.993218 
1 1 1 -14 2  37 o 54.70469 5.385094 37.56010       7.085864 42.55488       10.42472 33.27063       9.660690 57.46625 7.632717 50.52276 8.121873 6.943493       11.14555 
1 1 1 -14 2  38 f 85.40560 2.953453 89.67279       6.137598 97.31797       8.924593 82.81222       8.454242 88.59940 4.145024 81.67417 4.262451 6.925224       5.945563 
1 1 1 -14 2  39 o 16.33608 6.096322 2.678228       3.256988 3.737775       4.498961 1.511404       4.721225 19.09397 7.156957 17.06590 7.031348 2.028070       10.03304 
1 1 1 -14 2  40 o 34.45004 4.610793 15.13803       3.773703 16.40380       5.133629 13.64996       5.566224 35.29720 6.194067 31.69949 7.349031 3.597712       9.611177 
1 1 1 -14 2  41 f 53.39833 3.570359 35.68842       4.619267 36.41853       6.440863 34.91517       6.628436 53.26891 5.020967 51.99812 5.305280 1.270794       7.304527 
1 1 1 -14 2  42 o 19.87855 6.280898 5.279317       3.404679 3.156224       4.617888 7.807874       5.039589 18.04069 7.120457 23.68330 7.658517 -5.642612      10.45724 
1 1 1 -14 2  43 o 34.22999 5.564332 15.84325       4.482214 19.37229       5.675489 9.993940       7.306811 37.30878 6.477298 25.73262 9.203819 11.57616       11.25459 
1 1 1 -14 2  44 o 48.92213 3.929775 30.95195       4.645617 26.25541       6.366459 36.30073       6.794165 43.23764 6.221110 51.65305 5.481210 -8.415409      8.291313 
1 1 1 -14 2  45 o 20.69292 6.503753 6.303945       3.655126 8.320662       5.219545 4.363307       5.120146 23.02038 7.806966 18.70911 7.461074 4.311262       10.79890 
1 1 1 -14 2  46 o 17.51831 7.427657 3.194214       5.499430 13.16481       8.036261 -5.587606      7.541986 26.08267 9.605107 14.79576 7.117733 11.28691       11.95492 
1 1 1 -14 2  47 o 16.65788 6.508734 3.790882       3.825225 3.491743       5.401827 4.091767       5.417578 17.22964 7.335456 17.72148 7.435065 -0.4918442     10.44457 
1 1 1 -14 2  48 o 19.40283 6.808793 6.305963       3.982646 9.140285       5.666862 3.539723       5.598388 21.84200 8.061878 16.88834 7.331295 4.953659       10.89687 
1 1 1 -14 2  49 o 21.09066 7.437340 8.366686       4.756044 7.076310       5.923170 10.70849       7.979428 19.24607 7.896871 21.31163 8.987108 -2.065561      11.96364 
1 1 1 -14 3  1  o 440.8221 6.541145 2371.930       70.26728 2289.634       96.81721 2463.528       102.1424 432.7359 9.181076 448.8410 9.338506 -16.10510      13.09579 
1 1 1 -14 3  2  o 314.5222 4.841755 1206.468       37.10994 1213.637       52.75021 1199.443       52.21662 315.3061 6.865241 313.4594 6.835833 1.846710       9.688144 
1 1 1 -14 3  3  o 411.6578 5.477196 2067.223       54.94532 2131.373       88.60995 2027.149       70.03526 417.6232 8.706864 407.4913 7.052812 10.13193       11.20498 
1 1 1 -14 3  4  o 89.58202 2.538000 97.88227       5.534910 99.92808       7.973393 95.97958       7.689418 90.46549 3.624132 88.66031 3.566278 1.805183       5.084552 
1 1 1 -14 3  5  o 320.3875 4.902203 1251.873       38.27392 1262.551       54.57397 1241.537       53.69180 321.5993 6.963608 318.9164 6.908679 2.682953       9.809265 
1 1 1 -14 3  6  o 110.4680 2.591781 148.7281       6.977035 155.7913       10.18091 142.4734       9.580476 112.9847 3.702695 108.0450 3.643914 4.939636       5.195004 
1 1 1 -14 3  7  o 254.1356 4.707382 787.6300       29.15285 725.7626       49.08468 821.3480       36.23646 243.5849 8.281166 259.4628 5.731054 -15.87793      10.07088 
1 1 1 -14 3  8  o 406.2395 6.975468 2014.856       69.05444 2072.282       122.5786 1988.158       83.57880 410.9485 12.25396 403.3422 8.503279 7.606354       14.91527 
1 1 1 -14 3  9  o 295.1734 4.569061 1062.556       32.86550 1046.899       46.24044 1078.541       46.72095 292.8572 6.479328 297.2524 6.449860 -4.395172      9.142340 
1 1 1 -14 3  10 o 284.3083 5.096418 986.0474       35.30943 1018.976       62.45222 970.5760       42.80822 288.5333 8.892719 281.9869 6.229628 6.546417       10.85766 
1 1 1 -14 3  11 o 49.68706 3.653862 30.26286       4.393226 0.000000       0.000000 30.26286       4.393226 ?        ?        49.68706 3.653862 0.000000       3.653862 
1 1 1 -14 3  12 o 200.5923 3.421424 490.5669       16.72466 486.9967       23.79695 494.0515       23.51013 199.7980 4.887583 201.2447 4.793961 -1.446701      6.846205 
1 1 1 -14 3  13 o 622.3687 10.41674 4748.247       157.9850 4475.031       263.1569 4902.207       197.5451 600.3475 18.00807 631.3889 12.83906 -31.04132      22.11633 
1 1 1 -14 3  14 o 161.3597 3.491715 317.4823       13.72998 315.0560       16.95017 322.1119       23.41395 160.6514 4.333614 162.3106 5.929555 -1.659241      7.344374 
1 1 1 -14 3  15 o 541.1775 7.890468 3583.428       104.0587 3472.971       144.3845 3702.810       150.1047 531.6711 11.14401 548.9507 11.22083 -17.27954      15.81442 
1 1 1 -14 3  16 o 112.8662 2.610212 155.2931       7.179194 155.8983       10.48304 154.7585       9.852132 112.9896 3.812722 112.5891 3.595464 0.4005051      5.240631 
1 1 1 -14 3  17 f 242.7514 3.931939 718.9067       23.25974 728.3063       33.35867 710.0129       32.44868 244.1758 5.606218 241.0988 5.522884 3.077042       7.869684 
1 1 1 -14 3  18 o 104.9483 2.608604 134.2817       6.671439 123.6685       9.504530 144.5892       9.366659 100.6042 3.884141 108.8171 3.536947 -8.212929      5.253242 
1 1 1 -14 3  19 o 261.7169 4.176587 835.9678       26.63725 815.6904       37.35732 856.9402       37.99221 258.3054 5.934802 264.7630 5.888453 -6.457642      8.360368 
1 1 1 -14 3  20 o 243.7046 4.583934 725.2059       27.22313 700.6622       32.88716 778.6307       48.52075 239.4143 5.636898 251.8679 7.915130 -12.45360      9.717196 
1 1 1 -14 3  21 o 57.42414 3.854590 40.42408       5.362731 51.53123       7.847307 30.69171       7.345619 64.75197 5.012144 49.70534 6.198771 15.04663       7.971596 
1 1 1 -14 3  22 o 163.2160 3.089677 324.9517       12.28887 325.4989       17.64609 324.4364       17.12384 163.1958 4.441272 162.9428 4.316308 0.2529755      6.193175 
1 1 1 -14 3  23 o 151.3978 2.994395 279.6065       11.04752 275.3142       15.73080 283.7836       15.51846 150.0774 4.305748 152.3838 4.182970 -2.306351      6.003057 
1 1 1 -14 3  24 o 131.2670 2.861449 210.1909       9.153303 206.2544       13.01802 214.0399       12.87266 129.8879 4.118027 132.3318 3.996372 -2.443924      5.738391 
1 1 1 -14 3  25 o 282.8924 4.488954 978.0938       30.94586 1033.361       45.45359 930.3427       42.24990 290.3092 6.424973 275.4935 6.293297 14.81573       8.993657 
1 1 1 -14 3  26 f 63.57976 4.522532 49.66736       6.961329 57.10113       10.92324 44.58331       9.033418 67.88612 6.689728 59.97524 6.273482 7.910881       9.171098 
1 1 1 -14 3  27 o 86.02962 2.768906 90.39513       5.797307 91.37075       8.329370 89.47845       8.073861 86.38470 3.967348 85.49221 3.885576 0.8924942      5.553157 
1 1 1 -14 3  28 o 206.4293 3.611668 520.5358       18.16834 534.1599       26.25135 508.0105       25.17054 208.8383 5.158285 203.6800 5.071168 5.158295       7.233578 
1 1 1 -14 3  29 o 196.7513 3.523202 472.9109       16.89240 430.2373       22.95056 523.3595       24.95390 187.3435 5.031668 206.7159 4.953687 -19.37238      7.060927 
1 1 1 -14 3  30 o 91.48736 2.845281 102.2743       6.335693 109.2333       9.192329 95.97692       8.744483 94.42282 4.004050 88.48932 4.066020 5.933502       5.706569 
1 1 1 -14 3  31 o 47.29227 3.555325 27.49434       4.067374 23.43674       5.708848 31.67738       5.796422 43.34223 5.530910 50.61982 4.754644 -7.277584      7.293670 
1 1 1 -14 3  32 f 57.98579 3.250186 41.22306       4.574296 41.75222       6.474974 40.69583       6.463104 58.17878 4.604589 57.42514 4.658493 0.7536392      6.550098 
1 1 1 -14 3  33 o 60.04876 4.087010 44.38318       5.944971 41.65496       8.177332 47.44168       8.658176 57.84597 5.882745 61.78377 5.819168 -3.937794      8.274624 
1 1 1 -14 3  34 o 83.21288 2.937182 84.76251       5.946699 83.69896       8.471684 85.79559       8.349453 82.48359 4.228809 83.53410 4.114304 -1.050507      5.900028 
1 1 1 -14 3  35 o 60.98271 3.266785 45.67116       4.836993 44.28850       6.785006 47.10003       6.897462 59.79891 4.693676 61.69357 4.621480 -1.894661      6.587007 
1 1 1 -14 3  36 o 54.11822 3.412589 36.06788       4.477614 36.53095       6.263749 35.58397       6.403157 54.19028 4.792615 53.43550 4.974454 0.7547798      6.907557 
1 1 1 -14 3  37 o 13.97298 6.509562 -4.691453      5.407650 -3.810027      8.075628 -5.407968      7.281083 18.41328 8.344499 16.53939 7.652805 1.873888       11.32237 
1 1 1 -14 3  38 o 21.68642 5.994656 6.101753       3.273772 5.154147       4.534404 7.133533       4.731508 20.94351 7.270730 23.61750 7.396367 -2.673983      10.37158 
1 1 1 -14 3  39 o 71.22511 3.106632 62.61826       5.379145 60.65837       7.565179 64.62237       7.650049 69.61638 4.483185 71.90343 4.386824 -2.287056      6.272413 
1 1 1 -14 3  40 o 29.25731 5.303425 11.15181       3.641982 8.919169       5.086820 13.49992       5.216716 25.68119 7.596246 31.64721 6.954540 -5.966019      10.29896 
1 1 1 -14 3  41 o 17.77212 6.341209 3.719252       3.466328 2.368596       4.729422 5.286940       5.095249 17.58258 7.115271 20.98682 7.661282 -3.404242      10.45573 
1 1 1 -14 3  42 o 65.37267 3.670515 53.86185       5.823869 56.97890       9.285420 51.84046       7.477488 65.59409 5.871009 63.33054 4.882819 2.263550       7.636142 
1 1 1 -14 3  43 o 49.56158 4.276139 31.73968       5.114099 32.77169       6.411806 29.93513       8.478589 49.55501 5.396618 45.14014 8.000562 4.414871       9.650517 
1 1 1 -14 3  44 o 38.04431 4.610867 19.21024       4.187588 15.50595       5.800744 23.24170       6.051499 31.99899 7.559920 40.52719 6.334690 -8.528202      9.863097 
1 1 1 -14 3  45 o 14.75977 6.105999 1.783967       3.579884 0.8666047      5.012805 2.738800       5.114158 15.62844 6.857536 17.20951 7.222294 -1.581070      9.959284 
1 1 1 -14 3  46 o 16.56021 7.204264 2.052157       5.430160 7.129169       7.910229 -2.472659      7.467676 21.31915 8.966747 15.88286 7.478994 5.436290       11.67638 
1 1 1 -14 3  47 o 27.09066 6.460758 11.50942       4.205079 9.940372       5.811057 13.23425       6.092695 23.28620 8.220130 26.74996 8.395386 -3.463762      11.74960 
1 1 1 -14 3  48 o 12.88474 5.949046 -0.8295832     4.365650 3.712942       5.584981 -7.965059      6.999782 16.98452 7.347913 12.83494 6.321018 4.149583       9.692631 
1 1 1 -14 3  49 o 10.06569 4.894513 -4.417035      3.814651 -4.988967      5.374078 -3.836226      5.415623 11.89962 5.791523 12.38956 5.978081 -0.4899330     8.323412 
1 1 1 -14 4  1  o 287.1400 4.041732 1005.312       28.28116 1003.637       44.54247 1006.443       36.60645 286.7497 6.374341 287.2329 5.229827 -0.4831848     8.245199 
1 1 1 -14 4  2  o 286.5274 4.514131 1001.174       31.51929 981.1674       43.88684 1022.487       45.29660 283.5314 6.351803 289.4345 6.422131 -5.903107      9.032673 
1 1 1 -14 4  3  o 264.4753 3.777893 852.7670       24.34842 850.8567       38.44908 854.0460       31.46051 264.0629 5.975063 264.6218 4.878700 -0.5589294     7.713825 
1 1 1 -14 4  4  o 105.8350 2.589884 136.5158       6.679526 142.3102       9.747148 131.3854       9.171649 107.9787 3.709786 103.7501 3.633235 4.228561       5.192583 
1 1 1 -14 4  5  o 166.5547 3.480197 338.1687       14.12527 365.6703       25.03305 325.3220       17.10923 173.0117 5.946318 163.2827 4.303611 9.729019       7.340283 
1 1 1 -14 4  6  f 55.50673 2.702981 37.64047       3.645163 37.74702       5.476546 37.55573       4.884229 55.49109 4.078420 55.38389 3.639060 0.1071968      5.465919 
1 1 1 -14 4  7  o 120.2549 2.662385 176.2547       7.802070 177.7549       11.35709 174.9140       10.73662 120.6839 3.866718 119.7238 3.684412 0.9600754      5.341012 
1 1 1 -14 4  8  o 265.8344 4.871839 861.9344       31.56023 828.5776       54.41733 878.8411       38.74131 260.2176 8.593312 268.3629 5.924007 -8.145386      10.43738 
1 1 1 -14 4  9  o 140.5581 3.908328 241.0748       13.37400 0.000000       0.000000 241.0748       13.37400 ?        ?        140.5581 3.908328 0.000000       3.908328 
1 1 1 -14 4  10 o 264.4067 4.809911 852.7610       30.99172 860.7579       54.14449 848.8643       37.79561 265.2159 8.388127 263.7304 5.880917 1.485474       10.24431 
1 1 1 -14 4  11 o 407.4831 6.053340 2026.873       60.10917 1996.616       84.44529 2057.950       85.58047 404.0552 8.576274 410.2170 8.561008 -6.161835      12.11789 
1 1 1 -14 4  12 o 255.3697 5.722498 795.9987       35.61157 0.000000       0.000000 795.9987       35.61157 ?        ?        255.3697 5.722498 0.000000       5.722498 
1 1 1 -14 4  13 o 155.9140 2.958896 296.3452       11.24219 295.4477       16.27692 297.1638       15.54597 155.5746 4.297478 156.0394 4.091876 -0.4648285     5.933950 
1 1 1 -14 4  14 o 484.5905 8.222876 2873.555       97.10347 2932.804       120.7404 2765.058       163.3876 489.0186 10.13191 473.1522 14.18643 15.86642       17.43302 
1 1 1 -14 4  15 o 163.6099 3.045737 326.3666       12.14333 316.1487       17.29155 336.3097       17.05738 160.9109 4.413902 165.9807 4.220572 -5.069778      6.107025 
1 1 1 -14 4  16 o 195.4276 3.384652 465.7548       16.11892 434.8984       22.28462 499.6130       23.34343 188.6943 4.850320 202.3218 4.734629 -13.62746      6.778076 
1 1 1 -14 4  17 o 240.3605 3.909446 704.8309       22.89889 696.8561       32.46002 712.7314       32.30835 238.8397 5.577072 241.5547 5.488620 -2.715042      7.824875 
1 1 1 -14 4  18 o 194.8409 3.381992 463.0355       16.05790 493.2436       23.79995 437.7931       21.75604 200.9858 4.859308 189.3635 4.714630 11.62233       6.770570 
1 1 1 -14 4  19 o 383.6239 5.764831 1798.940       53.89249 1763.525       75.47185 1835.786       76.98157 379.2151 8.167012 386.9072 8.164768 -7.692047      11.54831 
1 1 1 -14 4  20 o 40.67125 3.763802 20.35639       3.688049 20.32685       4.819954 20.39811       5.728234 40.48866 4.990592 40.40730 5.999181 0.8135605E-01  7.803601 
1 1 1 -14 4  21 o 303.9218 5.437931 1129.152       40.27464 1196.684       72.48019 1098.987       48.44154 311.6745 9.554216 299.5953 6.635092 12.07922       11.63218 
1 1 1 -14 4  22 o 230.6673 4.441884 649.8405       24.96832 689.4462       31.76876 585.8474       40.38200 237.4444 5.490377 218.3891 7.599466 19.05528       9.375293 
1 1 1 -14 4  23 o 116.9083 2.746523 166.6966       7.824645 174.2882       11.47206 160.0929       10.69970 119.4129 3.947767 114.4510 3.841775 4.961929       5.508548 
1 1 1 -14 4  24 o 161.6873 3.115943 318.9736       12.27726 311.7821       17.46840 325.9935       17.25882 159.6732 4.493837 163.2941 4.341001 -3.620926      6.248108 
1 1 1 -14 4  25 o 128.7167 3.348830 202.3578       10.49530 182.8161       18.84163 211.1490       12.63741 121.9473 6.362310 131.4237 3.950405 -9.476425      7.488971 
1 1 1 -14 4  26 o 132.1616 3.391096 213.3713       10.91246 210.1622       13.42456 219.6218       18.73573 131.0721 4.208401 133.7633 5.761253 -2.691254      7.134611 
1 1 1 -14 4  27 o 161.6418 3.148376 318.9308       12.40156 327.2051       18.03745 311.5128       17.07872 163.5055 4.531329 159.5546 4.396672 3.950867       6.313768 
1 1 1 -14 4  28 o 230.0507 3.883640 646.7611       21.77201 629.3420       30.59075 664.6422       30.99375 226.5838 5.540198 232.8715 5.461624 -6.287674      7.779661 
1 1 1 -14 4  29 o 151.0347 3.094795 278.5188       11.39055 285.7556       16.52883 271.9738       15.71901 152.7535 4.445051 149.0403 4.332580 3.713257       6.207232 
1 1 1 -14 4  30 o 176.4819 3.334106 380.4999       14.33890 368.1946       20.20566 392.9838       20.35166 173.2968 4.789201 179.0671 4.667866 -5.770340      6.687706 
1 1 1 -14 4  31 o 138.1561 3.038827 233.1408       10.23086 238.3494       14.71940 228.2727       14.23023 139.4464 4.336858 136.4738 4.284151 2.972519       6.096087 
1 1 1 -14 4  32 o 54.93366 3.776454 37.09686       5.024680 39.35299       6.413792 33.51197       8.084826 56.45391 4.704866 51.71714 6.562613 4.736767       8.074878 
1 1 1 -14 4  33 o 129.6690 3.385224 205.8197       10.68779 232.3572       18.75550 193.0583       13.00614 137.2357 5.620118 125.4114 4.261936 11.82432       7.053355 
1 1 1 -14 4  34 o 31.30297 4.981130 12.34809       3.672510 10.87975       5.139664 13.87986       5.249505 29.01424 7.281612 32.86702 6.779381 -3.852779      9.948964 
1 1 1 -14 4  35 o 84.02033 2.954009 86.48663       6.038877 80.40026       8.447319 92.84843       8.636341 80.75514 4.308113 86.84582 4.092305 -6.090675      5.941953 
1 1 1 -14 4  36 o 134.8088 3.063412 222.6799       10.06375 213.3609       14.12608 232.2845       14.34092 131.4907 4.414757 137.2508 4.292996 -5.760071      6.157914 
1 1 1 -14 4  37 o 25.47700 8.106602 8.234756       5.663013 6.975592       9.064451 9.040852       7.252601 26.40334 10.09851 27.08489 9.202445 -0.6815491     13.66254 
1 1 1 -14 4  38 o 90.40089 2.967156 100.5031       6.527703 101.5937       9.325084 99.45506       9.140807 90.45749 4.242126 89.51396 4.202150 0.9435272      5.971071 
1 1 1 -14 4  39 o 59.01659 3.294212 43.11558       4.718835 45.15100       6.578070 40.95770       6.773083 59.98402 4.533714 56.96464 4.927564 3.019379       6.695928 
1 1 1 -14 4  40 o 30.39727 5.019201 11.95421       3.588318 7.466506       4.848067 17.39130       5.336288 23.72588 7.494732 36.29848 6.258724 -12.57261      9.764356 
1 1 1 -14 4  41 o 19.19703 6.381866 4.709414       3.489204 7.428898       4.767830 1.573448       5.119921 23.41680 7.436845 17.31678 7.244051 6.100014       10.38186 
1 1 1 -14 4  42 o 67.99934 3.680324 58.31332       6.075825 61.96975       9.738317 55.98284       7.774599 68.33589 5.905791 65.78547 4.884518 2.550423       7.663999 
1 1 1 -14 4  43 o 62.73901 3.938812 50.37865       5.991589 47.79271       7.543674 54.79763       9.861294 60.04398 5.207001 62.92154 6.525948 -2.877560      8.348703 
1 1 1 -14 4  44 o 16.46810 6.318823 3.144909       3.556584 3.845502       5.017201 2.437252       5.042432 18.40446 7.370173 17.14460 7.181697 1.259859       10.29059 
1 1 1 -14 4  45 o 13.04802 5.766740 -0.4449195E-01 3.604985 0.6207545      5.244478 -0.6403781     4.963552 15.68008 6.941539 14.50361 6.560380 1.176470       9.551102 
1 1 1 -14 4  46 o 20.90221 8.053009 7.016657       5.793105 2.621069       8.587530 10.68753       7.847735 18.91216 8.584187 23.88522 9.325564 -4.973068      12.67495 
1 1 1 -14 4  47 o 14.70461 6.463464 1.266525       4.470973 -0.7298239     5.449763 5.376197       7.819212 14.39181 6.645558 19.35340 8.525736 -4.961586      10.80979 
1 1 1 -14 4  48 f 11.38455 5.337646 -1.862666      3.732488 -6.692617      5.260577 3.033806       5.296679 11.32077 5.556237 16.31314 7.105727 -4.992370      9.020151 
1 1 1 -14 4  49 o 11.76280 5.480881 -1.245493      3.836299 -1.329414      5.482089 -1.164959      5.370329 13.54730 6.388058 13.52421 6.360257 0.2308559E-01  9.014441 
1 1 1 -14 5  1  o 325.4445 5.018022 1291.999       39.79657 1359.075       57.98270 1232.258       54.72055 333.5890 7.132646 317.6506 7.069108 15.93835       10.04226 
1 1 1 -14 5  2  o 384.4418 5.167375 1802.946       48.41017 1830.916       77.27805 1784.880       62.10664 387.0650 8.192871 382.3604 6.665445 4.704681       10.56178 
1 1 1 -14 5  3  o 453.7733 5.992685 2512.824       66.26688 2495.818       104.3341 2524.323       85.79390 451.7065 9.478374 454.5729 7.744918 -2.866425      12.24023 
1 1 1 -14 5  4  o 133.0407 2.537928 215.7225       8.228106 208.5163       13.01543 220.5197       10.61936 130.7069 4.091279 134.5001 3.239961 -3.793182      5.218804 
1 1 1 -14 5  5  o 263.4377 4.187149 846.2316       26.88019 881.3908       39.20702 815.0473       36.92427 268.7489 5.986610 258.4446 5.862843 10.30429       8.379286 
1 1 1 -14 5  6  o 264.5019 4.202051 853.0942       27.08484 813.9715       37.56681 895.4447       39.08582 258.2650 5.969015 270.8854 5.921032 -12.62045      8.407601 
1 1 1 -14 5  7  o 44.75468 2.994817 24.52413       3.247419 22.60470       5.015727 25.90944       4.261088 42.77051 4.900709 45.93821 3.841505 -3.167702      6.226886 
1 1 1 -14 5  8  o 203.9260 4.852223 507.2462       24.11290 0.000000       0.000000 507.2462       24.11290 ?        ?        203.9260 4.852223 0.000000       4.852223 
1 1 1 -14 5  9  o 169.9852 3.537444 352.2791       14.65334 329.4480       24.82369 364.4891       18.15360 164.1656 6.216322 172.8810 4.309029 -8.715454      7.563756 
1 1 1 -14 5  10 o 202.2704 3.454212 498.8045       17.02619 505.5244       24.59537 492.6211       23.59323 203.5639 4.958112 200.9561 4.817815 2.607880       6.913336 
1 1 1 -14 5  11 o 230.3974 4.335304 647.4329       24.34071 630.8453       42.01106 655.8149       29.86400 227.0658 7.603067 231.8277 5.286235 -4.761978      9.260179 
1 1 1 -14 5  12 o 290.5253 4.523390 1029.624       32.02463 1003.085       44.95243 1056.976       45.63460 286.5860 6.436683 294.1914 6.365436 -7.605408      9.052606 
1 1 1 -14 5  13 o 242.8011 3.943147 718.9885       23.33080 728.6933       33.74963 710.1060       32.28834 244.3100 5.668808 241.1884 5.493552 3.121567       7.893953 
1 1 1 -14 5  14 o 86.98138 3.002960 92.34998       6.355652 89.05656       8.093644 97.64748       10.26495 85.36060 3.901218 89.32993 4.732342 -3.969337      6.133071 
1 1 1 -14 5  15 o 131.4146 2.760256 210.5399       8.839526 206.5868       12.88823 214.0512       12.14666 130.0691 4.071162 132.4207 3.767962 -2.351608      5.547243 
1 1 1 -14 5  16 o 70.45360 2.555514 60.59092       4.380235 65.08222       6.877892 57.52635       5.681373 72.93838 3.883573 68.59556 3.409451 4.342819       5.167833 
1 1 1 -14 5  17 o 119.9043 2.695198 175.2863       7.875199 174.3248       11.56209 176.1183       10.75597 119.4651 3.977088 120.1000 3.679454 -0.6348801     5.418081 
1 1 1 -14 5  18 o 154.7126 2.982827 291.8880       11.24578 275.6674       15.84741 308.3420       15.96108 150.2213 4.333560 158.9003 4.125428 -8.678970      5.983218 
1 1 1 -14 5  19 o 170.5992 3.656863 355.0890       15.20274 341.3663       18.52800 383.3658       26.59652 167.1477 4.552989 176.9377 6.177817 -9.790024      7.674317 
1 1 1 -14 5  20 o 313.5610 4.849456 1200.965       37.05537 1228.714       53.49458 1175.369       51.37791 316.7531 6.930314 309.8289 6.804848 6.924164       9.712631 
1 1 1 -14 5  21 o 381.9946 6.632408 1786.821       61.73970 1799.322       107.4807 1780.664       75.42509 381.2269 11.58284 380.8625 8.126650 0.3644409      14.14937 
1 1 1 -14 5  22 o 237.3434 3.919531 687.6753       22.66978 678.1490       32.14111 697.1058       31.97933 235.4615 5.601507 238.7469 5.496617 -3.285400      7.847909 
1 1 1 -14 5  23 o 268.0567 4.977672 878.4144       32.51539 885.2404       40.23552 865.5650       55.20359 268.8639 6.141026 265.0987 8.556436 3.765228       10.53208 
1 1 1 -14 5  24 o 244.9438 4.019829 732.7429       23.99441 732.8313       34.26186 732.6578       33.61386 244.6613 5.746582 244.6541 5.638062 0.7217407E-02  8.050525 
1 1 1 -14 5  25 o 65.49757 3.377368 52.50267       5.372428 39.82628       10.43341 57.07655       6.267158 56.38401 7.802221 68.26170 3.782323 -11.87769      8.670676 
1 1 1 -14 5  26 f 49.46267 3.900962 30.07149       4.663994 34.10735       5.885422 23.25822       7.646934 52.60979 4.638102 42.85973 7.599769 9.750061       8.903285 
1 1 1 -14 5  27 o 95.41096 2.792388 111.1733       6.485489 110.7705       9.469978 111.5291       8.900244 95.11227 4.095389 95.46700 3.833510 -0.3547287     5.609636 
1 1 1 -14 5  28 o 251.8403 4.141809 775.4393       25.41859 807.4730       37.11992 747.1561       34.87926 256.5259 5.937993 246.7989 5.799466 9.727036       8.300214 
1 1 1 -14 5  29 o 168.0272 3.255105 344.8076       13.32848 358.3163       19.48599 332.9305       18.27124 171.0118 4.680248 164.8628 4.552239 6.148941       6.528981 
1 1 1 -14 5  30 o 121.6857 2.925868 180.7962       8.676218 185.4865       12.63780 176.6148       11.93260 123.0444 4.221016 120.0836 4.083641 2.960854       5.873082 
1 1 1 -14 5  31 o 86.22881 2.913849 90.91051       6.114082 82.77024       8.629250 99.11666       8.664091 82.09702 4.328594 89.91243 3.964021 -7.815407      5.869428 
1 1 1 -14 5  32 o 114.5290 3.382010 160.5158       9.428672 148.1464       11.55468 185.1654       16.31131 109.8710 4.324018 122.6001 5.473413 -12.72905      6.975341 
1 1 1 -14 5  33 o 63.14255 3.275495 48.89433       5.022824 47.58285       7.234174 50.11504       6.979368 62.05293 4.821809 63.74448 4.522374 -1.691551      6.610727 
1 1 1 -14 5  34 o 47.45133 3.688057 27.75416       4.231175 24.78721       5.979072 30.73048       5.988510 44.46737 5.644697 49.71669 5.011191 -5.249321      7.548154 
1 1 1 -14 5  35 o 121.6972 3.008336 181.2793       8.921607 184.3194       12.87970 178.4751       12.36985 122.3422 4.326910 120.4151 4.222017 1.927040       6.045459 
1 1 1 -14 5  36 o 68.19639 3.116292 57.12645       5.165190 54.72924       7.356640 59.45711       7.253809 66.43798 4.571753 69.32450 4.315211 -2.886520      6.286650 
1 1 1 -14 5  37 o 29.48022 8.126238 11.49300       6.025319 12.67631       9.647532 10.73627       7.714988 31.45067 10.61415 28.96215 9.483655 2.488523       14.23376 
1 1 1 -14 5  38 f 45.26846 3.759791 25.47892       4.110186 24.29280       5.716596 26.74827       5.913778 43.70381 5.488348 45.92236 5.386796 -2.218548      7.690223 
1 1 1 -14 5  39 o 37.47104 4.353948 17.72373       3.901770 20.10376       5.441470 15.20505       5.597719 39.43011 5.839341 33.76593 7.031691 5.664181       9.140163 
1 1 1 -14 5  40 o 21.63931 6.142853 6.212574       3.389529 5.619839       4.703060 6.853211       4.889404 21.28913 7.403903 22.91986 7.552174 -1.630722      10.57606 
1 1 1 -14 5  41 o 33.66898 4.720064 14.65365       3.766470 16.03289       5.315137 13.26244       5.338124 34.38886 6.582177 30.91379 7.217697 3.475071       9.768327 
1 1 1 -14 5  42 o 94.11841 3.431035 111.2048       7.856126 105.4052       12.66799 114.8292       10.01445 89.15653 5.863209 94.80601 4.346225 -5.649475      7.298417 
1 1 1 -14 5  43 o 35.57113 4.905711 16.80385       4.139308 15.13261       5.753793 18.59664       5.959349 32.04411 7.501549 35.98518 7.048047 -3.941071      10.29311 
1 1 1 -14 5  44 o 15.15173 6.186783 1.981581       3.613575 -0.9729095     5.100533 4.958965       5.120256 14.65370 6.637097 19.53373 7.558852 -4.880032      10.05919 
1 1 1 -14 5  45 o 27.31670 6.114976 10.89233       3.968963 11.66559       5.748242 10.18780       5.486802 26.62431 8.121016 25.00732 7.981984 1.616995       11.38696 
1 1 1 -14 5  46 o 13.04791 6.031239 -1.568031      4.505720 -2.935099      7.127410 -0.6580327     5.815098 15.29860 7.234953 15.11431 6.937446 0.1842947      10.02361 
1 1 1 -14 5  47 o 25.54893 6.539052 10.42549       4.087838 18.86038       5.958622 2.926033       5.618510 33.54372 7.480186 16.78252 7.314177 16.76119       10.46185 
1 1 1 -14 5  48 o 9.372678 4.600606 -5.455605      3.609669 -8.082211      5.213459 -3.037028      5.002744 10.79739 5.342997 12.43482 5.932110 -1.637438      7.983580 
1 1 1 -14 5  49 o 12.59840 5.691613 0.1998436      3.722500 -2.649050      5.483509 2.634920       5.069635 12.93035 6.180046 15.54565 6.855971 -2.615300      9.230238 
1 1 1 -14 6  1  o 207.2605 3.559646 523.7320       17.97875 547.8266       26.26509 502.4886       24.66214 211.9060 5.086272 202.9530 4.986539 8.952972       7.122902 
1 1 1 -14 6  2  o 247.3432 3.609785 745.8906       21.75792 761.9279       34.87496 735.6703       27.84062 249.8706 5.727464 245.5925 4.651871 4.278122       7.378601 
1 1 1 -14 6  3  o 218.3916 3.300600 581.4310       17.56567 582.8862       27.89227 580.4745       22.61337 218.5806 5.236440 218.1753 4.253276 0.4052734      6.746159 
1 1 1 -14 6  4  o 436.6729 5.787919 2326.959       61.59066 2413.929       99.87618 2273.591       78.23801 444.2310 9.226074 431.4193 7.441872 12.81177       11.85335 
1 1 1 -14 6  5  o 84.98264 2.654509 88.11108       5.490571 87.06700       7.930044 89.07247       7.609549 84.41520 3.865208 85.39561 3.665215 -0.9804153     5.326691 
1 1 1 -14 6  6  o 236.7594 3.856533 683.4724       22.25053 679.3185       43.90641 684.9078       25.81028 235.6763 7.655129 236.9798 4.469360 -1.303558      8.864321 
1 1 1 -14 6  7  f 45.07536 3.131289 24.88706       3.418143 30.12880       6.304347 22.70458       4.067972 49.40906 5.319695 42.97272 3.928015 6.436333       6.612750 
1 1 1 -14 6  8  o 297.2787 5.306662 1078.281       38.44336 1222.121       72.35115 1021.695       45.37932 315.8825 9.409534 289.2795 6.437306 26.60300       11.40080 
1 1 1 -14 6  9  o 329.9366 5.823666 1328.668       46.82341 1301.704       81.20156 1342.101       57.31112 325.8264 10.23956 331.4618 7.095276 -5.635376      12.45759 
1 1 1 -14 6  10 o 453.4323 7.705724 2513.086       85.14557 2470.478       146.1702 2534.968       104.7528 447.9439 13.40566 455.0403 9.446691 -7.096405      16.39975 
1 1 1 -14 6  11 o 229.6038 4.382596 643.0374       24.52147 636.9757       30.22277 654.7156       41.94929 228.4527 5.428775 231.3232 7.451374 -2.870422      9.219250 
1 1 1 -14 6  12 o 212.5282 3.583994 550.7784       18.56179 539.7955       26.44279 561.4473       26.06202 210.3109 5.159521 214.4987 4.985942 -4.187851      7.174976 
1 1 1 -14 6  13 o 223.8941 3.713257 611.3396       20.25973 652.1973       30.15918 577.7398       27.34960 231.1425 5.354311 217.5633 5.158568 13.57921       7.435017 
1 1 1 -14 6  14 o 74.08251 3.061604 67.02941       5.515233 62.35138       7.073053 74.28558       8.809046 71.37676 4.083476 77.88290 4.662766 -6.506142      6.198078 
1 1 1 -14 6  15 o 330.2969 5.819979 1332.737       46.84488 1483.121       87.59589 1272.502       55.43845 347.3065 10.36145 322.5502 7.053062 24.75626       12.53417 
1 1 1 -14 6  16 o 105.6806 2.608945 136.1578       6.718870 134.0936       9.942590 137.8926       9.115082 104.7675 3.901180 106.2687 3.524687 -1.501160      5.257626 
1 1 1 -14 6  17 o 302.8914 4.703283 1120.056       34.71556 1176.270       51.03125 1071.631       47.36403 310.0738 6.753596 295.9937 6.566441 14.08005       9.419618 
1 1 1 -14 6  18 o 175.9020 3.735430 377.5104       16.01207 367.1035       19.66028 398.0126       27.59508 173.3340 4.658689 180.2858 6.290713 -6.951797      7.827928 
1 1 1 -14 6  19 o 171.1963 3.686842 357.5992       15.38101 342.3745       18.76685 388.7516       26.84490 167.3845 4.605246 178.1668 6.192410 -10.78226      7.717138 
1 1 1 -14 6  20 o 185.6116 3.314130 420.2772       14.99032 417.1470       21.57661 423.1977       20.84152 184.7365 4.796914 186.1529 4.594343 -1.416382      6.642166 
1 1 1 -14 6  21 o 160.6280 3.489014 314.8223       13.65714 339.7602       24.83749 304.0148       16.35083 166.5106 6.131575 157.7350 4.257681 8.775635       7.464855 
1 1 1 -14 6  22 o 344.1468 5.263607 1448.189       44.14314 1463.053       63.24075 1434.066       61.64548 345.2774 7.516102 341.8775 7.399368 3.399902       10.54715 
1 1 1 -14 6  23 o 301.2173 4.715396 1108.900       34.61259 1106.610       49.28814 1111.127       48.61794 300.4308 6.732274 301.0725 6.626579 -0.6416626     9.446431 
1 1 1 -14 6  24 o 134.2700 2.915833 219.9451       9.540648 226.8212       14.06137 214.0791       12.98754 136.1911 4.242022 132.3301 4.032173 3.860931       5.852621 
1 1 1 -14 6  25 o 107.2030 4.041660 140.5954       10.53961 137.0177       16.05090 143.3073       13.97442 105.5281 6.269854 108.0752 5.322426 -2.547104      8.224311 
1 1 1 -14 6  26 o 69.16220 3.370570 58.53623       5.663677 64.94668       7.301794 48.85452       8.973493 72.78444 4.133749 62.85562 5.928460 9.928818       7.227345 
1 1 1 -14 6  27 o 75.57954 2.837858 69.80472       5.217458 68.57704       7.724257 70.83484       7.075546 74.77366 4.256668 76.04544 3.830464 -1.271782      5.726402 
1 1 1 -14 6  28 o 52.16706 3.358595 33.37195       4.246943 37.42843       6.323998 30.03968       5.731751 55.09459 4.756823 49.30251 4.832715 5.792076       6.781040 
1 1 1 -14 6  29 o 105.9263 2.890978 137.0729       7.455528 139.3386       10.84609 135.0434       10.26529 106.6474 4.181473 105.0101 4.018889 1.637253       5.799671 
1 1 1 -14 6  30 f 140.8226 3.046857 242.1903       10.45588 246.7868       15.27893 238.1416       14.33943 141.9030 4.423806 139.4286 4.225179 2.474319       6.117369 
1 1 1 -14 6  31 o 236.2431 3.999984 683.0741       23.02785 696.0311       33.33583 671.2480       31.84771 237.9074 5.749992 233.6915 5.592412 4.215897       8.021066 
1 1 1 -14 6  32 o 57.52442 4.386472 40.79255       6.102619 40.97685       8.456877 40.59231       8.815076 57.33733 6.148435 56.99848 6.460170 0.3388557      8.918355 
1 1 1 -14 6  33 o 50.50611 3.620175 31.38889       4.426083 31.07580       6.392159 31.67726       6.134634 49.96637 5.331986 50.50653 5.052042 -0.5401649     7.345284 
1 1 1 -14 6  34 o 112.6818 2.988068 155.4157       8.197794 154.3477       11.76353 156.4241       11.43050 112.0170 4.317493 112.8058 4.165282 -0.7888184     5.999194 
1 1 1 -14 6  35 o 29.25052 5.334007 10.89682       3.662051 8.356723       5.246468 13.31020       5.113921 25.64668 7.745232 32.09624 6.752550 -6.449554      10.27548 
1 1 1 -14 6  36 o 80.80080 3.064657 80.15115       6.023457 74.92719       8.554721 85.28745       8.482645 77.77016 4.533607 83.08263 4.203377 -5.312462      6.182392 
1 1 1 -14 6  37 o 34.74067 5.808535 15.48168       4.743985 24.74276       10.34389 13.01485       5.338543 42.54887 10.12367 31.45370 7.130049 11.09517       12.38250 
1 1 1 -14 6  38 o 46.19093 3.683514 26.51577       4.111921 30.30145       5.788204 22.65880       5.842445 49.04364 4.909028 42.03378 5.863068 7.009865       7.646838 
1 1 1 -14 6  39 o 15.15365 6.008187 1.740429       3.301642 -1.358427      4.439771 5.574407       4.938382 14.18829 6.327671 21.54449 7.580154 -7.356201      9.874116 
1 1 1 -14 6  40 o 21.11426 6.130373 5.905558       3.339635 5.826052       4.630163 5.991773       4.821565 21.46817 7.351571 21.77734 7.500432 -0.3091621     10.50248 
1 1 1 -14 6  41 o 38.98458 4.189210 19.37656       3.917430 21.90818       5.589027 16.93172       5.492401 40.70510 5.798187 35.28016 6.631849 5.424942       8.809109 
1 1 1 -14 6  42 o 15.37589 6.296343 1.679645       3.756015 8.968793       5.719280 -3.848246      4.980612 24.92985 8.165551 13.17966 6.174970 11.75019       10.23750 
1 1 1 -14 6  43 o 60.26708 3.487494 46.12794       5.100007 42.57132       7.010496 50.12620       7.433035 56.56910 5.141613 61.54956 4.998693 -4.980461      7.170990 
1 1 1 -14 6  44 o 27.12700 6.178116 10.59468       3.992404 7.869977       5.600075 13.41087       5.693303 22.69808 8.064083 29.31110 7.824451 -6.613020      11.23617 
1 1 1 -14 6  45 o 28.16079 6.394084 11.77079       4.287382 9.354881       5.962470 14.35727       6.169369 23.74914 8.331233 29.37799 8.269589 -5.628851      11.73864 
1 1 1 -14 6  46 o 12.66341 5.836367 -1.390683      4.174869 -5.478619      6.735595 1.159571       5.320049 13.87094 6.686383 15.69574 6.967638 -1.824799      9.656899 
1 1 1 -14 6  47 o 14.95126 6.252665 2.352510       3.812762 10.69135       5.709734 -4.358276      5.122121 23.89865 8.164291 12.17078 5.857704 11.72786       10.04830 
1 1 1 -14 6  48 o 16.82242 6.586164 4.310545       3.923252 5.347178       5.799168 3.435701       5.327435 18.16432 7.660812 16.54895 7.167959 1.615372       10.49131 
1 1 1 -14 7  1  o 57.11298 2.657819 39.84529       3.688958 44.34820       5.768291 36.72918       4.798510 60.17568 3.955532 54.76582 3.615741 5.409855       5.359088 
1 1 1 -14 7  2  o 194.8637 3.085444 462.8930       14.65159 475.7048       23.57183 454.8267       18.70358 197.4684 4.898460 193.1272 3.974159 4.341217       6.307840 
1 1 1 -14 7  3  o 462.0178 6.100181 2605.780       68.68114 2622.070       109.1394 2595.100       88.37399 462.8027 9.677196 460.7833 7.870306 2.019440       12.47357 
1 1 1 -14 7  4  o 235.2832 3.856159 675.0096       22.10965 711.4945       44.86728 663.3085       25.40888 241.1763 7.643771 233.2052 4.471066 7.971130       8.855375 
1 1 1 -14 7  5  o 113.0831 2.974599 155.9886       8.190018 164.1207       14.38094 152.0850       9.963672 115.8717 5.105537 111.6248 3.667860 4.246872       6.286469 
1 1 1 -14 7  6  o 192.5039 3.831749 451.8622       17.97516 438.8039       30.76216 458.6324       22.15004 189.4431 6.673919 193.9052 4.687583 -4.462036      8.155650 
1 1 1 -14 7  7  o 95.24762 2.610203 110.6603       6.052780 105.6942       9.029952 114.7121       8.156398 93.01353 3.993153 96.93766 3.458328 -3.924133      5.282547 
1 1 1 -14 7  8  o 128.0212 2.787211 199.7784       8.695368 210.1921       13.26313 191.9282       11.51545 131.2171 4.153045 125.4028 3.772522 5.814354       5.610678 
1 1 1 -14 7  9  o 299.4674 5.374327 1094.444       39.22019 1098.771       69.51451 1092.423       47.50293 299.3997 9.539874 299.0793 6.517754 0.3203430      11.55380 
1 1 1 -14 7  10 o 135.0704 2.810712 222.3944       9.251511 212.4282       13.41444 231.4348       12.77611 131.9070 4.178464 137.7095 3.810801 -5.802536      5.655242 
1 1 1 -14 7  11 o 112.3046 2.661461 153.7406       7.283725 154.6632       10.98138 153.0159       9.732763 112.5389 4.010633 111.9634 3.571742 0.5755539      5.370523 
1 1 1 -14 7  12 o 238.8516 3.903919 695.8148       22.72297 693.9605       32.61744 697.5634       31.67359 238.4067 5.614296 239.0400 5.437392 -0.6332703     7.815725 
1 1 1 -14 7  13 o 116.6277 2.688784 165.8173       7.641769 170.8460       11.52433 161.8710       10.20901 118.2790 4.004041 115.1498 3.642764 3.129219       5.413139 
1 1 1 -14 7  14 o 225.7112 4.359601 621.6343       23.97927 620.4722       29.65015 623.8314       40.76957 225.4141 5.397712 225.6824 7.423241 -0.2683563     9.178225 
1 1 1 -14 7  15 o 320.4757 4.930714 1253.875       38.50713 1324.678       56.89825 1194.041       52.30575 329.0522 7.095745 312.4458 6.869714 16.60645       9.876364 
1 1 1 -14 7  16 f 211.5610 4.114220 546.1583       21.21090 544.4646       37.39301 546.9617       25.75542 210.7758 7.291016 211.6426 4.993781 -0.8668060     8.837237 
1 1 1 -14 7  17 o 250.4154 4.059633 765.2374       24.77330 746.9406       35.07528 783.4498       34.99432 247.2028 5.822530 253.1926 5.671664 -5.989807      8.128323 
1 1 1 -14 7  18 o 186.8783 3.879858 426.1598       17.66895 446.8629       22.55028 393.2380       28.43654 191.2233 4.843115 179.1534 6.524415 12.06985       8.125500 
1 1 1 -14 7  19 o 282.8903 4.471030 977.1381       30.82206 951.6412       43.40310 1003.076       43.77727 278.8704 6.386785 286.3290 6.274039 -7.458588      8.952909 
1 1 1 -14 7  20 o 97.52332 2.656419 116.0616       6.307199 114.0857       9.449480 117.6491       8.470119 96.59261 4.023275 98.13008 3.547862 -1.537468      5.364146 
1 1 1 -14 7  21 o 124.0855 3.140775 187.9514       9.489533 174.9159       16.45942 194.4417       11.61413 119.4491 5.670711 126.1597 3.781990 -6.710663      6.816187 
1 1 1 -14 7  22 o 38.96085 3.557442 18.67970       3.340331 19.86943       5.386542 17.93630       4.257895 39.89969 5.701889 38.02670 4.694399 1.872986       7.385724 
1 1 1 -14 7  23 o 285.8268 4.527822 998.3193       31.53757 987.0652       44.74957 1009.425       44.45364 283.7838 6.470908 287.0098 6.355863 -3.226013      9.070262 
1 1 1 -14 7  24 o 271.2945 5.042671 900.2903       33.33786 859.6560       57.70192 920.6508       40.84488 263.8387 8.987735 274.0941 6.115074 -10.25546      10.87076 
1 1 1 -14 7  25 o 159.9941 3.137108 312.4077       12.23121 318.1849       17.93087 307.3802       16.72691 161.2558 4.567598 158.5257 4.333988 2.730103       6.296539 
1 1 1 -14 7  26 f 211.3866 4.249862 546.2185       21.89215 549.1291       27.21201 540.8786       36.85867 211.7646 5.273163 209.5903 7.227411 2.174255       8.946603 
1 1 1 -14 7  27 o 35.97227 4.259406 16.04113       3.661453 17.79650       5.396697 14.54395       4.984040 37.61279 6.096355 33.89278 6.265179 3.720009       8.741739 
1 1 1 -14 7  28 o 61.57307 3.137902 46.40915       4.692799 45.91441       6.905073 46.83380       6.397225 61.07002 4.675402 61.73285 4.278930 -0.6628227     6.337873 
1 1 1 -14 7  29 o 100.4126 2.895981 123.1922       7.078905 129.1584       10.44351 118.1211       9.628274 102.6658 4.183070 98.19385 4.032301 4.471962       5.810123 
1 1 1 -14 7  30 o 85.22852 2.914217 88.80376       6.043710 87.60117       8.864941 89.84811       8.261160 84.47919 4.320508 85.60690 3.970826 -1.127708      5.868071 
1 1 1 -14 7  31 o 187.1953 3.477879 428.4556       15.86519 436.5474       23.07643 421.2027       21.84752 188.5331 5.027275 185.2403 4.843992 3.292862       6.981243 
1 1 1 -14 7  32 o 157.7463 4.401990 305.3474       16.90517 286.1683       23.14490 327.2803       24.75085 152.1600 6.255265 162.7407 6.252686 -10.58072      8.844458 
1 1 1 -14 7  33 o 81.91696 3.025609 82.16019       6.029424 78.81435       8.741337 85.19674       8.327497 79.99242 4.502456 83.24953 4.117621 -3.257103      6.101386 
1 1 1 -14 7  34 o 59.24001 3.266188 43.09576       4.696868 41.42453       6.893468 44.54389       6.416862 57.78365 4.942923 60.03954 4.416717 -2.255886      6.628716 
1 1 1 -14 7  35 o 33.88119 4.658860 14.40995       3.744841 14.88717       5.427403 13.97630       5.173710 33.95605 6.796377 32.90296 6.680922 1.053097       9.530239 
1 1 1 -14 7  36 o 63.26440 5.088227 49.94116       7.778333 51.67741       12.48151 48.83871       9.945804 63.17344 8.308917 62.03516 6.684477 1.138283       10.66397 
1 1 1 -14 7  37 o 68.73717 3.118917 58.16469       5.210730 49.18188       7.490732 66.58679       7.253179 62.69851 4.942595 73.29675 4.076824 -10.59824      6.407007 
1 1 1 -14 7  38 o 35.60496 4.462008 16.00547       3.786695 14.65856       5.314780 17.39414       5.396547 33.33626 6.773607 36.56111 6.283443 -3.224846      9.239233 
1 1 1 -14 7  39 o 26.64832 5.619205 9.327368       3.533964 11.50760       5.126556 7.353222       4.878246 29.17042 7.244741 23.68253 7.522611 5.487898       10.44394 
1 1 1 -14 7  40 o 17.33227 6.311131 3.372643       3.454456 1.303260       4.712980 5.775084       5.078103 16.63258 6.953474 21.61988 7.679270 -4.987301      10.35963 
1 1 1 -14 7  41 o 37.29277 4.480740 17.89205       3.990563 15.78652       5.471927 20.28406       5.832313 33.84625 6.869272 38.75303 6.399025 -4.906776      9.387993 
1 1 1 -14 7  42 o 51.36911 4.800157 34.38276       5.939302 29.63930       8.196213 39.62768       8.618580 45.50692 7.662910 53.57065 6.751600 -8.063728      10.21295 
1 1 1 -14 7  43 o 18.26743 6.466273 4.402410       3.597884 9.749942       5.004810 -1.316880      5.175853 25.47949 7.534296 14.67988 6.663622 10.79961       10.05830 
1 1 1 -14 7  44 o 25.21420 6.302479 9.269596       3.861604 7.900557       5.583581 10.52480       5.346403 22.66026 8.052040 25.86142 7.820495 -3.201157      11.22477 
1 1 1 -14 7  45 o 40.99905 5.451860 23.55725       5.312084 23.46026       6.520400 23.74870       9.160325 39.27172 7.073427 35.45160 10.10998 3.820114       12.33876 
1 1 1 -14 7  46 o 10.39548 5.070203 -5.757131      4.180208 0.9056050      7.699241 -8.542152      4.977783 17.30611 7.957840 10.60264 5.241940 6.703470       9.529174 
1 1 1 -14 7  47 o 12.23599 5.582642 -0.6273723     3.691379 -0.5369188     5.377433 -0.7079808     5.076363 14.27488 6.595023 13.87352 6.408938 0.4013586      9.196131 
1 1 1 -14 7  48 o 16.90780 6.646513 4.421531       4.009305 -1.283574      5.866380 9.421939       5.492133 14.06724 6.625518 21.95126 7.962865 -7.884017      10.35880 
1 1 1 -14 8  1  f 172.2761 3.721167 361.9132       15.62213 375.8813       26.05460 354.0728       19.52020 175.3445 6.106883 170.2939 4.708319 5.050568       7.711180 
1 1 1 -14 8  2  o 438.5582 7.480182 2350.854       79.94208 2475.234       142.8482 2294.137       96.46185 448.3772 13.08761 432.8998 9.143913 15.47736       15.96548 
1 1 1 -14 8  3  o 173.5905 3.601620 367.4248       15.23562 383.2031       26.68605 359.7949       18.55727 177.0472 6.194824 171.6897 4.439135 5.357498       7.621139 
1 1 1 -14 8  4  o 323.1557 5.696362 1274.669       44.85858 1272.247       77.48360 1275.890       55.01635 322.1285 9.882310 323.1666 6.986009 -1.038147      12.10225 
1 1 1 -14 8  5  f 301.6946 4.698386 1110.358       34.54239 1086.742       48.68571 1134.297       49.01659 298.2841 6.697848 304.7513 6.600266 -6.467194      9.403440 
1 1 1 -14 8  6  o 149.9656 2.670285 274.1318       9.758550 293.2211       16.32960 263.5275       12.17088 154.9895 4.327752 147.0185 3.397141 7.970978       5.501819 
1 1 1 -14 8  7  o 509.6187 7.457948 3174.300       92.61916 3166.756       184.8619 3176.828       107.0201 506.4116 14.99637 509.5562 8.618611 -3.144592      17.29658 
1 1 1 -14 8  8  o 298.5553 4.650279 1087.417       33.83295 1071.791       47.96988 1102.883       47.72508 296.2105 6.645567 300.4908 6.517475 -4.280273      9.308117 
1 1 1 -14 8  9  o 210.6423 4.137178 541.1805       21.23664 529.3391       38.02686 546.5475       25.60086 207.9459 7.516561 211.6366 4.963953 -3.690704      9.007748 
1 1 1 -14 8  10 o 102.1516 2.931212 127.3173       7.289187 128.4066       13.39059 126.8586       8.689425 102.4237 5.383827 101.9375 3.503215 0.4861679      6.423248 
1 1 1 -14 8  11 o 231.0566 3.819804 651.1245       21.50778 644.0925       30.78082 657.8331       30.06500 229.6862 5.499322 232.1387 5.314686 -2.452423      7.647773 
1 1 1 -14 8  12 o 223.8115 3.734120 610.9406       20.36605 637.4560       30.03163 588.3632       27.71192 228.4946 5.393453 219.5372 5.179911 8.957382       7.478022 
1 1 1 -14 8  13 o 153.8780 2.998974 288.7047       11.24567 295.0800       16.68649 283.3995       15.22180 155.4443 4.409539 152.3575 4.103566 3.086731       6.023561 
1 1 1 -14 8  14 o 309.2939 5.557013 1168.502       41.88407 1126.487       50.44186 1261.787       75.16183 303.4916 6.820375 320.4636 9.635543 -16.97192      11.80513 
1 1 1 -14 8  15 o 310.2880 4.805461 1175.440       36.33592 1141.206       50.98158 1210.784       51.80175 305.4230 6.849760 314.6130 6.756654 -9.189941      9.621413 
1 1 1 -14 8  16 o 80.20059 2.627326 78.50576       5.127918 78.63564       8.109092 78.41921       6.619492 80.16382 4.165334 80.11037 3.398502 0.5344391E-01  5.375856 
1 1 1 -14 8  17 o 63.59827 3.799358 49.52764       5.861481 45.30669       8.861619 52.81075       7.815381 60.56771 6.086347 65.57406 4.926852 -5.006344      7.830548 
1 1 1 -14 8  18 o 183.2827 3.312451 409.7688       14.79473 415.8029       21.62993 404.4639       20.28098 184.4491 4.816308 181.9420 4.577887 2.507111       6.644838 
1 1 1 -14 8  19 o 111.8639 2.717478 152.5938       7.407848 152.0045       11.09763 153.0674       9.948823 111.5161 4.090657 111.9417 3.651955 -0.4255295     5.483634 
1 1 1 -14 8  20 o 73.89163 2.706821 66.67291       4.865824 71.90365       7.670221 63.15021       6.294543 76.63338 4.122449 71.84731 3.606689 4.786072       5.477480 
1 1 1 -14 8  21 o 179.0825 3.728376 391.4519       16.27080 413.6492       29.52483 381.7703       19.49891 183.6269 6.608819 176.7222 4.531497 6.904724       8.013173 
1 1 1 -14 8  22 o 101.0710 2.718281 124.6837       6.689019 131.3655       10.22810 119.6902       8.841969 103.6383 4.057686 98.95319 3.673140 4.685143       5.473278 
1 1 1 -14 8  23 o 139.9474 2.945353 238.9397       10.04473 236.9269       14.71276 240.6970       13.74713 139.1856 4.343056 140.3264 4.024253 -1.140854      5.920874 
1 1 1 -14 8  24 o 123.8891 3.326938 187.4756       10.03507 214.4951       20.10800 178.5142       11.58025 132.1243 6.263080 120.8291 3.938137 11.29524       7.398316 
1 1 1 -14 8  25 o 102.2367 2.800443 127.6221       6.970444 124.2205       10.36120 130.4343       9.421112 100.7284 4.230487 103.2733 3.749727 -2.544930      5.653094 
1 1 1 -14 8  26 o 135.4009 3.476045 224.0288       11.45998 217.1843       14.28788 236.3743       19.18887 133.1977 4.407918 138.7534 5.687102 -5.555725      7.195337 
1 1 1 -14 8  27 o 118.4227 3.395549 171.4068       9.788868 165.1089       12.17006 182.9479       16.47488 116.1140 4.308497 122.0362 5.554406 -5.922165      7.029550 
1 1 1 -14 8  28 o 172.8163 3.312020 364.7655       13.94806 400.2097       21.10451 337.2768       18.58575 180.7188 4.796451 165.9302 4.600851 14.78857       6.646336 
1 1 1 -14 8  29 o 69.31289 3.106557 58.79010       5.233889 54.25600       7.734025 62.62106       7.109075 66.37404 4.814302 71.42938 4.101377 -5.055344      6.324461 
1 1 1 -14 8  30 o 44.54556 3.831282 24.45040       4.118594 23.71334       6.265375 25.01126       5.465380 43.49276 6.077127 44.86949 5.088143 -1.376736      7.925950 
1 1 1 -14 8  31 o 60.98853 3.858738 45.70105       5.705546 49.03584       7.255711 40.29802       9.235592 63.05160 4.757331 56.72953 6.817084 6.322071       8.312931 
1 1 1 -14 8  32 o 141.7190 3.507128 245.7542       12.11199 254.6035       20.99988 241.3430       14.82659 143.5387 6.016941 140.2172 4.344383 3.321503       7.421404 
1 1 1 -14 8  33 o 116.4425 2.999074 165.9137       8.503018 157.0039       12.29073 174.0928       11.77595 112.9745 4.473221 119.0699 4.064388 -6.095383      6.043920 
1 1 1 -14 8  34 o 33.46193 4.887671 14.07938       3.867967 11.16860       5.654048 16.63999       5.303068 29.33115 7.782699 36.12922 6.249354 -6.798073      9.981224 
1 1 1 -14 8  35 o 93.11851 2.953853 106.2986       6.694394 102.8949       9.703729 109.3896       9.247357 91.28241 4.375036 94.21739 4.036996 -2.934982      5.953006 
1 1 1 -14 8  36 o 30.22001 7.835566 12.05393       5.817956 21.50820       10.46248 7.821775       7.000054 39.69072 10.61217 25.73969 9.027258 13.95103       13.93232 
1 1 1 -14 8  37 o 118.2131 3.022652 171.7863       8.700284 170.5677       12.64153 172.8829       11.99225 117.1991 4.434283 118.1197 4.172772 -0.9206161     6.088916 
1 1 1 -14 8  38 o 29.75670 5.211230 11.41707       3.641238 13.25693       5.353542 9.833234       4.967119 31.51241 7.137637 27.11520 7.339370 4.397205       10.23778 
1 1 1 -14 8  39 o 74.54967 3.128296 68.78107       5.670527 69.95735       8.185325 67.69558       7.863051 74.56181 4.526201 73.39815 4.416556 1.163658       6.323959 
1 1 1 -14 8  40 f 39.53436 4.340987 19.89530       4.113433 19.68253       5.731892 20.12124       5.906585 38.43327 6.340983 38.79982 6.475029 -0.3665504     9.062784 
1 1 1 -14 8  41 o 11.19856 5.147464 -1.980041      3.217172 -3.026680      4.618389 -0.9933746     4.484118 13.12470 6.080536 14.23462 6.353039 -1.109916      8.793976 
1 1 1 -14 8  42 o 22.24210 7.018984 6.985423       4.253095 9.994232       5.289446 1.481992       7.153683 26.05046 7.756255 18.92519 8.250491 7.125267       11.32387 
1 1 1 -14 8  43 o 53.99403 3.710957 37.39603       4.853094 31.71098       6.906892 42.93983       6.820544 47.77187 6.069856 56.76932 4.980666 -8.997448      7.851764 
1 1 1 -14 8  44 o 25.05941 6.382956 9.235424       3.908048 11.06311       5.765884 7.682280       5.315212 26.16049 8.160751 22.33739 7.863637 3.823101       11.33290 
1 1 1 -14 8  45 o 17.06308 6.935606 3.370195       4.516547 0.7442666      5.577773 8.370666       7.697059 15.90046 7.091761 22.41353 9.074656 -6.513070      11.51705 
1 1 1 -14 8  46 o 14.65596 6.390181 1.284351       4.292626 3.174137       8.112473 0.5494769      5.058867 18.53341 8.384729 14.90259 6.692195 3.630817       10.72796 
1 1 1 -14 8  47 o 28.43792 6.277191 12.73973       4.233492 6.111626       6.139904 18.74661       5.845094 19.11629 7.959964 33.22719 7.407813 -14.11090      10.87367 
1 1 1 -14 8  48 f 19.59229 6.834695 6.660067       4.009358 4.126984       6.041740 8.653401       5.359540 17.17530 7.532622 21.11772 7.831908 -3.942417      10.86642 
1 1 1 -14 9  1  o 221.0137 4.385638 595.9062       23.62045 611.0509       29.40743 568.3715       39.65216 223.7342 5.393724 215.4550 7.563944 8.279144       9.290076 
1 1 1 -14 9  2  o 178.5802 3.269806 388.8308       14.22956 405.0904       20.95761 374.9243       19.38190 182.1491 4.725478 175.2451 4.542351 6.904007       6.554624 
1 1 1 -14 9  3  o 246.9103 3.628022 743.4161       21.82957 748.7852       35.03615 740.0093       27.90880 247.6458 5.805629 246.2806 4.650234 1.365204       7.438414 
1 1 1 -14 9  4  o 236.1526 3.506353 680.0055       20.17830 715.6350       33.13480 659.0037       25.43946 242.1204 5.615868 232.4222 4.491529 9.698166       7.191092 
1 1 1 -14 9  5  o 385.1200 5.794425 1810.814       54.38042 1765.624       76.17736 1857.774       77.65497 379.8954 8.228597 389.6927 8.177318 -9.797302      11.60079 
1 1 1 -14 9  6  o 277.6214 4.381400 940.1937       29.64162 920.0777       58.42890 947.1650       34.39648 274.0202 8.761281 278.5942 5.066475 -4.574005      10.12073 
1 1 1 -14 9  7  o 177.7484 2.922621 385.1648       12.65944 379.9094       20.38916 388.4617       16.14936 176.3918 4.747662 178.4787 3.713068 -2.086838      6.027202 
1 1 1 -14 9  8  o 345.1953 4.714641 1453.949       39.65972 1490.940       64.12024 1431.028       50.47255 349.1764 7.535537 342.3075 6.050660 6.868896       9.664099 
1 1 1 -14 9  9  o 393.2853 6.811378 1890.379       65.27979 1846.250       112.8987 1912.543       80.01111 387.2536 11.97788 395.2904 8.306114 -8.036804      14.57605 
1 1 1 -14 9  10 o 135.7030 2.870158 224.5081       9.491426 216.8617       13.97371 231.0574       12.93248 133.2552 4.308862 137.5825 3.861112 -4.327255      5.785713 
1 1 1 -14 9  11 o 84.16243 2.672548 86.43802       5.474306 75.19047       8.358241 94.88747       7.244362 78.37836 4.393642 88.14617 3.378824 -9.767815      5.542611 
1 1 1 -14 9  12 o 158.7121 3.058250 307.1411       11.82822 300.7614       17.28581 312.7586       16.22024 156.9233 4.525014 160.0541 4.162199 -3.130783      6.148143 
1 1 1 -14 9  13 o 254.1257 4.107186 787.9504       25.43484 822.4028       37.46738 758.5026       34.63943 259.4296 5.926491 249.1732 5.704707 10.25647       8.225994 
1 1 1 -14 9  14 o 232.3876 4.483897 659.1514       25.39246 661.1122       31.52576 655.5299       42.84473 232.6246 5.561270 231.2482 7.613344 1.376389       9.428188 
1 1 1 -14 9  15 o 193.6475 3.417033 457.3970       16.12490 450.1874       23.25870 464.0692       22.37508 191.9365 4.976892 194.9613 4.709558 -3.024780      6.851963 
1 1 1 -14 9  16 o 234.8972 4.514161 673.6216       25.83991 680.5869       32.20932 661.0433       43.28374 235.9835 5.600978 232.1411 7.661822 3.842377       9.490758 
1 1 1 -14 9  17 o 66.49763 3.311726 54.07216       5.349681 54.22808       7.059426 53.86185       8.199011 66.50475 4.380315 66.20274 5.121982 0.3020096      6.739574 
1 1 1 -14 9  18 o 69.63096 2.727598 59.21370       4.619318 60.20123       7.368790 58.57440       5.928901 70.08704 4.335646 69.19897 3.527555 0.8880692      5.589407 
1 1 1 -14 9  19 o 203.1765 4.027265 503.9117       19.93976 533.9099       36.36123 491.0112       23.84484 208.6004 7.163614 200.4723 4.880945 8.128098       8.668390 
1 1 1 -14 9  20 o 180.8651 3.303381 399.1157       14.55961 408.1445       21.47567 391.4360       19.80629 182.6971 4.827916 178.9522 4.545501 3.744965       6.631014 
1 1 1 -14 9  21 o 132.1882 3.243537 213.2042       10.44835 205.3711       18.50157 216.8720       12.66041 129.3997 5.882699 133.2221 3.903951 -3.822342      7.060239 
1 1 1 -14 9  22 o 49.25178 3.198114 29.72321       3.817660 31.75940       6.150778 28.44721       4.869063 50.71591 5.043566 48.07749 4.197988 2.638424       6.562062 
1 1 1 -14 9  23 f 59.20330 3.411231 42.92411       4.900613 60.09390       11.15276 38.81574       5.455506 69.68320 6.648263 56.23116 4.007540 13.45203       7.762717 
1 1 1 -14 9  24 o 132.1556 2.933723 213.1039       9.448019 202.4057       13.72529 222.7387       13.02521 128.6095 4.385796 134.9736 3.964339 -6.364120      5.911953 
1 1 1 -14 9  25 o 40.64740 3.742428 20.35081       3.665412 20.91317       5.811948 19.97941       4.723150 40.87094 6.015131 40.10913 4.936288 0.7618141      7.781308 
1 1 1 -14 9  26 o 149.4862 3.592109 272.9472       13.08539 273.1985       16.48776 272.5197       21.50842 149.3779 4.534634 148.9359 5.938059 0.4420013      7.471509 
1 1 1 -14 9  27 o 117.8109 2.921446 169.4097       8.387242 168.1089       12.37786 170.5139       11.40453 117.1541 4.343147 118.0406 3.970347 -0.8864899     5.884436 
1 1 1 -14 9  28 o 47.70665 3.826411 27.99946       4.411156 36.30129       6.662894 21.52127       5.885767 54.18818 5.105895 41.44088 6.002851 12.74730       7.880633 
1 1 1 -14 9  29 o 17.28274 6.298204 2.994981       3.441312 4.228346       5.180790 2.021096       4.603668 20.84555 7.705825 17.77621 7.079476 3.069345       10.46416 
1 1 1 -14 9  30 o 57.45618 3.362008 40.48701       4.686729 38.30577       6.977257 42.28034       6.326498 55.62207 5.208128 58.57702 4.465662 -2.954948      6.860520 
1 1 1 -14 9  31 o 32.21148 6.038483 13.18884       4.565858 17.70613       5.953069 6.735136       7.115515 37.29634 6.800445 25.18187 9.073268 12.11448       11.33888 
1 1 1 -14 9  32 o 118.3826 3.344408 171.5893       9.638463 171.7911       16.61413 171.4870       11.83331 117.8819 5.801367 118.2006 4.114466 -0.3186646     7.112291 
1 1 1 -14 9  33 o 119.6263 3.018725 175.1521       8.793040 184.8146       13.19935 167.4428       11.79011 122.5701 4.426348 116.7275 4.151458 5.842529       6.068539 
1 1 1 -14 9  34 o 55.22291 3.483423 37.53431       4.663834 33.66835       6.812522 40.94440       6.398267 51.89597 5.469024 57.47843 4.606483 -5.582466      7.150518 
1 1 1 -14 9  35 o 90.92632 2.966619 101.4017       6.564561 112.5097       9.838049 92.48667       8.813589 95.46192 4.239625 86.54699 4.191389 8.914932       5.961725 
1 1 1 -14 9  36 o 29.15136 7.692021 11.22063       5.542690 20.05378       9.567970 6.759168       6.799869 38.36318 10.09846 24.50574 8.864390 13.85745       13.43712 
1 1 1 -14 9  37 o 73.10331 3.081289 65.82912       5.476848 63.36558       8.087553 67.91583       7.443352 71.21406 4.686361 73.93261 4.148027 -2.718552      6.258443 
1 1 1 -14 9  38 o 29.16521 5.535698 11.06919       3.790487 15.80111       5.418097 6.533074       5.304814 34.57949 6.671440 22.94296 7.868578 11.63653       10.31613 
1 1 1 -14 9  39 o 52.76213 3.570278 34.72797       4.563472 35.25085       6.430046 34.19731       6.477666 52.54362 5.085273 51.68614 5.214105 0.8574791      7.283330 
1 1 1 -14 9  40 o 29.03509 5.461954 11.15515       3.722821 13.34909       5.256935 8.947914       5.272830 31.10420 7.093255 25.39874 7.783880 5.705458       10.53105 
1 1 1 -14 9  41 o 13.58148 6.075771 -1.036186      4.126824 1.994480       5.531467 -4.840739      6.197594 17.91026 7.513444 14.55454 6.840982 3.355715       10.16124 
1 1 1 -14 9  42 o 34.13885 5.988135 16.04259       4.800120 14.86605       5.955616 18.22384       8.109135 31.62682 7.781509 33.65220 9.483800 -2.025387      12.26761 
1 1 1 -14 9  43 o 11.60365 5.371202 -2.110943      3.592104 -2.255454      5.291125 -1.987397      4.892290 14.18158 6.548354 13.78136 6.339400 0.4002199      9.114216 
1 1 1 -14 9  44 o 55.89552 3.887604 40.68585       5.262354 49.75114       7.916093 33.50760       7.044169 60.01021 5.473324 48.52920 6.090267 11.48101       8.188323 
1 1 1 -14 9  45 o 24.64261 7.387579 9.857644       4.785944 8.995184       6.003728 11.36112       7.926830 22.93781 8.324803 24.52700 9.427691 -1.589186      12.57711 
1 1 1 -14 9  46 o 28.71167 7.106479 13.46700       4.945192 10.88707       8.680296 14.70671       6.017143 22.96930 9.505651 28.65297 8.201242 -5.683666      12.55459 
1 1 1 -14 9  47 o 13.39791 5.933791 0.7436284      3.836313 -2.298187      6.105270 2.728255       4.931487 13.99654 6.641751 15.93823 6.899953 -1.941694      9.577171 
1 1 1 -14 9  48 o 20.50173 7.207808 7.651550       4.464537 11.88510       8.726313 6.150501       5.196076 21.84422 9.312478 18.58975 7.481028 3.254478       11.94521 
1 1 1 -14 10 1  o 204.6250 3.660283 510.6663       18.25196 493.6794       25.32454 529.0275       26.32908 201.0312 5.173721 208.1710 5.190143 -7.139816      7.328368 
1 1 1 -14 10 2  o 183.3700 3.440338 410.0321       15.37325 398.2728       21.46434 422.4181       22.02875 180.5810 4.882116 185.9797 4.864757 -5.398727      6.892090 
1 1 1 -14 10 3  o 470.4051 6.224932 2703.267       71.35802 2590.723       109.9659 2785.127       93.78541 459.6146 9.818114 477.0502 8.067429 -17.43558      12.70743 
1 1 1 -14 10 4  o 315.3928 4.384769 1213.581       33.70036 1199.445       53.28104 1223.007       43.50910 313.2415 6.980032 316.4818 5.641508 -3.240387      8.974824 
1 1 1 -14 10 5  o 256.7829 4.141905 804.3354       25.91806 847.6581       53.19662 790.8508       29.67886 263.0219 8.310004 254.5725 4.784093 8.449417       9.588728 
1 1 1 -14 10 6  o 379.4648 5.129828 1757.602       47.43626 1734.215       74.84446 1773.304       61.32687 376.4210 8.159241 380.9335 6.606411 -4.512482      10.49847 
1 1 1 -14 10 7  o 255.4679 3.714865 795.9590       23.12680 788.3606       36.88511 800.8812       29.68693 254.0563 5.957787 256.1790 4.755385 -2.122726      7.622920 
1 1 1 -14 10 8  o 207.3562 3.215654 524.2717       16.24884 525.8814       26.29122 523.2769       20.66882 207.4871 5.203869 207.1124 4.095184 0.3746643      6.621993 
1 1 1 -14 10 9  o 306.5904 4.784568 1147.223       35.74681 1135.530       72.51736 1150.976       41.08534 304.0611 9.799698 307.0103 5.491586 -2.949249      11.23350 
1 1 1 -14 10 10 o 38.69223 3.491892 18.40628       3.257067 16.44048       5.756872 19.33178       3.950052 36.08557 6.795883 39.58949 4.156269 -3.503922      7.966090 
1 1 1 -14 10 11 f 38.55144 3.446074 18.27009       3.203334 19.03052       5.774497 17.93205       3.850045 38.96978 6.295154 38.10458 4.216695 0.8652039      7.576905 
1 1 1 -14 10 12 o 199.4525 3.491477 485.2055       16.97012 456.6067       23.92884 514.1440       24.07052 193.3090 5.084059 205.2205 4.813141 -11.91151      7.000998 
1 1 1 -14 10 13 o 113.0790 2.728901 155.9023       7.519791 148.8353       11.19369 161.7148       10.15168 110.3601 4.169722 115.0822 3.624396 -4.722130      5.524746 
1 1 1 -14 10 14 o 120.4115 3.291503 176.9692       9.649183 182.5233       12.48090 168.7172       15.21319 122.2222 4.196665 117.3994 5.331544 4.822746       6.785084 
1 1 1 -14 10 15 o 112.9829 3.258304 155.8251       8.961624 152.2960       11.43391 161.4458       14.42994 111.6252 4.210910 114.8456 5.169261 -3.220428      6.667310 
1 1 1 -14 10 16 o 34.63404 4.729525 14.91838       3.887516 19.85916       5.554652 10.17489       5.442615 39.87737 5.893323 28.34923 7.686556 11.52814       9.685783 
1 1 1 -14 10 17 o 101.8918 2.694495 126.6844       6.684539 132.9469       10.39256 122.2654       8.730034 104.2834 4.097485 100.0400 3.586820 4.243378       5.445609 
1 1 1 -14 10 18 o 163.7221 3.141152 326.9657       12.53235 327.8969       18.46476 326.1704       17.06474 163.7836 4.630985 163.3886 4.289608 0.3950043      6.312428 
1 1 1 -14 10 19 o 160.6779 3.120354 314.9402       12.21789 309.6393       17.88093 319.5825       16.73349 159.1427 4.615582 161.7213 4.249716 -2.578537      6.274048 
1 1 1 -14 10 20 o 99.28449 3.046486 120.3644       7.362115 117.1884       13.53898 121.6978       8.772431 97.69965 5.711566 99.79028 3.613376 -2.090637      6.758585 
1 1 1 -14 10 21 o 214.6623 4.201137 562.8277       21.97651 543.7510       37.99978 572.4149       26.93856 210.3223 7.425773 216.3568 5.109375 -6.034454      9.013757 
1 1 1 -14 10 22 o 161.4792 3.647596 318.3460       14.35356 310.3728       26.48416 321.6619       17.07945 158.9022 6.855563 162.1958 4.324997 -3.293671      8.105822 
1 1 1 -14 10 23 o 55.06074 3.551207 37.16643       4.739493 54.82283       11.24461 33.35206       5.226424 66.45155 7.051397 52.08362 4.152172 14.36793       8.183076 
1 1 1 -14 10 24 o 97.33757 2.801678 115.6931       6.638695 114.9745       10.03893 116.2515       8.850108 96.89680 4.261923 97.49100 3.732078 -0.5941925     5.665015 
1 1 1 -14 10 25 o 112.3542 3.335686 154.2607       9.122830 156.7381       11.84352 150.6462       14.30571 113.1446 4.303319 110.7790 5.314771 2.365562       6.838519 
1 1 1 -14 10 26 o 52.95374 3.378233 34.38189       4.336623 36.42858       6.740159 32.93615       5.664867 54.29569 5.155908 51.68928 4.543499 2.606411       6.872174 
1 1 1 -14 10 27 o 85.59512 2.912421 89.53587       6.066051 96.50713       9.376910 84.51878       7.954818 88.71104 4.350837 83.05474 3.941583 5.656296       5.870763 
1 1 1 -14 10 28 o 105.5908 2.927960 136.2287       7.526754 132.5714       11.13249 139.3082       10.21542 103.9791 4.403465 106.6594 3.937012 -2.680359      5.906824 
1 1 1 -14 10 29 o 43.46378 3.996173 23.30701       4.185264 32.99517       6.562782 16.66600       5.433557 51.58294 5.296043 36.27343 6.379757 15.30951       8.291525 
1 1 1 -14 10 30 o 112.7294 3.479844 155.5296       9.548009 177.5239       12.68706 126.8021       14.49958 120.3006 4.334785 101.3378 5.896961 18.96288       7.318778 
1 1 1 -14 10 31 o 76.06138 3.748648 70.98929       6.926837 69.87515       8.636014 72.99899       11.59873 75.30404 4.729968 76.65961 6.263348 -1.355568      7.848701 
1 1 1 -14 10 32 o 198.7024 3.639895 483.5352       17.62496 490.8141       25.74561 477.1151       24.17899 199.5570 5.298888 196.8557 5.044430 2.701309       7.316043 
1 1 1 -14 10 33 o 71.77557 3.160075 63.17758       5.513714 69.64047       8.305399 58.08464       7.372784 75.11117 4.559002 68.59771 4.434236 6.513458       6.359791 
1 1 1 -14 10 34 o 35.54986 4.750684 15.85558       4.012644 22.53717       6.077255 10.69123       5.342881 42.17157 6.089776 28.65715 7.547598 13.51442       9.698021 
1 1 1 -14 10 35 o 58.44372 3.369437 42.07770       4.778443 41.06386       7.026837 42.94986       6.517363 57.33529 5.081809 58.77825 4.586364 -1.442955      6.845401 
1 1 1 -14 10 36 o 46.67310 5.676431 27.62624       6.323614 22.54106       10.16957 30.83197       8.074459 40.49387 10.28705 48.88288 6.975951 -8.389011      12.42929 
1 1 1 -14 10 37 o 29.52749 5.425756 11.26575       3.760293 6.076210       5.421786 16.07561       5.219686 22.60270 7.943304 35.11523 6.332693 -12.51253      10.15870 
1 1 1 -14 10 38 o 30.86738 5.181317 12.30628       3.759449 6.784635       5.401712 17.49336       5.235510 23.22795 7.940873 36.59622 6.084197 -13.36827      10.00375 
1 1 1 -14 10 39 o 24.25731 6.114298 7.888174       3.612598 5.064726       5.073564 10.79187       5.145159 20.84384 7.639244 28.01479 7.419936 -7.170950      10.64958 
1 1 1 -14 10 40 o 37.43663 5.199910 18.30671       4.615931 20.30865       5.896455 15.13801       7.418325 38.79860 6.463764 32.02680 9.086373 6.771801       11.15089 
1 1 1 -14 10 41 o 41.20970 4.824212 22.16583       4.753060 20.68738       7.589260 23.11999       6.096856 37.32021 8.531357 41.20620 6.269028 -3.885994      10.58701 
1 1 1 -14 10 42 o 16.89937 6.756796 2.821032       4.210056 0.5495987      5.062102 7.917063       7.582230 15.86723 6.928428 23.61171 9.181327 -7.744472      11.50217 
1 1 1 -14 10 43 o 42.38371 4.420400 23.71215       4.498559 22.95210       6.460869 24.42736       6.267389 39.61046 6.946529 41.36972 6.425189 -1.759254      9.462417 
1 1 1 -14 10 44 o 25.70070 6.567647 9.922188       4.128119 7.001367       5.836413 12.84627       5.839674 21.38398 8.121366 27.96308 8.102820 -6.579102      11.47224 
1 1 1 -14 10 45 o 16.84153 6.640961 3.648081       4.013522 5.909097       5.878967 1.674446       5.492659 19.81353 7.963046 16.25495 7.153781 3.558577       10.70452 
1 1 1 -14 10 46 o 12.05869 5.641699 -1.976764      4.132686 -12.15684      7.189790 3.046249       5.050365 12.14913 6.055662 16.53246 7.067280 -4.383326      9.306852 
1 1 1 -14 10 47 o 13.47263 6.076021 0.3296190      4.220983 -5.554132      7.512331 3.044101       5.102594 13.98231 6.814598 16.21697 7.019632 -2.234662      9.783352 
1 1 1 -14 10 48 o 8.898146 4.421183 -6.993619      3.710420 -6.029140      5.904680 -7.622976      4.769782 12.12610 5.938057 10.25930 5.082758 1.866796       7.816326 
1 1 1 -14 11 1  o 189.6439 4.021312 438.7709       18.58415 396.8927       33.43494 457.4933       22.35564 179.9073 7.643749 193.5997 4.738559 -13.69241      8.993378 
1 1 1 -14 11 2  o 590.5073 8.644385 4273.146       124.3929 4332.906       177.5156 4215.490       174.3628 592.8948 12.28635 584.8347 12.23446 8.060181       17.33887 
1 1 1 -14 11 3  o 171.7821 2.926457 359.7848       12.25056 357.5428       19.86771 361.1601       15.56079 171.0882 4.769969 172.0762 3.710860 -0.9880066     6.043433 
1 1 1 -14 11 4  o 227.4220 3.451970 630.7515       19.13091 685.3057       32.24060 601.1043       23.76738 236.8823 5.585145 221.9516 4.394271 14.93077       7.106579 
1 1 1 -14 11 5  o 217.9968 3.340961 579.5201       17.74833 568.3704       28.31806 586.7333       22.77703 215.7458 5.386231 219.2920 4.262245 -3.546158      6.868640 
1 1 1 -14 11 6  o 288.0012 4.087924 1011.907       28.69018 1024.318       46.29106 1004.167       36.55837 289.4754 6.562198 286.7827 5.231156 2.692657       8.392106 
1 1 1 -14 11 7  o 417.5888 5.589930 2129.798       56.88415 2119.106       90.21136 2136.855       73.29145 415.7797 8.903522 417.9534 7.195971 -2.173676      11.44791 
1 1 1 -14 11 8  o 209.8449 3.248504 536.9832       16.61185 542.7806       26.98688 533.4465       21.07846 210.8345 5.252605 209.0992 4.136666 1.735321       6.685946 
1 1 1 -14 11 9  o 146.8925 3.433038 263.1577       12.28894 272.6936       23.59284 259.6071       14.39606 149.2077 6.504255 145.8149 4.055343 3.392838       7.664929 
1 1 1 -14 11 10 o 156.1847 2.752332 297.4105       10.47552 325.7911       17.91158 282.6566       12.91449 163.3189 4.504807 152.2327 3.481235 11.08624       5.693179 
1 1 1 -14 11 11 o 135.8072 2.912484 224.8898       9.638791 210.0496       14.08385 237.9648       13.21977 131.1138 4.414246 139.6054 3.889636 -8.491608      5.883437 
1 1 1 -14 11 12 o 143.0472 2.971581 249.5221       10.35865 239.7022       15.23850 257.9578       14.12362 140.0631 4.470323 145.3443 3.991382 -5.281128      5.992905 
1 1 1 -14 11 13 o 131.2505 3.390627 210.2633       10.83560 202.5516       13.67506 223.2730       17.76182 128.7449 4.365076 135.0757 5.406951 -6.330856      6.949029 
1 1 1 -14 11 14 o 36.28038 6.645356 16.60881       5.658803 16.60881       5.658803 0.000000       0.000000 36.28038 6.645356 ?        ?        0.000000       6.645356 
1 1 1 -14 11 15 o 136.4729 2.930817 227.1319       9.747005 210.0934       14.10223 242.7162       13.48703 131.1073 4.420244 140.9736 3.929765 -9.866241      5.914526 
1 1 1 -14 11 16 o 83.07333 2.721635 84.24362       5.502259 84.40336       8.670105 84.13590       7.119708 83.03701 4.299302 82.96758 3.529482 0.6942749E-01  5.562485 
1 1 1 -14 11 17 o 23.79369 5.186289 7.187526       2.922063 11.00057       5.431665 5.634545       3.466411 29.39963 7.544467 21.29155 6.263610 8.108080       9.805702 
1 1 1 -14 11 18 o 58.07241 2.951703 41.23958       4.163436 52.62261       7.185047 35.48537       5.108499 65.48219 4.530604 53.77442 3.925393 11.70777       5.994588 
1 1 1 -14 11 19 o 71.25970 2.811376 62.03074       4.872434 60.93548       7.826322 62.72393       6.226242 70.47601 4.581851 71.60085 3.579739 -1.124840      5.814455 
1 1 1 -14 11 20 o 106.6919 2.779444 138.9375       7.220305 149.3245       11.26873 131.7030       9.404385 110.4927 4.192701 103.8025 3.723838 6.690193       5.607647 
1 1 1 -14 11 21 o 121.9837 3.216099 181.7031       9.551871 180.0363       17.52125 182.4080       11.39390 121.1005 5.955486 122.1643 3.832035 -1.063797      7.081829 
1 1 1 -14 11 22 o 179.6478 3.859387 394.1444       16.89571 420.1853       32.41620 384.4315       19.79748 184.8188 7.211308 177.2773 4.586544 7.541534       8.546306 
1 1 1 -14 11 23 o 56.27063 3.148349 38.76470       4.299971 45.25735       6.940603 34.72027       5.477905 60.64997 4.733490 53.13120 4.266703 7.518780       6.372651 
1 1 1 -14 11 24 o 149.1407 3.102175 271.4857       11.27453 267.1802       16.61686 275.1586       15.34784 147.7271 4.621547 149.9801 4.203454 -2.252991      6.247217 
1 1 1 -14 11 25 o 86.31616 3.327583 91.10741       6.986231 91.65549       9.229150 90.37192       10.69139 86.46068 4.394746 85.75298 5.139805 0.7077026      6.762498 
1 1 1 -14 11 26 o 84.86720 2.906893 88.01325       6.002934 86.62455       9.132814 89.06960       7.965304 84.02638 4.476338 85.28368 3.842530 -1.257294      5.899376 
1 1 1 -14 11 27 o 159.9025 3.221235 312.2699       12.55203 331.5829       18.98041 297.2586       16.73362 164.4826 4.740265 155.7912 4.412131 8.691391       6.475879 
1 1 1 -14 11 28 o 66.20688 3.125407 53.65676       5.028264 54.57293       7.769178 52.99640       6.596049 66.56099 4.822526 65.68206 4.142078 0.8789291      6.357167 
1 1 1 -14 11 29 o 67.81464 3.192281 56.31520       5.260655 56.43378       8.071684 56.22764       6.936146 67.65360 4.929782 67.63456 4.229537 0.1904297E-01  6.495517 
1 1 1 -14 11 30 o 49.79729 4.486657 30.64199       5.386259 30.92651       6.596149 30.07264       9.331098 49.85273 5.522054 48.56430 8.174638 1.288429       9.864978 
1 1 1 -14 11 31 o 36.08918 5.989508 16.48342       5.082918 15.41965       7.493783 17.38984       6.917424 34.45127 8.872438 36.68827 7.965954 -2.237003      11.92378 
1 1 1 -14 11 32 o 74.47534 3.116615 67.97085       5.643791 67.25239       8.281570 68.59386       7.711895 73.82628 4.626521 74.63271 4.257961 -0.8064270     6.287680 
1 1 1 -14 11 33 o 32.31762 5.129027 13.19506       3.904568 13.45110       5.733399 12.97360       5.332190 32.16846 7.459146 31.64189 7.091198 0.5265713      10.29193 
1 1 1 -14 11 34 o 57.06908 3.414328 40.10094       4.726634 42.37385       7.011906 38.20801       6.398999 58.33627 4.980012 55.42065 4.784918 2.915611       6.906226 
1 1 1 -14 11 35 o 61.71592 4.920347 47.52757       7.338726 42.75382       11.73490 50.59372       9.404722 57.10645 8.707598 63.27016 6.178371 -6.163712      10.67682 
1 1 1 -14 11 36 o 15.65063 6.165926 1.867432       3.457161 0.9473659      5.024744 2.694486       4.763999 17.09513 7.165576 18.37664 7.238650 -1.281509      10.18546 
1 1 1 -14 11 37 o 22.34514 6.192281 6.548913       3.488320 6.803885       5.307112 6.354966       4.628650 23.31470 7.872377 22.41097 7.346156 0.9037304      10.76756 
1 1 1 -14 11 38 o 18.00382 6.433855 3.711947       3.569745 -2.132581      5.037985 9.604971       5.058844 14.61878 6.611228 26.61108 7.487583 -11.99230      9.988605 
1 1 1 -14 11 39 o 23.45008 6.843251 7.443244       4.152068 3.696600       5.156007 14.35524       7.003162 19.39219 7.562490 31.66429 8.773470 -12.27210      11.58296 
1 1 1 -14 11 40 o 21.24439 6.416282 6.121119       3.600413 6.281390       5.225026 5.976216       4.968184 21.94970 7.790256 21.47598 7.598854 0.4737206      10.88259 
1 1 1 -14 11 41 o 17.32152 6.572322 3.382789       3.820131 3.061582       5.321305 3.724372       5.487489 18.41107 7.511447 19.15907 7.695662 -0.7480011     10.75384 
1 1 1 -14 11 42 o 22.24917 6.874784 7.187204       4.102823 6.450497       5.689880 7.985135       5.921589 21.51577 8.051968 23.16457 8.285555 -1.648800      11.55355 
1 1 1 -14 11 43 o 16.91301 6.523565 3.416079       3.804705 4.357163       5.655059 2.637799       5.142694 19.15597 7.770102 17.28591 7.247608 1.870060       10.62555 
1 1 1 -14 11 44 o 14.91205 6.481992 1.034701       4.388474 -1.858392      5.573992 5.752225       7.117742 14.42317 6.681387 20.50251 8.556369 -6.079345      10.85598 
1 1 1 -14 11 45 o 23.33555 6.845988 8.711305       4.145840 5.440246       6.146045 11.44244       5.615954 19.32475 7.998090 25.55632 8.065630 -6.231565      11.35887 
1 1 1 -14 11 46 o 13.04459 5.944445 -0.4064220     4.169358 -2.251980      8.106301 0.2574160      4.861720 15.77135 7.531365 14.26393 6.468243 1.507418       9.927720 
1 1 1 -14 11 47 o 35.12565 5.351300 18.35258       4.436065 25.60477       7.051129 13.60176       5.707007 37.82547 7.904650 26.64051 8.084956 11.18496       11.30708 
1 1 1 -14 12 1  o 172.0385 2.948412 360.8998       12.36089 344.4679       19.62603 371.7035       15.91381 167.9030 4.801578 174.5542 3.741174 -6.651108      6.086998 
1 1 1 -14 12 2  o 198.8670 4.116416 482.5679       19.94886 451.0171       32.20760 502.2057       25.40969 191.8834 6.899096 202.7258 5.147613 -10.84232      8.607871 
1 1 1 -14 12 3  o 120.0813 2.774511 175.8074       8.118915 173.3001       15.86877 176.6964       9.449313 118.9848 5.487658 120.3278 3.225447 -1.343040      6.365367 
1 1 1 -14 12 4  o 246.2582 4.053512 739.9117       24.32530 766.2219       35.77991 717.2993       33.17044 250.4120 5.863381 242.3141 5.617414 8.097809       8.120011 
1 1 1 -14 12 5  f 349.2798 4.795920 1489.294       40.82081 1546.297       66.58602 1454.971       51.66921 355.3707 7.688920 345.0208 6.145405 10.34995       9.843042 
1 1 1 -14 12 6  o 136.5107 2.649860 227.1923       8.815068 230.1138       14.66688 225.5402       11.02938 137.2457 4.390986 135.9905 3.328178 1.255188       5.509767 
1 1 1 -14 12 7  o 111.1712 2.514808 150.6686       6.812923 147.5029       11.41805 152.4188       8.489845 109.8592 4.273153 111.7556 3.120469 -1.896385      5.291234 
1 1 1 -14 12 8  o 212.2147 3.659594 549.3593       18.92538 538.4100       27.17926 559.6647       26.36821 209.8884 5.318181 214.0844 5.054283 -4.195984      7.336813 
1 1 1 -14 12 9  o 29.87215 4.314528 11.11469       3.049872 8.789790       8.346715 11.47293       3.276433 28.30790 9.862299 30.32010 4.576791 -2.012192      10.87253 
1 1 1 -14 12 10 o 205.0991 3.217009 513.0262       16.07875 484.7910       25.32047 532.1049       20.81381 199.1554 5.221776 208.8179 4.090230 -9.662476      6.633018 
1 1 1 -14 12 11 o 193.7197 3.455661 457.7587       16.31327 484.8159       24.57025 436.4284       21.81553 199.1716 5.066391 189.0009 4.740333 10.17075       6.938232 
1 1 1 -14 12 12 o 121.0231 3.353340 178.7908       9.880145 169.5448       12.58539 193.6419       15.95028 117.7703 4.392953 125.7938 5.214538 -8.023445      6.818316 
1 1 1 -14 12 13 o 189.6793 3.998799 439.0732       18.48356 444.1789       23.37741 430.5587       30.18925 190.6241 5.036898 187.4569 6.619066 3.167160       8.317595 
1 1 1 -14 12 14 o 326.9074 5.876196 1306.777       46.81200 1311.855       57.93666 1297.227       79.44984 327.2348 7.265372 324.4487 10.06088 2.786102       12.40996 
1 1 1 -14 12 15 o 92.11112 2.762563 103.5564       6.193973 104.6702       9.663813 102.7798       8.069411 92.49339 4.299238 91.70827 3.617847 0.7851105      5.618920 
1 1 1 -14 12 16 o 59.69107 2.953777 43.56223       4.283237 52.27345       7.274078 38.93871       5.299378 65.26058 4.603484 56.35036 3.882892 8.910221       6.022368 
1 1 1 -14 12 17 f 121.4798 2.869608 179.9874       8.494984 184.0083       13.05740 177.0366       11.18598 122.6717 4.374940 120.3739 3.818170 2.297783       5.806765 
1 1 1 -14 12 18 o 165.7999 3.201574 335.3848       12.93552 325.9239       18.86566 343.7793       17.77060 163.2483 4.747321 167.7131 4.351772 -4.464767      6.440106 
1 1 1 -14 12 19 o 104.6226 2.798146 133.6059       7.127575 130.7111       10.90029 135.7681       9.420649 103.3530 4.337559 105.3994 3.673423 -2.046432      5.684052 
1 1 1 -14 12 20 o 159.5444 3.564667 310.7135       13.85915 333.5681       25.78034 301.4238       16.43620 164.8475 6.429896 157.0181 4.299568 7.829422       7.734976 
1 1 1 -14 12 21 o 241.3733 4.648165 712.2301       27.34053 736.1537       50.39008 702.2488       32.54802 244.3160 8.476479 239.5024 5.576717 4.813538       10.14645 
1 1 1 -14 12 22 o 181.1319 3.381064 400.5049       14.92397 404.2667       22.06987 397.3355       20.25775 181.7134 4.988705 180.2099 4.616726 1.503479       6.797157 
1 1 1 -14 12 23 o 160.1487 3.597862 313.2092       14.04119 313.6374       25.16321 313.0155       16.92041 159.7261 6.478225 159.9581 4.344811 -0.2319946     7.800307 
1 1 1 -14 12 24 o 35.09010 4.189107 15.26405       3.511467 16.57697       5.729361 14.47416       4.443947 36.16105 6.749922 33.93314 5.567016 2.227913       8.749464 
1 1 1 -14 12 25 o 144.2340 3.581641 254.1297       12.58884 266.4564       16.36108 236.2414       19.70944 147.5043 4.557142 138.6491 5.846512 8.855179       7.412776 
1 1 1 -14 12 26 o 142.8080 3.095039 249.0100       10.77097 265.0766       16.36767 236.7380       14.30479 147.0921 4.571819 139.0559 4.226299 8.036163       6.226005 
1 1 1 -14 12 27 o 81.91647 2.932355 82.03320       5.844167 77.47603       8.869795 85.52941       7.768974 79.40929 4.603327 83.55055 3.825890 -4.141258      5.985654 
1 1 1 -14 12 28 o 123.8589 3.000446 187.3684       9.056264 189.0984       13.62361 185.9986       12.12241 124.1628 4.510105 123.2204 4.042581 0.9424362      6.056691 
1 1 1 -14 12 29 o 70.22756 3.132264 60.38205       5.346972 58.00028       8.167283 62.16865       7.073606 68.58174 4.919576 71.14142 4.097542 -2.559677      6.402505 
1 1 1 -14 12 30 o 57.31553 4.194676 40.47118       5.818205 36.64500       7.076039 48.45709       10.22280 54.31615 5.418160 62.22295 6.855383 -7.906803      8.738006 
1 1 1 -14 12 31 o 66.15743 3.538908 53.73511       5.684612 56.24055       10.11274 52.57771       6.873333 67.16284 6.250544 65.31360 4.343122 1.849243       7.611307 
1 1 1 -14 12 32 o 20.50450 6.590417 5.105316       3.735633 12.90003       5.912157 -0.7477319E-01 4.819640 31.50620 7.753802 16.11176 6.896095 15.39444       10.37678 
1 1 1 -14 12 33 o 69.90223 3.227703 59.99769       5.483360 63.67389       8.285208 57.13247       7.314482 71.69785 4.769107 67.97451 4.440021 3.723343       6.515993 
1 1 1 -14 12 34 o 12.78183 5.653607 -1.022985      3.471608 2.112149       5.310793 -3.362248      4.587444 18.64712 7.542140 13.28660 6.121555 5.360519       9.713769 
1 1 1 -14 12 35 o 44.47255 5.827165 25.14640       6.163404 29.81318       11.19751 23.11796       7.382350 46.79448 10.11490 42.06293 7.476032 4.731544       12.57785 
1 1 1 -14 12 36 o 52.72004 3.547966 34.44222       4.531635 37.73844       6.992674 32.05555       5.950200 54.64658 5.318222 50.46729 4.899810 4.179287       7.231295 
1 1 1 -14 12 37 o 54.87899 3.507831 37.40167       4.666606 41.46596       6.994874 34.14180       6.264519 57.22776 5.068106 51.91083 5.014499 5.316936       7.129580 
1 1 1 -14 12 38 o 18.44725 6.942871 3.572502       4.243131 8.117628       5.326462 -4.320893      7.019364 24.62962 7.864824 16.28537 7.527776 8.344248       10.88682 
1 1 1 -14 12 39 o 25.74320 5.907955 8.922770       3.627585 3.370608       5.375998 13.56405       4.915266 19.19933 7.648966 31.57386 6.601046 -12.37453      10.10349 
1 1 1 -14 12 40 o 18.17339 6.817818 3.771513       4.084555 4.580605       6.885530 3.332206       5.073674 21.23485 8.588179 18.61826 7.426375 2.616594       11.35376 
1 1 1 -14 12 41 o 17.69680 6.988203 3.275861       4.449937 0.4519829      5.338049 9.708549       8.056674 16.22163 7.098259 25.44139 9.568730 -9.219761      11.91410 
1 1 1 -14 12 42 o 33.89514 5.418147 15.74050       4.324687 21.40400       6.124511 10.10826       6.107585 38.51983 6.771613 25.30685 8.444217 13.21298       10.82403 
1 1 1 -14 12 43 o 42.02834 4.552766 23.59415       4.588501 26.29375       6.831632 21.37537       6.193447 42.19924 6.880125 37.90410 6.961641 4.295143       9.787776 
1 1 1 -14 12 44 o 26.62777 7.188375 11.25957       4.772406 15.27823       6.167191 5.261014       7.534780 30.08564 8.192644 20.07926 8.608934 10.00639       11.88416 
1 1 1 -14 12 45 o 15.51254 6.582210 2.280259       4.324282 -2.365977      8.479055 3.913531       5.027200 16.33325 7.772476 17.44185 7.227521 -1.108603      10.61360 
1 1 1 -14 12 46 o 35.28373 5.358515 18.28805       4.462716 12.87969       6.747932 22.49248       5.949644 24.97900 8.854260 37.38927 6.779500 -12.41027      11.15166 
1 1 1 -14 12 47 o 16.21093 6.593025 3.784244       4.084150 3.978781       6.430563 3.652719       5.287492 17.24100 7.656630 16.58588 7.162430 0.6551170      10.48448 
1 1 1 -14 13 1  o 168.9184 3.198461 348.0033       13.16600 341.7041       25.50838 350.2909       15.37184 167.0340 6.277915 169.4434 3.722761 -2.409348      7.298709 
1 1 1 -14 13 2  o 211.5577 3.786108 546.0658       19.51902 570.5947       28.14810 523.3456       27.09039 216.1136 5.344794 206.8998 5.377587 9.213745       7.581904 
1 1 1 -14 13 3  o 299.3603 4.237812 1093.735       30.91520 1157.621       51.07703 1056.798       38.83706 307.5770 6.814526 294.1080 5.418803 13.46906       8.706388 
1 1 1 -14 13 4  o 82.86330 2.507694 83.78697       5.057931 98.15533       9.096588 77.35683       6.085348 89.58574 4.178319 79.58163 3.144068 10.00411       5.229102 
1 1 1 -14 13 5  o 70.20718 2.567770 60.17402       4.385727 61.66529       7.736656 59.46789       5.323757 70.93352 4.498930 69.75983 3.139722 1.173691       5.486185 
1 1 1 -14 13 6  o 309.2024 4.337837 1166.911       32.68527 1195.362       52.98658 1149.435       41.52760 312.5277 6.957308 306.7097 5.556141 5.818054       8.903642 
1 1 1 -14 13 7  o 287.7693 4.571650 1010.954       32.05927 997.5876       45.61861 1023.997       45.06378 285.5706 6.555297 289.3542 6.390894 -3.783600      9.155078 
1 1 1 -14 13 8  o 208.6651 3.267573 531.0543       16.61541 526.4090       26.81721 533.9485       21.16793 207.5137 5.307466 209.1688 4.152843 -1.655060      6.739088 
1 1 1 -14 13 9  o 297.5717 4.704060 1081.192       34.11148 1015.118       67.16157 1104.162       39.59937 287.2239 9.608950 300.6149 5.405571 -13.39099      11.02507 
1 1 1 -14 13 10 o 123.1943 2.911027 185.0742       8.739225 183.7705       13.04516 186.1357       11.77107 122.6186 4.372729 123.4439 3.917965 -0.8252945     5.871219 
1 1 1 -14 13 11 o 255.1423 4.200199 794.5725       26.11490 747.2111       36.22977 845.7928       37.67682 247.1937 6.014396 263.0163 5.878350 -15.82256      8.409992 
1 1 1 -14 13 12 o 315.2993 4.924694 1214.307       37.83889 1229.450       54.66205 1200.375       52.43212 316.8411 7.079594 313.1184 6.871519 3.722687       9.866023 
1 1 1 -14 13 13 o 96.85771 3.365155 114.5821       7.930767 110.6529       10.21059 120.5575       12.59158 95.09660 4.418130 99.19055 5.227691 -4.093948      6.844605 
1 1 1 -14 13 14 o 224.1444 3.831537 613.1432       20.92845 576.7446       29.33154 650.8915       29.87040 217.1278 5.548037 230.7698 5.311608 -13.64204      7.680748 
1 1 1 -14 13 15 o 140.1077 2.992065 239.4288       10.21572 247.0468       15.54321 233.6354       13.55454 142.1572 4.492428 138.2864 4.026539 3.870804       6.032821 
1 1 1 -14 13 16 o 230.0677 3.888164 646.1214       21.79899 658.6162       31.99626 635.2977       29.77978 232.0440 5.658388 227.9444 5.361131 4.099640       7.794812 
1 1 1 -14 13 17 o 59.96035 3.033751 43.96969       4.418416 39.66172       6.983660 46.84505       5.705496 56.73169 5.106088 61.83151 3.805013 -5.099823      6.367908 
1 1 1 -14 13 18 o 145.7498 3.049140 259.1603       10.82983 264.8393       16.33601 254.7073       14.46540 147.1536 4.561038 144.3594 4.116167 2.794235       6.143769 
1 1 1 -14 13 19 o 77.03443 2.873847 72.49202       5.385458 78.06892       8.780357 69.12868       6.818685 79.80056 4.533782 75.15562 3.734787 4.644943       5.873994 
1 1 1 -14 13 20 o 179.4520 4.590535 393.8897       20.05815 0.000000       0.000000 393.8897       20.05815 ?        ?        179.4520 4.590535 0.000000       4.590535 
1 1 1 -14 13 21 o 112.0819 2.895546 153.3748       7.902022 150.3443       12.09372 155.6325       10.43841 110.8108 4.487878 112.8224 3.802103 -2.011597      5.881925 
1 1 1 -14 13 22 o 136.9710 3.031417 228.9546       10.11836 218.2717       14.94282 238.0007       13.75047 133.5219 4.599314 139.5061 4.049003 -5.984253      6.127651 
1 1 1 -14 13 23 o 124.6967 2.955061 189.7639       8.979608 208.5471       14.08188 176.8923       11.65715 130.5170 4.433926 120.2492 3.983586 10.26784       5.960592 
1 1 1 -14 13 24 o 70.37463 3.320040 60.60880       5.677660 44.59847       10.21174 67.77258       6.830786 59.78868 7.150434 74.38070 3.780954 -14.59202      8.088531 
1 1 1 -14 13 25 o 135.1775 3.520162 223.3810       11.58600 229.4041       15.07755 214.6964       18.10490 136.8428 4.527632 132.1808 5.633636 4.661987       7.227538 
1 1 1 -14 13 26 o 133.9603 3.057240 219.1254       9.980260 221.0800       14.97817 217.5646       13.38436 134.2996 4.583368 133.3019 4.125230 0.9976807      6.166424 
1 1 1 -14 13 27 o 83.88730 3.000197 86.04791       6.123254 88.70032       9.609918 84.23500       7.944906 84.96243 4.659318 82.89016 3.944551 2.072266       6.104812 
1 1 1 -14 13 28 o 50.60539 3.566868 31.46762       4.370477 30.00529       6.991622 32.40551       5.599278 49.03005 5.974908 51.22800 4.531970 -2.197945      7.499219 
1 1 1 -14 13 29 o 141.4383 3.734225 244.9665       12.85948 242.2663       16.06108 249.7891       21.46404 140.4522 4.699180 142.2048 6.208820 -1.752594      7.786638 
1 1 1 -14 13 30 o 77.10071 3.161690 72.81165       5.927771 75.49427       9.156839 70.87644       7.777344 78.24265 4.825969 75.91134 4.220869 2.331314       6.411374 
1 1 1 -14 13 31 o 60.25760 3.781654 44.67602       5.525026 42.54574       9.634030 45.72002       6.744317 58.12695 6.938171 60.82336 4.583946 -2.696407      8.315695 
1 1 1 -14 13 32 o 64.73025 3.292974 51.45671       5.177288 55.09730       8.076462 48.91713       6.745544 66.65272 5.009060 62.90671 4.428617 3.746006       6.686054 
1 1 1 -14 13 33 o 130.9392 3.115782 210.1145       9.941980 204.2954       14.59552 215.1516       13.57956 128.5726 4.666121 132.1159 4.223309 -3.543335      6.293570 
1 1 1 -14 13 34 o 123.2239 4.452921 187.9390       13.34939 208.7271       21.97793 175.7858       16.80444 128.3866 7.051834 118.5054 5.836981 9.881210       9.154163 
1 1 1 -14 13 35 o 54.16922 5.350288 36.99220       6.970491 56.34573       12.64512 28.54433       8.354426 65.71824 8.064761 46.70375 7.601749 19.01449       11.08273 
1 1 1 -14 13 36 o 75.86827 3.187770 71.04738       5.880502 76.76426       8.937940 66.68394       7.808574 78.28318 4.706993 73.06948 4.405770 5.213699       6.447216 
1 1 1 -14 13 37 o 47.06203 4.703391 28.05540       5.321905 24.43481       6.540795 35.14735       9.154267 43.19310 6.408130 51.32330 7.544323 -8.130199      9.898533 
1 1 1 -14 13 38 o 51.05523 3.613011 32.61404       4.466130 28.34712       6.698533 36.02879       5.992415 46.49376 6.055982 53.22163 4.667584 -6.727875      7.645996 
1 1 1 -14 13 39 o 11.40312 5.282191 -2.495365      3.483394 -1.237713      5.440300 -3.369243      4.534904 15.55623 6.966341 12.81833 5.968129 2.737896       9.173247 
1 1 1 -14 13 40 o 31.92770 6.102779 13.96865       4.575199 13.97119       7.768814 13.96730       5.661027 29.94106 9.491146 31.07275 7.551226 -1.131695      12.12860 
1 1 1 -14 13 41 o 64.99741 4.096084 54.46206       6.454860 48.50491       7.714580 68.36754       11.78653 60.22033 5.311320 69.27847 7.081032 -9.058144      8.851618 
1 1 1 -14 13 42 o 35.43316 5.253526 17.14505       4.399056 22.49853       6.397419 12.34331       6.058793 39.21203 6.949361 27.75542 8.310106 11.45661       10.83289 
1 1 1 -14 13 43 o 18.69613 6.863410 4.898568       4.098022 7.105855       5.671356 2.486889       5.928123 21.48573 8.039233 17.59705 7.591427 3.888687       11.05708 
1 1 1 -14 13 44 o 10.73234 5.181429 -4.731287      4.082612 -10.43729      7.052787 -1.855741      5.006739 12.70609 6.274055 13.54304 6.293806 -0.8369455     8.886830 
1 1 1 -14 13 45 o 17.36226 6.937319 4.274187       4.435075 -10.26950      8.307720 10.07120       5.245014 13.68040 6.765108 23.76348 7.821603 -10.08309      10.34138 
1 1 1 -14 13 46 f 14.60307 6.228225 2.068138       3.906319 1.702290       6.165293 2.313511       5.049127 16.02781 7.274388 15.68367 6.882037 0.3441334      10.01395 
1 1 1 -14 13 47 o 24.91558 6.744013 10.59749       4.193948 17.70599       6.530095 5.606751       5.471585 29.67966 8.558898 18.13217 7.529222 11.54749       11.39929 
1 1 1 -14 14 1  o 162.0196 3.150284 320.1732       12.43808 326.2921       24.61567 318.0753       14.41346 163.2050 6.200587 161.4589 3.663281 1.746048       7.201868 
1 1 1 -14 14 2  o 109.1494 3.077315 145.4150       8.177032 132.0373       11.25210 160.3865       11.90351 103.8994 4.454453 114.5460 4.271897 -10.64654      6.171812 
1 1 1 -14 14 3  o 188.2894 3.116189 432.3940       14.29835 407.2153       22.63682 449.1080       18.44327 182.5065 5.094790 191.8380 3.945184 -9.331467      6.443707 
1 1 1 -14 14 4  o 48.99357 2.921242 29.37571       3.471893 26.29458       6.180427 30.79632       4.196640 46.04399 5.624835 50.12602 3.456767 -4.082035      6.602121 
1 1 1 -14 14 5  o 295.0768 4.194872 1062.751       30.16407 1071.880       48.45470 1056.975       38.54325 295.9391 6.718887 294.1095 5.377783 1.829620       8.606044 
1 1 1 -14 14 6  o 164.5793 3.228753 330.3734       12.94930 315.8550       18.56122 344.1404       18.07461 160.7569 4.743250 167.8396 4.423001 -7.082687      6.485473 
1 1 1 -14 14 7  o 165.4080 3.234006 333.7117       13.03568 363.0781       19.85217 311.4518       17.28396 172.3659 4.730766 159.6607 4.446644 12.70518       6.492518 
1 1 1 -14 14 8  o 111.0331 3.304549 150.5117       8.931349 133.1276       17.12948 157.0023       10.46670 104.0683 6.791545 113.3689 3.793951 -9.300606      7.779406 
1 1 1 -14 14 9  o 128.5737 2.971518 201.6049       9.310360 209.8045       14.15408 195.3512       12.36100 131.0150 4.439689 126.4534 4.016411 4.561592       5.986852 
1 1 1 -14 14 10 o 220.7373 3.402621 594.4017       18.30314 599.1752       29.76836 591.5002       23.20841 221.4052 5.517355 220.1163 4.326702 1.288910       7.011530 
1 1 1 -14 14 11 o 129.4957 2.952637 204.5126       9.317547 198.3135       13.89559 209.5769       12.55948 127.3624 4.484125 130.9829 3.939260 -3.620491      5.968681 
1 1 1 -14 14 12 o 257.9187 3.782652 811.8055       23.77471 845.6768       39.23850 792.1577       29.88504 262.9108 6.124460 254.6546 4.815774 8.256180       7.791065 
1 1 1 -14 14 13 o 110.7811 2.920004 149.7809       7.876009 158.1103       11.97409 143.4293       10.45628 113.7117 4.329074 108.3279 3.967667 5.383789       5.872245 
1 1 1 -14 14 14 o 296.1698 4.697565 1071.569       33.90390 1074.626       48.89428 1068.738       47.05339 296.1757 6.774426 295.4185 6.536077 0.7572632      9.413455 
1 1 1 -14 14 15 o 139.6306 3.025414 237.8274       10.29441 223.4107       15.09286 250.3690       14.07714 135.1551 4.589161 143.1446 4.039596 -7.989471      6.113815 
1 1 1 -14 14 16 o 112.1781 2.874744 153.5938       7.852090 159.7974       12.26215 149.2819       10.22299 114.2909 4.410979 110.5190 3.801474 3.771889       5.823052 
1 1 1 -14 14 17 o 62.35568 3.115733 47.55668       4.719482 46.12441       7.758024 48.39812       5.946330 61.18877 5.253678 62.83914 3.902395 -1.650364      6.544449 
1 1 1 -14 14 18 o 261.1225 4.275620 832.9871       27.20692 834.2587       39.38165 831.8260       37.63084 260.9452 6.193106 260.6252 5.925041 0.3200073      8.570921 
1 1 1 -14 14 19 o 199.1392 4.104256 484.4331       19.91715 459.0064       35.45857 496.1533       24.07373 193.1102 7.549488 201.4233 4.904532 -8.313065      9.002733 
1 1 1 -14 14 20 o 117.4495 3.284154 168.5005       9.390403 176.3156       18.19193 165.6619       10.96398 119.7558 6.255393 116.3980 3.870714 3.357727       7.356111 
1 1 1 -14 14 21 o 97.61478 2.887160 116.3680       6.860329 110.4965       10.50824 120.7295       9.056715 94.95318 4.554626 99.35202 3.747460 -4.398842      5.898141 
1 1 1 -14 14 22 o 275.5968 4.470057 928.8250       30.02088 929.2713       43.34635 928.4136       41.61823 275.1183 6.465423 275.0723 6.208701 0.4602051E-01  8.963797 
1 1 1 -14 14 23 o 113.2188 2.930774 156.5505       8.079263 154.9230       12.26548 157.7978       10.73790 112.4528 4.484873 113.5696 3.885629 -1.116745      5.933987 
1 1 1 -14 14 24 o 133.7488 3.537225 218.6833       11.51880 213.6844       14.82327 226.3030       18.30104 132.0577 4.613302 135.7389 5.544343 -3.681274      7.212648 
1 1 1 -14 14 25 o 123.3146 3.348896 185.8852       10.05426 171.0461       17.80256 192.8350       12.18325 117.8112 6.223046 125.5160 3.988224 -7.704826      7.391362 
1 1 1 -14 14 26 o 186.2211 3.949911 424.1584       17.92472 402.3211       31.11941 435.0006       21.92757 180.4650 7.090030 188.3591 4.781002 -7.894119      8.551404 
1 1 1 -14 14 27 o 104.3397 2.965821 133.0721       7.533381 139.3070       11.70419 128.6621       9.843421 106.5376 4.518449 102.4682 3.949433 4.069450       6.001200 
1 1 1 -14 14 28 o 50.13036 4.614750 31.06887       5.574261 28.59608       6.892328 35.74490       9.477869 47.81881 6.049859 53.22186 7.516790 -5.403046      9.648986 
1 1 1 -14 14 29 o 44.57034 5.006268 24.70986       5.343565 28.45414       6.795797 18.64531       8.648790 47.67617 5.980526 37.82402 9.419240 9.852154       11.15745 
1 1 1 -14 14 30 o 101.3908 3.329760 125.9340       8.215958 119.6531       14.47006 128.9223       9.980837 98.21078 6.075847 102.4658 4.004875 -4.255051      7.277014 
1 1 1 -14 14 31 o 53.49559 3.569800 35.22620       4.627066 29.24733       6.990810 39.88745       6.172621 48.22474 6.083815 56.77977 4.497798 -8.555027      7.565910 
1 1 1 -14 14 32 f 47.76445 3.866475 28.20429       4.462009 25.70241       6.865664 30.03372       5.870926 44.99606 6.445240 49.07457 4.978034 -4.078510      8.143828 
1 1 1 -14 14 33 o 34.26207 4.877938 14.80717       3.957824 13.67364       6.180209 15.59526       5.153155 32.21174 7.927743 34.81793 6.305523 -2.606190      10.12960 
1 1 1 -14 14 34 f 104.6976 4.388383 135.8816       11.17155 160.8553       19.54503 123.7637       13.61476 112.3662 7.175296 99.35462 5.646474 13.01155       9.130584 
1 1 1 -14 14 35 o 28.98955 6.368405 11.03521       4.375702 15.53453       6.104838 6.281527       6.275026 34.14953 7.537957 23.46309 8.511478 10.68644       11.36952 
1 1 1 -14 14 36 o 24.26215 6.544590 7.807269       3.957740 13.31003       6.141829 3.899742       5.175572 31.25872 8.023036 19.91888 7.627655 11.33984       11.07024 
1 1 1 -14 14 37 o 24.12293 6.204176 7.779865       3.667596 5.106707       5.527031 9.883025       4.902481 21.30825 7.943591 26.93565 7.291752 -5.627401      10.78287 
1 1 1 -14 14 38 o 21.02662 6.441342 5.888676       3.611274 11.10667       5.920777 2.797528       4.557080 28.03572 8.169108 17.78919 7.056885 10.24653       10.79509 
1 1 1 -14 14 39 o 22.98394 6.350013 7.274347       3.674474 7.898733       5.598727 6.801902       4.870107 23.85664 8.085615 22.37508 7.541290 1.481564       11.05659 
1 1 1 -14 14 40 o 38.92576 4.765553 19.90143       4.426324 18.99857       6.567279 20.65297       5.991767 36.04359 7.710123 38.44164 6.635897 -2.398052      10.17257 
1 1 1 -14 14 41 o 36.99591 5.906501 18.99702       5.146037 22.37535       6.406493 12.85315       8.639544 39.34852 6.934493 27.48914 9.984983 11.85938       12.15677 
1 1 1 -14 14 42 o 25.31699 6.461163 9.439501       3.998961 13.19106       5.743784 5.910326       5.570944 28.84207 7.927741 20.52580 7.899934 8.316267       11.19187 
1 1 1 -14 14 43 o 35.39748 7.624253 19.83682       6.382205 15.70256       8.973669 24.06857       9.078854 28.06585 10.17885 35.76928 10.01871 -7.703434      14.28228 
1 1 1 -14 14 44 o 33.55228 5.743660 16.46519       4.527439 12.49628       6.525215 20.14956       6.286960 25.89674 8.729190 35.10456 7.571996 -9.207819      11.55569 
1 1 1 -14 14 45 o 18.07652 6.894569 5.092389       4.217530 2.022592       8.006204 6.271446       4.961800 17.46454 8.061001 19.38088 7.456507 -1.916348      10.98086 
1 1 1 -14 14 46 f 35.83983 5.318166 19.03204       4.504107 26.16977       6.985468 13.95299       5.892602 38.66055 7.685412 26.81759 8.230489 11.84295       11.26084 
1 1 1 -14 15 1  o 270.1252 4.998537 891.5257       32.90365 895.9744       57.06907 889.3105       40.27098 269.9123 8.687767 269.6025 6.129602 0.3097839      10.63247 
1 1 1 -14 15 2  o 57.82000 4.099699 41.01269       5.739056 38.38647       6.949049 46.64688       10.17832 55.81132 5.168055 61.33027 6.931614 -5.518951      8.646159 
1 1 1 -14 15 3  o 185.9753 3.469074 421.9655       15.72189 402.5976       22.48610 440.4889       21.99041 181.4515 5.090343 189.8465 4.757041 -8.395065      6.967139 
1 1 1 -14 15 4  o 285.7776 4.590314 997.3226       31.96736 1018.834       46.35506 977.8153       44.14333 288.5001 6.593486 282.6690 6.408418 5.831146       9.194666 
1 1 1 -14 15 5  o 234.0732 4.569288 669.0683       26.06371 663.6506       32.63498 678.6095       43.30928 232.9736 5.748314 235.1644 7.567269 -2.190781      9.502982 
1 1 1 -14 15 6  o 80.86597 2.865081 79.84718       5.637052 88.25829       9.124052 74.65456       7.168931 84.90606 4.425011 78.12538 3.776718 6.780678       5.817587 
1 1 1 -14 15 7  o 266.6334 3.898186 867.6412       25.32872 868.0225       40.68663 867.4000       32.36506 266.3497 6.268497 266.4592 4.984362 -0.1094971     8.008615 
1 1 1 -14 15 8  o 104.1573 2.884197 132.4059       7.313618 125.7352       16.88466 133.9465       8.114331 101.0934 6.895105 104.7431 3.182698 -3.649719      7.594211 
1 1 1 -14 15 9  o 162.9517 2.892869 323.8336       11.48745 323.9358       18.90074 323.7737       14.46587 162.7799 4.769913 162.8928 3.644238 -0.1128845     6.002711 
1 1 1 -14 15 10 o 100.1335 2.561897 122.3394       6.246263 138.8053       11.21560 114.9359       7.520528 106.5345 4.329139 97.01656 3.185338 9.517944       5.374740 
1 1 1 -14 15 11 o 73.20294 2.655745 65.43100       4.729668 54.02273       8.227636 71.06155       5.780168 66.28976 5.133189 76.26262 3.116798 -9.972855      6.005336 
1 1 1 -14 15 12 o 81.65678 2.602555 81.39146       5.172175 77.15217       8.992168 83.48742       6.322781 79.33504 4.671861 82.66858 3.144300 -3.333534      5.631421 
1 1 1 -14 15 13 o 107.2802 2.942581 140.4863       7.685528 146.3306       11.64691 135.9787       10.22863 109.3722 4.378715 105.4627 3.987175 3.909424       5.922053 
1 1 1 -14 15 14 o 131.0275 3.001295 209.4270       9.583127 204.1360       14.41289 213.6197       12.82998 129.1816 4.585680 132.2146 3.986638 -3.032944      6.076327 
1 1 1 -14 15 15 o 227.3270 3.894810 630.9391       21.57613 606.3047       30.69917 654.9857       30.33067 222.5228 5.665905 231.4064 5.378617 -8.883545      7.812298 
1 1 1 -14 15 16 o 31.52569 4.866111 12.43151       3.618177 10.29212       6.173083 13.55110       4.465656 28.64904 8.339498 32.79291 5.800327 -4.143866      10.15830 
1 1 1 -14 15 17 o 83.98277 3.227433 86.19637       6.592868 92.31976       13.38537 84.23502       7.575500 86.55410 6.391176 82.97585 3.756221 3.578255       7.413254 
1 1 1 -14 15 18 o 82.24323 3.226314 82.67346       6.453561 94.06947       13.39617 79.22938       7.364468 87.37149 6.334824 80.46270 3.766322 6.908791       7.369883 
1 1 1 -14 15 19 o 75.08398 3.279524 68.94167       5.986119 92.19762       12.99792 62.68121       6.743885 86.49886 6.207614 71.53204 3.883337 14.96682       7.322211 
1 1 1 -14 15 20 o 143.3101 3.095905 250.6527       10.81186 251.5530       16.27087 249.9409       14.46799 143.3431 4.664194 142.9524 4.157595 0.3906403      6.248223 
1 1 1 -14 15 21 o 169.9752 3.327199 352.7370       13.78163 356.4182       20.51361 349.7086       18.60605 170.5831 4.940010 169.0406 4.520817 1.542435       6.696379 
1 1 1 -14 15 22 f 179.1949 3.416369 392.1321       14.91855 396.6333       22.20233 388.4270       20.14363 179.9080 5.069266 178.1173 4.644791 1.790710       6.875430 
1 1 1 -14 15 23 f 55.76719 3.424576 38.12682       4.631505 35.87638       7.477785 39.52742       5.899251 53.77227 5.798166 56.68793 4.302548 -2.915665      7.220156 
1 1 1 -14 15 24 o 47.21222 4.251511 27.48555       4.839066 25.48277       7.135374 29.19112       6.584692 45.03252 6.706387 48.44909 5.685204 -3.416565      8.791881 
1 1 1 -14 15 25 o 42.97305 4.017359 22.78303       4.158244 18.83293       7.052391 24.88815       5.148384 38.36216 7.809721 44.82110 4.787650 -6.458935      9.160422 
1 1 1 -14 15 26 o 99.32367 2.979256 120.5930       7.202868 122.8823       11.32101 119.0360       9.336284 100.0306 4.657036 98.56634 3.894619 1.464302       6.070918 
1 1 1 -14 15 27 o 70.11014 3.526214 60.25636       6.005223 73.14886       11.62111 55.55942       7.014337 76.80340 6.263472 67.21217 4.305188 9.591225       7.600377 
1 1 1 -14 15 28 o 126.1911 3.696915 195.0594       11.35627 215.6191       14.76670 165.2977       17.76656 132.4960 4.580345 115.5524 6.333622 16.94363       7.816286 
1 1 1 -14 15 29 o 91.84900 3.042259 103.2579       6.799971 108.4981       10.71263 99.72165       8.800187 93.86385 4.698340 90.10833 4.017764 3.755516       6.181976 
1 1 1 -14 15 30 o 36.77062 4.862850 16.92207       4.250691 15.56351       7.969550 17.46221       5.025145 34.50733 9.277823 37.18053 5.730045 -2.673203      10.90465 
1 1 1 -14 15 31 o 60.24094 3.389172 44.61548       4.955260 45.83723       7.817600 43.79493       6.406713 60.66795 5.342351 59.48990 4.451605 1.178051       6.953956 
1 1 1 -14 15 32 o 20.81555 6.615762 5.349802       3.772535 3.648309       5.822525 6.580914       4.952734 20.73284 8.050202 23.19306 7.598780 -2.460220      11.07010 
1 1 1 -14 15 33 o 32.65094 6.131929 13.75667       4.699863 10.47052       11.40121 14.42940       5.158551 30.53149 11.40360 33.33807 6.583368 -2.806580      13.16749 
1 1 1 -14 15 34 o 9.249991 4.621417 -11.38229      4.294924 -11.93647      9.178732 -11.22694      4.859776 16.46721 7.903727 10.30589 5.110157 6.161328       9.411834 
1 1 1 -14 15 35 o 90.62253 3.114697 101.2726       6.868186 104.8037       10.47715 98.61175       9.094994 91.49300 4.715055 88.98672 4.206026 2.506279       6.318418 
1 1 1 -14 15 36 o 36.55306 4.803968 17.05412       4.175698 11.96968       6.512651 20.60340       5.441349 29.45587 8.563326 39.86393 5.768835 -10.40806      10.32521 
1 1 1 -14 15 37 o 19.43979 6.540211 4.753361       3.662999 6.175605       5.558453 3.661580       4.870062 22.36005 8.023973 19.11555 7.378613 3.244497       10.90083 
1 1 1 -14 15 38 o 39.32642 4.433730 19.83539       4.175055 17.49941       6.218235 21.75288       5.633775 35.38178 7.447916 40.47956 5.883319 -5.097786      9.491305 
1 1 1 -14 15 39 o 12.92033 5.898931 -1.906987      4.130669 4.598821       6.975531 -5.420289      5.126067 21.17018 8.613965 12.63195 6.020193 8.538227       10.50919 
1 1 1 -14 15 40 o 14.65528 6.523430 -0.4546470     4.695446 1.162812       5.785377 -3.576356      8.037321 17.15795 7.450495 16.96355 7.913836 0.1943951      10.86916 
1 1 1 -14 15 41 o 56.04042 3.915064 40.61084       5.312954 41.04679       7.731285 40.22073       7.313421 54.39229 5.928667 54.16375 5.622546 0.2285385      8.170809 
1 1 1 -14 15 42 f 19.37135 7.396878 5.194406       4.858029 -0.6564003     8.435101 8.098302       5.942552 17.89330 8.264306 22.59722 8.269915 -4.703926      11.69146 
1 1 1 -14 15 43 o 51.40831 4.852372 36.27232       6.006959 27.89613       7.330140 53.39909       10.48158 42.12458 7.411181 58.13459 7.578984 -16.01001      10.60031 
1 1 1 -14 15 44 o 13.14847 6.057693 -1.084419      4.491639 0.5994954      7.773339 -1.928460      5.503381 16.98943 7.877123 13.87174 6.496560 3.117691       10.21050 
1 1 1 -14 15 45 o 19.33297 6.856752 6.197073       4.047207 7.395055       6.382449 5.391399       5.234099 20.14267 8.223168 18.39069 7.469566 1.751980       11.10923 
1 1 1 -14 15 46 o 13.77769 6.008733 1.412153       3.797454 9.777961       6.574173 -2.776882      4.652049 21.56852 8.501104 12.06713 5.746537 9.501387       10.26116 
1 1 1 -14 16 1  o 130.4957 3.618160 207.9740       11.49478 206.7110       18.34143 208.7909       14.75105 129.8604 5.810611 130.6543 4.640378 -0.7939606     7.436149 
1 1 1 -14 16 2  o 253.6985 4.178980 785.8314       25.83595 834.3015       53.03933 770.7529       29.58288 260.4762 8.366766 251.1662 4.833293 9.309982       9.662478 
1 1 1 -14 16 3  o 198.3665 3.234459 480.0299       15.63530 450.0154       24.55321 500.5027       20.27831 191.8031 5.258070 202.4772 4.109789 -10.67409      6.673655 
1 1 1 -14 16 4  o 221.4406 3.449982 598.2931       18.61702 610.4578       30.39252 590.9874       23.55304 223.4339 5.581891 219.9912 4.393450 3.442780       7.103514 
1 1 1 -14 16 5  o 84.34072 2.619344 86.82386       5.376990 73.74731       8.973158 94.15000       6.716396 77.55186 4.771165 87.79794 3.144254 -10.24608      5.714049 
1 1 1 -14 16 6  o 115.7800 2.650130 163.4640       7.477161 161.6179       12.53246 164.4844       9.317087 114.9517 4.482481 116.0686 3.297386 -1.116898      5.564655 
1 1 1 -14 16 7  o 77.93964 2.677565 74.16401       5.077957 66.86057       8.638873 78.01959       6.276802 73.82095 4.828719 79.90688 3.230086 -6.085938      5.809474 
1 1 1 -14 16 8  o 223.8492 3.871235 611.6158       21.11744 595.9541       43.71254 616.3838       24.11860 220.1537 8.161998 224.6620 4.405410 -4.508316      9.275012 
1 1 1 -14 16 9  o 186.8823 3.112410 426.0334       14.17428 427.0982       23.18270 425.3978       17.91245 186.8660 5.095693 186.6782 3.937542 0.1877289      6.439746 
1 1 1 -14 16 10 o 105.4859 2.618599 135.6934       6.731312 116.7841       11.02385 146.9352       8.499897 97.66329 4.645285 109.7007 3.182934 -12.03742      5.631140 
1 1 1 -14 16 11 o 125.0271 2.680503 190.6365       8.166886 198.7290       14.02033 186.4804       10.04749 127.4678 4.520745 123.5811 3.339395 3.886734       5.620382 
1 1 1 -14 16 12 o 76.22658 2.690566 70.95182       4.990046 80.44743       9.093391 66.86030       5.969074 81.01295 4.625342 73.94979 3.320804 7.063156       5.693991 
1 1 1 -14 16 13 o 167.1433 3.338280 340.9013       13.59715 357.8386       20.38693 327.3304       18.24879 171.0298 4.896563 163.6119 4.581533 7.417892       6.705727 
1 1 1 -14 16 14 f 144.2294 2.779506 253.7322       9.769169 250.4713       16.33748 255.5471       12.18822 143.0829 4.691900 144.7023 3.456436 -1.619415      5.827596 
1 1 1 -14 16 15 o 102.6858 2.638268 128.6905       6.596376 123.9855       11.36372 131.0815       8.100901 100.6125 4.647372 103.5948 3.212805 -2.982361      5.649795 
1 1 1 -14 16 16 o 297.7733 5.454523 1085.206       39.58026 1091.730       70.51294 1082.205       47.82537 297.0668 9.753664 297.0530 6.606757 0.1373291E-01  11.78063 
1 1 1 -14 16 17 o 60.35990 3.579286 44.63635       5.241150 32.34610       10.34402 48.88145       6.079291 50.53032 8.715155 63.13679 3.971367 -12.60647      9.577353 
1 1 1 -14 16 18 o 35.21960 4.492700 15.40736       3.768255 14.13921       6.677899 15.99982       4.564383 33.23217 8.277278 35.75557 5.407140 -2.523396      9.886885 
1 1 1 -14 16 19 o 134.4812 3.450479 220.9575       11.29843 229.4672       21.56797 217.7391       13.26404 136.5822 6.498699 133.4248 4.084274 3.157440       7.675570 
1 1 1 -14 16 20 o 109.5471 2.961439 146.5614       7.898438 143.9368       12.16390 148.4748       10.38581 108.3802 4.616179 110.1696 3.874528 -1.789474      6.026698 
1 1 1 -14 16 21 o 51.68906 3.495526 32.77859       4.377089 37.50141       7.506829 30.34581       5.387755 55.02042 5.680390 49.60652 4.506016 5.413902       7.250587 
1 1 1 -14 16 22 o 144.3042 3.161508 254.2464       11.11755 259.0927       16.83763 250.5005       14.80329 145.4079 4.758192 143.0564 4.251055 2.351517       6.380585 
1 1 1 -14 16 23 o 148.3656 3.197119 268.8114       11.55921 269.1628       17.39595 268.5335       15.46779 148.1734 4.824152 148.0947 4.290527 0.7870483E-01  6.456088 
1 1 1 -14 16 24 o 91.83271 3.041369 103.0935       6.796778 110.5516       10.66994 98.00066       8.817118 94.89989 4.627767 89.41691 4.056988 5.482986       6.154297 
1 1 1 -14 16 25 o 126.1066 3.056477 194.2428       9.392800 212.2969       14.79707 182.0586       12.15585 131.5503 4.622994 121.9008 4.097893 9.649521       6.177767 
1 1 1 -14 16 26 o 120.3470 3.072147 177.0572       9.002398 180.7563       13.98327 174.4387       11.76483 121.3240 4.738733 119.3073 4.052411 2.016701       6.235192 
1 1 1 -14 16 27 o 126.1177 3.730747 194.8240       11.45329 200.2786       14.56395 185.9828       18.54183 127.6798 4.688774 122.6452 6.224265 5.034508       7.792693 
1 1 1 -14 16 28 o 56.47115 3.854117 39.24300       5.272016 36.85181       10.07509 40.14461       6.186611 53.85832 7.912137 57.02039 4.488487 -3.162067      9.096616 
1 1 1 -14 16 29 o 45.23347 4.149769 25.31379       4.523327 20.63723       7.290325 28.24097       5.767775 40.02160 7.755191 47.63557 5.045281 -7.613968      9.251911 
1 1 1 -14 16 30 o 23.15518 6.284799 6.877936       3.636290 7.409432       6.333380 6.616575       4.441257 25.12300 8.598191 23.04127 7.158259 2.081738       11.18792 
1 1 1 -14 16 31 o 46.74026 4.052550 27.06712       4.570324 32.99213       7.501494 23.56953       5.763521 51.13838 6.142356 43.25157 5.599561 7.886806       8.311656 
1 1 1 -14 16 32 f 89.64423 3.144022 98.71508       6.857585 95.38374       10.48476 101.2056       9.065492 87.59949 4.931491 90.50806 4.121061 -2.908577      6.426721 
1 1 1 -14 16 33 o 18.85750 8.050359 0.4793679      6.537326 -4.791607      10.80339 3.524431       8.211318 21.12557 9.604307 22.95759 9.344163 -1.832018      13.39985 
1 1 1 -14 16 34 o 55.12566 3.608323 37.67891       4.820604 42.58625       7.671699 34.47711       6.196777 57.98552 5.494760 52.33039 4.916931 5.655136       7.373507 
1 1 1 -14 16 35 o 35.34692 4.722869 15.90202       3.966409 16.49249       6.385931 15.53115       5.061015 34.90997 7.712430 34.39643 6.268828 0.5135422      9.938802 
1 1 1 -14 16 36 o 13.39231 5.800888 -0.1570513     3.489343 4.589188       5.784845 -2.871511      4.374804 20.98180 8.056677 12.97507 5.978014 8.006732       10.03228 
1 1 1 -14 16 37 o 54.80432 3.678736 37.69706       4.884574 37.11742       7.394880 38.14570       6.505863 53.26067 5.790656 54.49658 4.952961 -1.235909      7.619942 
1 1 1 -14 16 38 o 35.72440 5.687736 17.03600       4.785683 16.69693       6.227065 17.52523       7.479800 34.21990 7.658828 34.26484 8.884501 -0.4494095E-01 11.72996 
1 1 1 -14 16 39 o 30.99399 6.393236 13.42727       4.668389 14.44355       8.084541 12.91888       5.718061 29.97508 9.700644 29.50977 7.825031 0.4653168      12.46329 
1 1 1 -14 16 40 o 51.41637 4.878650 35.09389       6.039618 35.99892       7.295384 33.12248       10.76730 51.07211 5.974535 44.30660 10.18578 6.765507       11.80869 
1 1 1 -14 16 41 o 24.85805 7.225117 9.430467       4.636651 8.754453       7.984978 9.774359       5.695167 23.57908 9.345256 24.76396 8.150311 -1.184887      12.40006 
1 1 1 -14 16 42 o 14.49523 6.366779 0.5947716      4.330981 1.204372       5.470722 -0.4287802     7.088871 16.19102 7.132040 16.71644 7.667946 -0.5254154     10.47203 
1 1 1 -14 16 43 o 9.808366 4.774366 -5.096385      3.655602 -2.894852      5.120266 -7.385221      5.220805 13.08582 6.171430 11.35187 5.564047 1.733947       8.309342 
1 1 1 -14 16 44 o 22.04798 7.303945 8.336987       4.571326 9.899151       8.407302 7.681285       5.446863 22.02889 9.253437 20.85532 7.862556 1.173571       12.14273 
1 1 1 -14 16 45 o 25.29498 6.746796 10.68402       4.235209 12.60992       6.393427 9.178066       5.653561 24.78574 8.631749 21.82957 8.053272 2.956171       11.80518 
1 1 1 -14 17 1  o 17.87736 6.093409 3.596150       3.180203 3.553357       3.846192 3.688637       5.654395 18.57586 6.673584 20.89878 7.980149 -2.322924      10.40286 
1 1 1 -14 17 2  o 286.5687 5.256862 1004.183       36.71059 956.9422       61.91486 1029.794       45.58844 278.6033 9.131870 289.9388 6.452268 -11.33548      11.18136 
1 1 1 -14 17 3  o 215.3572 4.288289 566.4249       22.50503 557.3972       38.86196 570.9800       27.60488 212.9929 7.498970 216.0965 5.242062 -3.103561      9.149523 
1 1 1 -14 17 4  o 139.2508 2.792192 236.4991       9.474996 241.3964       15.77129 233.7332       11.85236 140.4905 4.612893 138.3496 3.518387 2.140915       5.801536 
1 1 1 -14 17 5  o 194.3589 3.579879 461.0163       16.95543 427.7981       23.90505 494.6465       24.05283 186.9792 5.251590 201.1806 4.906185 -14.20146      7.186783 
1 1 1 -14 17 6  o 213.9340 3.855286 558.7036       20.09891 522.3450       27.60034 599.7519       29.32643 206.5852 5.487364 221.4488 5.434377 -14.86356      7.722928 
1 1 1 -14 17 7  o 188.6694 3.159595 434.2712       14.52677 418.7166       23.21945 444.2751       18.62119 184.9936 5.155642 190.7566 4.005822 -5.763031      6.528955 
1 1 1 -14 17 8  o 168.0269 3.335206 344.4970       13.65644 357.7648       30.10970 341.0608       15.32318 170.6257 7.258035 167.1543 3.761796 3.471436       8.174973 
1 1 1 -14 17 9  o 190.1300 3.175697 441.0404       14.71383 429.3280       23.70522 448.3809       18.76650 187.3107 5.198350 191.6301 4.018681 -4.319382      6.570589 
1 1 1 -14 17 10 o 198.0471 3.233999 478.5707       15.60790 474.0400       25.34306 481.3392       19.81071 196.8087 5.288986 198.5361 4.094722 -1.727371      6.688806 
1 1 1 -14 17 11 o 18.09074 5.929636 3.838285       3.015735 5.121772       5.539615 3.297692       3.595170 22.26699 8.007920 17.92904 6.450768 4.337950       10.28296 
1 1 1 -14 17 12 o 53.84657 3.559699 35.54416       4.644769 41.84553       7.399960 31.44765       5.966492 58.25597 5.269506 50.48274 4.912018 7.773224       7.203861 
1 1 1 -14 17 13 o 205.0963 3.319884 513.3468       16.59269 529.2014       27.59669 504.3700       20.76536 207.8893 5.452100 203.1992 4.193546 4.690109       6.878315 
1 1 1 -14 17 14 o 239.6514 4.644044 702.0405       27.12142 743.3393       50.03460 684.8571       32.27418 245.5763 8.373046 236.5282 5.599331 9.048111       10.07276 
1 1 1 -14 17 15 o 91.99796 3.288226 103.4281       7.359984 104.0734       14.44498 103.2019       8.553550 91.89699 6.492080 91.84910 3.829917 0.4788971E-01  7.537597 
1 1 1 -14 17 16 o 120.4232 2.662201 176.8978       7.812448 201.6252       14.10094 165.9458       9.384416 128.3486 4.515417 116.5530 3.307401 11.79555       5.597132 
1 1 1 -14 17 17 o 54.17773 3.496634 35.98575       4.591786 36.97914       7.935482 35.48572       5.630064 54.59240 6.067289 53.70838 4.338548 0.8840179      7.458887 
1 1 1 -14 17 18 o 146.6073 3.171506 262.3546       11.33072 271.4634       17.40155 255.6503       14.92919 148.8836 4.802568 144.5592 4.242527 4.324402       6.408096 
1 1 1 -14 17 19 o 166.5619 3.792589 338.9323       15.39386 326.0884       28.03318 344.4774       18.41950 162.6876 7.088026 167.7668 4.509514 -5.079208      8.400942 
1 1 1 -14 17 20 o 43.02590 4.029266 22.82353       4.175518 18.47725       7.229590 24.99904       5.114870 38.00289 8.056941 44.95201 4.740576 -6.949120      9.348121 
1 1 1 -14 17 21 o 43.49104 3.882339 23.30060       4.071398 24.70373       7.096909 22.61227       4.970725 44.32233 6.786368 42.70328 4.863196 1.619049       8.348980 
1 1 1 -14 17 22 o 131.9949 3.106928 212.7379       9.993657 238.4956       15.99220 196.2345       12.80092 139.4866 4.711546 126.5984 4.154949 12.88821       6.281900 
1 1 1 -14 17 23 o 88.02332 3.502676 94.83105       7.498350 98.33741       10.45692 91.11984       10.75803 89.46305 4.814228 86.05421 5.153696 3.408836       7.052472 
1 1 1 -14 17 24 o 125.7565 3.094389 193.1748       9.482905 188.9958       14.44923 196.3365       12.56834 124.0830 4.787535 126.6004 4.079189 -2.517395      6.289696 
1 1 1 -14 17 25 o 128.0847 3.106846 200.4344       9.697351 216.9664       15.36367 189.4864       12.50254 132.9399 4.750091 124.3413 4.131906 8.598648       6.295713 
1 1 1 -14 17 26 o 105.0646 3.804111 135.2788       9.723621 131.5285       12.40751 141.2484       15.65413 103.3912 4.938811 106.9005 6.033641 -3.509323      7.797223 
1 1 1 -14 17 27 o 112.7341 3.081220 155.4861       8.456810 169.3442       13.53684 146.6155       10.83034 117.3321 4.744176 109.3005 4.073278 8.031609       6.252903 
1 1 1 -14 17 28 o 128.3995 3.140012 201.6739       9.824958 199.8010       14.99814 203.0817       13.00353 127.3672 4.840996 128.5909 4.155138 -1.223648      6.379688 
1 1 1 -14 17 29 o 90.02184 3.373308 99.40426       7.387052 105.1062       13.89937 97.15974       8.720613 91.84267 6.247522 88.87004 4.037303 2.972633       7.438505 
1 1 1 -14 17 30 o 49.57018 4.081483 30.41329       4.886674 20.57742       8.962700 34.57405       5.829330 39.38864 9.457239 52.77297 4.578093 -13.38433      10.50706 
1 1 1 -14 17 31 o 66.39764 3.360718 54.25744       5.420086 61.50412       8.982258 50.10786       6.797006 70.20664 5.289036 63.56847 4.415166 6.638168       6.889673 
1 1 1 -14 17 32 o 75.59937 5.242399 71.48142       9.598114 63.88468       15.10149 76.62992       12.43215 69.66800 9.113366 77.70074 6.629009 -8.032738      11.26930 
1 1 1 -14 17 33 o 62.91315 3.962749 49.14276       6.044524 48.22197       8.497897 50.08569       8.599504 61.70454 5.716410 62.91352 5.669874 -1.208984      8.051386 
1 1 1 -14 17 34 o 14.36622 6.022577 0.6354880      3.550341 5.380688       6.254683 -1.620227      4.312412 22.41311 8.430735 13.80287 6.190109 8.610240       10.45919 
1 1 1 -14 17 35 o 28.68066 5.831035 10.84552       3.936391 9.030473       6.436826 11.92983       4.975142 26.06728 8.668095 29.72291 6.987316 -3.655636      11.13366 
1 1 1 -14 17 36 o 70.74141 3.312786 62.27540       5.695020 65.12936       8.955070 60.33731       7.379586 71.28562 5.190593 69.07844 4.406806 2.207184       6.808979 
1 1 1 -14 17 37 f 22.43198 6.568139 6.876691       3.819337 1.059133       5.935124 10.98858       4.989767 17.77596 7.631351 27.97185 7.258389 -10.19589      10.53194 
1 1 1 -14 17 38 o 52.84308 4.267049 35.85270       5.448107 32.68632       9.844711 37.25051       6.541030 46.66812 8.982554 53.30203 5.097817 -6.633911      10.32831 
1 1 1 -14 17 39 o 33.06585 8.191146 16.69031       6.565849 16.69031       6.565849 0.000000       0.000000 33.06585 8.191146 ?        ?        0.000000       8.191146 
1 1 1 -14 17 40 o 27.81031 6.411476 11.18285       4.256151 6.429623       5.946319 16.17616       6.094634 21.38225 8.178925 32.44983 7.803370 -11.06758      11.30431 
1 1 1 -14 17 41 o 19.48026 6.941388 5.457364       4.152182 5.649122       6.156689 5.297376       5.623597 20.33292 8.156839 19.80203 7.844425 0.5308857      11.31676 
1 1 1 -14 17 42 o 13.03965 6.034368 -1.741668      4.529569 1.430841       5.785173 -6.767471      7.281447 16.45721 7.287831 14.12692 6.844239 2.330288       9.997805 
1 1 1 -14 17 43 o 20.65705 6.866479 6.886914       4.039260 6.008412       5.701286 7.772285       5.723531 19.50404 7.840702 21.17249 8.042118 -1.668459      11.23175 
1 1 1 -14 17 44 o 16.34024 6.775689 3.421079       4.422520 -5.171504      8.234992 6.903716       5.242705 14.84494 7.212249 19.91882 7.664359 -5.073887      10.52421 
1 1 1 -14 17 45 o 18.09896 6.746677 5.399743       3.986777 8.396063       6.286845 3.384312       5.156116 20.60695 8.250855 16.40879 7.079353 4.198160       10.87170 
1 1 1 -14 18 1  o 92.58420 2.979291 104.6833       6.713053 105.7403       8.733750 103.1571       10.49424 92.97871 3.863031 91.74770 4.709505 1.231010       6.091178 
1 1 1 -14 18 2  o 184.7128 3.450674 416.4155       15.53235 413.2712       30.38604 417.5276       18.07177 183.4473 6.808963 184.9051 4.010659 -1.457840      7.902365 
1 1 1 -14 18 3  o 149.0783 3.112329 271.1561       11.30670 276.2056       22.51406 269.4531       13.07515 150.0398 6.170764 148.5748 3.611315 1.464996       7.149819 
1 1 1 -14 18 4  o 258.6342 3.862185 816.7151       24.34193 820.8578       39.26234 814.1284       31.02400 258.8652 6.223955 258.0570 4.933398 0.8081970      7.942042 
1 1 1 -14 18 5  o 29.82875 4.625463 11.12785       3.253418 20.47692       6.185443 7.552155       3.825314 40.37654 6.507623 24.38340 6.369239 15.99314       9.105843 
1 1 1 -14 18 6  o 203.7960 3.317725 506.8207       16.47677 476.1492       25.98157 527.4542       21.31005 197.2125 5.411347 207.8074 4.208112 -10.59491      6.854990 
1 1 1 -14 18 7  o 63.43581 3.283991 49.23540       5.059312 61.34994       13.45418 47.24019       5.460062 70.20627 8.007000 62.10497 3.623478 8.101303       8.788722 
1 1 1 -14 18 8  f 149.7607 2.878597 273.5914       10.50545 277.7903       17.47964 271.2171       13.14429 150.6798 4.766372 149.0596 3.618604 1.620163       5.984363 
1 1 1 -14 18 9  o 59.61226 3.031676 43.46671       4.389611 50.04792       8.005248 40.63706       5.249133 63.75960 5.197248 57.57132 3.762105 6.188278       6.415982 
1 1 1 -14 18 10 o 119.0557 2.725410 172.8906       7.907113 156.2434       12.99379 182.6805       9.964471 112.9592 4.730865 122.3012 3.346537 -9.342064      5.794860 
1 1 1 -14 18 11 o 95.70039 3.313949 111.9069       7.716846 100.3898       14.35904 116.5842       9.150617 90.24696 6.574242 97.63471 3.853575 -7.387749      7.620413 
1 1 1 -14 18 12 o 138.1636 4.405258 233.5088       14.81309 239.9419       22.12684 228.2840       19.94099 139.7328 6.516022 136.3751 6.015135 3.357681       8.867941 
1 1 1 -14 18 13 o 128.4930 3.474978 201.6955       10.87099 192.5442       19.94035 205.5657       12.96755 125.1206 6.562798 129.6541 4.109457 -4.533524      7.743252 
1 1 1 -14 18 14 o 390.6416 5.338548 1867.889       50.82036 2019.746       85.29652 1784.314       63.27813 404.7120 8.648665 381.2563 6.810838 23.45578       11.00849 
1 1 1 -14 18 15 o 220.0268 3.455614 591.0427       18.52836 604.4417       30.65006 583.3265       23.25944 222.0641 5.668550 218.4564 4.369165 3.607727       7.156960 
1 1 1 -14 18 16 o 94.28584 2.673162 108.5388       6.135773 97.42628       10.57544 114.1777       7.533357 89.10294 4.889202 96.66393 3.202491 -7.560982      5.844677 
1 1 1 -14 18 17 o 164.0651 3.331363 328.6319       13.31908 327.8159       19.81133 329.3049       17.99190 163.5852 4.975523 164.0358 4.505197 -0.4505463     6.712125 
1 1 1 -14 18 18 f 167.3917 3.822170 342.3488       15.59122 333.3076       28.53889 346.1952       18.61460 164.4553 7.138199 168.1730 4.546320 -3.717682      8.463032 
1 1 1 -14 18 19 o 77.09040 3.206575 72.68285       6.010749 75.65344       9.754778 70.86462       7.631715 78.42875 5.132139 76.02330 4.135017 2.405449       6.590692 
1 1 1 -14 18 20 o 164.5476 3.355299 330.6867       13.45423 326.3647       19.98278 334.2707       18.19670 163.1519 5.032078 165.2163 4.523897 -2.064377      6.766643 
1 1 1 -14 18 21 o 108.5227 3.069945 143.9152       8.110555 140.2547       12.59856 146.5060       10.59898 106.9001 4.848854 109.3884 3.982743 -2.488297      6.274840 
1 1 1 -14 18 22 o 103.9470 3.063877 132.0639       7.752560 136.0462       12.39701 129.5064       9.934870 105.2606 4.845981 102.8253 3.972315 2.435265       6.266005 
1 1 1 -14 18 23 o 53.20424 4.150437 34.85310       5.338615 35.73947       8.043736 34.15526       7.137183 53.52791 6.286203 52.42659 5.676961 1.101318       8.470198 
1 1 1 -14 18 24 o 112.9139 3.061787 155.8669       8.417003 171.3099       13.41074 145.8298       10.81167 118.1238 4.668046 109.0728 4.074784 9.051041       6.196331 
1 1 1 -14 18 25 o 124.9217 3.824922 191.1819       11.63013 197.0594       14.89273 181.9948       18.61945 126.6251 4.835231 121.3087 6.320322 5.316399       7.957759 
1 1 1 -14 18 26 o 154.8797 3.341318 293.4190       12.61097 282.5910       18.85048 302.1913       16.96704 151.5164 5.112686 156.8822 4.442566 -5.365738      6.773179 
1 1 1 -14 18 27 o 58.01357 3.552876 41.36422       4.998709 41.89696       8.481477 41.08068       6.187555 57.90880 6.101835 57.67485 4.436541 0.2339439      7.544221 
1 1 1 -14 18 28 o 121.9535 3.141718 182.1510       9.329015 171.3930       14.14659 190.4297       12.40981 117.8483 4.936909 124.4736 4.096791 -6.625237      6.415354 
1 1 1 -14 18 29 o 67.08704 3.591300 55.37163       5.849796 58.96545       11.27108 54.04664       6.843720 68.39426 6.854832 66.14544 4.268558 2.248817       8.075228 
1 1 1 -14 18 30 o 37.99531 4.573606 18.07148       4.149664 16.96022       6.907537 18.69900       5.190706 35.90107 8.089967 38.38099 5.724555 -2.479923      9.910504 
1 1 1 -14 18 31 o 102.8592 6.415837 133.4326       16.00164 0.000000       0.000000 133.4326       16.00164 ?        ?        102.8592 6.415837 0.000000       6.415837 
1 1 1 -14 18 32 o 94.32616 3.573481 109.8305       8.199241 124.6690       17.73636 105.7975       9.246585 98.44115 7.448806 92.37985 4.117758 6.061295       8.511207 
1 1 1 -14 18 33 o 17.79130 6.769233 3.034288       4.059328 1.719572       5.955626 4.175023       5.547584 18.88745 7.850070 20.63730 7.898460 -1.749847      11.13595 
1 1 1 -14 18 34 o 57.78173 3.609305 41.54645       5.056802 49.98000       8.634341 37.14355       6.238685 62.44857 5.737842 54.19712 4.772378 8.251453       7.463138 
1 1 1 -14 18 35 o 35.60502 4.816154 16.28263       4.071710 19.09091       6.878357 14.76771       5.051952 37.20826 7.834024 33.22343 6.472687 3.984825       10.16207 
1 1 1 -14 18 36 o 21.08747 6.684731 5.924353       3.853750 9.529716       6.326973 3.797809       4.859131 26.07573 8.590916 19.08882 7.369786 6.986910       11.31890 
1 1 1 -14 18 37 o 46.22632 4.222764 27.35773       4.704403 19.54770       7.356667 32.76102       6.119054 36.45710 8.446404 50.09644 5.082620 -13.63934      9.857727 
1 1 1 -14 18 38 o 22.91027 7.300179 7.533891       4.591049 10.81181       8.540142 6.201534       5.444729 26.45156 9.871614 21.47492 7.906490 4.976643       12.64758 
1 1 1 -14 18 39 o 40.13124 6.163773 22.52653       5.835446 20.18593       7.092305 27.43183       10.26731 36.16061 8.233619 39.66537 10.47039 -3.504753      13.31997 
1 1 1 -14 18 40 o 14.17805 6.162133 0.5656352      3.964981 -0.4988865E-02 6.058602 0.9931107      5.243883 16.28272 7.316853 16.07778 7.035341 0.2049446      10.15049 
1 1 1 -14 18 41 f 26.74095 6.884674 11.00931       4.513061 17.05202       6.963882 6.633723       5.925891 31.42193 8.764826 20.88640 8.118132 10.53553       11.94681 
1 1 1 -14 18 42 o 21.44372 7.033866 7.373180       4.243176 8.187263       6.504518 6.770108       5.598420 21.77651 8.493566 20.48662 7.910278 1.289890       11.60660 
1 1 1 -14 18 43 o 17.39751 6.899537 4.365778       4.354952 8.858391       8.382989 2.705147       5.096664 21.41720 9.128845 16.29281 7.033915 5.124386       11.52440 
1 1 1 -14 18 44 o 18.45206 6.793952 5.574189       4.020354 12.57538       6.601328 1.446341       5.068822 24.60624 8.753980 15.08348 6.741651 9.522764       11.04907 
1 1 1 -14 19 1  o 12.91766 5.128389 1.061610       2.408493 1.940957       3.681004 0.4033335      3.184858 16.32240 6.382756 13.68611 5.718471 2.636287       8.569743 
1 1 1 -14 19 2  o 171.6967 3.369945 359.8228       14.10006 352.9429       27.32096 362.3205       16.46174 169.4969 6.627291 172.2383 3.922023 -2.741409      7.700860 
1 1 1 -14 19 3  o 13.60299 5.595051 0.6873599      2.982736 -3.689332      5.692035 2.344124       3.502070 15.21630 6.938534 16.54181 6.288960 -1.325503      9.364522 
1 1 1 -14 19 4  o 124.8595 2.979772 190.2093       9.066518 181.4249       17.71475 193.3270       10.55350 121.5481 5.999217 125.8033 3.445701 -4.255119      6.918342 
1 1 1 -14 19 5  o 10.06068 4.727102 -3.164556      2.954689 1.554401       5.401073 -5.179945      3.529690 18.54228 7.566570 10.19987 4.897086 8.342414       9.013015 
1 1 1 -14 19 6  o 113.7105 2.981972 157.8649       8.255914 154.9231       16.48441 158.8499       9.538403 112.2913 6.046384 114.0272 3.436584 -1.735924      6.954773 
1 1 1 -14 19 7  o 20.89247 7.187759 4.872783       4.427549 0.000000       0.000000 4.872783       4.427549 ?        ?        20.89247 7.187759 0.000000       7.187759 
1 1 1 -14 19 8  o 90.78051 3.328214 100.7169       7.350286 113.1589       13.96791 95.95212       8.643894 95.92240 6.005648 88.54201 4.016580 7.380394       7.225006 
1 1 1 -14 19 9  o 27.85572 6.198648 9.882660       4.099288 18.09489       8.240052 7.181779       4.725548 37.55891 9.099718 24.14155 7.363145 13.41736       11.70559 
1 1 1 -14 19 10 o 72.61530 3.469583 64.51551       6.121859 62.47173       11.81939 65.26482       7.156631 71.01030 6.917868 72.98338 4.039672 -1.973076      8.010983 
1 1 1 -14 19 11 o 244.0079 4.199668 727.5071       24.97209 752.5093       36.60160 705.7336       34.15677 247.7881 6.061548 240.0137 5.839890 7.774399       8.417048 
1 1 1 -14 19 12 o 46.72132 3.564764 26.80659       4.028011 26.00714       7.377496 27.14612       4.807876 45.52885 6.862483 46.94147 4.248978 -1.412624      8.071400 
1 1 1 -14 19 13 f 290.5824 4.206095 1031.893       29.78410 987.2572       46.71015 1062.475       38.66372 283.5635 6.759659 294.5777 5.386017 -11.01413      8.643042 
1 1 1 -14 19 14 o 188.1401 3.198202 432.0580       14.66302 413.9708       23.71257 443.2558       18.65782 183.7997 5.299703 190.4644 4.019861 -6.664749      6.651776 
1 1 1 -14 19 15 o 344.1732 4.808283 1449.316       40.32767 1448.366       64.65238 1449.921       51.59533 342.9335 7.736392 343.7892 6.158601 -0.8556519     9.888383 
1 1 1 -14 19 16 o 83.79694 2.725869 85.76713       5.558928 97.75925       10.14740 80.62508       6.644687 89.26941 4.680972 81.19022 3.365716 8.079193       5.765375 
1 1 1 -14 19 17 o 248.6128 3.763856 755.1671       22.80303 743.3771       36.77500 762.5317       29.06520 246.1081 6.131838 249.6133 4.778256 -3.505219      7.773748 
1 1 1 -14 19 18 o 120.8090 3.026375 178.2734       8.902585 187.5301       20.38148 176.0909       9.896603 123.2956 6.809923 120.0290 3.386868 3.266571       7.605651 
1 1 1 -14 19 19 o 85.26304 2.733013 88.81112       5.671229 92.79000       10.50498 87.17447       6.737395 86.89482 4.981832 84.42383 3.281093 2.470993       5.965251 
1 1 1 -14 19 20 o 111.2408 3.118071 151.2299       8.444180 139.9709       13.00342 159.4398       11.10400 106.7586 5.012250 114.1140 3.999229 -7.355469      6.412214 
1 1 1 -14 19 21 o 144.1391 3.237424 253.7964       11.37149 254.5455       17.28327 253.2246       15.10031 144.0250 4.931661 143.7697 4.314934 0.2553253      6.552857 
1 1 1 -14 19 22 o 28.33764 6.574498 10.28665       4.452070 19.43766       7.239285 4.720467       5.645988 38.94653 7.898191 21.85589 8.050509 17.09064       11.27795 
1 1 1 -14 19 23 o 133.8418 3.192931 218.8956       10.41399 222.6714       16.05894 216.1555       13.68054 134.6420 4.902593 132.7909 4.233057 1.851089       6.477206 
1 1 1 -14 19 24 o 86.42585 3.994749 91.65758       8.390598 99.28683       10.99209 81.00557       12.98838 89.77473 5.044763 80.71523 6.662623 9.059502       8.357043 
1 1 1 -14 19 25 o 78.42765 3.202102 75.33839       6.106977 80.60351       10.14854 72.34951       7.646359 80.79387 5.181849 76.72356 4.104624 4.070305       6.610560 
1 1 1 -14 19 26 f 74.65208 3.270139 68.31819       5.934571 60.18456       9.577158 73.38802       7.561203 69.61437 5.695228 77.25873 4.030058 -7.644356      6.976890 
1 1 1 -14 19 27 o 50.64083 3.805450 31.62515       4.661808 31.25946       8.100752 31.80623       5.700307 49.68367 6.874776 50.63404 4.672431 -0.9503670     8.312289 
1 1 1 -14 19 28 o 82.16107 3.384265 82.88428       6.761388 91.02043       13.81017 80.31915       7.754330 85.18208 6.707026 80.76485 3.951903 4.417229       7.784712 
1 1 1 -14 19 29 o 73.44344 3.271094 66.29108       5.839707 66.32666       9.760978 66.27124       7.287845 72.88583 5.537018 73.25401 4.098899 -0.3681717     6.889088 
1 1 1 -14 19 30 o 55.35975 4.992380 38.32154       6.662714 36.14174       8.491997 41.81208       10.74600 53.20972 6.697133 56.77839 7.987015 -3.568672      10.42324 
1 1 1 -14 19 31 o 123.8764 3.671217 189.3557       11.07020 184.8619       22.05103 190.8699       12.80010 119.9695 7.581387 124.1123 4.238383 -4.142769      8.685696 
1 1 1 -14 19 32 o 94.44155 3.664373 110.3900       8.417324 112.0081       11.63229 108.6115       12.19546 94.46653 5.071613 92.83029 5.414541 1.636238       7.418794 
1 1 1 -14 19 33 o 36.27811 4.825511 16.77488       4.160331 18.10888       7.046967 16.06118       5.154466 36.41551 8.145355 34.97578 6.278262 1.439732       10.28413 
1 1 1 -14 19 34 o 27.82639 6.083633 10.31478       4.009999 6.109942       6.784409 12.57249       4.971318 23.19080 8.767891 30.50143 6.855601 -7.310627      11.12992 
1 1 1 -14 19 35 o 59.18641 3.712713 43.94788       5.327901 45.92359       8.602499 42.71841       6.786096 59.14033 6.054403 57.75969 4.866468 1.380634       7.767773 
1 1 1 -14 19 36 o 50.91132 3.949239 32.87542       4.861348 39.43256       8.173115 29.28559       6.047389 54.22683 6.302235 47.27368 5.342960 6.953152       8.262287 
1 1 1 -14 19 37 o 38.52101 4.528440 19.31915       4.169813 18.07305       6.991756 20.00703       5.194767 34.73251 8.361601 38.51939 5.706506 -3.786877      10.12327 
1 1 1 -14 19 38 o 40.28107 5.732958 22.20269       5.468823 19.90281       6.762383 26.55018       9.297490 36.42426 7.850189 40.37880 9.591807 -3.954540      12.39469 
1 1 1 -14 19 39 o 13.85020 6.036730 0.3371272      3.828012 2.310394       5.795609 -1.189939      5.098414 17.70739 7.570189 14.51808 6.599373 3.189312       10.04288 
1 1 1 -14 19 40 o 12.31893 5.622289 -1.277735      3.747875 -1.785877      5.632038 -0.8738673     5.021020 14.64184 6.759147 14.42391 6.553635 0.2179279      9.414680 
1 1 1 -14 19 41 o 27.70399 7.202327 12.23184       4.906861 18.37115       6.658502 4.935188       7.259022 32.90583 8.304585 19.65873 8.439656 13.24710       11.84035 
1 1 1 -14 19 42 f 31.33011 6.835589 15.57106       5.071747 9.209250       6.574097 24.92412       7.971182 22.29665 8.581702 36.79697 8.971684 -14.50032      12.41518 
1 1 1 -14 19 43 o 20.08457 7.089195 6.804581       4.321980 10.67960       8.606720 5.497929       4.997822 22.23342 9.352345 18.54323 7.379146 3.690191       11.91294 
1 1 1 -14 19 44 o 27.97543 6.541676 12.78646       4.379539 15.94696       7.083010 10.83028       5.572431 27.19950 9.093906 23.59386 8.065395 3.605640       12.15524 
1 1 1 -14 20 1  o 169.0542 3.255756 348.8499       13.41263 340.8947       18.81974 357.0615       19.12048 166.8986 4.631748 170.8187 4.597506 -3.920151      6.526113 
1 1 1 -14 20 2  o 209.9061 3.691591 538.0775       18.88316 558.6489       27.23014 519.0203       26.20879 213.6365 5.230443 205.8548 5.228795 7.781708       7.395798 
1 1 1 -14 20 3  o 45.82364 4.108907 25.86057       4.539648 27.65314       7.959100 24.99620       5.526811 46.91367 7.190804 44.90588 5.143199 2.007790       8.840824 
1 1 1 -14 20 4  o 263.9077 5.004177 852.0983       32.18258 808.2960       54.39361 875.6907       39.91951 255.8224 8.737984 267.2630 6.129290 -11.44066      10.67336 
1 1 1 -14 20 5  o 40.39576 4.560749 20.20145       4.411198 15.00227       7.520047 22.92893       5.446712 34.23945 8.923621 42.95834 5.316314 -8.718884      10.38721 
1 1 1 -14 20 6  o 63.56507 3.467057 49.47401       5.350178 46.10769       14.71957 49.98645       5.742972 60.16760 10.41615 63.87224 3.705588 -3.704639      11.05566 
1 1 1 -14 20 7  o 145.2549 2.908955 257.4370       10.29684 259.9529       17.21008 256.0342       12.85065 145.7029 4.853837 144.7558 3.645851 0.9471588      6.070581 
1 1 1 -14 20 8  o 14.32786 5.886215 0.7907774      3.296185 9.346847       6.072839 -2.782621      3.924599 27.46574 8.341026 12.48207 5.718083 14.98367       10.11282 
1 1 1 -14 20 9  o 64.94688 3.010116 51.58298       4.751107 51.98965       8.455807 51.39536       5.743447 64.94384 5.391521 64.77254 3.653506 0.1713028      6.512803 
1 1 1 -14 20 10 f 156.9450 2.966948 300.5732       11.34732 300.9280       18.85555 300.3718       14.20823 156.7530 4.942312 156.8256 3.717808 -0.7255554E-01 6.184541 
1 1 1 -14 20 11 o 159.2758 3.402416 309.7269       13.20606 297.6516       18.94130 321.1490       18.42192 155.8808 4.992768 161.9756 4.672004 -6.094742      6.837788 
1 1 1 -14 20 12 o 132.9846 2.835807 215.7890       9.189972 228.2935       15.79604 209.3908       11.29906 136.5253 4.755131 130.8980 3.545466 5.627274       5.931408 
1 1 1 -14 20 13 o 147.1714 2.908345 264.3154       10.43051 258.7270       17.39883 267.4505       13.03197 145.3170 4.920333 147.9797 3.613864 -2.662720      6.104890 
1 1 1 -14 20 14 o 144.5772 2.896807 255.0869       10.20600 256.2186       17.23257 254.4755       12.66640 144.6051 4.897307 144.3421 3.601007 0.2630310      6.078723 
1 1 1 -14 20 15 o 164.7080 3.032932 331.1369       12.17344 316.7627       19.85430 339.7961       15.40991 160.7580 5.074463 166.7643 3.791935 -6.006317      6.334742 
1 1 1 -14 20 16 o 151.5373 2.929514 280.2834       10.81810 297.1320       18.65492 271.7465       13.27891 155.7033 4.922725 149.1400 3.653694 6.563324       6.130473 
1 1 1 -14 20 17 o 208.5291 3.755367 531.4139       19.08337 545.0208       40.61459 527.5588       21.61838 209.9527 7.952622 207.6807 4.271604 2.271988       9.027225 
1 1 1 -14 20 18 o 107.8032 2.777409 141.9387       7.290305 139.9815       12.80266 142.8778       8.868604 106.7838 4.933260 108.0991 3.370764 -1.315277      5.974873 
1 1 1 -14 20 19 o 42.71890 3.842590 22.49121       3.957483 15.17554       7.781627 25.04345       4.596262 34.35143 9.137465 45.04457 4.236981 -10.69315      10.07201 
1 1 1 -14 20 20 o 74.10323 3.304923 67.22598       5.953064 58.60627       9.565006 72.67595       7.605654 68.83099 5.755130 76.96339 4.069703 -8.132408      7.048687 
1 1 1 -14 20 21 o 73.58220 3.358333 66.30692       6.006011 69.61931       10.02327 64.45139       7.501941 75.08614 5.516398 72.42906 4.269285 2.657074       6.975489 
1 1 1 -14 20 22 o 117.0046 4.953567 168.2785       14.09202 168.2785       14.09202 0.000000       0.000000 117.0046 4.953567 ?        ?        0.000000       4.953567 
1 1 1 -14 20 23 o 64.89285 4.568069 51.90260       7.177644 50.16015       9.299398 54.47033       11.28885 63.50654 6.083258 65.96067 7.136619 -2.454132      9.377492 
1 1 1 -14 20 24 o 106.5620 3.182776 138.9803       8.255773 147.3170       13.51118 134.0132       10.42915 109.3413 5.084680 104.4835 4.104033 4.857849       6.534298 
1 1 1 -14 20 25 o 58.75970 3.574721 42.43692       5.094460 48.96976       9.000609 39.35740       6.179625 62.68314 5.964085 56.42694 4.532152 6.256199       7.490709 
1 1 1 -14 20 26 o 77.17517 3.236161 73.04217       6.072660 66.70384       9.872606 76.89982       7.702048 73.27263 5.570846 79.05580 4.011049 -5.783173      6.864607 
1 1 1 -14 20 27 o 78.69473 3.220202 75.99297       6.162351 78.79758       10.16513 74.36334       7.748525 79.67294 5.265110 77.67273 4.108295 2.000206       6.678283 
1 1 1 -14 20 28 o 95.79431 3.460866 112.7866       8.065780 129.3283       16.01572 107.1654       9.336178 101.5060 6.508991 93.20449 4.120700 8.301468       7.703709 
1 1 1 -14 20 29 o 22.20487 6.615744 6.294452       3.847233 2.475641       7.098012 7.883044       4.578031 21.09911 8.649508 24.69451 7.179798 -3.595402      11.24115 
1 1 1 -14 20 30 o 15.37921 6.310201 1.148094       3.782035 -17.34068      10.55965 3.868805       4.050761 16.60549 8.090019 18.90872 6.841478 -2.303232      10.59501 
1 1 1 -14 20 31 o 14.13268 5.933525 0.5394688      3.454063 4.347604       6.898034 -0.7348708     3.990357 22.15728 8.715675 13.94075 6.117630 8.216535       10.64840 
1 1 1 -14 20 32 o 88.49638 3.665977 97.16708       7.888782 97.91216       10.97417 96.37038       11.34806 88.08293 5.134891 87.24841 5.363300 0.8345261      7.425099 
1 1 1 -14 20 33 o 43.36607 4.285538 23.74703       4.469741 28.28438       7.672071 21.41562       5.499462 46.09766 7.053601 40.61375 5.714431 5.483906       9.077886 
1 1 1 -14 20 34 o 62.95468 3.858730 49.74963       5.891381 50.10188       11.87705 49.63468       6.784920 60.13926 8.327482 62.56564 4.479777 -2.426376      9.455970 
1 1 1 -14 20 35 o 27.36032 6.212348 10.21156       4.047119 5.295855       6.898069 12.79182       4.997663 22.03222 8.700518 30.36679 6.909626 -8.334574      11.11044 
1 1 1 -14 20 36 o 30.73868 6.237194 13.02730       4.512196 14.66838       9.524033 12.55234       5.123718 30.15388 10.53298 29.64572 7.171203 0.5081558      12.74244 
1 1 1 -14 20 37 o 48.46337 4.750713 30.87346       5.538585 34.49515       10.83291 29.59168       6.444578 46.11701 9.933064 46.63671 5.795268 -0.5197029     11.50004 
1 1 1 -14 20 38 o 29.67862 7.065230 13.03977       5.035894 5.862844       6.380776 24.89385       8.200459 21.10562 8.357434 39.66638 8.721536 -18.56076      12.07940 
1 1 1 -14 20 39 o 12.66578 5.721753 -0.8970709     3.761454 -3.726742      6.181292 0.7669342      4.740112 14.41423 6.792663 15.29384 6.690670 -0.8796148     9.534430 
1 1 1 -14 20 40 o 12.85178 5.776357 -0.4872244     3.778265 0.6156921      6.043941 -1.194715      4.840712 16.27835 7.312004 13.85126 6.347250 2.427087       9.682612 
1 1 1 -14 20 41 o 15.94294 6.384476 3.071486       3.764948 5.110892       6.298576 1.937706       4.696289 19.11304 8.017736 15.64915 6.753991 3.463886       10.48334 
1 1 1 -14 20 42 o 21.42754 7.153009 7.752796       4.382483 5.684981       9.115716 8.374407       4.997975 19.70128 8.902983 21.83068 7.629915 -2.129402      11.72513 
1 1 1 -14 20 43 o 26.68222 7.371871 12.46024       4.952200 20.71935       6.876224 3.560190       7.138050 33.17157 8.476115 17.56825 7.914166 15.60332       11.59649 
1 1 1 -14 21 1  o 370.8808 5.103989 1684.080       46.12965 1709.133       73.25510 1667.617       59.38204 372.2900 8.074587 368.4642 6.613384 3.825867       10.43723 
1 1 1 -14 21 2  o 36.98093 3.642592 16.86427       3.240082 11.54708       4.629444 21.96968       4.536310 30.09872 6.501965 42.15041 4.485159 -12.05169      7.898873 
1 1 1 -14 21 3  o 161.9880 3.306616 320.3518       13.05277 317.4996       25.70345 321.3429       15.15187 160.6668 6.578832 162.1834 3.833750 -1.516586      7.614373 
1 1 1 -14 21 4  o 101.9168 3.030537 126.8800       7.518289 121.7418       14.72932 128.6904       8.743016 99.44272 6.107647 102.5989 3.502027 -3.156204      7.040422 
1 1 1 -14 21 5  o 192.7865 3.599062 453.9015       16.90838 459.6940       34.09835 452.0128       19.47081 193.1994 7.255440 192.3113 4.154735 0.8881683      8.360816 
1 1 1 -14 21 6  o 230.9689 4.079485 651.9289       22.96122 621.9280       47.83828 660.9092       26.17314 224.2287 8.771766 232.4570 4.620374 -8.228378      9.914218 
1 1 1 -14 21 7  o 135.7638 2.886308 224.9165       9.549109 217.7827       15.87018 228.9649       11.95550 133.3191 4.893178 136.8781 3.587336 -3.559052      6.067304 
1 1 1 -14 21 8  o 120.8590 2.850753 178.2377       8.396044 202.9152       14.84829 166.6387       10.17975 128.7021 4.742400 116.7564 3.582071 11.94566       5.943197 
1 1 1 -14 21 9  o 65.20492 3.144981 52.01779       4.982553 60.15076       9.040955 48.47013       5.971183 69.87823 5.349972 62.86287 3.917363 7.015362       6.630832 
1 1 1 -14 21 10 f 233.0437 4.118110 663.8059       23.38683 678.4966       34.04013 650.6723       32.18567 235.1364 5.945436 230.3891 5.732769 4.747284       8.259108 
1 1 1 -14 21 11 o 231.2657 3.626126 653.2813       20.43573 684.6788       33.98873 635.5047       25.57469 236.2780 5.903038 227.9256 4.604486 8.352463       7.486465 
1 1 1 -14 21 12 o 153.4453 3.352896 287.5072       12.53746 291.1604       18.86983 284.6199       16.77564 154.1289 5.030720 152.4727 4.519920 1.656204       6.762974 
1 1 1 -14 21 13 o 126.6702 2.826529 195.8111       8.724969 189.0143       14.52118 199.6512       10.91486 124.1761 4.807829 127.8042 3.507904 -3.628098      5.951522 
1 1 1 -14 21 14 o 62.11470 3.161942 47.22784       4.770383 49.40577       8.538194 46.23945       5.751868 63.23258 5.598811 61.38911 3.864477 1.843468       6.803004 
1 1 1 -14 21 15 o 48.80668 3.551255 29.25468       4.194843 35.45104       8.252752 27.09604       4.871028 53.32170 6.484396 46.86949 4.313089 6.452213       7.787819 
1 1 1 -14 21 16 o 14.22731 5.813409 0.8858059      3.193331 12.52661       6.958235 -2.220068      3.594177 31.34881 8.767445 12.17583 5.537133 19.17298       10.36957 
1 1 1 -14 21 17 o 112.6787 3.071133 155.1538       8.425028 152.4928       19.30787 155.7796       9.363472 110.9852 7.177420 112.8677 3.408230 -1.882561      7.945527 
1 1 1 -14 21 18 o 215.0436 3.472001 565.1351       18.19460 571.6577       30.15948 561.4029       22.81370 215.6504 5.744132 214.1461 4.371691 1.504303       7.218499 
1 1 1 -14 21 19 f 67.29766 3.078884 55.43442       5.035902 58.88293       9.694807 54.16010       5.893356 68.97401 5.822219 66.45602 3.653137 2.517982       6.873401 
1 1 1 -14 21 20 o 96.11680 2.805365 112.9049       6.563867 119.9462       12.21557 110.0465       7.782919 98.73701 5.094112 94.82734 3.373380 3.909676       6.109801 
1 1 1 -14 21 21 o 168.6371 4.136576 348.2786       16.99927 348.8467       21.64077 347.3633       27.46978 168.4251 5.279179 167.5820 6.740293 0.8431549      8.561617 
1 1 1 -14 21 22 o 162.5894 4.134719 324.1270       16.36899 342.1759       21.16719 297.2755       25.81788 166.7518 5.215439 154.8533 6.858718 11.89856       8.616427 
1 1 1 -14 21 23 o 48.00294 4.164113 28.46155       4.822955 32.78411       8.614976 26.48839       5.820573 50.93584 7.136070 46.10141 5.275939 4.834427       8.874628 
1 1 1 -14 21 24 o 102.2531 3.186633 128.0464       7.930750 129.8642       12.89775 126.9413       10.05662 102.5537 5.177664 101.6483 4.068122 0.9054337      6.584665 
1 1 1 -14 21 25 o 54.57131 3.724494 36.68517       4.923305 35.90239       8.668452 37.05791       5.981719 53.30432 6.830076 54.70819 4.527307 -1.403870      8.194293 
1 1 1 -14 21 26 o 97.31597 3.155763 116.1237       7.473948 129.2529       12.58918 108.9775       9.287856 102.1767 5.071879 94.07490 4.060970 8.101845       6.497340 
1 1 1 -14 21 27 o 49.36967 4.247069 30.24636       5.059973 21.86522       10.74428 32.63499       5.735876 40.21375 10.75508 51.20702 4.647127 -10.99327      11.71612 
1 1 1 -14 21 28 o 48.35716 3.922652 28.99460       4.582840 33.51875       8.270858 26.99019       5.505221 51.19280 6.797728 46.40480 4.944339 4.787998       8.405688 
1 1 1 -14 21 29 o 122.5143 3.650290 185.1265       10.88593 215.1724       23.58094 176.9892       12.27183 129.6261 7.497032 119.5460 4.219100 10.08016       8.602691 
1 1 1 -14 21 30 o 11.99942 5.393955 -1.435432      3.295767 0.6304365      6.560664 -2.132743      3.811620 18.88520 8.063520 12.52438 5.698188 6.360817       9.873688 
1 1 1 -14 21 31 o 23.88676 6.796011 7.546481       4.144025 9.137128       7.093740 6.722421       5.105845 26.62605 9.100039 23.07107 7.721159 3.554981       11.93428 
1 1 1 -14 21 32 o 11.78946 5.341312 -1.628547      3.306170 -2.325817      6.457187 -1.380804      3.848961 16.61861 7.503092 13.05985 5.853145 3.558761       9.516075 
1 1 1 -14 21 33 o 30.98157 5.805634 12.71259       4.222165 15.70291       7.387766 11.26215       5.145236 33.06367 8.951404 28.56545 7.349341 4.498222       11.58190 
1 1 1 -14 21 34 o 31.77547 5.520179 13.38400       4.119436 8.766990       6.741106 16.13573       5.204202 25.26413 8.858848 34.50741 6.425159 -9.243277      10.94357 
1 1 1 -14 21 35 o 12.04780 5.555259 -2.316183      3.788742 -1.315077      9.229271 -2.519084      4.154985 19.58457 8.893243 12.58021 5.806765 7.004354       10.62112 
1 1 1 -14 21 36 o 46.03447 4.217659 27.38700       4.678885 14.98932       7.164256 36.60778       6.178520 30.87151 8.983421 52.79943 4.856328 -21.92792      10.21204 
1 1 1 -14 21 37 o 45.45168 5.610640 28.18711       6.082609 30.24739       7.661018 24.67324       10.00497 45.71611 7.107546 37.45446 10.52682 8.261646       12.70162 
1 1 1 -14 21 38 o 11.82144 5.426951 -1.638141      3.560599 -0.6216496     5.793182 -2.255241      4.513806 15.65180 7.082847 12.98657 6.014712 2.665231       9.292120 
1 1 1 -14 21 39 o 19.08454 6.771461 5.277104       3.947507 0.6227899      6.462107 8.047857       4.985919 16.77273 7.545171 22.52017 7.630311 -5.747442      10.73085 
1 1 1 -14 21 40 o 10.93256 5.316952 -5.829084      4.506800 -6.121134      6.019521 -5.456557      6.798490 12.87842 6.235451 14.00031 6.740854 -1.121881      9.182590 
1 1 1 -14 21 41 o 14.82169 6.206736 2.144038       3.764510 2.183211       6.544610 2.124668       4.602049 16.99925 7.624474 15.54831 6.697987 1.450937       10.14868 
1 1 1 -14 21 42 o 13.03458 5.884778 -0.1758317E-01 3.971793 4.729966       8.229843 -1.459080      4.534858 18.73198 8.462675 12.80300 5.963375 5.928986       10.35271 
1 1 1 -14 22 1  o 99.91402 2.660511 121.8936       6.472037 117.8774       9.803768 124.9958       8.616439 98.10752 4.109770 101.1005 3.502635 -2.992966      5.399876 
1 1 1 -14 22 2  o 316.3774 4.490637 1224.465       34.62179 1285.268       56.12507 1187.115       43.98841 323.1637 7.126860 311.1013 5.802301 12.06238       9.190149 
1 1 1 -14 22 3  o 99.05155 3.031582 119.8705       7.308953 117.3723       14.04442 120.7984       8.559372 97.63630 5.930750 99.38557 3.539783 -1.749268      6.906797 
1 1 1 -14 22 4  o 118.4374 3.098279 171.3512       8.934540 169.3921       17.65641 172.0255       10.35864 117.3116 6.198253 118.6191 3.587662 -1.307533      7.161680 
1 1 1 -14 22 5  o 173.4667 3.981372 367.7624       16.83003 0.000000       0.000000 367.7624       16.83003 ?        ?        173.4667 3.981372 0.000000       3.981372 
1 1 1 -14 22 6  o 75.95116 3.207038 70.55157       5.922377 54.48298       11.06428 77.00421       7.011377 66.20543 6.961998 79.31346 3.637291 -13.10803      7.854890 
1 1 1 -14 22 7  o 250.5683 3.844485 767.1868       23.47472 791.9120       38.62055 752.6993       29.56263 253.9816 6.239935 247.9719 4.892205 6.009735       7.929089 
1 1 1 -14 22 8  o 100.6153 2.865468 123.6460       7.018645 116.6248       11.89323 127.3978       8.693946 97.46725 5.024274 102.0719 3.500401 -4.604637      6.123409 
1 1 1 -14 22 9  o 213.8531 3.900273 558.9055       20.32576 543.5152       29.26324 573.2516       28.25327 210.4525 5.711287 216.2930 5.360313 -5.840576      7.832736 
1 1 1 -14 22 10 o 282.8140 4.703776 978.9025       32.41781 996.6512       46.92640 962.6996       44.83639 284.6927 6.764019 279.8723 6.574075 4.820343       9.432413 
1 1 1 -14 22 11 o 26.77290 5.882305 9.136217       3.732728 7.716467       7.115736 9.675222       4.384404 26.25316 9.108428 27.51091 6.620393 -1.257755      11.26024 
1 1 1 -14 22 12 o 142.7894 2.956736 248.8852       10.28833 260.3058       17.62825 242.9855       12.67001 145.7003 4.972210 140.9666 3.691465 4.733734       6.192720 
1 1 1 -14 22 13 o 40.37584 4.264301 20.16090       4.132399 17.44180       7.770720 21.23308       4.879581 36.80527 8.786006 41.34643 4.940601 -4.541161      10.07985 
1 1 1 -14 22 14 o 67.20737 3.097724 55.27045       5.059715 52.36175       9.112879 56.56675       6.083590 65.05495 5.809363 67.93288 3.688723 -2.877937      6.881525 
1 1 1 -14 22 15 o 86.04700 2.889456 90.49295       6.050223 83.36280       10.52206 94.01482       7.394999 82.28057 5.275472 87.64867 3.469088 -5.368103      6.313887 
1 1 1 -14 22 16 o 169.4644 3.435669 350.9380       14.18816 345.2285       30.45003 352.5214       16.03523 167.0052 7.501215 169.7789 3.875746 -2.773727      8.443318 
1 1 1 -14 22 17 f 53.05515 3.447528 34.54659       4.433158 32.98058       8.401381 35.15088       5.218862 51.26944 6.899402 53.44838 4.036709 -2.178932      7.993545 
1 1 1 -14 22 18 o 211.4753 3.453932 546.6729       17.79957 565.9977       29.92660 536.0943       22.14173 214.5014 5.730338 209.2235 4.342751 5.277939       7.190011 
1 1 1 -14 22 19 o 90.71278 3.313069 100.7136       7.311474 119.4774       11.91777 89.38909       9.258548 98.54935 4.978682 85.29196 4.470100 13.25739       6.690969 
1 1 1 -14 22 20 o 109.7156 3.263359 147.2934       8.715380 163.0274       13.64591 136.4536       11.32644 115.1389 4.874479 105.4092 4.419197 9.729660       6.579502 
1 1 1 -14 22 21 f 92.94174 2.881812 105.6534       6.519097 112.4299       11.83809 102.7040       7.810004 95.49776 5.105446 91.54974 3.507212 3.948021       6.194038 
1 1 1 -14 22 22 o 105.4942 2.817460 136.1052       7.236580 144.2113       13.37897 132.7528       8.603790 108.1456 5.090948 104.0983 3.396188 4.047272       6.119792 
1 1 1 -14 22 23 o 98.44913 2.811405 118.5854       6.737928 110.1325       12.18883 122.3052       8.085673 94.36355 5.322130 99.90050 3.325970 -5.536949      6.275918 
1 1 1 -14 22 24 o 67.11704 3.497822 55.35608       5.701187 51.33111       9.490464 57.62872       7.131355 64.04861 6.156264 68.33821 4.304115 -4.289597      7.511657 
1 1 1 -14 22 25 o 77.64662 3.301627 74.02997       6.232959 71.01678       10.36689 75.73585       7.800261 75.47844 5.677864 78.37600 4.098279 -2.897560      7.002430 
1 1 1 -14 22 26 o 66.34349 4.598797 54.60448       7.388945 54.62560       9.682602 54.57505       11.43336 65.91615 6.096946 65.45948 7.291064 0.4566727      9.504334 
1 1 1 -14 22 27 o 29.42029 6.060141 11.20524       4.200069 11.00213       10.39340 11.24488       4.591691 30.42898 10.96553 29.36376 6.580235 1.065222       12.78836 
1 1 1 -14 22 28 o 48.45315 4.280999 29.27173       5.002845 53.38409       13.54217 25.46086       5.383689 63.51731 9.000848 44.97292 4.996632 18.54440       10.29474 
1 1 1 -14 22 29 o 74.58411 3.382538 68.70628       6.131875 63.55928       10.31102 71.52256       7.627147 70.69081 6.043440 75.84756 4.142247 -5.156754      7.326758 
1 1 1 -14 22 30 o 71.49818 3.436703 63.31030       5.970345 56.01979       10.07713 67.25349       7.411086 65.96745 6.346849 73.42399 4.158984 -7.456543      7.588125 
1 1 1 -14 22 31 o 60.99553 3.546498 46.29206       5.248758 48.51354       8.943542 45.12495       6.482540 61.25694 6.071042 59.85315 4.476926 1.403782       7.543237 
1 1 1 -14 22 32 o 21.48334 6.555896 6.119639       3.745530 13.16970       7.089252 3.389598       4.411523 30.39208 8.961870 18.34748 7.038067 12.04460       11.39515 
1 1 1 -14 22 33 o 31.85029 5.691344 13.49124       4.255244 21.39747       7.545254 9.803829       5.152875 38.77708 8.239173 26.43005 7.597166 12.34703       11.20718 
1 1 1 -14 22 34 o 16.74196 6.770050 2.307883       4.278037 -8.047500      8.525306 5.793036       4.945815 16.17404 7.723636 21.13191 7.570595 -4.957870      10.81520 
1 1 1 -14 22 35 f 31.81646 5.454630 13.67177       4.077016 17.70317       7.075108 11.66759       4.988549 34.10203 8.534768 28.37277 7.203290 5.729258       11.16824 
1 1 1 -14 22 36 o 25.81735 8.570391 10.40285       6.293166 18.64902       9.578074 4.138782       8.347960 32.43523 10.56344 21.10201 9.054771 11.33321       13.91313 
1 1 1 -14 22 37 o 12.84624 5.942796 -2.224413      4.387498 3.324140       9.350362 -3.791029      4.968436 20.81511 9.238895 12.86517 6.070986 7.949939       11.05505 
1 1 1 -14 22 38 o 17.62159 6.674827 4.051971       3.936220 5.216628       6.560774 3.396979       4.920103 20.09876 8.285626 17.59655 7.206062 2.502211       10.98084 
1 1 1 -14 22 39 o 33.61541 5.758625 16.30713       4.547691 24.43794       7.472783 11.52463       5.731163 38.37423 8.237469 25.96622 8.141504 12.40800       11.58188 
1 1 1 -14 22 40 f 35.11384 5.126044 17.50955       4.256996 15.63258       7.074210 18.57508       5.330072 28.45117 9.061403 34.72369 6.538838 -6.272522      11.17432 
1 1 1 -14 22 41 o 10.10820 4.927885 -5.223478      3.936377 -15.91620      8.425251 -2.237623      4.452183 12.50025 6.277709 12.32433 5.794443 0.1759224      8.543139 
1 1 1 -14 22 42 o 18.43100 6.645967 5.532290       3.818519 6.518193       6.658006 5.049046       4.661337 19.30801 8.178981 17.86539 7.120815 1.442623       10.84443 
1 1 1 -14 23 1  o 204.4605 3.325868 510.6067       16.57106 473.5499       24.81785 540.4194       22.26026 196.4909 5.187590 210.1631 4.346479 -13.67226      6.767789 
1 1 1 -14 23 2  o 155.6178 3.220739 295.7371       12.21380 285.0833       16.90374 307.3754       17.66741 152.5505 4.552177 158.4022 4.581758 -5.851669      6.458701 
1 1 1 -14 23 3  o 131.5308 3.184962 211.2562       10.20864 212.3728       19.76680 210.8501       11.92159 131.3380 6.193485 131.2987 3.729735 0.3923035E-01  7.229812 
1 1 1 -14 23 4  o 125.7779 3.141423 193.1661       9.628683 203.9953       19.46883 189.6596       11.07843 128.7127 6.225472 124.5317 3.654536 4.181007       7.218874 
1 1 1 -14 23 5  o 175.2795 4.034793 375.6409       17.23410 0.000000       0.000000 375.6409       17.23410 ?        ?        175.2795 4.034793 0.000000       4.034793 
1 1 1 -14 23 6  o 256.2233 4.326884 803.1077       27.01656 832.8043       55.23581 793.7693       30.97446 259.1861 8.757844 254.5615 4.993155 4.624603       10.08124 
1 1 1 -14 23 7  o 66.56313 3.955283 54.35484       6.386821 57.63000       11.85966 53.01698       7.579859 68.01677 7.267662 65.63320 4.771754 2.383568       8.694167 
1 1 1 -14 23 8  o 218.1335 3.553608 581.3416       18.88983 620.7990       31.80978 559.8475       23.47772 224.8312 5.810750 213.8869 4.504386 10.94424       7.352164 
1 1 1 -14 23 9  o 87.29732 3.487786 93.25006       7.404772 99.06808       11.11139 88.60202       9.931520 89.77289 5.100085 84.92435 4.818736 4.848534       7.016486 
1 1 1 -14 23 10 o 89.26679 2.916006 97.37984       6.334776 104.8664       11.11890 93.78188       7.708120 92.38812 4.956810 87.52948 3.621572 4.858643       6.138872 
1 1 1 -14 23 11 o 134.8617 3.288077 222.1543       10.80604 208.1292       15.86861 234.2818       14.75607 130.2289 5.009637 138.2929 4.384132 -8.064041      6.657107 
1 1 1 -14 23 12 o 108.6651 2.887968 144.2583       7.640708 145.9596       13.12422 143.3860       9.397504 109.0254 4.952740 108.2604 3.566977 0.7649994      6.103520 
1 1 1 -14 23 13 o 150.8185 3.005777 277.7599       11.04708 315.1707       19.49810 260.0736       13.40646 160.2679 4.998517 145.7970 3.776549 14.47087       6.264782 
1 1 1 -14 23 14 o 135.9004 2.950264 225.5299       9.770518 246.9932       17.16655 215.2455       11.88300 141.8474 4.973914 132.6340 3.680060 9.213364       6.187298 
1 1 1 -14 23 15 o 145.7438 2.995687 259.4208       10.63954 255.9487       17.91179 261.3138       13.22556 144.3565 5.099755 146.1356 3.716846 -1.779083      6.310503 
1 1 1 -14 23 16 o 121.2547 3.195490 179.7657       9.433947 171.4698       21.14215 181.8282       10.54160 117.5285 7.419803 121.8992 3.552491 -4.370758      8.226400 
1 1 1 -14 23 17 o 119.2447 3.291754 173.9245       9.556237 164.6348       14.15981 181.6949       12.95018 115.7133 5.033595 121.7037 4.373634 -5.990402      6.668264 
1 1 1 -14 23 18 o 124.1070 3.322408 188.4506       10.03910 200.1621       15.50117 179.9896       13.17551 127.5799 4.995586 121.0825 4.472982 6.497360       6.705480 
1 1 1 -14 23 19 o 56.02020 3.380525 38.52293       4.593452 47.29796       9.020997 35.45133       5.337184 61.63349 6.085555 53.63284 4.115053 8.000652       7.346267 
1 1 1 -14 23 20 o 50.92427 3.889210 31.95366       4.789875 35.32684       8.518897 30.39426       5.792167 53.00290 6.748309 49.50000 4.864522 3.502895       8.318849 
1 1 1 -14 23 21 o 85.80916 2.862829 90.11036       5.978012 104.9089       11.45979 84.57790       7.006915 92.16950 5.122300 83.04392 3.470092 9.125580       6.187043 
1 1 1 -14 23 22 o 100.3021 2.839247 123.1206       6.932859 131.4877       12.81372 119.6575       8.243682 103.1591 5.113135 98.78072 3.429828 4.378349       6.156937 
1 1 1 -14 23 23 o 140.5522 2.935355 241.7471       10.05390 256.7839       17.90145 234.8188       12.15131 144.1422 5.104428 138.3250 3.607922 5.817200       6.250782 
1 1 1 -14 23 24 o 98.05566 2.820406 117.7842       6.732384 127.0410       12.48937 113.9927       7.993101 101.2404 5.078548 96.34360 3.409900 4.896843       6.117113 
1 1 1 -14 23 25 o 26.37044 7.917305 8.950977       5.493860 -1.349538      6.970911 25.83728       8.925392 18.34079 8.065901 44.32050 8.573986 -25.97971      11.77166 
1 1 1 -14 23 26 o 51.00300 4.741606 32.49900       5.825788 0.000000       0.000000 32.49900       5.825788 ?        ?        51.00300 4.741606 0.000000       4.741606 
1 1 1 -14 23 27 o 26.40596 6.415222 9.140168       4.086783 3.709303       10.19237 10.18057       4.461098 24.87761 10.29833 27.83259 6.665442 -2.954971      12.26718 
1 1 1 -14 23 28 o 31.04929 5.544435 12.45069       4.041183 9.258776       7.401708 13.80627       4.823575 27.06019 9.294059 32.49657 6.318700 -5.436375      11.23857 
1 1 1 -14 23 29 o 88.12024 3.242664 95.94627       6.951402 108.5415       11.93622 89.48193       8.551179 92.67550 5.307446 84.71828 4.154697 7.957222       6.740215 
1 1 1 -14 23 30 o 16.38856 6.567670 1.979731       3.987085 -5.733974      7.087346 5.551260       4.822577 15.77970 7.384391 21.35262 7.492493 -5.572920      10.51982 
1 1 1 -14 23 31 o 36.41490 4.710815 17.00575       4.082479 14.47690       7.203248 18.20244       4.955149 31.82407 8.927734 37.31846 5.623224 -5.494390      10.55107 
1 1 1 -14 23 32 o 23.39614 6.392802 7.459714       3.747647 4.325147       6.828397 8.810901       4.483194 21.29211 8.573357 25.23831 7.029774 -3.946201      11.08694 
1 1 1 -14 23 33 o 21.80596 6.905294 6.512557       4.113195 1.427345       8.534984 8.050859       4.694281 20.48095 8.968470 23.94111 7.345802 -3.460161      11.59285 
1 1 1 -14 23 34 o 31.04877 5.747764 13.14154       4.188772 9.788482       6.745055 15.24645       5.344186 25.59797 8.868711 32.77929 6.908501 -7.181318      11.24195 
1 1 1 -14 23 35 o 28.50688 8.069136 12.46242       5.857127 11.70007       9.224727 12.97735       7.581419 26.76565 10.19950 28.19921 9.408027 -1.433559      13.87591 
1 1 1 -14 23 36 o 17.53159 6.730797 3.700086       4.037068 1.428805       6.463980 5.152587       5.169194 17.74030 7.785574 19.80800 7.613351 -2.067694      10.88937 
1 1 1 -14 23 37 o 18.05155 6.687278 4.364081       3.905443 9.868133       6.702018 1.534089       4.805704 24.38605 8.803174 15.94668 6.856801 8.439375       11.15848 
1 1 1 -14 23 38 o 43.99008 4.523929 26.11823       4.780557 25.75937       7.692829 26.34399       6.101778 39.60556 8.239322 42.65681 6.038542 -3.051250      10.21521 
1 1 1 -14 23 39 o 19.68866 7.966964 5.958665       5.928905 2.140552       10.13834 7.943081       7.309014 19.10665 8.905172 21.42780 8.779885 -2.321148      12.50554 
1 1 1 -14 23 40 o 24.56538 6.933626 9.942104       4.330976 6.535574       8.810902 11.02742       4.973269 20.16104 8.957379 25.26543 7.520464 -5.104397      11.69581 
1 1 1 -14 23 41 o 15.62801 6.277845 3.206527       3.652078 0.4072566      6.209196 4.687138       4.515788 15.42617 7.112558 17.55600 7.005023 -2.129832      9.982927 
1 1 1 -14 24 1  o 93.30255 2.698958 106.3498       6.130122 107.5505       9.200459 105.3913       8.220653 93.67626 4.039856 92.78039 3.642998 0.8958740      5.439842 
1 1 1 -14 24 2  o 79.23222 3.214580 76.80842       6.193832 76.89706       7.996008 76.67543       9.793666 79.16798 4.159237 78.91357 5.120457 0.2544174      6.596843 
1 1 1 -14 24 3  f 38.89682 3.808483 18.67400       3.563746 13.70442       5.031355 23.67748       5.048484 32.80664 6.523167 43.70009 4.820716 -10.89345      8.111166 
1 1 1 -14 24 4  o 29.95834 6.803467 11.48943       4.853211 0.000000       0.000000 11.48943       4.853211 ?        ?        29.95834 6.803467 0.000000       6.803467 
1 1 1 -14 24 5  o 39.87426 4.753859 19.74801       4.528420 10.24204       8.584109 23.41356       5.330482 29.60360 10.01203 43.40294 5.139385 -13.79934      11.25407 
1 1 1 -14 24 6  o 195.0616 3.691647 465.1110       17.54802 484.7074       35.87129 458.9460       20.11983 198.0138 7.447149 193.6601 4.263322 4.353745       8.581139 
1 1 1 -14 24 7  o 65.45251 3.491075 52.49836       5.548142 54.05431       11.45695 52.02170       6.341283 65.80740 7.265067 65.09344 4.017213 0.7139587      8.301759 
1 1 1 -14 24 8  o 149.9803 3.485594 274.8853       12.73934 256.0002       18.06309 293.5754       17.96958 144.3980 5.141483 154.7246 4.771577 -10.32655      7.014471 
1 1 1 -14 24 9  o 54.75897 3.614656 36.81129       4.796478 42.77460       8.630846 34.14658       5.769447 58.66945 6.126988 52.61169 4.544544 6.057758       7.628425 
1 1 1 -14 24 10 o 75.22253 3.144259 69.23654       5.751004 66.60956       10.03778 70.52024       7.016841 73.43024 5.653013 75.84390 3.808702 -2.413658      6.816360 
1 1 1 -14 24 11 o 135.6097 2.976363 224.5817       9.835872 225.6995       16.80835 223.9996       12.12950 135.5560 5.097351 135.3029 3.682166 0.2530975      6.288190 
1 1 1 -14 24 12 o 144.0459 3.000288 253.4159       10.53174 273.9444       18.31091 243.2677       12.87436 149.3633 5.037929 140.9894 3.750496 8.373871       6.280680 
1 1 1 -14 24 13 o 114.2749 2.933760 159.5876       8.163048 146.1565       13.68093 167.0129       10.17222 109.0120 5.164664 116.8214 3.577418 -7.809395      6.282648 
1 1 1 -14 24 14 o 117.2020 3.323227 168.0214       9.481834 173.9024       14.45714 163.5821       12.56065 118.9486 4.998689 115.4597 4.472678 3.488899       6.707588 
1 1 1 -14 24 15 o 198.7492 5.472745 485.9214       26.48092 458.0893       38.16582 511.7583       36.77240 191.8431 8.182592 203.1553 7.440323 -11.31221      11.05953 
1 1 1 -14 24 16 o 47.52343 4.476706 27.93287       5.123373 33.34023       8.358596 24.67871       6.484261 51.50313 6.827883 44.32994 6.169367 7.173183       9.202232 
1 1 1 -14 24 17 o 37.85228 4.494009 17.81808       4.064550 22.87857       7.814253 15.94115       4.758995 42.24989 7.879501 35.54965 5.684873 6.700233       9.716188 
1 1 1 -14 24 18 f 101.1060 2.881056 125.0288       7.091234 136.6975       12.86087 119.9316       8.500092 105.3238 5.025305 98.92702 3.531587 6.396729       6.142133 
1 1 1 -14 24 19 o 125.2831 3.264331 192.1733       9.957557 210.4840       15.99945 180.5967       12.72167 130.6920 5.033062 121.2287 4.313155 9.463303       6.628350 
1 1 1 -14 24 20 o 80.66075 2.944808 79.67503       5.778642 75.89329       10.43330 81.34852       6.940426 78.22612 5.508320 81.41961 3.506228 -3.193489      6.529565 
1 1 1 -14 24 21 o 35.70406 4.501577 15.92337       3.829802 19.40863       7.646788 14.75641       4.424749 38.57048 8.376002 34.14106 5.505562 4.429420       10.02340 
1 1 1 -14 24 22 f 49.62209 3.623388 30.37084       4.351333 18.49885       8.482962 34.60995       5.069010 37.39039 9.338411 52.93026 3.958586 -15.53987      10.14280 
1 1 1 -14 24 23 o 93.60618 2.908026 107.4165       6.625396 114.8260       12.29133 104.3819       7.865964 96.12676 5.267219 92.14476 3.509456 3.982002       6.329287 
1 1 1 -14 24 24 o 80.59559 4.312829 80.39021       8.439664 75.78290       10.98421 87.02997       13.18624 77.74351 5.840573 83.04013 6.569728 -5.296623      8.790542 
1 1 1 -14 24 25 o 60.29152 4.455283 45.21835       6.499629 0.000000       0.000000 45.21835       6.499629 ?        ?        60.29152 4.455283 0.000000       4.455283 
1 1 1 -14 24 26 o 67.85287 3.748835 56.98613       6.174610 101.1091       15.36870 48.49311       6.742734 88.78098 7.164445 62.36786 4.466047 26.41313       8.442444 
1 1 1 -14 24 27 o 74.72811 3.349565 68.98849       6.084197 64.46470       10.05195 71.60404       7.643307 71.23973 5.841436 75.85841 4.150489 -4.618683      7.165817 
1 1 1 -14 24 28 o 38.30178 4.531615 18.56311       4.147855 9.134374       7.059011 23.53533       5.126165 26.57737 9.077876 43.03346 4.980019 -16.45610      10.35415 
1 1 1 -14 24 29 o 23.50898 6.851740 7.369977       4.164711 8.764531       7.668923 6.786669       4.959810 26.24135 9.423965 22.93074 7.608373 3.310608       12.11191 
1 1 1 -14 24 30 o 71.34991 3.392129 63.37890       5.881071 69.55056       10.09720 60.21028       7.234950 73.36905 5.691936 69.08417 4.319159 4.284882       7.145157 
1 1 1 -14 24 31 o 16.89634 6.383967 3.007412       3.595345 5.429022       7.317852 2.236868       4.127912 22.55996 8.944755 16.64094 6.677904 5.919018       11.16257 
1 1 1 -14 24 32 o 38.83153 4.519975 19.47786       4.197314 10.68396       7.420047 23.61588       5.089934 26.99086 9.304205 42.54191 5.005421 -15.55105      10.56515 
1 1 1 -14 24 33 o 36.35669 4.855581 17.40151       4.194455 21.13097       7.254244 15.52847       5.140956 37.83138 8.112197 33.33209 6.562841 4.499294       10.43449 
1 1 1 -14 24 34 o 30.82083 7.314129 13.98333       5.410412 9.203611       6.678301 23.11188       9.229233 24.62349 8.799994 37.22641 9.973293 -12.60292      13.30062 
1 1 1 -14 24 35 o 19.62297 8.050860 4.276786       6.155787 0.6207878      9.290051 7.138499       8.219173 19.61952 8.914370 22.79400 9.321720 -3.174484      12.89808 
1 1 1 -14 24 36 o 15.17385 6.291726 1.868837       3.813055 7.085121       6.610094 -0.7325803     4.668013 21.86437 8.552241 14.13309 6.380325 7.731283       10.67002 
1 1 1 -14 24 37 o 20.75736 6.774586 6.548893       3.938373 9.005385       6.616235 5.200804       4.901315 23.09821 8.674695 19.18161 7.402746 3.916595       11.40399 
1 1 1 -14 24 38 o 29.19771 7.290403 13.77866       5.171122 6.613012       6.703892 24.30590       8.125615 20.48754 8.403170 36.57751 9.142007 -16.08997      12.41731 
1 1 1 -14 24 39 o 20.40361 6.688127 6.681391       3.836571 7.817285       6.501729 6.074581       4.752106 21.00328 8.397054 19.41838 7.338873 1.584900       11.15211 
1 1 1 -14 24 40 o 11.31304 5.408685 -3.437387      4.206857 0.000000       0.000000 -3.437387      4.206857 ?        ?        11.31304 5.408685 0.000000       5.408685 
1 1 1 -14 25 1  o 39.86243 3.791970 19.61198       3.639221 15.02357       4.997970 24.79005       5.309410 34.42398 6.185282 44.68536 4.959197 -10.26138      7.927884 
1 1 1 -14 25 2  o 151.7726 2.948396 281.3356       10.90474 282.7602       16.87626 280.3145       14.28812 151.8372 4.566207 151.3169 3.878017 0.5203705      5.990765 
1 1 1 -14 25 3  o 52.38189 3.693195 33.72040       4.684106 26.62091       7.427479 38.40848       6.035666 45.97177 6.837882 55.81792 4.474720 -9.846149      8.171887 
1 1 1 -14 25 4  o 169.9153 3.475465 352.9200       14.39068 296.3676       26.32372 377.0254       17.18617 154.7945 6.996481 175.5269 4.017903 -20.73232      8.068103 
1 1 1 -14 25 5  o 102.7804 3.137439 129.1723       7.848976 131.0827       15.59851 128.5246       9.082600 103.0030 6.243691 102.4589 3.643480 0.5441513      7.229013 
1 1 1 -14 25 6  o 23.96377 6.858682 7.253588       4.208470 9.275817       7.938105 6.462984       4.963421 28.26541 9.627143 23.27438 7.605864 4.991028       12.26911 
1 1 1 -14 25 7  f 50.91006 4.050170 31.91694       4.983342 37.46853       10.13624 30.14737       5.722712 54.47205 7.863381 49.35786 4.819154 5.114185       9.222635 
1 1 1 -14 25 8  o 49.32917 6.330770 30.44390       7.434986 29.56446       10.01698 31.52275       11.09474 48.02771 8.885921 49.47197 9.548709 -1.444260      13.04367 
1 1 1 -14 25 9  o 116.6722 3.309761 166.4903       9.400718 171.5987       14.30475 162.6069       12.47212 118.1700 4.978644 115.1251 4.454044 3.044907       6.680225 
1 1 1 -14 25 10 o 30.29514 6.343564 11.72261       4.532808 7.240776       7.020782 14.92613       5.935693 25.63214 9.036457 34.10692 7.357921 -8.474779      11.65318 
1 1 1 -14 25 11 o 124.5138 3.370704 189.6577       10.21821 196.4149       15.59471 184.5740       13.52644 126.3994 5.073170 122.6348 4.534007 3.764557       6.803989 
1 1 1 -14 25 12 o 99.17082 3.399269 120.3871       8.202816 136.5527       12.90363 109.4240       10.62627 105.3453 5.041070 94.35104 4.635852 10.99429       6.848614 
1 1 1 -14 25 13 o 152.1111 3.484110 282.9982       12.91484 284.5381       19.24541 281.7365       17.41947 152.0830 5.200554 151.4579 4.725399 0.6251068      7.026745 
1 1 1 -14 25 14 o 77.72363 3.468590 74.04344       6.553098 71.26239       16.26132 74.58264       7.160246 74.96026 9.087366 77.96362 3.780036 -3.003365      9.842199 
1 1 1 -14 25 15 o 103.0504 2.955469 129.8898       7.414183 120.1760       12.72998 134.8764       9.120784 98.69136 5.312714 104.9195 3.572515 -6.228096      6.402170 
1 1 1 -14 25 16 f 162.8195 3.132010 324.1827       12.42698 357.6857       21.79902 308.0531       15.12543 170.3897 5.256263 158.5565 3.914602 11.83325       6.553809 
1 1 1 -14 25 17 f 147.5701 3.413582 266.5659       12.27566 261.3397       18.44430 270.7218       16.44758 145.5829 5.207338 148.3822 4.554057 -2.799301      6.917789 
1 1 1 -14 25 18 o 62.17704 3.297005 47.45623       4.977721 35.64451       8.809869 52.99539       6.033018 53.10926 6.975585 65.64064 3.787686 -12.53138      7.937591 
1 1 1 -14 25 19 o 163.7589 3.497023 328.6371       13.95531 333.3200       21.07074 324.9778       18.62616 164.2418 5.271363 162.3990 4.711543 1.842728       7.070071 
1 1 1 -14 25 20 o 44.41802 3.948336 24.42060       4.229264 26.49856       8.363268 23.70662       4.902288 45.32202 7.856963 43.61893 4.685346 1.703094       9.147914 
1 1 1 -14 25 21 f 66.96560 3.169684 55.08207       5.157859 51.21632       9.884037 56.52870       6.046408 63.76077 6.449887 67.74828 3.676149 -3.987511      7.423955 
1 1 1 -14 25 22 o 59.13387 3.786717 43.18000       5.428088 44.99421       9.159564 42.19799       6.738895 59.65448 6.400780 58.22277 4.792010 1.431709       7.995833 
1 1 1 -14 25 23 o 33.72578 5.788051 14.57237       4.585728 38.08540       11.39728 10.03064       5.009071 53.70794 9.028122 27.65313 7.319755 26.05481       11.62264 
1 1 1 -14 25 24 o 39.29126 4.317410 19.32291       4.065828 28.42780       10.95321 17.86787       4.378671 45.61489 10.11860 37.62176 4.891752 7.993130       11.23901 
1 1 1 -14 25 25 o 35.48700 5.699936 16.18236       4.762326 -13.95248      10.98707 23.15378       5.284554 17.96445 8.628860 42.75475 5.177452 -24.79029      10.06296 
1 1 1 -14 25 26 o 103.1156 2.861994 130.8291       7.184704 129.0940       13.07201 131.5801       8.600200 101.2311 5.317629 103.1951 3.424645 -1.963997      6.324980 
1 1 1 -14 25 27 o 59.71172 3.134778 44.10895       4.545468 50.56570       9.264338 42.06182       5.216513 62.65942 6.146238 58.13263 3.701570 4.526787       7.174808 
1 1 1 -14 25 28 o 53.39655 3.850738 35.67654       4.976986 37.49255       8.798941 34.82218       6.035228 53.24548 6.946765 52.38195 4.780617 0.8635292      8.432784 
1 1 1 -14 25 29 o 89.52056 3.757051 100.2142       8.177855 110.9714       12.01024 90.91578       11.16629 93.03241 5.319804 84.05248 5.481480 8.979927       7.638517 
1 1 1 -14 25 30 o 44.42793 4.300198 25.15584       4.597517 19.51869       8.198431 27.74180       5.552793 36.34697 9.237998 46.32981 4.997259 -9.982841      10.50301 
1 1 1 -14 25 31 o 53.40715 3.829026 36.13446       4.950310 32.78273       8.176998 38.07357       6.219564 48.69714 7.099334 54.28175 4.749667 -5.584614      8.541656 
1 1 1 -14 25 32 o 27.19565 6.103122 10.26526       3.945120 10.37695       7.050729 10.21436       4.759995 26.22048 9.068292 26.60452 7.177698 -0.3840332     11.56518 
1 1 1 -14 25 33 o 48.58083 5.287950 31.59485       6.159294 29.94606       7.770201 34.38239       10.10323 45.60853 7.232219 46.83814 9.180021 -1.229614      11.68665 
1 1 1 -14 25 34 o 21.84742 8.321493 6.756935       6.138630 12.32704       9.365914 2.562142       8.127810 26.82796 10.26404 19.83260 8.716177 6.995359       13.46559 
1 1 1 -14 25 35 o 37.75095 5.072404 19.39710       4.548381 13.73574       7.090216 23.35611       5.929148 28.36632 9.075706 40.48414 6.207663 -12.11782      10.99561 
1 1 1 -14 25 36 o 23.25025 6.676410 8.244075       3.981448 5.301693       6.412194 10.09025       5.079186 19.91261 8.198274 25.00879 7.634872 -5.096176      11.20281 
1 1 1 -14 25 37 o 25.83842 6.732346 10.42983       4.281013 16.91611       7.130464 6.774004       5.353192 30.37188 8.996158 20.58722 7.787268 9.784662       11.89842 
1 1 1 -14 25 38 o 23.16982 7.387899 9.077933       4.701405 10.00641       6.551033 8.091889       6.751058 23.07167 8.638687 21.31487 8.544677 1.756802       12.15065 
1 1 1 -14 25 39 o 10.80570 5.158916 -3.257101      3.798994 2.701404       8.463893 -4.760380      4.251295 17.99612 8.299865 10.79234 5.228936 7.203779       9.809665 
1 1 1 -14 26 1  o 109.1261 2.785727 145.5557       7.401981 143.0695       11.08283 147.5576       9.945284 107.9697 4.220364 109.7394 3.724331 -1.769699      5.628687 
1 1 1 -14 26 2  o 138.5638 3.180647 234.6875       10.73993 249.7341       15.44318 220.5939       14.94611 142.6520 4.447888 134.0329 4.582685 8.619080       6.386291 
1 1 1 -14 26 3  o 83.52605 4.594500 85.81662       9.315802 0.000000       0.000000 85.81662       9.315802 ?        ?        83.52605 4.594500 0.000000       4.594500 
1 1 1 -14 26 4  o 154.0566 3.840112 290.4922       14.41652 301.6018       25.30450 285.1532       17.54180 156.1298 6.666172 152.3847 4.729583 3.745132       8.173542 
1 1 1 -14 26 5  o 139.2164 4.717155 238.0306       15.98008 255.2816       22.68195 221.0289       22.51743 143.6768 6.495045 133.5277 6.943942 10.14908       9.508099 
1 1 1 -14 26 6  o 116.4016 3.670400 165.9400       10.39837 176.4986       18.29660 160.9026       12.63770 119.4647 6.307194 114.4638 4.539686 5.000908       7.771065 
1 1 1 -14 26 7  o 58.70740 4.948477 42.60755       7.013614 31.29014       10.88863 50.63265       9.169059 49.23498 9.418407 63.84208 5.962577 -14.60710      11.14714 
1 1 1 -14 26 8  o 148.3617 3.371782 269.1602       12.19038 280.7180       24.76076 265.4626       14.00533 150.5531 6.766272 147.1974 3.907880 3.355621       7.813703 
1 1 1 -14 26 9  o 92.99178 3.250849 105.8523       7.355445 120.6486       15.15070 101.2893       8.413486 98.67526 6.334144 90.88443 3.807267 7.790833       7.390308 
1 1 1 -14 26 10 o 73.69735 3.247939 66.53633       5.818725 66.01884       10.25469 66.78207       7.066466 72.97777 5.814322 73.73914 3.946874 -0.7613754     7.027386 
1 1 1 -14 26 11 f 64.07146 3.403646 50.35664       5.295222 56.83185       9.872422 47.74144       6.274064 67.61344 6.055822 62.27602 4.158026 5.337421       7.345894 
1 1 1 -14 26 12 o 119.9657 2.961736 175.9001       8.658437 180.1844       15.20037 173.8423       10.53456 120.9283 5.170032 119.1143 3.633493 1.814003       6.319138 
1 1 1 -14 26 13 o 126.2713 2.999874 194.9212       9.230895 200.1965       16.10683 192.3410       11.26430 127.4435 5.197185 125.2720 3.693930 2.171509       6.376194 
1 1 1 -14 26 14 o 282.0747 4.715020 977.8708       32.41036 933.4237       65.96471 992.0151       37.21162 271.3889 9.991381 283.7386 5.381756 -12.34970      11.34861 
1 1 1 -14 26 15 o 129.1950 2.992168 204.1308       9.420366 196.8810       15.97142 207.9985       11.66565 126.3053 5.200148 130.2388 3.679323 -3.933502      6.370162 
1 1 1 -14 26 16 o 67.52482 3.324111 55.96238       5.453033 69.43149       10.04421 50.33332       6.493288 74.77935 5.551455 63.88868 4.193848 10.89067       6.957515 
1 1 1 -14 26 17 o 97.11108 3.355102 115.6646       7.927893 116.6123       12.36686 115.0035       10.32962 97.05136 5.248567 96.60553 4.399340 0.4458313      6.848477 
1 1 1 -14 26 18 o 36.44963 5.177385 16.72771       4.469538 27.38041       8.014485 11.91909       5.384633 46.23043 7.360518 30.26242 7.370922 15.96800       10.41670 
1 1 1 -14 26 19 o 51.12141 3.576556 32.23268       4.427469 25.29891       8.111135 35.17541       5.284117 44.19889 7.816574 53.31754 4.098351 -9.118649      8.825831 
1 1 1 -14 26 20 o 93.83325 3.325410 108.1787       7.591908 117.5965       12.30747 102.3941       9.645687 97.25971 5.211812 91.01350 4.361714 6.246216       6.796141 
1 1 1 -14 26 21 o 17.30266 7.583784 -1.026934      6.115603 9.377992       9.624453 -8.072998      7.920085 28.74620 10.52384 16.29214 7.681088 12.45406       13.02883 
1 1 1 -14 26 22 o 108.7498 3.182699 145.3876       8.425443 143.1372       19.08420 145.9324       9.390115 105.8383 7.446907 108.8378 3.545153 -2.999443      8.247699 
1 1 1 -14 26 23 o 67.83118 3.095942 56.66433       5.104012 63.88718       10.06824 54.16611       5.921264 71.08961 5.863907 66.16821 3.686800 4.921402       6.926609 
1 1 1 -14 26 24 o 22.20089 7.009372 6.287138       4.240980 9.965890       11.51637 5.709981       4.561546 29.69468 11.37636 21.60116 7.298476 8.093521       13.51626 
1 1 1 -14 26 25 o 90.79688 2.908945 101.5532       6.428087 109.9999       11.98717 98.14388       7.615666 93.35057 5.291093 89.03490 3.516954 4.315674       6.353317 
1 1 1 -14 26 26 o 47.49640 3.674745 28.14587       4.220222 32.08086       8.545766 26.87670       4.853318 49.12128 7.365963 46.18572 4.363905 2.935562       8.561604 
1 1 1 -14 26 27 o 24.63177 5.741348 8.055820       3.382301 5.795540       6.959775 8.754699       3.870039 23.02418 8.838043 25.55780 6.263443 -2.533621      10.83244 
1 1 1 -14 26 28 o 85.55349 3.226074 90.98429       6.713816 95.97606       11.37310 88.31430       8.317760 86.33086 5.433569 83.78824 4.086003 2.542618       6.798462 
1 1 1 -14 26 29 o 50.22156 3.601789 31.71218       4.378760 32.53407       11.05179 31.55913       4.769046 46.43532 10.05820 49.94439 3.950553 -3.509071      10.80622 
1 1 1 -14 26 30 o 28.30204 5.906779 10.90589       3.941988 14.64346       7.365628 9.405655       4.666544 31.04606 9.129641 25.75556 7.171426 5.290501       11.60947 
1 1 1 -14 26 31 o 28.15185 5.857581 10.89847       3.887491 1.537999       6.933270 15.19067       4.694933 18.75992 8.151077 33.27367 6.011372 -14.51375      10.12801 
1 1 1 -14 26 32 o 51.97880 5.217889 36.05308       6.520029 36.02384       8.398913 36.09742       10.34317 50.25478 7.051974 48.02523 9.172269 2.229553       11.56983 
1 1 1 -14 26 33 o 20.38678 7.560283 5.703381       4.994066 9.177240       6.523890 0.7863404      7.761621 24.28516 8.695526 18.56316 8.316288 5.721998       12.03216 
1 1 1 -14 26 34 o 26.93608 6.312310 10.56556       4.070649 7.995671       6.371533 12.33794       5.291327 22.74160 8.518605 28.20608 7.549324 -5.464478      11.38240 
1 1 1 -14 26 35 o 19.04963 6.673723 5.268517       3.825161 5.973854       6.240402 4.843999       4.841311 20.44040 8.207919 18.85869 7.335549 1.581709       11.00819 
1 1 1 -14 26 36 o 12.52629 5.750276 -1.279394      3.996891 -7.918058      6.464240 2.829417       5.085517 12.80387 6.257865 16.84426 7.142302 -4.040393      9.495965 
1 1 1 -14 26 37 o 20.74446 7.457458 7.132175       4.803671 6.025119       6.629250 8.356111       6.970417 19.74722 8.250566 21.59126 8.673115 -1.844036      11.97058 
1 1 1 -14 26 38 o 23.84948 7.033850 9.522085       4.366744 17.30937       9.340256 7.343895       4.939849 26.82505 10.25317 20.64071 7.542202 6.184349       12.72841 
1 1 1 -14 27 1  o 28.73948 5.258357 10.47982       3.547021 9.657872       4.869296 11.40906       5.177357 27.38979 7.201295 29.72504 7.220037 -2.335253      10.19743 
1 1 1 -14 27 2  o 24.62949 6.323432 7.784296       3.814493 10.51943       5.999236 5.928128       4.942147 28.66208 8.184264 22.52510 7.596870 6.136978       11.16667 
1 1 1 -14 27 3  o 43.68417 3.696630 23.53314       3.898286 27.50331       5.424738 19.29362       5.605734 47.07415 4.795805 39.08335 6.083694 7.990803       7.746682 
1 1 1 -14 27 4  o 204.7587 4.414507 514.4870       22.02726 533.0613       38.54087 505.4765       26.84349 206.8235 7.660135 202.5143 5.444293 4.309280       9.397766 
1 1 1 -14 27 5  o 31.56614 6.011252 12.69587       4.455222 32.42836       8.844773 5.987006       5.157274 50.58862 7.392902 22.76659 7.759669 27.82203       10.71762 
1 1 1 -14 27 6  o 164.5304 4.111224 331.8761       16.48365 353.3208       28.78666 321.4143       20.10630 168.6352 7.020334 161.5668 5.113181 7.068420       8.685027 
1 1 1 -14 27 7  o 18.76145 6.931261 3.453086       4.190526 5.985007       7.687135 2.382529       4.998551 24.92033 9.352226 18.63740 7.391625 6.282936       11.92058 
1 1 1 -14 27 8  o 65.73483 3.652672 53.07373       5.828156 61.12234       11.86665 50.51509       6.690708 69.83929 7.069832 64.02337 4.313599 5.815926       8.281888 
1 1 1 -14 27 9  o 147.0403 3.374477 264.5872       12.09146 271.9526       24.94824 262.3260       13.82353 147.8849 6.942145 146.2574 3.881943 1.627548       7.953795 
1 1 1 -14 27 10 o 71.95473 3.583905 63.55864       6.264449 69.31367       13.27732 61.91064       7.104990 74.27256 7.435644 70.92651 4.128576 3.346054       8.504936 
1 1 1 -14 27 11 o 141.7576 3.058412 245.7855       10.56522 243.8050       17.95074 246.8351       13.06852 140.5708 5.249459 141.8673 3.783519 -1.296432      6.470845 
1 1 1 -14 27 12 o 60.17920 3.570880 44.51984       5.213158 43.40666       9.557520 44.99130       6.219893 58.74134 6.802332 60.38718 4.253925 -1.645840      8.022943 
1 1 1 -14 27 13 o 18.52726 6.959521 3.216241       4.259031 -17.96660      12.76818 5.868258       4.517779 19.23907 9.256755 22.10019 7.258374 -2.861124      11.76314 
1 1 1 -14 27 14 o 86.25052 3.056601 91.15847       6.414302 99.83470       11.71372 87.44267       7.665757 89.74664 5.380706 84.35285 3.738517 5.393791       6.551985 
1 1 1 -14 27 15 o 145.3199 3.066155 258.5401       10.85814 244.6812       17.90530 266.6011       13.65556 140.6395 5.233551 147.3304 3.806669 -6.690872      6.471536 
1 1 1 -14 27 16 o 96.47411 2.980505 114.0643       6.998671 99.44883       11.82589 121.9424       8.682372 89.45856 5.450570 99.62655 3.582075 -10.16798      6.522268 
1 1 1 -14 27 17 o 28.78252 6.399772 10.72968       4.372638 14.75399       7.584757 8.726361       5.351446 33.41415 9.079950 26.09597 7.809195 7.318180       11.97619 
1 1 1 -14 27 18 o 37.23262 5.463927 17.56258       4.810101 10.31017       7.482122 22.67140       6.279770 28.59541 9.337952 42.16440 6.304999 -13.56899      11.26723 
1 1 1 -14 27 19 o 117.1533 3.710491 169.0478       10.57972 171.7602       20.50250 168.0635       12.35117 116.3417 7.267922 116.5752 4.355423 -0.2335281     8.473040 
1 1 1 -14 27 20 o 20.87143 7.296668 5.021012       4.571112 5.448834       9.795420 4.901908       5.168381 25.80931 10.31073 21.25006 7.722276 4.559250       12.88195 
1 1 1 -14 27 21 o 85.10971 3.016653 89.07861       6.246737 103.5709       11.79422 83.42811       7.364523 90.90995 5.347416 82.17529 3.687014 8.734657       6.495300 
1 1 1 -14 27 22 o 59.10808 3.292291 43.15757       4.723477 55.53675       9.253825 38.79583       5.492950 66.18768 5.795729 55.82938 4.065304 10.35831       7.079348 
1 1 1 -14 27 23 o 12.59934 5.606778 -1.114610      3.466200 -6.479953      10.81695 -0.5006381     3.659153 20.18572 9.335659 13.50369 5.893603 6.682028       11.04034 
1 1 1 -14 27 24 o 25.71318 5.568590 8.668034       3.388099 8.120345       7.001485 8.835503       3.871595 25.50428 9.021103 25.81238 6.227240 -0.3080997     10.96170 
1 1 1 -14 27 25 o 50.43683 3.479747 31.67621       4.250709 37.71746       8.435786 29.62029       4.921124 53.66463 6.588723 48.52524 4.203004 5.139393       7.815146 
1 1 1 -14 27 26 o 41.95171 3.805943 22.12211       3.848585 27.86853       7.752237 20.24262       4.433515 45.48405 7.236269 39.81240 4.657693 5.671646       8.605678 
1 1 1 -14 27 27 o 9.232653 4.482130 -5.102612      3.164227 -6.409022      6.452546 -4.688983      3.630757 14.40077 6.831961 10.43049 4.996934 3.970281       8.464339 
1 1 1 -14 27 28 o 15.30946 6.015353 2.089838       3.282658 -3.496205      8.186782 3.160006       3.583332 17.75897 8.180537 17.02083 6.385736 0.7381458      10.37780 
1 1 1 -14 27 29 o 10.00660 4.702442 -2.724429      2.925969 -0.6448100     6.059219 -3.356843      3.341376 16.58372 7.394323 10.49666 4.960948 6.087060       8.904326 
1 1 1 -14 27 30 o 23.00844 5.926871 7.361165       3.343471 5.776974       6.444607 7.944589       3.910973 21.57743 8.443188 23.67633 6.554981 -2.098907      10.68902 
1 1 1 -14 27 31 o 27.45300 6.476973 10.76219       4.262582 13.15246       6.746872 9.174284       5.499094 28.81709 8.799842 24.68274 8.001535 4.134348       11.89377 
1 1 1 -14 27 32 o 24.31169 6.669299 8.650436       4.069567 11.30002       6.812104 7.180071       5.074643 26.39848 8.919015 22.08181 7.690145 4.316669       11.77655 
1 1 1 -14 27 33 o 31.67827 6.467402 14.60412       4.823526 21.89609       11.16348 12.93025       5.348569 32.72083 11.40528 28.90674 7.521760 3.814091       13.66226 
1 1 1 -14 27 34 o 21.32095 6.916573 6.934217       4.108491 6.397407       6.759093 7.248781       5.174067 20.94878 8.495708 21.54315 7.740245 -0.5943661     11.49297 
1 1 1 -14 27 35 o 17.56203 6.713394 4.238863       4.004599 2.951551       6.215290 5.152614       5.236406 17.73817 7.712215 19.01089 7.557144 -1.272715      10.79762 
1 1 1 -14 27 36 o 11.70532 5.468692 -2.067132      3.860673 -5.684215      6.365849 0.3721955E-01  4.855525 13.30069 6.433254 14.36553 6.494155 -1.064835      9.141160 
1 1 1 -14 27 37 o 30.30894 6.579037 14.49969       4.719533 11.94374       9.378398 15.36649       5.461475 23.18305 9.757837 30.15858 7.470360 -6.975534      12.28909 
1 1 1 -14 28 1  o 57.53620 3.524367 40.71841       4.917786 27.47536       7.698964 49.84589       6.391661 46.47278 7.016634 63.57390 4.148369 -17.10112      8.151204 
1 1 1 -14 28 2  o 41.07058 3.772810 20.85655       3.733844 22.14916       5.331517 19.61230       5.230828 42.04397 5.322787 39.46481 5.595789 2.579163       7.723012 
1 1 1 -14 28 3  o 37.87309 4.143645 17.81655       3.761937 17.29602       5.349220 18.32592       5.291611 36.89101 6.167807 38.06082 5.895746 -1.169804      8.532390 
1 1 1 -14 28 4  o 25.31916 7.135740 8.208194       4.590680 6.139558       7.115135 9.683454       6.008630 24.48462 9.034173 27.59418 8.278828 -3.109558      12.25379 
1 1 1 -14 28 5  o 77.67106 3.436476 74.03359       6.488318 89.89315       12.87661 68.63657       7.511616 84.93826 6.265121 74.65768 4.145061 10.28057       7.512208 
1 1 1 -14 28 6  o 56.91984 4.432629 40.05591       6.099946 44.08253       9.769605 37.48314       7.809223 59.14856 6.907840 54.72746 5.951258 4.421097       9.117880 
1 1 1 -14 28 7  o 59.80757 3.769595 44.03278       5.466031 44.32590       10.66182 43.92826       6.366334 59.11235 7.575344 59.62393 4.412878 -0.5115738     8.766945 
1 1 1 -14 28 8  o 172.3387 4.155219 364.7537       17.45070 352.5696       29.45029 371.3466       21.66348 167.9693 7.211679 173.4591 5.130652 -5.489746      8.850532 
1 1 1 -14 28 9  o 49.36347 4.063730 30.11861       4.845146 22.98138       9.099106 32.94320       5.724154 41.85265 9.175085 51.54126 4.605922 -9.688610      10.26629 
1 1 1 -14 28 10 o 76.71299 3.384979 72.24113       6.312339 69.85265       13.07969 72.96632       7.207203 74.42794 7.305519 77.01372 3.852509 -2.585777      8.259082 
1 1 1 -14 28 11 o 85.24703 3.367468 89.18851       6.981737 112.7113       15.43339 83.13605       7.828587 94.88237 6.718270 82.19261 3.919836 12.68976       7.778192 
1 1 1 -14 28 12 o 22.01183 7.132153 5.907154       4.369354 20.44895       13.36631 4.167312       4.623355 39.33434 12.44696 20.02436 7.299740 19.30998       14.42958 
1 1 1 -14 28 13 o 93.10698 3.016849 106.2745       6.835939 105.1810       12.01245 106.7981       8.313314 92.01736 5.380525 93.20090 3.667471 -1.183540      6.511558 
1 1 1 -14 28 14 o 64.56819 3.854443 51.42607       6.037194 50.14590       9.607958 52.26129       7.760608 63.10663 6.333212 64.83829 4.949055 -1.731663      8.037581 
1 1 1 -14 28 15 o 93.47856 3.457213 107.4282       7.861861 100.4045       12.20072 112.4154       10.28086 89.71313 5.608824 95.35463 4.436533 -5.641495      7.151345 
1 1 1 -14 28 16 o 75.22331 4.024999 69.90593       7.351402 91.01390       15.08556 63.33224       8.418661 84.56696 7.394545 71.35846 4.870492 13.20850       8.854433 
1 1 1 -14 28 17 o 39.74179 4.983666 19.88562       4.720658 22.77769       10.42848 19.14027       5.294128 40.85968 10.43717 38.76590 5.780572 2.093788       11.93103 
1 1 1 -14 28 18 o 78.86103 3.325567 76.58517       6.376587 84.75108       14.70315 74.69349       7.076739 81.27084 7.508898 77.76899 3.745149 3.501846       8.391048 
1 1 1 -14 28 19 o 32.73016 6.282062 13.92200       4.828410 12.61066       7.734221 14.75948       6.180828 30.75484 9.427543 33.30247 7.760455 -2.547636      12.21078 
1 1 1 -14 28 20 o 28.00659 5.546864 10.16595       3.651733 13.60864       7.375767 9.048047       4.203013 31.68118 9.083881 26.19609 6.590616 5.485090       11.22288 
1 1 1 -14 28 21 o 32.48696 5.787161 13.68554       4.413532 13.68449       7.767079 13.68605       5.363611 31.62425 9.394714 32.08889 7.051912 -0.4646435     11.74692 
1 1 1 -14 28 22 o 100.2956 2.943084 123.9724       7.185396 122.5177       12.79626 124.6423       8.683666 98.42744 5.355128 100.3046 3.558234 -1.877197      6.429496 
1 1 1 -14 28 23 o 24.22122 6.610930 7.830418       4.010330 11.00664       11.39764 7.381632       4.284292 29.72315 11.33470 23.57514 6.970819 6.148003       13.30668 
1 1 1 -14 28 24 o 69.67142 3.138811 60.16633       5.315440 60.47569       9.592209 60.02924       6.385507 68.47398 5.803132 69.32182 3.794448 -0.8478394     6.933554 
1 1 1 -14 28 25 o 42.75802 3.916696 23.05606       4.035779 18.48569       7.863018 24.69068       4.702430 35.80878 9.017494 44.05245 4.440979 -8.243675      10.05174 
1 1 1 -14 28 26 o 59.06399 3.373444 43.60762       4.835290 36.06682       8.944736 46.72098       5.747426 51.34050 7.359625 60.89062 3.893755 -9.550117      8.326188 
1 1 1 -14 28 27 o 26.87455 6.161293 9.891931       3.948725 9.153672       8.728148 10.08192       4.427772 25.95659 9.913898 26.88883 6.764338 -0.9322395     12.00173 
1 1 1 -14 28 28 o 58.69126 3.240125 43.25193       4.616180 45.35227       8.286368 42.30680       5.558596 58.15623 5.929861 57.61209 3.983804 0.5441399      7.143804 
1 1 1 -14 28 29 o 22.82674 6.012911 7.283628       3.390670 3.017313       6.041083 9.245714       4.096825 18.90713 7.886040 25.48733 6.558265 -6.580202      10.25673 
1 1 1 -14 28 30 f 42.48055 4.712509 23.81202       4.796438 17.17569       6.964235 29.80047       6.615563 33.15746 8.560407 46.55834 5.967929 -13.40089      10.43536 
1 1 1 -14 28 31 o 25.92902 5.730907 9.449283       3.524666 11.99506       6.585176 8.427124       4.172691 27.18234 8.751382 23.89482 6.826419 3.287527       11.09895 
1 1 1 -14 28 32 o 17.77149 6.413656 4.247832       3.557156 3.048932       9.105024 4.463782       3.864263 20.27206 9.049856 18.19893 6.667427 2.073135       11.24075 
1 1 1 -14 28 33 o 33.47372 4.586689 15.16868       3.643156 16.29567       7.057704 14.75930       4.253685 30.54550 8.924289 32.24876 5.616716 -1.703264      10.54469 
1 1 1 -14 28 34 o 16.50203 6.379139 3.516165       3.643966 0.8676357      6.178951 4.928498       4.512125 16.37287 7.370562 18.53372 7.115736 -2.160852      10.24494 
1 1 1 -14 28 35 o 31.31889 5.922788 14.57609       4.354765 9.267713       6.743417 18.37349       5.703513 22.48733 8.681906 33.92147 7.126668 -11.43414      11.23231 
1 1 1 -14 28 36 o 16.69808 7.042738 3.314648       4.901516 -2.666391      8.238897 6.591241       6.098065 15.87736 7.584929 19.86115 8.064095 -3.983788      11.07072 
1 1 1 -14 29 1  o 89.87626 3.634574 99.34354       7.943975 106.9856       12.66176 94.38266       10.20161 92.68427 5.632576 87.29347 4.814332 5.390800       7.409703 
1 1 1 -14 29 2  o 87.29687 3.159092 93.50471       6.709348 95.75130       8.995094 90.68742       10.07304 88.10709 4.201573 85.56622 4.850704 2.540878       6.417363 
1 1 1 -14 29 3  o 44.97466 3.699154 24.99893       4.018406 23.30174       5.430638 27.05267       5.973897 43.08811 5.282357 46.44930 5.376854 -3.361187      7.537497 
1 1 1 -14 29 4  o 98.90723 3.302831 120.0520       7.949521 130.5962       15.34060 116.1810       9.294874 102.2696 6.184348 97.15242 3.934169 5.117210       7.329655 
1 1 1 -14 29 5  o 26.08386 7.587801 8.741420       5.111895 10.16405       7.721623 7.631444       6.820560 28.66668 9.492581 25.61000 8.915632 3.056673       13.02296 
1 1 1 -14 29 6  f 90.46673 3.336931 100.4752       7.343910 100.4200       13.54363 100.4982       8.740428 89.60954 6.241196 90.33408 3.980269 -0.7245407     7.402369 
1 1 1 -14 29 7  o 108.2886 3.785991 144.2129       9.975391 149.3442       17.21411 141.6186       12.24005 109.2323 6.496264 107.0404 4.703931 2.191818       8.020498 
1 1 1 -14 29 8  o 40.80555 5.712796 21.04685       5.525295 20.98296       8.678217 21.09040       7.165253 39.80968 9.139047 40.34280 7.566230 -0.5331268     11.86465 
1 1 1 -14 29 9  o 104.9295 3.791150 135.4728       9.678102 129.5582       16.38617 138.6414       11.99351 101.5851 6.655950 105.8896 4.659309 -4.304466      8.124705 
1 1 1 -14 29 10 o 80.73846 4.918106 80.89513       9.630513 99.05598       14.40308 66.21044       12.95148 88.70852 6.712572 72.13822 7.475697 16.57030       10.04712 
1 1 1 -14 29 11 o 40.77708 7.158137 21.47483       6.853648 0.000000       0.000000 21.47483       6.853648 ?        ?        40.77708 7.158137 0.000000       7.158137 
1 1 1 -14 29 12 o 134.1474 3.868583 221.6407       12.63329 211.8650       22.41926 226.1891       15.29242 129.5012 7.131672 135.1978 4.648542 -5.696640      8.512914 
1 1 1 -14 29 13 o 25.01390 7.533756 8.032163       4.968703 3.409562       8.722654 10.25259       6.045387 23.52462 9.609668 28.05203 8.276849 -4.527411      12.68274 
1 1 1 -14 29 14 o 34.24665 5.392871 14.92812       4.351960 17.97973       8.924782 13.97615       4.984765 36.48116 9.822302 32.83463 6.460042 3.646523       11.75626 
1 1 1 -14 29 15 o 65.43163 3.393772 52.78040       5.392867 64.40063       9.960924 47.96196       6.414248 71.54955 5.761577 62.15340 4.260687 9.396149       7.165837 
1 1 1 -14 29 16 f 29.23786 6.502363 11.18820       4.513144 8.388822       7.092587 13.09288       5.850389 26.23443 9.094049 31.39420 7.705384 -5.159769      11.91951 
1 1 1 -14 29 17 o 52.94069 3.708259 34.75018       4.753797 33.36703       8.401128 35.40164       5.765625 50.78455 6.972293 53.22652 4.486850 -2.441971      8.291242 
1 1 1 -14 29 18 o 24.22587 6.431480 7.714749       3.859895 9.257051       7.214682 7.096265       4.568741 27.00048 9.178291 23.44516 7.256400 3.555315       11.70027 
1 1 1 -14 29 19 o 19.48599 6.502004 4.647222       3.621139 8.628253       6.850255 3.103398       4.265872 26.10218 8.941910 18.11810 6.928201 7.984079       11.31184 
1 1 1 -14 29 20 o 90.33663 3.369877 100.9574       7.405461 103.5209       11.51512 99.14937       9.670534 90.51947 5.242671 89.01399 4.472494 1.505478       6.891212 
1 1 1 -14 29 21 o 14.94687 6.071175 1.370542       3.458010 0.3220058      6.469199 1.789983       4.091609 18.34502 7.922285 16.35799 6.618691 1.987030       10.32326 
1 1 1 -14 29 22 o 13.62882 5.923418 -0.2584979     3.663723 -4.006731      10.88956 0.2199368      3.890526 20.86183 9.544838 14.45954 6.192530 6.402288       11.37767 
1 1 1 -14 29 23 o 74.48141 3.154252 68.85965       5.712103 67.85773       10.01246 69.34309       6.954968 72.44088 5.718143 74.41060 3.848598 -1.969719      6.892667 
1 1 1 -14 29 24 o 25.02223 5.959757 8.441935       3.581849 5.716193       6.905507 9.445204       4.189496 22.59988 8.769226 26.29113 6.560571 -3.691246      10.95173 
1 1 1 -14 29 25 o 55.85835 3.490519 39.15890       4.727572 42.01294       8.606544 37.92563       5.657526 56.00654 6.422029 54.56656 4.289104 1.439987       7.722621 
1 1 1 -14 29 26 o 23.13873 6.391597 7.419799       3.723141 8.670277       6.597095 6.835378       4.510010 24.77782 8.757393 22.26209 7.248497 2.515732       11.36805 
1 1 1 -14 29 27 o 22.58541 6.105203 7.098814       3.439776 10.47412       6.521013 5.797579       4.048889 26.37805 8.723003 20.60188 6.875336 5.776169       11.10680 
1 1 1 -14 29 28 o 66.78214 3.690028 56.77446       5.981838 53.32413       8.784937 59.75714       8.167915 62.77954 5.808113 67.32185 5.014756 -4.542313      7.673458 
1 1 1 -14 29 29 o 28.12572 6.105224 11.15953       4.064170 5.894638       5.807658 16.21216       5.689377 21.03971 8.074171 33.21519 7.234286 -12.17548      10.84099 
1 1 1 -14 29 30 o 19.31860 6.228121 5.262939       3.334493 2.235375       6.161684 6.516799       3.965312 17.99061 7.750197 21.16060 6.788900 -3.169991      10.30314 
1 1 1 -14 29 31 o 12.64336 5.625562 -0.3433008     3.488194 3.682562       9.809645 -0.9260240     3.732114 20.85859 9.346623 12.58304 5.690446 8.275555       10.94260 
1 1 1 -14 29 32 o 52.93534 3.545794 36.28798       4.547613 49.51362       8.671139 31.27005       5.341091 58.57664 6.166986 48.16262 4.606840 10.41402       7.697706 
1 1 1 -14 29 33 o 21.00196 6.357914 6.745666       3.532291 5.983281       6.679117 7.041691       4.161946 20.11683 8.332907 21.12928 6.968000 -1.012453      10.86234 
1 1 1 -14 29 34 o 17.85552 6.787484 4.642224       4.078948 5.262950       6.544952 4.248023       5.215737 19.22447 8.124785 17.89976 7.384223 1.324707       10.97902 
1 1 1 -14 29 35 o 16.28506 6.714993 3.246092       4.310510 -7.564465      8.190815 7.386884       5.069263 14.30288 7.001858 20.74922 7.630766 -6.446342      10.35638 
1 1 1 -14 30 1  o 26.61653 5.492158 9.133444       3.444083 13.95365       4.740105 3.743001       5.012653 32.89198 6.139482 19.85337 7.529606 13.03860       9.715360 
1 1 1 -14 30 2  o 12.97298 5.546527 -0.1547337E-01 3.111578 -1.372412      4.143003 1.740315       4.712714 13.79920 6.135900 17.44608 7.087084 -3.646875      9.374222 
1 1 1 -14 30 3  o 81.69216 3.310918 82.08319       6.577550 89.08537       11.68392 78.83447       7.958454 84.34554 5.718284 79.85558 4.103422 4.489967       7.038241 
1 1 1 -14 30 4  o 132.6140 3.242523 215.8793       10.47872 210.0391       13.96536 223.4036       15.85150 130.3302 4.403469 134.2068 4.854849 -3.876587      6.554396 
1 1 1 -14 30 5  o 103.1815 3.296416 130.8483       8.277942 131.5289       15.77303 130.5896       9.724847 102.2637 6.360823 102.9073 3.884909 -0.6436920     7.453360 
1 1 1 -14 30 6  o 39.53483 5.022830 19.67765       4.730012 25.20144       8.803566 17.43596       5.608256 43.69094 8.574903 36.78394 6.493880 6.906994       10.75637 
1 1 1 -14 30 7  o 137.6699 3.346447 232.7920       11.22688 233.7363       22.38801 232.4748       12.97641 136.1258 6.770238 137.3339 3.881293 -1.208130      7.803882 
1 1 1 -14 30 8  o 61.19625 3.781921 46.27708       5.612370 48.95318       11.00817 45.33716       6.523954 61.74819 7.467170 60.40368 4.463655 1.344517       8.699589 
1 1 1 -14 30 9  o 57.55595 3.898549 41.00181       5.435743 45.86937       11.02922 39.44015       6.247157 59.59022 7.780762 56.27310 4.595584 3.317120       9.036572 
1 1 1 -14 30 10 o 89.54221 3.386130 98.69168       7.375380 123.4406       16.05326 92.07007       8.303617 98.75130 6.710767 86.32086 3.957972 12.43044       7.791017 
1 1 1 -14 30 11 o 36.12811 6.162339 16.80112       5.230865 15.92455       9.233817 17.21535       6.347608 34.34822 10.25307 36.19360 7.445451 -1.845371      12.67124 
1 1 1 -14 30 12 o 24.73140 6.542932 7.995269       4.003634 3.422065       8.169930 9.440580       4.592919 22.84362 9.312035 26.79891 6.968658 -3.955290      11.63083 
1 1 1 -14 30 13 o 68.36584 3.568572 57.74589       5.924662 59.33275       12.27302 57.26373       6.765132 67.72169 7.565946 67.92778 4.106062 -0.2060928     8.608327 
1 1 1 -14 30 14 o 29.53008 5.719879 11.29513       3.967404 4.998757       7.174773 14.06836       4.761625 23.04414 8.939402 32.91047 6.163699 -9.866333      10.85837 
1 1 1 -14 30 15 o 42.79790 4.755776 23.08674       4.876326 32.53616       8.093128 17.70101       6.109928 50.12649 6.800656 36.64864 7.097818 13.47786       9.829951 
1 1 1 -14 30 16 o 47.35604 4.542432 28.17120       5.177835 26.12196       8.103574 29.58506       6.731083 44.34274 7.783007 48.07475 5.866947 -3.732010      9.746602 
1 1 1 -14 30 17 f 64.03230 3.346530 50.74658       5.203792 46.69268       9.246461 52.62577       6.295405 60.18437 6.402735 64.99846 3.993803 -4.814087      7.546223 
1 1 1 -14 30 18 o 56.79783 3.558112 40.09022       4.900046 38.30377       8.818996 40.88803       5.893491 54.12709 6.838381 57.12172 4.264626 -2.994625      8.059186 
1 1 1 -14 30 19 o 91.85365 3.468369 104.6635       7.749559 101.6641       11.78937 106.9455       10.28340 89.37744 5.438601 92.24003 4.589308 -2.862587      7.116187 
1 1 1 -14 30 20 o 64.22993 3.310338 51.23967       5.163904 45.71061       9.044688 53.91352       6.289794 59.15723 6.374581 65.62745 3.951217 -6.470215      7.499827 
1 1 1 -14 30 21 o 21.76364 6.836718 6.263441       4.039475 7.674801       11.26491 6.055180       4.327258 26.88833 10.94436 21.57403 7.104590 5.314299       13.04815 
1 1 1 -14 30 22 o 61.04250 3.404824 46.52868       5.044740 48.94662       9.101082 45.45628       6.061085 60.95227 6.214094 59.97051 4.173447 0.9817619      7.485494 
1 1 1 -14 30 23 o 40.49953 4.455153 21.03430       4.324388 24.75602       7.782433 19.37192       5.201273 41.94211 7.904132 38.22551 5.762604 3.716602       9.781764 
1 1 1 -14 30 24 o 15.83712 6.352227 2.076206       3.733186 19.02511       9.176903 -1.284851      4.086611 34.72755 10.18467 13.33585 5.999546 21.39169       11.82041 
1 1 1 -14 30 25 o 13.71466 5.899144 0.3386233      3.559444 5.544578       6.272849 -2.133643      4.322772 21.45811 8.349017 13.08058 5.995577 8.377535       10.27877 
1 1 1 -14 30 26 o 24.87047 6.805245 8.862082       4.243359 3.009310       6.355226 13.57041       5.700115 19.20161 8.054225 30.28490 7.705946 -11.08329      11.14684 
1 1 1 -14 30 27 o 36.27118 5.236614 17.68796       4.494728 26.40748       7.038040 11.68222       5.841017 43.04879 6.945267 27.63156 8.131249 15.41723       10.69364 
1 1 1 -14 30 28 o 34.98037 4.535244 16.18723       3.775079 15.41967       6.772135 16.53328       4.547109 31.08079 8.633517 34.70127 5.565225 -3.620481      10.27177 
1 1 1 -14 30 29 o 25.91497 5.846113 9.541355       3.603777 5.068245       6.427039 11.59270       4.352363 20.26419 8.259741 28.21239 6.468911 -7.948198      10.49143 
1 1 1 -14 30 30 o 16.84171 6.204050 3.698781       3.353189 1.198262       5.939031 4.868886       4.062683 16.78139 7.409933 18.70155 6.838882 -1.920160      10.08352 
1 1 1 -14 30 31 f 26.79443 6.377271 10.76096       4.103615 8.026315       10.42146 11.26278       4.464281 22.59309 9.901314 27.09678 6.778415 -4.503693      11.99929 
1 1 1 -14 30 32 o 9.741872 4.751846 -5.363599      3.674081 -4.846695      5.849080 -5.700473      4.721893 13.15435 6.312530 11.30200 5.484065 1.852347       8.361998 
1 1 1 -14 30 33 o 13.88848 6.124911 0.6586480      4.045789 3.826794       6.605874 -1.243042      5.117968 18.23514 7.939291 13.88529 6.421708 4.349854       10.21130 
1 1 1 -14 30 34 o 12.37622 5.742496 -1.512906      4.142880 1.929715       8.381828 -2.625836      4.765717 17.81360 8.231282 12.58805 5.941925 5.225552       10.15187 
1 1 1 -14 31 1  o 33.63893 4.439693 14.27240       3.550646 15.49713       5.028929 13.05500       5.013850 34.56922 6.197320 31.51403 6.733206 3.055183       9.151112 
1 1 1 -14 31 2  o 42.85955 3.673348 22.82088       3.799632 25.51663       5.193786 19.71683       5.573242 45.04478 4.805684 39.16456 6.032952 5.880219       7.713048 
1 1 1 -14 31 3  o 98.25629 3.193758 118.8464       7.636972 114.0456       9.924256 125.8171       11.95864 95.86844 4.258646 100.4127 4.901978 -4.544243      6.493493 
1 1 1 -14 31 4  o 18.22913 6.353582 3.812516       3.464345 -3.486935      4.821523 11.60287       4.981016 13.57291 6.261484 29.64844 7.005976 -16.07553      9.396270 
1 1 1 -14 31 5  o 70.42930 3.455614 61.22977       5.912712 61.02043       10.93449 61.31627       7.028984 69.16393 6.566240 70.28821 4.121774 -1.124283      7.752711 
1 1 1 -14 31 6  o 82.79270 3.349222 84.50153       6.743335 100.0003       13.66757 79.51482       7.752630 88.78006 6.359544 80.11493 3.983490 8.665131       7.504132 
1 1 1 -14 31 7  o 104.4245 3.284107 134.3065       8.346718 117.7182       15.85177 140.6700       9.817989 96.05785 6.816147 106.6864 3.782381 -10.62851      7.795272 
1 1 1 -14 31 8  o 28.77863 6.428292 10.86217       4.394282 15.70207       8.135693 8.868626       5.221434 33.94575 9.475352 26.00390 7.697227 7.941853       12.20777 
1 1 1 -14 31 9  o 28.50844 6.357136 10.66016       4.303833 14.01437       8.607100 9.541894       4.969746 32.19118 9.959221 26.85064 7.371814 5.340544       12.39071 
1 1 1 -14 31 10 o 82.84731 4.043663 85.17638       8.139085 0.000000       0.000000 85.17638       8.139085 ?        ?        82.84731 4.043663 0.000000       4.043663 
1 1 1 -14 31 11 o 83.70512 3.443858 86.55020       7.009788 89.24274       14.23782 85.68873       8.053475 83.20881 7.089073 83.09406 3.988848 0.1147461      8.134240 
1 1 1 -14 31 12 o 23.72684 6.830950 7.385590       4.162777 -1.382970      7.441514 11.37923       5.022059 18.68286 8.269871 29.22650 7.118336 -10.54364      10.91153 
1 1 1 -14 31 13 o 53.67798 4.717876 36.24397       6.108608 47.53643       11.37584 31.66846       7.241168 59.92870 7.988323 49.61741 6.118221 10.31129       10.06210 
1 1 1 -14 31 14 o 42.51285 5.428227 23.12218       5.495491 31.99879       10.30493 19.59444       6.496358 48.32470 9.084034 38.40176 7.206594 9.922947       11.59546 
1 1 1 -14 31 15 o 97.42760 3.505432 117.6151       8.309047 111.6587       12.12431 122.8901       11.40975 93.91295 5.319551 98.91078 4.747514 -4.997833      7.129972 
1 1 1 -14 31 16 o 43.34442 4.226938 23.65380       4.408068 17.51674       7.653960 26.69962       5.392091 35.40653 8.885980 45.82950 4.904255 -10.42297      10.14950 
1 1 1 -14 31 17 o 33.71336 5.161677 14.67796       4.105854 13.26435       7.198925 15.35949       4.998562 30.74463 9.021619 34.08735 6.247662 -3.342712      10.97374 
1 1 1 -14 31 18 f 22.54887 6.595110 6.788801       3.852607 12.35744       7.107045 4.471484       4.584662 29.60447 9.029984 19.79512 7.260713 9.809349       11.58700 
1 1 1 -14 31 19 o 58.57959 3.530694 42.86980       5.016743 30.49632       8.721012 48.98931       6.133094 47.09468 7.877014 62.39428 4.055631 -15.29959      8.859768 
1 1 1 -14 31 20 o 20.79240 7.013672 5.586609       4.212473 -1.231764      10.21111 6.985003       4.624313 21.04185 9.473477 22.79430 7.333120 -1.752443      11.98004 
1 1 1 -14 31 21 o 62.20547 3.427981 48.45192       5.176316 44.69526       9.108230 50.24406       6.290998 57.70419 6.595582 62.97553 4.121975 -5.271339      7.777685 
1 1 1 -14 31 22 o 21.10010 6.590695 6.048894       3.759407 12.61445       6.955773 3.339612       4.468243 29.08629 8.945041 18.06299 7.041227 11.02330       11.38388 
1 1 1 -14 31 23 o 46.75940 4.333784 28.14077       4.882052 25.10077       10.98583 28.88887       5.449749 38.70183 11.08286 47.09295 4.816576 -8.391117      12.08426 
1 1 1 -14 31 24 o 25.18558 7.513379 9.256828       4.959600 2.337473       6.537239 18.64050       7.612862 18.91570 8.061997 34.70285 8.945454 -15.78715      12.04230 
1 1 1 -14 31 25 o 21.54465 6.835582 6.575684       4.028887 -1.331107      6.062648 12.82904       5.391615 15.91479 7.219326 29.45745 7.494040 -13.54266      10.40573 
1 1 1 -14 31 26 o 38.22948 4.259445 19.07899       3.900826 16.11772       6.736073 20.57310       4.784763 32.07881 8.486951 39.14588 5.139825 -7.067070      9.922003 
1 1 1 -14 31 27 o 25.65480 5.793952 9.283695       3.536362 4.492209       6.102246 11.70658       4.339311 19.73310 8.046424 28.49198 6.405808 -8.758883      10.28491 
1 1 1 -14 31 28 o 17.77917 6.425740 4.239850       3.572174 8.455115       6.613360 2.503395       4.244646 23.14643 8.676996 16.28454 6.683696 6.861887       10.95272 
1 1 1 -14 31 29 o 21.18256 6.366213 6.671432       3.550761 3.388229       6.243499 8.240981       4.316846 18.45880 7.873381 23.11016 7.035338 -4.651356      10.55870 
1 1 1 -14 31 30 o 41.26736 4.682881 23.20300       4.626131 10.76907       11.13436 25.79725       5.085888 23.84213 10.34459 43.31696 4.904240 -19.47482      11.44824 
1 1 1 -14 31 31 o 18.59271 6.824046 5.149632       4.050818 5.409458       6.318060 4.968274       5.278514 19.46404 8.087194 18.73564 7.539999 0.7283955      11.05687 
1 1 1 -14 31 32 o 50.50452 4.159369 34.36119       5.073770 29.93842       10.74186 35.63128       5.756369 36.40405 11.10102 50.77114 4.706161 -14.36709      12.05739 
1 1 1 -14 31 33 o 15.01671 6.281715 2.300829       3.849818 12.44665       8.972522 0.1153745E-01  4.262079 23.75069 9.729325 13.54066 6.106221 10.21003       11.48676 
1 1 1 -14 32 1  o 53.46849 3.427307 35.46707       4.442159 41.85587       6.248050 28.93682       6.316838 57.75465 4.474241 47.56820 5.553760 10.18645       7.131836 
1 1 1 -14 32 2  o 38.22267 4.467338 18.44935       4.082692 18.94015       4.938118 17.38920       7.257616 38.42591 5.424217 35.64698 8.478925 2.778931       10.06550 
1 1 1 -14 32 3  o 31.67719 4.621467 12.77113       3.462446 13.99535       4.822894 11.46906       4.973871 32.66068 6.287780 29.29395 7.052635 3.366732       9.448589 
1 1 1 -14 32 4  o 36.21461 4.263072 16.52369       3.690217 15.89971       5.009248 17.26418       5.456957 34.93435 6.106333 36.33039 6.397313 -1.396042      8.843806 
1 1 1 -14 32 5  o 54.01866 4.094724 36.43521       5.350048 30.28373       9.470604 39.31839       6.483713 47.35615 8.519870 55.87726 4.808313 -8.521111      9.783050 
1 1 1 -14 32 6  o 86.08780 3.951001 92.11454       8.266570 0.000000       0.000000 92.11454       8.266570 ?        ?        86.08780 3.951001 0.000000       3.951001 
1 1 1 -14 32 7  o 53.85752 4.034153 36.20443       5.256149 36.37969       9.993921 36.13741       6.179887 52.19122 8.121942 53.55071 4.786044 -1.359493      9.427203 
1 1 1 -14 32 8  o 48.45423 4.233128 29.42353       4.948239 27.09937       9.402070 30.31390       5.819379 44.44243 8.990565 48.94406 4.946945 -4.501629      10.26170 
1 1 1 -14 32 9  o 18.63794 7.403878 2.790098       5.022894 0.000000       0.000000 2.790098       5.022894 ?        ?        18.63794 7.403878 0.000000       7.403878 
1 1 1 -14 32 10 o 59.53405 3.838888 44.15825       5.539695 54.52369       11.40800 40.95982       6.337000 64.37318 7.407092 57.05542 4.596625 7.317753       8.717452 
1 1 1 -14 32 11 o 52.43642 4.076331 34.42029       5.167922 41.41255       10.18438 31.99548       5.997430 55.78246 7.696976 50.22111 4.965444 5.561352       9.159644 
1 1 1 -14 32 12 o 40.30652 4.925626 20.71754       4.737680 18.79761       9.314321 21.38762       5.502682 36.17234 10.15362 40.66267 5.710326 -4.490322      11.64919 
1 1 1 -14 32 13 o 61.54868 4.374964 47.63564       6.519119 42.27290       10.82744 50.68524       8.164961 55.86573 8.196917 63.01391 5.368247 -7.148182      9.798343 
1 1 1 -14 32 14 o 41.97995 4.820829 22.48519       4.842340 34.32927       9.744740 18.60159       5.580036 50.08433 8.272792 37.52881 6.326219 12.55552       10.41442 
1 1 1 -14 32 15 o 12.45990 5.824625 -3.751647      4.390080 -9.481073      7.077605 -0.1688027     5.596863 14.19787 6.846494 16.71806 7.292842 -2.520185      10.00300 
1 1 1 -14 32 16 o 55.47614 4.184185 38.83416       5.614875 34.92088       8.224307 42.25052       7.684422 51.21481 6.754211 57.13010 5.591134 -5.915291      8.768132 
1 1 1 -14 32 17 o 23.06599 6.648938 7.211394       3.941596 13.46156       7.006393 4.317387       4.767586 30.55521 8.881733 19.64323 7.366548 10.91199       11.53912 
1 1 1 -14 32 18 o 54.08932 3.675479 36.76937       4.815863 31.36482       8.293661 39.51863       5.915272 47.83169 7.350145 55.72749 4.391270 -7.895802      8.562002 
1 1 1 -14 32 19 o 25.39847 6.345708 8.859957       3.916028 17.23412       7.341589 5.529875       4.629635 34.21553 8.766368 20.78718 7.337177 13.42835       11.43168 
1 1 1 -14 32 20 o 64.50632 3.374384 52.21305       5.285913 40.50842       8.605021 59.30629       6.698776 54.60974 6.599866 68.33696 4.040606 -13.72722      7.738523 
1 1 1 -14 32 21 o 40.18865 4.494695 20.93349       4.326597 20.49899       7.405687 21.15864       5.331008 37.21222 8.370045 39.73713 5.665503 -2.524910      10.10720 
1 1 1 -14 32 22 o 58.47080 4.090422 43.82512       5.791556 39.16747       8.705577 47.52325       7.757208 52.93900 6.913166 59.85112 5.375807 -6.912113      8.757349 
1 1 1 -14 32 23 o 18.63128 6.752539 4.437468       3.948291 3.449423       6.289598 5.080047       5.072215 19.41683 8.068385 20.04219 7.580363 -0.6253681     11.07071 
1 1 1 -14 32 24 f 16.83175 6.619225 2.997485       3.977814 1.976809       6.490350 3.611521       5.034092 18.36560 7.933214 18.40609 7.378562 -0.4049110E-01 10.83416 
1 1 1 -14 32 25 o 23.05470 6.257045 7.639423       3.604410 5.659379       6.229185 8.636065       4.419399 20.87966 8.260850 24.12073 7.066028 -3.241072      10.87062 
1 1 1 -14 32 26 o 43.30406 4.054628 24.48383       4.228981 19.41437       7.101853 27.26902       5.264030 34.82133 8.455023 45.07622 4.869394 -10.25489      9.756968 
1 1 1 -14 32 27 o 14.40452 5.988388 1.580635       3.467036 8.770951       6.793260 -0.9518868     4.031632 23.25654 8.777873 13.01833 5.898151 10.23821       10.57541 
1 1 1 -14 32 28 o 14.68880 6.012880 1.990974       3.423931 -1.924325      6.149975 3.749678       4.121804 15.03482 6.983105 17.25815 6.752527 -2.223330      9.713926 
1 1 1 -14 32 29 o 14.58939 6.510814 0.3240149      4.708541 3.465935       10.02064 -0.5662584     5.334080 19.98078 9.147144 14.71601 6.712868 5.264771       11.34605 
1 1 1 -14 32 30 o 17.79083 6.882119 4.465361       4.243430 0.7470794E-02  6.451002 7.865453       5.633883 15.97969 7.324348 21.55459 8.023015 -5.574901      10.86346 
1 1 1 -14 32 31 o 25.85895 6.481658 10.48381       4.076073 17.78894       9.386439 8.786102       4.524989 27.80672 10.35472 22.93384 7.240203 4.872879       12.63490 
1 1 1 -14 33 1  o 77.40352 3.239995 74.30389       6.097892 78.87158       8.051578 68.15974       9.338201 79.29370 4.181616 73.07481 5.279557 6.218895       6.734956 
1 1 1 -14 33 2  o 18.76846 5.918165 4.506227       3.024195 2.618286       3.997845 7.031699       4.623840 17.08244 6.659917 23.09186 7.322491 -6.009420      9.898149 
1 1 1 -14 33 3  o 54.42911 3.242545 36.78234       4.281347 39.13319       6.190612 34.62712       5.927437 55.63134 4.607736 52.26940 4.703801 3.361942       6.584602 
1 1 1 -14 33 4  f 26.18865 5.287809 8.979144       3.258232 11.48216       4.306207 5.627178       4.983255 29.38761 6.207908 21.52451 7.610896 7.863092       9.821601 
1 1 1 -14 33 5  o 35.60717 5.489679 16.44963       4.610538 6.965137       7.803632 21.53576       5.714571 24.68918 9.387505 40.64255 5.945763 -15.95336      11.11204 
1 1 1 -14 33 6  o 95.75906 3.369803 113.7301       7.851328 96.54945       14.20760 121.2835       9.420424 85.88660 6.844862 98.58204 3.929229 -12.69543      7.892463 
1 1 1 -14 33 7  o 71.07486 3.648197 62.92554       6.297596 63.15977       11.62807 62.82833       7.491383 69.25114 6.985787 70.68649 4.370373 -1.435349      8.240230 
1 1 1 -14 33 8  f 17.77355 7.176634 2.327547       4.799421 0.000000       0.000000 2.327547       4.799421 ?        ?        17.77355 7.176634 0.000000       7.176634 
1 1 1 -14 33 9  o 100.5770 3.385083 125.5910       8.284853 117.6602       16.10684 128.4442       9.660856 94.47484 7.046896 101.3960 3.917206 -6.921165      8.062459 
1 1 1 -14 33 10 o 65.53149 3.739265 53.66130       5.946563 45.30885       10.82005 57.27591       7.117915 57.78983 7.888937 67.41376 4.356115 -9.623924      9.011719 
1 1 1 -14 33 11 o 139.2046 3.455633 240.8183       11.72242 230.6783       23.13160 244.3223       13.59783 131.8147 7.228886 139.6996 3.998391 -7.884888      8.260987 
1 1 1 -14 33 12 o 106.4956 4.802486 143.9889       12.43126 138.1399       17.52350 149.9146       17.63797 101.9154 7.100180 106.5133 6.831318 -4.597839      9.852891 
1 1 1 -14 33 13 o 42.26426 4.914338 22.98314       4.967162 21.40862       8.960825 23.68154       5.967968 38.12593 9.640513 42.41483 5.936278 -4.288898      11.32161 
1 1 1 -14 33 14 f 23.44982 6.929725 7.496617       4.234940 7.322687       7.808247 7.569103       5.040746 24.51720 9.373773 23.63523 7.660729 0.8819675      12.10596 
1 1 1 -14 33 15 o 71.29599 4.214156 64.37302       7.289040 64.89074       12.36865 64.09756       9.022174 68.88113 7.489031 70.37875 5.299510 -1.497620      9.174442 
1 1 1 -14 33 16 o 23.39760 6.715359 7.544562       4.029003 13.15030       8.298156 5.815449       4.608683 29.59721 9.841891 21.13454 7.330424 8.462673       12.27184 
1 1 1 -14 33 17 o 47.40405 4.424325 28.84672       5.051886 34.38764       7.875013 24.97180       6.585555 50.34080 6.576504 42.85250 6.510968 7.488300       9.254356 
1 1 1 -14 33 18 o 59.93337 4.104821 45.80857       5.958940 49.57885       9.077520 42.95356       7.899232 60.66665 6.228544 56.80591 5.787034 3.860744       8.502030 
1 1 1 -14 33 19 o 60.34111 4.721063 47.28469       6.886844 57.50852       14.18687 44.13268       7.877240 60.83863 9.909879 57.49051 5.697526 3.348114       11.43099 
1 1 1 -14 33 20 o 73.57435 4.211737 69.54082       7.519786 61.90261       13.12448 73.27377       9.175123 64.54023 8.555305 74.67581 5.072019 -10.13558      9.945785 
1 1 1 -14 33 21 o 38.51498 4.569712 19.44397       4.205497 10.03416       7.380166 23.96874       5.117688 25.59749 9.238176 42.49987 5.039364 -16.90238      10.52326 
1 1 1 -14 33 22 o 29.77708 5.493297 12.14371       3.839310 9.466280       7.014627 13.28882       4.587442 24.83188 9.000373 30.64331 6.352038 -5.811424      11.01613 
1 1 1 -14 33 23 o 16.95019 6.660870 3.145870       4.025437 10.24831       6.250003 -1.888995      5.262236 25.49844 8.542711 14.39578 6.604600 11.10266       10.79809 
1 1 1 -14 33 24 o 14.38214 5.999594 1.409039       3.497324 3.136995       6.218068 0.6094701      4.229775 18.64245 7.900908 14.62843 6.361156 4.014018       10.14340 
1 1 1 -14 33 25 o 16.23130 6.263429 3.105664       3.508454 2.237975       6.624132 3.443980       4.136265 18.12781 7.920362 17.13114 6.745867 0.9966698      10.40379 
1 1 1 -14 33 26 o 22.19402 6.351544 7.350532       3.609292 0.8425689      6.227865 10.64174       4.428881 16.72179 7.473423 26.40854 6.830993 -9.686745      10.12494 
1 1 1 -14 33 27 o 24.43863 6.340787 9.026393       3.808215 12.08453       6.699486 7.566560       4.628760 25.94075 8.844052 21.80823 7.352058 4.132521       11.50087 
1 1 1 -14 33 28 o 18.07486 7.130690 4.503319       4.629271 -5.449007      9.524239 7.581794       5.297071 16.36644 7.904573 21.44812 7.814315 -5.081676      11.11512 
1 1 1 -14 33 29 o 15.70400 6.422673 2.771960       3.902161 8.304435       9.205545 1.560107       4.308388 21.69432 9.409394 14.94502 6.459634 6.749308       11.41331 
1 1 1 -14 33 30 o 13.16029 5.860871 0.2195457      3.794897 -0.4074804     7.716264 0.4195912      4.358417 16.51762 7.721686 14.00449 6.255951 2.513136       9.937876 
1 1 1 -14 34 1  o 22.74731 6.839248 7.029500       4.097427 8.973939       6.553973 5.781873       5.249889 25.54112 8.746495 21.55996 7.790210 3.981157       11.71275 
1 1 1 -14 34 2  o 33.52620 5.241045 14.70463       4.141816 16.00658       7.277638 14.08093       5.037127 33.20817 8.838098 32.16596 6.646092 1.042213       11.05814 
1 1 1 -14 34 3  o 26.87346 6.232696 9.781034       4.002293 12.24003       7.014374 8.594013       4.873482 29.15001 8.985869 24.95574 7.448593 4.194262       11.67165 
1 1 1 -14 34 4  o 24.34731 5.538585 7.912719       3.211785 8.496408       4.408829 7.252671       4.688345 24.87557 6.986736 23.17385 7.376332 1.701714       10.15996 
1 1 1 -14 34 5  o 39.52450 5.075727 20.22981       4.776070 23.49784       8.553628 18.74935       5.757120 40.39631 8.927073 37.31378 6.571341 3.082535       11.08491 
1 1 1 -14 34 6  o 16.00944 6.420780 1.994544       3.813847 5.994158       7.274606 0.4785334      4.478696 23.10864 8.991055 15.50552 6.642400 7.603118       11.17857 
1 1 1 -14 34 7  o 37.54007 5.940809 18.67173       5.254037 0.000000       0.000000 18.67173       5.254037 ?        ?        37.54007 5.940809 0.000000       5.940809 
1 1 1 -14 34 8  o 32.83649 5.662598 14.27148       4.367531 18.16286       7.546262 12.31141       5.355697 35.42854 8.784349 29.70061 7.421314 5.727930       11.49960 
1 1 1 -14 34 9  o 41.10819 4.902184 21.82580       4.814167 33.41317       9.205335 17.46351       5.648127 48.95923 7.990969 35.84369 6.712931 13.11554       10.43643 
1 1 1 -14 34 10 o 61.73106 3.805382 47.96640       5.696682 44.87762       10.47695 49.26290       6.787767 56.97642 7.746198 62.16481 4.511403 -5.188393      8.964170 
1 1 1 -14 34 11 o 12.95756 6.087569 -4.240697      4.897843 -13.18210      7.332805 2.961646       6.581185 13.21407 6.500284 19.91456 8.262357 -6.700485      10.51286 
1 1 1 -14 34 12 o 58.96958 3.898256 43.96157       5.570463 39.79674       10.57766 45.55989       6.552734 52.71627 8.524784 59.65629 4.541574 -6.940022      9.659081 
1 1 1 -14 34 13 o 32.36055 6.622334 14.43892       5.046209 11.42870       8.612362 16.01263       6.227087 27.82925 9.987732 33.43333 7.788404 -5.604074      12.66547 
1 1 1 -14 34 14 o 23.63786 8.390668 7.669950       6.061674 4.913634       8.057870 11.26322       9.200275 22.28429 9.184098 27.60005 10.25656 -5.315760      13.76753 
1 1 1 -14 34 15 o 16.40913 6.848811 1.662913       4.561031 -5.851053      7.122797 6.885321       5.938152 15.26769 7.223992 22.66254 8.271091 -7.394844      10.98167 
1 1 1 -14 34 16 o 41.84649 5.355752 23.27818       5.336514 29.29983       9.622464 20.60344       6.413122 43.66229 9.327009 38.13728 7.163520 5.525013       11.76049 
1 1 1 -14 34 17 o 15.48577 6.683922 0.6598601      4.599953 -0.2101076     8.385899 1.034285       5.501494 19.08430 8.589250 16.90098 7.302244 2.183311       11.27377 
1 1 1 -14 34 18 o 57.56367 4.130634 42.62162       5.755785 57.95732       13.90378 39.44995       6.323028 60.72240 9.724128 54.89005 4.774563 5.832348       10.83306 
1 1 1 -14 34 19 o 11.98509 5.538929 -2.242483      3.797581 -1.715235      7.317779 -2.436812      4.442640 17.09527 7.822632 12.96365 5.991081 4.131622       9.853254 
1 1 1 -14 34 20 o 14.02936 5.966039 0.8394911      3.566033 4.407001       6.313131 -0.8321441     4.321485 20.00450 8.173969 13.78391 6.187920 6.220587       10.25203 
1 1 1 -14 34 21 o 38.66962 4.607168 19.80762       4.256223 6.622333       7.003207 27.53025       5.359633 22.01960 8.743963 45.41198 4.921743 -23.39238      10.03397 
1 1 1 -14 34 22 o 15.53682 6.531150 1.706814       4.193006 0.2558466      6.377886 2.811323       5.564582 16.83682 7.541074 17.85017 7.514946 -1.013353      10.64623 
1 1 1 -14 34 23 o 10.26311 4.902126 -3.710948      3.438565 -5.760310      6.280723 -2.833764      4.109088 13.66770 6.554247 11.95822 5.604640 1.709475       8.623813 
1 1 1 -14 34 24 o 14.27101 6.007688 1.388379       3.555876 3.819124       6.792084 0.4705930      4.173535 19.11904 8.184943 14.25126 6.255103 4.867778       10.30144 
1 1 1 -14 34 25 o 18.98770 7.034088 5.234084       4.321031 -1.529404      6.725085 9.989533       5.639079 15.74410 7.309038 24.36827 8.113470 -8.624163      10.92019 
1 1 1 -14 34 26 o 15.60950 6.553011 2.238821       4.212407 0.3450989      5.933725 4.162866       5.981044 15.85648 7.172564 18.49018 7.788120 -2.633700      10.58775 
1 1 1 -14 34 27 o 10.10358 4.875474 -4.271087      3.603918 -6.428365      7.745075 -3.674908      4.071562 14.53077 7.044363 11.19347 5.343147 3.337301       8.841508 
1 1 1 -14 34 28 o 35.45817 5.400371 18.10721       4.519186 18.83558       9.833681 17.91220       5.088339 28.35170 10.59045 34.33749 6.313530 -5.985790      12.32957 
1 1 1 -14 35 1  o 54.01198 3.368587 36.68846       4.411706 42.33841       6.425060 31.64838       6.068394 57.25685 4.644680 49.14257 5.143432 8.114285       6.930219 
1 1 1 -14 35 2  o 13.74815 5.545862 1.391662       2.862989 4.688899       3.776572 -3.063900      4.390095 19.10557 6.635241 12.66499 5.888385 6.440578       8.871274 
1 1 1 -14 35 3  o 23.38878 5.659198 7.441823       3.190219 4.027929       4.405750 11.20489       4.625575 18.73421 7.069465 28.27852 6.796809 -9.544310      9.806831 
1 1 1 -14 35 4  o 25.77443 5.318120 8.911061       3.229421 9.506811       4.199273 8.048688       5.052309 26.11569 6.597294 23.91471 7.662183 2.200975       10.11105 
1 1 1 -14 35 5  o 12.42200 5.630735 -1.526483      3.679781 -2.681330      5.311421 -0.4605590     5.102835 14.38313 6.612252 15.49608 6.854245 -1.112952      9.523789 
1 1 1 -14 35 6  o 35.35103 7.459414 17.72290       6.223722 0.000000       0.000000 17.72290       6.223722 ?        ?        35.35103 7.459414 0.000000       7.459414 
1 1 1 -14 35 7  o 18.82268 6.961869 4.222189       4.229749 0.3347951      7.262080 6.218012       5.203466 18.59762 8.203634 21.73463 7.767737 -3.137011      11.29767 
1 1 1 -14 35 8  o 31.46535 6.463697 13.67160       4.790268 18.74486       8.049957 10.89023       5.960449 35.00862 9.285123 27.25736 8.260522 7.751261       12.42778 
1 1 1 -14 35 9  f 14.07885 6.222289 -0.4919991     4.196976 -5.806859      7.497906 1.933118       5.064778 15.77049 7.446823 17.27279 7.213785 -1.502299      10.36792 
1 1 1 -14 35 10 o 39.15534 5.529987 20.44977       5.129840 31.63038       9.152244 15.32828       6.194309 46.51823 8.381874 32.38202 7.917040 14.13621       11.52976 
1 1 1 -14 35 11 o 62.87191 4.787195 51.34748       7.279415 0.000000       0.000000 51.34748       7.279415 ?        ?        62.87191 4.787195 0.000000       4.787195 
1 1 1 -14 35 12 f 22.20894 7.087578 6.928874       4.326211 1.004428       8.275595 9.156801       5.074881 19.70866 8.722626 25.09587 7.625685 -5.387205      11.58599 
1 1 1 -14 35 13 o 20.05928 6.783109 5.444871       3.940104 15.49011       8.315061 2.536281       4.474316 30.96184 9.819692 17.02815 6.909845 13.93369       12.00718 
1 1 1 -14 35 14 o 27.35161 6.413190 10.54820       4.199941 11.31513       8.319779 10.28591       4.865389 26.91220 9.795066 26.55568 7.295269 0.3565235      12.21328 
1 1 1 -14 35 15 o 32.39426 5.812456 14.39628       4.419837 11.80819       8.412288 15.38313       5.194591 27.21337 9.857344 32.93460 6.700654 -5.721239      11.91914 
1 1 1 -14 35 16 o 10.41611 5.012218 -4.808790      3.745928 1.222644       7.315119 -6.952535      4.361117 18.69966 8.241702 10.58551 5.166358 8.114149       9.727122 
1 1 1 -14 35 17 o 16.28961 6.802484 1.926776       4.503022 0.000000       0.000000 1.926776       4.503022 ?        ?        16.28961 6.802484 0.000000       6.802484 
1 1 1 -14 35 18 o 26.19449 6.579499 9.952304       4.193741 9.468677       8.116879 10.12842       4.898170 24.68009 9.526003 25.95373 7.390041 -1.273640      12.05643 
1 1 1 -14 35 19 o 12.72296 5.695108 -0.6659569     3.631734 -0.4543124E-01 6.408131 -0.9595720     4.407991 16.76586 7.530190 13.72531 6.197799 3.040548       9.752768 
1 1 1 -14 35 20 o 14.62894 6.361727 0.6558046      4.231023 -1.036743      6.214712 2.118046       5.776438 15.87635 7.243579 17.45164 7.510864 -1.575291      10.43468 
1 1 1 -14 35 21 o 16.83765 6.614229 3.317531       3.968007 2.832522       5.703994 3.772342       5.523574 17.79274 7.555114 18.42487 7.599746 -0.6321278     10.71615 
1 1 1 -14 35 22 o 14.48168 6.086105 1.504507       3.639632 9.408223       6.547429 -2.030037      4.378464 23.69122 8.678941 12.78050 5.920869 10.91071       10.50622 
1 1 1 -14 35 23 o 59.27100 4.078158 46.42519       5.854465 42.90961       8.931626 49.07350       7.752038 53.09225 7.079701 59.21321 5.432806 -6.120960      8.923987 
1 1 1 -14 35 24 o 28.39639 7.269085 12.88785       5.050939 8.025863       8.615211 15.43434       6.234901 21.99429 9.309751 30.04844 8.259870 -8.054150      12.44576 
1 1 1 -14 35 25 o 17.53483 6.618465 4.327647       3.862076 -6.601050      7.962165 7.690001       4.416403 14.70987 7.133827 21.82285 7.176950 -7.112987      10.11929 
1 1 1 -14 35 26 o 28.38414 6.463569 12.44487       4.370345 8.441734       9.074582 13.65375       4.986760 21.72670 9.382798 29.11696 7.094269 -7.390259      11.76289 
1 1 1 -14 36 1  o 14.17613 5.731480 1.596220       3.065550 4.379825       4.209299 -1.547689      4.473433 18.71803 6.941001 13.60266 6.182635 5.115370       9.295293 
1 1 1 -14 36 2  o 27.00262 5.345718 9.911865       3.393091 11.59649       4.628582 7.954875       4.988746 28.45977 6.772440 23.39861 7.623852 5.061163       10.19750 
1 1 1 -14 36 3  o 47.06414 3.579763 28.16297       4.074838 35.18418       5.861069 21.59416       5.669106 51.89267 4.685255 39.67853 6.054497 12.21414       7.655622 
1 1 1 -14 36 4  o 68.92380 3.446847 60.05314       5.770945 58.12909       7.359440 63.12532       9.299509 66.93063 4.539004 68.68454 5.604719 -1.753914      7.212173 
1 1 1 -14 36 5  o 40.19226 5.953304 22.04942       5.654845 0.000000       0.000000 22.04942       5.654845 ?        ?        40.19226 5.953304 0.000000       5.953304 
1 1 1 -14 36 6  o 16.17967 6.418993 2.509940       3.770792 4.043112       6.780353 1.823419       4.537154 20.32070 8.404587 16.37776 6.832921 3.942936       10.83171 
1 1 1 -14 36 7  o 20.80872 6.769090 6.020108       3.933641 -2.371792      7.454074 9.259153       4.630971 17.02016 7.827724 25.24570 7.184728 -8.225538      10.62514 
1 1 1 -14 36 8  o 16.21773 6.543356 2.330746       3.986363 2.306776       6.938557 2.342556       4.870398 19.17395 8.241692 17.20921 7.120931 1.964741       10.89188 
1 1 1 -14 36 9  f 45.32812 4.623154 26.86905       5.035305 21.26216       10.01581 28.76546       5.824931 35.11187 10.72172 46.48203 5.233281 -11.37016      11.93073 
1 1 1 -14 36 10 o 15.59053 6.357505 1.965230       3.809599 5.893120       8.271697 0.9077660      4.291881 22.47641 9.288325 15.20665 6.508113 7.269752       11.34145 
1 1 1 -14 36 11 o 11.00336 5.275276 -4.821894      4.063086 -8.257783      7.030873 -3.099106      4.978582 14.02223 6.777064 13.42450 6.251334 0.5977297      9.219967 
1 1 1 -14 36 12 o 23.94078 6.603703 8.242031       3.977525 7.574362       8.019603 8.459855       4.580626 23.45062 9.342362 24.01085 7.233990 -0.5602283     11.81568 
1 1 1 -14 36 13 o 18.08267 7.274075 3.401932       4.910469 0.000000       0.000000 3.401932       4.910469 ?        ?        18.08267 7.274075 0.000000       7.274075 
1 1 1 -14 36 14 o 39.98935 4.825679 21.26842       4.607640 19.61452       8.947814 21.86525       5.375080 33.70079 10.10087 39.93581 5.683377 -6.235023      11.59001 
1 1 1 -14 36 15 o 27.69889 6.517002 11.09609       4.324992 13.08230       8.275394 10.34969       5.072960 27.70691 9.806828 26.09813 7.549140 1.608776       12.37592 
1 1 1 -14 36 16 o 24.97415 7.540968 9.553288       4.973661 0.000000       0.000000 9.553288       4.973661 ?        ?        24.97415 7.540968 0.000000       7.540968 
1 1 1 -14 36 17 o 12.38406 5.622045 -1.161291      3.685383 -1.636453      7.127775 -0.9879127     4.305566 16.52051 7.618349 13.49047 6.105319 3.030044       9.762897 
1 1 1 -14 36 18 o 23.74081 6.777110 8.473942       4.114206 -6.257325      7.344535 15.21035       4.966592 14.71091 7.063188 32.21074 6.550686 -17.49982      9.633282 
1 1 1 -14 36 19 o 19.38036 7.441716 5.197834       4.935425 29.81491       10.08866 -2.547105      5.658797 40.40395 10.23619 14.26554 6.650245 26.13841       12.20677 
1 1 1 -14 36 20 o 19.98395 7.776226 5.783051       5.442096 0.3125579      6.512708 18.44161       9.906960 16.60143 7.511472 29.80558 10.71028 -13.20416      13.08175 
1 1 1 -14 36 21 o 24.15099 7.498781 9.455180       4.874620 9.834455       8.127471 9.242093       6.091968 23.45682 9.384858 23.30423 8.395538 0.1525841      12.59209 
1 1 1 -14 36 22 o 20.52187 7.438560 6.623853       4.791464 8.027867       8.301014 5.922341       5.867631 21.94482 9.204949 19.92930 7.973905 2.015522       12.17843 
1 1 1 -14 36 23 o 24.01071 6.841996 9.141104       4.197031 12.94596       8.858445 8.039787       4.765895 25.09056 9.874590 22.10756 7.460178 2.983002       12.37585 
1 1 1 -14 36 24 o 69.43349 3.498902 62.92749       5.901127 77.20002       10.73847 56.75271       7.063217 72.11616 6.169670 64.51897 4.521020 7.597183       7.648820 
1 1 1 -14 37 1  o 18.22603 5.913776 4.571704       3.003431 2.885698       4.033579 6.669710       4.499501 16.64473 6.627379 21.41992 7.248622 -4.775187      9.821644 
1 1 1 -14 37 2  o 42.51559 3.690166 23.23503       3.785401 29.54510       5.620184 17.99556       5.121264 47.02127 4.980411 35.83583 6.081582 11.18544       7.860670 
1 1 1 -14 37 3  o 35.89961 4.143433 16.82417       3.558383 22.43156       5.110260 11.54630       4.957828 40.72948 5.272288 27.81498 7.243848 12.91450       8.959373 
1 1 1 -14 37 4  o 18.87476 6.436816 4.875635       3.548839 7.745322       6.138425 3.434928       4.349381 22.89713 8.400962 17.57053 6.917903 5.326599       10.88272 
1 1 1 -14 37 5  o 15.46456 6.222913 2.199407       3.595062 7.437368       6.908731 0.2544056      4.209951 22.77671 8.789263 14.41922 6.306794 8.357490       10.81789 
1 1 1 -14 37 6  o 14.23759 6.006720 1.079217       3.567183 -4.276523      6.708740 3.190295       4.211952 15.05352 7.088564 17.19127 6.795579 -2.137743      9.819757 
1 1 1 -14 37 7  o 12.98390 5.830479 -0.8386218     3.839750 0.5670658      6.678050 -1.532865      4.693113 17.51752 7.789658 13.82601 6.302943 3.691516       10.02027 
1 1 1 -14 37 8  o 38.29115 4.981758 19.65452       4.538442 23.20720       8.472214 18.22477       5.374641 37.71415 9.282189 35.85625 6.385149 1.857899       11.26628 
1 1 1 -14 37 9  o 31.69147 5.876750 14.02882       4.371460 14.06751       8.345067 14.01419       5.131917 28.59449 9.866693 30.88570 6.982929 -2.291214      12.08772 
1 1 1 -14 37 10 f 30.54283 6.947186 13.72549       5.053673 13.20027       7.986797 14.07619       6.526313 27.83903 9.650308 29.61551 8.561281 -1.776478      12.90054 
1 1 1 -14 37 11 o 20.95235 6.964489 6.369936       4.155398 2.740439       8.305031 7.582010       4.799352 19.93476 8.784037 22.50233 7.484841 -2.567574      11.54046 
1 1 1 -14 37 12 o 10.35802 5.013981 -5.277129      3.886540 2.374535       8.027455 -7.619893      4.441853 19.45664 8.601933 10.36521 5.090950 9.091435       9.995549 
1 1 1 -14 37 13 f 53.56312 4.154120 37.52151       5.379913 44.15385       11.31054 35.58220       6.116095 51.84429 9.293954 51.44135 4.939578 0.4029427      10.52507 
1 1 1 -14 37 14 o 18.70217 7.168690 4.591836       4.574446 6.995409       7.895405 3.377303       5.612425 22.12772 9.102345 18.22429 7.601159 3.903435       11.85876 
1 1 1 -14 37 15 o 28.30384 8.535343 13.37496       6.374774 0.000000       0.000000 13.37496       6.374774 ?        ?        28.30384 8.535343 0.000000       8.535343 
1 1 1 -14 37 16 o 19.46257 7.269072 5.396467       4.632520 6.764192       7.821194 4.657331       5.749577 21.64084 8.995317 19.20461 7.818124 2.436234       11.91800 
1 1 1 -14 37 17 o 14.83814 6.509770 0.7488662      4.515711 4.937209       7.530051 -1.603299      5.643009 20.11235 8.614332 14.64677 6.762956 5.465588       10.95191 
1 1 1 -14 37 18 o 14.17219 6.106821 1.028791       3.827536 -4.543773      7.294171 3.146246       4.496302 15.00829 7.160674 16.83022 6.890076 -1.821935      9.937222 
1 1 1 -14 37 19 o 16.92829 7.050403 3.074079       4.818391 -3.123835      7.415042 7.603968       6.339203 15.59994 7.378067 21.57386 8.393339 -5.973919      11.17515 
1 1 1 -14 37 20 o 14.43071 6.214641 1.253755       3.959489 11.96947       7.715786 -2.576893      4.613237 24.98234 9.370866 12.63636 5.927594 12.34598       11.08826 
1 1 1 -14 37 21 o 32.07953 5.610610 14.91065       4.226419 19.43036       6.924729 12.22750       5.335433 33.32340 8.501198 26.93218 7.727150 6.391222       11.48822 
1 1 1 -14 37 22 o 40.57724 4.662112 22.70235       4.526348 21.87486       7.469619 23.18252       5.690018 34.88208 8.791739 39.46744 6.113696 -4.585358      10.70850 
1 1 1 -14 38 1  o 25.14659 5.310811 8.879846       3.152221 13.24693       4.370085 4.143153       4.551260 30.24501 6.139227 18.10560 7.092208 12.13941       9.380273 
1 1 1 -14 38 2  o 15.96057 5.809762 3.258523       2.927063 5.507630       4.054590 0.8106474      4.229962 19.54910 6.869238 14.66776 6.369932 4.881339       9.368162 
1 1 1 -14 38 3  o 20.52320 6.522894 6.185284       3.667360 13.60260       6.219551 2.231800       4.540730 28.76263 8.370327 16.27295 6.815713 12.48969       10.79427 
1 1 1 -14 38 4  o 16.92892 5.970320 3.836931       3.064881 3.535249       4.189122 4.184418       4.495915 17.27351 6.792819 18.18553 7.070347 -0.9120235     9.804703 
1 1 1 -14 38 5  o 23.24520 7.283604 8.298976       4.587725 24.33195       7.872768 0.5508287E-01  5.645295 38.77602 8.560864 15.82035 7.089607 22.95567       11.11535 
1 1 1 -14 38 6  o 35.93220 5.985915 18.34083       5.057136 37.72576       9.039653 9.510118       6.101230 49.64407 7.723245 24.19870 8.431890 25.44537       11.43439 
1 1 1 -14 38 7  o 15.37514 6.909704 -0.2045939     5.404594 -4.512519      6.192689 13.56304       11.07069 14.06581 6.678821 26.57136 10.83674 -12.50555      12.72956 
1 1 1 -14 38 8  o 28.07415 6.945641 11.91892       4.725412 11.37729       7.358728 12.29900       6.164290 25.66209 9.229484 27.25961 8.427379 -1.597517      12.49816 
1 1 1 -14 38 9  o 17.96139 7.016560 4.047126       4.444643 6.458733       7.305037 2.629608       5.600586 21.41200 8.775915 17.53334 7.467123 3.878654       11.52279 
1 1 1 -14 38 10 o 17.61037 6.703166 4.009990       3.981505 -1.828381      7.228842 6.552366       4.770268 16.33059 7.580119 20.88724 7.440394 -4.556648      10.62157 
1 1 1 -14 38 11 o 15.03299 6.232050 1.908412       3.740002 -4.184833      6.569565 4.830092       4.549132 14.55676 6.902367 18.79795 7.162711 -4.241181      9.947216 
1 1 1 -14 38 12 o 18.92180 6.706004 5.157100       3.870592 11.71773       7.419495 2.704037       4.536867 25.59447 9.259292 16.56221 6.864781 9.032255       11.52648 
1 1 1 -14 38 13 o 18.31355 6.807631 4.683036       4.053697 -3.147142      7.075644 8.508797       4.945828 15.42574 7.268763 23.03752 7.595840 -7.611783      10.51341 
1 1 1 -14 38 14 o 44.74340 5.266411 27.87327       5.632373 0.000000       0.000000 27.87327       5.632373 ?        ?        44.74340 5.266411 0.000000       5.266411 
1 1 1 -14 38 15 o 18.69249 6.710421 5.099944       3.887949 4.507637       7.432971 5.323037       4.561762 19.57964 8.473733 19.10932 7.197366 0.4703121      11.11783 
1 1 1 -14 38 16 o 15.82190 6.566310 2.480614       4.158349 2.327752       7.471388 2.549217       5.005229 18.21409 8.159656 16.60906 7.065788 1.605022       10.79376 
1 1 1 -14 38 17 o 21.84521 7.465621 7.757796       4.774404 0.000000       0.000000 7.757796       4.774404 ?        ?        21.84521 7.465621 0.000000       7.465621 
1 1 1 -14 38 18 o 16.57769 7.031107 2.748932       4.930580 14.59497       8.048789 -4.366646      6.238053 26.90871 9.655653 13.77081 6.584407 13.13790       11.68700 
1 1 1 -14 38 19 o 27.48930 6.566535 11.72876       4.338323 4.747036       7.908203 14.73442       5.188795 19.46903 8.575493 30.32714 7.140090 -10.85812      11.15885 
1 1 1 -14 39 1  o 28.44682 5.034905 11.33516       3.362588 18.33868       5.060336 5.797488       4.499715 35.35437 6.093504 19.58103 7.191318 15.77334       9.425807 
1 1 1 -14 39 2  o 31.73918 5.315985 14.22920       3.966375 19.14230       7.218352 12.10415       4.747286 33.05089 8.804663 27.79734 7.010419 5.253550       11.25469 
1 1 1 -14 39 3  o 19.24614 6.039860 5.468712       3.153482 1.000391       4.466059 9.911663       4.453362 14.87871 6.502047 25.09580 7.012349 -10.21709      9.562931 
1 1 1 -14 39 4  o 22.33304 6.005621 7.412232       3.338963 13.83430       4.606599 0.3037249      4.846546 30.39443 6.420943 14.80471 6.606314 15.58972       9.212594 
1 1 1 -14 39 5  o 24.99330 6.450734 9.477074       3.955390 5.444620       6.554763 11.78632       4.960295 19.89894 8.249919 27.17984 7.324675 -7.280895      11.03232 
1 1 1 -14 39 6  o 20.50621 7.701091 6.478590       5.214374 15.47681       7.640221 -1.367246      7.134232 28.72848 9.439281 16.17684 7.516140 12.55164       12.06617 
1 1 1 -14 39 7  o 20.06845 7.255631 6.134295       4.554950 10.29126       7.684088 3.882275       5.655747 23.88514 9.255207 18.23254 7.619443 5.652597       11.98811 
1 1 1 -14 39 8  o 10.94137 5.132277 -2.428967      3.457736 -2.552544      5.697234 -2.356905      4.350629 14.12085 6.612181 12.44680 5.811897 1.674048       8.803356 
1 1 1 -14 39 9  o 9.643669 4.687813 -4.932127      3.491750 -5.220669      5.760885 -4.764568      4.390051 12.99132 6.242222 11.26231 5.421102 1.729015       8.267629 
1 1 1 -14 39 10 o 13.54189 5.985662 0.2567903      3.884908 -0.8437533     6.870231 0.7741128      4.710298 16.13213 7.453558 14.95625 6.601751 1.175884       9.956840 
1 1 1 -14 39 11 o 18.43705 6.670339 4.954058       3.850548 9.968873       7.241641 2.977348       4.546540 23.53698 9.020208 16.61547 6.878129 6.921507       11.34340 
1 1 1 -14 39 12 o 17.64132 6.773189 4.266400       4.088191 2.224880       6.883204 5.379080       5.081582 17.73020 7.894841 19.19855 7.501721 -1.468348      10.89056 
1 1 1 -14 39 13 o 27.67370 7.409004 12.46278       5.095532 0.000000       0.000000 12.46278       5.095532 ?        ?        27.67370 7.409004 0.000000       7.409004 
1 1 1 -14 39 14 o 17.78090 6.667845 4.515061       3.905992 -3.353209      6.898492 8.227882       4.738779 14.87716 7.059751 22.36008 7.437456 -7.482918      10.25455 
1 1 1 -14 39 15 f 10.00684 4.849729 -4.691225      3.663698 -6.958036      6.786222 -3.758752      4.352496 13.39789 6.517869 11.58672 5.529082 1.811162       8.547126 
1 1 1 -14 39 16 o 13.13845 5.856523 0.6577836E-01  3.798270 -2.324574      7.213116 0.9828864      4.467887 15.51111 7.318172 14.67252 6.454879 0.8385887      9.758130 
1 1 1 -14 40 1  o 28.41828 6.097108 12.17678       4.095882 12.93899       8.712351 11.96052       4.640698 24.80256 9.783113 27.32472 6.953233 -2.522161      12.00237 
1 1 1 -14 40 2  o 22.78831 6.081828 7.911868       3.440224 10.88241       5.107490 5.444951       4.654434 25.34167 7.639524 18.94099 7.238339 6.400679       10.52406 
1 1 1 -14 40 3  o 32.50045 5.169379 14.97869       3.957178 19.62918       5.828723 11.00248       5.389623 35.32959 7.017618 25.24957 7.892022 10.08002       10.56082 
1 1 1 -14 40 4  o 17.03930 6.098400 4.149748       3.208459 8.279879       4.532596 0.1893868E-02  4.542311 22.46664 7.262908 14.05372 6.323625 8.412921       9.630061 
1 1 1 -14 40 5  o 16.49027 6.950973 2.831061       4.770072 7.185216       7.015322 -0.9130159     6.505311 20.91760 8.589672 15.55981 7.211429 5.357796       11.21549 
1 1 1 -14 40 6  o 22.16732 7.147285 7.978058       4.391272 8.024491       6.920434 7.946761       5.681608 21.58693 8.652068 21.64281 8.056718 -0.5588531E-01 11.82239 
1 1 1 -14 40 7  o 19.35283 6.783865 5.770858       3.952831 8.464665       6.750903 4.365494       4.876105 21.96678 8.627820 17.95987 7.240171 4.006910       11.26319 
1 1 1 -14 40 8  o 14.08004 6.083344 1.133423       3.818045 5.267619       7.279112 -0.4356796     4.484443 19.60875 8.435222 13.68912 6.209417 5.919627       10.47425 
1 1 1 -14 40 9  o 11.13344 5.275646 -3.018255      3.825665 -1.268942      7.118413 -3.728722      4.536504 15.91011 7.430739 11.86645 5.657614 4.043658       9.339405 
1 1 1 -14 40 10 o 14.95519 6.182165 2.224976       3.665965 4.489942       6.476956 1.157358       4.446805 18.74173 8.007350 14.79183 6.475478 3.949904       10.29803 
1 1 1 -14 40 11 o 16.26785 6.533762 3.243469       3.955192 1.124590       7.400986 4.090540       4.679468 17.23775 7.879947 17.56154 7.088037 -0.3237858     10.59877 
1 1 1 -13 0  1  f 30.59336 5.029509 12.29177       3.445411 12.29177       3.445411 12.29177       3.445411 30.59336 5.029509 30.59336 5.029509 -0.000000      0.000000 
1 1 1 -13 0  2  o 613.8016 12.57190 4605.134       187.8684 4605.134       187.8684 4605.134       187.8684 613.8016 12.57190 613.8016 12.57190 -0.000000      0.000000 
1 1 1 -13 0  3  o 651.8643 13.31550 5194.965       211.3205 5194.965       211.3205 5194.965       211.3205 651.8643 13.31550 651.8643 13.31550 -0.000000      0.000000 
1 1 1 -13 0  4  o 336.0756 10.30891 1381.809       84.24792 1381.809       84.24792 1381.809       84.24792 336.0756 10.30891 336.0756 10.30891 -0.000000      0.000000 
1 1 1 -13 0  5  o 34.00990 5.123282 15.02394       3.961692 15.02394       3.961692 15.02394       3.961692 34.00990 5.123282 34.00990 5.123282 -0.000000      0.000000 
1 1 1 -13 0  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -13 0  7  o 596.7485 17.37152 4366.137       252.1340 4366.137       252.1340 4366.137       252.1340 596.7485 17.37152 596.7485 17.37152 -0.000000      0.000000 
1 1 1 -13 0  8  o 137.8085 5.670690 232.6652       18.97009 232.6652       18.97009 232.6652       18.97009 137.8085 5.670690 137.8085 5.670690 0.000000       0.000000 
1 1 1 -13 0  9  o 924.3279 18.73464 10471.85       421.6040 10471.85       421.6040 10471.85       421.6040 924.3279 18.73464 924.3279 18.73464 -0.000000      0.000000 
1 1 1 -13 0  10 o 392.6146 8.274866 1882.509       79.09116 1882.509       79.09116 1882.509       79.09116 392.6146 8.274866 392.6146 8.274866 0.000000       0.000000 
1 1 1 -13 0  11 o 308.8545 6.712969 1164.732       50.47093 1164.732       50.47093 1164.732       50.47093 308.8545 6.712969 308.8545 6.712969 -0.000000      0.000000 
1 1 1 -13 0  12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -13 0  13 o 945.1284 19.19910 10970.94       441.7771 10970.94       441.7771 10970.94       441.7771 945.1284 19.19910 945.1284 19.19910 -0.000000      0.000000 
1 1 1 -13 0  14 o 113.0086 5.301664 156.7206       14.52676 156.7206       14.52676 156.7206       14.52676 113.0086 5.301664 113.0086 5.301664 0.000000       0.000000 
1 1 1 -13 0  15 o 15.84562 7.900795 4.504684       3.708233 4.504684       3.708233 4.504684       3.708233 15.84562 7.900795 15.84562 7.900795 0.000000       0.000000 
1 1 1 -13 0  16 o 284.3465 6.278286 987.5816       43.45571 987.5816       43.45571 987.5816       43.45571 284.3465 6.278286 284.3465 6.278286 0.000000       0.000000 
1 1 1 -13 0  17 o 260.0410 5.854548 825.9957       37.05733 825.9957       37.05733 825.9957       37.05733 260.0410 5.854548 260.0410 5.854548 0.000000       0.000000 
1 1 1 -13 0  18 o 154.7994 4.187746 292.7826       15.77127 292.7826       15.77127 292.7826       15.77127 154.7994 4.187746 154.7994 4.187746 0.000000       0.000000 
1 1 1 -13 0  19 o 211.9216 5.058225 548.6700       26.08857 548.6700       26.08857 548.6700       26.08857 211.9216 5.058225 211.9216 5.058225 0.000000       0.000000 
1 1 1 -13 0  20 o 353.7212 7.594126 1530.300       65.39175 1530.300       65.39175 1530.300       65.39175 353.7212 7.594126 353.7212 7.594126 -0.000000      0.000000 
1 1 1 -13 0  21 o 98.23157 3.695488 118.1461       8.817781 118.1461       8.817781 118.1461       8.817781 98.23157 3.695488 98.23157 3.695488 0.000000       0.000000 
1 1 1 -13 0  22 o 77.10994 4.976502 73.43917       9.260759 73.43917       9.260759 73.43917       9.260759 77.10994 4.976502 77.10994 4.976502 0.000000       0.000000 
1 1 1 -13 0  23 o 107.3480 3.852283 141.0648       10.04792 141.0648       10.04792 141.0648       10.04792 107.3480 3.852283 107.3480 3.852283 0.000000       0.000000 
1 1 1 -13 0  24 o 245.1673 5.676972 734.9614       33.87578 734.9614       33.87578 734.9614       33.87578 245.1673 5.676972 245.1673 5.676972 -0.000000      0.000000 
1 1 1 -13 0  25 o 18.43239 8.327213 6.021767       4.020270 6.021767       4.020270 6.021767       4.020270 18.43239 8.327213 18.43239 8.327213 -0.000000      0.000000 
1 1 1 -13 0  26 o 264.6636 6.040757 857.0774       38.91441 857.0774       38.91441 857.0774       38.91441 264.6636 6.040757 264.6636 6.040757 0.000000       0.000000 
1 1 1 -13 0  27 o 42.29496 9.641171 25.02606       8.659229 25.02606       8.659229 25.02606       8.659229 42.29496 9.641171 42.29496 9.641171 0.000000       0.000000 
1 1 1 -13 0  28 o 68.78642 4.029494 58.32383       6.700912 58.32383       6.700912 58.32383       6.700912 68.78642 4.029494 68.78642 4.029494 -0.000000      0.000000 
1 1 1 -13 0  29 o 188.4112 4.849411 434.3683       22.23214 434.3683       22.23214 434.3683       22.23214 188.4112 4.849411 188.4112 4.849411 -0.000000      0.000000 
1 1 1 -13 0  30 o 75.09485 4.115443 69.44869       7.479120 69.44869       7.479120 69.44869       7.479120 75.09485 4.115443 75.09485 4.115443 -0.000000      0.000000 
1 1 1 -13 0  31 o 59.09244 4.586075 43.41220       6.510072 43.41220       6.510072 43.41220       6.510072 59.09244 4.586075 59.09244 4.586075 -0.000000      0.000000 
1 1 1 -13 0  32 o 198.7736 5.062490 483.9578       24.48623 483.9578       24.48623 483.9578       24.48623 198.7736 5.062490 198.7736 5.062490 -0.000000      0.000000 
1 1 1 -13 0  33 o 51.45819 4.957492 33.26456       6.075477 33.26456       6.075477 33.26456       6.075477 51.45819 4.957492 51.45819 4.957492 0.000000       0.000000 
1 1 1 -13 0  34 o 57.01257 6.208686 41.23344       8.366565 41.23344       8.366565 41.23344       8.366565 57.01257 6.208686 57.01257 6.208686 -0.000000      0.000000 
1 1 1 -13 0  35 f 42.70308 6.092438 23.68167       5.967029 23.68167       5.967029 23.68167       5.967029 42.70308 6.092438 42.70308 6.092438 0.000000       0.000000 
1 1 1 -13 0  36 o 12.68436 7.841005 1.498560       4.781270 1.498560       4.781270 1.498560       4.781270 12.68436 7.841005 12.68436 7.841005 -0.000000      0.000000 
1 1 1 -13 0  37 o 104.3491 4.240920 134.0312       10.74355 134.0312       10.74355 134.0312       10.74355 104.3491 4.240920 104.3491 4.240920 -0.000000      0.000000 
1 1 1 -13 0  38 o 80.77335 6.773417 82.48759       13.10887 82.48759       13.10887 82.48759       13.10887 80.77335 6.773417 80.77335 6.773417 0.000000       0.000000 
1 1 1 -13 0  39 o 67.73206 4.511472 57.16291       7.369490 57.16291       7.369490 57.16291       7.369490 67.73206 4.511472 67.73206 4.511472 -0.000000      0.000000 
1 1 1 -13 0  40 o 14.13972 8.298454 3.092242       4.819105 3.092242       4.819105 3.092242       4.819105 14.13972 8.298454 14.13972 8.298454 -0.000000      0.000000 
1 1 1 -13 0  41 o 12.10812 7.649383 1.052164       4.815643 1.052164       4.815643 1.052164       4.815643 12.10812 7.649383 12.10812 7.649383 -0.000000      0.000000 
1 1 1 -13 0  42 o 12.70431 7.910087 1.696702       4.953282 1.696702       4.953282 1.696702       4.953282 12.70431 7.910087 12.70431 7.910087 -0.000000      0.000000 
1 1 1 -13 0  43 o 15.07681 8.632019 4.153378       5.015920 4.153378       5.015920 4.153378       5.015920 15.07681 8.632019 15.07681 8.632019 -0.000000      0.000000 
1 1 1 -13 0  44 o 23.36863 9.909510 10.49900       5.716284 10.49900       5.716284 10.49900       5.716284 23.36863 9.909510 23.36863 9.909510 0.000000       0.000000 
1 1 1 -13 0  45 o 15.65166 8.978251 4.955286       5.441389 4.955286       5.441389 4.955286       5.441389 15.65166 8.978251 15.65166 8.978251 -0.000000      0.000000 
1 1 1 -13 0  46 o 21.61967 9.793944 9.732498       5.561999 9.732498       5.561999 9.732498       5.561999 21.61967 9.793944 21.61967 9.793944 0.000000       0.000000 
1 1 1 -13 0  47 o 46.43808 11.09681 37.14284       10.89462 37.14284       10.89462 37.14284       10.89462 46.43808 11.09681 46.43808 11.09681 -0.000000      0.000000 
1 1 1 -13 0  48 o 10.10969 6.826651 -0.7034900     4.902554 -0.7034900     4.902554 -0.7034900     4.902554 10.10969 6.826651 10.10969 6.826651 -0.000000      0.000000 
1 1 1 -13 0  49 o 14.45089 9.500413 4.034714       8.463813 4.034714       8.463813 4.034714       8.463813 14.45089 9.500413 14.45089 9.500413 0.000000       0.000000 
1 1 1 -13 0  50 o 13.85240 8.429291 4.537534       5.330343 4.537534       5.330343 4.537534       5.330343 13.85240 8.429291 13.85240 8.429291 -0.000000      0.000000 
1 1 1 -13 1  1  o 147.4649 3.389731 265.0388       12.18120 267.7169       14.84122 259.5104       21.32334 148.1408 4.115092 145.7496 6.016535 2.391190       7.289217 
1 1 1 -13 1  2  o 761.3062 9.772880 7078.523       181.3085 6930.702       282.3242 7182.278       236.5291 752.0092 15.40596 766.2559 12.66703 -14.24670      19.94486 
1 1 1 -13 1  3  o 183.2834 3.764158 409.4499       16.81230 423.3351       20.83861 383.5604       28.45475 186.3498 4.588848 177.2090 6.600739 9.140762       8.039109 
1 1 1 -13 1  4  o 653.7780 9.420059 5219.008       150.0790 5279.758       213.9714 5160.181       210.5574 656.8668 13.36726 649.3986 13.30525 7.468262       18.86036 
1 1 1 -13 1  5  o 306.6846 4.710922 1146.625       35.20741 1141.630       49.71667 1151.650       49.86525 305.9341 6.668652 307.2743 6.659410 -1.340149      9.424365 
1 1 1 -13 1  6  o 576.4907 11.83698 4063.212       166.2912 4046.759       234.6640 4079.809       235.6818 574.0953 16.79165 576.4357 16.79587 -2.340393      23.74996 
1 1 1 -13 1  7  o 179.6694 3.674954 393.4598       16.09023 407.1732       20.01171 368.3822       27.06178 182.7585 4.493353 173.6723 6.405221 9.086121       7.824135 
1 1 1 -13 1  8  o 349.6410 6.086333 1490.957       51.85781 1381.518       85.99377 1553.500       65.00837 336.0839 10.51278 356.8125 7.476409 -20.72864      12.90020 
1 1 1 -13 1  9  o 549.0627 7.967862 3679.533       106.6105 3723.837       152.1619 3636.814       149.4156 551.8795 11.31425 545.4048 11.24193 6.474670       15.94971 
1 1 1 -13 1  10 o 658.5086 9.485818 5297.151       152.2202 5184.625       212.1943 5416.452       218.4875 650.6524 13.38285 665.0149 13.48215 -14.36249      18.99655 
1 1 1 -13 1  11 o 610.7809 8.828767 4556.339       131.4079 4523.791       184.8941 4589.562       186.7983 607.8705 12.48176 612.2646 12.51981 -4.394043      17.67880 
1 1 1 -13 1  12 o 311.5634 4.771500 1183.669       36.22743 1125.934       49.71332 1249.047       52.90187 303.7565 6.716005 319.9276 6.785521 -16.17105      9.547148 
1 1 1 -13 1  13 o 484.9884 8.195345 2873.065       96.85781 2798.963       164.7632 2912.196       119.7310 477.3104 14.18094 487.9723 10.06874 -10.66187      17.39191 
1 1 1 -13 1  14 o 142.1756 3.241476 246.4018       11.23062 227.9642       19.00396 256.2965       13.92170 136.5710 5.722860 144.9334 3.945406 -8.362442      6.951069 
1 1 1 -13 1  15 o 211.6577 4.092177 546.2713       21.10691 531.8631       25.54048 577.3082       37.48551 208.8073 5.019348 217.3056 7.088230 -8.498367      8.685439 
1 1 1 -13 1  16 o 253.1262 4.042169 781.3510       24.93376 813.8901       36.17940 751.9161       34.41039 258.2320 5.749303 248.2101 5.688975 10.02184       8.088196 
1 1 1 -13 1  17 o 238.1905 3.863361 691.8811       22.42466 666.1096       31.11228 719.7446       32.35045 233.6109 5.465157 242.8339 5.466822 -9.222946      7.730076 
1 1 1 -13 1  18 o 82.49486 2.520264 83.03223       5.060568 73.19772       7.022425 93.65676       7.299037 77.38235 3.735024 87.57228 3.426904 -10.18993      5.068933 
1 1 1 -13 1  19 o 220.4204 3.668571 592.5824       19.70538 613.9039       28.46618 572.9644       27.30530 224.2357 5.209406 216.6331 5.172328 7.602661       7.341041 
1 1 1 -13 1  20 o 172.3423 3.142893 362.2031       13.19950 390.4112       19.41295 337.9496       18.00077 178.8523 4.454109 166.3439 4.444650 12.50841       6.292377 
1 1 1 -13 1  21 o 122.3585 2.733412 182.5484       8.150331 178.2197       11.51418 186.8953       11.53848 120.7914 3.916836 123.7059 3.832180 -2.914520      5.479709 
1 1 1 -13 1  22 o 289.9389 6.384391 1028.550       45.10889 1067.703       65.28897 992.7900       62.39648 294.6378 9.104094 284.1271 9.023235 10.51062       12.81808 
1 1 1 -13 1  23 o 220.5912 3.707824 593.8027       19.93165 581.4156       27.92340 606.6698       28.45947 218.1115 5.253560 222.7996 5.241751 -4.688065      7.421309 
1 1 1 -13 1  24 o 202.2197 3.507099 498.9940       17.28253 486.1108       24.15670 512.5024       24.73598 199.4435 4.970289 204.7876 4.956663 -5.344147      7.019422 
1 1 1 -13 1  25 o 185.5086 3.339160 419.9337       15.09514 444.9554       22.03978 397.8251       20.71708 190.8113 4.739877 180.3645 4.717524 10.44678       6.687411 
1 1 1 -13 1  26 o 136.1817 2.910906 226.2458       9.660133 217.9607       13.52712 234.8685       13.79995 133.5146 4.162664 138.6094 4.090008 -5.094803      5.835747 
1 1 1 -13 1  27 o 266.3591 6.175560 869.7529       40.08482 887.1579       57.62614 853.4363       55.79519 268.0178 8.835146 262.9148 8.720613 5.103027       12.41406 
1 1 1 -13 1  28 o 65.08917 2.924444 51.80209       4.626766 44.28702       6.412916 59.96066       6.681836 60.02538 4.415033 69.94546 3.936008 -9.920078      5.914784 
1 1 1 -13 1  29 o 76.53986 2.840168 71.58976       5.288274 72.80705       7.481005 70.37393       7.476494 77.07955 3.996413 75.76968 4.064044 1.309875       5.699804 
1 1 1 -13 1  30 o 61.60457 3.049953 46.44476       4.564463 41.74616       6.373160 51.39310       6.540338 58.23492 4.526440 64.69448 4.170777 -6.459560      6.155002 
1 1 1 -13 1  31 o 164.6981 3.226912 331.3121       12.95126 319.4002       17.99834 344.1032       18.65077 161.4482 4.579331 167.5817 4.571302 -6.133469      6.470477 
1 1 1 -13 1  32 o 106.4733 2.901610 138.5354       7.521610 146.2279       10.77357 131.2206       10.50581 109.2416 4.054053 103.4580 4.175635 5.783615       5.819903 
1 1 1 -13 1  33 o 24.38393 5.998826 7.609955       3.539695 7.011752       5.039723 8.192358       4.972719 23.99822 7.648776 25.50012 7.502182 -1.501898      10.71385 
1 1 1 -13 1  34 f 37.27816 5.430337 17.44585       4.788194 12.66862       6.418243 23.44171       7.190413 31.32914 8.282298 42.95962 7.117421 -11.63048      10.92035 
1 1 1 -13 1  35 o 88.82142 2.981737 96.57518       6.444764 101.0718       9.156760 92.16106       9.072371 90.67210 4.155163 86.54355 4.315412 4.128548       5.990673 
1 1 1 -13 1  36 o 115.9976 2.978988 164.7529       8.413840 163.3954       11.87117 166.1233       11.92696 115.2313 4.234735 116.1946 4.219194 -0.9633255     5.977841 
1 1 1 -13 1  37 o 15.51079 6.074891 1.829340       3.338814 1.166196       4.635579 2.544220       4.813009 16.84501 6.956482 18.43950 7.271975 -1.594486      10.06351 
1 1 1 -13 1  38 o 109.5501 4.595442 148.8108       12.24083 147.0786       17.39903 150.5084       17.22458 107.8947 6.649729 109.2356 6.500049 -1.340881      9.298900 
1 1 1 -13 1  39 o 87.92002 2.992928 95.08894       6.403044 94.91493       9.006051 95.26679       9.105307 87.42318 4.240028 87.56992 4.279774 -0.1467438     6.024475 
1 1 1 -13 1  40 o 20.06265 6.304069 5.130137       3.434338 3.502405       4.822360 6.805335       4.892167 19.14054 7.354353 23.07167 7.551774 -3.931129      10.54115 
1 1 1 -13 1  41 o 82.86037 3.067273 84.98238       6.182800 80.85217       8.534042 89.54515       8.969825 80.16899 4.384995 84.38453 4.376953 -4.215538      6.195635 
1 1 1 -13 1  42 o 23.55062 6.228487 7.529697       3.628826 2.116754       4.951673 13.80947       5.333436 17.55744 7.213913 31.61359 7.097405 -14.05615      10.11997 
1 1 1 -13 1  43 f 21.08498 6.539795 6.086153       3.708672 1.509001       5.230534 10.71378       5.259293 17.12052 7.250724 27.24539 7.623227 -10.12487      10.52077 
1 1 1 -13 1  44 o 30.33216 6.250237 12.93317       4.466192 12.89376       5.633851 12.99981       7.326948 29.27755 7.768929 28.42365 9.237779 0.8538914      12.07033 
1 1 1 -13 1  45 o 24.15947 6.359804 8.533753       3.794782 4.158827       5.219860 13.43783       5.526525 18.72585 7.511165 29.45543 7.636531 -10.72958      10.71141 
1 1 1 -13 1  46 o 33.07465 5.298000 15.28754       4.126065 21.31051       5.991325 9.854111       5.690559 37.74406 6.762225 24.35076 8.151316 13.39330       10.59111 
1 1 1 -13 1  47 o 20.81070 8.085649 7.184302       5.876838 9.264954       8.483340 5.264445       8.148950 22.35907 9.336926 19.83489 8.721989 2.524181       12.77698 
1 1 1 -13 1  48 o 12.04856 5.652021 -2.009765      4.194772 -3.249153      5.129156 0.4934582      7.289404 12.61810 6.015938 16.27952 7.575236 -3.661427      9.673454 
1 1 1 -13 1  49 o 16.25542 6.543755 3.893606       3.977031 4.823650       5.713604 3.019476       5.539193 17.56555 7.513166 16.20482 7.155715 1.360727       10.37554 
1 1 1 -13 1  50 o 18.81809 7.297494 6.659920       4.779966 9.584523       7.977833 5.022047       5.970238 20.08146 8.734232 17.33084 7.546587 2.750628       11.54287 
1 1 1 -13 2  1  o 694.0991 8.938093 5882.195       151.1828 5673.993       233.0302 6033.521       198.6672 680.6802 14.04860 702.4774 11.60534 -21.79712      18.22216 
1 1 1 -13 2  2  o 287.4749 5.178607 1007.621       36.27847 977.2418       43.59435 1076.044       65.42538 283.0617 6.319941 296.7330 9.058435 -13.67130      11.04522 
1 1 1 -13 2  3  o 446.0720 6.566453 2427.035       71.37923 2420.579       100.8526 2433.515       101.0386 445.2417 9.295122 446.4307 9.287468 -1.188995      13.13988 
1 1 1 -13 2  4  o 217.9113 3.620331 578.7678       19.22490 565.3514       26.96022 592.6475       27.42188 215.3359 5.137726 220.4739 5.103920 -5.138016      7.241977 
1 1 1 -13 2  5  o 195.0427 4.807383 463.7787       22.84938 461.6227       32.67854 465.8412       31.96120 194.4080 6.908813 195.3077 6.725369 -0.8997192     9.641696 
1 1 1 -13 2  6  o 325.0200 5.719363 1288.184       45.29955 1351.659       57.16512 1181.049       74.26662 332.8617 7.047437 310.8127 9.817567 22.04901       12.08516 
1 1 1 -13 2  7  f 570.6584 9.566402 3977.080       133.0335 4579.277       254.3689 3750.350       156.0810 610.5540 17.11325 553.8579 11.56420 56.69604       20.65415 
1 1 1 -13 2  8  o 233.4972 3.788115 664.5583       21.55465 675.3278       30.89885 654.3500       30.08326 235.3363 5.387873 231.6542 5.329036 3.682083       7.578114 
1 1 1 -13 2  9  o 369.6097 6.391719 1666.401       57.57012 1644.079       99.35509 1677.683       70.63677 366.5409 11.13616 370.7558 7.818201 -4.214935      13.60656 
1 1 1 -13 2  10 o 245.9883 3.939956 737.6180       23.61794 752.4937       33.92532 723.6280       32.89990 248.3989 5.604517 243.5905 5.542404 4.808426       7.882185 
1 1 1 -13 2  11 o 245.9874 3.940334 737.6386       23.62012 780.3979       34.64180 700.4885       32.28985 252.9529 5.619851 239.6564 5.528929 13.29651       7.883640 
1 1 1 -13 2  12 o 398.2218 6.827477 1935.303       66.25542 2012.796       117.7178 1899.373       80.15696 405.2803 11.93229 394.3531 8.341033 10.92719       14.55858 
1 1 1 -13 2  13 o 277.3966 5.005188 938.4673       33.83434 842.1212       55.10254 996.7766       42.86698 262.3867 8.629485 285.8152 6.154623 -23.42850      10.59941 
1 1 1 -13 2  14 o 337.1774 5.898784 1387.258       48.46822 1354.277       82.99144 1404.330       59.70883 332.4990 10.25478 339.1219 7.225146 -6.622955      12.54445 
1 1 1 -13 2  15 o 482.9275 8.175515 2850.533       96.21288 2919.551       119.7935 2725.102       161.4938 488.3463 10.06628 470.5320 14.10006 17.81430       17.32460 
1 1 1 -13 2  16 o 83.77028 2.941238 85.64804       5.994899 83.74352       7.427824 89.20670       10.15340 82.79179 3.690893 85.37104 4.901101 -2.579254      6.135428 
1 1 1 -13 2  17 o 117.1401 3.074874 167.4010       8.769871 169.5717       10.84865 163.3074       14.89811 117.8602 3.782118 115.5539 5.304822 2.306351       6.515025 
1 1 1 -13 2  18 o 388.0341 5.802599 1838.774       54.86919 1781.347       76.13110 1900.845       79.15044 381.4995 8.189021 394.0764 8.242081 -12.57687      11.61860 
1 1 1 -13 2  19 o 155.8083 2.979820 295.9928       11.31402 284.4333       15.91327 307.8091       16.08905 152.6207 4.282914 158.7825 4.161655 -6.161774      5.971828 
1 1 1 -13 2  20 o 144.5218 2.878951 254.6717       10.13920 255.5416       14.50832 253.8413       14.17546 144.6564 4.119894 144.1803 4.038528 0.4760590      5.769163 
1 1 1 -13 2  21 o 372.6055 5.615342 1696.672       50.98725 1629.047       70.33849 1771.551       74.01568 364.5696 7.917289 380.1605 7.989520 -15.59088      11.24793 
1 1 1 -13 2  22 o 120.4474 3.743129 177.1920       10.97339 176.5346       15.51626 177.8497       15.52117 120.0771 5.315797 120.5264 5.297468 -0.4492874     7.504723 
1 1 1 -13 2  23 o 96.05988 2.976648 112.6507       6.959550 107.7620       11.54098 115.4444       8.724315 93.77385 5.069234 97.19481 3.690130 -3.420959      6.270103 
1 1 1 -13 2  24 o 93.45788 2.655716 106.6005       6.042171 108.7424       8.672125 104.5798       8.423154 94.31336 3.780919 92.49065 3.744896 1.822716       5.321616 
1 1 1 -13 2  25 f 167.6845 3.161876 343.0653       12.92034 347.7762       18.49891 338.5786       18.05347 168.6554 4.505043 166.4149 4.455776 2.240524       6.336351 
1 1 1 -13 2  26 o 131.6372 2.884244 211.3944       9.252235 212.2684       13.23302 210.5585       12.94113 131.7608 4.126411 131.2367 4.051363 0.5240479      5.782804 
1 1 1 -13 2  27 o 147.2532 4.429195 265.2764       15.87566 279.5358       23.45638 253.2231       21.56573 150.8356 6.395992 143.5888 6.177670 7.246780       8.892262 
1 1 1 -13 2  28 o 104.6962 2.789890 133.8359       7.111595 131.2335       10.03444 136.4621       10.08035 103.5602 3.983590 105.6126 3.923551 -2.052429      5.591354 
1 1 1 -13 2  29 o 16.69561 5.964008 2.911988       3.067098 9.865208       4.327582 -4.105544      4.347549 27.79039 6.505726 12.49709 5.826907 15.29330       8.733689 
1 1 1 -13 2  30 o 97.27892 2.837532 115.5980       6.719412 117.9565       9.575393 113.3099       9.431607 98.14334 4.012142 96.18505 4.032800 1.958290       5.688652 
1 1 1 -13 2  31 o 24.54128 5.877470 7.692745       3.468572 8.440560       4.871201 6.923617       4.940129 25.83963 7.373641 23.86779 7.568823 1.971838       10.56682 
1 1 1 -13 2  32 o 99.39725 2.874778 120.7418       6.955979 119.4405       9.876805 122.0225       9.798146 98.70451 4.115259 99.77876 4.038014 -1.074249      5.765493 
1 1 1 -13 2  33 o 60.97105 3.208572 45.55852       4.750511 51.55648       6.804794 39.85632       6.634900 64.72485 4.339346 56.79437 4.840017 7.930473       6.500438 
1 1 1 -13 2  34 o 44.12274 4.847287 24.18936       5.126186 15.94484       6.866709 34.56824       7.704440 35.09980 8.180010 52.59067 6.126259 -17.49087      10.21977 
1 1 1 -13 2  35 o 43.78866 3.831657 23.67759       4.047538 27.22377       5.833361 20.38522       5.620725 46.73361 5.210700 40.21103 5.912406 6.522583       7.880859 
1 1 1 -13 2  36 o 22.64263 6.144421 6.571301       3.476085 4.425526       4.838222 8.860682       4.997499 20.56969 7.472060 26.26497 7.459930 -5.695276      10.55851 
1 1 1 -13 2  37 o 107.8794 2.958252 142.6539       7.769618 145.5921       11.06787 139.7990       10.90964 108.6618 4.187592 106.4671 4.213249 2.194710       5.940319 
1 1 1 -13 2  38 o 83.02062 4.761961 85.70184       9.593614 72.11387       13.55744 99.32990       13.57742 75.00081 7.519110 88.73942 6.319990 -13.73861      9.822387 
1 1 1 -13 2  39 o 63.54298 3.187874 49.79604       4.920571 49.39053       6.935847 50.20694       6.981859 62.89171 4.556433 63.41463 4.548196 -0.5229187     6.437948 
1 1 1 -13 2  40 o 102.2549 3.001513 128.9192       7.471193 125.9566       10.38566 132.0968       10.75579 100.4794 4.251121 102.8758 4.299833 -2.396408      6.046535 
1 1 1 -13 2  41 o 37.97827 4.132747 18.23618       3.763197 13.55516       5.228980 23.26562       5.420094 31.64045 6.970240 42.46797 5.356221 -10.82751      8.790525 
1 1 1 -13 2  42 o 24.65875 6.081807 8.242196       3.631436 11.15509       5.105224 5.258873       5.166577 28.25885 7.346409 20.91619 7.701696 7.342655       10.64358 
1 1 1 -13 2  43 o 21.88131 6.632096 6.622779       3.841907 5.572621       5.841730 7.423200       5.100037 21.32291 8.118705 23.06631 7.716721 -1.743395      11.20094 
1 1 1 -13 2  44 o 67.10618 3.843179 57.64083       6.258486 53.66898       7.810816 64.76402       10.46014 63.62104 5.080188 68.41732 6.346197 -4.796276      8.129116 
1 1 1 -13 2  45 o 19.26451 6.469531 5.265855       3.584352 6.414743       5.069611 4.117486       5.068468 20.97606 7.644339 18.57493 7.418072 2.401133       10.65193 
1 1 1 -13 2  46 o 21.65149 6.433376 7.052855       3.641947 2.638399       5.255620 11.13095       5.051427 17.06407 7.249151 26.37413 7.503117 -9.310059      10.43297 
1 1 1 -13 2  47 o 23.84479 8.332703 10.21557       5.960979 7.661025       8.212828 13.05953       8.665579 21.26831 9.049547 24.98965 9.786967 -3.721338      13.32963 
1 1 1 -13 2  48 o 14.96319 6.255910 2.438020       3.815129 2.970720       5.556510 1.962912       5.247550 16.59215 7.251637 15.68346 6.943278 0.9086905      10.03969 
1 1 1 -13 2  49 o 9.342089 4.595868 -5.644551      3.667480 -9.120695      5.059931 -1.797143      5.323286 10.21992 5.091826 13.24824 6.261492 -3.028323      8.070500 
1 1 1 -13 3  1  o 414.4325 6.165780 2094.842       62.26986 2024.882       85.94049 2172.167       90.35070 407.2541 8.659570 421.7927 8.790152 -14.53864      12.33916 
1 1 1 -13 3  2  o 577.3627 8.367046 4068.983       117.7218 4085.372       166.9927 4052.792       165.9796 578.0005 11.85586 575.6954 11.83112 2.305054       16.74924 
1 1 1 -13 3  3  o 183.0580 3.265777 408.4140       14.56838 404.2630       20.37989 412.7517       20.83319 182.0433 4.597681 183.9433 4.651406 -1.900040      6.540202 
1 1 1 -13 3  4  o 325.3478 5.734441 1290.804       45.46477 1300.549       56.04484 1272.047       77.75221 326.5051 7.043841 322.5608 9.903297 3.944305       12.15282 
1 1 1 -13 3  5  o 160.3217 3.474283 313.2730       13.57356 326.5802       17.06791 290.3749       22.38906 163.6225 4.284253 154.1905 5.969852 9.432022       7.348058 
1 1 1 -13 3  6  o 487.1594 7.120270 2895.409       84.52860 2993.402       122.3802 2806.008       116.8916 495.0052 10.14531 479.2774 10.00830 15.72781       14.25108 
1 1 1 -13 3  7  o 407.0738 6.036476 2021.000       59.88151 1982.558       83.81207 2061.086       85.58630 402.9921 8.534419 410.8946 8.547473 -7.902557      12.07872 
1 1 1 -13 3  8  o 394.3535 6.776823 1897.219       65.12502 1892.286       113.2873 1899.653       79.59085 393.1638 11.83768 394.4857 8.279341 -1.321930      14.44569 
1 1 1 -13 3  9  o 298.6074 5.323209 1087.317       38.73558 1071.351       67.17280 1095.271       47.41272 296.0157 9.323619 299.6389 6.493227 -3.623230      11.36186 
1 1 1 -13 3  10 o 685.7339 9.870332 5746.352       164.9391 5774.913       234.1599 5718.227       232.3685 686.4192 13.99868 683.0530 13.96004 3.366150       19.76982 
1 1 1 -13 3  11 o 350.1443 5.288167 1495.185       45.12200 1525.324       65.07798 1467.281       62.61740 353.4887 7.554791 346.7099 7.411272 6.778809       10.58309 
1 1 1 -13 3  12 o 328.4853 4.997632 1315.898       40.00518 1310.691       56.66668 1321.073       56.48550 327.6874 7.096300 328.9868 7.045671 -1.299438      9.999948 
1 1 1 -13 3  13 o 145.2441 3.254451 257.1478       11.51893 284.7873       21.31152 245.7406       13.69114 152.6767 5.738246 141.9166 3.962740 10.76007       6.973577 
1 1 1 -13 3  14 o 451.8619 6.651391 2492.585       73.24100 2578.444       106.1128 2414.465       101.2174 459.1243 9.484211 444.3099 9.348310 14.81442       13.31695 
1 1 1 -13 3  15 o 51.99010 3.293518 33.08345       4.151249 30.89147       5.323946 36.48299       6.630181 50.13618 4.402238 54.45281 5.054224 -4.316635      6.702602 
1 1 1 -13 3  16 o 254.2526 4.062842 788.3588       25.17279 829.7476       36.86541 752.2033       34.45601 260.7206 5.802399 248.2472 5.695667 12.47343       8.130711 
1 1 1 -13 3  17 o 151.8885 2.928534 281.2436       10.83955 271.2258       15.34930 291.2097       15.30965 149.0568 4.229997 154.4652 4.070777 -5.408401      5.870613 
1 1 1 -13 3  18 o 321.8893 5.705032 1265.307       44.75080 1277.800       55.24748 1241.470       76.31168 323.2892 7.012699 317.9847 9.859929 5.304504       12.09943 
1 1 1 -13 3  19 o 167.8288 3.096032 343.4502       12.66217 345.8587       18.24277 341.2112       17.58913 168.2905 4.452220 167.1661 4.321400 1.124435       6.204576 
1 1 1 -13 3  20 o 173.7779 3.167374 368.2774       13.41313 377.4295       19.39480 359.8870       18.57012 175.7856 4.531358 171.6572 4.443056 4.128357       6.346176 
1 1 1 -13 3  21 o 77.40199 2.611549 73.12867       4.918854 70.54955       7.057807 75.56458       6.859070 75.94363 3.825988 78.62077 3.589542 -2.677147      5.246237 
1 1 1 -13 3  22 o 177.9152 3.741975 386.2471       16.22371 387.3123       20.13281 384.2742       27.39838 178.0302 4.644571 177.1044 6.358647 0.9257813      7.874290 
1 1 1 -13 3  23 o 231.7673 4.401724 655.9329       24.86057 678.5708       43.69596 645.0977       30.23017 235.0961 7.637240 229.7185 5.400183 5.377640       9.353578 
1 1 1 -13 3  24 o 91.40751 2.659606 101.9800       5.917975 99.47842       8.511242 104.3213       8.234196 90.19014 3.881644 92.38142 3.664909 -2.191277      5.338419 
1 1 1 -13 3  25 o 133.8829 2.879293 218.6487       9.393924 221.9763       13.58208 215.5970       13.00663 134.7535 4.141005 132.8135 4.023348 1.940002       5.773669 
1 1 1 -13 3  26 o 206.5288 3.588091 520.7102       18.05844 499.1285       25.18966 543.5302       25.90222 201.9395 5.122896 210.8100 5.042079 -8.870453      7.187951 
1 1 1 -13 3  27 o 90.74185 4.172155 100.8236       9.201113 93.00107       13.52026 107.5718       12.55767 86.83947 6.434704 93.56625 5.532181 -6.726784      8.485896 
1 1 1 -13 3  28 f 70.62767 2.870327 60.96875       4.929883 64.52762       7.094819 57.64624       6.855172 72.55711 4.028408 68.55658 4.122342 4.000526       5.763833 
1 1 1 -13 3  29 o 85.70235 2.790147 89.72439       5.819380 89.25098       8.372057 90.16694       8.094646 85.35567 4.036415 85.81084 3.881013 -0.4551620     5.599545 
1 1 1 -13 3  30 o 83.50449 2.836237 85.20563       5.763119 82.63824       8.159585 87.76134       8.141009 82.10730 4.090913 84.63596 3.958146 -2.528664      5.692318 
1 1 1 -13 3  31 o 62.25550 3.149043 47.45499       4.761894 45.04925       6.724700 49.87457       6.744011 60.48213 4.597004 63.68694 4.371942 -3.204803      6.343998 
1 1 1 -13 3  32 f 105.0627 2.884865 134.8927       7.379020 138.7874       10.66405 131.3150       10.22106 106.4076 4.120360 103.5082 4.060020 2.899429       5.784560 
1 1 1 -13 3  33 f 28.90370 5.403929 10.59380       3.666364 12.42304       5.138062 8.696116       5.233293 31.10834 6.952866 26.24160 7.689718 4.866741       10.36697 
1 1 1 -13 3  34 o 52.34991 4.402067 33.84660       5.563787 31.18863       7.607843 36.90265       8.157667 49.85075 6.410823 54.31993 6.278105 -4.469181      8.972919 
1 1 1 -13 3  35 o 24.40195 6.039885 7.651161       3.572117 10.32718       5.119089 5.111491       4.986974 28.28066 7.358521 21.55608 7.614493 6.724588       10.58907 
1 1 1 -13 3  36 o 99.54969 2.981500 121.3886       7.224720 126.5304       10.37725 116.5520       10.06452 101.3756 4.209775 97.27800 4.255931 4.097603       5.986248 
1 1 1 -13 3  37 o 61.51705 3.251400 46.53594       4.856877 50.22331       6.874509 42.86108       6.862828 63.66483 4.459241 58.69921 4.840705 4.965618       6.581584 
1 1 1 -13 3  38 o 28.71815 8.033185 10.87318       5.840987 21.76809       9.464808 4.171650       7.423125 40.05723 9.782027 22.73910 9.011072 17.31813       13.29991 
1 1 1 -13 3  39 o 84.59270 2.981847 88.05381       6.137260 89.35791       8.770728 86.80265       8.590859 84.78901 4.258459 83.57523 4.231933 1.213783       6.003643 
1 1 1 -13 3  40 f 15.94406 6.003130 2.495737       3.172914 -0.4514785     4.453080 5.534982       4.522071 14.91286 6.505244 21.23388 7.265424 -6.321017      9.752158 
1 1 1 -13 3  41 o 27.23473 5.434526 9.755956       3.480321 9.204514       4.788741 10.37331       5.066862 25.98646 7.275381 27.51117 7.398144 -1.524712      10.37611 
1 1 1 -13 3  42 o 56.37675 3.464638 39.80718       4.736868 43.82721       6.675644 35.73053       6.722487 58.50068 4.722812 52.43584 5.335189 6.064846       7.125251 
1 1 1 -13 3  43 o 34.78824 5.416755 16.14116       4.442618 8.289182       6.751964 22.13575       5.899574 24.32796 8.828472 40.34637 6.198353 -16.01841      10.78710 
1 1 1 -13 3  44 o 47.71681 4.420215 29.71654       5.081439 25.11175       6.357511 37.86212       8.455573 42.40411 6.347291 51.62926 6.892691 -9.225143      9.370021 
1 1 1 -13 3  45 o 17.79423 6.321369 4.277942       3.441111 5.058425       5.025319 3.588896       4.721782 19.47040 7.500654 17.79635 7.141936 1.674046       10.35698 
1 1 1 -13 3  46 o 16.83843 6.457623 3.625803       3.713260 5.245961       5.139266 1.856184       5.371087 19.31649 7.545232 16.53416 7.179208 2.782330       10.41497 
1 1 1 -13 3  47 o 12.00773 5.780177 -4.756299      4.992234 -4.249903      7.044561 -5.267185      7.075714 14.54910 6.967451 14.20777 6.849845 0.3413258      9.770658 
1 1 1 -13 3  48 o 15.62247 6.418087 3.040298       3.918789 3.675769       5.369836 2.316251       5.731870 16.98470 7.274608 16.21943 7.214330 0.7652683      10.24531 
1 1 1 -13 3  49 o 11.73232 5.449770 -1.168138      3.747150 -0.7253763     5.336734 -1.598681      5.262586 13.78404 6.436516 13.27035 6.257892 0.5136948      8.977191 
1 1 1 -13 4  1  o 508.7658 8.582293 3160.293       106.4038 3186.474       131.0895 3109.732       182.1700 510.6053 10.53529 503.4401 14.86513 7.165283       18.21990 
1 1 1 -13 4  2  o 730.3553 10.52252 6518.796       187.2795 6083.249       251.9620 7056.477       279.9497 704.5457 14.67540 758.6727 15.14222 -54.12701      21.08682 
1 1 1 -13 4  3  o 580.7054 8.425533 4116.541       119.2310 4179.541       170.2704 4055.928       167.0132 584.5779 11.95255 575.8778 11.90102 8.700134       16.86706 
1 1 1 -13 4  4  o 400.2601 5.955126 1953.866       58.08572 2037.646       84.50414 1878.827       79.97414 408.5556 8.487714 392.3213 8.365108 16.23428       11.91706 
1 1 1 -13 4  5  o 238.2348 3.865772 691.8108       22.44283 690.3461       31.92188 693.2424       31.55912 237.9344 5.505480 238.4355 5.431477 -0.5011292     7.733773 
1 1 1 -13 4  6  o 487.5548 7.133192 2900.293       84.75072 2951.997       121.4487 2851.215       118.3237 491.5418 10.13902 483.0896 10.05097 8.452209       14.27661 
1 1 1 -13 4  7  o 435.2568 6.420355 2310.927       68.09901 2267.894       95.28900 2355.849       97.35738 430.9435 9.073740 439.2182 9.096042 -8.274658      12.84799 
1 1 1 -13 4  8  o 353.3691 5.327994 1522.692       45.88052 1494.946       64.41309 1551.266       65.36715 349.9930 7.552289 356.5270 7.523693 -6.533936      10.66035 
1 1 1 -13 4  9  o 416.7623 8.710060 2121.109       88.45975 0.000000       0.000000 2121.109       88.45975 ?        ?        416.7623 8.710060 0.000000       8.710060 
1 1 1 -13 4  10 o 166.3595 3.528144 337.3438       14.30309 304.1063       24.55119 354.4205       17.59792 157.7510 6.399806 170.5033 4.235381 -12.75226      7.674371 
1 1 1 -13 4  11 o 422.7232 6.251955 2180.209       64.40329 2244.083       93.01865 2121.395       89.25774 428.5768 8.906464 416.7112 8.789711 11.86554       12.51336 
1 1 1 -13 4  12 o 207.4714 4.018300 524.7878       20.31593 495.0399       34.61624 540.4178       25.09173 201.2552 7.069220 210.5079 4.891320 -9.252640      8.596446 
1 1 1 -13 4  13 o 373.8996 5.600881 1705.590       51.03257 1680.294       71.76379 1731.468       72.58514 370.8760 7.940365 376.4847 7.911599 -5.608734      11.20905 
1 1 1 -13 4  14 o 111.1637 2.617511 150.6145       7.090675 136.8283       10.09499 164.0393       9.961793 105.8613 3.919977 115.9438 3.529881 -10.08254      5.275062 
1 1 1 -13 4  15 o 265.5844 4.869952 860.4572       31.51834 895.2006       39.71164 801.3177       51.81080 270.8082 6.017553 255.8689 8.320407 14.93929       10.26840 
1 1 1 -13 4  16 o 321.9942 4.928862 1265.015       38.67505 1202.746       53.25590 1334.499       56.25695 313.7560 6.965297 330.4918 6.985209 -16.73584      9.864507 
1 1 1 -13 4  17 o 334.9210 5.100770 1369.010       41.63074 1354.682       58.76249 1383.448       58.98769 332.8851 7.243854 336.4083 7.195461 -3.523163      10.21019 
1 1 1 -13 4  18 o 230.1435 3.788316 646.0266       21.24619 649.7700       30.44846 642.4744       29.66034 230.6856 5.416377 229.3966 5.305827 1.288986       7.582146 
1 1 1 -13 4  19 o 31.89972 4.533569 12.66714       3.425106 12.01928       4.506924 13.55284       5.269688 30.81152 6.217123 32.68484 6.836236 -1.873314      9.240495 
1 1 1 -13 4  20 o 238.5930 3.901116 694.5646       22.68207 698.0190       32.35514 691.2264       31.80648 239.0186 5.554888 237.8608 5.487275 1.157883       7.808135 
1 1 1 -13 4  21 o 108.4135 3.087290 143.4595       8.148067 145.8209       10.25595 139.4184       13.41685 109.2499 3.858347 106.7044 5.175223 2.545471       6.455213 
1 1 1 -13 4  22 o 301.1991 4.697789 1107.969       34.48127 1123.889       49.53263 1093.000       48.02985 302.9884 6.708561 298.8193 6.595785 4.169098       9.407931 
1 1 1 -13 4  23 o 121.3739 3.116247 179.8147       9.209453 182.5732       15.95024 178.4353       11.27958 122.0904 5.374216 120.8520 3.834893 1.238358       6.602166 
1 1 1 -13 4  24 o 231.6168 3.858550 654.8763       21.77861 678.4251       31.72558 633.8894       29.95025 235.5126 5.527888 227.6714 5.398286 7.841187       7.726515 
1 1 1 -13 4  25 o 188.7260 3.388715 434.6702       15.58486 432.7102       22.26679 436.5525       21.82062 188.0798 4.862322 188.9314 4.743188 -0.8516388     6.792644 
1 1 1 -13 4  26 o 106.8427 2.755716 139.3417       7.168904 135.4593       10.26119 143.0437       10.01984 105.2357 4.008605 108.1658 3.807261 -2.930099      5.528485 
1 1 1 -13 4  27 o 216.2617 5.348706 572.5589       28.18801 589.6024       41.34027 557.7498       38.53514 218.7517 7.767398 212.8512 7.440689 5.900513       10.75622 
1 1 1 -13 4  28 o 179.7170 3.332772 394.3266       14.59590 399.7491       20.94709 389.2093       20.34934 180.6982 4.761156 178.3116 4.687177 2.386566       6.681185 
1 1 1 -13 4  29 o 87.09871 2.836142 92.67875       6.011687 91.06060       8.594110 94.22919       8.412419 86.20895 4.102612 87.71735 3.945595 -1.508392      5.692025 
1 1 1 -13 4  30 o 17.86465 6.137848 3.571315       3.228228 4.116215       4.577378 3.032079       4.553522 20.07547 7.271361 18.79783 7.165325 1.277637       10.20855 
1 1 1 -13 4  31 o 13.48256 5.738969 -0.4217966E-02 3.305204 0.8409383      4.535134 -0.9616722     4.827038 16.52618 6.857861 15.50033 6.766985 1.025846       9.634436 
1 1 1 -13 4  32 o 83.13545 2.940113 84.51500       5.947057 76.27757       8.316354 93.13592       8.507730 78.80199 4.347564 87.14725 4.016924 -8.345268      5.919205 
1 1 1 -13 4  33 o 65.75847 3.195626 52.97532       5.105537 55.07049       7.260030 50.92537       7.181255 66.87736 4.480599 64.27864 4.615279 2.598717       6.432462 
1 1 1 -13 4  34 o 154.4579 4.333817 292.8435       16.29624 279.6649       22.39587 307.6728       23.75702 150.3874 6.123924 157.7237 6.193041 -7.336273      8.709547 
1 1 1 -13 4  35 o 29.18805 5.428422 10.83498       3.719059 12.82059       5.178036 8.719238       5.345026 31.53056 6.928556 26.21988 7.794494 5.310678       10.42876 
1 1 1 -13 4  36 o 96.07063 2.965939 113.0658       6.935350 106.9500       9.834012 119.1174       9.782326 93.14491 4.344438 98.37476 4.089502 -5.229851      5.966420 
1 1 1 -13 4  37 o 87.04768 2.986193 92.95149       6.325102 90.72876       8.973267 95.14648       8.917089 85.68656 4.311211 87.78917 4.180186 -2.102608      6.005039 
1 1 1 -13 4  38 o 91.79462 4.682466 104.7280       10.43977 108.9705       15.63223 101.3125       14.02613 92.54710 6.982930 89.48489 6.475904 3.062202       9.523583 
1 1 1 -13 4  39 o 36.98375 4.340093 17.19910       3.837185 25.32713       5.508785 9.538655       5.347984 44.72989 5.147590 26.82732 7.748368 17.90257       9.302413 
1 1 1 -13 4  40 o 14.93845 5.921683 1.686864       3.206655 3.735415       4.673910 -0.1348834     4.407589 19.20066 7.273338 15.08495 6.526857 4.115712       9.772477 
1 1 1 -13 4  41 o 103.2362 3.019899 131.9012       7.589158 144.5305       11.00323 120.4419       10.48117 107.2886 4.216741 97.79089 4.409549 9.497726       6.101232 
1 1 1 -13 4  42 o 18.49400 6.270290 4.329767       3.366985 1.785946       4.595910 7.276719       4.946690 16.76045 6.924600 23.13980 7.594860 -6.379347      10.27774 
1 1 1 -13 4  43 o 19.61357 6.749760 5.065536       3.904480 6.707296       5.882603 3.772741       5.220109 22.40477 8.223425 19.05106 7.554312 3.353714       11.16657 
1 1 1 -13 4  44 o 14.90237 6.260057 1.322629       3.847923 3.337278       5.077564 -1.395321      5.897616 18.15147 7.362669 15.56892 7.085141 2.582548       10.21803 
1 1 1 -13 4  45 o 20.85192 6.642025 6.385984       3.800808 5.795010       5.248672 7.037566       5.511244 20.29100 7.702685 21.65877 7.957956 -1.367771      11.07522 
1 1 1 -13 4  46 o 17.92344 6.495098 4.520323       3.652807 8.411837       5.512476 1.473900       4.877335 22.65524 8.005376 15.74449 6.838760 6.910748       10.52876 
1 1 1 -13 4  47 o 11.47869 5.483211 -3.718169      4.304019 -6.839453      7.440882 -2.148757      5.276260 14.00163 6.814619 13.57025 6.357208 0.4313812      9.319502 
1 1 1 -13 4  48 o 12.62001 5.683381 -0.1191158E-01 3.678015 0.1039994      5.054969 -0.1423090     5.361556 14.24809 6.512922 14.39268 6.626371 -0.1445913     9.291229 
1 1 1 -13 4  49 o 11.68309 5.414024 -1.043565      3.664878 -2.137688      5.379456 -0.9590714E-01 5.006463 13.10609 6.223622 13.79818 6.370767 -0.6920919     8.906186 
1 1 1 -13 5  1  o 303.3763 4.728815 1122.158       34.95989 1137.878       49.65970 1106.713       49.22467 305.3946 6.672778 301.1813 6.706852 4.213287       9.460857 
1 1 1 -13 5  2  o 720.9960 9.278389 6349.432       163.0202 6292.183       256.0484 6388.458       211.4043 716.4269 14.66608 722.6130 12.00527 -6.186035      18.95311 
1 1 1 -13 5  3  o 181.5911 2.918189 401.8820       12.91350 413.7254       20.73182 394.3739       16.50678 184.1564 4.623365 179.8726 3.765835 4.283783       5.962971 
1 1 1 -13 5  4  f 384.0540 5.141095 1798.495       48.11540 1846.328       77.46117 1768.445       61.39614 388.9101 8.173325 380.7404 6.617226 8.169678       10.51622 
1 1 1 -13 5  5  o 275.7690 4.339327 927.0958       29.16110 882.0081       40.30621 976.6181       42.24190 268.9086 6.150795 282.9649 6.125968 -14.05637      8.681000 
1 1 1 -13 5  6  o 385.4331 5.756634 1811.798       54.06967 1815.214       76.84470 1808.448       76.09296 385.6131 8.177604 384.8995 8.112617 0.7135620      11.51902 
1 1 1 -13 5  7  o 222.7850 3.682636 604.9907       19.99314 594.7286       28.33420 615.1668       28.21531 220.8422 5.264933 224.6086 5.154925 -3.766357      7.368362 
1 1 1 -13 5  8  o 549.5762 9.212946 3689.533       123.3850 3520.294       207.0850 3782.680       153.6323 535.2458 15.89427 556.1057 11.33676 -20.85992      19.52307 
1 1 1 -13 5  9  o 159.2924 3.406878 309.2832       13.22476 291.7065       22.62990 318.3991       16.29728 154.5226 6.021247 161.5556 4.143004 -7.033020      7.308892 
1 1 1 -13 5  10 o 649.3619 10.82846 5158.161       171.3522 5100.728       295.3158 5187.311       210.3900 642.8946 18.87040 650.5508 13.27113 -7.656189      23.06978 
1 1 1 -13 5  11 f 480.5761 9.948406 2824.177       116.5070 0.000000       0.000000 2824.177       116.5070 ?        ?        480.5761 9.948406 0.000000       9.948406 
1 1 1 -13 5  12 o 343.9678 6.003938 1443.654       50.32573 1363.084       84.60628 1487.769       62.60533 333.5917 10.42039 349.0583 7.359990 -15.46655      12.75751 
1 1 1 -13 5  13 o 224.4939 3.704007 614.4321       20.26340 649.0963       29.92553 585.0811       27.53682 230.6663 5.323798 219.0049 5.159694 11.66139       7.413856 
1 1 1 -13 5  14 o 220.6109 3.664872 593.3879       19.70252 629.0181       29.17676 563.5209       26.71309 227.0597 5.273038 214.9226 5.100421 12.13712       7.336158 
1 1 1 -13 5  15 o 195.4858 3.925287 466.0063       18.69919 466.8743       23.21138 464.4015       31.56226 195.6247 4.869017 194.8868 6.655604 0.7378998      8.246477 
1 1 1 -13 5  16 o 110.3646 2.621715 148.4712       7.051010 153.9751       10.50565 143.9596       9.511562 112.2997 3.844581 108.5958 3.599176 3.703926       5.266391 
1 1 1 -13 5  17 o 293.5067 4.570796 1051.107       32.69233 1045.623       46.38940 1056.517       46.08003 292.5312 6.507445 294.0609 6.430421 -1.529724      9.148615 
1 1 1 -13 5  18 o 196.4028 3.404084 470.4126       16.29236 471.2644       23.35133 469.6047       22.74249 196.4907 4.876783 196.1528 4.757812 0.3378754      6.813207 
1 1 1 -13 5  19 o 292.7266 4.575157 1045.902       32.63655 1059.497       46.90644 1033.145       45.43866 294.3544 6.539218 290.6903 6.414441 3.664093       9.160045 
1 1 1 -13 5  20 o 250.7019 4.053624 766.9719       24.76493 793.9505       36.03009 742.8124       34.09573 254.8709 5.801081 246.5426 5.675077 8.328262       8.115358 
1 1 1 -13 5  21 o 177.7748 3.761060 385.6243       16.29358 379.3591       19.97365 398.0867       28.17015 176.1970 4.655898 180.2663 6.422928 -4.069290      7.932931 
1 1 1 -13 5  22 o 155.6694 3.434249 295.6426       13.02780 320.3514       23.45831 284.6231       15.66575 161.7278 5.962384 152.6335 4.215813 9.094315       7.302267 
1 1 1 -13 5  23 o 435.8822 7.480203 2330.147       79.45453 2430.680       141.5149 2283.867       96.01687 442.0005 13.15306 430.8380 9.145290 11.16257       16.01996 
1 1 1 -13 5  24 o 366.9336 5.569604 1647.101       49.80213 1596.992       69.32094 1700.553       71.59584 360.5846 7.888986 372.0899 7.895939 -11.50534      11.16163 
1 1 1 -13 5  25 f 130.7789 2.876258 208.6361       9.166457 202.3681       13.11799 214.6170       12.81401 128.6473 4.189961 132.5107 3.972729 -3.863358      5.773937 
1 1 1 -13 5  26 o 208.1443 4.202383 529.3248       21.31554 519.4304       37.97433 533.8764       25.75576 205.4179 7.599150 208.9093 5.059185 -3.491364      9.129208 
1 1 1 -13 5  27 o 93.87549 4.149925 107.8977       9.470086 105.2705       14.23032 109.9861       12.68751 92.42123 6.357121 94.60648 5.527328 -2.185249      8.424033 
1 1 1 -13 5  28 o 167.3482 3.216650 341.8824       13.11780 344.6947       18.91338 339.2755       18.20938 167.8008 4.629715 166.4984 4.492064 1.302368       6.450806 
1 1 1 -13 5  29 o 151.0022 3.088475 278.3614       11.36485 261.9954       15.89922 295.4601       16.25121 146.2754 4.465574 155.3725 4.296277 -9.097153      6.196721 
1 1 1 -13 5  30 o 76.93629 2.985792 72.37225       5.587297 78.06779       8.113659 67.23547       7.705402 79.78181 4.187938 74.01109 4.290702 5.770721       5.995744 
1 1 1 -13 5  31 o 31.94527 4.927804 12.79546       3.712923 14.62763       5.173270 10.84910       5.332062 33.92067 6.494866 29.09444 7.479578 4.826233       9.905926 
1 1 1 -13 5  32 f 95.56065 2.911991 111.6316       6.773268 118.0555       9.859900 105.8914       9.320534 98.11420 4.133123 92.91379 4.126762 5.200417       5.840623 
1 1 1 -13 5  33 o 56.39599 3.934521 39.12536       5.373332 40.09606       6.799368 37.51079       8.769068 56.93927 4.949399 54.71075 6.718115 2.228512       8.344437 
1 1 1 -13 5  34 o 33.18653 5.036964 13.84133       3.945699 6.798033       5.516628 21.21815       5.645733 23.98829 8.025710 41.08977 5.799400 -17.10147      9.901772 
1 1 1 -13 5  35 o 86.25439 2.982006 91.10561       6.258527 92.88918       9.018131 89.44848       8.692627 86.86873 4.273187 85.25626 4.196869 1.612465       5.989477 
1 1 1 -13 5  36 o 30.01694 5.444021 11.47854       3.835589 13.25515       5.421306 9.697939       5.427384 31.95669 7.141532 27.40656 7.770804 4.550137       10.55400 
1 1 1 -13 5  37 o 97.20680 2.961062 115.8998       7.006056 120.0448       10.05502 111.9885       9.767362 98.60589 4.194082 95.22609 4.219539 3.379799       5.949356 
1 1 1 -13 5  38 o 43.90346 5.036565 24.27083       5.291061 27.49958       10.74167 23.23648       6.079787 44.89492 10.06732 42.65527 6.015823 2.239658       11.72779 
1 1 1 -13 5  39 o 28.03467 5.364250 10.16627       3.531252 8.403627       4.891471 12.08476       5.103139 25.26437 7.442719 30.15388 7.068517 -4.889515      10.26440 
1 1 1 -13 5  40 o 45.89284 3.760277 26.30730       4.168494 34.05212       6.048280 19.30005       5.753074 51.86139 4.841721 38.34733 6.380537 13.51406       8.009588 
1 1 1 -13 5  41 o 45.77065 3.858824 26.33764       4.264005 22.06087       5.827172 31.26716       6.256074 40.96421 6.016529 49.26213 5.294375 -8.297916      8.014301 
1 1 1 -13 5  42 o 22.96270 6.195449 7.195930       3.546252 9.471952       4.904397 4.702024       5.133780 25.96041 7.395656 20.19240 7.628682 5.768003       10.62509 
1 1 1 -13 5  43 o 13.91381 5.940347 0.5653535      3.560043 -1.003252      5.536548 1.671080       4.648427 15.59948 7.003415 16.46302 6.895746 -0.8635349     9.828485 
1 1 1 -13 5  44 o 49.96376 4.384652 32.63400       5.284524 33.01205       6.627650 31.97415       8.756119 49.21114 5.627708 45.98428 8.110177 3.226860       9.871478 
1 1 1 -13 5  45 o 14.08052 5.923513 1.250907       3.453254 -1.153610      5.090564 3.300662       4.700056 14.41037 6.567438 17.43929 7.080053 -3.028929      9.657039 
1 1 1 -13 5  46 o 17.27613 6.528008 4.008804       3.759597 4.545200       5.252585 3.445320       5.383581 18.60011 7.508723 17.71198 7.420103 0.8881207      10.55646 
1 1 1 -13 5  47 o 21.55553 7.522155 7.868773       4.856710 4.234242       8.391387 9.699525       5.955584 19.11290 8.597949 23.07363 8.302489 -3.960728      11.95224 
1 1 1 -13 5  48 o 24.97153 6.502830 10.17797       3.995578 11.55700       5.911705 9.018239       5.421294 24.25294 8.306840 21.87162 7.914515 2.381313       11.47358 
1 1 1 -13 5  49 o 15.31589 6.284525 3.180958       3.751555 1.629474       5.552258 4.484325       5.088964 15.20821 6.902743 17.02067 7.177326 -1.812463      9.958006 
1 1 1 -13 6  1  o 369.9565 5.600910 1669.316       50.49464 1679.660       71.46342 1659.003       71.35709 370.9182 7.906233 368.6268 7.943541 2.291382       11.20751 
1 1 1 -13 6  2  o 165.4258 3.150518 333.5379       12.70052 324.8013       17.56314 343.1140       18.38770 163.1610 4.421302 167.6968 4.503600 -4.535767      6.311127 
1 1 1 -13 6  3  o 510.9388 6.680874 3185.130       83.18371 3093.430       129.0221 3250.362       108.8201 503.0301 10.52529 515.9095 8.655644 -12.87939      13.62725 
1 1 1 -13 6  4  o 151.0724 2.647194 278.1425       9.745567 273.7682       15.49716 281.0041       12.53421 149.7949 4.249698 151.8374 3.387522 -2.042587      5.434634 
1 1 1 -13 6  5  f 227.4971 3.372851 630.8210       18.69860 678.2606       30.96691 603.5991       23.45780 235.8339 5.388348 222.5099 4.326152 13.32397       6.910129 
1 1 1 -13 6  6  o 299.4366 4.639738 1093.202       33.85591 1116.925       48.82880 1071.239       46.98347 302.5653 6.622481 296.3195 6.506520 6.245819       9.283968 
1 1 1 -13 6  7  o 543.7849 9.119756 3612.351       120.8499 3598.511       208.8795 3619.314       148.1662 541.0954 15.85823 543.9541 11.17766 -2.858704      19.40164 
1 1 1 -13 6  8  o 62.17429 2.663723 47.19804       4.026506 49.37494       6.519050 45.85532       5.119843 63.49807 4.237209 61.23826 3.444705 2.259811       5.460763 
1 1 1 -13 6  9  o 392.8325 5.860394 1882.487       56.10097 1897.126       80.13263 1868.414       78.56802 394.1190 8.343454 391.1364 8.242926 2.982605       11.72856 
1 1 1 -13 6  10 o 384.9124 8.106555 1809.549       76.03864 0.000000       0.000000 1809.549       76.03864 ?        ?        384.9124 8.106555 0.000000       8.106555 
1 1 1 -13 6  11 o 264.3842 4.819455 852.4595       31.05057 888.3041       55.67184 836.2741       37.40970 269.4947 8.487720 261.8049 5.863681 7.689789       10.31621 
1 1 1 -13 6  12 o 417.9249 7.154498 2132.798       72.86407 2184.348       128.9922 2108.642       88.30099 421.8061 12.56315 415.3312 8.724387 6.474884       15.29535 
1 1 1 -13 6  13 o 105.8430 2.622733 136.5429       6.764757 131.8129       9.969319 140.5794       9.209424 103.8979 3.944684 107.3244 3.526045 -3.426506      5.290891 
1 1 1 -13 6  14 o 57.28900 2.739858 40.09647       3.813949 40.40546       6.107355 39.89893       4.883184 57.38965 4.400574 57.09715 3.526772 0.2924995      5.639430 
1 1 1 -13 6  15 o 288.7213 5.226073 1017.265       36.76972 992.3995       44.62580 1069.840       64.88933 285.0583 6.424158 295.5014 9.021663 -10.44312      11.07521 
1 1 1 -13 6  16 o 77.78848 2.586348 73.84129       4.895917 79.26950       7.597682 69.98660       6.402471 80.52684 3.883169 75.67991 3.480932 4.846931       5.214968 
1 1 1 -13 6  17 o 136.4727 2.811605 227.0599       9.350528 238.8978       13.94512 217.3900       12.60369 139.8814 4.095377 133.4451 3.879898 6.436325       5.641429 
1 1 1 -13 6  18 o 97.46025 2.617476 115.8801       6.210878 111.8482       9.111196 119.3800       8.488811 95.67230 3.916265 98.87206 3.528858 -3.199753      5.271619 
1 1 1 -13 6  19 o 128.2389 2.782644 200.5117       8.695878 195.9965       12.58372 204.6386       12.03058 126.6720 4.081876 129.4572 3.817675 -2.785172      5.588949 
1 1 1 -13 6  20 o 247.7624 4.664113 749.5142       28.16051 760.9450       35.00709 728.5542       47.40372 249.5088 5.757501 243.6550 7.994463 5.853821       9.851916 
1 1 1 -13 6  21 o 190.2440 3.921932 441.6902       18.18223 438.8067       22.44688 447.1919       31.00581 189.4791 4.865393 191.0238 6.670932 -1.544739      8.256718 
1 1 1 -13 6  22 o 318.3114 6.943915 1241.190       53.86327 1236.275       76.11980 1246.120       76.22865 316.6674 9.876191 317.9363 9.850679 -1.268982      13.94902 
1 1 1 -13 6  23 o 85.33232 2.699387 88.88911       5.606195 89.88087       8.339291 88.07130       7.572740 85.71174 4.003634 84.87066 3.670178 0.8410797      5.431325 
1 1 1 -13 6  24 o 296.0100 4.654042 1070.712       33.57166 1055.125       47.39658 1086.405       47.55883 293.4129 6.628750 297.7498 6.554560 -4.336914      9.322155 
1 1 1 -13 6  25 o 144.8712 2.981951 256.0528       10.52734 248.5191       15.05627 263.2587       14.72508 142.5561 4.339116 146.7522 4.121613 -4.196091      5.984615 
1 1 1 -13 6  26 o 80.40365 3.278771 79.03460       6.410780 87.44868       13.12135 76.39633       7.347421 84.19862 6.443919 78.99915 3.827992 5.199478       7.495173 
1 1 1 -13 6  27 o 184.2168 3.921228 414.5911       17.60303 428.4136       22.13238 390.7927       29.04082 187.0673 4.859169 178.2756 6.696588 8.791656       8.273803 
1 1 1 -13 6  28 o 261.9161 4.877262 839.6194       31.12966 847.8967       54.00148 835.4999       38.09653 261.8906 8.472695 260.9754 5.990316 0.9151917      10.37644 
1 1 1 -13 6  29 o 113.7002 2.890607 157.8898       8.002657 145.5566       11.29453 170.3236       11.34054 109.0125 4.259834 117.9770 3.950144 -8.964546      5.809460 
1 1 1 -13 6  30 o 123.5272 2.934718 186.2855       8.834155 181.5426       12.65182 190.7981       12.34075 121.7379 4.271344 124.8377 4.061984 -3.099777      5.894412 
1 1 1 -13 6  31 o 108.0199 2.937559 142.5863       7.725441 137.2398       10.96705 147.8524       10.88427 105.8027 4.262327 109.8524 4.072924 -4.049744      5.895434 
1 1 1 -13 6  32 o 94.34251 2.933834 108.8196       6.736758 105.8592       9.642666 111.6423       9.415812 92.87050 4.272167 95.41190 4.058939 -2.541397      5.892910 
1 1 1 -13 6  33 o 37.62774 5.666367 17.80431       5.034699 13.25761       6.648341 23.91768       7.709128 32.04556 8.409442 43.31218 7.579940 -11.26662      11.32140 
1 1 1 -13 6  34 o 103.0821 2.956370 130.0045       7.418727 137.1752       10.80236 123.6034       10.20632 105.6705 4.203356 100.3021 4.184834 5.368347       5.931361 
1 1 1 -13 6  35 f 96.02012 2.949407 112.8820       6.893151 106.2973       9.712444 119.5650       9.784732 92.92103 4.300887 98.61037 4.080653 -5.689339      5.928689 
1 1 1 -13 6  36 o 82.15096 2.999894 82.74412       5.995491 77.75591       8.417857 87.87968       8.541298 79.35406 4.369947 84.42609 4.164409 -5.072029      6.036450 
1 1 1 -13 6  37 o 74.83424 3.591970 68.99452       6.531293 73.40971       7.977314 60.01719       11.37512 77.02537 4.266649 68.76345 6.880633 8.261917       8.096135 
1 1 1 -13 6  38 o 65.78762 3.938261 53.62481       6.284809 65.48995       12.99038 49.99886       7.181195 71.21198 7.603190 63.29576 4.689010 7.916210       8.932822 
1 1 1 -13 6  39 o 45.66825 3.733163 25.96161       4.118362 25.94273       5.791762 25.98091       5.857277 45.15165 5.368826 45.16343 5.430810 -0.1178360E-01 7.636622 
1 1 1 -13 6  40 o 22.51370 6.035182 6.711158       3.378406 6.931755       4.819116 6.497969       4.737505 23.09884 7.490702 22.50877 7.434699 0.5900707      10.55393 
1 1 1 -13 6  41 o 19.12849 6.309612 4.658486       3.412534 7.569923       4.713444 1.451194       4.947137 23.67690 7.377307 17.05040 7.125841 6.626497       10.25682 
1 1 1 -13 6  42 o 33.10040 4.801065 14.28002       3.759738 9.386221       4.970961 20.82168       5.747270 25.77090 7.478318 39.32060 6.203408 -13.54970      9.716353 
1 1 1 -13 6  43 o 20.45865 6.750996 5.735874       3.906548 4.622566       5.831712 6.642134       5.261563 20.20554 7.993326 21.97774 7.815695 -1.772192      11.17937 
1 1 1 -13 6  44 f 14.52957 6.094177 1.299298       3.638121 6.913510       5.276901 -3.786981      5.022670 21.81099 7.819175 13.00693 6.127498 8.804065       9.934069 
1 1 1 -13 6  45 o 15.84210 6.345448 2.627086       3.719878 0.3207273      5.358251 4.772815       5.168293 15.64555 6.966166 19.12827 7.538064 -3.482719      10.26401 
1 1 1 -13 6  46 o 18.50893 7.091197 4.838905       4.474630 8.657375       5.454175 -3.022181      7.825743 22.80564 7.970538 16.01940 7.577403 6.786249       10.99757 
1 1 1 -13 6  47 o 14.81245 6.485236 1.361623       4.461327 4.575724       7.961778 -0.1094473     5.386380 19.04193 8.484151 14.72985 6.729299 4.312081       10.82886 
1 1 1 -13 6  48 o 19.68372 6.671331 6.485168       3.811432 5.375294       5.455944 7.543095       5.326735 18.23370 7.540096 20.27831 7.744929 -2.044603      10.80912 
1 1 1 -13 6  49 o 13.26390 5.908051 0.8801448      3.857989 -2.773157      6.004999 3.447968       5.034458 13.35973 6.407146 16.11721 6.974531 -2.757481      9.470777 
1 1 1 -13 7  1  o 130.7054 2.537432 208.2044       8.082095 216.9282       13.00973 202.7216       10.31374 133.3331 4.008551 128.9213 3.285558 4.411804       5.182989 
1 1 1 -13 7  2  o 347.2737 5.308095 1470.825       44.92071 1445.193       62.70742 1497.844       64.38058 344.0739 7.478785 350.2799 7.542295 -6.205994      10.62160 
1 1 1 -13 7  3  o 253.5473 4.705739 783.8649       29.07521 785.7438       36.03299 780.3588       49.22321 253.8016 5.825993 252.6791 8.004104 1.122467       9.899892 
1 1 1 -13 7  4  o 294.3119 4.607766 1056.145       33.04718 1062.310       47.08696 1050.161       46.39231 295.0651 6.548575 293.3767 6.489097 1.688324       9.219122 
1 1 1 -13 7  5  o 150.5793 2.946233 276.3506       10.81106 304.6671       16.39669 254.5729       14.37945 158.0238 4.261810 144.4475 4.089154 13.57631       5.906285 
1 1 1 -13 7  6  o 120.2570 3.028457 176.3741       8.867931 193.1468       16.04134 168.9924       10.64191 125.7375 5.246809 117.6832 3.715468 8.054260       6.429129 
1 1 1 -13 7  7  o 184.6179 3.289888 415.4464       14.80100 399.0425       21.05293 431.4780       20.81268 180.8360 4.781596 188.1147 4.540139 -7.278717      6.593673 
1 1 1 -13 7  8  o 207.3966 4.018397 524.3962       20.30909 561.3618       36.85391 508.2748       24.33804 214.3372 7.065516 204.1554 4.892025 10.18179       8.593801 
1 1 1 -13 7  9  o 153.6107 3.362133 287.6293       12.58556 288.0858       22.29534 287.4158       15.24712 153.5468 5.969876 153.4841 4.080127 0.6271362E-01  7.230965 
1 1 1 -13 7  10 o 348.5795 6.096831 1482.707       51.78955 1529.858       92.78665 1461.370       62.41696 353.3577 10.78807 345.9403 7.403981 7.417358       13.08440 
1 1 1 -13 7  11 o 178.3692 3.223684 387.8282       14.01227 379.3189       20.14870 395.7983       19.49991 176.2953 4.694147 180.1567 4.441668 -3.861343      6.462463 
1 1 1 -13 7  12 o 58.31860 2.763968 41.54769       3.916865 40.21043       6.320479 42.38144       4.990712 57.23768 4.569306 58.85715 3.495324 -1.619465      5.752899 
1 1 1 -13 7  13 o 277.4676 5.030685 939.2548       34.01539 969.2469       60.91752 925.6667       41.00303 281.3436 8.896421 275.3700 6.110309 5.973541       10.79269 
1 1 1 -13 7  14 o 66.68587 2.635513 54.28967       4.274437 61.33921       6.833657 49.75891       5.478460 70.81007 3.976218 63.78473 3.538433 7.025345       5.322670 
1 1 1 -13 7  15 o 251.6862 5.733255 773.3830       35.16388 754.4515       49.59739 792.5170       49.86215 248.1918 8.211711 254.4074 8.052902 -6.215637      11.50137 
1 1 1 -13 7  16 o 86.50308 2.593353 91.29716       5.460578 97.65754       8.415846 86.67243       7.176278 89.39703 3.872308 84.23296 3.503728 5.164070       5.222153 
1 1 1 -13 7  17 o 243.8488 3.968626 725.3776       23.58288 741.7822       34.23083 710.5571       32.53612 246.4350 5.700054 241.2092 5.535231 5.225754       7.945401 
1 1 1 -13 7  18 o 168.1946 3.131120 344.9738       12.83358 332.1835       18.29290 357.3705       18.00927 164.9091 4.556363 171.0721 4.323434 -6.163010      6.281125 
1 1 1 -13 7  19 o 153.1504 2.986334 286.0203       11.14532 306.1662       16.68939 269.8038       14.97357 158.3221 4.329828 148.6324 4.138079 9.689774       5.989250 
1 1 1 -13 7  20 o 247.8615 4.682070 750.1870       28.28024 745.6693       34.77264 759.0131       48.60330 246.9738 5.777642 248.6639 8.031319 -1.690094      9.893596 
1 1 1 -13 7  21 f 229.6607 3.826108 643.6599       21.41313 628.1229       30.32722 659.1060       30.23845 226.6851 5.490014 232.2282 5.343285 -5.543106      7.661002 
1 1 1 -13 7  22 o 54.57656 3.227114 36.46257       4.272810 48.41130       7.962495 31.63037       5.063615 62.71587 5.258344 50.73391 4.131414 11.98195       6.687209 
1 1 1 -13 7  23 o 201.5400 4.099879 495.9587       20.13578 475.7834       24.43278 538.6721       35.55040 197.2210 5.087992 209.5080 6.972898 -12.28699      8.631857 
1 1 1 -13 7  24 o 113.2267 2.777825 156.3741       7.664609 155.2914       11.20226 157.3270       10.50965 112.6911 4.086012 113.4550 3.806657 -0.7639008     5.584455 
1 1 1 -13 7  25 o 68.89613 2.817034 58.00052       4.719609 57.94355       7.126616 58.04502       6.298843 68.73494 4.275883 68.84541 3.768855 -0.1104660     5.699776 
1 1 1 -13 7  26 o 72.96401 3.321085 65.11755       5.889584 47.15966       11.47451 71.54081       6.862525 61.42337 7.844721 76.45185 3.694429 -15.02848      8.671128 
1 1 1 -13 7  27 o 58.11335 3.632560 41.40520       5.118554 46.40303       6.510089 33.31326       8.283668 61.45360 4.375766 51.65447 6.741512 9.799133       8.037121 
1 1 1 -13 7  28 o 49.12126 3.393721 29.60513       4.037420 30.81838       5.971691 28.58361       5.479549 49.92912 4.974136 48.10052 4.736124 1.828602       6.868253 
1 1 1 -13 7  29 o 142.6425 3.047868 248.4013       10.59452 256.0597       15.53418 241.7411       14.48645 144.6032 4.413496 140.5264 4.235102 4.076859       6.116784 
1 1 1 -13 7  30 o 149.5762 3.113703 273.2202       11.34947 256.8046       16.03489 289.7001       16.06632 144.7572 4.551239 153.8062 4.290728 -9.048996      6.254928 
1 1 1 -13 7  31 f 34.40539 4.685231 14.76787       3.826237 14.37908       5.516912 15.12821       5.311182 33.53553 6.978217 34.48874 6.559061 -0.9532051     9.576888 
1 1 1 -13 7  32 o 92.83794 2.984669 105.3988       6.743619 95.88285       9.585322 114.7250       9.489240 88.33969 4.467110 96.72069 4.034882 -8.380997      6.019580 
1 1 1 -13 7  33 o 38.37446 5.436799 18.46665       4.942001 16.31091       6.596970 21.22370       7.460515 35.56147 7.825263 40.67939 7.809768 -5.117916      11.05564 
1 1 1 -13 7  34 o 123.2632 3.034089 185.7990       9.113764 199.2883       13.53588 174.6126       12.32647 127.3398 4.368473 119.2141 4.249816 8.125687       6.094628 
1 1 1 -13 7  35 o 48.04510 3.661877 28.46356       4.255052 30.42057       6.127317 26.64076       5.913481 49.39938 5.166242 46.15319 5.357230 3.246193       7.442443 
1 1 1 -13 7  36 o 76.30224 3.101328 71.44776       5.754600 75.26268       8.374074 68.03426       7.921257 78.03341 4.421820 74.18433 4.401517 3.849075       6.239058 
1 1 1 -13 7  37 o 50.63676 4.250837 31.86528       5.197000 26.85743       6.245211 43.14240       9.371744 46.08921 5.680533 58.20549 6.731143 -12.11628      8.807766 
1 1 1 -13 7  38 o 49.06644 4.566796 30.13057       5.397806 23.74563       10.81557 32.24844       6.229023 41.30328 10.67030 50.60831 5.121227 -9.305035      11.83564 
1 1 1 -13 7  39 o 28.19294 5.366829 10.30699       3.552532 5.859315       4.985808 14.89374       5.063163 21.99394 7.624667 33.68627 6.401803 -11.69233      9.955834 
1 1 1 -13 7  40 o 38.28902 4.363699 18.57398       3.999015 17.16855       5.570547 20.06849       5.744381 35.94125 6.603435 39.08643 6.240646 -3.145180      9.085758 
1 1 1 -13 7  41 o 70.08113 3.582249 61.40243       6.097471 63.40415       7.703327 58.04433       9.977524 70.70794 4.493939 66.45644 6.233751 4.251503       7.684734 
1 1 1 -13 7  42 o 16.15198 6.181159 2.684643       3.397259 4.673781       4.635841 0.3772899      4.992903 19.69103 7.287435 15.98316 6.931013 3.707863       10.05712 
1 1 1 -13 7  43 o 44.90878 4.019102 25.92885       4.351967 22.85576       6.058859 29.20418       6.255051 40.64690 6.322298 46.57043 5.625543 -5.923531      8.462752 
1 1 1 -13 7  44 o 27.92862 6.041940 11.09126       3.992366 9.293152       5.768091 12.74486       5.531457 24.39303 8.207096 28.74334 7.730057 -4.350306      11.27432 
1 1 1 -13 7  45 o 25.20872 6.255130 9.358884       3.824220 9.134151       5.448854 9.577042       5.368567 23.82655 7.976333 24.39277 7.905882 -0.5662289     11.23053 
1 1 1 -13 7  46 o 11.60019 5.524577 -3.684565      4.301222 -1.897895      5.363382 -6.904549      7.200181 13.97968 6.502626 13.94577 6.768087 0.3391171E-01  9.385689 
1 1 1 -13 7  47 o 25.57084 7.269639 11.02951       4.743553 0.3404222      8.150707 16.50420       5.833175 16.98824 7.939856 30.99405 7.745390 -14.00581      11.09200 
1 1 1 -13 7  48 o 22.04668 6.775301 8.288936       3.991470 15.99621       6.439557 3.480399       5.086416 28.31207 8.587344 16.48953 7.071623 11.82253       11.12431 
1 1 1 -13 7  49 o 15.51665 6.366340 3.398632       3.849434 3.484634       5.812981 3.331461       5.137268 16.41022 7.284131 16.02699 6.989263 0.3832340      10.09497 
1 1 1 -13 8  1  o 263.8291 3.799961 848.5808       24.43081 872.6015       39.38760 833.5605       31.14622 267.4232 6.043998 261.4360 4.888817 5.987244       7.773702 
1 1 1 -13 8  2  o 444.1894 6.603300 2407.962       71.47683 2353.807       99.52840 2465.640       102.7139 438.8139 9.307447 449.1051 9.385230 -10.29126      13.21783 
1 1 1 -13 8  3  o 189.3681 3.027157 437.0847       13.96941 415.9444       21.79626 451.8219       18.19839 184.6198 4.848905 192.5134 3.879146 -7.893539      6.209642 
1 1 1 -13 8  4  o 268.1671 3.835931 876.6967       25.06758 904.0101       40.67765 859.9730       31.82977 272.1992 6.132435 265.5513 4.918686 6.647919       7.861312 
1 1 1 -13 8  5  o 47.34974 2.747108 27.41693       3.156172 28.11475       5.533102 27.08038       3.842637 47.77372 4.818507 47.01304 3.376580 0.7606812      5.883817 
1 1 1 -13 8  6  o 72.77464 2.570117 64.62691       4.550789 73.73860       9.302358 61.76018       5.217794 77.60156 4.944833 71.11935 3.017527 6.482208       5.792827 
1 1 1 -13 8  7  o 274.7680 4.975689 920.7640       33.31620 946.8019       58.95583 908.5478       40.38232 278.2205 8.706356 272.8761 6.072809 5.344391       10.61507 
1 1 1 -13 8  8  f 267.2603 4.863481 871.1290       31.67509 869.3151       55.19438 872.0197       38.67827 266.5902 8.506890 267.3355 5.937099 -0.7452698     10.37383 
1 1 1 -13 8  9  o 315.7276 4.862473 1215.790       37.41156 1240.554       54.06436 1193.036       51.82268 318.7625 6.959976 312.6121 6.802648 6.150421       9.732280 
1 1 1 -13 8  10 o 168.4657 3.615696 346.0027       14.84361 307.5677       25.90775 364.7850       18.11088 158.5801 6.719397 172.9572 4.296993 -14.37715      7.975867 
1 1 1 -13 8  11 o 302.7690 4.698065 1118.096       34.66303 1081.867       48.53274 1155.820       49.52414 297.6649 6.690693 307.6787 6.605161 -10.01379      9.401783 
1 1 1 -13 8  12 o 161.8572 3.075611 319.3581       12.13108 309.3763       17.56290 328.4655       16.77601 159.1987 4.531715 164.0613 4.199559 -4.862610      6.178409 
1 1 1 -13 8  13 o 196.1370 3.422324 469.0349       16.35750 440.4558       22.91035 498.7524       23.36226 189.9364 4.954028 202.1953 4.741411 -12.25893      6.857359 
1 1 1 -13 8  14 o 174.5436 3.211028 371.4355       13.65790 356.7328       19.61320 385.2772       19.03037 170.9283 4.713170 177.7180 4.394199 -6.789658      6.443830 
1 1 1 -13 8  15 o 147.0342 3.433065 263.6224       12.30089 263.7587       15.49676 263.3903       20.22453 146.9746 4.331483 146.7620 5.665593 0.2126465      7.131668 
1 1 1 -13 8  16 o 212.9590 3.613751 553.1148       18.75385 569.7272       27.47522 538.6234       25.66147 216.0209 5.219266 210.0576 5.013106 5.963242       7.236848 
1 1 1 -13 8  17 f 75.40665 2.645936 69.40721       4.854578 72.14867       7.620879 67.53511       6.297651 76.79031 4.087236 74.33147 3.486434 2.458832       5.372218 
1 1 1 -13 8  18 o 392.5987 5.891695 1883.814       56.36704 1844.889       79.12153 1923.929       80.32209 387.9161 8.369910 396.1530 8.320241 -8.236969      11.80177 
1 1 1 -13 8  19 o 131.4799 3.339161 210.9935       10.69009 204.3704       13.26630 223.2572       18.05219 129.3321 4.214904 135.0562 5.496515 -5.724075      6.926550 
1 1 1 -13 8  20 o 120.0106 2.768820 175.6259       8.097489 166.3715       11.74119 184.0204       11.18240 116.6763 4.136003 122.7483 3.742750 -6.072067      5.578055 
1 1 1 -13 8  21 o 127.6304 2.826570 198.6547       8.791238 202.0601       13.04307 195.8198       11.90069 128.5858 4.167971 126.6094 3.861696 1.976440       5.681960 
1 1 1 -13 8  22 o 261.9230 4.835943 838.2343       30.86675 850.8277       54.19891 832.1890       37.55147 262.9945 8.467869 260.7978 5.908632 2.196777       10.32554 
1 1 1 -13 8  23 o 223.1835 3.776300 608.0550       20.53831 622.0917       29.88456 595.4909       28.27346 225.5186 5.437865 220.6721 5.257694 4.846451       7.563975 
1 1 1 -13 8  24 o 85.01014 3.232608 88.31166       6.684483 85.69990       8.555709 92.40383       10.70941 83.65555 4.210402 86.77761 5.086632 -3.122063      6.603129 
1 1 1 -13 8  25 o 48.94567 3.907135 29.44428       4.621584 22.31418       9.739079 31.51655       5.250405 41.66865 9.762992 50.60551 4.298169 -8.936859      10.66725 
1 1 1 -13 8  26 o 62.11639 3.593565 47.27196       5.416389 50.79337       11.40860 46.24726       6.154194 63.84265 7.474389 61.38167 4.138495 2.460979       8.543631 
1 1 1 -13 8  27 o 85.76427 3.240691 89.92288       6.760803 98.68456       8.816396 77.41576       10.53358 89.77128 4.040472 79.30510 5.484310 10.46618       6.811980 
1 1 1 -13 8  28 o 106.8650 2.856264 139.4739       7.431562 137.8876       10.91028 140.8470       10.15044 106.1071 4.227909 107.2835 3.888976 -1.176353      5.744506 
1 1 1 -13 8  29 o 106.0856 2.909365 137.4810       7.514166 132.2769       10.89211 142.2070       10.37967 103.8949 4.311481 107.7778 3.958738 -3.882843      5.853245 
1 1 1 -13 8  30 o 157.6597 3.205246 303.6140       12.31454 298.1324       17.73817 308.7140       17.10962 155.9445 4.672967 158.7396 4.427343 -2.795105      6.437235 
1 1 1 -13 8  31 o 92.10979 2.935292 103.7212       6.580188 105.7934       9.704145 101.9576       8.952784 92.85033 4.300500 91.18636 4.038974 1.663971       5.899797 
1 1 1 -13 8  32 o 71.60223 3.127259 62.77144       5.443494 61.63466       7.904923 63.79665       7.507008 70.74855 4.610159 72.03276 4.296138 -1.284210      6.301616 
1 1 1 -13 8  33 o 85.15663 4.010749 89.04842       8.299617 89.56422       11.31046 88.44664       12.21672 85.11872 5.481941 84.47053 5.973426 0.6481934      8.107619 
1 1 1 -13 8  34 o 85.54031 3.032896 89.60461       6.312140 88.93503       9.032204 90.24381       8.824838 84.98975 4.375782 85.64111 4.241719 -0.6513672     6.094231 
1 1 1 -13 8  35 o 50.41270 3.719716 31.34461       4.537497 30.31722       6.456669 32.34712       6.378032 49.22733 5.474784 50.92709 5.212739 -1.699764      7.559492 
1 1 1 -13 8  36 o 90.23961 2.988075 99.86928       6.561839 98.93320       9.396416 100.7603       9.167501 89.49883 4.321096 90.36381 4.174412 -0.8649750     6.008126 
1 1 1 -13 8  37 o 58.94661 5.359101 43.60573       7.614094 39.47788       11.89742 46.46918       9.909122 54.52191 9.287162 60.32461 6.862547 -5.802696      11.54755 
1 1 1 -13 8  38 o 23.32254 6.263306 7.113222       3.634611 3.691570       5.101474 10.64054       5.179650 19.77644 7.572920 28.29696 7.421209 -8.520514      10.60299 
1 1 1 -13 8  39 o 79.87743 3.114099 78.78048       6.050061 87.42838       8.798656 71.02461       8.332518 83.64718 4.331223 75.26600 4.564441 8.381180       6.292346 
1 1 1 -13 8  40 o 42.44054 4.745923 22.95917       4.824436 27.03473       6.041641 15.78711       8.014624 45.75161 5.531054 33.19748 9.453177 12.55413       10.95240 
1 1 1 -13 8  41 o 50.70860 3.752712 32.35229       4.604414 29.15439       6.434787 35.70763       6.591282 47.15767 5.716002 52.53958 5.216941 -5.381916      7.738808 
1 1 1 -13 8  42 o 32.79582 5.522945 14.38320       4.257259 14.21551       6.612108 14.50194       5.563991 30.91566 8.509143 31.94524 7.306446 -1.029572      11.21560 
1 1 1 -13 8  43 o 35.06291 5.520305 16.68268       4.561017 13.95597       5.525755 22.51178       8.079274 30.75894 7.451463 38.00784 8.883334 -7.248899      11.59474 
1 1 1 -13 8  44 o 22.23207 6.547377 7.244231       3.785888 3.950146       5.255324 10.79803       5.458565 18.60234 7.510304 26.23171 7.895483 -7.629364      10.89694 
1 1 1 -13 8  45 o 21.39802 6.747469 6.924203       3.931112 3.596198       5.642510 10.06318       5.479919 18.20389 7.609217 24.80490 7.983006 -6.601006      11.02853 
1 1 1 -13 8  46 o 52.91752 4.732900 38.44182       6.038906 34.91812       7.444077 45.22449       10.32789 48.15154 6.510681 51.66478 8.498382 -3.513237      10.70567 
1 1 1 -13 8  47 o 17.11595 6.862914 4.149052       4.356085 6.289237       8.098433 3.277741       5.167277 19.74207 8.687551 16.72824 7.149733 3.013834       11.25132 
1 1 1 -13 8  48 o 22.50934 6.626569 8.558495       3.878629 8.561293       5.767731 8.556184       5.240512 20.92683 8.042396 21.21878 7.765972 -0.2919483     11.17991 
1 1 1 -13 8  49 o 26.75815 6.603920 12.18491       4.279621 12.56181       6.627598 11.91537       5.604767 23.44525 8.706613 24.06368 8.090030 -0.6184292     11.88502 
1 1 1 -13 9  1  o 79.26202 2.469570 76.64293       4.764225 74.37306       7.676925 78.06470       6.075772 77.99487 4.053010 79.96534 3.123920 -1.970467      5.117202 
1 1 1 -13 9  2  o 443.1796 6.609533 2397.525       71.38165 2273.606       97.33990 2541.691       104.9916 431.1931 9.263668 455.8728 9.450934 -24.67966      13.23388 
1 1 1 -13 9  3  o 155.5709 4.327503 295.3478       16.39003 270.9240       21.32907 330.5660       25.61236 148.8922 5.890086 164.4491 6.403432 -15.55692      8.700406 
1 1 1 -13 9  4  f 331.5292 5.820294 1341.073       47.02219 1350.545       81.82836 1336.403       57.45600 332.0797 10.12355 330.8370 7.126647 1.242676       12.38045 
1 1 1 -13 9  5  o 248.4883 4.604836 753.0023       27.88406 785.4233       49.60263 738.0234       33.71566 253.4286 8.041982 245.9516 5.625302 7.477005       9.814148 
1 1 1 -13 9  6  o 182.5331 3.717599 406.1999       16.53637 400.0817       28.75296 409.2238       20.21389 180.9272 6.532146 183.1857 4.528164 -2.258514      7.948157 
1 1 1 -13 9  7  o 178.4409 2.925180 388.1090       12.71988 384.3034       20.40253 390.5286       16.26862 177.4491 4.722373 178.9757 3.730099 -1.526642      6.017844 
1 1 1 -13 9  8  o 264.5623 3.798801 853.3745       24.49123 851.1204       39.01202 854.8408       31.46414 264.0821 6.062104 264.7346 4.877183 -0.6524963     7.780489 
1 1 1 -13 9  9  o 42.30363 3.249395 21.94443       3.324134 19.84222       5.523891 23.13789       4.162106 39.90133 5.855043 43.37930 3.981637 -3.477966      7.080606 
1 1 1 -13 9  10 o 215.7054 4.197746 567.4172       22.06548 602.1273       41.09982 553.3611       26.15441 221.8569 7.613333 212.9764 5.039382 8.880478       9.130072 
1 1 1 -13 9  11 o 120.8476 2.749053 178.0136       8.095753 187.4841       12.41446 171.0062       10.67882 123.9220 4.116672 118.3682 3.706702 5.553856       5.539551 
1 1 1 -13 9  12 o 181.0333 3.833843 399.6501       16.91332 399.3951       21.11985 400.1061       28.24077 180.8702 4.795909 180.8898 6.416749 -0.1951599E-01 8.010956 
1 1 1 -13 9  13 o 166.0752 3.127694 336.2586       12.65800 355.9096       19.03849 320.6900       16.94592 170.7400 4.579873 162.0859 4.294045 8.654114       6.278061 
1 1 1 -13 9  14 o 229.2833 3.809157 641.1626       21.28322 665.0460       31.28234 620.5795       29.04056 233.3931 5.500159 225.4728 5.285363 7.920288       7.628028 
1 1 1 -13 9  15 o 177.8708 3.782073 385.8936       16.39346 384.7724       20.44852 387.9106       27.42601 177.4974 4.731746 178.0568 6.330813 -0.5594788     7.903709 
1 1 1 -13 9  16 o 102.8298 2.997756 129.0395       7.503908 110.9462       13.29353 137.5007       9.090709 95.12445 5.761736 106.1200 3.520187 -10.99557      6.751986 
1 1 1 -13 9  17 o 157.3593 3.051525 301.9548       11.70161 288.2423       16.80103 314.8730       16.30717 153.6070 4.493199 160.5800 4.170796 -6.972977      6.130610 
1 1 1 -13 9  18 o 86.10383 3.205705 90.54607       6.714648 85.18359       8.488484 99.51139       10.97564 83.43998 4.188037 90.12685 5.017150 -6.686874      6.535399 
1 1 1 -13 9  19 o 154.5236 3.575310 291.3098       13.46309 294.2592       16.89009 286.1704       22.29549 155.1836 4.470984 152.8599 5.996955 2.323700       7.480185 
1 1 1 -13 9  20 o 159.5457 3.088454 310.4716       12.00777 328.4731       18.05148 296.1841       16.08179 163.9479 4.522575 155.7034 4.242339 8.244553       6.200898 
1 1 1 -13 9  21 o 192.3156 3.426851 451.2563       16.06001 439.0961       22.96767 462.8904       22.46522 189.4996 4.977930 194.6591 4.735873 -5.159470      6.870828 
1 1 1 -13 9  22 o 214.9215 4.202727 564.0658       22.01138 561.7478       38.26756 565.2119       26.90828 213.8676 7.353535 215.0222 5.135307 -1.154617      8.969161 
1 1 1 -13 9  23 o 65.07555 2.892085 51.75973       4.574870 52.69513       7.044449 51.07747       6.016223 65.52597 4.437794 64.56721 3.840988 0.9587555      5.869174 
1 1 1 -13 9  24 o 133.9264 2.936027 218.8222       9.582137 222.8097       14.18341 215.4742       12.99661 134.9729 4.317746 132.7635 4.021761 2.209427       5.900635 
1 1 1 -13 9  25 o 114.5946 3.315813 160.4223       9.249822 167.2602       18.29706 158.0748       10.72063 116.5962 6.464940 113.6981 3.874949 2.898048       7.537286 
1 1 1 -13 9  26 o 104.3953 3.290967 133.1738       8.361763 126.0890       10.50751 145.4084       13.80799 101.4776 4.258535 108.8601 5.220274 -7.382523      6.736942 
1 1 1 -13 9  27 o 225.7145 3.871857 622.5345       21.29683 627.5535       30.58430 617.8101       29.67289 226.2839 5.546370 224.5492 5.422657 1.734650       7.756767 
1 1 1 -13 9  28 o 57.12120 3.250936 39.97053       4.506559 40.84133       6.781152 39.28172       6.031063 57.55109 4.881194 56.49595 4.415724 1.055134       6.582148 
1 1 1 -13 9  29 o 65.80720 3.157163 53.00590       5.048215 61.01893       7.603276 46.68863       6.750984 70.47018 4.450235 61.59461 4.529353 8.875576       6.349774 
1 1 1 -13 9  30 o 17.06859 6.335362 2.768935       3.508311 5.021469       5.307389 1.020857       4.675474 21.85232 7.840800 16.91393 6.985784 4.938395       10.50140 
1 1 1 -13 9  31 o 15.32053 6.158103 1.345788       3.516381 1.683476       5.310442 1.082115       4.692517 18.45755 7.513768 16.98402 7.005018 1.473526       10.27263 
1 1 1 -13 9  32 o 53.98544 3.610417 35.81370       4.722439 42.83926       7.015872 29.99371       6.385607 58.86777 4.936077 49.09734 5.427646 9.770439       7.336497 
1 1 1 -13 9  33 o 23.47335 7.615908 6.663848       4.981212 8.740317       6.567642 3.851715       7.643013 26.81581 8.748180 23.08901 9.145527 3.726799       12.65588 
1 1 1 -13 9  34 o 26.20650 5.972514 8.828659       3.728976 3.013245       5.219886 14.88961       5.328943 19.51498 7.609532 34.07135 6.657039 -14.55637      10.11045 
1 1 1 -13 9  35 o 87.84412 3.026649 94.58894       6.469364 85.17483       9.023101 104.5477       9.280452 83.05299 4.474774 92.12172 4.144619 -9.068733      6.099301 
1 1 1 -13 9  36 o 42.76588 4.046931 22.71810       4.167369 26.57169       6.056638 19.25333       5.742963 45.93175 5.521654 38.79403 6.290063 7.137718       8.369800 
1 1 1 -13 9  37 o 23.99187 8.288121 6.893578       5.889064 5.837129       9.457932 7.562518       7.526024 25.76248 10.18334 25.73245 9.323262 0.3002167E-01  13.80665 
1 1 1 -13 9  38 o 57.61065 3.388537 41.05454       4.736189 43.17665       6.880561 39.14363       6.529208 58.63247 4.859192 55.81266 4.848621 2.819813       6.864464 
1 1 1 -13 9  39 f 48.31221 4.375854 29.36594       5.095951 35.06778       6.349210 19.04301       8.543064 52.57937 5.015995 36.76764 9.475459 15.81173       10.72122 
1 1 1 -13 9  40 o 16.40138 6.299094 2.574485       3.536665 7.608383       5.055104 -2.251797      4.949760 23.86522 7.666082 14.32555 6.508167 9.539665       10.05610 
1 1 1 -13 9  41 o 24.02721 6.050627 7.846721       3.540118 5.948359       5.031974 9.707098       4.981376 21.55505 7.645501 26.30130 7.440338 -4.746252      10.66829 
1 1 1 -13 9  42 o 16.34754 6.484732 2.482569       3.847940 7.084340       5.968629 -0.7904242     5.033669 22.83778 8.298703 15.08722 6.732492 7.750555       10.68620 
1 1 1 -13 9  43 o 35.22911 5.827128 17.10990       4.827825 15.99576       5.824751 19.55516       8.629189 32.86579 7.445834 34.13023 9.837748 -1.264439      12.33782 
1 1 1 -13 9  44 o 15.49395 6.302856 2.227530       3.733561 -1.444850      5.389718 5.615519       5.176821 14.66617 6.711987 20.12163 7.647117 -5.455458      10.17493 
1 1 1 -13 9  45 o 16.27741 6.537439 2.966249       3.959542 -0.8568478     5.562044 6.894484       5.638005 14.96045 6.835979 21.10351 7.989660 -6.143058      10.51500 
1 1 1 -13 9  46 o 11.75959 5.578165 -3.205408      4.298620 9.300908       7.949828 -8.372780      5.110083 22.38415 9.162488 10.84205 5.351168 11.54210       10.61066 
1 1 1 -13 9  47 o 25.34234 7.350943 11.15008       4.803960 6.894637       8.849483 12.92806       5.720170 19.96109 8.915745 26.34226 8.113646 -6.381168      12.05495 
1 1 1 -13 9  48 o 12.07933 5.587291 -0.9476650     3.876414 -2.124301      5.952692 -0.8129625E-01 5.107916 13.72916 6.527329 13.97308 6.445615 -0.2439251     9.173439 
1 1 1 -13 10 1  o 30.81212 3.995058 11.77045       2.929169 8.706150       5.002028 13.36968       3.613568 26.35869 7.455463 32.78214 4.654018 -6.423454      8.788846 
1 1 1 -13 10 2  o 286.2188 5.158694 999.4262       35.98107 1010.201       62.57570 994.1044       43.97842 287.2558 8.950166 285.3653 6.324153 1.890503       10.95903 
1 1 1 -13 10 3  o 218.3151 4.371443 581.2468       23.25653 609.2117       29.36814 534.2188       38.08453 223.4533 5.393288 208.9839 7.490358 14.46933       9.230006 
1 1 1 -13 10 4  o 194.5137 3.442051 461.2588       16.31562 444.3690       23.22958 477.7029       22.92106 190.7959 5.000467 197.9015 4.752801 -7.105515      6.898825 
1 1 1 -13 10 5  o 296.0858 4.161339 1069.031       30.02527 1086.035       48.33166 1058.344       38.31585 298.2454 6.650004 294.5258 5.338498 3.719574       8.527726 
1 1 1 -13 10 6  o 326.5516 4.504529 1300.540       35.84572 1318.336       57.53098 1289.248       45.82871 328.5363 7.185917 325.0301 5.785993 3.506226       9.225786 
1 1 1 -13 10 7  o 179.4924 2.942905 392.7164       12.87237 392.9187       20.86922 392.5922       16.35394 179.4142 4.777492 179.4411 3.739938 -0.2682495E-01 6.067254 
1 1 1 -13 10 8  o 212.2740 3.251456 549.3234       16.81941 595.7747       28.35670 524.1115       20.89104 220.9726 5.266005 207.3118 4.135233 13.66080       6.695593 
1 1 1 -13 10 9  o 68.20571 3.292971 56.84623       5.457071 49.52127       7.396336 65.59747       8.084414 63.53221 4.813153 73.19308 4.555125 -9.660877      6.626885 
1 1 1 -13 10 10 o 266.6776 4.919378 867.6695       31.96928 827.3468       55.24603 887.9697       39.19913 259.8925 8.735520 269.6954 5.964402 -9.802826      10.57750 
1 1 1 -13 10 11 o 118.6980 2.792672 171.7472       8.077918 152.9441       11.70519 188.8456       11.16197 111.8950 4.300717 124.3910 3.686339 -12.49596      5.664386 
1 1 1 -13 10 12 o 214.9256 3.654496 563.3056       19.14043 579.2410       28.11320 549.5366       26.13250 217.8446 5.295749 212.2020 5.053537 5.642654       7.320054 
1 1 1 -13 10 13 o 284.4464 4.493103 987.1864       31.14462 985.3032       44.60078 988.9786       43.50975 283.9705 6.445152 284.5203 6.275340 -0.5498352     8.995547 
1 1 1 -13 10 14 o 43.59028 3.278610 23.30081       3.457171 25.46885       5.876043 22.15301       4.275470 45.34972 5.424570 42.40642 4.192078 2.943298       6.855616 
1 1 1 -13 10 15 o 95.69907 3.168129 111.8002       7.378152 108.9585       9.517227 116.0806       11.68049 94.40913 4.146877 97.38725 4.937902 -2.978127      6.448215 
1 1 1 -13 10 16 o 45.67872 3.188315 25.56926       3.526762 28.93306       5.773380 23.56680       4.454479 48.42653 4.962383 43.74225 4.231662 4.684280       6.521672 
1 1 1 -13 10 17 o 80.40629 3.833140 79.06040       7.489078 76.83530       10.91940 81.03670       10.29084 79.08756 5.704033 81.28345 5.222962 -2.195885      7.734037 
1 1 1 -13 10 18 o 150.5564 3.559158 276.5353       13.05818 275.9550       16.34865 277.5581       21.70257 150.2778 4.469240 150.5515 5.927061 -0.2736816     7.423218 
1 1 1 -13 10 19 o 198.3670 3.503904 480.0723       16.93783 466.4792       24.26275 492.9943       23.65619 195.3312 5.101575 200.9020 4.831972 -5.570770      7.026665 
1 1 1 -13 10 20 o 310.1719 4.839920 1175.321       36.58278 1239.578       54.04760 1120.992       49.69746 318.0876 6.972580 302.5439 6.740772 15.54370       9.698190 
1 1 1 -13 10 21 o 150.2651 3.032721 275.4283       11.10521 261.5060       15.99245 288.3932       15.43277 146.2520 4.492544 153.6330 4.125880 -7.380997      6.099659 
1 1 1 -13 10 22 o 90.05054 3.661269 99.14346       8.017657 0.000000       0.000000 99.14346       8.017657 ?        ?        90.05054 3.661269 0.000000       3.661269 
1 1 1 -13 10 23 o 103.6068 2.796849 131.0336       7.054982 131.8475       10.60596 130.3876       9.448544 103.8087 4.201248 103.2740 3.760654 0.5346756      5.638528 
1 1 1 -13 10 24 o 163.3890 3.703978 325.9712       14.74780 289.4857       26.19757 342.8980       17.84381 153.3921 7.027116 167.4501 4.376617 -14.05804      8.278595 
1 1 1 -13 10 25 o 23.29505 6.310582 6.875933       3.670383 16.73188       9.267620 5.042437       3.997230 36.22293 10.11381 20.73452 6.828302 15.48841       12.20307 
1 1 1 -13 10 26 o 163.4843 3.728583 326.4787       14.85443 338.5983       18.95975 307.2144       23.90373 166.3050 4.682997 158.1140 6.215935 8.191040       7.782565 
1 1 1 -13 10 27 o 15.13530 6.130592 1.162667       3.514692 0.1376716      4.845529 2.300697       5.105722 16.43163 6.969725 18.79230 7.464843 -2.360674      10.21278 
1 1 1 -13 10 28 o 169.2794 3.290205 349.9588       13.57260 341.6345       19.48639 357.8024       18.91546 166.9703 4.794087 170.9275 4.545216 -3.957230      6.606229 
1 1 1 -13 10 29 o 30.88789 5.246340 12.01911       3.807829 18.07064       5.834778 7.529765       5.025544 37.79000 6.574580 24.69512 7.604846 13.09488       10.05280 
1 1 1 -13 10 30 o 109.7043 2.956049 147.0836       7.895423 163.3313       12.00086 134.6839       10.48388 115.4242 4.273956 104.8241 4.112142 10.60011       5.930971 
1 1 1 -13 10 31 o 50.65328 3.610410 31.53957       4.427348 29.41106       6.620695 33.26132       5.954576 48.57563 5.701457 51.86069 4.764904 -3.285065      7.430405 
1 1 1 -13 10 32 f 42.32385 5.599817 22.42454       5.633997 26.68311       7.727220 17.59132       8.232071 45.89293 7.141647 36.77551 9.207503 9.117420       11.65252 
1 1 1 -13 10 33 o 63.71271 3.260301 49.79536       5.045142 46.36294       7.357845 52.84115       6.931080 61.19205 4.977173 65.46650 4.369574 -4.274452      6.623098 
1 1 1 -13 10 34 o 28.65535 5.529097 10.47899       3.721086 7.846818       5.259032 13.11794       5.265794 25.04760 7.790727 31.85860 6.976374 -6.811003      10.45778 
1 1 1 -13 10 35 o 23.21723 6.385910 6.931891       3.725467 9.204576       5.240016 4.608923       5.297668 26.70438 7.656466 21.18481 7.799103 5.519575       10.92920 
1 1 1 -13 10 36 o 86.38217 3.541286 91.88197       7.438740 100.5016       9.501560 78.23275       11.95647 90.11674 4.339419 78.80031 6.278306 11.31644       7.632017 
1 1 1 -13 10 37 o 65.90553 3.858444 53.79625       6.169733 50.53538       12.81228 54.78069       7.039704 61.86190 8.742356 66.35457 4.378053 -4.492668      9.777328 
1 1 1 -13 10 38 o 35.34705 5.546982 16.08090       4.620866 14.74955       5.707691 18.61335       7.871986 33.25756 7.247831 36.83066 8.875915 -3.573105      11.45918 
1 1 1 -13 10 39 o 12.78311 5.620158 -0.6373326     3.382192 4.301733       4.803494 -5.493570      4.763047 19.89685 7.407763 12.26561 5.833578 7.631244       9.428976 
1 1 1 -13 10 40 o 45.17840 3.982977 25.74417       4.340197 21.50470       6.069461 30.18059       6.208842 40.19016 6.412543 48.30911 5.364401 -8.118946      8.360474 
1 1 1 -13 10 41 o 16.20697 6.259161 2.598980       3.505759 5.566571       4.865378 -0.6055635     5.055891 20.93303 7.507656 15.38912 6.814020 5.543909       10.13882 
1 1 1 -13 10 42 o 32.11968 5.895006 14.10941       4.444163 19.96830       7.262778 10.60256       5.618923 36.53958 8.340740 26.72368 8.003130 9.815895       11.55933 
1 1 1 -13 10 43 f 15.06066 6.463350 0.9655669      4.254543 0.1343823      5.165278 2.719321       7.502902 15.57086 6.891265 19.52351 8.481114 -3.952654      10.92789 
1 1 1 -13 10 44 f 14.94209 6.264750 1.614076       3.842320 -1.991266      5.431898 5.224636       5.435827 14.35451 6.630579 19.74178 7.745566 -5.387271      10.19600 
1 1 1 -13 10 45 o 16.93285 7.391976 2.052520       5.759171 6.185902       8.691726 -1.182558      7.689456 21.10584 9.148638 16.73883 7.786043 4.367004       12.01333 
1 1 1 -13 10 46 o 17.95270 6.776986 4.783374       4.049565 8.881724       5.948201 1.242737       5.528684 22.25127 8.251089 15.76199 7.043158 6.489285       10.84834 
1 1 1 -13 10 47 o 16.62541 6.904227 3.739068       4.601539 7.849831       8.843968 2.213130       5.388331 20.26727 8.991055 15.87356 7.031197 4.393709       11.41389 
1 1 1 -13 10 48 o 13.56168 5.968114 1.219667       3.822298 12.24748       5.988575 -6.361163      4.965206 24.27755 8.359097 10.93769 5.374208 13.33986       9.937636 
1 1 1 -13 11 1  o 367.1155 5.553889 1644.950       49.68623 1597.907       96.84761 1661.755       57.88455 360.7585 11.02926 368.8777 6.439381 -8.119171      12.77146 
1 1 1 -13 11 2  o 133.7828 2.627445 218.1566       8.565842 219.0230       13.98704 217.6367       10.83546 133.9382 4.290878 133.6083 3.327957 0.3298798      5.430187 
1 1 1 -13 11 3  o 247.1215 4.123191 744.7634       24.83019 756.0851       35.49018 733.9078       34.75185 248.8793 5.851719 245.2048 5.815847 3.674500       8.250254 
1 1 1 -13 11 4  o 199.2457 3.515067 484.0232       17.06706 468.4341       24.41562 498.9191       23.86668 195.8730 5.119524 202.2294 4.842967 -6.356445      7.047258 
1 1 1 -13 11 5  o 294.0419 4.144518 1054.430       29.69746 996.1651       45.75860 1096.831       39.03523 285.6065 6.574588 299.8058 5.342944 -14.19928      8.471850 
1 1 1 -13 11 6  o 207.9366 3.236869 527.1215       16.40182 513.7968       26.08115 535.8389       21.09545 205.1336 5.221641 209.6121 4.129870 -4.478531      6.657429 
1 1 1 -13 11 7  o 338.8500 5.198807 1401.073       42.92865 1317.508       59.01998 1494.948       62.55466 328.3447 7.376204 349.7622 7.339234 -21.41745      10.40542 
1 1 1 -13 11 8  o 265.4547 4.264624 859.4715       27.58718 837.4504       39.01302 881.4951       39.01530 261.8907 6.112987 268.7034 5.958344 -6.812775      8.536421 
1 1 1 -13 11 9  o 313.6990 4.361732 1200.374       33.34327 1180.147       52.67055 1213.902       43.07314 310.7777 6.954756 315.3472 5.605075 -4.569489      8.932273 
1 1 1 -13 11 10 o 118.8699 3.228200 172.4046       9.342569 163.6031       17.91283 175.6935       10.94983 115.5554 6.386016 119.9706 3.749988 -4.415237      7.405647 
1 1 1 -13 11 11 o 387.3267 5.829016 1832.008       55.01850 1811.918       77.84995 1852.055       77.76595 384.7573 8.303007 389.0163 8.203243 -4.259003      11.67190 
1 1 1 -13 11 12 o 115.0964 2.768573 161.4966       7.765223 172.6458       11.98220 153.4235       10.19611 118.8917 4.142028 112.0959 3.737805 6.795769       5.579210 
1 1 1 -13 11 13 o 68.07938 2.835940 56.60456       4.694579 54.50951       7.496633 57.95621       6.021451 66.67091 4.643188 68.84039 3.601930 -2.169479      5.876487 
1 1 1 -13 11 14 o 192.8188 3.432556 453.4381       16.12884 429.2569       22.79695 477.6731       22.82232 187.4413 4.995312 197.8197 4.734282 -10.37842      6.882337 
1 1 1 -13 11 15 o 104.2457 3.219507 132.6557       8.168885 134.4153       10.62988 130.1176       12.76649 104.8705 4.167777 103.0979 5.097227 1.772568       6.584230 
1 1 1 -13 11 16 o 157.0199 3.621300 300.7762       13.85655 298.5872       17.33480 304.6504       23.06090 156.3262 4.555274 157.7466 6.010012 -1.420380      7.541270 
1 1 1 -13 11 17 f 247.6903 4.726671 749.1720       28.52991 726.5096       34.69554 796.4911       50.13483 243.7738 5.840506 254.7272 8.086839 -10.95332      9.975393 
1 1 1 -13 11 18 o 81.45493 3.044531 81.03362       6.032661 58.70605       10.57684 91.79945       7.344444 68.97781 6.364023 86.67479 3.484304 -17.69698      7.255423 
1 1 1 -13 11 19 o 220.0121 3.757535 590.7186       20.14585 567.3781       28.55500 613.8494       28.42651 215.3679 5.445195 224.1168 5.204908 -8.748901      7.532677 
1 1 1 -13 11 20 o 206.2354 3.604329 519.0436       18.11440 520.8938       26.31785 517.3781       24.97048 206.3599 5.237694 205.7599 4.980007 0.5999603      7.227304 
1 1 1 -13 11 21 o 113.1942 3.133553 156.4363       8.635337 142.5795       15.15610 163.0968       10.50769 107.7874 5.791366 115.5318 3.737157 -7.744431      6.892479 
1 1 1 -13 11 22 o 86.23992 2.782871 90.81165       5.840750 91.52335       8.995683 90.29296       7.679677 86.45313 4.283233 85.92525 3.676130 0.5278854      5.644468 
1 1 1 -13 11 23 o 114.3687 2.844939 159.5690       7.928962 160.7897       11.88737 158.5907       10.64217 114.6401 4.262555 113.8965 3.839768 0.7436447      5.737002 
1 1 1 -13 11 24 o 165.3098 3.738659 333.7243       15.06089 306.4851       26.96113 346.0799       18.15818 157.8150 7.028205 168.2069 4.433749 -10.39189      8.309862 
1 1 1 -13 11 25 o 147.5760 3.083857 265.8038       11.09037 263.2131       16.23839 268.0687       15.18305 146.6417 4.549619 148.0373 4.213021 -1.395584      6.200692 
1 1 1 -13 11 26 o 110.5479 3.312621 149.3481       8.913910 157.8517       11.67358 137.4555       13.80518 113.5503 4.226086 105.7890 5.372663 7.761253       6.835591 
1 1 1 -13 11 27 f 153.4859 3.171576 287.6335       11.86259 280.9590       17.18589 293.7075       16.39456 151.4428 4.662350 154.8975 4.347594 -3.454712      6.374879 
1 1 1 -13 11 28 o 83.16064 3.395100 84.62205       6.865819 83.84547       8.929902 85.74485       10.73756 82.65182 4.450026 83.45881 5.307047 -0.8069916     6.925856 
1 1 1 -13 11 29 o 73.29799 3.049515 65.72593       5.435122 75.36369       8.399434 58.78360       7.128774 78.33404 4.418016 69.17495 4.249433 9.159088       6.129971 
1 1 1 -13 11 30 o 176.5068 3.399860 380.8288       14.62375 393.5632       21.57719 370.0101       19.88811 179.0442 4.950118 173.6638 4.703793 5.380386       6.828567 
1 1 1 -13 11 31 f 38.76260 4.463815 18.65871       4.139630 21.50186       6.197418 16.36823       5.562549 41.28962 6.363493 35.86517 6.607913 5.424450       9.173798 
1 1 1 -13 11 32 o 71.91276 4.350135 63.66707       7.587680 70.71037       10.51175 56.00507       10.96372 75.51966 5.755223 66.91090 6.819160 8.608757       8.923203 
1 1 1 -13 11 33 o 74.24227 3.125232 67.55349       5.641534 62.14473       8.279828 72.24041       7.707545 70.91203 4.820082 76.61353 4.143753 -5.701500      6.356404 
1 1 1 -13 11 34 o 90.77711 3.064662 100.9953       6.769740 108.7682       10.04835 94.53483       9.160798 93.92300 4.402477 87.57119 4.305957 6.351807       6.158171 
1 1 1 -13 11 35 o 38.00431 4.385657 18.03473       3.987246 16.01057       5.865221 19.77394       5.436758 35.12021 7.097618 39.47663 5.826405 -4.356422      9.182765 
1 1 1 -13 11 36 o 74.96919 3.676750 69.35990       6.696630 63.65055       8.349473 79.65532       11.21212 71.48135 4.821458 79.62000 5.818865 -8.138657      7.556828 
1 1 1 -13 11 37 o 55.49271 5.576457 38.98977       7.438910 41.89512       12.22978 37.28358       9.372016 55.78778 9.324744 53.51366 7.383285 2.274124       11.89385 
1 1 1 -13 11 38 o 14.87946 5.965386 1.511514       3.290772 5.148626       4.897346 -1.482596      4.443409 21.05111 7.534371 14.12356 6.312374 6.927549       9.829182 
1 1 1 -13 11 39 o 47.54160 3.868104 28.33807       4.442652 32.03996       6.609195 25.28663       6.000532 49.87003 5.531333 44.16440 5.708894 5.705631       7.949033 
1 1 1 -13 11 40 o 35.48785 4.746178 16.24663       4.001681 22.47116       5.895085 10.92732       5.449596 41.18319 6.054585 27.90182 7.742583 13.28138       9.828814 
1 1 1 -13 11 41 o 39.51694 4.793779 20.31498       4.522045 25.87573       7.487457 17.12202       5.673672 42.93977 7.423979 35.10073 6.879107 7.839035       10.12115 
1 1 1 -13 11 42 o 26.01679 6.301404 9.552507       3.952298 4.757360       5.524907 14.57825       5.656192 20.00438 7.820506 31.50781 7.479242 -11.50343      10.82125 
1 1 1 -13 11 43 o 9.759830 4.887521 -12.18351      4.933343 -12.18351      4.933343 0.000000       0.000000 9.759830 4.887521 ?        ?        0.000000       4.887521 
1 1 1 -13 11 44 o 15.85850 6.762458 1.752327       4.603741 2.014898       8.336672 1.637122       5.522104 19.08586 8.579161 16.67992 7.260562 2.405943       11.23912 
1 1 1 -13 11 45 o 14.99587 6.559428 1.117708       4.554623 -2.686108      5.767776 7.418979       7.423568 14.05578 6.604337 21.38925 8.815215 -7.333469      11.01478 
1 1 1 -13 11 46 o 18.56134 6.728220 5.372203       3.920099 8.820102       5.941476 2.714204       5.216684 21.99320 8.228589 16.44544 7.108082 5.547756       10.87357 
1 1 1 -13 11 47 o 15.63373 6.636401 2.854245       4.398897 -3.373312      8.434154 5.181287       5.155666 15.32802 7.411679 18.00859 7.375875 -2.680573      10.45641 
1 1 1 -13 11 48 o 13.40858 5.948813 1.029059       3.872275 -4.493154      6.148239 4.659758       4.985277 12.85645 6.242846 17.11601 7.153258 -4.259561      9.494326 
1 1 1 -13 12 1  o 176.0949 2.982944 378.0453       12.80053 378.9420       20.84706 377.5026       16.21778 176.1549 4.861042 175.9384 3.782638 0.2165375      6.159389 
1 1 1 -13 12 2  o 272.5625 3.929747 906.0475       26.10159 883.7172       41.08676 921.1578       33.79799 268.9857 6.268110 274.7411 5.048136 -5.755463      8.048161 
1 1 1 -13 12 3  o 15.62307 6.224838 1.485589       3.560851 -4.229589      4.854807 8.140306       5.238681 13.43670 6.228255 25.70291 7.734491 -12.26621      9.930433 
1 1 1 -13 12 4  o 250.9840 3.695671 768.1639       22.60349 770.7282       36.31200 766.5418       28.88123 251.2406 5.930950 250.6535 4.728309 0.5870514      7.585056 
1 1 1 -13 12 5  o 186.2634 3.038153 422.9629       13.79029 410.2588       21.91859 431.2865       17.74181 183.2973 4.911476 188.0547 3.871486 -4.757416      6.253879 
1 1 1 -13 12 6  o 249.1472 4.074920 757.1074       24.74065 783.7700       36.29982 733.9772       33.80986 253.3577 5.879417 245.1968 5.658386 8.160904       8.159955 
1 1 1 -13 12 7  f 164.6062 2.853847 330.3078       11.44756 316.6357       18.31923 339.0670       14.66301 161.0274 4.673378 166.7492 3.608472 -5.721756      5.904366 
1 1 1 -13 12 8  o 179.3872 2.972282 392.3156       12.99324 379.5768       20.82204 400.4393       16.62788 176.3011 4.851156 181.2039 3.765592 -4.902771      6.141124 
1 1 1 -13 12 9  o 187.9209 3.049971 430.5529       13.96712 421.5968       22.47877 436.1851       17.82577 185.7943 4.969286 189.1102 3.868096 -3.315857      6.297299 
1 1 1 -13 12 10 o 106.6156 2.766196 138.6668       7.180797 149.4166       16.53094 136.1666       7.972222 110.4197 6.167998 105.6329 3.100375 4.786835       6.903370 
1 1 1 -13 12 11 o 372.7254 5.647084 1696.716       51.29197 1731.910       74.09101 1664.326       71.07833 376.1062 8.083862 368.7326 7.910238 7.373627       11.31020 
1 1 1 -13 12 12 o 284.6675 4.517898 988.9570       31.34082 991.3025       45.03337 986.7540       43.64448 284.7627 6.489561 284.1351 6.303304 0.6275635      9.046880 
1 1 1 -13 12 13 o 167.5490 3.203369 342.3427       13.07931 333.1182       18.97773 350.6881       18.05092 165.1265 4.721038 169.4601 4.374811 -4.333603      6.436394 
1 1 1 -13 12 14 o 289.0472 4.581765 1019.881       32.27288 1066.239       47.45932 980.0054       44.01638 295.2500 6.596225 283.0938 6.380399 12.15616       9.177128 
1 1 1 -13 12 15 f 335.0583 7.398266 1374.903       60.40688 1374.903       60.40688 0.000000       0.000000 335.0583 7.398266 ?        ?        0.000000       7.398266 
1 1 1 -13 12 16 o 91.79962 3.281854 102.9212       7.329880 113.3725       9.644388 88.62862       11.27838 96.29200 4.119582 84.98620 5.474933 11.30580       6.851704 
1 1 1 -13 12 17 o 60.80741 3.002162 45.20444       4.434879 34.41794       6.873507 52.89749       5.804798 52.79268 5.419670 65.74374 3.637413 -12.95106      6.527143 
1 1 1 -13 12 18 o 268.2267 4.328980 878.4360       28.29591 869.4438       40.44971 887.0530       39.59682 266.5554 6.227187 269.2762 6.034290 -2.720886      8.671247 
1 1 1 -13 12 19 o 107.7021 2.812686 141.5645       7.375813 134.2994       10.98362 147.5316       9.954146 104.7839 4.310653 109.8848 3.722699 -5.100815      5.695632 
1 1 1 -13 12 20 o 373.3730 6.533510 1707.846       59.44641 1694.512       103.2082 1714.465       72.72089 369.6670 11.47079 373.5962 7.987679 -3.929169      13.97791 
1 1 1 -13 12 21 o 63.66801 3.311986 49.59841       5.120946 45.42096       9.390150 51.36674       6.109408 60.54477 6.464324 64.74583 3.890083 -4.201069      7.544550 
1 1 1 -13 12 22 o 181.2525 3.380816 400.9599       14.93281 401.7180       21.79171 400.2888       20.50348 181.1853 4.940124 180.9060 4.654782 0.2792358      6.787623 
1 1 1 -13 12 23 o 33.33012 5.111934 13.90238       4.019725 14.02636       9.493019 13.87529       4.437154 33.69691 10.46490 33.20086 5.688841 0.4960480      11.91121 
1 1 1 -13 12 24 o 75.42850 2.908955 69.52591       5.336957 67.68343       8.243452 70.85547       7.002635 74.25896 4.577625 76.07079 3.789457 -1.811829      5.942612 
1 1 1 -13 12 25 o 66.93158 3.011662 54.78578       4.899587 59.02686       7.565807 51.72245       6.430039 69.32806 4.502626 64.92628 4.084732 4.401772       6.079365 
1 1 1 -13 12 26 o 76.83831 3.409539 72.24566       6.368346 70.25536       8.500124 74.79226       9.614966 75.63276 4.634140 77.98396 5.087256 -2.351204      6.881528 
1 1 1 -13 12 27 o 97.52830 2.926034 116.2131       6.946319 121.5600       10.60042 112.1893       9.195795 99.58289 4.378904 95.71478 3.951017 3.868111       5.897910 
1 1 1 -13 12 28 o 156.7417 3.233505 300.0867       12.35078 297.7812       17.97092 302.1504       17.00256 155.8478 4.737380 157.0454 4.447240 -1.197601      6.497746 
1 1 1 -13 12 29 o 202.2040 3.670025 499.9437       18.08401 495.4896       26.13688 504.0341       25.04722 200.8348 5.345212 202.6411 5.076192 -1.806229      7.371500 
1 1 1 -13 12 30 o 70.46930 3.173231 60.80692       5.435282 54.54313       7.922220 66.37737       7.470917 66.49296 4.924113 73.50303 4.188262 -7.010071      6.464397 
1 1 1 -13 12 31 o 67.12065 3.964673 55.36670       6.455960 51.34278       7.853954 63.75027       11.33647 64.45258 5.040548 71.53661 6.576538 -7.084030      8.286011 
1 1 1 -13 12 32 o 103.9989 3.368070 132.4987       8.524574 139.2593       14.65661 129.0426       10.47939 106.0993 5.689525 102.4773 4.205291 3.622009       7.074968 
1 1 1 -13 12 33 f 60.18898 3.410314 44.51450       4.981577 45.98269       7.430530 43.31585       6.713881 60.87668 5.054332 59.14698 4.696595 1.729702       6.899585 
1 1 1 -13 12 34 o 45.06073 3.987835 25.14706       4.333807 24.16405       6.308501 26.02560       5.963866 43.69455 6.089893 45.52766 5.485904 -1.833111      8.196460 
1 1 1 -13 12 35 o 45.76037 4.015416 25.98711       4.432375 23.81138       6.618029 27.75688       5.968778 43.15063 6.494866 46.99799 5.304141 -3.847359      8.385535 
1 1 1 -13 12 36 o 49.92100 10.25768 34.01868       12.06109 34.01868       12.06109 0.000000       0.000000 49.92100 10.25768 ?        ?        0.000000       10.25768 
1 1 1 -13 12 37 o 59.01865 3.469287 43.12199       4.967592 46.61867       7.492687 40.37951       6.635608 60.82980 5.101532 56.67646 4.851032 4.153336       7.039754 
1 1 1 -13 12 38 o 43.87252 4.069061 24.15522       4.300764 25.78278       6.459233 22.85903       5.764313 44.56627 6.108091 42.05952 5.776448 2.506756       8.406910 
1 1 1 -13 12 39 o 32.65921 4.970082 13.79277       3.830950 12.93056       5.644652 14.52907       5.216237 30.58148 7.605972 32.81206 6.749009 -2.230581      10.16858 
1 1 1 -13 12 40 o 30.05902 5.399817 11.96884       3.810023 12.64480       5.442833 11.31935       5.335153 29.96769 7.477669 28.30793 7.582279 1.659754       10.64925 
1 1 1 -13 12 41 o 39.25135 5.231702 20.37953       4.879688 23.36366       8.079183 18.66576       6.122590 39.61614 8.614731 36.34299 7.167973 3.273148       11.20685 
1 1 1 -13 12 42 o 20.38187 6.767367 5.814529       3.923757 8.616447       5.687158 3.269199       5.420503 23.97910 8.148969 18.42358 7.556318 5.555529       11.11322 
1 1 1 -13 12 43 o 24.93660 7.725819 9.688165       5.177461 15.89081       9.285664 6.889848       6.236958 29.26114 10.38518 21.74683 8.361693 7.514303       13.33304 
1 1 1 -13 12 44 o 35.32959 5.292975 17.38647       4.416825 12.81237       6.092360 22.45409       6.412605 27.58035 8.349959 38.43321 7.108631 -10.85286      10.96606 
1 1 1 -13 12 45 o 26.73998 6.605690 11.11655       4.278902 5.215580       6.185421 16.53202       5.925507 19.22708 7.996393 31.51775 7.766072 -12.29067      11.14694 
1 1 1 -13 12 46 o 15.62010 6.391779 2.976249       3.867283 2.093941       6.026487 3.593948       5.042460 16.40366 7.339958 16.89393 7.135241 -0.4902649     10.23653 
1 1 1 -13 12 47 o 33.14779 5.658836 16.70495       4.407117 17.85753       7.059023 15.96873       5.641720 29.16895 9.018376 29.70418 7.723090 -0.5352287     11.87338 
1 1 1 -13 12 48 o 15.05419 6.289968 2.932819       3.853132 3.196513       5.723870 2.714301       5.210535 16.19724 7.206586 15.62755 6.918625 0.5696859      9.990108 
1 1 1 -13 13 1  o 73.17178 2.717799 65.36183       4.837731 69.42110       9.521156 63.94913       5.616804 75.22697 5.226233 72.34885 3.193692 2.878120       6.124800 
1 1 1 -13 13 2  o 220.8706 3.791167 595.0106       20.40549 574.5065       28.99917 615.1193       28.71832 216.8413 5.492336 224.4670 5.250136 -7.625656      7.598005 
1 1 1 -13 13 3  o 182.5429 4.024599 406.4680       17.90291 393.4975       21.69462 434.1568       31.69743 179.4856 4.964821 188.3245 6.918628 -8.838837      8.515684 
1 1 1 -13 13 4  o 137.9189 2.980821 231.9107       10.01834 222.7449       14.56024 240.1514       13.80597 135.0434 4.430447 140.2536 4.043622 -5.210236      5.998311 
1 1 1 -13 13 5  o 258.2539 3.780001 813.4492       23.78893 781.1002       37.21385 835.8028       30.93491 252.8723 6.039031 261.6945 4.850855 -8.822128      7.746011 
1 1 1 -13 13 6  o 231.5159 3.496366 653.6426       19.72576 704.7857       33.04929 625.3412       24.58510 240.2372 5.645285 226.3878 4.456387 13.84943       7.192261 
1 1 1 -13 13 7  o 126.7954 2.596368 195.9850       8.022432 212.7856       13.79103 187.3920       9.862914 131.9938 4.293242 123.9241 3.268832 8.069611       5.396035 
1 1 1 -13 13 8  o 111.6988 2.828107 152.2076       7.691852 162.3516       11.86622 144.8565       10.10147 115.2784 4.231223 108.9103 3.811975 6.368172       5.695120 
1 1 1 -13 13 9  o 104.1957 2.787600 132.4562       7.071734 149.9087       16.62507 128.6009       7.813885 110.5869 6.193878 102.6494 3.127386 7.937553       6.938636 
1 1 1 -13 13 10 o 503.8707 6.638280 3104.270       81.50999 3167.212       131.1444 3064.651       104.0476 507.5842 10.60243 500.0755 8.538082 7.508698       13.61288 
1 1 1 -13 13 11 o 332.7348 4.601858 1351.341       37.31364 1378.797       60.42674 1334.420       47.43846 335.6341 7.388003 330.4600 5.890818 5.174072       9.449039 
1 1 1 -13 13 12 o 70.35052 2.893698 60.44908       4.950267 58.67878       7.889167 61.59874       6.357617 69.17062 4.708364 70.96465 3.689010 -1.794029      5.981428 
1 1 1 -13 13 13 o 235.9674 4.591737 679.7452       26.40372 688.2338       33.06143 664.7973       43.87257 237.3107 5.717000 232.8195 7.743588 4.491165       9.625344 
1 1 1 -13 13 14 o 23.53258 8.083296 6.180523       5.598881 6.180523       5.598881 0.000000       0.000000 23.53258 8.083296 ?        ?        0.000000       8.083296 
1 1 1 -13 13 15 o 129.7952 3.465844 205.6628       10.95254 209.7856       13.95673 199.0539       17.67072 131.0165 4.377558 127.4806 5.702627 3.535904       7.189087 
1 1 1 -13 13 16 o 307.7397 4.825971 1156.745       36.19131 1162.293       52.00868 1151.537       50.39400 308.0771 6.927561 306.6888 6.742872 1.388306       9.667338 
1 1 1 -13 13 17 o 80.67165 2.823892 79.46266       5.542873 76.66273       8.595520 81.45582       7.252183 79.10732 4.477089 81.62117 3.655386 -2.513847      5.779808 
1 1 1 -13 13 18 o 154.7696 3.124264 292.1978       11.78337 296.3945       17.57162 288.7684       15.88425 155.7011 4.636264 153.7258 4.244236 1.975250       6.285577 
1 1 1 -13 13 19 o 13.65910 5.546392 0.8915740      2.884997 -6.401260      5.133169 4.258879       3.488018 12.80598 6.080639 19.18277 6.380887 -6.376793      8.814186 
1 1 1 -13 13 20 o 202.4448 3.594953 500.2426       17.73520 503.0663       25.89221 497.7469       24.34220 202.7481 5.244947 201.7809 4.950437 0.9672089      7.212233 
1 1 1 -13 13 21 o 211.6663 4.210037 547.2950       21.71570 527.9239       37.65897 556.9448       26.57987 207.1870 7.471046 213.3949 5.111315 -6.207916      9.052186 
1 1 1 -13 13 22 o 79.80544 3.312463 77.86764       6.427979 73.64935       13.30493 79.15202       7.341647 77.11507 7.161915 80.42310 3.756454 -3.308037      8.087273 
1 1 1 -13 13 23 o 163.5216 3.746331 326.5691       14.92854 327.4075       28.27491 326.2450       17.57834 163.0792 7.132111 163.3062 4.421187 -0.2270203     8.391298 
1 1 1 -13 13 24 o 264.4114 4.326638 854.7237       27.87834 859.0674       40.28889 850.7332       38.61613 264.6011 6.248237 263.3813 6.016554 1.219849       8.674064 
1 1 1 -13 13 25 o 200.8148 4.179877 493.0207       20.45480 504.9226       26.05946 473.9190       33.01361 202.9545 5.273498 196.1936 6.915948 6.760849       8.697133 
1 1 1 -13 13 26 o 98.47354 2.925507 118.4673       7.012534 113.9642       10.46129 122.1419       9.450067 96.41048 4.464840 99.88991 3.889627 -3.479424      5.921486 
1 1 1 -13 13 27 o 228.7769 3.932686 639.9678       21.92490 624.7457       31.27106 654.6855       30.74853 225.5358 5.694273 231.0162 5.461926 -5.480362      7.890335 
1 1 1 -13 13 28 o 96.58809 2.977572 114.0324       7.000080 127.0111       10.82197 104.6956       9.178918 101.7613 4.374241 92.41338 4.085973 9.347954       5.985746 
1 1 1 -13 13 29 f 65.54964 3.288834 52.64315       5.236712 54.99974       7.955866 50.84164       6.956077 66.78177 4.923314 64.26384 4.469683 2.517929       6.649593 
1 1 1 -13 13 30 o 48.27895 3.871587 28.71237       4.516793 14.75704       6.695689 40.36602       6.118660 33.79150 8.212611 57.21754 4.422551 -23.42604      9.327697 
1 1 1 -13 13 31 o 117.6468 5.934889 171.1976       16.95993 171.1976       16.95993 0.000000       0.000000 117.6468 5.934889 ?        ?        0.000000       5.934889 
1 1 1 -13 13 32 o 45.15844 4.055625 25.21558       4.415577 28.54123       6.931960 22.94481       5.728017 47.65784 6.109096 42.75869 5.634197 4.899151       8.310549 
1 1 1 -13 13 33 o 65.55298 3.400526 52.80067       5.413615 46.39617       7.906392 58.45359       7.427999 61.04361 5.369653 68.78268 4.455534 -7.739071      6.977460 
1 1 1 -13 13 34 o 101.1033 3.078634 125.3811       7.576235 122.3279       11.14245 128.0064       10.33220 99.45374 4.610060 101.8764 4.170637 -2.422638      6.216660 
1 1 1 -13 13 35 o 36.50481 5.514662 16.95468       4.752936 16.98432       6.042830 16.90658       7.696595 36.07618 7.126475 35.52905 8.907295 0.5471306      11.40730 
1 1 1 -13 13 36 o 29.52135 6.515246 11.43485       4.561350 10.32106       10.08836 11.72106       5.113925 29.41466 10.77353 29.75368 7.143557 -0.3390179     12.92669 
1 1 1 -13 13 37 o 18.79263 6.440997 4.217517       3.554394 10.03950       5.498091 0.3723504E-01  4.658856 27.34547 7.843524 15.67149 6.745002 11.67398       10.34485 
1 1 1 -13 13 38 o 46.11619 4.049770 26.71947       4.504966 27.62798       6.708824 25.97340       6.079528 46.03811 6.132250 44.81719 5.695022 1.220917       8.368856 
1 1 1 -13 13 39 o 16.65613 6.398523 2.712154       3.649821 13.70871       5.571703 -5.553364      4.830530 31.46669 7.392441 12.26231 5.844041 19.20438       9.423429 
1 1 1 -13 13 40 o 33.72209 5.170597 14.97173       4.113724 15.59627       6.183220 14.47576       5.510149 32.99512 7.811772 32.09293 7.220759 0.9021950      10.63782 
1 1 1 -13 13 41 o 22.23561 6.715533 6.971377       3.944111 11.40740       5.592441 2.581454       5.563304 27.70135 7.899307 18.18450 7.574881 9.516855       10.94431 
1 1 1 -13 13 42 o 19.97191 7.956991 4.865393       5.817864 4.770252       8.232759 4.960301       8.222655 21.26977 9.055703 21.38651 9.075666 -0.1167393     12.82082 
1 1 1 -13 13 43 o 15.54962 6.366483 2.208725       3.839403 -2.404200      5.391021 6.956581       5.469298 14.08621 6.540979 21.53117 7.924805 -7.444963      10.27555 
1 1 1 -13 13 44 o 15.42325 6.615232 1.634077       4.452175 0.9614820      5.710993 2.676168       7.108661 16.17415 7.197264 18.33546 8.101005 -2.161308      10.83637 
1 1 1 -13 13 45 o 30.12837 5.979749 13.58663       4.235346 22.44027       6.619350 7.449371       5.511146 36.92187 7.610033 20.96160 7.907455 15.96028       10.97454 
1 1 1 -13 13 46 o 10.41076 5.071275 -5.164569      4.145211 -12.86300      7.670938 -1.989373      4.926435 12.33233 6.163642 12.96090 6.094211 -0.6285744     8.667750 
1 1 1 -13 13 47 o 10.61538 5.088743 -3.220117      3.778651 -3.953304      6.118351 -2.768027      4.804401 13.12453 6.337997 12.22523 5.826884 0.8993053      8.609459 
1 1 1 -13 14 1  o 486.7986 8.302305 2903.878       98.48817 3015.634       174.6862 2851.801       119.2479 492.9787 14.55695 481.7343 10.15797 11.24442       17.75075 
1 1 1 -13 14 2  o 395.1288 6.946260 1909.761       66.88454 1902.443       81.77287 1924.551       116.2569 393.9848 8.517138 394.9175 12.09451 -0.9327087     14.79253 
1 1 1 -13 14 3  o 20.42118 5.379642 5.276480       2.713953 2.278762       4.972133 6.548610       3.239016 18.64421 7.379148 22.72290 5.823290 -4.078690      9.400134 
1 1 1 -13 14 4  o 345.3302 4.762563 1455.646       40.07850 1436.253       63.27557 1468.639       51.79254 342.5510 7.580096 346.6635 6.130881 -4.112518      9.749131 
1 1 1 -13 14 5  o 261.3589 3.829725 833.2708       24.39164 788.7977       37.89892 864.7184       31.86931 254.0590 6.121476 266.1451 4.913808 -12.08603      7.849712 
1 1 1 -13 14 6  o 189.1278 3.096078 436.1643       14.26932 473.4356       24.04371 415.8994       17.72910 196.8568 5.016132 184.6381 3.940301 12.21867       6.378680 
1 1 1 -13 14 7  o 227.1361 3.461407 629.2183       19.15910 607.4506       30.31293 643.6986       24.72356 222.9296 5.584265 229.6646 4.417544 -6.735001      7.120303 
1 1 1 -13 14 8  o 241.8889 3.611096 713.6887       21.28585 738.4784       34.87951 698.9775       26.86946 245.8409 5.822105 239.3014 4.607629 6.539505       7.424766 
1 1 1 -13 14 9  o 260.6364 4.252690 828.9872       27.01063 942.6794       59.79509 799.8409       30.27555 277.0800 8.867144 255.9536 4.853943 21.12643       10.10876 
1 1 1 -13 14 10 o 137.6363 2.688173 230.9669       9.016259 216.8172       14.59059 239.7080       11.46790 133.2014 4.501449 140.1916 3.356802 -6.990158      5.615262 
1 1 1 -13 14 11 o 243.5597 4.068663 723.8950       24.14867 720.0817       34.50804 727.5545       33.80556 242.7233 5.834085 243.9986 5.685450 -1.275284      8.146219 
1 1 1 -13 14 12 o 360.7429 5.531563 1590.246       48.62749 1678.985       71.61072 1514.315       66.24195 370.1022 7.939996 351.5387 7.732571 18.56351       11.08315 
1 1 1 -13 14 13 o 191.1689 4.060318 446.0155       18.91531 436.2765       23.41621 464.3040       32.08843 188.9141 5.091107 194.6496 6.775193 -5.735458      8.474822 
1 1 1 -13 14 14 o 139.2536 3.529739 236.7299       11.96837 249.5375       15.55444 218.1423       18.73846 142.8918 4.472455 133.4509 5.775716 9.440903       7.304913 
1 1 1 -13 14 15 o 302.7968 4.776351 1119.882       35.24387 1157.091       51.55456 1087.235       48.29016 307.3818 6.882605 298.0089 6.649566 9.372864       9.570109 
1 1 1 -13 14 16 f 95.09040 2.842952 110.3727       6.580431 109.3296       10.16327 111.1257       8.634724 94.51820 4.424753 95.35337 3.723160 -0.8351746     5.782764 
1 1 1 -13 14 17 o 92.42980 2.818600 104.2904       6.341235 102.8260       9.719140 105.3759       8.367586 91.65731 4.363890 92.84704 3.705692 -1.189728      5.725006 
1 1 1 -13 14 18 o 74.12712 2.893353 67.12489       5.216508 71.03759       8.390491 64.65960       6.660147 76.12082 4.543901 72.68385 3.773107 3.436966       5.906215 
1 1 1 -13 14 19 o 20.08960 6.007010 4.992133       3.167429 6.517056       5.705464 4.312775       3.808171 23.97234 8.161829 19.56133 6.667920 4.411016       10.53929 
1 1 1 -13 14 20 o 139.5324 3.069616 237.5447       10.43747 233.9130       15.66957 240.4412       13.99379 138.2620 4.657345 140.2467 4.098953 -1.984619      6.204214 
1 1 1 -13 14 21 o 133.1257 3.468080 216.4865       11.24131 201.9718       21.34441 222.0578       13.22392 128.1026 6.862429 134.7695 4.031075 -6.666885      7.958800 
1 1 1 -13 14 22 o 116.7896 3.894092 166.7940       11.06723 0.000000       0.000000 166.7940       11.06723 ?        ?        116.7896 3.894092 0.000000       3.894092 
1 1 1 -13 14 23 o 310.1082 4.902300 1176.722       37.04667 1189.302       53.51670 1165.146       51.33517 311.0555 7.060173 307.9627 6.840388 3.092773       9.830409 
1 1 1 -13 14 24 o 219.8853 3.829726 590.7559       20.52107 584.2796       29.68055 596.6871       28.40387 218.2649 5.584816 220.7098 5.281046 -2.444885      7.686327 
1 1 1 -13 14 25 o 135.7752 3.548856 225.3477       11.73201 227.8942       15.22927 221.6305       18.39998 136.3932 4.588481 134.3197 5.633869 2.073486       7.265992 
1 1 1 -13 14 26 o 233.8409 3.995000 668.6238       22.76530 692.9435       33.57541 647.9294       30.97194 237.5921 5.799001 229.8225 5.530185 7.769577       8.013199 
1 1 1 -13 14 27 o 208.0135 3.726758 528.9932       18.89117 510.0311       26.98756 547.2111       26.45276 203.7942 5.439065 211.2457 5.138626 -7.451538      7.482574 
1 1 1 -13 14 28 o 124.9350 3.022560 190.6535       9.202275 191.5429       13.69786 189.9219       12.42327 124.9585 4.505701 124.4999 4.100376 0.4586334      6.092161 
1 1 1 -13 14 29 o 11.92693 5.409249 -1.979674      3.401553 -6.368924      5.546761 0.6659870      4.306370 13.51328 6.388202 15.96313 6.658168 -2.449847      9.227151 
1 1 1 -13 14 30 o 35.22068 6.138362 15.73415       5.077084 14.97726       6.209748 17.26026       8.817629 34.07208 7.665011 36.42265 9.744091 -2.350563      12.39757 
1 1 1 -13 14 31 o 68.71690 3.640136 57.99305       6.073865 56.93616       10.27277 58.56112       7.531311 67.55291 6.313456 68.90915 4.509731 -1.356239      7.758698 
1 1 1 -13 14 32 o 24.70504 6.843303 7.827768       4.261378 15.28536       5.978479 0.1256681      6.075695 34.36915 7.360009 18.19328 7.763690 16.17587       10.69788 
1 1 1 -13 14 33 o 124.7543 3.123914 190.7805       9.489623 177.0843       13.64498 203.6105       13.20647 119.7388 4.685338 128.5674 4.220936 -8.828629      6.306242 
1 1 1 -13 14 34 o 62.29433 3.461984 47.81408       5.234776 47.34166       8.077398 48.15619       6.873620 61.48547 5.447224 62.26508 4.561727 -0.7796173     7.105041 
1 1 1 -13 14 35 o 118.2265 3.607934 172.3279       10.38248 174.2874       13.47215 169.4621       16.29279 118.4273 4.677393 116.1835 5.772673 2.243790       7.429789 
1 1 1 -13 14 36 o 31.39061 6.188460 12.87282       4.565549 27.32992       10.66553 9.629354       5.051797 44.32634 10.09979 26.91007 7.449796 17.41627       12.55011 
1 1 1 -13 14 37 o 20.16079 6.431466 5.173124       3.562584 6.823856       5.416356 3.914415       4.729678 23.29405 7.951917 19.45278 7.328219 3.841276       10.81368 
1 1 1 -13 14 38 o 22.47005 6.420572 6.745472       3.690953 10.93375       5.785867 3.871491       4.792836 28.08181 8.043467 19.30309 7.352816 8.778713       10.89776 
1 1 1 -13 14 39 o 57.30196 3.614743 41.21272       5.021856 43.47733       7.632651 39.48407       6.668540 57.79206 5.485324 55.35544 4.997255 2.436623       7.420332 
1 1 1 -13 14 40 o 15.69954 6.544862 1.439021       4.157918 -5.518051      7.109065 5.056281       5.126124 15.41665 7.271039 20.36198 7.638015 -4.945330      10.54549 
1 1 1 -13 14 41 o 18.05313 7.132065 3.515338       4.636899 8.488914       8.220618 1.194563       5.615477 24.32202 9.530348 17.02230 7.366101 7.299725       12.04521 
1 1 1 -13 14 42 o 29.54601 6.663266 12.76150       4.682812 14.89845       5.673853 8.195918       8.293332 31.28066 7.533601 23.42513 9.442671 7.855530       12.07970 
1 1 1 -13 14 43 o 20.29278 6.864654 6.112519       4.035422 3.040170       5.646490 9.320069       5.769392 17.82585 7.540736 23.89941 8.205591 -6.073565      11.14425 
1 1 1 -13 14 44 o 29.74144 6.903062 13.79119       4.906501 20.32613       6.321779 3.891306       7.780969 35.61879 7.519655 19.17517 8.473563 16.44361       11.32901 
1 1 1 -13 14 45 o 42.75101 4.603573 25.34274       4.720477 26.72144       7.051617 24.22326       6.354239 40.31544 7.452062 39.03187 6.934546 1.283573       10.17945 
1 1 1 -13 14 46 o 12.41909 5.738757 -0.9873235     4.074600 -3.674876      8.222096 -0.1124355     4.691161 15.12303 7.313859 13.69459 6.265303 1.428442       9.630502 
1 1 1 -13 14 47 o 22.76653 6.975178 9.215481       4.234497 20.18391       6.782766 2.210143       5.420622 31.79555 8.563757 15.50825 6.948622 16.28730       11.02820 
1 1 1 -13 15 1  o 451.7539 6.013270 2494.974       66.19859 2369.770       101.0100 2589.235       87.64418 439.1989 9.437716 459.6759 7.824116 -20.47693      12.25917 
1 1 1 -13 15 2  o 273.1780 4.495332 910.9546       29.92565 874.8737       41.40097 950.4319       43.30579 267.4685 6.351873 278.7756 6.374632 -11.30713      8.999012 
1 1 1 -13 15 3  o 133.2904 2.715529 216.6167       8.820422 201.9834       14.22380 225.7598       11.24324 128.5527 4.547608 136.0491 3.391249 -7.496399      5.672857 
1 1 1 -13 15 4  o 295.3226 4.205066 1064.354       30.26255 1063.897       48.32935 1064.648       38.81388 294.8968 6.725194 295.2128 5.395302 -0.3159790     8.621921 
1 1 1 -13 15 5  o 140.0896 2.735924 239.2811       9.339982 223.4963       14.98929 249.2997       11.94166 135.2338 4.554913 142.9650 3.427669 -7.731277      5.700539 
1 1 1 -13 15 6  o 187.6354 3.111619 429.3520       14.22779 416.8426       22.81674 437.3108       18.19947 184.6794 5.074707 189.3165 3.944884 -4.637146      6.427656 
1 1 1 -13 15 7  o 110.6520 2.603272 149.2768       7.019641 155.5293       11.93802 145.9725       8.678482 112.7998 4.351141 109.3529 3.260338 3.446922       5.437116 
1 1 1 -13 15 8  o 299.5116 4.247005 1094.859       30.99791 1079.381       49.14732 1105.083       39.94497 297.0017 6.790547 300.7445 5.450398 -3.742798      8.707375 
1 1 1 -13 15 9  o 216.2051 4.361874 570.5830       22.98133 572.5901       41.13970 569.6726       27.70751 216.0152 7.828155 215.9438 5.265269 0.7139587E-01  9.434144 
1 1 1 -13 15 10 o 204.0678 3.645185 508.0594       18.12717 550.6146       27.25969 474.3234       24.27117 212.2936 5.269239 196.9943 5.060118 15.29927       7.305456 
1 1 1 -13 15 11 f 222.5970 4.440467 604.9208       24.08708 598.8641       29.89424 616.1306       40.66940 221.2892 5.547967 224.1280 7.456595 -2.838867      9.294125 
1 1 1 -13 15 12 o 234.6397 3.550935 671.6932       20.30393 705.1909       33.70422 652.6122       25.43770 240.1663 5.758855 231.1908 4.515140 8.975540       7.317848 
1 1 1 -13 15 13 o 180.2443 3.032548 396.2357       13.32003 421.6890       22.43649 382.3818       16.55273 185.7257 4.961761 177.0133 3.837316 8.712433       6.272485 
1 1 1 -13 15 14 o 192.3375 4.093801 451.5836       19.18787 440.1511       23.78982 472.8655       32.45829 189.7158 5.150550 196.3838 6.792633 -6.668060      8.524554 
1 1 1 -13 15 15 o 78.06420 2.916095 74.42852       5.537652 73.05673       8.889301 75.29849       7.079077 77.18803 4.748858 78.46247 3.712892 -1.274445      6.028036 
1 1 1 -13 15 16 o 126.1471 2.965729 194.1009       9.116847 203.9159       14.08574 187.0249       11.95987 129.1308 4.483043 123.7102 3.972354 5.420578       5.989764 
1 1 1 -13 15 17 o 24.16466 5.622355 7.430490       3.248318 16.45626       6.119853 3.890249       3.832791 35.99734 7.227780 19.00978 6.678792 16.98757       9.841091 
1 1 1 -13 15 18 o 99.34065 2.880260 120.4807       6.965238 123.7822       10.82863 118.1507       9.096825 100.5601 4.429748 98.30185 3.804633 2.258217       5.839340 
1 1 1 -13 15 19 o 178.9873 3.386310 390.9954       14.77015 413.6502       22.29067 373.2629       19.72090 183.8558 4.979776 174.6938 4.636574 9.161957       6.804116 
1 1 1 -13 15 20 o 115.1817 3.888139 162.2105       10.89779 0.000000       0.000000 162.2105       10.89779 ?        ?        115.1817 3.888139 0.000000       3.888139 
1 1 1 -13 15 21 o 146.9764 3.589449 263.7678       12.85616 248.9782       23.94102 269.7607       15.23989 142.2220 6.928650 148.5179 4.215086 -6.295837      8.110064 
1 1 1 -13 15 22 o 266.9310 4.378448 871.0886       28.48100 894.4519       41.78683 850.8190       38.92203 269.9878 6.351250 263.4021 6.063733 6.585663       8.781073 
1 1 1 -13 15 23 o 176.0618 3.393872 378.5089       14.56119 369.1721       21.23328 386.7982       20.00668 173.5817 5.024980 177.7558 4.622574 -4.174057      6.827782 
1 1 1 -13 15 24 o 47.67462 3.983536 27.97369       4.585723 16.38325       8.476808 32.76901       5.452443 35.72471 9.552375 51.57690 4.379474 -15.85218      10.50846 
1 1 1 -13 15 25 f 153.3417 3.722225 287.3634       13.90910 278.8205       17.68375 301.2225       22.52374 150.8168 4.817769 156.5290 5.915505 -5.712189      7.629161 
1 1 1 -13 15 26 o 107.2104 3.020466 140.4614       7.883403 133.3058       11.93148 146.0055       10.50239 104.2200 4.710108 109.1944 3.953386 -4.974358      6.149340 
1 1 1 -13 15 27 o 150.8506 3.220851 278.0187       11.84006 293.3087       18.01555 266.3931       15.70914 154.6184 4.787116 147.4306 4.377338 7.187820       6.486722 
1 1 1 -13 15 28 o 114.3269 3.039414 159.7928       8.460360 155.6846       12.63760 163.1293       11.38908 112.6002 4.615417 115.3652 4.057461 -2.765045      6.145329 
1 1 1 -13 15 29 o 86.43388 3.039886 91.40869       6.392942 103.2013       10.07490 83.46001       8.271489 91.62283 4.526344 82.43659 4.130603 9.186234       6.127779 
1 1 1 -13 15 30 o 129.1783 3.733361 204.5436       11.74005 200.8519       14.49659 211.5791       20.01239 127.7927 4.662861 130.6684 6.303405 -2.875702      7.840611 
1 1 1 -13 15 31 o 122.5979 3.108014 184.0150       9.277942 189.4904       14.05199 179.7832       12.35348 124.0430 4.656947 120.9406 4.197978 3.102394       6.269783 
1 1 1 -13 15 32 o 78.97425 3.923597 76.77921       7.527382 77.07628       9.275434 76.20615       12.88279 78.91625 4.846537 77.86890 6.859099 1.047348       8.398582 
1 1 1 -13 15 33 o 38.20545 4.596785 18.26786       4.193847 12.97870       6.186487 22.76537       5.704749 31.41948 8.045786 42.45315 5.654808 -11.03366      9.834202 
1 1 1 -13 15 34 o 45.60843 4.154637 25.88484       4.566943 23.89713       6.736376 27.57549       6.212635 43.11864 6.622404 46.71387 5.566908 -3.595222      8.651399 
1 1 1 -13 15 35 o 34.39734 6.125358 15.32299       4.946179 6.736597       10.62114 17.70078       5.589239 27.10249 10.76635 36.92563 6.445762 -9.823141      12.54839 
1 1 1 -13 15 36 o 79.68796 3.176170 78.40797       6.155476 71.38142       8.952231 84.70901       8.477474 75.33990 4.902700 82.41579 4.235249 -7.075882      6.478720 
1 1 1 -13 15 37 o 49.67789 3.779612 30.85730       4.541240 28.73869       6.901757 32.47483       6.030602 46.94931 6.182569 50.51606 4.962857 -3.566746      7.928058 
1 1 1 -13 15 38 o 39.20568 4.467314 19.61796       4.192014 18.90340       6.699192 20.07781       5.374210 36.94331 7.691682 39.07809 5.820816 -2.134781      9.645925 
1 1 1 -13 15 39 o 41.66766 4.415012 22.28987       4.414856 24.48306       6.709846 20.61553       5.862659 42.36496 6.723684 39.01553 6.387048 3.349430       9.273743 
1 1 1 -13 15 40 o 50.20380 5.357291 33.44308       6.453016 0.000000       0.000000 33.44308       6.453016 ?        ?        50.20380 5.357291 0.000000       5.357291 
1 1 1 -13 15 41 o 16.72472 6.424270 3.191096       3.679017 -1.933934      5.224474 8.232395       5.181621 14.35017 6.582633 23.45010 7.776506 -9.099927      10.18848 
1 1 1 -13 15 42 o 19.17753 7.349928 4.878050       4.808243 6.407446       5.771934 1.410185       8.691455 21.10376 8.061625 19.27574 8.703633 1.828020       11.86352 
1 1 1 -13 15 43 o 23.53097 7.384120 8.797280       4.713464 4.230554       5.827722 17.43522       8.014959 18.74226 7.775413 30.61180 9.632147 -11.86954      12.37882 
1 1 1 -13 15 44 o 30.03057 6.228052 13.62535       4.408117 12.27318       6.382228 14.85882       6.095677 25.80649 8.632397 29.12390 8.227717 -3.317411      11.92533 
1 1 1 -13 15 45 o 20.27028 6.704315 6.747916       3.852001 6.879796       5.638625 6.632511       5.274673 19.90496 7.864445 19.69904 7.658399 0.2059212      10.97727 
1 1 1 -13 15 46 o 13.58630 6.147343 0.3653876      4.362197 -12.88687      8.920965 4.529777       5.000837 13.21801 6.612380 17.29402 7.191039 -4.076007      9.769064 
1 1 1 -13 16 1  o 185.4244 3.371253 419.4156       15.23331 409.9800       21.40559 429.0977       21.68341 183.1552 4.800058 187.3853 4.752331 -4.230087      6.754643 
1 1 1 -13 16 2  o 189.0181 4.103353 436.0616       18.90072 462.7689       32.24631 422.0842       23.32810 194.3132 6.820490 185.8021 5.157186 8.511063       8.550769 
1 1 1 -13 16 3  f 69.96239 2.947744 59.79686       5.014369 50.31649       7.673128 66.86333       6.624626 63.99308 4.959107 73.93674 3.688403 -9.943657      6.180377 
1 1 1 -13 16 4  o 107.2934 3.328939 140.5540       8.693389 126.7668       11.26826 160.8264       13.66375 101.7945 4.554048 114.6482 4.901964 -12.85378      6.690934 
1 1 1 -13 16 5  o 137.9147 3.076756 231.9707       10.34046 228.3789       15.23238 235.0407       14.08247 136.6892 4.579427 138.7078 4.170955 -2.018631      6.194192 
1 1 1 -13 16 6  o 159.3542 3.240500 309.7314       12.58380 288.5982       17.90426 330.3618       17.69003 153.6533 4.787499 164.4434 4.418447 -10.79007      6.514815 
1 1 1 -13 16 7  o 179.9246 3.879143 395.0395       17.00836 376.4436       29.20873 404.5798       20.92123 175.2276 6.853500 181.9576 4.722241 -6.729965      8.322862 
1 1 1 -13 16 8  o 72.40965 3.525342 64.11621       6.201927 68.51015       12.95203 62.80902       7.064477 74.44402 7.230535 71.62286 4.064230 2.821159       8.294492 
1 1 1 -13 16 9  o 292.1723 4.181670 1041.990       29.77316 1133.418       50.14958 992.2244       36.99926 304.2805 6.763277 284.9506 5.328284 19.32986       8.610024 
1 1 1 -13 16 10 o 42.05301 3.508612 21.72495       3.562842 18.45930       6.453952 23.15638       4.272928 38.20389 7.196310 43.36497 4.091811 -5.161076      8.278273 
1 1 1 -13 16 11 o 94.39755 2.586700 108.7340       5.944746 121.0757       10.64486 103.1403       7.166402 99.48363 4.401784 91.89848 3.204955 7.585144       5.444946 
1 1 1 -13 16 12 f 17.80914 6.047979 3.580701       3.132581 -15.69375      8.397109 6.696788       3.376320 14.66387 7.159457 22.97551 5.975046 -8.311642      9.325181 
1 1 1 -13 16 13 o 106.7007 3.432362 139.0507       8.913144 143.1686       11.51346 132.8917       14.08074 108.1914 4.375969 104.1027 5.570725 4.088692       7.083931 
1 1 1 -13 16 14 o 73.22561 2.635115 65.47186       4.694507 73.82884       8.655091 61.98846       5.587891 77.60784 4.597057 71.20930 3.228541 6.398544       5.617509 
1 1 1 -13 16 15 o 225.7132 3.477365 621.7047       19.12684 584.5963       30.05509 646.9629       24.79608 218.5278 5.648584 230.1441 4.421270 -11.61636      7.173153 
1 1 1 -13 16 16 o 129.5929 3.013962 204.8764       9.518203 201.2841       14.28128 207.7474       12.76717 128.2700 4.576172 130.3747 4.023327 -2.104691      6.093317 
1 1 1 -13 16 17 o 143.4550 3.109364 251.0858       10.86984 258.8265       16.47620 245.1203       14.46414 145.4543 4.654292 141.6006 4.196341 3.853714       6.266715 
1 1 1 -13 16 18 o 142.2856 3.120587 247.0310       10.82015 240.6068       16.11027 252.3103       14.60434 140.2150 4.721631 143.6562 4.176213 -3.441223      6.303535 
1 1 1 -13 16 19 o 192.8419 4.062576 454.2833       19.09146 456.7735       34.99755 453.2283       22.77930 192.6405 7.469261 192.4505 4.861083 0.1900330      8.911789 
1 1 1 -13 16 20 o 59.97782 4.054543 44.14984       5.891267 0.000000       0.000000 44.14984       5.891267 ?        ?        59.97782 4.054543 0.000000       4.054543 
1 1 1 -13 16 21 o 162.6250 3.282673 322.8506       13.00921 320.6598       19.26309 324.6878       17.63953 161.8130 4.890746 162.8984 4.447754 -1.085419      6.610742 
1 1 1 -13 16 22 o 81.26005 2.998089 80.70088       5.926693 81.23362       9.413888 80.35108       7.628207 81.34048 4.770200 81.00109 3.875764 0.3393936      6.146247 
1 1 1 -13 16 23 o 85.29469 3.034668 88.91860       6.297624 88.25877       9.998284 89.35254       8.108177 84.77247 4.860250 85.41661 3.905671 -0.6441422     6.235085 
1 1 1 -13 16 24 o 59.73059 3.829006 43.78508       5.544031 42.51294       8.022979 44.94769       7.669826 58.59571 5.690235 60.33154 5.269647 -1.735832      7.755511 
1 1 1 -13 16 25 o 195.7665 4.098433 468.7865       19.55205 473.4523       34.91334 466.6547       23.59987 195.7708 7.331205 195.0807 4.968355 0.6900635      8.856134 
1 1 1 -13 16 26 o 118.0916 3.048499 170.4354       8.765525 177.7648       13.48390 165.0712       11.53553 120.3750 4.605163 116.0768 4.084450 4.298187       6.155506 
1 1 1 -13 16 27 o 152.4923 3.247847 284.1749       12.06923 289.0992       18.11382 280.2433       16.18544 153.4546 4.849977 151.1850 4.397861 2.269531       6.547019 
1 1 1 -13 16 28 o 49.48238 3.695037 30.12407       4.423423 31.02976       7.323029 29.60378       5.550426 49.80768 6.164827 48.90163 4.716084 0.9060478      7.761865 
1 1 1 -13 16 29 f 19.99944 7.410385 3.904611       4.796152 4.231349       5.860881 3.242227       8.344841 21.51878 8.146237 23.38761 9.456099 -1.868830      12.48115 
1 1 1 -13 16 30 o 55.18116 3.888420 37.51267       5.195297 36.12421       9.096889 38.18474       6.328970 53.44537 7.165021 55.53303 4.721488 -2.087658      8.580791 
1 1 1 -13 16 31 o 21.23797 7.462076 5.033408       4.784571 0.9068255      5.847844 13.38943       8.321478 18.45463 7.732474 32.21787 9.759696 -13.76324      12.45162 
1 1 1 -13 16 32 o 62.75338 3.404479 48.44370       5.186741 54.64574       8.240902 44.37522       6.674572 66.27272 5.142970 59.80910 4.615196 6.463623       6.910150 
1 1 1 -13 16 33 o 54.96746 3.646070 37.32172       4.856295 38.77944       7.455190 36.24728       6.400505 55.54022 5.583962 53.86397 4.930820 1.676247       7.449404 
1 1 1 -13 16 34 o 33.29317 5.785294 14.26008       4.523462 14.99083       6.718737 13.65423       6.117704 33.46792 8.283161 32.01992 7.891735 1.448002       11.44073 
1 1 1 -13 16 35 o 26.65092 7.498585 9.448485       5.073794 -2.853503      9.857162 13.88273       5.917987 20.74685 9.327029 32.16436 7.660406 -11.41750      12.06960 
1 1 1 -13 16 36 o 38.21474 4.566802 18.51640       4.168752 22.41649       6.401492 15.64454       5.493204 41.31099 6.579335 34.28501 6.814954 7.025978       9.472658 
1 1 1 -13 16 37 o 18.80512 6.499246 4.309965       3.621422 4.342622       5.706967 4.287950       4.685666 20.62411 7.980344 19.65964 7.316945 0.9644680      10.82698 
1 1 1 -13 16 38 o 53.16241 3.787276 35.59793       4.874322 41.81792       7.619242 31.28868       6.341879 56.59343 5.597969 49.00658 5.399801 7.586849       7.777860 
1 1 1 -13 16 39 o 44.52094 4.914332 25.85483       5.243073 17.78307       10.75219 28.37289       6.005459 32.69707 11.20272 46.34075 5.420261 -13.64367      12.44509 
1 1 1 -13 16 40 o 21.99928 6.660952 6.878170       3.876808 4.644779       5.528040 9.039661       5.438329 19.86305 7.805626 24.63846 7.954737 -4.775406      11.14476 
1 1 1 -13 16 41 o 27.23819 7.283873 11.20269       4.928431 10.12944       5.868560 13.77090       9.078101 25.33481 8.269783 27.86159 10.21739 -2.526775      13.14475 
1 1 1 -13 16 42 o 20.40320 6.914155 6.164540       4.093928 5.076652       6.117647 7.046851       5.509385 19.82598 8.066946 21.51090 7.947399 -1.684925      11.32417 
1 1 1 -13 16 43 o 32.26417 6.725678 15.89381       5.116382 5.908759       6.180739 37.63189       9.119599 20.03916 8.125094 48.08835 8.067596 -28.04919      11.45003 
1 1 1 -13 16 44 o 13.41304 6.000264 0.1599544      4.024614 0.8301370      5.754276 -0.4818326     5.631053 15.65514 7.074123 14.78125 6.800031 0.8738861      9.812422 
1 1 1 -13 16 45 o 10.52598 5.109505 -4.736426      4.109422 -8.317510      8.398361 -3.609110      4.712053 14.00815 6.903608 11.88465 5.693315 2.123503       8.948388 
1 1 1 -13 16 46 o 23.15878 6.924014 9.388394       4.208459 6.130388       6.731338 11.47910       5.392272 18.62706 8.062676 24.28585 7.927079 -5.658794      11.30687 
1 1 1 -13 17 1  o 249.3028 4.747044 759.1785       28.83941 863.2128       53.57314 716.7296       34.22095 265.0295 8.305258 242.0840 5.800827 22.94554       10.13049 
1 1 1 -13 17 2  o 305.6999 5.548327 1142.494       41.33267 1133.699       71.11985 1146.979       50.79079 303.3513 9.632959 306.0398 6.810375 -2.688446      11.79725 
1 1 1 -13 17 3  o 23.50872 5.590512 7.028242       3.155667 0.3290781      5.517813 10.28438       3.846874 17.70424 7.470033 28.49679 5.738282 -10.79255      9.419621 
1 1 1 -13 17 4  o 224.2408 3.489948 613.4835       19.07084 611.0144       30.65693 615.0420       24.35738 223.4848 5.633664 224.4335 4.453556 -0.9486694     7.181387 
1 1 1 -13 17 5  o 63.44035 2.888891 49.18383       4.454424 46.93349       7.647857 50.33916       5.479852 61.76626 5.127219 64.13750 3.519562 -2.371235      6.218978 
1 1 1 -13 17 6  o 141.5907 2.801484 244.4790       9.666269 225.9084       15.43851 256.4531       12.39692 135.9256 4.667808 144.9819 3.508844 -9.056274      5.839556 
1 1 1 -13 17 7  o 319.0767 4.498245 1243.218       34.97633 1272.875       56.54500 1224.839       44.51390 322.3101 7.199201 316.4857 5.771722 5.824341       9.227202 
1 1 1 -13 17 8  o 202.8897 3.671335 502.3056       18.15182 498.4939       38.11445 503.4237       20.64319 201.4529 7.778517 203.0717 4.171490 -1.618790      8.826474 
1 1 1 -13 17 9  o 233.9607 3.577570 667.8994       20.39704 670.1663       33.02070 666.5007       25.93690 234.0877 5.788574 233.6121 4.556031 0.4756012      7.366478 
1 1 1 -13 17 10 o 165.8392 2.947626 335.4359       11.91231 343.9170       19.79380 330.6198       14.91589 167.7121 4.848247 164.5964 3.718715 3.115784       6.110184 
1 1 1 -13 17 11 o 126.5668 2.716040 195.3531       8.377068 195.9787       14.10205 195.0120       10.41352 126.5866 4.579040 126.3811 3.384313 0.2055817      5.693960 
1 1 1 -13 17 12 o 193.4792 3.186378 456.6776       15.02339 459.7720       24.64993 454.8489       18.94956 193.8630 5.222526 193.0204 4.028652 0.8425751      6.595818 
1 1 1 -13 17 13 o 140.0628 3.144057 239.3286       10.73123 259.5244       16.40049 224.2085       14.19072 145.6741 4.625825 135.4243 4.305502 10.24974       6.319462 
1 1 1 -13 17 14 f 250.5825 3.744900 766.4926       22.86794 819.6437       38.41905 737.3292       28.45829 258.7328 6.093391 245.6309 4.754334 13.10196       7.728720 
1 1 1 -13 17 15 o 42.39130 3.388132 22.06951       3.470929 22.67139       6.546905 21.83420       4.093581 42.52972 6.524928 42.09248 4.040384 0.4372368      7.674593 
1 1 1 -13 17 16 o 74.02262 2.747488 66.92667       4.947457 75.23547       9.032314 63.36524       5.913472 78.30994 4.755520 71.97671 3.380881 6.333229       5.834837 
1 1 1 -13 17 17 o 126.9391 3.446324 196.8320       10.65089 191.1070       19.98204 199.1041       12.58820 124.6558 6.601494 127.6087 4.053203 -2.952911      7.746495 
1 1 1 -13 17 18 o 83.25092 3.355068 84.73426       6.792599 103.3357       14.74767 79.72560       7.652649 91.53445 6.657045 80.69915 3.902981 10.83530       7.716833 
1 1 1 -13 17 19 o 231.4877 4.551217 655.1902       25.67389 679.7579       46.95977 644.7161       30.66216 234.7314 8.222236 229.4507 5.483747 5.280701       9.883149 
1 1 1 -13 17 20 o 60.40332 3.316968 44.67593       4.863713 46.83341       8.154580 43.48463       6.059507 61.59287 5.490438 59.49953 4.206259 2.093334       6.916468 
1 1 1 -13 17 21 o 85.38263 3.022731 89.09064       6.279419 96.88152       10.12980 84.22842       8.002481 88.86324 4.694462 82.92590 3.971573 5.937340       6.149095 
1 1 1 -13 17 22 o 108.1998 2.995566 143.0099       7.890842 142.3776       12.16842 143.4687       10.36576 107.7678 4.644401 108.2736 3.935187 -0.5057831     6.087377 
1 1 1 -13 17 23 o 76.40527 3.154464 71.40207       5.860706 69.51598       9.427876 72.58995       7.482010 75.14273 5.180321 76.95050 4.003750 -1.807770      6.547193 
1 1 1 -13 17 24 o 186.7123 4.124537 426.4359       18.76654 424.7918       23.98116 429.0334       30.14301 186.0426 5.294971 186.5859 6.639947 -0.5432587     8.492681 
1 1 1 -13 17 25 o 52.93931 3.628234 34.42014       4.652389 34.00960       7.892295 34.63877       5.759479 52.19864 6.333971 52.99542 4.502311 -0.7967873     7.771100 
1 1 1 -13 17 26 o 112.4015 3.069215 154.4545       8.399022 163.9894       13.18338 147.9404       10.89667 115.5681 4.690900 109.8628 4.077191 5.705307       6.215146 
1 1 1 -13 17 27 o 70.31924 3.334653 60.58655       5.697992 58.92529       9.229597 61.60965       7.243087 69.00794 5.534796 70.79488 4.217535 -1.786934      6.958561 
1 1 1 -13 17 28 o 70.02613 4.137296 60.30829       7.028669 60.64011       8.766328 59.71103       11.76112 70.03737 5.172823 69.06236 7.088812 0.9750137      8.775497 
1 1 1 -13 17 29 o 35.78483 4.699158 16.00107       3.998914 13.40270       6.216651 17.83512       5.222908 32.14388 7.974792 37.56825 5.899155 -5.424370      9.919543 
1 1 1 -13 17 30 o 70.18295 4.893900 60.96435       8.317507 52.79089       11.20782 70.98390       12.40916 64.67232 7.235455 75.22670 6.844002 -10.55438      9.959527 
1 1 1 -13 17 31 o 48.96610 3.944180 29.64963       4.666608 28.43320       7.525647 30.40957       5.948303 47.28895 6.719443 49.37487 5.013107 -2.085922      8.383446 
1 1 1 -13 17 32 o 62.48294 3.454461 48.09158       5.239434 50.09145       8.236382 46.73221       6.790531 63.29012 5.391567 61.33951 4.575806 1.950607       7.071562 
1 1 1 -13 17 33 o 73.99819 3.299742 67.43722       5.935311 69.62824       9.109289 65.82081       7.824123 74.67210 5.035434 72.79322 4.431710 1.878883       6.707880 
1 1 1 -13 17 34 o 30.27136 7.226613 12.17603       5.256916 2.493298       10.17004 15.70640       6.140937 23.98682 10.13222 34.35104 7.542965 -10.36422      12.63164 
1 1 1 -13 17 35 o 28.34880 5.674410 10.49924       3.783154 13.37719       6.165705 8.761534       4.791032 31.34757 8.034833 25.62684 7.312645 5.720734       10.86431 
1 1 1 -13 17 36 o 23.68144 6.807230 7.506804       4.136977 1.614702       6.100740 12.52265       5.628848 18.75632 7.880884 30.20644 7.642262 -11.45012      10.97782 
1 1 1 -13 17 37 o 42.17027 4.308408 22.61426       4.365360 20.48984       6.924152 24.01569       5.623822 38.47521 7.654390 42.92664 5.502491 -4.451427      9.426934 
1 1 1 -13 17 38 o 16.09722 6.319165 2.402404       3.619805 0.9786462      5.931028 3.247534       4.569552 17.64826 7.603243 18.09904 7.101446 -0.4507790     10.40384 
1 1 1 -13 17 39 o 26.67518 6.726156 10.11244       4.370681 1.057879       7.633496 14.52856       5.331018 19.12946 8.425605 31.89725 7.046539 -12.76780      10.98383 
1 1 1 -13 17 40 f 23.81254 6.545478 8.204997       3.915388 3.007511       5.798876 12.55982       5.308016 18.43207 7.709929 28.91352 7.477973 -10.48145      10.74072 
1 1 1 -13 17 41 f 20.34566 7.478014 5.898324       4.867190 4.123706       5.764129 10.30704       9.085255 19.02976 7.797104 24.83220 9.926723 -5.802441      12.62278 
1 1 1 -13 17 42 o 21.06811 6.947563 6.770834       4.137582 10.23126       6.094567 3.812355       5.635238 24.59386 8.434007 18.31669 7.626320 6.277178       11.37072 
1 1 1 -13 17 43 o 24.12500 6.610171 9.117637       4.000469 13.05573       5.756324 5.438790       5.563629 27.44838 8.070678 19.21092 7.737556 8.237455       11.18059 
1 1 1 -13 17 44 o 13.29022 5.924998 0.3696987      3.889009 -0.4876793     5.878993 1.036805       5.185783 14.83923 6.869804 15.11635 6.782907 -0.2771168     9.654120 
1 1 1 -13 17 45 o 12.64008 5.876972 -1.199054      4.373587 2.778042       8.756289 -2.521078      5.048433 17.68106 8.252421 12.73585 6.042379 4.945209       10.22804 
1 1 1 -13 18 1  o 165.0568 3.872031 332.5528       15.57429 327.2450       25.38447 335.7570       19.72262 163.3566 6.389011 165.6893 4.890007 -2.332733      8.045597 
1 1 1 -13 18 2  o 204.6547 3.253605 510.9713       16.22642 479.7535       24.63893 534.8806       21.56274 198.0566 5.109275 209.2973 4.227700 -11.24078      6.631601 
1 1 1 -13 18 3  o 214.5900 3.763333 562.0152       19.67969 638.8552       41.73572 540.0457       22.31639 228.1019 7.518595 210.2947 4.354712 17.80719       8.688659 
1 1 1 -13 18 4  o 117.1574 2.722862 167.3871       7.773770 151.4382       12.45672 177.5605       9.948837 111.2522 4.604673 120.5891 3.388901 -9.336914      5.717313 
1 1 1 -13 18 5  o 292.1026 4.212934 1041.781       29.98860 1031.976       47.68079 1048.198       38.57304 290.2568 6.741009 292.8052 5.405912 -2.548340      8.640896 
1 1 1 -13 18 6  o 197.5146 3.248610 475.9287       15.63626 485.1592       25.59159 470.4302       19.75181 199.1497 5.277940 196.2956 4.129146 2.854111       6.701231 
1 1 1 -13 18 7  o 243.4898 3.696469 723.5529       21.93330 712.1139       35.12914 730.8611       28.07874 241.2429 5.975536 244.5930 4.710832 -3.350037      7.609137 
1 1 1 -13 18 8  o 140.1882 3.136460 239.7411       10.71488 257.5102       24.34359 235.4714       11.93295 144.7978 6.919025 138.8678 3.529087 5.930008       7.767069 
1 1 1 -13 18 9  o 94.54671 2.678110 109.1010       6.164149 102.9626       10.32771 112.4978       7.682631 91.68837 4.637309 95.96801 3.289956 -4.279640      5.685811 
1 1 1 -13 18 10 o 212.6191 3.382783 551.6149       17.52720 547.6102       28.32383 554.1000       22.31238 211.5255 5.499482 213.0034 4.298564 -1.477905      6.980111 
1 1 1 -13 18 11 o 22.85970 5.702721 6.645374       3.166144 11.37020       6.359326 5.088202       3.650789 29.98739 8.379802 20.55247 6.505232 9.434925       10.60845 
1 1 1 -13 18 12 o 63.47686 3.370088 49.30710       5.194380 45.89018       8.150015 51.64461       6.740890 60.99722 5.543409 64.88446 4.287274 -3.887238      7.007860 
1 1 1 -13 18 13 o 255.0075 3.809756 793.9229       23.67479 804.7314       38.48240 787.3408       30.03034 256.3253 6.160765 253.7903 4.855669 2.534958       7.844269 
1 1 1 -13 18 14 o 274.5107 4.512073 920.8338       30.18363 877.6166       42.03089 966.8549       43.37294 267.5896 6.445599 280.8926 6.336397 -13.30307      9.038566 
1 1 1 -13 18 15 o 216.8658 4.383789 574.6917       23.16737 572.9691       41.71572 575.4599       27.85852 215.6920 7.950116 216.8721 5.271306 -1.180145      9.538920 
1 1 1 -13 18 16 o 17.05981 6.468269 2.527486       3.698494 -0.5863724     8.058881 3.358318       4.162766 20.63849 8.876833 18.70537 6.908671 1.933121       11.24846 
1 1 1 -13 18 17 o 104.4514 2.940900 133.2258       7.478219 131.2935       17.07583 133.6844       8.318343 103.1935 6.828781 104.6043 3.267262 -1.410858      7.570155 
1 1 1 -13 18 18 o 137.2767 3.136404 230.0001       10.49216 242.4095       16.30254 221.2255       13.70860 140.6980 4.761650 134.4798 4.188222 6.218170       6.341492 
1 1 1 -13 18 19 o 205.0638 4.232294 514.0284       21.14954 513.3920       38.18840 514.3100       25.40071 204.0397 7.694129 204.9734 5.085250 -0.9337006     9.222765 
1 1 1 -13 18 20 o 154.5968 3.277241 291.8061       12.34653 271.1559       17.95984 310.3099       17.00086 148.7488 4.961591 159.2350 4.385409 -10.48616      6.621873 
1 1 1 -13 18 21 o 99.71173 3.044092 121.4807       7.388073 108.3372       11.20333 131.5951       9.827891 93.94092 4.910967 103.6939 3.896226 -9.752998      6.268826 
1 1 1 -13 18 22 o 96.31662 3.075626 113.3789       7.209644 108.2170       11.31941 116.9024       9.351956 93.86379 4.966355 97.70959 3.935670 -3.845802      6.336733 
1 1 1 -13 18 23 o 20.36160 6.960734 4.693151       4.150538 -1.352193      6.445468 8.975855       5.425041 17.83744 7.802721 26.71344 7.829696 -8.875996      11.05380 
1 1 1 -13 18 24 o 72.52246 3.241850 64.38096       5.714818 51.63284       9.061557 72.79997       7.363943 64.56705 5.821575 77.04774 3.935095 -12.48069      7.026785 
1 1 1 -13 18 25 o 122.8969 3.107375 184.6347       9.298702 184.0954       14.25026 185.0346       12.27124 122.4428 4.785094 122.8806 4.103728 -0.4378052     6.303785 
1 1 1 -13 18 26 o 34.07682 5.092929 14.56483       4.099690 21.71062       7.552293 11.57941       4.881538 41.19064 7.809634 30.03597 6.824895 11.15467       10.37158 
1 1 1 -13 18 27 o 232.5319 4.778020 663.9456       27.07488 645.0612       33.07102 702.3305       47.14933 228.6466 5.940388 237.2779 8.166388 -8.631332      10.09842 
1 1 1 -13 18 28 o 158.6290 4.758117 309.5498       18.37225 299.0663       25.77980 320.3693       26.18962 155.1320 6.836123 160.6307 6.705338 -5.498718      9.575706 
1 1 1 -13 18 29 f 60.12248 5.261913 44.91488       7.631703 58.51237       10.91008 31.88649       10.67933 68.32700 6.635860 49.51891 9.188079 18.80809       11.33382 
1 1 1 -13 18 30 o 136.2845 3.197115 227.5304       10.61795 233.0584       16.19797 223.3654       14.06006 137.3697 4.846346 134.6759 4.289588 2.693817       6.472066 
1 1 1 -13 18 31 o 47.71639 3.771992 28.16244       4.350407 30.71073       7.298560 26.75811       5.418117 49.24240 6.220785 46.26944 4.878623 2.972961       7.905639 
1 1 1 -13 18 32 o 111.4433 3.127490 152.5795       8.485084 179.7314       13.65859 135.5156       10.82791 120.3657 4.665417 104.6533 4.254632 15.71238       6.314112 
1 1 1 -13 18 33 o 44.40713 5.487559 25.03623       5.812164 23.45610       11.90148 25.53111       6.660406 40.75248 11.49095 44.57157 6.308143 -3.819096      13.10857 
1 1 1 -13 18 34 o 30.17248 5.673358 11.83475       4.018369 11.67266       6.599539 11.93025       5.065655 29.35422 8.644415 29.89517 7.065896 -0.5409451     11.16480 
1 1 1 -13 18 35 f 24.32944 6.282175 7.885237       3.750255 7.941248       6.288979 7.854329       4.671786 24.87618 8.566151 24.27602 7.303781 0.6001663      11.25718 
1 1 1 -13 18 36 o 13.17489 5.745201 -0.3200541     3.470839 12.16152       6.272342 -5.828716      4.166949 29.40461 8.359365 10.95359 5.274798 18.45102       9.884457 
1 1 1 -13 18 37 o 13.29089 5.863791 -0.5860873     3.711792 -6.977808      5.874809 3.660699       4.788671 13.24808 6.349284 18.82866 7.303435 -5.580580      9.677478 
1 1 1 -13 18 38 o 10.12549 4.877649 -4.864963      3.570147 -2.687474      5.591039 -6.364072      4.639073 14.72820 6.775698 11.40985 5.512145 3.318343       8.734633 
1 1 1 -13 18 39 o 24.42524 6.526048 8.537887       3.958359 8.317977       5.988469 8.708522       5.275079 23.73226 8.347470 24.21100 7.835923 -0.4787331     11.44910 
1 1 1 -13 18 40 o 19.11131 7.276505 4.740546       4.692547 8.877828       5.766054 -3.373807      8.075105 23.91846 8.203513 16.78023 7.862144 7.138226       11.36270 
1 1 1 -13 18 41 o 13.88057 5.975975 0.7968525      3.659155 4.304153       5.833025 -1.478952      4.698668 19.02397 7.824460 13.63280 6.249487 5.391167       10.01390 
1 1 1 -13 18 42 o 16.77600 6.863668 3.205138       4.458487 8.639100       5.826079 -4.474645      6.926160 22.63309 8.202632 14.58154 6.962752 8.051554       10.75933 
1 1 1 -13 18 43 o 32.10095 5.575454 15.07127       4.203323 15.90301       6.246192 14.38287       5.682505 29.82603 8.293938 28.83074 7.869565 0.9952888      11.43326 
1 1 1 -13 18 44 o 19.11352 6.892331 6.038388       4.106914 4.926576       6.083985 6.969127       5.566552 18.19869 7.767577 19.86267 7.824450 -1.663980      11.02530 
1 1 1 -13 18 45 o 18.84659 7.208461 6.208341       4.618692 3.313920       9.529812 7.096946       5.280290 17.89867 8.434537 19.60556 7.650969 -1.706894      11.38766 
1 1 1 -13 19 1  o 84.45547 2.965680 87.11832       6.094158 82.08576       7.804695 94.97980       9.754700 81.90063 3.921900 88.04967 4.561770 -6.149040      6.015900 
1 1 1 -13 19 2  o 141.5644 2.747761 244.4271       9.479143 250.2572       14.94960 240.5071       12.25847 143.0757 4.292588 140.3295 3.587628 2.746155       5.594406 
1 1 1 -13 19 3  o 261.2301 4.312986 833.5123       27.45601 867.0205       55.82378 822.8202       31.53365 265.3189 8.645602 259.4426 4.987659 5.876282       9.981141 
1 1 1 -13 19 4  o 222.5968 3.866012 604.9094       20.97096 590.8433       41.09953 609.8607       24.38406 219.2282 7.705131 223.4316 4.478425 -4.203400      8.912089 
1 1 1 -13 19 5  o 216.3287 3.445216 571.0916       18.16213 547.6768       28.60710 586.9025       23.50751 211.5144 5.554870 219.1959 4.400866 -7.681519      7.086903 
1 1 1 -13 19 6  o 231.8798 3.596478 656.2454       20.32247 649.3790       32.61665 660.6025       25.98230 230.2769 5.817021 232.5254 4.585335 -2.248535      7.406959 
1 1 1 -13 19 7  o 86.78849 3.100264 92.00907       6.546342 108.4066       16.53091 88.95933       7.129167 93.71957 7.295630 85.31110 3.436265 8.408478       8.064374 
1 1 1 -13 19 8  o 54.24044 3.234581 36.02390       4.255988 33.81136       7.460399 37.09135       5.181929 52.21936 5.969808 54.98167 3.892732 -2.762314      7.126848 
1 1 1 -13 19 9  o 163.9611 2.998356 327.9555       11.98009 314.0978       19.33335 336.5933       15.26377 160.2152 4.957814 166.0475 3.772187 -5.832306      6.229712 
1 1 1 -13 19 10 o 99.70188 2.725229 121.3334       6.615077 111.4107       11.02585 126.9137       8.268542 95.35620 4.759948 101.9268 3.333414 -6.570549      5.811089 
1 1 1 -13 19 11 o 65.70512 2.943289 52.77162       4.700719 73.33643       9.043758 45.15905       5.502400 77.30585 4.824708 60.70535 3.737663 16.60050       6.103108 
1 1 1 -13 19 12 o 209.2113 3.807469 534.4283       19.41144 508.5197       27.22797 561.2072       27.68148 203.7738 5.488154 214.1774 5.303708 -10.40358      7.632113 
1 1 1 -13 19 13 o 218.9197 4.408797 585.6605       23.52021 658.7399       44.84314 557.9269       27.62498 231.2796 7.968410 213.5332 5.308851 17.74641       9.574940 
1 1 1 -13 19 14 o 221.2692 4.463931 598.3993       24.06991 537.2529       40.79799 631.0464       29.81092 208.7896 8.033501 227.0650 5.387523 -18.27533      9.672773 
1 1 1 -13 19 15 o 138.0180 3.115186 232.4650       10.47745 227.0594       22.24876 234.0054       11.87685 135.8495 6.741717 138.3996 3.524389 -2.550095      7.607369 
1 1 1 -13 19 16 o 200.8863 3.292706 492.6042       16.11905 503.9083       26.70708 486.1270       20.21640 202.7939 5.409078 199.4531 4.159364 3.340805       6.823373 
1 1 1 -13 19 17 o 91.98660 2.711022 103.3220       6.070433 103.6655       10.91741 103.1683       7.303560 91.91679 4.891651 91.87325 3.267394 0.4354095E-01  5.882526 
1 1 1 -13 19 18 o 122.1651 2.991858 182.1453       8.906851 211.0495       20.61506 175.5113       9.876232 130.9467 6.480453 119.8446 3.385104 11.10208       7.311306 
1 1 1 -13 19 19 o 215.7166 3.854786 568.6182       20.26375 576.6734       29.89922 561.7749       27.55826 216.8065 5.664004 214.1454 5.280887 2.661133       7.743947 
1 1 1 -13 19 20 f 183.4084 3.546839 410.9207       15.85246 436.9469       24.16357 391.2549       21.00445 188.7663 5.258039 178.7067 4.827612 10.05966       7.138124 
1 1 1 -13 19 21 f 49.02839 3.937701 29.57516       4.665110 32.24101       8.025977 28.21493       5.733037 50.77732 6.645560 47.73410 5.002790 3.043213       8.318135 
1 1 1 -13 19 22 o 45.00797 4.218766 24.99960       4.573187 20.61534       8.113945 27.04076       5.536320 40.05232 8.572073 46.72066 4.937281 -6.668343      9.892279 
1 1 1 -13 19 23 o 149.5917 3.804468 273.8367       13.85750 266.9105       17.89300 284.2172       21.90506 147.4586 4.986573 151.9404 5.927464 -4.481812      7.746015 
1 1 1 -13 19 24 o 31.10982 5.484536 12.23324       4.006011 11.23312       7.079572 12.70430       4.858686 29.87464 8.991670 31.53770 6.536870 -1.663065      11.11669 
1 1 1 -13 19 25 o 136.9099 3.215072 229.0944       10.72659 221.2258       16.24289 235.1800       14.28450 134.1602 4.976877 138.4958 4.237439 -4.335587      6.536451 
1 1 1 -13 19 26 o 243.9975 4.966608 731.4549       29.53121 725.9092       36.51015 741.9482       50.22177 242.4431 6.184755 243.6877 8.469994 -1.244598      10.48771 
1 1 1 -13 19 27 o 98.19344 3.975569 118.3805       9.493338 116.2921       12.00939 121.8595       15.50006 97.08564 5.093917 99.02038 6.458762 -1.934738      8.225788 
1 1 1 -13 19 28 o 26.43471 6.114287 8.992228       3.860295 9.566876       7.098022 8.750870       4.600085 27.90036 9.094061 26.08017 7.064612 1.820190       11.51567 
1 1 1 -13 19 29 o 13.12586 5.817976 -1.193729      3.695306 7.958104       8.194755 -3.529690      4.140136 26.90162 9.731183 12.35950 5.736751 14.54213       11.29629 
1 1 1 -13 19 30 o 19.74905 6.482846 4.701439       3.604131 2.298048       6.811475 5.635974       4.247434 20.71868 8.481008 21.52219 7.036093 -0.8035107     11.01971 
1 1 1 -13 19 31 o 59.62261 3.542179 43.86511       5.123370 50.31539       8.422882 40.07701       6.454788 63.33043 5.512605 56.70176 4.714022 6.628674       7.253331 
1 1 1 -13 19 32 o 92.49335 3.165171 105.2787       7.123663 112.9522       11.47737 100.4703       9.085477 95.13068 4.968133 90.03291 4.152230 5.097778       6.474825 
1 1 1 -13 19 33 o 46.99660 5.412956 28.08765       6.086119 27.95171       12.74893 28.12777       6.926311 43.94789 11.69830 46.71826 6.239741 -2.770367      13.25837 
1 1 1 -13 19 34 o 86.51011 3.249134 92.57461       6.837512 92.71466       10.80985 92.48120       8.827847 85.58136 5.207931 86.02450 4.224025 -0.4431381     6.705590 
1 1 1 -13 19 35 f 57.97029 3.747338 42.02535       5.265399 49.45504       9.180161 38.38290       6.427791 61.59514 6.200275 54.91427 4.853213 6.680874       7.873823 
1 1 1 -13 19 36 o 75.63140 3.456856 71.46708       6.354329 78.35291       10.23872 67.15340       8.103840 77.81236 5.433736 72.61739 4.603149 5.194969       7.121409 
1 1 1 -13 19 37 o 36.62204 4.814840 17.48539       4.192966 7.546391       6.684749 23.93208       5.383721 23.75295 8.757999 42.65581 5.292748 -18.90285      10.23307 
1 1 1 -13 19 38 o 40.99424 5.083844 22.27626       4.969917 30.84018       9.625154 19.16295       5.803404 44.72607 9.140024 36.93417 6.694335 7.791904       11.32935 
1 1 1 -13 19 39 o 29.78730 6.383759 12.68418       4.494535 17.13863       6.075933 7.301136       6.679288 33.80376 7.565034 22.55914 8.658481 11.24462       11.49778 
1 1 1 -13 19 40 o 16.37889 6.879755 2.157764       4.646887 2.498566       5.794724 1.543749       7.778054 17.71607 7.571647 18.68180 8.350476 -0.9657211     11.27210 
1 1 1 -13 19 41 o 38.55320 4.974450 20.42012       4.564679 17.72120       6.920465 22.49857       6.073084 32.24532 8.635058 38.88460 6.647758 -6.639275      10.89756 
1 1 1 -13 19 42 o 20.25867 6.814810 6.448883       3.977054 10.03364       6.207395 3.952712       5.179843 23.59814 8.478071 17.72217 7.339393 5.875973       11.21358 
1 1 1 -13 19 43 o 22.00990 6.571724 7.855646       3.793051 12.08259       6.045737 5.111784       4.870986 25.19191 8.401252 18.25053 7.277577 6.941380       11.11504 
1 1 1 -13 19 44 o 19.75780 7.095894 6.752280       4.347976 -0.8630311     8.175982 9.755226       5.134167 16.02500 7.627630 22.86531 7.742949 -6.840315      10.86895 
1 1 1 -13 20 1  o 142.3118 2.771188 247.0461       9.610436 227.1772       14.41480 262.9446       12.89436 136.2883 4.345797 146.7623 3.605365 -10.47398      5.646646 
1 1 1 -13 20 2  o 139.4738 2.747055 237.2830       9.336759 234.5034       14.39262 239.3027       12.26861 138.4821 4.270013 139.9653 3.599974 -1.483170      5.585053 
1 1 1 -13 20 3  f 227.0144 4.500717 629.7593       24.89839 610.7432       42.41005 639.7609       30.75684 222.7748 7.824228 228.6428 5.520113 -5.868073      9.575500 
1 1 1 -13 20 4  o 123.2647 3.024495 185.3745       9.085056 182.2626       17.73799 186.4812       10.57782 121.8486 5.992137 123.5539 3.516784 -1.705345      6.947911 
1 1 1 -13 20 5  o 160.4557 3.013786 314.1073       11.78430 336.5288       19.90188 302.0020       14.62344 165.8318 4.930292 157.2722 3.815588 8.559647       6.234299 
1 1 1 -13 20 6  o 34.57740 4.337579 14.83407       3.574692 19.92088       6.501567 12.63003       4.279616 39.72754 6.969733 31.63577 5.763523 8.091768       9.044080 
1 1 1 -13 20 7  o 202.2012 3.733769 499.1631       18.39786 516.4680       39.77258 494.4523       20.75150 204.7950 7.984752 201.1875 4.232652 3.607483       9.037234 
1 1 1 -13 20 8  o 52.62102 3.370708 33.93209       4.299587 31.82692       7.475479 34.97277       5.255950 50.59723 6.191710 53.35646 4.073081 -2.759232      7.411293 
1 1 1 -13 20 9  o 172.5090 3.886045 363.4152       16.33637 359.1690       29.02186 365.3847       19.76511 170.9330 6.981975 172.8234 4.697464 -1.890442      8.415113 
1 1 1 -13 20 10 o 146.4480 3.638306 261.8438       12.98430 290.0182       24.37624 250.6834       15.34193 153.6496 6.525127 143.1595 4.402915 10.49017       7.871655 
1 1 1 -13 20 11 o 116.5722 4.309870 166.2755       12.22213 164.3508       17.72696 168.0194       16.87398 115.6153 6.315903 116.9628 5.939609 -1.347435      8.670039 
1 1 1 -13 20 12 f 201.7876 4.226331 497.5347       20.78232 467.8970       35.73536 512.6815       25.54673 194.9445 7.536505 204.6366 5.126937 -9.692123      9.115064 
1 1 1 -13 20 13 o 216.9801 3.461579 574.7730       18.30334 572.3710       29.65256 576.2515       23.26422 216.1054 5.635485 217.1288 4.396782 -1.023361      7.147753 
1 1 1 -13 20 14 o 70.04552 2.926663 59.97185       4.984612 64.72772       8.987030 57.85874       5.990493 72.54797 5.116218 68.74229 3.588466 3.805679       6.249222 
1 1 1 -13 20 15 o 103.2782 2.775024 130.2332       6.977785 124.9617       11.91277 132.9864       8.609245 100.9469 4.856905 104.3121 3.391344 -3.365196      5.923743 
1 1 1 -13 20 16 o 171.3788 3.064412 358.4793       12.79795 350.9822       21.07334 362.8601       16.10881 169.2426 5.115479 172.3392 3.835687 -3.096634      6.393796 
1 1 1 -13 20 17 o 87.73655 2.735303 94.01662       5.841054 108.4145       10.83998 88.12572       6.933778 94.00850 4.747151 84.88790 3.358505 9.120598       5.815067 
1 1 1 -13 20 18 o 97.86201 3.008223 117.0096       7.165463 128.4537       16.82636 114.4745       7.919433 101.9874 6.809305 96.76182 3.363682 5.225555       7.594800 
1 1 1 -13 20 19 o 119.7014 2.783071 174.8687       8.118197 162.0395       13.72065 181.7792       10.07002 114.9262 4.910454 121.9487 3.391868 -7.022514      5.968025 
1 1 1 -13 20 20 o 146.8554 3.297349 263.4128       11.80025 261.6748       17.83393 264.7664       15.73804 146.0535 5.018161 147.0292 4.397433 -0.9757385     6.672283 
1 1 1 -13 20 21 o 100.4520 3.141959 123.3582       7.681761 119.1684       12.05136 126.2255       9.969609 98.47089 5.038933 101.5049 4.038526 -3.034004      6.457595 
1 1 1 -13 20 22 o 67.64177 3.936746 56.15983       6.461115 55.24521       9.330647 57.00241       8.955676 66.80227 5.788793 67.92268 5.456495 -1.120415      7.955091 
1 1 1 -13 20 23 o 92.81544 3.173958 105.3809       7.168331 103.2793       11.43145 106.7429       9.202412 91.59029 5.142373 93.29808 4.057256 -1.707787      6.550215 
1 1 1 -13 20 24 o 64.91598 3.491299 51.68189       5.502676 44.95890       8.947101 55.77198       6.978584 60.09032 6.198867 67.33751 4.274862 -7.247192      7.529967 
1 1 1 -13 20 25 o 29.78284 7.831627 11.43105       5.758476 8.651849       7.487619 15.45466       9.009319 27.29001 9.348653 34.63503 10.07269 -7.345015      13.74250 
1 1 1 -13 20 26 o 79.61765 4.196985 77.96778       8.114209 76.50545       10.26756 80.40019       13.24228 78.62588 5.391405 80.24334 6.837066 -1.617462      8.707049 
1 1 1 -13 20 27 o 96.49161 3.148285 114.0558       7.392953 115.5797       11.88984 113.0953       9.439590 96.72735 5.061793 95.91650 4.047632 0.8108444      6.481132 
1 1 1 -13 20 28 o 74.34793 3.597560 67.95024       6.498635 55.42977       12.28310 72.81729       7.658269 66.02421 7.783715 76.87056 4.103087 -10.84635      8.798951 
1 1 1 -13 20 29 o 89.60365 3.125392 98.51936       6.813980 106.0471       11.10598 93.97506       8.628976 92.48756 4.945608 87.29638 4.067452 5.191177       6.403375 
1 1 1 -13 20 30 o 27.42537 5.905396 9.736477       3.829915 9.488671       7.036514 9.840795       4.565422 27.48535 9.060042 27.43412 6.850195 0.5122948E-01  11.35824 
1 1 1 -13 20 31 o 113.4984 3.535380 158.7825       9.766347 153.9383       18.20986 160.7385       11.57132 110.0479 6.823869 113.9391 4.174542 -3.891174      7.999499 
1 1 1 -13 20 32 o 80.70599 4.492688 81.25755       8.800975 99.86426       16.93095 74.36834       10.30223 87.35313 8.043922 76.72914 5.547241 10.62399       9.771212 
1 1 1 -13 20 33 o 72.75104 3.355078 65.52827       5.932080 68.78571       9.720254 63.59504       7.488247 73.59853 5.458520 71.29238 4.330661 2.306145       6.967788 
1 1 1 -13 20 34 o 21.53132 7.228298 5.897903       4.474453 3.278274       11.09912 6.406259       4.889364 24.50411 10.47603 22.38093 7.556192 2.123177       12.91678 
1 1 1 -13 20 35 o 13.35154 5.864208 -0.5041127     3.673903 1.095512       6.245088 -1.350702      4.543242 18.33194 7.848222 14.19901 6.361775 4.132925       10.10281 
1 1 1 -13 20 36 o 18.74618 6.703748 4.307584       3.876203 7.975693       6.832866 2.566973       4.706875 24.35216 8.874706 17.56995 7.102563 6.782206       11.36692 
1 1 1 -13 20 37 o 33.16648 5.328365 14.72014       4.160729 5.689615       6.372143 21.43188       5.493468 21.57483 8.409042 39.81502 5.835043 -18.24018      10.23522 
1 1 1 -13 20 38 o 23.61511 6.795296 8.099438       4.120433 12.26281       6.517581 5.327546       5.318041 27.84667 8.674816 20.27689 7.740018 7.569786       11.62585 
1 1 1 -13 20 39 o 13.62008 6.252761 -1.792109      4.726912 3.777883       5.838808 -12.38578      8.052304 18.88032 7.803132 13.73505 6.767260 5.145271       10.32883 
1 1 1 -13 20 40 o 19.85029 7.355851 5.701694       4.726032 8.815274       6.659795 2.543160       6.707700 23.19777 8.705074 18.24959 7.971937 4.948187       11.80382 
1 1 1 -13 20 41 o 25.03196 7.387074 10.20477       4.815119 14.40936       6.636498 5.530957       6.997009 28.32135 8.742241 19.93606 8.411829 8.385284       12.13201 
1 1 1 -13 20 42 o 12.09761 5.532205 -0.9057785     3.652178 -2.959209      5.781436 0.4577910      4.711231 13.67403 6.481258 14.40452 6.464176 -0.7304869     9.153811 
1 1 1 -13 20 43 o 23.94527 6.629419 9.421141       4.000310 11.86656       6.455395 7.896666       5.096905 24.23590 8.652962 20.95895 7.660739 3.276951       11.55684 
1 1 1 -13 20 44 o 11.64932 5.485356 -2.002259      4.016647 0.2760113      7.849366 -2.810463      4.675116 16.11171 7.611391 12.08709 5.757370 4.024626       9.543613 
1 1 1 -13 21 1  o 131.1319 2.974449 209.8193       9.504976 198.1403       13.07095 222.9258       13.84670 127.2685 4.220376 135.0030 4.214044 -7.734482      5.964037 
1 1 1 -13 21 2  o 148.3678 3.107284 268.6303       11.23458 266.6202       15.80802 270.6818       15.96939 147.6326 4.398896 148.7523 4.410304 -1.119690      6.229050 
1 1 1 -13 21 3  o 178.3992 3.392007 388.4922       14.74639 387.4658       20.80278 389.5290       20.90670 177.9370 4.801934 178.4087 4.813160 -0.4716492     6.798903 
1 1 1 -13 21 4  o 164.5266 3.784653 330.5645       15.17394 348.3077       27.06693 322.4323       18.32421 168.3698 6.609722 162.3333 4.636888 6.036484       8.073980 
1 1 1 -13 21 5  o 175.7862 3.912978 377.4146       16.76210 389.2468       29.85798 371.9693       20.25512 177.9406 6.898789 174.3472 4.771913 3.593414       8.388351 
1 1 1 -13 21 6  o 214.3941 5.349581 562.5776       27.94915 0.000000       0.000000 562.5776       27.94915 ?        ?        214.3941 5.349581 0.000000       5.349581 
1 1 1 -13 21 7  o 185.1860 4.031085 418.9258       18.19141 382.7394       30.72566 438.4565       22.57294 176.3786 7.163477 189.2756 4.898042 -12.89697      8.677916 
1 1 1 -13 21 8  o 227.6379 4.548723 633.4753       25.23308 583.2113       42.42047 660.9984       31.39030 217.5235 8.016353 232.3447 5.544044 -14.82120      9.746709 
1 1 1 -13 21 9  o 144.6943 2.940722 255.4570       10.36911 240.2905       16.95321 264.5217       13.10649 140.0637 4.974855 147.1831 3.654202 -7.119370      6.172712 
1 1 1 -13 21 10 o 110.1015 2.801529 147.9909       7.510547 152.5889       12.84584 145.6028       9.257731 111.6016 4.734166 109.1508 3.484966 2.450844       5.878547 
1 1 1 -13 21 11 o 161.9431 3.422556 320.1747       13.50670 326.8521       19.85472 314.4226       18.42771 163.3665 4.993152 160.2704 4.723415 3.096054       6.873298 
1 1 1 -13 21 12 o 131.3201 3.093868 210.4681       9.900769 209.1754       20.58646 210.8571       11.29251 130.3909 6.499343 131.3615 3.530858 -0.9705353     7.396514 
1 1 1 -13 21 13 o 109.2801 3.132186 145.8822       8.332520 141.4136       12.56683 149.3881       11.13126 107.4032 4.813681 110.4815 4.141792 -3.078331      6.350273 
1 1 1 -13 21 14 o 301.0517 4.343446 1108.135       31.86483 1056.351       49.70206 1144.274       41.52076 293.1406 6.957645 305.5791 5.575779 -12.43848      8.916173 
1 1 1 -13 21 15 o 204.0486 3.370706 508.4055       16.76064 505.4804       27.35917 510.1628       21.20576 203.0159 5.535314 204.2695 4.260046 -1.253632      6.984818 
1 1 1 -13 21 16 o 21.81534 6.284084 5.971446       3.522025 15.03768       6.729384 2.551015       4.133351 34.23140 8.179103 17.69338 6.806037 16.53801       10.64048 
1 1 1 -13 21 17 o 212.5962 3.812572 552.3602       19.75194 570.5674       42.04377 547.2036       22.37481 214.8172 8.045713 211.5075 4.341076 3.309723       9.142125 
1 1 1 -13 21 18 o 144.2408 2.913944 253.9708       10.24249 248.7824       17.25119 256.7956       12.72885 142.4227 4.978197 144.9701 3.603087 -2.547379      6.145298 
1 1 1 -13 21 19 o 135.0820 2.875130 222.7561       9.464357 227.4220       16.29822 220.3822       11.62528 136.1522 4.920330 134.2459 3.556716 1.906326       6.071233 
1 1 1 -13 21 20 o 125.0650 2.828229 190.9562       8.619586 183.0603       14.79105 195.0167       10.60681 122.0998 4.981506 126.2803 3.450007 -4.180496      6.059534 
1 1 1 -13 21 21 o 78.63449 2.867851 75.60513       5.486277 59.05741       9.714775 83.35392       6.647840 69.07141 5.825894 82.52454 3.312415 -13.45313      6.701726 
1 1 1 -13 21 22 o 123.4357 3.723484 186.5408       11.18741 178.0729       14.69846 198.2017       17.24852 120.3613 5.022316 126.8624 5.593087 -6.501099      7.517066 
1 1 1 -13 21 23 o 86.58847 3.265161 91.78371       6.877365 93.47588       11.14494 90.74309       8.739850 87.05857 5.278072 85.96605 4.184538 1.092522       6.735607 
1 1 1 -13 21 24 o 29.30762 7.889680 11.05449       5.758770 1.428307       7.276613 27.18928       9.420713 20.83474 8.669716 45.92501 8.736944 -25.09027      12.30846 
1 1 1 -13 21 25 o 99.19881 4.034907 120.8520       9.733496 126.7563       12.56565 111.9947       15.39045 101.3607 5.103627 94.82629 6.703393 6.534378       8.425111 
1 1 1 -13 21 26 o 39.69328 4.542818 19.61734       4.315124 16.60255       7.749331 20.97224       5.195057 35.61177 8.943238 40.89881 5.339871 -5.287041      10.41613 
1 1 1 -13 21 27 o 69.00873 3.407702 58.50903       5.712898 43.48154       9.324763 67.53902       7.228337 58.73437 6.630703 74.03955 4.021348 -15.30518      7.754836 
1 1 1 -13 21 28 o 79.19616 3.526214 77.14065       6.788261 75.99787       13.35766 77.53854       7.881929 77.49610 7.153883 79.27254 4.093997 -1.776436      8.242502 
1 1 1 -13 21 29 o 15.03158 6.107049 1.223116       3.499977 -1.863547      6.906010 2.289927       4.060003 17.90681 7.944444 17.09216 6.697546 0.8146458      10.39092 
1 1 1 -13 21 30 o 19.81764 6.377605 4.855490       3.497523 3.703530       6.765189 5.275692       4.085927 21.63659 8.593370 20.81131 6.905666 0.8252773      11.02426 
1 1 1 -13 21 31 o 50.17241 4.324847 31.46957       5.236199 40.67167       13.12505 29.72775       5.710302 54.27594 10.30001 48.58246 4.889731 5.693485       11.40174 
1 1 1 -13 21 32 f 77.95362 3.788496 75.49749       7.175246 92.53825       10.98183 62.80397       9.478093 85.56042 5.292941 70.28461 5.579571 15.27581       7.690699 
1 1 1 -13 21 33 f 22.12310 7.034216 6.384818       4.264497 -7.949814      10.81973 9.021216       4.640114 19.32734 9.069953 25.83015 7.135552 -6.502806      11.54037 
1 1 1 -13 21 34 o 19.66709 6.554145 4.927093       3.679659 6.437236       6.655228 4.262191       4.416037 23.21865 8.704347 19.32427 7.119514 3.894384       11.24514 
1 1 1 -13 21 35 o 24.83092 6.457690 8.478520       3.943755 9.375134       6.693090 8.001667       4.881084 25.81572 8.838885 24.01689 7.511031 1.798830       11.59920 
1 1 1 -13 21 36 o 43.44311 4.346592 24.32887       4.539844 20.46922       7.259544 26.80771       5.817816 37.33162 8.204195 44.96853 5.418078 -7.636909      9.831805 
1 1 1 -13 21 37 o 24.34350 7.190729 8.665431       4.560766 17.73375       9.010157 5.541564       5.288290 32.29935 10.21918 20.58879 7.750481 11.71056       12.82581 
1 1 1 -13 21 38 o 29.91649 5.999207 12.63057       4.221262 20.02455       7.088234 8.567106       5.254690 35.81835 8.285603 23.70444 7.830021 12.11391       11.40002 
1 1 1 -13 21 39 o 24.92468 7.758080 9.844952       5.214020 13.76449       6.640371 3.543005       8.420002 28.59050 8.730007 20.08337 8.847265 8.507128       12.42929 
1 1 1 -13 21 40 o 12.76776 5.789398 -0.8159396     3.894019 -4.399827      6.082469 1.673125       5.068982 13.74924 6.554105 16.05383 6.972486 -2.304596      9.569319 
1 1 1 -13 21 41 o 25.14670 6.504006 9.870584       4.015272 11.14183       6.690185 9.154862       5.019906 24.32246 8.793356 23.18487 7.652872 1.137587       11.65717 
1 1 1 -13 21 42 o 36.20456 6.054173 19.93520       5.152935 27.97712       7.378622 12.27923       7.199383 40.57961 7.744029 24.30039 9.064674 16.27921       11.92218 
1 1 1 -13 21 43 o 25.82557 7.314163 11.74645       4.811043 9.248031       10.28079 12.44699       5.443913 20.66778 9.385547 25.76442 7.911610 -5.096638      12.27526 
1 1 1 -13 22 1  o 73.62434 2.665169 66.21586       4.773811 66.21745       7.221015 66.21462       6.362553 73.50260 4.047052 73.54988 3.560454 -0.4727936E-01 5.390312 
1 1 1 -13 22 2  o 243.6885 3.697615 725.2920       21.95800 788.6070       36.08310 688.0558       27.67153 253.6516 5.837544 237.1594 4.788029 16.49222       7.549976 
1 1 1 -13 22 3  o 168.9510 3.002012 348.3413       12.35974 309.8421       18.25536 380.9254       16.79451 159.0909 4.713984 176.5814 3.902889 -17.49052      6.119983 
1 1 1 -13 22 4  o 43.85176 4.181766 23.71234       4.414672 22.20070       8.868093 24.21037       5.090231 41.61620 9.006299 44.23174 4.799272 -2.615547      10.20522 
1 1 1 -13 22 5  o 93.47729 3.571177 106.8555       8.119965 0.000000       0.000000 106.8555       8.119965 ?        ?        93.47729 3.571177 0.000000       3.571177 
1 1 1 -13 22 6  o 202.8098 3.726072 502.3661       18.41519 465.7486       35.62159 515.7217       21.51295 194.4232 7.532716 205.4071 4.297821 -10.98396      8.672546 
1 1 1 -13 22 7  o 54.39386 3.419940 36.26484       4.510251 25.99180       7.638263 41.76416       5.588555 45.45524 7.129979 58.33447 3.954697 -12.87923      8.153296 
1 1 1 -13 22 8  f 58.92470 3.297435 42.51834       4.716000 32.60715       8.041146 47.71482       5.822501 51.12184 6.609205 62.37965 3.849025 -11.25782      7.648306 
1 1 1 -13 22 9  o 16.89183 6.262708 2.702741       3.426532 0.4843607      5.983320 3.785341       4.179827 18.49001 7.788911 19.24346 6.951378 -0.7534542     10.43977 
1 1 1 -13 22 10 o 111.7435 3.254190 152.5621       8.851940 143.7551       12.80349 160.6265       12.25180 108.2806 4.864651 114.5334 4.397840 -6.252739      6.557882 
1 1 1 -13 22 11 o 203.5979 3.378053 506.1340       16.76007 490.5592       26.83133 516.0993       21.46228 200.0180 5.509992 205.4609 4.286577 -5.442917      6.981029 
1 1 1 -13 22 12 o 173.2495 3.127998 366.3962       13.20610 365.0782       21.71588 367.1696       16.63579 172.5866 5.169209 173.3389 3.938324 -0.7522888     6.498547 
1 1 1 -13 22 13 o 215.3268 3.486670 566.2692       18.29553 579.3333       30.19508 558.6907       22.99785 217.2951 5.707242 213.7297 4.415565 3.565475       7.215943 
1 1 1 -13 22 14 o 205.7980 3.806476 517.5328       19.08975 525.2447       28.13391 510.9526       25.98761 206.9094 5.584846 204.1599 5.227778 2.749435       7.649848 
1 1 1 -13 22 15 o 238.9090 3.701943 697.4413       21.55254 716.6284       35.51385 686.2546       27.11708 241.6053 6.031915 236.7795 4.699618 4.825806       7.646595 
1 1 1 -13 22 16 o 34.17147 4.850756 14.58119       3.925964 7.394321       7.798812 17.02068       4.543675 26.45125 9.502934 36.91264 5.194726 -10.46139      10.83009 
1 1 1 -13 22 17 o 144.2796 2.965354 254.1475       10.42599 235.1694       17.19414 265.1829       13.11143 138.4239 5.105968 147.3025 3.652616 -8.878571      6.277939 
1 1 1 -13 22 18 o 183.7226 3.210515 412.2971       14.37387 423.0290       24.16087 406.4178       17.88278 185.6151 5.347074 182.2786 4.025902 3.336472       6.693212 
1 1 1 -13 22 19 o 15.05399 5.968006 1.492820       3.257287 4.072128       6.905501 0.7547090      3.694065 22.58120 8.767214 14.99774 6.203356 7.583454       10.73991 
1 1 1 -13 22 20 o 132.8831 2.876716 215.6378       9.315428 223.7358       16.19689 211.6351       11.38726 134.9724 4.932666 131.5182 3.556278 3.454147       6.080979 
1 1 1 -13 22 21 o 146.2996 3.278058 261.6085       11.68681 273.5507       18.18945 253.2126       15.25133 149.2085 5.009637 143.6953 4.360455 5.513199       6.641538 
1 1 1 -13 22 22 o 96.69595 3.279245 114.4514       7.715950 116.6316       11.87914 112.8603       10.14817 97.31480 5.026249 95.85235 4.355976 1.462456       6.651144 
1 1 1 -13 22 23 o 161.8094 4.130323 321.1645       16.27304 323.9742       20.41672 316.2705       26.94567 162.2091 5.171661 159.5999 6.944819 2.609131       8.658902 
1 1 1 -13 22 24 o 151.2312 4.079670 280.7137       15.02123 302.7973       19.45505 248.1164       23.63681 156.7531 5.099864 141.2147 6.889466 15.53842       8.571660 
1 1 1 -13 22 25 o 116.6801 3.186763 166.7660       9.052652 167.1303       14.17712 166.5153       11.76297 116.3554 5.011698 116.3771 4.154423 -0.2169037E-01 6.509712 
1 1 1 -13 22 26 o 126.9335 3.220742 197.5027       9.954454 215.3720       16.03532 186.2987       12.69729 132.0058 4.993814 123.0060 4.242280 8.999756       6.552490 
1 1 1 -13 22 27 o 21.94506 6.720111 6.058615       3.931097 0.7698354      9.532093 7.142466       4.315145 22.77865 9.722544 23.65606 6.996164 -0.8774014     11.97807 
1 1 1 -13 22 28 o 43.52502 4.227863 23.58915       4.427885 31.61880       8.502023 20.60061       5.186842 49.55218 7.255788 40.36122 5.409636 9.190960       9.050449 
1 1 1 -13 22 29 o 51.28956 3.899327 32.64028       4.837131 39.69330       8.774920 29.56152       5.797530 55.72824 6.588751 48.51796 4.973814 7.210285       8.255329 
1 1 1 -13 22 30 o 48.13500 4.325116 28.97830       5.019314 40.85746       12.92276 26.86780       5.446972 54.54618 10.09365 46.15967 4.917995 8.386513       11.22802 
1 1 1 -13 22 31 o 28.59582 6.259837 10.79469       4.240879 10.42843       7.360785 10.97668       5.188587 28.05252 9.267303 28.56884 7.395675 -0.5163193     11.85660 
1 1 1 -13 22 32 o 42.61576 4.691776 23.07270       4.791885 29.06596       11.86804 21.90534       5.237816 44.35176 11.02753 41.26870 5.332819 3.083061       12.24930 
1 1 1 -13 22 33 o 12.91461 5.696817 -0.6755066     3.502017 3.484667       6.413164 -2.443104      4.180308 20.44789 8.281682 12.85594 5.893857 7.591955       10.16483 
1 1 1 -13 22 34 o 19.84726 6.832528 5.022185       4.000936 2.115163       9.249027 5.691384       4.437615 21.74957 9.432484 20.95137 7.196367 0.7982044      11.86421 
1 1 1 -13 22 35 o 42.04662 4.429208 22.80653       4.470207 19.90417       7.181587 24.64232       5.711582 36.90755 8.198105 43.05701 5.574163 -6.149456      9.913638 
1 1 1 -13 22 36 o 11.65808 5.460492 -3.072558      3.889966 2.621601       8.215513 -4.718059      4.416406 20.38569 8.865003 11.69871 5.578917 8.686976       10.47438 
1 1 1 -13 22 37 o 11.09272 5.255255 -3.587085      3.792350 4.706306       6.165452 -8.634501      4.809871 20.05424 8.120919 10.65823 5.247223 9.396010       9.668644 
1 1 1 -13 22 38 o 22.87347 7.725663 8.061241       5.111148 7.474687       6.482545 9.024982       8.309435 22.26883 8.534321 23.79576 9.499784 -1.526934      12.77030 
1 1 1 -13 22 39 o 12.05893 5.497084 -1.147214      3.569158 -0.3975328     6.170073 -1.524229      4.375531 15.88500 7.235953 13.05693 6.002175 2.828075       9.401336 
1 1 1 -13 22 40 o 17.74146 7.090483 4.208568       4.634163 1.723556       6.138405 7.501888       7.066566 16.77602 7.463610 21.25668 8.662197 -4.480658      11.43412 
1 1 1 -13 22 41 o 22.38853 6.838408 8.227005       4.074071 1.688423       6.473102 12.51613       5.242702 16.59422 7.500294 26.87478 7.643289 -10.28055      10.70861 
1 1 1 -13 22 42 o 16.37395 6.401320 3.848250       3.701686 7.252606       6.456102 2.180982       4.518098 19.96414 8.223592 15.24141 6.601344 4.722726       10.54539 
1 1 1 -13 23 1  o 105.3511 2.665029 135.5069       6.836415 134.1082       10.35427 136.5878       9.102537 104.6652 4.067322 105.6897 3.539214 -1.024513      5.391581 
1 1 1 -13 23 2  o 173.7084 3.049301 368.3178       12.90795 363.1756       19.89995 372.0528       16.95974 172.2088 4.746518 174.4764 3.988839 -2.267624      6.200022 
1 1 1 -13 23 3  o 210.3800 3.378587 540.4519       17.32111 541.8837       27.08450 539.4611       22.53083 210.2626 5.290146 210.0283 4.402133 0.2342834      6.882182 
1 1 1 -13 23 4  o 198.5380 3.683831 481.5114       17.82294 522.5095       36.95378 469.0837       20.34573 205.8978 7.376893 195.8742 4.262457 10.02365       8.519806 
1 1 1 -13 23 5  o 55.54119 4.360689 37.95132       5.854801 0.000000       0.000000 37.95132       5.854801 ?        ?        55.54119 4.360689 0.000000       4.360689 
1 1 1 -13 23 6  o 143.5318 3.247227 251.5169       11.35787 251.8386       22.68285 251.4092       13.12128 143.0471 6.524202 143.4039 3.757973 -0.3567810     7.529115 
1 1 1 -13 23 7  o 247.2048 4.220591 747.1146       25.42532 734.0961       50.44770 751.5474       29.43742 243.6433 8.509777 247.7976 4.874910 -4.154297      9.807194 
1 1 1 -13 23 8  o 13.93143 5.971878 -0.2084887     3.624378 -4.119248      6.441175 1.603415       4.384318 16.19076 7.382164 17.04581 6.867592 -0.8550529     10.08267 
1 1 1 -13 23 9  o 182.9674 3.682044 408.9709       16.41719 409.0926       23.79801 408.8604       22.67735 182.6517 5.352413 182.6532 5.099811 -0.1541138E-02 7.392996 
1 1 1 -13 23 10 o 118.6381 2.893449 171.7782       8.365192 187.6422       14.53541 163.9219       10.22892 123.7210 4.830400 115.7824 3.629842 7.938576       6.042227 
1 1 1 -13 23 11 o 142.3474 2.978554 247.3301       10.33216 247.2781       17.18789 247.3596       12.92891 142.0212 4.973981 142.2352 3.733315 -0.2139435     6.219174 
1 1 1 -13 23 12 o 246.0305 3.797467 739.7378       22.76769 787.7201       38.13065 713.1527       28.38266 253.2647 6.178223 241.3484 4.825836 11.91629       7.839587 
1 1 1 -13 23 13 o 237.7209 3.722902 690.5943       21.56677 671.1785       34.47342 703.0800       27.64476 233.7119 6.058064 239.6425 4.733834 -5.930603      7.688258 
1 1 1 -13 23 14 o 98.16011 2.912788 117.7249       6.959841 120.4599       12.10735 116.3751       8.505630 99.02802 5.033636 97.52628 3.584995 1.501740       6.179780 
1 1 1 -13 23 15 o 107.6778 2.847537 141.6352       7.465354 162.5604       13.44857 132.3155       8.975144 115.1014 4.805245 103.9977 3.546643 11.10368       5.972358 
1 1 1 -13 23 16 o 124.6486 3.169122 189.8944       9.618562 192.2049       21.63273 189.3251       10.73843 124.6314 7.152792 124.4136 3.545519 0.2177658      7.983304 
1 1 1 -13 23 17 o 97.83942 2.861286 116.9807       6.814665 127.7661       12.22327 112.1163       8.208794 101.9660 4.933860 95.70805 3.525637 6.257942       6.064082 
1 1 1 -13 23 18 o 143.8087 2.967183 252.5818       10.39838 267.1660       18.11977 245.4204       12.69725 147.4883 5.048937 141.6178 3.682343 5.870422       6.249113 
1 1 1 -13 23 19 o 148.2050 3.362811 268.4875       12.14511 274.4850       18.43543 263.8885       16.14342 149.4633 5.068875 146.6722 4.522001 2.791046       6.792789 
1 1 1 -13 23 20 o 19.53051 6.678385 4.333371       3.820703 3.103507       6.654134 4.938271       4.666646 21.42188 8.517855 21.11298 7.373112 0.3089085      11.26573 
1 1 1 -13 23 21 o 55.53624 3.984800 37.97333       5.357016 45.71477       8.664677 33.18321       6.815764 60.61115 5.942588 51.63935 5.500812 8.971794       8.097733 
1 1 1 -13 23 22 o 99.11360 3.323342 120.3191       8.015485 119.1039       12.14504 121.2570       10.66906 98.26876 5.088964 99.30214 4.419989 -1.033379      6.740464 
1 1 1 -13 23 23 o 98.57935 2.879358 118.9144       6.909588 124.3454       12.42435 116.4826       8.313850 100.3567 5.097012 97.46473 3.506120 2.892006       6.186470 
1 1 1 -13 23 24 o 146.4177 2.974678 262.2980       10.61377 297.9134       19.25578 246.7550       12.72064 155.3415 5.093604 141.8098 3.684126 13.53168       6.286301 
1 1 1 -13 23 25 o 111.4718 3.204766 152.3638       8.696541 152.9875       13.77001 151.9500       11.21657 111.1673 5.096572 111.0837 4.150862 0.8364868E-01  6.573029 
1 1 1 -13 23 26 o 26.67988 6.242686 9.228590       3.986299 -1.429540      10.58126 10.99146       4.303360 22.68707 9.958697 29.15029 6.245925 -6.463221      11.75531 
1 1 1 -13 23 27 o 18.42795 6.425015 3.855386       3.542843 4.928032       7.140765 3.505126       4.080486 23.14754 8.934768 18.54139 6.841480 4.606144       11.25326 
1 1 1 -13 23 28 o 50.16381 3.880650 31.23085       4.706991 33.33244       8.780007 30.38323       5.575996 50.71692 7.315256 49.26469 4.701581 1.452221       8.695851 
1 1 1 -13 23 29 o 40.18033 5.006624 20.45308       4.796183 12.10908       11.05941 22.38587       5.322765 31.09295 11.29667 41.96124 5.325147 -10.86829      12.48888 
1 1 1 -13 23 30 o 60.18754 3.722867 45.03014       5.433620 34.65340       9.063918 50.85122       6.788706 51.22020 7.482518 63.73016 4.398228 -12.50996      8.679428 
1 1 1 -13 23 31 o 35.09096 4.876375 15.77295       4.057406 12.69027       7.611551 16.99661       4.795546 30.15916 9.371357 36.17559 5.622353 -6.016432      10.92855 
1 1 1 -13 23 32 o 34.92918 4.960351 15.74882       4.103598 19.15601       7.366931 14.21603       4.941161 36.91531 8.381371 32.55132 6.457141 4.363995       10.58027 
1 1 1 -13 23 33 o 32.95134 5.329712 14.28313       4.133660 11.09124       7.104576 15.91666       5.082515 27.76390 9.101297 34.35469 6.303157 -6.590786      11.07084 
1 1 1 -13 23 34 o 19.22048 6.530871 4.808673       3.652839 5.070164       6.514274 4.688741       4.411697 21.35517 8.448153 19.51351 7.128037 1.841661       11.05351 
1 1 1 -13 23 35 o 34.12855 5.349765 15.64435       4.303164 17.55766       7.005302 14.48491       5.453297 33.97280 8.486952 31.65901 7.227943 2.313784       11.14771 
1 1 1 -13 23 36 o 40.48167 5.209267 22.06551       5.019927 25.94813       10.37397 20.87841       5.736238 38.32371 10.70052 38.53593 6.327806 -0.2122231     12.43150 
1 1 1 -13 23 37 o 28.35678 7.206253 12.15702       4.989236 11.88880       6.797122 12.47037       7.346555 26.75212 8.907703 27.10345 9.260839 -0.3513279     12.84953 
1 1 1 -13 23 38 o 10.47946 5.034687 -4.310310      3.745045 -2.658964      6.202980 -5.257517      4.697900 14.82765 6.928898 11.62230 5.597823 3.205354       8.907596 
1 1 1 -13 23 39 o 31.03192 6.757121 14.81052       4.964671 16.03180       6.791336 13.40875       7.275894 29.96825 8.753875 26.65962 9.212342 3.308626       12.70817 
1 1 1 -13 23 40 o 23.30711 6.625288 8.682435       3.940156 1.712712       6.472022 12.78693       4.966636 16.72511 7.534989 27.80065 7.255308 -11.07554      10.46019 
1 1 1 -13 23 41 o 21.52061 6.787138 7.700632       3.977332 4.141054       6.674163 9.660911       4.952866 17.95712 7.894929 23.26924 7.597364 -5.312122      10.95673 
1 1 1 -13 23 42 o 15.98775 6.657082 3.344138       4.294289 13.97236       9.015359 0.2249879      4.883945 23.57666 9.715353 14.05124 6.414889 9.525414       11.64212 
1 1 1 -13 24 1  o 189.1913 3.201153 437.0802       14.75855 404.8566       22.07452 463.1268       19.84632 181.7320 4.989244 194.5957 4.185145 -12.86366      6.512142 
1 1 1 -13 24 2  o 99.42685 2.740142 120.7339       6.632826 137.7167       10.30119 108.7064       8.669015 106.0613 3.992737 94.23751 3.782624 11.82378       5.500017 
1 1 1 -13 24 3  o 149.4440 2.913220 272.6036       10.60933 269.0221       16.26786 275.2543       13.99505 148.2085 4.509482 150.0237 3.831193 -1.815109      5.917218 
1 1 1 -13 24 4  o 107.9957 3.670730 142.6684       9.646358 0.000000       0.000000 142.6684       9.646358 ?        ?        107.9957 3.670730 0.000000       3.670730 
1 1 1 -13 24 5  o 184.8821 3.593720 417.5959       16.19106 405.3650       31.69161 421.9159       18.83462 181.2925 7.187700 185.7515 4.160909 -4.459030      8.305191 
1 1 1 -13 24 6  o 49.03104 4.166032 29.60710       4.930625 41.71860       9.723008 25.41430       5.720767 57.80305 7.048185 45.23690 5.289222 12.56615       8.812082 
1 1 1 -13 24 7  o 262.4844 4.420366 842.9168       28.27469 838.1082       56.39646 844.5313       32.67839 259.9715 8.915241 262.5567 5.107419 -2.585205      10.27459 
1 1 1 -13 24 8  o 117.0283 2.950470 167.2868       8.407597 148.2474       13.63711 178.9611       10.67853 109.8844 5.106694 120.9705 3.626489 -11.08616      6.263366 
1 1 1 -13 24 9  o 172.5725 3.620870 363.8883       15.22722 350.4056       21.76669 376.8108       21.30966 168.9951 5.291975 175.3187 4.992920 -6.323608      7.275592 
1 1 1 -13 24 10 o 118.7969 2.960868 172.2839       8.571567 174.8057       14.56704 170.9483       10.60110 119.3466 5.019913 118.2169 3.684392 1.129646       6.226899 
1 1 1 -13 24 11 o 120.9429 2.929428 178.5661       8.633743 196.4543       15.21442 170.0696       10.48556 126.5376 4.943516 117.9117 3.653618 8.625923       6.147135 
1 1 1 -13 24 12 o 126.7740 2.924822 196.2101       9.035782 193.3920       15.34369 197.7062       11.17997 125.5207 5.026402 127.1400 3.612126 -1.619263      6.189682 
1 1 1 -13 24 13 o 93.47259 2.974034 106.7885       6.765707 98.37664       11.51935 111.2185       8.359488 89.40091 5.311436 95.32513 3.605119 -5.924217      6.419364 
1 1 1 -13 24 14 f 165.1188 3.122866 333.0050       12.56568 346.9210       21.29758 325.5739       15.56315 168.0934 5.205555 163.1534 3.914401 4.940094       6.513090 
1 1 1 -13 24 15 o 92.71397 3.253128 105.1520       7.338529 111.0258       17.62957 103.9209       8.071019 94.42706 7.728986 92.12773 3.601966 2.299332       8.527097 
1 1 1 -13 24 16 o 236.8790 3.728014 686.2556       21.51989 641.9301       33.89286 716.1955       27.85521 228.3086 6.097318 241.7160 4.728953 -13.40739      7.716235 
1 1 1 -13 24 17 o 84.58495 2.954645 87.49639       6.080888 84.88237       10.80972 88.70654       7.354984 82.95657 5.376171 85.09912 3.554495 -2.142555      6.444971 
1 1 1 -13 24 18 o 87.76289 3.430542 94.32651       7.322720 89.79518       10.96386 97.97573       9.838999 85.32310 5.299193 89.27989 4.537195 -3.956787      6.976215 
1 1 1 -13 24 19 o 162.5648 3.539265 323.3382       14.02090 326.5806       20.69450 320.5869       19.06293 162.9018 5.219801 161.5085 4.848978 1.393341       7.124529 
1 1 1 -13 24 20 o 129.0992 3.934882 204.3894       12.36472 216.3155       16.15127 187.5032       19.21872 132.5536 5.009119 122.9788 6.435344 9.574715       8.155055 
1 1 1 -13 24 21 o 28.18681 5.730312 10.15073       3.801772 7.041525       7.454653 11.24364       4.419728 25.65660 9.281281 29.59976 6.319643 -3.943155      11.22854 
1 1 1 -13 24 22 o 18.30490 6.353179 3.753308       3.462055 5.331099       7.016151 3.245497       3.980383 23.65535 8.922409 18.22159 6.750974 5.433764       11.18861 
1 1 1 -13 24 23 f 29.11090 5.123896 10.75650       3.502208 3.920058       6.984727 13.05250       4.047812 22.33281 8.774645 32.08721 5.366027 -9.754400      10.28536 
1 1 1 -13 24 24 o 61.80124 3.623121 47.03958       5.432591 53.01739       9.476372 44.11327       6.630276 65.03179 6.049072 59.64447 4.597135 5.387325       7.597692 
1 1 1 -13 24 25 o 34.97968 4.332186 15.31310       3.613966 19.22589       7.786731 14.23886       4.080014 38.11548 8.589721 33.52531 5.159221 4.590172       10.02002 
1 1 1 -13 24 26 f 22.54472 6.820888 6.479618       4.066302 9.275696       11.03040 6.039872       4.374390 29.44729 11.16921 22.07371 7.134958 7.373587       13.25363 
1 1 1 -13 24 27 o 39.79854 4.567223 19.89341       4.349336 30.86102       8.632614 16.16227       5.035089 48.65263 7.523685 35.40759 6.052757 13.24503       9.656175 
1 1 1 -13 24 28 o 93.50328 3.627071 108.1273       8.248872 107.0834       17.96626 108.4062       9.285418 90.33148 8.252801 93.43781 4.087850 -3.106323      9.209737 
1 1 1 -13 24 29 o 62.53395 3.625568 48.55844       5.501256 56.01975       10.12804 45.43582       6.552062 65.93925 6.382683 60.17732 4.500555 5.761929       7.809842 
1 1 1 -13 24 30 o 35.22641 5.483901 16.09002       4.554380 11.99384       7.486242 18.49685       5.738481 29.41602 9.315982 37.38573 6.536632 -7.969706      11.38047 
1 1 1 -13 24 31 o 24.96917 6.182285 8.385541       3.741642 5.591830       7.020651 9.493844       4.421971 22.76393 8.839495 26.40313 6.823660 -3.639208      11.16687 
1 1 1 -13 24 32 o 40.51259 4.508631 21.04088       4.375814 30.23920       8.070951 17.21141       5.207629 46.98360 7.284955 35.82277 6.189223 11.16082       9.559134 
1 1 1 -13 24 33 f 38.47549 4.723372 19.23589       4.335852 23.31316       7.384058 17.09028       5.356551 40.46285 7.771032 35.31567 6.462239 5.147182       10.10690 
1 1 1 -13 24 34 o 17.42475 6.620926 3.449865       3.880206 5.774827       6.393374 2.094107       4.882173 21.58093 8.419709 17.05558 7.099641 4.525356       11.01346 
1 1 1 -13 24 35 o 25.74201 6.865257 9.675219       4.385546 12.84460       9.446319 8.804406       4.951508 27.55820 10.36194 24.28223 7.560596 3.275970       12.82702 
1 1 1 -13 24 36 o 20.24882 7.684851 5.595989       5.223645 2.890414       6.696002 9.802580       8.349317 18.86670 8.102791 24.66247 9.621864 -5.795769      12.57917 
1 1 1 -13 24 37 o 21.25117 8.337711 6.641576       6.298693 7.943751       10.57169 5.924916       7.842710 23.16046 10.06408 21.18635 8.920660 1.974115       13.44856 
1 1 1 -13 24 38 o 25.49329 6.657755 10.00389       4.180303 15.46811       6.967859 6.931204       5.225090 29.31440 8.941050 20.93834 7.738956 8.376053       11.82514 
1 1 1 -13 24 39 o 12.82320 5.966520 -1.794830      4.520903 -6.743449      6.284117 3.514059       6.508847 12.83803 6.251497 17.97280 7.851917 -5.134769      10.03662 
1 1 1 -13 24 40 o 26.57654 6.425790 11.18283       4.115378 11.74927       6.724140 10.84358       5.203845 24.21958 8.807189 24.63270 7.762724 -0.4131241     11.73995 
1 1 1 -13 24 41 o 18.07877 6.906455 5.284987       4.236447 -0.1298063     8.417014 7.122122       4.902726 16.48505 7.815572 20.02793 7.478496 -3.542877      10.81717 
1 1 1 -13 25 1  o 126.5741 2.818450 195.5789       8.693435 205.4666       13.41715 188.4241       11.41326 129.5077 4.257151 124.0865 3.778813 5.421211       5.692343 
1 1 1 -13 25 2  o 164.2209 3.024423 329.3057       12.10338 328.6163       18.63757 329.8084       15.91629 163.7383 4.675714 164.2172 3.977287 -0.4789276     6.138494 
1 1 1 -13 25 3  o 107.6504 3.108270 141.6364       8.145456 152.9044       15.57880 137.3971       9.555667 111.4476 5.755737 105.9565 3.706523 5.491127       6.845934 
1 1 1 -13 25 4  o 126.6407 2.799807 195.7683       8.640476 190.2355       13.06375 200.0710       11.52024 124.6102 4.308557 127.8852 3.700515 -3.274971      5.679566 
1 1 1 -13 25 5  o 108.7664 3.183217 144.6048       8.428097 160.7978       17.00206 139.3294       9.704334 114.2216 6.130718 106.6972 3.738075 7.524399       7.180453 
1 1 1 -13 25 6  o 89.57017 3.239830 98.11910       7.060014 108.9755       14.23811 94.57957       8.129851 93.94350 6.255046 87.87478 3.805511 6.068718       7.321715 
1 1 1 -13 25 7  o 87.53041 3.281382 93.71780       6.986862 96.86239       13.92247 92.65926       8.077671 88.49278 6.501514 86.97349 3.820534 1.519295       7.540966 
1 1 1 -13 25 8  o 105.6673 3.722971 136.6602       9.571658 131.8594       16.09160 139.2888       11.90717 103.3320 6.422150 106.5554 4.596419 -3.223412      7.897536 
1 1 1 -13 25 9  o 107.4053 3.004445 140.9733       7.855956 132.6992       13.14098 145.5750       9.799981 103.8930 5.207053 109.0644 3.692606 -5.171341      6.383474 
1 1 1 -13 25 10 o 251.3347 3.890189 772.5505       23.82645 801.1346       39.34618 755.9993       29.94024 255.1636 6.327727 248.3434 4.947282 6.820221       8.032169 
1 1 1 -13 25 11 o 147.7891 3.068616 266.7646       11.05150 274.2430       18.87389 262.8629       13.63305 149.4267 5.191073 146.5591 3.820451 2.867661       6.445393 
1 1 1 -13 25 12 o 160.0734 3.119810 312.9993       12.16980 316.8128       20.44273 310.9059       15.14609 160.5954 5.230575 159.4242 3.898614 1.171219       6.523657 
1 1 1 -13 25 13 o 93.81573 2.971657 107.6006       6.785194 103.5424       11.70682 109.6536       8.326352 91.69756 5.261043 94.63152 3.617289 -2.933968      6.384619 
1 1 1 -13 25 14 o 119.6375 3.257890 175.0379       9.489326 166.8876       21.44164 177.0231       10.58207 115.8635 7.636660 120.2638 3.614870 -4.400276      8.449016 
1 1 1 -13 25 15 o 138.7042 3.012115 235.0311       10.18116 221.1317       16.87202 242.9908       12.76775 134.1009 5.172665 140.8876 3.722085 -6.786652      6.372627 
1 1 1 -13 25 16 o 140.9739 3.425800 243.0312       11.76893 243.3055       17.48179 242.8038       15.91577 140.6512 5.108912 140.6179 4.651027 0.3334045E-01  6.908909 
1 1 1 -13 25 17 o 172.4880 3.635915 364.1081       15.28300 366.1572       22.43043 362.3324       20.87966 172.4548 5.343803 171.6624 4.996598 0.7924042      7.315888 
1 1 1 -13 25 18 o 208.5895 3.956824 533.1053       20.11293 527.0661       28.97674 538.7198       27.93957 206.6859 5.758720 209.0791 5.488437 -2.393143      7.955237 
1 1 1 -13 25 19 o 139.2195 3.334927 237.1769       11.31417 263.6305       17.90760 219.6013       14.59658 146.2951 5.030581 133.6564 4.487883 12.63869       6.741502 
1 1 1 -13 25 20 o 64.18449 3.880000 50.69776       6.040390 44.52980       9.306294 55.18784       7.940224 59.58285 6.515521 66.78348 4.913361 -7.200626      8.160461 
1 1 1 -13 25 21 o 94.51340 2.908488 109.3786       6.690824 104.0681       11.76407 111.9178       8.134645 91.66711 5.288780 95.50041 3.501330 -3.833298      6.342752 
1 1 1 -13 25 22 o 97.50228 2.883100 116.4452       6.842791 101.8827       11.76451 123.8909       8.412148 90.60525 5.352090 100.4631 3.441166 -9.857887      6.362900 
1 1 1 -13 25 23 o 42.74766 3.914349 22.65451       4.032418 36.50062       8.376218 18.47750       4.600622 53.67755 6.538256 38.33329 5.047508 15.34426       8.259911 
1 1 1 -13 25 24 f 85.42647 2.902602 89.53913       6.033715 101.2869       11.56330 85.14377       7.072955 90.15904 5.286228 83.16986 3.497593 6.989182       6.338562 
1 1 1 -13 25 25 o 68.30997 3.845031 57.69496       6.374751 49.82999       13.96822 59.76400       7.164354 61.13564 9.699325 69.41544 4.255763 -8.279800      10.59190 
1 1 1 -13 25 26 f 63.49262 3.858948 49.96427       5.942548 62.34456       13.53714 47.00905       6.613882 69.04239 8.206271 61.40737 4.449962 7.635021       9.335152 
1 1 1 -13 25 27 o 25.96609 5.530351 8.783128       3.392127 27.93855       10.50970 6.555551       3.583939 44.88187 9.877483 22.39536 6.302562 22.48650       11.71695 
1 1 1 -13 25 28 o 60.57355 3.949393 45.75779       5.797956 57.67162       13.18876 42.90375       6.455176 65.54541 8.453723 58.41828 4.570802 7.127129       9.610290 
1 1 1 -13 25 29 o 39.64568 5.010609 20.12789       4.732931 25.84487       8.139521 17.20747       5.817527 43.57207 7.958933 35.85051 6.909490 7.721554       10.53972 
1 1 1 -13 25 30 o 35.23294 5.075837 16.07029       4.232491 9.419559       7.243864 19.51770       5.215332 26.41626 9.188629 38.60797 5.715755 -12.19171      10.82131 
1 1 1 -13 25 31 o 31.69502 5.561038 13.31673       4.138628 15.18493       7.512527 12.50271       4.958974 32.07342 9.158560 30.08853 6.909241 1.984890       11.47244 
1 1 1 -13 25 32 o 24.17734 6.370918 8.093189       3.805588 6.259837       6.775998 8.937927       4.599508 22.58847 8.707646 25.15393 7.160831 -2.565456      11.27389 
1 1 1 -13 25 33 o 26.25868 6.415128 9.704808       4.069349 8.378071       7.166486 10.33616       4.943656 24.26107 9.045138 26.64696 7.366815 -2.385883      11.66553 
1 1 1 -13 25 34 o 45.65364 4.408893 27.22281       4.844069 36.53311       7.997793 21.82854       6.087720 50.98180 6.591656 39.28339 6.592629 11.69841       9.322698 
1 1 1 -13 25 35 o 20.65700 7.721569 5.944588       5.229397 9.936898       7.138182 1.319866       7.682778 24.86530 9.069426 18.70571 8.334272 6.159590       12.31725 
1 1 1 -13 25 36 o 33.97230 6.751136 17.07948       5.392072 16.31833       6.964116 18.21876       8.520146 31.13714 8.793553 31.53432 9.932243 -0.3971786     13.26560 
1 1 1 -13 25 37 o 30.59360 6.143297 13.76903       4.420785 15.18512       7.297918 12.94821       5.556211 28.80216 9.206895 28.05546 7.830200 0.7467041      12.08631 
1 1 1 -13 25 38 o 22.23872 7.413717 8.211713       4.708043 5.496079       6.563267 11.09031       6.757331 19.48831 8.180412 24.30521 8.830279 -4.816902      12.03715 
1 1 1 -13 25 39 o 28.03595 6.359149 12.27193       4.244371 14.24916       7.186359 11.21274       5.259747 26.43069 9.154391 25.15157 7.786057 1.279119       12.01772 
1 1 1 -13 25 40 o 24.18188 6.718822 9.701250       4.100885 14.23134       7.154993 7.485104       5.004433 25.80400 9.120165 20.49282 7.573875 5.311178       11.85500 
1 1 1 -13 26 1  o 206.6919 3.390067 522.1635       17.07528 477.5006       25.33605 559.3325       23.11296 197.1494 5.278351 213.6846 4.438604 -16.53519      6.896535 
1 1 1 -13 26 2  o 206.5755 3.862061 522.0322       19.44168 581.6995       28.30398 468.7326       26.75108 217.6679 5.336014 195.2303 5.628746 22.43765       7.756019 
1 1 1 -13 26 3  o 167.3414 3.078226 342.0620       12.55278 365.5933       20.06304 326.9249       16.09144 172.6325 4.773700 163.4486 4.039966 9.183914       6.253761 
1 1 1 -13 26 4  f 150.9956 3.265427 278.5841       12.01546 277.9879       16.71286 279.2218       17.28650 150.5653 4.560271 150.8679 4.707668 -0.3026428     6.554251 
1 1 1 -13 26 5  o 17.55383 6.847100 2.331905       4.227416 -4.820230      7.163305 6.153942       5.236523 16.90223 7.736301 23.09423 7.819757 -6.192001      10.99995 
1 1 1 -13 26 6  o 73.97058 3.408421 67.01376       6.127445 75.13514       12.20535 64.27719       7.084975 77.83406 6.494066 72.36560 4.033592 5.468460       7.644786 
1 1 1 -13 26 7  o 44.82034 5.459597 25.02535       5.840209 24.98179       9.417629 25.05258       7.444551 44.03170 9.078634 44.51876 7.100492 -0.4870605     11.52556 
1 1 1 -13 26 8  o 123.0882 3.250524 185.2527       9.741495 175.4490       19.07267 188.7129       11.33094 119.1304 6.595555 124.1616 3.749214 -5.031273      7.586696 
1 1 1 -13 26 9  o 190.4003 3.689114 443.3456       17.11692 468.9158       35.48404 435.5912       19.54076 194.5588 7.498249 188.6140 4.251395 5.944778       8.619635 
1 1 1 -13 26 10 o 123.2075 3.011811 185.4240       9.042759 172.3312       14.84608 193.1466       11.40189 118.3829 5.158583 125.6088 3.729081 -7.225922      6.365299 
1 1 1 -13 26 11 o 65.28793 3.873563 52.33804       6.135120 45.63113       9.569823 57.01801       7.994000 60.47953 6.600204 68.01107 4.855282 -7.531540      8.193685 
1 1 1 -13 26 12 o 154.3051 4.104946 291.7458       15.42190 299.4570       19.87992 280.0923       24.43897 156.0603 5.234814 150.4950 6.680491 5.565338       8.487181 
1 1 1 -13 26 13 o 119.7599 4.004438 175.8126       11.67019 171.8363       14.81827 182.3068       18.93756 118.1616 5.158608 121.3860 6.424936 -3.224350      8.239602 
1 1 1 -13 26 14 o 107.3363 3.941707 141.2755       10.29269 130.7464       19.75776 145.1972       12.05811 102.2377 7.993824 108.7015 4.562197 -6.463814      9.204068 
1 1 1 -13 26 15 o 69.72472 3.765970 59.69474       6.375069 64.23599       10.13221 56.71888       8.202053 71.96214 5.827641 67.75718 5.002704 4.204964       7.680394 
1 1 1 -13 26 16 o 73.02272 3.178085 65.33296       5.641809 60.80205       10.08840 67.39483       6.805498 69.94160 5.976236 74.08392 3.782156 -4.142319      7.072489 
1 1 1 -13 26 17 o 90.38950 2.999449 100.0102       6.597719 113.3260       12.03273 94.28578       7.889438 95.80429 5.173173 87.65491 3.701797 8.149384       6.361212 
1 1 1 -13 26 18 o 89.80701 3.374576 98.88583       7.372118 99.39095       11.56026 98.53960       9.570762 89.62643 5.316812 89.45450 4.403980 0.1719360      6.903878 
1 1 1 -13 26 19 o 86.18604 3.512608 91.17683       7.361930 94.52110       11.41563 88.79563       9.632658 87.32613 5.390658 84.80959 4.678981 2.516548       7.138071 
1 1 1 -13 26 20 o 52.67863 3.544831 34.18294       4.524080 43.81384       8.898362 30.82565       5.253771 59.05414 6.279521 49.86751 4.367359 9.186630       7.648935 
1 1 1 -13 26 21 o 78.45235 3.444734 75.65210       6.569582 82.61328       10.91048 71.69263       8.228494 81.44360 5.530114 76.14326 4.454031 5.300339       7.100743 
1 1 1 -13 26 22 o 143.7429 3.019068 253.2661       10.57537 263.5996       18.40681 248.1744       12.92075 145.7105 5.192140 142.0179 3.736680 3.692596       6.396959 
1 1 1 -13 26 23 o 19.19835 6.306827 4.462867       3.410812 1.912053       7.358403 5.160904       3.849313 20.96834 8.721230 20.53605 6.697232 0.4322910      10.99603 
1 1 1 -13 26 24 o 56.73614 4.208042 40.01395       5.776612 48.43148       15.17927 38.58842       6.246630 59.47021 10.87467 55.58802 4.654035 3.882183       11.82872 
1 1 1 -13 26 25 o 42.02316 4.104205 22.06591       4.149435 13.93332       10.49190 23.57379       4.517766 32.44023 11.06754 43.38852 4.330588 -10.94829      11.88463 
1 1 1 -13 26 26 o 57.14100 3.252939 40.37935       4.510888 34.58705       8.650026 42.54296       5.286661 51.45546 7.086404 58.52388 3.726265 -7.068413      8.006384 
1 1 1 -13 26 27 o 80.86112 3.120801 80.79217       6.137985 77.71907       14.40251 81.47420       6.784996 76.57046 7.828709 81.08070 3.441795 -4.510239      8.551879 
1 1 1 -13 26 28 o 12.83789 5.459002 0.2462030      2.985317 -12.60563      6.759628 3.360276       3.327398 12.77056 6.273940 17.24700 6.205824 -4.476448      8.824657 
1 1 1 -13 26 29 o 36.51865 4.034868 16.90068       3.530902 21.97501       7.508351 15.45987       4.000904 39.72636 8.032297 34.60345 4.879964 5.122910       9.398502 
1 1 1 -13 26 30 o 38.36544 4.682261 18.98134       4.286972 13.27588       7.722637 21.52262       5.154024 29.94990 9.458996 40.56322 5.343947 -10.61332      10.86418 
1 1 1 -13 26 31 o 49.79386 4.042770 31.59260       4.863423 23.23843       8.092202 36.31639       6.084997 39.71154 8.610663 52.97037 4.764888 -13.25883      9.841123 
1 1 1 -13 26 32 o 18.78604 6.590889 4.588329       3.731673 4.139972       6.754130 4.785330       4.477052 20.44414 8.415247 19.46417 7.168967 0.9799690      11.05488 
1 1 1 -13 26 33 o 23.45650 6.810372 7.978920       4.121625 9.979545       6.749412 6.789209       5.204799 25.34947 8.866092 21.84176 7.772788 3.507715       11.79084 
1 1 1 -13 26 34 o 32.56958 8.380143 16.79468       6.689438 8.534493       9.850263 23.86503       9.113253 24.10610 10.06337 37.33711 9.868464 -13.23101      14.09461 
1 1 1 -13 26 35 o 19.85404 7.502427 5.524810       4.965859 10.88673       6.461454 -2.211806      7.761497 25.55083 8.685965 16.74087 7.798907 8.809963       11.67343 
1 1 1 -13 26 36 o 12.85656 5.788293 -0.5576153     3.812024 -1.372132      6.336986 -0.9573145E-01 4.771986 15.47130 7.151847 14.48781 6.503305 0.9834919      9.666534 
1 1 1 -13 26 37 o 17.76350 6.759541 4.488278       4.048043 -3.642012      6.536888 9.545483       5.155529 14.36669 6.833198 23.70444 7.751985 -9.337749      10.33372 
1 1 1 -13 26 38 o 29.58719 6.121091 13.34993       4.267684 12.80036       6.758575 13.71436       5.503715 25.52421 8.875675 28.10614 7.773943 -2.581938      11.79881 
1 1 1 -13 26 39 o 12.35307 5.636567 -0.5839936     3.764127 -2.575624      6.435933 0.4514580      4.640577 14.26774 6.784451 14.11925 6.368959 0.1484890      9.305505 
1 1 1 -13 27 1  o 112.3637 3.588051 154.6044       9.812140 132.7539       15.67378 168.6865       12.58281 103.5780 6.238609 117.2281 4.412512 -13.65006      7.641368 
1 1 1 -13 27 2  o 156.7376 4.834084 301.7330       18.44183 0.000000       0.000000 301.7330       18.44183 ?        ?        156.7376 4.834084 0.000000       4.834084 
1 1 1 -13 27 3  o 169.1664 4.021625 350.3740       16.57875 359.8391       28.52911 345.5479       20.37152 170.5140 6.879942 167.7070 4.990217 2.806992       8.499168 
1 1 1 -13 27 4  o 219.4806 5.543180 592.6783       29.62399 547.7589       40.50011 644.3650       43.44392 209.9305 7.930967 227.7655 7.838859 -17.83493      11.15114 
1 1 1 -13 27 5  o 116.1268 4.434169 165.5091       12.52513 171.1214       18.20707 160.4669       17.25746 117.6335 6.375273 113.9377 6.239276 3.695854       8.920352 
1 1 1 -13 27 6  o 132.5804 4.717897 215.8669       15.21847 242.2935       22.06134 191.8746       21.02069 139.9930 6.484416 124.4036 6.961675 15.58937       9.513809 
1 1 1 -13 27 7  o 98.98981 3.676899 120.0481       8.854272 122.7577       15.17450 118.6494       10.90273 99.58807 6.284804 98.26587 4.565464 1.322197       7.768026 
1 1 1 -13 27 8  o 216.6339 5.568878 577.6767       29.37447 606.0145       43.17352 553.2519       40.08207 220.6821 8.041573 210.9694 7.809889 9.712708       11.20987 
1 1 1 -13 27 9  o 77.83214 3.934014 74.36030       7.437386 75.43739       12.78948 73.80994       9.142121 77.82965 6.811886 77.39060 4.872282 0.4390488      8.375017 
1 1 1 -13 27 10 o 138.0884 3.873316 233.6567       13.02108 252.3111       23.63186 225.5242       15.60330 142.6678 6.817014 135.4729 4.733646 7.194885       8.299342 
1 1 1 -13 27 11 o 67.16222 3.433130 55.32198       5.600259 52.64626       9.506461 56.74409       6.930501 65.05858 6.066143 67.91232 4.208419 -2.853745      7.383013 
1 1 1 -13 27 12 o 52.75871 3.830990 34.26592       4.891840 40.70218       8.892287 31.47279       5.857899 57.02134 6.516273 50.39322 4.829192 6.628120       8.110665 
1 1 1 -13 27 13 o 150.7348 3.453055 278.0508       12.68391 283.2258       29.11156 276.8382       14.09180 150.5296 7.964448 150.2778 3.851178 0.2518768      8.846694 
1 1 1 -13 27 14 o 181.5561 3.309518 403.3288       14.64238 378.7907       23.68509 418.5082       18.62869 175.1933 5.554827 184.7221 4.138351 -9.528748      6.926908 
1 1 1 -13 27 15 o 87.31042 3.070281 93.35688       6.522346 85.76148       11.24638 97.20624       8.006302 83.18630 5.580129 88.99357 3.699862 -5.807266      6.695283 
1 1 1 -13 27 16 f 138.0596 3.022866 233.1779       10.17001 224.3009       16.98943 238.1351       12.69598 134.7865 5.182106 139.3211 3.742890 -4.534622      6.392453 
1 1 1 -13 27 17 o 182.3934 3.330316 407.4981       14.80235 404.3555       24.23830 409.3673       18.69310 180.7814 5.508320 182.5257 4.202632 -1.744278      6.928470 
1 1 1 -13 27 18 o 130.6042 3.044125 208.8424       9.688484 217.2527       16.67291 204.5547       11.90468 132.5100 5.173229 129.0313 3.790159 3.478699       6.413081 
1 1 1 -13 27 19 o 78.18633 3.095141 75.01356       5.885567 72.70029       10.69704 76.01788       7.048335 76.29768 5.796669 78.59265 3.690481 -2.294975      6.871755 
1 1 1 -13 27 20 o 21.68661 7.049394 5.760190       4.266597 0.8446342      7.197384 8.423466       5.297811 20.09102 8.506939 25.66086 7.790145 -5.569838      11.53492 
1 1 1 -13 27 21 o 101.9387 2.934016 127.5030       7.280910 143.1959       13.27120 120.7457       8.708508 107.2978 5.090062 99.01905 3.615085 8.278778       6.243202 
1 1 1 -13 27 22 o 67.57505 3.662345 56.39744       6.008357 52.71682       9.892641 58.54872       7.563108 64.44711 6.382768 68.60844 4.549320 -4.161339      7.838115 
1 1 1 -13 27 23 o 26.34293 6.768896 9.135096       4.368402 8.665132       9.588345 9.258196       4.907285 27.85758 10.44692 26.49729 7.345121 1.360291       12.77063 
1 1 1 -13 27 24 o 28.78089 5.872489 10.80312       3.979095 0.000000       0.000000 10.80312       3.979095 ?        ?        28.78089 5.872489 0.000000       5.872489 
1 1 1 -13 27 25 f 13.26070 5.685108 0.2539199E-01  3.285448 -7.120307      7.225438 1.887905       3.688854 15.48115 7.310215 15.93752 6.340454 -0.4563751     9.676807 
1 1 1 -13 27 26 o 79.00903 3.167302 77.22720       6.085850 69.93719       14.13738 78.88541       6.742574 72.18320 8.181142 79.73051 3.478656 -7.547310      8.890002 
1 1 1 -13 27 27 o 34.94394 4.334414 15.52987       3.611870 15.50569       7.363820 15.53754       4.144678 33.04593 8.932748 34.70129 5.049280 -1.655365      10.26105 
1 1 1 -13 27 28 o 38.70106 4.392819 19.11267       4.069676 17.95258       7.354257 19.62473       4.885970 35.42057 8.606088 38.83739 5.300751 -3.416817      10.10756 
1 1 1 -13 27 29 o 34.35056 4.471979 15.20639       3.654645 16.29875       7.524398 14.86912       4.180932 33.15077 9.058384 33.61549 5.277503 -0.4647217     10.48362 
1 1 1 -13 27 30 o 13.58567 5.619274 1.032305       3.031162 4.906539       6.582555 -0.1028565E-01 3.414747 21.20910 8.459186 13.17646 5.722780 8.032641       10.21313 
1 1 1 -13 27 31 o 40.51497 4.040956 21.12644       3.936503 37.40477       8.257689 16.33932       4.478073 51.86884 6.688589 34.83185 5.454561 17.03698       8.630728 
1 1 1 -13 27 32 o 19.79694 6.683390 5.420855       3.825074 4.204390       6.531519 6.055839       4.718957 20.02569 8.262481 20.85727 7.403303 -0.8315754     11.09403 
1 1 1 -13 27 33 o 47.64643 6.342883 32.05466       7.181890 45.50181       12.33020 25.15005       8.835367 51.92966 10.10736 38.96031 9.412347 12.96935       13.81126 
1 1 1 -13 27 34 o 28.95834 7.628766 13.12277       5.457564 16.24032       7.006283 8.312301       8.703105 31.08343 8.834340 23.19296 9.550238 7.890469       13.00971 
1 1 1 -13 27 35 f 14.43277 6.112139 1.425286       3.716507 -0.7027584     5.858776 2.858216       4.807607 15.35034 7.014827 16.85164 7.032352 -1.501302      9.932863 
1 1 1 -13 27 36 o 33.92767 5.497534 16.52493       4.389842 15.81150       6.910255 17.00766       5.684156 29.31679 8.896396 32.54388 7.342561 -3.227095      11.53512 
1 1 1 -13 27 37 o 24.17746 7.656915 10.15149       5.057252 10.67273       7.046399 9.597775       7.262567 23.37058 8.912219 22.37633 8.898307 0.9942436      12.59395 
1 1 1 -13 27 38 o 13.24139 5.890798 0.4566431      3.823460 2.016742       6.242230 -0.4801135     4.837012 16.45040 7.406600 13.76431 6.321255 2.686095       9.737350 
1 1 1 -13 28 1  o 27.85310 6.205137 9.956162       4.103829 8.346340       6.630136 10.95596       5.225028 26.42213 8.797598 29.13789 7.358145 -2.715752      11.46909 
1 1 1 -13 28 2  o 77.16782 2.969283 72.89679       5.573305 75.04632       8.026799 70.89581       7.744468 78.11333 4.232593 75.92130 4.202322 2.192032       5.964424 
1 1 1 -13 28 3  o 95.70084 2.841747 112.0156       6.619970 101.5982       9.450457 122.0521       9.276081 90.91674 4.277522 99.75073 3.823112 -8.833992      5.737018 
1 1 1 -13 28 4  o 81.18456 2.949000 80.66214       5.824547 82.73696       8.552299 78.86726       7.954461 82.02335 4.293626 80.11185 4.088049 1.911491       5.928522 
1 1 1 -13 28 5  o 66.11833 4.383071 53.86200       7.022278 62.28303       11.37953 48.68296       8.924128 70.63219 6.691059 62.54930 5.925386 8.082890       8.937587 
1 1 1 -13 28 6  o 89.34846 3.358594 97.80083       7.299731 130.7309       15.46185 88.35584       8.280674 102.6939 6.207449 84.81665 4.017768 17.87727       7.394247 
1 1 1 -13 28 7  o 134.5241 3.312604 221.3779       10.85940 216.4175       21.12467 223.1595       12.66029 132.0811 6.583919 134.9155 3.854706 -2.834381      7.629334 
1 1 1 -13 28 8  o 14.60265 6.263134 -0.1832307     3.990696 -2.317118      7.050392 0.8227241      4.840796 18.04676 8.015655 16.94504 7.062817 1.101728       10.68336 
1 1 1 -13 28 9  o 172.9355 3.562879 366.1460       15.01486 352.2086       29.67169 370.9434       17.40825 168.2053 7.255862 173.9281 4.107232 -5.722794      8.337679 
1 1 1 -13 28 10 o 19.18565 7.044391 3.688038       4.317305 11.59907       8.719031 1.118353       4.969259 30.72963 10.08300 17.39759 7.195294 13.33204       12.38706 
1 1 1 -13 28 11 o 45.50702 4.459504 25.67270       4.881970 28.68530       10.14627 24.76512       5.569000 46.98319 9.191259 44.54277 5.230072 2.440422       10.57511 
1 1 1 -13 28 12 o 149.5067 3.491294 273.7563       12.71988 272.4295       29.56160 274.0578       14.09103 147.1966 8.274582 149.4515 3.872328 -2.254929      9.135843 
1 1 1 -13 28 13 o 83.31064 3.136741 85.05791       6.356804 80.94112       11.14814 87.04134       7.738068 80.72855 5.703534 84.16861 3.782311 -3.440056      6.843696 
1 1 1 -13 28 14 o 42.25279 4.441532 22.19068       4.504941 34.51238       8.872092 17.91022       5.229210 52.13831 7.172735 37.60115 5.900956 14.53717       9.288133 
1 1 1 -13 28 15 o 80.84929 3.175822 80.17374       6.244863 80.31355       10.92180 80.10583       7.611907 80.36229 5.612341 80.68374 3.882827 -0.3214493     6.824567 
1 1 1 -13 28 16 o 81.57479 3.632343 81.82510       7.202584 77.37975       10.87980 85.29333       9.609964 78.79640 5.704651 83.01906 4.770239 -4.222656      7.436278 
1 1 1 -13 28 17 o 108.8408 3.383648 145.4705       8.963655 156.8614       14.08327 137.7138       11.62154 112.4578 5.152683 105.5714 4.527849 6.886398       6.859414 
1 1 1 -13 28 18 o 64.21197 3.373168 50.75079       5.259739 51.50836       9.691950 50.43454       6.262101 63.90256 6.305915 63.87056 4.044073 0.3200150E-01  7.491267 
1 1 1 -13 28 19 o 56.99306 4.050673 40.24102       5.589148 39.30519       9.196650 40.78909       7.038005 55.44814 6.959114 57.10690 5.111364 -1.658752      8.634542 
1 1 1 -13 28 20 o 13.79356 6.138840 -1.388143      4.156357 -0.7949312     8.931738 -1.552108      4.695768 21.02563 9.191532 14.64329 6.520529 6.382347       11.26950 
1 1 1 -13 28 21 o 20.75214 6.711207 5.348394       3.869917 17.29258       10.23685 3.356795       4.180123 35.50194 10.83910 18.40703 6.898855 17.09491       12.84835 
1 1 1 -13 28 22 o 62.23272 3.499582 47.91693       5.285886 48.61235       12.44032 47.76372       5.839206 60.42876 8.698197 62.02460 3.882735 -1.595837      9.525454 
1 1 1 -13 28 23 o 73.71563 3.358824 67.18943       6.017836 86.69034       16.08892 64.01743       6.488834 80.94828 8.272289 71.83224 3.719571 9.116035       9.070060 
1 1 1 -13 28 24 o 20.49357 6.167911 5.447054       3.331262 -1.713420      6.958380 7.576160       3.794337 17.73010 7.913500 23.89189 6.392036 -6.161789      10.17259 
1 1 1 -13 28 25 f 38.13132 4.068202 18.33507       3.721931 18.15602       7.616361 18.39125       4.265993 35.98188 8.767758 37.97692 4.710534 -1.995037      9.953026 
1 1 1 -13 28 26 o 43.27850 3.777369 23.53479       3.943920 27.93110       7.888096 22.06948       4.553997 45.41057 7.381450 41.61062 4.566011 3.799953       8.679531 
1 1 1 -13 28 27 o 56.76703 3.634320 40.42466       5.001131 43.58912       8.897480 38.96313       6.046730 57.23344 6.494078 55.29356 4.527158 1.939888       7.916325 
1 1 1 -13 28 28 o 36.21740 4.224117 16.81458       3.658205 8.065737       7.235628 19.81883       4.240028 24.58633 9.103390 39.22193 4.518609 -14.63560      10.16315 
1 1 1 -13 28 29 o 68.73070 3.070014 59.07649       5.128964 49.75066       9.308252 63.14243       6.146175 60.52019 6.408754 70.73910 3.577018 -10.21891      7.339427 
1 1 1 -13 28 30 o 31.41269 4.949201 13.14212       3.663337 8.876524       6.719073 14.94647       4.369977 24.51342 8.818870 33.16339 5.606998 -8.649969      10.45040 
1 1 1 -13 28 31 f 18.21504 6.230133 4.445356       3.325070 5.435719       6.378303 4.075772       3.896410 20.92251 8.332843 18.02639 6.679248 2.896122       10.67936 
1 1 1 -13 28 32 o 32.10242 6.012383 14.53678       4.530688 13.55399       7.058746 15.22533       5.908361 28.55088 9.046586 31.47932 7.753773 -2.928442      11.91477 
1 1 1 -13 28 33 o 15.47913 6.366391 2.136583       3.861564 3.969307       6.552485 1.161361       4.779792 19.27016 8.136037 15.62976 6.779603 3.640399       10.59047 
1 1 1 -13 28 34 o 19.10259 6.813706 5.341665       4.001818 2.129324       6.341339 7.467631       5.158795 17.50912 7.696846 21.68637 7.736122 -4.177254      10.91279 
1 1 1 -13 28 35 o 15.47791 6.436343 2.374013       4.006657 6.829959       6.655761 -0.1584878     5.017676 20.68155 8.414558 14.53578 6.583401 6.145764       10.68391 
1 1 1 -13 28 36 o 19.29369 7.310697 5.917501       4.722860 1.337329       6.390043 11.43169       7.011381 16.45365 7.442914 24.13397 8.956512 -7.680326      11.64543 
1 1 1 -13 28 37 o 23.99938 6.840637 9.535187       4.194797 17.71204       6.905937 4.754344       5.280581 30.24393 8.825459 17.97829 7.424612 12.26565       11.53315 
1 1 1 -13 29 1  o 59.71744 3.159350 43.76898       4.581282 45.07011       6.430281 42.42772       6.528660 60.39889 4.398984 58.55133 4.612865 1.847561       6.374135 
1 1 1 -13 29 2  o 45.54334 3.665734 25.58535       4.034044 24.12085       5.572655 27.19772       5.847245 43.91032 5.315969 46.68172 5.229861 -2.771397      7.457276 
1 1 1 -13 29 3  f 78.73982 2.923129 75.93015       5.599173 88.93185       8.477798 65.87117       7.456925 85.02190 4.103936 73.12540 4.202312 11.89651       5.873816 
1 1 1 -13 29 4  o 16.09256 6.029680 2.414853       3.192704 0.7401897      4.233151 4.624276       4.862274 15.86057 6.607256 20.85178 7.501959 -4.991207      9.996760 
1 1 1 -13 29 5  o 96.15211 3.934779 113.5953       9.200191 89.17738       13.62435 134.0630       12.47373 84.48614 6.671617 104.2309 4.924855 -19.74481      8.292446 
1 1 1 -13 29 6  o 118.4519 3.293081 171.9033       9.496400 187.9273       18.81208 166.4236       11.00095 122.9719 6.298598 116.4220 3.882998 6.549919       7.399325 
1 1 1 -13 29 7  o 21.73693 7.296796 5.564624       4.559665 11.24102       8.065166 2.897995       5.527877 30.03105 9.686486 19.78191 7.795814 10.24915       12.43393 
1 1 1 -13 29 8  o 102.3433 3.273372 128.3720       8.153276 106.4217       15.51758 136.7426       9.582599 92.20436 6.957492 105.5393 3.731787 -13.33498      7.895121 
1 1 1 -13 29 9  o 72.07207 3.613447 63.83267       6.326118 61.72031       12.25991 64.59919       7.385248 69.95871 7.298554 72.39664 4.204197 -2.437927      8.422835 
1 1 1 -13 29 10 o 58.64935 3.882875 42.39707       5.518242 43.91761       10.51538 41.81918       6.482601 58.80577 7.508923 58.10913 4.615827 0.6966362      8.814181 
1 1 1 -13 29 11 o 98.05482 3.739726 118.1414       8.919656 0.000000       0.000000 118.1414       8.919656 ?        ?        98.05482 3.739726 0.000000       3.739726 
1 1 1 -13 29 12 o 87.01383 3.395303 92.95246       7.185691 124.5361       15.81138 84.73131       8.066872 99.78080 6.538620 82.94733 4.002676 16.83347       7.666484 
1 1 1 -13 29 13 o 58.40534 3.649051 42.03228       5.167652 39.34582       9.237347 43.25602       6.234519 55.68120 6.959274 59.11408 4.358537 -3.432880      8.211476 
1 1 1 -13 29 14 o 54.86024 3.723920 37.14112       4.948941 41.46277       8.782462 35.13036       5.990626 57.30736 6.397843 53.15214 4.672546 4.155216       7.922442 
1 1 1 -13 29 15 o 21.22378 7.215726 5.309064       4.459186 0.5396225      7.026691 8.524967       5.769905 19.66604 8.369288 25.95672 8.173233 -6.290676      11.69815 
1 1 1 -13 29 16 o 27.53232 7.694668 9.902317       5.361615 8.916640       7.151980 11.16706       8.101399 26.97645 9.138677 29.64245 9.718933 -2.666002      13.34066 
1 1 1 -13 29 17 o 35.50892 6.254455 16.23694       5.214443 1.103178       9.445230 22.87158       6.253854 22.73079 9.689400 42.29641 6.255934 -19.56562      11.53348 
1 1 1 -13 29 18 o 76.79691 4.001136 72.99067       7.462129 52.63568       13.69596 81.58407       8.898966 63.07062 9.180309 81.03207 4.524541 -17.96146      10.23472 
1 1 1 -13 29 19 o 96.57772 3.276528 114.8796       7.700121 95.50203       15.93319 120.7844       8.795431 85.97663 7.685744 98.90252 3.655625 -12.92589      8.510832 
1 1 1 -13 29 20 f 64.86208 3.355768 51.97605       5.286154 58.48480       9.572916 49.12072       6.340500 67.89931 5.842276 62.81604 4.165596 5.083271       7.175262 
1 1 1 -13 29 21 o 41.89188 4.129649 21.98703       4.161027 25.38366       8.214505 20.81467       4.825987 43.54184 8.037775 40.49191 4.996703 3.049931       9.464294 
1 1 1 -13 29 22 o 44.21933 4.357058 24.60903       4.634136 21.16439       12.16439 25.19382       5.012088 37.94355 11.85596 44.64027 4.676735 -6.696724      12.74502 
1 1 1 -13 29 23 o 59.27419 3.595114 43.73968       5.168536 42.92639       11.67489 43.93793       5.764163 55.87601 8.870204 59.25400 4.015649 -3.377983      9.736835 
1 1 1 -13 29 24 o 62.93892 3.336487 49.25382       5.099063 43.56138       9.058608 51.89405       6.169264 57.54360 6.577987 64.35120 3.953136 -6.807598      7.674451 
1 1 1 -13 29 25 o 47.31948 3.747800 28.14160       4.286408 21.81602       8.066165 30.63084       5.059994 39.11438 8.688372 49.16365 4.265646 -10.04926      9.679026 
1 1 1 -13 29 26 o 16.35304 6.353703 2.552856       3.628841 4.608614       6.358220 1.559725       4.419292 21.10858 8.347688 16.32241 6.771191 4.786167       10.74862 
1 1 1 -13 29 27 o 52.92887 3.433313 35.22646       4.404457 30.75613       7.658611 37.43562       5.383869 47.35471 6.834193 54.21473 4.105646 -6.860023      7.972610 
1 1 1 -13 29 28 o 79.59414 2.997450 79.18684       5.803533 80.41714       10.13840 78.58720       7.077884 78.09518 5.359824 78.77745 3.697249 -0.6822739     6.511326 
1 1 1 -13 29 29 o 29.32314 5.377761 11.67716       3.701232 16.02039       6.827861 9.869823       4.404507 32.18365 8.558441 26.15196 6.836017 6.031691       10.95345 
1 1 1 -13 29 30 o 15.94969 6.084246 2.862695       3.284712 -1.424471      6.300138 4.463102       3.849287 16.00721 7.299407 18.46757 6.670894 -2.460361      9.888487 
1 1 1 -13 29 31 o 57.96124 4.037387 43.63421       5.666965 38.35865       8.566744 47.73896       7.556571 51.27913 7.041223 59.37232 5.277758 -8.093189      8.799634 
1 1 1 -13 29 32 o 30.53648 5.744400 13.22441       4.117793 6.705262       10.81945 14.32866       4.452904 22.62614 9.995569 31.61933 5.998421 -8.993189      11.65729 
1 1 1 -13 29 33 o 32.41396 5.047993 14.57626       3.857576 3.622736       6.750386 19.88793       4.700750 18.74634 8.094098 37.75972 5.250445 -19.01339      9.647881 
1 1 1 -13 29 34 o 24.05795 6.147512 8.778388       3.616998 8.824847       6.762988 8.759775       4.280651 22.34285 8.675831 23.37164 6.982082 -1.028790      11.13640 
1 1 1 -13 29 35 o 10.34689 4.895071 -2.604296      3.268558 -11.27023      5.976408 1.093967       3.904195 11.08709 5.525462 14.03153 6.106399 -2.944440      8.235219 
1 1 1 -13 29 36 o 13.96384 6.134892 1.021373       4.023515 8.455513       6.494646 -3.608901      5.125585 21.25818 8.427270 12.50598 5.976600 8.752198       10.33144 
1 1 1 -13 30 1  o 40.56343 3.899917 20.40397       3.807567 25.66453       5.194443 14.29526       5.597550 45.36013 4.770578 33.17269 7.136279 12.18744       8.583991 
1 1 1 -13 30 2  o 20.85637 6.027629 5.527998       3.235454 7.391121       4.233906 2.912818       5.016159 24.01490 6.881310 19.09200 7.455250 4.922895       10.14560 
1 1 1 -13 30 3  o 111.8611 3.212477 153.4565       8.747929 154.7780       11.57293 151.6948       13.36190 112.0725 4.245160 110.7206 4.964893 1.351875       6.532347 
1 1 1 -13 30 4  f 32.68048 5.189612 13.51500       3.994947 11.99875       5.082656 15.96581       6.461896 30.39142 7.006302 34.97445 7.782419 -4.583023      10.47160 
1 1 1 -13 30 5  o 81.17437 4.582378 81.46110       9.027735 84.32625       12.64338 78.48095       12.89462 82.05080 6.373250 79.00347 6.762689 3.047325       9.292592 
1 1 1 -13 30 6  o 53.09789 4.000729 34.84776       5.138616 51.65308       9.846534 28.55779       6.023995 64.09382 6.389243 47.77307 5.261485 16.32075       8.276814 
1 1 1 -13 30 7  o 33.76933 5.548535 14.48470       4.407569 12.75114       8.457282 15.13111       5.164348 31.49903 9.892015 34.32559 6.409583 -2.826559      11.78706 
1 1 1 -13 30 8  o 44.15324 5.246830 24.45109       5.535147 27.12807       8.884305 22.75278       7.076368 45.66109 8.289597 42.06234 7.159958 3.598751       10.95365 
1 1 1 -13 30 9  o 54.01839 4.084915 36.10478       5.337403 46.86143       10.92486 32.73236       6.117137 60.57541 7.565362 51.22823 4.962141 9.347183       9.047516 
1 1 1 -13 30 10 o 86.42366 4.896890 92.63377       10.27090 0.000000       0.000000 92.63377       10.27090 ?        ?        86.42366 4.896890 0.000000       4.896890 
1 1 1 -13 30 11 o 55.44732 4.777530 38.27708       6.392462 39.87443       10.94826 37.45084       7.874039 55.44043 8.363649 54.49941 6.029560 0.9410133      10.31049 
1 1 1 -13 30 12 o 111.4279 3.862900 152.9833       10.47336 165.0933       18.78259 147.5189       12.61694 114.4697 6.763459 109.1046 4.756855 5.365067       8.268739 
1 1 1 -13 30 13 o 22.40695 7.515111 6.058198       4.836683 14.23358       8.425029 2.039278       5.907069 32.75823 9.797385 19.33108 7.903702 13.42715       12.58798 
1 1 1 -13 30 14 o 80.71921 5.013700 81.18345       9.813458 86.51083       13.77224 75.68871       13.98690 82.53345 6.911001 76.85399 7.566261 5.679459       10.24745 
1 1 1 -13 30 15 o 62.70275 4.421683 48.88825       6.712997 61.14235       12.49289 43.91362       7.959803 68.91336 7.563287 59.04861 5.598549 9.864746       9.409945 
1 1 1 -13 30 16 o 45.77739 5.237490 26.45679       5.737604 19.78591       9.926589 29.80356       7.031083 37.88406 10.42550 48.33403 6.105402 -10.44997      12.08168 
1 1 1 -13 30 17 o 12.66359 5.675751 -1.457901      3.619540 3.235462       6.849929 -3.275974      4.263337 21.25212 8.576390 12.65899 5.856851 8.593131       10.38543 
1 1 1 -13 30 18 o 67.38328 3.258516 56.05978       5.334807 64.01540       9.692960 52.60265       6.389645 71.11716 5.639147 65.03331 4.051985 6.083855       6.943958 
1 1 1 -13 30 19 o 40.79368 4.375941 20.93821       4.282200 21.03537       7.499743 20.89121       5.216062 39.51361 8.062005 40.40992 5.434500 -0.8963051     9.722639 
1 1 1 -13 30 20 o 15.38824 6.179273 1.625274       3.536927 5.868909       6.515790 -0.1475128     4.211398 23.01624 8.615935 14.75525 6.382071 8.260994       10.72218 
1 1 1 -13 30 21 o 79.85682 3.365757 79.06535       6.535156 65.81079       15.29260 82.02670       7.228431 69.01870 9.331211 81.21329 3.661840 -12.19459      10.02400 
1 1 1 -13 30 22 f 45.70839 4.326862 26.41138       4.762159 13.84805       10.27195 29.85091       5.374652 31.24065 10.93690 48.50524 4.602061 -17.26459      11.86569 
1 1 1 -13 30 23 o 70.03526 3.165517 60.93850       5.388567 51.78129       9.352598 65.48882       6.592820 62.85956 6.185595 72.32843 3.753309 -9.468868      7.235255 
1 1 1 -13 30 24 o 17.81610 6.348009 3.780586       3.472581 -1.435446      6.530111 5.837223       4.100428 16.96552 7.612160 21.05401 6.914999 -4.088491      10.28407 
1 1 1 -13 30 25 o 29.95424 5.341414 11.91332       3.755961 13.36533       6.817563 11.28055       4.500555 30.08218 8.766127 28.57120 6.597292 1.510977       10.97129 
1 1 1 -13 30 26 o 44.35499 3.872080 25.05324       4.143348 30.63755       7.450702 22.55315       4.985292 47.24139 6.656291 41.45801 5.037811 5.783375       8.347799 
1 1 1 -13 30 27 o 20.73184 6.287663 5.965482       3.452464 3.201130       6.465196 7.068244       4.083438 19.47244 8.142670 22.34417 6.850359 -2.871733      10.64098 
1 1 1 -13 30 28 o 39.45692 4.244749 20.24780       4.017301 18.09418       6.935810 21.33507       4.928131 34.33138 8.367676 39.91681 5.188990 -5.585430      9.845995 
1 1 1 -13 30 29 o 32.68571 5.845208 14.86234       4.484878 18.99824       6.874945 11.79834       5.917375 35.07153 8.192817 27.46069 8.210368 7.610846       11.59881 
1 1 1 -13 30 30 o 43.36245 4.605368 25.00356       4.792138 22.38896       7.113258 27.17638       6.484510 38.09734 7.920568 43.76984 6.257328 -5.672504      10.09404 
1 1 1 -13 30 31 o 24.97785 6.374464 9.255080       3.892424 12.05427       10.24393 8.782737       4.208038 25.43964 10.40557 24.01517 6.853478 1.424471       12.45978 
1 1 1 -13 30 32 o 39.64008 4.198463 20.96086       3.994077 17.51431       7.201582 22.49195       4.799940 31.42077 8.965337 40.39159 4.981967 -8.970823      10.25657 
1 1 1 -13 30 33 o 40.40531 4.200158 21.97493       4.075336 18.71695       7.217345 23.49993       4.937859 32.03150 8.918482 40.96489 5.053426 -8.933388      10.25068 
1 1 1 -13 30 34 o 19.88657 6.350623 6.173471       3.472870 10.14617       6.653980 4.686132       4.071398 23.14269 8.697705 17.81730 6.779250 5.325392       11.02762 
1 1 1 -13 30 35 o 12.12242 5.719902 -2.503781      4.408343 0.8150762      6.012476 -6.362092      6.482727 15.66637 7.138905 12.99342 6.332148 2.672945       9.542539 
1 1 1 -13 31 1  o 45.70955 4.190143 25.99285       4.615492 40.02575       7.989409 18.96360       5.654520 56.31229 5.910001 38.45327 6.248614 17.85902       8.600773 
1 1 1 -13 31 2  o 86.17357 2.887253 91.12334       6.054541 88.05890       8.689435 94.01492       8.440804 84.36613 4.240155 87.25690 3.980092 -2.890770      5.815501 
1 1 1 -13 31 3  o 79.70129 3.244286 78.10371       6.287991 80.56993       8.245069 74.67532       9.721286 80.70634 4.206805 77.38750 5.184773 3.318840       6.676756 
1 1 1 -13 31 4  o 65.43772 3.481719 52.76577       5.532125 62.34289       7.312575 39.94940       8.459320 70.95778 4.248420 56.16182 6.288859 14.79596       7.589389 
1 1 1 -13 31 5  o 54.94141 4.496690 37.54145       5.967826 37.16796       9.224520 37.81030       7.826346 53.82803 7.213766 54.72482 5.965103 -0.8967857     9.360602 
1 1 1 -13 31 6  o 100.6448 3.818172 124.8725       9.347479 124.3858       15.25723 125.1650       11.82705 99.44819 6.328513 100.4072 4.847977 -0.9590530     7.972011 
1 1 1 -13 31 7  o 17.10501 6.848046 1.946101       4.330369 6.372721       7.530344 -0.2409790     5.293112 24.76270 9.263939 16.62346 7.172383 8.139236       11.71596 
1 1 1 -13 31 8  o 56.69400 4.097612 39.84474       5.622943 13.10703       9.771660 53.08112       6.875288 31.95227 10.68131 65.41521 4.337463 -33.46294      11.52840 
1 1 1 -13 31 9  o 43.85690 4.559946 24.04563       4.802351 23.03447       10.04485 24.34524       5.467715 41.16647 10.09216 43.96673 5.204007 -2.800259      11.35488 
1 1 1 -13 31 10 o 48.14744 6.495669 29.63720       7.427132 0.000000       0.000000 29.63720       7.427132 ?        ?        48.14744 6.495669 0.000000       6.495669 
1 1 1 -13 31 11 o 42.85868 4.574977 23.00474       4.704395 29.89110       10.46747 21.26171       5.266219 47.15770 9.438277 40.96236 5.407634 6.195339       10.87766 
1 1 1 -13 31 12 o 40.65806 5.004570 20.85971       4.853985 23.40029       9.260739 19.89735       5.699654 41.57026 9.366935 39.35908 6.143040 2.211182       11.20162 
1 1 1 -13 31 13 o 67.45514 3.742972 56.31036       6.128605 75.56573       13.17905 50.99749       6.922656 76.72064 7.130758 63.97181 4.468767 12.74883       8.415319 
1 1 1 -13 31 14 o 88.19268 3.912009 96.34760       8.386609 89.01495       14.32932 100.1681       10.34319 83.19493 7.136825 89.58076 4.755128 -6.385826      8.575869 
1 1 1 -13 31 15 o 18.24039 7.052454 2.979239       4.454416 1.640249       6.680993 4.050796       5.976679 19.76029 8.271255 20.99733 8.155190 -1.237041      11.61554 
1 1 1 -13 31 16 o 57.30934 3.588172 40.73941       4.985973 46.81252       8.855733 37.92079       6.033060 60.48772 6.090718 54.98883 4.542714 5.498898       7.598229 
1 1 1 -13 31 17 o 73.71031 3.242429 67.16253       5.809930 72.25926       10.42120 64.86391       6.998485 75.34988 5.718124 72.16822 3.995028 3.181656       6.975471 
1 1 1 -13 31 18 o 63.15770 3.413525 49.48222       5.234179 51.46296       9.314656 48.56814       6.327699 63.20126 6.124582 62.28968 4.193062 0.9115829      7.422417 
1 1 1 -13 31 19 o 39.02092 4.378800 19.27835       4.092037 25.78156       7.684789 16.70469       4.834412 43.81314 7.465040 35.81022 5.733220 8.002918       9.412579 
1 1 1 -13 31 20 o 84.68886 3.498399 89.22781       7.204365 92.38206       16.72902 88.50963       7.982510 82.23547 8.468810 84.13496 3.904024 -1.899483      9.325350 
1 1 1 -13 31 21 o 55.69684 3.724607 38.88146       5.026248 29.17400       9.341903 42.83645       5.962871 45.43994 8.753971 58.24200 4.230128 -12.80206      9.722448 
1 1 1 -13 31 22 o 73.21543 3.184268 66.72479       5.667724 74.89207       10.20746 63.08443       6.814775 75.98188 5.551095 70.77477 3.967151 5.207108       6.822972 
1 1 1 -13 31 23 o 44.36371 3.986798 24.98983       4.264189 26.81580       7.884943 24.23504       5.069473 43.76768 7.672354 43.24876 4.896103 0.5189171      9.101475 
1 1 1 -13 31 24 o 53.04744 3.645517 35.55871       4.683939 46.16413       8.540947 30.99720       5.601393 58.73154 6.054232 48.89913 4.760868 9.832417       7.701921 
1 1 1 -13 31 25 o 42.57541 4.459592 23.50780       4.558330 28.96377       7.381091 20.14403       5.795590 45.57241 6.858756 38.16281 6.462299 7.409595       9.423579 
1 1 1 -13 31 26 o 14.26840 5.936962 1.224915       3.411995 9.731805       6.037731 -2.766410      4.135680 25.38222 8.393539 12.27169 5.708809 13.11053       10.15096 
1 1 1 -13 31 27 o 31.46324 5.105005 13.34674       3.780106 2.794767       6.293176 19.30289       4.728095 18.75460 7.948461 37.83448 5.271088 -19.07988      9.537420 
1 1 1 -13 31 28 o 12.58905 5.723641 -1.315588      3.837434 -0.2174174     5.993398 -2.078579      4.995721 16.24695 7.290960 13.87725 6.391690 2.369699       9.695969 
1 1 1 -13 31 29 o 52.12538 3.617422 34.99876       4.566481 25.85091       7.772469 39.82093       5.643137 40.62425 8.135149 55.07225 4.237420 -14.44800      9.172588 
1 1 1 -13 31 30 o 16.46858 6.517910 3.143615       3.879162 -2.688082      9.939177 4.191567       4.213312 18.05006 8.538403 17.87929 6.873104 0.1707687      10.96102 
1 1 1 -13 31 31 o 38.77408 4.470973 20.33661       4.147276 23.94149       7.792142 18.91182       4.898774 37.34155 8.721620 36.28574 5.730051 1.055813       10.43552 
1 1 1 -13 31 32 o 14.48831 5.947413 2.072271       3.361653 -0.6984156     6.286296 3.181919       3.978266 15.45178 7.135860 16.23077 6.540921 -0.7789860     9.680090 
1 1 1 -13 31 33 f 32.08075 5.839196 15.30330       4.396804 13.72311       7.271319 16.21408       5.520362 26.11695 9.197222 31.37110 7.350397 -5.254145      11.77358 
1 1 1 -13 31 34 o 14.29179 6.383788 0.7229525      4.537411 -4.974328      5.990504 8.390347       6.949499 12.96006 6.261725 21.14630 8.600245 -8.186233      10.63830 
1 1 1 -13 32 1  o 68.67575 3.083199 58.09482       5.146740 65.61803       7.291216 50.62350       7.266030 72.69011 4.133157 63.62872 4.719665 9.061386       6.273613 
1 1 1 -13 32 2  o 44.96157 4.039577 25.19329       4.378890 22.80539       5.327258 30.16746       7.688750 42.42495 5.265819 48.36625 6.703433 -5.941299      8.524368 
1 1 1 -13 32 3  o 62.45032 3.542949 48.21109       5.369705 62.40456       9.516055 41.58049       6.504124 70.36765 5.595469 57.67134 4.667854 12.69631       7.286846 
1 1 1 -13 32 4  o 16.19002 5.933160 2.708089       3.060351 5.697302       4.171530 -0.7757987     4.503488 21.41484 6.971087 14.85578 6.509698 6.559067       9.537936 
1 1 1 -13 32 5  o 97.98231 2.865099 117.9434       6.833714 123.7056       10.33720 113.4703       9.107788 99.85969 4.257692 95.76611 3.910926 4.093575       5.781288 
1 1 1 -13 32 6  o 22.90827 6.925341 6.756484       4.192977 12.91541       7.818042 4.269605       4.967898 31.05890 9.470369 20.28543 7.537106 10.77347       12.10355 
1 1 1 -13 32 7  o 73.92425 3.529707 67.50054       6.340233 63.90577       11.77940 68.96677       7.522938 70.57269 6.939002 74.53018 4.158577 -3.957489      8.089716 
1 1 1 -13 32 8  o 42.17264 4.777545 22.39919       4.823503 23.67520       8.904793 21.86933       5.738248 41.82434 9.003643 41.33218 5.861312 0.4921570      10.74340 
1 1 1 -13 32 9  o 47.47159 5.293980 28.52251       6.020137 0.000000       0.000000 28.52251       6.020137 ?        ?        47.47159 5.293980 0.000000       5.293980 
1 1 1 -13 32 10 f 64.75163 3.716195 51.95993       5.839254 70.57368       11.95371 46.12624       6.692017 74.19545 6.682882 60.73651 4.554553 13.45894       8.087328 
1 1 1 -13 32 11 o 21.99847 7.534778 5.876213       4.863876 14.52063       8.660909 1.893986       5.878394 32.56171 9.975405 18.97411 7.834521 13.58760       12.68418 
1 1 1 -13 32 12 o 49.06287 4.335968 30.14964       5.130816 32.70721       9.642654 29.13953       6.059895 49.46118 8.293408 47.91743 5.276876 1.543751       9.829855 
1 1 1 -13 32 13 o 60.19339 4.387047 45.35258       6.390948 47.15288       10.72900 44.36249       7.956573 59.90802 7.514015 59.04310 5.596768 0.8649216      9.369324 
1 1 1 -13 32 14 o 35.26763 6.194629 16.26645       5.129711 20.92566       9.222157 14.17905       6.172764 38.52296 9.801448 32.29585 7.907688 6.227112       12.59365 
1 1 1 -13 32 15 o 57.77162 3.918198 41.66348       5.483525 45.10094       11.21634 40.58384       6.285944 57.93927 8.170627 56.76636 4.582982 1.172905       9.368183 
1 1 1 -13 32 16 o 71.88889 3.310645 64.06907       5.784194 60.46515       10.00654 65.87751       7.088408 68.47236 6.059464 72.60461 4.022062 -4.132256      7.272833 
1 1 1 -13 32 17 o 51.72769 3.774175 33.47299       4.724791 27.06429       8.151640 36.71523       5.798054 44.64254 7.775467 53.91974 4.452284 -9.277203      8.959951 
1 1 1 -13 32 18 o 55.53241 3.716130 38.59745       4.999962 25.28259       8.422759 45.84262       6.213128 42.56940 8.417710 60.29947 4.255584 -17.73007      9.432277 
1 1 1 -13 32 19 o 23.07402 6.684173 7.204396       3.974382 3.258445       6.959007 9.114452       4.841663 20.70998 8.535067 25.71157 7.355828 -5.001596      11.26746 
1 1 1 -13 32 20 o 70.35075 3.671728 62.07361       6.272918 69.36338       15.36994 60.61668       6.871236 69.38966 9.325386 69.28267 4.087979 0.1069870      10.18206 
1 1 1 -13 32 21 o 84.99976 3.123526 90.03600       6.458918 89.85721       10.97109 90.13083       7.990391 83.05838 5.450502 84.52995 3.889438 -1.471573      6.695947 
1 1 1 -13 32 22 o 35.16203 4.854276 16.17328       4.048586 19.18836       7.230657 14.79634       4.886369 36.14766 8.373085 32.85132 6.333344 3.296337       10.49856 
1 1 1 -13 32 23 o 55.73379 3.532262 39.26905       4.772737 30.04453       8.123090 44.13245       5.898191 45.92339 7.518509 58.70048 4.150016 -12.77709      8.587817 
1 1 1 -13 32 24 o 42.06978 4.710180 23.21258       4.746054 21.25600       7.421715 24.56627       6.173278 37.57928 8.323874 42.27429 6.174599 -4.695007      10.36400 
1 1 1 -13 32 25 o 16.55564 6.271660 3.145508       3.475274 6.315846       5.997623 1.543017       4.264069 21.64090 8.229514 15.69301 6.590885 5.947886       10.54347 
1 1 1 -13 32 26 o 24.73954 6.794590 8.970360       4.221098 6.253690       6.306751 11.17484       5.681202 21.49153 8.368852 26.84113 8.049458 -5.349600      11.61169 
1 1 1 -13 32 27 o 19.10567 6.817226 5.036089       4.006304 0.8349267      5.860784 8.721162       5.489010 16.69866 7.367712 23.70964 8.006150 -7.010983      10.88033 
1 1 1 -13 32 28 o 28.01935 5.668723 11.13420       3.737525 9.337042       6.660498 11.96019       4.515470 23.82877 8.749573 28.33410 6.653914 -4.505335      10.99225 
1 1 1 -13 32 29 o 33.16910 5.688378 15.68132       4.432451 11.36389       9.952317 16.74959       4.950538 24.59649 10.17863 33.82407 6.235758 -9.227579      11.93688 
1 1 1 -13 32 30 o 22.70141 6.445978 7.924176       3.731831 5.417931       6.538222 9.135182       4.544867 19.67183 8.204482 23.79243 7.213788 -4.120607      10.92485 
1 1 1 -13 32 31 o 20.02439 6.553040 6.249123       3.683822 6.561239       6.472071 6.099546       4.480403 20.26329 8.277552 19.66705 7.183452 0.5962391      10.95992 
1 1 1 -13 32 32 o 16.89866 6.761561 3.857759       4.219207 0.2721486      6.472802 6.506805       5.563595 15.88683 7.302042 19.85942 7.822618 -3.972590      10.70108 
1 1 1 -13 33 1  o 86.77440 3.225088 93.02930       6.807898 92.98643       8.851728 93.09139       10.65192 86.33277 4.220212 85.91724 5.110677 0.4155273      6.627911 
1 1 1 -13 33 2  o 24.29093 5.640609 7.741887       3.274724 8.568241       4.348925 6.659787       4.976597 25.37702 6.866881 22.94228 7.621525 2.434746       10.25874 
1 1 1 -13 33 3  o 31.12858 4.900259 12.40547       3.594441 15.10730       4.892571 9.237004       5.298245 34.01394 6.127969 26.31106 7.744666 7.702881       9.875822 
1 1 1 -13 33 4  o 76.02773 3.029580 71.29150       5.601704 68.41611       7.919366 74.17073       7.924648 73.97558 4.413107 77.11076 4.233489 -3.135178      6.115386 
1 1 1 -13 33 5  o 63.45459 3.152886 49.74724       4.860098 50.75438       6.932010 48.77357       6.815893 63.64616 4.498399 62.37996 4.514293 1.266201       6.372945 
1 1 1 -13 33 6  o 44.24810 4.687878 24.72178       4.978037 22.55433       8.810091 25.73832       6.033511 40.39690 9.161075 44.81509 5.650030 -4.418194      10.76328 
1 1 1 -13 33 7  o 51.78193 5.112047 33.97967       6.366673 41.41077       9.803401 28.55940       8.372606 56.14434 7.340969 46.32384 7.686123 9.820496       10.62856 
1 1 1 -13 33 8  o 102.7489 4.002268 131.3245       10.00203 0.000000       0.000000 131.3245       10.00203 ?        ?        102.7489 4.002268 0.000000       4.002268 
1 1 1 -13 33 9  o 12.64368 5.716781 -1.775452      3.764617 4.933470       7.010945 -4.493530      4.462530 22.57804 8.814609 12.26458 5.777148 10.31346       10.53911 
1 1 1 -13 33 10 o 69.06444 4.205047 59.64731       7.043661 58.44743       12.09085 60.26371       8.666062 66.49501 7.597808 68.96239 5.194913 -2.467384      9.204010 
1 1 1 -13 33 11 f 42.66756 4.772227 23.11375       4.877089 25.57659       9.158080 22.13877       5.762144 42.89396 9.046566 41.32255 5.888590 1.571407       10.79425 
1 1 1 -13 33 12 o 13.55579 6.156126 -2.170654      4.423584 -0.6915030E-01 6.933701 -3.613136      5.744538 18.63835 8.124089 14.87257 6.851522 3.765785       10.62752 
1 1 1 -13 33 13 o 27.21358 7.128353 10.04487       4.782736 10.51034       7.760254 9.759775       6.073298 27.90840 9.518426 26.78733 8.378376 1.121071       12.68060 
1 1 1 -13 33 14 o 82.30194 3.473141 84.23637       6.950104 81.76799       14.55810 84.96503       7.909678 78.03919 7.757806 82.41456 3.949889 -4.375366      8.705468 
1 1 1 -13 33 15 o 19.27660 6.845953 4.439796       4.035666 1.074099       7.841806 5.652339       4.706813 20.18849 8.720380 21.26218 7.406104 -1.073692      11.44095 
1 1 1 -13 33 16 o 22.39945 6.848146 6.731251       4.084444 1.277111       7.775414 8.809857       4.800058 20.15253 8.694009 25.31790 7.349161 -5.165365      11.38402 
1 1 1 -13 33 17 o 99.80206 3.086189 123.7024       7.496798 107.6538       12.15922 133.5443       9.521996 91.24178 5.494049 103.2057 3.792516 -11.96391      6.675909 
1 1 1 -13 33 18 o 29.96671 6.248315 12.19008       4.414858 17.86837       8.871081 10.32073       5.089952 34.19719 10.00924 27.08323 7.470218 7.113955       12.48956 
1 1 1 -13 33 19 o 115.7469 3.472937 167.8901       9.784778 139.8816       20.37022 176.2910       11.15610 99.02374 8.524401 118.2074 3.878110 -19.18364      9.365102 
1 1 1 -13 33 20 o 31.02023 5.725231 12.99108       4.168469 12.99015       7.006427 12.99159       5.186190 29.31574 8.970486 30.26374 7.147107 -0.9479923     11.46956 
1 1 1 -13 33 21 o 57.46607 3.517500 41.74133       4.902256 36.97313       8.272642 44.32193       6.085929 51.70139 6.725313 58.72026 4.282514 -7.018867      7.973064 
1 1 1 -13 33 22 o 13.46010 5.781805 0.4084013      3.410487 2.004136       6.194922 -0.2855687     4.085318 18.29297 7.823737 13.94073 6.151073 4.352243       9.952213 
1 1 1 -13 33 23 o 42.44690 5.796547 24.58381       5.839376 27.53542       7.526402 20.12029       9.255416 43.64204 7.337005 34.37082 10.26631 9.271221       12.61859 
1 1 1 -13 33 24 o 33.78323 5.674392 15.71813       4.506052 20.79515       7.277604 12.56168       5.738297 36.69160 8.330273 28.58213 7.950169 8.109463       11.51515 
1 1 1 -13 33 25 o 15.63495 6.330820 2.267286       3.746569 10.66320       7.056337 -1.028791      4.421239 25.56080 9.054929 13.69350 6.193008 11.86730       10.97019 
1 1 1 -13 33 26 o 52.00931 3.677253 34.92963       4.630539 30.92052       7.879486 37.04464       5.723071 45.33380 7.386556 52.85590 4.485561 -7.522099      8.641844 
1 1 1 -13 33 27 o 21.95151 6.450258 7.211552       3.677887 7.441287       6.448931 7.100811       4.477420 21.85182 8.475636 21.50245 7.230795 0.3493690      11.14095 
1 1 1 -13 33 28 o 28.81608 5.727603 12.00450       3.880301 12.89357       6.915930 11.59604       4.687654 26.65339 8.986736 27.21673 7.021436 -0.5633411     11.40447 
1 1 1 -13 33 29 f 15.41490 6.247026 2.616378       3.651588 18.60553       6.955282 -3.467800      4.290452 32.43594 8.643591 11.66047 5.543156 20.77547       10.26831 
1 1 1 -13 33 30 o 21.35775 7.045722 7.417962       4.255186 6.236701       6.593462 8.261125       5.570529 19.95420 8.273658 21.83149 8.004085 -1.877291      11.51168 
1 1 1 -13 33 31 o 11.68415 5.503366 -2.466377      4.048349 -7.724404      6.107087 1.655347       5.407072 12.21229 5.992334 15.82587 7.024955 -3.613584      9.233530 
1 1 1 -13 34 1  o 44.82715 3.635429 25.14096       3.937249 21.90657       5.239625 29.33610       5.967294 41.19913 5.344709 47.82424 5.204107 -6.625111      7.459802 
1 1 1 -13 34 2  o 50.84586 3.330293 32.16336       4.103714 33.14402       5.651327 31.06944       5.968728 51.15718 4.581691 49.32479 5.036299 1.832390       6.808539 
1 1 1 -13 34 3  o 53.25522 3.368217 35.27930       4.348782 40.61592       6.141435 29.91244       6.158815 56.72463 4.479180 48.27436 5.323637 8.450272       6.957311 
1 1 1 -13 34 4  f 74.49423 3.430765 68.94417       6.211294 54.85912       10.06369 77.61122       7.894300 64.85019 6.453667 78.71217 4.130075 -13.86198      7.662071 
1 1 1 -13 34 5  o 32.70243 4.535806 13.66018       3.517498 11.53106       4.744364 16.25911       5.241727 29.24220 6.788644 35.02548 6.376038 -5.783283      9.313407 
1 1 1 -13 34 6  o 46.35260 5.631978 27.76591       6.231283 0.000000       0.000000 27.76591       6.231283 ?        ?        46.35260 5.631978 0.000000       5.631978 
1 1 1 -13 34 7  o 21.08067 7.746412 5.117632       5.222367 0.000000       0.000000 5.117632       5.222367 ?        ?        21.08067 7.746412 0.000000       7.746412 
1 1 1 -13 34 8  o 47.70391 4.295916 28.73512       4.940528 25.13500       8.854127 30.36283       5.953543 42.29661 8.873803 48.71096 5.090546 -6.414352      10.23025 
1 1 1 -13 34 9  o 19.37639 6.907853 4.445435       4.112660 10.91869       7.090587 1.163646       5.048660 28.05422 9.085238 17.00621 7.158779 11.04801       11.56675 
1 1 1 -13 34 10 o 35.70425 5.338873 16.56753       4.502801 20.92711       7.893890 14.46489       5.482155 38.52398 8.623922 32.58134 7.105353 5.942642       11.17399 
1 1 1 -13 34 11 o 60.84698 5.482204 47.76977       8.041792 46.25928       10.49715 49.91573       12.51193 58.47418 7.542145 59.69349 8.870500 -1.219315      11.64344 
1 1 1 -13 34 12 o 66.92084 3.714456 56.08244       6.033726 57.69610       11.46227 55.46391       7.096517 65.44199 7.312335 66.17744 4.425914 -0.7354431     8.547454 
1 1 1 -13 34 13 o 71.56898 3.628077 64.11279       6.306935 66.15487       12.89606 63.47082       7.230646 69.57308 7.737129 70.88813 4.204581 -1.315048      8.805775 
1 1 1 -13 34 14 o 48.01812 4.356829 29.36758       5.042704 28.75395       9.998090 29.57693       5.839913 44.13385 9.572333 47.82075 5.089435 -3.686901      10.84121 
1 1 1 -13 34 15 o 34.81843 6.285685 16.37884       5.137114 13.96150       9.505563 17.37615       6.105526 30.34108 10.52739 35.29858 7.337586 -4.957499      12.83223 
1 1 1 -13 34 16 o 49.42918 4.218451 31.17312       5.032756 34.99970       10.39444 30.00137       5.751921 48.78549 9.077256 48.06474 4.982985 0.7207565      10.35503 
1 1 1 -13 34 17 f 39.79874 4.804543 20.62727       4.565514 16.43163       8.927628 22.11309       5.312766 32.20955 10.16990 40.84904 5.474787 -8.639492      11.54990 
1 1 1 -13 34 18 o 18.18657 6.866029 3.813612       4.156942 3.359061       10.39196 3.900201       4.535628 22.65119 9.908022 18.60210 7.136215 4.049091       12.21042 
1 1 1 -13 34 19 o 12.47359 5.626409 -1.195949      3.621164 -2.778076      6.011696 -0.2950254     4.536493 15.15406 6.991192 14.65297 6.472863 0.5010891      9.527577 
1 1 1 -13 34 20 o 13.42591 5.897198 -0.1748613     3.715824 0.1072091      5.387643 -0.4307622     5.131636 16.02802 7.068260 15.32657 6.821126 0.7014542      9.822834 
1 1 1 -13 34 21 o 28.38548 6.652416 11.55733       4.520871 17.67156       7.140145 7.465964       5.840775 33.65214 8.657419 22.77337 8.218492 10.87877       11.93711 
1 1 1 -13 34 22 o 52.96547 5.235397 37.65520       6.669090 42.29895       8.623695 30.74555       10.51931 54.74673 6.596762 42.53597 10.26645 12.21076       12.20316 
1 1 1 -13 34 23 o 13.47325 5.798052 0.5450915      3.441603 -4.228749      5.903974 3.002232       4.235703 13.98954 6.606520 16.92620 6.774026 -2.936658      9.462216 
1 1 1 -13 34 24 o 16.69662 6.398379 3.357332       3.643572 -4.125175      6.622543 6.605433       4.363309 14.79424 6.989697 21.11101 7.138108 -6.316777      9.990417 
1 1 1 -13 34 25 o 13.30511 5.812336 0.3308558      3.566104 7.608747       6.587653 -2.685880      4.241276 22.10402 8.568275 12.20988 5.713377 9.894138       10.29845 
1 1 1 -13 34 26 o 16.50860 6.303522 3.467855       3.527927 0.5815260E-01  6.119664 5.165104       4.317598 16.04163 7.267436 18.94572 7.028923 -2.904089      10.11046 
1 1 1 -13 34 27 o 29.95003 5.703958 13.01268       4.011041 7.300884       7.047878 15.74891       4.878075 21.25030 8.654056 32.35846 6.412946 -11.10816      10.77119 
1 1 1 -13 34 28 o 14.28689 6.258134 0.9165509      4.158765 -11.54864      9.594705 3.800188       4.614796 14.70959 7.273364 17.26267 7.012889 -2.553073      10.10359 
1 1 1 -13 34 29 o 67.00375 3.894248 59.75383       6.331158 63.69217       9.695098 56.82565       8.359786 65.21148 6.174413 62.74432 5.523784 2.467163       8.284658 
1 1 1 -13 34 30 o 17.95394 6.766331 4.891237       4.033104 18.66540       9.952435 2.184836       4.411567 27.53385 10.56884 15.39482 6.593649 12.13904       12.45699 
1 1 1 -13 35 1  o 24.49885 6.415490 8.198173       3.874679 9.650415       6.481093 7.390408       4.833605 26.22262 8.697167 23.31101 7.497030 2.911610       11.48243 
1 1 1 -13 35 2  o 9.344738 4.483169 -3.958015      2.945769 -4.027339      3.873333 -3.862907      4.536783 11.26125 5.327972 12.57966 5.893716 -1.318409      7.945010 
1 1 1 -13 35 3  o 59.61908 3.168790 44.27119       4.587247 50.16756       6.652468 38.92594       6.333941 62.87501 4.368964 55.14188 4.760201 7.733128       6.461220 
1 1 1 -13 35 4  o 12.18173 5.362527 -0.5402079     3.088209 1.256941       4.014207 -3.146251      4.833910 15.51175 6.445736 13.50461 6.243995 2.007140       8.974129 
1 1 1 -13 35 5  o 67.81219 3.085981 57.17128       5.086247 59.22771       7.252465 55.18089       7.135051 68.34255 4.377720 65.90340 4.469200 2.439148       6.256052 
1 1 1 -13 35 6  o 21.90657 7.844763 6.045052       5.309921 0.000000       0.000000 6.045052       5.309921 ?        ?        21.90657 7.844763 0.000000       7.844763 
1 1 1 -13 35 7  o 29.39692 7.004181 11.94146       4.945886 16.90270       8.620119 9.506686       6.038764 33.53942 9.880202 26.06029 8.379539 7.479136       12.95512 
1 1 1 -13 35 8  o 41.98003 5.865757 23.29175       5.837120 0.000000       0.000000 23.29175       5.837120 ?        ?        41.98003 5.865757 0.000000       5.865757 
1 1 1 -13 35 9  f 21.11532 7.048011 5.866979       4.254786 10.20390       8.055603 4.188994       5.010736 26.98165 9.662368 19.60780 7.506036 7.373848       12.23527 
1 1 1 -13 35 10 o 31.79139 7.967459 14.44911       6.159653 13.71040       7.577676 15.88791       10.57547 30.37001 9.335732 31.90172 11.10202 -1.531710      14.50554 
1 1 1 -13 35 11 o 22.39119 6.852272 6.863813       4.088088 2.273295       8.070545 8.448218       4.741385 20.73031 8.899293 24.58029 7.349430 -3.849977      11.54173 
1 1 1 -13 35 12 o 35.12875 5.497112 16.37749       4.551621 23.39651       9.292347 14.16183       5.220821 39.05407 9.785063 31.88926 6.917662 7.164814       11.98338 
1 1 1 -13 35 13 f 80.20483 3.525135 80.87063       6.873063 81.70007       13.99358 80.60692       7.890365 76.49632 7.607473 79.66141 4.078127 -3.165085      8.631614 
1 1 1 -13 35 14 o 25.73447 6.707202 9.309043       4.248281 12.13472       8.542065 8.380448       4.896828 28.15090 9.963622 24.26140 7.513001 3.889498       12.47874 
1 1 1 -13 35 15 o 36.27610 5.245617 17.48630       4.502697 19.69940       9.475032 16.84072       5.117466 34.64475 10.39658 35.02242 6.224214 -0.3776665     12.11733 
1 1 1 -13 35 16 o 19.17698 7.170987 4.510626       4.511073 16.30012       8.488396 -0.1295914     5.325338 31.68773 9.904246 15.85809 7.008800 15.82964       12.13332 
1 1 1 -13 35 17 o 31.35502 9.389251 15.74179       7.734108 0.000000       0.000000 15.74179       7.734108 ?        ?        31.35502 9.389251 0.000000       9.389251 
1 1 1 -13 35 18 o 20.74723 7.209980 5.947371       4.459500 13.37232       8.126239 2.747686       5.334533 28.59856 9.740558 17.97040 7.445729 10.62816       12.26040 
1 1 1 -13 35 19 o 30.43263 5.671026 12.76390       4.050995 9.238311       6.669423 14.82501       5.099455 24.58940 8.793422 32.14003 6.727143 -7.550631      11.07153 
1 1 1 -13 35 20 o 14.69202 6.106580 1.486354       3.604124 1.466126       5.907258 1.498349       4.548879 17.33214 7.527332 15.89021 6.747064 1.441932       10.10859 
1 1 1 -13 35 21 o 20.02868 7.005768 5.675220       4.214239 12.12572       6.545178 1.107369       5.507833 27.26212 8.719635 16.55792 7.228580 10.70420       11.32627 
1 1 1 -13 35 22 o 23.93955 6.412536 8.435567       3.815869 14.58363       6.730552 5.523314       4.632292 29.58078 8.734703 19.80159 7.292379 9.779188       11.37866 
1 1 1 -13 35 23 o 31.95997 5.465344 14.30999       4.103716 15.13353       7.436771 13.94943       4.920718 29.19925 9.289683 30.48595 6.797010 -1.286694      11.51076 
1 1 1 -13 35 24 o 15.85645 6.328309 2.803700       3.686271 -0.5317624     6.492985 4.390114       4.477902 16.09381 7.365968 18.15191 7.056479 -2.058090      10.20056 
1 1 1 -13 35 25 o 35.48577 4.888442 17.40684       4.115081 18.76947       7.214575 16.74975       5.009973 32.54092 8.860988 33.48738 6.372027 -0.9464607     10.91420 
1 1 1 -13 35 26 o 47.91600 4.541313 31.27567       5.239422 30.79664       8.159740 31.61172       6.834485 43.12666 8.060451 46.14968 6.236641 -3.023022      10.19149 
1 1 1 -13 35 27 f 16.65060 7.036891 3.016495       4.909456 9.661192       10.12014 0.9714639      5.614343 22.36119 9.779459 15.71653 7.054487 6.644658       12.05834 
1 1 1 -13 35 28 o 52.03226 4.276663 36.79026       5.374856 21.50038       10.86647 41.74267       6.184358 28.93280 11.05909 54.91053 4.665854 -25.97774      12.00307 
1 1 1 -13 36 1  o 20.78670 5.929240 5.913809       3.150357 4.423795       4.199018 7.832586       4.765019 18.98111 6.950833 23.52841 7.429992 -4.547295      10.17442 
1 1 1 -13 36 2  o 28.83152 5.182975 11.07799       3.507663 13.10629       4.804018 8.761899       5.133529 30.67211 6.621483 24.73724 7.697685 5.934868       10.15374 
1 1 1 -13 36 3  o 55.48955 4.056396 39.23986       5.447246 43.54885       6.332646 26.98105       10.68124 58.18085 4.501507 40.88729 10.62462 17.29355       11.53889 
1 1 1 -13 36 4  o 24.98438 6.003884 8.577073       3.609825 5.361814       4.699150 13.20603       5.638363 20.46560 7.373507 30.25207 7.645926 -9.786469      10.62209 
1 1 1 -13 36 5  o 62.05914 3.988210 48.95392       5.999496 61.96325       9.904890 41.41510       7.540039 68.10934 6.029934 55.94534 5.606067 12.16400       8.233353 
1 1 1 -13 36 6  o 33.60769 6.558765 15.61205       5.178627 27.55661       9.356830 10.33756       6.217764 42.69311 9.260610 26.53863 8.499832 16.15448       12.57005 
1 1 1 -13 36 7  o 44.73229 5.340375 26.41375       5.706564 19.16755       9.228134 30.90045       7.261432 34.57767 10.23227 47.65525 6.415639 -13.07759      12.07724 
1 1 1 -13 36 8  o 34.47395 6.181043 16.24097       5.001892 24.69932       8.724282 12.09923       6.104896 40.40855 9.081481 28.56785 8.286765 11.84070       12.29405 
1 1 1 -13 36 9  o 71.59737 5.222670 67.20921       9.049582 66.41866       12.37553 68.11775       13.26701 68.67778 7.517200 68.89523 8.053989 -0.2174530     11.01703 
1 1 1 -13 36 10 o 45.94124 6.456213 28.95921       7.028814 0.000000       0.000000 28.95921       7.028814 ?        ?        45.94124 6.456213 0.000000       6.456213 
1 1 1 -13 36 11 o 62.33101 4.433064 50.13810       6.689607 51.75062       11.41909 49.29552       8.254327 59.75353 8.046406 60.77901 5.637280 -1.025475      9.824641 
1 1 1 -13 36 12 o 19.55473 7.199844 4.844277       4.515052 8.908027       7.952074 2.910956       5.484902 24.88778 9.473202 18.38536 7.577229 6.502422       12.13078 
1 1 1 -13 36 13 o 21.94234 7.209839 6.802332       4.457359 7.927702       7.473289 6.180941       5.553244 23.83545 9.156031 21.50335 7.972692 2.332092       12.14071 
1 1 1 -13 36 14 o 14.60134 6.120460 1.187323       3.666054 -0.8000981     6.969580 1.947556       4.310573 17.26693 7.795516 16.18867 6.698968 1.078253       10.27844 
1 1 1 -13 36 15 o 23.55807 6.633557 7.964074       3.969086 -2.902957      7.694082 11.90456       4.633147 16.91601 7.840924 28.79357 6.725292 -11.87757      10.33004 
1 1 1 -13 36 16 o 19.97021 7.429356 5.262056       4.829757 0.000000       0.000000 5.262056       4.829757 ?        ?        19.97021 7.429356 0.000000       7.429356 
1 1 1 -13 36 17 o 25.72573 6.534836 9.580461       4.104070 22.71674       9.079066 6.206886       4.600978 36.56617 9.933257 20.91421 7.319839 15.65197       12.33895 
1 1 1 -13 36 18 f 44.93145 4.536477 26.65326       4.899175 33.39928       10.44824 24.75201       5.546751 44.59862 9.874500 42.56443 5.474156 2.034191       11.29036 
1 1 1 -13 36 19 o 31.34494 7.106753 14.71514       5.302858 24.50111       9.618181 10.44137       6.356189 36.89681 10.30382 25.33399 8.614882 11.56282       13.43074 
1 1 1 -13 36 20 f 12.90657 5.836324 -0.9150012     3.925059 1.262683       6.088526 -2.463630      5.134384 17.03764 7.513710 13.69793 6.368422 3.339705       9.849499 
1 1 1 -13 36 21 f 22.60770 6.727637 7.744012       3.980355 16.15218       6.906512 3.562394       4.870575 30.75849 8.780847 17.67948 7.196294 13.07902       11.35297 
1 1 1 -13 36 22 o 60.76484 3.543298 47.81853       5.224055 47.26107       8.753418 48.12692       6.510629 56.75074 6.443435 59.90446 4.492655 -3.153717      7.855050 
1 1 1 -13 36 23 o 21.46005 6.855622 7.184430       4.046865 3.018137       6.442785 9.899331       5.200866 17.98908 7.836296 24.37786 7.770133 -6.388781      11.03551 
1 1 1 -13 36 24 o 25.79660 6.954452 10.57822       4.470546 14.01039       6.662935 7.767999       6.029090 27.66146 8.792237 21.51216 8.233903 6.149305       12.04577 
1 1 1 -13 36 25 o 21.79018 7.275960 7.819630       4.534387 3.475654       6.813679 11.27268       6.074903 18.16488 7.981959 24.89778 8.422554 -6.732895      11.60393 
1 1 1 -13 36 26 o 14.60114 6.443161 1.009473       4.483665 0.000000       0.000000 1.009473       4.483665 ?        ?        14.60114 6.443161 0.000000       6.443161 
1 1 1 -13 37 1  o 14.35245 5.725839 1.809497       3.016628 2.619761       4.128266 0.8811467      4.418858 16.62833 6.676346 15.33230 6.583568 1.296026       9.376405 
1 1 1 -13 37 2  o 33.19669 4.372268 14.41697       3.451115 14.84221       4.798453 13.96130       4.967145 32.58718 6.270113 31.29396 6.714559 1.293221       9.186926 
1 1 1 -13 37 3  o 53.22549 4.809554 37.19634       6.170975 0.000000       0.000000 37.19634       6.170975 ?        ?        53.22549 4.809554 0.000000       4.809554 
1 1 1 -13 37 4  o 68.92950 3.327864 59.96990       5.573420 73.21141       7.986659 47.40038       7.781362 75.24598 4.374439 59.58184 5.418478 15.66414       6.963880 
1 1 1 -13 37 5  o 61.74224 3.192022 48.00277       4.786383 48.38544       7.042480 47.67426       6.525033 60.77817 4.793688 60.61999 4.448000 0.1581802      6.539431 
1 1 1 -13 37 6  o 24.32975 6.595381 8.453279       4.007524 4.162715       7.176664 10.39739       4.830876 20.62191 8.597842 26.65612 7.247677 -6.034204      11.24508 
1 1 1 -13 37 7  o 11.04528 5.276974 -4.495201      3.989539 -7.776038      6.546931 -2.557272      5.031695 13.59675 6.563615 13.83054 6.386097 -0.2337914     9.157690 
1 1 1 -13 37 8  o 34.49284 6.558653 16.76936       5.311467 16.96074       8.084148 16.62399       7.045591 32.24737 9.585723 32.68914 8.694271 -0.4417648     12.94127 
1 1 1 -13 37 9  o 13.56612 5.961085 -0.1380965     3.800118 8.682297       7.530874 -3.151223      4.401595 24.32331 9.228152 12.47973 5.833361 11.84358       10.91727 
1 1 1 -13 37 10 o 37.42299 5.393030 18.90945       4.776432 13.30226       10.07565 20.53483       5.424717 28.07513 10.66879 38.63002 5.953572 -10.55490      12.21753 
1 1 1 -13 37 11 f 23.16051 6.766388 7.753837       4.057305 9.267657       7.960529 7.222586       4.715794 24.74745 9.464013 22.32280 7.419234 2.424656       12.02550 
1 1 1 -13 37 12 o 35.14922 6.540365 17.55124       5.396020 0.000000       0.000000 17.55124       5.396020 ?        ?        35.14922 6.540365 0.000000       6.540365 
1 1 1 -13 37 13 o 21.16965 7.092803 6.432973       4.308480 8.646426       8.642219 5.700886       4.970171 24.15553 9.673052 20.43359 7.548635 3.721939       12.26987 
1 1 1 -13 37 14 o 23.25157 6.976153 7.984206       4.266435 6.099543       7.863021 8.770585       5.079123 21.94241 9.060678 24.03635 7.680549 -2.093943      11.87799 
1 1 1 -13 37 15 o 23.13490 7.476065 8.090503       4.802839 0.000000       0.000000 8.090503       4.802839 ?        ?        23.13490 7.476065 0.000000       7.476065 
1 1 1 -13 37 16 o 37.56141 5.329385 19.35828       4.741363 32.82123       9.891704 15.34246       5.402423 44.34922 9.442481 32.00406 7.111638 12.34517       11.82099 
1 1 1 -13 37 17 o 14.23864 6.132518 0.8458458      3.856254 6.213341       7.865706 -0.8524671     4.424465 21.52432 8.989646 13.70153 6.196086 7.822789       10.91811 
1 1 1 -13 37 18 o 28.06063 6.645355 11.77854       4.473584 14.04477       9.230585 11.08283       5.114367 27.10712 10.23190 26.46747 7.556300 0.6396503      12.71965 
1 1 1 -13 37 19 o 17.80284 7.147433 3.874144       4.731067 8.918818       7.644148 0.7419696      6.023314 23.05586 9.141799 16.42524 7.344655 6.630615       11.72674 
1 1 1 -13 37 20 o 13.79332 6.121057 0.1657161      4.102345 4.416811       6.586799 -2.528245      5.243481 19.14432 8.123465 13.58765 6.356314 5.556669       10.31472 
1 1 1 -13 37 21 o 13.96446 6.589767 -3.122932      5.853996 -4.514847      7.716441 -1.235635      8.985263 15.29837 7.317074 17.52364 8.236697 -2.225267      11.01738 
1 1 1 -13 37 22 o 14.21528 6.312744 0.4441880      4.370979 -3.464537      6.431366 3.799445       5.958660 14.36817 6.817729 18.09442 7.703969 -3.726241      10.28750 
1 1 1 -13 37 23 o 64.76941 3.932040 55.72599       6.176938 39.24574       11.94656 61.73940       7.216412 42.43619 11.33702 67.46954 4.413347 -25.03335      12.16576 
1 1 1 -13 37 24 o 50.97914 4.435884 35.48685       5.455913 32.07829       11.22294 36.54169       6.243310 37.23560 11.34535 50.87341 5.104940 -13.63781      12.44096 
1 1 1 -13 38 1  o 29.60014 5.099498 11.93759       3.545641 19.07814       4.958920 4.468952       5.071564 37.15631 5.654818 19.05577 7.480011 18.10054       9.376967 
1 1 1 -13 38 2  o 40.01612 4.547650 21.18727       4.356069 29.94168       7.892102 17.35171       5.223886 44.93740 7.468984 34.89437 6.378272 10.04303       9.821816 
1 1 1 -13 38 3  o 13.39025 5.631121 0.9450207      3.119005 2.488189       3.955883 -1.590482      5.070710 16.13441 6.515246 14.28557 6.527398 1.848845       9.222547 
1 1 1 -13 38 4  f 21.30361 6.166723 6.485600       3.384007 7.349998       4.790933 5.624963       4.780499 22.28998 7.479526 20.20914 7.413902 2.080839       10.53135 
1 1 1 -13 38 5  o 26.17699 5.592135 9.552347       3.458892 5.311141       4.864864 13.88812       4.918805 19.89319 7.445235 30.92105 6.720158 -11.02786      10.02956 
1 1 1 -13 38 6  o 28.87947 6.934674 12.28792       4.818682 17.12489       8.358674 9.880241       5.897261 31.49044 9.826111 25.13048 8.294706 6.359961       12.85903 
1 1 1 -13 38 7  f 68.91347 4.497007 62.30297       7.510777 74.58952       12.40636 55.19464       9.436556 71.63181 7.205030 62.83194 6.245675 8.799870       9.535246 
1 1 1 -13 38 8  o 24.87569 6.700564 9.086935       4.152195 0.1396061      7.146862 13.64582       5.101499 17.62158 7.930276 30.37169 7.031622 -12.75011      10.59873 
1 1 1 -13 38 9  o 12.18794 5.547408 -1.329349      3.617254 -3.683808      6.816320 -0.4063678     4.267768 15.33687 7.197838 13.91406 6.204726 1.422808       9.503026 
1 1 1 -13 38 10 o 20.15535 6.854128 5.819863       4.023492 -2.074511      7.530288 8.974063       4.759895 16.77252 7.768360 24.27403 7.387127 -7.501509      10.71994 
1 1 1 -13 38 11 o 29.69883 6.338385 12.74999       4.447509 20.04761       8.666703 10.14117       5.181850 33.65708 9.904740 25.51708 7.695492 8.140001       12.54291 
1 1 1 -13 38 12 o 16.17884 6.560740 2.591043       4.030455 2.265794       7.884114 2.706115       4.689549 19.16250 8.495672 16.91840 6.992794 2.244102       11.00344 
1 1 1 -13 38 13 f 15.80260 6.474211 2.327767       3.973635 -0.2157163     8.465862 3.046455       4.500150 18.22865 8.368282 17.01903 6.921039 1.209616       10.85951 
1 1 1 -13 38 14 o 15.30945 6.706321 0.8102866      4.776199 0.000000       0.000000 0.8102866      4.776199 ?        ?        15.30945 6.706321 0.000000       6.706321 
1 1 1 -13 38 15 o 15.33025 6.636261 1.224145       4.561095 -2.118588      7.453376 3.225365       5.766995 16.33723 7.621408 18.01717 7.621180 -1.679937      10.77814 
1 1 1 -13 38 16 o 20.56596 7.420835 6.447056       4.761825 5.552450       8.255856 6.893040       5.829151 20.76527 8.958467 21.12702 8.093788 -0.3617516     12.07326 
1 1 1 -13 38 17 o 11.88988 5.645892 -3.611965      4.426326 -1.593399      7.295463 -4.787903      5.568313 16.22009 7.557917 12.94794 6.199024 3.272150       9.774969 
1 1 1 -13 38 18 o 20.45049 8.051108 6.441013       5.890560 8.111887       7.513726 3.776301       9.488740 22.01313 8.946350 19.97014 9.048089 2.042997       12.72419 
1 1 1 -13 38 19 o 21.25691 7.116227 7.188354       4.337086 9.304183       8.525748 6.449660       5.037610 22.69902 9.409664 20.25900 7.577466 2.440018       12.08138 
1 1 1 -13 38 20 o 30.89722 6.160855 14.30128       4.475899 18.82734       9.314474 12.94238       5.103780 29.37855 10.40376 28.15058 7.358807 1.227962       12.74325 
1 1 1 -13 38 21 o 16.69746 6.620750 3.641770       4.009464 4.335900       8.193745 3.423236       4.597495 19.25189 8.590365 16.82993 6.936818 2.421959       11.04146 
1 1 1 -13 39 1  o 18.98824 6.395642 5.210045       3.502814 2.427201       6.068848 6.600233       4.289418 17.66083 7.650023 20.89464 7.077336 -3.233812      10.42169 
1 1 1 -13 39 2  o 9.959320 4.684136 -2.426878      2.913899 1.441589       4.175661 -6.098782      4.068192 15.09955 6.439653 10.24221 4.996843 4.857347       8.150925 
1 1 1 -13 39 3  f 28.23086 5.297839 11.13220       3.510845 11.28757       5.196569 11.00173       4.762012 26.67330 7.617342 26.68687 7.170233 -0.1357079E-01 10.46117 
1 1 1 -13 39 4  o 16.18950 6.281302 3.088653       3.542768 3.738969       4.661553 2.199410       5.451034 17.75616 7.106325 17.04435 7.315325 0.7118111      10.19872 
1 1 1 -13 39 5  o 18.64274 6.775709 4.844430       3.979183 6.271245       6.180071 3.834025       5.200648 20.87379 8.237694 18.21583 7.428060 2.657963       11.09214 
1 1 1 -13 39 6  o 21.09167 8.295273 6.499656       6.247812 14.78483       7.568392 -11.22608      11.07018 28.78342 9.391129 16.53898 8.105577 12.24444       12.40539 
1 1 1 -13 39 7  o 35.71414 6.031422 18.26384       5.062490 21.09083       8.016663 16.38869       6.529051 34.87519 9.273355 31.56804 8.357244 3.307154       12.48353 
1 1 1 -13 39 8  o 20.88940 7.285129 6.584509       4.555058 7.665020       7.552603 5.966791       5.710545 22.27990 9.000408 20.40340 7.958228 1.876501       12.01419 
1 1 1 -13 39 9  o 16.53039 6.804772 2.741342       4.416777 8.429564       7.570655 -0.1937145     5.438178 22.82011 9.081719 15.31151 6.901778 7.508605       11.40667 
1 1 1 -13 39 10 o 22.23132 7.434493 7.741695       4.733868 7.839067       7.214133 7.668061       6.273409 22.23195 8.859493 22.00400 8.404777 0.2279568      12.21192 
1 1 1 -13 39 11 o 16.22296 6.841290 2.288284       4.623971 9.883905       7.345600 -2.696955      5.950981 23.84507 9.097938 14.43839 6.759888 9.406679       11.33440 
1 1 1 -13 39 12 o 20.76564 7.496949 6.665087       4.860812 9.145358       8.271034 5.356482       6.007786 23.06852 9.382259 19.70469 8.002850 3.363829       12.33176 
1 1 1 -13 39 13 o 15.92875 6.860021 1.821233       4.824892 0.000000       0.000000 1.821233       4.824892 ?        ?        15.92875 6.860021 0.000000       6.860021 
1 1 1 -13 39 14 o 16.19703 6.456210 3.088906       3.832051 -3.264006      7.513762 5.322221       4.454982 15.64253 7.406758 19.04523 7.125342 -3.402703      10.27767 
1 1 1 -13 39 15 o 13.95937 6.098122 0.7351535      3.925369 4.574687       7.101346 -0.9541819     4.710417 19.32816 8.323236 13.73586 6.281905 5.592297       10.42778 
1 1 1 -13 39 16 o 19.07824 7.348674 5.391129       4.823311 0.000000       0.000000 5.391129       4.823311 ?        ?        19.07824 7.348674 0.000000       7.348674 
1 1 1 -13 39 17 o 23.41993 7.551728 9.180052       4.902250 0.4528082E-01  7.562223 15.80126       6.438273 16.88404 7.807659 29.86341 8.462317 -12.97937      11.51392 
1 1 1 -13 39 18 o 20.72977 6.875520 6.847165       4.050448 7.941988       7.738769 6.434083       4.753550 21.41732 8.928739 20.04660 7.386412 1.370716       11.58799 
1 1 1 -13 40 1  o 20.64104 5.977385 6.378598       3.178798 7.452599       4.509316 5.317661       4.481808 21.55687 7.256546 18.95126 7.134840 2.605612       10.17661 
1 1 1 -13 40 2  o 27.62111 5.278437 10.85266       3.423412 13.88735       4.998003 8.170524       4.698718 29.77065 7.006594 22.43455 7.403945 7.336100       10.19366 
1 1 1 -13 40 3  o 12.23871 5.417191 -0.4096540E-01 3.192793 2.409091       4.075705 -3.932811      5.136798 15.66360 6.500682 12.70078 6.045530 2.962821       8.877347 
1 1 1 -13 40 4  o 29.07614 5.451434 12.08625       3.720762 19.14295       5.616442 6.566961       4.967093 35.47197 6.743824 20.48298 7.549925 14.98899       10.12327 
1 1 1 -13 40 5  o 18.15721 7.120318 4.497424       4.591706 8.938162       7.117045 1.330970       6.009782 22.68343 8.873691 16.57234 7.378261 6.111092       11.54041 
1 1 1 -13 40 6  o 14.76347 6.206296 1.775273       3.786491 4.838799       6.679659 0.3247156      4.596327 19.38292 8.200641 14.48189 6.449736 4.901031       10.43310 
1 1 1 -13 40 7  o 11.08460 5.225592 -2.752848      3.664578 -5.048542      6.426709 -1.646808      4.460846 13.81326 6.625617 12.99056 6.003455 0.8227062      8.940932 
1 1 1 -13 40 8  o 13.30384 5.893976 0.1570565      3.787914 5.459102       6.529397 -2.532568      4.650473 19.75641 8.216065 12.73740 5.967454 7.019011       10.15452 
1 1 1 -13 40 9  o 12.05490 5.532768 -1.307075      3.697705 -3.277391      6.450856 -0.3428780     4.512658 14.54274 6.879138 13.88339 6.269900 0.6593428      9.307750 
1 1 1 -13 40 10 o 16.16475 6.602101 2.910091       4.116299 7.276974       7.587271 1.088647       4.900132 21.28150 8.854007 15.32418 6.750048 5.957324       11.13358 
1 1 1 -13 40 11 o 28.12992 6.302567 11.95290       4.213027 9.762731       7.758007 12.86895       5.017318 23.07982 9.190672 28.30513 7.244391 -5.225315      11.70255 
1 1 1 -13 40 12 o 20.44201 7.504832 6.677353       4.899908 0.000000       0.000000 6.677353       4.899908 ?        ?        20.44201 7.504832 0.000000       7.504832 
1 1 1 -13 40 13 o 22.68802 7.016994 8.299406       4.273142 22.64246       8.719041 3.765272       4.902246 33.72921 9.936895 17.41137 7.168375 16.31784       12.25265 
1 1 1 -13 40 14 o 27.73235 6.786185 12.11991       4.548113 16.16208       9.008661 10.73720       5.268890 27.27153 10.14637 25.01543 7.800742 2.256102       12.79846 
1 1 1 -13 40 15 o 21.62153 6.965213 7.549771       4.170995 3.300285       8.281665 8.994018       4.828031 18.76290 8.481756 23.11507 7.497756 -4.352175      11.32062 
1 1 1 -13 41 1  o 21.00164 6.173737 6.812055       3.368706 6.963024       4.846090 6.670890       4.686078 20.53885 7.475586 20.22897 7.352857 0.3098812      10.48565 
1 1 1 -13 41 2  o 11.49010 5.309141 -1.469083      3.486562 0.9416842      4.600801 -4.721189      5.343652 14.72244 6.510371 12.46633 5.995619 2.256114       8.850558 
1 1 1 -13 41 3  o 12.44676 5.669227 -0.7871186     3.786313 1.968689       4.804831 -5.302166      6.150137 15.72100 6.808332 13.21282 6.374140 2.508186       9.326470 
1 1 1 -13 41 4  o 12.27465 5.511680 -0.3166875     3.430803 3.719425       4.988275 -3.939702      4.726110 17.33245 7.192367 12.00406 5.737342 5.328393       9.200394 
1 1 1 -13 41 5  o 22.66642 7.170142 8.437580       4.435815 20.39462       7.780613 2.679784       5.399209 32.71087 9.313995 16.75599 7.236801 15.95488       11.79499 
1 1 1 -13 41 6  o 23.51941 6.747332 8.812792       4.068322 15.53288       8.221413 6.633620       4.681714 27.31040 9.763472 20.26954 7.352055 7.040863       12.22203 
1 1 1 -13 41 7  f 12.75408 5.760189 -0.4294081     3.809348 4.117217       7.030938 -2.318614      4.532193 18.66881 8.158270 12.56408 5.887802 6.104728       10.06099 
1 1 1 -13 41 8  o 15.37129 6.419178 2.354107       4.010012 2.338330       7.262606 2.361026       4.809621 17.73572 7.986848 16.05862 6.881469 1.677095       10.54250 
1 1 1 -13 41 9  o 11.86751 5.482084 -1.474372      3.713839 -0.9702521     6.905404 -1.679527      4.405179 15.79942 7.358953 12.75173 5.918368 3.047697       9.443583 
1 1 1 -12 0  1  o 196.4948 3.922101 471.0742       18.76356 471.0742       18.76356 471.0742       18.76356 196.4948 3.922101 196.4948 3.922101 0.000000       0.000000 
1 1 1 -12 0  2  o 76.30740 5.694332 72.14684       10.45006 72.14684       10.45006 72.14684       10.45006 76.30740 5.694332 76.30740 5.694332 -0.000000      0.000000 
1 1 1 -12 0  3  o 785.7167 15.95095 7548.806       305.1298 7548.806       305.1298 7548.806       305.1298 785.7167 15.95095 785.7167 15.95095 0.000000       0.000000 
1 1 1 -12 0  4  o 1006.998 20.36602 12417.21       499.3095 12417.21       499.3095 12417.21       499.3095 1006.998 20.36602 1006.998 20.36602 -0.000000      0.000000 
1 1 1 -12 0  5  o 526.3467 10.83984 3383.492       138.9041 3383.492       138.9041 3383.492       138.9041 526.3467 10.83984 526.3467 10.83984 0.000000       0.000000 
1 1 1 -12 0  6  o 703.2186 14.30655 6044.223       244.9377 6044.223       244.9377 6044.223       244.9377 703.2186 14.30655 703.2186 14.30655 0.000000       0.000000 
1 1 1 -12 0  7  o 352.6932 7.509067 1518.514       64.47253 1518.514       64.47253 1518.514       64.47253 352.6932 7.509067 352.6932 7.509067 0.000000       0.000000 
1 1 1 -12 0  8  o 103.2232 3.503041 130.2891       8.788654 130.2891       8.788654 130.2891       8.788654 103.2232 3.503041 103.2232 3.503041 -0.000000      0.000000 
1 1 1 -12 0  9  o 328.0446 10.00470 1316.161       79.80997 1316.161       79.80997 1316.161       79.80997 328.0446 10.00470 328.0446 10.00470 0.000000       0.000000 
1 1 1 -12 0  10 o 282.7333 8.833443 977.6371       60.72693 977.6371       60.72693 977.6371       60.72693 282.7333 8.833443 282.7333 8.833443 0.000000       0.000000 
1 1 1 -12 0  11 o 475.8209 9.859419 2765.108       114.2115 2765.108       114.2115 2765.108       114.2115 475.8209 9.859419 475.8209 9.859419 -0.000000      0.000000 
1 1 1 -12 0  12 o 503.2568 10.40294 3093.781       127.4567 3093.781       127.4567 3093.781       127.4567 503.2568 10.40294 503.2568 10.40294 0.000000       0.000000 
1 1 1 -12 0  13 o 116.5326 3.702852 165.9925       10.49119 165.9925       10.49119 165.9925       10.49119 116.5326 3.702852 116.5326 3.702852 0.000000       0.000000 
1 1 1 -12 0  14 o 418.1055 8.761949 2135.096       89.18505 2135.096       89.18505 2135.096       89.18505 418.1055 8.761949 418.1055 8.761949 0.000000       0.000000 
1 1 1 -12 0  15 o 401.3242 8.444127 1967.278       82.49965 1967.278       82.49965 1967.278       82.49965 401.3242 8.444127 401.3242 8.444127 0.000000       0.000000 
1 1 1 -12 0  16 o 362.7969 10.97791 1611.660       96.85401 1611.660       96.85401 1611.660       96.85401 362.7969 10.97791 362.7969 10.97791 -0.000000      0.000000 
1 1 1 -12 0  17 o 88.06509 3.568738 94.98614       7.630047 94.98614       7.630047 94.98614       7.630047 88.06509 3.568738 88.06509 3.568738 0.000000       0.000000 
1 1 1 -12 0  18 o 112.2629 3.697026 154.1102       10.08916 154.1102       10.08916 154.1102       10.08916 112.2629 3.697026 112.2629 3.697026 -0.000000      0.000000 
1 1 1 -12 0  19 o 345.0649 7.408386 1455.057       62.23123 1455.057       62.23123 1455.057       62.23123 345.0649 7.408386 345.0649 7.408386 0.000000       0.000000 
1 1 1 -12 0  20 o 211.5706 5.063882 546.7990       26.07431 546.7990       26.07431 546.7990       26.07431 211.5706 5.063882 211.5706 5.063882 -0.000000      0.000000 
1 1 1 -12 0  21 o 417.5631 8.801515 2133.601       89.47053 2133.601       89.47053 2133.601       89.47053 417.5631 8.801515 417.5631 8.801515 -0.000000      0.000000 
1 1 1 -12 0  22 o 71.41969 3.797465 62.71455       6.566240 62.71455       6.566240 62.71455       6.566240 71.41969 3.797465 71.41969 3.797465 0.000000       0.000000 
1 1 1 -12 0  23 o 189.9904 4.811800 441.1602       22.24567 441.1602       22.24567 441.1602       22.24567 189.9904 4.811800 189.9904 4.811800 -0.000000      0.000000 
1 1 1 -12 0  24 o 106.4560 5.118661 139.2339       13.20865 139.2339       13.20865 139.2339       13.20865 106.4560 5.118661 106.4560 5.118661 -0.000000      0.000000 
1 1 1 -12 0  25 o 117.6911 3.925624 169.4850       11.23029 169.4850       11.23029 169.4850       11.23029 117.6911 3.925624 117.6911 3.925624 -0.000000      0.000000 
1 1 1 -12 0  26 o 165.2245 4.467870 333.7889       17.95943 333.7889       17.95943 333.7889       17.95943 165.2245 4.467870 165.2245 4.467870 0.000000       0.000000 
1 1 1 -12 0  27 o 92.96145 3.827960 105.9423       8.638243 105.9423       8.638243 105.9423       8.638243 92.96145 3.827960 92.96145 3.827960 -0.000000      0.000000 
1 1 1 -12 0  28 o 112.5484 6.051698 156.1267       16.48754 156.1267       16.48754 156.1267       16.48754 112.5484 6.051698 112.5484 6.051698 -0.000000      0.000000 
1 1 1 -12 0  29 o 195.2571 5.016201 466.4911       23.83251 466.4911       23.83251 466.4911       23.83251 195.2571 5.016201 195.2571 5.016201 -0.000000      0.000000 
1 1 1 -12 0  30 o 301.5853 6.752225 1114.833       49.56800 1114.833       49.56800 1114.833       49.56800 301.5853 6.752225 301.5853 6.752225 -0.000000      0.000000 
1 1 1 -12 0  31 o 114.3640 4.108103 160.2660       11.41542 160.2660       11.41542 160.2660       11.41542 114.3640 4.108103 114.3640 4.108103 0.000000       0.000000 
1 1 1 -12 0  32 o 50.01440 5.338453 31.60500       6.319872 31.60500       6.319872 31.60500       6.319872 50.01440 5.338453 50.01440 5.338453 -0.000000      0.000000 
1 1 1 -12 0  33 o 118.1324 4.229834 171.0986       12.14120 171.0986       12.14120 171.0986       12.14120 118.1324 4.229834 118.1324 4.229834 0.000000       0.000000 
1 1 1 -12 0  34 o 213.3071 5.341978 557.8588       27.72857 557.8588       27.72857 557.8588       27.72857 213.3071 5.341978 213.3071 5.341978 -0.000000      0.000000 
1 1 1 -12 0  35 o 52.82480 6.679355 35.84059       8.224700 35.84059       8.224700 35.84059       8.224700 52.82480 6.679355 52.82480 6.679355 0.000000       0.000000 
1 1 1 -12 0  36 o 72.79402 4.487253 65.56769       7.889929 65.56769       7.889929 65.56769       7.889929 72.79402 4.487253 72.79402 4.487253 0.000000       0.000000 
1 1 1 -12 0  37 o 16.46617 8.974840 4.761803       5.105972 4.761803       5.105972 4.761803       5.105972 16.46617 8.974840 16.46617 8.974840 0.000000       0.000000 
1 1 1 -12 0  38 o 32.51262 8.081509 15.23470       5.540746 15.23470       5.540746 15.23470       5.540746 32.51262 8.081509 32.51262 8.081509 -0.000000      0.000000 
1 1 1 -12 0  39 o 19.39103 11.11961 6.365110       8.342540 6.365110       8.342540 6.365110       8.342540 19.39103 11.11961 19.39103 11.11961 0.000000       0.000000 
1 1 1 -12 0  40 o 52.78054 5.125619 35.33623       6.440251 35.33623       6.440251 35.33623       6.440251 52.78054 5.125619 52.78054 5.125619 -0.000000      0.000000 
1 1 1 -12 0  41 o 27.19842 9.023851 11.94456       5.319891 11.94456       5.319891 11.94456       5.319891 27.19842 9.023851 27.19842 9.023851 0.000000       0.000000 
1 1 1 -12 0  42 o 14.14857 8.329585 3.185428       4.881405 3.185428       4.881405 3.185428       4.881405 14.14857 8.329585 14.14857 8.329585 -0.000000      0.000000 
1 1 1 -12 0  43 o 57.34148 5.152544 42.15928       7.059732 42.15928       7.059732 42.15928       7.059732 57.34148 5.152544 57.34148 5.152544 -0.000000      0.000000 
1 1 1 -12 0  44 o 13.69835 8.278265 2.904719       5.066587 2.904719       5.066587 2.904719       5.066587 13.69835 8.278265 13.69835 8.278265 -0.000000      0.000000 
1 1 1 -12 0  45 o 9.407746 6.492675 -2.991813      4.990479 -2.991813      4.990479 -2.991813      4.990479 9.407746 6.492675 9.407746 6.492675 -0.000000      0.000000 
1 1 1 -12 0  46 f 8.538829 5.995014 -4.221508      4.777312 -4.221508      4.777312 -4.221508      4.777312 8.538829 5.995014 8.538829 5.995014 -0.000000      0.000000 
1 1 1 -12 0  47 o 22.68852 10.00477 10.81745       5.802957 10.81745       5.802957 10.81745       5.802957 22.68852 10.00477 22.68852 10.00477 0.000000       0.000000 
1 1 1 -12 0  48 o 49.25008 10.28580 40.79912       10.88007 40.79912       10.88007 40.79912       10.88007 49.25008 10.28580 49.25008 10.28580 -0.000000      0.000000 
1 1 1 -12 0  49 o 11.44941 7.600216 0.8336315      5.628752 0.8336315      5.628752 0.8336315      5.628752 11.44941 7.600216 11.44941 7.600216 0.000000       0.000000 
1 1 1 -12 0  50 o 33.43990 9.681503 20.72769       6.844334 20.72769       6.844334 20.72769       6.844334 33.43990 9.681503 33.43990 9.681503 -0.000000      0.000000 
1 1 1 -12 1  1  o 376.0962 5.041074 1724.298       46.20171 1704.820       72.30906 1737.737       60.06071 373.8333 7.937406 377.4976 6.528903 -3.664246      10.27760 
1 1 1 -12 1  2  o 590.9199 8.544621 4260.404       123.0432 4273.460       174.4458 4247.478       173.5761 591.4224 12.10394 589.6249 12.08031 1.797546       17.10085 
1 1 1 -12 1  3  o 368.8509 6.387515 1658.946       57.41414 1657.013       99.84407 1659.901       70.17757 368.1879 11.14080 368.8890 7.806682 -0.7011108     13.60374 
1 1 1 -12 1  4  f 266.3972 4.187035 864.9764       27.18143 866.1083       38.51273 863.8531       38.36838 266.5286 5.929587 266.1818 5.915059 0.3468018      8.375436 
1 1 1 -12 1  5  o 958.5458 13.68568 11233.58       319.6800 11379.72       456.2941 11092.69       448.0112 963.0872 19.44210 950.9000 19.33383 12.18719       27.41883 
1 1 1 -12 1  6  o 365.6610 5.468409 1630.060       48.72769 1701.619       70.83819 1565.790       67.13367 373.4952 7.782987 358.2832 7.689142 15.21204       10.94065 
1 1 1 -12 1  7  o 461.8508 6.762864 2601.254       76.11469 2634.143       108.6315 2569.537       106.6799 464.5591 9.595745 458.8313 9.540989 5.727844       13.53177 
1 1 1 -12 1  8  o 374.9695 5.589462 1714.192       51.07426 1767.796       73.70864 1664.684       70.83675 380.6703 7.945722 369.4059 7.868984 11.26437       11.18282 
1 1 1 -12 1  9  o 441.6452 7.497031 2379.249       80.68613 2391.820       99.17258 2354.635       138.7708 442.6856 9.193060 438.6722 12.99574 4.013397       15.91859 
1 1 1 -12 1  10 o 117.7420 3.630241 169.1222       10.40361 0.000000       0.000000 169.1222       10.40361 ?        ?        117.7420 3.630241 0.000000       3.630241 
1 1 1 -12 1  11 o 126.3742 2.656159 194.6214       8.179914 183.9793       11.40872 205.8799       11.73444 122.8011 3.817036 129.9156 3.710310 -7.114479      5.323172 
1 1 1 -12 1  12 o 391.4138 5.819733 1868.204       55.51052 1827.805       77.57875 1910.589       79.46260 387.0049 8.226029 395.6707 8.241244 -8.665833      11.64413 
1 1 1 -12 1  13 o 183.1666 3.706040 408.9324       16.54217 419.1846       20.56863 390.1577       27.83467 185.4318 4.551818 178.7359 6.400884 6.695953       7.854321 
1 1 1 -12 1  14 o 246.9209 4.560198 743.3237       27.43960 719.9236       46.57265 755.7655       33.95977 242.7338 7.883901 248.9417 5.597975 -6.207901      9.669189 
1 1 1 -12 1  15 o 392.8702 6.754200 1883.394       64.66349 1772.435       107.8719 1945.629       80.78754 380.3956 11.65061 399.1587 8.305441 -18.76309      14.30794 
1 1 1 -12 1  16 o 464.8918 9.673230 2642.441       109.5871 2731.746       158.5082 2560.667       151.6767 471.6452 13.80600 456.6666 13.64491 14.97861       19.41106 
1 1 1 -12 1  17 o 386.5518 5.767987 1823.215       54.33356 1780.875       75.74648 1868.090       77.98074 381.7685 8.141909 390.9993 8.184183 -9.230804      11.54433 
1 1 1 -12 1  18 o 108.5415 2.608447 143.5961       6.899438 131.5269       9.608443 156.4432       9.913251 103.7907 3.805346 113.2188 3.597602 -9.428055      5.236735 
1 1 1 -12 1  19 f 221.0209 3.670570 595.6703       19.76983 637.8301       29.06697 559.3785       26.96834 228.6193 5.217361 214.1014 5.168907 14.51790       7.344281 
1 1 1 -12 1  20 o 126.7168 2.754056 195.7459       8.504386 201.8342       12.26073 190.1006       11.80618 128.5798 3.917548 124.7847 3.887246 3.795082       5.518865 
1 1 1 -12 1  21 f 268.6532 4.263469 880.6398       27.91202 868.7128       39.27952 892.8055       39.67051 266.6393 6.045132 270.3144 6.022303 -3.675049      8.532980 
1 1 1 -12 1  22 o 262.9809 4.202169 843.9755       26.92984 895.1736       39.47155 799.3907       36.83418 270.6238 5.985247 255.7460 5.910253 14.87775       8.411556 
1 1 1 -12 1  23 o 117.5411 3.119520 168.6192       8.927489 168.4539       11.10267 168.9218       15.01644 117.4296 3.885187 117.4672 5.259163 -0.3762054E-01 6.538614 
1 1 1 -12 1  24 o 95.47078 3.024972 111.2786       7.028773 113.3882       11.73343 110.0979       8.778060 96.20621 5.022181 94.90736 3.803145 1.298851       6.299699 
1 1 1 -12 1  25 o 185.0827 3.330146 417.9347       15.01983 424.4590       21.44419 411.6516       21.04397 186.3382 4.726311 183.5057 4.709785 2.832489       6.672338 
1 1 1 -12 1  26 o 120.4585 2.795631 176.9815       8.206413 173.3058       11.55091 180.7276       11.66112 119.0715 3.986437 121.6015 3.940387 -2.530037      5.605205 
1 1 1 -12 1  27 o 206.2026 3.584296 519.0499       18.01085 495.1689       24.87047 545.3860       26.11764 201.1502 5.077792 211.1704 5.075336 -10.02023      7.179345 
1 1 1 -12 1  28 o 77.21774 4.360713 73.10421       8.172259 67.10317       11.57068 79.07761       11.54401 73.67767 6.511419 80.11404 5.955655 -6.436363      8.824307 
1 1 1 -12 1  29 o 29.38533 5.134047 10.87503       3.542693 15.77988       4.939792 5.680542       5.083549 35.40598 5.935117 22.45998 7.702737 12.94600       9.724082 
1 1 1 -12 1  30 o 164.9362 3.206964 332.1360       12.88980 321.0010       18.01556 343.8145       18.45007 161.9158 4.570432 167.5836 4.521968 -5.667801      6.429389 
1 1 1 -12 1  31 o 186.8600 3.440388 426.5276       15.66607 406.3723       21.66304 448.6244       22.68243 182.0913 4.886374 191.3340 4.868713 -9.242676      6.897900 
1 1 1 -12 1  32 o 182.8588 3.425376 408.5653       15.26371 418.6519       21.95151 399.1233       21.23845 184.7717 4.879475 180.4182 4.835017 4.353470       6.869255 
1 1 1 -12 1  33 o 146.0745 3.108911 260.6690       11.06672 282.0787       16.21216 241.9881       15.14381 151.6960 4.390234 140.4859 4.429038 11.21010       6.236228 
1 1 1 -12 1  34 o 160.7641 3.248823 315.9322       12.72773 313.0654       17.97989 318.8116       18.01964 159.7021 4.624855 161.1704 4.592697 -1.468369      6.517833 
1 1 1 -12 1  35 o 27.02889 6.846932 9.394296       4.514211 4.042237       6.058072 16.07631       6.769052 21.55323 8.252660 35.24643 8.057074 -13.69320      11.53355 
1 1 1 -12 1  36 o 49.12670 3.772368 29.75413       4.481589 21.95020       6.232738 38.10803       6.448620 41.64242 6.341932 55.45023 4.820139 -13.80781      7.965792 
1 1 1 -12 1  37 o 15.71688 6.124576 1.925098       3.379661 -2.341120      4.818034 6.057724       4.741998 14.40346 6.494060 22.46010 7.438992 -8.056646      9.874786 
1 1 1 -12 1  38 o 88.46146 2.995194 96.00678       6.447456 94.80832       8.989268 97.27649       9.252591 87.61102 4.222896 88.72690 4.292024 -1.115883      6.021155 
1 1 1 -12 1  39 o 43.46267 6.697800 24.35393       6.866331 20.36755       9.487846 28.73770       9.949512 38.60919 10.00390 46.31976 9.139254 -7.710571      13.55005 
1 1 1 -12 1  40 o 118.3509 3.071337 172.4610       8.850504 174.8555       12.62510 170.1470       12.41065 118.5374 4.378147 116.9370 4.362835 1.600418       6.180817 
1 1 1 -12 1  41 o 34.94427 4.833703 15.60590       4.006050 13.47727       5.599485 17.83780       5.733719 31.53849 7.411889 36.70770 6.654763 -5.169205      9.961021 
1 1 1 -12 1  42 o 69.93464 3.230530 60.78999       5.490696 59.18880       7.666940 62.47581       7.866956 68.30053 4.633839 70.18372 4.625536 -1.883194      6.547369 
1 1 1 -12 1  43 o 31.76730 5.236044 13.32135       3.912305 13.92183       5.378467 12.64662       5.701307 31.53038 7.163417 29.72543 7.781156 1.804947       10.57643 
1 1 1 -12 1  44 o 66.66972 3.811082 56.55221       6.165950 57.78917       9.957668 55.78299       7.852507 65.02125 6.365915 65.25587 4.975530 -0.2346268     8.079652 
1 1 1 -12 1  45 o 20.15787 6.623734 5.779936       3.762103 6.002360       5.274444 5.549585       5.367614 20.77682 7.757084 20.34093 7.773182 0.4358845      10.98156 
1 1 1 -12 1  46 o 34.47397 5.112237 16.35500       4.164828 15.91668       5.913857 16.78630       5.866344 31.74637 7.719914 32.87023 7.491048 -1.123863      10.75699 
1 1 1 -12 1  47 o 22.66945 6.531807 7.942773       3.804717 6.272735       5.568949 9.404634       5.210303 20.15635 7.859782 23.67071 7.795901 -3.514359      11.07033 
1 1 1 -12 1  48 o 20.59060 8.130195 7.494684       6.022677 13.61241       9.184373 2.879334       7.977313 24.30359 9.885924 17.98317 8.205553 6.320421       12.84767 
1 1 1 -12 1  49 o 23.91930 6.858479 9.851116       4.204511 5.732234       5.963438 13.92238       5.928866 18.38115 7.761260 26.54458 8.274471 -8.163427      11.34478 
1 1 1 -12 1  50 o 9.703784 4.735661 -4.522607      3.662278 -11.83275      4.896265 4.761029       5.517736 9.212265 4.646904 17.06056 7.341629 -7.848299      8.688684 
1 1 1 -12 2  1  o 582.3558 7.548333 4136.716       107.1212 3972.459       164.5459 4257.535       141.1220 570.2238 11.84147 590.5780 9.805761 -20.35419      15.37444 
1 1 1 -12 2  2  o 312.8113 4.291832 1192.672       32.71608 1162.995       50.84822 1213.636       42.73681 308.8161 6.756780 315.5115 5.558412 -6.695435      8.749287 
1 1 1 -12 2  3  o 583.2425 8.434297 4150.280       119.8765 4172.685       170.2140 4128.230       168.8562 584.4265 11.95169 581.3090 11.91993 3.117432       16.87980 
1 1 1 -12 2  4  o 340.0660 5.946829 1409.991       49.28160 1440.989       87.11253 1395.401       59.76461 343.3944 10.42208 338.2482 7.250575 5.146210       12.69608 
1 1 1 -12 2  5  o 481.2316 7.031136 2824.308       82.45475 2805.028       116.1375 2843.903       117.0856 479.3670 9.941871 482.6763 9.954314 -3.309235      14.06873 
1 1 1 -12 2  6  o 657.1659 9.462859 5270.880       151.5422 5185.465       212.1725 5359.832       216.5196 651.2773 13.36863 662.1284 13.41896 -10.85107      18.94172 
1 1 1 -12 2  7  o 577.3930 8.351429 4067.481       117.5083 4093.839       167.1344 4041.715       165.2453 578.8723 11.84805 575.1829 11.78928 3.689392       16.71417 
1 1 1 -12 2  8  o 157.1160 4.092840 301.0811       15.65710 287.3350       21.63505 316.1969       22.68739 153.4050 5.797820 160.9358 5.794355 -7.530853      8.196906 
1 1 1 -12 2  9  o 342.2921 5.950179 1428.601       49.63214 1550.624       90.60693 1376.292       59.32416 356.1929 10.44984 335.9089 7.247264 20.28406       12.71700 
1 1 1 -12 2  10 o 482.3089 8.137417 2838.344       95.64185 2858.673       166.7082 2828.371       116.7703 483.1403 14.17482 481.2934 9.956034 1.846924       17.32190 
1 1 1 -12 2  11 o 256.6250 4.689850 802.8187       29.32877 830.2122       52.06935 790.0890       35.49508 260.7059 8.206093 254.5517 5.722107 6.154175       10.00412 
1 1 1 -12 2  12 o 141.4391 2.792456 243.7956       9.624801 249.2126       13.89916 238.8048       13.34104 142.9321 3.994372 139.9165 3.916626 3.015625       5.594191 
1 1 1 -12 2  13 o 221.0144 3.642085 595.3849       19.61583 583.5097       27.57065 607.5581       27.91450 218.7607 5.171798 223.2243 5.131594 -4.463638      7.285654 
1 1 1 -12 2  14 o 452.2710 7.684598 2496.580       84.69466 2386.869       100.6464 2762.765       156.7704 442.0415 9.343277 474.7239 13.56539 -32.68240      16.47169 
1 1 1 -12 2  15 o 214.9944 5.076620 563.6740       26.59733 590.7768       38.83588 539.7320       36.50118 219.8864 7.257619 210.1717 7.137187 9.714676       10.17902 
1 1 1 -12 2  16 o 324.2180 5.717666 1282.374       45.17436 1279.197       55.30820 1288.740       78.29773 323.7160 7.011150 324.4723 9.913916 -0.7563171     12.14257 
1 1 1 -12 2  17 f 490.4294 7.175619 2937.183       85.75748 2949.001       121.6996 2925.527       120.8635 490.8611 10.17406 488.9099 10.14449 1.951172       14.36740 
1 1 1 -12 2  18 o 157.8787 2.977314 303.8409       11.45471 305.1728       16.37892 302.5657       16.02568 158.1307 4.254296 157.4577 4.180236 0.6729431      5.964345 
1 1 1 -12 2  19 o 358.2962 5.404563 1566.842       47.18879 1643.028       68.86250 1499.394       64.79330 366.5833 7.708573 350.2115 7.592130 16.37183       10.81954 
1 1 1 -12 2  20 o 222.6550 4.296051 604.7991       23.30977 604.1078       28.55559 606.1796       40.35374 222.4581 5.267526 222.5080 7.452728 -0.4988098E-01 9.126335 
1 1 1 -12 2  21 o 284.9048 4.468514 990.5660       31.02409 950.4725       42.90516 1034.500       44.91307 278.8629 6.313682 290.9254 6.335122 -12.06250      8.944068 
1 1 1 -12 2  22 o 254.0080 4.090050 787.3152       25.31699 759.9895       35.20029 816.5980       36.43911 249.3743 5.792399 258.4960 5.784660 -9.121658      8.186218 
1 1 1 -12 2  23 o 103.1329 3.047423 129.8316       7.650498 130.7526       9.508683 128.1410       12.88301 103.4488 3.778235 102.2840 5.185523 1.164757       6.415973 
1 1 1 -12 2  24 o 116.6152 3.110712 165.9903       8.832082 167.7360       14.91934 165.0485       10.95865 117.0384 5.244324 116.2271 3.874548 0.8113022      6.520357 
1 1 1 -12 2  25 o 55.58033 2.898202 37.77973       3.911856 41.96693       5.700203 34.05220       5.378227 58.49425 4.023411 52.64057 4.228122 5.853683       5.836510 
1 1 1 -12 2  26 o 106.7897 2.723914 139.1791       7.082787 136.4687       10.03751 141.8671       9.995772 105.6524 3.905335 107.7329 3.813443 -2.080521      5.458387 
1 1 1 -12 2  27 o 191.2176 3.424623 446.2838       15.95794 459.5875       22.98102 433.8956       22.17635 193.8156 4.869547 188.3222 4.836286 5.493423       6.863101 
1 1 1 -12 2  28 o 58.04214 4.993835 41.51575       6.994794 36.10218       10.13106 46.44714       9.669351 53.58515 8.003355 61.17917 6.589505 -7.594025      10.36703 
1 1 1 -12 2  29 o 165.7105 3.208564 335.2021       12.95677 322.7834       18.03874 348.4374       18.62249 162.3958 4.562742 168.7355 4.533031 -6.339722      6.431717 
1 1 1 -12 2  30 o 92.06987 2.795862 103.5406       6.265646 103.5172       8.866774 103.5640       8.855159 91.94509 3.966650 91.96660 3.960493 -0.2150726E-01 5.605338 
1 1 1 -12 2  31 o 130.9524 2.982007 209.3491       9.516087 200.1126       13.21868 219.2855       13.71033 127.8345 4.249209 133.8309 4.209165 -5.996414      5.981041 
1 1 1 -12 2  32 o 178.9552 3.390156 391.2924       14.78428 389.8550       20.90427 392.7308       20.91200 178.3110 4.815246 178.9716 4.799183 -0.6606750     6.798437 
1 1 1 -12 2  33 f 105.0001 2.918450 134.7486       7.460303 137.0150       10.57278 132.5011       10.52829 105.7208 4.111699 103.9540 4.164475 1.766876       5.852258 
1 1 1 -12 2  34 o 62.28595 3.171474 47.53907       4.797947 47.07670       6.822346 47.99153       6.748895 61.79443 4.562704 62.41007 4.467077 -0.6156387     6.385377 
1 1 1 -12 2  35 o 119.0103 3.990588 173.7433       11.55694 157.9765       15.71067 192.3360       17.06062 113.0697 5.720391 124.8170 5.623435 -11.74729      8.021589 
1 1 1 -12 2  36 o 48.49921 3.760849 29.00281       4.410134 24.24229       6.123874 34.13165       6.356365 43.91204 5.869642 52.40974 5.038945 -8.497696      7.735869 
1 1 1 -12 2  37 o 83.57899 3.018686 85.62775       6.138146 86.52741       8.732545 84.74915       8.629669 83.76226 4.292468 82.89626 4.286479 0.8660049      6.066233 
1 1 1 -12 2  38 o 42.53303 3.945642 22.45042       4.042971 21.18999       5.785316 23.65355       5.652255 40.82637 5.993328 43.31636 5.476904 -2.489986      8.118895 
1 1 1 -12 2  39 o 91.41648 4.666249 103.9298       10.36071 90.84868       14.35949 118.1349       14.96368 84.35905 7.049471 96.64278 6.389647 -12.28372      9.514338 
1 1 1 -12 2  40 o 35.86841 4.419691 16.22424       3.781533 16.47767       5.374719 15.97581       5.321469 35.51855 6.446980 34.94711 6.487401 0.5714378      9.146033 
1 1 1 -12 2  41 o 16.35642 6.158808 2.665287       3.339738 6.313416       4.712953 -1.014439      4.733319 22.27294 7.417396 14.90851 6.597539 7.364433       9.926998 
1 1 1 -12 2  42 o 38.22694 4.466908 18.64651       4.082791 20.16468       5.717381 17.06675       5.832208 38.99542 6.225795 35.44376 7.000838 3.551666       9.368685 
1 1 1 -12 2  43 o 111.8464 3.124450 155.8874       8.507578 157.3916       12.02043 154.3776       12.04267 111.1282 4.447721 109.9982 4.502149 1.130028       6.328631 
1 1 1 -12 2  44 o 42.23543 4.816231 23.41533       4.868535 26.91296       7.659272 21.04408       6.306505 43.24699 7.541759 38.58363 6.963498 4.663361       10.26491 
1 1 1 -12 2  45 o 21.31878 6.663778 6.589978       3.842524 1.275923       5.120020 13.44278       5.814237 16.29880 7.043302 29.41498 7.931492 -13.11619      10.60739 
1 1 1 -12 2  46 o 12.74479 5.633903 -0.8685607E-01 3.442550 -2.009414      4.764140 2.013899       4.980036 13.37931 6.190531 16.43471 7.021499 -3.055403      9.360775 
1 1 1 -12 2  47 o 13.84824 5.991145 0.9431867      3.712977 -5.290621      5.271760 7.079492       5.230370 12.26052 5.911411 20.94811 7.742812 -8.687589      9.741454 
1 1 1 -12 2  48 o 18.65290 7.752947 5.288937       5.809553 4.267592       7.927744 6.473591       8.538057 18.64468 8.374687 19.97979 8.850379 -1.335102      12.18460 
1 1 1 -12 2  49 o 13.77792 6.072963 1.215330       3.972539 -1.646793      5.754899 3.820468       5.490463 13.77649 6.510926 16.80536 7.277918 -3.028867      9.765258 
1 1 1 -12 2  50 o 21.63842 6.936069 8.562559       4.139758 5.122774       5.628274 12.61690       6.110402 17.33353 7.436265 23.91816 8.430416 -6.584631      11.24144 
1 1 1 -12 3  1  o 273.5886 4.319580 912.3472       28.79888 900.2150       40.25626 925.0650       41.21623 271.7149 6.079725 275.4377 6.140573 -3.722778      8.641162 
1 1 1 -12 3  2  o 406.3745 5.396550 2013.267       53.44152 2037.653       85.10399 1997.390       68.66890 408.6566 8.545851 404.6940 6.963013 3.962555       11.02339 
1 1 1 -12 3  3  o 286.2993 3.989297 999.0278       27.83253 962.0349       42.98867 1025.725       36.52000 280.8861 6.280405 290.0700 5.166446 -9.183868      8.132383 
1 1 1 -12 3  4  o 401.8312 5.961179 1968.722       58.37299 2024.493       84.18714 1917.083       81.00834 407.3435 8.481036 396.3964 8.386176 10.94711       11.92711 
1 1 1 -12 3  5  o 262.7918 4.805533 841.8201       30.77439 791.7496       52.20949 868.4790       38.09599 254.6026 8.426540 266.8921 5.857434 -12.28954      10.26236 
1 1 1 -12 3  6  o 672.4465 9.674543 5519.472       158.5347 5267.928       217.2025 5806.271       231.9247 656.3767 13.57924 689.0577 13.81196 -32.68097      19.36921 
1 1 1 -12 3  7  o 758.8267 12.57434 7037.612       232.5219 7251.609       290.7727 6658.046       387.2518 769.6637 15.50303 735.5652 21.62758 34.09845       26.61008 
1 1 1 -12 3  8  o 427.1012 7.266357 2224.977       75.62817 2232.208       131.1420 2221.374       92.57224 427.1577 12.61228 426.6425 8.903906 0.5151367      15.43856 
1 1 1 -12 3  9  o 230.6350 3.744878 648.3098       21.04742 645.0790       29.87028 651.4958       29.66191 230.0253 5.328777 231.1682 5.265444 -1.142853      7.491379 
1 1 1 -12 3  10 o 178.4058 3.149954 387.8979       13.69460 387.9668       19.59941 387.8322       19.14283 178.3444 4.513322 178.3724 4.403951 -0.2793884E-01 6.305939 
1 1 1 -12 3  11 o 331.9968 7.122563 1344.557       57.62439 1334.011       81.45680 1355.122       81.52962 330.3416 10.13075 332.9552 10.05986 -2.613647      14.27701 
1 1 1 -12 3  12 o 331.1619 5.023675 1337.079       40.54133 1305.302       56.72134 1370.266       57.96717 327.1008 7.115882 335.1428 7.097674 -8.042023      10.05051 
1 1 1 -12 3  13 o 275.4675 4.312925 925.0485       28.95199 891.3948       40.16087 961.4625       41.77542 270.3427 6.096104 280.7663 6.105760 -10.42365      8.628024 
1 1 1 -12 3  14 o 647.0140 10.78526 5118.546       170.0515 4750.678       280.3782 5332.610       213.8804 620.9515 18.54973 659.8073 13.30202 -38.85577      22.82622 
1 1 1 -12 3  15 f 162.7937 4.294698 323.3367       17.02264 350.4434       25.49266 301.5245       22.86794 169.3695 6.186916 157.1016 5.984186 12.26793       8.607463 
1 1 1 -12 3  16 o 111.8928 3.037847 152.7165       8.275647 147.5431       10.18273 162.7816       14.20314 109.9446 3.806359 115.4162 5.062200 -5.471550      6.333580 
1 1 1 -12 3  17 o 73.68671 2.595296 66.26035       4.653005 64.42776       6.769933 67.90112       6.405837 72.59120 3.840719 74.54633 3.536335 -1.955132      5.220804 
1 1 1 -12 3  18 o 140.5790 2.835688 240.8948       9.714379 230.6905       13.68651 251.2547       13.79049 137.4778 4.089847 143.4880 3.947672 -6.010147      5.684273 
1 1 1 -12 3  19 o 76.54915 2.572426 71.50685       4.791837 77.27631       7.088730 66.65217       6.502517 79.52173 3.667902 73.84361 3.624612 5.678116       5.156677 
1 1 1 -12 3  20 o 112.7685 2.663173 155.0227       7.318519 161.9977       10.73365 148.9630       10.00466 115.1838 3.829340 110.4541 3.722248 4.729706       5.340315 
1 1 1 -12 3  21 o 63.61535 2.697190 49.42665       4.171795 51.56805       6.098386 47.54311       5.719448 64.90197 3.873479 62.31547 3.784200 2.586498       5.415165 
1 1 1 -12 3  22 o 327.3239 5.022557 1308.450       40.06256 1265.204       55.64143 1355.003       57.73034 321.5017 7.101971 332.7116 7.120329 -11.20993      10.05669 
1 1 1 -12 3  23 o 107.6765 3.096836 141.5229       8.117532 147.8953       10.26413 130.8811       13.26412 110.0246 3.834075 103.3624 5.283515 6.662125       6.528067 
1 1 1 -12 3  24 o 202.3281 4.010951 499.6766       19.77606 477.7217       33.10712 511.8561       24.65869 197.3734 6.893884 204.6850 4.943652 -7.311615      8.483238 
1 1 1 -12 3  25 o 110.0247 2.737129 147.6318       7.338741 150.3091       10.53447 145.1074       10.22935 110.8977 3.904201 108.9634 3.858490 1.934265       5.489147 
1 1 1 -12 3  26 o 173.4137 3.234564 366.9315       13.66895 368.8013       19.47664 365.1167       19.18823 173.6688 4.606167 172.8045 4.560616 0.8642731      6.481974 
1 1 1 -12 3  27 f 61.08802 2.932811 45.63202       4.353172 44.93131       6.259021 46.28855       6.058503 60.49385 4.273297 61.42646 4.070335 -0.9326096     5.901584 
1 1 1 -12 3  28 o 72.84552 4.411804 65.09948       7.794969 67.26422       11.76857 63.40747       10.40452 73.74393 6.619135 71.67786 6.011979 2.066071       8.941858 
1 1 1 -12 3  29 f 191.6510 3.464359 448.5104       16.17969 420.6809       22.26777 479.6346       23.54902 185.3383 4.934716 197.9776 4.881133 -12.63936      6.940956 
1 1 1 -12 3  30 o 79.22490 2.890436 76.70592       5.570992 68.79028       7.674408 85.52373       8.099949 74.88708 4.222453 83.55279 3.989715 -8.665703      5.809211 
1 1 1 -12 3  31 o 108.4794 2.889079 143.7478       7.630552 144.8417       10.84408 142.6750       10.73914 108.7528 4.099156 107.9363 4.090274 0.8164749      5.790805 
1 1 1 -12 3  32 o 130.9191 3.001089 209.2991       9.574542 204.9774       13.51587 213.6524       13.56516 129.3415 4.294102 132.0654 4.220441 -2.723907      6.020916 
1 1 1 -12 3  33 o 59.87943 3.265459 43.94529       4.746912 50.45206       6.708085 37.41883       6.718222 64.03989 4.323796 54.99431 5.070071 9.045586       6.663395 
1 1 1 -12 3  34 f 82.98202 2.982493 84.24371       6.021332 81.35735       8.492633 87.16129       8.538451 81.36726 4.298331 84.24743 4.171953 -2.880165      5.990061 
1 1 1 -12 3  35 o 36.39290 5.684854 16.70211       4.876853 17.34029       6.459667 15.85622       7.436953 36.72046 7.473292 34.92321 8.755964 1.797249       11.51160 
1 1 1 -12 3  36 o 64.58813 3.274481 51.19458       5.137029 49.73493       7.051795 52.84501       7.498476 63.43822 4.592647 65.37234 4.739164 -1.934113      6.599400 
1 1 1 -12 3  37 o 25.59438 5.983898 8.450574       3.665031 6.344583       4.946565 11.01387       5.457258 22.94839 7.597645 29.09132 7.611640 -6.142929      10.75459 
1 1 1 -12 3  38 o 117.4520 3.029858 169.2199       8.664748 163.8322       12.07474 174.9394       12.44108 115.1705 4.309902 119.0206 4.296482 -3.850067      6.085640 
1 1 1 -12 3  39 o 40.42323 7.279670 21.35573       6.907290 27.86027       10.29436 16.02929       9.315578 45.34389 9.614949 34.36920 10.30754 10.97469       14.09584 
1 1 1 -12 3  40 o 18.22646 6.239161 3.935009       3.334869 1.996416       4.480758 6.342351       4.993178 17.22155 6.941191 22.62790 7.635993 -5.406351      10.31933 
1 1 1 -12 3  41 o 44.54275 3.909914 24.86297       4.201032 21.39786       5.733117 28.88102       6.173621 40.54579 5.981873 47.45295 5.436818 -6.907158      8.083426 
1 1 1 -12 3  42 o 37.13177 4.383666 17.58683       3.890228 14.88295       5.474297 20.34536       5.529344 33.01250 7.020959 39.27994 5.963707 -6.267441      9.211930 
1 1 1 -12 3  43 o 21.57822 6.386542 6.356621       3.594772 8.637253       4.873103 3.634042       5.324369 24.76012 7.461726 19.19904 7.624105 5.561083       10.66791 
1 1 1 -12 3  44 o 49.15391 4.217932 31.15935       5.003554 27.85957       7.847829 33.41941       6.494825 43.90007 7.611559 50.05590 5.410342 -6.155830      9.338502 
1 1 1 -12 3  45 o 35.90411 5.496229 17.73008       4.656106 19.70798       5.855489 14.32893       7.678432 36.86404 6.767461 28.97483 9.459517 7.889210       11.63103 
1 1 1 -12 3  46 o 21.19809 6.511711 6.708106       3.687431 7.786371       5.431332 5.786139       5.022285 22.21587 7.936415 19.99428 7.547264 2.221596       10.95207 
1 1 1 -12 3  47 o 16.67672 6.447417 3.648516       3.722707 6.839495       5.354548 0.6630706      5.179233 20.65412 7.793676 15.27851 6.822731 5.375612       10.35814 
1 1 1 -12 3  48 o 13.30314 6.117338 -0.7738322     4.550154 -9.177004      7.531875 4.055518       5.709865 13.19600 6.509891 17.61001 7.520882 -4.414008      9.946977 
1 1 1 -12 3  49 o 15.86542 6.398944 3.569023       3.810862 2.120464       5.704657 4.736416       5.121181 15.73853 7.083775 17.39708 7.258876 -1.658553      10.14254 
1 1 1 -12 3  50 o 16.36941 6.812142 4.211658       4.492995 3.970941       8.165384 4.316191       5.380828 17.14775 7.992063 16.66237 7.210453 0.4853764      10.76400 
1 1 1 -12 4  1  o 375.4603 5.636616 1718.746       51.57255 1691.274       72.03088 1747.642       73.87322 372.3306 7.938783 378.4800 8.009547 -6.149475      11.27728 
1 1 1 -12 4  2  o 1216.510 17.36659 18139.03       514.8330 18979.62       751.1384 17394.26       707.0295 1240.542 24.84690 1187.842 24.42545 52.70007       34.84209 
1 1 1 -12 4  3  o 216.1708 4.186762 569.5721       22.05522 631.6797       41.57796 545.2533       26.01731 227.4420 7.511948 211.4892 5.048219 15.95285       9.050628 
1 1 1 -12 4  4  o 548.2398 7.961401 3666.751       106.3644 3502.327       146.0874 3852.249       155.1667 535.4852 11.19513 561.5814 11.33835 -26.09619      15.93390 
1 1 1 -12 4  5  o 220.4689 4.204014 592.4482       22.58643 593.6400       27.88727 590.1757       38.50780 220.6708 5.185912 219.8552 7.197165 0.8155212      8.870900 
1 1 1 -12 4  6  f 369.1970 6.390066 1662.155       57.49095 1627.992       69.69357 1734.911       101.7065 365.3096 7.828807 376.7241 11.09078 -11.41455      13.57555 
1 1 1 -12 4  7  o 126.1354 3.717021 194.0783       11.41285 0.000000       0.000000 194.0783       11.41285 ?        ?        126.1354 3.717021 0.000000       3.717021 
1 1 1 -12 4  8  o 627.0401 9.046010 4798.769       138.2256 4729.817       193.6414 4870.403       197.3730 621.9976 12.77537 631.1643 12.83244 -9.166687      18.10750 
1 1 1 -12 4  9  o 396.9754 5.897189 1921.572       57.04856 1888.797       80.05236 1955.395       81.32029 393.4281 8.349734 400.3050 8.336270 -6.876892      11.79879 
1 1 1 -12 4  10 f 621.5869 8.970788 4716.221       135.8841 4902.915       197.5203 4548.471       187.2305 633.1788 12.80116 609.8977 12.59747 23.28107       17.96012 
1 1 1 -12 4  11 o 242.8022 4.499022 718.6552       26.61993 719.0678       46.69490 718.4566       32.40059 242.6217 7.908321 242.7405 5.477401 -0.1188202     9.619951 
1 1 1 -12 4  12 o 342.8740 5.182048 1433.425       43.29842 1502.806       63.34145 1372.569       59.32238 350.9475 7.406443 335.4054 7.257924 15.54211       10.36980 
1 1 1 -12 4  13 o 428.8964 6.338318 2243.891       66.24644 2383.769       97.84866 2125.516       90.01415 441.7989 9.088540 417.2060 8.853688 24.59296       12.68816 
1 1 1 -12 4  14 o 161.1878 3.461707 316.6900       13.59749 310.8697       24.19427 319.3772       16.43939 159.5108 6.236258 161.8027 4.172789 -2.291916      7.503537 
1 1 1 -12 4  15 o 467.1404 6.863238 2663.367       78.12907 2491.406       105.8431 2869.242       115.8108 451.4425 9.621085 484.4348 9.810197 -32.99234      13.74064 
1 1 1 -12 4  16 f 159.0484 3.484365 308.3760       13.50483 305.8445       16.70244 313.1560       22.95093 158.3135 4.333457 160.0944 5.892911 -1.780838      7.314728 
1 1 1 -12 4  17 o 148.7083 3.365593 269.5920       12.19643 276.0283       15.29340 258.3461       20.21541 150.3935 4.176953 145.3890 5.716921 5.004501       7.080263 
1 1 1 -12 4  18 o 181.5202 3.232921 401.6990       14.30066 410.9565       20.71414 393.2684       19.76745 183.4870 4.636319 179.5002 4.522677 3.986862       6.476887 
1 1 1 -12 4  19 o 350.5821 5.309181 1500.188       45.35795 1464.029       63.39210 1538.119       64.92709 346.0274 7.517763 354.6761 7.512041 -8.648682      10.62768 
1 1 1 -12 4  20 o 159.3767 3.032459 309.7017       11.77757 311.5407       16.97771 307.9957       16.35192 159.7331 4.365717 158.8314 4.228466 0.9016571      6.077780 
1 1 1 -12 4  21 o 240.9887 3.931725 708.5234       23.08957 729.1775       33.42899 689.6804       31.92975 244.3139 5.614860 237.6160 5.514216 6.697952       7.869767 
1 1 1 -12 4  22 o 54.58889 2.887031 36.43858       3.826880 36.99968       5.626920 35.95570       5.220011 54.89712 4.238965 54.13683 3.984707 0.7602959      5.817792 
1 1 1 -12 4  23 o 212.1159 4.180915 549.2060       21.61129 557.1222       26.84095 534.6149       36.44054 213.5388 5.158044 208.7932 7.172618 4.745636       8.834697 
1 1 1 -12 4  24 o 341.1250 6.006097 1423.609       49.92775 1503.402       89.18910 1387.192       60.25337 348.9568 10.50022 336.3958 7.350125 12.56104       12.81713 
1 1 1 -12 4  25 o 136.3599 2.903250 226.7928       9.647333 231.0635       13.89224 222.8149       13.40745 137.5013 4.150752 135.0295 4.079243 2.471832       5.819705 
1 1 1 -12 4  26 f 268.8502 4.318087 882.9568       28.29032 898.7085       40.58065 868.0632       39.45998 270.8821 6.147558 266.2382 6.082057 4.643921       8.647767 
1 1 1 -12 4  27 o 104.0639 2.760104 132.1936       6.993237 137.2290       10.11539 127.5834       9.678904 105.9301 3.925354 102.1371 3.895862 3.793030       5.530474 
1 1 1 -12 4  28 o 184.8269 4.928586 418.2160       22.17869 428.5858       32.60562 409.2865       30.25673 186.6118 7.183383 182.4465 6.817340 4.165314       9.903389 
1 1 1 -12 4  29 o 40.05535 3.823324 19.77851       3.686740 18.92648       5.191663 20.64525       5.236299 38.90249 5.640721 40.70229 5.413310 -1.799793      7.818034 
1 1 1 -12 4  30 o 137.8534 2.997962 231.9697       10.07117 233.2285       14.40079 230.7648       14.08986 138.0303 4.286498 137.3091 4.215860 0.7212067      6.012282 
1 1 1 -12 4  31 o 34.64015 4.467407 14.92515       3.683413 17.69501       5.149278 12.02265       5.271123 37.53674 5.817394 30.63301 7.186007 6.903732       9.245582 
1 1 1 -12 4  32 o 97.55950 2.919054 116.3180       6.932008 119.2556       9.879740 113.4696       9.728686 98.63988 4.119208 96.20739 4.159461 2.432487       5.853971 
1 1 1 -12 4  33 o 52.28102 3.590102 33.57997       4.546138 29.10484       6.402126 38.13163       6.456641 48.36020 5.531927 55.55733 4.816559 -7.197136      7.334948 
1 1 1 -12 4  34 o 46.46195 3.778723 26.59406       4.241467 27.36919       6.159042 25.89486       5.849594 46.85844 5.498197 45.58631 5.368508 1.272137       7.684468 
1 1 1 -12 4  35 o 120.4875 3.411981 177.7915       10.00799 182.2507       12.61636 170.2231       16.43648 121.8184 4.256502 117.3367 5.765951 4.481766       7.166868 
1 1 1 -12 4  36 o 100.4607 2.985418 123.5641       7.300545 136.5441       10.70434 112.2757       9.982478 105.3720 4.176954 95.50726 4.300126 9.864769       5.994834 
1 1 1 -12 4  37 o 54.15655 3.501053 36.12149       4.595708 36.83520       6.480785 35.39957       6.518000 54.40768 4.941860 53.29676 5.079912 1.110924       7.087135 
1 1 1 -12 4  38 o 65.57339 3.168602 52.87212       5.048288 55.12551       7.114836 50.58738       7.164135 66.68182 4.403103 63.80490 4.639283 2.876915       6.396113 
1 1 1 -12 4  39 o 35.78783 5.569799 16.37378       4.699499 14.18242       9.363915 17.11156       5.433317 32.58896 10.43021 36.36094 6.363567 -3.771976      12.21820 
1 1 1 -12 4  40 o 61.73980 3.277817 47.12651       4.913907 51.37085       6.848438 42.62255       7.054781 64.10013 4.411158 58.13460 5.029224 5.965527       6.689650 
1 1 1 -12 4  41 o 37.36701 4.421770 17.70666       3.948507 12.58947       5.347085 23.84334       5.855556 30.45061 7.300562 42.91582 5.743086 -12.46521      9.288770 
1 1 1 -12 4  42 o 17.05652 6.496927 2.954030       3.741927 4.614371       4.638417 -0.1404025     6.332301 19.89296 7.302071 17.60018 7.715502 2.292784       10.62305 
1 1 1 -12 4  43 o 15.49591 6.109498 2.158251       3.396413 2.396538       4.612162 1.875932       5.020251 17.24896 7.009570 17.24682 7.190877 0.2140045E-02  10.04205 
1 1 1 -12 4  44 o 19.26290 6.754006 4.914690       3.918268 4.159318       6.132449 5.435812       5.093578 19.90832 8.085488 20.46736 7.626604 -0.5590458     11.11486 
1 1 1 -12 4  45 o 15.07684 6.324775 1.549279       3.919662 6.161929       4.979500 -5.964517      6.355360 20.76281 7.574648 13.79295 6.608675 6.969856       10.05236 
1 1 1 -12 4  46 o 18.13679 6.447636 4.615447       3.580529 8.909938       5.239789 0.8535424      4.904128 23.52884 7.820586 15.41184 6.771994 8.117002       10.34512 
1 1 1 -12 4  47 o 14.21140 6.306070 0.4806188      4.353198 0.4540705      5.331344 0.5337280      7.540561 15.25448 6.858497 17.14078 7.879472 -1.886304      10.44629 
1 1 1 -12 4  48 o 15.69211 6.582773 2.789382       4.245857 6.786398       7.491117 0.8976453      5.153581 19.90722 8.560316 14.96776 6.735233 4.939459       10.89231 
1 1 1 -12 4  49 o 20.57796 6.913493 7.453641       4.093143 9.300849       6.162810 5.995655       5.475169 21.24474 8.272785 18.48123 7.588723 2.763514       11.22621 
1 1 1 -12 4  50 o 11.35701 5.355686 -1.751881      3.854756 -0.1613245     5.794970 -3.014226      5.162567 14.15017 6.639568 12.28342 5.903916 1.866748       8.884824 
1 1 1 -12 5  1  o 444.6353 5.868275 2410.615       63.58439 2339.816       98.58886 2461.038       83.20071 437.8235 9.240442 449.1516 7.601477 -11.32813      11.96529 
1 1 1 -12 5  2  o 84.50867 2.657070 87.11654       5.465129 82.12613       7.425950 93.01325       8.072143 82.00273 3.725836 87.27561 3.804560 -5.272881      5.325085 
1 1 1 -12 5  3  o 335.5129 5.915036 1372.565       48.36183 1459.604       61.33714 1229.543       78.62599 345.9245 7.276226 317.1684 10.18600 28.75607       12.51791 
1 1 1 -12 5  4  o 386.2928 5.774519 1819.415       54.35863 1837.017       77.30222 1802.197       76.45422 388.0257 8.175144 384.3314 8.163182 3.694336       11.55294 
1 1 1 -12 5  5  o 127.0812 3.668182 196.9921       11.34785 187.5450       15.83421 206.9679       16.27129 123.9192 5.255437 130.1951 5.138601 -6.275932      7.350160 
1 1 1 -12 5  6  o 181.1777 3.211922 400.0441       14.18097 399.9590       20.41595 400.1235       19.71239 181.0787 4.630444 181.1778 4.464761 -0.9916687E-01 6.432348 
1 1 1 -12 5  7  f 714.7111 10.26606 6237.710       178.8013 6281.765       254.3255 6194.654       251.4258 716.4310 14.56731 711.4603 14.50184 4.970642       20.55505 
1 1 1 -12 5  8  o 275.4966 4.993455 925.2774       33.52382 883.4665       57.44041 946.8760       41.28440 268.9068 8.777321 278.6574 6.079660 -9.750610      10.67725 
1 1 1 -12 5  9  o 862.6031 12.34674 9097.246       259.5370 8849.189       360.4359 9364.357       374.0226 849.3317 17.41465 873.6522 17.56804 -24.32056      24.73673 
1 1 1 -12 5  10 o 351.7131 5.301855 1508.240       45.44148 1500.028       64.39207 1516.386       64.13662 350.6361 7.535978 352.5472 7.465393 -1.911102      10.60769 
1 1 1 -12 5  11 o 408.7930 6.995658 2038.667       69.68963 2101.062       123.6895 2009.649       84.35286 414.2952 12.26493 405.7519 8.531063 8.543335       14.94014 
1 1 1 -12 5  12 o 209.1314 4.087398 533.1409       20.83062 550.4604       26.20257 503.3968       34.33822 212.4754 5.060567 203.0081 6.951356 9.467270       8.598296 
1 1 1 -12 5  13 o 537.0995 9.019825 3523.492       118.0563 3669.175       210.7200 3456.845       142.5245 546.4833 15.83986 531.6807 11.00025 14.80261       19.28488 
1 1 1 -12 5  14 o 426.8051 7.288105 2223.508       75.80194 2241.890       132.5369 2214.573       92.40737 427.5994 12.73350 425.7599 8.906473 1.839539       15.53922 
1 1 1 -12 5  15 o 329.7998 5.026382 1326.552       40.39634 1304.295       56.82313 1349.295       57.43997 326.8622 7.133857 332.4569 7.089942 -5.594788      10.05779 
1 1 1 -12 5  16 o 276.1720 5.023745 930.3394       33.80986 925.1462       41.48591 940.6103       58.34311 275.3225 6.183336 277.2612 8.645606 -1.938721      10.62921 
1 1 1 -12 5  17 f 152.7381 3.438964 284.4169       12.80003 268.8789       15.52545 317.3935       22.61778 148.4210 4.297049 161.1617 5.768370 -12.74069      7.192963 
1 1 1 -12 5  18 o 189.2913 3.859008 436.9529       17.80092 434.0624       21.96384 442.4858       30.38803 188.5611 4.783779 190.2215 6.565359 -1.660416      8.123329 
1 1 1 -12 5  19 o 326.9945 5.006938 1304.965       39.89779 1254.163       55.29789 1360.127       57.62182 320.3037 7.084520 333.5599 7.088870 -13.25620      10.02210 
1 1 1 -12 5  20 o 205.5344 3.528780 515.2093       17.67442 486.2997       24.52869 546.4288       25.48982 199.5230 5.048872 211.5743 4.943878 -12.05135      7.066331 
1 1 1 -12 5  21 o 177.6186 3.229572 384.7441       13.97879 406.0355       20.57202 366.4806       19.05321 182.3221 4.633974 173.2189 4.517599 9.103241       6.471662 
1 1 1 -12 5  22 o 91.31229 3.073664 101.8003       6.829710 102.7684       8.545979 100.0891       11.36198 91.69444 3.833024 90.37005 5.181044 1.324387       6.444788 
1 1 1 -12 5  23 o 206.1148 4.142292 518.5742       20.80588 524.1473       25.91502 508.4677       34.89862 207.1190 5.134469 203.6287 7.043486 3.490280       8.716276 
1 1 1 -12 5  24 o 296.3654 5.337276 1073.698       38.54634 1095.454       67.34292 1063.097       47.00875 298.2299 9.277547 294.6559 6.546776 3.574036       11.35487 
1 1 1 -12 5  25 o 154.6605 3.058436 291.7953       11.52697 312.9498       17.06547 274.0458       15.63188 160.0099 4.380707 149.7365 4.288398 10.27336       6.130331 
1 1 1 -12 5  26 o 127.2031 2.859740 197.3790       8.864627 197.5213       12.82010 197.2486       12.27088 127.1016 4.144627 127.0320 3.968802 0.6960297E-01  5.738407 
1 1 1 -12 5  27 o 113.8670 2.805989 158.1715       7.786101 155.1157       11.14742 161.0824       10.87987 112.6137 4.068754 114.7800 3.895393 -2.166313      5.632836 
1 1 1 -12 5  28 o 160.4585 4.606973 315.1028       17.99553 332.1135       26.94777 301.4113       24.17626 164.3269 6.743754 156.6186 6.347613 7.708344       9.261231 
1 1 1 -12 5  29 o 181.2928 3.369574 401.3176       14.88647 417.2054       21.67414 387.1298       20.48172 184.5796 4.822743 177.8144 4.730960 6.765167       6.755800 
1 1 1 -12 5  30 o 177.3798 3.340860 384.2493       14.44104 387.8087       20.68137 380.8625       20.17352 177.9235 4.774222 176.3366 4.698836 1.586884       6.698676 
1 1 1 -12 5  31 o 156.3295 3.172799 298.4512       12.08703 290.2389       17.11303 306.6264       17.07432 153.9100 4.567778 158.2243 4.432637 -4.314377      6.364972 
1 1 1 -12 5  32 f 159.9643 3.227166 312.6048       12.58000 310.8366       17.90868 314.3271       17.67522 159.2258 4.620336 160.1364 4.533942 -0.9105988     6.473341 
1 1 1 -12 5  33 o 240.9531 4.069829 710.7849       23.89708 700.4838       33.70809 721.1936       33.88374 238.6186 5.796872 242.1421 5.742288 -3.523438      8.159510 
1 1 1 -12 5  34 o 52.14195 3.904260 33.47370       4.924898 35.48040       7.737047 32.10680       6.385621 53.31572 6.062576 50.84789 5.227796 2.467831       8.005291 
1 1 1 -12 5  35 o 63.92925 3.649141 50.21203       5.661333 46.09086       6.885028 58.81538       9.947845 61.07683 4.661075 68.75407 5.997340 -7.677235      7.595637 
1 1 1 -12 5  36 o 74.27324 3.118318 67.63207       5.631467 73.74440       8.057426 61.79497       7.873936 77.35551 4.291155 70.73000 4.593114 6.625504       6.285754 
1 1 1 -12 5  37 o 63.17281 3.299752 49.05484       5.062201 46.11229       7.043809 52.19812       7.280105 60.94722 4.780852 64.90157 4.633537 -3.954342      6.657794 
1 1 1 -12 5  38 o 65.22149 3.803338 52.53687       6.018707 50.75360       7.079993 57.18377       11.42894 63.90868 4.576369 66.97614 7.110987 -3.067451      8.456317 
1 1 1 -12 5  39 o 30.15703 6.456705 11.90165       4.601870 13.18087       9.969702 11.55530       5.187568 31.77867 10.78950 29.53716 7.259488 2.241505       13.00437 
1 1 1 -12 5  40 o 40.46219 4.181129 20.55269       4.063357 21.16186       5.615479 19.88318       5.887044 40.51383 5.857674 39.04290 6.409794 1.470936       8.683190 
1 1 1 -12 5  41 o 44.39825 4.368309 24.91035       4.665094 24.00225       5.741583 26.67448       8.002604 43.08804 5.600523 44.42138 7.669872 -1.333347      9.496988 
1 1 1 -12 5  42 o 11.13376 5.115404 -2.019723      3.172345 -0.8413290     4.328343 -3.387429      4.663080 14.20669 6.296855 13.08852 6.079638 1.118166       8.752850 
1 1 1 -12 5  43 o 29.01594 5.375950 11.25699       3.661314 11.55628       5.084276 10.93461       5.276851 28.48785 7.293316 27.57582 7.606149 0.9120312      10.53784 
1 1 1 -12 5  44 o 20.03787 6.800343 5.508195       3.960376 3.189065       6.225053 7.085124       5.133182 19.12960 7.993988 22.29041 7.736041 -3.160814      11.12430 
1 1 1 -12 5  45 o 24.19362 6.924456 8.772974       4.289577 7.270596       5.421001 11.28913       7.015502 22.00578 7.920745 26.00435 9.042796 -3.998571      12.02125 
1 1 1 -12 5  46 o 13.63216 5.890811 0.7264870      3.581364 10.55028       5.490428 -6.549008      4.724957 25.32190 7.972764 11.09885 5.408207 14.22305       9.633985 
1 1 1 -12 5  47 o 16.54325 6.733500 3.296114       4.264036 1.500703       5.198775 6.986696       7.453608 15.78145 6.952037 20.78634 8.720961 -5.004889      11.15285 
1 1 1 -12 5  48 o 12.35460 5.792669 -1.961330      4.396679 -3.153548      7.890067 -1.424395      5.294971 15.25313 7.322814 13.70675 6.403991 1.546380       9.728037 
1 1 1 -12 5  49 o 31.35915 5.959597 15.45815       4.387812 9.620403       6.180414 21.39089       6.230494 21.45499 8.303979 34.63330 7.592153 -13.17831      11.25153 
1 1 1 -12 5  50 o 14.95588 6.344727 2.923032       4.016496 -1.071255      5.869430 6.440715       5.508136 13.76034 6.524576 18.29998 7.572591 -4.539636      9.995710 
1 1 1 -12 6  1  o 370.6500 5.581220 1675.070       50.41145 1670.710       71.04442 1679.492       71.54332 370.0409 7.878510 371.0099 7.913114 -0.9690247     11.16639 
1 1 1 -12 6  2  o 182.8066 3.265561 407.2772       14.54741 413.0422       20.83249 401.7906       20.32325 184.0154 4.649423 181.4923 4.598845 2.523071       6.539610 
1 1 1 -12 6  3  o 333.4605 5.104691 1355.617       41.48107 1372.873       58.95742 1338.700       58.37314 335.4832 7.211599 331.2805 7.230711 4.202667       10.21226 
1 1 1 -12 6  4  o 233.3000 3.798053 663.3899       21.59294 668.2693       42.81734 661.7257       25.00554 233.9311 7.520737 232.9948 4.404067 0.9362640      8.715347 
1 1 1 -12 6  5  o 136.0480 2.516671 225.5535       8.343628 234.3532       13.70338 220.3693       10.51805 138.6020 4.061541 134.4698 3.209775 4.132263       5.176753 
1 1 1 -12 6  6  o 212.8771 3.572755 552.3115       18.53396 560.0580       26.76791 545.1777       25.68743 214.3335 5.124935 211.4703 4.984657 2.863251       7.149249 
1 1 1 -12 6  7  o 214.0212 3.585362 558.2686       18.69932 552.6506       26.70782 563.6707       26.18947 212.9095 5.147629 215.0254 4.998053 -2.115860      7.174860 
1 1 1 -12 6  8  o 282.0471 4.407546 969.7097       30.29386 964.2692       43.05147 975.0455       42.63554 281.1906 6.282769 282.7613 6.187506 -1.570709      8.818073 
1 1 1 -12 6  9  f 463.7986 7.863082 2624.832       88.87065 2671.343       156.6039 2602.738       107.9336 466.9824 13.77657 461.6774 9.593608 5.304962       16.78783 
1 1 1 -12 6  10 o 66.09914 2.641851 53.32937       4.246826 54.89789       6.726964 52.28997       5.476049 66.98137 4.141506 65.40931 3.447689 1.572060       5.388750 
1 1 1 -12 6  11 o 429.8333 7.327183 2254.410       76.74908 2279.949       134.6078 2242.108       93.42234 431.4332 12.81748 428.5073 8.946567 2.925873       15.63102 
1 1 1 -12 6  12 o 112.3634 2.993565 153.9846       8.189597 153.5018       15.04378 154.1880       9.763049 112.0557 5.526226 112.4147 3.568427 -0.3589249     6.578210 
1 1 1 -12 6  13 o 124.5232 3.097145 188.9912       9.398268 178.8966       16.93843 193.4812       11.29666 120.9690 5.762532 125.9317 3.685073 -4.962715      6.840068 
1 1 1 -12 6  14 o 138.9536 2.827632 235.3270       9.574782 226.2679       13.76048 243.8298       13.33130 136.1669 4.151772 141.3708 3.873343 -5.203918      5.678028 
1 1 1 -12 6  15 o 297.3099 4.613037 1077.964       33.42199 1107.970       48.43421 1050.689       46.17813 301.2819 6.596950 293.4014 6.458595 7.880463       9.232183 
1 1 1 -12 6  16 o 485.0421 8.226495 2875.615       97.23672 2969.097       121.8648 2711.816       161.3135 492.4582 10.15483 469.3875 14.11878 23.07074       17.39139 
1 1 1 -12 6  17 o 189.4730 3.863112 437.7678       17.83695 435.7038       22.07539 441.6497       30.27419 188.9245 4.798833 190.0589 6.546319 -1.134308      8.116840 
1 1 1 -12 6  18 o 263.6100 4.202855 847.6041       26.99867 870.1736       39.13231 827.1013       37.29751 266.9474 6.015527 260.2694 5.880586 6.678009       8.412363 
1 1 1 -12 6  19 o 197.8914 3.982404 477.6826       19.20474 489.2071       24.07354 457.5106       31.84948 200.2053 4.934332 193.3493 6.770089 6.855988       8.377454 
1 1 1 -12 6  20 o 111.8709 2.692427 152.5776       7.340019 156.1070       10.79368 149.5414       10.01115 113.0529 3.923831 110.6611 3.717661 2.391869       5.405317 
1 1 1 -12 6  21 o 258.0138 4.152466 812.3890       26.10870 792.4958       36.70947 832.7524       37.14085 254.6326 5.915998 261.0304 5.838815 -6.397827      8.312087 
1 1 1 -12 6  22 o 258.1460 4.822869 813.8430       30.33940 866.6407       38.72538 729.9320       48.81995 266.2246 5.969135 243.8029 8.228964 22.42168       10.16594 
1 1 1 -12 6  23 o 201.8767 4.004923 497.4310       19.70228 462.3430       32.86015 517.1249       24.61815 194.1644 6.956105 205.7444 4.910113 -11.57994      8.514494 
1 1 1 -12 6  24 o 248.2610 4.060175 752.4338       24.56346 759.7504       35.31349 745.5756       34.18970 249.2106 5.814843 246.8970 5.682551 2.313629       8.130424 
1 1 1 -12 6  25 o 234.7451 3.912546 672.7707       22.38165 688.7777       32.41966 658.1941       30.93722 237.2720 5.606940 231.9668 5.472924 5.305176       7.835220 
1 1 1 -12 6  26 o 62.10691 2.958547 47.16439       4.464821 48.92900       6.594749 45.67108       6.066675 63.13897 4.312004 61.01245 4.104216 2.126514       5.952980 
1 1 1 -12 6  27 o 104.1453 2.784236 132.4122       7.059793 132.2242       10.21527 132.5842       9.767864 103.9599 4.039941 104.1204 3.856372 -0.1604385     5.585045 
1 1 1 -12 6  28 o 107.9411 4.233792 142.6251       11.11499 130.7701       16.46564 152.5496       15.06546 103.0019 6.594542 111.4557 5.564418 -8.453773      8.628484 
1 1 1 -12 6  29 o 219.1879 4.374313 587.5278       23.36482 589.5490       28.83337 583.6622       39.87441 219.3561 5.393981 217.5603 7.532411 1.795776       9.264569 
1 1 1 -12 6  30 o 135.7130 3.020861 224.8450       9.990526 227.6090       14.36832 222.2580       13.90076 136.3389 4.330133 134.7390 4.238866 1.599869       6.059541 
1 1 1 -12 6  31 o 176.7779 3.362632 381.7698       14.48583 397.0856       21.14040 368.2137       19.88894 179.9760 4.824524 173.3290 4.713110 6.646957       6.744586 
1 1 1 -12 6  32 f 41.85013 4.114748 21.63808       4.142188 18.36341       5.702828 25.29494       6.026434 38.12552 6.362224 45.04042 5.612031 -6.914902      8.483677 
1 1 1 -12 6  33 o 78.08098 3.036839 74.59935       5.767323 69.13137       7.995220 80.53109       8.327369 74.98294 4.394809 80.97348 4.234879 -5.990540      6.103159 
1 1 1 -12 6  34 o 19.75196 6.646798 4.523414       3.783355 11.38949       5.623222 -1.155230      5.113912 29.73058 7.700618 15.81163 6.932469 13.91895       10.36140 
1 1 1 -12 6  35 o 114.0214 3.433711 159.2931       9.529961 158.7592       11.82285 160.2835       16.10254 113.6564 4.276289 113.7858 5.826649 -0.1293564     7.227481 
1 1 1 -12 6  36 o 55.67836 3.455387 38.13058       4.665237 39.99238       6.590571 36.26078       6.604736 56.78339 4.807987 53.99315 5.079401 2.790237       6.994073 
1 1 1 -12 6  37 o 49.22239 3.622578 29.90596       4.314827 23.09519       5.921892 37.61373       6.299799 42.74010 5.838216 55.00113 4.746629 -12.26102      7.524311 
1 1 1 -12 6  38 o 14.11312 6.108100 -0.3472905     3.862345 1.624213       4.583323 -5.177252      7.173871 17.13854 6.979086 16.48923 7.617819 0.6493015      10.33145 
1 1 1 -12 6  39 o 42.22111 5.118212 22.55374       5.158641 12.41540       10.41400 25.85039       5.938416 31.21643 11.00557 45.11348 5.516288 -13.89705      12.31065 
1 1 1 -12 6  40 o 33.04126 5.408766 14.08764       4.204482 12.16633       5.145665 17.94713       7.293027 30.13252 7.121134 36.21960 8.422619 -6.087074      11.02955 
1 1 1 -12 6  41 o 44.38086 3.840643 24.71445       4.112866 23.12406       5.671151 26.47898       5.973567 42.21843 5.654338 45.27613 5.528664 -3.057701      7.908076 
1 1 1 -12 6  42 o 19.74608 6.348987 5.098622       3.466726 6.531855       4.851140 3.602808       4.955921 22.25217 7.526557 18.99814 7.412727 3.254034       10.56398 
1 1 1 -12 6  43 o 14.81616 5.994553 1.668869       3.356138 0.8863772      4.535903 2.615485       4.988972 15.70866 6.705914 17.79619 7.268361 -2.087527      9.889305 
1 1 1 -12 6  44 o 17.57540 6.455726 3.837742       3.626479 1.882510       5.220730 5.660822       5.041213 17.08095 7.239386 20.55908 7.601064 -3.478130      10.49690 
1 1 1 -12 6  45 o 16.92990 6.540766 3.422890       3.829337 2.821722       5.270317 4.095187       5.573383 17.53821 7.344081 18.85794 7.689739 -1.319723      10.63333 
1 1 1 -12 6  46 o 13.54931 5.877302 0.6519639      3.592317 -4.274559      5.170911 5.247704       4.994299 12.68681 6.046374 19.26488 7.462447 -6.578073      9.604517 
1 1 1 -12 6  47 o 15.80502 6.754005 2.269002       4.609705 -0.3304992     5.862974 6.477570       7.460022 15.18924 6.969658 20.31743 8.634151 -5.128192      11.09616 
1 1 1 -12 6  48 o 14.32256 6.335880 1.172309       4.361376 -3.855743      7.430004 3.815558       5.387139 14.58099 7.027135 17.08546 7.301277 -2.504473      10.13357 
1 1 1 -12 6  49 o 18.13682 6.746321 5.601871       3.982235 11.95273       6.078017 0.8251377      5.271222 23.78814 8.405972 14.54276 6.648815 9.245378       10.71761 
1 1 1 -12 6  50 o 11.42708 5.361164 -1.411946      3.776212 -1.415760      5.419859 -1.408347      5.264279 13.20747 6.264556 13.07083 6.192186 0.1366453      8.808395 
1 1 1 -12 7  1  o 540.5672 7.049501 3564.634       92.86331 3464.968       143.9780 3635.630       121.5175 532.4957 11.09542 545.7063 9.137843 -13.21063      14.37389 
1 1 1 -12 7  2  o 385.1553 5.163990 1808.611       48.46825 1781.378       75.97875 1827.298       62.93727 382.0685 8.160463 387.0602 6.672574 -4.991669      10.54118 
1 1 1 -12 7  3  o 207.8057 4.099326 526.3654       20.75897 530.6974       35.13625 524.0424       25.72976 208.4704 6.925933 207.3250 5.092698 1.145340       8.596750 
1 1 1 -12 7  4  o 120.9086 2.455577 178.1475       7.235138 182.9925       11.88929 175.2981       9.117763 122.4631 3.989280 119.8920 3.123431 2.571060       5.066575 
1 1 1 -12 7  5  f 246.9408 3.577257 743.2220       21.52678 722.5279       33.75396 757.4095       27.94819 243.4243 5.690162 249.2628 4.601083 -5.838501      7.317644 
1 1 1 -12 7  6  o 491.7399 6.439309 2949.126       77.16330 2932.178       121.7360 2960.509       99.76509 489.9713 10.19559 492.5308 8.312069 -2.559540      13.15449 
1 1 1 -12 7  7  o 245.7161 3.975075 735.9284       23.80209 740.6451       34.22856 731.5119       33.12123 246.4537 5.699243 244.9343 5.549076 1.519379       7.954472 
1 1 1 -12 7  8  o 253.5855 4.066478 783.8463       25.12922 809.0726       36.64974 761.4642       34.52180 257.5783 5.838825 249.8911 5.669002 7.687241       8.138147 
1 1 1 -12 7  9  o 434.0352 6.421109 2297.816       67.91585 2125.562       91.55731 2508.557       101.2706 417.2368 9.004806 453.2535 9.168661 -36.01669      12.85110 
1 1 1 -12 7  10 o 169.2532 3.583275 349.1658       14.77927 356.9524       27.08928 345.8658       17.63508 170.9375 6.515081 168.3837 4.301273 2.553787       7.806870 
1 1 1 -12 7  11 o 148.7580 4.009684 269.9517       14.52213 0.000000       0.000000 269.9517       14.52213 ?        ?        148.7580 4.009684 0.000000       4.009684 
1 1 1 -12 7  12 f 59.22711 3.084887 42.87015       4.437070 48.18806       9.155080 41.23753       5.072651 62.55687 6.082216 58.05224 3.603515 4.504627       7.069560 
1 1 1 -12 7  13 o 87.47258 2.603904 93.33377       5.544332 91.53801       8.387256 94.72752       7.389009 86.55976 3.986903 88.08690 3.448886 -1.527138      5.271642 
1 1 1 -12 7  14 o 368.7898 5.551837 1659.188       49.89439 1633.319       70.18229 1685.622       70.94658 365.6773 7.875778 371.4906 7.836958 -5.813324      11.11062 
1 1 1 -12 7  15 o 170.0486 3.133590 352.4866       12.98528 375.2963       19.39487 333.9550       17.48169 175.3633 4.542322 165.4281 4.340238 9.935242       6.282544 
1 1 1 -12 7  16 o 129.2744 3.242596 203.8610       10.20701 210.8754       13.03446 192.7403       16.41204 131.4378 4.074379 125.5658 5.376024 5.872009       6.745532 
1 1 1 -12 7  17 f 256.3491 4.119303 801.4756       25.73307 841.6178       37.87152 767.0460       35.07345 262.5551 5.919107 250.6683 5.741734 11.88686       8.246414 
1 1 1 -12 7  18 o 389.9829 5.844196 1857.219       55.54008 1859.090       78.97283 1855.388       78.12510 389.7362 8.315166 389.3651 8.233747 0.3711243      11.70199 
1 1 1 -12 7  19 o 167.4226 3.130938 341.7838       12.77393 340.3185       18.40975 343.1443       17.73904 166.9355 4.529651 167.6427 4.345860 -0.7071533     6.277279 
1 1 1 -12 7  20 o 104.8505 3.115239 134.1791       7.950900 131.2339       10.00587 139.2247       13.09646 103.6370 3.969241 106.6609 5.053002 -3.023842      6.425551 
1 1 1 -12 7  21 o 211.4306 3.623299 545.3530       18.66844 531.9113       26.34366 558.9126       26.45904 208.6744 5.180492 213.9160 5.075685 -5.241669      7.252591 
1 1 1 -12 7  22 o 157.5740 3.576971 302.9349       13.73524 300.1190       16.94690 308.3260       23.44868 156.7213 4.441855 158.6576 6.076100 -1.936264      7.526557 
1 1 1 -12 7  23 o 92.48794 2.988879 104.4389       6.727581 100.4954       11.50415 106.4884       8.293568 90.52879 5.237086 93.34548 3.653013 -2.816696      6.385262 
1 1 1 -12 7  24 o 68.30904 2.822692 57.00620       4.688577 57.24784       6.943701 56.80371       6.356448 68.34467 4.189305 68.10953 3.845370 0.2351456      5.686576 
1 1 1 -12 7  25 o 212.2127 3.659624 549.7150       18.92535 570.4686       27.70218 531.5516       25.91599 215.9722 5.263566 208.4991 5.100672 7.473068       7.329528 
1 1 1 -12 7  26 o 37.83747 3.827655 17.65964       3.480834 15.78757       5.118424 19.27038       4.747736 35.39420 6.157787 39.37381 5.065369 -3.979610      7.973475 
1 1 1 -12 7  27 o 77.65216 3.399480 73.75000       6.417243 75.93468       12.89384 73.03066       7.398675 78.35581 6.820556 77.22091 3.944794 1.134903       7.879174 
1 1 1 -12 7  28 o 204.7011 4.192090 512.1710       20.91158 521.7921       26.13155 495.0380       34.87143 206.3755 5.200164 200.5238 7.147645 5.851746       8.839148 
1 1 1 -12 7  29 o 169.8312 3.272993 352.1746       13.54561 369.7122       19.89883 337.0303       18.49130 173.7505 4.703975 165.9099 4.577983 7.840576       6.563940 
1 1 1 -12 7  30 o 83.61270 2.905995 85.44003       5.912109 89.31728       8.741574 82.17145       8.026136 85.35172 4.215871 81.87975 4.034907 3.471977       5.835585 
1 1 1 -12 7  31 o 94.15879 2.917432 108.3492       6.686108 105.0219       9.575119 111.5153       9.340418 92.54324 4.257243 95.39850 4.026860 -2.855263      5.860010 
1 1 1 -12 7  32 o 179.2110 3.410960 392.5447       14.89627 409.0069       21.78728 378.0941       20.41284 182.5635 4.901692 175.5557 4.775910 7.007843       6.843676 
1 1 1 -12 7  33 o 88.36864 2.990915 95.51587       6.431497 95.06210       9.201079 95.94939       8.993493 87.97731 4.304795 88.40685 4.186412 -0.4295349     6.004774 
1 1 1 -12 7  34 o 102.5931 3.937181 129.1185       9.825010 136.0635       13.80097 121.9815       13.99029 105.0093 5.411443 99.31630 5.805883 5.692970       7.936749 
1 1 1 -12 7  35 o 122.5299 3.070381 183.7594       9.160693 202.2554       13.52650 168.0886       12.45062 128.2702 4.333589 116.9110 4.377914 11.35915       6.160043 
1 1 1 -12 7  36 o 27.43313 5.857009 9.669564       3.796346 6.513070       5.124691 13.50849       5.651586 23.29309 7.733971 32.25010 7.354774 -8.957014      10.67272 
1 1 1 -12 7  37 o 29.62987 5.149213 11.17039       3.583109 13.07145       5.012917 9.184571       5.123455 31.75453 6.689640 26.62337 7.550546 5.131161       10.08772 
1 1 1 -12 7  38 o 18.07890 6.747773 3.233608       3.990574 1.958115       4.662418 6.727537       7.716655 17.55960 7.079418 25.14819 9.383929 -7.588587      11.75484 
1 1 1 -12 7  39 o 30.46587 7.605622 12.39821       5.628731 11.33302       9.424306 12.98888       7.017930 29.86269 10.47433 31.00874 8.851101 -1.146046      13.71326 
1 1 1 -12 7  40 o 60.14240 3.390464 44.85288       4.948958 40.68213       6.812124 49.51456       7.201896 56.69632 4.981088 62.68889 4.749674 -5.992573      6.882633 
1 1 1 -12 7  41 o 45.02898 3.911317 25.49271       4.249384 28.85251       5.989622 22.08786       6.029651 47.35083 5.280582 40.92671 6.243068 6.424114       8.176824 
1 1 1 -12 7  42 o 29.69364 5.250505 11.63338       3.660322 6.724617       5.036023 17.13069       5.329380 22.49095 7.667864 35.61234 6.375116 -13.12138      9.971873 
1 1 1 -12 7  43 o 15.21472 6.281754 1.514605       3.778765 7.704561       5.912581 -2.759512      4.913110 23.47413 8.291163 13.65860 6.308016 9.815531       10.41799 
1 1 1 -12 7  44 o 44.15281 4.230894 25.36725       4.496623 27.24397       6.381673 23.51676       6.336933 44.36907 6.060503 40.74102 6.609058 3.628056       8.967125 
1 1 1 -12 7  45 o 13.43965 5.870932 0.2920230      3.638127 -2.206458      4.939797 3.253772       5.378303 13.58628 6.292351 17.93150 7.456918 -4.345226      9.757013 
1 1 1 -12 7  46 o 10.40497 5.016573 -4.516632      3.795715 -5.251822      5.591096 -3.888122      5.169556 12.78745 6.145629 12.82640 6.093740 -0.3894901E-01 8.654618 
1 1 1 -12 7  47 o 14.25229 6.294629 0.8120801      4.288089 -0.9898744     5.243197 4.451797       7.451746 14.12747 6.521681 18.90432 8.325636 -4.776843      10.57585 
1 1 1 -12 7  48 o 11.89174 5.606577 -2.220408      4.220021 11.00875       8.446683 -6.620891      4.871585 22.09661 9.278058 10.85942 5.333251 11.23719       10.70168 
1 1 1 -12 7  49 o 10.51815 5.048353 -3.202362      3.744651 8.236452       5.743197 -11.66142      4.938831 20.24051 7.955437 9.364690 4.716605 10.87582       9.248531 
1 1 1 -12 8  1  o 98.36671 2.864597 118.0217       6.859382 122.3896       9.526532 113.3191       9.884638 100.1275 3.911847 96.32372 4.221311 3.803749       5.755173 
1 1 1 -12 8  2  o 267.4098 4.244175 871.6795       27.65710 852.8917       53.84660 878.4121       32.23389 264.2077 8.373856 268.4193 4.927910 -4.211609      9.716263 
1 1 1 -12 8  3  o 180.0435 3.329720 395.0753       14.60902 392.1492       20.48317 398.1047       20.84206 179.2900 4.692221 180.6450 4.738641 -1.355057      6.668707 
1 1 1 -12 8  4  o 546.1073 7.967144 3639.489       106.0271 3627.685       149.5770 3651.410       150.3156 544.7961 11.26664 546.5718 11.28550 -1.775757      15.94678 
1 1 1 -12 8  5  o 139.5988 2.588673 237.4879       8.806328 233.7409       14.22651 239.8155       11.21276 138.4097 4.222832 140.2741 3.280190 -1.864395      5.347145 
1 1 1 -12 8  6  o 67.34199 2.679527 55.35323       4.388461 52.84326       6.783453 57.15982       5.755025 65.70271 4.259696 68.39448 3.464230 -2.691765      5.490528 
1 1 1 -12 8  7  o 182.8551 3.793928 407.5506       16.90566 372.1784       29.52117 424.8111       20.62191 174.5252 6.955204 186.6722 4.533287 -12.14697      8.302142 
1 1 1 -12 8  8  o 286.8903 4.494398 1003.398       31.42124 1011.099       45.08723 996.1257       43.81287 287.9077 6.426348 285.7745 6.291325 2.133148       8.993259 
1 1 1 -12 8  9  o 66.22946 2.754769 53.54902       4.436325 47.51664       7.054673 57.49496       5.705683 62.25326 4.684644 68.59624 3.424099 -6.342987      5.802616 
1 1 1 -12 8  10 o 370.9848 6.423157 1679.025       58.06853 1714.436       102.6223 1662.347       70.42789 374.2277 11.26587 369.0264 7.831612 5.201355       13.72057 
1 1 1 -12 8  11 o 222.1174 5.152978 601.6537       27.89184 0.000000       0.000000 601.6537       27.89184 ?        ?        222.1174 5.152978 0.000000       5.152978 
1 1 1 -12 8  12 o 74.58553 3.018613 67.91507       5.475200 89.54007       11.46689 61.52891       6.231426 85.49979 5.533286 70.95341 3.615867 14.54639       6.609973 
1 1 1 -12 8  13 o 69.64748 2.702514 59.20994       4.578092 67.84455       7.317235 53.65575       5.868619 74.48623 4.046399 66.24213 3.649615 8.244102       5.449132 
1 1 1 -12 8  14 o 191.9696 3.378006 449.2503       15.80262 431.6949       22.40527 466.6282       22.29171 188.0663 4.892965 195.6024 4.676631 -7.536087      6.768456 
1 1 1 -12 8  15 o 61.23600 2.792721 45.80225       4.156481 50.85609       6.683190 42.61436       5.307914 64.43481 4.280520 59.00294 3.710382 5.431870       5.664785 
1 1 1 -12 8  16 o 329.0143 5.831967 1321.443       46.75908 1354.397       58.45715 1262.902       77.91214 332.9279 7.205288 320.9149 9.974859 12.01297       12.30504 
1 1 1 -12 8  17 o 169.9880 3.167000 352.3007       13.11905 365.4007       19.38496 341.2305       17.81995 172.9986 4.602270 167.1914 4.377543 5.807251       6.351675 
1 1 1 -12 8  18 o 197.2963 3.447094 474.6895       16.57327 493.0190       24.35556 458.8833       22.61716 200.9779 4.972945 193.9080 4.786370 7.069962       6.902138 
1 1 1 -12 8  19 o 137.0307 2.875412 228.9440       9.601829 224.6783       13.89778 232.8396       13.28126 135.6317 4.209925 138.0947 3.950687 -2.463028      5.773335 
1 1 1 -12 8  20 o 179.7733 3.275693 394.1615       14.35042 403.2704       20.93422 386.0867       19.71016 181.6826 4.732355 177.7848 4.553202 3.897751       6.567102 
1 1 1 -12 8  21 o 73.84213 3.311208 66.64282       5.943204 64.53158       7.366272 70.58007       10.05947 72.59280 4.181768 75.80073 5.482907 -3.207924      6.895611 
1 1 1 -12 8  22 o 173.3661 3.247083 366.6270       13.71809 357.3320       19.51707 375.7029       19.28562 170.9859 4.688438 175.3486 4.517072 -4.362640      6.510407 
1 1 1 -12 8  23 o 129.2620 3.214968 203.8306       10.12706 213.0544       17.97266 199.5396       12.25835 131.8753 5.605372 127.7952 3.940947 4.080063       6.852099 
1 1 1 -12 8  24 o 166.8759 3.201042 339.7505       13.01731 319.6826       18.30445 360.2847       18.51588 161.6892 4.650407 171.6858 4.429317 -9.996628      6.422237 
1 1 1 -12 8  25 o 31.97326 4.499770 12.73500       3.409148 9.822821       4.994369 15.27574       4.664994 27.78687 7.287188 34.88556 5.682871 -7.098686      9.241111 
1 1 1 -12 8  26 o 128.5048 2.900211 201.4677       9.082074 187.3505       12.91093 215.2959       12.77809 123.7526 4.287694 132.7096 3.955599 -8.957077      5.833616 
1 1 1 -12 8  27 o 199.4476 4.136800 486.0916       20.10617 549.8872       39.07150 463.1126       23.44932 211.2767 7.601172 194.4927 4.951583 16.78401       9.071714 
1 1 1 -12 8  28 o 159.0740 3.687192 309.0970       14.29325 311.1453       17.88773 305.4794       23.77216 159.4220 4.609215 157.6606 6.199502 1.761475       7.725198 
1 1 1 -12 8  29 o 214.8695 3.741480 564.1427       19.59090 578.0287       28.48076 551.6717       26.99069 217.1690 5.381678 212.1968 5.219621 4.972198       7.497126 
1 1 1 -12 8  30 o 103.5385 2.900430 130.9655       7.310926 137.3239       10.81977 125.6234       9.917480 105.8730 4.202036 101.2781 4.026393 4.594986       5.819704 
1 1 1 -12 8  31 o 92.07841 2.938902 103.6297       6.586012 97.02775       9.508466 109.7180       9.131049 88.91759 4.401887 94.62766 3.968548 -5.710068      5.926717 
1 1 1 -12 8  32 o 55.98984 3.450672 38.46724       4.685262 44.28505       6.869806 33.40790       6.406364 59.91570 4.743774 51.92554 5.129792 7.990162       6.987000 
1 1 1 -12 8  33 o 85.20256 3.034178 88.81980       6.289788 82.60131       8.843854 95.18454       8.947253 81.96421 4.444356 88.04630 4.182016 -6.082092      6.102586 
1 1 1 -12 8  34 o 63.65203 4.351262 49.93455       6.708785 56.64238       9.011945 41.59634       10.04764 67.58909 5.519513 57.42680 7.347941 10.16229       9.190063 
1 1 1 -12 8  35 o 63.08027 3.285886 48.84033       5.033642 46.82491       7.132650 50.83999       7.104721 61.50495 4.796789 64.14633 4.575089 -2.641384      6.628772 
1 1 1 -12 8  36 o 81.96743 3.071523 82.38402       6.124382 81.02804       8.634122 83.75713       8.688501 81.02250 4.389359 82.39051 4.342781 -1.368011      6.174643 
1 1 1 -12 8  37 o 33.05540 4.929830 13.80639       3.849857 17.54060       5.425206 10.01851       5.464041 37.00436 6.237855 27.71873 7.775444 9.285633       9.968369 
1 1 1 -12 8  38 o 17.92312 7.154161 2.277524       4.711864 2.277524       4.711864 0.000000       0.000000 17.92312 7.154161 ?        ?        0.000000       7.154161 
1 1 1 -12 8  39 o 71.07375 3.759780 62.63169       6.488735 70.27834       12.57682 59.85799       7.574705 73.73659 7.086400 69.21336 4.515621 4.523224       8.402850 
1 1 1 -12 8  40 o 75.71958 3.121756 70.88975       5.747923 74.72665       8.268781 67.30211       7.995677 77.19177 4.414166 73.20168 4.504081 3.990089       6.306473 
1 1 1 -12 8  41 o 24.21663 6.062506 7.875308       3.569127 7.903968       4.896572 7.842821       5.213322 24.16984 7.517421 24.14917 7.787708 0.2066994E-01  10.82405 
1 1 1 -12 8  42 o 20.45310 6.308018 5.615756       3.456137 8.619073       4.708790 2.108239       5.088721 24.82037 7.299890 17.60409 7.281037 7.216274       10.31028 
1 1 1 -12 8  43 o 16.45293 6.482155 2.649617       3.820943 2.693922       5.770863 2.615032       5.098622 18.52028 7.714833 17.78778 7.315601 0.7325020      10.63187 
1 1 1 -12 8  44 o 29.75508 5.760931 12.33406       4.026274 17.17073       5.568935 7.037078       5.827912 34.38190 6.886973 22.07866 8.170885 12.30325       10.68615 
1 1 1 -12 8  45 o 15.16980 6.521204 1.241660       4.344840 -3.743561      7.647915 3.617377       5.279565 15.94013 7.525116 18.10855 7.445560 -2.168426      10.58602 
1 1 1 -12 8  46 o 15.04889 6.352644 1.829011       3.993586 -3.835122      5.539398 7.959203       5.762791 13.28754 6.311421 21.95064 8.124815 -8.663100      10.28818 
1 1 1 -12 8  47 o 23.53671 6.730777 8.960285       4.054628 10.29300       5.916186 7.779873       5.567873 23.58818 8.296927 21.09951 7.950552 2.488676       11.49131 
1 1 1 -12 8  48 o 13.51265 6.104327 0.3383297      4.281275 2.031287       7.517665 -0.4742918     5.208398 16.81931 7.780153 13.94879 6.460564 2.870522       10.11285 
1 1 1 -12 8  49 o 12.79878 5.801401 0.2457200      3.905972 -1.627565      5.882928 1.722553       5.223448 13.68601 6.501694 14.94755 6.748515 -1.261547      9.370938 
1 1 1 -12 9  1  o 185.7428 3.303051 420.4995       14.95077 424.2949       29.18139 419.1487       17.40924 186.3875 6.434351 185.4338 3.852607 0.9536896      7.499564 
1 1 1 -12 9  2  o 482.7195 6.349143 2842.386       74.68716 2777.550       116.5357 2887.581       97.29600 476.7825 10.03004 486.3588 8.209224 -9.576355      12.96121 
1 1 1 -12 9  3  o 184.3031 2.993848 413.9790       13.44617 394.4366       21.10204 427.3375       17.44669 179.8008 4.820463 187.2386 3.823680 -7.437836      6.152836 
1 1 1 -12 9  4  o 541.4820 7.913626 3578.626       104.4229 3575.649       147.5332 3581.614       147.8197 540.7947 11.19492 541.2435 11.20737 -0.4487915     15.84081 
1 1 1 -12 9  5  o 326.3393 4.485443 1298.330       35.67064 1301.631       56.77160 1296.177       45.85171 326.6158 7.132764 326.0095 5.771507 0.6063232      9.175327 
1 1 1 -12 9  6  o 283.5233 4.462337 979.9981       30.83097 952.5809       43.32331 1008.131       43.88526 279.4488 6.361849 287.4864 6.264195 -8.037628      8.928228 
1 1 1 -12 9  7  o 353.0162 4.793900 1519.436       41.24010 1578.798       67.15295 1483.492       52.25484 359.6614 7.661877 348.7414 6.148751 10.91998       9.824026 
1 1 1 -12 9  8  o 526.2084 8.857536 3381.767       113.5813 3266.653       192.5472 3443.200       140.6606 515.7422 15.33738 530.6497 10.87748 -14.90747      18.80305 
1 1 1 -12 9  9  o 396.5669 6.822649 1919.021       65.93340 1890.036       113.6908 1933.710       80.93346 392.7935 11.89119 397.9361 8.346005 -5.142609      14.52777 
1 1 1 -12 9  10 o 155.3775 3.427709 294.2764       12.97861 294.3509       23.33238 294.2431       15.61777 155.2051 6.181396 155.2999 4.130450 -0.9484863E-01 7.434398 
1 1 1 -12 9  11 o 649.6941 10.84753 5165.267       171.7417 5194.878       299.5978 5150.773       209.5979 648.4236 18.98066 648.0911 13.27134 0.3325806      23.16018 
1 1 1 -12 9  12 o 251.2800 4.068166 769.8578       24.91109 793.9226       36.39970 748.6566       34.16553 255.0864 5.855640 247.7189 5.659693 7.367477       8.143749 
1 1 1 -12 9  13 o 241.5800 4.545535 711.7441       26.75975 668.3430       45.66687 734.4396       33.02338 233.7363 8.029422 245.3482 5.523350 -11.61186      9.745717 
1 1 1 -12 9  14 o 166.3408 3.136745 337.2963       12.71493 342.1468       18.65896 333.0913       17.37309 167.4249 4.577611 165.2090 4.318967 2.215973       6.293489 
1 1 1 -12 9  15 o 345.4259 5.262252 1456.022       44.29581 1456.872       63.13771 1455.199       62.16119 345.2591 7.504256 345.0764 7.392102 0.1826477      10.53361 
1 1 1 -12 9  16 o 98.76566 3.149570 119.0474       7.570732 120.4140       9.880532 117.1043       11.78196 99.27669 4.092883 97.83756 4.957853 1.439125       6.428997 
1 1 1 -12 9  17 o 289.5833 4.554489 1023.224       32.14025 979.7042       44.73381 1069.660       46.20842 283.1517 6.483067 295.8754 6.408791 -12.72369      9.116072 
1 1 1 -12 9  18 o 105.0518 2.707907 134.6317       6.926460 147.2462       10.63422 125.3369       9.128311 109.7916 3.981256 101.3018 3.703981 8.489761       5.437819 
1 1 1 -12 9  19 o 301.4082 4.711630 1109.040       34.60687 1104.755       49.30021 1113.203       48.59053 300.5263 6.731783 301.6944 6.609191 -1.168060      9.433892 
1 1 1 -12 9  20 o 145.8856 3.507352 259.6205       12.46889 259.4272       15.49994 259.9751       20.99055 145.7191 4.369870 145.7083 5.923928 0.1075745E-01  7.361297 
1 1 1 -12 9  21 o 114.0316 3.288375 158.7460       9.128280 167.9508       11.60972 143.8413       14.77322 117.2345 4.069953 108.3314 5.615252 8.903099       6.935098 
1 1 1 -12 9  22 o 238.3291 3.952712 693.2943       22.95665 698.4318       33.07898 688.5209       31.88512 238.9890 5.679868 237.3118 5.513566 1.677124       7.915826 
1 1 1 -12 9  23 o 148.7418 4.154592 270.3425       15.04430 265.3665       21.41321 275.1929       21.14109 147.1389 5.984465 149.8695 5.799605 -2.730606      8.333621 
1 1 1 -12 9  24 o 177.2466 3.308084 383.3529       14.28863 375.6667       20.43320 390.7083       19.98849 175.2553 4.788907 178.7591 4.592355 -3.503799      6.635009 
1 1 1 -12 9  25 o 237.4571 3.969060 688.6173       22.96725 700.4710       33.25007 677.8007       31.76218 239.1988 5.704236 235.3282 5.538602 3.870636       7.950750 
1 1 1 -12 9  26 f 135.6112 2.996137 224.4012       9.901322 234.6884       14.80412 216.0749       13.31856 138.5009 4.391807 132.9231 4.116657 5.577835       6.019537 
1 1 1 -12 9  27 o 40.48906 5.645382 20.46691       5.418901 23.64785       10.48026 19.30617       6.330859 42.82763 10.19031 39.07900 6.900093 3.748627       12.30665 
1 1 1 -12 9  28 o 119.2891 2.904569 173.6644       8.443422 176.2136       12.46844 171.5053       11.47494 119.9734 4.271542 118.3946 3.982915 1.578819       5.840349 
1 1 1 -12 9  29 f 120.2357 2.935657 176.4646       8.601514 178.4122       12.66728 174.7982       11.71698 120.6952 4.313761 119.5043 4.029189 1.190903       5.902787 
1 1 1 -12 9  30 o 43.22175 3.946019 23.03182       4.110417 30.19761       6.107057 17.09721       5.557714 49.36925 5.151938 36.76237 6.438264 12.60688       8.245831 
1 1 1 -12 9  31 o 120.7407 2.999604 178.0400       8.825793 170.9831       12.57792 184.8846       12.38737 118.0897 4.378377 122.8420 4.143986 -4.752289      6.028500 
1 1 1 -12 9  32 f 90.90180 2.995885 101.0549       6.627352 117.0750       9.843630 87.77274       8.963112 97.69147 4.144292 84.52816 4.366119 13.16331       6.019813 
1 1 1 -12 9  33 f 120.2727 3.357895 177.0391       9.832069 182.7254       16.73775 174.0433       12.14911 121.6988 5.659334 119.1022 4.192435 2.596596       7.043051 
1 1 1 -12 9  34 o 36.80920 5.533444 17.06156       4.810055 14.09633       5.816902 23.47343       8.553732 33.03592 7.408658 42.58814 8.539474 -9.552219      11.30534 
1 1 1 -12 9  35 o 47.73257 3.915357 28.13978       4.514312 26.38220       6.317750 29.97331       6.452796 45.83622 5.784688 48.96423 5.503107 -3.128006      7.984159 
1 1 1 -12 9  36 f 81.22215 3.108294 80.93439       6.140877 88.87160       8.782183 73.34071       8.590030 84.86829 4.260021 76.99440 4.599210 7.873894       6.269012 
1 1 1 -12 9  37 o 19.24915 7.356803 3.377995       4.808331 3.377995       4.808331 0.000000       0.000000 19.24915 7.356803 ?        ?        0.000000       7.356803 
1 1 1 -12 9  38 o 55.38968 3.598017 37.96712       4.830271 34.71096       6.920119 41.06084       6.745304 52.40765 5.500417 57.25141 4.881321 -4.843765      7.354038 
1 1 1 -12 9  39 o 49.88806 3.794343 30.98613       4.578250 33.21998       6.674016 29.00063       6.292097 51.10848 5.442293 47.69079 5.515624 3.417694       7.748591 
1 1 1 -12 9  40 o 43.31442 4.066762 23.59077       4.242358 27.15586       6.014036 20.05970       5.985269 45.94991 5.478670 38.96671 6.534191 6.983204       8.527102 
1 1 1 -12 9  41 o 52.25753 3.577886 34.19789       4.528801 32.06216       6.377902 36.36988       6.431823 49.77813 5.341226 53.22241 5.018347 -3.444283      7.328882 
1 1 1 -12 9  42 f 19.09559 6.440017 4.730541       3.551570 5.858868       4.979118 3.561847       5.067402 21.27670 7.599073 18.87079 7.455577 2.405905       10.64573 
1 1 1 -12 9  43 o 29.06926 5.777024 11.60878       3.948143 6.762389       5.580750 16.46480       5.586290 22.12856 8.026897 33.95592 6.984319 -11.82737      10.64010 
1 1 1 -12 9  44 o 19.32537 7.694351 4.532895       5.436637 9.029840       8.917486 1.872682       6.858702 24.18579 9.776481 18.34608 8.036486 5.839712       12.65562 
1 1 1 -12 9  45 o 18.95987 6.721799 5.134772       3.889133 2.755773       5.640083 7.291369       5.369983 17.59352 7.493100 21.70175 7.873608 -4.108229      10.86923 
1 1 1 -12 9  46 o 21.52901 7.311856 7.457056       4.578656 9.302294       5.754906 4.274481       7.557904 23.24266 8.182422 19.27929 8.440965 3.963369       11.75593 
1 1 1 -12 9  47 o 15.80375 6.511050 2.977105       4.048134 2.418220       5.901798 3.473675       5.563060 16.61277 7.358610 17.15324 7.376493 -0.5404720     10.41930 
1 1 1 -12 9  48 o 38.12679 5.955716 22.51392       5.352636 23.89276       10.22105 21.99288       6.283097 29.17401 10.81639 35.52623 7.493677 -6.352221      13.15863 
1 1 1 -12 9  49 o 18.57045 6.800519 6.128777       4.019386 7.473820       6.026315 5.050963       5.394552 19.23351 7.936153 17.32401 7.351351 1.909492       10.81780 
1 1 1 -12 10 1  o 149.5112 2.741202 272.4329       9.987361 268.2729       16.04129 275.0662       12.76279 148.2693 4.444699 150.2207 3.486420 -1.951370      5.648936 
1 1 1 -12 10 2  o 209.0684 3.237217 532.7542       16.49288 522.6483       26.12473 539.4509       21.26663 206.9576 5.184134 210.3559 4.148660 -3.398300      6.639777 
1 1 1 -12 10 3  o 542.1292 7.082127 3586.650       93.56266 3622.197       149.0864 3563.553       120.1744 544.1648 11.24272 540.1022 9.130613 4.062622       14.48333 
1 1 1 -12 10 4  o 273.2128 4.399113 910.0569       29.28885 904.2048       41.23545 916.0155       41.60843 272.2516 6.215330 274.0231 6.231004 -1.771454      8.800894 
1 1 1 -12 10 5  o 85.31294 2.619807 88.78469       5.440082 80.48127       10.72065 91.66425       6.313289 81.05177 5.459637 86.67174 2.993605 -5.619972      6.226500 
1 1 1 -12 10 6  o 390.1248 6.730646 1857.118       63.98768 1962.732       114.9906 1809.747       77.01248 400.2951 11.80104 384.9818 8.208899 15.31332       14.37534 
1 1 1 -12 10 7  o 84.76783 2.979847 87.68611       6.145894 91.05520       11.30558 86.27284       7.322345 86.23660 5.407000 84.05212 3.583134 2.184471       6.486486 
1 1 1 -12 10 8  o 535.3641 9.007617 3501.960       117.5155 3502.944       204.0705 3501.472       143.7411 533.7055 15.70780 534.9571 11.02620 -1.251587      19.19146 
1 1 1 -12 10 9  o 165.1681 3.647698 332.5583       14.68186 337.3805       18.65083 324.7013       23.80704 166.2738 4.607412 163.0282 6.002729 3.245560       7.567101 
1 1 1 -12 10 10 o 557.5258 8.121503 3797.036       110.3411 3739.444       154.9707 3856.254       157.1438 552.5718 11.50866 561.1401 11.49185 -8.568237      16.26382 
1 1 1 -12 10 11 o 251.8853 4.706569 773.7735       28.88972 769.0224       51.12535 776.0023       35.01620 250.7204 8.379558 252.1934 5.697694 -1.473007      10.13315 
1 1 1 -12 10 12 o 637.1230 9.228340 4965.112       143.2791 4932.737       202.2427 4997.734       203.0141 633.8063 13.09423 637.9820 13.05815 -4.175659      18.49255 
1 1 1 -12 10 13 o 321.0590 5.740530 1258.014       44.91309 1256.907       55.33680 1260.150       76.88359 320.7814 7.078949 320.6740 9.850290 0.1073608      12.13012 
1 1 1 -12 10 14 o 323.9022 5.746216 1280.607       45.35571 1354.068       82.23891 1248.496       54.37244 332.2737 10.16850 319.6788 6.979573 12.59485       12.33340 
1 1 1 -12 10 15 o 93.74750 2.718578 107.2220       6.204097 106.4960       9.446877 107.7727       8.226923 93.34825 4.163323 93.94273 3.600334 -0.5944824     5.504150 
1 1 1 -12 10 16 o 210.3923 4.192333 539.9852       21.49422 542.9030       26.84130 534.7696       35.88671 210.8908 5.222878 209.0286 7.055286 1.862137       8.778128 
1 1 1 -12 10 17 o 251.3318 4.091074 770.6398       25.05653 760.7923       35.69584 780.2051       35.18037 249.5537 5.869721 252.7349 5.712142 -3.181244      8.190372 
1 1 1 -12 10 18 o 155.2055 3.057208 293.7391       11.56294 273.0102       16.35872 314.4363       16.34621 149.4935 4.495569 160.4712 4.183643 -10.97763      6.141091 
1 1 1 -12 10 19 o 381.3074 5.760831 1777.008       53.52991 1760.974       75.69211 1793.051       75.71335 378.9893 8.195729 382.4460 8.123931 -3.456726      11.53985 
1 1 1 -12 10 20 o 172.2846 3.789952 362.1824       15.91169 372.4529       20.00200 344.4810       26.25921 174.5790 4.705886 167.6714 6.438642 6.907578       7.975053 
1 1 1 -12 10 21 o 127.3519 2.866290 197.7895       8.895323 197.7126       13.17506 197.8540       12.05871 127.1883 4.256784 127.2657 3.892820 -0.7743073E-01 5.768385 
1 1 1 -12 10 22 f 214.8692 3.700922 563.4433       19.37850 557.3188       27.79709 569.2343       27.02969 213.4461 5.348319 215.8102 5.139642 -2.364182      7.417576 
1 1 1 -12 10 23 o 104.9308 3.117457 134.4419       7.962656 117.3816       13.39808 143.7584       9.900921 97.79105 5.646222 108.4586 3.751715 -10.66756      6.779026 
1 1 1 -12 10 24 o 31.40352 4.994306 12.35365       3.694141 8.518830       5.004235 16.94596       5.476218 26.04794 7.486621 36.67193 6.358228 -10.62399      9.822248 
1 1 1 -12 10 25 o 98.80947 2.816091 119.2010       6.773890 105.1891       9.689232 132.5968       9.473853 92.68452 4.301621 104.1413 3.739152 -11.45674      5.699580 
1 1 1 -12 10 26 f 157.1276 3.664154 301.4987       14.03014 342.0696       27.70455 287.5050       16.27086 166.7672 6.831638 153.3050 4.359725 13.46211       8.104226 
1 1 1 -12 10 27 o 129.3512 3.419745 204.4437       10.77008 200.5052       13.54143 211.2243       17.76774 127.9866 4.348054 131.1775 5.570917 -3.190865      7.066873 
1 1 1 -12 10 28 o 45.85329 3.601537 25.84142       3.992062 29.49231       6.089887 23.09049       5.286273 48.79516 5.201590 43.12042 5.131253 5.674744       7.306593 
1 1 1 -12 10 29 o 210.0635 3.705144 539.2618       18.96670 561.3312       27.87551 520.2371       25.88130 213.9753 5.345928 205.9741 5.160355 8.001221       7.430223 
1 1 1 -12 10 30 o 51.46423 3.553080 32.52198       4.428663 32.13870       6.495768 32.85488       6.053722 50.91515 5.313482 51.55414 4.876583 -0.6389885     7.212084 
1 1 1 -12 10 31 o 64.97029 3.324606 51.71901       5.246198 54.79616       7.716236 49.07388       7.154100 66.68863 4.779773 63.10640 4.685491 3.582226       6.693285 
1 1 1 -12 10 32 o 54.51489 3.509182 36.49463       4.637076 37.75953       6.717007 35.34291       6.409432 55.23101 5.046339 53.43087 4.979907 1.800144       7.089782 
1 1 1 -12 10 33 o 18.59484 6.797542 3.481306       4.013199 8.583809       6.386308 0.1513843      5.159116 26.57129 8.623594 16.88794 7.178607 9.683352       11.22046 
1 1 1 -12 10 34 o 90.76802 3.500509 101.0377       7.728323 102.1556       9.584817 98.96033       13.06575 91.11472 4.329155 89.26038 6.042362 1.854332       7.433150 
1 1 1 -12 10 35 o 82.16905 3.095367 82.76932       6.186990 83.38827       8.809684 82.16693       8.690975 82.21980 4.413083 81.61996 4.385648 0.5998383      6.221673 
1 1 1 -12 10 36 o 44.81064 4.624107 25.03492       4.977028 24.68348       5.985125 25.82268       8.960746 44.23809 5.683006 44.38250 8.595654 -0.1444092     10.30446 
1 1 1 -12 10 37 f 21.48939 6.873446 5.745919       4.066977 8.290442       5.032028 0.9529416      6.906254 25.32817 7.570933 19.71693 8.340106 5.611242       11.26394 
1 1 1 -12 10 38 o 123.6306 4.315249 189.7633       12.98081 0.000000       0.000000 189.7633       12.98081 ?        ?        123.6306 4.315249 0.000000       4.315249 
1 1 1 -12 10 39 o 52.03185 3.668249 33.68577       4.621381 32.35601       6.753992 34.85646       6.337147 50.30287 5.604838 52.46946 5.017263 -2.166592      7.522443 
1 1 1 -12 10 40 o 31.35295 5.206487 12.76626       3.838483 13.07065       5.518587 12.48098       5.342560 30.90081 7.421984 30.21990 7.330658 0.6809101      10.43189 
1 1 1 -12 10 41 f 28.94589 5.650236 11.15553       3.842471 12.70449       5.527735 9.707286       5.345019 30.10606 7.549193 26.33013 7.786248 3.775934       10.84509 
1 1 1 -12 10 42 o 31.86396 5.902380 13.76603       4.414398 17.31790       7.243543 11.66746       5.567805 34.00946 8.704510 28.33731 7.811796 5.672150       11.69584 
1 1 1 -12 10 43 o 29.65261 6.944843 12.72891       4.929671 8.930272       9.213226 14.25268       5.835234 24.84588 9.974468 30.83265 7.770319 -5.986773      12.64389 
1 1 1 -12 10 44 o 25.91684 6.939785 10.07547       4.470109 14.97548       5.602689 1.492946       7.414896 31.33285 7.447779 18.44738 8.205357 12.88547       11.08139 
1 1 1 -12 10 45 o 18.72048 6.675303 5.026031       3.840599 8.675521       5.510780 1.579431       5.355405 23.08884 8.015391 16.36705 7.136860 6.721796       10.73225 
1 1 1 -12 10 46 o 13.88181 6.222112 0.8857301E-01  4.350619 3.182362       5.610791 -4.576327      6.889693 17.33965 7.431526 14.33141 6.870441 3.008242       10.12080 
1 1 1 -12 10 47 o 34.05945 5.666697 17.30083       4.538123 24.93863       6.629967 10.56778       6.224915 38.85211 7.269776 23.26297 8.471766 15.58914       11.16335 
1 1 1 -12 10 48 o 17.69153 6.966093 5.164708       4.410494 -2.212920      7.729496 8.726476       5.370634 15.03539 7.225968 21.17761 7.842617 -6.142221      10.66402 
1 1 1 -12 10 49 o 19.88323 6.822396 7.168598       3.988091 3.971217       6.066465 9.602135       5.292458 16.62940 7.407736 21.62027 7.820407 -4.990864      10.77188 
1 1 1 -12 11 1  o 214.3748 4.148925 560.3187       21.67432 537.7748       36.56199 572.5338       26.91318 209.7619 7.163163 216.6632 5.097342 -6.901291      8.791689 
1 1 1 -12 11 2  o 732.4536 12.18646 6572.410       217.5173 6517.046       374.5366 6600.588       267.1966 725.0894 21.21945 733.0172 14.95825 -7.927856      25.96178 
1 1 1 -12 11 3  o 153.9929 3.431703 289.0627       12.87794 299.9851       22.65985 283.8521       15.65116 156.6965 5.944975 152.5241 4.214913 4.172379       7.287539 
1 1 1 -12 11 4  o 401.0657 8.497123 1964.997       83.04691 1931.025       115.7449 2001.042       119.2245 396.8990 11.98073 404.0079 12.12359 -7.108826      17.04463 
1 1 1 -12 11 5  o 120.9677 3.134075 178.4804       9.231006 179.6064       16.25258 177.9442       11.21563 121.2191 5.516388 120.7558 3.816149 0.4633331      6.707721 
1 1 1 -12 11 6  o 413.0063 6.164857 2081.270       62.04630 2012.231       86.38567 2154.838       89.17418 405.8121 8.735355 419.9489 8.713779 -14.13678      12.33841 
1 1 1 -12 11 7  o 245.7984 3.609274 736.5117       21.61897 749.5690       35.00973 728.4637       27.48545 247.8706 5.795991 244.4133 4.614684 3.457306       7.408699 
1 1 1 -12 11 8  o 185.5588 3.010354 419.6873       13.61242 429.8972       22.33505 413.6537       17.16976 187.6836 4.887584 184.1998 3.825068 3.483841       6.206418 
1 1 1 -12 11 9  o 306.1877 4.271214 1143.177       31.86949 1126.578       50.38307 1154.249       41.14716 303.7778 6.806008 307.5902 5.489480 -3.812347      8.743920 
1 1 1 -12 11 10 o 154.7378 3.081080 291.8656       11.61811 280.6381       16.82099 302.1078       16.06598 151.6261 4.557587 157.3454 4.193769 -5.719299      6.193489 
1 1 1 -12 11 11 o 272.8365 5.013259 908.0945       33.33180 920.3739       59.50322 902.4794       40.23738 274.1769 8.917674 271.9156 6.072385 2.261261       10.78883 
1 1 1 -12 11 12 o 255.8586 4.151947 798.3473       25.88737 778.7499       36.68574 817.7842       36.53525 252.5799 5.960222 258.8458 5.792085 -6.265930      8.310986 
1 1 1 -12 11 13 o 239.5500 3.960142 699.8108       23.11761 692.4268       33.09696 706.8453       32.30394 238.1703 5.702487 240.6520 5.508456 -2.481628      7.928521 
1 1 1 -12 11 14 o 146.7929 3.005841 262.6988       10.75244 276.9281       16.17699 251.4370       14.39162 150.6033 4.412613 143.5180 4.119236 7.085281       6.036494 
1 1 1 -12 11 15 o 137.6496 2.949880 231.0011       9.894992 225.3349       14.51352 235.9223       13.52588 135.8313 4.390437 139.0164 3.996820 -3.185074      5.937214 
1 1 1 -12 11 16 o 162.6000 3.663418 322.4688       14.51587 323.7459       18.30834 320.3070       23.81958 162.8078 4.619307 161.8002 6.051807 1.007629       7.613302 
1 1 1 -12 11 17 o 97.34488 2.742770 115.6241       6.499881 124.1563       10.08383 109.5592       8.501768 100.7895 4.114222 94.69926 3.691128 6.090286       5.527318 
1 1 1 -12 11 18 o 288.9074 4.571160 1018.945       32.18261 1014.141       45.94038 1023.575       45.09749 287.9376 6.547267 289.2994 6.396888 -1.361786      9.153518 
1 1 1 -12 11 19 o 182.4271 3.924486 406.1123       17.44650 403.6393       21.58079 410.7776       29.64085 181.7306 4.877485 183.0917 6.654399 -1.361115      8.250508 
1 1 1 -12 11 20 o 106.6878 2.772016 138.8937       7.200766 146.9286       10.97256 132.8158       9.543235 109.6368 4.114211 104.2592 3.762337 5.377571       5.575116 
1 1 1 -12 11 21 o 213.0867 3.681190 554.1037       19.11529 531.5757       27.01695 576.6855       27.04927 208.4671 5.322528 217.2298 5.109756 -8.762634      7.378273 
1 1 1 -12 11 22 o 36.50311 4.199884 16.48457       3.667966 26.25577       7.156272 13.00291       4.271754 45.83621 6.596527 32.13595 5.661552 13.70026       8.692947 
1 1 1 -12 11 23 o 80.03088 2.795812 78.21882       5.444201 78.91600       8.165503 77.66088       7.304735 80.27414 4.188671 79.66988 3.773202 0.6042557      5.637554 
1 1 1 -12 11 24 o 144.9163 3.042680 256.2316       10.74508 272.0942       16.11589 243.5365       14.41727 149.1546 4.438794 141.1321 4.196660 8.022461       6.108588 
1 1 1 -12 11 25 f 213.6207 5.314874 558.5587       27.66766 578.6913       41.85486 542.9335       36.87289 216.6909 7.939699 210.0902 7.212901 6.600723       10.72682 
1 1 1 -12 11 26 o 119.1047 3.414684 173.3424       9.900728 177.6823       19.26757 171.7854       11.54096 120.1229 6.607559 118.5049 4.002147 1.617950       7.725090 
1 1 1 -12 11 27 o 318.5988 5.779538 1244.685       44.87178 1256.112       55.71539 1223.589       75.69904 319.5182 7.155557 313.8134 9.911232 5.704865       12.22434 
1 1 1 -12 11 28 o 186.6731 3.478157 425.6566       15.82220 440.5485       23.20096 412.7095       21.63316 189.5865 5.026269 183.5338 4.841134 6.052673       6.978535 
1 1 1 -12 11 29 o 37.67950 4.380702 17.60538       3.947490 6.768003       5.618300 28.17158       5.547561 24.12613 8.099695 47.71673 4.837622 -23.59060      9.434386 
1 1 1 -12 11 30 o 32.83006 4.973951 13.50745       3.854823 18.83861       5.773154 9.218290       5.178312 38.63424 6.352640 26.93990 7.573849 11.69434       9.885303 
1 1 1 -12 11 31 o 57.17512 3.453416 40.11061       4.789196 30.95593       6.896268 48.63853       6.656013 49.84260 5.785102 62.86041 4.372365 -13.01781      7.251551 
1 1 1 -12 11 32 o 129.1389 3.068130 203.8048       9.655324 208.7535       14.20870 199.5592       13.16081 130.4030 4.477911 127.5450 4.240210 2.857964       6.166934 
1 1 1 -12 11 33 o 130.7146 4.258001 209.8109       13.54522 200.2690       18.27008 221.4570       20.18433 127.2482 5.907988 133.7206 6.211092 -6.472359      8.572164 
1 1 1 -12 11 34 o 49.13610 3.888957 29.79401       4.618662 33.79960       6.728548 26.22498       6.351314 52.07291 5.379780 45.70018 5.836071 6.372730       7.937365 
1 1 1 -12 11 35 o 169.6388 3.401862 352.7957       14.06300 361.0281       20.55738 345.5546       19.28018 170.9593 4.939633 167.3461 4.732555 3.613129       6.840837 
1 1 1 -12 11 36 o 19.81335 6.551724 4.719676       3.678715 8.075704       5.315686 1.635036       5.096228 25.21924 7.830724 17.92191 7.335983 7.297331       10.73019 
1 1 1 -12 11 37 o 87.32529 3.544977 94.03545       7.528108 95.58858       9.460117 91.35369       12.43094 87.75004 4.438393 85.11591 6.032259 2.634132       7.489157 
1 1 1 -12 11 38 o 83.91871 3.688513 87.18406       7.524609 90.96888       15.05287 85.92326       8.687966 83.74145 7.454199 83.07118 4.306424 0.6702652      8.608738 
1 1 1 -12 11 39 o 41.83781 4.171422 22.01739       4.196320 21.23940       5.856970 22.83798       6.015176 40.36651 6.147967 41.92006 6.064296 -1.553547      8.635576 
1 1 1 -12 11 40 o 47.41011 3.934945 28.27359       4.505252 34.92294       6.634645 22.58400       6.137172 52.09529 5.299876 41.32984 6.291798 10.76545       8.226506 
1 1 1 -12 11 41 o 17.20118 6.440681 3.240231       3.641502 4.556373       5.306453 2.068741       5.006361 20.19140 7.725619 17.50465 7.229161 2.686754       10.58045 
1 1 1 -12 11 42 o 21.01289 7.842391 5.621520       5.390123 0.000000       0.000000 5.621520       5.390123 ?        ?        21.01289 7.842391 0.000000       7.842391 
1 1 1 -12 11 43 o 17.39018 6.519582 3.677788       3.733693 3.831895       5.106553 3.500775       5.472945 18.62121 7.442760 18.60522 7.607423 0.1599503E-01  10.64272 
1 1 1 -12 11 44 o 13.91778 6.160456 -0.1458462E-02 4.129135 -4.441578      4.960737 10.01327       7.450210 12.46261 5.934662 24.49994 9.204333 -12.03733      10.95171 
1 1 1 -12 11 45 o 21.26409 6.928629 6.983375       4.120358 4.025473       5.821267 9.953094       5.832885 18.48506 7.727925 24.23818 8.252463 -5.753124      11.30593 
1 1 1 -12 11 46 f 42.20582 4.684954 24.64683       4.737442 22.53011       6.776354 26.67048       6.625697 36.71878 7.813274 41.40484 6.802698 -4.686062      10.35973 
1 1 1 -12 11 47 o 19.95246 6.989152 6.767794       4.195212 6.472001       6.365678 6.994906       5.577914 19.32451 8.080209 19.80302 7.822672 -0.4785080     11.24651 
1 1 1 -12 11 48 o 19.33052 7.257870 6.784207       4.630861 21.69074       9.511925 2.153464       5.301582 27.91570 10.41811 15.41157 6.891043 12.50413       12.49094 
1 1 1 -12 12 1  o 280.9965 4.482641 962.9260       30.69523 896.5740       42.12920 1038.006       44.81436 271.0193 6.378915 291.6190 6.306163 -20.59970      8.969851 
1 1 1 -12 12 2  o 204.5518 3.225980 510.0433       16.08056 527.5181       26.21863 499.5060       20.35951 207.9533 5.173783 202.3989 4.127842 5.554321       6.618694 
1 1 1 -12 12 3  o 178.2238 3.405297 387.2140       14.78962 375.9675       20.62628 399.1145       21.21760 175.5069 4.827289 180.8334 4.819133 -5.326447      6.821053 
1 1 1 -12 12 4  o 358.6718 4.892072 1569.057       42.75886 1574.751       68.12211 1565.356       54.92667 359.0445 7.785808 358.1302 6.293704 0.9143372      10.01147 
1 1 1 -12 12 5  f 178.5044 2.976619 388.3893       12.94817 372.5415       20.55158 398.8204       16.67356 174.7043 4.831954 180.8646 3.783020 -6.160339      6.136695 
1 1 1 -12 12 6  f 459.9036 6.803106 2582.309       76.24479 2616.624       109.3290 2549.818       106.3841 462.4722 9.700938 456.5565 9.561942 5.915649       13.62127 
1 1 1 -12 12 7  o 122.4257 2.583596 182.6756       7.707852 187.1811       12.92155 180.1869       9.603548 123.8200 4.288882 121.5353 3.245504 2.284714       5.378458 
1 1 1 -12 12 8  f 279.6662 3.983815 953.6837       27.15034 1000.220       44.66832 926.4180       34.19119 286.2422 6.403682 275.5755 5.091403 10.66675       8.181047 
1 1 1 -12 12 9  o 146.3528 2.712106 261.0733       9.672612 244.5993       15.46235 271.6646       12.39797 141.5453 4.488415 149.2765 3.408185 -7.731186      5.635743 
1 1 1 -12 12 10 o 145.8753 3.459814 259.4393       12.29902 247.9715       22.41123 264.3815       14.71243 142.3593 6.477136 147.1826 4.105975 -4.823334      7.668920 
1 1 1 -12 12 11 o 179.9091 3.319787 394.6155       14.55457 401.1116       21.29903 388.9247       19.93514 181.2590 4.826259 178.4995 4.586761 2.759491       6.658165 
1 1 1 -12 12 12 o 58.99139 3.057364 42.53879       4.380135 45.82324       7.149035 40.56486       5.542201 61.09242 4.841583 57.53577 3.977308 3.556652       6.265773 
1 1 1 -12 12 13 o 50.54136 3.329938 31.28131       4.078429 28.89306       6.501103 32.83122       5.237200 48.32292 5.625826 51.71058 4.191994 -3.387661      7.015892 
1 1 1 -12 12 14 o 59.56164 3.065280 43.36824       4.434143 40.48264       6.931808 45.36679       5.768809 57.37353 5.008059 60.86140 3.910319 -3.487865      6.353837 
1 1 1 -12 12 15 o 118.9548 3.317252 172.6926       9.606655 164.9892       12.11155 185.7607       15.77486 116.2051 4.284327 123.2306 5.265176 -7.025513      6.788043 
1 1 1 -12 12 16 o 172.4656 3.252769 362.7409       13.67073 359.3469       19.88263 365.7842       18.82719 171.5042 4.761934 173.0622 4.467973 -1.557922      6.529840 
1 1 1 -12 12 17 o 205.4144 4.102325 514.9122       20.53511 516.4586       36.34974 514.1873       24.88688 205.2583 7.278680 205.1956 4.976984 0.6265259E-01  8.817571 
1 1 1 -12 12 18 o 192.8671 4.066430 453.9706       19.11206 455.3265       23.74855 451.4782       32.19743 193.0041 5.053686 191.9232 6.895472 1.080887       8.549109 
1 1 1 -12 12 19 o 203.0526 3.583354 503.0470       17.73104 482.3236       25.17732 523.4384       24.97487 198.6099 5.206516 207.0004 4.951034 -8.390472      7.184744 
1 1 1 -12 12 20 f 78.09012 2.843763 74.46759       5.402562 71.43395       8.369991 76.63413       7.073386 76.34795 4.518960 79.16119 3.676773 -2.813248      5.825776 
1 1 1 -12 12 21 o 84.50616 2.798637 87.19044       5.755347 90.60262       8.815372 84.65549       7.598172 86.03658 4.217420 83.19821 3.757347 2.838364       5.648388 
1 1 1 -12 12 22 o 211.0354 4.178105 543.9023       21.48675 582.3180       39.01963 527.1838       25.74107 217.7099 7.365371 207.6510 5.086939 10.05891       8.951293 
1 1 1 -12 12 23 o 237.4494 3.983311 688.5522       23.04897 713.0624       33.81837 667.2906       31.49756 241.3415 5.750222 233.5076 5.535282 7.833878       7.981503 
1 1 1 -12 12 24 o 65.52714 3.020854 52.50304       4.810795 47.78464       7.301412 56.12297       6.395267 62.32390 4.845510 67.67709 3.894202 -5.353195      6.216413 
1 1 1 -12 12 25 o 133.7258 3.499170 218.4896       11.39313 235.4409       22.53699 212.6703       13.20470 138.3234 6.705947 131.8621 4.114377 6.461288       7.867517 
1 1 1 -12 12 26 o 149.6227 3.626100 273.4306       13.22127 264.8117       16.59947 288.3859       21.86580 147.0610 4.637714 153.2521 5.865773 -6.191147      7.477679 
1 1 1 -12 12 27 o 243.2020 4.715212 723.8820       27.94502 753.1891       35.54442 676.4469       45.22050 247.7699 5.886902 234.0197 7.941024 13.75024       9.885115 
1 1 1 -12 12 28 o 289.5021 4.651625 1025.983       32.81652 1008.855       46.47462 1043.015       46.34478 286.3754 6.659538 291.2367 6.530083 -4.861267      9.326920 
1 1 1 -12 12 29 f 15.11950 6.113410 1.200834       3.488056 5.514587       5.553962 -1.608779      4.482275 22.64124 8.032120 14.39336 6.392172 8.247878       10.26522 
1 1 1 -12 12 30 o 38.17497 4.592288 18.10959       4.186435 14.48178       6.309026 20.96367       5.595936 33.54315 7.856986 40.90582 5.774134 -7.362667      9.750531 
1 1 1 -12 12 31 o 53.27603 3.548454 34.86603       4.580622 36.80246       6.965871 33.39078       6.080061 54.47665 5.314724 51.94387 4.859692 2.532784       7.201590 
1 1 1 -12 12 32 o 136.5610 3.484225 228.3055       11.58548 237.7790       20.16939 223.6406       14.15334 138.7358 5.979836 134.9889 4.308056 3.746902       7.370060 
1 1 1 -12 12 33 o 91.99259 3.673242 103.8316       8.217969 104.4713       10.07713 102.5614       14.19957 92.11643 4.502790 90.77316 6.461454 1.343269       7.875628 
1 1 1 -12 12 34 o 73.52550 3.228952 66.32119       5.771321 60.84543       8.405936 71.20418       7.937919 70.08974 4.953385 75.99255 4.304063 -5.902817      6.562087 
1 1 1 -12 12 35 o 30.54811 5.414380 11.89125       3.883053 11.89932       5.672283 11.88414       5.326906 30.16691 7.693115 30.18073 7.319136 -0.1381874E-01 10.61856 
1 1 1 -12 12 36 o 54.61065 4.106576 36.98388       5.425004 35.26463       6.891823 39.78456       8.796231 52.97716 5.414438 55.91842 6.581003 -2.941257      8.522073 
1 1 1 -12 12 37 o 82.10489 3.071547 82.95359       6.134737 85.56770       9.090448 80.76738       8.313214 82.92191 4.515667 80.65430 4.244601 2.267616       6.197409 
1 1 1 -12 12 38 o 58.69038 4.144727 42.99519       5.889748 55.65190       12.94073 39.68842       6.614545 64.60249 8.420219 56.11582 4.885684 8.486664       9.734988 
1 1 1 -12 12 39 o 39.83007 4.399684 20.08861       4.199312 23.28197       6.077864 17.17181       5.808723 42.23954 6.079548 35.82590 6.903799 6.413647       9.199095 
1 1 1 -12 12 40 o 10.41311 4.949809 -3.942125      3.419799 -5.628170      4.859822 -2.288296      4.813167 12.27670 5.853918 14.02551 6.389705 -1.748813      8.665834 
1 1 1 -12 12 41 o 19.31896 7.158337 4.437900       4.475464 -2.962228      8.344267 7.426445       5.302718 18.08731 8.305084 23.25004 7.869048 -5.162727      11.44099 
1 1 1 -12 12 42 o 16.14839 6.375350 2.538965       3.702917 3.361887       5.342543 1.778164       5.136938 18.62556 7.553304 17.04457 7.200468 1.580992       10.43547 
1 1 1 -12 12 43 o 32.97278 5.440769 14.93514       4.219372 16.81600       6.063674 13.16951       5.874985 33.30005 7.635490 29.03570 8.032187 4.264341       11.08227 
1 1 1 -12 12 44 o 15.66335 6.665959 1.685508       4.457696 -0.2576350     5.408973 5.799354       7.870212 15.29826 6.890625 21.10938 8.914836 -5.811123      11.26743 
1 1 1 -12 12 45 o 10.71778 5.211180 -5.722921      4.321879 -3.086997      5.434085 -10.26049      7.129704 13.49528 6.362456 12.89368 6.355602 0.6015997      8.993027 
1 1 1 -12 12 46 o 51.42490 4.124953 35.72948       5.125944 33.75406       7.522261 37.44200       7.003830 46.26106 6.881882 50.33347 5.817006 -4.072411      9.010984 
1 1 1 -12 12 47 o 8.606810 4.297689 -7.963846      3.691595 -8.701650      5.630675 -7.407620      4.888952 11.12886 5.515128 10.58824 5.227435 0.5406199      7.598863 
1 1 1 -12 12 48 o 17.31491 6.950520 4.999481       4.473283 3.302220       7.968390 5.780501       5.405393 17.07248 7.936066 18.05552 7.489256 -0.9830322     10.91193 
1 1 1 -12 13 1  o 205.1243 2.954012 512.9033       14.76608 499.4212       20.79362 526.6180       20.97231 202.3632 4.216602 207.8035 4.141497 -5.440338      5.910307 
1 1 1 -12 13 2  o 293.3735 4.635960 1049.825       33.14337 1053.481       47.52736 1046.364       46.24265 293.7173 6.640152 292.7387 6.482261 0.9786682      9.279618 
1 1 1 -12 13 3  o 130.2740 3.087023 206.8839       9.800175 211.2846       13.91937 202.5581       13.80047 131.5502 4.347998 128.7984 4.403381 2.751724       6.188283 
1 1 1 -12 13 4  o 516.2994 6.782356 3255.314       85.33325 3188.493       133.4272 3301.562       111.0026 510.1056 10.73367 519.5598 8.767210 -9.454254      13.85914 
1 1 1 -12 13 5  o 119.5090 2.593797 174.0813       7.553925 188.8710       12.87124 166.3109       9.329623 124.3746 4.252966 116.7535 3.282383 7.621101       5.372314 
1 1 1 -12 13 6  o 346.0940 4.750953 1461.130       40.06922 1408.580       62.33264 1498.138       52.30901 339.5207 7.533784 350.3174 6.127436 -10.79666      9.710992 
1 1 1 -12 13 7  o 88.07921 2.753784 94.65580       5.903446 92.59415       12.06403 95.30491       6.769297 86.91296 5.727952 88.36251 3.148721 -1.449547      6.536350 
1 1 1 -12 13 8  o 304.2187 4.271540 1128.765       31.66697 1167.582       51.60830 1105.324       40.10430 309.1675 6.849984 300.9492 5.468418 8.218353       8.765037 
1 1 1 -12 13 9  o 286.3922 4.071464 1000.306       28.41501 997.4037       45.36263 1002.180       36.45267 285.7691 6.513987 286.5745 5.219822 -0.8053589     8.347369 
1 1 1 -12 13 10 o 316.8618 4.927914 1225.097       38.05125 1246.506       78.10303 1218.433       43.57209 318.7363 10.06805 315.9264 5.659608 2.809875       11.54975 
1 1 1 -12 13 11 o 359.7825 4.909160 1579.602       43.04110 1629.316       69.92038 1549.269       54.61515 364.9663 7.861671 356.1372 6.293028 8.829071       10.07016 
1 1 1 -12 13 12 o 83.28207 2.843508 84.65508       5.762416 81.74284       8.820863 86.82318       7.610927 81.73191 4.445507 84.29295 3.714307 -2.561043      5.792979 
1 1 1 -12 13 13 o 165.0403 3.207438 332.1346       12.89984 342.4702       19.17704 323.5928       17.43358 167.4500 4.704257 162.7909 4.398641 4.659088       6.440347 
1 1 1 -12 13 14 o 66.90597 2.959265 54.68705       4.812925 60.44404       7.655151 50.92387       6.189189 70.23315 4.496377 64.48743 3.957486 5.745720       5.989916 
1 1 1 -12 13 15 o 309.4814 5.614892 1170.168       42.34597 1150.965       51.79346 1208.886       73.54330 306.7152 6.929526 313.5940 9.635066 -6.878815      11.86814 
1 1 1 -12 13 16 o 196.9909 4.109670 473.5593       19.72828 479.7198       24.66926 462.6295       32.85936 198.1181 5.113982 194.3008 6.951025 3.817322       8.629576 
1 1 1 -12 13 17 o 300.1681 5.501920 1101.110       40.24528 1135.138       50.54497 1042.172       66.52136 304.5294 6.811027 291.0486 9.391358 13.48087       11.60119 
1 1 1 -12 13 18 o 91.04198 3.154700 101.2190       6.988423 110.6669       13.46907 97.73862       8.174879 94.95453 5.849234 89.41832 3.760010 5.536209       6.953504 
1 1 1 -12 13 19 o 333.7838 5.170094 1361.551       42.05328 1315.270       58.81123 1409.973       60.15621 327.5587 7.367751 339.1711 7.278225 -11.61234      10.35646 
1 1 1 -12 13 20 o 201.2365 3.575689 494.1778       17.53487 494.2765       25.46077 494.0887       24.18452 201.0186 5.201927 201.0793 4.935531 -0.6071472E-01 7.170741 
1 1 1 -12 13 21 o 58.95965 3.094239 42.52526       4.430188 36.95942       7.025314 46.19979       5.708232 54.71758 5.336426 61.39907 3.834219 -6.681492      6.571049 
1 1 1 -12 13 22 o 226.4155 5.370945 627.1631       29.63418 626.4077       42.65421 627.8681       41.20166 225.6507 7.768501 225.9895 7.491886 -0.3387146     10.79249 
1 1 1 -12 13 23 o 279.2629 4.497621 953.1605       30.60781 963.7792       44.19378 943.3716       42.43190 280.3553 6.468688 277.4226 6.276457 2.932709       9.013204 
1 1 1 -12 13 24 o 275.5441 5.164299 929.1682       34.67677 1009.847       65.12029 897.2365       40.96837 285.6827 9.366639 270.5027 6.214997 15.17993       11.24100 
1 1 1 -12 13 25 o 288.6237 5.362537 1020.218       37.71710 950.2733       64.63904 1056.327       46.44330 276.8447 9.595767 293.3367 6.497115 -16.49203      11.58841 
1 1 1 -12 13 26 o 87.30330 3.367312 93.20982       7.150478 96.12770       9.473699 89.34696       10.90032 88.54758 4.404250 85.24241 5.273260 3.305176       6.870567 
1 1 1 -12 13 27 o 116.4685 2.974770 165.6949       8.436115 184.3444       12.98169 152.0620       11.09920 122.6830 4.349090 111.4441 4.093902 11.23888       5.972824 
1 1 1 -12 13 28 o 190.6265 4.081493 444.4595       18.96000 446.6090       23.86195 440.7784       31.22674 190.8068 5.136546 189.0820 6.788059 1.724823       8.512453 
1 1 1 -12 13 29 o 95.51826 2.997368 111.5302       6.968265 115.6573       10.46084 108.2381       9.342880 97.08634 4.433226 93.96404 4.090011 3.122307       6.031723 
1 1 1 -12 13 30 o 227.4138 3.955229 632.9667       21.91919 631.5004       31.54760 634.3351       30.47696 226.5298 5.719424 227.1852 5.504976 -0.6554260     7.938297 
1 1 1 -12 13 31 o 12.57693 5.559540 -1.053925      3.352041 -3.878515      5.067146 1.144002       4.469844 13.95572 6.431220 16.67712 6.853270 -2.721396      9.398293 
1 1 1 -12 13 32 o 119.1192 4.253543 174.2650       12.32739 172.2796       16.88320 176.5321       18.04150 118.0122 5.889336 119.3591 6.224207 -1.346954      8.568841 
1 1 1 -12 13 33 o 90.54383 3.759345 100.6721       8.276779 98.67149       10.15124 104.6398       14.29562 89.44864 4.673240 91.63644 6.442812 -2.187798      7.959208 
1 1 1 -12 13 34 o 60.27897 3.540165 44.71281       5.177372 48.19156       7.694895 41.83532       6.998384 62.26490 5.116444 58.01239 4.999124 4.252514       7.153267 
1 1 1 -12 13 35 o 19.83615 6.598996 4.702945       3.730522 6.052048       5.513660 3.563927       5.066206 22.92591 8.013795 19.77996 7.553507 3.145945       11.01256 
1 1 1 -12 13 36 o 56.04316 4.111850 38.98981       5.576509 38.62879       7.210689 39.52707       8.796332 55.41200 5.408723 55.63486 6.617644 -0.2228584     8.546783 
1 1 1 -12 13 37 o 56.03205 4.110222 39.09710       5.573212 34.25276       11.26709 40.66632       6.412662 50.13008 9.572113 56.97921 4.658979 -6.849133      10.64572 
1 1 1 -12 13 38 o 24.59100 6.351273 8.027303       3.832570 5.111528       5.935157 10.11269       5.019363 21.81883 8.211411 27.39994 7.361262 -5.581106      11.02794 
1 1 1 -12 13 39 o 53.08477 3.643727 35.21469       4.685003 35.74483       7.045186 34.79439       6.273026 52.62524 5.578524 52.20335 4.991814 0.4218864      7.485862 
1 1 1 -12 13 40 o 19.54798 7.062337 4.605220       4.314512 13.44772       9.244458 2.142758       4.878415 30.08526 10.38462 17.47431 7.167926 12.61094       12.61822 
1 1 1 -12 13 41 o 14.01943 6.096281 0.4591254E-01  3.884786 -4.637222      6.578686 2.553254       4.813685 15.11808 7.087533 17.55340 7.150714 -2.435322      10.06806 
1 1 1 -12 13 42 o 15.61075 6.352824 2.034229       3.794733 0.9524277      5.394441 3.093953       5.339111 16.57154 7.195124 18.24384 7.492827 -1.672304      10.38808 
1 1 1 -12 13 43 o 15.44701 6.290928 2.166460       3.724493 1.615686       5.267896 2.716955       5.266562 16.61873 7.162700 17.50070 7.335801 -0.8819752     10.25272 
1 1 1 -12 13 44 o 21.20791 7.012573 6.862650       4.214452 9.747190       5.906463 3.870828       6.015296 24.19477 8.302647 18.63508 7.827446 5.559687       11.41065 
1 1 1 -12 13 45 o 23.81603 7.426538 9.397506       4.775547 7.870483       6.213842 11.60079       7.464017 21.52431 8.327599 24.54640 9.214745 -3.022091      12.42016 
1 1 1 -12 13 46 o 19.27624 6.834486 6.037585       4.020691 4.623987       5.717734 7.420341       5.655015 18.03291 7.606190 20.48126 7.938789 -2.448347      10.99448 
1 1 1 -12 13 47 o 12.54264 5.723885 -0.3068562     3.883438 -4.613766      6.253494 2.396688       4.954577 13.06287 6.332046 15.50336 6.809652 -2.440498      9.298718 
1 1 1 -12 13 48 o 17.37451 6.744913 5.127873       4.086821 5.703798       6.290038 4.707133       5.376222 17.91053 7.773034 17.07212 7.294680 0.8384132      10.65985 
1 1 1 -12 14 1  o 489.8860 6.464771 2931.500       77.17635 2864.721       119.8218 2978.845       100.8911 483.3776 10.17216 493.4013 8.391048 -10.02374      13.18645 
1 1 1 -12 14 2  o 262.4654 3.839325 840.0931       24.55630 889.0521       40.44547 811.5084       30.90436 269.8216 6.151160 257.8898 4.917560 11.93182       7.875225 
1 1 1 -12 14 3  o 133.5416 3.103471 217.4115       10.09951 208.9927       13.98848 226.5782       14.59666 130.8203 4.394163 136.2183 4.403041 -5.398071      6.220565 
1 1 1 -12 14 4  o 97.61938 2.575571 116.2376       6.121617 101.7935       9.974479 124.9658       7.753618 91.23829 4.500068 101.1948 3.148028 -9.956528      5.491875 
1 1 1 -12 14 5  o 150.4042 2.783939 275.7541       10.20365 269.2255       16.52370 279.7781       12.97254 148.4862 4.571966 151.4773 3.514318 -2.991165      5.766568 
1 1 1 -12 14 6  o 381.7646 5.787109 1779.328       53.83855 1675.786       73.82376 1896.962       78.68716 370.1248 8.184871 393.7905 8.199785 -23.66568      11.58571 
1 1 1 -12 14 7  o 176.7419 2.987553 380.8202       12.86742 364.8003       20.44379 391.3299       16.55872 172.8398 4.858620 179.1345 3.793250 -6.294769      6.164003 
1 1 1 -12 14 8  o 259.1323 3.788235 818.9174       23.92184 798.5856       37.80320 832.4965       30.89416 255.7154 6.066464 261.1965 4.853699 -5.481155      7.769195 
1 1 1 -12 14 9  f 291.0890 4.137585 1033.583       29.35005 1008.688       46.19446 1050.436       38.00750 287.3134 6.597782 293.3454 5.316844 -6.032013      8.473462 
1 1 1 -12 14 10 o 179.2338 3.343608 391.7255       14.60399 417.0079       31.63111 384.8762       16.46377 184.5491 7.046362 177.6398 3.803234 6.909302       8.007235 
1 1 1 -12 14 11 o 220.1094 3.782619 590.9337       20.28931 590.2773       29.23284 591.5436       28.18279 219.8626 5.456116 220.1157 5.254081 -0.2531281     7.574600 
1 1 1 -12 14 12 o 198.1951 3.562487 479.0949       17.20609 519.3911       25.82261 446.9185       23.07477 206.2517 5.137673 191.2718 4.954686 14.97987       7.137548 
1 1 1 -12 14 13 o 252.3598 4.149645 777.0841       25.51921 778.3600       36.72833 775.8933       35.48310 252.3736 5.972019 251.9972 5.778162 0.3763885      8.309764 
1 1 1 -12 14 14 o 250.2315 4.138610 764.1006       25.23670 746.6868       35.76969 781.3604       35.61102 247.1649 5.938712 252.8595 5.779217 -5.694550      8.286594 
1 1 1 -12 14 15 o 303.2710 6.859175 1125.627       50.69193 1125.627       50.69193 0.000000       0.000000 303.2710 6.859175 ?        ?        0.000000       6.859175 
1 1 1 -12 14 16 o 11.94239 5.523764 -3.181941      3.788294 -8.946311      5.229017 3.185747       5.495851 11.89736 5.772505 20.22753 7.830138 -8.330169      9.727942 
1 1 1 -12 14 17 o 206.4836 3.643012 520.2188       18.33083 522.1116       26.68426 518.5274       25.22469 206.6294 5.303787 206.0174 5.024417 0.6119995      7.305815 
1 1 1 -12 14 18 o 170.5774 3.285612 354.9565       13.65758 371.9846       20.53045 341.4388       18.29221 174.4315 4.834553 167.1497 4.494888 7.281860       6.601282 
1 1 1 -12 14 19 o 241.5712 4.045399 712.4360       23.81457 717.2437       34.54883 708.0839       32.87152 242.1261 5.855388 240.6160 5.606078 1.510101       8.106398 
1 1 1 -12 14 20 o 221.6172 3.827285 599.5662       20.66952 591.9487       29.80222 606.6265       28.69164 219.9031 5.565833 222.7267 5.286241 -2.823593      7.676122 
1 1 1 -12 14 21 o 92.59546 3.157650 104.7349       7.114657 103.4446       13.08915 105.2760       8.476144 91.73321 5.886358 92.78577 3.756468 -1.052567      6.982854 
1 1 1 -12 14 22 o 211.9015 3.723424 548.2444       19.22705 535.3020       27.54724 560.5386       26.84852 209.0758 5.411323 214.0625 5.146875 -4.986725      7.468115 
1 1 1 -12 14 23 o 129.8090 3.463959 205.8575       10.94776 208.4097       21.12251 204.9200       12.80141 130.1466 6.682410 129.4485 4.063150 0.6980743      7.820728 
1 1 1 -12 14 24 o 197.2743 4.144410 475.6089       19.92367 508.5436       37.93724 463.0657       23.41221 203.1112 7.678537 194.4704 4.944306 8.640839       9.132694 
1 1 1 -12 14 25 o 246.6566 4.134297 743.6943       24.85023 740.3102       35.72038 746.8683       34.59377 245.6661 5.966707 246.8103 5.751731 -1.144211      8.287580 
1 1 1 -12 14 26 f 149.4448 3.648911 272.8639       13.28863 276.3549       17.09288 267.5302       21.12789 150.1955 4.675754 147.5419 5.888132 2.653519       7.518828 
1 1 1 -12 14 27 o 166.4292 3.320283 338.3178       13.46606 325.5393       19.36486 350.2828       18.73836 162.9534 4.882082 169.1052 4.551279 -6.151871      6.674493 
1 1 1 -12 14 28 o 134.4040 3.121698 220.6278       10.22443 223.3133       15.16984 218.3924       13.84048 134.9517 4.619632 133.5182 4.259223 1.433456       6.283469 
1 1 1 -12 14 29 o 75.87607 3.559499 70.54273       6.563230 78.11640       8.939487 61.68668       9.666730 79.70698 4.622183 70.62488 5.664212 9.082100       7.310805 
1 1 1 -12 14 30 o 76.76056 3.132480 72.12453       5.847216 82.05814       9.018541 64.92046       7.680182 81.68594 4.548532 72.65771 4.357666 9.028229       6.299080 
1 1 1 -12 14 31 o 71.40906 3.931533 62.64740       6.815099 61.29136       8.376079 65.30341       11.72246 70.46705 4.908424 72.35208 6.725631 -1.885033      8.326268 
1 1 1 -12 14 32 o 64.91822 4.566453 52.02917       7.177981 54.23396       10.00307 49.68877       10.30611 65.90559 6.305163 62.92415 6.830561 2.981434       9.295786 
1 1 1 -12 14 33 o 40.97077 4.262043 20.84619       4.193157 29.67074       6.983596 15.87126       5.243558 48.57639 6.028868 35.24768 6.337604 13.32871       8.747141 
1 1 1 -12 14 34 f 108.3923 3.063580 144.0463       8.084032 150.3208       12.28457 139.2537       10.73631 110.3116 4.579815 106.2964 4.152760 4.015266       6.182242 
1 1 1 -12 14 35 o 33.06733 5.179722 13.88616       4.036963 13.94706       6.056630 13.83747       5.415308 32.51618 7.753153 32.54014 7.034501 -0.2396011E-01 10.46879 
1 1 1 -12 14 36 o 77.67106 3.218425 74.30902       6.078504 82.01575       9.042844 67.95651       8.209987 81.16171 4.590840 73.85804 4.584105 7.303665       6.487668 
1 1 1 -12 14 37 o 22.47251 7.187781 6.453018       4.447476 13.90857       9.566909 4.397546       5.023280 31.96046 10.56547 20.36296 7.576493 11.59750       13.00124 
1 1 1 -12 14 38 o 56.31778 3.539382 39.46909       4.832895 37.88908       7.175271 40.78111       6.538512 54.38833 5.488741 56.77508 4.769971 -2.386749      7.271789 
1 1 1 -12 14 39 o 18.49446 6.938673 3.698837       4.230780 12.09296       9.474759 1.608294       4.728354 29.32307 10.48149 16.90253 7.007205 12.42053       12.60804 
1 1 1 -12 14 40 o 52.55883 3.827614 34.91819       4.868812 39.56279       7.524469 31.57289       6.385864 54.79407 5.719270 49.08311 5.429566 5.710953       7.886078 
1 1 1 -12 14 41 o 11.35487 5.361802 -3.657250      3.887161 1.294312       6.580210 -6.311401      4.817608 18.29091 7.944117 11.69299 5.641084 6.597916       9.743245 
1 1 1 -12 14 42 o 34.75104 5.368475 16.44348       4.399920 14.42644       6.370860 18.28292       6.083909 30.30297 8.357162 35.17158 7.336087 -4.868608      11.12027 
1 1 1 -12 14 43 o 16.43832 6.848355 2.373585       4.548129 3.621985       5.315942 -1.036048      8.785310 18.20571 7.476792 18.13113 8.395228 0.7458115E-01  11.24199 
1 1 1 -12 14 44 o 21.66939 7.415781 7.427394       4.711223 3.919194       5.799068 14.23775       8.079804 18.38116 7.700821 27.24296 9.685540 -8.861801      12.37386 
1 1 1 -12 14 45 o 22.83431 6.740975 8.356316       4.009061 2.216778       5.739096 14.20750       5.602701 16.60659 7.310373 28.83563 7.790437 -12.22905      10.68328 
1 1 1 -12 14 46 o 13.97897 6.080877 1.370366       3.868094 2.817208       5.965140 0.3205550      5.081191 16.64618 7.384405 14.41278 6.565775 2.233399       9.881237 
1 1 1 -12 14 47 o 15.54510 6.650620 2.942302       4.479028 7.579111       8.793529 1.317869       5.204803 19.45029 8.771068 14.84105 6.714988 4.609240       11.04639 
1 1 1 -12 15 1  o 339.6780 4.679217 1408.049       38.73260 1404.854       60.98174 1410.210       50.14656 338.8994 7.384021 339.7599 6.056657 -0.8605042     9.550228 
1 1 1 -12 15 2  o 264.0595 3.530598 850.3279       22.71884 875.8984       32.93933 827.1268       31.37621 267.8794 5.045910 260.3235 4.945964 7.555817       7.065675 
1 1 1 -12 15 3  o 243.1749 4.779824 721.6456       28.32480 765.5630       35.79581 648.0938       46.32446 250.3659 5.867066 229.9428 8.280643 20.42307       10.14847 
1 1 1 -12 15 4  f 41.15512 3.494227 20.80301       3.471281 22.98146       6.034646 19.72574       4.243645 42.97731 5.919071 39.96520 4.431740 3.012112       7.394303 
1 1 1 -12 15 5  o 288.8950 4.131916 1018.112       29.08891 1030.259       46.81284 1010.472       37.12673 290.3471 6.616242 287.7006 5.295534 2.646515       8.474511 
1 1 1 -12 15 6  f 267.7669 3.901787 874.5424       25.45989 853.2714       40.16377 888.8315       32.91886 264.2726 6.236576 269.8531 5.005889 -5.580475      7.997113 
1 1 1 -12 15 7  o 251.2566 3.730134 769.9670       22.83904 715.8412       35.14417 809.5375       30.04948 242.0782 5.957464 257.5493 4.787850 -15.47104      7.642963 
1 1 1 -12 15 8  o 215.0218 3.350629 563.8065       17.55678 569.1606       28.42526 560.5042       22.32394 215.8299 5.408775 214.3356 4.274057 1.494308       6.893651 
1 1 1 -12 15 9  o 316.9477 4.960455 1226.303       38.31291 1160.328       75.40058 1249.266       44.48351 307.2397 10.08440 319.8041 5.707935 -12.56436      11.58774 
1 1 1 -12 15 10 o 297.6151 4.222080 1080.773       30.62087 1056.835       48.25970 1096.904       39.61707 293.9778 6.736495 299.6893 5.424691 -5.711548      8.649141 
1 1 1 -12 15 11 o 65.15087 2.717747 51.84044       4.305371 61.42388       7.814855 47.66418       5.158869 70.79413 4.554045 62.42226 3.404284 8.371864       5.685813 
1 1 1 -12 15 12 o 149.6998 2.795129 273.2420       10.19668 275.2255       16.81304 272.0881       12.82436 150.0835 4.602466 149.3530 3.523592 0.7305450      5.796412 
1 1 1 -12 15 13 o 354.3252 5.456979 1533.941       47.11839 1472.217       65.34953 1600.774       68.00043 346.6413 7.736172 361.4635 7.719891 -14.82220      10.92909 
1 1 1 -12 15 14 o 98.75200 4.465003 119.2951       10.71714 119.2951       10.71714 0.000000       0.000000 98.75200 4.465003 ?        ?        0.000000       4.465003 
1 1 1 -12 15 15 f 200.2285 4.199349 489.3754       20.49010 484.5876       25.38876 498.3194       34.70089 199.0787 5.237912 201.5940 7.074578 -2.515350      8.802577 
1 1 1 -12 15 16 o 114.5603 2.933750 160.1623       8.183439 158.6221       12.39172 161.3535       10.89792 113.8884 4.473647 114.9168 3.897202 -1.028397      5.933102 
1 1 1 -12 15 17 o 59.59502 3.178991 43.44639       4.600035 41.51116       7.482373 44.62225       5.832454 58.03053 5.351345 60.33076 3.989525 -2.300236      6.674819 
1 1 1 -12 15 18 o 135.5809 3.013943 224.2229       9.957939 223.5647       14.83707 224.7624       13.43272 135.2153 4.509146 135.6220 4.069015 -0.4067383     6.073655 
1 1 1 -12 15 19 o 161.4492 3.225712 318.0292       12.69105 312.5007       18.57025 322.8740       17.38413 159.8405 4.772892 162.5213 4.393444 -2.680817      6.487129 
1 1 1 -12 15 20 o 120.3427 2.944702 176.6731       8.635694 178.5637       13.10316 175.2214       11.48218 120.8091 4.458471 119.7257 3.940877 1.083435       5.950502 
1 1 1 -12 15 21 o 188.9781 3.970519 436.1614       18.28499 422.4967       32.06635 442.7453       22.25835 185.3825 7.111327 190.2356 4.805213 -4.853088      8.582602 
1 1 1 -12 15 22 o 80.48306 3.360656 79.20517       6.576699 82.63906       14.02343 78.23696       7.446366 81.72261 7.112452 79.94600 3.833353 1.776611       8.079700 
1 1 1 -12 15 23 o 87.29680 3.418295 93.18347       7.257779 85.00448       14.82078 95.76360       8.324197 82.80998 7.422991 88.45538 3.871104 -5.645393      8.371753 
1 1 1 -12 15 24 o 67.30476 3.118753 55.41257       5.101297 58.63556       8.139483 53.32763       6.546565 69.04978 4.868457 65.92800 4.095027 3.121780       6.361692 
1 1 1 -12 15 25 o 255.5880 4.920037 799.8120       30.64397 780.2799       37.75004 837.5511       52.47333 252.1076 6.144625 260.2727 8.283755 -8.165085      10.31392 
1 1 1 -12 15 26 o 177.7628 3.423522 385.9950       14.83030 369.0616       21.27008 402.0150       20.68845 173.4942 5.036258 181.1545 4.690380 -7.660385      6.882119 
1 1 1 -12 15 27 o 92.16547 3.032545 103.8366       6.801738 98.91429       10.19836 107.7803       9.128528 89.74881 4.679163 93.79012 4.003203 -4.041313      6.157938 
1 1 1 -12 15 28 o 164.0960 3.332378 329.0495       13.32565 312.3831       19.08082 344.9177       18.61832 159.5412 4.913672 167.7337 4.559183 -8.192520      6.703008 
1 1 1 -12 15 29 o 22.90484 6.279427 6.669535       3.608974 4.757537       5.665912 7.974879       4.681540 21.89601 8.064803 25.11457 7.248265 -3.218559      10.84336 
1 1 1 -12 15 30 o 101.8324 3.768491 127.1027       9.335546 132.7725       11.64110 116.8853       15.62709 103.9316 4.607775 97.03435 6.648889 6.897240       8.089458 
1 1 1 -12 15 31 o 53.91475 6.999059 36.64102       8.978847 36.64102       8.978847 0.000000       0.000000 53.91475 6.999059 ?        ?        0.000000       6.999059 
1 1 1 -12 15 32 o 126.6657 3.750533 196.8760       11.56404 196.5564       14.20460 197.5043       19.91337 126.3327 4.621786 125.9823 6.508396 0.3503952      7.982488 
1 1 1 -12 15 33 o 79.58859 3.179936 77.71738       6.155030 69.91298       9.002521 84.56765       8.434293 75.10522 4.946321 82.82085 4.192643 -7.715637      6.484161 
1 1 1 -12 15 34 o 59.79886 3.490716 44.06222       5.064668 49.18608       7.662609 40.08725       6.749091 62.82368 5.047597 56.70681 4.933022 6.116871       7.057828 
1 1 1 -12 15 35 o 64.18297 3.828310 50.96218       5.960534 49.82478       7.946298 52.42545       9.013057 63.05455 5.218130 64.48462 5.797434 -1.430073      7.799944 
1 1 1 -12 15 36 o 29.56330 5.541905 11.30100       3.845881 15.79693       6.218763 8.516576       4.893984 34.41691 7.616462 25.44435 7.430748 8.972567       10.64079 
1 1 1 -12 15 37 o 55.49786 4.182284 38.55326       5.614594 26.37483       11.41612 42.43882       6.448360 42.65772 10.93279 58.08653 4.592871 -15.42881      11.85835 
1 1 1 -12 15 38 o 25.54061 6.833934 8.827376       4.336783 15.80430       9.538689 7.009395       4.869130 32.91918 10.52618 23.10143 7.532229 9.817743       12.94353 
1 1 1 -12 15 39 f 27.24278 6.069168 10.02248       3.925951 6.554631       6.058551 12.53271       5.154610 22.84049 8.351624 30.07027 7.141183 -7.229788      10.98845 
1 1 1 -12 15 40 o 50.61252 3.942961 32.57198       4.824793 32.57259       7.238492 32.57150       6.472207 49.18308 6.175210 49.70748 5.431404 -0.5243988     8.223950 
1 1 1 -12 15 41 o 37.74145 4.912851 18.88138       4.411299 23.42751       6.308563 14.53170       6.170756 40.91327 6.548211 30.97474 8.088818 9.938528       10.40711 
1 1 1 -12 15 42 o 37.21596 5.295397 18.90468       4.667104 10.28970       6.422743 28.54271       6.793408 25.28059 8.658452 44.81146 6.402851 -19.53087      10.76872 
1 1 1 -12 15 43 o 33.85218 6.430664 16.79012       5.111002 16.73074       6.232785 16.91203       8.930069 32.30064 7.968403 29.66953 10.20794 2.631109       12.94981 
1 1 1 -12 15 44 o 12.28612 5.781631 -2.795323      4.449983 0.5321405      5.686388 -8.052914      7.147814 15.72121 7.074504 13.51880 6.601485 2.202409       9.676167 
1 1 1 -12 15 45 o 13.97907 6.042819 1.278411       3.771175 -2.579912      5.650313 4.377783       5.064191 13.66200 6.455215 17.73004 7.291252 -4.068044      9.738180 
1 1 1 -12 15 46 o 26.01070 6.784677 11.33766       4.344669 11.11534       6.844592 11.48768       5.622640 22.84111 8.765410 24.35641 8.101421 -1.515301      11.93589 
1 1 1 -12 15 47 o 42.27272 5.346337 26.92780       5.384504 21.05392       10.08927 29.26708       6.367050 26.30701 10.47927 42.55235 6.332839 -16.24534      12.24418 
1 1 1 -12 16 1  o 105.9865 2.513933 136.9415       6.492926 119.5100       9.686297 151.1652       8.749731 98.88909 4.027942 111.2891 3.229726 -12.39999      5.162891 
1 1 1 -12 16 2  o 241.1329 4.058501 709.4161       23.84834 734.4208       33.86536 684.8169       33.58962 245.1897 5.667838 236.7477 5.822149 8.442047       8.125381 
1 1 1 -12 16 3  o 67.76643 3.086980 56.11330       5.084433 58.66496       7.761145 54.19484       6.729620 69.17470 4.630748 66.51559 4.172772 2.659111       6.233446 
1 1 1 -12 16 4  o 285.9958 4.111189 997.9590       28.65255 980.0599       45.24831 1009.940       37.02050 283.1241 6.558273 287.5810 5.282578 -4.456970      8.421198 
1 1 1 -12 16 5  o 261.8593 3.852338 836.4885       24.58264 826.8733       39.06364 842.7928       31.63117 260.1084 6.162858 262.7433 4.940234 -2.634918      7.898527 
1 1 1 -12 16 6  o 326.4020 4.557743 1300.302       36.25256 1299.838       57.71511 1300.605       46.59061 325.9204 7.266778 326.2604 5.860004 -0.3400269     9.335186 
1 1 1 -12 16 7  o 48.27093 3.225835 28.54174       3.772803 23.56142       6.642566 30.91346       4.583947 43.42913 6.474027 50.19907 3.774861 -6.769939      7.494172 
1 1 1 -12 16 8  o 32.32867 4.415721 12.99117       3.387941 12.23807       6.160669 13.31767       4.056392 31.03525 8.071131 32.60887 5.285455 -1.573618      9.647756 
1 1 1 -12 16 9  o 281.9034 5.229718 970.6085       35.92648 918.0287       61.59605 997.7181       44.22886 273.3126 9.261576 285.6509 6.353807 -12.33832      11.23155 
1 1 1 -12 16 10 o 206.1925 3.288723 518.5327       16.52480 489.1648       25.97340 538.5040       21.41885 200.0387 5.332933 210.0623 4.184196 -10.02353      6.778471 
1 1 1 -12 16 11 o 187.1487 3.491327 427.2450       15.92259 433.2169       23.13847 421.8734       21.94479 188.2676 5.047949 185.8068 4.850709 2.460800       7.000798 
1 1 1 -12 16 12 o 205.2673 3.681295 514.0667       18.41435 507.6920       26.41742 520.0912       25.68182 203.7748 5.324465 206.3406 5.107460 -2.565796      7.378081 
1 1 1 -12 16 13 o 26.28936 5.616918 8.770271       3.489182 12.80716       5.920318 6.621855       4.318976 31.69831 7.733922 23.19698 7.032019 8.501328       10.45289 
1 1 1 -12 16 14 o 112.2641 2.924725 153.8062       7.994516 159.2760       12.17441 149.6595       10.60025 114.1337 4.385375 110.6677 3.936873 3.465904       5.893258 
1 1 1 -12 16 15 f 241.5888 4.063570 712.4474       23.92327 688.8770       33.91837 735.7812       33.74752 237.3244 5.864843 245.3050 5.645461 -7.980576      8.140491 
1 1 1 -12 16 16 o 144.5628 3.119276 254.9232       10.98870 265.3544       16.64967 246.8727       14.62684 147.3172 4.643642 142.1323 4.227704 5.184906       6.279880 
1 1 1 -12 16 17 o 181.4308 3.431109 401.6612       15.16987 406.9231       22.38333 397.1910       20.63056 182.3929 5.040775 180.2428 4.700974 2.150146       6.892646 
1 1 1 -12 16 18 f 168.6631 3.313779 347.1182       13.62008 350.6157       20.18887 344.1968       18.45156 169.2948 4.898795 167.7871 4.516830 1.507736       6.663328 
1 1 1 -12 16 19 o 175.3181 3.381804 375.1090       14.44812 380.5791       21.42238 370.5447       19.56866 176.3555 4.989758 174.0669 4.617348 2.288574       6.798351 
1 1 1 -12 16 20 o 280.0139 5.190958 959.2109       35.42119 987.0498       63.26558 946.4998       42.74962 282.6925 9.195922 277.8850 6.312931 4.807526       11.15429 
1 1 1 -12 16 21 o 33.47190 5.178166 14.02807       4.087463 20.07388       10.08608 12.84003       4.471069 39.53222 10.35007 31.86128 5.978060 7.670933       11.95245 
1 1 1 -12 16 22 o 79.95262 3.894625 78.27480       7.565296 0.000000       0.000000 78.27480       7.565296 ?        ?        79.95262 3.894625 0.000000       3.894625 
1 1 1 -12 16 23 o 149.3120 3.198421 272.1533       11.63768 273.0483       17.33279 271.4185       15.70385 149.3104 4.769798 148.9313 4.331575 0.3791351      6.443098 
1 1 1 -12 16 24 o 219.0157 3.852109 586.1774       20.55938 582.1545       29.79648 589.8330       28.40417 217.8332 5.617816 219.4083 5.312426 -1.575150      7.731864 
1 1 1 -12 16 25 o 115.5947 3.441185 163.3616       9.682734 166.4013       12.81970 159.3245       14.77428 116.5239 4.523270 113.8848 5.338445 2.639076       6.997068 
1 1 1 -12 16 26 o 91.80738 3.030380 103.0274       6.770414 103.7012       10.41752 102.5347       8.908274 91.90683 4.666639 91.47802 4.005853 0.4288101      6.150153 
1 1 1 -12 16 27 o 136.4686 3.140796 227.4893       10.44501 227.5653       15.50490 227.4261       14.13315 136.2049 4.678273 136.2406 4.262174 -0.3569031E-01 6.328694 
1 1 1 -12 16 28 o 20.92961 6.540563 5.359845       3.701970 2.101386       6.166181 7.196232       4.629055 19.98652 8.111210 24.03681 7.278702 -4.050283      10.89822 
1 1 1 -12 16 29 f 26.41325 7.420516 8.887167       4.972612 8.696400       6.050702 9.284092       8.727842 26.56155 8.370565 28.71082 10.07913 -2.149269      13.10173 
1 1 1 -12 16 30 o 149.7131 3.260549 274.1510       11.89561 283.2643       17.80911 266.8096       15.98430 151.7625 4.821619 147.3849 4.455575 4.377686       6.565071 
1 1 1 -12 16 31 o 71.18583 4.535965 62.52013       7.827702 64.06813       10.93226 60.89156       11.21316 71.65209 6.325927 69.74484 6.679019 1.907249       9.199274 
1 1 1 -12 16 32 o 49.68190 4.359829 30.58422       5.224966 24.95733       7.153665 37.01847       7.649686 44.26362 6.853319 54.35871 5.867686 -10.09509      9.022069 
1 1 1 -12 16 33 o 77.11774 3.220491 73.03822       6.038868 86.12224       9.556158 64.33945       7.791871 83.38828 4.721941 72.10568 4.456186 11.28260       6.492635 
1 1 1 -12 16 34 o 53.62703 3.638048 35.54348       4.726173 41.43765       7.350343 31.38909       6.170928 57.48843 5.306617 50.02011 5.135407 7.468315       7.384619 
1 1 1 -12 16 35 o 42.53261 4.655276 22.72631       4.746348 23.13411       6.670135 22.30802       6.755376 42.26663 6.699051 41.40326 6.940856 0.8633690      9.646386 
1 1 1 -12 16 36 o 22.14350 6.993563 6.288492       4.221550 13.86744       9.928758 4.616002       4.664145 31.96026 10.76771 20.27630 7.340530 11.68396       13.03177 
1 1 1 -12 16 37 o 19.06357 6.456267 4.460918       3.569610 0.6347008      5.679636 6.959061       4.589277 17.52005 7.492180 23.03840 7.293784 -5.518353      10.45620 
1 1 1 -12 16 38 o 17.36041 6.305516 3.414660       3.445313 3.277218       5.506771 3.503065       4.416481 19.34674 7.730202 18.45518 7.051328 0.8915615      10.46314 
1 1 1 -12 16 39 o 47.88910 3.995334 29.10454       4.620133 30.16848       7.005639 28.28565       6.146120 47.48889 6.201715 46.37119 5.549011 1.117706       8.321826 
1 1 1 -12 16 40 o 16.04101 6.556596 1.989762       4.063592 0.2202188      7.302309 2.783551       4.890822 18.37130 8.158824 17.74879 7.216169 0.6225128      10.89218 
1 1 1 -12 16 41 o 21.53371 6.864532 6.675728       4.059091 10.75350       5.664873 2.372938       5.819076 26.40701 8.063318 17.96716 7.630133 8.439844       11.10117 
1 1 1 -12 16 42 o 51.68751 3.948819 34.76117       4.936152 34.27569       7.305964 35.16890       6.695468 49.10257 6.246956 50.50637 5.530308 -1.403801      8.343186 
1 1 1 -12 16 43 o 15.24367 6.649427 1.097603       4.652480 2.837636       5.543343 -3.049006      8.557355 17.42286 7.424755 16.76759 7.929031 0.6552792      10.86262 
1 1 1 -12 16 44 o 22.99995 6.962132 8.545850       4.235703 14.18333       6.328797 3.971830       5.700696 27.98180 8.518501 17.95702 7.585580 10.02478       11.40640 
1 1 1 -12 16 45 o 14.39646 6.233534 1.597382       4.026248 1.548620       5.974683 1.637948       5.449444 15.96949 7.212989 15.64477 6.991520 0.3247194      10.04533 
1 1 1 -12 16 46 o 32.40373 5.962274 16.36955       4.534636 23.42118       7.076247 11.45594       5.906882 35.19664 8.372640 23.75616 8.295278 11.44048       11.78612 
1 1 1 -12 16 47 o 14.54617 6.311305 2.210616       4.144592 5.179883       8.672555 1.331758       4.718259 17.96849 8.327317 14.31197 6.441944 3.656513       10.52819 
1 1 1 -12 17 1  f 428.0288 5.737516 2239.242       59.84571 2276.796       95.48549 2214.947       76.80218 430.5923 9.099865 425.2598 7.411107 5.332520       11.73593 
1 1 1 -12 17 2  o 202.0129 3.658152 497.8563       18.00848 504.7692       25.05374 490.4666       25.90316 203.2956 5.057180 200.3004 5.311512 2.995148       7.333978 
1 1 1 -12 17 3  o 195.8562 3.535875 467.9285       16.87603 444.7827       32.51055 476.4657       19.74458 190.5027 7.015030 197.5956 4.100477 -7.092987      8.125549 
1 1 1 -12 17 4  o 414.2618 5.594932 2097.001       56.48145 2015.776       87.45082 2155.132       73.98172 405.2893 8.854471 419.5615 7.235902 -14.27213      11.43503 
1 1 1 -12 17 5  o 157.0724 2.908666 300.8448       11.13345 311.4393       18.39917 294.7247       13.98420 159.6423 4.734720 155.4296 3.692050 4.212692       6.004066 
1 1 1 -12 17 6  o 407.6245 5.513101 2030.231       54.76364 2009.739       86.51975 2043.930       70.73728 404.6939 8.773088 408.6194 7.103842 -3.925476      11.28856 
1 1 1 -12 17 7  o 216.6021 3.814954 572.4318       20.13669 567.9545       28.78121 576.7250       28.18336 215.5277 5.484322 217.2728 5.322937 -1.745087      7.642738 
1 1 1 -12 17 8  o 178.9504 4.833146 391.3390       21.05721 379.6978       30.87392 401.4642       28.79358 175.9464 7.216022 181.0327 6.537569 -5.086304      9.737082 
1 1 1 -12 17 9  o 226.2695 3.932446 624.7593       21.68327 629.4623       31.31902 620.4296       30.04989 226.9360 5.663287 225.3251 5.472643 1.610886       7.875446 
1 1 1 -12 17 10 o 203.5316 3.673423 505.4255       18.21960 525.1022       26.75652 488.4139       24.87866 207.2367 5.302537 199.8858 5.111699 7.350891       7.365213 
1 1 1 -12 17 11 o 232.7198 3.558216 660.7517       20.17910 661.6951       32.54160 660.1624       25.72154 232.6435 5.740000 232.5211 4.539400 0.1224060      7.318043 
1 1 1 -12 17 12 o 38.13163 3.765560 17.91519       3.453431 20.03201       6.300248 17.00599       4.128996 39.91556 6.715235 37.02411 4.680832 2.891449       8.185632 
1 1 1 -12 17 13 o 213.3346 3.780339 555.4083       19.65297 579.2979       28.95719 535.0071       26.75970 217.6201 5.464684 209.1613 5.254212 8.458771       7.580865 
1 1 1 -12 17 14 o 167.9341 2.963801 343.9704       12.12897 325.6075       19.47266 355.6108       15.50377 163.1745 4.902636 170.7021 3.727026 -7.527557      6.158454 
1 1 1 -12 17 15 o 63.01068 2.839866 48.52156       4.349412 46.64169       7.814161 49.36539       5.235358 61.54590 5.260501 63.51707 3.394691 -1.971169      6.260735 
1 1 1 -12 17 16 o 104.0536 2.973363 132.1794       7.531744 124.1679       11.44033 138.3082       10.00615 100.7008 4.674725 106.3706 3.866630 -5.669739      6.066621 
1 1 1 -12 17 17 o 218.2887 3.832663 581.7418       20.38768 576.6271       29.53151 586.3993       28.18097 217.0139 5.588865 218.9658 5.281332 -1.951920      7.689466 
1 1 1 -12 17 18 o 173.9784 3.390929 369.4104       14.37640 396.8274       21.90106 348.6518       19.05695 180.0780 4.995605 168.8363 4.636208 11.24174       6.815460 
1 1 1 -12 17 19 o 84.01679 3.010253 86.23669       6.153224 78.81333       9.590257 91.43092       8.022150 80.12734 4.935441 86.44543 3.817553 -6.318085      6.239575 
1 1 1 -12 17 20 o 128.4426 4.146613 201.7797       12.96192 0.000000       0.000000 201.7797       12.96192 ?        ?        128.4426 4.146613 0.000000       4.146613 
1 1 1 -12 17 21 f 272.6539 5.153584 909.9394       34.24184 902.7644       61.17122 913.2136       41.32256 270.0353 9.309805 272.8619 6.214529 -2.826599      11.19343 
1 1 1 -12 17 22 o 40.01686 4.141549 19.78047       3.980397 16.75537       6.714021 21.41992       4.942665 36.19630 7.839035 41.54013 4.981938 -5.343838      9.288175 
1 1 1 -12 17 23 o 53.51830 3.551734 35.13822       4.605902 27.59829       7.536772 39.63276       5.818950 46.90882 6.790465 56.77641 4.236256 -9.867584      8.003517 
1 1 1 -12 17 24 o 91.10824 3.528943 101.5548       7.820174 95.03689       10.74395 108.8986       11.40436 87.94145 5.034460 94.16289 4.987777 -6.221436      7.086868 
1 1 1 -12 17 25 o 207.8449 3.750071 528.0549       18.99393 540.3973       28.07583 517.6387       25.79218 209.8038 5.496134 205.4283 5.156264 4.375519       7.536216 
1 1 1 -12 17 26 o 71.18545 3.154202 62.01732       5.458045 57.44273       8.698470 64.98808       7.009723 68.22564 5.272785 72.78215 3.967209 -4.556511      6.598561 
1 1 1 -12 17 27 o 87.65707 3.061090 93.98001       6.528782 95.01818       10.32640 93.28867       8.426723 87.89149 4.840007 87.21978 3.975125 0.6717148      6.263169 
1 1 1 -12 17 28 o 121.4676 3.139357 180.4302       9.284810 178.9097       13.93907 181.6429       12.44842 120.6719 4.749419 121.7004 4.203767 -1.028496      6.342605 
1 1 1 -12 17 29 o 67.34335 3.318485 55.60220       5.429142 51.54371       8.547941 58.34645       7.028953 64.47790 5.492432 68.86217 4.208750 -4.384270      6.919565 
1 1 1 -12 17 30 o 87.30416 4.563969 93.89195       9.676158 89.37990       13.00960 99.47838       14.47585 84.74286 6.345853 89.32195 6.699238 -4.579094      9.227656 
1 1 1 -12 17 31 o 69.07157 3.305091 58.56003       5.546983 68.11461       8.852131 52.38273       7.117728 74.18963 4.924173 65.10545 4.514251 9.084175       6.680265 
1 1 1 -12 17 32 o 67.90298 3.261508 56.64479       5.381108 60.00156       8.571124 54.46091       6.913393 69.48901 5.097034 66.37674 4.297140 3.112267       6.666720 
1 1 1 -12 17 33 o 24.84611 6.782838 8.013960       4.221118 12.78792       6.585140 4.684241       5.499576 31.10889 8.463386 21.38528 7.933112 9.723606       11.60014 
1 1 1 -12 17 34 o 17.74034 6.637292 3.099062       3.865640 8.622964       5.753931 -1.445208      5.218837 25.90330 8.162652 15.57925 6.909291 10.32404       10.69426 
1 1 1 -12 17 35 o 42.60767 4.159379 22.71861       4.263762 12.75697       6.685636 29.54789       5.535602 30.70384 8.596504 48.46475 4.747938 -17.76091      9.820530 
1 1 1 -12 17 36 o 51.91919 4.339782 33.85557       5.440572 47.73608       12.53142 30.63154       6.039453 59.14248 8.976515 49.07816 5.125246 10.06432       10.33663 
1 1 1 -12 17 37 o 35.48836 4.782764 16.15744       4.030998 22.78372       6.450484 11.91175       5.163354 41.40928 6.614789 29.50979 7.236382 11.89949       9.804114 
1 1 1 -12 17 38 f 71.93610 3.379390 64.61875       5.907527 69.75059       9.103093 60.88506       7.764644 73.62278 5.105512 69.08718 4.638872 4.535599       6.898216 
1 1 1 -12 17 39 o 22.32476 6.497373 6.895891       3.747427 9.936131       5.865976 4.799568       4.870970 26.13863 8.242401 19.93462 7.452108 6.204010       11.11175 
1 1 1 -12 17 40 o 27.38715 6.239611 10.55433       4.071045 7.504533       5.961740 13.21897       5.572594 22.92800 8.299246 29.82724 7.635167 -6.899237      11.27711 
1 1 1 -12 17 41 o 34.68297 5.024299 16.26763       4.122938 13.33659       6.084617 18.75583       5.606158 28.99094 8.230504 36.05492 6.624696 -7.063980      10.56541 
1 1 1 -12 17 42 o 24.62258 7.622923 9.611475       5.041533 10.53812       6.226480 7.847497       8.590769 25.11645 8.526724 22.65428 9.422933 2.462175       12.70813 
1 1 1 -12 17 43 o 14.42629 6.374355 0.5782655      4.402153 2.135947       5.423369 -2.430139      7.536989 16.61082 7.213268 15.95508 7.513192 0.6557436      10.41534 
1 1 1 -12 17 44 f 14.09136 6.141533 1.121968       3.961657 2.576188       5.995301 -0.5182849E-02 5.278214 16.90624 7.455857 14.68460 6.690475 2.221642       10.01760 
1 1 1 -12 17 45 o 10.22624 4.948181 -4.190063      3.775501 -2.131227      5.802559 -5.701628      4.971899 13.76089 6.513762 11.32763 5.525870 2.433257       8.541916 
1 1 1 -12 17 46 o 9.485952 4.693244 -6.696676      4.016333 -22.35048      7.650515 -0.7411636     4.718894 10.43398 5.318645 13.13119 6.105060 -2.697211      8.096896 
1 1 1 -12 18 1  o 180.4370 4.861254 397.9646       21.35571 391.3064       28.92209 405.9469       31.66734 178.6707 6.654259 181.9023 7.157904 -3.231659      9.773165 
1 1 1 -12 18 2  o 249.2480 4.751790 758.7235       28.86190 726.9275       48.54381 776.1088       35.89540 243.2738 8.200184 251.9365 5.846710 -8.662704      10.07110 
1 1 1 -12 18 3  o 189.1288 3.986006 436.5453       18.37095 437.2110       31.67641 436.2078       22.55081 188.8431 6.894909 188.9138 4.902636 -0.7069397E-01 8.460237 
1 1 1 -12 18 4  o 184.2890 3.489719 414.3285       15.67205 408.9566       22.59284 419.3108       21.75799 182.8940 5.074055 185.2265 4.824468 -2.332474      7.001538 
1 1 1 -12 18 5  f 123.1297 3.046079 184.9026       9.139870 174.9337       13.28979 193.8493       12.59004 119.6072 4.567975 125.9580 4.107204 -6.350830      6.142924 
1 1 1 -12 18 6  o 192.6492 4.064973 452.9766       19.08363 442.1751       32.93077 458.4382       23.41644 189.8736 7.129737 193.6633 4.965876 -3.789749      8.688675 
1 1 1 -12 18 7  o 142.1827 2.840508 246.5256       9.841899 243.4683       15.99946 248.3867       12.48309 141.1226 4.658737 142.6376 3.594166 -1.514969      5.884034 
1 1 1 -12 18 8  o 268.0627 5.080956 877.9144       33.19082 928.7285       61.21783 856.7586       39.50041 274.7312 9.156746 264.6514 6.124791 10.07974       11.01631 
1 1 1 -12 18 9  o 254.2374 3.798323 788.7744       23.53247 784.3882       37.66615 791.5827       30.13841 253.2219 6.103990 254.5653 4.858307 -1.343338      7.801400 
1 1 1 -12 18 10 o 232.5422 3.572405 659.8031       20.24410 662.3087       32.76671 658.2562       25.74552 232.7218 5.777762 232.1689 4.550525 0.5529327      7.354578 
1 1 1 -12 18 11 o 126.7999 2.722793 196.0673       8.413363 203.2267       14.27983 192.2607       10.41254 128.9182 4.552551 125.4873 3.408182 3.430901       5.686953 
1 1 1 -12 18 12 o 135.1855 2.752644 222.8675       9.068099 236.5009       15.35314 215.5636       11.23765 139.0812 4.536010 132.8722 3.473585 6.208954       5.713245 
1 1 1 -12 18 13 o 82.68672 3.053384 83.51330       6.141956 100.1668       9.866361 72.97630       7.848062 90.44842 4.490347 77.19611 4.187550 13.25231       6.139934 
1 1 1 -12 18 14 o 240.3565 3.647944 705.0986       21.36683 731.8819       35.22844 689.5121       26.87427 244.5444 5.911526 237.5612 4.642212 6.983185       7.516400 
1 1 1 -12 18 15 o 114.6480 2.658403 160.3050       7.427171 184.8860       13.33368 149.2471       8.943047 122.9400 4.458003 110.5442 3.323586 12.39578       5.560576 
1 1 1 -12 18 16 o 64.65964 2.867326 51.09990       4.506766 68.34909       8.522430 44.40377       5.309956 74.63440 4.709868 60.20344 3.636328 14.43096       5.950272 
1 1 1 -12 18 17 o 278.0651 4.534489 944.9389       30.72634 927.7714       43.84245 961.5106       43.07493 275.0822 6.540279 280.0994 6.310682 -5.017212      9.088452 
1 1 1 -12 18 18 o 149.6447 3.234784 273.2971       11.79622 261.3186       17.31736 283.6666       16.11247 146.0979 4.870899 152.2962 4.345914 -6.198288      6.527835 
1 1 1 -12 18 19 o 22.48262 6.949261 6.187684       4.191785 0.000000       0.000000 6.187684       4.191785 ?        ?        22.48262 6.949261 0.000000       6.949261 
1 1 1 -12 18 20 o 43.14153 4.405240 22.98850       4.566351 23.59974       10.35789 22.84105       5.087419 42.79425 10.09657 42.92415 4.954433 -0.1299057     11.24665 
1 1 1 -12 18 21 o 39.60510 4.264797 19.39621       4.051296 28.08624       7.448513 15.74535       4.827882 47.37040 6.634109 35.38576 5.799488 11.98465       8.811666 
1 1 1 -12 18 22 o 176.8583 3.470425 382.0219       14.95700 370.1012       21.89001 392.4610       20.48463 173.7493 5.175725 179.0208 4.699637 -5.271423      6.991045 
1 1 1 -12 18 23 o 52.46606 3.640769 33.79354       4.625998 35.83897       7.938338 32.74176       5.692431 53.67423 6.181928 51.52426 4.581392 2.149967       7.694503 
1 1 1 -12 18 24 o 209.3338 4.378603 536.2608       22.33628 542.0444       28.49620 527.0457       35.96994 210.1053 5.570539 206.6602 7.153228 3.445145       9.066399 
1 1 1 -12 18 25 o 148.7495 3.650879 270.4902       13.23394 274.9494       24.33301 268.6172       15.77025 149.2418 6.707807 148.0635 4.375535 1.178345       8.008744 
1 1 1 -12 18 26 o 115.0874 3.128857 161.9370       8.766909 164.8954       13.47808 159.7674       11.54234 115.8720 4.783527 114.1643 4.155782 1.707733       6.336612 
1 1 1 -12 18 27 o 146.5165 3.250725 262.3887       11.60654 264.2458       17.40162 260.9005       15.57767 146.6674 4.875556 145.8475 4.387951 0.8199005      6.559357 
1 1 1 -12 18 28 o 224.7142 3.970128 618.5467       21.74058 631.2433       32.05223 607.7279       29.58714 226.2503 5.818264 222.2150 5.463785 4.035309       7.981550 
1 1 1 -12 18 29 o 87.28300 3.860122 93.54070       8.190139 94.72018       10.34407 91.55888       13.40848 87.63729 4.862644 85.76218 6.463320 1.875114       8.088251 
1 1 1 -12 18 30 o 103.4519 4.506727 131.8366       11.33424 132.2556       15.81551 131.3942       16.25146 103.0759 6.326847 102.6681 6.529451 0.4077988      9.091904 
1 1 1 -12 18 31 o 64.19843 3.394351 50.66610       5.291407 54.71215       8.422867 48.02823       6.800977 66.32205 5.254447 62.28660 4.511217 4.035454       6.925337 
1 1 1 -12 18 32 f 15.28107 6.111303 1.507123       3.444970 3.702610       6.105688 0.4817781      4.172574 21.07475 8.226404 15.44338 6.504901 5.631363       10.48749 
1 1 1 -12 18 33 o 62.02704 3.498666 47.47914       5.266905 59.21154       8.680040 40.64215       6.626144 68.78665 5.217137 57.04117 4.811734 11.74548       7.097274 
1 1 1 -12 18 34 o 44.73947 4.746363 25.17855       5.095881 16.53771       7.205390 33.82550       7.207937 34.97979 8.530600 51.54978 5.840627 -16.56999      10.33847 
1 1 1 -12 18 35 o 54.95237 4.996140 38.17700       6.617411 28.22469       12.01035 42.51524       7.929589 44.14674 11.15997 57.70207 5.714240 -13.55532      12.53784 
1 1 1 -12 18 36 o 52.65057 3.776885 34.65276       4.813690 43.65043       8.040778 29.62678       6.009574 58.21154 5.743034 48.10939 5.208985 10.10215       7.753448 
1 1 1 -12 18 37 o 62.75579 3.612741 49.27493       5.501579 46.08512       8.239144 51.84158       7.390646 59.50790 5.753277 63.75267 4.792241 -4.244766      7.487708 
1 1 1 -12 18 38 o 35.78701 4.763276 16.64463       4.050949 11.73643       6.145126 20.41679       5.387215 28.39416 8.336096 39.12934 5.827197 -10.73519      10.17088 
1 1 1 -12 18 39 f 36.56741 5.592687 18.01010       4.825556 14.31936       8.311660 19.88667       5.926704 29.86990 9.846839 37.72783 6.691374 -7.857927      11.90524 
1 1 1 -12 18 40 o 24.60278 6.584204 8.777793       4.025165 11.22546       5.743102 6.414628       5.643100 26.91189 8.098304 21.44592 8.020230 5.465973       11.39766 
1 1 1 -12 18 41 o 18.04997 6.669063 4.316120       3.879648 6.257003       5.598677 2.523166       5.381091 20.89497 7.949860 17.38204 7.357583 3.512930       10.83210 
1 1 1 -12 18 42 o 15.04993 6.566329 1.001148       4.539016 0.6164064      5.492366 1.830006       8.061478 15.79732 7.042061 18.57097 8.384132 -2.773653      10.94917 
1 1 1 -12 18 43 o 11.39781 5.288391 -1.718029      3.513235 -1.658880      5.350101 -1.762872      4.658347 13.97519 6.498514 13.06936 6.072723 0.9058304      8.894304 
1 1 1 -12 18 44 o 26.94622 6.283687 11.41341       4.049970 8.207419       6.165281 13.84698       5.371469 21.04288 8.251040 28.13820 7.639020 -7.095327      11.24430 
1 1 1 -12 18 45 o 12.98977 5.816662 0.4169624      3.792153 4.313099       6.019120 -2.147324      4.883140 17.42770 7.583236 12.68686 5.996434 4.740831       9.667610 
1 1 1 -12 18 46 o 25.75455 7.194018 11.96350       4.687937 15.76245       10.12937 10.92802       5.288383 22.96889 9.916154 23.46047 7.858065 -0.4915867     12.65224 
1 1 1 -12 19 1  o 198.7257 4.169695 482.1484       20.19270 467.5318       23.96519 517.9247       37.49356 195.5370 5.033582 205.3746 7.504204 -9.837585      9.036040 
1 1 1 -12 19 2  o 100.5273 2.576699 123.3065       6.307043 111.1185       9.389977 133.3249       8.513331 95.32285 4.051567 104.4852 3.347877 -9.162384      5.255804 
1 1 1 -12 19 3  o 211.7495 3.339621 547.0092       17.23279 513.2578       26.14235 572.9454       22.91668 204.8590 5.240953 216.6179 4.341315 -11.75885      6.805483 
1 1 1 -12 19 4  o 216.7741 3.799045 573.4843       20.06864 582.0285       40.10647 570.6304       23.17921 217.7334 7.570323 216.1746 4.400054 1.558823       8.756156 
1 1 1 -12 19 5  o 199.5318 3.282269 485.6838       15.95961 470.1420       25.39599 495.8277       20.51718 196.0499 5.320644 201.5295 4.177754 -5.479645      6.764827 
1 1 1 -12 19 6  o 129.9357 2.780389 205.8922       8.803797 197.5376       14.27326 211.0225       11.18486 127.0921 4.616264 131.4652 3.494369 -4.373116      5.789690 
1 1 1 -12 19 7  o 190.5361 3.584973 442.9888       16.64559 515.4873       38.14820 425.9396       18.49959 204.8674 7.654723 186.7948 4.064069 18.07259       8.666685 
1 1 1 -12 19 8  o 315.1449 4.469587 1212.892       34.32526 1152.213       53.20690 1256.149       44.92397 306.6214 7.120810 320.4747 5.752389 -13.85327      9.154011 
1 1 1 -12 19 9  o 198.8366 3.276426 482.3286       15.87570 465.5760       25.28282 493.2336       20.39858 195.0810 5.323295 200.9943 4.164665 -5.913345      6.758839 
1 1 1 -12 19 10 o 353.4523 4.904143 1526.587       42.24059 1452.291       65.38630 1579.801       55.33771 343.9865 7.800262 359.2176 6.321608 -15.23105      10.04026 
1 1 1 -12 19 11 o 227.7493 3.954835 633.2328       21.94934 626.6727       31.57493 639.3674       30.53339 226.2536 5.731398 228.6459 5.479935 -2.392303      7.929603 
1 1 1 -12 19 12 o 50.54691 3.656360 31.34701       4.473363 44.91442       7.259826 23.04284       5.679705 60.41529 4.975143 43.05228 5.542109 17.36301       7.447619 
1 1 1 -12 19 13 o 169.2601 3.014921 349.4962       12.43559 343.1035       20.19956 353.3978       15.78061 167.4596 4.955342 170.1409 3.806089 -2.681335      6.248338 
1 1 1 -12 19 14 o 138.1573 2.808121 232.8249       9.454221 237.9145       15.91002 230.0467       11.75467 139.4448 4.688677 137.2430 3.517567 2.201813       5.861482 
1 1 1 -12 19 15 o 203.9406 3.314283 507.5775       16.47136 512.0827       27.04373 504.9207       20.76776 204.4995 5.431539 203.3096 4.191754 1.189941       6.860934 
1 1 1 -12 19 16 o 98.13962 3.035389 117.6303       7.250573 128.6932       11.57646 110.4894       9.300786 102.4987 4.646780 95.02412 4.025638 7.474586       6.148035 
1 1 1 -12 19 17 o 127.0586 3.501785 197.2386       10.83217 244.2643       22.33001 182.7673       12.38724 140.9631 6.518154 122.2351 4.164639 18.72798       7.735021 
1 1 1 -12 19 18 o 268.6351 5.099366 883.1390       33.38221 953.1414       62.38776 855.0568       39.51475 277.5555 9.236742 264.0706 6.140489 13.48486       11.09157 
1 1 1 -12 19 19 o 137.1955 3.586645 230.0225       11.98096 242.8511       23.07497 225.2875       14.01870 140.4508 6.761741 135.6946 4.244668 4.756226       7.983630 
1 1 1 -12 19 20 o 60.42186 3.518858 44.73664       5.158798 43.21215       8.432322 45.64855       6.521692 59.06521 5.938927 60.93791 4.421822 -1.872700      7.404280 
1 1 1 -12 19 21 o 111.8001 3.109064 152.7067       8.462251 156.9339       13.23905 149.7866       11.00351 113.1280 4.813315 110.6163 4.089066 2.511742       6.315732 
1 1 1 -12 19 22 o 241.6044 4.149399 713.8363       24.43015 718.1626       35.67606 710.0164       33.52323 241.7635 6.060278 240.5638 5.718465 1.199692       8.332335 
1 1 1 -12 19 23 o 73.34204 3.812165 65.93382       6.789967 58.72311       9.625319 73.07644       9.579768 68.92351 5.784058 77.04487 5.131660 -8.121361      7.732352 
1 1 1 -12 19 24 o 168.4363 3.423567 346.6887       14.05241 373.0485       21.64550 327.4850       18.47513 174.3412 5.100334 163.4411 4.643339 10.90004       6.897391 
1 1 1 -12 19 25 o 189.3839 4.294268 439.2173       19.81839 434.2349       24.49241 448.6661       33.72870 187.9713 5.352372 190.3819 7.283494 -2.410583      9.038648 
1 1 1 -12 19 26 o 49.62661 3.950196 30.33424       4.737760 36.34816       8.566788 27.68442       5.686522 53.87195 6.667784 47.23168 5.017240 6.640266       8.344582 
1 1 1 -12 19 27 o 95.38594 3.146321 111.3450       7.303462 116.2120       11.59529 108.1443       9.403135 97.15039 4.913755 93.85648 4.121283 3.293915       6.413265 
1 1 1 -12 19 28 o 129.4711 3.923467 205.6275       12.36453 193.9065       15.16179 228.8998       21.36425 125.4677 4.968694 135.8366 6.472706 -10.36899      8.159893 
1 1 1 -12 19 29 o 81.02054 4.788389 81.05981       9.411951 72.40852       12.88840 90.94519       13.77701 75.96274 7.042637 85.31791 6.679630 -9.355171      9.706502 
1 1 1 -12 19 30 o 104.7603 3.149339 134.5273       8.030803 137.7807       12.57995 132.2896       10.43341 105.5738 4.903138 103.6589 4.138637 1.914940       6.416313 
1 1 1 -12 19 31 f 89.59419 3.169469 98.53725       6.909041 92.94884       10.70178 102.5311       9.047060 86.50201 5.099467 91.17332 4.082315 -4.671303      6.532217 
1 1 1 -12 19 32 o 59.49343 3.582703 43.69835       5.170099 42.26615       8.524000 44.53187       6.502802 57.77868 6.148273 59.83886 4.492243 -2.060181      7.614558 
1 1 1 -12 19 33 o 57.62860 4.964975 41.65780       6.904628 38.71191       13.08232 42.79523       8.129028 53.05699 10.49015 58.11136 5.818569 -5.054375      11.99579 
1 1 1 -12 19 34 o 29.60204 6.531205 11.58361       4.584855 22.30989       10.70076 9.171722       5.074210 39.55164 10.80042 26.24596 7.537298 13.30568       13.17042 
1 1 1 -12 19 35 o 47.88652 4.759238 29.06835       5.480328 54.64851       13.64995 24.15257       5.983785 62.99250 9.160378 43.18502 5.835168 19.80748       10.86102 
1 1 1 -12 19 36 o 12.26303 5.637416 -2.441412      3.860332 2.594529       6.016837 -5.964690      5.032704 19.32501 7.947375 12.44547 5.940682 6.879549       9.922321 
1 1 1 -12 19 37 o 50.42386 3.849179 32.11139       4.694026 37.52243       7.596776 28.76958       5.970076 53.28856 5.951543 46.97591 5.308038 6.312653       7.974719 
1 1 1 -12 19 38 o 74.17879 3.450831 69.23767       6.220821 68.79185       9.499948 69.57234       8.231008 72.28015 5.433212 73.44617 4.622275 -1.166023      7.133388 
1 1 1 -12 19 39 o 18.92883 6.780203 4.699446       3.966834 10.90979       5.961335 -0.2356982     5.314174 26.66434 8.294791 15.63571 6.951080 11.02862       10.82225 
1 1 1 -12 19 40 o 17.80279 6.559422 4.107841       3.748657 3.834873       5.721077 4.313205       4.962322 18.86003 7.752168 18.78993 7.391954 0.7009315E-01  10.71154 
1 1 1 -12 19 41 o 12.09749 5.703138 -3.239360      4.365097 -3.718202      5.287523 -2.214645      7.734956 13.20095 6.239525 16.59913 7.750343 -3.398189      9.949848 
1 1 1 -12 19 42 o 11.39488 5.448547 -4.020088      4.272203 -2.894282      5.392581 -5.917714      7.001164 13.51533 6.361471 14.08847 6.797640 -0.5731430     9.310007 
1 1 1 -12 19 43 o 12.58108 5.664124 -0.2469264     3.649973 0.1823273      5.457117 -0.5943994     4.909834 14.96926 6.813477 13.93575 6.388368 1.033511       9.339952 
1 1 1 -12 19 44 o 25.85842 6.345547 10.72511       3.968192 16.14217       6.412914 7.364054       5.051398 28.82932 8.529536 20.28397 7.587620 8.545345       11.41600 
1 1 1 -12 19 45 o 11.11442 5.254814 -2.198341      3.755294 0.5189127      6.136653 -3.825056      4.748126 15.05566 6.986865 11.65421 5.616839 3.401448       8.964662 
1 1 1 -12 20 1  o 211.8783 3.350937 547.7734       17.30170 572.7165       27.69332 531.8043       22.15847 216.4232 5.250915 208.6638 4.357693 7.759430       6.823606 
1 1 1 -12 20 2  o 182.2332 3.078977 405.1150       13.67320 418.2212       21.64916 396.4177       17.63578 184.9375 4.807823 180.1913 4.016288 4.746216       6.264641 
1 1 1 -12 20 3  o 104.9866 2.637404 134.5001       6.742214 125.8396       10.12357 141.4033       9.038315 101.4375 4.103899 107.5927 3.451683 -6.155182      5.362473 
1 1 1 -12 20 4  o 217.2954 3.825797 576.3602       20.25856 563.3778       39.63536 580.9511       23.56997 214.1303 7.607800 218.0912 4.434908 -3.960907      8.806080 
1 1 1 -12 20 5  o 370.7920 5.694341 1681.936       51.45290 1650.176       101.5777 1692.897       59.67505 364.8939 11.43753 371.7466 6.587335 -6.852661      13.19887 
1 1 1 -12 20 6  o 274.9280 4.046521 922.8501       27.11045 946.4060       44.05689 908.4948       34.39308 277.9659 6.504085 272.6042 5.177290 5.361725       8.313089 
1 1 1 -12 20 7  o 224.2869 3.954285 614.1445       21.61265 625.4716       45.77654 610.8953       24.51728 225.4290 8.347333 223.6279 4.498941 1.801147       9.482533 
1 1 1 -12 20 8  o 159.2747 2.966498 309.4496       11.51402 317.5572       19.14405 304.8548       14.41203 161.1193 4.881479 158.0350 3.742274 3.084229       6.150890 
1 1 1 -12 20 9  o 176.8991 3.102742 381.7730       13.37542 418.1502       22.79929 362.6828       16.51626 184.8727 5.065495 172.3537 3.932375 12.51898       6.412707 
1 1 1 -12 20 10 o 187.9935 3.199709 431.2076       14.65850 434.3246       23.96779 429.3450       18.52753 188.3853 5.225945 187.5093 4.054698 0.8759613      6.614460 
1 1 1 -12 20 11 o 283.3941 4.641378 981.4572       32.05338 1007.451       46.53677 957.9942       44.21310 286.6744 6.661488 279.5925 6.489173 7.081879       9.299719 
1 1 1 -12 20 12 o 104.4116 2.753105 133.0667       6.998882 124.9223       11.37417 138.0295       8.878804 100.9968 4.633772 106.2911 3.432348 -5.294319      5.766529 
1 1 1 -12 20 13 o 51.38163 3.302246 32.35143       4.112898 30.94311       7.257184 33.01780       4.991984 49.89462 6.095061 51.84440 3.981734 -1.949780      7.280382 
1 1 1 -12 20 14 o 23.67286 6.396783 7.099888       3.777026 13.09723       6.291324 3.720148       4.722853 32.01064 8.068879 19.81311 7.351272 12.19752       10.91549 
1 1 1 -12 20 15 o 169.5700 3.880617 351.1880       16.03562 379.3187       30.22963 340.1729       18.91641 175.6054 7.078640 166.7373 4.660107 8.868073       8.474889 
1 1 1 -12 20 16 o 128.1146 3.571418 200.5652       11.13914 186.1573       20.29827 206.7740       13.32478 122.9513 6.801196 130.0116 4.211288 -7.060333      7.999451 
1 1 1 -12 20 17 o 175.0541 3.078747 373.9926       13.13356 366.5962       21.54190 378.3684       16.56914 172.9905 5.115677 175.9924 3.863404 -3.001862      6.410620 
1 1 1 -12 20 18 o 71.05942 3.041203 61.74094       5.254092 61.80774       12.53122 61.72669       5.787357 70.49461 7.405019 71.02438 3.353240 -0.5297699     8.128871 
1 1 1 -12 20 19 o 114.5801 2.743380 160.1964       7.660045 164.1031       13.36500 158.2852       9.347719 115.7058 4.750093 113.8028 3.374400 1.903030       5.826659 
1 1 1 -12 20 20 o 66.72278 3.470408 54.52232       5.623355 58.88883       9.208048 51.92521       7.101433 69.09282 5.514617 64.99276 4.511796 4.100060       7.125118 
1 1 1 -12 20 21 o 136.0151 3.216486 225.9180       10.66117 229.3008       16.33852 223.4097       14.06908 136.7399 4.911194 135.0750 4.279599 1.664978       6.514200 
1 1 1 -12 20 22 o 96.56889 3.160323 114.0105       7.427104 101.7002       11.44723 122.9599       9.760322 90.93246 5.187414 100.1916 4.005651 -9.259102      6.553969 
1 1 1 -12 20 23 o 30.74886 6.544162 12.07799       4.752975 12.03072       7.385076 12.11141       6.210045 30.86579 9.158625 30.73079 8.157454 0.1349907      12.26476 
1 1 1 -12 20 24 o 214.6364 4.606386 564.5939       24.09349 566.1712       29.99187 561.7236       40.45732 214.5174 5.742428 212.7996 7.814994 1.717880       9.697918 
1 1 1 -12 20 25 f 47.26265 4.061649 27.54842       4.632636 38.17513       8.352485 22.82688       5.567475 55.30396 6.310390 42.75677 5.468399 12.54719       8.350114 
1 1 1 -12 20 26 o 116.3223 3.189578 165.5477       9.032796 158.5290       13.94963 170.6155       11.85343 113.4728 5.057401 117.9274 4.131089 -4.454605      6.530176 
1 1 1 -12 20 27 o 20.83061 7.867347 3.999154       5.459053 1.116987       6.944032 8.662567       8.832914 20.16051 8.435205 28.14049 10.11292 -7.979980      13.16905 
1 1 1 -12 20 28 o 53.40427 5.968181 35.70221       7.634373 42.62304       10.81172 28.81988       10.78161 57.88956 7.867471 46.88459 9.754647 11.00497       12.53197 
1 1 1 -12 20 29 o 17.03110 6.462704 2.608306       3.693962 4.963565       8.974816 2.127926       4.053205 25.11087 9.921702 16.97938 6.680328 8.131493       11.96106 
1 1 1 -12 20 30 o 29.58819 5.686224 11.22232       3.951018 5.149755       6.972924 14.09396       4.795058 23.30199 8.870532 33.13313 6.165600 -9.831135      10.80282 
1 1 1 -12 20 31 o 132.0870 3.252159 214.2291       10.46810 233.7483       16.52347 201.1424       13.52960 137.1963 4.950343 127.5276 4.359974 9.668663       6.596610 
1 1 1 -12 20 32 o 89.49870 3.727513 98.95073       8.111857 87.07218       16.92265 102.4944       9.242974 81.53876 8.648353 90.93003 4.182472 -9.391273      9.606616 
1 1 1 -12 20 33 o 80.98335 3.750227 81.28024       7.380889 69.70450       10.05695 94.79403       10.86627 74.20650 5.602845 86.83276 5.158489 -12.62625      7.615897 
1 1 1 -12 20 34 o 97.57964 3.734885 118.2913       8.864821 112.5804       17.96553 120.1293       10.19200 92.00574 8.095353 98.04455 4.276075 -6.038811      9.155303 
1 1 1 -12 20 35 o 32.11459 5.680274 13.54392       4.282770 18.99675       7.298913 10.68075       5.288970 36.89379 8.317723 27.86103 7.586957 9.032763       11.25817 
1 1 1 -12 20 36 o 41.86045 4.565778 22.45229       4.582110 25.75217       7.609849 20.57540       5.739123 43.21635 7.497611 39.26490 6.203806 3.951458       9.731463 
1 1 1 -12 20 37 o 60.81443 3.777289 46.76832       5.570239 47.28915       8.744220 46.41264       7.226120 59.44621 6.123671 59.77090 5.007089 -0.3246841     7.910138 
1 1 1 -12 20 38 o 9.214264 4.584313 -9.271863      4.042419 -5.646777      7.863792 -10.57385      4.712777 16.04468 7.591280 9.961931 4.955231 6.082747       9.065420 
1 1 1 -12 20 39 o 9.121603 4.510322 -7.467553      3.689700 -2.597765      5.728448 -10.92029      4.823513 14.60502 6.768303 9.954946 4.961674 4.650070       8.392147 
1 1 1 -12 20 40 o 30.40151 5.832532 13.10503       4.163913 10.81563       6.322697 14.85843       5.533271 25.58640 8.592482 31.11834 7.404581 -5.531940      11.34278 
1 1 1 -12 20 41 o 15.15924 6.633315 1.001150       4.661558 0.8105889      5.798414 1.349376       7.838306 16.18750 7.224499 18.12374 8.216347 -1.936241      10.94083 
1 1 1 -12 20 42 o 32.11614 5.769651 15.14719       4.349573 20.76505       6.593761 10.81951       5.787291 35.22663 7.878818 24.61785 8.219935 10.60877       11.38609 
1 1 1 -12 20 43 o 10.83199 5.144859 -2.826884      3.680175 -7.106779      5.695968 0.2400184      4.821708 11.82688 5.799928 14.20119 6.440498 -2.374309      8.667132 
1 1 1 -12 20 44 o 18.49915 6.584485 5.662066       3.735192 3.775572       6.022531 6.841307       4.761595 17.07295 7.503134 19.60133 7.359593 -2.528381      10.51003 
1 1 1 -12 21 1  o 63.16558 2.755902 48.75935       4.231886 44.57443       6.154696 52.51208       5.828221 60.26155 4.217751 65.48428 3.666917 -5.222721      5.588891 
1 1 1 -12 21 2  o 84.69481 2.647958 87.57274       5.458459 80.92344       8.086743 93.13766       7.398009 81.29782 4.095052 87.28642 3.485026 -5.988594      5.377254 
1 1 1 -12 21 3  o 170.3648 3.011090 354.0889       12.50086 346.0243       19.24752 359.9727       16.44028 168.1967 4.700536 171.6986 3.929221 -3.501938      6.126485 
1 1 1 -12 21 4  o 110.5202 2.649396 148.9739       7.135501 153.9620       11.07508 145.4339       9.330065 112.2093 4.056927 109.1028 3.513821 3.106544       5.367085 
1 1 1 -12 21 5  o 222.1658 4.461582 603.0507       24.15473 639.3231       43.27690 586.6379       29.11105 227.9771 7.801339 218.9729 5.455459 9.004150       9.519608 
1 1 1 -12 21 6  o 290.8699 4.749471 1034.099       33.66511 958.8147       66.58515 1059.952       39.01975 278.4928 9.826717 294.3401 5.440001 -15.84729      11.23201 
1 1 1 -12 21 7  o 173.9265 3.125015 369.0887       13.24506 335.3409       20.72550 392.3870       17.22043 165.5122 5.144777 179.2596 3.942082 -13.74736      6.481415 
1 1 1 -12 21 8  o 87.06783 3.312368 92.64458       7.015194 97.48841       10.62959 88.90677       9.337493 89.16279 4.911082 85.17967 4.514523 3.983116       6.670805 
1 1 1 -12 21 9  f 236.5788 3.670122 683.2776       21.15887 698.7501       34.52942 673.9745       26.77473 238.8708 5.931849 234.8210 4.678990 4.049850       7.555117 
1 1 1 -12 21 10 o 238.9378 3.688990 697.0200       21.47971 705.8959       34.94346 691.6293       27.23219 240.0654 5.973105 237.8643 4.698047 2.201187       7.599318 
1 1 1 -12 21 11 o 48.62707 4.924432 29.21006       5.755042 25.33449       7.546895 34.59542       8.896275 44.88498 7.138511 52.61661 7.120842 -7.731628      10.08289 
1 1 1 -12 21 12 o 161.9133 3.807479 320.1474       15.02298 350.3526       27.98095 307.9140       17.80722 168.8266 6.815207 158.6401 4.611138 10.18648       8.228587 
1 1 1 -12 21 13 o 81.44897 3.546880 81.14674       7.023050 71.76810       13.08822 84.93909       8.322716 76.11057 7.140037 83.27931 4.113752 -7.168739      8.240333 
1 1 1 -12 21 14 o 37.54937 4.444315 17.47447       3.987969 18.61527       9.018272 17.19716       4.446334 38.06716 9.696269 37.15552 5.040563 0.9116364      10.92817 
1 1 1 -12 21 15 o 46.23058 3.628670 26.26013       4.055278 16.96752       7.180855 30.61157       4.913866 36.39226 8.283765 49.88685 4.077587 -13.49459      9.232956 
1 1 1 -12 21 16 o 202.8776 3.743644 502.7760       18.50822 487.0218       26.60329 517.5540       25.76594 199.3113 5.482519 205.5425 5.148137 -6.231247      7.520727 
1 1 1 -12 21 17 o 143.2760 3.184264 250.6017       11.11779 228.9204       23.20285 257.0630       12.66653 136.2623 7.011196 145.0743 3.582870 -8.811996      7.873616 
1 1 1 -12 21 18 o 194.8933 3.282501 463.7917       15.58970 441.2188       25.19492 477.7960       19.84490 189.6595 5.457000 197.6932 4.119278 -8.033691      6.837200 
1 1 1 -12 21 19 o 79.65552 2.864716 77.54194       5.551696 75.07342       9.844999 78.69292       6.722516 78.10500 5.202156 80.19193 3.448109 -2.086937      6.241145 
1 1 1 -12 21 20 o 121.3880 2.799253 179.8506       8.280454 190.8572       14.59722 174.6283       10.05474 124.7449 4.810897 119.5089 3.456139 5.236053       5.923649 
1 1 1 -12 21 21 o 97.61958 3.198838 116.5186       7.599386 120.3415       12.10556 114.0322       9.762740 98.95821 5.036486 96.45419 4.163307 2.504013       6.534471 
1 1 1 -12 21 22 o 100.7483 3.580713 124.2365       8.777122 121.4977       11.71882 127.7359       13.24657 99.44196 4.850541 101.8777 5.354457 -2.435745      7.224815 
1 1 1 -12 21 23 o 46.34445 5.646749 26.78009       6.245737 20.83603       7.837361 37.12465       10.33913 40.26822 8.263978 54.15069 8.082141 -13.88248      11.55917 
1 1 1 -12 21 24 o 29.82002 5.700587 11.29759       3.991565 20.78469       7.363715 7.350148       4.749938 40.28669 7.782379 24.28873 7.376913 15.99796       10.72307 
1 1 1 -12 21 25 o 89.55197 3.215406 98.17971       7.005539 118.1778       12.03026 87.91872       8.617375 97.93487 5.057962 84.59233 4.193377 13.34254       6.570189 
1 1 1 -12 21 26 o 55.19221 5.213165 37.82120       6.928491 44.25862       8.996507 28.43789       10.86165 59.50584 6.299646 46.64376 9.864442 12.86207       11.70439 
1 1 1 -12 21 27 o 72.63621 4.359985 65.04179       7.681934 66.18674       9.795229 63.21242       12.38140 73.01559 5.546567 70.87453 7.271766 2.141060       9.145654 
1 1 1 -12 21 28 o 51.36106 4.159492 32.62899       5.161564 28.17849       10.43718 34.06980       5.938587 46.26338 9.573653 52.38383 4.702080 -6.120449      10.66604 
1 1 1 -12 21 29 o 74.13120 3.551274 67.61340       6.396706 87.25043       13.65498 62.09256       7.240280 83.23075 6.791404 70.89188 4.210009 12.33887       7.990453 
1 1 1 -12 21 30 o 41.97188 4.256805 21.95738       4.293750 20.65092       7.984007 22.48899       5.092954 39.45966 8.550389 42.29556 5.040330 -2.835899      9.925426 
1 1 1 -12 21 31 o 74.68859 3.837708 68.99963       6.961514 62.27170       15.88911 70.59792       7.744385 68.19701 9.845607 75.43083 4.230049 -7.233826      10.71584 
1 1 1 -12 21 32 o 94.42854 3.723221 110.3722       8.550787 108.5672       11.96055 112.2593       12.22920 92.90883 5.304773 94.46370 5.334150 -1.554871      7.522883 
1 1 1 -12 21 33 f 78.38894 3.931463 76.50104       7.486117 65.77066       15.89054 79.56185       8.486920 69.07361 9.707942 79.74035 4.384403 -10.66674      10.65209 
1 1 1 -12 21 34 o 84.59945 3.302692 88.78880       6.795738 87.49370       10.64299 89.68027       8.830142 82.82869 5.300683 84.50244 4.302233 -1.673752      6.826892 
1 1 1 -12 21 35 o 18.08434 6.729993 3.611935       3.963881 2.744166       6.800420 4.058485       4.878305 20.13252 8.379675 19.45238 7.416064 0.6801414      11.19004 
1 1 1 -12 21 36 o 48.69099 4.042233 30.14205       4.753087 33.99478       7.956756 28.00442       5.926767 50.02468 6.694962 46.20472 5.363281 3.819965       8.578304 
1 1 1 -12 21 37 o 26.36824 6.979139 9.962396       4.553946 1.365448       8.745938 13.16020       5.334088 20.27179 8.969697 30.15969 7.330299 -9.887901      11.58399 
1 1 1 -12 21 38 o 14.51543 6.166549 0.9945070      3.803185 3.326020       6.049942 -0.5288528     4.890279 18.92430 7.892406 14.80454 6.619070 4.119763       10.30059 
1 1 1 -12 21 39 o 17.14989 6.949596 3.054272       4.518717 1.658505       6.106538 4.743556       6.717998 17.45678 7.616333 20.13907 8.350968 -2.682287      11.30253 
1 1 1 -12 21 40 o 13.54908 6.215790 -1.434602      4.659999 -3.172404      5.960955 1.296553       7.472893 14.27513 6.709481 18.00569 8.105624 -3.730560      10.52227 
1 1 1 -12 21 41 o 30.12198 6.997527 14.26853       5.038078 10.08074       6.503500 20.55327       7.967060 23.68494 8.654056 33.06337 9.428400 -9.378433      12.79795 
1 1 1 -12 21 42 o 12.24564 5.600796 -0.8443712     3.745273 -2.103700      5.696395 0.1145284      4.970694 13.92864 6.550467 14.39408 6.532441 -0.4654455     9.251021 
1 1 1 -12 21 43 o 12.10826 5.553617 -0.7584723     3.717333 5.660801       5.755967 -5.351599      4.868886 18.59045 7.721209 11.33347 5.515211 7.256979       9.488658 
1 1 1 -12 21 44 o 13.07563 5.845607 0.6004280      3.813339 1.496071       6.189417 0.5244710E-01  4.841332 15.61697 7.164120 13.76159 6.321505 1.855374       9.554373 
1 1 1 -12 22 1  o 176.9619 3.390278 382.2539       14.62013 371.7948       20.25227 393.6365       21.12745 174.3049 4.772401 179.3447 4.838595 -5.039810      6.796162 
1 1 1 -12 22 2  o 219.6401 3.837194 589.1476       20.53816 591.4800       29.02631 586.8091       29.06440 219.8246 5.418506 218.9496 5.447299 0.8749847      7.683311 
1 1 1 -12 22 3  o 191.9149 3.548108 449.6409       16.59364 448.0075       23.32391 451.3150       23.61264 191.3176 5.007072 192.0154 5.050679 -0.6977844     7.111970 
1 1 1 -12 22 4  o 165.9389 3.313006 336.0733       13.39697 345.1452       19.09347 327.2761       18.80225 167.9601 4.669433 163.5433 4.722762 4.416840       6.641392 
1 1 1 -12 22 5  o 132.7556 4.396753 215.6115       14.20436 0.000000       0.000000 215.6115       14.20436 ?        ?        132.7556 4.396753 0.000000       4.396753 
1 1 1 -12 22 6  o 90.06334 3.523458 99.17277       7.718173 88.88682       13.09827 104.6439       9.552787 84.91111 6.376727 92.44752 4.251705 -7.536407      7.664179 
1 1 1 -12 22 7  o 78.59127 3.636015 75.57284       6.944765 63.19999       11.54363 82.59119       8.694109 71.46448 6.706893 82.09539 4.361455 -10.63091      8.000295 
1 1 1 -12 22 8  o 77.24099 3.634441 73.00510       6.821845 83.68436       12.19456 68.14077       8.230133 82.41046 6.115814 74.52400 4.553577 7.886459       7.624844 
1 1 1 -12 22 9  o 147.3241 3.728331 265.2092       13.37442 242.4249       22.90136 277.0020       16.47599 140.3948 6.713274 150.4696 4.498363 -10.07483      8.081047 
1 1 1 -12 22 10 o 61.34219 4.881084 46.31318       7.236323 39.77974       10.02977 53.40640       10.45061 56.40450 7.481246 65.64629 6.623212 -9.241787      9.991796 
1 1 1 -12 22 11 o 59.77613 3.478502 43.77161       5.045169 35.52194       9.835634 46.71729       5.877276 53.17494 7.823983 61.71763 3.928172 -8.542690      8.754726 
1 1 1 -12 22 12 o 163.0938 3.044480 324.6136       12.10003 321.4287       19.88375 326.4867       15.24848 161.9916 5.043117 163.4888 3.827387 -1.497208      6.331029 
1 1 1 -12 22 13 o 177.2612 3.154838 383.5246       13.62783 414.8735       23.19338 366.9948       16.84173 184.0196 5.177210 173.3086 3.987773 10.71097       6.534971 
1 1 1 -12 22 14 o 58.31306 3.303336 41.64696       4.674928 35.80094       7.979230 44.70256       5.768720 53.66617 6.216148 60.35762 3.943630 -6.691452      7.361570 
1 1 1 -12 22 15 o 116.7565 2.833817 166.3516       8.062860 148.9781       13.28266 176.4885       10.14598 110.2097 4.958415 120.1663 3.468405 -9.956635      6.051091 
1 1 1 -12 22 16 o 99.43784 2.831341 120.7653       6.853896 121.7839       11.99948 120.2720       8.350028 99.61356 4.958788 99.17625 3.460270 0.4373169      6.046739 
1 1 1 -12 22 17 o 118.4311 3.112512 171.3543       8.975036 174.2401       20.30250 170.6534       10.00581 118.7795 7.045757 118.1492 3.479033 0.6302872      7.857885 
1 1 1 -12 22 18 o 63.79869 3.089691 49.81246       4.789275 44.98029       8.456264 52.09439       5.811104 60.26183 5.831150 65.18936 3.672873 -4.927532      6.891466 
1 1 1 -12 22 19 o 194.9465 3.296975 464.2139       15.66272 472.4200       26.01099 459.5458       19.61820 196.1668 5.446479 193.8224 4.153547 2.344406       6.849532 
1 1 1 -12 22 20 o 38.41688 4.067428 18.25483       3.750065 21.35562       7.152654 17.07937       4.403863 40.97924 7.436329 36.99561 5.013729 3.983635       8.968638 
1 1 1 -12 22 21 o 185.2724 3.594548 419.6779       16.22898 420.5045       24.14729 418.9969       21.91695 184.9916 5.362148 184.7949 4.871164 0.1967010      7.244368 
1 1 1 -12 22 22 o 118.4629 2.810049 171.3722       8.112082 181.4029       14.21915 166.5322       9.877184 121.5259 4.810916 116.6576 3.478318 4.868294       5.936633 
1 1 1 -12 22 23 o 59.93756 3.658892 44.11374       5.318762 38.83495       8.607177 47.37469       6.764968 55.74381 6.455368 62.00153 4.508214 -6.257717      7.873739 
1 1 1 -12 22 24 o 83.84178 3.280863 86.09848       6.690300 96.27290       11.04116 80.19537       8.410088 88.33917 5.151261 80.76028 4.288708 7.578888       6.702873 
1 1 1 -12 22 25 o 119.5538 4.027329 175.4395       11.71645 178.3960       14.80652 170.4877       19.16258 120.3039 5.061845 117.0805 6.744901 3.223427       8.433028 
1 1 1 -12 22 26 o 142.6796 4.055807 250.0355       14.08752 262.7567       18.03879 230.1471       22.55500 145.9390 5.079989 135.8868 6.833221 10.05219       8.514647 
1 1 1 -12 22 27 o 97.65382 3.559674 117.0960       8.456842 141.2169       17.78511 110.0489       9.613161 106.1643 6.912094 94.52589 4.183662 11.63841       8.079608 
1 1 1 -12 22 28 o 64.77402 3.440001 51.62589       5.410475 58.12439       9.527188 48.53238       6.573301 68.15643 5.790946 62.61609 4.334612 5.540337       7.233527 
1 1 1 -12 22 29 o 37.42493 4.601676 17.57149       4.108502 16.24174       7.307655 18.18607       4.968028 34.92945 8.634842 37.84519 5.551878 -2.915741      10.26566 
1 1 1 -12 22 30 o 34.48756 5.292685 15.15069       4.306258 36.74156       12.30205 12.13571       4.597102 52.03047 10.06650 30.50892 6.388451 21.52155       11.92253 
1 1 1 -12 22 31 o 35.89729 5.257686 16.45164       4.462985 17.54241       9.765379 16.16367       5.017658 35.50328 10.53092 35.32845 6.045477 0.1748314      12.14282 
1 1 1 -12 22 32 o 84.66968 3.649324 88.92908       7.512000 101.1749       16.34000 85.64729       8.458904 87.71375 7.723280 82.84982 4.203470 4.863930       8.793077 
1 1 1 -12 22 33 o 49.05491 4.113918 30.25040       4.872580 25.81130       7.967714 32.90230       6.158366 43.61101 7.782785 50.79423 5.041724 -7.183220      9.273118 
1 1 1 -12 22 34 o 65.88523 3.582288 54.25684       5.729911 57.68249       9.179900 52.07034       7.334001 66.68433 5.703802 63.94075 4.740535 2.743576       7.416605 
1 1 1 -12 22 35 o 29.01068 6.146910 11.44264       4.210352 13.97116       7.214298 10.13657       5.184954 30.67540 9.039288 26.74463 7.599349 3.930771       11.80927 
1 1 1 -12 22 36 o 22.66476 6.594454 7.187123       3.860738 10.13498       6.599998 5.653738       4.760104 26.13015 8.778918 20.74801 7.427799 5.382132       11.49963 
1 1 1 -12 22 37 o 25.29410 7.011513 9.346550       4.471669 18.23950       8.891729 6.336041       5.173487 32.75671 10.12057 21.36423 7.731430 11.39248       12.73581 
1 1 1 -12 22 38 o 17.15671 6.576496 3.518715       3.849964 4.108383       6.099148 3.128134       4.963880 19.37047 7.987449 17.67309 7.237802 1.697378       10.77892 
1 1 1 -12 22 39 o 19.97005 6.906793 5.842248       4.090131 8.157612       6.641475 4.427561       5.191405 22.67167 8.650743 18.76883 7.503472 3.902847       11.45153 
1 1 1 -12 22 40 o 17.27832 7.530176 2.424448       5.955118 2.424448       5.955118 0.000000       0.000000 17.27832 7.530176 ?        ?        0.000000       7.530176 
1 1 1 -12 22 41 o 19.30782 6.705708 5.836254       3.857229 2.302999       5.770730 8.689657       5.185907 16.66844 7.334308 22.40678 7.775711 -5.738342      10.68895 
1 1 1 -12 22 42 o 20.48607 6.782997 6.977661       3.942634 6.220170       6.188443 7.495175       5.115094 19.26768 8.004557 20.56462 7.646594 -1.296938      11.06993 
1 1 1 -12 22 43 o 25.45658 6.378667 10.58430       3.948522 9.033486       6.403531 11.53566       5.015501 21.06885 8.362896 25.06889 7.573279 -4.000040      11.28240 
1 1 1 -12 23 1  o 108.2153 2.714688 142.9582       7.153219 148.6528       10.95396 138.7242       9.445245 110.2203 4.085315 106.5178 3.644139 3.702484       5.474445 
1 1 1 -12 23 2  o 136.7330 3.086626 228.1712       10.28475 248.5782       14.79072 209.0670       14.31080 142.5483 4.262648 130.6874 4.500310 11.86087       6.198626 
1 1 1 -12 23 3  f 144.2536 2.850028 253.8973       10.01871 268.8808       15.88048 243.9908       12.91274 148.2433 4.400819 141.2905 3.753653 6.952774       5.784213 
1 1 1 -12 23 4  o 52.68974 3.156192 34.00438       4.033948 34.68138       5.768485 33.35645       5.643303 53.07182 4.502738 52.04197 4.493813 1.029858       6.361525 
1 1 1 -12 23 5  o 93.59772 3.614928 107.1363       8.229695 0.000000       0.000000 107.1363       8.229695 ?        ?        93.59772 3.614928 0.000000       3.614928 
1 1 1 -12 23 6  o 82.89712 3.201518 84.00047       6.455268 105.2267       13.34287 77.51399       7.375940 92.46577 5.953138 79.57159 3.814962 12.89419       7.070629 
1 1 1 -12 23 7  o 13.82599 6.004512 -0.6198026     3.758757 9.500504       7.228696 -4.370080      4.400426 28.19460 9.176519 12.45438 5.825122 15.74021       10.86925 
1 1 1 -12 23 8  o 60.32551 3.321186 44.55917       4.863527 28.80257       7.810105 54.53953       6.215824 47.94971 6.880867 66.70996 3.839819 -18.76025      7.879755 
1 1 1 -12 23 9  o 156.6514 3.453837 299.6263       13.18476 304.9643       19.33144 294.9835       18.02877 157.7769 5.034321 155.2138 4.772172 2.563141       6.936715 
1 1 1 -12 23 10 o 140.1115 3.326318 239.6691       11.35726 232.9311       16.61095 245.5840       15.56336 137.8748 4.951986 141.6411 4.514743 -3.766266      6.701125 
1 1 1 -12 23 11 o 168.2596 3.118642 345.5706       12.78738 355.7274       21.33950 339.8800       15.97277 170.3778 5.145565 166.7815 3.930035 3.596344       6.474721 
1 1 1 -12 23 12 o 182.1921 3.207136 405.2296       14.23911 412.9087       23.57112 400.8171       17.86779 183.5348 5.275657 181.0940 4.048841 2.440765       6.650239 
1 1 1 -12 23 13 o 42.55244 4.061350 22.33186       4.160416 28.37020       7.713838 19.85479       4.940611 47.56552 6.852330 39.93262 5.200545 7.632893       8.602330 
1 1 1 -12 23 14 o 128.0508 2.901138 200.1219       9.052876 210.9524       15.60167 194.6245       11.11549 131.1794 4.889110 126.1698 3.618978 5.009636       6.082795 
1 1 1 -12 23 15 o 102.2585 2.861137 127.7250       7.122741 144.2988       12.64669 120.0253       8.619900 108.4633 4.796600 99.05595 3.576837 9.407310       5.983405 
1 1 1 -12 23 16 o 186.2204 3.604012 423.7201       16.35497 446.3144       35.57104 417.6633       18.41710 190.0255 7.697477 184.8102 4.089396 5.215240       8.716325 
1 1 1 -12 23 17 o 136.7440 2.940599 228.2832       9.798962 237.6048       16.82592 223.4991       12.05400 139.1681 4.969364 135.1815 3.662506 3.986618       6.173211 
1 1 1 -12 23 18 o 85.54553 2.930692 89.45456       6.100449 87.57160       10.81678 90.33284       7.387424 84.33147 5.290119 85.90211 3.536575 -1.570641      6.363389 
1 1 1 -12 23 19 o 115.1729 2.849863 161.9621       7.998534 160.5911       13.80367 162.6552       9.814057 114.3362 4.966056 115.3058 3.496740 -0.9696426     6.073623 
1 1 1 -12 23 20 o 141.9496 3.379594 246.2802       11.69054 235.0021       16.99577 256.4083       16.10594 138.3055 5.051208 144.5801 4.577086 -6.274567      6.816482 
1 1 1 -12 23 21 f 14.13923 5.991601 0.1333755      3.575131 -0.2853240     7.009098 0.2806173      4.156487 19.32185 8.294032 15.34751 6.479920 3.974341       10.52522 
1 1 1 -12 23 22 o 36.93978 4.396044 16.96083       3.879702 6.381588       7.545578 20.76279       4.523438 25.20110 9.302565 40.88545 4.620972 -15.68435      10.38706 
1 1 1 -12 23 23 o 148.3257 2.976678 268.9134       10.75931 284.2908       18.71474 261.3216       13.14972 151.9729 5.060430 146.0457 3.697779 5.927231       6.267498 
1 1 1 -12 23 24 f 141.2055 4.077875 244.7546       14.01736 256.3924       17.86513 226.1147       22.60955 144.2308 5.090891 134.7848 6.906619 9.445984       8.580126 
1 1 1 -12 23 25 o 73.27043 3.442885 65.90671       6.130150 67.74051       10.17357 64.86137       7.681157 73.81140 5.700194 72.52038 4.366636 1.291023       7.180510 
1 1 1 -12 23 26 o 111.0040 3.237129 151.0837       8.747233 160.6408       14.24846 145.3033       11.08117 113.9251 5.145587 108.6262 4.194031 5.298943       6.638295 
1 1 1 -12 23 27 o 65.78390 3.785854 53.36084       6.043400 53.90878       12.81527 53.20414       6.853292 64.70207 8.320168 65.57170 4.312852 -0.8696289     9.371547 
1 1 1 -12 23 28 f 53.59417 3.772741 35.52675       4.895836 38.01989       8.878262 34.43735       5.868802 54.56998 6.825175 52.56408 4.628913 2.005901       8.246808 
1 1 1 -12 23 29 o 46.41191 4.168707 26.83640       4.664663 23.51495       8.469173 28.28276       5.588769 41.98665 8.567801 47.46141 4.902623 -5.474758      9.871319 
1 1 1 -12 23 30 o 16.96955 6.289194 2.936701       3.454995 8.694559       7.183933 1.204202       3.940653 26.42273 9.152782 15.64466 6.432522 10.77807       11.18708 
1 1 1 -12 23 31 o 61.29719 4.667773 47.23677       6.920034 47.41547       13.60014 47.17434       8.038397 58.47565 9.896723 60.90914 5.473979 -2.433487      11.30971 
1 1 1 -12 23 32 o 102.5699 3.628646 130.8061       9.055572 158.6467       19.01806 122.6432       10.29790 109.9075 7.139361 98.92587 4.281861 10.98164       8.324951 
1 1 1 -12 23 33 o 41.38469 4.442974 21.80788       4.410662 27.35254       7.592594 18.98370       5.418748 44.99419 7.164681 37.88484 6.074673 7.109344       9.393312 
1 1 1 -12 23 34 o 24.76685 6.629158 8.457619       4.079917 1.912346       6.745103 12.23399       5.123443 19.29210 8.204645 29.57745 7.181205 -10.28535      10.90348 
1 1 1 -12 23 35 o 30.68114 5.974943 12.84164       4.306552 10.77222       7.036305 14.08119       5.445673 26.87117 9.064613 31.42892 7.256926 -4.557751      11.61164 
1 1 1 -12 23 36 o 48.67215 4.617670 30.98499       5.411446 22.02896       10.27207 34.42536       6.366540 35.47294 10.86303 50.86117 5.210223 -15.38823      12.04789 
1 1 1 -12 23 37 f 18.83607 6.791393 4.763609       3.987346 4.870149       6.425093 4.696877       5.085022 20.27313 8.260329 19.33978 7.519255 0.9333534      11.17015 
1 1 1 -12 23 38 o 16.73803 6.500627 3.318511       3.797410 5.114124       6.594783 2.427814       4.644716 20.19750 8.314727 16.57746 6.914624 3.620035       10.81419 
1 1 1 -12 23 39 o 16.33994 6.737064 2.748433       4.338412 1.767073       5.835933 3.960734       6.486364 16.84270 7.394479 18.83276 8.028728 -1.990059      10.91507 
1 1 1 -12 23 40 o 15.07702 6.527933 1.556904       4.415159 0.3075551E-03  5.693473 3.905123       6.992920 15.26657 6.952937 18.57390 8.126045 -3.307327      10.69467 
1 1 1 -12 23 41 o 14.80008 6.252061 2.126923       3.872616 -3.932735      5.939644 6.607576       5.107484 13.31182 6.380995 19.77445 7.576070 -6.462633      9.905248 
1 1 1 -12 23 42 o 16.58667 6.612001 4.011628       4.019506 3.388558       6.185107 4.467148       5.288498 17.00171 7.531909 17.43532 7.332390 -0.4336147     10.51159 
1 1 1 -12 24 1  o 106.5570 2.728661 138.6342       7.079623 146.7921       10.92243 132.7236       9.297029 109.5095 4.100143 104.1711 3.668083 5.338364       5.501455 
1 1 1 -12 24 2  o 127.7274 2.772106 199.0690       8.628396 203.8197       13.23514 195.5574       11.37893 129.0520 4.214152 126.4711 3.696069 2.580933       5.605355 
1 1 1 -12 24 3  o 135.5704 2.819921 224.2756       9.316185 236.5257       14.54952 215.7631       12.12859 139.0211 4.299859 132.8444 3.750298 6.176743       5.705569 
1 1 1 -12 24 4  o 110.1934 3.637065 148.4755       9.753200 0.000000       0.000000 148.4755       9.753200 ?        ?        110.1934 3.637065 0.000000       3.637065 
1 1 1 -12 24 5  o 192.8213 3.654130 454.1448       17.17019 474.8408       34.82763 447.4993       19.73525 196.3100 7.292913 191.3243 4.232885 4.985703       8.432313 
1 1 1 -12 24 6  o 106.1625 3.166560 137.7033       8.182942 154.4923       16.85956 132.5295       9.359262 112.0343 6.199489 104.0949 3.695437 7.939392       7.217334 
1 1 1 -12 24 7  o 65.36799 3.534213 52.33743       5.608877 46.37503       10.65115 54.62527       6.597792 60.96455 7.315335 66.72922 4.076844 -5.764668      8.374651 
1 1 1 -12 24 8  o 96.43783 3.207887 113.6647       7.528314 111.1278       14.72198 114.5630       8.760340 94.92194 6.401934 96.76776 3.721899 -1.845825      7.405221 
1 1 1 -12 24 9  o 138.4107 3.961906 234.3187       13.34944 240.7089       16.94064 223.8498       21.68316 140.1348 4.968617 134.8170 6.620214 5.317780       8.277342 
1 1 1 -12 24 10 o 202.0759 3.408478 498.6784       16.78461 494.5500       27.23270 501.2074       21.31433 200.7820 5.571214 202.4486 4.320369 -1.666550      7.050107 
1 1 1 -12 24 11 o 107.0670 3.302822 140.1105       8.607104 129.5592       19.88829 142.5421       9.547503 102.1541 8.054361 107.9577 3.634290 -5.803665      8.836334 
1 1 1 -12 24 12 o 179.7357 3.224584 394.4577       14.12356 428.5139       24.18663 376.8363       17.39791 186.9186 5.315302 175.5650 4.066522 11.35361       6.692461 
1 1 1 -12 24 13 o 52.76561 3.674905 34.18481       4.695809 21.85262       8.141955 40.33146       5.748144 41.32408 8.372397 57.28050 4.146045 -15.95642      9.342736 
1 1 1 -12 24 14 o 110.6132 2.932660 149.4663       7.898079 145.6904       13.40990 151.4719       9.773009 108.9259 5.065818 111.2798 3.608698 -2.353920      6.219744 
1 1 1 -12 24 15 o 117.7319 3.222218 169.4149       9.235847 195.0176       22.23660 164.0774       10.15303 125.5424 7.299942 115.8157 3.601806 9.726669       8.140158 
1 1 1 -12 24 16 o 110.5604 2.884074 149.3374       7.763740 170.2961       13.92617 139.8861       9.351854 117.7884 4.862145 106.9218 3.594292 10.86662       6.046436 
1 1 1 -12 24 17 o 113.5492 2.892160 157.5370       7.996296 149.1720       13.51526 162.0423       9.918559 110.1753 5.047300 115.0833 3.540930 -4.907928      6.165503 
1 1 1 -12 24 18 o 171.1327 3.134234 357.7849       13.07075 387.5684       22.49469 342.6034       16.06017 177.6272 5.202388 167.3346 3.938478 10.29260       6.525064 
1 1 1 -12 24 19 o 195.2857 3.801005 466.5835       18.08860 488.7505       26.76599 447.9489       24.54089 199.3459 5.515151 190.9120 5.280053 8.433929       7.635172 
1 1 1 -12 24 20 o 112.3291 3.204952 154.3506       8.764067 162.0804       13.98591 149.3529       11.24590 114.7864 5.012013 110.3389 4.190048 4.447472       6.532746 
1 1 1 -12 24 21 o 23.90978 6.872294 7.240862       4.216606 10.91510       7.186717 5.312055       5.207047 29.48969 9.096473 22.03137 7.780844 7.458315       11.97027 
1 1 1 -12 24 22 o 123.7645 3.374208 187.5687       10.16714 187.7823       15.13924 187.3932       13.72201 123.4583 5.042694 123.4517 4.569142 0.6645203E-02  6.804838 
1 1 1 -12 24 23 o 55.21444 4.012944 37.58809       5.362623 34.37892       8.598680 39.63079       6.860219 52.16968 6.935226 56.51726 5.033665 -4.347576      8.569430 
1 1 1 -12 24 24 o 32.61615 4.722349 13.36049       3.644332 14.95560       7.415294 12.85253       4.184562 33.79785 8.887025 31.79402 5.605709 2.003836       10.50729 
1 1 1 -12 24 25 o 112.7467 2.846882 155.6651       7.815596 155.9499       14.03262 155.5370       9.410259 112.2176 5.145160 112.5724 3.434329 -0.3547745     6.186056 
1 1 1 -12 24 26 o 19.28805 6.660019 4.267420       3.802466 22.74231       11.53613 2.015556       4.027542 40.89948 11.23252 16.77077 6.640166 24.12871       13.04842 
1 1 1 -12 24 27 f 87.17148 3.680803 93.67782       7.801437 128.5422       18.20320 85.83318       8.634624 100.4009 7.494077 83.26636 4.269630 17.13456       8.625018 
1 1 1 -12 24 28 o 82.36426 3.306213 83.56696       6.622505 75.80239       10.99701 87.98509       8.295364 77.53216 5.863925 84.28973 4.050396 -6.757576      7.126803 
1 1 1 -12 24 29 o 57.22881 3.674294 40.61833       5.097111 44.01693       8.954809 38.98947       6.199384 58.59256 6.374213 55.78733 4.600992 2.805225       7.861279 
1 1 1 -12 24 30 o 61.23494 4.647420 47.13352       6.883227 42.73252       12.90263 48.88428       8.137972 55.43254 9.915668 62.02277 5.439302 -6.590233      11.30958 
1 1 1 -12 24 31 o 82.72889 3.344397 84.88033       6.728449 80.66990       10.90232 87.47060       8.551235 79.35375 5.675342 83.55709 4.213210 -4.203339      7.068285 
1 1 1 -12 24 32 o 62.18152 3.562289 48.29534       5.375334 42.03612       9.018914 51.74370       6.694236 56.27839 6.708117 64.00845 4.316933 -7.730057      7.977139 
1 1 1 -12 24 33 f 51.74936 3.969805 33.88258       4.967999 50.55215       8.721770 25.87643       6.044413 62.02029 5.839504 44.29504 5.734095 17.72525       8.184110 
1 1 1 -12 24 34 o 33.32902 6.157819 15.16206       4.817143 4.880465       9.741050 18.49036       5.542258 23.24575 9.871941 36.71824 6.428031 -13.47249      11.78027 
1 1 1 -12 24 35 o 36.29249 5.202148 17.61150       4.469438 8.747328       6.944636 23.87898       5.839519 24.40187 8.938478 41.86000 5.886984 -17.45814      10.70294 
1 1 1 -12 24 36 o 13.96056 6.099666 0.2135477      3.928787 -8.077185      6.355033 5.342402       4.998406 13.09510 6.355998 20.02291 7.535579 -6.927806      9.858177 
1 1 1 -12 24 37 o 39.58523 4.899200 21.14524       4.625230 23.30583       7.357007 19.73317       5.947617 38.61452 8.078320 36.55422 6.930366 2.060303       10.64374 
1 1 1 -12 24 38 o 19.81476 7.444453 5.732835       4.873695 4.414312       6.276466 7.735168       7.734632 19.17857 8.021586 22.17230 9.052176 -2.993729      12.09495 
1 1 1 -12 24 39 o 15.83375 6.702940 2.301010       4.466929 8.065086       6.054313 -4.585495      6.617583 21.79142 8.272636 14.11093 6.756378 7.680489       10.68107 
1 1 1 -12 24 40 o 22.17837 6.932882 8.128448       4.159072 10.00097       6.747501 6.981100       5.281741 22.74836 8.709767 20.26781 7.719105 2.480553       11.63807 
1 1 1 -12 24 41 f 13.01898 5.752048 0.6201845      3.583864 -1.849752      5.906363 2.059502       4.508744 14.04573 6.625396 15.14326 6.576463 -1.097529      9.335188 
1 1 1 -12 24 42 o 18.42390 6.794879 5.712731       4.024265 3.866396       6.583626 6.814075       5.084771 17.26251 7.701617 19.39831 7.525446 -2.135796      10.76788 
1 1 1 -12 25 1  o 154.7236 2.964958 292.2249       11.17921 292.5182       17.18344 292.0097       14.72039 154.5400 4.567831 154.5125 3.912633 0.2746582E-01  6.014464 
1 1 1 -12 25 2  o 129.4949 2.822516 204.6565       8.906873 200.5156       13.41821 207.9181       11.90887 127.9667 4.309049 130.3871 3.751902 -2.420410      5.713552 
1 1 1 -12 25 3  o 59.54103 3.380130 43.43505       4.884254 26.45571       7.563333 55.58142       6.396996 45.86177 6.987976 67.32166 3.916193 -21.45990      8.010517 
1 1 1 -12 25 4  o 104.4198 3.119899 133.2349       7.929978 132.3527       10.49995 134.4062       12.09854 103.9581 4.153055 104.6807 4.755168 -0.7225647     6.313437 
1 1 1 -12 25 5  o 116.9697 3.278662 167.2021       9.336361 148.5914       16.97771 175.2700       11.17835 109.7982 6.372621 119.6960 3.837281 -9.897743      7.438751 
1 1 1 -12 25 6  o 167.2745 3.471703 341.7711       14.15169 389.8242       29.81728 327.7996       16.07792 177.8756 6.891886 163.7499 4.029143 14.12572       7.983238 
1 1 1 -12 25 7  o 23.18237 6.944682 6.681659       4.230470 0.9086990      7.284975 9.618999       5.196440 20.58116 8.627447 27.50194 7.533045 -6.920784      11.45337 
1 1 1 -12 25 8  o 160.6606 4.026827 315.7684       15.75310 302.7800       26.57755 322.8028       19.55917 156.6892 6.977995 162.2756 4.951875 -5.586349      8.556487 
1 1 1 -12 25 9  o 230.2550 3.688827 647.8626       20.69824 649.6763       33.58601 646.7520       26.28246 229.9542 5.998627 229.8521 4.692254 0.1021729      7.615824 
1 1 1 -12 25 10 o 136.0879 3.019982 226.1023       10.01520 215.1427       16.44031 232.5695       12.62907 132.4090 5.104705 137.8944 3.761791 -5.485352      6.341063 
1 1 1 -12 25 11 o 263.2286 4.014532 847.2768       25.75159 819.7461       40.83932 865.4481       33.17899 258.0921 6.498501 265.7383 5.123573 -7.646179      8.275356 
1 1 1 -12 25 12 f 164.8470 3.153633 331.8626       12.66859 339.8226       21.22079 327.4548       15.79135 166.3982 5.239844 163.6412 3.959958 2.757050       6.567894 
1 1 1 -12 25 13 o 59.00871 3.515693 42.70076       5.032569 44.99572       8.866740 41.61010       6.112536 60.19825 6.129689 58.14787 4.345132 2.050373       7.513539 
1 1 1 -12 25 14 o 27.45928 6.183296 9.637156       4.037688 5.349868       7.576070 11.33802       4.771863 24.39035 9.255288 29.75830 6.737552 -5.367950      11.44792 
1 1 1 -12 25 15 o 79.90018 3.435015 78.16828       6.672627 52.21787       15.01271 84.55682       7.448824 63.94447 9.958467 83.07667 3.688559 -19.13219      10.61963 
1 1 1 -12 25 16 o 86.73991 3.028662 92.01272       6.392034 98.12758       11.33813 89.16374       7.739142 89.26015 5.235508 85.30264 3.732042 3.957504       6.429517 
1 1 1 -12 25 17 o 108.3359 2.949563 143.4640       7.779679 144.4100       13.50188 142.9939       9.518591 108.3438 5.128482 108.0707 3.619445 0.2730942      6.277078 
1 1 1 -12 25 18 o 130.6843 3.445565 208.9850       10.96329 195.4878       16.03773 220.8252       15.02101 126.0357 5.233103 134.1150 4.602883 -8.079353      6.969354 
1 1 1 -12 25 19 o 143.4847 3.352748 251.7911       11.72311 244.8893       17.59141 257.3049       15.72337 141.0627 5.125959 144.7719 4.462148 -3.709259      6.796045 
1 1 1 -12 25 20 o 79.40681 4.401144 77.59907       8.483150 76.25848       10.45235 80.18633       14.52071 78.49719 5.498948 79.97254 7.539924 -1.475349      9.332143 
1 1 1 -12 25 21 o 21.56194 7.184142 5.491115       4.421093 10.92213       7.506191 2.606221       5.470713 29.54720 9.324676 19.46188 7.728271 10.08533       12.11098 
1 1 1 -12 25 22 o 78.56377 3.000394 75.61501       5.733737 80.59942       10.75236 73.63446       6.777825 80.61102 5.506670 77.43369 3.601768 3.177322       6.579981 
1 1 1 -12 25 23 o 28.16504 5.361639 10.11846       3.545586 12.18236       7.301422 9.481596       4.055900 30.70840 9.105269 27.10405 6.266004 3.604355       11.05300 
1 1 1 -12 25 24 o 90.85429 2.885679 101.1564       6.380847 113.4626       12.06391 96.37646       7.518630 95.62815 5.196383 88.56125 3.490683 7.066902       6.259973 
1 1 1 -12 25 25 o 31.22211 5.230705 12.40297       3.839134 4.557426       11.91444 13.31195       4.055439 27.17518 11.18041 32.34771 5.330166 -5.172533      12.38597 
1 1 1 -12 25 26 o 37.94017 4.359677 18.01801       3.957621 17.97109       12.13411 18.02359       4.186561 36.53226 11.88911 37.88228 4.631274 -1.350021      12.75930 
1 1 1 -12 25 27 f 55.98323 3.252084 38.67446       4.417558 37.43847       9.147036 39.05043       5.044901 53.81115 7.152401 56.15042 3.707669 -2.339272      8.056280 
1 1 1 -12 25 28 o 122.0700 3.287797 183.7608       9.771344 189.4794       15.56033 180.0375       12.55567 122.8554 5.209250 120.3222 4.288973 2.533241       6.747709 
1 1 1 -12 25 29 o 24.56435 6.629623 8.017240       4.059954 6.764656       9.816096 8.275734       4.459244 26.12112 10.35872 24.93043 7.035166 1.190685       12.52185 
1 1 1 -12 25 30 o 50.09338 4.091033 31.51925       4.950556 24.25079       8.087444 35.87478       6.260517 42.03655 8.189445 53.13409 4.889851 -11.09753      9.538221 
1 1 1 -12 25 31 o 30.91008 5.483255 12.55833       3.978996 13.76016       7.345196 12.05917       4.733727 30.93399 9.122356 29.80590 6.682674 1.128088       11.30821 
1 1 1 -12 25 32 o 32.61844 5.421369 14.05335       4.158108 21.91796       7.750913 10.87531       4.927127 39.09546 8.386977 27.88928 7.200401 11.20619       11.05383 
1 1 1 -12 25 33 o 36.59493 4.982452 17.57439       4.327954 10.87077       7.024935 21.67540       5.494559 27.05557 9.056729 40.24266 5.767527 -13.18709      10.73726 
1 1 1 -12 25 34 o 34.47052 5.454854 16.02925       4.429800 11.57202       7.370109 18.55019       5.542710 27.20753 9.276140 36.45358 6.476733 -9.246052      11.31348 
1 1 1 -12 25 35 o 28.36602 6.953471 11.81322       4.768774 14.84385       10.19636 10.96471       5.395209 28.78323 10.77740 26.77697 7.796904 2.006258       13.30203 
1 1 1 -12 25 36 o 17.85606 6.703778 4.092400       3.950625 0.2554753      6.321642 6.551147       5.060520 16.75779 7.506558 21.15987 7.648044 -4.402075      10.71639 
1 1 1 -12 25 37 o 18.25503 7.296235 4.150065       4.907358 4.710979       6.346942 3.316314       7.738102 19.53207 8.109722 19.35269 8.504978 0.1793804      11.75169 
1 1 1 -12 25 38 o 24.54275 7.430146 9.858336       4.824087 10.77858       6.641184 8.830387       7.019068 24.41115 8.769410 22.49710 8.808990 1.914045       12.42984 
1 1 1 -12 25 39 o 11.39479 5.309965 -1.837533      3.602269 1.619111       6.208272 -3.591974      4.422959 16.47402 7.404426 11.67529 5.571986 4.798723       9.266745 
1 1 1 -12 25 40 o 15.85666 6.302739 3.365871       3.642004 4.274134       6.322071 2.914732       4.455623 17.88764 7.777681 15.90005 6.710912 1.987589       10.27271 
1 1 1 -12 25 41 o 14.00400 5.994081 1.769696       3.641434 -3.778717      6.236064 4.640418       4.485613 13.40636 6.455166 17.30154 6.954916 -3.895185      9.488942 
1 1 1 -12 26 1  o 95.68143 2.779746 111.8446       6.474529 112.3614       9.686439 111.4272       8.704763 95.74537 4.161488 95.39869 3.751682 0.3466797      5.602955 
1 1 1 -12 26 2  o 91.01630 3.170886 101.2933       7.022180 115.1742       13.00949 95.58618       8.341760 96.72434 5.542562 88.33236 3.884769 8.391983       6.768413 
1 1 1 -12 26 3  o 57.66428 3.188474 40.73336       4.463051 42.92147       6.318658 38.55487       6.304780 59.05589 4.422742 55.92004 4.669226 3.135853       6.431354 
1 1 1 -12 26 4  o 127.9809 2.829842 199.9370       8.825584 194.9121       13.32284 203.8663       11.78135 126.1325 4.340916 129.0892 3.749119 -2.956703      5.735804 
1 1 1 -12 26 5  o 72.74660 2.897485 64.70691       5.126258 69.20245       7.618298 60.98725       6.929765 75.09785 4.179369 70.50092 4.050602 4.596939       5.820181 
1 1 1 -12 26 6  o 110.6582 3.184617 149.6729       8.578769 127.7268       15.78911 158.8654       10.21871 101.7108 6.402709 113.9486 3.684869 -12.23788      7.387351 
1 1 1 -12 26 7  o 118.4510 3.818369 171.7113       11.00740 198.1567       19.46146 159.2719       13.34749 126.7868 6.318823 113.9244 4.818687 12.86236       7.946526 
1 1 1 -12 26 8  o 76.26286 3.350237 71.18839       6.211030 75.64338       12.27054 69.65378       7.201768 78.14185 6.502704 75.36939 3.934727 2.772453       7.600476 
1 1 1 -12 26 9  o 80.04295 3.371599 78.41454       6.561776 77.09643       12.76313 78.88811       7.650270 78.84615 6.706212 80.22129 3.925288 -1.375137      7.770532 
1 1 1 -12 26 10 f 70.65858 3.326340 61.13158       5.711455 53.72472       9.793229 64.94941       7.030995 65.81399 6.178461 72.76154 3.980486 -6.947556      7.349670 
1 1 1 -12 26 11 o 172.0943 3.229400 361.8132       13.54330 342.4156       21.81200 373.9836       17.27723 166.9462 5.368440 174.8320 4.055244 -7.885880      6.727938 
1 1 1 -12 26 12 o 148.1405 3.094988 268.0653       11.17297 235.1978       17.84257 289.2672       14.33049 138.3282 5.302926 153.7862 3.823910 -15.45792      6.537836 
1 1 1 -12 26 13 o 25.76552 6.581609 8.494165       4.146828 9.042443       7.646636 8.265738       4.935642 27.85772 9.449313 25.60273 7.458145 2.254995       12.03800 
1 1 1 -12 26 14 o 240.9122 4.225989 710.6835       24.80979 726.3799       52.51324 706.1732       28.14950 241.3364 8.944621 239.9701 4.813683 1.366333       10.15765 
1 1 1 -12 26 15 o 47.27408 4.064708 27.56022       4.637198 29.68978       8.458937 26.64527       5.544590 48.45132 7.398513 46.33406 4.989118 2.117260       8.923525 
1 1 1 -12 26 16 o 67.25314 3.315992 55.43146       5.417775 63.32253       9.934899 52.09157       6.463405 71.49973 5.750401 65.08906 4.095666 6.410675       7.059858 
1 1 1 -12 26 17 o 143.0533 3.491903 250.3652       12.17296 268.7915       18.45766 236.1814       16.19395 147.7887 5.132856 138.6099 4.801518 9.178741       7.028569 
1 1 1 -12 26 18 o 73.72849 4.309184 66.89909       7.708489 61.05996       10.15637 74.83318       11.83894 70.09022 6.004053 77.56739 6.317886 -7.477173      8.715753 
1 1 1 -12 26 19 o 44.96025 6.138862 25.43211       6.550448 31.34023       8.372677 16.10968       10.51730 49.75684 7.106863 35.47363 11.01474 14.28321       13.10847 
1 1 1 -12 26 20 o 117.9541 2.930040 170.1517       8.422144 186.5118       15.13028 162.8066       10.13797 122.9455 5.060900 115.2136 3.615338 7.731956       6.219596 
1 1 1 -12 26 21 o 44.57638 3.897892 24.56934       4.191638 27.25060       7.984867 23.54940       4.924766 46.17437 7.341800 43.48366 4.723333 2.690716       8.729943 
1 1 1 -12 26 22 o 70.35528 3.082655 60.73525       5.272326 66.71468       9.869094 58.34719       6.236917 73.18275 5.575891 68.84296 3.731650 4.339798       6.709379 
1 1 1 -12 26 23 o 77.91720 2.980930 74.48605       5.649622 69.10828       10.49091 76.68270       6.704914 74.31800 5.839602 78.95874 3.493279 -4.640739      6.804701 
1 1 1 -12 26 24 o 21.18400 6.061980 5.749812       3.287836 10.75026       7.421210 4.528648       3.667390 28.96579 9.286934 19.50883 6.543962 9.456963       11.36092 
1 1 1 -12 26 25 o 27.98743 5.843657 10.14992       3.856643 0.000000       0.000000 10.14992       3.856643 ?        ?        27.98743 5.843657 0.000000       5.843657 
1 1 1 -12 26 26 o 46.10736 4.078776 26.50236       4.535636 23.60554       8.090882 27.82989       5.477185 42.10282 8.180696 47.04315 4.847066 -4.940331      9.508830 
1 1 1 -12 26 27 o 119.2798 3.702598 176.1360       10.74938 186.0931       21.71610 172.9046       12.37131 119.7578 7.478508 117.8472 4.315135 1.910652       8.634147 
1 1 1 -12 26 28 o 42.51434 3.954824 22.64667       4.050322 40.19909       12.31253 20.51676       4.289032 53.67113 9.773893 40.30228 4.440618 13.36885       10.73537 
1 1 1 -12 26 29 o 33.11139 5.968149 14.43607       4.638517 9.300474       7.484453 17.63876       5.910472 26.60899 9.334203 36.25638 6.942358 -9.647392      11.63287 
1 1 1 -12 26 30 o 23.83327 6.397493 7.683259       3.793094 4.418835       7.224102 8.925773       4.456881 21.87382 8.814509 25.53658 6.969012 -3.662764      11.23667 
1 1 1 -12 26 31 o 31.11067 5.811594 12.95695       4.243985 7.146995       7.088802 16.20280       5.298478 23.80768 8.970975 34.50219 6.541169 -10.69451      11.10249 
1 1 1 -12 26 32 o 20.82104 6.749740 5.883243       3.913072 11.10834       6.920474 3.427587       4.744305 27.30062 8.984358 18.35232 7.225324 8.948299       11.52927 
1 1 1 -12 26 33 o 11.49756 5.317574 -2.222558      3.509683 -6.705366      6.666105 -0.5033719     4.128179 14.18962 6.790575 13.83883 6.140827 0.3507938      9.155417 
1 1 1 -12 26 34 o 15.48272 6.547304 1.406586       4.254333 17.55015       10.33869 -1.884224      4.667851 30.92578 10.95996 13.58399 6.227799 17.34179       12.60580 
1 1 1 -12 26 35 o 29.44837 5.778912 12.20255       3.998926 12.11549       6.636403 12.25218       5.010792 27.09259 8.790678 28.47416 7.214061 -1.381571      11.37184 
1 1 1 -12 26 36 o 25.03731 6.650457 9.441433       4.125818 12.95003       6.910991 7.498498       5.142834 27.28724 8.978114 21.95880 7.734677 5.328440       11.85039 
1 1 1 -12 26 37 o 26.08159 8.587790 12.06756       6.322707 14.83068       10.05528 10.26065       8.131355 26.33667 10.47125 23.60790 9.406501 2.728771       14.07584 
1 1 1 -12 26 38 o 13.32820 6.104969 -0.8261712     4.471854 1.208354       6.193398 -3.042066      6.463563 16.29194 7.352601 14.41064 6.836976 1.881302       10.04017 
1 1 1 -12 26 39 o 19.48767 6.747968 6.180511       3.904670 1.481010       6.228950 9.222567       5.011556 16.17318 7.329031 22.74473 7.649955 -6.571554      10.59417 
1 1 1 -12 26 40 o 21.13664 6.928864 7.686696       4.117706 3.168830       6.904897 10.18010       5.129642 17.18481 7.758776 23.39939 7.736581 -6.214581      10.95688 
1 1 1 -12 27 1  o 168.4868 3.510253 347.0404       14.41254 349.8925       27.72979 345.9847       16.87021 168.2880 6.775574 168.1256 4.117660 0.1624146      7.928652 
1 1 1 -12 27 2  o 156.2308 3.032359 298.1283       11.54472 301.6858       17.74327 295.5166       15.20293 156.8339 4.647688 155.3500 4.019248 1.483978       6.144539 
1 1 1 -12 27 3  o 98.33124 2.808877 118.1533       6.723804 115.5778       10.02055 120.2626       9.068384 97.07182 4.246334 99.09287 3.762191 -2.021057      5.673221 
1 1 1 -12 27 4  o 148.7431 2.971376 270.2015       10.77037 266.5142       16.40084 272.9973       14.28136 147.4217 4.570813 149.3303 3.927922 -1.908569      6.026682 
1 1 1 -12 27 5  o 27.00307 5.541516 9.279366       3.524190 17.33174       4.884262 0.5342720      5.090017 37.16505 5.563865 17.13277 7.198606 20.03228       9.098161 
1 1 1 -12 27 6  o 126.4676 3.798238 195.7950       11.69244 195.6553       19.58829 195.8723       14.57349 125.8816 6.406615 126.3277 4.742425 -0.4460983     7.970904 
1 1 1 -12 27 7  o 242.9984 4.234406 722.8947       25.07448 681.7916       48.35999 738.0077       29.32415 234.1762 8.488411 245.3268 4.905059 -11.15062      9.803710 
1 1 1 -12 27 8  o 113.6153 3.747711 158.0440       10.36201 153.4494       17.60134 160.4810       12.81876 111.4073 6.511689 114.3482 4.609690 -2.940941      7.978179 
1 1 1 -12 27 9  o 253.6368 4.360530 787.9026       26.95180 712.6404       51.16205 816.8111       31.70823 239.1875 8.792513 258.0239 5.042849 -18.83638      10.13601 
1 1 1 -12 27 10 o 13.96238 6.156226 -1.180592      4.085267 -3.401613      8.535768 -0.5206744     4.652765 19.56352 8.745955 15.53052 6.712771 4.033002       11.02511 
1 1 1 -12 27 11 o 53.33428 3.826938 34.98017       4.940803 29.27109       8.779016 37.62674       5.977295 48.02508 7.766344 55.23510 4.479122 -7.210018      8.965413 
1 1 1 -12 27 12 o 215.9843 3.588686 570.5488       18.88834 554.3990       30.43838 580.6620       24.08698 212.1481 5.893419 217.6432 4.541520 -5.495087      7.440281 
1 1 1 -12 27 13 o 117.9045 3.361347 170.1111       9.647976 169.7170       22.32950 170.2016       10.69812 116.6465 7.902097 117.8776 3.728950 -1.231133      8.737746 
1 1 1 -12 27 14 o 212.5676 4.019531 553.4754       20.82133 564.4353       30.47307 543.8782       28.51589 213.9543 5.850149 210.1340 5.573630 3.820343       8.080198 
1 1 1 -12 27 15 o 151.6484 3.524327 281.4178       13.02417 303.4723       19.77148 264.5115       17.31075 157.0065 5.174627 146.6632 4.850163 10.34331       7.092309 
1 1 1 -12 27 16 o 164.4716 3.608329 331.1865       14.46216 349.6411       21.71049 316.4649       19.39069 168.4467 5.295547 160.3564 4.968156 8.090347       7.261225 
1 1 1 -12 27 17 o 15.83848 6.523946 0.9952682      4.063026 -5.059742      7.578978 3.437256       4.813100 17.31944 7.938608 19.47872 7.380347 -2.159279      10.83933 
1 1 1 -12 27 18 o 21.84271 7.037137 5.798653       4.257513 0.2907542E-01  7.271056 8.808908       5.252029 19.78618 8.469543 26.29613 7.702859 -6.509956      11.44846 
1 1 1 -12 27 19 o 127.5177 2.970129 198.9603       9.229581 222.1264       16.51260 188.4344       11.13061 134.1126 5.061625 123.9042 3.690466 10.20840       6.264151 
1 1 1 -12 27 20 o 14.22586 5.921430 0.6087554      3.395956 0.5004983E-01  6.969672 0.7826922      3.888809 19.33498 8.284616 15.28785 6.347758 4.047128       10.43690 
1 1 1 -12 27 21 o 24.43004 5.989567 7.715870       3.537881 8.634026       7.355504 7.439528       4.035317 26.90820 9.264142 24.02727 6.660748 2.880930       11.41008 
1 1 1 -12 27 22 o 71.77929 3.097918 63.29897       5.406067 70.15616       10.33931 60.71894       6.342058 74.85854 5.710902 70.16959 3.722216 4.688950       6.816839 
1 1 1 -12 27 23 o 76.40429 3.023524 71.73393       5.618350 75.66454       10.71877 70.24493       6.597251 77.65115 5.704302 75.47343 3.597368 2.177711       6.743894 
1 1 1 -12 27 24 o 24.74775 6.062586 7.995401       3.626863 33.48718       12.85211 5.789660       3.780520 49.10121 11.01304 21.36322 6.598922 27.73799       12.83873 
1 1 1 -12 27 25 o 54.76879 3.809986 37.25132       5.053315 44.74033       8.793799 33.55909       6.174608 59.18582 6.188450 51.62500 4.969424 7.560822       7.936756 
1 1 1 -12 27 26 o 58.07283 3.567839 41.84530       5.024731 41.41057       11.97083 41.93828       5.536036 55.10809 9.240823 58.02408 3.938548 -2.915989      10.04515 
1 1 1 -12 27 27 f 61.40585 3.397987 46.79381       5.064902 39.11844       12.12672 48.41565       5.574394 52.79267 9.786413 62.36549 3.684313 -9.572826      10.45696 
1 1 1 -12 27 28 o 47.38919 3.880409 28.17966       4.441978 24.10330       8.101151 29.93207       5.311640 41.76027 8.253343 48.59721 4.537650 -6.836937      9.418489 
1 1 1 -12 27 29 f 43.75122 3.689186 24.06388       3.896683 32.81123       8.143674 21.46644       4.437670 49.38220 6.960088 40.99008 4.517455 8.392120       8.297604 
1 1 1 -12 27 30 o 23.77208 5.827966 7.656829       3.349673 12.62673       7.332411 6.346094       3.765567 29.23663 9.214706 21.63025 6.567927 7.606382       11.31585 
1 1 1 -12 27 31 o 37.35687 4.924548 18.29962       4.373965 25.68627       7.789705 14.89829       5.285932 42.30778 7.844300 32.59458 6.871731 9.713200       10.42850 
1 1 1 -12 27 32 o 67.47864 3.669688 57.86592       6.011655 52.19955       9.617090 61.50014       7.701882 61.44072 6.522743 68.75159 4.623928 -7.310867      7.995429 
1 1 1 -12 27 33 o 11.52996 5.404377 -2.955450      3.822053 7.537523       6.724581 -7.962726      4.645332 22.86057 8.709070 10.64252 5.222921 12.21805       10.15514 
1 1 1 -12 27 34 o 26.09632 6.379138 9.907214       4.022062 8.072412       6.255473 11.20030       5.251461 22.95067 8.470378 26.89093 7.650265 -3.940260      11.41376 
1 1 1 -12 27 35 o 18.30141 6.764817 4.578506       3.992591 10.22907       6.697636 1.463637       4.972739 24.61442 8.810889 16.01017 6.929926 8.604254       11.20962 
1 1 1 -12 27 36 o 17.04690 7.176326 2.976182       5.073908 10.96126       6.691373 -7.826386      7.782860 24.73717 8.812118 14.30646 6.964439 10.43070       11.23196 
1 1 1 -12 27 37 o 14.86432 6.551077 1.091063       4.621427 -4.650769      6.247489 8.029784       6.867837 13.56561 6.513567 21.40014 8.604641 -7.834526      10.79196 
1 1 1 -12 27 38 o 11.14799 5.267035 -2.557382      3.760617 -1.619179      5.952983 -3.180430      4.851178 14.36363 6.736466 12.37919 5.887513 1.984441       8.946664 
1 1 1 -12 27 39 o 30.71103 6.106273 14.68776       4.408944 20.56918       7.480613 11.55728       5.457599 31.75802 9.161394 24.80217 7.965274 6.955853       12.13988 
1 1 1 -12 28 1  o 139.7277 3.782292 239.0974       12.86690 202.5690       20.55857 262.6197       16.49749 127.9233 6.617378 146.2615 4.634471 -18.33821      8.078862 
1 1 1 -12 28 2  o 65.73451 5.012234 53.34735       7.968449 71.00166       11.04461 34.18107       11.50784 75.69006 6.037929 51.50984 9.518387 24.18022       11.27192 
1 1 1 -12 28 3  o 139.0648 3.765706 236.8025       12.74969 246.6477       22.04203 231.8523       15.62971 141.2716 6.419438 137.4192 4.674120 3.852417       7.940818 
1 1 1 -12 28 4  o 81.66125 3.822834 81.78136       7.586310 84.36743       12.70268 80.34760       9.458334 82.48007 6.369209 80.78526 4.826485 1.694809       7.991357 
1 1 1 -12 28 5  f 69.68951 4.718083 59.83300       7.965285 57.43376       10.94697 62.53242       11.61161 67.88845 6.704448 70.84049 6.810079 -2.952042      9.556505 
1 1 1 -12 28 6  o 150.6277 3.906523 277.8916       14.32731 263.5021       24.12477 285.7321       17.80784 145.9023 6.803975 152.5394 4.796597 -6.637100      8.324747 
1 1 1 -12 28 7  o 244.3584 4.925740 732.8898       29.33155 769.8140       52.32176 715.9673       35.42085 248.4144 8.656327 241.0079 6.035781 7.406555       10.55285 
1 1 1 -12 28 8  o 37.06773 5.966576 17.33846       5.206709 17.12085       9.533165 17.43096       6.215662 36.38787 10.29259 36.92662 7.165883 -0.5387421     12.54142 
1 1 1 -12 28 9  o 175.4599 4.166511 377.1857       17.81502 395.0620       31.82973 369.0313       21.49763 178.3998 7.337202 173.2435 5.097651 5.156235       8.934236 
1 1 1 -12 28 10 o 47.50937 5.042742 28.03471       5.749181 22.63214       9.558787 31.09678       7.196312 41.67571 9.608640 49.86979 6.044817 -8.194073      11.35191 
1 1 1 -12 28 11 o 187.7243 4.297028 432.0830       19.65734 469.0743       35.62294 415.8876       23.57093 194.2002 7.541717 183.8111 5.267651 10.38911       9.199219 
1 1 1 -12 28 12 o 69.82735 4.361940 60.03741       7.385276 67.01551       16.14266 58.19022       8.305442 72.50866 9.353532 68.62707 5.000595 3.881592       10.60634 
1 1 1 -12 28 13 o 97.50151 3.091270 116.3573       7.335594 113.0185       12.58136 118.0770       9.029151 95.64280 5.420267 98.11033 3.783650 -2.467529      6.610242 
1 1 1 -12 28 14 o 76.89333 3.683280 72.58704       6.881686 82.00183       11.09402 66.69871       8.773633 81.34647 5.631224 73.47846 4.928355 7.868011       7.483273 
1 1 1 -12 28 15 o 80.21611 3.236960 78.87160       6.314546 85.41841       11.31393 75.90961       7.610093 82.99873 5.627056 78.57114 3.987615 4.427589       6.896726 
1 1 1 -12 28 16 o 200.7521 3.905670 494.4182       19.10697 474.4672       27.59217 512.7996       26.48452 195.7818 5.789683 203.7815 5.337838 -7.999664      7.874830 
1 1 1 -12 28 17 o 105.8426 3.377605 137.3969       8.700594 167.4396       14.27420 119.6367       10.97506 116.3993 5.044261 98.48123 4.585759 17.91805       6.817167 
1 1 1 -12 28 18 o 42.45745 4.367392 22.41421       4.454312 12.38962       8.236045 26.55862       5.295622 31.11608 9.760360 46.16986 4.775621 -15.05379      10.86606 
1 1 1 -12 28 19 o 76.81403 3.123415 72.42773       5.834447 87.45029       10.81086 66.25419       6.930360 83.85564 5.317834 73.30960 3.893310 10.54604       6.590693 
1 1 1 -12 28 20 o 74.63661 3.119309 68.43083       5.660933 85.89254       10.76639 61.75875       6.655145 83.01153 5.350753 70.73917 3.875464 12.27235       6.606798 
1 1 1 -12 28 21 o 119.4317 4.112063 176.1786       11.94998 172.4455       15.09257 182.4516       19.56422 117.6451 5.277890 120.2116 6.705088 -2.566444      8.533131 
1 1 1 -12 28 22 o 38.85372 4.665294 18.97812       4.328962 22.33768       10.33648 18.26352       4.767178 40.28860 10.44306 37.93649 5.301201 2.352119       11.71154 
1 1 1 -12 28 23 o 62.60364 4.218686 48.76769       6.398374 56.45593       14.92296 47.03597       7.082405 64.67661 9.772816 61.29688 4.779142 3.379730       10.87879 
1 1 1 -12 28 24 o 84.13168 3.732968 87.71101       7.634264 77.77795       14.77993 91.32553       8.915725 76.94234 7.999253 85.62469 4.286520 -8.682350      9.075369 
1 1 1 -12 28 25 o 47.95628 3.829161 28.70334       4.437776 39.30291       11.43284 26.82301       4.815337 53.59118 9.078100 46.19627 4.327825 7.394913       10.05694 
1 1 1 -12 28 26 o 29.06017 5.274903 10.99036       3.597963 3.724476       6.923024 13.67908       4.211380 21.34232 8.618735 32.40944 5.530643 -11.06713      10.24063 
1 1 1 -12 28 27 o 39.79530 4.273279 20.08272       4.079246 25.12147       7.696929 18.11461       4.810387 42.91068 7.640789 37.32094 5.449942 5.589737       9.385283 
1 1 1 -12 28 28 o 31.99311 4.701909 13.23988       3.556509 4.490510       7.019253 16.26187       4.125236 21.64173 8.699953 35.43003 4.909730 -13.78830      9.989727 
1 1 1 -12 28 29 o 35.60405 4.352339 16.30477       3.697812 12.35323       7.300470 17.66844       4.288661 28.85128 9.206990 36.83414 4.899258 -7.982868      10.42935 
1 1 1 -12 28 30 o 37.61958 4.214044 18.23835       3.796904 10.42507       7.368171 21.06329       4.430445 26.44621 9.262584 40.25672 4.598596 -13.81051      10.34130 
1 1 1 -12 28 31 o 49.47414 3.635591 31.17369       4.352571 34.58332       8.405469 29.92444       5.087835 49.22107 7.222419 47.99246 4.399236 1.228607       8.456750 
1 1 1 -12 28 32 o 18.13388 6.190303 4.426214       3.282367 4.035610       6.319138 4.570546       3.841221 19.65183 8.119465 18.58833 6.670346 1.063499       10.50805 
1 1 1 -12 28 33 o 16.71849 6.787549 2.785182       4.319821 5.053280       9.420756 2.181318       4.860983 21.72221 9.468955 16.68493 7.024051 5.037275       11.78976 
1 1 1 -12 28 34 o 19.32731 7.408365 5.158955       4.885466 2.328980       6.195205 9.813138       7.944858 17.74482 7.707566 24.02845 9.382628 -6.283632      12.14250 
1 1 1 -12 28 35 o 17.66447 7.209844 3.790539       4.905038 0.6617026      6.288299 8.652414       7.838693 16.44487 7.416343 22.50617 9.141073 -6.061296      11.77121 
1 1 1 -12 28 36 o 9.781010 4.779185 -5.535387      3.762997 -12.06655      6.109621 -1.543461      4.776504 11.09640 5.538978 13.31872 6.175042 -2.222312      8.295264 
1 1 1 -12 28 37 o 19.98823 6.876620 6.523695       4.052529 8.160404       6.256795 5.340845       5.319011 21.17529 8.309338 18.62513 7.542647 2.550158       11.22215 
1 1 1 -12 28 38 o 19.71427 6.992036 6.566916       4.208493 9.657267       7.127871 4.913064       5.214400 21.73859 8.757159 17.91869 7.386776 3.819902       11.45654 
1 1 1 -12 29 1  o 56.11775 3.319185 38.66017       4.518806 41.38195       6.497111 36.10990       6.289076 57.86593 4.646481 53.99712 4.830441 3.868805       6.702458 
1 1 1 -12 29 2  o 69.95374 3.071273 59.94344       5.222826 61.09887       7.439858 58.82075       7.333671 70.43879 4.355583 69.10444 4.377409 1.334351       6.175177 
1 1 1 -12 29 3  f 49.95179 3.565969 30.69475       4.312200 31.00957       6.108942 30.38209       6.087855 49.96493 5.088154 49.44448 5.126866 0.5204506      7.223162 
1 1 1 -12 29 4  o 181.2319 3.624447 402.0832       16.00709 378.9422       21.38191 431.5885       24.14377 175.4976 5.004757 187.1931 5.298052 -11.69548      7.288137 
1 1 1 -12 29 5  o 112.6085 2.846803 155.0546       7.805782 160.5222       11.83376 150.8434       10.38556 114.3311 4.254816 110.9053 3.848577 3.425766       5.737160 
1 1 1 -12 29 6  o 76.76800 3.476282 72.26595       6.486389 86.56042       12.70387 67.22539       7.543822 83.46515 6.292230 73.92577 4.204886 9.539383       7.567907 
1 1 1 -12 29 7  o 72.87524 3.532320 65.15459       6.254329 58.00789       12.09641 67.76223       7.306791 67.93815 7.427323 74.24332 4.054005 -6.305176      8.461683 
1 1 1 -12 29 8  o 47.11070 4.468989 27.48216       5.069209 43.56916       9.937681 21.82404       5.893639 58.85480 7.070343 41.63932 5.979545 17.21547       9.259844 
1 1 1 -12 29 9  o 68.94891 3.683327 58.38774       6.166304 56.43902       12.27013 59.04619       7.132381 66.90631 7.663833 69.24778 4.247043 -2.341469      8.761947 
1 1 1 -12 29 10 o 38.52304 5.165239 18.58698       4.726864 12.67916       8.906214 20.90368       5.577183 31.82426 10.17071 40.76487 5.775810 -8.940605      11.69629 
1 1 1 -12 29 11 o 67.73116 4.109268 56.48563       6.750578 0.000000       0.000000 56.48563       6.750578 ?        ?        67.73116 4.109268 0.000000       4.109268 
1 1 1 -12 29 12 o 67.83250 3.622623 56.53830       5.966493 63.08912       12.50364 54.60688       6.789323 70.78349 7.355993 66.56232 4.207166 4.221176       8.474131 
1 1 1 -12 29 13 o 128.3972 3.098664 201.7478       9.695407 197.4541       16.15397 204.1655       12.12139 126.4040 5.255700 128.9528 3.861671 -2.548714      6.521877 
1 1 1 -12 29 14 o 81.52637 3.191072 81.50680       6.327487 81.78157       11.37364 81.38364       7.614653 81.07278 5.795111 81.34578 3.852252 -0.2730026     6.958674 
1 1 1 -12 29 15 o 100.5651 3.497511 124.1556       8.558173 108.9515       13.11945 135.4178       11.29140 93.58315 5.781057 104.7987 4.431357 -11.21559      7.284061 
1 1 1 -12 29 16 o 41.81132 4.981273 21.88901       4.975714 21.24673       8.367173 22.24040       6.188936 40.17510 8.791264 41.83494 6.263104 -1.659840      10.79411 
1 1 1 -12 29 17 o 88.32784 3.077432 95.73112       6.613909 107.1606       11.64547 90.28916       8.035645 92.88152 5.165421 85.60400 3.861984 7.277519       6.449534 
1 1 1 -12 29 18 o 87.08770 3.062243 93.11059       6.488678 100.5226       11.47424 89.62593       7.867461 89.84393 5.263878 85.26798 3.795793 4.575951       6.489719 
1 1 1 -12 29 19 o 27.72967 6.141483 9.990067       4.040565 11.04165       8.073960 9.638707       4.667025 29.43690 9.705058 27.12841 7.009717 2.308496       11.97181 
1 1 1 -12 29 20 o 36.81327 5.415546 17.24299       4.713227 12.28818       7.393889 20.63441       6.117162 30.45089 9.194394 40.00288 6.497906 -9.551994      11.25876 
1 1 1 -12 29 21 o 69.53553 4.089146 60.02465       6.898492 49.15093       13.08817 64.20756       8.117623 60.69228 9.132021 71.72710 4.669569 -11.03482      10.25664 
1 1 1 -12 29 22 o 44.06504 5.681978 24.81769       5.959535 0.000000       0.000000 24.81769       5.959535 ?        ?        44.06504 5.681978 0.000000       5.681978 
1 1 1 -12 29 23 o 56.29374 3.687685 39.39244       5.030976 51.49055       12.32676 36.97444       5.510851 62.07673 8.361012 54.37360 4.191381 7.703129       9.352765 
1 1 1 -12 29 24 o 61.45364 3.248123 46.79472       4.846980 43.29052       9.050287 48.20405       5.739490 57.65121 6.558411 62.18356 3.805807 -4.532356      7.582673 
1 1 1 -12 29 25 o 24.06726 6.037481 7.728232       3.534484 12.14112       7.016502 6.227681       4.091519 29.45265 8.970016 21.81133 6.884540 7.641319       11.30744 
1 1 1 -12 29 26 o 41.22905 4.059043 21.50271       4.025321 17.40028       7.523845 23.14787       4.764559 34.81305 8.850667 42.54494 4.672360 -7.731892      10.00826 
1 1 1 -12 29 27 o 49.55525 3.630353 30.87627       4.353620 35.19104       8.401584 29.29235       5.090374 50.96503 6.945297 47.91182 4.409261 3.053219       8.226708 
1 1 1 -12 29 28 o 58.16036 3.354311 42.43777       4.733913 35.77375       8.604342 45.33058       5.669032 50.90355 7.131797 59.81086 3.910944 -8.907310      8.133758 
1 1 1 -12 29 29 o 14.68695 5.936599 1.688707       3.288024 -2.052350      6.796323 2.831901       3.756962 16.56429 7.564137 16.61101 6.461819 -0.4671860E-01 9.948430 
1 1 1 -12 29 30 o 23.56132 6.037256 7.805840       3.481767 7.456513       6.833844 7.928308       4.046321 23.05186 8.780114 23.48216 6.726663 -0.4303074     11.06067 
1 1 1 -12 29 31 o 32.27806 4.740766 13.90306       3.617956 13.34738       6.588834 14.14294       4.328972 28.87624 8.670666 31.92275 5.777419 -3.046511      10.41917 
1 1 1 -12 29 32 o 44.14645 4.222980 25.58044       4.487772 19.88828       10.51823 26.84728       4.962102 31.85060 11.07267 44.94518 4.595102 -13.09458      11.98829 
1 1 1 -12 29 33 o 14.99484 6.294204 1.700719       3.885509 5.298683       6.161836 -0.6742992     5.006279 19.95169 8.104200 14.50975 6.573332 5.441948       10.43488 
1 1 1 -12 29 34 o 24.88962 6.712910 9.584750       4.164285 8.897495       6.522047 10.05776       5.410782 22.78747 8.600856 24.47982 7.937126 -1.692350      11.70353 
1 1 1 -12 29 35 o 37.42876 5.258630 19.94031       4.664286 21.06513       7.445805 19.21383       5.983870 34.00057 8.888382 34.47868 7.346818 -0.4781036     11.53166 
1 1 1 -12 29 36 o 18.15937 7.169976 4.977091       4.683921 -1.772312      6.337862 13.10002       6.952908 14.70503 6.913672 25.53353 8.993441 -10.82850      11.34376 
1 1 1 -12 29 37 o 19.99540 6.802080 6.664429       3.962661 4.733976       6.284017 7.938836       5.105777 18.11840 7.816159 20.99783 7.668587 -2.879427      10.94987 
1 1 1 -12 30 1  o 152.2829 3.046933 283.7485       11.30707 283.9184       17.12428 283.6172       15.05589 151.8427 4.633304 151.9449 4.069823 -0.1021423     6.166925 
1 1 1 -12 30 2  o 14.05909 5.833753 0.6350397      3.281506 -3.754266      4.459225 5.819680       4.846417 12.86296 5.964671 22.27494 7.522930 -9.411977      9.600613 
1 1 1 -12 30 3  o 105.3313 3.196432 135.9155       8.195131 132.3431       10.75139 140.8692       12.66057 103.7185 4.262841 106.8571 4.874827 -3.138664      6.475782 
1 1 1 -12 30 4  o 45.29492 3.776042 25.32559       4.130069 25.58044       5.884502 25.07818       5.798057 45.21177 5.450854 44.76500 5.425667 0.4467659      7.690882 
1 1 1 -12 30 5  o 72.53089 3.407759 64.56673       6.006370 69.88885       7.909459 57.31666       9.231553 75.30444 4.328362 67.89077 5.630518 7.413673       7.101933 
1 1 1 -12 30 6  o 32.65332 6.112447 13.61566       4.685111 2.466198       8.411998 18.62952       5.641027 22.81745 9.391715 38.30038 6.259971 -15.48294      11.28679 
1 1 1 -12 30 7  o 61.69136 3.890516 46.86947       5.819026 35.53473       10.58852 51.77399       6.965104 52.53230 8.566197 64.75061 4.441047 -12.21831      9.648971 
1 1 1 -12 30 8  f 58.54956 3.983054 42.26420       5.649141 50.66539       11.17584 39.38094       6.547152 63.29855 7.383704 56.35250 4.813686 6.946049       8.814231 
1 1 1 -12 30 9  o 65.50031 3.755587 52.79359       5.969430 55.52900       11.77411 51.84721       6.925509 66.26905 7.418039 64.78734 4.412917 1.481712       8.631404 
1 1 1 -12 30 10 o 27.30494 7.669476 9.614199       5.312438 0.000000       0.000000 9.614199       5.312438 ?        ?        27.30494 7.669476 0.000000       7.669476 
1 1 1 -12 30 11 o 22.73997 7.378339 6.307071       4.675258 4.554561       8.817225 6.992517       5.514273 24.65410 9.804412 24.10637 8.023101 0.5477276      12.66873 
1 1 1 -12 30 12 o 127.3630 3.362669 198.9923       10.42758 198.1336       21.09241 199.2700       11.99609 125.7313 6.910670 127.3124 3.871130 -1.581062      7.921049 
1 1 1 -12 30 13 o 97.73711 3.331388 117.2694       7.922925 117.5630       16.20931 117.1773       9.081734 96.67387 6.926386 97.58241 3.826519 -0.9085388     7.913095 
1 1 1 -12 30 14 f 22.83877 7.303028 6.464320       4.591465 8.380653       7.233615 5.171280       5.941908 26.56020 9.185180 22.35720 8.254644 4.202999       12.34936 
1 1 1 -12 30 15 o 122.4520 3.420711 184.2594       10.19748 200.7042       15.77364 172.4510       13.36631 127.1530 5.100954 118.0334 4.656114 9.119606       6.906456 
1 1 1 -12 30 16 o 84.18301 3.186793 87.09842       6.525737 94.69623       11.49485 83.48515       7.927003 87.07932 5.444155 82.22047 3.968050 4.858849       6.736783 
1 1 1 -12 30 17 o 38.03789 5.471411 18.37815       4.925952 16.83914       7.842217 19.38107       6.330692 35.40630 9.054471 38.62767 6.982306 -3.221375      11.43399 
1 1 1 -12 30 18 o 40.59528 5.060781 20.81082       4.898018 24.85098       8.347151 18.68917       6.048880 43.32709 8.206094 37.91405 6.796613 5.413036       10.65523 
1 1 1 -12 30 19 o 20.92037 7.412105 5.024076       4.728305 11.47480       8.579430 2.210053       5.666541 29.75532 10.00926 19.03712 7.757148 10.71820       12.66328 
1 1 1 -12 30 20 o 55.01016 3.880710 37.63176       5.168851 36.97954       11.30614 37.80410       5.811758 52.22357 9.221121 54.98811 4.373129 -2.764534      10.20555 
1 1 1 -12 30 21 o 21.45755 7.034421 5.795262       4.244100 0.000000       0.000000 5.795262       4.244100 ?        ?        21.45755 7.034421 0.000000       7.034421 
1 1 1 -12 30 22 o 71.45447 3.164710 63.14881       5.496935 70.10426       10.29587 60.37572       6.501021 74.06448 5.749490 69.61797 3.846944 4.446510       6.917775 
1 1 1 -12 30 23 o 41.36738 4.171055 21.58489       4.147392 15.96020       7.712704 23.87293       4.919137 33.55667 9.171738 43.31942 4.736958 -9.762753      10.32277 
1 1 1 -12 30 24 o 30.80355 5.359772 12.41698       3.877265 7.247398       7.595265 14.23893       4.509041 24.58030 9.280673 32.83841 5.849110 -8.258108      10.97009 
1 1 1 -12 30 25 o 15.05956 5.992011 1.814095       3.294996 -2.671474      6.637143 3.281192       3.795788 16.43710 7.494152 17.48515 6.569704 -1.048044      9.966108 
1 1 1 -12 30 26 f 35.28512 5.047664 16.27722       4.216775 12.59985       6.947255 18.42228       5.305957 29.24673 8.929276 37.04076 6.089686 -7.794022      10.80816 
1 1 1 -12 30 27 o 25.02813 6.017379 8.620430       3.624672 2.892462       6.514696 11.18861       4.362211 19.52664 8.170156 28.37486 6.454716 -8.848217      10.41224 
1 1 1 -12 30 28 o 32.54279 4.812121 13.99488       3.701254 5.412665       6.421109 18.26530       4.529446 21.25693 8.394342 37.05204 5.155939 -15.79511      9.851330 
1 1 1 -12 30 29 o 21.94288 6.298009 6.831786       3.543725 4.366752       6.709901 7.785307       4.173205 20.31466 8.377413 23.18320 6.886171 -2.868546      10.84437 
1 1 1 -12 30 30 o 48.87976 3.643166 30.63380       4.308336 23.92109       7.289124 34.23812       5.341189 39.85615 7.784220 51.18275 4.322687 -11.32660      8.903914 
1 1 1 -12 30 31 f 32.68712 5.206420 14.65825       4.008183 0.9067342      8.570223 18.50825       4.534686 18.95879 8.593512 36.79498 5.202291 -17.83619      10.04551 
1 1 1 -12 30 32 o 15.38241 6.285868 2.270186       3.733819 0.4487655      5.603242 3.724970       5.007647 15.88141 7.093924 17.89704 7.292361 -2.015632      10.17361 
1 1 1 -12 30 33 o 12.10750 5.424717 -0.4175636     3.303464 6.016081       5.820981 -3.474014      4.012142 20.05638 7.969414 11.27317 5.359417 8.783209       9.603901 
1 1 1 -12 30 34 o 33.48098 4.941041 15.74459       3.910370 13.58788       6.943102 16.74649       4.732275 26.56924 9.004209 33.53764 6.011109 -6.968405      10.82632 
1 1 1 -12 30 35 o 23.89378 6.817279 9.330271       4.164169 -2.116293      6.416118 17.66086       5.473595 14.63024 6.902413 33.07956 7.008311 -18.44932      9.836652 
1 1 1 -12 30 36 o 17.76535 6.379797 4.924314       3.514607 -1.376869      6.441108 7.595808       4.193984 14.78382 6.956651 21.14480 6.995673 -6.360985      9.865821 
1 1 1 -12 31 1  o 47.82510 3.641561 28.24029       4.212134 27.90521       5.809182 28.61174       6.116399 47.23511 5.129011 47.78424 5.344016 -0.5491333     7.407109 
1 1 1 -12 31 2  o 102.7565 3.215794 129.5313       8.042643 126.6053       10.52819 133.6315       12.46309 101.3256 4.273412 103.8991 4.936527 -2.573578      6.529269 
1 1 1 -12 31 3  o 68.08270 3.028833 56.87803       5.012560 54.43869       7.059138 59.35883       7.118901 66.34523 4.390926 69.32568 4.234079 -2.980446      6.099808 
1 1 1 -12 31 4  o 18.40352 6.054723 4.045455       3.143126 5.087292       4.139355 2.626773       4.830312 20.72741 6.952296 18.56471 7.296114 2.162701       10.07808 
1 1 1 -12 31 5  o 25.86952 5.618140 8.607836       3.440098 4.609509       4.643907 13.47007       5.121088 20.55584 7.339130 32.27597 6.729312 -11.72013      9.957232 
1 1 1 -12 31 6  o 36.22267 5.127111 16.52964       4.399384 19.20316       8.178358 15.44098       5.218788 38.12689 8.955691 34.68208 6.410969 3.444813       11.01385 
1 1 1 -12 31 7  o 30.64586 6.901212 12.19870       5.029492 8.054032       7.547131 15.50987       6.745705 26.48292 9.366142 34.36731 8.174356 -7.884386      12.43160 
1 1 1 -12 31 8  o 87.35575 3.393045 93.74992       7.209258 101.0498       14.01608 91.12392       8.406546 89.75725 6.451005 85.97813 4.023460 3.779121       7.602874 
1 1 1 -12 31 9  o 14.26262 6.486271 -2.823915      4.932296 0.000000       0.000000 -2.823915      4.932296 ?        ?        14.26262 6.486271 0.000000       6.486271 
1 1 1 -12 31 10 o 25.22664 7.513903 8.159346       4.963304 9.971120       8.699929 7.285141       6.043244 28.85939 10.06789 24.67463 8.399975 4.184759       13.11190 
1 1 1 -12 31 11 o 148.1624 3.461198 269.5967       12.49685 262.9730       24.86119 271.8362       14.45590 144.3713 7.088177 148.5296 3.997524 -4.158279      8.137718 
1 1 1 -12 31 12 o 63.12932 4.533105 49.49415       6.927270 47.09187       11.85073 50.74104       8.537828 60.26588 8.288636 63.62449 5.562530 -3.358604      9.982145 
1 1 1 -12 31 13 o 38.02560 6.063862 18.50301       5.430446 26.72949       9.251158 14.17819       6.707686 44.91891 8.766232 32.66793 8.384351 12.25098       12.13030 
1 1 1 -12 31 14 o 89.93306 4.667892 100.4766       10.19500 99.60628       14.96611 101.2302       13.92585 88.49657 6.996683 89.51009 6.427088 -1.013519      9.500581 
1 1 1 -12 31 15 o 37.39250 5.948652 17.93243       5.239106 14.94339       9.069931 19.42917       6.418150 33.32663 10.20795 38.58881 7.086207 -5.262180      12.42645 
1 1 1 -12 31 16 o 31.70004 6.858618 13.21471       5.144063 10.23314       8.929606 14.69560       6.293190 28.81373 10.18816 33.17869 7.897895 -4.364964      12.89091 
1 1 1 -12 31 17 o 34.73608 5.212610 15.40256       4.276339 23.23596       9.996184 13.64784       4.731119 40.90114 10.09202 32.35770 6.225969 8.543434       11.85797 
1 1 1 -12 31 18 o 44.98822 4.309175 25.37175       4.666525 24.24489       10.72925 25.63465       5.182368 41.39857 10.59286 45.07600 4.791192 -3.677433      11.62601 
1 1 1 -12 31 19 f 16.60102 6.325485 2.607185       3.547776 6.443845       6.868691 1.211178       4.143250 23.86991 8.863702 15.90654 6.573564 7.963369       11.03526 
1 1 1 -12 31 20 o 58.89512 3.594340 43.13881       5.134067 44.75326       9.108153 42.38696       6.215618 58.69931 6.474839 58.07603 4.425207 0.6232872      7.842576 
1 1 1 -12 31 21 o 23.06926 6.974986 7.063956       4.253098 23.40452       12.02366 4.726962       4.547072 39.30666 11.69183 20.13610 7.253416 19.17056       13.75903 
1 1 1 -12 31 22 o 71.36494 3.234254 63.25114       5.610026 62.14731       10.19584 63.73043       6.718473 69.08945 6.119058 71.34153 3.879082 -2.252075      7.245008 
1 1 1 -12 31 23 o 15.44467 6.213762 1.770082       3.583785 -1.450376      6.576894 3.130136       4.274055 17.07500 7.652022 17.84025 6.905372 -0.7652493     10.30716 
1 1 1 -12 31 24 o 36.97482 4.622910 17.63226       4.074637 14.95608       7.375490 18.80786       4.888342 31.80487 9.072292 37.80975 5.463704 -6.004877      10.59049 
1 1 1 -12 31 25 o 47.66028 4.228148 29.05045       4.859790 27.83631       8.054636 29.74544       6.093979 44.34700 7.734347 47.57653 5.348749 -3.229538      9.403682 
1 1 1 -12 31 26 o 24.27081 5.993317 8.152543       3.523382 4.041445       6.515533 9.851596       4.188654 20.30011 8.300450 26.47052 6.533610 -6.170408      10.56341 
1 1 1 -12 31 27 o 31.75368 5.197153 13.55353       3.882574 10.65482       6.730195 14.99941       4.753264 26.27761 8.865246 32.85114 6.163870 -6.573538      10.79749 
1 1 1 -12 31 28 o 25.59386 5.896202 9.195821       3.601697 9.545860       6.228532 9.019974       4.414634 24.89551 8.526541 24.78696 7.001690 0.1085472      11.03293 
1 1 1 -12 31 29 o 27.12114 5.717345 10.32083       3.659397 0.3570711      6.163158 15.74615       4.547829 16.76253 7.466819 33.63456 5.755354 -16.87203      9.427485 
1 1 1 -12 31 30 o 19.83093 6.428523 5.687000       3.549511 3.538840       6.151196 6.759373       4.346094 18.73615 7.895281 21.27957 7.123610 -2.543415      10.63397 
1 1 1 -12 31 31 o 29.47892 6.098367 12.68791       4.236265 10.22152       6.568857 14.44405       5.542922 24.39764 8.726641 30.16666 7.556828 -5.769018      11.54383 
1 1 1 -12 31 32 f 27.43750 5.879766 11.07069       3.813105 18.34398       7.034994 8.045004       4.537435 32.24757 8.737028 22.35040 7.270023 9.897171       11.36613 
1 1 1 -12 31 33 o 19.70830 6.474718 6.041629       3.594804 11.04856       6.469378 3.805125       4.323761 24.29262 8.663525 17.02122 6.833114 7.271395       11.03395 
1 1 1 -12 31 34 f 21.81531 6.937563 7.873982       4.147959 4.479802       6.411979 10.31664       5.439460 18.30997 7.897047 23.88817 7.968934 -5.578199      11.21906 
1 1 1 -12 31 35 o 10.98662 5.138008 -1.834406      3.421825 -0.5745820     6.089200 -2.415858      4.136778 14.88037 6.923974 11.73580 5.538524 3.144574       8.866604 
1 1 1 -12 32 1  o 44.29430 4.242175 24.43791       4.523126 28.89131       5.791605 17.47441       7.242142 47.99786 5.025979 36.26676 8.365060 11.73110       9.758826 
1 1 1 -12 32 2  o 38.58310 4.441992 18.63140       4.100360 18.28881       5.058669 19.28763       7.001333 37.91934 5.646392 38.32959 7.762151 -0.4102516     9.598580 
1 1 1 -12 32 3  o 25.17166 6.113334 8.235440       3.712139 12.50592       4.657386 0.7970580      6.146717 31.05455 6.368258 18.64373 7.876258 12.41081       10.12868 
1 1 1 -12 32 4  o 64.04670 3.493009 50.56534       5.431072 50.08629       6.893080 51.34957       8.819529 63.50507 4.483001 63.93114 5.721469 -0.4260635     7.268597 
1 1 1 -12 32 5  o 14.98267 6.131366 1.089498       3.558890 -3.131247      4.159436 12.62267       6.875658 12.60110 5.814075 30.89072 8.742188 -18.28962      10.49902 
1 1 1 -12 32 6  o 58.49232 4.733202 42.63004       6.689094 41.42507       10.00810 43.60293       8.992759 56.76224 7.412194 58.63704 6.397018 -1.874798      9.790937 
1 1 1 -12 32 7  o 87.02856 4.049148 93.60007       8.563858 106.8894       14.20475 86.01155       10.73398 92.08766 6.369129 82.98678 5.336095 9.100883       8.309014 
1 1 1 -12 32 8  o 27.90504 10.68247 7.937417       10.14912 0.000000       0.000000 7.937417       10.14912 ?        ?        27.90504 10.68247 0.000000       10.68247 
1 1 1 -12 32 9  o 65.88003 5.260837 54.33908       8.375757 51.51417       11.37778 57.68098       12.37519 63.25919 7.528216 66.88544 7.734860 -3.626251      10.79361 
1 1 1 -12 32 10 o 75.27956 4.160351 70.21594       7.602404 73.12898       12.80527 68.63027       9.447599 75.69682 7.021894 74.05213 5.269811 1.644684       8.779402 
1 1 1 -12 32 11 o 41.63255 5.725647 22.07117       5.655214 24.35313       9.217002 20.69345       7.161712 42.51786 9.165941 39.64036 7.691357 2.877499       11.96543 
1 1 1 -12 32 12 o 62.80070 3.815093 48.84887       5.811017 65.23161       11.89464 43.71298       6.659876 71.36921 6.926170 59.15578 4.657444 12.21343       8.346474 
1 1 1 -12 32 13 o 28.83132 6.951763 10.98868       4.826943 9.563704       8.047487 11.78943       6.032591 27.75247 9.682931 29.69258 8.109805 -1.940104      12.63044 
1 1 1 -12 32 14 o 54.48446 4.012613 36.94698       5.290277 22.87084       10.61377 41.60001       6.102334 40.33472 10.64488 57.72075 4.370870 -17.38604      11.50730 
1 1 1 -12 32 15 o 37.16301 5.157617 17.60756       4.545122 11.09642       8.829606 19.95484       5.301456 29.30035 10.14725 39.42892 5.681259 -10.12856      11.62942 
1 1 1 -12 32 16 o 16.67105 6.481802 2.403470       3.778699 12.53663       7.112572 -1.581290      4.460209 30.30185 8.987253 14.09624 6.310475 16.20560       10.98148 
1 1 1 -12 32 17 o 46.23164 4.431899 26.91442       4.931971 34.80344       11.00486 24.93168       5.517042 50.16323 9.346289 44.20375 5.222384 5.959473       10.70637 
1 1 1 -12 32 18 o 27.60956 5.985360 10.08350       3.910690 13.83774       7.036576 8.405660       4.704087 31.51162 8.818001 25.03350 7.277863 6.478119       11.43348 
1 1 1 -12 32 19 o 26.82880 6.032713 9.579668       3.848104 16.53531       7.204445 6.803137       4.551799 34.33185 8.623811 22.76224 7.270654 11.56961       11.27974 
1 1 1 -12 32 20 o 38.14347 5.135829 18.79445       4.652637 12.93873       10.96707 20.07965       5.137907 30.42773 11.21802 39.28031 5.519599 -8.852579      12.50240 
1 1 1 -12 32 21 o 23.76289 6.512810 7.673126       3.882856 4.424296       7.024796 9.102350       4.659297 21.64434 8.702557 25.69328 7.170214 -4.048946      11.27592 
1 1 1 -12 32 22 o 19.77325 6.479249 5.108275       3.600808 0.5140806      6.682232 6.988182       4.274497 18.30489 7.977124 22.64875 7.020339 -4.343866      10.62637 
1 1 1 -12 32 23 o 39.94675 4.483768 20.56786       4.289507 18.28211       7.196486 21.82746       5.342231 35.31121 8.471819 40.60566 5.543426 -5.294441      10.12429 
1 1 1 -12 32 24 o 60.12252 3.774542 45.84141       5.502253 43.17845       8.552734 47.72181       7.186974 56.40498 6.331487 60.53927 4.913823 -4.134296      8.014573 
1 1 1 -12 32 25 o 10.19164 4.855394 -3.733478      3.328065 -1.792552      6.097093 -4.557192      3.971977 15.76324 7.185328 11.00200 5.258767 4.761234       8.904132 
1 1 1 -12 32 26 o 14.76682 6.056872 1.632562       3.482955 -5.385603      5.955645 5.280455       4.293763 13.69816 6.517247 19.80385 7.058519 -6.105691      9.607143 
1 1 1 -12 32 27 o 15.47343 6.151619 2.341395       3.470105 2.890698       6.228736 2.094175       4.178648 18.66459 7.908872 16.01668 6.608622 2.647913       10.30651 
1 1 1 -12 32 28 o 41.15025 4.216949 22.22785       4.168952 21.16657       7.240506 22.75418       5.098990 36.63457 8.302935 40.87540 5.239332 -4.240837      9.817806 
1 1 1 -12 32 29 o 23.88110 6.707500 8.598020       4.063435 9.898833       6.362738 7.702076       5.280520 24.41034 8.602827 22.22961 7.836894 2.180725       11.63725 
1 1 1 -12 32 30 o 15.79131 6.415505 2.619582       3.862315 6.339611       5.940392 -0.1045877     5.083455 20.55669 8.087478 14.84889 6.684851 5.707803       10.49259 
1 1 1 -12 32 31 o 40.14968 4.388061 21.83298       4.223473 9.250070       6.907438 29.34597       5.337438 22.75549 8.786479 46.13824 4.818112 -23.38275      10.02080 
1 1 1 -12 32 32 o 12.86604 5.662648 0.3994693      3.441972 -1.160115      6.176242 1.102036       4.145374 15.00237 6.978218 14.34053 6.265615 0.6618338      9.378350 
1 1 1 -12 32 33 o 19.87528 6.998296 6.483187       4.209925 7.217230       6.846267 6.036850       5.338564 20.33807 8.431619 19.27183 7.640282 1.066240       11.37832 
1 1 1 -12 33 1  o 30.81800 4.738653 12.07702       3.444936 11.05568       4.522780 13.48840       5.316695 28.99097 6.556062 31.95177 7.020398 -2.960793      9.605619 
1 1 1 -12 33 2  o 27.50302 5.265513 9.752307       3.400561 15.09573       4.612202 3.387815       5.033622 34.25103 5.727950 19.39356 7.497325 14.85747       9.435004 
1 1 1 -12 33 3  o 66.65622 3.038097 54.71425       4.921926 55.19579       6.940072 54.22696       6.981421 66.59998 4.299125 65.98905 4.366008 0.6109238      6.127357 
1 1 1 -12 33 4  o 18.99154 5.917554 4.530551       3.032667 3.813345       3.948010 5.562865       4.736551 18.70206 6.755856 21.59143 7.434110 -2.889370      10.04528 
1 1 1 -12 33 5  o 16.61877 5.997681 2.967629       3.110706 7.297235       3.975496 -3.869004      4.995607 23.63978 6.632669 13.64960 6.323810 9.990179       9.164217 
1 1 1 -12 33 6  o 41.11585 5.624591 21.56560       5.487972 18.35705       8.668606 23.71176       7.089656 36.58416 9.603507 42.63184 7.071948 -6.047672      11.92643 
1 1 1 -12 33 7  f 24.91450 8.452850 7.709491       6.118968 0.000000       0.000000 7.709491       6.118968 ?        ?        24.91450 8.452850 0.000000       8.452850 
1 1 1 -12 33 8  o 35.28039 5.639938 15.98861       4.685683 19.98115       8.593371 14.29930       5.589757 38.19872 9.316348 32.85670 7.182136 5.342014       11.76339 
1 1 1 -12 33 9  o 16.24252 6.556127 1.685077       4.003806 -1.112558      6.796809 3.171755       4.954709 18.03906 7.947697 19.04560 7.417367 -1.006540      10.87121 
1 1 1 -12 33 10 o 48.72318 6.315136 30.56449       7.321933 23.40655       9.444516 41.34733       11.59185 41.16928 9.592524 55.48753 8.871448 -14.31825      13.06595 
1 1 1 -12 33 11 o 38.77979 4.860951 19.06302       4.493053 23.45672       8.629200 17.42881       5.262716 41.50441 8.804893 36.65131 6.107078 4.853100       10.71553 
1 1 1 -12 33 12 o 60.92731 4.412087 46.46565       6.506389 43.88438       10.63323 48.01053       8.226136 57.64326 7.767207 61.46991 5.551344 -3.826653      9.547090 
1 1 1 -12 33 13 o 62.43785 3.837573 48.52313       5.810819 48.25127       11.48891 48.61658       6.735896 60.21107 8.030105 62.26664 4.468911 -2.055561      9.189872 
1 1 1 -12 33 14 o 28.66681 6.259741 10.88534       4.250087 10.06884       8.443118 11.16245       4.918708 27.93443 9.903953 28.81152 7.061487 -0.8770943     12.16359 
1 1 1 -12 33 15 o 69.50864 3.621778 60.08985       6.113585 55.98966       12.31772 61.43002       7.042190 64.63560 7.990242 70.06370 4.143065 -5.428101      9.000498 
1 1 1 -12 33 16 o 104.8200 3.365716 136.2569       8.586067 151.9940       18.44179 131.9017       9.701688 107.5832 7.073566 102.8351 3.878365 4.748108       8.067035 
1 1 1 -12 33 17 o 57.19225 3.573457 40.82606       4.955487 32.59449       8.299041 45.38729       6.177716 49.36832 7.102466 60.02421 4.250932 -10.65590      8.277406 
1 1 1 -12 33 18 o 75.50748 3.279111 70.91421       6.019294 57.52609       9.640100 79.46941       7.706141 66.39404 6.023707 79.55758 3.987549 -13.16354      7.223959 
1 1 1 -12 33 19 o 43.66480 4.716845 24.46855       4.939457 23.09052       11.80884 24.76078       5.438038 37.99065 11.64980 43.69090 5.210123 -5.700241      12.76179 
1 1 1 -12 33 20 o 28.50824 5.943496 10.96867       3.995057 8.180522       6.947164 12.34627       4.883281 24.70745 8.956745 29.86990 6.854361 -5.162455      11.27854 
1 1 1 -12 33 21 o 14.09984 5.914629 0.8723706      3.427520 2.460087       5.534610 -0.1153600     4.365358 18.32238 7.587137 14.69052 6.423877 3.631859       9.941370 
1 1 1 -12 33 22 f 54.14943 3.552987 37.04256       4.662488 35.45524       7.976536 37.86636       5.746402 50.86668 6.589655 54.25575 4.383538 -3.389065      7.914477 
1 1 1 -12 33 23 o 20.03051 6.892911 5.405608       4.071836 4.899131       6.283491 5.772264       5.346268 20.72054 8.264635 21.02044 7.817208 -0.2998962     11.37598 
1 1 1 -12 33 24 o 28.45452 5.928302 11.25525       3.977128 9.301831       6.721062 12.30782       4.933618 24.80505 8.832140 29.10632 7.034524 -4.301271      11.29120 
1 1 1 -12 33 25 o 35.57306 4.799686 16.84213       4.054675 7.734722       6.749922 21.98375       5.071673 23.07658 8.740847 40.36778 5.282210 -17.29120      10.21294 
1 1 1 -12 33 26 o 23.02810 6.372262 7.695008       3.697021 4.533492       6.324050 9.336429       4.556776 19.87699 8.158173 24.94263 7.136230 -5.065647      10.83889 
1 1 1 -12 33 27 o 32.93091 5.808444 15.29742       4.490915 9.934076       6.631072 19.84183       6.103859 24.58121 8.770612 36.41241 7.134170 -11.83120      11.30575 
1 1 1 -12 33 28 o 61.08709 3.937239 48.81460       5.829863 35.52379       8.286963 61.83752       8.203021 48.37127 7.253648 67.35476 5.034105 -18.98349      8.829361 
1 1 1 -12 33 29 o 48.42986 4.342924 31.44391       5.071085 33.91486       11.68234 30.87022       5.629074 39.97807 11.42253 47.35490 4.951010 -7.376831      12.44936 
1 1 1 -12 33 30 o 25.08096 6.247071 9.602644       3.803777 16.27058       6.982090 6.788347       4.536017 29.62739 8.932274 20.56407 7.262240 9.063328       11.51198 
1 1 1 -12 33 31 o 16.85151 6.397706 4.001183       3.621113 -3.323718      6.424233 7.412161       4.383893 14.22623 6.768573 21.19664 7.154954 -6.970410      9.849211 
1 1 1 -12 33 32 o 12.01031 5.493489 -0.8388095     3.603840 1.243067       6.605991 -1.720944      4.300094 16.36296 7.466563 12.42881 5.795054 3.934148       9.451571 
1 1 1 -12 34 1  o 57.87275 3.289027 41.48853       4.619405 43.58358       6.420143 39.23965       6.651658 58.90516 4.506773 55.70204 4.951858 3.203121       6.695662 
1 1 1 -12 34 2  o 48.03892 3.468991 28.67549       4.033644 29.67464       5.498345 27.51112       5.935581 48.48363 4.713132 46.43738 5.342392 2.046249       7.124238 
1 1 1 -12 34 3  o 42.31836 4.342402 22.53667       4.414656 21.65047       6.613393 23.24896       5.929051 40.50576 6.950103 42.44434 5.890891 -1.938576      9.110792 
1 1 1 -12 34 4  o 48.31814 3.582201 29.03858       4.187899 25.58464       5.547614 33.61473       6.385561 44.83593 5.172113 51.46862 5.160757 -6.632687      7.306447 
1 1 1 -12 34 5  o 56.63372 3.290091 39.72088       4.521111 36.13602       6.097611 44.09809       6.737857 53.54900 4.721042 59.19693 4.709546 -5.647923      6.668437 
1 1 1 -12 34 6  o 21.48024 8.338656 4.439078       6.246256 0.000000       0.000000 4.439078       6.246256 ?        ?        21.48024 8.338656 0.000000       8.338656 
1 1 1 -12 34 7  o 12.44119 5.702077 -2.456830      3.908913 -5.110787      6.665495 -1.065664      4.825863 15.55222 7.239162 15.06312 6.664047 0.4890966      9.839460 
1 1 1 -12 34 8  o 33.95000 6.078569 15.08442       4.844273 22.01180       9.118519 12.36050       5.717906 39.56393 9.564370 30.16184 7.741042 9.402086       12.30451 
1 1 1 -12 34 9  f 36.05822 6.413218 17.11139       5.428757 9.124988       8.064566 23.72928       7.341165 26.90825 9.663936 42.14311 7.419143 -15.23486      12.18340 
1 1 1 -12 34 10 o 21.00769 6.994452 5.553232       4.190855 -1.903609      7.887821 8.486120       4.946834 18.74823 8.392573 25.17580 7.502073 -6.427563      11.25684 
1 1 1 -12 34 11 o 38.77144 5.663042 19.48392       5.192687 14.02917       8.216388 23.11153       6.700454 31.54021 9.725843 41.77064 6.817533 -10.23043      11.87732 
1 1 1 -12 34 12 f 73.64514 4.141448 67.95128       7.402511 65.06512       12.74708 69.41986       9.092854 69.84573 7.612229 73.93402 5.077674 -4.088287      9.150345 
1 1 1 -12 34 13 o 35.60489 5.588708 16.52600       4.689538 14.35051       9.405066 17.24584       5.410038 31.60353 10.47678 36.04667 6.392911 -4.443140      12.27323 
1 1 1 -12 34 14 o 21.95409 6.913393 6.366279       4.128153 4.807847       7.560561 7.028243       4.927505 22.55466 9.042195 23.08439 7.580303 -0.5297298     11.79925 
1 1 1 -12 34 15 o 46.90623 4.546231 28.02304       5.131506 31.39826       10.16314 26.86815       5.944954 46.79539 9.240313 45.48734 5.472997 1.308044       10.73951 
1 1 1 -12 34 16 o 57.66759 3.918719 41.88158       5.474248 44.68172       11.17597 40.99768       6.279091 56.53366 8.364365 56.71812 4.581931 -0.1844597     9.537122 
1 1 1 -12 34 17 o 70.76344 4.299118 63.53728       7.378542 83.72919       13.57687 55.07382       8.789919 78.62362 7.164783 64.96782 5.606822 13.65580       9.097834 
1 1 1 -12 34 18 o 34.33473 5.804359 15.76928       4.683594 -7.737269      11.78258 20.18050       5.104170 19.63410 9.290346 39.08706 5.511462 -19.45296      10.80216 
1 1 1 -12 34 19 o 74.82675 3.258977 70.11667       5.928320 57.60934       9.804593 77.32449       7.443024 65.52130 6.214910 78.11730 3.922454 -12.59600      7.349201 
1 1 1 -12 34 20 o 50.63289 3.954237 32.71387       4.840341 32.99660       8.197447 32.56253       5.997498 48.52537 7.145971 49.85336 5.004339 -1.327991      8.724008 
1 1 1 -12 34 21 o 40.60300 4.430361 21.44185       4.312587 20.99756       7.131326 21.69801       5.414938 37.66479 8.015912 40.05092 5.709579 -2.386124      9.841450 
1 1 1 -12 34 22 o 25.99971 6.583448 9.676522       4.174706 9.365149       6.182312 9.937510       5.660049 24.89444 8.495652 25.64502 8.097704 -0.7505817     11.73665 
1 1 1 -12 34 23 o 42.39180 4.219417 23.38655       4.301019 20.53325       7.372888 24.85843       5.295410 36.39472 8.472252 43.07299 5.146702 -6.678272      9.913001 
1 1 1 -12 34 24 o 11.96329 5.445687 -1.340641      3.486883 2.041364       6.035690 -3.034814      4.271876 17.79706 7.668716 12.21857 5.722775 5.578492       9.568666 
1 1 1 -12 34 25 o 30.01941 6.270019 12.99558       4.438582 6.906797       6.433575 18.52604       6.131518 21.77980 8.460590 34.96784 7.425215 -13.18805      11.25679 
1 1 1 -12 34 26 o 14.15356 6.140785 0.7121716      3.923433 -6.769595      5.931168 6.533086       5.231591 12.77801 6.187473 20.89491 7.739970 -8.116900      9.909185 
1 1 1 -12 34 27 o 23.28358 6.300488 8.137427       3.661070 7.968462       6.548034 8.214266       4.415749 22.11931 8.551085 22.86547 7.143003 -0.7461605     11.14197 
1 1 1 -12 34 28 o 20.98000 6.833766 6.892011       4.008477 28.52447       10.43758 3.149484       4.341395 36.82785 10.87804 16.56093 6.773988 20.26692       12.81479 
1 1 1 -12 34 29 o 25.39070 6.214280 9.859581       3.813319 1.229105       6.389205 14.63495       4.752617 16.53769 7.465310 30.81339 6.532339 -14.27569      9.919793 
1 1 1 -12 34 30 o 43.74942 5.050048 27.10869       5.285284 25.45441       7.763652 28.53760       7.215457 37.63416 8.647258 41.93845 7.326687 -4.304291      11.33382 
1 1 1 -12 34 31 o 24.47578 7.132286 10.10913       4.513089 5.275831       7.028704 13.49971       5.886951 18.92602 8.215242 27.04516 8.212186 -8.119137      11.61595 
1 1 1 -12 35 1  o 13.96889 5.611662 1.349864       2.918275 4.653955       3.997913 -2.418561      4.269599 19.55480 6.824714 13.05810 5.975261 6.496697       9.070858 
1 1 1 -12 35 2  o 54.59747 3.421639 37.13290       4.529536 45.77113       6.515924 29.05527       6.300946 60.18917 4.474445 47.40613 5.559777 12.78304       7.136651 
1 1 1 -12 35 3  o 47.32200 3.656149 28.01311       4.183544 36.47775       6.017299 20.09322       5.820459 53.63105 4.650053 38.98786 6.344129 14.64319       7.865810 
1 1 1 -12 35 4  o 48.93830 3.512430 29.88781       4.160971 25.41222       5.589555 35.45076       6.231678 44.44735 5.262515 52.75481 4.903513 -8.307457      7.192948 
1 1 1 -12 35 5  o 59.43434 3.736765 44.14557       5.384753 40.21732       8.392698 46.89404       7.020175 55.44723 6.324290 60.79054 4.777239 -5.343311      7.925822 
1 1 1 -12 35 6  o 68.16066 4.395692 58.55946       7.262321 57.07961       11.88672 59.44084       9.173526 65.18477 7.627101 67.98840 5.586108 -2.803635      9.453956 
1 1 1 -12 35 7  o 52.82618 4.414901 35.28956       5.631450 40.27182       10.13657 33.06531       6.772821 54.44727 7.867617 50.57518 5.588458 3.872089       9.650401 
1 1 1 -12 35 8  o 47.85353 4.440211 29.02852       5.118843 35.25464       10.16841 26.91514       5.924246 50.34877 8.595916 45.62910 5.434562 4.719669       10.16977 
1 1 1 -12 35 9  o 29.91312 6.484937 12.06144       4.590632 9.969954       8.185957 13.02095       5.544539 27.24209 9.742014 30.70617 7.479915 -3.464083      12.28234 
1 1 1 -12 35 10 o 34.90459 6.261232 16.24790       5.130053 8.600513       7.662328 22.46080       6.906396 25.74218 9.395388 40.64803 7.237657 -14.90585      11.85989 
1 1 1 -12 35 11 o 20.82335 6.873450 5.634600       4.049449 6.685877       7.536644 5.207927       4.801394 23.91639 9.192797 20.70413 7.454082 3.212254       11.83515 
1 1 1 -12 35 12 o 26.32745 6.542479 9.464581       4.179059 7.982056       7.418552 10.15373       5.057953 24.91553 9.219118 27.00036 7.446442 -2.084827      11.85081 
1 1 1 -12 35 13 o 23.97065 6.828708 7.888909       4.181311 5.855907       8.252841 8.590993       4.849858 23.51455 9.440195 24.88610 7.431166 -1.371550      12.01414 
1 1 1 -12 35 14 o 53.57359 4.131604 36.43064       5.352290 27.49336       10.08727 39.93276       6.314468 42.63938 9.898711 55.78883 4.687979 -13.14945      10.95270 
1 1 1 -12 35 15 o 48.30327 4.344636 29.85392       5.059476 26.67811       10.08031 30.92340       5.849675 41.59873 10.05605 48.80513 4.988565 -7.206402      11.22541 
1 1 1 -12 35 16 o 47.01523 4.284410 28.33551       4.854818 24.28939       9.782265 29.65774       5.592091 39.27557 10.14848 47.76977 4.871925 -8.494198      11.25732 
1 1 1 -12 35 17 o 14.86358 6.491994 0.5207762E-01  4.447133 0.000000       0.000000 0.5207762E-01  4.447133 ?        ?        14.86358 6.491994 0.000000       6.491994 
1 1 1 -12 35 18 o 18.36317 6.684948 4.191315       3.875481 2.616253       7.902100 4.690145       4.447028 20.29874 8.760858 19.35335 7.141963 0.9453945      11.30311 
1 1 1 -12 35 19 o 53.41805 3.778844 36.41470       4.887321 34.38285       8.275993 37.50273       6.056107 49.24682 7.101050 53.57604 4.685711 -4.329220      8.507690 
1 1 1 -12 35 20 o 25.99801 6.189537 9.542500       3.864670 9.825181       6.406857 9.380812       4.845473 25.32987 8.648461 25.18917 7.404200 0.1406956      11.38499 
1 1 1 -12 35 21 o 23.63787 7.072474 8.214260       4.389629 23.49756       7.142749 -1.061064      5.564438 39.78576 7.644914 15.33583 6.940561 24.44993       10.32551 
1 1 1 -12 35 22 o 12.35715 5.697690 -2.020156      3.984982 -4.836772      6.011135 0.1882395      5.322689 13.87182 6.584822 15.74799 6.981250 -1.876173      9.596756 
1 1 1 -12 35 23 o 20.76265 6.923711 6.304842       4.106202 1.935404       6.282959 9.562578       5.425120 17.77810 7.741522 24.65090 7.943864 -6.872803      11.09216 
1 1 1 -12 35 24 o 46.41744 4.052445 28.26975       4.537976 30.14725       7.841232 27.32423       5.564536 44.43344 7.508939 44.62171 5.215637 -0.1882668     9.142595 
1 1 1 -12 35 25 o 43.11088 4.296156 24.77128       4.453371 22.75559       7.570809 25.83775       5.506866 36.90090 8.581851 43.04912 5.365476 -6.148224      10.12109 
1 1 1 -12 35 26 o 37.08095 4.684535 18.81660       4.138754 20.78220       7.196778 17.84531       5.059020 34.80657 8.548109 34.75291 6.201146 0.5365753E-01  10.56051 
1 1 1 -12 35 27 o 31.94287 5.997966 15.11471       4.497484 32.24016       11.18648 11.81281       4.911958 38.31423 11.24684 26.89453 7.306473 11.41971       13.41179 
1 1 1 -12 35 28 o 16.27815 6.332926 3.515614       3.608844 2.740081       6.198683 3.913267       4.438654 17.25031 7.595455 17.16074 6.911383 0.8956146E-01  10.26928 
1 1 1 -12 35 29 o 17.20643 6.504397 4.333436       3.733354 12.14587       6.321732 0.1496316      4.626244 25.17185 8.590899 14.05356 6.347386 11.11829       10.68143 
1 1 1 -12 36 1  o 17.51530 6.493136 3.444355       3.683135 3.791190       5.636248 3.185865       4.865757 19.74617 7.843301 18.42092 7.296925 1.325249       10.71273 
1 1 1 -12 36 2  f 56.10583 3.286116 39.33300       4.473233 45.36449       6.330167 33.31697       6.322054 59.70625 4.381207 50.68203 5.192111 9.024216       6.793599 
1 1 1 -12 36 3  o 63.14631 3.526543 49.95842       5.405110 60.15406       7.285230 37.47412       8.061545 68.81640 4.366777 53.02821 6.365521 15.78819       7.719366 
1 1 1 -12 36 4  f 44.06427 4.510277 24.85540       4.774871 22.36356       7.889200 26.29587       5.998266 39.52971 8.446211 44.76160 5.622758 -5.231892      10.14662 
1 1 1 -12 36 5  o 120.9219 2.993313 181.4106       8.820498 198.9519       13.59749 168.6670       11.58981 125.1993 4.463921 115.6095 4.120422 9.589813       6.074904 
1 1 1 -12 36 6  o 50.63054 5.675698 33.62004       6.882337 36.26311       9.345853 30.48851       10.17284 51.13975 7.741242 45.46571 9.488811 5.674042       12.24599 
1 1 1 -12 36 7  o 26.23505 7.592478 9.677830       5.130212 0.000000       0.000000 9.677830       5.130212 ?        ?        26.23505 7.592478 0.000000       7.592478 
1 1 1 -12 36 8  o 45.93849 4.638775 27.11903       5.121911 24.74046       9.444793 28.10997       6.096170 40.55750 9.689237 46.30052 5.511027 -5.743019      11.14687 
1 1 1 -12 36 9  o 18.86482 7.300910 3.743770       4.777206 -1.286932      7.726241 6.857400       6.078373 18.33783 8.249645 22.98848 8.371508 -4.650644      11.75325 
1 1 1 -12 36 10 o 27.04067 6.441458 10.08127       4.183771 11.96556       7.821267 9.325967       4.951787 28.37938 9.556829 25.68565 7.466889 2.693727       12.12796 
1 1 1 -12 36 11 o 33.93997 5.248750 15.21857       4.201186 22.94125       8.403725 12.64545       4.850851 39.25548 8.980152 30.13887 6.770472 9.116610       11.24644 
1 1 1 -12 36 12 o 24.53959 6.466851 8.375558       3.920872 15.77716       8.266156 6.226861       4.453776 31.82636 9.744530 21.45476 7.211655 10.37160       12.12286 
1 1 1 -12 36 13 o 16.05394 6.450890 2.190397       3.857424 3.227727       7.740915 1.847712       4.449187 20.76471 8.808548 16.44068 6.804777 4.324024       11.13084 
1 1 1 -12 36 14 o 66.83263 3.618374 56.50397       5.871046 62.75264       12.29534 54.65842       6.682039 66.32143 7.753817 65.29800 4.221892 1.023430       8.828706 
1 1 1 -12 36 15 f 16.86155 6.657600 2.830020       4.038428 8.507195       7.938962 0.8481711      4.690649 24.55026 9.435349 15.75920 6.775179 8.791057       11.61589 
1 1 1 -12 36 16 o 27.58562 7.322633 11.13941       5.004005 0.000000       0.000000 11.13941       5.004005 ?        ?        27.58562 7.322633 0.000000       7.322633 
1 1 1 -12 36 17 o 18.42171 6.731741 4.304699       3.935331 1.623554       7.663924 5.264781       4.586114 19.26354 8.465014 19.95296 7.270803 -0.6894226     11.15890 
1 1 1 -12 36 18 o 48.22964 4.999466 30.91840       5.790769 41.09135       11.07913 27.09469       6.792428 51.08005 9.240657 43.87119 6.554092 7.208866       11.32898 
1 1 1 -12 36 19 o 25.09572 7.259431 9.413276       4.690993 7.253100       8.410363 10.38879       5.651799 23.04993 9.428316 25.89178 8.080024 -2.841843      12.41692 
1 1 1 -12 36 20 o 13.15573 6.082767 -2.255380      4.587712 -2.102038      5.831075 -2.504517      7.432542 14.94389 6.891054 16.52736 7.676497 -1.583469      10.31578 
1 1 1 -12 36 21 o 21.31639 6.707500 6.705239       3.886631 7.434060       6.676724 6.331690       4.779984 22.25047 8.625743 20.79631 7.443502 1.454153       11.39338 
1 1 1 -12 36 22 o 11.21387 5.249833 -2.525573      3.588160 -4.885605      6.507790 -1.494745      4.300983 14.23334 6.783339 13.04559 5.979879 1.187747       9.042823 
1 1 1 -12 36 23 o 15.26338 6.212349 2.300922       3.629384 13.86180       6.844814 -2.220729      4.280699 28.04557 8.911091 12.48657 5.808525 15.55900       10.63703 
1 1 1 -12 36 24 o 20.64727 6.576571 6.519053       3.726298 12.36745       6.603571 3.786830       4.513552 26.22244 8.780961 17.39600 6.982195 8.826441       11.21857 
1 1 1 -12 36 25 o 32.34287 5.251044 14.83855       3.996850 19.14494       7.247904 12.95675       4.791189 32.57551 8.885982 28.67343 6.933708 3.902079       11.27107 
1 1 1 -12 36 26 o 9.839647 4.793110 -5.157741      3.703121 -14.02011      9.124259 -3.410079      4.051831 13.72342 6.837392 11.26208 5.363123 2.461339       8.689823 
1 1 1 -12 36 27 o 16.50234 6.744708 3.414374       4.299753 0.5228709      6.280575 5.965114       5.898895 15.88349 7.260170 19.42419 7.914694 -3.540696      10.74023 
1 1 1 -12 37 1  o 30.76227 4.528032 12.37939       3.292961 11.79402       4.416918 13.11188       4.940914 29.08297 6.405663 30.46350 6.825280 -1.380526      9.360394 
1 1 1 -12 37 2  o 44.75408 3.955864 25.58992       4.269920 29.52033       5.583030 20.05118       6.627597 47.53226 4.889648 37.39631 7.533350 10.13596       8.981091 
1 1 1 -12 37 3  o 36.18406 5.562131 17.54246       4.747735 20.51553       7.084263 15.11837       6.396855 37.51329 7.994171 31.94333 8.182232 5.569958       11.43922 
1 1 1 -12 37 4  o 14.87224 6.057981 1.617015       3.454545 1.867269       4.515547 1.263845       5.364280 16.52230 6.848471 17.02715 7.281303 -0.5048523     9.995946 
1 1 1 -12 37 5  o 48.53897 5.806442 31.55761       6.732004 48.91428       9.832226 16.24000       9.236643 59.49424 6.910143 31.63102 10.37794 27.86322       12.46803 
1 1 1 -12 37 6  o 62.36089 4.382264 49.99450       6.617184 68.03650       11.92200 41.96165       7.955029 70.00370 7.086117 55.91808 5.928046 14.08562       9.238766 
1 1 1 -12 37 7  o 29.04079 6.861743 11.94707       4.778397 16.25848       7.969207 9.526859       5.970800 32.15421 9.507094 25.47532 8.343108 6.678888       12.64881 
1 1 1 -12 37 8  o 38.53611 7.510470 21.30874       6.799392 24.96635       9.818589 17.93844       9.425063 39.34196 10.16816 32.94825 10.45519 6.393711       14.58432 
1 1 1 -12 37 9  o 42.59298 5.597672 24.32716       5.669581 22.98685       9.991626 24.96364       6.885412 37.18437 10.54373 42.17744 6.940239 -4.993073      12.62289 
1 1 1 -12 37 10 o 16.00505 6.705688 1.564652       4.397486 9.977895       7.823441 -2.321203      5.316911 25.79912 9.481091 14.44608 6.631800 11.35303       11.57030 
1 1 1 -12 37 11 o 43.80527 5.324600 25.59221       5.567342 39.95689       9.918416 18.98433       6.727067 52.24289 8.048847 35.82949 7.915885 16.41341       11.28916 
1 1 1 -12 37 12 o 29.37675 6.731931 12.31528       4.715796 14.98476       8.386256 11.08082       5.702867 30.19379 9.887669 27.11546 8.048813 3.078323       12.74949 
1 1 1 -12 37 13 o 18.12998 7.100493 3.640643       4.561221 5.598529       7.693589 2.579509       5.663964 21.93701 9.000384 18.14945 7.607625 3.787558       11.78486 
1 1 1 -12 37 14 o 28.82886 6.890425 12.03994       4.774721 14.12926       8.434832 11.05475       5.792062 29.08636 9.923439 26.87906 8.142401 2.207306       12.83641 
1 1 1 -12 37 15 o 29.92553 7.946874 13.69107       5.892080 0.000000       0.000000 13.69107       5.892080 ?        ?        29.92553 7.946874 0.000000       7.946874 
1 1 1 -12 37 16 f 16.51385 6.653812 2.656769       4.115973 9.970970       7.958421 -0.1401395E-01 4.809089 25.06678 9.491934 15.01443 6.646993 10.05235       11.58790 
1 1 1 -12 37 17 o 31.49014 7.002260 14.63863       5.234399 11.02645       8.782037 16.62897       6.518890 25.71700 9.913286 32.54372 8.219194 -6.826729      12.87744 
1 1 1 -12 37 18 o 16.09347 6.570732 2.435495       4.075565 -3.580714      7.638505 4.829815       4.818790 16.15493 7.593676 19.16540 7.354766 -3.010464      10.57150 
1 1 1 -12 37 19 o 33.85888 6.522854 16.75262       5.186838 10.90929       8.179561 20.68255       6.707986 25.10037 9.594725 36.46164 7.786319 -11.36127      12.35660 
1 1 1 -12 37 20 o 27.44643 6.293281 11.09824       4.119239 11.93265       8.402003 10.83422       4.726221 25.58217 9.737513 26.43333 7.161042 -0.8511658     12.08717 
1 1 1 -12 37 21 o 22.22500 6.866507 7.626394       4.093091 2.656348       8.016301 9.379061       4.760401 18.93962 8.470726 24.23341 7.390068 -5.293789      11.24128 
1 1 1 -12 37 22 o 38.87647 4.952659 20.91163       4.585657 20.11224       7.855339 21.32487       5.647889 33.06334 9.339894 37.91505 6.336204 -4.851715      11.28632 
1 1 1 -12 37 23 f 29.16139 5.824693 12.48889       3.994255 12.15089       6.610170 12.68328       5.012947 25.68968 8.784285 28.01012 7.278696 -2.320440      11.40803 
1 1 1 -12 37 24 o 28.01842 5.945798 11.72228       3.933858 13.16973       6.868852 11.01580       4.798802 26.27280 8.955188 25.84671 7.299619 0.4260845      11.55335 
1 1 1 -12 37 25 o 28.26179 7.664205 13.62239       5.410439 30.81071       11.51094 8.748260       6.129749 35.41874 11.58331 22.00830 8.331124 13.41044       14.26817 
1 1 1 -12 38 1  o 34.20304 6.050455 16.25648       4.858531 19.54733       7.718059 14.09645       6.252942 35.08173 8.988338 30.22587 8.257049 4.855858       12.20529 
1 1 1 -12 38 2  o 17.07697 6.514973 3.351516       3.766511 5.824622       6.660795 2.188976       4.566766 21.49452 8.530078 16.64783 6.892642 4.846687       10.96680 
1 1 1 -12 38 3  o 17.01251 5.999910 3.689238       3.095348 3.001769       4.140610 4.560103       4.660293 17.03227 6.736193 19.16142 7.261758 -2.129147      9.905021 
1 1 1 -12 38 4  o 14.62540 5.816001 1.941342       3.102578 3.977094       4.156604 -0.6197860     4.662210 18.15721 6.863338 14.49360 6.472660 3.663610       9.434020 
1 1 1 -12 38 5  o 27.52825 5.495617 10.38641       3.557452 11.06793       5.202554 9.787908       4.875364 27.24484 7.566859 25.72694 7.388104 1.517899       10.57551 
1 1 1 -12 38 6  o 49.76175 6.021517 33.95593       7.153588 43.05479       9.872142 23.89609       10.38039 54.33780 7.668374 36.90594 10.83420 17.43186       13.27343 
1 1 1 -12 38 7  o 22.89219 7.778765 7.641071       5.182150 12.80502       8.357830 4.415940       6.605050 27.90192 9.857425 20.31085 8.336981 7.591066       12.91023 
1 1 1 -12 38 8  o 22.30008 6.933886 7.165901       4.166220 6.747730       8.367105 7.303759       4.804120 22.95094 9.397805 22.44398 7.489136 0.5069599      12.01690 
1 1 1 -12 38 9  o 20.52251 6.971950 5.897241       4.162885 4.324251       7.777853 6.528749       4.928176 20.92311 8.850553 21.47446 7.570899 -0.5513496     11.64692 
1 1 1 -12 38 10 o 36.97472 5.283935 18.47734       4.625770 9.986509       9.636121 21.01991       5.273071 25.40762 10.20053 39.17925 5.689128 -13.77163      11.67977 
1 1 1 -12 38 11 o 25.69168 6.751653 9.636952       4.281517 9.992684       8.469990 9.514856       4.962173 25.17514 9.727284 25.12937 7.519774 0.4576492E-01  12.29500 
1 1 1 -12 38 12 o 30.16078 6.229535 12.92912       4.426975 17.87813       9.421721 11.52692       5.015061 31.49798 10.48740 27.70568 7.319670 3.792294       12.78918 
1 1 1 -12 38 13 o 27.04055 7.533768 11.16143       5.148335 0.000000       0.000000 11.16143       5.148335 ?        ?        27.04055 7.533768 0.000000       7.533768 
1 1 1 -12 38 14 o 25.58801 6.966915 9.804096       4.460215 7.465481       8.417973 10.71688       5.259099 22.86176 9.400932 26.26178 7.712208 -3.400023      12.15959 
1 1 1 -12 38 15 o 14.78797 6.186733 1.553601       3.734915 -0.2860567E-01 7.164101 2.144137       4.376765 17.33651 7.857700 16.09331 6.712409 1.243202       10.33440 
1 1 1 -12 38 16 o 32.70658 5.830976 15.16263       4.476968 13.49192       8.632656 15.77729       5.236147 27.10154 9.959425 32.56050 6.818032 -5.458965      12.06962 
1 1 1 -12 38 17 o 12.32287 5.613438 -1.174697      3.713510 -0.1805611     7.316370 -1.519679      4.309939 17.16304 7.841607 13.01913 5.974558 4.143909       9.858303 
1 1 1 -12 38 18 o 25.82068 7.690471 10.80500       5.199407 12.97360       8.469017 9.493191       6.586877 26.15209 9.815945 23.63192 8.697060 2.520170       13.11456 
1 1 1 -12 38 19 o 14.79297 6.582280 0.4101840      4.776018 -0.9913970     7.233458 1.493470       6.359286 16.41694 7.607166 17.02258 7.583549 -0.6056328     10.74147 
1 1 1 -12 38 20 o 41.39788 5.051361 23.84345       4.990514 29.11129       10.03831 22.11404       5.751651 38.24688 10.46754 38.55788 6.341568 -0.3109932     12.23867 
1 1 1 -12 38 21 o 14.75303 6.268420 1.701594       3.930880 -1.741571      7.730512 2.902325       4.565119 16.25973 7.641787 16.43540 6.855225 -0.1756668     10.26601 
1 1 1 -12 38 22 o 11.63009 5.528725 -3.347620      4.268196 -8.398694      7.759844 -1.156596      5.110750 13.87293 6.796344 13.94589 6.438187 -0.7295990E-01 9.361652 
1 1 1 -12 38 23 o 18.38595 6.977090 5.122797       4.305491 4.275840       6.510892 5.780966       5.739557 18.39440 7.945707 19.31238 7.829987 -0.9179764     11.15540 
1 1 1 -12 39 1  o 13.20928 5.616907 0.7650850      3.160500 -2.276397      4.432712 3.910020       4.507469 12.86685 5.959673 18.02672 7.058980 -5.159873      9.238338 
1 1 1 -12 39 2  o 48.60649 3.947740 30.66519       4.635828 32.75200       6.361274 28.30169       6.769889 48.96636 5.421744 44.56845 6.418082 4.397911       8.401612 
1 1 1 -12 39 3  o 13.88278 5.731979 1.388145       3.146387 8.281898       4.418799 -5.701637      4.481184 23.50178 7.110373 11.20621 5.414688 12.29556       8.937352 
1 1 1 -12 39 4  o 21.01117 6.104198 6.329269       3.310257 8.038608       4.578466 4.457061       4.791627 23.12062 7.280699 18.83993 7.306273 4.280691       10.31456 
1 1 1 -12 39 5  o 20.66540 6.614812 6.169872       3.766143 6.916138       4.572305 4.595239       6.641682 21.64557 7.307090 20.07006 8.311161 1.575512       11.06657 
1 1 1 -12 39 6  o 34.07507 6.244288 16.53961       4.994064 25.04547       8.863608 12.58343       6.044907 38.63922 9.484788 28.06411 8.275500 10.57510       12.58750 
1 1 1 -12 39 7  o 14.02248 6.104889 0.4252980      3.905540 -3.091268      6.987583 2.022978       4.709909 15.74200 7.355478 16.40081 6.909783 -0.6588106     10.09199 
1 1 1 -12 39 8  o 16.03555 6.528993 2.433107       4.010523 4.881974       7.688259 1.517633       4.700763 20.74668 8.788750 15.93418 6.815075 4.812500       11.12148 
1 1 1 -12 39 9  o 16.63677 6.636351 2.985150       4.051818 7.181453       8.212942 1.635265       4.658154 22.47642 9.268549 15.96119 6.804155 6.515229       11.49794 
1 1 1 -12 39 10 o 17.23965 6.684058 3.585298       4.009519 -1.347449      7.371275 5.657988       4.778213 16.83772 7.758420 20.00065 7.399133 -3.162935      10.72102 
1 1 1 -12 39 11 o 30.95207 6.315588 13.91064       4.602160 14.97541       8.861321 13.51737       5.385418 28.34450 10.13596 29.53168 7.477177 -1.187172      12.59547 
1 1 1 -12 39 12 o 40.33769 6.308582 23.47116       5.998228 0.000000       0.000000 23.47116       5.998228 ?        ?        40.33769 6.308582 0.000000       6.308582 
1 1 1 -12 39 13 o 16.38635 6.625376 2.865525       4.096541 -8.431375      8.355185 6.440665       4.700272 14.92144 7.252924 20.70252 7.384414 -5.781077      10.35058 
1 1 1 -12 39 14 o 13.12068 5.865359 -0.3256990     3.838478 7.058682       7.604972 -2.849981      4.446410 21.66758 8.925316 12.39128 5.814791 9.276291       10.65237 
1 1 1 -12 39 15 o 11.59774 5.397423 -2.108537      3.702571 -0.3695601     6.909281 -2.809103      4.385416 16.52053 7.575151 12.27548 5.764980 4.245054       9.519343 
1 1 1 -12 39 16 o 15.64953 6.409033 2.519439       3.892148 -9.536241      7.186047 7.524291       4.630094 13.18976 6.477661 21.73921 7.353081 -8.549455      9.799381 
1 1 1 -12 39 17 o 12.61072 6.062711 -5.067869      5.451662 -11.83433      6.836416 6.750651       9.035020 12.12723 6.021464 21.27069 9.272589 -9.143466      11.05617 
1 1 1 -12 39 18 o 17.85875 7.089605 4.317648       4.602595 11.34412       7.805782 0.5727025      5.698631 24.29440 9.350986 15.70818 7.074212 8.586223       11.72542 
1 1 1 -12 39 19 o 11.71307 5.588957 -3.760524      4.445535 4.203053       7.615258 -7.877319      5.475328 19.04552 8.400997 11.51365 5.654460 7.531864       10.12668 
1 1 1 -12 39 20 o 18.35871 7.232626 4.937509       4.756679 -1.764980      8.494470 7.999299       5.741242 16.62543 7.873092 21.50216 8.079592 -4.876732      11.28120 
1 1 1 -12 40 1  o 15.74066 6.172369 2.871069       3.450332 4.690620       4.373065 -0.1295793     5.615795 18.45579 7.025028 15.46162 6.987410 2.994168       9.908325 
1 1 1 -12 40 2  o 15.64116 5.985000 2.957512       3.184820 1.869546       4.500178 4.049197       4.507863 15.75744 6.701526 17.85069 7.038322 -2.093247      9.718459 
1 1 1 -12 40 3  o 36.90215 4.629134 18.41002       4.071463 23.74860       5.529772 12.08953       6.016853 41.00242 5.687208 26.80950 8.332269 14.19292       10.08816 
1 1 1 -12 40 4  o 13.17052 5.914363 -0.4907970     3.951179 -0.9618958     4.324085 1.892535       9.725916 13.37630 6.079282 19.68146 9.010682 -6.305160      10.86969 
1 1 1 -12 40 5  o 15.67374 6.176520 2.770894       3.469794 0.4373269      4.419027 6.522720       5.603223 14.51438 6.401059 20.82068 7.945510 -6.306307      10.20317 
1 1 1 -12 40 6  o 22.41149 7.336541 7.861008       4.617218 11.29415       7.740059 5.964392       5.752918 25.08587 9.390576 20.30172 7.967374 4.784153       12.31511 
1 1 1 -12 40 7  o 21.09625 7.236899 6.833938       4.487343 7.766087       6.919657 6.157430       5.894926 22.09208 8.717241 20.49522 8.058540 1.596859       11.87141 
1 1 1 -12 40 8  o 14.78901 6.435062 0.9628631      4.334386 1.345486       7.042326 0.7295333      5.499406 17.61504 7.904210 15.88849 7.066862 1.726551       10.60269 
1 1 1 -12 40 9  o 17.49333 7.013313 3.738333       4.548480 -4.345989      6.712218 10.60279       6.185110 14.52511 6.912997 24.84706 8.497133 -10.32195      10.95403 
1 1 1 -12 40 10 o 21.96025 7.516981 7.689533       4.840747 0.9388502      7.677630 12.14387       6.236556 17.76147 8.083330 26.44759 8.516744 -8.686117      11.74203 
1 1 1 -12 40 11 o 14.93491 6.904783 -1.422808      5.909512 0.000000       0.000000 -1.422808      5.909512 ?        ?        14.93491 6.904783 0.000000       6.904783 
1 1 1 -12 40 12 o 21.96998 7.483377 7.780404       4.796432 25.13386       8.671638 0.1310894      5.757306 37.02653 9.548719 15.61417 7.063833 21.41235       11.87753 
1 1 1 -12 40 13 o 15.14829 6.538571 1.494988       4.402476 1.672392       7.508055 1.402030       5.434850 17.83541 8.067893 16.08198 7.095310 1.753426       10.74404 
1 1 1 -12 40 14 o 11.26677 5.555109 -8.741179      5.458894 0.000000       0.000000 -8.741179      5.458894 ?        ?        11.26677 5.555109 0.000000       5.555109 
1 1 1 -12 40 15 o 16.48561 6.616607 3.331051       4.053147 3.365880       7.942528 3.318786       4.713011 18.81630 8.422440 16.91913 7.003290 1.897163       10.95370 
1 1 1 -12 40 16 o 11.85257 5.695459 -4.540319      4.797808 -5.487257      7.237752 -3.798051      6.408014 14.32266 6.910862 14.12748 6.732397 0.1951876      9.648067 
1 1 1 -12 40 17 o 32.86971 5.907813 16.01180       4.558211 11.32757       9.408859 17.44836       5.210493 23.40958 9.808368 33.62273 6.595033 -10.21315      11.81941 
1 1 1 -12 41 1  o 12.32207 5.420488 0.1881317      3.150189 2.086777       4.747473 -1.305475      4.210742 15.87753 6.820928 12.77447 5.878068 3.103054       9.004263 
1 1 1 -12 41 2  o 9.165293 4.429869 -3.896665      3.004915 -5.050737      4.182382 -2.665311      4.320148 10.73706 5.198388 12.13385 5.705821 -1.396783      7.718784 
1 1 1 -12 41 3  o 12.78369 5.740445 -0.3195296     3.721847 -1.740500      4.352084 3.548709       7.180611 12.72437 5.897691 18.59974 8.182821 -5.875374      10.08669 
1 1 1 -12 41 4  o 27.62771 5.572619 11.06630       3.622206 10.87293       5.264670 11.24012       4.991394 25.39272 7.777066 26.14762 7.464876 -0.7549000     10.77994 
1 1 1 -12 41 5  o 19.16356 6.322536 5.529887       3.426467 3.136336       5.023839 7.611775       4.685360 17.02280 7.151983 21.65705 7.395813 -4.634241      10.28829 
1 1 1 -12 41 6  o 14.63383 6.113352 1.869356       3.638914 8.154007       6.661583 -0.8035027     4.344350 21.86201 8.575377 13.31717 6.068372 8.544832       10.50534 
1 1 1 -12 41 7  f 13.29755 5.958674 -0.1429510     3.987179 10.61284       7.080608 -5.137232      4.824872 23.95166 8.978407 11.68790 5.640291 12.26376       10.60305 
1 1 1 -12 41 8  o 14.10623 6.185450 0.7547858      4.072206 9.022782       7.507385 -2.692021      4.847268 22.47477 9.010281 12.86690 6.048456 9.607865       10.85214 
1 1 1 -12 41 9  o 20.36360 6.998615 6.533037       4.197262 8.425662       7.243244 5.576230       5.150067 21.97275 8.836055 19.28507 7.547259 2.687674       11.62054 
1 1 1 -12 41 10 f 22.06120 7.679047 8.151299       5.059668 0.000000       0.000000 8.151299       5.059668 ?        ?        22.06120 7.679047 0.000000       7.679047 
1 1 1 -12 41 11 o 18.91717 6.785449 5.461414       3.974466 13.93739       7.627643 2.302486       4.656562 26.46300 9.410383 15.92465 6.796215 10.53836       11.60792 
1 1 1 -12 41 12 o 18.20022 6.909791 4.876912       4.224010 11.98244       7.831946 1.962265       5.016080 24.50021 9.382833 15.92631 6.926365 8.573897       11.66242 
1 1 1 -12 41 13 o 15.77954 6.430121 2.869759       3.893868 1.915489       7.852060 3.180965       4.484075 17.82525 8.136322 16.51627 6.833298 1.308985       10.62514 
1 1 1 -12 42 2  o 17.36814 6.313087 4.430185       3.454481 4.656835       5.087185 4.236243       4.705820 18.12519 7.363156 17.57391 7.102627 0.5512829      10.23051 
1 1 1 -12 42 3  o 20.37158 6.446596 6.514767       3.585443 12.68653       5.503259 1.962936       4.726159 26.99555 7.878593 15.59174 6.752357 11.40381       10.37625 
1 1 1 -12 42 4  o 21.61009 6.296036 7.277172       3.517119 5.839874       5.115639 8.565579       4.843431 19.30448 7.531523 22.45454 7.520210 -3.150063      10.64319 
1 1 1 -12 42 5  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -11 0  1  o 237.7530 5.441782 689.9872       31.49119 689.9872       31.49119 689.9872       31.49119 237.7530 5.441782 237.7530 5.441782 0.000000       0.000000 
1 1 1 -11 0  2  o 156.3698 4.124675 298.5893       15.69261 298.5893       15.69261 298.5893       15.69261 156.3698 4.124675 156.3698 4.124675 0.000000       0.000000 
1 1 1 -11 0  3  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -11 0  4  o 106.5482 3.479774 138.7794       9.013257 138.7794       9.013257 138.7794       9.013257 106.5482 3.479774 106.5482 3.479774 0.000000       0.000000 
1 1 1 -11 0  5  o 294.4029 6.416067 1057.905       45.98130 1057.905       45.98130 1057.905       45.98130 294.4029 6.416067 294.4029 6.416067 0.000000       0.000000 
1 1 1 -11 0  6  o 179.3506 4.427850 392.7090       19.32562 392.7090       19.32562 392.7090       19.32562 179.3506 4.427850 179.3506 4.427850 0.000000       0.000000 
1 1 1 -11 0  7  o 902.6819 18.25765 9966.660       401.2496 9966.660       401.2496 9966.660       401.2496 902.6819 18.25765 902.6819 18.25765 0.000000       0.000000 
1 1 1 -11 0  8  o 91.78854 3.362411 103.0777       7.498064 103.0777       7.498064 103.0777       7.498064 91.78854 3.362411 91.78854 3.362411 0.000000       0.000000 
1 1 1 -11 0  9  o 30.86022 7.215776 13.34080       4.716649 13.34080       4.716649 13.34080       4.716649 30.86022 7.215776 30.86022 7.215776 0.000000       0.000000 
1 1 1 -11 0  10 o 504.9807 10.41052 3113.931       127.9872 3113.931       127.9872 3113.931       127.9872 504.9807 10.41052 504.9807 10.41052 0.000000       0.000000 
1 1 1 -11 0  11 o 871.6177 25.08074 9331.042       531.7258 9331.042       531.7258 9331.042       531.7258 871.6177 25.08074 871.6177 25.08074 0.000000       0.000000 
1 1 1 -11 0  12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -11 0  13 o 541.4611 11.14869 3581.180       146.9642 3581.180       146.9642 3581.180       146.9642 541.4611 11.14869 541.4611 11.14869 0.000000       0.000000 
1 1 1 -11 0  14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -11 0  15 o 48.44506 4.250210 29.25665       4.924864 29.25665       4.924864 29.25665       4.924864 48.44506 4.250210 48.44506 4.250210 0.000000       0.000000 
1 1 1 -11 0  16 o 104.2072 3.636779 132.8186       9.209755 132.8186       9.209755 132.8186       9.209755 104.2072 3.636779 104.2072 3.636779 0.000000       0.000000 
1 1 1 -11 0  17 o 313.0673 9.687148 1199.344       73.74398 1199.344       73.74398 1199.344       73.74398 313.0673 9.687148 313.0673 9.687148 0.000000       0.000000 
1 1 1 -11 0  18 o 153.9000 4.167448 289.3156       15.60358 289.3156       15.60358 289.3156       15.60358 153.9000 4.167448 153.9000 4.167448 0.000000       0.000000 
1 1 1 -11 0  19 o 232.9586 5.399539 662.7249       30.61572 662.7249       30.61572 662.7249       30.61572 232.9586 5.399539 232.9586 5.399539 0.000000       0.000000 
1 1 1 -11 0  20 o 211.6754 5.062463 547.2327       26.07996 547.2327       26.07996 547.2327       26.07996 211.6754 5.062463 211.6754 5.062463 0.000000       0.000000 
1 1 1 -11 0  21 o 134.5607 3.993675 221.3068       13.06953 221.3068       13.06953 221.3068       13.06953 134.5607 3.993675 134.5607 3.993675 0.000000       0.000000 
1 1 1 -11 0  22 o 38.13490 5.419646 18.77859       4.743050 18.77859       4.743050 18.77859       4.743050 38.13490 5.419646 38.13490 5.419646 0.000000       0.000000 
1 1 1 -11 0  23 o 142.7112 4.101798 248.9438       14.23823 248.9438       14.23823 248.9438       14.23823 142.7112 4.101798 142.7112 4.101798 0.000000       0.000000 
1 1 1 -11 0  24 o 186.5186 4.743322 425.1679       21.52810 425.1679       21.52810 425.1679       21.52810 186.5186 4.743322 186.5186 4.743322 0.000000       0.000000 
1 1 1 -11 0  25 o 8.184101 5.721915 -4.258350      4.220550 -4.258350      4.220550 -4.258350      4.220550 8.184101 5.721915 8.184101 5.721915 0.000000       0.000000 
1 1 1 -11 0  26 o 82.94400 3.877265 84.44795       7.797792 84.44795       7.797792 84.44795       7.797792 82.94400 3.877265 82.94400 3.877265 0.000000       0.000000 
1 1 1 -11 0  27 o 109.6199 3.940915 147.1313       10.49653 147.1313       10.49653 147.1313       10.49653 109.6199 3.940915 109.6199 3.940915 0.000000       0.000000 
1 1 1 -11 0  28 f 228.3327 5.462248 637.7401       30.35386 637.7401       30.35386 637.7401       30.35386 228.3327 5.462248 228.3327 5.462248 0.000000       0.000000 
1 1 1 -11 0  29 o 148.7080 4.387125 270.5766       15.86696 270.5766       15.86696 270.5766       15.86696 148.7080 4.387125 148.7080 4.387125 0.000000       0.000000 
1 1 1 -11 0  30 o 201.8519 7.427893 500.9544       36.42470 500.9544       36.42470 500.9544       36.42470 201.8519 7.427893 201.8519 7.427893 0.000000       0.000000 
1 1 1 -11 0  31 o 215.9387 5.318826 570.8195       27.95031 570.8195       27.95031 570.8195       27.95031 215.9387 5.318826 215.9387 5.318826 0.000000       0.000000 
1 1 1 -11 0  32 o 18.47301 9.174966 6.172782       4.991735 6.172782       4.991735 6.172782       4.991735 18.47301 9.174966 18.47301 9.174966 0.000000       0.000000 
1 1 1 -11 0  33 o 113.1521 4.181827 156.9817       11.49514 156.9817       11.49514 156.9817       11.49514 113.1521 4.181827 113.1521 4.181827 0.000000       0.000000 
1 1 1 -11 0  34 o 70.22524 4.506349 60.99829       7.638007 60.99829       7.638007 60.99829       7.638007 70.22524 4.506349 70.22524 4.506349 0.000000       0.000000 
1 1 1 -11 0  35 o 64.35667 4.735887 51.46011       7.332818 51.46011       7.332818 51.46011       7.332818 64.35667 4.735887 64.35667 4.735887 0.000000       0.000000 
1 1 1 -11 0  36 o 70.07816 5.941693 61.50557       9.972525 61.50557       9.972525 61.50557       9.972525 70.07816 5.941693 70.07816 5.941693 0.000000       0.000000 
1 1 1 -11 0  37 o 44.32036 5.900381 25.34832       6.057206 25.34832       6.057206 25.34832       6.057206 44.32036 5.900381 44.32036 5.900381 0.000000       0.000000 
1 1 1 -11 0  38 o 39.19074 6.533005 20.39413       5.718597 20.39413       5.718597 20.39413       5.718597 39.19074 6.533005 39.19074 6.533005 0.000000       0.000000 
1 1 1 -11 0  39 o 69.83847 4.503688 60.59142       7.590703 60.59142       7.590703 60.59142       7.590703 69.83847 4.503688 69.83847 4.503688 0.000000       0.000000 
1 1 1 -11 0  40 o 71.59393 7.395894 65.92565       12.56035 65.92565       12.56035 65.92565       12.56035 71.59393 7.395894 71.59393 7.395894 0.000000       0.000000 
1 1 1 -11 0  41 o 14.17873 8.337353 3.083293       4.880403 3.083293       4.880403 3.083293       4.880403 14.17873 8.337353 14.17873 8.337353 0.000000       0.000000 
1 1 1 -11 0  42 o 15.99070 8.706063 4.730093       4.799329 4.730093       4.799329 4.730093       4.799329 15.99070 8.706063 15.99070 8.706063 0.000000       0.000000 
1 1 1 -11 0  43 o 10.40654 6.950861 -1.224533      4.833761 -1.224533      4.833761 -1.224533      4.833761 10.40654 6.950861 10.40654 6.950861 0.000000       0.000000 
1 1 1 -11 0  44 o 47.08784 5.990293 29.44063       6.570495 29.44063       6.570495 29.44063       6.570495 47.08784 5.990293 47.08784 5.990293 0.000000       0.000000 
1 1 1 -11 0  45 o 11.71752 7.839284 -0.9844635     6.192734 -0.9844635     6.192734 -0.9844635     6.192734 11.71752 7.839284 11.71752 7.839284 0.000000       0.000000 
1 1 1 -11 0  46 o 15.72391 9.003602 5.095459       5.458013 5.095459       5.458013 5.095459       5.458013 15.72391 9.003602 15.72391 9.003602 0.000000       0.000000 
1 1 1 -11 0  47 o 37.37276 7.399009 20.71596       5.989295 20.71596       5.989295 20.71596       5.989295 37.37276 7.399009 37.37276 7.399009 0.000000       0.000000 
1 1 1 -11 0  48 o 9.826737 6.771140 -2.301400      5.376385 -2.301400      5.376385 -2.301400      5.376385 9.826737 6.771140 9.826737 6.771140 0.000000       0.000000 
1 1 1 -11 0  49 o 20.95973 11.32023 12.39529       8.050457 12.39529       8.050457 12.39529       8.050457 20.95973 11.32023 20.95973 11.32023 0.000000       0.000000 
1 1 1 -11 0  50 o 8.963224 6.301473 -3.556612      5.332531 -3.556612      5.332531 -3.556612      5.332531 8.963224 6.301473 8.963224 6.301473 0.000000       0.000000 
1 1 1 -11 1  1  o 354.1277 5.325183 1528.697       45.95477 1510.410       64.49195 1547.560       65.49947 351.9245 7.520036 356.2252 7.545310 -4.300690      10.65282 
1 1 1 -11 1  2  o 624.4677 10.39466 4759.496       158.1817 4792.645       194.7256 4695.183       271.2326 626.3705 12.75721 618.9314 18.00217 7.439087       22.06410 
1 1 1 -11 1  3  o 454.0319 6.655476 2513.496       73.63794 2555.632       105.3139 2473.187       103.0041 457.6622 9.442882 450.2231 9.388374 7.439087       13.31576 
1 1 1 -11 1  4  o 498.8131 7.263639 3034.152       88.29340 2989.970       123.6428 3080.125       126.1257 494.9674 10.25076 502.3701 10.30252 -7.402740      14.53341 
1 1 1 -11 1  5  o 179.4406 3.125394 392.3860       13.66663 400.8046       19.57502 384.3800       19.08921 181.3414 4.429647 177.5872 4.411033 3.754227       6.251319 
1 1 1 -11 1  6  o 302.8571 4.631867 1117.964       34.18456 1144.040       49.07156 1093.378       47.64839 306.3166 6.573903 299.4588 6.529426 6.857758       9.265506 
1 1 1 -11 1  7  o 520.0860 7.555834 3298.755       95.76210 3350.557       136.8332 3249.028       134.0653 523.9135 10.71756 515.9193 10.66347 7.994202       15.11872 
1 1 1 -11 1  8  o 598.2454 9.965761 4367.792       145.2867 4392.600       252.5247 4355.517       177.6303 598.7249 17.32596 597.1647 12.20638 1.560242       21.19398 
1 1 1 -11 1  9  o 406.2866 6.004057 2012.476       59.44474 2067.708       85.61333 1961.060       82.60260 411.6987 8.533473 400.9454 8.454198 10.75333       12.01223 
1 1 1 -11 1  10 o 637.6201 10.61084 4963.254       164.8724 4785.432       196.8900 5380.577       301.6240 625.8045 12.91067 662.2844 18.70771 -36.47992      22.73024 
1 1 1 -11 1  11 o 296.9668 6.455172 1075.333       46.71450 1009.913       63.63864 1151.773       68.79028 287.5441 9.093408 307.0862 9.202820 -19.54211      12.93762 
1 1 1 -11 1  12 o 115.0546 2.952947 161.4249       8.272494 149.5994       14.00838 167.7571       10.25081 110.6552 5.209557 117.2686 3.591306 -6.613380      6.327477 
1 1 1 -11 1  13 o 528.7751 7.685807 3410.826       99.03681 3228.752       135.0923 3622.376       145.6176 514.1757 10.78159 544.5942 10.97248 -30.41858      15.38304 
1 1 1 -11 1  14 o 576.1053 8.337710 4050.063       117.0536 4227.149       170.3915 3891.807       161.0784 588.1099 11.88922 564.3256 11.71309 23.78424       16.68982 
1 1 1 -11 1  15 o 200.3052 3.406128 489.0013       16.62605 468.7709       23.03620 510.9969       24.02025 196.0909 4.820778 204.7324 4.814539 -8.641495      6.813200 
1 1 1 -11 1  16 o 313.1906 4.792758 1195.887       36.57888 1209.782       52.18643 1182.466       51.28602 314.9071 6.800471 311.3340 6.759840 3.573151       9.588632 
1 1 1 -11 1  17 o 440.1933 9.199904 2367.135       98.68766 2343.774       138.8244 2391.002       140.3184 437.2510 13.04322 441.6363 13.05240 -4.385345      18.45239 
1 1 1 -11 1  18 o 132.5554 2.767446 214.1517       8.939488 207.6596       12.55227 220.8337       12.73439 130.4521 3.953088 134.5332 3.888377 -4.081161      5.544942 
1 1 1 -11 1  19 o 278.5214 4.367465 945.9780       29.64314 997.3981       43.28930 900.5786       40.67607 285.8704 6.214057 271.6463 6.144677 14.22409       8.739082 
1 1 1 -11 1  20 o 269.3483 4.260069 884.7836       27.96192 871.5741       39.26611 898.3740       39.82812 267.2059 6.030257 271.2834 6.024632 -4.077484      8.524095 
1 1 1 -11 1  21 o 237.8277 3.887313 689.8069       22.52932 703.3605       32.25661 676.8979       31.48011 240.0419 5.514365 235.4853 5.485754 4.556610       7.778285 
1 1 1 -11 1  22 o 217.5756 3.660339 577.3574       19.40741 570.9973       27.28940 583.8658       27.60578 216.2697 5.178002 218.6930 5.179990 -2.423279      7.324207 
1 1 1 -11 1  23 o 17.69385 5.528769 3.786008       2.645282 2.009723       3.777722 5.494856       3.705317 16.57929 6.471036 21.21886 6.529194 -4.639568      9.192643 
1 1 1 -11 1  24 o 116.6585 2.730743 165.9404       7.763065 156.6502       10.76270 176.0154       11.20811 113.2361 3.906167 120.0446 3.836292 -6.808434      5.474968 
1 1 1 -11 1  25 o 224.2001 5.233912 614.2795       28.59554 612.4944       40.28801 616.0919       40.59414 223.4215 7.409962 224.0701 7.444694 -0.6485443     10.50386 
1 1 1 -11 1  26 o 314.0185 4.878640 1204.891       37.33276 1186.868       52.36600 1223.520       53.23778 311.2195 6.904728 315.9860 6.913788 -4.766510      9.771169 
1 1 1 -11 1  27 o 168.5305 3.195576 346.5381       13.12392 358.9091       18.93973 335.1118       18.20229 171.3346 4.540205 165.5560 4.515967 5.778549       6.403703 
1 1 1 -11 1  28 o 184.4046 3.376660 415.0363       15.17383 430.6963       21.93283 400.6600       21.01467 187.6283 4.800838 180.9680 4.769396 6.660248       6.767214 
1 1 1 -11 1  29 o 330.2120 5.126390 1334.365       41.25158 1367.698       59.27139 1303.052       57.44840 333.5735 7.291509 325.6146 7.239990 7.958923       10.27539 
1 1 1 -11 1  30 o 91.34898 4.363571 102.2604       9.685551 108.4718       13.93166 96.44976       13.47464 93.83453 6.126118 88.43096 6.293972 5.403564       8.783132 
1 1 1 -11 1  31 o 78.59350 2.922731 75.49741       5.587974 75.13546       7.876619 75.86417       7.928817 78.28165 4.143750 78.66053 4.151026 -0.3788834     5.865294 
1 1 1 -11 1  32 o 173.2315 3.336148 366.5611       14.08343 372.5794       20.05275 360.7032       19.78391 174.3662 4.723629 171.5599 4.736703 2.806305       6.689471 
1 1 1 -11 1  33 o 120.7449 2.983992 178.0399       8.780165 181.7897       12.53654 174.4296       12.30088 121.7999 4.230135 119.3046 4.237730 2.495331       5.987687 
1 1 1 -11 1  34 o 74.19785 3.075867 67.37505       5.549478 67.56496       7.981091 67.19727       7.721631 74.12723 4.438560 73.94462 4.303754 0.1826096      6.182484 
1 1 1 -11 1  35 o 126.1762 3.048671 194.5703       9.373982 200.1960       13.42530 189.2185       13.09452 127.7213 4.319664 124.1631 4.334385 3.558151       6.119345 
1 1 1 -11 1  36 f 134.6187 4.175075 222.4868       13.67983 226.4134       19.30995 218.5307       19.38265 135.3073 5.870272 132.8825 6.001106 2.424805       8.394841 
1 1 1 -11 1  37 o 165.2417 3.342133 334.4019       13.45797 351.6359       19.44942 318.5706       18.64119 168.9507 4.728658 160.7921 4.762681 8.158585       6.711433 
1 1 1 -11 1  38 o 57.96861 3.405977 41.35282       4.790191 48.12913       6.875618 34.96152       6.677433 62.32224 4.558765 52.90727 5.248250 9.414967       6.951724 
1 1 1 -11 1  39 o 84.03358 3.066134 86.73846       6.268323 87.55878       8.899051 85.93067       8.830839 84.08866 4.357670 83.29874 4.365621 0.7899170      6.168300 
1 1 1 -11 1  40 o 100.9390 4.730296 126.9811       11.60309 115.1017       16.05019 139.9865       16.79354 94.84141 6.993779 104.9018 6.602862 -10.06035      9.618250 
1 1 1 -11 1  41 o 53.08103 3.693553 35.04901       4.747906 36.50793       6.732135 33.60522       6.697109 53.64703 5.215312 51.36543 5.432554 2.281605       7.530745 
1 1 1 -11 1  42 o 33.47431 4.963650 14.43814       3.926532 14.13745       5.504799 14.74958       5.602396 32.25362 7.187562 32.96312 7.178288 -0.7094994     10.15819 
1 1 1 -11 1  43 o 37.11455 5.106618 17.92424       4.496336 21.42178       5.893210 13.05203       6.955586 40.04512 6.242491 29.97023 8.887172 10.07489       10.86050 
1 1 1 -11 1  44 o 16.27073 6.366365 2.588805       3.663939 4.051594       5.127079 1.062107       5.237883 19.27849 7.534569 16.73474 7.176449 2.543751       10.40534 
1 1 1 -11 1  45 f 61.24330 4.012316 48.31797       5.955133 44.42588       9.400935 50.92650       7.696218 55.68450 7.088327 61.81561 5.155996 -6.131115      8.765197 
1 1 1 -11 1  46 o 34.51748 5.338089 16.48462       4.345395 21.64631       6.400885 12.07220       5.918104 37.93828 7.186528 27.19880 8.228667 10.73948       10.92507 
1 1 1 -11 1  47 o 18.39262 6.633977 4.892286       3.805073 5.786369       5.584023 4.117259       5.198960 19.83827 7.829957 18.14234 7.415933 1.695934       10.78445 
1 1 1 -11 1  48 o 16.37514 6.533390 3.500073       3.927905 6.290725       5.571033 0.7415228      5.538898 19.68135 7.804148 15.39291 6.949471 4.288441       10.44987 
1 1 1 -11 1  49 o 14.88043 6.783881 0.8045149      5.437285 10.93327       7.599286 -9.819805      7.782969 22.18773 9.004569 13.00063 6.449915 9.187099       11.07627 
1 1 1 -11 1  50 o 10.79296 5.152557 -2.686009      3.788566 -3.352703      5.472193 -2.072270      5.250372 12.52362 6.034364 12.85349 6.116457 -0.3298626     8.592124 
1 1 1 -11 2  1  o 84.67238 3.630558 87.53433       7.473792 95.54692       11.28253 81.26926       9.976613 88.37747 5.262594 81.49689 5.048278 6.880577       7.292462 
1 1 1 -11 2  2  o 435.6080 6.418985 2313.559       68.13940 2278.231       95.23338 2350.616       97.53517 432.1309 9.043527 438.9374 9.118482 -6.806549      12.84259 
1 1 1 -11 2  3  o 638.8029 10.62708 4980.908       165.4310 4912.537       200.7915 5125.399       291.8979 634.1260 12.99373 646.5726 18.54498 -12.44666      22.64405 
1 1 1 -11 2  4  o 385.0289 5.722422 1807.237       53.69196 1801.244       75.83421 1813.262       76.02997 384.2912 8.097829 385.5715 8.091776 -1.280243      11.44778 
1 1 1 -11 2  5  o 297.0280 4.561948 1075.332       33.02052 1062.025       46.42084 1088.963       46.98033 295.1361 6.454380 298.8558 6.450868 -3.719696      9.125389 
1 1 1 -11 2  6  o 631.4217 9.100095 4864.225       140.0237 5085.843       204.3614 4668.116       192.2407 645.2067 12.99762 618.1715 12.76146 27.03516       18.21519 
1 1 1 -11 2  7  o 375.9436 5.599401 1722.937       51.29799 1690.719       71.75111 1756.625       73.36856 372.3190 7.908195 379.5052 7.933342 -7.186218      11.20167 
1 1 1 -11 2  8  o 451.2457 6.617796 2482.805       72.77171 2666.589       107.9165 2329.541       98.54961 467.4737 9.473158 436.9469 9.255291 30.52676       13.24391 
1 1 1 -11 2  9  o 399.0601 5.908063 1941.496       57.45391 1985.233       82.53592 1900.379       80.02637 403.4099 8.395767 394.6985 8.320158 8.711395       11.82006 
1 1 1 -11 2  10 o 274.3374 4.937445 917.4009       33.00832 920.2430       40.59210 911.8534       56.71292 274.7327 6.063106 273.2602 8.527102 1.472504       10.46292 
1 1 1 -11 2  11 o 363.3101 6.281782 1609.416       55.61557 1675.233       69.89198 1495.800       91.82887 370.5965 7.739091 349.8456 10.78414 20.75092       13.27371 
1 1 1 -11 2  12 o 431.7370 7.341053 2273.461       77.23492 2347.460       136.5440 2238.645       93.65766 438.0662 12.80452 428.3106 8.973221 9.755585       15.63567 
1 1 1 -11 2  13 o 207.5664 3.479736 525.0812       17.60108 493.9183       24.17557 560.2308       25.67547 201.2880 4.928591 214.3752 4.914822 -13.08716      6.960351 
1 1 1 -11 2  14 o 97.15764 2.546362 115.1118       6.023635 113.8935       8.614033 116.2775       8.426476 96.59850 3.665970 97.61095 3.548417 -1.012444      5.102019 
1 1 1 -11 2  15 o 602.5253 8.706586 4431.478       127.8378 4500.809       182.8153 4365.136       178.8305 606.6585 12.36608 597.4597 12.28278 9.198792       17.42948 
1 1 1 -11 2  16 o 210.7639 3.533665 541.4346       18.14921 546.0184       25.93776 537.0375       25.40426 211.6173 5.029737 209.8715 4.967260 1.745758       7.069082 
1 1 1 -11 2  17 o 305.2941 6.680806 1137.239       49.70308 1056.336       67.51495 1232.964       73.43977 293.8793 9.439710 317.5150 9.502104 -23.63574      13.39396 
1 1 1 -11 2  18 o 245.1655 4.573259 732.9276       27.32254 745.8373       33.84018 708.7517       46.30901 247.2665 5.616052 240.7742 7.903295 6.492310       9.695469 
1 1 1 -11 2  19 o 227.1924 3.742626 629.3056       20.72079 622.2222       29.24569 636.4454       29.36191 225.8394 5.314055 228.4081 5.275173 -2.568695      7.487766 
1 1 1 -11 2  20 o 151.4847 2.942348 279.7301       10.86173 282.3620       15.51002 277.1971       15.21581 152.1030 4.188437 150.7069 4.147045 1.396088       5.894148 
1 1 1 -11 2  21 o 210.1436 3.569325 538.4910       18.27841 558.6196       26.43406 520.0493       25.30223 213.9499 5.070089 206.4343 5.029686 7.515671       7.141676 
1 1 1 -11 2  22 o 109.1801 2.676585 145.3183       7.121323 154.4809       10.33174 137.0255       9.829186 112.4772 3.774751 105.9221 3.814210 6.555168       5.366278 
1 1 1 -11 2  23 o 111.1520 2.705602 150.6304       7.328537 162.1808       10.66450 140.2954       10.08776 115.2372 3.802830 107.1665 3.869129 8.070717       5.425097 
1 1 1 -11 2  24 o 167.7719 3.162202 343.2967       12.92841 326.2642       17.83591 362.1531       18.76663 163.4153 4.483086 172.1757 4.476585 -8.760391      6.335446 
1 1 1 -11 2  25 o 115.3330 3.725336 162.4881       10.45647 176.8237       15.05216 149.1175       14.53667 120.1833 5.151421 110.3180 5.423951 9.865318       7.480400 
1 1 1 -11 2  26 o 214.9224 3.672585 563.7326       19.23489 553.7272       26.95917 574.1071       27.45200 212.8338 5.197923 216.7150 5.198149 -3.881241      7.351133 
1 1 1 -11 2  27 o 137.4681 2.930466 230.5199       9.816905 232.4883       13.97491 228.6023       13.79327 137.9108 4.163054 136.7544 4.143728 1.156433       5.873798 
1 1 1 -11 2  28 o 102.0716 2.773294 127.1848       6.891825 127.4304       9.851787 126.9495       9.644542 102.0695 3.968360 101.8840 3.891695 0.1855545      5.558163 
1 1 1 -11 2  29 o 241.6623 4.686926 714.1890       27.60153 698.1247       33.28257 749.5721       49.39513 238.7154 5.721374 246.5062 8.234366 -7.790741      10.02691 
1 1 1 -11 2  30 o 40.75840 4.710424 20.59164       4.592577 27.89417       9.124332 18.11386       5.314914 46.88065 8.289970 37.98919 5.935206 8.891453       10.19560 
1 1 1 -11 2  31 o 139.3522 3.028947 237.0560       10.28588 225.4765       14.26422 249.5994       14.84609 135.7066 4.318813 142.7958 4.271193 -7.089218      6.074145 
1 1 1 -11 2  32 o 99.59211 2.922780 121.1898       7.085772 123.3675       10.00707 119.0001       10.03457 100.3495 4.100829 98.54258 4.188229 1.806885       5.861575 
1 1 1 -11 2  33 o 119.8570 2.988026 175.4345       8.727382 162.1381       12.00861 190.3192       12.70562 115.0086 4.292292 124.6329 4.189333 -9.624359      5.997857 
1 1 1 -11 2  34 o 94.18517 2.979743 108.4701       6.830471 108.3339       9.655992 108.6065       9.663502 93.95795 4.228062 94.07663 4.225974 -0.1186829     5.977906 
1 1 1 -11 2  35 o 123.2410 3.045632 185.6256       9.146792 192.9494       13.03766 178.5269       12.83574 125.3931 4.272923 120.5891 4.375191 4.803909       6.115567 
1 1 1 -11 2  36 o 69.68174 4.192459 59.77391       7.086154 64.87603       9.880445 54.37003       10.16843 72.31259 5.651814 65.98516 6.404144 6.327431       8.541431 
1 1 1 -11 2  37 o 42.52758 4.320364 22.44992       4.415334 20.36008       6.106641 24.73931       6.391549 40.00881 6.485239 44.29004 6.082418 -4.281223      8.891239 
1 1 1 -11 2  38 o 31.12898 5.318036 12.31792       3.889384 8.444409       5.163604 17.39754       5.913104 25.69870 7.666320 36.74437 6.855827 -11.04567      10.28469 
1 1 1 -11 2  39 o 31.45335 5.358605 12.62747       3.960183 14.38904       5.527141 10.76911       5.676953 33.18428 7.052505 28.62313 7.886978 4.561153       10.58028 
1 1 1 -11 2  40 o 28.90952 8.454370 11.12834       6.331373 16.02205       9.652775 7.433273       8.387733 34.22299 10.53974 26.06092 9.771442 8.162069       14.37245 
1 1 1 -11 2  41 o 80.13048 3.134008 79.28067       6.107953 76.42027       8.594394 82.19979       8.682175 78.10847 4.534741 81.07581 4.411030 -2.967339      6.326221 
1 1 1 -11 2  42 o 77.09082 3.564314 73.99567       6.677866 72.46596       8.350816 76.70888       11.12154 75.78526 4.542616 77.03732 5.970747 -1.252052      7.502345 
1 1 1 -11 2  43 o 20.03613 6.485255 5.264550       3.613244 3.830712       5.022919 6.802191       5.201560 19.27216 7.478699 22.68538 7.791244 -3.413223      10.79974 
1 1 1 -11 2  44 o 16.00462 6.255881 2.499658       3.534902 -1.028651      4.797857 6.688991       5.228010 14.58607 6.536219 22.16879 7.799313 -7.582715      10.17602 
1 1 1 -11 2  45 o 13.25514 5.975563 -1.035780      4.077902 -0.6096074     6.523043 -1.309188      5.224718 16.73381 7.549452 14.75390 6.696344 1.979912       10.09135 
1 1 1 -11 2  46 o 17.69449 6.615108 4.109762       3.838353 5.953802       5.622726 2.500475       5.252653 20.47793 7.921918 17.15975 7.266630 3.318184       10.74992 
1 1 1 -11 2  47 o 29.32822 5.769829 12.47479       3.976718 16.72858       6.072457 9.280614       5.262056 31.94898 7.855494 23.62685 7.836682 8.322124       11.09605 
1 1 1 -11 2  48 o 10.56480 5.045574 -3.337257      3.640246 -5.832820      5.114484 -0.7750185     5.182357 11.65569 5.667599 14.12298 6.506718 -2.467293      8.628966 
1 1 1 -11 2  49 o 26.94246 7.410818 12.89874       5.017161 3.767214       8.580767 17.64222       6.184476 17.96317 8.310259 30.70408 8.136147 -12.74091      11.63002 
1 1 1 -11 2  50 o 17.59913 6.672342 5.326169       3.935404 3.918345       5.573885 6.725554       5.557155 16.50180 7.236230 18.69585 7.657557 -2.194048      10.53571 
1 1 1 -11 3  1  o 216.6814 3.610661 572.1917       19.06534 544.2245       26.14211 603.9672       27.86522 211.2979 5.077027 222.5925 5.137074 -11.29465      7.222585 
1 1 1 -11 3  2  o 168.7719 3.041175 347.1129       12.50771 341.7999       17.63963 352.4852       17.73791 167.4067 4.327579 170.0066 4.284963 -2.599884      6.090061 
1 1 1 -11 3  3  o 448.8502 9.353570 2458.179       102.3093 2438.603       144.3949 2477.915       144.9812 446.5480 13.28406 450.1425 13.23113 -3.594543      18.74911 
1 1 1 -11 3  4  o 531.6724 7.718853 3447.506       100.0076 3469.808       142.1882 3425.672       140.6879 533.1347 10.94436 529.7374 10.89833 3.397339       15.44515 
1 1 1 -11 3  5  o 518.8909 8.698051 3284.590       109.9852 3285.466       190.3149 3284.150       134.7693 518.1169 15.08939 518.6994 10.66201 -0.5824585     18.47615 
1 1 1 -11 3  6  o 406.3197 6.006951 2012.765       59.47823 2051.371       85.29199 1976.219       82.98525 410.0770 8.535064 402.4995 8.460568 7.577545       12.01784 
1 1 1 -11 3  7  o 478.3449 6.985588 2790.183       81.42921 2729.425       113.6573 2854.261       116.7203 472.9220 9.862158 483.6129 9.904045 -10.69092      13.97685 
1 1 1 -11 3  8  o 145.8500 2.792011 259.2239       9.923378 242.7908       13.85009 276.5586       14.22497 141.0839 4.032597 150.5887 3.879581 -9.504837      5.595801 
1 1 1 -11 3  9  o 478.6861 8.076339 2795.050       94.21096 2902.936       118.3876 2608.750       155.5713 487.6961 9.961411 461.7571 13.84109 25.93900       17.05302 
1 1 1 -11 3  10 o 941.1202 15.52894 10837.50       356.1418 11073.23       442.7880 10405.58       599.3625 950.2682 19.12113 917.9736 26.82188 32.29462       32.93981 
1 1 1 -11 3  11 o 306.2155 4.690352 1142.971       35.00005 1164.738       50.18011 1122.348       48.84209 309.0544 6.662858 303.3804 6.606489 5.674042       9.382930 
1 1 1 -11 3  12 o 602.5547 10.04706 4432.469       147.5271 4241.540       248.2761 4536.675       183.4200 588.0506 17.34439 609.2930 12.35334 -21.24237      21.29396 
1 1 1 -11 3  13 o 60.41323 2.689578 44.56508       3.949683 38.67413       5.533070 50.68560       5.639850 56.18212 4.068974 64.38730 3.608883 -8.205177      5.438803 
1 1 1 -11 3  14 o 513.9595 7.486670 3222.632       93.76778 3211.155       132.3729 3234.191       132.8437 512.7201 10.59455 514.5559 10.59430 -1.835815      14.98278 
1 1 1 -11 3  15 o 709.5925 10.20338 6150.989       176.4368 5985.577       244.9524 6329.337       254.3515 699.0989 14.37828 718.8576 14.51962 -19.75867      20.43415 
1 1 1 -11 3  16 o 219.6727 4.215198 588.2674       22.56473 558.5814       38.58287 603.6993       27.81819 213.8186 7.416021 222.5086 5.130337 -8.690018      9.017634 
1 1 1 -11 3  17 o 83.11558 3.728820 84.38000       7.533257 95.18279       11.54359 76.36665       9.942144 88.17807 5.397969 78.96284 5.195663 9.215233       7.492195 
1 1 1 -11 3  18 o 363.5892 6.323524 1613.221       56.02814 1632.779       69.25159 1576.162       95.32861 365.6435 7.772053 358.6808 10.91906 6.962708       13.40263 
1 1 1 -11 3  19 o 199.8614 3.434406 486.9640       16.72694 470.5981       23.40808 504.0405       23.91088 196.4201 4.890393 203.2823 4.826805 -6.862228      6.871244 
1 1 1 -11 3  20 o 169.0828 3.121940 348.5233       12.86353 356.4151       18.56051 341.2289       17.84418 170.8819 4.460969 167.2044 4.383161 3.677490       6.253986 
1 1 1 -11 3  21 o 521.3442 7.626616 3323.924       96.89304 3379.602       138.8007 3271.003       135.3205 524.7064 10.85524 516.2418 10.75658 8.464600       15.28202 
1 1 1 -11 3  22 o 339.7617 5.182408 1409.385       42.90839 1401.414       60.58984 1417.404       60.77382 338.4561 7.346176 340.3852 7.326723 -1.929108      10.37532 
1 1 1 -11 3  23 o 173.3197 3.190372 366.3432       13.47489 361.8127       19.09157 370.8405       19.02137 172.1052 4.556105 174.2475 4.483323 -2.142273      6.392048 
1 1 1 -11 3  24 o 122.4661 3.790911 183.1778       11.29984 179.0852       15.62375 187.6666       16.36262 120.9491 5.313832 123.8050 5.436744 -2.855934      7.602302 
1 1 1 -11 3  25 o 48.69336 3.524000 29.08026       4.153300 33.30204       6.579792 26.28399       5.354928 51.93569 5.271850 46.13533 4.834760 5.800365       7.153132 
1 1 1 -11 3  26 o 92.26089 2.715793 103.8977       6.099265 108.4742       8.853681 99.76411       8.414401 94.18952 3.865530 90.32514 3.831475 3.864380       5.442658 
1 1 1 -11 3  27 o 35.06215 3.955505 15.20037       3.320765 16.71219       4.726735 13.72690       4.666390 36.56287 5.473067 32.97509 6.029203 3.587784       8.142835 
1 1 1 -11 3  28 o 69.78484 2.880902 59.51290       4.888670 58.75492       6.864947 60.29277       6.963352 69.23419 4.087116 70.13701 4.091903 -0.9028168     5.783440 
1 1 1 -11 3  29 o 60.20110 4.869128 44.62164       7.082273 46.79387       10.64885 42.89872       9.483778 61.28025 7.272573 58.73335 6.748621 2.546906       9.921402 
1 1 1 -11 3  30 o 113.4647 2.886854 157.2112       7.975702 150.5778       11.21604 163.9964       11.34373 110.9112 4.157166 115.7702 4.027029 -4.859009      5.787831 
1 1 1 -11 3  31 o 193.3528 3.509073 456.6828       16.53404 447.2706       23.18956 466.4153       23.58067 191.0383 4.985485 195.0915 4.964033 -4.053238      7.035388 
1 1 1 -11 3  32 o 43.05286 3.825302 22.83671       3.971582 20.28231       5.488748 25.64394       5.753964 40.24987 5.759946 45.42975 5.296702 -5.179878      7.825089 
1 1 1 -11 3  33 o 100.9919 2.935953 124.6525       7.217896 131.9374       10.29942 117.6216       10.11828 103.7590 4.081303 97.93468 4.249806 5.824364       5.892188 
1 1 1 -11 3  34 o 60.00769 3.342022 44.15311       4.867805 46.92747       6.791480 41.22204       6.980651 61.70974 4.548173 57.74200 5.010535 3.967735       6.766930 
1 1 1 -11 3  35 o 103.2570 3.016372 130.4129       7.581842 132.1290       10.77128 128.7275       10.67407 103.7353 4.270060 102.3859 4.287619 1.349464       6.051206 
1 1 1 -11 3  36 o 135.3733 3.581944 224.5711       11.80609 215.7613       14.47937 242.0462       20.39274 132.4729 4.491748 139.8360 5.998349 -7.363113      7.493730 
1 1 1 -11 3  37 f 118.6072 3.041804 172.2671       8.784556 169.9499       12.31429 174.6682       12.53513 117.5116 4.307524 119.1290 4.325108 -1.617332      6.104205 
1 1 1 -11 3  38 o 68.69894 3.260048 57.99048       5.442135 51.31005       7.394008 65.88738       8.039077 64.30090 4.752333 72.95965 4.544108 -8.658752      6.575225 
1 1 1 -11 3  39 o 14.48705 5.947309 0.9578205      3.361832 2.484628       4.578239 -0.8288016     4.952479 17.99650 7.093903 15.62482 6.837104 2.371676       9.852384 
1 1 1 -11 3  40 o 50.89561 4.631512 32.45810       5.681473 35.41551       10.69989 31.29687       6.704739 51.44286 8.854653 49.64101 5.642501 1.801842       10.49965 
1 1 1 -11 3  41 o 32.75461 5.584735 13.90729       4.297959 18.58197       5.422304 6.005970       7.049486 37.78303 6.096601 23.56427 8.931068 14.21876       10.81353 
1 1 1 -11 3  42 o 34.79651 4.655927 15.50112       3.849020 17.76120       5.429354 13.21760       5.457428 36.60787 6.314106 31.07615 7.326717 5.531717       9.672059 
1 1 1 -11 3  43 o 27.34515 5.960266 10.09257       3.859365 10.08832       5.337553 10.09722       5.586915 26.75160 7.745107 26.71939 7.975227 0.3220940E-01  11.11715 
1 1 1 -11 3  44 o 20.22060 6.531341 5.553932       3.665958 5.699474       5.113332 5.400003       5.258615 20.97247 7.671903 20.72387 7.743806 0.2486000      10.90067 
1 1 1 -11 3  45 o 18.52919 6.880551 4.386258       4.138960 4.132766       6.440090 4.564643       5.402432 19.82697 8.194792 19.51377 7.701682 0.3132000      11.24591 
1 1 1 -11 3  46 o 26.77095 6.258217 10.49436       4.009160 9.495207       5.655117 11.50397       5.684615 24.23763 8.126067 26.62139 8.066980 -2.383764      11.45029 
1 1 1 -11 3  47 o 11.79824 5.416800 -1.351035      3.548403 -0.1446793     5.142578 -2.447352      4.902429 14.79222 6.685557 13.14255 6.147454 1.649664       9.082282 
1 1 1 -11 3  48 o 13.77579 6.309632 -0.5648925     4.775805 0.1267283      5.901821 -1.876918      8.128738 15.30686 7.012105 16.13063 7.657137 -0.8237705     10.38274 
1 1 1 -11 3  49 o 16.33668 6.804961 3.680963       4.489668 -5.938479      7.971154 8.150547       5.433502 14.12932 6.914883 20.69268 7.841298 -6.563359      10.45474 
1 1 1 -11 3  50 o 16.78790 6.652624 4.646234       4.045886 0.4788362      6.000383 8.120416       5.478640 14.66917 6.841607 19.97662 7.794043 -5.307446      10.37086 
1 1 1 -11 4  1  o 492.5743 6.440443 2958.340       77.30785 2855.253       119.2921 3032.983       101.5080 483.6718 10.12104 498.6328 8.353786 -14.96100      13.12330 
1 1 1 -11 4  2  o 280.3584 3.918271 957.9489       26.76974 1018.089       43.86974 922.2701       33.78993 288.9695 6.229842 275.0653 5.040986 13.90417       8.013892 
1 1 1 -11 4  3  o 227.1502 4.299924 628.8727       23.80181 607.0362       28.58883 678.1996       42.96821 223.1551 5.257187 235.6999 7.490373 -12.54486      9.151158 
1 1 1 -11 4  4  o 479.4377 14.07406 2812.106       164.2544 0.000000       0.000000 2812.106       164.2544 ?        ?        479.4377 14.07406 0.000000       14.07406 
1 1 1 -11 4  5  o 330.2171 5.001975 1329.173       40.25105 1329.589       57.10386 1328.763       56.74498 330.2007 7.096617 330.0998 7.054173 0.1008911      10.00616 
1 1 1 -11 4  6  o 261.7719 4.121813 835.1664       26.29344 826.2073       37.10351 844.2042       37.26611 260.3274 5.848696 263.1483 5.811354 -2.820953      8.244943 
1 1 1 -11 4  7  o 427.7558 6.302849 2230.922       65.70053 2242.247       93.39962 2219.829       92.43703 428.6971 8.940432 426.5517 8.892793 2.145386       12.61004 
1 1 1 -11 4  8  o 54.36491 2.979731 36.12525       3.932494 35.32133       5.146894 37.25280       6.095428 53.68828 3.961866 55.09404 4.581501 -1.405754      6.056942 
1 1 1 -11 4  9  o 580.0181 9.689647 4105.802       136.9574 4000.206       164.8914 4340.708       245.9361 572.2827 11.82364 595.1382 16.97510 -22.85547      20.68701 
1 1 1 -11 4  10 o 441.5841 6.491230 2377.725       69.85163 2488.139       101.9873 2280.165       95.86683 451.5434 9.268517 432.2722 9.100704 19.27124       12.98954 
1 1 1 -11 4  11 o 69.86289 2.529817 59.55530       4.299858 63.18619       6.545580 56.79905       5.702964 71.90546 3.748455 68.18146 3.443552 3.724007       5.090085 
1 1 1 -11 4  12 o 352.1102 6.111720 1511.773       52.44187 1450.311       88.71468 1544.785       65.01785 344.4612 10.58119 355.8671 7.497364 -11.40588      12.96811 
1 1 1 -11 4  13 o 408.1978 6.984000 2032.361       69.47218 2048.979       121.4470 2024.278       84.69863 409.2467 12.19130 407.2805 8.533883 1.966187       14.88136 
1 1 1 -11 4  14 o 458.4333 7.776714 2564.306       86.87772 2596.591       107.4235 2503.265       147.7095 461.1444 9.559305 452.1188 13.42149 9.025635       16.47777 
1 1 1 -11 4  15 o 309.3887 4.755194 1166.994       35.85162 1127.086       49.84583 1209.767       51.60353 303.9634 6.729323 314.9156 6.724331 -10.95218      9.513171 
1 1 1 -11 4  16 o 279.6368 5.062705 953.5019       34.49952 894.5987       58.26983 985.2945       42.80920 270.5089 8.851386 284.2081 6.181083 -13.69922      10.79596 
1 1 1 -11 4  17 o 276.9572 4.360034 935.2195       29.42650 892.4075       40.60973 982.5513       42.69960 270.4562 6.161651 283.7866 6.174416 -13.33032      8.722921 
1 1 1 -11 4  18 o 119.8910 3.134638 175.3264       9.150340 180.5113       11.49255 166.3474       15.12361 121.6176 3.882761 116.6553 5.334155 4.962341       6.597654 
1 1 1 -11 4  19 o 467.4922 6.875316 2668.883       78.32549 2697.236       111.7501 2641.504       109.8132 469.4330 9.768736 464.5726 9.699846 4.860413       13.76645 
1 1 1 -11 4  20 o 114.7460 2.690783 160.4934       7.524065 156.0379       10.75321 164.7671       10.53153 113.0493 3.909200 116.1827 3.724564 -3.133369      5.399465 
1 1 1 -11 4  21 f 415.5292 6.186155 2109.128       62.64097 2169.867       90.39060 2053.003       86.88857 420.9256 8.812150 409.4582 8.707972 11.46738       12.38882 
1 1 1 -11 4  22 o 208.5550 3.565989 530.4902       18.12328 518.8389       25.48043 542.4195       25.78261 206.1477 5.072152 210.7846 5.019402 -4.636887      7.135903 
1 1 1 -11 4  23 o 189.2456 3.364016 436.8177       15.51386 435.4079       22.06687 438.1955       21.81513 188.7797 4.800669 189.4500 4.725276 -0.6702271     6.736071 
1 1 1 -11 4  24 o 93.36590 3.082511 106.4325       7.003792 104.4678       8.699088 110.0526       11.80849 92.44410 3.870082 94.77325 5.132109 -2.329147      6.427758 
1 1 1 -11 4  25 f 177.0289 3.703204 382.4398       15.97563 393.3597       27.70405 376.9995       19.55428 179.1597 6.355584 175.6354 4.572600 3.524246       7.829567 
1 1 1 -11 4  26 o 157.5939 3.095596 302.9701       11.88831 319.0247       17.37434 288.8360       16.30205 161.5566 4.417284 153.7236 4.356158 7.832962       6.203911 
1 1 1 -11 4  27 o 113.8718 2.800726 158.1652       7.771824 157.1072       11.08781 159.1870       10.89672 113.3542 4.020316 114.1123 3.924407 -0.7581024     5.618176 
1 1 1 -11 4  28 o 148.8100 3.050124 270.2046       11.06078 273.6792       15.85098 266.9070       15.44165 149.5899 4.352911 147.7335 4.293779 1.856461       6.114276 
1 1 1 -11 4  29 o 56.56036 5.061149 39.45891       6.902206 53.43128       11.00748 30.40543       8.860550 65.58383 6.995253 49.14411 7.647325 16.43972       10.36413 
1 1 1 -11 4  30 o 168.9313 3.260239 348.4185       13.42133 342.0312       18.97407 354.8148       18.98720 167.1357 4.663154 170.2473 4.580780 -3.111542      6.536708 
1 1 1 -11 4  31 o 89.00555 2.856329 96.78951       6.187265 92.54134       8.742071 101.0533       8.758180 86.89567 4.140294 90.83372 3.966238 -3.938049      5.733505 
1 1 1 -11 4  32 o 156.8174 3.197597 300.3452       12.21952 300.6087       17.30201 300.0829       17.26009 156.6343 4.537657 156.4985 4.530582 0.1357880      6.412215 
1 1 1 -11 4  33 o 135.3332 3.065379 223.7038       10.10938 223.6333       14.30499 223.7741       14.28868 135.0761 4.351510 135.1199 4.345121 -0.4374695E-01 6.149448 
1 1 1 -11 4  34 o 163.5679 3.288562 327.0365       13.10812 321.5628       18.44886 332.6169       18.62778 161.8609 4.682181 164.6305 4.647825 -2.769562      6.597355 
1 1 1 -11 4  35 o 92.25775 3.369099 104.2411       7.561758 100.0899       11.84623 107.0956       9.823451 90.03106 5.424639 93.36000 4.329636 -3.328941      6.940638 
1 1 1 -11 4  36 o 151.8664 3.692358 282.5556       13.66475 281.3666       16.90997 284.7933       23.19751 151.2533 4.593096 151.5569 6.294711 -0.3036804     7.792299 
1 1 1 -11 4  37 o 63.28968 3.299568 49.19350       5.071352 44.13508       6.900149 55.13571       7.478683 59.67078 4.785352 66.76964 4.624897 -7.098854      6.655018 
1 1 1 -11 4  38 o 70.49290 3.167084 61.03328       5.426635 54.18425       7.422515 68.89797       7.953846 66.10358 4.637178 74.64048 4.392285 -8.536896      6.387143 
1 1 1 -11 4  39 o 66.49359 3.839194 54.65885       6.194489 55.58262       7.246224 52.15133       11.93859 66.88504 4.471451 63.50622 7.883573 3.378822       9.063365 
1 1 1 -11 4  40 o 13.33704 6.179308 -3.697108      4.770804 4.802610       8.546277 -7.544861      5.750139 24.05762 9.624166 13.13826 6.292624 10.91936       11.49877 
1 1 1 -11 4  41 o 48.98604 3.745556 29.92171       4.437298 26.71079       6.007508 33.77657       6.582394 45.65906 5.510538 51.48985 5.322618 -5.830788      7.661350 
1 1 1 -11 4  42 o 24.01095 6.065116 7.721403       3.549321 7.038456       4.934491 8.453524       5.109055 23.11824 7.585365 24.95900 7.664451 -1.840759      10.78339 
1 1 1 -11 4  43 o 41.22326 4.221328 21.67711       4.180780 19.25735       5.734620 24.42229       6.108067 37.73129 6.469628 42.85162 6.014605 -5.120331      8.833548 
1 1 1 -11 4  44 o 32.18094 5.386543 13.88538       4.075040 7.237699       5.494197 22.01418       6.075503 22.80284 7.997533 39.96759 6.458014 -17.16475      10.27942 
1 1 1 -11 4  45 o 15.88406 6.303230 2.533326       3.636838 -5.857225      5.105809 11.17469       5.181559 12.19053 5.862383 27.16169 7.554511 -14.97116      9.562331 
1 1 1 -11 4  46 o 20.77764 6.684959 6.421225       3.842911 5.544239       5.462152 7.280798       5.407652 19.95301 7.783031 21.73714 7.899045 -1.784132      11.08921 
1 1 1 -11 4  47 o 13.77010 6.044297 0.5512910      3.897529 -8.474133      5.797184 7.995811       5.265039 11.82375 5.809065 22.01833 7.819486 -10.19458      9.741129 
1 1 1 -11 4  48 o 14.02444 6.285773 0.4216624      4.439584 0.1988177      5.428325 0.8718351      7.715325 14.88373 6.782648 16.94674 7.853980 -2.063006      10.37735 
1 1 1 -11 4  49 o 15.04402 6.540181 2.246174       4.468794 -4.646224      7.848752 5.552270       5.435922 14.37834 6.998172 18.18465 7.523634 -3.806316      10.27519 
1 1 1 -11 4  50 o 11.71155 5.473839 -1.220592      3.874440 1.293723       5.595137 -3.536935      5.370346 14.80078 6.797752 12.30210 5.940121 2.498678       9.027430 
1 1 1 -11 5  1  o 136.4606 3.256288 226.9338       10.82845 235.1368       13.36340 211.2494       18.47837 138.8429 3.953665 131.5082 5.780121 7.334686       7.002947 
1 1 1 -11 5  2  o 139.6817 2.507994 237.7557       8.536938 241.3674       13.61168 235.4139       10.96058 140.6713 3.974714 138.9872 3.236105 1.684082       5.125497 
1 1 1 -11 5  3  o 271.5316 4.251611 898.6234       28.13261 895.9858       55.55776 899.5328       32.62439 270.8828 8.426667 271.6549 4.928205 -0.7721252     9.761964 
1 1 1 -11 5  4  o 1027.040 16.94325 12913.68       424.0529 13006.29       522.1258 12734.21       726.8324 1029.471 20.81253 1014.619 29.42757 14.85254       36.04363 
1 1 1 -11 5  5  o 372.2845 6.436912 1689.882       58.39674 1684.754       101.8443 1692.393       71.27805 371.2844 11.26929 372.4982 7.852277 -1.213745      13.73518 
1 1 1 -11 5  6  o 684.0925 9.835463 5711.407       163.9629 5464.924       225.1480 5989.736       239.2513 668.6387 13.81785 699.9744 14.02607 -31.33569      19.68918 
1 1 1 -11 5  7  o 267.2267 4.852006 870.4434       31.59638 852.0461       38.43190 908.8128       55.50172 264.3604 5.965672 272.8174 8.358164 -8.457001      10.26880 
1 1 1 -11 5  8  o 427.5299 7.287404 2229.161       75.92337 2164.339       91.39393 2373.513       136.3859 421.1719 8.904753 440.5568 12.71704 -19.38489      15.52475 
1 1 1 -11 5  9  o 830.5422 11.88869 8426.114       240.6201 8166.854       333.0693 8709.137       347.9977 816.6537 16.73635 843.2809 16.93433 -26.62720      23.80918 
1 1 1 -11 5  10 o 333.3130 7.140186 1354.948       57.99598 1289.984       79.89094 1427.326       84.32607 324.9139 10.10232 341.7858 10.13566 -16.87183      14.31043 
1 1 1 -11 5  11 o 469.7530 6.880558 2691.207       78.76429 2695.779       111.7186 2686.688       111.0634 469.9325 9.755596 469.1431 9.714702 0.7893982      13.76761 
1 1 1 -11 5  12 o 772.8857 12.80124 7303.208       241.1034 7018.417       406.7360 7457.491       299.3708 754.8062 22.13658 780.3282 15.74331 -25.52197      27.16394 
1 1 1 -11 5  13 o 501.3586 7.316839 3066.359       89.39393 3011.779       125.1897 3123.141       127.6916 496.5798 10.34531 505.6752 10.36226 -9.095337      14.64247 
1 1 1 -11 5  14 o 92.10918 2.555549 103.4702       5.730643 105.8597       8.561669 101.5307       7.713271 93.11706 3.780918 91.20457 3.476818 1.912491       5.136497 
1 1 1 -11 5  15 o 422.3209 8.858100 2177.822       91.16312 2106.459       126.7326 2254.343       131.2334 414.7089 12.55478 429.0301 12.56576 -14.32120      17.76291 
1 1 1 -11 5  16 o 147.4346 3.360202 264.9464       12.07260 234.0182       20.84254 280.5622       14.81001 138.3655 6.197125 151.6529 4.010974 -13.28740      7.381888 
1 1 1 -11 5  17 o 215.8842 4.188625 568.2317       22.03578 570.0721       27.25048 564.7546       37.45633 216.1973 5.172348 214.9723 7.160000 1.225037       8.832824 
1 1 1 -11 5  18 o 252.6762 4.695768 778.6554       28.91393 784.9235       35.78516 766.8679       49.07313 253.6288 5.789863 250.3986 8.052688 3.230255       9.918078 
1 1 1 -11 5  19 f 404.4971 6.026482 1997.226       59.40396 2003.557       84.40057 1991.010       83.62458 404.7642 8.556718 403.5037 8.504530 1.260468       12.06418 
1 1 1 -11 5  20 o 135.4175 2.841169 223.5434       9.375791 216.9990       13.36446 229.8860       13.15672 133.3223 4.118451 137.2388 3.938074 -3.916550      5.698251 
1 1 1 -11 5  21 o 117.9452 2.729134 169.5864       7.844069 175.6335       11.49044 164.3089       10.73448 119.9318 3.936906 116.0052 3.802373 3.926605       5.473323 
1 1 1 -11 5  22 o 327.5993 5.033611 1310.344       40.18451 1299.910       56.82314 1320.784       56.83582 325.9507 7.153806 328.5679 7.098406 -2.617188      10.07791 
1 1 1 -11 5  23 o 157.4270 3.052740 302.2332       11.71130 314.1122       17.06824 291.6652       16.09880 160.3585 4.371858 154.5265 4.279301 5.832031       6.117643 
1 1 1 -11 5  24 o 106.3025 3.716542 138.0535       9.612804 137.3853       13.28260 138.7885       13.92959 105.9140 5.161827 106.4305 5.388297 -0.5164871     7.461783 
1 1 1 -11 5  25 o 93.50763 2.727608 106.7184       6.208702 102.0313       8.922046 111.1192       8.645351 91.33652 4.018353 95.34888 3.727938 -4.012360      5.481303 
1 1 1 -11 5  26 o 110.8539 2.783609 149.9704       7.513659 155.3526       10.96784 145.2107       10.31410 112.7319 3.998772 108.9952 3.889418 3.736755       5.578329 
1 1 1 -11 5  27 o 258.6260 4.205696 817.0389       26.50612 812.5789       37.56242 821.4625       37.40869 257.5880 5.984002 259.0047 5.926915 -1.416687      8.422387 
1 1 1 -11 5  28 o 205.5099 3.604229 515.6526       18.05017 526.3049       25.97145 505.6999       25.10422 207.4037 5.138585 203.3149 5.066890 4.088852       7.216538 
1 1 1 -11 5  29 o 247.3063 5.889250 749.7232       35.49207 738.2894       50.68484 760.7240       49.71591 244.4669 8.520917 248.2717 8.228723 -3.804794      11.84559 
1 1 1 -11 5  30 o 120.7346 2.902260 177.8997       8.538946 170.7594       12.01295 185.1917       12.13984 118.1108 4.180317 123.0231 4.054938 -4.912285      5.823879 
1 1 1 -11 5  31 o 170.4096 3.299200 354.6536       13.70058 360.8974       19.58861 348.6742       19.16928 171.6371 4.687737 168.7073 4.667165 2.929779       6.614931 
1 1 1 -11 5  32 o 148.0490 3.134761 267.6832       11.30956 263.2911       15.97658 272.0947       16.01175 146.5860 4.477803 149.0305 4.413736 -2.444550      6.287431 
1 1 1 -11 5  33 o 58.49084 3.358912 41.94659       4.767520 44.24840       6.643530 39.50262       6.845593 59.92310 4.584358 56.53200 5.021318 3.391102       6.799263 
1 1 1 -11 5  34 o 171.2838 3.352929 358.6960       13.99513 347.9615       19.57913 369.9106       20.01217 168.3389 4.777627 173.5828 4.735408 -5.243866      6.726798 
1 1 1 -11 5  35 o 115.0954 3.377258 162.1785       9.462120 157.5930       15.39440 164.9628       11.99555 112.9826 5.608867 115.9192 4.253691 -2.936607      7.039409 
1 1 1 -11 5  36 o 156.0893 3.733677 298.5720       14.20188 287.4035       17.29784 321.6707       24.87636 152.8322 4.649928 161.0240 6.352036 -8.191757      7.872115 
1 1 1 -11 5  37 o 125.4382 3.071621 192.6218       9.389311 183.0579       12.99292 203.0753       13.58377 121.9134 4.380518 128.4245 4.346729 -6.511047      6.171142 
1 1 1 -11 5  38 o 15.11711 6.050032 1.455110       3.378690 6.286824       4.580564 -4.310785      5.003821 22.59409 7.300997 13.50631 6.281907 9.087783       9.631557 
1 1 1 -11 5  39 o 24.25826 7.645798 7.476494       5.048092 7.476494       5.048092 0.000000       0.000000 24.25826 7.645798 ?        ?        0.000000       7.645798 
1 1 1 -11 5  40 o 24.10465 7.305606 7.561054       4.661927 12.79088       9.403434 5.856735       5.368071 31.09619 10.47899 22.34214 7.899360 8.754044       13.12285 
1 1 1 -11 5  41 o 11.44567 5.219261 -1.865447      3.220920 -1.963652      4.251054 -1.733084      4.935282 13.40964 6.067857 14.74993 6.617885 -1.340291      8.978601 
1 1 1 -11 5  42 o 18.49297 6.319527 4.212517       3.421014 6.784626       4.798265 1.553310       4.878829 22.71422 7.481317 17.07884 7.102271 5.635378       10.31564 
1 1 1 -11 5  43 o 35.94485 4.755445 16.75739       4.063378 18.54844       5.801561 15.03277       5.692947 36.82417 6.712344 32.74039 7.319466 4.083778       9.931271 
1 1 1 -11 5  44 o 30.81192 5.946106 13.02756       4.302917 9.774446       6.573581 15.46639       5.691726 25.60877 8.759851 32.76743 7.313523 -7.158657      11.41151 
1 1 1 -11 5  45 o 44.16553 4.393468 25.61084       4.665898 17.36858       6.265786 35.87068       6.990729 33.78431 7.772523 51.13731 5.706981 -17.35300      9.642705 
1 1 1 -11 5  46 o 23.94041 7.022603 8.822145       4.362732 10.35855       6.344900 7.444330       6.008505 24.80754 8.601260 21.87479 8.255539 2.932749       11.92206 
1 1 1 -11 5  47 o 27.16282 6.303195 11.16144       4.091540 9.910729       5.846950 12.36158       5.727520 23.85645 8.257608 26.82041 8.090970 -2.963959      11.56079 
1 1 1 -11 5  48 o 14.40386 6.374645 1.019846       4.419622 -0.6379272     5.335720 4.643205       7.888349 14.26298 6.582359 18.82318 8.411868 -4.560194      10.68115 
1 1 1 -11 5  49 o 10.81466 5.248549 -4.539618      4.330222 -15.09585      8.120294 -0.3449823     5.118756 12.06881 6.074579 13.81488 6.400693 -1.746071      8.824363 
1 1 1 -11 5  50 o 12.06563 5.578956 -0.5919705     3.859767 -0.1940025     5.546418 -0.9656777     5.374700 13.93220 6.523917 13.40948 6.323715 0.5227203      9.085751 
1 1 1 -11 6  1  o 594.9396 7.702284 4317.245       111.6679 4310.943       176.4514 4321.456       144.2233 594.0377 12.18919 595.0218 9.946411 -0.9840698     15.73237 
1 1 1 -11 6  2  o 36.01388 2.966722 15.91285       2.580582 16.24600       4.243478 15.71735       3.250766 36.17273 4.943166 35.71066 3.793498 0.4620781      6.231013 
1 1 1 -11 6  3  o 585.1494 7.577856 4176.096       108.0561 3990.523       165.7131 4313.367       142.5239 571.5856 11.89705 594.4868 9.838058 -22.90118      15.43785 
1 1 1 -11 6  4  o 249.9087 5.665718 761.3932       34.50423 780.8323       48.90960 742.1332       48.68388 252.8867 7.946416 246.5229 8.114917 6.363861       11.35770 
1 1 1 -11 6  5  o 351.1664 7.528189 1504.034       64.42279 1504.034       64.42279 0.000000       0.000000 351.1664 7.528189 ?        ?        0.000000       7.528189 
1 1 1 -11 6  6  o 539.9792 11.10979 3560.365       146.1905 3471.862       204.1025 3653.604       209.4919 532.4188 15.74840 546.1867 15.75593 -13.76794      22.27693 
1 1 1 -11 6  7  o 597.9650 8.642333 4362.458       125.9340 4382.187       178.8724 4343.067       177.3326 598.9162 12.25579 596.2436 12.20475 2.672607       17.29625 
1 1 1 -11 6  8  o 434.2887 6.401913 2299.772       67.75234 2345.372       97.35880 2256.952       94.34483 438.4065 9.113015 430.0710 9.002059 8.335510       12.80953 
1 1 1 -11 6  9  o 291.9963 4.526268 1039.267       32.20726 1043.110       45.96516 1035.561       45.14189 292.4780 6.449106 291.4209 6.356571 1.057068       9.055218 
1 1 1 -11 6  10 o 45.09712 2.954848 24.89069       3.229395 22.10325       5.153005 26.69355       4.144184 42.27452 5.105293 46.65534 3.674677 -4.380817      6.290252 
1 1 1 -11 6  11 o 273.4313 4.295304 911.3125       28.62057 923.0606       41.15764 900.3121       39.82637 275.1337 6.138617 271.7265 6.014544 3.407227       8.594029 
1 1 1 -11 6  12 o 200.6213 3.933836 490.5774       19.23222 483.5424       33.63175 493.9958       23.44363 198.9854 6.946383 201.3028 4.779021 -2.317413      8.431564 
1 1 1 -11 6  13 o 178.9079 3.202920 390.0951       13.96406 374.7028       19.72630 405.5558       19.77008 175.2588 4.622844 182.3982 4.447868 -7.139420      6.415155 
1 1 1 -11 6  14 o 499.8225 8.441720 3049.618       102.8212 3031.162       177.7955 3058.892       126.0349 497.1585 14.69151 500.3499 10.33667 -3.191345      17.96350 
1 1 1 -11 6  15 o 90.09153 2.974839 99.02838       6.522102 107.4925       12.89979 96.12167       7.559496 93.71054 5.675431 88.73434 3.502831 4.976204       6.669358 
1 1 1 -11 6  16 o 344.6656 6.042098 1449.230       50.74834 1458.695       62.66659 1431.197       86.50008 345.6795 7.439201 341.9462 10.39267 3.733276       12.78082 
1 1 1 -11 6  17 o 171.2339 3.640985 357.4475       15.19304 355.6038       18.83863 360.8779       25.69618 170.7072 4.532582 171.8614 6.145453 -1.154160      7.636157 
1 1 1 -11 6  18 o 193.3287 3.382882 455.6459       15.93747 459.4301       22.90991 452.0973       22.18550 194.0762 4.844123 192.5260 4.728721 1.550156       6.769515 
1 1 1 -11 6  19 o 377.2087 6.558066 1737.681       60.28282 1692.375       72.79101 1836.596       107.5543 372.0452 8.028712 386.7266 11.42521 -14.68134      13.96408 
1 1 1 -11 6  20 o 59.30103 2.825890 42.96663       4.071947 44.88991       6.045716 41.36975       5.508857 60.52548 4.123585 58.11002 3.913036 2.415462       5.684699 
1 1 1 -11 6  21 o 205.2431 3.539790 513.7413       17.70444 521.6514       25.55128 506.4366       24.55420 206.7167 5.072254 203.6892 4.946770 3.027481       7.085075 
1 1 1 -11 6  22 o 33.03402 3.990126 13.50748       3.147064 13.33504       4.667987 13.65116       4.261041 32.50413 6.117688 32.99139 5.493096 -0.4872627     8.221935 
1 1 1 -11 6  23 o 68.20922 2.782131 56.82485       4.614709 50.60714       6.551723 62.94655       6.500942 64.25500 4.207345 71.73077 3.731906 -7.475777      5.623956 
1 1 1 -11 6  24 o 123.6138 3.896762 186.6722       11.72369 199.7890       16.68389 173.8777       16.47762 127.7405 5.371591 119.1165 5.693056 8.624008       7.827188 
1 1 1 -11 6  25 o 109.4612 2.779947 146.2183       7.409369 144.5709       10.63534 147.7719       10.32827 108.7499 4.020077 109.9627 3.860292 -1.212776      5.573408 
1 1 1 -11 6  26 f 239.0166 3.971671 697.5196       23.13329 691.9319       32.83165 703.0287       32.60040 237.8044 5.665479 239.7186 5.580654 -1.914185      7.952444 
1 1 1 -11 6  27 o 263.6221 4.273815 849.0380       27.45577 843.5370       38.93541 854.4789       38.72212 262.4074 6.088812 264.1207 6.016177 -1.713318      8.559673 
1 1 1 -11 6  28 o 41.16888 3.756345 20.86901       3.727049 27.98445       5.423624 14.50244       5.130287 47.60569 4.737972 33.83254 6.458094 13.77314       8.009704 
1 1 1 -11 6  29 o 118.4584 4.267634 171.7536       12.29926 176.7184       18.73544 167.9936       16.30441 119.8186 6.440242 116.9385 5.739048 2.880119       8.626319 
1 1 1 -11 6  30 o 45.08696 3.690347 25.00037       4.019213 27.16712       5.631947 22.75159       5.737576 46.84001 5.011884 42.71373 5.650677 4.126286       7.553088 
1 1 1 -11 6  31 o 54.51764 3.395144 36.44505       4.488183 36.70635       6.222346 36.16166       6.479988 54.55242 4.727239 54.10827 4.969915 0.4441452      6.859071 
1 1 1 -11 6  32 o 36.31731 4.549110 16.39968       3.937944 15.50563       5.320786 17.48254       5.855761 34.95208 6.485662 37.12255 6.720406 -2.170471      9.339575 
1 1 1 -11 6  33 o 44.04252 3.883652 23.91380       4.125543 24.72745       5.676257 23.00270       6.006540 44.56683 5.332244 42.85471 5.908699 1.712120       7.958992 
1 1 1 -11 6  34 o 57.89640 3.375894 41.12531       4.742292 42.95359       6.538655 39.09631       6.888219 59.00651 4.583202 56.19494 5.085043 2.811569       6.845685 
1 1 1 -11 6  35 o 35.79102 4.991122 16.04076       4.234956 8.118566       6.233092 22.83361       5.771744 25.95800 8.525686 42.68274 5.690713 -16.72474      10.25044 
1 1 1 -11 6  36 o 34.44400 5.574683 15.00511       4.519399 13.47317       5.405765 18.56184       8.236876 32.30791 7.063548 37.64822 9.083318 -5.340305      11.50654 
1 1 1 -11 6  37 o 125.1651 3.058375 191.8123       9.328460 188.1215       13.06661 195.6487       13.32197 123.5772 4.345753 126.0286 4.344233 -2.451431      6.144748 
1 1 1 -11 6  38 o 56.90828 3.914944 40.03548       5.396137 43.34290       6.659249 33.71089       9.208663 59.04975 4.665650 51.14991 7.620043 7.899845       8.934951 
1 1 1 -11 6  39 o 55.25535 4.134348 37.93339       5.526593 33.06460       6.399273 52.22200       10.96265 51.27409 5.193017 63.75856 7.180424 -12.48446      8.861485 
1 1 1 -11 6  40 o 43.09411 5.140089 23.55858       5.291609 11.70523       9.851134 28.36579       6.273528 30.22179 10.69957 47.18949 5.562180 -16.96770      12.05897 
1 1 1 -11 6  41 o 72.15883 3.203201 64.45827       5.618572 63.80331       7.771044 65.17568       8.133033 71.24937 4.498680 71.93233 4.664884 -0.6829605     6.480684 
1 1 1 -11 6  42 o 33.19929 4.906399 14.25732       3.850009 18.16151       5.329751 9.997050       5.567497 37.00770 6.123869 26.81928 7.950657 10.18842       10.03567 
1 1 1 -11 6  43 o 44.40607 4.025982 25.09137       4.309331 28.73015       6.331992 21.95190       5.881537 46.60309 5.693662 40.39103 6.170938 6.212067       8.396324 
1 1 1 -11 6  44 o 24.95122 6.569137 8.840112       4.048343 10.24765       6.467577 7.933354       5.191063 26.01956 8.689670 23.43822 7.783947 2.581337       11.66620 
1 1 1 -11 6  45 o 17.04745 6.943969 2.861199       4.538861 -8.010355      8.987111 6.583639       5.258818 15.98281 7.709162 21.34154 7.784437 -5.358721      10.95576 
1 1 1 -11 6  46 o 12.46080 5.654649 -0.9826127     3.723749 -3.985684      5.229183 2.106966       5.303965 12.95754 6.148150 16.75862 7.204676 -3.801078      9.471384 
1 1 1 -11 6  47 o 49.02126 4.139860 32.14301       4.899269 26.41087       6.935651 37.85193       6.921596 41.00509 7.203598 51.38347 5.619237 -10.37838      9.136063 
1 1 1 -11 6  48 o 11.68917 5.452334 -1.737464      3.812541 1.049877       5.551520 -4.225522      5.245019 15.39505 6.953262 12.36441 5.944912 3.030647       9.148215 
1 1 1 -11 6  49 o 15.07597 6.568910 2.342937       4.529644 -9.322156      8.002808 7.841575       5.494471 13.14510 6.524819 20.12469 7.818444 -6.979594      10.18338 
1 1 1 -11 6  50 o 9.376409 4.621336 -5.637111      3.765987 -5.127902      5.595668 -6.058735      5.091746 11.88540 5.811808 11.01476 5.418053 0.8706360      7.945590 
1 1 1 -11 7  1  o 672.3209 9.690317 5517.082       158.7635 5667.892       228.7829 5376.998       220.4972 680.8460 13.78918 663.1686 13.64404 17.67743       19.39849 
1 1 1 -11 7  2  o 337.5107 5.133494 1388.637       42.22180 1395.289       60.02819 1382.125       59.39808 338.2363 7.282810 336.6388 7.240560 1.597534       10.26962 
1 1 1 -11 7  3  o 224.5293 4.245715 614.4589       23.23057 624.2397       40.27239 609.5815       28.43887 226.1189 7.318243 223.6179 5.218789 2.501053       8.988461 
1 1 1 -11 7  4  o 123.3506 3.221241 185.5520       9.674507 201.8700       12.16494 157.4713       15.95808 128.6401 3.885040 113.5022 5.788647 15.13789       6.971511 
1 1 1 -11 7  5  o 229.9701 3.817065 644.5593       21.39129 669.5384       30.90844 621.5953       29.63542 234.3528 5.412163 225.8070 5.385643 8.545792       7.635225 
1 1 1 -11 7  6  o 564.3345 8.186293 3885.160       112.5797 3892.197       159.6015 3878.191       158.8247 564.4985 11.60214 563.4861 11.56641 1.012390       16.38266 
1 1 1 -11 7  7  o 507.6065 7.409692 3142.701       91.65654 3185.378       131.0447 3101.828       128.2445 510.7765 10.52816 504.0419 10.44086 6.734589       14.82746 
1 1 1 -11 7  8  o 460.9285 6.772919 2590.914       76.07563 2527.278       106.2140 2657.951       109.0151 455.0339 9.578592 466.6489 9.586506 -11.61493      13.55177 
1 1 1 -11 7  9  o 467.4767 6.860270 2665.199       78.15148 2711.973       112.1489 2621.042       108.9656 471.3363 9.764006 463.3773 9.649806 7.959076       13.72788 
1 1 1 -11 7  10 o 260.2944 4.807037 825.9302       30.49147 852.1251       38.26818 780.3851       50.46048 264.3566 5.940345 252.7679 8.202929 11.58871       10.12797 
1 1 1 -11 7  11 o 292.2237 4.542941 1040.957       32.35106 1064.564       46.74817 1019.262       44.81563 295.4492 6.493004 289.0997 6.361298 6.349426       9.089841 
1 1 1 -11 7  12 o 618.8419 10.32463 4677.888       155.7006 4566.713       265.8806 4735.912       192.0812 609.6604 17.91571 622.2763 12.66676 -12.61591      21.94127 
1 1 1 -11 7  13 o 349.7715 5.290612 1491.712       45.09480 1544.005       65.55254 1444.734       62.13220 355.7170 7.562212 344.1018 7.409581 11.61514       10.58721 
1 1 1 -11 7  14 o 418.0916 7.158936 2132.942       72.93835 2143.476       127.5632 2127.826       88.90524 418.3127 12.52789 417.4414 8.739684 0.8712463      15.27515 
1 1 1 -11 7  15 o 78.05812 2.676528 74.34508       5.083737 81.07272       7.882215 69.55324       6.652244 81.45277 3.983137 75.45061 3.628643 6.002159       5.388175 
1 1 1 -11 7  16 o 612.3305 8.870682 4581.851       132.3668 4495.829       185.2101 4671.662       189.2449 605.6755 12.54841 617.3973 12.57834 -11.72186      17.76731 
1 1 1 -11 7  17 o 103.2594 3.108451 130.0884       7.812948 133.3952       10.04381 125.0213       12.43300 104.5230 3.950322 101.1133 5.061919 3.409782       6.420908 
1 1 1 -11 7  18 o 434.9155 6.445233 2309.474       68.30927 2287.980       96.25303 2331.284       96.95860 432.4372 9.133878 436.5142 9.114900 -4.076935      12.90384 
1 1 1 -11 7  19 o 155.4746 3.022009 294.6828       11.44963 289.7598       16.39118 299.3737       16.00033 154.0643 4.370301 156.6128 4.196209 -2.548492      6.058688 
1 1 1 -11 7  20 o 365.0196 5.522595 1626.796       49.12420 1690.901       71.55186 1569.637       67.56378 371.7425 7.898463 358.1945 7.740321 13.54803       11.05886 
1 1 1 -11 7  21 o 131.6349 2.847614 211.2641       9.134576 227.8633       13.65337 197.8138       12.29036 136.6000 4.106259 127.2759 3.967464 9.324112       5.709828 
1 1 1 -11 7  22 o 191.9560 3.944521 449.5925       18.45151 454.1942       23.00309 441.2892       30.89946 192.8006 4.899973 189.8090 6.690794 2.991592       8.293159 
1 1 1 -11 7  23 o 42.92674 4.225692 22.70948       4.363156 30.92851       5.499156 8.743710       7.168334 50.12469 4.551606 27.44764 9.147920 22.67705       10.21771 
1 1 1 -11 7  24 o 72.98168 3.066197 65.08046       5.441034 63.28124       9.027276 66.10703       6.818824 71.77287 5.196504 73.49983 3.820147 -1.726959      6.449587 
1 1 1 -11 7  25 o 131.5003 2.888334 210.9117       9.255718 216.5300       13.52150 205.9581       12.69654 133.1017 4.173903 129.8234 4.018088 3.278305       5.793661 
1 1 1 -11 7  26 o 54.30327 3.202486 36.10463       4.219071 34.02744       5.988876 38.15128       5.944704 52.55618 4.726554 55.70971 4.414958 -3.153526      6.467779 
1 1 1 -11 7  27 o 187.6861 3.427972 429.9707       15.67853 434.7600       22.55556 425.4932       21.80888 188.4893 4.914749 186.4864 4.802989 2.002945       6.871933 
1 1 1 -11 7  28 o 90.04218 2.820239 99.01471       6.180623 98.04575       8.890540 99.92101       8.598230 89.48634 4.087745 90.35784 3.914159 -0.8714981     5.659532 
1 1 1 -11 7  29 o 229.8707 5.616941 647.5715       31.46441 689.4017       47.39351 614.6035       42.07462 236.2549 8.244573 223.2330 7.746120 13.02182       11.31262 
1 1 1 -11 7  30 o 152.2457 3.123885 282.9815       11.58980 291.8466       16.85719 275.0346       15.96046 154.3852 4.485429 149.8869 4.374320 4.498306       6.265281 
1 1 1 -11 7  31 o 180.6942 3.403498 398.8574       14.98670 389.9785       21.23109 407.6752       21.15788 178.3611 4.889292 182.3936 4.764292 -4.032562      6.826687 
1 1 1 -11 7  32 o 32.51725 5.077476 13.27018       3.892002 12.82219       5.263373 13.81066       5.781250 31.64000 7.010936 32.80818 7.407089 -1.168180      10.19893 
1 1 1 -11 7  33 o 30.77918 5.489154 11.98338       3.966143 7.333631       5.288931 17.95781       5.995167 24.55364 7.836687 37.59087 6.794619 -13.03723      10.37210 
1 1 1 -11 7  34 o 121.6528 3.017522 180.8488       8.945580 179.8301       12.75281 181.8355       12.55152 121.0474 4.330266 121.7399 4.237306 -0.6925049     6.058544 
1 1 1 -11 7  35 o 17.19996 6.606218 2.480745       3.890117 -1.683738      5.572783 6.438639       5.432799 16.18477 7.160697 23.50322 7.964908 -7.318449      10.71053 
1 1 1 -11 7  36 o 38.35773 5.022666 18.42567       4.582187 19.89349       5.641442 15.57983       7.855250 39.66055 6.026460 34.50614 9.181489 5.154411       10.98262 
1 1 1 -11 7  37 o 33.24109 5.575065 14.04320       4.356332 12.97509       5.182673 16.61476       8.041619 31.63852 6.915518 35.46116 9.220880 -3.822636      11.52601 
1 1 1 -11 7  38 f 47.17238 3.864739 27.56779       4.403755 27.13557       6.017466 28.06623       6.461964 46.43203 5.419961 47.14148 5.743445 -0.7094498     7.897033 
1 1 1 -11 7  39 o 37.13150 5.198902 17.50464       4.575511 13.77262       5.276871 28.81148       9.184911 32.38670 6.897604 46.61422 8.394436 -14.22752      10.86478 
1 1 1 -11 7  40 o 20.12934 7.302179 4.519037       4.618613 -0.6028927     9.306961 6.192530       5.319894 21.24132 9.331431 22.62272 7.874072 -1.381399      12.20969 
1 1 1 -11 7  41 o 31.63635 4.977117 12.89771       3.710471 10.29705       4.897214 16.40281       5.685344 27.55394 7.211045 34.99777 6.911560 -7.443829      9.988435 
1 1 1 -11 7  42 o 28.57108 5.674428 10.85107       3.811461 12.13848       5.219424 9.380190       5.578960 29.60169 7.285573 25.98720 8.014395 3.614489       10.83098 
1 1 1 -11 7  43 o 45.33099 4.076454 26.21520       4.455079 26.43361       6.257000 25.99062       6.344784 44.45953 5.922344 43.97690 6.083198 0.4826241      8.489963 
1 1 1 -11 7  44 o 13.85147 6.382998 -2.419982      4.990951 0.000000       0.000000 -2.419982      4.990951 ?        ?        13.85147 6.382998 0.000000       6.382998 
1 1 1 -11 7  45 o 15.83215 6.342899 2.522828       3.717761 1.761754       5.106071 3.381537       5.423711 16.57026 7.095325 18.19658 7.520605 -1.626316      10.33940 
1 1 1 -11 7  46 o 32.30212 5.383625 14.64903       4.088739 17.03992       5.746044 12.19674       5.819355 33.12240 7.314529 27.04937 8.154599 6.073034       10.95444 
1 1 1 -11 7  47 o 25.26267 7.187100 10.41262       4.634818 12.16478       5.792763 7.295407       7.726500 26.27448 8.177173 21.03485 8.855452 5.239630       12.05343 
1 1 1 -11 7  48 o 20.13781 6.833805 6.760406       3.999441 4.927851       5.868367 8.349840       5.465251 18.17981 7.688823 21.31959 7.908396 -3.139784      11.02999 
1 1 1 -11 7  49 o 21.82499 7.342304 8.875265       4.616559 -1.709087      8.420768 13.42355       5.520057 15.48850 7.468631 26.28516 7.946027 -10.79665      10.90504 
1 1 1 -11 7  50 o 13.25440 5.935085 1.037851       3.947995 2.817654       5.954982 -0.3579220     5.273537 15.71056 7.137820 13.55226 6.350960 2.158298       9.554223 
1 1 1 -11 8  1  o 305.5343 4.734268 1137.932       35.24917 1142.726       50.19156 1133.266       49.51505 306.1089 6.728506 304.8417 6.665408 1.267120       9.471032 
1 1 1 -11 8  2  o 970.0406 12.39198 11499.18       292.9319 11147.33       453.3859 11751.30       383.7935 953.0078 19.52250 979.6326 16.07675 -26.62476      25.29011 
1 1 1 -11 8  3  o 278.7301 3.931970 946.8950       26.70731 943.8967       42.28887 948.8843       34.44595 278.2263 6.237230 278.9956 5.066462 -0.7692566     8.035675 
1 1 1 -11 8  4  o 381.3511 5.709457 1773.068       53.05862 1900.711       78.77428 1667.072       71.78435 394.7100 8.189742 369.6681 7.968593 25.04184       11.42674 
1 1 1 -11 8  5  o 191.3605 3.406962 446.2796       15.88750 485.2550       23.43832 413.1488       21.60958 199.5195 4.820642 184.0369 4.822583 15.48268       6.818790 
1 1 1 -11 8  6  o 339.1367 5.151985 1402.100       42.57802 1427.479       61.27718 1378.408       59.20509 342.1013 7.350349 336.1756 7.226978 5.925629       10.30810 
1 1 1 -11 8  7  o 239.6042 3.907229 699.7227       22.81389 691.5435       32.48391 707.6838       32.04792 238.1618 5.597061 240.9287 5.458524 -2.766907      7.818093 
1 1 1 -11 8  8  o 716.4693 10.30261 6268.158       179.8792 6143.067       251.1494 6399.915       257.7543 708.5248 14.54591 723.1680 14.62617 -14.64319      20.62786 
1 1 1 -11 8  9  o 162.5422 4.215332 322.2504       16.68274 0.000000       0.000000 322.2504       16.68274 ?        ?        162.5422 4.215332 0.000000       4.215332 
1 1 1 -11 8  10 o 382.7104 5.731208 1785.927       53.45060 1726.045       74.32493 1850.069       76.92313 376.1021 8.109473 389.3803 8.106751 -13.27820      11.46660 
1 1 1 -11 8  11 o 453.6150 6.683589 2509.801       73.88108 2568.761       106.5072 2455.119       102.5712 458.6624 9.529050 448.4163 9.386592 10.24615       13.37576 
1 1 1 -11 8  12 o 260.7691 4.793065 829.0346       30.45828 793.0355       52.19159 847.6270       37.50783 254.7508 8.418715 263.6396 5.838150 -8.888794      10.24494 
1 1 1 -11 8  13 o 268.6322 4.912276 879.8649       32.15711 913.1301       57.83528 864.9791       38.68877 273.3290 8.694082 266.3076 5.961633 7.021454       10.54173 
1 1 1 -11 8  14 o 79.01594 2.718071 76.18148       5.225942 69.99158       7.903997 80.98911       6.965786 75.64716 4.305414 81.43694 3.518345 -5.789780      5.560156 
1 1 1 -11 8  15 o 274.4843 4.345763 918.6160       29.06829 954.0956       42.44600 887.2800       39.89046 279.6353 6.228861 269.6755 6.070038 9.959778       8.697360 
1 1 1 -11 8  16 o 327.4818 5.020833 1308.070       40.06813 1281.038       56.31605 1335.782       57.02030 323.9092 7.134653 330.7636 7.074173 -6.854401      10.04725 
1 1 1 -11 8  17 o 347.3818 6.110518 1472.947       51.72747 1459.419       63.33400 1500.053       89.64828 345.6261 7.519592 349.8007 10.52882 -4.174652      12.93833 
1 1 1 -11 8  18 o 119.2365 2.768901 173.3031       8.045497 154.3759       11.36816 192.2964       11.38797 112.4311 4.156384 125.5241 3.727044 -13.09298      5.582686 
1 1 1 -11 8  19 o 515.9139 8.743226 3258.757       109.9221 3218.085       133.8119 3343.155       192.7594 512.0644 10.72344 519.8034 15.23383 -7.739014      18.62959 
1 1 1 -11 8  20 o 148.3228 2.989591 268.2299       10.80577 272.4174       15.77654 264.5294       14.83062 149.3591 4.339148 147.1940 4.138706 2.165192       5.996423 
1 1 1 -11 8  21 o 479.5886 7.078487 2814.354       82.72665 2890.527       119.3777 2743.977       114.7460 484.9772 10.10103 472.5777 9.963874 12.39957       14.18836 
1 1 1 -11 8  22 o 182.5383 3.324270 406.4167       14.78722 414.0770       21.48476 399.5218       20.38325 184.0840 4.793449 180.8350 4.629266 3.248978       6.663877 
1 1 1 -11 8  23 o 251.2257 4.769294 770.8646       29.19808 741.0292       35.13654 837.4410       52.48726 246.1659 5.857267 261.0963 8.259689 -14.93039      10.12571 
1 1 1 -11 8  24 f 152.4332 3.452763 283.5060       12.82574 282.5627       22.04950 283.9884       15.76771 151.8563 5.970034 152.4503 4.248426 -0.5939789     7.327375 
1 1 1 -11 8  25 o 43.82437 3.457232 23.58163       3.662274 24.39864       5.568904 22.95903       4.861371 44.36498 5.252808 43.09422 4.705550 1.270763       7.052248 
1 1 1 -11 8  26 o 123.0682 2.869925 184.7585       8.607010 192.0644       12.67259 178.5025       11.72667 125.3294 4.155058 120.8358 3.987845 4.493637       5.759116 
1 1 1 -11 8  27 o 202.4661 3.582144 500.4692       17.67386 504.9084       25.44677 496.3320       24.56573 203.0825 5.146051 201.4364 5.004440 1.646011       7.178179 
1 1 1 -11 8  28 o 292.8637 6.673079 1053.073       47.62423 1047.522       68.54056 1058.255       66.22097 290.7133 9.688436 292.3922 9.305657 -1.678833      13.43358 
1 1 1 -11 8  29 o 79.44843 3.512148 77.23840       6.782965 82.32116       13.76009 75.60687       7.795968 81.52798 6.993433 78.54336 4.087156 2.984627       8.100183 
1 1 1 -11 8  30 f 186.4909 3.458905 424.8232       15.71926 423.2726       22.48281 426.3060       21.98631 185.8380 4.969010 186.5308 4.840974 -0.6928711     6.937297 
1 1 1 -11 8  31 o 96.89907 2.938136 114.7365       6.929878 121.6330       10.08521 108.5677       9.538297 99.62923 4.163133 94.11581 4.169186 5.513412       5.891841 
1 1 1 -11 8  32 o 119.3102 3.016701 173.9612       8.763904 181.8638       12.75299 166.8897       12.06377 121.8068 4.303156 116.6868 4.249630 5.119949       6.047852 
1 1 1 -11 8  33 o 65.49921 3.283949 52.56866       5.224936 40.47955       7.188648 66.10748       7.607479 57.17968 5.216431 73.33977 4.275157 -16.16009      6.744488 
1 1 1 -11 8  34 o 25.72674 6.591576 8.489347       4.150722 11.39162       6.177355 6.100489       5.604396 29.78630 8.234932 23.27480 8.083005 6.511505       11.53902 
1 1 1 -11 8  35 o 111.2657 3.464622 151.6982       9.382608 147.3332       11.55458 160.1483       16.07650 109.4759 4.339710 113.7509 5.818970 -4.274986      7.259028 
1 1 1 -11 8  36 o 47.09176 4.476912 27.51232       5.075866 26.82613       6.092850 29.06881       9.176394 46.28240 5.510243 47.47903 8.229172 -1.196636      9.903638 
1 1 1 -11 8  37 o 40.07195 4.259665 19.98513       4.095943 15.60879       5.515575 25.36598       6.115906 34.78303 6.750624 44.86366 5.724304 -10.08064      8.850908 
1 1 1 -11 8  38 o 30.23343 6.176342 11.83620       4.396523 13.04826       5.214514 8.856131       8.176434 31.59204 6.961381 27.43231 9.744261 4.159735       11.97545 
1 1 1 -11 8  39 o 46.72133 3.730851 27.10614       4.212488 24.18332       5.788991 30.39558       6.141325 43.60202 5.575708 49.07376 5.215198 -5.471748      7.634580 
1 1 1 -11 8  40 o 32.82265 6.027338 14.07008       4.643376 15.62397       8.975991 13.50230       5.425787 33.41475 10.13917 31.76025 7.179654 1.654497       12.42378 
1 1 1 -11 8  41 o 29.88093 5.369971 11.65720       3.766503 9.147713       5.266624 14.28442       5.388756 25.93603 7.743688 32.50677 7.009136 -6.570738      10.44475 
1 1 1 -11 8  42 o 18.31424 6.378297 4.116889       3.490985 2.276103       4.920628 5.982376       4.953534 17.67253 7.218195 21.63755 7.593457 -3.965019      10.47678 
1 1 1 -11 8  43 o 15.46865 6.426491 1.443644       3.989094 4.950912       8.135421 0.3334733      4.577100 22.27101 9.208238 15.30787 6.637165 6.963143       11.35093 
1 1 1 -11 8  44 o 17.80597 6.472837 4.009923       3.631638 5.919106       5.253373 2.262430       5.025994 20.92747 7.755322 17.19464 7.183995 3.732826       10.57141 
1 1 1 -11 8  45 o 16.53108 6.369121 3.243764       3.623787 3.776869       4.931514 2.618036       5.342773 18.10364 7.287149 17.40487 7.347514 0.6987686      10.34836 
1 1 1 -11 8  46 f 14.95287 6.251571 1.859883       3.809813 1.448609       5.386337 2.271632       5.389443 16.22065 7.113180 16.82898 7.249015 -0.6083317     10.15606 
1 1 1 -11 8  47 o 16.95448 6.802157 3.781291       4.281919 3.399913       5.233437 4.553601       7.447399 17.15168 7.257812 19.01510 8.350575 -1.863426      11.06381 
1 1 1 -11 8  48 o 20.51273 6.886759 7.138638       4.061600 12.76733       6.064688 2.560893       5.469284 25.48816 8.411579 16.15670 7.123448 9.331455       11.02262 
1 1 1 -11 8  49 o 15.32907 6.552691 2.919040       4.341476 10.93540       8.784568 0.3282471      4.993996 20.94133 9.135843 13.95205 6.413178 6.989278       11.16210 
1 1 1 -11 8  50 o 12.83163 5.813525 0.5467683      3.916696 8.403497       5.869393 -5.760443      5.258852 19.66421 7.937694 11.26027 5.532336 8.403940       9.675419 
1 1 1 -11 9  1  o 608.7559 7.887043 4521.287       117.0020 4517.852       185.0726 4523.574       151.0076 607.9237 12.49271 608.6440 10.18121 -0.7203369     16.11598 
1 1 1 -11 9  2  o 320.9050 4.422299 1255.264       34.58285 1285.320       55.65270 1236.358       44.13950 324.6235 7.035098 318.4369 5.688109 6.186584       9.046944 
1 1 1 -11 9  3  o 329.8748 4.524181 1326.437       36.36849 1298.290       56.97677 1345.791       47.24502 326.2527 7.166510 332.2263 5.835605 -5.973663      9.241923 
1 1 1 -11 9  4  o 195.3054 3.075148 464.8563       14.63580 427.3922       22.42954 492.6363       19.31433 187.1771 4.921625 201.0439 3.942326 -13.86684      6.305896 
1 1 1 -11 9  5  o 572.8588 8.331233 4004.265       116.3035 3922.141       162.1646 4091.248       166.8934 566.5539 11.74570 578.6261 11.83600 -12.07220      16.67490 
1 1 1 -11 9  6  o 260.8194 3.741773 829.1116       23.78227 801.4059       37.16425 848.3251       30.94882 256.3672 5.948765 263.7988 4.814322 -7.431580      7.652811 
1 1 1 -11 9  7  o 527.0826 6.877834 3388.468       88.34184 3392.392       140.1329 3385.880       113.8047 526.9832 10.91207 526.7048 8.866590 0.2783813      14.06022 
1 1 1 -11 9  8  o 592.5343 8.589830 4284.896       124.0321 4170.716       172.4830 4407.164       178.4869 584.1160 12.11745 600.4323 12.19849 -16.31628      17.19406 
1 1 1 -11 9  9  f 392.0756 5.863601 1874.519       56.02351 1912.187       80.67043 1839.428       77.86259 395.8333 8.363075 388.2393 8.229876 7.593964       11.73337 
1 1 1 -11 9  10 o 359.4041 6.269234 1575.386       54.90775 1452.285       91.27007 1645.209       68.73777 344.5753 10.88311 367.1945 7.681803 -22.61917      13.32112 
1 1 1 -11 9  11 o 198.1857 3.968101 478.7728       19.16422 438.1434       32.70076 500.0268       23.65147 189.3721 7.098639 202.5179 4.792462 -13.14575      8.564950 
1 1 1 -11 9  12 o 338.9102 7.257629 1401.600       59.93983 0.000000       0.000000 1401.600       59.93983 ?        ?        338.9102 7.257629 0.000000       7.257629 
1 1 1 -11 9  13 o 311.6755 4.819949 1184.483       36.60844 1141.947       51.07010 1229.441       52.50396 305.9141 6.850640 317.4214 6.787655 -11.50732      9.643834 
1 1 1 -11 9  14 o 201.9732 3.502385 497.2587       17.23828 482.7446       24.47141 511.5547       24.28685 198.8931 5.053066 204.8146 4.866022 -5.921524      7.015101 
1 1 1 -11 9  15 o 621.9711 10.42020 4734.134       157.9365 4851.525       196.9380 4522.569       264.3832 628.9232 12.84978 605.0744 17.95020 23.84875       22.07548 
1 1 1 -11 9  16 o 234.9301 3.884778 672.9532       22.24032 677.3800       32.03513 668.8344       30.90067 235.6148 5.579404 234.1335 5.415870 1.481293       7.775693 
1 1 1 -11 9  17 o 199.1806 4.026597 483.8040       19.54436 466.4986       23.87556 518.9540       34.02718 195.4760 5.016296 206.0173 6.787024 -10.54135      8.439604 
1 1 1 -11 9  18 o 222.8268 3.747738 605.4912       20.35039 610.4277       29.32993 600.9084       28.25950 223.6330 5.381943 221.8934 5.226174 1.739563       7.501880 
1 1 1 -11 9  19 o 128.0850 2.844767 200.0077       8.879346 197.3223       12.94719 202.3923       12.20062 127.1120 4.185483 128.7561 3.892936 -1.644096      5.716049 
1 1 1 -11 9  20 o 377.6128 6.590124 1743.437       60.64240 1745.463       74.68922 1739.517       103.8833 377.4937 8.119177 375.7420 11.35844 1.751770       13.96192 
1 1 1 -11 9  21 f 113.7851 2.788842 157.8641       7.732955 140.3057       10.94271 175.3798       10.92940 107.1411 4.199276 119.8393 3.747099 -12.69817      5.628026 
1 1 1 -11 9  22 o 227.3371 4.459360 630.9827       24.70467 631.2125       30.42811 630.5381       42.31753 227.2607 5.494328 226.6853 7.671619 0.5753326      9.436174 
1 1 1 -11 9  23 o 225.0407 3.822671 618.0552       20.96352 609.0807       29.75785 626.8970       29.53716 223.2128 5.470743 226.4699 5.352077 -3.257065      7.653349 
1 1 1 -11 9  24 o 201.8488 4.041493 497.4063       19.87944 486.4142       33.95201 503.1405       24.52250 199.0933 7.008913 202.9083 4.959396 -3.814987      8.586062 
1 1 1 -11 9  25 o 133.6525 2.945715 217.9025       9.594095 216.5119       13.94703 219.1516       13.21847 133.0689 4.306667 133.9049 4.055549 -0.8359833     5.915645 
1 1 1 -11 9  26 o 106.2528 2.818875 137.8159       7.292365 135.2439       10.65726 140.0805       10.00001 105.1386 4.167815 107.0377 3.840005 -1.899101      5.667126 
1 1 1 -11 9  27 o 258.7629 4.234440 818.2264       26.70140 824.8501       38.34342 811.9901       37.20527 259.4121 6.065471 257.4155 5.931078 1.996613       8.483374 
1 1 1 -11 9  28 o 154.4938 4.532508 292.1393       17.04574 313.7581       26.47646 276.8351       22.27655 159.6653 6.820482 150.1120 6.102428 9.553253       9.151973 
1 1 1 -11 9  29 o 110.9085 2.896218 150.2266       7.820969 144.1705       11.13013 156.1335       10.99220 108.5057 4.217346 112.9518 3.999830 -4.446106      5.812457 
1 1 1 -11 9  30 o 157.0373 3.198552 301.1428       12.24030 307.0872       17.71899 295.7166       16.92884 158.3275 4.597342 155.3882 4.475338 2.939331       6.415933 
1 1 1 -11 9  31 o 105.5297 2.964030 136.0845       7.614880 131.1812       10.85002 140.8442       10.68990 103.4417 4.313734 107.2214 4.098795 -3.779785      5.950498 
1 1 1 -11 9  32 o 266.5717 4.386618 870.3057       28.49574 917.4268       41.90903 829.7888       38.86143 272.9485 6.300730 259.6527 6.141717 13.29575       8.798858 
1 1 1 -11 9  33 f 25.45683 6.315703 8.305264       3.899095 9.823368       5.437682 6.698656       5.593943 27.73822 7.747908 23.96911 8.082315 3.769106       11.19616 
1 1 1 -11 9  34 o 59.61604 3.736018 43.68111       5.400317 41.54321       8.502375 45.12681       6.991738 57.70430 6.140586 60.43428 4.786573 -2.729980      7.785761 
1 1 1 -11 9  35 o 124.1777 3.569040 189.0283       10.78898 194.5277       13.44562 179.0856       18.07911 125.7778 4.393476 120.1328 6.196540 5.644958       7.596035 
1 1 1 -11 9  36 o 85.51964 3.088616 89.64928       6.426168 89.17340       8.999011 90.14446       9.179628 85.04073 4.356942 85.48866 4.421388 -0.4479294     6.207384 
1 1 1 -11 9  37 o 87.26517 3.098781 93.45234       6.579276 93.71687       9.391682 93.19741       9.219704 87.06387 4.441264 86.84142 4.370714 0.2224426      6.231209 
1 1 1 -11 9  38 o 92.62185 3.554066 105.7177       8.006975 100.5257       9.644520 117.2336       14.36355 90.04200 4.408813 96.49007 6.140477 -6.448074      7.559305 
1 1 1 -11 9  39 o 18.29059 6.427358 3.820205       3.549758 0.1649422      4.764056 8.382577       5.322465 16.00948 6.854352 25.36528 7.828939 -9.355804      10.40550 
1 1 1 -11 9  40 o 38.84172 5.515052 19.42447       5.073595 33.77393       10.99737 15.54452       5.718529 49.28877 9.500420 34.08609 7.114700 15.20267       11.86916 
1 1 1 -11 9  41 o 25.18482 6.038886 8.488554       3.658247 9.511249       5.061700 7.370198       5.293142 26.34182 7.516274 23.65148 7.860271 2.690334       10.87558 
1 1 1 -11 9  42 o 34.19007 6.188410 15.73985       4.966259 1.785039       9.134151 21.59631       5.917298 21.46372 9.340489 40.13735 6.253448 -18.67363      11.24057 
1 1 1 -11 9  43 o 11.50596 5.356274 -2.696331      3.650513 0.4332223      5.529455 -5.114215      4.860253 16.58509 7.241553 12.32610 5.870947 4.258998       9.322452 
1 1 1 -11 9  44 o 14.87923 6.152654 1.603771       3.632570 0.9434001      4.947021 2.376462       5.351215 15.94381 6.906572 17.52712 7.373647 -1.583304      10.10304 
1 1 1 -11 9  45 f 21.22512 7.081483 6.761118       4.295378 4.927633       5.340423 10.12048       7.228788 19.36755 7.653178 24.50872 9.094551 -5.141163      11.88621 
1 1 1 -11 9  46 o 26.32837 6.454750 10.51811       4.108877 10.73724       5.735166 10.28702       5.889569 25.07420 8.174629 24.45801 8.292940 0.6161938      11.64463 
1 1 1 -11 9  47 o 15.57746 6.658534 2.264772       4.482455 -0.4719665E-01 5.700309 6.010642       7.255775 15.07039 6.899119 19.72106 8.451555 -4.650669      10.90993 
1 1 1 -11 9  48 o 10.23709 4.935616 -3.764090      3.674113 -1.866255      5.511914 -5.281619      4.928806 13.53370 6.388873 11.39138 5.544666 2.142325       8.459374 
1 1 1 -11 9  49 o 21.53699 7.387252 8.852369       4.675703 4.214188       8.093651 11.17568       5.728279 17.42808 8.065593 23.06524 8.159619 -5.637161      11.47315 
1 1 1 -11 10 1  o 374.6768 5.062829 1711.502       46.22598 1759.470       74.60490 1681.610       58.89340 379.7182 8.062503 371.3188 6.508541 8.399414       10.36171 
1 1 1 -11 10 2  o 385.2103 5.181433 1809.116       48.63892 1795.580       76.74605 1818.202       62.87949 383.5903 8.210173 386.0985 6.683051 -2.508179      10.58632 
1 1 1 -11 10 3  o 250.1404 3.647311 762.6118       22.23273 774.3735       35.73376 755.1830       28.39877 252.0038 5.818828 248.8950 4.682170 3.108826       7.468699 
1 1 1 -11 10 4  o 382.6349 5.779610 1785.255       53.89136 1803.145       76.61959 1767.739       75.81458 384.4031 8.179314 380.6107 8.174018 3.792389       11.56355 
1 1 1 -11 10 5  o 508.0681 7.456962 3149.170       92.32514 3020.909       126.8809 3293.502       134.5952 497.3107 10.46966 519.2430 10.63709 -21.93228      14.92519 
1 1 1 -11 10 6  o 196.7915 3.098944 471.9702       14.86128 452.3017       23.40226 485.2622       19.23833 192.5490 4.991683 199.5295 3.956619 -6.980530      6.369594 
1 1 1 -11 10 7  o 356.0745 4.834785 1545.708       41.95214 1447.609       64.02106 1619.531       55.53778 344.4489 7.627145 364.4109 6.254045 -19.96204      9.863388 
1 1 1 -11 10 8  o 227.5471 3.405571 631.0615       18.88414 617.0589       29.88763 640.3662       24.36348 224.9586 5.451961 229.1977 4.362072 -4.239075      6.982232 
1 1 1 -11 10 9  o 367.5319 5.551634 1647.174       49.72239 1618.943       70.06632 1675.814       70.57255 364.2217 7.894187 370.5696 7.815016 -6.347931      11.10822 
1 1 1 -11 10 10 o 360.5790 6.285075 1585.899       55.22644 1605.884       97.21924 1576.378       67.10490 362.2725 11.02520 359.4008 7.661946 2.871643       13.42611 
1 1 1 -11 10 11 f 535.4018 11.02936 3505.246       143.9018 0.000000       0.000000 3505.246       143.9018 ?        ?        535.4018 11.02936 0.000000       11.02936 
1 1 1 -11 10 12 o 256.2859 4.764565 800.8939       29.75666 759.5012       50.91797 822.3629       36.67038 249.2423 8.395247 259.6526 5.795444 -10.41025      10.20134 
1 1 1 -11 10 13 o 422.0623 6.278611 2173.573       64.57675 2151.600       91.17115 2195.696       91.48026 419.6217 8.915863 423.9080 8.855636 -4.286255      12.56642 
1 1 1 -11 10 14 o 275.1920 4.375285 923.4514       29.34123 943.9421       42.51973 904.8239       40.54052 278.1149 6.273793 272.3023 6.109447 5.812531       8.757044 
1 1 1 -11 10 15 f 459.8899 6.792958 2582.427       76.12878 2724.088       111.9629 2460.618       103.8221 471.8122 9.737983 448.4622 9.500093 23.34998       13.60441 
1 1 1 -11 10 16 o 115.3483 2.786469 162.1819       7.832517 184.2401       12.12788 146.3984       10.25892 122.8482 4.056732 109.5044 3.850441 13.34380       5.593118 
1 1 1 -11 10 17 o 34.31535 4.616798 14.62367       3.762834 9.944508       5.185985 19.82580       5.468120 28.03510 7.460405 39.88554 5.795284 -11.85044      9.446849 
1 1 1 -11 10 18 o 279.7928 4.444977 955.1138       30.30694 927.4013       42.55791 983.6287       43.16962 275.5152 6.338677 283.7559 6.243056 -8.240662      8.896886 
1 1 1 -11 10 19 o 152.9665 3.052197 285.3057       11.37746 281.6050       16.42429 288.7199       15.77561 151.8456 4.443401 153.7717 4.213892 -1.926041      6.123782 
1 1 1 -11 10 20 o 313.3005 4.874866 1198.467       37.21858 1188.573       52.82155 1208.222       52.45045 311.6717 6.954690 314.2571 6.849013 -2.585480      9.760978 
1 1 1 -11 10 21 o 187.2377 3.934759 427.8042       17.95344 425.5502       22.33954 431.9151       30.16947 186.6009 4.917031 187.7649 6.603799 -1.163956      8.233308 
1 1 1 -11 10 22 o 81.39197 3.400515 80.95764       6.729837 83.76663       8.331339 75.68325       11.41632 82.73600 4.145433 78.43378 6.018915 4.302216       7.308349 
1 1 1 -11 10 23 o 298.9903 5.399633 1092.902       39.34209 1113.200       68.88886 1083.077       47.92650 300.5831 9.416389 297.3938 6.613139 3.189270       11.50661 
1 1 1 -11 10 24 o 231.4542 3.900917 653.9883       22.00229 674.1057       32.05967 636.0767       30.25091 234.7476 5.604305 228.0555 5.443294 6.692139       7.812662 
1 1 1 -11 10 25 o 115.8444 2.860001 163.7025       8.073783 161.3088       11.74538 165.8469       11.11665 114.8413 4.204036 116.4761 3.922119 -1.634773      5.749516 
1 1 1 -11 10 26 o 118.4234 2.882660 171.0946       8.318925 165.4618       11.95162 176.3884       11.58636 116.2966 4.224212 120.1083 3.963994 -3.811760      5.792859 
1 1 1 -11 10 27 o 63.76172 3.062754 49.72930       4.745003 52.50743       7.102013 47.48926       6.377240 65.38235 4.484591 62.19313 4.233020 3.189213       6.166848 
1 1 1 -11 10 28 o 122.6879 4.262343 184.2447       12.72407 185.3843       19.84468 183.4492       16.58102 122.6656 6.663757 122.2235 5.581725 0.4420853      8.692600 
1 1 1 -11 10 29 o 157.7533 3.202803 303.8606       12.31245 298.0384       17.62712 309.4076       17.20541 155.9866 4.642389 158.9709 4.445678 -2.984344      6.427739 
1 1 1 -11 10 30 o 168.3479 3.307920 346.1658       13.57059 354.9312       19.78814 338.3829       18.64616 170.1745 4.776436 166.1907 4.608570 3.983856       6.637263 
1 1 1 -11 10 31 o 57.82673 3.526980 41.02079       4.946492 34.97556       6.986197 47.09797       7.004632 53.10373 5.477062 61.82932 4.683790 -8.725590      7.206670 
1 1 1 -11 10 32 o 94.54829 3.021390 109.3116       6.952462 105.8811       10.00761 112.5117       9.665824 92.85883 4.435358 95.77351 4.151357 -2.914680      6.075044 
1 1 1 -11 10 33 o 146.7511 3.192385 263.2541       11.41649 256.7324       16.26687 269.5845       16.02654 144.5936 4.622502 148.2157 4.442215 -3.622131      6.410991 
1 1 1 -11 10 34 o 106.7533 3.354382 139.5673       8.715466 133.6885       14.30870 143.0349       10.98923 103.9865 5.668031 107.9206 4.186504 -3.934044      7.046516 
1 1 1 -11 10 35 o 27.26445 6.860830 9.598343       4.554045 11.57266       5.458851 5.078790       8.259257 29.87961 7.507412 24.61418 9.579278 5.265427       12.17061 
1 1 1 -11 10 36 o 85.34533 3.113939 89.32507       6.465428 95.21595       9.338418 83.90160       8.960292 87.84685 4.376032 82.42447 4.477792 5.422379       6.261013 
1 1 1 -11 10 37 f 16.31443 6.296122 2.241648       3.545427 -0.5951835     4.751205 5.806170       5.325834 15.49986 6.740956 22.48697 7.874990 -6.987109      10.36610 
1 1 1 -11 10 38 o 38.67173 5.121425 18.92631       4.707836 19.02979       5.762266 18.71857       8.164512 38.40305 6.381168 37.22194 9.082606 1.181110       11.10014 
1 1 1 -11 10 39 o 28.41910 5.735918 10.51967       3.835280 5.771433       5.306632 15.71212       5.549315 22.16416 7.852370 34.52428 6.837905 -12.36012      10.41233 
1 1 1 -11 10 40 o 40.36500 4.465053 20.62063       4.318713 19.17406       6.158693 22.02017       6.057724 37.95905 6.912486 41.03395 6.255555 -3.074898      9.322791 
1 1 1 -11 10 41 o 46.08562 4.740211 27.14327       5.247697 32.51279       10.58860 25.39502       6.041894 47.50471 9.479112 44.08235 5.762150 3.422367       11.09306 
1 1 1 -11 10 42 o 36.90527 4.445364 17.54357       3.917482 19.79502       5.661907 15.47587       5.425936 38.27167 6.289108 33.42563 6.890418 4.846039       9.329026 
1 1 1 -11 10 43 o 26.85017 6.701795 10.25182       4.370986 11.28778       7.002315 9.590456       5.594872 27.10115 9.041574 25.45580 8.052610 1.645348       12.10763 
1 1 1 -11 10 44 o 22.97291 6.546842 7.686496       3.842566 5.656831       5.207596 10.11237       5.693239 20.38356 7.687218 25.43958 8.131916 -5.056019      11.19024 
1 1 1 -11 10 45 o 13.84737 6.135291 0.5094495E-01  4.105284 -2.730362      5.061844 5.396463       7.017447 13.39027 6.257864 20.41368 8.505766 -7.023404      10.55978 
1 1 1 -11 10 46 o 24.52728 6.843713 9.467794       4.244998 14.28794       5.904005 4.309056       6.107850 29.01208 8.062037 18.64330 7.862397 10.36878       11.26116 
1 1 1 -11 10 47 o 25.60631 6.813437 10.69142       4.325782 7.363818       6.249582 13.75200       5.993603 20.46231 8.214908 27.28653 8.286398 -6.824219      11.66829 
1 1 1 -11 10 48 o 19.28778 6.839389 6.397115       4.026566 10.04822       6.160638 3.674226       5.320205 22.07106 8.352723 16.63998 7.185167 5.431086       11.01792 
1 1 1 -11 10 49 o 15.64173 6.699760 3.334455       4.555143 13.83490       8.932391 -0.3559847     5.295450 22.17726 9.437028 13.70101 6.402285 8.476241       11.40380 
1 1 1 -11 11 1  o 552.7880 6.583641 3727.447       88.68717 3798.918       127.0275 3659.476       123.8771 557.7446 9.346009 547.4206 9.286106 10.32397       13.17496 
1 1 1 -11 11 2  o 497.7941 6.539132 3022.580       79.32424 3084.567       127.3268 2983.260       101.4086 502.4555 10.39887 494.3692 8.417579 8.086273       13.37879 
1 1 1 -11 11 3  o 91.39651 2.484587 101.8717       5.528621 101.9220       9.147293 101.8427       6.939564 91.34772 4.119817 91.35986 3.121613 -0.1213837E-01 5.168884 
1 1 1 -11 11 4  o 122.6392 2.938972 183.2984       8.783360 199.5825       12.84217 168.9859       12.03972 127.8909 4.126021 117.6654 4.205625 10.22549       5.891632 
1 1 1 -11 11 5  o 236.0434 3.905557 679.1372       22.46523 696.9647       32.69197 663.1868       30.92305 239.0722 5.611459 233.2126 5.441194 5.859634       7.816333 
1 1 1 -11 11 6  o 461.4117 6.093209 2596.568       68.51266 2627.392       109.4417 2576.704       87.85843 463.8034 9.683066 459.4984 7.846271 4.304962       12.46297 
1 1 1 -11 11 7  o 124.9407 2.819012 190.2417       8.582953 176.5345       16.91998 194.9909       9.959463 120.1751 5.794699 126.4450 3.234857 -6.269836      6.636477 
1 1 1 -11 11 8  o 373.6551 6.488150 1703.161       59.07827 1603.178       99.00951 1758.442       73.62057 361.9260 11.23952 379.5586 7.959472 -17.63257      13.77244 
1 1 1 -11 11 9  o 68.39048 4.001654 57.21146       6.640023 66.20977       10.38118 50.98122       8.638103 73.44679 5.848396 64.41705 5.557048 9.029747       8.067497 
1 1 1 -11 11 10 o 737.9435 10.63333 6658.771       191.2178 6881.694       277.0512 6455.974       264.2486 748.8176 15.18266 725.3655 14.94926 23.45209       21.30713 
1 1 1 -11 11 11 o 279.5394 5.110897 952.9701       34.81579 1046.170       65.00716 915.4851       41.22691 292.4632 9.132432 273.9302 6.175964 18.53293       11.02469 
1 1 1 -11 11 12 o 232.9192 3.882936 661.3972       22.03950 638.8683       31.13153 684.0336       31.20572 228.8490 5.582329 236.8087 5.407549 -7.959686      7.772000 
1 1 1 -11 11 13 f 194.9776 3.962902 463.5103       18.82929 462.4497       33.44497 464.0024       22.78302 194.4881 7.068456 195.0515 4.793204 -0.5633698     8.540367 
1 1 1 -11 11 14 o 385.6511 5.805198 1814.989       54.55665 1795.225       77.11056 1834.797       77.19903 383.2397 8.256713 387.4524 8.176310 -4.212677      11.62004 
1 1 1 -11 11 15 o 45.95459 3.379478 25.88561       3.758083 23.69486       5.900308 27.38101       4.874792 43.69780 5.674788 47.18860 4.285894 -3.490799      7.111407 
1 1 1 -11 11 16 o 59.65283 3.429034 43.53067       4.963695 36.46288       6.519892 53.27499       7.655514 54.43988 4.969320 65.90582 4.799561 -11.46593      6.908685 
1 1 1 -11 11 17 o 125.0930 2.846475 190.7678       8.677138 203.3206       13.11597 180.9976       11.57132 129.0359 4.176631 121.7564 3.904965 7.279526       5.717779 
1 1 1 -11 11 18 o 230.9268 3.866742 650.4941       21.75984 619.0789       30.39794 683.5092       31.16242 225.1484 5.540377 236.5877 5.405090 -11.43932      7.740205 
1 1 1 -11 11 19 o 130.3953 2.894833 207.3185       9.198594 209.6522       13.54637 205.3218       12.53050 131.0049 4.248875 129.6648 3.970289 1.340149       5.815165 
1 1 1 -11 11 20 o 125.0516 2.852304 190.6855       8.692027 199.6286       12.96949 183.3933       11.71133 127.8271 4.169128 122.5325 3.927174 5.294662       5.727506 
1 1 1 -11 11 21 o 160.9610 3.706378 316.1288       14.53805 325.7174       18.22103 299.3316       24.11649 163.2585 4.584491 156.2852 6.345474 6.973297       7.828321 
1 1 1 -11 11 22 f 132.4075 2.936955 213.8210       9.476458 222.6200       14.11934 206.6082       12.78349 134.9621 4.298534 130.0369 4.038998 4.925262       5.898381 
1 1 1 -11 11 23 o 253.0067 5.784016 783.1312       35.66133 771.7096       50.40604 794.5770       50.45946 250.4926 8.268888 254.2127 8.155896 -3.720047      11.61435 
1 1 1 -11 11 24 o 107.2441 2.847358 140.3883       7.434763 142.7457       11.05334 138.4405       10.04721 108.0279 4.206807 106.4149 3.880923 1.612946       5.723529 
1 1 1 -11 11 25 o 225.6345 3.848001 621.6796       21.15810 628.0076       30.55833 615.8524       29.32397 226.5155 5.535995 224.3436 5.363806 2.171875       7.708285 
1 1 1 -11 11 26 o 156.4889 3.166528 298.8684       12.07544 315.6403       17.91324 284.8989       16.34835 160.6126 4.581445 152.6096 4.400577 8.002991       6.352537 
1 1 1 -11 11 27 o 49.30257 4.892443 30.03160       5.800569 29.49777       10.25843 30.28249       7.032811 48.09252 9.086099 49.34496 5.969798 -1.252441      10.87178 
1 1 1 -11 11 28 o 135.7718 3.037925 225.0114       10.05131 223.8415       14.67863 226.0443       13.79214 135.2056 4.461181 135.9122 4.169183 -0.7066193     6.106081 
1 1 1 -11 11 29 o 35.88895 4.534261 16.00979       3.877199 19.48039       5.762829 13.13963       5.240667 39.35618 6.214834 32.07294 6.909375 7.283237       9.293203 
1 1 1 -11 11 30 o 77.54803 3.079598 73.55160       5.808130 70.26143       8.414214 76.54614       8.027312 75.61382 4.588015 78.98921 4.185227 -3.375389      6.210153 
1 1 1 -11 11 31 o 57.83461 3.451085 41.02615       4.841723 43.25502       7.142302 39.13099       6.585947 59.18217 4.999056 56.29314 4.848131 2.889034       6.963830 
1 1 1 -11 11 32 o 131.1161 3.628357 210.4496       11.58202 208.5491       14.25235 214.1451       19.87420 130.3602 4.493193 131.6750 6.211206 -1.314804      7.666020 
1 1 1 -11 11 33 o 102.6440 3.374097 128.9974       8.428238 136.6822       14.16599 124.7866       10.48610 105.2350 5.543512 100.8040 4.278476 4.431000       7.002563 
1 1 1 -11 11 34 o 121.9792 3.075194 182.0833       9.133724 180.7469       13.18823 183.3152       12.66191 121.2372 4.471561 122.1480 4.260319 -0.9108276     6.176178 
1 1 1 -11 11 35 o 106.3866 3.626783 138.9152       9.388779 135.1209       11.51937 146.4235       16.20429 104.7097 4.525140 108.4969 6.154049 -3.787163      7.638666 
1 1 1 -11 11 36 o 51.67645 3.813242 32.98444       4.768186 39.60593       6.998024 27.24655       6.514389 56.35947 5.152260 46.47976 5.882973 9.879715       7.820177 
1 1 1 -11 11 37 f 28.72188 6.281098 10.71836       4.273529 9.656864       5.263856 12.77085       7.319585 27.17935 7.634373 31.08259 9.090348 -3.903234      11.87089 
1 1 1 -11 11 38 o 58.53165 3.447427 42.34045       4.895471 46.31903       7.151132 38.83149       6.715837 60.81617 4.865808 55.60591 5.009797 5.210255       6.983849 
1 1 1 -11 11 39 o 58.11656 4.339134 42.27447       6.100888 43.94269       12.36678 41.73788       7.013781 56.76310 9.259240 57.47336 5.059422 -0.7102585     10.55136 
1 1 1 -11 11 40 f 76.42253 3.959677 72.99927       7.349092 91.99787       15.38587 67.38345       8.365033 83.06128 7.688534 73.02681 4.725935 10.03447       9.024856 
1 1 1 -11 11 41 o 23.68742 6.361794 7.614858       3.749636 9.334204       5.258163 5.835883       5.348565 25.90969 7.737856 21.72741 7.861395 4.182283       11.03068 
1 1 1 -11 11 42 o 26.01478 6.148805 9.312754       3.836004 8.524235       5.514701 10.05194       5.339403 24.50729 8.017648 26.41869 7.774247 -1.911402      11.16788 
1 1 1 -11 11 43 o 24.51514 6.604078 8.599318       4.033242 9.368040       5.767662 7.863690       5.642140 24.98179 8.200995 23.26343 8.108299 1.718361       11.53260 
1 1 1 -11 11 44 o 39.41712 4.722581 20.78238       4.446092 19.73484       6.130613 21.94462       6.457566 36.42441 7.162154 38.46712 7.151969 -2.042706      10.12162 
1 1 1 -11 11 45 o 25.25640 7.095606 9.929600       4.546658 8.262401       5.527042 13.41929       7.996364 22.63731 8.014377 26.86451 9.626026 -4.227192      12.52560 
1 1 1 -11 11 46 o 28.19126 7.076712 12.71616       4.853669 18.25941       6.190419 3.870627       7.819880 33.16589 7.792399 18.99132 8.438094 14.17456       11.48577 
1 1 1 -11 11 47 o 22.84867 6.725840 8.617734       3.995865 13.84286       5.995753 4.442539       5.359616 27.13684 8.297265 17.69484 7.407603 9.441998       11.12282 
1 1 1 -11 11 48 o 17.03767 6.683613 4.625959       4.046932 14.13168       6.286334 -2.101752      5.288573 25.99648 8.563210 13.04974 6.189298 12.94673       10.56579 
1 1 1 -11 11 49 o 20.41603 7.273393 8.056556       4.558661 6.711510       8.815971 8.547457       5.325973 18.31453 8.455290 20.34272 7.750466 -2.028191      11.47003 
1 1 1 -11 12 1  o 471.3183 5.684182 2709.290       65.28574 2605.961       90.04939 2823.781       94.78880 462.0241 7.997975 480.9354 8.087871 -18.91132      11.37459 
1 1 1 -11 12 2  o 210.6988 3.618637 541.1242       18.57990 543.8632       36.67463 540.1785       21.55009 210.9940 7.143092 210.5006 4.201066 0.4933624      8.286901 
1 1 1 -11 12 3  o 265.5698 4.880126 859.9296       31.58245 792.3314       52.14680 899.0888       39.68965 254.6067 8.416259 271.5013 5.998866 -16.89467      10.33537 
1 1 1 -11 12 4  o 299.2375 6.628361 1092.422       48.33463 1081.657       67.58321 1103.693       69.15484 297.4285 9.335945 300.4321 9.457611 -3.003601      13.28933 
1 1 1 -11 12 5  o 326.0948 5.770291 1296.931       45.85405 1275.087       78.84361 1308.096       56.36724 322.8647 10.03315 327.4159 7.064656 -4.551208      12.27084 
1 1 1 -11 12 6  o 208.9619 4.123335 532.3058       20.99673 523.3972       36.34559 536.7682       25.72337 206.9721 7.217203 209.8098 5.031135 -2.837708      8.797746 
1 1 1 -11 12 7  o 373.4195 6.493899 1701.249       59.09335 1602.601       98.99597 1755.857       73.65533 361.7874 11.24230 379.2401 7.969918 -17.45267      13.78075 
1 1 1 -11 12 8  o 84.88682 2.845684 87.92013       5.878257 96.28583       9.197043 82.14244       7.643181 88.76674 4.264164 81.99796 3.835661 6.768784       5.735450 
1 1 1 -11 12 9  o 514.0901 6.740686 3225.255       84.44608 3099.796       130.3648 3315.956       110.8452 503.4082 10.62684 520.9929 8.730697 -17.58475      13.75336 
1 1 1 -11 12 10 o 271.5419 4.352586 899.0498       28.80185 916.7043       41.76247 883.0363       39.77415 274.0931 6.252476 269.0240 6.066997 5.069092       8.712171 
1 1 1 -11 12 11 o 376.0921 6.552918 1726.403       60.05719 1752.062       105.9189 1714.245       72.91060 378.0267 11.51121 374.6089 7.986867 3.417786       14.01064 
1 1 1 -11 12 12 o 47.03803 3.542039 27.12653       4.030289 28.91511       6.762054 26.14111       5.019209 48.32598 5.861677 46.07687 4.528534 2.249111       7.407218 
1 1 1 -11 12 13 o 96.82544 2.787487 114.3686       6.570315 121.5204       10.22487 109.3386       8.575004 99.73533 4.216515 94.62435 3.726019 5.110977       5.626919 
1 1 1 -11 12 14 o 317.1814 5.664263 1227.904       43.78116 1223.298       76.36470 1230.159       53.43506 315.8729 9.933090 317.3402 6.909794 -1.467346      12.10006 
1 1 1 -11 12 15 o 165.8881 3.198595 335.5060       12.93036 334.7198       18.86588 336.2025       17.75703 165.5705 4.680521 165.9576 4.394601 -0.3871002     6.420264 
1 1 1 -11 12 16 o 454.5285 7.799663 2527.467       86.39190 2544.422       106.7436 2495.271       147.0900 455.5728 9.614974 449.6475 13.43886 5.925354       16.52425 
1 1 1 -11 12 17 o 225.8613 3.821151 622.2504       21.03158 627.2946       30.40893 617.6250       29.11927 226.6414 5.505868 224.9054 5.313057 1.736038       7.651350 
1 1 1 -11 12 18 o 315.8845 4.917765 1218.268       37.85578 1212.400       53.90109 1223.981       53.17854 314.7910 7.026501 316.3144 6.898923 -1.523376      9.847175 
1 1 1 -11 12 19 o 382.3690 5.787819 1786.982       53.93040 1781.967       76.62576 1791.905       75.91740 381.2231 8.248204 382.3135 8.148649 -1.090332      11.59454 
1 1 1 -11 12 20 o 240.8960 4.677149 708.6445       27.45661 700.1024       33.57837 725.8792       47.69569 239.3031 5.758045 243.1470 8.060739 -3.843918      9.906089 
1 1 1 -11 12 21 o 231.2509 4.554929 653.0690       25.66854 669.9507       32.05116 622.8768       42.86308 234.0823 5.618742 225.2120 7.821960 8.870285       9.630852 
1 1 1 -11 12 22 o 174.1610 3.289593 370.0539       13.96141 367.3824       20.23005 372.4834       19.29214 173.3408 4.793771 174.5722 4.538766 -1.231445      6.601563 
1 1 1 -11 12 23 o 82.36111 3.113710 82.87319       6.238118 94.42367       11.23917 77.73072       7.499290 87.71549 5.282493 79.70075 3.872787 8.014740       6.550055 
1 1 1 -11 12 24 o 405.2428 7.078372 2015.273       69.90122 1976.105       85.02540 2096.949       122.7819 400.5541 8.710668 410.2718 12.29467 -9.717743      15.06767 
1 1 1 -11 12 25 o 236.6349 3.994662 683.9739       23.03536 679.7294       32.93862 688.0369       32.22688 235.5901 5.737363 237.0583 5.578622 -1.468201      8.002397 
1 1 1 -11 12 26 o 240.7472 4.048020 708.1769       23.74871 680.2198       33.38757 736.8079       33.78751 235.5981 5.815366 245.2407 5.653631 -9.642670      8.110612 
1 1 1 -11 12 27 o 136.5936 4.336842 228.3593       14.41748 240.5346       22.69555 220.1216       18.66819 139.7669 6.682829 133.8787 5.735380 5.888199       8.806520 
1 1 1 -11 12 28 o 208.9478 3.710258 533.4587       18.89200 516.9342       26.74488 549.9153       26.68987 205.3074 5.350201 211.8669 5.169483 -6.559494      7.439638 
1 1 1 -11 12 29 o 40.35386 3.978848 20.10252       3.861868 14.72340       5.893691 24.14984       5.112293 33.92069 7.343214 44.14634 4.830874 -10.22565      8.789774 
1 1 1 -11 12 30 o 119.3397 3.023343 174.0327       8.785340 176.0310       12.84100 172.2743       12.04579 119.8300 4.404906 118.5796 4.175106 1.250473       6.069160 
1 1 1 -11 12 31 o 156.6445 3.826404 300.1887       14.60637 289.5826       17.77433 322.2471       25.63318 153.6119 4.753959 161.5499 6.524602 -7.938019      8.072828 
1 1 1 -11 12 32 o 137.8104 3.139222 232.1157       10.54242 221.9041       15.06150 241.9245       14.76148 134.4306 4.604425 140.4349 4.318523 -6.004303      6.312716 
1 1 1 -11 12 33 o 28.14253 6.385628 10.17105       4.278486 8.367161       6.731879 11.39347       5.541688 26.51805 8.865624 29.71415 7.618042 -3.196098      11.68905 
1 1 1 -11 12 34 o 66.07565 3.997463 53.74911       6.406573 56.46861       7.920120 48.60157       10.89649 67.57392 4.841773 62.04865 7.348901 5.525269       8.800517 
1 1 1 -11 12 35 o 93.78518 3.067937 107.7990       7.002159 103.1791       10.11745 112.0462       9.700783 91.42908 4.555339 95.38009 4.183799 -3.951012      6.185086 
1 1 1 -11 12 36 o 40.78898 4.400102 20.74784       4.304502 15.48955       6.111257 25.92510       6.063988 34.42673 7.497351 45.35643 5.605519 -10.92970      9.361202 
1 1 1 -11 12 37 o 91.58031 3.551080 103.3732       7.909969 98.34512       9.793458 112.8080       13.41531 89.00203 4.530342 94.76991 5.837228 -5.767876      7.388994 
1 1 1 -11 12 38 o 11.25487 5.222614 -2.818324      3.427754 -1.122640      5.081376 -4.234258      4.643338 15.52487 6.854625 12.79704 5.984853 2.727827       9.099689 
1 1 1 -11 12 39 o 12.39895 5.777379 -3.580182      4.262832 -6.804286      9.096848 -2.672986      4.825442 17.98336 8.399399 13.96482 6.375784 4.018542       10.54517 
1 1 1 -11 12 40 o 49.47402 3.830107 30.70293       4.581748 32.75587       6.653264 28.85120       6.318805 50.36597 5.510611 47.19245 5.603749 3.173519       7.859315 
1 1 1 -11 12 41 o 21.32072 6.495762 6.122718       3.679097 7.550127       5.158558 4.645003       5.248671 23.53762 7.757328 20.27365 7.701148 3.263968       10.93087 
1 1 1 -11 12 42 o 19.51103 6.883753 4.918614       4.074768 -1.267414      6.324292 9.309306       5.328100 16.48820 7.436562 25.33806 7.835248 -8.849854      10.80248 
1 1 1 -11 12 43 o 57.83319 3.751518 42.82191       5.258604 43.57018       7.434711 42.07280       7.438867 56.87827 5.429730 55.77288 5.546720 1.105396       7.761963 
1 1 1 -11 12 44 o 33.92224 5.364353 15.92016       4.287145 9.241732       5.774793 24.12043       6.399022 24.02262 8.210572 40.64029 6.694185 -16.61766      10.59366 
1 1 1 -11 12 45 o 14.62375 6.451151 0.5862945      4.491518 4.273849       5.472229 -7.026796      7.862768 18.49446 7.589602 14.70053 7.119775 3.793930       10.40640 
1 1 1 -11 12 46 o 33.81300 6.386661 17.46446       5.069697 11.38162       6.266720 28.98552       8.624486 24.72209 8.549301 39.81628 9.089351 -15.09419      12.47826 
1 1 1 -11 12 47 o 11.43967 5.375037 -2.039824      3.820194 -4.419865      5.928011 -0.3493918     4.995922 12.95178 6.250633 13.89852 6.397981 -0.9467335     8.944528 
1 1 1 -11 12 48 o 18.12763 6.851665 5.665433       4.142305 6.309403       6.436860 5.210235       5.411794 18.53662 7.952457 17.64578 7.418923 0.8908348      10.87575 
1 1 1 -11 12 49 o 15.79600 6.728700 3.685128       4.549423 5.303755       8.888337 3.110547       5.295694 17.62026 8.253416 15.63918 6.946586 1.981081       10.78767 
1 1 1 -11 13 1  o 140.4453 3.320911 240.4315       11.36581 259.4983       20.18211 231.5758       13.75430 145.7414 5.693557 137.7593 4.101714 7.982101       7.017168 
1 1 1 -11 13 2  o 98.90484 2.656633 119.3057       6.397227 115.2975       8.985452 123.4258       9.109922 97.17752 3.801690 100.5536 3.724192 -3.376068      5.321884 
1 1 1 -11 13 3  f 310.2472 5.544182 1174.037       41.91615 1070.142       68.66464 1235.750       52.92064 295.7427 9.540072 318.2100 6.824567 -22.46735      11.72978 
1 1 1 -11 13 4  o 386.0680 5.863762 1818.228       55.16660 1769.959       76.56413 1870.344       79.55660 380.6880 8.253157 391.3246 8.342629 -10.63663      11.73516 
1 1 1 -11 13 5  o 190.5724 3.411968 442.6926       15.84532 409.6991       30.35792 455.0468       18.57651 183.0961 6.815780 193.2000 3.945671 -10.10391      7.875480 
1 1 1 -11 13 6  o 280.7407 4.010571 960.8737       27.43770 916.4747       42.58962 992.3754       35.87434 274.0577 6.377136 285.2518 5.160828 -11.19415      8.203780 
1 1 1 -11 13 7  o 180.3720 3.348701 396.5741       14.71911 394.5880       21.33298 398.3786       20.33480 179.8123 4.873001 180.6891 4.621986 -0.8767700     6.716316 
1 1 1 -11 13 8  f 385.9658 5.211634 1817.025       49.01836 1752.835       76.18779 1862.365       64.03112 378.7867 8.253812 390.6148 6.726766 -11.82806      10.64776 
1 1 1 -11 13 9  o 250.4486 3.682293 764.6898       22.47362 754.1566       35.75330 771.5698       28.89571 248.6090 5.901510 251.5279 4.714234 -2.918884      7.553266 
1 1 1 -11 13 10 f 143.4025 2.709881 250.6451       9.469844 264.7857       15.97404 242.9824       11.75896 147.2845 4.455755 141.1800 3.417903 6.104553       5.615676 
1 1 1 -11 13 11 o 197.2873 3.511376 474.5227       16.88156 479.0319       35.23477 473.1792       19.23273 197.8958 7.318930 196.9905 4.006448 0.9053192      8.343761 
1 1 1 -11 13 12 o 216.8211 3.732789 573.2168       19.72291 589.0042       28.86403 559.3896       27.01274 219.7016 5.391228 214.1196 5.176975 5.582031       7.474383 
1 1 1 -11 13 13 o 249.7683 4.106793 760.8349       24.99633 758.1744       35.85050 763.3519       34.87017 249.2060 5.903379 250.0701 5.722109 -0.8641510     8.221461 
1 1 1 -11 13 14 o 128.6902 2.931736 201.8958       9.194044 201.9296       13.71455 201.8683       12.39068 128.5846 4.383208 128.5927 3.958771 -0.8132935E-02 5.906300 
1 1 1 -11 13 15 o 269.5907 4.999221 887.0703       32.84304 833.4058       55.50199 915.9872       40.74187 260.7059 8.748572 273.8347 6.105432 -13.12875      10.66836 
1 1 1 -11 13 16 o 205.4594 4.188570 515.0373       20.97142 486.3443       25.40212 576.4542       37.16433 199.5117 5.229258 216.9878 7.037683 -17.47607      8.767789 
1 1 1 -11 13 17 o 90.04662 2.795892 98.95654       6.127697 96.10369       9.323912 101.1256       8.130002 88.63584 4.329809 90.97621 3.674695 -2.340370      5.678964 
1 1 1 -11 13 18 o 102.7769 2.795614 128.8938       6.995285 135.3424       10.70963 124.0953       9.238292 105.2254 4.184898 100.7830 3.768198 4.442429       5.631402 
1 1 1 -11 13 19 o 79.80072 3.417591 77.82561       6.630650 81.31899       8.534675 72.50657       10.53127 81.50491 4.312363 76.81040 5.666212 4.694511       7.120564 
1 1 1 -11 13 20 o 296.9677 5.471201 1078.028       39.59387 1092.472       49.06913 1051.075       67.03007 298.7006 6.741183 292.1566 9.427290 6.544067       11.58954 
1 1 1 -11 13 21 o 425.0871 6.374558 2212.159       66.03347 2214.510       93.99567 2209.868       92.78693 424.2790 9.091179 423.8821 8.982673 0.3968811      12.78037 
1 1 1 -11 13 22 o 149.4865 3.477470 272.6936       12.66780 259.6345       21.83278 279.3213       15.55362 145.4951 6.171805 151.1784 4.226024 -5.683304      7.480004 
1 1 1 -11 13 23 o 220.8708 3.810349 595.6094       20.50875 627.9324       30.37463 568.5275       27.80317 226.5365 5.502204 215.5886 5.292153 10.94788       7.634208 
1 1 1 -11 13 24 o 250.2085 4.152923 764.7877       25.32165 767.5766       36.44490 762.1848       35.20758 250.3164 5.974636 249.4761 5.791233 0.8402405      8.320736 
1 1 1 -11 13 25 o 41.70174 4.185991 21.46254       4.196446 18.88551       5.779078 24.33708       6.103549 38.74834 6.339254 44.19668 5.807423 -5.448338      8.597227 
1 1 1 -11 13 26 o 84.21260 3.424807 86.73416       7.013621 86.24232       14.29722 86.89003       8.048605 83.46033 7.096922 84.23830 3.931648 -0.7779770     8.113209 
1 1 1 -11 13 27 o 50.03804 3.924373 30.78621       4.747011 29.31147       6.448153 32.53117       7.014067 48.59135 5.544645 51.19436 5.719902 -2.603004      7.966201 
1 1 1 -11 13 28 o 106.2848 2.937033 137.9997       7.599752 130.9530       10.94177 144.5677       10.56355 103.3706 4.353393 108.6682 3.995872 -5.297600      5.909232 
1 1 1 -11 13 29 o 139.6400 3.124269 238.1348       10.63150 240.1272       15.57970 236.3984       14.54408 139.9661 4.573870 138.9218 4.301334 1.044266       6.278675 
1 1 1 -11 13 30 o 80.27672 3.762417 78.98277       7.339774 80.77399       9.101397 75.65106       12.41275 81.06380 4.626494 78.08672 6.584404 2.977089       8.047287 
1 1 1 -11 13 31 f 137.7067 3.136820 231.7306       10.52643 233.3876       15.46519 230.3003       14.36847 137.8902 4.608891 137.0378 4.307980 0.8523712      6.308769 
1 1 1 -11 13 32 o 54.75752 3.657164 36.85616       4.852075 39.33783       7.228405 34.82095       6.545979 56.31213 5.330970 52.98714 5.133778 3.324989       7.401008 
1 1 1 -11 13 33 o 99.20354 3.351669 120.5717       8.090964 125.9096       13.91203 117.8434       9.946004 100.8679 5.682788 97.92475 4.177525 2.943138       7.053070 
1 1 1 -11 13 34 o 39.50695 5.343309 19.60168       5.012470 26.23351       6.534601 10.12156       7.812840 45.64803 6.021039 28.78516 9.549071 16.86287       11.28883 
1 1 1 -11 13 35 o 19.13665 6.530528 4.236556       3.653032 3.621187       5.304570 4.791644       5.038061 20.15762 7.721363 21.14226 7.632480 -0.9846363     10.85699 
1 1 1 -11 13 36 o 66.18581 3.351891 53.92912       5.388584 45.30273       7.779954 61.88327       7.470669 60.14885 5.364012 70.66833 4.359310 -10.51948      6.912034 
1 1 1 -11 13 37 o 22.96107 6.275456 6.863019       3.610816 11.81175       5.561943 3.257909       4.747216 29.82249 7.624652 18.96130 7.293900 10.86119       10.55160 
1 1 1 -11 13 38 o 60.12706 4.126717 45.07949       6.009928 62.51409       13.05809 40.39385       6.769526 68.91642 7.919106 56.61301 4.956841 12.30341       9.342512 
1 1 1 -11 13 39 o 13.60696 6.143612 -1.851587      4.329728 -6.129715      8.121588 -0.1529220     5.117618 16.98777 7.935051 16.13586 7.007001 0.8519096      10.58599 
1 1 1 -11 13 40 o 20.66867 6.667635 5.577649       3.821327 8.039434       5.409967 3.126382       5.398396 24.38392 7.938792 19.07825 7.643317 5.305670       11.02020 
1 1 1 -11 13 41 o 22.21343 6.675081 6.769632       3.903867 10.26842       5.487732 3.184956       5.554679 26.77142 7.882410 19.01454 7.705173 7.756884       11.02280 
1 1 1 -11 13 42 o 16.28225 6.598469 2.255353       4.073965 5.889662       6.549422 -0.3835447E-01 5.203086 21.75966 8.512428 15.75079 6.946065 6.008871       10.98678 
1 1 1 -11 13 43 o 16.91112 6.632167 3.175540       3.983949 10.56597       5.540416 -4.737103      5.732819 26.06587 7.977167 13.55040 6.431766 12.51547       10.24709 
1 1 1 -11 13 44 o 44.47203 4.409033 26.31615       4.715384 21.18217       6.522142 31.93850       6.825303 37.11723 7.469616 47.37092 6.050464 -10.25369      9.612662 
1 1 1 -11 13 45 o 24.56544 8.465722 10.61306       6.142787 10.61306       6.142787 0.000000       0.000000 24.56544 8.465722 ?        ?        0.000000       8.465722 
1 1 1 -11 13 46 o 26.67916 6.624242 11.34672       4.286843 6.249527       6.431497 15.42167       5.750523 19.64615 8.160878 29.81851 7.819111 -10.17237      11.30214 
1 1 1 -11 13 47 o 14.06711 6.110031 1.585851       3.893080 1.185951       5.847140 1.904295       5.217753 15.38176 7.021052 15.38656 6.861043 -0.4796982E-02 9.816775 
1 1 1 -11 13 48 o 19.27977 6.829550 6.647238       4.014108 7.693198       5.958249 5.777942       5.431815 19.49712 7.950650 17.97005 7.485133 1.527071       10.91971 
1 1 1 -11 14 1  o 268.2228 3.858886 877.1559       25.22283 873.5715       39.61414 879.5999       32.71015 267.5471 6.075946 268.5378 4.998515 -0.9906616     7.867800 
1 1 1 -11 14 2  o 278.1151 3.652453 942.9740       24.75399 963.1008       35.58870 924.1105       34.45374 280.9864 5.197455 275.2435 5.136688 5.742828       7.307469 
1 1 1 -11 14 3  o 75.56741 3.185282 69.73147       5.852527 63.00050       8.162620 76.85241       8.395748 71.72047 4.696194 79.26804 4.363184 -7.547569      6.410274 
1 1 1 -11 14 4  o 210.3496 3.297630 539.3696       16.90362 531.9143       26.95052 544.2045       21.70329 208.7487 5.302234 211.2599 4.215726 -2.511215      6.773923 
1 1 1 -11 14 5  o 302.6719 4.761716 1117.288       35.12139 1116.231       50.10743 1118.309       49.24216 302.3787 6.800093 302.6707 6.676220 -0.2919312     9.529595 
1 1 1 -11 14 6  o 131.3535 2.686863 210.2928       8.600492 203.2258       14.05025 214.5275       10.87621 129.0146 4.475766 132.6150 3.368221 -3.600418      5.601552 
1 1 1 -11 14 7  o 381.3034 5.166313 1773.628       48.00511 1733.064       75.24778 1801.467       62.33870 376.5791 8.199765 384.1337 6.659463 -7.554657      10.56336 
1 1 1 -11 14 8  o 230.3326 3.487055 646.7878       19.57268 662.8707       31.85470 637.0334       24.80800 233.0745 5.608447 228.5485 4.454278 4.526047       7.162071 
1 1 1 -11 14 9  f 163.6153 2.879345 326.3089       11.48031 326.6974       18.74190 326.0756       14.52407 163.5900 4.706220 163.5369 3.644489 0.5311584E-01  5.952378 
1 1 1 -11 14 10 o 309.2501 4.839901 1166.682       36.47392 1217.046       75.85692 1151.536       41.59812 315.0961 9.891321 307.1771 5.557108 7.919037       11.34547 
1 1 1 -11 14 11 f 265.3587 3.854743 858.6786       24.92670 863.9597       40.00292 855.3266       31.87050 266.0023 6.171209 264.7703 4.939507 1.231995       7.904591 
1 1 1 -11 14 12 o 136.3769 2.679593 226.7120       8.905242 235.2639       14.89874 221.9584       11.10786 138.8045 4.410232 134.8801 3.382120 3.924408       5.557776 
1 1 1 -11 14 13 o 92.01886 2.858864 103.3261       6.402939 99.92152       9.720877 105.9352       8.509748 90.39215 4.426508 93.12463 3.757585 -2.732483      5.806326 
1 1 1 -11 14 14 o 288.5739 4.600338 1016.201       32.35063 1026.922       46.61158 1006.236       44.93583 289.8597 6.598873 286.9485 6.426176 2.911163       9.210910 
1 1 1 -11 14 15 o 78.61747 3.374923 75.51456       6.450693 72.56973       8.509713 79.49259       9.890525 76.97765 4.556817 80.53239 5.065452 -3.554741      6.813471 
1 1 1 -11 14 16 o 341.7202 5.267261 1426.212       43.86231 1457.662       63.44771 1397.423       60.70453 345.0345 7.546009 337.8674 7.372907 7.167145       10.54998 
1 1 1 -11 14 17 o 288.0919 5.267156 1013.899       36.97799 1011.110       64.59270 1015.259       45.09956 286.7754 9.254961 288.1032 6.423742 -1.327820      11.26582 
1 1 1 -11 14 18 o 356.4038 6.351049 1554.018       55.15997 1595.492       68.92625 1480.144       91.98953 360.7453 7.840575 346.2949 10.91437 14.45035       13.43868 
1 1 1 -11 14 19 o 279.7995 5.246762 956.7289       35.77457 983.9492       44.77293 908.6643       59.49523 283.5313 6.480052 271.7557 8.996351 11.77554       11.08717 
1 1 1 -11 14 20 o 282.5351 4.534262 974.9536       31.21872 935.7429       43.70486 1015.803       44.60889 276.4515 6.487460 288.0635 6.354730 -11.61197      9.081284 
1 1 1 -11 14 21 o 142.3356 3.051076 247.1377       10.58285 245.7082       15.60725 248.3544       14.39855 141.7530 4.523916 142.5552 4.149176 -0.8021851     6.138524 
1 1 1 -11 14 22 o 36.46781 4.378731 16.47853       3.813558 21.68466       7.414909 14.60617       4.446755 41.38001 7.634439 34.12053 5.537680 7.259483       9.431360 
1 1 1 -11 14 23 o 77.32006 2.881538 73.03403       5.419912 76.33973       8.527947 70.79399       7.020046 78.91351 4.452690 76.04892 3.800047 2.864594       5.853786 
1 1 1 -11 14 24 o 17.29032 5.907227 3.357613       2.989152 3.246246       5.025303 3.418590       3.718505 19.66055 7.519248 18.23261 6.560421 1.427942       9.978888 
1 1 1 -11 14 25 o 35.60690 4.904306 15.80166       4.142563 13.91949       9.065021 16.29847       4.657310 33.41973 10.19917 36.07897 5.468377 -2.659233      11.57265 
1 1 1 -11 14 26 o 196.2384 5.108554 471.8646       24.40893 460.8701       36.32340 480.9172       32.96006 193.2392 7.729157 197.6721 6.852735 -4.432831      10.32956 
1 1 1 -11 14 27 o 82.44837 3.035250 83.09675       6.087945 78.88598       8.979329 86.67905       8.282176 80.15501 4.616558 84.10415 4.052949 -3.949142      6.143208 
1 1 1 -11 14 28 o 90.68027 2.988658 100.5016       6.595253 108.0243       10.03618 94.78380       8.749782 93.85183 4.400486 87.93897 4.094242 5.912857       6.010581 
1 1 1 -11 14 29 o 78.18728 3.798608 74.92889       7.215978 77.05920       8.844604 70.68808       12.47907 79.18549 4.603341 75.42529 6.864494 3.760201       8.265109 
1 1 1 -11 14 30 o 56.29190 3.509973 38.89185       4.790926 34.63501       7.197732 42.27807       6.419619 52.78068 5.685672 58.56491 4.533441 -5.784229      7.271791 
1 1 1 -11 14 31 o 57.61135 3.559065 40.75428       4.972269 29.67520       7.310883 50.28981       6.782506 48.65701 6.314579 63.90546 4.381797 -15.24845      7.685965 
1 1 1 -11 14 32 o 102.6684 3.318477 129.0753       8.291643 134.3227       14.61990 126.5870       10.06736 104.2174 5.779259 101.5442 4.076694 2.673172       7.072430 
1 1 1 -11 14 33 f 50.69185 3.921040 31.69801       4.806053 34.33166       6.980318 29.32421       6.627007 52.46120 5.543863 48.39995 5.729700 4.061249       7.972695 
1 1 1 -11 14 34 o 101.7509 3.679227 127.1786       9.107838 133.8381       11.30294 114.8486       15.37976 104.1877 4.462165 95.80950 6.628116 8.378235       7.990171 
1 1 1 -11 14 35 o 66.55265 3.259295 54.45310       5.269898 59.62251       8.095483 50.65160       6.942249 69.29053 4.824520 63.92420 4.485010 5.366325       6.587208 
1 1 1 -11 14 36 o 40.14963 4.968097 20.30692       4.757190 21.24514       6.372189 19.12560       7.150191 40.57586 6.676440 38.04423 7.968174 2.531631       10.39551 
1 1 1 -11 14 37 o 32.58341 6.246677 13.82962       4.779562 16.99274       9.670186 12.80711       5.498074 35.07308 10.49801 31.02606 7.379927 4.047026       12.83244 
1 1 1 -11 14 38 o 75.74063 3.846870 71.35167       7.076980 74.70191       14.39896 70.28461       8.126223 75.06226 7.994665 74.90378 4.472300 0.1584778      9.160575 
1 1 1 -11 14 39 o 56.70999 3.704191 40.18417       5.091028 49.20644       7.807694 33.51082       6.714858 62.05480 5.211205 51.00442 5.488766 11.05038       7.568567 
1 1 1 -11 14 40 o 48.60802 3.863089 29.80259       4.538311 32.38009       6.808053 27.74123       6.088364 49.70971 5.724524 46.07906 5.532530 3.630653       7.961097 
1 1 1 -11 14 41 o 13.56048 5.914351 -0.9346033E-01 3.679563 5.767364       5.427336 -5.078812      5.005589 21.30164 7.884758 12.61825 5.995272 8.683393       9.905186 
1 1 1 -11 14 42 o 18.50443 6.661813 4.425953       3.834934 2.649061       5.249258 6.459911       5.616145 17.78055 7.378200 21.67676 8.021259 -3.896210      10.89855 
1 1 1 -11 14 43 o 60.52740 3.810123 47.33926       5.591368 45.10203       7.867172 49.62282       7.948227 57.08479 5.732913 60.20022 5.477895 -3.115437      7.929289 
1 1 1 -11 14 44 o 32.99806 5.886102 15.63431       4.559540 14.53867       6.283082 16.85318       6.626979 29.42611 8.366865 31.73276 8.428423 -2.306644      11.87614 
1 1 1 -11 14 45 o 33.03877 6.618632 16.76090       5.142902 16.34097       6.430503 17.50626       8.567062 30.49256 8.390998 28.98356 9.997238 1.508997       13.05196 
1 1 1 -11 14 46 o 18.46429 6.813634 5.427866       4.047491 1.542204       5.972087 8.728882       5.504495 16.01064 7.223358 21.82121 7.963457 -5.810577      10.75144 
1 1 1 -11 14 47 o 20.30961 7.570163 7.727919       5.019224 9.853791       6.385133 4.289824       8.120079 21.64450 8.422880 17.86308 8.198665 3.781414       11.75428 
1 1 1 -11 14 48 o 13.43426 6.105582 0.6197543      4.361490 -5.862465      9.012819 2.601943       4.983923 14.37608 7.097515 15.26373 6.761577 -0.8876410     9.802736 
1 1 1 -11 15 1  f 295.7662 4.174424 1066.829       30.08716 1082.948       47.82909 1056.274       38.70427 297.7919 6.590877 294.2102 5.398400 3.581665       8.519529 
1 1 1 -11 15 2  o 285.9542 4.542692 997.3616       31.65526 955.6229       61.20712 1012.602       36.98584 279.3369 9.003371 288.0788 5.268513 -8.741913      10.43158 
1 1 1 -11 15 3  o 214.2365 3.799173 559.6372       19.83438 526.2046       27.23369 597.4022       28.94452 207.5934 5.387958 221.2674 5.368004 -13.67400      7.605627 
1 1 1 -11 15 4  o 396.2839 5.982957 1916.885       57.77746 1807.251       79.11678 2042.169       84.57543 384.4438 8.445001 408.6586 8.492733 -24.21487      11.97683 
1 1 1 -11 15 5  f 263.8100 3.856489 848.6235       24.79244 895.8397       40.81082 821.0059       31.21208 270.8898 6.182249 259.4194 4.937239 11.47040       7.911797 
1 1 1 -11 15 6  f 158.2769 2.874995 305.3701       11.08896 292.6497       17.75170 313.5100       14.20044 154.8184 4.710713 160.3522 3.634049 -5.533798      5.949549 
1 1 1 -11 15 7  o 348.8480 4.801889 1484.601       40.82107 1453.370       64.08887 1505.922       52.95184 344.8383 7.626602 351.2022 6.187109 -6.363922      9.820661 
1 1 1 -11 15 8  o 323.5334 4.511105 1276.826       35.56626 1205.715       54.70512 1328.891       46.80939 314.1292 7.146339 329.9407 5.821850 -15.81155      9.217598 
1 1 1 -11 15 9  o 303.2365 4.785139 1121.875       35.36000 1134.230       50.92944 1110.377       49.13216 304.6890 6.859240 301.4884 6.687427 3.200562       9.579711 
1 1 1 -11 15 10 o 481.6842 8.230152 2838.773       96.60651 2850.680       168.8549 2832.979       117.7891 480.4253 14.43926 480.7029 10.05524 -0.2776794     17.59546 
1 1 1 -11 15 11 o 307.7708 4.330286 1155.566       32.47731 1163.213       52.06747 1150.696       41.55125 308.4923 6.926056 306.9999 5.554050 1.492432       8.877934 
1 1 1 -11 15 12 o 191.3437 3.130920 446.4115       14.59897 435.9064       23.46628 453.0446       18.64688 188.9021 5.102336 192.7194 3.970494 -3.817291      6.465188 
1 1 1 -11 15 13 f 176.6994 2.993598 380.6919       12.89035 382.3283       21.02798 379.7068       16.31534 176.9114 4.882260 176.4340 3.794702 0.4774017      6.183545 
1 1 1 -11 15 14 o 207.8808 3.675875 527.1321       18.62136 519.9612       26.84685 533.7806       25.85054 206.2652 5.345613 209.0823 5.073602 -2.817093      7.370008 
1 1 1 -11 15 15 o 58.30501 3.759027 41.64454       5.312476 42.12836       7.230532 41.07697       7.831335 58.51032 5.122716 57.70818 5.640754 0.8021469      7.619733 
1 1 1 -11 15 16 o 188.0838 3.478890 431.5314       15.94514 451.3392       23.69638 415.1418       21.55506 192.1612 5.064762 184.3187 4.803016 7.842545       6.980027 
1 1 1 -11 15 17 o 124.3241 3.535414 188.7218       10.70017 183.9893       13.28706 197.4536       18.04845 122.6787 4.451891 126.9447 5.850035 -4.265991      7.351344 
1 1 1 -11 15 18 o 275.6313 5.122436 928.3223       34.40656 936.6877       60.35407 924.2947       41.87801 275.9146 8.988262 274.8416 6.252699 1.073029       10.94921 
1 1 1 -11 15 19 o 181.9032 3.420302 403.7161       15.16145 425.5277       22.68486 386.1073       20.38252 186.5430 4.994731 177.7220 4.710463 8.820938       6.865551 
1 1 1 -11 15 20 o 132.5267 3.030128 214.2451       9.785894 215.4467       14.59744 213.2643       13.18829 132.7284 4.519711 132.0968 4.101915 0.6316223      6.103565 
1 1 1 -11 15 21 o 278.0922 5.143047 945.6837       34.85342 924.0560       60.08027 956.6539       42.78934 273.7325 9.019091 279.4535 6.283332 -5.720978      10.99201 
1 1 1 -11 15 22 f 123.7337 2.966047 186.7854       8.943390 196.5907       13.58964 179.2944       11.87816 126.7654 4.405870 121.0945 4.030828 5.670944       5.971538 
1 1 1 -11 15 23 o 54.37745 3.297248 36.22266       4.348713 35.66637       6.937824 36.58268       5.581211 53.71605 5.372081 54.55396 4.231286 -0.8379059     6.838351 
1 1 1 -11 15 24 o 137.4170 3.069714 230.4575       10.27956 233.8440       15.38639 227.7273       13.81519 138.2117 4.574616 136.4455 4.159768 1.766159       6.183104 
1 1 1 -11 15 25 o 84.02795 3.364426 86.34914       6.875304 97.33061       15.03831 83.44726       7.730523 88.70193 7.014178 82.55356 3.853336 6.148369       8.002930 
1 1 1 -11 15 26 o 191.6659 4.081481 449.1153       19.06333 472.3455       24.65649 414.5918       30.05814 196.2967 5.158919 183.5020 6.733212 12.79471       8.482369 
1 1 1 -11 15 27 o 167.5604 3.355241 342.9393       13.70034 340.3416       19.91608 345.2728       18.87613 166.6200 4.910374 167.8826 4.618317 -1.262604      6.740966 
1 1 1 -11 15 28 o 23.10941 8.037743 5.941968       5.542844 5.941968       5.542844 0.000000       0.000000 23.10941 8.037743 ?        ?        0.000000       8.037743 
1 1 1 -11 15 29 o 88.38056 3.062413 95.52687       6.585668 101.1851       9.998616 91.19126       8.752387 90.76778 4.534711 86.21033 4.178558 4.557442       6.166357 
1 1 1 -11 15 30 o 106.3932 3.053605 138.4211       7.908847 125.8524       11.47397 149.7980       10.91644 101.1957 4.665365 110.5325 4.059696 -9.336777      6.184396 
1 1 1 -11 15 31 o 178.3964 3.486785 389.3562       15.15819 384.9218       21.97530 393.3812       20.93626 176.8960 5.103109 178.9263 4.805982 -2.030304      7.009935 
1 1 1 -11 15 32 o 52.98201 3.962072 34.60392       5.078442 37.90985       8.813139 32.96051       6.213804 54.90228 6.727685 51.51921 5.012701 3.383068       8.389811 
1 1 1 -11 15 33 o 72.16593 3.965407 64.10957       6.946781 65.20782       8.469316 61.85153       12.14398 72.60962 4.813677 70.05887 7.216252 2.550751       8.674433 
1 1 1 -11 15 34 o 39.89987 4.523087 19.86401       4.320381 14.54331       6.562734 23.93365       5.739554 33.28812 8.155468 43.61599 5.523721 -10.32787      9.850033 
1 1 1 -11 15 35 o 38.02236 4.487441 18.10085       4.077888 22.20008       6.360605 15.24007       5.313601 41.62461 6.481597 34.31213 6.594382 7.312481       9.246458 
1 1 1 -11 15 36 o 25.33675 7.925365 8.266214       5.434176 -1.703109      9.758890 12.74675       6.542334 21.38801 9.468694 30.86880 8.451354 -9.480793      12.69179 
1 1 1 -11 15 37 f 17.30288 6.364781 3.142881       3.527085 2.072320       5.375538 3.952195       4.673848 18.46629 7.543690 19.53689 7.300501 -1.070602      10.49784 
1 1 1 -11 15 38 o 26.96774 7.060201 9.809177       4.693353 20.48062       9.898955 6.714648       5.330588 37.57985 10.43777 23.06109 7.888300 14.51875       13.08329 
1 1 1 -11 15 39 o 40.13510 4.468696 20.53083       4.296568 23.57981       6.442047 18.08782       5.766460 42.09348 6.488404 36.66803 6.700176 5.425446       9.326937 
1 1 1 -11 15 40 o 16.62311 6.497388 2.633378       3.812980 6.609250       5.683793 -0.6201540     5.141615 22.53170 8.110406 15.51377 6.870260 7.017935       10.62917 
1 1 1 -11 15 41 o 17.45193 6.691394 3.361555       3.986364 9.853213       7.027492 0.2816644      4.840500 25.72658 9.043187 15.54466 6.781558 10.18192       11.30348 
1 1 1 -11 15 42 o 22.12584 6.880515 7.120698       4.102199 12.24919       5.918665 2.379476       5.690812 28.02732 8.167933 17.81710 7.555130 10.21022       11.12633 
1 1 1 -11 15 43 o 23.59536 6.736175 8.363232       4.064481 9.010348       5.968647 7.803666       5.550221 23.66686 8.332884 22.40628 8.020704 1.260578       11.56584 
1 1 1 -11 15 44 o 21.99719 7.357709 7.701324       4.636558 9.086489       5.742273 5.106540       7.859298 23.24668 8.174292 20.15007 8.716981 3.096611       11.95010 
1 1 1 -11 15 45 o 23.92933 6.868004 9.278596       4.214239 9.435431       6.103750 9.135726       5.825640 22.73810 8.371362 22.55433 8.198258 0.1837749      11.71713 
1 1 1 -11 15 46 o 10.57644 5.063804 -3.291868      3.716301 0.2088273      5.698143 -5.883135      4.902441 14.84618 6.833726 11.17257 5.458235 3.673614       8.745978 
1 1 1 -11 15 47 o 12.75969 5.767255 0.2296373      3.827510 -8.312816      6.005814 6.072106       4.966824 11.51974 5.706545 18.45013 7.351582 -6.930396      9.306472 
1 1 1 -11 16 1  f 173.6035 2.948725 367.4153       12.47466 370.7072       19.53500 365.1486       16.21022 174.2514 4.604493 173.0346 3.844324 1.216873       5.998348 
1 1 1 -11 16 2  o 216.5728 4.337549 572.1506       22.89204 556.3516       27.31366 609.4468       41.96599 213.5051 5.249712 223.1108 7.730320 -9.605667      9.344374 
1 1 1 -11 16 3  o 261.9205 3.867504 836.6339       24.68518 783.5917       37.89836 875.7203       32.53292 253.3088 6.139515 267.8894 4.983464 -14.58067      7.907500 
1 1 1 -11 16 4  o 457.8549 6.819624 2561.376       76.08944 2504.057       106.5155 2621.107       108.7321 452.0672 9.668829 462.5181 9.647017 -10.45087      13.65837 
1 1 1 -11 16 5  o 493.3435 6.526873 2973.200       78.46765 2949.457       123.7937 2989.147       101.4516 490.4120 10.35861 494.2415 8.423325 -3.829559      13.35115 
1 1 1 -11 16 6  o 274.5665 3.986390 919.4479       26.67248 871.4468       41.34171 953.6750       34.90988 267.1020 6.351483 279.5409 5.124682 -12.43884      8.161109 
1 1 1 -11 16 7  o 338.0321 4.687454 1394.208       38.61278 1359.375       60.52166 1418.120       50.14407 333.4287 7.448551 340.7620 6.038545 -7.333344      9.588792 
1 1 1 -11 16 8  o 113.2033 2.635214 156.2152       7.269610 153.7828       12.00928 157.6220       9.132990 112.1866 4.401326 113.6493 3.301191 -1.462685      5.501775 
1 1 1 -11 16 9  o 164.8523 3.760350 331.4522       15.10635 305.6159       26.67440 343.6508       18.32888 157.9599 6.946644 167.7641 4.487361 -9.804184      8.269962 
1 1 1 -11 16 10 o 200.0220 3.225842 487.8553       15.72378 475.6983       25.08762 495.7204       20.17896 197.3243 5.221854 201.5804 4.107847 -4.256119      6.643957 
1 1 1 -11 16 11 o 83.73798 2.660364 85.57088       5.421860 75.87306       8.931997 91.22907       6.822609 78.70682 4.678038 86.43346 3.244923 -7.726639      5.693291 
1 1 1 -11 16 12 o 296.1450 4.212084 1070.159       30.39747 1074.323       48.72418 1067.505       38.89485 296.3828 6.746142 295.6392 5.398760 0.7435608      8.640430 
1 1 1 -11 16 13 o 109.1582 2.608232 145.2707       6.938075 137.8853       11.53848 149.4532       8.683187 106.1926 4.468789 110.6543 3.223576 -4.461670      5.510128 
1 1 1 -11 16 14 o 193.0446 3.537684 454.5979       16.64227 441.3479       23.72839 467.4262       23.34769 190.0199 5.128974 195.5836 4.902502 -5.563690      7.095132 
1 1 1 -11 16 15 o 118.8940 3.522568 172.5988       10.19474 165.5269       12.62583 185.8469       17.28113 116.3557 4.461094 123.1655 5.773743 -6.809761      7.296402 
1 1 1 -11 16 16 o 266.0832 5.076300 864.9863       32.91553 874.2304       40.87342 847.9302       55.51972 267.3118 6.274609 262.6274 8.686985 4.684387       10.71608 
1 1 1 -11 16 17 f 93.56201 2.931193 106.8666       6.674888 106.0489       10.22294 107.4742       8.812705 93.07923 4.520512 93.76147 3.865280 -0.6822357     5.947724 
1 1 1 -11 16 18 o 244.4144 4.107914 729.3212       24.46720 756.6230       36.00220 705.8894       33.35312 248.6790 5.940923 240.2369 5.697191 8.442093       8.231194 
1 1 1 -11 16 19 o 274.5067 5.106894 921.1661       34.16221 910.8994       59.58688 926.1929       41.69513 271.8899 9.005777 275.0367 6.220978 -3.146759      10.94553 
1 1 1 -11 16 20 o 340.8361 5.298745 1420.893       44.01034 1424.580       63.04902 1417.389       61.46138 340.5916 7.596409 339.7910 7.422570 0.8005066      10.62073 
1 1 1 -11 16 21 o 221.3293 4.383976 598.5555       23.64521 606.7687       42.03933 594.7548       28.59749 222.0413 7.781401 220.4789 5.322611 1.562332       9.427640 
1 1 1 -11 16 22 o 37.83041 4.181694 17.69743       3.790772 18.83484       6.341166 17.06491       4.728756 38.58410 7.001902 36.95317 5.411565 1.630932       8.849388 
1 1 1 -11 16 23 o 235.4286 4.016427 677.1979       23.04279 712.5801       34.22955 647.8749       31.16103 241.1365 5.825082 229.9867 5.559977 11.14983       8.052634 
1 1 1 -11 16 24 o 102.5601 3.454687 128.5881       8.621896 128.1967       17.44901 128.7144       9.917132 101.8691 7.072906 102.5556 3.975704 -0.6865540     8.113706 
1 1 1 -11 16 25 o 148.7497 3.641453 270.3097       13.19978 269.7195       16.99369 271.2074       20.95822 148.3830 4.705620 148.5859 5.799297 -0.2028961     7.468246 
1 1 1 -11 16 26 o 134.1379 3.088312 219.6829       10.09506 219.0012       15.09729 220.2342       13.57661 133.6787 4.641520 134.1312 4.158633 -0.4525146     6.232008 
1 1 1 -11 16 27 o 149.2735 3.218361 272.1623       11.70722 252.5689       16.71080 291.0483       16.40641 143.5108 4.785024 154.1467 4.372021 -10.63586      6.481591 
1 1 1 -11 16 28 o 91.43667 3.079384 102.2354       6.851730 94.94955       10.22339 108.1767       9.231907 87.88676 4.791608 93.93987 4.042247 -6.053101      6.268913 
1 1 1 -11 16 29 o 71.63303 3.604355 62.91538       6.271613 58.19051       8.450290 68.70956       9.357772 68.66512 5.086203 74.62807 5.177681 -5.962952      7.257951 
1 1 1 -11 16 30 o 73.61338 3.205419 66.36870       5.736346 60.47781       8.689088 70.91959       7.637168 69.97403 5.131350 75.97244 4.140808 -5.998413      6.593712 
1 1 1 -11 16 31 o 80.12615 3.430383 78.71325       6.682621 74.41673       11.52551 80.88915       8.202044 77.36749 6.164089 81.11071 4.163547 -3.743217      7.438488 
1 1 1 -11 16 32 o 58.24832 4.449412 41.93385       6.267909 39.36712       7.553133 47.61068       11.23285 56.19328 5.589825 61.28235 7.690665 -5.089069      9.507496 
1 1 1 -11 16 33 o 48.37894 4.977722 29.17932       5.784798 34.63197       7.009977 17.53935       10.24209 52.61346 5.551007 36.45657 10.77758 16.15689       12.12312 
1 1 1 -11 16 34 o 30.70162 5.461884 12.03481       3.936611 10.85699       5.833733 13.01954       5.334166 28.81796 8.016099 31.59164 7.101940 -2.773682      10.70959 
1 1 1 -11 16 35 o 47.65108 4.403111 28.32232       5.055112 26.37756       6.821504 30.69123       7.528720 45.41104 6.336599 48.99798 6.462742 -3.586941      9.050941 
1 1 1 -11 16 36 o 35.95588 4.593164 16.32218       3.932785 11.49081       5.829239 20.35853       5.328083 29.30299 7.958979 39.90110 5.636400 -10.59811      9.752658 
1 1 1 -11 16 37 o 22.26563 6.461251 6.508911       3.710756 5.669160       5.872606 7.067036       4.787641 22.34725 8.214070 23.34522 7.456606 -0.9979782     11.09378 
1 1 1 -11 16 38 o 21.53149 7.294445 5.882116       4.556637 6.849886       9.869084 5.619918       5.136948 25.77220 10.33127 21.56134 7.716538 4.210859       12.89496 
1 1 1 -11 16 39 o 15.67596 6.143524 2.188756       3.416524 2.446952       5.466327 2.023234       4.376711 18.45058 7.580065 16.76001 6.821826 1.690567       10.19778 
1 1 1 -11 16 40 o 15.39148 6.260623 1.758436       3.683312 2.488549       5.417507 1.130828       5.022834 18.16453 7.512679 16.57340 7.065319 1.591135       10.31305 
1 1 1 -11 16 41 o 29.86113 6.021754 12.39635       4.230512 10.07943       6.004111 14.68073       5.961807 25.74869 8.361942 31.31454 7.833084 -5.565845      11.45772 
1 1 1 -11 16 42 o 36.28294 5.172019 17.91994       4.443664 22.90155       6.889014 14.37035       5.815158 38.99792 7.521605 30.42152 7.806024 8.576397       10.84014 
1 1 1 -11 16 43 o 49.41841 4.231072 32.31129       5.046384 32.24790       7.309256 32.36903       6.975749 46.91861 6.572872 47.45584 6.178616 -0.5372353     9.020972 
1 1 1 -11 16 44 o 17.90400 7.648473 3.530223       5.908063 3.530223       5.908063 0.000000       0.000000 17.90400 7.648473 ?        ?        0.000000       7.648473 
1 1 1 -11 16 45 o 23.62029 6.533574 8.959048       3.887413 9.641675       6.142595 8.502989       5.020779 22.59896 8.383933 21.98309 7.649624 0.6158657      11.34932 
1 1 1 -11 16 46 f 19.42611 6.610088 6.347192       3.742152 4.125889       6.116293 7.676226       4.730993 17.32374 7.588856 20.55453 7.399358 -3.230782      10.59911 
1 1 1 -11 16 47 o 19.36012 6.766838 6.667721       3.931245 5.817833       6.151526 7.254446       5.111155 18.00769 7.750538 19.39682 7.539359 -1.389133      10.81262 
1 1 1 -11 17 1  o 255.0971 3.757500 793.7337       23.35827 794.9519       36.74953 792.9080       30.25634 255.0948 5.911723 254.8731 4.871428 0.2216949      7.660240 
1 1 1 -11 17 2  o 217.1295 4.408660 575.2572       23.32714 600.3088       40.10489 562.4481       28.67727 221.3921 7.444184 214.5448 5.489598 6.847305       9.249409 
1 1 1 -11 17 3  o 100.4366 2.572831 123.0504       6.291898 131.1958       9.801871 117.3420       8.205591 103.6370 3.888024 98.03268 3.440143 5.604286       5.191465 
1 1 1 -11 17 4  o 180.0402 3.435849 395.2906       15.07439 393.5801       21.72766 396.8781       20.93143 179.4979 4.972058 180.2673 4.769002 -0.7693787     6.889466 
1 1 1 -11 17 5  f 254.5567 3.791986 790.3705       23.52271 792.7985       37.73030 788.8268       30.08526 254.7379 6.077998 254.2227 4.856277 0.5152283      7.779812 
1 1 1 -11 17 6  o 148.2968 3.162452 268.1586       11.42857 261.9685       16.50714 273.8574       15.83846 146.4402 4.631502 149.7523 4.344730 -3.312103      6.350393 
1 1 1 -11 17 7  o 355.9067 4.905330 1546.225       42.54422 1545.425       67.65703 1546.749       54.71577 355.3158 7.813800 355.7539 6.311414 -0.4381104     10.04437 
1 1 1 -11 17 8  o 159.6349 2.906448 310.7060       11.30646 314.5260       18.46708 308.4155       14.29994 160.4565 4.728014 159.0132 3.690329 1.443344       5.997720 
1 1 1 -11 17 9  o 132.2950 3.056744 213.4143       9.854587 194.0891       20.79533 219.0109       11.19093 125.7915 6.809266 133.9614 3.430900 -8.169846      7.624774 
1 1 1 -11 17 10 o 327.9195 4.580469 1312.548       36.60272 1342.760       59.21247 1293.864       46.56519 331.2105 7.336231 325.3906 5.872464 5.819946       9.397133 
1 1 1 -11 17 11 o 324.0930 4.539310 1282.161       35.85054 1268.849       56.87706 1290.936       46.17900 321.9488 7.249603 325.0066 5.830641 -3.057739      9.303392 
1 1 1 -11 17 12 o 167.1667 2.951315 340.7681       12.02268 342.7601       19.63011 339.5724       15.20895 167.4727 4.814969 166.8320 3.740966 0.6407318      6.097438 
1 1 1 -11 17 13 o 413.4611 6.254202 2090.921       63.01482 2006.942       87.21697 2182.636       91.14561 404.2988 8.852429 421.6176 8.871171 -17.31882      12.53249 
1 1 1 -11 17 14 o 109.8051 3.522924 147.2483       9.414549 145.2466       11.85946 150.6593       15.48132 108.9782 4.475219 110.8615 5.750133 -1.883347      7.286399 
1 1 1 -11 17 15 o 248.0574 3.713619 750.8518       22.44842 716.0925       35.21996 774.6346       29.13292 241.9635 5.973142 251.8372 4.747097 -9.873627      7.629767 
1 1 1 -11 17 16 o 122.2375 3.008025 182.2471       8.960285 185.7211       13.59119 179.5762       11.91678 123.2340 4.533482 121.2216 4.039706 2.012344       6.072206 
1 1 1 -11 17 17 o 220.6213 3.855300 594.1190       20.72725 594.6745       30.10583 593.6183       28.57923 220.4353 5.609010 220.3510 5.322299 0.8427429E-01  7.732261 
1 1 1 -11 17 18 o 187.7230 3.513662 430.0622       16.07362 425.8839       23.45481 433.7621       22.07127 186.5664 5.163928 188.3369 4.812955 -1.770477      7.059086 
1 1 1 -11 17 19 o 150.2149 3.184457 275.3212       11.65694 283.0748       17.54129 269.1890       15.59978 152.1133 4.737924 148.3832 4.318767 3.730087       6.410903 
1 1 1 -11 17 20 o 120.8736 3.384832 178.4594       9.960402 161.3823       17.89683 186.1225       11.98868 114.5604 6.436586 123.3849 3.992505 -8.824440      7.574282 
1 1 1 -11 17 21 o 57.94838 3.620912 41.15987       5.087678 36.97535       9.839929 42.68671       5.943836 54.31894 7.644920 58.96245 4.163483 -4.643509      8.705136 
1 1 1 -11 17 22 o 112.9872 2.990447 155.8931       8.226584 163.9150       12.73518 150.1485       10.77681 115.6975 4.525678 110.7869 3.998327 4.910583       6.038906 
1 1 1 -11 17 23 o 70.87016 3.614213 61.50126       6.221237 53.72758       13.24313 63.70259       7.047257 65.44859 8.504270 72.08831 4.027629 -6.639717      9.409803 
1 1 1 -11 17 24 o 217.9539 3.862337 580.5094       20.51403 579.3436       29.80875 581.5583       28.27445 217.3049 5.633841 217.8635 5.325662 -0.5585632     7.752603 
1 1 1 -11 17 25 o 62.68539 5.336692 48.50859       8.074759 48.50859       8.074759 0.000000       0.000000 62.68539 5.336692 ?        ?        0.000000       5.336692 
1 1 1 -11 17 26 o 23.26763 6.154852 6.891090       3.543088 13.15772       6.350389 4.058655       4.269366 32.00851 8.127756 19.66158 7.035011 12.34693       10.74950 
1 1 1 -11 17 27 o 36.47002 4.663048 16.55578       4.049534 19.29663       6.826502 15.06761       5.030168 38.89130 7.474441 34.48524 6.214215 4.406055       9.720274 
1 1 1 -11 17 28 o 71.02740 3.202534 61.77159       5.528881 60.26501       8.899049 62.71872       7.055911 69.86141 5.265980 71.46452 4.068406 -1.603111      6.654508 
1 1 1 -11 17 29 o 117.0833 3.090763 167.6419       8.810826 172.1267       13.39103 164.2181       11.70021 118.3692 4.651419 115.7098 4.156170 2.659386       6.237744 
1 1 1 -11 17 30 o 107.9032 3.150053 142.4872       8.274144 153.7498       12.65173 134.0700       10.93739 111.8062 4.653700 104.4648 4.305658 7.341385       6.340001 
1 1 1 -11 17 31 o 116.7252 3.461290 166.9791       9.834643 178.5582       17.74771 161.8480       11.81443 119.9900 6.089529 114.7510 4.232188 5.238976       7.415779 
1 1 1 -11 17 32 o 25.98496 7.481852 8.653397       4.993644 3.811526       6.229065 17.36174       8.353800 21.42416 8.324308 36.29849 9.377799 -14.87433      12.53943 
1 1 1 -11 17 33 o 80.98042 3.213020 80.51828       6.328003 81.10931       9.619510 80.06740       8.401866 80.87029 4.904266 80.51125 4.297933 0.3590393      6.521047 
1 1 1 -11 17 34 o 37.11576 4.600480 17.29402       4.071985 12.71551       6.433858 20.35351       5.259372 30.97952 8.339118 40.06926 5.533835 -9.089745      10.00821 
1 1 1 -11 17 35 o 55.58868 4.089444 38.41828       5.500930 31.93903       7.401997 46.41130       8.221334 49.99065 6.209531 60.61430 5.630206 -10.62365      8.381974 
1 1 1 -11 17 36 o 14.11289 5.964834 0.4131285      3.527929 3.930842       5.390334 -2.222873      4.666146 20.22415 7.774189 14.02405 6.350418 6.200100       10.03822 
1 1 1 -11 17 37 o 24.21299 7.104035 7.833844       4.464100 14.87490       10.12425 6.134538       4.973702 32.36800 10.87301 22.15934 7.618392 10.20866       13.27638 
1 1 1 -11 17 38 o 24.38105 6.506501 8.055633       3.937589 1.904415       5.928726 12.91037       5.267004 18.62677 7.793881 30.64610 7.179210 -12.01933      10.59649 
1 1 1 -11 17 39 o 17.48406 6.487344 3.459471       3.678070 4.290093       5.793511 2.898654       4.760474 20.26412 7.982435 17.96392 7.184081 2.300200       10.73919 
1 1 1 -11 17 40 o 37.23671 5.621659 18.66260       4.942451 12.48743       8.650413 21.65547       6.022213 28.15388 10.02043 39.59115 6.464872 -11.43727      11.92492 
1 1 1 -11 17 41 o 14.55662 6.186201 1.019927       3.829751 1.246788       5.685366 0.8314763      5.181769 16.97912 7.379215 16.12027 7.024874 0.8588524      10.18831 
1 1 1 -11 17 42 o 11.69990 5.460580 -2.498269      3.833252 -1.451833      5.465333 -3.511454      5.377800 14.71085 6.742339 13.49804 6.353152 1.212805       9.263999 
1 1 1 -11 17 43 o 14.34184 6.199523 1.011122       3.969165 -2.457764      5.591414 4.534719       5.635336 14.07901 6.578868 18.81555 7.709439 -4.736535      10.13494 
1 1 1 -11 17 44 o 11.40413 5.463813 -4.003535      4.342831 -3.913777      5.524426 -4.148732      7.026314 13.03801 6.223694 14.54443 6.963394 -1.506421      9.339337 
1 1 1 -11 17 45 o 11.18982 5.277682 -2.316366      3.745992 -5.705494      5.644655 0.3509731      5.007633 12.19713 5.936142 14.38178 6.538569 -2.184648      8.831233 
1 1 1 -11 17 46 f 14.37995 6.092290 2.232057       3.694959 0.1710274      6.061007 3.451073       4.661304 14.83912 6.905841 16.08267 6.829402 -1.243547      9.712435 
1 1 1 -11 17 47 o 10.11050 4.895669 -3.787385      3.712505 -3.745394      6.112244 -3.811932      4.673314 12.94213 6.270344 11.41406 5.518632 1.528067       8.352995 
1 1 1 -11 18 1  o 232.7012 3.993462 660.7112       22.64562 662.5251       31.51266 658.7741       32.56472 232.8682 5.553142 232.1848 5.755426 0.6834412      7.997644 
1 1 1 -11 18 2  o 193.0391 3.521637 454.5294       16.56632 460.4644       32.77359 452.4926       19.19976 193.8724 6.948241 192.5700 4.091393 1.302338       8.063346 
1 1 1 -11 18 3  f 142.1071 3.021671 246.2505       10.46403 229.6776       14.32923 265.1868       15.31684 137.1204 4.293588 147.3509 4.270107 -10.23051      6.055470 
1 1 1 -11 18 4  o 304.7202 4.348178 1133.209       32.28826 1118.080       50.86594 1143.419       41.78630 302.3083 6.904639 305.9265 5.605065 -3.618256      8.893301 
1 1 1 -11 18 5  o 151.2885 2.893533 279.0814       10.66769 263.8268       17.00013 288.9896       13.70092 146.9295 4.754220 153.9178 3.652790 -6.988327      5.995455 
1 1 1 -11 18 6  o 196.7931 3.242336 472.3056       15.54905 491.7695       25.53560 460.8361       19.60209 200.5927 5.228357 194.3329 4.139232 6.259781       6.668505 
1 1 1 -11 18 7  o 330.1032 4.620463 1330.231       37.16819 1307.491       58.63593 1345.506       48.05626 326.7945 7.362969 331.7878 5.943654 -4.993256      9.462576 
1 1 1 -11 18 8  o 311.4429 5.688776 1185.326       43.17510 1267.376       79.54517 1151.058       51.40637 320.8491 10.18656 306.7005 6.878067 14.14862       12.29121 
1 1 1 -11 18 9  o 264.1147 3.908958 851.1592       25.15878 798.7469       38.72226 889.4478       33.09626 255.5752 6.217357 269.8634 5.032674 -14.28815      7.998959 
1 1 1 -11 18 10 o 228.2974 4.568738 636.3298       25.41753 671.3908       32.45744 580.7352       40.87134 234.3736 5.682893 217.5565 7.721470 16.81717       9.587302 
1 1 1 -11 18 11 o 45.51614 3.918816 25.46785       4.304388 21.81092       6.604639 28.16794       5.675183 41.69423 6.729431 47.76931 4.946731 -6.075085      8.351969 
1 1 1 -11 18 12 o 335.2826 5.248376 1373.612       42.88171 1365.587       60.82698 1381.542       60.46244 333.8135 7.477497 335.7806 7.389142 -1.967072      10.51249 
1 1 1 -11 18 13 o 191.5496 3.574999 447.6758       16.68758 488.5811       25.29222 416.1409       22.20720 199.8904 5.196696 184.4991 4.943732 15.39133       7.172596 
1 1 1 -11 18 14 o 276.7095 4.026294 934.6377       27.14974 937.6630       43.71127 932.7375       34.64217 276.7575 6.481236 276.2693 5.145604 0.4882202      8.275485 
1 1 1 -11 18 15 o 120.6424 2.683704 177.4896       7.889884 196.5620       13.89885 168.4215       9.583711 126.7822 4.505838 117.4447 3.352035 9.337425       5.615934 
1 1 1 -11 18 16 o 336.8375 4.699584 1386.241       38.57589 1395.690       62.09372 1380.302       49.22841 337.2520 7.555393 335.8216 6.015492 1.430450       9.657645 
1 1 1 -11 18 17 o 108.1249 3.019437 142.7317       7.948079 132.5608       11.96221 150.7709       10.63504 104.0437 4.730393 111.0551 3.935970 -7.011337      6.153737 
1 1 1 -11 18 18 o 237.2729 4.057566 687.5576       23.46118 693.1722       34.18273 682.5572       32.25901 237.9339 5.895415 236.1603 5.605420 1.773605       8.134903 
1 1 1 -11 18 19 o 53.16101 3.532449 34.64991       4.550244 27.84061       7.381733 38.82287       5.778689 47.20070 6.597603 56.21209 4.250041 -9.011387      7.848007 
1 1 1 -11 18 20 o 89.46227 3.339970 97.82799       7.268678 122.3654       15.15524 90.49737       8.283590 99.70676 6.269112 85.98280 3.964068 13.72396       7.417250 
1 1 1 -11 18 21 o 93.87076 3.046934 107.6491       6.960714 114.5035       11.14301 103.2629       8.913843 96.63966 4.746150 91.84854 3.992041 4.791115       6.201801 
1 1 1 -11 18 22 o 265.4152 6.135459 864.2407       39.68341 0.000000       0.000000 864.2407       39.68341 ?        ?        265.4152 6.135459 0.000000       6.135459 
1 1 1 -11 18 23 o 228.4815 3.995160 638.0688       22.24443 608.8998       31.58315 666.7813       31.33507 222.7324 5.823832 233.2364 5.513130 -10.50406      8.019453 
1 1 1 -11 18 24 o 163.5898 5.007433 328.0975       19.93866 328.0975       19.93866 0.000000       0.000000 163.5898 5.007433 ?        ?        0.000000       5.007433 
1 1 1 -11 18 25 o 260.7744 4.359529 832.1813       27.70388 808.7858       39.45496 854.9340       38.90915 256.4750 6.312776 263.7866 6.052892 -7.311584      8.745778 
1 1 1 -11 18 26 o 42.25013 4.175850 22.05478       4.243246 18.53823       6.881606 24.21196       5.389814 38.06753 7.683357 44.14603 5.103993 -6.078499      9.224137 
1 1 1 -11 18 27 o 148.4795 3.245621 269.4041       11.74358 265.9050       17.52688 272.2548       15.81986 147.1601 4.894215 149.0259 4.360859 -1.865799      6.555184 
1 1 1 -11 18 28 o 68.13063 3.288759 56.87453       5.444098 65.62728       8.804714 51.45703       6.926955 72.94912 4.982811 64.64518 4.423800 8.303940       6.663214 
1 1 1 -11 18 29 o 94.76203 3.106666 109.8944       7.164364 115.5844       11.12244 105.8594       9.366269 96.91352 4.723783 92.84408 4.150262 4.069443       6.287988 
1 1 1 -11 18 30 o 161.6064 3.796114 320.0484       14.94974 301.3055       25.71194 329.6208       18.37492 155.6850 6.793579 163.7199 4.610209 -8.034851      8.210160 
1 1 1 -11 18 31 o 92.62776 3.983701 105.5064       8.971139 107.3573       11.12286 102.0611       15.17533 93.21754 4.913819 90.25954 6.952915 2.958000       8.514027 
1 1 1 -11 18 32 o 46.74881 5.638988 27.47255       6.294420 25.65682       11.86355 28.18395       7.425796 43.58432 11.13164 47.08346 6.657522 -3.499142      12.97058 
1 1 1 -11 18 33 o 72.24855 3.347188 64.22568       5.877107 72.27071       9.361880 58.99299       7.550250 76.18410 5.071572 68.95747 4.517961 7.226624       6.792114 
1 1 1 -11 18 34 o 104.7022 3.525684 135.1256       8.982873 144.2273       12.10332 123.9638       13.40331 107.7349 4.620862 99.43336 5.553578 8.301552       7.224583 
1 1 1 -11 18 35 o 17.69449 6.356193 3.449207       3.488931 -1.766707      5.608627 6.741640       4.456047 15.90189 7.100595 22.90963 7.178295 -7.007741      10.09685 
1 1 1 -11 18 36 o 72.85269 3.328231 65.72942       5.893136 61.01743       8.921721 69.37662       7.849220 69.32126 5.322070 74.43288 4.346295 -5.111626      6.871296 
1 1 1 -11 18 37 o 20.68713 6.960677 5.426576       4.149117 0.5218801      8.753865 6.847686       4.712025 20.83456 9.103958 22.81163 7.407727 -1.977064      11.73697 
1 1 1 -11 18 38 o 21.86481 6.516584 6.463841       3.732286 10.66058       5.886949 3.643238       4.826200 27.38765 8.189399 18.88814 7.330481 8.499504       10.99101 
1 1 1 -11 18 39 o 25.03577 6.437752 8.728333       3.949453 12.85094       6.044665 5.657377       5.217025 29.56220 8.135522 21.07121 7.742532 8.490993       11.23092 
1 1 1 -11 18 40 o 49.88423 4.005694 32.01725       4.828520 25.15612       7.033504 38.13314       6.640545 41.87819 7.148414 53.57291 5.149906 -11.69472      8.810298 
1 1 1 -11 18 41 o 24.42352 6.729211 8.831617       4.132792 11.93492       5.911108 5.864055       5.780385 27.35288 8.212499 20.69889 8.025438 6.653990       11.48272 
1 1 1 -11 18 42 o 10.46354 5.030426 -4.370548      3.753190 -0.6630611     5.313064 -8.063410      5.302575 14.88166 6.753697 11.43477 5.605254 3.446890       8.776748 
1 1 1 -11 18 43 o 17.38702 7.482507 2.955036       5.732109 2.955036       5.732109 0.000000       0.000000 17.38702 7.482507 ?        ?        0.000000       7.482507 
1 1 1 -11 18 44 o 11.92973 5.505058 -1.268620      3.730873 0.6733796      5.811295 -2.630289      4.866135 15.50952 7.048325 12.70653 5.999773 2.802984       9.256141 
1 1 1 -11 18 45 o 14.80604 6.237480 2.416099       3.837566 -3.704641      5.948154 6.780447       5.022731 13.17126 6.332340 19.51556 7.503747 -6.344304      9.818592 
1 1 1 -11 18 46 o 22.86651 6.677054 9.088671       3.951772 6.682967       6.632905 10.41249       4.920369 18.71792 8.052056 23.29761 7.570035 -4.579689      11.05174 
1 1 1 -11 19 1  o 74.39059 4.332804 67.78269       7.820588 70.99055       10.14717 63.08934       12.27378 76.01673 5.515228 71.42384 7.147707 4.592888       9.028148 
1 1 1 -11 19 2  o 174.7283 4.595772 373.0237       19.55152 376.6596       28.21620 369.6657       27.11663 175.3192 6.616264 173.7111 6.416808 1.608093       9.216852 
1 1 1 -11 19 3  o 249.4696 4.786783 760.0046       29.10030 712.0625       48.44733 787.0648       36.39787 240.7992 8.268438 253.7263 5.886734 -12.92709      10.14991 
1 1 1 -11 19 4  o 152.5593 3.647623 283.9543       13.56078 281.5757       23.21960 285.1856       16.70588 151.5946 6.299154 152.7728 4.492200 -1.178253      7.736873 
1 1 1 -11 19 5  o 221.9318 4.493127 601.3183       24.29989 601.4271       30.35983 601.1243       40.53552 221.7573 5.622580 221.3758 7.524909 0.3815002      9.393490 
1 1 1 -11 19 6  o 197.6165 3.657017 476.4600       17.61109 475.9688       25.40072 476.9147       24.43882 197.3025 5.287728 197.5247 5.081400 -0.2222595     7.333532 
1 1 1 -11 19 7  o 199.9499 3.680763 487.7954       17.93475 515.1284       26.60784 465.0378       24.27897 205.2552 5.324098 195.0407 5.112619 10.21451       7.381388 
1 1 1 -11 19 8  o 213.4888 5.403996 557.3453       28.09163 603.7681       42.98420 522.7360       37.11418 221.7458 7.967532 206.4230 7.390044 15.32281       10.86712 
1 1 1 -11 19 9  o 159.3933 3.316032 309.9146       12.88026 300.5221       18.48343 318.7815       17.95879 156.7837 4.843581 161.5106 4.567477 -4.726852      6.657486 
1 1 1 -11 19 10 o 109.3625 2.722635 145.8430       7.255946 146.0457       12.11676 145.7297       9.060056 109.2663 4.560580 109.2427 3.407482 0.2354431E-01  5.692963 
1 1 1 -11 19 11 o 157.2117 2.933734 301.4291       11.23936 288.1248       18.09312 309.7890       14.34223 153.5026 4.842897 159.3329 3.693813 -5.830307      6.090805 
1 1 1 -11 19 12 o 113.9124 3.043318 158.3844       8.440438 167.2558       12.76333 151.4894       11.25214 116.9433 4.487031 111.3174 4.155268 5.625900       6.115530 
1 1 1 -11 19 13 o 94.84389 2.692434 109.7851       6.216571 115.2644       10.66177 106.9628       7.651906 97.04134 4.520971 93.57214 3.361190 3.469208       5.633541 
1 1 1 -11 19 14 o 156.1125 2.916096 297.2609       11.09368 306.9419       18.52917 291.8516       13.85044 158.4195 4.805222 154.6379 3.675459 3.781677       6.049724 
1 1 1 -11 19 15 o 52.79941 3.138078 34.13085       4.019439 39.79833       7.360123 31.72228       4.798109 56.79288 5.382315 50.82518 3.903846 5.967709       6.649010 
1 1 1 -11 19 16 o 369.1341 5.083312 1666.156       45.72639 1638.227       72.16341 1684.892       59.10711 365.0285 8.112489 370.7731 6.541771 -5.744598      10.42148 
1 1 1 -11 19 17 f 272.6188 3.995980 907.6550       26.54699 872.6462       41.84639 931.2337       34.34227 266.8194 6.435829 275.9355 5.107229 -9.116119      8.216063 
1 1 1 -11 19 18 o 176.3724 3.467672 379.7269       14.90406 384.3377       22.05916 375.8544       20.21626 177.1746 5.114535 175.2670 4.737651 1.907547       6.971642 
1 1 1 -11 19 19 o 197.3705 4.156484 475.9849       19.99146 476.5656       35.89437 475.7237       24.07031 196.7290 7.500980 197.1273 5.014777 -0.3982239     9.022898 
1 1 1 -11 19 20 o 112.9200 3.494006 155.8404       9.603017 143.6708       18.42734 160.3775       11.25163 107.8998 7.046750 114.4951 4.038992 -6.595360      8.122200 
1 1 1 -11 19 21 f 197.8128 4.233230 478.3573       20.40621 439.8058       36.21239 496.2956       24.70167 188.7453 7.890489 201.2867 5.039841 -12.54140      9.362681 
1 1 1 -11 19 22 o 214.2137 3.855255 560.7562       20.12503 573.0771       29.80684 550.4338       27.28256 216.1153 5.664597 211.9610 5.281935 4.154266       7.745095 
1 1 1 -11 19 23 o 249.9111 5.037391 765.0490       30.67802 773.3896       38.23460 749.9749       51.40103 250.9096 6.253212 246.0532 8.585641 4.856415       10.62148 
1 1 1 -11 19 24 o 111.8701 3.561647 153.0825       9.697219 145.2250       12.92189 163.2127       14.67212 108.7695 4.887578 115.2605 5.237363 -6.490997      7.163685 
1 1 1 -11 19 25 o 142.0207 3.236726 246.3979       11.20195 235.2632       16.60633 255.6950       15.17425 138.4518 4.929836 144.4662 4.315112 -6.014374      6.551600 
1 1 1 -11 19 26 o 14.64247 6.037216 0.7841079      3.483903 4.577927       6.655969 -0.6475320     4.088744 22.75531 8.665589 14.40857 6.259988 8.346739       10.69018 
1 1 1 -11 19 27 o 28.37263 5.921271 10.27393       3.961503 7.498898       6.974596 11.59557       4.813284 25.83542 9.014367 30.06551 6.736882 -4.230083      11.25364 
1 1 1 -11 19 28 o 105.3234 3.119022 135.7221       7.996516 131.4645       12.29690 138.8418       10.52605 103.3438 4.896801 106.3753 4.068079 -3.031563      6.366155 
1 1 1 -11 19 29 o 85.84109 3.104206 90.23646       6.482852 95.39586       10.40084 86.95853       8.290280 87.94708 4.872046 84.11512 4.056403 3.831963       6.339656 
1 1 1 -11 19 30 o 145.1887 4.753559 259.7326       16.79585 247.6890       22.84661 273.8967       24.77640 141.0219 6.667002 148.2072 6.878901 -7.185303      9.579572 
1 1 1 -11 19 31 o 206.1021 5.721554 527.0554       28.70860 506.1262       41.32230 546.5827       39.91449 199.8040 8.506267 208.2203 7.880538 -8.416290      11.59566 
1 1 1 -11 19 32 o 71.48802 3.333790 62.85278       5.791752 63.52363       9.282961 62.42521       7.411123 71.34464 5.378977 71.02538 4.302051 0.3192596      6.887745 
1 1 1 -11 19 33 o 67.16825 3.790109 55.77309       6.178545 60.23380       8.796947 51.43040       8.679792 69.36636 5.242934 63.93552 5.628369 5.430832       7.692002 
1 1 1 -11 19 34 o 16.54533 6.575257 2.007707       3.963053 0.7888691      6.177800 2.860035       5.166119 18.53246 7.865662 19.00535 7.521832 -0.4728947     10.88332 
1 1 1 -11 19 35 o 72.18995 3.375984 64.51066       5.922550 64.96850       9.200395 64.18669       7.739320 71.62981 5.308531 71.59312 4.458163 0.3668976E-01  6.932223 
1 1 1 -11 19 36 o 41.06047 5.128975 21.63743       5.020431 26.33164       11.06374 20.42020       5.633862 42.22947 10.73075 39.49401 6.045910 2.735458       12.31674 
1 1 1 -11 19 37 o 27.61498 5.989025 10.23470       3.914032 9.042010       6.265431 10.99806       5.012447 25.66536 8.552378 28.18373 7.255311 -2.518366      11.21529 
1 1 1 -11 19 38 o 33.26246 5.145539 14.57211       4.036301 14.71741       6.702559 14.48943       5.055847 31.61040 8.512575 32.41914 6.623667 -0.8087349     10.78596 
1 1 1 -11 19 39 o 72.29302 3.801702 66.47573       6.673927 59.30262       11.89364 69.77235       8.062976 64.21812 7.757120 73.42996 4.527969 -9.211838      8.981950 
1 1 1 -11 19 40 o 14.49003 6.125790 1.130658       3.722449 2.836313       5.245845 -0.5992628     5.283029 17.75763 7.372861 15.21667 6.835589 2.540959       10.05407 
1 1 1 -11 19 41 o 14.32620 6.123964 1.032212       3.791922 -2.110474      5.375073 4.145868       5.350190 14.22057 6.578270 18.69208 7.566546 -4.471505      10.02628 
1 1 1 -11 19 42 o 18.41829 6.821235 4.814848       4.062962 2.794642       5.914194 6.620415       5.591194 17.60764 7.589152 20.73261 7.930810 -3.124964      10.97693 
1 1 1 -11 19 43 o 19.17891 7.368364 5.701242       4.840419 7.140897       6.233932 3.515518       7.681225 20.65568 8.234226 18.55147 8.294847 2.104204       11.68790 
1 1 1 -11 19 44 o 14.46314 6.204296 1.830724       3.917241 -3.721611      5.922464 6.148814       5.222884 13.27538 6.365707 19.11231 7.563399 -5.836931      9.885708 
1 1 1 -11 19 45 o 22.13071 6.840253 8.519209       4.061351 11.12129       6.367824 6.734926       5.273057 22.86470 8.525905 19.21015 7.600422 3.654554       11.42180 
1 1 1 -11 20 1  o 238.8056 3.624609 695.8671       21.09316 715.8593       33.53730 682.7830       27.13125 241.9548 5.687976 236.4317 4.708992 5.523071       7.384286 
1 1 1 -11 20 2  o 79.11161 2.648528 76.40202       5.098804 80.06085       7.669493 73.50403       6.825644 80.89919 3.901834 77.53001 3.622766 3.369179       5.324354 
1 1 1 -11 20 3  o 200.9072 4.162716 492.7350       20.38020 461.0561       33.99240 510.5128       25.46455 193.8464 7.208502 204.3378 5.117915 -10.49136      8.840563 
1 1 1 -11 20 4  o 123.3978 2.684523 185.6776       8.072549 183.9619       12.34045 186.9610       10.67287 122.6916 4.133335 123.7372 3.543170 -1.045601      5.444126 
1 1 1 -11 20 5  o 320.2869 5.046856 1253.382       39.39093 1146.628       74.58739 1294.672       46.38750 304.9395 10.05100 325.3657 5.850501 -20.42621      11.62975 
1 1 1 -11 20 6  o 213.3600 3.426733 555.3786       17.81679 564.6343       28.97801 549.7532       22.59141 214.8380 5.539669 212.1917 4.368968 2.646255       7.055197 
1 1 1 -11 20 7  o 282.1390 4.613908 972.1934       31.72256 1014.341       66.88619 959.9614       36.03297 286.9227 9.579543 280.2574 5.276026 6.665344       10.93637 
1 1 1 -11 20 8  o 186.1973 3.187240 422.9100       14.46186 452.6756       24.26275 406.5075       18.01100 192.3895 5.179859 182.4868 4.050142 9.902679       6.575302 
1 1 1 -11 20 9  o 75.23833 2.902209 69.14273       5.311152 66.04242       8.925866 70.84210       6.608345 73.34589 5.024228 76.11147 3.572896 -2.765572      6.165100 
1 1 1 -11 20 10 o 256.9405 3.851371 805.7956       24.11482 795.8351       38.39418 812.2849       30.99015 254.9998 6.178592 257.8299 4.932354 -2.830154      7.905891 
1 1 1 -11 20 11 o 145.8231 2.886916 259.3565       10.25880 250.6041       16.71059 264.6503       12.99609 143.1347 4.797610 147.2612 3.621497 -4.126526      6.011015 
1 1 1 -11 20 12 o 80.36073 3.165957 78.90659       6.187774 79.29958       9.336979 78.59881       8.262815 80.41663 4.786230 80.11368 4.247565 0.3029480      6.399204 
1 1 1 -11 20 13 o 88.48325 2.746904 95.58215       5.915812 112.6298       10.53672 87.73463       7.148907 95.90959 4.520969 84.71809 3.470145 11.19151       5.699217 
1 1 1 -11 20 14 o 24.65014 5.701090 7.734132       3.356384 7.841013       6.290288 7.691590       3.968537 25.87832 8.567663 24.61784 6.514798 1.260481       10.76325 
1 1 1 -11 20 15 o 226.1512 3.537697 624.2842       19.49645 615.7289       31.38760 629.6588       24.87775 224.1944 5.749841 226.9974 4.497322 -2.803055      7.299766 
1 1 1 -11 20 16 o 209.2424 3.365558 534.3750       17.16101 555.9198       28.48969 522.1062       21.49895 213.0475 5.492087 206.7195 4.267759 6.328079       6.955342 
1 1 1 -11 20 17 o 263.7081 3.913181 849.3933       25.14720 873.7476       41.21791 834.9529       31.73862 266.9370 6.336379 261.2594 4.985170 5.677582       8.062358 
1 1 1 -11 20 18 o 230.5461 5.543684 650.9587       31.14529 0.000000       0.000000 650.9587       31.14529 ?        ?        230.5461 5.543684 0.000000       5.543684 
1 1 1 -11 20 19 o 146.9328 3.711329 263.8617       13.27812 272.9565       25.17554 260.3567       15.62861 148.8779 6.958499 145.8621 4.401889 3.015869       8.233913 
1 1 1 -11 20 20 o 71.91630 3.605966 63.32941       6.299372 69.27084       12.92217 61.47734       7.214692 74.70277 7.187027 70.79108 4.201077 3.911690       8.324806 
1 1 1 -11 20 21 o 104.3643 3.104919 133.0848       7.887789 140.6352       12.43386 127.9999       10.20384 107.0855 4.776763 102.2412 4.103787 4.844215       6.297503 
1 1 1 -11 20 22 o 162.6117 3.396888 322.9762       13.46075 340.1768       20.46329 309.8565       17.87158 166.5653 5.047264 159.0446 4.616019 7.520706       6.839774 
1 1 1 -11 20 23 o 61.11809 3.950680 45.86559       5.852546 39.33367       8.399113 52.03025       8.159583 56.23216 6.233923 64.94185 5.199332 -8.709690      8.117564 
1 1 1 -11 20 24 o 58.79187 3.606086 42.40903       5.141561 36.74798       8.386909 45.81763       6.507916 54.26428 6.469647 61.01754 4.406425 -6.753262      7.827702 
1 1 1 -11 20 25 o 48.54450 4.216975 29.06769       4.939138 25.34171       10.03755 30.25809       5.673532 44.23834 9.588168 49.45424 4.766747 -5.215897      10.70770 
1 1 1 -11 20 26 o 134.5577 3.236207 221.2992       10.61160 208.8955       15.83045 231.4207       14.30010 130.3588 4.992527 137.3751 4.276851 -7.016357      6.573946 
1 1 1 -11 20 27 o 105.9456 3.175896 137.3457       8.190206 133.2057       12.74636 140.2570       10.68880 103.9990 5.044499 106.9118 4.110334 -2.912758      6.507059 
1 1 1 -11 20 28 o 113.3939 3.162771 157.3916       8.731099 162.3848       13.69324 153.9707       11.33394 114.8130 4.905474 111.9659 4.161167 2.847130       6.432650 
1 1 1 -11 20 29 o 83.95329 3.588702 86.52132       7.325008 85.79095       13.89624 86.80235       8.619786 82.75839 6.954759 83.96948 4.226076 -1.211090      8.138083 
1 1 1 -11 20 30 o 88.20824 5.040765 96.36042       10.79021 79.26353       16.15145 110.1416       14.50095 78.75777 8.552696 93.88278 6.376157 -15.12501      10.66790 
1 1 1 -11 20 31 o 72.49707 3.361585 64.62796       5.922659 60.18031       9.301941 67.66041       7.680778 69.40505 5.545899 73.97608 4.278929 -4.571030      7.004729 
1 1 1 -11 20 32 o 42.71831 4.295825 22.76586       4.411298 22.53260       7.294094 22.90037       5.539082 41.56400 7.476269 42.54406 5.469085 -0.9800529     9.263125 
1 1 1 -11 20 33 o 35.31792 5.408267 15.93532       4.506716 11.70028       6.754699 19.33307       6.050249 29.61841 8.751536 38.55910 6.680808 -8.940697      11.01011 
1 1 1 -11 20 34 o 71.52268 3.379236 63.27840       5.873116 67.91549       9.229020 60.12242       7.613777 73.36789 5.195553 69.29728 4.533559 4.070610       6.895428 
1 1 1 -11 20 35 o 71.39477 3.999762 63.68958       6.931014 77.49642       15.31120 60.13116       7.773026 75.71758 8.441455 69.06685 4.645341 6.650734       9.635215 
1 1 1 -11 20 36 o 46.72529 4.763371 27.89481       5.348013 20.17600       11.95514 29.82588       5.979684 36.00346 11.80646 48.13241 5.179474 -12.12895      12.89261 
1 1 1 -11 20 37 o 35.97113 4.937082 16.84677       4.213679 17.12776       7.152843 16.69743       5.214522 34.26130 8.585435 35.12495 6.324603 -0.8636513     10.66350 
1 1 1 -11 20 38 o 56.58883 3.811926 40.67889       5.226007 47.16122       8.611588 36.89988       6.575161 59.18872 6.055731 53.00103 5.155884 6.187695       7.953302 
1 1 1 -11 20 39 f 18.74812 6.753681 4.599326       3.942143 2.518756       5.840557 6.340322       5.342713 18.17747 7.678354 21.39144 7.839366 -3.213974      10.97328 
1 1 1 -11 20 40 o 29.75646 5.856421 12.51140       4.095398 10.64198       5.945180 14.19960       5.649651 25.73715 8.317830 30.32273 7.647947 -4.585577      11.29944 
1 1 1 -11 20 41 o 44.33964 4.429072 26.26521       4.721683 26.68057       6.844840 25.88814       6.521802 42.26302 6.882728 41.92241 6.602006 0.3406105      9.537212 
1 1 1 -11 20 42 o 12.35264 5.915892 -4.415305      5.080073 -4.415305      5.080073 0.000000       0.000000 12.35264 5.915892 ?        ?        0.000000       5.915892 
1 1 1 -11 20 43 o 25.50039 6.575268 10.39842       4.112276 9.722354       5.979031 11.00532       5.664944 22.80622 8.303164 24.45916 8.131734 -1.652937      11.62186 
1 1 1 -11 20 44 o 21.32542 6.905027 7.838280       4.095914 5.343948       6.266510 9.698720       5.411983 18.30142 7.848946 22.50048 7.933721 -4.199064      11.16019 
1 1 1 -11 20 45 o 16.02220 6.534163 3.781427       4.024726 -1.339463      6.213597 7.482855       5.282689 14.13965 6.706971 19.70347 7.663065 -5.563815      10.18362 
1 1 1 -11 21 1  o 78.53476 2.691504 75.30509       5.143407 71.56843       7.662742 78.36903       6.938776 76.44975 4.128442 80.05759 3.565622 -3.607834      5.455061 
1 1 1 -11 21 2  o 36.66346 3.908566 16.59397       3.438320 8.528168       4.876498 24.56795       4.848660 26.03366 7.360560 44.62172 4.521356 -18.58805      8.638316 
1 1 1 -11 21 3  o 181.8482 3.094325 403.3886       13.71233 400.1796       21.24175 405.6812       17.95443 180.9113 4.822541 182.2903 4.041773 -1.379013      6.292283 
1 1 1 -11 21 4  o 123.9131 3.045038 187.2937       9.194881 192.0824       12.60305 181.8439       13.44478 125.3611 4.131141 121.9312 4.532727 3.429955       6.132857 
1 1 1 -11 21 5  o 144.8544 3.178214 255.9748       11.21892 256.0288       22.15594 255.9561       13.01014 144.4767 6.308182 144.7718 3.690763 -0.2950897     7.308550 
1 1 1 -11 21 6  o 95.13779 3.162797 110.5392       7.322449 87.43387       15.62956 117.0368       8.288343 84.06213 7.715739 97.87379 3.480624 -13.81167      8.464477 
1 1 1 -11 21 7  o 113.1066 2.802016 156.0274       7.723151 147.7691       12.65195 160.9324       9.750602 109.8731 4.736435 114.7874 3.489843 -4.914322      5.883266 
1 1 1 -11 21 8  o 101.5955 2.809468 125.9840       6.948926 119.1736       11.52804 129.8708       8.708975 98.63880 4.810423 103.1052 3.471123 -4.466393      5.932020 
1 1 1 -11 21 9  o 132.9654 3.183124 215.6989       10.31403 223.3127       15.43198 209.5520       13.86586 135.1079 4.694238 130.9114 4.352486 4.196503       6.401563 
1 1 1 -11 21 10 o 162.8000 3.033315 323.3274       12.03395 330.4903       19.91554 319.2080       15.10293 164.3501 4.978368 161.7012 3.832763 2.648972       6.282851 
1 1 1 -11 21 11 o 124.3468 3.184286 188.7800       9.641074 192.6913       14.36542 185.5745       13.00494 125.4799 4.706287 123.1786 4.339264 2.301392       6.401433 
1 1 1 -11 21 12 o 178.1078 3.129876 387.0502       13.58458 371.3061       21.75026 397.1199       17.39453 174.1719 5.130078 180.3357 3.958174 -6.163834      6.479571 
1 1 1 -11 21 13 o 170.9759 3.435462 356.7938       14.31384 354.8840       20.91348 358.4769       19.63281 170.2759 5.045641 171.1861 4.710759 -0.9101868     6.902879 
1 1 1 -11 21 14 o 61.94940 3.033742 46.93751       4.565928 64.59090       8.633098 40.08181       5.379956 72.51164 4.914695 57.15864 3.885530 15.35300       6.265108 
1 1 1 -11 21 15 o 143.4531 2.891034 251.0723       10.10646 266.0672       17.09927 243.0216       12.52912 147.4317 4.765641 141.0324 3.648635 6.399307       6.001989 
1 1 1 -11 21 16 o 139.6514 3.638013 238.3076       12.37017 261.2414       23.66330 229.6837       14.51077 145.7396 6.680644 137.0146 4.351497 8.724991       7.972861 
1 1 1 -11 21 17 o 350.1622 6.312273 1504.308       53.86307 1384.121       90.21552 1570.882       67.14378 333.3099 11.12258 357.2224 7.713135 -23.91251      13.53530 
1 1 1 -11 21 18 o 286.0746 5.322419 1002.329       37.10432 0.000000       0.000000 1002.329       37.10432 ?        ?        286.0746 5.322419 0.000000       5.322419 
1 1 1 -11 21 19 o 198.3359 3.296691 480.3074       15.93366 521.7081       27.31975 458.9650       19.61530 206.2649 5.439944 193.7601 4.154269 12.50487       6.844775 
1 1 1 -11 21 20 o 71.84711 2.922987 63.10933       5.106985 71.47809       9.419122 59.62477       6.077907 76.22268 5.100309 69.77090 3.586771 6.451775       6.235229 
1 1 1 -11 21 21 o 50.16308 3.953612 30.95301       4.793930 24.64243       7.743228 34.87526       6.104567 44.11960 7.468194 53.15980 4.762742 -9.040203      8.857632 
1 1 1 -11 21 22 o 145.6781 3.806918 259.6260       13.50304 253.9251       17.51113 267.9879       21.20784 143.8576 5.002727 147.5915 5.908504 -3.733917      7.741944 
1 1 1 -11 21 23 o 80.99705 3.296307 80.28722       6.492689 83.08021       10.60856 78.61448       8.209871 82.11129 5.330537 80.03449 4.224387 2.076797       6.801476 
1 1 1 -11 21 24 o 70.43856 3.343603 60.77718       5.722946 67.10076       9.756252 57.45981       7.066395 73.70633 5.470787 68.36886 4.262549 5.337471       6.935332 
1 1 1 -11 21 25 o 95.40513 3.176778 111.3616       7.375450 119.6602       12.03511 106.3706       9.333454 98.60255 5.025282 93.10809 4.123801 5.494469       6.500707 
1 1 1 -11 21 26 o 59.25832 3.898067 43.18683       5.597786 28.92807       11.96847 47.17937       6.333187 46.95560 10.69899 61.90015 4.223810 -14.94455      11.50256 
1 1 1 -11 21 27 o 52.70921 3.834493 34.21851       4.891592 30.22634       8.249425 36.38332       6.074770 48.85005 7.140782 54.22855 4.641497 -5.378494      8.516705 
1 1 1 -11 21 28 o 107.5125 3.517880 141.7522       9.204306 150.1040       17.50046 138.5584       10.82201 109.7727 6.572223 106.1495 4.191877 3.623184       7.795252 
1 1 1 -11 21 29 o 66.59413 5.836684 55.37878       9.376261 58.81041       14.29284 52.78630       12.42298 67.60749 8.890611 64.28709 8.109984 3.320404       12.03390 
1 1 1 -11 21 30 o 60.51579 3.595886 45.12936       5.278957 41.68772       8.630206 47.18693       6.672913 57.49204 6.260981 61.69928 4.468400 -4.207241      7.691975 
1 1 1 -11 21 31 o 85.03187 3.191278 88.88953       6.601021 96.51788       10.73797 84.25561       8.369150 88.04167 5.025805 82.52039 4.175396 5.521286       6.533961 
1 1 1 -11 21 32 o 57.62854 3.650015 41.10503       5.099542 41.82174       8.204849 40.65389       6.509566 57.40655 5.951301 57.01160 4.727947 0.3949471      7.600754 
1 1 1 -11 21 33 o 79.69096 3.285249 78.42319       6.366213 92.47063       10.27106 69.65980       8.112473 85.84863 4.930334 74.66883 4.478976 11.17979       6.661037 
1 1 1 -11 21 34 o 67.05138 3.495604 55.81755       5.691985 54.27514       8.978769 56.85389       7.359846 65.11749 5.716206 67.25885 4.516563 -2.141365      7.285214 
1 1 1 -11 21 35 f 45.02662 4.757356 25.86989       5.141171 25.38551       11.93915 25.98016       5.696362 40.60011 11.53006 44.88014 5.311247 -4.280025      12.69455 
1 1 1 -11 21 36 o 60.14811 4.103055 45.77129       5.978015 47.87313       8.488618 43.70320       8.420177 60.40815 5.839113 57.51292 6.100800 2.895226       8.444820 
1 1 1 -11 21 37 o 40.60993 4.438674 21.28576       4.321150 27.65816       6.998367 17.35940       5.493390 44.96843 6.581161 35.46556 6.598995 9.502872       9.319786 
1 1 1 -11 21 38 o 31.56287 6.155125 13.86862       4.564118 9.674032       8.432705 15.60647       5.427864 25.38354 9.732290 32.97527 6.972932 -7.591738      11.97244 
1 1 1 -11 21 39 o 13.32554 5.812915 0.1916419      3.555783 0.3987016      5.522641 0.4502545E-01  4.647189 16.10219 7.126081 14.78453 6.540217 1.317664       9.672408 
1 1 1 -11 21 40 o 23.32661 6.632340 8.153355       3.948100 7.724413       6.252618 8.437777       5.091486 22.28578 8.419145 23.17855 7.709262 -0.8927708     11.41555 
1 1 1 -11 21 41 o 22.74899 7.335221 8.294526       4.625203 11.28595       5.980889 3.843862       7.295235 25.56066 8.348878 19.07987 8.324582 6.480795       11.78993 
1 1 1 -11 21 42 o 14.27498 6.293984 0.8626954      4.270029 -0.1756081E-01 5.691695 1.995979       6.458124 15.14195 6.917500 16.93394 7.586181 -1.791984      10.26655 
1 1 1 -11 21 43 o 16.87434 6.410583 4.264974       3.637159 1.930372       6.050520 5.585952       4.551285 16.16444 7.283672 18.50662 7.135826 -2.342182      10.19666 
1 1 1 -11 21 44 o 15.22565 6.248748 3.031780       3.709907 7.367682       5.874964 0.1560379      4.784543 19.64879 7.937891 13.79460 6.317179 5.854193       10.14480 
1 1 1 -11 22 1  o 119.9169 2.689063 175.3888       7.858099 176.1561       12.07004 174.8243       10.35265 120.0266 4.132792 119.6265 3.555251 0.4000702      5.451585 
1 1 1 -11 22 2  f 228.9137 3.546556 639.5838       19.78402 667.1277       31.68621 621.9855       25.32755 233.4966 5.568699 225.6090 4.606814 7.887589       7.227250 
1 1 1 -11 22 3  o 79.08890 2.686782 76.37705       5.170744 87.59515       8.040671 68.46655       6.752043 84.61076 3.910269 74.79915 3.715902 9.811607       5.394269 
1 1 1 -11 22 4  o 54.02763 3.023171 35.72137       3.964415 37.58676       5.920527 34.20516       5.337717 55.29165 4.431110 52.75645 4.186167 2.535198       6.095797 
1 1 1 -11 22 5  o 119.0851 3.588213 173.2492       10.40102 0.000000       0.000000 173.2492       10.40102 ?        ?        119.0851 3.588213 0.000000       3.588213 
1 1 1 -11 22 6  o 115.0543 3.648938 161.7465       10.21776 150.4408       16.80891 168.3725       12.86822 110.6469 6.259490 117.3038 4.510036 -6.656891      7.715026 
1 1 1 -11 22 7  o 110.7879 2.833363 149.8147       7.643178 153.2766       12.77085 147.8826       9.540460 111.8916 4.694095 110.0142 3.563342 1.877388       5.893381 
1 1 1 -11 22 8  o 242.7540 3.749955 719.4385       22.18342 686.5755       34.85311 741.8178       28.76144 236.6966 6.047406 246.3476 4.791001 -9.650955      7.715232 
1 1 1 -11 22 9  o 20.78144 6.305523 5.316563       3.471571 10.46324       6.307088 3.079554       4.158141 28.89055 8.435151 18.36870 6.881477 10.52185       10.88607 
1 1 1 -11 22 10 o 177.0791 3.549725 382.7680       15.31786 391.8814       22.43145 374.8050       20.96796 178.9208 5.150064 175.0115 4.921358 3.909286       7.123406 
1 1 1 -11 22 11 o 152.9382 2.981910 285.3759       11.11339 268.5323       17.78368 296.1685       14.23537 148.1034 4.934319 155.7429 3.750804 -7.639450      6.198068 
1 1 1 -11 22 12 f 212.8906 3.456728 553.2543       17.93320 556.0913       29.13251 551.5233       22.75556 213.0393 5.616439 212.4358 4.395655 0.6034698      7.132053 
1 1 1 -11 22 13 o 106.1178 3.202272 137.5588       8.271518 157.2583       13.04379 124.3090       10.69746 113.3055 4.734507 100.7587 4.367114 12.54684       6.441059 
1 1 1 -11 22 14 o 329.3710 6.005333 1329.764       48.20128 1285.250       83.12160 1352.317       59.16477 321.6122 10.62041 331.6722 7.320117 -10.06003      12.89873 
1 1 1 -11 22 15 o 114.6204 3.538545 160.5760       9.871929 187.1962       19.30060 151.1443       11.48843 123.3426 6.443625 111.1222 4.250354 12.22044       7.719185 
1 1 1 -11 22 16 o 208.0897 3.778172 528.9675       19.15880 509.7525       38.88084 535.1291       22.01739 203.2565 7.864578 209.2154 4.318530 -5.958908      8.972251 
1 1 1 -11 22 17 o 42.27579 4.197484 22.06215       4.267260 30.76884       11.34299 20.62676       4.605599 48.96700 9.847443 40.78997 4.720383 8.177025       10.92035 
1 1 1 -11 22 18 o 45.83082 3.572099 25.81239       3.958002 22.78010       7.222235 27.11403       4.731857 42.44389 7.242326 46.90735 4.183418 -4.463459      8.363748 
1 1 1 -11 22 19 o 82.75481 3.381534 83.78120       6.804988 67.16340       9.834248 99.04837       9.426134 73.80984 5.507221 89.88445 4.316024 -16.07462      6.996967 
1 1 1 -11 22 20 o 205.9330 3.388674 518.0503       17.00560 518.1410       27.96577 517.9971       21.42111 205.4239 5.591701 205.7672 4.271985 -0.3433228     7.036829 
1 1 1 -11 22 21 o 107.1275 3.179901 140.2932       8.292198 149.4796       13.00571 134.0009       10.76373 110.3468 4.848414 104.5615 4.233054 5.785294       6.436293 
1 1 1 -11 22 22 o 104.2634 3.581259 133.0499       9.085699 146.0904       12.54034 118.6409       13.18189 109.0826 4.728797 98.13629 5.534462 10.94633       7.279546 
1 1 1 -11 22 23 o 23.78697 6.555776 7.192136       3.921847 2.718846       7.180627 9.093799       4.681829 21.75045 8.779736 26.66368 7.085322 -4.913225      11.28209 
1 1 1 -11 22 24 o 55.08897 3.850873 37.32240       5.137081 33.71228       8.572854 39.34492       6.416702 51.77649 6.971473 56.44373 4.707925 -4.667240      8.412252 
1 1 1 -11 22 25 o 48.96027 4.102286 29.57734       4.849514 43.36742       8.972194 23.88590       5.764030 58.92915 6.347888 43.71099 5.535192 15.21815       8.422235 
1 1 1 -11 22 26 o 82.51158 3.291226 83.43105       6.604447 89.97603       11.02218 79.76489       8.249348 85.30627 5.328744 80.52598 4.218565 4.780296       6.796456 
1 1 1 -11 22 27 o 74.43490 3.441699 68.00344       6.225991 79.14793       10.63721 62.19609       7.678685 79.88506 5.497719 70.99925 4.460641 8.885811       7.079706 
1 1 1 -11 22 28 o 41.45351 7.609569 22.17995       7.403821 22.09862       10.81622 22.25166       10.15610 40.66106 10.75294 40.87802 10.22275 -0.2169609     14.83679 
1 1 1 -11 22 29 o 39.37261 4.576739 19.37551       4.309489 14.41671       7.255023 22.07908       5.356966 33.03973 8.838431 41.87872 5.372772 -8.838993      10.34333 
1 1 1 -11 22 30 o 65.87170 3.381087 53.45038       5.409235 53.65058       8.930847 53.33438       6.798013 65.36286 5.662744 65.58733 4.276623 -0.2244720     7.096208 
1 1 1 -11 22 31 o 20.26988 6.505175 5.107384       3.640592 7.188440       6.892416 4.302102       4.287496 24.90332 8.935265 19.68075 7.048993 5.222569       11.38100 
1 1 1 -11 22 32 o 10.64594 5.074111 -4.558596      3.643078 -10.97315      6.056786 -0.9223506     4.560217 12.34036 6.036878 14.78658 6.512541 -2.446226      8.880151 
1 1 1 -11 22 33 o 14.81914 6.088919 1.133528       3.527768 -3.130169      6.205269 3.169671       4.288167 15.87726 7.241720 18.14316 6.944171 -2.265903      10.03315 
1 1 1 -11 22 34 o 32.37909 5.920786 13.83344       4.499653 20.36390       10.58111 12.39175       4.971584 36.85275 10.96957 30.24020 6.899383 6.612555       12.95889 
1 1 1 -11 22 35 o 60.41454 3.535733 45.69057       5.182682 43.93370       8.273132 46.82536       6.649035 57.85624 5.952760 60.65069 4.531450 -2.794449      7.481269 
1 1 1 -11 22 36 o 48.49766 4.002502 29.91685       4.688223 24.82691       7.558123 33.09998       5.977031 41.89450 7.686392 50.50255 4.918902 -8.608047      9.125580 
1 1 1 -11 22 37 o 17.33077 6.965219 2.837426       4.497916 -4.500930      7.477772 6.997736       5.630353 16.11016 7.553819 22.43918 8.072811 -6.329018      11.05579 
1 1 1 -11 22 38 o 19.22608 6.652662 5.081211       3.794868 8.236930       5.885176 2.835241       4.964921 23.36090 8.270010 17.50999 7.212039 5.850906       10.97299 
1 1 1 -11 22 39 o 10.10222 4.860437 -4.333045      3.519387 -9.139153      5.247075 -0.4026322     4.745037 11.07094 5.456208 14.47887 6.493236 -3.407927      8.481292 
1 1 1 -11 22 40 o 24.98352 6.752560 9.566714       4.208247 10.17282       6.601098 9.151728       5.462104 24.27336 8.740011 23.59605 7.986433 0.6773014      11.83938 
1 1 1 -11 22 41 o 21.00473 8.200900 7.364225       6.068984 7.364225       6.068984 0.000000       0.000000 21.00473 8.200900 ?        ?        0.000000       8.200900 
1 1 1 -11 22 42 o 27.80094 6.284032 12.09036       4.156876 16.47268       6.436992 8.955438       5.444329 29.66126 8.480201 22.14858 7.942006 7.512678       11.61849 
1 1 1 -11 22 43 o 8.155509 4.085224 -8.109588      3.457712 -9.567449      5.568196 -7.194588      4.411303 10.79956 5.374239 9.982034 4.935028 0.8175287      7.296365 
1 1 1 -11 22 44 o 17.84959 6.737686 5.409456       4.002609 -0.6589805     6.083669 10.04123       5.314973 14.35350 6.756244 22.44621 7.866495 -8.092705      10.36960 
1 1 1 -11 23 1  o 104.5533 2.717447 133.4343       6.917778 132.8734       10.27786 133.8988       9.353736 104.2176 4.054664 104.6572 3.673279 -0.4395370     5.471131 
1 1 1 -11 23 2  o 256.3569 4.274404 802.9739       26.70279 837.8431       38.51062 770.6853       37.05815 261.5022 6.043229 250.7982 6.063497 10.70398       8.560760 
1 1 1 -11 23 3  o 179.8238 3.116069 394.5814       13.65496 384.8926       20.91626 401.7779       18.02643 177.3532 4.844132 181.3616 4.078761 -4.008423      6.332607 
1 1 1 -11 23 4  f 107.2331 2.696888 140.3502       7.041795 127.4722       10.51417 150.8255       9.482718 102.0583 4.236781 111.1010 3.506899 -9.042686      5.499877 
1 1 1 -11 23 5  o 107.7326 3.039545 141.7259       7.971819 168.7873       15.82766 132.5277       9.227714 117.2952 5.553096 104.1243 3.642295 13.17091       6.641024 
1 1 1 -11 23 6  o 285.7859 4.690646 998.4803       32.66702 1051.964       66.89642 981.7333       37.43370 291.7203 9.422586 283.2198 5.423792 8.500549       10.87210 
1 1 1 -11 23 7  o 138.5485 3.698016 234.5479       12.47436 232.8067       21.67046 235.4108       15.25535 137.6335 6.479312 138.7074 4.519252 -1.073929      7.899692 
1 1 1 -11 23 8  o 285.5117 4.714681 996.6837       32.80290 949.4346       45.86850 1046.146       46.93035 278.1529 6.766979 292.0280 6.594670 -13.87512      9.448898 
1 1 1 -11 23 9  o 102.9163 4.469156 129.7047       11.18174 143.8953       16.43333 117.4704       15.25865 108.1595 6.261600 97.65915 6.447687 10.50036       8.987786 
1 1 1 -11 23 10 o 136.9619 3.723404 229.2429       12.41575 222.4752       21.28577 232.7328       15.28534 134.5110 6.513107 137.9002 4.554813 -3.389206      7.947760 
1 1 1 -11 23 11 o 95.75776 3.597153 112.1227       8.379076 123.1708       15.48071 107.5449       9.964937 100.0055 6.385658 93.69897 4.376280 6.306534       7.741347 
1 1 1 -11 23 12 o 144.7367 3.294816 255.7222       11.62107 272.6393       24.23800 250.6724       13.24239 148.8695 6.698362 143.2071 3.797952 5.662445       7.700162 
1 1 1 -11 23 13 o 116.8417 3.133721 166.7488       8.914602 161.3782       18.38993 168.3984       10.19219 114.4573 6.621533 117.3764 3.567425 -2.919159      7.521384 
1 1 1 -11 23 14 o 169.4925 3.121379 350.6566       12.89238 337.3908       20.85912 358.8568       16.39994 165.9195 5.165255 171.3739 3.927005 -5.454361      6.488546 
1 1 1 -11 23 15 o 51.94982 3.576044 33.11803       4.499512 40.88265       8.102945 29.65642       5.410314 57.44402 5.870917 49.02641 4.581578 8.417606       7.447049 
1 1 1 -11 23 16 o 129.0827 3.197256 203.4318       10.05731 198.2914       21.76607 204.8272       11.34052 126.7534 7.074746 129.4403 3.598730 -2.686882      7.937436 
1 1 1 -11 23 17 o 89.48298 2.906982 97.83591       6.330560 87.18356       10.75950 103.4760       7.829113 84.18629 5.271078 91.97246 3.499545 -7.786163      6.327012 
1 1 1 -11 23 18 o 188.4742 3.715429 434.1307       17.06463 435.4129       24.74012 432.9671       23.56856 188.3623 5.395348 187.8911 5.152297 0.4712219      7.460291 
1 1 1 -11 23 19 o 131.0551 2.885497 209.6769       9.215323 213.3318       15.67706 207.7472       11.39114 131.8665 4.887041 130.3330 3.589969 1.533524       6.063914 
1 1 1 -11 23 20 o 173.6818 3.545844 368.6948       15.00756 348.2999       21.64523 387.5756       20.82623 168.4102 5.280740 177.7771 4.811699 -9.366867      7.144135 
1 1 1 -11 23 21 o 42.43871 4.239880 22.26707       4.326189 26.86584       7.853838 20.26390       5.183470 46.10424 7.227832 40.26962 5.419562 5.834621       9.034003 
1 1 1 -11 23 22 o 52.98699 3.362115 34.45710       4.318892 32.79913       8.149494 35.10460       5.092892 51.13632 6.700879 53.41360 3.940441 -2.277275      7.773600 
1 1 1 -11 23 23 o 23.79915 5.796508 7.249366       3.330085 6.578273       6.551095 7.483192       3.866952 24.56726 8.722601 24.20349 6.442784 0.3637753      10.84404 
1 1 1 -11 23 24 o 85.98750 3.310794 90.56966       6.924548 77.83928       10.97681 98.98440       8.924334 79.27364 5.720606 89.77707 4.089936 -10.50343      7.032277 
1 1 1 -11 23 25 o 9.600771 4.694102 -6.925821      3.647184 -11.67986      7.039226 -5.181264      4.264185 13.81688 6.702371 11.69591 5.550231 2.120974       8.702117 
1 1 1 -11 23 26 o 79.99114 4.523033 78.92319       8.780810 71.63128       11.17531 90.68895       14.19544 75.81038 6.100626 85.10522 6.903971 -9.294838      9.213167 
1 1 1 -11 23 27 o 161.4605 5.091455 322.2428       20.00788 316.0705       28.57590 328.1785       28.02303 158.6451 7.412067 161.8446 7.122716 -3.199539      10.27968 
1 1 1 -11 23 28 o 50.62749 3.933625 31.71154       4.815004 21.82671       7.995645 37.33594       6.031250 40.79401 8.325192 54.82526 4.555415 -14.03126      9.490028 
1 1 1 -11 23 29 o 23.71006 6.638988 7.278449       3.987323 5.349405       9.554296 7.685281       4.387683 25.60979 10.19894 24.37429 7.011724 1.235493       12.37669 
1 1 1 -11 23 30 o 19.83110 6.241714 4.923324       3.365374 4.557288       6.765679 5.043666       3.879346 22.34830 8.677665 20.33315 6.728184 2.015152       10.98045 
1 1 1 -11 23 31 o 30.01912 5.994469 11.75936       4.231536 17.83131       7.146203 8.480835       5.251108 36.32951 8.259589 25.42616 7.763152 10.90335       11.33523 
1 1 1 -11 23 32 o 42.76901 4.230320 22.99794       4.351293 16.07674       7.716619 26.22464       5.268849 33.96046 9.128807 45.49486 4.825968 -11.53440      10.32594 
1 1 1 -11 23 33 o 29.23691 6.396407 11.44442       4.430242 4.112262       9.385170 13.54667       5.025381 23.64285 9.842760 31.74756 6.706171 -8.104708      11.91019 
1 1 1 -11 23 34 o 52.49177 3.937558 34.72101       5.000087 38.80828       8.217113 32.31779       6.300858 54.14955 6.347482 49.99808 5.249632 4.151466       8.237061 
1 1 1 -11 23 35 o 19.50111 6.721541 4.882617       3.872410 2.519305       6.399477 6.247882       4.863986 19.29213 8.086547 21.72108 7.530895 -2.428955      11.05019 
1 1 1 -11 23 36 o 22.45641 6.666289 7.090852       3.911888 13.87960       6.298880 2.828461       4.991086 30.39534 8.280757 17.87623 7.281638 12.51911       11.02693 
1 1 1 -11 23 37 o 35.60606 5.162563 17.07612       4.348951 20.36651       6.826078 14.82800       5.642314 36.81495 7.848626 31.56228 7.455449 5.252676       10.82519 
1 1 1 -11 23 38 o 24.47745 6.640109 8.857400       4.060362 7.624934       6.324699 9.721480       5.295776 22.47970 8.473021 24.93972 7.827077 -2.460014      11.53496 
1 1 1 -11 23 39 o 19.79968 7.300996 5.711452       4.645742 4.585765       6.333812 7.022301       6.834909 19.41401 8.084369 21.55383 8.612086 -2.139820      11.81207 
1 1 1 -11 23 40 o 29.94607 7.156885 14.23343       5.151468 15.44914       6.816636 12.61459       7.866098 29.18976 8.831328 25.44216 9.478150 3.747601       12.95483 
1 1 1 -11 23 41 o 20.65580 7.516882 7.224563       4.899489 5.794315       6.228938 9.545201       7.934365 19.29020 8.023710 22.09854 9.111089 -2.808334      12.14051 
1 1 1 -11 23 42 o 29.29680 6.190107 13.47929       4.280677 11.49442       6.686126 14.85802       5.572485 23.50447 8.741851 28.75860 7.769306 -5.254124      11.69539 
1 1 1 -11 23 43 o 12.13800 5.534671 -0.3288606     3.621359 0.4592015      5.974552 -0.7865385     4.553078 14.92404 6.914761 12.96373 6.016811 1.960304       9.166020 
1 1 1 -11 24 1  o 192.3891 3.225936 451.7930       15.12420 466.3663       23.82873 441.9616       19.57179 195.1585 5.014612 190.1637 4.223445 4.994736       6.556204 
1 1 1 -11 24 2  o 44.59693 3.486525 24.43066       3.758985 23.96667       5.314987 24.89500       5.317028 43.97073 5.051908 44.84018 4.948115 -0.8694572     7.071465 
1 1 1 -11 24 3  o 257.7371 4.336850 811.9515       27.23877 863.1988       55.53028 795.7139       31.25757 264.3811 8.630693 255.0083 5.029963 9.372803       9.989465 
1 1 1 -11 24 4  o 73.20645 3.173524 65.53110       5.647996 49.90098       9.230584 74.88499       7.140759 63.52164 6.035517 78.21408 3.757470 -14.69244      7.109574 
1 1 1 -11 24 5  o 190.6370 3.214662 443.5806       14.93408 466.0336       23.78430 428.9669       19.18817 195.0984 5.006793 187.3555 4.202724 7.742828       6.536885 
1 1 1 -11 24 6  o 32.58917 5.209557 13.32006       3.997972 14.34151       7.580179 12.92641       4.705701 33.51847 9.064113 31.92123 6.273154 1.597235       11.02318 
1 1 1 -11 24 7  o 73.03947 3.330466 65.25842       5.912271 71.00782       11.64953 63.26380       6.861609 75.81780 6.363907 71.85544 3.933598 3.962364       7.481477 
1 1 1 -11 24 8  o 45.95139 4.208783 26.02041       4.660646 31.30342       9.157980 24.17389       5.414219 49.85019 7.793746 44.14988 5.127613 5.700306       9.329249 
1 1 1 -11 24 9  o 161.6665 3.495251 319.1334       13.77002 295.7253       19.37674 343.0161       19.57222 155.3510 5.125372 167.3802 4.803406 -12.02922      7.024396 
1 1 1 -11 24 10 o 111.6540 2.862449 152.2210       7.781975 162.3690       13.36987 147.0215       9.570152 115.1054 4.776834 109.6625 3.585989 5.442879       5.973061 
1 1 1 -11 24 11 o 105.3969 2.874779 135.6567       7.376709 125.2725       12.20742 141.6295       9.258250 101.0473 4.972776 107.6328 3.534580 -6.585411      6.100963 
1 1 1 -11 24 12 o 171.9905 3.153265 361.0999       13.21603 357.4474       21.67463 363.2614       16.67435 170.7636 5.214704 172.4104 3.968708 -1.646881      6.553151 
1 1 1 -11 24 13 o 126.6566 2.922674 195.7858       9.020785 190.7622       14.88516 198.7017       11.34055 124.7386 4.906417 127.4850 3.654157 -2.746399      6.117662 
1 1 1 -11 24 14 o 222.4152 3.580416 604.2948       19.40591 591.8483       31.19695 612.1506       24.78464 219.5715 5.835594 223.6807 4.546926 -4.109161      7.397885 
1 1 1 -11 24 15 f 154.4326 3.052114 291.1551       11.48619 282.0989       18.92080 296.4404       14.45438 151.6600 5.126928 155.7442 3.808479 -4.084198      6.386697 
1 1 1 -11 24 16 o 23.92543 6.793006 7.223617       4.144625 13.10812       11.40787 6.328767       4.448611 33.63614 11.53878 22.80008 7.176294 10.83605       13.58833 
1 1 1 -11 24 17 o 122.0395 2.932711 181.8290       8.721793 166.5392       14.33148 190.8228       10.99161 116.4611 5.061887 124.9056 3.614933 -8.444565      6.220164 
1 1 1 -11 24 18 o 114.7270 2.882123 160.8008       8.051381 169.8456       14.00291 156.3338       9.840743 117.6225 4.896011 113.0400 3.576899 4.582497       6.063426 
1 1 1 -11 24 19 o 49.15200 4.234799 29.79027       5.022950 25.55819       7.910473 32.64939       6.501924 44.89481 7.494554 51.31467 5.274553 -6.419861      9.164564 
1 1 1 -11 24 20 o 77.46560 3.261894 73.46314       6.143868 75.82983       10.17963 72.10706       7.705565 78.39761 5.360608 76.63533 4.141483 1.762276       6.774068 
1 1 1 -11 24 21 o 59.12099 3.261358 42.85138       4.680481 39.25356       8.774516 44.28220       5.533452 56.03765 6.548845 60.03788 3.801637 -4.000237      7.572306 
1 1 1 -11 24 22 o 36.88607 4.299280 16.89979       3.792145 16.45985       7.581329 17.04659       4.379362 35.61744 8.789219 36.92690 4.994605 -1.309464      10.10923 
1 1 1 -11 24 23 o 172.5036 3.147759 363.8917       13.23231 386.9297       22.88560 352.3221       16.21807 177.2162 5.305326 169.5696 3.924778 7.646591       6.599270 
1 1 1 -11 24 24 o 65.96333 3.131527 53.34700       5.019413 43.94712       9.223354 57.30228       5.982963 59.21249 6.498707 68.30289 3.607312 -9.090393      7.432758 
1 1 1 -11 24 25 o 59.90971 4.491591 44.38257       6.509690 34.12461       12.69106 48.04507       7.583273 50.76941 10.60067 62.23054 5.043736 -11.46113      11.73940 
1 1 1 -11 24 26 o 156.6797 5.071777 303.5510       19.33911 319.6870       28.54457 289.8600       26.29320 159.5153 7.363054 152.0282 7.116890 7.487152       10.24035 
1 1 1 -11 24 27 o 27.96618 6.117129 10.11597       4.052564 8.390335       7.563807 10.81079       4.799595 26.75234 9.383626 28.79762 6.924695 -2.045284      11.66207 
1 1 1 -11 24 28 o 36.53291 4.803070 16.80969       4.172538 14.31265       7.689727 17.85168       4.967405 32.74558 9.237728 37.45451 5.615247 -4.708931      10.81049 
1 1 1 -11 24 29 f 36.66257 4.754167 16.96234       4.147578 12.57597       7.287663 19.06373       5.044167 30.68811 9.096039 38.68930 5.505284 -8.001194      10.63231 
1 1 1 -11 24 30 o 66.78747 3.451928 55.17452       5.599079 52.14743       9.534541 56.76791       6.917467 63.87147 6.203768 67.49831 4.226721 -3.626835      7.506791 
1 1 1 -11 24 31 o 84.11115 3.678594 87.83029       7.521769 107.3413       16.09593 82.37911       8.507882 90.58318 7.354986 81.17033 4.316707 9.412842       8.528175 
1 1 1 -11 24 32 o 13.38064 5.806808 -0.2178927     3.509966 3.052380       9.446241 -0.7417318     3.780646 23.05149 9.752424 13.42495 5.920640 9.626539       11.40893 
1 1 1 -11 24 33 o 54.42546 4.228499 37.47577       5.564241 42.13258       12.12045 36.23225       6.263248 54.00578 9.559392 53.18379 4.887239 0.8219910      10.73625 
1 1 1 -11 24 34 o 29.58074 6.073770 11.87386       4.231558 12.41468       6.977487 11.55923       5.321945 28.99318 8.966501 28.52018 7.542854 0.4729919      11.71720 
1 1 1 -11 24 35 o 30.41787 5.827181 12.61136       4.162197 5.098891       6.431563 18.02480       5.459613 21.13380 8.383591 36.12087 6.438657 -14.98707      10.57076 
1 1 1 -11 24 36 o 54.53387 4.354645 38.66521       5.738982 35.13340       10.72607 40.08184       6.793136 46.59771 9.759068 54.86694 5.140560 -8.269226      11.03018 
1 1 1 -11 24 37 o 36.25365 4.959487 17.72485       4.266777 22.16936       6.961901 15.05113       5.399755 38.18227 7.747354 31.77077 7.147901 6.411495       10.54106 
1 1 1 -11 24 38 o 38.73211 4.857413 20.35394       4.484156 19.66481       7.405270 20.75292       5.634649 34.19954 8.826208 37.84966 6.332504 -3.650120      10.86290 
1 1 1 -11 24 39 o 15.49935 6.306563 2.528919       3.739015 1.805555       6.150224 2.953024       4.709223 17.00640 7.523460 16.73831 6.970580 0.2680931      10.25629 
1 1 1 -11 24 40 o 15.77976 7.156129 0.6647867      5.952053 0.6647867      5.952053 0.000000       0.000000 15.77976 7.156129 ?        ?        0.000000       7.156129 
1 1 1 -11 24 41 o 15.40409 6.307255 2.897435       3.768566 5.236784       6.217607 1.538959       4.738074 18.50888 7.874631 14.98264 6.616953 3.526235       10.28561 
1 1 1 -11 24 42 o 19.32814 6.789186 6.382653       3.960396 7.579962       6.356711 5.623059       5.063142 19.85146 8.166828 18.25750 7.371481 1.593956       11.00163 
1 1 1 -11 25 1  o 64.49750 2.983015 50.88001       4.675808 43.41530       6.543321 58.66940       6.684109 59.40319 4.554892 69.17345 3.982055 -9.770260      6.050107 
1 1 1 -11 25 2  o 96.31557 2.736896 113.2814       6.417270 119.5992       9.753101 108.4582       8.521792 98.83903 4.057913 94.15163 3.721545 4.687393       5.506047 
1 1 1 -11 25 3  f 140.3899 3.215771 240.6107       11.00163 230.0400       20.63319 244.8097       13.00446 136.7754 6.206625 141.5083 3.774526 -4.732880      7.264244 
1 1 1 -11 25 4  o 74.96925 2.845832 68.68288       5.189665 71.28748       7.760891 66.57623       6.979697 76.25117 4.192796 73.71269 3.899473 2.538475       5.725856 
1 1 1 -11 25 5  o 206.9881 3.801169 523.4359       19.17338 464.0755       35.87601 547.1691       22.68475 193.9746 7.604406 211.5320 4.400700 -17.55742      8.785964 
1 1 1 -11 25 6  o 73.64918 3.346433 66.36495       5.990318 74.55974       12.09511 63.70155       6.895407 77.66358 6.448943 72.09450 3.939811 5.569084       7.557180 
1 1 1 -11 25 7  o 191.1633 3.668209 446.3898       17.08814 403.4567       32.54634 462.7293       20.07824 180.8916 7.398868 194.5487 4.235076 -13.65706      8.525205 
1 1 1 -11 25 8  o 113.6757 3.709636 158.0293       10.26250 150.3530       17.27356 162.2169       12.75829 110.4645 6.444855 115.0669 4.558966 -4.602356      7.894322 
1 1 1 -11 25 9  o 83.60327 3.053283 85.43008       6.210069 77.14684       10.36478 90.06886       7.756422 79.16660 5.404988 85.78270 3.719280 -6.616096      6.561017 
1 1 1 -11 25 10 o 32.93995 5.163980 13.60512       4.009043 12.53725       6.968763 14.13336       4.901323 31.39044 8.772250 33.40013 6.251556 -2.009695      10.77192 
1 1 1 -11 25 11 o 67.00834 3.296292 54.96082       5.366063 52.77620       9.218781 56.08030       6.599252 65.33311 5.852262 67.61420 4.023361 -2.281082      7.101859 
1 1 1 -11 25 12 o 41.96241 4.288708 21.75828       4.323933 16.33313       7.559906 24.39588       5.271261 35.63540 8.766779 44.36147 4.960944 -8.726074      10.07310 
1 1 1 -11 25 13 o 24.50650 6.220581 7.662018       3.720747 1.518398       6.882540 10.19896       4.422746 20.50067 8.472275 28.24462 6.552737 -7.743944      10.71064 
1 1 1 -11 25 14 o 181.8904 3.250287 404.0599       14.40681 434.1426       24.56562 388.2891       17.78669 188.0849 5.365149 178.1826 4.096320 9.902313       6.750160 
1 1 1 -11 25 15 o 112.9626 3.290006 156.0029       9.046996 166.9844       20.67589 153.4026       10.06130 116.1174 7.344491 111.9675 3.692498 4.149925       8.220468 
1 1 1 -11 25 16 o 223.5664 3.626026 610.9624       19.75484 611.4887       32.27187 610.6470       24.98238 222.9830 5.944343 223.2928 4.591167 -0.3098145     7.510927 
1 1 1 -11 25 17 o 105.2144 2.946471 135.2927       7.547198 148.4054       13.37266 129.1639       9.142374 109.8931 5.006727 102.7167 3.658273 7.176414       6.200828 
1 1 1 -11 25 18 o 104.0573 2.926672 132.3467       7.413977 150.3635       13.34226 124.2984       8.917475 110.6056 4.962765 100.7539 3.637954 9.851677       6.153352 
1 1 1 -11 25 19 o 199.0578 3.780946 484.8002       18.34069 507.2638       27.69337 467.2495       24.47844 203.0413 5.602356 195.0090 5.155539 8.032257       7.613539 
1 1 1 -11 25 20 o 134.3403 2.946427 220.4967       9.645795 225.3091       16.47507 217.9867       11.89828 135.3618 5.003145 133.4249 3.662877 1.936905       6.200655 
1 1 1 -11 25 21 o 32.05463 4.974339 12.91757       3.759766 20.00711       7.747793 10.73385       4.299997 39.34090 8.340769 28.93899 6.278337 10.40191       10.43963 
1 1 1 -11 25 22 o 61.11099 3.244367 45.81422       4.814225 31.91964       9.070949 51.26266       5.680227 50.08376 7.676590 64.60065 3.622731 -14.51690      8.488476 
1 1 1 -11 25 23 o 30.33920 6.458943 11.83391       4.628716 9.388801       7.860372 13.13188       5.726981 28.12905 9.579906 31.82878 7.506356 -3.699734      12.17045 
1 1 1 -11 25 24 o 114.5748 3.786493 161.2413       10.55761 170.9304       20.31246 157.6549       12.35802 116.7817 7.172189 113.1074 4.492483 3.674210       8.463019 
1 1 1 -11 25 25 o 99.38412 2.872116 121.0054       6.948632 116.8430       12.50539 122.8645       8.357589 97.02263 5.309416 100.0292 3.433700 -3.006584      6.322989 
1 1 1 -11 25 26 o 42.76575 4.012799 22.71138       4.133103 31.95919       11.31083 21.28628       4.440157 48.93784 9.826161 41.29190 4.484563 7.645935       10.80115 
1 1 1 -11 25 27 o 22.45634 6.587267 6.475485       3.838601 3.709067       7.415229 7.488206       4.486529 22.36960 8.959349 24.10207 7.135198 -1.732471      11.45343 
1 1 1 -11 25 28 o 76.86578 3.345100 72.84847       6.250823 76.85464       10.60112 70.71329       7.739348 78.13910 5.604559 75.46428 4.225369 2.674820       7.018891 
1 1 1 -11 25 29 o 49.47828 3.905066 30.49554       4.670316 26.93881       8.226248 32.18722       5.673282 45.05873 7.772525 50.61399 4.651664 -5.555252      9.058152 
1 1 1 -11 25 30 o 67.59123 3.884404 56.91071       6.371152 50.23445       9.473242 62.42435       8.608977 62.37248 6.319727 70.27540 5.060933 -7.902920      8.096418 
1 1 1 -11 25 31 o 14.00627 6.020853 0.8166086E-01  3.703484 -1.966324      8.754808 0.5280195      4.087194 19.58176 8.797729 15.06256 6.395571 4.519195       10.87674 
1 1 1 -11 25 32 o 29.06227 6.824851 11.55480       4.750488 0.000000       0.000000 11.55480       4.750488 ?        ?        29.06227 6.824851 0.000000       6.824851 
1 1 1 -11 25 33 o 16.47103 6.488040 2.485412       3.827232 1.795714       6.930903 2.787975       4.590588 19.34744 8.275101 17.67779 7.059737 1.669655       10.87737 
1 1 1 -11 25 34 o 34.40977 5.334898 15.78595       4.328736 16.94923       6.965859 15.05412       5.525038 33.62675 8.498269 32.52354 7.164897 1.103207       11.11559 
1 1 1 -11 25 35 o 37.53492 5.445642 19.05187       4.835770 9.670283       9.728790 22.13033       5.572978 25.45986 10.23975 40.19634 5.861851 -14.73648      11.79889 
1 1 1 -11 25 36 o 14.73768 6.169435 1.431357       3.717460 7.128901       6.206924 -1.755563      4.642138 22.14064 8.382908 13.55342 6.212605 8.587218       10.43406 
1 1 1 -11 25 37 o 38.96801 4.891030 20.57634       4.542512 17.58654       7.215806 22.53898       5.846354 32.28502 8.890318 39.60888 6.265140 -7.323860      10.87611 
1 1 1 -11 25 38 o 13.85142 6.053309 0.6026595      3.871149 5.295953       6.157042 -2.465507      4.978204 19.65733 8.056833 13.28614 6.208134 6.371185       10.17121 
1 1 1 -11 25 39 o 30.67731 8.756978 17.19820       6.869281 17.19820       6.869281 0.000000       0.000000 30.67731 8.756978 ?        ?        0.000000       8.756978 
1 1 1 -11 25 40 o 11.92904 5.493295 -1.097464      3.687507 2.373162       6.378099 -2.840016      4.519394 16.79438 7.530168 12.08466 5.728635 4.709726       9.461537 
1 1 1 -11 25 41 o 12.81082 5.771894 0.1188644      3.798310 0.8431838      6.053088 -0.3515807     4.878277 15.39788 7.071432 13.71202 6.315774 1.685861       9.481253 
1 1 1 -11 26 1  o 139.4826 2.898102 237.4688       9.850760 247.6691       15.26568 230.1909       12.89468 142.2158 4.410193 137.1818 3.861093 5.033951       5.861556 
1 1 1 -11 26 2  o 59.47094 3.519812 43.35416       5.078245 50.26407       9.449609 40.54820       6.021689 63.68818 6.165647 57.41471 4.335915 6.273464       7.537596 
1 1 1 -11 26 3  o 102.2869 2.758533 127.7726       6.869698 127.1894       10.40681 128.2229       9.145402 101.8999 4.199906 102.3772 3.671700 -0.4773254     5.578583 
1 1 1 -11 26 4  o 47.27969 3.407498 27.44206       3.899629 24.17060       5.528321 30.68197       5.501592 44.11000 5.245670 49.86717 4.578334 -5.757172      6.962628 
1 1 1 -11 26 5  o 63.01899 3.010908 48.58899       4.610489 59.50435       6.887317 39.72586       6.206182 69.64674 4.075824 56.80370 4.520711 12.84303       6.086802 
1 1 1 -11 26 6  o 54.94646 3.871338 37.08061       5.150485 24.25550       9.777216 42.00656       6.059402 43.40152 9.507842 58.45090 4.283799 -15.04939      10.42833 
1 1 1 -11 26 7  o 17.93776 7.208923 1.848739       4.818003 -3.855074      8.023271 5.065560       6.025350 18.67942 8.404730 22.63648 8.320236 -3.957060      11.82649 
1 1 1 -11 26 8  o 144.5998 3.335526 255.3642       11.75352 258.2309       23.61832 254.4205       13.55059 144.7417 6.714353 144.2242 3.858997 0.5175629      7.744313 
1 1 1 -11 26 9  o 30.42530 6.265328 11.78592       4.490521 4.954123       8.836075 14.16475       5.214035 25.33052 9.893784 33.36242 6.646810 -8.031897      11.91919 
1 1 1 -11 26 10 o 156.8134 3.114463 300.2592       11.90152 293.2948       19.43757 304.4361       15.05322 154.6119 5.166224 157.8031 3.914512 -3.191223      6.481764 
1 1 1 -11 26 11 o 49.08695 4.004508 29.65816       4.748589 24.22744       8.179492 32.41902       5.832028 43.62317 7.988672 51.23964 4.723791 -7.616478      9.280791 
1 1 1 -11 26 12 o 135.3933 3.038147 223.8368       10.02402 213.3223       16.73735 229.7174       12.51716 131.7983 5.221569 137.0325 3.751933 -5.234146      6.429758 
1 1 1 -11 26 13 o 194.5995 3.389614 462.6920       16.07416 497.0601       27.43491 444.7271       19.83528 201.1403 5.602626 190.6297 4.269840 10.51054       7.044214 
1 1 1 -11 26 14 o 214.3232 4.622125 562.7007       24.14054 625.2868       46.07439 539.0183       28.34225 224.3789 8.441441 209.4427 5.557980 14.93614       10.10688 
1 1 1 -11 26 15 o 270.3386 4.093198 894.4396       26.96540 920.8307       44.34018 878.9505       33.96901 273.3031 6.657586 267.6206 5.208675 5.682526       8.453032 
1 1 1 -11 26 16 o 153.4677 3.495833 287.9426       13.07386 270.3093       19.03725 303.6821       17.98596 148.2838 5.276759 157.3244 4.696646 -9.040588      7.064182 
1 1 1 -11 26 17 o 37.99902 4.634043 17.96024       4.202448 32.13241       8.396381 13.22339       4.854211 50.53496 7.006349 32.20007 6.411649 18.33490       9.497272 
1 1 1 -11 26 18 o 93.56928 2.985423 107.0819       6.798594 114.2411       12.15179 103.8200       8.202454 96.28800 5.198104 92.04306 3.664253 4.244942       6.359798 
1 1 1 -11 26 19 o 105.5149 3.263973 136.2770       8.382502 136.7577       13.12870 135.9462       10.89156 105.3489 5.129354 105.2185 4.256567 0.1304550      6.665481 
1 1 1 -11 26 20 o 159.3842 3.100026 310.6331       12.04056 304.0141       20.11368 314.3297       15.03136 157.0657 5.262446 160.1747 3.850953 -3.108978      6.520980 
1 1 1 -11 26 21 o 76.49115 3.652096 71.84034       6.787864 69.66821       10.35754 73.47556       8.986729 74.90656 5.717347 77.14530 4.804153 -2.238747      7.467793 
1 1 1 -11 26 22 o 72.24621 3.743517 64.17466       6.568213 79.29538       10.55596 54.62189       8.390277 79.94958 5.450680 66.34032 5.232272 13.60926       7.555567 
1 1 1 -11 26 23 o 109.2480 3.437511 146.4606       9.140138 156.8389       14.42700 139.5019       11.81344 112.5232 5.276050 106.3285 4.569887 6.194641       6.980012 
1 1 1 -11 26 24 o 111.5800 2.891676 152.5559       7.856079 158.7033       14.24677 149.8699       9.417253 113.1107 5.182415 110.4473 3.503344 2.663399       6.255465 
1 1 1 -11 26 25 o 67.53554 3.355683 56.14413       5.505376 63.77727       14.52550 54.86368       5.949245 70.08170 8.691470 66.69147 3.674831 3.390228       9.436421 
1 1 1 -11 26 26 o 72.14092 3.018951 63.98592       5.295572 73.81491       10.43078 60.57282       6.146624 76.67489 5.621556 70.05036 3.612933 6.624527       6.682453 
1 1 1 -11 26 27 o 84.02866 2.911425 86.81847       5.952680 103.1064       11.80565 81.26566       6.893078 90.62453 5.369815 81.13100 3.494700 9.493538       6.406859 
1 1 1 -11 26 28 o 52.87508 3.269186 34.59614       4.191772 48.49902       8.917352 30.65273       4.749187 61.60593 6.016468 49.57593 3.964085 12.03000       7.204988 
1 1 1 -11 26 29 o 55.75521 4.219075 38.96446       5.689886 46.83427       9.378317 34.38021       7.157755 60.06077 6.511692 51.72253 5.777415 8.338242       8.705208 
1 1 1 -11 26 30 o 15.49273 6.324153 1.469193       3.774465 1.306397       9.185205 1.502269       4.140178 21.75910 9.418341 16.06750 6.598466 5.691599       11.49978 
1 1 1 -11 26 31 o 55.04224 4.062770 38.22696       5.411064 41.90880       12.21290 37.32767       6.035824 53.72178 9.685166 54.11764 4.620965 -0.3958549     10.73106 
1 1 1 -11 26 32 o 36.55079 4.963932 17.41667       4.307228 18.16545       7.516046 17.05051       5.255886 35.10861 8.802377 35.48001 6.310182 -0.3714066     10.83052 
1 1 1 -11 26 33 o 26.92850 6.337779 10.09826       4.089325 17.88149       7.010652 6.084418       5.034530 34.65294 8.392119 21.38310 7.640772 13.26985       11.34941 
1 1 1 -11 26 34 o 22.56287 7.169333 7.342993       4.430510 5.069442       9.761447 7.932877       4.972158 22.64194 9.754402 23.29009 7.612653 -0.6481533     12.37339 
1 1 1 -11 26 35 o 36.65305 5.208328 18.22262       4.521251 19.39535       7.447918 17.53827       5.689509 34.71859 8.794648 34.61013 6.986875 0.1084595      11.23220 
1 1 1 -11 26 36 f 25.96659 6.284665 9.856672       3.933532 14.58804       6.640426 7.299009       4.882298 29.59856 8.658916 21.90771 7.547434 7.690849       11.48654 
1 1 1 -11 26 37 o 47.22967 4.337911 29.78426       4.936937 25.85868       7.681391 32.54713       6.444193 39.89487 8.176055 48.03657 5.610578 -8.141693      9.915970 
1 1 1 -11 26 38 o 17.53363 7.813372 2.337549       6.755363 2.337549       6.755363 0.000000       0.000000 17.53363 7.813372 ?        ?        0.000000       7.813372 
1 1 1 -11 26 39 f 13.46112 6.208452 -0.9252373     4.736205 0.7056174      6.010685 -3.596155      7.692130 15.65068 7.134103 15.09498 7.242560 0.5557022      10.16613 
1 1 1 -11 26 40 o 9.938727 4.823154 -4.400601      3.655296 -3.990597      5.946605 -4.649597      4.634161 13.13731 6.319996 11.30721 5.473835 1.830100       8.360933 
1 1 1 -11 26 41 o 15.44987 6.288592 3.226821       3.719256 4.590446       6.397653 2.530702       4.571044 17.59951 7.733953 15.31292 6.636089 2.286591       10.19077 
1 1 1 -11 27 1  o 35.07685 4.992573 15.37650       4.147227 19.23391       6.869143 13.16393       5.202401 38.83372 7.530512 32.09414 6.859867 6.739582       10.18658 
1 1 1 -11 27 2  o 188.8651 3.261371 435.6955       15.01025 432.3278       23.03445 438.1810       19.78873 187.7461 5.039224 189.2322 4.291278 -1.486130      6.618825 
1 1 1 -11 27 3  o 123.3955 2.842993 185.8723       8.548921 165.2131       12.36377 204.7977       11.83364 116.1065 4.377607 129.3814 3.757256 -13.27484      5.768919 
1 1 1 -11 27 4  o 211.0966 3.460654 544.4588       17.80227 535.2532       27.41007 551.1749       23.41236 208.8269 5.390771 212.1869 4.527834 -3.359985      7.040007 
1 1 1 -11 27 5  o 133.8133 3.261445 218.7101       10.63519 205.6505       14.13948 235.7243       16.13894 129.5389 4.485936 138.6443 4.783965 -9.105453      6.558197 
1 1 1 -11 27 6  o 130.0867 3.950973 207.1276       12.51034 237.6584       21.59522 191.7059       15.34810 138.8589 6.399074 124.9642 5.050433 13.89467       8.151995 
1 1 1 -11 27 7  o 120.8468 3.236843 178.5055       9.523610 175.3474       18.39676 179.6617       11.13124 119.2349 6.354381 121.1691 3.774378 -1.934212      7.390811 
1 1 1 -11 27 8  o 166.2857 4.026544 338.2134       16.31637 327.6299       27.92916 343.6971       20.10381 162.8692 7.053645 167.3956 4.933695 -4.526413      8.607860 
1 1 1 -11 27 9  o 175.9586 3.582421 378.4235       15.36113 368.9916       30.36208 381.6683       17.80849 172.7850 7.226853 176.6197 4.137630 -3.834747      8.327508 
1 1 1 -11 27 10 f 134.6090 3.321920 221.3838       10.89681 200.6917       21.51834 228.5200       12.63690 127.3913 6.958005 136.6516 3.798491 -9.260269      7.927319 
1 1 1 -11 27 11 o 89.13365 3.095514 97.15801       6.713530 97.06653       11.40147 97.20657       8.306186 88.78084 5.293978 89.06902 3.835819 -0.2881851     6.537561 
1 1 1 -11 27 12 o 66.52071 3.386719 54.21955       5.471931 59.06458       9.786486 52.01596       6.600011 69.06626 5.870233 65.05383 4.185490 4.012436       7.209574 
1 1 1 -11 27 13 f 112.1570 3.929281 154.1051       10.72270 175.1014       22.37066 147.8424       12.21765 118.6569 7.779499 109.7445 4.578506 8.912415       9.026812 
1 1 1 -11 27 14 o 40.65766 4.653850 20.52478       4.527966 12.53926       8.035500 24.24012       5.481009 31.55355 9.597169 44.13706 5.195297 -12.58351      10.91315 
1 1 1 -11 27 15 o 175.6733 3.655469 377.5249       15.64894 391.1576       23.46188 366.5995       21.00352 178.3179 5.405473 172.7452 4.994664 5.572647       7.359742 
1 1 1 -11 27 16 o 142.5316 3.068764 248.2770       10.65886 273.6567       18.61566 235.8982       13.00095 149.1518 5.129330 138.7610 3.848499 10.39082       6.412564 
1 1 1 -11 27 17 o 74.58649 3.235466 68.15515       5.866768 58.90906       10.57658 72.26440       7.050943 68.76776 6.384283 76.73116 3.782509 -7.963394      7.420677 
1 1 1 -11 27 18 o 97.00829 3.324734 115.2676       7.848009 111.7807       12.17753 117.7446       10.26376 95.14943 5.272521 97.87216 4.313996 -2.722733      6.812491 
1 1 1 -11 27 19 o 90.58268 3.470770 100.6088       7.647207 101.1459       11.89687 100.2306       9.982763 90.41736 5.424331 90.20752 4.555964 0.2098389      7.083796 
1 1 1 -11 27 20 o 164.2302 3.623789 330.5672       14.50280 364.3128       22.23689 305.5880       19.13171 171.7511 5.319395 157.4137 4.993731 14.33743       7.296116 
1 1 1 -11 27 21 o 141.3057 3.517347 244.7956       12.11186 243.6899       18.11235 245.6900       16.28977 140.3414 5.305614 141.1322 4.743188 -0.7908020     7.116697 
1 1 1 -11 27 22 o 42.76771 4.235237 22.72439       4.356069 32.52694       8.498313 19.23104       5.073223 50.50560 7.100704 39.03810 5.483836 11.46750       8.971759 
1 1 1 -11 27 23 o 186.7806 3.326635 428.1306       15.14165 419.3131       25.22415 433.0978       18.93209 183.5399 5.646334 187.4929 4.143599 -3.952988      7.003606 
1 1 1 -11 27 24 o 72.96203 3.285669 65.51234       5.826947 53.39565       14.67172 67.78145       6.349155 63.38884 9.814963 74.16278 3.523201 -10.77394      10.42816 
1 1 1 -11 27 25 o 52.82761 3.401869 34.47534       4.356120 38.89600       9.178700 33.19018       4.948973 54.97978 7.010026 51.70401 3.957937 3.275776       8.050200 
1 1 1 -11 27 26 o 89.17934 2.903504 97.81499       6.301495 95.52747       11.83433 98.72023       7.444657 87.02998 5.609941 89.42966 3.422388 -2.399689      6.571466 
1 1 1 -11 27 27 o 95.37179 3.319133 112.3740       7.702260 108.2469       12.44071 114.9392       9.808069 92.47040 5.546344 96.06051 4.200041 -3.590111      6.957174 
1 1 1 -11 27 28 o 28.91565 6.448829 11.13987       4.428355 10.99336       7.622142 11.21452       5.440816 28.49177 9.431107 28.70131 7.643243 -0.2095470     12.13940 
1 1 1 -11 27 29 o 64.06226 3.269121 50.98235       5.086642 45.93699       12.69744 51.94683       5.551579 57.00421 9.472906 64.55985 3.542300 -7.555645      10.11355 
1 1 1 -11 27 30 o 70.29252 3.047675 61.37331       5.208116 42.92325       9.329186 69.72675       6.277366 56.54071 6.914618 74.73093 3.456358 -18.19022      7.730353 
1 1 1 -11 27 31 o 21.81957 6.710566 6.488714       3.914652 6.232903       6.900243 6.610124       4.753695 22.77951 8.785578 22.15842 7.450534 0.6210842      11.51941 
1 1 1 -11 27 32 o 15.98759 6.332801 2.368343       3.664778 0.7323141      6.539526 3.117380       4.424889 17.94365 7.854063 17.64514 6.968289 0.2985039      10.49968 
1 1 1 -11 27 33 o 45.18354 4.223328 26.46014       4.596318 22.83086       7.517739 28.62662       5.808386 38.93729 8.183286 46.28962 5.241267 -7.352322      9.717873 
1 1 1 -11 27 34 o 9.650615 4.739970 -6.857040      3.850499 -0.5506491E-01 8.698533 -8.514692      4.294129 18.87408 8.595236 9.831637 4.862199 9.042445       9.875174 
1 1 1 -11 27 35 o 14.22607 6.212309 0.4712565      4.070450 -4.219707      8.491039 1.870926       4.638127 16.63421 7.875552 16.09996 6.823553 0.5342522      10.42042 
1 1 1 -11 27 36 o 15.62762 6.427341 2.359274       3.935760 -2.989617      6.497706 5.458994       4.946401 14.90830 7.006441 19.50292 7.459731 -4.594624      10.23415 
1 1 1 -11 27 37 o 33.41389 5.520548 16.04529       4.338323 13.58098       7.036099 17.55677       5.510440 26.81173 9.064446 33.51765 6.973802 -6.705921      11.43670 
1 1 1 -11 27 38 o 16.52128 6.968551 3.161568       4.799220 1.828779       6.200671 5.152868       7.579250 16.50595 7.410873 19.15433 8.417534 -2.648376      11.21499 
1 1 1 -11 27 39 o 16.09063 6.483921 3.493974       3.908888 -0.8881402     6.403466 6.096742       4.935043 14.94790 7.002861 19.05134 7.407418 -4.103438      10.19362 
1 1 1 -11 27 40 o 41.84187 4.750709 25.06561       4.758368 26.22572       7.870785 24.39736       5.973655 36.37101 8.943703 38.90440 6.532222 -2.533386      11.07519 
1 1 1 -11 28 1  o 106.2448 3.216459 138.0490       8.318049 150.8127       15.95662 133.2863       9.747194 110.5703 5.943820 104.3114 3.841084 6.258858       7.076929 
1 1 1 -11 28 2  o 78.20486 2.965719 74.80258       5.641729 70.25578       8.151214 78.98367       7.816526 75.60583 4.443755 80.24111 4.010138 -4.635284      5.985663 
1 1 1 -11 28 3  o 63.04226 3.131783 48.67022       4.796204 52.30701       7.028894 45.50154       6.560968 65.19939 4.450607 60.78809 4.460126 4.411304       6.300844 
1 1 1 -11 28 4  o 80.49496 3.261240 79.30019       6.383920 71.92284       8.371368 89.55272       9.868748 76.49270 4.510999 85.34332 4.764130 -8.850624      6.560949 
1 1 1 -11 28 5  o 282.4688 4.683125 977.8545       32.23609 926.5861       43.64477 1039.396       47.81792 274.2134 6.531417 290.3109 6.759135 -16.09756      9.399220 
1 1 1 -11 28 6  o 145.5684 3.294335 258.9393       11.68614 247.7951       15.87820 272.1101       17.26173 142.1354 4.590214 148.9154 4.762859 -6.780014      6.614748 
1 1 1 -11 28 7  o 91.76678 3.307393 103.0413       7.384083 103.1804       14.31905 102.9909       8.618415 91.28704 6.478884 91.67358 3.866547 -0.3865433     7.544940 
1 1 1 -11 28 8  o 53.37256 4.214079 35.09053       5.436522 29.87484       10.55702 36.97287       6.342112 48.17883 9.328984 54.70728 4.806009 -6.528450      10.49417 
1 1 1 -11 28 9  o 101.0118 3.301521 124.8296       8.115931 134.3277       16.46711 121.7822       9.327474 104.1902 6.518319 99.69714 3.846456 4.493065       7.568600 
1 1 1 -11 28 10 o 153.5763 3.452578 288.3456       12.92123 245.8161       24.71939 304.3348       15.15674 140.8257 7.227280 157.6468 3.948449 -16.82112      8.235522 
1 1 1 -11 28 11 o 75.32484 3.555385 69.53916       6.507790 97.02189       14.00009 61.96402       7.350153 88.45356 6.541291 70.99886 4.267942 17.45470       7.810494 
1 1 1 -11 28 12 o 187.3743 3.781215 429.6279       17.26544 422.8875       36.98891 431.5056       19.52271 184.2417 8.259489 187.6729 4.268766 -3.431274      9.297394 
1 1 1 -11 28 13 o 77.71115 3.286465 73.96630       6.209646 85.69815       11.09323 68.61274       7.493701 83.28898 5.496279 74.72565 4.131274 8.563324       6.875791 
1 1 1 -11 28 14 o 178.0412 3.716622 388.0341       16.12519 391.9662       23.93179 384.7644       21.82279 178.3621 5.512621 176.8660 5.068481 1.496063       7.488558 
1 1 1 -11 28 15 o 228.4978 3.719447 639.3187       20.71078 672.7668       34.78584 620.9512       25.77749 233.3403 6.122826 224.8593 4.704286 8.480988       7.721354 
1 1 1 -11 28 16 o 225.8952 4.186066 625.9233       23.04353 640.7621       33.70048 612.8934       31.57976 227.6401 6.080514 222.7667 5.822303 4.873367       8.418543 
1 1 1 -11 28 17 o 130.8860 4.075914 210.3637       12.98448 212.6745       16.59176 206.7119       20.85720 131.2870 5.196289 128.9129 6.661918 2.374100       8.448820 
1 1 1 -11 28 18 o 98.78510 3.470566 119.6926       8.341661 126.0167       12.83205 115.0643       10.97762 100.9454 5.234313 96.59261 4.677578 4.352745       7.019813 
1 1 1 -11 28 19 o 180.3389 3.308988 398.4232       14.54188 415.5768       24.75764 389.3881       17.96805 183.2013 5.551956 178.0092 4.142118 5.192169       6.926858 
1 1 1 -11 28 20 o 120.9966 3.240725 179.5446       9.546849 193.1653       21.40907 176.1639       10.66603 123.9997 7.114887 119.7445 3.659497 4.255226       8.000846 
1 1 1 -11 28 21 o 41.51153 4.202473 21.43763       4.192684 23.82528       8.118982 20.56936       4.896026 42.72149 8.094873 40.46125 5.077047 2.260239       9.555281 
1 1 1 -11 28 22 o 136.0372 3.013003 226.9400       9.988339 255.9956       18.10624 214.2299       11.97536 143.4965 5.186398 131.8973 3.729517 11.59920       6.388115 
1 1 1 -11 28 23 o 63.76198 3.909581 50.32507       6.045540 61.69006       14.31556 47.85828       6.669443 68.62535 8.759691 62.03204 4.441409 6.593307       9.821319 
1 1 1 -11 28 24 o 123.3421 2.940825 186.8409       8.839278 185.6993       15.48660 187.3925       10.76503 121.8264 5.228666 123.2362 3.588422 -1.409882      6.341587 
1 1 1 -11 28 25 o 121.9229 2.931418 182.7836       8.709617 184.7238       15.35183 181.8627       10.57650 121.2865 5.206240 121.2936 3.582150 -0.7141113E-02 6.319552 
1 1 1 -11 28 26 o 15.81719 6.373407 1.672770       3.776564 5.908668       7.391524 0.1763384      4.393289 23.74097 9.109360 15.34255 6.575798 8.398419       11.23484 
1 1 1 -11 28 27 o 42.28408 4.930845 22.81243       4.985585 22.17862       11.09676 22.97272       5.580527 38.63376 11.16214 42.18219 5.564457 -3.548435      12.47223 
1 1 1 -11 28 28 o 30.38134 5.019920 11.98563       3.586867 6.352895       8.713317 13.13490       3.935814 24.55689 9.752725 31.74072 5.273371 -7.183832      11.08711 
1 1 1 -11 28 29 o 18.83545 5.890135 4.638898       3.001763 3.168377       6.701628 5.007973       3.357392 20.28954 8.370169 19.56221 6.243832 0.7273312      10.44247 
1 1 1 -11 28 30 o 64.37459 3.090539 51.71440       4.834086 53.17017       9.182750 51.15630       5.685704 63.24781 6.030794 63.71465 3.677546 -0.4668427     7.063627 
1 1 1 -11 28 31 f 27.07444 5.516147 9.950301       3.515716 10.68696       6.699719 9.670362       4.130050 26.64428 8.842827 26.22865 6.495900 0.4156246      10.97234 
1 1 1 -11 28 32 o 68.42706 3.126895 58.94342       5.200294 38.16488       8.686926 70.54855       6.492073 51.73223 7.076045 74.50060 3.586452 -22.76836      7.933035 
1 1 1 -11 28 33 f 17.31294 6.633442 3.564008       3.915760 -0.3611218     8.398379 4.654319       4.426329 18.48747 8.429386 18.92783 7.098062 -0.4403553     11.01985 
1 1 1 -11 28 34 o 23.38065 6.665672 8.144325       3.982548 1.064071       6.233529 13.02764       5.176866 17.09432 7.567718 29.18509 7.298560 -12.09076      10.51377 
1 1 1 -11 28 35 o 19.22223 6.776494 5.404411       3.948180 8.489422       6.395253 3.504476       5.018787 22.70127 8.527967 17.63155 7.255435 5.069719       11.19676 
1 1 1 -11 28 36 o 14.55671 6.281683 1.294471       4.061392 2.081814       6.585673 0.8112494      5.159306 17.35580 7.725586 15.35117 6.835325 2.004632       10.31535 
1 1 1 -11 28 37 o 13.81326 6.880529 -13.26238      9.217061 -13.26238      9.217061 0.000000       0.000000 13.81326 6.880529 ?        ?        0.000000       6.880529 
1 1 1 -11 28 38 o 22.32745 7.033670 8.488379       4.272654 10.47851       6.665522 7.100306       5.566728 22.80915 8.675201 20.04755 7.846339 2.761602       11.69719 
1 1 1 -11 28 39 o 20.25828 6.947532 7.108310       4.135591 3.643822       6.683588 9.257728       5.264421 17.27375 7.729489 22.06601 7.820742 -4.792257      10.99586 
1 1 1 -11 29 1  o 19.22769 7.633302 2.491321       5.335770 -3.998662      6.463791 16.37340       9.453505 16.23803 7.400400 35.65926 10.30253 -19.42123      12.68495 
1 1 1 -11 29 2  o 104.4274 3.673965 133.5806       9.334870 140.0378       15.66156 130.0226       11.62562 106.4462 6.062733 102.8608 4.650016 3.585327       7.640640 
1 1 1 -11 29 3  o 166.5076 4.054358 339.4880       16.45100 334.6094       27.66083 342.1581       20.46353 164.3931 6.920188 166.8629 5.038281 -2.469803      8.559981 
1 1 1 -11 29 4  o 211.8468 5.568789 552.3019       28.72381 591.4534       41.33956 515.7568       39.93981 218.2076 7.786760 203.6056 8.065667 14.60196       11.21109 
1 1 1 -11 29 5  o 130.8719 3.794809 209.7688       12.08964 220.7013       20.99525 204.3456       14.78726 133.5948 6.468268 128.9873 4.712327 4.607529       8.002781 
1 1 1 -11 29 6  o 64.34067 4.275929 50.94052       6.666238 63.35519       11.26116 44.24319       8.271154 71.35680 6.549048 59.69009 5.757642 11.66671       8.720119 
1 1 1 -11 29 7  o 166.8071 3.556109 340.3562       14.45525 355.4006       28.93926 335.3547       16.68596 169.3574 7.027355 165.4107 4.142795 3.946671       8.157602 
1 1 1 -11 29 8  o 67.83045 3.704410 56.46997       6.099978 60.73673       11.47795 54.79052       7.201111 69.76785 6.838832 66.70211 4.455758 3.065742       8.162315 
1 1 1 -11 29 9  o 28.07554 7.224666 10.13424       4.971505 19.44003       8.519844 5.329735       6.121803 38.66573 9.179973 22.90689 8.392027 15.75885       12.43777 
1 1 1 -11 29 10 o 65.39053 4.248309 52.63372       6.733017 58.77494       11.68273 49.57948       8.238903 68.52572 7.098771 63.25634 5.396252 5.269382       8.916954 
1 1 1 -11 29 11 o 76.72461 4.874958 72.60612       9.067547 0.000000       0.000000 72.60612       9.067547 ?        ?        76.72461 4.874958 0.000000       4.874958 
1 1 1 -11 29 12 o 49.07610 5.067030 29.92579       5.972788 33.94597       10.62122 28.06651       7.223083 51.40059 8.795489 47.22312 6.444698 4.177471       10.90389 
1 1 1 -11 29 13 o 191.4880 3.893541 449.3737       18.16864 439.9258       26.18792 458.1414       25.22765 188.7590 5.699740 192.7704 5.375569 -4.011429      7.834781 
1 1 1 -11 29 14 o 182.5439 3.812996 408.4121       16.96172 402.3751       24.58084 413.8995       23.43513 180.4964 5.595215 183.2106 5.254479 -2.714188      7.675674 
1 1 1 -11 29 15 f 139.1137 3.558919 237.2538       12.05500 248.8001       18.32706 228.4484       16.00467 141.9331 5.308095 136.1544 4.831343 5.778778       7.177587 
1 1 1 -11 29 16 o 121.4383 3.445088 180.8325       10.18481 198.8672       16.06126 168.7032       13.17173 126.8465 5.207020 116.9914 4.629254 9.855141       6.967285 
1 1 1 -11 29 17 o 182.4445 3.343313 407.8953       14.86428 429.4547       25.38534 396.6465       18.33649 186.1681 5.601909 179.6198 4.189148 6.548218       6.995023 
1 1 1 -11 29 18 o 157.0528 3.159310 302.2251       12.09133 313.1993       20.61664 296.4712       14.92829 158.9766 5.329212 155.2582 3.948863 3.718414       6.632799 
1 1 1 -11 29 19 o 75.90321 3.411933 70.85159       6.294847 76.71756       14.43718 69.47463       6.994750 77.56036 7.741789 75.06902 3.836347 2.491341       8.640188 
1 1 1 -11 29 20 o 100.0354 2.969122 122.7911       7.229981 136.3627       13.03630 116.7624       8.688684 104.7110 5.124446 97.36636 3.668482 7.344643       6.302199 
1 1 1 -11 29 21 o 50.68380 3.708611 31.80028       4.548832 27.09676       8.551358 33.65642       5.371915 45.45341 8.012973 52.01811 4.275485 -6.564701      9.082263 
1 1 1 -11 29 22 o 32.25706 5.384626 13.32379       4.083584 7.212027       11.14762 14.27104       4.388641 27.87683 11.04407 33.34929 5.598351 -5.472467      12.38196 
1 1 1 -11 29 23 o 23.33142 6.279305 7.132157       3.648379 20.45402       7.646271 3.205156       4.151430 39.00027 8.300402 18.14499 6.858988 20.85527       10.76765 
1 1 1 -11 29 24 o 33.02671 5.595668 14.10510       4.342908 7.164314       7.111883 18.23237       5.484185 24.75583 9.049089 37.42046 6.233204 -12.66462      10.98812 
1 1 1 -11 29 25 o 53.18878 4.212005 35.48458       5.414861 36.91906       11.27044 35.05409       6.174137 51.61632 9.302316 52.61250 4.870901 -0.9961777     10.50042 
1 1 1 -11 29 26 o 45.62165 3.943671 26.13999       4.341369 37.06001       10.75208 24.01291       4.745389 51.65839 8.859934 43.49979 4.543522 8.158600       9.957008 
1 1 1 -11 29 27 o 24.50894 6.237940 8.109577       3.734498 10.55713       7.347798 7.257137       4.336333 27.52138 9.263026 23.19118 7.049418 4.330204       11.64036 
1 1 1 -11 29 28 o 27.33882 5.328160 9.918939       3.422096 1.030729       6.664887 13.10107       3.987905 18.63315 8.043940 31.49257 5.390049 -12.85942      9.682851 
1 1 1 -11 29 29 o 67.50427 3.115513 56.92957       5.111216 48.25228       9.180213 60.82783       6.153122 59.81635 6.397125 69.46686 3.647592 -9.650513      7.363975 
1 1 1 -11 29 30 o 14.08233 5.808174 1.256905       3.225980 0.2520396      6.550820 1.578614       3.706582 17.56705 7.768376 15.12793 6.231234 2.439115       9.958713 
1 1 1 -11 29 31 o 43.25513 3.813233 24.03509       3.978342 20.61482       7.257760 25.50419       4.756621 36.71771 8.306246 44.14318 4.483950 -7.425476      9.439255 
1 1 1 -11 29 32 o 46.26752 4.150277 27.89310       4.629731 7.710208       10.05211 33.32717       5.215882 23.71277 10.04753 50.49975 4.278638 -26.78698      10.92060 
1 1 1 -11 29 33 o 34.43163 4.382747 15.76643       3.594165 20.28748       6.474802 13.75288       4.321034 36.41291 7.545046 31.10245 5.917223 5.310463       9.588600 
1 1 1 -11 29 34 o 27.24670 5.546125 10.59151       3.557115 11.87491       6.608806 10.06806       4.220631 26.05109 8.784930 25.71433 6.677079 0.3367615      11.03442 
1 1 1 -11 29 35 o 15.94210 6.548751 2.750443       4.079456 0.2373439E-01  6.441396 4.576539       5.271356 16.07238 7.348789 18.42410 7.491305 -2.351728      10.49401 
1 1 1 -11 29 36 o 29.54615 9.249759 17.29855       7.400535 17.29855       7.400535 0.000000       0.000000 29.54615 9.249759 ?        ?        0.000000       9.249759 
1 1 1 -11 29 37 o 12.78013 5.783458 -0.2079204     3.862803 -8.145015      6.254811 4.685650       4.911299 12.13926 5.977785 17.75922 7.227226 -5.619961      9.379057 
1 1 1 -11 29 38 f 10.57698 5.092846 -3.759253      3.881783 -6.755837      6.208549 -1.836024      4.973846 12.37420 6.065644 12.99408 6.114066 -0.6198797     8.612424 
1 1 1 -11 30 1  o 57.88632 3.379378 41.14051       4.746309 45.95014       6.840549 36.67541       6.590994 60.99305 4.637046 54.38080 5.030589 6.612251       6.841712 
1 1 1 -11 30 2  o 135.4352 3.320774 224.4073       10.95991 224.3358       14.78202 224.4946       16.33310 135.1123 4.495811 135.0326 4.972057 0.7971191E-01  6.703258 
1 1 1 -11 30 3  o 48.41224 4.062109 28.92809       4.748136 29.03461       5.963494 28.74363       7.847727 48.31649 5.143868 47.67517 6.960010 0.6413231      8.654543 
1 1 1 -11 30 4  o 73.96907 3.014968 66.99798       5.423227 60.33170       7.646953 73.74383       7.692453 69.96535 4.509079 77.45374 4.090049 -7.488380      6.087717 
1 1 1 -11 30 5  o 85.22397 2.935928 88.88171       6.088274 88.82297       8.957627 88.93214       8.300153 84.97868 4.339979 85.08865 4.014251 -0.1099701     5.911821 
1 1 1 -11 30 6  o 138.9520 2.975299 236.0247       10.07469 233.4554       15.23857 238.0198       13.42807 137.8209 4.543461 139.3074 3.959533 -1.486511      6.026686 
1 1 1 -11 30 7  o 68.01879 3.739739 56.83666       6.174929 51.95265       11.06487 59.04570       7.441498 64.30180 7.183942 69.21888 4.434969 -4.917076      8.442628 
1 1 1 -11 30 8  o 29.88116 6.538218 11.47500       4.628322 19.37834       9.252943 8.837742       5.345038 38.44977 9.836493 26.39653 7.781165 12.05323       12.54205 
1 1 1 -11 30 9  o 55.68627 4.547878 38.33878       6.117830 44.74809       10.87512 35.37136       7.399755 59.45545 7.685588 53.22554 5.798726 6.229912       9.627746 
1 1 1 -11 30 10 o 44.00840 5.635239 24.27702       5.904942 0.000000       0.000000 24.27702       5.904942 ?        ?        44.00840 5.635239 0.000000       5.635239 
1 1 1 -11 30 11 o 17.80922 7.154111 1.931805       4.742795 2.551707       7.649137 1.544632       6.045107 22.04063 9.000647 19.27354 7.950182 2.767090       12.00904 
1 1 1 -11 30 12 o 107.3724 3.372062 141.3261       8.812222 140.9383       18.34467 141.4425       10.04738 106.1216 7.135123 107.3188 3.848084 -1.197220      8.106647 
1 1 1 -11 30 13 o 127.8539 3.853188 200.7587       11.99152 0.000000       0.000000 200.7587       11.99152 ?        ?        127.8539 3.853188 0.000000       3.853188 
1 1 1 -11 30 14 o 82.02083 3.239128 82.53321       6.461503 83.67204       11.49641 82.00734       7.812180 81.97824 5.792051 81.62556 3.939071 0.3526840      7.004580 
1 1 1 -11 30 15 o 86.78464 3.504993 92.53108       7.397276 108.3438       12.25940 83.47763       9.276260 93.40486 5.409106 82.16061 4.652124 11.24425       7.134472 
1 1 1 -11 30 16 o 38.83981 4.727914 18.88794       4.382811 22.84485       8.087957 17.24294       5.214855 41.80801 8.231707 36.77490 6.027730 5.033104       10.20267 
1 1 1 -11 30 17 o 49.77551 3.892444 30.66788       4.683915 38.47002       8.815226 27.59859       5.528985 55.01350 6.714449 46.98195 4.901230 8.031544       8.312995 
1 1 1 -11 30 18 o 104.4928 3.026950 134.0239       7.699626 110.2353       12.85643 147.3280       9.614572 93.89092 5.645092 109.3923 3.611628 -15.50135      6.701560 
1 1 1 -11 30 19 f 124.6573 3.030536 190.7143       9.206051 189.7448       15.62151 191.2301       11.39503 123.3724 5.207709 124.5297 3.759275 -1.157227      6.422802 
1 1 1 -11 30 20 o 45.08314 3.906533 25.27741       4.249508 20.67839       7.748991 27.25534       5.081810 39.35549 8.339375 46.66986 4.525054 -7.314373      9.487955 
1 1 1 -11 30 21 o 32.49167 5.021073 13.46754       3.847584 5.079632       6.969818 17.14410       4.614400 22.89205 8.829553 36.65170 5.321795 -13.75965      10.30934 
1 1 1 -11 30 22 o 13.38548 6.082208 -2.271057      4.325505 -4.106463      10.93254 -1.930414      4.709828 21.26944 9.666512 14.30082 6.436619 6.968619       11.61342 
1 1 1 -11 30 23 o 22.34043 7.061032 6.457780       4.302663 9.605230       9.107488 5.553460       4.881804 27.84805 10.23035 21.48705 7.538460 6.361008       12.70781 
1 1 1 -11 30 24 o 37.44851 4.642429 17.85975       4.145923 12.34098       9.833285 19.05289       4.572177 30.10662 10.68685 38.57511 4.979922 -8.468483      11.79018 
1 1 1 -11 30 25 o 30.66533 5.276104 12.27381       3.800564 7.664873       7.551367 13.83733       4.398217 24.96106 9.288993 32.40475 5.781818 -7.443699      10.94143 
1 1 1 -11 30 26 f 37.34396 4.558803 17.89254       4.062758 23.79677       7.597742 15.52824       4.807875 41.35797 7.825101 34.14080 5.997626 7.217171       9.859196 
1 1 1 -11 30 27 o 36.43774 4.428352 17.08387       3.851512 8.406753       7.200634 20.56132       4.558409 24.93710 9.106939 39.84735 4.790322 -14.91024      10.28997 
1 1 1 -11 30 28 o 52.66377 3.484628 34.97628       4.446879 29.20570       7.856791 37.69618       5.394009 45.59953 7.317954 54.33190 4.104350 -8.732376      8.390360 
1 1 1 -11 30 29 o 24.65392 5.856303 8.432640       3.465927 9.797259       6.612278 7.915676       4.069820 25.49416 8.783384 23.55456 6.745775 1.939604       11.07490 
1 1 1 -11 30 30 o 28.61044 5.419203 11.21449       3.640012 11.84841       6.696744 10.94866       4.336563 27.28799 8.828684 27.60113 6.546933 -0.3131428     10.99127 
1 1 1 -11 30 31 o 29.83806 5.140382 12.14469       3.602797 5.689458       6.413185 15.12137       4.354954 20.89420 8.344296 33.04998 5.607462 -12.15578      10.05340 
1 1 1 -11 30 32 o 19.85943 6.286671 5.710092       3.409497 7.353098       5.988439 4.922056       4.147315 21.97253 8.252681 18.87009 6.908273 3.102438       10.76248 
1 1 1 -11 30 33 o 22.37606 6.117515 7.436368       3.430717 1.962143       5.952349 10.15948       4.198169 17.10903 7.490845 25.84378 6.633121 -8.734745      10.00555 
1 1 1 -11 30 34 o 50.07266 4.268696 33.68934       5.159112 21.94977       7.720422 43.16130       6.934815 34.91768 9.012329 55.52285 5.185360 -20.60517      10.39760 
1 1 1 -11 30 35 o 24.43101 7.618279 10.32331       5.025328 9.304880       6.835399 11.52131       7.413527 22.24986 8.698598 23.93669 9.138199 -1.686832      12.61635 
1 1 1 -11 30 36 o 15.29759 6.109332 2.965905       3.437864 0.8946662E-01  6.173433 4.258918       4.139049 15.34291 7.080567 17.10638 6.744441 -1.763468      9.778646 
1 1 1 -11 30 37 o 21.93524 6.909360 8.251317       4.123068 9.980014       6.515927 7.096955       5.324611 22.10333 8.534060 19.84723 7.700529 2.256104       11.49471 
1 1 1 -11 31 1  o 64.40585 3.518902 50.98215       5.501936 46.70125       6.947639 58.18215       9.010233 61.42633 4.676523 68.42416 5.448661 -6.997829      7.180375 
1 1 1 -11 31 2  o 49.23245 4.137032 29.96887       4.917499 29.13924       6.092160 31.52014       8.330523 48.32434 5.257999 49.83860 7.056248 -1.514259      8.799840 
1 1 1 -11 31 3  o 13.06556 5.609638 -0.1745510     3.207513 0.5524031      4.233450 -1.154253      4.914598 15.67827 6.574809 15.42814 6.779185 0.2501268      9.443805 
1 1 1 -11 31 4  o 23.98467 6.565539 7.374453       3.948764 7.489905       4.906958 7.162301       6.651731 24.44545 7.512173 25.11223 8.800351 -0.6667843     11.57061 
1 1 1 -11 31 5  o 70.01288 3.103733 60.10373       5.282234 57.90716       7.611051 62.14491       7.336904 68.46235 4.588509 70.99958 4.260132 -2.537231      6.261241 
1 1 1 -11 31 6  o 53.66653 3.475470 35.43259       4.520758 35.67789       6.440193 35.19430       6.347450 53.58269 4.989516 53.22331 4.950737 0.3593826      7.028874 
1 1 1 -11 31 7  o 40.79704 5.003799 20.81282       4.870627 21.12243       8.712237 20.67207       5.874383 40.11319 9.119800 40.39622 6.162179 -0.2830353     11.00651 
1 1 1 -11 31 8  o 56.35950 4.112770 39.21882       5.609679 50.14426       11.23182 35.58777       6.475107 62.90942 7.472336 53.49376 5.026035 9.415653       9.005378 
1 1 1 -11 31 9  o 88.89320 4.004849 97.24019       8.653147 0.000000       0.000000 97.24019       8.653147 ?        ?        88.89320 4.004849 0.000000       4.004849 
1 1 1 -11 31 10 o 94.31210 3.972250 109.4482       9.108912 119.3070       16.26648 104.9443       10.99439 97.54237 6.887564 92.10771 4.916035 5.434662       8.462029 
1 1 1 -11 31 11 o 24.18690 6.973421 7.485108       4.335300 7.837899       8.006020 7.338742       5.156789 26.63259 9.620557 24.30972 7.735862 2.322874       12.34499 
1 1 1 -11 31 12 o 26.32012 6.815163 8.984638       4.405311 8.958842       9.116611 8.992496       5.031766 28.30779 10.26059 26.38788 7.482314 1.919912       12.69901 
1 1 1 -11 31 13 o 79.37231 3.488253 77.47752       6.730560 83.78026       14.09022 75.61426       7.661107 81.36504 7.179897 78.28922 4.029181 3.075813       8.233179 
1 1 1 -11 31 14 o 61.18394 4.456783 46.43971       6.599432 56.19445       12.12651 42.33493       7.866342 66.26640 7.649678 58.09102 5.627230 8.175377       9.496489 
1 1 1 -11 31 15 o 121.6870 3.095359 181.7547       9.171464 177.4007       15.34620 184.1740       11.43907 119.3847 5.288044 122.2527 3.844467 -2.868019      6.537839 
1 1 1 -11 31 16 o 76.12766 3.450305 71.39498       6.384188 82.49317       13.83526 68.39254       7.196128 80.46384 7.129583 74.37007 3.985231 6.093773       8.167804 
1 1 1 -11 31 17 o 87.84431 3.104542 94.88585       6.635351 82.24347       11.33072 101.4842       8.185779 80.85747 5.788743 90.67568 3.712380 -9.818214      6.876867 
1 1 1 -11 31 18 o 59.88438 3.544586 44.34414       5.149538 44.92410       9.162372 44.07636       6.225895 59.30124 6.443748 59.49149 4.324000 -0.1902466     7.760082 
1 1 1 -11 31 19 o 39.74480 5.168434 20.06771       4.887372 23.69821       7.802787 17.72375       6.269622 42.23030 7.871621 36.60645 7.284563 5.623848       10.72508 
1 1 1 -11 31 20 o 35.62578 5.614801 16.35316       4.713345 17.27661       7.682951 15.79587       5.968455 35.45595 8.905272 34.40418 7.342633 1.051769       11.54202 
1 1 1 -11 31 21 f 30.42435 6.480844 12.27091       4.657703 0.000000       0.000000 12.27091       4.657703 ?        ?        30.42435 6.480844 0.000000       6.480844 
1 1 1 -11 31 22 o 34.51379 5.140013 15.34257       4.191392 18.03986       9.965870 14.76294       4.619846 35.20765 10.68372 33.58393 5.857858 1.623722       12.18427 
1 1 1 -11 31 23 o 25.84441 5.864782 8.890004       3.608684 1.683749       7.025965 11.47229       4.205841 19.79309 8.393962 29.36009 6.078717 -9.566996      10.36385 
1 1 1 -11 31 24 o 58.44746 3.391136 42.62762       4.809256 38.17561       8.975660 44.42048       5.695889 53.25362 7.092607 59.41832 3.956271 -6.164707      8.121401 
1 1 1 -11 31 25 o 23.40557 6.299939 7.472027       3.672156 8.509665       6.689859 7.024554       4.393167 25.00202 8.820347 22.71745 7.128816 2.284575       11.34101 
1 1 1 -11 31 26 o 41.68469 4.045755 22.17171       4.058097 17.30364       6.831810 24.82580       5.044467 34.43909 8.249117 43.73598 4.812479 -9.296890      9.550282 
1 1 1 -11 31 27 o 30.45375 5.006612 12.31571       3.586527 11.53899       6.123646 12.72125       4.424868 27.75493 8.364593 30.34190 6.194206 -2.586966      10.40839 
1 1 1 -11 31 28 o 10.46134 4.921788 -2.884835      3.221516 -4.352883      6.057488 -2.305863      3.804094 14.33290 6.745039 11.96352 5.534145 2.369382       8.724810 
1 1 1 -11 31 29 o 16.12701 6.073907 3.030424       3.248733 1.316538       6.112821 3.705070       3.835205 17.47158 7.621565 17.48387 6.596246 -0.1229286E-01 10.07962 
1 1 1 -11 31 30 o 13.55361 5.719145 0.9714946      3.234704 2.671796       5.954615 0.2596960      3.852736 18.09543 7.702774 13.81027 6.037033 4.285163       9.786649 
1 1 1 -11 31 31 o 17.56147 6.578141 4.032334       3.799361 -8.174361      9.400927 6.415347       4.153697 16.03461 7.770457 20.76084 6.964340 -4.726229      10.43466 
1 1 1 -11 31 32 o 33.82400 4.782673 15.67337       3.832284 7.796603       6.518443 19.83402       4.737512 21.91929 8.515812 37.64412 5.311830 -15.72483      10.03666 
1 1 1 -11 31 33 o 16.10844 6.478695 3.089054       3.894537 4.534650       6.285937 2.188441       4.961531 18.76830 7.948616 16.13892 6.953562 2.629374       10.56090 
1 1 1 -11 31 34 o 13.61390 6.048685 0.4532802      4.017963 -1.348330      6.452042 1.594558       5.135260 15.08000 7.053285 15.60371 6.890091 -0.5237064     9.860131 
1 1 1 -11 31 35 o 28.26959 5.858448 12.15542       3.903152 9.437575       7.163760 13.30286       4.654725 21.80427 8.780739 28.61523 6.779793 -6.810961      11.09356 
1 1 1 -11 31 36 o 10.91065 5.113198 -1.866265      3.418773 -4.323031      6.239679 -0.8123431     4.086811 13.28840 6.413028 12.55967 5.783471 0.7287312      8.635709 
1 1 1 -11 32 1  f 131.1599 2.969492 210.7132       9.491158 195.3314       13.76129 224.6684       13.10760 125.7788 4.496920 135.0928 3.985936 -9.313980      6.009158 
1 1 1 -11 32 2  o 22.76482 6.035992 6.677712       3.402488 6.341445       4.563228 7.098747       5.106097 22.67702 7.283494 23.94966 7.705738 -1.272642      10.60319 
1 1 1 -11 32 3  o 61.26890 3.212556 46.13776       4.779769 48.24296       6.638641 43.87180       6.887452 62.42489 4.392037 59.42302 4.797024 3.001865       6.503954 
1 1 1 -11 32 4  o 34.64098 4.620569 15.05330       3.803328 9.234085       5.008913 22.97662       5.844741 26.69866 7.428284 42.65075 5.771410 -15.95209      9.406837 
1 1 1 -11 32 5  o 43.05939 4.309882 23.05653       4.461689 22.05290       5.472103 25.04701       7.706307 41.83592 5.500587 44.08600 7.437516 -2.250084      9.250573 
1 1 1 -11 32 6  o 34.74227 4.993038 15.21379       4.105982 15.79777       5.252347 14.29606       6.584304 35.07949 6.379097 32.97053 8.223070 2.108959       10.40729 
1 1 1 -11 32 7  o 18.58225 6.935738 3.364405       4.216021 -0.8153708     7.181111 5.562898       5.208080 18.99751 8.274391 22.15135 7.785142 -3.153839      11.36107 
1 1 1 -11 32 8  o 45.15302 5.831858 25.75693       6.267249 0.000000       0.000000 25.75693       6.267249 ?        ?        45.15302 5.831858 0.000000       5.831858 
1 1 1 -11 32 9  o 58.60898 4.533639 42.65029       6.424805 43.04435       10.47714 42.41280       8.133578 57.92952 7.605265 58.09605 5.823554 -0.1665306     9.578822 
1 1 1 -11 32 10 o 65.07811 3.799905 52.27372       5.999986 47.05597       11.82835 54.08141       6.962186 60.30019 8.266905 66.06803 4.348499 -5.767845      9.340833 
1 1 1 -11 32 11 o 83.39498 3.501418 85.61322       7.099905 75.61210       13.63322 89.33504       8.316716 77.02186 7.352665 85.05366 4.023982 -8.031799      8.381773 
1 1 1 -11 32 12 o 107.8041 3.358162 142.9173       8.811362 174.1792       18.87714 134.2086       9.963362 117.5099 6.618882 104.2879 3.927468 13.22203       7.696402 
1 1 1 -11 32 13 o 68.77500 4.239210 58.65107       7.070267 79.13699       13.05487 50.14845       8.410488 78.89317 6.858516 63.18597 5.517450 15.70720       8.802357 
1 1 1 -11 32 14 o 43.10630 5.545717 23.56799       5.690702 28.71689       9.970396 21.08021       6.930440 46.27938 9.165058 40.14741 7.354765 6.131969       11.75121 
1 1 1 -11 32 15 o 44.19370 5.443350 24.76567       5.738502 24.83211       10.06228 24.73364       6.985924 42.56161 9.890466 43.71228 6.777478 -1.150661      11.98981 
1 1 1 -11 32 16 o 52.45002 4.423601 34.38726       5.601368 33.86525       8.744523 34.75049       7.294299 51.00402 7.238582 52.25410 5.827376 -1.250080      9.292759 
1 1 1 -11 32 17 o 35.74729 6.318899 16.65073       5.303241 6.851069       9.027977 21.81389       6.553036 25.87506 10.03039 40.83958 6.825216 -14.96452      12.13229 
1 1 1 -11 32 18 o 26.30055 6.589675 9.184471       4.214294 6.968989       9.217665 9.769957       4.738543 25.96800 10.11594 27.04066 7.101287 -1.072660      12.35964 
1 1 1 -11 32 19 o 45.46276 4.431883 26.04510       4.847723 24.69093       10.40035 26.42097       5.479351 41.51064 10.32435 45.58541 5.015258 -4.074764      11.47802 
1 1 1 -11 32 20 o 74.80373 3.968466 69.89467       7.208174 0.000000       0.000000 69.89467       7.208174 ?        ?        74.80373 3.968466 0.000000       3.968466 
1 1 1 -11 32 21 o 80.99848 3.108551 81.27983       6.124407 76.43842       10.74142 83.61184       7.454893 77.01608 5.765104 81.85000 3.747490 -4.833916      6.876053 
1 1 1 -11 32 22 f 20.09464 6.508922 5.238938       3.639269 6.123307       7.012981 4.913017       4.257377 23.13702 8.874199 19.99446 7.037846 3.142559       11.32619 
1 1 1 -11 32 23 o 15.07738 6.046383 1.743421       3.381701 2.930539       6.953410 1.375654       3.870237 20.31220 8.465443 15.39328 6.356585 4.918921       10.58631 
1 1 1 -11 32 24 o 12.75171 5.729590 -1.212376      3.714100 -1.665202      6.279452 -0.9687231     4.606191 16.36506 7.392880 14.44292 6.442941 1.922140       9.806435 
1 1 1 -11 32 25 o 47.30666 3.772231 28.43014       4.312676 17.47308       6.923299 35.37772       5.512930 34.31584 8.357815 52.45903 4.351593 -18.14319      9.422814 
1 1 1 -11 32 26 f 20.14602 6.445206 5.590629       3.575838 -3.519500      6.086509 10.39247       4.418856 14.83700 6.910066 26.97550 6.741432 -12.13850      9.653803 
1 1 1 -11 32 27 o 46.92664 3.869841 28.30184       4.386062 30.47904       7.743278 27.27328       5.322203 46.06480 7.127920 45.37422 4.890481 0.6905746      8.644307 
1 1 1 -11 32 28 o 29.18095 5.402445 11.71100       3.700269 8.210457       6.409878 13.46060       4.531595 23.32590 8.580270 30.76979 6.256891 -7.443890      10.61931 
1 1 1 -11 32 29 o 13.83238 5.852786 1.033695       3.402872 1.171611       6.105108 0.9715374      4.098577 17.09845 7.532890 14.72582 6.332067 2.372630       9.840707 
1 1 1 -11 32 30 o 23.65676 6.635607 8.450109       3.979595 -2.260575      9.392770 10.79345       4.393417 17.87427 8.407722 26.70995 6.748441 -8.835678      10.78106 
1 1 1 -11 32 31 o 25.28754 6.253138 9.598678       3.831509 1.166788       6.505137 14.07771       4.741175 16.93604 7.598366 30.51538 6.570265 -13.57934      10.04508 
1 1 1 -11 32 32 o 18.07636 6.842865 4.765610       4.135399 7.863394       6.350259 2.484511       5.449265 21.41655 8.380887 16.68908 7.238967 4.727467       11.07438 
1 1 1 -11 32 33 o 15.02676 6.109360 2.566627       3.505506 -0.8548751     6.139056 4.221993       4.270121 15.01791 6.975817 17.29951 6.841094 -2.281596      9.770495 
1 1 1 -11 32 34 o 11.34547 5.264802 -1.465640      3.483725 0.5289810      6.210426 -2.381440      4.208155 15.58730 7.160015 11.87492 5.598660 3.712378       9.089049 
1 1 1 -11 33 1  o 33.66912 4.580476 14.28038       3.660824 21.15015       5.073442 6.818480       5.287568 40.92890 5.204225 23.57684 7.856692 17.35206       9.423989 
1 1 1 -11 33 2  f 63.55763 3.482020 49.82051       5.372455 53.83444       6.976956 43.97358       8.420650 65.85207 4.372474 59.01236 5.936092 6.839714       7.372633 
1 1 1 -11 33 3  o 24.41469 6.126650 7.754064       3.638797 8.283792       4.342987 6.506166       6.665786 25.20963 6.879228 24.18270 8.772495 1.026928       11.14811 
1 1 1 -11 33 4  o 12.15044 5.466367 -1.562932      3.392739 -0.9957117     3.992340 -3.037401      6.436790 13.80540 6.086458 16.51906 7.471530 -2.713658      9.636843 
1 1 1 -11 33 5  o 49.07390 4.333783 29.98206       5.129467 30.69273       5.815611 27.49217       10.88555 49.51674 4.883039 44.98655 10.16936 4.530186       11.28095 
1 1 1 -11 33 6  o 40.31617 4.454157 20.33767       4.303161 20.49290       5.294853 20.03567       7.385203 40.18643 5.555193 38.95531 8.046119 1.231125       9.777535 
1 1 1 -11 33 7  o 61.81647 9.116208 50.40442       13.32096 0.000000       0.000000 50.40442       13.32096 ?        ?        61.81647 9.116208 0.000000       9.116208 
1 1 1 -11 33 8  o 31.34163 7.056828 12.89968       5.259549 7.823962       7.774198 17.18367       7.142179 26.16406 9.476280 35.91222 8.323899 -9.748152      12.61298 
1 1 1 -11 33 9  o 50.01015 5.252809 31.48357       6.306118 33.24453       10.60623 30.52066       7.842985 49.94553 9.047235 48.71800 6.790542 1.227531       11.31211 
1 1 1 -11 33 10 o 44.15112 5.472316 24.70271       5.761800 32.35490       9.595448 20.38776       7.205442 49.55727 8.234366 39.28389 7.801960 10.27338       11.34352 
1 1 1 -11 33 11 o 101.9261 3.887062 128.4888       9.637097 118.2564       15.99462 134.3207       12.07501 96.27702 6.862331 103.8231 4.785494 -7.546120      8.366155 
1 1 1 -11 33 12 o 108.9346 4.755984 147.9738       12.59490 151.0645       18.00239 145.0106       17.62728 108.7675 6.826382 106.5600 6.824073 2.207489       9.652329 
1 1 1 -11 33 13 o 31.89017 6.047717 13.23117       4.527928 6.205624       8.325321 16.18225       5.395742 24.91905 9.639673 35.19048 6.532457 -10.27144      11.64458 
1 1 1 -11 33 14 o 54.94249 4.026393 37.61449       5.353458 49.76715       11.33008 34.12150       6.074289 61.57220 7.720402 52.05521 4.844043 9.516987       9.114240 
1 1 1 -11 33 15 o 79.15526 3.449140 77.53583       6.637170 72.62498       13.29054 79.16746       7.660834 74.56857 7.411948 79.79443 3.952035 -5.225861      8.399735 
1 1 1 -11 33 16 o 27.77321 6.421975 10.24596       4.259633 15.72316       9.011158 8.669902       4.833791 33.40260 10.16384 25.47647 7.368952 7.926130       12.55408 
1 1 1 -11 33 17 o 32.90647 5.353501 14.01721       4.145514 21.35628       7.356073 10.60167       5.018285 39.65136 7.890556 27.98373 7.287922 11.66763       10.74126 
1 1 1 -11 33 18 f 24.87345 6.270607 8.273984       3.799231 6.612607       6.128778 9.310859       4.841755 23.31006 8.417810 26.19228 7.309182 -2.882221      11.14826 
1 1 1 -11 33 19 o 22.67154 6.915705 6.858772       4.168497 18.01209       11.33631 5.114917       4.482545 34.52305 11.50395 20.47280 7.220253 14.05025       13.58209 
1 1 1 -11 33 20 o 37.19451 4.722817 17.78442       4.184329 17.03524       7.457448 18.12865       5.055050 34.38190 8.849007 37.09858 5.779792 -2.716682      10.56934 
1 1 1 -11 33 21 o 44.10319 4.200702 24.73890       4.460229 31.91795       8.128570 21.64627       5.335122 48.42494 7.098982 40.61113 5.534818 7.813812       9.001654 
1 1 1 -11 33 22 o 35.61444 4.822870 16.50686       4.078229 14.13861       7.139585 17.65382       4.968595 30.81199 8.968471 36.36056 5.802374 -5.548569      10.68181 
1 1 1 -11 33 23 o 46.82826 4.264513 28.14847       4.813132 30.52768       7.528593 26.50384       6.259389 47.09176 6.753467 44.41273 5.931644 2.679031       8.988533 
1 1 1 -11 33 24 o 30.03354 5.328304 12.14456       3.756902 17.05070       6.625053 9.819054       4.561195 33.80739 8.139683 26.13280 7.015685 7.674595       10.74590 
1 1 1 -11 33 25 o 29.83365 5.421014 12.11425       3.796026 2.310025       6.319182 17.64970       4.748217 18.52660 7.912161 36.03044 5.588782 -17.50384      9.686938 
1 1 1 -11 33 26 o 46.75763 3.798109 28.10719       4.290454 18.13522       7.114900 33.80550       5.378375 33.93892 8.595037 50.87779 4.380584 -16.93887      9.646976 
1 1 1 -11 33 27 o 66.82115 3.324496 56.78725       5.396472 45.04415       8.674314 64.20199       6.892740 56.38093 6.428148 70.36948 4.036429 -13.98855      7.590378 
1 1 1 -11 33 28 o 55.14223 3.548432 39.11777       4.742916 37.59650       8.176742 39.88916       5.822521 50.71933 6.785721 54.93281 4.385939 -4.213478      8.079757 
1 1 1 -11 33 29 o 28.07496 6.081534 11.53141       4.040162 15.20189       9.833412 10.78598       4.431469 27.35940 10.50454 26.55095 6.815099 0.8084545      12.52162 
1 1 1 -11 33 30 o 23.96854 6.882379 9.045388       4.230981 11.92522       6.336185 6.728011       5.683850 25.85827 8.600106 20.65148 7.971344 5.206783       11.72622 
1 1 1 -11 33 31 o 20.15131 7.032302 6.489188       4.244771 7.774956       6.812909 5.673378       5.426823 21.21876 8.556640 19.27127 7.682590 1.947483       11.49949 
1 1 1 -11 33 32 o 31.96063 5.425604 14.89085       4.074768 13.72826       7.190861 15.44073       4.945393 26.00877 9.147267 31.24110 6.697083 -5.232328      11.33682 
1 1 1 -11 33 33 o 18.84940 6.781734 5.756014       3.973516 4.368086       6.470685 6.596236       5.034584 18.01790 7.850982 19.65312 7.523754 -1.635220      10.87404 
1 1 1 -11 34 1  o 66.73081 3.159321 54.92474       5.122963 52.76764       7.142643 57.21003       7.351810 64.98512 4.538870 67.69788 4.481616 -2.712761      6.378576 
1 1 1 -11 34 2  o 22.73576 6.192527 6.754908       3.523061 7.273323       4.660316 6.063511       5.381957 23.72628 7.326259 22.59805 7.916192 1.128227       10.78611 
1 1 1 -11 34 3  o 55.23507 3.395991 37.73410       4.548967 36.18793       6.323486 39.39246       6.548852 53.66109 4.889362 56.01889 4.844849 -2.357800      6.883199 
1 1 1 -11 34 4  o 37.64233 4.313392 17.79706       3.885303 16.98226       5.252805 18.78135       5.773300 36.20879 6.174351 38.02160 6.462023 -1.812813      8.937581 
1 1 1 -11 34 5  o 13.06567 5.577096 0.7828210E-01  3.136811 -2.060477      3.949926 3.730366       5.161529 12.85414 5.829458 19.86349 7.614572 -7.009354      9.589801 
1 1 1 -11 34 6  o 48.00714 4.618745 28.92843       5.336780 26.71268       7.298872 31.47387       7.823059 45.34611 6.815759 49.34711 6.676594 -4.000996      9.541041 
1 1 1 -11 34 7  o 28.14114 6.777451 10.48197       4.592056 18.84401       8.521976 7.060548       5.451142 36.99300 9.427311 23.77867 7.978243 13.21433       12.35016 
1 1 1 -11 34 8  o 44.82641 4.678412 25.29662       5.035419 21.79170       8.841771 26.97905       6.125896 39.82603 9.282649 46.00826 5.577602 -6.182228      10.82946 
1 1 1 -11 34 9  o 14.36197 6.399438 -1.419083      4.530592 -1.454360      6.952932 -1.393053      5.972661 17.99945 7.979218 16.67344 7.393174 1.326012       10.87782 
1 1 1 -11 34 10 o 83.00974 3.495714 85.25125       7.055501 88.04253       13.52244 84.20711       8.270514 82.67461 6.771194 82.24892 4.139660 0.4256897      7.936362 
1 1 1 -11 34 11 o 28.11019 7.268667 10.59646       5.015752 9.450100       7.896816 11.37168       6.493896 27.29756 9.586951 28.96972 8.586316 -1.672155      12.86991 
1 1 1 -11 34 12 o 59.60126 3.918905 44.28400       5.660307 50.65917       11.33658 42.16691       6.532897 61.89347 7.680990 57.87840 4.671495 4.015064       8.990021 
1 1 1 -11 34 13 o 24.05017 6.845991 7.693242       4.204136 3.228051       8.934938 8.962921       4.764513 22.94757 9.582417 25.83780 7.265265 -2.890236      12.02526 
1 1 1 -11 34 14 o 77.55933 3.612932 74.78291       6.809810 78.17542       13.62428 73.65310       7.862395 76.97656 7.352271 76.69173 4.223282 0.2848358      8.478915 
1 1 1 -11 34 15 o 26.23762 6.676580 9.272284       4.278769 3.762091       8.066843 11.42940       5.047275 22.36048 9.199632 28.99305 7.181405 -6.632574      11.67072 
1 1 1 -11 34 16 o 38.98587 5.143929 19.59542       4.767830 10.76861       9.377902 22.67231       5.536813 28.40895 10.39012 41.78783 5.576239 -13.37888      11.79191 
1 1 1 -11 34 17 o 36.01962 5.409719 16.92640       4.601845 9.553978       9.022977 19.51825       5.349950 27.08983 10.13935 38.50679 5.888103 -11.41696      11.72503 
1 1 1 -11 34 18 o 84.17002 3.604481 88.62378       7.376146 61.33599       15.74969 96.29070       8.348302 64.23200 10.41864 87.53284 3.923706 -23.30083      11.13299 
1 1 1 -11 34 19 o 45.07131 4.144845 25.83262       4.501501 29.18112       7.835374 24.18290       5.499712 46.12075 7.207213 43.00256 5.364537 3.118187       8.984552 
1 1 1 -11 34 20 f 22.59365 6.569112 7.033231       3.832338 9.331355       6.809541 5.967925       4.636265 25.63030 8.909284 21.26441 7.353512 4.365891       11.55203 
1 1 1 -11 34 21 o 13.86132 5.947655 0.3959713      3.601585 -5.612796      6.032437 3.724151       4.489557 13.91602 6.603097 18.40515 7.089747 -4.489133      9.688416 
1 1 1 -11 34 22 o 49.52535 4.246469 31.60670       5.075556 18.76982       7.248485 43.95558       7.109376 35.20341 8.538178 57.79041 5.100533 -22.58700      9.945649 
1 1 1 -11 34 23 o 37.33739 4.516882 18.26768       4.026338 12.10436       6.802116 21.59185       4.995497 27.77092 8.889841 40.17839 5.225818 -12.40747      10.31205 
1 1 1 -11 34 24 o 25.43953 6.035520 9.136810       3.684886 4.460325       6.178022 11.71917       4.590901 19.96842 8.113419 28.46485 6.725852 -8.496426      10.53872 
1 1 1 -11 34 25 o 21.15451 6.376027 6.435279       3.557996 10.00642       6.192941 4.675736       4.347039 25.15108 8.504007 18.89221 7.044414 6.258862       11.04273 
1 1 1 -11 34 26 o 30.08537 5.189124 12.44290       3.667002 5.780379       5.954871 16.51267       4.654126 20.58863 8.098153 34.31784 5.769729 -13.72921      9.943333 
1 1 1 -11 34 27 f 13.39932 5.728946 0.8284966      3.319764 9.203993       6.400259 -2.254245      3.882941 23.60051 8.590919 11.88015 5.528339 11.72036       10.21599 
1 1 1 -11 34 28 o 62.52695 4.627151 52.79958       7.000494 33.97082       12.28240 61.85932       8.519821 39.25182 11.84995 66.73148 5.282241 -27.47966      12.97395 
1 1 1 -11 34 29 o 36.33370 5.398209 18.81828       4.634604 17.93004       6.846751 19.56946       6.296420 31.80804 8.619933 34.61152 7.667212 -2.803473      11.53644 
1 1 1 -11 34 30 o 44.56538 4.208323 26.86233       4.516157 25.75358       7.625975 27.46121       5.604662 38.51076 8.365843 43.76829 5.366965 -5.257530      9.939399 
1 1 1 -11 34 31 o 22.82730 6.531885 8.374615       3.817413 8.599309       6.746669 8.268801       4.629818 21.45475 8.561717 21.96124 7.352469 -0.5064945     11.28547 
1 1 1 -11 34 32 o 22.78166 6.917058 8.728837       4.176640 5.552594       6.801019 10.65207       5.292160 18.89299 8.140675 24.12836 7.851618 -5.235371      11.31011 
1 1 1 -11 35 1  o 51.59486 3.349452 33.04853       4.188541 27.93808       5.613089 39.46962       6.291831 46.88077 4.989857 55.94117 4.657619 -9.060398      6.825840 
1 1 1 -11 35 2  f 71.68628 3.921594 64.04739       6.824605 62.08657       10.30243 65.58060       9.110079 69.46130 6.149883 71.92250 5.233634 -2.461205      8.075394 
1 1 1 -11 35 3  o 24.72798 6.058899 8.096494       3.621932 5.459674       4.568241 12.55958       5.943280 21.14830 7.300016 30.33647 7.946245 -9.188166      10.79041 
1 1 1 -11 35 4  o 25.16172 6.556528 8.435553       4.060127 9.015430       6.185053 7.996463       5.382095 26.11530 8.487453 24.68551 7.908216 1.429783       11.60072 
1 1 1 -11 35 5  o 58.03229 4.539989 42.36349       6.369310 60.61578       9.537424 27.67015       8.557217 68.87343 5.734532 45.27077 8.051829 23.60266       9.885181 
1 1 1 -11 35 6  o 51.09733 3.510340 32.47052       4.344471 35.47885       6.078871 29.32971       6.211287 52.98695 4.758419 47.88158 5.418357 5.105377       7.211182 
1 1 1 -11 35 7  o 78.41244 3.643763 76.39664       6.943559 74.26355       12.53984 77.33984       8.338578 75.46149 6.895264 78.56351 4.372722 -3.102020      8.164886 
1 1 1 -11 35 8  o 35.59195 5.576665 16.42082       4.678109 14.92162       7.994051 17.20163       5.769106 32.54358 9.494979 35.94553 6.835836 -3.401947      11.69971 
1 1 1 -11 35 9  o 59.50410 4.025776 44.31107       5.803212 63.52884       11.42767 37.63298       6.736464 69.70123 6.814898 54.35680 5.146905 15.34442       8.540110 
1 1 1 -11 35 10 o 65.03295 4.389977 53.19582       6.916389 40.92042       10.90652 61.45295       8.945050 54.73870 8.447834 69.41848 5.328496 -14.67978      9.987931 
1 1 1 -11 35 11 f 79.26900 3.472131 78.10516       6.690843 82.83247       13.08956 76.43311       7.784701 79.45441 6.826482 78.10905 4.104224 1.345360       7.965270 
1 1 1 -11 35 12 o 38.15354 4.922530 18.68965       4.470226 26.42913       8.715205 15.92652       5.207414 43.56482 8.514642 34.57299 6.417060 8.991837       10.66198 
1 1 1 -11 35 13 o 23.57792 6.730624 7.507380       4.057954 1.018371       7.507301 10.18594       4.823308 19.78350 8.538845 27.24716 7.168840 -7.463659      11.14918 
1 1 1 -11 35 14 o 72.09113 3.636753 64.99314       6.368347 73.71246       12.63419 62.02321       7.373584 74.24762 7.067945 70.04007 4.341464 4.207550       8.294827 
1 1 1 -11 35 15 o 69.68558 3.685998 60.87805       6.237157 66.93931       12.58116 58.90294       7.181832 70.16013 7.473482 68.17178 4.345718 1.988342       8.645125 
1 1 1 -11 35 16 o 17.19644 6.586252 3.035161       3.859244 -0.1378155     7.833581 4.052083       4.434764 19.15981 8.482766 18.95166 7.105276 0.2081547      11.06536 
1 1 1 -11 35 17 o 23.10239 7.227810 7.371423       4.519471 0.000000       0.000000 7.371423       4.519471 ?        ?        23.10239 7.227810 0.000000       7.227810 
1 1 1 -11 35 18 o 60.49906 3.793379 46.32993       5.564416 50.63850       11.73518 45.08025       6.320070 59.31256 8.349898 59.29139 4.405638 0.2116776E-01  9.440892 
1 1 1 -11 35 19 o 60.87384 3.535517 46.79614       5.222119 48.58242       9.358458 45.98844       6.292969 59.58893 6.552710 59.81253 4.347123 -0.2235985     7.863554 
1 1 1 -11 35 20 o 18.37083 6.531034 4.322746       3.673780 3.856093       6.393836 4.552740       4.488718 19.91444 8.191470 19.17496 7.156616 0.7394791      10.87738 
1 1 1 -11 35 21 o 39.24552 5.116525 20.54919       4.776897 9.499709       6.977563 30.29632       6.553470 25.02161 8.988750 47.18494 5.822832 -22.16333      10.70995 
1 1 1 -11 35 22 o 22.00574 6.436773 6.923308       3.669711 4.914802       5.843569 8.231212       4.715517 20.15974 7.993104 23.59603 7.383008 -3.436285      10.88111 
1 1 1 -11 35 23 o 44.11168 3.922856 25.18780       4.172949 25.05296       6.902559 25.26546       5.238670 41.44477 7.089077 43.37114 5.051016 -1.926365      8.704469 
1 1 1 -11 35 24 o 35.61793 4.715594 17.00735       3.992533 7.916374       6.542702 22.40115       5.039634 22.77136 8.610069 40.54598 5.221624 -17.77462      10.06969 
1 1 1 -11 35 25 o 26.02687 6.054494 9.841254       3.767424 8.605437       6.577344 10.44469       4.596081 23.09447 8.654203 26.10434 7.057447 -3.009874      11.16704 
1 1 1 -11 35 26 o 14.52158 6.119017 1.530647       3.694507 0.8682988      5.954393 1.945252       4.710987 16.40326 7.320895 15.99685 6.831669 0.4064159      10.01335 
1 1 1 -11 35 27 o 19.73008 7.228154 5.959503       4.541502 10.44947       10.00796 4.795136       5.096461 23.44962 9.984115 18.62408 7.438252 4.825535       12.45031 
1 1 1 -11 35 28 o 24.88858 6.106082 9.404550       3.675011 7.448236       6.030574 10.56023       4.635098 21.03303 8.185472 25.43204 7.171095 -4.399015      10.88240 
1 1 1 -11 35 29 o 26.73778 6.068761 10.89437       3.863400 13.86756       6.448961 9.229997       4.825063 27.12570 8.653088 23.22694 7.492266 3.898754       11.44596 
1 1 1 -11 35 30 o 10.20860 4.896829 -3.503260      3.511328 -1.367556      6.165102 -4.528687      4.271911 14.67172 6.872770 10.94023 5.286310 3.731485       8.670642 
1 1 1 -11 36 1  o 10.48291 4.895758 -2.707674      3.089399 -3.658220      3.827596 -0.9309039     5.233053 11.42524 5.372013 15.61513 6.922293 -4.189896      8.762229 
1 1 1 -11 36 2  o 44.13753 3.955751 24.54614       4.209671 27.38197       5.854154 21.50957       6.057817 46.05284 5.313735 40.25061 6.389229 5.802227       8.310116 
1 1 1 -11 36 3  o 47.53206 4.231233 28.56034       4.849881 28.96043       7.573306 28.28220       6.314550 46.55113 6.883304 46.64537 5.671598 -0.9423828E-01 8.918907 
1 1 1 -11 36 4  o 98.88257 3.340601 121.5041       8.038157 128.3262       14.48605 118.4691       9.662128 99.50447 6.001987 97.16805 4.089643 2.336426       7.262853 
1 1 1 -11 36 5  o 59.30016 3.287591 43.75566       4.732240 44.76923       6.546341 42.64631       6.848687 59.42620 4.555207 57.81324 4.907535 1.612953       6.695805 
1 1 1 -11 36 6  o 48.69876 3.570909 29.67398       4.208264 23.22053       5.665493 37.61703       6.285439 42.20600 5.650236 54.31702 4.797857 -12.11102      7.412463 
1 1 1 -11 36 7  o 37.38945 5.422653 18.21162       4.796782 19.30520       8.237481 17.65055       5.900350 36.51757 9.248375 36.08406 6.962303 0.4335175      11.57610 
1 1 1 -11 36 8  o 42.99232 5.711844 24.16477       5.836244 16.39164       9.251275 29.30343       7.521920 33.14553 10.33668 46.78798 6.795769 -13.64245      12.37050 
1 1 1 -11 36 9  o 61.70662 4.085312 48.00434       6.108593 52.11267       11.60210 46.42868       7.185138 61.62996 7.907127 60.21976 4.939586 1.410198       9.323206 
1 1 1 -11 36 10 o 23.76724 6.787622 7.707916       4.126095 2.648002       7.339721 10.04579       4.989058 20.55619 8.641086 26.87877 7.388742 -6.322577      11.36934 
1 1 1 -11 36 11 o 30.28860 5.862156 12.26498       4.170440 21.75810       8.640741 9.381958       4.761786 38.44720 9.320461 25.99092 7.246940 12.45628       11.80632 
1 1 1 -11 36 12 o 47.03571 5.169601 28.72679       5.827882 34.27197       10.27742 26.09862       7.075433 48.66307 8.997944 43.82949 6.848387 4.833572       11.30767 
1 1 1 -11 36 13 o 55.64874 3.969672 39.20931       5.347918 36.17962       10.24329 40.34459       6.270344 50.09698 8.706405 56.07827 4.629600 -5.981289      9.860765 
1 1 1 -11 36 14 o 18.90991 6.577815 4.535454       3.712220 6.578514       7.559793 3.886281       4.261373 23.34804 9.142055 18.49339 6.958308 4.854650       11.48892 
1 1 1 -11 36 15 o 40.69304 5.312522 21.86784       5.142470 0.000000       0.000000 21.86784       5.142470 ?        ?        40.69304 5.312522 0.000000       5.312522 
1 1 1 -11 36 16 o 8.964619 4.426682 -7.213873      3.511643 -15.45546      7.590692 -4.969691      3.961002 12.78909 6.349219 10.82040 5.193091 1.968691       8.202486 
1 1 1 -11 36 17 o 73.92716 3.567981 69.15109       6.408827 61.06887       12.61587 71.96225       7.440370 64.65375 8.190871 74.98874 4.087024 -10.33499      9.153913 
1 1 1 -11 36 18 o 39.14766 4.985523 20.31998       4.648363 17.58451       9.349171 21.21826       5.357487 32.15189 10.43392 39.52557 5.729023 -7.373672      11.90329 
1 1 1 -11 36 19 o 36.90139 5.258992 18.31563       4.595461 26.98032       9.642197 15.76902       5.227337 40.57386 9.851848 33.27008 6.679784 7.303780       11.90287 
1 1 1 -11 36 20 o 42.62318 5.471626 24.65571       5.552342 21.61412       9.372936 26.30009       6.891682 35.31070 10.27532 42.89857 6.820516 -7.587864      12.33295 
1 1 1 -11 36 21 o 13.52770 5.919445 0.1313473      3.712276 2.000892       6.221428 -0.9023136     4.626060 17.92795 7.755678 14.09617 6.358729 3.831780       10.02916 
1 1 1 -11 36 22 o 10.46320 4.933734 -2.860600      3.269918 -2.494094      5.860269 -3.026298      3.940355 14.69895 6.823522 11.60531 5.454766 3.093639       8.735842 
1 1 1 -11 36 23 o 18.59568 6.812912 4.777783       4.034771 0.5261280      6.195863 7.908329       5.316586 16.61898 7.438899 22.48170 7.868512 -5.862724      10.82824 
1 1 1 -11 36 24 o 19.77842 6.868099 5.813636       4.046236 10.30970       6.437700 2.877700       5.202209 24.52109 8.652358 17.23180 7.261023 7.289293       11.29539 
1 1 1 -11 36 25 o 19.98979 6.845215 6.110219       4.014299 4.980230       5.975791 7.039479       5.419100 19.20860 7.912014 21.00919 7.858924 -1.800583      11.15180 
1 1 1 -11 36 26 o 24.53075 6.751397 9.500052       4.162645 1.631261       9.616652 11.31433       4.617660 18.78702 8.728027 26.58887 7.023233 -7.801849      11.20287 
1 1 1 -11 36 27 o 41.72602 4.412005 23.77919       4.418337 14.46474       7.388065 28.96528       5.512802 26.91435 9.283863 45.32086 5.078842 -18.40651      10.58228 
1 1 1 -11 36 28 o 12.14314 5.508512 -0.5510676     3.529881 -1.368742      6.413325 -0.1957123     4.227896 14.97306 7.012588 13.35146 6.045453 1.621600       9.258719 
1 1 1 -11 37 1  o 43.85729 3.853072 24.38121       4.076172 21.81338       5.536194 27.42128       6.023779 40.51552 5.770201 45.64027 5.528651 -5.124748      7.991321 
1 1 1 -11 37 2  o 73.30059 3.954960 67.90228       7.038406 49.79771       10.12578 84.82706       9.790308 60.47036 7.000640 81.12128 4.976461 -20.65092      8.589187 
1 1 1 -11 37 3  o 57.98293 3.329190 42.08543       4.684306 48.65031       6.883638 36.42341       6.392781 61.61772 4.617928 53.04309 5.004833 8.574627       6.809817 
1 1 1 -11 37 4  o 22.60889 6.263851 6.983274       3.569900 6.213263       4.854314 7.890206       5.268254 21.73063 7.523966 23.89201 7.837615 -2.161385      10.86454 
1 1 1 -11 37 5  o 42.27744 3.971655 22.70638       4.043896 21.47082       5.652223 24.00204       5.788063 40.11155 5.963644 42.58538 5.722138 -2.473827      8.264860 
1 1 1 -11 37 6  o 64.96951 3.216769 52.73049       5.077068 55.25208       7.427444 50.51894       6.955851 65.62528 4.675043 62.80506 4.576251 2.820221       6.542026 
1 1 1 -11 37 7  o 18.12186 6.941889 3.515266       4.287765 1.913143       6.438789 4.791860       5.747546 18.89544 8.025317 20.68132 8.006987 -1.785873      11.33656 
1 1 1 -11 37 8  o 27.53930 6.719449 10.55893       4.468893 13.54637       8.192752 9.293571       5.331975 29.82199 9.773335 25.54478 7.827184 4.277218       12.52130 
1 1 1 -11 37 9  o 20.07258 6.929055 5.247055       4.115773 7.252450       7.276530 4.303646       4.990848 23.73487 9.055264 19.53692 7.488060 4.197954       11.75027 
1 1 1 -11 37 10 o 23.79152 7.049165 7.951940       4.377502 19.73444       8.979516 4.278841       5.013610 35.39627 9.981359 19.48607 7.495760 15.91020       12.48254 
1 1 1 -11 37 11 o 111.1333 3.434106 155.1518       9.289081 121.2587       17.69661 168.0419       10.91344 92.42207 7.934089 115.1694 3.894158 -22.74737      8.838225 
1 1 1 -11 37 12 o 13.99560 6.081871 0.1107359      3.861092 5.641447       7.615378 -1.802928      4.479544 22.31571 9.029512 13.55069 6.169857 8.765022       10.93614 
1 1 1 -11 37 13 o 31.94681 5.673577 13.85131       4.255130 23.52833       9.084370 11.13143       4.816133 38.51183 9.689430 27.82398 7.085142 10.68785       12.00351 
1 1 1 -11 37 14 f 87.99069 5.055793 101.6662       10.79518 0.000000       0.000000 101.6662       10.79518 ?        ?        87.99069 5.055793 0.000000       5.055793 
1 1 1 -11 37 15 o 16.86605 6.514761 3.107643       3.798379 -3.139702      7.244752 5.475948       4.460614 16.37542 7.596632 20.18960 7.194533 -3.814178      10.46280 
1 1 1 -11 37 16 o 37.35690 5.299850 18.78530       4.689438 14.89313       9.407104 20.07235       5.409497 29.47453 10.45366 38.13620 6.020330 -8.661671      12.06331 
1 1 1 -11 37 17 o 13.84105 6.065402 0.5165534E-01  3.910230 4.231103       7.713616 -1.393796      4.536283 20.77373 8.801853 13.72118 6.232343 7.052555       10.78493 
1 1 1 -11 37 18 o 56.31551 3.919929 40.91840       5.345924 44.21210       10.89443 39.87378       6.135381 53.31891 8.683223 55.00318 4.620046 -1.684269      9.835812 
1 1 1 -11 37 19 o 27.15920 8.255657 11.75249       5.947273 5.531424       7.889073 19.94233       9.051716 21.39797 8.974480 33.38882 10.19207 -11.99085      13.58012 
1 1 1 -11 37 20 o 17.54638 6.943488 3.603894       4.401688 3.416660       8.161367 3.680698       5.227080 19.96415 8.755298 18.22438 7.441099 1.739775       11.49022 
1 1 1 -11 37 21 o 32.23241 6.607956 15.37634       5.015896 25.93231       9.998957 11.82676       5.798219 36.92290 10.57333 26.85460 8.149180 10.06830       13.34932 
1 1 1 -11 37 22 o 17.97026 6.803140 4.379342       4.087677 5.667540       6.363883 3.474562       5.333380 20.17138 8.220131 17.81406 7.418326 2.357328       11.07258 
1 1 1 -11 37 23 o 40.73042 4.397196 22.36701       4.295367 28.45501       7.374784 19.24143       5.284173 42.65224 7.361259 36.10540 6.230871 6.546841       9.644268 
1 1 1 -11 37 24 o 12.82952 5.650405 0.2704793      3.432512 -3.658394      5.343066 3.031420       4.479042 13.02367 6.189669 16.49507 6.827454 -3.471403      9.215537 
1 1 1 -11 37 25 o 29.19948 6.300457 13.01064       4.351410 15.12283       10.52716 12.57538       4.778766 25.43563 10.49160 27.96006 7.023704 -2.524429      12.62561 
1 1 1 -11 37 26 o 16.45373 6.442962 3.662337       3.755058 1.891454       6.451629 4.569585       4.617826 16.77010 7.541938 17.80221 7.090183 -1.032110      10.35140 
1 1 1 -11 37 27 o 23.85522 6.573143 9.156737       3.943141 10.63568       7.032370 8.478533       4.762190 23.08987 8.878685 22.12624 7.457268 0.9636364      11.59491 
1 1 1 -11 38 1  f 53.36730 5.236686 37.71538       6.722734 36.82477       9.391079 38.65151       9.628115 50.31446 7.920825 51.56952 7.913810 -1.255054      11.19678 
1 1 1 -11 38 2  o 18.21322 6.364243 4.276266       3.477239 2.485975       4.446230 7.095672       5.579676 16.94573 6.883809 22.56806 8.046070 -5.622324      10.58896 
1 1 1 -11 38 3  o 38.68765 4.747026 19.62546       4.381695 29.79291       6.057030 8.463331       6.346398 47.34842 5.342691 24.19993 8.585936 23.14849       10.11250 
1 1 1 -11 38 4  o 43.78036 5.236593 25.42440       5.476134 31.17606       8.984820 22.02502       6.907370 45.92826 8.334599 39.10210 7.522041 6.826160       11.22705 
1 1 1 -11 38 5  o 81.19609 4.834320 85.88033       9.522171 87.84453       13.00223 83.60828       13.98409 79.73790 6.754896 76.63037 7.588069 3.107529       10.15911 
1 1 1 -11 38 6  o 57.74541 5.529569 44.46297       7.686220 52.59675       10.81108 36.14956       10.92981 60.82191 7.449460 48.05475 9.668626 12.76715       12.20560 
1 1 1 -11 38 7  o 27.29116 7.916903 11.09176       5.571949 0.000000       0.000000 11.09176       5.571949 ?        ?        27.29116 7.916903 0.000000       7.916903 
1 1 1 -11 38 8  o 24.22230 6.836330 8.400587       4.210426 12.45879       7.540737 6.562272       5.075245 28.10392 9.382892 21.77372 7.682458 6.330198       12.12678 
1 1 1 -11 38 9  o 33.70297 6.433918 15.89338       5.091516 18.59241       10.23912 15.00676       5.868501 32.65965 10.93408 31.89651 7.648891 0.7631321      13.34390 
1 1 1 -11 38 10 o 37.59970 5.723372 19.23415       5.078885 13.90902       8.620059 22.06576       6.285811 29.05091 10.02778 39.54564 6.765728 -10.49474      12.09675 
1 1 1 -11 38 11 o 18.10476 6.954327 3.810488       4.311144 9.091094       7.950551 1.611172       5.130967 24.76139 9.460855 16.81037 7.152798 7.951021       11.86045 
1 1 1 -11 38 12 o 33.57640 6.133771 15.70847       4.833897 14.85108       8.418852 16.13016       5.904123 29.78028 9.913496 33.03798 7.504858 -3.257700      12.43384 
1 1 1 -11 38 13 o 41.71519 6.771291 24.76058       6.647569 0.000000       0.000000 24.76058       6.647569 ?        ?        41.71519 6.771291 0.000000       6.771291 
1 1 1 -11 38 14 o 18.89907 7.188055 4.491692       4.576128 -3.108335      7.385430 9.227838       5.830164 16.34166 7.611151 24.51174 8.251160 -8.170080      11.22547 
1 1 1 -11 38 15 o 18.15915 6.972294 4.034108       4.332201 5.451049       7.815187 3.405566       5.205119 21.44546 8.959018 18.18855 7.425838 3.256910       11.63645 
1 1 1 -11 38 16 o 25.81079 8.301173 10.60713       5.926112 17.59882       8.485696 3.950802       8.279677 31.59698 9.906608 20.58318 8.925587 11.01380       13.33443 
1 1 1 -11 38 17 o 26.89018 7.295403 11.08488       4.901008 6.571155       8.083702 13.70836       6.162857 21.95910 9.137754 29.10397 8.290123 -7.144861      12.33794 
1 1 1 -11 38 18 o 26.85510 7.584646 11.36150       5.180791 11.77988       8.227798 11.08664       6.668857 25.72473 9.670987 25.58761 8.820663 0.1371212      13.08939 
1 1 1 -11 38 19 o 16.69465 6.528190 3.362270       3.850596 -3.153637      7.430424 5.754595       4.502319 15.84705 7.461571 19.80811 7.206162 -3.961056      10.37323 
1 1 1 -11 38 20 o 37.53750 5.217742 19.63376       4.644062 28.15573       10.17000 17.38855       5.220101 37.83438 10.60604 34.15595 6.509142 3.678436       12.44416 
1 1 1 -11 38 21 o 40.54371 5.145871 22.96299       4.969780 42.14949       11.23276 18.29311       5.541682 47.73199 9.978662 34.53629 6.826683 13.19571       12.09038 
1 1 1 -11 38 22 o 15.36252 6.308517 2.468835       3.783983 9.822651       8.117647 0.4273350      4.277091 22.94493 9.308538 14.07647 6.248202 8.868467       11.21111 
1 1 1 -11 38 23 o 15.84368 6.287977 3.102614       3.619677 6.610395       6.178234 1.269271       4.466527 20.23854 8.152934 14.86117 6.498207 5.377370       10.42579 
1 1 1 -11 38 24 o 19.80897 7.067454 6.339443       4.305699 -7.188974      10.26158 9.230187       4.743464 16.01240 7.838402 23.28979 7.420283 -7.277395      10.79357 
1 1 1 -11 39 1  o 28.09602 5.133863 10.72928       3.385514 18.04876       4.989486 4.484052       4.608819 36.10394 5.872718 18.92277 7.209722 17.18118       9.298865 
1 1 1 -11 39 2  o 50.58891 3.493855 32.60852       4.280756 32.62949       6.294323 32.59047       5.839083 49.22359 5.332405 49.55579 4.899236 -0.3322067     7.241343 
1 1 1 -11 39 3  o 14.11926 5.670012 1.708320       2.978134 3.294967       4.095008 -0.7304279E-01 4.339012 17.24290 6.735207 14.37358 6.340742 2.869321       9.250298 
1 1 1 -11 39 4  o 10.12527 4.766657 -2.734854      3.030039 1.154512       4.257672 -6.726163      4.313110 15.28356 6.509859 10.56317 5.151589 4.720397       8.301635 
1 1 1 -11 39 5  o 12.68027 5.676460 -0.7635466     3.608777 -1.997331      4.567911 1.285269       5.886395 13.37839 6.143610 17.25873 7.504557 -3.880336      9.698572 
1 1 1 -11 39 6  o 40.37561 4.114788 21.17807       3.992058 25.63907       5.966260 17.56192       5.371680 43.21219 5.813095 35.16941 6.507327 8.042786       8.725674 
1 1 1 -11 39 7  o 21.70146 7.004559 6.806325       4.216914 9.277907       8.894504 6.089699       4.789393 24.72718 9.842768 20.85067 7.452216 3.876507       12.34567 
1 1 1 -11 39 8  o 26.93700 6.713948 10.56487       4.391386 18.66399       9.273781 8.223918       4.985795 32.47540 10.37842 23.44803 7.620294 9.027372       12.87558 
1 1 1 -11 39 9  o 19.36122 7.351325 4.838407       4.781383 0.000000       0.000000 4.838407       4.781383 ?        ?        19.36122 7.351325 0.000000       7.351325 
1 1 1 -11 39 10 o 38.51637 5.333247 20.18245       4.871632 14.43272       9.384188 22.30365       5.699855 28.45280 10.39558 39.95614 6.042403 -11.50334      12.02409 
1 1 1 -11 39 11 o 17.17308 6.688567 3.397199       4.029102 15.68644       8.052038 -0.7075871     4.653595 30.13021 9.674911 14.25330 6.408102 15.87691       11.60464 
1 1 1 -11 39 12 o 16.98361 7.002938 2.691996       4.688025 0.000000       0.000000 2.691996       4.688025 ?        ?        16.98361 7.002938 0.000000       7.002938 
1 1 1 -11 39 13 o 18.72249 6.814240 4.786859       4.026526 1.450053       7.172376 6.322461       4.865605 18.18210 8.079719 20.81549 7.502524 -2.633396      11.02587 
1 1 1 -11 39 14 o 19.11728 6.895678 5.129820       4.111262 3.580810       7.607868 5.768763       4.886154 19.66479 8.541380 20.10046 7.473606 -0.4356689     11.34945 
1 1 1 -11 39 15 o 19.93813 6.983394 5.826467       4.188231 -1.258525      7.923508 8.573545       4.933821 17.20376 7.968271 23.34322 7.580042 -6.139460      10.99774 
1 1 1 -11 39 16 o 19.52751 7.044477 5.564148       4.290760 1.191531       8.033803 7.309221       5.075248 18.33242 8.313824 21.64683 7.678279 -3.314402      11.31705 
1 1 1 -11 39 17 o 16.03905 6.850911 2.005262       4.739069 1.976949       7.377768 2.025150       6.183417 18.13727 8.118062 17.29968 7.602738 0.8375931      11.12226 
1 1 1 -11 39 18 o 35.12451 6.727734 18.74146       5.548975 16.06522       8.801769 20.50676       7.148538 28.07454 10.09435 34.62778 8.528522 -6.553242      13.21482 
1 1 1 -11 39 19 o 12.07495 5.575072 -1.563939      3.833809 6.847369       7.777406 -4.263879      4.406361 20.96634 8.858659 11.46486 5.495758 9.501471       10.42493 
1 1 1 -11 39 20 o 13.97126 6.064926 0.9900981      3.831285 5.006881       8.037202 -0.1910691     4.358343 19.71037 8.664789 13.70129 6.177073 6.009084       10.64118 
1 1 1 -11 39 21 o 25.31178 6.972288 10.37356       4.437353 14.84924       9.189540 9.012691       5.067252 25.88037 10.09515 22.91694 7.692218 2.963432       12.69182 
1 1 1 -11 39 22 o 22.84928 6.925104 8.545514       4.188959 10.62713       8.643140 7.906445       4.789000 22.83559 9.470957 21.58271 7.473156 1.252886       12.06429 
1 1 1 -11 40 1  o 20.53930 6.121579 6.119826       3.293522 3.596741       4.542344 8.916651       4.782409 17.60714 7.025537 23.98086 7.424469 -6.373716      10.22159 
1 1 1 -11 40 2  o 18.03511 6.191070 4.506572       3.284250 7.977243       4.840392 1.545610       4.470850 22.76898 7.514756 15.62781 6.664117 7.141173       10.04400 
1 1 1 -11 40 3  o 32.15840 5.729957 14.54852       4.325699 8.674649       5.227643 27.30418       7.703619 23.54572 7.811056 42.14462 7.787757 -18.59890      11.03004 
1 1 1 -11 40 4  f 19.10117 6.264934 5.194382       3.366198 -1.228788      4.826625 11.27734       4.697063 14.03744 6.396490 27.31332 7.019259 -13.27588      9.496582 
1 1 1 -11 40 5  o 42.83811 3.988609 23.96959       4.115938 26.87019       6.050310 21.47083       5.615598 43.82369 5.808304 38.84369 6.136051 4.980000       8.449114 
1 1 1 -11 40 6  o 20.29175 6.209907 5.963795       3.357520 3.240260       4.865751 8.439265       4.638870 17.53531 7.171845 23.44799 7.320676 -5.912678      10.24830 
1 1 1 -11 40 7  o 25.90294 6.645828 9.995770       4.215349 16.13306       8.307235 7.867501       4.891943 29.80203 9.845079 22.60089 7.557592 7.201132       12.41140 
1 1 1 -11 40 8  o 15.39017 6.445677 1.826469       4.060780 -6.611644      7.638338 5.150955       4.794446 14.88432 7.161033 19.37077 7.359861 -4.486445      10.26879 
1 1 1 -11 40 9  o 12.10411 5.598470 -1.968613      3.891210 -13.14438      7.033504 2.960742       4.671195 12.24671 6.085336 17.03478 7.003695 -4.788070      9.278095 
1 1 1 -11 40 10 o 18.28188 6.775472 4.562764       4.009902 8.762705       7.726458 3.014530       4.691127 23.18336 9.191354 17.06152 7.017071 6.121838       11.56375 
1 1 1 -11 40 11 o 32.36377 6.851785 15.77032       5.235214 0.000000       0.000000 15.77032       5.235214 ?        ?        32.36377 6.851785 0.000000       6.851785 
1 1 1 -11 40 12 o 14.48422 6.238719 1.071387       3.991503 -3.599849      8.104154 2.567463       4.586364 16.23852 7.689933 16.45949 6.868663 -0.2209663     10.31085 
1 1 1 -11 40 13 o 13.16758 5.874409 -0.1877791     3.829817 -0.1932423     7.283319 -0.1856911     4.502556 16.92777 7.767671 14.08894 6.321225 2.838839       10.01472 
1 1 1 -11 40 14 o 18.21852 6.701335 4.735165       3.909891 9.440834       8.143335 3.325378       4.457264 23.10498 9.341446 16.93089 6.886946 6.174093       11.60572 
1 1 1 -11 40 15 o 20.21562 7.605750 6.338315       5.091064 -1.443434      7.651274 12.52090       6.819931 16.46729 7.695194 26.14429 8.922989 -9.676998      11.78286 
1 1 1 -11 40 16 o 11.84200 5.501747 -1.887463      3.821728 3.783231       7.063130 -4.234933      4.544427 18.70577 8.175621 11.68322 5.595299 7.022557       9.906975 
1 1 1 -11 40 17 o 29.17728 6.627563 13.16754       4.604632 16.83802       8.989315 11.86188       5.361418 28.02375 10.18424 26.43468 7.793254 1.589077       12.82394 
1 1 1 -11 40 18 o 21.17677 7.545184 7.458165       4.905841 3.503071       7.906608 9.933987       6.255636 18.69114 8.382072 23.33681 8.493546 -4.645674      11.93312 
1 1 1 -11 40 19 o 12.95438 5.992721 -1.393010      4.461244 -4.615854      7.402568 0.4451535      5.590554 14.67374 7.057138 15.31979 6.942708 -0.6460505     9.899717 
1 1 1 -11 41 1  o 12.75992 5.462320 0.7537295      3.024744 0.4194985      4.029856 1.184987       4.577566 13.87649 6.116507 15.13835 6.599710 -1.261856      8.998213 
1 1 1 -11 41 2  f 22.86323 6.764365 8.104546       4.033289 9.855441       5.146853 5.318334       6.492600 24.45761 7.721757 19.75878 8.202912 4.698826       11.26558 
1 1 1 -11 41 3  o 26.23887 6.208633 10.26706       3.907565 14.62403       5.272530 4.957858       5.820240 30.53746 7.202752 19.21907 7.850164 11.31839       10.65386 
1 1 1 -11 41 4  o 14.60344 5.946822 2.058132       3.327812 1.135135       4.187134 3.640968       5.483208 14.69255 6.359304 17.94193 7.500471 -3.249383      9.833505 
1 1 1 -11 41 5  o 16.62469 6.650970 3.266055       4.081712 1.225701       6.402184 4.663360       5.298110 16.92141 7.568917 18.73157 7.548489 -1.810158      10.68963 
1 1 1 -11 41 6  o 20.35229 6.598688 6.284807       3.739816 8.159224       4.847727 3.529355       5.877621 22.49857 7.523360 18.08505 7.673832 4.413519       10.74656 
1 1 1 -11 41 7  o 17.11401 7.021129 3.347218       4.681493 -3.156708      6.853205 9.037528       6.410234 15.08565 7.122240 22.97801 8.556972 -7.892365      11.13320 
1 1 1 -11 41 8  o 11.33537 5.419647 -4.043576      4.225135 -8.407669      6.022508 0.1861600      5.929075 12.16352 5.964778 15.82648 7.163318 -3.662966      9.321571 
1 1 1 -11 41 9  o 15.77753 7.043534 0.7857062      5.515683 0.000000       0.000000 0.7857062      5.515683 ?        ?        15.77753 7.043534 0.000000       7.043534 
1 1 1 -11 41 10 o 34.37704 6.503297 17.79255       5.248515 20.23087       8.797356 16.44505       6.539897 31.77260 10.10327 30.80197 8.456498 0.9706345      13.17530 
1 1 1 -11 41 11 f 17.74637 7.061473 4.178940       4.576412 -3.260881      7.046729 9.605649       6.018311 15.11529 7.161756 23.45522 8.356998 -8.339933      11.00592 
1 1 1 -11 41 12 o 28.58065 7.396587 13.28123       5.190879 15.79524       8.939377 12.00231       6.375945 27.36047 10.12074 25.73529 8.628436 1.625187       13.29960 
1 1 1 -11 41 13 o 28.18795 8.545211 14.27258       6.377676 0.000000       0.000000 14.27258       6.377676 ?        ?        28.18795 8.545211 0.000000       8.545211 
1 1 1 -11 41 14 o 26.05848 8.826556 12.76567       6.671775 14.13570       8.712561 10.82327       10.37407 25.82163 9.894429 23.12188 10.00877 2.699757       14.07392 
1 1 1 -11 41 15 o 32.61791 6.997450 16.89484       5.395322 13.96087       8.771686 18.68035       6.842846 25.48160 9.884480 32.29779 8.558177 -6.816191      13.07461 
1 1 1 -11 41 16 o 27.17293 6.687145 11.68166       4.397530 15.41161       8.726375 10.41201       5.091259 26.52492 9.962266 24.58683 7.668280 1.938093       12.57176 
1 1 1 -11 42 1  o 14.00292 5.835314 1.716702       3.303379 4.294275       4.978839 -0.3102674     4.415158 17.85402 7.272658 13.64161 6.177251 4.212412       9.542012 
1 1 1 -11 42 2  o 9.255529 4.480516 -4.058120      3.104454 -5.909689      4.608659 -2.520059      4.200408 10.99646 5.354494 11.98427 5.632572 -0.9878120     7.771516 
1 1 1 -11 42 3  o 16.50972 6.254010 3.705729       3.455657 1.806275       5.207255 5.200559       4.619451 15.99457 7.004529 18.68193 7.192829 -2.687362      10.03993 
1 1 1 -11 42 4  o 14.77868 5.991233 2.337237       3.359987 -1.021785      4.891392 5.338276       4.623405 13.79925 6.344412 18.84140 7.210730 -5.042144      9.604487 
1 1 1 -11 42 5  o 12.20661 5.440934 -0.1386459     3.277991 2.813424       4.825278 -2.668591      4.466986 16.48923 6.972868 12.30199 5.790207 4.187235       9.063519 
1 1 1 -11 42 6  o 9.539955 4.573869 -3.356718      3.055132 -3.082106      4.250198 -3.650313      4.394640 11.75935 5.568825 11.68499 5.570361 0.7435894E-01  7.876594 
1 1 1 -11 42 7  o 10.75329 5.151398 -3.808810      3.857948 0.2207537      6.589330 -5.910580      4.758880 16.15954 7.405171 11.21821 5.457635 4.941330       9.199040 
1 1 1 -11 42 8  o 23.20583 7.637920 9.155813       5.001567 0.000000       0.000000 9.155813       5.001567 ?        ?        23.20583 7.637920 0.000000       7.637920 
1 1 1 -11 42 9  o 14.64372 6.293976 1.541605       4.046017 8.205243       7.441279 -1.255286      4.820917 21.54128 8.846283 13.53626 6.250463 8.005021       10.83167 
1 1 1 -11 42 10 o 14.53558 6.193924 1.659320       3.857345 1.971643       7.102965 1.528685       4.593756 17.39035 7.858755 15.16722 6.611850 2.223130       10.27018 
1 1 1 -11 42 11 o 16.73226 6.616973 3.720876       3.995027 5.661139       7.077852 2.813702       4.839677 19.59831 8.371863 16.40194 6.961666 3.196377       10.88820 
1 1 1 -10 0  1  o 328.5392 7.052781 1317.474       56.40683 1317.474       56.40683 1317.474       56.40683 328.5392 7.052781 328.5392 7.052781 0.000000       0.000000 
1 1 1 -10 0  2  o 45.13593 4.726278 25.63303       5.055911 25.63303       5.055911 25.63303       5.055911 45.13593 4.726278 45.13593 4.726278 0.000000       0.000000 
1 1 1 -10 0  3  o 1031.962 29.62486 13093.19       743.6110 13093.19       743.6110 13093.19       743.6110 1031.962 29.62486 1031.962 29.62486 0.000000       0.000000 
1 1 1 -10 0  4  o 914.2007 18.49263 10221.79       411.5999 10221.79       411.5999 10221.79       411.5999 914.2007 18.49263 914.2007 18.49263 0.000000       0.000000 
1 1 1 -10 0  5  o 113.4786 3.470001 157.3577       9.575443 157.3577       9.575443 157.3577       9.575443 113.4786 3.470001 113.4786 3.470001 0.000000       0.000000 
1 1 1 -10 0  6  o 719.1959 20.72430 6337.803       362.5317 6337.803       362.5317 6337.803       362.5317 719.1959 20.72430 719.1959 20.72430 0.000000       0.000000 
1 1 1 -10 0  7  o 808.4068 16.37716 7988.240       322.3312 7988.240       322.3312 7988.240       322.3312 808.4068 16.37716 808.4068 16.37716 0.000000       0.000000 
1 1 1 -10 0  8  o 241.9207 5.453387 714.3447       32.11271 714.3447       32.11271 714.3447       32.11271 241.9207 5.453387 241.9207 5.453387 0.000000       0.000000 
1 1 1 -10 0  9  o 43.51334 3.679335 23.56343       3.834846 23.56343       3.834846 23.56343       3.834846 43.51334 3.679335 43.51334 3.679335 0.000000       0.000000 
1 1 1 -10 0  10 o 837.7673 16.98874 8580.859       346.5114 8580.859       346.5114 8580.859       346.5114 837.7673 16.98874 837.7673 16.98874 0.000000       0.000000 
1 1 1 -10 0  11 o 73.08582 3.347550 65.49806       5.933484 65.49806       5.933484 65.49806       5.933484 73.08582 3.347550 73.08582 3.347550 0.000000       0.000000 
1 1 1 -10 0  12 o 839.5751 17.00378 8619.275       347.5674 8619.275       347.5674 8619.275       347.5674 839.5751 17.00378 839.5751 17.00378 0.000000       0.000000 
1 1 1 -10 0  13 o 14.98615 7.949598 3.936006       3.906887 3.936006       3.906887 3.936006       3.906887 14.98615 7.949598 14.98615 7.949598 0.000000       0.000000 
1 1 1 -10 0  14 o 257.5980 5.777508 809.9820       36.22644 809.9820       36.22644 809.9820       36.22644 257.5980 5.777508 257.5980 5.777508 0.000000       0.000000 
1 1 1 -10 0  15 o 397.8926 8.379692 1932.897       81.16991 1932.897       81.16991 1932.897       81.16991 397.8926 8.379692 397.8926 8.379692 0.000000       0.000000 
1 1 1 -10 0  16 o 663.8683 13.55021 5387.096       219.0058 5387.096       219.0058 5387.096       219.0058 663.8683 13.55021 663.8683 13.55021 0.000000       0.000000 
1 1 1 -10 0  17 o 350.0569 7.477612 1496.112       63.72213 1496.112       63.72213 1496.112       63.72213 350.0569 7.477612 350.0569 7.477612 0.000000       0.000000 
1 1 1 -10 0  18 o 131.2623 5.725782 211.2245       18.23566 211.2245       18.23566 211.2245       18.23566 131.2623 5.725782 131.2623 5.725782 0.000000       0.000000 
1 1 1 -10 0  19 o 59.95779 6.247384 45.23738       8.880568 45.23738       8.880568 45.23738       8.880568 59.95779 6.247384 59.95779 6.247384 0.000000       0.000000 
1 1 1 -10 0  20 o 54.94827 4.121477 37.41777       5.445702 37.41777       5.445702 37.41777       5.445702 54.94827 4.121477 54.94827 4.121477 0.000000       0.000000 
1 1 1 -10 0  21 o 295.1164 6.511210 1063.804       46.77498 1063.804       46.77498 1063.804       46.77498 295.1164 6.511210 295.1164 6.511210 0.000000       0.000000 
1 1 1 -10 0  22 o 258.1693 5.874456 814.1724       36.91479 814.1724       36.91479 814.1724       36.91479 258.1693 5.874456 258.1693 5.874456 0.000000       0.000000 
1 1 1 -10 0  23 o 66.43351 3.915473 54.36141       6.287941 54.36141       6.287941 54.36141       6.287941 66.43351 3.915473 66.43351 3.915473 0.000000       0.000000 
1 1 1 -10 0  24 o 81.29057 3.771364 81.08260       7.434181 81.08260       7.434181 81.08260       7.434181 81.29057 3.771364 81.29057 3.771364 0.000000       0.000000 
1 1 1 -10 0  25 o 7.908025 5.477755 -3.059592      3.634179 -3.059592      3.634179 -3.059592      3.634179 7.908025 5.477755 7.908025 5.477755 0.000000       0.000000 
1 1 1 -10 0  26 o 43.34368 6.233485 24.31164       6.189130 24.31164       6.189130 24.31164       6.189130 43.34368 6.233485 43.34368 6.233485 0.000000       0.000000 
1 1 1 -10 0  27 o 311.8813 6.891788 1190.341       52.32128 1190.341       52.32128 1190.341       52.32128 311.8813 6.891788 311.8813 6.891788 0.000000       0.000000 
1 1 1 -10 0  28 o 89.18333 3.959172 97.58561       8.565766 97.58561       8.565766 97.58561       8.565766 89.18333 3.959172 89.18333 3.959172 0.000000       0.000000 
1 1 1 -10 0  29 o 216.0562 5.303815 571.0313       27.88686 571.0313       27.88686 571.0313       27.88686 216.0562 5.303815 216.0562 5.303815 0.000000       0.000000 
1 1 1 -10 0  30 o 66.61009 4.418634 54.86085       7.098903 54.86085       7.098903 54.86085       7.098903 66.61009 4.418634 66.61009 4.418634 0.000000       0.000000 
1 1 1 -10 0  31 o 99.57040 6.211221 122.6442       14.93507 122.6442       14.93507 122.6442       14.93507 99.57040 6.211221 99.57040 6.211221 0.000000       0.000000 
1 1 1 -10 0  32 o 64.86678 4.511251 52.11807       7.050480 52.11807       7.050480 52.11807       7.050480 64.86678 4.511251 64.86678 4.511251 0.000000       0.000000 
1 1 1 -10 0  33 o 58.47738 4.777151 42.60361       6.699607 42.60361       6.699607 42.60361       6.699607 58.47738 4.777151 58.47738 4.777151 0.000000       0.000000 
1 1 1 -10 0  34 o 13.26626 8.181211 1.652246       5.175617 1.652246       5.175617 1.652246       5.175617 13.26626 8.181211 13.26626 8.181211 0.000000       0.000000 
1 1 1 -10 0  35 o 78.51851 4.375782 76.03476       8.312774 76.03476       8.312774 76.03476       8.312774 78.51851 4.375782 78.51851 4.375782 0.000000       0.000000 
1 1 1 -10 0  36 o 145.9419 4.531239 261.1973       16.07990 261.1973       16.07990 261.1973       16.07990 145.9419 4.531239 145.9419 4.531239 0.000000       0.000000 
1 1 1 -10 0  37 o 84.50040 5.757800 88.80227       11.72793 88.80227       11.72793 88.80227       11.72793 84.50040 5.757800 84.50040 5.757800 0.000000       0.000000 
1 1 1 -10 0  38 o 59.81817 5.180425 44.86040       7.415799 44.86040       7.415799 44.86040       7.415799 59.81817 5.180425 59.81817 5.180425 0.000000       0.000000 
1 1 1 -10 0  39 o 106.4161 4.362653 139.5164       11.27011 139.5164       11.27011 139.5164       11.27011 106.4161 4.362653 106.4161 4.362653 0.000000       0.000000 
1 1 1 -10 0  40 o 60.43031 5.023758 45.86476       7.276269 45.86476       7.276269 45.86476       7.276269 60.43031 5.023758 60.43031 5.023758 0.000000       0.000000 
1 1 1 -10 0  41 o 26.32177 12.58301 13.33261       9.260531 13.33261       9.260531 13.33261       9.260531 26.32177 12.58301 26.32177 12.58301 0.000000       0.000000 
1 1 1 -10 0  42 o 15.42509 9.263448 3.452953       6.264188 3.452953       6.264188 3.452953       6.264188 15.42509 9.263448 15.42509 9.263448 0.000000       0.000000 
1 1 1 -10 0  43 o 22.91070 9.579198 9.549964       5.355700 9.549964       5.355700 9.549964       5.355700 22.91070 9.579198 22.91070 9.579198 0.000000       0.000000 
1 1 1 -10 0  44 o 10.49567 6.952423 -0.7007245     4.669496 -0.7007245     4.669496 -0.7007245     4.669496 10.49567 6.952423 10.49567 6.952423 0.000000       0.000000 
1 1 1 -10 0  45 o 25.28300 9.898825 11.75133       5.832540 11.75133       5.832540 11.75133       5.832540 25.28300 9.898825 25.28300 9.898825 0.000000       0.000000 
1 1 1 -10 0  46 o 15.70807 9.294296 4.835894       6.131730 4.835894       6.131730 4.835894       6.131730 15.70807 9.294296 15.70807 9.294296 0.000000       0.000000 
1 1 1 -10 0  47 o 15.32847 8.888145 4.917449       5.420388 4.917449       5.420388 4.917449       5.420388 15.32847 8.888145 15.32847 8.888145 0.000000       0.000000 
1 1 1 -10 0  48 o 12.09392 7.810808 1.546158       5.370664 1.546158       5.370664 1.546158       5.370664 12.09392 7.810808 12.09392 7.810808 0.000000       0.000000 
1 1 1 -10 0  49 o 8.993889 6.502169 -10.40676      7.435310 -10.40676      7.435310 -10.40676      7.435310 8.993889 6.502169 8.993889 6.502169 0.000000       0.000000 
1 1 1 -10 0  50 o 9.153961 6.402634 -3.009011      5.300069 -3.009011      5.300069 -3.009011      5.300069 9.153961 6.402634 9.153961 6.402634 0.000000       0.000000 
1 1 1 -10 0  51 o 11.75476 7.691434 2.108515       5.450112 2.108515       5.450112 2.108515       5.450112 11.75476 7.691434 11.75476 7.691434 0.000000       0.000000 
1 1 1 -10 1  1  o 408.9125 6.973043 2038.842       69.48464 2052.033       120.4970 2032.270       85.04945 409.7576 12.08058 408.1780 8.550388 1.579590       14.80032 
1 1 1 -10 1  2  o 454.7403 7.681557 2521.843       85.12336 2551.200       148.2893 2507.415       103.9573 456.7789 13.33622 453.3369 9.410174 3.441986       16.32195 
1 1 1 -10 1  3  o 882.5673 14.56044 9520.960       313.1544 9323.669       378.0125 9952.557       559.1022 872.6973 17.77487 899.0412 25.54560 -26.34393      31.12111 
1 1 1 -10 1  4  o 872.9704 14.40211 9314.198       306.3810 9286.722       374.5225 9369.788       532.7107 871.0098 17.64488 872.4935 25.08095 -1.483704      30.66588 
1 1 1 -10 1  5  o 483.4951 8.135079 2851.109       95.84953 2916.427       168.1525 2819.671       116.6572 488.3178 14.14564 480.7053 9.958562 7.612518       17.29948 
1 1 1 -10 1  6  o 596.3126 8.600762 4337.359       124.9819 4300.506       175.8272 4374.997       177.6896 593.4526 12.15805 598.5676 12.18183 -5.115051      17.21091 
1 1 1 -10 1  7  o 735.8317 10.54745 6608.021       189.1307 6552.206       265.6053 6665.435       269.3770 732.1258 14.88727 738.4113 14.97015 -6.285461      21.11246 
1 1 1 -10 1  8  o 469.5803 6.854947 2688.595       78.44226 2711.184       111.5726 2666.515       110.3064 471.3851 9.712830 467.4878 9.682652 3.897278       13.71469 
1 1 1 -10 1  9  o 841.6868 12.03266 8650.440       246.8018 8222.587       336.8604 9146.238       362.6226 819.7622 16.86266 864.5034 17.21282 -44.74121      24.09627 
1 1 1 -10 1  10 o 730.5021 10.46877 6512.815       186.3602 6590.214       265.7004 6437.867       261.4571 734.2149 14.85022 725.6895 14.78473 8.525391       20.95513 
1 1 1 -10 1  11 o 348.9922 5.235110 1484.646       44.52231 1448.136       61.98997 1523.545       63.98555 344.6017 7.381896 353.4581 7.428615 -8.856445      10.47267 
1 1 1 -10 1  12 o 131.3947 3.052533 210.3913       9.774049 223.0393       12.30406 188.7599       16.09091 135.2299 3.737285 124.3239 5.323489 10.90596       6.504371 
1 1 1 -10 1  13 o 106.5439 3.481011 138.4893       9.025824 134.0769       12.60869 143.1266       12.92611 104.7609 4.952979 108.2484 4.912965 -3.487579      6.976334 
1 1 1 -10 1  14 o 316.6484 5.582704 1222.375       43.07825 1171.608       72.72743 1249.813       53.46690 309.6811 9.648897 320.1371 6.853508 -10.45593      11.83519 
1 1 1 -10 1  15 o 746.5940 10.71261 6806.776       194.9017 6436.521       265.0591 7242.627       287.5818 725.2311 14.99789 769.2281 15.34158 -43.99695      21.45462 
1 1 1 -10 1  16 o 582.8079 8.431866 4144.904       119.7527 4096.402       168.0332 4194.963       170.7102 578.9523 11.91012 585.8688 11.95702 -6.916565      16.87665 
1 1 1 -10 1  17 o 432.6201 6.387533 2282.661       67.34043 2258.533       94.77246 2307.265       95.70185 430.1179 9.041876 434.7342 9.033590 -4.616333      12.78129 
1 1 1 -10 1  18 o 269.3670 4.918267 884.6726       32.28439 879.9273       56.11484 887.0204       39.47116 268.3246 8.592936 269.6803 6.006128 -1.355743      10.48390 
1 1 1 -10 1  19 o 392.0465 8.302503 1876.945       79.31999 1830.944       110.5989 1925.666       113.8213 386.6035 11.75313 396.4793 11.79369 -9.875763      16.65014 
1 1 1 -10 1  20 o 233.4219 3.824328 664.2610       21.75368 645.1243       30.33407 684.5234       31.21347 229.9687 5.412849 236.8872 5.407099 -6.918549      7.650859 
1 1 1 -10 1  21 o 155.8745 2.990420 296.1707       11.35909 294.5192       16.05446 297.8262       16.07391 155.3478 4.244843 156.2193 4.226198 -0.8714600     5.989945 
1 1 1 -10 1  22 o 171.5633 3.165500 358.8439       13.23436 349.2934       18.53353 368.7805       18.90440 169.1555 4.500098 173.8156 4.466816 -4.660126      6.340609 
1 1 1 -10 1  23 o 107.2852 2.700314 140.4041       7.054151 147.5797       10.10759 133.5902       9.849564 109.9359 3.778487 104.5832 3.871409 5.352669       5.409692 
1 1 1 -10 1  24 o 183.4791 3.313259 410.5599       14.81419 435.4233       21.58205 388.4081       20.37121 188.8665 4.689230 178.3173 4.692074 10.54924       6.633584 
1 1 1 -10 1  25 o 62.95908 2.874252 48.43662       4.398171 53.81675       6.359992 43.50557       6.088776 66.29147 3.954956 59.55388 4.222891 6.737591       5.785714 
1 1 1 -10 1  26 o 214.9870 5.105872 564.7778       26.74966 559.8879       37.65476 569.7596       38.00716 213.6239 7.243735 215.5003 7.247694 -1.876358      10.24699 
1 1 1 -10 1  27 o 154.8294 3.088392 292.4280       11.65257 276.7829       16.11705 309.5629       16.86697 150.4767 4.399941 159.1505 4.353125 -8.673752      6.189441 
1 1 1 -10 1  28 o 190.6799 3.443547 443.7313       16.00100 454.3304       22.88787 433.5987       22.37839 192.7257 4.877289 188.2737 4.881681 4.452026       6.900635 
1 1 1 -10 1  29 o 64.85754 3.003759 51.43492       4.734571 51.14772       6.751371 51.71284       6.641373 64.55458 4.316499 64.92206 4.220755 -0.3674774     6.037129 
1 1 1 -10 1  30 f 96.63131 2.891780 114.0399       6.801900 105.3193       9.330798 123.9292       9.936419 92.74287 4.139022 100.6272 4.060421 -7.884354      5.798149 
1 1 1 -10 1  31 o 80.54411 3.527141 79.38492       6.906187 80.54518       12.67698 78.89523       8.235593 80.72250 6.499335 80.21970 4.227793 0.5028000      7.753425 
1 1 1 -10 1  32 o 149.7982 3.126015 273.9875       11.41126 260.0582       15.78493 289.2366       16.51578 145.7169 4.450473 153.6877 4.414426 -7.970810      6.268482 
1 1 1 -10 1  33 o 101.3964 2.959991 125.6385       7.306072 123.8598       10.13885 127.5597       10.53736 100.5337 4.147388 102.0124 4.248096 -1.478737      5.936931 
1 1 1 -10 1  34 o 109.9186 2.995284 147.6768       8.015680 154.6884       11.48307 141.0134       11.19421 112.3314 4.202303 107.2296 4.292607 5.101723       6.007148 
1 1 1 -10 1  35 o 87.07059 3.037336 92.74825       6.434797 84.43383       8.777257 102.4097       9.461581 82.88917 4.360691 91.32516 4.263216 -8.435989      6.098413 
1 1 1 -10 1  36 o 110.0159 3.065390 148.0752       8.210203 147.2773       11.55865 148.8877       11.66403 109.4961 4.340438 110.0908 4.356319 -0.5946655     6.149546 
1 1 1 -10 1  37 o 91.84000 4.003279 103.6599       8.937981 112.7678       12.53865 94.25068       12.74429 95.46579 5.411894 87.08068 6.043106 8.385109       8.112197 
1 1 1 -10 1  38 o 103.9562 3.067413 132.4258       7.762177 121.9021       10.72889 143.9842       11.24396 99.42554 4.439330 108.1175 4.276069 -8.691948      6.163799 
1 1 1 -10 1  39 o 44.67156 4.038945 24.76476       4.349331 24.54315       6.074888 24.99780       6.229804 44.05111 5.799838 44.43638 5.898622 -0.3852730     8.272356 
1 1 1 -10 1  40 o 69.80903 3.261955 60.03516       5.533795 60.10927       7.849207 59.96193       7.802934 69.45862 4.664322 69.38039 4.641847 0.7822418E-01  6.580474 
1 1 1 -10 1  41 o 96.79389 7.118358 120.8805       16.67307 120.8805       16.67307 0.000000       0.000000 96.79389 7.118358 ?        ?        0.000000       7.118358 
1 1 1 -10 1  42 o 22.62306 6.520788 6.781649       3.791250 4.536005       5.293999 9.145839       5.431936 20.59011 7.753865 26.03358 7.884983 -5.443476      11.05872 
1 1 1 -10 1  43 o 13.81006 5.968767 -0.1003463E-02 3.678103 -2.908079      5.554121 2.269703       4.908713 14.82030 6.794137 17.71203 7.218843 -2.891727      9.913223 
1 1 1 -10 1  44 o 17.26636 6.449145 3.353189       3.646489 1.095630       5.243247 5.467949       5.074711 16.86332 7.204641 20.86366 7.641146 -4.000338      10.50209 
1 1 1 -10 1  45 o 21.85473 6.646235 6.768836       3.853894 11.58028       5.557190 2.310782       5.349217 27.77605 7.858979 17.64459 7.394430 10.13146       10.79079 
1 1 1 -10 1  46 o 20.39508 7.446035 5.947857       4.813148 10.25287       7.268564 2.586002       6.423194 24.89569 9.140425 18.33221 7.905276 6.563486       12.08473 
1 1 1 -10 1  47 o 15.44618 6.292040 2.419134       3.726837 5.398476       5.324857 -0.4416782     5.217859 19.49544 7.660933 14.78501 6.703119 4.710423       10.17947 
1 1 1 -10 1  48 o 14.69354 6.476452 1.015565       4.517796 3.319169       8.058097 -0.4047772E-01 5.455939 18.61221 8.394423 14.94195 6.805581 3.670255       10.80659 
1 1 1 -10 1  49 o 10.57091 5.077643 -3.576117      3.805043 -5.704386      5.368347 -1.427435      5.394031 11.82403 5.762259 13.69520 6.419599 -1.871175      8.626406 
1 1 1 -10 1  50 o 15.87290 7.135689 2.795571       5.769058 6.311602       8.405770 -0.3354216     7.932173 18.38956 8.403196 15.50074 7.415161 2.888819       11.20707 
1 1 1 -10 1  51 o 13.58109 5.996724 1.681332       3.889543 3.307174       5.599754 0.1657057      5.406618 15.65474 7.034522 13.76521 6.444256 1.889526       9.540070 
1 1 1 -10 2  1  o 1037.433 14.79077 13156.60       373.9272 13155.69       528.8503 13157.50       528.7756 1035.700 20.95380 1035.772 20.94937 -0.7275391E-01 29.63001 
1 1 1 -10 2  2  o 170.7247 3.039014 355.1884       12.64344 353.0202       17.91607 357.3393       17.84520 170.1360 4.324767 171.2294 4.276682 -1.093399      6.082238 
1 1 1 -10 2  3  o 627.6154 9.038875 4805.298       138.2433 4910.601       198.4702 4706.060       192.6698 634.0630 12.84479 620.7299 12.73723 13.33307       18.08938 
1 1 1 -10 2  4  o 1305.579 26.42158 20983.01       840.6166 20584.87       1172.859 21403.57       1205.433 1286.008 37.46528 1311.129 37.76717 -25.12097      53.19780 
1 1 1 -10 2  5  o 706.3607 11.70365 6091.630       201.4577 6088.068       246.6896 6098.763       349.0616 705.7978 14.34282 705.0555 20.33746 0.7422485      24.88631 
1 1 1 -10 2  6  o 377.3277 5.611633 1735.578       51.59932 1784.335       74.40177 1690.396       71.62248 382.5005 7.982062 372.2995 7.894431 10.20102       11.22655 
1 1 1 -10 2  7  o 842.3133 12.03273 8663.148       246.9869 8700.315       350.3716 8626.437       348.2228 843.2170 17.05114 839.6360 17.01884 3.580994       24.09113 
1 1 1 -10 2  8  o 222.8031 3.617332 604.9674       19.64019 622.4174       28.30448 588.7638       27.27497 225.9714 5.140029 219.7783 5.092645 6.193161       7.235671 
1 1 1 -10 2  9  o 539.8854 9.038920 3555.803       118.9198 3459.240       142.9850 3772.468       214.1798 532.3467 11.02199 555.1675 15.84758 -22.82086      19.30363 
1 1 1 -10 2  10 o 162.0793 2.930208 320.1240       11.57343 310.3834       16.25323 330.1429       16.48382 159.5288 4.184462 164.5857 4.109886 -5.056900      5.865226 
1 1 1 -10 2  11 o 330.9871 5.001323 1335.362       40.33965 1407.385       59.04827 1272.329       55.23973 339.7269 7.132490 323.0195 7.017569 16.70740       10.00593 
1 1 1 -10 2  12 o 981.4548 16.19012 11787.09       387.2188 12021.22       480.9652 11355.77       652.8102 990.0630 19.93493 958.8828 27.96724 31.18024       34.34484 
1 1 1 -10 2  13 o 301.9617 5.344949 1111.536       39.33069 1051.817       65.81314 1144.712       49.05386 293.4520 9.214632 306.3965 6.569817 -12.94449      11.31689 
1 1 1 -10 2  14 o 392.3477 5.830592 1876.796       55.74679 1869.627       78.70081 1884.015       78.97565 391.4764 8.249688 392.9801 8.246820 -1.503662      11.66479 
1 1 1 -10 2  15 o 673.8905 9.699674 5543.540       159.2878 5840.955       233.2271 5283.526       218.0700 691.0695 13.84909 657.3084 13.61415 33.76111       19.42015 
1 1 1 -10 2  16 o 631.0488 9.108215 4860.828       140.0659 5040.017       203.3198 4698.980       193.2312 641.9799 12.99637 619.9147 12.79114 22.06519       18.23510 
1 1 1 -10 2  17 o 284.9730 4.440740 989.9677       30.83864 1002.165       44.05897 978.2523       43.17918 286.6537 6.307261 283.2152 6.256359 3.438416       8.883894 
1 1 1 -10 2  18 f 89.24659 3.015006 97.18394       6.547748 104.8072       12.23752 94.12613       7.750491 92.54712 5.450315 87.80147 3.630188 4.745651       6.548603 
1 1 1 -10 2  19 o 184.5234 3.787026 415.0642       17.02887 409.8904       20.71769 425.8394       29.89818 183.2892 4.642137 186.6981 6.581860 -3.408920      8.054211 
1 1 1 -10 2  20 f 175.6939 3.184003 376.2669       13.63221 383.4871       19.56218 369.4505       19.00748 177.2767 4.531956 174.0026 4.486371 3.274155       6.377002 
1 1 1 -10 2  21 o 192.4846 3.368924 451.6875       15.80241 471.9979       22.91901 433.2823       21.81761 196.7095 4.781173 188.4107 4.755682 8.298798       6.743599 
1 1 1 -10 2  22 f 74.15365 2.699925 67.11675       4.870737 62.44746       6.750758 72.18684       7.034527 71.45303 3.891691 76.84677 3.767899 -5.393745      5.416855 
1 1 1 -10 2  23 o 124.2235 2.789754 188.1275       8.445119 188.7593       11.96929 187.5012       11.91729 124.3347 3.955421 123.9195 3.951456 0.4151917      5.591007 
1 1 1 -10 2  24 o 112.7417 2.742062 154.9712       7.533519 159.4242       10.75386 150.6799       10.55688 114.2489 3.868147 111.0650 3.906602 3.183853       5.497645 
1 1 1 -10 2  25 o 266.6928 4.275909 868.1795       27.78919 865.9797       39.32116 870.3746       39.27858 266.1133 6.063505 266.7911 6.041548 -0.6778870     8.559579 
1 1 1 -10 2  26 o 177.2031 4.515246 383.7183       19.48206 367.6272       26.85370 401.5985       28.30732 173.1937 6.373490 181.0205 6.427240 -7.826813      9.051562 
1 1 1 -10 2  27 o 116.3046 2.808799 164.9763       7.960742 157.2893       11.10553 173.1010       11.41733 113.4338 4.023917 119.0131 3.942150 -5.579277      5.633157 
1 1 1 -10 2  28 o 213.6483 3.690678 557.2123       19.21506 545.6638       26.96632 569.1238       27.38697 211.2218 5.238982 215.7191 5.209778 -4.497345      7.388418 
1 1 1 -10 2  29 o 91.64993 2.799138 102.5658       6.244290 98.78867       8.729008 106.5243       8.936155 89.84335 3.996975 93.30705 3.938929 -3.463699      5.611682 
1 1 1 -10 2  30 o 87.08879 3.409537 92.74088       7.221938 102.2559       8.872767 74.06290       12.43141 91.39605 3.993422 77.38700 6.656606 14.00905       7.762590 
1 1 1 -10 2  31 o 130.7911 3.528983 209.0855       11.23742 216.5357       20.66558 205.9577       13.39014 132.6303 6.412946 129.7179 4.241637 2.912415       7.688781 
1 1 1 -10 2  32 o 57.29229 3.269742 40.21631       4.546097 36.24423       6.248925 44.68214       6.625931 54.19923 4.780192 60.25351 4.546153 -6.054279      6.596798 
1 1 1 -10 2  33 o 66.77450 3.186335 54.58337       5.169913 56.97581       7.257564 52.11864       7.366373 68.08485 4.397781 65.06716 4.676949 3.017685       6.419839 
1 1 1 -10 2  34 o 103.7871 2.994038 131.6742       7.564545 129.8745       10.66178 133.4985       10.73435 102.9039 4.260908 104.3369 4.230613 -1.433006      6.004450 
1 1 1 -10 2  35 o 48.07926 3.930929 28.48709       4.565461 36.15631       6.517556 21.09849       6.397201 54.03793 5.006282 40.82705 6.659253 13.21088       8.331177 
1 1 1 -10 2  36 o 25.64478 6.292685 8.444386       3.902556 3.578078       5.302649 14.19491       5.764304 20.23386 7.727535 33.19221 7.323200 -12.95835      10.64632 
1 1 1 -10 2  37 o 40.96355 5.007493 20.96103       4.894863 18.59463       6.063861 25.38685       8.292832 38.15668 6.769307 44.42922 7.951424 -6.272545      10.44264 
1 1 1 -10 2  38 o 69.91396 3.235329 60.00653       5.497171 57.23786       7.543690 63.14148       8.027164 68.02142 4.577604 71.44452 4.635624 -3.423096      6.514865 
1 1 1 -10 2  39 o 54.66635 3.576318 36.86954       4.738065 36.98141       6.753485 36.76110       6.649010 54.38984 5.156955 54.24397 5.089463 0.1458626      7.245469 
1 1 1 -10 2  40 o 87.08742 3.505216 93.51959       7.423660 102.4145       9.524497 79.75180       11.84957 90.86804 4.313567 79.41332 6.171540 11.45472       7.529592 
1 1 1 -10 2  41 o 47.04697 4.892407 27.94009       5.527240 40.58020       10.79457 23.44841       6.434789 55.22799 8.275175 42.52406 6.408478 12.70393       10.46648 
1 1 1 -10 2  42 o 59.86755 3.505888 44.57733       5.092379 41.01716       7.171855 48.19740       7.231942 56.70599 5.249573 61.69957 4.848842 -4.993584      7.146277 
1 1 1 -10 2  43 o 39.45682 4.431791 19.87192       4.187674 16.33388       5.950422 23.34378       5.894503 34.42752 7.318276 42.11041 5.906248 -7.682896      9.404304 
1 1 1 -10 2  44 o 15.81721 6.433666 1.876195       3.889650 7.583600       6.161923 -1.904442      5.015099 23.60355 8.450927 14.40686 6.547412 9.196691       10.69050 
1 1 1 -10 2  45 o 22.27938 6.677212 7.070833       3.910209 5.840725       5.629806 8.217316       5.435075 21.09590 7.984514 23.65546 7.966696 -2.559566      11.27922 
1 1 1 -10 2  46 o 12.32537 5.798553 -3.281578      4.470778 -8.310257      6.587585 1.012280       6.087278 13.17444 6.412014 16.96085 7.494941 -3.786409      9.863471 
1 1 1 -10 2  47 o 20.76851 6.700546 6.568037       3.859077 5.516279       5.472565 7.608338       5.442677 19.63847 7.751320 21.76759 7.922447 -2.129126      11.08369 
1 1 1 -10 2  48 o 16.06969 6.445907 3.196471       3.844354 3.760071       5.460579 2.642609       5.413207 17.57599 7.424339 16.68207 7.225524 0.8939247      10.35997 
1 1 1 -10 2  49 o 25.69563 7.261844 11.52242       4.747623 6.793410       5.462107 26.13467       9.601373 19.54583 7.734761 32.84049 10.56665 -13.29467      13.09506 
1 1 1 -10 2  50 o 13.83352 6.265313 0.8910086      4.544452 -4.260854      8.007372 3.338821       5.519464 14.26408 6.970107 16.10140 7.124963 -1.837317      9.967320 
1 1 1 -10 2  51 o 11.78227 5.640341 -2.382918      4.607182 -1.241744      5.651950 -4.642831      7.953683 13.27681 6.325824 13.71465 6.751097 -0.4378443     9.251668 
1 1 1 -10 3  1  o 138.1624 2.452517 232.6082       8.257302 248.3306       13.40664 222.9987       10.48126 142.6938 3.859027 135.2743 3.179525 7.419495       5.000147 
1 1 1 -10 3  2  o 674.5438 8.675846 5550.248       142.6127 5279.417       218.1021 5752.533       188.4920 657.3431 13.61544 686.4626 11.26782 -29.11951      17.67326 
1 1 1 -10 3  3  o 776.6171 11.12321 7362.328       210.5103 7541.675       303.0813 7195.162       292.6078 785.2819 15.83790 767.0621 15.65378 18.21973       22.26836 
1 1 1 -10 3  4  o 163.1117 3.366065 324.2269       13.37962 325.1656       22.96088 323.7442       16.46362 163.2188 5.781876 162.9304 4.149930 0.2884674      7.117023 
1 1 1 -10 3  5  o 865.8943 14.29257 9163.062       301.5861 9102.707       367.7585 9286.999       527.0001 862.3928 17.49933 868.7300 24.91947 -6.337219      30.45007 
1 1 1 -10 3  6  o 801.7053 11.46493 7846.471       223.9866 7931.477       319.2710 7764.083       314.3170 805.2490 16.27021 796.7216 16.18919 8.527405       22.95233 
1 1 1 -10 3  7  o 164.7469 2.955536 330.7473       11.86560 325.6439       16.79146 335.8374       16.76954 163.4056 4.220356 165.9994 4.145514 -2.593842      5.915800 
1 1 1 -10 3  8  o 364.4329 5.441127 1618.943       48.32174 1590.061       67.70729 1648.927       68.98513 361.0883 7.694597 367.7114 7.698610 -6.623047      10.88464 
1 1 1 -10 3  9  o 285.8530 4.414157 995.9075       30.74869 1052.423       45.06020 946.6567       42.06462 293.8073 6.293531 278.6556 6.194597 15.15173       8.830717 
1 1 1 -10 3  10 o 516.6144 10.62588 3257.573       133.7727 3114.117       183.6555 3419.700       195.2421 504.4623 14.95612 528.6223 15.17195 -24.16000      21.30431 
1 1 1 -10 3  11 o 861.5844 14.24223 9074.126       299.0280 9104.261       367.6188 9015.196       514.0776 862.3065 17.49444 855.6780 24.67949 6.628540       30.25116 
1 1 1 -10 3  12 o 170.0611 3.534259 352.4570       14.64669 349.5860       18.00436 358.0750       25.18544 169.3015 4.367606 171.2705 6.043830 -1.968979      7.456800 
1 1 1 -10 3  13 o 295.6143 5.252005 1065.286       37.83438 978.7051       62.32482 1115.811       47.61063 283.0686 9.046721 302.5060 6.458532 -19.43738      11.11557 
1 1 1 -10 3  14 o 206.2529 3.476329 518.4462       17.47258 492.4010       24.19719 546.8224       25.25679 200.9825 4.940496 211.7989 4.893485 -10.81644      6.953753 
1 1 1 -10 3  15 o 278.8900 4.359334 948.0645       29.62711 937.7434       41.79422 958.4899       42.00470 277.3142 6.184548 280.3663 6.148030 -3.052124      8.720488 
1 1 1 -10 3  16 o 320.9222 4.899971 1255.557       38.32034 1216.472       53.28147 1297.437       55.15327 315.8040 6.923450 326.1433 6.939476 -10.33932      9.802575 
1 1 1 -10 3  17 o 255.2972 4.074299 794.4692       25.34749 808.1937       36.35551 781.4871       35.35880 257.4386 5.795094 253.1517 5.731664 4.286942       8.150772 
1 1 1 -10 3  18 o 135.8094 3.263965 224.8015       10.80218 232.0981       19.80565 221.7119       12.88782 137.8214 5.910811 134.8066 3.927313 3.014862       7.096582 
1 1 1 -10 3  19 o 485.2170 8.224837 2875.319       97.25219 2720.334       114.6620 3272.631       183.5869 471.7014 9.975079 516.1664 14.61009 -44.46494      17.69059 
1 1 1 -10 3  20 o 334.2140 5.093291 1362.458       41.48196 1319.758       57.61191 1408.428       59.77665 328.7592 7.191149 339.6206 7.222731 -10.86142      10.19218 
1 1 1 -10 3  21 o 110.6557 2.677421 149.2486       7.219827 146.6339       10.25455 151.8188       10.16677 109.5939 3.845630 111.5225 3.746290 -1.928581      5.368758 
1 1 1 -10 3  22 o 332.0384 5.081035 1345.422       41.11275 1395.686       59.59307 1299.772       56.79242 337.9138 7.236919 326.1088 7.146472 11.80496       10.17079 
1 1 1 -10 3  23 o 188.3343 3.355822 432.5339       15.40155 436.4756       21.98606 428.7359       21.58174 189.0513 4.776167 187.3707 4.730380 1.680603       6.722221 
1 1 1 -10 3  24 o 415.8263 6.205332 2113.856       62.88008 2087.813       88.34068 2140.602       89.52283 412.5685 8.786756 417.7495 8.793905 -5.180939      12.43141 
1 1 1 -10 3  25 o 222.1107 3.750161 601.9442       20.29810 592.2730       28.55836 611.8177       28.85565 220.1621 5.322977 223.7690 5.291698 -3.606857      7.505741 
1 1 1 -10 3  26 o 234.3663 5.426095 671.4813       30.98979 677.5920       43.86559 665.3923       43.78687 234.9200 7.672746 232.7801 7.729734 2.139893       10.89127 
1 1 1 -10 3  27 o 55.81800 3.101931 38.12493       4.202727 43.76595       6.088840 32.99194       5.808195 59.71959 4.210900 51.75862 4.654586 7.960972       6.276691 
1 1 1 -10 3  28 o 157.1710 3.113379 301.3982       11.92451 293.3106       16.74491 309.7196       16.98527 154.8761 4.441308 159.1601 4.383449 -4.283951      6.240180 
1 1 1 -10 3  29 o 251.2293 4.137021 771.1089       25.32760 750.4280       35.35537 792.9105       36.30061 247.5024 5.861920 254.4132 5.855151 -6.910828      8.285222 
1 1 1 -10 3  30 o 140.9878 3.536652 242.8839       12.14135 248.4927       14.89278 231.7684       20.96559 142.5125 4.293211 137.3004 6.282780 5.212143       7.609532 
1 1 1 -10 3  31 o 29.35057 6.316473 10.97994       4.383833 11.34687       8.652732 10.85323       5.084728 30.74404 10.04205 29.12805 7.203987 1.615988       12.35881 
1 1 1 -10 3  32 o 27.53256 5.479730 9.621081       3.547227 7.437757       4.942918 11.93950       5.093544 24.54670 7.538981 30.54225 6.994460 -5.995556      10.28391 
1 1 1 -10 3  33 o 80.15986 3.019661 78.57524       5.888086 82.64932       8.442446 74.71661       8.216185 82.07481 4.235394 78.01195 4.338977 4.062859       6.063438 
1 1 1 -10 3  34 o 116.6912 3.020400 166.4380       8.581700 161.0432       12.08743 171.9211       12.18588 114.5907 4.336437 118.4213 4.229501 -3.830635      6.057504 
1 1 1 -10 3  35 o 45.75867 3.941363 25.82447       4.352183 27.18719       6.109493 24.42046       6.201369 46.70689 5.471276 44.14661 5.912951 2.560276       8.055920 
1 1 1 -10 3  36 o 170.9635 3.860325 358.0378       16.08287 355.5148       26.81738 359.4548       20.09828 169.4134 6.507902 170.9788 4.828537 -1.565384      8.103553 
1 1 1 -10 3  37 o 57.78183 3.934558 41.13960       5.507122 36.79500       6.696112 50.22087       9.681015 54.41445 5.109563 63.34636 6.357219 -8.931908      8.156094 
1 1 1 -10 3  38 o 33.92423 5.124318 14.52146       4.104320 20.48588       5.793012 8.509969       5.815825 40.18201 6.108187 26.05213 8.206019 14.12988       10.22979 
1 1 1 -10 3  39 o 25.31801 6.621784 8.330543       4.131227 6.740568       5.053943 11.53234       7.171861 23.42043 7.676187 29.77964 9.068615 -6.359209      11.88123 
1 1 1 -10 3  40 o 48.46640 4.642560 29.40519       5.416248 30.33461       6.348000 26.91778       10.38492 49.00636 5.405239 44.42682 9.850745 4.579536       11.23627 
1 1 1 -10 3  41 o 61.91919 4.232538 47.84827       6.348086 60.90878       12.55338 43.36094       7.358252 68.16222 7.691724 58.57198 5.209534 9.590240       9.289880 
1 1 1 -10 3  42 o 32.00657 5.252897 13.27460       3.955072 13.05376       5.623491 13.49076       5.563623 30.91688 7.534051 31.49022 7.379709 -0.5733452     10.54619 
1 1 1 -10 3  43 o 29.55719 5.704766 11.61210       3.960172 8.799343       5.606805 14.41229       5.594274 25.26302 8.069362 32.28348 7.284623 -7.020458      10.87108 
1 1 1 -10 3  44 o 16.39571 6.392021 2.637375       3.682612 6.292196       5.388245 -0.5662696     5.044713 21.89165 7.894567 15.32525 6.795036 6.566401       10.41617 
1 1 1 -10 3  45 o 14.74796 6.287728 0.9048535      3.978749 2.595680       6.711560 -0.1135008E-01 4.940490 19.07271 8.149980 15.32042 6.761878 3.752288       10.58986 
1 1 1 -10 3  46 o 20.60349 6.816590 6.224545       3.982007 7.325456       5.869009 5.285466       5.420510 22.00388 8.189017 19.84825 7.750096 2.155634       11.27493 
1 1 1 -10 3  47 o 14.23976 6.016040 1.425524       3.586405 0.1663119      5.279518 2.504489       4.887070 15.21050 6.833027 16.55891 7.010556 -1.348409      9.789696 
1 1 1 -10 3  48 o 16.55558 6.467129 3.686274       3.775699 6.064473       5.633101 1.746271       5.087739 19.57061 7.818799 15.73629 6.906615 3.834329       10.43240 
1 1 1 -10 3  49 o 11.19933 5.390368 -3.889024      4.338449 -8.859438      5.124861 8.681920       8.150228 10.46297 5.198235 20.59776 8.893661 -10.13478      10.30140 
1 1 1 -10 3  50 o 15.08160 6.477981 2.806144       4.280813 1.207055       7.634778 3.539392       5.169940 15.89852 7.509455 16.07994 7.011921 -0.1814251     10.27419 
1 1 1 -10 3  51 o 22.16679 6.964741 9.354786       4.191973 4.879007       6.095854 13.37031       5.773928 16.72484 7.439456 24.48120 8.211025 -7.756367      11.08000 
1 1 1 -10 4  1  o 615.5793 10.26432 4624.438       153.9750 0.000000       0.000000 4624.438       153.9750 ?        ?        615.5793 10.26432 0.000000       10.26432 
1 1 1 -10 4  2  o 268.6361 3.775362 879.4824       24.71492 846.3444       38.26572 903.2000       32.37300 263.4848 5.959614 272.2149 4.880171 -8.730072      7.702796 
1 1 1 -10 4  3  o 353.2237 5.302507 1520.852       45.64227 1517.929       64.58698 1523.768       64.50893 352.8100 7.512214 353.4889 7.488728 -0.6788330     10.60728 
1 1 1 -10 4  4  f 463.2284 6.782662 2616.325       76.56521 2591.907       107.8292 2641.156       108.7356 460.9044 9.600401 465.2634 9.590403 -4.358948      13.56995 
1 1 1 -10 4  5  f 874.4966 14.43463 9346.636       307.6096 9402.793       378.3413 9237.114       528.3602 876.4405 17.71435 866.3392 25.05316 10.10132       30.68320 
1 1 1 -10 4  6  o 173.6358 3.068183 367.4048       12.98245 380.7585       18.87350 355.4117       17.88617 176.7504 4.381836 170.7127 4.302904 6.037689       6.141292 
1 1 1 -10 4  7  o 345.4368 5.193972 1454.510       43.72243 1484.532       62.81960 1426.304       60.89119 348.9121 7.388273 342.0040 7.306125 6.908112       10.39067 
1 1 1 -10 4  8  o 305.0463 4.664913 1134.173       34.67731 1136.579       49.27666 1131.813       48.80893 305.3190 6.622949 304.6797 6.573848 0.6392822      9.331610 
1 1 1 -10 4  9  o 111.1667 2.489644 150.5903       6.744477 162.6928       10.07396 140.7591       9.079612 115.4861 3.583939 107.4159 3.473234 8.070221       4.990788 
1 1 1 -10 4  10 o 305.0285 5.401849 1134.190       40.15309 1130.126       49.23558 1142.260       69.38317 304.4460 6.636402 305.8320 9.320566 -1.385986      11.44180 
1 1 1 -10 4  11 o 411.4762 8.624317 2065.480       86.47799 2065.480       86.47799 0.000000       0.000000 411.4762 8.624317 ?        ?        0.000000       8.624317 
1 1 1 -10 4  12 o 286.7681 4.442603 1002.337       31.04591 1021.243       44.62732 984.6060       43.21770 289.4101 6.327775 284.1741 6.240812 5.236053       8.887546 
1 1 1 -10 4  13 o 413.7498 7.056052 2087.698       71.14356 2224.543       128.7055 2027.488       85.37170 426.5213 12.39599 407.6523 8.593854 18.86902       15.08360 
1 1 1 -10 4  14 o 190.7530 3.306274 443.4447       15.36903 445.5590       21.97393 441.4199       21.50386 191.1866 4.716439 190.2978 4.637101 0.8887634      6.614190 
1 1 1 -10 4  15 o 289.9073 4.502806 1024.488       31.81108 992.3250       44.28845 1058.766       45.72108 285.2602 6.371082 294.6554 6.367456 -9.395233      9.007506 
1 1 1 -10 4  16 o 577.9614 8.383871 4076.652       118.0809 4358.701       175.1587 3841.692       159.8698 597.1107 12.03762 560.6310 11.70181 36.47961       16.78800 
1 1 1 -10 4  17 o 334.7727 5.889558 1366.772       48.04728 1516.823       89.71189 1306.421       56.89510 352.1759 10.46493 327.2295 7.134876 24.94641       12.66575 
1 1 1 -10 4  18 o 408.2383 7.017489 2033.655       69.81223 1912.972       116.9385 2100.488       87.02148 395.1701 12.15777 414.7367 8.610292 -19.56662      14.89794 
1 1 1 -10 4  19 o 368.0916 6.396992 1653.324       57.38097 1643.735       70.13419 1672.738       99.79456 366.8866 7.844437 369.5365 11.09444 -2.649902      13.58756 
1 1 1 -10 4  20 o 201.7357 3.471663 496.1353       17.06697 494.7415       24.23513 497.5065       24.03874 201.3980 4.938035 201.9623 4.884334 -0.5643158     6.945567 
1 1 1 -10 4  21 o 242.3392 3.947523 716.1563       23.31226 714.3553       33.04766 717.9401       32.88993 241.9340 5.605415 242.5432 5.564650 -0.6091614     7.898481 
1 1 1 -10 4  22 o 428.0435 6.356857 2238.112       66.30808 2225.026       93.57751 2251.309       93.97131 426.2469 9.008949 428.7606 8.993823 -2.513702      12.72989 
1 1 1 -10 4  23 o 232.7619 3.860252 660.8743       21.89594 660.2576       31.09646 661.4808       30.83626 232.5198 5.488010 232.7400 5.436941 -0.2201843     7.725192 
1 1 1 -10 4  24 o 242.8076 3.983197 719.3575       23.56840 709.5749       33.22570 729.2648       33.43681 240.9777 5.657978 244.3033 5.616416 -3.325653      7.972255 
1 1 1 -10 4  25 o 115.4529 3.229764 162.7118       9.077887 166.6104       11.36081 155.8263       15.09807 116.7721 3.998300 112.7794 5.510261 3.992706       6.808038 
1 1 1 -10 4  26 o 92.02307 3.212002 103.4281       7.191875 105.3789       9.006963 99.99648       11.94620 92.82816 3.990968 90.27525 5.455781 2.552917       6.759687 
1 1 1 -10 4  27 o 145.8120 3.007826 259.3526       10.68765 253.0415       15.06205 265.7526       15.16773 143.8771 4.300750 147.4578 4.225371 -3.580688      6.029114 
1 1 1 -10 4  28 o 113.7994 2.855013 158.0753       7.911174 150.8699       11.07610 165.5797       11.30354 111.0666 4.099331 116.3731 3.991805 -5.306458      5.721802 
1 1 1 -10 4  29 o 153.5377 3.112601 287.6794       11.64594 285.3227       16.52683 290.0038       16.41345 152.7207 4.445475 153.9785 4.378696 -1.257874      6.239810 
1 1 1 -10 4  30 o 54.65315 5.290111 36.91317       6.957582 30.94092       10.19412 42.12113       9.519502 49.33917 8.801429 58.16182 6.847518 -8.822655      11.15140 
1 1 1 -10 4  31 o 218.2302 4.416702 582.5272       23.48816 576.6348       41.64201 585.2766       28.44496 216.0611 7.922366 218.5496 5.340958 -2.488480      9.554565 
1 1 1 -10 4  32 o 47.51320 3.649951 27.74866       4.193715 23.25785       5.612422 33.42584       6.310359 43.21344 5.450623 51.99071 5.044026 -8.777271      7.426405 
1 1 1 -10 4  33 o 119.4880 2.986555 174.3425       8.696225 165.0701       12.05892 184.3896       12.55257 116.0574 4.271113 122.6802 4.204984 -6.622871      5.993688 
1 1 1 -10 4  34 o 136.0160 3.115314 226.0251       10.32590 225.1875       14.58391 226.8672       14.62222 135.5078 4.422375 136.0138 4.417441 -0.5059662     6.250695 
1 1 1 -10 4  35 o 206.9304 3.719287 524.0632       18.75513 516.7930       26.33146 531.5497       26.72034 204.9648 5.276194 207.8713 5.279136 -2.906494      7.463746 
1 1 1 -10 4  36 o 58.73263 3.868586 42.44032       5.506084 34.51293       8.202287 48.94278       7.428627 52.42211 6.564238 62.92060 4.883037 -10.49849      8.181275 
1 1 1 -10 4  37 f 116.5239 3.470779 166.4669       9.844502 168.0785       12.16968 163.4155       16.74533 116.9000 4.279194 114.7445 6.009552 2.155449       7.377413 
1 1 1 -10 4  38 o 56.96125 3.995444 40.06587       5.510837 42.76960       6.771602 34.76337       9.483082 58.69844 4.775220 52.07850 7.704489 6.619938       9.064319 
1 1 1 -10 4  39 o 38.24340 4.495847 18.30440       4.109965 15.31106       5.585611 21.83848       6.069192 34.32224 6.917428 41.37152 6.211617 -7.049278      9.297042 
1 1 1 -10 4  40 f 74.73738 3.730970 69.06523       6.773612 64.15104       7.887930 82.86602       13.21871 71.77231 4.533090 80.57987 6.794984 -8.807564      8.168275 
1 1 1 -10 4  41 o 42.73311 4.988673 23.16113       5.097386 19.39211       9.897701 24.52165       5.946651 37.00539 10.49442 43.72678 5.717528 -6.721386      11.95086 
1 1 1 -10 4  42 o 57.39296 3.525645 41.01959       4.907184 38.23148       6.773673 44.09904       7.118795 54.74197 5.137758 58.88614 5.008340 -4.144176      7.174958 
1 1 1 -10 4  43 o 27.73333 5.829489 10.30135       3.814451 10.71289       5.381891 9.885945       5.407093 27.63382 7.704130 26.57227 7.824416 1.061552       10.98067 
1 1 1 -10 4  44 o 19.57247 6.546744 5.069261       3.670802 10.59448       5.294804 -0.4408504E-01 5.093633 27.06839 7.675434 15.74205 6.909834 11.32634       10.32754 
1 1 1 -10 4  45 o 16.81501 6.662618 2.894109       4.057623 -5.964207      6.131485 9.796165       5.412269 13.68754 6.540050 25.47129 7.900326 -11.78375      10.25609 
1 1 1 -10 4  46 o 18.75795 6.684309 4.910277       3.850361 5.175133       5.421252 4.640684       5.469533 19.68966 7.732160 19.20971 7.694355 0.4799423      10.90823 
1 1 1 -10 4  47 o 13.40953 5.881413 0.4071472      3.683767 1.342452       5.201193 -0.5342526     5.218113 15.90848 6.982665 14.67405 6.672668 1.234430       9.658266 
1 1 1 -10 4  48 o 15.39646 6.329791 2.645478       3.815254 6.266403       5.407900 -0.9426486     5.383351 19.66894 7.723051 14.26735 6.594061 5.401584       10.15515 
1 1 1 -10 4  49 o 18.16077 7.126940 5.441525       4.603119 4.184915       5.612571 8.023498       8.045208 17.25770 7.415161 20.11639 8.759951 -2.858688      11.47699 
1 1 1 -10 4  50 o 10.54761 5.126945 -4.324420      4.175053 -8.070218      7.448533 -2.608414      5.041478 12.77923 6.334797 12.36104 5.912766 0.4181910      8.665475 
1 1 1 -10 4  51 o 18.02684 6.710633 6.055590       3.941683 0.3506363      5.607149 11.62911       5.542182 13.95671 6.543144 22.85253 8.031021 -8.895815      10.35906 
1 1 1 -10 5  1  o 673.2143 8.664190 5528.454       142.1404 5386.479       220.7236 5629.048       185.7930 663.9593 13.64178 679.0510 11.22770 -15.09167      17.66804 
1 1 1 -10 5  2  o 415.8840 6.165809 2108.614       62.48825 2052.066       123.5635 2128.046       72.43344 409.7307 12.38953 417.7566 7.115079 -8.025909      14.28722 
1 1 1 -10 5  3  o 140.0162 2.474990 238.8922       8.444766 243.6881       13.57355 235.8635       10.78653 141.3497 3.944456 139.1216 3.181641 2.228104       5.067698 
1 1 1 -10 5  4  o 148.5753 2.827868 268.9990       10.23863 276.9553       14.91321 261.9051       14.08175 150.6922 4.064818 146.5418 3.946886 4.150406       5.665744 
1 1 1 -10 5  5  o 536.4202 9.002094 3510.258       117.6752 3485.769       143.5544 3560.419       205.4540 534.3853 11.02366 539.3596 15.64802 -4.974365      19.14110 
1 1 1 -10 5  6  o 417.8820 7.135740 2129.332       72.66558 2194.809       90.79888 2012.692       121.1879 424.1753 8.784135 405.7901 12.26933 18.38519       15.08964 
1 1 1 -10 5  7  o 431.1778 6.347945 2266.641       66.69997 2373.257       97.44904 2172.668       91.48884 441.0627 9.066531 422.0215 8.896054 19.04117       12.70204 
1 1 1 -10 5  8  o 47.15092 2.626890 27.17550       3.006408 20.28225       4.548133 32.52491       4.006578 40.52230 4.692400 51.56254 3.204461 -11.04024      5.682181 
1 1 1 -10 5  9  o 649.3096 9.361961 5144.040       148.1340 4781.009       199.1057 5594.125       221.6967 625.5737 13.06078 676.6284 13.44537 -51.05469      18.74465 
1 1 1 -10 5  10 o 971.5070 16.02438 11547.59       379.3702 11490.70       463.2274 11663.49       661.1152 968.1108 19.63510 971.9060 27.94267 -3.795227      34.15157 
1 1 1 -10 5  11 o 600.9018 8.679197 4405.142       127.0923 4456.441       181.2869 4355.562       178.2235 604.0054 12.31656 597.1384 12.24768 6.867004       17.36961 
1 1 1 -10 5  12 o 382.0566 6.589910 1779.882       61.35406 1731.540       74.01236 1886.083       109.6994 376.7615 8.061236 392.8207 11.47201 -16.05923      14.02107 
1 1 1 -10 5  13 f 491.6078 8.292381 2948.447       99.34228 2867.314       168.6594 2991.549       122.9294 483.9818 14.31604 495.0283 10.19036 -11.04654      17.57249 
1 1 1 -10 5  14 o 298.1123 4.608689 1083.300       33.48061 1078.029       47.49393 1088.506       47.20486 297.3223 6.555028 298.7663 6.483641 -1.444000      9.219870 
1 1 1 -10 5  15 f 399.4160 5.939991 1945.309       57.81592 1967.700       82.62636 1923.829       80.92820 401.5518 8.443858 397.0559 8.363964 4.495941       11.88506 
1 1 1 -10 5  16 o 98.84022 2.605906 119.1368       6.271183 123.3004       9.204757 115.5301       8.567119 100.5081 3.764813 97.29176 3.619766 3.216339       5.222693 
1 1 1 -10 5  17 o 173.1618 3.651863 365.4846       15.41000 421.9508       29.73711 344.7542       18.01803 185.8661 6.575778 168.1078 4.402071 17.75830       7.913222 
1 1 1 -10 5  18 o 491.0336 8.312509 2944.356       99.46709 2928.449       121.5907 2976.534       172.9413 489.4327 10.19463 492.4079 14.42800 -2.975189      17.66629 
1 1 1 -10 5  19 o 116.6820 2.743193 165.9355       7.800032 159.0634       10.99245 172.9047       11.06978 114.1540 3.957531 119.0297 3.821296 -4.875664      5.501305 
1 1 1 -10 5  20 o 293.0885 4.572490 1047.668       32.65784 1021.158       45.67424 1075.398       46.71363 289.2156 6.480574 296.7992 6.458695 -7.583557      9.149458 
1 1 1 -10 5  21 f 97.36517 2.673462 115.6410       6.337274 121.1061       9.242290 110.7914       8.706230 99.58356 3.815576 95.24530 3.758408 4.338257       5.355768 
1 1 1 -10 5  22 o 191.7306 3.395023 448.2495       15.86245 450.3105       22.67289 446.2734       22.20034 192.0339 4.848868 191.2370 4.763781 0.7969666      6.797436 
1 1 1 -10 5  23 o 37.48611 3.787237 17.31538       3.412228 14.46346       4.647412 20.65091       5.026037 33.93226 5.830385 40.80181 5.170823 -6.869553      7.792997 
1 1 1 -10 5  24 o 61.27523 2.901515 45.88651       4.320266 47.89902       6.193299 43.97900       6.029549 62.51768 4.087629 59.88718 4.157377 2.630505       5.830308 
1 1 1 -10 5  25 o 155.3149 4.220737 294.6907       15.96007 272.7283       21.50153 321.6396       23.81765 149.2181 5.924829 162.0501 6.041915 -12.83197      8.462171 
1 1 1 -10 5  26 o 14.93324 5.723828 1.823647       2.916230 4.981803       4.089930 -1.442534      4.159290 20.75155 6.909732 13.94270 6.176625 6.808846       9.267961 
1 1 1 -10 5  27 o 228.8371 3.856835 639.2852       21.50768 644.9463       30.69316 633.8238       30.14708 229.6224 5.485187 227.6419 5.434468 1.980469       7.721445 
1 1 1 -10 5  28 o 198.2882 3.528527 479.9467       17.05008 467.4786       23.93717 492.7868       24.29165 195.4479 5.029987 200.7437 4.965683 -5.295822      7.068153 
1 1 1 -10 5  29 o 80.66978 2.836609 79.49343       5.567626 79.03282       7.926081 79.94209       7.822566 80.32821 4.062248 80.79798 3.985242 -0.4697723     5.690695 
1 1 1 -10 5  30 o 148.1721 4.578468 268.7845       16.51206 274.5694       24.47100 263.9490       22.37295 149.3492 6.741148 146.5254 6.280335 2.823730       9.213343 
1 1 1 -10 5  31 o 153.1740 3.141489 286.4456       11.72618 290.7198       16.81103 282.3954       16.36463 154.0895 4.481743 151.8747 4.426376 2.214828       6.299113 
1 1 1 -10 5  32 o 135.5850 3.037536 224.4560       10.03620 216.3276       14.06490 232.8883       14.32534 132.8925 4.348958 137.9039 4.267911 -5.011353      6.093316 
1 1 1 -10 5  33 o 89.28245 2.977296 97.45020       6.468688 89.91965       8.871538 105.9989       9.452267 85.60601 4.266081 92.97445 4.182632 -7.368439      5.974434 
1 1 1 -10 5  34 o 92.05817 3.013645 103.6363       6.751572 98.67358       9.267661 109.2489       9.855783 89.66100 4.253738 94.34651 4.298049 -4.685516      6.047108 
1 1 1 -10 5  35 f 63.25833 3.335922 49.06930       5.124268 48.06571       7.124352 50.14498       7.375805 62.40682 4.719635 63.73888 4.783534 -1.332062      6.719908 
1 1 1 -10 5  36 o 82.43878 3.428975 83.31425       6.873577 76.02972       10.55301 88.68176       9.058632 78.34929 5.563389 84.89488 4.393647 -6.545593      7.089106 
1 1 1 -10 5  37 o 61.11501 3.825104 45.98811       5.668184 41.88696       6.910695 54.41858       9.908198 58.11044 4.926516 65.96969 6.237377 -7.859245      7.948298 
1 1 1 -10 5  38 o 40.41632 4.367955 20.34205       4.233739 25.49201       5.651567 13.75580       6.391255 45.10577 5.238983 32.38927 8.115054 12.71650       9.659246 
1 1 1 -10 5  39 o 39.20805 4.376255 19.21034       4.110114 18.01500       5.510837 20.70874       6.170015 37.47248 6.255240 40.15478 6.529525 -2.682293      9.042274 
1 1 1 -10 5  40 o 41.12075 4.967064 21.35255       4.876606 21.11575       5.761573 21.95073       9.157177 40.56804 6.009507 40.08183 9.517770 0.4862099      11.25620 
1 1 1 -10 5  41 o 46.47296 4.809865 27.29679       5.368505 21.85780       10.22427 29.36715       6.308050 39.15634 10.50019 47.96595 5.495799 -8.809612      11.85149 
1 1 1 -10 5  42 o 32.96144 5.024243 14.02182       3.908227 14.24466       5.327319 13.76211       5.751116 32.48498 6.940366 31.67912 7.556063 0.8058624      10.25976 
1 1 1 -10 5  43 o 42.47950 4.256072 22.97883       4.346519 25.84259       6.123612 20.07107       6.170470 44.28990 5.813961 38.40726 6.843760 5.882641       8.979933 
1 1 1 -10 5  44 o 60.72393 4.295805 47.27433       6.315795 40.15115       11.70896 50.19725       7.500492 51.08116 9.762129 62.04264 5.003334 -10.96148      10.96962 
1 1 1 -10 5  45 o 31.60057 6.152113 14.01822       4.567091 8.829335       7.034600 17.79893       6.004668 24.17919 8.971698 34.81350 7.310980 -10.63431      11.57332 
1 1 1 -10 5  46 o 28.82337 5.933903 11.91788       4.028983 5.676115       5.428658 19.57187       6.011501 20.11543 7.783377 36.07282 7.091507 -15.95739      10.52950 
1 1 1 -10 5  47 o 14.01018 6.027455 1.063136       3.717378 0.8808373      5.285766 1.241541       5.229027 15.62304 6.939707 15.81863 6.970175 -0.1955872     9.835796 
1 1 1 -10 5  48 o 12.15251 5.554545 -0.8461363     3.675722 -2.373704      5.304436 0.5649620      5.098208 13.38144 6.301797 14.82863 6.683478 -1.447190      9.185941 
1 1 1 -10 5  49 o 10.93211 5.184128 -2.494033      3.707470 3.150458       5.047636 -9.106449      5.463308 16.15448 6.987154 10.77519 5.355668 5.379286       8.803607 
1 1 1 -10 5  50 o 12.51773 5.843717 -0.8795860     4.394427 0.2790431      8.502538 -1.301884      5.133174 15.83782 7.603047 13.04352 6.159893 2.794294       9.785223 
1 1 1 -10 5  51 o 9.958538 4.842757 -3.875357      3.736213 -3.335755      5.234843 -4.435630      5.334165 11.99414 5.809103 11.68060 5.703631 0.3135338      8.141074 
1 1 1 -10 6  1  o 598.3991 7.742534 4367.052       112.9042 4375.260       178.5506 4361.583       145.7406 598.5480 12.24126 597.8400 10.00367 0.7079468      15.80892 
1 1 1 -10 6  2  o 129.0587 2.427458 202.9643       7.634402 212.0433       12.45484 197.5000       9.662470 131.8474 3.880641 127.3059 3.114610 4.541512       4.975959 
1 1 1 -10 6  3  o 402.7021 5.972166 1977.009       58.60732 1916.556       81.42133 2042.008       84.42688 396.3911 8.429041 409.1568 8.467494 -12.76566      11.94769 
1 1 1 -10 6  4  o 569.2241 8.255569 3952.033       114.5160 3661.563       218.1102 4062.578       134.5540 546.8359 16.38600 577.0281 9.568931 -30.19214      18.97539 
1 1 1 -10 6  5  o 343.2243 5.179500 1435.949       43.32135 1436.034       61.51014 1435.866       61.02404 343.1635 7.355454 343.1456 7.297707 0.1788330E-01  10.36143 
1 1 1 -10 6  6  o 385.7644 6.649651 1814.443       62.51109 1820.888       76.81194 1801.803       107.5706 386.3831 8.157826 383.9887 11.50878 2.394440       14.10682 
1 1 1 -10 6  7  o 384.9306 5.733168 1806.307       53.77906 1838.257       77.14045 1776.093       75.01427 388.2194 8.153966 381.6029 8.066704 6.616486       11.46991 
1 1 1 -10 6  8  o 682.0947 11.32746 5680.299       188.2839 5622.125       229.1808 5801.093       330.2451 678.2523 13.86599 687.6245 19.72869 -9.372131      24.11403 
1 1 1 -10 6  9  o 591.2725 9.882755 4266.439       142.3973 4082.113       169.3125 4711.936       263.2191 578.1412 12.01763 620.1049 17.43602 -41.96368      21.17636 
1 1 1 -10 6  10 o 328.7373 4.996423 1317.299       40.02620 1344.153       57.57434 1292.180       55.68414 332.0002 7.116305 325.5220 7.019644 6.478180       9.995859 
1 1 1 -10 6  11 o 530.3375 7.713703 3430.506       99.68993 3615.275       146.2292 3270.064       136.2635 544.1399 11.02776 517.5309 10.80456 26.60895       15.43859 
1 1 1 -10 6  12 o 123.9367 2.680625 187.1812       8.096027 188.8110       11.82073 185.7412       11.11121 124.4048 3.903991 123.3964 3.699248 1.008415       5.378251 
1 1 1 -10 6  13 o 393.0202 6.746263 1883.722       64.61215 1968.950       115.4923 1844.894       77.95264 401.2759 11.82355 388.8656 8.226123 12.41034       14.40366 
1 1 1 -10 6  14 o 481.7445 8.151615 2831.656       95.69661 2817.069       117.0249 2861.101       166.2612 480.3346 9.997663 483.3695 14.12999 -3.034912      17.30924 
1 1 1 -10 6  15 o 254.0115 4.069246 786.4609       25.18856 789.2313       35.96848 783.7948       35.28536 254.4088 5.801681 253.5341 5.711130 0.8747253      8.141038 
1 1 1 -10 6  16 o 437.6563 7.468030 2337.175       79.64809 2430.426       142.4569 2294.769       96.06595 445.4472 13.13790 433.5188 9.093382 11.92841       15.97792 
1 1 1 -10 6  17 o 224.2270 4.318213 612.9420       23.59544 602.3255       41.46437 618.0262       28.69442 222.0137 7.675610 225.1263 5.230402 -3.112564      9.288278 
1 1 1 -10 6  18 o 134.9376 3.267037 221.9384       10.74294 223.8922       13.49953 218.5642       17.74055 135.4542 4.094388 133.7529 5.454309 1.701279       6.820080 
1 1 1 -10 6  19 o 115.0542 2.727500 161.3410       7.647213 153.8026       10.87289 168.7204       10.75762 112.2441 3.981379 117.5796 3.759295 -5.335487      5.475736 
1 1 1 -10 6  20 o 126.0785 2.791114 193.7562       8.575403 187.1858       12.24027 200.0898       12.01769 123.8292 4.061814 128.0422 3.855910 -4.213013      5.600569 
1 1 1 -10 6  21 o 125.2195 2.800807 191.1398       8.546561 194.8625       12.42552 187.7972       11.77410 126.3370 4.041166 124.0317 3.900309 2.305290       5.616354 
1 1 1 -10 6  22 o 193.7140 3.420355 457.5998       16.14612 487.8347       23.84095 431.9829       21.94484 199.9251 4.893506 188.0785 4.791936 11.84662       6.849019 
1 1 1 -10 6  23 o 92.47381 2.701364 104.3465       6.080961 92.97891       8.509367 116.2104       8.693131 87.20456 4.015031 97.53737 3.663885 -10.33281      5.435488 
1 1 1 -10 6  24 o 78.17836 2.760692 74.61725       5.251197 74.59339       7.520263 74.63995       7.335802 78.08376 3.965156 78.11607 3.865648 -0.3231049E-01 5.537662 
1 1 1 -10 6  25 o 193.9973 4.797828 459.7115       22.68174 471.8366       32.17274 447.7299       31.98177 196.1865 6.739509 191.0785 6.879611 5.107971       9.630681 
1 1 1 -10 6  26 o 26.63648 5.236345 8.973883       3.277699 5.273691       4.547363 12.97504       4.728685 21.53043 7.287066 32.00862 6.286717 -10.47819      9.624144 
1 1 1 -10 6  27 o 80.53045 2.848354 79.20236       5.580918 80.23135       7.986724 78.22048       7.801747 80.95599 4.061373 79.93650 4.017958 1.019493       5.713032 
1 1 1 -10 6  28 o 112.3197 2.830274 153.9986       7.740598 160.8035       11.26706 147.9158       10.65249 114.6687 4.038387 109.9776 3.981331 4.691124       5.670941 
1 1 1 -10 6  29 o 53.57037 3.196263 35.15050       4.153595 37.35168       5.945581 33.05212       5.805079 55.09632 4.466555 51.78348 4.649693 3.312840       6.447462 
1 1 1 -10 6  30 o 110.2978 4.336474 148.9785       11.63302 140.4300       17.18300 156.2120       15.80623 106.7167 6.640303 112.7331 5.772838 -6.016426      8.798822 
1 1 1 -10 6  31 o 43.44466 3.848294 23.24707       4.032088 17.91987       5.446258 29.70844       5.998065 37.73042 6.133881 48.98626 5.099138 -11.25584      7.976572 
1 1 1 -10 6  32 o 52.82923 3.448507 34.24262       4.415308 30.76074       6.069238 38.15705       6.435197 49.84658 5.066801 55.61132 4.795362 -5.764732      6.976243 
1 1 1 -10 6  33 o 174.2189 3.383408 370.9157       14.36434 366.3638       20.31071 375.4708       20.31778 172.8176 4.827549 174.9680 4.769655 -2.150360      6.786371 
1 1 1 -10 6  34 o 127.6657 3.072250 199.1359       9.557997 189.7778       13.24408 209.3074       13.80763 124.3785 4.376406 130.6355 4.343362 -6.256996      6.165852 
1 1 1 -10 6  35 o 42.68417 4.218403 22.54477       4.330532 20.30482       5.833472 25.29464       6.463461 40.12268 6.163027 44.89800 6.062230 -4.775318      8.644856 
1 1 1 -10 6  36 o 23.63561 6.989600 7.046723       4.307182 5.923362       6.231352 8.074461       5.960238 23.56133 8.490668 25.72486 8.329556 -2.163530      11.89424 
1 1 1 -10 6  37 o 134.2049 3.614652 220.9638       11.81069 218.0037       14.43912 226.9483       20.53075 133.0652 4.459170 135.0997 6.253078 -2.034454      7.680181 
1 1 1 -10 6  38 o 110.1052 3.050264 148.6294       8.176414 149.5132       11.50025 147.7260       11.62718 110.1007 4.294522 109.4164 4.369483 0.6842880      6.126606 
1 1 1 -10 6  39 o 101.4465 3.031951 126.3635       7.486995 129.3457       10.63706 123.4354       10.54002 102.2518 4.278339 99.86185 4.341551 2.389961       6.095346 
1 1 1 -10 6  40 o 77.44370 3.653087 74.17076       6.874741 79.11386       8.326917 63.58794       12.18388 79.76441 4.299790 70.18842 7.226498 9.575996       8.408952 
1 1 1 -10 6  41 f 29.48949 6.731967 11.59036       4.730961 12.80782       9.489397 11.18766       5.457586 30.76791 10.52482 28.75959 7.653304 2.008318       13.01326 
1 1 1 -10 6  42 o 51.40282 3.663379 33.04177       4.558785 38.29152       6.344184 27.43702       6.555183 54.87246 4.792489 45.82193 6.015652 9.050529       7.691295 
1 1 1 -10 6  43 o 13.29815 6.034151 -1.816486      4.239307 -13.20381      8.557012 1.887536       4.880318 14.75927 7.210631 17.21642 7.126443 -2.457146      10.13802 
1 1 1 -10 6  44 o 19.34705 6.430140 4.997511       3.542240 2.033989       4.820239 8.476864       5.222925 17.00442 7.064415 24.25777 7.792305 -7.253355      10.51789 
1 1 1 -10 6  45 o 16.01750 6.520147 2.286287       3.998569 -8.550376      5.836219 11.87316       5.489367 12.23792 5.973648 27.86151 7.785482 -15.62359      9.813165 
1 1 1 -10 6  46 o 15.23790 6.171948 2.266535       3.562137 -0.6326796     4.662145 6.332917       5.521405 14.11465 6.373754 20.73298 7.893242 -6.618330      10.14534 
1 1 1 -10 6  47 o 17.91562 6.613049 4.587724       3.813157 4.316297       5.310378 4.876641       5.478803 18.26717 7.484203 18.84171 7.646065 -0.5745316     10.69933 
1 1 1 -10 6  48 o 14.14960 6.316507 0.6275868      4.435300 -5.347018      5.278626 14.97473       8.179917 12.00627 5.819334 26.07125 9.674375 -14.06498      11.28974 
1 1 1 -10 6  49 o 15.04425 6.253335 2.807342       3.779742 -1.501513      5.497582 6.669949       5.205123 13.58286 6.402451 19.16507 7.561073 -5.582209      9.907634 
1 1 1 -10 6  50 o 21.33039 7.373494 8.890050       4.661315 5.164166       8.394095 10.55125       5.604939 17.60308 8.169899 22.18496 8.044712 -4.581879      11.46580 
1 1 1 -10 7  1  f 385.8951 5.758615 1815.402       54.15311 1830.353       77.16126 1800.891       76.01962 387.3778 8.173884 384.2502 8.118495 3.127594       11.52052 
1 1 1 -10 7  2  o 186.8877 3.252259 425.6373       14.81160 461.3489       30.33775 414.4610       16.97179 194.4179 6.412178 184.4124 3.776603 10.00545       7.441690 
1 1 1 -10 7  3  o 486.8175 6.370790 2889.437       75.57804 2860.808       118.8282 2908.885       97.94140 484.1705 10.07129 488.3499 8.229986 -4.179443      13.00629 
1 1 1 -10 7  4  o 997.0714 12.71794 12143.71       309.0146 12185.79       489.9450 12115.91       398.2064 996.9018 20.16782 995.0956 16.42129 1.806152       26.00768 
1 1 1 -10 7  5  o 434.2861 6.415680 2299.520       67.89764 2140.186       130.2201 2359.011       79.56990 418.3767 12.78747 439.8200 7.423997 -21.44324      14.78631 
1 1 1 -10 7  6  o 413.0533 8.686559 2081.302       87.43594 2081.302       87.43594 0.000000       0.000000 413.0533 8.686559 ?        ?        0.000000       8.686559 
1 1 1 -10 7  7  o 385.0856 6.640762 1808.121       62.31769 1733.046       74.47808 1983.388       113.7967 376.9410 8.108099 402.8600 11.60358 -25.91901      14.15572 
1 1 1 -10 7  8  f 605.7869 10.10986 4478.892       149.2455 4440.927       181.9660 4556.922       260.8726 602.9624 12.38409 609.7649 17.57451 -6.802490      21.49952 
1 1 1 -10 7  9  o 473.0658 6.934583 2728.975       79.94255 2738.459       113.7349 2719.714       112.3888 473.6925 9.852829 472.0750 9.769585 1.617493       13.87527 
1 1 1 -10 7  10 o 209.8978 3.530030 536.9277       18.05604 546.3218       26.09487 528.2985       25.00986 211.7019 5.058180 208.1829 4.929810 3.519028       7.063159 
1 1 1 -10 7  11 o 224.5294 3.707309 614.4128       20.28468 617.1397       29.05863 611.8210       28.32902 224.9980 5.299812 224.0287 5.189096 0.9692993      7.417191 
1 1 1 -10 7  12 o 293.0837 4.554764 1047.035       32.53072 1027.300       45.78342 1067.157       46.23060 290.2501 6.472913 295.8292 6.412869 -5.579132      9.111723 
1 1 1 -10 7  13 o 436.6083 7.429912 2325.298       79.05180 2323.478       137.2423 2326.202       96.70554 435.7498 12.93886 436.5713 9.089921 -0.8214417     15.81268 
1 1 1 -10 7  14 o 471.1592 6.917435 2707.706       79.42347 2614.951       110.0756 2808.439       114.7113 462.7761 9.760771 479.5859 9.815297 -16.80988      13.84242 
1 1 1 -10 7  15 o 910.9597 15.07539 10167.35       334.6601 10235.96       412.0229 10034.31       573.7083 912.7454 18.52404 899.6193 26.19745 13.12610       32.08499 
1 1 1 -10 7  16 o 579.2495 9.710335 4098.920       137.0680 4001.476       234.5344 4149.468       168.9179 570.5779 16.88627 582.4296 11.90135 -11.85175      20.65885 
1 1 1 -10 7  17 o 473.1029 6.952918 2731.435       80.16020 2867.264       117.3372 2612.563       109.7682 484.3318 9.941607 462.3489 9.742508 21.98294       13.91948 
1 1 1 -10 7  18 o 57.71020 3.271390 40.72668       4.581827 46.50140       6.149314 33.51961       6.869743 61.62038 4.118765 52.13311 5.489732 9.487270       6.863045 
1 1 1 -10 7  19 o 303.3658 4.711383 1122.473       34.82982 1122.540       49.55868 1122.408       48.96038 303.2186 6.706991 303.2081 6.626250 0.1052856E-01  9.428198 
1 1 1 -10 7  20 o 356.9300 5.410919 1554.725       47.06415 1604.096       68.19599 1509.826       65.03404 362.2583 7.725105 351.4715 7.593020 10.78680       10.83195 
1 1 1 -10 7  21 o 183.9663 3.325566 412.6557       14.90871 424.5816       21.67868 401.9539       20.53590 186.4755 4.774548 181.4452 4.648253 5.030273       6.663525 
1 1 1 -10 7  22 o 200.2274 3.505799 488.9415       17.10592 469.0117       23.94981 509.6964       24.44051 195.9446 5.019847 204.3417 4.908142 -8.397095      7.020593 
1 1 1 -10 7  23 o 80.30875 2.763355 78.72961       5.399930 80.71226       7.774683 76.88176       7.505724 81.23836 3.938962 79.28580 3.896669 1.952553       5.540708 
1 1 1 -10 7  24 o 115.1424 2.796134 161.6666       7.845660 167.0469       11.42266 156.8615       10.79482 116.9251 4.014840 113.3081 3.915358 3.617050       5.607938 
1 1 1 -10 7  25 o 204.0661 4.984556 508.8158       24.78754 519.5574       34.95044 497.9449       35.16024 205.8173 6.978518 201.4483 7.173745 4.368958       10.00811 
1 1 1 -10 7  26 o 131.8201 2.932943 211.9501       9.421531 207.4857       13.41909 216.2901       13.23101 130.2810 4.232361 133.0338 4.086111 -2.752823      5.882957 
1 1 1 -10 7  27 o 128.3037 2.923856 200.8170       9.141790 211.5636       13.37916 191.4056       12.52041 131.5447 4.178982 125.1215 4.111886 6.423264       5.862720 
1 1 1 -10 7  28 o 227.9863 3.865568 634.7919       21.47623 648.0377       30.95237 622.4951       29.82306 230.0755 5.520614 225.5136 5.426795 4.561874       7.741271 
1 1 1 -10 7  29 o 28.50975 5.622187 10.30217       3.767162 10.05554       4.568639 10.82608       6.658587 28.06075 6.761453 29.39242 8.690159 -1.331669      11.01073 
1 1 1 -10 7  30 o 76.52620 3.606729 71.69118       6.707119 89.53825       13.91685 66.29177       7.654755 85.08878 6.767416 73.50717 4.291992 11.58161       8.013682 
1 1 1 -10 7  31 o 158.7970 3.202459 307.9215       12.39259 298.8263       17.36915 317.3524       17.68670 156.1920 4.568257 160.9749 4.513167 -4.782913      6.421655 
1 1 1 -10 7  32 o 189.8822 3.520440 440.5939       16.28986 430.7023       22.94784 450.6414       23.12790 187.3892 5.029838 191.6993 4.955003 -4.310074      7.060547 
1 1 1 -10 7  33 o 136.7812 3.104345 228.5403       10.34743 258.4536       15.35571 203.6601       14.00440 145.2171 4.344151 128.8703 4.466141 16.34673       6.230413 
1 1 1 -10 7  34 o 114.5409 3.023146 160.4073       8.430939 158.7745       11.86506 162.0724       11.98210 113.7581 4.287749 114.9355 4.285522 -1.177383      6.062218 
1 1 1 -10 7  35 o 90.50268 3.397346 100.3343       7.479382 101.4362       11.65745 99.56335       9.750940 90.65539 5.299954 89.98043 4.460859 0.6749573      6.927394 
1 1 1 -10 7  36 o 34.74643 4.870778 15.13327       4.011130 14.90406       5.274895 15.44750       6.176359 34.12197 6.582225 34.56468 7.544941 -0.4427071     10.01258 
1 1 1 -10 7  37 o 51.14051 4.238486 32.36283       5.234764 31.82586       6.406657 33.44140       9.079911 50.49746 5.284413 51.18909 7.501484 -0.6916313     9.175908 
1 1 1 -10 7  38 f 80.42160 3.090096 79.38150       6.044661 78.95417       8.429181 79.83389       8.672912 79.92205 4.344287 80.34001 4.447283 -0.4179611     6.217005 
1 1 1 -10 7  39 o 52.93240 4.202651 34.82190       5.376552 31.97839       6.303083 42.41771       10.30177 50.44499 5.201929 57.30003 7.562123 -6.855042      9.178550 
1 1 1 -10 7  40 o 36.38586 4.555422 16.70677       3.950944 15.41804       5.492717 18.08844       5.687321 34.24077 6.822425 37.27113 6.497915 -3.030357      9.421698 
1 1 1 -10 7  41 o 24.91152 7.041568 8.288611       4.463540 0.3662795      7.972591 11.90552       5.386931 20.18690 8.756098 29.64677 7.462763 -9.459871      11.50487 
1 1 1 -10 7  42 o 21.27582 7.246292 5.759892       4.497314 -0.7534134     9.442237 7.671064       5.114745 20.76689 9.246861 23.93175 7.713385 -3.164860      12.04163 
1 1 1 -10 7  43 o 38.65329 4.502276 19.22392       4.161571 13.57861       5.787386 25.26833       5.988463 30.88917 7.712505 43.69649 5.764289 -12.80732      9.628592 
1 1 1 -10 7  44 o 10.34890 4.919171 -3.665703      3.377201 -0.4524891     4.582389 -7.486094      4.996618 14.61474 6.478298 11.50428 5.595783 3.110458       8.560440 
1 1 1 -10 7  45 o 18.80793 6.611666 4.816222       3.756509 4.100904       4.977237 5.763001       5.726154 18.66997 7.384956 20.71250 7.999338 -2.042528      10.88701 
1 1 1 -10 7  46 o 19.79280 6.598508 5.774714       3.729574 2.191562       5.023032 10.17716       5.567758 16.57953 7.066617 24.90820 8.049439 -8.328671      10.71124 
1 1 1 -10 7  47 o 22.63678 6.728173 8.061602       3.982886 5.683555       5.665222 10.38573       5.600635 19.53667 7.828922 24.48053 8.083545 -4.943859      11.25325 
1 1 1 -10 7  48 f 15.90456 6.754299 2.772098       4.559956 0.7033459      5.861571 5.943241       7.257177 15.45545 7.045091 19.34682 8.372950 -3.891360      10.94256 
1 1 1 -10 7  49 o 17.59683 6.657131 5.129358       3.912504 10.82575       5.847812 0.5130426      5.264307 22.89217 8.228302 14.37541 6.599190 8.516768       10.54771 
1 1 1 -10 7  50 o 8.607640 4.321909 -8.996174      3.982818 -11.73747      7.154731 -7.765265      4.794335 11.59029 5.815771 10.09143 5.016024 1.498860       7.680084 
1 1 1 -10 8  1  o 195.2827 3.041850 464.7296       14.47564 445.9182       22.54535 477.9239       18.88173 191.2059 4.842493 198.0256 3.912771 -6.819687      6.225714 
1 1 1 -10 8  2  o 432.9763 6.395990 2285.729       67.48511 2262.425       95.07040 2309.396       95.81062 430.6187 9.059753 435.0673 9.036934 -4.448639      12.79630 
1 1 1 -10 8  3  o 487.2123 6.385593 2894.212       75.81508 2747.068       115.9974 3003.946       100.1723 474.4349 10.03311 496.2505 8.283442 -21.81561      13.01072 
1 1 1 -10 8  4  o 447.8980 6.601805 2446.086       72.05729 2399.955       100.8268 2494.243       103.0173 443.4980 9.329279 452.1247 9.350094 -8.626648      13.20832 
1 1 1 -10 8  5  o 338.5348 5.149088 1397.013       42.47855 1420.859       60.85381 1374.352       59.32292 341.3366 7.315917 335.7065 7.251482 5.630157       10.30081 
1 1 1 -10 8  6  o 199.2416 4.954266 483.8845       24.05445 523.4241       35.77999 451.2754       32.49327 207.0565 7.101639 192.2483 6.947196 14.80818       9.934627 
1 1 1 -10 8  7  o 421.3622 6.238472 2164.713       64.05750 2107.615       89.29370 2225.254       91.94649 415.6331 8.816061 427.0739 8.834785 -11.44083      12.48104 
1 1 1 -10 8  8  o 512.3887 7.479347 3201.998       93.38978 3328.556       135.6309 3087.900       128.7813 522.1590 10.65908 502.9425 10.50748 19.21646       14.96740 
1 1 1 -10 8  9  o 173.4186 3.154862 366.4998       13.33252 377.1750       19.50945 357.1457       18.26234 175.8504 4.556499 171.1213 4.383026 4.729187       6.322389 
1 1 1 -10 8  10 o 166.9616 3.103710 339.7155       12.62798 328.9849       18.04168 350.0213       17.68109 164.2256 4.512444 169.4075 4.286366 -5.181976      6.223752 
1 1 1 -10 8  11 o 563.9318 8.187271 3879.860       112.5128 3920.558       160.4698 3840.507       157.7981 566.5132 11.62377 560.7091 11.54856 5.804077       16.38540 
1 1 1 -10 8  12 o 650.0131 9.376431 5157.338       148.5237 5016.673       206.4048 5308.381       213.8833 640.5228 13.22358 658.8649 13.32123 -18.34204      18.77015 
1 1 1 -10 8  13 o 524.0333 8.814566 3351.682       112.5631 3410.672       197.6331 3323.358       136.9459 527.4860 15.39137 521.5953 10.77406 5.890625       18.78762 
1 1 1 -10 8  14 o 295.2939 4.600701 1063.005       33.10660 1026.043       46.15387 1102.179       47.51542 290.0402 6.530011 300.6107 6.486255 -10.57056      9.203941 
1 1 1 -10 8  15 o 97.26514 3.089382 115.4167       7.313307 123.4300       14.44179 112.6531       8.481172 100.4271 5.927475 96.06892 3.629263 4.358147       6.950289 
1 1 1 -10 8  16 o 154.0439 4.271132 289.5140       16.01785 327.6585       25.27112 263.8981       20.70924 163.7635 6.344446 146.9796 5.793253 16.78386       8.591495 
1 1 1 -10 8  17 o 416.1891 6.193934 2113.397       62.81934 2085.782       88.41684 2141.546       89.26922 413.1762 8.781395 418.6671 8.749773 -5.490906      12.39643 
1 1 1 -10 8  18 o 189.1363 3.874221 436.1454       17.85646 458.9403       22.80226 400.0011       28.71297 193.9821 4.823698 180.9077 6.523742 13.07445       8.113400 
1 1 1 -10 8  19 o 86.00652 2.688702 90.25030       5.628289 88.67311       8.226434 91.63825       7.717157 85.18275 3.973951 86.61698 3.664380 -1.434227      5.405550 
1 1 1 -10 8  20 o 272.0680 4.338801 902.9005       28.76625 902.3762       40.92938 903.4122       40.43832 271.8351 6.178649 271.9987 6.100848 -0.1636047     8.683090 
1 1 1 -10 8  21 o 82.47360 2.724018 83.01029       5.467197 82.72361       8.070155 83.25347       7.432694 82.25183 4.038593 82.53841 3.704780 -0.2865753     5.480477 
1 1 1 -10 8  22 o 462.1620 6.840171 2612.468       77.03664 2586.198       108.5262 2639.150       109.3712 458.9488 9.703634 463.6319 9.680407 -4.683105      13.70660 
1 1 1 -10 8  23 o 170.6915 3.222561 355.3487       13.40446 354.2527       19.22475 356.3856       18.69967 170.2763 4.637406 170.8025 4.496572 -0.5262299     6.459466 
1 1 1 -10 8  24 o 73.34116 3.383148 65.75780       6.030222 63.52390       7.224838 70.88783       10.94855 72.02163 4.133875 75.90053 5.967328 -3.878899      7.259334 
1 1 1 -10 8  25 o 113.8136 3.881710 158.2921       10.75022 152.6601       14.48590 165.1961       16.03860 111.6213 5.341018 116.0820 5.687078 -4.460709      7.801879 
1 1 1 -10 8  26 o 138.3945 2.986672 233.6370       10.07262 236.8791       14.60392 230.6953       13.91100 139.1988 4.310439 137.3839 4.159938 1.814880       5.990407 
1 1 1 -10 8  27 o 105.8718 2.841460 136.8318       7.324281 137.6779       10.54776 136.0439       10.17831 106.0922 4.087461 105.4718 3.967147 0.6204605      5.696104 
1 1 1 -10 8  28 o 50.91405 3.336437 31.77653       4.116775 39.67225       6.042791 24.93788       5.623765 56.80440 4.399627 44.84011 5.245667 11.96429       6.846439 
1 1 1 -10 8  29 o 64.11624 3.473565 50.34333       5.406980 51.66838       6.843456 48.14199       8.820744 64.86480 4.354657 62.39549 5.870137 2.469307       7.309004 
1 1 1 -10 8  30 o 159.4317 3.765471 310.5789       14.62952 321.3880       27.25605 306.2046       17.33879 161.4967 6.941902 158.1465 4.503659 3.350204       8.274838 
1 1 1 -10 8  31 o 84.45750 2.944350 87.18317       6.050606 82.45076       8.425620 92.22234       8.694407 81.99220 4.231212 86.74029 4.125051 -4.748085      5.909247 
1 1 1 -10 8  32 o 51.87138 3.590996 33.04239       4.511176 32.26905       6.229159 33.89531       6.541852 51.05670 5.073634 52.31950 5.199733 -1.262802      7.264915 
1 1 1 -10 8  33 o 78.76480 3.111321 75.90861       5.960160 72.68629       8.219067 79.48243       8.655754 76.90871 4.403826 80.43047 4.433342 -3.521759      6.248857 
1 1 1 -10 8  34 o 160.9870 3.305128 316.8700       12.96627 313.2488       18.32452 320.5012       18.34965 159.7133 4.713364 161.5658 4.665490 -1.852539      6.631938 
1 1 1 -10 8  35 o 60.89663 3.689478 45.56783       5.449442 46.36654       8.429319 44.99431       7.142824 61.07294 5.730747 60.31683 4.901756 0.7561150      7.541132 
1 1 1 -10 8  36 o 35.06598 4.831282 15.40786       4.018823 9.383901       5.363665 23.11849       6.068284 27.06591 7.741867 42.83933 5.975180 -15.77342      9.779533 
1 1 1 -10 8  37 o 83.89756 3.566519 86.48340       7.275085 80.49281       8.803129 99.38882       12.92077 80.73523 4.492143 89.30415 5.971500 -8.568916      7.472493 
1 1 1 -10 8  38 o 65.46828 3.315508 52.72962       5.272308 62.96429       7.574402 43.10994       7.343307 71.31203 4.379753 58.75406 5.181875 12.55797       6.784841 
1 1 1 -10 8  39 o 55.06724 4.054784 37.65192       5.403072 36.35095       6.391597 40.90934       10.11378 53.86393 4.923794 56.17322 7.581758 -2.309284      9.040288 
1 1 1 -10 8  40 o 75.36255 3.137598 70.04396       5.749605 76.70341       8.336463 64.00237       7.940331 78.43085 4.379118 71.54563 4.578301 6.885216       6.335418 
1 1 1 -10 8  41 o 52.34594 4.680216 34.64797       5.907227 26.36855       11.02769 37.97974       6.995553 42.52736 10.66211 54.53598 5.331881 -12.00861      11.92097 
1 1 1 -10 8  42 o 45.37375 4.025919 25.99467       4.405335 24.69535       6.022467 27.48999       6.460770 43.39970 5.842734 45.77483 5.931214 -2.375134      8.325674 
1 1 1 -10 8  43 o 19.22837 6.590882 4.753223       3.721764 3.907546       5.192641 5.646599       5.337067 19.34070 7.575632 21.24804 7.827073 -1.907345      10.89281 
1 1 1 -10 8  44 o 11.66529 5.409967 -2.426042      3.670110 1.529374       5.503117 -5.594616      4.925435 17.22822 7.371288 12.14242 5.817863 5.085796       9.390603 
1 1 1 -10 8  45 o 9.607019 4.674047 -5.304257      3.491740 -11.22079      4.540620 3.257884       5.462265 9.389121 4.699985 18.16477 7.531028 -8.775645      8.877288 
1 1 1 -10 8  46 o 20.61765 6.791201 6.419159       3.953837 4.270023       5.481306 8.750365       5.708767 18.61163 7.612011 23.10167 8.148123 -4.490046      11.15054 
1 1 1 -10 8  47 o 21.10467 6.809364 7.062871       3.985405 9.571935       5.624637 4.533044       5.647862 23.39190 8.098986 18.43050 7.651015 4.961397       11.14144 
1 1 1 -10 8  48 o 20.84910 7.261227 7.530639       4.524384 5.550095       5.630877 11.13861       7.600033 18.62600 7.677002 22.84124 9.096305 -4.215237      11.90290 
1 1 1 -10 8  49 o 19.34723 6.829155 6.605822       4.010750 7.785718       5.666013 5.420878       5.678120 19.85094 7.870713 17.83225 7.553477 2.018692       10.90886 
1 1 1 -10 8  50 o 11.38233 5.496904 -3.430102      4.603442 -2.295733      8.528501 -3.896487      5.468495 14.82385 7.232693 12.13204 5.890287 2.691809       9.327772 
1 1 1 -10 9  1  o 171.4395 3.563064 358.1985       14.88575 340.0482       24.88881 368.3070       18.57401 166.8910 6.130184 173.7764 4.389616 -6.885330      7.539753 
1 1 1 -10 9  2  o 370.1306 5.574974 1670.124       50.28448 1595.339       69.26218 1753.473       73.12058 361.6534 7.859004 379.1512 7.913910 -17.49777      11.15320 
1 1 1 -10 9  3  o 31.62712 3.610099 12.34919       2.732598 6.758832       4.565466 15.46988       3.411076 23.56745 7.246735 35.39920 4.025656 -11.83175      8.289817 
1 1 1 -10 9  4  o 360.1332 4.872779 1580.916       42.76377 1599.168       68.30001 1569.147       54.84437 362.0941 7.740396 358.7424 6.273550 3.351776       9.963491 
1 1 1 -10 9  5  o 214.3869 3.659153 560.1479       19.11679 564.0304       27.16661 556.3397       26.90573 215.1037 5.182645 213.6325 5.168226 1.471237       7.319178 
1 1 1 -10 9  6  o 214.2817 4.209345 559.6417       21.98040 554.7685       26.91513 569.3995       38.08605 213.3298 5.177365 215.9552 7.247396 -2.625305      8.906732 
1 1 1 -10 9  7  o 290.4033 4.544084 1027.940       32.15762 1002.175       64.12544 1036.596       37.16916 286.4320 9.198909 291.6061 5.230582 -5.174164      10.58201 
1 1 1 -10 9  8  o 455.5655 6.709051 2530.818       74.48143 2578.220       106.9816 2486.230       103.7577 459.6203 9.551549 451.3554 9.433339 8.264893       13.42460 
1 1 1 -10 9  9  f 672.0236 9.684253 5512.339       158.5940 5393.056       221.2523 5638.396       227.4476 664.1360 13.67082 679.0616 13.74472 -14.92560      19.38579 
1 1 1 -10 9  10 o 180.1836 3.257119 395.6640       14.30161 407.6904       21.00786 385.2760       19.52457 182.8198 4.719389 177.7285 4.511694 5.091385       6.529013 
1 1 1 -10 9  11 o 186.3176 3.328062 423.0708       15.11059 396.8782       21.18098 450.2175       21.56335 180.3709 4.823179 192.1822 4.604335 -11.81133      6.668055 
1 1 1 -10 9  12 o 194.8524 3.420706 462.7323       16.24268 444.7414       22.95599 480.7691       22.98527 190.9366 4.937822 198.5900 4.749591 -7.653381      6.851328 
1 1 1 -10 9  13 o 257.2322 4.750696 806.6610       29.77959 845.4774       53.41780 789.1574       35.87092 263.0692 8.343137 254.3930 5.786305 8.676239       10.15329 
1 1 1 -10 9  14 o 905.6910 15.00108 10053.96       331.0843 9881.716       567.4221 10142.88       407.6784 892.2008 26.12616 908.3279 18.41785 -16.12708      31.96550 
1 1 1 -10 9  15 o 261.9872 4.856873 836.8953       31.00794 833.2006       54.66373 838.6481       37.65172 261.0718 8.603928 262.2180 5.892318 -1.146210      10.42818 
1 1 1 -10 9  16 o 928.0742 13.31425 10558.67       301.1171 10443.51       422.6616 10677.36       429.0991 920.2061 18.84827 930.4055 18.92558 -10.19934      26.71021 
1 1 1 -10 9  17 o 355.0087 6.226767 1538.016       53.86885 1548.996       66.64928 1517.331       91.48172 356.1292 7.679834 351.9220 10.67959 4.207123       13.15422 
1 1 1 -10 9  18 o 140.7986 3.382647 241.6781       11.60623 234.9056       14.49243 253.7893       19.38029 138.7228 4.292202 144.1129 5.528757 -5.390121      6.999296 
1 1 1 -10 9  19 o 303.4178 4.732553 1123.115       34.99231 1092.935       49.03403 1154.435       49.95193 299.1251 6.726801 307.4327 6.667547 -8.307556      9.471327 
1 1 1 -10 9  20 o 136.0347 2.912274 225.6023       9.654237 216.3593       13.78116 234.5096       13.52865 133.1098 4.254002 138.6024 4.009630 -5.492569      5.845825 
1 1 1 -10 9  21 o 222.3396 3.760389 602.9854       20.37444 648.0746       30.34449 565.9705       27.49361 230.3707 5.405260 215.2983 5.240287 15.07237       7.528442 
1 1 1 -10 9  22 o 195.7884 3.485766 467.5685       16.63111 440.2382       23.18093 496.5580       23.87428 189.8056 5.016104 201.6650 4.858069 -11.85934      6.982989 
1 1 1 -10 9  23 o 248.6195 4.081300 754.3973       24.72691 754.9116       35.33157 753.9035       34.61762 248.4885 5.834728 248.3389 5.720268 0.1495819      8.171017 
1 1 1 -10 9  24 f 197.6017 4.915239 477.0357       23.66854 487.4699       33.34449 466.4398       33.60173 199.3801 6.873154 194.9879 7.083374 4.392166       9.869875 
1 1 1 -10 9  25 o 175.8434 3.299911 377.2546       14.14048 383.1738       20.46213 371.8440       19.56345 177.0289 4.747477 174.4078 4.607061 2.621124       6.615403 
1 1 1 -10 9  26 o 129.6446 2.942453 205.0330       9.296089 198.6726       13.27148 211.1596       13.02529 127.4636 4.278712 131.4344 4.071610 -3.970840      5.906385 
1 1 1 -10 9  27 o 82.93324 2.854425 84.00597       5.760172 85.78081       8.409087 82.43700       7.906363 83.69629 4.135745 82.06159 3.965410 1.634697       5.729647 
1 1 1 -10 9  28 o 73.82730 2.946330 66.61298       5.290069 60.63943       7.516879 72.47472       7.446196 70.29504 4.410328 76.91942 3.986084 -6.624382      5.944734 
1 1 1 -10 9  29 o 177.8581 3.903179 386.5271       16.91719 393.1952       21.28281 375.0838       27.88062 179.1782 4.878788 174.6360 6.563057 4.542252       8.177793 
1 1 1 -10 9  30 o 119.3209 3.504947 174.0625       10.18036 180.2564       19.52579 171.7502       11.93023 120.9040 6.652867 118.4460 4.139620 2.458023       7.835630 
1 1 1 -10 9  31 o 119.2741 2.975982 173.6875       8.649934 163.2054       12.14751 184.4694       12.32002 115.4105 4.326887 122.7390 4.124870 -7.328484      5.978002 
1 1 1 -10 9  32 o 94.14315 3.503214 108.4736       8.022936 105.2510       9.764235 115.1707       14.07607 92.62133 4.338098 96.60105 6.009239 -3.979721      7.411481 
1 1 1 -10 9  33 o 200.9490 3.660563 493.8961       17.92544 509.3171       26.03649 479.9999       24.71583 203.5857 5.252451 197.6726 5.135239 5.913086       7.345673 
1 1 1 -10 9  34 o 77.04536 3.176773 72.68668       5.951634 69.53573       8.389176 75.87962       8.444864 75.14715 4.603197 78.54169 4.430172 -3.394539      6.388728 
1 1 1 -10 9  35 o 73.28967 4.600848 66.21988       8.175608 0.000000       0.000000 66.21988       8.175608 ?        ?        73.28967 4.600848 0.000000       4.600848 
1 1 1 -10 9  36 o 91.90012 3.551380 103.6439       7.938366 100.8889       9.608712 109.5674       14.08934 90.50259 4.369717 93.82316 6.197027 -3.320572      7.582715 
1 1 1 -10 9  37 o 67.23907 3.388784 55.57545       5.534767 62.06916       7.807971 49.01690       7.846860 70.82745 4.547801 62.75842 5.176829 8.069031       6.890723 
1 1 1 -10 9  38 o 25.86831 6.050848 8.683690       3.746040 8.202697       5.172672 9.214170       5.432258 25.30434 7.700793 26.66102 7.840486 -1.356686      10.98979 
1 1 1 -10 9  39 o 38.73138 5.141488 19.01196       4.732997 24.34512       5.809252 8.482405       8.162673 43.77255 5.572193 26.88070 9.713680 16.89185       11.19843 
1 1 1 -10 9  40 o 44.23531 5.133227 24.85563       5.430822 21.21375       10.65880 26.13259       6.311522 38.52048 10.87899 45.09354 5.883786 -6.573063      12.36816 
1 1 1 -10 9  41 o 20.91065 7.421336 5.250902       4.741845 -7.486238      9.248783 9.792909       5.522968 17.76805 8.353152 26.79612 7.912409 -9.028070      11.50571 
1 1 1 -10 9  42 o 14.79350 5.999427 1.485851       3.370598 0.1437680      4.488902 3.220607       5.103519 15.23657 6.589621 18.79745 7.464413 -3.560875      9.956936 
1 1 1 -10 9  43 o 24.50856 6.100127 8.274674       3.628838 6.943991       4.873242 9.930914       5.436787 22.46976 7.543540 26.21317 7.877432 -3.743404      10.90683 
1 1 1 -10 9  44 o 15.06674 6.368606 1.185659       4.022370 7.131046       5.872893 -4.067518      5.520432 22.46376 8.221265 13.71374 6.449120 8.750027       10.44894 
1 1 1 -10 9  45 o 12.70849 5.650878 -0.3601594     3.513859 -3.559546      4.810846 3.298574       5.144622 12.69349 5.985072 17.84078 7.344129 -5.147294      9.474033 
1 1 1 -10 9  46 o 21.36043 6.906341 7.032159       4.098376 0.4808972      5.503677 15.18699       6.140419 15.68049 7.015510 30.18507 8.156018 -14.50458      10.75816 
1 1 1 -10 9  47 o 12.32247 5.763327 -2.148442      4.307257 -3.039883      5.259910 -0.3338609     7.504474 13.11329 6.205583 16.51824 7.686270 -3.404956      9.878664 
1 1 1 -10 9  48 o 34.85429 5.506469 18.09261       4.521827 16.63705       6.465121 19.48654       6.326780 29.30367 8.535752 32.94212 7.968867 -3.638454      11.67741 
1 1 1 -10 9  49 f 13.03947 5.855941 0.6231110      3.874296 -5.868961      5.762077 5.979889       5.234067 11.94255 5.851865 18.18813 7.438529 -6.245586      9.464461 
1 1 1 -10 9  50 o 16.50573 6.873028 4.644843       4.577666 1.533162       8.418500 5.951141       5.454543 15.90065 7.615221 17.60791 7.428110 -1.707259      10.63806 
1 1 1 -10 10 1  o 490.4871 5.880954 2933.183       70.29290 2958.562       100.0826 2908.477       98.74913 492.4452 8.339973 488.2622 8.299351 4.183014       11.76581 
1 1 1 -10 10 2  o 414.7137 5.526482 2096.743       55.85130 2029.868       86.66441 2144.248       73.04238 407.8771 8.719174 419.3066 7.148371 -11.42957      11.27489 
1 1 1 -10 10 3  o 147.4204 2.669443 264.8362       9.589903 273.0317       15.70181 259.9604       12.11118 149.6064 4.311385 146.0511 3.402870 3.555298       5.492501 
1 1 1 -10 10 4  o 165.5165 2.802740 333.8495       11.30473 333.0989       18.14935 334.3252       14.45020 165.2501 4.511176 165.6269 3.580195 -0.3768311     5.759210 
1 1 1 -10 10 5  o 110.2466 2.837160 148.2134       7.615948 150.1488       10.88359 146.3564       10.66101 110.9192 4.033231 109.5090 4.001690 1.410225       5.681592 
1 1 1 -10 10 6  o 293.7670 4.116891 1051.837       29.47193 1035.873       46.51245 1062.546       38.09554 291.4593 6.548702 295.2284 5.295169 -3.769104      8.421658 
1 1 1 -10 10 7  o 591.4202 7.668356 4266.599       110.5184 4173.940       172.4005 4331.243       143.9990 584.4783 12.10415 595.6606 9.920293 -11.18237      15.65000 
1 1 1 -10 10 8  o 482.3746 7.084466 2837.918       83.27750 2731.879       115.1974 2953.996       120.5277 473.0481 9.993126 491.8971 10.05487 -18.84903      14.17614 
1 1 1 -10 10 9  o 311.3158 4.833071 1181.446       36.66573 1220.163       53.45246 1147.038       50.38936 316.2966 6.934850 306.6804 6.742434 9.616180       9.672257 
1 1 1 -10 10 10 o 147.4579 2.998335 264.9874       10.77418 261.3836       15.73527 268.1683       14.78324 146.3688 4.416584 148.2715 4.095358 -1.902664      6.023137 
1 1 1 -10 10 11 o 158.5154 3.084328 306.2263       11.91429 298.3154       17.18639 313.5458       16.53139 156.3702 4.514914 160.3276 4.234924 -3.957336      6.190237 
1 1 1 -10 10 12 o 398.7887 6.871097 1939.945       66.77364 1993.584       118.3261 1914.882       80.88313 403.6080 12.04400 396.0938 8.379610 7.514221       14.67228 
1 1 1 -10 10 13 o 522.5543 8.822132 3334.035       112.3417 3628.469       207.0759 3211.233       133.7328 543.7123 15.64502 512.5894 10.70612 31.12299       18.95752 
1 1 1 -10 10 14 o 359.0833 6.281723 1572.920       54.96803 1570.307       96.16901 1574.187       66.98940 358.1796 11.03103 359.1259 7.654614 -0.9463196     13.42672 
1 1 1 -10 10 15 o 382.0481 5.748163 1780.451       53.51595 1812.402       76.91323 1750.464       74.50993 385.2380 8.192865 378.6104 8.075799 6.627625       11.50398 
1 1 1 -10 10 16 o 104.6980 2.757876 133.6946       7.030255 133.6741       10.47416 133.7114       9.483984 104.6263 4.116144 104.6619 3.724424 -0.3555298E-01 5.551033 
1 1 1 -10 10 17 o 385.2620 6.695945 1812.204       62.86432 1780.306       76.49810 1878.548       110.3250 381.6579 8.225082 391.2868 11.58300 -9.628876      14.20626 
1 1 1 -10 10 18 o 175.0853 3.249618 373.7217       13.86495 393.3931       20.49983 357.1363       18.82327 179.5188 4.690037 171.0520 4.519719 8.466797       6.513394 
1 1 1 -10 10 19 o 179.9782 3.316344 394.9479       14.54506 406.6527       21.12431 384.3962       20.05683 182.4990 4.753964 177.4397 4.642463 5.059265       6.644745 
1 1 1 -10 10 20 o 285.4566 4.519977 994.3170       31.44216 977.7601       44.35854 1011.035       44.57410 282.8565 6.435391 287.6394 6.359135 -4.782898      9.047257 
1 1 1 -10 10 21 o 352.4008 5.386970 1516.811       46.26126 1432.530       63.47879 1612.274       67.55820 342.0575 7.615412 362.8774 7.639802 -20.81992      10.78708 
1 1 1 -10 10 22 o 150.3466 3.052383 275.6630       11.18327 259.4751       15.79327 291.9425       15.83788 145.7249 4.452582 154.6037 4.207705 -8.878784      6.126196 
1 1 1 -10 10 23 o 97.35371 3.304996 115.7477       7.829416 125.5475       9.866282 99.08115       12.86672 101.3434 4.002920 89.81780 5.911400 11.52563       7.139189 
1 1 1 -10 10 24 o 138.9999 4.153258 236.0965       14.05245 239.0115       19.46819 232.9256       20.30452 139.6750 5.731846 137.8378 6.059700 1.837234       8.341105 
1 1 1 -10 10 25 o 20.28146 5.653141 5.176183       2.898124 5.501484       4.477254 4.941587       3.802136 21.76354 7.229027 20.45206 6.655117 1.311478       9.825955 
1 1 1 -10 10 26 o 187.1023 3.433235 427.2643       15.65376 424.2821       22.43948 430.0914       21.84790 186.2141 4.949364 187.5110 4.785220 -1.296921      6.884368 
1 1 1 -10 10 27 o 163.6455 3.219224 326.8318       12.83783 321.8712       18.40337 331.5338       17.91724 162.1875 4.661165 164.6337 4.470112 -2.446136      6.458201 
1 1 1 -10 10 28 o 53.41433 3.746812 35.01880       4.846099 36.67781       6.353930 32.71171       7.492882 54.54333 4.830290 51.29110 6.115038 3.252239       7.792650 
1 1 1 -10 10 29 o 87.31989 3.453067 93.26207       7.333261 79.07986       13.88759 98.74544       8.635323 79.84618 7.215119 89.80147 3.955724 -9.955292      8.228347 
1 1 1 -10 10 30 o 139.4771 3.075302 237.5134       10.45266 224.7376       14.79165 250.2569       14.77296 135.4467 4.487577 142.9774 4.244682 -7.530685      6.177028 
1 1 1 -10 10 31 o 215.4481 4.409904 568.1560       23.15303 577.8099       28.70701 550.1886       39.16311 216.9491 5.434205 210.9289 7.631702 6.020203       9.368750 
1 1 1 -10 10 32 o 45.76780 3.911899 25.80979       4.321194 19.91980       5.968906 32.29644       6.263946 39.73945 6.379448 51.06108 5.102357 -11.32163      8.168929 
1 1 1 -10 10 33 o 50.23456 3.822663 31.05831       4.644419 29.86458       6.338175 32.44255       6.825235 49.00658 5.396528 51.06889 5.574776 -2.062313      7.758907 
1 1 1 -10 10 34 o 72.93048 3.557001 65.23764       6.302564 60.57348       9.811709 68.51404       8.223485 69.87587 5.814754 74.59105 4.545692 -4.715179      7.380697 
1 1 1 -10 10 35 o 115.4105 3.092731 163.0316       8.690243 162.7499       12.39802 163.3036       12.18448 115.0367 4.430905 115.2527 4.346090 -0.2160187     6.206563 
1 1 1 -10 10 36 o 77.14146 3.740250 73.16326       7.010167 75.35894       8.496175 68.48057       12.40757 78.14243 4.480482 73.80212 6.981936 4.340309       8.295911 
1 1 1 -10 10 37 o 146.6112 3.237920 263.5377       11.56830 263.0511       16.55468 264.0020       16.17211 145.9199 4.661524 146.2337 4.543708 -0.3138123     6.509615 
1 1 1 -10 10 38 o 97.63608 3.549851 117.4093       8.432047 118.4527       10.40430 115.4125       14.39349 97.79851 4.376694 95.75848 6.201472 2.040031       7.590370 
1 1 1 -10 10 39 o 64.10088 4.193480 51.12009       6.514536 47.46242       12.89524 52.37348       7.548635 59.51241 9.187160 64.67188 4.824555 -5.159473      10.37691 
1 1 1 -10 10 40 o 45.44870 3.968308 25.84084       4.351006 26.98645       6.071776 24.63161       6.238098 45.90525 5.539589 43.63779 6.026900 2.267464       8.185999 
1 1 1 -10 10 41 o 28.99225 6.815999 11.38758       4.733917 8.492659       9.581012 12.32257       5.444984 26.74488 10.34243 29.94228 7.483615 -3.197403      12.76598 
1 1 1 -10 10 42 o 13.76331 5.865634 0.4073491      3.460105 2.391829       4.624319 -2.116966      5.215503 17.39468 7.037015 14.70006 6.679204 2.694614       9.702131 
1 1 1 -10 10 43 o 25.26874 6.013087 8.814774       3.648819 11.74176       5.113297 5.777851       5.208437 28.57180 7.313730 21.11761 7.740030 7.454193       10.64888 
1 1 1 -10 10 44 o 19.69892 6.582829 5.391897       3.711503 5.230329       4.881687 5.613230       5.713675 19.92589 7.457970 20.72222 7.993934 -0.7963314     10.93272 
1 1 1 -10 10 45 o 30.00667 5.933557 12.88343       4.185003 10.29317       5.607616 16.13993       6.287547 25.22214 8.071388 31.67979 8.110600 -6.457651      11.44243 
1 1 1 -10 10 46 o 21.10398 7.306646 7.026518       4.577919 4.360691       5.451122 13.40613       8.432703 18.46678 7.576232 26.09562 9.794849 -7.628836      12.38299 
1 1 1 -10 10 47 o 32.97388 6.532663 16.91135       5.063574 15.87889       6.175257 19.03013       8.846292 29.77844 8.233832 29.22797 10.15494 0.5504723      13.07359 
1 1 1 -10 10 48 o 19.47676 6.862807 6.475331       4.049018 4.816412       5.841175 8.009751       5.617714 17.78131 7.600793 20.54097 7.925856 -2.759659      10.98140 
1 1 1 -10 10 49 o 11.08795 5.237002 -1.938468      3.712376 -7.382977      5.470702 2.708558       5.054186 11.09977 5.489109 15.42446 6.822082 -4.324695      8.756205 
1 1 1 -10 10 50 o 15.42584 6.586711 3.537276       4.377899 1.971096       7.930415 4.223773       5.250424 15.82821 7.527784 16.19974 7.065189 -0.3715286     10.32397 
1 1 1 -10 11 1  o 132.5344 2.381658 214.0489       7.692085 213.7614       11.05834 214.3184       10.70669 132.3928 3.430483 132.6107 3.313145 -0.2179260     4.769186 
1 1 1 -10 11 2  o 267.9589 3.847721 875.1254       25.12511 872.0030       39.90271 877.1766       32.34139 267.4202 6.123109 268.2470 4.947522 -0.8267822     7.872130 
1 1 1 -10 11 3  o 436.7376 5.795241 2325.601       61.67770 2319.492       97.51461 2329.675       79.62906 435.9458 9.179120 437.0238 7.477051 -1.078003      11.83903 
1 1 1 -10 11 4  o 104.8941 2.481262 134.0791       6.342490 145.7245       10.66419 127.7053       7.889520 109.2703 4.011692 102.3176 3.168018 6.952660       5.111753 
1 1 1 -10 11 5  o 226.4865 3.837145 625.1984       21.17808 621.4049       29.91252 629.0111       29.98828 225.7649 5.437014 227.1429 5.417716 -1.377991      7.675465 
1 1 1 -10 11 6  o 23.60154 5.218228 7.058872       2.921398 3.828220       4.996245 8.737250       3.601169 20.33039 7.557670 26.25764 5.784438 -5.927248      9.517253 
1 1 1 -10 11 7  o 197.2066 3.452091 473.9763       16.58975 438.5328       32.14112 486.8482       19.36932 189.4899 6.972363 199.8584 3.977002 -10.36847      8.026855 
1 1 1 -10 11 8  o 266.1183 3.820779 863.1606       24.77780 908.1298       40.67567 836.6287       31.24364 272.8957 6.116486 261.9701 4.894111 10.92557       7.833499 
1 1 1 -10 11 9  o 360.2706 5.461157 1582.536       47.94569 1576.542       68.06691 1588.439       67.54698 359.4649 7.770401 360.8241 7.681999 -1.359253      10.92668 
1 1 1 -10 11 10 o 480.3719 8.157497 2816.078       95.49279 2637.971       159.1379 2916.296       119.3730 463.9990 14.09043 488.6489 10.02474 -24.64984      17.29264 
1 1 1 -10 11 11 o 195.8679 3.963992 467.6334       18.92048 489.1587       34.44734 458.3341       22.64156 200.1136 7.075006 193.8928 4.791908 6.220749       8.545063 
1 1 1 -10 11 12 o 268.7577 6.016191 880.9704       39.40203 0.000000       0.000000 880.9704       39.40203 ?        ?        268.7577 6.016191 0.000000       6.016191 
1 1 1 -10 11 13 o 483.4305 8.210595 2853.436       96.72636 3000.103       174.1656 2788.023       116.3131 494.4221 14.47091 477.6209 9.993307 16.80115       17.58617 
1 1 1 -10 11 14 o 454.5857 6.727730 2521.825       74.52817 2725.395       111.3351 2356.541       100.3208 472.1846 9.675740 439.1140 9.375135 33.07053       13.47268 
1 1 1 -10 11 15 o 226.5105 3.811761 625.5058       21.04021 580.5425       28.98588 675.5820       30.58953 218.1522 5.452439 235.3383 5.333891 -17.18608      7.627548 
1 1 1 -10 11 16 o 214.0788 3.674053 558.7515       19.16705 523.0538       26.56176 597.5345       27.68576 206.9937 5.270079 221.3194 5.133350 -14.32570      7.356970 
1 1 1 -10 11 17 o 384.3499 6.692651 1804.140       62.68464 1788.867       76.77153 1834.690       108.5762 382.4910 8.236504 386.5368 11.53970 -4.045837      14.17761 
1 1 1 -10 11 18 o 465.7683 6.890324 2650.813       78.20701 2537.258       107.8039 2776.970       113.6286 455.0443 9.721758 476.0345 9.795198 -20.99023      13.80067 
1 1 1 -10 11 19 o 362.9067 5.518109 1608.100       48.80017 1590.760       68.93114 1625.524       69.09687 360.5566 7.845235 364.4879 7.779274 -3.931366      11.04830 
1 1 1 -10 11 20 o 383.4174 6.701066 1797.683       62.61116 1736.480       75.43584 1933.203       112.2517 376.4922 8.222154 396.0071 11.64463 -19.51489      14.25487 
1 1 1 -10 11 21 o 112.3249 2.792347 153.8395       7.643311 168.9487       11.59969 142.2455       10.16115 117.5957 4.053858 107.9048 3.870525 9.690910       5.604885 
1 1 1 -10 11 22 o 134.6965 2.944914 221.2605       9.666408 211.1605       13.84306 230.8717       13.50397 131.4481 4.327472 137.4786 4.035158 -6.030548      5.916883 
1 1 1 -10 11 23 o 223.7971 4.456137 611.6173       24.30240 631.6185       30.36054 575.9459       40.54547 227.2976 5.481236 216.5633 7.695064 10.73434       9.447643 
1 1 1 -10 11 24 o 43.18900 3.779643 22.94057       3.937907 25.32159       6.879301 21.78013       4.802590 45.02267 6.454509 41.95121 4.783157 3.071461       8.033634 
1 1 1 -10 11 25 o 138.7967 3.005817 235.0156       10.16665 238.6472       14.91417 231.8631       13.89544 139.7001 4.386366 137.7247 4.144946 1.975357       6.034964 
1 1 1 -10 11 26 o 33.06377 4.374087 13.58927       3.437955 7.869570       5.028997 18.60767       4.710610 25.19581 7.577273 38.66961 5.124917 -13.47381      9.147669 
1 1 1 -10 11 27 o 214.0124 3.741517 559.3625       19.51294 547.1792       27.70156 571.3610       27.49058 211.3391 5.383220 216.0581 5.221283 -4.719009      7.499391 
1 1 1 -10 11 28 o 111.0552 3.320525 150.7115       8.976228 145.4938       11.29462 159.6571       14.78891 109.0111 4.259922 114.0498 5.335943 -5.038757      6.827827 
1 1 1 -10 11 29 o 121.2809 3.524661 179.8221       10.40602 173.1235       19.82560 182.3693       12.22544 118.4365 6.899047 122.0638 4.115886 -3.627342      8.033515 
1 1 1 -10 11 30 o 211.6999 4.368622 548.3851       22.53726 553.3801       27.78586 538.7795       38.53181 212.3653 5.373449 208.8190 7.584648 3.546371       9.295205 
1 1 1 -10 11 31 o 82.60830 3.056197 83.45288       6.141746 83.52701       8.923382 83.38615       8.466125 82.47610 4.456370 82.43801 4.228384 0.3808594E-01  6.143164 
1 1 1 -10 11 32 o 70.88196 3.123268 61.50114       5.381625 66.65129       7.958084 57.16126       7.305285 73.62612 4.456343 68.16815 4.421493 5.457970       6.277627 
1 1 1 -10 11 33 o 97.66808 3.002268 116.6685       7.137107 111.5432       10.27226 121.4518       9.923553 95.28207 4.436215 99.49120 4.101841 -4.209129      6.041946 
1 1 1 -10 11 34 o 59.94920 3.716438 44.17216       5.402635 47.18417       8.691514 42.27553       6.896961 61.58454 5.862074 58.45614 4.886288 3.128395       7.631496 
1 1 1 -10 11 35 o 111.2890 3.060185 151.6275       8.291322 145.2545       11.73558 157.9790       11.71585 108.6368 4.442306 113.3503 4.248978 -4.713493      6.147186 
1 1 1 -10 11 36 o 148.5399 3.785703 271.0080       13.69215 258.2641       16.58870 298.2475       24.25269 144.6850 4.711205 154.6694 6.448716 -9.984344      7.986325 
1 1 1 -10 11 37 o 26.94193 6.187398 9.410148       3.976544 12.76936       5.602769 6.000309       5.644831 31.21650 7.465926 22.96570 8.102174 8.250805       11.01750 
1 1 1 -10 11 38 o 49.08368 5.931982 30.60386       6.951584 38.13572       11.71057 26.50565       8.638207 53.43448 9.332772 44.80952 8.213323 8.624958       12.43219 
1 1 1 -10 11 39 o 122.4442 3.112968 184.6340       9.281043 181.7116       13.20254 187.4890       13.04955 120.7797 4.493505 122.7601 4.369135 -1.980362      6.267450 
1 1 1 -10 11 40 o 16.95270 6.437966 2.806771       3.667469 0.6972705      5.060150 5.141118       5.322997 16.74580 7.113471 21.29648 7.821532 -4.550680      10.57250 
1 1 1 -10 11 41 o 61.90916 3.471365 47.80978       5.216129 43.17132       7.353399 52.50755       7.400264 57.95131 5.264405 64.24669 4.760549 -6.295383      7.097660 
1 1 1 -10 11 42 f 21.25949 6.520951 6.122287       3.699605 2.192607       5.042766 10.70276       5.444344 17.61727 7.263523 27.38108 7.789421 -9.763813      10.65053 
1 1 1 -10 11 43 o 14.27903 6.159008 0.4100100      3.900785 3.188023       5.810832 -1.868771      5.262868 18.93868 7.801563 14.64839 6.676588 4.290291       10.26846 
1 1 1 -10 11 44 o 26.01083 6.252264 9.714659       3.913841 3.097745       5.076225 19.41416       6.145932 17.80018 7.307824 36.28081 7.205570 -18.48063      10.26277 
1 1 1 -10 11 45 o 31.67425 5.703902 14.24154       4.240758 19.02578       6.226322 10.10163       5.791893 34.98167 7.527225 24.74262 8.222236 10.23905       11.14739 
1 1 1 -10 11 46 o 13.29849 6.103503 -1.163534      4.499859 1.907654       5.457305 -7.686632      7.953386 16.40925 7.178812 14.41373 7.021951 1.995519       10.04207 
1 1 1 -10 11 47 o 21.02209 6.968881 7.358561       4.161337 9.702000       5.942692 5.103938       5.828992 22.72919 8.277476 18.50121 7.733747 4.227980       11.32817 
1 1 1 -10 11 48 o 16.81523 6.626057 4.396174       3.993094 9.021959       5.967687 0.6461526      5.373165 21.11700 8.163423 14.60310 6.690076 6.513901       10.55455 
1 1 1 -10 11 49 o 15.25552 6.406925 3.226914       4.029148 -3.858916      6.062252 8.833599       5.392519 12.81354 6.216656 20.61429 7.811651 -7.800747      9.983421 
1 1 1 -10 12 1  o 598.8076 7.097822 4373.925       103.5735 4435.975       148.0244 4314.407       144.9733 602.6946 10.07859 594.3881 10.00879 8.306458       14.20401 
1 1 1 -10 12 2  o 528.2047 6.916007 3403.061       89.02127 3308.385       138.1019 3470.367       116.4415 520.3989 10.88998 533.2115 8.961322 -12.81256      14.10308 
1 1 1 -10 12 3  o 188.6892 3.068664 433.9003       14.11018 435.9182       22.67939 432.6260       18.02317 189.0325 4.927528 188.3995 3.925683 0.6329651      6.300121 
1 1 1 -10 12 4  o 641.1748 8.298990 5016.677       129.6695 4839.851       200.2870 5144.277       170.1398 629.0708 13.06524 648.9440 10.75877 -19.87323      16.92488 
1 1 1 -10 12 5  o 584.7841 8.511741 4173.441       121.2970 4171.696       171.5101 4175.187       171.5696 584.1920 12.04753 584.4364 12.04667 -0.2444458     17.03717 
1 1 1 -10 12 6  o 389.3781 5.239346 1848.495       49.71469 1884.961       79.87673 1825.436       63.51649 393.0136 8.340203 386.8637 6.737401 6.149872       10.72155 
1 1 1 -10 12 7  f 585.2382 7.608038 4178.829       108.5029 4258.180       174.0130 4128.353       138.7866 590.1633 12.09967 581.4364 9.795110 8.726868       15.56747 
1 1 1 -10 12 8  o 102.5780 2.499213 128.2271       6.247316 131.6210       10.55839 126.3988       7.749435 103.8285 4.181521 101.7917 3.127787 2.036827       5.221893 
1 1 1 -10 12 9  o 182.1694 3.821996 404.4995       16.96688 419.3983       30.53605 397.8455       20.40693 185.2972 6.773910 180.5895 4.640975 4.707718       8.211243 
1 1 1 -10 12 10 o 490.0782 8.314305 2931.898       99.29502 2856.938       169.6876 2970.932       122.4481 482.6517 14.44339 493.0986 10.19019 -10.44690      17.67629 
1 1 1 -10 12 11 o 318.9579 6.936456 1241.317       53.91468 0.000000       0.000000 1241.317       53.91468 ?        ?        318.9579 6.936456 0.000000       6.936456 
1 1 1 -10 12 12 o 347.1888 6.114104 1470.483       51.72907 1414.134       88.22047 1500.008       63.85914 339.8895 10.66432 350.5528 7.475385 -10.66330      13.02341 
1 1 1 -10 12 13 o 441.3741 6.553204 2377.332       70.48499 2311.901       98.30407 2446.561       101.1171 434.9216 9.275223 447.4088 9.274361 -12.48718      13.11654 
1 1 1 -10 12 14 o 236.1400 3.935341 679.8573       22.64582 676.4719       32.45149 683.0709       31.61687 235.4727 5.655331 236.6276 5.482988 -1.154938      7.876924 
1 1 1 -10 12 15 f 396.7578 5.962591 1921.173       57.64963 1886.490       81.05193 1956.685       82.01438 392.8343 8.466772 400.0846 8.412055 -7.250305      11.93520 
1 1 1 -10 12 16 o 116.0466 2.829875 164.1545       8.002687 171.4878       11.97552 158.2373       10.75727 118.5093 4.153149 113.8489 3.883052 4.660416       5.685661 
1 1 1 -10 12 17 o 205.5650 4.150277 515.4061       20.79038 496.8920       25.44366 552.6028       36.06462 201.7154 5.180409 212.5421 6.972499 -10.82671      8.686334 
1 1 1 -10 12 18 o 363.8433 5.535753 1616.381       49.08256 1602.510       69.44785 1630.224       69.37863 361.8918 7.874880 365.0223 7.799562 -3.130463      11.08363 
1 1 1 -10 12 19 o 169.0772 3.224883 348.6029       13.28725 359.4608       19.49251 339.1785       18.16017 171.5504 4.667064 166.6533 4.475723 4.897110       6.466342 
1 1 1 -10 12 20 o 206.2393 3.610914 518.8635       18.14783 532.0153       26.42903 507.1299       24.96345 208.7071 5.196463 203.7832 5.026899 4.923965       7.230003 
1 1 1 -10 12 21 o 305.2827 5.530705 1139.014       41.14516 1153.676       51.26825 1112.483       68.96732 306.9921 6.853070 300.6964 9.423571 6.295715       11.65196 
1 1 1 -10 12 22 o 246.9027 4.774550 744.6224       28.72727 745.9211       35.32104 742.0845       49.37497 246.9615 5.869056 245.7404 8.256794 1.221085       10.13018 
1 1 1 -10 12 23 o 108.9922 4.029729 145.2183       10.68461 152.2906       14.69288 137.2811       15.56550 111.4729 5.425097 105.7437 6.065949 5.729263       8.138023 
1 1 1 -10 12 24 o 183.0681 3.408098 408.9661       15.20411 407.7190       21.91180 410.1241       21.11409 182.5726 4.929512 183.1381 4.735022 -0.5654449     6.835241 
1 1 1 -10 12 25 o 107.6066 2.860228 141.3525       7.493595 125.4816       10.67167 156.7899       10.52494 101.2518 4.335108 113.2538 3.819026 -12.00199      5.777380 
1 1 1 -10 12 26 o 190.5894 3.492695 443.4472       16.22166 437.3308       23.25885 449.2402       22.63563 189.0043 5.054410 191.5978 4.851942 -2.593445      7.006311 
1 1 1 -10 12 27 o 50.04567 3.362034 30.71426       4.076408 27.15712       6.149328 33.50281       5.444611 46.77004 5.500436 52.17490 4.320934 -5.404861      6.994660 
1 1 1 -10 12 28 o 87.28242 4.186656 93.34851       8.878959 103.9264       15.23275 87.90521       10.92723 91.69038 6.867282 84.54260 5.331080 7.147774       8.693675 
1 1 1 -10 12 29 o 87.16576 4.613619 93.24948       9.765046 95.54991       14.68808 91.42730       13.07241 87.84753 6.916953 86.04223 6.277788 1.805305       9.341030 
1 1 1 -10 12 30 o 104.8505 2.977972 134.3340       7.601284 125.9848       10.95693 142.0805       10.55406 101.3567 4.446914 107.7085 4.028093 -6.351761      6.000048 
1 1 1 -10 12 31 o 184.1676 3.492249 414.5714       15.67308 425.1992       22.80301 405.0550       21.57787 186.1322 5.031915 181.7061 4.877483 4.426056       7.007853 
1 1 1 -10 12 32 o 27.29620 5.923120 9.520335       3.826508 13.86914       5.489014 5.408795       5.337180 32.88789 7.060045 22.28964 7.876983 10.59825       10.57786 
1 1 1 -10 12 33 o 114.8917 3.029921 161.4359       8.475721 163.3315       12.45363 159.8002       11.56824 115.3201 4.439838 114.1188 4.166808 1.201225       6.088880 
1 1 1 -10 12 34 o 57.01821 3.920317 40.03314       5.414019 36.33250       8.640379 42.42530       6.946884 53.73684 6.746501 58.53405 4.915551 -4.797215      8.347330 
1 1 1 -10 12 35 o 57.29234 3.575997 40.38412       4.967741 43.11497       7.179595 37.87583       6.880820 58.93169 5.047938 55.18062 5.177503 3.751072       7.231060 
1 1 1 -10 12 36 o 36.23627 5.529981 16.62610       4.728739 19.64779       5.770597 10.44920       8.250513 39.27678 6.237316 29.17704 9.815528 10.09973       11.62965 
1 1 1 -10 12 37 o 65.14014 4.149306 52.53577       6.552345 62.39890       13.32519 49.39038       7.524944 69.60775 8.000932 62.94047 4.945813 6.667282       9.406167 
1 1 1 -10 12 38 o 93.75769 3.051731 108.1198       6.963223 115.2647       10.12403 101.7055       9.592428 96.36058 4.322400 90.48827 4.362966 5.872314       6.141548 
1 1 1 -10 12 39 o 45.22031 3.973601 25.54982       4.334306 21.94320       6.039367 29.38042       6.224072 41.13767 6.218299 48.03403 5.411333 -6.896362      8.243165 
1 1 1 -10 12 40 o 63.30779 4.023002 50.17608       6.174346 48.97403       12.70467 50.54778       7.064759 59.50333 9.046146 63.27894 4.613128 -3.775612      10.15449 
1 1 1 -10 12 41 o 24.80716 6.332767 8.355035       3.840883 11.91482       5.342607 4.547112       5.525674 29.23658 7.471713 20.50922 7.874409 8.727367       10.85508 
1 1 1 -10 12 42 f 19.21236 6.629079 4.755914       3.766963 2.524530       5.248903 7.125755       5.409297 18.04241 7.421721 22.85619 7.940871 -4.813787      10.86919 
1 1 1 -10 12 43 o 15.74796 6.584646 1.598926       4.227226 11.08022       6.828465 -4.292395      5.382643 26.69472 8.929074 13.42818 6.331265 13.26654       10.94593 
1 1 1 -10 12 44 o 38.90737 4.813193 20.32704       4.466312 20.06540       6.127369 20.62364       6.523901 36.78966 7.091684 36.91353 7.508380 -0.1238708     10.32801 
1 1 1 -10 12 45 o 36.97917 5.150134 18.93387       4.515249 17.74611       6.578489 19.99182       6.208605 32.78045 8.244327 35.92663 7.339819 -3.146175      11.03820 
1 1 1 -10 12 46 o 17.06570 7.382044 2.797580       5.635481 2.797580       5.635481 0.000000       0.000000 17.06570 7.382044 ?        ?        0.000000       7.382044 
1 1 1 -10 12 47 o 21.65446 6.999639 7.968081       4.210018 10.88169       6.208829 5.488328       5.727933 23.49861 8.474365 18.60180 7.712088 4.896812       11.45824 
1 1 1 -10 12 48 o 16.58388 6.462849 4.317145       3.763498 4.495069       5.573309 4.168008       5.102569 17.14815 7.378904 16.76263 7.132749 0.3855209      10.26276 
1 1 1 -10 12 49 o 20.43656 7.093812 7.982183       4.316352 10.01848       6.399107 6.282275       5.846713 20.78701 8.323772 17.98846 7.644053 2.798544       11.30118 
1 1 1 -10 13 1  f 81.83839 2.772388 81.71532       5.521025 84.63226       10.34905 80.55489       6.527486 83.15627 5.132049 81.23132 3.304409 1.924950       6.103855 
1 1 1 -10 13 2  o 375.3831 4.646148 1717.874       42.50146 1758.701       61.08765 1679.569       59.17047 379.7127 6.601798 371.0754 6.543449 8.637268       9.295184 
1 1 1 -10 13 3  o 848.2263 10.88603 8792.473       225.0181 8882.672       358.4887 8733.832       289.0529 850.6588 17.29354 844.5666 14.04453 6.092163       22.27814 
1 1 1 -10 13 4  o 308.7931 4.864634 1162.514       36.60614 1186.188       52.40115 1139.950       51.15899 311.8283 6.895872 305.6918 6.867552 6.136475       9.732231 
1 1 1 -10 13 5  o 566.1072 7.383687 3910.238       101.8610 3913.631       161.2535 3907.985       131.3951 565.7639 11.69601 565.6840 9.531672 0.7989502E-01  15.08806 
1 1 1 -10 13 6  o 212.1739 4.196063 548.7669       21.69552 540.0702       37.53012 553.1318       26.58836 210.2601 7.335891 212.9922 5.122614 -2.732147      8.947429 
1 1 1 -10 13 7  o 180.0325 3.810427 395.0725       16.71709 363.5218       28.26094 412.0542       20.73345 172.4919 6.736240 183.7856 4.633086 -11.29372      8.175721 
1 1 1 -10 13 8  o 465.3228 7.929083 2642.894       89.91112 2610.486       155.0006 2659.329       110.3791 461.4348 13.79987 466.5624 9.708246 -5.127563      16.87266 
1 1 1 -10 13 9  o 458.1715 7.819182 2562.415       87.30227 2512.271       149.9884 2588.107       107.3636 452.6337 13.61346 460.2550 9.572436 -7.621307      16.64205 
1 1 1 -10 13 10 o 297.2808 4.188097 1077.416       30.34029 1016.716       46.76476 1121.537       39.87047 288.6626 6.648017 303.2507 5.395272 -14.58817      8.561840 
1 1 1 -10 13 11 o 339.6687 6.017519 1407.551       49.80914 1379.133       85.91460 1421.939       61.13102 335.6256 10.51749 341.2946 7.350150 -5.668915      12.83130 
1 1 1 -10 13 12 o 98.90379 3.409343 119.3825       8.204835 130.8666       10.97983 104.8607       12.34688 103.5067 4.362808 92.55273 5.499134 10.95395       7.019585 
1 1 1 -10 13 13 o 144.6383 3.070742 255.0044       10.82337 248.4948       15.85063 260.6911       14.81492 142.6726 4.564878 146.1583 4.163732 -3.485672      6.178574 
1 1 1 -10 13 14 o 446.3740 6.633080 2432.849       72.15231 2389.384       101.3521 2477.511       102.7395 441.8996 9.411812 449.9837 9.369248 -8.084076      13.28025 
1 1 1 -10 13 15 o 267.7932 4.325603 874.6614       28.22814 846.8907       39.65340 903.1936       40.19331 263.3706 6.178415 271.9946 6.063975 -8.623993      8.657056 
1 1 1 -10 13 16 o 144.2079 3.498323 253.5742       12.29377 257.9203       15.73303 246.7597       19.70054 145.3376 4.447434 142.0564 5.702493 3.281235       7.231742 
1 1 1 -10 13 17 o 120.6887 2.880884 177.5771       8.472833 181.1858       12.62391 174.6189       11.42969 121.7935 4.259934 119.5857 3.927429 2.207779       5.794112 
1 1 1 -10 13 18 o 350.9163 5.377442 1503.815       45.98492 1465.594       64.40200 1543.570       65.68188 346.0312 7.637443 355.1271 7.589718 -9.095917      10.76728 
1 1 1 -10 13 19 o 271.7011 4.387967 900.9988       29.05300 867.5381       40.55743 936.2665       41.63816 266.3769 6.247953 276.7384 6.174274 -10.36151      8.783996 
1 1 1 -10 13 20 o 210.2587 3.668954 539.3675       18.79889 537.4399       27.00096 541.1808       26.18892 209.6681 5.288805 210.4823 5.105825 -0.8142242     7.351253 
1 1 1 -10 13 21 o 70.17553 3.624788 60.24764       6.177747 66.65800       7.710015 48.75089       10.32528 73.76623 4.307801 62.72705 6.866854 11.03917       8.106222 
1 1 1 -10 13 22 o 244.4529 4.774338 730.0323       28.44098 700.5388       33.97658 799.0792       51.98622 239.3099 5.826166 254.9202 8.379892 -15.61034      10.20621 
1 1 1 -10 13 23 o 132.1151 3.318743 213.1009       10.67624 216.3033       18.80242 211.5771       12.96985 132.8290 5.822926 131.5768 4.049831 1.252228       7.092785 
1 1 1 -10 13 24 o 205.2326 3.647056 514.1705       18.24000 507.5100       26.12170 520.5081       25.48075 203.6260 5.268623 206.3150 5.068103 -2.689011      7.310544 
1 1 1 -10 13 25 o 215.5113 3.763879 567.1390       19.76705 544.7026       27.79129 590.1115       28.12129 210.8929 5.412148 219.6067 5.254768 -8.713867      7.543470 
1 1 1 -10 13 26 o 97.15997 2.878342 115.2840       6.807487 117.9091       10.15193 113.1391       9.176308 98.13006 4.255437 96.15674 3.924331 1.973320       5.788706 
1 1 1 -10 13 27 o 63.50358 3.542140 49.40230       5.459786 45.22853       7.220696 54.97424       8.342922 60.59222 4.932833 66.80933 5.164491 -6.217110      7.141765 
1 1 1 -10 13 28 o 79.90063 4.864781 78.44576       9.427283 90.28445       14.75274 70.27499       12.25610 85.34688 7.159230 75.30362 6.750369 10.04326       9.839820 
1 1 1 -10 13 29 o 228.7220 3.944565 639.6147       21.98584 632.7991       31.32079 646.2354       30.86947 227.0869 5.659845 229.5249 5.519036 -2.438034      7.905290 
1 1 1 -10 13 30 o 127.7630 3.044696 199.3449       9.479492 208.3243       14.13423 192.0038       12.77990 130.3648 4.455685 125.1913 4.194991 5.173447       6.119729 
1 1 1 -10 13 31 o 139.0915 3.154831 236.3715       10.69333 241.2891       15.59780 232.0105       14.68843 140.2478 4.569952 137.5584 4.387407 2.689331       6.335124 
1 1 1 -10 13 32 o 69.90932 3.220438 59.86760       5.471644 63.33250       8.165952 57.04440       7.371097 71.69819 4.699626 68.06741 4.468536 3.630775       6.484929 
1 1 1 -10 13 33 o 77.84045 3.448272 74.27954       6.524748 64.50073       10.73310 80.01166       8.217497 72.02288 6.174840 80.67896 4.194081 -8.656075      7.464514 
1 1 1 -10 13 34 o 79.78766 3.216491 78.02917       6.241127 81.56439       9.263073 75.09013       8.445982 81.31017 4.694883 78.05378 4.458930 3.256386       6.474874 
1 1 1 -10 13 35 o 12.76221 5.840058 -2.719548      4.079017 -5.229586      5.157565 1.472640       6.665380 13.32618 6.256372 19.97911 8.304303 -6.652931      10.39729 
1 1 1 -10 13 36 o 32.28470 6.533715 13.47578       4.963698 22.66508       9.973082 10.44990       5.722873 41.08714 10.04595 28.31749 7.962486 12.76965       12.81883 
1 1 1 -10 13 37 o 79.65695 3.592522 78.25481       6.955687 78.20633       8.755779 78.33773       11.45194 79.34638 4.547306 78.85912 6.004382 0.4872665      7.531971 
1 1 1 -10 13 38 o 31.91075 5.263369 13.05390       3.950383 16.86634       5.636959 9.374491       5.537733 35.90791 6.687994 26.65217 7.936401 9.255737       10.37862 
1 1 1 -10 13 39 o 24.14332 6.333797 7.731686       3.772187 9.075094       5.339753 6.393371       5.329619 26.03815 7.802702 22.76048 7.883554 3.277664       11.09200 
1 1 1 -10 13 40 o 55.72687 4.251096 39.14918       5.729431 47.13277       12.14321 36.86296       6.498207 58.21630 8.836862 53.71282 5.022795 4.503479       10.16458 
1 1 1 -10 13 41 o 14.13694 5.970071 0.6707312      3.529364 2.171068       4.958223 -0.8702878     5.024995 17.57221 7.219193 15.22454 6.764318 2.347664       9.893065 
1 1 1 -10 13 42 o 32.12098 6.107472 14.13986       4.605968 10.96044       7.296918 16.24573       5.938564 26.96873 9.229115 33.64364 7.441016 -6.674910      11.85518 
1 1 1 -10 13 43 o 17.60192 6.566487 3.812066       3.778103 1.568456       5.522179 5.786459       5.180284 17.08844 7.348993 20.67339 7.693601 -3.584953      10.63951 
1 1 1 -10 13 44 o 27.93789 6.404060 11.45673       4.266595 12.26905       5.924512 10.58152       6.149531 27.43780 8.218082 25.33733 8.473534 2.100466       11.80414 
1 1 1 -10 13 45 o 58.39817 3.935218 44.88295       5.567509 42.98989       7.920854 46.73154       7.827274 54.49462 6.067385 57.39037 5.670784 -2.895744      8.304875 
1 1 1 -10 13 46 o 22.11119 8.235128 8.782135       5.937435 8.782135       5.937435 0.000000       0.000000 22.11119 8.235128 ?        ?        0.000000       8.235128 
1 1 1 -10 13 47 o 22.94157 6.855985 8.956154       4.126879 11.44334       6.083591 6.835942       5.616884 23.88441 8.412464 19.54938 7.808467 4.335030       11.47788 
1 1 1 -10 13 48 o 13.38637 5.978291 0.9361464      3.977411 -4.020411      5.949000 4.942714       5.348600 12.77884 6.189996 17.31401 7.332360 -4.535178      9.595810 
1 1 1 -10 13 49 o 12.72546 5.772775 0.4926927      3.876909 -1.326211      5.752217 2.006677       5.247966 13.41182 6.387774 14.79344 6.713078 -1.381616      9.266557 
1 1 1 -10 14 1  o 471.4149 6.949235 2711.738       79.83189 2636.342       110.8042 2793.119       115.1180 464.4814 9.789304 478.0797 9.881136 -13.59833      13.90925 
1 1 1 -10 14 2  o 189.8661 3.900138 439.4376       18.04528 417.4554       30.30998 451.5074       22.45943 184.8511 6.739927 192.4339 4.789401 -7.582733      8.268312 
1 1 1 -10 14 3  o 389.4957 5.852843 1850.331       55.55277 1912.352       80.20062 1793.129       77.02266 395.7664 8.315774 383.2376 8.247348 12.52887       11.71200 
1 1 1 -10 14 4  o 523.0342 10.85248 3344.843       138.3233 3312.668       194.0683 3378.067       197.2067 519.3902 15.34976 524.4706 15.44678 -5.080444      21.77654 
1 1 1 -10 14 5  o 246.7433 4.664488 742.3012       28.04694 708.8313       47.48910 760.2290       34.75602 240.8225 8.103632 249.6645 5.712645 -8.841934      9.914795 
1 1 1 -10 14 6  o 65.46068 3.419107 52.37275       5.435271 56.88513       9.642328 50.27120       6.580332 68.03929 5.872918 64.07525 4.238074 3.964043       7.242405 
1 1 1 -10 14 7  o 68.86443 2.794584 57.89202       4.679992 48.23750       7.792527 63.33896       5.853144 62.68311 5.146715 72.00907 3.344675 -9.325958      6.138040 
1 1 1 -10 14 8  o 110.2050 2.607732 148.0159       7.003263 146.1361       11.60958 149.0913       8.780794 109.3936 4.363759 110.5494 3.262999 -1.155800      5.448812 
1 1 1 -10 14 9  o 184.4365 3.052385 414.6152       13.71900 398.2520       21.75154 425.4243       17.67877 180.6438 4.945836 186.8059 3.883517 -6.162064      6.288322 
1 1 1 -10 14 10 o 387.6507 5.235981 1832.935       49.46235 1784.461       77.28354 1866.567       64.37348 382.1850 8.298074 391.0535 6.755145 -8.868561      10.70000 
1 1 1 -10 14 11 o 320.5994 4.980249 1253.674       38.90899 1204.488       76.75848 1270.682       45.13782 313.5855 10.05765 322.7117 5.739708 -9.126190      11.58018 
1 1 1 -10 14 12 o 153.6542 3.153339 287.8018       11.80731 285.8536       17.35574 289.4805       16.10990 153.0210 4.659745 154.0116 4.296629 -0.9906006     6.338315 
1 1 1 -10 14 13 o 244.6685 4.070240 730.0061       24.26801 730.0623       34.93243 729.9537       33.73897 244.5678 5.861292 244.5639 5.661134 0.3921509E-02  8.148815 
1 1 1 -10 14 14 o 149.6416 3.525776 273.0323       12.85711 281.4156       23.49609 269.4492       15.36093 151.6690 6.371343 148.5726 4.247060 3.096390       7.657123 
1 1 1 -10 14 15 o 200.4503 4.112497 490.0939       20.08854 503.4229       36.66072 484.3744       24.01482 202.7803 7.431465 199.2301 4.946389 3.550125       8.927118 
1 1 1 -10 14 16 o 221.8533 4.401910 600.5249       23.79815 594.8431       29.53731 611.0376       40.17740 220.7175 5.491590 223.3889 7.390646 -2.671402      9.207562 
1 1 1 -10 14 17 o 113.3601 2.891359 156.7818       7.980747 158.6678       12.04062 155.3039       10.65833 113.9471 4.344160 112.7645 3.884453 1.182625       5.827581 
1 1 1 -10 14 18 o 199.6826 3.571202 486.3801       17.37764 496.3354       25.36344 477.5721       23.85706 201.5259 5.168919 197.7017 4.955791 3.824234       7.160837 
1 1 1 -10 14 19 o 266.4450 4.328746 866.5885       28.10644 880.8027       40.63317 853.5482       38.91922 268.3624 6.213309 264.2043 6.044887 4.158112       8.668672 
1 1 1 -10 14 20 o 249.5741 4.830273 760.8161       29.37699 777.7779       36.50938 729.6661       49.47621 252.1811 5.940949 243.6754 8.344298 8.505661       10.24315 
1 1 1 -10 14 21 o 84.75163 3.517300 87.79293       7.248508 81.47880       8.724759 101.8617       13.02342 81.56622 4.405771 91.06322 5.900521 -9.497002      7.363896 
1 1 1 -10 14 22 o 114.9015 3.226387 161.1971       9.025015 147.4130       15.48726 168.2848       11.10552 109.6112 5.818923 117.3482 3.888899 -7.737068      6.998815 
1 1 1 -10 14 23 o 101.1008 2.865828 124.7814       7.053463 126.7122       10.47484 123.1796       9.540679 101.7661 4.233093 100.3661 3.908293 1.399956       5.761408 
1 1 1 -10 14 24 o 118.8282 3.339271 172.4685       9.659985 166.8140       12.37835 181.2762       15.44884 116.7610 4.358044 121.6151 5.225006 -4.854095      6.803913 
1 1 1 -10 14 25 o 65.07266 3.045698 51.78547       4.816315 56.83705       7.277560 47.84873       6.424518 68.04880 4.412423 62.43074 4.248160 5.618053       6.125059 
1 1 1 -10 14 26 o 63.43504 3.167564 49.24000       4.881065 53.72983       7.417013 45.81010       6.482684 66.11861 4.632613 61.05586 4.386267 5.062752       6.379690 
1 1 1 -10 14 27 o 186.2886 4.978405 425.1886       22.57996 425.1383       34.19696 425.2275       30.06614 185.6062 7.576571 185.8966 6.647676 -0.2904053     10.07948 
1 1 1 -10 14 28 o 129.9511 3.065090 206.1762       9.706424 221.9869       14.75327 194.1092       12.88878 134.6110 4.503848 125.9099 4.206550 8.701065       6.162768 
1 1 1 -10 14 29 o 84.11114 3.059723 86.50344       6.261055 93.50768       9.476624 81.07772       8.340688 87.28673 4.470109 81.29534 4.224669 5.991386       6.150585 
1 1 1 -10 14 30 o 22.63494 6.288606 6.492534       3.592655 0.2570212      5.508977 11.10694       4.739065 17.55717 7.438680 29.44179 6.749723 -11.88462      10.04454 
1 1 1 -10 14 31 o 147.6107 3.218668 266.2970       11.57790 257.8048       16.73030 274.1017       16.03884 144.9035 4.744328 149.4954 4.407411 -4.591904      6.475640 
1 1 1 -10 14 32 o 114.1504 3.058602 159.3702       8.500509 152.4852       12.39768 165.4787       11.67767 111.3931 4.576907 116.1392 4.132704 -4.746124      6.166630 
1 1 1 -10 14 33 o 64.57354 3.711786 51.24247       5.816207 53.06875       9.982379 50.30385       7.156427 65.19209 6.364482 63.82549 4.632681 1.366604       7.871999 
1 1 1 -10 14 34 o 72.30135 3.320683 64.14838       5.835105 79.86019       8.860901 52.11785       7.753667 80.45571 4.537837 64.85835 4.942979 15.59737       6.710068 
1 1 1 -10 14 35 o 102.8805 4.825120 130.9110       12.06329 131.7496       18.24513 130.2597       16.07948 102.2080 7.374904 102.0097 6.502207 0.1982269      9.831984 
1 1 1 -10 14 36 o 90.92787 3.100873 101.5264       6.860902 102.4558       9.907034 100.6699       9.510661 90.96170 4.483210 90.20933 4.339089 0.7523727      6.239140 
1 1 1 -10 14 37 o 83.81806 3.593708 86.72549       7.323292 83.76220       9.288509 91.59360       11.90526 82.00674 4.667208 85.29003 5.761834 -3.283295      7.414955 
1 1 1 -10 14 38 o 68.29630 3.306419 57.64941       5.486544 56.49102       7.871372 58.74401       7.651585 67.06256 4.849281 68.49015 4.611326 -1.427589      6.691775 
1 1 1 -10 14 39 o 56.93928 3.654043 40.40049       5.043399 55.59421       7.638969 28.66024       6.714930 66.34560 4.756392 47.00382 5.998881 19.34179       7.655706 
1 1 1 -10 14 40 o 43.10037 4.899911 23.86696       5.055170 20.42570       10.44924 24.91848       5.776097 36.51804 10.90850 43.74575 5.542513 -7.227707      12.23580 
1 1 1 -10 14 41 o 13.44009 5.882633 -0.2686408     3.668346 -3.823141      5.310553 2.975265       5.073230 13.79008 6.433174 18.33404 7.387167 -4.543958      9.795711 
1 1 1 -10 14 42 o 14.55997 6.244361 0.6356110      3.966258 0.9521118      6.604988 0.4571204      4.960122 18.02169 7.890622 15.78863 6.876779 2.233068       10.46671 
1 1 1 -10 14 43 o 35.96191 5.008880 17.43774       4.270586 21.71578       6.199603 13.57471       5.891231 38.72768 6.818014 29.50619 7.995730 9.221491       10.50795 
1 1 1 -10 14 44 o 39.50430 4.649313 21.03264       4.390182 23.80375       6.419177 18.59743       6.017574 40.00928 6.828784 34.78320 7.330838 5.226078       10.01866 
1 1 1 -10 14 45 o 13.18499 5.888408 -0.7972553E-01 3.858799 -3.571702      5.436652 3.465460       5.477915 13.22250 6.272434 17.61650 7.438509 -4.393992      9.730100 
1 1 1 -10 14 46 o 18.73228 7.216330 5.564741       4.651563 2.021439       5.658936 12.94610       8.167683 16.18818 7.186192 24.37974 9.515170 -8.191565      11.92392 
1 1 1 -10 14 47 o 15.85071 6.527737 3.426919       4.066724 2.419290       5.962690 4.303282       5.560757 16.09305 7.242873 17.19162 7.383721 -1.098566      10.34304 
1 1 1 -10 14 48 o 17.34685 6.674839 5.155987       3.976409 11.00675       6.114940 0.8692203      5.234206 22.26638 8.344338 14.32261 6.576925 7.943769       10.62468 
1 1 1 -10 15 1  o 212.1152 3.297890 548.4349       17.04685 545.5692       26.57297 550.4390       22.22205 211.4987 5.155804 212.4727 4.291854 -0.9739838     6.708377 
1 1 1 -10 15 2  o 532.7120 7.793499 3465.381       101.1722 3405.635       141.5093 3527.854       144.7022 527.5206 11.00803 536.8917 11.05993 -9.371094      15.60445 
1 1 1 -10 15 3  o 195.6309 5.034652 467.0522       23.98181 465.8905       33.25757 468.3104       34.61389 195.2438 7.001333 195.7277 7.269714 -0.4838562     10.09294 
1 1 1 -10 15 4  o 363.8571 4.974272 1614.570       44.10588 1702.641       72.47597 1562.770       55.58334 373.3875 7.965228 357.8697 6.373583 15.51773       10.20134 
1 1 1 -10 15 5  o 142.3961 3.086773 247.1465       10.71122 237.3399       15.33141 256.4974       14.97092 139.4415 4.517807 144.9804 4.241997 -5.538879      6.197186 
1 1 1 -10 15 6  o 273.1350 3.952426 909.5300       26.30736 933.0777       42.67747 895.0990       33.40974 276.5203 6.333382 270.9084 5.060747 5.611877       8.106965 
1 1 1 -10 15 7  o 380.7934 5.167370 1768.645       47.95071 1782.446       76.58775 1759.747       61.49482 381.9688 8.228020 379.7041 6.645950 2.264709       10.57681 
1 1 1 -10 15 8  o 508.6398 6.697558 3158.145       83.01621 3417.542       138.6933 3013.324       103.6306 528.3404 10.77223 496.5488 8.564264 31.79163       13.76181 
1 1 1 -10 15 9  o 224.7535 3.446492 615.8078       18.87643 598.4752       29.89530 627.2999       24.34277 221.4073 5.545195 226.8036 4.404373 -5.396286      7.081503 
1 1 1 -10 15 10 o 134.0764 3.007591 219.1265       9.826688 236.3038       21.72996 214.7106       11.01761 138.9791 6.433587 132.6667 3.410748 6.312393       7.281774 
1 1 1 -10 15 11 o 304.6635 4.292816 1132.012       31.87123 1122.970       50.57682 1137.967       41.04634 303.2269 6.844594 305.3715 5.515818 -2.144531      8.790489 
1 1 1 -10 15 12 o 294.3867 4.181094 1056.962       29.99468 993.7249       46.24840 1102.872       39.40619 285.2350 6.653617 300.6179 5.379148 -15.38287      8.556043 
1 1 1 -10 15 13 o 176.8073 3.937650 381.2506       16.96576 372.3840       20.87599 398.4984       29.11615 174.6254 4.910604 180.4876 6.631158 -5.862198      8.251442 
1 1 1 -10 15 14 o 239.3295 4.020404 698.6571       23.44779 673.0884       33.03638 724.6126       33.28539 234.7756 5.774353 243.6112 5.606866 -8.835602      8.048609 
1 1 1 -10 15 15 o 58.02523 4.379601 41.31506       6.147091 51.70472       10.66457 36.14574       7.522455 64.66954 6.872281 54.09172 5.797122 10.57782       8.990822 
1 1 1 -10 15 16 o 228.7191 3.904192 638.1918       21.76054 653.3697       31.78010 624.7945       29.85787 231.2667 5.639050 226.1756 5.417228 5.091171       7.819542 
1 1 1 -10 15 17 o 83.16130 2.928029 84.43459       5.924539 93.55064       9.324033 78.26193       7.672494 87.43806 4.389941 79.99114 3.948232 7.446915       5.904245 
1 1 1 -10 15 18 o 288.6007 4.611737 1016.969       32.43382 1028.595       46.76933 1006.198       45.01751 289.9253 6.619709 286.7840 6.441549 3.141235       9.236564 
1 1 1 -10 15 19 o 251.0745 4.874847 770.0279       29.82632 721.4564       35.31994 890.7629       55.68596 242.8745 5.967631 269.2201 8.498581 -26.34563      10.38453 
1 1 1 -10 15 20 o 102.0204 3.512155 127.1455       8.718634 123.2516       10.69202 134.8729       15.06198 100.3711 4.381902 104.8366 5.919718 -4.465492      7.365061 
1 1 1 -10 15 21 o 139.2603 3.047130 236.5678       10.34081 252.1264       15.67408 224.5766       13.76033 143.6021 4.484537 135.5540 4.170590 8.048172       6.124124 
1 1 1 -10 15 22 o 240.5865 4.615955 707.2831       27.06256 671.4540       45.78473 726.5231       33.55095 233.5960 8.055075 243.6631 5.650396 -10.06718      9.839269 
1 1 1 -10 15 23 o 91.30959 2.868865 101.8101       6.375633 102.2949       9.727915 101.4450       8.441352 91.39426 4.380574 91.06920 3.812114 0.3250580      5.807034 
1 1 1 -10 15 24 o 199.1383 3.613630 484.1960       17.53616 513.1274       26.17899 460.6483       23.61802 204.6978 5.252456 193.9873 5.000303 10.71054       7.251987 
1 1 1 -10 15 25 o 200.7098 5.258944 493.5461       25.69975 493.5461       25.69975 0.000000       0.000000 200.7098 5.258944 ?        ?        0.000000       5.258944 
1 1 1 -10 15 26 o 121.5527 3.440801 180.5742       10.18176 187.9682       13.39459 170.4546       15.67005 123.8942 4.443718 117.8178 5.472825 6.076370       7.049713 
1 1 1 -10 15 27 o 73.21680 3.638016 65.65688       6.470666 71.63417       13.48578 63.86922       7.375070 75.90131 7.384294 72.14629 4.213181 3.755028       8.501687 
1 1 1 -10 15 28 f 97.75937 2.997028 116.7905       7.131355 132.6328       10.97202 105.2028       9.383735 104.0233 4.337845 92.64637 4.167006 11.37691       6.015051 
1 1 1 -10 15 29 o 48.99924 3.618713 29.50793       4.290463 34.49505       6.654821 25.96047       5.612683 52.77242 5.244109 45.72858 5.124766 7.043842       7.332387 
1 1 1 -10 15 30 o 56.15282 3.506866 38.69995       4.774781 35.16131       7.171384 41.51780       6.399472 53.19764 5.616592 58.02881 4.562140 -4.831165      7.235968 
1 1 1 -10 15 31 o 107.0702 3.066423 140.2103       7.992620 143.6616       11.89335 137.3680       10.79312 108.1438 4.522995 105.8048 4.194373 2.338997       6.168488 
1 1 1 -10 15 32 o 131.1121 3.525594 210.5347       11.25426 223.7784       19.94904 204.3519       13.63043 134.4969 6.102479 129.0000 4.342134 5.496979       7.489618 
1 1 1 -10 15 33 o 89.06865 3.127060 97.18063       6.776773 91.65656       9.832145 102.1798       9.353377 86.20518 4.698112 91.13612 4.223029 -4.930946      6.317138 
1 1 1 -10 15 34 o 35.30455 4.961367 15.66428       4.150819 18.86006       6.265372 13.16442       5.541367 38.32177 6.965619 31.83455 7.299075 6.487213       10.08942 
1 1 1 -10 15 35 o 76.88811 3.862885 72.87948       7.214624 73.24409       8.781915 72.12249       12.65363 76.86423 4.711076 75.51665 6.954048 1.347588       8.399585 
1 1 1 -10 15 36 o 40.77969 4.783220 20.89215       4.663113 20.16486       6.095366 21.91848       7.240863 39.54681 6.554245 40.94017 7.535374 -1.393360      9.986991 
1 1 1 -10 15 37 o 31.43323 5.009029 12.61506       3.708222 12.34205       5.484252 12.84500       5.033171 30.43401 7.454744 31.21378 6.809018 -0.7797680     10.09633 
1 1 1 -10 15 38 o 94.36297 3.117634 109.9226       7.159227 106.7076       10.34299 112.8798       9.919628 92.26109 4.615008 95.07644 4.292476 -2.815353      6.302670 
1 1 1 -10 15 39 o 22.28302 7.458446 6.400869       4.764281 10.02917       10.24579 5.399913       5.381477 28.20992 10.74934 21.47582 7.868166 6.734097       13.32127 
1 1 1 -10 15 40 o 50.65596 4.025980 32.45482       4.928940 44.55579       7.813746 24.45741       6.352199 58.49317 5.548064 42.81406 6.274541 15.67911       8.375612 
1 1 1 -10 15 41 o 11.38959 5.266931 -2.289088      3.441450 -3.080396      5.301221 -1.712687      4.524447 14.09775 6.525475 13.71896 6.228527 0.3787861      9.020885 
1 1 1 -10 15 42 o 16.89084 6.553877 3.129547       3.857123 2.491209       5.383687 3.802761       5.528800 17.75003 7.427010 19.01039 7.693106 -1.260361      10.69319 
1 1 1 -10 15 43 o 13.84318 5.994843 0.5722370      3.724903 2.072432       5.238910 -0.9615210     5.297190 16.89216 7.208882 14.82988 6.735482 2.062280       9.865835 
1 1 1 -10 15 44 o 23.55222 6.678615 8.482834       4.008756 9.347868       5.689206 7.629838       5.649478 23.71830 8.148197 21.85135 8.052276 1.866955       11.45567 
1 1 1 -10 15 45 o 32.04774 6.569249 15.81724       4.957903 16.58483       6.278495 14.54570       8.080826 30.87930 8.204781 26.57815 9.656341 4.301149       12.67136 
1 1 1 -10 15 46 o 10.93810 5.162498 -2.365199      3.595517 -4.997458      5.457047 -0.3458598     4.779673 12.26336 5.937489 13.74533 6.301836 -1.481972      8.658343 
1 1 1 -10 15 47 o 19.26433 6.564832 6.350961       3.691289 0.6420579E-01  5.818674 10.58503       4.775178 14.54848 6.769164 23.87999 7.423073 -9.331507      10.04607 
1 1 1 -10 15 48 o 13.17765 5.827405 1.221493       3.686380 -2.420604      6.046473 3.376171       4.650692 13.29493 6.389906 15.59276 6.725336 -2.297826      9.276909 
1 1 1 -10 16 1  o 425.9267 5.695130 2213.717       59.11185 2110.137       90.41839 2291.032       78.11768 415.3920 8.932284 433.0787 7.401954 -17.68671      11.60063 
1 1 1 -10 16 2  o 225.5692 3.848453 620.3765       21.15446 654.1529       42.79413 609.4537       24.33578 231.2805 7.603258 223.5487 4.467218 7.731857       8.818480 
1 1 1 -10 16 3  o 241.9773 4.117019 713.9774       24.27692 739.7153       34.99957 690.1116       33.70266 246.2062 5.833477 237.8091 5.815670 8.397156       8.237201 
1 1 1 -10 16 4  o 102.4769 2.682580 128.0841       6.693312 117.4068       10.78333 134.7762       8.536944 98.01281 4.526978 105.0937 3.337651 -7.080841      5.624361 
1 1 1 -10 16 5  o 174.6365 3.017159 371.7541       12.84013 382.2182       20.92889 365.4382       16.25980 176.9525 4.858078 173.1240 3.854089 3.828506       6.201203 
1 1 1 -10 16 6  o 156.1020 3.204302 297.0509       12.18928 300.1886       17.80357 294.2823       16.72356 156.8132 4.664136 155.2764 4.424154 1.536819       6.428632 
1 1 1 -10 16 7  o 229.9238 3.520754 644.5151       19.72676 654.7568       31.91468 638.1829       25.09470 231.6344 5.653944 228.7482 4.501821 2.886139       7.227273 
1 1 1 -10 16 8  o 351.5232 4.839397 1507.389       41.45543 1560.102       67.39572 1475.306       52.57869 357.2894 7.740626 347.6304 6.206631 9.658997       9.921671 
1 1 1 -10 16 9  o 110.4587 2.643787 148.7191       7.116434 155.7419       11.98366 144.8933       8.844909 112.9166 4.363288 108.9658 3.334867 3.950752       5.491777 
1 1 1 -10 16 10 o 151.9706 3.148611 281.5581       11.66043 260.3702       23.74366 288.2922       13.38579 145.8444 6.698586 153.7648 3.572324 -7.920456      7.591610 
1 1 1 -10 16 11 f 263.6238 3.859152 847.5527       24.79206 859.0666       39.94338 840.3375       31.61994 265.2216 6.180163 262.4235 4.944499 2.798096       7.914701 
1 1 1 -10 16 12 o 357.2598 4.904731 1557.613       42.70074 1513.446       66.79385 1588.140       55.53019 351.7358 7.792625 360.5560 6.320047 -8.820221      10.03334 
1 1 1 -10 16 13 o 140.9550 2.753266 242.2160       9.457246 252.2786       15.87035 236.6751       11.77660 143.7149 4.537255 139.3112 3.468949 4.403702       5.711418 
1 1 1 -10 16 14 o 199.0499 3.218958 483.1503       15.61397 527.5443       26.44897 459.4025       19.34451 207.7906 5.227471 194.0480 4.090840 13.74255       6.637878 
1 1 1 -10 16 15 o 220.5963 4.422062 593.9191       23.77164 601.0453       29.87950 581.6303       39.23724 221.8118 5.527803 217.8515 7.401726 3.960312       9.238082 
1 1 1 -10 16 16 o 94.50967 2.963296 109.0280       6.816326 106.8655       10.54378 110.5807       8.934381 93.44348 4.644882 95.12183 3.862356 -1.678345      6.040921 
1 1 1 -10 16 17 o 111.5138 2.955189 151.7563       8.023555 136.7478       11.65996 165.2551       11.05800 105.7338 4.535848 116.3052 3.907134 -10.57139      5.986619 
1 1 1 -10 16 18 o 314.6115 5.766889 1210.320       44.21323 1223.168       54.71448 1186.144       75.05424 315.9865 7.105549 310.2155 9.941151 5.770935       12.21946 
1 1 1 -10 16 19 o 167.2621 3.922380 341.4802       15.98760 330.9781       19.47164 363.2086       28.00783 164.5212 4.862072 172.0847 6.691596 -7.563507      8.271469 
1 1 1 -10 16 20 o 252.7513 4.203735 780.0708       25.89195 803.5304       37.91762 759.5755       35.44118 256.2224 6.072784 249.1586 5.837087 7.063766       8.423200 
1 1 1 -10 16 21 o 95.07541 3.253677 110.4245       7.527284 106.8880       13.53614 112.0077       9.056758 93.24798 5.988544 95.70251 3.891527 -2.454536      7.141893 
1 1 1 -10 16 22 o 270.8887 4.424716 896.6566       29.20871 901.9036       42.05988 891.7691       40.59384 271.2681 6.362579 269.7858 6.174544 1.482300       8.866082 
1 1 1 -10 16 23 o 183.5551 3.468529 411.3034       15.51486 403.0475       22.33357 419.0037       21.56905 181.4408 5.056042 185.0456 4.787192 -3.604797      6.962813 
1 1 1 -10 16 24 o 146.5411 3.773519 262.4651       13.46420 257.0146       16.48960 273.3685       23.32239 144.8900 4.676326 149.1210 6.433108 -4.231033      7.953169 
1 1 1 -10 16 25 o 258.4308 4.295784 816.5571       27.05346 829.7861       39.27193 804.6097       37.32132 260.0341 6.197488 256.1218 5.979629 3.912323       8.611900 
1 1 1 -10 16 26 o 125.8260 4.306175 193.8569       13.18432 180.5869       20.93121 202.5847       16.97511 120.9146 7.135336 128.4461 5.435485 -7.531487      8.969811 
1 1 1 -10 16 27 o 73.98373 3.178166 66.96355       5.716561 67.64808       8.755210 66.45485       7.547451 74.16080 4.871554 73.58715 4.226618 0.5736542      6.449522 
1 1 1 -10 16 28 o 99.29160 3.051874 120.5086       7.375634 112.5614       10.91034 127.1973       10.00926 95.74706 4.690296 101.8925 4.039105 -6.145416      6.189770 
1 1 1 -10 16 29 f 179.7003 3.482258 394.7469       15.24916 391.8711       22.21799 397.3081       20.96743 178.6385 5.109046 179.9601 4.785403 -1.321564      7.000174 
1 1 1 -10 16 30 o 49.30059 3.817518 29.92149       4.550664 22.40004       7.043610 35.31032       5.961998 41.99749 7.137503 53.46447 4.621375 -11.46698      8.503003 
1 1 1 -10 16 31 o 117.7680 3.106227 169.6572       8.906709 173.5044       13.34390 166.5660       11.96121 118.8159 4.617424 116.4954 4.220348 2.320473       6.255552 
1 1 1 -10 16 32 f 19.26019 6.782295 4.064383       3.954119 5.492464       7.323412 3.476759       4.697717 24.12661 9.112248 19.38371 7.303153 4.742893       11.67772 
1 1 1 -10 16 33 o 32.44939 5.401802 13.33878       4.121410 9.045275       6.193736 16.75047       5.521178 26.88972 8.468245 36.20211 6.497111 -9.312393      10.67350 
1 1 1 -10 16 34 o 29.08005 6.970345 10.99772       4.875197 11.02891       5.840673 10.92606       8.852592 29.09196 7.993494 29.89642 10.16684 -0.8044643     12.93292 
1 1 1 -10 16 35 o 15.98554 6.329350 1.833736       3.659366 5.161330       5.591140 -0.6598253     4.839999 21.96563 8.024374 15.58214 6.789828 6.383489       10.51153 
1 1 1 -10 16 36 o 24.33055 6.728578 7.736983       4.123424 10.66238       5.564610 4.174564       6.140656 28.35985 7.806241 21.37992 8.276602 6.979923       11.37715 
1 1 1 -10 16 37 o 60.53708 3.379292 45.35337       4.965422 54.87123       7.903499 39.14688       6.382237 66.04680 4.946498 55.80580 4.737817 10.24100       6.849434 
1 1 1 -10 16 38 o 19.16142 6.583950 4.451369       3.714562 12.39506       5.706359 -1.389789      4.893251 30.10117 7.737266 14.88848 6.641256 15.21268       10.19664 
1 1 1 -10 16 39 f 21.81381 7.320261 6.181270       4.589068 14.28889       9.857443 3.937892       5.185241 31.20750 10.72535 19.66013 7.606965 11.54737       13.14911 
1 1 1 -10 16 40 o 37.46742 4.641284 18.16104       4.147139 15.09050       5.908607 21.14245       5.822228 32.60739 7.580150 39.60395 6.238950 -6.996563      9.817493 
1 1 1 -10 16 41 o 16.18539 6.570291 2.179068       4.047116 2.444565       6.865966 2.037707       5.009998 19.31141 8.247351 17.16206 7.171626 2.149353       10.92936 
1 1 1 -10 16 42 o 56.05101 3.932558 40.55596       5.337404 47.39476       7.618834 33.96491       7.479553 59.26432 5.332405 49.09375 6.404456 10.17057       8.333762 
1 1 1 -10 16 43 o 18.91553 6.777507 5.055344       3.964002 5.183598       5.622620 4.928600       5.589419 19.69248 7.829969 19.44296 7.781468 0.2495136      11.03901 
1 1 1 -10 16 44 o 44.43145 4.402926 26.59562       4.704620 24.12716       6.897619 28.74293       6.433299 39.00652 7.529185 44.36170 6.113361 -5.355179      9.698547 
1 1 1 -10 16 45 o 46.47007 4.909816 30.34506       5.476029 33.51352       7.197028 25.98876       8.438942 46.67216 6.504353 36.77146 9.386836 9.900700       11.42013 
1 1 1 -10 16 46 o 9.205072 4.507478 -4.991223      3.401316 -11.96427      5.304297 -0.1217405     4.432593 9.865168 4.957981 13.36858 6.106303 -3.503417      7.865654 
1 1 1 -10 16 47 f 15.28250 6.286083 3.222775       3.765195 3.633459       5.899567 2.940532       4.890768 16.51959 7.335123 15.59993 6.810970 0.9196577      10.00966 
1 1 1 -10 17 1  o 471.0314 6.246695 2709.298       71.70283 2862.448       117.3200 2617.982       90.59141 483.3470 9.960403 462.6945 8.034458 20.65247       12.79696 
1 1 1 -10 17 2  o 244.9489 4.115130 731.7501       24.56378 756.1978       34.96260 707.9196       34.51851 248.8953 5.764359 240.8100 5.882221 8.085281       8.235797 
1 1 1 -10 17 3  o 123.9036 2.960570 187.1468       8.939131 178.1308       17.05293 190.5630       10.49692 120.6601 5.816752 124.9711 3.450101 -4.311043      6.762973 
1 1 1 -10 17 4  o 80.84189 2.452622 79.72996       4.826148 86.68187       6.958031 73.28467       6.699704 84.25037 3.396013 77.44536 3.559484 6.805016       4.919637 
1 1 1 -10 17 5  o 265.4888 3.897506 859.5377       25.21559 832.0817       39.49728 878.4265       32.76054 261.0449 6.208918 268.3162 5.010351 -7.271332      7.978363 
1 1 1 -10 17 6  o 101.5057 2.916438 125.7057       7.206577 124.6276       14.13672 126.0842       8.376755 100.8759 5.774887 101.6355 3.386892 -0.7595520     6.694801 
1 1 1 -10 17 7  o 217.9809 3.409600 579.3472       18.11165 589.2792       29.28661 573.1963       23.04746 219.7238 5.469604 216.7737 4.362952 2.950134       6.996564 
1 1 1 -10 17 8  o 82.74274 2.738240 83.54861       5.513646 76.34384       9.055290 87.79348       6.950641 78.96139 4.727644 84.78822 3.370696 -5.826836      5.806222 
1 1 1 -10 17 9  f 230.8450 4.554113 650.1675       25.61890 628.8854       44.81385 660.4993       31.22425 226.5622 8.130052 232.6003 5.508655 -6.038101      9.820540 
1 1 1 -10 17 10 o 197.4878 3.591092 475.6292       17.28235 482.5733       25.14176 469.4086       23.79564 198.7613 5.195176 196.0493 4.984807 2.712036       7.199872 
1 1 1 -10 17 11 o 314.4414 4.425695 1206.441       33.91231 1221.066       54.50277 1197.202       43.31913 315.9904 7.077967 313.0908 5.677712 2.899658       9.073811 
1 1 1 -10 17 12 o 78.51883 2.719050 75.25312       5.194829 71.31381       8.714591 77.42452       6.470041 76.29319 4.710293 79.60953 3.342514 -3.316338      5.775748 
1 1 1 -10 17 13 o 94.43968 2.647257 108.8207       6.086366 112.0732       10.37690 107.1150       7.514708 95.72305 4.460780 93.66026 3.297606 2.062782       5.547321 
1 1 1 -10 17 14 o 262.2031 4.972376 839.5586       31.77151 831.2278       55.81701 843.5515       38.64238 260.1315 8.817911 262.6871 6.036553 -2.555573      10.68623 
1 1 1 -10 17 15 o 40.97958 3.518588 20.63657       3.479779 21.00043       6.357218 20.48091       4.158000 40.91853 6.599956 40.74339 4.250279 0.1751328      7.850114 
1 1 1 -10 17 16 o 110.9320 3.562396 150.2910       9.617707 154.2364       12.12782 143.6049       15.78783 112.3085 4.440079 108.1966 6.011510 4.111977       7.473457 
1 1 1 -10 17 17 o 123.8084 3.627980 187.1980       10.93409 191.1598       13.77546 180.4519       17.97598 125.0337 4.528567 121.2987 6.100942 3.735008       7.597988 
1 1 1 -10 17 18 o 132.1308 4.444861 213.4514       14.29156 211.1845       20.36925 215.6493       20.05702 131.1875 6.390801 132.5939 6.224732 -1.406464      8.921302 
1 1 1 -10 17 19 o 384.0597 5.863965 1804.919       54.88152 1859.216       79.78842 1756.161       75.60855 388.9155 8.418767 378.0655 8.206684 10.85001       11.75693 
1 1 1 -10 17 20 o 102.0263 2.973064 127.0916       7.383955 132.5403       11.46548 123.2301       9.652081 104.0543 4.532511 100.3835 3.953417 3.670837       6.014412 
1 1 1 -10 17 21 o 58.21350 3.611778 41.52766       5.098430 48.05053       10.01572 39.24627       5.923301 62.24073 6.709331 56.51191 4.334261 5.728821       7.987549 
1 1 1 -10 17 22 o 67.05550 3.167945 54.99500       5.162005 61.46858       8.432880 51.11580       6.527917 70.72303 4.923792 64.54814 4.172417 6.174889       6.453897 
1 1 1 -10 17 23 o 174.7585 4.054250 373.1625       17.26573 367.1825       21.13470 385.1613       29.93746 173.1529 5.014040 176.9326 6.956938 -3.779709      8.575522 
1 1 1 -10 17 24 o 167.3908 3.362902 342.1165       13.71772 352.7567       20.38163 333.3052       18.54741 169.6999 4.933810 165.0056 4.617169 4.694366       6.757273 
1 1 1 -10 17 25 o 92.77097 4.113176 105.4245       9.275652 86.60493       15.26531 116.4400       11.67894 83.49690 7.585070 97.39654 4.936764 -13.89964      9.050135 
1 1 1 -10 17 26 o 165.5057 3.344178 334.5650       13.48772 338.2819       19.88125 331.3956       18.35864 166.1187 4.916628 164.4828 4.584669 1.635895       6.722530 
1 1 1 -10 17 27 o 123.9383 3.071023 187.5796       9.275232 195.3913       14.14552 181.6879       12.28474 126.2346 4.606100 121.7955 4.145072 4.439102       6.196594 
1 1 1 -10 17 28 o 96.61127 3.458326 114.2262       8.128842 113.7478       10.93415 114.8174       12.15424 96.23434 4.676503 96.59952 5.182139 -0.3651733     6.980276 
1 1 1 -10 17 29 o 84.55518 3.120546 87.48064       6.418911 100.7721       10.12135 78.53801       8.302038 90.54671 4.602101 79.95864 4.276277 10.58807       6.282187 
1 1 1 -10 17 30 o 128.6365 3.155214 202.2714       9.890751 200.9285       14.69830 203.3827       13.37099 127.8682 4.725156 128.7484 4.267625 -0.8801956     6.367082 
1 1 1 -10 17 31 o 98.43659 4.143385 119.0352       9.916894 0.000000       0.000000 119.0352       9.916894 ?        ?        98.43659 4.143385 0.000000       4.143385 
1 1 1 -10 17 32 o 62.10695 3.447996 47.38822       5.197986 49.96170       8.135605 45.61302       6.756995 63.42751 5.312271 60.73271 4.599769 2.694805       7.026955 
1 1 1 -10 17 33 o 83.83854 3.204730 86.23206       6.535380 89.85441       9.887184 83.42136       8.709309 85.23254 4.779409 82.21884 4.362480 3.013702       6.471011 
1 1 1 -10 17 34 o 20.30725 7.361400 4.400653       4.692709 6.082549       5.547985 0.1719139      8.797133 22.98258 8.038343 21.56911 9.275776 1.413471       12.27416 
1 1 1 -10 17 35 o 38.88440 4.899316 19.05840       4.539612 20.66880       6.342382 17.36670       6.500498 39.96432 6.752779 36.30263 7.592568 3.661694       10.16106 
1 1 1 -10 17 36 o 29.63334 5.406348 11.32636       3.760291 12.04835       5.856284 10.81988       4.904994 29.97688 7.905105 28.54883 7.084189 1.428043       10.61491 
1 1 1 -10 17 37 o 12.95796 5.706612 -0.7350446     3.500626 -4.550064      5.389376 2.049230       4.604115 13.84892 6.467263 17.36105 7.022269 -3.512128      9.546609 
1 1 1 -10 17 38 o 53.11152 3.793323 35.32404       4.877261 33.92402       7.292551 36.45705       6.560379 51.04594 5.975442 53.38966 5.104459 -2.343712      7.858843 
1 1 1 -10 17 39 o 17.55578 6.907521 2.861280       4.333815 2.548269       9.224678 2.949936       4.909340 22.06091 9.493026 18.28021 7.300588 3.780704       11.97565 
1 1 1 -10 17 40 o 53.51520 3.761505 36.30221       4.874161 39.47659       7.456679 33.93398       6.440615 54.49967 5.698691 50.79530 5.280125 3.704365       7.768835 
1 1 1 -10 17 41 o 27.71290 6.152905 10.80080       4.046945 14.15900       6.019560 8.031053       5.466779 30.54757 7.994905 23.36888 7.988568 7.178692       11.30202 
1 1 1 -10 17 42 o 19.11946 6.697517 5.121769       3.852424 5.572916       5.492513 4.684909       5.404847 20.22179 7.827802 19.32369 7.678948 0.8981056      10.96543 
1 1 1 -10 17 43 o 12.56021 5.677210 -0.7899264     3.709158 2.747386       5.639350 -3.486928      4.924170 17.48281 7.470636 12.74994 6.024843 4.732872       9.597350 
1 1 1 -10 17 44 o 38.37731 5.961527 21.64736       5.394441 18.51511       6.753076 27.17016       8.967120 32.53893 8.444333 37.84560 9.684142 -5.306675      12.84871 
1 1 1 -10 17 45 o 8.981716 4.503836 -9.985849      4.256034 -8.882915      5.408041 -11.78035      6.898225 10.92356 5.411904 11.87931 5.922827 -0.9557476     8.023003 
1 1 1 -10 17 46 o 16.02576 6.425451 3.730160       3.818236 7.205318       5.986028 1.346372       4.957757 19.47922 7.959371 14.70676 6.612902 4.772459       10.34805 
1 1 1 -10 17 47 o 12.52079 5.653634 0.3503188      3.667454 -3.397136      5.524233 3.303639       4.904097 12.50539 6.034904 15.73316 6.845416 -3.227772      9.125776 
1 1 1 -10 18 1  o 175.9011 4.794954 377.8761       20.53449 343.2849       26.80911 426.9766       31.94051 167.4740 6.581810 186.7493 7.031097 -19.27524      9.631021 
1 1 1 -10 18 2  o 174.1041 2.988560 369.5610       12.67965 382.4983       20.05225 360.9418       16.36720 176.9885 4.653274 172.0252 3.904326 4.963303       6.074267 
1 1 1 -10 18 3  o 272.7128 3.956822 907.1363       26.29591 833.6041       39.31723 966.6487       35.37106 261.2296 6.176244 281.4132 5.157835 -20.18359      8.046693 
1 1 1 -10 18 4  o 212.0843 3.333630 548.4628       17.22907 508.9217       25.97741 579.5155       23.02081 204.1187 5.226780 217.9494 4.334399 -13.83063      6.790158 
1 1 1 -10 18 5  o 268.5554 3.948604 879.6984       25.84126 835.8922       40.11857 910.7608       33.78283 261.5703 6.293916 273.1615 5.075052 -11.59119      8.085142 
1 1 1 -10 18 6  o 223.3684 3.491755 608.4388       19.00648 612.1644       30.64228 606.1092       24.23095 223.8306 5.622242 222.8808 4.461302 0.9497375      7.177243 
1 1 1 -10 18 7  o 289.9028 4.173923 1025.303       29.48716 987.8112       46.08210 1051.297       38.37114 284.2808 6.651946 293.4356 5.366064 -9.154846      8.546521 
1 1 1 -10 18 8  o 155.0708 3.247799 293.2285       12.27313 262.5045       24.89620 303.0922       14.10631 146.3479 7.001191 157.6402 3.672065 -11.29234      7.905740 
1 1 1 -10 18 9  o 177.1477 4.811427 383.3322       20.75120 379.4202       29.69420 387.0663       29.01097 176.0008 6.937009 177.7982 6.707774 -1.797348      9.649680 
1 1 1 -10 18 10 o 88.45945 2.675659 95.48708       5.761182 89.96802       9.506714 98.69037       7.242620 85.73540 4.566712 89.89726 3.311739 -4.161858      5.641141 
1 1 1 -10 18 11 o 311.4139 4.402760 1183.603       33.41175 1180.814       53.27252 1185.411       42.89772 310.6450 7.037247 311.4839 5.651484 -0.8388977     9.025638 
1 1 1 -10 18 12 o 120.9075 3.034274 178.3811       8.933073 175.1666       13.07304 181.1968       12.23510 119.7075 4.489408 121.7832 4.128691 -2.075714      6.099252 
1 1 1 -10 18 13 o 345.3709 5.363916 1457.395       45.14440 1402.163       62.75488 1516.633       64.99151 338.2907 7.612395 351.8368 7.580176 -13.54611      10.74279 
1 1 1 -10 18 14 o 126.6390 3.081134 195.5953       9.508545 208.4747       14.21665 185.1705       12.79038 130.5962 4.473756 123.0899 4.270545 7.506355       6.184824 
1 1 1 -10 18 15 o 212.4208 4.412106 550.9358       22.83911 583.3514       29.05178 498.4861       36.95448 218.4608 5.457115 201.5181 7.538469 16.94264       9.306376 
1 1 1 -10 18 16 o 123.6582 3.098268 186.6346       9.329018 171.3251       13.26488 201.6177       13.12271 118.3487 4.608237 128.4402 4.198268 -10.09157      6.233884 
1 1 1 -10 18 17 o 149.8321 3.209143 273.8724       11.71737 267.1839       17.17496 279.6963       16.02633 147.8049 4.774642 151.2770 4.351880 -3.472031      6.460345 
1 1 1 -10 18 18 o 202.0723 3.672084 498.3861       18.08237 517.0092       26.81316 482.8513       24.48923 205.5450 5.357665 198.6807 5.062175 6.864258       7.370901 
1 1 1 -10 18 19 o 165.0421 3.775475 332.5434       15.18456 318.7944       26.79076 339.0506       18.43085 161.0917 6.840145 166.5140 4.546373 -5.422333      8.213226 
1 1 1 -10 18 20 f 293.9976 5.420149 1057.721       38.83212 1031.796       67.04123 1070.811       47.63707 288.9190 9.535096 295.4992 6.615347 -6.580170      11.60521 
1 1 1 -10 18 21 o 138.5132 3.143118 234.1364       10.60933 247.5998       16.17027 223.9604       14.05817 142.2295 4.671768 135.3136 4.268692 6.915878       6.328282 
1 1 1 -10 18 22 o 321.7172 5.940877 1268.706       46.57587 1274.204       57.40320 1258.112       79.68259 321.9160 7.317411 318.3179 10.28577 3.598083       12.62306 
1 1 1 -10 18 23 o 148.9765 3.234922 270.9414       11.74404 274.5333       17.50985 268.0043       15.83355 149.7115 4.805672 147.9822 4.395560 1.729263       6.512713 
1 1 1 -10 18 24 o 57.06485 3.838963 39.97182       5.307430 38.16430       12.47865 40.37101       5.864287 54.68147 9.720861 57.30558 4.229149 -2.624111      10.60098 
1 1 1 -10 18 25 o 75.67857 4.310194 70.28451       7.916011 52.71239       14.26358 78.10577       9.516001 64.54763 9.339109 79.70856 4.923093 -15.16093      10.55726 
1 1 1 -10 18 26 o 122.2858 3.099993 182.7284       9.230442 192.1249       14.12900 175.7318       12.19182 125.1727 4.640002 119.7782 4.183327 5.394455       6.247387 
1 1 1 -10 18 27 o 158.3979 3.325677 306.5713       12.83706 317.9876       19.30638 297.5243       17.18664 160.9752 4.927393 155.7903 4.531859 5.184921       6.694546 
1 1 1 -10 18 28 o 70.96707 3.351297 61.69743       5.779327 63.14735       9.034360 60.69310       7.519091 71.52711 5.219028 70.24609 4.414778 1.281021       6.835826 
1 1 1 -10 18 29 o 157.7216 3.847665 304.5180       14.78851 304.5884       19.08313 304.4120       23.39881 157.4159 4.980947 157.0194 6.126869 0.3964386      7.896097 
1 1 1 -10 18 30 o 73.84818 3.787423 66.96519       6.793080 81.04819       15.64656 63.69405       7.540855 80.23152 8.114134 71.93215 4.321843 8.299370       9.193339 
1 1 1 -10 18 31 o 93.24687 3.463347 106.6232       7.856173 124.4567       14.65065 99.42556       9.307496 100.1286 6.032278 89.89119 4.261061 10.23740       7.385460 
1 1 1 -10 18 32 o 53.07515 3.694991 34.72046       4.749197 44.43303       7.807634 29.01625       5.983424 59.71658 5.424356 48.21390 5.173439 11.50268       7.495872 
1 1 1 -10 18 33 o 18.39586 7.090036 2.903808       4.491665 2.979277       5.571033 2.763623       7.592785 19.81554 7.820889 21.97628 8.970061 -2.160736      11.90077 
1 1 1 -10 18 34 o 44.02046 4.029457 24.09106       4.274630 32.76976       6.851428 18.55972       5.469766 50.97580 5.607976 38.06329 6.103113 12.91251       8.288388 
1 1 1 -10 18 35 o 40.56478 4.704210 20.71570       4.564084 19.80632       6.400038 21.65676       6.510560 38.92289 7.005035 40.82198 6.782594 -1.899097      9.750595 
1 1 1 -10 18 36 f 56.81187 3.515667 40.03587       4.843397 33.76832       7.189075 45.24510       6.554075 51.34356 5.850039 60.07512 4.509855 -8.731556      7.386593 
1 1 1 -10 18 37 o 43.25433 4.313989 23.62145       4.486629 13.57243       6.719082 31.70762       6.027250 31.20477 8.573347 49.88398 5.026652 -18.67920      9.938286 
1 1 1 -10 18 38 o 30.90687 6.330262 12.85854       4.607218 -0.2099855     8.926787 17.60355       5.378988 20.42891 9.049455 36.30471 6.308814 -15.87580      11.03149 
1 1 1 -10 18 39 o 24.10808 6.367367 8.013506       3.795711 6.063760       5.510556 9.773714       5.235864 21.80058 7.965982 26.18546 7.696598 -4.384884      11.07675 
1 1 1 -10 18 40 o 20.44607 6.955633 5.687820       4.143594 7.010998       7.234045 5.041722       5.055003 23.05882 8.967563 20.10096 7.575263 2.957863       11.73890 
1 1 1 -10 18 41 o 16.65859 6.557197 2.999042       3.906774 3.106249       5.482701 2.888461       5.568320 18.17122 7.540408 18.06281 7.555263 0.1084156      10.67426 
1 1 1 -10 18 42 o 27.46053 6.370408 11.09034       4.180273 13.01280       6.108222 9.396709       5.733181 28.10055 8.327124 24.09750 8.181971 4.003046       11.67414 
1 1 1 -10 18 43 o 32.95299 5.896771 15.77561       4.561408 7.875031       6.418237 23.83861       6.483874 21.84712 8.460474 39.42758 7.005004 -17.58046      10.98407 
1 1 1 -10 18 44 o 13.62904 6.016180 0.6146973      3.912164 -2.317650      5.690666 3.242519       5.387079 13.89226 6.537656 17.03697 7.291396 -3.144711      9.793131 
1 1 1 -10 18 45 o 14.11668 6.196781 1.331817       4.097191 5.396717       6.286250 -1.670271      5.402297 18.41370 7.878423 13.56142 6.378193 4.852276       10.13661 
1 1 1 -10 18 46 o 11.12794 5.210254 -1.563022      3.536104 -0.2911750     5.951309 -2.257059      4.396293 14.42203 6.754759 11.90183 5.644338 2.520204       8.802575 
1 1 1 -10 19 1  o 117.3613 3.027003 168.0639       8.649899 159.1506       11.46507 179.8409       13.17879 114.1329 4.129010 121.3079 4.465729 -7.174965      6.082060 
1 1 1 -10 19 2  o 112.7414 2.601278 154.9579       7.146713 145.8542       10.71504 162.2531       9.591922 109.2632 4.031153 115.2911 3.417854 -6.027924      5.285066 
1 1 1 -10 19 3  o 143.3969 2.762632 250.7003       9.653812 239.1353       14.70229 259.4658       12.79970 139.9215 4.317023 145.8506 3.601268 -5.929077      5.621905 
1 1 1 -10 19 4  o 135.7755 3.018011 224.7870       9.985699 236.1981       14.34192 214.0501       13.91173 139.0649 4.237019 132.3718 4.318482 6.693130       6.049927 
1 1 1 -10 19 5  o 281.2110 4.109605 964.8796       28.16233 946.9572       44.36468 976.9760       36.44743 278.2913 6.541866 282.8397 5.287988 -4.548401      8.411826 
1 1 1 -10 19 6  o 274.6656 4.027072 920.4550       26.95441 924.0352       43.18172 918.1696       34.50131 274.9091 6.445770 274.2050 5.163261 0.7040100      8.258766 
1 1 1 -10 19 7  o 128.9747 2.776333 202.8153       8.725936 209.0989       14.48026 199.2325       10.93426 130.8062 4.549604 127.7568 3.515459 3.049370       5.749552 
1 1 1 -10 19 8  o 118.9409 3.059803 172.6285       8.861349 186.9113       20.00700 169.1428       9.883667 123.4352 6.676151 117.7093 3.449371 5.725891       7.514596 
1 1 1 -10 19 9  f 106.5214 2.704349 138.4357       7.014300 147.3615       11.87161 133.6485       8.694151 109.7854 4.446602 104.6208 3.414720 5.164589       5.606477 
1 1 1 -10 19 10 o 153.9678 2.903355 289.0758       10.89347 278.7966       17.51990 295.5545       13.90903 151.0292 4.766270 155.6468 3.667080 -4.617615      6.013718 
1 1 1 -10 19 11 o 64.63611 2.978887 51.05681       4.679461 52.63670       7.922982 50.21047       5.798943 65.45646 5.005026 64.04194 3.731935 1.414520       6.243206 
1 1 1 -10 19 12 o 276.3903 4.527499 932.7442       30.49420 959.5328       44.16378 908.3350       42.15682 280.0254 6.471915 272.4742 6.349016 7.551178       9.066183 
1 1 1 -10 19 13 o 199.2802 4.263606 484.8133       20.70510 483.7387       25.55998 486.8642       35.31198 198.8876 5.278381 199.2012 7.286625 -0.3135834     8.997567 
1 1 1 -10 19 14 o 214.0645 3.828957 559.2465       19.97382 580.2773       29.12616 540.5755       27.44339 217.7964 5.492158 210.2287 5.361225 7.567657       7.675059 
1 1 1 -10 19 15 o 117.7620 2.704460 169.1171       7.761074 175.8295       13.11515 165.4998       9.627793 119.9023 4.496554 116.4177 3.397320 3.484627       5.635670 
1 1 1 -10 19 16 o 172.7740 3.040313 364.1317       12.80067 351.3584       20.63311 372.1242       16.32135 169.4788 5.001366 174.6010 3.835954 -5.122223      6.303031 
1 1 1 -10 19 17 o 63.87924 2.831830 49.86957       4.397261 47.93448       7.944808 50.72415       5.279680 62.38732 5.275171 64.38484 3.376826 -1.997520      6.263416 
1 1 1 -10 19 18 o 183.8652 3.523748 412.6340       15.78848 414.1438       23.12562 411.3159       21.60812 183.9452 5.164149 183.3660 4.839961 0.5791473      7.077687 
1 1 1 -10 19 19 o 111.8949 3.413755 152.9628       9.297589 170.7242       18.05370 146.5518       10.84656 117.8540 6.309160 109.4599 4.073418 8.394035       7.509876 
1 1 1 -10 19 20 o 125.9665 3.122697 193.6423       9.585641 190.4583       14.38139 196.1877       12.85839 124.7096 4.740852 126.6455 4.172093 -1.935844      6.315223 
1 1 1 -10 19 21 o 202.0625 3.719899 498.6677       18.31695 499.6963       26.78159 497.7638       25.10752 201.9240 5.447649 201.6022 5.114739 0.3218842      7.472445 
1 1 1 -10 19 22 o 184.9898 3.550212 417.9347       16.00435 412.1475       23.29174 423.1111       22.02822 183.3854 5.217262 185.8798 4.867264 -2.494385      7.135130 
1 1 1 -10 19 23 o 240.9439 4.783642 710.5696       28.08735 645.7116       48.56747 743.1617       34.42866 228.3191 8.745223 246.1632 5.739327 -17.84412      10.46034 
1 1 1 -10 19 24 o 228.1057 5.614336 638.2383       31.20833 704.1761       49.38986 594.4136       40.26527 238.4240 8.514313 219.4230 7.541509 19.00092       11.37400 
1 1 1 -10 19 25 o 94.01356 3.138412 108.0575       7.180047 111.5620       11.36679 105.7309       9.261726 95.29774 4.911190 92.88322 4.101956 2.414528       6.398893 
1 1 1 -10 19 26 o 209.2527 3.817384 535.4830       19.46584 558.5057       29.04720 516.7151       26.22615 213.1830 5.596176 205.1519 5.250248 8.031082       7.673480 
1 1 1 -10 19 27 o 82.59579 3.173461 83.48006       6.375561 86.10396       10.29212 81.84624       8.121447 83.61133 5.075207 81.66587 4.093963 1.945457       6.520602 
1 1 1 -10 19 28 o 71.96190 3.271939 63.43615       5.722768 64.42481       9.167523 62.80490       7.325333 72.22241 5.244610 71.47482 4.224541 0.7475967      6.734440 
1 1 1 -10 19 29 o 102.1884 3.594829 127.9664       8.937969 129.3455       18.56705 127.5505       10.19726 101.7632 7.540723 101.9320 4.113672 -0.1688309     8.589808 
1 1 1 -10 19 30 o 101.2803 4.052920 126.0173       9.982771 121.5766       15.21888 129.3709       13.22559 98.88808 6.348970 102.3202 5.322469 -3.432091      8.284811 
1 1 1 -10 19 31 o 89.75041 3.183025 98.74387       6.950634 109.9722       10.99069 91.26009       8.972813 94.36929 4.794946 86.06258 4.291911 8.306709       6.435216 
1 1 1 -10 19 32 o 136.4052 3.946660 228.9246       13.10509 226.0846       16.02421 234.6607       22.77329 135.2140 4.871123 136.7841 6.853931 -1.570175      8.408580 
1 1 1 -10 19 33 o 29.46351 7.422649 11.40200       5.326086 7.322411       6.291996 21.71445       10.00371 24.80960 8.567136 40.02042 10.22219 -15.21081      13.33750 
1 1 1 -10 19 34 o 78.83560 3.640661 76.75736       6.975326 76.90675       9.523720 76.58450       10.24492 78.44656 5.008071 78.11707 5.415308 0.3294983      7.376065 
1 1 1 -10 19 35 o 65.78417 3.323888 53.48544       5.311219 58.81966       8.317755 49.81321       6.901373 68.38854 5.026098 63.10046 4.518044 5.288078       6.758283 
1 1 1 -10 19 36 o 48.72501 3.873002 29.68210       4.560894 31.34117       7.218600 28.57973       5.884183 49.16037 6.160522 47.33471 5.185971 1.825668       8.052721 
1 1 1 -10 19 37 o 68.01883 3.420320 57.61122       5.651141 43.71690       8.324278 69.48868       7.696436 57.93850 5.981704 74.28257 4.269728 -16.34407      7.349242 
1 1 1 -10 19 38 o 29.19929 6.768267 11.76483       4.721882 13.17648       10.11931 11.37191       5.338733 29.75872 10.80675 28.37305 7.578168 1.385664       13.19904 
1 1 1 -10 19 39 o 16.90301 6.703088 2.707499       4.110293 -1.058284      6.987731 4.699773       5.082568 17.39411 7.833524 19.90100 7.573890 -2.506891      10.89623 
1 1 1 -10 19 40 o 16.51005 6.424201 2.935571       3.714100 4.420894       5.165195 1.345365       5.344450 19.30630 7.557522 16.77522 7.222202 2.531086       10.45353 
1 1 1 -10 19 41 o 32.60412 5.485961 14.75094       4.204143 12.69610       6.002237 16.72995       5.890451 28.07275 8.237760 33.11650 7.476732 -5.043755      11.12485 
1 1 1 -10 19 42 o 34.79910 5.336673 16.92348       4.381421 19.68668       6.459544 14.56895       5.962759 35.23031 7.736262 29.80428 8.030293 5.426027       11.15058 
1 1 1 -10 19 43 o 26.53215 7.212932 11.43940       4.785075 11.79404       5.928952 10.77682       8.104020 25.74836 8.305177 23.58410 9.392765 2.164253       12.53794 
1 1 1 -10 19 44 o 22.66741 7.193434 8.786059       4.461548 8.449698       5.839467 9.257768       6.915236 21.42436 8.126559 21.80194 8.678659 -0.3775826     11.88949 
1 1 1 -10 19 45 f 11.27740 5.270303 -1.579480      3.589933 1.010338       5.660399 -3.322156      4.643235 15.06827 6.889382 11.79173 5.649545 3.276540       8.909598 
1 1 1 -10 19 46 o 13.95766 5.965281 2.071510       3.596711 3.910843       6.066500 1.074521       4.466354 16.63869 7.410076 13.87401 6.254204 2.764688       9.696612 
1 1 1 -10 20 1  o 292.0309 6.532927 1043.412       46.49140 1068.302       66.93999 1020.218       64.61897 294.7189 9.332312 288.0362 9.217994 6.682709       13.11730 
1 1 1 -10 20 2  o 196.7002 4.962387 472.8383       23.76756 505.5593       35.08214 445.0786       32.31316 203.0845 7.099729 190.5557 6.970339 12.52882       9.949461 
1 1 1 -10 20 3  o 228.2655 3.954645 635.8179       21.99804 628.0084       43.04877 638.5778       25.59164 226.2380 7.820103 228.7013 4.591911 -2.463242      9.068608 
1 1 1 -10 20 4  o 121.6728 3.567199 180.7550       10.56544 0.000000       0.000000 180.7550       10.56544 ?        ?        121.6728 3.567199 0.000000       3.567199 
1 1 1 -10 20 5  o 183.3632 3.995054 410.2920       17.85134 412.2020       30.98213 409.3428       21.84127 183.3773 6.945690 183.0153 4.901688 0.3619843      8.501127 
1 1 1 -10 20 6  o 315.8470 5.020864 1218.481       38.64482 1199.582       54.62991 1237.411       54.67418 312.9937 7.162405 317.9134 7.057280 -4.919708      10.05511 
1 1 1 -10 20 7  o 64.71221 3.964305 51.29414       6.221574 35.97055       13.05427 55.79769       7.077015 53.15113 10.45134 67.47142 4.327025 -14.32029      11.31166 
1 1 1 -10 20 8  o 225.4132 3.970806 620.0858       21.81193 575.4315       30.08870 669.5416       31.66510 216.8898 5.697765 234.0534 5.551751 -17.16359      7.955279 
1 1 1 -10 20 9  f 256.8252 4.308991 805.2147       26.96804 821.8283       39.00670 790.0020       37.32594 259.2004 6.175433 254.1557 6.026634 5.044785       8.628805 
1 1 1 -10 20 10 o 117.1936 3.141505 167.6398       8.963671 183.0648       13.34799 154.9702       12.09719 122.3628 4.483999 112.5750 4.418253 9.787781       6.295014 
1 1 1 -10 20 11 o 167.6244 3.420468 342.7937       13.97201 311.5248       19.31046 377.1494       20.24120 159.6071 4.970890 175.6585 4.732895 -16.05145      6.863675 
1 1 1 -10 20 12 o 249.6165 4.217859 760.7172       25.65674 789.9561       37.56438 735.1505       35.12641 254.0968 6.066540 245.1547 5.879731 8.942062       8.448322 
1 1 1 -10 20 13 o 193.9020 3.235111 458.6731       15.28648 450.5534       24.58159 463.7931       19.51990 191.9133 5.261126 194.9079 4.109719 -2.994568      6.676019 
1 1 1 -10 20 14 o 127.9215 2.768332 199.5732       8.629744 216.9399       14.76962 190.5710       10.63373 133.1868 4.557347 124.9195 3.496605 8.267334       5.744185 
1 1 1 -10 20 15 o 171.2715 3.050200 357.8510       12.73062 352.1075       20.78140 361.3011       16.10664 169.6408 5.032557 172.0340 3.841974 -2.393204      6.331460 
1 1 1 -10 20 16 o 377.3152 5.183364 1741.085       47.65978 1712.726       75.27572 1760.060       61.57272 373.1637 8.277884 378.9079 6.668353 -5.744202      10.62969 
1 1 1 -10 20 17 o 190.6721 3.199989 443.6368       14.86865 456.7814       24.67118 436.1393       18.63267 193.1633 5.246039 188.9698 4.046194 4.193481       6.625150 
1 1 1 -10 20 18 o 129.7826 2.769690 205.4723       8.759588 208.4742       14.86084 203.8740       10.84361 130.5010 4.680556 129.1891 3.447465 1.311813       5.813142 
1 1 1 -10 20 19 o 83.98830 4.753337 86.54179       9.688959 95.75755       14.64099 79.36119       12.92365 88.04708 6.878238 80.14011 6.678225 7.906967       9.586909 
1 1 1 -10 20 20 o 88.82072 3.140259 96.41047       6.786284 90.22513       10.42192 100.9636       8.941733 85.71907 5.011094 90.80886 4.050904 -5.089790      6.443670 
1 1 1 -10 20 21 o 130.0081 3.183858 206.3332       10.08696 212.5932       15.43321 201.6648       13.32755 131.7185 4.816207 128.3624 4.266586 3.356110       6.434252 
1 1 1 -10 20 22 o 104.9403 4.133761 134.8463       10.55051 0.000000       0.000000 134.8463       10.55051 ?        ?        104.9403 4.133761 0.000000       4.133761 
1 1 1 -10 20 23 o 195.8965 4.243690 469.3826       20.25846 471.3441       25.96112 466.3284       32.39499 195.9898 5.440946 194.5457 6.843795 1.444046       8.743078 
1 1 1 -10 20 24 o 68.58714 3.290283 57.59295       5.483320 61.73976       9.290531 55.37629       6.792564 70.73831 5.431058 67.15223 4.171449 3.586082       6.848166 
1 1 1 -10 20 25 o 129.9809 3.170767 206.3791       10.04338 208.2573       15.24377 204.9384       13.35070 130.2695 4.810167 129.3286 4.241908 0.9408112      6.413383 
1 1 1 -10 20 26 o 123.6102 3.167613 186.8152       9.533768 183.9203       14.39016 189.0799       12.72791 122.3680 4.835237 124.1943 4.211610 -1.826294      6.412267 
1 1 1 -10 20 27 o 118.8775 3.149608 172.8330       9.116113 173.9763       13.91169 171.9725       12.06821 118.9768 4.808140 118.4117 4.188870 0.5650940      6.376899 
1 1 1 -10 20 28 o 111.2696 3.582080 151.6743       9.700221 157.5399       19.71421 149.8006       11.14236 112.4833 7.230388 110.4780 4.146068 2.005226       8.334769 
1 1 1 -10 20 29 o 159.4370 3.803943 311.5161       14.77948 336.1285       27.40711 301.4242       17.54988 164.4254 6.855068 156.5585 4.605041 7.866882       8.258230 
1 1 1 -10 20 30 o 74.76217 3.275281 68.57099       5.952665 69.64861       9.367231 67.84104       7.709513 74.97432 5.158430 74.18316 4.282878 0.7911606      6.704659 
1 1 1 -10 20 31 o 26.57226 6.323934 9.135776       4.035492 5.727520       6.664174 11.10918       5.070942 23.60594 8.737223 29.21790 7.175263 -5.611961      11.30590 
1 1 1 -10 20 32 o 22.59579 8.350778 5.320423       6.083660 5.320423       6.083660 0.000000       0.000000 22.59579 8.350778 ?        ?        0.000000       8.350778 
1 1 1 -10 20 33 f 50.60411 3.865960 31.76346       4.731285 28.44807       7.368194 34.08958       6.171763 47.07237 6.604770 52.15961 4.913437 -5.087234      8.231940 
1 1 1 -10 20 34 o 40.36745 4.234304 20.42231       4.103410 18.40087       6.465949 21.78540       5.309620 37.28305 7.378095 41.36379 5.396049 -4.080738      9.140767 
1 1 1 -10 20 35 o 67.06170 3.348074 55.70315       5.454187 56.46744       8.449394 55.15718       7.141326 66.74837 5.236454 66.32339 4.444161 0.4249878      6.868116 
1 1 1 -10 20 36 o 56.11593 3.677092 39.33371       5.000662 29.78823       7.494412 46.99427       6.713811 47.46706 6.662157 60.97392 4.551276 -13.50686      8.068360 
1 1 1 -10 20 37 o 18.12219 6.826267 3.550639       4.103710 -0.5597644     9.085669 4.604087       4.599613 20.30358 9.053649 19.79878 7.270802 0.5048027      11.61177 
1 1 1 -10 20 38 o 49.40728 3.970256 31.04912       4.739984 31.96975       7.106427 30.31129       6.361899 48.79601 6.109838 47.87657 5.555949 0.9194374      8.258249 
1 1 1 -10 20 39 o 38.21039 5.264165 19.52916       4.771589 22.35707       8.636923 18.28686       5.724509 37.45522 9.461243 35.94978 6.783035 1.505440       11.64151 
1 1 1 -10 20 40 o 26.63749 6.306160 10.22989       4.029656 2.447520       5.554497 18.87699       5.854957 17.63451 7.470305 35.93429 6.937429 -18.29978      10.19477 
1 1 1 -10 20 41 o 17.77238 6.561265 4.235359       3.753942 5.579580       5.440057 3.013407       5.186749 19.99030 7.775876 17.48612 7.301300 2.504181       10.66645 
1 1 1 -10 20 42 f 24.60645 7.328912 9.772355       4.721987 3.239558       5.847839 22.01287       8.004710 17.77750 7.602294 34.89619 9.260696 -17.11869      11.98146 
1 1 1 -10 20 43 o 15.77819 6.338149 3.074981       3.722565 5.423527       5.599583 1.215041       4.983170 18.90553 7.708302 15.20688 6.747421 3.698649       10.24430 
1 1 1 -10 20 44 o 16.79429 6.914494 4.009137       4.561300 2.575634       5.712544 6.530736       7.576492 16.24891 7.216259 19.33523 8.458740 -3.086315      11.11866 
1 1 1 -10 20 45 o 17.79025 6.705471 5.336793       3.961153 -4.744085      5.893348 13.64402       5.349841 12.53135 6.091215 26.85034 7.748105 -14.31899      9.855761 
1 1 1 -10 21 1  o 160.3647 3.230870 313.7013       12.62596 344.4878       18.42171 286.4271       17.33903 167.8996 4.506476 153.0714 4.653708 14.82816       6.478065 
1 1 1 -10 21 2  o 268.6854 3.954629 881.0997       25.89321 908.3829       41.29533 863.4233       33.23908 272.4764 6.219221 265.8239 5.131199 6.652496       8.062748 
1 1 1 -10 21 3  o 34.99135 4.165406 15.15652       3.482207 15.07388       5.010858 15.23371       4.842618 34.58854 6.171293 34.81600 5.919440 -0.2274551     8.551293 
1 1 1 -10 21 4  o 236.7676 4.067140 684.2554       23.46645 683.3310       46.31225 684.5748       27.21941 235.8618 8.069420 236.7506 4.717931 -0.8887939     9.347428 
1 1 1 -10 21 5  o 254.5912 4.906200 791.7961       30.43860 768.5057       51.85131 804.0425       37.59892 250.0282 8.522559 256.3859 6.017903 -6.357666      10.43308 
1 1 1 -10 21 6  f 169.5360 4.778991 351.3525       19.72425 0.000000       0.000000 351.3525       19.72425 ?        ?        169.5360 4.778991 0.000000       4.778991 
1 1 1 -10 21 7  o 92.61232 2.834267 104.6961       6.389019 107.2669       10.77344 103.3016       7.934924 93.59346 4.739020 91.94537 3.548074 1.648094       5.920063 
1 1 1 -10 21 8  o 113.3140 2.780522 156.5839       7.677961 167.8464       13.04879 150.6196       9.495766 117.1432 4.579884 111.0512 3.513319 6.092049       5.772240 
1 1 1 -10 21 9  o 187.4038 3.208009 428.4221       14.65042 414.6241       23.40555 437.3105       18.78564 184.1101 5.222086 189.2700 4.072941 -5.159866      6.622615 
1 1 1 -10 21 10 o 76.17296 2.863433 70.86549       5.305790 79.81426       9.190866 66.39251       6.497897 80.69602 4.694043 73.67133 3.630597 7.024696       5.934246 
1 1 1 -10 21 11 o 143.5053 3.266193 251.2464       11.42210 239.4098       16.33118 262.5809       15.98108 139.8987 4.797453 146.5558 4.479993 -6.657043      6.563984 
1 1 1 -10 21 12 o 46.09001 3.550216 26.07724       3.956765 24.95825       7.137570 26.57368       4.754134 44.63457 6.774639 46.45574 4.246392 -1.821167      7.995472 
1 1 1 -10 21 13 o 131.0900 2.830165 209.6059       9.041022 209.4331       14.96900 209.7051       11.34385 130.8309 4.702768 131.0331 3.555863 -0.2022552     5.895778 
1 1 1 -10 21 14 o 129.2350 2.827252 203.7250       8.903907 193.6300       14.56488 209.7491       11.25114 125.7763 4.760547 131.0445 3.526440 -5.268288      5.924407 
1 1 1 -10 21 15 f 282.0393 4.120669 971.6024       28.32132 946.8425       44.76274 988.1302       36.57203 277.8885 6.610130 284.2050 5.280575 -6.316528      8.460395 
1 1 1 -10 21 16 f 193.1998 3.241861 455.5227       15.26290 448.1841       24.71489 460.0469       19.40550 191.3095 5.306469 194.0640 4.103399 -2.754501      6.707943 
1 1 1 -10 21 17 o 275.9681 4.053463 930.3973       27.25971 958.2964       44.62362 913.7877       34.43088 279.4826 6.552001 273.2683 5.170384 6.214325       8.346352 
1 1 1 -10 21 18 o 151.0995 3.813503 279.0460       14.03060 289.3780       25.35360 274.4850       16.84512 153.3625 6.800892 149.7502 4.621581 3.612244       8.222600 
1 1 1 -10 21 19 o 111.1174 3.115325 150.8221       8.427382 157.9968       12.96574 145.5739       11.08929 113.5528 4.695711 109.0545 4.180509 4.498337       6.286999 
1 1 1 -10 21 20 o 90.29840 3.588668 99.75029       7.881042 103.9427       15.99865 98.40700       9.056046 91.63048 7.223225 89.62553 4.157725 2.004944       8.334367 
1 1 1 -10 21 21 o 136.3819 3.704457 227.4291       12.30028 211.2958       23.02324 233.8734       14.55097 130.7954 7.251724 138.2145 4.325510 -7.419083      8.443787 
1 1 1 -10 21 22 f 236.9877 4.127580 686.8322       23.83731 690.2222       34.73663 683.8149       32.77126 237.0090 6.019193 236.0759 5.696465 0.9330902      8.287363 
1 1 1 -10 21 23 o 109.8461 4.234647 147.8525       11.31420 134.2132       17.81574 157.0715       14.64704 104.1164 7.063626 113.0408 5.332176 -8.924400      8.850249 
1 1 1 -10 21 24 o 106.5370 3.125506 138.7570       8.105637 143.4665       12.89533 135.6810       10.42188 108.0705 4.909359 105.2259 4.072003 2.844643       6.378324 
1 1 1 -10 21 25 o 146.0427 3.325644 260.6830       11.83564 264.9662       17.93760 257.3804       15.75101 146.8636 5.019413 144.8669 4.467069 1.996735       6.719316 
1 1 1 -10 21 26 o 16.94405 6.502578 2.395069       3.766892 5.513631       7.025696 1.136906       4.462525 23.95600 8.950976 16.66283 6.847555 7.293165       11.26983 
1 1 1 -10 21 27 o 122.7903 3.207823 184.4820       9.590436 183.6689       14.69546 185.0852       12.65743 122.1682 4.946386 122.8005 4.236041 -0.6323318     6.512355 
1 1 1 -10 21 28 o 112.2839 3.172239 154.3485       8.671291 150.7635       13.26943 157.0204       11.45565 110.5990 4.935831 113.0595 4.165042 -2.460464      6.458328 
1 1 1 -10 21 29 o 139.0180 3.669662 237.0833       12.42091 253.3580       23.41241 230.7084       14.65303 142.5739 6.757842 136.9328 4.396907 5.641144       8.062333 
1 1 1 -10 21 30 o 172.4596 3.506870 364.8004       14.73816 403.2165       22.85370 337.4485       19.28386 180.5291 5.200271 165.3298 4.791431 15.19934       7.071112 
1 1 1 -10 21 31 o 61.09443 4.734421 46.40485       6.993659 50.53955       8.642952 38.56310       11.90273 63.51529 5.642698 54.08622 9.370037 9.429070       10.93790 
1 1 1 -10 21 32 o 63.51993 3.503041 49.78813       5.401401 58.78411       8.816228 44.38226       6.834257 68.49731 5.323458 59.64378 4.741067 8.853539       7.128599 
1 1 1 -10 21 33 o 50.07230 4.194661 31.27247       5.071360 34.14597       7.505044 28.85790       6.879666 51.71196 6.071103 47.48266 6.085311 4.229294       8.595889 
1 1 1 -10 21 34 o 9.763344 4.717075 -5.218921      3.398932 -6.946821      5.839221 -4.333446      4.180075 13.47347 6.422389 11.82844 5.577724 1.645032       8.506356 
1 1 1 -10 21 35 o 44.41822 4.149645 24.84548       4.439690 24.69630       7.033762 24.94427       5.724035 43.09321 6.933111 44.00209 5.454911 -0.9088745     8.821795 
1 1 1 -10 21 36 o 24.06359 6.407597 7.845824       3.824061 4.419040       6.495138 9.663866       4.730936 21.24597 8.425938 26.48714 7.159935 -5.241163      11.05717 
1 1 1 -10 21 37 o 76.09182 3.850368 73.07739       7.116435 63.98180       13.88444 76.31824       8.287849 66.63775 8.762212 77.34714 4.415394 -10.70939      9.811832 
1 1 1 -10 21 38 o 44.07920 4.781770 25.41260       5.054214 24.61517       9.321386 25.74467       6.015213 39.38334 9.761898 43.70068 5.790805 -4.317337      11.35025 
1 1 1 -10 21 39 o 24.73028 6.636424 8.884297       4.082407 4.799896       5.812120 12.86163       5.735436 19.97087 7.954220 28.94977 7.907798 -8.978897      11.21619 
1 1 1 -10 21 40 o 21.92761 6.743254 7.153955       3.952981 8.709059       5.932961 5.912504       5.300987 23.43294 8.302754 20.42123 7.743558 3.011709       11.35334 
1 1 1 -10 21 41 o 12.13379 5.497456 -0.8741060     3.502570 -2.101371      5.385887 0.2531348E-01  4.610724 14.04213 6.526433 14.38842 6.430478 -0.3462868     9.162170 
1 1 1 -10 21 42 o 16.68670 6.865089 3.309924       4.491974 -1.753888      5.614686 12.31476       7.487291 14.20971 6.624239 25.01196 9.260466 -10.80224      11.38581 
1 1 1 -10 21 43 o 15.81618 6.681057 2.823994       4.422044 3.249603       5.547508 2.082258       7.323477 16.84402 7.305062 17.10141 7.825530 -0.2573910     10.70527 
1 1 1 -10 21 44 o 25.33971 6.768778 10.90259       4.258914 13.62114       6.556479 8.918202       5.601632 25.25627 8.744188 21.29929 7.985499 3.956984       11.84183 
1 1 1 -10 21 45 o 11.19764 5.290253 -1.967329      3.793048 -0.3036056     6.088548 -3.022574      4.848974 14.39292 6.769866 12.00005 5.755700 2.392877       8.885897 
1 1 1 -10 22 1  o 252.1104 3.783385 775.7792       23.24381 834.2368       37.88054 740.4774       29.43705 261.1039 5.953422 246.1624 4.907230 14.94150       7.715189 
1 1 1 -10 22 2  o 150.7266 2.885197 277.0885       10.59745 287.6917       16.56564 269.7430       13.78792 153.4157 4.435664 148.6117 3.810378 4.803970       5.847572 
1 1 1 -10 22 3  o 116.1833 3.050201 164.7679       8.628445 174.4530       16.91246 161.3599       10.03230 119.2738 5.836415 114.9350 3.586280 4.338860       6.850193 
1 1 1 -10 22 4  o 61.48533 2.945742 46.21567       4.400857 47.51049       6.584244 45.17010       5.916649 62.22129 4.370203 60.69593 4.022886 1.525356       5.939889 
1 1 1 -10 22 5  o 117.2866 3.015090 167.9032       8.610420 186.9792       16.94063 161.2586       9.998194 123.5162 5.643109 114.8996 3.575161 8.616554       6.680304 
1 1 1 -10 22 6  o 210.1505 3.786560 539.0317       19.39149 514.3008       37.67068 547.9474       22.61842 204.6098 7.568152 211.8195 4.381876 -7.209702      8.745156 
1 1 1 -10 22 7  o 195.9465 3.302362 468.4454       15.76879 473.3189       25.65293 465.4856       19.99180 196.6778 5.357352 195.2462 4.201779 1.431595       6.808537 
1 1 1 -10 22 8  o 112.5581 2.840857 154.6222       7.786009 171.6486       13.28168 145.7073       9.610570 118.4450 4.610313 109.2062 3.616306 9.238785       5.859407 
1 1 1 -10 22 9  o 241.7311 3.728185 713.2527       21.96171 701.4404       35.04923 720.8885       28.17973 239.3062 6.014960 242.8856 4.761008 -3.579376      7.671176 
1 1 1 -10 22 10 o 110.5154 3.186295 149.1396       8.572183 150.5734       12.65110 147.9225       11.65577 110.9064 4.691564 109.9594 4.358469 0.9470520      6.403672 
1 1 1 -10 22 11 o 97.60780 2.793095 116.3029       6.636813 122.8542       11.41270 112.9553       8.158085 100.1549 4.689075 96.14062 3.487913 4.014320       5.844053 
1 1 1 -10 22 12 o 133.8933 2.868957 218.6889       9.360927 207.7124       15.31826 225.2310       11.82597 130.2625 4.834015 135.7908 3.576916 -5.528366      6.013487 
1 1 1 -10 22 13 o 186.9227 3.220351 426.3699       14.66903 410.5879       23.45379 436.5102       18.79995 183.1253 5.261130 189.0459 4.080876 -5.920578      6.658307 
1 1 1 -10 22 14 o 69.06184 3.011069 58.30459       5.055336 66.49231       9.065810 54.60974       6.090090 73.55373 5.089226 66.77035 3.758031 6.783386       6.326375 
1 1 1 -10 22 15 o 279.5781 4.111145 954.9561       28.00928 1043.073       47.42010 907.7411       34.71141 291.5509 6.674397 272.3523 5.230041 19.19855       8.479440 
1 1 1 -10 22 16 o 145.2879 2.922247 257.5639       10.34624 268.2391       17.41537 251.7412       12.86204 148.0069 4.835014 143.5294 3.680368 4.477478       6.076386 
1 1 1 -10 22 17 o 128.9068 4.745491 203.5424       14.88165 207.3617       21.62784 200.1083       20.50841 129.7413 6.865105 127.4941 6.623652 2.247208       9.539519 
1 1 1 -10 22 18 o 123.4600 3.622235 186.3313       10.88602 225.2411       21.86186 173.5028       12.55294 135.2486 6.653550 119.0446 4.334364 16.20399       7.940809 
1 1 1 -10 22 19 o 220.9915 4.542687 597.4664       24.46383 601.3885       44.16454 595.7302       29.38363 220.5545 8.231601 220.4703 5.469142 0.8422852E-01  9.882853 
1 1 1 -10 22 20 o 26.84382 5.557196 9.159713       3.515445 12.12070       6.993441 8.158534       4.066572 30.91451 8.839345 25.29443 6.547053 5.620087       10.99991 
1 1 1 -10 22 21 o 64.92388 3.084384 51.58235       4.865924 55.11366       9.155325 50.19213       5.744437 66.78136 5.679610 63.97934 3.700228 2.802013       6.778618 
1 1 1 -10 22 22 o 91.16386 3.674088 101.7511       8.145502 108.0198       11.48356 95.40338       11.55574 93.73984 5.045679 88.01814 5.413722 5.721695       7.400490 
1 1 1 -10 22 23 o 134.4309 3.270176 220.8020       10.71288 221.3017       16.26483 220.4190       14.23739 134.2486 4.980321 134.1004 4.362571 0.1481476      6.620848 
1 1 1 -10 22 24 o 36.75166 4.988352 16.87011       4.352334 16.56994       7.607102 17.01619       5.306719 35.79054 8.787608 36.69229 6.152513 -0.9017448     10.72732 
1 1 1 -10 22 25 o 65.49960 3.898927 52.70093       6.195126 72.80698       14.49060 48.20401       6.852996 76.18401 7.920737 62.54112 4.527188 13.64289       9.123240 
1 1 1 -10 22 26 o 76.99023 3.330768 72.63442       6.234296 73.62814       10.17363 72.03689       7.889056 77.15456 5.446002 76.53693 4.246427 0.6176300      6.905872 
1 1 1 -10 22 27 o 75.74508 3.284973 70.33406       6.049070 76.09325       10.16279 67.17417       7.527796 78.40787 5.350910 73.87686 4.198701 4.531006       6.801568 
1 1 1 -10 22 28 o 40.03917 4.981293 20.04611       4.755500 11.06390       10.02855 22.65179       5.401404 30.79147 10.80453 42.52520 5.328923 -11.73374      12.04721 
1 1 1 -10 22 29 o 45.80008 4.119979 25.99270       4.549207 27.35964       7.763618 25.27794       5.613973 46.27372 7.112120 44.93245 5.224439 1.341267       8.824796 
1 1 1 -10 22 30 o 92.16006 4.045092 104.7664       9.062500 110.5570       11.21992 93.89791       15.37130 94.41386 4.893305 86.00487 7.406249 8.408989       8.876765 
1 1 1 -10 22 31 o 106.3279 3.196852 138.9715       8.273938 148.7113       13.22465 132.7069       10.60615 109.3197 4.977260 103.5673 4.211197 5.752396       6.519762 
1 1 1 -10 22 32 o 47.43544 4.410841 28.14099       5.040290 29.67910       7.665162 26.96934       6.690025 47.93748 6.748123 45.88453 6.136818 2.052944       9.121277 
1 1 1 -10 22 33 o 17.03532 6.422608 2.851272       3.634543 4.156549       6.322419 2.207004       4.441862 21.34892 8.360119 17.35339 6.939647 3.995527       10.86509 
1 1 1 -10 22 34 o 56.24067 3.809608 39.49601       5.190346 38.14033       8.214672 40.39687       6.696355 54.12663 6.348437 56.43363 4.918363 -2.307007      8.030750 
1 1 1 -10 22 35 o 26.31227 6.224867 9.324791       3.928596 7.622337       6.623884 10.24862       4.879444 24.39183 8.758533 27.29874 7.223711 -2.906904      11.35314 
1 1 1 -10 22 36 o 37.77295 5.613386 18.86755       5.010186 35.05619       11.51826 15.08980       5.564146 48.07235 10.15126 32.93327 7.139382 15.13908       12.41043 
1 1 1 -10 22 37 o 41.66401 4.537043 22.50857       4.532167 20.77352       7.041039 23.73599       5.922112 37.84024 7.891536 41.92348 5.964829 -4.083237      9.892196 
1 1 1 -10 22 38 o 17.57499 6.615162 3.706515       3.852212 1.195170       5.848881 5.630493       5.119407 17.22211 7.484700 20.55582 7.648567 -3.333710      10.70146 
1 1 1 -10 22 39 o 14.79151 6.182265 1.531580       3.724147 0.2036020      5.581820 2.596983       4.999623 15.95992 7.107834 17.16639 7.168135 -1.206470      10.09472 
1 1 1 -10 22 40 o 13.62899 5.890799 0.6866674      3.582990 1.929278       5.558034 -0.1969299     4.686849 16.86682 7.313484 14.40956 6.458410 2.457253       9.756952 
1 1 1 -10 22 41 o 24.29292 7.344134 9.633344       4.715384 5.435525       6.065121 16.04795       7.497433 19.49220 7.993629 29.02627 9.337238 -9.534061      12.29155 
1 1 1 -10 22 42 o 20.62544 6.786467 6.916606       3.948718 8.274288       5.826909 5.763615       5.369727 21.46758 8.123561 19.08218 7.630409 2.385401       11.14520 
1 1 1 -10 22 43 o 14.10095 6.332297 0.7815606      4.529561 -0.6391489     5.676449 3.271796       7.515266 14.32037 6.670723 17.46772 7.968064 -3.147347      10.39176 
1 1 1 -10 22 44 o 11.22890 5.277061 -1.758083      3.685412 0.9408109      6.260120 -3.189618      4.559221 15.25030 7.070146 11.65269 5.586976 3.597616       9.011174 
1 1 1 -10 23 1  o 244.5271 4.134430 730.2657       24.63648 737.0922       34.79986 723.4067       34.88279 245.3848 5.819608 243.0826 5.888723 2.302170       8.279184 
1 1 1 -10 23 2  o 141.4966 2.831306 244.2147       9.762674 248.1477       15.13726 241.4137       12.77452 142.4581 4.365527 140.5770 3.732317 1.881134       5.743519 
1 1 1 -10 23 3  o 186.3768 3.162618 423.8161       14.36397 433.8670       22.52284 416.9255       18.64864 188.3307 4.911757 184.7662 4.141796 3.564529       6.424938 
1 1 1 -10 23 4  o 225.0984 3.941026 618.6754       21.61812 628.0447       42.81312 615.4689       25.04550 225.9790 7.786137 224.4320 4.579404 1.546982       9.032988 
1 1 1 -10 23 5  f 146.4158 2.878480 261.4993       10.27040 272.9302       16.17567 253.7787       13.29379 149.3996 4.447959 144.1294 3.788234 5.270126       5.842522 
1 1 1 -10 23 6  o 211.9741 3.843708 548.5895       19.85497 572.8776       40.26836 540.7881       22.82203 215.8360 7.668223 210.3892 4.451381 5.446793       8.866590 
1 1 1 -10 23 7  o 77.19720 3.212501 72.84106       6.030188 61.29684       11.51439 77.20390       7.078540 70.38222 6.797888 79.44276 3.666282 -9.060547      7.723529 
1 1 1 -10 23 8  o 69.22884 3.127873 58.59473       5.263189 60.05214       9.245376 57.89597       6.401777 69.84532 5.475636 68.75470 3.836078 1.090622       6.685663 
1 1 1 -10 23 9  o 98.69604 3.247155 118.9951       7.799149 127.2205       11.90672 112.8139       10.32165 101.9012 4.808431 95.98717 4.424554 5.914047       6.534347 
1 1 1 -10 23 10 o 90.45609 3.240654 99.97781       7.131882 94.72720       10.50835 104.4617       9.710808 87.88008 4.926632 92.36540 4.326317 -4.485321      6.556579 
1 1 1 -10 23 11 o 138.6992 2.924528 234.7014       9.884757 230.9131       16.33623 236.8895       12.41549 137.3302 4.889261 139.2454 3.662048 -1.915192      6.108639 
1 1 1 -10 23 12 o 183.1362 3.209626 409.3143       14.32401 399.8911       23.13077 415.1757       18.24287 180.6946 5.258610 184.3533 4.060749 -3.658707      6.643994 
1 1 1 -10 23 13 o 165.8907 3.078306 335.8282       12.44429 324.5580       20.08595 342.8492       15.85349 162.7919 5.069361 167.5399 3.883029 -4.748047      6.385635 
1 1 1 -10 23 14 o 17.92541 6.731397 2.912550       3.983746 6.534149       6.588296 0.8252158      5.001716 24.68194 8.748907 17.28763 7.190299 7.394314       11.32448 
1 1 1 -10 23 15 o 110.2479 3.587541 148.5880       9.625526 187.4659       19.28437 135.6882       11.10821 123.4270 6.433706 105.2655 4.339644 18.16145       7.760482 
1 1 1 -10 23 16 o 282.7868 6.501148 981.9560       44.80075 0.000000       0.000000 981.9560       44.80075 ?        ?        282.7868 6.501148 0.000000       6.501148 
1 1 1 -10 23 17 o 136.8659 3.609796 228.9748       12.02914 0.000000       0.000000 228.9748       12.02914 ?        ?        136.8659 3.609796 0.000000       3.609796 
1 1 1 -10 23 18 o 83.28761 2.982729 84.78171       6.044057 86.08841       10.54259 84.14196       7.376684 83.66904 5.196310 82.90790 3.660167 0.7611465      6.355978 
1 1 1 -10 23 19 o 225.7555 3.587238 622.6923       19.73489 632.9673       32.40322 616.6337       24.88201 227.0180 5.862130 224.4678 4.548783 2.550156       7.419972 
1 1 1 -10 23 20 o 211.7149 3.458243 547.6395       17.84198 537.8060       28.92709 553.6776       22.66722 209.2469 5.678206 212.7052 4.373047 -3.458237      7.166977 
1 1 1 -10 23 21 o 116.7452 3.132891 166.5860       8.904875 184.0440       14.33748 155.6222       11.36205 122.4612 4.813764 112.7018 4.144095 9.759415       6.351838 
1 1 1 -10 23 22 o 86.38060 2.853963 91.21127       5.999348 92.41640       10.79715 90.67301       7.215770 86.63822 5.137093 86.06098 3.447626 0.5772400      6.186748 
1 1 1 -10 23 23 o 55.13923 3.332731 37.29784       4.457227 41.73870       8.823130 35.77620       5.164706 57.85533 6.363029 53.92200 3.958038 3.933331       7.493611 
1 1 1 -10 23 24 o 55.42756 4.258727 37.86351       5.708234 37.23820       11.91262 38.04987       6.503486 53.81708 9.426808 55.46986 4.860253 -1.652782      10.60598 
1 1 1 -10 23 25 o 12.73820 5.693827 -1.516227      3.616315 4.647360       7.307400 -3.515361      4.161664 23.41504 9.038312 12.44649 5.768314 10.96856       10.72215 
1 1 1 -10 23 26 o 71.82275 3.702173 63.36292       6.457833 69.79844       13.88768 61.58746       7.294445 74.41871 7.772387 70.71537 4.252592 3.703339       8.859715 
1 1 1 -10 23 27 o 75.28542 3.740852 69.67152       6.841558 49.95932       13.45147 76.55017       7.946092 62.27067 9.135971 78.84531 4.150245 -16.57463      10.03447 
1 1 1 -10 23 28 o 45.92727 4.100801 26.13322       4.541373 35.58740       8.262719 22.04108       5.436080 53.06941 6.526431 41.86246 5.458635 11.20695       8.508289 
1 1 1 -10 23 29 o 70.13671 4.559573 60.97934       7.750778 63.79773       9.719016 56.05525       12.84650 71.43195 5.628787 66.00137 8.160896 5.430573       9.913801 
1 1 1 -10 23 30 o 51.72250 3.782686 33.12584       4.734810 46.28809       8.305554 26.78879       5.762977 60.63697 5.687134 46.13207 5.217832 14.50490       7.718112 
1 1 1 -10 23 31 o 61.92786 3.499454 47.40031       5.259587 43.25214       8.639555 49.84295       6.629682 58.27352 6.177926 63.27554 4.325541 -5.002018      7.541689 
1 1 1 -10 23 32 o 16.77723 6.406454 2.628382       3.644218 -1.364348      6.571008 4.401914       4.379420 17.51358 7.760757 19.77008 7.118843 -2.256506      10.53125 
1 1 1 -10 23 33 o 91.12512 3.239036 102.7532       7.181228 102.1100       11.13760 103.2109       9.394914 89.82393 5.109265 90.82484 4.256591 -1.000908      6.650049 
1 1 1 -10 23 34 o 26.33596 6.203970 9.319167       3.915606 15.57037       6.568645 5.873444       4.876791 33.34290 8.153235 21.63150 7.538401 11.71139       11.10418 
1 1 1 -10 23 35 o 55.32947 4.346999 38.95545       5.814105 45.43435       11.98593 36.96188       6.648711 56.13898 9.070490 53.42204 5.171787 2.716949       10.44132 
1 1 1 -10 23 36 o 47.17457 4.546992 28.73804       5.162501 26.30734       7.419834 31.01888       7.187468 43.30420 7.289845 47.83220 6.320779 -4.528004      9.648528 
1 1 1 -10 23 37 o 25.07018 7.171055 9.173500       4.601877 10.97765       8.908525 8.516848       5.374487 26.45531 10.03685 24.02258 7.918058 2.432726       12.78413 
1 1 1 -10 23 38 f 23.03463 6.386084 7.704908       3.709213 5.240292       5.668718 9.550177       4.905011 20.12800 7.905955 25.03484 7.472756 -4.906839      10.87870 
1 1 1 -10 23 39 o 57.16765 3.798191 42.42175       5.261302 40.81461       8.050481 43.61995       6.951185 53.32700 6.317532 56.62658 5.091664 -3.299572      8.113954 
1 1 1 -10 23 40 o 26.64624 6.391297 10.70862       4.096677 6.050851       6.002254 14.77061       5.605253 20.20086 8.070816 30.23349 7.613619 -10.03263      11.09528 
1 1 1 -10 23 41 o 48.40791 4.273835 31.77063       4.989891 36.01616       7.602426 28.55736       6.613926 48.38898 6.620606 43.24688 6.474676 5.142101       9.260338 
1 1 1 -10 23 42 o 20.17140 7.227252 7.020810       4.507508 7.895370       5.853621 5.746797       7.065075 20.64639 8.056070 18.95347 8.231743 1.692917       11.51789 
1 1 1 -10 23 43 o 22.06476 6.863849 8.492255       4.081969 15.61055       6.582189 4.043784       5.203406 27.28135 8.746150 16.83304 7.184054 10.44832       11.31838 
1 1 1 -10 24 1  o 125.1977 2.767001 191.2088       8.441932 198.9938       12.98615 185.5111       11.10967 127.5569 4.183386 123.2058 3.704482 4.351143       5.587836 
1 1 1 -10 24 2  o 115.4608 3.014291 162.7675       8.473921 144.6753       11.22133 186.7765       12.92665 108.7365 4.242945 123.5636 4.299539 -14.82708      6.040581 
1 1 1 -10 24 3  o 236.4433 4.087683 682.8922       23.55268 639.7805       44.72330 699.4375       27.70597 227.8933 8.065878 239.1847 4.753395 -11.29141      9.362327 
1 1 1 -10 24 4  o 192.1861 3.234382 450.7475       15.14779 464.0974       23.94928 441.8458       19.55652 194.7264 5.051244 190.1739 4.219924 4.552505       6.582007 
1 1 1 -10 24 5  o 145.9583 2.880631 259.9014       10.24596 257.4821       15.80450 261.6553       13.45691 145.0806 4.475640 146.3357 3.776783 -1.255127      5.856232 
1 1 1 -10 24 6  o 140.2590 2.840611 239.9952       9.709093 225.8414       14.74490 250.8297       12.90063 135.8655 4.459493 143.2815 3.697839 -7.416016      5.793193 
1 1 1 -10 24 7  o 256.2455 4.335485 802.3837       27.07259 799.6688       54.17830 803.2872       31.25438 254.5337 8.747619 256.2659 5.004768 -1.732162      10.07812 
1 1 1 -10 24 8  o 62.32077 3.534757 47.56751       5.346188 40.16188       10.17864 50.38885       6.282563 56.67200 7.558599 64.09911 4.042653 -7.427109      8.571783 
1 1 1 -10 24 9  o 215.2864 4.583922 566.6263       24.04860 563.9145       29.81871 571.6722       40.67468 214.4978 5.709739 215.4349 7.760363 -0.9371185     9.634540 
1 1 1 -10 24 10 o 111.5852 3.229847 152.0972       8.773390 150.2202       12.92136 153.7026       11.95035 110.7241 4.800239 112.0540 4.384866 -1.329872      6.501488 
1 1 1 -10 24 11 o 163.4991 3.509210 326.3889       13.98173 331.2887       20.84685 322.3828       18.84992 164.4362 5.209007 162.2811 4.771746 2.155106       7.064228 
1 1 1 -10 24 12 o 57.49417 4.226377 40.61728       5.880069 40.45256       10.97023 40.68368       6.965119 56.73270 8.170237 57.44178 5.026412 -0.7090797     9.592580 
1 1 1 -10 24 13 o 176.3143 4.041758 379.8821       17.36576 391.0037       31.44231 375.0004       20.83121 178.1566 7.257490 174.9922 4.889737 3.164413       8.751040 
1 1 1 -10 24 14 o 118.2990 3.715297 171.1232       10.69725 184.3952       19.85385 165.6942       12.69802 122.3322 6.685310 116.3101 4.488470 6.022118       8.052313 
1 1 1 -10 24 15 o 173.3703 3.478851 367.0906       14.69761 369.1276       30.75531 366.4878       16.73186 173.0108 7.311238 173.1673 3.964991 -0.1565247     8.317172 
1 1 1 -10 24 16 o 69.24011 4.015937 58.79960       6.747036 61.61979       13.88023 57.92708       7.720525 70.16631 8.276769 68.64673 4.642512 1.519577       9.489880 
1 1 1 -10 24 17 o 110.7645 2.880882 149.8504       7.769506 158.7406       13.48649 145.4341       9.505348 113.7534 4.876502 109.0466 3.581868 4.706787       6.050624 
1 1 1 -10 24 18 f 129.3126 2.907981 204.1320       9.163651 216.8649       15.94820 197.8562       11.19645 132.9591 4.930725 127.1927 3.615955 5.766350       6.114505 
1 1 1 -10 24 19 o 154.2029 3.019938 290.3569       11.34819 313.3117       19.56465 278.7183       13.93115 159.7981 5.030435 150.9397 3.790452 8.858368       6.298635 
1 1 1 -10 24 20 o 149.4115 3.333892 272.7743       12.13868 268.9766       18.23306 275.7974       16.26790 148.0100 5.062582 150.0056 4.455225 -1.995544      6.743794 
1 1 1 -10 24 21 o 102.7871 2.864545 129.1235       7.168145 117.3587       12.15342 135.3993       8.876453 97.65543 5.124941 105.1838 3.467756 -7.528381      6.187920 
1 1 1 -10 24 22 o 104.2920 2.834396 132.9406       7.196891 150.7508       13.20002 125.4068       8.585161 110.7317 4.903941 101.2101 3.486080 9.521629       6.016760 
1 1 1 -10 24 23 o 73.21890 3.263869 65.67438       5.808970 62.58036       14.29359 66.28651       6.357679 70.37499 8.507079 73.52280 3.559037 -3.147804      9.221558 
1 1 1 -10 24 24 o 114.1301 2.846512 159.1809       7.916790 160.8793       14.15471 158.4077       9.550241 114.2555 5.096621 113.7222 3.450129 0.5332489      6.154587 
1 1 1 -10 24 25 o 58.17215 3.798677 41.64980       5.355516 42.29282       9.207545 41.32103       6.583761 58.03841 6.628910 57.78455 4.716471 0.2538567      8.135572 
1 1 1 -10 24 26 o 91.73661 3.265507 103.1826       7.288465 100.6024       11.60234 104.8646       9.367478 90.12069 5.306539 92.30071 4.175492 -2.180023      6.752339 
1 1 1 -10 24 27 o 126.3843 3.664480 196.2191       11.27413 244.5809       23.52727 181.8038       12.84495 139.6885 6.933208 121.4470 4.347209 18.24146       8.183372 
1 1 1 -10 24 28 o 72.61086 5.277511 65.72780       9.274532 54.88216       13.21334 76.26015       13.02111 65.11857 8.531687 77.61895 6.957784 -12.50038      11.00911 
1 1 1 -10 24 29 o 92.18822 3.229434 104.5165       7.243804 105.0661       11.75856 104.1804       9.196020 91.72718 5.282761 91.77394 4.122441 -0.4676056E-01 6.700902 
1 1 1 -10 24 30 o 9.047813 4.414161 -5.736875      3.174849 -2.480956      6.552049 -6.735928      3.629399 16.92606 7.607213 9.583322 4.684945 7.342740       8.934114 
1 1 1 -10 24 31 o 61.92351 3.862952 47.67580       5.800194 51.32597       8.756207 44.82190       7.742448 63.52357 5.717581 59.46828 5.401520 4.055294       7.865568 
1 1 1 -10 24 32 o 36.63391 4.909441 17.15045       4.272566 20.47456       7.459466 15.52748       5.212255 38.69090 8.168379 34.25925 6.480579 4.431644       10.42690 
1 1 1 -10 24 33 o 12.41165 5.548771 -1.139436      3.435899 -0.8567501     5.915084 -1.283388      4.221028 16.67724 7.378021 13.76049 6.151082 2.916753       9.605780 
1 1 1 -10 24 34 o 30.45306 6.482898 12.62427       4.663299 24.68534       10.84490 9.888313       5.165206 39.75620 10.87969 26.56324 7.597035 13.19296       13.26962 
1 1 1 -10 24 35 o 43.40022 5.114662 24.66788       5.305588 24.77839       11.39812 24.63732       5.994617 38.50871 11.36576 42.90600 5.888503 -4.397289      12.80058 
1 1 1 -10 24 36 o 71.51633 3.924145 65.33610       6.812693 63.52624       12.54835 66.09254       8.112402 66.04892 7.956295 71.22429 4.700236 -5.175369      9.240933 
1 1 1 -10 24 37 o 23.06208 7.041430 7.861008       4.320110 8.451503       5.996296 7.223692       6.229492 23.53930 8.346321 22.31551 8.409471 1.223787       11.84822 
1 1 1 -10 24 38 o 13.56010 5.921864 0.3191843      3.699239 -1.479294      5.741237 1.595861       4.837191 15.03332 6.897672 16.06885 6.893795 -1.035529      9.752041 
1 1 1 -10 24 39 o 38.17838 5.011717 20.08702       4.550246 17.24928       7.158287 22.01111       5.894345 31.33494 8.937532 38.56267 6.503488 -7.227732      11.05327 
1 1 1 -10 24 40 o 20.14513 7.191101 6.470608       4.458246 2.975826       6.022624 10.70713       6.631018 17.42395 7.583476 24.00181 8.743304 -6.577864      11.57387 
1 1 1 -10 24 41 o 29.42763 6.178762 13.41266       4.289589 21.13338       6.802160 8.315001       5.527177 34.33284 8.236035 21.38728 7.949376 12.94556       11.44661 
1 1 1 -10 24 42 o 13.79605 6.262360 0.3416474      4.571127 3.584595       5.733259 -5.316955      7.573318 16.83748 7.362304 14.03484 6.840644 2.802649       10.04977 
1 1 1 -10 24 43 o 17.37204 6.531488 5.008045       3.753088 11.72289       6.213402 1.150770       4.709250 23.24248 8.463984 14.23928 6.420156 9.003195       10.62344 
1 1 1 -10 25 1  o 32.50661 4.657773 13.18285       3.584360 11.87037       4.985004 14.58773       5.157495 30.49409 6.873288 33.92501 6.474669 -3.430922      9.442638 
1 1 1 -10 25 2  o 92.70691 3.551946 105.0974       8.009592 133.6069       13.91564 90.97301       9.794743 104.3063 5.494025 86.12167 4.684711 18.18462       7.220168 
1 1 1 -10 25 3  o 137.7725 3.154341 231.6649       10.59027 212.7467       14.22367 255.1982       15.86406 131.8458 4.433302 144.4044 4.513690 -12.55861      6.326734 
1 1 1 -10 25 4  o 160.2181 3.315413 313.3529       12.94450 310.7032       18.00702 316.1864       18.62101 159.3309 4.642683 160.7136 4.759850 -1.382721      6.649110 
1 1 1 -10 25 5  o 44.13766 4.077561 24.00476       4.336213 26.01672       5.729609 21.30754       6.633971 45.81036 5.225811 41.11525 6.862916 4.695110       8.626048 
1 1 1 -10 25 6  o 382.3091 5.875974 1791.355       54.74325 1742.190       75.88260 1844.714       79.05192 375.9431 8.282931 386.7903 8.386888 -10.84720      11.78757 
1 1 1 -10 25 7  o 93.82294 3.667390 107.6679       8.368834 90.06521       13.73908 118.0519       10.55241 85.39799 6.654471 98.16769 4.422457 -12.76970      7.990001 
1 1 1 -10 25 8  o 183.4018 4.223021 411.1132       18.87395 417.8336       32.36325 407.6494       23.23419 184.2082 7.223536 182.4024 5.232508 1.805771       8.919563 
1 1 1 -10 25 9  o 36.98097 5.078790 17.04863       4.456170 12.96497       8.143918 18.79381       5.323874 32.17221 9.634991 38.73600 5.819723 -6.563782      11.25621 
1 1 1 -10 25 10 o 108.1004 3.158404 142.7631       8.311228 166.4144       17.80955 136.1781       9.397268 116.2801 6.308720 105.5270 3.659819 10.75302       7.293437 
1 1 1 -10 25 11 o 58.35682 3.515066 41.73976       4.975574 46.11420       9.173767 39.91666       5.922315 60.98367 6.261888 56.97843 4.296919 4.005234       7.594389 
1 1 1 -10 25 12 o 78.73579 3.485410 75.85861       6.670902 66.75101       10.10181 82.90165       8.883366 73.57420 5.678172 82.21059 4.450781 -8.636383      7.214644 
1 1 1 -10 25 13 o 141.5528 3.395630 244.6989       11.71318 238.4981       17.03241 250.2628       16.13396 139.4710 5.019553 142.9381 4.638014 -3.467163      6.834258 
1 1 1 -10 25 14 o 32.63823 5.034679 13.34701       3.875738 9.579027       7.118130 14.93483       4.620748 28.18067 9.100930 34.44878 5.703718 -6.268114      10.74055 
1 1 1 -10 25 15 o 75.55077 4.076706 69.99500       7.477783 76.24921       15.33687 68.04456       8.564787 78.14497 8.174578 74.40195 4.748635 3.743011       9.453743 
1 1 1 -10 25 16 o 64.50523 3.340702 50.96051       5.233431 48.83195       9.489294 51.89093       6.273827 62.72273 6.293235 65.02385 3.978392 -2.301117      7.445294 
1 1 1 -10 25 17 o 146.5126 3.020079 262.1141       10.78275 267.6476       18.25596 259.1494       13.36263 147.6754 5.080515 145.5461 3.770694 2.129303       6.326909 
1 1 1 -10 25 18 o 66.28187 3.231858 53.79652       5.204415 61.61155       9.647155 50.58839       6.181012 70.60649 5.654061 64.18697 3.971079 6.419525       6.909260 
1 1 1 -10 25 19 o 55.67669 3.531910 38.04842       4.767325 32.20451       8.764000 40.50434       5.681428 50.54553 7.328657 57.38346 4.089692 -6.837933      8.392544 
1 1 1 -10 25 20 o 127.8760 3.261094 199.9801       10.15392 211.7429       15.94524 191.9564       13.16931 131.2643 4.993914 125.1067 4.326138 6.157646       6.607166 
1 1 1 -10 25 21 o 33.83601 4.808711 14.32359       3.853495 11.39891       7.350642 15.43199       4.525159 30.10498 9.183588 35.01916 5.482364 -4.914173      10.69554 
1 1 1 -10 25 22 o 30.11777 5.655212 11.52722       3.998188 24.80060       10.93189 9.477563       4.295808 43.47595 10.44846 27.15647 6.564597 16.31948       12.33954 
1 1 1 -10 25 23 o 66.08724 3.145454 53.53602       5.051132 47.05024       9.711110 55.94151       5.914111 61.29704 6.605349 67.49624 3.608738 -6.199200      7.526860 
1 1 1 -10 25 24 o 79.11387 2.950166 76.65157       5.677717 87.32667       10.93414 72.71052       6.643610 83.97666 5.371216 76.96149 3.551954 7.015175       6.439436 
1 1 1 -10 25 25 o 56.24412 3.337501 38.88835       4.553837 35.03487       9.033601 40.20120       5.272810 52.49457 7.255507 57.11344 3.810297 -4.618870      8.195167 
1 1 1 -10 25 26 o 28.72370 7.062789 10.73528       4.908575 12.68644       11.13435 10.26460       5.468672 32.44344 11.38460 28.10286 7.739895 4.340582       13.76645 
1 1 1 -10 25 27 o 55.24907 5.330584 38.23174       7.087874 48.33321       8.983042 21.56969       11.53707 61.96076 6.025368 39.77810 11.34671 22.18266       12.84729 
1 1 1 -10 25 28 o 44.63268 4.158198 24.80846       4.470629 25.76336       7.970490 24.37015       5.400060 44.42220 7.638204 43.98617 5.134311 0.4360275      9.203440 
1 1 1 -10 25 29 o 68.58714 3.769987 58.24875       6.276898 58.84267       13.10541 58.07195       7.150393 67.01640 8.195088 68.31361 4.317315 -1.297218      9.262758 
1 1 1 -10 25 30 o 26.78766 6.213305 9.462496       3.977162 19.93227       7.434417 5.264842       4.707406 38.39577 8.195227 21.09423 7.402434 17.30154       11.04345 
1 1 1 -10 25 31 o 27.86823 6.006330 10.26463       3.958665 12.17102       7.294578 9.468813       4.713057 29.68965 9.165586 26.51110 7.137776 3.178545       11.61705 
1 1 1 -10 25 32 o 50.75689 3.894404 32.33893       4.780156 33.05415       8.256021 31.97826       5.862815 49.77023 7.000341 50.06528 4.866784 -0.2950478     8.525865 
1 1 1 -10 25 33 o 21.10107 6.853464 5.886295       4.033175 13.22879       10.34201 4.569327       4.379967 30.02546 10.92188 19.56858 7.109254 10.45688       13.03185 
1 1 1 -10 25 34 o 16.10142 6.623377 1.773718       4.180470 -2.542609      8.676456 3.078693       4.770747 18.58406 8.509166 18.08313 7.205122 0.5009251      11.14987 
1 1 1 -10 25 35 o 44.14745 4.383206 25.26890       4.653354 11.98284       6.823495 36.81984       6.362350 27.84756 8.902697 52.90958 4.993614 -25.06201      10.20755 
1 1 1 -10 25 36 o 20.39218 6.709117 5.893035       3.859251 4.023415       6.238066 7.052328       4.912129 19.56111 8.073154 21.99246 7.570704 -2.431356      11.06758 
1 1 1 -10 25 37 o 24.13353 6.648396 8.645600       4.034435 6.415957       6.516315 10.03152       5.137510 21.34793 8.448153 25.35022 7.666254 -4.002293      11.40801 
1 1 1 -10 25 38 o 35.12199 5.335731 17.22120       4.423301 12.69688       7.064357 20.13887       5.673023 26.70091 9.082083 36.91116 6.546676 -10.21024      11.19568 
1 1 1 -10 25 39 o 15.90384 6.748227 2.306273       4.545148 -1.113530      6.231097 6.194804       6.644414 15.25848 7.066909 20.19082 8.332390 -4.932343      10.92565 
1 1 1 -10 25 40 o 29.89646 5.916663 13.49015       4.157901 18.34089       6.754404 10.53043       5.276045 31.51692 8.570250 24.28741 7.834606 7.229507       11.61164 
1 1 1 -10 25 41 o 14.76364 6.561416 1.414928       4.731472 2.066148       6.035978 0.3770140      7.620168 16.13072 7.271122 16.23058 7.615098 -0.9985542E-01 10.52896 
1 1 1 -10 25 42 o 16.20470 6.531424 3.902522       3.967389 7.402355       6.510978 1.835636       5.003580 19.44103 8.153336 15.01197 6.704711 4.429061       10.55604 
1 1 1 -10 26 1  o 152.9019 3.358461 285.4739       12.51380 324.8418       25.45170 272.9232       14.37075 162.5130 6.439515 149.3896 3.950977 13.12346       7.554970 
1 1 1 -10 26 2  o 139.7858 3.202610 238.5476       10.90946 257.2207       15.53100 220.3604       15.32763 144.9630 4.401591 134.1208 4.696923 10.84218       6.437010 
1 1 1 -10 26 3  o 118.3154 2.799941 170.8163       8.072837 159.3215       11.84540 180.7856       11.03144 114.0749 4.268648 121.5932 3.727348 -7.518333      5.666964 
1 1 1 -10 26 4  o 131.3180 2.829828 210.4304       9.055670 209.1000       13.79599 211.4376       12.00358 130.6986 4.337586 131.5042 3.749544 -0.8056641     5.733562 
1 1 1 -10 26 5  o 183.1068 3.183206 409.3014       14.20382 406.8112       21.92618 411.1019       18.64487 182.2382 4.941839 183.3837 4.172175 -1.145462      6.467520 
1 1 1 -10 26 6  f 59.82819 3.094478 43.80843       4.496256 44.77893       6.562016 42.94955       6.173120 60.34195 4.494823 59.11153 4.315175 1.230419       6.230905 
1 1 1 -10 26 7  o 183.9536 4.185663 413.6900       18.76327 382.1945       30.79631 432.2836       23.66223 176.0973 7.191584 187.8063 5.175158 -11.70900      8.860086 
1 1 1 -10 26 8  o 96.51574 3.225620 113.8566       7.575945 124.5154       15.44700 110.4807       8.693287 100.5046 6.339283 95.01868 3.761821 5.485970       7.371418 
1 1 1 -10 26 9  o 86.16199 3.298989 90.78179       6.914005 77.69518       13.15699 95.77438       8.126539 79.19450 6.885886 88.45450 3.778779 -9.260002      7.854591 
1 1 1 -10 26 10 o 79.45679 3.392334 77.24211       6.553377 69.63054       13.42700 79.62231       7.508435 74.82040 7.463625 80.62885 3.832373 -5.808456      8.390040 
1 1 1 -10 26 11 o 105.9481 2.972789 137.1257       7.667676 129.9145       12.76469 141.1968       9.590844 102.8587 5.108510 107.4385 3.668584 -4.579773      6.289308 
1 1 1 -10 26 12 o 128.1299 3.393114 200.6629       10.58528 205.4446       15.76181 196.7345       14.28641 129.4120 5.007439 126.6966 4.635051 2.715439       6.823353 
1 1 1 -10 26 13 o 33.94041 5.340814 14.46003       4.271547 20.79752       8.162506 12.06991       5.012728 40.24891 8.584185 30.72014 6.868627 9.528776       10.99392 
1 1 1 -10 26 14 o 167.6814 4.091894 343.8998       16.72035 330.0586       30.71968 349.7263       19.93131 163.2972 7.741772 168.8980 4.847578 -5.600815      9.134224 
1 1 1 -10 26 15 o 131.2083 2.994293 210.2139       9.573964 198.6875       15.73496 216.9896       12.06411 127.2038 5.086347 133.1770 3.720965 -5.973206      6.302104 
1 1 1 -10 26 16 f 50.54057 3.812746 31.41311       4.661219 27.03028       8.262727 33.45895       5.645250 46.18443 7.606171 52.07975 4.491996 -5.895325      8.833565 
1 1 1 -10 26 17 o 107.1689 2.950042 140.3743       7.696968 137.9281       13.40796 141.5766       9.400146 105.8830 5.212394 107.5473 3.591771 -1.664268      6.330077 
1 1 1 -10 26 18 o 125.4999 2.952852 192.3824       9.030692 184.2132       15.22934 196.8126       11.21522 122.4000 5.117085 126.8049 3.633153 -4.404968      6.275696 
1 1 1 -10 26 19 o 134.6292 3.325937 221.5799       10.91162 228.2039       16.93212 216.8751       14.26989 136.2258 5.109593 132.9530 4.410500 3.272751       6.749848 
1 1 1 -10 26 20 o 64.62629 3.311489 51.20564       5.197784 52.16777       9.626652 50.80973       6.175300 64.74450 6.176247 64.28967 3.960905 0.4548264      7.337220 
1 1 1 -10 26 21 o 184.0797 3.279875 414.4947       14.71294 420.7471       24.73065 411.0693       18.30469 184.7309 5.499761 183.1157 4.102047 1.615204       6.861062 
1 1 1 -10 26 22 o 93.35985 2.919870 106.6685       6.634763 139.1070       12.93596 95.08924       7.728749 106.1980 5.012722 88.03721 3.610183 18.16077       6.177442 
1 1 1 -10 26 23 o 92.76621 3.338979 105.5179       7.535822 104.3137       11.94034 106.3151       9.715083 91.78068 5.361975 92.92446 4.301901 -1.143784      6.874382 
1 1 1 -10 26 24 o 13.79467 5.821031 0.2756072      3.351137 4.532775       7.518243 -0.7799115     3.743595 23.37450 9.127252 13.56939 5.940859 9.805112       10.89039 
1 1 1 -10 26 25 o 49.45593 4.801295 30.48285       5.713731 25.38870       11.73788 32.06475       6.540996 43.28344 11.08192 50.59190 5.388319 -7.308464      12.32245 
1 1 1 -10 26 26 o 61.42009 3.984387 46.66708       5.931411 36.51891       9.130527 54.07664       7.801865 53.35238 7.206858 65.89378 4.893607 -12.54140      8.711267 
1 1 1 -10 26 27 o 54.57053 3.343255 36.75128       4.424602 18.29144       8.538705 43.52747       5.173337 36.73238 9.476475 59.34965 3.593822 -22.61728      10.13504 
1 1 1 -10 26 28 o 88.19083 2.861983 95.61538       6.142583 82.75021       11.24528 101.0864       7.333279 80.94676 5.737979 90.54054 3.329348 -9.593781      6.633925 
1 1 1 -10 26 29 o 53.03753 4.321065 35.22980       5.536482 32.64996       8.375545 37.23194       7.378435 49.93100 7.081911 54.01141 5.691314 -4.080410      9.085402 
1 1 1 -10 26 30 o 26.69193 5.952936 9.427743       3.773464 9.035843       6.974994 9.589906       4.486753 26.30659 9.022614 26.70737 6.858641 -0.4007759     11.33351 
1 1 1 -10 26 31 o 50.12487 4.274806 31.73614       5.171844 39.36185       12.11891 30.03807       5.718753 52.29253 9.871943 48.48589 4.907551 3.806641       11.02449 
1 1 1 -10 26 32 o 47.37532 4.503428 28.66417       5.136687 30.43963       11.02482 28.17189       5.805304 44.86245 10.30210 46.61464 5.198930 -1.752182      11.53959 
1 1 1 -10 26 33 o 101.7747 3.713465 130.4727       9.194471 123.5149       18.27407 132.8311       10.63925 93.50558 8.099564 102.1427 4.283835 -8.637108      9.162651 
1 1 1 -10 26 34 f 41.77223 4.713685 22.83737       4.714565 21.23514       7.730856 23.78605       5.948779 37.39259 8.655343 41.78033 6.015958 -4.387741      10.54072 
1 1 1 -10 26 35 o 25.87752 6.951864 9.843850       4.476732 14.11979       9.850848 8.730905       5.025680 28.37279 10.59941 24.11577 7.632427 4.257019       13.06145 
1 1 1 -10 26 36 o 40.44963 4.804621 21.94681       4.643564 17.69604       7.403583 24.70341       5.962045 32.56073 9.020404 41.92336 6.007288 -9.362621      10.83768 
1 1 1 -10 26 37 o 14.13603 6.095078 0.8904034      3.817487 2.809701       6.335806 -0.2035022     4.783223 18.11556 7.831730 14.52566 6.516367 3.589897       10.18818 
1 1 1 -10 26 38 o 13.15434 5.846618 0.4983025E-01  3.757424 1.278239       6.155521 -0.6797175     4.743734 16.59851 7.423284 13.93670 6.347002 2.661803       9.766759 
1 1 1 -10 26 39 o 20.23045 6.942742 6.636977       4.130081 6.134907       6.539432 6.970125       5.326920 19.67657 8.205757 20.35427 7.752046 -0.6777000     11.28843 
1 1 1 -10 26 40 o 22.68429 8.586135 10.39200       6.510356 10.39200       6.510356 0.000000       0.000000 22.68429 8.586135 ?        ?        0.000000       8.586135 
1 1 1 -10 26 41 o 21.71104 6.950424 8.291751       4.157896 5.634101       6.694748 9.960588       5.305085 18.34413 7.989551 22.64301 7.864167 -4.298885      11.21062 
1 1 1 -10 27 1  o 66.33591 3.047431 53.83463       4.913115 61.38580       7.232335 47.36361       6.695109 70.72280 4.215589 62.06006 4.456672 8.662739       6.134583 
1 1 1 -10 27 2  o 71.13454 2.996701 61.87944       5.183059 63.76792       7.652269 60.27872       7.045209 72.06786 4.377901 70.08958 4.143299 1.978271       6.027681 
1 1 1 -10 27 3  o 48.92539 3.501883 29.38865       4.147539 33.35303       6.172952 26.12621       5.599850 51.95821 4.934468 45.90566 5.091314 6.052547       7.090167 
1 1 1 -10 27 4  o 63.69262 3.098768 49.64419       4.795225 54.36139       7.128078 45.74461       6.480962 66.51482 4.422746 60.99504 4.389581 5.519775       6.231300 
1 1 1 -10 27 5  o 101.9518 2.816662 126.9523       6.991160 125.7868       10.40429 127.9117       9.439900 101.3304 4.222694 102.2368 3.795585 -0.9064331     5.677818 
1 1 1 -10 27 6  o 96.68402 3.150037 114.2546       7.411846 123.4335       10.26092 104.2400       10.71787 100.3775 4.204134 92.15069 4.789240 8.226791       6.372720 
1 1 1 -10 27 7  o 42.44987 4.611017 22.31119       4.693364 23.81366       8.656306 21.68561       5.585637 43.15081 8.534479 41.67584 5.644859 1.474976       10.23239 
1 1 1 -10 27 8  o 153.5294 3.414738 287.9258       12.77571 292.5555       25.61802 286.3932       14.73936 154.0300 6.842101 153.0039 3.956440 1.026062       7.903655 
1 1 1 -10 27 9  o 160.9887 3.463625 316.6229       13.58821 315.8655       27.08506 316.8776       15.70802 160.0100 6.962855 160.9821 4.004127 -0.9721069     8.032084 
1 1 1 -10 27 10 o 104.6772 3.298092 133.9669       8.402502 122.3053       16.55519 138.0134       9.751922 99.43260 6.874656 106.1922 3.774443 -6.759552      7.842660 
1 1 1 -10 27 11 o 79.85490 3.180479 78.00217       6.176759 79.10390       10.51010 77.42087       7.634293 80.12407 5.414591 79.47160 3.954460 0.6524658      6.704890 
1 1 1 -10 27 12 o 37.13918 4.955498 17.19855       4.373108 21.89794       7.689970 14.95241       5.316454 41.42128 7.906756 34.28980 6.601934 7.131481       10.30060 
1 1 1 -10 27 13 o 167.6547 3.590220 343.5800       14.66807 347.7949       32.29526 342.4846       16.46420 167.4641 7.936308 167.3163 4.037998 0.1477203      8.904517 
1 1 1 -10 27 14 o 100.1663 3.018260 122.6514       7.358999 145.0542       13.53118 113.2421       8.769279 108.6187 5.126516 96.15658 3.749575 12.46214       6.351415 
1 1 1 -10 27 15 o 74.80158 3.214037 68.49305       5.844983 76.88448       10.68503 64.90978       6.982285 78.90605 5.593110 72.72662 3.954623 6.179428       6.849958 
1 1 1 -10 27 16 f 30.60001 5.639083 11.86907       4.050111 17.80594       7.820244 9.693007       4.734532 37.09775 8.786621 27.49213 7.037784 9.605616       11.25767 
1 1 1 -10 27 17 o 88.60036 3.041627 96.02787       6.557422 96.18964       11.72914 95.95432       7.908895 88.28569 5.478796 88.48598 3.675801 -0.2002945     6.597630 
1 1 1 -10 27 18 o 34.61158 5.638223 15.11697       4.591994 11.47751       7.562229 17.24277       5.779526 30.23548 9.331896 36.80197 6.690827 -6.566492      11.48266 
1 1 1 -10 27 19 f 91.79514 3.221499 103.1780       7.195154 105.7501       16.30833 102.5563       8.017677 92.00340 7.334617 91.46121 3.604348 0.5421829      8.172388 
1 1 1 -10 27 20 o 124.9406 2.958509 190.8530       9.007676 208.1845       16.04566 182.8777       10.88462 129.9639 5.076157 122.1376 3.661157 7.826218       6.258708 
1 1 1 -10 27 21 o 91.98544 2.959744 103.5941       6.625882 99.18700       11.72359 105.6625       8.031655 89.50353 5.400194 92.80154 3.558107 -3.298012      6.467010 
1 1 1 -10 27 22 o 91.37650 2.952071 102.2740       6.564885 108.9657       12.04422 99.44568       7.830313 93.78561 5.291414 89.99152 3.577732 3.794083       6.387427 
1 1 1 -10 27 23 f 63.94456 3.858526 50.41048       5.984608 56.02878       9.571879 46.80468       7.668228 66.91448 5.931417 61.31505 5.180490 5.599434       7.875226 
1 1 1 -10 27 24 o 61.40158 4.335094 46.71408       6.444859 41.63506       13.26415 48.28373       7.373791 55.94621 10.10071 62.28880 4.897216 -6.342590      11.22528 
1 1 1 -10 27 25 o 51.35814 3.535071 32.58655       4.397301 25.28079       8.482811 35.27110       5.142130 43.83269 8.244070 53.34494 3.984393 -9.512253      9.156423 
1 1 1 -10 27 26 o 35.81983 4.540703 16.14942       3.874605 4.946077       7.569020 20.12768       4.510373 23.43232 9.155647 40.00225 4.717549 -16.56994      10.29957 
1 1 1 -10 27 27 o 73.07941 3.024882 65.78436       5.375263 53.51512       10.08632 70.65118       6.352524 64.62488 6.492542 75.61533 3.456611 -10.99046      7.355357 
1 1 1 -10 27 28 o 74.55743 2.980466 68.55611       5.404246 49.03148       9.781164 77.13554       6.483779 61.54262 6.626256 78.95927 3.377485 -17.41665      7.437383 
1 1 1 -10 27 29 o 17.78845 5.913922 3.897725       2.996268 0.2866533      7.011256 4.704563       3.314142 18.95278 8.216063 19.26709 6.208868 -0.3143158     10.29824 
1 1 1 -10 27 30 o 12.76960 5.658946 -0.8397654     3.494348 -3.935028      6.633237 0.3491417      4.111031 15.89203 7.335955 14.89432 6.371864 0.9977140      9.716835 
1 1 1 -10 27 31 o 52.72527 4.340152 35.36025       5.527143 29.22771       11.70704 37.11927       6.269918 43.17747 11.07396 53.75991 4.837626 -10.58245      12.08450 
1 1 1 -10 27 32 o 78.00565 4.352652 77.69617       8.241199 0.000000       0.000000 77.69617       8.241199 ?        ?        78.00565 4.352652 0.000000       4.352652 
1 1 1 -10 27 33 o 40.19764 4.771926 21.20116       4.583349 16.04518       7.444601 24.34840       5.816349 32.00966 9.109447 42.44771 5.772319 -10.43805      10.78433 
1 1 1 -10 27 34 o 44.85785 4.832082 26.68900       5.198906 32.21709       11.19315 25.16834       5.870572 43.04667 10.71308 42.83671 5.770403 0.2099609      12.16830 
1 1 1 -10 27 35 o 64.42398 3.643109 53.30242       5.696164 49.31555       8.873799 56.09648       7.428666 59.13100 6.252874 64.98401 4.723274 -5.853012      7.836309 
1 1 1 -10 27 36 o 38.06454 4.885675 19.71984       4.427539 14.59731       6.850935 23.39380       5.801961 29.10927 8.863175 40.41302 6.079539 -11.30375      10.74787 
1 1 1 -10 27 37 o 14.91190 6.281928 1.816229       3.892306 1.074625       6.193710 2.300260       5.003819 16.55761 7.422532 16.39794 7.022781 0.1596699      10.21829 
1 1 1 -10 27 38 o 16.77785 6.914984 3.465915       4.568277 3.653753       6.293421 3.256714       6.641675 17.88989 7.769517 17.81063 7.851388 0.7926178E-01  11.04580 
1 1 1 -10 27 39 f 21.44620 7.695395 8.284244       5.112425 6.536480       6.342915 11.52503       8.637195 19.52788 8.107491 22.72310 9.449694 -3.195223      12.45103 
1 1 1 -10 27 40 o 14.72826 6.642990 1.137561       5.047001 -8.028090      6.273529 17.95213       8.497148 12.00656 5.926519 26.93647 9.883918 -14.92991      11.52456 
1 1 1 -10 28 1  o 207.0269 3.430767 523.6973       17.30829 537.0696       26.98936 514.3560       22.55770 209.1815 5.298867 204.9615 4.516336 4.219925       6.962420 
1 1 1 -10 28 2  o 71.68990 2.978847 62.86041       5.192720 53.74877       7.222152 72.61188       7.471421 66.10686 4.510171 76.94896 3.998126 -10.84210      6.027160 
1 1 1 -10 28 3  o 166.2998 3.111460 337.7370       12.60933 333.1628       19.14424 341.2418       16.75770 164.8490 4.770596 167.0179 4.117326 -2.168915      6.301663 
1 1 1 -10 28 4  o 159.5154 3.424417 310.8906       13.31145 314.4381       18.28206 306.8876       19.41988 160.1628 4.689162 158.1517 5.045364 2.011063       6.887956 
1 1 1 -10 28 5  o 103.5782 3.206100 131.1618       8.082736 127.6432       10.77466 135.6903       12.22333 102.0339 4.343279 105.1385 4.783338 -3.104584      6.460990 
1 1 1 -10 28 6  o 173.2122 3.156456 366.4302       13.32338 341.5296       19.94371 386.5001       17.90495 166.8728 4.909722 177.7423 4.133767 -10.86958      6.418209 
1 1 1 -10 28 7  f 156.0624 3.451262 297.6095       13.12539 303.3409       26.10735 295.6708       15.18380 156.7556 6.850993 155.4240 4.012266 1.331635       7.939419 
1 1 1 -10 28 8  o 115.7816 3.318224 163.9108       9.352622 187.3089       19.01541 156.4443       10.74171 123.2208 6.354112 113.0348 3.905513 10.18604       7.458402 
1 1 1 -10 28 9  o 68.22856 4.160866 57.17455       6.885194 44.88849       11.55900 63.93093       8.571783 59.67776 8.161892 72.05455 4.911085 -12.37679      9.525504 
1 1 1 -10 28 10 o 54.69933 4.073731 36.81183       5.391144 42.74586       10.57050 34.72562       6.267579 58.32546 7.619026 52.99876 4.908630 5.326698       9.063344 
1 1 1 -10 28 11 o 52.35850 4.764386 33.87703       6.012465 39.29969       10.58885 31.29683       7.304136 55.77764 8.020602 50.07287 6.112458 5.704769       10.08426 
1 1 1 -10 28 12 o 186.1063 3.754800 423.6454       17.02880 459.4743       38.39436 414.8715       18.99979 192.2561 8.213974 184.0726 4.235684 8.183502       9.241774 
1 1 1 -10 28 13 o 164.0105 3.205890 328.7095       12.81316 343.2865       21.69608 320.9024       15.87787 167.0961 5.335017 161.9159 4.024080 5.180191       6.682487 
1 1 1 -10 28 14 o 128.1279 3.043960 200.5762       9.504271 209.2916       16.41634 196.1821       11.65651 130.4462 5.174534 126.5669 3.783556 3.879349       6.410233 
1 1 1 -10 28 15 o 214.7461 3.592879 564.1633       18.80200 610.6332       32.20758 540.1394       23.15760 222.5639 5.943690 209.8763 4.527870 12.68759       7.471884 
1 1 1 -10 28 16 o 166.7389 3.224526 339.9390       13.10204 314.1281       21.26813 355.7254       16.63299 159.6686 5.474146 170.4049 4.005457 -10.73625      6.783065 
1 1 1 -10 28 17 o 50.29255 4.432831 31.27317       5.377218 22.11385       8.451804 37.50192       6.969763 41.31320 8.671854 54.95845 5.268566 -13.64524      10.14686 
1 1 1 -10 28 18 f 78.48702 3.368746 75.52965       6.428207 60.41450       13.52220 79.94280       7.306610 69.06850 8.193424 80.69640 3.725626 -11.62789      9.000694 
1 1 1 -10 28 19 o 63.01056 3.390002 48.75330       5.186179 56.17053       9.771202 45.84432       6.119233 67.11567 6.038818 60.97777 4.142624 6.137897       7.323159 
1 1 1 -10 28 20 o 80.74944 3.027266 79.90591       5.946434 97.86169       11.37600 73.15530       6.975239 88.88173 5.275934 77.14325 3.721415 11.73848       6.456347 
1 1 1 -10 28 21 o 70.92667 3.707677 61.91045       6.386118 63.96786       9.953736 60.47109       8.325491 71.60696 5.752562 69.83012 4.924074 1.776848       7.572217 
1 1 1 -10 28 22 o 71.39298 3.753522 62.80321       6.507320 62.42274       9.855666 63.09727       8.664464 70.64282 5.775451 71.24934 5.022459 -0.6065216     7.653818 
1 1 1 -10 28 23 o 83.80205 3.258049 86.33105       6.640797 100.4164       16.46705 83.59539       7.257085 88.67192 7.696843 82.37508 3.624053 6.296837       8.507359 
1 1 1 -10 28 24 o 28.67019 5.373794 10.55777       3.616552 16.26230       7.707322 8.947094       4.095417 34.77691 9.019289 26.16180 6.462300 8.615108       11.09544 
1 1 1 -10 28 25 o 64.42477 3.187194 51.16622       4.988238 31.88307       9.030626 59.63306       5.983973 49.30344 7.773520 69.46996 3.546467 -20.16652      8.544298 
1 1 1 -10 28 26 o 78.48152 2.983102 75.87333       5.694823 74.20359       10.69891 76.53342       6.726953 76.47871 5.783543 78.65617 3.518440 -2.177467      6.769696 
1 1 1 -10 28 27 o 54.05788 3.372473 36.24731       4.420535 30.31918       8.643184 38.34729       5.144258 47.67171 7.702596 55.46801 3.829284 -7.796303      8.601941 
1 1 1 -10 28 28 o 34.51504 5.700556 15.55019       4.627468 2.467819       7.135948 25.04375       6.078871 20.55363 8.571708 43.92725 5.821961 -23.37362      10.36192 
1 1 1 -10 28 29 o 20.63086 6.666843 5.536529       3.819378 -0.2883212     6.772400 8.253185       4.625062 18.09910 7.955241 24.60947 7.233850 -6.510366      10.75242 
1 1 1 -10 28 30 o 68.62547 3.221922 58.73206       5.373067 68.19489       13.56540 56.97125       5.851655 69.93648 8.109793 67.40815 3.575082 2.528328       8.862841 
1 1 1 -10 28 31 o 48.00821 3.527154 29.07355       4.097640 20.50433       7.656243 32.51347       4.850863 37.23418 8.609830 50.55830 3.969026 -13.32411      9.480630 
1 1 1 -10 28 32 f 32.76962 5.498868 14.50933       4.235778 22.71516       7.473768 10.62627       5.141207 39.17146 8.097219 26.89460 7.541524 12.27686       11.06524 
1 1 1 -10 28 33 o 98.91489 3.794710 125.2328       9.129988 115.3568       17.62553 128.8546       10.67358 87.23494 8.394693 99.50111 4.412938 -12.26617      9.483929 
1 1 1 -10 28 34 o 38.87815 5.578189 20.87267       5.133697 21.15256       10.58543 20.78660       5.870259 32.98027 11.11811 37.96338 6.583915 -4.983109      12.92131 
1 1 1 -10 28 35 o 41.08533 4.657243 22.71715       4.580703 20.61308       7.319303 24.07187       5.873053 35.30667 8.590061 41.04790 6.052761 -5.741226      10.50833 
1 1 1 -10 28 36 o 18.06134 6.790739 4.590624       4.056968 4.837152       6.472443 4.431087       5.206747 19.31917 8.117400 18.40014 7.458588 0.9190311      11.02373 
1 1 1 -10 28 37 o 19.82358 7.360140 6.305315       4.735738 3.228081       6.396683 10.03774       7.044823 17.71266 7.759998 23.03036 8.878510 -5.317699      11.79176 
1 1 1 -10 28 38 o 15.90127 6.487120 3.203472       3.968671 -0.3388093     6.166692 5.707862       5.185154 15.11824 7.011781 18.80187 7.504889 -3.683629      10.27076 
1 1 1 -10 28 39 o 26.60982 7.718699 12.95991       5.296621 12.96635       6.648059 12.94871       8.764121 24.75441 8.787129 23.04962 9.546320 1.704788       12.97482 
1 1 1 -10 29 1  o 78.72653 3.032352 75.82066       5.806629 73.77905       8.290546 77.78651       8.135281 77.48410 4.408902 79.59644 4.209101 -2.112335      6.095486 
1 1 1 -10 29 2  o 133.2956 2.928596 216.9982       9.512866 220.8682       14.45554 214.0421       12.63413 134.2055 4.426111 132.2037 3.925971 2.001816       5.916393 
1 1 1 -10 29 3  o 208.2646 4.475216 531.3732       22.71253 527.1051       27.20438 541.1927       41.26369 207.1036 5.394920 208.7334 8.127759 -1.629791      9.755287 
1 1 1 -10 29 4  o 78.83495 2.980329 76.01623       5.715264 79.37792       8.297369 72.98138       7.883698 80.40588 4.249731 77.09416 4.212361 3.311714       5.983661 
1 1 1 -10 29 5  o 161.7504 3.453021 319.8192       13.61071 307.6287       18.37546 334.6368       20.25898 158.3354 4.767814 165.0777 5.041996 -6.742310      6.939292 
1 1 1 -10 29 6  o 134.0828 2.935773 219.5712       9.592495 237.4076       15.11558 207.5444       12.41212 139.1375 4.463822 130.1814 3.917015 8.956116       5.938747 
1 1 1 -10 29 7  o 112.7416 3.351866 155.4896       9.198659 125.1801       16.41457 169.3658       11.10648 100.5130 6.740448 117.5911 3.881158 -17.07801      7.777984 
1 1 1 -10 29 8  o 71.47248 4.167375 62.75417       7.226857 65.23520       12.55783 61.52562       8.836823 72.30012 7.224164 70.61087 5.171432 1.689247       8.884383 
1 1 1 -10 29 9  o 73.38456 3.568152 66.00886       6.361806 72.14722       12.65750 63.93407       7.358838 76.13626 6.896871 72.13525 4.204479 4.001007       8.077405 
1 1 1 -10 29 10 o 85.77650 4.026856 90.26910       8.393760 99.47688       14.89392 85.98344       10.16109 89.48489 6.882886 83.55115 5.013654 5.933746       8.515330 
1 1 1 -10 29 11 o 84.27829 4.023804 87.16254       8.240097 0.000000       0.000000 87.16254       8.240097 ?        ?        84.27829 4.023804 0.000000       4.023804 
1 1 1 -10 29 12 o 224.7066 4.093355 618.5051       22.41462 656.4222       46.97802 607.3288       25.50499 229.3955 8.418038 222.4783 4.704370 6.917206       9.643364 
1 1 1 -10 29 13 o 29.15351 6.325614 10.89090       4.364550 4.480758       7.788601 13.82528       5.269682 23.78105 9.288779 32.84349 6.807917 -9.062447      11.51647 
1 1 1 -10 29 14 o 135.1941 3.096526 223.4597       10.20161 240.3302       17.78889 215.1923       12.45286 139.6693 5.235777 132.4896 3.861133 7.179718       6.505514 
1 1 1 -10 29 15 o 107.2811 3.040500 140.8345       7.940835 140.5371       13.86419 140.9797       9.687206 106.6932 5.349454 107.2244 3.712998 -0.5312119     6.511760 
1 1 1 -10 29 16 o 147.4301 3.537122 266.1778       12.70785 244.8721       18.54580 285.0351       17.44766 140.8310 5.414034 152.1962 4.709994 -11.36520      7.176058 
1 1 1 -10 29 17 o 188.9560 3.412412 437.2648       15.71297 427.5383       25.96529 442.8849       19.73720 185.8950 5.738652 189.8949 4.265170 -3.999863      7.150091 
1 1 1 -10 29 18 o 70.61529 3.828932 61.36293       6.564246 62.54454       10.25108 60.54166       8.546239 70.79435 5.998443 69.88515 5.052381 0.9091949      7.842695 
1 1 1 -10 29 19 o 79.20306 3.665541 77.14358       7.055648 65.74683       10.72127 85.85023       9.370897 72.49208 6.126332 83.33959 4.632399 -10.84751      7.680563 
1 1 1 -10 29 20 o 83.38109 3.538906 85.49525       7.174374 94.38128       11.19298 79.29866       9.346924 87.13126 5.296535 79.98133 4.817949 7.149933       7.160022 
1 1 1 -10 29 21 o 57.77421 3.430679 41.13560       4.808286 35.74236       8.512797 43.66233       5.826763 52.96298 6.748832 59.39878 4.049664 -6.435795      7.870611 
1 1 1 -10 29 22 o 97.54948 2.987179 116.8457       7.092679 107.0610       12.32761 121.6874       8.671733 92.52263 5.492288 99.38415 3.586455 -6.861519      6.559565 
1 1 1 -10 29 23 o 29.64271 5.295389 11.27292       3.684796 6.379507       7.418232 12.87576       4.245596 24.53163 9.191183 31.61391 5.721500 -7.082277      10.82651 
1 1 1 -10 29 24 o 78.37009 3.034837 75.63648       5.784958 80.59475       10.78872 73.63564       6.853498 79.91766 5.574718 77.14070 3.656204 2.776962       6.666731 
1 1 1 -10 29 25 o 26.34296 5.493958 9.049611       3.412497 19.32565       7.787424 6.607394       3.796411 37.56225 8.681584 22.47041 6.539682 15.09184       10.86910 
1 1 1 -10 29 26 o 91.66769 2.912545 103.6523       6.497908 109.2290       12.21872 101.4533       7.672848 92.72267 5.431374 90.44972 3.487609 2.272949       6.454707 
1 1 1 -10 29 27 o 19.45231 6.974228 4.434953       4.198170 -1.393823      6.848641 7.943583       5.313546 17.62126 7.858818 24.40648 7.861448 -6.785227      11.11591 
1 1 1 -10 29 28 o 17.41960 6.606049 3.146287       3.858213 12.44389       9.349515 1.238017       4.235684 29.48967 10.42516 15.85046 6.606624 13.63921       12.34226 
1 1 1 -10 29 29 o 18.71161 6.216442 4.510986       3.310785 -3.787000      8.830816 5.868102       3.571273 18.34497 8.466870 20.88076 6.407238 -2.535793      10.61794 
1 1 1 -10 29 30 o 40.61539 3.896574 21.03586       3.809394 17.36003       7.162200 22.48593       4.498454 34.08235 8.619290 41.70438 4.497376 -7.622036      9.722065 
1 1 1 -10 29 31 o 47.52855 3.650475 28.75956       4.195682 16.54148       7.651975 34.01204       5.017121 32.27110 9.252210 51.47091 4.032132 -19.19981      10.09264 
1 1 1 -10 29 32 o 21.31867 6.132225 6.453288       3.356126 14.63554       7.004610 4.015218       3.823584 30.08378 8.917829 17.86051 6.616765 12.22327       11.10447 
1 1 1 -10 29 33 o 59.00908 3.331455 44.36322       4.771131 44.18760       8.495962 44.44412       5.766240 55.83452 6.357252 58.43908 4.074574 -2.604557      7.550948 
1 1 1 -10 29 34 o 43.08305 3.931651 24.30165       4.082350 23.06384       7.329890 24.85826       4.915242 37.96068 8.166176 42.88527 4.784691 -4.924587      9.464655 
1 1 1 -10 29 35 o 19.87417 7.453590 5.989892       4.881068 18.35700       10.31680 2.423271       5.540380 28.82441 10.83081 16.96328 7.328580 11.86112       13.07725 
1 1 1 -10 29 36 o 12.11374 5.715161 -2.771029      4.398771 -1.050021      6.285404 -4.423056      6.158151 15.19522 7.058280 13.55878 6.498827 1.636443       9.594481 
1 1 1 -10 29 37 o 14.13256 6.125905 1.387046       3.896948 1.847664       6.687631 1.150233       4.795179 16.68748 7.574769 14.83098 6.597557 1.856493       10.04514 
1 1 1 -10 29 38 f 13.16971 6.133956 -1.175355      4.797310 -0.3808513     6.085466 -2.479674      7.797181 14.81536 6.903164 15.21805 7.299040 -0.4026947     10.04638 
1 1 1 -10 30 1  o 75.52822 3.904563 70.02751       7.162110 71.34332       11.52163 69.19886       9.143313 75.79194 6.294901 74.89341 5.039171 0.8985291      8.063437 
1 1 1 -10 30 2  o 36.54457 7.159502 17.08308       6.147750 15.47751       7.744868 19.81797       10.10810 34.56983 9.078707 38.98812 10.43384 -4.418293      13.83068 
1 1 1 -10 30 3  o 74.82978 3.491407 68.63381       6.349098 75.53296       11.58702 65.67354       7.589971 78.04324 6.142033 73.08424 4.280413 4.958992       7.486421 
1 1 1 -10 30 4  o 37.80795 5.151055 17.87614       4.622563 13.79030       8.684873 19.49117       5.460252 32.96291 9.967364 39.36828 5.870752 -6.405369      11.56780 
1 1 1 -10 30 5  o 57.80752 4.050003 41.12435       5.669168 45.87425       10.88917 39.35816       6.640037 60.37326 7.567176 56.41837 4.877485 3.954884       9.002889 
1 1 1 -10 30 6  o 83.15736 3.479417 84.72871       7.035300 89.72273       13.78185 82.96870       8.181606 84.95078 6.711891 82.19882 4.097398 2.751953       7.863724 
1 1 1 -10 30 7  o 123.6415 3.401515 187.1075       10.23906 159.5081       18.53351 199.2317       12.28385 113.3907 6.737620 127.4870 3.958759 -14.09622      7.814557 
1 1 1 -10 30 8  o 63.99763 3.892435 50.33819       6.041749 46.06444       11.40206 52.00660       7.124106 60.37089 7.942814 64.95585 4.529029 -4.584961      9.143326 
1 1 1 -10 30 9  o 110.8696 3.862377 150.7179       10.41932 154.3135       17.78211 148.8380       12.85778 111.5302 6.571795 109.9854 4.808899 1.544708       8.143341 
1 1 1 -10 30 10 o 147.9310 4.000577 268.3440       14.40851 0.000000       0.000000 268.3440       14.40851 ?        ?        147.9310 4.000577 0.000000       4.000577 
1 1 1 -10 30 11 o 197.4502 3.830391 477.5942       18.43048 547.0583       39.80803 458.6417       20.79330 209.4165 7.814227 193.3228 4.413715 16.09377       8.974576 
1 1 1 -10 30 12 o 63.87727 3.861186 50.18081       5.982331 67.99282       12.83813 45.24037       6.761265 73.62628 7.249312 60.51414 4.619878 13.11214       8.596267 
1 1 1 -10 30 13 o 65.77847 4.456165 53.38211       7.100843 57.25392       12.30134 51.44730       8.695902 67.35884 7.628256 64.33697 5.602296 3.021873       9.464460 
1 1 1 -10 30 14 o 185.0228 3.846370 419.7867       17.34253 423.7078       25.40408 416.3645       23.73318 185.1278 5.637701 183.6657 5.308204 1.462143       7.743430 
1 1 1 -10 30 15 f 54.17664 5.937302 36.75961       7.710332 31.15006       11.10415 41.98229       10.71440 48.74009 9.690282 57.39315 7.867617 -8.653057      12.48203 
1 1 1 -10 30 16 o 33.95718 6.372550 14.77771       5.079650 16.22248       8.175040 13.86910       6.483077 35.09907 9.378888 32.57113 8.180202 2.527935       12.44505 
1 1 1 -10 30 17 o 65.11958 3.944217 52.29730       6.229705 59.02417       9.948862 47.95856       7.990033 68.67535 6.005144 62.03478 5.337229 6.640568       8.034163 
1 1 1 -10 30 18 o 68.96356 3.281414 58.45975       5.498815 43.14111       9.523417 66.12103       6.734932 58.31441 6.830951 73.25025 3.785856 -14.93584      7.809904 
1 1 1 -10 30 19 o 64.48517 4.020280 51.41758       6.286175 41.49220       9.277731 59.84132       8.547132 57.09764 6.801420 69.29147 5.097475 -12.19383      8.499621 
1 1 1 -10 30 20 o 43.32323 4.127779 23.36571       4.305254 30.60167       8.057313 20.47427       5.093307 48.78613 6.975646 40.23513 5.325305 8.550995       8.776019 
1 1 1 -10 30 21 o 52.70776 3.645529 34.38851       4.653581 30.63397       8.499115 35.99604       5.561286 48.54566 7.419527 53.77526 4.279081 -5.229603      8.565040 
1 1 1 -10 30 22 o 30.53018 5.761153 12.07026       4.129119 6.048748       10.91276 13.07640       4.460766 26.81866 10.82423 31.74220 5.986284 -4.923540      12.36930 
1 1 1 -10 30 23 o 9.661036 4.634737 -4.376322      3.147648 -9.451131      6.237672 -2.642595      3.645887 13.13958 6.358422 11.81475 5.448416 1.324833       8.373456 
1 1 1 -10 30 24 o 32.98684 4.766200 13.89134       3.720372 11.06088       7.427528 14.83931       4.298469 28.64069 9.300423 33.91492 5.380431 -5.274229      10.74462 
1 1 1 -10 30 25 o 24.23871 6.633715 7.868027       4.031673 2.181030       7.014773 10.67322       4.926674 20.23694 8.473378 28.04501 7.179095 -7.808073      11.10574 
1 1 1 -10 30 26 o 84.46844 3.955176 89.38497       8.118742 85.23783       11.46117 93.56186       11.50221 81.19166 5.831549 85.29743 5.563986 -4.105774      8.060081 
1 1 1 -10 30 27 o 70.16862 3.335581 61.42469       5.687290 55.04953       13.84854 62.71804       6.237565 61.62152 9.529425 70.75403 3.629792 -9.132507      10.19732 
1 1 1 -10 30 28 o 33.80268 4.882062 14.91782       3.905144 4.490103       10.30666 16.66578       4.219773 23.66326 10.10526 35.71117 4.984588 -12.04791      11.26776 
1 1 1 -10 30 29 o 29.01574 5.103033 11.21961       3.476593 11.70258       6.951333 11.05850       4.014781 27.76875 8.995806 28.37184 5.994860 -0.6030960     10.81031 
1 1 1 -10 30 30 o 46.50402 3.733538 27.63531       4.195518 16.73541       7.561025 32.48443       5.043141 32.39806 9.167135 50.16470 4.162862 -17.76664      10.06806 
1 1 1 -10 30 31 o 41.43801 3.993130 22.25769       3.982383 16.94621       7.098053 24.69771       4.810920 32.52167 8.761056 43.22910 4.639340 -10.70743      9.913606 
1 1 1 -10 30 32 o 20.06793 6.633435 5.798103       3.771154 0.3110698      9.509511 6.822053       4.107985 19.39223 8.890071 21.49290 6.911350 -2.100674      11.26056 
1 1 1 -10 30 33 o 62.87880 3.264684 50.55422       4.985303 53.29473       8.940312 49.31755       6.005696 61.18126 6.076738 61.34533 4.039892 -0.1640663     7.297086 
1 1 1 -10 30 34 o 52.42292 3.489835 35.67255       4.432842 29.34817       7.775222 38.71820       5.395649 42.86182 7.728250 53.96862 4.134140 -11.10680      8.764528 
1 1 1 -10 30 35 o 12.54495 5.536420 0.2315894      3.311361 13.06344       6.295622 -4.676114      3.893437 26.61645 8.555661 10.37410 5.020967 16.24235       9.920154 
1 1 1 -10 30 36 o 14.36342 5.961085 2.105519       3.427168 1.279277       5.943212 2.517145       4.194873 15.88397 7.182294 15.43398 6.512753 0.4499950      9.695427 
1 1 1 -10 30 37 o 38.03754 8.162461 26.09962       7.339521 23.36549       10.84867 28.40723       9.966632 28.54577 11.01433 34.18415 10.73895 -5.638382      15.38313 
1 1 1 -10 31 1  o 109.9701 3.234580 148.0784       8.658776 148.0200       11.54866 148.1534       13.08557 109.7364 4.327098 109.6486 4.909713 0.8780670E-01  6.544392 
1 1 1 -10 31 2  o 51.95611 3.728844 33.23422       4.689745 40.96253       6.784424 26.16219       6.489973 57.51665 4.886640 45.65348 5.976949 11.86317       7.720309 
1 1 1 -10 31 3  o 15.71096 6.143932 1.848767       3.410817 3.767492       4.582268 -0.5351498     5.107633 19.58678 7.245868 16.24644 7.027744 3.340338       10.09415 
1 1 1 -10 31 4  o 39.64376 4.442747 19.52946       4.218282 15.68706       5.424599 25.40712       6.709173 35.04445 6.593958 44.90761 6.304097 -9.863155      9.122605 
1 1 1 -10 31 5  o 58.32206 3.703726 41.82852       5.236709 42.02430       6.928788 41.56771       7.997245 58.25497 4.926923 57.76647 5.757646 0.4885063      7.577932 
1 1 1 -10 31 6  o 76.16425 3.366926 71.13047       6.233704 70.82843       8.257608 71.53065       9.504988 75.81658 4.489549 76.05791 5.158801 -0.2413254     6.838807 
1 1 1 -10 31 7  o 156.3080 4.050394 299.8236       15.41517 317.2375       26.97269 291.3770       18.78536 159.6958 6.947602 153.7962 5.019030 5.899628       8.570871 
1 1 1 -10 31 8  o 145.0288 3.966153 258.1041       14.00399 241.7891       23.23072 267.4172       17.55160 139.3855 6.860338 147.3533 4.894676 -7.967834      8.427461 
1 1 1 -10 31 9  o 79.70025 5.056598 78.52840       9.770329 0.000000       0.000000 78.52840       9.770329 ?        ?        79.70025 5.056598 0.000000       5.056598 
1 1 1 -10 31 10 o 33.47738 6.624640 14.38018       5.213020 11.29308       8.650073 16.14087       6.532599 30.34253 10.04706 35.27374 7.806440 -4.931210      12.72336 
1 1 1 -10 31 11 o 33.94990 6.824869 14.82710       5.450357 23.30196       9.709464 10.92795       6.585882 42.05748 9.675175 29.19827 8.645103 12.85921       12.97485 
1 1 1 -10 31 12 o 42.33141 4.845738 22.35762       4.908741 28.99844       9.887331 20.18538       5.654871 47.19100 8.924576 39.94007 5.994910 7.250935       10.75114 
1 1 1 -10 31 13 o 24.17833 6.925577 7.476756       4.289319 13.56976       8.929190 5.648993       4.890533 32.50259 10.15803 22.05878 7.555399 10.44381       12.65977 
1 1 1 -10 31 14 o 90.66314 3.898488 101.1678       8.593042 117.9449       16.02406 94.39564       10.18068 96.93720 6.827040 87.34238 4.801643 9.594826       8.346512 
1 1 1 -10 31 15 o 89.20074 3.149774 97.63895       6.835996 82.39087       11.35048 106.3178       8.563231 81.23967 5.770940 92.94106 3.788832 -11.70139      6.903550 
1 1 1 -10 31 16 o 71.90810 3.308356 63.58235       5.781771 60.94872       9.915430 64.93916       7.116951 69.71243 5.891784 72.51118 4.043678 -2.798744      7.145939 
1 1 1 -10 31 17 o 22.09440 6.653597 6.207186       3.875728 2.122871       6.905598 8.085332       4.682809 20.62160 8.500813 25.00787 7.258756 -4.386271      11.17825 
1 1 1 -10 31 18 o 47.12185 3.941438 27.56622       4.484561 28.89471       8.414105 27.03909       5.300105 47.14019 7.581581 46.47294 4.746610 0.6672516      8.944869 
1 1 1 -10 31 19 o 94.71404 3.000789 110.2590       6.917315 100.4089       11.70244 115.5489       8.575913 89.51575 5.389606 96.76446 3.643383 -7.248703      6.505544 
1 1 1 -10 31 20 o 39.82819 4.439119 19.92423       4.235326 19.16414       7.733787 20.24984       5.061853 37.66071 8.614375 39.89676 5.340379 -2.236042      10.13544 
1 1 1 -10 31 21 o 45.97943 4.262591 26.47976       4.721727 16.39684       11.48457 28.53080       5.179752 34.42160 11.58059 47.66455 4.513166 -13.24295      12.42895 
1 1 1 -10 31 22 o 51.02213 3.686006 32.40604       4.552114 32.79833       8.515904 32.24911       5.386214 49.90469 7.211380 50.66991 4.405876 -0.7652245     8.450784 
1 1 1 -10 31 23 o 29.92174 5.852268 11.77283       4.114307 12.02137       6.938460 11.63804       5.109521 29.47590 8.908181 29.31606 7.204387 0.1598339      11.45683 
1 1 1 -10 31 24 o 13.24680 5.868711 -0.8840907     3.755514 2.749633       6.732554 -2.525476      4.524902 20.27311 8.378957 13.45246 6.154055 6.820647       10.39612 
1 1 1 -10 31 25 o 55.36613 4.030360 38.64139       5.400571 51.93433       12.61691 35.65952       5.975678 60.79741 8.769103 52.86617 4.686973 7.931240       9.943082 
1 1 1 -10 31 26 o 51.15612 3.720267 32.96926       4.606058 45.55061       12.07685 30.82762       4.982689 56.04050 9.159436 49.24092 4.192247 6.799583       10.07324 
1 1 1 -10 31 27 o 58.83222 3.257404 43.37717       4.651835 40.04602       8.503510 44.79980       5.557080 54.30408 6.558521 59.46482 3.855655 -5.160736      7.607909 
1 1 1 -10 31 28 o 14.11446 5.734508 1.467819       3.086038 3.312979       6.319674 0.8900509      3.536344 19.49664 8.093410 14.17629 5.980770 5.320353       10.06344 
1 1 1 -10 31 29 o 11.17340 5.131431 -1.728886      3.187585 -1.149427      5.942451 -1.962971      3.776947 15.81581 7.163655 12.12007 5.573343 3.695737       9.076348 
1 1 1 -10 31 30 o 8.545433 4.213405 -6.163082      3.140766 -6.612569      6.019645 -5.994950      3.681606 13.17055 6.341761 9.691628 4.733723 3.478917       7.913663 
1 1 1 -10 31 31 o 13.95819 6.007148 0.7414083      3.694785 -15.98000      8.458706 4.684034       4.107337 13.24408 6.596107 18.62626 6.865502 -5.382178      9.520701 
1 1 1 -10 31 32 o 19.89495 6.233840 5.810836       3.360595 1.098244       6.162347 7.805599       4.009238 16.82903 7.483212 22.64854 6.754971 -5.819508      10.08108 
1 1 1 -10 31 33 o 30.14898 5.110749 12.76458       3.620880 11.49172       6.305521 13.39080       4.422787 25.41910 8.580990 29.93454 6.264445 -4.515446      10.62434 
1 1 1 -10 31 34 o 43.59850 4.341124 25.86141       4.550993 44.17628       11.64102 22.55720       4.944506 47.02180 10.43206 39.80809 5.222870 7.213715       11.66646 
1 1 1 -10 31 35 o 11.22566 5.298953 -2.491766      3.790517 -3.430686      5.556897 -1.674713      5.183738 13.10366 6.251417 13.52460 6.324600 -0.4209452     8.892737 
1 1 1 -10 31 36 o 25.79845 6.831294 11.13232       4.361844 15.73760       6.866832 8.017282       5.647542 27.59723 8.941019 20.72311 7.959686 6.874117       11.97073 
1 1 1 -10 32 1  o 91.61295 3.004811 102.8240       6.699189 102.8576       9.650284 102.7928       9.307196 91.35674 4.347215 91.36425 4.191457 -0.7507324E-02 6.038757 
1 1 1 -10 32 2  o 141.9408 3.070859 246.6008       10.62192 238.5718       15.59834 253.5433       14.50456 139.1432 4.606586 143.5979 4.149309 -4.454697      6.199790 
1 1 1 -10 32 3  o 80.11078 3.008870 78.64560       5.863514 79.76881       8.436667 77.59614       8.155025 80.43983 4.319759 79.35222 4.232569 1.087616       6.047724 
1 1 1 -10 32 4  o 80.89407 3.263538 80.26914       6.420208 88.00410       8.790119 71.42441       9.399581 84.50939 4.282245 75.92346 5.110147 8.585930       6.667175 
1 1 1 -10 32 5  o 67.72389 3.146765 56.27104       5.179089 62.37883       7.620939 51.02948       7.059874 71.08241 4.421462 64.24096 4.538935 6.841446       6.336502 
1 1 1 -10 32 6  o 110.6402 3.214785 150.0325       8.658451 151.1297       11.62346 148.6647       12.97801 110.7855 4.313673 109.7203 4.865938 1.065155       6.502701 
1 1 1 -10 32 7  o 75.86093 3.514374 70.70219       6.479188 75.87513       12.81411 68.92542       7.509917 77.72991 6.834463 74.78053 4.137199 2.949387       7.989137 
1 1 1 -10 32 8  o 13.11114 6.114984 -4.387565      4.793616 0.000000       0.000000 -4.387565      4.793616 ?        ?        13.11114 6.114984 0.000000       6.114984 
1 1 1 -10 32 9  o 135.7712 3.440529 226.1640       11.37415 253.7362       23.85921 218.0550       12.93906 142.3602 6.898040 133.1543 3.992105 9.205933       7.969935 
1 1 1 -10 32 10 o 90.25130 3.432655 100.0362       7.535765 98.88417       14.66080 100.4499       8.785139 88.70179 6.835172 90.31036 4.001795 -1.608566      7.920476 
1 1 1 -10 32 11 o 61.65606 3.987270 46.93877       5.958713 54.62505       12.12015 44.48876       6.842800 65.40911 7.754546 59.85627 4.729656 5.552845       9.083096 
1 1 1 -10 32 12 o 51.86758 4.099877 33.32133       5.139949 31.49627       10.15677 33.94963       5.959378 49.02001 8.827081 52.21755 4.734671 -3.197544      10.01671 
1 1 1 -10 32 13 o 37.85093 6.219213 18.33412       5.537455 17.85516       10.00519 18.54561       6.648586 36.45929 10.61814 37.71078 7.498899 -1.251495      12.99917 
1 1 1 -10 32 14 o 51.37949 4.220253 32.78187       5.237484 31.27377       10.65262 33.26265       6.014660 48.48505 9.354906 51.60664 4.839108 -3.121597      10.53239 
1 1 1 -10 32 15 o 87.93878 3.391787 95.19163       7.254877 86.76007       14.79235 97.86210       8.324868 82.35967 7.450834 89.03727 3.845872 -6.677597      8.384848 
1 1 1 -10 32 16 o 36.21815 4.799801 16.55214       4.132102 14.77275       7.418623 17.35246       4.975325 33.15888 8.967056 36.84343 5.727454 -3.684551      10.64010 
1 1 1 -10 32 17 o 63.25557 3.493308 49.43758       5.363918 48.47113       9.490460 49.89120       6.502030 61.63916 6.411812 63.34127 4.236728 -1.702106      7.685128 
1 1 1 -10 32 18 o 94.96944 3.060679 111.0376       7.074085 110.4612       12.27956 111.3239       8.654490 93.71240 5.399987 94.84734 3.751784 -1.134941      6.575389 
1 1 1 -10 32 19 o 30.32520 5.536066 11.91094       3.940408 24.49931       7.683655 7.418881       4.589927 42.95249 7.619821 23.83573 7.254096 19.11676       10.52063 
1 1 1 -10 32 20 o 73.94278 4.165228 68.24905       7.475001 56.89633       14.68325 72.22057       8.684619 64.24696 9.678707 75.81413 4.724197 -11.56717      10.77012 
1 1 1 -10 32 21 o 69.21898 3.689881 59.63938       6.201569 63.79245       9.837873 56.90082       7.988736 70.54200 5.773377 67.05708 4.923057 3.484917       7.587383 
1 1 1 -10 32 22 o 52.91217 4.580264 35.45788       5.847745 29.17252       10.78448 38.07556       6.959732 44.83059 10.11314 54.49867 5.307639 -9.668079      11.42132 
1 1 1 -10 32 23 o 13.62291 5.878909 0.1274731E-01  3.557491 -12.38832      8.318192 2.788732       3.935573 14.83150 7.215495 17.10596 6.624897 -2.274455      9.795541 
1 1 1 -10 32 24 o 57.39219 4.025194 41.62314       5.593881 28.96507       10.50481 46.63317       6.608826 43.88469 10.04094 60.48876 4.516056 -16.60406      11.00978 
1 1 1 -10 32 25 o 10.35169 4.861939 -2.894219      3.120350 1.375699       6.373653 -4.240241      3.578531 18.42312 7.908704 10.50879 5.014353 7.914330       9.364366 
1 1 1 -10 32 26 o 60.90866 3.300100 46.61983       4.879970 34.11221       8.327303 53.16185       6.022450 49.42014 7.119688 64.71336 3.836156 -15.29322      8.087400 
1 1 1 -10 32 27 o 25.23334 6.010550 8.889851       3.642918 -2.042146      6.408888 14.10788       4.427783 15.98029 7.315549 32.03237 5.889280 -16.05209      9.391533 
1 1 1 -10 32 28 o 37.65562 4.433159 18.61591       3.990125 22.90656       7.205811 16.71850       4.791841 39.12575 7.831100 34.76542 5.864570 4.360336       9.783625 
1 1 1 -10 32 29 o 13.30403 5.720238 0.5299517      3.344287 -4.120929      6.116630 2.513132       3.994162 14.31005 6.747697 16.17274 6.540963 -1.862687      9.397638 
1 1 1 -10 32 30 o 29.34044 5.993768 12.32916       4.140536 -2.218845      9.062043 16.16764       4.654835 17.85302 8.353130 33.80753 5.862480 -15.95451      10.20507 
1 1 1 -10 32 31 o 24.70079 5.895896 8.907751       3.499544 6.333881       6.439250 9.986628       4.168962 20.75686 8.336742 25.65474 6.623186 -4.897879      10.64744 
1 1 1 -10 32 32 o 10.93734 5.080382 -1.811723      3.256124 -6.421475      5.727195 0.3899718      3.958055 12.41790 6.028829 13.69480 6.048017 -1.276903      8.539630 
1 1 1 -10 32 33 o 38.30770 4.420318 20.10796       4.050853 14.90296       6.985942 22.74460       4.972093 27.69700 9.021580 39.91643 5.237791 -12.21943      10.43184 
1 1 1 -10 32 34 o 20.23558 7.455153 6.991063       4.842195 11.76397       6.546857 1.226824       7.194692 24.36300 8.712272 16.69708 7.683215 7.665920       11.61617 
1 1 1 -10 32 35 o 18.87517 7.011127 5.947290       4.298147 7.250897       6.712497 5.041357       5.595757 19.87850 8.303575 18.06168 7.565640 1.816820       11.23335 
1 1 1 -10 33 1  o 94.50286 2.954951 109.5285       6.796687 126.3470       10.19124 96.05573       9.121430 101.1962 4.141379 88.18085 4.257333 13.01537       5.939353 
1 1 1 -10 33 2  o 49.99501 3.805028 30.90510       4.600937 33.60385       5.886462 26.66763       7.376098 51.95262 4.700348 45.65799 6.839685 6.294632       8.299070 
1 1 1 -10 33 3  o 101.8404 2.977029 127.1781       7.380280 129.9237       10.77600 124.7525       10.12864 102.5768 4.320618 100.5653 4.141876 2.011528       5.985221 
1 1 1 -10 33 4  o 130.6465 3.347684 209.5641       10.64928 199.5484       13.99339 223.3474       16.41568 127.0839 4.525748 134.2426 5.026902 -7.158714      6.764032 
1 1 1 -10 33 5  o 102.2416 3.284769 128.3648       8.173436 122.6376       10.73725 136.2563       12.60378 99.61382 4.434322 104.8308 4.947696 -5.217018      6.644013 
1 1 1 -10 33 6  o 76.91951 3.432246 72.77591       6.417352 76.21938       11.18594 71.08654       7.834957 78.00792 5.928739 75.82748 4.257173 2.180435       7.298868 
1 1 1 -10 33 7  o 59.59663 3.727081 43.83567       5.385760 41.86157       8.621709 45.09896       6.896992 57.57249 6.245199 60.21951 4.738013 -2.647015      7.839086 
1 1 1 -10 33 8  o 106.3803 3.400357 139.1002       8.803668 135.9762       17.54775 140.1510       10.17715 103.7398 6.981945 106.6284 3.923358 -2.888618      8.008763 
1 1 1 -10 33 9  o 55.03641 4.165928 37.55810       5.545755 27.53935       10.92259 41.03793       6.437214 45.15218 10.17175 57.42730 4.639309 -12.27512      11.17979 
1 1 1 -10 33 10 o 75.90018 3.548693 70.98343       6.545508 56.70382       12.21981 76.72902       7.751283 66.42550 7.691010 78.78786 4.050780 -12.36236      8.692552 
1 1 1 -10 33 11 o 84.86691 3.466259 88.70221       7.153533 85.47396       13.95829 89.85213       8.330743 81.94899 7.058311 85.26001 4.020940 -3.311020      8.123282 
1 1 1 -10 33 12 o 108.5259 3.814877 145.3487       10.07335 173.9373       18.88509 133.9801       11.90898 117.2654 6.635733 103.8402 4.718557 13.42517       8.142342 
1 1 1 -10 33 13 o 52.92429 4.228620 34.85731       5.408351 35.71661       10.63833 34.55782       6.280522 51.91667 8.717394 52.48780 4.969403 -0.5711250     10.03434 
1 1 1 -10 33 14 o 88.95244 3.420403 97.58135       7.400502 96.04433       14.96604 98.07882       8.514296 86.52104 7.162330 89.00700 3.935169 -2.485962      8.172179 
1 1 1 -10 33 15 o 54.41954 3.983386 36.83665       5.245955 40.39902       11.06476 35.80369       5.958172 55.13683 8.508481 53.45966 4.618779 1.677166       9.681290 
1 1 1 -10 33 16 o 37.90495 6.256647 18.65849       5.577821 10.25063       9.335770 23.32597       6.955817 28.76981 10.38934 42.17612 7.014012 -13.40631      12.53534 
1 1 1 -10 33 17 f 23.63892 7.215218 7.309766       4.536469 8.524951       6.934590 6.400683       5.997931 25.97745 8.992847 23.25863 8.336501 2.718819       12.26249 
1 1 1 -10 33 18 o 24.28999 7.232574 7.827796       4.599182 9.314965       7.326496 6.860623       5.908372 26.80755 9.245180 23.60254 8.292295 3.205011       12.41916 
1 1 1 -10 33 19 o 55.44605 5.611777 39.47614       7.478125 0.000000       0.000000 39.47614       7.478125 ?        ?        55.44605 5.611777 0.000000       5.611777 
1 1 1 -10 33 20 o 58.67171 3.770921 43.04564       5.362986 35.19535       10.86000 45.57751       6.167478 49.95589 9.261826 60.18207 4.232359 -10.22617      10.18304 
1 1 1 -10 33 21 o 58.81229 3.749421 43.35370       5.345655 33.36110       10.91668 46.50553       6.131017 47.95443 9.675766 60.72378 4.168503 -12.76936      10.53550 
1 1 1 -10 33 22 o 66.12338 3.273443 54.53227       5.258279 40.38404       8.796835 62.39781       6.559033 54.86591 6.719521 70.44429 3.835299 -15.57838      7.737020 
1 1 1 -10 33 23 o 38.80397 4.850368 19.55461       4.486664 20.92544       7.317206 18.72869       5.679653 38.21542 8.108625 37.08357 6.523035 1.131847       10.40672 
1 1 1 -10 33 24 o 15.70305 6.077975 2.453972       3.311126 5.688907       5.876737 0.9494053      4.007830 21.45184 8.148850 15.01748 6.352880 6.434363       10.33261 
1 1 1 -10 33 25 o 24.81802 6.048183 8.577966       3.623931 9.089954       6.436194 8.340303       4.385098 24.83120 8.659745 24.11287 7.031531 0.7183228      11.15498 
1 1 1 -10 33 26 o 57.85278 3.398109 42.42049       4.769589 45.34011       8.341409 41.00220       5.813769 57.51818 6.041173 56.24999 4.273278 1.268196       7.399776 
1 1 1 -10 33 27 o 21.23005 6.212562 6.425030       3.417868 1.905186       6.114943 8.478650       4.121837 17.84528 7.704378 24.07613 6.753123 -6.230852      10.24510 
1 1 1 -10 33 28 o 19.15581 6.321465 5.182647       3.425237 11.25352       6.460062 2.808493       4.039854 26.21731 8.682610 16.47010 6.607343 9.747204       10.91076 
1 1 1 -10 33 29 o 54.01427 3.857984 37.98045       5.044709 35.23389       11.41350 38.64729       5.623868 43.27404 10.84573 54.07210 4.303493 -10.79805      11.66833 
1 1 1 -10 33 30 o 30.31906 5.282050 12.93259       3.760847 4.031233       6.552797 17.30487       4.592535 18.89712 8.063361 34.89369 5.589557 -15.99657      9.811266 
1 1 1 -10 33 31 o 12.05344 5.407190 -0.3863162     3.293273 4.578942       6.382483 -2.187943      3.844601 18.85919 7.999231 11.67092 5.454152 7.188274       9.681708 
1 1 1 -10 33 32 o 36.02209 4.742617 18.11383       4.062123 16.21882       7.005912 19.07354       4.985734 28.99756 8.987593 35.78061 5.925208 -6.783049      10.76499 
1 1 1 -10 33 33 o 25.08113 7.605302 11.09120       5.051402 10.42404       6.545825 12.07346       7.942594 23.00176 8.630530 23.64395 9.336332 -0.6421814     12.71429 
1 1 1 -10 33 34 o 9.245117 4.523273 -4.972946      3.403596 -0.5821591     6.356684 -6.737681      4.029946 14.99089 7.008135 9.599291 4.740460 5.391601       8.460846 
1 1 1 -10 34 1  o 26.77645 6.615187 9.395685       4.290979 11.83030       4.928426 1.767949       8.723511 30.01520 6.884736 22.30282 9.400490 7.712379       11.65199 
1 1 1 -10 34 2  o 81.97755 3.344507 82.76314       6.667303 81.49381       8.492669 84.80219       10.76391 81.06002 4.314882 82.29037 5.397456 -1.230354      6.910191 
1 1 1 -10 34 3  o 155.6349 3.987239 299.1232       15.10975 299.9305       17.88433 297.1097       28.24319 155.4256 4.727365 152.4398 7.627127 2.985779       8.973351 
1 1 1 -10 34 4  o 68.03532 3.468924 57.09222       5.732308 51.78585       7.067246 67.29694       9.800579 64.51015 4.524269 73.22256 5.533463 -8.712402      7.147602 
1 1 1 -10 34 5  o 119.5072 5.074013 177.9673       14.74321 0.000000       0.000000 177.9673       14.74321 ?        ?        119.5072 5.074013 0.000000       5.074013 
1 1 1 -10 34 6  o 164.9116 3.574282 334.8702       14.36402 304.7604       18.66323 378.6223       22.49741 156.5336 4.898668 174.1856 5.306288 -17.65201      7.221748 
1 1 1 -10 34 7  o 82.05670 3.304353 82.92993       6.593978 79.01289       8.498739 88.85433       10.45196 79.76526 4.389165 84.32426 5.110375 -4.559006      6.736520 
1 1 1 -10 34 8  o 66.68002 4.520370 55.37860       7.301816 53.13050       11.94355 56.72036       9.227011 63.95034 7.826941 67.06356 5.699920 -3.113216      9.682463 
1 1 1 -10 34 9  o 63.70118 4.504746 50.58538       6.947742 44.95293       11.23800 54.07011       8.839455 58.58275 8.087496 65.47803 5.593306 -6.895279      9.833242 
1 1 1 -10 34 10 f 28.97486 8.382946 11.19303       6.254890 15.44328       8.268368 5.506566       9.563877 33.64794 9.608270 25.45217 10.18137 8.195776       13.99926 
1 1 1 -10 34 11 f 83.54256 5.001608 87.43692       10.13586 89.24207       14.04875 85.47719       14.63792 83.34026 6.981567 81.24773 7.476989 2.092529       10.22974 
1 1 1 -10 34 12 o 88.24091 4.015239 96.67060       8.611485 89.93872       14.43240 100.3923       10.73107 83.43336 7.167838 89.50430 4.939126 -6.070946      8.704762 
1 1 1 -10 34 13 o 97.07259 4.008063 117.0521       9.460891 126.2843       16.44308 112.4831       11.56741 99.05236 6.854392 94.63575 5.033965 4.416611       8.504322 
1 1 1 -10 34 14 o 42.06002 5.761576 22.76608       5.750316 22.48204       9.614044 22.92429       7.175253 39.95458 9.920063 41.55127 7.355381 -1.596684      12.34946 
1 1 1 -10 34 15 o 10.97965 5.241479 -4.933419      3.919656 -2.109693      7.300596 -6.077030      4.646075 17.95259 8.052375 11.80448 5.654486 6.148101       9.839408 
1 1 1 -10 34 16 o 94.76340 3.379887 111.2884       7.792608 105.2609       15.65012 113.2755       8.985743 89.51749 7.235819 95.35587 3.875039 -5.838371      8.208106 
1 1 1 -10 34 17 o 67.46033 4.209625 57.13239       6.885859 0.000000       0.000000 57.13239       6.885859 ?        ?        67.46033 4.209625 0.000000       4.209625 
1 1 1 -10 34 18 o 41.20785 4.844256 21.75130       4.771749 28.50974       10.41385 19.95520       5.368495 44.25875 9.903385 39.03431 5.821509 5.224442       11.48769 
1 1 1 -10 34 19 o 43.98708 4.076174 24.48044       4.319624 21.33211       7.110479 26.32199       5.438148 39.25110 7.708998 45.20704 5.020974 -5.955936      9.199936 
1 1 1 -10 34 20 o 37.71465 4.535958 18.27430       4.085260 7.672954       6.814717 24.22131       5.104070 24.25776 8.859428 43.30016 4.924559 -19.04240      10.13611 
1 1 1 -10 34 21 o 63.87700 3.240571 51.00870       5.027833 44.40671       8.273708 54.87417       6.330882 57.88128 5.950445 65.85083 3.963527 -7.969551      7.149639 
1 1 1 -10 34 22 o 23.66337 6.570086 7.817204       3.922857 9.626821       5.934442 6.412790       5.227983 25.72674 8.309961 21.91045 7.790823 3.816292       11.39089 
1 1 1 -10 34 23 o 18.98832 6.254618 4.831355       3.353719 5.591310       5.818439 4.453259       4.104058 21.13095 8.088586 18.85044 6.876693 2.280512       10.61669 
1 1 1 -10 34 24 o 31.15061 5.297295 13.11952       3.877387 8.523706       6.635621 15.50229       4.777950 24.03596 8.747748 33.42080 6.090975 -9.384834      10.65941 
1 1 1 -10 34 25 f 39.68705 4.291787 20.57978       4.084761 25.37539       6.982665 18.08492       5.036427 41.88942 7.093271 36.12143 5.927042 5.767986       9.243609 
1 1 1 -10 34 26 o 21.27378 6.379955 6.532512       3.568943 1.804482       6.126478 8.961198       4.390928 17.67290 7.670597 24.51077 7.002747 -6.837860      10.38636 
1 1 1 -10 34 27 o 11.87137 5.335737 -0.7508706     3.223896 -4.873369      5.440171 1.480528       4.002403 12.95930 6.183339 15.02944 6.352805 -2.070140      8.865202 
1 1 1 -10 34 28 o 13.85087 5.986085 0.7721047      3.699081 -4.493263      8.931261 1.862336       4.064038 16.64483 7.936519 15.31082 6.432655 1.334005       10.21604 
1 1 1 -10 34 29 o 23.49649 6.163795 8.296540       3.572528 18.31871       6.399857 3.759866       4.305843 33.31305 7.987082 17.24123 6.853107 16.07182       10.52419 
1 1 1 -10 34 30 o 23.20886 6.301435 8.321126       3.654858 6.323081       6.500010 9.244902       4.419720 20.08262 8.259772 23.81496 7.089800 -3.732342      10.88527 
1 1 1 -10 34 31 o 16.67746 6.678304 3.708303       4.119264 5.516578       6.454475 2.465652       5.350609 19.14146 8.077977 16.37187 7.136399 2.769583       10.77877 
1 1 1 -10 34 32 o 18.27972 7.247642 5.239295       4.804380 4.712190       6.341299 5.949549       7.361001 18.23391 7.858739 19.30277 8.392726 -1.068861      11.49772 
1 1 1 -10 35 1  o 91.34533 2.909795 102.7091       6.468901 88.80708       8.799417 119.0582       9.542511 84.42463 4.291167 97.91592 4.007671 -13.49129      5.871588 
1 1 1 -10 35 2  o 12.14994 5.435226 -1.256696      3.302326 0.4054979E-01  3.826973 -5.038926      6.534587 14.30676 6.134714 15.46488 7.188068 -1.158121      9.450028 
1 1 1 -10 35 3  o 86.09386 3.030770 91.31306       6.348679 86.99168       8.713346 96.20335       9.269187 83.56937 4.292987 87.87125 4.342161 -4.301880      6.106071 
1 1 1 -10 35 4  o 69.20181 3.578384 59.30274       6.013993 54.08340       10.01309 62.24800       7.521817 64.93345 6.411542 70.62029 4.392508 -5.686836      7.771872 
1 1 1 -10 35 5  o 157.6220 3.548634 306.8371       13.63057 289.6437       17.96443 330.1661       20.92575 152.1873 4.850135 162.0882 5.304919 -9.900925      7.187905 
1 1 1 -10 35 6  o 81.52780 3.033901 81.91237       6.017070 78.11388       8.459167 85.80249       8.560582 79.11825 4.404866 82.99943 4.246568 -3.881180      6.118511 
1 1 1 -10 35 7  o 82.36452 3.343369 83.81906       6.696641 83.21695       8.814140 84.64118       10.29932 81.63525 4.447434 81.98112 5.181869 -0.3458786     6.828721 
1 1 1 -10 35 8  o 115.8868 3.444617 165.9951       9.716924 132.9332       17.05968 181.8722       11.82204 101.4950 6.939219 121.0009 4.014852 -19.50584      8.016970 
1 1 1 -10 35 9  o 61.02801 4.386914 46.63699       6.480628 46.71702       10.54831 46.58846       8.213584 59.63942 7.417800 60.47319 5.638558 -0.8337746     9.317569 
1 1 1 -10 35 10 o 44.97435 4.701763 25.56873       5.076974 17.07098       8.760579 29.86590       6.229764 34.80242 9.874382 48.38864 5.373646 -13.58622      11.24186 
1 1 1 -10 35 11 o 43.86764 4.830451 24.41765       5.078414 24.21397       10.02028 24.48805       5.891051 41.22965 10.06293 43.61013 5.678005 -2.380478      11.55432 
1 1 1 -10 35 12 o 26.48116 6.544535 9.378893       4.198716 7.109627       7.967785 10.25130       4.940310 25.02160 9.492304 27.53060 7.260910 -2.508997      11.95093 
1 1 1 -10 35 13 o 58.42453 3.854930 42.65611       5.457757 46.76786       11.14524 41.35909       6.259654 58.92736 7.965096 57.25808 4.522895 1.669277       9.159658 
1 1 1 -10 35 14 o 42.16495 4.724349 22.65414       4.770963 20.50752       8.937682 23.50956       5.642045 37.70492 9.678800 42.61397 5.566014 -4.909050      11.16511 
1 1 1 -10 35 15 o 19.20185 6.854041 4.369055       4.050058 4.732204       7.668155 4.228559       4.769593 22.58200 9.087875 19.64717 7.368083 2.934832       11.69949 
1 1 1 -10 35 16 o 10.97274 5.306045 -6.397325      4.324219 0.000000       0.000000 -6.397325      4.324219 ?        ?        10.97274 5.306045 0.000000       5.306045 
1 1 1 -10 35 17 o 30.15756 6.088284 12.23200       4.319970 13.79861       8.654910 11.71220       4.985400 30.50230 10.04777 29.07587 7.098846 1.426424       12.30249 
1 1 1 -10 35 18 o 30.57940 5.817836 12.53637       4.177012 5.388545       8.921829 14.54294       4.727086 23.48615 9.670082 32.83925 6.132428 -9.353096      11.45064 
1 1 1 -10 35 19 o 18.56114 6.696323 4.195004       3.877203 4.589387       8.243877 4.082993       4.393434 22.26880 9.243952 18.82993 7.069480 3.438877       11.63736 
1 1 1 -10 35 20 o 32.95956 4.988645 14.33448       3.881649 14.41434       6.436830 14.28884       4.865972 31.13434 8.323545 32.13580 6.438177 -1.001455      10.52290 
1 1 1 -10 35 21 o 25.33534 6.705147 9.132950       4.203641 8.587118       6.708982 9.485738       5.393670 24.36124 8.805928 25.37655 7.889309 -1.015306      11.82310 
1 1 1 -10 35 22 o 16.65259 6.272824 3.203129       3.465302 4.585331       6.166621 2.565211       4.189324 20.21947 8.145262 16.64459 6.710597 3.574875       10.55355 
1 1 1 -10 35 23 o 15.10690 6.042794 2.096792       3.368816 0.9669026      6.083496 2.596520       4.045779 17.24908 7.561975 16.43747 6.605987 0.8116074      10.04104 
1 1 1 -10 35 24 f 51.44107 3.700415 33.99571       4.607708 33.41415       7.962152 34.28853       5.649888 48.00795 7.012755 50.96268 4.598800 -2.954731      8.386161 
1 1 1 -10 35 25 o 23.67303 6.163732 8.131370       3.590105 8.761357       5.872880 7.755484       4.536413 23.58665 8.268847 22.64302 7.261031 0.9436245      11.00438 
1 1 1 -10 35 26 o 12.24450 5.463470 -0.4270944     3.314119 7.842415       6.102805 -3.885749      3.946783 22.29273 8.339781 11.06192 5.274886 11.23081       9.867946 
1 1 1 -10 35 27 o 37.61247 4.946172 19.47678       4.423775 14.00705       10.11426 20.77067       4.919258 26.11243 10.46183 38.45263 5.398193 -12.34020      11.77244 
1 1 1 -10 35 28 o 29.69526 5.493104 12.69615       3.828662 13.47523       6.860260 12.34372       4.614077 26.90353 8.948731 28.10165 6.809918 -1.198122      11.24521 
1 1 1 -10 35 29 o 23.08868 6.835636 8.603321       4.117607 11.31170       6.503323 6.791074       5.319730 24.48372 8.690959 20.29602 7.742724 4.187704       11.63970 
1 1 1 -10 35 30 o 12.03361 5.560861 -1.322122      3.826472 1.851205       5.963504 -3.542973      4.988888 16.33048 7.304770 12.41727 5.923777 3.913210       9.404829 
1 1 1 -10 35 31 o 38.65694 5.121277 21.55866       4.705814 16.26511       7.065338 25.77925       6.308790 28.21809 9.062939 40.31617 6.653291 -12.09808      11.24292 
1 1 1 -10 36 1  o 19.34002 7.127900 4.130971       4.427119 -0.1625093     5.701056 10.65285       7.026465 16.95406 7.378614 27.95141 9.043424 -10.99735      11.67165 
1 1 1 -10 36 2  o 54.85665 3.988912 37.67416       5.295929 41.98805       8.815310 35.23791       6.624668 56.73396 6.492968 52.53544 5.244598 4.198517       8.346522 
1 1 1 -10 36 3  o 19.05354 6.798356 4.211217       3.984117 3.768244       5.804925 4.605708       5.478056 20.31396 7.993894 20.82463 7.877452 -0.5106659     11.22304 
1 1 1 -10 36 4  o 77.84570 3.093614 74.94345       5.856945 71.61842       8.251811 78.31918       8.314485 75.47395 4.507117 79.02742 4.333983 -3.553467      6.252800 
1 1 1 -10 36 5  o 50.77936 3.599950 32.14472       4.425832 28.86888       6.123647 35.72726       6.403898 47.44371 5.392126 53.00293 5.017767 -5.559223      7.365664 
1 1 1 -10 36 6  o 68.45865 3.151316 58.03259       5.243121 60.00835       7.488779 56.13293       7.343151 69.06285 4.473769 66.75493 4.541050 2.307922       6.374617 
1 1 1 -10 36 7  o 46.35275 3.676540 26.85242       4.118900 22.87975       5.500716 31.92276       6.214361 42.11013 5.491058 49.98164 5.176979 -7.871510      7.546710 
1 1 1 -10 36 8  o 24.14464 7.718663 7.734802       5.129209 11.92321       8.331002 5.177958       6.509161 29.35564 9.863202 22.17511 8.538095 7.180527       13.04538 
1 1 1 -10 36 9  o 13.62866 6.195360 -2.187250      4.493907 -5.590513      6.642314 0.6854442      6.102620 15.16749 7.114218 18.03479 7.740307 -2.867295      10.51306 
1 1 1 -10 36 10 o 38.22087 5.301697 18.90515       4.805215 11.18188       8.530173 22.49520       5.815769 28.54194 9.968377 41.46585 5.923614 -12.92391      11.59559 
1 1 1 -10 36 11 o 35.05606 5.328671 15.99088       4.409036 20.64547       8.732989 14.39858       5.107813 37.70228 9.508228 32.68607 6.639445 5.016212       11.59692 
1 1 1 -10 36 12 o 41.54959 4.732991 22.12052       4.706898 15.35826       9.045630 24.63135       5.511896 32.19639 10.24563 43.61252 5.294572 -11.41613      11.53280 
1 1 1 -10 36 13 o 33.00064 5.430295 14.30880       4.215225 10.04433       7.915767 15.99669       4.980042 27.00199 9.588055 34.61329 6.128349 -7.611296      11.37926 
1 1 1 -10 36 14 o 68.51846 3.573121 58.81068       5.945498 66.04481       12.05806 56.48697       6.833998 69.84754 7.186625 66.78885 4.220476 3.058693       8.334266 
1 1 1 -10 36 15 o 21.23934 7.159940 5.956344       4.390011 0.000000       0.000000 5.956344       4.390011 ?        ?        21.23934 7.159940 0.000000       7.159940 
1 1 1 -10 36 16 o 16.62090 6.455389 2.731296       3.744855 -10.39733      7.237283 7.531666       4.376262 13.85748 6.739076 23.28119 7.082820 -9.423712      9.776578 
1 1 1 -10 36 17 o 26.23749 6.307225 9.544684       3.982718 15.92064       8.724932 7.866430       4.476292 31.69320 10.05966 23.62948 7.158064 8.063721       12.34644 
1 1 1 -10 36 18 o 40.49058 4.728601 21.42020       4.578024 38.41797       9.681396 16.52479       5.195610 51.58072 7.957884 34.55356 6.406152 17.02716       10.21600 
1 1 1 -10 36 19 o 43.20094 4.560119 24.35380       4.728357 15.46101       9.365455 27.39597       5.477745 30.33789 10.45319 45.53464 5.019750 -15.19675      11.59600 
1 1 1 -10 36 20 o 24.51522 7.143020 8.787369       4.526897 4.704054       8.311996 10.50927       5.397635 21.61015 9.145678 26.42142 7.827350 -4.811275      12.03789 
1 1 1 -10 36 21 o 36.68725 4.579021 17.76711       4.004891 26.81909       6.786901 12.93126       4.960622 43.54153 6.603243 29.75637 6.964886 13.78516       9.597524 
1 1 1 -10 36 22 o 25.09462 6.044582 8.980014       3.652243 14.81570       6.443224 6.217350       4.433240 30.53742 8.397695 20.81576 7.191064 9.721661       11.05589 
1 1 1 -10 36 23 o 26.04413 5.989681 9.716234       3.722083 10.19717       6.522416 9.483985       4.532568 25.01525 8.717967 25.03383 7.102506 -0.1858139E-01 11.24493 
1 1 1 -10 36 24 o 16.44269 6.207993 3.374953       3.398432 9.951330       5.868090 0.5608168E-01  4.168681 24.63845 8.277849 13.96074 6.184156 10.67771       10.33279 
1 1 1 -10 36 25 o 14.88611 6.054022 2.154253       3.443527 8.696002       6.141346 -0.8456126     4.158795 22.89086 8.402249 13.17758 5.978307 9.713278       10.31203 
1 1 1 -10 36 26 o 34.15087 5.552486 16.68724       4.462302 30.67709       11.68982 14.30101       4.827890 36.79370 11.63987 30.56896 6.669004 6.224741       13.41500 
1 1 1 -10 36 27 o 20.90138 6.975467 7.003367       4.167677 5.880161       6.788543 7.682794       5.279806 19.81713 8.319103 21.37198 7.799276 -1.554852      11.40334 
1 1 1 -10 36 28 o 29.81415 6.473288 13.82157       4.567997 12.33693       7.076054 14.88237       5.981308 24.91600 9.038442 28.94245 8.141020 -4.026447      12.16428 
1 1 1 -10 36 29 o 33.86644 5.040380 16.42463       4.033186 13.49529       6.704697 18.08571       5.048817 26.00825 8.847847 34.22757 6.284618 -8.219322      10.85269 
1 1 1 -10 37 1  o 26.56886 6.612509 9.644794       4.264250 7.703094       6.608776 11.02983       5.581630 24.32676 8.746881 28.01790 7.858413 -3.691143      11.75851 
1 1 1 -10 37 2  o 57.17334 3.472448 40.86120       4.815184 40.05012       6.715583 41.71940       6.907884 55.86336 4.985443 57.00097 5.024474 -1.137611      7.078134 
1 1 1 -10 37 3  f 54.53185 3.513560 37.20256       4.644258 35.32299       6.634270 39.00883       6.503622 52.28769 5.278847 55.18918 4.886199 -2.901493      7.193133 
1 1 1 -10 37 4  o 73.28518 3.093692 66.70966       5.512535 60.72635       7.831152 72.58643       7.761122 69.07180 4.680163 75.84077 4.215976 -6.768974      6.299078 
1 1 1 -10 37 5  o 84.51064 3.007257 88.59256       6.183369 88.30250       9.080503 88.84335       8.443420 83.47806 4.480179 83.96972 4.139044 -0.4916611     6.099483 
1 1 1 -10 37 6  o 60.69046 3.303866 45.92914       4.867860 46.12274       7.041639 45.75194       6.736859 60.03641 4.854447 59.90999 4.650876 0.1264191      6.722820 
1 1 1 -10 37 7  o 46.15241 4.044753 26.95224       4.503131 24.64692       5.584453 31.23790       7.614199 43.50832 5.381731 48.29253 6.646122 -4.784214      8.551840 
1 1 1 -10 37 8  o 36.26421 5.483839 17.27451       4.694987 26.80646       8.203034 12.63083       5.725517 43.78710 7.981612 29.91540 7.781345 13.87170       11.14699 
1 1 1 -10 37 9  f 63.18048 3.829472 50.24372       5.868321 38.33047       10.53536 55.60262       7.065971 51.92150 8.629353 66.13707 4.409390 -14.21557      9.690637 
1 1 1 -10 37 10 o 58.27750 3.980650 42.93679       5.619215 37.09585       11.20633 44.89869       6.494723 50.16121 9.515727 59.28798 4.529585 -9.126774      10.53880 
1 1 1 -10 37 11 o 26.95454 7.269309 10.22370       4.883419 9.163110       8.357224 10.77360       6.017675 25.98032 9.751054 27.34511 8.302781 -1.364796      12.80700 
1 1 1 -10 37 12 o 37.00248 5.063797 17.93259       4.446417 1.938937       8.036490 24.98844       5.337860 20.40163 8.820240 43.74701 5.102765 -23.34538      10.18994 
1 1 1 -10 37 13 f 24.95850 6.766800 8.732882       4.218188 7.571479       7.862022 9.202345       4.998545 24.19099 9.365015 25.38553 7.535438 -1.194542      12.02025 
1 1 1 -10 37 14 o 43.44894 5.180714 24.86618       5.377422 0.000000       0.000000 24.86618       5.377422 ?        ?        43.44894 5.180714 0.000000       5.180714 
1 1 1 -10 37 15 o 18.35397 6.671437 4.176261       3.857789 3.276608       7.291728 4.525968       4.546160 20.29298 8.576048 19.25474 7.199073 1.038240       11.19711 
1 1 1 -10 37 16 o 31.14381 6.032751 13.40225       4.413090 14.60482       8.720831 12.98829       5.116566 29.80297 10.09138 29.99237 7.109579 -0.1893997     12.34431 
1 1 1 -10 37 17 f 28.60981 6.378934 11.56806       4.333870 14.60264       8.692043 10.56405       4.999671 29.58023 10.07397 26.74147 7.414370 2.838757       12.50831 
1 1 1 -10 37 18 o 19.19485 6.760741 4.945719       3.929183 3.149224       7.686700 5.581164       4.571573 20.11574 8.660906 20.25315 7.275783 -0.1374149     11.31142 
1 1 1 -10 37 19 o 45.23124 5.305044 27.62202       5.736409 33.15912       10.00159 24.90760       7.002704 45.36939 9.357107 41.31164 7.218569 4.057751       11.81792 
1 1 1 -10 37 20 o 38.24385 5.109561 19.78540       4.642872 22.51028       9.255713 18.86921       5.366944 35.75786 10.15097 36.47122 6.264287 -0.7133560     11.92827 
1 1 1 -10 37 21 o 18.36558 6.773975 4.508870       3.999695 -5.653691      7.903274 8.007828       4.637403 15.58766 7.441667 22.93482 7.340068 -7.347161      10.45251 
1 1 1 -10 37 22 o 42.19205 4.141803 23.47338       4.203677 25.24252       6.995110 22.47333       5.259262 40.78318 7.306829 40.14799 5.521668 0.6351891      9.158525 
1 1 1 -10 37 23 o 31.75125 5.310717 14.13203       3.964124 20.91270       6.886615 10.77191       4.847824 35.91257 8.066659 26.07512 7.327273 9.837450       10.89770 
1 1 1 -10 37 24 o 17.06882 6.545999 3.873975       3.815600 9.437801       5.931315 -0.5405416E-01 4.983697 23.42444 8.301423 14.66178 6.608160 8.762657       10.61044 
1 1 1 -10 37 25 o 10.94878 5.307186 -5.277979      4.392579 0.9366245      9.448751 -6.991356      4.961285 18.39845 8.582376 11.12328 5.446162 7.275179       10.16454 
1 1 1 -10 37 26 o 22.49638 7.145744 8.366151       4.401722 4.458019       6.915474 11.02781       5.707080 18.71946 8.136986 24.77139 8.159123 -6.051929      11.52310 
1 1 1 -10 37 27 o 22.56716 6.605150 8.218067       3.863153 7.133483       6.878326 8.717838       4.669135 20.32146 8.440350 22.54282 7.377562 -2.221361      11.21017 
1 1 1 -10 37 28 o 43.19754 4.310652 25.64258       4.477201 23.19970       7.886780 26.80417       5.438471 34.37082 9.224427 42.97967 5.304986 -8.608849      10.64110 
1 1 1 -10 38 1  o 56.18629 3.392241 39.68414       4.623016 30.01927       6.506227 49.53971       6.570106 47.49172 5.737979 62.19284 4.362741 -14.70111      7.208185 
1 1 1 -10 38 2  o 23.11734 5.769900 7.292045       3.239990 9.094672       4.616671 5.542511       4.548174 25.35020 7.159881 20.63534 7.273320 4.714865       10.20613 
1 1 1 -10 38 3  o 46.65224 3.662644 27.52769       4.130563 30.31360       5.855522 24.76831       5.827575 48.19553 5.061080 43.15627 5.678930 5.039265       7.606890 
1 1 1 -10 38 4  o 70.07312 3.574097 61.81759       6.082990 49.15598       10.21166 68.78175       7.573312 59.65696 7.167619 73.44222 4.249744 -13.78527      8.332772 
1 1 1 -10 38 5  o 47.23727 4.077134 28.46743       4.647383 26.60615       5.869198 31.59601       7.609342 44.86208 5.482400 48.08157 6.674006 -3.219490      8.637074 
1 1 1 -10 38 6  o 13.50043 5.631778 0.8724813      3.081644 -1.017940      4.132085 3.241627       4.625790 13.58721 6.078892 18.06464 7.127591 -4.477436      9.367789 
1 1 1 -10 38 7  o 28.46175 6.376320 11.21780       4.312550 26.68436       8.361153 5.611791       5.033800 42.80803 8.314786 20.92456 7.618540 21.88347       11.27731 
1 1 1 -10 38 8  o 61.74215 3.899753 48.42114       5.837547 60.24509       11.04596 43.83914       6.876221 66.11112 6.960673 58.05449 4.906358 8.056633       8.516062 
1 1 1 -10 38 9  o 26.59863 6.718567 9.980676       4.355412 17.49061       8.183290 7.012540       5.144602 33.37384 9.567926 22.51130 7.747839 10.86253       12.31155 
1 1 1 -10 38 10 o 45.40958 4.731692 26.88758       5.159286 6.264748       8.668654 38.19963       6.420194 23.28753 9.554015 54.05041 4.928467 -30.76288      10.75030 
1 1 1 -10 38 11 o 37.66992 5.283943 18.92307       4.717335 19.51178       9.261569 18.71684       5.481689 34.35875 10.27138 36.79563 6.342344 -2.436886      12.07173 
1 1 1 -10 38 12 o 54.82252 4.141068 38.65347       5.491415 22.91810       10.23829 45.00850       6.506501 36.60744 10.76336 58.84600 4.573143 -22.23856      11.69460 
1 1 1 -10 38 13 o 15.02463 6.607435 0.2415516E-01  4.677742 0.000000       0.000000 0.2415516E-01  4.677742 ?        ?        15.02463 6.607435 0.000000       6.607435 
1 1 1 -10 38 14 o 14.53869 6.228714 0.7445964      3.938781 -0.8092403     7.022595 1.457738       4.757543 17.25205 7.803486 16.23297 6.896630 1.019079       10.41431 
1 1 1 -10 38 15 o 17.18977 6.519632 3.475466       3.758188 3.797169       7.366261 3.362262       4.369671 20.29707 8.600707 17.58547 6.930880 2.711596       11.04578 
1 1 1 -10 38 16 o 54.59265 4.201124 38.72444       5.546065 18.85556       10.08151 47.34692       6.641327 32.07750 10.85018 60.05473 4.572446 -27.97722      11.77428 
1 1 1 -10 38 17 o 22.81227 6.878865 7.671640       4.140628 4.335026       7.776822 8.991744       4.891626 20.62614 8.792165 24.33653 7.504332 -3.710382      11.55929 
1 1 1 -10 38 18 o 19.64266 7.311737 5.289214       4.679338 2.354077       7.841842 6.912223       5.831286 19.29276 8.516921 21.71145 8.145979 -2.418686      11.78537 
1 1 1 -10 38 19 o 73.67616 3.683602 70.02550       6.592591 65.62222       13.11697 71.51373       7.625734 64.05266 8.622286 73.77351 4.259865 -9.720856      9.617186 
1 1 1 -10 38 20 o 17.20338 6.626742 3.736259       3.922278 1.147902       7.031140 4.905623       4.725945 17.62158 7.903261 18.94395 7.280040 -1.322372      10.74526 
1 1 1 -10 38 21 o 28.60833 6.887802 12.57657       4.743966 10.14132       9.754699 13.33096       5.429262 23.76382 9.973868 28.77466 7.622433 -5.010832      12.55307 
1 1 1 -10 38 22 o 12.09543 5.637581 -2.140131      4.063714 -4.560773      7.613655 -1.175835      4.805441 15.18437 7.264070 13.72246 6.301505 1.461906       9.616427 
1 1 1 -10 38 23 o 11.21321 5.354416 -3.713843      4.096188 -0.7444474     6.413528 -5.759565      5.323367 15.57318 7.197516 12.08905 5.855770 3.484130       9.278701 
1 1 1 -10 38 24 o 14.09357 6.150588 1.007726       3.984565 -0.9287494     9.917244 1.380505       4.351218 17.76672 8.440664 14.80132 6.443891 2.965399       10.61925 
1 1 1 -10 38 25 o 30.84216 5.623522 14.03792       4.070902 19.70688       7.112258 11.27573       4.964577 32.55262 8.770002 25.67399 7.480280 6.878630       11.52682 
1 1 1 -10 38 26 o 30.81462 5.569136 14.05310       4.028086 16.54536       7.023176 12.83139       4.917241 28.90008 9.005320 27.65735 7.219744 1.242733       11.54212 
1 1 1 -10 39 1  o 52.95946 3.901926 35.95061       5.000328 33.79588       6.450908 39.19398       7.914477 50.27655 5.347183 53.39606 6.197411 -3.119511      8.185369 
1 1 1 -10 39 2  o 28.25331 5.818007 11.03119       3.872231 15.08717       5.111495 5.568615       5.931970 32.62096 6.655714 20.99594 8.132896 11.62502       10.50916 
1 1 1 -10 39 3  o 8.041843 3.989635 -6.654692      2.977065 -4.845636      3.808400 -9.497012      4.773679 10.53326 5.064806 10.38507 5.134183 0.1481943      7.211942 
1 1 1 -10 39 4  o 17.28721 7.307817 1.934781       5.297008 -6.950083      6.739014 16.29834       8.568444 14.15836 6.789440 31.33437 9.971771 -17.17601      12.06369 
1 1 1 -10 39 5  o 19.34508 7.197743 4.736558       4.533596 11.57201       7.868679 1.339955       5.546776 27.02961 9.563205 17.08796 7.357251 9.941652       12.06582 
1 1 1 -10 39 6  o 33.80247 7.581050 16.82062       6.090424 0.000000       0.000000 16.82062       6.090424 ?        ?        33.80247 7.581050 0.000000       7.581050 
1 1 1 -10 39 7  o 36.87334 5.429253 18.35257       4.732649 11.83660       8.837296 20.97277       5.603983 27.11928 10.05704 38.98874 6.097871 -11.86946      11.76129 
1 1 1 -10 39 8  o 38.82254 5.288489 20.24063       4.873293 40.37904       10.59941 14.84249       5.487709 51.40968 8.775309 31.89750 7.227743 19.51217       11.36865 
1 1 1 -10 39 9  f 21.62060 6.946494 6.668408       4.150483 4.704419       7.263317 7.620656       5.057553 20.94968 8.684857 22.86310 7.684948 -1.913414      11.59677 
1 1 1 -10 39 10 o 32.40051 5.910791 14.55174       4.495048 9.025202       8.779988 16.51483       5.232846 24.69164 9.795205 34.13175 6.529165 -9.440111      11.77183 
1 1 1 -10 39 11 o 62.41948 4.630710 51.12172       6.993578 0.000000       0.000000 51.12172       6.993578 ?        ?        62.41948 4.630710 0.000000       4.630710 
1 1 1 -10 39 12 o 51.79005 5.295285 36.13470       6.589041 0.000000       0.000000 36.13470       6.589041 ?        ?        51.79005 5.295285 0.000000       5.295285 
1 1 1 -10 39 13 o 14.17274 6.204587 0.2290869      4.082723 -11.47099      7.527770 5.104853       4.859520 13.45651 6.612913 19.64804 7.422316 -6.191529      9.940895 
1 1 1 -10 39 14 o 29.15905 6.711094 12.46271       4.669761 -0.5554870     8.127413 18.87842       5.705573 18.06258 8.257236 36.06288 6.740122 -18.00029      10.65886 
1 1 1 -10 39 15 o 42.63451 5.325618 24.87608       5.412746 21.89282       9.733745 26.21153       6.512527 34.21818 10.59179 42.74232 6.453370 -8.524147      12.40290 
1 1 1 -10 39 16 o 27.13657 8.409287 12.14478       6.133643 14.89318       8.360893 8.941866       9.025775 28.53147 9.874583 23.63323 9.727989 4.898237       13.86150 
1 1 1 -10 39 17 o 18.40346 7.191724 4.402390       4.670641 2.024636       7.673013 5.802014       5.886922 18.61276 8.308527 20.29561 8.030406 -1.682848      11.55504 
1 1 1 -10 39 18 o 38.20360 5.959435 20.96706       5.367109 20.65316       9.072674 21.13605       6.656842 32.60537 10.24645 36.54726 7.716934 -3.941895      12.82735 
1 1 1 -10 39 19 o 13.10840 5.959686 -0.8576142     4.160310 -2.821707      7.704535 -0.4920715E-01 4.942884 16.01562 7.558374 14.66129 6.596825 1.354329       10.03230 
1 1 1 -10 39 20 o 17.27786 6.799269 3.930629       4.199639 -4.940351      8.149492 7.138215       4.900426 15.47206 7.431644 21.04176 7.536073 -5.569703      10.58403 
1 1 1 -10 39 21 o 14.65186 6.283775 1.527954       4.016491 -9.129592      7.861319 5.292718       4.672353 13.81556 6.783017 18.82090 7.237125 -5.005339      9.918937 
1 1 1 -10 39 22 o 15.30694 6.421860 2.298696       4.041460 1.920899       7.876096 2.433723       4.708620 17.79438 8.132328 15.99059 6.829500 1.803789       10.61964 
1 1 1 -10 39 23 f 12.68859 5.882267 -1.461862      4.332560 0.000000       0.000000 -1.461862      4.332560 ?        ?        12.68859 5.882267 0.000000       5.882267 
1 1 1 -10 40 1  o 10.67217 5.011298 -2.713422      3.311671 -3.551589      3.873858 -0.4378774     6.382943 11.23173 5.318252 16.52217 7.459664 -5.290434      9.161353 
1 1 1 -10 40 2  o 19.00291 6.544590 4.985802       3.670951 11.39585       4.661399 -5.481133      5.956557 27.76678 6.915273 13.52232 6.456985 14.24446       9.461165 
1 1 1 -10 40 3  o 12.61084 5.473051 0.1883600      3.118444 2.364248       4.483006 -1.851604      4.340725 16.55639 6.839531 13.04844 5.990908 3.507953       9.092314 
1 1 1 -10 40 4  o 14.78709 6.175063 1.472205       3.710687 1.153096       6.385414 1.634915       4.559601 17.52582 7.713177 15.97937 6.768689 1.546453       10.26198 
1 1 1 -10 40 5  o 15.88937 6.022537 2.926013       3.205704 3.809916       4.455223 1.977096       4.616160 17.98895 7.025607 16.33960 6.859717 1.649342       9.819107 
1 1 1 -10 40 6  o 10.51389 4.918455 -2.433553      3.139671 -3.789388      4.449244 -1.088727      4.431142 12.09187 5.717792 13.68345 6.193080 -1.591580      8.428961 
1 1 1 -10 40 7  o 31.89635 5.953497 14.31001       4.457376 11.20367       8.182427 15.62080       5.315268 25.89715 9.663067 32.63671 6.899301 -6.739565      11.87330 
1 1 1 -10 40 8  o 18.87723 7.324823 4.470390       4.818039 0.000000       0.000000 4.470390       4.818039 ?        ?        18.87723 7.324823 0.000000       7.324823 
1 1 1 -10 40 9  o 26.62702 6.777127 10.50319       4.407950 15.07332       8.231787 8.665953       5.219298 29.23540 9.804107 23.70175 7.802460 5.533651       12.52992 
1 1 1 -10 40 10 o 40.30681 6.193069 23.07379       5.888729 0.000000       0.000000 23.07379       5.888729 ?        ?        40.30681 6.193069 0.000000       6.193069 
1 1 1 -10 40 11 o 56.19859 4.350265 41.64015       5.911326 48.54471       11.67641 39.26062       6.854670 54.46048 9.120353 53.57990 5.320065 0.8805809      10.55860 
1 1 1 -10 40 12 o 44.47931 4.923718 26.78469       5.247620 12.51665       9.215636 33.63089       6.383633 26.13847 10.13366 49.41286 5.388632 -23.27439      11.47730 
1 1 1 -10 40 13 o 20.17165 7.155860 6.004453       4.408229 8.448421       9.304220 5.297048       5.005717 23.12870 9.726135 19.51123 7.493868 3.617477       12.27826 
1 1 1 -10 40 14 o 30.25482 6.396661 13.52862       4.568430 12.84671       8.486015 13.80690       5.421037 26.18577 9.826378 29.56193 7.511138 -3.376156      12.36830 
1 1 1 -10 40 15 o 33.89532 6.669647 17.24626       5.312781 5.656243       8.091783 26.02813       7.043612 20.71617 8.902378 41.08031 7.303643 -20.36414      11.51501 
1 1 1 -10 40 16 o 14.57132 6.271400 1.249740       4.027472 -2.112652      7.277225 2.734322       4.835525 15.92032 7.460652 16.66071 7.009264 -0.7403822     10.23675 
1 1 1 -10 40 17 o 10.88237 5.168571 -3.219203      3.713406 -6.799377      7.439837 -2.031373      4.285373 14.21564 6.894547 12.47880 5.807200 1.736841       9.014341 
1 1 1 -10 40 18 o 29.04322 6.555945 12.97723       4.529610 5.953556       8.551601 15.71626       5.340276 20.46215 8.968258 31.45075 7.132544 -10.98860      11.45874 
1 1 1 -10 40 19 o 17.44308 6.756268 4.253547       4.093571 12.43457       8.421348 1.722387       4.684222 24.59930 9.643923 15.44794 6.706039 9.151361       11.74633 
1 1 1 -10 40 20 o 14.83634 6.173875 2.181988       3.690250 11.00491       7.197735 -0.9641721     4.298134 23.70610 9.015233 12.99946 5.965842 10.70663       10.81044 
1 1 1 -10 40 21 o 34.53727 5.890770 17.80431       4.780169 2.149850       8.921298 24.10864       5.661459 18.21767 8.443871 40.17373 5.963679 -21.95606      10.33753 
1 1 1 -10 41 1  o 31.35180 5.648934 13.93515       4.157118 14.62904       5.161869 12.65446       7.012711 30.99996 6.999229 26.81543 9.049403 4.184536       11.44032 
1 1 1 -10 41 2  o 27.70721 5.472245 10.84044       3.563691 12.30815       5.230251 9.568593       4.868781 27.91711 7.520479 24.61274 7.467246 3.304371       10.59799 
1 1 1 -10 41 3  o 24.94137 5.724122 8.935732       3.405253 10.30105       5.042977 7.791469       4.616716 25.47001 7.570928 22.41289 7.336092 3.057119       10.54216 
1 1 1 -10 41 4  o 21.80520 6.111681 6.984046       3.377306 5.053681       4.904916 8.724332       4.657171 19.20154 7.406783 23.63391 7.328207 -4.432371      10.41936 
1 1 1 -10 41 5  o 26.23153 5.617230 9.808093       3.482478 6.128819       4.764966 14.02667       5.102251 20.34231 7.411443 30.33275 7.038799 -9.990446      10.22126 
1 1 1 -10 41 6  o 33.74612 4.746731 15.46525       3.795765 12.63881       5.372157 18.28300       5.363899 28.19005 7.633784 35.28888 6.476021 -7.098829      10.01067 
1 1 1 -10 41 7  o 11.20916 5.309161 -3.319026      3.866163 2.146859       6.926652 -5.792431      4.659515 18.10642 7.998360 11.32379 5.483517 6.782634       9.697563 
1 1 1 -10 41 8  o 11.85458 5.458623 -1.627181      3.640214 -2.482182      6.830968 -1.288079      4.301942 15.53403 7.262973 13.12472 6.002767 2.409309       9.422526 
1 1 1 -10 41 9  o 24.89793 7.886717 10.16039       5.365123 0.000000       0.000000 10.16039       5.365123 ?        ?        24.89793 7.886717 0.000000       7.886717 
1 1 1 -10 41 10 o 35.07150 6.923017 18.70493       5.706664 0.000000       0.000000 18.70493       5.706664 ?        ?        35.07150 6.923017 0.000000       6.923017 
1 1 1 -10 41 11 o 40.39190 4.944004 22.46664       4.765079 26.50352       8.996655 20.89261       5.617765 38.06844 9.678216 37.60774 6.356118 0.4607010      11.57878 
1 1 1 -10 41 12 o 39.81004 5.129141 22.08389       4.860414 22.23077       8.912635 22.02172       5.798528 33.71150 10.07560 38.48178 6.408672 -4.770283      11.94105 
1 1 1 -10 41 13 o 40.20990 5.024655 22.47889       4.816349 23.20584       9.175489 22.20241       5.658604 34.05347 10.23360 38.78912 6.194638 -4.735653      11.96245 
1 1 1 -10 41 14 o 11.66415 5.563262 -3.793611      4.395061 -9.080826      6.812284 -0.2364374E-01 5.752387 12.81007 6.294348 15.40350 7.004985 -2.593435      9.417464 
1 1 1 -10 41 15 f 13.08941 5.882275 -0.2380269     3.916451 2.960684       7.231843 -1.565474      4.658757 18.18401 8.094897 13.20904 6.115225 4.974974       10.14511 
1 1 1 -10 41 16 o 24.59193 6.924646 9.738317       4.325075 4.174942       7.701037 12.30164       5.227349 18.98742 8.408357 27.01397 7.614884 -8.026550      11.34403 
1 1 1 -10 41 17 o 15.61521 6.341056 2.844685       3.771177 4.836877       7.895790 2.255917       4.292418 19.30264 8.532598 15.46923 6.560626 3.833408       10.76323 
1 1 1 -10 41 18 o 18.02802 6.854010 4.871595       4.159652 1.970998       8.109281 5.907306       4.845715 17.81160 8.181736 19.26721 7.379964 -1.455603      11.01838 
1 1 1 -10 42 1  o 18.92115 7.306307 5.264873       4.776381 2.039306       7.231442 7.761061       6.361515 17.76364 7.987085 21.51640 8.397504 -3.752760      11.58929 
1 1 1 -10 42 2  o 9.299845 4.485402 -3.800235      3.041149 -1.374923      4.584745 -5.705776      4.063878 13.28001 6.118966 10.27516 5.008788 3.004852       7.907572 
1 1 1 -10 42 3  o 16.25292 6.303649 3.363268       3.567047 1.850812       4.516187 5.871602       5.815984 15.53170 6.662199 19.80969 7.934427 -4.277983      10.36050 
1 1 1 -10 42 4  o 25.51776 6.197914 9.818521       3.815319 5.431673       4.734621 17.94295       6.443257 19.12870 7.302787 32.62104 8.133721 -13.49233      10.93106 
1 1 1 -10 42 5  o 21.90811 6.965867 7.606470       4.182024 5.873624       5.510287 9.960552       6.422513 19.74611 7.782878 23.65599 8.606627 -3.909885      11.60376 
1 1 1 -10 42 6  o 55.32601 4.019249 40.62183       5.381937 40.77421       7.149338 40.42255       8.175969 53.50060 5.564889 51.77866 6.631711 1.721947       8.657227 
1 1 1 -10 42 7  o 25.41286 9.395905 12.52991       7.703175 0.000000       0.000000 12.52991       7.703175 ?        ?        25.41286 9.395905 0.000000       9.395905 
1 1 1 -10 42 8  o 18.33242 7.151905 4.771132       4.612741 5.625572       7.430197 4.235323       5.883892 20.01163 8.563789 18.40380 7.736572 1.607838       11.54093 
1 1 1 -10 42 9  o 18.78354 7.193692 5.218265       4.603755 2.379673       7.417595 6.996849       5.871498 18.00944 8.094114 20.74915 8.076283 -2.739712      11.43421 
1 1 1 -10 42 10 o 15.05176 6.567214 1.329934       4.540373 6.796577       7.515904 -1.811488      5.697495 20.72212 8.729439 14.31461 6.673063 6.407507       10.98785 
1 1 1 -10 42 11 o 20.94853 7.458561 7.192065       4.793033 11.16341       8.052032 5.012663       5.964933 23.80663 9.400476 18.92028 7.859322 4.886345       12.25308 
1 1 1 -10 42 12 o 30.74891 11.61927 24.81245       11.91094 0.000000       0.000000 24.81245       11.91094 ?        ?        30.74891 11.61927 0.000000       11.61927 
1 1 1 -10 42 13 o 16.33423 6.913979 2.810396       4.751689 11.91194       7.822693 -2.511226      5.981647 24.26523 9.355512 14.16429 6.677087 10.10094       11.49387 
1 1 1 -10 42 14 o 22.80587 7.570744 8.915002       4.910717 11.53835       8.214682 7.456195       6.125784 23.69460 9.450098 20.82230 8.206358 2.872299       12.51594 
1 1 1 -10 43 1  o 14.38088 6.187965 1.479217       3.919239 2.734758       5.145346 -0.2560188     6.048925 16.49418 7.093627 15.30049 7.042149 1.193690       9.995569 
1 1 1 -10 43 2  f 13.23370 5.628822 1.186953       3.175417 0.7631372      4.541556 1.592309       4.441549 14.47921 6.432075 15.01873 6.524785 -0.5395174     9.162118 
1 1 1 -10 43 3  o 14.67108 5.957676 2.342333       3.328961 2.269780       4.925702 2.403334       4.516582 15.99372 6.909902 15.77496 6.711523 0.2187662      9.632823 
1 1 1 -10 43 4  o 12.49198 5.449565 0.5012666      3.125481 -1.212443      4.322885 2.378289       4.524178 12.88076 5.937399 15.76499 6.712564 -2.884236      8.961653 
1 1 1 -10 43 5  o 34.48420 5.008577 16.80457       4.085930 10.02814       5.919445 22.97144       5.646937 23.47033 8.295418 39.15445 6.118361 -15.68411      10.30768 
1 1 1 -10 43 6  o 15.98502 6.408352 3.173568       3.797471 -2.117742      6.293039 6.203756       4.762266 14.63734 6.884139 19.65602 7.364285 -5.018681      10.08088 
1 1 1 -10 43 7  f 14.28225 6.130394 1.458770       3.828780 -1.359719      6.675654 2.840415       4.673947 15.33121 7.171978 16.27330 6.871159 -0.9420919     9.932276 
1 1 1 -10 43 8  o 25.95170 6.622568 10.66336       4.201507 8.348044       7.532954 11.70886       5.062003 21.46907 8.867162 26.27140 7.523057 -4.802328      11.62854 
1 1 1 -9  0  1  o 592.0963 12.11395 4283.141       174.6239 4283.141       174.6239 4283.141       174.6239 592.0963 12.11395 592.0963 12.11395 0.000000       0.000000 
1 1 1 -9  0  2  o 328.3166 7.029727 1315.837       56.18468 1315.837       56.18468 1315.837       56.18468 328.3166 7.029727 328.3166 7.029727 0.000000       0.000000 
1 1 1 -9  0  3  o 630.6966 12.86586 4860.739       197.5547 4860.739       197.5547 4860.739       197.5547 630.6966 12.86586 630.6966 12.86586 0.000000       0.000000 
1 1 1 -9  0  4  o 315.2095 9.578830 1215.047       73.42407 1215.047       73.42407 1215.047       73.42407 315.2095 9.578830 315.2095 9.578830 0.000000       0.000000 
1 1 1 -9  0  5  o 51.95090 4.235160 33.54099       5.276991 33.54099       5.276991 33.54099       5.276991 51.95090 4.235160 51.95090 4.235160 0.000000       0.000000 
1 1 1 -9  0  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -9  0  7  f 490.7805 10.12184 2941.172       120.9389 2941.172       120.9389 2941.172       120.9389 490.7805 10.12184 490.7805 10.12184 0.000000       0.000000 
1 1 1 -9  0  8  o 456.0450 9.448037 2539.214       104.8974 2539.214       104.8974 2539.214       104.8974 456.0450 9.448037 456.0450 9.448037 0.000000       0.000000 
1 1 1 -9  0  9  o 1057.497 21.37848 13691.23       550.4167 13691.23       550.4167 13691.23       550.4167 1057.497 21.37848 1057.497 21.37848 0.000000       0.000000 
1 1 1 -9  0  10 o 554.7441 11.38065 3758.057       153.7033 3758.057       153.7033 3758.057       153.7033 554.7441 11.38065 554.7441 11.38065 0.000000       0.000000 
1 1 1 -9  0  11 o 844.5844 17.09866 8720.926       351.5923 8720.926       351.5923 8720.926       351.5923 844.5844 17.09866 844.5844 17.09866 0.000000       0.000000 
1 1 1 -9  0  12 f 362.5312 7.678532 1604.245       67.76723 1604.245       67.76723 1604.245       67.76723 362.5312 7.678532 362.5312 7.678532 0.000000       0.000000 
1 1 1 -9  0  13 o 196.4630 4.711076 471.1830       22.52541 471.1830       22.52541 471.1830       22.52541 196.4630 4.711076 196.4630 4.711076 0.000000       0.000000 
1 1 1 -9  0  14 o 312.0742 9.534257 1190.831       72.35384 1190.831       72.35384 1190.831       72.35384 312.0742 9.534257 312.0742 9.534257 0.000000       0.000000 
1 1 1 -9  0  15 o 704.8037 14.33817 6070.711       246.0323 6070.711       246.0323 6070.711       246.0323 704.8037 14.33817 704.8037 14.33817 0.000000       0.000000 
1 1 1 -9  0  16 o 322.6459 6.964502 1270.740       54.70101 1270.740       54.70101 1270.740       54.70101 322.6459 6.964502 322.6459 6.964502 0.000000       0.000000 
1 1 1 -9  0  17 o 130.4568 3.913999 207.9582       12.41759 207.9582       12.41759 207.9582       12.41759 130.4568 3.913999 130.4568 3.913999 0.000000       0.000000 
1 1 1 -9  0  18 o 66.59888 3.832011 54.58675       6.171630 54.58675       6.171630 54.58675       6.171630 66.59888 3.832011 66.59888 3.832011 0.000000       0.000000 
1 1 1 -9  0  19 o 235.6687 5.462540 678.0696       31.33325 678.0696       31.33325 678.0696       31.33325 235.6687 5.462540 235.6687 5.462540 0.000000       0.000000 
1 1 1 -9  0  20 o 589.9377 17.23668 4270.456       247.3180 4270.456       247.3180 4270.456       247.3180 589.9377 17.23668 589.9377 17.23668 0.000000       0.000000 
1 1 1 -9  0  21 o 196.6675 4.847688 472.3365       23.20100 472.3365       23.20100 472.3365       23.20100 196.6675 4.847688 196.6675 4.847688 0.000000       0.000000 
1 1 1 -9  0  22 o 15.74741 8.203946 4.398854       4.103218 4.398854       4.103218 4.398854       4.103218 15.74741 8.203946 15.74741 8.203946 0.000000       0.000000 
1 1 1 -9  0  23 o 78.51451 3.847143 75.68238       7.320308 75.68238       7.320308 75.68238       7.320308 78.51451 3.847143 78.51451 3.847143 0.000000       0.000000 
1 1 1 -9  0  24 o 141.5943 4.159242 245.0637       14.32342 245.0637       14.32342 245.0637       14.32342 141.5943 4.159242 141.5943 4.159242 0.000000       0.000000 
1 1 1 -9  0  25 f 132.8523 4.094683 215.8169       13.22786 215.8169       13.22786 215.8169       13.22786 132.8523 4.094683 132.8523 4.094683 0.000000       0.000000 
1 1 1 -9  0  26 o 151.7603 4.325496 281.5684       15.96731 281.5684       15.96731 281.5684       15.96731 151.7603 4.325496 151.7603 4.325496 0.000000       0.000000 
1 1 1 -9  0  27 o 37.53041 8.537780 19.65327       6.805882 19.65327       6.805882 19.65327       6.805882 37.53041 8.537780 37.53041 8.537780 0.000000       0.000000 
1 1 1 -9  0  28 o 437.8613 9.271984 2351.961       98.83383 2351.961       98.83383 2351.961       98.83383 437.8613 9.271984 437.8613 9.271984 0.000000       0.000000 
1 1 1 -9  0  29 o 45.81717 5.216015 26.60364       5.628947 26.60364       5.628947 26.60364       5.628947 45.81717 5.216015 45.81717 5.216015 0.000000       0.000000 
1 1 1 -9  0  30 o 210.7961 5.239195 543.6271       26.87551 543.6271       26.87551 543.6271       26.87551 210.7961 5.239195 210.7961 5.239195 0.000000       0.000000 
1 1 1 -9  0  31 o 17.38193 8.938262 5.422428       4.827815 5.422428       4.827815 5.422428       4.827815 17.38193 8.938262 17.38193 8.938262 0.000000       0.000000 
1 1 1 -9  0  32 o 39.96562 6.692613 21.09953       5.969179 21.09953       5.969179 21.09953       5.969179 39.96562 6.692613 39.96562 6.692613 0.000000       0.000000 
1 1 1 -9  0  33 o 254.5588 5.987381 794.1039       37.09524 794.1039       37.09524 794.1039       37.09524 254.5588 5.987381 254.5588 5.987381 0.000000       0.000000 
1 1 1 -9  0  34 o 123.9727 4.351385 188.4080       13.10911 188.4080       13.10911 188.4080       13.10911 123.9727 4.351385 123.9727 4.351385 0.000000       0.000000 
1 1 1 -9  0  35 o 66.29537 4.954496 54.63042       7.899036 54.63042       7.899036 54.63042       7.899036 66.29537 4.954496 66.29537 4.954496 0.000000       0.000000 
1 1 1 -9  0  36 o 66.38081 4.689908 54.68483       7.497912 54.68483       7.497912 54.68483       7.497912 66.38081 4.689908 66.38081 4.689908 0.000000       0.000000 
1 1 1 -9  0  37 o 25.35125 9.652069 10.74313       5.610530 10.74313       5.610530 10.74313       5.610530 25.35125 9.652069 25.35125 9.652069 0.000000       0.000000 
1 1 1 -9  0  38 o 69.62903 6.178366 60.97317       10.28475 60.97317       10.28475 60.97317       10.28475 69.62903 6.178366 69.62903 6.178366 0.000000       0.000000 
1 1 1 -9  0  39 o 16.64841 9.257320 4.774265       5.553001 4.774265       5.553001 4.774265       5.553001 16.64841 9.257320 16.64841 9.257320 0.000000       0.000000 
1 1 1 -9  0  40 o 56.58444 6.846698 41.33452       9.073827 41.33452       9.073827 41.33452       9.073827 56.58444 6.846698 56.58444 6.846698 0.000000       0.000000 
1 1 1 -9  0  41 o 29.15283 9.232899 13.38147       5.767825 13.38147       5.767825 13.38147       5.767825 29.15283 9.232899 29.15283 9.232899 0.000000       0.000000 
1 1 1 -9  0  42 o 12.43775 8.583105 -5.829538      8.717047 -5.829538      8.717047 -5.829538      8.717047 12.43775 8.583105 12.43775 8.583105 0.000000       0.000000 
1 1 1 -9  0  43 o 35.22300 7.441162 17.53358       5.619842 17.53358       5.619842 17.53358       5.619842 35.22300 7.441162 35.22300 7.441162 0.000000       0.000000 
1 1 1 -9  0  44 o 12.64318 7.959003 1.465245       5.162086 1.465245       5.162086 1.465245       5.162086 12.64318 7.959003 12.64318 7.959003 0.000000       0.000000 
1 1 1 -9  0  45 o 7.317589 5.290365 -8.812349      4.923112 -8.812349      4.923112 -8.812349      4.923112 7.317589 5.290365 7.317589 5.290365 0.000000       0.000000 
1 1 1 -9  0  46 o 12.63138 7.867906 2.102555       4.905705 2.102555       4.905705 2.102555       4.905705 12.63138 7.867906 12.63138 7.867906 0.000000       0.000000 
1 1 1 -9  0  47 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -9  0  48 o 15.36739 8.990272 5.189023       5.625877 5.189023       5.625877 5.189023       5.625877 15.36739 8.990272 15.36739 8.990272 0.000000       0.000000 
1 1 1 -9  0  49 o 8.778349 6.189260 -4.309814      5.261151 -4.309814      5.261151 -4.309814      5.261151 8.778349 6.189260 8.778349 6.189260 0.000000       0.000000 
1 1 1 -9  0  50 o 14.36599 9.402087 4.477194       8.150596 4.477194       8.150596 4.477194       8.150596 14.36599 9.402087 14.36599 9.402087 0.000000       0.000000 
1 1 1 -9  0  51 o 9.144834 6.376032 -2.358453      5.140847 -2.358453      5.140847 -2.358453      5.140847 9.144834 6.376032 9.144834 6.376032 0.000000       0.000000 
1 1 1 -9  1  1  f 623.7913 8.987579 4748.658       136.6212 4810.808       194.9264 4688.647       191.5412 627.3589 12.75025 619.3516 12.69079 8.007324       17.98958 
1 1 1 -9  1  2  o 506.3625 8.503960 3128.604       104.9346 3365.195       190.4873 3025.527       125.7323 524.1708 14.92793 497.7785 10.36512 26.39233       18.17358 
1 1 1 -9  1  3  o 315.3956 5.515241 1212.770       42.38930 1201.635       72.78419 1218.485       52.14549 313.6132 9.534792 316.0898 6.769712 -2.476593      11.69364 
1 1 1 -9  1  4  o 838.4524 13.84888 8597.634       282.9628 8262.025       476.5490 8780.394       351.6676 818.5804 23.91531 846.5073 17.04769 -27.92688      29.36947 
1 1 1 -9  1  5  o 374.4492 6.423244 1709.740       58.61158 1722.950       72.17443 1684.156       100.4409 375.8191 7.880766 371.1839 11.11668 4.635193       13.62671 
1 1 1 -9  1  6  o 422.4915 7.174959 2176.942       73.87092 2129.038       89.22775 2281.311       131.7035 417.7212 8.765512 431.9087 12.52646 -14.18747      15.28877 
1 1 1 -9  1  7  o 454.5953 6.648712 2519.928       73.65438 2415.384       101.2537 2637.414       107.3385 444.9002 9.339253 464.8888 9.474804 -19.98862      13.30389 
1 1 1 -9  1  8  o 528.7280 7.662564 3409.489       98.72850 3341.161       137.7681 3481.624       141.5553 523.1542 10.80644 534.0310 10.87736 -10.87683      15.33285 
1 1 1 -9  1  9  o 480.2681 7.000514 2812.584       81.93127 2822.488       116.3310 2802.836       115.4111 480.9273 9.926132 479.2534 9.882030 1.673920       14.00652 
1 1 1 -9  1  10 o 459.8834 6.722557 2578.681       75.33873 2555.505       105.9968 2602.343       107.1019 457.6563 9.504232 461.8305 9.516530 -4.174225      13.44971 
1 1 1 -9  1  11 o 342.9097 5.151134 1433.298       43.04460 1440.434       61.12263 1426.277       60.62889 343.6942 7.297831 342.0019 7.274698 1.692261       10.30435 
1 1 1 -9  1  12 o 253.0139 3.997174 780.1863       24.64527 810.2511       35.67240 752.7314       34.08885 257.8116 5.677979 248.4931 5.629397 9.318451       7.995596 
1 1 1 -9  1  13 o 531.4874 7.710338 3445.000       99.86250 3452.479       141.5022 3437.579       140.9532 531.8197 10.91850 530.6725 10.89964 1.147156       15.42776 
1 1 1 -9  1  14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -9  1  15 o 549.4137 7.971100 3681.943       106.7220 3479.115       145.2297 3920.050       157.3536 533.7877 11.16479 566.5792 11.39672 -32.79150      15.95425 
1 1 1 -9  1  16 o 638.0471 9.195312 4968.031       142.9734 4846.370       198.8018 5098.367       205.7680 629.7064 12.95526 645.8522 13.07400 -16.14581      18.40566 
1 1 1 -9  1  17 o 89.88931 2.564652 98.54460       5.612140 100.3888       7.948359 96.71108       7.925222 90.68610 3.603847 89.00404 3.661795 1.682053       5.137748 
1 1 1 -9  1  18 f 511.5973 7.460377 3193.054       93.00903 3055.476       127.7194 3348.395       135.7136 500.1501 10.47901 523.5558 10.63713 -23.40567      14.93178 
1 1 1 -9  1  19 o 220.5210 3.671037 592.7299       19.72762 574.3990       27.44738 612.3190       28.37382 217.0467 5.189335 224.0963 5.195734 -7.049683      7.343354 
1 1 1 -9  1  20 o 184.9695 4.739357 417.4354       21.34508 432.0595       30.84829 404.0022       29.56555 188.0568 6.742321 181.8445 6.683271 6.212250       9.493420 
1 1 1 -9  1  21 o 512.4938 7.493164 3207.020       93.58149 3102.254       129.5965 3321.167       135.2744 503.5288 10.56168 520.9725 10.65528 -17.44376      15.00280 
1 1 1 -9  1  22 o 155.1789 3.016424 293.5325       11.40673 301.6857       16.37062 285.8387       15.90267 157.2275 4.276651 153.0397 4.268290 4.187790       6.042189 
1 1 1 -9  1  23 o 202.8886 3.513479 501.9127       17.37125 510.2532       24.80371 493.8837       24.33628 204.4947 4.977355 201.1885 4.963808 3.306168       7.029469 
1 1 1 -9  1  24 o 201.8874 3.514018 497.0497       17.28818 495.4243       24.44446 498.6765       24.45390 201.4693 4.978923 202.1305 4.964552 -0.6612091     7.031106 
1 1 1 -9  1  25 o 88.69487 2.709033 96.00170       5.848433 92.11209       8.204387 100.0201       8.339127 86.80447 3.888407 90.46807 3.790991 -3.663597      5.430591 
1 1 1 -9  1  26 o 143.6286 2.981278 251.5800       10.43469 244.9613       14.61071 258.4704       14.90752 141.5989 4.239011 145.4570 4.210094 -3.858032      5.974455 
1 1 1 -9  1  27 o 125.3471 3.882617 191.9549       11.84543 184.1604       16.31055 200.6542       17.23128 122.6092 5.472748 127.9844 5.538006 -5.375175      7.785916 
1 1 1 -9  1  28 o 87.63963 2.845604 93.78050       6.069250 93.68941       8.558952 93.87263       8.607685 87.50591 4.024497 87.58988 4.043614 -0.8396912E-01 5.705032 
1 1 1 -9  1  29 o 393.0975 5.949162 1892.433       56.98915 1852.125       79.53760 1934.959       81.69536 387.9031 8.414205 396.4627 8.455884 -8.559540      11.92899 
1 1 1 -9  1  30 o 123.6327 2.929644 186.5010       8.826411 190.0927       12.61756 183.0592       12.35155 124.6601 4.159300 122.3307 4.149339 2.329399       5.875099 
1 1 1 -9  1  31 o 74.31687 3.544552 67.60253       6.400756 65.78136       7.617348 71.97752       11.80641 73.22861 4.287370 76.30894 6.408156 -3.080338      7.710123 
1 1 1 -9  1  32 o 104.0626 3.439919 132.4097       8.711275 132.6895       15.97480 132.2913       10.39244 103.7375 6.349639 103.9381 4.111158 -0.2005539     7.564360 
1 1 1 -9  1  33 o 90.29527 2.985947 99.65451       6.561234 94.65585       9.176188 104.8836       9.385318 87.84921 4.299415 92.50108 4.174328 -4.651871      5.992494 
1 1 1 -9  1  34 o 60.98281 3.470680 45.59845       5.136430 44.57254       7.283163 46.61364       7.245004 60.08353 5.020100 61.47530 4.876090 -1.391769      6.998404 
1 1 1 -9  1  35 o 157.3404 3.276145 302.5857       12.56144 304.4605       17.80998 300.7299       17.71948 157.5111 4.645055 156.5411 4.650163 0.9700317      6.572713 
1 1 1 -9  1  36 o 92.03000 3.083231 103.6441       6.904909 97.22088       9.583413 110.5785       9.957350 88.92101 4.436634 94.86880 4.318418 -5.947784      6.191320 
1 1 1 -9  1  37 f 47.96711 4.107143 28.42106       4.754708 30.78694       6.801699 26.16006       6.649239 49.63402 5.728418 45.61135 6.137874 4.022667       8.395729 
1 1 1 -9  1  38 o 97.63737 3.458669 116.9632       8.216268 120.5584       10.49766 111.2785       13.20032 98.92747 4.365262 94.65434 5.749912 4.273140       7.219210 
1 1 1 -9  1  39 o 24.08874 7.055286 7.423345       4.406342 15.27775       5.711476 -4.125216      6.925570 34.31651 7.065334 16.73293 7.639074 17.58358       10.40550 
1 1 1 -9  1  40 o 90.02761 3.122842 99.60434       6.840750 108.4257       9.892849 91.52169       9.469588 93.56446 4.350759 85.88239 4.540848 7.682068       6.288752 
1 1 1 -9  1  41 o 60.11919 3.935507 44.89695       5.733972 50.13805       9.016457 41.33796       7.429983 62.79684 5.963471 57.19516 5.394520 5.601677       8.041383 
1 1 1 -9  1  42 o 64.84672 4.148550 52.57293       6.521337 40.25586       11.97032 57.77157       7.776725 53.91452 9.455559 67.73083 4.741614 -13.81632      10.57783 
1 1 1 -9  1  43 o 26.86887 6.097988 9.676376       3.900986 12.64568       5.551706 6.780542       5.482597 30.23494 7.556508 22.99705 7.994220 7.237886       11.00038 
1 1 1 -9  1  44 o 50.28293 3.965022 32.04477       4.819212 33.62769       6.808300 30.45525       6.822515 50.56587 5.619987 47.87173 5.978242 2.694145       8.205098 
1 1 1 -9  1  45 f 26.89345 6.280075 10.13433       4.040756 9.691381       6.000842 10.50177       5.465575 25.49017 8.364983 26.60255 7.875300 -1.112373      11.48883 
1 1 1 -9  1  46 o 23.31382 7.459642 8.219986       4.789933 7.770895       9.026730 8.396002       5.651184 23.33488 9.678510 23.37426 8.116724 -0.3937531E-01 12.63150 
1 1 1 -9  1  47 o 14.01172 6.209803 0.1927256      4.208429 0.6997211      5.298547 -0.6736946     6.926582 15.65288 6.950801 16.42681 7.551487 -0.7739305     10.26346 
1 1 1 -9  1  48 o 11.00199 5.336574 -5.346758      4.460835 -7.613449      5.371402 -0.3087393     8.007953 11.44730 5.617550 16.94983 7.904757 -5.502538      9.697528 
1 1 1 -9  1  49 o 12.82802 5.785674 -0.2506223E-02 3.827913 3.136671       5.630084 -2.701144      5.220106 16.68520 7.295736 12.93069 6.137560 3.754509       9.534013 
1 1 1 -9  1  50 o 15.61385 6.712096 3.186792       4.602934 4.467183       5.727664 0.8520525      7.734380 16.98241 7.393321 15.86653 7.513380 1.115883       10.54097 
1 1 1 -9  1  51 o 8.968883 4.435329 -5.713877      3.571799 -6.950009      5.058696 -4.484960      5.043910 10.57099 5.236692 11.38567 5.556712 -0.8146782     7.635443 
1 1 1 -9  2  1  o 259.9521 4.079316 823.6266       25.84144 798.9848       50.16837 832.5258       30.14867 255.7897 8.058477 261.3383 4.734009 -5.548569      9.346117 
1 1 1 -9  2  2  o 138.8528 3.055145 234.9598       10.33767 267.9095       18.63400 220.3098       12.42507 148.1547 5.169163 134.3941 3.797678 13.76057       6.414250 
1 1 1 -9  2  3  o 102.2671 2.678386 127.5367       6.669160 131.7027       11.38852 125.3625       8.227462 103.8486 4.510948 101.3677 3.335200 2.480888       5.610010 
1 1 1 -9  2  4  o 672.8337 9.664756 5525.718       158.4655 5483.662       223.0800 5568.555       225.1423 669.6774 13.66969 674.8375 13.69058 -5.160095      19.34664 
1 1 1 -9  2  5  o 116.6105 2.453361 165.7027       6.971644 161.5712       9.845934 169.8570       9.872908 115.0872 3.514818 118.0069 3.436881 -2.919670      4.915902 
1 1 1 -9  2  6  o 46.21214 2.635950 26.10850       2.956136 27.42831       3.684696 23.72469       4.952019 47.33242 3.213585 43.86628 4.705982 3.466141       5.698543 
1 1 1 -9  2  7  o 370.1275 6.352017 1670.344       57.29268 1664.157       99.01528 1673.458       70.24657 369.0241 11.02297 370.4090 7.782293 -1.384827      13.49333 
1 1 1 -9  2  8  o 377.4477 5.605179 1736.759       51.55638 1734.103       72.95670 1739.407       72.86684 377.0630 7.939901 377.6404 7.917999 -0.5773315     11.21324 
1 1 1 -9  2  9  o 312.1937 4.741366 1187.969       36.07146 1196.784       51.32376 1179.366       50.70732 313.2948 6.722476 311.0076 6.690577 2.287201       9.484488 
1 1 1 -9  2  10 o 1054.503 15.02503 13594.57       386.0995 13601.35       546.4263 13587.80       545.6287 1052.981 21.29488 1052.463 21.27426 0.5178223      30.10093 
1 1 1 -9  2  11 o 554.6648 8.029137 3752.170       108.5264 3631.448       150.1117 3884.369       157.0848 545.4140 11.29412 564.0750 11.42776 -18.66101      16.06707 
1 1 1 -9  2  12 o 191.9770 3.269749 449.1320       15.29677 436.5885       21.39059 462.2603       21.88362 189.2619 4.637924 194.7471 4.611179 -5.485260      6.540131 
1 1 1 -9  2  13 o 328.9192 4.981796 1318.716       39.93110 1288.055       55.67701 1351.190       57.30016 325.0110 7.029778 332.8799 7.063698 -7.868835      9.965622 
1 1 1 -9  2  14 o 322.5135 6.910609 1268.351       54.31257 1258.891       76.44197 1277.995       77.18253 321.0352 9.782506 323.4625 9.803034 -2.427307      13.84908 
1 1 1 -9  2  15 o 265.7481 4.811491 860.8354       31.15917 871.7874       54.16786 855.4193       38.09240 267.1973 8.329219 264.8841 5.901283 2.313232       10.20789 
1 1 1 -9  2  16 o 436.4363 6.430012 2322.631       68.38625 2317.289       96.62242 2327.993       96.80338 435.7672 9.098867 436.7727 9.094920 -1.005585      12.86495 
1 1 1 -9  2  17 o 213.6398 3.573349 556.2668       18.60346 567.0399       26.65760 546.0390       25.97424 215.6702 5.072181 211.6396 5.036279 4.030670       7.147806 
1 1 1 -9  2  18 o 381.3197 5.699414 1772.990       52.96092 1796.934       75.62893 1749.950       74.18797 383.7419 8.087469 378.6952 8.039104 5.046722       11.40326 
1 1 1 -9  2  19 o 54.16745 3.580620 35.91869       4.699913 28.51925       8.707841 38.96029       5.582932 47.73407 7.751615 56.38640 4.090868 -8.652328      8.764857 
1 1 1 -9  2  20 f 360.7463 7.732646 1588.624       67.97766 1676.279       99.80412 1512.771       92.84277 370.0379 11.08041 351.5455 10.85052 18.49234       15.50836 
1 1 1 -9  2  21 o 190.0081 3.346729 440.0861       15.49633 444.7462       22.09367 435.5738       21.74083 190.9698 4.747521 188.9913 4.720613 1.978592       6.695009 
1 1 1 -9  2  22 o 333.3391 5.094711 1355.550       41.38491 1390.824       59.55474 1322.610       57.55087 337.4357 7.242512 329.0641 7.176875 8.371613       10.19615 
1 1 1 -9  2  23 o 150.9685 2.995850 277.8471       11.02154 274.6241       15.57278 281.0818       15.60089 149.9896 4.264913 151.7470 4.222947 -1.757385      6.001896 
1 1 1 -9  2  24 o 78.90790 2.766684 76.00052       5.311823 85.20641       7.607474 67.24245       7.420134 83.49879 3.748287 74.12889 4.123853 9.369896       5.572774 
1 1 1 -9  2  25 o 235.5215 3.907751 676.7691       22.42815 688.9216       32.12431 665.2123       31.32711 237.4672 5.551291 233.3499 5.509049 4.117310       7.820899 
1 1 1 -9  2  26 o 97.26322 2.748173 115.4469       6.507185 124.7499       9.508791 107.2529       8.924109 101.0346 3.869211 93.66667 3.918356 7.367950       5.506751 
1 1 1 -9  2  27 o 164.1218 4.355583 329.1497       17.40462 335.0909       24.65951 323.2523       24.56844 165.3649 6.129956 162.3998 6.219556 2.965103       8.732654 
1 1 1 -9  2  28 f 262.6836 4.914217 843.3752       31.45744 831.7971       38.40191 866.9919       54.84590 260.6669 6.045482 265.3884 8.491520 -4.721558      10.42371 
1 1 1 -9  2  29 o 136.1542 2.993719 226.1702       9.932952 230.7095       14.19279 221.8123       13.90622 137.3582 4.245206 134.6814 4.242360 2.676865       6.001616 
1 1 1 -9  2  30 o 133.1961 2.995014 216.4860       9.721351 217.8545       13.80320 215.1391       13.69359 133.4499 4.249908 132.6156 4.242733 0.8342438      6.005206 
1 1 1 -9  2  31 o 161.5440 3.743677 318.7955       14.73755 314.1082       17.77756 329.0950       26.35222 160.1880 4.558774 163.5517 6.625611 -3.363770      8.042459 
1 1 1 -9  2  32 o 28.82655 6.410740 10.60808       4.386942 8.446840       8.151435 11.48928       5.205016 27.69954 9.739310 29.95538 7.216406 -2.255836      12.12150 
1 1 1 -9  2  33 o 82.80548 3.009482 83.83054       6.062670 77.66972       8.388574 90.56757       8.772100 79.55006 4.343727 85.93845 4.201441 -6.388382      6.043183 
1 1 1 -9  2  34 o 209.0138 3.738653 534.2225       19.04260 533.1693       26.94521 535.2734       26.91541 208.3600 5.311109 208.7762 5.294618 -0.4161072     7.499391 
1 1 1 -9  2  35 o 117.6299 3.048578 169.1682       8.731424 168.8005       12.29328 169.5427       12.40366 117.3038 4.307822 117.5563 4.337234 -0.2525101     6.113013 
1 1 1 -9  2  36 o 95.93824 3.062494 112.6195       7.150662 114.4041       10.07813 110.8103       10.14736 96.50163 4.296345 94.95231 4.397362 1.549324       6.147794 
1 1 1 -9  2  37 o 128.0763 3.518214 200.9938       10.97023 191.1439       17.69244 207.1461       13.98263 124.2783 5.858419 129.8125 4.426619 -5.534157      7.342753 
1 1 1 -9  2  38 o 63.82134 3.735529 50.13049       5.784306 50.35802       7.231786 49.72641       9.637187 63.78505 4.685235 62.96931 6.367785 0.8157387      7.905701 
1 1 1 -9  2  39 o 20.38705 6.579383 5.075456       3.720602 0.6316148      4.957977 10.80388       5.629150 16.86159 7.095833 28.77204 7.823874 -11.91044      10.56238 
1 1 1 -9  2  40 o 68.15609 3.306587 57.20743       5.475488 54.25920       7.660803 60.28650       7.828953 65.98433 4.797044 69.61819 4.641221 -3.633858      6.674770 
1 1 1 -9  2  41 o 60.32355 4.141246 45.30217       6.050777 45.34047       7.110972 45.20170       11.51835 60.09676 4.898026 58.45055 8.321361 1.646210       9.655863 
1 1 1 -9  2  42 o 90.81755 4.478914 103.3617       9.881816 0.000000       0.000000 103.3617       9.881816 ?        ?        90.81755 4.478914 0.000000       4.478914 
1 1 1 -9  2  43 o 15.55130 6.235205 1.808680       3.595474 -4.206622      5.128036 7.625161       5.042577 13.46686 6.295289 23.84169 7.656390 -10.37483      9.912163 
1 1 1 -9  2  44 o 79.16034 3.308290 78.33328       6.367793 74.43356       9.078136 82.11050       8.934422 76.00260 4.928105 80.12057 4.595278 -4.117966      6.738160 
1 1 1 -9  2  45 o 17.74217 7.047579 3.192897       4.550809 -0.6380548     9.591537 4.305830       5.169749 19.86895 9.039492 19.38922 7.569329 0.4797363      11.79013 
1 1 1 -9  2  46 o 18.29698 6.722093 4.414104       3.932225 7.371231       5.697641 1.724556       5.433752 22.22921 8.103559 16.92123 7.283648 5.307978       10.89583 
1 1 1 -9  2  47 o 17.04959 6.910650 3.338717       4.469469 4.689824       5.490803 0.6855618      7.694355 18.93600 7.665316 17.71830 8.074695 1.217703       11.13363 
1 1 1 -9  2  48 o 22.27186 6.763512 7.920511       3.993021 3.197844       5.353201 13.84373       5.995134 17.12277 7.296569 27.95392 8.240927 -10.83116      11.00694 
1 1 1 -9  2  49 o 12.80359 5.970936 -1.441676      4.568562 -4.176536      5.690462 3.517779       7.662968 12.80433 6.165549 17.79707 8.090182 -4.992740      10.17178 
1 1 1 -9  2  50 o 23.27724 7.546474 10.48257       4.891340 12.75825       6.147267 6.555334       8.075521 24.16866 8.460771 18.48575 8.364151 5.682915       11.89721 
1 1 1 -9  2  51 o 12.17285 5.554845 0.1629093      3.656848 -2.606678      5.431165 2.459738       4.945951 12.49540 6.018478 14.79558 6.632739 -2.300179      8.956300 
1 1 1 -9  3  1  f 379.4128 6.502721 1755.358       60.12335 1763.272       104.0348 1751.389       73.67185 379.8092 11.25269 378.9096 7.978658 0.8995361      13.79428 
1 1 1 -9  3  2  o 427.2953 6.285719 2226.276       65.45144 2217.989       92.41577 2234.616       92.70954 426.3434 8.895091 427.9389 8.890099 -1.595459      12.57603 
1 1 1 -9  3  3  o 571.8297 8.268085 3989.202       115.2147 3953.194       162.1692 4025.900       163.7181 568.8848 11.69790 574.0918 11.70252 -5.206970      16.54659 
1 1 1 -9  3  4  o 538.2115 7.805841 3533.394       102.3785 3352.838       139.9700 3741.123       150.1338 523.9987 10.96147 553.4905 11.13095 -29.49182      15.62216 
1 1 1 -9  3  5  o 313.8434 4.766339 1200.623       36.45306 1198.203       51.59104 1203.036       51.51389 313.4634 6.753849 314.0958 6.730170 -0.6323853     9.534657 
1 1 1 -9  3  6  o 402.4482 6.869758 1975.044       67.37325 1938.248       81.54285 2054.198       119.5980 398.6023 8.394794 409.9216 11.98542 -11.31931      14.63294 
1 1 1 -9  3  7  o 338.4701 5.883359 1396.668       48.52681 1427.535       60.29300 1339.900       81.76675 342.1401 7.231472 331.1803 10.14352 10.95987       12.45733 
1 1 1 -9  3  8  o 377.3497 5.606976 1735.834       51.55951 1726.431       72.77931 1745.308       73.05378 376.2332 7.938066 378.2852 7.924781 -2.051941      11.21673 
1 1 1 -9  3  9  o 550.0215 7.960494 3689.641       106.6979 3770.014       153.2420 3614.012       148.6499 555.7068 11.31608 544.0976 11.21119 11.60919       15.92936 
1 1 1 -9  3  10 o 142.7150 2.732802 248.1951       9.504163 241.9297       13.40258 254.5327       13.47958 140.8398 3.908833 144.4671 3.832262 -3.627304      5.474048 
1 1 1 -9  3  11 o 417.8244 6.161451 2128.328       62.73543 2142.577       89.16622 2114.361       88.28297 419.1017 8.730616 416.3345 8.701587 2.767181       12.32645 
1 1 1 -9  3  12 o 471.3193 6.889218 2708.620       79.12638 2590.589       108.7514 2841.390       115.3425 460.7747 9.685234 482.5551 9.808581 -21.78040      13.78448 
1 1 1 -9  3  13 f 60.63089 2.909428 44.90038       4.286160 45.39498       5.317291 43.98279       7.242496 60.92586 3.597411 59.86028 5.010870 1.065578       6.168483 
1 1 1 -9  3  14 o 358.7125 6.203269 1568.826       54.22546 1520.738       92.00151 1594.424       67.12375 352.7885 10.71391 361.5689 7.618142 -8.780426      13.14625 
1 1 1 -9  3  15 o 148.8643 3.285229 270.0658       11.91770 281.1156       20.83731 264.6941       14.52855 151.7463 5.644752 147.3135 4.050943 4.432846       6.947903 
1 1 1 -9  3  16 o 665.3113 9.577656 5402.639       155.2817 5623.770       225.7966 5204.214       213.8899 678.1852 13.66259 652.4321 13.45299 25.75311       19.17418 
1 1 1 -9  3  17 o 555.2815 8.063523 3762.001       109.1124 3581.754       149.2532 3968.917       159.9143 541.4624 11.31148 569.9485 11.51372 -28.48608      16.14049 
1 1 1 -9  3  18 o 526.3458 7.665829 3380.218       98.32554 3291.552       136.7425 3475.141       141.4854 519.0447 10.81092 533.3130 10.88663 -14.26837      15.34258 
1 1 1 -9  3  19 o 102.7497 3.117555 128.7896       7.797013 136.8380       14.46854 125.4957       9.256007 105.7794 5.633217 101.3986 3.752367 4.380745       6.768559 
1 1 1 -9  3  20 f 444.9727 7.588884 2417.033       82.29006 2362.540       99.33733 2536.213       146.9067 439.7265 9.270299 454.7502 13.27081 -15.02365      16.18805 
1 1 1 -9  3  21 o 102.2513 2.668650 127.5154       6.643934 134.0776       9.607537 121.5011       9.197738 104.8026 3.768002 99.75854 3.790405 5.044098       5.344625 
1 1 1 -9  3  22 o 384.7588 5.770145 1806.734       54.10176 1840.457       77.53999 1774.743       75.52278 388.0093 8.200634 381.0296 8.133607 6.979767       11.55015 
1 1 1 -9  3  23 o 215.4977 3.660026 566.2920       19.22042 544.5095       26.66180 589.8607       27.73342 211.2274 5.179682 219.8481 5.176600 -8.620682      7.322998 
1 1 1 -9  3  24 o 292.4957 4.593840 1044.038       32.74397 1035.670       46.16836 1052.508       46.44683 291.0947 6.508398 293.4534 6.495026 -2.358734      9.194814 
1 1 1 -9  3  25 f 136.2593 2.920355 226.3947       9.697010 232.7781       13.83467 220.2299       13.59574 138.0544 4.116876 134.2751 4.160021 3.779358       5.852730 
1 1 1 -9  3  26 o 13.29228 5.542389 0.4087139      2.982578 2.562671       4.151260 -1.889556      4.288071 17.76995 6.824555 13.85766 6.196756 3.912295       9.218153 
1 1 1 -9  3  27 o 31.63787 5.749056 12.62027       4.269196 9.947865       5.603351 16.31819       6.591376 28.08411 7.872507 35.78719 7.780461 -7.703077      11.06851 
1 1 1 -9  3  28 o 215.1587 3.714042 565.0722       19.47340 594.2794       28.35707 539.0062       26.78889 220.4475 5.278616 209.9517 5.235994 10.49580       7.435013 
1 1 1 -9  3  29 f 228.6920 3.880981 638.6667       21.62860 634.1217       30.54273 643.2384       30.63240 227.6207 5.506302 229.2554 5.483092 -1.634705      7.770692 
1 1 1 -9  3  30 o 129.2700 2.967386 203.9090       9.347763 216.7373       13.61530 192.4702       12.85676 133.1108 4.202641 125.4288 4.212256 7.681999       5.950234 
1 1 1 -9  3  31 o 31.83378 5.689197 12.79197       4.251428 12.86492       5.019017 12.60667       7.999059 31.77443 6.693605 31.74391 9.558538 0.3051758E-01  11.66919 
1 1 1 -9  3  32 o 89.95523 3.494967 98.99480       7.646779 99.86346       14.36698 98.65147       9.032453 89.88829 6.604948 89.72575 4.142150 0.1625366      7.796329 
1 1 1 -9  3  33 o 161.9283 3.274710 320.2861       12.92206 342.3872       18.88185 300.8161       17.72233 167.1484 4.640090 156.6634 4.647266 10.48506       6.567155 
1 1 1 -9  3  34 o 162.2075 3.309409 321.5079       13.08150 327.9349       18.62665 315.2527       18.37596 163.5216 4.679185 160.3193 4.708677 3.202286       6.638253 
1 1 1 -9  3  35 o 31.06491 5.591966 12.22153       4.077567 6.205268       5.342196 20.61855       6.311306 23.21227 7.897814 40.36228 6.647880 -17.15001      10.32326 
1 1 1 -9  3  36 o 127.1250 3.114444 197.5679       9.648229 197.2864       13.63501 197.8501       13.65432 126.7449 4.421345 126.9261 4.421267 -0.1811981     6.252671 
1 1 1 -9  3  37 o 88.62312 3.521561 96.32417       7.590192 81.61633       11.45921 107.8209       10.13133 81.08842 5.838167 93.59300 4.454875 -12.50458      7.343711 
1 1 1 -9  3  38 o 116.0156 3.500125 165.1305       9.884148 165.5973       12.33617 164.2934       16.51895 115.9572 4.373464 114.9936 5.914719 0.9635620      7.356024 
1 1 1 -9  3  39 o 44.34958 4.287262 24.45244       4.575758 15.80277       6.221226 34.64618       6.753719 34.78303 7.556209 52.61089 5.341800 -17.82786      9.253709 
1 1 1 -9  3  40 o 107.7503 3.100836 142.6499       8.133575 136.7788       11.35247 148.8423       11.65887 105.0471 4.444805 109.6187 4.373293 -4.571510      6.235542 
1 1 1 -9  3  41 o 86.71413 3.739284 93.09617       7.883018 91.01910       9.317742 98.32638       14.78581 85.44058 4.490948 87.42735 6.998435 -1.986763      8.315450 
1 1 1 -9  3  42 o 52.72705 4.583761 35.06236       5.831210 26.83512       11.26254 38.07555       6.815900 42.94976 10.77902 54.71452 5.173359 -11.76476      11.95621 
1 1 1 -9  3  43 o 92.41159 3.544270 106.4774       7.966792 108.5679       13.24423 105.2922       9.972816 91.43129 5.977000 91.26502 4.497978 0.1662674      7.480397 
1 1 1 -9  3  44 o 18.80480 7.171001 3.903236       4.561964 7.572252       9.369237 2.763075       5.222908 25.07750 10.06163 18.30600 7.451769 6.771492       12.52059 
1 1 1 -9  3  45 o 16.07122 6.390496 2.438606       3.745526 2.470311       5.400565 2.409221       5.199123 17.88439 7.457615 17.62882 7.331399 0.2555637      10.45779 
1 1 1 -9  3  46 o 11.91003 5.594854 -3.103676      4.135228 -3.564877      6.886085 -2.843547      5.171555 15.41746 7.235318 13.64064 6.358454 1.776820       9.632225 
1 1 1 -9  3  47 o 27.32552 6.885326 11.51686       4.582273 12.84088       5.715256 9.133979       7.667225 27.81768 8.002554 23.07724 9.153886 4.740438       12.15872 
1 1 1 -9  3  48 o 13.44589 5.905820 0.6033861      3.726472 4.949842       5.133863 -4.236847      5.417635 18.49820 7.438927 12.77079 6.114309 5.727407       9.629248 
1 1 1 -9  3  49 o 20.19307 6.801936 6.876619       3.961992 5.769481       5.737752 7.885604       5.477509 18.67268 7.728003 20.65354 7.862088 -1.980865      11.02427 
1 1 1 -9  3  50 o 13.98168 6.372205 0.8170955      4.792732 -3.264786      5.795762 9.645423       8.523532 12.86510 6.201740 20.01527 8.855617 -7.150171      10.81127 
1 1 1 -9  3  51 o 13.21105 6.056809 0.6297010      4.415024 -8.816700      8.017770 4.740538       5.289145 12.71106 6.345011 16.50506 7.145562 -3.793993      9.556057 
1 1 1 -9  4  1  o 379.2650 5.056386 1753.415       46.73250 1753.594       73.87746 1753.296       60.33853 379.1577 7.995690 379.1958 6.529729 -0.3802490E-01 10.32320 
1 1 1 -9  4  2  o 286.8456 4.428673 1002.887       30.95693 1010.162       44.05075 995.7881       43.51363 287.8341 6.280221 285.7800 6.248236 2.054138       8.858986 
1 1 1 -9  4  3  f 599.9466 8.660312 4391.378       126.6141 4165.970       172.8103 4652.618       186.0395 583.9767 12.14334 617.1135 12.37098 -33.13672      17.33499 
1 1 1 -9  4  4  o 385.6349 5.725595 1813.029       53.80630 1745.421       74.37618 1887.263       77.93575 378.2709 8.068537 393.3375 8.130838 -15.06653      11.45477 
1 1 1 -9  4  5  o 460.2793 6.736868 2583.340       75.56410 2495.043       104.5251 2680.006       109.3668 452.1747 9.485891 468.6287 9.576805 -16.45392      13.47952 
1 1 1 -9  4  6  o 514.7234 7.479643 3231.104       93.81902 3248.038       133.3508 3214.508       132.0194 515.8320 10.60844 513.1671 10.55706 2.664856       14.96631 
1 1 1 -9  4  7  o 308.7819 5.445131 1162.284       40.97285 1146.077       49.82471 1196.134       72.00897 306.5858 6.668938 312.9571 9.452872 -6.371338      11.56856 
1 1 1 -9  4  8  o 88.66997 2.338057 95.87324       5.047643 94.70776       7.316181 96.93196       6.973063 88.08969 3.414653 89.12790 3.215779 -1.038208      4.690532 
1 1 1 -9  4  9  o 153.4895 2.842101 287.0887       10.63052 282.0419       15.07707 292.0780       14.99095 152.0703 4.072184 154.7575 3.978336 -2.687195      5.692964 
1 1 1 -9  4  10 o 642.3283 9.246012 5033.500       144.7263 5001.755       203.7928 5065.801       205.5667 639.8958 13.06903 643.9758 13.09927 -4.080017      18.50380 
1 1 1 -9  4  11 o 705.1650 10.11874 6068.060       173.8815 6150.578       248.3489 5988.712       243.5329 709.3948 14.36607 700.0114 14.27633 9.383484       20.25333 
1 1 1 -9  4  12 o 515.4473 8.661745 3240.962       108.7992 3325.645       135.6344 3088.142       182.2061 521.9833 10.66294 502.3645 14.90006 19.61884       18.32240 
1 1 1 -9  4  13 o 83.20924 2.837096 84.47133       5.744418 84.90850       7.118564 83.65517       9.726378 83.39608 3.510614 82.70242 4.847358 0.6936646      5.985089 
1 1 1 -9  4  14 o 367.8805 6.345362 1650.115       56.88520 1631.466       97.86185 1659.631       69.90903 365.3828 11.00333 368.8771 7.777061 -3.494263      13.47427 
1 1 1 -9  4  15 o 608.5290 8.792828 4518.259       130.3905 4703.470       189.6488 4352.221       179.5642 620.4310 12.54355 596.8414 12.34596 23.58960       17.60009 
1 1 1 -9  4  16 o 542.2111 7.876634 3586.454       104.0747 3558.853       146.5999 3614.500       147.7749 539.7956 11.14469 543.9992 11.14721 -4.203613      15.76276 
1 1 1 -9  4  17 o 504.3140 7.360311 3102.510       90.45514 3149.872       129.3676 3057.206       126.5256 507.8487 10.45334 500.3312 10.37731 7.517487       14.72959 
1 1 1 -9  4  18 o 173.9844 3.159635 368.9197       13.39625 361.9682       18.88474 375.9609       19.00616 172.2572 4.502669 175.5599 4.446136 -3.302689      6.327887 
1 1 1 -9  4  19 o 210.8947 4.154473 542.1869       21.35097 593.5349       39.58373 521.1180       25.35571 220.4165 7.379880 206.7329 5.033037 13.68364       8.932755 
1 1 1 -9  4  20 o 60.65444 3.294231 44.97480       4.850870 39.55571       5.948936 55.72758       8.379858 56.79456 4.330960 67.40336 5.140525 -10.60880      6.721772 
1 1 1 -9  4  21 o 427.8687 6.344163 2234.390       66.14866 2228.257       93.48631 2240.540       93.61048 426.9197 8.985985 428.0968 8.973181 -1.177063      12.69905 
1 1 1 -9  4  22 o 144.8770 2.943732 255.8576       10.39283 240.5485       14.37381 272.6286       15.04448 140.3805 4.206484 149.4605 4.134585 -9.080032      5.898245 
1 1 1 -9  4  23 o 166.8333 3.148584 339.3442       12.80071 342.3019       18.28902 336.5038       17.92242 167.4455 4.486135 166.0241 4.433823 1.421417       6.307471 
1 1 1 -9  4  24 o 287.7693 4.538172 1010.594       31.82449 998.5722       44.80053 1022.840       45.21560 285.8264 6.431980 289.2813 6.414041 -3.454895      9.083517 
1 1 1 -9  4  25 o 70.57085 2.839111 60.82428       4.872552 65.11919       6.958104 56.69156       6.825469 72.94906 3.928622 68.03308 4.136504 4.915977       5.704799 
1 1 1 -9  4  26 o 48.42223 3.613835 28.76716       4.233562 27.43304       6.535423 29.73177       5.557158 47.00959 5.829792 49.11758 4.700062 -2.107983      7.488461 
1 1 1 -9  4  27 o 58.25104 3.489869 41.55180       4.931205 40.72814       5.983289 43.29603       8.706950 57.59362 4.294042 59.16638 6.127447 -1.572754      7.482273 
1 1 1 -9  4  28 o 113.8001 2.822140 157.9610       7.826317 161.2290       11.15667 154.7948       10.98157 114.8417 3.992639 112.5223 4.011299 2.319397       5.659654 
1 1 1 -9  4  29 o 101.5346 2.817993 125.8598       6.965780 119.5894       9.691345 132.5615       10.01903 98.86754 4.030936 104.1076 3.956380 -5.240059      5.648131 
1 1 1 -9  4  30 o 71.04905 2.966037 61.70480       5.124065 60.37328       7.237633 63.04288       7.255445 70.15677 4.253398 71.70563 4.170160 -1.548859      5.956646 
1 1 1 -9  4  31 o 80.33554 3.426737 78.95345       6.693077 80.05972       8.161359 76.68126       11.69649 80.82130 4.157792 78.81620 6.138177 2.005096       7.413801 
1 1 1 -9  4  32 o 30.41853 6.528720 11.80518       4.694709 19.56616       9.471998 9.277727       5.405366 38.93204 9.948214 27.10642 7.777780 11.82563       12.62778 
1 1 1 -9  4  33 o 130.3683 3.637746 207.8939       11.54558 217.2593       21.54029 204.1187       13.67606 132.6702 6.684105 129.0695 4.354353 3.600723       7.977321 
1 1 1 -9  4  34 o 25.98121 5.962747 8.630491       3.695096 14.97987       5.086809 1.537261       5.376527 34.35708 6.308042 18.43077 7.538575 15.92632       9.829624 
1 1 1 -9  4  35 o 140.7034 3.163544 241.9533       10.84712 244.8030       15.30993 239.0809       15.37054 141.2511 4.453367 139.5731 4.525074 1.677979       6.348919 
1 1 1 -9  4  36 o 22.40273 6.657979 6.295662       3.900360 5.980684       5.368282 6.647847       5.676498 22.93501 7.913616 23.93781 8.141233 -1.002794      11.35363 
1 1 1 -9  4  37 o 90.72530 3.466881 100.9338       7.650742 97.33463       12.12737 103.3133       9.860573 88.62419 5.644708 91.60696 4.430238 -2.982773      7.175635 
1 1 1 -9  4  38 o 27.43303 6.781214 9.744119       4.507188 8.801227       5.461586 11.75739       7.980662 26.29739 7.893705 30.44344 9.615826 -4.146051      12.44085 
1 1 1 -9  4  39 o 80.94562 3.157509 80.45521       6.216417 75.26492       8.651442 85.99533       8.938256 77.95452 4.574291 83.38864 4.414278 -5.434120      6.356885 
1 1 1 -9  4  40 o 21.43093 6.617139 5.812778       3.801879 0.3545986      5.266401 11.75329       5.494167 17.00620 7.241711 29.81212 7.554539 -12.80592      10.46487 
1 1 1 -9  4  41 o 101.7063 3.690322 128.0016       9.131194 127.1660       10.96917 129.8877       16.47894 101.0142 4.467151 100.6675 6.756568 0.3467026      8.099793 
1 1 1 -9  4  42 o 33.83115 6.322287 15.10981       5.020669 16.16096       9.457390 14.69732       5.924432 33.59616 10.44711 32.88691 7.551993 0.7092438      12.89088 
1 1 1 -9  4  43 o 50.08715 4.901934 32.14169       5.906632 30.46536       11.60469 32.72782       6.861998 44.86723 10.75391 50.11344 5.721410 -5.246204      12.18118 
1 1 1 -9  4  44 o 48.82706 4.387025 30.55873       5.164367 25.00807       8.418048 33.90859       6.539621 41.35258 8.632820 50.85650 5.357170 -9.503918      10.15996 
1 1 1 -9  4  45 o 20.14838 6.710264 5.582611       3.857165 2.993966       5.435204 8.209034       5.474720 18.32399 7.546447 23.69164 7.995726 -5.367649      10.99457 
1 1 1 -9  4  46 o 10.14615 4.948452 -6.118762      3.981032 -4.673800      6.117585 -7.180146      5.243097 13.98697 6.640465 11.77150 5.727207 2.215473       8.769075 
1 1 1 -9  4  47 f 20.83611 6.963552 6.681860       4.153218 6.782296       5.104151 6.485061       7.144791 20.86265 7.659584 20.91573 8.636867 -0.5307770E-01 11.54403 
1 1 1 -9  4  48 o 27.91796 6.153050 11.85440       4.073109 8.620766       5.546043 15.64076       6.001354 22.17274 8.007556 29.99324 8.045335 -7.820501      11.35114 
1 1 1 -9  4  49 o 17.04486 6.589122 4.445030       3.887875 2.425231       5.363019 6.682281       5.644332 15.92662 7.036572 19.39558 7.799930 -3.468956      10.50487 
1 1 1 -9  4  50 o 12.86384 5.808347 0.4830242      3.870558 -2.927425      5.484812 3.866211       5.462846 12.67942 6.091956 16.38956 7.176021 -3.710136      9.413140 
1 1 1 -9  4  51 o 14.38672 6.742876 0.8806021      5.947723 -4.785205      8.156166 7.315450       8.692092 13.72237 6.770458 17.91159 8.313279 -4.189215      10.72146 
1 1 1 -9  5  1  o 322.7482 4.929626 1269.717       38.77161 1186.238       75.08095 1300.073       45.27548 311.6132 9.899863 326.5619 5.689334 -14.94870      11.41822 
1 1 1 -9  5  2  o 750.6364 9.626628 6875.909       176.0921 6648.771       271.8189 7040.173       231.1570 737.3058 15.12850 759.1524 12.49516 -21.84656      19.62143 
1 1 1 -9  5  3  o 422.3915 5.574601 2174.998       57.38060 2115.295       89.15274 2217.220       74.97359 416.3958 8.786022 426.3979 7.215346 -10.00217      11.36905 
1 1 1 -9  5  4  o 119.2684 2.873383 173.3467       8.351319 182.7336       14.66888 168.8450       10.15834 122.3399 4.930412 117.6520 3.547183 4.687912       6.073835 
1 1 1 -9  5  5  f 459.3706 6.726604 2573.035       75.30003 2535.844       105.6417 2611.446       107.3597 455.8745 9.509418 462.6193 9.523173 -6.744720      13.45808 
1 1 1 -9  5  6  o 710.7830 10.19701 6165.729       176.6225 6131.609       249.0070 6200.275       250.5643 708.2390 14.42765 712.1921 14.43730 -3.953125      20.41060 
1 1 1 -9  5  7  o 480.0937 8.104784 2811.214       94.82077 2802.148       115.9952 2829.474       164.6214 479.1983 9.933185 480.9623 14.06066 -1.764008      17.21541 
1 1 1 -9  5  8  o 98.11137 2.401376 117.2957       5.741371 115.9498       8.325145 118.5164       7.928425 97.47895 3.510384 98.56137 3.305666 -1.082420      4.821849 
1 1 1 -9  5  9  o 293.2866 4.518607 1048.388       32.29482 1053.175       45.96782 1043.721       45.38139 293.9103 6.418047 292.5897 6.364769 1.320648       9.038895 
1 1 1 -9  5  10 o 495.0075 8.339053 2988.671       100.5923 3070.553       125.5557 2841.907       168.0941 501.6088 10.27153 482.0045 14.32674 19.60434       17.62839 
1 1 1 -9  5  11 o 715.4223 11.86320 6249.652       206.8238 6186.085       251.6655 6381.909       363.0101 711.3984 14.51692 721.1006 20.67929 -9.702209      25.26606 
1 1 1 -9  5  12 o 691.4032 11.47803 5836.644       193.3904 5934.471       239.6556 5654.026       327.4375 696.8065 14.11365 678.8361 19.81493 17.97040       24.32748 
1 1 1 -9  5  13 o 731.3420 10.49269 6528.751       187.0008 6417.720       261.4976 6644.959       267.5234 724.4490 14.81234 737.1487 14.89260 -12.69971      21.00464 
1 1 1 -9  5  14 o 642.3543 10.68496 5037.488       167.2567 5237.521       297.5127 4945.054       202.2421 653.3904 18.70440 636.1253 13.04646 17.26514       22.80493 
1 1 1 -9  5  15 o 149.0710 2.901519 270.8071       10.54034 260.8839       14.86515 280.8409       14.94778 146.2426 4.175457 151.7425 4.045955 -5.499908      5.814137 
1 1 1 -9  5  16 o 230.1027 3.774691 645.3186       21.16602 609.3409       29.17022 685.3235       30.75954 223.5640 5.354288 237.0942 5.323813 -13.53020      7.550589 
1 1 1 -9  5  17 o 460.8016 6.774195 2589.886       76.06901 2588.566       107.7066 2591.200       107.4495 460.4457 9.599043 460.6826 9.571198 -0.2369080     13.55542 
1 1 1 -9  5  18 o 531.0627 7.735738 3441.577       100.1114 3521.498       143.9822 3366.778       139.2921 536.7761 11.00727 524.8689 10.89029 11.90723       15.48413 
1 1 1 -9  5  19 o 196.4034 4.882927 470.3418       23.37036 468.5374       33.90166 471.9757       32.26073 195.8193 7.116265 196.5656 6.744885 -0.7462311     9.804831 
1 1 1 -9  5  20 o 245.7418 3.991331 736.2325       23.90193 739.6717       34.01487 732.8781       33.59391 246.2429 5.668512 245.1117 5.624197 1.131226       7.985212 
1 1 1 -9  5  21 o 504.5207 7.389637 3108.994       90.85278 3112.864       128.7315 3105.155       128.2404 504.2166 10.47687 503.5982 10.44972 0.6183167      14.79735 
1 1 1 -9  5  22 o 466.4479 6.876677 2657.820       78.16599 2663.450       110.8626 2652.255       110.2269 466.3376 9.755476 465.3653 9.719808 0.9723816      13.77113 
1 1 1 -9  5  23 o 505.1539 7.417007 3120.484       91.30373 3166.539       130.5598 3076.402       127.7325 507.9329 10.54793 500.6785 10.46903 7.254364       14.86134 
1 1 1 -9  5  24 o 126.2678 2.841685 194.3890       8.743890 200.3514       12.63101 188.9026       12.11649 128.0831 4.051881 124.3695 4.003067 3.713631       5.695813 
1 1 1 -9  5  25 o 141.9154 2.973568 245.6008       10.28356 229.4592       14.26881 263.0463       14.83395 137.0448 4.277808 146.7524 4.152145 -9.707581      5.961539 
1 1 1 -9  5  26 o 236.4498 4.503495 682.7203       25.94925 703.1357       45.00706 672.5545       31.75948 239.3245 7.727288 234.5478 5.556559 4.776688       9.517685 
1 1 1 -9  5  27 o 112.7957 3.284353 155.3553       9.018113 165.8774       11.33026 137.1673       14.89645 116.4973 3.996978 105.7284 5.803956 10.76889       7.047108 
1 1 1 -9  5  28 o 101.5908 2.840045 125.9876       7.024081 124.3574       9.872160 127.6590       9.996100 100.8354 4.025657 102.1676 4.022825 -1.332169      5.691136 
1 1 1 -9  5  29 o 91.59592 2.834146 102.4497       6.318463 107.0003       9.013549 98.05311       8.859749 93.51391 3.964331 89.50076 4.072849 4.013153       5.683662 
1 1 1 -9  5  30 o 182.1293 3.391243 404.9723       15.05133 406.9886       21.42504 403.0076       21.14922 182.3344 4.826130 181.4466 4.787281 0.8877563      6.797763 
1 1 1 -9  5  31 o 87.01636 3.369472 92.59899       7.131442 95.47239       8.733796 86.85062       12.35315 88.28462 4.070542 83.91238 6.082383 4.372246       7.318791 
1 1 1 -9  5  32 o 26.35476 7.037559 8.850463       4.604823 0.7173322E-01  9.266900 11.72884       5.306308 22.48751 9.591958 30.25584 7.284697 -7.768335      12.04460 
1 1 1 -9  5  33 o 137.8406 3.086041 232.0347       10.36609 245.0820       15.00076 220.1096       14.34119 141.4365 4.357468 134.0232 4.397009 7.413239       6.190413 
1 1 1 -9  5  34 o 70.25002 3.202255 60.42232       5.467577 54.91327       7.379169 67.12854       8.141572 66.79198 4.561009 73.88132 4.544058 -7.089340      6.438266 
1 1 1 -9  5  35 o 120.1067 3.435648 176.5546       10.04536 170.7102       15.97214 180.3792       12.92072 117.6690 5.586074 121.2338 4.380680 -3.564758      7.098914 
1 1 1 -9  5  36 o 57.27833 3.560772 40.30790       4.945583 28.59451       6.605122 55.25378       7.461058 47.82488 5.784916 66.93461 4.602193 -19.10973      7.392256 
1 1 1 -9  5  37 o 62.75312 3.774704 48.44419       5.745686 54.72148       8.923578 43.99882       7.509432 66.35435 5.570022 59.52500 5.230039 6.829346       7.640580 
1 1 1 -9  5  38 o 83.84638 3.531866 86.36176       7.200305 84.27474       8.729468 90.80363       12.73523 82.65144 4.349432 85.28207 6.169631 -2.630623      7.548636 
1 1 1 -9  5  39 o 11.65798 5.365971 -2.584678      3.512791 -4.811743      4.719357 0.1820938      5.260210 12.70856 5.972170 16.93271 7.224776 -4.224153      9.373591 
1 1 1 -9  5  40 o 66.67320 3.365999 54.81695       5.451226 50.62550       7.493980 59.52702       7.944090 63.64999 4.868403 69.08807 4.747368 -5.438087      6.799916 
1 1 1 -9  5  41 o 59.16222 3.660301 43.42526       5.251283 36.83073       7.158094 51.11050       7.727411 53.83718 5.534811 63.72109 5.016831 -9.883907      7.470122 
1 1 1 -9  5  42 o 62.38319 4.290040 48.87046       6.482055 47.21097       12.22912 49.51887       7.644241 58.64052 8.831588 62.43562 5.067719 -3.795101      10.18227 
1 1 1 -9  5  43 o 35.68752 4.829133 16.43827       4.092063 12.34976       5.586338 21.17212       6.011079 29.71219 7.664875 39.80641 6.414714 -10.09422      9.994942 
1 1 1 -9  5  44 o 17.48566 6.499910 3.501300       3.695512 1.855073       5.256350 5.110344       5.196648 17.47620 7.327317 20.52055 7.691858 -3.044346      10.62329 
1 1 1 -9  5  45 o 27.90934 6.494957 11.08179       4.334128 5.838715       6.854062 14.57512       5.594681 21.66670 8.635129 31.48002 7.415826 -9.813318      11.38244 
1 1 1 -9  5  46 o 43.00786 4.945215 24.98993       5.088645 22.64885       7.907425 26.64474       6.648146 37.09704 8.867683 42.92324 6.564070 -5.826202      11.03281 
1 1 1 -9  5  47 o 16.16807 6.667611 2.700061       4.250618 -0.6737280     5.101183 10.36342       7.688144 14.45680 6.583059 23.92344 9.261029 -9.466638      11.36236 
1 1 1 -9  5  48 o 9.713707 4.741527 -5.271292      3.677042 -7.431155      5.269433 -3.221444      5.133478 11.31360 5.554379 12.82396 6.086761 -1.510363      8.240132 
1 1 1 -9  5  49 o 11.66278 5.538674 -2.679626      4.262172 -3.945696      5.077159 0.3420837      7.843651 12.11425 5.830863 16.25081 7.656174 -4.136566      9.623718 
1 1 1 -9  5  50 o 12.40413 5.676711 -0.9948246E-01 3.855178 5.788120       5.524307 -5.688795      5.382546 17.80358 7.491072 11.50764 5.642287 6.295944       9.378249 
1 1 1 -9  5  51 o 16.13266 6.815917 4.450771       4.603657 11.32151       8.770185 1.837532       5.408745 19.68804 8.828642 14.56173 6.686344 5.126307       11.07484 
1 1 1 -9  6  1  f 419.0746 6.210419 2141.170       63.42324 2118.876       126.6582 2148.631       73.27119 416.3181 12.49868 419.7623 7.162980 -3.444214      14.40573 
1 1 1 -9  6  2  o 493.8467 6.449426 2973.539       77.61565 2985.227       123.0777 2965.822       100.0087 494.5735 10.21204 493.0986 8.322768 1.474854       13.17400 
1 1 1 -9  6  3  o 167.0870 3.022646 340.2148       12.30739 343.5292       17.72352 337.1282       17.10358 167.8302 4.337183 166.2623 4.224829 1.567886       6.054778 
1 1 1 -9  6  4  o 608.9948 7.863057 4523.240       116.6920 4345.002       179.6133 4653.419       153.5009 596.4557 12.35732 617.4940 10.20098 -21.03833      16.02384 
1 1 1 -9  6  5  o 256.1888 4.057329 799.9004       25.33007 793.1530       35.88606 806.5999       35.75854 255.0730 5.773313 257.2277 5.704609 -2.154678      8.116262 
1 1 1 -9  6  6  o 593.3895 8.571778 4295.040       123.9501 4227.463       173.5885 4365.335       177.0465 588.3788 12.10676 597.8915 12.15147 -9.512695      17.15319 
1 1 1 -9  6  7  o 509.8554 8.582175 3170.834       106.6303 3055.819       127.4266 3439.499       194.7540 500.3915 10.44995 530.2004 15.08871 -29.80887      18.35403 
1 1 1 -9  6  8  o 256.2784 4.057459 800.4534       25.33975 825.4799       36.70993 777.6763       35.02131 260.2211 5.789020 252.5761 5.689892 7.644943       8.117120 
1 1 1 -9  6  9  o 107.5256 2.512472 140.8868       6.583381 134.3624       9.428051 147.0951       9.196866 104.9357 3.692666 109.8108 3.441084 -4.875061      5.047459 
1 1 1 -9  6  10 o 964.3262 13.75763 11362.97       323.2986 11268.63       454.7482 11459.37       459.7189 958.9506 19.45981 967.0186 19.50839 -8.068054      27.55470 
1 1 1 -9  6  11 o 480.6541 9.961256 2819.279       116.6763 2819.279       116.6763 0.000000       0.000000 480.6541 9.961256 ?        ?        0.000000       9.961256 
1 1 1 -9  6  12 o 328.7737 5.785950 1317.755       46.35620 1398.293       58.99440 1187.770       74.94753 338.6234 7.149204 311.8208 9.875612 26.80261       12.19175 
1 1 1 -9  6  13 o 377.8337 5.646727 1740.371       51.99164 1698.945       72.60382 1783.974       74.48690 373.2092 7.983089 382.4339 7.992587 -9.224701      11.29651 
1 1 1 -9  6  14 o 94.68726 2.854836 109.3572       6.579798 105.6183       11.26098 111.2953       8.107819 92.94919 4.989873 95.49891 3.489799 -2.549721      6.089132 
1 1 1 -9  6  15 o 522.8802 7.616499 3335.001       97.04958 3274.470       135.7736 3398.235       138.7732 517.8254 10.75959 527.5168 10.79526 -9.691406      15.24161 
1 1 1 -9  6  16 o 286.1290 4.473649 997.9611       31.19319 1031.239       45.22907 967.7745       43.07722 290.7967 6.382519 281.7106 6.274924 9.086090       8.950487 
1 1 1 -9  6  17 o 575.0881 8.343230 4036.360       116.9243 4096.102       167.1200 3979.076       163.6465 578.8446 11.84760 570.5281 11.77046 8.316467       16.70058 
1 1 1 -9  6  18 o 190.1196 3.892983 440.5938       18.03622 452.7374       32.79042 435.3260       21.59677 192.5066 7.001472 188.9620 4.690058 3.544525       8.427174 
1 1 1 -9  6  19 o 325.6422 5.779093 1293.465       45.86025 1352.608       58.02803 1195.063       74.84888 332.9088 7.152806 312.5382 9.839828 20.37054       12.16490 
1 1 1 -9  6  20 o 350.2640 5.320642 1496.505       45.41462 1432.698       62.68668 1566.988       65.88451 342.5274 7.510069 358.2169 7.547466 -15.68951      10.64732 
1 1 1 -9  6  21 o 187.6223 3.351286 429.1493       15.32259 405.1392       21.26127 455.0958       22.10199 182.1842 4.793138 193.1609 4.695436 -10.97673      6.709791 
1 1 1 -9  6  22 o 355.8521 5.404497 1545.539       46.86632 1564.367       66.99678 1527.496       65.58378 357.7041 7.685885 353.4747 7.613809 4.229370       10.81864 
1 1 1 -9  6  23 o 277.5948 4.412079 940.2027       29.84632 973.8854       43.30328 909.7216       41.19383 282.3244 6.294139 272.8773 6.194819 9.447021       8.831306 
1 1 1 -9  6  24 o 79.87239 2.765039 77.87519       5.373764 71.03725       7.446470 85.30622       7.762690 76.19753 4.024540 83.53464 3.823515 -7.337112      5.551233 
1 1 1 -9  6  25 o 221.3277 3.759917 597.7040       20.27917 597.8470       28.85395 597.5644       28.50734 221.1953 5.352953 221.1503 5.289724 0.4492188E-01  7.525642 
1 1 1 -9  6  26 o 34.90010 5.164600 15.20475       4.259948 21.60429       5.602568 6.434420       6.558749 41.65531 5.666000 24.60583 8.728549 17.04948       10.40630 
1 1 1 -9  6  27 o 129.7470 2.932981 205.3371       9.273480 217.6126       13.39813 194.0481       12.84849 133.4357 4.125325 125.9904 4.190670 7.445236       5.880477 
1 1 1 -9  6  28 o 120.8036 2.884377 178.0213       8.491179 163.6943       11.70418 193.9408       12.33752 115.6939 4.158161 125.9561 4.024672 -10.26227      5.786906 
1 1 1 -9  6  29 o 94.21543 2.860224 108.3954       6.559261 113.8839       9.446961 103.2866       9.114369 96.47086 4.027320 91.85910 4.081824 4.611755       5.734160 
1 1 1 -9  6  30 o 136.8759 3.495576 228.9202       11.65001 232.7449       14.40440 221.6868       19.80924 137.9174 4.291101 134.3125 6.067899 3.604919       7.431887 
1 1 1 -9  6  31 o 247.6288 4.822751 750.5956       29.10262 777.9652       52.66579 738.5643       34.91813 250.6963 8.633624 245.3738 5.839647 5.322495       10.42310 
1 1 1 -9  6  32 f 104.6615 2.953094 133.8323       7.524297 129.4050       10.51934 138.4703       10.76691 102.7693 4.209291 106.3201 4.163706 -3.550735      5.920691 
1 1 1 -9  6  33 o 59.04390 3.413514 42.73952       4.890546 40.18908       6.630098 45.78333       7.243028 57.07086 4.812057 60.92329 4.920492 -3.852428      6.882379 
1 1 1 -9  6  34 o 59.00261 3.473974 42.70547       4.972878 41.50549       6.727264 44.15115       7.383941 57.98479 4.803968 59.76553 5.119177 -1.780743      7.020263 
1 1 1 -9  6  35 f 66.65995 3.301639 54.46273       5.346592 61.52518       7.476365 47.07030       7.649037 70.71316 4.359845 61.68668 5.134900 9.026474       6.736129 
1 1 1 -9  6  36 o 177.9009 3.930112 387.7955       17.03802 426.8445       29.59537 368.4378       20.83750 185.6095 6.553443 173.0525 4.946266 12.55702       8.210551 
1 1 1 -9  6  37 o 23.21452 6.400244 6.891766       3.737234 5.818577       5.039976 8.202642       5.570206 22.42419 7.670265 25.64513 8.024261 -3.220943      11.10053 
1 1 1 -9  6  38 f 134.3914 3.588255 221.7424       11.74092 210.3215       14.18226 246.6190       20.93100 130.6115 4.462375 140.7346 6.117753 -10.12305      7.572297 
1 1 1 -9  6  39 o 18.39732 6.503895 3.750228       3.638914 2.010655       4.931557 5.829461       5.391556 18.03285 7.277098 22.55364 7.921520 -4.520784      10.75670 
1 1 1 -9  6  40 o 44.03448 4.757572 24.36022       5.024259 22.00115       5.903241 30.56012       9.570000 41.44594 6.020829 47.98716 8.494522 -6.541218      10.41188 
1 1 1 -9  6  41 o 18.26619 7.082137 2.992290       4.501361 3.967585       8.252610 2.579240       5.370621 23.02706 9.369420 18.90038 7.605777 4.126684       12.06789 
1 1 1 -9  6  42 o 24.77990 7.456355 8.257691       4.868776 5.046474       9.289086 9.474042       5.716992 24.24697 9.912190 26.40027 8.107753 -2.153299      12.80575 
1 1 1 -9  6  43 o 37.43144 4.636448 18.01245       4.138856 18.77797       5.611916 17.09949       6.128610 37.40746 6.385262 35.13431 7.392550 2.273148       9.768386 
1 1 1 -9  6  44 o 31.77829 5.328849 13.45972       3.980724 11.57595       5.569481 15.42707       5.691696 28.20014 7.828009 32.95077 7.282351 -4.750628      10.69160 
1 1 1 -9  6  45 o 19.65788 6.663808 5.311405       3.802854 3.012568       5.089130 8.218067       5.722512 17.91015 7.330986 23.53979 8.168145 -5.629637      10.97552 
1 1 1 -9  6  46 o 14.86815 6.398491 1.084682       4.191526 1.269125       5.965866 0.9048830      5.890284 16.91295 7.449009 16.60050 7.352389 0.3124466      10.46639 
1 1 1 -9  6  47 o 20.61065 6.720116 6.530904       3.875767 6.120125       5.417411 6.961604       5.547220 20.07774 7.773540 20.93603 7.925342 -0.8582916     11.10131 
1 1 1 -9  6  48 o 27.43143 6.295900 11.66314       4.119362 10.19126       5.708800 13.26203       5.950000 23.61638 8.160198 26.93915 8.270973 -3.322771      11.61886 
1 1 1 -9  6  49 o 28.02691 7.141792 13.58325       4.891076 9.955466       5.895697 21.59184       8.759767 22.24384 8.220751 29.73885 10.11339 -7.495014      13.03309 
1 1 1 -9  6  50 o 13.83906 6.030882 1.839580       3.819267 -0.7222863     5.550461 4.143374       5.263476 13.65057 6.433999 16.42253 7.118963 -2.771966      9.595623 
1 1 1 -9  6  51 o 18.34378 7.244881 6.873424       4.783551 -3.064027      8.169274 12.05856       5.901004 14.11384 6.926449 22.55788 8.243262 -8.444039      10.76694 
1 1 1 -9  7  1  o 570.7949 8.283898 3973.880       115.2261 3890.352       227.8161 4002.593       133.5709 563.6458 16.60411 572.7545 9.569895 -9.108643      19.16454 
1 1 1 -9  7  2  o 517.5272 7.550620 3266.219       95.22519 3294.439       192.1781 3257.035       109.6300 518.8564 15.21563 516.7261 8.706287 2.130310       17.53040 
1 1 1 -9  7  3  o 247.5491 3.558404 746.8120       21.46608 716.7004       33.29590 768.2301       28.08114 242.4723 5.634981 251.0579 4.589917 -8.585571      7.267761 
1 1 1 -9  7  4  o 474.8004 6.225001 2748.395       72.02555 2709.357       112.8477 2775.229       93.56091 471.2133 9.827408 477.0201 8.048623 -5.806854      12.70269 
1 1 1 -9  7  5  o 250.0591 3.578679 762.0333       21.80728 739.6109       34.04793 777.6294       28.39606 246.3173 5.672307 252.5891 4.613253 -6.271851      7.311441 
1 1 1 -9  7  6  o 328.0938 4.985684 1312.086       39.86198 1312.760       56.62252 1311.423       56.12746 328.1165 7.081495 327.9514 7.023114 0.1651001      9.973550 
1 1 1 -9  7  7  o 543.4429 9.118682 3602.877       120.7597 3640.383       149.0190 3531.135       206.1007 546.0932 11.19795 537.1188 15.76316 8.974426       19.33575 
1 1 1 -9  7  8  o 641.2975 9.244677 5017.383       144.4732 4897.515       201.4446 5144.338       207.3138 633.1911 13.05524 648.9438 13.10947 -15.75275      18.50128 
1 1 1 -9  7  9  o 556.2892 8.066051 3774.287       109.3447 3740.085       153.8909 3809.161       155.3936 553.4906 11.40950 558.5778 11.41598 -5.087158      16.14005 
1 1 1 -9  7  10 o 856.3719 14.15526 8963.472       295.4039 8911.198       360.5679 9070.185       515.1775 853.2104 17.34182 858.4160 24.65318 -5.205566      30.14164 
1 1 1 -9  7  11 o 459.6738 7.807913 2577.094       87.46227 2521.044       105.7183 2698.669       155.6990 454.5377 9.544306 469.7274 13.61640 -15.18976      16.62829 
1 1 1 -9  7  12 o 157.0567 3.447457 300.6116       13.19446 288.1961       16.08878 326.1139       23.05853 153.7107 4.299418 163.4507 5.798255 -9.739990      7.218363 
1 1 1 -9  7  13 o 357.8935 5.391172 1561.480       47.01897 1586.876       67.44614 1537.469       65.58273 360.6972 7.673231 355.0421 7.580076 5.655060       10.78592 
1 1 1 -9  7  14 o 295.6894 5.276412 1065.870       38.01986 1050.787       65.45470 1073.550       46.70715 293.2929 9.169318 296.7142 6.459649 -3.421326      11.21621 
1 1 1 -9  7  15 o 331.9248 5.060768 1343.111       40.93476 1378.267       59.07375 1310.637       56.77559 336.1505 7.211484 327.8045 7.107398 8.345978       10.12525 
1 1 1 -9  7  16 o 456.1111 6.714734 2537.394       74.63380 2612.038       107.8505 2468.802       103.3872 462.5296 9.568557 449.6819 9.434639 12.84775       13.43762 
1 1 1 -9  7  17 o 257.8809 4.142249 810.6494       26.03103 835.7924       37.78339 787.9321       35.91455 261.7902 5.922586 254.1889 5.797994 7.601288       8.288171 
1 1 1 -9  7  18 o 622.6630 10.41934 4739.140       158.0990 4662.406       271.8231 4778.368       194.3545 615.3502 18.14690 624.7357 12.76622 -9.385498      22.18753 
1 1 1 -9  7  19 o 275.2985 5.035531 924.2773       33.78199 907.6068       41.21294 958.4158       58.97671 272.7416 6.200778 279.9594 8.655086 -7.217834      10.64707 
1 1 1 -9  7  20 f 224.9392 3.759941 616.8788       20.61020 617.9270       29.43033 615.8701       28.87215 225.0595 5.366136 224.6893 5.273034 0.3701172      7.523317 
1 1 1 -9  7  21 o 461.6192 6.816843 2602.665       76.68373 2514.848       106.2656 2698.083       110.7689 453.2248 9.621501 469.4314 9.682994 -16.20657      13.65041 
1 1 1 -9  7  22 o 156.4263 3.070148 298.3192       11.70321 303.7031       16.89894 293.3572       16.22341 157.7214 4.401062 155.0167 4.298798 2.704712       6.152155 
1 1 1 -9  7  23 o 107.4035 2.789843 140.7313       7.295694 142.7212       10.49888 138.8731       10.14553 108.0899 3.992719 106.6263 3.911207 1.463585       5.589217 
1 1 1 -9  7  24 o 138.4904 2.959646 233.8768       9.988394 263.4592       14.97373 210.1603       13.40719 146.8711 4.187947 131.1618 4.200050 15.70932       5.931216 
1 1 1 -9  7  25 o 106.9170 2.795078 139.4913       7.276191 136.4574       10.32851 142.4806       10.25209 105.6623 4.018591 107.9817 3.902481 -2.319412      5.601646 
1 1 1 -9  7  26 o 126.8665 3.975983 196.6621       12.27697 201.7204       16.85491 190.9454       17.91834 128.3385 5.401389 124.7937 5.908867 3.544785       8.005605 
1 1 1 -9  7  27 o 93.21524 2.814317 106.0762       6.385551 99.62704       9.016834 112.5646       9.044295 90.23304 4.111450 95.94572 3.876216 -5.712677      5.650582 
1 1 1 -9  7  28 o 162.5063 3.197471 322.2499       12.66231 316.0522       17.86886 328.5011       17.94581 160.7476 4.566216 163.8946 4.497518 -3.147003      6.409211 
1 1 1 -9  7  29 f 90.49446 2.857198 100.0137       6.292944 102.3129       8.994134 97.80872       8.807922 91.42414 4.047063 89.38437 4.054226 2.039772       5.728478 
1 1 1 -9  7  30 o 104.3385 3.320893 133.0475       8.432999 130.0601       10.22190 139.4135       14.92190 103.0799 4.077360 106.4896 5.771743 -3.409706      7.066674 
1 1 1 -9  7  31 o 128.1887 3.578461 200.8957       11.16752 183.7197       19.98121 208.6983       13.46727 122.0488 6.744409 130.5685 4.238195 -8.519684      7.965510 
1 1 1 -9  7  32 o 143.0319 3.596137 250.1594       12.52451 233.5445       14.96423 289.0213       22.88589 138.0651 4.453514 153.2402 6.141003 -15.17511      7.585888 
1 1 1 -9  7  33 o 98.47878 2.987247 118.5396       7.160570 119.1853       10.02890 117.8680       10.22716 98.59801 4.183473 98.03486 4.291331 0.5631485      5.993077 
1 1 1 -9  7  34 o 84.13702 3.088417 86.60517       6.321521 88.83603       8.820789 84.24952       9.064138 85.05995 4.269104 82.79228 4.509655 2.267670       6.209850 
1 1 1 -9  7  35 o 146.1788 3.219728 261.2548       11.46937 272.6024       16.52281 250.7022       15.93351 148.9962 4.555997 142.8737 4.582316 6.122437       6.461790 
1 1 1 -9  7  36 o 162.0499 3.753808 321.6679       14.82371 317.6017       24.37153 324.0556       18.67543 160.1542 6.256693 162.3322 4.725987 -2.178040      7.840993 
1 1 1 -9  7  37 o 13.15257 5.803836 -1.038369      3.637873 -1.153936      4.766264 -0.8770902     5.630527 15.17070 6.670738 16.79741 7.321310 -1.626710      9.904561 
1 1 1 -9  7  38 o 12.84882 5.848776 -2.407966      4.022171 -6.643667      4.646471 10.25404       8.033630 11.69184 5.614765 28.88862 9.685356 -17.19678      11.19516 
1 1 1 -9  7  39 o 56.55766 3.503013 39.46337       4.804327 38.41148       6.534823 40.70070       7.087462 55.47281 4.883939 57.03798 5.154641 -1.565174      7.100928 
1 1 1 -9  7  40 o 29.39901 8.485783 11.53383       6.416243 8.119677       9.537170 14.35680       8.672248 27.37859 10.38545 32.57694 9.982284 -5.198345      14.40498 
1 1 1 -9  7  41 o 42.41778 4.220520 22.59530       4.304825 19.34365       5.754775 26.72656       6.486598 38.48963 6.357221 45.52868 5.991794 -7.039055      8.735895 
1 1 1 -9  7  42 o 31.20466 6.871270 13.15643       5.083462 21.39708       10.05843 10.32953       5.891211 38.04768 10.50390 27.38489 8.193254 10.66279       13.32146 
1 1 1 -9  7  43 o 17.34923 6.315086 3.463138       3.458359 6.487676       4.756186 0.7001907E-01  5.037659 22.12629 7.452552 15.93957 6.936581 6.186720       10.18119 
1 1 1 -9  7  44 o 21.26785 6.497349 6.248632       3.677595 4.762061       4.926631 8.119431       5.526760 19.83749 7.477914 23.86996 8.033587 -4.032476      10.97532 
1 1 1 -9  7  45 o 15.55759 6.501001 1.665218       4.116682 5.065967       6.173057 -1.058502      5.524516 20.43551 8.178005 15.27936 6.915254 5.156142       10.70983 
1 1 1 -9  7  46 o 35.36459 5.069587 17.16781       4.244168 11.39402       5.609352 24.89931       6.491035 26.45785 8.012553 41.09613 6.713066 -14.63828      10.45305 
1 1 1 -9  7  47 o 31.62661 6.651841 15.28422       4.963819 13.01422       8.117112 16.64021       6.273587 25.71119 9.618235 31.36130 8.139180 -5.650110      12.59987 
1 1 1 -9  7  48 o 16.64285 6.562322 3.843726       3.918874 -0.1643156     5.731031 7.363669       5.370745 14.91668 6.861531 20.56085 7.794839 -5.644172      10.38461 
1 1 1 -9  7  49 o 15.37578 6.418961 3.013164       4.007807 2.585315       5.680637 3.437195       5.655238 15.99592 7.144071 16.55070 7.272275 -0.5547781     10.19430 
1 1 1 -9  7  50 o 18.20557 6.578698 5.901139       3.744056 9.807339       5.550402 2.639663       5.071709 21.33585 7.959087 15.20683 6.773677 6.129025       10.45130 
1 1 1 -9  7  51 o 13.03666 6.018683 0.4313011      4.467093 -4.980690      8.182290 2.729332       5.331805 13.58876 6.718707 14.99004 6.788021 -1.401277      9.550824 
1 1 1 -9  8  1  o 399.4772 5.960842 1945.463       58.02774 1862.508       113.6914 1974.686       67.47890 390.3688 11.96546 402.4305 6.880833 -12.06168      13.80283 
1 1 1 -9  8  2  o 222.1051 3.684836 601.1897       19.94402 581.8797       28.02002 621.0184       28.39391 218.4858 5.262705 225.7160 5.162105 -7.230179      7.371797 
1 1 1 -9  8  3  o 668.1406 9.626997 5446.830       156.7454 5457.088       314.4813 5443.438       180.8046 667.0875 19.36581 667.7791 11.11068 -0.6915894     22.32671 
1 1 1 -9  8  4  f 302.6870 4.183648 1116.624       30.85922 1099.914       48.49721 1127.992       40.00241 300.3545 6.625926 304.1975 5.396279 -3.843048      8.545334 
1 1 1 -9  8  5  o 582.7928 7.548635 4141.933       107.2059 4085.340       168.0041 4180.806       139.2391 578.4313 11.91879 585.3542 9.761267 -6.922913      15.40584 
1 1 1 -9  8  6  o 167.4698 3.127188 341.7767       12.76223 329.4212       17.75747 354.9768       18.35437 164.3428 4.438048 170.6036 4.418561 -6.260773      6.262583 
1 1 1 -9  8  7  o 149.0365 3.382516 270.6865       12.28482 270.4500       15.19712 271.1325       20.86834 148.9056 4.192245 149.0239 5.757230 -0.1183014     7.121840 
1 1 1 -9  8  8  o 279.6173 5.064697 953.0258       34.51068 915.8054       41.45050 1037.116       62.30367 274.0757 6.206161 291.4460 8.782440 -17.37030      10.75396 
1 1 1 -9  8  9  o 527.0164 8.874143 3388.357       113.9690 3223.354       134.9704 3798.296       212.7422 513.8740 10.77819 557.0408 15.68785 -43.16681      19.03360 
1 1 1 -9  8  10 o 600.9429 10.04363 4407.368       147.0822 4398.767       180.0667 4424.611       254.9560 600.1108 12.31306 600.8862 17.42994 -0.7754517     21.34044 
1 1 1 -9  8  11 o 148.9104 2.920903 270.2206       10.59933 286.6554       15.69552 256.4420       14.37129 153.3026 4.205335 144.9974 4.071267 8.305161       5.853209 
1 1 1 -9  8  12 o 130.1233 2.783116 206.3361       8.825155 188.6299       12.37881 224.6371       12.58505 124.3379 4.091013 135.7099 3.809230 -11.37196      5.589868 
1 1 1 -9  8  13 o 400.6103 6.895483 1957.189       67.31671 1950.528       82.51582 1970.443       116.3987 399.8386 8.468694 401.4388 11.91168 -1.600250      14.61530 
1 1 1 -9  8  14 o 564.6866 9.456329 3892.197       130.1266 3794.533       221.7370 3943.501       160.7107 556.3316 16.37349 568.1397 11.60790 -11.80811      20.07073 
1 1 1 -9  8  15 o 615.7954 8.913759 4628.407       133.7622 4904.956       196.9096 4391.440       182.2737 633.3510 12.75811 599.3265 12.48028 34.02448       17.84732 
1 1 1 -9  8  16 o 360.8076 5.455248 1587.345       47.96520 1556.270       67.31918 1619.388       68.35885 357.1280 7.735329 364.3005 7.700144 -7.172516      10.91456 
1 1 1 -9  8  17 o 748.4596 12.44650 6854.996       227.0135 6762.346       390.4451 6902.311       279.0228 739.8640 21.67907 750.2294 15.26193 -10.36548      26.51242 
1 1 1 -9  8  18 f 173.4350 3.225387 366.6293       13.63185 387.1556       20.27189 349.6858       18.41789 178.1295 4.674096 169.2948 4.468276 8.834702       6.466270 
1 1 1 -9  8  19 f 320.5465 5.703973 1253.551       44.55584 1246.943       54.70125 1266.576       76.80444 319.5956 7.023610 321.6589 9.809855 -2.063324      12.06501 
1 1 1 -9  8  20 o 205.6588 3.548805 515.6555       17.78547 494.0126       24.88738 538.2456       25.42619 201.1697 5.080754 210.0552 4.967201 -8.885483      7.105431 
1 1 1 -9  8  21 o 129.9183 2.849054 205.7535       9.020014 209.3231       13.14967 202.5812       12.39611 130.9426 4.126106 128.8250 3.953333 2.117599       5.714333 
1 1 1 -9  8  22 o 73.48706 2.766340 65.92770       4.945117 72.61938       7.346045 60.38252       6.687196 77.06109 3.924776 70.25095 3.921779 6.810143       5.548353 
1 1 1 -9  8  23 o 192.4356 3.440473 451.6451       16.13391 461.3976       23.29724 442.6577       22.36490 194.3418 4.923252 190.3616 4.825050 3.980194       6.893440 
1 1 1 -9  8  24 o 50.29742 3.132251 30.97279       3.820125 27.15246       5.425672 34.72848       5.379568 46.90980 4.814539 53.17944 4.184838 -6.269642      6.379080 
1 1 1 -9  8  25 o 375.7411 6.549054 1728.235       59.96576 1689.299       101.9490 1748.832       74.14898 369.6126 11.33218 377.5231 8.059824 -7.910461      13.90608 
1 1 1 -9  8  26 f 175.5236 3.850964 376.0560       16.47180 378.0288       20.27457 372.2254       28.25110 175.8399 4.735805 174.1918 6.667669 1.648041       8.178365 
1 1 1 -9  8  27 o 228.9545 3.878139 639.9964       21.63758 683.6755       32.00181 603.2114       29.36790 236.3890 5.555346 222.0638 5.426989 14.32518       7.766214 
1 1 1 -9  8  28 o 46.58231 3.534910 26.64091       3.982733 27.21603       5.567464 26.03814       5.699733 46.91796 4.943696 45.84449 5.193254 1.073475       7.170078 
1 1 1 -9  8  29 o 362.6746 5.564218 1611.020       49.17647 1583.868       69.02750 1639.003       70.07642 358.6620 7.897702 364.8588 7.881537 -6.196838      11.15761 
1 1 1 -9  8  30 o 193.3057 4.076333 456.7247       19.20218 461.5928       23.80271 447.6520       32.49479 194.1094 5.036291 190.6703 7.005408 3.439026       8.627860 
1 1 1 -9  8  31 o 191.4873 5.153091 449.5815       24.02420 436.6173       34.52961 461.7455       33.44695 188.0305 7.551120 193.5210 7.104445 -5.490417      10.36786 
1 1 1 -9  8  32 o 68.07120 3.112056 56.70393       5.148687 61.26867       7.256525 52.07620       7.306417 70.63849 4.234966 65.04981 4.639625 5.588676       6.281804 
1 1 1 -9  8  33 o 89.58668 2.989233 98.12648       6.516744 92.27016       9.012395 104.5438       9.434203 86.71038 4.278348 92.32124 4.204448 -5.610863      5.998470 
1 1 1 -9  8  34 o 58.63633 3.403666 42.17685       4.842604 41.36565       6.648953 43.09330       7.067112 57.88118 4.755805 59.05256 4.956668 -1.171379      6.869224 
1 1 1 -9  8  35 o 106.7041 3.034151 139.2762       7.881582 147.4525       11.29029 131.5042       11.00757 109.5927 4.235507 103.4605 4.375854 6.132248       6.089960 
1 1 1 -9  8  36 o 143.4267 3.590927 252.0887       12.54097 242.9040       20.26686 257.7878       15.96447 140.0903 5.950212 144.7965 4.529966 -4.706192      7.478343 
1 1 1 -9  8  37 o 136.8966 3.192289 229.4653       10.64955 213.3733       14.62959 247.6047       15.53238 131.5961 4.568907 141.7939 4.500852 -10.19780      6.413468 
1 1 1 -9  8  38 o 75.99094 3.704824 71.10075       6.839979 76.91288       8.380187 59.50107       11.83884 78.88376 4.376588 68.48836 7.201032 10.39540       8.426706 
1 1 1 -9  8  39 o 44.71584 5.149891 25.16026       5.509347 20.86255       10.79239 26.67494       6.407060 39.00058 10.92317 45.85003 5.868715 -6.849442      12.39990 
1 1 1 -9  8  40 o 59.28416 4.028266 43.69779       5.785032 44.36448       6.953891 42.19935       10.42524 59.47632 4.839653 56.77542 7.736153 2.700897       9.125256 
1 1 1 -9  8  41 o 15.33423 6.151816 1.627879       3.502112 5.235794       4.651256 -3.094981      5.321630 20.93846 7.357338 14.54061 6.660125 6.397846       9.924096 
1 1 1 -9  8  42 o 20.36690 7.278066 4.981910       4.567963 6.136817       8.878262 4.566111       5.327172 24.52296 9.809654 20.50158 7.765265 4.021383       12.51114 
1 1 1 -9  8  43 o 11.14558 5.181127 -2.611961      3.396708 1.979986       4.485750 -8.783695      5.200442 16.78398 6.877802 11.48577 5.613485 5.298214       8.877802 
1 1 1 -9  8  44 o 20.38234 6.573214 5.694679       3.714053 4.960672       5.035278 6.570558       5.500417 20.04243 7.558878 22.01144 7.971098 -1.969009      10.98522 
1 1 1 -9  8  45 o 27.52723 6.988784 11.22198       4.695790 14.74245       7.282228 8.716259       6.143692 29.81752 9.149359 23.80287 8.447441 6.014654       12.45271 
1 1 1 -9  8  46 o 30.64097 5.831575 13.45941       4.195333 12.33372       5.717647 14.77234       6.174893 27.40005 8.040025 29.89751 8.220676 -2.497459      11.49876 
1 1 1 -9  8  47 o 13.37185 5.908452 0.3296070      3.782178 -2.778536      5.275181 3.617538       5.425606 13.35978 6.289368 17.63396 7.422018 -4.274181      9.728437 
1 1 1 -9  8  48 o 13.62402 6.410280 -2.005370      5.466740 -7.883339      7.585795 4.345702       7.885169 13.55746 6.657670 18.53610 8.336854 -4.978634      10.66901 
1 1 1 -9  8  49 o 12.04468 5.553846 -0.7172567     3.786880 -6.055416      5.330942 4.720237       5.380314 11.46693 5.620853 17.28156 7.337823 -5.814635      9.243248 
1 1 1 -9  8  50 o 14.36471 6.144076 2.522374       3.820977 3.242260       5.704648 1.936622       5.145813 15.80743 7.101866 14.72298 6.667684 1.084451       9.741382 
1 1 1 -9  9  1  o 244.4777 3.570694 728.4005       21.27297 726.0369       33.92572 729.9319       27.30865 244.0435 5.704607 244.7191 4.579270 -0.6755981     7.315207 
1 1 1 -9  9  2  o 444.2826 5.867697 2406.321       63.52769 2337.250       98.67126 2455.223       83.02460 437.6885 9.251016 448.6945 7.593114 -11.00598      11.96815 
1 1 1 -9  9  3  o 319.7378 4.394266 1246.011       34.23863 1231.608       53.89787 1255.756       44.33297 317.8139 6.959253 320.9543 5.668230 -3.140442      8.975525 
1 1 1 -9  9  4  o 379.8500 5.092453 1758.742       47.13844 1792.231       75.63920 1737.476       60.27460 383.3335 8.097184 377.4976 6.552154 5.835968       10.41610 
1 1 1 -9  9  5  o 242.2879 3.945225 715.4397       23.29376 709.4924       47.10804 717.3645       26.79933 241.0551 8.030622 242.6043 4.533038 -1.549194      9.221676 
1 1 1 -9  9  6  o 173.3815 4.535878 366.6454       19.14816 366.6454       19.14816 0.000000       0.000000 173.3815 4.535878 ?        ?        0.000000       4.535878 
1 1 1 -9  9  7  o 159.1011 3.503597 308.4864       13.58387 300.3405       16.75282 324.1215       23.20969 156.9167 4.385395 162.9502 5.854432 -6.033478      7.314784 
1 1 1 -9  9  8  o 437.7596 7.473879 2337.033       79.72927 2301.330       96.90926 2411.819       140.2584 434.3058 9.156585 444.1223 12.97346 -9.816498      15.87935 
1 1 1 -9  9  9  o 698.7374 10.05237 5958.734       171.1664 5849.875       239.3819 6072.615       244.8421 691.7554 14.20047 704.7929 14.25570 -13.03754      20.12158 
1 1 1 -9  9  10 o 199.5824 3.452466 485.4431       16.79143 476.1072       23.86199 494.6006       23.63299 197.5704 4.960119 201.4368 4.814418 -3.866348      6.912409 
1 1 1 -9  9  11 o 418.7005 6.215191 2137.519       63.41531 2027.185       86.91227 2263.136       92.73634 407.6144 8.749747 430.6776 8.836119 -23.06326      12.43524 
1 1 1 -9  9  12 o 250.5803 4.046663 765.3005       24.71042 780.6124       35.68598 751.1961       34.24987 253.0345 5.787378 248.2244 5.662111 4.810089       8.096496 
1 1 1 -9  9  13 o 597.8071 9.991303 4363.030       145.5524 4489.173       257.2439 4303.629       176.5272 604.9104 17.46920 593.4346 12.20683 11.47583       21.31149 
1 1 1 -9  9  14 o 514.6987 7.523303 3231.778       94.36214 3193.736       132.7902 3270.583       134.1161 511.3472 10.65648 517.4651 10.63565 -6.117920      15.05582 
1 1 1 -9  9  15 o 537.4468 9.050592 3526.311       118.5355 3523.093       145.4092 3532.684       204.6542 536.9371 11.11302 536.6696 15.66544 0.2675171      19.20691 
1 1 1 -9  9  16 o 583.2111 9.789477 4154.985       139.1302 3972.876       234.8074 4253.514       172.7147 568.5859 16.96546 589.7032 12.01876 -21.11725      20.79128 
1 1 1 -9  9  17 o 201.9864 4.077979 497.3633       20.07258 443.4323       34.04315 526.1046       24.85215 190.4702 7.348219 207.7165 4.909721 -17.24635      8.837516 
1 1 1 -9  9  18 o 351.4142 6.169078 1506.788       52.82940 1477.508       64.27438 1567.760       92.75142 347.8590 7.582258 357.8026 10.64938 -9.943634      13.07287 
1 1 1 -9  9  19 o 252.0886 4.090066 774.8780       25.12579 777.1176       35.88670 772.7246       35.19001 252.3562 5.835572 251.6482 5.738383 0.7080688      8.184311 
1 1 1 -9  9  20 o 323.6603 4.996070 1278.070       39.40524 1269.952       55.75803 1286.171       55.69688 322.4157 7.096679 324.4744 7.043920 -2.058655      9.998983 
1 1 1 -9  9  21 o 180.8644 3.308890 398.8507       14.58383 403.9496       21.10392 394.1901       20.17661 181.8877 4.765385 179.6876 4.611614 2.200089       6.631431 
1 1 1 -9  9  22 o 407.6608 6.109743 2030.574       60.69571 1979.797       84.70347 2084.162       87.01665 401.9687 8.647147 412.4247 8.658080 -10.45596      12.23665 
1 1 1 -9  9  23 o 324.6993 5.024613 1287.474       39.75760 1251.119       55.54011 1325.682       56.93739 319.7212 7.128518 329.1166 7.099236 -9.395447      10.06056 
1 1 1 -9  9  24 o 175.1665 3.282366 374.2691       14.01116 388.2279       20.40878 361.8248       19.26978 178.2388 4.702820 172.0780 4.599441 6.160843       6.578098 
1 1 1 -9  9  25 o 197.2752 4.924329 475.4988       23.67313 485.4215       33.20873 465.2466       33.75569 198.9491 6.860004 194.7157 7.125953 4.233383       9.891354 
1 1 1 -9  9  26 o 150.7984 3.616662 277.5329       13.29049 275.2286       16.22403 282.2339       23.17319 150.0432 4.442061 151.6909 6.282482 -1.647644      7.694250 
1 1 1 -9  9  27 o 110.0591 2.861616 147.8601       7.668402 152.3638       11.16047 143.8322       10.55441 111.6170 4.110159 108.4535 4.000360 3.163498       5.735529 
1 1 1 -9  9  28 o 292.7697 4.661829 1047.966       33.25972 1023.216       46.63929 1073.577       47.44373 288.7879 6.627304 295.8234 6.581279 -7.035492      9.339935 
1 1 1 -9  9  29 o 147.6608 3.581550 266.2690       12.88761 266.6453       16.01842 265.5784       21.70051 147.6069 4.458359 147.0356 6.069407 0.5712891      7.530914 
1 1 1 -9  9  30 f 117.9350 3.415733 169.9984       9.806295 172.2157       12.07849 165.7105       16.79668 118.6102 4.185389 116.0670 5.958469 2.543243       7.281541 
1 1 1 -9  9  31 o 180.4944 4.005558 398.3367       17.61825 418.1400       32.81834 390.3186       20.88255 184.0332 7.332541 178.4682 4.805981 5.564987       8.767189 
1 1 1 -9  9  32 o 70.88113 3.069374 61.46925       5.289151 64.36294       7.647486 58.81590       7.323036 72.38586 4.355546 69.18334 4.365902 3.202522       6.166999 
1 1 1 -9  9  33 o 74.69421 3.116352 68.27609       5.659974 67.61915       7.940788 68.95452       8.069590 74.17143 4.413253 74.89867 4.441149 -0.7272339     6.261039 
1 1 1 -9  9  34 o 116.4819 3.040883 165.9049       8.624272 168.8679       12.29381 163.0339       12.10158 117.3107 4.307756 115.2622 4.316056 2.048492       6.097959 
1 1 1 -9  9  35 o 39.49501 4.867260 19.44661       4.585510 25.11565       6.924200 15.01820       6.119822 44.61020 6.565595 34.12114 7.559186 10.48906       10.01241 
1 1 1 -9  9  36 o 124.6109 3.128538 190.0989       9.492706 186.7172       13.42078 193.4846       13.42865 123.1911 4.478017 125.4273 4.400251 -2.236191      6.278125 
1 1 1 -9  9  37 o 56.70245 3.653342 39.60131       5.021240 38.66473       6.816817 40.71223       7.424214 55.74645 5.073501 57.13940 5.395759 -1.392956      7.406391 
1 1 1 -9  9  38 o 49.62882 6.384927 31.25054       7.543224 35.23458       11.91834 28.58815       9.742919 51.47663 9.859884 46.59757 8.904579 4.879063       13.28566 
1 1 1 -9  9  39 o 31.70264 5.986672 12.98540       4.455576 10.50964       5.221102 19.62024       8.547186 28.22344 7.474167 38.09289 9.291733 -9.869450      11.92474 
1 1 1 -9  9  40 o 88.89371 3.107488 97.37273       6.721220 97.03731       9.318573 97.73643       9.703593 88.27081 4.345434 88.51376 4.513588 -0.2429428     6.265403 
1 1 1 -9  9  41 o 68.14142 3.251260 57.51485       5.383246 51.61169       7.277234 64.64906       8.000128 63.97028 4.701061 71.67806 4.604449 -7.707787      6.580344 
1 1 1 -9  9  42 o 26.45644 7.439147 9.660096       4.995329 9.917183       9.551490 9.563304       5.860730 27.56891 10.40779 26.28654 8.231729 1.282372       13.26965 
1 1 1 -9  9  43 o 18.82653 6.499765 4.501774       3.621630 4.231156       5.038948 4.790942       5.208791 19.55231 7.516373 20.26842 7.678148 -0.7161179     10.74476 
1 1 1 -9  9  44 o 11.32873 5.271433 -2.536110      3.529638 -5.711590      4.732278 1.445449       5.298978 11.77928 5.659256 16.94521 7.241313 -5.165929      9.190418 
1 1 1 -9  9  45 f 12.69431 5.660040 -0.5067561     3.550122 1.159068       4.738518 -2.638187      5.359985 15.72096 6.784631 14.02007 6.514319 1.700886       9.405721 
1 1 1 -9  9  46 o 14.55609 6.152014 1.492062       3.752681 10.01345       5.175685 -7.953226      5.449044 24.80428 7.730903 11.62735 5.696021 13.17692       9.602683 
1 1 1 -9  9  47 o 32.82509 5.590539 15.64024       4.311813 14.66248       6.136346 16.59383       6.060019 28.80031 8.294250 31.25066 7.942168 -2.450350      11.48358 
1 1 1 -9  9  48 o 12.14010 5.717992 -2.218170      4.369824 -0.8485905     5.486725 -4.593782      7.226157 14.14968 6.580098 14.16401 6.851635 -0.1432037E-01 9.499610 
1 1 1 -9  9  49 o 12.58053 5.837215 -0.7283941     4.280446 -0.3583457     6.937460 -0.9558676     5.439221 15.00180 7.107404 13.61855 6.403465 1.383254       9.566586 
1 1 1 -9  9  50 o 14.33175 6.199128 2.461850       3.973716 9.247755       5.902012 -3.164910      5.374343 20.21733 8.027496 12.27010 5.929000 7.947227       9.979667 
1 1 1 -9  10 1  o 355.1197 5.396799 1537.304       46.70325 1593.699       68.08181 1487.176       64.18690 361.4856 7.728657 349.2038 7.542779 12.28180       10.79934 
1 1 1 -9  10 2  f 436.8899 7.451370 2327.745       79.33123 2389.026       99.20011 2219.021       132.1333 442.5005 9.199460 426.0123 12.74215 16.48816       15.71599 
1 1 1 -9  10 3  o 590.2877 8.562789 4250.504       123.1729 4342.814       176.5905 4163.043       171.8900 596.3104 12.15231 583.8458 12.08138 12.46460       17.13588 
1 1 1 -9  10 4  o 205.1476 3.530139 512.8913       17.64795 483.8220       24.46181 544.4448       25.48561 199.1648 5.044167 211.3436 4.948458 -12.17876      7.066176 
1 1 1 -9  10 5  o 557.3785 8.104374 3789.345       110.0793 3633.728       151.4986 3963.392       160.2185 545.5328 11.39598 569.7269 11.54011 -24.19409      16.21858 
1 1 1 -9  10 6  o 472.1338 9.853559 2720.323       113.3690 2809.240       163.9098 2638.775       156.9712 479.1942 14.05162 464.4376 13.88495 14.75668       19.75449 
1 1 1 -9  10 7  o 111.4581 2.688343 151.3844       7.301841 153.0641       10.73599 149.9386       9.960311 111.9978 3.939791 110.8573 3.692146 1.140533       5.399435 
1 1 1 -9  10 8  o 209.0038 3.569080 532.3633       18.17802 515.4092       25.60767 549.5847       25.80872 205.6256 5.110422 212.3357 4.987781 -6.710083      7.141034 
1 1 1 -9  10 9  o 489.7516 7.178698 2925.145       85.67569 2882.123       120.2817 2969.453       122.0655 485.9183 10.15781 493.2253 10.15573 -7.307007      14.36384 
1 1 1 -9  10 10 o 432.9825 6.413551 2285.960       67.67137 2390.880       98.84991 2193.417       92.83646 442.6366 9.164165 423.9764 8.985469 18.66013       12.83435 
1 1 1 -9  10 11 o 597.7163 8.658460 4359.246       126.1165 4321.010       177.6168 4398.125       179.1038 594.6669 12.25672 599.9507 12.25048 -5.283752      17.32921 
1 1 1 -9  10 12 o 255.2008 4.119093 793.8127       25.61649 782.1616       36.27573 805.4016       36.17884 253.2763 5.877404 257.0146 5.776447 -3.738266      8.240827 
1 1 1 -9  10 13 o 720.8060 11.97696 6350.234       210.3784 6171.865       357.6067 6444.639       260.1614 708.1259 20.74567 725.5721 14.71384 -17.44623      25.43384 
1 1 1 -9  10 14 o 849.2113 12.17428 8817.750       251.9388 8609.179       350.7027 9040.177       362.1642 837.6579 17.18052 858.3228 17.31485 -20.66486      24.39210 
1 1 1 -9  10 15 o 232.9936 4.475960 661.7955       25.41361 665.0416       45.23472 660.2983       30.72015 233.2953 7.968336 232.7014 5.417368 0.5939941      9.635468 
1 1 1 -9  10 16 o 510.8214 10.60060 3190.168       131.9580 3169.935       186.9598 3210.254       186.2756 508.0929 15.11654 511.3561 14.96456 -3.263214      21.27082 
1 1 1 -9  10 17 o 234.6703 3.890898 671.3591       22.25072 706.3846       32.74028 641.2966       30.33207 240.6458 5.583004 229.2980 5.428323 11.34784       7.786953 
1 1 1 -9  10 18 o 31.64259 4.913544 12.50107       3.665968 11.23984       5.239102 13.71101       5.131496 29.75028 7.285593 32.92944 6.624475 -3.179153      9.847006 
1 1 1 -9  10 19 o 132.2640 2.889587 213.2405       9.313509 207.2058       13.40486 218.8722       12.94952 130.2797 4.227903 133.9156 3.972525 -3.635895      5.801390 
1 1 1 -9  10 20 o 282.4041 4.484077 972.8863       30.85887 1020.988       45.16814 930.7811       42.25904 289.1226 6.410827 276.0683 6.281553 13.05435       8.975334 
1 1 1 -9  10 21 o 76.80778 2.770169 72.01335       5.176495 58.14008       7.410488 85.23383       7.234039 68.88757 4.437994 83.52508 3.562266 -14.63751      5.690828 
1 1 1 -9  10 22 o 257.5268 4.188701 809.2466       26.28680 801.5574       37.29736 816.8359       37.05414 256.1082 5.976110 258.5495 5.881077 -2.441345      8.384567 
1 1 1 -9  10 23 o 99.42155 2.748267 120.6180       6.652099 131.2315       9.978073 112.1270       8.924782 103.6275 3.958537 95.78589 3.831220 7.841660       5.508925 
1 1 1 -9  10 24 o 276.8197 4.442012 935.6748       29.96490 897.7406       41.71930 976.0981       43.06633 270.8552 6.320679 282.4406 6.257121 -11.58542      8.893961 
1 1 1 -9  10 25 o 237.4445 5.595693 689.5219       32.37815 744.6979       47.06253 639.9363       44.61471 246.1960 7.854422 228.1592 8.036792 18.03676       11.23752 
1 1 1 -9  10 26 o 127.5492 2.921885 198.4493       9.081909 202.7430       13.19274 194.5817       12.52108 128.7757 4.209680 126.1677 4.077822 2.608017       5.860890 
1 1 1 -9  10 27 o 142.0644 3.044034 246.2493       10.53830 240.9191       15.03899 251.3915       14.77144 140.3445 4.402755 143.3860 4.232096 -3.041489      6.106955 
1 1 1 -9  10 28 f 42.55473 3.678261 22.27796       3.776991 21.00872       5.352049 23.53721       5.330957 41.06424 5.485434 43.56213 5.119408 -2.497894      7.503221 
1 1 1 -9  10 29 o 217.6185 5.429235 580.1553       28.79191 580.1553       28.79191 0.000000       0.000000 217.6185 5.429235 ?        ?        0.000000       5.429235 
1 1 1 -9  10 30 f 145.6985 3.116751 259.1630       11.06606 254.2255       15.81796 263.8958       15.48685 144.0789 4.510756 146.8248 4.333143 -2.745850      6.254842 
1 1 1 -9  10 31 o 93.23437 3.535146 106.3656       8.017371 104.7823       15.35900 106.9586       9.399616 91.99040 6.901802 93.42117 4.139122 -1.430771      8.047807 
1 1 1 -9  10 32 o 53.36559 3.553515 34.96243       4.594881 32.84797       6.415966 37.18880       6.583560 51.49411 5.183360 54.85487 4.979228 -3.360764      7.187485 
1 1 1 -9  10 33 o 110.1025 3.022951 148.2000       8.103137 147.6981       11.52855 148.6900       11.39180 109.7258 4.319957 110.1055 4.253683 -0.3797226     6.062660 
1 1 1 -9  10 34 o 37.16035 4.531642 17.18368       4.018888 16.10672       5.556170 18.36540       5.820146 35.54755 6.658638 38.04921 6.510917 -2.501659      9.312868 
1 1 1 -9  10 35 o 84.15718 3.460604 86.82274       7.081931 85.13170       11.29322 87.91875       9.091729 82.92004 5.622089 84.52490 4.429390 -1.604866      7.157331 
1 1 1 -9  10 36 o 97.19518 3.083117 115.7101       7.293252 115.4326       10.25754 115.9938       10.37184 96.82661 4.358402 97.05325 4.396822 -0.2266464     6.190938 
1 1 1 -9  10 37 o 84.01137 3.970891 86.92437       8.106460 78.19267       14.99463 90.53036       9.636045 78.40641 7.957917 85.57563 4.638086 -7.169220      9.210878 
1 1 1 -9  10 38 o 72.69451 3.263246 64.98664       5.766057 66.54065       7.944726 63.25698       8.381680 73.26775 4.470979 71.32233 4.851347 1.945419       6.597365 
1 1 1 -9  10 39 o 41.46395 4.799590 21.64099       4.760206 18.17767       5.585588 30.83119       9.098825 37.50209 6.337493 48.42115 7.989459 -10.91905      10.19781 
1 1 1 -9  10 40 o 47.48371 3.868221 28.11082       4.437276 27.81472       5.971628 28.47587       6.630468 46.76035 5.335968 47.10233 5.905997 -0.3419838     7.959482 
1 1 1 -9  10 41 o 74.69297 3.239443 69.14854       5.882370 67.50366       8.072584 71.01072       8.589292 73.19994 4.547956 74.98750 4.724386 -1.787560      6.557723 
1 1 1 -9  10 42 o 55.47581 4.491077 39.15502       6.019551 37.41326       11.97680 39.74371       6.962895 50.20902 10.13829 55.49574 5.209575 -5.286720      11.39845 
1 1 1 -9  10 43 o 27.89424 6.002081 10.63856       3.958875 6.199113       5.394326 15.82087       5.828202 21.78130 7.892998 33.37333 7.364078 -11.59203      10.79486 
1 1 1 -9  10 44 o 25.51471 6.904852 9.447235       4.396883 0.9724355      6.535480 16.45495       5.942934 17.81574 7.823289 33.43792 7.480737 -15.62218      10.82429 
1 1 1 -9  10 45 o 13.14350 5.786859 0.2610954E-02  3.597650 -3.834232      4.562928 6.306931       5.848920 12.16613 5.763996 20.99471 8.090906 -8.828577      9.934103 
1 1 1 -9  10 46 o 42.31567 4.576166 24.23649       4.643893 26.48956       6.493471 21.87773       6.644030 42.24907 6.516296 37.16664 7.592559 5.082432       10.00545 
1 1 1 -9  10 47 o 17.29208 6.933819 4.046344       4.446746 2.738220       5.273778 7.263869       8.271006 16.63383 7.167931 20.82758 8.975877 -4.193754      11.48676 
1 1 1 -9  10 48 o 28.31186 6.377342 12.85087       4.293904 11.28663       6.047304 14.44145       6.098008 23.73558 8.384950 27.22553 8.375828 -3.489946      11.85166 
1 1 1 -9  10 49 o 11.33312 5.328332 -1.647109      3.764469 -3.858260      5.321063 0.5685374      5.326468 12.15457 5.879573 14.25237 6.577171 -2.097801      8.822049 
1 1 1 -9  10 50 o 23.72855 7.394784 11.20844       4.735565 16.85714       8.051322 8.220693       5.855516 24.10415 9.435618 19.21199 7.863719 4.892155       12.28287 
1 1 1 -9  11 1  f 135.5316 2.972451 223.8480       9.817286 189.2824       20.17494 234.5720       11.23747 124.4121 6.678954 138.7375 3.323829 -14.32541      7.460313 
1 1 1 -9  11 2  o 126.6565 2.334696 195.4794       7.205991 184.4874       10.10145 206.8691       10.28259 122.9915 3.373516 130.2885 3.238621 -7.296967      4.676460 
1 1 1 -9  11 3  o 703.8023 9.064348 6043.815       155.4617 6026.341       245.2978 6055.545       200.9785 702.0521 14.33799 704.1576 11.71234 -2.105469      18.51369 
1 1 1 -9  11 4  o 353.1316 5.360613 1520.166       46.13039 1545.716       66.23933 1496.104       64.28120 355.9977 7.635414 350.2426 7.531455 5.755096       10.72485 
1 1 1 -9  11 5  o 800.1556 10.27120 7815.146       200.2773 7599.318       310.4702 7968.966       262.1029 787.9822 16.16841 807.4965 13.31972 -19.51428      20.94833 
1 1 1 -9  11 6  o 147.6950 3.540792 265.8472       12.74390 253.5242       15.38251 292.8141       22.75542 144.1564 4.383914 154.8554 6.041666 -10.69896      7.464612 
1 1 1 -9  11 7  o 190.6124 3.396792 442.7890       15.77815 391.3100       30.48248 461.6292       18.44073 178.9941 7.001872 194.6192 3.888269 -15.62511      8.009048 
1 1 1 -9  11 8  o 117.7960 2.501468 169.0894       7.180616 167.1684       11.70005 170.2503       9.094916 117.0417 4.108517 118.1534 3.161599 -1.111710      5.184170 
1 1 1 -9  11 9  o 418.8620 6.231683 2139.256       63.60810 2085.579       88.77570 2195.884       91.18352 413.4241 8.811751 424.2155 8.820510 -10.79144      12.46789 
1 1 1 -9  11 10 o 590.2250 8.563182 4250.728       123.1655 4258.324       174.6829 4243.218       173.6859 590.3253 12.14292 589.2839 12.09494 1.041321       17.13879 
1 1 1 -9  11 11 o 417.4026 6.217367 2124.532       63.24086 2103.153       89.14645 2146.191       89.72857 415.1299 8.812190 419.3584 8.780299 -4.228455      12.43979 
1 1 1 -9  11 12 o 110.3679 3.168518 148.5750       8.513051 131.0459       15.20626 156.5768       10.27400 103.4885 6.056147 113.2816 3.726796 -9.793091      7.110971 
1 1 1 -9  11 13 o 645.4620 10.77588 5090.490       169.4960 5366.629       304.7610 4966.825       203.9480 660.5491 18.95254 637.1423 13.13551 23.40680       23.05950 
1 1 1 -9  11 14 o 598.4784 10.03920 4375.896       146.4143 4726.849       268.1769 4226.864       174.7583 620.0003 17.76812 587.8239 12.19985 32.17645       21.55325 
1 1 1 -9  11 15 o 269.4720 4.985986 885.4390       32.74166 980.2401       61.40622 847.7809       38.70216 283.1595 8.910171 263.6340 6.024177 19.52548       10.75555 
1 1 1 -9  11 16 o 110.4281 2.806042 148.7185       7.544977 147.3204       11.16187 149.8947       10.23828 109.8457 4.177438 110.8222 3.796697 -0.9764938     5.644989 
1 1 1 -9  11 17 o 311.8858 5.598328 1186.740       42.54906 1174.659       52.21904 1210.605       73.39645 310.1902 6.908198 314.4715 9.588824 -4.281311      11.81815 
1 1 1 -9  11 18 o 278.8686 5.113248 948.7533       34.74823 975.4417       43.70872 902.9153       57.28211 282.6675 6.345357 271.5916 8.666082 11.07590       10.74079 
1 1 1 -9  11 19 o 323.2182 5.002325 1274.714       39.40069 1253.547       55.44497 1296.307       56.00116 320.2932 7.103598 325.7166 7.055392 -5.423370      10.01198 
1 1 1 -9  11 20 o 97.90072 2.768381 116.9353       6.597990 122.1999       9.787832 112.5506       8.932632 100.0112 4.024293 95.98773 3.826474 4.023453       5.553092 
1 1 1 -9  11 21 o 297.3617 4.681895 1079.251       33.92680 1094.453       48.76433 1064.990       47.23183 299.1814 6.688543 295.1455 6.566932 4.035889       9.373431 
1 1 1 -9  11 22 o 150.6471 3.063120 276.7567       11.24504 296.7108       16.74102 260.3521       15.17922 155.8499 4.412419 145.9932 4.271178 9.856628       6.141043 
1 1 1 -9  11 23 o 174.5224 3.282774 371.5280       13.96138 368.1120       20.01301 374.7665       19.48627 173.5498 4.736509 175.1310 4.569839 -1.581146      6.581637 
1 1 1 -9  11 24 o 130.4970 3.290192 207.8829       10.45470 210.6445       17.84398 206.4395       12.90087 131.1312 5.596926 129.9777 4.078042 1.153458       6.925027 
1 1 1 -9  11 25 o 152.7245 3.673049 284.6818       13.67010 271.1227       16.37400 315.8723       24.83429 148.9106 4.517473 160.4779 6.363003 -11.56729      7.803549 
1 1 1 -9  11 26 o 216.6721 3.763050 573.1570       19.86914 559.1785       28.05756 587.2189       28.14105 213.7237 5.391480 219.1052 5.270497 -5.381546      7.539642 
1 1 1 -9  11 27 o 135.4294 3.008924 223.7930       9.930247 215.9489       14.10956 231.4918       13.97834 132.8602 4.363874 137.5865 4.173939 -4.726334      6.038639 
1 1 1 -9  11 28 o 203.9886 4.262884 508.6166       21.19071 503.4664       25.83296 519.2111       37.05078 202.7245 5.233534 205.3165 7.417399 -2.591965      9.077868 
1 1 1 -9  11 29 f 159.2907 3.708664 309.9802       14.39607 298.7252       17.70083 331.9704       24.74207 156.1850 4.655895 164.3437 6.189044 -8.158676      7.744780 
1 1 1 -9  11 30 f 231.8706 4.628404 658.0806       26.15249 705.9150       48.93108 638.9515       30.94297 238.7552 8.423192 228.2448 5.563203 10.51038       10.09452 
1 1 1 -9  11 31 o 89.34305 3.027999 97.57921       6.583010 98.15614       9.411192 97.02650       9.211580 89.45415 4.330120 88.94598 4.262235 0.5081635      6.075902 
1 1 1 -9  11 32 o 59.40627 3.357344 43.26405       4.840531 37.06460       6.782040 49.70126       6.910867 54.72751 5.145700 63.54315 4.491959 -8.815643      6.830514 
1 1 1 -9  11 33 o 47.39447 3.856502 27.66970       4.415612 19.99028       6.022662 36.59561       6.493074 39.77354 6.433346 54.38522 4.953600 -14.61169      8.119489 
1 1 1 -9  11 34 o 44.12864 4.015829 24.05110       4.271233 28.59099       6.222980 20.00741       5.873066 47.90499 5.426104 39.79605 6.262763 8.108948       8.286423 
1 1 1 -9  11 35 o 109.3344 3.138846 146.3436       8.354364 157.1796       12.25564 136.9374       11.41845 113.0461 4.457553 105.5057 4.451145 7.540390       6.299403 
1 1 1 -9  11 36 o 43.82892 5.137524 24.01197       5.383171 37.45076       11.97142 20.60591       6.026867 53.58971 9.515574 40.27739 6.350494 13.31232       11.44006 
1 1 1 -9  11 37 o 93.15662 3.649483 106.7288       8.268754 109.8289       10.14489 100.5933       14.27202 94.29726 4.427171 89.49870 6.590055 4.798561       7.939059 
1 1 1 -9  11 38 o 62.92717 3.312562 48.77530       5.061812 45.35412       6.963610 52.60816       7.370691 60.31912 4.776399 65.01752 4.683403 -4.698402      6.689414 
1 1 1 -9  11 39 o 82.49414 3.141874 83.82258       6.304540 88.62792       8.927423 79.04182       8.904552 84.41523 4.354512 79.60876 4.609742 4.806473       6.341254 
1 1 1 -9  11 40 o 66.57070 3.273777 54.83661       5.294614 54.04684       7.375794 55.67620       7.604891 65.58407 4.645084 66.53693 4.720888 -0.9528656     6.622959 
1 1 1 -9  11 41 o 42.21614 4.056359 22.46885       4.121728 21.86648       5.770016 23.09649       5.889838 40.86926 5.969674 42.04884 5.910910 -1.179588      8.400945 
1 1 1 -9  11 42 o 23.37270 7.384901 7.472215       4.706764 3.173037       8.649899 9.280599       5.610010 21.92564 9.306621 25.71297 8.053965 -3.787333      12.30770 
1 1 1 -9  11 43 o 26.25684 6.212236 9.573919       3.912426 4.836465       5.337183 15.07659       5.752097 20.18641 7.741868 32.36092 7.448556 -12.17451      10.74325 
1 1 1 -9  11 44 f 16.37785 6.540319 2.663131       3.939766 -0.9397859     5.848917 5.655608       5.330448 15.75134 7.123438 20.56900 7.772879 -4.817658      10.54329 
1 1 1 -9  11 45 o 15.86375 6.303502 2.736741       3.641744 6.364321       4.731974 -2.533123      5.703395 20.66802 7.405037 14.34624 6.684034 6.321778       9.975514 
1 1 1 -9  11 46 o 13.66659 5.968933 0.6345313      3.759047 -1.423414      5.096752 3.089247       5.566436 13.94591 6.435044 17.44043 7.436471 -3.494516      9.834169 
1 1 1 -9  11 47 o 17.26388 7.386752 3.575114       5.526510 3.575114       5.526510 0.000000       0.000000 17.26388 7.386752 ?        ?        0.000000       7.386752 
1 1 1 -9  11 48 o 12.10837 5.571447 -0.7546480     3.782621 1.335184       5.457500 -2.686777      5.247544 15.14708 6.862505 12.81487 6.102801 2.332211       9.183580 
1 1 1 -9  11 49 o 11.93952 5.536027 -0.7509810     3.840209 3.123377       5.685734 -4.000968      5.207478 15.89650 7.120006 11.91943 5.777891 3.977068       9.169434 
1 1 1 -9  11 50 o 10.05911 4.874545 -3.513197      3.698777 -3.451433      5.410874 -3.567375      5.067695 12.10222 5.871931 11.71747 5.684649 0.3847475      8.172809 
1 1 1 -9  12 1  o 597.1880 7.079419 4349.406       103.0255 4207.287       142.6053 4504.567       149.0055 587.0838 9.967804 607.4600 10.06581 -20.37622      14.16607 
1 1 1 -9  12 2  o 454.2397 6.004906 2515.721       66.47026 2503.483       85.67514 2534.227       105.3530 453.0334 7.760478 455.6828 9.487423 -2.649323      12.25709 
1 1 1 -9  12 3  o 189.6049 3.392306 438.1232       15.67403 385.4329       28.97507 459.9200       18.63614 177.6583 6.704755 194.2571 3.936798 -16.59879      7.775096 
1 1 1 -9  12 4  o 258.7896 3.757763 816.2281       23.69804 845.3723       38.51944 798.4791       30.06017 263.3166 6.002962 255.9392 4.819685 7.377457       7.698371 
1 1 1 -9  12 5  o 583.3269 8.488422 4151.503       120.6633 4078.283       168.5797 4228.421       172.7852 577.7818 11.97307 588.3106 12.05213 -10.52881      16.98847 
1 1 1 -9  12 6  o 272.0767 3.895541 902.2185       25.82826 915.4033       41.43089 893.8371       33.03276 273.9979 6.204989 270.7850 5.005924 3.212891       7.972526 
1 1 1 -9  12 7  o 226.4405 3.415916 624.9011       18.84939 642.1445       30.58853 614.3445       23.93359 229.5034 5.469320 224.5037 4.374700 4.999710       7.003675 
1 1 1 -9  12 8  o 330.0099 5.073720 1327.641       40.80276 1353.505       83.24341 1319.462       46.81195 332.7890 10.27698 328.9646 5.839442 3.824371       11.82013 
1 1 1 -9  12 9  o 925.5412 13.24959 10475.23       298.8370 10853.41       433.3862 10132.43       412.6170 940.3460 18.91260 908.6731 18.63388 31.67291       26.55011 
1 1 1 -9  12 10 o 555.2923 8.090850 3762.407       109.4843 3806.911       156.4585 3719.706       153.2595 558.1627 11.50276 551.7469 11.39859 6.415771       16.19387 
1 1 1 -9  12 11 o 490.2694 7.206774 2932.223       86.10172 2857.818       120.0878 3010.939       123.5171 483.7195 10.18753 496.5068 10.20859 -12.78729      14.42224 
1 1 1 -9  12 12 o 247.2769 4.667492 745.4338       28.12570 718.6747       48.51102 758.9833       34.51966 242.5213 8.220203 249.4817 5.677952 -6.960403      9.990540 
1 1 1 -9  12 13 o 510.2279 8.639017 3178.527       107.4149 3368.020       194.3857 3095.230       128.8790 523.8657 15.24299 503.2505 10.50901 20.61523       18.51454 
1 1 1 -9  12 14 o 382.3183 6.657936 1783.407       62.02987 1963.466       115.4245 1710.287       73.55408 400.3900 11.84285 374.2793 8.064451 26.11066       14.32789 
1 1 1 -9  12 15 o 35.36824 4.293723 15.47570       3.624986 11.82016       5.864457 17.73606       4.611487 30.53774 7.840714 37.78926 5.140859 -7.251516      9.375778 
1 1 1 -9  12 16 o 347.1085 5.315879 1469.740       44.96519 1499.440       64.76999 1442.108       62.47298 350.3878 7.585579 343.6371 7.460296 6.750702       10.63941 
1 1 1 -9  12 17 o 404.1655 7.001253 1994.993       68.95585 1965.735       84.09141 2055.051       120.4788 400.9513 8.606447 409.0800 12.09884 -8.128723      14.84766 
1 1 1 -9  12 18 o 380.8552 6.652797 1771.703       61.74477 1692.525       73.79106 1956.587       112.7588 372.0212 8.139541 399.0715 11.60714 -27.05023      14.17666 
1 1 1 -9  12 19 f 191.4432 3.443697 446.9083       16.06575 448.0987       23.09061 445.7914       22.36744 191.5562 4.950709 191.0743 4.807541 0.4818878      6.900867 
1 1 1 -9  12 20 o 312.0839 4.872418 1188.856       37.05544 1190.427       52.81056 1187.332       52.00728 312.0011 6.945901 311.6109 6.848814 0.3901672      9.754579 
1 1 1 -9  12 21 o 70.22290 2.829093 60.22416       4.831391 65.53291       7.356444 56.19755       6.406806 73.16592 4.142868 67.75686 3.896617 5.409065       5.687441 
1 1 1 -9  12 22 o 168.9987 3.250465 348.3602       13.38643 341.0976       19.19117 355.2423       18.68166 167.0646 4.718633 170.5189 4.499730 -3.454346      6.520205 
1 1 1 -9  12 23 o 295.1778 4.674575 1064.196       33.62497 1049.700       47.57752 1078.662       47.52829 292.7956 6.668086 296.8284 6.570685 -4.032806      9.361479 
1 1 1 -9  12 24 o 26.62288 7.000778 9.001392       4.601429 9.104992       5.684700 8.804535       7.836205 27.05580 8.037198 27.92543 9.563865 -0.8696289     12.49256 
1 1 1 -9  12 25 o 250.9169 4.150671 768.8866       25.37958 778.7173       36.52622 759.7100       35.28999 252.2127 5.942945 249.1410 5.812598 3.071747       8.312935 
1 1 1 -9  12 26 o 83.78384 2.887195 85.73947       5.886038 83.56849       8.587727 87.66294       8.083377 82.59367 4.281346 84.63306 3.930104 -2.039398      5.811682 
1 1 1 -9  12 27 o 265.1637 4.347159 859.3726       28.09026 828.4283       39.25424 891.8494       40.21441 259.9308 6.197161 269.7183 6.118362 -9.787506      8.708569 
1 1 1 -9  12 28 o 129.4759 3.439995 204.8453       10.84421 203.7804       13.72970 206.6113       17.68120 129.0252 4.372991 129.7279 5.606201 -0.7027130     7.110031 
1 1 1 -9  12 29 o 70.41949 3.071875 60.65081       5.258798 60.20147       7.692644 61.04503       7.205375 70.00154 4.533926 70.53178 4.211315 -0.5302429     6.188025 
1 1 1 -9  12 30 o 119.3095 3.548903 174.0823       10.30676 192.1743       20.45461 167.9256       11.93229 124.7772 6.752128 117.0937 4.188458 7.683548       7.945717 
1 1 1 -9  12 31 o 92.34375 2.998160 104.2402       6.737867 106.6456       9.730309 102.0243       9.339280 93.24647 4.293638 91.21072 4.213142 2.035751       6.015471 
1 1 1 -9  12 32 o 109.6164 3.056621 146.8974       8.156971 154.8733       12.00575 140.0588       11.11686 112.3574 4.393286 106.8594 4.277716 5.498024       6.131869 
1 1 1 -9  12 33 o 26.78584 6.220773 9.198741       3.982579 8.959349       5.762750 9.417607       5.510171 26.74529 8.125909 27.23046 7.865035 -0.4851723     11.30881 
1 1 1 -9  12 34 o 78.41196 3.434519 75.37421       6.546806 74.26285       10.62970 76.05343       8.309964 77.42422 5.673269 78.62064 4.354377 -1.196419      7.151684 
1 1 1 -9  12 35 f 72.83573 4.063430 65.29554       7.183703 68.84889       14.64750 64.17016       8.243150 73.66312 8.304311 72.07697 4.719063 1.586143       9.551499 
1 1 1 -9  12 36 o 55.34685 3.666614 37.74496       4.917439 44.19368       7.000051 31.46208       6.909451 59.67212 4.855796 50.07273 5.767722 9.599396       7.539587 
1 1 1 -9  12 37 o 38.77878 5.346789 18.99042       4.918367 21.05794       5.885886 14.20592       8.953764 40.66222 6.130341 32.90971 10.15372 7.752510       11.86082 
1 1 1 -9  12 38 o 79.88010 3.591954 78.72917       6.974178 79.72509       8.635422 76.86114       11.82671 80.12274 4.440105 77.93567 6.280324 2.187073       7.691360 
1 1 1 -9  12 39 o 70.05003 3.255627 60.57807       5.542295 62.32399       7.880345 58.86920       7.796309 70.60004 4.605549 68.57352 4.693786 2.026527       6.575919 
1 1 1 -9  12 40 o 45.68992 3.958598 26.15568       4.364113 27.59915       6.243780 24.77692       6.102230 46.30734 5.649850 43.75217 5.871461 2.555164       8.148305 
1 1 1 -9  12 41 f 58.94771 3.627800 43.45931       5.186058 48.77680       7.537338 38.67881       7.146636 61.73511 5.054347 54.72962 5.430024 7.005486       7.418327 
1 1 1 -9  12 42 o 43.04999 4.210464 23.66923       4.360708 23.06629       6.040807 24.32531       6.301389 41.45024 6.168065 42.52142 6.269107 -1.071182      8.794699 
1 1 1 -9  12 43 o 16.92743 6.531246 3.087233       3.814563 1.160910       5.785013 4.569072       5.073883 17.31302 7.484171 19.61257 7.541649 -2.299549      10.62494 
1 1 1 -9  12 44 o 18.04267 6.337514 4.371424       3.450957 2.866734       4.723335 6.094324       5.054231 17.24424 7.060994 20.77983 7.623218 -3.535597      10.39091 
1 1 1 -9  12 45 f 11.83150 5.439174 -1.548927      3.593913 -6.465741      4.986611 3.765400       5.184272 11.53781 5.607080 18.02906 7.391645 -6.491249      9.277703 
1 1 1 -9  12 46 o 23.39525 6.649210 8.581258       3.968998 10.96846       5.611969 6.192278       5.614053 25.12518 8.077917 19.96577 7.859999 5.159405       11.27086 
1 1 1 -9  12 47 o 21.85988 8.069631 8.846238       5.678115 8.846238       5.678115 0.000000       0.000000 21.85988 8.069631 ?        ?        0.000000       8.069631 
1 1 1 -9  12 48 o 17.60915 6.707415 5.157989       3.988312 3.801182       5.692321 6.466331       5.589729 16.71885 7.322567 18.78080 7.684731 -2.061945      10.61485 
1 1 1 -9  12 49 o 13.95868 6.095435 1.948506       3.918584 2.220933       5.884938 1.731504       5.252295 15.33361 7.015982 14.70409 6.689510 0.6295242      9.693995 
1 1 1 -9  13 1  o 182.0406 2.978556 403.8510       13.21327 384.9412       20.26744 417.8298       17.42564 177.6422 4.685934 185.1529 3.862087 -7.510757      6.072371 
1 1 1 -9  13 2  o 517.4064 6.784979 3264.921       85.54929 3279.425       111.1059 3243.799       134.0755 518.3909 8.795157 515.3774 10.67549 3.013428       13.83188 
1 1 1 -9  13 3  o 436.7310 5.802894 2325.561       61.75822 2327.043       79.95811 2323.369       97.23283 436.7704 7.512305 436.3064 9.145032 0.4639893      11.83496 
1 1 1 -9  13 4  o 96.85290 2.559298 114.3909       6.035160 116.7037       9.907902 113.0266       7.609838 97.76184 4.168447 96.24849 3.249140 1.513351       5.285154 
1 1 1 -9  13 5  o 148.3996 3.137893 268.3852       11.34768 269.1607       16.12926 267.6252       15.96803 148.5317 4.461200 148.1084 4.429184 0.4232483      6.286491 
1 1 1 -9  13 6  o 621.6168 9.011432 4716.108       136.5063 4902.393       198.3748 4548.567       188.1304 633.2229 12.85565 609.9759 12.65640 23.24701       18.04029 
1 1 1 -9  13 7  o 416.3053 5.563012 2113.085       56.43623 2128.109       89.91171 2103.317       72.49657 417.5726 8.835845 415.2516 7.164240 2.321075       11.37535 
1 1 1 -9  13 8  o 250.5141 3.675566 764.8930       22.43844 755.7324       35.63375 770.9119       28.88419 248.9516 5.873684 251.4736 4.713372 -2.521988      7.531005 
1 1 1 -9  13 9  o 290.7166 4.112222 1030.188       29.13281 1045.700       46.88023 1020.429       37.18437 292.8078 6.570086 289.2996 5.274441 3.508179       8.425304 
1 1 1 -9  13 10 o 285.4049 4.519936 992.9952       31.43618 1076.450       66.74958 969.2090       35.63562 296.7764 9.240866 281.9435 5.186641 14.83295       10.59693 
1 1 1 -9  13 11 o 380.2345 6.627632 1763.664       61.41098 1813.337       109.1244 1740.641       74.29172 384.9096 11.64734 377.6382 8.072879 7.271454       14.17152 
1 1 1 -9  13 12 o 761.2156 15.53000 7109.809       288.0815 0.000000       0.000000 7109.809       288.0815 ?        ?        761.2156 15.53000 0.000000       15.53000 
1 1 1 -9  13 13 o 211.8213 4.234563 547.0140       21.85820 591.1177       40.56348 528.9670       25.94776 219.9241 7.580118 208.2701 5.112542 11.65401       9.143100 
1 1 1 -9  13 14 o 108.3628 2.863845 143.2188       7.555877 141.9665       11.23529 144.2529       10.20947 107.8205 4.284621 108.7094 3.860021 -0.8888855     5.766952 
1 1 1 -9  13 15 o 55.13722 3.343557 37.19566       4.471401 39.16888       7.174535 35.94247       5.717635 56.41917 5.279645 54.11482 4.372967 2.304352       6.855472 
1 1 1 -9  13 16 o 254.6667 4.171387 790.8900       25.88741 786.7072       36.94178 794.9260       36.28765 253.8803 5.971078 255.2129 5.834722 -1.332626      8.348518 
1 1 1 -9  13 17 o 376.0321 6.580916 1727.036       60.30418 1751.554       74.96400 1682.075       101.5168 378.4528 8.128398 370.0786 11.26975 8.374237       13.89526 
1 1 1 -9  13 18 o 224.0875 3.816314 612.4160       20.84001 626.5856       30.23507 599.5913       28.76434 226.5532 5.476520 221.6309 5.325839 4.922333       7.639164 
1 1 1 -9  13 19 o 194.4982 3.502257 461.3538       16.59968 466.7286       24.06076 456.4719       22.93097 195.4663 5.055522 193.3230 4.871345 2.143326       7.020564 
1 1 1 -9  13 20 o 61.71706 3.357496 46.59239       5.030582 50.31190       7.018664 42.66297       7.213991 64.04366 4.526360 58.89098 5.076288 5.152687       6.801223 
1 1 1 -9  13 21 o 25.95216 5.322329 8.530015       3.252923 2.436429       4.967452 13.10494       4.304169 18.78627 7.394170 32.27486 5.679861 -13.48859      9.323872 
1 1 1 -9  13 22 o 167.5889 3.242387 342.5999       13.24177 334.1461       18.92443 350.7092       18.53502 165.3391 4.701674 169.4135 4.493581 -4.074387      6.503692 
1 1 1 -9  13 23 o 128.8002 4.172422 202.7577       13.07878 194.9594       17.48004 212.6758       19.71302 126.1260 5.701986 131.6812 6.160253 -5.555199      8.394127 
1 1 1 -9  13 24 o 190.9203 4.102137 445.0903       19.08527 466.1938       23.89557 407.9107       31.71702 195.2244 5.026996 182.2338 7.156035 12.99063       8.745257 
1 1 1 -9  13 25 o 63.84010 3.096891 49.84332       4.803502 43.08888       6.922228 56.11654       6.671086 59.17210 4.842900 67.66313 4.064575 -8.491028      6.322535 
1 1 1 -9  13 26 o 177.0609 3.383685 382.6823       14.59986 376.8438       20.93618 388.2094       20.37010 175.4632 4.901184 178.1244 4.696916 -2.661270      6.788419 
1 1 1 -9  13 27 o 58.36332 3.201955 41.70269       4.536536 48.27037       6.953520 36.83564       5.985922 62.66031 4.585572 54.69956 4.531292 7.960754       6.446711 
1 1 1 -9  13 28 o 136.8596 3.523445 228.9191       11.74134 226.7438       14.86921 232.5220       19.13614 136.0780 4.490131 137.5925 5.719676 -1.514587      7.271586 
1 1 1 -9  13 29 o 115.5468 3.504125 163.2496       9.855336 152.0975       18.87427 167.4299       11.55578 110.9318 7.017944 116.9482 4.060963 -6.016373      8.108203 
1 1 1 -9  13 30 o 75.30694 3.688234 69.48375       6.747869 55.66687       13.32132 74.25267       7.826224 66.54590 8.401567 77.79964 4.142927 -11.25375      9.367506 
1 1 1 -9  13 31 o 30.75972 5.205782 11.92385       3.763099 11.51653       5.518193 12.27795       5.145032 29.94722 7.561327 30.94737 6.988138 -1.000154      10.29601 
1 1 1 -9  13 32 o 117.6703 3.073267 169.2932       8.805041 184.2846       13.13810 157.0693       11.86362 122.5543 4.406313 113.1484 4.310500 9.405807       6.164090 
1 1 1 -9  13 33 o 52.48375 3.764800 33.89235       4.783087 29.02816       6.768756 38.74378       6.759865 48.18674 5.886332 55.93663 5.012202 -7.749893      7.731175 
1 1 1 -9  13 34 o 147.0341 3.672876 264.7954       13.16014 269.5617       22.87529 262.4376       16.08931 147.4471 6.381516 146.1131 4.524137 1.333939       7.822504 
1 1 1 -9  13 35 o 32.31208 5.369989 13.22172       4.080029 11.28007       5.935868 14.96059       5.617362 29.50094 8.039226 34.06289 7.001441 -4.561949      10.66064 
1 1 1 -9  13 36 o 14.72132 6.137620 0.6363562      3.657066 2.135794       5.232199 -0.7958686     5.113585 18.61507 7.501443 15.98346 6.971659 2.631613       10.24088 
1 1 1 -9  13 37 o 15.94383 6.664055 0.7673718      4.327380 1.366910       5.097356 -0.7797357     8.188355 17.65817 7.293757 20.22767 8.822510 -2.569496      11.44708 
1 1 1 -9  13 38 o 28.90998 6.343048 10.93735       4.345657 7.358382       5.423617 17.35541       7.262932 24.20112 7.953057 35.93225 8.439207 -11.73114      11.59618 
1 1 1 -9  13 39 o 35.80581 4.537438 16.22780       3.870365 15.38839       5.562929 17.01534       5.388293 34.06071 6.938041 36.07135 6.362347 -2.010643      9.413601 
1 1 1 -9  13 40 o 117.1969 3.158335 169.9531       9.011858 178.7254       13.08631 162.0405       12.42851 119.2449 4.511545 113.5433 4.500725 5.701561       6.372642 
1 1 1 -9  13 41 o 63.33149 4.292626 50.79506       6.585744 48.24066       12.97672 51.68122       7.643185 57.69239 9.565029 63.47292 4.981280 -5.780537      10.78438 
1 1 1 -9  13 42 o 39.75065 4.425507 20.38871       4.214297 16.50026       5.638696 25.30942       6.343133 34.34191 6.976099 43.26965 6.191983 -8.927734      9.327733 
1 1 1 -9  13 43 o 24.16478 6.804361 8.426037       4.176124 8.550564       6.368420 8.332089       5.531484 24.02691 8.592650 23.75617 8.037015 0.2707329      11.76551 
1 1 1 -9  13 44 o 27.27005 6.203707 10.75958       4.029365 14.28350       5.508189 6.703129       5.909742 30.50053 7.470969 21.43040 8.164346 9.070139       11.06670 
1 1 1 -9  13 45 o 26.09381 6.185470 10.10735       3.872885 12.92485       5.847662 7.905825       5.169072 27.77898 8.125349 22.17365 7.758736 5.605330       11.23473 
1 1 1 -9  13 46 o 10.81822 5.198134 -4.104923      3.995203 2.303850       4.997935 -15.44867      6.649384 16.14974 6.968766 10.96417 5.515739 5.185571       8.887467 
1 1 1 -9  13 47 o 11.57363 5.436822 -2.038493      3.904904 -3.500253      5.415512 -0.4553875     5.635810 12.77890 6.116827 14.46472 6.706776 -1.685826      9.077247 
1 1 1 -9  13 48 o 14.34050 6.171545 2.159865       3.899620 13.67796       6.167922 -5.510233      5.033255 25.27969 8.486634 11.25251 5.504389 14.02717       10.11540 
1 1 1 -9  13 49 o 20.79684 6.914797 8.175217       4.096245 10.18605       5.963962 6.379529       5.635881 21.07458 8.157128 17.92935 7.556431 3.145224       11.11928 
1 1 1 -9  14 1  o 245.3012 4.078402 733.4539       24.37955 757.6230       34.67862 709.8363       34.28062 249.2640 5.709080 241.2710 5.830523 7.993057       8.160183 
1 1 1 -9  14 2  o 394.1725 5.319417 1894.348       51.09594 1957.729       82.66713 1855.164       64.99886 400.5135 8.469925 389.9922 6.839332 10.52130       10.88651 
1 1 1 -9  14 3  f 976.7885 12.50342 11666.78       297.6223 11392.13       462.8594 11860.39       388.6121 962.6809 19.73016 983.6718 16.21175 -20.99091      25.53625 
1 1 1 -9  14 4  o 267.6277 4.369800 873.0876       28.49894 878.6718       40.36750 867.5386       40.23998 268.4240 6.171268 266.7173 6.191139 1.706696       8.741553 
1 1 1 -9  14 5  o 844.8748 10.84495 8721.169       223.2832 8614.165       349.9833 8794.617       289.9590 837.9693 17.13890 847.6462 14.03737 -9.676880      22.15378 
1 1 1 -9  14 6  o 415.5641 6.217465 2106.105       62.96330 2060.444       88.12639 2153.717       89.98995 410.8457 8.802197 420.0429 8.791527 -9.197144      12.44064 
1 1 1 -9  14 7  o 127.9598 2.971933 199.5477       9.267201 195.8077       13.51042 202.8710       12.73549 126.6632 4.383665 128.9451 4.058035 -2.281937      5.973623 
1 1 1 -9  14 8  o 313.3060 5.629283 1197.004       42.97916 1166.070       73.79366 1212.884       52.87233 308.8209 9.818122 315.3143 6.880955 -6.493347      11.98929 
1 1 1 -9  14 9  o 455.0444 7.778046 2527.117       86.25024 2649.650       154.8019 2471.955       103.8657 464.9520 13.67743 449.8724 9.474289 15.07959       16.63833 
1 1 1 -9  14 10 o 236.5454 4.559402 682.1776       26.28201 655.7596       45.22009 695.6537       32.29704 231.6354 8.023180 238.8358 5.549160 -7.200333      9.755234 
1 1 1 -9  14 11 o 333.7612 7.244797 1359.564       58.92481 0.000000       0.000000 1359.564       58.92481 ?        ?        333.7612 7.244797 0.000000       7.244797 
1 1 1 -9  14 12 o 127.6352 2.996529 198.5565       9.320197 198.9095       13.75765 198.2570       12.67083 127.6482 4.429473 127.4564 4.084776 0.1917725      6.025415 
1 1 1 -9  14 13 o 233.4279 3.942533 664.3194       22.42665 665.2963       32.30874 663.4111       31.15486 233.5230 5.677462 233.2019 5.482234 0.3211212      7.892305 
1 1 1 -9  14 14 o 342.6008 5.274091 1431.921       44.03238 1437.558       62.92038 1426.510       61.64168 343.0553 7.526466 341.7487 7.401701 1.306610       10.55618 
1 1 1 -9  14 15 o 270.1407 4.366409 890.0219       28.74422 920.2260       41.93443 863.2532       39.47765 274.5473 6.267833 265.9271 6.091896 8.620178       8.740534 
1 1 1 -9  14 16 o 122.6308 3.383120 183.4925       10.10039 185.6976       13.05545 180.2048       15.94104 123.3096 4.351512 121.3926 5.402286 1.916946       6.936883 
1 1 1 -9  14 17 o 194.3650 3.510006 460.6700       16.62501 470.2438       24.26046 452.1937       22.82755 196.2231 5.077827 192.4358 4.871768 3.787277       7.036935 
1 1 1 -9  14 18 o 400.4046 6.036100 1958.779       58.89678 2006.007       85.00671 1915.177       81.67822 404.6317 8.620990 395.4013 8.476804 9.230469       12.09040 
1 1 1 -9  14 19 o 107.4264 2.877442 140.8137       7.525969 139.4237       11.10309 141.9952       10.23633 106.8026 4.274686 107.8125 3.902617 -1.009949      5.788209 
1 1 1 -9  14 20 o 257.4673 4.225982 809.0820       26.51464 815.1444       38.08694 803.3810       36.93436 258.1983 6.053221 256.3491 5.912383 1.849213       8.461546 
1 1 1 -9  14 21 o 86.91224 3.216326 92.26456       6.800288 92.55663       9.070689 91.88972       10.27577 86.96669 4.293346 86.59586 4.889326 0.3708267      6.506791 
1 1 1 -9  14 22 o 138.9639 3.629739 235.8102       12.28122 226.9220       14.80883 255.3884       21.97874 136.2405 4.466484 144.3169 6.264483 -8.076401      7.693714 
1 1 1 -9  14 23 o 65.72607 4.451711 53.00667       7.088111 52.63124       9.191885 53.55740       11.13290 65.32710 5.835354 65.72283 7.061787 -0.3957291     9.160796 
1 1 1 -9  14 24 o 181.1657 4.033706 400.8110       17.80805 433.7468       22.56503 346.4260       28.99617 188.2948 4.921915 167.8822 7.103664 20.41252       8.642180 
1 1 1 -9  14 25 o 332.7988 5.195860 1355.083       42.13813 1266.875       57.61225 1456.552       61.79166 321.1179 7.362313 344.3180 7.364345 -23.20010      10.41332 
1 1 1 -9  14 26 o 126.9393 3.011240 196.6364       9.314886 193.9822       13.59571 198.9845       12.78785 125.8892 4.438715 127.5439 4.119760 -1.654686      6.055957 
1 1 1 -9  14 27 o 119.7011 3.402934 175.0991       9.916235 173.0234       12.70445 178.3352       15.86305 118.8720 4.393271 120.5332 5.414444 -1.661217      6.972592 
1 1 1 -9  14 28 o 297.0756 4.757413 1080.297       34.44086 1075.345       49.04578 1085.115       48.37463 295.6824 6.806755 297.0731 6.682181 -1.390656      9.538525 
1 1 1 -9  14 29 o 158.1008 3.831800 305.5641       14.76295 338.2479       28.88479 294.0076       17.17575 165.5112 7.178599 154.9115 4.554785 10.59973       8.501668 
1 1 1 -9  14 30 o 53.90763 3.595410 35.67812       4.696185 31.50510       6.832839 39.41419       6.465217 50.33948 5.668438 56.52345 4.737272 -6.183971      7.387349 
1 1 1 -9  14 31 o 29.31856 5.635166 10.91456       3.879872 13.25249       5.792375 9.012007       5.225277 32.09830 7.535104 26.66478 7.645874 5.433519       10.73486 
1 1 1 -9  14 32 o 107.9984 3.048549 142.6464       8.015155 148.2638       12.00180 138.1243       10.76851 109.8690 4.492126 106.0980 4.173114 3.771004       6.131402 
1 1 1 -9  14 33 o 80.35561 3.522421 79.17227       6.880770 74.43235       11.47456 81.83369       8.598178 77.40971 6.132898 81.56639 4.341364 -4.156685      7.513979 
1 1 1 -9  14 34 o 78.16882 3.234457 74.90876       6.147972 67.27866       8.856282 82.00586       8.541357 73.76278 4.955706 81.60600 4.310340 -7.843224      6.567956 
1 1 1 -9  14 35 o 81.60071 3.174234 81.66955       6.299989 81.91161       9.124133 81.44898       8.709391 81.42461 4.617249 81.24135 4.415809 0.1832581      6.388925 
1 1 1 -9  14 36 o 76.08642 3.840397 71.36931       7.097620 67.74953       8.459610 79.97530       13.04397 73.90537 4.721889 79.60452 6.788853 -5.699150      8.269507 
1 1 1 -9  14 37 o 107.6819 3.564484 142.8716       9.340638 140.5124       11.55352 147.3234       15.87081 106.4529 4.463605 108.2359 6.041131 -1.783012      7.511261 
1 1 1 -9  14 38 o 40.46231 4.166519 20.49956       4.049620 22.09999       5.760716 18.93603       5.693924 41.51210 5.857216 38.20903 6.337104 3.303078       8.629361 
1 1 1 -9  14 39 o 41.31654 4.223280 21.48320       4.192412 23.57487       6.155698 19.67363       5.725573 42.60655 6.102833 38.79173 6.270638 3.814819       8.750170 
1 1 1 -9  14 40 o 37.25848 4.643028 17.75390       4.124407 23.02363       5.926696 12.80542       5.743216 41.90868 5.972040 30.38910 7.736406 11.51959       9.773293 
1 1 1 -9  14 41 o 44.96087 5.069526 26.23099       5.457688 23.52106       10.83276 27.15283       6.318138 38.47311 11.00155 45.30583 5.859787 -6.832722      12.46480 
1 1 1 -9  14 42 o 38.80046 4.663321 19.64642       4.321018 18.73609       5.897839 20.70126       6.348726 36.53801 6.876143 38.31783 7.059098 -1.779816      9.854552 
1 1 1 -9  14 43 f 14.80812 6.148285 1.527464       3.648009 0.9950778      5.064828 2.101401       5.258764 16.10545 6.982414 17.19069 7.274885 -1.085243      10.08355 
1 1 1 -9  14 44 o 17.28710 6.551243 3.830514       3.792883 1.904484       5.107789 6.197986       5.662963 16.50667 7.082852 20.66774 7.962207 -4.161074      10.65662 
1 1 1 -9  14 45 o 20.79770 6.681945 6.665101       3.840387 6.082870       5.493092 7.221781       5.371212 20.02960 7.807294 21.18396 7.843393 -1.154362      11.06674 
1 1 1 -9  14 46 o 28.92049 6.859579 13.46089       4.760800 10.15080       5.898681 19.64627       8.063406 23.40635 8.280112 30.83622 9.655349 -7.429869      12.71951 
1 1 1 -9  14 47 o 15.78312 6.704230 3.041881       4.494324 9.950549       5.824036 -7.128913      7.066499 22.33968 8.185199 13.05312 6.413161 9.286559       10.39837 
1 1 1 -9  14 48 o 12.05446 5.553516 -0.5058810     3.774718 1.997617       6.008980 -2.137726      4.851395 15.45535 7.078386 12.38081 5.888103 3.074531       9.207242 
1 1 1 -9  14 49 o 10.87078 5.176320 -2.167574      3.772775 -2.154700      6.032128 -2.175847      4.835238 13.19359 6.351706 12.11786 5.794852 1.075721       8.597935 
1 1 1 -9  15 1  o 576.2766 8.388790 4054.159       117.8057 3923.545       162.9467 4197.189       170.5159 566.3858 11.80584 585.7776 11.94527 -19.39185      16.79486 
1 1 1 -9  15 2  o 242.0830 4.000074 714.3671       23.59764 708.2618       33.24094 720.5696       33.50481 240.9945 5.660178 243.0796 5.656172 -2.085052      8.001868 
1 1 1 -9  15 3  o 316.2716 5.694373 1219.840       43.88763 1210.107       53.30001 1240.333       77.34179 314.9409 6.944839 318.4769 9.977835 -3.536072      12.15681 
1 1 1 -9  15 4  o 353.0677 6.230608 1520.462       53.60737 1514.513       65.39211 1532.651       93.60892 352.2855 7.617186 353.9381 10.86597 -1.652679      13.26992 
1 1 1 -9  15 5  o 373.8579 6.530682 1705.006       59.49784 1735.986       104.3271 1690.073       72.43151 376.6223 11.38029 372.1096 7.987679 4.512695       13.90375 
1 1 1 -9  15 6  o 372.3659 6.514447 1691.468       59.11307 1664.757       101.5621 1705.153       72.69537 368.7996 11.31408 373.7575 7.981430 -4.957916      13.84600 
1 1 1 -9  15 7  o 175.2323 3.819111 374.2995       16.30844 374.5319       28.56069 374.1871       19.86550 175.0812 6.706513 175.1260 4.659067 -0.4473877E-01 8.166040 
1 1 1 -9  15 8  o 140.3698 3.041253 240.1470       10.40309 221.2101       20.27352 246.9155       12.12048 134.5190 6.201254 142.3277 3.494574 -7.808746      7.118118 
1 1 1 -9  15 9  o 210.8987 3.316145 542.1396       17.04291 518.2975       26.78276 558.3633       22.09319 206.0810 5.337612 214.0067 4.236382 -7.925629      6.814472 
1 1 1 -9  15 10 o 371.7489 5.060214 1685.389       45.84106 1575.027       69.80424 1769.076       60.78553 359.1294 7.976177 380.7496 6.551258 -21.62021      10.32174 
1 1 1 -9  15 11 o 181.4665 3.378549 401.4135       14.94042 410.5515       31.21767 398.6986       17.01567 183.2536 7.003452 180.8396 3.861174 2.413971       7.997312 
1 1 1 -9  15 12 o 79.05016 2.953836 76.27454       5.680161 70.07310       12.57652 77.86372       6.366495 75.44351 6.917655 79.85445 3.278610 -4.410934      7.655275 
1 1 1 -9  15 13 o 145.3017 3.113822 257.3642       11.02556 256.0020       16.11954 258.5617       15.11397 144.8059 4.573780 145.5475 4.265858 -0.7415924     6.254359 
1 1 1 -9  15 14 o 286.7427 4.581694 1002.940       32.01508 1043.697       46.87096 967.2933       43.83380 292.3382 6.579339 281.4527 6.390981 10.88547       9.172368 
1 1 1 -9  15 15 o 318.9242 4.991891 1241.153       38.79615 1214.457       54.54826 1268.480       55.18945 315.2367 7.100814 322.1815 7.029419 -6.944794      9.991711 
1 1 1 -9  15 16 o 181.9885 3.930538 403.9667       17.43139 403.1230       21.90698 405.4229       28.77937 181.6757 4.952846 182.0375 6.498029 -0.3617554     8.170378 
1 1 1 -9  15 17 o 427.0858 7.372105 2231.699       76.72603 2274.525       134.8677 2211.207       93.29437 429.1477 12.91098 424.6858 9.014707 4.461914       15.74670 
1 1 1 -9  15 18 o 113.4783 2.920805 157.1221       8.070312 157.8003       12.02437 156.5662       10.88656 113.6269 4.350591 113.2116 3.952120 0.4152679      5.877660 
1 1 1 -9  15 19 o 264.5225 4.321042 854.0984       27.85398 860.2523       40.02107 848.3171       38.79070 265.2243 6.192118 263.4009 6.043301 1.823395       8.652388 
1 1 1 -9  15 20 o 322.4919 5.040787 1270.583       39.61442 1282.106       56.78260 1259.656       55.29358 323.5022 7.202810 320.6879 7.075482 2.814270       10.09668 
1 1 1 -9  15 21 o 229.4232 3.917364 642.4501       21.90117 611.9971       30.63803 674.2721       31.31907 223.6425 5.626204 234.8415 5.472652 -11.19901      7.848827 
1 1 1 -9  15 22 o 105.0285 5.600123 135.3066       14.28131 135.3066       14.28131 0.000000       0.000000 105.0285 5.600123 ?        ?        0.000000       5.600123 
1 1 1 -9  15 23 o 174.0555 3.979689 369.9277       16.88002 360.8945       20.39131 389.5951       30.08828 171.7561 4.876820 178.0982 6.946008 -6.342117      8.487072 
1 1 1 -9  15 24 o 122.3991 2.975546 182.7844       8.875257 174.1705       12.91374 190.4953       12.21815 119.3003 4.449755 124.8215 4.022048 -5.521202      5.998099 
1 1 1 -9  15 25 o 292.6858 4.695240 1047.553       33.48849 1026.488       47.27141 1068.777       47.44883 289.1865 6.707868 295.1185 6.597706 -5.932068      9.408784 
1 1 1 -9  15 26 o 69.17697 3.061551 58.52029       5.148279 64.00927       7.896587 54.46230       6.789675 72.20874 4.510114 66.61957 4.203694 5.589172       6.165401 
1 1 1 -9  15 27 o 241.0760 4.701932 711.2158       27.62272 725.6725       34.87443 686.8767       45.25048 243.2155 5.884097 235.8640 7.883813 7.351563       9.837536 
1 1 1 -9  15 28 o 61.88821 3.839726 46.99559       5.762355 34.78610       12.43460 50.33466       6.502741 52.00465 10.17646 64.01607 4.191474 -12.01142      11.00585 
1 1 1 -9  15 29 o 80.98373 3.652148 80.32300       7.188913 82.37309       15.30104 79.74226       8.143715 81.27875 7.821629 80.62830 4.158809 0.6504517      8.858531 
1 1 1 -9  15 30 o 57.11776 3.471987 40.02308       4.809824 39.27162       7.078002 40.66782       6.556170 56.33517 5.214971 57.41291 4.727884 -1.077744      7.039092 
1 1 1 -9  15 31 o 132.6480 3.154385 215.0284       10.19651 218.9041       15.12202 211.7971       13.80755 133.5262 4.654489 131.4081 4.317659 2.118057       6.348736 
1 1 1 -9  15 32 o 121.3101 3.117960 180.0105       9.209654 189.8459       13.83659 172.1873       12.34029 124.3056 4.575561 118.4370 4.282698 5.868546       6.267157 
1 1 1 -9  15 33 o 130.3992 3.520423 208.3405       11.17656 207.9025       19.06311 208.5699       13.79654 129.5613 6.054593 130.2804 4.351758 -0.7191010     7.456265 
1 1 1 -9  15 34 f 45.97356 4.048579 26.14485       4.489437 28.56676       6.647790 24.11417       6.087226 47.70547 5.840028 43.77085 5.853476 3.934620       8.268561 
1 1 1 -9  15 35 o 45.91122 4.158685 26.13985       4.602350 24.45836       6.843979 27.52797       6.218322 43.81063 6.616531 46.81330 5.559328 -3.002666      8.642026 
1 1 1 -9  15 36 o 53.42133 4.417667 35.48122       5.699638 31.35157       6.702756 46.26445       10.83108 49.88129 5.611389 60.00085 7.576200 -10.11956      9.427963 
1 1 1 -9  15 37 o 31.26123 5.965492 12.66080       4.378774 16.23236       5.701130 7.523246       6.837715 35.21247 6.890819 25.18046 8.914186 10.03201       11.26703 
1 1 1 -9  15 38 o 73.37646 3.231217 66.50208       5.763586 66.93600       8.322511 66.10218       7.989562 73.07043 4.698775 72.68250 4.533408 0.3879242      6.529186 
1 1 1 -9  15 39 o 84.04386 3.180920 87.44170       6.502949 100.5727       9.848886 77.29245       8.658753 89.42788 4.534168 78.35922 4.554123 11.06866       6.426408 
1 1 1 -9  15 40 o 36.84140 4.611074 17.41766       4.049338 22.75347       5.984905 12.91286       5.499142 41.46225 6.105996 30.47275 7.465234 10.98949       9.644320 
1 1 1 -9  15 41 o 16.31827 6.644742 2.018259       4.154460 -2.071087      8.032231 3.511793       4.854190 18.14921 8.262938 18.60787 7.313808 -0.4586582     11.03485 
1 1 1 -9  15 42 f 13.81861 6.009471 0.1604690      3.775615 -2.848957      6.209948 1.925313       4.755534 15.31332 7.079165 16.70729 6.984757 -1.393967      9.944919 
1 1 1 -9  15 43 o 15.24183 6.228955 2.011191       3.666899 6.220481       5.405234 -1.577730      4.991052 20.94236 7.845799 14.12508 6.462330 6.817288       10.16456 
1 1 1 -9  15 44 o 18.06079 6.626776 4.517778       3.819535 6.073637       5.705558 3.254280       5.141626 20.38213 7.953367 17.53051 7.290651 2.851618       10.78933 
1 1 1 -9  15 45 o 20.61020 6.742230 6.657543       3.899768 7.033025       5.672627 6.321054       5.370015 20.75685 7.976139 20.03991 7.744708 0.7169437      11.11752 
1 1 1 -9  15 46 o 28.17749 6.220407 12.38655       4.156837 14.82227       6.442250 10.64907       5.441066 27.65077 8.626204 24.03239 7.968787 3.618378       11.74363 
1 1 1 -9  15 47 o 17.36307 7.049252 4.900813       4.659362 1.603803       5.987436 9.962929       7.419024 15.50831 7.088692 21.06611 8.759089 -5.557802      11.26815 
1 1 1 -9  15 48 o 10.41605 5.008640 -3.100082      3.725227 -5.272878      5.726592 -1.506101      4.904878 11.95841 5.854241 12.65846 5.990983 -0.7000484     8.376396 
1 1 1 -9  16 1  o 489.1172 7.231351 2920.064       86.19229 2996.355       123.6515 2847.960       120.2100 495.0287 10.25021 482.6196 10.22114 12.40909       14.47545 
1 1 1 -9  16 2  o 224.7608 4.405607 615.9207       24.13028 606.3249       41.01582 620.9999       29.84091 222.7366 7.567544 225.6483 5.426800 -2.911774      9.312244 
1 1 1 -9  16 3  o 437.8638 6.541408 2339.339       69.79855 2172.536       93.67664 2547.522       104.6531 421.6863 9.116030 456.5905 9.405656 -34.90417      13.09841 
1 1 1 -9  16 4  o 248.3440 3.693078 751.8120       22.35003 723.5996       28.39560 797.7488       36.23360 243.6026 4.783359 255.7334 5.814171 -12.13081      7.528952 
1 1 1 -9  16 5  o 267.1682 4.355279 870.2687       28.35548 866.2791       40.40426 874.1405       39.80388 266.4665 6.222263 267.6796 6.102027 -1.213043      8.715004 
1 1 1 -9  16 6  o 403.2955 5.438705 1983.803       53.45089 2002.710       85.34962 1971.602       68.56055 404.8953 8.650133 401.9181 7.000041 2.977142       11.12769 
1 1 1 -9  16 7  o 490.1082 6.478070 2931.234       77.37019 3014.828       124.8924 2879.173       98.56065 496.4672 10.32308 485.4953 8.330718 10.97192       13.26525 
1 1 1 -9  16 8  o 260.6372 3.831168 828.1761       24.33345 833.6591       39.05170 824.6961       31.11155 261.3840 6.130908 260.0421 4.909552 1.341888       7.854409 
1 1 1 -9  16 9  o 339.6482 4.697863 1406.877       38.88353 1370.859       60.92009 1431.637       50.51044 335.0426 7.461470 342.5222 6.051406 -7.479645      9.606928 
1 1 1 -9  16 10 o 352.4853 5.408832 1515.820       46.46014 1580.440       96.30773 1496.220       53.04010 359.0260 11.02081 350.1266 6.216459 8.899384       12.65317 
1 1 1 -9  16 11 o 144.5867 2.799827 254.8152       9.864964 246.5936       15.92641 259.9332       12.56574 142.1153 4.604840 146.0153 3.531454 -3.900009      5.803078 
1 1 1 -9  16 12 o 93.95511 3.412585 107.7661       7.800418 118.2295       14.70312 103.6675       9.202214 98.21497 6.174461 92.10777 4.110127 6.107201       7.417352 
1 1 1 -9  16 13 o 274.3205 3.972834 917.7321       26.55796 1018.117       45.15291 864.6340       32.83904 288.7241 6.417511 266.1913 5.062447 22.53284       8.173911 
1 1 1 -9  16 14 o 217.8487 4.357571 578.9493       23.13319 568.7083       40.41210 583.9406       28.21286 215.5004 7.707742 218.7229 5.293180 -3.222504      9.350243 
1 1 1 -9  16 15 o 136.4061 3.541200 227.0663       11.76124 216.8860       14.78299 244.6230       19.41335 133.2413 4.559610 141.4200 5.644518 -8.178726      7.256076 
1 1 1 -9  16 16 f 156.7525 3.207290 299.6335       12.25149 284.2875       17.52513 314.3019       17.13394 152.5404 4.720231 160.4268 4.386843 -7.886429      6.443987 
1 1 1 -9  16 17 o 331.4892 5.163333 1342.042       41.70956 1295.587       58.25621 1390.901       59.74439 325.3097 7.348677 337.0800 7.273243 -11.77023      10.33940 
1 1 1 -9  16 18 o 325.2663 5.081702 1292.329       40.27953 1308.826       57.89607 1276.853       56.07526 326.9083 7.267535 322.9224 7.125854 3.985840       10.17816 
1 1 1 -9  16 19 o 351.1331 5.417315 1506.940       46.35450 1496.293       65.72543 1517.477       65.38622 349.3333 7.720712 351.8243 7.626483 -2.490967      10.85231 
1 1 1 -9  16 20 o 143.6481 3.115069 251.7010       10.90445 251.7040       15.91953 251.6983       14.96695 143.4869 4.558621 143.5133 4.284415 -0.2642822E-01 6.255976 
1 1 1 -9  16 21 o 216.8393 4.462921 574.3087       23.58269 594.0615       29.44245 538.9534       39.39004 220.3998 5.481844 209.4077 7.732218 10.99211       9.478281 
1 1 1 -9  16 22 o 261.4822 6.114115 837.2834       38.95936 770.8607       52.03786 921.9973       58.76762 250.1567 8.548892 273.5112 8.828691 -23.35448      12.28940 
1 1 1 -9  16 23 o 172.6313 3.364305 363.7238       14.15308 348.6871       20.17257 378.3011       19.86200 168.7955 4.909372 175.8638 4.638630 -7.068314      6.754170 
1 1 1 -9  16 24 o 51.26340 3.431017 32.22330       4.261463 38.82428       6.818332 27.99188       5.459045 56.11052 5.040168 47.60807 4.769600 8.502453       6.939192 
1 1 1 -9  16 25 o 194.0821 3.578426 459.9989       16.92442 464.0615       24.64363 456.3723       23.28370 194.6252 5.200667 193.0538 4.953321 1.571396       7.182084 
1 1 1 -9  16 26 o 163.3123 3.793073 325.8703       15.09546 327.4494       19.26172 323.3564       24.30298 163.4953 4.839850 162.2008 6.159710 1.294479       7.833657 
1 1 1 -9  16 27 o 36.89240 4.476858 16.89484       3.942552 13.11970       6.163671 19.50897       5.129045 31.98011 7.944566 39.52205 5.472152 -7.541941      9.646791 
1 1 1 -9  16 28 o 78.81642 3.591625 76.07002       6.880199 74.36719       14.74656 76.54384       7.778738 77.17656 7.954780 79.00822 4.053732 -1.831657      8.928117 
1 1 1 -9  16 29 o 50.39642 3.630663 31.20903       4.428954 35.56767       6.965413 28.25078       5.738376 53.56356 5.410401 47.74334 5.006574 5.820217       7.371447 
1 1 1 -9  16 30 o 158.6366 3.885121 307.9454       15.01910 290.6169       27.77522 315.1059       17.85456 153.0557 7.469393 160.2737 4.576101 -7.217926      8.759711 
1 1 1 -9  16 31 o 43.72588 4.185505 23.63746       4.405496 20.18003       6.604803 26.40861       5.913059 39.81205 7.066654 46.03966 5.371187 -6.227612      8.876219 
1 1 1 -9  16 32 o 50.38560 4.175718 31.33783       5.081117 19.26239       8.275302 38.64537       6.437511 38.45993 8.991453 55.88870 4.772317 -17.42877      10.17945 
1 1 1 -9  16 33 o 44.67929 4.143213 24.70900       4.459685 34.31793       6.945184 17.96714       5.817494 52.44926 5.516343 37.52617 6.602569 14.92308       8.603717 
1 1 1 -9  16 34 o 61.01158 3.519978 45.79542       5.211236 37.77444       7.695905 52.58762       7.081924 54.90342 5.841655 65.20789 4.484014 -10.30447      7.364192 
1 1 1 -9  16 35 o 16.43857 6.350214 2.260557       3.609165 2.364013       5.305355 2.171433       4.924193 18.88632 7.573492 18.19707 7.296615 0.6892567      10.51658 
1 1 1 -9  16 36 o 28.58953 7.915053 10.79339       5.702368 10.79339       5.702368 0.000000       0.000000 28.58953 7.915053 ?        ?        0.000000       7.915053 
1 1 1 -9  16 37 o 65.96334 3.334374 53.74295       5.342471 51.17434       7.786170 56.02810       7.343993 63.80805 5.048513 66.97906 4.526003 -3.171009      6.780280 
1 1 1 -9  16 38 o 67.35125 3.375612 56.21446       5.522652 52.91974       7.956584 59.27741       7.671627 64.65471 5.091036 68.67545 4.610773 -4.020737      6.868615 
1 1 1 -9  16 39 o 19.09541 6.499366 4.517609       3.617872 3.063091       5.319055 5.769845       4.935351 19.01890 7.597945 21.56565 7.578620 -2.546747      10.73146 
1 1 1 -9  16 40 o 52.62785 4.599295 35.44954       5.839307 38.01292       11.91267 34.63884       6.699347 50.35613 10.06001 51.55100 5.413523 -1.194870      11.42410 
1 1 1 -9  16 41 o 14.23072 6.078822 0.5892577      3.731440 -1.058805      5.490769 2.003567       5.086494 15.53643 6.974811 17.30284 7.227999 -1.766415      10.04450 
1 1 1 -9  16 42 o 28.29079 6.208939 11.32842       4.162814 20.12428       6.066285 3.500102       5.722925 37.40231 6.910102 18.82536 7.747304 18.57694       10.38124 
1 1 1 -9  16 43 o 18.01471 6.683605 4.326357       3.903812 2.451240       5.384233 6.404602       5.668366 17.25366 7.333790 20.95979 7.993269 -3.706131      10.84790 
1 1 1 -9  16 44 o 15.96942 6.464404 2.789204       3.905080 5.708933       5.664187 0.1441692      5.391159 19.82799 7.866932 15.30356 6.887329 4.524423       10.45581 
1 1 1 -9  16 45 o 15.16214 6.529446 1.836683       4.370544 2.454828       5.673088 0.9341184      6.855096 16.68286 7.308402 16.60165 7.587118 0.8120537E-01  10.53457 
1 1 1 -9  16 46 o 26.49267 7.153064 12.05810       4.725173 8.598182       6.075786 17.35363       7.516641 21.09951 8.214753 28.25385 9.366089 -7.154341      12.45816 
1 1 1 -9  16 47 o 19.83879 6.752870 6.973780       3.905612 8.403964       6.094146 5.976935       5.087805 20.11387 8.099177 18.21294 7.376469 1.900925       10.95486 
1 1 1 -9  16 48 o 13.02278 5.777558 1.170097       3.652393 5.200223       6.211756 -0.9594261     4.515399 17.11141 7.565881 12.46926 5.854028 4.642152       9.566200 
1 1 1 -9  17 1  o 112.0799 2.590427 153.1034       7.075143 149.0049       10.74600 156.2395       9.400057 110.4757 3.998164 113.1588 3.412735 -2.683075      5.256622 
1 1 1 -9  17 2  o 644.9930 10.82931 5093.625       170.2127 5009.717       205.9465 5274.484       302.3574 638.8967 13.22780 652.7851 19.02733 -13.88837      23.17357 
1 1 1 -9  17 3  o 59.32096 2.908153 42.99476       4.191175 41.81744       6.234601 43.96548       5.661232 58.39385 4.414011 59.92412 3.897952 -1.530270      5.888763 
1 1 1 -9  17 4  o 156.2988 2.912998 297.7632       11.09512 286.1660       17.70879 305.2573       14.23553 153.1064 4.752102 158.2365 3.691739 -5.130112      6.017592 
1 1 1 -9  17 5  o 353.3015 4.875106 1522.424       41.97259 1425.052       63.95170 1596.105       55.63076 341.5611 7.683296 361.6266 6.312750 -20.06546      9.944036 
1 1 1 -9  17 6  o 402.7062 5.443439 1978.541       53.41925 2009.529       85.62875 1958.797       68.35072 405.4452 8.666652 400.5222 7.002939 4.922943       11.14235 
1 1 1 -9  17 7  o 68.56129 2.938162 57.40242       4.897592 65.82005       8.373846 53.02594       6.037995 73.31027 4.712269 65.83966 3.779179 7.470612       6.040503 
1 1 1 -9  17 8  o 293.5903 4.202038 1051.127       30.06338 986.2697       46.09988 1099.121       39.65611 284.2080 6.656217 300.1341 5.421989 -15.92609      8.585056 
1 1 1 -9  17 9  o 281.4246 4.540401 966.0099       31.13811 919.0891       61.54155 982.1551       36.09999 273.9055 9.233211 283.7191 5.221346 -9.813507      10.60729 
1 1 1 -9  17 10 o 496.2857 7.338466 3009.752       88.75098 3042.754       126.8335 2978.089       124.2326 498.2585 10.44583 492.9642 10.34151 5.294312       14.69906 
1 1 1 -9  17 11 o 419.6686 5.642075 2149.925       57.70074 2172.680       92.26625 2135.309       73.94434 421.2850 8.987332 417.9862 7.259503 3.298767       11.55303 
1 1 1 -9  17 12 o 303.9519 4.309350 1127.005       31.91926 1175.064       52.17282 1098.256       40.35235 310.0799 6.904537 299.9372 5.520805 10.14270       8.840357 
1 1 1 -9  17 13 o 34.95149 4.751067 15.18080       3.941954 15.49081       6.081136 14.95612       5.176922 34.93758 7.374562 34.43838 6.404345 0.4991989      9.767282 
1 1 1 -9  17 14 o 103.0073 2.925294 129.4719       7.335566 126.5822       10.89294 131.8698       9.922899 101.7554 4.403322 103.8976 3.926262 -2.142120      5.899558 
1 1 1 -9  17 15 o 127.3450 4.111055 198.0779       12.74095 0.000000       0.000000 198.0779       12.74095 ?        ?        127.3450 4.111055 0.000000       4.111055 
1 1 1 -9  17 16 f 55.43308 3.426497 37.62378       4.606037 31.00633       7.067671 42.50932       6.072781 50.02076 5.912296 58.86375 4.262412 -8.842999      7.288580 
1 1 1 -9  17 17 o 166.6026 3.310721 338.5670       13.44128 341.6285       19.70313 335.9020       18.38311 167.1807 4.841398 165.8027 4.554103 1.377960       6.646728 
1 1 1 -9  17 18 o 239.3830 4.065507 699.4614       23.71615 664.2130       33.19552 736.2106       33.89481 232.9794 5.851532 245.3857 5.668234 -12.40627      8.146735 
1 1 1 -9  17 19 o 309.6384 5.711740 1172.574       43.09822 1183.711       53.20514 1151.321       73.49924 310.8081 7.024657 305.5296 9.884744 5.278564       12.12658 
1 1 1 -9  17 20 o 283.0337 5.335942 979.5076       36.80318 970.5767       44.91929 997.7455       64.19093 281.4908 6.548360 284.5054 9.271015 -3.014587      11.35045 
1 1 1 -9  17 21 o 169.7741 3.795625 351.8786       15.70330 318.5477       26.40267 370.1229       19.53385 161.0586 6.742008 173.9789 4.611458 -12.92027      8.168244 
1 1 1 -9  17 22 o 148.7406 3.163889 269.9633       11.46798 285.6624       17.33455 257.7444       15.29299 152.8026 4.660728 145.1787 4.327513 7.623886       6.360012 
1 1 1 -9  17 23 o 108.4872 3.007676 143.7209       7.943761 132.9022       11.64513 153.1366       10.86386 104.1633 4.599020 111.8956 3.990536 -7.732231      6.088954 
1 1 1 -9  17 24 o 99.00993 2.977302 119.7357       7.175367 125.2327       10.89549 115.5258       9.535049 101.1119 4.432665 97.15176 4.036298 3.960167       5.995016 
1 1 1 -9  17 25 o 70.56818 3.433043 60.95515       5.885985 65.51424       8.386055 56.52846       8.263382 73.02055 4.738360 67.76594 5.040005 5.254608       6.917637 
1 1 1 -9  17 26 o 156.0428 3.715216 297.5295       14.12745 308.7203       18.41232 281.5105       22.02909 158.7343 4.765335 151.3256 5.985571 7.408737       7.650848 
1 1 1 -9  17 27 o 115.7300 3.566948 163.8110       10.04755 139.6325       19.08213 173.0858       11.81857 106.1477 7.423804 118.8951 4.085174 -12.74741      8.473577 
1 1 1 -9  17 28 o 82.76309 3.130081 83.78101       6.301516 68.39713       9.422022 96.23132       8.476205 74.49319 5.223393 88.61423 3.935015 -14.12105      6.539738 
1 1 1 -9  17 29 o 99.79382 3.590162 121.9278       8.716567 132.1494       18.20722 118.8885       9.928256 103.1468 7.290529 98.46120 4.147108 4.685608       8.387509 
1 1 1 -9  17 30 o 133.0645 3.164492 216.4106       10.26130 229.0307       15.57293 206.7269       13.64146 136.5584 4.686621 129.8095 4.318403 6.748917       6.372835 
1 1 1 -9  17 31 o 109.0913 3.073778 145.5942       8.163298 134.5425       11.96943 155.2052       11.16210 104.5779 4.708829 112.4667 4.079491 -7.888855      6.230194 
1 1 1 -9  17 32 o 112.1649 3.421299 154.1657       9.340626 142.8261       15.82828 160.2247       11.57001 107.2976 6.078375 114.1951 4.164645 -6.897552      7.368237 
1 1 1 -9  17 33 o 47.25796 3.959278 27.60461       4.517728 22.33441       6.775032 31.82427       6.062286 41.82759 6.886227 50.56873 4.984193 -8.741142      8.500724 
1 1 1 -9  17 34 o 105.9441 3.112902 137.6548       8.027998 140.6864       11.93526 135.1500       10.84894 106.6975 4.601118 104.6778 4.261921 2.019661       6.271703 
1 1 1 -9  17 35 o 60.35924 4.307842 45.21205       6.294704 45.76653       7.573002 43.97268       11.32205 60.48586 5.187869 58.17040 8.215503 2.315453       9.716402 
1 1 1 -9  17 36 o 63.12528 3.919826 49.41844       6.000095 49.90231       8.003568 48.79755       9.066282 62.99836 5.261366 61.97385 6.081450 1.024509       8.041517 
1 1 1 -9  17 37 o 92.44522 3.153823 105.4415       7.094495 97.97042       10.29144 112.2070       9.793347 88.38549 4.796108 94.89368 4.245795 -6.508194      6.405422 
1 1 1 -9  17 38 f 20.17141 6.659857 5.140480       3.801610 4.014917       5.603314 6.100469       5.174796 20.31988 7.895161 22.20629 7.763534 -1.886404      11.07276 
1 1 1 -9  17 39 o 50.78887 3.902411 32.48670       4.792892 31.06047       7.035904 33.72154       6.546837 48.56127 6.078346 51.04547 5.342075 -2.484200      8.092222 
1 1 1 -9  17 40 o 29.96143 6.645694 12.44771       4.725113 26.51399       10.48162 8.860072       5.293503 40.94976 10.46561 24.97565 7.823537 15.97410       13.06663 
1 1 1 -9  17 41 o 19.98902 6.952596 5.376808       4.147246 1.101740       7.086506 7.603703       5.114587 18.55045 8.146152 23.00388 7.728126 -4.453426      11.22870 
1 1 1 -9  17 42 o 40.06495 4.753123 21.42316       4.550345 23.03864       6.439841 19.81238       6.430489 39.79806 6.889497 36.28213 7.520250 3.515934       10.19899 
1 1 1 -9  17 43 o 26.25315 6.463829 10.28789       4.107281 9.624587       5.971381 10.88348       5.658394 24.09628 8.344790 25.70904 8.093682 -1.612757      11.62511 
1 1 1 -9  17 44 o 13.85328 6.092153 0.5764346      3.976366 -2.254046      5.687529 3.282818       5.561452 14.13862 6.615982 17.49850 7.446247 -3.359879      9.960814 
1 1 1 -9  17 45 o 21.95129 6.722392 7.890290       3.933696 9.100984       6.190917 7.070536       5.094241 22.01012 8.363156 20.29801 7.614181 1.712111       11.31009 
1 1 1 -9  17 46 o 21.01787 7.478180 8.206499       4.817513 7.392602       6.146245 9.503136       7.757726 19.65289 8.051796 20.83625 8.827602 -1.183355      11.94814 
1 1 1 -9  17 47 o 19.12126 6.580632 6.456739       3.711277 5.585403       5.762917 7.074171       4.851142 17.67555 7.552491 19.18170 7.374697 -1.506147      10.55586 
1 1 1 -9  18 1  o 264.4417 5.034343 853.1905       32.44209 811.0989       53.34114 877.9012       40.87018 257.3773 8.516367 268.1465 6.254582 -10.76920      10.56638 
1 1 1 -9  18 2  o 181.6227 3.413562 402.1698       15.10824 352.1166       27.69998 423.3655       18.02549 169.6661 6.712838 186.3274 3.969851 -16.66130      7.798840 
1 1 1 -9  18 3  o 404.2423 5.455837 1994.152       53.74514 2016.281       85.50548 1979.698       69.10223 406.0080 8.642179 402.5681 7.043954 3.439880       11.14919 
1 1 1 -9  18 4  o 94.98693 3.463248 110.1490       8.003057 98.04167       12.34924 118.9158       10.50837 89.44636 5.695119 98.64454 4.382398 -9.198181      7.186083 
1 1 1 -9  18 5  o 340.7936 4.320153 1416.502       35.87788 1391.254       50.34407 1442.558       51.14332 337.5753 6.119861 343.7449 6.105435 -6.169556      8.644596 
1 1 1 -9  18 6  o 333.0666 4.647943 1353.247       37.72490 1422.186       61.86891 1312.446       47.59700 341.1327 7.442400 327.8838 5.956945 13.24896       9.532812 
1 1 1 -9  18 7  o 119.7970 3.025796 175.0644       8.826201 179.7655       12.98566 171.0277       12.03297 121.3192 4.399652 118.3443 4.178993 2.974884       6.068024 
1 1 1 -9  18 8  o 270.1021 3.949168 889.7332       25.99379 919.1819       42.32472 871.8988       32.93738 274.3385 6.330985 267.3031 5.056488 7.035431       8.102434 
1 1 1 -9  18 9  o 454.4141 6.788236 2523.181       75.17005 2743.304       159.7386 2460.571       85.19239 471.4771 13.91839 448.5375 7.794100 22.93958       15.95210 
1 1 1 -9  18 10 o 192.1451 4.095595 450.3460       19.17708 473.2663       35.11680 440.6062       22.89188 196.5974 7.342854 189.9433 4.949845 6.654083       8.855420 
1 1 1 -9  18 11 o 37.58597 4.538755 17.48810       4.073101 13.53065       6.153894 20.57334       5.433588 32.60441 7.841644 40.66133 5.634904 -8.056919      9.656268 
1 1 1 -9  18 12 o 173.9084 3.395274 368.8347       14.38903 367.9044       20.79123 369.6900       19.93414 173.5351 4.921480 173.9757 4.706215 -0.4406586     6.809510 
1 1 1 -9  18 13 o 117.9172 2.683905 169.5198       7.712240 176.6619       12.90740 165.5542       9.617877 120.2339 4.412789 116.4598 3.392581 3.774124       5.566175 
1 1 1 -9  18 14 o 271.0474 4.423135 896.7214       29.21538 944.2927       43.15339 856.4668       39.69634 277.8825 6.372614 264.6769 6.154578 13.20557       8.859404 
1 1 1 -9  18 15 o 158.2366 2.901629 305.3321       11.18884 319.1677       18.62804 297.5234       13.99452 161.6042 4.735295 156.1617 3.677455 5.442459       5.995556 
1 1 1 -9  18 16 o 50.53849 3.659334 31.32637       4.476195 0.000000       0.000000 31.32637       4.476195 ?        ?        50.53849 3.659334 0.000000       3.659334 
1 1 1 -9  18 17 o 102.4308 2.994076 128.0748       7.465570 132.7511       11.36077 124.5207       9.904284 104.1688 4.485936 100.9219 4.035323 3.246933       6.033858 
1 1 1 -9  18 18 o 170.1164 3.998362 353.2731       16.57541 360.8266       20.63261 339.5260       27.83473 171.7713 4.934211 166.3291 6.882115 5.442230       8.468172 
1 1 1 -9  18 19 o 51.23223 4.654157 32.32983       5.747244 31.18707       7.109827 34.48444       9.762614 50.13705 5.934111 52.42716 7.885384 -2.290108      9.868787 
1 1 1 -9  18 20 o 61.47983 3.645445 46.29921       5.437074 27.02156       9.821094 54.81863       6.528865 46.05528 9.073621 66.88094 4.024511 -20.82566      9.926091 
1 1 1 -9  18 21 o 129.9795 3.069436 206.1390       9.722313 192.1544       14.04596 219.0019       13.47092 125.3002 4.607910 133.8343 4.135375 -8.534142      6.191459 
1 1 1 -9  18 22 o 93.56084 2.977172 106.9165       6.779238 108.2740       10.46191 105.9339       8.900764 93.99937 4.580994 93.04539 3.934392 0.9539719      6.038621 
1 1 1 -9  18 23 o 61.01362 3.309891 45.57751       4.902835 47.75769       7.852445 44.18457       6.276607 62.24365 5.225134 59.96765 4.324122 2.276005       6.782334 
1 1 1 -9  18 24 o 147.5272 3.204291 265.6967       11.51967 263.9267       16.96243 267.2120       15.69396 146.7906 4.748163 147.7623 4.363236 -0.9717407     6.448479 
1 1 1 -9  18 25 f 213.2017 4.393771 556.0257       22.82781 567.3630       29.18358 538.1536       36.64118 215.0368 5.573860 208.9354 7.207291 6.101364       9.111144 
1 1 1 -9  18 26 o 156.6520 4.630494 300.6768       17.65723 300.2841       28.08850 300.9333       22.70425 155.8746 7.415912 156.4324 5.966797 -0.5578613     9.518320 
1 1 1 -9  18 27 o 114.7096 3.564029 160.9727       9.950612 144.1301       19.01800 167.3216       11.67642 107.8364 7.279737 116.8760 4.106044 -9.039543      8.357881 
1 1 1 -9  18 28 o 53.57421 4.257477 35.35933       5.512647 25.60267       11.99049 37.97435       6.207603 44.26873 11.12858 55.47794 4.633924 -11.20921      12.05481 
1 1 1 -9  18 29 o 137.7362 3.213212 231.8738       10.78509 232.3254       16.08214 231.5046       14.53915 137.5246 4.806129 137.3820 4.348308 0.1425934      6.481254 
1 1 1 -9  18 30 o 54.95268 3.653924 37.11898       4.865311 40.90723       7.858493 34.76442       6.195478 57.36067 5.697196 52.99170 4.851448 4.368973       7.482953 
1 1 1 -9  18 31 o 95.70735 3.374264 112.2399       7.857430 97.72335       13.43431 119.7878       9.687119 88.67319 6.257267 98.75953 4.033614 -10.08634      7.444692 
1 1 1 -9  18 32 o 14.03898 5.949961 0.1687524      3.526449 8.711089       5.663811 -5.239364      4.506542 26.29263 8.069078 12.12690 5.740342 14.16574       9.902603 
1 1 1 -9  18 33 o 75.29111 3.245404 69.59592       5.940563 69.58803       8.959491 69.60212       7.935798 74.91835 4.934968 75.06833 4.356803 -0.1499786     6.582982 
1 1 1 -9  18 34 o 62.41305 3.418367 47.97619       5.179273 50.37176       7.898261 46.16896       6.860151 63.53652 5.145178 60.94374 4.654430 2.592777       6.938053 
1 1 1 -9  18 35 o 29.62430 8.228368 11.66033       6.151683 11.66033       6.151683 0.000000       0.000000 29.62430 8.228368 ?        ?        0.000000       8.228368 
1 1 1 -9  18 36 o 121.0874 3.146862 180.6234       9.277792 186.6038       13.91396 175.8357       12.44942 122.2748 4.678210 118.9072 4.303499 3.367622       6.356552 
1 1 1 -9  18 37 o 43.72918 4.221646 24.05620       4.442857 28.40545       6.862225 20.91741       5.829610 46.77262 6.170969 40.03661 6.173301 6.736004       8.728717 
1 1 1 -9  18 38 o 14.20811 5.963356 0.7139623      3.487220 -1.369986      5.045240 2.620292       4.825446 15.04879 6.726063 18.01862 7.223761 -2.969828      9.870291 
1 1 1 -9  18 39 o 41.73558 4.330114 22.26570       4.340023 17.76098       6.288010 26.36408       5.997715 35.62996 7.480673 44.77346 5.620577 -9.143494      9.356889 
1 1 1 -9  18 40 o 47.42016 5.631790 30.00379       6.381017 0.000000       0.000000 30.00379       6.381017 ?        ?        47.42016 5.631790 0.000000       5.631790 
1 1 1 -9  18 41 o 13.49804 5.891729 0.1135999      3.657616 -1.191391      5.447674 1.184732       4.935473 15.12031 6.852749 16.14300 6.945083 -1.022692      9.756760 
1 1 1 -9  18 42 o 22.85664 6.766856 7.832489       4.035182 5.636992       6.001026 9.644416       5.451666 20.36940 8.092394 24.59448 7.966483 -4.225079      11.35569 
1 1 1 -9  18 43 o 27.89938 6.401220 11.67274       4.259488 13.78250       6.478795 10.06655       5.652955 28.09923 8.631335 24.45959 8.122861 3.639647       11.85246 
1 1 1 -9  18 44 o 13.29355 6.064166 -0.6662679     4.353354 0.7905695      5.832607 -2.498644      6.541305 15.77299 7.125241 14.73779 6.958092 1.035196       9.959122 
1 1 1 -9  18 45 o 13.87821 5.989737 1.459127       3.693674 3.747093       5.591405 -0.3123945     4.920050 17.10538 7.375954 13.86997 6.371803 3.235412       9.747029 
1 1 1 -9  18 46 o 15.52156 6.635189 3.035147       4.451745 1.870209       5.731445 4.806769       7.068030 15.43581 7.008887 17.66089 7.922188 -2.225082      10.57760 
1 1 1 -9  18 47 o 22.19006 6.842552 9.028186       4.066900 8.328755       6.592564 9.457880       5.167285 19.35090 8.165021 21.31930 7.725175 -1.968401      11.24037 
1 1 1 -9  19 1  o 57.74397 3.499794 40.80893       4.901639 43.75636       6.108480 35.47945       8.213978 59.74294 4.222971 53.50829 6.427902 6.234653       7.690996 
1 1 1 -9  19 2  o 320.2485 4.490130 1251.253       35.04146 1220.115       54.30739 1273.464       45.86713 315.9375 7.053775 322.9348 5.828417 -6.997284      9.150202 
1 1 1 -9  19 3  o 561.5844 7.370824 3856.110       100.8712 3822.033       158.0672 3879.522       131.0171 557.6540 11.63164 562.6208 9.555998 -4.966858      15.05364 
1 1 1 -9  19 4  o 246.9740 4.113182 744.0165       24.75513 734.6939       34.75512 753.6167       35.26860 245.2882 5.814416 248.4259 5.825797 -3.137695      8.230878 
1 1 1 -9  19 5  o 239.1887 3.342535 697.5982       19.48286 688.0477       27.54461 707.1602       27.56126 237.4565 4.760106 240.7365 4.698086 -3.280045      6.688096 
1 1 1 -9  19 6  o 183.2793 3.141579 409.5630       14.03128 422.9147       22.95965 401.6040       17.72675 186.0753 5.068098 181.4519 4.008958 4.623383       6.461994 
1 1 1 -9  19 7  o 135.0241 2.817072 222.2636       9.269269 219.6275       15.04681 223.8757       11.76716 134.0801 4.612019 135.4435 3.568254 -1.363449      5.831223 
1 1 1 -9  19 8  o 144.2294 3.190269 253.6499       11.21288 250.5500       23.79244 254.5349       12.71325 142.9930 6.847817 144.4659 3.611230 -1.472855      7.741678 
1 1 1 -9  19 9  o 107.1578 2.703112 140.0785       7.053054 150.3818       11.99201 134.6295       8.720882 110.9228 4.445448 105.0137 3.412364 5.909142       5.604127 
1 1 1 -9  19 10 o 165.8551 3.352704 335.4720       13.55065 337.0641       19.65983 334.0311       18.70298 166.0947 4.862456 165.3649 4.645815 0.7297668      6.725108 
1 1 1 -9  19 11 f 72.71200 2.844744 64.56248       5.030910 70.19509       8.621943 61.65472       6.194843 75.68555 4.697886 71.00497 3.591851 4.680573       5.913672 
1 1 1 -9  19 12 o 131.4011 2.761736 210.5250       8.843355 193.2266       14.04541 221.8866       11.38290 125.7271 4.591978 134.8290 3.467320 -9.101952      5.754004 
1 1 1 -9  19 13 o 176.8011 3.423667 381.2979       14.75069 406.0959       22.03979 361.1777       19.85250 182.2795 4.966364 171.9194 4.743180 10.36009       6.867498 
1 1 1 -9  19 14 o 90.22067 2.673786 99.33770       5.872046 102.1763       10.04537 97.86429       7.237325 91.36755 4.525761 89.50912 3.323760 1.858437       5.615148 
1 1 1 -9  19 15 o 156.9183 2.923897 300.2976       11.18077 294.8485       18.03142 303.7015       14.25128 155.2972 4.770299 157.7612 3.706958 -2.464066      6.041298 
1 1 1 -9  19 16 o 67.86153 3.285092 56.31141       5.416455 54.90867       8.148153 57.42204       7.250272 66.84599 5.039152 68.43681 4.370224 -1.590820      6.670225 
1 1 1 -9  19 17 o 115.3716 3.087802 162.4842       8.673488 150.4946       12.38490 174.0248       12.15078 110.9018 4.592602 119.3110 4.185631 -8.409187      6.213815 
1 1 1 -9  19 18 o 27.38946 8.343456 9.255875       6.070087 1.403071       8.258985 18.48097       8.951583 22.21654 9.239880 37.99351 9.651121 -15.77697      13.36112 
1 1 1 -9  19 19 o 115.1123 3.049945 161.7771       8.548052 165.2808       12.99601 159.1055       11.34836 116.2068 4.598338 114.0660 4.089252 2.140739       6.153592 
1 1 1 -9  19 20 o 182.3716 3.976793 406.2072       17.67365 380.7573       30.60362 418.9423       21.64855 175.9605 7.151999 185.0461 4.804855 -9.085632      8.616131 
1 1 1 -9  19 21 o 312.1869 4.977396 1192.252       37.86631 1154.644       53.21407 1230.829       53.89452 306.5847 7.122622 316.5867 6.985796 -10.00192      9.976627 
1 1 1 -9  19 22 o 202.6772 3.708118 501.7091       18.31448 486.9795       26.21872 515.7450       25.59375 199.3414 5.402297 205.2718 5.116448 -5.930344      7.440622 
1 1 1 -9  19 23 o 99.57230 3.040061 121.1258       7.367973 124.1125       11.29750 118.9152       9.719429 100.6207 4.619758 98.55627 4.055545 2.064430       6.147326 
1 1 1 -9  19 24 o 91.01913 3.434954 101.3265       7.605184 107.9485       10.59679 94.29271       10.92126 93.80583 4.650121 87.58767 5.139325 6.218163       6.930821 
1 1 1 -9  19 25 o 73.49701 3.641074 66.16921       6.501015 76.62220       14.29727 63.44469       7.299237 78.45985 7.571675 71.90204 4.183891 6.557816       8.650734 
1 1 1 -9  19 26 o 92.65531 3.541185 105.0684       7.980956 94.19427       15.57982 108.9371       9.292835 87.05254 7.414708 94.28421 4.054050 -7.231674      8.450635 
1 1 1 -9  19 27 o 80.18182 3.612792 78.76165       7.041059 90.36179       15.59296 75.79057       7.891406 85.15233 7.594032 78.58508 4.135322 6.567245       8.646976 
1 1 1 -9  19 28 o 139.4843 3.205206 237.7758       10.89475 248.1002       16.34793 229.5269       14.61269 142.1521 4.725822 136.7939 4.389244 5.358215       6.449718 
1 1 1 -9  19 29 o 89.02322 3.104562 96.98231       6.724725 91.63628       10.11446 101.2177       9.002724 86.26385 4.830766 90.80829 4.078704 -4.544434      6.322351 
1 1 1 -9  19 30 f 35.74932 5.138141 16.03660       4.347766 18.62362       8.172695 15.01546       5.134636 37.79686 9.002375 34.31789 6.374383 3.478973       11.03066 
1 1 1 -9  19 31 o 91.57919 3.124964 102.7412       6.963717 101.6737       10.46584 103.5894       9.328382 90.78266 4.747303 91.76223 4.182632 -0.9795685     6.327029 
1 1 1 -9  19 32 o 43.73642 4.160789 23.72310       4.381247 20.26946       6.723245 26.27221       5.776090 39.68325 7.218237 45.81738 5.269113 -6.134129      8.936806 
1 1 1 -9  19 33 o 59.03848 3.578747 42.96634       5.124574 33.75637       7.665810 50.40758       6.890512 51.66492 6.213270 63.76951 4.462228 -12.10459      7.649589 
1 1 1 -9  19 34 f 38.73822 6.172666 19.25425       5.631666 13.59490       6.683699 33.10789       10.45720 31.93792 8.455861 49.96048 8.916340 -18.02256      12.28832 
1 1 1 -9  19 35 o 40.92909 4.265126 20.98360       4.191686 23.95016       6.571827 18.94903       5.442474 43.05301 6.463314 38.35374 6.021197 4.699265       8.833417 
1 1 1 -9  19 36 o 51.87268 3.760725 33.51683       4.721578 34.85678       7.140509 32.47578       6.293962 52.18502 5.707959 50.56679 5.180837 1.618233       7.708558 
1 1 1 -9  19 37 o 72.25438 3.314049 64.80990       5.819709 59.68478       8.547483 69.23911       7.946015 68.43446 5.163486 74.16309 4.416691 -5.728638      6.794759 
1 1 1 -9  19 38 o 40.41072 4.315364 20.81233       4.183928 17.91685       6.285182 23.11643       5.606709 35.98707 7.413796 42.00414 5.618227 -6.017075      9.302089 
1 1 1 -9  19 39 o 20.05555 7.042967 5.193336       4.261832 -5.783904      8.614151 8.751163       4.904088 17.11155 8.049809 24.82425 7.486369 -7.712704      10.99296 
1 1 1 -9  19 40 o 52.34957 4.338311 35.49380       5.484736 19.85569       8.766012 45.55421       7.031009 34.75045 9.883401 58.83509 4.949798 -24.08464      11.05360 
1 1 1 -9  19 41 o 13.76897 6.020749 0.2360207      3.834449 6.823330       5.563066 -5.726119      5.292504 21.62298 7.986520 12.45481 5.984083 9.168167       9.979667 
1 1 1 -9  19 42 o 14.39115 6.100235 1.313899       3.707868 1.468165       5.790466 1.206681       4.827378 16.75484 7.360449 15.61005 6.791758 1.144794       10.01520 
1 1 1 -9  19 43 o 28.86744 7.169965 13.28609       5.021032 9.672801       6.132181 20.63658       8.746249 23.45490 8.426558 32.05268 10.05870 -8.597788      13.12190 
1 1 1 -9  19 44 o 17.61126 6.560999 4.684656       3.769266 4.276144       5.248060 5.119899       5.417051 17.64916 7.354925 18.43526 7.556703 -0.7860928     10.54508 
1 1 1 -9  19 45 o 21.51345 6.827240 8.006312       4.018863 8.218077       5.937470 7.827263       5.459614 20.49563 8.078736 20.30823 7.819451 0.1874027      11.24321 
1 1 1 -9  19 46 o 14.10819 6.054187 2.111067       3.732457 0.8477456      5.815135 2.996156       4.867395 14.75705 6.831980 15.55139 6.792129 -0.7943420     9.633740 
1 1 1 -9  20 1  o 294.1842 4.211936 1056.006       30.19516 1071.460       47.82537 1045.763       38.93700 296.0163 6.629895 292.6115 5.460532 3.404816       8.589116 
1 1 1 -9  20 2  o 237.5226 4.021803 688.2964       23.27887 705.9705       33.22915 671.2624       32.62183 240.3997 5.672169 234.4117 5.710748 5.988037       8.048984 
1 1 1 -9  20 3  o 439.8926 5.896416 2364.267       63.20784 2426.702       101.4373 2324.637       80.81557 444.7340 9.359686 435.7913 7.609924 8.942657       12.06295 
1 1 1 -9  20 4  o 287.0651 4.132099 1005.443       28.90594 1015.631       45.76305 998.6803       37.28554 288.2247 6.515499 285.9665 5.350437 2.258240       8.430830 
1 1 1 -9  20 5  o 156.8298 2.881047 299.8844       11.01070 311.9771       17.51218 291.9785       14.15964 159.8205 4.500952 154.7125 3.755698 5.108017       5.862068 
1 1 1 -9  20 6  o 203.3587 3.332304 504.3456       16.51366 506.7511       26.74423 502.8634       20.99380 203.6216 5.394522 203.0020 4.243797 0.6195679      6.863722 
1 1 1 -9  20 7  o 214.6282 3.831677 561.9766       20.04065 586.3296       42.65367 555.0775       22.70256 218.6273 8.019596 213.2671 4.368324 5.360184       9.132151 
1 1 1 -9  20 8  o 266.5225 3.950425 866.6931       25.65746 865.6250       40.98297 867.3817       32.90341 266.0759 6.320651 266.5114 5.066277 -0.4355774     8.100480 
1 1 1 -9  20 9  o 80.27094 2.832008 78.66425       5.531055 74.28215       9.283218 81.07603       6.886929 77.84031 4.919090 81.45378 3.477593 -3.613472      6.024209 
1 1 1 -9  20 10 o 81.84859 2.791753 81.78082       5.560170 81.62792       9.422664 81.86251       6.887013 81.62477 4.757758 81.84795 3.460734 -0.2231827     5.883276 
1 1 1 -9  20 11 o 155.0592 2.929795 293.2029       11.07059 263.3340       17.25190 314.1127       14.43450 146.7635 4.830307 160.4531 3.691625 -13.68956      6.079470 
1 1 1 -9  20 12 o 131.4333 3.112466 210.6928       9.968873 205.8910       14.51274 214.9825       13.71711 129.7698 4.596488 132.6398 4.249261 -2.870010      6.259706 
1 1 1 -9  20 13 o 143.6807 2.862833 251.7590       10.02376 272.5940       16.84215 240.3310       12.47344 149.3302 4.633826 140.2959 3.651529 9.034317       5.899662 
1 1 1 -9  20 14 o 36.73547 4.634232 16.74213       4.056446 16.93091       6.552765 16.62484       5.165099 36.48814 7.615932 36.38586 6.036649 0.1022797      9.718206 
1 1 1 -9  20 15 o 102.6157 3.477626 128.6323       8.683701 126.6428       15.73967 129.5029       10.41164 101.5066 6.395560 102.9060 4.160436 -1.399445      7.629706 
1 1 1 -9  20 16 o 114.0900 2.714083 158.7456       7.545829 151.8115       12.45618 162.7655       9.484157 111.3805 4.599124 115.4475 3.374773 -4.067017      5.704475 
1 1 1 -9  20 17 o 240.3356 4.136927 705.4066       24.22881 748.7564       35.78770 668.7236       32.92096 247.3098 5.938222 233.7483 5.779469 13.56155       8.286420 
1 1 1 -9  20 18 o 224.4115 3.513395 614.7016       19.21358 608.7830       31.02695 618.3830       24.46995 222.9322 5.715953 224.9604 4.463658 -2.028244      7.252335 
1 1 1 -9  20 19 o 115.7449 3.495706 163.6864       9.848608 160.9366       18.23694 164.8185       11.70166 114.3665 6.571269 116.0801 4.143342 -1.713600      7.768453 
1 1 1 -9  20 20 o 227.9965 3.994903 635.0425       22.19578 636.2145       32.14445 633.9745       30.68551 227.8048 5.795085 227.5307 5.534231 0.2741394      8.013159 
1 1 1 -9  20 21 o 83.64552 3.129011 85.51504       6.366776 93.38696       10.12419 80.36530       8.188651 87.24229 4.780353 80.98473 4.163257 6.257568       6.339123 
1 1 1 -9  20 22 o 79.91924 3.178671 78.09384       6.178255 75.43845       9.697956 79.90771       8.015300 78.32896 5.108553 80.75323 4.086370 -2.424271      6.541845 
1 1 1 -9  20 23 o 71.43476 3.317379 62.44884       5.759081 60.74354       9.175849 63.55721       7.397587 70.19456 5.405835 71.96919 4.236749 -1.774628      6.868267 
1 1 1 -9  20 24 o 77.82678 4.166221 74.29070       7.872666 94.56942       14.63175 66.02789       9.339858 87.37680 6.928379 73.20620 5.270761 14.17060       8.705363 
1 1 1 -9  20 25 o 113.8557 3.567036 158.5806       9.884674 159.5468       19.22684 158.2335       11.52429 113.5669 6.981100 113.6482 4.168230 -0.8132935E-01 8.130799 
1 1 1 -9  20 26 o 85.28770 3.161475 88.98145       6.559338 93.77696       10.64915 86.04983       8.326296 87.30067 5.026916 83.75618 4.091807 3.544487       6.481726 
1 1 1 -9  20 27 o 105.8595 3.105349 137.0410       8.002147 137.7277       12.38876 136.5494       10.48218 105.8550 4.815253 105.5292 4.083788 0.3257523      6.313793 
1 1 1 -9  20 28 o 154.6988 3.333276 292.6309       12.56592 305.0600       18.95803 282.8912       16.78206 157.5401 4.944292 151.8062 4.541593 5.733841       6.713574 
1 1 1 -9  20 29 o 89.04787 3.539367 97.20915       7.665125 97.13041       10.42346 97.30187       11.31111 88.77815 4.836298 88.76704 5.252465 0.1111603E-01  7.139899 
1 1 1 -9  20 30 o 129.3394 3.567942 205.0825       11.23491 208.0773       19.99451 203.7007       13.58177 129.4277 6.358852 128.7153 4.336210 0.7124176      7.696605 
1 1 1 -9  20 31 o 95.51360 3.136041 111.8213       7.289435 110.2777       11.00515 113.0280       9.729877 94.47652 4.795777 95.80878 4.177447 -1.332268      6.360074 
1 1 1 -9  20 32 o 64.03631 3.390433 50.44857       5.271899 58.04564       8.547049 45.78333       6.697770 68.28504 5.174874 60.75473 4.557120 7.530315       6.895409 
1 1 1 -9  20 33 o 25.05112 7.718043 8.031067       5.175543 6.188559       6.191072 12.30667       9.431047 23.51235 8.464445 31.10790 10.49438 -7.595552      13.48254 
1 1 1 -9  20 34 o 45.63375 6.457560 26.79741       6.980701 26.79741       6.980701 0.000000       0.000000 45.63375 6.457560 ?        ?        0.000000       6.457560 
1 1 1 -9  20 35 o 64.09248 3.363199 50.82990       5.234478 48.59982       8.325706 52.28762       6.731255 61.84302 5.584632 64.69942 4.293620 -2.856400      7.044380 
1 1 1 -9  20 36 o 70.95297 3.359662 62.45319       5.792512 58.92201       8.833720 65.11684       7.672224 67.97642 5.376478 72.00381 4.393411 -4.027390      6.943239 
1 1 1 -9  20 37 o 51.08906 3.832118 32.79881       4.736161 28.67202       6.987269 36.30645       6.441817 46.55462 6.322199 53.20108 5.028471 -6.646458      8.078101 
1 1 1 -9  20 38 o 18.30700 6.504478 4.102652       3.643472 5.126258       5.564445 3.334440       4.820544 20.89826 7.931519 18.46060 7.278478 2.437653       10.76500 
1 1 1 -9  20 39 o 16.41791 7.044366 1.053331       5.051891 0.000000       0.000000 1.053331       5.051891 ?        ?        16.41791 7.044366 0.000000       7.044366 
1 1 1 -9  20 40 o 14.65600 6.147737 1.306611       3.702840 -1.645689      5.278574 4.166854       5.195625 14.58449 6.662407 18.96750 7.531621 -4.383012      10.05550 
1 1 1 -9  20 41 o 26.41168 6.287915 10.21297       3.988551 7.807265       5.835320 12.32245       5.464272 22.40084 8.195454 27.89184 7.757969 -5.490999      11.28501 
1 1 1 -9  20 42 o 27.31626 6.493162 11.28180       4.258425 14.03066       6.270507 8.928804       5.801453 28.56209 8.430123 23.07989 8.206967 5.482204       11.76526 
1 1 1 -9  20 43 o 21.28787 7.393688 7.551864       4.689326 12.74264       5.979595 -0.7400031     7.557566 26.53140 8.315713 16.34658 7.641772 10.18483       11.29370 
1 1 1 -9  20 44 o 18.29035 6.769254 5.398447       4.000059 0.5902926E-01  5.762850 10.36261       5.556657 14.86434 6.853025 23.35903 8.051637 -8.494690      10.57321 
1 1 1 -9  20 45 o 16.67211 6.867499 4.250793       4.502365 2.266602       6.131886 6.571916       6.632103 15.92478 7.238254 18.77038 8.062772 -2.845602      10.83516 
1 1 1 -9  20 46 o 17.61990 6.619738 5.450899       3.853637 2.782402       6.137410 7.187678       4.951354 15.81941 7.210206 19.12140 7.423835 -3.301991      10.34893 
1 1 1 -9  21 1  o 348.4734 4.835894 1482.914       41.06601 1463.666       64.21676 1496.232       53.41580 345.6318 7.624276 349.7697 6.266882 -4.137848      9.869315 
1 1 1 -9  21 2  o 207.8432 3.328115 526.9060       16.85661 500.3505       25.70458 546.9433       22.32812 202.3168 5.218013 211.6816 4.328455 -9.364868      6.779615 
1 1 1 -9  21 3  o 114.8166 2.698403 160.7361       7.550012 150.1594       11.30520 169.2511       10.14365 110.8421 4.192962 117.7365 3.539491 -6.894333      5.487160 
1 1 1 -9  21 4  o 159.0063 2.914168 308.3070       11.29185 292.3764       17.13887 320.5261       15.01019 154.6881 4.551576 162.0811 3.800298 -7.393066      5.929512 
1 1 1 -9  21 5  f 91.78011 2.663050 102.7925       5.949831 103.3329       9.168665 102.3994       7.820006 91.92596 4.103248 91.55300 3.511594 0.3729553      5.400735 
1 1 1 -9  21 6  o 336.5342 6.092496 1384.906       49.96440 0.000000       0.000000 1384.906       49.96440 ?        ?        336.5342 6.092496 0.000000       6.092496 
1 1 1 -9  21 7  o 221.3895 3.514683 597.9276       18.96178 588.7953       30.28250 603.8174       24.31958 219.4063 5.668528 222.3920 4.487463 -2.985687      7.229766 
1 1 1 -9  21 8  o 136.2573 2.856440 226.4032       9.484643 225.3249       15.56941 227.0395       11.96003 135.7552 4.713449 136.3682 3.602163 -0.6130371     5.932300 
1 1 1 -9  21 9  o 187.2611 3.598542 427.8421       16.42140 436.1660       23.82225 420.3057       22.66750 188.8679 5.180826 185.4195 5.021253 3.448380       7.214841 
1 1 1 -9  21 10 o 28.12547 6.008563 10.04386       3.993110 1.554082       6.116625 16.34943       5.271395 19.57819 8.028039 36.04923 6.225589 -16.47104      10.15910 
1 1 1 -9  21 11 o 89.79224 4.328537 98.66811       9.443542 116.4174       14.44233 85.41109       12.48158 97.35809 6.118296 83.32295 6.191321 14.03514       8.704367 
1 1 1 -9  21 12 o 63.91096 4.168143 50.07798       6.456215 49.14738       8.169895 51.62556       10.53575 63.18309 5.356586 64.57153 6.797418 -1.388447      8.654357 
1 1 1 -9  21 13 o 146.4270 3.832870 261.8794       13.66494 251.8837       16.67088 282.3481       23.85604 143.5066 4.773702 151.7140 6.467465 -8.207367      8.038428 
1 1 1 -9  21 14 o 279.1078 4.089570 951.1634       27.81542 935.4213       44.02188 961.6249       35.88684 276.3414 6.537122 280.4491 5.251036 -4.107758      8.384948 
1 1 1 -9  21 15 o 20.36776 6.203437 5.095487       3.355770 3.362016       6.326405 5.774188       3.958568 21.39106 8.366824 21.76691 6.757390 -0.3758564     10.75482 
1 1 1 -9  21 16 f 418.9982 6.385116 2151.336       65.19542 2037.547       89.37820 2280.723       95.30766 406.6169 9.020072 430.1586 9.092077 -23.54163      12.80733 
1 1 1 -9  21 17 o 220.3773 3.493634 592.8239       18.76205 561.6007       29.60324 613.7856       24.25571 214.1035 5.678885 224.1148 4.441273 -10.01132      7.209344 
1 1 1 -9  21 18 o 70.75914 3.122077 61.21804       5.370214 45.49464       11.79509 65.32967       6.031631 60.24114 8.251348 73.07880 3.396226 -12.83766      8.922955 
1 1 1 -9  21 19 o 209.9937 3.393434 538.3431       17.36528 551.7909       28.70247 530.5787       21.80970 212.1843 5.555762 208.3526 4.295511 3.831787       7.022671 
1 1 1 -9  21 20 f 204.7095 3.709176 511.8634       18.50340 499.1222       37.63961 515.9237       21.24814 201.1870 7.691478 205.4415 4.244207 -4.254578      8.784767 
1 1 1 -9  21 21 o 251.4214 4.285120 772.9273       26.25436 789.7584       38.39373 758.1443       35.98203 253.6541 6.211298 248.6037 5.939394 5.050476       8.593987 
1 1 1 -9  21 22 o 135.5992 3.218491 224.5140       10.63519 242.1148       16.41531 211.7816       13.96171 140.5508 4.799736 131.5098 4.362607 9.041016       6.486124 
1 1 1 -9  21 23 o 167.3899 4.765432 343.3755       19.41893 369.2718       31.19234 326.9870       24.81410 172.8935 7.420712 163.0021 6.258597 9.891388       9.707575 
1 1 1 -9  21 24 o 141.9913 3.743319 246.6490       12.94124 268.4292       25.54769 239.1313       15.00940 147.3669 7.135232 139.6991 4.414475 7.667862       8.390419 
1 1 1 -9  21 25 f 244.7537 4.216370 733.2877       25.14803 727.4119       36.29909 738.7109       34.87313 243.0708 6.133011 245.1387 5.837717 -2.067841      8.467158 
1 1 1 -9  21 26 o 57.20943 3.610890 40.18683       5.008374 40.88268       8.577421 39.82685       6.169285 57.27456 6.246651 56.83228 4.491027 0.4422798      7.693502 
1 1 1 -9  21 27 o 213.6614 3.887883 558.9014       20.24302 559.6417       29.45567 558.2388       27.86632 213.1554 5.675747 213.0072 5.372741 0.1481628      7.815399 
1 1 1 -9  21 28 o 110.7985 3.141078 150.2309       8.472474 155.8827       13.07666 146.1418       11.12284 112.5479 4.778734 109.0941 4.191670 3.453850       6.356603 
1 1 1 -9  21 29 f 134.1594 3.616429 220.6566       11.81248 234.1989       21.99262 215.1658       14.00393 137.2532 6.594639 132.2974 4.349639 4.955811       7.899913 
1 1 1 -9  21 30 o 49.94248 4.187668 30.85960       5.049688 40.62743       8.048778 24.51920       6.484694 56.97933 5.881043 44.03896 6.215083 12.94038       8.556513 
1 1 1 -9  21 31 o 161.1497 3.433219 318.6016       13.48240 334.3761       20.37510 306.3146       17.98228 164.3415 5.093788 157.4782 4.691078 6.863312       6.924802 
1 1 1 -9  21 32 o 37.90419 4.759077 18.05260       4.299229 16.91908       7.066896 18.71861       5.416967 35.73358 8.278113 38.28156 6.004016 -2.547977      10.22621 
1 1 1 -9  21 33 o 31.56948 8.286726 13.33487       6.454599 13.33487       6.454599 0.000000       0.000000 31.56948 8.286726 ?        ?        0.000000       8.286726 
1 1 1 -9  21 34 o 54.84019 3.722613 37.35393       4.945395 47.71176       8.077746 31.14403       6.254580 61.38038 5.457215 49.57203 5.257631 11.80835       7.577855 
1 1 1 -9  21 35 o 39.13546 4.546466 19.41121       4.255303 11.59424       6.736776 24.60052       5.488933 29.05915 8.776792 43.85865 5.239165 -14.79950      10.22159 
1 1 1 -9  21 36 o 16.16771 6.318008 2.315323       3.604702 1.425149       5.869131 2.854497       4.567735 18.23525 7.699650 17.95817 7.083609 0.2770767      10.46241 
1 1 1 -9  21 37 o 32.07302 5.356436 13.56663       4.038967 12.57424       6.168343 14.31147       5.343883 29.57337 8.248943 32.16357 7.015911 -2.590199      10.82904 
1 1 1 -9  21 38 o 35.52344 5.805655 17.01934       4.852330 21.10819       10.64271 15.94633       5.451961 35.44334 11.09186 33.74019 6.864721 1.703156       13.04430 
1 1 1 -9  21 39 o 26.01736 6.232020 9.585176       3.899158 1.049687       5.446338 18.56002       5.584752 16.68689 7.237525 36.24066 6.565373 -19.55377      9.771688 
1 1 1 -9  21 40 o 30.63632 5.823775 13.23861       4.188996 8.718805       6.018381 17.48598       5.834183 23.54216 8.360255 34.12432 7.240322 -10.58216      11.05966 
1 1 1 -9  21 41 o 13.29922 5.923846 -0.1802721     3.878750 1.818841       5.775303 -1.822926      5.235151 16.93969 7.398496 14.06398 6.500984 2.875706       9.848885 
1 1 1 -9  21 42 o 23.34582 7.300665 8.914670       4.611580 1.397136       5.818402 21.61596       7.562928 16.31873 7.262930 34.77755 8.890771 -18.45882      11.48024 
1 1 1 -9  21 43 o 14.08160 6.106912 1.328097       3.876823 -4.251767      5.541742 6.676173       5.425419 12.74382 6.123052 19.83225 7.750775 -7.088428      9.877564 
1 1 1 -9  21 44 o 14.15704 6.152243 1.671381       3.951248 -0.2288495     6.094921 3.048958       5.189469 14.76258 6.888527 16.12543 7.028560 -1.362841      9.841365 
1 1 1 -9  21 45 o 13.05965 6.057560 -0.4257480     4.604041 -2.010703      5.682957 2.601299       7.853719 13.28911 6.334889 16.58847 7.766274 -3.299363      10.02227 
1 1 1 -9  22 1  o 95.96007 2.921179 112.4062       6.823055 108.7511       9.330579 116.6071       10.00299 94.30228 4.069808 97.64277 4.213831 -3.340485      5.858303 
1 1 1 -9  22 2  o 215.2202 5.313912 566.0956       27.86977 636.4600       42.01040 510.7865       37.24593 227.7237 7.580858 203.9937 7.505283 23.73001       10.66765 
1 1 1 -9  22 3  o 131.1947 4.369701 210.3803       13.95076 0.000000       0.000000 210.3803       13.95076 ?        ?        131.1947 4.369701 0.000000       4.369701 
1 1 1 -9  22 4  o 404.0019 7.103058 1999.481       69.93022 2134.196       126.1752 1939.754       84.01411 414.8796 12.49427 397.3965 8.675452 17.48315       15.21086 
1 1 1 -9  22 5  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -9  22 6  o 64.12085 3.863509 50.35868       6.008942 41.97370       10.27788 54.71322       7.406675 58.05428 7.435436 66.77866 4.579163 -8.724380      8.732379 
1 1 1 -9  22 7  o 21.41891 6.880399 5.470239       4.072010 4.898527       6.966465 5.766940       5.018609 23.51359 8.885915 22.55271 7.655145 0.9608841      11.72863 
1 1 1 -9  22 8  o 192.4345 3.672140 451.8875       17.22020 433.0012       24.25103 471.0950       24.45636 188.1429 5.294664 196.2756 5.117525 -8.132736      7.363595 
1 1 1 -9  22 9  o 152.7632 3.350798 284.7119       12.47393 291.3610       18.37255 279.0258       16.99004 154.3473 4.890834 151.0721 4.620458 3.275192       6.728216 
1 1 1 -9  22 10 o 159.8683 3.403670 311.8358       13.26007 311.1191       19.26526 312.4810       18.27876 159.4851 4.963037 159.8663 4.697048 -0.3811493     6.833300 
1 1 1 -9  22 11 o 15.31614 6.054662 1.555437       3.343723 4.928742       6.031498 0.5871281E-01  4.017615 22.56816 8.319437 14.94637 6.343353 7.621784       10.46189 
1 1 1 -9  22 12 o 187.5803 3.217197 429.2939       14.70622 447.4650       24.32803 418.8304       18.46106 191.2317 5.225384 185.2048 4.090424 6.026947       6.635978 
1 1 1 -9  22 13 o 17.92012 6.204419 3.536878       3.300920 0.7914724      6.076897 4.685980       3.931497 18.89092 7.896560 20.19672 6.775507 -1.305799      10.40496 
1 1 1 -9  22 14 o 125.1941 3.203938 191.3738       9.766680 180.2388       13.92937 202.1418       13.69788 121.3439 4.719614 128.5557 4.378853 -7.211807      6.438098 
1 1 1 -9  22 15 o 96.24186 2.755901 113.0770       6.456785 125.5906       11.25681 106.9413       7.882365 101.2675 4.573317 93.53852 3.464023 7.728981       5.737132 
1 1 1 -9  22 16 o 125.0601 3.161666 190.9821       9.627701 211.7732       14.79256 175.7025       12.68123 131.5373 4.622040 119.8302 4.349910 11.70712       6.347044 
1 1 1 -9  22 17 o 158.1773 3.302353 305.4019       12.72928 305.6777       26.65017 305.3204       14.48890 157.6157 6.955613 158.1143 3.760349 -0.4986420     7.907008 
1 1 1 -9  22 18 f 182.5461 3.171909 406.7336       14.11008 413.8631       23.40317 402.6618       17.68608 183.7902 5.230681 181.5369 3.997889 2.253326       6.583551 
1 1 1 -9  22 19 o 141.9580 2.890121 245.9194       9.997972 231.8781       16.43971 254.1608       12.59485 137.5602 4.912054 144.2577 3.582760 -6.697571      6.079839 
1 1 1 -9  22 20 o 94.49619 3.187438 109.1419       7.329428 116.4258       11.58182 104.2762       9.466079 97.40075 4.895226 92.25317 4.221876 5.147583       6.464324 
1 1 1 -9  22 21 o 104.2557 3.537363 132.9334       8.973999 135.7801       17.92683 131.9816       10.36637 104.7894 7.061436 103.8138 4.105750 0.9755936      8.168296 
1 1 1 -9  22 22 o 122.3870 5.490885 184.0929       16.33452 0.000000       0.000000 184.0929       16.33452 ?        ?        122.3870 5.490885 0.000000       5.490885 
1 1 1 -9  22 23 o 175.8678 4.042217 378.3451       17.32376 378.3488       32.25443 378.3436       20.53744 174.8466 7.588069 175.6612 4.802221 -0.8145447     8.979984 
1 1 1 -9  22 24 o 155.2875 3.375983 294.7016       12.77535 308.7806       19.38856 283.8987       16.98352 158.5875 5.023294 152.1543 4.585675 6.433151       6.801610 
1 1 1 -9  22 25 o 105.4888 3.157820 136.1030       8.108503 147.6432       12.86075 128.4889       10.44638 109.6023 4.827000 102.3426 4.197552 7.259689       6.396824 
1 1 1 -9  22 26 o 77.40450 3.288650 73.38369       6.189124 80.57024       10.02769 68.96143       7.866159 80.82481 5.117476 74.88659 4.328900 5.938225       6.702830 
1 1 1 -9  22 27 o 54.92110 3.697403 37.09800       4.919647 33.86408       8.383108 38.79681       6.075934 51.87027 6.795348 56.04978 4.485807 -4.179512      8.142433 
1 1 1 -9  22 28 o 100.4862 3.500073 123.8033       8.557680 126.7631       16.19679 122.6571       10.07945 100.8810 6.625119 99.89333 4.149646 0.9876862      7.817401 
1 1 1 -9  22 29 o 72.33047 3.308532 64.21297       5.816223 64.09848       9.556805 64.28033       7.330008 71.80760 5.503368 72.21173 4.183346 -0.4041290     6.912847 
1 1 1 -9  22 30 o 13.02858 5.707843 -0.7376693     3.460746 7.263971       6.318419 -4.166959      4.136385 24.87955 8.585383 11.96058 5.611320 12.91897       10.25650 
1 1 1 -9  22 31 o 30.08829 5.521725 11.59729       3.899480 6.475631       6.705177 14.21479       4.793451 24.23844 8.797566 33.23097 6.145590 -8.992531      10.73152 
1 1 1 -9  22 32 o 68.57125 4.635489 58.58704       7.700408 62.15271       9.162047 50.00859       14.21104 70.36972 5.383699 60.98789 9.901196 9.381832       11.27022 
1 1 1 -9  22 33 o 88.96073 3.218232 97.58482       6.965232 80.32153       10.33892 111.9311       9.425037 79.85732 5.343564 94.94641 4.083050 -15.08909      6.724951 
1 1 1 -9  22 34 o 14.88510 6.122517 1.125651       3.571724 0.1149576E-01  5.902819 1.769203       4.486196 17.42824 7.546975 16.92093 6.899384 0.5073090      10.22538 
1 1 1 -9  22 35 o 55.64064 3.685243 38.68852       4.968671 44.47855       8.171318 35.29183       6.258644 58.64277 5.793582 52.60896 4.939637 6.033810       7.613515 
1 1 1 -9  22 36 o 18.99317 6.629519 4.457190       3.772559 5.163285       6.218781 4.046025       4.745494 21.59369 8.337223 19.27915 7.322862 2.314539       11.09656 
1 1 1 -9  22 37 o 24.43369 6.558767 8.314583       3.986706 1.698985       6.146029 13.12024       5.238255 18.32848 7.814551 30.44646 7.177974 -12.11797      10.61087 
1 1 1 -9  22 38 o 43.60511 5.998029 25.97980       6.204879 0.000000       0.000000 25.97980       6.204879 ?        ?        43.60511 5.998029 0.000000       5.998029 
1 1 1 -9  22 39 o 32.69607 5.421885 14.69477       4.168724 9.476963       5.830974 20.14997       5.962146 24.60357 8.251481 37.25924 6.817637 -12.65567      10.70360 
1 1 1 -9  22 40 o 17.06115 6.530783 3.646121       3.793098 -0.5168203     5.550348 7.294063       5.195699 15.29389 6.925665 21.76536 7.763804 -6.471469      10.40392 
1 1 1 -9  22 41 o 28.50801 6.393532 12.24170       4.331882 23.12857       6.848348 4.980406       5.592957 38.04165 7.652770 19.06455 7.729403 18.97710       10.87697 
1 1 1 -9  22 42 o 9.211400 4.507025 -5.186732      3.380573 -4.967357      5.043319 -5.365722      4.555515 11.92212 5.756589 11.07453 5.376688 0.8475838      7.876998 
1 1 1 -9  22 43 o 10.67288 5.102565 -3.179577      3.743902 -3.120330      5.683945 -3.224980      4.975794 13.19782 6.303531 12.35596 5.900444 0.8418560      8.634219 
1 1 1 -9  22 44 o 25.42837 7.607439 12.15412       5.079002 14.96069       6.282250 6.858094       8.629845 26.77404 8.540466 18.96152 8.606087 7.812515       12.12453 
1 1 1 -9  22 45 o 12.68412 5.734161 0.4297937      3.785779 -0.6050302     6.017664 1.107632       4.870325 14.07734 6.654550 14.13299 6.434353 -0.5565548E-01 9.256562 
1 1 1 -9  23 1  o 215.5180 3.439767 566.7557       18.06545 601.9558       28.92521 544.2440       23.13179 221.8844 5.349504 211.0872 4.496881 10.79727       6.988500 
1 1 1 -9  23 2  o 252.3755 3.799446 777.4169       23.36703 766.4534       36.34544 785.1414       30.50776 250.2731 5.959359 253.4747 4.939006 -3.201599      7.740009 
1 1 1 -9  23 3  o 180.3241 3.121881 396.6618       13.71849 406.6422       21.57020 389.8830       17.77708 182.3633 4.858113 178.7026 4.082191 3.660675       6.345514 
1 1 1 -9  23 4  o 218.4782 4.458252 582.9830       23.73607 551.4305       39.33533 601.0513       29.76620 211.8639 7.631322 221.6991 5.509643 -9.835220      9.412398 
1 1 1 -9  23 5  o 78.95035 2.747110 76.10835       5.277205 84.07774       8.177914 70.42191       6.907973 82.88765 4.061072 75.86785 3.748031 7.019798       5.526305 
1 1 1 -9  23 6  o 186.7742 3.170409 425.5693       14.43007 430.2850       22.59467 422.3210       18.75257 187.5774 4.947305 185.9802 4.137691 1.597137       6.449521 
1 1 1 -9  23 7  o 63.66554 3.449311 49.60440       5.331481 28.66698       10.07742 57.74255       6.282759 47.49897 9.036289 68.67756 3.768488 -21.17859      9.790609 
1 1 1 -9  23 8  o 212.2865 3.898360 550.1555       20.16696 576.5212       29.65570 527.4733       27.50622 217.0188 5.612279 207.6049 5.441665 9.413925       7.817250 
1 1 1 -9  23 9  o 236.0069 4.136971 680.1776       23.79267 702.4543       34.68455 660.3784       32.69901 239.5577 5.941415 232.3015 5.776258 7.256195       8.286469 
1 1 1 -9  23 10 o 137.3819 2.928257 230.2321       9.803359 219.8543       15.77412 236.7629       12.51343 134.0301 4.837483 139.2209 3.691639 -5.190765      6.085183 
1 1 1 -9  23 11 o 120.8051 2.844624 178.0180       8.374253 180.0322       13.94615 176.8822       10.47244 121.2755 4.728004 120.3271 3.575447 0.9483871      5.927718 
1 1 1 -9  23 12 o 141.7692 2.928783 245.1914       10.11825 243.7328       16.54459 246.0629       12.78869 141.1173 4.818115 141.9208 3.700961 -0.8035583     6.075470 
1 1 1 -9  23 13 o 139.3597 3.307570 237.0216       11.23265 244.4863       16.64142 230.7746       15.22381 141.3241 4.839262 137.3360 4.555167 3.988159       6.645902 
1 1 1 -9  23 14 o 36.32352 4.482973 16.36926       3.884056 10.05633       6.719601 19.53671       4.759737 28.56290 8.793278 39.64940 5.039913 -11.08649      10.13521 
1 1 1 -9  23 15 o 96.40977 3.202942 113.5672       7.514548 113.3174       11.25760 113.7680       10.09203 96.13531 4.820755 96.38733 4.307459 -0.2520218     6.464818 
1 1 1 -9  23 16 o 179.0417 3.167848 391.2573       13.82148 412.8874       23.23602 379.4135       17.19408 183.5843 5.199094 176.2204 4.003932 7.363907       6.562168 
1 1 1 -9  23 17 o 291.6240 4.738520 1040.426       33.67458 1007.778       67.14353 1051.398       38.92386 285.0344 9.680583 292.9660 5.452084 -7.931641      11.11031 
1 1 1 -9  23 18 o 44.47238 4.279171 24.40386       4.580345 28.81421       7.299723 21.53981       5.882477 48.02977 6.395580 41.48497 5.992239 6.544800       8.764153 
1 1 1 -9  23 19 o 132.8585 3.685459 215.8273       11.92057 224.9324       22.81295 212.4074       13.98115 135.0372 6.955976 131.7083 4.362075 3.328888       8.210560 
1 1 1 -9  23 20 o 102.6196 3.134890 128.7004       7.830313 121.0384       17.65056 130.5779       8.737140 98.82934 7.382196 103.3306 3.474741 -4.501274      8.159083 
1 1 1 -9  23 21 o 167.4422 4.599841 343.5289       18.75134 0.000000       0.000000 343.5289       18.75134 ?        ?        167.4422 4.599841 0.000000       4.599841 
1 1 1 -9  23 22 o 104.1976 3.085049 132.7145       7.824872 129.1525       18.23015 133.5189       8.663529 102.0149 7.383108 104.4764 3.407391 -2.461472      8.131457 
1 1 1 -9  23 23 f 162.2985 3.929467 322.2820       15.54119 308.3392       27.79459 328.6238       18.74533 157.8080 7.246964 163.6746 4.704641 -5.866638      8.640146 
1 1 1 -9  23 24 o 88.05762 3.268508 94.90671       7.001616 96.74106       11.18324 93.72414       8.979219 88.60343 5.202307 87.37389 4.229733 1.229546       6.704823 
1 1 1 -9  23 25 o 86.49328 3.244666 91.58826       6.826809 93.75987       10.85206 90.16603       8.782259 87.20699 5.129166 85.67721 4.219323 1.529778       6.641613 
1 1 1 -9  23 26 o 109.5370 3.200510 146.8648       8.533948 145.1615       13.22657 148.0796       11.17004 108.5392 5.014177 109.8126 4.181777 -1.273415      6.529107 
1 1 1 -9  23 27 o 127.5720 3.242292 199.2914       10.07143 211.9874       15.80276 190.6072       13.06963 131.1436 4.953718 124.5197 4.313656 6.623871       6.568634 
1 1 1 -9  23 28 o 65.84872 3.791988 53.37119       6.059124 59.77090       12.52399 51.41549       6.923305 68.70347 7.607789 64.50716 4.431141 4.196312       8.804173 
1 1 1 -9  23 29 o 21.20649 6.545207 5.618980       3.720115 -3.508265      6.755012 9.592260       4.456879 16.82228 7.626786 27.18158 6.757443 -10.35930      10.18974 
1 1 1 -9  23 30 o 61.85784 3.525983 47.17014       5.293082 48.55492       8.735874 46.36687       6.653450 62.14791 5.836557 61.10476 4.499794 1.043144       7.369773 
1 1 1 -9  23 31 o 50.02103 5.445843 31.57910       6.531204 35.93046       8.001752 22.89393       11.30477 53.09480 6.307510 40.58811 11.10822 12.50669       12.77409 
1 1 1 -9  23 32 o 112.1751 3.666712 155.5595       10.00980 151.0785       13.39130 161.2334       15.06868 109.8601 5.015262 113.2107 5.478261 -3.350540      7.427261 
1 1 1 -9  23 33 o 52.79115 4.231657 34.92025       5.398313 36.28931       7.918105 33.73124       7.379098 52.98756 6.252388 51.16364 6.034370 1.823929       8.689418 
1 1 1 -9  23 34 o 28.96777 5.900639 11.10461       4.023713 17.49407       7.087137 8.065374       4.887881 35.44099 8.344966 24.50380 7.491460 10.93719       11.21430 
1 1 1 -9  23 35 o 21.49168 6.649850 6.160640       3.837200 11.59232       6.345614 3.029546       4.817864 28.55892 8.493506 18.32502 7.260293 10.23390       11.17370 
1 1 1 -9  23 36 o 17.14680 6.525128 3.142460       3.772241 0.3806712      6.111984 4.841793       4.794312 17.42058 7.609760 20.01245 7.410112 -2.591867      10.62159 
1 1 1 -9  23 37 o 39.61531 6.301940 21.61509       5.880205 0.000000       0.000000 21.61509       5.880205 ?        ?        39.61531 6.301940 0.000000       6.301940 
1 1 1 -9  23 38 o 24.35313 6.437590 8.565529       3.877776 2.119821       5.613669 14.44829       5.362927 17.53450 7.471995 31.25271 7.191242 -13.71822      10.37037 
1 1 1 -9  23 39 o 27.28203 6.299698 10.86267       4.103639 17.00756       6.400610 6.573914       5.347247 32.68385 8.082084 21.10010 7.823377 11.58375       11.24835 
1 1 1 -9  23 40 o 33.35224 5.436077 15.69581       4.266179 15.44303       6.420961 15.89559       5.708299 30.15030 8.418479 31.63867 7.515791 -1.488373      11.28530 
1 1 1 -9  23 41 o 25.77720 7.331901 10.98919       4.823976 8.437920       6.353183 14.46270       7.413063 21.88529 8.432906 27.07062 9.301060 -5.185333      12.55482 
1 1 1 -9  23 42 o 21.51508 6.797151 7.705363       3.987481 -0.7668242     5.671547 15.98670       5.607302 14.43623 6.705392 30.40921 7.590932 -15.97299      10.12840 
1 1 1 -9  23 43 o 29.25356 6.018032 13.48946       4.146882 14.66640       6.528597 12.69345       5.369118 26.37488 8.728312 25.89280 7.838604 0.4820843      11.73146 
1 1 1 -9  23 44 f 15.17757 6.680633 2.553396       4.791796 3.664653       6.155147 0.8437329      7.634603 16.52680 7.404768 15.76578 7.465404 0.7610197      10.51489 
1 1 1 -9  24 1  f 151.5963 2.930033 280.3496       10.82423 305.5501       17.20121 263.8287       13.92748 158.0757 4.469860 146.9436 3.892857 11.13213       5.927392 
1 1 1 -9  24 2  o 144.8996 3.169798 256.1771       11.19271 252.6927       15.42241 260.0547       16.26927 143.7513 4.407759 145.8110 4.584391 -2.059677      6.359636 
1 1 1 -9  24 3  o 240.9721 4.817227 709.7701       28.28785 0.000000       0.000000 709.7701       28.28785 ?        ?        240.9721 4.817227 0.000000       4.817227 
1 1 1 -9  24 4  o 128.8768 2.778353 202.5887       8.725662 191.2721       13.11471 211.5771       11.68805 125.0590 4.309799 131.6042 3.648005 -6.545158      5.646442 
1 1 1 -9  24 5  o 199.6949 3.682282 486.7996       17.91926 527.5347       26.10838 450.5213       24.63876 207.6961 5.158406 191.8502 5.275127 15.84590       7.378084 
1 1 1 -9  24 6  o 277.5705 4.073267 940.9185       27.55194 933.2983       43.13388 946.1703       35.80913 275.9755 6.413750 278.1260 5.283431 -2.150543      8.309683 
1 1 1 -9  24 7  o 150.3301 3.310563 275.7828       12.12785 256.0564       23.56598 282.8895       14.14475 144.3546 6.717554 152.1685 3.817486 -7.813889      7.726495 
1 1 1 -9  24 8  o 284.1640 5.392981 987.9853       37.34513 905.9977       61.55284 1035.746       46.97985 270.8419 9.339991 290.6423 6.633102 -19.80042      11.45572 
1 1 1 -9  24 9  o 98.59387 3.313113 118.7653       7.948862 132.1171       12.10177 108.6339       10.54177 103.8462 4.795079 94.16576 4.607924 9.680481       6.650244 
1 1 1 -9  24 10 o 137.8040 2.935252 231.6807       9.856965 224.1223       16.11815 236.1962       12.45809 135.2944 4.896842 139.0408 3.680061 -3.746353      6.125513 
1 1 1 -9  24 11 o 191.4901 3.300592 447.5414       15.40190 444.0630       24.93341 449.6876       19.58540 190.4034 5.379058 191.8497 4.189240 -1.446259      6.817918 
1 1 1 -9  24 12 o 95.77283 3.271784 112.0832       7.624737 115.5663       11.56707 109.4068       10.13943 97.07973 4.905331 94.50875 4.414762 2.570976       6.599424 
1 1 1 -9  24 13 o 138.6080 2.931542 234.4247       9.901949 231.6708       16.29680 236.0363       12.46716 137.5338 4.870156 138.9778 3.684422 -1.443985      6.106831 
1 1 1 -9  24 14 o 86.32372 3.289514 91.09758       6.907207 86.12849       10.22682 95.26564       9.366335 83.74260 5.034638 88.16957 4.372926 -4.426971      6.668588 
1 1 1 -9  24 15 o 164.2688 3.098110 329.3579       12.40189 327.6985       20.41354 330.3287       15.61372 163.5292 5.128899 164.4279 3.896678 -0.8987274     6.441250 
1 1 1 -9  24 16 o 187.1430 4.187248 428.1526       19.09583 432.5471       35.00598 426.2910       22.78440 187.2124 7.689480 186.5344 5.016918 0.6779175      9.181371 
1 1 1 -9  24 17 o 85.24890 3.760720 88.96964       7.793379 75.31058       14.90694 94.10715       9.142286 77.73411 7.982692 87.61879 4.294837 -9.884682      9.064713 
1 1 1 -9  24 18 o 234.9192 4.107335 674.7995       23.51336 656.6616       47.93769 680.5457       26.98213 230.2385 8.558936 235.7899 4.695858 -5.551407      9.762503 
1 1 1 -9  24 19 o 169.9659 3.461816 352.9262       14.33844 360.4173       30.83362 350.8593       16.19620 170.7906 7.426147 169.4035 3.923326 1.387100       8.398819 
1 1 1 -9  24 20 o 129.3050 2.921470 204.1331       9.205612 193.4964       15.40552 210.0405       11.48076 125.5408 5.045931 131.0453 3.598522 -5.504585      6.197643 
1 1 1 -9  24 21 o 180.2882 3.582121 397.3409       15.73779 389.5536       33.41635 399.5605       17.84018 177.2864 7.753520 180.7086 4.051205 -3.422226      8.748104 
1 1 1 -9  24 22 o 183.6657 3.234437 412.2183       14.47648 406.5091       24.02347 415.4735       18.13992 181.8309 5.427731 184.2394 4.040329 -2.408463      6.766426 
1 1 1 -9  24 23 o 100.6775 2.801869 123.8877       6.867422 116.5525       11.97300 127.4841       8.383568 97.30055 5.066997 102.0581 3.375539 -4.757576      6.088408 
1 1 1 -9  24 24 o 140.8150 2.928853 242.2846       10.05038 233.6996       17.09211 246.8216       12.42550 137.8137 5.098196 141.9817 3.594139 -4.168015      6.237743 
1 1 1 -9  24 25 o 134.2702 3.723626 220.9755       12.17201 222.7779       22.98974 220.2735       14.34805 133.7912 7.076484 133.8989 4.403224 -0.1076508     8.334567 
1 1 1 -9  24 26 o 138.1984 3.321378 233.7983       11.18555 234.2560       17.13633 233.4586       14.76479 137.8033 5.111821 137.7865 4.402936 0.1675415E-01  6.746596 
1 1 1 -9  24 27 o 138.1793 3.732088 234.4028       12.55547 241.7394       23.94814 231.6219       14.74430 138.9790 7.094565 137.1505 4.417307 1.828552       8.357360 
1 1 1 -9  24 28 o 108.0627 3.256727 143.2842       8.566382 155.5766       13.80983 135.5959       10.92154 112.0585 5.070305 104.8530 4.283340 7.205536       6.637393 
1 1 1 -9  24 29 o 68.91792 3.426189 58.48354       5.736086 65.07774       9.736400 54.97812       7.098834 72.10502 5.584611 66.58781 4.399431 5.517204       7.109351 
1 1 1 -9  24 30 o 68.21793 4.682703 57.99272       7.737292 58.64141       9.462697 56.68414       13.43985 68.22190 5.745209 65.76632 8.591192 2.455582       10.33518 
1 1 1 -9  24 31 o 84.21954 3.693173 87.76365       7.561212 86.05679       10.80287 89.40290       10.58674 82.68678 5.390651 84.39086 5.172760 -1.704079      7.471048 
1 1 1 -9  24 32 o 14.42040 5.954139 0.9560136      3.395149 6.150412       6.528428 -0.9696742     3.974971 23.32614 8.645182 13.67104 6.048134 9.655104       10.55079 
1 1 1 -9  24 33 o 88.13017 3.293052 96.29143       7.059839 97.92444       11.02525 95.15650       9.191340 87.77857 5.177221 87.05650 4.346275 0.7220688      6.759713 
1 1 1 -9  24 34 o 65.66814 3.989354 54.23749       6.353890 55.71709       8.909362 52.70603       9.064153 65.56654 5.630539 63.56115 5.920003 2.005398       8.170032 
1 1 1 -9  24 35 o 31.04024 5.802098 12.94265       4.227482 18.69196       6.930952 9.536569       5.334727 36.07261 8.085086 25.90592 7.807179 10.16669       11.23925 
1 1 1 -9  24 36 o 32.01738 6.387368 14.23038       4.808809 13.79986       10.00235 14.35981       5.484200 29.20261 10.72231 31.62385 7.268869 -2.421244      12.95393 
1 1 1 -9  24 37 o 33.18873 5.459237 15.02099       4.261901 17.69409       6.493757 12.99835       5.648691 34.17035 7.948815 29.27559 7.784102 4.894754       11.12546 
1 1 1 -9  24 38 o 28.00745 6.046061 11.23722       4.005441 12.16003       6.268538 10.60047       5.207098 27.25133 8.510255 26.05205 7.680233 1.199280       11.46344 
1 1 1 -9  24 39 o 38.11082 4.791200 19.75656       4.351575 21.13404       6.688289 18.74543       5.730293 36.58369 7.743944 35.23845 6.920105 1.345245       10.38540 
1 1 1 -9  24 40 o 20.10871 7.132320 6.349443       4.379112 4.804444       5.739948 8.501009       6.773624 18.78414 7.747476 22.09253 8.652709 -3.308390      11.61433 
1 1 1 -9  24 41 o 21.16435 6.805345 7.342715       3.982971 4.821765       5.917863 9.430330       5.385275 18.36027 7.740882 22.86095 7.924283 -4.500679      11.07770 
1 1 1 -9  24 42 f 18.42787 6.758013 5.625322       3.971518 5.190227       6.102924 5.944925       5.230593 18.13769 7.761567 18.66329 7.507507 -0.5256004     10.79836 
1 1 1 -9  24 43 o 11.32902 5.478051 -4.019076      4.607653 -4.088729      5.837561 -3.903966      7.504401 12.67997 6.139630 14.14148 6.873790 -1.461515      9.216509 
1 1 1 -9  25 1  o 99.17217 2.758180 120.0695       6.659268 115.6042       9.860451 123.8141       9.029563 97.18539 4.173236 100.6316 3.688346 -3.446205      5.569541 
1 1 1 -9  25 2  o 141.6122 3.242730 244.7427       11.19045 237.1285       21.09209 247.7257       13.20170 138.9506 6.245029 142.3785 3.808374 -3.427856      7.314650 
1 1 1 -9  25 3  o 104.7233 2.737403 133.8712       6.979846 126.5193       10.24362 140.2428       9.536284 101.6829 4.142662 107.1126 3.658815 -5.429726      5.527076 
1 1 1 -9  25 4  o 226.7988 3.563962 627.9622       19.69745 614.0980       30.38168 638.0156       25.87150 223.9678 5.566600 228.4516 4.647201 -4.483719      7.251449 
1 1 1 -9  25 5  o 281.1664 4.598896 966.3823       31.51034 911.3853       42.87832 1030.956       46.46178 272.6187 6.454255 289.9156 6.576398 -17.29697      9.214467 
1 1 1 -9  25 6  o 115.8675 2.766135 163.7755       7.810363 158.8795       11.82586 167.5633       10.40172 113.9496 4.266303 117.0915 3.649846 -3.141907      5.614510 
1 1 1 -9  25 7  f 66.11497 4.037157 53.59553       6.473455 47.77077       10.52063 57.14449       8.212079 61.97384 7.093900 68.17007 4.977677 -6.196236      8.666065 
1 1 1 -9  25 8  o 94.94143 3.227866 110.1395       7.457193 112.8602       14.43935 109.1498       8.708442 95.74709 6.222210 94.46286 3.790759 1.284225       7.285997 
1 1 1 -9  25 9  o 225.9799 4.017668 623.8687       22.12483 619.6321       44.05798 625.2973       25.58476 224.1724 8.078244 226.1384 4.642704 -1.966019      9.317334 
1 1 1 -9  25 10 o 173.9207 3.183684 369.1880       13.49327 399.4442       22.72811 352.7195       16.76809 180.5831 5.170081 169.9082 4.049797 10.67491       6.567389 
1 1 1 -9  25 11 o 42.60405 4.325311 22.41360       4.428426 19.26156       7.478783 24.11549       5.495409 38.82593 8.163892 44.08181 5.216670 -5.255878      9.688280 
1 1 1 -9  25 12 o 107.7406 3.300057 141.8438       8.654151 133.0781       12.78905 149.2481       11.75399 104.1507 5.054035 110.4014 4.377605 -6.250679      6.686306 
1 1 1 -9  25 13 o 185.8533 3.675691 421.9200       16.64736 391.0061       23.53662 452.8671       23.54924 178.5744 5.414905 192.2750 5.030267 -13.70064      7.390858 
1 1 1 -9  25 14 f 170.5114 4.011931 355.3477       16.67028 368.5545       30.37193 349.6536       19.94276 172.9086 7.223994 168.9513 4.848830 3.957291       8.700416 
1 1 1 -9  25 15 o 289.4345 6.667760 1029.799       47.02906 0.000000       0.000000 1029.799       47.02906 ?        ?        289.4345 6.667760 0.000000       6.667760 
1 1 1 -9  25 16 o 120.6131 3.184164 177.7510       9.350740 167.6272       19.71769 180.6884       10.62101 116.5004 6.977293 121.5605 3.589328 -5.060066      7.846394 
1 1 1 -9  25 17 o 128.4389 2.938874 201.3828       9.198430 206.6718       15.96834 198.7562       11.25300 129.7768 5.058935 127.4845 3.625904 2.292358       6.224147 
1 1 1 -9  25 18 o 102.8027 2.884624 129.1203       7.219387 123.9651       12.43277 131.7429       8.867544 100.4366 5.096376 103.7749 3.511566 -3.338318      6.189034 
1 1 1 -9  25 19 o 55.40857 3.432474 37.65956       4.611930 42.59321       8.496076 35.59844       5.491425 58.55791 6.040411 53.76958 4.224860 4.788330       7.371296 
1 1 1 -9  25 20 o 167.5419 3.479865 343.1284       14.20764 338.6188       21.27535 346.7582       19.08750 166.0108 5.265676 168.1467 4.662771 -2.135971      7.033404 
1 1 1 -9  25 21 o 48.39448 3.702675 28.81444       4.333481 19.02164       8.518413 32.23364       5.033474 38.29833 9.235403 51.15266 4.071548 -12.85433      10.09308 
1 1 1 -9  25 22 o 60.44257 3.213770 44.78075       4.716610 36.71169       8.778725 48.05527       5.592339 54.09697 6.809755 62.56272 3.684416 -8.465752      7.742589 
1 1 1 -9  25 23 o 137.1653 2.931690 229.9221       9.799374 237.2254       17.13212 226.3708       11.94664 138.8280 5.072579 135.9510 3.609205 2.876938       6.225545 
1 1 1 -9  25 24 o 114.9056 2.853332 161.3831       7.989684 160.7969       14.18530 161.6555       9.669282 114.1898 5.110657 114.8665 3.458275 -0.6766739     6.170776 
1 1 1 -9  25 25 o 127.1637 2.889839 197.7511       8.955151 190.0486       15.60682 201.5319       10.93428 124.0609 5.173658 128.2169 3.502804 -4.156052      6.247910 
1 1 1 -9  25 26 o 77.24396 3.164453 73.18890       5.944000 67.17403       14.17383 74.47243       6.547568 72.63303 8.148190 77.86910 3.459107 -5.236076      8.852029 
1 1 1 -9  25 27 o 56.57836 3.683960 39.47955       5.051651 39.67229       8.863893 39.38683       6.147768 55.97910 6.626061 56.34208 4.515404 -0.3629723     8.018326 
1 1 1 -9  25 28 f 63.84481 3.574649 50.26755       5.539332 62.29614       9.837188 44.68259       6.703066 70.45485 5.780378 59.93480 4.625182 10.52005       7.403045 
1 1 1 -9  25 29 o 52.10479 5.644094 34.32806       7.052218 30.96232       8.697275 40.78884       12.04995 48.75832 7.564761 55.30008 9.269492 -6.541759      11.96449 
1 1 1 -9  25 30 o 23.65220 6.772497 7.318743       4.102491 9.224527       7.338818 6.452497       4.947773 27.03243 9.255444 22.78457 7.600227 4.247862       11.97609 
1 1 1 -9  25 31 o 38.18129 4.569451 18.45311       4.167253 21.04682       7.517210 17.30238       5.007056 39.41401 8.097594 36.53963 5.818091 2.874386       9.971019 
1 1 1 -9  25 32 o 48.80429 4.052394 29.91304       4.776105 31.14630       8.292729 29.30091       5.842382 48.30019 7.270759 47.89619 5.083079 0.4039993      8.871394 
1 1 1 -9  25 33 o 10.90687 5.123597 -3.293681      3.467900 -5.022136      6.034896 -2.441535      4.237385 14.45557 6.780564 12.94501 5.934416 1.510570       9.010735 
1 1 1 -9  25 34 o 48.78022 4.209866 30.31276       4.955433 25.95424       7.796705 33.26672       6.418666 43.00265 7.723987 50.49994 5.294377 -7.497288      9.364316 
1 1 1 -9  25 35 o 39.02140 5.394741 20.26325       4.992823 24.73220       10.32186 18.89823       5.704607 38.80919 10.61148 36.93744 6.578794 1.871742       12.48536 
1 1 1 -9  25 36 o 59.79602 6.316777 49.51163       9.065618 0.000000       0.000000 49.51163       9.065618 ?        ?        59.79602 6.316777 0.000000       6.316777 
1 1 1 -9  25 37 o 30.83592 5.932267 13.43840       4.295910 20.00547       6.924129 9.328546       5.477627 35.76933 8.128790 24.41782 7.990788 11.35151       11.39868 
1 1 1 -9  25 38 o 31.35469 5.528210 13.83635       4.069688 7.092041       6.420893 18.36502       5.261523 21.59685 8.434379 35.54330 6.305493 -13.94645      10.53081 
1 1 1 -9  25 39 o 18.77692 6.766181 5.214260       3.957117 1.412299       6.025358 8.097800       5.247375 16.61320 7.392661 22.15591 7.812143 -5.542717      10.75551 
1 1 1 -9  25 40 o 17.06864 6.476391 4.176218       3.709433 4.499307       5.799652 3.952548       4.825521 18.20805 7.669189 17.31281 7.118273 0.8952389      10.46357 
1 1 1 -9  25 41 o 17.05710 6.624504 4.403480       3.943496 12.85041       6.139503 -1.529022      5.145207 25.45854 8.465530 13.39695 6.276581 12.06159       10.53853 
1 1 1 -9  25 42 o 10.68187 5.079531 -2.568599      3.608388 1.274118       5.869129 -4.903776      4.575243 15.27401 6.995410 10.97948 5.343709 4.294532       8.802896 
1 1 1 -9  26 1  o 33.94938 5.690306 14.49991       4.541211 13.48917       6.519037 15.45277       6.329635 32.46133 8.230762 34.76724 7.676399 -2.305916      11.25489 
1 1 1 -9  26 2  o 111.4791 3.062055 151.7825       8.310572 166.1981       11.75365 137.3704       11.75220 116.5452 4.145092 105.8924 4.564987 10.65282       6.166109 
1 1 1 -9  26 3  o 234.2401 4.066072 670.4444       23.20985 684.6066       32.91107 656.4316       32.73698 236.3745 5.713541 231.3656 5.810955 5.008820       8.149340 
1 1 1 -9  26 4  o 229.5737 4.011051 643.9501       22.43967 636.7714       31.22991 651.6122       32.26434 227.9871 5.621141 230.6015 5.741488 -2.614456      8.035043 
1 1 1 -9  26 5  o 79.43620 3.139293 77.13595       6.064993 80.60152       8.145229 72.82352       9.086088 81.10907 4.134595 77.00005 4.867184 4.109016       6.386263 
1 1 1 -9  26 6  o 51.24113 4.281754 32.31597       5.297754 33.57666       6.140523 28.64548       10.47762 52.16064 4.887818 47.31948 9.417595 4.841160       10.61046 
1 1 1 -9  26 7  o 120.9557 3.694919 178.8562       10.87822 213.1523       19.73088 163.8788       13.03893 131.6823 6.165815 115.6628 4.635459 16.01949       7.713933 
1 1 1 -9  26 8  o 134.9621 3.761226 222.6693       12.35815 202.2026       20.30064 234.7196       15.57704 128.1740 6.520833 138.4538 4.623315 -10.27979      7.993516 
1 1 1 -9  26 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -9  26 10 o 149.9707 3.871590 274.9944       14.13737 261.5550       24.20477 281.9531       17.41697 145.7210 6.835252 151.7313 4.716163 -6.010269      8.304388 
1 1 1 -9  26 11 o 117.2315 3.698562 168.0594       10.55284 144.7339       17.73222 180.8510       13.13139 108.3108 6.751810 121.5205 4.441771 -13.20970      8.081848 
1 1 1 -9  26 12 o 73.94115 3.344543 66.89907       6.010815 70.90549       12.63833 65.72792       6.833106 75.61733 6.935729 73.23988 3.841987 2.377457       7.928758 
1 1 1 -9  26 13 o 101.4897 3.222390 125.8935       7.959491 147.1977       17.30799 120.1796       8.963549 109.2483 6.531050 99.10563 3.718059 10.14268       7.515223 
1 1 1 -9  26 14 o 137.5576 3.334477 231.0964       11.17760 219.1220       24.66572 234.1909       12.53899 133.0759 7.638120 138.3862 3.721585 -5.310303      8.496532 
1 1 1 -9  26 15 o 185.3475 3.290373 419.5878       14.86168 447.0127       25.25060 405.0522       18.38297 190.8377 5.435181 181.9805 4.145288 8.857162       6.835539 
1 1 1 -9  26 16 o 122.0253 2.948221 181.7954       8.766899 207.0251       15.74125 170.4508       10.55548 129.8809 4.982693 118.0341 3.674206 11.84673       6.190882 
1 1 1 -9  26 17 f 43.55009 4.133817 23.41249       4.334555 14.34523       7.586480 27.80700       5.281503 33.42323 9.080381 47.42525 4.628805 -14.00203      10.19211 
1 1 1 -9  26 18 o 99.37799 3.197066 120.7810       7.732366 113.8310       16.82534 122.6418       8.706214 95.72890 7.266768 100.0952 3.575015 -4.366325      8.098558 
1 1 1 -9  26 19 o 77.48137 3.386090 73.52301       6.377961 92.57695       10.82149 63.38142       7.894920 86.69378 5.145420 71.77473 4.536994 14.91905       6.860004 
1 1 1 -9  26 20 o 117.3697 2.906412 168.2737       8.312834 152.6224       13.94841 176.8947       10.35214 111.3608 5.153896 120.2142 3.537617 -8.853439      6.251190 
1 1 1 -9  26 21 o 119.3182 2.925913 173.9523       8.507543 175.8197       14.89526 173.0482       10.36443 119.5061 5.126647 118.8720 3.582000 0.6340942      6.254057 
1 1 1 -9  26 22 o 215.9655 3.548458 570.9113       18.67498 625.0270       32.20813 543.5037       22.92130 224.9980 5.879264 210.4352 4.469764 14.56279       7.385427 
1 1 1 -9  26 23 f 129.5425 2.922190 205.1801       9.224796 223.9610       16.73539 196.9832       11.05609 134.7707 5.104933 126.7686 3.582528 8.002136       6.236574 
1 1 1 -9  26 24 o 85.61616 2.892336 89.75835       6.025827 104.8625       11.73814 84.35358       7.021664 92.04278 5.255111 82.90182 3.483443 9.140961       6.304805 
1 1 1 -9  26 25 f 51.89581 3.640557 33.20378       4.574802 23.59393       11.78468 34.90894       4.964110 41.87809 11.29184 53.18071 3.856668 -11.30262      11.93229 
1 1 1 -9  26 26 o 20.70552 6.041884 5.448250       3.236669 6.630201       7.696280 5.194292       3.567484 25.23150 9.379991 20.46180 6.424495 4.769701       11.36918 
1 1 1 -9  26 27 o 28.39533 5.293028 10.33072       3.527870 11.04428       7.834532 10.14924       3.951119 29.37232 9.552860 27.99176 5.974329 1.380552       11.26720 
1 1 1 -9  26 28 f 39.17551 8.422491 20.50187       7.801410 19.14954       11.04969 21.84600       11.01611 37.22931 11.23962 39.63401 11.01203 -2.404701      15.73511 
1 1 1 -9  26 29 o 41.92961 4.333532 22.05224       4.364178 29.62090       8.438882 19.28903       5.098970 47.45239 7.550508 38.82618 5.546619 8.626209       9.368840 
1 1 1 -9  26 30 o 29.05619 5.834245 11.06040       3.987397 19.58869       7.585743 7.804383       4.687169 37.82713 8.443369 24.30383 7.316610 13.52331       11.17243 
1 1 1 -9  26 31 o 19.52304 6.595567 4.726843       3.725217 2.502180       6.794523 5.682985       4.454388 20.21799 8.392333 21.26015 7.212049 -1.042162      11.06548 
1 1 1 -9  26 32 o 16.55816 6.405130 2.596553       3.675539 7.287727       6.667580 0.5486717      4.405343 24.03401 8.765497 15.49264 6.611053 8.541368       10.97907 
1 1 1 -9  26 33 o 70.28683 3.614935 62.05105       6.170908 57.59345       9.550611 65.24572       8.085257 66.00764 6.003062 71.37078 4.674489 -5.363136      7.608390 
1 1 1 -9  26 34 o 74.39837 4.036634 70.49429       7.291036 69.95576       14.61774 70.67264       8.412132 68.70421 8.942973 73.93558 4.693143 -5.231369      10.09962 
1 1 1 -9  26 35 o 41.67253 5.986400 23.86294       5.904994 0.000000       0.000000 23.86294       5.904994 ?        ?        41.67253 5.986400 0.000000       5.986400 
1 1 1 -9  26 36 o 26.56622 6.408396 10.24510       4.100478 13.10371       6.604732 8.452226       5.230618 28.30833 8.718312 23.49011 7.813912 4.818214       11.70753 
1 1 1 -9  26 37 o 19.04799 7.156430 5.008008       4.503887 3.002966       6.379862 7.000023       6.359104 18.39439 7.904711 21.59648 8.405272 -3.202082      11.53833 
1 1 1 -9  26 38 o 29.19922 6.183157 12.63315       4.262474 17.53198       6.823796 9.498671       5.458369 31.87424 8.591644 23.82184 7.983418 8.052404       11.72823 
1 1 1 -9  26 39 f 13.03773 5.989087 -1.036336      4.345791 -0.8767453E-01 5.990753 -2.090037      6.313712 15.39792 7.057895 14.69421 6.906047 0.7037039      9.874582 
1 1 1 -9  26 40 o 14.30012 6.087524 1.847896       3.719467 4.414337       6.138297 0.3588474      4.675593 17.87073 7.717235 14.08225 6.368759 3.788476       10.00584 
1 1 1 -9  26 41 f 16.15015 6.470891 3.778675       3.869678 6.624559       6.271805 2.029355       4.917209 19.08183 8.002404 15.20426 6.726637 3.877580       10.45400 
1 1 1 -9  26 42 o 32.01798 7.113774 17.92070       5.406300 18.28688       7.124352 17.42356       8.301191 28.55785 9.093244 25.73693 9.705687 2.820913       13.29990 
1 1 1 -9  27 1  o 199.2074 3.339935 484.5725       16.21360 458.4677       24.33340 505.4162       21.74355 193.4076 5.167522 203.2867 4.389201 -9.879028      6.779998 
1 1 1 -9  27 2  o 73.16523 2.966072 65.44280       5.277416 64.72862       7.606736 66.10558       7.327861 72.62875 4.317356 73.42364 4.111912 -0.7948914     5.962162 
1 1 1 -9  27 3  o 37.45383 4.119594 17.35297       3.697980 15.97650       5.074800 18.91137       5.399784 35.59934 6.067149 38.83767 5.889970 -3.238331      8.455888 
1 1 1 -9  27 4  f 96.30140 2.768003 113.2577       6.489098 118.7099       9.846785 109.0721       8.627548 98.46017 4.112967 94.41138 3.757467 4.048782       5.570912 
1 1 1 -9  27 5  o 95.79659 3.825044 112.3094       8.911453 126.7278       15.17691 104.7226       11.00910 101.4290 6.169416 92.36493 4.908751 9.064049       7.884005 
1 1 1 -9  27 6  o 91.69438 2.804304 102.6974       6.258831 95.08429       9.073489 109.6080       8.644717 88.08397 4.239536 94.64211 3.755722 -6.558144      5.663843 
1 1 1 -9  27 7  o 115.5556 2.799997 162.9510       7.884691 158.7435       11.68945 166.4632       10.68006 113.8653 4.220059 116.6620 3.761633 -2.796646      5.653210 
1 1 1 -9  27 8  f 34.46709 6.136539 15.01275       4.965267 14.17149       8.302110 15.48123       6.195418 33.42338 9.654222 34.79409 7.526062 -1.370716      12.24114 
1 1 1 -9  27 9  o 91.82122 3.238714 103.0744       7.235544 118.5473       14.88854 98.29005       8.278943 98.05351 6.263682 89.60471 3.800101 8.448799       7.326287 
1 1 1 -9  27 10 o 170.8906 4.072102 357.0508       16.95793 377.5654       30.30999 347.7034       20.45979 174.9760 7.123283 168.4217 4.990527 6.554291       8.697500 
1 1 1 -9  27 11 o 121.1623 3.262878 179.4056       9.625181 184.8461       19.64536 177.6871       11.04119 122.4283 6.609299 120.5208 3.764009 1.907509       7.605958 
1 1 1 -9  27 12 o 157.7137 3.138362 303.7304       12.06170 289.6675       19.53212 312.3989       15.33502 153.6372 5.224554 159.8490 3.936754 -6.211792      6.541712 
1 1 1 -9  27 13 o 110.2700 3.956638 148.8756       10.61488 118.1032       20.09858 160.7793       12.50050 97.28371 8.565288 114.5215 4.487928 -17.23778      9.669831 
1 1 1 -9  27 14 o 111.7155 3.010126 152.5051       8.187256 138.4930       13.80480 160.1077       10.16863 106.1182 5.355624 114.3915 3.652493 -8.273293      6.482547 
1 1 1 -9  27 15 o 104.5830 2.994847 133.6771       7.624729 107.0566       12.42531 149.7561       9.656665 93.22524 5.493727 110.6278 3.586751 -17.40253      6.560932 
1 1 1 -9  27 16 o 39.12699 4.627313 19.01637       4.326778 21.09916       8.142317 18.19681       5.107604 40.49447 8.521410 38.07685 5.677831 2.417622       10.23974 
1 1 1 -9  27 17 o 56.42065 3.889973 39.13406       5.315626 50.81269       12.88584 36.73917       5.835255 63.39263 8.559919 54.58523 4.424711 8.807400       9.635885 
1 1 1 -9  27 18 o 93.63408 3.347412 107.3158       7.625703 125.7951       12.58323 96.58989       9.586671 101.0883 5.124767 88.66550 4.451109 12.42281       6.787902 
1 1 1 -9  27 19 o 133.3349 2.991065 217.2356       9.718646 220.6298       16.62090 215.4722       11.98011 133.9146 5.102531 132.6400 3.710026 1.274643       6.308733 
1 1 1 -9  27 20 o 126.5593 2.949934 195.7629       9.097930 187.0486       15.39389 200.4407       11.27845 123.2223 5.137795 127.9123 3.621916 -4.690056      6.286113 
1 1 1 -9  27 21 o 136.1171 2.982669 226.5336       9.893587 236.3379       17.14623 221.6401       12.11358 138.4849 5.089433 134.4639 3.700359 4.021088       6.292454 
1 1 1 -9  27 22 o 140.1266 3.000199 240.1811       10.24488 253.9305       17.94828 233.5364       12.47719 143.4536 5.142549 137.9830 3.714069 5.470566       6.343510 
1 1 1 -9  27 23 o 116.2892 3.190019 165.7183       9.031466 180.6574       21.48530 162.5120       9.953571 119.9610 7.385430 115.0787 3.553602 4.882309       8.195893 
1 1 1 -9  27 24 o 65.12492 3.408941 52.15511       5.391232 45.99939       13.47350 53.32858       5.882699 59.26023 9.662623 65.80548 3.683112 -6.545250      10.34077 
1 1 1 -9  27 25 o 45.57062 3.764359 25.70752       4.143090 27.44310       8.635707 25.18860       4.722017 45.91486 8.009180 44.98388 4.362289 0.9309845      9.120117 
1 1 1 -9  27 26 o 39.80112 5.071114 19.98002       4.806980 13.60394       8.128178 23.40952       5.961180 31.99735 9.635492 42.90691 5.853723 -10.90957      11.27425 
1 1 1 -9  27 27 o 22.46680 6.972104 6.433976       4.214564 9.779776       7.426512 4.844538       5.118665 27.75243 9.312286 21.07605 7.681165 6.676378       12.07141 
1 1 1 -9  27 28 o 33.42443 4.316806 14.09770       3.434083 17.30801       7.894100 13.34838       3.813863 35.49818 9.087757 32.32132 5.003718 3.176857       10.37422 
1 1 1 -9  27 29 o 73.38706 3.570707 66.82982       6.366553 46.28958       13.98593 72.19862       7.150349 57.26848 10.40479 76.16764 3.864938 -18.89916      11.09943 
1 1 1 -9  27 30 o 20.83755 6.500481 5.655434       3.658412 8.709210       6.595210 4.298149       4.396890 25.69617 8.774641 19.47203 7.115566 6.224142       11.29715 
1 1 1 -9  27 31 o 28.31102 6.062990 10.75234       4.056843 12.00738       7.023893 10.12407       4.969576 29.00446 9.000668 27.05488 7.348852 1.949587       11.61971 
1 1 1 -9  27 32 o 53.61803 3.879868 36.34844       5.035195 38.44268       8.616041 35.26226       6.205049 53.25386 6.793755 52.23127 4.933500 1.022591       8.396103 
1 1 1 -9  27 33 o 55.20750 4.362337 39.18639       5.821191 29.17371       11.60188 42.55514       6.729580 41.73690 11.18216 57.17868 4.876157 -15.44178      12.19908 
1 1 1 -9  27 34 o 78.73689 4.548287 80.66885       8.689804 0.000000       0.000000 80.66885       8.689804 ?        ?        78.73689 4.548287 0.000000       4.548287 
1 1 1 -9  27 35 o 48.13903 4.232931 30.29457       4.915117 31.04572       8.114141 29.85921       6.177431 45.61419 7.564610 46.70529 5.535048 -1.091099      9.373370 
1 1 1 -9  27 36 o 42.68093 4.520504 24.29930       4.630334 28.27368       7.331005 21.66149       5.972416 43.46115 7.171849 38.50392 6.602712 4.957230       9.748396 
1 1 1 -9  27 37 o 24.74336 6.643900 9.375561       4.090116 4.589675       6.679768 12.24622       5.173337 19.36320 8.196894 27.60514 7.497861 -8.241938      11.10887 
1 1 1 -9  27 38 o 24.05276 7.457335 9.705350       4.822878 9.477314       6.581128 9.969882       7.088228 22.78141 8.630447 23.06283 8.901901 -0.2814217     12.39873 
1 1 1 -9  27 39 o 17.36881 6.739810 4.504704       4.079300 5.723645       6.413275 3.676427       5.286599 19.00541 8.037929 17.06109 7.260008 1.944317       10.83125 
1 1 1 -9  27 40 o 29.10423 5.887575 13.12983       4.032095 12.84135       6.778550 13.28778       5.015978 24.43298 8.848767 27.48232 7.347890 -3.049341      11.50183 
1 1 1 -9  27 41 o 18.59713 7.481177 6.297071       5.194177 6.794213       6.647743 5.517856       8.322669 18.86631 8.087557 18.23807 8.344397 0.6282444      11.62057 
1 1 1 -9  28 1  o 247.2885 3.832527 747.4677       23.09538 721.4472       34.96518 767.6069       30.76087 242.4145 5.918899 250.3077 5.042993 -7.893173      7.775934 
1 1 1 -9  28 2  o 178.0626 3.554943 387.3712       15.42558 404.1718       21.79919 370.5215       21.83098 181.5906 4.930751 173.8119 5.159869 7.778656       7.136984 
1 1 1 -9  28 3  o 248.7128 4.266775 756.6388       25.86033 739.6363       35.76636 775.2645       37.43471 245.4445 5.979783 251.2431 6.114264 -5.798660      8.552311 
1 1 1 -9  28 4  o 173.1992 4.049318 366.7909       17.09086 361.3016       20.35740 379.8986       31.45766 171.6964 4.870392 175.4083 7.375822 -3.711914      8.838748 
1 1 1 -9  28 5  f 45.48959 3.754417 25.46016       4.124868 22.22653       5.812097 28.74174       5.855029 42.17015 5.810010 48.17508 5.062935 -6.004936      7.706460 
1 1 1 -9  28 6  o 216.1363 3.509190 570.7188       18.48293 571.1906       28.72678 570.3856       24.14406 215.7469 5.468351 215.8686 4.589704 -0.1216431     7.139205 
1 1 1 -9  28 7  f 90.44664 2.887252 99.96022       6.355600 89.90005       9.036081 109.8098       8.941025 85.61010 4.345521 94.69722 3.882720 -9.087120      5.827441 
1 1 1 -9  28 8  o 153.2501 3.449644 286.9210       12.88282 315.4266       26.38750 278.0002       14.76165 159.9351 6.785882 150.7239 4.022585 9.211243       7.888560 
1 1 1 -9  28 9  o 137.8766 3.872311 232.5986       12.99770 269.0496       23.74748 217.0087       15.53045 147.7200 6.613703 133.0214 4.798866 14.69862       8.171302 
1 1 1 -9  28 10 o 163.8108 3.512463 327.9013       14.02137 305.0995       27.34554 336.0344       16.33165 157.1435 7.159729 165.7523 4.043286 -8.608795      8.222523 
1 1 1 -9  28 11 o 46.52849 4.460724 26.74433       4.995911 25.05563       9.917959 27.31851       5.783209 44.05646 9.516546 46.92588 5.141392 -2.869419      10.81659 
1 1 1 -9  28 12 o 81.37069 4.015480 81.19582       7.937762 0.000000       0.000000 81.19582       7.937762 ?        ?        81.37069 4.015480 0.000000       4.015480 
1 1 1 -9  28 13 o 80.22592 3.226363 78.76127       6.294733 67.92079       10.50870 84.82742       7.861071 74.10308 5.867231 83.18394 3.888748 -9.080864      7.038946 
1 1 1 -9  28 14 o 15.81915 6.490457 1.038403       4.000997 10.89990       7.548372 -2.814731      4.718336 29.69009 9.348320 13.98386 6.353432 15.70623       11.30297 
1 1 1 -9  28 15 o 133.1794 3.045612 216.6861       9.884338 232.7561       17.22042 208.7901       12.07081 137.5986 5.144686 130.5801 3.797388 7.018524       6.394368 
1 1 1 -9  28 16 o 16.90774 6.534334 2.294847       3.822722 7.585108       6.868760 -0.7898192E-01 4.601130 25.84688 8.949939 15.79815 6.749306 10.04873       11.20957 
1 1 1 -9  28 17 o 119.7319 3.324516 175.4296       9.690674 180.5886       15.03596 171.7641       12.67410 121.1293 5.105296 118.2805 4.404809 2.848732       6.742877 
1 1 1 -9  28 18 o 141.3004 3.045736 244.0685       10.48749 247.5087       18.01102 242.3037       12.89995 141.7516 5.222970 140.6174 3.767946 1.134186       6.440251 
1 1 1 -9  28 19 o 153.5051 3.115726 288.1815       11.65516 262.3805       18.94373 303.8968       14.78461 145.8552 5.338765 157.4807 3.852533 -11.62550      6.583648 
1 1 1 -9  28 20 o 75.58171 3.139535 70.01311       5.769943 68.51066       10.38014 70.68492       6.941091 74.24837 5.782500 75.84737 3.767145 -1.599007      6.901354 
1 1 1 -9  28 21 o 70.97890 3.189718 61.80254       5.503089 54.48375       10.09969 64.89293       6.562892 65.95478 6.362737 72.64857 3.719461 -6.693794      7.370130 
1 1 1 -9  28 22 o 28.69348 5.659528 10.54373       3.816651 8.937146       7.849988 11.04107       4.367634 27.56093 9.566570 29.25438 6.312103 -1.693449      11.46132 
1 1 1 -9  28 23 o 105.9572 3.190331 137.7649       8.228247 134.7688       19.15647 138.4427       9.111584 103.0775 7.681557 106.1347 3.527804 -3.057144      8.452911 
1 1 1 -9  28 24 o 79.17909 3.629092 77.25925       6.983743 84.01217       10.96316 72.64758       9.059819 81.98095 5.519827 76.42168 4.890485 5.559265       7.374641 
1 1 1 -9  28 25 o 42.54255 4.955827 22.77881       5.041693 21.19386       8.413065 23.66696       6.297808 39.73439 8.909105 43.00743 6.186911 -3.273041      10.84666 
1 1 1 -9  28 26 o 84.68765 2.967950 88.22488       6.115626 78.27998       11.23123 92.41634       7.291373 78.66064 5.902180 86.53050 3.464839 -7.869865      6.844036 
1 1 1 -9  28 27 o 84.17343 2.941502 87.27152       6.024378 75.12370       10.96931 92.51810       7.208877 76.83017 5.904082 86.50433 3.426523 -9.674156      6.826365 
1 1 1 -9  28 28 f 60.53626 3.446029 45.49135       5.062594 39.86864       9.091754 48.01825       6.094928 55.13905 6.918203 61.98227 4.057508 -6.843220      8.020281 
1 1 1 -9  28 29 o 11.45538 5.104997 -0.9295161     2.884117 2.384111       6.913691 -1.627654      3.173429 20.19556 8.430893 11.48888 5.216169 8.706682       9.914049 
1 1 1 -9  28 30 o 22.37401 5.965434 6.730771       3.311819 1.701144       6.922723 8.223512       3.771389 19.50736 8.304634 24.63558 6.267870 -5.128225      10.40448 
1 1 1 -9  28 31 o 43.72789 5.026680 24.86925       5.259127 9.191257       10.78391 29.76157       6.024055 26.81239 10.78178 47.73714 5.265804 -20.92475      11.99898 
1 1 1 -9  28 32 o 25.05466 6.763105 8.874169       4.224655 1.455894       8.938665 11.00785       4.793866 20.60060 9.093718 27.76927 7.067422 -7.168665      11.51712 
1 1 1 -9  28 33 o 33.17433 6.153474 15.33204       4.791485 12.26739       10.16456 16.20760       5.432991 27.35112 10.63183 33.63671 6.860835 -6.285595      12.65333 
1 1 1 -9  28 34 o 56.35893 3.963588 41.11132       5.408903 32.47642       8.157948 47.88485       7.225363 46.87952 7.385138 59.83432 5.001037 -12.95480      8.919116 
1 1 1 -9  28 35 o 39.84059 4.750504 21.36751       4.521376 25.21135       7.420081 19.09740       5.702281 40.32054 7.834087 36.00235 6.747378 4.318184       10.33925 
1 1 1 -9  28 36 o 31.39981 5.809113 14.19544       4.281333 26.10545       7.164851 7.581093       5.339425 40.95182 7.454084 21.78540 7.858397 19.16643       10.83133 
1 1 1 -9  28 37 o 38.16978 6.035337 21.54880       5.427373 18.96300       7.307280 24.73045       8.105574 32.06652 8.990618 36.87998 9.080458 -4.813457      12.77834 
1 1 1 -9  28 38 o 15.98059 6.428133 3.306669       3.834531 8.046554       6.404878 0.6586220      4.787291 20.95856 8.349201 14.50212 6.511406 6.456438       10.58809 
1 1 1 -9  28 39 o 28.54210 6.266700 12.94700       4.239079 22.37286       7.201637 7.949606       5.243758 34.17072 8.643728 20.73918 7.736184 13.43154       11.60011 
1 1 1 -9  28 40 o 13.86192 6.562082 -1.522408      5.891072 -1.522408      5.891072 0.000000       0.000000 13.86192 6.562082 ?        ?        0.000000       6.562082 
1 1 1 -9  29 1  o 122.7827 2.916450 184.0738       8.726253 187.9594       13.18404 181.0444       11.64106 123.8334 4.375803 121.6010 3.933607 2.232437       5.883955 
1 1 1 -9  29 2  o 211.0791 3.499110 544.4985       17.99861 542.6209       27.72395 545.8665       23.66335 210.2084 5.416652 211.1145 4.599622 -0.9060822     7.106099 
1 1 1 -9  29 3  o 271.1898 5.260319 902.1411       34.76334 947.5220       43.39124 820.8099       58.08899 277.4733 6.417188 256.6958 9.301597 20.77747       11.30044 
1 1 1 -9  29 4  o 20.44910 6.280910 5.144709       3.430791 3.749385       4.485194 7.112377       5.326228 19.52197 7.178008 24.32981 7.873776 -4.807838      10.65458 
1 1 1 -9  29 5  o 174.7797 3.523862 373.3445       15.00880 354.1124       20.33375 396.3646       22.24625 169.9046 4.916241 179.7218 5.084597 -9.817245      7.072662 
1 1 1 -9  29 6  o 95.98254 2.884542 112.5832       6.739257 119.9847       10.19236 106.8336       8.983238 98.92464 4.237811 93.37411 3.956908 5.550537       5.797945 
1 1 1 -9  29 7  o 51.98121 3.559290 33.18075       4.481436 31.08500       6.340179 35.27324       6.335238 50.06370 5.276120 53.42049 4.921821 -3.356789      7.215384 
1 1 1 -9  29 8  o 80.84651 3.448288 80.02586       6.778011 73.64281       12.82593 82.49920       7.983925 76.97581 6.910997 82.02016 4.006598 -5.044350      7.988411 
1 1 1 -9  29 9  o 140.9191 3.383052 242.6898       11.61755 227.5130       22.50014 248.2068       13.56576 135.6521 6.828437 142.3866 3.913371 -6.734451      7.870326 
1 1 1 -9  29 10 o 59.79598 3.913147 43.93169       5.670762 46.29095       11.25607 43.12920       6.564729 60.66885 7.793293 59.15191 4.590095 1.516937       9.044578 
1 1 1 -9  29 11 o 78.95688 3.979258 76.48508       7.631782 0.000000       0.000000 76.48508       7.631782 ?        ?        78.95688 3.979258 0.000000       3.979258 
1 1 1 -9  29 12 o 128.6243 3.341424 202.3622       10.46460 229.2089       22.20423 194.6965       11.86491 136.1197 6.714615 126.0802 3.866297 10.03954       7.748180 
1 1 1 -9  29 13 o 92.36807 3.414530 104.4576       7.672567 143.6666       17.11761 94.59975       8.583058 107.7088 6.552628 87.81157 4.021692 19.89719       7.688365 
1 1 1 -9  29 14 o 133.2211 3.357706 217.1478       10.89195 206.3568       22.19510 220.5709       12.50068 128.9415 7.090934 134.1848 3.826820 -5.243301      8.057660 
1 1 1 -9  29 15 o 57.38665 3.740964 40.48412       5.203033 45.36587       9.591527 38.44862       6.193492 60.22310 6.646055 55.79091 4.596230 4.432190       8.080555 
1 1 1 -9  29 16 o 108.3586 3.410073 143.8070       8.993362 136.0364       13.82724 149.5044       11.83985 104.9706 5.423840 110.2959 4.413964 -5.325317      6.992933 
1 1 1 -9  29 17 f 144.4738 3.100331 255.2736       10.91524 263.0464       18.86977 251.3649       13.38116 146.0382 5.311144 143.1709 3.838797 2.867294       6.553214 
1 1 1 -9  29 18 o 96.58869 3.004876 114.2174       7.064158 102.7462       11.99559 120.3077       8.740511 91.10651 5.427618 99.02611 3.628155 -7.919594      6.528594 
1 1 1 -9  29 19 o 51.61561 3.756613 32.84502       4.692782 28.51671       8.742795 34.59674       5.561915 47.11333 7.894006 52.87777 4.354902 -5.764435      9.015570 
1 1 1 -9  29 20 o 58.95705 3.398595 42.74665       4.862133 38.99795       8.925919 44.32827       5.797795 55.54471 6.731591 59.93808 3.992147 -4.393372      7.826337 
1 1 1 -9  29 21 o 68.24732 3.225804 57.22355       5.349693 59.36463       9.905943 56.34200       6.356320 68.84358 5.963433 67.59489 3.875070 1.248695       7.111871 
1 1 1 -9  29 22 o 30.61777 6.634801 12.18690       4.807127 -0.1010840     7.389130 21.20404       6.329760 19.67818 8.482231 40.64401 6.618302 -20.96583      10.75873 
1 1 1 -9  29 23 o 166.8714 4.221109 344.1569       17.15125 365.0056       31.86452 335.6528       20.35077 169.0535 7.755425 164.2691 5.089945 4.784348       9.276538 
1 1 1 -9  29 24 o 43.98510 3.961639 24.08268       4.200902 22.90531       8.220399 24.49884       4.887267 41.43842 8.427855 44.20527 4.604265 -2.766853      9.603540 
1 1 1 -9  29 25 o 85.06808 2.971607 89.07861       6.150730 83.27963       11.34457 91.49293       7.319976 81.11067 5.777323 86.04695 3.498199 -4.936279      6.753878 
1 1 1 -9  29 26 o 109.6129 2.942167 148.0154       7.851854 142.9505       13.95531 150.3614       9.497828 106.3512 5.402391 110.2094 3.541063 -3.858223      6.459486 
1 1 1 -9  29 27 o 54.70069 3.712682 37.32117       4.919663 31.22380       8.693795 40.19346       5.966945 48.23819 7.650817 56.53093 4.365205 -8.292747      8.808519 
1 1 1 -9  29 28 o 59.17775 3.214647 43.51412       4.618428 33.46927       8.590950 47.59716       5.477230 49.90371 7.278563 61.72605 3.657699 -11.82233      8.145934 
1 1 1 -9  29 29 o 53.02123 3.443681 35.17874       4.425403 37.61567       8.557642 34.28916       5.170422 52.92967 6.790928 52.05598 4.109161 0.8736839      7.937374 
1 1 1 -9  29 30 o 35.32467 5.041706 16.34666       4.217025 19.06911       7.335775 15.00296       5.153689 36.12401 8.479515 33.01148 6.636805 3.112526       10.76798 
1 1 1 -9  29 31 o 43.52074 4.107994 24.31908       4.305196 26.89028       11.01851 23.85583       4.676979 40.00638 10.97379 42.85933 4.547303 -2.852955      11.87864 
1 1 1 -9  29 32 o 18.23328 6.597324 4.265946       3.766840 0.000000       0.000000 4.265946       3.766840 ?        ?        18.23328 6.597324 0.000000       6.597324 
1 1 1 -9  29 33 o 34.58872 4.939136 16.11574       4.045057 11.21814       9.801420 17.12116       4.440889 25.83209 10.31587 35.41619 5.308950 -9.584101      11.60182 
1 1 1 -9  29 34 o 16.31712 6.513940 2.879043       3.906770 9.709612       6.647405 -0.7252245     4.828722 24.26823 8.766352 14.33107 6.477619 9.937160       10.89993 
1 1 1 -9  29 35 o 35.44588 5.330386 17.59795       4.461851 14.79827       7.071285 19.44997       5.751307 28.73459 9.048155 35.88543 6.826128 -7.150837      11.33425 
1 1 1 -9  29 36 o 16.40622 6.571864 3.325238       3.990366 4.262267       6.448309 2.743721       5.079840 18.59973 7.969138 16.64647 7.101152 1.953264       10.67396 
1 1 1 -9  29 37 o 23.25289 6.950186 8.985238       4.240792 9.908382       6.599803 8.336034       5.534603 22.62595 8.625916 21.53630 7.963987 1.089643       11.74017 
1 1 1 -9  29 38 o 27.89381 6.537185 12.60539       4.365611 18.07307       7.073452 9.241209       5.548424 29.78971 8.992562 22.03310 8.001984 7.756617       12.03736 
1 1 1 -9  29 39 o 30.04127 6.087249 14.31768       4.303465 9.916074       6.897428 17.12331       5.506774 21.38562 8.614625 31.19821 7.362626 -9.812584      11.33226 
1 1 1 -9  30 1  o 77.21267 3.661237 73.08015       6.869318 81.23831       8.333645 55.78782       12.13292 81.34057 4.218697 66.71074 7.598645 14.62983       8.691191 
1 1 1 -9  30 2  o 47.14552 3.812293 27.36883       4.342558 27.53076       5.919968 27.18019       6.389482 47.06648 5.250776 46.67330 5.738376 0.3931847      7.778149 
1 1 1 -9  30 3  o 73.21387 3.091742 65.60344       5.503690 60.40298       7.829311 70.68366       7.738274 70.05032 4.612116 75.86229 4.202253 -5.811966      6.239435 
1 1 1 -9  30 4  o 154.3259 3.385934 291.1272       12.73367 269.4988       17.01812 318.6393       19.19379 148.1848 4.718738 161.0986 4.894824 -12.91377      6.798955 
1 1 1 -9  30 5  o 44.70616 3.759453 24.62004       4.057790 20.25375       5.387476 30.34441       6.168695 40.20751 5.654483 49.45004 5.196628 -9.242531      7.679721 
1 1 1 -9  30 6  o 29.24208 6.092981 10.91298       4.200775 9.221229       5.267901 13.86752       6.961686 26.94186 7.661393 32.79776 8.604610 -5.855898      11.52112 
1 1 1 -9  30 7  o 111.9563 2.908685 153.1971       7.928905 157.0244       11.94225 150.1800       10.60314 113.1338 4.339738 110.7046 3.936632 2.429237       5.859215 
1 1 1 -9  30 8  f 57.55127 4.009864 40.74033       5.588505 36.18272       10.38982 42.59573       6.629151 53.37788 8.253518 58.75748 4.668105 -5.379604      9.482182 
1 1 1 -9  30 9  o 51.37753 4.543576 32.60959       5.630047 21.48966       11.67400 35.97980       6.426838 40.60746 11.35598 53.92190 4.946025 -13.31444      12.38634 
1 1 1 -9  30 10 o 139.3339 3.935827 237.8695       13.35038 0.000000       0.000000 237.8695       13.35038 ?        ?        139.3339 3.935827 0.000000       3.935827 
1 1 1 -9  30 11 o 91.14404 3.433871 101.7497       7.613265 123.6669       15.95346 95.28640       8.663395 99.83315 6.594521 88.10700 4.045780 11.72614       7.736669 
1 1 1 -9  30 12 f 86.55872 3.437889 91.80293       7.237258 101.4392       15.07126 88.91491       8.250806 90.25880 6.904518 85.10132 3.989648 5.157478       7.974313 
1 1 1 -9  30 13 o 80.74021 3.529762 79.93700       6.928204 91.62820       14.65186 76.57015       7.862770 85.67177 7.081278 78.92973 4.101962 6.742043       8.183557 
1 1 1 -9  30 14 o 100.8234 3.350911 124.5247       8.221600 102.0349       16.11739 132.4351       9.558768 90.29318 7.389514 103.9050 3.781416 -13.61179      8.300844 
1 1 1 -9  30 15 o 83.85728 3.526094 86.26527       7.189530 96.60406       11.67308 79.94627       9.125867 88.34751 5.448449 80.51314 4.671327 7.834373       7.176830 
1 1 1 -9  30 16 o 150.0203 3.134873 275.4107       11.46057 297.5645       20.04193 264.6471       13.96996 155.2281 5.306058 146.8337 3.907685 8.394409       6.589708 
1 1 1 -9  30 17 o 75.67455 3.204361 70.24392       5.895808 69.34851       10.38422 70.66988       7.162147 74.64021 5.753438 75.78481 3.891181 -1.144592      6.945742 
1 1 1 -9  30 18 o 65.65434 3.293627 52.95325       5.252726 53.89304       9.762458 52.57033       6.231652 65.57291 6.182367 65.30238 3.934204 0.2705383      7.328003 
1 1 1 -9  30 19 o 45.52247 4.789029 25.86030       5.233147 30.41363       8.460465 23.03871       6.660046 48.69860 7.358510 42.46482 6.654361 6.233776       9.921098 
1 1 1 -9  30 20 o 33.22501 5.891954 14.14268       4.595803 22.17107       7.196178 8.612637       5.972443 41.34354 7.415051 26.12244 8.326621 15.22110       11.14969 
1 1 1 -9  30 21 o 86.70271 3.552630 92.61278       7.490276 81.99548       11.01684 101.7396       10.21433 80.89795 5.623350 90.53449 4.645303 -9.636543      7.293895 
1 1 1 -9  30 22 o 70.95915 3.464556 62.11706       5.972792 63.99234       14.72166 61.74756       6.534784 69.74674 8.861341 70.65655 3.809355 -0.9098053     9.645441 
1 1 1 -9  30 23 o 40.00414 4.252323 20.05116       4.081969 20.87128       8.013992 19.76385       4.743406 39.33645 8.600554 39.49555 5.043305 -0.1590996     9.970178 
1 1 1 -9  30 24 o 19.28156 6.281521 4.618564       3.386726 2.366405       7.342363 5.227231       3.817036 20.97474 8.716788 20.44685 6.669158 0.5278893      10.97543 
1 1 1 -9  30 25 o 14.00758 5.808157 0.8267772      3.249466 -10.57784      7.163114 3.781826       3.646228 14.05687 6.805068 18.22027 6.503397 -4.163399      9.412923 
1 1 1 -9  30 26 o 46.73354 4.045518 27.45135       4.561891 32.45395       8.282885 25.27313       5.465549 49.39983 7.082864 44.41008 5.145386 4.989758       8.754539 
1 1 1 -9  30 27 o 56.38961 3.410820 39.66354       4.665075 31.91452       8.778968 42.71272       5.506944 48.32031 7.714818 58.32124 3.897151 -10.00092      8.643274 
1 1 1 -9  30 28 o 45.66139 4.451436 26.65307       4.890378 25.87352       8.390740 27.05410       6.018232 42.62063 8.377575 45.43533 5.550601 -2.814693      10.04952 
1 1 1 -9  30 29 o 31.97441 5.585113 13.68611       4.193528 19.48765       7.464391 11.01052       5.069115 36.34673 8.568192 27.79485 7.366395 8.551882       11.29946 
1 1 1 -9  30 30 o 22.29021 6.176363 6.932319       3.470624 2.551759       8.684167 7.764973       3.786130 20.85040 9.090046 23.48556 6.428913 -2.635160      11.13373 
1 1 1 -9  30 31 o 10.17602 4.779211 -2.617410      3.014466 0.7310983      5.758364 -3.881461      3.537982 16.76423 7.353048 10.47867 4.996059 6.285559       8.889765 
1 1 1 -9  30 32 o 36.65659 4.755930 17.96689       4.148329 29.15761       10.22971 15.76445       4.538220 40.85522 10.28384 33.65097 5.739915 7.204254       11.77727 
1 1 1 -9  30 33 o 41.47327 4.033159 22.55644       4.024728 14.66546       7.120697 26.26078       4.878793 29.16265 9.064545 44.33245 4.581960 -15.16980      10.15679 
1 1 1 -9  30 34 o 19.10071 6.423528 5.373561       3.533480 10.32775       9.256776 4.528568       3.822960 23.84859 9.837716 17.99333 6.625063 5.855261       11.86053 
1 1 1 -9  30 35 o 31.79777 5.023574 14.22090       3.763518 6.784886       6.935055 17.32497       4.480702 20.60550 8.508995 34.73332 5.474844 -14.12782      10.11815 
1 1 1 -9  30 36 o 22.06278 6.318728 7.709748       3.570795 9.962842       6.770758 6.841631       4.202782 22.63079 8.709426 20.34926 7.002858 2.281530       11.17560 
1 1 1 -9  30 37 o 9.889028 4.812468 -4.716814      3.708035 -4.551358      5.887235 -4.825611      4.773952 12.87001 6.215590 11.43108 5.539031 1.438939       8.325528 
1 1 1 -9  30 38 o 23.71441 7.099438 9.951512       4.422204 21.39350       7.168648 2.922523       5.618662 32.63713 8.809860 16.22118 7.182804 16.41595       11.36689 
1 1 1 -9  31 1  o 42.52134 5.271500 22.56694       5.345419 23.46311       8.251672 21.91895       7.016719 42.71752 8.225249 41.48537 7.201781 1.232151       10.93254 
1 1 1 -9  31 2  o 39.19245 5.122566 19.19169       4.775464 15.63191       8.441147 20.86732       5.791346 34.74664 9.633967 40.71631 6.017874 -5.969673      11.35906 
1 1 1 -9  31 3  o 14.96673 6.370342 0.4380920E-01  4.072029 -3.838513      6.652932 2.369468       5.149207 16.60736 7.544974 18.84726 7.493352 -2.239902      10.63377 
1 1 1 -9  31 4  o 99.78970 3.359501 121.9267       8.157874 135.8247       15.73480 116.8176       9.540241 104.7359 6.192587 97.57055 4.021019 7.165375       7.383544 
1 1 1 -9  31 5  o 63.55827 3.608968 49.59394       5.566764 47.01027       7.136833 53.60814       8.895812 61.69622 4.784270 65.75249 5.605237 -4.056267      7.369391 
1 1 1 -9  31 6  o 199.3379 3.414234 486.0854       16.58515 454.6825       24.73357 511.7414       22.35609 192.1890 5.286093 204.2350 4.491895 -12.04593      6.936851 
1 1 1 -9  31 7  o 109.1574 2.934943 145.7212       7.800001 130.4869       11.35832 159.3172       10.73020 103.0200 4.535468 113.9869 3.868534 -10.96690      5.961210 
1 1 1 -9  31 8  o 127.9743 3.943169 200.8426       12.28247 0.000000       0.000000 200.8426       12.28247 ?        ?        127.9743 3.943169 0.000000       3.943169 
1 1 1 -9  31 9  o 66.16608 3.803417 53.79979       6.106771 54.52716       12.11670 53.55212       7.070430 65.76563 7.706479 65.91393 4.427504 -0.1483002     8.887778 
1 1 1 -9  31 10 o 140.3199 3.977205 241.5382       13.58611 257.6538       23.94732 233.8891       16.49824 143.9886 6.844436 137.8315 4.919831 6.157150       8.429178 
1 1 1 -9  31 11 o 80.75269 3.584701 80.01395       7.036590 105.7682       14.88019 72.59605       7.985914 92.13194 6.672911 76.79304 4.284419 15.33890       7.929942 
1 1 1 -9  31 12 o 69.38152 3.691553 59.15018       6.219033 33.97750       11.57246 69.37206       7.374394 51.07094 9.652146 75.09306 4.044792 -24.02213      10.46538 
1 1 1 -9  31 13 o 88.41137 3.909543 96.06805       8.402237 117.2244       15.89496 87.86388       9.898203 96.88445 6.775091 84.34888 4.835760 12.53556       8.323848 
1 1 1 -9  31 14 o 65.69426 4.215394 53.23945       6.712801 61.28196       12.63191 50.07440       7.924349 69.60554 7.568865 63.50525 5.165124 6.100292       9.163308 
1 1 1 -9  31 15 o 199.0250 4.498047 487.6398       21.81563 494.7075       38.43527 484.2807       26.49752 198.1507 7.976025 197.7622 5.503618 0.3885345      9.690552 
1 1 1 -9  31 16 f 27.05115 7.182621 9.495094       4.813688 15.49451       7.704243 5.653148       6.165255 34.26954 9.080985 23.09465 8.427928 11.17490       12.38928 
1 1 1 -9  31 17 o 90.64508 3.604231 101.0678       7.945592 97.09872       11.83651 104.3233       10.71982 88.28129 5.529752 91.76059 4.810774 -3.479301      7.329510 
1 1 1 -9  31 18 o 14.39059 6.283015 -0.6882889     4.162002 0.3401425E-01  6.964975 -1.089458      5.190674 19.21352 8.258016 15.84808 6.965242 3.365439       10.80321 
1 1 1 -9  31 19 o 49.68629 3.797599 30.57912       4.563293 31.91028       8.257875 29.99393       5.475203 49.83376 6.992091 49.00949 4.639656 0.8242607      8.391409 
1 1 1 -9  31 20 f 112.4872 2.996276 155.4458       8.206047 158.3310       14.43439 154.0680       9.974790 112.5680 5.276642 111.7598 3.667503 0.8082123      6.426004 
1 1 1 -9  31 21 o 88.17622 3.327979 95.86516       7.138188 101.8613       16.83746 94.55133       7.881518 88.56182 7.884116 87.44513 3.707016 1.116692       8.712132 
1 1 1 -9  31 22 o 30.50825 5.069520 11.93993       3.636729 21.98647       7.001411 8.227754       4.255903 40.79264 7.311745 24.94691 6.810880 15.84573       9.992482 
1 1 1 -9  31 23 o 51.67055 3.488598 33.16055       4.366935 30.69152       7.839916 34.27120       5.258176 48.42586 6.833217 52.32685 4.157740 -3.900993      7.998728 
1 1 1 -9  31 24 o 21.74246 6.222088 6.240119       3.463724 11.26933       7.094030 4.665874       3.968981 28.63647 9.068606 19.63827 6.803147 8.998199       11.33677 
1 1 1 -9  31 25 o 56.53122 3.722338 39.97300       5.099374 32.16234       8.648566 44.13549       6.313605 48.78141 7.516414 59.10937 4.415030 -10.32796      8.717165 
1 1 1 -9  31 26 o 41.79625 4.758148 22.43914       4.760124 18.69944       7.859532 24.60558       5.982074 35.88417 9.003771 43.26470 5.821497 -7.380535      10.72183 
1 1 1 -9  31 27 o 19.87852 6.748120 5.117694       3.899808 12.14340       7.107794 2.091817       4.664611 28.72030 9.075160 17.09057 7.009646 11.62972       11.46707 
1 1 1 -9  31 28 o 42.14393 4.206821 22.80550       4.262749 12.43508       9.665126 25.30991       4.749659 28.41267 10.52107 44.27897 4.462598 -15.86630      11.42838 
1 1 1 -9  31 29 o 47.10125 3.994226 28.48075       4.541407 39.17149       10.90313 26.23667       4.995359 50.41090 9.214922 44.80105 4.642759 5.609844       10.31843 
1 1 1 -9  31 30 o 22.38599 6.074505 7.115136       3.397519 9.623473       6.431687 6.144287       4.001361 24.89725 8.658330 20.78542 6.831173 4.111830       11.02867 
1 1 1 -9  31 31 o 10.86841 5.096409 -2.664268      3.404881 1.127985       8.753322 -3.340358      3.695953 19.33756 8.732772 11.00853 5.207254 8.329027       10.16744 
1 1 1 -9  31 32 o 50.69843 3.532033 33.12450       4.336416 30.99862       7.917355 34.03554       5.182959 45.13671 7.458293 50.80890 4.224198 -5.672192      8.571464 
1 1 1 -9  31 33 o 26.34745 5.784331 10.09879       3.611883 6.996254       6.569487 11.44291       4.324063 21.18449 8.450315 27.47328 6.551210 -6.288792      10.69234 
1 1 1 -9  31 34 o 24.96325 5.863250 9.296847       3.505655 13.16776       6.715235 7.846692       4.110191 26.51414 8.854473 22.14491 6.887337 4.369226       11.21771 
1 1 1 -9  31 35 o 22.42858 6.729680 8.212339       3.970189 3.597366       6.558458 10.88171       4.987948 17.75263 7.814845 25.02076 7.551085 -7.268127      10.86695 
1 1 1 -9  31 36 o 13.74390 5.779019 1.758605       3.284259 3.661392       6.420979 1.084414       3.822062 17.40953 7.695221 13.68697 5.997289 3.722566       9.756224 
1 1 1 -9  31 37 o 12.69372 5.625665 0.5844570      3.453895 3.982926       6.600251 -0.6971313     4.053154 17.35188 7.728347 12.49295 5.755228 4.858934       9.635870 
1 1 1 -9  32 1  o 83.19378 3.235591 84.82306       6.547143 81.45313       8.640296 89.36707       10.03316 81.32508 4.375930 85.09216 4.858709 -3.767075      6.538793 
1 1 1 -9  32 2  o 63.95434 3.330406 50.19662       5.172547 60.61579       7.687907 41.57904       6.991725 70.09676 4.524810 57.91090 5.003390 12.18585       6.745948 
1 1 1 -9  32 3  o 17.23125 6.654212 2.432260       3.962029 3.438579       4.916130 0.5673687      6.692408 19.59808 7.451157 19.40681 8.209496 0.1912708      11.08673 
1 1 1 -9  32 4  o 36.68627 5.307384 16.91781       4.607116 14.82157       5.308237 23.31809       9.275321 34.01303 6.642641 42.24146 9.265996 -8.228424      11.40102 
1 1 1 -9  32 5  o 52.08137 3.829492 33.42594       4.826277 36.54662       6.380889 29.25383       7.377931 54.28975 4.874961 48.18356 6.444954 6.106194       8.081007 
1 1 1 -9  32 6  o 77.38690 3.772957 73.57538       7.093729 72.78302       8.305183 75.71273       13.64034 76.84360 4.454211 77.64944 7.294008 -0.8058395     8.546494 
1 1 1 -9  32 7  o 61.25452 4.128801 46.25478       6.127080 47.66636       9.224991 45.14055       8.195993 61.74229 6.215724 60.20308 5.652719 1.539211       8.401694 
1 1 1 -9  32 8  o 90.08781 3.942821 99.74976       8.634875 111.1120       15.05601 94.18066       10.54070 94.38060 6.587583 87.30663 4.974935 7.073967       8.255073 
1 1 1 -9  32 9  o 100.2221 3.858556 123.3954       9.406156 145.2737       16.88372 113.5488       11.32677 107.9929 6.444912 95.90098 4.862577 12.09189       8.073509 
1 1 1 -9  32 10 o 127.3239 3.881485 199.1229       12.02919 199.5135       20.89528 198.9293       14.71158 126.4051 6.808525 127.0055 4.761791 -0.6004028     8.308470 
1 1 1 -9  32 11 o 70.27585 4.182937 60.91039       7.131060 71.12328       12.69185 56.19896       8.620392 75.18257 7.008145 67.24305 5.303608 7.939522       8.788763 
1 1 1 -9  32 12 o 106.0136 4.729327 138.8252       12.18715 130.5447       17.17590 147.2212       17.29520 101.9939 6.952059 108.5030 6.571867 -6.509132      9.566638 
1 1 1 -9  32 13 o 54.93271 5.833987 37.86742       7.690386 36.57613       10.98033 39.11070       10.77430 53.02691 8.806092 55.06037 8.286598 -2.033459      12.09194 
1 1 1 -9  32 14 o 33.23950 6.712774 14.29491       5.249939 10.02215       8.960954 16.52798       6.478157 29.07776 10.21246 35.55478 7.700119 -6.477018      12.79008 
1 1 1 -9  32 15 o 86.99237 3.398747 93.05394       7.191172 86.10158       14.68096 95.24862       8.248478 82.28311 7.400612 87.89866 3.860255 -5.615547      8.346893 
1 1 1 -9  32 16 o 69.79704 3.638872 60.08345       6.167902 43.05072       12.22407 65.90092       7.143981 57.18924 9.073982 73.00862 4.031057 -15.81939      9.929077 
1 1 1 -9  32 17 o 47.46753 4.058714 28.00452       4.649839 31.07706       8.416102 26.65456       5.578574 49.03201 7.262929 46.05082 5.054017 2.981190       8.848346 
1 1 1 -9  32 18 o 23.17727 6.482968 6.984654       3.804249 1.488290       7.224224 9.093648       4.474979 20.41013 8.575838 26.30260 6.897844 -5.892464      11.00569 
1 1 1 -9  32 19 o 99.70379 3.355257 122.5793       8.140561 123.5114       19.22227 122.3755       8.986181 97.29631 8.182986 99.48845 3.713035 -2.192139      8.985983 
1 1 1 -9  32 20 o 95.12000 3.009039 111.4387       6.966089 112.8311       12.06746 110.7428       8.531034 94.68520 5.250509 94.55932 3.709408 0.1258774      6.428651 
1 1 1 -9  32 21 o 14.93086 6.028684 1.422906       3.386746 6.695127       6.865516 -0.2726559     3.893437 24.08856 8.876691 14.10790 6.119142 9.980661       10.78144 
1 1 1 -9  32 22 o 24.98009 6.097454 8.292171       3.678729 7.437262       6.923528 8.628472       4.342423 24.68214 8.942350 25.35751 6.861808 -0.6753769     11.27165 
1 1 1 -9  32 23 f 19.69262 6.440293 4.933887       3.558414 0.1892513      6.464820 6.996186       4.262171 18.13040 7.874282 22.92531 6.992951 -4.794910      10.53118 
1 1 1 -9  32 24 o 19.49499 7.141186 4.402973       4.432673 4.525886       6.156877 4.270704       6.386944 21.06976 8.250198 21.03809 8.351616 0.3167343E-01  11.73947 
1 1 1 -9  32 25 o 39.50745 4.763789 20.14850       4.493891 7.058356       6.941284 29.59440       5.896429 23.69955 8.888441 47.76699 5.146661 -24.06744      10.27095 
1 1 1 -9  32 26 o 52.15405 3.785274 34.42309       4.778102 30.92360       10.79200 35.27633       5.328851 44.66293 10.14716 52.58020 4.193595 -7.917271      10.97958 
1 1 1 -9  32 27 o 28.01176 5.899063 10.77787       3.899349 14.39070       9.414852 10.02982       4.284060 29.74991 10.46635 26.65239 6.624701 3.097517       12.38673 
1 1 1 -9  32 28 o 52.98653 3.462585 35.63287       4.446478 33.04875       7.790268 36.88152       5.415219 48.42060 6.788384 53.42071 4.193369 -5.000111      7.979129 
1 1 1 -9  32 29 o 19.12172 6.354174 5.071784       3.459071 5.847033       6.386524 4.749953       4.114889 21.14441 8.364864 18.91652 6.888043 2.227896       10.83587 
1 1 1 -9  32 30 o 27.09114 5.759698 10.37729       3.685249 3.653456       8.351243 12.00323       4.106728 20.33348 8.888412 29.02458 6.004427 -8.691101      10.72646 
1 1 1 -9  32 31 o 34.15246 4.708008 15.79066       3.814146 18.67854       6.780546 14.45389       4.613207 33.87101 8.284508 31.52786 6.225446 2.343142       10.36288 
1 1 1 -9  32 32 o 17.83113 6.257902 4.554040       3.364315 6.169948       6.396883 3.936172       3.955562 20.38099 8.265121 17.26023 6.653182 3.120758       10.61023 
1 1 1 -9  32 33 o 37.84669 4.518877 19.63000       4.085432 23.28732       7.410087 18.03278       4.896927 36.55851 8.481980 34.90200 5.972095 1.656509       10.37352 
1 1 1 -9  32 34 o 15.76603 6.338171 3.143518       3.725657 0.1085252      6.262072 4.806458       4.635296 15.52983 7.154018 17.93772 7.116745 -2.407890      10.09099 
1 1 1 -9  32 35 o 16.11636 6.118454 3.751720       3.311848 3.224954       6.137360 3.968125       3.933740 16.99959 7.518248 16.59806 6.565354 0.4015293      9.981380 
1 1 1 -9  32 36 o 17.21779 6.814487 4.642207       4.240243 -0.7776468     6.406976 8.866243       5.656179 14.77070 6.946647 21.30393 8.016432 -6.533234      10.60750 
1 1 1 -9  33 1  o 63.86125 3.734981 50.22524       5.787115 49.99578       7.289523 50.61639       9.517420 63.50866 4.744383 63.51854 6.228687 -0.9883881E-02 7.829797 
1 1 1 -9  33 2  o 33.59976 5.117483 14.24768       4.058002 15.38266       5.029369 12.13034       6.869340 34.69656 6.174619 30.55062 8.768618 4.145939       10.72448 
1 1 1 -9  33 3  o 51.68369 3.745280 32.95302       4.685085 40.26849       6.725114 26.05464       6.530589 56.93167 4.894881 45.43567 6.048291 11.49600       7.780854 
1 1 1 -9  33 4  o 54.77009 3.502393 36.93203       4.650105 39.60491       6.635891 34.35315       6.518173 56.46179 4.870467 52.49141 5.162394 3.970383       7.097307 
1 1 1 -9  33 5  o 27.73092 5.596729 9.853322       3.651583 14.56814       4.916766 4.054004       5.452998 33.73305 6.209948 20.78633 7.860215 12.94672       10.01731 
1 1 1 -9  33 6  o 38.71933 4.818544 18.76719       4.448429 7.565581       6.451939 28.91706       6.141586 25.32168 8.677941 48.07048 5.332428 -22.74880      10.18535 
1 1 1 -9  33 7  o 138.8620 3.014178 236.1197       10.19972 216.3798       14.92828 253.4033       13.96866 132.4059 4.633790 143.5305 3.997585 -11.12463      6.119861 
1 1 1 -9  33 8  o 44.06212 4.753150 24.22410       5.023013 28.81877       9.450964 22.41529       5.929869 47.01952 8.563654 42.08277 5.947978 4.936756       10.42663 
1 1 1 -9  33 9  f 69.97317 3.725752 60.31196       6.330140 65.54035       12.32469 58.43849       7.377603 71.95467 7.122134 68.72041 4.429067 3.234268       8.386979 
1 1 1 -9  33 10 o 47.77728 4.462825 28.39087       5.135864 23.51358       9.692335 30.29497       6.055967 41.96244 9.676081 49.21238 5.124774 -7.249943      10.94942 
1 1 1 -9  33 11 o 98.80187 3.851546 120.2732       9.255581 136.2103       16.83221 113.3660       11.08123 104.0302 6.674876 95.63524 4.769875 8.394936       8.204004 
1 1 1 -9  33 12 o 85.46679 3.453974 89.87997       7.178885 90.03457       14.46227 89.82943       8.269639 84.23045 7.112215 85.30408 3.989194 -1.073631      8.154586 
1 1 1 -9  33 13 o 100.4225 3.330148 124.0133       8.138221 122.0281       16.67779 124.6338       9.323609 98.08351 7.024104 100.5308 3.812734 -2.447327      7.992182 
1 1 1 -9  33 14 o 84.19803 3.473347 87.34537       7.111360 77.39883       14.12613 90.72182       8.230336 77.65217 7.560689 85.67403 3.952795 -8.021858      8.531624 
1 1 1 -9  33 15 o 60.54485 3.742355 45.36209       5.494527 59.96241       11.75992 41.28477       6.214556 68.34964 7.166899 57.55891 4.465495 10.79073       8.444234 
1 1 1 -9  33 16 f 23.70367 6.862536 7.316878       4.190448 0.5927119      8.523225 9.460372       4.812223 21.25207 9.134706 26.76089 7.215710 -5.508820      11.64085 
1 1 1 -9  33 17 o 45.26217 4.521161 25.71930       4.920139 23.72417       10.18011 26.32738       5.620127 41.23994 10.18966 45.60493 5.146870 -4.364990      11.41575 
1 1 1 -9  33 18 o 102.9224 3.396211 130.8862       8.506398 141.2008       19.93609 128.5903       9.405560 103.7798 7.943359 101.8387 3.796618 1.941132       8.804048 
1 1 1 -9  33 19 o 33.91264 4.992295 14.72539       4.002378 11.39379       7.352557 16.12833       4.771229 28.98686 9.238619 35.26187 5.750500 -6.275015      10.88211 
1 1 1 -9  33 20 o 47.67565 3.763209 28.40655       4.336680 32.03258       8.088813 26.94385       5.137434 49.26750 6.928490 46.12775 4.633000 3.139744       8.334786 
1 1 1 -9  33 21 o 19.72932 6.876615 4.732391       4.058210 -0.8121416     6.432577 8.398271       5.230481 17.43942 7.705586 24.95742 7.770638 -7.517998      10.94344 
1 1 1 -9  33 22 o 60.14559 3.872408 45.41420       5.645561 40.64447       8.530691 49.13111       7.530571 55.48102 6.428453 61.95485 5.031147 -6.473824      8.163177 
1 1 1 -9  33 23 o 40.43969 5.883151 21.64546       5.627787 35.41422       8.229010 9.547009       7.713741 51.31129 6.744218 26.35930 9.453266 24.95199       11.61244 
1 1 1 -9  33 24 o 32.14333 5.328914 13.67965       4.028008 25.62906       9.736850 11.21243       4.424345 40.91812 9.878052 28.51110 6.511277 12.40701       11.83100 
1 1 1 -9  33 25 f 61.11774 3.534404 47.12978       5.241590 43.05069       11.28978 48.25065       5.918088 53.83709 8.917216 61.57208 3.965305 -7.734989      9.759118 
1 1 1 -9  33 26 o 40.04068 4.092803 20.68013       3.937428 31.20798       7.513647 16.69452       4.623046 47.27833 6.709812 35.11410 5.589911 12.16423       8.733194 
1 1 1 -9  33 27 o 27.21926 5.785479 10.31895       3.719162 18.77904       6.948543 6.922120       4.402949 34.93994 8.287011 21.89809 7.164037 13.04185       10.95436 
1 1 1 -9  33 28 o 40.59878 4.208443 21.56541       4.103298 28.97713       7.490485 18.38766       4.904681 44.51749 7.146434 36.44914 5.709175 8.068352       9.146923 
1 1 1 -9  33 29 o 28.38285 5.949008 11.51393       3.982874 1.403408       9.583648 13.62474       4.378942 19.78822 9.015561 30.87674 6.036139 -11.08852      10.84967 
1 1 1 -9  33 30 o 26.89736 5.716508 10.39190       3.631333 11.23755       6.576061 10.02091       4.355639 25.48880 8.760155 25.56742 6.852190 -0.7862473E-01 11.12173 
1 1 1 -9  33 31 o 11.90234 5.311572 -0.3064367     3.133589 5.678882       5.800574 -2.773026      3.723709 19.69574 7.911832 11.16607 5.265098 8.529664       9.503596 
1 1 1 -9  33 32 o 44.37758 4.035419 26.40864       4.316359 19.38503       7.634414 29.70865       5.233034 31.71362 9.286253 46.35770 4.697041 -14.64408      10.40657 
1 1 1 -9  33 33 o 16.28635 6.424985 3.604990       3.758255 4.835349       5.992817 2.807437       4.824973 18.34152 7.764165 16.16529 6.908984 2.176239       10.39309 
1 1 1 -9  33 34 o 10.81541 5.078978 -2.000519      3.402944 1.044804       6.264588 -3.275230      4.053047 15.76609 7.223196 11.11928 5.314099 4.646804       8.967397 
1 1 1 -9  34 1  o 72.66308 3.488459 65.02456       6.159041 75.64661       8.062484 50.13958       9.544188 78.19210 4.247206 62.99412 6.301821 15.19798       7.599454 
1 1 1 -9  34 2  o 46.36345 3.919034 26.65105       4.386398 29.22138       6.124528 23.94409       6.285198 48.23461 5.297566 43.38222 6.114668 4.852386       8.090325 
1 1 1 -9  34 3  o 76.26051 3.377692 71.55289       6.261480 67.71178       7.970404 77.74483       10.11963 73.91822 4.445332 78.95625 5.289995 -5.038025      6.909777 
1 1 1 -9  34 4  o 42.01517 5.542429 22.31595       5.536426 19.69033       7.782195 25.00665       7.878063 38.56186 8.509847 43.86524 7.647827 -5.303383      11.44145 
1 1 1 -9  34 5  o 100.9378 3.321960 125.2259       8.160040 111.7369       13.75406 132.5527       10.13676 94.40666 6.009699 103.6448 4.021060 -9.238129      7.230865 
1 1 1 -9  34 6  o 95.42454 2.949986 111.7375       6.851635 99.60139       9.647881 124.0863       9.732019 89.68788 4.427992 100.2755 3.990620 -10.58760      5.960886 
1 1 1 -9  34 7  o 40.45389 4.204110 20.40297       4.084109 24.77044       5.984302 16.59524       5.587680 44.23913 5.682038 35.81376 6.647104 8.425365       8.744686 
1 1 1 -9  34 8  o 93.71500 3.366241 108.0488       7.675107 91.04593       14.31636 114.9067       9.092115 84.65250 7.002543 96.49788 3.874314 -11.84538      8.002870 
1 1 1 -9  34 9  o 78.16407 3.556628 75.31984       6.756818 69.66535       12.85955 77.47627       7.941389 73.82482 7.241096 79.11719 4.133313 -5.292366      8.337730 
1 1 1 -9  34 10 o 73.22871 4.170729 66.45641       7.411906 68.25069       12.46151 65.47416       9.220102 73.08255 7.085958 72.32408 5.267497 0.7584686      8.829345 
1 1 1 -9  34 11 o 126.5055 3.958117 197.7621       12.18708 220.2637       21.83044 187.5743       14.68914 131.7294 6.823807 122.7325 4.921328 8.996895       8.413311 
1 1 1 -9  34 12 o 29.85783 6.278033 11.63436       4.422755 10.31008       8.665656 12.10083       5.143034 28.78048 10.04753 30.26646 7.096897 -1.485981      12.30117 
1 1 1 -9  34 13 o 88.05161 3.381102 95.64126       7.241423 91.19269       14.66811 97.07490       8.326911 84.16489 7.221397 88.54289 3.868508 -4.378006      8.192309 
1 1 1 -9  34 14 o 77.27103 3.508832 73.82285       6.589928 73.78135       13.56391 73.83567       7.539564 75.35819 7.484986 77.10117 4.026772 -1.742973      8.499406 
1 1 1 -9  34 15 o 17.32186 6.688492 2.693114       4.002647 -5.459904      7.489431 5.952902       4.735702 16.60929 7.711558 21.97258 7.436443 -5.363297      10.71302 
1 1 1 -9  34 16 o 92.55209 3.397902 105.9659       7.650596 96.87257       15.31542 108.9895       8.831414 86.12688 7.367868 93.65285 3.878054 -7.525970      8.326151 
1 1 1 -9  34 17 o 66.78269 5.391413 56.75588       8.699577 0.000000       0.000000 56.75588       8.699577 ?        ?        66.78269 5.391413 0.000000       5.391413 
1 1 1 -9  34 18 o 106.9530 3.906283 142.6510       10.16395 113.8899       16.97561 158.7232       12.68996 92.64293 7.585658 112.2946 4.647347 -19.65166      8.896070 
1 1 1 -9  34 19 o 26.62693 6.768604 9.610522       4.400736 8.666313       6.553770 10.38583       5.938745 25.55451 8.746495 27.40801 8.232270 -1.853500      12.01130 
1 1 1 -9  34 20 o 53.42843 4.203170 36.08353       5.428459 40.61773       8.506073 32.96789       7.051028 55.43901 6.414381 50.20749 5.873882 5.231525       8.697515 
1 1 1 -9  34 21 o 42.59942 4.426426 23.19500       4.528163 18.09704       9.467387 24.70714       5.156178 34.31882 10.41291 43.74486 4.922200 -9.426041      11.51767 
1 1 1 -9  34 22 o 49.55550 4.518372 31.51174       5.396493 32.73013       10.35166 31.05705       6.323793 46.93091 9.379595 48.66570 5.424456 -1.734791      10.83520 
1 1 1 -9  34 23 o 41.02017 4.114062 21.56635       4.057032 16.14116       7.105287 24.19072       4.941823 32.73587 8.742088 43.10467 4.785178 -10.36879      9.966044 
1 1 1 -9  34 24 o 33.46783 4.665229 14.71645       3.701574 13.49007       6.313171 15.35891       4.569419 29.84064 8.353174 33.57936 5.793347 -3.738728      10.16555 
1 1 1 -9  34 25 o 42.46175 4.052482 23.30024       4.142489 23.24345       7.313231 23.32707       5.026654 39.52991 7.868603 41.86271 5.027875 -2.332798      9.337796 
1 1 1 -9  34 26 o 12.59358 5.504561 -0.9250602E-02 3.202307 0.1068843      5.422538 -0.7144324E-01 3.968174 15.86840 7.039897 13.78817 6.073863 2.080228       9.297955 
1 1 1 -9  34 27 o 41.17006 4.164409 22.20879       4.120637 7.516123       6.758633 30.90150       5.198599 22.48113 8.688436 48.37910 4.459691 -25.89797      9.766154 
1 1 1 -9  34 28 o 30.84612 5.560008 13.36760       4.025668 20.07229       9.866186 12.02841       4.409420 31.91288 10.73365 28.54738 6.486337 3.365501       12.54128 
1 1 1 -9  34 29 o 11.96316 5.393252 -0.6945727     3.322085 2.333296       5.889114 -2.107799      4.023345 17.28631 7.511521 12.12607 5.637564 5.160243       9.391756 
1 1 1 -9  34 30 o 12.57354 5.551692 0.1317231      3.333444 -2.013593      6.199808 1.004102       3.953531 14.79796 6.918977 14.17703 6.157535 0.6209230      9.262154 
1 1 1 -9  34 31 o 31.86869 5.075222 14.45582       3.809377 13.43137       6.629979 14.96069       4.654344 26.47408 8.797006 31.22672 6.333302 -4.752642      10.83965 
1 1 1 -9  34 32 o 12.08487 5.539179 -0.8904703     3.689683 6.605494       5.939543 -5.600882      4.708350 19.72762 7.977213 11.11886 5.413644 8.608762       9.640720 
1 1 1 -9  34 33 o 18.25992 6.448173 5.347607       3.576038 6.448671       6.552864 4.880624       4.267518 19.29377 8.140629 17.66015 6.882093 1.633619       10.65988 
1 1 1 -9  35 1  o 38.74788 4.630803 18.89887       4.286136 18.16824       5.229872 20.39345       7.480046 37.61429 5.899482 39.12303 8.112232 -1.508743      10.03056 
1 1 1 -9  35 2  o 66.86230 3.614279 55.26819       5.867075 58.91637       7.508118 49.54682       9.402487 68.77050 4.504957 62.39151 6.269037 6.378986       7.719810 
1 1 1 -9  35 3  o 82.06575 4.079422 83.48254       8.132670 71.92472       11.76010 94.07623       11.25892 75.17705 6.482593 86.60456 5.361106 -11.42751      8.412222 
1 1 1 -9  35 4  o 81.83334 3.758577 82.80136       7.475298 81.07562       8.506173 88.65476       15.66576 80.77972 4.337015 82.71390 7.866670 -1.934174      8.982995 
1 1 1 -9  35 5  o 23.78623 6.614367 7.387154       3.972572 9.739830       4.939979 3.080952       6.683304 27.14951 7.306688 20.97805 8.469425 6.171461       11.18565 
1 1 1 -9  35 6  o 62.38517 3.615890 48.14941       5.473531 44.28619       6.889826 54.75930       9.012197 59.47799 4.794111 65.84341 5.671945 -6.365429      7.426605 
1 1 1 -9  35 7  o 63.68639 3.581788 50.17346       5.536418 40.58168       6.872968 67.89990       9.343410 56.83217 5.014023 73.52170 5.249534 -16.68953      7.259341 
1 1 1 -9  35 8  o 31.23690 7.490951 13.00586       5.628510 5.785694       8.341304 19.04154       7.626471 24.63918 9.615960 37.55345 8.528811 -12.91427      12.85330 
1 1 1 -9  35 9  o 22.26559 8.250804 5.367203       5.945954 4.262214       7.412785 7.360883       9.957039 22.58602 8.987194 26.95972 10.51053 -4.373705      13.82899 
1 1 1 -9  35 10 o 24.69736 7.745197 7.925204       5.186528 3.313156       7.765426 11.63951       6.968789 22.15239 9.060213 29.41786 8.935425 -7.265467      12.72514 
1 1 1 -9  35 11 o 80.03261 4.214251 79.79372       8.190119 79.41558       13.41253 80.01855       10.34217 78.29297 7.107308 79.61067 5.362227 -1.317703      8.903218 
1 1 1 -9  35 12 o 101.0104 3.998456 126.8442       9.822808 122.4159       16.65997 129.2040       12.16159 97.19360 7.082576 101.4224 4.935445 -4.228760      8.632584 
1 1 1 -9  35 13 o 23.07610 7.764977 6.728857       5.163365 15.79316       8.366192 1.152083       6.562240 33.54224 9.692273 19.11005 8.108590 14.43219       12.63683 
1 1 1 -9  35 14 o 54.67325 4.884012 37.85922       6.438652 37.68223       10.56534 37.96378       8.120864 52.61119 8.532847 54.09799 6.276410 -1.486801      10.59258 
1 1 1 -9  35 15 o 58.50288 4.538719 43.18023       6.420052 41.24706       10.86836 44.21631       7.956602 55.02251 8.369039 58.67294 5.634014 -3.650433      10.08875 
1 1 1 -9  35 16 o 17.60402 7.184378 2.079672       4.869795 0.000000       0.000000 2.079672       4.869795 ?        ?        17.60402 7.184378 0.000000       7.184378 
1 1 1 -9  35 17 o 23.34956 6.783618 7.357697       4.088136 11.45061       8.248822 6.025065       4.706854 28.59707 9.811853 21.70091 7.412711 6.896168       12.29718 
1 1 1 -9  35 18 o 27.71329 6.230879 10.38512       4.105471 12.52954       8.250451 9.679394       4.733058 29.39737 9.814506 26.45841 7.165535 2.938961       12.15193 
1 1 1 -9  35 19 o 38.23035 4.577776 18.80575       4.180111 25.20301       9.367221 17.21505       4.670991 41.16028 9.527413 36.15530 5.472496 5.004982       10.98726 
1 1 1 -9  35 20 o 55.45889 3.590783 38.73039       4.826759 33.75646       8.305377 41.26708       5.931218 49.53674 7.081372 56.85264 4.313303 -7.315899      8.291587 
1 1 1 -9  35 21 o 67.67307 3.635818 57.83990       5.973884 63.21249       9.483658 54.30581       7.691709 69.04419 5.686914 64.63121 4.920635 4.412979       7.520216 
1 1 1 -9  35 22 o 54.83103 3.533871 38.07506       4.696717 34.78143       7.999274 39.80785       5.802118 50.02018 6.733356 55.55845 4.319401 -5.538277      7.999707 
1 1 1 -9  35 23 f 11.90864 5.382804 -1.161360      3.334627 -4.270112      5.559282 0.5857698      4.167621 13.66862 6.441466 14.72879 6.359658 -1.060163      9.051946 
1 1 1 -9  35 24 o 39.65380 4.315144 20.56951       4.102634 16.03467       6.949603 22.99531       5.082839 31.72256 8.720591 41.37208 5.152916 -9.649519      10.12923 
1 1 1 -9  35 25 o 17.69065 6.340158 4.127048       3.469144 -1.023170      5.962861 6.762282       4.265318 15.70069 7.136945 21.47991 7.052547 -5.779225      10.03366 
1 1 1 -9  35 26 o 26.41560 5.870269 9.978179       3.680754 10.24760       6.460338 9.848685       4.478781 24.93872 8.677304 25.49055 6.998137 -0.5518284     11.14762 
1 1 1 -9  35 27 o 48.36946 4.215284 30.98681       4.919021 28.64442       11.51061 31.51017       5.440866 36.76388 11.53962 48.34198 4.676915 -11.57810      12.45136 
1 1 1 -9  35 28 f 14.53798 6.007363 1.900159       3.459760 2.318455       6.444910 1.730816       4.100716 17.55682 7.737069 15.07415 6.403536 2.482676       10.04328 
1 1 1 -9  35 29 o 40.02320 4.222989 21.62955       4.056753 29.79200       7.411974 18.13862       4.847237 43.29679 7.283203 35.11710 5.871334 8.179699       9.355084 
1 1 1 -9  35 30 o 34.82687 4.800962 17.02766       3.966257 12.21887       6.695279 19.62764       4.923071 25.00265 8.823624 36.46354 5.729112 -11.46089      10.52041 
1 1 1 -9  35 31 o 12.25576 5.596146 -0.6703012     3.718869 -1.424367      5.619096 -0.8257738E-01 4.960763 14.06353 6.579292 14.14253 6.459836 -0.7900429E-01 9.220443 
1 1 1 -9  35 32 o 11.86792 5.512397 -1.365486      3.832799 -2.755856      5.971974 -0.3916655     4.997952 13.66324 6.507837 13.86870 6.389688 -0.2054615     9.120310 
1 1 1 -9  36 1  o 94.77699 3.411305 111.1219       7.865940 134.1625       14.47549 101.4678       9.370063 102.7214 5.806418 90.17232 4.276342 12.54906       7.211213 
1 1 1 -9  36 2  o 16.88456 6.485688 2.622241       3.749707 5.767727       5.217573 -0.7377284     5.392526 22.01766 7.787545 16.20653 7.111819 5.811132       10.54627 
1 1 1 -9  36 3  o 32.23502 5.109980 13.33994       3.880319 17.14111       5.186198 8.505914       5.848504 36.29282 6.078750 25.51699 8.250196 10.77583       10.24778 
1 1 1 -9  36 4  o 84.73291 3.091343 88.58913       6.372455 85.62167       9.106414 91.43666       8.920487 82.70567 4.535673 85.59417 4.290374 -2.888496      6.243368 
1 1 1 -9  36 5  o 21.06725 6.439589 5.732308       3.611858 8.013426       4.798406 2.750261       5.486309 24.62536 7.400570 19.15430 7.694458 5.471058       10.67582 
1 1 1 -9  36 6  o 46.57519 4.120474 27.17677       4.628488 18.06870       5.696293 44.87507       7.940448 37.08164 6.542810 59.34622 5.555110 -22.26458      8.582984 
1 1 1 -9  36 7  o 31.95867 6.796718 13.59768       5.130276 9.965307       7.572895 16.67877       6.974591 27.58027 9.402896 34.88618 8.321101 -7.305910      12.55608 
1 1 1 -9  36 8  o 14.94767 6.466430 -0.1340887     4.324975 1.759441       7.794074 -0.9765576     5.198828 20.89498 8.850183 15.70209 6.933108 5.192890       11.24250 
1 1 1 -9  36 9  o 117.9966 3.470580 172.5214       9.968630 180.7435       19.39705 169.5703       11.62068 118.0695 6.769962 116.6015 4.096061 1.468018       7.912654 
1 1 1 -9  36 10 o 111.6285 3.481872 154.5363       9.460032 145.8907       18.32618 157.6769       11.04542 105.5174 7.169664 112.4197 4.038405 -6.902351      8.228779 
1 1 1 -9  36 11 o 70.35281 3.683345 61.65875       6.292809 57.99369       12.63933 62.86666       7.256061 65.58715 8.078561 70.79748 4.225003 -5.210327      9.116676 
1 1 1 -9  36 12 o 93.49363 3.429931 108.5687       7.801296 100.8009       15.40052 111.2500       9.048081 87.20788 7.314077 94.35532 3.943779 -7.147438      8.309581 
1 1 1 -9  36 13 o 81.03133 3.502358 81.75691       6.899583 73.01987       13.68177 84.73656       7.989934 73.58961 7.745387 82.23148 3.999201 -8.641869      8.716916 
1 1 1 -9  36 14 o 29.12991 6.034573 11.34524       4.142740 12.00706       8.052841 11.10704       4.831050 29.05222 9.696195 28.46029 7.012033 0.5919380      11.96599 
1 1 1 -9  36 15 o 34.15962 6.066154 15.56514       4.864691 0.000000       0.000000 15.56514       4.864691 ?        ?        34.15962 6.066154 0.000000       6.066154 
1 1 1 -9  36 16 o 20.85335 6.487581 5.810501       3.646611 7.874072       6.651341 4.923668       4.360341 24.37694 8.773732 19.95926 7.113127 4.417688       11.29491 
1 1 1 -9  36 17 o 22.94222 6.656065 7.241911       3.938306 5.382406       8.235005 7.793319       4.484371 22.94319 9.350390 23.69727 7.161528 -0.7540836     11.77783 
1 1 1 -9  36 18 o 50.36502 3.991344 32.27963       4.858710 31.83173       10.14022 32.41311       5.535529 45.97846 9.368542 50.13702 4.581260 -4.158566      10.42869 
1 1 1 -9  36 19 o 41.04268 4.592975 21.89516       4.515050 11.11672       9.347521 25.17512       5.156470 27.17350 10.28762 43.85061 4.909671 -16.67711      11.39913 
1 1 1 -9  36 20 o 46.01208 4.570317 27.58691       5.056865 20.33647       8.838634 31.11515       6.165694 35.34164 9.880330 48.35179 5.320622 -13.01015      11.22185 
1 1 1 -9  36 21 o 26.29707 5.971544 9.676102       3.739125 8.272163       6.681164 10.31637       4.511886 23.75368 8.756108 26.66352 6.893568 -2.909845      11.14409 
1 1 1 -9  36 22 f 13.21839 5.721630 0.2946562      3.389962 3.086459       6.029571 -0.9956875     4.099178 18.70606 7.845680 13.30673 5.995659 5.399333       9.874342 
1 1 1 -9  36 23 o 26.62797 5.928596 10.04748       3.748162 9.440983       6.443715 10.35763       4.607906 24.45997 8.654074 26.34336 7.042341 -1.883396      11.15740 
1 1 1 -9  36 24 o 30.21001 5.380054 12.65612       3.815493 15.29963       6.640910 11.35351       4.661716 30.53134 8.574703 27.48440 6.955477 3.046942       11.04102 
1 1 1 -9  36 25 o 31.65683 5.319037 13.97034       3.957961 5.934938       6.638204 18.40263       4.930156 20.65783 8.403995 35.99596 5.818878 -15.33813      10.22186 
1 1 1 -9  36 26 o 32.74735 5.754404 15.41009       4.424606 13.39761       10.72195 15.82315       4.857500 25.50389 10.56049 32.68629 6.327034 -7.182400      12.31078 
1 1 1 -9  36 27 o 19.66468 6.473657 5.908476       3.592918 -2.777110      6.298583 10.09793       4.374436 14.53384 6.851418 25.21970 6.913084 -10.68585      9.733070 
1 1 1 -9  36 28 o 12.00866 5.444655 -0.6408544     3.443033 1.187265       6.170965 -1.467176      4.148828 16.26067 7.338809 12.48843 5.777840 3.772246       9.340319 
1 1 1 -9  36 29 f 17.41360 6.437785 4.532396       3.616173 2.723309       6.227457 5.452737       4.441761 17.03929 7.552634 18.62420 7.082159 -1.584915      10.35371 
1 1 1 -9  36 30 o 21.47842 7.740548 8.354673       5.179050 1.630309       6.507060 19.97665       8.554589 16.34323 7.439345 29.60427 9.994852 -13.26105      12.45957 
1 1 1 -9  37 1  o 22.45727 5.959832 6.719863       3.315272 5.811845       4.161875 8.296444       5.484034 21.23282 6.966236 24.85764 7.984682 -3.624821      10.59639 
1 1 1 -9  37 2  o 37.25542 4.303237 17.61064       3.835073 20.02815       5.158191 14.62251       5.734731 39.27973 5.542686 32.71759 7.370264 6.562145       9.221830 
1 1 1 -9  37 3  o 91.29637 3.010415 103.1024       6.688391 106.1617       9.652753 100.2771       9.276113 91.91868 4.321445 89.36029 4.272136 2.558388       6.076679 
1 1 1 -9  37 4  o 61.75305 3.182934 47.32088       4.773690 44.41992       6.582023 50.54016       6.933735 59.24675 4.594775 63.24980 4.528510 -4.003044      6.451307 
1 1 1 -9  37 5  o 95.25699 3.028560 112.2720       7.021289 105.0017       9.975163 119.4109       9.884658 91.28218 4.498188 97.58425 4.166260 -6.302071      6.131184 
1 1 1 -9  37 6  o 29.93795 5.740935 11.82773       4.035985 9.201350       5.081755 16.31450       6.642043 25.94860 7.570250 34.23479 8.090546 -8.286182      11.07996 
1 1 1 -9  37 7  f 32.29170 4.850950 13.45216       3.699397 10.19575       4.825701 18.09354       5.761211 27.29478 7.165470 36.75102 6.678860 -9.456247      9.795465 
1 1 1 -9  37 8  o 100.6339 4.066896 127.0454       9.952866 147.1514       17.25358 117.0181       12.18453 105.7396 6.730783 95.66632 5.246619 10.07330       8.534076 
1 1 1 -9  37 9  o 57.26746 3.945451 41.23126       5.472406 50.28397       10.64177 37.97672       6.380718 61.13968 7.285748 54.52107 4.853189 6.618607       8.754174 
1 1 1 -9  37 10 o 80.72373 3.544986 81.37310       6.956513 62.81081       12.62481 89.46631       8.336221 67.83788 7.777350 84.32886 4.068555 -16.49097      8.777261 
1 1 1 -9  37 11 o 26.28108 6.794889 9.489697       4.383554 11.16839       8.938367 8.958097       5.029974 28.19215 10.16779 25.41762 7.562593 2.774527       12.67189 
1 1 1 -9  37 12 f 55.53041 4.055898 39.00069       5.450655 56.10803       11.53010 34.07737       6.185450 64.00899 7.536156 51.40033 5.001376 12.60866       9.044744 
1 1 1 -9  37 13 o 15.19571 6.345034 1.147075       3.917163 1.493120       7.351923 1.009895       4.628923 19.61218 8.457366 16.08545 6.817065 3.526726       10.86275 
1 1 1 -9  37 14 o 38.92141 5.854915 20.22763       5.381370 0.000000       0.000000 20.22763       5.381370 ?        ?        38.92141 5.854915 0.000000       5.854915 
1 1 1 -9  37 15 f 33.73405 5.425000 15.15183       4.308505 18.55518       8.717687 14.05184       4.956100 34.39309 9.880200 31.84147 6.604010 2.551620       11.88408 
1 1 1 -9  37 16 o 23.04731 6.797466 7.464125       4.078123 17.85454       8.590531 4.441288       4.633518 33.48491 9.862989 19.28267 7.255675 14.20224       12.24432 
1 1 1 -9  37 17 o 45.94087 4.370162 27.31618       4.833665 27.88011       9.757758 27.13280       5.564353 41.94957 9.733694 45.29673 5.131214 -3.347160      11.00337 
1 1 1 -9  37 18 o 12.89035 5.712567 -0.4856209     3.561051 -6.364756      7.425838 1.270157       4.058107 15.21870 7.251003 15.22212 6.413567 -0.3419876E-02 9.680439 
1 1 1 -9  37 19 o 35.89950 6.234213 18.00605       5.256131 -1.771230      8.718845 29.29701       6.587812 18.35241 8.449655 46.15486 5.998971 -27.80245      10.36264 
1 1 1 -9  37 20 o 39.15168 4.650781 20.28589       4.350636 19.19287       8.107487 20.72793       5.155856 34.02856 9.444212 38.92282 5.596454 -4.894264      10.97786 
1 1 1 -9  37 21 o 18.06893 6.666984 4.242704       3.874949 7.637650       7.944575 3.182937       4.438738 22.96949 9.247979 17.27914 6.927934 5.690357       11.55515 
1 1 1 -9  37 22 o 12.16920 5.570343 -1.509117      3.714591 -7.415404      7.543467 0.3814931      4.267904 14.58038 7.040178 14.43915 6.331857 0.1412334      9.468713 
1 1 1 -9  37 23 o 35.40244 4.779675 17.00732       4.018272 20.62540       7.092921 15.29730       4.876254 35.61550 8.322913 32.28199 6.424572 3.333511       10.51409 
1 1 1 -9  37 24 o 15.41138 6.146434 2.603936       3.475038 0.5993576      6.169037 3.535653       4.205793 16.39634 7.374290 17.04146 6.773241 -0.6451149     10.01284 
1 1 1 -9  37 25 o 26.93530 6.449848 11.07281       4.177536 13.48901       10.41378 10.60941       4.560577 25.12547 10.40606 25.80990 7.052078 -0.6844215     12.57051 
1 1 1 -9  37 26 o 22.31323 6.334044 7.730090       3.603839 12.41844       6.196872 5.334095       4.430015 26.05313 8.497544 18.75199 7.086073 7.301140       11.06439 
1 1 1 -9  37 27 o 17.39032 6.464881 4.454675       3.655899 -0.6704316     6.311824 7.042168       4.484800 15.27787 7.088574 20.60781 7.225782 -5.329937      10.12224 
1 1 1 -9  37 28 o 18.68551 6.960706 5.593322       4.242369 -1.841800      6.107622 12.52482       5.897143 14.37052 6.765889 25.81685 8.278705 -11.44634      10.69178 
1 1 1 -9  38 1  o 33.74044 5.405245 15.00995       4.294305 14.59571       6.601396 15.31384       5.654168 31.75996 8.401254 33.18896 7.198579 -1.428997      11.06348 
1 1 1 -9  38 2  o 54.52072 3.535550 37.29602       4.672038 36.83878       6.457327 37.79834       6.768145 53.41497 5.019654 53.99706 5.208102 -0.5820885     7.233343 
1 1 1 -9  38 3  o 63.31503 3.563110 50.26545       5.475405 59.37410       7.465500 39.66198       8.054822 68.26009 4.513362 54.70383 6.148631 13.55626       7.627326 
1 1 1 -9  38 4  f 19.00068 7.119960 4.076653       4.451904 3.110101       5.902125 5.352427       6.780824 19.41389 7.914468 22.07649 8.654083 -2.662603      11.72740 
1 1 1 -9  38 5  o 51.31197 3.921471 33.28045       4.866325 36.47402       6.155502 27.95798       7.946602 53.26884 4.793122 44.92254 7.524966 8.346298       8.921835 
1 1 1 -9  38 6  o 55.33745 3.321468 38.30873       4.458428 38.61269       6.345292 38.01234       6.265800 54.79562 4.800361 54.37908 4.776830 0.4165382      6.772117 
1 1 1 -9  38 7  o 77.03190 3.067722 73.88055       5.747161 66.78524       8.211909 80.69215       8.046054 72.20657 4.692344 79.81071 4.151270 -7.604141      6.265073 
1 1 1 -9  38 8  o 31.82570 6.056505 13.68697       4.525613 14.97448       8.054758 13.09304       5.470769 31.41429 9.619264 30.42356 7.441570 0.9907303      12.16171 
1 1 1 -9  38 9  o 44.66266 4.766561 25.81196       5.107741 36.76942       9.839784 21.77040       5.975930 50.76143 8.236606 40.11551 6.322106 10.64592       10.38319 
1 1 1 -9  38 10 o 52.72746 4.250328 35.53635       5.415051 28.13292       10.14553 38.48557       6.403418 42.66325 9.943206 54.49246 4.873529 -11.82920      11.07333 
1 1 1 -9  38 11 o 35.58985 5.622199 16.95372       4.714314 17.33889       9.606791 16.83154       5.410585 32.69722 10.57397 34.89294 6.604930 -2.195721      12.46732 
1 1 1 -9  38 12 o 19.78559 7.313057 4.859247       4.665854 0.000000       0.000000 4.859247       4.665854 ?        ?        19.78559 7.313057 0.000000       7.313057 
1 1 1 -9  38 13 o 11.08744 5.251579 -3.784472      3.782999 -2.678201      7.606105 -4.148076      4.360593 17.14588 7.893398 11.94096 5.650635 5.204916       9.707492 
1 1 1 -9  38 14 o 32.26557 5.852089 14.26317       4.431962 7.402658       8.361016 16.94413       5.226672 23.74349 9.512224 34.88744 6.382947 -11.14395      11.45532 
1 1 1 -9  38 15 o 67.60332 3.699487 58.18495       6.071377 58.36003       12.40109 58.12976       6.962938 62.62380 8.332747 67.08710 4.281439 -4.463303      9.368319 
1 1 1 -9  38 16 o 23.61880 6.807105 8.072662       4.131691 7.231447       8.156241 8.363043       4.792033 23.23040 9.364255 23.81832 7.441193 -0.5879173     11.96080 
1 1 1 -9  38 17 o 20.00456 7.197138 5.457634       4.475170 10.30406       8.171824 3.381552       5.348481 25.49204 9.626132 18.39550 7.520900 7.096540       12.21582 
1 1 1 -9  38 18 o 12.31674 5.625140 -1.525547      3.759998 -3.117455      7.253427 -0.9405966     4.396870 16.12082 7.519800 13.74900 6.200932 2.371823       9.746740 
1 1 1 -9  38 19 o 38.18515 5.036562 19.72635       4.572512 15.11782       8.959455 21.34947       5.317102 28.86553 10.20530 39.19492 5.736680 -10.32938      11.70716 
1 1 1 -9  38 20 o 58.15947 4.031942 44.15502       5.679028 38.06756       11.21341 46.25504       6.586141 46.49540 10.17959 58.92453 4.623693 -12.42912      11.18045 
1 1 1 -9  38 21 o 21.89203 6.952434 7.312812       4.166958 10.43374       8.356367 6.279933       4.807292 24.37683 9.591594 20.49829 7.447845 3.878542       12.14368 
1 1 1 -9  38 22 o 30.51847 6.022727 13.59296       4.320004 8.893192       8.865196 15.05650       4.947126 22.89195 9.550993 31.61188 6.633813 -8.719929      11.62880 
1 1 1 -9  38 23 o 18.87257 6.812636 5.314276       4.013776 10.08481       8.639377 4.001150       4.532649 23.26545 9.540624 17.55061 7.013000 5.714848       11.84085 
1 1 1 -9  38 24 o 37.25443 5.420234 19.89086       4.776545 14.04263       10.66858 21.35707       5.341855 24.87487 10.43478 38.05889 5.954759 -13.18402      12.01432 
1 1 1 -9  38 25 o 25.10201 6.399690 9.852306       3.926048 9.832210       6.565522 9.863493       4.898306 22.88678 8.631430 24.01248 7.526412 -1.125698      11.45201 
1 1 1 -9  38 26 o 14.29623 6.246777 1.252421       4.121231 -2.928074      6.356304 4.284430       5.413226 14.18378 6.743907 17.72106 7.433302 -3.537280      10.03665 
1 1 1 -9  39 1  o 10.36882 4.902995 -3.280347      3.271452 -2.808784      5.087627 -3.612780      4.271670 13.86839 6.409922 12.08365 5.679552 1.784740       8.564135 
1 1 1 -9  39 2  o 22.00631 5.975594 6.693813       3.286436 8.484380       4.499818 4.646826       4.811242 24.36897 7.127617 19.59752 7.389305 4.771442       10.26668 
1 1 1 -9  39 3  o 53.74643 6.422070 39.46620       8.244987 0.000000       0.000000 39.46620       8.244987 ?        ?        53.74643 6.422070 0.000000       6.422070 
1 1 1 -9  39 4  o 38.57592 4.373991 19.27028       4.039298 26.02728       5.849689 13.11225       5.584401 44.15166 5.559894 29.98917 7.625515 14.16249       9.437209 
1 1 1 -9  39 5  o 12.31883 5.451055 -0.5338301     3.230531 -0.3252074     4.469706 -0.7620073     4.674491 14.56861 6.430780 14.55231 6.491217 0.1629639E-01  9.137332 
1 1 1 -9  39 6  o 23.31788 5.958136 7.534026       3.397690 9.433707       4.742772 5.531166       4.869867 25.56607 7.269291 20.59787 7.494374 4.968208       10.44070 
1 1 1 -9  39 7  o 66.62392 3.187911 55.74662       5.160722 48.31938       7.298027 63.17523       7.298699 60.73140 4.974801 70.09863 4.293268 -9.367237      6.571210 
1 1 1 -9  39 8  o 15.62914 6.420435 1.807825       3.921347 -7.876836      6.655596 6.957229       4.853144 13.76234 6.637162 22.23056 7.528059 -8.468220      10.03611 
1 1 1 -9  39 9  o 35.91990 5.473659 17.38946       4.640040 22.93917       9.045096 15.40742       5.405486 37.70226 9.767081 32.82677 6.972745 4.875488       12.00063 
1 1 1 -9  39 10 o 24.72501 6.716224 8.764292       4.150706 10.05720       7.764212 8.246932       4.911447 25.67216 9.443321 23.76937 7.547926 1.902790       12.08915 
1 1 1 -9  39 11 o 75.28990 5.370016 75.56444       9.787861 0.000000       0.000000 75.56444       9.787861 ?        ?        75.28990 5.370016 0.000000       5.370016 
1 1 1 -9  39 12 o 13.78632 5.986875 0.2599010      3.736181 0.4610832      7.485996 0.1931653      4.311555 18.37836 8.205086 14.58931 6.381787 3.789051       10.39474 
1 1 1 -9  39 13 f 51.77962 4.213509 34.78489       5.270747 25.75090       9.810360 38.45072       6.249296 38.95718 10.21155 53.97593 4.801157 -15.01875      11.28392 
1 1 1 -9  39 14 o 50.04949 4.325727 32.70207       5.224144 33.34338       10.46772 32.48936       6.028594 44.87771 9.843061 49.26554 5.094975 -4.387833      11.08353 
1 1 1 -9  39 15 o 22.57357 6.979563 7.518415       4.228033 -2.731169      7.759531 11.84648       5.042303 16.78944 7.813588 28.04600 7.305938 -11.25656      10.69714 
1 1 1 -9  39 16 o 34.13416 6.580075 16.87163       5.274963 11.11055       8.409300 20.60909       6.773228 25.63680 9.745661 36.65097 7.821907 -11.01417      12.49640 
1 1 1 -9  39 17 o 44.56033 4.620490 26.50422       4.944595 27.26916       9.910580 26.25070       5.705429 38.84115 10.30284 43.59202 5.492547 -4.750870      11.67547 
1 1 1 -9  39 18 o 18.24209 6.777831 4.519622       4.017381 7.294815       8.104846 3.615676       4.625615 22.17020 9.181000 17.60219 7.067173 4.568005       11.58601 
1 1 1 -9  39 19 f 37.44808 5.595685 19.79553       4.950069 16.78066       9.899422 20.80068       5.715986 28.53414 10.63228 37.57221 6.476746 -9.038069      12.44964 
1 1 1 -9  39 20 o 34.03661 5.657109 16.57640       4.527562 10.38422       8.237256 19.25693       5.419642 23.83319 9.476957 36.00692 6.411665 -12.17373      11.44212 
1 1 1 -9  39 21 o 15.61348 6.465364 2.474927       4.018959 3.180486       8.343090 2.261734       4.586125 18.98570 8.554125 15.92198 6.768130 3.063712       10.90782 
1 1 1 -9  39 22 o 24.91188 7.476464 10.38888       4.899803 11.48984       9.260248 9.960798       5.774354 23.68012 9.810615 23.68434 8.205769 -0.4217148E-02 12.78995 
1 1 1 -9  39 23 o 28.08963 6.990766 12.74520       4.766179 15.94517       8.791575 11.41325       5.672034 26.85908 10.01743 25.21980 8.122213 1.639277       12.89648 
1 1 1 -9  39 24 o 14.25126 6.244061 1.143019       4.142346 0.7911304      6.933890 1.338300       5.165412 16.40882 7.547691 15.37425 6.842869 1.034568       10.18786 
1 1 1 -9  40 1  o 29.29357 6.860386 12.46378       4.810707 14.04373       5.621742 8.142260       9.297517 30.62049 7.575893 24.12637 9.895920 6.494122       12.46288 
1 1 1 -9  40 2  o 24.65361 6.091538 8.600048       3.638175 10.61314       4.699426 5.588620       5.747762 26.86763 7.079607 20.76018 8.015306 6.107452       10.69420 
1 1 1 -9  40 3  o 16.23995 6.280580 2.870448       3.533378 0.6518331      4.756650 5.601835       5.277787 15.52767 6.749017 20.55910 7.742028 -5.031429      10.27075 
1 1 1 -9  40 4  o 11.77138 5.527823 -3.217834      4.030719 1.232463       7.381020 -5.108951      4.811506 18.67746 8.253301 12.10724 5.787282 6.570218       10.08016 
1 1 1 -9  40 5  o 20.42407 7.931145 5.292101       5.652033 0.000000       0.000000 5.292101       5.652033 ?        ?        20.42407 7.931145 0.000000       7.931145 
1 1 1 -9  40 6  o 26.01454 6.703332 9.809718       4.275977 11.02942       7.649867 9.255470       5.156787 26.22983 9.413175 24.80336 7.714601 1.426474       12.17058 
1 1 1 -9  40 7  o 22.35152 6.829050 7.236191       4.062552 8.547586       7.348607 6.658991       4.875304 23.92876 9.107018 21.57317 7.535987 2.355591       11.82070 
1 1 1 -9  40 8  o 14.61338 6.145310 1.241093       3.714441 7.714840       7.053826 -1.242785      4.369302 23.07854 8.887567 13.54478 6.138071 9.533759       10.80115 
1 1 1 -9  40 9  o 60.74808 4.537842 48.43141       6.669125 0.000000       0.000000 48.43141       6.669125 ?        ?        60.74808 4.537842 0.000000       4.537842 
1 1 1 -9  40 10 o 76.41203 4.345165 76.19113       8.057687 0.000000       0.000000 76.19113       8.057687 ?        ?        76.41203 4.345165 0.000000       4.345165 
1 1 1 -9  40 11 o 13.14300 5.880647 -0.6204069     3.867834 1.655284       6.971911 -1.632213      4.648833 18.31354 8.059747 13.63234 6.236880 4.681199       10.19108 
1 1 1 -9  40 12 o 41.96862 4.945129 23.69889       4.960554 31.87465       9.918258 20.97155       5.728503 43.64214 9.588425 38.33500 6.354520 5.307148       11.50295 
1 1 1 -9  40 13 o 21.03952 7.657670 6.499796       5.085004 -1.073181      7.783196 12.13953       6.716670 17.35952 7.989213 26.91144 8.850819 -9.551918      11.92328 
1 1 1 -9  40 14 o 19.49674 6.863580 5.453177       4.049250 10.94648       7.999532 3.560782       4.695194 25.12668 9.516008 17.65875 7.109585 7.467928       11.87858 
1 1 1 -9  40 15 o 17.30585 7.119527 3.177523       4.830856 15.18418       8.256119 -3.073297      5.957080 28.55941 9.815596 14.35399 6.734122 14.20542       11.90354 
1 1 1 -9  40 16 o 31.84258 5.806107 14.53530       4.339410 8.401635       7.227080 17.99336       5.426489 22.62145 8.914132 34.72514 6.654816 -12.10369      11.12422 
1 1 1 -9  40 17 o 17.00084 6.851016 3.431207       4.364250 -5.180244      7.435534 7.957071       5.390447 14.89477 7.139691 22.11348 7.905735 -7.218708      10.65250 
1 1 1 -9  40 18 o 27.18584 7.076088 11.72897       4.732588 18.83273       9.443083 9.346240       5.468993 29.69268 10.47897 23.46429 7.990864 6.228388       13.17812 
1 1 1 -9  40 19 o 21.05809 7.616244 7.258793       5.019561 13.35307       9.233292 4.702062       5.980506 25.16760 10.02505 18.76123 7.837381 6.406374       12.72503 
1 1 1 -9  40 20 o 16.82168 6.912097 3.447483       4.546418 9.066546       8.087289 0.8511407      5.497332 22.14639 9.171087 15.55843 6.982288 6.587963       11.52654 
1 1 1 -9  40 21 o 19.55964 7.628696 6.151604       5.247180 0.000000       0.000000 6.151604       5.247180 ?        ?        19.55964 7.628696 0.000000       7.628696 
1 1 1 -9  40 22 o 16.60883 6.633231 3.716431       4.052912 0.9298407      7.908591 4.708909       4.719793 17.09574 7.932946 17.90228 7.155376 -0.8065414     10.68321 
1 1 1 -9  41 1  o 22.67323 6.091094 7.453822       3.436745 5.331690       4.835212 9.620559       4.885764 19.66976 7.409621 24.93484 7.461675 -5.265081      10.51566 
1 1 1 -9  41 2  o 34.30791 4.644380 15.77700       3.783288 21.59921       5.488512 10.50614       5.222175 39.18141 5.933825 25.90557 7.705222 13.27584       9.725263 
1 1 1 -9  41 3  o 42.04510 4.099162 23.14861       4.146702 28.01007       6.228316 19.27797       5.557493 44.77385 5.847972 36.53932 6.478591 8.234535       8.727595 
1 1 1 -9  41 4  o 11.74403 5.250735 -0.6044589     3.077386 -0.4842482     4.359227 -0.7238845     4.344970 13.91580 6.233495 13.72382 6.179137 0.1919765      8.777141 
1 1 1 -9  41 5  o 10.70060 4.992036 -2.259722      3.198088 0.7662110      4.553996 -5.204086      4.492197 15.11451 6.586111 11.40466 5.488141 3.709846       8.573013 
1 1 1 -9  41 6  o 21.66127 5.918809 6.758206       3.212498 3.936569       4.227655 10.61363       4.941796 17.79077 6.872751 26.20219 7.410180 -8.411421      10.10670 
1 1 1 -9  41 7  o 35.38117 4.918696 16.98366       4.126379 19.65022       6.723081 15.37206       5.226638 35.34900 7.992823 32.13329 6.882058 3.215710       10.54741 
1 1 1 -9  41 8  o 45.25847 5.599137 28.47509       6.043715 0.000000       0.000000 28.47509       6.043715 ?        ?        45.25847 5.599137 0.000000       5.599137 
1 1 1 -9  41 9  o 26.87497 7.303186 11.19828       4.906738 16.15069       8.466414 8.693562       6.021022 29.50865 9.943194 23.25558 8.350463 6.253063       12.98450 
1 1 1 -9  41 10 o 19.99812 7.225661 5.855324       4.516509 7.739681       7.512321 4.788652       5.652077 22.34026 8.993493 19.30016 7.789851 3.040102       11.89810 
1 1 1 -9  41 11 o 43.73455 5.202459 26.37548       5.436049 33.78237       9.588179 22.86683       6.599149 44.71797 9.108407 38.67986 7.267885 6.038113       11.65269 
1 1 1 -9  41 12 o 13.43912 6.020641 -0.3235763     4.067841 5.445627       7.235894 -2.989386      4.918683 20.33970 8.566641 12.98533 6.100583 7.354373       10.51686 
1 1 1 -9  41 13 o 25.74587 8.246541 11.27884       5.852633 2.903253       7.412863 25.14020       9.536326 18.65605 8.256170 35.94091 10.33646 -17.28486      13.22901 
1 1 1 -9  41 14 o 18.06916 6.879328 4.561419       4.194110 -5.703175      7.236375 9.753718       5.146713 14.44355 6.954340 24.24730 7.729692 -9.803748      10.39764 
1 1 1 -9  41 15 o 28.39264 7.729062 13.38883       5.490058 7.971849       8.718722 16.94785       7.067080 21.85352 9.312179 30.54729 8.931726 -8.693769      12.90319 
1 1 1 -9  41 16 o 16.35605 6.605640 3.206208       4.067025 3.364005       7.728611 3.145776       4.782809 18.69754 8.342998 16.80218 7.013138 1.895361       10.89907 
1 1 1 -9  41 17 o 20.46568 6.985477 6.686547       4.179777 9.991593       8.091905 5.483820       4.881411 22.86652 9.287501 19.01823 7.374685 3.848291       11.85933 
1 1 1 -9  41 18 o 17.01454 6.599235 4.021621       3.909503 3.892552       7.780273 4.065218       4.521834 18.72587 8.362206 17.34038 6.978607 1.385490       10.89162 
1 1 1 -9  41 19 o 26.61306 6.805751 11.40664       4.430632 8.702353       8.630560 12.37438       5.162883 21.52196 9.220311 26.90019 7.562511 -5.378229      11.92500 
1 1 1 -9  42 1  o 16.40137 6.096609 3.547020       3.251087 11.07971       4.856430 -2.570158      4.376408 26.35436 7.307519 12.37478 5.794788 13.97958       9.326275 
1 1 1 -9  42 2  o 21.29273 6.065905 6.740008       3.299316 10.72154       4.860991 3.339055       4.492624 25.89294 7.358367 17.02000 6.917541 8.872934       10.09940 
1 1 1 -9  42 3  o 15.47956 5.995867 2.853269       3.224037 6.613956       4.688007 -0.5215203     4.440971 20.68939 7.375312 13.76339 6.217408 6.926001       9.646315 
1 1 1 -9  42 4  o 37.63918 4.339519 19.00689       3.907541 23.80204       5.837096 15.11297       5.260039 40.48490 6.106284 31.23860 7.074599 9.246294       9.345408 
1 1 1 -9  42 5  o 19.80473 6.191744 5.825087       3.317258 2.305634       4.506199 9.988741       4.901286 16.05707 6.761479 24.86999 7.480701 -8.812923      10.08358 
1 1 1 -9  42 6  o 25.23171 6.342854 9.590073       3.895205 7.334568       6.183616 11.07382       5.015346 21.42528 8.302406 26.17459 7.486059 -4.749310      11.17904 
1 1 1 -9  42 7  o 20.49804 6.627390 6.404873       3.774001 4.526549       6.397910 7.407232       4.673739 19.09817 8.050178 21.58849 7.386272 -2.490322      10.92531 
1 1 1 -9  42 8  o 32.61835 5.713087 15.32946       4.375783 16.14881       8.583398 15.04174       5.086373 28.34675 9.991762 31.24092 6.868556 -2.894163      12.12487 
1 1 1 -9  42 9  o 14.04363 6.125519 0.7941739      3.947618 -0.5164081     7.019428 1.400422       4.774137 16.37177 7.553505 15.46237 6.740464 0.9094009      10.12370 
1 1 1 -9  42 10 o 15.49962 6.457276 2.306947       4.043505 1.053343       7.267555 2.868992       4.866242 17.30946 7.872501 16.70885 7.030621 0.6006126      10.55490 
1 1 1 -9  42 11 o 30.27458 6.366708 13.85535       4.547891 30.23266       9.469282 8.944983       5.185050 40.13428 9.774242 23.04611 7.781320 17.08817       12.49339 
1 1 1 -9  42 12 o 14.93056 6.694854 0.4337081      5.042325 -3.297885      7.493149 3.521893       6.816616 15.41936 7.328756 18.31933 8.018611 -2.899967      10.86318 
1 1 1 -9  42 13 o 15.68675 6.430392 2.712288       3.922834 3.093248       7.756221 2.581344       4.547315 18.47448 8.292092 16.07226 6.781394 2.402212       10.71196 
1 1 1 -9  42 14 o 15.89896 6.602408 2.752597       4.207893 2.778846       7.458221 2.740340       5.096515 18.04280 8.112085 16.55564 7.088865 1.487162       10.77302 
1 1 1 -9  42 15 o 24.53299 6.939207 9.795341       4.333234 8.773274       8.486922 10.15573       5.039631 21.72798 9.220455 24.27940 7.637620 -2.551418      11.97289 
1 1 1 -9  42 16 o 26.19652 6.863191 11.10301       4.433008 15.28311       8.707860 9.640696       5.150358 26.20661 9.927607 23.44596 7.752195 2.760653       12.59579 
1 1 1 -9  43 1  o 15.55625 6.108406 2.994692       3.383136 2.351577       5.112287 3.495775       4.512589 16.30416 7.041775 16.86547 6.903299 -0.5613098     9.861143 
1 1 1 -9  43 2  o 13.96458 5.863766 1.586304       3.374055 0.9008003      4.938603 2.186351       4.620531 15.09101 6.705400 15.78110 6.753300 -0.6900902     9.516799 
1 1 1 -9  43 3  o 16.39918 6.298344 3.584176       3.535859 2.047471       5.009137 5.110279       4.991828 16.00913 6.942273 18.68764 7.394565 -2.678501      10.14272 
1 1 1 -9  43 4  o 14.97434 6.216923 2.189168       3.729596 -4.112571      4.711109 12.76974       6.104463 11.92569 5.707549 26.63792 8.409392 -14.71223      10.16337 
1 1 1 -9  43 5  o 16.27925 6.637785 3.123825       4.152477 6.516513       6.296420 0.5124161      5.524069 20.23838 8.202635 15.40916 6.950006 4.829216       10.75108 
1 1 1 -9  43 6  o 9.005322 4.425490 -5.713334      3.371464 -3.469353      4.452087 -8.730350      5.162296 11.85305 5.638094 10.80228 5.340195 1.050766       7.765680 
1 1 1 -9  43 7  o 11.81746 5.420557 -1.154911      3.542049 0.3245804      4.502394 -3.557604      5.737681 14.19242 6.347855 13.46877 6.404910 0.7236500      9.017656 
1 1 1 -9  43 8  f 20.37202 7.418790 6.767326       4.773624 6.885283       7.630099 6.691462       6.119094 20.59563 8.741393 20.26813 8.131538 0.3274956      11.93876 
1 1 1 -9  43 9  o 36.10184 6.451219 19.92330       5.467230 15.51258       8.651557 22.85575       7.054303 26.74095 9.944342 36.55574 8.129082 -9.814783      12.84414 
1 1 1 -9  43 10 o 17.52443 7.739752 2.941949       6.482937 0.1995033      8.066850 7.943375       10.89386 17.07060 7.951954 21.43040 9.703784 -4.359793      12.54580 
1 1 1 -9  43 11 o 58.30693 5.171543 48.20349       7.271987 59.04675       12.47599 42.62385       8.949486 56.58101 9.376424 51.40242 7.353903 5.178581       11.91626 
1 1 1 -8  0  1  o 897.3660 25.89797 9932.862       565.2646 9932.862       565.2646 9932.862       565.2646 897.3660 25.89797 897.3660 25.89797 0.000000       0.000000 
1 1 1 -8  0  2  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -8  0  3  o 504.0116 10.38209 3104.040       127.3929 3104.040       127.3929 3104.040       127.3929 504.0116 10.38209 504.0116 10.38209 0.000000       0.000000 
1 1 1 -8  0  4  o 364.7029 7.694285 1624.184       68.31359 1624.184       68.31359 1624.184       68.31359 364.7029 7.694285 364.7029 7.694285 0.000000       0.000000 
1 1 1 -8  0  5  f 1260.073 25.53293 19547.63       783.3036 19547.63       783.3036 19547.63       783.3036 1260.073 25.53293 1260.073 25.53293 0.000000       0.000000 
1 1 1 -8  0  6  o 643.4483 13.11617 5062.717       205.4705 5062.717       205.4705 5062.717       205.4705 643.4483 13.11617 643.4483 13.11617 0.000000       0.000000 
1 1 1 -8  0  7  o 21.02873 6.584476 6.761036       2.960211 6.761036       2.960211 6.761036       2.960211 21.02873 6.584476 21.02873 6.584476 0.000000       0.000000 
1 1 1 -8  0  8  o 632.0804 12.89288 4883.427       198.4040 4883.427       198.4040 4883.427       198.4040 632.0804 12.89288 632.0804 12.89288 0.000000       0.000000 
1 1 1 -8  0  9  o 161.7214 4.080107 319.3338       16.05647 319.3338       16.05647 319.3338       16.05647 161.7214 4.080107 161.7214 4.080107 0.000000       0.000000 
1 1 1 -8  0  10 o 88.93873 3.188907 96.76068       6.891263 96.76068       6.891263 96.76068       6.891263 88.93873 3.188907 88.93873 3.188907 0.000000       0.000000 
1 1 1 -8  0  11 o 56.96204 3.158140 39.90135       4.352793 39.90135       4.352793 39.90135       4.352793 56.96204 3.158140 56.96204 3.158140 0.000000       0.000000 
1 1 1 -8  0  12 o 118.3682 3.541886 171.1918       10.19587 171.1918       10.19587 171.1918       10.19587 118.3682 3.541886 118.3682 3.541886 0.000000       0.000000 
1 1 1 -8  0  13 o 577.6581 11.82742 4075.220       166.3359 4075.220       166.3359 4075.220       166.3359 577.6581 11.82742 577.6581 11.82742 0.000000       0.000000 
1 1 1 -8  0  14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -8  0  15 o 127.1093 5.216566 197.8963       16.09639 197.8963       16.09639 197.8963       16.09639 127.1093 5.216566 127.1093 5.216566 0.000000       0.000000 
1 1 1 -8  0  16 o 85.60434 4.796646 90.14410       9.933827 90.14410       9.933827 90.14410       9.933827 85.60434 4.796646 85.60434 4.796646 0.000000       0.000000 
1 1 1 -8  0  17 o 56.54198 3.942174 39.52413       5.370074 39.52413       5.370074 39.52413       5.370074 56.54198 3.942174 56.54198 3.942174 0.000000       0.000000 
1 1 1 -8  0  18 o 52.99827 4.123623 34.84699       5.249519 34.84699       5.249519 34.84699       5.249519 52.99827 4.123623 52.99827 4.123623 -0.000000      0.000000 
1 1 1 -8  0  19 o 451.7484 9.424503 2492.235       103.6488 2492.235       103.6488 2492.235       103.6488 451.7484 9.424503 451.7484 9.424503 0.000000       0.000000 
1 1 1 -8  0  20 o 115.1476 3.863178 162.1287       10.81248 162.1287       10.81248 162.1287       10.81248 115.1476 3.863178 115.1476 3.863178 0.000000       0.000000 
1 1 1 -8  0  21 o 433.2877 12.94004 2299.402       136.3546 2299.402       136.3546 2299.402       136.3546 433.2877 12.94004 433.2877 12.94004 -0.000000      0.000000 
1 1 1 -8  0  22 o 184.7299 4.703811 416.7782       21.14397 416.7782       21.14397 416.7782       21.14397 184.7299 4.703811 184.7299 4.703811 -0.000000      0.000000 
1 1 1 -8  0  23 o 12.66539 7.605725 1.957358       4.222365 1.957358       4.222365 1.957358       4.222365 12.66539 7.605725 12.66539 7.605725 0.000000       0.000000 
1 1 1 -8  0  24 o 72.86279 4.057012 65.31793       7.152138 65.31793       7.152138 65.31793       7.152138 72.86279 4.057012 72.86279 4.057012 0.000000       0.000000 
1 1 1 -8  0  25 o 215.1439 5.213892 565.5350       27.29924 565.5350       27.29924 565.5350       27.29924 215.1439 5.213892 215.1439 5.213892 0.000000       0.000000 
1 1 1 -8  0  26 o 158.4333 4.415339 306.8230       17.01702 306.8230       17.01702 306.8230       17.01702 158.4333 4.415339 158.4333 4.415339 0.000000       0.000000 
1 1 1 -8  0  27 f 137.2023 4.200409 230.2248       14.01413 230.2248       14.01413 230.2248       14.01413 137.2023 4.200409 137.2023 4.200409 0.000000       0.000000 
1 1 1 -8  0  28 o 222.0565 7.472962 604.8638       40.33435 604.8638       40.33435 604.8638       40.33435 222.0565 7.472962 222.0565 7.472962 0.000000       0.000000 
1 1 1 -8  0  29 f 258.8413 5.997740 819.6473       37.78596 819.6473       37.78596 819.6473       37.78596 258.8413 5.997740 258.8413 5.997740 0.000000       0.000000 
1 1 1 -8  0  30 o 140.2844 4.335745 240.8221       14.79001 240.8221       14.79001 240.8221       14.79001 140.2844 4.335745 140.2844 4.335745 0.000000       0.000000 
1 1 1 -8  0  31 o 94.33792 4.098157 109.2080       9.380749 109.2080       9.380749 109.2080       9.380749 94.33792 4.098157 94.33792 4.098157 0.000000       0.000000 
1 1 1 -8  0  32 o 78.28130 6.806335 76.67512       12.74861 76.67512       12.74861 76.67512       12.74861 78.28130 6.806335 78.28130 6.806335 0.000000       0.000000 
1 1 1 -8  0  33 o 114.0816 4.259360 159.5559       11.80369 159.5559       11.80369 159.5559       11.80369 114.0816 4.259360 114.0816 4.259360 0.000000       0.000000 
1 1 1 -8  0  34 o 44.07013 6.225877 25.14229       6.302315 25.14229       6.302315 25.14229       6.302315 44.07013 6.225877 44.07013 6.225877 0.000000       0.000000 
1 1 1 -8  0  35 o 208.8394 5.357337 534.6041       27.22396 534.6041       27.22396 534.6041       27.22396 208.8394 5.357337 208.8394 5.357337 0.000000       0.000000 
1 1 1 -8  0  36 o 9.056957 6.337142 -5.266582      5.206053 -5.266582      5.206053 -5.266582      5.206053 9.056957 6.337142 9.056957 6.337142 0.000000       0.000000 
1 1 1 -8  0  37 o 33.94743 8.412313 16.51481       6.023036 16.51481       6.023036 16.51481       6.023036 33.94743 8.412313 33.94743 8.412313 0.000000       0.000000 
1 1 1 -8  0  38 f 69.56015 6.214794 60.85208       10.33217 60.85208       10.33217 60.85208       10.33217 69.56015 6.214794 69.56015 6.214794 0.000000       0.000000 
1 1 1 -8  0  39 o 21.65035 10.00147 8.521267       5.810665 8.521267       5.810665 8.521267       5.810665 21.65035 10.00147 21.65035 10.00147 -0.000000      0.000000 
1 1 1 -8  0  40 o 62.39760 5.048088 48.78008       7.556670 48.78008       7.556670 48.78008       7.556670 62.39760 5.048088 62.39760 5.048088 -0.000000      0.000000 
1 1 1 -8  0  41 o 29.43392 9.085258 13.48400       5.701957 13.48400       5.701957 13.48400       5.701957 29.43392 9.085258 29.43392 9.085258 0.000000       0.000000 
1 1 1 -8  0  42 o 15.90037 10.27828 0.7354022      9.327281 0.7354022      9.327281 0.7354022      9.327281 15.90037 10.27828 15.90037 10.27828 0.000000       0.000000 
1 1 1 -8  0  43 f 20.96099 9.873060 8.366803       5.681022 8.366803       5.681022 8.366803       5.681022 20.96099 9.873060 20.96099 9.873060 0.000000       0.000000 
1 1 1 -8  0  44 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -8  0  45 o 15.95754 10.16190 2.856784       8.696852 2.856784       8.696852 2.856784       8.696852 15.95754 10.16190 15.95754 10.16190 0.000000       0.000000 
1 1 1 -8  0  46 o 10.54359 7.080738 -1.154371      5.139707 -1.154371      5.139707 -1.154371      5.139707 10.54359 7.080738 10.54359 7.080738 0.000000       0.000000 
1 1 1 -8  0  47 o 19.98570 9.935676 8.784039       5.856313 8.784039       5.856313 8.784039       5.856313 19.98570 9.935676 19.98570 9.935676 0.000000       0.000000 
1 1 1 -8  0  48 o 6.803908 4.969757 -10.74410      5.017965 -10.74410      5.017965 -10.74410      5.017965 6.803908 4.969757 6.803908 4.969757 0.000000       0.000000 
1 1 1 -8  0  49 o 10.89134 7.323276 -0.2403552     5.529187 -0.2403552     5.529187 -0.2403552     5.529187 10.89134 7.323276 10.89134 7.323276 0.000000       0.000000 
1 1 1 -8  0  50 o 7.869490 5.650157 -6.452726      5.184955 -6.452726      5.184955 -6.452726      5.184955 7.869490 5.650157 7.869490 5.650157 0.000000       0.000000 
1 1 1 -8  0  51 f 10.46370 7.414564 -4.196602      7.869971 -4.196602      7.869971 -4.196602      7.869971 10.46370 7.414564 10.46370 7.414564 0.000000       0.000000 
1 1 1 -8  1  1  o 385.6487 5.718748 1813.866       53.74387 1833.172       76.53772 1795.089       75.48387 387.5088 8.105090 383.4650 8.077785 4.043793       11.44304 
1 1 1 -8  1  2  o 538.9309 9.021987 3547.412       118.4872 3511.890       144.1657 3621.354       207.9971 535.9074 11.03916 542.9721 15.73628 -7.064697      19.22222 
1 1 1 -8  1  3  o 650.1459 9.353120 5163.435       148.1847 5139.715       208.8301 5187.492       210.3074 647.8236 13.22819 650.8196 13.26044 -2.995972      18.73030 
1 1 1 -8  1  4  o 1095.268 15.65396 14719.73       417.8118 14835.34       594.4529 14606.86       587.3613 1095.643 22.26447 1087.239 22.16891 8.404541       31.41921 
1 1 1 -8  1  5  o 284.8171 4.373417 988.9421       30.35451 971.3883       42.49351 1007.232       43.37560 282.2029 6.179097 287.3615 6.194136 -5.158661      8.749203 
1 1 1 -8  1  6  o 935.6517 15.46005 10735.35       352.5018 10883.47       616.0138 10663.23       429.8315 935.5834 27.04755 931.0139 18.94550 4.569519       33.02275 
1 1 1 -8  1  7  o 122.1704 2.867796 181.8977       8.537889 186.2289       10.62432 174.0009       14.34588 123.5594 3.532117 119.3628 4.942681 4.196541       6.075027 
1 1 1 -8  1  8  o 232.0670 3.705087 656.4013       20.95308 647.5001       29.44487 665.5327       29.82299 230.4518 5.243166 233.6388 5.238055 -3.187088      7.411343 
1 1 1 -8  1  9  o 734.7448 12.16686 6598.068       217.8468 6684.193       269.2236 6434.735       370.7535 738.9453 14.95081 723.0787 21.06331 15.86658       25.83002 
1 1 1 -8  1  10 o 184.3069 3.140623 413.9710       14.10567 408.6732       19.85779 419.3667       20.04032 183.1067 4.450313 185.4871 4.433582 -2.380402      6.281873 
1 1 1 -8  1  11 o 346.2155 5.191020 1461.165       43.79609 1454.297       61.76610 1468.110       62.10939 345.3214 7.339907 346.9572 7.345904 -1.635803      10.38444 
1 1 1 -8  1  12 o 303.1360 4.633316 1120.026       34.22673 1047.728       46.43711 1206.017       50.64384 293.1408 6.500589 314.5025 6.607947 -21.36163      9.269445 
1 1 1 -8  1  13 o 270.2026 4.212602 889.8186       27.73806 894.4276       39.43724 885.3064       39.02115 270.8649 5.974723 269.4810 5.942043 1.383850       8.426457 
1 1 1 -8  1  14 o 209.5691 3.478475 535.2300       17.76447 525.6892       24.90391 545.1138       25.34748 207.6738 4.920959 211.4759 4.918560 -3.802063      6.957591 
1 1 1 -8  1  15 o 435.1751 9.042439 2310.430       95.89274 2202.039       131.2909 2434.369       140.3917 424.3900 12.70934 446.2103 12.92480 -21.82025      18.12671 
1 1 1 -8  1  16 o 416.0961 7.098380 2111.343       71.97620 2297.729       131.6233 2031.833       85.96837 433.5155 12.47222 408.1032 8.644356 25.41232       15.17502 
1 1 1 -8  1  17 o 143.6877 3.255206 251.6102       11.39815 245.7029       19.11377 254.8702       14.19908 141.8574 5.539800 144.5520 4.034831 -2.694580      6.853411 
1 1 1 -8  1  18 o 577.7499 8.369791 4072.707       117.8394 4023.376       165.3008 4123.682       168.0330 573.8481 11.82067 580.9508 11.86914 -7.102661      16.75126 
1 1 1 -8  1  19 o 63.42826 2.730280 49.11869       4.210250 46.18884       5.840740 52.28779       6.074525 61.43409 3.921896 65.38590 3.829103 -3.951809      5.481177 
1 1 1 -8  1  20 o 306.4910 4.736697 1145.223       35.37769 1224.196       52.14564 1077.874       48.15546 316.7887 6.754796 297.2598 6.647728 19.52890       9.477318 
1 1 1 -8  1  21 o 185.5920 4.774118 420.2560       21.57385 418.4273       30.63004 422.0563       30.39143 185.0580 6.803676 185.8660 6.720952 -0.8079987     9.563535 
1 1 1 -8  1  22 o 199.7415 3.467674 486.3418       16.87885 476.0805       23.63681 497.0188       24.11083 197.5777 4.909246 201.8761 4.901073 -4.298355      6.936946 
1 1 1 -8  1  23 o 72.42077 2.782321 64.02262       4.901148 55.96379       6.754494 72.98401       7.122693 67.61949 4.118598 77.27504 3.794011 -9.655548      5.599765 
1 1 1 -8  1  24 o 117.8834 2.789694 169.3999       8.013929 164.0284       11.21690 175.0006       11.45363 115.9036 3.977257 119.7246 3.931087 -3.821022      5.592139 
1 1 1 -8  1  25 o 51.81102 3.178380 32.85498       3.993639 34.44188       5.745110 31.37116       5.555385 52.93760 4.495955 50.49775 4.563669 2.439846       6.406301 
1 1 1 -8  1  26 o 200.4558 3.526386 490.1527       17.22600 493.1591       24.45733 487.1931       24.26629 200.9561 4.994268 199.7376 4.985484 1.218445       7.056753 
1 1 1 -8  1  27 o 82.97192 2.813182 84.04906       5.679846 83.69624       8.065719 84.39613       7.999718 82.71208 4.013621 83.06214 3.963605 -0.3500595     5.640862 
1 1 1 -8  1  28 o 300.6943 6.629859 1107.560       48.58091 1096.319       68.20020 1119.139       69.21867 298.2247 9.396111 301.2995 9.438974 -3.074829      13.31845 
1 1 1 -8  1  29 o 94.07628 2.855511 108.0554       6.538785 111.4739       9.361496 104.7988       9.137065 95.45946 4.033388 92.54943 4.061211 2.910027       5.723780 
1 1 1 -8  1  30 o 38.90179 4.071403 18.68757       3.802570 22.13984       5.497457 15.52066       5.265343 42.18026 5.477553 35.04138 6.401913 7.138878       8.425443 
1 1 1 -8  1  31 o 160.8504 3.226963 315.8220       12.64888 300.6864       17.50642 332.3539       18.29614 156.7366 4.588373 164.7946 4.560349 -8.058090      6.469154 
1 1 1 -8  1  32 o 113.8965 3.484379 158.5888       9.659634 156.6594       11.60155 162.9493       17.44084 113.1134 4.216254 115.0351 6.245002 -1.921677      7.535042 
1 1 1 -8  1  33 o 124.5380 3.046156 189.3683       9.244643 183.8147       13.08227 194.9077       13.06554 122.4847 4.390039 126.1516 4.256188 -3.666969      6.114538 
1 1 1 -8  1  34 o 17.29243 6.559849 2.620032       3.805143 5.225241       5.387173 0.2618228E-01  5.375414 22.15800 7.905380 17.17262 7.314551 4.985380       10.77022 
1 1 1 -8  1  35 o 15.25110 6.341337 0.6699364      3.888644 -2.068499      5.442614 3.525661       5.557947 15.74883 7.015929 20.52623 7.893146 -4.777401      10.56054 
1 1 1 -8  1  36 o 53.81763 3.933168 35.65418       5.122643 31.65214       7.294554 39.54825       7.195485 50.31615 6.071769 56.47485 5.289970 -6.158699      8.052960 
1 1 1 -8  1  37 o 18.63181 6.736273 3.599823       3.926211 8.328506       5.551694 -1.131611      5.553309 25.84280 7.999087 16.53307 7.237117 9.309738       10.78709 
1 1 1 -8  1  38 o 73.59858 3.703589 66.57645       6.621105 62.98382       10.62239 68.85914       8.467208 71.02345 6.199476 74.66325 4.677184 -3.639793      7.765922 
1 1 1 -8  1  39 o 35.37320 6.389925 16.03940       5.305492 14.43328       7.760940 17.44851       7.269361 33.12623 9.257463 36.45380 8.361340 -3.327564      12.47448 
1 1 1 -8  1  40 o 36.26640 5.030355 16.60593       4.326149 13.84568       6.044549 19.50473       6.194400 32.40550 7.757522 38.86668 6.786943 -6.461178      10.30736 
1 1 1 -8  1  41 o 20.50144 6.715749 5.186384       3.868606 2.302531       5.508299 7.993496       5.434516 18.92725 7.671796 24.96012 7.941284 -6.032871      11.04176 
1 1 1 -8  1  42 o 27.68163 6.967053 10.24868       4.695553 7.622766       5.394038 18.46401       9.540818 24.29297 7.928310 36.06582 10.32838 -11.77285      13.02050 
1 1 1 -8  1  43 o 37.94146 4.766327 18.42480       4.309903 11.17802       5.974102 26.29005       6.223809 28.37049 8.187971 44.94204 5.819356 -16.57154      10.04529 
1 1 1 -8  1  44 o 30.43699 6.645254 12.71482       4.790352 7.360367       8.518270 15.19138       5.793208 24.71756 9.696587 32.94339 7.397785 -8.225834      12.19635 
1 1 1 -8  1  45 o 12.61810 5.692412 -1.236855      3.708171 -3.262874      5.140773 0.9607331      5.354017 13.69043 6.367460 16.72100 7.213992 -3.030569      9.622174 
1 1 1 -8  1  46 o 27.49426 7.077910 11.23601       4.770283 14.74770       5.776984 3.710012       8.457170 31.14264 7.664843 20.70762 8.999825 10.43502       11.82145 
1 1 1 -8  1  47 o 16.15524 6.679254 2.544972       4.280089 -0.8358892     6.319808 5.409554       5.817291 15.80217 7.245404 19.77986 7.930932 -3.977690      10.74223 
1 1 1 -8  1  48 o 16.64310 6.787124 3.343225       4.342185 4.472568       5.404257 1.286185       7.293642 18.26651 7.524076 17.26657 7.866043 0.9999447      10.88514 
1 1 1 -8  1  49 o 16.25533 6.528925 3.620588       3.949459 7.978846       5.578154 -0.7603250     5.592632 20.84902 7.934587 14.31006 6.650809 6.538966       10.35331 
1 1 1 -8  1  50 o 10.56991 5.070668 -3.100766      3.767248 -10.15742      5.364026 3.767881       5.292088 10.23754 5.122276 16.37904 7.118906 -6.141500      8.770206 
1 1 1 -8  1  51 o 12.19476 5.934949 -3.893192      5.642140 1.587021       8.311483 -8.576942      7.683812 15.74595 7.547920 12.54585 6.254493 3.200103       9.802540 
1 1 1 -8  2  1  o 95.03936 2.352587 110.0733       5.448606 100.9413       11.21056 112.8976       6.234493 90.84344 5.084331 96.21198 2.661665 -5.368538      5.738892 
1 1 1 -8  2  2  o 266.2555 4.147199 864.2076       26.90850 869.7195       38.25416 858.8094       37.85769 267.0366 5.878572 265.3575 5.854458 1.679108       8.296523 
1 1 1 -8  2  3  o 448.2062 7.583581 2451.750       82.83012 2393.714       99.82779 2579.997       148.3973 442.6918 9.253666 458.8105 13.28661 -16.11862      16.19149 
1 1 1 -8  2  4  f 180.7850 3.094651 398.3344       13.63359 402.3360       19.42784 394.4517       19.13705 181.6660 4.388486 179.8777 4.365777 1.788300       6.190219 
1 1 1 -8  2  5  o 387.9825 6.623554 1836.334       62.62379 1802.802       107.1151 1853.748       77.19013 383.7950 11.46575 389.6994 8.128229 -5.904419      14.05459 
1 1 1 -8  2  6  o 76.23686 2.441314 70.90033       4.529647 74.25192       7.969969 69.30120       5.505200 77.93243 4.212301 75.34800 3.004255 2.584435       5.173879 
1 1 1 -8  2  7  o 609.1138 10.14193 4531.913       150.5412 4472.079       182.7257 4658.334       265.6044 604.7084 12.39988 615.7369 17.71968 -11.02844      21.62739 
1 1 1 -8  2  8  o 256.2081 4.635890 800.2025       28.94423 800.5630       35.50821 799.4885       49.96753 256.2349 5.686623 255.8463 8.024351 0.3885651      9.835033 
1 1 1 -8  2  9  o 457.4055 6.689497 2551.538       74.56429 2391.271       101.0349 2743.237       110.4991 442.6148 9.367194 474.0529 9.565244 -31.43802      13.38799 
1 1 1 -8  2  10 o 56.68024 2.199075 39.20676       3.031678 35.12876       4.305589 43.21672       4.269519 53.58666 3.313364 59.47755 2.954961 -5.890896      4.439615 
1 1 1 -8  2  11 o 647.7831 9.321424 5120.323       147.1458 4800.855       199.0767 5505.040       218.4630 626.8141 13.03303 671.1641 13.35713 -44.34998      18.66207 
1 1 1 -8  2  12 o 455.1677 6.663404 2526.101       73.91010 2544.397       105.1010 2508.200       103.9577 456.6532 9.444615 453.3958 9.408990 3.257446       13.33154 
1 1 1 -8  2  13 o 90.27567 2.375390 99.37678       5.221127 100.3406       7.436223 98.43967       7.332447 90.67725 3.371124 89.81366 3.356101 0.8635941      4.756878 
1 1 1 -8  2  14 o 284.2791 4.403032 984.9718       30.50232 954.7833       42.41637 1017.302       43.89521 279.8477 6.219789 288.8642 6.235732 -9.016479      8.807390 
1 1 1 -8  2  15 o 39.38987 3.446196 19.05313       3.274679 17.56504       4.011685 22.02468       5.668977 37.70081 4.452363 42.12777 5.665538 -4.426964      7.205682 
1 1 1 -8  2  16 o 319.4385 5.614089 1243.974       43.70213 1342.196       79.10009 1200.818       52.43090 331.4857 9.802875 313.8078 6.856264 17.67795       11.96264 
1 1 1 -8  2  17 o 472.6141 6.921112 2723.938       79.71107 2750.514       113.5367 2698.106       111.9372 474.7053 9.814683 470.1648 9.769859 4.540497       13.84840 
1 1 1 -8  2  18 o 458.4040 6.737817 2562.684       75.26685 2500.245       104.7805 2629.250       108.1881 452.5834 9.500481 464.1068 9.565893 -11.52341      13.48204 
1 1 1 -8  2  19 f 363.0337 5.465949 1606.907       48.35580 1591.249       67.98203 1622.943       68.79610 361.1400 7.724714 364.7179 7.740530 -3.577881      10.93558 
1 1 1 -8  2  20 o 272.5764 4.311999 905.7155       28.64198 924.1641       41.04021 888.1974       39.99189 275.2714 6.118041 269.8633 6.081238 5.408081       8.626232 
1 1 1 -8  2  21 o 389.8760 8.291336 1856.044       78.77477 1873.600       112.4263 1839.113       110.4098 391.1101 11.80947 387.5083 11.70547 3.601776       16.62774 
1 1 1 -8  2  22 o 230.5495 3.822171 648.0095       21.47387 651.9733       30.52830 644.1274       30.21146 231.1872 5.418796 229.7931 5.395090 1.394119       7.646590 
1 1 1 -8  2  23 o 138.3352 2.894680 233.2651       9.758195 228.2437       13.70855 238.4230       13.89366 136.7477 4.118421 139.7684 4.083544 -3.020782      5.799717 
1 1 1 -8  2  24 o 191.8206 3.414606 448.6463       15.96144 437.6589       22.30597 460.1758       22.84962 189.3282 4.838667 194.2012 4.828264 -4.872925      6.835557 
1 1 1 -8  2  25 o 349.1713 5.332456 1488.708       45.37346 1489.931       64.22810 1487.489       64.10760 348.9408 7.553309 348.6563 7.545290 0.2844543      10.67632 
1 1 1 -8  2  26 o 284.9652 4.521821 991.2974       31.40084 965.5022       43.73037 1018.755       45.11710 280.9715 6.386821 288.6113 6.414927 -7.639771      9.052225 
1 1 1 -8  2  27 o 185.2305 3.395659 418.5729       15.32755 414.1140       21.61408 423.0837       21.73931 184.0623 4.822922 186.0493 4.798929 -1.986984      6.803698 
1 1 1 -8  2  28 o 164.8322 4.393694 332.0624       17.63277 325.8574       24.45196 338.7848       25.45104 163.0418 6.165410 166.2279 6.294348 -3.186172      8.810850 
1 1 1 -8  2  29 o 44.71806 3.617756 24.56778       3.908745 19.94436       5.450751 29.46219       5.608213 39.96276 5.763495 48.86713 4.770129 -8.904369      7.481444 
1 1 1 -8  2  30 o 100.1806 2.874058 122.5442       7.009162 121.1052       9.814830 124.0418       10.01305 99.48548 4.056944 100.6830 4.089581 -1.197502      5.760509 
1 1 1 -8  2  31 o 242.1808 4.063444 716.7189       23.98116 731.4891       34.33344 702.6482       33.51049 244.3040 5.767009 239.4452 5.742995 4.858795       8.138820 
1 1 1 -8  2  32 o 66.89325 3.725676 54.84072       6.049288 48.29129       7.063275 72.86642       11.71791 62.64890 4.659914 76.77394 6.319150 -14.12504      7.851526 
1 1 1 -8  2  33 o 88.35202 3.573323 95.53983       7.677644 93.74032       14.09654 96.29877       9.154599 87.02568 6.698561 88.62092 4.251435 -1.595238      7.933815 
1 1 1 -8  2  34 o 107.4309 3.036241 141.0623       7.940830 140.9464       11.23398 141.1781       11.22608 107.2189 4.308356 107.3082 4.301700 -0.8927155E-01 6.088231 
1 1 1 -8  2  35 o 53.97063 3.789960 35.80930       4.952889 32.63911       6.824852 39.33662       7.199001 51.24071 5.554372 56.35142 5.304819 -5.110710      7.680635 
1 1 1 -8  2  36 o 106.0103 3.076424 137.4712       7.939089 137.4362       11.20081 137.5065       11.25452 105.7889 4.354142 105.8121 4.374141 -0.2326202E-01 6.171844 
1 1 1 -8  2  37 o 96.48775 3.107964 113.9659       7.298228 119.4480       10.30897 108.4576       10.33358 98.57629 4.301835 93.87730 4.530415 4.698990       6.247435 
1 1 1 -8  2  38 o 121.8637 3.526623 182.1314       10.46195 189.0348       17.24986 178.1146       13.15824 123.4960 5.747637 120.2666 4.497615 3.229408       7.298211 
1 1 1 -8  2  39 o 29.00020 6.364412 10.87150       4.374033 9.608202       5.563668 12.91592       7.077719 27.28831 7.909527 31.41327 8.862720 -4.124964      11.87891 
1 1 1 -8  2  40 o 43.82825 4.874314 24.08166       5.118031 27.17811       8.387015 22.24443       6.460348 45.67644 7.815713 41.62233 6.588424 4.054104       10.22217 
1 1 1 -8  2  41 o 53.53939 3.823555 35.58046       4.955742 27.87538       6.849945 44.04253       7.178552 46.63754 6.179088 59.22386 5.021264 -12.58632      7.962049 
1 1 1 -8  2  42 o 50.20316 4.681829 31.78091       5.661694 30.80965       6.682765 34.25095       10.65709 49.03190 5.699022 49.99113 9.082453 -0.9592285     10.72240 
1 1 1 -8  2  43 o 75.67997 3.990333 71.75789       7.333121 55.61887       12.95259 79.37113       8.896163 63.52967 8.586093 79.23362 4.627555 -15.70395      9.753730 
1 1 1 -8  2  44 o 40.51033 4.511014 21.07545       4.377786 19.39041       6.092792 22.87384       6.294378 37.60798 6.902428 41.16787 6.488818 -3.559895      9.473557 
1 1 1 -8  2  45 o 41.37154 4.709854 22.36800       4.663929 19.58116       6.591508 25.16209       6.600083 36.78298 7.604977 42.64236 6.561468 -5.859379      10.04433 
1 1 1 -8  2  46 o 15.69004 6.390061 2.188483       3.842912 1.243493       5.262744 3.267925       5.624689 16.44830 7.124336 18.40000 7.636563 -1.951694      10.44382 
1 1 1 -8  2  47 o 21.54343 8.013549 7.302616       5.618815 10.78136       7.297010 2.235658       8.806584 24.66437 9.140146 19.24480 8.718389 5.419563       12.63141 
1 1 1 -8  2  48 o 11.56460 5.499965 -3.403386      4.233043 -1.866609      5.258291 -6.233212      7.135412 13.75261 6.410949 13.96716 6.768836 -0.2145567     9.322950 
1 1 1 -8  2  49 o 10.31187 4.940871 -3.332690      3.552773 -2.225674      4.942626 -4.516104      5.110331 12.85225 6.061933 12.01078 5.798242 0.8414669      8.388482 
1 1 1 -8  2  50 o 17.02278 6.608079 4.798036       3.922553 1.158696       5.657688 8.166645       5.443183 14.86489 6.830304 20.14771 7.794347 -5.282816      10.36363 
1 1 1 -8  2  51 o 21.77603 7.566628 9.916976       4.911528 9.870636       8.829584 9.937739       5.910315 19.11240 8.686577 20.67044 8.086404 -1.558035      11.86788 
1 1 1 -8  3  1  o 316.6380 4.826213 1222.393       37.23965 1147.349       71.91883 1249.885       43.52965 306.3197 9.646579 320.1442 5.579605 -13.82449      11.14399 
1 1 1 -8  3  2  o 146.5121 3.201063 261.6235       11.42889 248.2599       19.93213 268.1692       13.94987 142.5606 5.749232 148.2738 3.864027 -5.713165      6.927075 
1 1 1 -8  3  3  o 231.7932 4.267710 654.9762       24.10636 628.3140       40.59719 669.4969       29.96003 226.7955 7.355297 234.3184 5.246864 -7.522903      9.034931 
1 1 1 -8  3  4  o 418.5422 7.104824 2137.368       72.46507 2179.110       127.0215 2117.228       88.23201 421.8446 12.36966 416.4238 8.694698 5.420807       15.11973 
1 1 1 -8  3  5  o 241.1579 5.401640 709.1514       31.74412 717.5666       45.09380 700.8843       44.69479 242.3723 7.644358 239.5338 7.666792 2.838562       10.82663 
1 1 1 -8  3  6  o 450.6000 6.594427 2476.584       72.41096 2448.106       101.7416 2505.817       103.0807 447.7625 9.324266 453.0081 9.337600 -5.245636      13.19594 
1 1 1 -8  3  7  o 326.9610 4.933162 1303.289       39.30587 1320.480       56.15824 1286.781       55.03264 329.0168 7.004212 324.7940 6.953065 4.222809       9.869352 
1 1 1 -8  3  8  o 328.4041 5.725097 1314.998       45.81709 1326.442       56.51339 1293.050       78.26355 329.7717 7.032373 325.2789 9.884890 4.492798       12.13117 
1 1 1 -8  3  9  o 606.9076 8.746889 4494.625       129.3637 4448.986       181.7776 4541.459       184.1409 603.3738 12.36283 609.6075 12.39550 -6.233643      17.50679 
1 1 1 -8  3  10 o 272.3723 4.233852 904.2102       28.10183 852.6876       38.50551 962.9266       41.10579 264.4570 5.974916 281.0317 6.002215 -16.57477      8.469132 
1 1 1 -8  3  11 o 473.5607 6.914756 2734.604       79.79738 2650.544       110.6270 2825.780       115.2137 466.0473 9.740811 481.2003 9.825218 -15.15298      13.83540 
1 1 1 -8  3  12 o 309.5736 4.721625 1168.108       35.61980 1173.956       50.62916 1162.376       50.12265 310.2937 6.695634 308.7606 6.661561 1.533051       9.444994 
1 1 1 -8  3  13 o 247.5971 3.940592 747.1347       23.77624 734.2680       33.37206 760.3986       33.88312 245.4270 5.579877 249.7561 5.567128 -4.329132      7.882128 
1 1 1 -8  3  14 o 273.0580 4.264053 908.7344       28.37354 921.9097       40.54693 896.0921       39.71840 274.9915 6.050657 271.1147 6.011774 3.876862       8.529471 
1 1 1 -8  3  15 o 609.8342 12.44766 4542.630       184.9846 4524.614       260.7732 4560.879       262.4502 607.6150 17.63022 610.0386 17.67305 -2.423645      24.96320 
1 1 1 -8  3  16 o 289.7985 5.168565 1023.757       36.50079 1015.094       62.64987 1028.208       44.91034 288.3017 8.928131 290.3942 6.346325 -2.092468      10.95387 
1 1 1 -8  3  17 o 116.8369 2.642715 166.3498       7.524306 159.7416       10.53923 173.2195       10.74573 114.4225 3.784944 119.1600 3.705077 -4.737579      5.296546 
1 1 1 -8  3  18 o 123.7153 2.719484 186.5170       8.198720 178.3352       11.45190 195.1201       11.74306 120.8994 3.892097 126.4697 3.814657 -5.570328      5.449773 
1 1 1 -8  3  19 o 477.1536 6.996793 2777.225       81.35670 2861.279       117.4426 2699.672       112.8088 484.0417 9.956499 470.1854 9.845495 13.85629       14.00234 
1 1 1 -8  3  20 o 303.0004 4.700948 1119.306       34.71082 1061.624       47.58956 1184.874       50.73864 295.0043 6.619835 311.6552 6.680798 -16.65091      9.405066 
1 1 1 -8  3  21 o 327.8168 7.146552 1311.544       57.09051 1350.267       82.65897 1276.223       78.94535 332.1798 10.22346 322.9594 10.04317 9.220398       14.33124 
1 1 1 -8  3  22 o 228.4671 3.800460 636.3646       21.15904 642.3474       30.12870 630.5421       29.72224 229.4711 5.387858 227.3539 5.364670 2.117294       7.603204 
1 1 1 -8  3  23 o 151.1467 3.002699 278.4846       11.05978 281.4604       15.72601 275.5723       15.55714 151.8579 4.253761 150.2598 4.252925 1.598038       6.015136 
1 1 1 -8  3  24 o 266.6606 4.275051 867.3995       27.78025 914.0620       40.57896 826.2394       38.11146 273.5791 6.086700 260.1118 6.012558 13.46722       8.555629 
1 1 1 -8  3  25 o 254.2546 4.138487 788.7111       25.64168 816.9315       37.06999 762.8214       35.50618 258.5891 5.882692 249.8843 5.830809 8.704788       8.282778 
1 1 1 -8  3  26 o 391.9071 5.908504 1877.554       56.42828 1844.567       78.96778 1911.973       80.66248 387.8167 8.355786 394.8305 8.383488 -7.013824      11.83647 
1 1 1 -8  3  27 o 42.13859 4.097096 21.87886       4.154141 26.10534       6.528965 19.00404       5.384694 45.81274 5.991648 38.99377 5.846714 6.818974       8.371613 
1 1 1 -8  3  28 o 212.7888 4.264405 552.9422       22.11278 572.0134       27.69944 519.4319       36.71725 216.3014 5.255034 205.6598 7.338061 10.64160       9.025659 
1 1 1 -8  3  29 o 44.18675 3.629646 23.99299       3.873917 22.12803       5.286968 26.15510       5.692585 42.21370 5.252763 45.95954 5.172442 -3.745842      7.371952 
1 1 1 -8  3  30 o 135.2894 3.012691 223.3372       9.932404 230.0975       14.20176 216.8646       13.89630 137.1579 4.254129 133.1475 4.288417 4.010391       6.040541 
1 1 1 -8  3  31 o 71.10010 3.059318 61.81173       5.288269 56.24359       7.273097 68.05739       7.702877 67.67887 4.434340 74.49550 4.260906 -6.816628      6.149690 
1 1 1 -8  3  32 o 157.3578 3.749868 302.5615       14.37939 285.2319       16.97671 346.5585       27.05021 152.6128 4.569998 167.7798 6.629038 -15.16699      8.051647 
1 1 1 -8  3  33 o 91.96584 3.525914 103.4939       7.887313 103.4746       14.98644 103.5012       9.275908 91.43640 6.773897 91.89339 4.152980 -0.4569931     7.945622 
1 1 1 -8  3  34 o 64.93584 3.310225 51.65274       5.220869 54.45100       7.152594 48.46167       7.638149 66.53880 4.436501 62.66606 5.044307 3.872746       6.717706 
1 1 1 -8  3  35 o 54.93574 3.687464 37.07935       4.907906 34.15184       6.705643 40.45689       7.202628 52.46810 5.317923 57.16621 5.228114 -4.698109      7.457445 
1 1 1 -8  3  36 o 55.02328 3.695680 37.22153       4.926642 27.84457       6.624648 48.82516       7.369346 47.18030 5.889835 62.87453 4.847094 -15.69423      7.627875 
1 1 1 -8  3  37 o 113.8556 3.106228 158.6476       8.610294 158.7853       12.02642 158.5028       12.33296 113.6651 4.349862 113.5373 4.466223 0.1277237      6.234457 
1 1 1 -8  3  38 o 76.33432 3.629499 71.59256       6.732197 67.39628       10.52814 74.49532       8.756368 73.54662 5.924343 77.66653 4.647776 -4.119919      7.529918 
1 1 1 -8  3  39 o 74.79639 3.642033 68.84384       6.618401 71.08665       8.334356 65.01498       10.88959 75.80548 4.532345 71.98519 6.270228 3.820290       7.736789 
1 1 1 -8  3  40 o 43.66488 4.240492 23.74928       4.455410 26.16908       6.373503 21.43669       6.230725 45.41812 5.897687 40.86836 6.471586 4.549755       8.755806 
1 1 1 -8  3  41 o 29.19675 6.279779 11.15977       4.335267 7.829007       6.771391 13.47340       5.643550 25.38877 8.880468 31.83075 7.414110 -6.441973      11.56857 
1 1 1 -8  3  42 f 31.38412 8.663005 13.56345       6.842293 0.8232178      9.775261 25.80132       9.580602 22.35827 9.696783 43.03213 9.399836 -20.67386      13.50498 
1 1 1 -8  3  43 o 56.01647 4.534514 39.75011       6.137012 36.68999       11.92686 40.85209       7.157217 50.27729 10.08576 56.42412 5.266088 -6.146828      11.37780 
1 1 1 -8  3  44 o 69.58891 3.394081 60.59951       5.738342 56.59039       8.115541 64.60803       8.114940 66.18155 5.070662 71.00365 4.716692 -4.822105      6.925230 
1 1 1 -8  3  45 o 40.30966 4.477046 21.12933       4.323721 22.00305       6.199556 20.30188       6.033170 39.74489 6.634655 38.06627 6.751011 1.678619       9.465453 
1 1 1 -8  3  46 o 20.09702 6.867272 5.733603       4.039735 1.647986       5.527189 10.41901       5.919013 16.99710 7.331398 25.66409 8.299947 -8.666998      11.07423 
1 1 1 -8  3  47 o 14.52833 6.313021 0.9161869      4.159683 -0.1311661     6.109621 1.821193       5.679283 15.94680 7.239143 16.78705 7.334181 -0.8402462     10.30512 
1 1 1 -8  3  48 o 20.89381 8.068497 7.321592       5.825137 7.321592       5.825137 0.000000       0.000000 20.89381 8.068497 ?        ?        0.000000       8.068497 
1 1 1 -8  3  49 o 15.53763 6.394495 3.003064       3.898953 3.981225       5.827161 2.210173       5.246364 17.36084 7.508123 15.78425 6.967262 1.576590       10.24279 
1 1 1 -8  3  50 o 12.65386 5.847703 -0.4466506     4.231987 3.455238       5.217675 -7.949177      7.235081 16.05743 7.022291 12.67437 6.275825 3.383055       9.417991 
1 1 1 -8  3  51 o 9.639299 4.715313 -4.460751      3.693961 -9.495131      5.323094 0.2156253      5.130336 10.14286 5.078982 13.52674 6.314540 -3.383883      8.103671 
1 1 1 -8  4  1  o 369.7985 5.514382 1667.533       49.69333 1590.245       95.78158 1696.000       58.12875 360.5545 10.91378 372.8914 6.396943 -12.33691      12.65036 
1 1 1 -8  4  2  o 609.9734 12.45805 4551.645       185.1813 0.000000       0.000000 4551.645       185.1813 ?        ?        609.9734 12.45805 0.000000       12.45805 
1 1 1 -8  4  3  o 196.8590 3.781981 472.3633       18.14306 439.2151       30.08439 491.3100       22.74460 189.6457 6.519411 200.7493 4.649305 -11.10365      8.007419 
1 1 1 -8  4  4  o 672.6927 9.669237 5526.604       158.5058 5496.697       223.4754 5556.882       224.8529 670.0829 13.68564 673.7392 13.69527 -3.656250      19.36123 
1 1 1 -8  4  5  o 378.2254 5.620632 1744.371       51.80503 1744.599       73.41029 1744.145       73.11734 378.1046 7.967258 378.0575 7.936452 0.4702759E-01  11.24564 
1 1 1 -8  4  6  o 442.4875 7.510635 2388.746       80.98672 2253.405       95.33295 2739.673       153.5103 429.6392 9.105484 473.0346 13.33036 -43.39542      16.14337 
1 1 1 -8  4  7  o 764.3983 10.94862 7137.785       203.9460 7113.117       287.8367 7162.654       289.0131 762.0936 15.49893 764.7402 15.50842 -2.646606      21.92551 
1 1 1 -8  4  8  o 242.5963 4.464522 717.3748       26.39340 697.0151       31.87079 761.8159       47.08691 239.1053 5.469751 249.7790 7.745212 -10.67368      9.481903 
1 1 1 -8  4  9  o 528.6866 7.672182 3409.323       98.84467 3290.624       136.5892 3539.829       143.2214 519.1290 10.79705 538.4150 10.91578 -19.28595      15.35352 
1 1 1 -8  4  10 o 689.8661 9.905583 5808.355       166.5256 5679.137       232.0690 5945.515       239.0935 681.5928 13.97192 697.3786 14.06899 -15.78583      19.82804 
1 1 1 -8  4  11 f 75.99494 2.313643 70.43918       4.279677 68.37602       6.158968 72.36544       5.951137 74.82826 3.386360 76.99427 3.178633 -2.166008      4.644474 
1 1 1 -8  4  12 o 234.6624 3.781345 671.0992       21.62349 662.0032       30.48368 680.3114       30.67771 233.0411 5.367830 236.2424 5.328794 -3.201248      7.563706 
1 1 1 -8  4  13 f 333.8276 5.050273 1358.369       41.08405 1356.656       58.17801 1360.073       58.02552 333.5522 7.157460 333.9730 7.129704 -0.4207764     10.10257 
1 1 1 -8  4  14 o 746.7700 12.38245 6811.043       225.3354 6570.572       269.2660 7372.994       411.6230 733.0489 15.07344 774.7280 21.82465 -41.67908      26.52403 
1 1 1 -8  4  15 o 363.6740 7.705993 1613.065       68.29313 1770.163       102.2581 1486.581       91.75541 380.6190 11.03646 348.7949 10.80811 31.82416       15.44729 
1 1 1 -8  4  16 o 538.5460 7.824030 3537.658       102.6808 3538.523       145.3860 3536.798       145.0398 538.3224 11.08266 538.1936 11.05892 0.1287842      15.65647 
1 1 1 -8  4  17 o 314.4078 5.571393 1205.166       42.68676 1178.944       51.68786 1261.412       75.70183 310.9232 6.821806 321.3264 9.678747 -10.40326      11.84125 
1 1 1 -8  4  18 o 748.8358 10.75384 6849.024       196.2395 6603.357       270.7347 7120.980       284.8522 734.4162 15.12744 762.6094 15.32785 -28.19318      21.53561 
1 1 1 -8  4  19 o 84.16441 2.655604 86.41073       5.439814 80.13112       7.610231 92.97137       7.778652 80.98910 3.867156 87.26091 3.666209 -6.271812      5.328788 
1 1 1 -8  4  20 o 447.7116 9.379843 2448.298       102.3364 2439.146       145.0300 2457.373       144.4229 446.1183 13.35553 447.8042 13.24920 -1.685852      18.81253 
1 1 1 -8  4  21 o 409.0837 7.059754 2042.505       70.37815 2025.680       121.8011 2050.938       86.22977 406.5137 12.30951 409.7560 8.635665 -3.242371      15.03658 
1 1 1 -8  4  22 o 149.3784 2.993000 271.9860       10.89509 297.0730       16.04387 250.5163       14.84216 156.0292 4.223443 143.2707 4.255840 12.75850       5.995802 
1 1 1 -8  4  23 o 298.4560 4.665130 1086.588       33.92971 1103.262       48.55265 1070.672       47.43458 300.5618 6.628925 296.0949 6.573975 4.466858       9.335940 
1 1 1 -8  4  24 o 60.43861 2.980529 44.64149       4.376251 38.95769       6.004028 51.08376       6.392092 56.33778 4.408356 64.58635 4.082196 -8.248566      6.008155 
1 1 1 -8  4  25 o 356.7614 5.436952 1554.503       47.26824 1582.418       67.71702 1527.978       66.01042 359.5160 7.729359 353.2911 7.667323 6.224945       10.88719 
1 1 1 -8  4  26 o 224.4259 3.801211 614.5513       20.78888 608.8176       29.30877 620.3570       29.49193 223.2195 5.388020 225.3270 5.370983 -2.107498      7.607774 
1 1 1 -8  4  27 o 18.83638 6.278244 4.093671       3.376360 2.851763       4.802742 5.307188       4.747526 18.98190 7.327327 21.75274 7.444298 -2.770832      10.44544 
1 1 1 -8  4  28 o 53.78669 3.749710 35.48263       4.884052 31.09601       5.787452 46.33649       9.103635 50.22045 4.786849 61.21331 6.187721 -10.99286      7.823160 
1 1 1 -8  4  29 o 136.5434 3.009920 227.4596       10.01525 235.8847       14.42593 219.6203       13.91527 138.8945 4.267153 134.0160 4.266313 4.878494       6.034072 
1 1 1 -8  4  30 o 165.2223 3.725482 333.3632       14.99986 331.9639       18.46969 336.0741       25.70798 164.7140 4.605953 165.4125 6.389710 -0.6984863     7.876750 
1 1 1 -8  4  31 o 166.6402 3.285522 339.0155       13.34198 338.0376       18.82782 340.0018       18.90926 166.1712 4.654105 166.6525 4.660725 -0.4813080     6.586581 
1 1 1 -8  4  32 o 63.25331 3.789276 49.06679       5.814066 49.97090       6.931198 46.92031       10.67976 63.75319 4.490109 61.30542 7.291376 2.447765       8.563016 
1 1 1 -8  4  33 o 120.9642 4.434901 179.3308       13.05092 186.5386       19.87575 173.8677       17.30392 122.9314 6.659618 118.8177 5.995606 4.113647       8.960904 
1 1 1 -8  4  34 o 37.73319 4.561058 17.69019       4.108965 16.37199       5.750040 19.06577       5.873845 35.86588 6.828237 38.85426 6.428240 -2.988377      9.378011 
1 1 1 -8  4  35 o 117.1900 3.060674 167.9062       8.733169 164.6174       12.18363 171.3817       12.52456 115.8394 4.323615 118.1927 4.355915 -2.353241      6.137397 
1 1 1 -8  4  36 o 13.06417 5.831887 -1.534373      3.780708 -0.5263883     5.129008 -2.733733      5.594757 16.30578 7.047908 15.55291 7.006411 0.7528763      9.937947 
1 1 1 -8  4  37 o 48.47319 4.046778 29.00808       4.736636 23.12641       6.396684 36.14804       7.047778 42.79671 6.323691 53.89385 5.440737 -11.09714      8.342103 
1 1 1 -8  4  38 o 58.28363 3.649022 41.81263       5.156732 37.29441       7.028181 47.08147       7.589571 54.70525 5.339938 61.57751 5.103570 -6.872253      7.386567 
1 1 1 -8  4  39 o 55.41569 4.203286 38.01654       5.633867 36.93013       6.932861 40.12894       9.667283 54.36079 5.300738 56.11012 7.238606 -1.749329      8.971914 
1 1 1 -8  4  40 o 68.88660 3.352332 58.44360       5.610634 64.14648       7.949896 52.78429       7.919461 71.85783 4.563529 65.01609 5.037766 6.841736       6.797418 
1 1 1 -8  4  41 o 40.15761 5.652294 20.62367       5.378466 12.40317       9.925291 24.04117       6.399537 30.95349 10.75632 43.19642 6.261826 -12.24293      12.44624 
1 1 1 -8  4  42 o 45.66900 4.760286 26.40769       5.220061 27.73392       8.300543 25.54002       6.713899 45.48307 7.767625 44.24557 6.413635 1.237499       10.07327 
1 1 1 -8  4  43 o 17.87502 7.191603 2.509218       4.800510 3.152217       9.411171 2.283078       5.581189 22.90464 9.714239 18.58380 7.649630 4.320839       12.36460 
1 1 1 -8  4  44 o 23.36881 6.638289 7.526089       3.956987 11.45953       5.675280 3.804943       5.520000 28.26605 7.922647 19.58853 7.768007 8.677517       11.09551 
1 1 1 -8  4  45 o 29.07350 6.140032 11.74957       4.213510 10.19890       6.023487 13.23537       5.896159 26.04941 8.368257 29.76087 7.970749 -3.711454      11.55684 
1 1 1 -8  4  46 o 31.83752 5.850754 14.22927       4.372059 9.874228       5.916003 19.47009       6.489808 24.96250 8.310274 35.77300 7.674561 -10.81050      11.31192 
1 1 1 -8  4  47 o 14.68537 6.200673 1.586901       3.806280 -0.4114211     5.197374 3.898388       5.589809 14.78162 6.696942 18.27348 7.600878 -3.491858      10.13027 
1 1 1 -8  4  48 o 14.90106 6.493903 1.393399       4.428534 -1.012734      5.699480 5.059361       7.035086 14.64157 6.773319 19.22606 8.281841 -4.584489      10.69891 
1 1 1 -8  4  49 o 16.35002 6.833292 3.504529       4.549429 5.800040       5.621010 -0.8548883     7.746204 18.67689 7.681245 15.83237 7.503652 2.844521       10.73808 
1 1 1 -8  4  50 o 10.89504 5.271382 -3.866573      4.282713 -0.5731476     5.442753 -9.220868      6.939784 13.71369 6.434721 12.06556 6.003505 1.648127       8.800438 
1 1 1 -8  4  51 o 14.27214 6.159629 2.580325       3.906020 2.042664       5.645354 3.074100       5.410050 14.80267 6.809438 15.31549 6.895463 -0.5128174     9.691019 
1 1 1 -8  5  1  o 147.1580 3.794033 264.1242       13.59436 257.2455       19.06901 271.2333       19.38556 145.1521 5.400408 149.0545 5.345656 -3.902420      7.598713 
1 1 1 -8  5  2  o 301.1758 4.631588 1105.772       33.99272 1098.692       68.31725 1108.101       39.18818 299.8314 9.361590 301.4680 5.334304 -1.636597      10.77470 
1 1 1 -8  5  3  o 176.4143 2.766771 379.2728       11.89442 410.8303       19.66894 361.0787       14.93468 183.5819 4.396579 172.1208 3.560626 11.46107       5.657557 
1 1 1 -8  5  4  o 376.7382 5.612857 1730.609       51.52995 1618.641       69.94932 1863.482       76.19996 364.2195 7.881052 390.7878 8.001614 -26.56836      11.23106 
1 1 1 -8  5  5  o 229.6816 3.704915 642.9699       20.73675 645.7410       29.56045 640.2850       29.09741 230.1402 5.270871 229.1675 5.210329 0.9726868      7.411451 
1 1 1 -8  5  6  o 197.5826 3.327025 475.7781       16.01920 463.4448       22.51287 488.4269       22.79898 194.9816 4.738068 200.1691 4.673931 -5.187561      6.655442 
1 1 1 -8  5  7  o 253.5003 4.635978 783.3341       28.63888 803.3664       35.66940 746.9938       48.04238 256.6934 5.702235 247.3192 7.981778 9.374115       9.809397 
1 1 1 -8  5  8  o 502.7570 8.463861 3083.846       103.6962 3231.773       131.1050 2836.684       169.4677 514.4963 10.45685 481.3683 14.46326 33.12802       17.84746 
1 1 1 -8  5  9  o 821.0886 11.74748 8233.995       235.0558 8062.178       327.6003 8416.307       337.4569 811.5322 16.56542 829.1318 16.70162 -17.59961      23.52355 
1 1 1 -8  5  10 o 833.6295 11.92311 8486.611       242.2136 8405.063       340.1344 8570.509       345.0010 828.6831 16.84325 836.7823 16.91889 -8.099243      23.87350 
1 1 1 -8  5  11 o 379.6470 5.653719 1757.028       52.30585 1719.889       73.13462 1795.916       74.83809 375.5216 7.991936 383.7311 8.003124 -8.209534      11.31022 
1 1 1 -8  5  12 o 811.7110 11.61305 8044.315       229.7120 8091.261       326.4421 7998.267       323.3044 813.2435 16.47212 808.5694 16.40809 4.674072       23.24987 
1 1 1 -8  5  13 o 548.0945 7.948655 3663.825       106.1659 3715.590       151.7670 3614.219       148.5668 551.6832 11.28890 544.1133 11.20460 7.569885       15.90541 
1 1 1 -8  5  14 o 551.8391 11.34022 3718.039       152.5001 3718.039       152.5001 0.000000       0.000000 551.8391 11.34022 ?        ?        0.000000       11.34022 
1 1 1 -8  5  15 o 266.7430 4.836935 867.2865       31.44122 867.6148       54.26721 867.1206       38.57539 266.5587 8.364623 266.6910 5.935616 -0.1322937     10.25663 
1 1 1 -8  5  16 o 338.9694 5.142041 1400.663       42.47488 1352.151       58.89544 1453.241       61.31467 332.9691 7.258412 345.1901 7.289034 -12.22101      10.28662 
1 1 1 -8  5  17 o 370.1685 5.557591 1670.578       50.13282 1670.001       71.06173 1671.149       70.73643 369.9919 7.881474 370.1212 7.842654 -0.1292725     11.11867 
1 1 1 -8  5  18 o 398.5680 5.944606 1937.071       57.73799 1884.776       80.45955 1992.590       82.90295 393.0003 8.401340 404.0830 8.419054 -11.08267      11.89382 
1 1 1 -8  5  19 o 351.6175 5.327057 1507.488       45.64508 1498.273       64.45963 1516.756       64.64455 350.4164 7.548614 352.5729 7.523967 -2.156464      10.65794 
1 1 1 -8  5  20 o 131.4188 4.116763 210.7478       13.16781 200.9190       19.46136 219.0468       17.88282 128.1872 6.248888 133.9088 5.491784 -5.721527      8.319153 
1 1 1 -8  5  21 o 308.3311 4.775113 1159.307       35.87873 1160.562       50.92516 1158.070       50.55722 308.3694 6.776807 308.0413 6.735010 0.3280945      9.554342 
1 1 1 -8  5  22 o 326.6671 5.018347 1301.698       39.94865 1299.207       56.55547 1304.179       56.43657 326.1673 7.115381 326.7938 7.086808 -0.6265259     10.04248 
1 1 1 -8  5  23 o 124.8466 2.847601 190.0009       8.663471 193.3933       12.36158 186.7262       12.14528 125.8631 4.035536 123.6722 4.035349 2.190826       5.706978 
1 1 1 -8  5  24 o 143.0849 2.987961 249.6083       10.41849 253.8933       14.88610 245.4941       14.58642 144.2011 4.240805 141.7948 4.226076 2.406311       5.986998 
1 1 1 -8  5  25 o 77.55251 2.815536 73.42741       5.312166 74.97355       7.441331 71.82065       7.585827 78.29468 3.912556 76.61374 4.077813 1.680939       5.651253 
1 1 1 -8  5  26 f 175.5460 3.291480 375.8888       14.08051 370.9623       19.86670 380.8614       19.95931 174.2325 4.683327 176.5479 4.643270 -2.315369      6.594961 
1 1 1 -8  5  27 o 101.6807 3.156713 126.2403       7.812384 120.7215       12.36729 129.9049       10.07770 99.25650 5.130453 103.0810 4.019574 -3.824455      6.517555 
1 1 1 -8  5  28 o 63.30505 3.507605 49.05623       5.389941 52.54964       6.616325 42.16362       9.293591 65.46732 4.168869 58.28666 6.662574 7.180668       7.859348 
1 1 1 -8  5  29 o 220.9823 3.798219 596.2536       20.45378 584.1434       28.63930 608.8611       29.22150 218.4968 5.378748 223.0723 5.375524 -4.575470      7.604419 
1 1 1 -8  5  30 o 88.52249 2.884970 95.71260       6.215137 86.82853       8.521459 105.8097       9.084605 84.19386 4.166280 92.97779 4.018997 -8.783928      5.788802 
1 1 1 -8  5  31 o 39.78944 4.716798 19.63854       4.484667 18.68561       5.293880 22.06059       8.439872 38.61877 5.804626 41.51702 8.624219 -2.898251      10.39571 
1 1 1 -8  5  32 o 106.5595 3.368207 138.8189       8.735372 143.8542       10.90763 129.8142       14.58654 108.3855 4.137342 102.6888 5.853229 5.696671       7.167837 
1 1 1 -8  5  33 o 57.38180 4.199278 40.49753       5.831328 39.91729       10.88460 40.73111       6.906027 56.24033 8.181722 57.43910 4.983088 -1.198772      9.579756 
1 1 1 -8  5  34 o 81.75688 3.078538 81.75939       6.122495 74.11275       8.313617 90.82112       9.050238 77.67070 4.410474 86.01798 4.331462 -8.347282      6.181735 
1 1 1 -8  5  35 o 55.43592 3.689477 37.76081       4.955796 34.46419       6.697934 41.74875       7.366828 52.70719 5.286040 58.06387 5.263535 -5.356674      7.459693 
1 1 1 -8  5  36 o 69.68468 3.335310 59.52983       5.647380 63.73741       7.829466 54.96666       8.153594 71.93795 4.488563 66.68436 5.055178 5.253593       6.760327 
1 1 1 -8  5  37 o 109.3003 3.437026 146.3901       9.143245 121.5068       13.84379 165.6422       12.17698 99.04771 5.760400 116.0880 4.311929 -17.04028      7.195481 
1 1 1 -8  5  38 o 37.13278 4.941984 17.28837       4.361001 9.979502       5.737581 27.28747       6.710950 27.84701 8.020386 46.53725 6.061532 -18.69023      10.05330 
1 1 1 -8  5  39 o 57.78749 4.085258 41.30095       5.715852 42.33937       6.943593 39.11814       10.06710 58.31825 4.932090 55.20425 7.691952 3.113998       9.137376 
1 1 1 -8  5  40 o 31.30312 6.879426 12.82781       5.104310 10.76698       9.416271 13.68536       6.074165 29.69394 10.46542 32.14081 7.828789 -2.446873      13.06962 
1 1 1 -8  5  41 o 63.12796 4.098082 49.58725       6.270252 52.79571       7.641149 42.97285       10.97124 64.87428 4.868893 57.04192 8.121892 7.832367       9.469490 
1 1 1 -8  5  42 o 43.65077 4.264671 23.98698       4.478622 22.31799       6.165357 25.85160       6.516693 41.31308 6.324982 44.59202 6.161477 -3.278942      8.830016 
1 1 1 -8  5  43 f 32.80172 7.831730 15.00856       6.173494 0.000000       0.000000 15.00856       6.173494 ?        ?        32.80172 7.831730 0.000000       7.831730 
1 1 1 -8  5  44 o 43.24499 4.303052 23.94843       4.474591 23.20290       6.286673 24.71391       6.370208 41.37286 6.445376 42.81717 6.292784 -1.444305      9.007886 
1 1 1 -8  5  45 o 15.01664 6.214579 1.517494       3.710231 2.123371       5.300515 0.9354565      5.195189 17.47252 7.343934 16.40804 7.092672 1.064480       10.20977 
1 1 1 -8  5  46 o 18.63299 7.016991 4.557927       4.335649 1.162856       6.301744 7.609455       5.974411 17.30861 7.638218 22.41893 8.277233 -5.110319      11.26299 
1 1 1 -8  5  47 o 16.62014 6.479759 3.449179       3.784514 0.7362591      5.261173 6.358123       5.447933 15.56682 6.918631 20.41940 7.824162 -4.852588      10.44438 
1 1 1 -8  5  48 o 20.30404 7.236608 6.725896       4.513133 9.414547       5.367554 0.2390774      8.337293 23.13182 7.915519 17.25657 8.053724 5.875244       11.29238 
1 1 1 -8  5  49 f 17.99618 6.740028 5.252455       3.988376 8.020910       5.702776 2.601869       5.580057 20.59682 7.975341 16.15525 7.155622 4.441570       10.71490 
1 1 1 -8  5  50 o 14.75453 6.502568 2.290726       4.553045 0.2547463      5.479642 6.830863       8.182762 14.12169 6.570046 18.41589 8.367006 -4.294207      10.63825 
1 1 1 -8  5  51 o 15.98772 6.448468 4.381835       3.870208 2.643359       5.488840 6.100761       5.457891 15.02960 6.837945 17.41543 7.392434 -2.385832      10.07003 
1 1 1 -8  6  1  o 410.3730 5.436653 2053.207       54.36839 2005.135       84.56654 2087.075       70.98215 405.3547 8.561054 413.6569 7.041623 -8.302216      11.08495 
1 1 1 -8  6  2  o 740.6224 10.63236 6699.425       191.8945 6782.078       387.5094 6672.571       220.8783 742.1628 21.44879 738.8445 12.26772 3.318298       24.70926 
1 1 1 -8  6  3  o 115.3819 2.519779 162.2332       7.084944 163.3277       10.24264 161.2292       9.810568 115.7050 3.637169 114.9638 3.505944 0.7412491      5.051795 
1 1 1 -8  6  4  o 957.4152 13.68913 11211.91       319.3833 10050.79       592.6805 11687.07       379.1426 901.0955 27.02120 976.8282 15.92753 -75.73267      31.36609 
1 1 1 -8  6  5  f 566.0135 8.193466 3908.762       113.0136 3882.945       159.2724 3934.942       160.3840 563.7646 11.59329 567.5264 11.59682 -3.761719      16.39788 
1 1 1 -8  6  6  o 755.4332 10.82724 6968.893       199.3196 6861.638       279.0926 7080.543       284.7536 748.7702 15.29550 760.6055 15.36292 -11.83527      21.67883 
1 1 1 -8  6  7  o 485.8327 7.091527 2878.538       83.95809 2929.110       120.2942 2830.505       117.2343 489.8564 10.07720 481.5482 9.990304 8.308258       14.19000 
1 1 1 -8  6  8  o 427.1682 7.275692 2225.328       75.73721 2233.171       93.09698 2209.977       130.2395 427.8231 8.929667 425.1276 12.58536 2.695496       15.43147 
1 1 1 -8  6  9  o 543.4158 7.882411 3601.644       104.3824 3607.676       147.9619 3595.667       147.2785 543.5994 11.16953 542.6971 11.13643 0.9022827      15.77271 
1 1 1 -8  6  10 o 308.3037 4.719105 1158.543       35.45475 1185.033       50.99903 1133.765       49.32409 311.7538 6.712961 304.9379 6.637609 6.815887       9.440430 
1 1 1 -8  6  11 o 465.8508 6.826641 2646.081       77.49791 2584.547       108.0437 2711.290       111.2226 460.2430 9.633321 471.3895 9.682271 -11.14651      13.65823 
1 1 1 -8  6  12 o 665.4966 9.576333 5403.788       155.3035 5579.415       224.5745 5242.813       215.0026 675.7450 13.63771 655.0669 13.46858 20.67810       19.16742 
1 1 1 -8  6  13 o 381.1425 6.581993 1771.223       61.13372 1757.906       74.62267 1798.403       106.6062 379.6427 8.066026 383.6277 11.41616 -3.984924      13.97818 
1 1 1 -8  6  14 o 227.4200 4.334787 630.3714       24.02329 668.1293       30.43277 567.9397       39.13269 234.1135 5.334318 215.6714 7.457012 18.44206       9.168531 
1 1 1 -8  6  15 o 93.51505 3.407344 106.7167       7.751879 107.3952       11.09202 106.0689       10.83802 93.73785 4.872510 93.16057 4.790076 0.5772781      6.832729 
1 1 1 -8  6  16 o 326.9445 4.992663 1303.033       39.77795 1237.811       54.64671 1376.539       58.01313 318.5840 7.038887 335.9607 7.086010 -17.37665      9.987866 
1 1 1 -8  6  17 o 461.2802 6.785309 2595.040       76.27296 2654.737       109.6357 2539.047       106.1798 466.3321 9.647629 456.0662 9.553839 10.26584       13.57765 
1 1 1 -8  6  18 o 446.2865 6.587506 2429.218       71.64252 2471.969       102.6186 2388.568       100.0653 449.9682 9.358541 442.3195 9.283491 7.648712       13.18201 
1 1 1 -8  6  19 o 339.4758 5.176206 1405.178       42.82096 1474.144       62.50179 1344.172       58.78494 347.5796 7.379078 331.9105 7.267900 15.66904       10.35728 
1 1 1 -8  6  20 o 560.4631 11.56890 3843.545       158.0066 3949.119       228.4981 3746.803       218.7318 566.6218 16.56608 551.9941 16.27856 14.62769       23.22556 
1 1 1 -8  6  21 o 280.2379 4.429534 957.6174       30.24970 941.2004       42.52398 974.4349       43.03976 277.7180 6.283385 282.5810 6.250154 -4.862976      8.862582 
1 1 1 -8  6  22 o 55.33427 3.053039 37.43766       4.100871 37.90614       5.784178 36.96417       5.814959 55.58572 4.303640 54.87924 4.384569 0.7064819      6.143758 
1 1 1 -8  6  23 o 89.70549 2.733303 98.18376       5.968098 93.64664       8.352283 102.9170       8.530879 87.54054 3.925237 91.78603 3.822369 -4.245483      5.478868 
1 1 1 -8  6  24 o 166.4296 3.177992 337.7437       12.88901 343.8806       18.47829 331.9287       17.98724 167.8108 4.522742 164.8701 4.481151 2.940750       6.366782 
1 1 1 -8  6  25 o 106.7464 2.805935 139.0320       7.292729 134.8782       10.20445 143.3682       10.42608 105.0628 3.992966 108.3263 3.956224 -3.263535      5.620986 
1 1 1 -8  6  26 o 190.8852 3.450120 444.5181       16.04880 458.7498       23.17109 431.3955       22.24979 193.7317 4.912019 187.8690 4.864073 5.862671       6.912824 
1 1 1 -8  6  27 o 224.5541 4.357024 615.7791       23.84224 649.5502       41.72025 599.4009       29.05405 230.0143 7.452975 221.4166 5.384686 8.597656       9.194655 
1 1 1 -8  6  28 o 232.6651 4.546266 661.3866       25.77639 654.5782       31.45429 675.3076       44.97733 231.3046 5.580326 234.3297 7.887685 -3.025162      9.662071 
1 1 1 -8  6  29 o 328.6624 5.116652 1321.330       40.98000 1327.988       58.15918 1314.766       57.75192 328.8379 7.257722 327.2019 7.242934 1.635986       10.25352 
1 1 1 -8  6  30 o 69.43926 3.009769 58.95128       5.080914 56.31799       6.999155 61.88494       7.387560 67.74940 4.260977 71.02848 4.288050 -3.279083      6.045106 
1 1 1 -8  6  31 o 211.8612 5.313005 550.1856       27.40849 550.1856       27.40849 0.000000       0.000000 211.8612 5.313005 ?        ?        0.000000       5.313005 
1 1 1 -8  6  32 o 63.41436 3.243462 49.23567       4.995597 47.73826       6.817537 50.97194       7.341172 62.29633 4.521633 64.35676 4.713655 -2.060425      6.531746 
1 1 1 -8  6  33 o 121.4656 3.601950 180.4828       10.64994 179.8607       19.54451 180.7456       12.70123 120.6778 6.671979 121.4523 4.298225 -0.7744904     7.936627 
1 1 1 -8  6  34 o 80.47437 3.105135 79.22913       6.077970 79.78483       8.412992 78.62245       8.790526 80.60762 4.298445 79.98264 4.528569 0.6249847      6.243762 
1 1 1 -8  6  35 o 102.8148 3.044885 129.2789       7.620508 135.0165       10.71600 123.4087       10.83910 104.9004 4.200479 100.2392 4.448389 4.661156       6.118185 
1 1 1 -8  6  36 o 148.9010 3.245155 271.1558       11.77522 278.6819       16.73608 263.7778       16.57051 150.6119 4.565201 146.5035 4.647308 4.108414       6.514486 
1 1 1 -8  6  37 f 125.3152 3.503692 192.4674       10.68905 193.1383       17.33208 192.0556       13.57888 124.9334 5.708015 124.9533 4.466623 -0.1993561E-01 7.247907 
1 1 1 -8  6  38 o 91.52451 3.106818 102.6820       6.919255 104.6373       9.630802 100.5960       9.947490 92.14130 4.301025 90.28273 4.535928 1.858574       6.250877 
1 1 1 -8  6  39 o 77.33714 5.010571 74.33254       9.392204 59.66518       14.03655 86.22339       12.63836 67.90137 8.681230 82.85946 6.306483 -14.95808      10.73012 
1 1 1 -8  6  40 o 124.4068 3.161006 190.2471       9.575328 188.8116       13.43447 191.7293       13.65125 123.3950 4.475143 124.3274 4.513261 -0.9324493     6.355819 
1 1 1 -8  6  41 o 29.73356 6.423254 11.63795       4.517929 11.96642       5.289773 10.75228       8.686168 29.93032 7.315314 28.95122 10.06239 0.9791031      12.44048 
1 1 1 -8  6  42 o 61.58278 3.523721 47.15460       5.265993 43.13350       7.192984 51.79915       7.730514 58.24232 5.120031 63.91947 5.002770 -5.677143      7.158382 
1 1 1 -8  6  43 o 19.20445 7.417136 3.763835       4.923078 -8.008579      9.290113 8.360687       5.805218 17.39355 8.235873 24.81936 8.231177 -7.425812      11.64396 
1 1 1 -8  6  44 o 41.92847 4.760952 22.81240       4.778481 16.88372       7.374105 27.10408       6.273992 33.57544 8.878341 45.08256 5.848540 -11.50713      10.63157 
1 1 1 -8  6  45 o 36.33095 5.004282 17.57127       4.312955 16.46050       6.002114 18.75712       6.201658 33.43558 7.546154 35.93163 7.331187 -2.496048      10.52097 
1 1 1 -8  6  46 o 9.246758 4.582908 -8.018372      3.891983 -12.78863      6.099931 -4.743109      5.054488 11.21890 5.589725 12.47744 5.955278 -1.258547      8.167641 
1 1 1 -8  6  47 o 16.72802 6.517512 3.551325       3.826724 8.202570       5.203226 -1.928434      5.647663 22.37281 7.787242 14.35980 6.677165 8.013011       10.25796 
1 1 1 -8  6  48 o 23.08212 7.240727 8.943448       4.532576 11.31200       5.695432 4.852209       7.485367 24.98790 8.146248 19.06318 8.371757 5.924721       11.68108 
1 1 1 -8  6  49 o 15.87680 6.550169 3.371677       4.104438 -3.138018      5.760136 10.08610       5.850012 13.18102 6.309081 22.45888 8.207493 -9.277857      10.35217 
1 1 1 -8  6  50 o 12.82568 5.754416 0.7160738      3.731236 6.301662       5.418528 -4.320950      5.145575 18.14667 7.510096 11.70139 5.688677 6.445280       9.421390 
1 1 1 -8  6  51 o 10.13018 4.981179 -5.209375      4.291393 -6.494140      5.178682 -2.393576      7.666697 10.75623 5.323085 13.98536 6.830957 -3.229125      8.660092 
1 1 1 -8  7  1  o 603.5681 7.120544 4442.930       104.7311 4381.862       146.7566 4506.307       149.5059 599.1248 10.05181 607.5675 10.09782 -8.442749      14.24798 
1 1 1 -8  7  2  o 452.4876 7.692036 2497.480       84.81723 2236.617       137.4202 2658.010       107.8005 427.5407 13.20560 466.6688 9.479293 -39.12814      16.25561 
1 1 1 -8  7  3  o 749.6216 9.619282 6858.684       175.7199 6892.324       278.5253 6836.440       226.4813 750.4824 15.22958 747.9737 12.42539 2.508728       19.65529 
1 1 1 -8  7  4  o 108.9063 2.256939 144.5282       5.989753 147.0166       9.717212 143.0033       7.606731 109.7714 3.637613 108.2886 2.885135 1.482796       4.642869 
1 1 1 -8  7  5  o 862.2615 12.32734 9083.657       259.0266 9139.865       368.0678 9028.504       364.5948 863.7432 17.48667 858.4807 17.42785 5.262451       24.68833 
1 1 1 -8  7  6  o 189.9857 3.282104 439.8745       15.19531 423.2960       21.30786 457.0302       21.67567 186.2939 4.697336 193.6380 4.593524 -7.344025      6.570040 
1 1 1 -8  7  7  o 341.7442 5.167280 1423.637       43.03276 1419.938       60.89872 1427.326       60.81639 341.2242 7.323728 342.1120 7.294847 -0.8877869     10.33691 
1 1 1 -8  7  8  o 472.1098 7.993368 2718.500       91.96210 2690.603       112.0745 2775.990       160.8904 469.5628 9.794378 476.3936 13.87366 -6.830841      16.98259 
1 1 1 -8  7  9  o 107.6876 2.527608 141.3123       6.633023 140.6384       9.561389 141.9374       9.209524 107.3625 3.659889 107.8636 3.508360 -0.5011673     5.069850 
1 1 1 -8  7  10 o 372.9893 5.582144 1695.905       50.73802 1651.004       70.70949 1743.561       72.84704 367.9331 7.886290 378.1050 7.906119 -10.17194      11.16693 
1 1 1 -8  7  11 o 1041.738 14.86145 13266.72       377.2729 12680.53       517.0886 13933.97       551.6783 1016.828 20.86803 1065.774 21.24147 -48.94623      29.77708 
1 1 1 -8  7  12 o 372.6371 6.459250 1693.002       58.65490 1675.648       71.43216 1728.922       102.7690 370.6629 7.908216 376.1590 11.22382 -5.496063      13.73004 
1 1 1 -8  7  13 o 326.0433 5.757329 1295.948       45.74382 1303.486       56.30961 1281.319       78.44225 326.9462 7.067569 323.8750 9.950663 3.071228       12.20517 
1 1 1 -8  7  14 o 353.3944 5.333459 1522.420       45.93088 1496.419       64.49235 1549.183       65.42995 350.2788 7.555414 356.4017 7.533568 -6.122894      10.66953 
1 1 1 -8  7  15 o 538.9115 11.06841 3546.515       145.3580 3419.193       200.6803 3687.041       210.8294 528.3463 15.60365 548.6345 15.78570 -20.28815      22.19599 
1 1 1 -8  7  16 o 511.8709 7.473563 3195.955       93.22326 3215.574       132.6655 3176.817       131.0250 513.1559 10.60895 510.0611 10.54134 3.094818       14.95559 
1 1 1 -8  7  17 o 685.0167 9.871314 5729.596       164.7829 5890.293       237.4507 5580.313       228.8630 693.8086 14.04422 675.3338 13.90660 18.47479       19.76446 
1 1 1 -8  7  18 o 148.5843 2.975063 269.0580       10.77221 271.5724       15.54280 266.7339       14.94331 149.1984 4.279352 147.8678 4.151137 1.330597       5.961945 
1 1 1 -8  7  19 o 525.6381 8.876381 3374.104       113.6996 3233.971       192.4088 3449.293       140.9397 513.2206 15.40198 531.1608 10.88858 -17.94019      18.86218 
1 1 1 -8  7  20 o 167.5503 4.517307 342.5452       18.42742 337.5389       27.20161 346.7914       25.05157 166.1746 6.731217 168.4870 6.111567 -2.312408      9.091784 
1 1 1 -8  7  21 o 378.4205 5.700011 1747.263       52.56377 1664.941       72.23999 1839.885       76.62658 369.1464 8.030507 388.0464 8.103259 -18.89996      11.40841 
1 1 1 -8  7  22 o 413.4569 6.171144 2087.059       62.17733 2036.619       86.73151 2140.392       89.18380 408.0237 8.722790 418.2847 8.749393 -10.26096      12.35471 
1 1 1 -8  7  23 o 297.7377 4.673697 1081.639       33.91022 1061.470       47.63689 1102.357       48.28219 294.7398 6.632367 300.3674 6.596265 -5.627563      9.354091 
1 1 1 -8  7  24 o 200.2267 3.524366 488.9603       17.19647 500.2118       24.72752 478.4219       23.93099 202.4165 5.013009 197.9004 4.966165 4.516144       7.056419 
1 1 1 -8  7  25 o 292.2425 4.617495 1042.708       32.88410 1091.318       47.99011 999.6808       45.15000 298.6667 6.593694 285.8721 6.481118 12.79465       9.245630 
1 1 1 -8  7  26 o 45.50347 3.609350 25.42272       3.969534 29.73058       6.293903 22.57732       5.115177 49.03158 5.354471 42.69718 5.011433 6.334400       7.333814 
1 1 1 -8  7  27 o 174.2807 3.820539 370.7484       16.22594 363.9565       19.71258 385.0188       28.57394 172.5356 4.692802 177.1640 6.630181 -4.628433      8.122911 
1 1 1 -8  7  28 o 180.2666 3.904974 396.7706       17.15416 419.3322       21.60514 358.2869       28.21698 185.1624 4.792184 170.8102 6.792466 14.35217       8.312799 
1 1 1 -8  7  29 o 36.06440 4.122307 16.09512       3.557885 23.26179       4.956466 8.476753       5.110279 43.35823 4.769675 26.01799 7.591741 17.34024       8.965732 
1 1 1 -8  7  30 o 118.2674 3.428537 170.9174       9.870774 172.0658       12.08478 168.6156       17.10915 118.5807 4.188623 117.1177 6.014881 1.462944       7.329622 
1 1 1 -8  7  31 o 117.0585 3.416930 167.4832       9.736665 158.5143       11.75496 187.0856       17.37818 113.7802 4.246992 123.3743 5.796417 -9.594101      7.185777 
1 1 1 -8  7  32 o 45.66237 4.929131 25.83257       5.398036 17.73452       10.04978 29.11631       6.399571 37.20962 10.58225 48.41470 5.522884 -11.20507      11.93676 
1 1 1 -8  7  33 o 43.53660 4.183890 23.40465       4.384272 25.76592       6.127762 20.92816       6.275470 45.46721 5.652216 40.73633 6.543114 4.730881       8.646380 
1 1 1 -8  7  34 o 16.01538 6.231853 1.961797       3.495079 0.2124601      4.503131 4.612195       5.542856 15.89128 6.728795 21.62675 7.974809 -5.735472      10.43428 
1 1 1 -8  7  35 o 43.68574 4.197594 23.59454       4.413718 21.44122       5.858963 26.42002       6.711391 41.30058 5.996537 45.89720 6.155596 -4.596622      8.593592 
1 1 1 -8  7  36 o 139.7859 3.191449 238.9681       10.87145 230.9317       15.13662 247.5304       15.62407 137.0838 4.537384 141.9337 4.523005 -4.849945      6.406671 
1 1 1 -8  7  37 o 139.3128 3.596868 237.9653       12.20080 211.5262       18.93778 256.7264       15.95274 130.6200 5.965287 144.4391 4.537885 -13.81914      7.495135 
1 1 1 -8  7  38 o 23.14700 7.717552 6.423057       5.101817 0.4729053      9.714328 8.689294       5.995168 22.89067 9.793843 26.33839 8.336194 -3.447720      12.86124 
1 1 1 -8  7  39 o 39.17828 4.929660 19.28881       4.602548 19.53713       5.515259 18.71919       8.353231 39.16671 5.966694 37.44019 9.217984 1.726517       10.98056 
1 1 1 -8  7  40 o 92.19175 3.108459 104.5446       6.973517 92.58847       9.457907 118.7875       10.32285 86.29950 4.512970 97.84832 4.340022 -11.54882      6.261206 
1 1 1 -8  7  41 o 43.32657 4.225617 23.53582       4.404864 27.79560       5.827678 17.85880       6.727633 46.79955 5.197516 36.45754 7.807792 10.34201       9.379541 
1 1 1 -8  7  42 o 15.77082 6.223300 2.021575       3.526872 1.843689       4.567602 2.284236       5.550274 17.02731 6.954528 18.66446 7.649678 -1.637146      10.33843 
1 1 1 -8  7  43 o 22.92782 7.580829 7.031361       4.925175 4.523939       9.683016 7.906474       5.720436 23.67854 9.937556 24.20183 8.173182 -0.5232868     12.86685 
1 1 1 -8  7  44 f 20.98043 6.504934 6.020992       3.669629 8.094021       5.137654 3.861886       5.243233 23.91149 7.732702 19.23072 7.588166 4.680769       10.83397 
1 1 1 -8  7  45 o 27.45548 6.641026 10.84544       4.394302 3.397962       6.654169 16.60519       5.851822 19.53206 8.220119 33.62518 7.347347 -14.09312      11.02515 
1 1 1 -8  7  46 f 29.71752 6.641883 13.09612       4.688796 13.90142       6.968576 12.42995       6.338092 28.44194 8.985669 27.27643 8.563096 1.165510       12.41245 
1 1 1 -8  7  47 o 16.93562 6.507140 3.791206       3.775288 -0.4651768     5.206125 8.511903       5.482736 14.64050 6.660373 22.54948 7.982293 -7.908981      10.39604 
1 1 1 -8  7  48 o 17.95202 7.034319 4.804195       4.478482 -0.5365849     5.318253 17.82460       8.303839 14.36649 6.608947 28.66177 9.844165 -14.29528      11.85689 
1 1 1 -8  7  49 o 22.76448 7.348397 9.458961       4.640999 6.249784       5.422012 18.25385       8.975916 18.77016 7.610249 26.35060 10.05625 -7.580442      12.61127 
1 1 1 -8  7  50 o 16.64778 6.456785 4.677826       3.742459 0.9870871      5.139046 8.845297       5.460874 14.17667 6.512469 20.39360 7.828590 -6.216933      10.18327 
1 1 1 -8  7  51 o 14.58297 6.211323 3.065569       3.875984 -0.1193901     5.512982 6.178731       5.450490 13.48103 6.371686 17.34588 7.376097 -3.864848      9.747061 
1 1 1 -8  8  1  o 414.2517 7.096043 2092.677       71.63357 0.000000       0.000000 2092.677       71.63357 ?        ?        414.2517 7.096043 0.000000       7.096043 
1 1 1 -8  8  2  o 563.6985 8.183605 3876.063       112.4159 3880.302       225.5574 3874.661       129.6679 562.8015 16.46391 563.4911 9.442986 -0.6896362     18.97973 
1 1 1 -8  8  3  o 322.9820 4.415855 1271.467       34.75595 1182.464       52.65060 1340.204       46.26994 311.3977 6.938281 331.5605 5.726642 -20.16284      8.996343 
1 1 1 -8  8  4  o 110.4148 2.317233 148.5591       6.234951 148.2407       10.06740 148.7573       7.941219 110.2246 3.753502 110.4459 2.953190 -0.2213135     4.775992 
1 1 1 -8  8  5  o 114.1589 2.578641 158.8080       7.173594 162.9949       10.47793 155.1139       9.841898 115.5873 3.724749 112.7607 3.586225 2.826561       5.170567 
1 1 1 -8  8  6  o 647.4963 9.338655 5115.378       147.3526 4950.023       204.0736 5295.495       212.9883 636.5149 13.15655 658.3356 13.27615 -21.82074      18.69094 
1 1 1 -8  8  7  o 270.4392 4.933510 891.4736       32.51335 918.2307       40.67221 844.1033       54.11679 274.4409 6.081529 262.9247 8.457261 11.51620       10.41683 
1 1 1 -8  8  8  o 1175.984 16.75868 16921.60       480.2612 16857.89       677.6920 16985.87       680.7017 1171.288 23.74283 1175.719 23.75839 -4.431152      33.58844 
1 1 1 -8  8  9  o 536.0477 7.800242 3504.357       101.8938 3330.451       139.5004 3703.248       149.1858 522.3463 10.95925 550.7914 11.11486 -28.44519      15.60915 
1 1 1 -8  8  10 o 152.6380 2.940800 283.9146       10.93866 270.0837       15.40556 297.9779       15.53445 148.8024 4.252822 156.3100 4.081735 -7.507568      5.894664 
1 1 1 -8  8  11 o 608.5081 12.47037 4522.487       184.9191 4522.487       184.9191 0.000000       0.000000 608.5081 12.47037 ?        ?        0.000000       12.47037 
1 1 1 -8  8  12 o 438.4031 7.486806 2343.911       79.98460 2374.591       98.92588 2285.992       135.9232 441.1625 9.201852 432.3807 12.91452 8.781830       15.85746 
1 1 1 -8  8  13 o 833.2313 11.92929 8479.506       242.2234 8203.043       334.9883 8782.440       350.6600 818.5813 16.79313 846.9502 16.98996 -28.36890      23.88866 
1 1 1 -8  8  14 o 163.3980 3.490759 325.3821       13.89961 321.6390       24.00046 327.2712       17.04996 162.3062 6.078778 163.8071 4.274899 -1.500870      7.431441 
1 1 1 -8  8  15 o 386.3138 5.789954 1819.544       54.50689 1979.744       81.71006 1691.100       73.16471 402.8248 8.323831 372.3179 8.064022 30.50693       11.58942 
1 1 1 -8  8  16 o 278.7489 4.397970 947.1250       29.87456 922.3135       41.86416 972.8703       42.64467 275.0173 6.246638 282.4561 6.195518 -7.438873      8.798008 
1 1 1 -8  8  17 o 192.6690 3.388777 452.4241       15.91076 433.1245       22.29936 472.4386       22.70865 188.4256 4.860481 196.8596 4.733677 -8.433975      6.784687 
1 1 1 -8  8  18 o 87.00646 2.676204 92.34266       5.667483 89.76659       8.270414 94.62340       7.781932 85.72326 3.969843 88.03397 3.635268 -2.310715      5.382828 
1 1 1 -8  8  19 o 176.2218 4.611913 378.8897       19.78807 363.2570       28.70822 393.0397       27.31300 172.4024 6.846860 179.3844 6.257694 -6.982025      9.275680 
1 1 1 -8  8  20 o 327.1884 5.027996 1305.641       40.08934 1342.776       57.88926 1271.421       55.57153 331.6430 7.162935 322.7194 7.066285 8.923645       10.06181 
1 1 1 -8  8  21 o 228.5629 3.816823 636.9666       21.25905 684.9662       31.50771 596.8525       28.80361 236.9331 5.457013 221.1756 5.344087 15.75752       7.637949 
1 1 1 -8  8  22 o 386.8817 5.823153 1827.295       54.90001 1795.582       77.01376 1860.062       78.28246 383.1345 8.248614 389.9551 8.237848 -6.820648      11.65769 
1 1 1 -8  8  23 o 267.9958 4.306374 876.2440       28.12393 911.7861       40.92929 844.4518       38.70991 273.1935 6.147914 262.9244 6.041645 10.26910       8.619648 
1 1 1 -8  8  24 o 342.1849 5.251639 1430.023       43.79171 1442.200       62.53253 1418.304       61.34616 343.2275 7.476320 340.3895 7.395630 2.838013       10.51621 
1 1 1 -8  8  25 o 20.01836 5.861350 4.982550       3.041593 5.014548       4.183329 4.946663       4.430202 20.88450 6.988906 21.01619 7.191236 -0.1316814     10.02790 
1 1 1 -8  8  26 o 142.3632 3.378665 247.2672       11.72139 244.8491       19.54576 248.6251       14.64747 141.3843 5.684620 142.6398 4.218551 -1.255478      7.078918 
1 1 1 -8  8  27 o 50.64101 3.807023 31.48042       4.663721 30.99864       5.456481 32.78654       8.984210 50.17371 4.510828 51.17563 7.420316 -1.001915      8.683815 
1 1 1 -8  8  28 o 77.25184 2.871546 72.90061       5.396399 80.49301       7.698209 65.56519       7.566810 81.09694 3.906866 73.13770 4.264058 7.959236       5.783234 
1 1 1 -8  8  29 o 213.0089 4.334692 554.5210       22.50050 554.2292       27.58318 555.1012       38.89930 212.7900 5.319332 212.3434 7.529302 0.4465179      9.218767 
1 1 1 -8  8  30 o 99.53516 3.321144 121.0901       8.044366 123.9273       10.00709 115.9080       13.52427 100.6159 4.089884 97.07647 5.742599 3.539474       7.050148 
1 1 1 -8  8  31 o 96.48524 2.903266 113.7262       6.818511 111.6012       9.512486 115.9717       9.778684 95.45474 4.098960 97.30500 4.133325 -1.850258      5.821155 
1 1 1 -8  8  32 o 140.8322 3.689386 242.5737       12.65080 251.1357       23.72749 239.1730       14.95353 142.6508 6.845589 139.7305 4.397008 2.920319       8.136078 
1 1 1 -8  8  33 o 69.19920 3.196366 58.61927       5.375501 61.13303       7.530780 56.00796       7.675497 70.52571 4.403816 67.45097 4.699012 3.074745       6.440055 
1 1 1 -8  8  34 o 155.5372 3.253439 295.6535       12.33142 290.3824       17.31327 301.0809       17.56805 153.8407 4.623436 156.6553 4.606959 -2.814606      6.526886 
1 1 1 -8  8  35 o 88.11331 3.050833 95.00267       6.540944 99.31519       9.363520 90.89262       9.141075 89.91042 4.285932 85.98912 4.376717 3.921303       6.125754 
1 1 1 -8  8  36 o 56.62894 3.999074 39.50072       5.483171 37.42834       8.113218 41.24312       7.439288 54.69633 6.195938 57.62887 5.358707 -2.932537      8.191788 
1 1 1 -8  8  37 f 141.1253 3.891358 244.5314       13.36987 241.5044       24.58343 245.8028       15.93211 138.9325 7.286575 141.2676 4.634285 -2.335144      8.635437 
1 1 1 -8  8  38 o 118.2443 3.140059 171.4167       9.040024 163.8883       12.44940 179.8141       13.14825 115.2608 4.440624 120.7268 4.476941 -5.465996      6.305723 
1 1 1 -8  8  39 o 99.69167 3.515117 122.3021       8.526182 115.8084       10.23100 137.0645       15.42587 96.75093 4.350502 104.5376 6.081633 -7.786713      7.477508 
1 1 1 -8  8  40 o 16.33156 6.595159 1.668369       4.053727 6.172547       4.766294 -10.10848      7.707039 22.38009 7.459406 15.12845 7.256240 7.251634       10.40652 
1 1 1 -8  8  41 o 28.58828 5.536730 10.63655       3.717875 13.75850       5.087686 7.058894       5.446359 32.22666 6.697314 23.65765 7.974982 8.569006       10.41414 
1 1 1 -8  8  42 o 24.76570 6.396019 8.237692       3.886917 -0.5464397     5.025771 21.31242       6.131541 15.64319 6.865130 40.11572 6.493991 -24.47253      9.449970 
1 1 1 -8  8  43 o 16.52186 6.809127 1.739983       4.429180 3.177896       9.030080 1.284455       5.082564 22.24809 9.478548 16.96419 7.164168 5.283901       11.88142 
1 1 1 -8  8  44 o 19.77329 6.614419 5.230561       3.747076 5.178317       5.218818 5.286152       5.383342 20.46310 7.700214 20.67535 7.811733 -0.2122536     10.96889 
1 1 1 -8  8  45 o 20.63698 7.053101 6.020044       4.261365 -2.442462      6.014958 14.54770       6.038069 15.10240 6.976517 30.77986 7.983263 -15.67746      10.60209 
1 1 1 -8  8  46 o 23.54996 7.059800 8.552003       4.370721 3.954285       6.275937 12.88203       6.090499 18.93830 7.977389 27.81473 8.332742 -8.876438      11.53574 
1 1 1 -8  8  47 o 19.18449 6.639032 5.577975       3.779379 4.359306       5.020619 7.171607       5.741278 18.11230 7.330538 20.98349 8.034116 -2.871193      10.87584 
1 1 1 -8  8  48 o 10.27856 5.024913 -5.731338      4.175803 -1.505833      5.033530 -15.05918      7.478662 13.43709 6.266717 11.77498 5.913620 1.662110       8.616418 
1 1 1 -8  8  49 o 11.44306 5.474978 -3.081436      4.328195 -4.069300      5.064906 -0.4071701     8.333456 11.92338 5.760074 15.93724 7.617570 -4.013854      9.550174 
1 1 1 -8  8  50 o 19.88680 6.778222 7.339665       3.935189 11.02393       5.643692 3.853466       5.489891 22.34578 8.076706 16.10183 7.116405 6.243952       10.76459 
1 1 1 -8  8  51 o 19.46524 6.915112 7.554403       4.117906 6.494709       5.919332 8.548211       5.732363 17.42596 7.551721 19.11549 7.797180 -1.689535      10.85470 
1 1 1 -8  9  1  o 635.0831 8.199323 4919.515       126.8950 4841.073       198.5423 4973.686       164.9925 629.5079 12.94242 638.3450 10.60651 -8.837097      16.73334 
1 1 1 -8  9  2  o 216.8544 4.191370 573.1409       22.14931 0.000000       0.000000 573.1409       22.14931 ?        ?        216.8544 4.191370 0.000000       4.191370 
1 1 1 -8  9  3  o 804.3945 10.30581 7896.970       202.0167 7698.890       313.9148 8036.994       263.9317 793.2736 16.23876 811.0410 13.35404 -17.76746      21.02445 
1 1 1 -8  9  4  o 268.5097 4.246001 878.7125       27.78281 870.9357       39.29376 886.4869       39.28791 267.2811 6.032805 269.6581 5.978735 -2.377045      8.493527 
1 1 1 -8  9  5  o 248.1085 3.997670 750.2313       24.17045 731.2203       33.91126 769.8621       34.45968 244.9144 5.681899 251.3036 5.626993 -6.389206      7.996688 
1 1 1 -8  9  6  o 460.5436 6.058327 2585.749       67.99228 2575.812       107.3525 2592.405       87.86111 459.4680 9.587837 461.0516 7.820076 -1.583679      12.37256 
1 1 1 -8  9  7  o 509.7601 8.600782 3169.699       106.8415 3170.823       131.0353 3167.468       184.5439 509.7084 10.54947 508.8024 14.89987 0.9059753      18.25644 
1 1 1 -8  9  8  o 913.5645 13.05707 10195.13       290.6841 10347.74       415.7579 10049.19       406.5746 919.1816 18.56108 905.8606 18.41801 13.32104       26.14836 
1 1 1 -8  9  9  o 163.5458 3.514747 325.9614       14.00779 335.6930       25.06241 321.5403       16.89264 165.8201 6.213243 162.3695 4.273018 3.450607       7.540761 
1 1 1 -8  9  10 o 579.3920 9.706506 4096.229       137.0476 4129.638       168.8837 4031.803       234.5242 581.5352 11.91724 573.7432 16.79197 7.791992       20.59104 
1 1 1 -8  9  11 o 525.2946 8.858110 3366.330       113.3914 3245.198       135.5202 3649.089       207.0535 515.6011 10.78584 545.9759 15.57820 -30.37482      18.94769 
1 1 1 -8  9  12 f 431.2039 7.370006 2267.598       77.44380 2271.238       95.20389 2260.478       133.1492 431.4501 9.054990 429.9536 12.72210 1.496521       15.61552 
1 1 1 -8  9  13 o 313.1141 4.828492 1195.061       36.84260 1195.415       52.35494 1194.714       51.85526 313.0949 6.861919 313.0054 6.798371 0.8953857E-01  9.659389 
1 1 1 -8  9  14 o 558.0455 9.356089 3800.644       127.2331 3603.059       212.6589 3910.805       158.7883 542.2385 16.11161 565.8365 11.51573 -23.59802      19.80394 
1 1 1 -8  9  15 o 159.4863 3.063370 309.9816       11.90581 316.5798       17.29269 304.0354       16.41620 161.0981 4.409046 157.8773 4.270866 3.220749       6.138402 
1 1 1 -8  9  16 o 232.3031 3.845168 657.7497       21.76739 656.1600       31.04673 659.2867       30.52732 231.9820 5.491935 232.5370 5.387167 -0.5550232     7.693044 
1 1 1 -8  9  17 o 328.7362 5.046143 1317.594       40.42435 1251.705       55.63921 1391.260       58.83161 320.3083 7.128147 337.6912 7.149158 -17.38284      10.09559 
1 1 1 -8  9  18 o 74.04902 3.214111 66.95670       5.786031 75.86153       11.78224 64.12673       6.642104 78.61764 6.200105 72.43300 3.776029 6.184639       7.259456 
1 1 1 -8  9  19 o 334.0834 7.276256 1362.485       59.23780 1248.445       80.50723 1497.121       87.47578 319.3230 10.35962 349.7259 10.27531 -30.40283      14.59122 
1 1 1 -8  9  20 o 146.0591 2.983248 260.0345       10.61828 263.2932       15.34996 257.0443       14.70390 146.8786 4.293179 145.1310 4.161837 1.747635       5.979321 
1 1 1 -8  9  21 o 340.7645 5.217068 1416.888       43.32284 1399.861       61.04016 1434.171       61.49790 338.4661 7.400557 342.5934 7.366228 -4.127350      10.44172 
1 1 1 -8  9  22 o 194.8046 3.467503 462.7394       16.46085 457.9174       23.39601 467.4662       23.16403 193.6463 4.961973 195.7252 4.856588 -2.078888      6.943171 
1 1 1 -8  9  23 o 255.2708 4.163441 795.0386       25.89940 813.9122       37.38200 777.6158       35.91650 258.1044 5.943347 252.2953 5.841827 5.809082       8.333685 
1 1 1 -8  9  24 o 76.92790 2.823391 72.25616       5.283889 72.32183       7.697791 72.19764       7.265986 76.87267 4.124306 76.82487 3.893813 0.4779816E-01  5.672009 
1 1 1 -8  9  25 o 125.2854 2.886461 191.4216       8.812561 189.2421       12.57994 193.5218       12.34895 124.4422 4.154168 125.8537 4.031705 -1.411461      5.788934 
1 1 1 -8  9  26 o 124.8475 3.243315 190.2835       9.859097 201.6727       16.75518 184.2517       12.19348 128.3219 5.369988 122.7819 4.080948 5.539978       6.744695 
1 1 1 -8  9  27 o 251.2571 4.823983 771.5759       29.53657 764.6641       35.97351 785.8757       51.74271 249.9376 5.906295 252.6469 8.415997 -2.709290      10.28170 
1 1 1 -8  9  28 o 106.1003 3.353768 137.5315       8.660439 128.8035       10.39695 157.3126       15.65219 102.5986 4.167091 113.2108 5.691761 -10.61214      7.054132 
1 1 1 -8  9  29 o 231.7425 3.952933 656.0779       22.32345 652.4095       31.66479 659.7029       31.47631 230.7833 5.630359 232.0838 5.565483 -1.300461      7.916788 
1 1 1 -8  9  30 o 182.5722 3.953133 407.3347       17.58783 405.6951       21.66286 410.5058       30.12581 181.9984 4.888837 182.6395 6.780512 -0.6411133     8.359191 
1 1 1 -8  9  31 o 68.25984 3.142442 57.00963       5.213169 50.83342       7.085238 64.30009       7.697876 64.29258 4.551707 72.36750 4.385657 -8.074921      6.320761 
1 1 1 -8  9  32 o 168.3461 3.945078 346.5713       16.18433 329.8946       28.98884 354.1231       19.50759 163.3715 7.299898 169.9740 4.714163 -6.602585      8.689754 
1 1 1 -8  9  33 o 54.73228 3.573137 36.77612       4.739672 36.86274       6.498229 36.67766       6.928232 54.61164 4.936090 54.41566 5.291453 0.1959724      7.236330 
1 1 1 -8  9  34 o 30.09088 5.341961 11.45095       3.773690 10.07554       5.141529 13.05714       5.556164 28.02972 7.414253 31.86360 7.311015 -3.833883      10.41259 
1 1 1 -8  9  35 o 70.26719 3.267591 60.50992       5.579889 54.02582       7.483671 68.62741       8.373380 66.18007 4.670352 74.63531 4.626588 -8.455238      6.574002 
1 1 1 -8  9  36 o 120.3574 4.379050 178.0671       12.82225 0.000000       0.000000 178.0671       12.82225 ?        ?        120.3574 4.379050 0.000000       4.379050 
1 1 1 -8  9  37 o 55.22939 3.705340 37.57616       4.958088 49.47483       7.091480 26.19766       6.934737 63.23167 4.634396 45.49659 6.434175 17.73508       7.929453 
1 1 1 -8  9  38 o 111.3721 3.096795 152.1120       8.396594 153.0711       11.73120 151.1044       12.02334 111.3820 4.330316 110.6180 4.469497 0.7639694      6.223185 
1 1 1 -8  9  39 o 57.85563 3.966629 41.45709       5.558629 39.76131       6.573996 45.71041       10.41138 56.43410 4.826553 59.66319 7.313648 -3.229080      8.762709 
1 1 1 -8  9  40 o 32.38833 5.859538 13.57903       4.454546 17.15022       5.304150 5.032061       8.205689 36.38179 6.205090 23.93258 9.477295 12.44921       11.32794 
1 1 1 -8  9  41 o 51.41826 3.783885 32.96783       4.708025 33.59138       6.362955 32.21345       6.998659 51.41508 5.147610 50.04490 5.848949 1.370190       7.791540 
1 1 1 -8  9  42 o 35.75098 4.663280 16.37284       3.965968 15.54340       5.264849 17.46095       6.030182 34.03843 6.585303 35.85645 7.152146 -1.818020      9.722109 
1 1 1 -8  9  43 o 53.21223 4.660306 36.34969       5.982194 36.64363       11.11991 36.22997       7.096625 49.74636 9.519520 52.52387 5.632321 -2.777508      11.06094 
1 1 1 -8  9  44 o 32.06981 5.386014 13.82917       4.060140 11.63077       5.372407 16.75695       6.199894 28.13459 7.640378 33.86057 7.689684 -5.725981      10.84005 
1 1 1 -8  9  45 o 19.34775 6.911012 5.134212       4.118398 1.873162       5.928463 8.175722       5.725429 17.57006 7.585777 23.19197 8.161700 -5.621910      11.14259 
1 1 1 -8  9  46 o 16.40804 6.407467 3.242452       3.705402 0.8645688      4.783301 6.810594       5.859404 15.24434 6.693556 21.09304 8.106113 -5.848702      10.51251 
1 1 1 -8  9  47 o 15.99850 6.559451 2.876910       4.082875 2.887952       6.484903 2.869658       5.255193 17.68184 7.777753 16.86465 7.209225 0.8171844      10.60502 
1 1 1 -8  9  48 o 16.41001 6.785599 3.518184       4.418365 3.106715       5.199777 4.586967       8.380323 16.49108 7.112023 18.69401 8.483121 -2.202927      11.06997 
1 1 1 -8  9  49 o 16.23566 6.497855 4.050185       3.897486 4.784315       5.490610 3.304569       5.533393 17.25159 7.371634 16.18870 7.150132 1.062891       10.26963 
1 1 1 -8  9  50 o 29.13286 6.310456 14.39382       4.350194 6.484646       6.170592 22.20891       6.133778 17.88114 7.729663 34.36217 7.533212 -16.48104      10.79338 
1 1 1 -8  10 1  o 202.1958 2.855700 498.2005       14.07087 477.0703       19.54397 520.9401       20.27456 197.8491 4.053617 206.7462 4.024184 -8.897110      5.711905 
1 1 1 -8  10 2  o 894.7022 11.44531 9772.856       249.5412 10072.99       402.7964 9585.910       317.8953 906.9633 18.22467 885.5296 14.73143 21.43372       23.43403 
1 1 1 -8  10 3  o 135.4026 2.876416 223.4158       9.491060 213.9349       19.63346 226.3070       10.84206 132.3290 6.104885 136.2734 3.264860 -3.944382      6.923072 
1 1 1 -8  10 4  o 700.1216 9.011711 5979.747       153.7506 6185.166       248.8587 5852.931       195.5325 711.3792 14.35541 692.3821 11.58877 18.99707       18.44932 
1 1 1 -8  10 5  o 173.0222 2.839972 364.8064       11.97435 369.5294       19.26620 361.8336       15.28516 174.0629 4.545961 172.3091 3.640203 1.753784       5.823817 
1 1 1 -8  10 6  o 639.6609 8.258153 4990.573       128.7268 4827.547       199.1287 5107.611       168.7210 628.6514 12.99834 646.8932 10.70288 -18.24182      16.83771 
1 1 1 -8  10 7  o 544.3980 9.158436 3615.684       121.4993 3502.701       206.1670 3675.803       150.3898 534.9190 15.83337 548.7286 11.24669 -13.80957      19.42121 
1 1 1 -8  10 8  o 301.0681 5.409037 1104.921       39.68449 1065.313       47.66829 1194.362       71.63203 295.5897 6.617656 312.7329 9.410049 -17.14316      11.50402 
1 1 1 -8  10 9  o 575.3013 9.646250 4038.609       135.2352 4079.251       166.9021 3960.922       230.7527 577.9738 11.84998 568.6757 16.66921 9.298096       20.45201 
1 1 1 -8  10 10 o 616.7160 10.31387 4642.232       155.0040 4482.104       185.3614 5014.578       282.6556 605.7340 12.55744 639.5613 18.15428 -33.82733      22.07413 
1 1 1 -8  10 11 o 397.9468 5.949275 1930.705       57.69327 1921.813       81.62328 1939.584       81.55798 396.9091 8.438918 398.7426 8.393395 -1.833496      11.90229 
1 1 1 -8  10 12 o 557.1808 8.103178 3787.079       110.0240 3822.336       156.7991 3752.882       154.4231 559.4380 11.50153 554.3400 11.43141 5.098022       16.21612 
1 1 1 -8  10 13 f 686.2807 11.42479 5752.698       191.0672 5674.638       232.1150 5916.749       336.4965 681.1946 13.98286 693.9924 19.91770 -12.79773      24.33588 
1 1 1 -8  10 14 o 46.83211 3.707833 26.89834       4.197048 28.16274       7.709594 26.36579       5.003452 47.56860 6.847861 46.29102 4.491839 1.277584       8.189616 
1 1 1 -8  10 15 o 660.9756 9.550391 5334.034       153.8306 5072.131       210.6159 5633.506       225.2158 643.9100 13.42239 678.5685 13.61975 -34.65851      19.12219 
1 1 1 -8  10 16 o 228.2589 3.817916 635.0659       21.23686 587.3303       29.08594 689.5712       31.08004 219.4719 5.438363 237.8108 5.363075 -18.33893      7.637955 
1 1 1 -8  10 17 o 127.0188 2.847069 196.6265       8.812556 197.2997       12.90482 196.0381       12.06336 127.1510 4.170461 126.7554 3.910079 0.3955460      5.716771 
1 1 1 -8  10 18 o 327.0634 5.839225 1304.871       46.53967 1311.704       82.03527 1301.629       56.51431 327.3635 10.29615 326.5672 7.101495 0.7962646      12.50767 
1 1 1 -8  10 19 o 40.97699 3.936321 20.66042       3.882379 17.21494       5.400084 24.34676       5.585641 37.06171 6.197824 44.36552 5.269238 -7.303810      8.134979 
1 1 1 -8  10 20 o 322.3730 4.980919 1267.805       39.12949 1257.253       55.31569 1278.372       55.35924 320.8300 7.075178 323.5193 7.021886 -2.689392      9.968201 
1 1 1 -8  10 21 o 184.8914 3.359675 416.8007       15.13735 395.1016       21.09895 439.8169       21.72989 179.8868 4.817443 189.8674 4.696463 -9.980637      6.727891 
1 1 1 -8  10 22 o 66.45526 2.892179 53.94391       4.672502 51.65756       6.788659 56.00200       6.440880 64.92692 4.315137 67.64490 3.924122 -2.717979      5.832593 
1 1 1 -8  10 23 o 83.08134 2.781326 84.25270       5.623139 80.23267       8.158006 87.89140       7.761445 80.98216 4.147703 84.79743 3.765374 -3.815269      5.601918 
1 1 1 -8  10 24 o 307.6519 4.825411 1155.922       36.17680 1155.090       51.42907 1156.737       50.89850 307.1774 6.870420 307.4121 6.794350 -0.2347107     9.662601 
1 1 1 -8  10 25 o 125.6307 3.255290 192.6662       9.957618 204.8635       17.02448 186.3236       12.27660 129.3417 5.413280 123.4773 4.085575 5.864349       6.782000 
1 1 1 -8  10 26 o 196.8732 3.539510 472.9965       16.98110 469.1738       24.10387 476.7632       23.92692 195.8528 5.054568 197.4430 4.976859 -1.590256      7.093503 
1 1 1 -8  10 27 o 124.0921 3.457637 188.0838       10.44566 175.0308       12.38810 220.1951       19.43027 119.6286 4.256238 133.9691 5.966628 -14.34052      7.329135 
1 1 1 -8  10 28 o 253.5973 4.193676 785.7713       25.91645 803.6725       37.32195 769.1012       36.01574 256.1045 5.980134 250.5546 5.898667 5.549942       8.399779 
1 1 1 -8  10 29 o 186.7150 3.461954 425.6743       15.75203 422.0606       22.38675 429.2177       22.16833 185.6517 4.952724 187.2371 4.862648 -1.585358      6.940808 
1 1 1 -8  10 30 o 103.2537 3.319368 130.3168       8.341271 134.8964       10.61149 122.9113       13.49392 104.9604 4.156948 99.98223 5.560236 4.978188       6.942366 
1 1 1 -8  10 31 o 119.0348 2.971135 172.9790       8.618517 183.1544       12.50057 163.7600       11.89855 122.2969 4.200719 115.6285 4.229854 6.668320       5.961351 
1 1 1 -8  10 32 o 248.6867 4.890684 757.9207       29.63864 717.9651       51.58100 777.6155       36.21394 240.3333 8.822211 251.5643 5.907322 -11.23106      10.61734 
1 1 1 -8  10 33 o 126.6613 3.074337 195.9807       9.489244 196.6263       13.57286 195.3633       13.27184 126.6230 4.405394 126.2307 4.320868 0.3923340      6.170688 
1 1 1 -8  10 34 o 115.8402 3.073416 164.0978       8.668277 163.4192       12.19951 164.7897       12.31895 115.3914 4.346203 115.8702 4.370641 -0.4788055     6.163764 
1 1 1 -8  10 35 o 34.56815 6.530068 15.24741       5.299306 17.71573       11.34275 14.55820       5.993654 37.14712 11.42246 33.59060 7.510856 3.556519       13.67061 
1 1 1 -8  10 36 f 43.88894 4.119699 23.84180       4.354611 18.85523       5.981719 29.46414       6.351612 38.46737 6.619857 48.57557 5.460186 -10.10820      8.581150 
1 1 1 -8  10 37 o 29.59730 5.647833 11.19397       3.924948 7.825363       5.161093 15.81432       6.044405 24.94664 7.711005 34.93198 7.334512 -9.985340      10.64212 
1 1 1 -8  10 38 o 38.65507 4.603639 18.70165       4.251435 26.19944       5.825415 10.15726       6.218712 45.66402 5.335441 28.03538 8.424846 17.62865       9.972210 
1 1 1 -8  10 39 o 78.55968 3.625761 76.16859       6.922488 73.66495       8.281339 81.97585       12.61248 77.01281 4.431380 80.40480 6.492142 -3.391991      7.860346 
1 1 1 -8  10 40 o 44.73052 4.016193 24.98339       4.331234 23.50297       5.724676 26.96537       6.623803 42.88362 5.612591 45.80238 6.084882 -2.918755      8.278102 
1 1 1 -8  10 41 o 97.68880 3.090825 117.9204       7.348665 108.0847       9.980449 129.5668       10.86038 92.84425 4.423950 101.6900 4.392952 -8.845764      6.234529 
1 1 1 -8  10 42 o 52.51923 3.652471 34.56315       4.645438 34.85262       6.371927 34.23473       6.786980 52.07849 5.085568 51.38625 5.505656 0.6922379      7.495015 
1 1 1 -8  10 43 o 84.50182 3.934902 90.29700       8.080569 94.32072       15.22185 88.71817       9.535002 82.32861 7.675629 83.09108 4.728537 -0.7624741     9.015228 
1 1 1 -8  10 44 o 44.41581 4.177148 25.47995       4.468122 22.37805       5.942011 29.51600       6.777942 40.24187 6.262943 46.39392 6.146212 -6.152050      8.774985 
1 1 1 -8  10 45 o 13.42367 5.900407 0.5232645E-01  3.725916 0.7899074E-01  4.848916 0.1388579E-01  5.822039 15.00400 6.656735 16.09898 7.208207 -1.094975      9.811747 
1 1 1 -8  10 46 o 19.01810 6.628953 5.318133       3.771179 1.410026       5.069746 10.15940       5.642641 15.87884 6.933572 24.58945 8.113557 -8.710615      10.67259 
1 1 1 -8  10 47 o 22.41893 6.671287 8.009170       3.913996 5.178622       5.433620 11.06180       5.642754 18.78094 7.617013 24.92594 8.107264 -6.144991      11.12415 
1 1 1 -8  10 48 o 19.17101 8.361465 6.223753       7.354580 6.223753       7.354580 0.000000       0.000000 19.17101 8.361465 ?        ?        0.000000       8.361465 
1 1 1 -8  10 49 f 19.02066 6.804080 6.492345       3.993429 7.409686       5.608321 5.548873       5.687637 19.26662 7.765546 17.70499 7.532046 1.561628       10.81829 
1 1 1 -8  10 50 o 13.11331 5.913395 1.020964       3.996941 -0.7082385     5.676141 2.721689       5.629206 13.48630 6.400919 15.23464 6.928732 -1.748339      9.432873 
1 1 1 -8  11 1  o 558.9690 7.284479 3810.114       99.22527 3947.995       160.7359 3725.217       126.1263 568.6350 11.59961 552.5583 9.366806 16.07672       14.90932 
1 1 1 -8  11 2  o 744.7654 9.573847 6767.944       173.7569 6649.950       271.3819 6849.920       226.2011 737.4728 15.10076 748.9060 12.39457 -11.43317      19.53607 
1 1 1 -8  11 3  o 336.8553 4.209318 1382.964       34.55343 1367.885       48.68045 1398.275       49.05354 334.9680 5.963692 338.6692 5.943724 -3.701172      8.419827 
1 1 1 -8  11 4  o 595.5649 9.985495 4328.420       144.9221 4488.352       182.3769 4054.419       238.7145 606.2228 12.34530 575.3155 17.04574 30.90729       21.04670 
1 1 1 -8  11 5  o 403.8862 6.032675 1988.695       59.37520 1884.652       81.24080 2107.992       86.99239 393.0713 8.481384 415.7040 8.587386 -22.63272      12.06968 
1 1 1 -8  11 6  o 227.8692 5.410888 632.9590       30.04625 632.9590       30.04625 0.000000       0.000000 227.8692 5.410888 ?        ?        0.000000       5.410888 
1 1 1 -8  11 7  o 358.3987 5.431755 1565.820       47.43978 1503.747       65.59036 1633.913       68.69739 351.1417 7.665165 366.0222 7.701878 -14.88055      10.86617 
1 1 1 -8  11 8  o 711.2189 10.23625 6173.762       177.4110 6015.318       246.5738 6343.827       255.4559 701.4469 14.42501 720.3244 14.55297 -18.87750      20.49072 
1 1 1 -8  11 9  o 387.0810 5.806946 1826.645       54.77542 1822.496       77.62189 1830.760       77.30734 386.5310 8.240695 387.4091 8.188698 -0.8781128     11.61739 
1 1 1 -8  11 10 o 88.56352 3.128022 95.70410       6.740285 82.59576       12.09117 101.6142       8.118800 82.08200 6.088178 91.23787 3.659000 -9.155869      7.103112 
1 1 1 -8  11 11 o 441.6529 6.538817 2378.503       70.37466 2335.593       98.61407 2423.036       100.4613 437.4818 9.250024 445.5959 9.251694 -8.114166      13.08269 
1 1 1 -8  11 12 o 889.7890 12.73527 9676.536       276.1412 9827.249       394.9690 9532.423       386.2231 895.2852 18.10363 881.7924 17.97363 13.49280       25.51064 
1 1 1 -8  11 13 o 200.2395 4.014921 488.7070       19.59128 466.6718       33.51445 500.1454       24.14655 195.4796 7.047028 202.5531 4.891929 -7.073532      8.578553 
1 1 1 -8  11 14 o 265.7274 4.275023 860.7076       27.68286 859.8813       39.43041 861.5108       38.87445 265.5441 6.093385 265.7988 6.001711 -0.2547607     8.552771 
1 1 1 -8  11 15 o 51.25781 3.235220 32.14871       4.020488 36.58736       6.344223 29.16976       5.197390 54.56997 4.820284 48.71652 4.426241 5.853443       6.544215 
1 1 1 -8  11 16 o 194.7139 3.462922 462.1107       16.43144 443.7745       23.13297 480.7824       23.34360 190.7126 4.981822 198.5773 4.823943 -7.864731      6.934621 
1 1 1 -8  11 17 o 238.0460 4.571598 690.9146       26.51948 726.9982       48.61611 675.6295       31.64166 243.8623 8.192500 235.3615 5.516808 8.500839       9.876853 
1 1 1 -8  11 18 o 81.20300 3.129248 80.49326       6.180655 86.94304       8.372356 72.76858       9.162524 84.34618 4.085449 77.08891 4.902792 7.257278       6.381869 
1 1 1 -8  11 19 o 346.3345 5.294263 1463.415       44.68250 1500.547       64.51810 1429.189       61.94180 350.4629 7.554459 342.0432 7.431334 8.419769       10.59691 
1 1 1 -8  11 20 o 340.3935 5.228655 1413.939       43.37180 1341.490       59.65813 1495.158       63.16605 331.3066 7.389301 349.7647 7.410910 -18.45810      10.46534 
1 1 1 -8  11 21 o 115.1572 2.808610 161.6650       7.881676 157.6021       11.36820 165.4256       10.93705 113.5926 4.113610 116.3979 3.861182 -2.805267      5.641854 
1 1 1 -8  11 22 o 302.4249 4.753771 1116.406       35.03418 1104.358       49.50752 1128.491       49.58418 300.5127 6.760397 303.7887 6.697851 -3.275970      9.516521 
1 1 1 -8  11 23 o 257.1061 4.197398 806.7617       26.29836 785.6681       36.94675 828.4237       37.44118 253.5082 5.980646 260.3260 5.901955 -6.817841      8.402452 
1 1 1 -8  11 24 o 108.2361 2.837394 142.9622       7.477446 146.2233       10.94165 140.1046       10.24236 109.3726 4.112565 107.0715 3.932136 2.301079       5.689893 
1 1 1 -8  11 25 f 88.57349 3.144847 95.82267       6.777189 90.96002       10.85818 98.92596       8.674243 86.10835 5.198802 89.93465 3.967699 -3.826302      6.539891 
1 1 1 -8  11 26 o 145.8107 3.625132 259.4982       12.88099 262.6910       15.77730 253.1158       22.30667 146.5772 4.422084 143.6061 6.390205 2.971100       7.771071 
1 1 1 -8  11 27 o 112.2304 2.878447 153.7604       7.865862 154.0290       11.39139 153.5157       10.87461 112.2125 4.173079 112.0441 3.989167 0.1683655      5.773045 
1 1 1 -8  11 28 o 286.9255 4.603392 1006.616       32.18720 1067.979       47.38206 954.0334       43.86076 295.0014 6.591037 278.8611 6.454344 16.14026       9.224984 
1 1 1 -8  11 29 o 102.4081 3.305490 128.1740       8.238292 125.1195       10.31939 133.5417       13.67990 101.0843 4.198372 104.2718 5.402107 -3.187538      6.841716 
1 1 1 -8  11 30 o 101.0370 2.910479 124.7036       7.158601 123.2707       10.13087 126.1325       10.11673 100.3212 4.152960 101.4877 4.099067 -1.166512      5.835189 
1 1 1 -8  11 31 o 206.7437 3.712929 522.4385       18.70618 527.3407       26.77096 517.7615       26.14906 207.3070 5.303597 205.4349 5.227557 1.872177       7.446845 
1 1 1 -8  11 32 o 80.76491 3.679001 79.91367       7.221820 72.35082       14.58118 82.37189       8.313066 76.05177 7.986723 81.93660 4.177175 -5.884834      9.013131 
1 1 1 -8  11 33 o 11.40886 5.280436 -2.902160      3.470257 -3.971056      4.749981 -1.678506      5.082218 13.32768 6.171776 15.40037 6.824718 -2.072688      9.201500 
1 1 1 -8  11 34 o 23.97545 7.553828 7.060273       4.927813 6.855979       10.13663 7.123495       5.638995 27.76145 10.66364 24.47708 8.112300 3.284365       13.39860 
1 1 1 -8  11 35 o 51.12503 4.202465 32.26957       5.189507 27.71447       7.802479 35.88318       6.949502 46.76320 7.067142 53.71749 5.381246 -6.954292      8.882696 
1 1 1 -8  11 36 o 38.88717 4.382111 18.81426       4.080433 18.00085       5.630444 19.71403       5.921782 37.60153 6.372006 39.38653 6.388438 -1.785000      9.023004 
1 1 1 -8  11 37 o 50.46458 3.821101 31.45378       4.664142 29.83822       6.347390 33.34991       6.876525 48.80586 5.428629 51.59770 5.556417 -2.791840      7.768126 
1 1 1 -8  11 38 o 78.17361 3.670931 75.31795       6.973611 71.64371       8.258616 84.44674       13.01760 76.02692 4.477451 81.78673 6.587159 -5.759811      7.964812 
1 1 1 -8  11 39 o 38.18021 5.144488 18.48491       4.664797 21.42921       5.565412 11.53109       8.552997 40.97710 5.729819 29.86336 9.993258 11.11373       11.51938 
1 1 1 -8  11 40 o 17.90875 6.411027 3.587918       3.546058 6.301209       4.675903 -0.8484975E-01 5.440190 22.36450 7.386168 16.77207 7.254018 5.592436       10.35260 
1 1 1 -8  11 41 o 44.18108 4.089842 24.57022       4.353335 24.53605       5.886022 24.61149       6.468163 43.52037 5.685838 43.29837 6.316116 0.2220001      8.498357 
1 1 1 -8  11 42 o 35.18805 4.796697 16.00468       4.006165 17.86080       5.452065 13.82639       5.906305 36.46819 6.366444 31.33463 7.772702 5.133566       10.04721 
1 1 1 -8  11 43 o 19.07979 7.238589 4.208143       4.633581 17.04409       9.143960 -0.2266854     5.374755 32.58886 10.29273 15.98572 7.054275 16.60314       12.47811 
1 1 1 -8  11 44 o 71.93027 3.744577 66.05954       6.541128 55.33115       9.853865 74.51120       8.746014 62.99603 6.512650 75.33019 4.789162 -12.33416      8.083977 
1 1 1 -8  11 45 o 18.68168 6.602789 4.883984       3.750230 7.007956       5.061250 2.298116       5.584529 21.52588 7.664381 17.31204 7.416788 4.213840       10.66543 
1 1 1 -8  11 46 o 11.32916 5.268155 -1.964003      3.516165 0.8773773      4.799277 -5.256445      5.166188 15.12777 6.671209 12.17879 5.866950 2.948986       8.884038 
1 1 1 -8  11 47 f 16.78578 6.545599 3.897710       3.862410 -3.286550      5.306351 11.99312       5.632799 12.97887 6.168374 25.84816 8.066434 -12.86929      10.15461 
1 1 1 -8  11 48 o 15.47858 6.709371 2.546069       4.674665 0.1048930E-02  5.537202 8.860141       8.721666 14.47127 6.688065 20.44760 9.006167 -5.976336      11.21790 
1 1 1 -8  11 49 o 14.36648 6.359598 1.938759       4.401307 2.698127       7.558549 1.549194       5.413811 16.35082 7.643271 14.77624 6.748939 1.574589       10.19646 
1 1 1 -8  11 50 o 11.04911 5.222596 -1.573182      3.704932 -1.249232      5.293586 -1.884237      5.187165 12.87241 6.130009 12.49615 5.982825 0.3762579      8.565700 
1 1 1 -8  12 1  o 166.4255 4.412038 337.8228       17.87772 0.000000       0.000000 337.8228       17.87772 ?        ?        166.4255 4.412038 0.000000       4.412038 
1 1 1 -8  12 2  o 531.3284 7.764925 3443.157       100.5394 3376.846       140.4641 3512.820       143.9691 525.9322 10.95972 536.4113 11.01376 -10.47906      15.53764 
1 1 1 -8  12 3  o 403.0825 6.036375 1980.843       59.29338 2110.130       87.53990 1871.252       80.59673 415.9004 8.637351 391.6629 8.444402 24.23752       12.07939 
1 1 1 -8  12 4  o 538.2433 7.854411 3533.448       103.0216 3528.867       145.7694 3538.019       145.6199 537.6234 11.12633 538.3226 11.10048 -0.6992188     15.71674 
1 1 1 -8  12 5  o 134.9472 2.624927 221.9132       8.632115 219.3064       13.85578 223.5667       11.03535 134.0729 4.246215 135.4443 3.343407 -1.371414      5.404508 
1 1 1 -8  12 6  o 223.1511 4.380424 606.9353       23.82052 603.7501       41.62896 608.4859       29.04562 222.3583 7.694158 223.4187 5.334884 -1.060486      9.362748 
1 1 1 -8  12 7  o 579.2078 7.524778 4091.578       106.2097 3997.280       165.5011 4157.606       138.4892 572.0869 11.87142 583.6743 9.736639 -11.58740      15.35359 
1 1 1 -8  12 8  o 520.2085 6.802786 3299.970       86.23833 3416.627       139.8123 3228.332       109.5635 528.9959 10.84569 514.3964 8.740411 14.59949       13.92924 
1 1 1 -8  12 9  o 239.6552 3.541731 699.9672       20.68419 693.4733       32.80566 704.2521       26.64858 238.4996 5.644494 240.3701 4.549436 -1.870453      7.249668 
1 1 1 -8  12 10 o 712.7778 10.26875 6202.503       178.3643 6268.249       254.4342 6138.972       250.1117 715.8315 14.58574 708.4302 14.48774 7.401306       20.55817 
1 1 1 -8  12 11 f 471.1586 6.951069 2707.403       79.80954 2582.844       109.8222 2846.805       116.1815 459.9773 9.797557 482.9029 9.872817 -22.92566      13.90916 
1 1 1 -8  12 12 o 445.2112 6.598289 2417.327       71.58691 2414.996       101.5871 2419.627       100.8948 444.7896 9.372339 445.2223 9.299416 -0.4326477     13.20303 
1 1 1 -8  12 13 f 600.7931 10.06177 4408.146       147.3111 4306.112       251.4390 4461.472       181.7750 592.1842 17.44268 604.0647 12.34851 -11.88049      21.37131 
1 1 1 -8  12 14 o 106.2899 2.847078 137.7810       7.367771 126.8960       10.71686 147.5367       10.14578 101.9365 4.324036 109.9540 3.792179 -8.017525      5.751340 
1 1 1 -8  12 15 o 259.4915 4.210610 820.8614       26.62589 830.8505       38.33812 811.5542       37.00658 260.9969 6.027805 257.9545 5.887078 3.042480       8.425683 
1 1 1 -8  12 16 o 191.0468 4.855334 445.3474       22.58619 474.3055       34.52830 423.6889       29.86100 197.0018 7.204452 186.2270 6.590384 10.77478       9.764081 
1 1 1 -8  12 17 o 270.7149 4.358943 893.6090       28.75606 900.0052       41.29709 887.5886       40.06531 271.5781 6.240059 269.7074 6.095924 1.870667       8.723453 
1 1 1 -8  12 18 o 242.9537 4.626650 719.9094       27.39216 708.9034       33.74490 741.1719       46.90310 241.0255 5.745250 246.1680 7.828641 -5.142426      9.710588 
1 1 1 -8  12 19 o 599.5933 8.729495 4398.495       127.5505 4426.424       181.4960 4371.241       179.2913 600.2397 12.40813 596.5158 12.33392 3.723877       17.49535 
1 1 1 -8  12 20 o 361.9535 5.514859 1599.388       48.64333 1600.151       69.15170 1598.641       68.43795 361.6811 7.845867 361.5243 7.768253 0.1567688      11.04099 
1 1 1 -8  12 21 o 238.4234 3.984664 693.4687       23.15137 689.3845       33.04744 697.4047       32.44289 237.5698 5.708348 238.9617 5.571281 -1.391907      7.976491 
1 1 1 -8  12 22 o 272.1901 4.388273 904.2639       29.10731 877.4489       40.75428 932.1848       41.58622 267.8892 6.242836 276.1279 6.180208 -8.238678      8.784531 
1 1 1 -8  12 23 o 117.4114 2.863992 168.1087       8.194418 174.6354       12.11336 162.6018       11.12672 119.5411 4.164618 115.3604 3.963874 4.180664       5.749464 
1 1 1 -8  12 24 o 181.3168 4.753556 401.8815       20.98544 394.2523       28.56892 410.8221       30.92692 179.3239 6.548617 182.9879 6.948130 -3.664032      9.547821 
1 1 1 -8  12 25 o 93.12334 2.854871 105.8705       6.470948 114.0509       9.616903 99.10246       8.747377 96.56081 4.096245 90.00735 3.998056 6.553467       5.723957 
1 1 1 -8  12 26 o 192.4736 4.121024 452.4594       19.32913 438.2129       23.21728 484.6351       34.89159 189.2418 5.039005 198.5843 7.222105 -9.342499      8.806269 
1 1 1 -8  12 27 o 136.8970 3.036097 228.6769       10.12851 222.5995       14.50639 234.4578       14.14808 134.8849 4.419230 138.4622 4.197901 -3.577332      6.095241 
1 1 1 -8  12 28 o 71.96461 2.992740 63.30951       5.236911 71.12875       7.771151 56.80439       7.088109 76.17248 4.202789 68.03529 4.297189 8.137184       6.010763 
1 1 1 -8  12 29 o 19.82375 6.434884 4.666719       3.555851 9.225091       4.797890 -0.8882370     5.296460 26.91516 7.181942 16.36986 7.118311 10.54530       10.11191 
1 1 1 -8  12 30 o 141.5744 3.123004 244.7304       10.77441 244.9815       15.44451 244.4923       15.03823 141.4189 4.487255 141.2964 4.372729 0.1225128      6.265478 
1 1 1 -8  12 31 o 84.22610 3.586428 86.85729       7.344289 103.2979       15.43238 82.04356       8.350539 91.28780 6.990376 81.77908 4.204327 9.508720       8.157310 
1 1 1 -8  12 32 f 59.65248 3.434468 43.63649       4.971464 53.02439       7.444364 36.07940       6.679144 65.61193 4.686820 53.98740 5.138727 11.62453       6.955055 
1 1 1 -8  12 33 o 149.7670 3.254710 274.1747       11.87858 274.2559       17.12984 274.0994       16.48633 149.4559 4.709192 149.4552 4.531884 0.6408691E-03  6.535631 
1 1 1 -8  12 34 o 26.65555 6.255849 9.120602       3.993358 7.597326       5.423278 10.92465       5.901960 24.90570 7.934106 29.16512 8.043887 -4.259422      11.29841 
1 1 1 -8  12 35 o 49.10017 4.176834 29.79003       4.950262 26.97402       7.542964 31.92044       6.560796 46.12729 6.923951 50.60961 5.403184 -4.482327      8.782681 
1 1 1 -8  12 36 f 33.29583 5.240191 14.00546       4.111446 15.56592       5.523697 12.06695       6.156578 34.79727 6.757671 30.45117 8.140072 4.346094       10.57955 
1 1 1 -8  12 37 f 55.66626 3.596641 38.20419       4.852824 38.05503       6.779094 38.36097       6.949954 55.23420 5.093829 55.42920 5.206208 -0.1949921     7.283660 
1 1 1 -8  12 38 o 52.33426 4.231964 34.03780       5.351145 32.50210       6.297771 38.02562       10.14849 50.89285 5.148764 54.09432 7.934377 -3.201473      9.458547 
1 1 1 -8  12 39 o 34.47706 4.696155 15.04867       3.843097 14.00353       5.282154 16.22414       5.601843 32.60107 6.866060 35.17794 6.780512 -2.576866      9.649773 
1 1 1 -8  12 40 o 80.97748 3.116398 80.99195       6.138212 82.97208       8.735045 79.06031       8.627440 81.41220 4.419479 79.43790 4.474841 1.974304       6.289356 
1 1 1 -8  12 41 o 14.25045 5.873146 1.049073       3.295300 -4.616338      4.422994 8.117273       4.940320 12.04438 5.696995 24.50962 7.538716 -12.46524      9.449232 
1 1 1 -8  12 42 o 32.34044 5.159915 13.72971       3.929969 13.28653       5.349738 14.24924       5.792228 30.82925 7.244375 31.77417 7.585809 -0.9449120     10.48930 
1 1 1 -8  12 43 o 71.52585 4.116245 65.41054       7.144341 78.84219       13.89801 60.58639       8.329095 74.28944 7.792817 68.02042 5.061111 6.269012       9.292085 
1 1 1 -8  12 44 o 18.73748 6.807842 4.645594       4.016550 4.243229       5.896864 4.993830       5.485893 19.48177 7.922587 19.91232 7.790409 -0.4305477     11.11116 
1 1 1 -8  12 45 o 25.06032 6.321795 9.319200       3.859736 10.98199       5.236509 7.341196       5.711331 26.16032 7.699178 21.71677 8.079017 4.443556       11.16010 
1 1 1 -8  12 46 o 11.12046 5.221956 -2.439762      3.596416 0.7196633      5.108643 -5.544031      5.063854 15.24143 6.793107 11.85857 5.736225 3.382862       8.891039 
1 1 1 -8  12 47 o 26.94883 7.039580 12.06137       4.672793 10.05370       5.731285 16.04203       8.070178 23.19312 8.165559 26.96142 9.669209 -3.768303      12.65583 
1 1 1 -8  12 48 o 18.16756 7.041065 5.650962       4.447948 2.645751       5.683083 10.40242       7.145947 15.99129 7.143556 21.58890 8.742675 -5.597615      11.29003 
1 1 1 -8  12 49 o 10.96430 5.217891 -2.268255      3.822586 -9.345051      5.620086 3.824129       5.214567 10.61816 5.302135 16.07040 7.024255 -5.452247      8.800727 
1 1 1 -8  12 50 o 14.93528 6.507414 3.187922       4.444944 -4.737569      7.715885 7.124537       5.437936 13.34761 6.585484 18.17897 7.523504 -4.831359      9.998586 
1 1 1 -8  13 1  o 324.9532 4.484169 1287.069       35.50904 1228.138       54.39511 1330.831       46.87466 317.3446 7.033842 330.3914 5.822014 -13.04675      9.130760 
1 1 1 -8  13 2  o 383.9798 5.180276 1797.325       48.47271 1775.652       62.29950 1830.573       77.16243 381.5974 6.699511 387.3797 8.173968 -5.782318      10.56869 
1 1 1 -8  13 3  o 300.1768 4.218065 1098.235       30.85507 1117.422       49.46917 1086.018       39.47452 302.7158 6.705998 298.4722 5.427213 4.243652       8.626995 
1 1 1 -8  13 4  f 522.6169 6.849314 3330.657       87.23016 3432.460       140.6363 3267.004       111.2060 530.2117 10.88459 517.4591 8.818936 12.75262       14.00885 
1 1 1 -8  13 5  o 354.0846 5.414687 1528.429       46.72146 1541.885       66.54292 1515.346       65.61510 355.5465 7.680143 352.4754 7.639042 3.071136       10.83234 
1 1 1 -8  13 6  o 396.8200 5.329766 1919.617       51.53921 1867.677       80.22018 1956.126       67.25640 391.2659 8.413477 400.5071 6.891079 -9.241211      10.87537 
1 1 1 -8  13 7  o 345.5000 5.288474 1455.206       44.52608 1428.390       88.62008 1464.262       51.49826 341.8696 10.65039 346.5441 6.098148 -4.674469      12.27266 
1 1 1 -8  13 8  f 423.2453 6.309975 2184.321       65.08125 2134.523       90.88851 2236.721       93.23386 418.2365 8.917662 428.1303 8.936378 -9.893860      12.62472 
1 1 1 -8  13 9  o 463.3730 6.125021 2618.109       69.16309 2669.100       111.1376 2585.879       88.35761 467.5991 9.753290 460.4012 7.875378 7.197876       12.53588 
1 1 1 -8  13 10 o 567.0197 7.384971 3921.857       102.0430 3852.135       159.6729 3969.992       132.6707 561.4838 11.66965 570.2733 9.546760 -8.789490      15.07718 
1 1 1 -8  13 11 o 228.6213 3.860880 637.0623       21.50993 636.0864       30.79929 637.9915       30.05369 228.4066 5.533450 228.7523 5.391335 -0.3456726     7.725643 
1 1 1 -8  13 12 o 623.4001 10.43293 4747.450       158.4928 4650.633       271.2130 4797.660       195.3140 615.1569 18.11180 626.2810 12.79759 -11.12415      22.17692 
1 1 1 -8  13 13 o 187.3615 3.425693 427.8579       15.64102 442.2976       22.97593 415.3864       21.35264 190.4008 4.956073 184.5235 4.752535 5.877258       6.866531 
1 1 1 -8  13 14 o 766.1957 12.75795 7186.897       238.2082 7036.013       407.2658 7265.356       293.6824 754.2038 22.18326 769.4456 15.66260 -15.24182      27.15537 
1 1 1 -8  13 15 o 250.2774 4.759227 763.7965       29.02647 703.4813       49.21580 795.9666       35.94323 239.8514 8.433397 255.4482 5.774018 -15.59680      10.22064 
1 1 1 -8  13 16 o 423.2704 6.323691 2186.334       65.22659 2250.767       94.41923 2127.514       90.21310 429.1164 9.029199 417.2244 8.872865 11.89206       12.65915 
1 1 1 -8  13 17 o 505.1295 8.577757 3119.387       105.5875 3146.643       130.5199 3067.769       179.6192 506.8923 10.56635 499.0753 14.78529 7.817017       18.17285 
1 1 1 -8  13 18 f 426.7845 6.376687 2224.160       66.31928 2167.413       92.66453 2283.750       94.95672 420.8452 9.035559 431.9955 9.020081 -11.15024      12.76727 
1 1 1 -8  13 19 o 349.6638 5.363231 1492.410       45.69969 1451.793       63.95969 1534.773       65.32002 344.5582 7.617415 354.2769 7.566018 -9.718658      10.73637 
1 1 1 -8  13 20 o 174.8815 3.314532 372.9454       14.12545 381.7419       20.58335 365.1150       19.42017 176.7904 4.782118 172.9092 4.613036 3.881180       6.644453 
1 1 1 -8  13 21 o 282.6243 4.520281 974.9641       31.13229 946.8011       43.67281 1004.061       44.39141 278.2609 6.440550 286.5648 6.356821 -8.303955      9.049301 
1 1 1 -8  13 22 o 134.5878 2.976702 220.9008       9.762861 225.2755       14.35665 217.1376       13.31559 135.7778 4.344577 133.3212 4.103387 2.456558       5.976047 
1 1 1 -8  13 23 f 198.2309 4.178054 479.7171       20.18280 466.5505       24.35337 508.5923       36.06506 195.3308 5.120671 203.5834 7.281287 -8.252579      8.901596 
1 1 1 -8  13 24 o 79.50781 3.109624 77.23174       6.013337 71.64426       9.895467 80.50320       7.571781 76.36317 5.351483 81.12076 3.841186 -4.757584      6.587343 
1 1 1 -8  13 25 o 41.16431 4.850859 20.99558       4.772713 24.57433       5.724705 12.83828       8.642921 44.50251 5.388379 32.28074 9.978731 12.22177       11.34062 
1 1 1 -8  13 26 o 182.6868 3.437494 407.3735       15.30331 404.4594       21.84795 410.1803       21.44205 181.7947 4.936232 183.0970 4.809781 -1.302338      6.892052 
1 1 1 -8  13 27 o 242.4203 4.078070 718.0309       24.09128 720.0757       34.45615 716.0753       33.69696 242.4162 5.832692 241.7680 5.719471 0.6481781      8.169005 
1 1 1 -8  13 28 o 126.9098 3.412147 196.8076       10.54301 196.8795       13.44034 196.6926       16.99890 126.8188 4.355474 126.5795 5.524186 0.2392654      7.034685 
1 1 1 -8  13 29 f 146.5424 3.135756 262.1831       11.19803 270.8447       16.46260 254.7245       15.27663 148.7103 4.548123 144.2444 4.351002 4.465881       6.294176 
1 1 1 -8  13 30 o 24.65418 5.930288 7.762542       3.519209 13.69752       5.277375 3.009896       4.722545 32.76043 6.832000 18.98824 7.282428 13.77218       9.985489 
1 1 1 -8  13 31 o 118.6062 3.589094 172.1114       10.36164 158.4796       19.56461 177.4254       12.21545 113.1140 7.134058 120.3388 4.171813 -7.224876      8.264309 
1 1 1 -8  13 32 o 180.4025 3.480490 397.8984       15.30098 397.5812       21.98052 398.1966       21.31263 179.9323 5.017842 180.1151 4.860131 -0.1827240     6.985672 
1 1 1 -8  13 33 o 131.3925 3.130800 211.0202       10.02448 208.8807       14.35610 213.0560       14.00397 130.4237 4.523786 131.7568 4.367601 -1.333099      6.288130 
1 1 1 -8  13 34 o 74.25585 3.531135 67.64080       6.371403 56.70954       9.861923 75.47227       8.347335 67.51035 6.058901 78.30673 4.391941 -10.79638      7.483276 
1 1 1 -8  13 35 o 71.65100 3.237082 62.96741       5.637531 61.15710       7.862448 64.88293       8.087667 70.37260 4.610161 72.49489 4.601794 -2.122292      6.513838 
1 1 1 -8  13 36 f 48.21071 3.961745 28.74255       4.613398 28.91739       6.286808 28.53855       6.790983 48.04338 5.466963 47.59485 5.987313 0.4485283      8.107750 
1 1 1 -8  13 37 o 65.43651 3.368219 52.70084       5.352944 48.77628       7.386657 57.04127       7.768156 62.59756 4.880885 67.76237 4.734058 -5.164806      6.799584 
1 1 1 -8  13 38 o 48.40918 5.462897 29.61640       6.332035 29.61640       6.332035 0.000000       0.000000 48.40918 5.462897 ?        ?        0.000000       5.462897 
1 1 1 -8  13 39 o 116.3371 3.130161 166.7668       8.865967 155.0695       12.30632 179.3901       12.78407 111.4953 4.538832 120.0288 4.378001 -8.533470      6.306179 
1 1 1 -8  13 40 o 54.65218 3.640276 37.22161       4.820533 37.86115       6.719439 36.54343       6.919488 54.54192 5.115220 53.45477 5.385242 1.087151       7.427403 
1 1 1 -8  13 41 o 74.49266 3.280638 69.04861       5.940752 64.83127       8.222283 73.65477       8.592955 71.36662 4.754945 76.15391 4.652558 -4.787285      6.652503 
1 1 1 -8  13 42 o 31.97725 6.491743 14.04885       4.885718 14.49226       9.725416 13.89917       5.650482 30.46826 10.64369 31.25113 7.512722 -0.7828770     13.02801 
1 1 1 -8  13 43 o 22.01087 6.898053 6.865236       4.114703 4.242001       6.389264 8.724167       5.378533 20.17908 8.231519 24.34799 7.914880 -4.168913      11.41942 
1 1 1 -8  13 44 o 25.46850 6.140387 9.338411       3.766198 11.10968       5.459438 7.730074       5.202280 26.63623 7.867178 22.58307 7.790383 4.053156       11.07170 
1 1 1 -8  13 45 o 14.10874 5.938320 1.397371       3.473256 6.343799       4.960760 -3.358968      4.864506 20.44021 7.543188 12.70182 5.997916 7.738389       9.637151 
1 1 1 -8  13 46 o 47.75655 4.163416 30.65885       4.796891 29.89038       6.918758 31.37016       6.656496 44.22448 6.623490 46.01618 6.085071 -1.791698      8.994370 
1 1 1 -8  13 47 o 10.88479 5.238383 -3.917526      4.094530 -3.552533      5.244583 -4.487254      6.552443 12.58483 6.022748 13.59538 6.563797 -1.010543      8.908251 
1 1 1 -8  13 48 o 15.06324 6.501974 2.638916       4.353478 0.4647374      5.547568 6.124294       7.023926 14.44250 6.681655 18.31153 8.073103 -3.869031      10.47948 
1 1 1 -8  13 49 o 14.66965 6.237620 2.881369       3.897324 6.764411       5.963584 -0.1332792E-01 5.149000 18.13714 7.714127 13.51709 6.315290 4.620048       9.969485 
1 1 1 -8  14 1  f 686.9690 8.871054 5758.904       148.5075 5863.459       237.2284 5691.524       190.4396 692.3833 14.05996 682.5938 11.44877 9.789551       18.13165 
1 1 1 -8  14 2  o 469.6496 6.944062 2690.015       79.47374 2379.015       146.7551 2819.066       94.53561 440.8728 13.67633 480.7055 8.070125 -39.83270      15.87982 
1 1 1 -8  14 3  o 357.1935 4.453854 1555.170       38.76820 1506.448       53.77414 1607.902       55.94322 351.4880 6.278079 363.1290 6.321940 -11.64099      8.909613 
1 1 1 -8  14 4  o 211.5440 5.314561 545.9046       27.37539 528.4721       38.47656 563.7753       38.95720 208.0071 7.603499 214.8614 7.451626 -6.854340      10.64612 
1 1 1 -8  14 5  o 828.5143 10.63400 8382.244       214.7004 8503.882       343.1292 8303.979       275.2381 833.1099 16.90126 824.0394 13.70644 9.070496       21.76049 
1 1 1 -8  14 6  o 484.5152 7.141002 2863.256       84.31458 2854.258       119.2712 2872.246       119.2064 483.5066 10.12272 485.0314 10.08541 -1.524811      14.28933 
1 1 1 -8  14 7  o 447.4163 5.940348 2440.858       64.76790 2478.838       103.7237 2416.585       82.92065 450.6360 9.445305 445.0809 7.645178 5.555054       12.15165 
1 1 1 -8  14 8  o 363.6167 5.535799 1612.041       49.05239 1693.015       101.9067 1587.621       55.96199 372.0904 11.25168 360.8144 6.364630 11.27594       12.92706 
1 1 1 -8  14 9  o 507.6278 6.666471 3142.867       82.46648 3202.367       132.3395 3105.096       105.4413 512.0233 10.60629 504.4049 8.578187 7.618408       13.64107 
1 1 1 -8  14 10 o 876.3541 11.23759 9385.463       239.9876 9757.296       390.1187 9159.081       304.3991 891.4932 17.95737 864.8847 14.44272 26.60846       23.04472 
1 1 1 -8  14 11 o 408.1721 5.474999 2031.524       54.45823 2112.251       88.67888 1982.646       69.00229 415.9583 8.748513 403.1335 7.023904 12.82489       11.21926 
1 1 1 -8  14 12 o 207.1598 4.184573 523.1521       21.12481 516.5624       37.04427 526.3278       25.71601 205.6120 7.405363 207.7638 5.079226 -2.151779      8.979863 
1 1 1 -8  14 13 o 270.1039 5.033043 889.6243       33.12817 898.0394       58.66888 885.6852       40.13974 271.0090 8.895631 269.4553 6.112963 1.553772       10.79354 
1 1 1 -8  14 14 o 444.9903 7.644672 2417.667       82.89828 2612.699       152.2289 2335.449       98.83910 461.3853 13.55402 437.1470 9.278231 24.23834       16.42550 
1 1 1 -8  14 15 f 469.9644 6.960653 2696.405       79.71703 2754.853       114.6304 2641.665       110.9342 474.5545 9.912372 464.7249 9.795657 9.829651       13.93593 
1 1 1 -8  14 16 o 495.2922 8.436315 2998.967       101.8240 2971.546       124.4539 3054.490       177.0912 492.6060 10.36747 498.0009 14.60832 -5.394958      17.91333 
1 1 1 -8  14 17 o 112.0236 3.333472 153.1331       9.089898 149.4646       11.78724 158.5159       14.27801 110.6119 4.381617 113.8619 5.159208 -3.249985      6.768751 
1 1 1 -8  14 18 o 319.7970 5.748376 1248.683       44.79770 1250.407       55.45458 1245.445       76.00304 319.8421 7.114848 318.6080 9.800653 1.234161       12.11090 
1 1 1 -8  14 19 o 363.4284 5.553200 1612.946       49.18110 1673.914       71.51486 1558.238       67.74344 369.8011 7.935823 356.8243 7.790704 12.97684       11.12081 
1 1 1 -8  14 20 o 274.9934 4.437065 922.9417       29.73405 951.4292       43.24670 897.4021       40.94800 278.9600 6.361726 270.9468 6.201725 8.013184       8.884421 
1 1 1 -8  14 21 o 214.2005 3.733005 559.7982       19.48566 593.5446       28.84152 531.4592       26.42992 220.4040 5.369854 208.5765 5.199892 11.82750       7.474905 
1 1 1 -8  14 22 o 270.1664 6.275381 893.1178       41.31497 893.1178       41.31497 0.000000       0.000000 270.1664 6.275381 ?        ?        0.000000       6.275381 
1 1 1 -8  14 23 o 265.8221 4.942360 863.4550       32.01560 856.4706       55.01433 867.0317       39.36871 263.8495 8.567607 266.1776 6.069369 -2.328064      10.49958 
1 1 1 -8  14 24 o 123.1963 2.952927 185.1368       8.865162 177.1637       12.70519 192.7018       12.37576 120.3580 4.338917 125.5608 4.049954 -5.202805      5.935346 
1 1 1 -8  14 25 f 177.8084 3.992710 386.1114       17.30040 378.8054       20.94507 401.7988       30.69153 175.9497 4.889658 180.8254 6.978129 -4.875717      8.520741 
1 1 1 -8  14 26 o 217.9278 3.813896 580.0214       20.25432 556.9334       28.48119 603.6447       28.80951 213.2117 5.486204 222.0764 5.323501 -8.864700      7.644482 
1 1 1 -8  14 27 o 177.7401 3.408415 385.7234       14.76298 387.0118       21.31558 384.5356       20.46633 177.7696 4.925181 177.2321 4.742987 0.5374908      6.837641 
1 1 1 -8  14 28 o 108.6720 3.353281 144.3474       8.869595 148.7383       11.55202 138.0415       13.84372 110.2023 4.309921 106.0051 5.376637 4.197220       6.890838 
1 1 1 -8  14 29 o 149.0611 3.190234 271.3267       11.58839 258.4090       16.52850 283.8158       16.25191 145.2116 4.676950 152.2418 4.385178 -7.030136      6.411212 
1 1 1 -8  14 30 o 158.9367 3.309849 308.5939       12.81942 291.8102       18.36750 324.5347       17.90032 154.2400 4.892903 162.7454 4.517898 -8.505386      6.659722 
1 1 1 -8  14 31 o 65.59961 3.906716 52.83059       6.216953 40.96809       12.93296 56.39554       7.089842 56.53301 9.739170 67.72961 4.318069 -11.19659      10.65350 
1 1 1 -8  14 32 o 23.17304 6.454553 6.817766       3.779515 2.204612       5.390075 11.27991       5.301118 19.03518 7.633539 29.61120 7.374492 -10.57602      10.61386 
1 1 1 -8  14 33 o 75.40070 3.220653 69.64327       5.904102 76.98602       8.731045 63.45667       8.014252 79.08033 4.549868 71.76155 4.607183 7.318779       6.475140 
1 1 1 -8  14 34 o 79.76978 3.483943 78.05336       6.756113 71.50226       10.75058 82.32943       8.685548 75.87119 5.859971 81.77515 4.374446 -5.903961      7.312663 
1 1 1 -8  14 35 o 96.60135 3.111973 114.3456       7.316242 114.4621       10.46737 114.2343       10.23017 96.36404 4.469624 96.29202 4.371095 0.7202911E-01  6.251721 
1 1 1 -8  14 36 o 95.58872 3.143494 112.0945       7.312474 106.9452       10.36801 117.1913       10.31499 93.00626 4.588704 97.43842 4.355134 -4.432167      6.326405 
1 1 1 -8  14 37 o 26.06882 6.220903 8.844447       3.896752 7.241015       5.348838 10.65800       5.688511 24.14871 7.895900 28.47998 7.913301 -4.331270      11.17880 
1 1 1 -8  14 38 f 69.47459 4.674991 60.27715       7.868776 60.27715       7.868776 0.000000       0.000000 69.47459 4.674991 ?        ?        0.000000       4.674991 
1 1 1 -8  14 39 o 68.79865 3.336437 58.57579       5.577019 51.79940       7.574369 66.59952       8.242057 64.11820 4.884382 72.84563 4.667530 -8.727425      6.755962 
1 1 1 -8  14 40 o 19.05726 6.563756 4.429391       3.692506 1.611352       5.110010 7.508734       5.341673 17.49907 7.272102 23.89613 7.894613 -6.397060      10.73352 
1 1 1 -8  14 41 o 23.10230 6.269206 7.250567       3.618693 7.188490       5.232602 7.307472       5.009870 23.16753 7.816922 23.25147 7.643824 -0.8394432E-01 10.93308 
1 1 1 -8  14 42 o 43.53597 5.179867 24.95414       5.387821 17.02214       10.27233 27.96432       6.328106 32.06321 10.95084 45.69171 5.814844 -13.62850      12.39892 
1 1 1 -8  14 43 o 14.56470 6.241018 0.7836028      3.955714 -5.192413      5.870639 5.753156       5.353505 13.64280 6.485104 20.75784 7.801550 -7.115039      10.14499 
1 1 1 -8  14 44 o 22.47960 6.539729 7.511230       3.797148 5.485816       5.236352 9.757440       5.514386 19.89706 7.658743 24.66556 8.013928 -4.768501      11.08510 
1 1 1 -8  14 45 o 17.95651 6.608374 4.561411       3.802976 7.166935       5.390917 1.980287       5.365614 21.18979 7.855514 16.50675 7.171360 4.683043       10.63661 
1 1 1 -8  14 46 o 15.15643 6.493435 1.960615       4.280771 3.414411       5.301919 -0.7619075     7.255496 17.12170 7.277601 16.03374 7.492898 1.087959       10.44543 
1 1 1 -8  14 47 o 20.87083 6.921387 7.524762       4.104706 11.69612       6.135437 4.145022       5.522661 23.98084 8.448082 17.20141 7.372617 6.779427       11.21274 
1 1 1 -8  14 48 o 18.31584 7.221975 6.192879       4.746326 10.05606       6.058101 0.5243598E-01  7.637719 21.39191 8.236848 15.40305 7.342995 5.988865       11.03473 
1 1 1 -8  14 49 o 11.83609 5.456554 -0.2812606     3.652709 -1.672242      5.924540 0.5717109      4.639394 13.25741 6.359654 13.35050 6.152844 -0.9309578E-01 8.848881 
1 1 1 -8  15 1  f 250.0145 4.109104 761.8990       25.03505 725.8771       47.95788 775.3922       29.35175 243.7699 8.084348 252.2023 4.775829 -8.432449      9.389634 
1 1 1 -8  15 2  o 229.7385 3.854766 643.3003       21.58081 617.9572       29.78893 671.2930       31.30742 225.1319 5.429773 234.6452 5.475194 -9.513245      7.711043 
1 1 1 -8  15 3  o 132.9190 3.383058 215.4610       10.94912 201.3739       18.25868 223.3712       13.68213 128.3772 5.851794 135.3085 4.154391 -6.931290      7.176521 
1 1 1 -8  15 4  o 212.4693 3.334635 550.1788       17.26556 559.2512       22.44818 537.0389       27.01572 214.1967 4.300633 209.8117 5.288067 4.384995       6.816092 
1 1 1 -8  15 5  o 337.3980 5.200158 1387.879       42.75581 1326.153       82.85434 1410.282       49.91532 329.3578 10.33592 340.0755 6.023133 -10.71768      11.96283 
1 1 1 -8  15 6  o 483.2667 6.382901 2848.270       75.16940 2949.494       121.9361 2786.221       95.46754 491.4287 10.18206 477.8305 8.198716 13.59827       13.07261 
1 1 1 -8  15 7  o 343.8572 4.743813 1441.424       39.75042 1393.680       61.86306 1474.998       51.87729 337.9802 7.511108 347.7778 6.121239 -9.797607      9.689495 
1 1 1 -8  15 8  o 426.5230 6.372886 2218.824       66.23914 2248.384       94.79298 2190.617       92.59817 429.1367 9.064511 423.5967 8.970440 5.540009       12.75281 
1 1 1 -8  15 9  o 184.6530 3.070405 415.5517       13.81619 445.7195       23.04179 398.6163       17.26399 191.1369 4.951097 180.8374 3.917572 10.29955       6.313536 
1 1 1 -8  15 10 o 293.6260 5.373951 1051.342       38.45247 1141.425       70.97019 1013.909       45.74953 305.5349 9.543595 288.2970 6.511940 17.23788       11.55360 
1 1 1 -8  15 11 o 512.9348 10.64524 3216.761       133.0619 0.000000       0.000000 3216.761       133.0619 ?        ?        512.9348 10.64524 0.000000       10.64524 
1 1 1 -8  15 12 o 198.7140 4.112628 481.4046       19.91517 530.2736       37.19096 461.7583       23.58093 208.2984 7.338283 194.5276 4.978524 13.77071       8.867700 
1 1 1 -8  15 13 o 492.9113 7.277562 2966.285       87.41596 3071.934       126.9501 2871.023       120.5479 501.0912 10.39633 484.4628 10.21088 16.62842       14.57209 
1 1 1 -8  15 14 o 240.8353 4.036447 707.2138       23.68947 709.9481       34.08501 704.6589       32.94786 241.2104 5.798708 240.3204 5.626010 0.8900146      8.079418 
1 1 1 -8  15 15 o 265.2952 4.323120 858.3454       27.94878 840.1506       39.48651 876.6123       39.56469 262.3436 6.176496 267.9853 6.058437 -5.641754      8.651807 
1 1 1 -8  15 16 o 258.7471 4.894060 816.8410       30.85893 805.6998       38.04146 838.2795       52.77019 256.8835 6.076938 261.6650 8.286185 -4.781494      10.27570 
1 1 1 -8  15 17 o 241.1555 4.039515 709.3382       23.73900 695.8779       33.66198 722.6556       33.48278 238.7257 5.786345 243.2878 5.647614 -4.562119      8.085626 
1 1 1 -8  15 18 o 439.3388 6.565626 2359.319       70.29296 2395.358       100.8105 2325.216       98.06485 441.9577 9.360285 435.4743 9.240910 6.483368       13.15330 
1 1 1 -8  15 19 o 307.0789 4.843585 1151.247       36.24540 1167.302       52.08350 1136.170       50.47196 308.8939 6.919181 304.7687 6.795849 4.125183       9.698383 
1 1 1 -8  15 20 o 476.6574 7.079349 2781.644       82.23103 2725.642       115.1446 2839.935       117.4749 470.6983 10.03841 480.4681 10.03332 -9.769806      14.19285 
1 1 1 -8  15 21 o 258.8239 4.986703 818.3959       31.45241 819.8591       38.54947 815.4822       54.39741 258.8838 6.110511 257.5307 8.680289 1.353058       10.61536 
1 1 1 -8  15 22 o 67.40921 3.078777 55.54240       5.044120 46.88033       7.546096 62.53883       6.781872 61.73159 5.060630 71.47299 3.908659 -9.741398      6.394340 
1 1 1 -8  15 23 o 146.7725 3.487319 262.8852       12.47304 267.0792       21.59518 260.7856       15.27940 147.5930 6.016813 146.0641 4.297334 1.528885       7.393857 
1 1 1 -8  15 24 o 173.5074 3.958932 367.6205       16.73910 375.3367       20.68832 352.9930       28.48435 175.1556 4.851585 169.5009 6.910506 5.654709       8.443517 
1 1 1 -8  15 25 o 210.2282 3.729650 539.6703       19.10712 536.8022       27.42009 542.3774       26.63989 209.3563 5.379062 210.5413 5.192291 -1.184982      7.476242 
1 1 1 -8  15 26 o 49.66551 3.469342 30.26302       4.172520 26.43900       6.219784 33.39220       5.626404 46.11692 5.652565 52.07056 4.477507 -5.953648      7.211071 
1 1 1 -8  15 27 f 158.5344 3.713908 307.0334       14.34798 321.7932       18.65821 285.6752       22.44465 162.1013 4.728375 152.4752 6.052592 9.626083       7.680586 
1 1 1 -8  15 28 o 23.38221 6.008263 6.965466       3.441741 5.779419       5.141306 7.928583       4.632998 22.60724 7.746584 25.08628 7.201496 -2.479042      10.57691 
1 1 1 -8  15 29 o 267.4969 5.140563 877.1357       33.50931 916.2144       61.81235 860.8711       39.87754 271.3533 9.361705 264.6494 6.183316 6.703918       11.21940 
1 1 1 -8  15 30 o 49.65754 4.500019 30.44318       5.386416 27.11733       11.49543 31.37882       6.097189 45.66148 10.54389 50.33926 5.037966 -4.677784      11.68566 
1 1 1 -8  15 31 o 99.47893 3.054857 121.0114       7.396787 122.0574       10.92527 120.1261       10.05065 99.69917 4.508477 98.96002 4.177111 0.7391510      6.146106 
1 1 1 -8  15 32 o 121.6231 3.093336 180.9116       9.160658 179.8919       13.27892 181.8376       12.65392 121.0251 4.510368 121.7281 4.272401 -0.7029953     6.212635 
1 1 1 -8  15 33 o 126.9749 3.487762 197.4679       10.78175 213.2459       18.65439 189.5532       13.21204 131.3490 5.842606 124.2180 4.371460 7.130920       7.296966 
1 1 1 -8  15 34 o 54.97143 3.636089 37.19213       4.843511 37.74460       7.217821 36.73954       6.532810 55.04102 5.452851 54.39567 4.983652 0.6453552      7.387176 
1 1 1 -8  15 35 o 13.62270 5.907804 -0.4600505     3.628033 0.7426463      5.202539 -1.598635      5.061974 17.36036 7.284942 15.33246 6.801991 2.027903       9.966818 
1 1 1 -8  15 36 o 113.9152 3.122368 159.2405       8.659481 156.8089       12.43936 161.5269       12.06206 112.5975 4.542822 114.3567 4.336219 -1.759178      6.280129 
1 1 1 -8  15 37 o 85.88945 4.599976 91.71960       9.592776 91.71960       9.592776 0.000000       0.000000 85.88945 4.599976 ?        ?        0.000000       4.599976 
1 1 1 -8  15 38 o 63.83498 3.468779 50.42148       5.375720 48.93444       7.534864 51.96306       7.671818 62.37366 4.999040 64.31175 4.932871 -1.938095      7.023078 
1 1 1 -8  15 39 o 23.63740 6.357000 7.426871       3.740885 8.607539       5.498353 6.409328       5.104406 25.41551 7.975229 22.59761 7.719403 2.817902       11.09926 
1 1 1 -8  15 40 o 29.49005 5.594451 11.48304       3.873350 10.08676       5.592916 12.76995       5.369405 26.95427 7.963200 30.43815 7.327429 -3.483887      10.82145 
1 1 1 -8  15 41 o 24.59249 6.435508 8.330549       3.900684 8.222605       5.398792 8.448439       5.642044 24.29223 7.932046 24.58945 8.113109 -0.2972126     11.34636 
1 1 1 -8  15 42 o 64.10173 5.189298 54.15918       8.036897 0.000000       0.000000 54.15918       8.036897 ?        ?        64.10173 5.189298 0.000000       5.189298 
1 1 1 -8  15 43 o 20.76742 6.616820 6.200561       3.771820 6.354099       5.265254 6.038714       5.405841 21.14921 7.777048 20.85581 7.839332 0.2933998      11.04254 
1 1 1 -8  15 44 o 18.32841 6.626590 4.708098       3.799398 11.45313       5.454133 -1.650739      5.295690 26.54476 7.869301 14.25276 6.570461 12.29200       10.25168 
1 1 1 -8  15 45 o 28.90384 5.908387 12.32835       4.020981 10.62255       5.934848 13.77580       5.466975 24.52851 8.324674 28.84238 7.652798 -4.313873      11.30776 
1 1 1 -8  15 46 o 42.78022 5.296446 26.50647       5.403754 28.49805       6.984565 23.53687       8.528815 41.95535 7.083439 33.51038 9.815917 8.444962       12.10485 
1 1 1 -8  15 47 o 28.35675 6.170419 12.91058       4.142453 7.390018       6.012338 17.89958       5.715551 19.57062 7.984378 31.65345 7.521392 -12.08283      10.96912 
1 1 1 -8  15 48 o 18.70867 7.272552 6.736156       4.756145 11.41242       6.199580 0.4700748E-01  7.414781 22.30146 8.392488 15.13653 7.221244 7.164931       11.07160 
1 1 1 -8  16 1  o 425.2241 6.366070 2205.435       65.96680 2181.481       92.30623 2230.439       94.30825 422.6926 8.961285 427.4002 9.054800 -4.707581      12.73947 
1 1 1 -8  16 2  o 629.3125 8.172531 4833.651       125.3312 4479.241       188.0154 5117.077       168.1360 605.0675 12.75127 647.1151 10.66211 -42.04761      16.62154 
1 1 1 -8  16 3  o 674.1978 9.759888 5551.750       160.3497 5641.653       228.9286 5465.163       224.6689 678.8076 13.83940 668.1149 13.79926 10.69275       19.54350 
1 1 1 -8  16 4  o 485.1483 6.410334 2870.863       75.78640 2757.039       95.38332 3065.759       124.8120 475.2707 8.235601 500.9388 10.22435 -25.66803      13.12869 
1 1 1 -8  16 5  o 364.6332 5.558867 1621.320       49.39451 1638.670       70.46481 1604.559       69.25955 366.4291 7.891258 362.5992 7.838208 3.829926       11.12248 
1 1 1 -8  16 6  o 482.4507 8.223943 2841.198       96.68722 2878.821       169.1835 2822.949       117.8240 484.5281 14.34437 480.6824 10.05865 3.845734       17.51962 
1 1 1 -8  16 7  o 317.6545 5.722535 1230.594       44.29754 1171.943       74.88422 1262.165       54.94130 309.5479 9.940074 321.6297 7.009818 -12.08173      12.16317 
1 1 1 -8  16 8  o 171.0017 3.797671 356.4445       15.82537 368.4169       28.24414 350.9658       19.10618 173.6441 6.687208 169.6020 4.627141 4.042099       8.131986 
1 1 1 -8  16 9  o 849.2967 14.12284 8844.140       292.2924 9323.194       525.5751 8629.626       351.6977 865.9331 24.93255 837.6528 17.22937 28.28033       30.30649 
1 1 1 -8  16 10 o 322.7862 5.788338 1270.970       45.53077 0.000000       0.000000 1270.970       45.53077 ?        ?        322.7862 5.788338 0.000000       5.788338 
1 1 1 -8  16 11 o 64.76189 3.697281 51.29552       5.810718 49.89743       11.62661 51.76100       6.708644 63.46460 7.673314 65.01642 4.257668 -1.551819      8.775391 
1 1 1 -8  16 12 o 82.41599 2.930951 82.89596       5.877114 82.25741       12.81968 83.06587       6.612988 81.83783 6.481044 82.48282 3.296658 -0.6449890     7.271306 
1 1 1 -8  16 13 o 523.1003 6.877796 3341.450       87.67391 3274.829       137.1990 3387.432       113.9830 517.0010 10.88989 526.2988 8.887336 -9.297791      14.05612 
1 1 1 -8  16 14 o 313.0252 4.924999 1195.407       37.56829 1188.736       53.40622 1201.941       52.85722 311.9460 7.025484 313.6864 6.914687 -1.740417      9.857501 
1 1 1 -8  16 15 o 68.07774 3.557688 56.66588       5.881653 53.04916       7.936883 61.07135       8.759680 65.74707 4.991078 70.55711 5.129651 -4.810043      7.157107 
1 1 1 -8  16 16 o 344.8065 5.326482 1451.373       44.75607 1475.185       64.40698 1429.137       62.23802 347.2817 7.610530 341.8423 7.471259 5.439392       10.66489 
1 1 1 -8  16 17 o 185.5477 3.467402 419.8705       15.67819 395.5365       22.02436 444.8696       22.32328 179.9301 5.027932 190.8512 4.803661 -10.92116      6.953795 
1 1 1 -8  16 18 o 190.4145 3.511334 442.2505       16.29327 428.7477       23.16566 455.4691       22.92063 187.3080 5.079881 193.0830 4.875219 -5.775009      7.040806 
1 1 1 -8  16 19 o 269.0948 4.393156 883.9460       28.80833 880.8509       41.08513 886.9397       40.40562 268.3625 6.282417 269.3086 6.156806 -0.9461670     8.796308 
1 1 1 -8  16 20 o 183.7794 3.451457 412.0497       15.45736 400.0168       22.08901 423.5962       21.63799 180.8800 5.016135 186.1684 4.773458 -5.288452      6.924414 
1 1 1 -8  16 21 o 197.9846 4.122941 478.5430       19.89183 460.1440       24.55353 513.6807       33.93154 193.9602 5.199447 204.6664 6.812814 -10.70625      8.570221 
1 1 1 -8  16 22 o 40.45209 3.924418 20.16356       3.820038 20.56210       7.133217 20.00330       4.523338 40.29647 7.541227 40.18987 4.707672 0.1066055      8.890010 
1 1 1 -8  16 23 o 109.5878 3.581892 146.7445       9.552718 142.6817       11.47417 155.9209       17.24430 107.9832 4.369452 112.6394 6.307506 -4.656158      7.673118 
1 1 1 -8  16 24 o 62.65118 3.180975 48.02282       4.840632 49.02993       7.363906 47.25653       6.423437 63.14083 4.822366 62.04465 4.274539 1.096180       6.444137 
1 1 1 -8  16 25 o 164.0938 3.290750 328.6826       13.15901 341.2549       19.52007 318.2099       17.81578 166.9640 4.802573 161.2639 4.537992 5.700134       6.607426 
1 1 1 -8  16 26 o 178.3864 3.443214 388.5761       14.96794 386.3875       21.60612 390.5959       20.75524 177.6004 4.997222 178.6075 4.772889 -1.007156      6.910333 
1 1 1 -8  16 27 o 67.52069 3.210871 55.78992       5.268048 62.76150       8.017586 50.49342       6.988312 71.46814 4.628465 64.08760 4.503349 7.380539       6.457774 
1 1 1 -8  16 28 f 208.6491 4.370053 532.6925       22.21976 525.1390       40.65318 535.9103       26.53377 205.9499 8.116113 209.0930 5.207428 -3.143158      9.643059 
1 1 1 -8  16 29 o 28.91401 6.501692 10.69251       4.469600 13.80486       10.63344 10.02461       4.925889 33.79631 11.13739 27.98266 7.186605 5.813648       13.25476 
1 1 1 -8  16 30 o 165.2101 3.945052 333.9722       15.88274 330.7773       29.84826 335.2341       18.75904 163.3514 7.518413 165.3199 4.661042 -1.968475      8.846007 
1 1 1 -8  16 31 o 29.20984 5.435231 10.82012       3.726517 13.27550       5.714428 9.003303       4.915522 32.10880 7.447828 26.55953 7.347045 5.549269       10.46180 
1 1 1 -8  16 32 o 90.91498 3.099606 101.1618       6.857130 104.1553       10.23871 98.72705       9.233846 92.01177 4.580717 89.63856 4.239200 2.373215       6.241296 
1 1 1 -8  16 33 o 115.6485 3.147683 163.7394       8.862641 149.8437       12.69770 176.9395       12.37583 110.2946 4.735302 119.9945 4.238961 -9.699928      6.355461 
1 1 1 -8  16 34 o 26.32637 6.295115 8.943729       3.983922 1.692570       5.798323 15.42795       5.483116 19.03045 7.811330 34.64523 6.737190 -15.61479      10.31536 
1 1 1 -8  16 35 o 61.15599 3.480451 46.04228       5.165519 38.84383       7.361243 53.02541       7.250314 55.71156 5.493534 65.41045 4.577448 -9.698891      7.150661 
1 1 1 -8  16 36 o 21.94420 6.536766 6.145895       3.756220 3.143353       5.480745 8.805347       5.158117 19.78285 7.772751 26.04667 7.634751 -6.263819      10.89519 
1 1 1 -8  16 37 o 39.46388 5.857542 19.96713       5.462481 22.94430       6.394936 11.93250       10.50552 42.15897 6.427581 30.86102 11.03627 11.29796       12.77157 
1 1 1 -8  16 38 o 39.58947 4.401216 19.75962       4.174399 18.44963       6.182970 20.85690       5.658780 37.29874 7.060963 40.15212 5.964256 -2.853382      9.242811 
1 1 1 -8  16 39 o 29.77502 5.790708 11.68667       4.050329 10.04805       5.971302 13.08304       5.512257 27.07745 8.280563 30.93948 7.409054 -3.862036      11.11134 
1 1 1 -8  16 40 o 23.85023 6.538792 7.759163       3.913197 10.73145       5.704590 5.117436       5.378028 27.56524 8.014720 20.93598 7.829584 6.629261       11.20438 
1 1 1 -8  16 41 o 55.60333 3.789532 39.18369       5.104100 38.42717       7.100446 39.99260       7.342197 53.95687 5.475866 54.99307 5.554822 -1.036198      7.800074 
1 1 1 -8  16 42 o 30.45602 7.375086 13.66705       5.414748 0.000000       0.000000 13.66705       5.414748 ?        ?        30.45602 7.375086 0.000000       7.375086 
1 1 1 -8  16 43 o 25.83329 6.433816 9.801528       4.034886 8.365606       5.679155 11.26512       5.733615 23.12668 8.129473 26.48782 8.116722 -3.361139      11.48780 
1 1 1 -8  16 44 o 23.04436 6.861045 8.236169       4.138958 2.883852       6.020576 13.03260       5.699365 17.76072 7.656132 28.04728 7.966716 -10.28656      11.04920 
1 1 1 -8  16 45 o 20.05603 7.289773 6.474429       4.605966 10.21956       5.851817 0.3762195      7.467215 23.83239 8.260439 16.83655 7.776049 6.995842       11.34468 
1 1 1 -8  16 46 o 25.48322 6.272577 10.35690       3.868600 7.420131       5.920056 12.54563       5.110778 20.13725 8.025346 26.59243 7.541007 -6.455179      11.01240 
1 1 1 -8  16 47 o 16.24763 6.431740 4.104655       3.777965 3.882643       6.019712 4.248927       4.852649 16.72060 7.417724 16.64286 7.012844 0.7773209E-01  10.20797 
1 1 1 -8  16 48 o 17.37964 6.745662 5.462945       4.087153 7.312555       6.082072 3.939913       5.519069 18.54665 7.834962 16.11587 7.128356 2.430784       10.59245 
1 1 1 -8  17 1  o 141.7338 2.757558 244.8260       9.524323 245.7230       14.65191 244.1696       12.53365 141.9066 4.241733 141.4843 3.638260 0.4222412      5.588312 
1 1 1 -8  17 2  o 363.9041 5.577486 1615.112       49.46083 1703.648       71.89104 1535.539       68.15478 373.5627 7.897238 354.6542 7.885970 18.90851       11.16042 
1 1 1 -8  17 3  o 240.3275 4.061439 704.1041       23.78589 728.4962       33.73981 680.0032       33.53774 244.3952 5.665182 236.1140 5.828757 8.281174       8.128265 
1 1 1 -8  17 4  o 201.6812 3.223738 495.7696       15.84387 480.2444       24.36239 507.1485       20.85702 198.3872 5.043390 203.9593 4.196358 -5.572174      6.560884 
1 1 1 -8  17 5  o 373.1075 5.667323 1697.951       51.52856 1771.175       74.80708 1631.841       71.08043 380.8656 8.059998 365.5856 7.978566 15.27997       11.34112 
1 1 1 -8  17 6  o 159.3332 3.336242 309.4431       12.95388 304.1654       18.58398 314.4306       18.06611 157.8623 4.836562 160.5182 4.623353 -2.655869      6.690869 
1 1 1 -8  17 7  o 500.7174 7.390585 3060.711       90.17945 3092.527       182.5343 3050.438       103.7215 501.6158 14.94934 499.7197 8.517384 1.896149       17.20548 
1 1 1 -8  17 8  f 423.6176 5.689214 2189.154       58.73032 2098.323       90.54919 2255.114       77.16217 414.3668 8.967337 429.7773 7.367581 -15.41043      11.60579 
1 1 1 -8  17 9  o 84.24424 3.082230 86.62262       6.316967 74.54308       13.94344 89.74220       7.085861 77.77763 7.447505 85.73437 3.398308 -7.956734      8.186197 
1 1 1 -8  17 10 o 450.0536 6.705172 2472.738       73.53775 2484.891       148.1134 2468.762       84.71712 449.6213 13.53337 449.5478 7.733200 0.7348633E-01  15.58700 
1 1 1 -8  17 11 o 244.7557 4.108783 730.4950       24.50655 737.9260       35.28286 723.5684       34.06425 245.8945 5.888150 243.5004 5.740676 2.394089       8.223483 
1 1 1 -8  17 12 o 242.2481 4.667631 715.8387       27.55453 0.000000       0.000000 715.8387       27.55453 ?        ?        242.2481 4.667631 0.000000       4.667631 
1 1 1 -8  17 13 o 300.9848 4.275493 1104.964       31.35934 1108.196       50.24786 1102.903       40.13481 301.1791 6.846311 300.6033 5.478875 0.5758057      8.768697 
1 1 1 -8  17 14 o 229.8126 3.929885 644.1377       22.00846 682.5540       32.77143 612.5773       29.70357 236.4397 5.687728 224.0114 5.441296 12.42834       7.871337 
1 1 1 -8  17 15 o 52.23211 4.147843 33.49120       5.236213 33.24930       7.191849 33.76409       7.638571 51.85668 5.789819 52.21746 6.118809 -0.3607750     8.423884 
1 1 1 -8  17 16 o 180.3038 3.967964 396.6093       17.43447 387.5929       30.98037 400.7883       21.09125 177.8477 7.162945 181.1370 4.782327 -3.289261      8.612690 
1 1 1 -8  17 17 o 365.2632 5.601835 1630.162       49.86231 1609.608       70.41978 1650.829       70.61251 362.4351 7.973120 367.0670 7.894054 -4.631927      11.21993 
1 1 1 -8  17 18 o 147.1642 3.775790 264.4259       13.52968 266.9614       16.67263 259.5364       23.15275 147.7919 4.635052 145.4954 6.546830 2.296478       8.021514 
1 1 1 -8  17 19 o 137.4270 3.089922 230.3538       10.34798 205.0495       14.50855 256.5544       14.76329 129.4971 4.604895 144.9101 4.185076 -15.41299      6.222533 
1 1 1 -8  17 20 o 91.97125 2.937227 103.2725       6.574588 97.36999       9.720385 108.2497       8.926061 89.17841 4.487303 94.09308 3.901298 -4.914665      5.946092 
1 1 1 -8  17 21 o 72.14182 3.345814 63.63817       5.865980 73.88142       11.11600 59.68478       6.905809 77.47453 5.932942 69.79787 4.077857 7.676651       7.199216 
1 1 1 -8  17 22 o 45.97033 5.863125 26.28358       6.418872 26.28358       6.418872 0.000000       0.000000 45.97033 5.863125 ?        ?        0.000000       5.863125 
1 1 1 -8  17 23 o 175.9718 4.047685 378.2391       17.35745 382.8629       21.27332 369.0302       30.02206 176.8690 4.940524 173.2246 7.127271 3.644394       8.672184 
1 1 1 -8  17 24 o 186.4633 3.510742 424.4954       15.95249 408.5662       22.68831 440.0699       22.43427 182.6556 5.102217 189.6160 4.859135 -6.960434      7.045836 
1 1 1 -8  17 25 o 36.57590 4.279432 16.57530       3.742299 17.53143       6.142594 16.01094       4.719239 37.16802 7.039474 35.72639 5.604846 1.441631       8.998250 
1 1 1 -8  17 26 o 234.9141 4.631140 675.2407       26.51143 693.2264       33.74030 646.2170       42.86095 237.7309 5.824079 228.8371 7.696936 8.893860       9.652083 
1 1 1 -8  17 27 o 158.4560 3.837846 306.9058       14.81946 310.9953       28.18787 305.3437       17.42141 158.6854 7.308986 157.8892 4.532572 0.7962494      8.600319 
1 1 1 -8  17 28 o 225.3050 3.947583 620.7841       21.67395 608.8677       30.92131 632.2935       30.38883 222.6178 5.704530 226.9951 5.493655 -4.377319      7.919717 
1 1 1 -8  17 29 f 81.86752 3.601840 82.09788       7.168162 82.52934       15.47327 81.97998       8.088451 81.27208 7.912833 81.74844 4.073050 -0.4763641     8.899588 
1 1 1 -8  17 30 o 60.60366 3.409945 45.04473       5.015648 37.45436       7.344516 51.67831       6.866031 54.92037 5.564445 64.79842 4.373783 -9.878044      7.077642 
1 1 1 -8  17 31 f 91.26449 3.113819 101.9306       6.915041 99.05640       10.10698 104.4602       9.481639 89.72808 4.638026 92.22305 4.230249 -2.494972      6.277443 
1 1 1 -8  17 32 o 85.10371 3.430952 88.78429       7.100813 77.58477       11.69278 95.32774       8.937614 79.00981 6.120661 88.06331 4.176668 -9.053497      7.409929 
1 1 1 -8  17 33 o 48.67191 3.838444 29.23290       4.515882 30.43958       6.612808 28.17839       6.181800 49.33180 5.599717 47.47619 5.441435 1.855610       7.808075 
1 1 1 -8  17 34 o 19.19062 6.492602 4.296700       3.609854 7.724926       5.732736 2.044247       4.646812 25.07127 8.172845 17.73132 7.095522 7.339945       10.82321 
1 1 1 -8  17 35 o 17.11938 6.417301 2.805547       3.617238 2.506147       5.250738 3.075982       4.990288 18.93146 7.553670 19.16746 7.449829 -0.2360077     10.60933 
1 1 1 -8  17 36 o 51.40748 4.330247 32.93500       5.374305 32.63050       7.173683 33.32453       8.113652 50.68512 5.919306 50.94645 6.697350 -0.2613373     8.938271 
1 1 1 -8  17 37 o 32.59665 6.380498 13.91887       4.886805 15.51586       6.013586 10.81381       8.385280 34.10279 7.445443 28.90452 9.893428 5.198273       12.38202 
1 1 1 -8  17 38 o 27.24921 6.127348 9.850299       3.969725 10.39159       6.020688 9.433993       5.280025 27.62453 8.286946 26.42098 7.718902 1.203541       11.32497 
1 1 1 -8  17 39 o 64.80624 3.538499 52.42844       5.566998 48.95229       8.143188 55.47859       7.627901 61.59421 5.482467 66.03402 4.772449 -4.439812      7.268680 
1 1 1 -8  17 40 o 41.28057 4.306370 21.81268       4.268415 19.67319       6.171885 23.77417       5.909558 37.78688 6.958899 42.27356 5.896795 -4.486675      9.121319 
1 1 1 -8  17 41 o 13.07258 6.163531 -4.304543      5.100939 0.000000       0.000000 -4.304543      5.100939 ?        ?        13.07258 6.163531 0.000000       6.163531 
1 1 1 -8  17 42 o 52.72237 3.975442 35.94499       5.069966 30.59950       7.030879 41.73559       7.317752 46.62389 6.353335 55.43534 5.488937 -8.811443      8.396029 
1 1 1 -8  17 43 o 31.14811 5.501669 13.63926       4.023354 11.94757       5.827577 15.18001       5.561508 26.93392 8.169066 31.24937 7.415378 -4.315445      11.03275 
1 1 1 -8  17 44 o 11.53704 5.387989 -2.194658      3.741656 -8.010229      5.411075 3.133828       5.179517 11.45514 5.624808 17.17430 7.241440 -5.719165      9.169347 
1 1 1 -8  17 45 o 24.45943 7.185813 10.07254       4.564900 13.42243       5.896408 5.061086       7.211971 27.08066 8.217915 18.94975 8.272204 8.130911       11.66034 
1 1 1 -8  17 46 f 17.39295 6.477672 4.844035       3.673585 6.150803       5.614368 3.865714       4.857831 18.73058 7.687132 16.62817 7.012162 2.102407       10.40492 
1 1 1 -8  17 47 o 13.78749 6.212222 1.094296       4.400540 3.722007       5.578017 -3.236518      7.161036 16.28822 7.187150 13.93043 6.758073 2.357789       9.865429 
1 1 1 -8  17 48 o 13.28764 5.899907 1.430627       3.816525 3.410497       5.900767 0.6726597E-02  5.004145 15.76168 7.138876 13.33900 6.230025 2.422678       9.475060 
1 1 1 -8  18 1  o 256.4957 4.919126 802.4026       30.74710 849.5004       53.73316 779.4733       37.49183 263.5386 8.377492 252.7385 6.087361 10.80013       10.35559 
1 1 1 -8  18 2  o 33.18137 4.220183 13.64095       3.335314 7.406662       4.498754 21.24998       4.970078 24.41340 7.122894 41.43829 5.024327 -17.02489      8.716620 
1 1 1 -8  18 3  o 542.0108 7.952603 3588.557       105.0397 3750.384       153.2122 3445.036       144.2863 553.3705 11.36165 530.4124 11.16286 22.95807       15.92785 
1 1 1 -8  18 4  o 407.3801 5.494339 2024.585       54.54454 2208.378       91.06448 1921.756       68.11475 425.0651 8.791389 396.7440 7.045222 28.32114       11.26604 
1 1 1 -8  18 5  o 59.82365 2.801242 43.71626       4.072414 52.57660       5.839962 35.32930       5.681820 65.56840 3.669574 53.64763 4.384315 11.92077       5.717341 
1 1 1 -8  18 6  o 572.9146 7.498688 4008.953       104.6915 3988.193       165.2460 4022.874       135.3123 570.3929 11.88832 573.4487 9.682929 -3.055847      15.33269 
1 1 1 -8  18 7  o 328.9652 4.598972 1319.826       36.86776 1275.986       57.44039 1350.540       48.07781 323.2242 7.292516 332.6667 5.930609 -9.442444      9.399624 
1 1 1 -8  18 8  o 251.8958 4.223660 773.7722       25.92662 785.1739       37.29947 763.1138       36.06332 253.6338 6.034751 250.0536 5.918294 3.580231       8.452480 
1 1 1 -8  18 9  o 503.4401 7.437037 3096.725       91.23971 2928.438       176.6974 3157.908       106.5423 487.3276 14.89647 508.1518 8.603842 -20.82419      17.20264 
1 1 1 -8  18 10 o 430.5032 5.779576 2262.236       60.63291 2237.802       95.64625 2278.653       78.39874 427.5891 9.179210 431.8064 7.450473 -4.217346      11.82233 
1 1 1 -8  18 11 o 162.7842 2.942020 323.0347       11.67062 313.4591       18.74831 329.0926       14.91208 160.2143 4.807467 164.2785 3.724958 -4.064255      6.081698 
1 1 1 -8  18 12 o 184.9063 3.495493 416.9130       15.75057 426.3101       23.03761 408.6652       21.58282 186.8309 5.064698 182.9391 4.845606 3.891754       7.009356 
1 1 1 -8  18 13 o 252.0854 3.759680 775.0497       23.09588 805.3482       37.83887 757.0594       29.15731 256.7647 6.047374 249.0648 4.803954 7.699829       7.723258 
1 1 1 -8  18 14 o 339.0516 5.269187 1403.676       43.53571 1351.759       60.65720 1458.836       62.52274 332.3603 7.489230 345.2846 7.430614 -12.92438      10.55000 
1 1 1 -8  18 15 o 225.0586 3.481731 617.7960       19.09532 642.1415       31.38870 603.4922       24.05956 229.2608 5.618331 222.3662 4.439997 6.894592       7.160951 
1 1 1 -8  18 16 o 348.2967 5.393932 1482.115       45.78160 1511.669       66.05362 1454.793       63.51111 351.2549 7.716816 344.6212 7.562608 6.633636       10.80474 
1 1 1 -8  18 17 o 234.9942 4.708879 674.3678       26.96564 673.3788       33.11200 676.3152       46.46550 234.6870 5.789758 234.6723 8.137488 0.1467896E-01  9.986993 
1 1 1 -8  18 18 o 125.2657 3.038207 191.3855       9.274395 194.7687       13.92115 188.6856       12.43608 126.2091 4.533716 124.2592 4.112612 1.949944       6.121124 
1 1 1 -8  18 19 o 152.7079 3.210088 284.4811       11.94578 274.5585       17.27832 293.5673       16.53403 149.8404 4.737864 154.9853 4.382162 -5.144913      6.453735 
1 1 1 -8  18 20 o 97.83690 2.954693 116.8649       7.036444 113.1941       10.53288 119.8236       9.456055 96.15686 4.507557 98.99345 3.927627 -2.836586      5.978656 
1 1 1 -8  18 21 o 141.3990 4.510053 244.5434       15.52059 254.0644       21.64446 234.4661       22.26767 143.8894 6.187256 138.1433 6.634068 5.746033       9.071549 
1 1 1 -8  18 22 o 121.4345 3.684560 180.2087       10.89083 175.5709       13.09927 190.5915       19.59972 119.7732 4.495966 124.5094 6.482011 -4.736206      7.888611 
1 1 1 -8  18 23 o 262.4580 5.005802 842.7585       32.01619 854.3326       40.33371 823.0435       52.64071 263.9475 6.270679 258.2922 8.374305 5.655273       10.46185 
1 1 1 -8  18 24 o 210.1929 3.768361 539.6894       19.30220 542.7069       28.02869 536.9674       26.62057 210.4149 5.470901 209.4194 5.216321 0.9954987      7.559152 
1 1 1 -8  18 25 o 85.83816 3.390924 90.11759       7.079119 80.58998       9.348230 102.9267       10.83919 81.01173 4.756201 91.57023 4.874999 -10.55849      6.810805 
1 1 1 -8  18 26 o 190.3915 4.158967 443.2973       19.29608 425.1734       34.82322 451.3279       23.18014 185.4752 7.721432 191.8967 4.961088 -6.421509      9.177849 
1 1 1 -8  18 27 o 197.6412 3.658113 477.4207       17.61857 498.6134       26.05219 459.5589       23.91733 201.5687 5.308394 193.5680 5.074786 8.000671       7.343874 
1 1 1 -8  18 28 o 41.85721 4.747435 21.74058       4.757031 11.00841       10.38231 24.59231       5.351856 31.29695 10.99254 44.50622 5.022155 -13.20927      12.08545 
1 1 1 -8  18 29 o 128.3357 3.142469 201.2429       9.827763 201.8095       14.61918 200.7757       13.27497 128.2125 4.686926 127.9663 4.262933 0.2462082      6.335604 
1 1 1 -8  18 30 o 63.83477 3.356488 49.96577       5.202950 53.61402       8.024024 47.31904       6.834464 65.87885 5.036341 61.94769 4.559284 3.931160       6.793511 
1 1 1 -8  18 31 f 31.23597 5.792617 12.40429       4.246948 22.82637       7.590977 7.655726       5.123914 42.22520 7.659146 24.81901 7.685156 17.40619       10.85008 
1 1 1 -8  18 32 o 79.52453 3.207970 77.51970       6.204049 82.62661       9.294808 73.41631       8.331692 81.83611 4.680305 77.17244 4.449177 4.663666       6.457588 
1 1 1 -8  18 33 f 81.00740 3.191150 80.49287       6.287204 78.99950       9.366381 81.71758       8.482134 79.90768 4.832612 81.40489 4.290965 -1.497208      6.462702 
1 1 1 -8  18 34 o 18.43115 6.567863 3.698140       3.717379 3.521946       5.732846 3.825974       4.883129 20.50926 7.981076 19.86636 7.454223 0.6428928      10.92076 
1 1 1 -8  18 35 o 70.65627 3.642663 61.61588       6.250822 56.30484       8.141265 69.24310       9.756306 67.14774 5.011501 74.35333 5.421805 -7.205589      7.383164 
1 1 1 -8  18 36 o 12.16658 5.721160 -4.369356      4.343230 -2.882306      5.100225 -8.293345      8.284959 14.39903 6.566658 16.56248 7.822951 -2.163455      10.21369 
1 1 1 -8  18 37 o 36.54145 4.791087 16.98754       4.163675 17.30161       6.112068 16.71559       5.687483 35.99788 7.218928 35.52393 6.817828 0.4739532      9.929537 
1 1 1 -8  18 38 o 44.95024 4.094449 25.45226       4.435835 21.13258       6.380144 29.49403       6.171495 39.78260 6.826882 47.87199 5.383410 -8.089390      8.694103 
1 1 1 -8  18 39 o 73.07464 3.385034 66.66766       6.011520 63.56867       8.713597 69.48235       8.304310 70.27419 5.123414 73.83564 4.638757 -3.561447      6.911399 
1 1 1 -8  18 40 o 36.43196 5.118617 17.49902       4.419185 13.55775       6.387096 21.11844       6.120752 30.21549 8.381217 39.13457 6.656227 -8.919075      10.70281 
1 1 1 -8  18 41 o 32.07050 6.599815 14.61753       4.985816 2.246126       9.589326 19.20095       5.836781 21.00191 9.337032 36.74825 6.767068 -15.74634      11.53141 
1 1 1 -8  18 42 o 27.32703 6.371037 10.89200       4.164125 7.631990       5.650845 14.76590       6.159962 22.34899 8.081285 30.40150 8.149234 -8.052517      11.47681 
1 1 1 -8  18 43 o 16.26472 6.518511 2.992779       3.927915 -3.151111      5.799099 8.200788       5.339181 14.01662 6.597260 22.50425 7.884572 -8.487629      10.28058 
1 1 1 -8  18 44 o 33.86738 6.602256 17.64194       5.253064 15.15996       6.720351 21.54039       8.422443 28.60744 8.791378 32.91949 9.783916 -4.312052      13.15345 
1 1 1 -8  18 45 o 14.09392 6.114429 1.443394       3.889198 3.901472       6.034883 -0.3026672     5.086285 17.46087 7.595468 14.07772 6.471391 3.383147       9.978478 
1 1 1 -8  18 46 o 32.30392 5.456408 15.88619       4.142516 16.10946       6.597197 15.74085       5.322673 27.43564 8.751974 29.58578 7.401689 -2.150135      11.46220 
1 1 1 -8  18 47 o 14.01039 6.330477 1.366771       4.607142 -1.671872      5.867212 6.253531       7.440507 13.39678 6.400143 17.87078 8.062603 -4.474000      10.29405 
1 1 1 -8  19 1  o 41.29563 3.648583 20.95465       3.633945 18.73122       5.347867 22.86198       4.953149 38.74320 5.846118 43.02442 4.806225 -4.281219      7.568150 
1 1 1 -8  19 2  o 466.5122 6.207541 2656.946       70.56977 2661.098       111.1965 2654.146       91.31606 466.1992 9.787768 465.9572 8.042019 0.2420044      12.66785 
1 1 1 -8  19 3  o 136.9342 2.761267 228.5589       9.214175 243.0021       14.59264 218.9822       11.88257 141.0934 4.248997 133.9660 3.643200 7.127319       5.597042 
1 1 1 -8  19 4  o 401.2820 5.428780 1964.998       53.08697 1944.822       83.23569 1978.832       68.92537 398.7682 8.565505 402.4868 7.027347 -3.718567      11.07933 
1 1 1 -8  19 5  o 173.8548 2.997801 368.4547       12.70064 331.4102       18.93513 398.7514       17.12396 164.7589 4.720972 180.8324 3.885902 -16.07353      6.114558 
1 1 1 -8  19 6  o 172.6563 3.449631 363.4542       14.51414 347.8331       20.46325 379.2686       20.58950 168.7734 4.980926 176.2547 4.798143 -7.481354      6.916054 
1 1 1 -8  19 7  o 218.1250 3.875763 580.2072       20.60150 544.1563       28.42226 620.1151       29.90401 211.0757 5.530428 225.4095 5.444039 -14.33382      7.760360 
1 1 1 -8  19 8  o 197.6272 3.647178 476.2552       17.56467 420.1102       34.22924 496.3239       20.46448 185.2168 7.599835 201.7242 4.163002 -16.50740      8.665338 
1 1 1 -8  19 9  o 216.8106 3.432503 573.1731       18.13542 552.0811       28.45201 587.6065       23.53630 212.5916 5.496615 219.4717 4.400718 -6.880127      7.041243 
1 1 1 -8  19 10 o 473.9844 6.308738 2744.636       72.86897 2695.750       114.2289 2778.180       94.62250 468.8076 9.998738 476.4508 8.149674 -7.643188      12.89930 
1 1 1 -8  19 11 o 250.1048 3.757843 762.9408       22.90323 747.3646       36.34052 773.2044       29.49924 247.3411 6.029187 251.7000 4.809406 -4.358887      7.712424 
1 1 1 -8  19 12 o 239.4250 3.643281 699.1882       21.25682 687.6962       33.82370 706.6899       27.32792 237.2559 5.850163 240.6269 4.660434 -3.371048      7.479576 
1 1 1 -8  19 13 o 118.0149 3.514539 170.0262       10.09618 190.8833       13.35979 142.2536       15.41634 124.9859 4.393172 107.7334 5.894575 17.25249       7.351597 
1 1 1 -8  19 14 o 169.2651 2.994959 349.3787       12.35363 368.1705       20.62468 338.8647       15.42720 173.5718 4.880938 166.6572 3.798629 6.914566       6.184912 
1 1 1 -8  19 15 o 89.59943 2.910261 98.00192       6.345953 114.5961       14.24993 93.89684       7.087556 96.61512 6.083336 87.67509 3.323312 8.940033       6.931911 
1 1 1 -8  19 16 o 130.9597 3.141450 209.1863       10.02545 194.8502       14.21861 223.3604       14.13800 126.2315 4.630094 135.1949 4.296785 -8.963364      6.316655 
1 1 1 -8  19 17 o 190.7266 3.178753 443.7317       14.77420 432.0569       23.81409 451.0370       18.83774 187.9507 5.204418 192.2248 4.021454 -4.274094      6.577085 
1 1 1 -8  19 18 o 267.1550 4.410130 871.6544       28.71116 894.7159       41.80677 851.0689       39.49888 270.3295 6.346248 263.6925 6.146826 6.637024       8.835062 
1 1 1 -8  19 19 o 62.17694 4.219163 47.42825       6.354943 41.70220       7.825489 58.51773       10.89028 58.12068 5.594179 68.80211 6.575223 -10.68143      8.632983 
1 1 1 -8  19 20 o 52.93652 5.412632 34.63780       6.884147 29.78654       9.484748 40.03865       10.00759 48.54505 8.316636 56.63260 7.430555 -8.087555      11.15256 
1 1 1 -8  19 21 o 165.1816 3.351196 333.0198       13.48955 333.8859       19.70332 332.2558       18.50704 165.1642 4.900811 164.8025 4.612799 0.3616943      6.730220 
1 1 1 -8  19 22 o 275.6214 4.524971 928.7361       30.39239 933.0159       43.72334 924.7350       42.27586 275.7620 6.506430 274.5898 6.317889 1.172241       9.069143 
1 1 1 -8  19 23 o 115.4354 3.012882 162.7349       8.468096 180.7009       13.19940 150.1680       11.03939 121.4832 4.466240 110.7753 4.096518 10.70789       6.060426 
1 1 1 -8  19 24 o 71.67183 3.187102 62.83581       5.552556 80.17348       8.978140 52.09701       7.065921 80.82565 4.576985 65.11038 4.480623 15.71527       6.405059 
1 1 1 -8  19 25 o 133.8472 3.580961 219.0296       11.66957 206.5704       14.95388 238.4335       18.66181 129.8150 4.735013 139.3375 5.506884 -9.522446      7.262652 
1 1 1 -8  19 26 o 110.4924 3.057425 149.1850       8.224442 161.9139       12.72989 140.0650       10.77519 114.9157 4.554814 106.9282 4.143041 7.987434       6.157200 
1 1 1 -8  19 27 o 193.3724 4.222863 457.6504       19.89929 466.5023       37.16683 454.0933       23.56072 194.0127 7.877588 192.3757 5.030083 1.637085       9.346558 
1 1 1 -8  19 28 o 174.3795 4.029767 372.1819       17.12424 376.2798       32.24098 370.5716       20.21064 174.1747 7.614439 173.7792 4.777033 0.3954468      8.988868 
1 1 1 -8  19 29 o 69.80019 3.212404 59.68034       5.449502 63.58327       8.531367 56.99031       7.082743 71.80453 4.905086 68.06157 4.292209 3.742958       6.517893 
1 1 1 -8  19 30 o 103.7852 3.069790 131.7879       7.755370 131.6365       11.62632 131.9094       10.40975 103.4551 4.623306 103.6601 4.129167 -0.2049484     6.198788 
1 1 1 -8  19 31 o 109.2770 3.449610 146.3530       9.174674 150.7679       16.14398 144.2469       11.15029 110.2615 6.031255 108.3278 4.232011 1.933693       7.367900 
1 1 1 -8  19 32 o 32.54146 5.289661 13.39802       4.050775 10.08917       6.251520 15.79272       5.318289 28.11226 8.446834 35.12928 6.450124 -7.017015      10.62794 
1 1 1 -8  19 33 o 42.65757 4.248050 22.61882       4.357289 21.96300       6.700222 23.09944       5.735839 41.38038 6.886358 42.79948 5.636351 -1.419102      8.898897 
1 1 1 -8  19 34 o 35.15227 4.908321 15.59591       4.090100 7.585102       6.124014 22.04667       5.495454 24.98164 8.456499 41.73853 5.539589 -16.75689      10.10937 
1 1 1 -8  19 35 o 20.07721 6.843900 4.799199       4.011838 3.174077       5.663137 6.436382       5.684114 19.92526 7.878680 23.28966 8.137015 -3.364397      11.32628 
1 1 1 -8  19 36 o 11.75460 5.589538 -5.181714      4.368938 -5.126841      5.090820 -5.335092      8.511199 13.08995 6.167325 17.98973 8.306234 -4.899780      10.34550 
1 1 1 -8  19 37 o 24.96118 6.309444 8.318610       3.839184 3.173656       5.635024 12.77567       5.244804 19.57865 7.820763 30.72967 7.140306 -11.15102      10.59001 
1 1 1 -8  19 38 o 25.77627 6.248102 8.978152       3.883352 7.589293       5.703868 10.17816       5.301912 23.92759 8.160415 27.05829 7.683281 -3.130707      11.20826 
1 1 1 -8  19 39 o 67.45409 3.415142 57.04238       5.595486 52.70381       7.945794 61.31052       7.881028 63.69579 5.163295 69.07911 4.709833 -5.383320      6.988716 
1 1 1 -8  19 40 o 52.46782 4.311831 35.52255       5.464433 23.69827       8.661677 43.34003       7.042841 39.00977 9.252392 57.37587 5.089880 -18.36611      10.56000 
1 1 1 -8  19 41 o 26.97401 6.988066 10.78585       4.630077 6.072912       8.372618 12.86204       5.557117 22.12604 9.260292 28.96034 7.730071 -6.834301      12.06263 
1 1 1 -8  19 42 f 14.09457 6.101280 0.7611523      3.855262 4.404813       5.526223 -2.693527      5.381004 18.88669 7.673645 13.83317 6.460674 5.053525       10.03121 
1 1 1 -8  19 43 o 25.92931 6.719911 10.44228       4.280486 0.1925696      6.272649 19.37516       5.855862 16.08256 7.314230 35.31380 7.051752 -19.23124      10.15998 
1 1 1 -8  19 44 o 20.88992 6.915173 7.167009       4.097852 1.078565       5.911250 12.79989       5.685799 15.84657 7.164403 26.65715 8.065709 -10.81058      10.78816 
1 1 1 -8  19 45 o 11.24725 5.251971 -1.587650      3.553245 -1.692125      5.672929 -1.520201      4.558125 13.73573 6.483419 12.64027 5.917418 1.095460       8.777844 
1 1 1 -8  19 46 o 13.97084 6.022158 1.972183       3.724657 -0.2507594     5.690195 3.638684       4.926811 14.10065 6.604453 16.07072 6.926724 -1.970075      9.570701 
1 1 1 -8  19 47 o 12.03363 5.731210 -1.958881      4.629843 -0.8755764     5.829891 -3.808847      7.618459 13.60858 6.467038 13.78212 6.748153 -0.1735382     9.346665 
1 1 1 -8  20 1  o 149.0063 2.834997 270.6709       10.29422 257.1964       15.51949 281.2570       13.75597 145.1309 4.393209 151.8638 3.717071 -6.732895      5.754729 
1 1 1 -8  20 2  o 253.7627 3.778360 785.3418       23.36508 804.5040       37.15485 772.8068       30.05072 256.6673 5.940307 251.6509 4.900274 5.016434       7.700644 
1 1 1 -8  20 3  o 444.6176 5.951238 2414.144       64.48075 2507.399       104.2194 2356.307       82.07563 452.3446 9.454602 438.9305 7.673303 13.41403       12.17658 
1 1 1 -8  20 4  o 306.7528 4.864679 1148.277       36.36460 1119.199       71.00564 1158.615       42.33839 302.0147 9.660232 308.0497 5.639978 -6.034973      11.18613 
1 1 1 -8  20 5  o 117.7549 2.666912 169.0313       7.652860 160.9227       11.55867 175.3600       10.21163 114.7836 4.139074 119.8679 3.499624 -5.084274      5.420268 
1 1 1 -8  20 6  o 139.4610 2.849156 237.1102       9.682895 238.6548       15.76560 236.1747       12.26977 139.7749 4.634961 139.1151 3.622394 0.6598358      5.882567 
1 1 1 -8  20 7  o 250.4135 4.229722 765.0085       25.81105 744.8575       52.30733 771.4943       29.67557 246.4396 8.723717 251.4237 4.843471 -4.984116      9.978098 
1 1 1 -8  20 8  o 254.8009 3.824740 791.9081       23.74865 831.2100       38.99989 768.7458       29.93973 260.8267 6.135858 250.9609 4.895598 9.865845       7.849562 
1 1 1 -8  20 9  o 279.2354 4.074857 951.2731       27.72802 956.1392       44.41020 948.1642       35.49707 279.6690 6.516317 278.6632 5.227292 1.005829       8.353860 
1 1 1 -8  20 10 o 284.5705 4.133362 988.0818       28.66352 991.3315       45.90390 986.0049       36.69704 284.7277 6.615822 284.1435 5.299773 0.5841675      8.476833 
1 1 1 -8  20 11 o 42.96112 3.796299 22.69152       3.933548 28.44235       7.253856 20.29605       4.681657 47.81168 6.385349 40.48583 4.841111 7.325848       8.013054 
1 1 1 -8  20 12 o 222.5621 3.899544 604.3923       21.14955 604.9528       30.46258 603.8707       29.38641 222.4261 5.624621 222.3201 5.424149 0.1059875      7.813946 
1 1 1 -8  20 13 o 127.1695 2.755115 197.1950       8.538055 190.5337       13.87234 201.2571       10.83293 124.8389 4.567687 128.3983 3.465356 -3.559349      5.733451 
1 1 1 -8  20 14 o 112.4192 3.123939 154.2630       8.549839 149.2914       12.28482 158.9333       11.90665 110.4774 4.572977 114.0205 4.292860 -3.543076      6.272222 
1 1 1 -8  20 15 f 132.2688 3.094569 213.3916       9.974555 214.3829       21.34401 213.1146       11.28233 132.1602 6.648697 132.1168 3.507429 0.4335022E-01  7.517130 
1 1 1 -8  20 16 o 206.2084 4.270875 519.2043       21.46146 539.4871       38.42967 510.0115       25.87179 209.5968 7.536215 204.2045 5.203302 5.392349       9.157995 
1 1 1 -8  20 17 o 250.2220 3.766389 764.2181       22.96607 759.8462       36.84314 766.9963       29.37043 249.1577 6.068007 250.5381 4.810614 -1.380341      7.743560 
1 1 1 -8  20 18 o 146.8954 3.253673 263.2896       11.64711 239.6676       16.27161 288.1091       16.67896 139.9565 4.777917 153.5038 4.463496 -13.54726      6.538447 
1 1 1 -8  20 19 f 170.1584 4.849136 354.2648       20.08680 333.2816       27.50827 378.2334       29.40004 164.6890 6.869374 175.4577 6.889448 -10.76866      9.728967 
1 1 1 -8  20 20 o 128.0459 3.102544 200.0698       9.680989 208.9127       14.82716 193.4987       12.78146 130.6408 4.664884 125.7813 4.175712 4.859444       6.260808 
1 1 1 -8  20 21 o 35.89114 4.458020 15.98757       3.815323 20.99345       6.915553 13.79722       4.574500 40.73871 7.230827 33.06664 5.893106 7.672066       9.328106 
1 1 1 -8  20 22 o 207.8552 3.777064 527.7632       19.13160 564.2749       28.84021 499.0692       25.56690 214.5438 5.520869 201.8285 5.202616 12.71526       7.585987 
1 1 1 -8  20 23 o 89.91483 3.130347 98.81301       6.848523 103.3588       10.90928 95.85632       8.798223 91.76099 4.896401 88.45973 4.092528 3.301262       6.381499 
1 1 1 -8  20 24 o 192.7385 4.153611 454.2685       19.50879 444.0500       24.57459 471.6836       32.08154 190.2693 5.305247 195.7111 6.736771 -5.441727      8.574947 
1 1 1 -8  20 25 o 226.3999 3.982826 626.7794       21.97372 636.1169       32.01795 618.4657       30.21172 227.5592 5.778491 224.5234 5.521762 3.035812       7.992548 
1 1 1 -8  20 26 o 127.1584 4.339962 198.1622       13.42858 186.7653       21.68575 205.2503       17.10199 122.7943 7.279699 129.2024 5.443949 -6.408127      9.090137 
1 1 1 -8  20 27 o 113.7807 3.557629 158.4412       9.852160 173.2608       20.20108 153.8162       11.28529 118.2442 7.042564 112.0177 4.141314 6.226410       8.169957 
1 1 1 -8  20 28 o 104.2365 3.076374 132.8880       7.805841 137.5132       11.96497 129.4607       10.29954 105.7827 4.652910 102.7278 4.122655 3.054871       6.216579 
1 1 1 -8  20 29 o 112.1280 3.125177 153.8183       8.531020 164.9742       13.10651 145.6174       11.23739 115.8434 4.652262 108.9071 4.242332 6.936295       6.296104 
1 1 1 -8  20 30 o 98.39053 3.395148 118.6327       8.128246 116.1319       14.52632 119.7726       9.807311 96.70401 6.196788 98.73681 4.084827 -2.032799      7.421994 
1 1 1 -8  20 31 o 87.82697 3.172242 94.54536       6.778232 93.79911       10.28890 95.11759       9.009695 87.13181 4.865016 87.89371 4.218772 -0.7619019     6.439442 
1 1 1 -8  20 32 o 55.77117 3.718080 38.35484       5.024319 32.20266       7.738140 42.83886       6.606265 50.45323 6.440414 58.76584 4.651022 -8.312611      7.944240 
1 1 1 -8  20 33 o 38.57740 4.522345 18.62456       4.170793 16.56039       6.518411 20.05546       5.427176 35.51313 7.750319 39.73957 5.772960 -4.226444      9.664083 
1 1 1 -8  20 34 o 76.07507 3.653067 71.47388       6.752508 66.04789       9.105253 78.10506       10.06581 72.63094 5.178363 78.97855 5.259999 -6.347618      7.381263 
1 1 1 -8  20 35 o 107.5849 3.842153 143.3816       10.05690 140.5549       12.33136 148.9960       17.37903 106.0407 4.784346 107.9436 6.638940 -1.902946      8.183245 
1 1 1 -8  20 36 o 68.54843 3.383025 58.25532       5.633718 48.13181       8.159884 67.47639       7.787703 61.41167 5.511055 73.37236 4.375400 -11.96069      7.036750 
1 1 1 -8  20 37 o 28.88119 5.995827 11.10976       4.081639 8.934485       6.268931 12.71047       5.377651 25.71741 8.554373 30.41628 7.339951 -4.698868      11.27174 
1 1 1 -8  20 38 o 14.08851 5.968674 0.5977831      3.546394 -0.7476469     5.130228 1.829114       4.907875 15.45896 6.853458 17.19543 7.134722 -1.736465      9.893136 
1 1 1 -8  20 39 o 53.59020 3.780006 36.46218       4.904770 36.01596       7.144655 36.85991       6.745341 51.93597 5.740882 52.87642 5.306520 -0.9404449     7.817729 
1 1 1 -8  20 40 o 28.54346 7.232209 12.02888       5.035744 -2.352740      9.701815 17.33232       5.891531 18.90878 8.778427 34.41962 7.253191 -15.51084      11.38725 
1 1 1 -8  20 41 o 49.46083 4.202299 32.13767       5.017150 34.25139       7.181120 30.12203       7.012527 49.17340 6.125166 45.73220 6.473121 3.441196       8.911731 
1 1 1 -8  20 42 o 43.14314 4.642153 25.20270       4.803829 21.76509       7.007441 28.25060       6.598287 36.58734 8.075951 43.91444 6.349909 -7.327099      10.27338 
1 1 1 -8  20 43 o 23.28635 7.397020 9.051152       4.716686 3.564218       5.857598 19.16928       7.954354 17.71507 7.592836 31.17936 9.561345 -13.46429      12.20944 
1 1 1 -8  20 44 o 15.98447 6.466602 3.378141       3.905076 5.649231       5.614512 1.249893       5.435081 18.69708 7.681813 15.34487 6.909810 3.352204       10.33227 
1 1 1 -8  20 45 o 12.63318 5.614973 0.6058050      3.465567 -1.037867      5.738458 1.549447       4.348018 13.92740 6.557560 14.27561 6.320099 -0.3482084     9.107429 
1 1 1 -8  20 46 o 14.10092 6.391636 1.291833       4.741197 3.812402       6.066235 -2.664781      7.600317 16.35846 7.338528 14.29127 6.939905 2.067186       10.10031 
1 1 1 -8  21 1  o 342.1243 5.333436 1429.463       44.46590 1415.713       88.07365 1434.167       51.51320 339.1441 10.67005 342.5535 6.170979 -3.409363      12.32602 
1 1 1 -8  21 2  o 253.1776 3.783198 781.9064       23.34106 760.4454       36.08803 797.3407       30.60417 249.4701 5.936201 255.5636 4.914118 -6.093491      7.706298 
1 1 1 -8  21 3  o 93.89667 2.681842 107.5746       6.130196 113.2339       9.422633 103.4214       8.072037 96.25555 4.025968 92.01190 3.606992 4.243645       5.405443 
1 1 1 -8  21 4  o 261.8715 3.872683 836.5800       24.71362 827.7767       38.59249 842.6995       32.17654 260.2593 6.084997 262.7190 5.025875 -2.459686      7.892186 
1 1 1 -8  21 5  o 118.5711 2.680903 171.4034       7.746336 168.6397       11.85143 173.4647       10.23534 117.4906 4.145842 119.2044 3.527377 -1.713829      5.443381 
1 1 1 -8  21 6  f 280.9458 4.555528 963.3955       31.18870 1006.735       63.26082 949.4783       35.84829 286.3185 9.078175 278.8267 5.275918 7.491760       10.49993 
1 1 1 -8  21 7  o 199.4295 3.314186 485.0595       16.10654 446.3735       24.89219 512.9216       21.12483 191.0924 5.350710 205.0165 4.228325 -13.92412      6.819738 
1 1 1 -8  21 8  o 163.7500 3.390796 327.0496       13.53066 345.7962       20.08385 311.4691       18.30950 168.2127 4.904740 159.6568 4.711163 8.555862       6.800848 
1 1 1 -8  21 9  o 295.1810 4.260256 1063.440       30.64504 1040.248       48.25466 1079.116       39.67224 291.5673 6.791480 297.1856 5.478011 -5.618347      8.725411 
1 1 1 -8  21 10 o 149.1648 2.907447 271.3270       10.56852 293.0179       17.75530 259.4250       13.15222 154.8388 4.711049 145.7725 3.705440 9.066315       5.993685 
1 1 1 -8  21 11 o 205.0883 3.743092 513.2173       18.70714 511.6446       26.87063 514.6965       26.05978 204.5477 5.395435 205.1815 5.216134 -0.6337738     7.504584 
1 1 1 -8  21 12 o 133.1523 2.825473 216.2068       9.168029 217.4207       15.06067 215.4922       11.55581 133.3500 4.641708 132.8508 3.572683 0.4992523      5.857432 
1 1 1 -8  21 13 o 144.5400 3.260077 254.8531       11.48291 233.9513       16.04084 276.8222       16.44529 138.3127 4.766267 150.4959 4.489175 -12.18323      6.547518 
1 1 1 -8  21 14 o 372.3849 5.132475 1694.761       46.57523 1677.918       73.69508 1705.963       60.09948 369.6677 8.180708 373.2418 6.607609 -3.574127      10.51591 
1 1 1 -8  21 15 o 271.3794 5.229102 900.3283       34.58120 926.1631       43.20507 854.2730       57.68623 275.0087 6.446919 263.3430 9.002296 11.66568       11.07267 
1 1 1 -8  21 16 o 199.4661 3.724758 485.6497       18.10520 492.6071       26.13332 479.2281       25.10676 200.6284 5.350001 197.9056 5.210439 2.722733       7.468011 
1 1 1 -8  21 17 o 179.2513 3.545463 392.1831       15.48715 397.3784       22.49036 387.4979       21.35777 180.1913 5.127059 177.9651 4.929506 2.226105       7.112438 
1 1 1 -8  21 18 o 255.3106 4.256810 796.3580       26.48435 760.9924       52.45580 808.4575       30.68215 248.3831 8.679672 257.1316 4.896594 -8.748535      9.965608 
1 1 1 -8  21 19 o 88.16949 2.721588 94.92093       5.840586 101.4389       10.48033 91.98472       7.034158 90.95921 4.744563 86.74728 3.333721 4.211929       5.798670 
1 1 1 -8  21 20 o 177.8401 3.506604 386.1640       15.19681 389.0069       22.42591 383.7500       20.66500 178.2018 5.169650 177.0590 4.793812 1.142776       7.050242 
1 1 1 -8  21 21 o 324.1826 5.155751 1286.723       40.73031 1306.771       58.84145 1268.281       56.43650 325.8620 7.409922 321.1108 7.212222 4.751160       10.34036 
1 1 1 -8  21 22 o 39.51846 4.741186 19.38276       4.474814 21.75934       10.36211 18.83795       4.961275 41.04509 10.36048 38.84679 5.385529 2.198303       11.67662 
1 1 1 -8  21 23 o 17.82507 6.606669 3.027925       3.812718 -4.247525      6.185848 7.485208       4.841773 15.70070 7.187396 24.56602 7.445137 -8.865316      10.34837 
1 1 1 -8  21 24 o 148.8812 3.305801 270.7444       11.99369 262.9879       17.52200 277.5823       16.45180 146.4330 4.917284 150.5267 4.490033 -4.093750      6.658834 
1 1 1 -8  21 25 o 106.2714 3.547905 138.1882       9.175196 162.2862       19.34876 131.1974       10.42142 114.5177 6.966327 103.4655 4.141654 11.05220       8.104506 
1 1 1 -8  21 26 o 51.25986 4.259050 32.39232       5.272165 35.16695       11.63277 31.67507       5.914474 52.33656 9.469496 50.59602 4.856499 1.740540       10.64222 
1 1 1 -8  21 27 o 103.2755 3.502104 130.5920       8.801035 132.8444       12.03293 128.0010       12.90596 103.9502 4.762836 101.9434 5.212418 2.006805       7.060730 
1 1 1 -8  21 28 o 93.63873 3.118706 107.3020       7.106565 109.0153       10.96341 106.0605       9.332767 94.10722 4.796467 92.94246 4.130919 1.164757       6.330132 
1 1 1 -8  21 29 o 49.65113 4.143399 30.44370       4.967620 29.68676       9.862227 30.70103       5.750374 47.96230 8.760708 49.74896 4.802895 -1.786659      9.990886 
1 1 1 -8  21 30 o 137.6508 3.264452 231.9782       10.95027 239.2985       16.48296 226.1950       14.65054 139.3181 4.862483 135.5780 4.440323 3.740097       6.584847 
1 1 1 -8  21 31 o 115.8925 3.150676 164.6418       8.889802 167.7012       13.42092 162.2501       11.86629 116.5258 4.736199 114.7640 4.250343 1.761757       6.363725 
1 1 1 -8  21 32 o 77.95452 3.189721 74.65629       6.046608 79.44286       9.589406 71.49711       7.790536 79.96702 4.945094 76.04951 4.220280 3.917503       6.501132 
1 1 1 -8  21 33 o 35.71147 4.886666 16.11380       4.141194 25.29155       6.703331 10.44914       5.266352 44.43065 6.373405 28.15034 7.530184 16.28031       9.865291 
1 1 1 -8  21 34 o 49.99706 4.014328 31.13241       4.849881 28.47900       7.183733 33.35468       6.574255 47.00899 6.440065 51.35071 5.331176 -4.341717      8.360375 
1 1 1 -8  21 35 o 22.99135 7.422919 6.806668       4.735476 4.704792       5.840511 10.83975       8.090322 21.35360 8.120832 28.60505 9.719388 -7.251453      12.66548 
1 1 1 -8  21 36 o 56.57323 3.664850 39.96291       5.025276 34.40520       7.609441 44.26155       6.692214 51.32376 6.210279 59.10896 4.684289 -7.785202      7.778826 
1 1 1 -8  21 37 o 17.29960 6.470737 3.236970       3.673584 -0.6121338     5.529989 6.277227       4.914730 16.17921 7.146849 21.98756 7.572561 -5.808348      10.41255 
1 1 1 -8  21 38 o 44.61341 4.227552 25.49759       4.541275 24.44294       6.759901 26.36507       6.130759 42.11377 6.819915 44.45746 5.796849 -2.343685      8.950682 
1 1 1 -8  21 39 o 16.70574 6.644278 2.732073       4.049789 6.377021       6.776094 0.7066376      5.051181 22.17210 8.662937 16.04310 6.964086 6.128996       11.11508 
1 1 1 -8  21 40 o 50.93002 4.845913 34.62869       5.941916 38.56966       11.87751 33.31316       6.862352 46.69077 10.67244 48.98985 5.864579 -2.299088      12.17762 
1 1 1 -8  21 41 o 41.48462 4.697642 23.23681       4.665531 21.54102       6.761082 24.77836       6.446283 37.03736 7.740714 40.94781 6.691014 -3.910442      10.23173 
1 1 1 -8  21 42 o 18.00322 6.639784 4.666037       3.842666 1.914844       5.850493 6.753384       5.095999 16.74271 7.375231 20.59685 7.637260 -3.854139      10.61705 
1 1 1 -8  21 43 o 26.77824 6.597588 11.43585       4.276861 3.969166       5.982934 19.23849       6.116052 17.75334 7.642357 33.74858 7.617919 -15.99523      10.79066 
1 1 1 -8  21 44 o 11.48259 5.362527 -1.562097      3.706287 3.963385       5.794726 -5.387319      4.821433 17.08409 7.437045 11.17869 5.450660 5.905394       9.220592 
1 1 1 -8  21 45 o 12.37028 5.649368 -0.1217841     3.791971 2.217414       5.570588 -2.141639      5.176397 15.40758 6.961464 12.75444 6.070427 2.653140       9.236453 
1 1 1 -8  22 1  o 224.2387 3.921188 613.5822       21.42715 635.6057       42.74654 606.1916       24.76278 227.6139 7.717820 222.8258 4.560347 4.788086       8.964458 
1 1 1 -8  22 2  o 78.04329 2.758374 74.35923       5.237709 80.68450       7.995220 69.60381       6.932425 81.21066 4.052806 75.43497 3.783247 5.775688       5.544204 
1 1 1 -8  22 3  o 474.4307 6.331765 2753.060       73.20381 2842.677       118.0210 2697.023       93.32510 480.6847 10.07542 468.9832 8.165919 11.70145       12.96905 
1 1 1 -8  22 4  o 167.4511 3.001122 341.9465       12.24638 336.1853       18.89182 346.1220       16.08323 165.8663 4.678574 168.4190 3.918736 -2.552658      6.102913 
1 1 1 -8  22 5  o 154.1820 3.244569 289.9461       12.19065 303.6096       23.84817 285.1128       14.18383 157.4356 6.228362 152.8621 3.807655 4.573502       7.300050 
1 1 1 -8  22 6  o 36.99242 3.907903 16.88414       3.469651 12.39234       4.917931 21.33561       4.895799 31.23410 6.664456 41.50547 4.937046 -10.27137      8.293938 
1 1 1 -8  22 7  o 201.8690 3.707216 497.2172       18.23701 543.0386       38.41424 483.8848       20.72099 210.3844 7.504797 199.0992 4.270757 11.28520       8.634892 
1 1 1 -8  22 8  o 250.8366 3.815593 767.7849       23.32325 737.7216       36.54108 788.4523       30.29747 245.5896 6.105698 254.0675 4.893518 -8.477890      7.824709 
1 1 1 -8  22 9  o 51.26749 3.531311 32.21888       4.384832 31.50114       7.398242 32.60753       5.444062 50.37591 6.154182 51.49446 4.379892 -1.118549      7.553636 
1 1 1 -8  22 10 o 96.29449 3.151829 113.2251       7.386091 110.2714       10.93722 115.7014       10.01466 94.89830 4.744518 97.25977 4.235547 -2.361473      6.360056 
1 1 1 -8  22 11 o 153.6098 2.957986 287.7880       11.07264 290.9124       18.06366 285.9073       14.01424 154.2419 4.811703 153.0608 3.757243 1.181076       6.104864 
1 1 1 -8  22 12 f 15.01835 6.255752 0.5567835      3.794156 4.198972       5.880347 -2.041042      4.966228 21.67611 8.169996 15.00480 6.692036 6.671312       10.56088 
1 1 1 -8  22 13 o 155.6674 3.360849 295.6654       12.74919 294.3601       18.31755 296.8918       17.75573 155.1324 4.851356 155.8192 4.681385 -0.6868439     6.741736 
1 1 1 -8  22 14 o 113.0320 3.707141 156.1145       10.19738 158.7143       12.80404 151.6055       16.86228 113.8812 4.623415 111.0926 6.253917 2.788582       7.777368 
1 1 1 -8  22 15 f 157.4446 3.384489 302.5136       12.98545 307.9604       18.89135 297.6351       17.87885 158.6453 4.892366 155.9849 4.708890 2.660400       6.790353 
1 1 1 -8  22 16 o 220.3549 3.501119 592.6848       18.80033 602.1852       30.79658 587.0410       23.73658 221.7159 5.704669 219.1842 4.443986 2.531677       7.231339 
1 1 1 -8  22 17 o 84.34930 2.806117 86.89041       5.759946 99.00948       10.52293 81.70605       6.882559 89.85548 4.823371 81.74062 3.463068 8.114861       5.937824 
1 1 1 -8  22 18 o 193.7908 3.601280 458.5630       17.00694 476.0717       35.77681 453.4516       19.33068 196.6242 7.480338 192.6446 4.117694 3.979630       8.538786 
1 1 1 -8  22 19 o 28.87001 5.400865 10.53468       3.660035 2.669636       9.483580 11.91116       3.967403 24.42136 10.00315 30.72771 5.500318 -6.306349      11.41562 
1 1 1 -8  22 20 o 119.3665 2.766678 173.8560       8.047802 172.2795       13.74722 174.6780       9.926548 118.5635 4.767759 119.5559 3.410635 -0.9923859     5.862078 
1 1 1 -8  22 21 o 168.1175 3.974118 345.4618       16.28133 309.8514       28.97734 361.8899       19.68175 158.4011 7.528509 171.8968 4.702925 -13.49573      8.876709 
1 1 1 -8  22 22 o 165.0640 3.909788 333.0626       15.72684 340.6695       20.51838 322.2291       24.48622 166.6806 5.057369 161.8384 6.220331 4.842178       8.016826 
1 1 1 -8  22 23 o 110.1368 3.124991 148.2473       8.378727 153.1821       12.97472 144.7173       10.97368 111.7329 4.776215 108.6903 4.150727 3.042641       6.327777 
1 1 1 -8  22 24 o 127.7156 3.659892 199.5691       11.37890 176.5805       21.14711 208.9375       13.49983 119.3788 7.304185 130.5885 4.247812 -11.20976      8.449558 
1 1 1 -8  22 25 o 152.7247 3.843383 285.5293       14.29269 308.4706       28.08669 277.5125       16.60321 157.7943 7.324189 150.4266 4.534481 7.367661       8.614247 
1 1 1 -8  22 26 o 139.4951 3.289480 237.8769       11.18207 231.2032       16.59737 243.4240       15.13174 137.1470 4.974355 140.8595 4.413702 -3.712448      6.650186 
1 1 1 -8  22 27 o 176.0297 3.521661 379.1180       15.10670 388.2269       22.56216 371.7160       20.33863 177.6198 5.218244 173.9297 4.803169 3.690063       7.092285 
1 1 1 -8  22 28 o 95.81604 3.148797 112.4098       7.342244 117.7741       11.47965 108.6964       9.551284 97.75936 4.833736 94.04328 4.178144 3.716080       6.389202 
1 1 1 -8  22 29 o 117.7609 4.135050 170.4603       11.84796 183.1903       19.21999 162.6581       15.04690 121.3063 6.525823 114.6767 5.399544 6.629639       8.470032 
1 1 1 -8  22 30 o 47.33549 4.181173 27.76022       4.773505 25.66612       7.637430 29.10269       6.115073 44.75886 7.249950 48.24314 5.288071 -3.484283      8.973599 
1 1 1 -8  22 31 o 59.67504 3.558836 43.88955       5.151807 57.44574       8.671763 36.49522       6.404545 67.87128 5.284688 54.10494 4.910971 13.76633       7.214261 
1 1 1 -8  22 32 o 20.46821 6.486042 5.218970       3.628357 15.05352       6.484025 0.7355104      4.377983 33.67843 8.016681 15.97063 6.691002 17.70780       10.44206 
1 1 1 -8  22 33 o 54.35461 4.054503 36.75432       5.331756 40.62313       7.753514 33.28372       7.343653 56.61322 5.697509 51.07763 6.015108 5.535587       8.285116 
1 1 1 -8  22 34 o 22.10205 7.689749 5.918194       5.073479 7.014120       6.047359 3.313540       9.322881 23.93252 8.390727 23.49154 9.797280 0.4409771      12.89926 
1 1 1 -8  22 35 o 38.62479 4.582176 18.96965       4.229012 20.90018       6.654769 17.66190       5.477199 39.46654 7.183969 36.56060 6.379570 2.905941       9.607722 
1 1 1 -8  22 36 o 28.88764 5.826075 11.12126       3.959627 16.10210       6.308860 7.883988       5.086146 33.95661 7.789971 24.10410 7.684079 9.852514       10.94206 
1 1 1 -8  22 37 o 25.40529 6.344190 8.890797       3.915599 7.731133       6.008826 9.746665       5.162107 23.80958 8.362691 26.18025 7.627601 -2.370670      11.31879 
1 1 1 -8  22 38 o 43.74620 4.640314 24.95517       4.871438 36.34230       9.211165 20.53353       5.739830 50.19481 7.782201 38.59480 6.321525 11.60001       10.02618 
1 1 1 -8  22 39 o 22.81173 7.325771 7.700264       4.616467 13.07514       8.754831 5.630190       5.433208 27.63757 10.04956 20.52674 7.826291 7.110834       12.73752 
1 1 1 -8  22 40 o 53.39453 3.970663 37.21561       5.129511 42.79459       7.769810 32.90551       6.829304 55.20304 5.865469 48.30089 5.926136 6.902153       8.338034 
1 1 1 -8  22 41 o 44.58080 4.354290 26.65333       4.670202 22.99642       6.901780 29.74197       6.342885 37.93716 7.728253 45.52764 5.852297 -7.590473      9.694085 
1 1 1 -8  22 42 o 25.52864 7.280891 10.83558       4.750711 6.425491       5.919868 18.81375       7.962334 19.94635 7.999569 30.54373 9.599059 -10.59739      12.49540 
1 1 1 -8  22 43 o 37.29767 5.143776 20.19908       4.550848 19.10549       7.012837 20.99462       5.981289 31.18940 8.829736 35.53004 7.155905 -4.340645      11.36535 
1 1 1 -8  22 44 o 25.45995 6.601215 10.97628       4.129370 10.57325       6.102503 11.31668       5.608362 22.30213 8.340331 23.61425 8.090827 -1.312120      11.61992 
1 1 1 -8  22 45 o 12.28818 5.596650 0.7576358E-01  3.689275 -1.264819      5.826352 0.9730235      4.766603 13.59587 6.462165 13.92898 6.350737 -0.3331089     9.060432 
1 1 1 -8  23 1  o 124.1703 3.510031 188.2676       10.61033 169.4109       16.93053 200.4635       13.61586 117.5396 5.930014 128.0583 4.369560 -10.51876      7.366011 
1 1 1 -8  23 2  o 229.5284 5.672170 644.1758       31.72648 642.5641       44.02887 645.9164       45.75705 228.7287 7.911067 229.2567 8.203523 -0.5280609     11.39661 
1 1 1 -8  23 3  o 94.53763 3.518402 109.1943       8.091478 130.7652       14.44969 99.34033       9.766315 103.2498 5.765827 90.08662 4.462604 13.16319       7.291062 
1 1 1 -8  23 4  o 197.8760 5.215948 478.8298       25.12948 0.000000       0.000000 478.8298       25.12948 ?        ?        197.8760 5.215948 0.000000       5.215948 
1 1 1 -8  23 5  o 288.5866 6.645901 1019.682       46.73758 0.000000       0.000000 1019.682       46.73758 ?        ?        288.5866 6.645901 0.000000       6.645901 
1 1 1 -8  23 6  o 154.2163 3.794865 290.2432       14.26142 244.6093       22.97267 318.8580       18.19129 141.1801 6.696406 161.5111 4.626716 -20.33105      8.139309 
1 1 1 -8  23 7  o 247.2905 4.868694 747.1096       29.33973 703.5648       49.11642 771.2679       36.58410 239.1902 8.439725 251.0863 5.979064 -11.89610      10.34303 
1 1 1 -8  23 8  o 127.0122 3.629548 197.0202       11.22247 173.1622       18.69301 210.4652       14.03279 118.7504 6.484240 131.2083 4.395011 -12.45784      7.833357 
1 1 1 -8  23 9  o 278.4158 6.589044 949.3380       44.70462 949.3380       44.70462 0.000000       0.000000 278.4158 6.589044 ?        ?        0.000000       6.589044 
1 1 1 -8  23 10 o 120.2252 3.217286 176.4629       9.417393 205.9809       14.63394 155.5975       12.30356 129.7684 4.635048 112.7786 4.485754 16.98980       6.450245 
1 1 1 -8  23 11 o 162.8473 4.005876 323.7798       15.89696 330.2663       19.87227 312.2517       26.49239 164.3063 4.968859 159.4695 6.833060 4.836731       8.448684 
1 1 1 -8  23 12 o 109.0178 3.194333 145.1308       8.477059 148.4464       12.60402 142.3923       11.45493 110.1163 4.707875 107.8796 4.366320 2.236710       6.420969 
1 1 1 -8  23 13 o 146.2994 2.934843 261.1031       10.46318 257.4528       16.99906 263.3297       13.27604 145.0470 4.815956 146.8224 3.713547 -1.775345      6.081436 
1 1 1 -8  23 14 o 151.1994 2.965523 278.9089       10.92666 279.3506       18.03618 278.6528       13.73382 151.0727 4.905674 151.0738 3.730493 -0.1052856E-02 6.162971 
1 1 1 -8  23 15 o 41.94801 3.852775 21.66848       3.894458 17.00553       6.912230 23.83707       4.713850 36.48478 7.995722 43.93996 4.464211 -7.455181      9.157552 
1 1 1 -8  23 16 o 165.3660 3.053319 333.6986       12.30423 339.7759       20.34166 330.1921       15.45140 166.5769 5.016847 164.4210 3.856333 2.155884       6.327722 
1 1 1 -8  23 17 o 71.82826 3.233529 63.10224       5.645381 62.76809       13.03962 63.17932       6.262747 71.02139 7.655010 71.84074 3.588684 -0.8193436     8.454456 
1 1 1 -8  23 18 f 143.7376 2.918575 252.1248       10.22297 236.9234       16.72802 261.1865       12.91544 139.0504 4.944562 146.2369 3.624233 -7.186417      6.130560 
1 1 1 -8  23 19 o 159.1226 3.005700 309.0458       11.65503 312.5525       19.57160 307.1188       14.50805 159.6949 5.035496 158.5487 3.755001 1.146210       6.281421 
1 1 1 -8  23 20 o 71.60888 3.493685 62.78362       6.078186 0.000000       0.000000 62.78362       6.078186 ?        ?        71.60888 3.493685 0.000000       3.493685 
1 1 1 -8  23 21 o 147.2797 3.793504 265.2983       13.60373 271.4892       17.91322 256.8630       20.90964 148.7937 4.947174 144.5186 5.949993 4.275101       7.738019 
1 1 1 -8  23 22 o 153.7058 3.380358 288.6342       12.66162 304.0333       19.19587 276.7747       16.84586 157.4233 5.010212 150.2738 4.605604 7.149429       6.805426 
1 1 1 -8  23 23 o 192.0138 4.223386 451.2647       19.76193 426.7229       35.48451 462.2989       23.79327 185.5323 7.866289 194.0993 5.034552 -8.567047      9.339443 
1 1 1 -8  23 24 o 63.36872 3.884340 49.31509       5.969481 53.13949       13.34177 48.35784       6.674882 64.83096 8.661412 62.67854 4.397985 2.152420       9.714028 
1 1 1 -8  23 25 o 87.07834 3.223496 92.80968       6.828465 100.0842       11.06405 88.33395       8.678503 90.14117 5.057077 84.81256 4.212206 5.328613       6.581543 
1 1 1 -8  23 26 o 150.7456 3.344659 277.9244       12.28662 290.7005       18.92653 268.6183       16.15302 153.7199 5.059376 147.9123 4.486583 5.807556       6.762153 
1 1 1 -8  23 27 f 113.0901 3.226373 156.5858       8.882418 160.4137       13.76897 153.8573       11.62476 114.0924 4.964203 111.8969 4.270984 2.195488       6.548635 
1 1 1 -8  23 28 o 101.9211 3.557232 127.4359       8.821577 158.2411       17.97747 117.6658       10.12429 112.7019 6.574323 97.78595 4.258875 14.91593       7.833245 
1 1 1 -8  23 29 o 43.56574 4.201560 23.54908       4.405315 26.36685       7.649895 22.15102       5.388474 45.41158 7.148852 41.99292 5.389793 3.418659       8.952986 
1 1 1 -8  23 30 o 50.34696 4.220507 31.44027       5.130529 37.12009       8.204572 27.79312       6.574534 54.18026 6.333462 46.91446 5.879486 7.265793       8.641822 
1 1 1 -8  23 31 o 47.52969 3.988585 28.04897       4.577192 28.75281       7.783463 27.67689       5.659149 47.25960 6.967205 46.95647 5.023575 0.3031311      8.589426 
1 1 1 -8  23 32 o 52.50253 4.180112 34.33598       5.304032 36.65485       7.883603 32.41831       7.169250 53.60315 6.146338 50.44654 5.945937 3.156609       8.551703 
1 1 1 -8  23 33 o 41.61561 5.832513 22.28909       5.752742 27.39971       7.247311 13.58423       9.458481 45.86416 6.680534 31.61257 10.50734 14.25159       12.45126 
1 1 1 -8  23 34 o 39.94506 4.518715 20.22823       4.321448 16.17392       6.715937 23.09304       5.645422 34.25439 8.162057 42.29048 5.616686 -8.036091      9.907892 
1 1 1 -8  23 35 o 26.03141 6.245008 9.136411       3.910709 8.807982       6.277979 9.344662       4.999106 25.50548 8.562011 26.05298 7.481133 -0.5474987     11.36993 
1 1 1 -8  23 36 o 14.34278 6.088367 0.6183131      3.702338 -6.524080      6.036965 4.924080       4.687292 13.66139 6.517042 20.11742 7.347514 -6.456030      9.821293 
1 1 1 -8  23 37 o 18.47010 6.626339 4.269567       3.790455 10.76462       5.963607 -0.1328417     4.909787 26.93846 8.282196 15.36756 6.763391 11.57090       10.69291 
1 1 1 -8  23 38 o 10.24130 4.914633 -4.351044      3.545466 -2.635338      5.202234 -5.839151      4.844907 13.95797 6.461995 11.83040 5.694673 2.127570       8.613169 
1 1 1 -8  23 39 o 15.48202 6.562506 1.580128       4.290972 -2.221814      7.412182 3.496549       5.262459 16.48388 7.659603 18.10840 7.438202 -1.624525      10.67691 
1 1 1 -8  23 40 o 27.61785 6.300599 11.31021       4.146353 8.638837       6.283306 13.37085       5.518512 22.86226 8.479828 28.80838 7.709311 -5.946123      11.46041 
1 1 1 -8  23 41 o 26.33360 7.188021 11.24237       4.740833 10.52361       6.136475 12.30652       7.466652 24.19163 8.454434 25.16237 9.259780 -0.9707413     12.53878 
1 1 1 -8  23 42 o 11.38541 5.319391 -1.850939      3.653198 -1.679828      6.012489 -1.951080      4.599604 14.35693 6.744939 12.66486 5.933872 1.692074       8.983599 
1 1 1 -8  23 43 o 14.03272 6.095102 1.632883       3.874092 10.53846       5.982359 -4.799260      5.084160 22.67232 8.297541 11.71036 5.684154 10.96196       10.05777 
1 1 1 -8  23 44 o 13.60332 5.977199 1.467249       3.820349 3.113885       5.926767 0.2967182      4.997012 16.08771 7.232385 13.82544 6.376703 2.262270       9.642081 
1 1 1 -8  24 1  o 123.7518 2.782123 186.7773       8.390040 201.4453       13.05954 176.4684       10.94832 128.3746 4.180151 120.1838 3.742786 8.190826       5.610892 
1 1 1 -8  24 2  o 128.0391 3.147757 199.9949       9.821546 185.5798       18.33125 205.7991       11.63199 122.9789 6.136199 129.8029 3.681054 -6.824059      7.155634 
1 1 1 -8  24 3  o 234.2367 4.071863 669.8790       23.24257 627.4084       44.13669 686.1758       27.34065 225.8906 8.030768 236.9844 4.734268 -11.09383      9.322368 
1 1 1 -8  24 4  o 259.7418 3.887283 823.5576       24.60504 751.8079       36.57595 882.8671       33.25431 247.8426 6.055967 268.7566 5.077532 -20.91402      7.902915 
1 1 1 -8  24 5  o 222.7684 3.509952 605.5852       19.05421 541.2243       28.04346 660.7778       25.96934 210.2981 5.476838 232.5739 4.582093 -22.27579      7.140821 
1 1 1 -8  24 6  o 285.7210 4.163360 996.8614       28.98826 987.6558       45.29801 1003.246       37.72449 283.9449 6.546496 286.4214 5.404828 -2.476440      8.489333 
1 1 1 -8  24 7  o 67.08822 2.918647 55.00342       4.760182 49.79740       6.925821 59.66466       6.553432 63.69032 4.491127 69.80381 3.867717 -6.113495      5.927011 
1 1 1 -8  24 8  o 117.2396 3.661039 167.9339       10.44677 159.3242       17.51940 172.6843       13.01351 113.8773 6.338151 118.8058 4.503057 -4.928490      7.774939 
1 1 1 -8  24 9  o 81.65419 3.708107 81.55641       7.359222 86.13230       12.91719 79.35738       8.954605 83.60773 6.388322 80.45945 4.586016 3.148285       7.863982 
1 1 1 -8  24 10 o 61.33970 3.315296 46.04827       4.937228 47.97346       8.321933 45.00258       6.133225 62.37329 5.532394 60.55689 4.181812 1.816399       6.935051 
1 1 1 -8  24 11 o 126.5890 3.251455 195.6784       10.02190 197.2600       14.79780 194.3382       13.62140 126.9390 4.792330 126.0358 4.441924 0.9031372      6.534303 
1 1 1 -8  24 12 o 315.7558 4.531949 1218.525       34.87165 1263.261       56.89598 1191.608       44.13243 320.7285 7.279607 311.9443 5.805568 8.784149       9.311138 
1 1 1 -8  24 13 o 113.1442 2.839233 156.2737       7.822154 154.8782       12.99844 157.0659       9.794040 112.4473 4.754308 113.3712 3.549428 -0.9239120     5.933117 
1 1 1 -8  24 14 o 126.7720 2.879576 196.0827       8.895861 189.2000       14.72334 200.0399       11.16404 124.2770 4.871034 127.9476 3.584110 -3.670578      6.047546 
1 1 1 -8  24 15 o 120.0574 2.859299 175.8680       8.365358 173.4564       14.06000 177.1896       10.40799 118.9776 4.859583 120.4103 3.550929 -1.432724      6.018691 
1 1 1 -8  24 16 o 133.9005 3.198155 218.8596       10.43561 234.1936       23.06788 214.9139       11.70145 137.8869 6.886925 132.6044 3.624542 5.282486       7.782483 
1 1 1 -8  24 17 o 169.7594 3.110804 351.7749       12.86894 355.9427       21.33479 349.3912       16.13463 170.4171 5.143235 169.0934 3.915581 1.323730       6.464104 
1 1 1 -8  24 18 o 78.40031 2.966128 75.13119       5.656657 73.50873       10.22319 75.84709       6.790938 77.25298 5.465731 78.71991 3.549176 -1.466934      6.516967 
1 1 1 -8  24 19 o 22.74909 6.735446 6.456588       3.997705 9.279919       7.097311 5.144543       4.838239 27.84640 9.094735 21.57791 7.509240 6.268494       11.79419 
1 1 1 -8  24 20 o 77.19822 3.323533 72.92713       6.237704 89.32988       10.26476 63.32362       7.854261 85.24767 4.962632 71.78784 4.512539 13.45983       6.707513 
1 1 1 -8  24 21 f 70.02339 4.545066 60.28947       7.713769 64.34268       14.07052 58.54784       9.223325 71.64558 8.207017 68.84682 5.544379 2.798759       9.904305 
1 1 1 -8  24 22 o 122.2032 3.490696 182.6837       10.38449 0.000000       0.000000 182.6837       10.38449 ?        ?        122.2032 3.490696 0.000000       3.490696 
1 1 1 -8  24 23 o 134.4082 2.885060 220.6436       9.449671 214.8092       15.93630 223.8075       11.73539 132.2224 4.954677 135.2375 3.564046 -3.015045      6.103380 
1 1 1 -8  24 24 o 72.04259 2.908852 63.50757       5.096278 57.87525       9.477459 65.79861       6.044550 68.33707 5.744265 73.27743 3.394213 -4.940353      6.672125 
1 1 1 -8  24 25 o 52.33939 3.931704 33.74089       4.978051 27.91209       8.462750 36.82485       6.155674 46.81741 7.684021 54.57624 4.673393 -7.758835      8.993597 
1 1 1 -8  24 26 o 24.36331 6.481173 7.609889       3.914744 1.077502       7.095331 10.46867       4.693829 20.31498 8.515041 28.49205 6.845905 -8.177076      10.92577 
1 1 1 -8  24 27 o 23.66440 6.718546 7.143280       4.054367 18.90681       10.09389 4.880313       4.427197 37.86382 10.54881 20.74813 7.185261 17.11568       12.76344 
1 1 1 -8  24 28 f 80.51678 3.247904 79.55677       6.359655 85.25294       10.61567 76.36797       7.942742 82.87952 5.283616 78.70478 4.155998 4.174744       6.722270 
1 1 1 -8  24 29 o 21.13480 6.461563 5.614284       3.636309 18.76066       7.407558 1.440585       4.173810 37.75983 8.278900 16.38639 6.664773 21.37345       10.62823 
1 1 1 -8  24 30 o 70.81245 3.411223 61.77897       5.869168 65.00363       9.858787 60.00873       7.304630 71.95779 5.667973 69.55350 4.331154 2.404282       7.133359 
1 1 1 -8  24 31 f 20.86095 6.837292 5.373269       4.009661 3.689500       6.854187 6.249269       4.943868 21.65460 8.633586 22.58595 7.598127 -0.9313564     11.50088 
1 1 1 -8  24 32 o 82.97959 4.291915 85.84147       8.649285 85.03306       10.35496 87.70719       15.73097 82.15538 5.198874 81.65359 8.008672 0.5017929      9.548147 
1 1 1 -8  24 33 o 75.84606 3.410618 71.34541       6.287669 64.82866       9.456985 76.50852       8.417692 71.30385 5.484680 78.07702 4.442523 -6.773170      7.058167 
1 1 1 -8  24 34 o 67.16230 3.534648 56.26450       5.764694 62.93142       9.137519 51.85659       7.429889 69.98865 5.399241 63.84279 4.811070 6.145859       7.231750 
1 1 1 -8  24 35 o 24.13419 6.256622 7.949604       3.709842 10.98218       6.266141 6.312956       4.603328 27.65700 8.487211 21.81829 7.331718 5.838711       11.21547 
1 1 1 -8  24 36 o 56.92265 3.696214 41.00808       5.099453 41.34961       7.936362 40.76792       6.655081 55.56532 5.953854 55.95752 4.930824 -0.3921967     7.730550 
1 1 1 -8  24 37 o 30.66378 6.400076 13.27661       4.627642 5.953786       8.134278 16.78082       5.626980 22.36663 9.223743 34.14214 6.998425 -11.77550      11.57823 
1 1 1 -8  24 38 o 18.58785 6.959641 4.539674       4.251893 -0.4601495     7.669715 6.758049       5.108806 17.65836 8.052913 21.43747 7.692622 -3.779110      11.13669 
1 1 1 -8  24 39 o 17.01603 6.537564 3.635171       3.810483 1.924118       5.724603 4.996396       5.105973 17.03068 7.403099 19.21094 7.515868 -2.180264      10.54960 
1 1 1 -8  24 40 o 18.26391 6.694094 4.838541       3.895882 5.469866       5.611928 4.251247       5.412690 19.43320 7.790455 18.27070 7.528296 1.162500       10.83358 
1 1 1 -8  24 41 o 20.30539 6.727149 6.651033       3.877816 6.893121       5.860944 6.462542       5.171631 20.17398 8.002982 19.77699 7.611594 0.3969936      11.04464 
1 1 1 -8  24 42 o 14.09051 6.060608 1.714965       3.756720 0.1986101      5.771667 2.829608       4.948443 14.83120 6.845086 15.93503 6.905152 -1.103832      9.722980 
1 1 1 -8  24 43 o 20.80003 7.033376 7.847566       4.236212 -0.8309325     6.330812 14.88389       5.700464 14.44705 6.828172 27.66210 8.002698 -13.21505      10.51984 
1 1 1 -8  25 1  o 182.6704 3.568839 407.3110       15.88661 370.3319       29.54750 422.3479       18.84175 173.5982 6.998915 185.9518 4.158003 -12.35362      8.140872 
1 1 1 -8  25 2  f 96.48959 2.753140 113.6534       6.466968 131.2295       10.12896 101.5584       8.402453 103.5845 4.020308 91.12605 3.792080 12.45845       5.526549 
1 1 1 -8  25 3  o 154.7937 3.328675 292.4072       12.55627 269.2628       16.65408 322.8918       19.11337 148.3643 4.611929 162.4515 4.833487 -14.08719      6.680755 
1 1 1 -8  25 4  o 77.89217 2.850961 74.10882       5.402414 71.17525       8.003450 76.56427       7.322249 76.20733 4.327460 79.09824 3.809961 -2.890907      5.765649 
1 1 1 -8  25 5  o 156.5511 2.972211 298.9935       11.33892 286.3505       17.16924 308.7734       15.10052 153.0021 4.610129 159.0193 3.896782 -6.017166      6.036406 
1 1 1 -8  25 6  o 93.04159 2.764654 105.6860       6.261409 98.79971       9.142214 111.7701       8.593204 89.83854 4.187444 95.61224 3.695080 -5.773697      5.584649 
1 1 1 -8  25 7  o 143.2551 3.805079 250.7519       13.27166 245.7589       22.33802 253.4759       16.49944 141.4404 6.498260 143.9247 4.710674 -2.484344      8.026072 
1 1 1 -8  25 8  o 150.2497 3.841878 275.8435       14.05519 274.9628       24.25152 276.2890       17.24711 149.5847 6.669745 150.2636 4.715900 -0.6788330     8.168550 
1 1 1 -8  25 9  o 101.2938 3.154408 125.3268       7.776909 123.9480       15.39950 125.7988       9.010299 100.3601 6.328882 101.4422 3.650845 -1.082108      7.306395 
1 1 1 -8  25 10 o 77.17178 3.513958 72.85416       6.590981 73.47261       9.790502 72.34158       8.913247 77.31406 5.227222 76.76819 4.788356 0.5458755      7.088879 
1 1 1 -8  25 11 o 149.1947 3.388834 271.7179       12.32082 273.6041       18.13105 270.0996       16.79419 149.4685 4.984770 148.5571 4.644764 0.9114380      6.813352 
1 1 1 -8  25 12 o 114.6171 2.879683 160.3905       8.036857 173.8584       13.71823 153.3523       9.916931 119.1368 4.734584 112.0046 3.638162 7.132202       5.970972 
1 1 1 -8  25 13 o 125.4420 2.907449 192.0120       8.887739 185.0281       14.67300 196.0593       11.17003 122.8765 4.910090 126.6546 3.622794 -3.778122      6.101936 
1 1 1 -8  25 14 o 205.0193 3.423933 513.2319       17.10630 535.3295       28.46706 500.7426       21.40127 208.9445 5.595857 202.3799 4.339463 6.564636       7.081282 
1 1 1 -8  25 15 o 114.4429 3.181819 160.0100       8.864999 159.8332       19.94226 160.0536       9.896596 113.7493 7.231763 114.4206 3.553630 -0.6713257     8.057710 
1 1 1 -8  25 16 o 192.8858 3.317353 454.3101       15.59294 445.6302       25.32691 459.6085       19.78784 190.6041 5.458351 193.8821 4.188172 -3.278046      6.879999 
1 1 1 -8  25 17 o 114.8042 3.685328 161.2084       10.29691 136.8539       18.12310 172.8181       12.51273 105.1970 7.111367 118.7855 4.329921 -13.58851      8.325849 
1 1 1 -8  25 18 o 55.68926 3.938210 38.10279       5.310020 35.16953       8.454005 40.01404       6.824105 53.06144 6.686172 56.94062 4.967674 -3.879185      8.329626 
1 1 1 -8  25 19 o 51.08226 4.496154 32.18771       5.539842 35.24958       11.95901 31.35115       6.250985 52.42345 9.719035 50.30803 5.172495 2.115425       11.00974 
1 1 1 -8  25 20 o 72.61480 3.665233 64.62583       6.464817 60.79412       13.58424 65.74776       7.350590 69.60675 8.163380 73.18565 4.138410 -3.578896      9.152443 
1 1 1 -8  25 21 o 123.3742 2.879856 185.8784       8.658271 179.2148       14.80852 189.3396       10.67258 120.7603 5.043226 124.3989 3.524155 -3.638596      6.152544 
1 1 1 -8  25 22 o 181.8594 3.219978 404.2053       14.27002 400.4671       23.65023 406.3454       17.89444 180.4454 5.384427 182.1829 4.030643 -1.737488      6.725930 
1 1 1 -8  25 23 o 102.0137 3.084290 127.2998       7.658623 112.2871       16.72271 131.2844       8.615225 94.93551 7.284032 103.5534 3.418708 -8.617874      8.046409 
1 1 1 -8  25 24 o 118.9221 2.850662 172.8188       8.261222 174.0581       14.52388 172.2261       10.04436 118.8823 5.024693 118.5835 3.479619 0.2988281      6.111897 
1 1 1 -8  25 25 o 44.06320 3.725236 23.95630       3.962612 17.01406       7.934884 26.26288       4.573775 36.08704 9.042406 46.08967 4.115511 -10.00263      9.934916 
1 1 1 -8  25 26 o 82.16423 3.096114 82.73618       6.188113 78.93710       14.66922 83.55859       6.825108 79.06842 7.711084 82.52293 3.401188 -3.454506      8.427864 
1 1 1 -8  25 27 o 28.39727 5.832531 10.35673       3.900996 5.908819       7.494452 12.00970       4.568709 24.50831 9.226448 30.52581 6.348862 -6.017502      11.19979 
1 1 1 -8  25 28 o 78.22821 3.349003 75.23170       6.369552 69.45242       10.42189 78.67756       8.047454 74.49875 5.785985 79.81531 4.151755 -5.316559      7.121425 
1 1 1 -8  25 29 o 61.18929 3.599012 46.22972       5.342847 46.60510       9.245316 46.04149       6.546731 60.61009 6.353847 60.85460 4.445299 -0.2445145     7.754486 
1 1 1 -8  25 30 o 112.1761 3.330296 155.0187       9.093649 158.7733       14.05640 152.3161       11.92546 112.6873 5.132213 110.7292 4.428470 1.958076       6.778713 
1 1 1 -8  25 31 o 123.8118 4.165439 190.6019       12.54990 196.2561       15.39439 179.3984       21.66973 125.0424 5.062536 117.3971 7.615704 7.645226       9.144847 
1 1 1 -8  25 32 f 54.38737 5.192272 37.65431       6.798205 40.10575       8.254783 32.48714       11.98455 55.65797 6.190778 47.42415 10.63331 8.233822       12.30419 
1 1 1 -8  25 33 o 55.30389 4.157217 38.52973       5.561651 37.10570       8.099836 39.80003       7.650138 53.11611 6.385594 55.40695 5.749378 -2.290840      8.592506 
1 1 1 -8  25 34 f 41.33209 4.473135 21.87679       4.433709 20.49222       6.983691 22.81166       5.738521 38.23682 7.760400 41.54470 5.828325 -3.307877      9.705317 
1 1 1 -8  25 35 o 40.05938 4.568985 20.78504       4.380609 11.81497       6.663867 27.61102       5.813139 28.13419 8.772754 45.78883 5.307944 -17.65464      10.25356 
1 1 1 -8  25 36 o 79.08453 4.633517 81.41556       8.890613 0.000000       0.000000 81.41556       8.890613 ?        ?        79.08453 4.633517 0.000000       4.633517 
1 1 1 -8  25 37 o 22.45335 7.336579 7.513544       4.618257 -6.722749      8.911037 12.74159       5.400071 16.34093 7.828417 28.86603 7.580853 -12.52509      10.89741 
1 1 1 -8  25 38 o 13.48253 5.834179 0.5714080      3.522484 5.712447       6.144186 -1.945624      4.299157 20.39465 8.159804 12.76713 5.897879 7.627522       10.06814 
1 1 1 -8  25 39 o 17.34450 6.506243 4.100640       3.719573 5.766902       5.613138 2.796149       4.966548 19.82881 7.842790 16.83063 7.093464 2.998182       10.57481 
1 1 1 -8  25 40 f 16.13743 6.627117 3.062592       4.176155 -1.198702      5.300652 10.03646       6.781029 14.07997 6.520000 23.05659 8.754566 -8.976619      10.91571 
1 1 1 -8  25 41 o 14.83772 6.178174 2.445187       3.698611 2.757653       5.772300 2.227543       4.817479 16.50770 7.296405 15.51040 6.766035 0.9972982      9.950716 
1 1 1 -8  25 42 o 13.14376 5.829394 0.8287444      3.715315 -1.322996      5.594833 2.526120       4.969139 13.71895 6.464212 15.50856 6.815537 -1.789607      9.393487 
1 1 1 -8  25 43 o 21.69101 6.931553 8.604603       4.136757 8.374817       6.306765 8.778117       5.480404 19.76324 8.133042 20.57467 7.856406 -0.8114223     11.30794 
1 1 1 -8  26 1  o 218.4568 3.500995 582.6274       18.63774 528.3840       27.44252 629.0681       25.39220 207.6834 5.426983 226.8357 4.593595 -19.15237      7.110082 
1 1 1 -8  26 2  o 26.01570 5.377319 8.588904       3.296345 8.781555       4.619374 8.389021       4.705285 26.29573 7.060664 25.77153 7.210438 0.5241985      10.09175 
1 1 1 -8  26 3  o 49.34517 3.416703 29.86514       4.083174 26.73651       5.793227 32.95360       5.755913 46.45662 5.206733 51.71441 4.615845 -5.257786      6.958167 
1 1 1 -8  26 4  o 110.3146 2.768927 148.5510       7.437677 156.7699       11.48536 142.6150       9.760752 113.1969 4.170778 108.0059 3.714038 5.191032       5.584753 
1 1 1 -8  26 5  o 97.79994 2.778935 116.7805       6.616260 126.2042       10.11413 109.7313       8.747545 101.5548 4.095280 94.71398 3.797672 6.840820       5.585126 
1 1 1 -8  26 6  o 23.56791 6.256627 7.050944       3.652933 5.510796       4.664717 9.493012       5.873851 21.90942 7.380546 27.56705 8.164988 -5.657631      11.00634 
1 1 1 -8  26 7  o 242.7805 4.869206 720.9700       28.80767 701.4760       48.82311 731.3817       35.68075 238.4178 8.416519 244.2839 5.993811 -5.866150      10.33265 
1 1 1 -8  26 8  o 222.5465 3.990321 605.0604       21.64038 576.3458       41.95025 615.4724       25.26092 216.2041 7.975897 224.3520 4.620438 -8.147919      9.217558 
1 1 1 -8  26 9  o 57.07650 4.398536 40.05826       6.070728 35.34390       9.951842 42.85218       7.661256 53.00748 7.949052 58.91510 5.396129 -5.907616      9.607582 
1 1 1 -8  26 10 o 149.5993 3.374908 273.2309       12.30347 300.7906       25.72302 265.0556       14.00997 156.3509 6.767292 147.2429 3.907969 9.108047       7.814631 
1 1 1 -8  26 11 f 130.3323 2.967909 207.2992       9.426249 214.3763       15.88543 203.4530       11.71086 132.2629 4.937282 129.0051 3.729078 3.257767       6.187308 
1 1 1 -8  26 12 o 71.31030 3.192060 62.20091       5.532955 56.40181       9.392335 65.28292       6.847161 67.58852 5.757241 72.99500 3.863050 -5.406487      6.933179 
1 1 1 -8  26 13 o 178.5208 3.644958 389.3113       15.85688 391.1319       23.27118 387.7333       21.66490 178.5948 5.353081 177.8884 5.002701 0.7064362      7.326834 
1 1 1 -8  26 14 o 180.5631 4.197306 398.6537       18.46868 396.8739       34.00304 399.3984       21.99603 179.2229 7.804235 180.5296 5.004711 -1.306656      9.271096 
1 1 1 -8  26 15 o 207.3693 3.913224 525.6301       19.77494 522.6422       28.71494 528.3254       27.27273 206.3294 5.716490 207.5335 5.397256 -1.204117      7.861847 
1 1 1 -8  26 16 o 156.2981 3.951805 298.8589       15.03962 299.0461       27.47868 298.7788       17.97013 155.6047 7.266716 156.1417 4.728210 -0.5369873     8.669553 
1 1 1 -8  26 17 o 105.4730 3.192978 135.9901       8.197339 163.9581       19.21573 129.7681       9.063415 115.1740 6.877796 102.9815 3.617193 12.19249       7.770981 
1 1 1 -8  26 18 o 116.5566 3.172219 166.0626       9.001861 186.0044       20.56397 161.3354       10.01211 122.6498 6.908173 114.8336 3.582217 7.816109       7.781718 
1 1 1 -8  26 19 o 52.19613 3.921542 33.51558       4.951583 36.82267       8.463711 31.79466       6.105477 54.29327 6.527821 50.67368 5.009741 3.619591       8.228606 
1 1 1 -8  26 20 o 168.6307 3.144949 347.4602       12.92369 356.4651       21.81420 342.5902       16.04207 170.2911 5.262996 167.3116 3.934581 2.979507       6.571153 
1 1 1 -8  26 21 o 85.93207 2.922328 90.31138       6.110657 93.49543       11.23152 88.97260       7.282879 87.06509 5.319071 85.22076 3.514427 1.844330       6.375242 
1 1 1 -8  26 22 o 55.93403 3.416094 38.40891       4.634105 44.98359       9.189731 36.16694       5.366367 60.03326 6.379217 54.17954 4.094831 5.853714       7.580373 
1 1 1 -8  26 23 o 123.0382 2.891233 185.0318       8.668805 205.5753       15.69130 176.0073       10.39999 129.1951 4.993384 119.8506 3.564835 9.344521       6.135302 
1 1 1 -8  26 24 o 105.9865 2.863787 137.4411       7.389744 134.2128       13.25662 138.8965       8.900964 104.2265 5.236147 106.4497 3.435782 -2.223274      6.262734 
1 1 1 -8  26 25 o 100.6087 3.074261 124.0067       7.528395 146.5780       18.53272 119.5460       8.238789 108.1750 7.069069 98.71485 3.430087 9.460106       7.857305 
1 1 1 -8  26 26 f 78.57832 2.879496 75.68263       5.504530 76.68362       10.67562 75.32014       6.424377 78.45071 5.621449 78.30299 3.374717 0.1477127      6.556631 
1 1 1 -8  26 27 o 35.99352 4.172344 16.17216       3.591945 23.67379       8.283363 14.43489       3.986226 42.47412 8.300584 33.79886 4.989601 8.675259       9.684824 
1 1 1 -8  26 28 o 48.85228 4.060799 29.65131       4.790617 33.29770       8.863671 28.14658       5.693907 50.73723 7.385501 47.34814 5.010765 3.389088       8.924875 
1 1 1 -8  26 29 o 39.13239 4.609611 19.27347       4.311552 11.97778       7.750481 22.54303       5.188483 30.04899 9.474163 42.20556 5.151305 -12.15657      10.78405 
1 1 1 -8  26 30 o 64.75779 6.097040 53.64753       9.508375 53.64753       9.508375 0.000000       0.000000 64.75779 6.097040 ?        ?        0.000000       6.097040 
1 1 1 -8  26 31 o 55.63779 3.836097 38.64287       5.169268 32.56150       8.335320 42.44354       6.589487 49.63100 7.093326 57.98125 4.704040 -8.350258      8.511361 
1 1 1 -8  26 32 o 31.50145 5.446894 12.98975       4.030106 16.86143       7.180236 11.20908       4.869468 34.53971 8.571399 28.65459 7.027880 5.885117       11.08422 
1 1 1 -8  26 33 o 64.73061 3.542587 52.48394       5.566824 63.63742       9.159076 45.94998       7.010273 70.06988 5.405708 59.84494 4.848457 10.22494       7.261488 
1 1 1 -8  26 34 o 27.89773 6.640150 10.85851       4.448750 9.460261       6.584640 12.03278       6.034288 25.61587 8.767081 28.63029 8.218683 -3.014423      12.01701 
1 1 1 -8  26 35 o 60.29612 4.238661 46.86037       6.188399 33.70323       11.35186 52.42378       7.381708 45.12876 10.51769 63.28986 4.822463 -18.16109      11.57056 
1 1 1 -8  26 36 o 15.64086 6.608613 1.549246       4.328390 7.281558       8.165519 -0.6909089     5.104554 22.89250 9.317921 14.90333 6.704945 7.989177       11.47954 
1 1 1 -8  26 37 o 20.19700 7.003507 5.959522       4.206661 16.10209       8.940336 3.075505       4.767370 29.27598 10.20651 17.26712 7.084732 12.00886       12.42442 
1 1 1 -8  26 38 o 46.59320 4.216727 28.88778       4.736001 32.56897       7.397356 26.33080       6.165190 46.73506 6.685516 42.60514 6.112985 4.129921       9.058958 
1 1 1 -8  26 39 o 19.37897 7.193011 5.856606       4.522511 5.656678       6.183625 6.086539       6.631421 19.47256 8.037353 19.91562 8.280952 -0.4430599     11.54007 
1 1 1 -8  26 40 o 19.70727 6.818816 6.390467       3.986772 7.909732       6.162196 5.296736       5.228462 20.76564 8.216129 18.41631 7.470840 2.349331       11.10487 
1 1 1 -8  26 41 o 21.33513 6.610957 7.720037       3.790869 8.142072       6.098527 7.454279       4.839418 20.36629 8.135829 20.18613 7.450197 0.1801605      11.03164 
1 1 1 -8  26 42 o 20.99820 7.032022 8.086171       4.235010 18.58108       6.999321 2.025046       5.319163 29.04898 8.979967 15.17077 6.833192 13.87820       11.28416 
1 1 1 -8  27 1  o 162.0921 3.372416 320.7862       13.32107 331.4127       18.62198 309.6500       19.06346 164.5394 4.648958 158.9950 4.926137 5.544357       6.773450 
1 1 1 -8  27 2  o 232.4950 4.062031 660.5569       23.01405 654.5287       32.00808 667.0086       33.11363 231.1071 5.683425 233.2662 5.825307 -2.159073      8.138520 
1 1 1 -8  27 3  o 260.0558 4.378980 826.8353       27.75080 844.7177       39.34930 809.1403       39.14264 262.4183 6.153282 256.8041 6.254782 5.614227       8.774119 
1 1 1 -8  27 4  o 14.25679 6.009289 0.2417747      3.564949 -1.215551      4.457625 2.827937       5.938178 14.66455 6.449555 20.39857 8.067134 -5.734021      10.32838 
1 1 1 -8  27 5  f 48.43991 4.438861 28.92865       5.181564 24.78507       5.715188 48.06085       12.28076 44.67245 5.356640 61.88166 8.357234 -17.20922      9.926579 
1 1 1 -8  27 6  o 134.8101 3.189099 221.8441       10.47675 225.4870       14.40562 217.7538       15.26437 135.7351 4.360815 133.3360 4.705186 2.399155       6.415254 
1 1 1 -8  27 7  o 262.4653 4.397508 842.3359       28.12643 797.2799       38.22765 895.5149       41.53091 254.9185 6.153753 270.1195 6.309275 -15.20093      8.813377 
1 1 1 -8  27 8  o 134.3520 3.843514 220.7209       12.57078 226.4568       21.81329 217.8687       15.38189 135.6177 6.620378 133.3565 4.740794 2.261246       8.142758 
1 1 1 -8  27 9  o 182.3254 4.187208 406.3978       18.60406 410.8101       32.39862 404.2272       22.72396 182.5522 7.297589 181.6130 5.139703 0.9392395      8.925881 
1 1 1 -8  27 10 o 118.3981 4.602052 171.7647       13.25271 179.2305       19.10990 164.8471       18.39486 120.6115 6.526109 115.6508 6.553795 4.960686       9.248910 
1 1 1 -8  27 11 o 254.9943 5.033810 796.2861       31.27975 840.3384       56.52900 776.8455       37.55273 260.4015 8.921412 251.5565 6.125898 8.844955       10.82212 
1 1 1 -8  27 12 o 130.0895 3.774177 206.9792       11.95202 234.2142       22.42364 196.1712       14.12586 137.8508 6.695167 126.5296 4.588878 11.32124       8.116838 
1 1 1 -8  27 13 o 154.6313 3.900427 292.4683       14.68584 0.000000       0.000000 292.4683       14.68584 ?        ?        154.6313 3.900427 0.000000       3.900427 
1 1 1 -8  27 14 o 137.6003 3.301353 231.2601       11.06999 258.0690       24.24231 224.1971       12.44306 144.6081 6.899218 135.3801 3.775379 9.228043       7.864648 
1 1 1 -8  27 15 o 91.13149 3.243204 101.5673       7.190943 99.88059       15.23308 102.0510       8.157012 89.75969 7.019987 91.30077 3.673739 -1.541077      7.923167 
1 1 1 -8  27 16 o 103.3962 2.956685 130.6482       7.442166 126.4563       12.62233 132.8819       9.214103 101.4200 5.123761 104.1987 3.634296 -2.778648      6.281802 
1 1 1 -8  27 17 f 163.8988 3.140679 328.1555       12.54399 320.4386       20.68509 332.6441       15.77583 161.5003 5.262940 164.8964 3.925951 -3.396057      6.565945 
1 1 1 -8  27 18 o 85.33475 3.294090 89.13009       6.837244 93.07823       11.18927 86.77747       8.637363 86.89917 5.309184 84.07540 4.229345 2.823769       6.787841 
1 1 1 -8  27 19 o 80.58135 3.030846 79.44610       5.941004 70.53377       10.33115 83.84948       7.261836 75.51954 5.654814 82.71715 3.611292 -7.197609      6.709571 
1 1 1 -8  27 20 o 62.05823 3.324676 47.22496       5.009526 36.93884       8.923625 51.95825       6.053373 54.23050 6.909120 65.03683 3.836503 -10.80633      7.902828 
1 1 1 -8  27 21 o 126.3822 2.951203 195.2221       9.089105 222.8218       16.50025 183.1995       10.89028 134.5286 5.042074 122.2729 3.658994 12.25564       6.229827 
1 1 1 -8  27 22 o 149.6718 3.067676 273.9707       11.18885 281.3961       19.42377 270.2832       13.68798 151.0455 5.285173 148.4694 3.786351 2.576172       6.501501 
1 1 1 -8  27 23 o 88.36182 2.954330 95.60887       6.352560 102.1419       11.83090 92.96229       7.530154 90.82516 5.369297 87.03111 3.558032 3.794052       6.441191 
1 1 1 -8  27 24 o 90.01325 3.153663 99.34229       6.906950 86.77036       15.94041 102.2482       7.663740 82.70164 8.009657 91.26588 3.452071 -8.564240      8.721891 
1 1 1 -8  27 25 o 33.76526 4.532358 14.30076       3.635227 11.93665       8.242514 14.87164       4.050435 30.59064 9.785243 34.34528 4.984974 -3.754637      10.98185 
1 1 1 -8  27 26 o 42.75700 4.012599 22.71521       4.132035 9.037257       11.23356 24.85538       4.443559 29.51198 11.25314 44.71879 4.124028 -15.20681      11.98503 
1 1 1 -8  27 27 f 31.12346 4.784718 12.28540       3.512934 9.880550       7.573387 12.94467       3.965329 28.00276 9.403997 31.83405 5.297634 -3.831299      10.79352 
1 1 1 -8  27 28 o 15.44449 5.808037 2.283744       2.968073 -0.2141873     6.839345 2.863335       3.294465 18.70041 8.110646 16.68748 6.149095 2.012926       10.17811 
1 1 1 -8  27 29 o 25.16062 7.234431 8.399746       4.671902 9.208366       7.520029 7.891469       5.962074 26.92404 9.362329 24.87555 8.343739 2.048491       12.54078 
1 1 1 -8  27 30 o 49.14536 3.999499 30.26560       4.748503 34.42126       8.483567 28.36964       5.730234 51.06873 7.000997 47.18036 5.063077 3.888371       8.639948 
1 1 1 -8  27 31 o 48.49937 3.942011 29.58035       4.618835 39.84547       8.301176 24.97733       5.558770 55.10744 6.294241 43.98943 5.291681 11.11802       8.223100 
1 1 1 -8  27 32 o 44.98886 4.172220 25.71970       4.522016 23.94804       7.400681 26.77525       5.712430 41.53452 7.591493 45.37574 5.263618 -3.841225      9.237773 
1 1 1 -8  27 33 o 68.05695 3.596970 58.35523       5.944297 56.59390       9.114722 59.65878       7.841278 65.35494 5.782678 67.98486 4.763158 -2.629921      7.491798 
1 1 1 -8  27 34 o 36.86050 5.556026 18.34467       4.835774 17.10080       9.860134 18.73861       5.548944 31.60128 10.73004 36.67371 6.444021 -5.072437      12.51636 
1 1 1 -8  27 35 o 56.59281 4.008934 41.41986       5.492954 37.82957       8.550145 43.94309       7.167813 51.16429 7.044338 57.20106 5.198909 -6.036774      8.755075 
1 1 1 -8  27 36 o 35.64872 5.814954 17.88490       4.877595 18.05849       9.044283 17.81370       5.792092 31.09952 10.27250 34.44581 7.135103 -3.346294      12.50735 
1 1 1 -8  27 37 o 37.88471 5.051372 19.79515       4.547365 26.46043       7.539574 15.98422       5.701019 40.79554 7.869150 31.83110 7.477524 8.964441       10.85527 
1 1 1 -8  27 38 o 17.12056 6.949966 3.681638       4.528407 2.114792       6.111663 5.588949       6.743059 16.95961 7.501439 19.68154 8.278453 -2.721930      11.17159 
1 1 1 -8  27 39 f 12.50772 5.702510 -0.6244965     3.842713 -3.605395      5.913175 1.554663       5.055820 13.43728 6.421043 15.38814 6.813760 -1.950860      9.362538 
1 1 1 -8  27 40 o 17.52260 6.551441 4.889870       3.764999 1.695327       5.853032 7.144706       4.917383 15.71463 7.114513 19.93068 7.479909 -4.216052      10.32305 
1 1 1 -8  27 41 o 13.37910 5.926827 1.060713       3.829478 2.639583       6.272205 0.1223801      4.835322 16.14502 7.331374 13.70100 6.302418 2.444011       9.667963 
1 1 1 -8  28 1  o 141.4932 2.972484 244.3699       10.24923 232.7990       15.20523 254.0049       13.87512 137.8675 4.531953 144.1036 3.954909 -6.236084      6.014973 
1 1 1 -8  28 2  f 121.0021 2.852172 178.6888       8.410172 178.9220       12.71239 178.5072       11.21534 120.8777 4.322599 120.8038 3.814526 0.7390594E-01  5.765022 
1 1 1 -8  28 3  o 182.7500 4.133529 408.3164       18.40833 397.9745       21.83941 433.6943       34.21127 180.2156 4.977699 187.4701 7.503767 -7.254486      9.004665 
1 1 1 -8  28 4  o 102.2886 3.649625 127.9855       9.082699 125.5042       14.52317 129.5794       11.63987 100.9669 5.928734 102.7987 4.658589 -1.831818      7.540049 
1 1 1 -8  28 5  o 149.2771 3.298037 272.1064       11.99733 264.5126       16.22089 281.2775       17.82606 146.9680 4.534566 151.5066 4.834418 -4.538605      6.628264 
1 1 1 -8  28 6  o 50.64213 3.659438 31.49515       4.485629 28.36946       5.742128 36.38899       7.184969 47.87654 4.995079 54.20812 5.515810 -6.331581      7.441436 
1 1 1 -8  28 7  o 88.57732 2.831532 95.85245       6.104104 107.2047       9.349495 87.41850       8.058639 93.54945 4.111239 84.47980 3.925197 9.069649       5.684141 
1 1 1 -8  28 8  o 114.3656 3.256305 159.8457       9.065972 130.8222       16.75633 171.8583       10.78009 102.9252 6.717393 118.5333 3.736705 -15.60818      7.686763 
1 1 1 -8  28 9  o 30.21645 6.173355 11.61678       4.391951 7.245349       8.415899 13.25288       5.148654 26.82103 9.837376 32.23282 6.770515 -5.411787      11.94210 
1 1 1 -8  28 10 o 152.1767 3.422131 282.8839       12.69056 282.5182       25.31307 283.0066       14.66697 151.3425 6.881541 152.0931 3.960630 -0.7506409     7.939911 
1 1 1 -8  28 11 o 131.8675 3.832932 212.7538       12.30393 0.000000       0.000000 212.7538       12.30393 ?        ?        131.8675 3.832932 0.000000       3.832932 
1 1 1 -8  28 12 o 72.92084 3.998647 65.22355       7.078405 0.000000       0.000000 65.22355       7.078405 ?        ?        72.92084 3.998647 0.000000       3.998647 
1 1 1 -8  28 13 o 64.15240 3.674535 50.47250       5.720460 65.09282       11.68094 45.85983       6.561090 72.40056 6.696499 61.04535 4.440866 11.35521       8.035197 
1 1 1 -8  28 14 o 48.13943 4.036304 28.54929       4.691453 29.04127       8.214760 28.31116       5.715149 47.98639 7.250847 47.79971 4.979350 0.1866798      8.795948 
1 1 1 -8  28 15 o 65.00175 3.427730 51.78621       5.410408 36.20132       9.275840 59.82248       6.660836 53.66048 7.281214 69.81593 3.930935 -16.15545      8.274559 
1 1 1 -8  28 16 o 176.3405 3.261498 380.0282       14.01539 390.7005       23.57735 374.1961       17.42910 178.2442 5.434395 174.8318 4.090896 3.412415       6.802064 
1 1 1 -8  28 17 o 134.3689 3.343845 220.7230       10.94916 225.7380       16.75876 216.9880       14.46265 135.4991 5.084407 132.9801 4.469332 2.518982       6.769500 
1 1 1 -8  28 18 o 22.37205 6.499779 6.305216       3.753143 7.460488       7.332608 5.895114       4.368798 26.04300 9.230031 22.10686 7.129077 3.936142       11.66264 
1 1 1 -8  28 19 o 77.53945 3.057172 73.61076       5.765363 85.64814       10.43285 68.31856       6.917586 83.29623 5.165154 74.59325 3.818267 8.702972       6.423237 
1 1 1 -8  28 20 o 56.30794 3.540915 38.96936       4.834112 54.17063       9.314827 33.36609       5.655303 65.99491 5.852618 51.93547 4.513205 14.05944       7.390681 
1 1 1 -8  28 21 o 60.18718 3.393373 44.49339       4.956888 25.96165       8.921943 52.76771       5.961664 44.79863 8.483084 65.50694 3.750272 -20.70830      9.275087 
1 1 1 -8  28 22 o 72.38647 3.116389 64.25895       5.484367 58.41338       10.14987 66.66944       6.517776 68.35794 6.159040 73.64808 3.642939 -5.290138      7.155751 
1 1 1 -8  28 23 o 162.1178 3.162112 321.9889       12.49234 327.1902       21.71741 319.4169       15.27187 162.4425 5.494116 161.2447 3.886608 1.197830       6.729861 
1 1 1 -8  28 24 o 20.78622 6.289320 5.445011       3.457116 -0.8380662     7.829000 6.966915       3.853130 19.80821 8.633360 23.26653 6.530456 -3.458326      10.82505 
1 1 1 -8  28 25 o 75.47563 3.029860 69.99252       5.561371 71.43604       10.55886 69.43832       6.542404 75.43224 5.788350 75.05035 3.587633 0.3818970      6.810000 
1 1 1 -8  28 26 f 30.54078 4.921179 11.87546       3.538122 13.82151       7.862346 11.38130       3.961955 32.07586 9.432453 29.69070 5.682797 2.385164       11.01206 
1 1 1 -8  28 27 o 52.09163 4.335318 33.91187       5.453483 27.39360       8.756309 38.04241       6.970409 45.31048 8.233418 54.87478 5.277542 -9.564301      9.779654 
1 1 1 -8  28 28 o 93.02155 4.766378 108.5906       10.76856 94.36102       16.99804 118.1303       13.91776 84.16985 8.399196 96.25256 5.962918 -12.08271      10.30062 
1 1 1 -8  28 29 o 49.42122 3.391602 30.38560       4.059883 28.13664       8.042280 31.15474       4.703151 45.80952 7.460745 49.88234 3.900048 -4.072815      8.418616 
1 1 1 -8  28 30 o 35.52314 4.181441 16.03059       3.550452 17.74999       7.388231 15.51429       4.048570 35.34905 8.648847 34.66889 4.930974 0.6801605      9.955754 
1 1 1 -8  28 31 o 50.09844 3.481478 31.48211       4.223900 23.21977       8.031098 34.64155       4.966257 40.26037 8.455309 52.36668 3.920137 -12.10632      9.319857 
1 1 1 -8  28 32 o 58.18086 3.696051 42.77769       5.213186 37.88923       8.497416 45.72813       6.601537 52.58914 6.788858 59.59985 4.580421 -7.010712      8.189557 
1 1 1 -8  28 33 o 30.55569 5.861377 12.83739       4.205715 9.866267       7.094249 14.44746       5.222386 25.54256 9.076179 31.77978 6.938468 -6.237217      11.42451 
1 1 1 -8  28 34 o 25.81163 6.639919 9.707356       4.200249 6.449435       7.258262 11.34765       5.150197 22.00570 8.846636 27.38055 7.499314 -5.374855      11.59753 
1 1 1 -8  28 35 o 33.06957 6.192194 15.67754       4.806754 12.30075       9.328181 16.89832       5.608726 26.18556 10.18327 33.61262 7.071778 -7.427057      12.39794 
1 1 1 -8  28 36 o 27.32400 6.323151 11.08381       4.126827 6.895518       6.357024 14.13455       5.425479 21.24927 8.364352 29.91560 7.466349 -8.666327      11.21199 
1 1 1 -8  28 37 o 43.81021 5.330980 27.16219       5.574369 27.90527       7.778525 26.37766       7.992527 41.02628 8.067991 39.06249 8.626984 1.963795       11.81175 
1 1 1 -8  28 38 o 16.84920 6.664276 3.932225       4.052941 10.18430       6.605974 0.1582829      5.132422 22.97525 8.659472 14.58477 6.626417 8.390477       10.90394 
1 1 1 -8  28 39 o 21.55588 6.702276 7.819606       3.892577 -0.7318162     6.141085 13.56287       5.032750 14.70211 6.878058 27.96577 7.305915 -13.26366      10.03415 
1 1 1 -8  28 40 o 14.93640 6.242025 2.759507       3.795771 5.600818       6.313364 1.151013       4.750192 18.12552 7.826883 14.34485 6.459621 3.780667       10.14824 
1 1 1 -8  29 1  o 57.90267 3.346824 41.09011       4.702328 41.02275       6.700351 41.15548       6.600955 57.67645 4.810972 57.78191 4.729244 -0.1054611     6.746198 
1 1 1 -8  29 2  o 122.8470 3.801352 184.6521       11.36622 180.4270       17.90824 187.5022       14.70850 121.0352 6.091207 123.6238 4.892022 -2.588654      7.812470 
1 1 1 -8  29 3  o 115.5272 3.165915 163.1071       8.904510 172.4152       12.48359 153.4658       12.70509 118.6292 4.325532 111.8591 4.671187 6.770096       6.366335 
1 1 1 -8  29 4  o 189.1547 3.287724 437.0120       15.15474 426.3457       23.02620 445.1629       20.12889 186.4529 5.072482 190.7409 4.330519 -4.287933      6.669593 
1 1 1 -8  29 5  o 56.16859 3.734761 38.73055       5.082982 46.76784       6.867973 28.99618       7.558364 61.63739 4.605742 48.10779 6.622832 13.52960       8.066893 
1 1 1 -8  29 6  o 19.78917 6.440352 4.649775       3.560633 10.50223       4.917864 -1.798144      5.161993 28.63625 7.086231 15.47633 6.867174 13.15992       9.867764 
1 1 1 -8  29 7  o 249.4751 3.847773 760.9235       23.39229 802.9648       37.65953 734.5126       29.84889 255.6362 6.045280 244.8197 5.003175 10.81653       7.847112 
1 1 1 -8  29 8  o 148.3780 3.939721 269.4200       14.23268 273.8042       24.77562 267.2605       17.38808 148.9350 6.844699 147.6190 4.840172 1.315994       8.383148 
1 1 1 -8  29 9  o 74.18369 3.658381 67.43186       6.593132 70.96384       13.43184 66.31073       7.567532 75.47282 7.398064 73.49136 4.243583 1.981461       8.528737 
1 1 1 -8  29 10 o 78.39084 4.041782 75.37574       7.694945 0.000000       0.000000 75.37574       7.694945 ?        ?        78.39084 4.041782 0.000000       4.041782 
1 1 1 -8  29 11 o 39.37217 5.428513 19.38088       5.069957 18.18476       10.25567 19.76774       5.832503 37.58659 10.69031 39.61444 6.248662 -2.027851      12.38259 
1 1 1 -8  29 12 o 158.2121 3.482551 305.9816       13.42682 319.6079       27.94233 301.8907       15.31022 160.7081 7.152840 157.0186 4.004504 3.689468       8.197510 
1 1 1 -8  29 13 o 107.6208 3.324437 141.6923       8.708222 132.9917       17.54322 144.5371       10.03134 103.5437 6.993665 108.6311 3.795215 -5.087379      7.957072 
1 1 1 -8  29 14 o 83.88344 3.201431 86.11420       6.532187 88.86408       11.56459 84.82578       7.915904 84.83031 5.626053 83.16140 3.917102 1.668915       6.855375 
1 1 1 -8  29 15 o 28.29502 6.232900 10.24871       4.181417 17.28427       7.705075 7.311747       4.978250 36.52717 8.767681 24.34377 7.581178 12.18340       11.59079 
1 1 1 -8  29 16 o 123.0702 3.348922 185.3591       10.03437 180.7782       15.10576 188.9767       13.42411 121.1827 5.126819 124.0603 4.447540 -2.877571      6.787112 
1 1 1 -8  29 17 f 44.37556 4.284760 24.36976       4.575912 31.87650       8.613970 21.41859       5.401001 50.19540 7.252111 41.35581 5.495083 8.839588       9.098849 
1 1 1 -8  29 18 o 79.84688 3.079323 78.08019       5.980459 77.98145       10.65904 78.12556       7.224794 79.34532 5.547601 79.77589 3.726658 -0.4305725     6.683103 
1 1 1 -8  29 19 o 60.43829 3.410396 44.86522       5.002504 41.64575       9.082705 46.26712       5.993497 57.58466 6.591120 61.28178 4.035870 -3.697117      7.728590 
1 1 1 -8  29 20 o 86.92855 3.007037 92.57168       6.360377 87.83438       11.07598 94.90247       7.769061 84.15750 5.429715 87.90905 3.634432 -3.751549      6.533827 
1 1 1 -8  29 21 o 66.93207 3.260704 55.01833       5.302405 62.08809       10.17045 52.37942       6.213703 70.48599 5.977399 65.18595 3.929905 5.300041       7.153563 
1 1 1 -8  29 22 f 112.9034 2.949054 156.2297       8.106880 144.9711       14.07978 161.8134       9.915418 108.0260 5.365285 114.7550 3.549981 -6.728973      6.433402 
1 1 1 -8  29 23 o 76.49778 3.279551 71.96239       6.099432 71.31329       14.77118 72.09582       6.697052 74.36012 8.292484 76.49648 3.602700 -2.136368      9.041280 
1 1 1 -8  29 24 o 61.64915 3.252416 46.82563       4.868892 50.36036       9.406798 45.53215       5.690437 63.05350 6.202237 60.64978 3.870369 2.403725       7.310780 
1 1 1 -8  29 25 o 41.64408 3.988635 21.62641       3.998334 22.06457       7.984683 21.47977       4.619192 40.63375 8.343296 41.32824 4.668121 -0.6944962     9.560436 
1 1 1 -8  29 26 o 39.69481 5.016128 20.00599       4.744047 25.48456       8.025331 17.06325       5.881731 43.77025 7.810538 35.95647 6.964242 7.813778       10.46447 
1 1 1 -8  29 27 o 43.78442 4.233747 24.09534       4.461027 16.90651       7.602349 27.87059       5.509244 34.88920 8.911048 46.88873 4.893505 -11.99953      10.16628 
1 1 1 -8  29 28 o 17.84778 6.079574 3.869343       3.165703 1.362980       6.891557 4.539657       3.563975 19.48073 8.289352 19.13943 6.451250 0.3413067      10.50390 
1 1 1 -8  29 29 o 89.97413 3.160782 100.4990       6.919477 98.20721       16.14129 101.0150       7.658901 84.97541 7.884805 90.01830 3.498058 -5.042892      8.625923 
1 1 1 -8  29 30 o 48.72474 3.847156 30.00229       4.530953 10.32911       10.71208 34.28892       5.000275 27.71019 10.87282 52.04737 3.972396 -24.33718      11.57575 
1 1 1 -8  29 31 o 47.86930 3.570693 28.95838       4.135289 19.96305       7.627457 32.70315       4.921344 36.57629 8.687238 50.64816 4.020308 -14.07188      9.572408 
1 1 1 -8  29 32 o 12.25941 5.517687 -1.051830      3.460807 1.616106       6.199530 -2.259615      4.171247 17.99643 7.763490 12.65889 5.834121 5.337548       9.711269 
1 1 1 -8  29 33 f 35.57169 5.282386 17.19755       4.440162 0.000000       0.000000 17.19755       4.440162 ?        ?        35.57169 5.282386 0.000000       5.282386 
1 1 1 -8  29 34 o 20.07329 7.081069 5.799239       4.311591 -5.733828      8.598392 9.673251       4.983395 16.21422 7.746614 24.94896 7.551561 -8.734739      10.81832 
1 1 1 -8  29 35 o 35.19258 5.157668 17.15295       4.292001 20.61344       7.232458 15.27181       5.332465 35.16136 8.529204 31.51386 7.112981 3.647497       11.10594 
1 1 1 -8  29 36 o 28.80015 6.482949 12.66260       4.439852 -0.2379896     6.997996 21.35375       5.743909 16.40091 7.557971 37.63259 6.498201 -21.23168      9.967423 
1 1 1 -8  29 37 o 16.32589 6.548463 3.461583       3.967525 4.734351       6.133392 2.545793       5.202644 18.45574 7.835391 16.32236 7.076612 2.133379       10.55802 
1 1 1 -8  29 38 o 19.97940 6.897160 6.751908       4.077985 8.988793       6.660663 5.410642       5.157665 21.28968 8.503256 18.31763 7.424002 2.972057       11.28810 
1 1 1 -8  29 39 o 11.03031 5.231385 -2.430021      3.777786 -2.915422      6.293083 -2.156544      4.723596 13.67461 6.558389 12.42281 5.879386 1.251804       8.807931 
1 1 1 -8  30 1  o 139.4159 4.706019 238.4525       15.96538 261.2507       22.58388 215.6763       22.57303 145.5263 6.383796 132.0186 7.041948 13.50771       9.504835 
1 1 1 -8  30 2  o 80.96366 3.038571 80.17223       5.984452 78.52351       8.691454 81.65852       8.252206 79.94838 4.479057 81.57807 4.164857 -1.629692      6.116207 
1 1 1 -8  30 3  o 90.81065 2.968478 100.8143       6.560287 114.7615       9.856031 89.71986       8.790435 96.74239 4.190641 85.51098 4.231589 11.23141       5.955486 
1 1 1 -8  30 4  o 84.77031 3.254708 87.92460       6.710955 97.36929       9.100616 76.66702       9.935721 89.09370 4.203530 78.88201 5.197711 10.21169       6.684749 
1 1 1 -8  30 5  o 61.64792 3.312271 46.57120       4.957730 55.39422       7.362228 39.25055       6.706183 67.09766 4.529163 56.36827 4.931700 10.72939       6.695893 
1 1 1 -8  30 6  o 217.7164 3.567228 579.4809       18.92597 574.5609       29.11904 583.0795       24.90339 216.2157 5.531088 218.1279 4.685016 -1.912231      7.248607 
1 1 1 -8  30 7  f 173.2730 3.191208 366.8190       13.47480 319.5727       19.50620 409.9441       18.63605 161.3428 4.967117 182.9976 4.179000 -21.65471      6.491247 
1 1 1 -8  30 8  o 88.88940 3.394007 96.71620       7.338379 73.69658       13.52787 106.3146       8.735341 76.88060 7.308452 93.14169 3.856917 -16.26109      8.263733 
1 1 1 -8  30 9  o 93.99017 3.927903 108.2882       8.976789 0.000000       0.000000 108.2882       8.976789 ?        ?        93.99017 3.927903 0.000000       3.927903 
1 1 1 -8  30 10 o 36.28987 5.627110 16.56245       4.815280 9.625061       9.009776 19.33636       5.697209 29.23069 10.24223 39.16495 6.173582 -9.934259      11.95894 
1 1 1 -8  30 11 o 154.6198 3.478883 292.3334       13.10814 305.3356       27.00033 288.3239       14.99362 156.9984 7.075470 153.4140 4.014012 3.584335       8.134775 
1 1 1 -8  30 12 o 59.39891 4.087974 43.41036       5.881202 39.22237       11.45895 44.90807       6.852594 55.46026 8.769925 60.32755 4.698279 -4.867283      9.949142 
1 1 1 -8  30 13 o 19.47871 7.109745 3.838540       4.387814 10.48261       8.972389 1.750116       5.030374 29.91963 10.23411 18.09764 7.332920 11.82200       12.59003 
1 1 1 -8  30 14 o 55.69696 4.090251 38.21747       5.512874 34.14515       11.23290 39.50957       6.327298 51.44875 9.301735 56.54958 4.632037 -5.100830      10.39125 
1 1 1 -8  30 15 o 83.61771 3.525176 85.73296       7.167039 90.05640       11.35324 82.86851       9.241143 85.32813 5.489105 82.01563 4.642695 3.312500       7.189220 
1 1 1 -8  30 16 o 23.38951 6.692210 6.948280       4.007269 4.264062       7.370206 8.074829       4.774696 23.11615 9.033878 25.21391 7.332850 -2.097761      11.63536 
1 1 1 -8  30 17 o 150.2539 3.104444 276.2174       11.36699 284.9079       19.37230 271.6542       14.03753 151.9344 5.240098 148.7872 3.874885 3.147186       6.517159 
1 1 1 -8  30 18 o 77.74308 3.117412 74.09792       5.894006 75.90089       10.41110 73.24751       7.150161 78.18456 5.499442 77.17725 3.813622 1.007317       6.692352 
1 1 1 -8  30 19 o 61.49004 3.396734 46.48714       5.070045 51.67120       9.714872 44.54668       5.943670 64.16951 6.293439 60.06760 4.084791 4.101906       7.502859 
1 1 1 -8  30 20 o 85.59653 3.015625 89.85899       6.280447 94.29372       11.16241 87.80481       7.597007 87.10716 5.283419 84.47193 3.699547 2.635231       6.449896 
1 1 1 -8  30 21 o 127.8464 3.290292 200.7280       10.24231 213.0734       23.43487 197.8130       11.38749 129.6574 7.448358 126.7859 3.689632 2.871468       8.312124 
1 1 1 -8  30 22 o 25.27863 6.051241 8.312644       3.678047 9.267596       7.340403 7.992507       4.250075 27.34694 9.258319 24.77879 6.822822 2.568151       11.50076 
1 1 1 -8  30 23 o 68.59450 3.222463 57.97155       5.371525 57.54492       9.598500 58.16608       6.481491 67.47720 5.896455 68.53545 3.896878 -1.058258      7.067803 
1 1 1 -8  30 24 o 39.97530 5.033480 20.25405       4.794921 30.04412       8.181277 15.13170       5.917831 47.96632 7.223098 33.73155 7.402908 14.23477       10.34293 
1 1 1 -8  30 25 o 31.19279 6.128840 12.75611       4.492501 10.59080       7.312943 14.06861       5.693516 28.22959 9.232610 32.37949 7.380361 -4.149908      11.81993 
1 1 1 -8  30 26 o 17.33986 6.303971 3.305204       3.444731 6.353272       7.026037 2.340674       3.952354 23.74137 8.934381 16.76100 6.595999 6.980371       11.10542 
1 1 1 -8  30 27 o 42.69226 3.911408 22.92413       4.024114 14.59285       7.938820 25.80495       4.668290 31.89672 9.503506 45.17633 4.291929 -13.27961      10.42772 
1 1 1 -8  30 28 o 27.24116 5.484080 9.843725       3.514422 10.98439       7.332196 9.503505       4.004385 27.84069 9.251154 26.47516 6.298654 1.365526       11.19182 
1 1 1 -8  30 29 o 11.05181 5.025521 -1.474834      2.959865 -6.746016      6.267398 0.3828997E-01  3.357922 13.88462 6.628150 13.18395 5.700620 0.7006683      8.742393 
1 1 1 -8  30 30 o 17.52241 6.216744 3.804906       3.327186 -9.012701      6.098913 9.235892       3.969980 12.67070 6.167467 25.73590 6.365789 -13.06520      8.863460 
1 1 1 -8  30 31 o 21.41796 7.086931 6.473319       4.304078 -3.179184      9.143925 9.220649       4.878295 18.24865 8.489079 25.01775 7.448693 -6.769093      11.29369 
1 1 1 -8  30 32 f 21.18812 6.777318 6.489365       3.953990 0.000000       0.000000 6.489365       3.953990 ?        ?        21.18812 6.777318 0.000000       6.777318 
1 1 1 -8  30 33 o 38.60766 4.595646 19.91080       4.238943 31.67152       10.96785 17.84558       4.596085 41.42148 10.76761 35.93963 5.415873 5.481853       12.05293 
1 1 1 -8  30 34 o 16.49144 6.147640 3.523847       3.310286 3.736376       6.133978 3.436517       3.932014 18.58063 7.859744 16.80958 6.589851 1.771053       10.25679 
1 1 1 -8  30 35 f 44.03480 3.853471 25.63428       4.093456 28.15973       7.489803 24.55861       4.888089 41.88488 7.618553 42.16996 4.844523 -0.2850761     9.028386 
1 1 1 -8  30 36 o 23.59399 6.621837 8.924872       3.961885 9.153335       6.914845 8.813222       4.833997 22.04984 8.709962 22.63223 7.511317 -0.5823956     11.50145 
1 1 1 -8  30 37 o 21.92205 7.041981 8.254014       4.265518 8.075011       6.712475 8.375256       5.524333 20.59815 8.423950 21.22630 7.935933 -0.6281528     11.57333 
1 1 1 -8  30 38 f 29.60031 6.125307 13.90813       4.272593 16.41015       7.089204 12.48088       5.354293 27.36260 9.096695 25.66176 7.839827 1.700832       12.00886 
1 1 1 -8  31 1  o 127.2866 2.964673 197.9284       9.195926 188.2942       13.47059 206.3368       12.58458 123.8651 4.470070 129.7653 3.984362 -5.900253      5.988044 
1 1 1 -8  31 2  o 82.45037 3.277807 83.22427       6.572729 83.61912       8.710100 82.70206       10.01675 82.49854 4.347871 81.92693 5.041652 0.5716171      6.657495 
1 1 1 -8  31 3  o 28.06970 5.547225 10.01973       3.659873 13.83826       5.013319 5.662513       5.355270 32.94311 6.475860 22.59367 7.897837 10.34944       10.21335 
1 1 1 -8  31 4  o 79.90523 3.013661 78.11501       5.857694 90.93184       9.070681 68.94621       7.671950 86.04111 4.340128 74.90915 4.219824 11.13196       6.053398 
1 1 1 -8  31 5  f 129.6749 2.949448 205.4205       9.320357 208.2607       14.13315 203.2347       12.39849 130.2768 4.458371 128.7903 3.955168 1.486588       5.959901 
1 1 1 -8  31 6  o 14.27965 5.862669 0.8267594      3.267184 0.2612840      4.402300 1.520113       4.874726 15.75317 6.660860 17.66368 7.195809 -1.910512      9.805443 
1 1 1 -8  31 7  o 79.63605 3.032364 77.60220       5.873987 78.55006       8.602334 76.77416       8.040266 79.92991 4.433798 79.05692 4.188388 0.8729935      6.099275 
1 1 1 -8  31 8  o 42.04538 6.245368 22.25953       6.204898 0.000000       0.000000 22.25953       6.204898 ?        ?        42.04538 6.245368 0.000000       6.245368 
1 1 1 -8  31 9  o 65.19209 3.776419 52.19757       5.973766 48.02692       11.43558 53.76281       7.005623 61.71838 7.775598 66.07725 4.375337 -4.358868      8.922078 
1 1 1 -8  31 10 o 27.85941 6.827679 9.983709       4.598609 0.6689933E-01  8.233311 14.48011       5.543970 21.11217 9.024251 33.59164 6.999954 -12.47947      11.42088 
1 1 1 -8  31 11 o 126.8870 3.398263 197.1205       10.49830 204.2523       21.40458 194.8614       12.04682 128.2225 6.875391 126.0558 3.926480 2.166664       7.917591 
1 1 1 -8  31 12 o 67.52539 3.782386 56.02621       6.199116 55.44862       12.49014 56.21500       7.140694 66.25980 7.890179 67.54666 4.361421 -1.286865      9.015371 
1 1 1 -8  31 13 o 65.42256 4.274540 52.74540       6.777478 55.79555       12.32502 51.42329       8.114474 66.46940 7.754535 64.41631 5.213784 2.053093       9.344322 
1 1 1 -8  31 14 o 75.93508 3.596889 70.79508       6.636962 101.1722       14.79315 63.13958       7.426329 90.01221 6.794247 71.58646 4.276529 18.42575       8.028107 
1 1 1 -8  31 15 o 76.01552 3.500386 70.94449       6.466763 76.35129       13.98409 69.47374       7.293462 77.85436 7.462046 75.13480 3.997814 2.719559       8.465498 
1 1 1 -8  31 16 o 86.53323 3.115337 91.79073       6.558656 100.5199       12.02225 88.09196       7.825786 89.99710 5.508157 84.64359 3.803722 5.353508       6.693884 
1 1 1 -8  31 17 o 68.42882 3.290026 57.51802       5.470162 72.33013       10.44447 51.91931       6.421286 76.18865 5.666049 64.86021 4.083355 11.32845       6.984118 
1 1 1 -8  31 18 o 92.02213 3.008784 103.8478       6.738064 115.2181       12.20075 98.85795       8.082433 96.32561 5.217142 89.63108 3.708399 6.694534       6.400843 
1 1 1 -8  31 19 o 48.21706 3.825684 28.78103       4.458346 25.15288       8.179605 30.31447       5.317688 43.91675 7.935006 49.35430 4.469833 -5.437553      9.107345 
1 1 1 -8  31 20 o 65.97072 3.642464 53.71819       5.833023 52.95827       14.30234 53.86981       6.388470 63.20592 9.586065 65.97926 3.991994 -2.773338      10.38406 
1 1 1 -8  31 21 o 10.77011 5.221750 -6.937544      4.258448 -4.594785      7.244120 -8.174611      5.264031 16.82036 7.728824 12.09586 5.850399 4.724502       9.693394 
1 1 1 -8  31 22 o 85.06813 3.609572 89.44055       7.465698 83.10493       11.20266 94.50236       10.01335 81.13762 5.702128 87.00532 4.740686 -5.867699      7.415414 
1 1 1 -8  31 23 o 44.71469 4.692015 25.21033       5.036582 27.41805       8.106209 23.82216       6.427871 45.50887 7.575666 42.86788 6.344495 2.640995       9.881465 
1 1 1 -8  31 24 o 38.42998 4.235931 18.61180       3.901208 20.19945       7.416083 18.00436       4.587198 38.51065 8.156537 37.49608 5.156675 1.014568       9.649891 
1 1 1 -8  31 25 o 79.70683 3.315346 78.79897       6.425564 76.49738       10.62631 80.12561       8.067602 77.22848 5.686235 79.97765 4.153656 -2.749168      7.041741 
1 1 1 -8  31 26 f 87.39911 2.972542 94.58131       6.321769 88.92320       11.21094 97.21925       7.654880 83.09851 5.568352 88.30408 3.564635 -5.205574      6.611593 
1 1 1 -8  31 27 o 15.03338 5.874740 2.018411       3.116640 12.82807       7.155703 -0.5122580     3.462294 29.65058 9.064122 12.91865 5.682804 16.73193       10.69825 
1 1 1 -8  31 28 o 14.14164 5.771772 1.321921       3.143331 5.769202       6.739276 0.8543286E-01  3.553539 22.19090 8.648257 13.54715 5.860992 8.643757       10.44718 
1 1 1 -8  31 29 o 25.66826 6.228990 9.191205       3.856271 6.361746       6.205000 10.97175       4.922281 22.11502 8.379690 27.57553 7.235683 -5.460505      11.07133 
1 1 1 -8  31 30 o 34.94537 5.208982 16.42957       4.300551 16.63798       7.037693 16.30537       5.432916 32.55927 8.702868 33.71355 6.846879 -1.154282      11.07338 
1 1 1 -8  31 31 o 18.67624 6.790073 4.652488       3.996516 0.000000       0.000000 4.652488       3.996516 ?        ?        18.67624 6.790073 0.000000       6.790073 
1 1 1 -8  31 32 o 29.11520 5.709055 11.97766       3.905782 1.327055       9.187665 14.32701       4.315108 19.47673 8.855611 31.86287 5.769756 -12.38614      10.56939 
1 1 1 -8  31 33 o 21.59950 6.301924 6.968081       3.521478 2.367472       6.682546 8.736805       4.143471 17.97851 7.902262 23.85474 6.798412 -5.876230      10.42421 
1 1 1 -8  31 34 o 37.82574 4.218146 19.25468       3.822081 20.32523       7.059560 18.81076       4.545973 34.23952 8.500324 36.46897 5.267726 -2.229454      10.00022 
1 1 1 -8  31 35 o 30.02794 5.921577 13.56185       4.179060 5.372672       6.512264 19.29527       5.449020 19.04839 8.079842 35.17920 6.598512 -16.13081      10.43188 
1 1 1 -8  31 36 o 14.46069 5.950175 2.331778       3.375120 -1.585854      6.169567 4.004965       4.031950 14.42330 6.793633 16.69615 6.633147 -2.272855      9.494845 
1 1 1 -8  31 37 o 21.21065 6.351504 7.454445       3.539175 3.251855       6.349633 9.348533       4.262753 16.81195 7.527561 23.13105 6.980573 -6.319094      10.26609 
1 1 1 -8  32 1  o 29.44253 7.101140 11.17788       5.035510 13.95178       7.310258 8.673338       6.946250 32.81992 8.912313 26.95922 9.005538 5.860704       12.67001 
1 1 1 -8  32 2  o 94.37606 3.410461 109.1222       7.830624 127.8389       14.92163 102.0086       9.199123 101.5852 6.055151 91.12181 4.153666 10.46339       7.342874 
1 1 1 -8  32 3  o 131.0679 3.992774 210.7114       12.73798 0.000000       0.000000 210.7114       12.73798 ?        ?        131.0679 3.992774 0.000000       3.992774 
1 1 1 -8  32 4  f 105.1003 2.945308 135.1183       7.536023 124.4423       10.96763 144.6669       10.37236 100.5966 4.485251 108.5910 3.926117 -7.994385      5.960861 
1 1 1 -8  32 5  o 94.59236 2.944147 109.4732       6.778328 113.1197       10.03014 106.4080       9.196083 95.93492 4.301301 93.08343 4.063893 2.851494       5.917468 
1 1 1 -8  32 6  o 121.1038 3.300495 179.5522       9.731234 191.5394       18.12383 174.6964       11.53500 124.4142 5.995481 119.3263 3.972383 5.087898       7.192053 
1 1 1 -8  32 7  o 58.29066 4.412244 41.93795       6.220958 46.71469       8.748332 37.05171       8.848042 61.23689 5.936803 54.26098 6.843402 6.975910       9.059678 
1 1 1 -8  32 8  o 100.9342 2.966882 124.6624       7.289591 127.8361       10.96914 122.1523       9.755353 101.9484 4.425806 99.73387 4.022129 2.214485       5.980408 
1 1 1 -8  32 9  o 116.4075 3.407970 166.0181       9.657061 159.1341       19.09958 168.3824       11.19324 112.9825 6.971025 117.1293 3.927070 -4.146767      8.001066 
1 1 1 -8  32 10 o 65.29115 3.787277 52.42524       5.999973 52.79859       11.86353 52.29692       6.955035 64.61517 7.684674 65.10441 4.409844 -0.4892426     8.860076 
1 1 1 -8  32 11 o 76.57397 3.605959 72.00858       6.709905 58.10789       12.45138 77.69738       7.965441 67.79021 7.671959 79.45311 4.128144 -11.66290      8.712090 
1 1 1 -8  32 12 o 57.87765 4.477387 41.43463       6.265905 54.26842       11.64102 36.19967       7.434819 65.51885 7.421577 53.80061 5.760397 11.71824       9.394785 
1 1 1 -8  32 13 o 78.47630 3.455202 75.62607       6.591468 83.05003       13.83051 73.44424       7.497750 81.28053 7.052296 77.23183 3.997412 4.048706       8.106428 
1 1 1 -8  32 14 o 53.91442 4.095112 35.93412       5.340060 34.35118       11.17243 36.40282       6.079459 51.23876 9.289716 54.15506 4.651723 -2.916298      10.38929 
1 1 1 -8  32 15 o 67.79646 3.676275 56.60331       6.050946 52.99002       12.57277 57.69252       6.902978 64.24633 8.218526 68.34600 4.164410 -4.099670      9.213386 
1 1 1 -8  32 16 o 73.72605 3.445188 66.87144       6.172589 82.15270       14.15509 63.28332       6.859091 80.46291 7.298373 71.60832 3.945927 8.854584       8.296782 
1 1 1 -8  32 17 o 32.23597 6.465508 13.46264       4.902133 14.61582       7.792937 12.70753       6.306079 33.13025 9.283042 31.01158 8.214873 2.118670       12.39593 
1 1 1 -8  32 18 o 122.4794 3.512444 184.6776       10.47273 176.7705       15.40595 191.4705       14.27946 119.0355 5.324470 124.1999 4.726588 -5.164345      7.119734 
1 1 1 -8  32 19 o 133.3307 4.094934 219.9148       13.28918 219.5542       25.38191 220.0511       15.59793 130.4790 8.021432 132.9868 4.821048 -2.507828      9.358732 
1 1 1 -8  32 20 o 52.80920 4.400722 34.84129       5.611873 42.78554       9.107074 29.97812       7.125450 57.73150 6.591331 48.36758 6.186821 9.363918       9.040044 
1 1 1 -8  32 21 o 83.62212 3.441498 86.44951       6.998028 97.09050       11.03986 79.30177       9.048095 87.84171 5.180352 79.59324 4.685656 8.248466       6.985085 
1 1 1 -8  32 22 o 73.75822 3.124870 67.20451       5.603937 74.55768       10.01226 63.85013       6.762404 76.68604 5.392085 71.62199 3.889117 5.064049       6.648294 
1 1 1 -8  32 23 o 85.24883 2.993201 89.78101       6.208490 88.17744       10.88471 90.55431       7.558641 83.21339 5.396800 85.33505 3.643180 -2.121658      6.511391 
1 1 1 -8  32 24 o 17.14620 6.431500 3.065873       3.634495 3.945879       6.504614 2.666412       4.382439 20.99055 8.396570 17.56159 6.934942 3.428959       10.89017 
1 1 1 -8  32 25 o 40.45062 4.133845 20.76615       4.017654 31.67469       7.849169 16.89351       4.676745 48.56721 6.819623 35.87891 5.526078 12.68830       8.777516 
1 1 1 -8  32 26 o 33.76223 4.599886 14.75119       3.686223 5.329294       6.750457 18.75448       4.400201 21.94703 8.625281 38.01078 4.861531 -16.06375      9.901008 
1 1 1 -8  32 27 o 14.50811 6.092075 0.9804428      3.641983 1.841793       5.840519 0.4324194      4.658660 18.06718 7.657201 15.50839 6.710124 2.558785       10.18128 
1 1 1 -8  32 28 o 23.61680 6.475454 7.890232       3.837530 8.887529       6.096812 7.235869       4.938554 24.55342 8.435040 22.56367 7.594062 1.989748       11.34988 
1 1 1 -8  32 29 o 39.65504 4.472809 20.65602       4.246975 12.24439       9.147454 22.96743       4.795110 27.06225 10.19213 41.60261 4.818799 -14.54036      11.27388 
1 1 1 -8  32 30 o 14.83114 6.245707 1.377304       3.845393 0.000000       0.000000 1.377304       3.845393 ?        ?        14.83114 6.245707 0.000000       6.245707 
1 1 1 -8  32 31 f 34.53359 4.614768 16.03135       3.786419 16.54835       6.750123 15.79398       4.573766 31.63911 8.552408 33.39021 5.833255 -1.751095      10.35232 
1 1 1 -8  32 32 o 29.27761 5.253776 12.04255       3.610648 17.80682       6.888580 9.859030       4.239710 32.29424 8.600326 25.33719 6.746901 6.957048       10.93098 
1 1 1 -8  32 33 o 16.63760 6.208922 3.795327       3.378435 -2.564568      6.547554 6.102971       3.944015 14.85262 6.996717 19.82819 6.785163 -4.975564      9.746409 
1 1 1 -8  32 34 o 33.02066 5.983733 16.42416       4.637733 8.877597       9.781610 18.61254       5.267420 21.50461 9.501915 34.63860 6.478342 -13.13399      11.50023 
1 1 1 -8  32 35 o 11.65744 5.313041 -0.6482968     3.332121 -1.651070      6.076148 -0.2170298     3.984740 14.31369 6.742007 12.88522 5.848120 1.428473       8.924974 
1 1 1 -8  32 36 o 20.16115 6.519238 6.823675       3.651764 12.08633       6.896098 4.772890       4.304881 23.47865 8.847938 17.35679 6.867263 6.121864       11.20024 
1 1 1 -8  33 1  o 49.84485 3.829261 30.64952       4.615645 33.06854       6.469430 28.14165       6.587179 51.52375 5.224707 47.35490 5.831192 4.168842       7.829455 
1 1 1 -8  33 2  o 71.67793 3.369313 63.05675       5.868751 71.04820       7.870974 53.05153       8.807018 75.93325 4.270850 65.29947 5.588228 10.63378       7.033381 
1 1 1 -8  33 3  o 93.65871 3.822285 107.7581       8.705503 103.8972       13.99923 110.1925       11.11627 91.31646 6.330172 94.48143 4.844275 -3.164970      7.971077 
1 1 1 -8  33 4  o 37.23005 4.825820 17.34126       4.275341 14.27972       5.648026 21.44945       6.542629 33.23825 7.182971 41.02505 6.781056 -7.786797      9.878147 
1 1 1 -8  33 5  o 58.29272 4.274891 41.96691       6.030383 41.80509       9.278633 42.08524       7.934700 57.61440 6.735678 58.08027 5.678634 -0.4658737     8.810008 
1 1 1 -8  33 6  o 47.47119 4.070570 27.86707       4.663510 27.92302       6.189408 27.79358       7.092935 47.24110 5.477840 46.91795 6.367921 0.3231430      8.399831 
1 1 1 -8  33 7  o 37.48354 6.035347 17.83109       5.325736 20.28845       8.613648 16.31033       6.776177 39.28376 9.166149 35.37754 8.042728 3.906216       12.19442 
1 1 1 -8  33 8  o 60.00144 4.535243 44.55378       6.582195 29.69692       10.51219 54.13504       8.441919 47.60345 9.395597 65.99958 5.293190 -18.39613      10.78402 
1 1 1 -8  33 9  o 30.97377 6.987843 12.43515       5.148514 12.46276       8.465611 12.41894       6.485840 31.29056 9.906253 30.85946 8.400912 0.4311008      12.98881 
1 1 1 -8  33 10 o 32.42097 6.604333 13.55475       5.040448 9.576033       8.591731 15.64276       6.224070 28.58169 10.00274 34.66719 7.579329 -6.085501      12.54994 
1 1 1 -8  33 11 o 93.98533 4.722026 109.2445       10.78030 106.1501       15.34807 112.2577       15.14526 91.87251 6.905939 94.61334 6.610417 -2.740829      9.559791 
1 1 1 -8  33 12 o 79.75303 4.077686 78.47266       7.898654 73.63248       13.43292 81.03058       9.765218 76.20147 7.323962 80.80136 4.983628 -4.599892      8.858723 
1 1 1 -8  33 13 o 108.5885 3.920633 145.2857       10.35769 125.4334       17.22931 156.5207       12.96131 99.59768 7.146257 112.4287 4.741455 -12.83102      8.576153 
1 1 1 -8  33 14 o 99.58293 3.937388 122.3224       9.536134 136.6328       17.29501 116.0712       11.43073 103.9942 6.862938 96.68928 4.866968 7.304970       8.413519 
1 1 1 -8  33 15 o 58.32643 4.684616 42.39426       6.602534 51.73200       11.97912 38.31978       7.912978 63.24641 7.947405 55.03968 5.996527 8.206738       9.955882 
1 1 1 -8  33 16 o 81.88869 4.032841 82.98804       8.022934 81.57806       14.24777 83.64269       9.708434 79.74782 7.416490 81.91814 4.885516 -2.170319      8.881024 
1 1 1 -8  33 17 f 68.84401 3.567285 58.56211       5.964256 65.37926       13.32377 56.85376       6.669833 70.95448 7.836068 67.69020 4.062149 3.264282       8.826382 
1 1 1 -8  33 18 o 81.30991 3.541949 81.71762       7.001302 77.51505       16.88075 82.59073       7.694286 76.11692 9.293157 81.62868 3.879126 -5.511757      10.07027 
1 1 1 -8  33 19 o 64.83141 3.339874 51.98454       5.258784 52.94238       9.459992 51.55617       6.326349 64.33400 6.107271 64.33752 4.055723 -0.3517151E-02 7.331279 
1 1 1 -8  33 20 o 73.81030 3.127962 67.30642       5.613437 67.13064       9.608694 67.39749       6.916448 72.70266 5.463447 73.59303 3.870255 -0.8903656     6.695382 
1 1 1 -8  33 21 o 37.27802 4.506559 17.64465       4.010873 23.48100       7.609895 15.39974       4.719630 41.63113 7.787284 34.32094 5.852798 7.310196       9.741510 
1 1 1 -8  33 22 o 71.83766 3.155325 63.99031       5.510255 69.55673       9.830169 61.43993       6.653903 73.61913 5.519601 70.06270 3.912751 3.556435       6.765768 
1 1 1 -8  33 23 o 50.99918 3.992370 32.78606       4.922176 31.73340       7.972390 33.43449       6.257158 48.60787 6.926190 50.97497 5.105793 -2.367104      8.604721 
1 1 1 -8  33 24 o 49.73581 3.530676 31.06097       4.251385 32.04985       7.786986 30.64104       5.074396 48.71784 6.739420 49.05574 4.287872 -0.3378983     7.987843 
1 1 1 -8  33 25 o 39.80358 4.709354 20.54913       4.479554 16.18037       6.862439 23.79280       5.913124 33.13695 8.467797 42.17199 5.916330 -9.035038      10.32989 
1 1 1 -8  33 26 o 18.05433 6.711141 3.882034       3.939561 2.906113       6.209946 4.539338       5.096399 19.12641 7.987851 19.66983 7.559732 -0.5434208     10.99797 
1 1 1 -8  33 27 o 28.70642 5.692974 11.34619       3.841791 13.48637       8.752125 10.83539       4.275740 28.51399 10.08602 27.60217 6.470030 0.9118195      11.98287 
1 1 1 -8  33 28 o 34.27900 5.029435 15.82457       4.076409 8.509595       8.418003 18.06537       4.659124 23.95403 9.562084 36.39731 5.417796 -12.44328      10.99027 
1 1 1 -8  33 29 o 45.48759 4.292162 27.20053       4.701538 17.17463       10.57835 29.66850       5.248399 29.70111 11.00530 47.25599 4.616382 -17.55487      11.93430 
1 1 1 -8  33 30 f 17.43981 6.335331 4.094757       3.478153 12.91133       6.240685 0.1221470      4.189095 27.78787 8.458900 14.02985 6.207789 13.75802       10.49236 
1 1 1 -8  33 31 o 39.50039 4.275076 20.89475       4.049603 26.47330       7.279991 18.39511       4.873138 40.96871 7.570738 35.77091 5.787986 5.197796       9.529787 
1 1 1 -8  33 32 o 41.47136 4.031124 22.99742       4.022562 23.53754       7.016671 22.73300       4.909424 37.65358 7.899427 40.17527 5.131577 -2.521694      9.419875 
1 1 1 -8  33 33 o 29.77658 5.875482 13.35568       4.111914 10.64680       6.479200 15.18246       5.320704 23.44583 8.626175 30.18005 7.312322 -6.734221      11.30845 
1 1 1 -8  33 34 o 20.19762 6.390418 6.617849       3.523365 5.972333       6.559012 6.879673       4.177235 19.04216 8.094229 20.15961 6.979573 -1.117449      10.68789 
1 1 1 -8  33 35 o 21.00113 6.461571 7.360050       3.629069 6.584791       6.742527 7.676240       4.305996 19.11492 8.168408 20.83871 7.090607 -1.723787      10.81664 
1 1 1 -8  34 1  o 88.70451 3.994461 96.96464       8.612403 97.87737       13.49925 96.33810       11.18430 88.38726 6.308831 88.06295 5.235332 0.3243103      8.198174 
1 1 1 -8  34 2  o 97.26279 2.988458 115.9742       7.074805 119.8119       10.46771 112.7469       9.599185 98.52060 4.370902 95.63301 4.128714 2.887589       6.012575 
1 1 1 -8  34 3  o 66.98378 3.696959 55.26840       6.011224 72.22187       11.15785 48.33549       7.135242 75.94849 6.079447 62.40710 4.726943 13.54139       7.700887 
1 1 1 -8  34 4  o 70.31346 3.653780 60.87085       6.239138 63.99981       11.15961 59.44811       7.525081 71.32631 6.491465 69.30381 4.479719 2.022499       7.887142 
1 1 1 -8  34 5  o 42.11875 4.039650 22.01848       4.095480 15.32300       5.530610 30.14772       6.094067 34.42342 6.834135 49.09549 5.171229 -14.67207      8.570123 
1 1 1 -8  34 6  f 36.40099 4.386734 16.56023       3.812909 13.07050       5.147815 20.80165       5.675218 31.72568 6.858670 40.49020 5.927227 -8.764517      9.064953 
1 1 1 -8  34 7  o 45.27569 4.755667 25.59480       5.168784 31.16585       9.552742 23.28861       6.146202 48.93967 8.306646 42.83833 6.056319 6.101341       10.28005 
1 1 1 -8  34 8  o 153.2473 3.111798 287.9416       11.62091 273.9297       17.28515 299.4986       15.69814 148.7735 4.773908 155.8677 4.136567 -7.094238      6.316754 
1 1 1 -8  34 9  o 31.01251 7.209298 12.58765       5.344660 16.13304       8.865532 10.56345       6.698843 34.75061 9.957561 28.58767 8.775828 6.162943       13.27284 
1 1 1 -8  34 10 f 100.3305 3.895517 124.1445       9.506224 151.6414       17.60334 112.8245       11.29475 109.6973 6.615861 95.31165 4.879127 14.38564       8.220431 
1 1 1 -8  34 11 f 31.79776 6.110172 13.05479       4.562631 7.684843       8.972765 14.92753       5.298834 26.91942 10.10372 33.91022 6.650036 -6.990803      12.09579 
1 1 1 -8  34 12 o 63.13169 3.903205 49.32476       5.975523 51.28011       12.03537 48.68505       6.883937 62.86597 8.039882 62.54744 4.547450 0.3185310      9.236829 
1 1 1 -8  34 13 o 14.41206 6.117147 0.2541391      3.736768 5.950060       7.858540 -1.410001      4.247710 24.53941 9.398523 13.93456 6.203496 10.60485       11.26124 
1 1 1 -8  34 14 o 33.11819 5.660556 14.10147       4.404381 13.56842       9.104815 14.26432       5.032367 31.91562 10.29167 33.07571 6.475350 -1.160082      12.15930 
1 1 1 -8  34 15 o 111.1644 3.323617 152.3398       8.993423 125.3941       17.43856 162.1032       10.49705 98.65752 7.305275 114.4860 3.767651 -15.82851      8.219625 
1 1 1 -8  34 16 o 17.99217 6.733431 3.268004       3.979017 1.365414       8.375435 3.822598       4.521911 21.43735 9.130671 19.24288 7.182817 2.194473       11.61732 
1 1 1 -8  34 17 o 123.7474 3.862092 190.0286       11.63223 0.000000       0.000000 190.0286       11.63223 ?        ?        123.7474 3.862092 0.000000       3.862092 
1 1 1 -8  34 18 o 61.01535 3.737977 46.34884       5.531240 39.93713       11.58789 48.24077       6.294625 53.87255 9.153955 62.08714 4.184817 -8.214592      10.06517 
1 1 1 -8  34 19 o 70.74709 3.223749 62.02291       5.543232 69.58227       9.920297 58.59114       6.684085 73.75837 5.560155 68.43781 4.025613 5.320564       6.864466 
1 1 1 -8  34 20 f 57.27898 3.530102 40.91954       4.903470 43.66157       8.742823 39.66117       5.922688 57.76591 6.313428 56.04580 4.371047 1.720104       7.678895 
1 1 1 -8  34 21 o 69.62591 3.188119 60.27304       5.394949 51.54203       9.023014 65.13107       6.730533 62.81882 5.965724 72.05858 3.846843 -9.239758      7.098455 
1 1 1 -8  34 22 o 27.30440 7.251849 10.41421       4.906080 5.712872       6.442697 16.90319       7.569115 22.18409 8.506483 33.90399 9.008801 -11.71990      12.39027 
1 1 1 -8  34 23 o 35.86820 5.232176 16.93825       4.438656 16.52351       7.023516 17.21404       5.727355 33.49215 8.570855 35.24367 6.915728 -1.751518      11.01303 
1 1 1 -8  34 24 o 71.84221 3.517989 65.07381       6.140273 61.96904       9.145492 67.62206       8.285394 68.44528 5.530168 72.27267 4.730385 -3.827393      7.277314 
1 1 1 -8  34 25 o 36.77178 4.797399 17.83414       4.196487 10.50340       8.481763 20.21034       4.828953 26.16547 9.822831 38.91320 5.224233 -12.74773      11.12567 
1 1 1 -8  34 26 o 52.43410 3.882770 35.35415       4.926053 30.26635       10.62132 36.74845       5.560219 42.13773 10.40615 53.12706 4.332352 -10.98933      11.27197 
1 1 1 -8  34 27 o 24.14615 6.111881 8.358552       3.598990 4.925397       6.344354 9.987556       4.370205 20.23231 8.221441 26.01088 6.814327 -5.778568      10.67835 
1 1 1 -8  34 28 o 28.97960 6.032475 12.04028       4.121421 7.331428       9.193072 13.22478       4.610740 22.73458 9.619717 30.06755 6.483644 -7.332970      11.60071 
1 1 1 -8  34 29 o 35.52701 4.606599 17.05570       3.894375 12.46633       6.450104 19.68843       4.885318 26.92245 8.660559 37.44916 5.518443 -10.52671      10.26930 
1 1 1 -8  34 30 o 41.63738 4.122086 23.12508       4.127672 15.67531       6.914126 27.25043       5.145133 29.46409 8.889934 44.54777 4.815999 -15.08368      10.11063 
1 1 1 -8  34 31 o 35.85408 4.564869 17.71144       3.898128 18.45048       7.030219 17.38336       4.684146 31.71245 8.791768 34.37204 5.798381 -2.659594      10.53169 
1 1 1 -8  34 32 o 11.70573 5.406472 -1.291318      3.609968 -2.763295      5.432910 -0.1276529     4.830545 13.28488 6.292704 14.04816 6.400489 -0.7632809     8.975767 
1 1 1 -8  34 33 o 10.10255 4.805695 -2.705102      3.235390 -4.637764      5.876016 -1.864255      3.875819 12.83264 6.200512 11.63929 5.451324 1.193345       8.256106 
1 1 1 -8  34 34 o 17.47920 6.379023 4.876832       3.532044 9.337703       6.560913 3.056407       4.191225 21.30632 8.462496 15.61589 6.544849 5.690432       10.69808 
1 1 1 -8  35 1  o 84.83133 3.064665 88.43892       6.325008 86.74204       8.919970 90.15491       8.970066 83.63723 4.391898 85.29154 4.329889 -1.654312      6.167390 
1 1 1 -8  35 2  o 149.3474 3.545655 274.4147       12.90418 262.7348       23.54401 279.4298       15.42785 144.2063 6.718237 150.3506 4.214956 -6.144272      7.930988 
1 1 1 -8  35 3  o 32.23918 4.978455 13.18896       3.785408 16.75697       5.366243 9.654981       5.340599 36.04648 6.340399 27.15130 7.711787 8.895180       9.983603 
1 1 1 -8  35 4  o 59.00862 3.400916 42.94518       4.869717 35.77774       6.772355 50.61854       7.007292 53.37174 5.276007 63.79319 4.537155 -10.42146      6.958593 
1 1 1 -8  35 5  o 85.59169 3.082999 90.04155       6.419942 92.97987       9.472623 87.54531       8.730993 86.55762 4.506371 84.05978 4.276304 2.497841       6.212420 
1 1 1 -8  35 6  o 84.78474 3.585257 88.63805       7.390821 96.61395       13.98086 85.54464       8.706894 87.30910 6.620449 83.06826 4.316026 4.240837       7.903064 
1 1 1 -8  35 7  o 82.84564 3.040193 84.36848       6.127308 89.76026       8.895156 79.50008       8.452430 85.08498 4.304052 80.04716 4.349447 5.037811       6.119032 
1 1 1 -8  35 8  o 109.6640 3.242804 147.9571       8.656528 139.7652       11.44904 158.8906       13.22687 106.1367 4.436353 112.9995 4.814384 -6.862778      6.546719 
1 1 1 -8  35 9  o 16.41203 6.670986 1.549302       4.178481 -7.062632      7.264081 5.807978       5.108197 15.70263 7.388606 22.18599 7.716190 -6.483351      10.68321 
1 1 1 -8  35 10 o 17.90056 6.905546 2.842590       4.263789 -4.087754      7.697497 5.910233       5.121233 17.65331 8.057078 22.28870 7.727489 -4.635384      11.16381 
1 1 1 -8  35 11 o 59.40321 3.892103 43.80957       5.603142 36.48082       10.84821 46.47607       6.543550 52.19958 8.843554 61.02720 4.430178 -8.827625      9.891154 
1 1 1 -8  35 12 f 43.06820 4.663081 23.35954       4.816046 28.75771       9.728691 21.60725       5.542866 46.05656 8.990932 41.07805 5.689767 4.978516       10.64003 
1 1 1 -8  35 13 o 47.44976 4.353383 28.22744       4.977763 18.70366       9.877442 31.46958       5.763092 36.41895 10.53370 49.97827 4.790509 -13.55933      11.57186 
1 1 1 -8  35 14 f 41.42255 4.674811 21.69591       4.636521 32.76242       9.291302 18.02636       5.350293 49.54053 7.966290 37.22726 6.109409 12.31327       10.03926 
1 1 1 -8  35 15 o 36.85345 5.237861 17.43344       4.571699 15.04447       9.329512 18.18838       5.244530 32.69702 10.40518 37.39370 5.954874 -4.696686      11.98868 
1 1 1 -8  35 16 o 100.9749 3.878803 127.0260       9.526621 0.000000       0.000000 127.0260       9.526621 ?        ?        100.9749 3.878803 0.000000       3.878803 
1 1 1 -8  35 17 o 43.65868 4.452755 24.15112       4.671103 17.44128       9.406250 26.34745       5.381567 34.54491 10.35697 45.42408 4.941217 -10.87917      11.47530 
1 1 1 -8  35 18 o 33.85755 5.206712 14.89157       4.158514 19.30081       7.961527 13.23730       4.876617 36.74106 8.971268 31.33142 6.596019 5.409645       11.13513 
1 1 1 -8  35 19 o 51.23475 4.823275 33.63083       5.951180 26.81764       10.07304 37.28413       7.376131 42.51354 9.907144 53.43203 5.755556 -10.91849      11.45766 
1 1 1 -8  35 20 o 20.14675 7.231970 5.011010       4.515705 6.127716       8.430860 4.561762       5.347438 23.75187 9.539395 20.25680 7.754213 3.495071       12.29341 
1 1 1 -8  35 21 o 21.33501 7.144625 6.100465       4.371728 6.020757       5.464059 6.242254       7.287640 21.71526 7.932696 22.93330 8.977071 -1.218044      11.97979 
1 1 1 -8  35 22 o 39.78337 4.630797 20.58614       4.405631 21.69999       9.611843 20.28989       4.957000 36.60238 10.32868 39.09856 5.342190 -2.496185      11.62844 
1 1 1 -8  35 23 o 52.55773 3.922356 35.33980       4.987428 49.99925       11.51588 31.95533       5.533287 58.13602 8.369442 49.49807 4.641463 8.637947       9.570305 
1 1 1 -8  35 24 o 67.19833 3.536470 57.40469       5.770760 49.74191       11.86526 59.77886       6.604515 56.84015 8.854497 68.19299 3.991796 -11.35285      9.712701 
1 1 1 -8  35 25 o 61.68845 3.387951 48.38541       5.073485 41.67690       8.438702 52.18293       6.349108 54.33061 6.502758 63.43744 4.129504 -9.106827      7.703159 
1 1 1 -8  35 26 o 22.25382 6.317519 7.212729       3.584963 6.777628       6.376998 7.413774       4.334789 21.69297 8.424297 22.26992 7.093221 -0.5769520     11.01284 
1 1 1 -8  35 27 o 48.10841 4.112633 30.41770       4.775244 23.44622       11.03186 32.02510       5.297225 33.56747 11.35009 49.04182 4.481961 -15.47435      12.20298 
1 1 1 -8  35 28 o 18.57349 6.317553 5.018617       3.418215 13.06292       6.261370 1.603310       4.079811 27.51219 8.491412 15.00492 6.381148 12.50727       10.62182 
1 1 1 -8  35 29 o 21.07643 6.131187 6.735753       3.337627 16.62997       6.272746 2.828327       3.941962 31.21559 8.157193 15.89648 6.472729 15.31911       10.41326 
1 1 1 -8  35 30 o 29.10397 5.591563 12.46159       3.821633 7.427118       6.662654 14.93012       4.665408 20.73700 8.425660 31.15589 6.360303 -10.41890      10.55676 
1 1 1 -8  35 31 o 20.86987 6.948276 7.267921       4.135712 4.545394       6.361799 9.260633       5.442721 18.19930 7.857788 22.49746 7.954113 -4.298164      11.18091 
1 1 1 -8  35 32 o 10.60148 4.996657 -2.178400      3.346945 4.675968       5.930572 -5.381742      4.054286 17.86286 7.647736 10.15460 4.961508 7.708261       9.116163 
1 1 1 -8  36 1  o 72.07414 3.767457 64.39017       6.594068 64.05211       11.01783 64.57885       8.230961 70.73646 6.463033 71.83127 4.728494 -1.094810      8.008086 
1 1 1 -8  36 2  o 29.21556 6.001025 11.14293       4.129366 12.17918       5.054261 9.062649       7.161233 30.30549 6.986853 26.77332 9.143403 3.532175       11.50730 
1 1 1 -8  36 3  o 66.08103 4.128270 54.33256       6.614638 51.18790       7.354931 67.63707       15.12834 63.91563 4.756194 71.25535 8.906363 -7.339714      10.09677 
1 1 1 -8  36 4  o 67.27406 3.579641 56.02251       5.847322 52.85706       7.541291 60.79460       9.259386 64.93441 4.799716 69.35722 5.524020 -4.422813      7.317928 
1 1 1 -8  36 5  o 51.91035 3.998758 33.56735       5.019463 30.76717       6.176997 39.01094       8.612465 49.30356 5.220393 55.03193 6.550503 -5.728371      8.376251 
1 1 1 -8  36 6  o 29.22807 6.048031 11.17550       4.165626 10.10008       4.887174 14.03236       7.965518 27.53721 7.202178 32.02782 9.513811 -4.490608      11.93248 
1 1 1 -8  36 7  o 36.21006 5.575133 16.85634       4.761887 12.92452       5.174620 38.59586       12.16764 31.19081 6.982278 52.97306 9.786136 -21.78225      12.02167 
1 1 1 -8  36 8  o 52.10178 3.786602 33.77529       4.774896 33.31045       6.051257 34.54226       7.772947 51.38834 4.891112 51.78133 6.288704 -0.3929901     7.966855 
1 1 1 -8  36 9  o 67.53500 4.394323 57.04355       7.192705 59.26377       11.68092 55.68758       9.128613 67.41172 7.223073 66.13898 5.720009 1.272736       9.213647 
1 1 1 -8  36 10 o 110.0538 4.006510 150.6550       10.72709 131.4901       17.07549 163.1496       13.78734 100.7126 7.001087 113.9047 4.979128 -13.19213      8.591096 
1 1 1 -8  36 11 o 111.5149 4.040011 154.8906       10.96057 140.8374       17.91057 163.3045       13.85857 103.9868 7.110765 113.8488 5.007462 -9.861938      8.696991 
1 1 1 -8  36 12 o 95.08212 4.058822 112.8205       9.382849 88.45022       14.75339 129.3723       12.15858 81.87309 7.477032 101.2605 4.942200 -19.38743      8.962775 
1 1 1 -8  36 13 o 134.2850 4.047781 225.1304       13.23076 207.4125       21.96349 235.2220       16.57582 125.6639 7.202408 136.4125 4.994807 -10.74863      8.764861 
1 1 1 -8  36 14 f 62.14869 4.654740 48.88543       6.998371 29.72959       11.46128 60.27359       8.837091 44.89067 10.64043 68.66113 5.323111 -23.77046      11.89766 
1 1 1 -8  36 15 o 56.85982 5.946963 42.09888       8.118460 0.000000       0.000000 42.09888       8.118460 ?        ?        56.85982 5.946963 0.000000       5.946963 
1 1 1 -8  36 16 o 16.55767 6.873369 1.513600       4.557945 -2.056432      7.030198 4.102430       5.986642 17.32115 7.823797 20.51232 8.103791 -3.191170      11.26425 
1 1 1 -8  36 17 o 31.98163 6.804501 14.02343       5.140047 9.040107       7.909574 17.66636       6.762674 25.96028 9.534343 35.29802 8.042031 -9.337744      12.47309 
1 1 1 -8  36 18 f 27.43075 6.203728 10.26950       4.049443 24.82954       8.701579 6.244595       4.575038 41.15192 8.933793 21.66340 7.309276 19.48853       11.54288 
1 1 1 -8  36 19 o 38.01637 4.913527 18.88075       4.445619 15.50406       9.443639 19.84209       5.038870 31.24734 10.50122 38.66921 5.502357 -7.421871      11.85544 
1 1 1 -8  36 20 o 46.05727 4.709847 27.60627       5.211821 24.66268       10.02010 28.69799       6.102241 38.97452 10.36946 46.44898 5.497540 -7.474457      11.73664 
1 1 1 -8  36 21 o 19.28049 6.604434 4.972074       3.736931 3.794139       7.270825 5.394937       4.356349 20.48928 8.605926 20.09568 7.115103 0.3936005      11.16632 
1 1 1 -8  36 22 o 37.42126 4.466345 18.36708       3.992617 16.35513       7.086958 19.30258       4.832500 32.17127 8.791292 37.78302 5.402126 -5.611752      10.31842 
1 1 1 -8  36 23 o 52.16245 3.830620 35.01159       4.835304 31.06905       7.909410 37.36432       6.110031 46.14093 7.275034 53.13821 4.769131 -6.997276      8.698893 
1 1 1 -8  36 24 o 59.59505 3.732912 45.72198       5.393955 57.05896       12.05239 42.88253       6.031734 60.65916 8.376812 57.15412 4.363697 3.505039       9.445254 
1 1 1 -8  36 25 o 10.04718 4.777009 -3.226918      3.189003 -9.216415      5.603657 -0.3579532     3.878278 11.53657 5.676523 13.25593 5.912797 -1.719360      8.196590 
1 1 1 -8  36 26 o 24.47454 6.780848 9.176895       4.183475 7.667529       10.18234 9.483422       4.588652 22.55728 9.838425 24.57975 7.199944 -2.022472      12.19155 
1 1 1 -8  36 27 o 25.08277 6.174051 9.445928       3.748005 5.866111       6.528617 11.20576       4.577474 20.08552 8.271214 26.70023 6.963856 -6.614710      10.81241 
1 1 1 -8  36 28 o 17.07813 6.339437 4.143462       3.512964 6.452509       6.354933 3.127362       4.215632 20.13866 8.211507 16.29834 6.671859 3.840319       10.58029 
1 1 1 -8  36 29 o 19.56345 6.558272 6.073854       3.683500 0.2005180      6.241014 9.213489       4.563019 15.62741 7.178139 23.33890 7.256526 -7.711489      10.20700 
1 1 1 -8  36 30 o 27.43927 6.522517 12.05446       4.296956 13.19505       6.692504 11.25450       5.604784 25.51338 8.834368 24.54246 8.085761 0.9709244      11.97604 
1 1 1 -8  36 31 o 28.43161 5.718030 12.31860       3.824282 15.86961       6.454217 10.39739       4.747403 28.36824 8.595594 24.19054 7.380558 4.177698       11.32947 
1 1 1 -8  37 1  o 86.03638 3.340177 91.70374       6.989753 94.87717       9.245089 87.46933       10.67931 87.00653 4.374401 82.98854 5.308506 4.017990       6.878634 
1 1 1 -8  37 2  o 48.56454 3.739546 29.44601       4.391564 22.85369       5.827012 38.11361       6.681534 41.99714 5.852391 54.77346 5.063040 -12.77632      7.738530 
1 1 1 -8  37 3  o 51.22897 4.263714 32.97376       5.274586 45.95128       9.742990 27.59334       6.273422 59.21903 6.879295 46.28586 5.680850 12.93317       8.921701 
1 1 1 -8  37 4  o 13.15999 5.569067 0.3457598      3.081673 1.214082       3.800912 -1.320065      5.264559 15.32372 6.310762 15.53705 6.912209 -0.2133226     9.359720 
1 1 1 -8  37 5  o 50.57001 3.947810 32.00878       4.826503 33.26032       6.147243 29.99719       7.793399 51.15681 4.994612 47.68104 6.908273 3.475769       8.524693 
1 1 1 -8  37 6  o 13.03378 5.588113 0.5792609E-01  3.174603 1.511872       4.094277 -2.134000      5.027082 16.06184 6.575095 14.60664 6.605065 1.455202       9.319804 
1 1 1 -8  37 7  o 15.22738 5.983520 1.901288       3.248201 1.898080       4.259883 1.905746       5.020583 16.67738 6.751433 17.69558 7.266574 -1.018200      9.918919 
1 1 1 -8  37 8  o 34.04663 4.929294 14.89700       3.970880 19.05896       5.040286 8.086993       6.447335 38.34312 5.555952 25.01720 8.670602 13.32592       10.29796 
1 1 1 -8  37 9  o 57.63958 4.043331 41.68187       5.643293 42.55827       10.60371 41.33555       6.665683 56.02680 7.992850 57.04664 4.840548 -1.019844      9.344332 
1 1 1 -8  37 10 o 26.15140 6.497971 9.222629       4.122746 12.78107       8.188828 8.014417       4.771593 30.02728 9.766516 24.37187 7.391963 5.655411       12.24851 
1 1 1 -8  37 11 o 61.27000 3.864240 47.06804       5.740243 55.10061       11.55119 44.43391       6.614821 63.90877 7.563451 59.16537 4.624623 4.743404       8.865266 
1 1 1 -8  37 12 o 37.53537 5.280434 18.31726       4.696649 19.04736       9.456630 18.07820       5.411196 35.60614 10.30935 36.84282 6.250185 -1.236679      12.05601 
1 1 1 -8  37 13 o 90.59009 3.937756 103.1290       8.672154 0.000000       0.000000 103.1290       8.672154 ?        ?        90.59009 3.937756 0.000000       3.937756 
1 1 1 -8  37 14 o 56.31016 3.901709 40.00323       5.320883 39.10144       10.79456 40.29267       6.115443 52.29510 8.781421 56.19943 4.503047 -3.904331      9.868676 
1 1 1 -8  37 15 o 15.82625 6.393224 1.920451       3.810696 -4.280427      7.543289 4.045175       4.415557 16.64829 7.732943 18.87378 7.086979 -2.225483      10.48922 
1 1 1 -8  37 16 o 38.24810 4.913569 19.09344       4.474096 7.083977       8.711202 23.39647       5.214393 24.28319 9.715848 42.24658 5.172755 -17.96339      11.00705 
1 1 1 -8  37 17 o 37.39185 5.009920 18.39197       4.450268 23.28333       9.441677 16.99491       5.045942 38.31997 10.00483 35.33072 6.080017 2.989254       11.70740 
1 1 1 -8  37 18 o 18.35393 7.036344 3.842999       4.407583 4.115305       7.940832 3.721752       5.298754 21.30391 8.973574 18.97589 7.582536 2.328016       11.74819 
1 1 1 -8  37 19 o 36.95585 5.026455 18.17441       4.409473 10.15829       9.254384 20.52880       5.015389 25.86826 10.11902 39.05602 5.415135 -13.18776      11.47685 
1 1 1 -8  37 20 o 48.83539 4.054886 30.80461       4.782090 36.31371       10.48937 29.35915       5.372944 47.86196 9.328737 47.19102 4.736105 0.6709366      10.46212 
1 1 1 -8  37 21 o 33.71592 5.278766 15.45570       4.194943 18.59181       8.260947 14.36602       4.869503 33.17846 9.644162 31.64362 6.531457 1.534843       11.64774 
1 1 1 -8  37 22 f 42.22517 4.563437 23.64815       4.621178 40.79210       10.39023 19.42059       5.159586 50.81270 8.703992 37.27072 5.875167 13.54198       10.50129 
1 1 1 -8  37 23 o 21.99517 6.483524 7.145716       3.710989 4.429909       6.346260 8.556868       4.574623 19.53801 8.110485 23.61842 7.252461 -4.080412      10.88017 
1 1 1 -8  37 24 o 19.89820 6.547616 5.857247       3.675634 0.1231813      6.237021 8.908385       4.549638 16.29529 7.363995 23.86644 7.213628 -7.571154      10.30848 
1 1 1 -8  37 25 o 41.97307 4.894280 24.22238       4.912229 8.495226       11.05451 28.09193       5.483339 22.70986 10.06456 45.02924 5.085960 -22.31937      11.27663 
1 1 1 -8  37 26 o 12.00113 5.426687 -0.6367163     3.393047 -0.3599782     5.865257 -0.7759140     4.159763 15.26542 6.992084 13.04196 5.941063 2.223461       9.175263 
1 1 1 -8  37 27 o 34.26598 5.074970 16.67363       4.109787 20.27845       7.095797 14.85395       5.041474 33.45263 8.643070 30.46085 6.946251 2.991785       11.08842 
1 1 1 -8  37 28 o 37.39772 4.620812 19.50996       4.121658 17.04416       7.077873 20.77518       5.069987 29.41307 9.019104 37.39183 5.747809 -7.978756      10.69493 
1 1 1 -8  37 29 o 13.82643 6.114664 0.9109977      4.059340 5.206191       6.232756 -2.253076      5.349487 18.44824 7.867671 13.31260 6.287380 5.135641       10.07131 
1 1 1 -8  38 1  f 14.73875 5.895462 1.635917       3.206504 2.469577       4.128626 0.3686869      5.090249 16.96193 6.720713 16.32646 7.038843 0.6354733      9.732076 
1 1 1 -8  38 2  o 56.51944 3.911510 40.16988       5.354156 36.16749       8.800030 42.52231       6.746571 51.78822 7.164666 57.69038 4.843603 -5.902164      8.648291 
1 1 1 -8  38 3  o 10.52758 4.985198 -3.696916      3.405040 -2.555839      4.077113 -6.327891      6.190896 12.57356 5.785049 14.08916 6.686418 -1.515600      8.841661 
1 1 1 -8  38 4  o 72.26987 3.429803 65.12898       6.023120 57.82346       7.459894 78.81001       10.20861 67.49274 4.562463 78.23980 5.387183 -10.74706      7.059590 
1 1 1 -8  38 5  o 19.55003 6.287532 4.956405       3.399792 7.379941       4.782028 2.479429       4.834464 23.39431 7.450024 17.81876 7.199962 5.575552       10.36061 
1 1 1 -8  38 6  o 28.20077 5.481610 10.52775       3.631354 12.74678       4.933185 7.903274       5.364964 30.54216 6.802632 24.15416 7.908404 6.388006       10.43162 
1 1 1 -8  38 7  o 24.63152 5.911913 8.170643       3.503388 9.696015       4.660764 6.189266       5.311934 26.49259 7.082790 22.09365 7.853418 4.398945       10.57554 
1 1 1 -8  38 8  o 64.57148 3.164380 51.91694       4.964103 48.30048       7.103508 55.36878       6.939952 61.43695 4.782325 66.07788 4.333791 -4.640926      6.453866 
1 1 1 -8  38 9  o 26.53476 6.662457 9.684138       4.301327 4.071806       8.192822 11.81976       5.053873 22.17636 9.211265 29.13906 7.167540 -6.962692      11.67138 
1 1 1 -8  38 10 o 45.91426 4.446102 26.97321       4.912476 36.39744       9.558283 23.59027       5.726696 50.98961 7.951729 42.27277 5.704599 8.716839       9.786340 
1 1 1 -8  38 11 o 62.82288 3.782304 49.77319       5.763606 43.99060       10.78317 52.08596       6.819478 55.76925 8.177243 63.88924 4.407136 -8.119999      9.289249 
1 1 1 -8  38 12 o 26.35653 7.185340 9.815810       4.740728 0.000000       0.000000 9.815810       4.740728 ?        ?        26.35653 7.185340 0.000000       7.185340 
1 1 1 -8  38 13 f 14.58875 6.052590 1.219099       3.531545 1.112458       6.331398 1.267263       4.254940 18.07353 7.821288 15.67488 6.583583 2.398644       10.22331 
1 1 1 -8  38 14 o 29.96012 5.953169 12.28105       4.193181 13.68979       8.475657 11.82450       4.825043 29.44026 9.948616 28.86083 6.945022 0.5794296      12.13294 
1 1 1 -8  38 15 o 38.95046 4.827309 19.94066       4.483991 2.004801       8.468328 26.92859       5.285798 20.36702 8.925582 45.30804 4.863429 -24.94102      10.16459 
1 1 1 -8  38 16 o 43.12244 4.609034 24.33536       4.768373 18.60020       9.389142 26.32872       5.535356 33.05679 10.42842 44.46123 5.207458 -11.40443      11.65631 
1 1 1 -8  38 17 o 53.37497 4.763259 37.46899       6.130486 37.13905       10.92002 37.62082       7.408038 48.15678 9.641873 52.49414 5.892655 -4.337353      11.29996 
1 1 1 -8  38 18 o 14.17170 5.958993 1.101830       3.492091 7.360221       6.541893 -1.392126      4.129681 22.67338 8.601193 13.07722 5.942451 9.596165       10.45434 
1 1 1 -8  38 19 o 34.53006 5.260484 16.22863       4.286843 16.84999       8.147397 15.99076       5.041061 31.34172 9.688452 33.45584 6.416579 -2.114124      11.62061 
1 1 1 -8  38 20 o 13.70534 5.961505 0.3910630      3.717274 -1.060717      7.173271 0.9240626      4.346406 16.88250 7.732677 15.02551 6.491232 1.856989       10.09606 
1 1 1 -8  38 21 o 50.72993 4.153514 33.79729       5.089796 18.96637       9.940251 39.06748       5.925517 31.01250 10.76513 54.20124 4.527546 -23.18874      11.67847 
1 1 1 -8  38 22 o 21.68259 6.889880 7.176940       4.091815 10.60314       8.880511 6.253498       4.610376 24.34917 9.786597 20.40030 7.309256 3.948877       12.21486 
1 1 1 -8  38 23 o 35.87803 5.421368 18.17986       4.592245 7.298043       9.890983 21.17015       5.184962 21.95976 9.634247 38.48653 5.700541 -16.52677      11.19441 
1 1 1 -8  38 24 o 16.12717 6.475682 3.102347       3.884187 7.279262       8.769485 2.082939       4.332318 21.30362 9.211957 15.50578 6.584194 5.797839       11.32306 
1 1 1 -8  38 25 o 24.58418 6.514428 9.497644       3.964781 15.82048       7.053228 6.576808       4.793861 28.71097 9.036035 20.11399 7.416545 8.596981       11.68996 
1 1 1 -8  38 26 o 35.12987 4.992599 17.52292       4.153843 22.07994       7.468963 15.48226       4.998104 34.45886 8.849101 31.19626 6.769438 3.262600       11.14145 
1 1 1 -8  38 27 o 19.85467 6.628280 6.423337       3.763079 11.81500       6.546140 3.762237       4.598904 24.28412 8.708541 16.78744 6.930437 7.496681       11.12967 
1 1 1 -8  39 1  o 25.85722 6.131451 9.186373       3.804516 2.502917       4.507060 25.75334       7.096011 17.21800 6.953793 43.16346 6.984707 -25.94546      9.856031 
1 1 1 -8  39 2  o 45.35477 4.263278 26.34090       4.656717 28.59723       5.988989 22.89109       7.405417 46.63647 5.367543 40.04480 7.869461 6.591663       9.525699 
1 1 1 -8  39 3  o 44.42046 3.727511 24.98782       3.997769 20.36305       5.484866 30.22934       5.839149 38.93724 5.970660 48.16147 5.050261 -9.224232      7.820097 
1 1 1 -8  39 4  o 16.37894 5.984081 3.088640       3.109491 3.661665       4.141844 2.348513       4.707171 18.10380 6.849342 17.30171 7.062492 0.8020859      9.838306 
1 1 1 -8  39 5  o 28.94639 5.246274 11.15379       3.564451 12.76614       5.006106 9.495821       5.076419 30.15808 6.953930 25.78203 7.578632 4.376047       10.28556 
1 1 1 -8  39 6  o 58.96833 3.436802 43.72637       4.917259 43.94339       7.058889 43.52179       6.853756 58.10210 5.035150 57.91662 4.902118 0.1854858      7.027339 
1 1 1 -8  39 7  o 35.50581 4.593225 16.39095       3.881198 16.56013       5.499269 16.22305       5.478476 34.49572 6.783752 34.10609 6.829980 0.3896332      9.626418 
1 1 1 -8  39 8  o 16.48480 6.922158 1.550268       4.702142 2.075069       7.129509 1.146245       6.255542 19.47661 8.362793 17.97205 7.775834 1.504560       11.41928 
1 1 1 -8  39 9  o 27.80364 6.525403 10.82820       4.344850 12.91091       7.645329 9.834681       5.280435 28.86637 9.440051 25.99046 7.752373 2.875904       12.21531 
1 1 1 -8  39 10 o 15.29318 6.600973 0.5719922      4.486723 0.000000       0.000000 0.5719922      4.486723 ?        ?        15.29318 6.600973 0.000000       6.600973 
1 1 1 -8  39 11 f 49.02943 4.271705 31.02329       5.052903 35.42975       10.39994 29.66169       5.781107 48.00313 9.225592 47.39421 5.084941 0.6089211      10.53414 
1 1 1 -8  39 12 o 36.20571 5.188902 17.52178       4.447432 22.41385       8.846609 15.86722       5.144841 37.28368 9.659664 33.60110 6.518449 3.682571       11.65330 
1 1 1 -8  39 13 o 18.82459 6.866273 4.550047       4.091417 7.505754       7.673079 3.375823       4.836314 23.37115 9.192546 18.08286 7.237889 5.288292       11.70000 
1 1 1 -8  39 14 o 24.49418 6.919283 8.743527       4.311235 -0.5967711     8.859895 11.64126       4.934885 19.00502 8.662485 28.12676 7.177164 -9.121746      11.24946 
1 1 1 -8  39 15 f 33.26382 5.901283 15.37221       4.608430 10.35892       8.448731 17.49553       5.498415 25.53227 9.753407 34.94314 6.700861 -9.410872      11.83345 
1 1 1 -8  39 16 o 27.35966 7.461839 11.34296       5.111395 7.278563       8.214113 13.91128       6.529608 22.91396 9.338506 29.45183 8.578019 -6.537870      12.68030 
1 1 1 -8  39 17 o 37.33246 5.024141 18.84130       4.454797 13.90727       9.023560 20.43139       5.122571 27.85250 10.19109 38.42898 5.637624 -10.57648      11.64650 
1 1 1 -8  39 18 f 33.39342 5.824615 15.71778       4.567571 21.62400       9.268038 13.82308       5.249326 34.32508 10.27818 30.16238 7.234838 4.162697       12.56916 
1 1 1 -8  39 19 o 45.65493 4.594786 27.92976       5.042529 28.11360       10.14152 27.86939       5.811864 38.75840 10.48559 44.82993 5.430577 -6.071533      11.80841 
1 1 1 -8  39 20 o 44.27015 4.435058 26.25984       4.720247 20.68175       8.884048 28.45391       5.571763 32.83807 10.11102 45.43415 5.121522 -12.59608      11.33414 
1 1 1 -8  39 21 o 21.51035 6.962043 7.235148       4.164091 -5.755391      8.158466 11.81148       4.842325 15.32016 7.378368 27.27999 7.185571 -11.95984      10.29916 
1 1 1 -8  39 22 o 33.61886 6.717670 17.40705       5.310853 0.000000       0.000000 17.40705       5.310853 ?        ?        33.61886 6.717670 0.000000       6.717670 
1 1 1 -8  39 23 o 20.28619 6.891903 6.572535       4.067848 6.593629       7.768975 6.564567       4.774675 20.40316 8.744635 20.12290 7.404824 0.2802620      11.45862 
1 1 1 -8  39 24 o 30.11735 5.897794 13.61219       4.173594 11.37612       8.087381 14.42387       4.872558 23.44462 9.367843 30.07025 6.808331 -6.625631      11.58058 
1 1 1 -8  39 25 o 21.16036 6.947175 7.477079       4.138842 19.27175       9.844620 4.944787       4.561556 27.70259 10.54139 17.99976 7.085326 9.702829       12.70129 
1 1 1 -8  40 1  o 31.29298 5.756248 13.43868       4.227871 4.916223       7.370509 17.61810       5.161470 21.27884 8.778082 35.65768 6.162813 -14.37885      10.72544 
1 1 1 -8  40 2  o 15.93475 6.343072 2.399801       3.694009 -10.97976      5.953716 10.77434       4.710289 11.72282 5.784024 27.24372 7.043469 -15.52090      9.114021 
1 1 1 -8  40 3  o 51.38014 3.585471 33.56731       4.461118 37.57581       6.255841 29.41969       6.363483 53.47405 4.853536 46.62592 5.720269 6.848125       7.501885 
1 1 1 -8  40 4  o 21.69671 6.148600 6.603268       3.398810 5.101669       4.545430 8.507571       5.118775 19.78161 7.233802 24.06063 7.712770 -4.279016      10.57425 
1 1 1 -8  40 5  o 33.30535 5.056538 14.81948       3.975154 14.74205       5.532941 14.90209       5.714908 31.79341 7.296299 31.82896 7.493108 -0.3555107E-01 10.45862 
1 1 1 -8  40 6  o 26.94283 5.623606 9.990948       3.572793 10.58498       4.921446 9.329039       5.195032 26.81787 7.325076 25.04616 7.735380 1.771709       10.65330 
1 1 1 -8  40 7  o 39.39273 4.169303 20.12303       3.941681 16.14131       5.306127 25.02577       5.887915 33.69247 6.698571 42.85753 5.785261 -9.165062      8.850994 
1 1 1 -8  40 8  o 52.16941 4.218079 35.23634       5.316801 44.25697       9.973452 31.65496       6.284224 55.11608 7.630001 48.53627 5.404686 6.579803       9.350270 
1 1 1 -8  40 9  o 40.97379 7.531494 24.62110       7.243063 0.000000       0.000000 24.62110       7.243063 ?        ?        40.97379 7.531494 0.000000       7.531494 
1 1 1 -8  40 10 o 25.54864 7.503236 9.779820       4.977829 6.927079       7.636437 11.88760       6.564060 22.69725 9.091516 27.38308 8.729386 -4.685831      12.60388 
1 1 1 -8  40 11 o 40.18007 4.957919 21.57144       4.751665 16.50471       8.886209 23.60028       5.623092 30.74447 10.18339 41.47723 5.715003 -10.73277      11.67744 
1 1 1 -8  40 12 o 17.66988 6.682217 3.839566       3.941171 -1.395490      7.735665 5.674806       4.580190 17.42100 7.998157 20.20654 7.279655 -2.785543      10.81498 
1 1 1 -8  40 13 o 30.05895 6.110856 12.84372       4.323521 20.75488       8.964290 10.44559       4.935506 34.33374 10.06512 26.20003 7.404054 8.133715       12.49507 
1 1 1 -8  40 14 o 19.98626 7.416109 5.558544       4.806707 -0.6251521     7.465140 9.937874       6.282287 17.37294 7.931187 24.84136 8.561289 -7.468424      11.67045 
1 1 1 -8  40 15 o 20.33606 7.095834 6.040107       4.321733 -1.801377      7.783310 9.535322       5.196394 16.96891 7.872634 24.59441 7.758030 -7.625504      11.05285 
1 1 1 -8  40 16 o 28.58326 6.472324 12.08521       4.403096 4.933047       8.235876 14.94759       5.210208 20.67095 8.932816 31.44187 6.981888 -10.77091      11.33764 
1 1 1 -8  40 17 o 10.82721 5.171263 -3.861933      3.825305 -12.76107      7.897633 -1.134206      4.372435 13.21056 6.544086 13.31523 6.075354 -0.1046753     8.929444 
1 1 1 -8  40 18 f 21.58491 7.185255 7.308681       4.422664 16.59860       9.085416 4.423695       5.063033 28.57171 10.25786 18.40285 7.391998 10.16886       12.64378 
1 1 1 -8  40 19 o 20.37547 7.006387 6.477626       4.206759 3.557275       8.732865 7.360064       4.800441 19.42530 8.751972 21.35408 7.476603 -1.928783      11.51072 
1 1 1 -8  40 20 o 10.14005 4.891522 -4.246166      3.620725 -0.4088508     7.794059 -5.302176      4.088686 16.82106 7.829196 10.45197 5.078892 6.369085       9.332280 
1 1 1 -8  40 21 o 12.91979 5.950553 -1.194505      4.329573 0.000000       0.000000 -1.194505      4.329573 ?        ?        12.91979 5.950553 0.000000       5.950553 
1 1 1 -8  40 22 o 12.93343 5.842817 -0.2626618     3.922610 1.017390       7.723941 -0.7075436     4.553524 17.09332 7.899582 13.43433 6.156153 3.658987       10.01507 
1 1 1 -8  40 23 o 25.32661 6.866334 10.54590       4.343293 21.26671       9.954531 8.025103       4.826982 29.22069 10.70194 21.47719 7.498812 7.743502       13.06766 
1 1 1 -8  41 1  o 26.01426 6.252957 9.735474       3.914773 7.851200       5.353729 11.90068       5.738976 22.82157 7.901536 27.55796 8.046349 -4.736393      11.27732 
1 1 1 -8  41 2  o 56.08581 3.749305 40.44595       5.094931 43.99360       7.032053 36.52575       7.392061 57.27396 5.091362 51.23418 6.036379 6.039780       7.896824 
1 1 1 -8  41 3  o 12.42951 5.490155 -0.2765087     3.262873 1.308679       4.167393 -2.787575      5.245094 15.21347 6.458765 13.83249 6.432927 1.380980       9.115821 
1 1 1 -8  41 4  o 15.96898 6.713258 1.798024       4.430551 -3.097237      7.987618 3.973436       5.324762 16.85369 7.871406 18.77771 7.567321 -1.924021      10.91895 
1 1 1 -8  41 5  o 14.01193 6.026357 0.6762445      3.713848 6.609387       6.760338 -1.888316      4.444598 21.84126 8.616913 13.17652 6.054294 8.664735       10.53118 
1 1 1 -8  41 6  o 30.63622 6.196513 13.37179       4.467010 11.54601       7.821275 14.25567       5.441895 26.25009 9.505278 30.76513 7.357951 -4.515036      12.02039 
1 1 1 -8  41 7  o 20.17766 7.466545 5.649054       4.866234 0.000000       0.000000 5.649054       4.866234 ?        ?        20.17766 7.466545 0.000000       7.466545 
1 1 1 -8  41 8  o 38.46402 5.262498 20.17672       4.803473 16.93613       8.963753 21.48219       5.689325 30.52635 10.23063 38.94217 6.203119 -8.415819      11.96430 
1 1 1 -8  41 9  o 50.03920 5.352335 34.18308       6.425388 40.68433       10.87618 30.69752       7.963689 49.76268 9.311016 45.22859 7.487181 4.534092       11.94792 
1 1 1 -8  41 10 o 25.38336 6.774251 9.642146       4.268224 13.02864       8.765036 8.589488       4.886772 26.86590 10.00576 23.56534 7.534100 3.300564       12.52509 
1 1 1 -8  41 11 o 11.96286 5.514934 -1.797465      3.731143 -2.477251      7.176529 -1.545648      4.367886 16.04963 7.484345 13.14570 6.025933 2.903926       9.608708 
1 1 1 -8  41 12 o 26.88548 7.811668 11.59852       5.420889 13.00704       8.364244 10.57840       7.118205 26.61773 9.799669 24.83921 9.057213 1.778526       13.34416 
1 1 1 -8  41 13 o 26.30523 7.540538 11.02518       5.083019 17.16655       8.048876 6.951088       6.555686 30.51243 9.659279 21.40748 8.473030 9.104946       12.84889 
1 1 1 -8  41 14 o 33.77745 5.563303 16.16315       4.419978 13.76820       8.292100 17.11369       5.223984 26.85513 9.778090 33.88223 6.564062 -7.027098      11.77701 
1 1 1 -8  41 15 o 12.90470 5.830956 -0.6339317     3.908908 -2.190908      7.456772 -0.4396099E-01 4.590131 16.06550 7.536171 14.24726 6.388102 1.818239       9.879358 
1 1 1 -8  41 16 o 18.50582 6.954698 4.978011       4.254195 6.504097       8.541464 4.474545       4.906004 20.95842 9.077021 18.20794 7.289208 2.750484       11.64151 
1 1 1 -8  41 17 o 14.04952 6.079699 1.070405       3.825408 -6.052711      6.596827 4.679202       4.695494 13.51620 6.540252 18.22056 7.183570 -4.704355      9.714864 
1 1 1 -8  41 18 o 17.71967 6.796450 4.499595       4.113502 3.495740       7.887924 4.874578       4.820951 18.68703 8.376821 18.35723 7.265927 0.3298054      11.08895 
1 1 1 -8  41 19 o 13.78118 6.128537 0.4462331      4.134178 0.6206051E-01  7.014538 0.6507047      5.117436 16.26671 7.521279 14.98660 6.730299 1.280105       10.09290 
1 1 1 -8  41 20 o 25.35105 8.297359 11.91842       5.905898 0.000000       0.000000 11.91842       5.905898 ?        ?        25.35105 8.297359 0.000000       8.297359 
1 1 1 -8  42 1  o 14.70496 5.848818 2.233300       3.138301 3.065705       4.289180 1.274225       4.603978 16.73396 6.774511 15.41593 6.670372 1.318025       9.507254 
1 1 1 -8  42 2  f 26.94297 5.624350 10.34531       3.573321 5.752383       4.912802 15.50458       5.206889 19.92897 7.477020 32.08314 6.867183 -12.15417      10.15205 
1 1 1 -8  42 3  o 32.74281 4.962627 14.70214       3.835753 16.94001       5.341342 12.31913       5.511822 33.70424 6.738922 27.64478 7.828537 6.059458       10.32952 
1 1 1 -8  42 4  o 10.34825 4.833450 -2.145721      3.012738 -0.9989434     4.035443 -3.589746      4.528339 12.95078 5.880771 12.15116 5.752531 0.7996264      8.226486 
1 1 1 -8  42 5  o 19.16959 6.495632 5.335669       3.613302 9.347587       6.187423 3.259448       4.451133 23.73993 8.471950 17.05970 6.903089 6.680231       10.92825 
1 1 1 -8  42 6  o 21.59262 6.705373 7.051275       3.897518 6.900302       6.556759 7.133769       4.846760 21.36907 8.468671 21.47347 7.513005 -0.1043987     11.32094 
1 1 1 -8  42 7  o 13.67785 5.794343 1.112897       3.341918 2.988958       4.698063 -0.8087652     4.754818 16.95177 7.002147 14.05335 6.382226 2.898427       9.474326 
1 1 1 -8  42 8  o 13.09959 5.951305 -0.9344547     4.139174 7.549384       7.107600 -5.288226      5.091662 21.88890 8.769930 12.14550 5.844193 9.743400       10.53880 
1 1 1 -8  42 9  o 33.58474 7.571015 17.87932       6.047707 19.70204       8.684855 16.16343       8.426494 31.97719 10.02167 28.86137 9.916465 3.115814       14.09858 
1 1 1 -8  42 10 o 39.14710 5.778958 21.96386       5.347414 21.43798       8.965292 22.25426       6.662243 33.08596 10.15165 37.52068 7.548164 -4.434719      12.65033 
1 1 1 -8  42 11 o 17.47074 7.473600 3.017463       5.654939 2.655494       7.664450 3.449929       8.377639 18.51674 8.282085 19.31963 8.648728 -0.8028831     11.97470 
1 1 1 -8  42 12 f 34.97655 6.269297 18.20420       5.147289 9.718606       8.363065 23.37891       6.530821 23.03438 9.409468 38.66132 7.196710 -15.62694      11.84613 
1 1 1 -8  42 13 o 13.01216 5.972739 -1.171451      4.310708 4.261514       7.429061 -3.929165      5.292857 19.12545 8.371282 12.84380 6.120091 6.281651       10.36985 
1 1 1 -8  42 14 o 27.43467 8.538013 13.62213       6.315333 7.760847       8.387968 21.29305       9.595868 21.42676 9.132195 31.11370 10.58498 -9.686945      13.97994 
1 1 1 -8  42 15 o 58.96909 4.698308 47.87895       6.695740 50.61752       11.59505 46.50885       8.201392 52.73434 9.365931 55.98641 6.110378 -3.252071      11.18291 
1 1 1 -8  42 16 o 25.89157 7.464046 11.33245       4.967061 15.50615       8.797886 9.379666       6.017892 26.47923 9.990467 22.70535 8.320125 3.773882       13.00130 
1 1 1 -8  42 17 o 25.96748 6.849553 10.92902       4.396022 3.696109       8.460499 13.60391       5.145076 18.73170 8.509439 28.52928 7.353979 -9.797575      11.24685 
1 1 1 -8  43 1  o 14.40704 6.129829 1.508691       3.767907 -2.160177      4.572646 9.269066       6.650325 12.78008 5.964489 22.81619 8.668265 -10.03611      10.52207 
1 1 1 -8  43 2  o 15.40979 6.051528 2.843417       3.320725 9.226138       4.761480 -3.200965      4.633562 23.67502 7.420536 12.31269 5.826028 11.36232       9.434350 
1 1 1 -8  43 3  o 14.74358 5.957694 2.291732       3.310315 6.883216       4.877242 -1.630098      4.507566 20.72175 7.505713 13.01053 6.020469 7.711220       9.621943 
1 1 1 -8  43 4  o 31.85473 5.918579 14.90230       4.425305 12.12468       7.384392 16.45884       5.527894 25.19763 9.219201 32.17983 7.226460 -6.982201      11.71390 
1 1 1 -8  43 5  o 17.98791 6.534999 4.705800       3.700956 7.234383       5.430399 2.512675       5.057372 21.04100 7.867866 16.51491 7.066281 4.526091       10.57524 
1 1 1 -8  43 6  o 22.19836 6.381254 7.591413       3.635328 10.54558       5.396615 5.137211       4.918802 24.82238 7.915361 18.80080 7.370501 6.021584       10.81560 
1 1 1 -8  43 7  o 10.98208 5.080843 -1.584682      3.208057 -2.388823      5.013733 -1.027226      4.174459 13.22458 6.195837 12.90520 5.906429 0.3193817      8.560041 
1 1 1 -8  43 8  o 19.78403 7.147918 6.131023       4.419769 13.50342       7.903900 2.776943       5.331185 25.95147 9.530953 16.86507 7.236352 9.086397       11.96678 
1 1 1 -8  43 9  f 24.10342 7.491327 9.721877       4.863611 16.69241       8.166570 5.890723       6.054408 28.57294 9.763987 19.68930 8.019982 8.883640       12.63549 
1 1 1 -8  43 10 o 45.45470 5.810071 30.16956       6.288772 29.49625       9.687893 30.65989       8.267397 38.41444 10.18494 42.46894 8.286039 -4.054497      13.12979 
1 1 1 -8  43 11 o 21.93290 6.932802 7.798956       4.147729 16.08252       8.299301 5.041176       4.788646 27.58796 9.815387 18.46645 7.262434 9.121502       12.21003 
1 1 1 -8  43 12 f 11.51781 5.427506 -2.563570      3.945633 -5.989356      7.044793 -0.9977744     4.762727 13.85191 6.715988 13.56388 6.245003 0.2880268      9.170854 
1 1 1 -8  43 13 o 13.48056 6.019638 0.2515694      4.031351 -3.783781      7.142250 2.138271       4.883667 14.68609 7.028365 15.80853 6.855031 -1.122438      9.817809 
1 1 1 -8  43 14 o 33.47687 6.038261 16.89828       4.744787 15.87622       9.027616 17.28838       5.577243 26.33499 10.07658 32.51084 7.226961 -6.175846      12.40026 
1 1 1 -8  44 1  o 16.84579 6.303371 4.063923       3.486680 7.527502       5.151341 1.135667       4.736552 20.97983 7.696184 14.91467 6.600053 6.065154       10.13864 
1 1 1 -8  44 2  o 13.75983 6.019275 0.8889724      3.836092 -5.928055      7.280386 3.509000       4.513462 14.06400 6.820827 16.73509 6.882874 -2.671098      9.690080 
1 1 1 -8  44 3  o 29.46482 5.681386 12.83744       3.931518 13.45107       5.922966 12.35414       5.256516 27.30193 8.226021 26.80982 7.662712 0.4921093      11.24209 
1 1 1 -8  44 4  o 24.53936 6.916735 9.813114       4.312968 9.754664       5.643276 9.895202       6.687807 23.26189 8.109030 22.86026 8.690859 0.4016342      11.88644 
1 1 1 -8  44 5  o 44.93660 4.452976 27.69167       4.812196 27.19445       6.427486 28.32588       7.259090 42.11783 6.468897 41.72401 7.410857 0.3938179      9.837044 
1 1 1 -8  44 6  o 15.59583 6.332818 2.877765       3.761130 1.921424       4.905428 4.241921       5.858715 15.66317 6.830183 18.03708 7.657802 -2.373914      10.26125 
1 1 1 -8  44 7  o 15.85311 6.382759 3.106518       3.784359 1.356279       5.012154 5.427359       5.771629 15.33060 6.786474 18.94611 7.786818 -3.615508      10.32912 
1 1 1 -7  0  1  o 167.8957 5.971577 344.9706       24.36212 344.9706       24.36212 344.9706       24.36212 167.8957 5.971577 167.8957 5.971577 0.000000       0.000000 
1 1 1 -7  0  2  o 169.1242 4.185500 349.2521       17.22614 349.2521       17.22614 349.2521       17.22614 169.1242 4.185500 169.1242 4.185500 0.000000       0.000000 
1 1 1 -7  0  3  o 354.0115 7.484572 1530.459       64.50333 1530.459       64.50333 1530.459       64.50333 354.0115 7.484572 354.0115 7.484572 0.000000       0.000000 
1 1 1 -7  0  4  o 269.9870 5.914160 889.9548       38.86882 889.9548       38.86882 889.9548       38.86882 269.9870 5.914160 269.9870 5.914160 -0.000000      0.000000 
1 1 1 -7  0  5  o 452.8108 9.377277 2505.196       103.3735 2505.196       103.3735 2505.196       103.3735 452.8108 9.377277 452.8108 9.377277 -0.000000      0.000000 
1 1 1 -7  0  6  o 494.0869 10.17842 2983.394       122.4345 2983.394       122.4345 2983.394       122.4345 494.0869 10.17842 494.0869 10.17842 0.000000       0.000000 
1 1 1 -7  0  7  o 852.6072 17.30115 8911.415       359.1339 8911.415       359.1339 8911.415       359.1339 852.6072 17.30115 852.6072 17.30115 0.000000       0.000000 
1 1 1 -7  0  8  o 138.2925 5.259939 234.1366       17.66788 234.1366       17.66788 234.1366       17.66788 138.2925 5.259939 138.2925 5.259939 0.000000       0.000000 
1 1 1 -7  0  9  o 353.2521 10.61071 1527.057       91.15429 1527.057       91.15429 1527.057       91.15429 353.2521 10.61071 353.2521 10.61071 0.000000       0.000000 
1 1 1 -7  0  10 o 326.9784 6.986950 1305.320       55.61539 1305.320       55.61539 1305.320       55.61539 326.9784 6.986950 326.9784 6.986950 -0.000000      0.000000 
1 1 1 -7  0  11 o 144.4843 3.841609 254.9411       13.50440 254.9411       13.50440 254.9411       13.50440 144.4843 3.841609 144.4843 3.841609 0.000000       0.000000 
1 1 1 -7  0  12 o 50.08889 3.234225 30.95336       3.909484 30.95336       3.909484 30.95336       3.909484 50.08889 3.234225 50.08889 3.234225 -0.000000      0.000000 
1 1 1 -7  0  13 o 397.3795 8.335095 1927.762       80.63446 1927.762       80.63446 1927.762       80.63446 397.3795 8.335095 397.3795 8.335095 0.000000       0.000000 
1 1 1 -7  0  14 o 23.13102 6.088806 7.731266       2.965227 7.731266       2.965227 7.731266       2.965227 23.13102 6.088806 23.13102 6.088806 0.000000       0.000000 
1 1 1 -7  0  15 o 63.00201 3.437729 48.79819       5.241754 48.79819       5.241754 48.79819       5.241754 63.00201 3.437729 63.00201 3.437729 -0.000000      0.000000 
1 1 1 -7  0  16 o 475.2996 9.857245 2758.234       114.0611 2758.234       114.0611 2758.234       114.0611 475.2996 9.857245 475.2996 9.857245 0.000000       0.000000 
1 1 1 -7  0  17 o 73.94724 4.841082 67.49255       8.636721 67.49255       8.636721 67.49255       8.636721 73.94724 4.841082 73.94724 4.841082 -0.000000      0.000000 
1 1 1 -7  0  18 o 337.1482 7.252797 1387.571       59.52626 1387.571       59.52626 1387.571       59.52626 337.1482 7.252797 337.1482 7.252797 -0.000000      0.000000 
1 1 1 -7  0  19 o 223.9355 5.264946 612.1949       28.69528 612.1949       28.69528 612.1949       28.69528 223.9355 5.264946 223.9355 5.264946 -0.000000      0.000000 
1 1 1 -7  0  20 o 88.75242 3.756056 96.50670       8.090424 96.50670       8.090424 96.50670       8.090424 88.75242 3.756056 88.75242 3.756056 -0.000000      0.000000 
1 1 1 -7  0  21 o 70.67200 4.022280 61.45775       6.875429 61.45775       6.875429 61.45775       6.875429 70.67200 4.022280 70.67200 4.022280 0.000000       0.000000 
1 1 1 -7  0  22 o 97.93495 5.942185 118.2145       14.06062 118.2145       14.06062 118.2145       14.06062 97.93495 5.942185 97.93495 5.942185 0.000000       0.000000 
1 1 1 -7  0  23 o 287.9726 6.422453 1012.781       45.01945 1012.781       45.01945 1012.781       45.01945 287.9726 6.422453 287.9726 6.422453 0.000000       0.000000 
1 1 1 -7  0  24 o 191.0946 4.824433 446.0573       22.43390 446.0573       22.43390 446.0573       22.43390 191.0946 4.824433 191.0946 4.824433 0.000000       0.000000 
1 1 1 -7  0  25 o 142.0421 4.228766 246.6272       14.60812 246.6272       14.60812 246.6272       14.60812 142.0421 4.228766 142.0421 4.228766 0.000000       0.000000 
1 1 1 -7  0  26 o 100.2783 3.994686 123.1844       9.726442 123.1844       9.726442 123.1844       9.726442 100.2783 3.994686 100.2783 3.994686 -0.000000      0.000000 
1 1 1 -7  0  27 o 72.65987 4.170196 65.01517       7.327816 65.01517       7.327816 65.01517       7.327816 72.65987 4.170196 72.65987 4.170196 -0.000000      0.000000 
1 1 1 -7  0  28 o 214.6036 5.264923 563.0617       27.49630 563.0617       27.49630 563.0617       27.49630 214.6036 5.264923 214.6036 5.264923 0.000000       0.000000 
1 1 1 -7  0  29 o 21.48906 10.30683 8.316112       6.218971 8.316112       6.218971 8.316112       6.218971 21.48906 10.30683 21.48906 10.30683 0.000000       0.000000 
1 1 1 -7  0  30 o 18.39570 8.864509 6.091704       4.606610 6.091704       4.606610 6.091704       4.606610 18.39570 8.864509 18.39570 8.864509 0.000000       0.000000 
1 1 1 -7  0  31 o 28.87077 8.396998 12.46401       5.127417 12.46401       5.127417 12.46401       5.127417 28.87077 8.396998 28.87077 8.396998 0.000000       0.000000 
1 1 1 -7  0  32 o 15.17487 8.565775 3.740796       4.843955 3.740796       4.843955 3.740796       4.843955 15.17487 8.565775 15.17487 8.565775 0.000000       0.000000 
1 1 1 -7  0  33 o 85.04922 6.776209 90.22829       13.83285 90.22829       13.83285 90.22829       13.83285 85.04922 6.776209 85.04922 6.776209 0.000000       0.000000 
1 1 1 -7  0  34 o 65.13077 4.650327 52.60650       7.292711 52.60650       7.292711 52.60650       7.292711 65.13077 4.650327 65.13077 4.650327 0.000000       0.000000 
1 1 1 -7  0  35 o 38.58344 7.811085 20.33375       6.504041 20.33375       6.504041 20.33375       6.504041 38.58344 7.811085 38.58344 7.811085 -0.000000      0.000000 
1 1 1 -7  0  36 o 16.49894 9.384805 4.395180       5.874682 4.395180       5.874682 4.395180       5.874682 16.49894 9.384805 16.49894 9.384805 0.000000       0.000000 
1 1 1 -7  0  37 o 52.00953 5.588655 34.26385       6.876780 34.26385       6.876780 34.26385       6.876780 52.00953 5.588655 52.00953 5.588655 0.000000       0.000000 
1 1 1 -7  0  38 o 48.37140 6.233640 30.11772       7.012998 30.11772       7.012998 30.11772       7.012998 48.37140 6.233640 48.37140 6.233640 0.000000       0.000000 
1 1 1 -7  0  39 o 109.5402 5.799552 148.7256       15.38146 148.7256       15.38146 148.7256       15.38146 109.5402 5.799552 109.5402 5.799552 0.000000       0.000000 
1 1 1 -7  0  40 o 136.5138 4.610709 229.4704       15.29871 229.4704       15.29871 229.4704       15.29871 136.5138 4.610709 136.5138 4.610709 0.000000       0.000000 
1 1 1 -7  0  41 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -7  0  42 o 12.99088 8.277791 0.8515574      5.781449 0.8515574      5.781449 0.8515574      5.781449 12.99088 8.277791 12.99088 8.277791 0.000000       0.000000 
1 1 1 -7  0  43 o 19.49948 11.24532 6.896867       8.604241 6.896867       8.604241 6.896867       8.604241 19.49948 11.24532 19.49948 11.24532 -0.000000      0.000000 
1 1 1 -7  0  44 o 8.883216 6.209156 -4.495974      4.961175 -4.495974      4.961175 -4.495974      4.961175 8.883216 6.209156 8.883216 6.209156 0.000000       0.000000 
1 1 1 -7  0  45 o 13.27936 8.277285 2.088208       5.439126 2.088208       5.439126 2.088208       5.439126 13.27936 8.277285 13.27936 8.277285 0.000000       0.000000 
1 1 1 -7  0  46 o 32.73537 8.963628 17.02504       6.181423 17.02504       6.181423 17.02504       6.181423 32.73537 8.963628 32.73537 8.963628 0.000000       0.000000 
1 1 1 -7  0  47 o 8.052473 5.742961 -6.229540      5.005713 -6.229540      5.005713 -6.229540      5.005713 8.052473 5.742961 8.052473 5.742961 0.000000       0.000000 
1 1 1 -7  0  48 f 16.48488 9.806281 6.221352       6.892967 6.221352       6.892967 6.221352       6.892967 16.48488 9.806281 16.48488 9.806281 -0.000000      0.000000 
1 1 1 -7  0  49 o 11.75602 7.624494 1.520981       5.190289 1.520981       5.190289 1.520981       5.190289 11.75602 7.624494 11.75602 7.624494 0.000000       0.000000 
1 1 1 -7  0  50 f 27.63868 9.911812 15.44808       6.102015 15.44808       6.102015 15.44808       6.102015 27.63868 9.911812 27.63868 9.911812 0.000000       0.000000 
1 1 1 -7  0  51 o 9.950153 6.798419 -0.6111215     5.164665 -0.6111215     5.164665 -0.6111215     5.164665 9.950153 6.798419 9.950153 6.798419 -0.000000      0.000000 
1 1 1 -7  0  52 o 8.631293 6.102207 -3.464361      5.229021 -3.464361      5.229021 -3.464361      5.229021 8.631293 6.102207 8.631293 6.102207 -0.000000      0.000000 
1 1 1 -7  1  1  o 265.0081 4.768774 856.3531       30.79654 871.4236       54.14804 849.1473       37.44203 266.9935 8.332549 263.8417 5.823442 3.151764       10.16582 
1 1 1 -7  1  2  o 186.9197 3.655509 425.9005       16.65095 436.4227       29.43750 420.9501       20.19143 189.0206 6.400037 185.8102 4.459247 3.210403       7.800344 
1 1 1 -7  1  3  o 459.7287 6.712848 2579.031       75.20461 2535.107       105.1484 2625.031       107.6049 455.4608 9.473609 463.4606 9.527596 -7.999756      13.43594 
1 1 1 -7  1  4  f 200.2592 3.303043 488.8204       16.11917 485.7005       22.73612 491.9733       22.85626 199.5826 4.674740 200.8674 4.669384 -1.284821      6.607295 
1 1 1 -7  1  5  o 408.4280 6.012273 2035.010       59.83982 2139.614       87.45275 1942.916       82.05728 418.5299 8.574541 398.8432 8.442651 19.68671       12.03333 
1 1 1 -7  1  6  f 256.7885 4.004414 803.8743       25.05824 827.1143       36.07779 782.2134       34.83052 260.4036 5.685345 253.2388 5.644086 7.164810       8.011170 
1 1 1 -7  1  7  f 685.7662 11.39233 5754.215       190.3814 6208.582       347.3975 5559.182       227.6026 708.9006 20.13006 673.3626 13.87050 35.53802       24.44607 
1 1 1 -7  1  8  o 551.0507 9.213536 3709.738       123.7240 3677.055       212.8683 3726.412       152.0429 546.9326 15.98849 551.9177 11.30461 -4.985107      19.58127 
1 1 1 -7  1  9  o 293.4076 6.343717 1050.156       45.35772 1027.766       63.29641 1073.788       65.02970 289.9571 8.968746 296.3792 9.014322 -6.422089      12.71599 
1 1 1 -7  1  10 o 406.3246 5.991724 2013.535       59.32817 1970.800       82.77252 2058.686       85.08049 401.8034 8.453499 410.6603 8.501805 -8.856934      11.98926 
1 1 1 -7  1  11 o 72.62135 2.175679 64.32372       3.845964 68.37476       5.551678 60.58560       5.332943 74.84084 3.050427 70.43846 3.114557 4.402374       4.359538 
1 1 1 -7  1  12 f 361.7772 5.401598 1595.655       47.62112 1617.924       67.92584 1574.130       66.78161 364.1871 7.653751 359.2259 7.628746 4.961243       10.80637 
1 1 1 -7  1  13 o 35.37125 2.684881 15.33400       2.296970 14.38001       3.253937 16.28153       3.242904 34.11708 3.989032 36.36164 3.711781 -2.244556      5.448825 
1 1 1 -7  1  14 o 757.6942 10.85998 7008.250       200.5206 6699.537       275.0760 7358.319       292.9225 740.1436 15.25108 775.6339 15.49744 -35.49030      21.74319 
1 1 1 -7  1  15 f 420.1257 6.199244 2151.897       63.46789 2168.260       90.25700 2135.892       89.26550 421.5943 8.785169 418.4375 8.754210 3.156769       12.40223 
1 1 1 -7  1  16 o 583.1962 9.743158 4150.342       138.4684 4074.659       167.5845 4313.185       245.8210 577.6418 11.90527 593.3796 17.01763 -15.73779      20.76861 
1 1 1 -7  1  17 o 340.8622 7.264951 1416.923       60.34587 1437.525       86.03665 1396.973       84.66382 343.0247 10.30421 338.1490 10.28629 4.875732       14.55969 
1 1 1 -7  1  18 o 166.0105 3.060069 335.8541       12.37949 340.5324       17.63642 331.3103       17.38087 167.0923 4.334957 164.8128 4.331326 2.279449       6.127988 
1 1 1 -7  1  19 o 84.70554 2.643685 87.52106       5.450365 86.13175       7.612855 88.98205       7.806762 83.98300 3.729104 85.36232 3.762155 -1.379318      5.297172 
1 1 1 -7  1  20 o 55.42420 2.972454 37.54378       3.999991 40.04382       5.753470 35.20491       5.564923 57.16570 4.158516 53.56932 4.298979 3.596378       5.981177 
1 1 1 -7  1  21 o 92.35348 2.738967 104.0351       6.157380 108.6066       8.785565 99.62183       8.632162 94.31568 3.830489 90.31823 3.931421 3.997452       5.488964 
1 1 1 -7  1  22 o 250.4559 5.810264 765.1351       35.46201 740.8683       49.38494 790.9678       50.95354 246.1806 8.243614 254.3784 8.230573 -8.197800      11.64901 
1 1 1 -7  1  23 o 77.37717 2.826836 73.07207       5.321315 70.40550       7.417213 75.90022       7.638621 75.88370 4.025434 78.79940 3.990914 -2.915703      5.668467 
1 1 1 -7  1  24 f 426.2670 6.341619 2218.571       65.87460 2186.359       92.29675 2252.019       94.04947 422.7238 8.959704 429.0172 8.995919 -6.293427      12.69657 
1 1 1 -7  1  25 o 102.4211 2.785074 127.9745       6.944786 131.5705       9.924191 124.5238       9.721756 103.7883 3.930939 100.9648 3.958961 2.823494       5.579037 
1 1 1 -7  1  26 o 133.2226 2.953300 216.4061       9.587857 206.7866       13.29192 226.8403       13.84344 130.1137 4.197566 136.2849 4.173230 -6.171188      5.919071 
1 1 1 -7  1  27 o 228.0553 3.854054 634.6368       21.41875 625.9457       30.06652 643.5920       30.51994 226.3220 5.451552 229.4893 5.457391 -3.167282      7.713789 
1 1 1 -7  1  28 o 174.3937 3.311738 371.0393       14.07417 376.6471       20.05669 365.5992       19.75452 175.5320 4.693068 172.9367 4.691855 2.595230       6.636143 
1 1 1 -7  1  29 o 203.2098 4.965063 504.7727       24.58700 504.0908       34.55186 505.4722       34.99490 202.6305 7.007849 202.8905 7.088833 -0.2600098     9.968023 
1 1 1 -7  1  30 o 128.0439 2.975911 200.0301       9.285708 205.0805       13.30172 195.2296       12.96856 129.4960 4.220812 126.3445 4.218019 3.151466       5.967155 
1 1 1 -7  1  31 o 49.13694 3.540975 29.63339       4.211576 30.53585       5.904227 28.69853       6.009299 49.71662 4.938544 48.14452 5.204659 1.572105       7.174796 
1 1 1 -7  1  32 o 67.13383 3.171858 55.14386       5.174416 55.14441       7.151905 55.14326       7.495651 67.00520 4.404453 66.97765 4.620758 0.2754974E-01  6.383620 
1 1 1 -7  1  33 o 148.8942 4.743107 271.7168       17.18788 279.1571       24.63509 264.6596       23.99233 150.4761 6.735231 146.5082 6.738122 3.967941       9.527100 
1 1 1 -7  1  34 o 32.97925 6.067956 13.78476       4.696980 12.19064       5.943007 16.43748       7.666386 30.81488 7.883183 35.69579 8.855959 -4.880911      11.85633 
1 1 1 -7  1  35 o 211.2799 3.791938 546.0630       19.52340 576.9667       28.38809 518.3286       26.89305 216.7443 5.374677 205.3656 5.378364 11.37868       7.603549 
1 1 1 -7  1  36 o 45.86912 4.319334 26.01131       4.771233 22.89687       6.658360 29.29837       6.840407 42.56956 6.634676 48.42057 5.920154 -5.851013      8.891971 
1 1 1 -7  1  37 o 111.7393 3.140322 152.8037       8.542506 159.3688       12.29740 146.6813       11.87550 113.8684 4.440250 109.2281 4.470952 4.640228       6.301209 
1 1 1 -7  1  38 o 44.53457 4.278342 24.57702       4.586057 19.44431       6.374612 30.08366       6.602729 38.98502 6.965610 49.04438 5.626322 -10.05936      8.954062 
1 1 1 -7  1  39 o 127.4100 4.235033 199.9109       13.13084 185.4241       18.01353 216.3365       19.18104 122.0162 6.077352 131.8593 5.984930 -9.843063      8.529572 
1 1 1 -7  1  40 o 28.42812 6.041809 10.45309       4.056398 8.848794       5.314782 12.69160       6.278017 26.18316 7.769635 31.01684 8.187368 -4.833683      11.28717 
1 1 1 -7  1  41 o 11.72003 5.444205 -3.138446      3.739877 -10.80576      5.267255 4.656717       5.310986 11.14467 5.487550 21.05064 7.798329 -9.905967      9.535572 
1 1 1 -7  1  42 o 61.32727 4.389967 47.07099       6.517318 37.27588       11.88703 51.28093       7.793034 51.91385 9.754279 63.75435 5.057446 -11.84050      10.98743 
1 1 1 -7  1  43 o 35.46628 7.908778 17.33457       6.661104 13.55970       9.756106 20.63093       9.116803 30.97388 10.66912 37.75095 9.818816 -6.777067      14.49963 
1 1 1 -7  1  44 o 45.37416 5.121687 26.69071       5.564292 31.77491       6.688423 15.26213       10.02788 49.22520 5.679738 31.60250 10.81907 17.62270       12.21932 
1 1 1 -7  1  45 o 15.68437 6.378576 1.915684       3.822576 6.837369       5.396206 -3.041667      5.415723 22.35585 7.918549 14.24914 6.595555 8.106712       10.30557 
1 1 1 -7  1  46 o 23.35540 6.876745 7.993101       4.176739 3.438550       5.767418 13.01617       6.056802 18.73396 7.750155 28.85914 8.217857 -10.12518      11.29593 
1 1 1 -7  1  47 o 15.03787 6.301343 1.785076       3.883976 -3.827081      5.251190 8.563519       5.771090 13.05309 6.183989 22.94613 8.182695 -9.893038      10.25662 
1 1 1 -7  1  48 o 35.54613 6.233867 18.91793       5.203108 16.68550       8.411953 20.30130       6.621792 28.35545 9.899342 34.77767 7.982619 -6.422218      12.71689 
1 1 1 -7  1  49 o 18.92688 6.826587 5.856710       4.029216 6.370996       5.854488 5.393905       5.553744 19.34596 7.884085 18.47971 7.621231 0.8662491      10.96549 
1 1 1 -7  1  50 o 12.61543 5.770442 -0.1250234     3.976773 6.974647       5.738397 -6.685508      5.516194 18.98657 7.779576 11.41070 5.617996 7.575868       9.596025 
1 1 1 -7  1  51 o 18.02368 6.782463 6.144011       4.049005 -0.6563896E-01 5.343975 14.51353       6.204133 13.52731 6.356356 24.80863 8.509422 -11.28132      10.62137 
1 1 1 -7  1  52 f 13.20777 6.057331 1.154176       4.420784 0.3145316E-02  8.036663 1.653569       5.293631 14.52459 7.072077 14.01680 6.499401 0.5077906      9.605023 
1 1 1 -7  2  1  o 603.2325 8.707288 4445.145       127.9982 4590.297       184.9045 4311.589       177.3643 612.2008 12.39417 593.3558 12.26634 18.84497       17.43785 
1 1 1 -7  2  2  f 198.3407 3.819858 479.5591       18.46270 479.1432       32.35204 479.7599       22.48336 198.0403 6.713365 198.3588 4.651292 -0.3184814     8.167239 
1 1 1 -7  2  3  o 92.81516 2.595583 105.0706       5.864936 93.80305       10.23503 110.5792       7.156398 87.57558 4.814421 95.19978 3.088856 -7.624199      5.720113 
1 1 1 -7  2  4  o 112.0957 2.361633 153.1319       6.451152 153.5523       9.183758 152.7224       9.064035 112.1882 3.363007 111.8858 3.328077 0.3023758      4.731375 
1 1 1 -7  2  5  o 398.1789 5.878902 1934.035       57.04408 1951.232       81.22822 1917.301       80.12805 399.7117 8.339191 396.2255 8.298623 3.486206       11.76475 
1 1 1 -7  2  6  o 191.1527 3.202211 445.3621       14.91648 432.8978       20.84975 458.4308       21.34931 188.4267 4.540695 193.9046 4.518138 -5.477905      6.405582 
1 1 1 -7  2  7  o 534.7190 8.953176 3492.833       116.6645 3512.891       202.6746 3482.893       142.6716 534.6378 15.57280 533.6129 10.97173 1.024902       19.04970 
1 1 1 -7  2  8  o 286.3292 5.075427 999.7222       35.41394 948.8690       59.50549 1027.612       44.06780 278.5965 8.775811 290.2378 6.230621 -11.64127      10.76269 
1 1 1 -7  2  9  f 327.0579 5.697212 1304.529       45.40702 1375.075       57.49245 1187.565       74.02805 335.7046 7.027770 311.6239 9.760345 24.08063       12.02721 
1 1 1 -7  2  10 f 347.7745 5.209809 1474.685       44.15253 1475.040       62.47504 1474.331       62.40724 347.6969 7.373431 347.6137 7.367191 0.8319092E-01  10.42319 
1 1 1 -7  2  11 o 294.1249 4.508248 1054.545       32.31288 1094.135       46.79128 1018.453       44.67664 299.5262 6.410532 288.9841 6.344107 10.54208       9.019013 
1 1 1 -7  2  12 o 307.7868 4.694868 1154.757       35.21353 1101.737       48.39077 1214.433       51.33878 300.5754 6.606523 315.5713 6.675932 -14.99588      9.392242 
1 1 1 -7  2  13 o 480.7582 7.015377 2818.544       82.18902 2784.537       115.3627 2853.596       117.1229 477.6491 9.911067 483.5336 9.939833 -5.884491      14.03672 
1 1 1 -7  2  14 o 348.8881 5.242002 1483.771       44.56763 1493.687       63.33784 1474.046       62.72294 349.9756 7.426589 347.6680 7.403305 2.307648       10.48633 
1 1 1 -7  2  15 o 518.1608 7.543438 3274.281       95.25111 3110.290       129.9823 3464.479       139.9839 504.8057 10.56632 532.7547 10.78238 -27.94904      15.09659 
1 1 1 -7  2  16 o 477.1133 8.060865 2776.490       93.72151 2807.990       115.7103 2716.406       159.8046 479.6869 9.898700 471.2376 13.93126 8.449310       17.08988 
1 1 1 -7  2  17 o 345.1414 7.350055 1452.765       61.81924 1408.119       85.54445 1501.566       89.43661 339.4879 10.35236 350.5701 10.48075 -11.08221      14.73151 
1 1 1 -7  2  18 o 228.0119 3.753875 633.6257       20.85803 641.5784       29.75672 625.9440       29.24535 229.4085 5.322793 226.5966 5.296236 2.811859       7.508811 
1 1 1 -7  2  19 o 368.7441 5.545539 1657.772       49.83162 1740.768       72.74801 1584.405       68.39807 377.7417 7.902966 360.3839 7.788295 17.35776       11.09569 
1 1 1 -7  2  20 o 261.9570 4.181435 836.4497       26.69264 859.5753       38.39648 814.8206       37.13338 265.4997 5.934597 258.4969 5.894853 7.002777       8.364732 
1 1 1 -7  2  21 o 90.93932 2.708194 100.8740       5.994921 96.49753       8.335699 105.5629       8.628056 88.89162 3.857270 92.98293 3.815903 -4.091309      5.425832 
1 1 1 -7  2  22 o 591.2635 12.18441 4280.278       175.5584 4299.755       249.3665 4261.137       247.2017 590.9004 17.33635 588.2648 17.26285 2.635559       24.46538 
1 1 1 -7  2  23 o 334.9582 5.127619 1368.551       41.85453 1409.531       60.30236 1330.458       58.13936 339.7479 7.283522 330.0862 7.227813 9.661713       10.26114 
1 1 1 -7  2  24 o 334.4673 5.128480 1364.946       41.80020 1400.075       60.09209 1332.014       58.18295 338.5053 7.284769 330.1818 7.231137 8.323517       10.26437 
1 1 1 -7  2  25 o 204.0493 3.567350 507.7395       17.73851 525.4689       25.53345 491.2006       24.66135 207.4940 5.049727 200.5508 5.050122 6.943130       7.141672 
1 1 1 -7  2  26 f 188.8814 3.421361 435.1151       15.74796 441.8111       22.46071 428.6407       22.08598 190.1751 4.850522 187.3181 4.842451 2.857040       6.853969 
1 1 1 -7  2  27 o 215.7989 3.718762 568.2076       19.55616 594.2307       28.34108 544.5551       27.01942 220.5307 5.273649 211.1141 5.251975 9.416519       7.442756 
1 1 1 -7  2  28 o 94.87428 3.189229 109.9279       7.362960 117.6559       12.33147 105.6464       9.178729 97.97652 5.183279 92.93806 4.062593 5.038460       6.585670 
1 1 1 -7  2  29 o 105.5129 3.275597 135.9717       8.412129 137.7330       10.51234 132.8358       14.02690 106.1265 4.072360 104.0553 5.551833 2.071266       6.885272 
1 1 1 -7  2  30 o 229.7897 3.914606 644.8585       21.92072 691.7013       32.20935 604.4423       29.91843 237.7123 5.560249 222.2197 5.524847 15.49261       7.838387 
1 1 1 -7  2  31 o 126.5535 2.987369 195.4424       9.212956 196.5726       12.96308 194.2888       13.09612 126.7551 4.202499 126.0072 4.271094 0.7478104      5.991931 
1 1 1 -7  2  32 o 27.93270 5.678549 9.909465       3.733462 6.864502       5.173543 13.21839       5.393125 23.96235 7.760523 32.16486 7.073380 -8.202505      10.50040 
1 1 1 -7  2  33 o 176.1390 4.866511 380.2670       20.86858 380.2670       20.86858 0.000000       0.000000 176.1390 4.866511 ?        ?        0.000000       4.866511 
1 1 1 -7  2  34 f 75.59687 3.239417 69.94006       5.953861 70.02916       8.522970 69.85515       8.320733 75.46889 4.657013 75.39012 4.550273 0.7877350E-01  6.510972 
1 1 1 -7  2  35 o 89.39989 3.127246 97.76559       6.802456 98.38219       9.584342 97.13968       9.656312 89.50945 4.407526 88.93123 4.470084 0.5782242      6.277574 
1 1 1 -7  2  36 o 82.03185 3.201182 82.38435       6.386964 74.28322       8.955132 90.77172       9.111973 77.65808 4.754842 85.94212 4.365107 -8.284035      6.454664 
1 1 1 -7  2  37 o 74.27000 3.310461 67.61540       5.976477 59.20219       8.298113 76.68306       8.614809 69.21899 4.952185 78.91068 4.498594 -9.691689      6.690403 
1 1 1 -7  2  38 f 25.02566 6.688664 8.051068       4.157241 7.163023       5.809007 8.983390       5.952055 24.54633 8.235966 26.74389 8.283251 -2.197556      11.68090 
1 1 1 -7  2  39 o 14.77090 6.422578 -0.6047973     4.311112 4.954969       6.326798 -5.423790      5.890251 22.56245 8.480845 14.47383 6.759754 8.088616       10.84523 
1 1 1 -7  2  40 o 48.13790 4.152591 28.77250       4.823696 30.17871       6.664652 27.22542       6.990479 48.91837 5.697243 46.23273 6.374151 2.685638       8.549174 
1 1 1 -7  2  41 o 25.68428 7.525255 8.633693       5.012163 7.556447       9.430989 9.057723       5.916951 26.91656 10.29921 26.42626 8.270477 0.4903011      13.20888 
1 1 1 -7  2  42 o 32.10528 5.522348 13.33417       4.164762 14.98133       5.931161 11.73211       5.849415 33.40232 7.473739 29.43930 7.962932 3.963022       10.92085 
1 1 1 -7  2  43 o 61.57592 4.279044 47.72222       6.380923 48.16913       7.520845 46.57396       12.05528 61.47669 5.065082 58.00705 8.804489 3.469639       10.15746 
1 1 1 -7  2  44 o 43.12953 4.535494 23.84149       4.695638 19.66998       6.399757 28.70601       6.910933 37.75170 7.219513 46.39098 6.273838 -8.639282      9.564644 
1 1 1 -7  2  45 o 25.41467 7.481936 9.340075       4.944556 11.64320       5.765479 2.935656       9.614265 28.04795 8.027851 21.85596 9.545768 6.191994       12.47269 
1 1 1 -7  2  46 o 20.95964 6.715318 6.301750       3.880778 2.554507       5.194450 11.03549       5.838295 17.47628 7.302657 26.57344 8.199141 -9.097158      10.97974 
1 1 1 -7  2  47 o 22.09257 6.823234 7.461682       4.042076 12.49437       5.559978 1.820094       5.886724 27.69919 7.868979 17.02305 7.451411 10.67615       10.83717 
1 1 1 -7  2  48 f 30.16525 6.821741 14.26700       4.896695 12.05986       8.001301 15.58863       6.191548 24.57604 9.465290 29.88750 8.237205 -5.311451      12.54764 
1 1 1 -7  2  49 o 11.33358 5.341644 -2.285343      3.824859 5.090418       5.506860 -9.159980      5.316497 18.18130 7.551866 10.68140 5.304681 7.499900       9.228777 
1 1 1 -7  2  50 o 13.06804 5.900626 0.5075867      3.994673 -4.040667      5.642852 5.076754       5.655811 12.45467 6.031935 17.43119 7.465821 -4.976513      9.598058 
1 1 1 -7  2  51 o 14.62598 6.489065 2.551858       4.607800 5.061251       5.388340 -4.276689      8.888630 16.69634 7.220315 14.21959 7.025477 2.476756       10.07424 
1 1 1 -7  2  52 o 13.00402 6.032393 0.6564233      4.567700 -6.102273      8.122237 3.782614       5.523978 12.97593 6.462725 15.33261 6.929490 -2.356677      9.475475 
1 1 1 -7  3  1  o 98.84519 3.111446 119.2035       7.485360 121.4723       10.57956 116.9294       10.59224 99.71968 4.364190 97.82822 4.454808 1.891464       6.236302 
1 1 1 -7  3  2  o 183.3179 3.629264 409.6466       16.21285 398.0306       19.55142 435.2188       29.00903 180.6801 4.440500 188.7626 6.315286 -8.082565      7.720161 
1 1 1 -7  3  3  o 157.9811 3.293214 304.2110       12.67830 314.2385       22.73489 299.6852       15.27377 160.3959 5.826201 156.7369 4.002159 3.659058       7.068373 
1 1 1 -7  3  4  o 44.50521 2.163666 24.19471       2.339558 25.09972       3.444012 23.41922       3.188060 45.27078 3.141323 43.73130 3.009920 1.539486       4.350578 
1 1 1 -7  3  5  o 80.97954 2.155582 79.97064       4.250005 86.09089       6.228458 74.63821       5.813777 83.98921 3.048188 78.19508 3.056894 5.794136       4.316949 
1 1 1 -7  3  6  o 163.1273 3.329055 324.3510       13.23377 308.5802       22.44475 332.7554       16.38483 158.9482 5.804342 165.2125 4.069705 -6.264313      7.088927 
1 1 1 -7  3  7  o 207.5610 3.933025 525.1813       19.89338 547.5038       35.43067 514.9041       24.04049 211.7090 6.876707 205.4955 4.800702 6.213440       8.386646 
1 1 1 -7  3  8  o 284.2892 4.377136 985.3065       30.32400 956.9217       42.14746 1015.768       43.66185 280.0863 6.175092 288.5680 6.208945 -8.481689      8.756869 
1 1 1 -7  3  9  o 155.2560 3.267850 293.7846       12.36365 290.3428       15.15092 300.6448       21.39018 154.2795 4.033364 156.9142 5.602909 -2.634766      6.903666 
1 1 1 -7  3  10 o 153.1206 2.809370 285.7296       10.48283 281.0203       14.81889 290.4467       14.83103 151.7857 4.009862 154.3147 3.947160 -2.528976      5.626639 
1 1 1 -7  3  11 o 726.0344 10.41111 6437.408       184.2004 6430.800       260.4222 6444.023       260.5752 724.8320 14.74363 725.5783 14.73712 -0.7462769     20.84604 
1 1 1 -7  3  12 o 109.7691 2.442135 146.8298       6.532598 147.5815       9.315740 146.1024       9.163128 109.9885 3.480013 109.4369 3.440199 0.5515594      4.893409 
1 1 1 -7  3  13 o 589.5346 8.517392 4239.811       122.3635 4172.056       171.1840 4310.599       174.9746 584.4575 12.01916 594.0744 12.08643 -9.616943      17.04530 
1 1 1 -7  3  14 o 916.3373 13.08216 10258.21       292.1265 10335.80       415.4771 10182.35       410.8208 918.5617 18.56105 911.7360 18.49044 6.825745       26.19941 
1 1 1 -7  3  15 o 569.2287 8.238858 3952.156       114.2852 3858.364       159.1264 4052.077       164.2422 562.1432 11.61607 576.0734 11.69960 -13.93011      16.48677 
1 1 1 -7  3  16 o 337.1448 7.196889 1386.114       59.12858 1414.322       84.49623 1359.046       82.77133 340.2639 10.20178 333.5427 10.19536 6.721161       14.42296 
1 1 1 -7  3  17 o 264.2268 4.186948 850.9221       26.95942 860.2713       38.52094 841.9464       37.74368 265.6338 5.950830 262.7909 5.893834 2.842865       8.375539 
1 1 1 -7  3  18 o 332.2215 5.055766 1345.450       40.93085 1339.196       57.76922 1351.754       58.00141 331.3698 7.153977 332.9200 7.149285 -1.550232      10.11393 
1 1 1 -7  3  19 o 822.7839 11.79909 8272.106       236.5759 7837.503       321.9587 8782.157       348.7872 799.7860 16.51925 846.5018 16.90816 -46.71582      23.63835 
1 1 1 -7  3  20 o 222.7408 3.720090 604.7089       20.19246 622.7337       29.06334 587.8890       28.07520 225.9990 5.277193 219.5860 5.246650 6.412994       7.441512 
1 1 1 -7  3  21 o 162.8887 3.602049 323.4026       14.29805 314.8552       17.32933 341.6290       25.30544 160.6460 4.430886 167.2414 6.220015 -6.595337      7.636840 
1 1 1 -7  3  22 o 111.4270 3.313047 151.4718       8.986107 140.7673       15.92058 156.4765       10.88594 107.2434 6.117267 113.2251 3.951418 -5.981773      7.282490 
1 1 1 -7  3  23 o 178.5578 3.277129 388.6548       14.25963 409.0436       20.67778 370.1660       19.69075 183.0805 4.638479 174.1567 4.643802 8.923828       6.563565 
1 1 1 -7  3  24 o 304.9059 4.755333 1134.152       35.33319 1153.996       50.53547 1115.173       49.42055 307.3708 6.746798 302.1601 6.711729 5.210693       9.516647 
1 1 1 -7  3  25 o 88.38670 2.811242 95.33472       6.047398 102.1308       8.585121 88.64153       8.519876 91.42602 3.862067 85.14522 4.118384 6.280800       5.645941 
1 1 1 -7  3  26 o 84.11544 2.816220 86.36436       5.764552 78.95528       7.880150 94.89336       8.454764 80.34203 4.037848 88.10384 3.947982 -7.761810      5.647192 
1 1 1 -7  3  27 o 127.1898 2.924553 197.2838       9.064589 202.9506       12.91887 191.7885       12.72193 128.8827 4.118621 125.2800 4.172933 3.602684       5.863140 
1 1 1 -7  3  28 o 195.1368 4.010724 464.8507       19.07208 492.1575       33.16583 451.3593       23.31218 200.3147 6.804136 192.1207 4.983559 8.194000       8.433987 
1 1 1 -7  3  29 o 85.90330 3.267867 90.17172       6.828379 85.94749       8.306979 98.97287       11.99055 83.79546 4.080319 89.77851 5.507131 -5.983055      6.854012 
1 1 1 -7  3  30 o 88.78498 2.902820 96.27280       6.272079 92.96524       8.697485 99.85654       9.053332 87.14108 4.107320 90.31828 4.124245 -3.177200      5.820608 
1 1 1 -7  3  31 o 48.91816 3.591394 29.37877       4.251397 33.60233       5.974190 25.04545       6.051318 52.19982 4.748411 44.86443 5.660687 7.335388       7.388558 
1 1 1 -7  3  32 o 30.25582 6.013066 11.62351       4.277207 12.08519       5.174201 10.62723       7.600821 30.73982 7.056720 29.52499 9.391388 1.214834       11.74715 
1 1 1 -7  3  33 o 116.2716 3.514066 165.3218       9.945374 164.7644       11.96853 166.5653       17.87668 115.9793 4.241862 116.2378 6.335020 -0.2585220     7.624032 
1 1 1 -7  3  34 o 131.4985 3.696826 211.5745       11.83463 193.1624       20.99959 220.1439       14.32639 124.9809 6.921985 134.0231 4.392464 -9.042191      8.198026 
1 1 1 -7  3  35 o 97.03262 3.059184 115.1361       7.224644 109.0609       9.933541 121.9584       10.52661 94.26164 4.336086 99.68933 4.343576 -5.427689      6.137450 
1 1 1 -7  3  36 o 80.49218 3.223581 79.33372       6.310287 76.50643       8.714457 82.45043       9.149627 78.84753 4.554792 81.85396 4.605565 -3.006432      6.477450 
1 1 1 -7  3  37 o 112.0095 3.127522 153.5466       8.528368 167.6144       12.27900 140.4357       11.85409 116.8011 4.321449 106.8467 4.563228 9.954369       6.284741 
1 1 1 -7  3  38 o 66.89460 3.510777 54.97408       5.703054 48.43694       7.920531 62.01213       8.218387 62.45196 5.253065 70.81947 4.790279 -8.367516      7.109251 
1 1 1 -7  3  39 o 104.5781 3.218099 134.1411       8.191422 122.8666       11.35264 146.3858       11.83100 99.71130 4.685250 108.9234 4.466695 -9.212135      6.473247 
1 1 1 -7  3  40 o 58.70118 5.491385 43.21988       7.764163 42.02753       12.41404 43.98594       9.950521 56.41084 9.358357 58.67466 7.103672 -2.263817      11.74909 
1 1 1 -7  3  41 o 36.53162 4.881703 16.88930       4.237189 15.81241       5.868208 18.06235       6.124590 34.63512 7.188322 37.12898 7.026311 -2.493855      10.05192 
1 1 1 -7  3  42 o 91.75725 3.774633 104.4941       8.422149 101.0827       9.957785 113.0676       15.78591 89.86762 4.561907 93.43815 6.983317 -3.570526      8.341326 
1 1 1 -7  3  43 o 53.78008 3.742220 36.18549       4.873816 33.89519       6.789584 38.62029       7.000488 51.26505 5.521808 54.86810 5.301630 -3.603046      7.654910 
1 1 1 -7  3  44 o 14.26941 6.367621 -1.062823      4.502979 -4.429368      7.898499 0.5582562      5.480934 17.06341 7.921360 16.87998 7.290863 0.1834316      10.76590 
1 1 1 -7  3  45 o 42.31363 4.656681 23.33736       4.722391 21.13140       6.528169 25.75887       6.839654 38.58220 7.208330 43.04479 6.741574 -4.462589      9.869592 
1 1 1 -7  3  46 o 43.27088 5.591482 25.63803       5.758315 21.23114       6.558254 40.46926       12.03124 37.85181 7.375137 48.52152 10.48188 -10.66971      12.81649 
1 1 1 -7  3  47 o 14.29961 6.187746 0.9191061      3.962359 -0.1786746E-01 5.339284 2.067696       5.911556 15.23695 6.856009 17.17932 7.494541 -1.942363      10.15741 
1 1 1 -7  3  48 o 16.19760 6.511879 3.206416       3.932805 5.630455       5.642439 0.9161232      5.484571 19.32616 7.789277 15.61328 6.993052 3.712882       10.46784 
1 1 1 -7  3  49 o 16.76068 6.824982 3.965178       4.382970 5.928518       5.230742 -0.6624905     8.030576 18.83705 7.531477 16.14368 7.647945 2.693371       10.73379 
1 1 1 -7  3  50 o 19.17447 6.924448 6.660505       4.147131 6.550054       5.715646 6.783298       6.026554 18.54447 7.697425 18.68871 7.841404 -0.1442413     10.98808 
1 1 1 -7  3  51 o 14.69947 6.526995 2.637719       4.671335 8.022979       5.576858 -10.02545      8.551797 19.04138 7.718905 12.76042 6.396596 6.280961       10.02487 
1 1 1 -7  4  1  o 108.3961 2.447611 143.1924       6.465353 142.3772       8.961276 144.0774       9.337077 108.0234 3.408473 108.6616 3.530820 -0.6382675     4.907583 
1 1 1 -7  4  2  o 214.9838 3.147256 563.3268       16.48823 573.2977       26.35071 556.9109       21.13750 216.8243 4.987103 213.7328 4.058321 3.091492       6.429709 
1 1 1 -7  4  3  o 251.3442 5.651522 770.5512       34.61548 730.9814       47.69638 814.5868       50.31596 244.5450 8.014521 258.1661 8.007479 -13.62112      11.32927 
1 1 1 -7  4  4  o 232.7319 3.726125 660.2600       21.13243 646.3615       29.61703 674.6746       30.16196 230.2167 5.279205 235.2055 5.262304 -4.988831      7.453982 
1 1 1 -7  4  5  o 250.6487 4.548661 765.9973       27.78338 791.8858       49.10667 753.8087       33.69484 254.5534 7.926017 248.6054 5.561819 5.948013       9.682746 
1 1 1 -7  4  6  o 284.0158 5.045428 983.6484       34.92019 965.9572       59.95274 992.7322       42.95977 281.0872 8.763200 285.2669 6.179800 -4.179718      10.72304 
1 1 1 -7  4  7  o 697.5190 10.02834 5945.891       170.4595 5559.604       230.2069 6414.759       253.6230 673.5199 14.02593 723.3568 14.38798 -49.83685      20.09331 
1 1 1 -7  4  8  o 111.6546 2.425252 151.9255       6.598869 139.4355       9.206572 165.1212       9.463138 106.8982 3.539083 116.3461 3.341159 -9.447990      4.867078 
1 1 1 -7  4  9  o 639.6464 10.64259 4999.471       165.8912 4990.706       203.0298 5017.076       287.7424 638.6288 13.04593 638.6735 18.50747 -0.4467773E-01 22.64338 
1 1 1 -7  4  10 o 596.3956 9.956760 4343.496       144.7067 4138.802       171.4298 4850.860       269.8944 581.8669 12.09001 628.5355 17.63833 -46.66858      21.38408 
1 1 1 -7  4  11 o 804.8214 11.51918 7912.991       225.9212 7815.640       317.0361 8013.429       322.0241 798.8138 16.28647 808.8453 16.33755 -10.03143      23.06869 
1 1 1 -7  4  12 o 672.5094 9.667221 5519.705       158.4295 5528.242       224.3288 5511.210       223.7786 672.4750 13.68903 671.4404 13.67650 1.034607       19.35036 
1 1 1 -7  4  13 o 642.9951 9.262617 5044.505       145.1368 5030.821       204.7927 5058.314       205.7192 641.6821 13.09660 643.4299 13.12011 -1.747803      18.53802 
1 1 1 -7  4  14 o 839.7921 12.00689 8612.072       245.7189 8654.126       348.7235 8570.604       346.2873 840.9061 17.01757 836.8464 16.98067 4.059692       24.04040 
1 1 1 -7  4  15 o 494.9105 7.225108 2986.830       87.13790 3060.015       125.3765 2918.447       121.1931 500.7303 10.27487 489.0185 10.16990 11.71185       14.45682 
1 1 1 -7  4  16 o 651.7770 13.28185 5190.955       210.9569 5155.853       296.6446 5226.870       300.0610 648.3741 18.79461 652.8081 18.88185 -4.433960      26.64135 
1 1 1 -7  4  17 o 645.3949 9.301971 5082.907       146.2974 5081.560       206.9314 5084.253       206.8602 644.8216 13.16893 644.9937 13.16089 -0.1720581     18.61800 
1 1 1 -7  4  18 o 359.9445 5.423994 1579.499       47.57631 1593.789       67.75154 1565.596       66.82417 361.4673 7.691553 358.2579 7.654233 3.209412       10.85114 
1 1 1 -7  4  19 o 384.6194 5.756536 1803.733       53.95460 1802.044       76.32121 1805.420       76.28545 384.3043 8.149554 384.6649 8.138101 -0.3605652     11.51711 
1 1 1 -7  4  20 o 517.0511 7.549856 3261.912       95.12797 3272.959       134.9424 3250.999       134.1239 517.5662 10.69908 515.8309 10.66996 1.735291       15.11020 
1 1 1 -7  4  21 o 287.6716 5.221187 1009.114       36.60179 1015.058       45.07438 997.6069       62.71572 288.4602 6.412210 285.6635 9.020491 2.796661       11.06733 
1 1 1 -7  4  22 o 571.3452 9.616501 3990.521       133.8911 3988.938       232.3361 3991.308       163.8311 569.0906 16.77155 570.9341 11.77536 -1.843506      20.49253 
1 1 1 -7  4  23 o 227.6987 3.807267 632.1373       21.12565 648.6320       30.34608 616.6262       29.42745 230.5740 5.400775 224.8150 5.371447 5.759048       7.617139 
1 1 1 -7  4  24 o 334.7209 5.138725 1367.169       41.91547 1392.408       60.01678 1343.136       58.56473 337.5398 7.296449 331.5204 7.249194 6.019379       10.28538 
1 1 1 -7  4  25 o 122.3781 2.855292 182.5844       8.515112 182.3073       12.02740 182.8630       12.05703 122.1830 4.045049 122.3691 4.048843 -0.1860275     5.723246 
1 1 1 -7  4  26 o 114.1988 2.832512 159.0139       7.882597 165.3066       11.34628 153.1434       10.95915 116.3266 4.008551 111.9589 4.023360 4.367752       5.679429 
1 1 1 -7  4  27 o 193.6792 3.488191 457.6445       16.46339 458.6421       23.34612 456.6576       23.21989 193.7019 4.949950 193.2841 4.933818 0.4177704      6.988889 
1 1 1 -7  4  28 o 204.0651 4.116019 508.4342       20.46832 521.1981       35.04833 501.8278       25.21499 206.0970 6.988569 202.5585 5.112339 3.538528       8.658875 
1 1 1 -7  4  29 o 89.55553 3.281765 97.99571       7.149917 92.79926       8.589877 109.7166       12.90070 87.07933 4.059125 94.52424 5.626044 -7.444908      6.937497 
1 1 1 -7  4  30 o 36.86740 4.165910 16.81571       3.677246 15.86904       4.941875 17.99012       5.504290 35.52442 5.916587 37.83153 6.183953 -2.307110      8.558463 
1 1 1 -7  4  31 o 26.28910 6.406944 8.818832       4.066479 7.048117       4.787127 13.40809       7.706760 23.98171 7.428701 32.52317 9.272689 -8.541460      11.88143 
1 1 1 -7  4  32 o 32.23821 5.737424 13.12261       4.342147 11.93632       5.094975 16.27086       8.300018 30.55093 6.994720 35.59670 9.422266 -5.045769      11.73479 
1 1 1 -7  4  33 o 157.6947 3.257246 303.7194       12.51711 298.1298       17.49283 309.5845       17.91857 155.9848 4.606995 158.9511 4.630917 -2.966293      6.532212 
1 1 1 -7  4  34 o 103.6418 3.642545 131.4791       9.185443 144.3784       17.27204 126.3922       10.84642 108.0706 6.589757 101.5084 4.395205 6.562233       7.921031 
1 1 1 -7  4  35 o 34.53869 5.219731 14.96955       4.256361 10.29183       5.690316 20.91107       6.413102 28.39626 7.923696 40.65194 6.707393 -12.25568      10.38143 
1 1 1 -7  4  36 o 77.48660 3.259103 73.54155       6.140305 68.08210       8.446639 79.66002       8.941916 74.33790 4.686553 80.45222 4.579881 -6.114319      6.552792 
1 1 1 -7  4  37 o 104.8863 3.098303 134.6481       7.910470 119.6413       10.65065 153.1113       11.81372 98.62444 4.442958 111.6145 4.351741 -12.99002      6.219126 
1 1 1 -7  4  38 o 64.02207 3.899392 50.47328       6.054779 46.74593       9.298706 53.21687       7.977774 61.06828 6.340610 65.52057 5.035111 -4.452293      8.096646 
1 1 1 -7  4  39 o 68.37268 4.245317 57.75350       7.038517 54.75817       13.42730 58.88841       8.265065 65.17508 8.668949 68.87360 4.957617 -3.698517      9.986423 
1 1 1 -7  4  40 o 27.76391 6.817736 10.07775       4.578416 9.734718       5.552163 10.80669       8.093517 27.32049 7.896128 29.24939 9.719590 -1.928900      12.52275 
1 1 1 -7  4  41 o 66.86431 3.395980 55.20675       5.515325 51.15590       7.660537 59.56626       7.947043 63.87641 4.960179 69.03132 4.753160 -5.154911      6.869927 
1 1 1 -7  4  42 o 63.99682 4.037306 51.08926       6.264223 49.45058       7.251663 55.90731       12.43446 62.66520 4.784888 64.84042 8.041715 -2.175220      9.357581 
1 1 1 -7  4  43 o 19.90246 6.703210 4.982941       3.847819 3.272530       5.300675 6.888215       5.594479 19.20114 7.612845 23.21651 8.075088 -4.015371      11.09786 
1 1 1 -7  4  44 o 43.05725 5.171282 24.15568       5.317554 9.178019       9.416629 31.16791       6.443197 26.42803 10.24422 48.76499 5.518860 -22.33696      11.63623 
1 1 1 -7  4  45 f 27.61097 6.433267 10.70987       4.248005 5.237184       5.943077 16.42678       6.074244 20.85857 8.123523 33.57957 7.600751 -12.72100      11.12488 
1 1 1 -7  4  46 f 9.449212 4.623885 -5.995621      3.561037 -9.178871      4.823495 -2.182083      5.279472 10.47186 5.174113 14.20263 6.552025 -3.730769      8.348681 
1 1 1 -7  4  47 o 32.27570 8.097134 17.14934       6.357084 10.17877       7.786310 31.08506       11.00937 23.92463 9.303768 39.20132 11.05130 -15.27670      14.44616 
1 1 1 -7  4  48 o 14.20422 6.056563 1.489173       3.692282 -0.4189955     5.024025 3.730234       5.444654 14.27098 6.511774 17.57675 7.418507 -3.305770      9.871040 
1 1 1 -7  4  49 o 9.541553 4.734267 -7.651609      4.197259 -8.863624      5.074057 -5.024983      7.469657 10.41558 5.174302 14.15711 6.875968 -3.741538      8.605367 
1 1 1 -7  4  50 o 12.22566 5.607831 -0.2789877     3.791102 2.324190       5.429546 -2.755507      5.295812 15.33362 6.905382 12.56022 6.021916 2.773401       9.162301 
1 1 1 -7  4  51 o 13.29234 5.937421 1.418982       3.925180 -4.920930      5.303338 9.099169       5.837051 11.42863 5.602946 19.77474 7.939054 -8.346108      9.717077 
1 1 1 -7  5  1  o 551.4417 7.148960 3711.271       96.06795 3763.550       153.3537 3677.504       123.2487 554.6171 11.34658 548.6272 9.218686 5.989929       14.61947 
1 1 1 -7  5  2  o 216.9727 3.185527 573.7974       16.84311 571.2613       26.66640 575.4807       21.72532 216.4387 5.055840 217.2672 4.103326 -0.8284760     6.511436 
1 1 1 -7  5  3  o 135.6391 3.705919 224.4354       12.23798 0.000000       0.000000 224.4354       12.23798 ?        ?        135.6391 3.705919 0.000000       3.705919 
1 1 1 -7  5  4  o 297.8009 6.459257 1082.015       46.87536 1094.903       66.65038 1069.400       65.93890 299.2312 9.151039 295.7213 9.161088 3.509857       12.94863 
1 1 1 -7  5  5  o 560.4064 9.369465 3836.905       127.9540 3781.613       219.5038 3865.363       157.4767 554.6248 16.25832 562.0990 11.49654 -7.474182      19.91240 
1 1 1 -7  5  6  o 395.3549 5.855607 1906.414       56.41507 1900.623       79.75832 1912.212       79.80760 394.5542 8.295322 395.7572 8.275216 -1.203064      11.71715 
1 1 1 -7  5  7  o 358.7223 5.366025 1569.173       46.90803 1574.306       66.61315 1564.123       66.06618 359.1632 7.610831 358.0026 7.572808 1.160583       10.73649 
1 1 1 -7  5  8  o 495.9510 7.227178 3000.976       87.34611 2930.608       121.6984 3075.735       125.4385 489.7789 10.19645 501.7513 10.25903 -11.97241      14.46427 
1 1 1 -7  5  9  o 204.6476 3.942947 510.4753       19.66363 507.0362       24.10962 517.3082       33.98329 203.9383 4.851269 205.8291 6.784476 -1.890793      8.340499 
1 1 1 -7  5  10 o 593.1700 8.567589 4293.566       123.8437 4289.950       175.1101 4297.185       175.1728 592.4731 12.12848 592.9733 12.12259 -0.5001831     17.14810 
1 1 1 -7  5  11 o 167.7443 3.007774 342.9049       12.29502 345.5898       17.59407 340.3424       17.18858 168.3307 4.292610 167.0495 4.225786 1.281128       6.023601 
1 1 1 -7  5  12 o 698.8151 10.04139 5960.138       170.9985 6033.286       243.8165 5889.328       239.8881 702.4972 14.24237 694.0753 14.18293 8.421875       20.09977 
1 1 1 -7  5  13 o 810.5045 11.59758 8020.976       229.0650 8025.458       324.1660 8016.505       323.7282 809.8786 16.42523 809.4294 16.41215 0.4492188      23.21954 
1 1 1 -7  5  14 o 905.2654 12.93916 10010.88       285.4422 10325.94       412.3859 9721.086       395.4961 918.1912 18.43039 890.9466 18.21606 27.24457       25.91340 
1 1 1 -7  5  15 o 560.0062 9.395350 3826.441       128.2159 4092.293       164.1285 3410.165       205.3784 578.9192 11.63402 527.7350 15.98836 51.18420       19.77317 
1 1 1 -7  5  16 o 114.8721 3.649065 160.9791       10.20190 156.7231       13.80959 166.0926       15.13692 113.2786 5.015044 116.6043 5.341238 -3.325653      7.326629 
1 1 1 -7  5  17 o 479.7751 7.032173 2807.157       82.21733 2780.529       115.7315 2834.289       116.8219 477.2822 9.950392 481.8743 9.948428 -4.592133      14.07059 
1 1 1 -7  5  18 o 331.5643 5.059834 1340.167       40.88275 1272.824       56.12215 1416.307       59.67517 323.0468 7.129067 340.7663 7.186228 -17.71942      10.12252 
1 1 1 -7  5  19 o 276.1452 4.361836 929.5284       29.35235 969.5700       42.68200 893.6000       40.43045 281.9697 6.211640 270.7007 6.128909 11.26904       8.726282 
1 1 1 -7  5  20 o 521.8470 7.619953 3323.013       96.90173 3266.616       135.5602 3381.940       138.5688 517.0219 10.75938 526.0620 10.80917 -9.040100      15.25131 
1 1 1 -7  5  21 o 187.3576 4.832322 428.2974       22.04452 423.7133       31.92973 432.4728       30.47261 186.2068 7.049340 188.1540 6.656483 -1.947189      9.695461 
1 1 1 -7  5  22 o 89.87737 3.346975 98.60343       7.317783 87.68559       13.55841 103.0910       8.692577 84.50282 6.637414 91.87438 3.891371 -7.371559      7.694026 
1 1 1 -7  5  23 o 163.8675 3.146141 327.3393       12.56340 326.8948       17.77438 327.7831       17.76027 163.6563 4.460987 163.8793 4.451351 -0.2229919     6.301978 
1 1 1 -7  5  24 o 141.6860 2.960896 244.7302       10.22318 226.0319       14.04325 265.8116       14.91129 136.0624 4.240569 147.5669 4.150704 -11.50449      5.933867 
1 1 1 -7  5  25 o 85.72266 2.819851 89.68568       5.882561 89.80379       8.249991 89.56353       8.390174 85.70959 3.960624 85.58936 4.034028 0.1202316      5.653311 
1 1 1 -7  5  26 o 110.9571 2.825899 150.2155       7.634739 160.9800       11.01907 140.2765       10.58813 114.7938 3.944902 107.1398 4.062747 7.654015       5.662876 
1 1 1 -7  5  27 o 128.2101 2.931612 200.4731       9.159356 195.6530       12.77829 205.5666       13.13568 126.5326 4.149750 129.7009 4.161365 -3.168335      5.876852 
1 1 1 -7  5  28 o 78.93056 3.197156 76.12974       6.136848 60.93791       9.127661 88.66198       8.290273 70.39301 5.361337 85.12498 4.007714 -14.73196      6.693707 
1 1 1 -7  5  29 o 242.2092 4.674009 716.9758       27.58775 691.0920       33.15186 775.2658       49.74969 237.6170 5.725248 250.9613 8.145603 -13.34431      9.956370 
1 1 1 -7  5  30 o 47.07361 4.182468 27.28681       4.747951 30.72277       5.675883 19.27893       8.664987 49.90495 4.723383 38.74849 9.295838 11.15646       10.42703 
1 1 1 -7  5  31 o 148.9033 3.161111 270.6408       11.47044 271.7932       16.21634 269.4869       16.22697 149.0203 4.470568 148.3828 4.492812 0.6374664      6.338086 
1 1 1 -7  5  32 o 38.08662 4.885552 18.04683       4.430128 13.79914       5.114683 30.80564       8.864355 32.93394 6.603001 49.44096 7.600348 -16.50702      10.06801 
1 1 1 -7  5  33 o 96.65762 2.989130 114.1770       7.032258 109.6963       9.732994 119.0707       10.17174 94.59657 4.232884 98.56171 4.244926 -3.965141      5.994723 
1 1 1 -7  5  34 o 134.3023 3.721177 220.7197       12.16693 209.0814       21.87598 225.9323       14.64020 130.0196 6.929375 135.7590 4.431232 -5.739426      8.225087 
1 1 1 -7  5  35 o 58.56686 3.528461 42.09541       5.012501 40.27023       6.918108 44.11247       7.272669 57.06420 5.026253 59.74136 5.042583 -2.677166      7.119752 
1 1 1 -7  5  36 o 28.35930 5.992618 10.28357       4.011530 8.988873       5.523138 11.72914       5.836111 26.68057 7.921277 30.16067 7.861601 -3.480101      11.16026 
1 1 1 -7  5  37 o 25.09893 6.574631 8.087970       4.068483 5.784337       5.497514 10.87734       6.049408 22.78964 7.999405 29.09308 8.188586 -6.303438      11.44742 
1 1 1 -7  5  38 o 44.81300 6.656433 25.48577       7.048621 0.000000       0.000000 25.48577       7.048621 ?        ?        44.81300 6.656433 0.000000       6.656433 
1 1 1 -7  5  39 o 133.1634 3.202124 217.3515       10.39104 211.5432       14.52580 223.4388       14.87057 130.8966 4.560785 134.5379 4.542243 -3.641251      6.436826 
1 1 1 -7  5  40 o 45.74458 4.804484 26.20378       5.275938 27.75315       6.445874 23.05894       9.183388 46.82217 5.771291 41.44941 9.318834 5.372761       10.96123 
1 1 1 -7  5  41 o 75.11612 3.361201 69.64549       6.137087 55.39353       8.413771 85.84895       8.971339 66.34612 5.246704 83.02440 4.450466 -16.67828      6.880010 
1 1 1 -7  5  42 o 32.26075 6.377100 13.73980       4.835646 16.28373       5.798459 7.929871       8.762857 34.92921 7.055396 26.28830 9.958826 8.640907       12.20479 
1 1 1 -7  5  43 o 122.3791 3.227512 185.7938       9.616829 187.3951       13.63624 184.2092       13.56454 121.7914 4.602819 120.7355 4.618873 1.055992       6.520731 
1 1 1 -7  5  44 o 20.01047 7.157391 5.002375       4.418803 -4.591657      8.187033 8.946053       5.249001 17.25412 8.028526 25.18835 7.774789 -7.934229      11.17607 
1 1 1 -7  5  45 o 16.88310 6.557314 3.022287       3.864085 1.111522       5.463464 4.934700       5.465821 16.89141 7.287432 20.21391 7.813077 -3.322504      10.68414 
1 1 1 -7  5  46 f 27.96666 6.319284 11.29389       4.204892 9.970376       5.723969 12.84541       6.197443 25.12441 8.164931 28.25311 8.391582 -3.128704      11.70832 
1 1 1 -7  5  47 o 33.47306 6.058957 16.34155       4.760400 13.04163       6.996591 19.18591       6.495722 26.82093 9.038983 34.36139 7.919924 -7.540459      12.01784 
1 1 1 -7  5  48 o 12.43376 5.810389 -2.057276      4.362410 1.998887       5.151743 -12.33596      8.200972 15.98536 6.984560 13.21987 6.569247 2.765484       9.588488 
1 1 1 -7  5  49 o 29.10140 7.222306 14.54424       5.097599 9.372402       6.182249 25.52881       9.009811 21.68366 8.328143 33.38345 10.16410 -11.69978      13.14028 
1 1 1 -7  5  50 o 12.45848 5.787556 -0.6418130     4.227402 1.796417       5.036554 -6.454742      7.776670 14.70119 6.632960 13.38951 6.607140 1.311678       9.362182 
1 1 1 -7  5  51 o 10.68402 5.108241 -2.316453      3.753605 -3.211620      5.260856 -1.388179      5.357255 11.98325 5.808496 12.82685 6.124525 -0.8436060     8.440879 
1 1 1 -7  6  1  o 200.8669 3.354970 491.7772       16.42226 485.6063       23.10878 498.0735       23.34216 199.5689 4.751689 202.1149 4.739218 -2.545929      6.711091 
1 1 1 -7  6  2  o 346.3511 6.002325 1463.212       50.66081 1524.347       89.86599 1434.732       61.33611 352.9724 10.45918 342.8723 7.340872 10.10007       12.77822 
1 1 1 -7  6  3  o 123.4927 2.996991 185.8678       9.019090 188.2080       16.66734 184.8989       10.72497 124.1054 5.524964 123.1114 3.578679 0.9940033      6.582718 
1 1 1 -7  6  4  o 278.4918 3.876278 945.4110       26.30652 930.6864       41.30526 955.4593       34.12166 276.2237 6.136324 279.9272 5.002061 -3.703491      7.916760 
1 1 1 -7  6  5  o 331.2497 5.012664 1337.903       40.46320 1343.289       57.50903 1332.623       56.94238 331.7967 7.112593 330.4796 7.070576 1.317047       10.02906 
1 1 1 -7  6  6  o 264.0061 4.799510 849.7745       30.87785 846.5393       37.84779 856.2141       53.39661 263.4615 5.895046 264.7129 8.287773 -1.251404      10.17048 
1 1 1 -7  6  7  o 885.5009 12.66708 9592.175       273.3390 9298.401       378.3923 9912.756       395.2799 870.1312 17.84520 898.3325 18.05642 -28.20123      25.38672 
1 1 1 -7  6  8  o 144.4737 2.779338 254.3668       9.785124 246.1930       13.79624 262.6409       13.88066 142.0643 3.989051 146.7409 3.885125 -4.676605      5.568368 
1 1 1 -7  6  9  o 457.8225 7.754962 2557.054       86.51929 2492.453       104.2732 2699.816       155.0092 451.8646 9.469531 469.6366 13.55859 -17.77197      16.53806 
1 1 1 -7  6  10 o 328.1108 4.978122 1312.344       39.80358 1265.728       55.17556 1362.928       57.47646 322.1570 7.028183 334.2968 7.055399 -12.13986      9.958615 
1 1 1 -7  6  11 o 408.6866 6.055248 2036.372       60.30572 1941.130       82.81828 2143.873       87.98649 398.8934 8.519876 419.2018 8.613045 -20.30841      12.11498 
1 1 1 -7  6  12 o 403.6719 5.986955 1986.595       58.89394 1995.021       83.66873 1978.321       82.91362 404.4112 8.489926 402.7173 8.448692 1.693878       11.97745 
1 1 1 -7  6  13 o 491.7137 7.186899 2948.309       86.11722 2861.610       119.5439 3041.839       124.1637 484.2420 10.13045 499.2525 10.20560 -15.01053      14.37986 
1 1 1 -7  6  14 f 188.3951 3.275865 432.5308       15.03944 458.3074       22.10505 410.3159       20.52112 193.9108 4.677926 183.4211 4.594704 10.48972       6.557004 
1 1 1 -7  6  15 o 203.2041 4.013138 503.2500       19.87251 495.9545       24.16299 518.4994       34.93406 201.7128 4.915653 206.0887 6.965999 -4.375961      8.525772 
1 1 1 -7  6  16 o 188.3407 3.768954 432.3150       17.29820 437.6691       29.83898 429.6048       21.22956 189.3477 6.476308 187.7375 4.640383 1.610214       7.967165 
1 1 1 -7  6  17 o 663.8365 9.567233 5378.566       154.7688 5344.187       218.0699 5413.458       219.6915 661.1495 13.53505 665.4183 13.54823 -4.268860      19.15077 
1 1 1 -7  6  18 o 414.8810 6.165606 2098.894       62.33550 2045.678       86.85038 2155.435       89.52173 409.4299 8.704745 420.2673 8.741114 -10.83737      12.33611 
1 1 1 -7  6  19 o 253.8388 4.093403 785.3998       25.32087 766.4860       35.43682 805.1298       36.19341 250.7148 5.800144 256.9578 5.780049 -6.243073      8.188445 
1 1 1 -7  6  20 o 58.66668 2.964626 42.05317       4.224618 41.41492       6.024989 42.67046       5.925285 58.12918 4.283383 59.01912 4.146222 -0.8899345     5.961420 
1 1 1 -7  6  21 o 312.4507 6.877000 1191.348       52.36205 1210.109       75.73965 1174.172       72.47070 314.4879 9.895187 309.8152 9.610571 4.672729       13.79412 
1 1 1 -7  6  22 o 102.2822 2.745682 127.6005       6.837436 133.0822       9.883123 122.5682       9.469333 104.4051 3.891323 100.1904 3.885810 4.214691       5.499264 
1 1 1 -7  6  23 o 293.1231 4.607215 1048.048       32.90976 1036.883       46.41304 1059.338       46.67088 291.3963 6.536118 294.5380 6.502324 -3.141663      9.219602 
1 1 1 -7  6  24 o 77.32308 2.811710 72.98214       5.289224 75.43197       7.544351 70.61403       7.417449 78.54346 3.954350 75.98248 4.020252 2.560982       5.639088 
1 1 1 -7  6  25 o 16.78523 5.808736 3.092601       2.893171 3.489645       3.948346 2.632228       4.251586 18.63722 6.752882 18.00122 6.908275 0.6360035      9.660522 
1 1 1 -7  6  26 o 143.3887 3.014925 250.7356       10.53483 263.0408       15.21926 239.4157       14.59720 146.7396 4.260593 139.9870 4.284075 6.752594       6.042016 
1 1 1 -7  6  27 o 183.6249 3.838953 411.5194       17.17831 429.1198       29.45481 402.4472       21.14716 187.1150 6.469420 181.4434 4.786897 5.671555       8.047843 
1 1 1 -7  6  28 o 279.3875 4.486547 953.5187       30.54607 962.9208       43.51817 944.3876       42.88610 280.3989 6.368809 277.6944 6.337432 2.704529       8.984696 
1 1 1 -7  6  29 o 134.1044 3.455671 219.6437       11.28365 215.5022       13.69367 228.4033       19.91525 132.7539 4.238318 136.4332 6.004744 -3.679367      7.349849 
1 1 1 -7  6  30 o 288.0586 4.617348 1014.574       32.41227 991.3015       45.26941 1039.053       46.42830 284.2392 6.535590 291.0010 6.547149 -6.761810      9.250896 
1 1 1 -7  6  31 o 206.6137 3.678952 521.4459       18.52335 502.4951       25.69840 541.9390       26.72360 202.5043 5.211908 210.3703 5.212840 -7.866013      7.371410 
1 1 1 -7  6  32 o 16.84033 6.435583 2.387367       3.679304 -0.3361903     4.301078 9.817756       7.104194 15.08456 6.486471 28.42324 9.083673 -13.33867      11.16187 
1 1 1 -7  6  33 o 83.52228 3.047476 85.29617       6.192271 89.08051       8.667965 81.35190       8.849236 85.22782 4.186302 81.39837 4.478482 3.829453       6.130410 
1 1 1 -7  6  34 o 19.62174 7.504400 3.284164       5.005476 9.757824       10.00993 1.125690       5.780022 30.02958 10.76884 18.66013 7.742626 11.36945       13.26334 
1 1 1 -7  6  35 o 121.0133 3.089193 179.0549       9.102466 171.9788       12.54217 186.9298       13.23110 118.3921 4.354665 123.4276 4.406003 -5.035553      6.194834 
1 1 1 -7  6  36 o 100.6113 3.084912 123.8621       7.554611 119.0051       10.42044 129.2431       10.96827 98.40916 4.356040 102.5543 4.399054 -4.145103      6.190860 
1 1 1 -7  6  37 o 91.66684 3.901759 103.1887       8.695895 79.14531       15.52521 114.1802       10.49703 79.16344 8.164783 96.31594 4.484623 -17.15250      9.315337 
1 1 1 -7  6  38 f 119.7116 3.186027 175.6033       9.286145 167.7311       13.07989 183.6037       13.18594 116.6350 4.611005 122.0888 4.439384 -5.453789      6.400742 
1 1 1 -7  6  39 o 61.93500 3.629638 47.26992       5.454159 49.25713       7.423918 44.93949       8.039497 62.94831 4.877670 59.92648 5.568937 3.021839       7.403022 
1 1 1 -7  6  40 o 40.63087 5.021216 20.79984       4.865974 18.86060       5.831954 25.24312       8.827752 38.24427 6.489374 43.61995 8.610575 -5.375683      10.78211 
1 1 1 -7  6  41 o 84.79270 3.224151 88.65865       6.649945 95.70315       9.455121 81.76318       9.354570 87.64019 4.441668 80.85151 4.769060 6.788681       6.517081 
1 1 1 -7  6  42 o 10.71431 5.127191 -4.962556      3.799325 -3.330049      5.709198 -6.260184      5.090058 14.99960 6.880792 12.49519 5.967174 2.504412       9.107823 
1 1 1 -7  6  43 o 59.64873 3.662901 44.52452       5.298622 46.30986       7.392414 42.63820       7.598606 60.11301 5.094326 57.43574 5.495906 2.677277       7.493807 
1 1 1 -7  6  44 o 17.25809 6.890169 2.654302       4.371464 7.307219       8.695367 1.080563       5.056985 24.53032 9.742511 16.64857 7.093073 7.881742       12.05107 
1 1 1 -7  6  45 o 25.60107 6.348196 9.268909       3.940823 7.956652       5.389476 10.77667       5.777014 23.39260 7.933034 26.70169 8.140662 -3.309086      11.36677 
1 1 1 -7  6  46 o 16.33837 6.432087 2.951088       3.759598 -3.228349      4.795752 12.80411       6.055738 12.86129 6.036475 28.17624 8.276091 -15.31495      10.24367 
1 1 1 -7  6  47 o 11.16140 5.193279 -1.985572      3.424991 -3.623637      4.377875 0.5988046      5.498899 11.78961 5.603055 15.67300 7.012289 -3.883398      8.975881 
1 1 1 -7  6  48 o 13.80386 5.996776 1.055805       3.751504 0.3044442      5.045979 1.984361       5.609510 14.66020 6.624504 16.26571 7.190958 -1.605503      9.777215 
1 1 1 -7  6  49 o 21.15329 7.737845 8.425733       5.201559 8.425733       5.201559 0.000000       0.000000 21.15329 7.737845 ?        ?        0.000000       7.737845 
1 1 1 -7  6  50 o 14.50684 6.382382 2.218247       4.368706 1.283889       5.239473 4.349703       7.913506 14.44722 6.614035 17.07711 7.928118 -2.629890      10.32475 
1 1 1 -7  6  51 o 8.999322 4.442942 -5.284337      3.531399 -6.443766      5.179892 -4.277479      4.827058 10.74695 5.319427 11.09479 5.419345 -0.3478394     7.593787 
1 1 1 -7  7  1  o 671.0276 7.890108 5495.563       129.0207 5472.826       182.2488 5518.407       182.6776 669.0761 11.17771 671.8606 11.15758 -2.784485      15.79345 
1 1 1 -7  7  2  o 210.2434 3.141430 538.7245       16.09481 544.7430       25.68472 534.8334       20.65246 211.3717 4.986454 209.4644 4.045996 1.907364       6.421433 
1 1 1 -7  7  3  f 304.1490 4.685334 1127.804       34.72667 1058.684       67.29221 1152.893       40.54231 294.2721 9.395860 307.4834 5.410666 -13.21127      10.84239 
1 1 1 -7  7  4  o 189.7836 2.927804 438.9553       13.54057 445.7505       21.69955 434.6222       17.32810 191.2144 4.656869 188.8309 3.765666 2.383530       5.988879 
1 1 1 -7  7  5  o 442.8856 6.523255 2392.480       70.40313 2262.789       95.98195 2543.523       103.5820 430.4944 9.149259 456.4015 9.313245 -25.90701      13.05548 
1 1 1 -7  7  6  o 379.9321 5.670030 1760.134       52.49614 1729.329       73.59492 1792.045       74.90390 376.4505 8.022391 383.2161 8.020928 -6.765564      11.34434 
1 1 1 -7  7  7  o 216.3871 4.144042 570.7324       21.85202 559.9091       26.61105 593.1407       38.29032 214.3049 5.095582 220.3974 7.138709 -6.092514      8.770754 
1 1 1 -7  7  8  o 801.4941 13.27265 7854.967       259.2354 7666.783       312.3271 8271.721       464.7918 791.1507 16.19998 819.1503 23.30776 -27.99963      28.38469 
1 1 1 -7  7  9  o 301.3449 4.640270 1106.894       34.07558 1032.002       46.27060 1195.646       50.37029 290.9154 6.526829 313.1295 6.601070 -22.21408      9.282974 
1 1 1 -7  7  10 f 120.2271 2.607882 176.1411       7.640578 181.6590       11.13258 171.2274       10.50548 122.0307 3.748056 118.4758 3.643064 3.554901       5.226838 
1 1 1 -7  7  11 o 312.3757 4.785085 1189.374       36.42529 1186.874       51.62604 1191.852       51.40098 311.9897 6.790354 312.6448 6.746586 -0.6550903     9.572112 
1 1 1 -7  7  12 o 463.3374 6.800612 2617.618       76.78590 2637.339       109.3760 2598.453       107.8239 464.9136 9.654142 461.4780 9.588002 3.435638       13.60633 
1 1 1 -7  7  13 o 363.8830 5.467701 1614.092       48.48447 1613.808       68.69542 1614.375       68.44009 363.7670 7.749405 363.8322 7.719217 -0.6521606E-01 10.93799 
1 1 1 -7  7  14 o 499.3555 8.433924 3041.682       102.6303 3125.110       127.9517 2891.178       171.8561 506.0114 10.37647 486.0936 14.52434 19.91782       17.85015 
1 1 1 -7  7  15 o 484.5972 10.03233 2866.138       118.4728 2764.188       163.1560 2979.848       172.3103 475.3047 14.10183 493.4784 14.34393 -18.17371      20.11492 
1 1 1 -7  7  16 o 697.7668 11.60546 5946.649       197.3371 6104.604       246.3866 5664.029       329.5734 706.5311 14.31033 679.1068 19.93648 27.42438       24.54076 
1 1 1 -7  7  17 o 172.3163 3.172067 361.8626       13.32002 360.2333       18.97695 363.4448       18.70081 171.8507 4.535432 172.6191 4.449360 -0.7684021     6.353499 
1 1 1 -7  7  18 o 199.8412 3.467830 486.7309       16.88802 506.1559       24.58700 469.3809       23.23670 203.7624 4.951599 196.2225 4.859477 7.539886       6.937784 
1 1 1 -7  7  19 o 505.9864 7.408111 3123.722       91.34451 3208.830       131.6340 3044.676       126.8595 512.4777 10.54040 499.2117 10.42803 13.26602       14.82713 
1 1 1 -7  7  20 o 256.5757 4.770699 802.6488       29.82866 799.7264       36.70968 808.3278       51.17430 256.0640 5.882961 257.1875 8.175569 -1.123505      10.07220 
1 1 1 -7  7  21 o 202.1047 4.096473 497.9893       20.17543 476.3517       35.25505 508.5263       24.60223 197.3985 7.341734 204.2037 4.943958 -6.805191      8.851202 
1 1 1 -7  7  22 o 267.3608 4.285025 871.6841       27.91818 855.6807       39.20478 888.1489       39.76574 264.7850 6.075885 269.7638 6.049081 -4.978760      8.573668 
1 1 1 -7  7  23 f 251.9828 4.107308 774.3834       25.22111 769.8429       35.69781 778.9087       35.63835 251.1230 5.833362 252.6009 5.789573 -1.477890      8.218715 
1 1 1 -7  7  24 o 162.1597 3.146454 320.6177       12.43370 320.3882       17.64568 320.8441       17.52278 161.9838 4.474526 162.1017 4.440057 -0.1179504     6.303609 
1 1 1 -7  7  25 o 378.4669 5.730459 1750.134       52.85102 1778.702       75.66747 1722.921       73.85089 381.0019 8.149782 374.9977 8.081484 6.004242       11.47734 
1 1 1 -7  7  26 o 170.2986 3.250979 353.7488       13.49154 366.8018       19.48898 341.7371       18.69557 173.2560 4.620111 167.2304 4.591966 6.025650       6.513953 
1 1 1 -7  7  27 o 184.0407 3.844782 413.4141       17.24335 422.3684       29.23835 408.6388       21.35175 185.6178 6.473846 182.8244 4.796654 2.793411       8.057207 
1 1 1 -7  7  28 o 149.8518 3.119638 273.9586       11.39206 275.9826       16.02867 271.8926       16.19423 150.2477 4.382460 149.1201 4.461454 1.127548       6.253841 
1 1 1 -7  7  29 o 140.5888 3.528584 241.4247       12.07936 235.7117       14.57926 253.9328       21.57244 138.8290 4.314660 143.8272 6.169261 -4.998169      7.528352 
1 1 1 -7  7  30 o 68.84751 3.028676 57.95499       5.068892 61.72156       7.073571 53.97922       7.267346 70.95400 4.108536 66.29214 4.525747 4.661858       6.112484 
1 1 1 -7  7  31 o 193.3021 4.096591 456.7442       19.29724 474.7956       24.11172 424.5800       32.18540 196.8616 5.030221 185.6369 7.127975 11.22464       8.724170 
1 1 1 -7  7  32 o 108.1045 2.947606 142.7652       7.757896 145.8041       10.88236 139.6248       11.06250 109.1186 4.099788 106.7565 4.260851 2.362114       5.912961 
1 1 1 -7  7  33 o 109.9747 3.010873 147.7953       8.061440 145.6811       11.19357 150.0735       11.61955 109.0309 4.220888 110.6503 4.317528 -1.619308      6.037959 
1 1 1 -7  7  34 o 39.19148 5.654940 19.25373       5.244739 24.91145       10.29602 17.27122       6.094757 43.81507 9.879532 36.80891 7.051287 7.006153       12.13778 
1 1 1 -7  7  35 o 25.74167 6.284636 8.494247       3.907451 5.653177       5.136192 12.39785       6.020505 22.38875 7.739948 31.01431 7.934528 -8.625557      11.08438 
1 1 1 -7  7  36 o 55.30679 4.644902 37.81563       6.202454 41.86076       12.38910 36.46266       7.165028 57.09597 9.218173 54.14141 5.507224 2.954552       10.73798 
1 1 1 -7  7  37 o 75.07048 3.570007 69.18274       6.512206 59.13438       9.841722 77.00890       8.685557 68.92449 5.916704 79.03825 4.528410 -10.11376      7.450764 
1 1 1 -7  7  38 o 63.44877 3.543624 49.51571       5.457303 57.98048       7.566838 40.34009       7.878154 68.47381 4.560752 56.78228 5.773658 11.69153       7.357689 
1 1 1 -7  7  39 o 26.33217 6.382214 9.003236       4.052159 8.304644       5.495637 9.835544       5.998572 25.58877 7.964847 27.60331 8.269668 -2.014540      11.48156 
1 1 1 -7  7  40 o 60.60320 4.014577 45.53344       5.895445 45.87287       7.060370 44.75178       10.71428 60.60180 4.820556 58.78141 7.661922 1.820389       9.052227 
1 1 1 -7  7  41 o 37.37630 5.297872 17.84718       4.690341 16.81101       5.496940 20.62131       8.994306 35.84252 6.534086 38.56218 9.606973 -2.719666      11.61844 
1 1 1 -7  7  42 o 33.85354 4.983489 14.72390       3.988361 16.78428       5.472535 12.38980       5.824711 35.58288 6.552565 30.05416 7.863801 5.528715       10.23599 
1 1 1 -7  7  43 o 24.83083 6.806411 8.428819       4.240506 6.522130       5.943105 10.40625       6.052348 22.83249 8.283226 27.21427 8.339267 -4.381781      11.75394 
1 1 1 -7  7  44 o 14.21394 6.377030 -1.178298      4.581850 3.095176       9.548786 -2.456538      5.222324 22.19466 9.604906 14.37856 6.590302 7.816101       11.64845 
1 1 1 -7  7  45 o 41.22215 4.361728 22.14236       4.315142 24.64869       5.884980 19.22783       6.346144 42.48440 5.838587 36.27058 7.430002 6.213821       9.449552 
1 1 1 -7  7  46 o 17.02674 6.786898 3.256169       4.234635 4.027257       5.907742 2.441328       6.073036 18.95124 7.842314 17.85669 7.693390 1.094547       10.98591 
1 1 1 -7  7  47 o 17.68291 6.615910 4.376405       3.840803 -1.514282      5.035412 12.57155       5.939233 13.81503 6.382315 26.96338 8.260704 -13.14835      10.43902 
1 1 1 -7  7  48 o 19.83135 6.855950 6.363932       4.029965 3.383504       5.468127 9.907468       5.962354 17.09987 7.332747 23.07886 8.306848 -5.978991      11.08029 
1 1 1 -7  7  49 o 14.73643 6.432887 1.985787       4.361283 2.282833       5.294949 1.359098       7.690887 15.60598 6.938141 16.43350 7.691011 -0.8275270     10.35806 
1 1 1 -7  7  50 o 13.27970 6.101934 0.3752136      4.515419 4.199185       5.505995 -7.478845      7.890882 16.38609 7.188564 13.09194 6.495087 3.294149       9.688220 
1 1 1 -7  7  51 o 8.988234 4.450086 -5.689606      3.633928 -6.038624      5.198130 -5.355991      5.082132 10.86175 5.367594 10.95880 5.394906 -0.9704876E-01 7.610261 
1 1 1 -7  8  1  o 363.6343 4.883192 1612.033       43.27178 1594.158       55.58344 1639.532       68.94330 361.5464 6.308778 366.5724 7.717847 -5.026001      9.968242 
1 1 1 -7  8  2  o 808.8465 10.37259 7991.279       204.4511 8064.195       324.8590 7943.455       263.0884 811.0106 16.43737 805.7552 13.39869 5.255371       21.20642 
1 1 1 -7  8  3  o 481.8486 7.061064 2832.190       82.91190 2693.844       160.9583 2882.157       96.73294 468.9263 14.10154 485.9870 8.167961 -17.06070      16.29629 
1 1 1 -7  8  4  o 1219.856 15.56850 18229.18       462.7979 18116.35       729.9321 18305.03       598.4639 1211.118 24.73204 1220.188 20.12682 -9.070190      31.88672 
1 1 1 -7  8  5  o 265.9565 3.757290 862.1020       24.35126 864.8896       38.70888 860.2762       31.32661 266.3249 5.964345 265.6483 4.839164 0.6766663      7.680554 
1 1 1 -7  8  6  o 317.0419 4.853653 1225.313       37.49916 1176.203       51.95373 1278.723       54.17995 310.5492 6.865153 323.8005 6.866334 -13.25128      9.709628 
1 1 1 -7  8  7  o 548.1269 7.959177 3665.150       106.3128 3666.577       150.5367 3663.730       150.1618 547.9016 11.27467 547.6916 11.25090 0.2099609      15.92799 
1 1 1 -7  8  8  o 428.1668 7.305239 2235.859       76.22256 2202.424       92.56509 2306.282       134.3386 424.8530 8.940720 434.2561 12.70826 -9.403107      15.53822 
1 1 1 -7  8  9  o 708.3810 10.17961 6124.745       175.7253 6090.975       247.8521 6158.878       249.1794 705.8160 14.41003 709.7399 14.40711 -3.923889      20.37680 
1 1 1 -7  8  10 o 556.8406 8.080333 3781.942       109.6469 3875.207       157.7293 3694.725       152.5295 563.3687 11.48904 550.1043 11.37818 13.26440       16.16975 
1 1 1 -7  8  11 o 544.7676 7.918528 3619.442       105.1216 3501.981       145.5920 3747.370       151.9397 535.6045 11.15468 554.0428 11.25361 -18.43829      15.84521 
1 1 1 -7  8  12 o 300.9839 4.653222 1104.170       34.12975 1137.310       49.33728 1073.758       47.26303 305.4154 6.629002 296.7623 6.535469 8.653107       9.308922 
1 1 1 -7  8  13 o 287.0078 4.485657 1003.992       31.37298 936.3503       42.74267 1082.999       46.19428 277.1277 6.329152 298.0393 6.360314 -20.91156      8.972835 
1 1 1 -7  8  14 o 262.1383 4.852775 837.5960       30.99965 858.6028       38.55811 799.1993       52.12941 265.3791 5.962288 255.8254 8.373142 9.553680       10.27903 
1 1 1 -7  8  15 o 702.8749 11.66780 6033.813       199.8495 6075.396       347.6147 6013.282       244.2515 703.3198 20.30317 701.2627 14.29290 2.057068       24.82954 
1 1 1 -7  8  16 o 312.7849 4.825350 1192.579       36.77991 1110.632       49.95450 1289.592       54.35270 301.7827 6.792728 325.1859 6.858882 -23.40323      9.653260 
1 1 1 -7  8  17 o 745.8533 10.71994 6794.222       194.8417 6696.808       273.1422 6895.146       278.0181 739.6156 15.15468 750.4771 15.20196 -10.86151      21.46541 
1 1 1 -7  8  18 f 191.4828 3.386234 446.8698       15.80093 418.1572       21.80195 478.6381       22.93269 185.1403 4.836491 198.1467 4.749327 -13.00641      6.778477 
1 1 1 -7  8  19 o 124.9223 2.818574 190.1860       8.580360 175.5741       11.99463 205.4997       12.27930 119.9429 4.109776 129.7838 3.886933 -9.840843      5.656722 
1 1 1 -7  8  20 o 388.2365 6.727584 1839.200       63.64901 1828.630       77.97967 1860.298       110.1702 386.9761 8.269155 389.7274 11.61320 -2.751343      14.25641 
1 1 1 -7  8  21 o 240.3616 4.609025 704.5355       26.99668 699.7234       47.79333 706.7904       32.71592 239.1803 8.212027 240.6988 5.577622 -1.518478      9.927096 
1 1 1 -7  8  22 o 453.9901 6.721167 2516.926       74.35791 2524.555       105.6169 2509.429       104.7050 454.1623 9.543027 452.8112 9.488860 1.351074       13.45763 
1 1 1 -7  8  23 f 548.4383 8.021598 3679.296       107.2074 3752.764       153.7609 3609.792       149.5549 552.7794 11.41453 542.1828 11.31928 10.59656       16.07537 
1 1 1 -7  8  24 o 158.8328 3.144071 307.6159       12.16939 303.6949       17.24840 311.5022       17.17208 157.6927 4.493080 159.7146 4.416307 -2.021927      6.300122 
1 1 1 -7  8  25 o 142.5757 3.007239 247.8882       10.44840 260.1586       15.17529 236.8286       14.40715 145.9384 4.271682 139.2370 4.251050 6.701355       6.026499 
1 1 1 -7  8  26 o 186.2576 3.412981 423.2309       15.49116 420.0551       21.95717 426.3783       21.85879 185.3747 4.864802 186.7728 4.806592 -1.398117      6.838832 
1 1 1 -7  8  27 o 125.2354 3.262858 191.4772       9.949277 195.3238       16.44669 189.2570       12.49485 126.2790 5.356720 124.4331 4.126291 1.845879       6.761711 
1 1 1 -7  8  28 o 215.9069 3.756058 569.0803       19.76218 539.3171       27.15119 602.6128       28.81923 209.9174 5.311944 221.9614 5.328055 -12.04407      7.523624 
1 1 1 -7  8  29 f 89.65958 3.338420 98.25359       7.281397 97.80371       8.712758 99.29547       13.25914 89.39239 4.009830 89.81230 6.094291 -0.4199142     7.295144 
1 1 1 -7  8  30 o 164.8375 3.260419 331.6838       13.09681 344.5529       18.88078 319.7492       18.18233 167.7849 4.622159 161.6283 4.621062 6.156540       6.535944 
1 1 1 -7  8  31 f 124.4604 3.452968 189.3303       10.46261 184.2467       12.74445 199.8388       18.32352 122.6756 4.269622 127.4938 5.913826 -4.818237      7.294039 
1 1 1 -7  8  32 o 156.0189 3.227042 297.2745       12.26925 304.9761       17.51698 289.8575       17.19031 157.7818 4.560601 153.8123 4.591377 3.969513       6.471462 
1 1 1 -7  8  33 o 183.0699 4.117689 410.0707       18.36989 372.2290       31.73616 429.1377       22.52738 173.4158 7.527754 187.0404 4.946757 -13.62463      9.007634 
1 1 1 -7  8  34 o 38.14856 4.823306 18.12532       4.383877 27.03466       6.255005 9.524041       6.145911 46.57005 5.625548 27.60116 8.392880 18.96889       10.10382 
1 1 1 -7  8  35 o 95.87529 3.735311 112.6674       8.710394 113.4386       16.71957 112.3801       10.20460 95.43245 7.243506 95.64507 4.389924 -0.2126160     8.469936 
1 1 1 -7  8  36 o 106.6965 3.086210 139.3119       8.015951 131.1060       10.94254 148.8151       11.77580 103.2800 4.357556 110.0365 4.400422 -6.756554      6.192900 
1 1 1 -7  8  37 o 24.09621 6.933305 7.391996       4.289626 6.463125       6.088839 8.307327       6.044302 23.97215 8.418312 25.99660 8.385607 -2.024452      11.88219 
1 1 1 -7  8  38 o 141.0086 3.220346 243.6138       11.06583 231.4471       15.31322 256.9109       16.00885 136.9772 4.594066 144.3375 4.557108 -7.360275      6.470910 
1 1 1 -7  8  39 o 46.64788 3.962135 26.98050       4.461414 24.81652       5.973679 29.70994       6.708917 44.31936 5.660108 48.51515 5.788719 -4.195789      8.096054 
1 1 1 -7  8  40 o 79.57059 3.550236 78.14954       6.866746 75.00809       8.211758 85.45335       12.52117 77.69995 4.354319 82.10661 6.306203 -4.406662      7.663439 
1 1 1 -7  8  41 o 18.78551 6.726750 3.975472       3.904207 10.80329       4.594536 -13.76383      7.405747 28.51916 6.721727 13.45732 6.602337 15.06184       9.421914 
1 1 1 -7  8  42 o 23.89767 6.186175 7.624243       3.630366 4.294091       4.778910 12.16846       5.582468 19.81692 7.386677 29.77352 7.652691 -9.956598      10.63610 
1 1 1 -7  8  43 o 11.85803 5.370483 -1.511344      3.338843 -3.478701      4.233783 1.724848       5.430056 12.25775 5.726809 17.79465 7.453216 -5.536894      9.399296 
1 1 1 -7  8  44 o 37.70736 7.046985 19.93373       6.237353 0.000000       0.000000 19.93373       6.237353 ?        ?        37.70736 7.046985 0.000000       7.046985 
1 1 1 -7  8  45 o 51.94924 3.857127 34.67392       4.848077 28.34484       6.447268 42.90924       7.354369 45.35348 5.978990 56.46467 5.410945 -11.11119      8.063910 
1 1 1 -7  8  46 o 26.25604 6.926607 10.50147       4.495093 16.28295       6.457909 5.067665       6.260720 31.54930 8.292418 19.86362 8.130940 11.68568       11.61363 
1 1 1 -7  8  47 o 17.90225 6.518412 4.630139       3.685045 2.958302       4.944155 6.719652       5.527358 16.81784 7.082168 20.54339 7.878638 -3.725550      10.59387 
1 1 1 -7  8  48 o 19.71410 6.679441 6.283075       3.820682 4.172394       5.288023 8.588318       5.526376 17.54922 7.353072 21.77254 7.973954 -4.223318      10.84673 
1 1 1 -7  8  49 o 14.76097 6.674006 1.309856       5.130653 1.309856       5.130653 0.000000       0.000000 14.76097 6.674006 ?        ?        0.000000       6.674006 
1 1 1 -7  8  50 o 17.09033 6.602909 5.167623       3.902516 2.836524       5.387987 7.740072       5.660039 15.34627 6.897711 19.05342 7.756846 -3.707146      10.38013 
1 1 1 -7  8  51 o 23.19996 6.978417 10.55636       4.265188 11.05298       5.917429 10.01937       6.153254 21.06979 8.133306 19.89849 8.092641 1.171299       11.47351 
1 1 1 -7  9  1  o 552.3515 6.554366 3720.504       88.22310 3757.832       125.6562 3684.215       123.8951 554.8802 9.292841 549.4222 9.253621 5.458069       13.11436 
1 1 1 -7  9  2  o 521.7512 6.216014 3319.422       79.03357 3398.078       113.7414 3245.990       109.8983 527.6918 8.845089 515.7567 8.743999 11.93512       12.43757 
1 1 1 -7  9  3  o 428.5931 7.323930 2240.523       76.49368 2321.722       136.3149 2203.202       92.41589 435.6305 12.85477 424.9011 8.925297 10.72943       15.64947 
1 1 1 -7  9  4  o 168.2942 3.082505 345.1619       12.64180 343.3716       18.02479 346.8951       17.73515 167.7833 4.412272 168.6463 4.318962 -0.8629608     6.174267 
1 1 1 -7  9  5  o 543.2685 7.064186 3599.426       93.52178 3527.974       146.0125 3649.130       121.7805 537.4824 11.14782 546.8379 9.138669 -9.355469      14.41489 
1 1 1 -7  9  6  o 306.9975 4.235802 1148.718       31.68886 1090.954       48.68675 1191.175       41.74051 299.1088 6.679524 312.5860 5.479640 -13.47723      8.639588 
1 1 1 -7  9  7  o 523.8361 7.646448 3346.756       97.60930 3139.141       132.0851 3596.546       144.8814 507.0901 10.68889 542.7523 10.95405 -35.66211      15.30502 
1 1 1 -7  9  8  o 328.0346 5.785732 1311.831       46.25026 1313.178       56.86021 1309.197       79.50868 328.1582 7.110318 327.3810 9.977741 0.7772827      12.25202 
1 1 1 -7  9  9  o 611.6539 10.21475 4565.827       152.2543 4469.359       183.9462 4775.708       271.3234 604.9173 12.47840 624.2679 17.85362 -19.35065      21.78215 
1 1 1 -7  9  10 o 495.2539 7.243645 2990.932       87.42208 3081.194       126.2797 2907.859       121.1469 502.4667 10.31312 488.1385 10.18435 14.32819       14.49419 
1 1 1 -7  9  11 o 448.1683 6.607900 2448.933       72.16734 2380.611       100.3551 2522.103       103.8549 441.7272 9.322862 454.6616 9.373520 -12.93442      13.22039 
1 1 1 -7  9  12 o 686.0652 9.883356 5743.790       165.2365 5424.955       224.6404 6119.657       243.9060 666.2653 13.83581 707.5929 14.14500 -41.32758      19.78663 
1 1 1 -7  9  13 o 402.2858 6.937696 1973.401       68.01208 1988.687       83.73533 1943.765       116.5905 403.7613 8.510361 398.7628 12.01179 4.998444       14.72105 
1 1 1 -7  9  14 o 375.7188 5.645218 1720.958       51.68681 1698.458       72.71272 1743.938       73.48579 373.1517 7.996295 378.1159 7.975214 -4.964142      11.29357 
1 1 1 -7  9  15 o 455.1633 7.730271 2527.075       85.74287 2579.771       150.4912 2501.747       104.3335 459.1763 13.46371 452.7531 9.456407 6.423279       16.45282 
1 1 1 -7  9  16 o 329.6727 5.051609 1324.931       40.58343 1286.905       56.55621 1365.297       58.26941 324.8246 7.144886 334.5715 7.146864 -9.746948      10.10579 
1 1 1 -7  9  17 o 399.4596 5.973075 1945.791       58.14426 1884.088       80.76628 2012.174       83.77293 392.9200 8.435092 406.0540 8.466107 -13.13403      11.95097 
1 1 1 -7  9  18 o 275.6690 4.375607 926.3864       29.39424 927.5764       41.81866 925.2244       41.32520 275.7778 6.222642 275.4307 6.156962 0.3470459      8.753825 
1 1 1 -7  9  19 o 413.7742 7.111246 2089.223       71.70430 1997.200       120.0311 2140.285       89.41160 403.7871 12.21250 418.6372 8.764354 -14.85013      15.03193 
1 1 1 -7  9  20 o 384.2454 6.712007 1801.899       62.84882 1718.823       106.4853 1846.308       77.85557 374.4861 11.68287 388.7939 8.217395 -14.30780      14.28338 
1 1 1 -7  9  21 o 274.3755 4.382239 918.0587       29.30067 907.5422       41.44211 928.5704       41.43270 272.6793 6.236682 275.8258 6.164136 -3.146545      8.768853 
1 1 1 -7  9  22 o 402.0007 6.027916 1972.999       59.05139 1933.334       82.64374 2014.373       84.40672 397.5419 8.530823 405.7873 8.535766 -8.245392      12.06790 
1 1 1 -7  9  23 f 92.24511 2.766442 103.8260       6.211693 98.69078       8.822511 108.8740       8.747293 89.85873 4.039313 94.40498 3.810095 -4.546249      5.552735 
1 1 1 -7  9  24 o 92.64867 2.788022 104.7502       6.287488 101.1742       8.959101 108.2207       8.826092 90.97250 4.051437 94.10728 3.856829 -3.134789      5.593681 
1 1 1 -7  9  25 o 270.2659 5.071169 892.2502       33.39915 898.9758       41.05536 879.0890       57.43187 271.1109 6.214222 267.4392 8.824434 3.671692       10.79292 
1 1 1 -7  9  26 o 147.0146 3.441197 263.7001       12.32838 263.8266       20.58334 263.6293       15.39533 146.7600 5.766579 146.8765 4.305959 -0.1164703     7.196855 
1 1 1 -7  9  27 o 98.68111 2.825687 118.8691       6.788078 121.2931       9.730486 116.5711       9.474226 99.59097 4.017638 97.63240 3.990524 1.958572       5.662658 
1 1 1 -7  9  28 o 240.9211 4.693597 709.4390       27.55604 724.4256       34.07502 681.1150       46.84501 243.2626 5.748104 235.1754 8.186495 8.087143       10.00297 
1 1 1 -7  9  29 o 132.3971 3.009053 213.8949       9.708325 217.2418       13.83104 210.6443       13.63045 133.2628 4.264511 131.2211 4.268238 2.041702       6.033565 
1 1 1 -7  9  30 o 172.0299 3.333038 361.3195       13.97270 364.1725       19.88163 358.5351       19.64132 172.4664 4.735026 171.1289 4.714386 1.337524       6.681760 
1 1 1 -7  9  31 o 107.2869 2.987042 140.6131       7.801916 136.9772       10.69921 144.7418       11.40138 105.7603 4.159498 108.7007 4.312725 -2.940460      5.991746 
1 1 1 -7  9  32 o 110.0641 2.981959 148.0130       7.990670 143.4129       11.03588 153.0824       11.58514 108.1919 4.193721 111.7752 4.261042 -3.583359      5.978610 
1 1 1 -7  9  33 o 137.4385 3.739017 231.1464       12.51118 235.0966       23.52708 229.5889       14.77319 137.8678 7.025923 136.8550 4.435592 1.012802       8.308915 
1 1 1 -7  9  34 o 84.64420 3.794986 87.83401       7.807961 85.23559       14.81214 88.83385       9.188180 82.66492 7.432191 85.02876 4.449811 -2.363838      8.662464 
1 1 1 -7  9  35 o 157.9698 3.312833 305.1708       12.75292 317.4979       18.25510 293.4199       17.82336 160.7746 4.664339 154.5328 4.738558 6.241730       6.649059 
1 1 1 -7  9  36 o 47.79293 4.001104 28.19355       4.617204 30.27601       6.293951 25.76695       6.794123 49.30499 5.322629 45.22224 6.339020 4.082748       8.277291 
1 1 1 -7  9  37 o 26.92298 6.090345 9.330390       3.901986 3.568637       5.077471 17.64149       6.098169 19.89697 7.570630 37.05775 7.009499 -17.16078      10.31734 
1 1 1 -7  9  38 o 39.16117 4.396143 19.11952       4.122952 22.36786       5.580502 15.21536       6.117959 42.13102 5.571911 34.15939 7.550633 7.971638       9.383936 
1 1 1 -7  9  39 o 50.29309 3.847432 31.32393       4.679568 32.45922       6.341675 29.96676       6.933700 50.87434 5.187795 48.63455 5.975851 2.239788       7.913534 
1 1 1 -7  9  40 o 42.62458 5.821276 23.21972       5.888810 23.21972       5.888810 0.000000       0.000000 42.62458 5.821276 ?        ?        0.000000       5.821276 
1 1 1 -7  9  41 o 16.48882 6.330525 2.496495       3.571215 -0.8266301     4.702406 7.024920       5.489342 15.04787 6.620988 23.62027 8.006233 -8.572396      10.38929 
1 1 1 -7  9  42 o 34.72336 4.836065 15.49374       3.981250 12.57886       5.166918 19.75327       6.246005 30.38535 7.105592 38.35027 6.938773 -7.964911      9.931566 
1 1 1 -7  9  43 o 43.61377 4.112034 24.18104       4.318770 16.21134       5.723919 34.71497       6.580631 34.23015 7.095197 51.66144 5.302322 -17.43129      8.857564 
1 1 1 -7  9  44 o 50.84940 4.776583 33.70395       5.849568 41.26030       11.82368 31.25506       6.731030 51.51437 9.776154 48.18899 5.851670 3.325375       11.39365 
1 1 1 -7  9  45 o 12.16821 5.553930 -1.503730      3.658201 0.5406411      5.069325 -3.725191      5.284326 15.73644 6.900766 13.42903 6.313500 2.307409       9.353121 
1 1 1 -7  9  46 o 15.05902 6.222883 2.003815       3.712631 0.8718107E-02  4.792306 4.998588       5.871437 14.65389 6.552023 19.47614 7.910966 -4.822250      10.27192 
1 1 1 -7  9  47 o 14.23015 5.989601 1.636695       3.533669 1.047065       4.923385 2.263144       5.074777 15.22086 6.732571 16.26823 7.021028 -1.047373      9.727402 
1 1 1 -7  9  48 o 13.50281 5.874263 1.094558       3.610366 6.490094       5.152495 -4.109838      5.060407 19.49983 7.572468 12.15016 5.841244 7.349673       9.563598 
1 1 1 -7  9  49 o 12.29925 5.890805 -2.965806      5.039352 -2.965806      5.039352 0.000000       0.000000 12.29925 5.890805 ?        ?        0.000000       5.890805 
1 1 1 -7  9  50 o 13.04503 5.804971 1.213311       3.715356 4.439193       5.319023 -1.860214      5.191897 16.33563 7.118034 12.60735 6.022334 3.728283       9.323890 
1 1 1 -7  9  51 o 12.39678 5.663717 0.5749069      3.816188 2.321356       5.341925 -1.245337      5.453618 14.50456 6.654476 12.79382 6.127809 1.710743       9.046109 
1 1 1 -7  10 1  o 228.4875 3.097681 636.2122       17.24786 619.9764       24.14518 653.1297       24.64688 225.5347 4.393200 231.4868 4.369177 -5.952118      6.195960 
1 1 1 -7  10 2  o 274.8632 3.895946 920.7706       26.09550 954.5748       42.34265 900.0679       33.13644 279.8076 6.209870 271.7328 5.004121 8.074799       7.975194 
1 1 1 -7  10 3  o 800.3472 9.366658 7816.394       182.6834 7992.082       262.2853 7650.860       254.5931 808.6819 13.30945 791.2490 13.20375 17.43292       18.74782 
1 1 1 -7  10 4  o 221.8395 3.698087 599.7672       19.99181 599.2599       28.44450 600.2623       28.10396 221.7198 5.264505 221.9065 5.197104 -0.1866455     7.397628 
1 1 1 -7  10 5  o 525.2941 6.852924 3364.661       87.72322 3218.288       134.7582 3472.302       115.5613 513.4545 10.77004 533.4922 8.888906 -20.03772      13.96447 
1 1 1 -7  10 6  o 309.9761 4.279633 1171.085       32.32740 1162.587       51.06872 1176.767       41.75925 308.7815 6.786839 310.6974 5.515424 -1.915924      8.745347 
1 1 1 -7  10 7  f 523.7759 7.641277 3345.720       97.53210 3286.489       136.4634 3407.570       139.4474 518.8858 10.79216 528.3544 10.83051 -9.468628      15.28956 
1 1 1 -7  10 8  o 776.0672 11.13615 7352.192       210.6060 7102.808       290.7572 7627.455       305.4708 762.0968 15.65612 789.7007 15.87344 -27.60394      22.29530 
1 1 1 -7  10 9  o 530.5775 7.732078 3433.178       99.97263 3372.196       139.8733 3496.866       142.9419 525.6079 10.92036 535.2322 10.95926 -9.624268      15.47125 
1 1 1 -7  10 10 o 508.6713 7.435526 3155.344       92.16904 3125.641       129.7512 3185.598       130.9505 506.0579 10.52143 510.8888 10.51828 -4.830872      14.87732 
1 1 1 -7  10 11 o 420.4611 7.224939 2155.823       74.02802 2173.918       91.17855 2120.823       126.8050 422.1349 8.863502 416.5079 12.50746 5.627014       15.32965 
1 1 1 -7  10 12 f 477.7607 8.116585 2784.154       94.49740 2748.498       114.7656 2859.224       166.5245 474.5656 9.923830 483.4251 14.15078 -8.859558      17.28372 
1 1 1 -7  10 13 o 354.3123 5.370599 1530.361       46.37086 1527.269       65.75311 1533.421       65.40488 353.8652 7.625044 354.5797 7.569377 -0.7145386     10.74415 
1 1 1 -7  10 14 o 179.5610 3.724921 392.9527       16.29916 419.9757       29.20576 380.7293       19.64258 185.4724 6.471710 176.6760 4.566138 8.796402       7.920394 
1 1 1 -7  10 15 f 533.8080 7.789890 3476.118       101.3334 3309.775       138.8412 3665.728       148.2335 520.5770 10.94454 547.8365 11.10348 -27.25946      15.59071 
1 1 1 -7  10 16 o 280.9520 4.447454 962.1810       30.44947 935.3465       42.61125 990.1819       43.52748 276.9463 6.313827 284.9505 6.268418 -8.004272      8.897048 
1 1 1 -7  10 17 o 310.2043 4.817859 1173.134       36.41983 1113.686       50.15162 1239.465       52.97513 302.1570 6.811085 318.7629 6.819746 -16.60593      9.638454 
1 1 1 -7  10 18 o 179.2718 3.289482 391.7082       14.37062 400.5229       20.83849 383.7145       19.84420 181.1869 4.723608 177.3480 4.595548 3.838898       6.590261 
1 1 1 -7  10 19 o 157.8554 4.382865 304.0465       16.84353 318.1761       26.05182 293.8979       22.07886 161.3402 6.640313 155.1090 5.851711 6.231201       8.850779 
1 1 1 -7  10 20 o 112.5143 3.306928 154.4514       9.057263 134.0850       16.66015 162.9963       10.79128 104.6047 6.568858 115.5620 3.837290 -10.95730      7.607542 
1 1 1 -7  10 21 o 200.8139 3.530480 491.6639       17.27681 504.2072       24.99659 480.1912       23.90609 203.2923 5.045725 198.3968 4.944674 4.895523       7.064641 
1 1 1 -7  10 22 o 163.2233 3.154621 324.8154       12.54773 327.2567       18.11163 322.5621       17.40010 163.7188 4.544052 162.5499 4.396710 1.168808       6.322932 
1 1 1 -7  10 23 o 320.0969 4.975643 1250.765       38.81206 1199.877       53.73089 1306.287       56.12440 313.2267 7.039293 326.8195 7.047056 -13.59271      9.960554 
1 1 1 -7  10 24 o 54.78597 3.821955 36.79740       5.070595 37.15396       5.994083 35.90022       9.508161 54.98589 4.513058 53.63744 7.477288 1.348457       8.733701 
1 1 1 -7  10 25 o 106.3607 2.821385 138.0507       7.306275 132.6510       10.40266 143.3073       10.26400 104.1671 4.106101 108.2938 3.895695 -4.126762      5.660080 
1 1 1 -7  10 26 o 124.9060 3.258431 190.4662       9.909615 193.3813       16.49012 188.8185       12.39799 125.6472 5.398205 124.2936 4.098838 1.353584       6.777986 
1 1 1 -7  10 27 o 141.6681 3.032801 244.8397       10.47013 239.0820       14.78427 250.6331       14.82982 139.8355 4.343835 143.1868 4.254798 -3.351257      6.080477 
1 1 1 -7  10 28 o 118.1562 3.444494 170.5536       9.907270 164.9563       11.82892 183.7067       18.13304 116.1260 4.186885 122.2967 6.103719 -6.170708      7.401715 
1 1 1 -7  10 29 o 101.9991 2.879199 127.0438       7.149395 124.8364       10.03620 129.3181       10.18703 100.9953 4.086294 102.7964 4.074694 -1.801048      5.770696 
1 1 1 -7  10 30 o 95.96765 3.315179 112.5848       7.741325 108.1589       9.560930 121.0093       13.19093 93.96758 4.185790 99.22477 5.476550 -5.257187      6.892999 
1 1 1 -7  10 31 o 82.97003 3.009486 84.14964       6.074766 84.34831       8.491320 83.94134       8.694310 82.93977 4.215049 82.72478 4.327894 0.2149887      6.041299 
1 1 1 -7  10 32 o 124.3483 3.041303 188.8170       9.215850 188.1196       12.94181 189.5345       13.12651 123.9101 4.292485 124.3685 4.337787 -0.4583969     6.102608 
1 1 1 -7  10 33 o 192.3733 4.239234 453.0678       19.87322 438.7785       35.84001 459.4120       23.88078 188.0839 7.836696 193.4530 5.070042 -5.369080      9.333763 
1 1 1 -7  10 34 o 208.6266 3.762258 532.5999       19.12733 512.5605       26.53714 554.2674       27.59408 204.1557 5.338624 212.3049 5.337825 -8.149216      7.549390 
1 1 1 -7  10 35 f 53.02927 3.722468 34.59711       4.779860 27.96541       6.353427 43.24573       7.255525 47.32644 5.618449 59.09565 5.087703 -11.76921      7.579689 
1 1 1 -7  10 36 o 87.01037 3.438456 92.82661       7.276368 82.19055       10.89754 101.3834       9.774498 81.45358 5.522780 90.75480 4.433071 -9.301216      7.081894 
1 1 1 -7  10 37 o 60.18085 3.453264 44.53081       5.043093 37.90598       6.827922 52.48295       7.480717 55.19081 5.135684 65.10361 4.747859 -9.912807      6.994098 
1 1 1 -7  10 38 o 9.092140 4.441684 -6.048611      3.245451 -6.550561      4.328067 -5.403790      4.905498 11.11653 5.358933 12.75477 6.022986 -1.638248      8.061918 
1 1 1 -7  10 39 o 20.87953 6.402113 5.509287       3.566393 -1.585975      4.732329 14.83625       5.425765 14.68861 6.542964 33.73030 6.835335 -19.04169      9.462145 
1 1 1 -7  10 40 o 51.86466 4.940884 33.86462       6.169349 33.86462       6.169349 0.000000       0.000000 51.86466 4.940884 ?        ?        0.000000       4.940884 
1 1 1 -7  10 41 o 47.18164 3.945636 27.85810       4.495052 24.53730       5.959982 32.23907       6.845554 43.61539 5.747218 50.09676 5.709188 -6.481369      8.100947 
1 1 1 -7  10 42 o 19.05225 6.467270 4.525602       3.581946 7.333763       4.662841 0.4826665      5.594844 23.38164 7.345362 17.14668 7.385861 6.234955       10.41659 
1 1 1 -7  10 43 o 45.07449 4.044427 25.83897       4.395290 23.93547       5.831281 28.34304       6.688222 42.46551 5.785258 46.05277 6.110253 -3.587261      8.414535 
1 1 1 -7  10 44 o 37.14586 6.192811 19.02336       5.408509 13.74030       10.42518 20.96892       6.326481 28.79867 10.87309 38.43530 7.012861 -9.636631      12.93848 
1 1 1 -7  10 45 o 19.14808 6.848532 5.048232       4.045606 8.485044       5.943665 2.081491       5.522251 23.40970 8.308700 17.27122 7.386756 6.138477       11.11749 
1 1 1 -7  10 46 o 26.85713 6.837667 11.11290       4.486149 6.415254       6.675541 14.98168       6.058059 20.78285 8.437669 30.03626 8.094824 -9.253410      11.69275 
1 1 1 -7  10 47 o 13.88996 5.978784 1.198406       3.661151 3.542083       5.170298 -1.158646      5.185031 17.25708 7.253257 14.00827 6.473306 3.248810       9.721802 
1 1 1 -7  10 48 o 22.72482 6.637579 8.591826       3.904694 10.21441       5.610733 7.067899       5.437485 23.05984 8.082340 19.85414 7.759371 3.205706       11.20411 
1 1 1 -7  10 49 o 17.94856 7.068872 5.765236       4.542490 8.445732       5.582657 0.5135489      7.814169 20.23026 7.874897 15.69241 7.465816 4.537854       10.85138 
1 1 1 -7  10 50 o 9.163510 4.525180 -5.548241      3.671683 -10.64213      5.473102 -1.379632      4.951134 10.02241 5.036905 12.54858 5.962283 -2.526166      7.805078 
1 1 1 -7  11 1  o 512.0149 7.498730 3197.058       93.56348 2976.486       179.2654 3279.640       109.6888 493.1750 14.93344 518.5085 8.681013 -25.33350      17.27332 
1 1 1 -7  11 2  o 741.4711 12.31263 6714.533       222.4749 6548.777       379.4391 6801.368       274.6348 730.2393 21.34554 745.8071 15.11099 -15.56775      26.15290 
1 1 1 -7  11 3  f 754.7946 9.701323 6951.763       178.4415 6555.481       271.0823 7254.761       237.0388 732.1935 15.19285 770.6807 12.62144 -38.48718      19.75154 
1 1 1 -7  11 4  o 451.4380 5.961361 2484.498       65.58125 2516.902       104.6715 2463.557       84.14471 454.1851 9.457132 449.4507 7.682607 4.734375       12.18441 
1 1 1 -7  11 5  o 307.5044 4.265293 1152.466       31.96217 1115.857       49.69274 1178.298       41.74233 302.5186 6.740695 310.9030 5.509544 -8.384399      8.705863 
1 1 1 -7  11 6  o 218.9963 3.700195 584.4797       19.74684 559.3414       27.42010 611.5637       28.46148 214.2126 5.252765 223.9901 5.214260 -9.777420      7.401354 
1 1 1 -7  11 7  o 674.0317 9.716070 5543.526       159.5905 5407.485       221.9852 5689.057       229.5974 665.2426 13.69329 682.3263 13.80826 -17.08368      19.44670 
1 1 1 -7  11 8  f 495.6182 6.494504 2994.873       78.43851 2873.774       120.8109 3083.124       103.1325 485.2657 10.21622 502.7581 8.417831 -17.49240      13.23749 
1 1 1 -7  11 9  o 441.0432 7.544393 2372.198       81.08518 2368.200       99.28236 2380.207       140.5181 440.5739 9.247349 441.2049 13.08386 -0.6309509     16.02189 
1 1 1 -7  11 10 o 684.8633 11.40963 5726.800       190.4196 5608.263       229.9268 5985.620       339.7503 677.3954 13.92872 698.3984 19.98330 -21.00293      24.35860 
1 1 1 -7  11 11 o 730.0670 12.13819 6510.127       215.9498 6359.196       260.2396 6843.861       386.9766 721.1260 14.80901 746.3644 21.29815 -25.23840      25.94067 
1 1 1 -7  11 12 o 1132.877 18.69387 15732.50       516.0814 15534.59       626.7789 16149.16       909.4250 1124.042 22.88208 1140.240 32.76311 -16.19751      39.96262 
1 1 1 -7  11 13 f 210.2861 3.613530 538.9290       18.51733 525.8607       26.14433 552.0838       26.23080 207.6949 5.165537 212.8127 5.057991 -5.117722      7.229526 
1 1 1 -7  11 14 o 538.5077 9.066365 3539.092       118.9765 3280.575       195.6323 3690.831       149.8801 517.4294 15.53264 549.6987 11.18879 -32.26923      19.14293 
1 1 1 -7  11 15 o 97.58154 2.763163 116.1344       6.564065 126.2048       9.850647 108.0914       8.803366 101.6783 3.983287 94.09379 3.847412 7.584473       5.537973 
1 1 1 -7  11 16 o 615.4625 8.923909 4624.229       133.8421 4796.780       194.1549 4467.978       184.7573 626.2230 12.72282 604.4120 12.54389 21.81097       17.86671 
1 1 1 -7  11 17 o 178.0311 3.294686 386.3017       14.29374 380.0781       20.42892 392.2706       20.00650 176.4988 4.754042 179.3179 4.582131 -2.819016      6.602790 
1 1 1 -7  11 18 o 94.56815 2.783828 109.0888       6.408412 116.4771       9.638296 103.2346       8.579545 97.66251 4.058671 91.94519 3.837558 5.717316       5.585665 
1 1 1 -7  11 19 o 185.4922 4.774616 419.8855       21.56448 452.9180       33.50626 396.5278       28.17540 192.4753 7.156023 180.1394 6.428684 12.33591       9.619596 
1 1 1 -7  11 20 o 233.6377 3.903283 665.5909       22.22332 666.3088       31.75233 664.9016       31.11443 233.6753 5.576050 233.4350 5.469654 0.2403564      7.810855 
1 1 1 -7  11 21 o 316.1677 4.917829 1219.680       37.89022 1159.193       52.16241 1287.247       55.13041 308.0146 6.949446 324.5793 6.970023 -16.56470      9.842562 
1 1 1 -7  11 22 o 197.5332 3.513829 475.8384       16.91441 463.0993       23.86050 488.7066       23.98113 194.7185 5.032692 200.1039 4.917879 -5.385437      7.036585 
1 1 1 -7  11 23 o 23.98902 6.709942 7.234971       4.075318 5.671893       4.701073 11.96194       8.175195 22.18879 7.408475 31.29054 9.710391 -9.101757      12.21381 
1 1 1 -7  11 24 o 88.71750 2.807124 96.07208       6.061220 95.71640       8.743156 96.40120       8.410251 88.46649 4.066460 88.79657 3.896145 -0.3300781     5.631700 
1 1 1 -7  11 25 o 122.2311 3.236587 182.3842       9.632144 172.4099       15.78985 188.2957       12.15589 118.6276 5.476833 124.1347 4.023754 -5.507118      6.796051 
1 1 1 -7  11 26 o 124.5466 2.926547 189.2071       8.882257 185.7709       12.69154 192.5059       12.43520 123.2661 4.231353 125.4989 4.071476 -2.232819      5.872076 
1 1 1 -7  11 27 o 122.2743 2.941516 182.3911       8.764810 185.1562       12.61925 179.8139       12.18289 123.0475 4.214694 121.2663 4.128647 1.781227       5.899947 
1 1 1 -7  11 28 f 118.1255 3.474545 170.4911       9.990914 190.3427       12.50632 135.4750       16.60986 124.7508 4.119514 104.8900 6.530642 19.86089       7.721378 
1 1 1 -7  11 29 o 214.7595 3.770794 563.3881       19.73428 557.2630       27.96280 569.4659       27.85450 213.2427 5.385402 215.6496 5.300423 -2.406937      7.556258 
1 1 1 -7  11 30 o 53.51136 3.800554 35.16496       4.923721 35.46627       6.361117 34.71465       7.776622 53.59976 4.925076 52.82900 6.155835 0.7707634      7.883571 
1 1 1 -7  11 31 f 185.0141 3.493212 418.2103       15.74947 406.1100       22.07223 430.7614       22.47959 181.9962 4.981457 187.4554 4.925277 -5.459274      7.005231 
1 1 1 -7  11 32 o 157.9650 3.274705 304.8448       12.60576 291.6235       17.61807 318.7132       18.04404 154.2163 4.693509 161.2468 4.596739 -7.030502      6.569554 
1 1 1 -7  11 33 o 136.2548 3.741289 227.2604       12.41075 237.6897       23.57133 223.2603       14.59807 138.5560 7.003797 134.9206 4.446052 3.635391       8.295815 
1 1 1 -7  11 34 o 90.16817 3.084585 99.47848       6.767779 101.9775       9.474606 96.87500       9.670574 91.12095 4.278794 88.77184 4.484874 2.349106       6.198562 
1 1 1 -7  11 35 o 56.63977 3.546904 39.41978       4.871037 42.26881       6.825279 36.46238       6.953893 58.45531 4.834571 54.16895 5.337204 4.286358       7.201307 
1 1 1 -7  11 36 o 9.556566 4.663239 -6.530304      3.547982 -5.687641      4.626569 -7.733394      5.528165 12.13418 5.764859 12.83479 6.153307 -0.7006159     8.431891 
1 1 1 -7  11 37 o 43.66109 4.118978 23.63659       4.330691 23.26999       5.843080 24.08343       6.450990 42.97526 5.721410 43.59861 6.250341 -0.6233559     8.473565 
1 1 1 -7  11 38 o 64.13460 3.382958 50.63287       5.268494 45.95449       7.088888 56.40553       7.874422 60.76541 4.826879 67.35791 4.829316 -6.592499      6.827961 
1 1 1 -7  11 39 o 87.01782 3.130351 93.14911       6.627187 84.54900       8.906913 103.8149       9.919094 82.49539 4.447027 91.42851 4.465498 -8.933121      6.302120 
1 1 1 -7  11 40 o 47.78588 4.560106 28.69604       5.245879 26.74523       6.105823 34.19549       10.25172 45.77026 5.590113 50.39856 8.659182 -4.628300      10.30683 
1 1 1 -7  11 41 o 66.30474 3.345624 54.55585       5.388304 57.68886       7.381838 50.98275       7.883279 67.69805 4.500127 63.30778 5.154480 4.390270       6.842501 
1 1 1 -7  11 42 o 56.08877 3.640667 39.42931       4.949258 36.31978       6.640851 43.31432       7.422875 53.06070 5.202683 57.91175 5.319168 -4.851048      7.440528 
1 1 1 -7  11 43 o 25.30159 6.190524 8.824126       3.785119 8.790275       4.920650 8.873188       5.923780 24.87601 7.498345 24.94386 8.316027 -0.6784821E-01 11.19739 
1 1 1 -7  11 44 o 27.61629 7.423645 11.28468       5.103010 9.997480       9.634905 11.78654       6.016112 25.72785 10.24321 27.71881 8.276460 -1.990961      13.16902 
1 1 1 -7  11 45 o 43.17189 4.988227 25.23027       5.151463 19.08686       7.613592 30.41753       6.996057 33.63328 9.079320 46.04187 6.408881 -12.40859      11.11341 
1 1 1 -7  11 46 o 11.26682 5.255351 -2.130896      3.542089 4.065725       4.987557 -8.436611      5.031269 17.95220 7.291504 10.81070 5.330785 7.141504       9.032348 
1 1 1 -7  11 47 o 26.71293 6.951241 11.59942       4.567828 18.17456       7.659267 7.969974       5.690559 30.09480 9.408367 21.30281 8.035365 8.791988       12.37273 
1 1 1 -7  11 48 o 13.78893 6.172237 0.7842399      4.265703 -2.491761      5.249892 7.149417       7.317852 12.93415 6.143773 19.52716 8.429322 -6.593014      10.43070 
1 1 1 -7  11 49 o 18.56902 7.119410 6.476431       4.512523 7.454412       5.697776 4.830851       7.390945 19.06455 7.774670 17.26161 7.884675 1.802946       11.07310 
1 1 1 -7  11 50 o 24.39926 6.814637 11.12381       4.206799 7.705595       5.992757 14.44467       5.906799 18.43518 7.782000 25.02787 8.302967 -6.592691      11.37975 
1 1 1 -7  12 1  o 132.8611 2.888377 215.1083       9.351642 241.9356       19.62518 207.2272       10.63692 140.7598 5.733355 130.3586 3.351201 10.40114       6.640927 
1 1 1 -7  12 2  o 516.0142 6.164551 3246.239       77.51739 3176.799       108.0594 3319.858       111.2630 510.3197 8.689291 521.6793 8.752078 -11.35965      12.33299 
1 1 1 -7  12 3  o 302.3859 5.455590 1114.616       40.20123 1164.830       72.34972 1092.189       48.35277 308.8254 9.625391 299.2960 6.629556 9.529419       11.68756 
1 1 1 -7  12 4  o 330.4937 5.080728 1331.382       40.91902 1264.172       56.16727 1407.397       59.73372 321.9818 7.158399 339.7299 7.215222 -17.74814      10.16376 
1 1 1 -7  12 5  o 202.0918 3.545232 497.7219       17.45941 515.4041       25.18956 481.3725       24.22154 205.6304 5.026864 198.6630 5.007200 6.967422       7.095168 
1 1 1 -7  12 6  o 582.2228 8.460970 4134.869       120.0454 3998.400       166.0817 4284.170       173.7151 572.2261 11.91017 592.3083 12.03521 -20.08228      16.93217 
1 1 1 -7  12 7  o 891.6267 12.76136 9711.198       277.2784 9553.110       387.9899 9876.220       396.4074 883.2276 18.02651 898.0178 18.11426 -14.79016      25.55546 
1 1 1 -7  12 8  o 105.7196 3.231351 136.3309       8.315063 135.2085       10.32819 138.3988       14.01822 105.2505 4.034307 106.4141 5.423660 -1.163582      6.759565 
1 1 1 -7  12 9  o 373.9475 5.649548 1704.725       51.48260 1768.466       74.61452 1646.806       71.12552 380.7725 8.041215 367.4464 7.943199 13.32614       11.30290 
1 1 1 -7  12 10 o 241.7249 4.627481 712.2080       27.25851 709.0123       33.41039 718.5701       47.14079 241.1597 5.685134 242.5841 7.985287 -1.424423      9.802324 
1 1 1 -7  12 11 o 773.2307 11.10923 7300.870       209.3289 7478.182       301.0864 7134.975       291.2311 781.6892 15.80596 763.5737 15.65131 18.11548       22.24392 
1 1 1 -7  12 12 o 513.0341 7.516354 3210.378       93.97008 3328.085       136.4804 3104.280       129.5758 522.0695 10.72768 504.2284 10.54534 17.84113       15.04285 
1 1 1 -7  12 13 o 294.1285 6.487421 1054.983       46.49917 1058.434       66.36562 1051.655       65.17020 294.3358 9.264142 293.4024 9.125939 0.9333191      13.00412 
1 1 1 -7  12 14 o 188.2091 3.411670 431.7153       15.64746 433.1003       22.56293 430.4319       21.71888 188.4210 4.918148 187.8470 4.748380 0.5740204      6.836321 
1 1 1 -7  12 15 o 487.1000 7.169010 2894.539       85.09683 2848.103       119.4002 2942.475       121.3128 482.8777 10.14686 490.8130 10.14272 -7.935364      14.34690 
1 1 1 -7  12 16 o 212.4107 3.667612 549.9432       18.98435 553.4695       27.25673 546.6207       26.45698 213.0497 5.249970 211.7311 5.127664 1.318588       7.338605 
1 1 1 -7  12 17 o 186.1770 3.394576 422.4901       15.40095 421.7302       22.14855 423.2014       21.42971 185.9087 4.893135 186.2419 4.725563 -0.3332672     6.802479 
1 1 1 -7  12 18 o 526.9495 10.94534 3398.704       140.5512 3265.853       195.0191 3542.289       202.7447 515.1339 15.55316 536.5215 15.52327 -21.38757      21.97436 
1 1 1 -7  12 19 o 327.5090 5.864907 1308.994       46.80805 1367.125       84.78075 1283.504       56.14002 333.9734 10.42994 324.1851 7.106298 9.788391       12.62074 
1 1 1 -7  12 20 o 347.2405 5.322811 1471.444       45.04095 1452.357       63.57731 1490.677       63.81842 344.7068 7.568611 349.2348 7.498812 -4.527924      10.65439 
1 1 1 -7  12 21 o 487.3687 7.196642 2904.027       85.47195 2929.801       121.9426 2879.136       119.8360 488.6761 10.23996 484.4612 10.15061 4.214874       14.41846 
1 1 1 -7  12 22 o 42.71233 4.736148 22.54013       4.846879 25.38343       5.768433 15.71212       8.939087 45.28165 5.329507 35.30470 9.960020 9.976952       11.29627 
1 1 1 -7  12 23 o 322.4260 5.021192 1269.667       39.45236 1246.010       55.47313 1293.879       56.12063 319.0255 7.135445 325.1071 7.083697 -6.081512      10.05452 
1 1 1 -7  12 24 o 126.7138 2.921232 195.8181       9.020404 201.4248       13.25219 190.9778       12.31307 128.3801 4.241804 125.0201 4.046905 3.360023       5.862622 
1 1 1 -7  12 25 o 44.48266 3.684866 24.31356       3.958565 21.88709       6.440978 25.78643       5.018171 41.78317 6.540134 45.72092 4.564915 -3.937748      7.975701 
1 1 1 -7  12 26 o 113.6771 2.867217 157.7259       7.936390 153.5149       11.30501 161.8179       11.14422 112.0417 4.147681 115.0520 3.980834 -3.010284      5.748939 
1 1 1 -7  12 27 o 129.0565 3.560188 203.4795       11.18597 205.5957       13.62991 199.1135       19.57747 129.6453 4.320232 127.2968 6.330935 2.348495       7.664538 
1 1 1 -7  12 28 o 47.57141 3.618224 27.79327       4.163012 23.25445       5.866385 32.39767       5.908617 43.19986 5.712389 51.24573 4.786808 -8.045864      7.452847 
1 1 1 -7  12 29 o 112.5748 3.329480 154.8714       9.123809 158.0746       11.62051 149.7232       14.73223 113.6352 4.203640 110.4039 5.493056 3.231270       6.916954 
1 1 1 -7  12 30 o 120.7432 3.028298 178.0884       8.903369 168.0335       12.55841 188.2493       12.62438 117.1143 4.408232 124.0010 4.183804 -6.886719      6.077559 
1 1 1 -7  12 31 o 63.90514 3.219219 50.00552       4.997139 48.00772       7.142916 51.92062       6.993496 62.43121 4.730221 64.97889 4.443317 -2.547684      6.489843 
1 1 1 -7  12 32 o 14.07313 5.873646 0.4759073      3.354515 2.616161       4.650187 -1.846211      4.843731 18.45580 7.186339 14.87343 6.622771 3.582372       9.772644 
1 1 1 -7  12 33 f 135.2723 3.756666 224.0519       12.37163 225.7423       23.55889 223.4083       14.53744 134.9113 7.191883 134.9499 4.426569 -0.3860474E-01 8.444981 
1 1 1 -7  12 34 o 118.6574 3.084057 172.2211       8.910149 163.3326       12.39223 181.7344       12.82038 115.3154 4.418046 121.6655 4.331023 -6.350105      6.186832 
1 1 1 -7  12 35 o 75.96626 3.549993 70.80852       6.553624 71.73385       10.14404 70.14560       8.586028 76.09290 5.507823 75.41239 4.695409 0.6805115      7.237609 
1 1 1 -7  12 36 o 79.93121 3.242063 78.35574       6.301904 78.93901       8.736316 77.72301       9.099233 79.98930 4.500027 79.31757 4.729068 0.6717377      6.527965 
1 1 1 -7  12 37 o 72.70347 3.269736 64.92611       5.778182 68.28451       8.033875 61.32716       8.316624 74.31207 4.456870 70.30531 4.884633 4.006752       6.612362 
1 1 1 -7  12 38 o 58.43497 3.576415 42.14187       5.068408 41.35009       7.035291 42.99624       7.308115 57.51346 5.071589 58.62726 5.168139 -1.113804      7.240903 
1 1 1 -7  12 39 o 76.64952 4.433674 73.13181       8.246162 73.13181       8.246162 0.000000       0.000000 76.64952 4.433674 ?        ?        0.000000       4.433674 
1 1 1 -7  12 40 o 30.52639 5.252689 12.02708       3.766546 10.50250       5.137055 13.79958       5.539029 27.94842 7.419530 32.08445 7.255111 -4.136028      10.37719 
1 1 1 -7  12 41 o 18.58574 6.484406 4.144412       3.608984 4.435015       4.699244 3.726551       5.634997 19.87072 7.340134 20.00729 7.875165 -0.1365700     10.76549 
1 1 1 -7  12 42 o 36.89862 4.708846 17.57273       4.137751 17.32582       5.586311 17.87283       6.158818 35.68919 6.668352 35.91822 7.285801 -0.2290306     9.876731 
1 1 1 -7  12 43 o 49.49630 3.964444 31.26271       4.741847 28.01613       6.240150 35.69921       7.294611 45.75074 5.721838 51.55434 5.913222 -5.803596      8.228343 
1 1 1 -7  12 44 o 33.56284 7.600186 16.85612       6.071160 0.000000       0.000000 16.85612       6.071160 ?        ?        33.56284 7.600186 0.000000       7.600186 
1 1 1 -7  12 45 f 15.79463 6.314834 2.664966       3.677155 4.095235       4.864139 0.7574290      5.617377 18.21453 7.269389 16.14779 7.164476 2.066736       10.20655 
1 1 1 -7  12 46 o 9.260900 4.515460 -4.939066      3.308389 -7.081949      4.988291 -3.256224      4.420529 11.17214 5.468170 11.98757 5.677613 -0.8154240     7.882650 
1 1 1 -7  12 47 f 15.47069 6.273395 2.913400       3.685017 1.896886       5.308370 3.858889       5.119559 15.83067 6.997110 17.21866 7.226120 -1.387991      10.05865 
1 1 1 -7  12 48 o 19.72132 7.137647 6.972167       4.409494 19.52474       8.330514 2.086302       5.197281 28.16706 9.850087 15.35175 6.846412 12.81530       11.99573 
1 1 1 -7  12 49 f 19.89321 7.284118 7.826994       4.611173 8.346667       5.836613 6.963943       7.521668 19.59552 7.913523 18.20314 8.168389 1.392380       11.37306 
1 1 1 -7  12 50 o 15.20665 6.345672 3.742738       3.914372 6.460699       5.755641 1.403775       5.339293 17.43828 7.501130 14.11099 6.537622 3.327293       9.950249 
1 1 1 -7  13 1  o 347.8181 6.110944 1474.921       51.79604 1386.676       86.04413 1525.070       64.86520 336.8952 10.49349 353.6276 7.527132 -16.73236      12.91399 
1 1 1 -7  13 2  o 636.2963 13.00348 4946.367       201.6299 5014.262       288.0528 4881.143       282.3290 639.5108 18.50312 630.9837 18.38080 8.527100       26.08101 
1 1 1 -7  13 3  o 452.9671 6.703537 2501.775       73.99575 2465.598       103.8150 2539.133       105.4969 449.5206 9.477074 456.1738 9.490154 -6.653229      13.41186 
1 1 1 -7  13 4  o 315.2333 6.923954 1211.717       53.18908 1227.545       76.60984 1196.988       73.90450 317.0032 9.929346 313.0473 9.699495 3.955963       13.88064 
1 1 1 -7  13 5  o 193.1010 4.019213 454.4514       18.91305 446.4840       22.98882 471.1393       33.27029 191.3246 4.934834 196.4405 6.961076 -5.115906      8.532828 
1 1 1 -7  13 6  o 186.2571 3.904958 422.8046       17.72415 426.9174       22.03886 415.2738       29.82216 187.0859 4.838118 184.4280 6.646406 2.657928       8.220833 
1 1 1 -7  13 7  o 147.1575 3.470931 263.9114       12.44700 274.9693       22.16319 258.8169       15.04343 150.0553 6.073559 145.6614 4.242574 4.393890       7.408614 
1 1 1 -7  13 8  o 947.6791 13.56090 10977.15       313.1743 11066.41       445.2337 10889.75       440.5933 950.0224 19.23172 942.4235 19.18473 7.598877       27.16455 
1 1 1 -7  13 9  o 688.4616 8.878406 5783.220       148.9535 5732.202       234.4683 5817.742       192.8750 684.7023 14.05226 690.1929 11.46752 -5.490662      18.13753 
1 1 1 -7  13 10 o 204.5565 3.202341 509.9344       15.96309 494.8151       25.22518 520.0336       20.61626 201.4057 5.143775 206.5598 4.095698 -5.154144      6.575193 
1 1 1 -7  13 11 o 250.4013 4.737290 764.3065       28.90698 791.2629       51.78120 752.1021       34.84149 254.5256 8.359766 248.3685 5.756576 6.157120       10.15007 
1 1 1 -7  13 12 f 152.3420 3.688020 282.8571       13.69143 285.6871       17.05419 277.7259       22.96365 153.0222 4.578564 150.7843 6.263184 2.237854       7.758267 
1 1 1 -7  13 13 o 151.8030 4.436022 281.1436       16.39246 304.3126       23.92089 260.6300       22.50842 157.8452 6.231090 146.0517 6.339249 11.79347       8.888901 
1 1 1 -7  13 14 o 229.1500 4.459329 640.1152       24.90149 639.7717       30.98504 640.7418       41.84517 229.0577 5.550999 229.0369 7.507423 0.2076721E-01  9.336755 
1 1 1 -7  13 15 o 296.8049 4.679240 1074.018       33.84406 1124.571       49.55964 1029.841       46.32898 303.6132 6.698403 290.5526 6.543226 13.06067       9.363889 
1 1 1 -7  13 16 o 91.36491 2.862469 101.8367       6.365318 100.4502       9.560360 102.9407       8.531141 90.66630 4.339653 91.81510 3.821266 -1.148804      5.782271 
1 1 1 -7  13 17 o 546.7494 11.33110 3660.036       150.9720 3639.261       214.1708 3680.555       212.8487 543.5981 16.18565 546.7451 15.99252 -3.146973      22.75381 
1 1 1 -7  13 18 f 217.6328 4.355023 577.5997       23.09675 543.6254       40.05289 594.5256       28.27066 210.7919 7.810803 220.7554 5.255189 -9.963547      9.414120 
1 1 1 -7  13 19 o 147.2675 3.070014 264.3864       11.01750 251.0026       15.65826 277.5096       15.50507 143.3805 4.486960 150.7852 4.223837 -7.404678      6.162274 
1 1 1 -7  13 20 o 291.2812 4.625082 1035.197       32.82978 1040.670       46.95795 1029.963       45.91621 291.8441 6.602709 290.3525 6.489396 1.491516       9.257863 
1 1 1 -7  13 21 o 501.4162 8.581707 3080.553       104.8596 3003.220       126.2233 3252.796       188.3761 494.4077 10.47654 512.0443 15.11324 -17.63657      18.38935 
1 1 1 -7  13 22 o 198.7375 3.558717 481.7917       17.23493 497.5966       25.13867 467.7740       23.67487 201.7844 5.116454 195.6569 4.969446 6.127472       7.132565 
1 1 1 -7  13 23 o 314.2541 4.928124 1206.300       37.73972 1196.999       53.44491 1215.552       53.29942 312.6391 7.014988 315.0692 6.941934 -2.430054      9.869169 
1 1 1 -7  13 24 o 201.6228 4.082020 496.2776       20.05631 472.5919       33.45952 509.5607       25.05677 196.2614 7.007228 204.2005 5.035381 -7.939102      8.628806 
1 1 1 -7  13 25 o 324.6325 5.064632 1288.287       40.06600 1309.183       57.56782 1268.656       55.79741 326.7006 7.230924 321.6370 7.118885 5.063568       10.14716 
1 1 1 -7  13 26 o 83.15068 2.893285 84.44601       5.853705 80.27399       8.461531 88.27541       8.106646 80.94753 4.305007 84.93359 3.927379 -3.986061      5.827297 
1 1 1 -7  13 27 o 58.77654 4.005155 42.39586       5.702391 43.24353       6.759207 40.30286       10.62102 59.28306 4.717625 56.70220 7.900803 2.580856       9.202102 
1 1 1 -7  13 28 o 128.6100 2.996301 201.8604       9.390667 193.7423       13.41783 209.6542       13.14712 125.8072 4.383338 130.9111 4.126300 -5.103905      6.019967 
1 1 1 -7  13 29 o 74.44308 3.488200 67.83405       6.310336 63.87065       8.185493 73.64026       9.907339 72.09449 4.684515 77.34976 5.287884 -5.255272      7.064446 
1 1 1 -7  13 30 o 180.2823 3.449314 397.0580       15.15382 395.5559       21.65969 398.4983       21.20889 179.6238 4.952985 180.3180 4.830968 -0.6942291     6.918837 
1 1 1 -7  13 31 o 192.8906 3.600503 454.7809       16.92429 460.6757       24.40079 449.3160       23.49408 193.7438 5.172835 191.3728 5.042206 2.370987       7.223716 
1 1 1 -7  13 32 o 137.2207 3.723119 230.4671       12.43830 213.0580       23.13644 237.5441       14.75138 131.0951 7.270739 139.1984 4.354084 -8.103333      8.474768 
1 1 1 -7  13 33 o 207.8246 3.771759 528.5931       19.10192 521.3364       27.20682 535.6478       26.82561 205.8374 5.428709 208.7008 5.278836 -2.863373      7.572119 
1 1 1 -7  13 34 o 88.93268 3.132848 96.82325       6.778879 103.8128       9.725102 90.21767       9.454203 91.89280 4.355262 85.61494 4.547786 6.277855       6.296878 
1 1 1 -7  13 35 o 46.73029 4.358086 27.04595       4.905618 23.99147       7.258853 29.61378       6.655527 43.38748 7.111589 48.64590 5.723770 -5.258423      9.128869 
1 1 1 -7  13 36 o 156.5449 3.344950 300.2868       12.76041 313.7356       18.60284 288.3359       17.53625 159.4709 4.792420 152.9051 4.711913 6.565750       6.720819 
1 1 1 -7  13 37 o 52.36706 3.818343 33.89273       4.839211 37.69805       6.838308 30.07544       6.849061 54.93459 5.168930 48.82920 5.873733 6.105389       7.824230 
1 1 1 -7  13 38 o 41.85921 4.190463 21.85544       4.217130 15.43337       5.635383 30.02895       6.357553 34.36406 6.968225 48.79024 5.439540 -14.42619      8.839952 
1 1 1 -7  13 39 f 32.32155 6.125592 13.60942       4.648223 13.59622       5.370011 13.64886       9.282433 32.02023 7.071146 31.82076 10.40149 0.1994781      12.57745 
1 1 1 -7  13 40 o 91.47719 3.121670 103.3982       6.948629 96.16637       9.556693 111.5098       10.12128 87.56474 4.493629 94.35382 4.414134 -6.789085      6.298990 
1 1 1 -7  13 41 o 34.40277 5.016492 15.31425       4.081893 15.53037       5.525932 15.05470       6.055712 33.82024 6.937812 32.94359 7.684731 0.8766441      10.35318 
1 1 1 -7  13 42 o 22.32036 6.566721 6.823505       3.809914 5.665377       4.973142 8.468924       5.927761 21.11686 7.588297 24.64824 8.319980 -3.531378      11.26074 
1 1 1 -7  13 43 o 10.94383 5.139991 -3.021584      3.487274 -2.011503      4.557869 -4.447748      5.415873 13.48082 6.170570 13.45373 6.345592 0.2709389E-01  8.851128 
1 1 1 -7  13 44 o 26.87882 6.990483 10.76822       4.621272 10.91349       7.127631 10.66285       6.069969 25.78011 9.103524 25.85035 8.408612 -0.7024193E-01 12.39270 
1 1 1 -7  13 45 o 12.93198 5.724061 -0.1808407E-01 3.564784 5.155144       5.201037 -4.601456      4.895553 19.26959 7.571596 12.15825 5.818677 7.111338       9.549140 
1 1 1 -7  13 46 o 11.25943 5.237433 -1.836136      3.479692 0.4430772      4.890021 -4.174086      4.952631 14.72810 6.599371 12.23025 5.852962 2.497856       8.820933 
1 1 1 -7  13 47 o 15.86888 6.701015 2.936996       4.446007 0.7096325      5.602761 6.724714       7.306264 15.13778 6.895460 19.65907 8.453830 -4.521289      10.90938 
1 1 1 -7  13 48 o 28.67162 5.962150 13.12461       4.029762 15.52515       6.185265 11.35418       5.311825 27.36028 8.438796 23.87482 7.871873 3.485458       11.54035 
1 1 1 -7  13 49 o 22.83813 7.875381 11.21192       5.316237 9.137016       8.075595 12.79886       7.062443 19.08220 8.520511 22.17548 8.788882 -3.093277      12.24106 
1 1 1 -7  14 1  o 230.1615 3.453550 645.5953       19.37022 601.1476       29.30860 680.0670       25.81081 222.0639 5.416028 236.2097 4.484023 -14.14577      7.031345 
1 1 1 -7  14 2  o 469.1801 6.195543 2683.923       70.83616 2579.664       109.0324 2760.069       93.17997 459.7559 9.731779 475.6825 8.038394 -15.92661      12.62233 
1 1 1 -7  14 3  f 435.8690 5.795952 2316.154       61.56259 2264.715       78.42236 2398.755       99.37798 430.9202 7.468046 443.3800 9.197673 -12.45984      11.84774 
1 1 1 -7  14 4  o 333.4373 7.321490 1355.920       59.49079 1357.065       84.55872 1354.798       83.71302 333.2585 10.42499 332.9884 10.32888 0.2701111      14.67536 
1 1 1 -7  14 5  o 291.3248 4.128837 1034.402       29.31171 1000.286       45.60242 1058.421       38.26284 286.4165 6.533618 294.6585 5.328710 -8.241974      8.431092 
1 1 1 -7  14 6  f 356.2560 4.867655 1547.079       42.25889 1498.352       65.65932 1581.536       55.21477 350.4912 7.687464 360.1510 6.291216 -9.659729      9.933604 
1 1 1 -7  14 7  o 354.1999 4.840060 1529.279       41.77681 1457.059       64.34623 1581.905       54.92793 345.6260 7.639775 360.1915 6.257829 -14.56546      9.875555 
1 1 1 -7  14 8  o 405.6280 5.442562 2005.862       53.79815 1909.466       82.66833 2076.675       70.85472 395.6000 8.575251 412.6491 7.046148 -17.04913      11.09879 
1 1 1 -7  14 9  o 551.1307 8.048422 3705.611       108.0940 3592.374       149.9697 3828.044       155.9410 542.3090 11.34804 559.8047 11.43109 -17.49567      16.10738 
1 1 1 -7  14 10 o 1036.186 13.24876 13129.03       334.5410 13518.30       539.5059 12885.85       426.4209 1048.562 21.11379 1025.341 17.06609 23.22083       27.14854 
1 1 1 -7  14 11 o 371.5335 5.042307 1682.837       45.65238 1643.590       71.42900 1709.940       59.35825 367.0226 7.986300 374.4448 6.505148 -7.422150      10.30038 
1 1 1 -7  14 12 o 584.8087 9.829564 4176.532       140.0826 4286.890       246.8481 4124.110       170.1304 590.8759 17.16161 580.8022 12.02036 10.07367       20.95256 
1 1 1 -7  14 13 o 290.5836 4.613386 1029.403       32.66834 1017.349       46.26027 1041.395       46.13998 288.7961 6.573259 292.1937 6.479933 -3.397583      9.230237 
1 1 1 -7  14 14 o 161.9336 3.231440 319.6029       12.75173 309.3490       18.24599 329.3930       17.82859 159.2184 4.707770 164.3125 4.456682 -5.094040      6.482677 
1 1 1 -7  14 15 o 167.9071 3.279908 343.6361       13.42045 349.7543       19.62134 338.2579       18.39656 169.2952 4.760793 166.4993 4.538302 2.795975       6.577335 
1 1 1 -7  14 16 o 239.5486 4.638987 699.7682       27.08026 672.5656       47.17945 713.1337       33.07043 234.4898 8.269386 241.7788 5.612875 -7.289063      9.994354 
1 1 1 -7  14 17 f 314.4005 6.943606 1207.054       53.19911 1263.387       78.99204 1160.294       71.96745 321.1028 10.10752 307.7941 9.606646 13.30862       13.94452 
1 1 1 -7  14 18 o 364.0263 5.553329 1617.289       49.26315 1620.189       70.09069 1614.458       69.25408 364.0456 7.900753 363.4135 7.820028 0.6321411      11.11642 
1 1 1 -7  14 19 f 151.1044 3.113149 278.3718       11.46339 270.4247       16.36587 286.0263       16.06178 148.8134 4.518188 153.0645 4.310380 -4.251160      6.244470 
1 1 1 -7  14 20 f 186.4519 3.443499 423.9576       15.64598 411.3452       22.18601 436.4363       22.06799 183.5035 4.965902 189.0374 4.794347 -5.533920      6.902605 
1 1 1 -7  14 21 o 331.9528 5.153133 1345.751       41.68539 1347.002       59.39882 1344.536       58.51519 331.7109 7.348216 331.4288 7.245064 0.2821045      10.31927 
1 1 1 -7  14 22 o 240.5575 4.024956 706.2357       23.59479 697.2523       33.56050 715.0160       33.17891 238.8186 5.766660 241.8605 5.629386 -3.041946      8.058805 
1 1 1 -7  14 23 o 182.9373 3.428768 408.3050       15.28539 407.1507       22.06218 409.3706       21.19735 182.4793 4.965954 183.0028 4.757254 -0.5234375     6.876930 
1 1 1 -7  14 24 o 254.1562 4.785625 789.2910       29.63981 835.9405       52.67207 767.6738       35.85555 260.6912 8.301793 250.4723 5.874361 10.21890       10.16995 
1 1 1 -7  14 25 o 145.6995 3.098564 258.9952       11.00157 274.7465       16.28141 245.7606       14.92418 149.8933 4.462285 141.7746 4.324779 8.118729       6.214153 
1 1 1 -7  14 26 o 156.7087 3.810233 299.8914       14.55060 313.0179       17.97573 274.9457       24.78057 159.9521 4.616523 149.5301 6.818531 10.42198       8.234358 
1 1 1 -7  14 27 o 273.0053 5.205089 912.3201       34.62863 890.4286       41.76103 960.5011       61.95428 269.4049 6.361062 278.6502 9.136151 -9.245361      11.13249 
1 1 1 -7  14 28 o 111.1168 4.209592 151.1609       11.37810 151.0544       18.41978 151.2267       14.46850 110.6422 6.865502 110.9763 5.365946 -0.3340302     8.713696 
1 1 1 -7  14 29 o 192.6183 3.575568 453.2782       16.78335 467.0376       24.41879 440.9583       23.10607 195.1756 5.138550 189.6748 5.003335 5.500732       7.172033 
1 1 1 -7  14 30 o 97.72160 3.005311 116.7100       7.148248 111.2957       10.23616 121.8638       9.986754 95.25520 4.421797 99.72697 4.118235 -4.471771      6.042528 
1 1 1 -7  14 31 o 28.11225 5.649726 10.04990       3.736017 12.24473       5.438629 8.088730       5.140979 30.87914 7.336606 25.45385 7.662580 5.425295       10.60853 
1 1 1 -7  14 32 o 293.9276 5.549685 1062.109       39.75070 1042.495       70.38496 1071.295       48.16782 288.1429 10.03922 294.5912 6.709670 -6.448364      12.07500 
1 1 1 -7  14 33 o 48.86187 3.833593 29.41059       4.528173 25.39324       6.324927 33.63477       6.485707 45.01790 5.907904 52.05594 5.181437 -7.038044      7.858156 
1 1 1 -7  14 34 o 88.65083 3.377930 96.30998       7.284073 91.30761       11.79287 99.39569       9.262092 85.86422 5.667701 89.91506 4.239016 -4.050842      7.077576 
1 1 1 -7  14 35 o 29.88512 5.760816 11.40665       4.043320 10.87584       5.492927 12.03441       5.973487 28.97205 7.663392 30.43352 7.963859 -1.461466      11.05218 
1 1 1 -7  14 36 o 43.91111 4.302518 23.95486       4.544950 20.02675       6.285496 28.25925       6.579650 39.52818 6.768525 47.38082 5.820712 -7.852646      8.927128 
1 1 1 -7  14 37 o 134.3648 3.193100 221.5407       10.45525 209.4895       14.70077 233.8754       14.87263 130.0688 4.645461 137.5324 4.443419 -7.463577      6.428396 
1 1 1 -7  14 38 o 69.04020 3.767895 58.98635       6.315208 52.29085       7.798147 71.74500       10.76471 64.61146 4.991417 75.35192 5.909601 -10.74046      7.735478 
1 1 1 -7  14 39 o 114.2032 3.708467 161.5646       10.30700 162.4498       12.45984 159.6458       18.34376 114.0815 4.490661 111.4040 6.789196 2.677452       8.139976 
1 1 1 -7  14 40 o 46.70323 3.959400 27.37515       4.463793 37.00437       6.578049 19.15651       6.077173 53.87986 5.069535 37.88857 6.833342 15.99129       8.508511 
1 1 1 -7  14 41 o 23.09049 6.435643 7.234900       3.756112 5.220566       5.054585 9.718979       5.613094 20.84192 7.627136 26.35423 8.022264 -5.512316      11.06932 
1 1 1 -7  14 42 o 12.93701 5.709279 -0.5006317     3.521120 1.399423       4.675982 -2.989131      5.351289 16.35865 6.888031 14.24708 6.581041 2.111579       9.526546 
1 1 1 -7  14 43 o 42.20161 6.904707 25.33058       6.855520 0.000000       0.000000 25.33058       6.855520 ?        ?        42.20161 6.904707 0.000000       6.904707 
1 1 1 -7  14 44 o 13.42964 5.859639 0.3070873      3.614911 -1.757973      4.820425 2.960796       5.464439 13.69723 6.297765 17.78009 7.463884 -4.082868      9.765829 
1 1 1 -7  14 45 o 25.83873 6.556110 10.19578       4.134125 14.68623       5.856994 5.737258       5.836133 29.77836 7.930232 19.86556 7.951095 9.912800       11.22980 
1 1 1 -7  14 46 o 11.60820 5.395593 -1.719752      3.682186 1.034636       5.382341 -4.143028      5.048474 15.47390 6.929329 12.29135 5.889449 3.182558       9.094020 
1 1 1 -7  14 47 o 18.20650 7.074697 5.471606       4.499568 4.683251       5.643789 6.846825       7.454107 17.66311 7.508179 19.42829 8.446487 -1.765184      11.30115 
1 1 1 -7  14 48 o 15.43665 6.363409 3.453935       3.869529 12.66057       6.066729 -2.860363      5.024196 23.96087 8.403890 12.21008 5.857053 11.75079       10.24356 
1 1 1 -7  14 49 o 10.57072 5.157830 -4.313993      4.338840 -1.684480      5.560246 -8.408180      6.938094 12.92379 6.189355 11.94722 5.954016 0.9765625      8.588272 
1 1 1 -7  15 1  o 567.6791 8.272351 3931.621       114.4374 4057.997       233.1005 3891.490       131.3567 575.3657 16.64255 564.6538 9.546272 10.71185       19.18608 
1 1 1 -7  15 2  o 462.4869 6.122073 2608.013       68.99760 2597.637       108.7629 2615.002       89.25757 461.3237 9.674733 462.9974 7.910982 -1.673737      12.49736 
1 1 1 -7  15 3  o 481.8164 7.114743 2831.269       83.53661 2723.631       162.3722 2870.014       97.41824 471.7004 14.14165 485.0234 8.242169 -13.32303      16.36825 
1 1 1 -7  15 4  o 211.6348 3.321780 545.8467       17.13145 520.6406       21.53681 589.2736       28.26881 206.6765 4.276161 219.8576 5.276306 -13.18106      6.791536 
1 1 1 -7  15 5  o 580.6802 7.566615 4112.971       107.0717 4062.873       168.1416 4147.143       138.8678 576.6597 11.96519 582.8740 9.776669 -6.214355      15.45150 
1 1 1 -7  15 6  o 210.8603 3.309331 541.8619       17.00478 519.4724       26.62166 557.2932       22.10112 206.3555 5.298371 213.8269 4.241464 -7.471390      6.786954 
1 1 1 -7  15 7  o 297.5516 5.436861 1079.417       39.42272 1102.998       69.94394 1068.438       47.72580 300.4456 9.565374 295.9921 6.616632 4.453461       11.63083 
1 1 1 -7  15 8  o 352.3606 4.833920 1513.537       41.50714 1518.682       66.04195 1510.178       53.36396 352.8274 7.681065 351.9128 6.222672 0.9145813      9.885364 
1 1 1 -7  15 9  o 698.0674 9.017312 5948.090       153.3948 6203.224       249.7047 5793.456       194.3997 711.8976 14.39373 688.5334 11.58603 23.36414       18.47743 
1 1 1 -7  15 10 o 118.6712 2.639941 171.6199       7.634415 165.9271       12.46419 175.0380       9.658136 116.5869 4.394977 119.7959 3.311558 -3.208946      5.502929 
1 1 1 -7  15 11 o 170.3600 3.775227 353.7502       15.67280 368.4601       28.34415 347.2719       18.81000 173.6698 6.709977 168.7166 4.579274 4.953186       8.123641 
1 1 1 -7  15 12 o 375.4704 5.096609 1718.971       46.63298 1759.877       75.18201 1693.392       59.45125 379.7022 8.125213 372.5797 6.547956 7.122528       10.43527 
1 1 1 -7  15 13 o 396.7867 5.987928 1920.431       57.89883 1857.386       80.48579 1988.047       83.35204 390.0047 8.468632 403.4884 8.477135 -13.48367      11.98247 
1 1 1 -7  15 14 o 426.3668 7.371769 2219.221       76.59338 2143.048       130.6964 2259.067       94.52682 417.9822 12.84653 429.9739 9.021461 -11.99167      15.69777 
1 1 1 -7  15 15 o 269.2995 5.046960 884.5557       33.12085 919.1289       59.93834 869.3585       39.73906 274.0595 8.986931 266.9120 6.109607 7.147491       10.86702 
1 1 1 -7  15 16 o 85.70906 3.442255 89.70169       7.174993 97.61143       10.08956 81.60931       10.20538 89.33890 4.650430 81.62698 5.156854 7.711922       6.944037 
1 1 1 -7  15 17 o 412.0326 7.142530 2074.334       71.71661 2073.133       88.35258 2076.653       122.7895 411.6153 8.808290 410.9697 12.27446 0.6456604      15.10789 
1 1 1 -7  15 18 o 261.7750 4.997763 836.2790       31.88159 819.0507       38.52106 873.7419       56.80375 258.9637 6.104123 266.9979 8.742164 -8.034241      10.66235 
1 1 1 -7  15 19 o 316.4495 4.961981 1222.387       38.26446 1234.066       54.84782 1211.313       53.40911 317.6563 7.085422 314.7343 6.963620 2.921967       9.934546 
1 1 1 -7  15 20 o 352.9128 5.429898 1521.411       46.69766 1533.169       66.74407 1510.136       65.35865 353.8098 7.741172 351.1661 7.637555 2.643707       10.87465 
1 1 1 -7  15 21 o 306.1037 4.830736 1144.309       36.03445 1152.543       51.60151 1136.471       50.34262 306.8360 6.901126 304.7140 6.779650 2.122040       9.674151 
1 1 1 -7  15 22 o 188.1268 3.464495 431.7992       15.88278 457.6404       23.61953 410.4695       21.45889 193.4699 5.014042 183.2466 4.809622 10.22334       6.947883 
1 1 1 -7  15 23 o 65.80573 3.257092 52.96000       5.206885 53.81694       9.069013 52.53862       6.359501 66.08911 5.686343 65.48027 4.004593 0.6088409      6.954945 
1 1 1 -7  15 24 o 70.89254 2.956538 61.41339       5.096427 63.19228       7.618319 59.97245       6.856585 71.79253 4.375330 69.96579 4.038644 1.826744       5.954340 
1 1 1 -7  15 25 o 270.9459 4.421664 897.0870       29.19472 891.7780       41.59020 902.2443       40.99145 269.7327 6.327342 271.3432 6.199236 -1.610504      8.858091 
1 1 1 -7  15 26 o 70.51507 3.791361 60.90338       6.491026 57.61026       7.589742 69.87193       12.52519 68.49281 4.573424 75.12034 6.919834 -6.627525      8.294595 
1 1 1 -7  15 27 o 146.2890 4.460889 261.9445       15.88406 289.6837       26.27818 245.9744       19.93890 153.3363 7.051448 141.5320 5.793347 11.80434       9.126105 
1 1 1 -7  15 28 o 165.9154 3.329519 336.1645       13.46183 327.4592       19.15534 344.6595       18.92261 163.4841 4.813394 167.7601 4.633108 -4.275955      6.680902 
1 1 1 -7  15 29 o 86.14836 3.002442 90.71897       6.293517 101.8296       9.496413 82.01733       8.404106 91.13172 4.288187 81.77290 4.231809 9.358826       6.024678 
1 1 1 -7  15 30 o 80.95672 3.098053 80.16147       6.100643 83.19494       9.061324 77.64644       8.250755 82.30064 4.535600 79.53708 4.272527 2.763565       6.231063 
1 1 1 -7  15 31 o 48.65177 3.824262 29.13301       4.497586 36.70310       6.821370 23.31120       5.982049 54.43916 5.205219 43.15830 5.837389 11.28086       7.821087 
1 1 1 -7  15 32 o 26.51881 7.196003 8.994737       4.767834 18.68796       10.47335 6.460798       5.354881 37.96306 10.80508 23.51381 7.907645 14.44925       13.38957 
1 1 1 -7  15 33 o 107.5585 3.101775 141.5585       8.121518 146.8729       11.97862 137.0370       11.04877 109.3063 4.506692 105.6184 4.301780 3.687904       6.230216 
1 1 1 -7  15 34 f 65.35248 3.402739 52.43112       5.400429 51.89396       7.779919 52.93063       7.502361 64.74261 4.969140 65.43650 4.736872 -0.6938934     6.865152 
1 1 1 -7  15 35 o 35.94217 4.960801 16.22334       4.229280 13.79711       5.902133 18.78391       6.063334 32.55833 7.581016 38.30209 6.742230 -5.743763      10.14542 
1 1 1 -7  15 36 f 83.14917 3.199486 84.89769       6.470876 90.30534       9.408606 80.04385       8.913829 85.43183 4.535534 80.40885 4.567877 5.022980       6.437124 
1 1 1 -7  15 37 o 56.34013 3.592998 39.22083       4.907292 36.07183       6.882262 42.47768       6.999132 53.56652 5.343537 58.28177 4.975593 -4.715256      7.301364 
1 1 1 -7  15 38 o 74.55883 3.272385 68.58920       5.931172 71.44921       8.437486 65.79538       8.339264 75.64646 4.598805 72.52442 4.744589 3.122040       6.607582 
1 1 1 -7  15 39 o 49.80390 4.606601 31.28704       5.527539 29.78734       6.463573 35.36947       10.66422 48.19577 5.607978 50.79577 8.941618 -2.599998      10.55471 
1 1 1 -7  15 40 o 24.75449 6.305345 8.247268       3.813566 6.869524       5.219593 9.824871       5.585361 23.00859 7.806959 26.69424 7.975644 -3.685644      11.16062 
1 1 1 -7  15 41 o 26.39711 6.266120 9.521093       3.970124 3.971651       5.267491 16.81961       6.040829 19.57104 7.640481 34.69481 7.372472 -15.12377      10.61745 
1 1 1 -7  15 42 o 54.19241 3.710639 37.29095       4.870738 38.63700       6.904462 35.95745       6.872177 54.05441 5.310046 51.97955 5.509094 2.074860       7.651581 
1 1 1 -7  15 43 o 23.61644 8.059473 8.461424       5.563789 0.000000       0.000000 8.461424       5.563789 ?        ?        23.61644 8.059473 0.000000       8.059473 
1 1 1 -7  15 44 o 16.37358 6.446914 3.118964       3.777448 -3.407588      5.121181 10.90730       5.594362 13.10089 6.176531 25.79297 8.037271 -12.69209      10.13643 
1 1 1 -7  15 45 o 15.07775 6.214008 2.247599       3.688823 5.593199       5.713570 -0.1437368     4.830485 19.50611 7.846492 14.36396 6.486933 5.142155       10.18075 
1 1 1 -7  15 46 o 17.96857 7.028027 4.914415       4.463704 0.7768646      5.722321 11.34478       7.133759 15.42310 7.003193 23.57314 8.972610 -8.150041      11.38211 
1 1 1 -7  15 47 o 17.08687 6.606160 4.659204       3.908355 4.815475       5.904237 4.537319       5.214330 17.58556 7.581223 17.20646 7.260940 0.3790989      10.49744 
1 1 1 -7  15 48 o 11.04767 5.199481 -1.587567      3.600938 -1.644279      5.549139 -1.546314      4.732733 13.15878 6.269150 12.43319 5.884528 0.7255926      8.598250 
1 1 1 -7  15 49 o 21.79244 7.564643 10.17710       4.908352 3.915470       5.944052 23.59854       8.702388 15.85303 7.174141 27.84994 10.03419 -11.99690      12.33504 
1 1 1 -7  16 1  o 176.4306 2.980360 379.3471       12.81382 372.3058       19.83608 384.3897       16.78631 174.6992 4.663558 177.5876 3.878881 -2.888382      6.065846 
1 1 1 -7  16 2  o 182.8334 3.042522 407.3828       13.55581 414.0780       21.33151 402.8475       17.55672 184.2422 4.755100 181.8003 3.962895 2.441879       6.189953 
1 1 1 -7  16 3  o 481.3735 7.112685 2826.437       83.43568 2750.320       115.6203 2909.148       120.5242 474.5978 9.997058 488.0950 10.13290 -13.49719      14.23435 
1 1 1 -7  16 4  o 336.7574 4.655551 1382.430       38.20537 1392.049       49.63987 1368.453       59.83941 337.8735 6.028931 334.9349 7.331465 2.938599       9.492017 
1 1 1 -7  16 5  o 264.4636 3.524772 852.4252       22.71607 866.8889       32.45089 838.5278       31.80945 266.6613 4.993792 262.2635 4.977168 4.397858       7.050543 
1 1 1 -7  16 6  o 304.7113 4.307937 1131.787       31.98850 1121.455       50.66151 1138.637       41.25185 303.2203 6.856205 305.5903 5.539465 -2.369995      8.814376 
1 1 1 -7  16 7  o 422.3025 5.659715 2174.590       58.24442 2141.521       91.58376 2197.049       75.47404 418.8429 8.972866 424.3728 7.298170 -5.529846      11.56614 
1 1 1 -7  16 8  o 148.6362 3.169541 269.2537       11.48040 284.6562       24.60757 264.9685       12.97953 152.6217 6.632151 147.4433 3.612417 5.178391       7.552151 
1 1 1 -7  16 9  o 580.6146 7.574547 4113.638       107.1718 4247.460       173.3207 4030.797       136.3670 589.3116 12.06894 574.4604 9.741215 14.85126       15.50970 
1 1 1 -7  16 10 o 156.2080 3.185630 297.3961       12.12648 324.9131       26.18123 289.8805       13.68264 163.0658 6.602219 154.2149 3.640891 8.850937       7.539587 
1 1 1 -7  16 11 o 244.2291 4.087871 727.1455       24.32936 770.1467       35.97707 690.9097       33.02588 251.2789 5.875349 238.0092 5.694091 13.26967       8.181833 
1 1 1 -7  16 12 o 89.17868 3.419727 97.08175       7.417935 108.0972       14.33710 93.05502       8.668372 93.91644 6.300920 87.27083 4.087338 6.645607       7.510520 
1 1 1 -7  16 13 o 107.3801 3.382358 140.6935       8.839704 136.1818       16.11348 142.6358       10.57265 105.4528 6.299107 108.0880 4.020946 -2.635201      7.473068 
1 1 1 -7  16 14 o 211.8925 4.305178 547.5054       22.23017 538.1990       39.33723 551.8719       26.94532 209.7564 7.708889 212.6964 5.198609 -2.939911      9.297983 
1 1 1 -7  16 15 o 306.2836 5.577972 1144.790       41.63285 1164.531       52.12475 1110.006       69.19105 308.7836 6.927135 301.0143 9.444180 7.769257       11.71229 
1 1 1 -7  16 16 o 122.5299 2.997212 183.0259       8.949435 206.3547       13.75980 165.9217       11.78196 129.9954 4.349708 116.5629 4.154477 13.43253       6.014951 
1 1 1 -7  16 17 o 168.8857 4.796229 348.3319       19.71918 348.3319       19.71918 0.000000       0.000000 168.8857 4.796229 ?        ?        0.000000       4.796229 
1 1 1 -7  16 18 o 296.7210 5.430132 1075.160       39.26402 1069.856       48.53931 1085.200       66.78348 295.8108 6.733541 297.3373 9.228043 -1.526520      11.42354 
1 1 1 -7  16 19 o 146.5928 3.122746 262.0597       11.15541 271.9661       16.45818 253.6407       15.17240 149.1995 4.531920 144.0982 4.325653 5.101318       6.264948 
1 1 1 -7  16 20 o 106.5213 2.924706 138.4751       7.584791 140.7994       11.26697 136.5489       10.25705 107.3123 4.317266 105.7044 3.989082 1.607903       5.878057 
1 1 1 -7  16 21 o 254.6115 4.217897 791.4182       26.17038 779.5723       37.15564 803.0809       36.86705 252.4414 6.039875 256.2421 5.904076 -3.800644      8.446194 
1 1 1 -7  16 22 o 138.3115 3.423429 233.4155       11.53867 273.9995       21.33370 216.6340       13.71840 149.5385 5.865706 133.1308 4.233910 16.40773       7.234121 
1 1 1 -7  16 23 o 211.7002 3.742271 547.0699       19.30602 525.5670       27.23225 568.7972       27.37396 207.2242 5.397303 215.6787 5.208281 -8.454468      7.500472 
1 1 1 -7  16 24 o 170.4931 3.329650 354.7475       13.83380 365.9174       20.37415 345.1931       18.84329 172.9346 4.839368 167.9953 4.607166 4.939346       6.681726 
1 1 1 -7  16 25 o 97.17583 3.557262 115.4471       8.409626 109.6975       10.11428 128.3246       15.13657 94.63623 4.397749 102.1393 6.109247 -7.503090      7.527489 
1 1 1 -7  16 26 o 146.6852 3.721174 262.9820       13.29081 268.1375       25.57513 261.0745       15.55641 147.5103 7.135914 146.0653 4.375382 1.445007       8.370498 
1 1 1 -7  16 27 o 143.9325 3.575208 253.0513       12.53996 253.8708       16.09698 251.7860       20.00022 143.9763 4.593814 143.1774 5.743896 0.7989044      7.354962 
1 1 1 -7  16 28 o 66.31123 3.133446 53.80985       5.049113 50.41378       7.627390 56.45882       6.736378 63.96931 4.930952 67.82627 4.094678 -3.856964      6.409421 
1 1 1 -7  16 29 o 130.7851 3.107373 208.8888       9.903479 206.2523       14.38140 211.2668       13.65786 129.7081 4.556941 131.3253 4.273431 -1.617233      6.247233 
1 1 1 -7  16 30 o 62.42395 3.293533 47.74691       4.992406 45.51627       7.207536 49.80418       6.921788 60.73209 4.911920 63.60836 4.494416 -2.876278      6.657833 
1 1 1 -7  16 31 o 119.6760 3.614700 175.3447       10.52973 182.7243       21.13669 172.9087       12.14394 121.3325 7.180755 118.7414 4.203459 2.591110       8.320595 
1 1 1 -7  16 32 o 168.3536 3.420357 346.7085       14.03233 342.2675       20.19637 350.8531       19.51081 166.8342 4.973216 168.9852 4.742641 -2.151047      6.872083 
1 1 1 -7  16 33 o 65.74010 3.629181 53.08306       5.791442 55.66610       9.848147 51.71752       7.160475 66.84706 6.113151 64.73425 4.568462 2.112816       7.631609 
1 1 1 -7  16 34 o 13.78804 5.940898 -0.2837723     3.621911 1.173143       5.113053 -1.751108      5.131306 17.62762 7.295311 15.36813 6.831379 2.259490       9.994464 
1 1 1 -7  16 35 f 16.62654 6.423552 2.293001       3.693313 -5.518786      5.314041 9.592202       5.136738 13.44064 6.322787 27.20345 7.504898 -13.76282      9.813314 
1 1 1 -7  16 36 o 10.82748 5.103704 -3.781872      3.493525 -2.805907      4.988166 -4.721471      4.894351 14.34393 6.523115 13.06561 6.121445 1.278329       8.945564 
1 1 1 -7  16 37 o 36.65168 5.399943 17.12201       4.678658 14.22220       6.039528 21.47387       7.398699 32.69596 7.706853 40.30024 7.815868 -7.604275      10.97649 
1 1 1 -7  16 38 o 31.61601 6.578352 13.19152       4.903072 10.43889       5.749376 20.53172       9.388605 27.88287 8.027983 38.25727 9.970866 -10.37440      12.80104 
1 1 1 -7  16 39 o 28.42373 5.802543 10.65658       3.883032 11.54885       5.412484 9.710267       5.573947 29.06093 7.568899 26.70464 7.964801 2.356283       10.98755 
1 1 1 -7  16 40 o 16.37721 6.385934 2.468418       3.676120 -1.231620      5.037072 6.685048       5.377220 15.06102 6.726831 22.71537 7.915756 -7.654346      10.38795 
1 1 1 -7  16 41 o 15.35802 6.186811 1.864827       3.557679 3.452523       4.931810 0.1421995      5.137104 18.60499 7.353715 15.98332 6.979333 2.621667       10.13845 
1 1 1 -7  16 42 o 20.58599 7.038331 5.844330       4.243619 10.74811       6.519804 2.239822       5.589746 26.41770 8.721623 17.82842 7.520291 8.589279       11.51614 
1 1 1 -7  16 43 o 68.01206 4.173594 60.38187       6.883919 44.37347       12.39116 67.52830       8.279090 50.34256 10.44315 71.18277 4.800863 -20.84021      11.49381 
1 1 1 -7  16 44 o 44.52432 4.334176 26.50576       4.643171 23.06726       6.676571 29.72637       6.461576 38.50845 7.383359 45.46138 5.977227 -6.952934      9.499539 
1 1 1 -7  16 45 o 16.71548 6.487293 3.769099       3.779798 2.889030       5.445343 4.587421       5.250843 16.93249 7.289986 18.22792 7.452108 -1.295427      10.42486 
1 1 1 -7  16 46 o 32.84254 5.670147 16.22329       4.374043 17.47340       6.311788 15.06821       6.067127 30.66612 8.261748 28.23137 8.281588 2.434748       11.69791 
1 1 1 -7  16 47 o 14.17681 6.058364 2.156337       3.709199 0.7389566      5.354220 3.464265       5.143333 14.43153 6.636087 16.09294 7.006068 -1.661415      9.650007 
1 1 1 -7  16 48 o 13.28186 5.796351 1.640849       3.538817 -1.613321      5.475704 3.974895       4.637400 13.00059 6.203167 15.88765 6.781372 -2.887057      9.190555 
1 1 1 -7  17 1  o 416.2148 7.253450 2113.579       73.56958 2197.363       129.8344 2073.954       89.28732 423.6337 12.59057 412.1575 8.889769 11.47617       15.41267 
1 1 1 -7  17 2  o 103.8343 2.971661 131.5042       7.511548 136.7254       10.23243 125.4022       11.06185 105.8352 3.974524 101.3244 4.491153 4.510719       5.997274 
1 1 1 -7  17 3  o 317.7146 4.444245 1230.541       34.40894 1248.217       54.66560 1218.942       44.28175 319.8702 7.013005 316.1609 5.747520 3.709320       9.067317 
1 1 1 -7  17 4  o 128.1376 4.258013 200.3723       13.27749 195.4428       17.71424 206.6924       20.05779 126.4662 5.763083 130.0233 6.349518 -3.557190      8.574935 
1 1 1 -7  17 5  o 600.2722 7.134773 4396.204       104.3673 4395.458       147.7107 4396.947       147.4849 599.8220 10.10540 599.9263 10.08820 -0.1043091     14.27903 
1 1 1 -7  17 6  o 289.1492 4.638901 1019.298       32.68686 999.4966       46.03748 1039.428       46.41727 286.2422 6.599968 291.9079 6.525259 -5.665710      9.281087 
1 1 1 -7  17 7  o 453.3148 6.751884 2507.046       74.58664 2417.966       103.3234 2603.977       107.7806 444.9060 9.530034 461.6958 9.579624 -16.78979      13.51261 
1 1 1 -7  17 8  o 480.7448 7.123757 2820.261       83.45644 2807.543       118.2144 2832.899       117.8369 479.2924 10.12124 481.4631 10.04344 -2.170654      14.25869 
1 1 1 -7  17 9  o 359.1601 7.756129 1574.764       67.88428 0.000000       0.000000 1574.764       67.88428 ?        ?        359.1601 7.756129 0.000000       7.756129 
1 1 1 -7  17 10 o 127.3532 4.194484 197.9525       12.99964 0.000000       0.000000 197.9525       12.99964 ?        ?        127.3532 4.194484 0.000000       4.194484 
1 1 1 -7  17 11 o 274.5050 5.134624 919.0623       34.34749 1037.337       64.78954 872.8270       40.50840 291.1731 9.142312 267.4483 6.215400 23.72473       11.05500 
1 1 1 -7  17 12 o 335.9417 5.207346 1376.693       42.63012 1440.307       88.79874 1357.640       48.59645 342.8234 10.64208 333.5476 5.978753 9.275787       12.20653 
1 1 1 -7  17 13 o 193.9746 3.175387 458.6753       15.00990 447.1826       23.98253 466.0760       19.24521 191.3851 5.146893 195.5041 4.039527 -4.119003      6.542804 
1 1 1 -7  17 14 o 171.6647 2.995947 359.2342       12.53290 349.4808       20.12533 365.4127       16.01797 169.1804 4.886661 173.1094 3.797090 -3.929001      6.188485 
1 1 1 -7  17 15 o 272.0066 5.114275 902.9286       33.89999 870.3542       41.12886 971.9489       59.86829 266.9434 6.322538 281.6509 8.733226 -14.70755      10.78164 
1 1 1 -7  17 16 o 301.6959 5.588606 1111.423       41.08743 1128.892       50.82879 1078.485       69.79316 303.8917 6.863645 296.4016 9.675615 7.490143       11.86285 
1 1 1 -7  17 17 o 356.2560 5.486839 1550.097       47.63438 1575.282       68.48739 1526.497       66.29639 358.6980 7.835119 353.1283 7.704089 5.569733       10.98827 
1 1 1 -7  17 18 o 59.25687 3.211582 42.94894       4.620274 39.78748       7.319377 45.04311       5.957119 56.82231 5.348818 60.62170 4.055812 -3.799389      6.712635 
1 1 1 -7  17 19 o 120.9118 3.371457 178.4725       9.924268 171.6356       12.74154 189.0178       15.82415 118.4891 4.420481 124.2723 5.237022 -5.783173      6.853251 
1 1 1 -7  17 20 o 193.9071 3.557378 458.7705       16.80969 452.7353       24.13501 464.4564       23.42583 192.4128 5.151911 194.9181 4.935785 -2.505295      7.134715 
1 1 1 -7  17 21 o 76.97777 2.987104 72.38496       5.592766 67.46420       8.462137 76.20152       7.452457 74.16479 4.706437 78.91618 3.887191 -4.751389      6.104162 
1 1 1 -7  17 22 o 165.5615 3.708297 334.5786       14.96132 325.5226       25.70808 339.2167       18.39785 162.8798 6.489880 166.5703 4.536679 -3.690491      7.918333 
1 1 1 -7  17 23 o 241.8155 4.094411 714.1974       24.12746 717.9336       34.65668 710.6833       33.61015 242.1400 5.873331 240.9440 5.724246 1.195984       8.201403 
1 1 1 -7  17 24 o 211.1526 4.435824 544.9401       22.82480 551.5972       28.05028 531.8946       39.26707 212.2063 5.428747 207.8039 7.767903 4.402344       9.476898 
1 1 1 -7  17 25 o 142.9044 4.820282 250.1141       16.76225 236.8839       23.82651 263.0787       23.58612 138.6541 7.075054 146.2332 6.636017 -7.579178      9.700160 
1 1 1 -7  17 26 o 110.2201 3.327876 148.4699       8.928251 146.6642       11.72497 150.9620       13.77400 109.4229 4.406122 110.9171 5.109682 -1.494194      6.747056 
1 1 1 -7  17 27 o 132.5863 3.072204 214.6157       9.926238 206.2225       14.31885 222.3809       13.77272 129.7386 4.535983 134.7836 4.198329 -5.044983      6.180705 
1 1 1 -7  17 28 o 132.9294 3.115752 215.7837       10.09300 202.8772       14.41928 228.1817       14.13235 128.6413 4.607111 136.4980 4.253855 -7.856613      6.270627 
1 1 1 -7  17 29 o 181.1948 3.495630 401.2762       15.43503 391.4217       22.00836 410.8148       21.65284 178.5831 5.062320 183.0087 4.859498 -4.425674      7.017251 
1 1 1 -7  17 30 o 49.73154 3.764136 30.42702       4.527896 23.52429       6.597485 36.57334       6.225516 43.22669 6.461068 54.41151 4.742478 -11.18481      8.014768 
1 1 1 -7  17 31 o 60.57949 4.084388 45.15776       5.994360 53.84509       12.80922 42.72178       6.782921 65.28284 8.234529 58.80763 4.774140 6.475204       9.518396 
1 1 1 -7  17 32 o 35.96228 5.094740 16.21274       4.339982 27.58357       7.799776 11.11347       5.223239 46.65927 7.081923 29.34982 7.326286 17.30945       10.18961 
1 1 1 -7  17 33 o 154.2902 3.315608 291.4343       12.46630 286.4821       17.91572 296.0826       17.35756 152.4969 4.827081 155.1120 4.597128 -2.615082      6.665905 
1 1 1 -7  17 34 o 67.06234 3.374520 55.25596       5.497041 45.21420       7.711729 65.62869       7.837784 60.25838 5.305810 72.89256 4.433355 -12.63417      6.914207 
1 1 1 -7  17 35 o 60.21634 3.503516 44.67158       5.118878 42.94396       7.466677 46.20360       7.031299 58.62607 5.282988 60.96254 4.770976 -2.336475      7.118439 
1 1 1 -7  17 36 f 63.83688 3.793092 50.39733       5.874064 46.55199       7.652327 55.91346       9.165230 60.94545 5.202166 66.65475 5.697129 -5.709305      7.714908 
1 1 1 -7  17 37 o 58.68589 3.634855 42.68258       5.172733 41.09520       7.408412 44.19263       7.225708 57.00617 5.397220 59.26300 5.051454 -2.256828      7.392373 
1 1 1 -7  17 38 o 43.14510 4.979165 23.68499       5.139163 27.33315       6.286413 16.33438       8.923340 46.09159 5.719521 33.94952 10.06581 12.14207       11.57728 
1 1 1 -7  17 39 o 21.09804 6.639435 5.835148       3.808064 5.233296       5.362073 6.447596       5.409064 21.23401 7.841262 22.60685 7.934828 -1.372843      11.15558 
1 1 1 -7  17 40 o 36.93156 4.739312 17.64156       4.167105 13.10334       5.733056 22.72472       6.067509 30.38608 7.726291 41.18451 6.240933 -10.79844      9.932010 
1 1 1 -7  17 41 o 37.02246 4.700059 17.92438       4.144943 18.97402       5.826972 16.84923       5.897330 36.87312 6.732819 34.33995 7.273848 2.533165       9.911595 
1 1 1 -7  17 42 o 44.64805 4.285508 26.01596       4.605550 20.02237       6.327341 32.76956       6.716533 36.91121 7.293128 48.92986 5.742074 -12.01864      9.282302 
1 1 1 -7  17 43 o 44.36018 5.432330 27.29334       5.749989 14.71992       10.41999 32.79838       6.894790 27.20920 10.70925 48.02731 6.023217 -20.81811      12.28687 
1 1 1 -7  17 44 o 15.33790 6.294954 2.379693       3.765083 6.296383       5.749088 -0.5617113     4.982149 20.25516 7.960023 14.32246 6.515626 5.932697       10.28666 
1 1 1 -7  17 45 o 19.46379 7.201802 6.147088       4.527103 3.284261       5.580954 11.65502       7.741147 17.09636 7.370539 23.74053 9.264050 -6.644171      11.83839 
1 1 1 -7  17 46 o 10.33259 4.932781 -2.901000      3.472284 -8.945050      5.403156 1.351216       4.532012 10.74978 5.340185 14.44276 6.420050 -3.692972      8.350726 
1 1 1 -7  17 47 o 12.10960 5.556034 -0.2852545     3.724665 0.7897825      5.673127 -1.099734      4.937997 14.53516 6.735795 12.94378 6.090896 1.591377       9.081297 
1 1 1 -7  17 48 o 11.15734 5.254670 -1.385696      3.688958 0.4898597      5.665376 -2.766226      4.860562 14.00313 6.568773 11.82220 5.694055 2.180936       8.693161 
1 1 1 -7  18 1  o 147.8353 4.532794 266.7168       16.31049 268.6524       22.32392 264.5003       23.88850 148.2701 6.192097 147.0820 6.682350 1.188126       9.110207 
1 1 1 -7  18 2  o 337.3015 5.211098 1387.427       42.83350 1381.493       60.34496 1393.453       60.80913 336.4377 7.360380 337.8890 7.385139 -1.451294      10.42667 
1 1 1 -7  18 3  o 562.3163 8.218048 3860.863       112.6122 4072.775       164.9874 3676.028       154.0863 576.9104 11.73563 548.1306 11.53570 28.77985       16.45592 
1 1 1 -7  18 4  o 135.5204 3.021654 223.8418       9.978964 211.6393       13.60525 238.0499       14.68081 131.6878 4.245147 139.6675 4.318579 -7.979630      6.055691 
1 1 1 -7  18 5  o 40.30314 4.021698 19.99897       3.897206 16.87804       5.101782 24.37180       6.038949 36.73831 5.898130 44.33440 5.723025 -7.596096      8.218330 
1 1 1 -7  18 6  o 256.2155 4.215312 800.3473       26.31910 833.3809       38.08000 770.1354       36.41731 261.3699 5.978680 251.2581 5.947737 10.11180       8.433279 
1 1 1 -7  18 7  f 513.8248 7.570952 3223.460       94.79855 3086.931       184.5182 3272.421       110.4965 501.0769 15.12852 517.5334 8.761413 -16.45645      17.48240 
1 1 1 -7  18 8  o 94.19431 3.531933 108.3104       8.092885 128.1645       15.21403 100.4757       9.557192 102.3050 6.130673 90.67286 4.337888 11.63216       7.510155 
1 1 1 -7  18 9  o 187.5074 3.521244 428.6103       16.08980 438.3795       33.99924 425.7910       18.26448 189.3267 7.383372 186.8756 4.010686 2.451065       8.402368 
1 1 1 -7  18 10 o 96.51654 2.728150 113.6317       6.410180 126.2463       11.11882 107.3517       7.845175 101.6453 4.500005 93.77696 3.438797 7.868347       5.663512 
1 1 1 -7  18 11 o 156.7072 3.229852 299.3669       12.33411 283.7136       25.13060 304.3341       14.15644 152.2734 6.789474 157.9901 3.676952 -5.716690      7.721200 
1 1 1 -7  18 12 o 413.5359 5.575926 2087.143       56.19096 2126.652       90.38434 2062.253       71.73947 416.8987 8.896652 410.8413 7.165523 6.057312       11.42345 
1 1 1 -7  18 13 o 215.6223 3.809865 566.9772       20.01886 563.3775       28.72689 570.3758       27.91257 214.7677 5.493386 216.1812 5.298413 -1.413452      7.632199 
1 1 1 -7  18 14 o 297.1320 4.733444 1077.322       34.27384 1060.257       48.60100 1094.205       48.34111 294.5423 6.771135 299.2392 6.629213 -4.696960      9.476008 
1 1 1 -7  18 15 o 418.8961 6.309542 2144.361       64.40806 2020.599       88.19714 2285.784       94.28036 406.0340 8.913659 431.8440 8.958973 -25.81003      12.63790 
1 1 1 -7  18 16 f 256.1998 4.252714 800.9702       26.55102 798.4627       37.95589 803.3730       37.15454 255.5965 6.093801 256.4000 5.946449 -0.8035736     8.514380 
1 1 1 -7  18 17 o 44.39489 3.908024 24.23378       4.184804 15.88402       6.575831 29.91710       5.425185 35.31926 7.844310 49.29392 4.568294 -13.97466      9.077583 
1 1 1 -7  18 18 o 238.7678 4.057847 695.8029       23.61062 699.6539       34.02598 692.2269       32.78928 239.2133 5.836995 237.9656 5.654335 1.247650       8.126623 
1 1 1 -7  18 19 o 109.9049 2.975544 147.4295       7.961952 129.8402       11.51663 163.5332       11.01961 103.0060 4.599638 115.6867 3.914468 -12.68069      6.039845 
1 1 1 -7  18 20 o 91.65503 2.964679 102.5718       6.612999 95.02796       9.892152 108.6673       8.891984 88.07949 4.624921 94.27370 3.878829 -6.194214      6.036158 
1 1 1 -7  18 21 o 129.6159 4.039763 205.3333       12.74441 205.3289       19.19619 205.3367       17.04212 129.3598 6.106710 129.4590 5.413959 -0.9916687E-01 8.161058 
1 1 1 -7  18 22 o 121.4202 3.017681 179.8680       8.928946 172.7077       13.15129 185.9912       12.16157 118.7939 4.551373 123.3391 4.051751 -4.545204      6.093577 
1 1 1 -7  18 23 o 141.7712 3.858542 245.6490       13.31814 238.4588       15.91234 262.4676       24.33646 139.5775 4.684881 146.0741 6.855853 -6.496628      8.303664 
1 1 1 -7  18 24 o 217.6297 4.546100 579.1388       24.10978 577.9146       29.40563 581.6497       42.11299 217.1387 5.561794 217.1636 7.971326 -0.2490234E-01 9.719856 
1 1 1 -7  18 25 f 173.5771 3.423785 367.9139       14.48221 358.9315       20.72414 376.4866       20.24611 171.1652 4.973770 175.3475 4.742471 -4.182312      6.872366 
1 1 1 -7  18 26 o 116.8006 3.048509 166.6549       8.669564 160.3813       12.63430 172.2375       11.91824 114.3983 4.541083 118.6157 4.129494 -4.217407      6.137928 
1 1 1 -7  18 27 o 112.7545 3.029850 155.3396       8.317590 162.1826       12.42534 149.7835       11.19615 115.0320 4.440890 110.5810 4.162249 4.451019       6.086528 
1 1 1 -7  18 28 o 101.4158 3.022058 125.7113       7.460359 134.5362       11.27275 118.8339       9.951443 104.7348 4.426730 98.46117 4.156838 6.273643       6.072499 
1 1 1 -7  18 29 o 10.12779 4.808129 -3.973847      3.206789 -5.311102      5.229764 -3.168099      4.059519 13.47856 6.319022 12.47827 5.752526 1.000290       8.545267 
1 1 1 -7  18 30 o 135.3826 3.706349 224.4396       12.21621 221.7357       23.60877 225.4283       14.27599 133.6190 7.277997 135.5584 4.327133 -1.939438      8.467192 
1 1 1 -7  18 31 o 132.9357 3.150499 216.0661       10.20604 216.2630       14.97828 215.8955       13.94417 132.6504 4.640737 132.6136 4.320647 0.3683472E-01  6.340696 
1 1 1 -7  18 32 o 112.4485 3.429281 154.9478       9.386097 152.0130       15.84898 156.5332       11.64852 110.7655 5.892867 112.8535 4.243206 -2.088005      7.261589 
1 1 1 -7  18 33 o 45.56608 3.958974 25.67652       4.352440 26.16080       6.428081 25.26653       5.914501 45.59029 5.926025 44.88644 5.523472 0.7038498      8.101019 
1 1 1 -7  18 34 o 76.10439 3.166451 71.10566       5.859611 80.93040       8.954853 63.74905       7.748845 80.88389 4.561672 71.78412 4.451585 9.099770       6.373811 
1 1 1 -7  18 35 o 24.41774 6.293244 7.751683       3.768242 12.66482       5.597713 3.680144       5.095779 31.01925 7.490625 19.88737 7.580129 11.13189       10.65682 
1 1 1 -7  18 36 o 120.5019 3.610375 179.2151       10.58991 177.3002       13.65675 182.1030       16.77135 119.3254 4.705770 120.3091 5.737023 -0.9836349     7.420088 
1 1 1 -7  18 37 o 25.82884 5.968894 8.779990       3.681561 10.13082       5.494374 7.679310       4.959620 27.46670 7.828873 24.24924 7.569339 3.217461       10.88973 
1 1 1 -7  18 38 o 48.54765 4.914387 30.01308       5.733991 33.13345       6.848009 22.69364       10.48819 50.69804 5.638161 39.21871 10.68567 11.47932       12.08191 
1 1 1 -7  18 39 o 31.66997 5.465166 13.21208       4.065440 11.45188       5.789119 14.92478       5.710488 28.48689 8.007844 32.83717 7.322898 -4.350281      10.85129 
1 1 1 -7  18 40 o 39.10022 4.632974 19.81603       4.328753 16.51136       6.106758 23.15342       6.136916 34.02724 7.560884 41.33144 6.291252 -7.304203      9.835996 
1 1 1 -7  18 41 o 31.09253 6.313889 13.54825       4.620468 8.620502       6.953265 17.44471       6.183005 24.24073 8.933156 34.46896 7.568677 -10.22823      11.70838 
1 1 1 -7  18 42 f 18.13385 7.142840 3.923885       4.638622 -11.55781      9.102816 9.354156       5.391098 15.00657 7.353641 24.45809 7.922089 -9.451518      10.80905 
1 1 1 -7  18 43 o 45.80079 4.428568 28.10422       4.881205 31.97134       7.223298 24.85416       6.621968 46.54979 6.548467 40.55800 6.949922 5.991787       9.549023 
1 1 1 -7  18 44 o 11.10272 5.224456 -2.499742      3.632736 -4.011159      5.439698 -1.283053      4.880589 12.93805 6.175926 13.62858 6.291644 -0.6905260     8.816283 
1 1 1 -7  18 45 o 23.34339 6.628677 8.948053       3.946249 2.612841       5.609967 15.15338       5.552161 16.38157 7.218859 29.38280 7.672470 -13.00124      10.53464 
1 1 1 -7  18 46 o 22.11213 6.886386 8.684659       4.107549 15.60065       6.444921 3.953820       5.330394 27.12389 8.650141 16.63053 7.186600 10.49336       11.24598 
1 1 1 -7  18 47 o 15.63375 6.376112 3.803766       3.832643 4.870968       6.124272 3.116738       4.913810 16.93832 7.499756 15.40704 6.773980 1.531281       10.10609 
1 1 1 -7  19 1  o 374.5002 5.725316 1711.163       52.25016 1717.306       104.3377 1709.107       60.36468 374.2489 11.45397 374.1909 6.619934 0.5807495E-01  13.22940 
1 1 1 -7  19 2  o 410.2196 6.176596 2053.570       61.74500 2017.068       86.08971 2092.236       88.60585 406.2499 8.696047 413.7368 8.788244 -7.486908      12.36343 
1 1 1 -7  19 3  o 341.1565 4.725025 1419.407       39.28202 1387.244       60.99455 1442.203       51.34876 337.0447 7.426214 343.7787 6.129357 -6.733978      9.629003 
1 1 1 -7  19 4  o 314.4024 4.953039 1205.637       37.94843 1116.224       72.13532 1239.852       44.62213 301.9156 9.817572 318.7768 5.744173 -16.86118      11.37454 
1 1 1 -7  19 5  o 316.3248 4.440485 1220.211       34.22944 1244.371       54.55241 1204.523       43.96004 319.2423 7.012251 314.1967 5.741433 5.045532       9.062876 
1 1 1 -7  19 6  o 229.8289 3.230765 643.8941       18.09448 667.0609       26.12085 622.5211       25.08924 233.8727 4.583231 225.9311 4.556962 7.941544       6.463119 
1 1 1 -7  19 7  o 284.0984 4.616173 984.3947       31.95854 959.3705       44.83692 1010.237       45.56427 280.3240 6.563559 287.6650 6.499818 -7.341003      9.237312 
1 1 1 -7  19 8  o 228.5138 3.962187 636.7403       22.06396 627.0317       45.01412 639.8104       25.31332 226.3380 8.174649 229.0369 4.535315 -2.698959      9.348475 
1 1 1 -7  19 9  o 132.2077 2.798062 213.0571       9.014681 229.6776       15.16764 203.9796       11.20927 137.1471 4.544598 129.2955 3.560996 7.851593       5.773566 
1 1 1 -7  19 10 o 291.1985 4.191470 1034.213       29.74347 1079.734       48.68884 1007.111       37.56833 297.3094 6.720238 287.2678 5.366596 10.04163       8.600114 
1 1 1 -7  19 11 o 387.6623 5.281077 1834.193       49.88985 1785.275       77.95781 1868.123       64.92619 381.9711 8.375157 391.0128 6.813855 -9.041656      10.79685 
1 1 1 -7  19 12 o 207.8098 4.338213 526.8396       21.96914 617.5399       41.80388 492.2321       25.82248 224.5651 7.650202 200.7391 5.283328 23.82594       9.297266 
1 1 1 -7  19 13 o 405.1581 7.114031 2007.505       70.23869 2014.664       86.43195 1993.584       120.5285 405.4981 8.746803 402.0939 12.31511 3.404205       15.10524 
1 1 1 -7  19 14 o 198.0301 3.245978 478.2307       15.66437 457.3032       24.78616 492.1476       20.21251 193.4440 5.262858 200.8382 4.129884 -7.394180      6.689815 
1 1 1 -7  19 15 o 420.0386 6.342242 2157.402       64.91845 2078.643       90.06322 2242.576       93.65945 411.5660 8.979908 427.4835 8.990753 -15.91751      12.70718 
1 1 1 -7  19 16 o 305.3820 4.339804 1138.378       32.29606 1138.792       51.66013 1138.113       41.37904 305.0019 6.950512 305.1671 5.564250 -0.1651611     8.903398 
1 1 1 -7  19 17 o 189.1796 3.149749 436.5240       14.52065 446.8352       23.91484 430.5027       18.27502 191.1667 5.138225 187.8108 3.993018 3.355972       6.507345 
1 1 1 -7  19 18 o 182.5199 3.481249 406.4638       15.48394 392.5760       22.16202 419.7079       21.64241 179.1647 5.081124 185.2941 4.797041 -6.129379      6.987805 
1 1 1 -7  19 19 o 180.1891 3.455142 396.1810       15.17157 391.4838       21.92824 400.4941       21.01271 178.9019 5.034830 180.9863 4.768467 -2.084427      6.934536 
1 1 1 -7  19 20 o 94.34491 3.334979 108.7469       7.655333 106.5536       14.14574 109.6552       9.103636 93.06673 6.273941 94.68703 3.954077 -1.620308      7.416000 
1 1 1 -7  19 21 o 107.3038 2.991188 140.5832       7.813957 140.7497       11.88613 140.4565       10.36966 107.2213 4.559486 107.1705 3.977472 0.5074310E-01  6.050553 
1 1 1 -7  19 22 o 34.34674 10.41494 14.71966       9.473091 14.71966       9.473091 0.000000       0.000000 34.34674 10.41494 ?        ?        0.000000       10.41494 
1 1 1 -7  19 23 o 165.9974 4.018227 336.6750       16.25443 362.5880       20.45916 292.3249       26.76561 172.0853 4.883682 154.0564 7.149031 18.02896       8.657886 
1 1 1 -7  19 24 o 51.76689 3.513866 32.87677       4.406479 30.87992       7.073374 34.14322       5.633096 49.83349 5.941533 52.65545 4.431108 -2.821957      7.411919 
1 1 1 -7  19 25 f 151.6741 3.693902 281.0800       13.65316 276.7778       17.56140 287.6540       21.70815 150.2905 4.801193 153.0139 5.832460 -2.723404      7.554406 
1 1 1 -7  19 26 o 15.66266 6.032416 1.979092       3.249959 0.4481497      5.348536 2.875215       4.092032 17.48319 7.364439 18.00477 6.808898 -0.5215759     10.02976 
1 1 1 -7  19 27 o 74.85236 3.133003 68.54819       5.702182 68.12405       8.729491 68.86386       7.530837 74.40926 4.840491 74.91085 4.141483 -0.5015945     6.370419 
1 1 1 -7  19 28 o 12.19986 5.408152 -1.104144      3.193947 -5.579448      5.208881 1.592299       4.043234 13.30668 6.259817 16.46875 6.608969 -3.162062      9.102954 
1 1 1 -7  19 29 o 157.2088 3.841548 302.4699       14.71700 342.3261       29.48169 289.2417       16.98459 166.1388 7.299727 153.5315 4.544642 12.60732       8.598825 
1 1 1 -7  19 30 o 135.7408 3.714662 225.7169       12.27601 249.2880       24.61556 217.9138       14.16295 141.6474 7.154404 133.2348 4.368048 8.412659       8.382442 
1 1 1 -7  19 31 o 28.45160 6.202919 10.38767       4.179118 5.139297       7.271892 12.97589       5.106650 23.77644 9.056895 31.76610 6.801939 -7.989660      11.32668 
1 1 1 -7  19 32 o 54.74807 3.557736 36.88457       4.720849 36.93196       7.176833 36.84842       6.267712 54.41761 5.486836 54.50894 4.766418 -0.9133148E-01 7.268020 
1 1 1 -7  19 33 o 55.96844 3.567220 38.58643       4.839974 41.07092       7.570748 36.86915       6.294198 57.33820 5.485031 54.46395 4.791152 2.874249       7.282905 
1 1 1 -7  19 34 o 67.64936 3.358938 56.32160       5.520029 62.58753       8.297282 51.34618       7.393630 70.95757 4.827192 64.25896 4.755281 6.698608       6.776022 
1 1 1 -7  19 35 o 60.30394 3.843376 45.04315       5.618606 38.70556       7.423237 53.54383       8.597224 55.37348 5.577066 65.25558 5.456254 -9.882095      7.802204 
1 1 1 -7  19 36 o 17.02278 6.288632 2.992594       3.449434 3.780714       5.296399 2.412059       4.545679 20.01808 7.703259 17.73984 7.044590 2.278240       10.43870 
1 1 1 -7  19 37 o 40.29712 5.682983 20.99447       5.425903 18.41143       6.237594 29.02709       10.99967 37.08701 7.161064 45.00323 10.25878 -7.916225      12.51093 
1 1 1 -7  19 38 o 14.32175 6.040214 0.6388726      3.605138 3.196658       5.396598 -1.422586      4.844794 19.18238 7.656509 14.68271 6.574677 4.499670       10.09200 
1 1 1 -7  19 39 o 24.21760 6.283961 8.033310       3.740054 9.036962       5.318812 7.051676       5.260147 25.33274 7.827527 22.89892 7.835920 2.433825       11.07573 
1 1 1 -7  19 40 o 50.36895 4.360595 32.73326       5.299682 26.96251       8.208079 36.85894       6.940213 42.87843 8.153267 52.64267 5.490636 -9.764244      9.829692 
1 1 1 -7  19 41 o 25.72955 6.535913 9.587968       4.105374 7.749580       5.555659 11.79936       6.093263 22.83338 8.039429 27.37246 8.363526 -4.539074      11.60090 
1 1 1 -7  19 42 o 42.91462 5.496517 25.62204       5.616365 12.92873       10.02503 31.42840       6.780313 26.09190 10.42844 46.96771 6.065469 -20.87581      12.06409 
1 1 1 -7  19 43 o 32.51523 5.646913 15.20317       4.312145 15.00922       6.419952 15.36259       5.820597 29.33383 8.494637 30.55530 7.793513 -1.221470      11.52813 
1 1 1 -7  19 44 o 20.88845 7.306308 7.320639       4.583548 7.555381       6.003834 6.992674       7.096564 20.79086 8.145235 20.32195 8.516726 0.4689083      11.78471 
1 1 1 -7  19 45 o 14.70047 6.143497 2.444586       3.676946 12.57373       5.781933 -4.433354      4.764483 25.35964 8.203423 11.51129 5.567234 13.84835       9.914144 
1 1 1 -7  19 46 o 12.40340 5.633924 0.1037801      3.707242 3.457818       5.971825 -1.999263      4.728758 16.29668 7.298265 12.31649 5.844734 3.980193       9.350165 
1 1 1 -7  19 47 o 13.90422 6.007117 2.222831       3.722636 -0.1385098     5.780757 3.895887       4.865870 13.85317 6.540636 15.81529 6.850297 -1.962119      9.471352 
1 1 1 -7  20 1  o 248.0452 3.715111 750.2098       22.45633 760.3168       35.43117 743.4238       29.03227 249.5786 5.825620 246.8593 4.826088 2.719223       7.564983 
1 1 1 -7  20 2  o 82.88757 2.718120 83.83360       5.482851 77.73637       8.054901 89.09766       7.484342 79.73057 4.160104 85.40785 3.604101 -5.677284      5.504181 
1 1 1 -7  20 3  o 267.3985 3.921595 871.9128       25.55394 892.9903       40.67699 858.1713       32.84404 270.4509 6.171976 265.2107 5.081938 5.240204       7.994959 
1 1 1 -7  20 4  o 71.60063 2.781027 62.58515       4.843190 79.29372       7.456468 50.39177       6.369794 80.55005 3.809461 64.15099 4.096005 16.39906       5.593680 
1 1 1 -7  20 5  o 527.8485 6.954814 3403.764       89.46042 3737.633       150.3372 3220.726       111.3138 551.9924 11.17628 513.0323 8.903654 38.96008       14.28931 
1 1 1 -7  20 6  o 151.7728 2.853134 280.7965       10.55243 288.8845       16.69475 275.4152       13.61774 153.8283 4.458267 150.2876 3.718313 3.540726       5.805342 
1 1 1 -7  20 7  o 277.2166 4.540142 937.4880       30.67077 919.8503       62.03372 943.1945       35.28529 273.9153 9.306936 278.0063 5.208383 -4.091003      10.66519 
1 1 1 -7  20 8  o 248.0527 3.754330 750.3592       22.69408 805.3253       37.78428 719.3404       28.38416 256.8017 6.037779 242.8052 4.797135 13.99643       7.711503 
1 1 1 -7  20 9  o 381.4596 5.221113 1776.126       48.53418 1767.698       76.93023 1781.698       62.55405 380.0380 8.306803 381.8348 6.722700 -1.796844      10.68633 
1 1 1 -7  20 10 o 305.2429 4.357527 1136.771       32.41319 1128.736       51.51915 1142.035       41.70051 303.8506 6.957809 305.8175 5.595551 -1.966919      8.928679 
1 1 1 -7  20 11 o 300.3572 4.304020 1100.751       31.50275 1105.990       50.43777 1097.400       40.33872 300.7447 6.882113 299.7646 5.522118 0.9800720      8.823677 
1 1 1 -7  20 12 o 49.73186 4.614655 30.44597       5.528762 26.18720       7.075521 37.12325       8.859637 45.82687 6.519504 54.67956 6.795153 -8.852695      9.416901 
1 1 1 -7  20 13 o 291.8027 4.686869 1039.503       33.32792 1049.483       67.67249 1036.307       38.29391 292.1673 9.517532 291.2622 5.395224 0.9051514      10.94038 
1 1 1 -7  20 14 o 379.7045 5.825856 1762.391       53.90656 1798.592       77.67256 1728.750       74.87515 382.9413 8.323373 375.4738 8.183178 7.467468       11.67231 
1 1 1 -7  20 15 o 283.8535 4.118746 983.4432       28.49019 957.5995       44.96803 1000.773       36.82383 279.7191 6.596988 286.1837 5.280169 -6.464691      8.449878 
1 1 1 -7  20 16 o 154.6410 2.902438 291.6464       10.93764 288.1183       17.89670 293.7498       13.81868 153.5067 4.790064 155.1558 3.654790 -1.649094      6.025131 
1 1 1 -7  20 17 o 54.82798 3.035046 36.77900       4.039297 32.17019       7.318431 38.79805       4.843936 50.92765 6.012757 56.27628 3.550225 -5.348637      6.982646 
1 1 1 -7  20 18 o 161.5696 2.933559 318.4133       11.55023 320.2527       19.11247 317.3549       14.49696 161.8132 4.852411 161.2507 3.689261 0.5625305      6.095616 
1 1 1 -7  20 19 o 236.1222 4.636925 681.2970       26.68105 680.5181       46.90305 681.6697       32.44143 235.1272 8.198362 236.0232 5.640389 -0.8960571     9.951238 
1 1 1 -7  20 20 o 73.91051 3.166054 66.78059       5.689227 61.50824       8.877449 70.45512       7.411173 70.72250 5.187116 75.84579 4.024171 -5.123291      6.565069 
1 1 1 -7  20 21 o 81.48331 4.921467 81.50162       9.726801 92.40051       14.62973 72.86681       13.02180 86.47171 7.002524 76.71681 7.043930 9.754898       9.932385 
1 1 1 -7  20 22 o 119.0933 3.807097 173.4232       11.03466 167.5017       13.32393 186.3534       19.68868 116.9338 4.685287 123.0368 6.590727 -6.102951      8.086384 
1 1 1 -7  20 23 o 56.25626 3.846436 38.84639       5.241368 39.19779       7.768701 38.55281       7.101043 56.25869 5.747258 55.86041 5.279158 0.3982811      7.803876 
1 1 1 -7  20 24 o 164.1392 3.825005 329.2413       15.29961 326.2602       19.62387 333.8620       24.43150 163.1598 4.941243 164.8033 6.093920 -1.643494      7.845492 
1 1 1 -7  20 25 f 64.62263 3.246233 51.12894       5.095743 52.41446       8.153455 50.30498       6.527638 65.19465 5.174499 63.99309 4.209253 1.201561       6.670326 
1 1 1 -7  20 26 o 30.32185 5.135098 11.57891       3.659092 9.208497       6.334138 12.76614       4.482727 27.35229 8.556601 31.72011 6.019380 -4.367819      10.46176 
1 1 1 -7  20 27 o 62.40764 3.234975 47.71224       4.902977 58.79977       8.306505 41.78382       6.073943 69.06916 4.968319 58.26117 4.308633 10.80799       6.576360 
1 1 1 -7  20 28 o 108.0087 3.561680 142.8262       9.361715 138.4086       18.80934 144.2808       10.79359 105.4984 7.362510 108.4754 4.090509 -2.977028      8.422518 
1 1 1 -7  20 29 o 85.97455 3.608478 90.60625       7.543335 102.3627       16.71809 87.60091       8.452684 90.48443 7.653594 84.45679 4.119419 6.027634       8.691784 
1 1 1 -7  20 30 o 132.1415 3.522456 213.8901       11.33270 224.5904       20.36993 209.0935       13.63822 134.6608 6.224274 130.4820 4.294999 4.178741       7.562315 
1 1 1 -7  20 31 o 134.1109 3.186839 220.1259       10.41502 225.8658       15.55153 215.4579       14.02466 135.4093 4.720121 132.3566 4.354136 3.052673       6.421686 
1 1 1 -7  20 32 o 49.05602 3.832947 29.72219       4.545714 22.76100       6.812827 35.30807       6.102835 42.20478 6.859460 53.31525 4.746836 -11.11047      8.341742 
1 1 1 -7  20 33 o 47.77346 3.891365 28.25726       4.491074 22.91423       6.864211 32.25640       5.938549 42.23023 6.908752 50.85181 4.850943 -8.621586      8.441711 
1 1 1 -7  20 34 o 110.7014 3.554679 150.9724       9.576927 153.3412       12.79051 147.9497       14.44812 111.0987 4.735218 108.7765 5.468081 2.322174       7.233408 
1 1 1 -7  20 35 o 37.40960 4.731524 17.68623       4.217084 9.795375       6.431779 23.63643       5.585150 27.33794 8.632099 43.10744 5.437485 -15.76950      10.20193 
1 1 1 -7  20 36 o 32.14601 5.186539 13.30627       3.924693 8.903955       6.053713 16.49819       5.154743 25.98766 8.392952 35.51783 6.179908 -9.530170      10.42271 
1 1 1 -7  20 37 f 28.88571 7.099456 11.36516       4.961331 13.01738       5.765406 6.649981       9.739714 30.71685 7.713963 25.54455 10.25531 5.172295       12.83264 
1 1 1 -7  20 38 o 88.57544 3.210160 97.66473       6.917628 88.92316       9.811775 106.3045       9.754484 83.38749 4.849406 91.58621 4.383294 -8.198723      6.536819 
1 1 1 -7  20 39 o 43.09737 4.250682 23.85373       4.406164 23.85325       6.349592 23.85417       6.119299 41.78411 6.442730 41.96875 6.167074 -0.1846428     8.918609 
1 1 1 -7  20 40 o 13.70877 6.111362 -0.6212013     4.137103 6.660689       6.746332 -5.010129      5.237510 22.29871 8.663344 12.84787 6.112415 9.450846       10.60260 
1 1 1 -7  20 41 o 37.28999 5.077529 18.90437       4.494292 16.12644       6.113290 22.17160       6.629868 32.12324 7.871968 38.41250 7.350344 -6.289265      10.77012 
1 1 1 -7  20 42 o 33.31812 6.324672 16.34929       4.947396 9.310372       8.732042 19.67715       6.004070 23.26700 9.571888 35.81250 7.130504 -12.54549      11.93587 
1 1 1 -7  20 43 o 34.83538 6.433739 18.42863       5.260457 20.36024       6.765250 15.47482       8.365919 34.53256 8.168115 27.23283 9.834817 7.299734       12.78443 
1 1 1 -7  20 44 o 31.31269 5.655568 14.69229       4.156737 15.04950       6.267304 14.41175       5.554125 28.05372 8.463785 28.44561 7.786565 -0.3918858     11.50071 
1 1 1 -7  20 45 o 11.18379 5.217082 -1.391766      3.491928 0.2690684      5.455475 -2.544473      4.544946 14.34982 6.634263 11.95571 5.689668 2.394109       8.739895 
1 1 1 -7  20 46 o 16.12745 6.456467 4.219384       3.849169 1.441723       5.919105 6.254731       5.066823 14.92337 6.903298 18.08995 7.348566 -3.166578      10.08251 
1 1 1 -7  21 1  o 106.7842 2.682916 139.0922       6.975997 126.6449       10.30269 149.6303       9.479715 101.8073 4.161520 110.7156 3.518049 -8.908310      5.449304 
1 1 1 -7  21 2  o 119.0937 3.044417 173.0347       8.828212 173.0756       11.91515 172.9849       13.14524 119.0457 4.113419 118.9844 4.541933 0.6130219E-01  6.127754 
1 1 1 -7  21 3  o 90.10355 2.671186 99.05499       5.858715 101.1552       8.909602 97.45507       7.776463 90.97737 4.028721 89.32378 3.579806 1.653587       5.389398 
1 1 1 -7  21 4  o 202.6853 3.293704 500.9186       16.26833 530.6788       26.15792 482.1468       20.77494 208.5098 5.148024 198.8010 4.288300 9.708878       6.700124 
1 1 1 -7  21 5  o 122.1208 3.475112 182.0102       10.33125 196.7225       17.61005 174.2891       12.75734 126.7946 5.714012 119.4409 4.390465 7.353691       7.205977 
1 1 1 -7  21 6  o 42.81121 4.008825 22.55227       4.133614 23.82370       7.079793 21.89467       5.091574 43.61952 6.888881 42.04935 5.071133 1.570171       8.554126 
1 1 1 -7  21 7  o 140.4701 3.185669 240.6014       10.90487 259.6247       22.36770 234.6701       12.48972 145.6224 6.318176 138.6606 3.699574 6.961823       7.321625 
1 1 1 -7  21 8  o 246.1590 4.195058 739.3097       25.16459 721.6686       35.52781 757.0710       35.64870 243.0323 5.998853 248.9360 5.876514 -5.903671      8.397598 
1 1 1 -7  21 9  o 273.6294 4.034651 913.4944       26.90326 904.8525       42.79605 919.1411       34.59348 272.0518 6.455294 274.3570 5.174186 -2.305176      8.273030 
1 1 1 -7  21 10 o 85.91048 3.191586 90.13133       6.670112 110.8094       10.34883 75.43706       8.723884 95.17774 4.474424 78.48086 4.581447 16.69688       6.403915 
1 1 1 -7  21 11 o 306.5190 5.702379 1148.173       42.59411 1087.251       50.64932 1295.328       78.71827 298.0579 6.973276 324.4358 9.968417 -26.37787      12.16536 
1 1 1 -7  21 12 o 213.7447 3.429490 557.3019       17.86327 566.0239       29.00089 551.9696       22.67544 215.1441 5.536137 212.6438 4.375895 2.500275       7.056718 
1 1 1 -7  21 13 o 205.8764 3.348106 517.0328       16.79739 516.2855       27.14546 517.4964       21.38283 205.4648 5.426304 205.8953 4.261696 -0.4305725     6.899771 
1 1 1 -7  21 14 f 113.1833 2.732871 156.2149       7.537675 158.0871       12.69992 155.1967       9.365685 113.6834 4.593707 112.7368 3.413014 0.9466019      5.722832 
1 1 1 -7  21 15 o 174.8426 3.396065 372.9683       14.46969 344.8614       28.68957 382.5570       16.75708 167.6175 7.039413 177.0400 3.884104 -9.422516      8.039876 
1 1 1 -7  21 16 o 83.65891 3.005795 85.47991       6.117884 85.83331       9.696313 85.24618       7.885661 83.68095 4.774745 83.47755 3.887106 0.2033997      6.156929 
1 1 1 -7  21 17 o 109.7126 2.701967 146.8009       7.223917 135.7265       12.00462 153.0877       9.044868 105.2899 4.690478 111.9615 3.318769 -6.671570      5.745852 
1 1 1 -7  21 18 o 283.8792 4.587260 984.8035       31.73387 911.7797       61.49790 1011.304       37.04720 271.7612 9.299875 287.5348 5.287238 -15.77362      10.69778 
1 1 1 -7  21 19 f 148.9101 3.311522 270.6264       12.01678 269.5535       17.46945 271.5900       16.55590 148.3983 4.837210 148.9954 4.565167 -0.5970917     6.651267 
1 1 1 -7  21 20 o 111.6301 4.719492 152.6481       12.80949 177.9227       19.40895 133.1436       17.05012 120.2329 6.650244 103.9356 6.768554 16.29733       9.488892 
1 1 1 -7  21 21 o 78.25407 3.137420 74.86154       5.970826 77.84332       9.573429 72.96326       7.638513 79.60658 4.959583 77.16514 4.076571 2.441437       6.419961 
1 1 1 -7  21 22 o 246.6298 4.215672 743.6168       25.33661 745.0247       36.59818 742.3210       35.11083 246.4152 6.094748 246.0334 5.856133 0.3818665      8.452233 
1 1 1 -7  21 23 o 77.92575 3.547561 74.33129       6.719027 72.99876       9.490039 75.67065       9.514285 77.03497 5.083683 78.44954 5.002862 -1.414574      7.132493 
1 1 1 -7  21 24 o 94.79348 3.066322 109.8276       7.073927 102.3357       10.72787 115.5912       9.409385 91.28416 4.839907 97.14988 3.982949 -5.865723      6.268060 
1 1 1 -7  21 25 o 105.1250 3.124662 135.0846       7.995820 136.7922       12.07036 133.7494       10.67362 105.5761 4.703381 104.4690 4.201212 1.107063       6.306503 
1 1 1 -7  21 26 o 45.22906 3.909865 25.20928       4.267112 26.92677       7.086921 24.23251       5.344496 46.32912 6.452032 44.16637 5.056745 2.162754       8.197523 
1 1 1 -7  21 27 o 122.0657 3.146457 182.1917       9.351671 200.7221       14.56469 169.1935       12.19827 127.8582 4.682425 117.4515 4.269004 10.40670       6.336363 
1 1 1 -7  21 28 o 16.75105 6.578007 2.036876       3.923537 -8.627047      10.05987 3.950032       4.260976 19.15425 8.908237 19.47310 7.020623 -0.3188591     11.34222 
1 1 1 -7  21 29 o 126.9933 3.170646 197.2206       9.812158 205.7909       14.99439 190.8020       12.97633 129.3415 4.765382 124.6517 4.278207 4.689873       6.404055 
1 1 1 -7  21 30 o 115.7862 3.148878 164.1638       8.876575 164.4184       13.36734 163.9629       11.87202 115.5100 4.759056 115.4868 4.225607 0.2320099E-01  6.364305 
1 1 1 -7  21 31 o 55.30921 3.662889 37.68619       4.909122 32.04890       7.655180 41.62378       6.397867 50.39837 6.375505 57.97035 4.565733 -7.571980      7.841746 
1 1 1 -7  21 32 o 43.63269 4.091397 23.63224       4.299557 23.45145       6.791517 23.75317       5.554350 42.81086 6.731916 43.46378 5.357330 -0.6529198     8.603469 
1 1 1 -7  21 33 o 73.24904 3.269759 66.02983       5.821805 67.79814       9.013715 64.76416       7.625789 73.72641 5.047454 72.26674 4.350367 1.459671       6.663519 
1 1 1 -7  21 34 o 26.59484 6.348158 9.282752       4.056938 6.959092       5.818509 11.48118       5.659545 23.93285 8.239583 29.34751 7.786224 -5.414654      11.33649 
1 1 1 -7  21 35 o 113.8091 3.184198 159.8039       8.822390 151.6227       12.93017 166.9304       12.06790 109.9658 4.836980 115.7417 4.286045 -5.775887      6.462706 
1 1 1 -7  21 36 o 47.28784 5.097490 28.56488       5.781416 29.72860       7.097635 26.27028       9.966481 47.71674 6.254302 42.87009 9.759732 4.846653       11.59175 
1 1 1 -7  21 37 o 53.71857 3.784390 36.24923       4.922302 37.21849       7.302645 35.44219       6.663544 53.45111 5.693993 52.37632 5.293334 1.074795       7.774377 
1 1 1 -7  21 38 o 18.82358 6.591230 4.459745       3.730885 -1.197435      5.404169 9.611358       5.157040 15.45644 6.930763 25.97807 7.639196 -10.52163      10.31469 
1 1 1 -7  21 39 o 38.53790 5.235364 19.79413       4.789647 9.325375       7.807111 26.11245       6.065175 25.17880 9.429973 43.92904 5.807881 -18.75023      11.07501 
1 1 1 -7  21 40 f 19.03388 6.734817 4.948796       3.902596 4.976245       5.795244 4.926019       5.279016 19.99679 7.949814 19.66640 7.657083 0.3303909      11.03768 
1 1 1 -7  21 41 o 20.56224 7.469057 6.314240       4.834267 8.921041       9.443770 5.388590       5.627490 23.38752 9.814629 19.81285 7.847638 3.574671       12.56632 
1 1 1 -7  21 42 o 16.23455 6.545601 3.062772       3.986061 6.249973       5.860041 0.3182409      5.437885 20.20145 8.006048 15.35881 6.914229 4.842643       10.57844 
1 1 1 -7  21 43 o 40.14159 5.668272 23.71175       5.390612 21.57292       6.689937 27.67131       9.102440 35.41482 7.947481 36.89889 9.912951 -1.484070      12.70547 
1 1 1 -7  21 44 o 19.24428 6.784980 6.282952       3.958153 10.86630       6.158483 3.057104       5.166594 23.01635 8.419538 16.17445 7.031949 6.841900       10.96982 
1 1 1 -7  21 45 o 11.36594 5.292987 -1.156838      3.569804 0.8498974      5.611839 -2.520778      4.626556 14.61227 6.746040 11.96003 5.705359 2.652244       8.835167 
1 1 1 -7  21 46 o 19.28414 6.818403 7.013980       3.999473 9.701710       6.130964 5.022942       5.276862 20.40490 8.155361 16.81707 7.207259 3.587831       10.88368 
1 1 1 -7  22 1  o 23.26180 5.636616 6.875764       3.161293 5.822934       4.533892 7.871915       4.410163 22.25439 7.269112 25.01200 6.974336 -2.757605      10.07380 
1 1 1 -7  22 2  o 99.25185 2.654835 120.1844       6.415375 121.2716       9.718767 119.3448       8.540439 99.61748 4.011703 98.85349 3.551062 0.7639923      5.357593 
1 1 1 -7  22 3  o 111.9020 3.066647 152.8084       8.354648 142.9064       15.79105 156.6577       9.845501 107.9689 6.025632 113.2732 3.571227 -5.304337      7.004421 
1 1 1 -7  22 4  o 192.0636 4.114323 450.1057       19.25660 457.3044       33.03440 446.4006       23.69969 193.2040 7.028111 191.1318 5.092847 2.072144       8.679368 
1 1 1 -7  22 5  o 228.7533 5.626791 639.3159       31.36637 0.000000       0.000000 639.3159       31.36637 ?        ?        228.7533 5.626791 0.000000       5.626791 
1 1 1 -7  22 6  o 99.00361 2.700298 119.5934       6.508682 131.9084       10.16855 111.0461       8.471442 103.8967 4.023860 95.34063 3.652981 8.556107       5.434678 
1 1 1 -7  22 7  o 156.2341 3.749071 297.7885       14.27367 305.0714       17.45679 283.0977       24.79335 158.0217 4.537968 151.9734 6.711257 6.048325       8.101488 
1 1 1 -7  22 8  o 224.0763 3.551310 612.5046       19.39191 594.7579       30.67718 624.3154       25.02623 220.5271 5.713251 226.1420 4.541279 -5.614868      7.298250 
1 1 1 -7  22 9  o 19.41556 6.482364 4.339374       3.599206 11.71576       6.317345 0.7943043      4.379506 30.42066 8.295043 16.27985 6.745936 14.14081       10.69184 
1 1 1 -7  22 10 f 189.8965 3.631552 439.9650       16.80526 418.6077       23.63870 461.7894       23.89584 185.0224 5.248101 194.3638 5.049389 -9.341354      7.282781 
1 1 1 -7  22 11 o 117.4753 3.134844 168.4443       8.966237 172.1934       13.19947 165.2322       12.21771 118.6609 4.573268 116.2573 4.320056 2.403572       6.291079 
1 1 1 -7  22 12 o 67.18263 3.012080 55.15963       4.918739 52.98602       8.528637 56.24295       6.020981 65.62217 5.380468 67.79292 3.658124 -2.170746      6.506251 
1 1 1 -7  22 13 o 77.75887 2.881642 73.84367       5.450975 68.63374       9.210148 76.65248       6.762559 74.77071 5.084999 79.18227 3.513417 -4.411560      6.180721 
1 1 1 -7  22 14 o 198.9422 3.290438 482.8659       15.95206 468.2439       25.42830 492.3547       20.48421 195.6268 5.338989 200.8065 4.186058 -5.179688      6.784385 
1 1 1 -7  22 15 o 137.9196 2.836792 232.0076       9.534313 242.4319       16.07975 226.3555       11.84023 140.7814 4.693594 136.1419 3.571969 4.639481       5.898203 
1 1 1 -7  22 16 o 172.1610 3.399974 361.7094       14.26417 349.2603       28.98540 365.6877       16.38562 168.5867 7.071071 173.0636 3.885269 -4.476822      8.068169 
1 1 1 -7  22 17 o 257.8357 4.377409 812.2755       27.50403 824.1818       39.68861 801.2743       38.15014 259.3367 6.280089 255.7437 6.121460 3.592972       8.769937 
1 1 1 -7  22 18 o 116.1461 3.611543 164.8578       10.20952 143.0937       17.45680 176.1720       12.58655 107.7951 6.678328 119.9950 4.311357 -12.19991      7.949080 
1 1 1 -7  22 19 o 63.50780 3.600137 49.40631       5.548810 57.68221       9.322993 44.86661       6.904972 68.39425 5.643895 60.38622 4.730046 8.008034       7.363890 
1 1 1 -7  22 20 o 79.76470 2.781818 77.72327       5.398962 70.61827       9.446280 81.17018       6.579514 75.77946 5.145848 81.47251 3.320915 -5.693047      6.124396 
1 1 1 -7  22 21 o 33.41354 4.265055 13.87002       3.393768 9.818470       6.600250 15.32620       3.956927 28.20915 8.720186 35.07573 4.751362 -6.866585      9.930614 
1 1 1 -7  22 22 o 129.1386 3.621432 203.9058       11.38527 210.7927       15.31059 195.3867       17.02848 131.1323 4.799317 126.1117 5.554579 5.020599       7.340763 
1 1 1 -7  22 23 o 153.4392 3.335651 287.5716       12.47249 287.5461       18.45117 287.5930       16.92500 153.1278 4.951137 153.2188 4.537946 -0.9103394E-01 6.716153 
1 1 1 -7  22 24 o 221.7177 3.958441 601.2243       21.38754 625.0276       31.66716 581.2598       29.00142 225.5188 5.766956 217.5667 5.474392 7.952148       7.951525 
1 1 1 -7  22 25 o 42.64408 4.216728 22.47498       4.324678 19.04040       7.547208 24.15403       5.276935 38.47255 8.294506 44.10315 4.997940 -5.630596      9.683916 
1 1 1 -7  22 26 f 121.1974 3.600650 179.8069       10.62255 180.9655       14.40806 178.4272       15.72301 121.3532 4.882088 120.3904 5.372836 0.9628906      7.259624 
1 1 1 -7  22 27 o 99.00127 3.567438 120.0665       8.592563 113.9073       17.27398 122.0915       9.904912 95.55432 7.477849 99.75131 4.083335 -4.196991      8.520085 
1 1 1 -7  22 28 o 99.34520 3.123588 120.7947       7.552604 122.6515       11.70689 119.4709       9.884795 99.79858 4.828045 98.63527 4.121520 1.163315       6.347987 
1 1 1 -7  22 29 o 29.56654 5.960908 11.18510       4.146398 13.13914       8.754689 10.62002       4.707915 32.17519 10.05867 28.68099 6.833600 3.494198       12.16038 
1 1 1 -7  22 30 o 146.8518 3.318033 264.1890       11.87397 282.4083       18.11585 250.4665       15.72208 151.2652 4.921098 142.5853 4.530550 8.679932       6.689028 
1 1 1 -7  22 31 o 89.39474 3.186578 98.07813       6.930706 93.08376       10.50720 101.9248       9.221220 86.62874 4.998469 90.90097 4.173923 -4.272232      6.512014 
1 1 1 -7  22 32 o 58.31570 3.573970 41.97170       5.054539 45.91430       8.285523 39.63474       6.379038 60.43198 5.693309 56.40274 4.683286 4.029240       7.372037 
1 1 1 -7  22 33 o 68.51507 3.704685 58.06439       6.162474 55.95035       8.600691 60.29472       8.834104 66.72081 5.334152 69.30180 5.270491 -2.580994      7.498750 
1 1 1 -7  22 34 o 39.02961 4.604294 19.23781       4.294998 23.32383       6.990352 16.75985       5.443730 42.12838 7.058538 35.78464 6.481136 6.343746       9.582697 
1 1 1 -7  22 35 o 75.96505 3.330391 71.52398       6.150188 66.52772       9.166694 75.61421       8.293997 72.36333 5.233624 77.62594 4.402557 -5.262604      6.839103 
1 1 1 -7  22 36 o 37.11405 6.108321 18.23589       5.332517 15.93232       6.267198 24.27754       10.14963 33.86765 7.760382 40.36901 10.28862 -6.501366      12.88717 
1 1 1 -7  22 37 f 10.52696 4.983050 -3.581464      3.396081 -1.645382      5.193953 -5.027324      4.488480 14.92171 6.733824 11.84400 5.641498 3.077706       8.784696 
1 1 1 -7  22 38 o 19.83306 6.904723 5.184855       4.090816 9.635625       7.612877 3.377951       4.850639 25.64581 9.364275 18.30639 7.274634 7.339420       11.85791 
1 1 1 -7  22 39 o 16.56748 6.481928 2.950505       3.797896 1.665239       5.615438 4.034061       5.155997 17.24688 7.413876 18.85434 7.497599 -1.607456      10.54417 
1 1 1 -7  22 40 o 12.20004 5.618971 -1.777828      3.860308 -3.024821      5.365556 -0.4397141     5.558137 13.71276 6.419713 15.40842 6.958528 -1.695654      9.467514 
1 1 1 -7  22 41 o 25.46005 7.258288 10.30317       4.722235 16.67259       9.115526 7.966810       5.520793 28.66694 10.27692 22.13760 7.990047 6.529345       13.01752 
1 1 1 -7  22 42 o 29.73395 6.983435 14.11699       4.973331 10.91836       6.370053 19.11052       7.959105 24.24238 8.601830 31.00459 9.574399 -6.762217      12.87092 
1 1 1 -7  22 43 o 16.26753 6.507742 3.660772       3.907594 5.358421       5.755792 2.209365       5.322010 18.43968 7.694820 15.87067 7.010835 2.569011       10.40971 
1 1 1 -7  22 44 o 17.72477 6.714177 5.292485       3.982861 2.343737       5.897115 7.765762       5.400788 15.82091 7.154026 19.96820 7.753213 -4.147288      10.54952 
1 1 1 -7  22 45 o 21.01243 6.958185 8.269290       4.148881 10.47108       6.220444 6.504919       5.568370 21.33576 8.310484 18.21116 7.581544 3.124598       11.24918 
1 1 1 -7  23 1  o 89.38573 2.748502 97.51691       5.979764 91.38052       8.830430 102.7142       8.126665 86.42300 4.205544 91.68164 3.644687 -5.258636      5.565101 
1 1 1 -7  23 2  o 184.1744 3.550782 413.8177       15.93637 374.6805       29.71735 429.6161       18.88084 174.7967 6.990653 187.6156 4.129677 -12.81898      8.119327 
1 1 1 -7  23 3  o 334.0598 6.074912 1364.729       49.45387 1312.609       82.81178 1393.620       61.65516 326.2976 10.42798 337.2534 7.501998 -10.95581      12.84612 
1 1 1 -7  23 4  f 94.66827 2.701953 109.3667       6.226930 106.2786       9.316749 111.8599       8.371339 93.22521 4.111159 95.68591 3.596537 -2.460693      5.462299 
1 1 1 -7  23 5  o 259.3471 3.874338 820.7827       24.48585 850.2798       39.16558 801.8556       31.37303 263.6714 6.095446 256.2070 5.024923 7.464447       7.899641 
1 1 1 -7  23 6  o 171.1764 3.040010 357.3599       12.68104 400.5114       20.82767 331.9402       15.98556 181.0341 4.725152 164.9203 3.977566 16.11371       6.176414 
1 1 1 -7  23 7  o 29.08200 4.840491 10.60626       3.309913 8.267906       4.743578 12.82503       4.620687 25.65080 7.262030 31.84259 6.177652 -6.191786      9.534174 
1 1 1 -7  23 8  o 155.7358 3.847444 295.9872       14.60148 308.8176       25.76097 289.9141       17.72344 158.6839 6.676747 153.9954 4.728453 4.688477       8.181518 
1 1 1 -7  23 9  o 326.6400 5.189269 1303.862       41.30586 1367.903       60.39480 1247.579       56.61852 334.0501 7.419110 319.0553 7.282097 14.99481       10.39577 
1 1 1 -7  23 10 o 305.1559 4.912368 1137.728       36.52991 1144.750       52.26234 1131.020       51.08015 305.6618 7.016355 303.8514 6.898501 1.810394       9.839642 
1 1 1 -7  23 11 o 11.91879 5.375419 -1.758085      3.303986 2.683583       6.131201 -3.575745      3.922193 20.55489 8.175268 11.96850 5.564965 8.586391       9.889583 
1 1 1 -7  23 12 o 154.8931 2.990627 292.6485       11.28835 316.4319       19.12970 279.9425       13.98227 160.8438 4.886206 151.3956 3.792890 9.448135       6.185550 
1 1 1 -7  23 13 o 210.2690 3.417931 539.5225       17.51356 538.6507       28.29599 540.0638       22.29786 209.7704 5.540192 210.2763 4.351476 -0.5058899     7.044790 
1 1 1 -7  23 14 o 152.5526 3.374050 284.0009       12.54317 276.4899       17.94962 291.1689       17.53508 150.3126 4.906886 154.2863 4.669218 -3.973709      6.773413 
1 1 1 -7  23 15 o 114.1376 3.206083 159.0920       8.908595 156.0576       12.98497 161.7905       12.24489 112.8918 4.730486 114.9905 4.377747 -2.098709      6.445322 
1 1 1 -7  23 16 o 206.7757 3.838636 522.1304       19.34250 535.2437       28.10969 510.3375       26.65694 209.0339 5.523112 204.1402 5.363173 4.893677       7.698597 
1 1 1 -7  23 17 o 248.1181 4.233685 752.2863       25.59842 805.8798       55.11591 737.5459       28.90515 255.4058 8.868896 245.5680 4.830225 9.837799       10.09893 
1 1 1 -7  23 18 o 177.3282 3.138094 383.7941       13.56063 382.8555       22.31492 384.3437       17.07518 176.7772 5.185644 177.3672 3.950536 -0.5900116     6.519022 
1 1 1 -7  23 19 o 162.0617 3.022793 320.5500       11.93781 316.6833       19.68625 322.7989       15.01315 160.7652 5.031180 162.5512 3.790056 -1.786011      6.298992 
1 1 1 -7  23 20 o 36.66252 4.135291 16.63899       3.630188 22.50236       7.290018 14.70562       4.186122 42.15750 7.363916 34.27348 5.172991 7.884022       8.999283 
1 1 1 -7  23 21 o 40.46003 3.753886 20.17554       3.658999 28.02373       7.289411 17.53200       4.230593 47.31986 6.492379 37.55300 4.727494 9.766865       8.031200 
1 1 1 -7  23 22 f 132.9480 3.646779 216.1655       11.80367 229.3703       15.89291 199.9213       17.62732 136.7723 4.775690 127.5078 5.687324 9.264503       7.426497 
1 1 1 -7  23 23 o 93.66257 3.190756 107.2788       7.272123 97.11400       11.11283 114.8917       9.617210 88.84288 5.155077 96.82310 4.085178 -7.980225      6.577500 
1 1 1 -7  23 24 o 138.1441 3.264343 233.1836       10.98915 248.6599       16.89947 221.8450       14.46500 142.3251 4.879760 134.5144 4.418790 7.810699       6.583142 
1 1 1 -7  23 25 f 159.4963 3.943630 311.3788       15.32791 296.9710       28.53253 317.2235       18.17288 154.6355 7.594965 160.7794 4.643147 -6.143906      8.901815 
1 1 1 -7  23 26 o 83.99071 3.631904 86.47974       7.416074 106.5423       16.51732 81.41416       8.299675 92.41763 7.395808 81.40462 4.198029 11.01300       8.504200 
1 1 1 -7  23 27 o 110.1842 3.567925 148.7613       9.567491 171.4819       13.83923 127.9610       13.24150 118.0414 4.821214 101.8154 5.355719 16.22606       7.206097 
1 1 1 -7  23 28 o 42.04295 4.662385 21.99233       4.696597 26.65736       10.46153 20.81477       5.256039 45.06736 9.805149 40.73521 5.429954 4.332153       11.20827 
1 1 1 -7  23 29 f 93.17406 3.132643 106.4034       7.102710 111.5466       11.22795 102.9722       9.170877 95.01289 4.865534 91.45986 4.125377 3.553024       6.379041 
1 1 1 -7  23 30 o 94.93561 3.160673 110.5752       7.301952 114.3885       11.43600 107.9505       9.487773 96.10239 4.899360 93.56233 4.171773 2.540062       6.434860 
1 1 1 -7  23 31 o 39.72799 4.511213 19.74653       4.290190 7.427298       6.993767 27.17906       5.432349 25.36972 9.011986 46.60298 4.854492 -21.23326      10.23631 
1 1 1 -7  23 32 o 55.94594 4.021228 38.86490       5.445736 39.97264       8.116865 37.95809       7.343887 56.10170 6.031761 54.81723 5.575082 1.284473       8.213628 
1 1 1 -7  23 33 o 36.27353 4.656407 16.64934       4.021195 20.71044       7.122517 14.74923       4.871922 39.43182 7.688563 33.64631 6.169194 5.785507       9.857635 
1 1 1 -7  23 34 o 56.98780 3.615161 40.41140       4.994605 37.57979       7.775412 42.40059       6.516935 53.96722 6.014398 57.99136 4.650470 -4.024143      7.602622 
1 1 1 -7  23 35 o 15.26161 6.726127 -0.6991264     4.871630 0.9946995      5.820351 -4.662093      8.902767 17.85512 7.608452 18.39659 8.494470 -0.5414734     11.40371 
1 1 1 -7  23 36 o 10.61034 4.997303 -3.269063      3.337193 -5.313519      5.185657 -1.823807      4.360007 12.91747 6.127209 13.50900 6.125708 -0.5915279     8.664121 
1 1 1 -7  23 37 o 48.89209 3.950152 30.45773       4.666356 27.17210       6.918890 33.19929       6.320129 44.51130 6.576431 50.25381 5.237626 -5.742512      8.407269 
1 1 1 -7  23 38 f 18.21371 6.944582 3.948651       4.278033 5.123295       7.614048 3.406764       5.171504 21.48897 8.898766 18.38477 7.440214 3.104202       11.59935 
1 1 1 -7  23 39 o 13.93064 6.042485 0.5244893      3.796790 -0.5458275E-01 5.520212 1.044363       5.230443 15.70631 7.026623 16.14067 7.045354 -0.4343586     9.950399 
1 1 1 -7  23 40 o 14.00825 6.152277 0.4225479      4.043169 0.9348326      8.086846 0.2518150      4.668551 18.21628 8.292508 14.67324 6.519649 3.543039       10.54853 
1 1 1 -7  23 41 o 24.48366 7.272933 9.781828       4.655022 11.67448       6.108173 7.159649       7.189639 25.55888 8.441971 21.01820 8.670050 4.540676       12.10110 
1 1 1 -7  23 42 o 22.18285 6.878259 8.168900       4.102835 5.610627       6.071640 10.31871       5.565865 18.94289 7.903840 23.65186 8.061198 -4.708967      11.28954 
1 1 1 -7  23 43 o 15.07238 6.311795 2.742400       3.893106 -1.559586      5.777541 6.320273       5.268912 13.83521 6.534170 18.85490 7.552030 -5.019694      9.986418 
1 1 1 -7  23 44 o 12.74401 5.811513 0.1186108      3.993831 -5.495396      6.162614 4.183928       5.244157 12.40402 6.072522 16.57573 7.145373 -4.171707      9.377199 
1 1 1 -7  24 1  o 146.5505 3.721582 262.2654       13.28004 283.3200       23.20754 252.0145       16.19333 152.0206 6.278069 143.5678 4.634602 8.452835       7.803441 
1 1 1 -7  24 2  o 157.5716 4.747417 303.5681       18.20857 0.000000       0.000000 303.5681       18.20857 ?        ?        157.5716 4.747417 0.000000       4.747417 
1 1 1 -7  24 3  o 126.9734 4.465405 197.1243       13.79536 173.1322       18.08400 230.5211       21.33601 118.7764 6.270027 137.0831 6.404650 -18.30671      8.962855 
1 1 1 -7  24 4  o 68.77853 3.830660 57.91227       6.395042 58.10564       11.04024 57.81463       7.845223 68.56226 6.692934 68.63626 4.719183 -0.7400513E-01 8.189386 
1 1 1 -7  24 5  o 138.5293 3.678619 234.3503       12.40733 219.0115       20.74890 242.8879       15.47985 133.6074 6.391310 140.9530 4.512490 -7.345642      7.823772 
1 1 1 -7  24 6  o 288.0740 5.444992 1014.620       38.22411 1011.264       65.69094 1016.338       47.00016 286.4709 9.422806 288.0654 6.695332 -1.594543      11.55927 
1 1 1 -7  24 7  o 155.6479 3.858989 295.7026       14.63703 307.1729       25.62020 290.1448       17.83404 158.2260 6.659487 154.0353 4.756791 4.190643       8.183876 
1 1 1 -7  24 8  o 203.1429 5.349193 504.8954       26.45744 482.5182       36.31362 530.2136       38.62632 198.1839 7.532800 207.7365 7.643207 -9.552597      10.73134 
1 1 1 -7  24 9  o 59.90150 4.998633 44.15713       7.230223 33.26722       9.734867 57.55467       10.79768 51.45065 8.026179 68.23580 6.574859 -16.78515      10.37537 
1 1 1 -7  24 10 o 180.6472 3.602217 398.2829       15.85759 396.4586       22.74662 400.0078       22.11860 179.9978 5.191196 180.8268 5.024351 -0.8289185     7.224446 
1 1 1 -7  24 11 o 145.4376 3.351772 258.1146       11.87920 254.5049       17.15723 261.4383       16.46368 144.2129 4.889172 146.1990 4.626935 -1.986115      6.731458 
1 1 1 -7  24 12 o 37.38953 5.137778 17.41369       4.557596 10.55766       6.792637 23.02746       6.146517 29.17135 8.813629 42.95002 6.039161 -13.77867      10.68417 
1 1 1 -7  24 13 o 215.2887 4.557418 566.4540       23.90981 582.8118       30.04887 538.2236       39.47504 218.1243 5.657895 209.1155 7.759865 9.008774       9.603503 
1 1 1 -7  24 14 o 153.0862 3.002040 285.9407       11.19924 290.7286       18.61784 283.2260       14.01924 154.1000 4.964297 152.2967 3.777442 1.803223       6.238054 
1 1 1 -7  24 15 o 285.6104 4.200251 996.7595       29.23380 952.9926       45.84102 1026.760       37.95281 278.6431 6.751029 289.6136 5.377605 -10.97052      8.631050 
1 1 1 -7  24 16 o 56.45728 4.036485 39.14181       5.516766 0.000000       0.000000 39.14181       5.516766 ?        ?        56.45728 4.036485 0.000000       4.036485 
1 1 1 -7  24 17 o 55.09462 3.294640 37.18871       4.403165 39.29726       8.000894 36.27266       5.273602 56.30962 5.919086 54.33646 4.010996 1.973164       7.150082 
1 1 1 -7  24 18 o 123.3061 2.840909 185.5418       8.536468 213.0537       15.30830 173.1259       10.28384 131.8630 4.771826 119.0053 3.550085 12.85766       5.947557 
1 1 1 -7  24 19 o 137.6372 3.180865 231.2957       10.66884 220.8626       22.36562 234.3691       12.13896 133.8225 6.881396 138.4623 3.600661 -4.639847      7.766490 
1 1 1 -7  24 20 o 32.84495 4.619372 13.46016       3.595302 22.48579       7.341552 10.61269       4.123620 42.10963 7.425632 28.86796 6.055344 13.24167       9.581608 
1 1 1 -7  24 21 o 115.5376 3.086632 163.1212       8.682706 153.2119       13.28134 170.5175       11.47430 111.7236 4.890060 118.0158 3.995551 -6.292213      6.314833 
1 1 1 -7  24 22 o 84.90541 2.805750 88.10416       5.797271 89.60026       10.35025 87.42023       6.997995 85.34539 4.998505 84.51419 3.404849 0.8311996      6.047978 
1 1 1 -7  24 23 o 57.15466 3.680145 40.11217       5.098452 37.09916       8.306035 41.93375       6.458298 54.52237 6.371470 58.32268 4.580803 -3.800304      7.847253 
1 1 1 -7  24 24 o 61.95173 3.357596 47.05868       5.050006 45.83794       13.00377 47.27549       5.480129 59.94202 9.195342 62.06084 3.639549 -2.118813      9.889421 
1 1 1 -7  24 25 o 91.63749 3.608516 102.9091       8.042445 88.53441       15.80713 107.9298       9.341981 84.07263 7.804573 93.77275 4.098040 -9.700119      8.815060 
1 1 1 -7  24 26 o 79.06363 3.295103 76.60191       6.334740 78.47985       10.39117 75.49120       7.991465 79.65473 5.384891 78.34767 4.201024 1.307060       6.829762 
1 1 1 -7  24 27 o 49.27739 4.290502 30.03742       5.100876 28.16634       11.21179 30.52579       5.728014 46.23363 10.22314 49.58696 4.800201 -3.353333      11.29400 
1 1 1 -7  24 28 o 64.85633 3.579014 51.72782       5.634622 58.00116       9.430292 48.24466       7.026878 68.22007 5.725301 62.42650 4.652555 5.793568       7.377353 
1 1 1 -7  24 29 o 31.22944 5.832083 12.48837       4.275196 16.40203       7.388286 10.51833       5.241912 35.25476 8.662847 28.40929 7.472904 6.845470       11.44068 
1 1 1 -7  24 30 o 56.55142 3.641176 39.48815       4.991225 41.61689       8.607661 38.40981       6.126328 57.34558 6.261155 55.56094 4.564976 1.784645       7.748617 
1 1 1 -7  24 31 o 53.21054 3.999790 35.16164       5.148496 42.92504       8.416036 30.51877       6.508412 58.17207 6.023936 49.11947 5.533498 9.052601       8.179694 
1 1 1 -7  24 32 o 55.50882 3.731509 38.25202       5.018248 39.84897       8.166596 37.28321       6.360837 55.82136 6.102823 54.45483 4.843877 1.366531       7.791508 
1 1 1 -7  24 33 o 51.92680 3.788578 33.63111       4.761080 33.13959       7.538155 33.95731       6.140980 50.56591 6.250388 51.77304 4.926724 -1.207134      7.958641 
1 1 1 -7  24 34 o 69.77724 4.363096 61.33612       7.381858 62.64834       8.908777 58.46148       13.18581 70.00892 5.260374 65.26894 8.491288 4.739983       9.988668 
1 1 1 -7  24 35 o 55.09383 3.810605 38.19896       5.084509 27.87927       7.526343 46.86266       6.896087 45.30468 7.046130 60.55725 4.710064 -15.25257      8.475414 
1 1 1 -7  24 36 o 50.02524 3.971499 31.83878       4.801790 30.17739       7.328627 33.08854       6.356225 47.04233 6.572009 50.21732 5.272640 -3.174992      8.425677 
1 1 1 -7  24 37 o 48.90838 4.539022 31.16429       5.348076 22.07559       9.846691 34.96727       6.369443 36.03201 10.54500 51.35589 5.159323 -15.32389      11.73949 
1 1 1 -7  24 38 o 29.05042 5.916702 11.90952       4.046147 16.79062       6.220058 8.328964       5.327339 33.03531 7.844081 23.35422 7.887362 9.681097       11.12385 
1 1 1 -7  24 39 o 14.50223 6.084420 1.503855       3.628050 7.298544       5.798088 -2.225001      4.651120 21.73899 8.129664 13.09768 6.079758 8.641313       10.15160 
1 1 1 -7  24 40 f 14.19045 6.248175 0.5897229      4.194677 -5.123476      7.629538 3.064836       5.021761 15.01357 7.205998 17.04321 7.154899 -2.029637      10.15475 
1 1 1 -7  24 41 o 24.35816 6.964342 9.734626       4.341318 9.417559       6.381954 10.00771       5.922824 22.48272 8.503032 23.31102 8.292038 -0.8282948     11.87685 
1 1 1 -7  24 42 o 17.07072 6.681981 4.443610       4.037532 5.126511       6.264892 3.958478       5.280373 18.20033 7.827398 17.02109 7.249791 1.179245       10.66900 
1 1 1 -7  24 43 o 18.01654 6.745546 5.577062       3.994263 7.332639       6.328491 4.414665       5.149529 19.23646 8.050910 16.90186 7.177744 2.334599       10.78597 
1 1 1 -7  24 44 o 20.07770 7.413322 8.058072       4.792507 12.66924       6.342011 1.919429       7.317415 23.28293 8.539694 15.79753 7.427771 7.485394       11.31804 
1 1 1 -7  25 1  o 108.6095 3.723583 144.1530       9.840610 0.000000       0.000000 144.1530       9.840610 ?        ?        108.6095 3.723583 0.000000       3.723583 
1 1 1 -7  25 2  o 146.2568 3.310996 261.0045       11.80079 272.7114       16.56002 248.9262       16.82070 149.3385 4.555764 142.6369 4.846268 6.701614       6.651413 
1 1 1 -7  25 3  o 84.30846 2.805743 86.78912       5.756384 82.71703       8.454955 90.30755       7.859169 82.19105 4.235630 85.93148 3.762201 -3.740433      5.665220 
1 1 1 -7  25 4  o 318.3889 4.531420 1238.423       35.15834 1219.588       54.68537 1251.693       45.90264 315.3495 7.116115 319.7996 5.890113 -4.450165      9.237560 
1 1 1 -7  25 5  o 85.99819 2.784962 90.29762       5.828699 93.04544       8.719526 88.07790       7.836976 87.19411 4.115256 84.85764 3.799481 2.336464       5.601017 
1 1 1 -7  25 6  o 105.0091 2.774235 134.5872       7.092932 147.9015       10.85527 124.6678       9.369729 109.9811 4.057249 100.9832 3.814373 8.997864       5.568726 
1 1 1 -7  25 7  o 280.3556 5.349958 961.3890       36.55070 916.2118       61.23026 986.3994       45.55814 272.5027 9.233938 283.6967 6.589852 -11.19394      11.34424 
1 1 1 -7  25 8  o 158.5682 3.402382 306.8555       13.14726 296.6292       25.74105 310.4648       15.29234 155.3832 6.814650 159.4549 3.935499 -4.071686      7.869410 
1 1 1 -7  25 9  o 117.7236 3.171775 169.2258       9.090884 167.0052       18.06146 169.9792       10.52071 116.5664 6.382694 117.9433 3.664910 -1.376900      7.360051 
1 1 1 -7  25 10 o 200.4847 3.759426 490.7556       18.36702 455.1273       35.68502 503.5956       21.42249 192.3051 7.629954 203.0220 4.330027 -10.71696      8.772988 
1 1 1 -7  25 11 o 213.4449 3.502461 556.1360       18.21777 550.2916       29.31584 559.8129       23.25271 211.9263 5.681635 214.0268 4.458300 -2.100464      7.222009 
1 1 1 -7  25 12 o 26.30134 5.969561 8.811662       3.738203 7.368992       6.699249 9.463970       4.504734 25.64045 8.840661 27.24128 6.805924 -1.600830      11.15697 
1 1 1 -7  25 13 o 38.13640 4.417117 18.01329       4.029197 20.27565       7.415671 17.06566       4.799430 39.90682 7.905129 36.93626 5.499596 2.970562       9.629986 
1 1 1 -7  25 14 o 165.8351 3.106234 335.6414       12.55297 349.9409       21.06955 327.7723       15.62983 169.0151 5.121473 163.8000 3.915652 5.215073       6.446846 
1 1 1 -7  25 15 o 241.3618 5.863982 714.2000       34.49032 0.000000       0.000000 714.2000       34.49032 ?        ?        241.3618 5.863982 0.000000       5.863982 
1 1 1 -7  25 16 o 222.3666 3.578920 603.9384       19.39356 613.2887       31.72918 598.3619       24.50354 223.5623 5.829010 221.1742 4.546303 2.388168       7.392309 
1 1 1 -7  25 17 o 136.9073 3.236789 228.8580       10.79884 259.1964       24.43893 221.4973       12.03779 144.9966 6.936651 134.5976 3.673495 10.39894       7.849311 
1 1 1 -7  25 18 o 102.4677 2.857459 128.2512       7.128187 111.7845       11.93370 137.3852       8.887946 95.37993 5.153447 105.9981 3.445441 -10.61813      6.199119 
1 1 1 -7  25 19 o 100.9493 2.854077 124.4923       7.014054 118.4503       12.04713 127.5907       8.627024 98.19189 5.051663 102.1358 3.471191 -3.943916      6.129312 
1 1 1 -7  25 20 o 110.6485 3.478104 149.7531       9.366652 175.6470       19.24737 141.7178       10.72191 119.2573 6.649260 107.5544 4.098292 11.70287       7.810803 
1 1 1 -7  25 21 o 88.24230 3.286748 95.27113       7.055369 89.74046       10.97270 99.16946       9.212206 85.35155 5.301702 89.91369 4.216119 -4.562134      6.773751 
1 1 1 -7  25 22 o 129.4118 3.739424 205.0268       11.78037 225.7804       23.33755 197.9306       13.64659 134.9903 7.119587 127.0319 4.415052 7.958405       8.377423 
1 1 1 -7  25 23 o 177.9668 3.533894 387.3824       15.32600 367.3023       32.52602 393.1129       17.37581 171.8710 7.786126 179.1870 3.979260 -7.315948      8.744041 
1 1 1 -7  25 24 o 105.3265 2.844728 135.6331       7.294854 126.7429       12.83888 139.8715       8.864800 101.4014 5.213235 106.8820 3.407877 -5.480545      6.228278 
1 1 1 -7  25 25 o 170.0875 3.132489 353.8090       12.98369 351.8073       21.88964 354.8954       16.12686 168.9326 5.323921 170.1773 3.888768 -1.244766      6.592925 
1 1 1 -7  25 26 o 52.54264 4.265399 34.11948       5.414518 16.49333       11.51020 39.12827       6.135794 35.97978 11.56875 56.24557 4.514462 -20.26579      12.41839 
1 1 1 -7  25 27 o 62.43362 3.548303 47.94458       5.376302 52.45290       9.302832 45.68372       6.587857 64.78024 5.959749 60.76768 4.480225 4.012558       7.455938 
1 1 1 -7  25 28 o 49.14476 3.910622 29.87636       4.644781 32.26420       8.301125 28.78804       5.604184 50.31006 6.956873 48.03979 4.853628 2.270275       8.482676 
1 1 1 -7  25 29 o 53.52892 3.801100 35.44303       4.926057 31.82298       8.588607 37.21772       6.013505 49.70328 7.308993 54.68503 4.553854 -4.981754      8.611560 
1 1 1 -7  25 30 o 120.1438 3.650447 178.0516       10.67529 204.5581       15.47065 153.9589       14.74943 128.1287 4.964191 110.8622 5.476486 17.26649       7.391556 
1 1 1 -7  25 31 o 85.86279 3.293892 90.96859       6.879300 98.05573       11.05083 86.48442       8.790221 88.36103 5.154515 83.33104 4.343690 5.029991       6.740673 
1 1 1 -7  25 32 o 53.62294 3.750026 35.82855       4.869394 37.69686       8.141541 34.78801       6.075903 53.95717 6.310939 52.46491 4.805643 1.492256       7.932349 
1 1 1 -7  25 33 o 47.37197 5.263583 28.82349       5.973834 27.09364       7.213288 32.60038       10.65850 45.18489 6.758220 47.91836 9.463534 -2.733467      11.62893 
1 1 1 -7  25 34 o 14.35124 6.522563 -2.152493      4.978119 -0.6267341     5.984518 -5.579628      8.969161 16.79459 7.425981 17.90899 8.356599 -1.114403      11.17935 
1 1 1 -7  25 35 f 77.73589 3.342106 75.70084       6.316291 76.00192       9.620141 75.47269       8.374095 76.43359 5.195778 76.77714 4.495460 -0.3435516     6.870610 
1 1 1 -7  25 36 o 13.15079 5.913924 -1.083198      3.966337 4.173279       8.304378 -2.636695      4.514555 21.51237 9.124516 13.02446 6.026289 8.487914       10.93494 
1 1 1 -7  25 37 o 33.83895 5.024790 15.43763       4.017910 19.14717       6.434653 13.06699       5.143974 35.69130 7.629501 29.63536 7.195774 6.055937       10.48754 
1 1 1 -7  25 38 o 16.31388 6.364465 3.086797       3.652934 4.501814       5.872977 2.193948       4.665157 19.26356 7.879037 16.35211 6.882362 2.911449       10.46165 
1 1 1 -7  25 39 o 23.23333 7.077577 8.505693       4.367859 12.45711       8.186303 6.933104       5.164393 25.57321 9.639530 21.00699 7.705964 4.566227       12.34109 
1 1 1 -7  25 40 o 32.76631 6.533252 16.54610       5.033569 19.77362       6.761810 12.53462       7.538428 33.66849 8.296031 25.01695 9.286510 8.651545       12.45245 
1 1 1 -7  25 41 o 18.42873 6.787323 5.464995       4.012995 2.407753       6.046340 7.872054       5.365016 16.49523 7.368524 20.84149 7.814783 -4.346268      10.74086 
1 1 1 -7  25 42 o 13.82325 6.017989 1.544526       3.794926 0.4943288      5.777707 2.341366       5.032754 14.78217 6.831757 15.40339 6.810424 -0.6212177     9.646490 
1 1 1 -7  25 43 o 26.55889 7.735805 13.77464       5.310248 9.865585       6.551426 21.26189       9.066938 20.78278 8.387279 27.13170 10.16218 -6.348917      13.17635 
1 1 1 -7  26 1  o 208.7559 3.428208 531.9073       17.43982 535.8257       27.15712 529.1572       22.75100 209.1997 5.331390 208.0872 4.486616 1.112518       6.968030 
1 1 1 -7  26 2  o 69.84461 3.257267 59.66042       5.528719 63.93301       7.525899 54.65132       8.148773 72.21244 4.296133 66.65861 5.054155 5.553833       6.633343 
1 1 1 -7  26 3  o 199.2574 3.330557 484.5530       16.17214 493.1927       25.31699 478.5975       21.01959 200.7287 5.179996 197.9146 4.358232 2.814102       6.769530 
1 1 1 -7  26 4  o 140.3009 3.195388 240.2035       10.92497 246.4342       15.23241 233.6032       15.67768 141.9448 4.408998 138.1649 4.663056 3.779877       6.417426 
1 1 1 -7  26 5  o 159.0309 3.362166 308.6714       13.02977 296.2283       17.60823 323.7312       19.37146 155.6051 4.648824 162.6393 4.893221 -7.034210      6.749457 
1 1 1 -7  26 6  o 112.5165 4.460558 154.9555       12.20619 147.7434       16.60322 163.4382       18.00634 109.6222 6.241025 115.2840 6.434981 -5.661827      8.964339 
1 1 1 -7  26 7  o 250.1996 3.810455 764.4299       23.23269 728.6452       35.33447 791.6816       30.83518 243.8880 5.945275 254.4232 4.973404 -10.53514      7.751196 
1 1 1 -7  26 8  o 120.1511 3.219700 176.3083       9.418631 168.5654       18.15929 179.1578       11.01625 117.0774 6.389086 121.0702 3.738362 -3.992775      7.402416 
1 1 1 -7  26 9  o 135.6946 3.265900 224.7374       10.79945 214.3149       21.36154 228.3159       12.51684 131.9897 6.662900 136.6811 3.761517 -4.691437      7.651356 
1 1 1 -7  26 10 o 174.1649 4.078121 370.6084       17.30840 418.8991       32.07381 350.7675       20.55888 184.5087 7.146932 169.2513 4.990059 15.25739       8.716612 
1 1 1 -7  26 11 o 147.0630 3.328752 264.0153       11.92947 226.3868       22.70662 278.3611       14.02029 135.5916 6.894640 150.9134 3.815413 -15.32184      7.879940 
1 1 1 -7  26 12 o 204.8939 3.440364 512.5884       17.17788 499.8499       27.61056 520.6328       21.94137 201.9057 5.617107 206.3649 4.363067 -4.459183      7.112541 
1 1 1 -7  26 13 o 107.9176 3.266136 142.3087       8.579511 127.4667       19.33249 145.9487       9.573934 101.4112 7.884783 109.2570 3.600797 -7.845848      8.668077 
1 1 1 -7  26 14 o 247.5155 4.281918 749.0828       25.82717 728.9341       52.79178 755.4226       29.61300 242.5863 8.945576 248.4285 4.891532 -5.842148      10.19561 
1 1 1 -7  26 15 o 142.6431 2.985091 248.3590       10.37635 252.7461       17.29337 245.8910       12.97067 143.5905 4.949570 141.8098 3.756666 1.780746       6.213758 
1 1 1 -7  26 16 o 124.2546 2.920845 188.4539       8.844172 171.7813       14.57148 198.1783       11.12839 118.3131 5.065721 127.3120 3.590549 -8.998978      6.209152 
1 1 1 -7  26 17 o 149.0859 3.014577 271.3586       10.95214 269.5051       18.32541 272.3885       13.66014 148.2194 5.081071 149.2394 3.759079 -1.020020      6.320439 
1 1 1 -7  26 18 o 72.49651 3.572051 64.38398       6.291171 61.55073       9.774905 66.38750       8.219901 70.57648 5.732831 73.48890 4.613232 -2.912422      7.358482 
1 1 1 -7  26 19 o 103.5219 3.747008 131.2052       9.437047 125.6454       12.55765 138.4191       14.30429 101.0918 5.114104 106.0353 5.555164 -4.943573      7.550756 
1 1 1 -7  26 20 o 96.44838 3.724705 113.9335       8.737875 86.91010       16.05160 125.3136       10.41648 83.38019 7.997808 101.0823 4.238133 -17.70211      9.051336 
1 1 1 -7  26 21 o 107.5017 3.145741 141.3396       8.232028 133.7215       18.55241 143.2072       9.185822 103.6823 7.391236 108.1637 3.489546 -4.481392      8.173573 
1 1 1 -7  26 22 o 90.34380 3.488147 99.97702       7.665007 0.000000       0.000000 99.97702       7.665007 ?        ?        90.34380 3.488147 0.000000       3.488147 
1 1 1 -7  26 23 o 149.7632 3.008497 274.1461       10.97971 299.9445       19.41286 262.0118       13.31379 156.1090 5.109886 146.2392 3.739021 9.869766       6.331762 
1 1 1 -7  26 24 o 154.8800 3.030936 293.3392       11.43953 317.3066       20.16707 281.9691       13.89044 160.4514 5.164511 151.7015 3.757424 8.749939       6.386737 
1 1 1 -7  26 25 o 17.35460 6.182886 3.223233       3.294187 -0.1514766     10.08279 3.626502       3.485458 23.03416 9.918422 18.14633 6.369493 4.887829       11.78752 
1 1 1 -7  26 26 o 73.23155 2.954124 65.74369       5.261031 61.29023       9.943115 67.47526       6.200014 70.06793 5.877385 74.11121 3.442395 -4.043282      6.811295 
1 1 1 -7  26 27 o 103.8198 2.844926 132.0748       7.190809 122.9897       12.89236 136.1774       8.663584 99.47484 5.337975 105.2996 3.380631 -5.824783      6.318437 
1 1 1 -7  26 28 o 19.46162 6.606993 4.460543       3.738401 8.236271       7.501699 3.213063       4.311974 26.45598 9.339605 18.46494 6.988003 7.991043       11.66449 
1 1 1 -7  26 29 o 95.75747 3.293858 112.9132       7.674791 113.8574       12.37358 112.3229       9.784294 95.34497 5.346934 95.18313 4.228818 0.1618423      6.817082 
1 1 1 -7  26 30 o 48.15823 4.344617 29.03581       5.043913 30.26789       8.200026 28.28590       6.397318 48.10249 7.217884 47.08325 5.690983 1.019241       9.191580 
1 1 1 -7  26 31 o 44.52080 4.585398 25.03882       4.903739 32.09675       8.208777 21.12258       6.114692 49.39627 7.016588 40.14934 6.469532 9.246929       9.543969 
1 1 1 -7  26 32 o 77.92769 4.464147 76.50509       8.442000 82.10095       10.38563 65.60705       14.49351 80.17289 5.346358 68.97641 8.824418 11.19648       10.31765 
1 1 1 -7  26 33 o 24.21336 7.783272 7.988164       5.210211 7.040250       6.390514 9.867487       8.998122 23.56514 8.583426 27.17158 10.13433 -3.606443      13.28081 
1 1 1 -7  26 34 o 55.47373 3.802955 38.91540       5.109866 42.63664       8.247871 36.59736       6.509657 56.53651 6.082101 53.02795 5.100357 3.508560       7.937606 
1 1 1 -7  26 35 f 10.46727 5.023857 -4.659873      3.708068 -9.526880      7.982673 -3.320753      4.187232 14.86581 7.193590 12.08269 5.661275 2.783117       9.154113 
1 1 1 -7  26 36 o 17.47742 6.433761 3.835437       3.605054 0.8134293      5.644072 5.917996       4.685365 16.62980 7.287302 20.59966 7.369885 -3.969858      10.36436 
1 1 1 -7  26 37 o 23.35453 6.470580 8.064795       3.809379 9.804247       6.283851 7.054127       4.789870 24.51207 8.556106 21.62538 7.474526 2.886696       11.36114 
1 1 1 -7  26 38 o 16.80066 6.597697 3.456555       3.947169 0.9472902      7.452262 4.434997       4.653529 17.68044 8.013818 18.28487 7.168774 -0.6044312     10.75233 
1 1 1 -7  26 39 o 21.92341 7.294785 7.881736       4.558631 11.29389       6.304540 4.143048       6.599312 24.84912 8.575901 18.56817 8.010013 6.280952       11.73484 
1 1 1 -7  26 40 o 12.08183 5.566012 -1.103930      3.791455 3.681266       5.832774 -4.605272      4.989334 17.36910 7.511718 11.89872 5.740437 5.470382       9.454021 
1 1 1 -7  26 41 o 15.46055 6.409931 3.076030       3.957097 7.498329       6.253865 0.1233410      5.110147 19.78076 8.115076 14.12471 6.490633 5.656049       10.39148 
1 1 1 -7  26 42 o 17.92450 7.400513 5.751882       5.244555 11.37335       6.515180 -4.596011      8.839499 22.37510 8.560589 14.68867 7.207824 7.686427       11.19091 
1 1 1 -7  27 1  o 180.1921 3.593256 396.4716       15.77829 450.0132       32.42635 379.8621       18.06059 191.2836 6.968037 176.3075 4.203635 14.97618       8.137818 
1 1 1 -7  27 2  o 22.64487 5.934021 6.513708       3.313457 6.615986       4.452770 6.386798       4.960039 23.22470 7.159495 23.24075 7.603790 -0.1605034E-01 10.44394 
1 1 1 -7  27 3  o 266.1652 5.152827 866.9974       33.42204 771.0670       53.36653 928.9041       42.87057 249.8200 8.779733 275.1787 6.393054 -25.35867      10.86070 
1 1 1 -7  27 4  o 58.91088 3.647115 42.54083       5.210103 43.32836       6.714406 41.34909       8.259730 59.34211 4.680985 57.78460 5.950650 1.557510       7.571120 
1 1 1 -7  27 5  o 161.3035 3.841506 317.8094       15.10016 328.4028       18.59137 297.2739       25.88477 163.8087 4.662085 155.4405 6.850339 8.368256       8.286264 
1 1 1 -7  27 6  o 235.8057 3.680681 679.0624       21.15040 661.6820       32.46532 691.8784       27.87830 232.3895 5.732805 237.8278 4.810249 -5.438354      7.483552 
1 1 1 -7  27 7  o 102.4889 2.823853 128.2577       7.045970 137.3631       10.71017 121.3098       9.355634 105.9391 4.156692 99.57816 3.862758 6.360939       5.674416 
1 1 1 -7  27 8  o 148.9900 3.287650 270.9844       11.93655 283.9625       16.83769 257.8725       16.92431 152.3181 4.541298 145.1080 4.792693 7.210098       6.602521 
1 1 1 -7  27 9  o 226.4476 4.047194 626.6380       22.33356 641.5378       45.39612 621.8802       25.65272 227.9521 8.185488 225.4770 4.668689 2.475128       9.423315 
1 1 1 -7  27 10 o 107.7079 3.215957 141.7463       8.431546 123.1252       16.43352 148.3995       9.823007 99.87614 6.792423 110.1639 3.664156 -10.28772      7.717710 
1 1 1 -7  27 11 o 97.44008 3.253061 116.0476       7.713591 128.3785       15.95880 112.2887       8.811198 102.0439 6.450679 95.79420 3.781934 6.249672       7.477585 
1 1 1 -7  27 12 o 180.6193 4.132650 398.8330       18.18985 0.000000       0.000000 398.8330       18.18985 ?        ?        180.6193 4.132650 0.000000       4.132650 
1 1 1 -7  27 13 o 167.4469 3.186414 342.3409       13.00216 364.1971       22.20995 330.9447       16.03759 172.3161 5.295433 164.5384 3.999778 7.777695       6.636251 
1 1 1 -7  27 14 o 174.4372 3.221735 371.5677       13.69510 378.4788       22.86807 367.7030       17.10085 175.6341 5.349226 173.4179 4.046576 2.216232       6.707385 
1 1 1 -7  27 15 o 86.83929 3.443969 92.26849       7.273602 88.49735       11.10387 95.10285       9.626452 84.78209 5.402560 88.03669 4.502057 -3.254601      7.032508 
1 1 1 -7  27 16 o 85.72440 3.367403 89.91425       7.020855 91.78242       10.70762 88.50536       9.298753 86.37992 5.109617 84.90820 4.510241 1.471718       6.815458 
1 1 1 -7  27 17 o 127.3212 3.736129 198.3695       11.57947 188.9002       20.66053 202.7062       13.98183 123.6042 6.886404 128.5884 4.468756 -4.984245      8.209284 
1 1 1 -7  27 18 o 59.63858 4.032213 43.71940       5.825674 67.04697       12.18927 36.81340       6.632176 73.40968 6.894485 54.55546 5.045791 18.85421       8.543649 
1 1 1 -7  27 19 o 83.82051 3.278750 86.00003       6.684305 68.78332       15.13474 90.17207       7.450300 73.90137 8.562256 85.79662 3.571232 -11.89525      9.277172 
1 1 1 -7  27 20 o 83.66727 3.020521 85.64151       6.148374 85.62505       11.49599 85.64810       7.276515 83.22861 5.702561 83.60191 3.579957 -0.3733063     6.733149 
1 1 1 -7  27 21 o 21.19998 6.356366 5.607402       3.542904 -1.604752      7.536838 7.653156       4.014055 19.18134 8.412771 24.47346 6.586395 -5.292122      10.68435 
1 1 1 -7  27 22 o 141.4392 2.996943 244.5632       10.32962 246.3078       17.69406 243.6613       12.72270 141.3958 5.143744 141.0064 3.705793 0.3893738      6.339637 
1 1 1 -7  27 23 o 73.30568 3.271593 65.89507       5.829583 79.37974       14.41953 63.26045       6.373681 79.45453 7.537400 71.76487 3.656589 7.689659       8.377532 
1 1 1 -7  27 24 o 40.91136 4.233758 20.77884       4.159985 20.79660       11.62127 20.77622       4.455205 39.58943 11.41824 40.84987 4.552781 -1.260445      12.29244 
1 1 1 -7  27 25 o 152.7055 3.047249 285.5622       11.33962 294.1111       20.00077 281.5124       13.76593 154.0903 5.334466 151.4294 3.730432 2.660873       6.509427 
1 1 1 -7  27 26 o 41.72498 3.815418 21.58211       3.836598 20.20834       8.078330 21.98221       4.359639 39.09030 8.704007 42.01336 4.319686 -2.923054      9.716967 
1 1 1 -7  27 27 o 14.14226 5.658172 1.285921       2.954274 5.099291       7.314666 0.5426295      3.229384 23.42740 9.042877 13.78563 5.759053 9.641766       10.72102 
1 1 1 -7  27 28 o 48.28064 3.363065 28.82508       3.932065 34.80602       8.503375 27.19837       4.434669 51.96056 6.884809 46.76575 3.927577 5.194817       7.926314 
1 1 1 -7  27 29 o 35.29833 4.481012 15.73876       3.767740 12.24231       7.871483 16.77792       4.291265 30.16033 9.552794 36.31770 4.979754 -6.157368      10.77283 
1 1 1 -7  27 30 o 105.7180 3.271092 138.1938       8.416959 135.4284       13.17085 140.1029       10.94309 103.4810 5.240018 105.9187 4.248281 -2.437653      6.745790 
1 1 1 -7  27 31 o 50.53177 5.516219 32.91849       6.682509 26.50985       7.976047 48.01146       12.24030 44.17180 7.688964 58.89452 8.797980 -14.72272      11.68438 
1 1 1 -7  27 32 o 17.66802 7.442387 1.478734       5.462464 -0.9419498     6.485099 7.390470       10.13456 17.25223 7.673719 25.83913 10.43034 -8.586899      12.94905 
1 1 1 -7  27 33 o 26.15515 6.835783 9.560791       4.404657 10.66436       6.772899 8.751974       5.798293 27.03343 8.887630 24.88527 8.225273 2.148159       12.10971 
1 1 1 -7  27 34 o 39.89132 4.752421 20.84026       4.529132 18.92965       7.587784 21.89776       5.645065 35.13589 8.863943 40.15232 5.949000 -5.016422      10.67521 
1 1 1 -7  27 35 o 10.23633 4.918666 -4.461230      3.577709 -6.957658      5.921113 -3.025701      4.490036 12.95701 6.251628 12.63600 5.901570 0.3210087      8.597174 
1 1 1 -7  27 36 o 38.01257 4.851404 19.48408       4.391699 20.48069       7.013197 18.84117       5.632849 35.99664 8.181238 35.91217 6.682369 0.8446121E-01  10.56346 
1 1 1 -7  27 37 o 48.03462 4.641070 31.09783       5.365029 40.96346       10.72220 27.80285       6.196517 48.88021 9.341945 44.14779 5.907900 4.732430       11.05329 
1 1 1 -7  27 38 o 29.63784 7.579672 14.43091       5.495393 13.20294       8.539376 15.29894       7.179615 25.48223 9.787663 28.50100 9.134175 -3.018770      13.38774 
1 1 1 -7  27 39 o 12.10289 5.527187 -0.7909124     3.629577 -3.557181      5.879464 0.9124586      4.613655 13.45130 6.420866 14.55581 6.473529 -1.104506      9.117790 
1 1 1 -7  27 40 o 14.47320 6.077579 2.252063       3.624825 -1.659084      5.585276 5.098212       4.764545 13.70126 6.456742 17.82625 7.167181 -4.124988      9.646658 
1 1 1 -7  27 41 o 15.17340 6.707039 2.304182       4.878139 2.066732       5.966212 2.783054       8.472703 15.65987 7.126413 17.05329 8.010171 -1.393413      10.72141 
1 1 1 -7  28 1  o 107.4617 3.167739 141.0926       8.286382 134.9409       10.98403 149.2180       12.62375 104.9678 4.303195 110.3365 4.705779 -5.368698      6.376664 
1 1 1 -7  28 2  o 125.3722 3.731263 192.1833       11.38701 201.7286       13.45792 168.1282       21.36424 128.3775 4.307930 116.6109 7.558904 11.76665       8.700304 
1 1 1 -7  28 3  o 101.1631 3.643524 125.1647       8.967473 117.2830       10.28325 150.1873       18.32257 97.84550 4.323414 110.3353 6.848288 -12.48976      8.098825 
1 1 1 -7  28 4  o 134.8501 3.226238 222.0005       10.60190 232.0469       14.79357 211.3924       15.20145 137.6809 4.414943 131.3541 4.756892 6.326843       6.489973 
1 1 1 -7  28 5  o 168.1794 3.459287 345.4073       14.17737 381.2440       20.52263 312.6928       19.60826 176.4446 4.777362 159.7362 5.043643 16.70847       6.947052 
1 1 1 -7  28 6  o 65.22665 3.477474 52.10511       5.507476 45.64749       7.200727 61.20786       8.549214 60.87477 4.895275 70.53281 5.006463 -9.658031      7.002027 
1 1 1 -7  28 7  f 136.1798 3.232747 226.4169       10.72805 207.1060       14.20903 252.0202       16.36105 130.0447 4.490429 143.4384 4.686981 -13.39371      6.490897 
1 1 1 -7  28 8  o 241.0885 4.191417 710.6541       24.62485 758.7213       35.75410 667.2786       33.96437 248.6884 5.899759 233.1236 5.983570 15.56483       8.402991 
1 1 1 -7  28 9  o 196.7010 4.350724 473.2265       20.85471 451.6526       35.42237 484.6714       25.80008 191.2723 7.614796 198.8066 5.330234 -7.534241      9.294972 
1 1 1 -7  28 10 o 231.0098 4.757537 653.2551       26.78234 657.1755       46.82908 651.3494       32.64899 230.4488 8.352647 230.3356 5.821310 0.1131287      10.18108 
1 1 1 -7  28 11 o 167.6666 4.963470 344.6096       20.25768 0.000000       0.000000 344.6096       20.25768 ?        ?        167.6666 4.963470 0.000000       4.963470 
1 1 1 -7  28 12 o 122.6677 3.788186 184.0932       11.31037 194.7983       20.65058 179.5057       13.51827 125.6363 6.769990 121.0121 4.592455 4.624214       8.180673 
1 1 1 -7  28 13 o 80.17698 4.649045 78.97304       9.044465 98.25702       13.99485 65.14201       11.85215 89.14394 6.486675 72.42977 6.794288 16.71416       9.393578 
1 1 1 -7  28 14 o 176.7843 5.230323 383.6041       22.50767 366.7608       31.25140 401.7568       32.44335 172.2021 7.464965 180.2672 7.401120 -8.065125      10.51201 
1 1 1 -7  28 15 o 145.1392 3.339693 257.3895       11.81211 266.7534       24.90990 254.6731       13.41643 146.9072 6.978084 144.2593 3.819790 2.647934       7.955152 
1 1 1 -7  28 16 o 177.7598 3.599727 386.3395       15.59334 444.9815       34.53157 371.3186       17.47669 189.5512 7.490479 174.1776 4.117472 15.37361       8.547565 
1 1 1 -7  28 17 o 78.51115 3.753149 75.57661       7.159848 69.08939       13.97966 77.88335       8.336173 74.26251 7.843218 79.62447 4.312288 -5.361961      8.950524 
1 1 1 -7  28 18 o 24.69847 6.415001 7.803400       3.895119 3.940787       7.323073 9.327329       4.599761 22.88409 8.986639 26.96848 6.954224 -4.084387      11.36314 
1 1 1 -7  28 19 o 60.34628 3.336784 44.66579       4.887883 42.69061       8.979295 45.49754       5.826831 58.47053 6.406639 60.82745 3.952343 -2.356915      7.527685 
1 1 1 -7  28 20 o 78.75399 3.082311 75.94244       5.903991 78.21995       10.83064 74.97952       7.042324 79.48061 5.628269 78.16663 3.707646 1.313988       6.739737 
1 1 1 -7  28 21 o 53.94489 3.494832 35.77603       4.569504 32.67057       8.671131 36.97001       5.376656 50.78867 7.208276 54.75792 4.058139 -3.969250      8.272106 
1 1 1 -7  28 22 o 98.38585 2.927315 118.4931       7.010597 112.7452       12.46767 121.1508       8.477841 95.43837 5.382572 99.38438 3.506000 -3.946014      6.423715 
1 1 1 -7  28 23 o 59.10474 3.549581 42.98552       5.088967 31.66753       12.62913 45.17949       5.560376 48.67766 10.91638 60.55941 3.786739 -11.88174      11.55451 
1 1 1 -7  28 24 o 104.2415 2.935330 133.1647       7.449050 125.8507       13.56183 136.3246       8.914104 100.5902 5.554125 105.3506 3.476963 -4.760391      6.552677 
1 1 1 -7  28 25 o 66.93646 3.333909 55.13701       5.421052 63.15307       14.30837 53.79350       5.857755 69.82388 8.589945 66.04818 3.653673 3.775696       9.334692 
1 1 1 -7  28 26 o 54.15344 3.353978 36.18751       4.404390 26.84962       8.816670 39.29272       5.084236 45.09793 8.329298 56.35730 3.722879 -11.25937      9.123433 
1 1 1 -7  28 27 o 50.53174 3.469255 31.60487       4.246132 14.07877       8.258008 37.90386       4.950717 32.26331 9.711374 55.30473 3.694602 -23.04143      10.39042 
1 1 1 -7  28 28 o 27.84822 5.407818 10.06213       3.537580 5.232087       7.707161 11.35133       3.981804 23.53201 9.225803 29.52397 5.741168 -5.991961      10.86630 
1 1 1 -7  28 29 o 34.12683 4.301644 14.74997       3.498080 13.74518       7.422461 15.03686       3.966158 31.40998 9.144956 34.27985 4.885960 -2.869875      10.36836 
1 1 1 -7  28 30 o 74.51218 3.707068 69.29780       6.710083 64.72479       10.12454 72.87986       8.960675 70.71139 5.930144 75.76772 4.879049 -5.056328      7.679305 
1 1 1 -7  28 31 o 29.84734 4.935198 11.61614       3.464262 15.17224       6.957716 10.44397       3.994615 32.43613 8.645766 27.84434 6.059626 4.591797       10.55786 
1 1 1 -7  28 32 o 40.47830 4.549707 21.14530       4.410273 22.25973       7.711709 20.60366       5.376229 39.17896 8.333701 39.29997 5.786746 -0.1210098     10.14579 
1 1 1 -7  28 33 o 62.87693 3.726388 50.19706       5.684123 47.86729       8.997359 51.74451       7.332757 59.21726 6.333137 63.00824 4.812071 -3.790974      7.953907 
1 1 1 -7  28 34 o 53.90578 5.084808 38.74418       6.600615 45.72261       12.03262 35.74033       7.894422 53.29500 9.618685 50.34870 6.592427 2.946297       11.66101 
1 1 1 -7  28 35 o 13.26712 5.849943 -0.4482941E-01 3.689280 1.817222       6.142072 -1.095825      4.614446 17.56247 7.650835 13.85888 6.291307 3.703589       9.905343 
1 1 1 -7  28 36 o 47.76100 4.287403 30.28424       4.936997 30.71407       7.652295 29.97776       6.461677 44.97532 7.226774 45.90000 5.914229 -0.9246826     9.338327 
1 1 1 -7  28 37 o 26.04979 7.246044 10.94800       4.766768 5.952027       9.071671 12.85354       5.602554 20.77419 9.166127 27.59094 7.918870 -6.816748      12.11307 
1 1 1 -7  28 38 o 11.91581 5.528482 -1.572366      3.838808 -6.880961      5.993649 2.119917       4.998608 12.36724 6.040435 15.85293 6.904116 -3.485693      9.173532 
1 1 1 -7  28 39 o 20.07478 6.767953 6.792335       3.922486 7.398356       6.107895 6.366971       5.117146 19.99996 8.088709 19.17756 7.517804 0.8223972      11.04285 
1 1 1 -7  28 40 o 12.71900 6.005732 -1.842157      4.876085 1.149973       6.107646 -7.101325      8.097337 15.33592 7.064894 13.75116 6.777301 1.584752       9.790022 
1 1 1 -7  28 41 o 23.36518 6.920027 9.861926       4.219279 23.61961       7.186412 2.624848       5.212199 33.91846 8.664243 15.41342 6.866205 18.50504       11.05504 
1 1 1 -7  29 1  f 148.8510 3.345753 270.6005       12.13617 265.0301       16.24570 277.6347       18.25592 147.0974 4.537504 150.4771 4.985368 -3.379684      6.741130 
1 1 1 -7  29 2  o 119.1324 3.195878 173.4208       9.269656 189.2020       12.86297 156.3701       13.37029 124.3056 4.252598 112.9025 4.871067 11.40305       6.466211 
1 1 1 -7  29 3  o 120.6354 2.892493 177.6288       8.503215 193.4336       13.09528 166.1069       11.18104 125.6855 4.281818 116.5041 3.943952 9.181412       5.821403 
1 1 1 -7  29 4  o 125.8080 2.871985 193.1840       8.804941 189.5559       13.23468 196.0650       11.79366 124.4041 4.372387 126.6008 3.827147 -2.196724      5.810751 
1 1 1 -7  29 5  o 22.42294 6.106867 6.373875       3.426417 10.18174       4.646419 1.834712       5.073007 28.21238 6.831866 18.29398 7.381346 9.918402       10.05777 
1 1 1 -7  29 6  o 129.5011 2.909086 204.7069       9.180495 203.2115       13.80900 205.8914       12.28976 128.8036 4.405934 129.7256 3.892000 -0.9220581     5.878768 
1 1 1 -7  29 7  o 176.1294 3.184178 378.8065       13.66675 396.2204       21.49691 366.9936       17.70553 179.7964 4.910956 173.2226 4.194384 6.573730       6.458354 
1 1 1 -7  29 8  o 140.0172 2.961996 239.3363       10.10653 264.0515       16.13359 223.3739       12.96574 146.8131 4.514882 135.1100 3.942198 11.70316       5.993754 
1 1 1 -7  29 9  o 39.01646 5.315282 19.00369       4.922430 21.48209       9.466967 18.08537       5.762676 40.76411 9.675873 37.82976 6.484302 2.934353       11.64769 
1 1 1 -7  29 10 o 112.3087 3.783544 154.3692       10.34018 0.000000       0.000000 154.3692       10.34018 ?        ?        112.3087 3.783544 0.000000       3.783544 
1 1 1 -7  29 11 o 74.16507 3.582465 67.38157       6.455517 52.42131       12.61621 72.68775       7.513638 64.58212 8.201107 76.98478 4.018980 -12.40266      9.132927 
1 1 1 -7  29 12 o 101.0041 3.298653 124.7730       8.108277 136.7917       17.34757 121.4134       9.171790 105.1374 6.807477 99.57360 3.786744 5.563789       7.789813 
1 1 1 -7  29 13 o 134.7435 3.330888 221.8590       10.93715 218.1970       22.46219 222.9971       12.52178 132.8068 6.964926 134.9754 3.810746 -2.168640      7.939268 
1 1 1 -7  29 14 o 72.50410 3.236536 64.36353       5.704045 61.80035       9.648911 65.74048       7.072113 70.68894 5.648277 73.18722 3.980296 -2.498276      6.909833 
1 1 1 -7  29 15 o 97.89655 3.348985 117.2863       7.977684 112.7875       12.39798 120.4653       10.42188 95.67352 5.338866 99.07201 4.327209 -3.398491      6.872280 
1 1 1 -7  29 16 o 121.5266 3.331651 180.6886       9.857275 194.8586       15.53931 171.1474       12.75114 125.8701 5.076506 118.0831 4.439143 7.786995       6.743657 
1 1 1 -7  29 17 o 26.87770 6.396335 9.271327       4.128572 11.15038       7.761603 8.529876       4.875540 29.97550 9.484842 25.90260 7.372114 4.072903       12.01292 
1 1 1 -7  29 18 o 141.4438 3.047641 244.5745       10.50470 258.0948       18.25712 237.8834       12.84368 144.7588 5.183856 139.3199 3.786543 5.438889       6.419523 
1 1 1 -7  29 19 o 123.3603 2.980803 186.0626       8.960756 191.1046       15.59478 183.5773       10.94865 124.4911 5.151624 122.3694 3.675736 2.121651       6.328528 
1 1 1 -7  29 20 o 16.78823 6.344278 2.552517       3.551153 11.15188       6.999707 -0.4279220     4.120850 29.58710 8.948618 14.60935 6.316021 14.97775       10.95308 
1 1 1 -7  29 21 o 10.11146 4.819755 -4.275186      3.288361 -9.267787      6.891361 -2.803261      3.741833 14.42218 6.902537 12.02327 5.535572 2.398909       8.848027 
1 1 1 -7  29 22 f 88.70927 3.231301 96.55732       6.973589 94.58834       16.68104 96.97432       7.676598 86.26672 8.027048 88.83623 3.553200 -2.569511      8.778310 
1 1 1 -7  29 23 o 54.22445 3.461553 36.23876       4.550179 48.47618       9.186380 32.26038       5.237847 62.05924 6.155408 50.99555 4.253575 11.06369       7.482109 
1 1 1 -7  29 24 o 30.71150 4.894559 11.96783       3.540264 6.416612       7.524388 13.54612       4.012098 24.78150 9.262443 32.63584 5.220638 -7.854338      10.63240 
1 1 1 -7  29 25 o 52.72326 3.410773 34.34397       4.358675 23.63911       8.359497 38.34080       5.107961 42.14389 8.434325 55.63132 3.790479 -13.48743      9.246922 
1 1 1 -7  29 26 o 65.21918 3.363154 52.54503       5.327077 87.02107       15.50363 47.92983       5.672441 81.71007 7.883913 62.17356 3.761530 19.53651       8.735284 
1 1 1 -7  29 27 o 47.83343 3.788750 28.51896       4.380303 26.00095       8.202507 29.52351       5.180898 44.04861 7.933222 48.47603 4.434808 -4.427414      9.088649 
1 1 1 -7  29 28 o 76.97248 3.679287 73.71231       6.881387 68.00991       10.48017 78.03412       9.123726 72.71661 5.966666 78.64917 4.782997 -5.932564      7.647101 
1 1 1 -7  29 29 o 35.18401 5.540987 16.17026       4.593856 18.00301       7.316629 14.97759       5.902255 35.72405 8.523828 32.98645 7.511336 2.737598       11.36115 
1 1 1 -7  29 30 o 62.39610 3.185305 48.51061       4.827309 38.89851       8.867344 52.55910       5.754805 53.67879 6.941175 64.72589 3.663474 -11.04710      7.848627 
1 1 1 -7  29 31 o 56.02751 3.335412 39.38554       4.533325 28.97722       8.121023 44.09703       5.463861 45.36574 7.615518 59.03457 3.818503 -13.66883      8.519218 
1 1 1 -7  29 32 o 74.36247 3.018541 69.22823       5.458627 63.58364       9.719372 71.82897       6.597382 68.78548 5.853926 75.32298 3.604710 -6.537491      6.874764 
1 1 1 -7  29 33 o 66.00282 3.411486 55.31372       5.468471 38.76599       12.12670 59.53767       6.126783 47.40527 10.74623 68.24352 3.697945 -20.83825      11.36469 
1 1 1 -7  29 34 o 9.581841 4.674768 -5.622231      3.561173 -4.317102      6.313256 -6.231300      4.312804 14.37879 6.802714 10.67306 5.193131 3.705725       8.558360 
1 1 1 -7  29 35 o 33.79673 5.522509 16.05782       4.391348 14.12716       7.139628 17.23265       5.569420 28.25813 9.113679 33.72078 7.006697 -5.462643      11.49578 
1 1 1 -7  29 36 o 17.58722 6.942948 4.088603       4.391353 1.703896       9.140940 4.804095       5.006978 18.79622 8.653186 18.59678 7.390643 0.1994362      11.37977 
1 1 1 -7  29 37 o 16.58107 6.852335 3.353339       4.502128 8.371504       6.264043 -2.008751      6.475143 21.57556 8.357431 14.81298 6.971812 6.762580       10.88360 
1 1 1 -7  29 38 o 31.96005 5.747404 15.46953       4.311705 11.51257       6.580657 18.44607       5.707483 23.65172 8.694888 33.02920 7.286848 -9.377485      11.34457 
1 1 1 -7  29 39 o 44.53450 4.657710 28.32691       4.980150 30.92986       7.891824 26.60440       6.419864 40.93039 8.198206 40.08858 6.815275 0.8418159      10.66108 
1 1 1 -7  29 40 o 29.89888 6.245068 14.63407       4.403182 15.85432       7.249002 13.92061       5.542904 25.69525 9.169938 26.51731 7.950542 -0.8220634     12.13667 
1 1 1 -7  30 1  o 211.4192 3.915762 546.6103       20.17422 572.2514       28.60216 521.2240       28.45970 215.8890 5.440995 205.9631 5.675694 9.925903       7.862438 
1 1 1 -7  30 2  o 56.33167 3.359270 38.90435       4.590465 40.69688       6.383384 36.98453       6.606139 57.46895 4.596362 54.70708 5.010874 2.761871       6.799662 
1 1 1 -7  30 3  o 58.52527 3.430264 41.99291       4.870784 55.05415       7.133348 30.58384       6.666938 66.92352 4.398378 49.60687 5.613568 17.31665       7.131471 
1 1 1 -7  30 4  o 139.0956 2.966906 236.2334       10.05665 213.8399       14.64576 256.2118       13.83347 132.0740 4.557323 144.6917 3.926930 -12.61771      6.015810 
1 1 1 -7  30 5  o 76.09356 3.022140 70.81606       5.592859 62.02223       7.885818 79.71631       7.933393 71.02232 4.580766 80.62645 4.050780 -9.604134      6.114919 
1 1 1 -7  30 6  o 87.36745 2.933935 93.30370       6.237631 86.83559       8.927462 99.47317       8.718921 84.11322 4.370385 90.09428 3.981101 -5.981064      5.911804 
1 1 1 -7  30 7  o 122.1036 3.368376 182.3085       10.01313 190.1163       19.77530 179.6165       11.61171 124.0857 6.563153 121.1189 3.939365 2.966843       7.654644 
1 1 1 -7  30 8  o 36.62514 4.439899 16.66236       3.881857 17.21527       5.478516 16.10487       5.501105 36.89973 6.319802 35.61280 6.581173 1.286922       9.124239 
1 1 1 -7  30 9  o 130.8727 4.744399 210.1805       15.10592 0.000000       0.000000 210.1805       15.10592 ?        ?        130.8727 4.744399 0.000000       4.744399 
1 1 1 -7  30 10 o 58.79611 3.957154 42.48749       5.636779 46.68115       10.72308 40.88619       6.626127 61.03320 7.357981 57.55872 4.766735 3.474480       8.767077 
1 1 1 -7  30 11 o 66.06322 3.772795 53.55999       6.048526 66.22973       12.60851 49.77276       6.893514 72.86406 7.194710 63.58123 4.477772 9.282833       8.474332 
1 1 1 -7  30 12 o 121.4220 3.327852 180.3453       9.837572 177.3601       20.05263 181.2915       11.28949 119.6401 6.907303 121.6661 3.812458 -2.025993      7.889593 
1 1 1 -7  30 13 o 72.15546 3.640064 63.84826       6.379831 58.50111       12.91533 65.57416       7.337552 68.22558 7.914929 73.05868 4.138308 -4.833099      8.931499 
1 1 1 -7  30 14 o 92.52281 3.792571 104.9498       8.532908 94.31664       14.60440 110.4610       10.51421 87.06087 6.941176 94.79633 4.564859 -7.735458      8.307699 
1 1 1 -7  30 15 o 67.10711 3.358822 55.21669       5.475312 65.43898       9.998195 50.83782       6.543777 72.67276 5.691010 64.26736 4.201357 8.405403       7.073824 
1 1 1 -7  30 16 o 113.4896 3.010801 157.5640       8.319370 162.4757       14.41550 155.1111       10.18701 114.8046 5.165930 112.4835 3.721520 2.321098       6.366832 
1 1 1 -7  30 17 o 74.60013 3.250199 68.21868       5.894434 61.30344       10.44337 71.45155       7.140539 70.14783 6.172161 76.25888 3.854920 -6.111046      7.277086 
1 1 1 -7  30 18 o 162.5286 3.191459 323.2721       12.64023 326.5775       21.33981 321.4855       15.68861 162.6135 5.392609 161.8833 3.976915 0.7301483      6.700454 
1 1 1 -7  30 19 o 65.77551 3.347487 53.13223       5.347968 56.76001       10.09769 51.71792       6.304831 67.36147 6.221678 64.78008 4.013600 2.581383       7.403936 
1 1 1 -7  30 20 o 93.09449 2.963888 106.2001       6.715342 110.9078       12.12746 104.1183       8.064576 94.56143 5.283850 92.05193 3.602066 2.509499       6.394837 
1 1 1 -7  30 21 o 31.29344 5.342667 12.45947       3.928108 22.56491       12.21943 11.29482       4.148293 40.77581 11.69230 29.62877 5.952213 11.14703       13.12016 
1 1 1 -7  30 22 o 46.76528 3.842704 27.09711       4.340621 32.21476       8.794535 25.44895       4.990870 49.98079 7.447676 45.14633 4.600687 4.834457       8.754096 
1 1 1 -7  30 23 o 84.07657 2.979113 86.84873       6.094122 99.01315       11.42878 82.01591       7.203686 89.00568 5.293121 81.53524 3.634681 7.470444       6.420907 
1 1 1 -7  30 24 o 49.37404 3.579832 30.20429       4.277970 24.40276       8.179840 32.38855       5.019094 42.87360 8.126569 51.01614 4.070960 -8.142540      9.089215 
1 1 1 -7  30 25 o 47.61388 3.651230 28.17663       4.204193 19.37497       8.334925 31.18019       4.868973 37.51832 9.190301 49.99725 4.030401 -12.47893      10.03523 
1 1 1 -7  30 26 o 17.96603 6.225464 3.805829       3.323649 7.966990       6.737916 2.467750       3.820843 25.22880 8.855962 16.77029 6.518560 8.458511       10.99635 
1 1 1 -7  30 27 o 27.27641 6.648455 10.01259       4.378384 20.86795       7.355840 4.056349       5.448742 39.00502 8.007269 20.19626 7.802307 18.80876       11.18000 
1 1 1 -7  30 28 o 73.35351 4.230751 67.80512       7.530573 41.89016       13.09727 80.60350       9.204137 53.25336 10.46585 79.65063 4.763724 -26.39728      11.49900 
1 1 1 -7  30 29 o 30.67609 4.932234 12.29675       3.562095 10.30194       7.403189 12.89769       4.063375 26.93726 9.293291 31.16783 5.553540 -4.230572      10.82622 
1 1 1 -7  30 30 o 63.05616 3.206529 49.78379       4.911009 36.60287       8.841632 55.66463       5.905809 51.27289 7.280797 66.41693 3.663107 -15.14404      8.150360 
1 1 1 -7  30 31 o 22.19156 5.990727 6.861329       3.314649 7.619183       6.552056 6.600659       3.842646 23.31110 8.656840 21.66596 6.645853 1.645132       10.91367 
1 1 1 -7  30 32 o 43.52120 4.028148 24.54668       4.223643 21.49924       10.31187 25.16100       4.629819 34.23420 10.94425 43.82244 4.394667 -9.588245      11.79363 
1 1 1 -7  30 33 o 39.72717 4.658237 21.08491       4.424119 14.97578       7.158908 24.85966       5.627308 29.75555 9.060250 42.40286 5.581280 -12.64731      10.64137 
1 1 1 -7  30 34 o 51.99648 3.901658 35.34973       4.907726 35.28445       11.22647 35.36515       5.456756 43.21410 10.71409 51.55396 4.385039 -8.339867      11.57672 
1 1 1 -7  30 35 o 11.22874 5.227031 -1.974707      3.475974 5.100741       8.204545 -3.522506      3.837381 20.07421 8.791680 10.93630 5.211148 9.137915       10.22006 
1 1 1 -7  30 36 o 20.44612 6.618760 6.651793       3.763472 5.065188       6.460430 7.466788       4.630251 18.90753 8.034943 21.13514 7.346604 -2.227615      10.88728 
1 1 1 -7  30 37 o 14.66022 6.470923 1.411477       4.525197 7.195255       6.719787 -3.387784      6.121203 19.94270 8.317550 13.59655 6.506855 6.346141       10.56034 
1 1 1 -7  30 38 o 40.54095 5.019887 23.97091       4.853480 22.35517       7.647940 25.06039       6.280136 32.64489 9.213729 38.87976 6.880113 -6.234863      11.49908 
1 1 1 -7  30 39 o 15.68691 6.400856 3.567383       3.864694 2.082399       6.265364 4.479410       4.910087 15.76622 7.223403 16.85740 7.075768 -1.091176      10.11158 
1 1 1 -7  31 1  o 30.97795 5.358730 12.11609       3.898946 16.23979       5.613913 8.273582       5.419129 35.72534 6.694334 25.79092 7.888670 9.934414       10.34627 
1 1 1 -7  31 2  o 115.5286 2.925624 163.1141       8.229900 167.2693       12.35508 159.7998       11.03427 116.7812 4.349062 114.2033 3.970910 2.577919       5.889183 
1 1 1 -7  31 3  o 63.73860 3.257865 49.77468       5.043461 55.50544       7.380076 44.75312       6.908334 67.15227 4.536495 60.23437 4.744729 6.917900       6.564467 
1 1 1 -7  31 4  o 78.35273 3.041532 75.10651       5.796381 83.07959       8.660046 68.63574       7.801633 82.24712 4.336111 74.74001 4.301647 7.507118       6.107866 
1 1 1 -7  31 5  o 94.25038 2.938226 108.6019       6.740213 114.1852       9.980800 103.9207       9.138940 96.46961 4.256073 92.04873 4.084367 4.420883       5.898831 
1 1 1 -7  31 6  o 103.8476 2.918737 131.8201       7.378981 140.2907       11.25834 125.4409       9.770098 106.9343 4.329326 101.1634 3.970852 5.770866       5.874583 
1 1 1 -7  31 7  o 95.10735 3.316741 110.6934       7.675321 133.4338       14.32733 101.5404       9.089666 104.0193 5.673651 90.97736 4.110568 13.04194       7.006217 
1 1 1 -7  31 8  o 153.2615 3.068448 286.9877       11.46009 291.5279       17.70151 283.7117       15.03664 154.1104 4.719045 152.1749 4.058444 1.935562       6.224174 
1 1 1 -7  31 9  o 78.20578 3.594635 74.96510       6.832297 103.5026       14.48519 66.79950       7.748366 91.35819 6.549859 73.71171 4.332684 17.64648       7.853203 
1 1 1 -7  31 10 o 46.74961 5.145278 27.16244       5.764888 18.07407       9.823536 31.93646       7.119786 37.33254 10.40872 50.59770 5.883937 -13.26516      11.95668 
1 1 1 -7  31 11 o 14.56993 6.396013 -1.061506      4.365304 4.043460       8.430170 -2.931840      5.102693 24.10880 9.587049 14.58968 6.620180 9.519122       11.65068 
1 1 1 -7  31 12 o 60.26245 3.937193 44.66958       5.750226 31.87636       11.25213 49.19155       6.689729 49.58045 9.660351 63.18501 4.371637 -13.60456      10.60347 
1 1 1 -7  31 13 o 36.66715 6.076169 17.02354       5.239316 29.13630       9.338751 11.45978       6.329237 47.65867 8.344907 29.86028 8.365647 17.79839       11.81616 
1 1 1 -7  31 14 o 68.10795 3.740136 56.99204       6.183737 46.86877       12.35730 60.37388       7.142326 60.61423 8.607645 70.03061 4.204557 -9.416382      9.579659 
1 1 1 -7  31 15 o 105.0131 3.319067 135.1100       8.483007 141.3530       18.08805 133.3498       9.604782 106.4178 7.014063 104.2394 3.787406 2.178368       7.971294 
1 1 1 -7  31 16 o 42.48319 4.734727 22.47668       4.818509 23.31328       10.83883 22.27062       5.379306 41.91262 10.60531 42.15882 5.356811 -0.2462082     11.88141 
1 1 1 -7  31 17 o 139.5453 3.486650 238.6787       11.85658 228.3524       17.61408 247.2341       16.03274 135.8568 5.330724 141.6240 4.651834 -5.767242      7.075039 
1 1 1 -7  31 18 o 98.90282 2.992478 119.8725       7.204037 139.9890       13.20675 111.3514       8.595442 106.3185 5.112412 95.17091 3.713318 11.14754       6.318662 
1 1 1 -7  31 19 f 74.97778 3.137751 69.02346       5.720397 79.90990       10.49418 64.42121       6.823238 80.10500 5.407608 72.28122 3.888036 7.823784       6.660258 
1 1 1 -7  31 20 o 88.92224 3.311047 97.20255       7.162304 95.83279       17.69005 97.47112       7.833040 86.19527 8.533785 88.96855 3.620478 -2.773285      9.270024 
1 1 1 -7  31 21 o 17.05637 6.315598 2.917523       3.482629 0.2276627      6.746628 3.894648       4.066276 18.99644 8.145493 18.99283 6.856913 0.3606796E-02  10.64736 
1 1 1 -7  31 22 o 16.34663 6.250353 2.406769       3.471805 8.472263       7.242927 0.5974082      3.955884 26.37433 9.187179 15.11138 6.347526 11.26295       11.16671 
1 1 1 -7  31 23 o 52.92014 3.538639 34.70534       4.537226 22.95738       8.230516 39.83414       5.438182 41.29504 8.463474 56.59372 3.968356 -15.29868      9.347633 
1 1 1 -7  31 24 f 58.39873 3.356228 42.23975       4.756176 46.57055       9.032628 40.57835       5.594573 60.17221 6.251006 57.02307 4.052467 3.149147       7.449669 
1 1 1 -7  31 25 o 57.13207 4.487627 41.09432       6.197766 47.47254       8.504474 33.87005       9.050960 60.79312 5.811241 50.33648 7.616460 10.45663       9.580239 
1 1 1 -7  31 26 o 24.08102 6.772100 7.814158       4.139376 15.10561       6.737977 3.394171       5.246058 32.81357 8.393569 19.28002 7.595578 13.53355       11.32011 
1 1 1 -7  31 27 o 108.3593 2.947742 145.4831       7.776576 134.0980       13.31131 151.3821       9.581738 102.0845 5.369759 110.1070 3.575771 -8.022476      6.451392 
1 1 1 -7  31 28 o 17.11757 6.147580 3.465675       3.263468 4.993938       6.997008 3.040793       3.689331 21.81754 8.714897 16.97630 6.454731 4.841238       10.84495 
1 1 1 -7  31 29 o 26.93020 5.780737 9.893294       3.680194 10.42675       9.760573 9.804889       3.973459 26.84359 10.42290 26.60142 6.238275 0.2421684      12.14714 
1 1 1 -7  31 30 f 13.54319 5.658499 0.9715501      3.118196 0.9354691      5.863337 0.9857790      3.682060 17.14959 7.473030 14.42719 6.095509 2.722403       9.643723 
1 1 1 -7  31 31 o 14.81901 6.311318 1.085144       4.001186 -3.568805      8.859922 2.277476       4.484539 17.52092 8.217549 16.50278 6.831237 1.018139       10.68616 
1 1 1 -7  31 32 o 54.32394 3.986765 38.40611       5.240983 34.78320       8.260095 40.84749       6.780690 48.40828 7.222787 54.92145 5.125545 -6.513165      8.856627 
1 1 1 -7  31 33 o 35.89444 4.801840 17.54082       4.094943 13.73408       9.483183 18.41332       4.540029 26.54567 10.28295 36.41518 5.269082 -9.869511      11.55432 
1 1 1 -7  31 34 o 9.831974 4.716070 -3.616254      3.256493 -7.024722      7.636047 -2.858549      3.600304 14.34046 6.962029 10.89298 5.148654 3.447478       8.659011 
1 1 1 -7  31 35 o 14.26329 5.931339 1.919846       3.402657 -1.074063      5.856792 3.445273       4.180576 14.69438 6.821434 16.49526 6.684448 -1.800879      9.550591 
1 1 1 -7  31 36 o 15.02134 6.033202 2.818234       3.372431 9.362402       6.123055 -0.3141981E-01 4.040517 21.98642 8.325725 13.09423 5.921328 8.892190       10.21664 
1 1 1 -7  31 37 o 22.37461 6.192252 8.144044       3.490839 6.370291       6.209109 8.963812       4.221125 18.91821 7.949841 22.65705 6.968327 -3.738846      10.57154 
1 1 1 -7  31 38 o 10.94360 5.285881 -3.860814      4.261000 -4.943614      5.843714 -2.631551      6.226402 12.38158 6.029055 13.60463 6.524491 -1.223054      8.883608 
1 1 1 -7  32 1  o 75.36971 3.162837 69.55962       5.796200 77.76077       8.557571 62.60825       7.878590 79.51382 4.433996 71.30083 4.558251 8.212990       6.359086 
1 1 1 -7  32 2  o 57.56407 3.527592 40.68614       4.924650 37.56619       7.047262 43.66373       6.884600 55.02670 5.321802 59.45548 4.792287 -4.428780      7.161535 
1 1 1 -7  32 3  o 163.8767 3.149234 328.2636       12.57646 307.9136       18.64634 345.2472       17.03436 158.3017 4.839296 167.8631 4.164229 -9.561386      6.384324 
1 1 1 -7  32 4  o 237.6729 4.229654 692.2671       24.49744 696.5450       34.16206 687.7387       35.14820 237.7613 5.896127 236.0785 6.114716 1.682846       8.494355 
1 1 1 -7  32 5  o 111.8204 2.944871 152.8904       8.017613 152.2746       11.97719 153.3903       10.79238 111.3491 4.422793 111.8433 3.966058 -0.4942017     5.940599 
1 1 1 -7  32 6  o 95.54317 3.289131 111.7593       7.646606 94.75937       12.91012 120.9460       9.490392 87.44090 6.096897 99.29762 3.929775 -11.85672      7.253639 
1 1 1 -7  32 7  o 44.43947 4.013544 24.38914       4.299634 19.27619       5.961246 29.93311       6.207423 38.99240 6.502524 49.05676 5.275300 -10.06436      8.373267 
1 1 1 -7  32 8  o 107.1639 2.937264 140.4583       7.663340 150.4203       11.64268 132.8432       10.17933 110.6613 4.325718 104.0427 4.022449 6.618675       5.906940 
1 1 1 -7  32 9  o 73.51426 3.615927 66.32080       6.457921 71.19573       12.97803 64.71648       7.445111 75.42227 7.146360 72.52178 4.231136 2.900490       8.304997 
1 1 1 -7  32 10 o 63.23405 3.909764 49.18590       5.995265 64.27278       12.60453 44.77472       6.815605 71.55283 7.332356 60.19266 4.683317 11.36018       8.700397 
1 1 1 -7  32 11 o 44.68980 4.635379 24.79791       4.974892 30.98549       10.30219 22.91625       5.681191 48.95300 8.966355 42.75586 5.586112 6.197136       10.56410 
1 1 1 -7  32 12 o 80.24929 3.946074 79.16560       7.693231 75.72076       13.74596 80.73679       9.283335 77.63508 7.353410 80.88918 4.730171 -3.254097      8.743406 
1 1 1 -7  32 13 o 68.17068 3.680455 57.12886       6.091468 65.62503       12.66750 54.57325       6.947467 72.19487 7.300475 66.51381 4.309458 5.681061       8.477521 
1 1 1 -7  32 14 o 25.36391 6.781704 8.288817       4.272673 17.10587       9.392926 5.988420       4.797782 36.05814 10.22248 22.43134 7.484179 13.62681       12.66934 
1 1 1 -7  32 15 o 99.81793 3.307219 122.2240       8.033550 134.5002       17.27996 118.8390       9.073763 103.5832 6.884769 98.31963 3.794260 5.263557       7.861072 
1 1 1 -7  32 16 o 87.48050 3.373260 93.98542       7.177655 94.11307       15.16127 93.94855       8.148679 86.31905 7.275300 87.36256 3.836952 -1.043510      8.225095 
1 1 1 -7  32 17 o 121.1221 3.292126 180.1034       9.708070 172.9942       20.23206 182.2298       11.06511 117.1017 7.123610 121.7048 3.735310 -4.603043      8.043530 
1 1 1 -7  32 18 o 69.90919 3.304862 60.13784       5.614258 63.66711       10.22160 58.61316       6.718392 71.17527 5.947554 68.85312 4.021614 2.322151       7.179608 
1 1 1 -7  32 19 o 51.69957 4.120549 33.20054       5.148396 30.79900       13.77671 33.59036       5.550541 46.83442 12.01362 51.92807 4.428506 -5.093655      12.80385 
1 1 1 -7  32 20 o 93.31442 3.038423 107.0644       6.900074 115.4599       12.41163 103.3090       8.301092 96.02425 5.324951 91.45100 3.732711 4.573250       6.502941 
1 1 1 -7  32 21 o 89.43245 3.024798 98.45097       6.582670 105.3531       12.03322 95.50340       7.863609 91.50999 5.420347 87.86803 3.680592 3.641968       6.551864 
1 1 1 -7  32 22 f 38.86140 5.171532 19.26081       4.776032 18.16389       7.504772 20.00746       6.191706 36.45038 8.590474 39.04401 6.751807 -2.593628      10.92626 
1 1 1 -7  32 23 o 52.86098 4.274817 35.06517       5.459727 39.81837       8.602571 31.85928       7.064960 55.34964 6.501728 49.69905 5.951665 5.650585       8.814465 
1 1 1 -7  32 24 o 32.34202 6.589200 13.98706       5.016696 14.35550       6.849129 13.56062       7.368687 32.01092 8.598476 31.00835 9.134995 1.002565       12.54520 
1 1 1 -7  32 25 o 74.84742 3.046923 69.46108       5.545817 69.61723       9.636422 69.38376       6.781404 73.58311 5.411911 74.47657 3.748542 -0.8934631     6.583339 
1 1 1 -7  32 26 o 30.98931 4.996618 12.54981       3.645025 12.60545       7.136301 12.53016       4.239801 29.40051 9.063726 30.58241 5.902831 -1.181904      10.81640 
1 1 1 -7  32 27 o 40.70348 4.102618 21.16454       4.013918 15.74724       7.319759 23.49407       4.799974 32.40871 8.965714 42.60787 4.700937 -10.19916      10.12338 
1 1 1 -7  32 28 o 18.71820 6.118904 4.672979       3.212291 10.61826       6.239659 2.529027       3.746990 26.62787 8.513371 16.24379 6.413127 10.38408       10.65860 
1 1 1 -7  32 29 o 14.75678 5.881817 1.971338       3.180363 0.4460202      5.805805 2.625276       3.801463 16.67328 7.345736 16.26125 6.447068 0.4120274      9.773664 
1 1 1 -7  32 30 o 16.86598 6.698102 3.042457       4.109826 1.291409       8.753438 3.537607       4.654773 19.52800 8.783349 17.84900 7.115298 1.678997       11.30375 
1 1 1 -7  32 31 o 56.00402 4.406537 41.43460       5.965441 34.03891       11.27190 44.31194       7.030758 42.97958 10.78180 57.19096 5.098128 -14.21138      11.92636 
1 1 1 -7  32 32 f 13.51101 5.824208 0.7439512      3.484121 -1.163126      8.293695 1.152631       3.839331 17.38783 8.087331 14.36802 6.152457 3.019813       10.16158 
1 1 1 -7  32 33 o 55.08833 3.767256 39.89077       5.026887 36.49136       11.42295 40.70721       5.598094 42.05341 11.01684 55.17507 4.194967 -13.12166      11.78849 
1 1 1 -7  32 34 f 13.99448 5.947265 1.525580       3.539584 2.288301       6.273728 1.169430       4.287059 16.91958 7.535347 14.49435 6.351336 2.425233       9.854995 
1 1 1 -7  32 35 o 14.01227 6.092789 1.358481       3.879837 4.443047       6.290470 -0.5354136     4.929059 17.93492 7.778519 13.78055 6.347782 4.154372       10.03990 
1 1 1 -7  32 36 o 34.73037 4.699054 17.25131       3.875068 16.53190       7.201758 17.54447       4.597312 27.46816 9.169550 33.81550 5.786858 -6.347343      10.84290 
1 1 1 -7  33 1  o 203.8789 4.561499 510.6901       22.66293 490.6485       36.92316 522.8043       28.70643 198.2162 7.658463 205.7145 5.731939 -7.498367      9.565939 
1 1 1 -7  33 2  o 53.97341 4.204976 35.95645       5.487079 39.86389       10.49951 34.48830       6.435882 55.99503 7.914984 52.69704 5.074376 3.297993       9.401929 
1 1 1 -7  33 3  o 133.4178 3.446175 218.0568       11.19499 183.0572       19.71742 234.7068       13.59958 121.3181 6.695390 138.2836 4.040029 -16.96553      7.819851 
1 1 1 -7  33 4  o 28.67234 6.558207 10.58507       4.482559 10.17558       7.588965 10.80449       5.555182 28.80651 9.404225 28.93045 7.731711 -0.1239376     12.17451 
1 1 1 -7  33 5  o 97.32160 2.988753 115.9311       7.079790 120.3498       10.69295 112.4820       9.447069 98.89096 4.448547 95.67727 4.061076 3.213692       6.023447 
1 1 1 -7  33 6  o 28.78941 6.635364 10.68215       4.559635 7.752203       8.446712 11.88702       5.416623 27.02937 9.864666 30.30418 7.399957 -3.274813      12.33171 
1 1 1 -7  33 7  o 116.7044 2.957962 166.6718       8.405545 163.0745       12.49941 169.6416       11.35701 115.1195 4.464044 117.5375 3.970778 -2.417984      5.974509 
1 1 1 -7  33 8  o 12.77856 5.624870 -0.9047261     3.397215 -2.530659      4.537887 1.168446       5.124129 13.78872 6.251303 17.65183 7.304072 -3.863114      9.613962 
1 1 1 -7  33 9  o 40.42884 5.267718 20.49266       5.066492 14.52407       9.490646 22.87158       5.991699 33.64820 10.46581 42.59752 5.932809 -8.949318      12.03044 
1 1 1 -7  33 10 o 50.81211 5.095696 32.15376       6.224608 31.23588       10.55206 32.64362       7.708686 48.94660 9.183889 50.90330 6.352253 -1.956696      11.16669 
1 1 1 -7  33 11 o 25.31634 7.622728 8.129379       5.087268 18.98848       9.044601 3.104093       6.152802 37.87779 9.743473 20.69007 8.202351 17.18772       12.73632 
1 1 1 -7  33 12 o 16.12460 6.622926 1.151087       4.171748 7.895055       8.334317 -1.103512      4.818889 26.91866 9.802691 15.27258 6.711775 11.64608       11.88026 
1 1 1 -7  33 13 f 86.27099 3.429622 91.43685       7.195828 74.09052       14.12727 97.51393       8.361844 76.34783 7.698221 88.99871 3.864726 -12.65088      8.613868 
1 1 1 -7  33 14 o 51.29096 4.113468 32.59247       5.098372 41.96760       11.15996 30.11974       5.731430 56.97190 8.280594 49.13281 4.850101 7.839088       9.596443 
1 1 1 -7  33 15 o 18.32668 6.777495 3.381996       4.008438 22.28282       9.275874 -0.9580340     4.444889 40.77859 9.509939 14.68273 6.449521 26.09587       11.49066 
1 1 1 -7  33 16 o 119.4494 3.307313 175.3951       9.617831 182.4206       20.39389 173.3857       10.90691 120.0059 7.004110 118.6033 3.778534 1.402618       7.958322 
1 1 1 -7  33 17 o 87.46655 3.333174 94.19366       7.091540 120.8051       16.53277 88.19351       7.850410 97.41551 7.011263 84.49181 3.822680 12.92370       7.985655 
1 1 1 -7  33 18 o 36.96532 6.143660 17.62467       5.340054 0.000000       0.000000 17.62467       5.340054 ?        ?        36.96532 6.143660 0.000000       6.143660 
1 1 1 -7  33 19 o 89.26685 3.575871 98.50308       7.762977 100.6497       11.68399 96.80657       10.38710 89.43285 5.386110 87.96065 4.864797 1.472206       7.257853 
1 1 1 -7  33 20 o 56.61876 4.130781 40.01936       5.660181 43.56060       8.721081 37.44202       7.440080 58.22028 6.244408 54.16226 5.723423 4.058022       8.470549 
1 1 1 -7  33 21 o 78.37115 3.655181 76.27901       6.961508 92.22666       10.91188 65.33293       9.040249 85.34365 5.272518 71.81886 5.200652 13.52480       7.405824 
1 1 1 -7  33 22 o 54.32974 3.498464 36.75195       4.607194 28.70868       8.063653 40.65019       5.613708 46.28372 7.398386 56.93805 4.072760 -10.65434      8.445324 
1 1 1 -7  33 23 o 21.23377 6.542322 5.946560       3.718757 5.682762       6.247743 6.091296       4.627820 22.32333 8.419728 21.77903 7.351316 0.5442963      11.17737 
1 1 1 -7  33 24 o 87.36097 2.979036 94.67657       6.332766 98.66676       11.12585 92.76427       7.702189 87.58272 5.236806 86.07133 3.680641 1.511383       6.400879 
1 1 1 -7  33 25 o 24.48743 5.859075 8.139961       3.449430 17.21180       6.659648 4.813796       4.032510 34.63248 8.045129 19.53308 6.851531 15.09940       10.56729 
1 1 1 -7  33 26 o 13.26366 5.656362 0.4386647      3.221298 8.379407       6.322314 -2.345572      3.743679 24.35515 8.576128 11.93661 5.510468 12.41854       10.19388 
1 1 1 -7  33 27 o 31.20749 4.899589 12.93905       3.603488 15.50430       6.567345 11.83406       4.310286 31.95183 8.345056 29.09124 6.265372 2.860590       10.43527 
1 1 1 -7  33 28 o 14.20057 6.009949 0.9898857      3.589437 3.345189       5.806812 -0.4665990     4.566330 18.73714 7.766317 14.39484 6.418674 4.342294       10.07547 
1 1 1 -7  33 29 o 18.33439 7.037666 4.206491       4.412997 10.45844       9.197675 2.336883       5.029740 25.18380 10.01414 17.01920 7.153675 8.164598       12.30683 
1 1 1 -7  33 30 o 48.86066 3.988069 31.20285       4.707249 23.75206       10.45867 33.09560       5.271348 34.60727 11.01731 49.99471 4.370654 -15.38744      11.85259 
1 1 1 -7  33 31 o 33.32415 5.287873 15.54751       4.150896 10.68858       9.076834 16.83236       4.667552 24.16401 9.828349 34.26905 5.795635 -10.10504      11.40990 
1 1 1 -7  33 32 o 47.60723 4.104342 30.29123       4.715151 29.51257       10.40781 30.49232       5.289065 37.48074 10.80434 47.17740 4.661395 -9.696659      11.76701 
1 1 1 -7  33 33 o 15.96878 6.374125 3.266948       3.740417 -2.949402      6.407868 6.479768       4.606691 14.28990 6.787714 19.85514 7.278889 -5.565248      9.952652 
1 1 1 -7  33 34 o 23.09091 6.947055 9.032251       4.226616 8.239337       6.327821 9.670967       5.679307 20.86797 8.303513 22.56022 8.108898 -1.692251      11.60614 
1 1 1 -7  33 35 o 12.09474 5.401383 0.1876925      3.246694 4.142030       5.791516 -1.624551      3.920701 17.20986 7.463857 11.74948 5.496407 5.460384       9.269285 
1 1 1 -7  34 1  o 26.25581 5.916566 8.878618       3.694579 9.286996       5.066918 8.415009       5.398696 26.82497 7.474056 25.78447 7.871285 1.040499       10.85443 
1 1 1 -7  34 2  o 40.77482 5.263299 20.86699       5.107942 19.49872       7.417573 22.10101       7.044314 38.68505 8.127160 41.48728 7.230353 -2.802223      10.87790 
1 1 1 -7  34 3  o 29.21395 6.697467 11.04491       4.665983 2.788957       6.566858 19.46294       6.631002 20.90286 8.410740 38.86388 7.268740 -17.96102      11.11644 
1 1 1 -7  34 4  o 111.2589 3.258957 151.7761       8.826356 147.5614       11.82533 157.0775       13.26266 109.4073 4.444632 112.7659 4.837577 -3.358536      6.569392 
1 1 1 -7  34 5  o 77.02045 4.099434 73.11305       7.666532 76.08801       12.68616 71.40152       9.622378 77.83221 6.755428 75.83783 5.238869 1.994377       8.548776 
1 1 1 -7  34 6  o 115.1371 3.908392 163.0178       10.95013 166.1704       18.82694 161.4061       13.46117 115.2182 6.734731 114.2856 4.844416 0.9325562      8.296082 
1 1 1 -7  34 7  o 87.81763 4.021713 94.98867       8.583699 90.17640       14.33745 97.67718       10.71649 84.63231 7.014798 88.80413 4.971884 -4.171822      8.598083 
1 1 1 -7  34 8  o 101.1545 3.961224 125.9669       9.745644 152.0303       17.58430 114.4119       11.70834 110.1808 6.579083 96.09547 5.017222 14.08533       8.273866 
1 1 1 -7  34 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -7  34 10 o 15.11223 6.533050 -0.3669979     4.408405 -0.2556898     7.886260 -0.4175875     5.316656 20.24339 8.744582 16.56835 7.168547 3.675045       11.30733 
1 1 1 -7  34 11 o 16.42524 7.171704 -0.8154685     5.423211 -3.737113      7.864032 1.834066       7.488872 18.21682 8.247060 21.12857 8.793885 -2.911751      12.05597 
1 1 1 -7  34 12 o 89.90538 4.028875 99.80673       8.804422 95.30803       15.01237 102.1654       10.87012 86.61876 7.176512 90.66479 4.938585 -4.046036      8.711598 
1 1 1 -7  34 13 o 63.59840 4.327773 50.19960       6.667325 48.72565       12.30500 50.81219       7.932734 61.11325 8.491562 63.74763 5.150308 -2.634377      9.931379 
1 1 1 -7  34 14 o 103.8434 3.894826 133.1870       9.838585 136.0155       17.07214 131.7805       12.03877 103.5299 6.804566 102.9283 4.812994 0.6015778      8.334688 
1 1 1 -7  34 15 o 90.77387 3.860997 101.8911       8.521251 120.1346       15.63851 94.18723       10.16239 97.22768 6.640245 86.91317 4.816996 10.31451       8.203433 
1 1 1 -7  34 16 o 73.97432 4.210168 68.02471       7.558222 71.16676       13.40936 66.56165       9.150259 74.10402 7.530033 72.79831 5.192019 1.305710       9.146500 
1 1 1 -7  34 17 o 36.84276 6.838821 17.83846       5.914019 0.000000       0.000000 17.83846       5.914019 ?        ?        36.84276 6.838821 0.000000       6.838821 
1 1 1 -7  34 18 o 68.07734 4.183608 57.83697       6.906960 42.83340       11.02132 67.54045       8.863395 56.63020 8.226854 73.22675 4.996943 -16.59655      9.625516 
1 1 1 -7  34 19 o 51.72506 3.999427 33.47068       5.002080 42.05825       10.38244 30.87485       5.708243 56.14315 7.798984 49.38189 4.804152 6.761261       9.159914 
1 1 1 -7  34 20 o 29.02789 5.639658 11.06806       3.845577 10.01569       6.942683 11.53384       4.618863 27.21415 9.000659 29.31258 6.622787 -2.098431      11.17467 
1 1 1 -7  34 21 o 44.59492 3.844944 24.99194       4.137650 23.62823       7.174468 25.67155       5.064798 41.76971 7.314826 44.87115 4.701624 -3.101437      8.695513 
1 1 1 -7  34 22 f 32.32806 5.452065 13.74780       4.142502 14.96390       6.673885 12.98563       5.283496 32.36864 8.391925 30.64737 7.197864 1.721268       11.05593 
1 1 1 -7  34 23 o 13.49352 5.697300 0.5899842      3.213252 2.169677       6.115522 -0.1243635E-01 3.776566 18.82026 7.897995 13.88814 6.025198 4.932123       9.933848 
1 1 1 -7  34 24 o 27.80738 5.547670 10.41437       3.627448 3.307383       6.300526 13.93820       4.436513 19.71648 8.122978 32.10442 5.887659 -12.38793      10.03231 
1 1 1 -7  34 25 o 57.74849 3.401923 42.07914       4.766209 39.95251       8.379664 43.09616       5.794869 53.90467 6.510920 57.98009 4.128374 -4.075428      7.709445 
1 1 1 -7  34 26 o 55.60858 3.875315 39.64703       5.218657 42.54966       8.329268 37.77121       6.695858 55.49291 6.268950 53.20988 5.231470 2.283024       8.165049 
1 1 1 -7  34 27 o 42.97684 4.452881 24.29368       4.596006 23.49485       6.937738 24.91844       6.135426 39.84325 7.418316 42.20567 6.145748 -2.362419      9.633361 
1 1 1 -7  34 28 o 29.56669 6.028815 12.46222       4.196380 5.260454       10.35055 13.87883       4.590583 22.14902 9.781046 31.05717 6.281622 -8.908146      11.62444 
1 1 1 -7  34 29 o 38.42936 4.588717 19.84967       4.212431 29.53024       9.295316 17.34775       4.725528 41.42118 9.422119 35.02156 5.735406 6.399628       11.03047 
1 1 1 -7  34 30 o 12.29253 5.458879 -0.1554797     3.268500 2.354192       6.079080 -1.175993      3.876491 17.35875 7.585861 12.47023 5.701452 4.888520       9.489565 
1 1 1 -7  34 31 f 22.38704 6.174633 7.674030       3.477600 7.307034       6.296194 7.835141       4.171669 20.92742 8.297080 22.07020 6.949706 -1.142780      10.82312 
1 1 1 -7  34 32 o 25.85029 6.513860 10.62723       4.101065 9.610281       6.736754 11.22599       5.169271 22.33673 8.662988 25.25520 7.700745 -2.918474      11.59089 
1 1 1 -7  34 33 f 11.63219 5.313469 -0.7254092     3.356869 1.307766       5.892783 -1.702159      4.084367 15.69106 7.117692 12.04429 5.626346 3.646770       9.072888 
1 1 1 -7  34 34 o 10.13862 4.871325 -3.367535      3.507551 10.04679       9.442486 -5.514821      3.777869 20.92154 9.285316 9.605399 4.713158 11.31614       10.41302 
1 1 1 -7  35 1  o 100.5602 3.416967 124.3329       8.361258 125.4914       15.36268 123.8454       9.966715 99.94168 6.340582 100.1674 4.091709 -0.2257156     7.546196 
1 1 1 -7  35 2  o 85.37658 3.004336 89.46548       6.240881 90.31335       9.039342 88.69319       8.626968 85.44033 4.355854 84.71593 4.191872 0.7244034      6.045267 
1 1 1 -7  35 3  o 88.76742 3.042985 96.72262       6.572746 91.62220       9.624496 101.1803       8.997665 85.98062 4.610333 90.52606 4.089242 -4.545441      6.162554 
1 1 1 -7  35 4  f 43.57803 4.143535 23.61269       4.347338 22.16696       5.959991 25.25648       6.355146 41.74092 6.034232 44.61581 5.996941 -2.874882      8.507365 
1 1 1 -7  35 5  o 91.96701 3.029316 103.8195       6.779844 114.7856       10.17617 95.06643       9.091544 96.33871 4.345771 87.67995 4.267838 8.658768       6.090990 
1 1 1 -7  35 6  o 137.8137 3.065696 232.9506       10.29574 241.4246       15.67308 226.5180       13.65534 139.6452 4.611989 135.4690 4.141299 4.176193       6.198452 
1 1 1 -7  35 7  o 133.7781 3.351926 219.9726       10.91876 201.0181       14.30208 246.4551       16.90524 127.3835 4.614963 140.9019 4.931039 -13.51833      6.753741 
1 1 1 -7  35 8  o 55.55349 3.826171 38.19013       5.148150 36.46850       6.532260 41.01250       8.363734 53.98019 5.023502 56.92118 6.125947 -2.940987      7.922298 
1 1 1 -7  35 9  o 42.23027 4.794480 22.38688       4.846801 17.04633       9.135026 24.47933       5.718000 35.47584 10.08914 44.00365 5.448666 -8.527809      11.46642 
1 1 1 -7  35 10 o 78.85362 3.595382 76.71577       6.890625 77.85838       13.34642 76.30050       8.045907 78.06658 7.092929 78.45468 4.224004 -0.3880997     8.255414 
1 1 1 -7  35 11 o 109.8834 3.367772 148.6951       9.007372 155.4740       18.45849 146.5763       10.31944 110.5316 6.887107 108.9026 3.894766 1.628944       7.912107 
1 1 1 -7  35 12 o 64.26304 3.725767 51.12662       5.809608 48.74998       11.81296 51.88483       6.672277 60.97462 8.154354 64.58283 4.263410 -3.608212      9.201638 
1 1 1 -7  35 13 o 42.44849 4.781531 22.71425       4.860181 22.65211       9.587987 22.73574       5.638241 40.49098 9.819390 42.20583 5.621620 -1.714844      11.31473 
1 1 1 -7  35 14 o 25.44888 6.401305 8.546423       3.965611 15.35130       7.727506 6.113638       4.620415 33.43340 9.197621 22.13523 7.343411 11.29816       11.76953 
1 1 1 -7  35 15 o 22.39655 7.362466 6.342319       4.647864 0.000000       0.000000 6.342319       4.647864 ?        ?        22.39655 7.362466 0.000000       7.362466 
1 1 1 -7  35 16 o 56.72195 4.475754 40.42614       6.136522 0.000000       0.000000 40.42614       6.136522 ?        ?        56.72195 4.475754 0.000000       4.475754 
1 1 1 -7  35 17 f 46.92638 4.225810 27.70263       4.780692 23.86200       9.925550 28.86276       5.455163 40.75395 10.05665 47.71096 4.755207 -6.957008      11.12422 
1 1 1 -7  35 18 o 30.06456 5.880795 11.93950       4.154109 15.50725       7.760814 10.50683       4.917953 32.98368 9.271728 27.76740 7.206284 5.216284       11.74289 
1 1 1 -7  35 19 f 60.15268 3.635693 45.23199       5.304519 48.80429       10.55668 44.02538       6.135307 60.26589 7.339369 59.04950 4.292995 1.216389       8.502714 
1 1 1 -7  35 20 o 38.88728 5.322027 19.71659       4.911186 28.81810       9.651320 16.53635       5.705054 44.62330 9.181852 34.76839 6.976290 9.854912       11.53148 
1 1 1 -7  35 21 o 49.74744 3.668548 31.17447       4.416062 34.04545       7.615447 29.71997       5.420475 50.44904 6.333744 48.07628 4.686098 2.372753       7.878821 
1 1 1 -7  35 22 f 19.35750 6.344746 4.954404       3.452759 2.961699       6.246490 5.831107       4.143248 19.40808 8.050632 20.85546 6.954878 -1.447388      10.63875 
1 1 1 -7  35 23 o 60.72481 3.428714 46.50612       5.053189 45.30239       8.737715 47.11103       6.194072 57.67618 6.320156 60.59703 4.220972 -2.920845      7.600064 
1 1 1 -7  35 24 o 30.35353 6.110607 12.83691       4.363328 16.32098       6.868269 10.47924       5.649962 32.49792 8.556644 26.34208 8.054484 6.155840       11.75121 
1 1 1 -7  35 25 o 30.13208 6.135061 12.80235       4.351603 11.11642       6.832832 13.95278       5.644292 26.36820 8.932450 30.40532 7.630700 -4.037119      11.74803 
1 1 1 -7  35 26 o 86.01409 3.406746 94.19788       7.126653 80.49933       14.77954 98.34793       8.134867 71.77779 8.621966 87.39987 3.828764 -15.62209      9.433862 
1 1 1 -7  35 27 o 27.93569 6.618491 11.57255       4.436032 0.000000       0.000000 11.57255       4.436032 ?        ?        27.93569 6.618491 0.000000       6.618491 
1 1 1 -7  35 28 o 33.92091 5.041271 15.88025       4.040677 14.13227       8.422242 16.40289       4.605294 27.21282 9.862328 33.88581 5.784502 -6.672997      11.43355 
1 1 1 -7  35 29 o 14.46995 5.944482 1.974277       3.361685 2.105940       5.904490 1.911128       4.089146 16.94154 7.437833 15.17985 6.419068 1.761694       9.824755 
1 1 1 -7  35 30 o 24.40189 6.113205 9.110177       3.627218 8.971894       6.470769 9.173537       4.380075 22.22215 8.524004 23.65262 7.061911 -1.430477      11.06929 
1 1 1 -7  35 31 o 10.01652 4.835511 -4.028122      3.554202 -7.127188      5.409553 -1.674162      4.714607 11.50741 5.645096 12.98060 6.057508 -1.473185      8.280128 
1 1 1 -7  35 32 o 9.084756 4.443748 -4.834149      3.279107 -5.907952      5.927883 -4.360700      3.936169 12.41710 6.052132 10.41703 5.043349 2.000068       7.878049 
1 1 1 -7  35 33 o 12.23814 5.491837 0.1079584      3.400238 3.368242       6.012560 -1.424994      4.122836 16.76727 7.427176 12.13991 5.664997 4.627353       9.341045 
1 1 1 -7  36 1  o 63.71190 3.332148 50.08268       5.155477 55.30172       7.445536 45.27565       7.145600 66.58701 4.617090 60.12218 4.920166 6.464821       6.747262 
1 1 1 -7  36 2  o 60.32710 4.027795 45.17368       5.887363 63.69129       10.66895 37.06610       7.059512 70.83655 6.244430 54.20435 5.416947 16.63220       8.266573 
1 1 1 -7  36 3  o 65.78831 3.351983 53.39644       5.356152 55.71480       7.558059 51.05750       7.591536 66.82191 4.670879 63.87358 4.914989 2.948330       6.780430 
1 1 1 -7  36 4  o 96.84824 2.988278 115.3076       7.044155 107.0073       10.13317 123.0696       9.799109 92.77339 4.495525 99.69500 4.041833 -6.921608      6.045342 
1 1 1 -7  36 5  o 66.13678 3.285515 53.94827       5.278625 51.27599       7.313049 56.85497       7.627053 64.06229 4.717553 67.49176 4.666073 -3.429466      6.635325 
1 1 1 -7  36 6  o 55.16943 3.776150 37.74548       5.046116 39.93397       6.411689 34.18390       8.179403 56.48822 4.700324 51.53905 6.668695 4.949169       8.158710 
1 1 1 -7  36 7  o 54.95424 3.454139 37.35864       4.602299 35.47406       6.558854 39.18658       6.459549 53.06219 5.136477 55.90923 4.787164 -2.847046      7.021420 
1 1 1 -7  36 8  o 55.77932 3.464559 38.50444       4.686063 50.26265       6.992322 28.91780       6.313703 63.42304 4.554487 47.70679 5.533362 15.71626       7.166690 
1 1 1 -7  36 9  o 32.08888 6.021550 13.39537       4.535774 19.59966       8.447157 10.88180       5.376633 37.77266 9.251585 28.53273 7.597880 9.239929       11.97162 
1 1 1 -7  36 10 o 58.70465 3.906306 42.86787       5.556446 39.82472       10.57649 44.02797       6.530225 54.74186 8.178828 59.28173 4.555245 -4.539871      9.361811 
1 1 1 -7  36 11 o 60.31472 3.935481 45.29250       5.752795 27.67450       10.22223 53.45870       6.959490 44.63187 9.677986 65.38084 4.393590 -20.74897      10.62860 
1 1 1 -7  36 12 o 54.68214 3.996672 37.32757       5.288963 36.12547       10.44367 37.74221       6.133679 51.66331 8.597361 54.76131 4.639965 -3.097996      9.769539 
1 1 1 -7  36 13 o 12.60655 5.682319 -1.603253      3.685901 -4.406777      6.149896 -0.3165120E-01 4.604546 15.10984 7.005927 15.47990 6.684351 -0.3700638     9.683159 
1 1 1 -7  36 14 o 24.48516 7.524841 7.989195       4.923429 0.000000       0.000000 7.989195       4.923429 ?        ?        24.48516 7.524841 0.000000       7.524841 
1 1 1 -7  36 15 o 39.72846 4.699976 20.12113       4.462216 21.61087       8.616690 19.57521       5.216118 39.01397 9.211744 38.79293 5.686487 0.2210388      10.82554 
1 1 1 -7  36 16 o 46.92115 4.330920 27.86631       4.896195 18.49596       8.933009 31.89012       5.853809 35.51173 9.934780 49.98262 4.867588 -14.47089      11.06315 
1 1 1 -7  36 17 o 46.53050 4.183536 27.41654       4.693110 29.62270       8.703828 26.51220       5.572591 46.22913 8.016506 45.32455 5.135708 0.9045792      9.520497 
1 1 1 -7  36 18 o 39.10388 4.704494 19.69511       4.393063 11.34767       7.435184 24.17215       5.445160 28.07005 9.315539 43.07739 5.298610 -15.00734      10.71702 
1 1 1 -7  36 19 o 19.60586 6.957781 4.805682       4.167908 3.859086       6.451697 5.483693       5.460217 20.44922 8.297649 21.21198 7.897829 -0.7627544     11.45542 
1 1 1 -7  36 20 o 22.17293 7.311611 6.756618       4.582572 11.42611       8.303757 4.711693       5.495139 27.61761 9.818842 20.28925 7.836197 7.328358       12.56247 
1 1 1 -7  36 21 o 25.49614 7.194736 9.353115       4.663847 15.79048       8.796072 6.835610       5.500725 31.18517 10.12061 22.32947 7.985824 8.855696       12.89186 
1 1 1 -7  36 22 o 73.36636 4.001921 68.98055       7.127775 67.56220       13.09543 69.57764       8.496634 67.76989 8.089045 72.89655 4.809917 -5.126663      9.411054 
1 1 1 -7  36 23 o 46.63098 3.973558 28.07264       4.472363 32.36657       8.049019 26.15486       5.379171 47.29312 7.211922 44.22911 5.083107 3.064011       8.823253 
1 1 1 -7  36 24 f 29.24073 6.121233 12.14910       4.221622 12.87210       9.576960 11.97473       4.703231 27.10928 10.37720 28.52383 6.852260 -1.414547      12.43542 
1 1 1 -7  36 25 o 54.05701 3.942664 37.98762       5.158001 41.92650       11.31820 36.95513       5.794726 49.88942 9.658725 52.77383 4.550260 -2.884415      10.67688 
1 1 1 -7  36 26 o 33.28976 5.698202 15.68573       4.456472 17.86594       11.26602 15.28130       4.852235 28.92810 11.20736 32.28157 6.394312 -3.353470      12.90319 
1 1 1 -7  36 27 o 27.63947 5.798808 11.10641       3.780935 9.615056       6.622049 11.82773       4.605411 23.51863 8.708712 27.64558 6.866991 -4.126949      11.09041 
1 1 1 -7  36 28 o 17.58067 6.334224 4.473739       3.467851 2.883819       6.050312 5.251612       4.231991 17.44303 7.596211 18.72345 6.956545 -1.280428      10.30029 
1 1 1 -7  36 29 o 30.55390 5.311023 13.51180       3.810940 20.24018       6.895147 10.55243       4.572867 33.63293 8.430147 25.22246 7.126533 8.410471       11.03879 
1 1 1 -7  36 30 o 40.67273 6.049623 25.13521       5.813806 32.64118       7.713704 15.26380       8.846050 44.38798 7.390952 25.45551 9.911738 18.93246       12.36401 
1 1 1 -7  36 31 o 12.83794 5.670448 0.6107903      3.480532 -2.775711      5.909069 2.409871       4.306939 13.57186 6.466882 15.21401 6.515573 -1.642145      9.180046 
1 1 1 -7  37 1  o 31.82536 5.131845 13.01695       3.844658 10.72206       5.062963 16.14274       5.908860 28.25651 7.300907 34.77926 7.208818 -6.522753      10.26013 
1 1 1 -7  37 2  o 47.11469 4.854459 28.06856       5.493879 25.20049       5.973794 43.79787       13.98975 44.32838 5.658953 55.66455 10.70189 -11.33617      12.10596 
1 1 1 -7  37 3  o 24.38229 6.561238 7.874393       3.983678 11.21308       4.812014 0.6021538      7.101872 28.98376 6.910692 19.42358 8.343397 9.560183       10.83374 
1 1 1 -7  37 4  f 29.18728 6.204383 11.22575       4.276867 11.51068       4.557473 9.123284       12.37982 29.47151 6.518842 29.28893 11.62724 0.1825771      13.32997 
1 1 1 -7  37 5  o 43.12527 4.472383 23.43878       4.631941 25.93376       5.907664 19.45759       7.462571 45.02057 5.498767 37.77243 8.331420 7.248138       9.982434 
1 1 1 -7  37 6  o 90.17535 3.364552 100.6055       7.380553 88.28965       9.429550 120.0829       11.85834 83.89655 4.630183 97.65363 4.999741 -13.75709      6.814397 
1 1 1 -7  37 7  o 28.85067 6.097421 10.97934       4.152466 13.64087       5.117198 5.847510       7.105638 32.00355 6.772942 23.42662 8.945706 8.576923       11.22045 
1 1 1 -7  37 8  o 32.32154 5.251510 13.48954       3.994452 10.61944       4.844192 19.58689       7.060616 28.08169 7.081320 37.98372 7.886272 -9.902029      10.59898 
1 1 1 -7  37 9  o 20.93989 7.020652 5.497561       4.221193 15.40212       8.173152 1.894515       4.929545 33.00032 9.592891 17.59633 7.210269 15.40400       12.00048 
1 1 1 -7  37 10 o 18.46622 6.965534 3.517192       4.276188 8.734454       7.606491 1.106408       5.170614 26.19579 9.388190 17.19790 7.242398 8.997894       11.85708 
1 1 1 -7  37 11 o 87.36037 3.558090 94.91891       7.558885 108.4305       14.80107 90.15151       8.791856 91.07941 6.715868 84.75607 4.270466 6.323341       7.958628 
1 1 1 -7  37 12 o 55.18920 5.015935 38.88365       6.672317 22.46536       10.22474 51.06078       8.805639 38.88031 10.53275 62.82819 5.817410 -23.94789      12.03250 
1 1 1 -7  37 13 o 32.63678 8.779946 15.21495       7.134661 0.000000       0.000000 15.21495       7.134661 ?        ?        32.63678 8.779946 0.000000       8.779946 
1 1 1 -7  37 14 o 28.36077 7.460608 11.19300       5.224464 16.44032       8.953300 8.483801       6.433308 33.15076 10.13983 25.09688 8.662966 8.053879       13.33653 
1 1 1 -7  37 15 o 49.40222 5.055316 31.52533       6.000261 17.91355       9.411599 40.84660       7.788318 34.18125 10.38446 55.80654 5.811998 -21.62529      11.90027 
1 1 1 -7  37 16 f 19.49258 7.313679 4.369355       4.700630 -3.104727      7.191429 9.944731       6.211169 16.79589 7.711351 26.39552 8.499338 -9.599628      11.47622 
1 1 1 -7  37 17 o 20.34291 7.347788 5.216427       4.669991 5.735838       8.045895 4.952547       5.734851 22.93926 9.281446 20.75930 8.008601 2.179962       12.25899 
1 1 1 -7  37 18 o 31.44109 8.155880 14.61183       6.301429 13.12021       8.960130 16.07155       8.863784 28.92188 10.20744 31.65548 10.14952 -2.733606      14.39460 
1 1 1 -7  37 19 o 34.43957 5.367688 15.90875       4.358057 11.20603       8.906572 17.38912       4.997136 26.94564 10.07611 35.67567 5.957911 -8.730036      11.70575 
1 1 1 -7  37 20 o 30.44319 5.675640 12.71871       4.055711 16.97946       7.776651 11.12688       4.753326 32.42529 9.336940 27.64504 7.038372 4.780254       11.69261 
1 1 1 -7  37 21 o 24.05613 6.345541 8.292835       3.772819 9.172770       7.834423 8.027157       4.304867 24.53214 9.386995 23.41141 7.003656 1.120729       11.71183 
1 1 1 -7  37 22 o 22.88252 6.626135 7.644106       3.906355 16.52190       8.809906 5.471514       4.358208 30.53867 10.14040 19.86479 7.107817 10.67388       12.38341 
1 1 1 -7  37 23 o 60.17543 3.759993 46.74210       5.486136 26.59928       9.918333 55.62158       6.585251 38.42659 10.35831 65.25369 4.162956 -26.82710      11.16355 
1 1 1 -7  37 24 o 24.39444 6.845831 9.038738       4.234667 7.993615       10.68582 9.233447       4.612293 23.18790 10.09662 24.40228 7.237157 -1.214384      12.42249 
1 1 1 -7  37 25 o 32.22694 5.187601 14.49604       3.935745 12.35451       6.913982 15.52264       4.787030 26.25979 8.983762 32.45434 6.279871 -6.194555      10.96106 
1 1 1 -7  37 26 o 24.08599 6.234407 8.800098       3.687402 10.58597       6.737328 8.036374       4.405865 24.12991 8.809565 22.36752 7.154064 1.762388       11.34853 
1 1 1 -7  37 27 o 16.17526 6.255939 3.475202       3.505864 7.080555       6.314565 1.868623       4.215223 20.56033 8.256386 15.06862 6.449399 5.491714       10.47677 
1 1 1 -7  37 28 o 20.40692 6.637635 6.724939       3.782400 6.363246       6.435207 6.915846       4.675226 19.67401 8.167048 20.28144 7.348289 -0.6074314     10.98627 
1 1 1 -7  37 29 o 21.14978 7.066097 7.644220       4.276492 11.92873       6.440144 4.264893       5.719528 24.35371 8.648256 17.61477 7.525195 6.738943       11.46390 
1 1 1 -7  37 30 o 19.36895 6.582205 6.218036       3.710502 6.179251       6.517143 6.236638       4.513450 18.99319 8.070693 19.10391 7.166849 -0.1107216     10.79351 
1 1 1 -7  38 1  o 68.64752 3.224854 58.48578       5.379666 53.18606       7.313182 64.73544       7.941603 64.81335 4.661397 71.58126 4.576714 -6.767906      6.532606 
1 1 1 -7  38 2  o 63.89380 3.609343 50.91223       5.596975 57.26968       7.141551 40.79036       9.011181 67.42384 4.370075 55.55526 6.797548 11.86858       8.081102 
1 1 1 -7  38 3  o 68.81356 3.499004 58.95103       5.848261 48.67253       7.277687 77.68764       9.825937 61.89163 4.864378 78.05786 5.195174 -16.16623      7.117023 
1 1 1 -7  38 4  o 48.31923 3.764408 29.24971       4.397589 30.50780       5.995808 27.78501       6.469421 48.80176 5.117726 46.19573 5.879881 2.606033       7.795135 
1 1 1 -7  38 5  o 36.72235 5.291865 17.46807       4.599096 10.31038       7.056670 22.75339       6.063852 27.40480 9.074648 41.59460 6.169075 -14.18980      10.97300 
1 1 1 -7  38 6  o 12.32391 5.400589 -0.4702968     3.100059 -3.983080      4.017426 4.700075       4.873972 11.62367 5.477164 20.27522 7.477862 -8.651549      9.269182 
1 1 1 -7  38 7  o 27.31026 5.468380 9.842240       3.512289 6.201266       4.642381 14.71616       5.371195 21.90727 7.362761 32.93116 6.913672 -11.02388      10.09996 
1 1 1 -7  38 8  o 19.67590 6.095749 5.061530       3.223193 2.440641       4.349903 8.252594       4.799798 17.23127 6.875255 24.59974 7.403616 -7.368467      10.10360 
1 1 1 -7  38 9  o 35.41558 5.504393 16.43679       4.596291 25.32530       8.880214 13.18424       5.371819 42.05420 8.940768 30.89971 7.258216 11.15449       11.51603 
1 1 1 -7  38 10 o 24.78933 6.674954 8.404261       4.121393 8.760469       7.556352 8.253423       4.917177 25.68681 9.336956 24.50518 7.518050 1.181629       11.98749 
1 1 1 -7  38 11 o 22.90070 7.598159 7.047158       4.946513 0.000000       0.000000 7.047158       4.946513 ?        ?        22.90070 7.598159 0.000000       7.598159 
1 1 1 -7  38 12 o 59.08263 3.976387 44.12873       5.691778 40.83697       10.90143 45.36237       6.673626 53.43856 8.668014 59.52440 4.637338 -6.085846      9.830532 
1 1 1 -7  38 13 o 37.01206 5.272938 18.01463       4.621549 15.35754       8.684662 19.06433       5.458632 31.55756 10.03875 37.61072 6.169465 -6.053160      11.78299 
1 1 1 -7  38 14 o 41.91278 4.811404 22.84120       4.825211 10.93903       9.123993 27.46249       5.685305 27.34130 10.20351 45.77540 5.188029 -18.43410      11.44672 
1 1 1 -7  38 15 o 82.11718 3.454278 84.85046       6.896939 78.10870       13.82688 87.08345       7.957578 74.24078 7.757013 82.78687 3.955867 -8.546089      8.707476 
1 1 1 -7  38 16 o 39.15750 4.892634 20.17564       4.567079 10.40503       8.862314 23.70873       5.329224 26.35035 10.00758 42.23182 5.294342 -15.88146      11.32174 
1 1 1 -7  38 17 o 50.00247 4.759934 32.78867       5.730124 32.76078       10.43043 32.80072       6.857646 45.30266 9.737985 49.16462 5.837644 -3.861965      11.35370 
1 1 1 -7  38 18 o 43.48751 4.422859 24.70636       4.621950 13.88222       9.430836 28.12803       5.302393 28.53426 10.42201 46.17039 4.781871 -17.63614      11.46667 
1 1 1 -7  38 19 o 10.59876 5.066756 -4.163758      3.690075 -13.11605      7.325006 -1.119225      4.271705 12.82448 6.343762 13.47874 6.092446 -0.6542606     8.795523 
1 1 1 -7  38 20 o 36.12305 5.177045 17.71385       4.427139 19.72052       9.065484 17.08541       5.073229 33.27296 10.20807 34.71023 6.226552 -1.437263      11.95720 
1 1 1 -7  38 21 o 15.97316 6.427162 2.571394       3.834667 -0.5072786     7.206041 3.787621       4.529210 17.13790 7.811763 17.86364 7.051392 -0.7257404     10.52358 
1 1 1 -7  38 22 o 16.70676 6.327775 3.509375       3.537367 1.036138       6.440359 4.577811       4.233032 17.12438 7.630139 18.41109 6.933448 -1.286711      10.30979 
1 1 1 -7  38 23 o 21.06007 7.068808 6.828716       4.279192 0.000000       0.000000 6.828716       4.279192 ?        ?        21.06007 7.068808 0.000000       7.068808 
1 1 1 -7  38 24 o 14.94136 6.245690 1.962614       3.801677 9.609135       8.098303 -0.1988133     4.305587 23.04560 9.316249 13.72143 6.166836 9.324179       11.17239 
1 1 1 -7  38 25 o 28.17983 5.674669 11.67150       3.761923 6.080762       6.211277 14.91044       4.727677 19.80839 8.102440 31.21195 6.429798 -11.40356      10.34369 
1 1 1 -7  38 26 o 13.83200 5.950140 1.277351       3.621858 6.227008       6.639205 -0.8197534     4.321541 19.72220 8.249629 13.07838 5.994627 6.643819       10.19764 
1 1 1 -7  38 27 o 22.02957 6.841738 8.065152       4.057543 5.670903       7.038000 9.257119       4.965886 19.12641 8.261491 22.82659 7.614122 -3.700180      11.23508 
1 1 1 -7  38 28 o 32.19093 6.108706 16.06175       4.616774 22.37654       7.305655 11.86320       5.957026 34.23175 8.731339 24.64497 8.340421 9.586773       12.07472 
1 1 1 -7  39 1  o 36.28091 4.949024 17.11869       4.261610 11.34941       5.199398 28.92805       7.438847 28.39482 7.429749 46.17759 6.815131 -17.78278      10.08202 
1 1 1 -7  39 2  o 25.12043 5.925158 8.545512       3.567928 5.201389       4.555092 13.85445       5.739313 20.39864 7.270186 31.33171 7.596504 -10.93307      10.51487 
1 1 1 -7  39 3  o 36.82576 4.307435 17.36637       3.792564 14.31361       5.044283 21.33603       5.752152 32.35308 6.621304 39.97455 6.097597 -7.621471      9.001242 
1 1 1 -7  39 4  o 12.16394 5.323406 -0.3447500     3.003213 -2.619408      3.837316 3.250917       4.824576 12.01786 5.558924 18.43992 7.278052 -6.422055      9.158149 
1 1 1 -7  39 5  o 19.08813 6.947592 4.358734       4.185720 1.888483       4.534053 18.60767       10.88948 16.75744 6.895993 34.07565 11.27244 -17.31820      13.21448 
1 1 1 -7  39 6  o 29.33140 5.400656 11.43386       3.718052 13.57129       5.162097 9.129659       5.359709 31.26294 6.955250 25.43585 7.857248 5.827091       10.49342 
1 1 1 -7  39 7  o 15.16053 6.023017 1.932633       3.324303 7.583500       4.639435 -4.029886      4.765654 23.40465 7.323217 12.81856 6.016761 10.58610       9.477919 
1 1 1 -7  39 8  o 12.86170 5.507764 0.2515093      3.077198 -0.1935333     4.200311 0.7671014      4.520993 14.38445 6.295384 15.66514 6.691319 -1.280696      9.187252 
1 1 1 -7  39 9  o 15.62893 6.312812 1.917323       3.714978 4.573173       7.558058 1.071273       4.265857 21.72177 8.917371 15.54298 6.563647 6.178788       11.07253 
1 1 1 -7  39 10 o 18.28248 7.184505 3.419105       4.683271 0.000000       0.000000 3.419105       4.683271 ?        ?        18.28248 7.184505 0.000000       7.184505 
1 1 1 -7  39 11 o 55.32128 3.995143 39.02542       5.349648 38.58060       10.16647 39.19575       6.291056 51.38660 8.409257 54.94944 4.744549 -3.562847      9.655379 
1 1 1 -7  39 12 o 42.56939 5.597465 24.28355       5.666083 20.29930       9.280270 26.65147       7.154357 35.22480 10.21686 43.60340 6.967507 -8.378597      12.36650 
1 1 1 -7  39 13 o 21.08155 6.923247 6.184937       4.110262 3.289699       7.865492 7.272574       4.820874 20.60877 8.815003 22.59298 7.501205 -1.984211      11.57464 
1 1 1 -7  39 14 f 47.80182 4.363698 29.67838       5.027182 29.53310       9.938725 29.72832       5.827667 42.84196 9.740901 47.29126 5.139374 -4.449306      11.01355 
1 1 1 -7  39 15 o 25.25697 7.123650 9.369849       4.573332 4.928069       6.840275 12.96038       6.149992 20.83064 8.509587 28.94564 8.293283 -8.114998      11.88241 
1 1 1 -7  39 16 o 42.28066 4.572200 23.54037       4.636037 12.44740       9.122429 27.40293       5.382992 27.18983 10.19131 45.36615 4.949358 -18.17632      11.32956 
1 1 1 -7  39 17 o 26.27168 6.552279 10.03855       4.180510 -2.875835      7.322188 16.28409       5.092012 16.30346 7.588358 33.77110 6.422032 -17.46764      9.941111 
1 1 1 -7  39 18 o 36.49312 5.232124 18.17261       4.519986 11.56558       8.018932 21.24930       5.472112 26.06805 9.595603 38.91911 5.959132 -12.85106      11.29543 
1 1 1 -7  39 19 o 10.50114 5.013940 -3.815670      3.590090 3.349136       6.524912 -6.926435      4.299383 18.85448 8.045707 10.34859 5.067492 8.505885       9.508569 
1 1 1 -7  39 20 o 22.70563 6.794850 7.840066       4.051475 6.027961       8.268125 8.412658       4.647700 21.27521 9.067135 23.19624 7.339601 -1.921030      11.66545 
1 1 1 -7  39 21 o 10.20745 4.946743 -5.015357      3.810720 -9.025238      7.645616 -3.689960      4.395617 13.88519 6.790487 11.82115 5.616998 2.064047       8.812570 
1 1 1 -7  39 22 o 13.84776 6.198981 -0.1016446E-01 4.303520 0.000000       0.000000 -0.1016446E-01 4.303520 ?        ?        13.84776 6.198981 0.000000       6.198981 
1 1 1 -7  39 23 o 47.79219 4.501622 31.18105       5.181034 33.61255       11.11058 30.50540       5.856800 39.33500 11.10650 46.37120 5.276691 -7.036201      12.29625 
1 1 1 -7  39 24 o 25.79590 6.790468 10.70187       4.326170 10.53665       8.762836 10.75512       4.974697 22.75107 9.494217 25.06611 7.535802 -2.315046      12.12141 
1 1 1 -7  39 25 o 43.54308 4.733513 26.56319       4.941985 19.07624       9.645409 29.22831       5.754746 27.90131 10.47489 44.89095 5.366757 -16.98964      11.76968 
1 1 1 -7  39 26 o 20.12192 8.044303 7.257371       5.966655 6.606077       8.454741 7.903571       8.421605 19.75223 8.775184 20.47547 8.938629 -0.7232380     12.52609 
1 1 1 -7  40 1  o 38.00933 4.306501 18.70307       3.918677 14.14545       5.261810 24.37893       5.871947 31.49835 7.033121 42.49656 5.823097 -10.99822      9.130896 
1 1 1 -7  40 2  o 25.71867 5.401695 8.972400       3.277546 6.090866       4.342687 12.78609       4.995967 21.08716 7.121245 29.95261 6.975176 -8.865452      9.968210 
1 1 1 -7  40 3  o 42.87714 3.880142 23.49438       4.010402 18.77707       5.440619 29.10731       5.934661 36.95362 6.265221 46.87544 5.287502 -9.921825      8.198212 
1 1 1 -7  40 4  o 13.23331 5.614012 0.5872157      3.144668 -0.8033301     4.204420 2.352838       4.737642 13.78193 6.151309 17.16855 7.055438 -3.386613      9.360438 
1 1 1 -7  40 5  o 27.19376 5.555402 10.07101       3.556932 11.61830       5.006950 8.494561       5.053901 28.35285 7.226455 24.21516 7.652553 4.137691       10.52536 
1 1 1 -7  40 6  o 36.65333 4.474946 17.51208       3.914254 16.98250       5.486534 18.06104       5.585989 34.74916 6.722241 35.92871 6.624012 -1.179550      9.437482 
1 1 1 -7  40 7  o 46.34904 4.270794 27.76149       4.769552 24.08437       6.055719 33.76944       7.740610 41.94275 6.103740 49.32667 6.605460 -7.383919      8.993761 
1 1 1 -7  40 8  o 12.93055 5.785582 -0.8431302     3.743779 3.510029       6.078228 -3.504102      4.752202 19.32888 7.972363 12.88677 6.035803 6.442107       9.999475 
1 1 1 -7  40 9  o 39.19021 5.051908 20.42592       4.712571 16.96125       8.261201 22.09721       5.737696 32.14506 9.721453 40.08347 6.063276 -7.938408      11.45731 
1 1 1 -7  40 10 o 14.52694 6.259433 0.5960488      4.020917 0.7314408      7.118955 0.5326214      4.872567 18.22882 8.077771 15.63223 6.812131 2.596584       10.56672 
1 1 1 -7  40 11 o 38.29034 5.397388 19.82212       4.896722 37.90393       10.59774 14.91391       5.521463 49.14471 9.186810 31.87059 7.270617 17.27413       11.71577 
1 1 1 -7  40 12 o 67.64864 4.467249 59.71640       7.323144 54.35640       12.08801 62.82423       9.204525 59.64913 8.561037 68.14247 5.592189 -8.493343      10.22565 
1 1 1 -7  40 13 o 22.50966 6.987741 7.421093       4.233092 18.73131       8.238274 3.363670       4.934303 33.35317 9.611894 17.97762 7.270415 15.37555       12.05186 
1 1 1 -7  40 14 o 17.74245 7.010258 3.575920       4.480407 12.25967       7.064996 -2.265813      5.794674 27.22372 9.081940 14.82847 6.849122 12.39526       11.37506 
1 1 1 -7  40 15 o 23.60225 6.787763 8.276703       4.112401 2.645037       7.953589 10.33164       4.804457 19.54256 8.604272 26.05120 7.285062 -6.508638      11.27411 
1 1 1 -7  40 16 o 17.10699 6.634849 3.517642       3.951703 6.514609       8.092198 2.579149       4.528361 21.86794 9.124529 16.62559 6.871649 5.242342       11.42264 
1 1 1 -7  40 17 f 17.10615 6.659773 3.580690       3.993194 -0.2803966     7.664148 5.019395       4.678375 17.43833 7.989362 19.09406 7.266563 -1.655737      10.79967 
1 1 1 -7  40 18 o 24.53777 6.921199 9.308738       4.316954 4.880220       8.187676 11.01384       5.080502 20.36413 8.852859 26.20797 7.546819 -5.843836      11.63304 
1 1 1 -7  40 19 o 22.98572 6.957369 8.287972       4.230007 18.21841       8.930208 5.415399       4.803004 30.03419 10.21134 19.27067 7.355738 10.76352       12.58485 
1 1 1 -7  40 20 o 25.70094 6.686058 10.30440       4.226733 12.61033       8.808380 9.614609       4.817621 24.92366 9.835022 24.14009 7.447980 0.7835732      12.33694 
1 1 1 -7  40 21 o 19.20708 7.333119 5.696893       4.774206 0.000000       0.000000 5.696893       4.774206 ?        ?        19.20708 7.333119 0.000000       7.333119 
1 1 1 -7  40 22 f 40.13286 4.995578 22.72962       4.780178 16.50180       10.11396 24.52094       5.424254 26.18499 10.47158 41.05618 5.564695 -14.87119      11.85832 
1 1 1 -7  40 23 o 15.45276 6.449612 2.623673       4.044800 -2.223958      7.906377 4.342168       4.707463 15.75420 7.499324 17.49411 7.091733 -1.739904      10.32146 
1 1 1 -7  40 24 o 13.90702 6.080049 1.151809       3.908850 3.736494       8.094534 0.3657855      4.463811 18.26332 8.307114 13.90527 6.261757 4.358053       10.40278 
1 1 1 -7  41 1  o 14.71965 6.599109 -0.6615039     4.896755 0.000000       0.000000 -0.6615039     4.896755 ?        ?        14.71965 6.599109 0.000000       6.599109 
1 1 1 -7  41 2  o 31.08709 5.263019 13.12731       3.844925 6.737899       5.411849 19.63953       5.463610 21.77344 7.903578 37.47656 6.199050 -15.70312      10.04464 
1 1 1 -7  41 3  f 10.73503 4.944931 -1.751235      2.991192 -3.009911      3.897372 0.5285835E-01  4.665997 11.64170 5.456949 14.92257 6.579435 -3.280871      8.547938 
1 1 1 -7  41 4  o 17.02167 6.084433 3.691710       3.192738 7.261550       4.322146 -0.5957658     4.736701 22.33787 7.079108 14.54794 6.508606 7.789930       9.616429 
1 1 1 -7  41 5  o 21.22187 6.328590 6.411322       3.519266 3.488744       4.769047 9.905702       5.214752 18.00973 7.194530 25.55976 7.722392 -7.550032      10.55446 
1 1 1 -7  41 6  o 14.25742 6.137618 0.6476255      3.859062 6.179321       6.686216 -2.115587      4.725616 21.62336 8.557445 13.52275 6.224092 8.100610       10.58155 
1 1 1 -7  41 7  o 46.66268 5.036161 29.13095       5.636107 15.35067       8.342247 40.70300       7.644676 29.87848 9.865615 54.40831 5.857969 -24.52983      11.47372 
1 1 1 -7  41 8  o 28.16217 5.418116 10.93762       3.583376 9.043525       4.901351 13.11254       5.252133 24.45306 7.506661 29.57468 7.325826 -5.121626      10.48893 
1 1 1 -7  41 9  o 44.77221 5.387984 27.28434       5.760549 30.55320       9.420162 25.33182       7.280457 43.42332 9.189261 41.19483 7.529749 2.228489       11.88022 
1 1 1 -7  41 10 o 30.14672 6.296664 13.04706       4.476350 15.41896       8.382173 12.10073       5.294548 29.54693 9.893048 28.07052 7.568625 1.476404       12.45618 
1 1 1 -7  41 11 o 44.56482 4.575102 26.37554       4.898063 34.87843       9.663598 23.43591       5.682010 46.65191 8.823412 40.95163 5.860590 5.700279       10.59241 
1 1 1 -7  41 12 o 17.27704 6.924192 3.324102       4.432015 3.104715       7.250391 3.454984       5.600116 19.20148 8.339233 18.29651 7.608957 0.9049721      11.28889 
1 1 1 -7  41 13 o 19.54269 6.952797 5.491613       4.164309 0.5183429      7.472353 7.732027       5.015340 17.74545 8.035824 22.32971 7.651109 -4.584259      11.09567 
1 1 1 -7  41 14 o 9.983923 4.851665 -5.295427      3.732107 -6.082101      6.980766 -4.980585      4.416234 14.25876 6.856421 11.29833 5.438136 2.960432       8.751219 
1 1 1 -7  41 15 o 16.78948 6.736344 3.265840       4.199713 9.959669       8.317698 0.9754239      4.865450 23.77005 9.499485 15.39476 6.755469 8.375289       11.65661 
1 1 1 -7  41 16 o 23.78959 7.033703 8.921343       4.362072 3.852794       8.683469 10.63208       5.044788 19.77109 8.831241 25.53720 7.567640 -5.766109      11.63013 
1 1 1 -7  41 17 o 23.32956 6.923100 8.633537       4.219676 -6.059217      8.073725 14.15523       4.949468 15.04041 7.267482 30.13818 6.889731 -15.09777      10.01423 
1 1 1 -7  41 18 o 12.75883 5.792314 -0.6673433     3.912275 -8.209887      7.927887 1.760761       4.498132 14.14139 6.915551 15.34409 6.616066 -1.202694      9.570641 
1 1 1 -7  41 19 o 24.44567 7.481682 10.09645       4.873454 0.000000       0.000000 10.09645       4.873454 ?        ?        24.44567 7.481682 0.000000       7.481682 
1 1 1 -7  41 20 o 14.08737 6.096655 1.264960       3.847505 -4.090161      7.089432 3.500738       4.580798 14.51202 6.960271 16.74807 6.915737 -2.236055      9.811870 
1 1 1 -7  41 21 o 18.27046 6.813611 5.199445       4.067155 14.88419       9.181294 2.834983       4.536551 25.18233 10.00793 16.00331 6.763901 9.179018       12.07928 
1 1 1 -7  42 1  o 19.85610 6.556847 5.714890       3.684869 11.18898       4.969866 -0.9685500     5.491472 26.89817 7.366714 15.02194 6.836457 11.87622       10.05016 
1 1 1 -7  42 2  o 12.59972 5.644664 -0.5969787     3.575760 0.7398971      4.679737 -2.472511      5.542915 15.21135 6.651407 14.24885 6.621959 0.9624977      9.385710 
1 1 1 -7  42 3  o 17.40860 6.326998 4.015108       3.469572 1.980354       4.685847 6.484476       5.162084 16.23203 6.868090 20.98228 7.703026 -4.750252      10.32024 
1 1 1 -7  42 4  o 23.41886 6.968367 8.305305       4.270462 16.13995       7.594238 4.682204       5.164340 30.41177 9.345447 19.09305 7.531786 11.31872       12.00272 
1 1 1 -7  42 5  o 34.17433 6.807025 17.29589       5.469606 0.000000       0.000000 17.29589       5.469606 ?        ?        34.17433 6.807025 0.000000       6.807025 
1 1 1 -7  42 6  o 32.79375 5.633057 15.10586       4.339500 18.89107       8.303489 13.68357       5.089900 32.43636 9.732352 30.04199 7.070891 2.394377       12.02980 
1 1 1 -7  42 7  o 30.98964 5.945201 13.74400       4.326455 5.647525       7.663525 17.53171       5.241660 20.94502 8.818558 34.66538 6.441998 -13.72035      10.92091 
1 1 1 -7  42 8  o 14.91212 6.335977 1.432746       4.016023 7.813775       7.425761 -1.205216      4.774521 22.39897 8.967546 13.89000 6.341790 8.508973       10.98340 
1 1 1 -7  42 9  o 34.78625 5.670330 17.11191       4.641334 34.87977       9.703738 11.84130       5.285086 45.57186 9.057050 27.21726 7.651431 18.35460       11.85641 
1 1 1 -7  42 10 o 45.74080 5.365971 29.10427       5.867604 32.55260       9.733943 27.13610       7.353868 43.14711 9.513926 41.87455 7.481150 1.272564       12.10299 
1 1 1 -7  42 11 o 27.77783 7.500713 12.35017       5.195363 11.67459       8.277347 12.78933       6.673665 25.05055 9.632602 26.91514 8.820852 -1.864588      13.06118 
1 1 1 -7  42 12 o 45.68611 4.759921 28.47565       5.221693 34.46416       9.931599 26.18783       6.138622 43.94761 9.547255 42.40482 6.117106 1.542793       11.33883 
1 1 1 -7  42 13 o 24.49990 6.744220 9.364158       4.153342 11.26115       8.180191 8.705274       4.820974 24.29802 9.511032 23.06285 7.493143 1.235170       12.10813 
1 1 1 -7  42 14 o 51.52293 4.338523 35.77607       5.396704 47.98717       11.05927 31.95949       6.182819 52.50990 8.964222 47.41709 5.449724 5.092808       10.49079 
1 1 1 -7  42 15 o 15.03234 6.350737 1.970062       3.996398 6.385415       7.937664 0.4707955      4.625401 20.48094 8.809452 14.47539 6.456964 6.005545       10.92240 
1 1 1 -7  42 16 o 26.45703 6.783970 11.12752       4.394202 3.643402       8.456906 13.89538       5.142966 18.96380 8.571947 29.17444 7.262464 -10.21064      11.23484 
1 1 1 -7  42 17 o 15.77473 6.372586 3.014375       3.786246 5.716475       6.879375 1.840194       4.534880 19.48126 8.285529 15.29146 6.618319 4.189805       10.60435 
1 1 1 -7  42 18 o 21.29730 7.544134 7.809262       4.898042 0.000000       0.000000 7.809262       4.898042 ?        ?        21.29730 7.544134 0.000000       7.544134 
1 1 1 -7  42 19 o 18.23503 6.809609 5.179782       4.065108 8.915810       7.479383 3.613460       4.842852 21.50795 8.854587 16.86467 7.049430 4.643282       11.31805 
1 1 1 -7  43 1  o 13.95664 5.788982 1.614054       3.229564 -1.422763      4.489350 4.871319       4.649441 13.18472 6.067777 18.59964 7.201439 -5.414921      9.416934 
1 1 1 -7  43 2  o 17.96550 6.470435 4.613051       3.618196 6.542712       5.772060 3.364031       4.643817 20.57368 8.007710 17.08659 6.999428 3.487089       10.63557 
1 1 1 -7  43 3  o 17.61000 6.601543 4.282635       3.828023 -1.379133      6.329790 7.547415       4.806625 15.37116 7.120338 21.70632 7.488265 -6.335157      10.33312 
1 1 1 -7  43 4  o 30.71483 5.311085 13.33904       3.831492 16.18192       5.606497 10.84779       5.248317 31.95241 7.353079 25.58186 7.751071 6.370554       10.68395 
1 1 1 -7  43 5  o 12.95419 5.576189 0.7198554      3.184904 0.2219328      4.376646 1.280338       4.643456 14.14726 6.297643 15.26194 6.650419 -1.114680      9.159060 
1 1 1 -7  43 6  o 27.92458 5.443265 11.16971       3.570949 15.26889       5.343050 7.860655       4.800566 31.11137 7.191472 22.02930 7.486879 9.082073       10.38126 
1 1 1 -7  43 7  f 13.26721 5.624888 1.098732       3.153542 -1.826448      4.507870 3.902340       4.413201 12.92487 5.994669 17.39707 6.930494 -4.472200      9.163395 
1 1 1 -7  43 8  o 8.984262 4.391884 -5.032220      3.188453 -6.521132      4.125428 -2.823435      5.024713 10.05064 4.930315 13.05426 6.143274 -3.003618      7.877043 
1 1 1 -7  43 9  o 17.38797 7.405626 3.218431       5.509254 2.359227       7.518466 4.214726       8.096084 18.08736 8.137380 19.39238 8.602740 -1.305027      11.84163 
1 1 1 -7  43 10 o 19.36517 7.156478 5.772196       4.467870 3.184514       7.193349 7.397465       5.700832 18.30535 8.115349 21.10456 8.023843 -2.799212      11.41232 
1 1 1 -7  43 11 o 11.98961 5.629842 -2.471572      4.179381 -7.051523      6.976475 0.9217215E-01  5.219669 13.54025 6.591968 14.84837 6.720819 -1.308127      9.414003 
1 1 1 -7  43 12 o 20.09722 7.151307 6.471525       4.405669 8.593221       8.008161 5.550655       5.275824 21.80828 9.086572 19.12617 7.591171 2.682102       11.84026 
1 1 1 -7  43 13 o 15.55023 6.682099 2.090112       4.558469 -6.563550      7.351434 7.495966       5.810376 13.97047 6.793565 20.91690 8.063339 -6.946435      10.54372 
1 1 1 -7  43 14 o 17.81730 7.043936 4.603815       4.525967 -2.022553      7.923157 7.813331       5.514172 15.98070 7.578318 21.18275 7.926805 -5.202053      10.96655 
1 1 1 -7  43 15 o 25.87111 7.330277 11.31887       4.831192 13.98579       8.339056 9.971509       5.927244 25.26315 9.680123 23.16947 8.289257 2.093678       12.74428 
1 1 1 -7  44 1  o 12.28039 5.731548 -2.005350      4.223253 -3.318575      5.926211 -0.6502040     6.020057 13.75093 6.530530 15.13291 6.986648 -1.381973      9.563528 
1 1 1 -7  44 2  o 14.95377 6.073872 2.453865       3.461011 6.531705       5.094972 -1.040149      4.716165 20.06610 7.595551 13.52103 6.221322 6.545078       9.818210 
1 1 1 -7  44 3  f 35.73019 4.854562 17.84386       4.117665 25.36600       6.304450 12.24781       5.437726 40.67129 6.585993 26.61666 7.848943 14.05462       10.24603 
1 1 1 -7  44 4  o 52.71278 4.186820 37.43661       5.334039 28.42176       6.740230 52.54317       8.725260 42.98649 6.648769 59.46118 6.108324 -16.47469      9.028718 
1 1 1 -7  44 5  o 13.08544 5.685481 0.7395692      3.373120 -3.179989      4.728830 4.799740       4.812905 12.35114 5.856395 18.22128 7.244505 -5.870140      9.315590 
1 1 1 -7  44 6  o 15.94805 6.420594 3.108388       3.829105 3.377296       6.665269 2.975920       4.678117 17.91855 7.883408 16.41657 6.899654 1.501986       10.47632 
1 1 1 -7  44 7  f 19.77920 6.916011 6.244419       4.106721 4.241358       5.413615 8.959558       6.302840 17.89835 7.465274 22.19548 8.437280 -4.297123      11.26579 
1 1 1 -7  44 8  o 16.61675 6.638676 3.629698       4.060974 9.901080       7.685859 1.200803       4.783163 22.57022 9.093012 15.03260 6.643267 7.537624       11.26125 
1 1 1 -7  44 9  o 15.72980 6.670777 2.479188       4.437364 5.925651       7.542084 0.6546012      5.487655 19.73356 8.538027 15.29572 6.910326 4.437844       10.98410 
1 1 1 -7  44 10 o 13.88511 6.114099 0.8120260      4.017147 9.074239       7.636143 -2.349489      4.723604 21.83611 8.963704 12.70125 5.970655 9.134856       10.77018 
1 1 1 -6  0  1  o 452.3042 9.367403 2498.604       103.1491 2498.604       103.1491 2498.604       103.1491 452.3042 9.367403 452.3042 9.367403 -0.000000      0.000000 
1 1 1 -6  0  2  o 119.2963 3.417640 173.8558       9.917048 173.8558       9.917048 173.8558       9.917048 119.2963 3.417640 119.2963 3.417640 -0.000000      0.000000 
1 1 1 -6  0  3  o 40.87369 4.263869 21.01673       4.131538 21.01673       4.131538 21.01673       4.131538 40.87369 4.263869 40.87369 4.263869 -0.000000      0.000000 
1 1 1 -6  0  4  o 253.4918 5.604119 784.4136       34.58023 784.4136       34.58023 784.4136       34.58023 253.4918 5.604119 253.4918 5.604119 -0.000000      0.000000 
1 1 1 -6  0  5  o 47.97005 2.795384 28.32553       3.242124 28.32553       3.242124 28.32553       3.242124 47.97005 2.795384 47.97005 2.795384 -0.000000      0.000000 
1 1 1 -6  0  6  o 155.3550 3.932852 294.7059       14.86756 294.7059       14.86756 294.7059       14.86756 155.3550 3.932852 155.3550 3.932852 -0.000000      0.000000 
1 1 1 -6  0  7  o 211.7139 4.870771 547.2119       25.09942 547.2119       25.09942 547.2119       25.09942 211.7139 4.870771 211.7139 4.870771 -0.000000      0.000000 
1 1 1 -6  0  8  o 176.3233 4.285707 379.5988       18.39028 379.5988       18.39028 379.5988       18.39028 176.3233 4.285707 176.3233 4.285707 0.000000       0.000000 
1 1 1 -6  0  9  o 41.29079 3.057602 21.11659       3.036939 21.11659       3.036939 21.11659       3.036939 41.29079 3.057602 41.29079 3.057602 -0.000000      0.000000 
1 1 1 -6  0  10 o 195.6012 6.586431 468.0880       31.31404 468.0880       31.31404 468.0880       31.31404 195.6012 6.586431 195.6012 6.586431 -0.000000      0.000000 
1 1 1 -6  0  11 o 619.2507 12.64786 4689.411       190.6825 4689.411       190.6825 4689.411       190.6825 619.2507 12.64786 619.2507 12.64786 -0.000000      0.000000 
1 1 1 -6  0  12 o 590.0679 12.07836 4255.833       173.5143 4255.833       173.5143 4255.833       173.5143 590.0679 12.07836 590.0679 12.07836 -0.000000      0.000000 
1 1 1 -6  0  13 o 186.1193 4.524451 422.9180       20.49337 422.9180       20.49337 422.9180       20.49337 186.1193 4.524451 186.1193 4.524451 -0.000000      0.000000 
1 1 1 -6  0  14 o 144.2940 3.914718 254.2857       13.74237 254.2857       13.74237 254.2857       13.74237 144.2940 3.914718 144.2940 3.914718 -0.000000      0.000000 
1 1 1 -6  0  15 o 332.1803 7.128344 1346.899       57.64305 1346.899       57.64305 1346.899       57.64305 332.1803 7.128344 332.1803 7.128344 -0.000000      0.000000 
1 1 1 -6  0  16 o 207.1628 4.923207 523.8980       24.82228 523.8980       24.82228 523.8980       24.82228 207.1628 4.923207 207.1628 4.923207 -0.000000      0.000000 
1 1 1 -6  0  17 o 560.3530 11.51252 3834.750       157.0559 3834.750       157.0559 3834.750       157.0559 560.3530 11.51252 560.3530 11.51252 -0.000000      0.000000 
1 1 1 -6  0  18 o 347.3441 10.50647 1475.436       88.74666 1475.436       88.74666 1475.436       88.74666 347.3441 10.50647 347.3441 10.50647 -0.000000      0.000000 
1 1 1 -6  0  19 o 25.83393 7.676355 10.01803       4.204433 10.01803       4.204433 10.01803       4.204433 25.83393 7.676355 25.83393 7.676355 -0.000000      0.000000 
1 1 1 -6  0  20 o 664.3798 13.57728 5395.167       219.6119 5395.167       219.6119 5395.167       219.6119 664.3798 13.57728 664.3798 13.57728 -0.000000      0.000000 
1 1 1 -6  0  21 o 430.7002 9.050494 2265.436       94.89656 2265.436       94.89656 2265.436       94.89656 430.7002 9.050494 430.7002 9.050494 -0.000000      0.000000 
1 1 1 -6  0  22 o 715.3556 14.60461 6261.739       254.3545 6261.739       254.3545 6261.739       254.3545 715.3556 14.60461 715.3556 14.60461 -0.000000      0.000000 
1 1 1 -6  0  23 o 553.4320 16.27687 3758.968       219.0887 3758.968       219.0887 3758.968       219.0887 553.4320 16.27687 553.4320 16.27687 -0.000000      0.000000 
1 1 1 -6  0  24 o 196.7928 4.936239 473.0228       23.63870 473.0228       23.63870 473.0228       23.63870 196.7928 4.936239 196.7928 4.936239 0.000000       0.000000 
1 1 1 -6  0  25 o 329.9677 7.207363 1330.519       57.89165 1330.519       57.89165 1330.519       57.89165 329.9677 7.207363 329.9677 7.207363 -0.000000      0.000000 
1 1 1 -6  0  26 o 71.86333 4.199090 63.60692       7.295604 63.60692       7.295604 63.60692       7.295604 71.86333 4.199090 71.86333 4.199090 -0.000000      0.000000 
1 1 1 -6  0  27 o 64.22411 4.529109 51.04984       7.005904 51.04984       7.005904 51.04984       7.005904 64.22411 4.529109 64.22411 4.529109 -0.000000      0.000000 
1 1 1 -6  0  28 o 74.73051 4.210992 68.75773       7.612526 68.75773       7.612526 68.75773       7.612526 74.73051 4.210992 74.73051 4.210992 -0.000000      0.000000 
1 1 1 -6  0  29 o 112.9610 4.165577 156.2802       11.43130 156.2802       11.43130 156.2802       11.43130 112.9610 4.165577 112.9610 4.165577 -0.000000      0.000000 
1 1 1 -6  0  30 o 45.43607 7.490195 27.20105       7.616682 27.20105       7.616682 27.20105       7.616682 45.43607 7.490195 45.43607 7.490195 -0.000000      0.000000 
1 1 1 -6  0  31 o 7.686859 5.477520 -6.531694      4.516939 -6.531694      4.516939 -6.531694      4.516939 7.686859 5.477520 7.686859 5.477520 -0.000000      0.000000 
1 1 1 -6  0  32 o 23.04185 9.310046 9.043148       5.103613 9.043148       5.103613 9.043148       5.103613 23.04185 9.310046 23.04185 9.310046 -0.000000      0.000000 
1 1 1 -6  0  33 f 42.32676 8.628247 24.49532       7.872896 24.49532       7.872896 24.49532       7.872896 42.32676 8.628247 42.32676 8.628247 -0.000000      0.000000 
1 1 1 -6  0  34 o 200.6640 7.666163 496.2395       37.36283 496.2395       37.36283 496.2395       37.36283 200.6640 7.666163 200.6640 7.666163 -0.000000      0.000000 
1 1 1 -6  0  35 o 17.61057 9.591229 5.389565       5.826856 5.389565       5.826856 5.389565       5.826856 17.61057 9.591229 17.61057 9.591229 -0.000000      0.000000 
1 1 1 -6  0  36 o 9.346900 6.526876 -5.295258      5.444270 -5.295258      5.444270 -5.295258      5.444270 9.346900 6.526876 9.346900 6.526876 -0.000000      0.000000 
1 1 1 -6  0  37 o 19.12930 9.974861 6.614949       6.069823 6.614949       6.069823 6.614949       6.069823 19.12930 9.974861 19.12930 9.974861 -0.000000      0.000000 
1 1 1 -6  0  38 o 11.31874 7.512426 -1.426876      5.496290 -1.426876      5.496290 -1.426876      5.496290 11.31874 7.512426 11.31874 7.512426 -0.000000      0.000000 
1 1 1 -6  0  39 o 89.50403 4.588799 98.90854       9.948333 98.90854       9.948333 98.90854       9.948333 89.50403 4.588799 89.50403 4.588799 -0.000000      0.000000 
1 1 1 -6  0  40 o 76.27439 6.304913 73.22704       11.52845 73.22704       11.52845 73.22704       11.52845 76.27439 6.304913 76.27439 6.304913 0.000000       0.000000 
1 1 1 -6  0  41 o 18.93537 11.40199 5.059410       9.541239 5.059410       9.541239 5.059410       9.541239 18.93537 11.40199 18.93537 11.40199 -0.000000      0.000000 
1 1 1 -6  0  42 o 14.38096 8.675116 2.775398       5.543421 2.775398       5.543421 2.775398       5.543421 14.38096 8.675116 14.38096 8.675116 -0.000000      0.000000 
1 1 1 -6  0  43 o 11.21583 7.424250 -0.9259135     5.309640 -0.9259135     5.309640 -0.9259135     5.309640 11.21583 7.424250 11.21583 7.424250 -0.000000      0.000000 
1 1 1 -6  0  44 o 52.89104 10.45908 40.73521       11.98414 40.73521       11.98414 40.73521       11.98414 52.89104 10.45908 52.89104 10.45908 -0.000000      0.000000 
1 1 1 -6  0  45 o 10.31194 7.030954 -2.505853      5.462402 -2.505853      5.462402 -2.505853      5.462402 10.31194 7.030954 10.31194 7.030954 -0.000000      0.000000 
1 1 1 -6  0  46 o 21.62618 10.20114 9.647542       6.066712 9.647542       6.066712 9.647542       6.066712 21.62618 10.20114 21.62618 10.20114 -0.000000      0.000000 
1 1 1 -6  0  47 o 12.99929 8.121325 2.446346       5.267117 2.446346       5.267117 2.446346       5.267117 12.99929 8.121325 12.99929 8.121325 -0.000000      0.000000 
1 1 1 -6  0  48 o 9.148578 6.393682 -3.708936      5.254866 -3.708936      5.254866 -3.708936      5.254866 9.148578 6.393682 9.148578 6.393682 -0.000000      0.000000 
1 1 1 -6  0  49 o 12.48066 8.480199 -0.1434368     7.803415 -0.1434368     7.803415 -0.1434368     7.803415 12.48066 8.480199 12.48066 8.480199 -0.000000      0.000000 
1 1 1 -6  0  50 o 9.014622 6.314532 -3.160570      5.210694 -3.160570      5.210694 -3.160570      5.210694 9.014622 6.314532 9.014622 6.314532 -0.000000      0.000000 
1 1 1 -6  0  51 o 10.86428 7.301391 0.7521076      5.483315 0.7521076      5.483315 0.7521076      5.483315 10.86428 7.301391 10.86428 7.301391 -0.000000      0.000000 
1 1 1 -6  0  52 o 16.58566 10.44282 10.63781       8.891397 10.63781       8.891397 10.63781       8.891397 16.58566 10.44282 16.58566 10.44282 -0.000000      0.000000 
1 1 1 -6  1  1  o 452.4236 7.634393 2497.657       84.16972 2532.980       104.0693 2430.853       143.1206 455.4421 9.376768 445.4916 13.19792 9.950500       16.18978 
1 1 1 -6  1  2  o 337.7285 5.840161 1390.950       48.06497 1377.110       58.51793 1419.647       84.26635 335.9730 7.147407 340.7507 10.15937 -4.777710      12.42168 
1 1 1 -6  1  3  o 613.2066 10.20708 4593.704       152.5261 4696.593       189.7556 4405.864       256.3915 619.6160 12.56712 598.7380 17.59146 20.87793       21.61925 
1 1 1 -6  1  4  o 315.1770 5.493574 1211.316       42.19350 1191.443       72.46200 1221.510       51.89948 312.1889 9.535998 316.4380 6.730360 -4.249054      11.67189 
1 1 1 -6  1  5  o 258.0766 4.011863 811.8881       25.23079 813.9940       35.76912 809.8027       35.59498 258.3535 5.681432 257.6880 5.668373 0.6654358      8.025529 
1 1 1 -6  1  6  o 253.0482 3.951376 780.5760       24.36620 830.2978       35.75748 737.4733       33.29245 260.9209 5.623698 245.9065 5.555712 15.01440       7.905183 
1 1 1 -6  1  7  o 213.0705 3.453196 553.3720       17.93002 568.8621       25.77785 538.8540       24.95588 215.9908 4.897511 210.2176 4.871556 5.773193       6.907798 
1 1 1 -6  1  8  o 671.2824 9.657344 5507.530       157.9789 5606.691       225.7117 5412.303       221.1888 676.2457 13.69662 664.4300 13.66085 11.81567       19.34467 
1 1 1 -6  1  9  o 70.66353 2.420467 60.92442       4.161873 63.51342       7.454512 59.75197       5.016497 72.05078 4.264729 69.95587 2.949278 2.094910       5.185185 
1 1 1 -6  1  10 o 122.4527 3.538641 182.9289       10.54837 185.0677       15.11125 180.8963       14.73130 123.0886 5.048579 121.6955 4.977924 1.393158       7.089984 
1 1 1 -6  1  11 o 718.1422 10.30831 6303.719       180.3989 6184.970       251.7935 6428.962       258.5873 710.2377 14.54805 724.0779 14.65500 -13.84027      20.64981 
1 1 1 -6  1  12 f 272.9792 4.241079 908.3818       28.21254 895.9492       39.62560 921.1629       40.17722 271.0414 5.999350 274.8287 5.999039 -3.787354      8.484141 
1 1 1 -6  1  13 o 140.3900 2.704654 240.1865       9.253035 241.0739       13.11714 239.3075       13.05462 140.5856 3.832371 140.0694 3.828179 0.5162354      5.416828 
1 1 1 -6  1  14 f 283.1318 4.383869 977.1005       30.24700 997.3923       43.33489 957.8232       42.23764 286.0047 6.217680 280.2751 6.184135 5.729584       8.769440 
1 1 1 -6  1  15 o 400.5531 5.935609 1956.044       57.93774 1985.474       82.73544 1927.725       81.15994 403.4367 8.415502 397.5284 8.377943 5.908295       11.87479 
1 1 1 -6  1  16 o 296.7765 4.580015 1073.515       33.12322 1153.071       48.94239 1006.279       44.99304 307.5247 6.530841 287.2868 6.426782 20.23782       9.162718 
1 1 1 -6  1  17 o 661.0051 9.521993 5331.455       153.3800 5146.780       211.9567 5534.470       222.2321 648.9949 13.40201 672.9728 13.55106 -23.97791      19.05899 
1 1 1 -6  1  18 o 414.4731 8.666471 2095.827       87.53358 2180.206       126.8666 2019.161       120.9291 422.2773 12.34183 406.3818 12.22516 15.89554       17.37168 
1 1 1 -6  1  19 o 270.2905 4.273837 890.4623       28.15041 888.7059       39.77390 892.2253       39.84759 269.9778 6.045526 270.5118 6.044769 -0.5340576     8.549129 
1 1 1 -6  1  20 o 92.90770 2.668212 105.2765       6.034733 94.62859       8.299726 117.2201       8.790179 88.02779 3.878604 98.00086 3.687288 -9.973076      5.351604 
1 1 1 -6  1  21 o 475.1309 6.983697 2753.833       80.86018 2706.408       113.0279 2803.551       115.7270 470.7509 9.852774 479.1183 9.911873 -8.367310      13.97578 
1 1 1 -6  1  22 o 346.5630 5.278555 1464.584       44.57932 1492.758       63.80102 1437.707       62.31461 349.7409 7.485919 343.2338 7.450128 6.507050       10.56141 
1 1 1 -6  1  23 o 160.4089 4.537757 313.9978       17.72022 303.3851       24.85674 324.9653       25.26870 157.5447 6.488355 163.0697 6.371032 -5.525009      9.093338 
1 1 1 -6  1  24 o 282.5295 4.476170 973.4898       30.81814 939.0638       42.64777 1011.112       44.58352 277.3636 6.309730 287.8032 6.356860 -10.43958      8.956694 
1 1 1 -6  1  25 o 254.6240 4.142892 790.7507       25.70627 801.9258       36.65105 779.9307       36.06435 256.2878 5.868437 252.7497 5.855329 3.538010       8.289960 
1 1 1 -6  1  26 o 343.8889 5.277884 1443.887       44.22971 1476.461       63.44323 1413.084       61.69395 347.3849 7.494424 339.8558 7.449236 7.529022       10.56681 
1 1 1 -6  1  27 o 166.6438 3.237630 338.6916       13.14778 332.4397       18.42275 345.1812       18.76963 164.9548 4.587492 168.0887 4.586563 -3.133865      6.487037 
1 1 1 -6  1  28 o 287.2326 4.580144 1007.590       32.05893 990.8767       44.90340 1024.966       45.78582 284.5103 6.476571 289.3595 6.493175 -4.849182      9.171002 
1 1 1 -6  1  29 o 21.87014 6.567200 5.911183       3.779705 8.767335       5.943842 3.972140       4.897454 26.75394 8.276045 20.31524 7.495286 6.438705       11.16567 
1 1 1 -6  1  30 o 115.4250 3.346710 162.7311       9.403625 165.5599       11.70658 157.5857       15.78834 116.3503 4.135403 113.3130 5.736350 3.037216       7.071581 
1 1 1 -6  1  31 o 16.25321 6.144199 2.322684       3.331358 7.061441       4.596154 -2.922367      4.835454 23.90756 7.255559 14.16329 6.433714 9.744267       9.697206 
1 1 1 -6  1  32 o 137.7611 3.512047 231.9253       11.78063 253.4937       15.10714 198.4586       18.81825 143.9222 4.312295 127.0362 6.096563 16.88596       7.467528 
1 1 1 -6  1  33 o 77.06663 3.092972 72.63132       5.796894 70.34884       8.082519 75.04914       8.318674 75.70119 4.400318 78.19965 4.382829 -2.498459      6.210635 
1 1 1 -6  1  34 o 90.30056 6.783874 101.0104       14.81896 0.000000       0.000000 101.0104       14.81896 ?        ?        90.30056 6.783874 0.000000       6.783874 
1 1 1 -6  1  35 o 127.4606 3.114737 198.4744       9.674611 199.8719       13.74586 197.1026       13.61895 127.6620 4.425185 126.7753 4.415057 0.8866425      6.250999 
1 1 1 -6  1  36 o 73.25588 3.333831 65.74845       5.935842 59.64248       8.182067 72.53261       8.624494 69.54211 4.858696 76.76102 4.632147 -7.218918      6.712951 
1 1 1 -6  1  37 o 42.12449 4.691425 22.05808       4.734254 20.50348       6.629257 23.67616       6.763246 40.10134 7.040463 43.26101 6.626073 -3.159664      9.668142 
1 1 1 -6  1  38 o 193.5354 3.652256 458.9625       17.22494 462.7784       24.41459 455.1807       24.30528 193.7228 5.176330 192.1160 5.196368 1.606766       7.334619 
1 1 1 -6  1  39 o 73.31583 3.388824 66.02688       6.038186 65.41614       8.451055 66.66380       8.630336 72.68166 4.798289 73.36051 4.854887 -0.6788559     6.825944 
1 1 1 -6  1  40 o 47.53242 8.154281 29.43466       9.105290 0.000000       0.000000 29.43466       9.105290 ?        ?        47.53242 8.154281 0.000000       8.154281 
1 1 1 -6  1  41 o 36.98230 5.015137 17.31252       4.403369 13.62310       6.094106 21.34311       6.369638 31.98991 7.871832 40.61398 6.666933 -8.624069      10.31570 
1 1 1 -6  1  42 o 59.75608 4.424052 44.70098       6.396572 45.68931       7.565186 42.22249       11.98013 60.10850 5.216322 55.75974 9.132537 4.348759       10.51728 
1 1 1 -6  1  43 o 76.18011 3.389570 72.06552       6.276730 74.34414       8.767880 69.67023       8.989542 76.71311 4.712924 74.08424 5.008831 2.628876       6.877502 
1 1 1 -6  1  44 o 19.69212 7.463634 4.302863       4.923299 7.189766       9.789923 3.325605       5.695971 25.38439 10.24979 19.44515 7.830044 5.939243       12.89837 
1 1 1 -6  1  45 o 22.32321 6.846076 6.960122       4.077931 7.014031       5.914618 6.911275       5.630032 22.74946 8.261875 22.54217 8.077130 0.2072906      11.55416 
1 1 1 -6  1  46 o 17.57019 6.813585 3.560500       4.167056 3.431356       5.833395 3.695070       5.954691 18.79962 7.787408 19.10956 7.887310 -0.3099422     11.08392 
1 1 1 -6  1  47 o 31.98716 5.915132 14.70021       4.441009 8.159274       5.900335 23.24839       6.745180 22.51756 8.240531 38.86350 7.392272 -16.34595      11.07032 
1 1 1 -6  1  48 o 17.10324 6.644069 3.984577       3.967584 4.690256       5.550224 3.247114       5.673839 18.50208 7.623458 17.40794 7.467212 1.094141       10.67129 
1 1 1 -6  1  49 o 12.59348 5.886145 -1.687477      4.480407 -4.182430      5.577180 2.852846       7.523619 12.71840 6.118998 17.50017 7.978877 -4.781771      10.05508 
1 1 1 -6  1  50 o 13.13664 5.870306 0.8214116      3.841149 -4.192389      5.299385 6.371375       5.575541 12.02773 5.829981 18.44894 7.625047 -6.421204      9.598439 
1 1 1 -6  1  51 o 15.13625 6.243896 3.593148       3.728983 2.426697       5.127215 4.902995       5.433238 14.73760 6.666800 16.50831 7.193653 -1.770705      9.807898 
1 1 1 -6  1  52 o 11.84660 5.619051 -1.002918      4.360398 -2.209298      5.118097 2.190829       8.327538 11.98203 5.788855 15.15393 7.336451 -3.171897      9.345284 
1 1 1 -6  2  1  o 100.1995 2.587812 122.4342       6.313511 119.7903       7.752635 127.6403       10.87887 99.08799 3.214900 102.2317 4.376917 -3.143723      5.430744 
1 1 1 -6  2  2  o 723.1336 10.36792 6389.248       182.7033 6289.726       255.5820 6493.252       261.2751 716.4931 14.63801 727.9683 14.72819 -11.47522      20.76514 
1 1 1 -6  2  3  f 261.3879 4.061113 832.8463       25.86823 841.4492       36.84909 824.4874       36.32298 262.6772 5.756630 260.0172 5.732492 2.660004       8.124054 
1 1 1 -6  2  4  o 475.4727 8.001408 2759.373       92.71032 2921.282       167.0149 2687.263       111.4599 488.1432 14.05479 469.0216 9.751906 19.12155       17.10663 
1 1 1 -6  2  5  o 342.1219 5.117446 1427.230       42.66486 1402.780       59.73143 1452.698       60.96183 339.0522 7.229368 345.0305 7.250441 -5.978363      10.23878 
1 1 1 -6  2  6  o 289.6513 4.427974 1022.873       31.25480 988.5196       43.33695 1060.110       45.11879 284.6599 6.247352 294.7856 6.280802 -10.12567      8.858774 
1 1 1 -6  2  7  o 240.3601 4.391753 704.3691       25.72388 688.0995       31.11474 739.5049       45.72480 237.5313 5.375381 246.0100 7.636411 -8.478699      9.338602 
1 1 1 -6  2  8  o 120.2933 2.443888 176.3504       7.164057 180.2257       10.29829 172.7164       9.972569 121.5456 3.480467 118.9860 3.442962 2.559616       4.895675 
1 1 1 -6  2  9  o 534.3483 8.963271 3488.349       116.7151 3415.139       198.8972 3526.799       144.1419 527.0856 15.50185 536.9180 11.01656 -9.832458      19.01768 
1 1 1 -6  2  10 o 523.1428 8.773390 3342.925       111.8468 3376.389       137.9806 3278.806       190.9944 525.4229 10.77638 516.6040 15.18793 8.818848       18.62266 
1 1 1 -6  2  11 o 496.5533 7.230711 3008.827       87.49493 3027.959       124.3993 2990.097       123.0842 497.7475 10.25587 494.6323 10.21137 3.115234       14.47256 
1 1 1 -6  2  12 o 433.0124 6.362646 2286.911       67.13889 2262.249       94.32241 2312.238       95.58768 430.4528 8.991937 435.1805 9.013559 -4.727722      12.73182 
1 1 1 -6  2  13 o 82.40385 2.281786 82.80985       4.577624 79.77954       6.414981 85.95378       6.534141 80.84259 3.262964 83.92020 3.200979 -3.077614      4.570909 
1 1 1 -6  2  14 o 381.8760 5.682762 1777.900       52.88322 1838.415       76.46278 1722.410       73.21899 388.2035 8.082664 375.7608 7.996063 12.44272       11.36954 
1 1 1 -6  2  15 f 393.5566 5.850640 1888.267       56.11084 2045.109       83.63158 1759.866       75.66984 409.4549 8.381623 379.8392 8.174985 29.61575       11.70820 
1 1 1 -6  2  16 o 521.7014 7.593091 3319.269       96.53320 3490.796       141.3013 3169.148       132.1908 534.7604 10.84303 509.5452 10.64590 25.21527       15.19561 
1 1 1 -6  2  17 o 620.6584 10.34098 4701.739       156.4049 4829.070       275.3870 4641.110       190.0271 627.6537 18.02342 616.3806 12.65117 11.27313       22.02034 
1 1 1 -6  2  18 o 372.7864 7.883751 1695.085       71.61914 1857.256       107.1261 1564.020       96.30537 389.8305 11.28862 357.7294 11.06068 32.10110       15.80416 
1 1 1 -6  2  19 o 273.9700 4.324116 914.8820       28.86931 926.2178       41.13982 903.8841       40.52194 275.6133 6.125282 272.2707 6.107357 3.342621       8.649792 
1 1 1 -6  2  20 o 307.2826 4.755489 1151.033       35.60977 1124.937       49.69038 1178.584       51.05708 303.7078 6.713984 310.8641 6.739834 -7.156342      9.513304 
1 1 1 -6  2  21 o 82.17686 2.774232 82.39112       5.547602 80.21349       7.751740 84.67737       7.942733 81.02660 3.937656 83.25645 3.925915 -2.229858      5.560391 
1 1 1 -6  2  22 o 449.4261 7.681215 2465.258       84.12486 2505.074       104.0931 2390.286       142.8387 452.8451 9.432703 441.5945 13.28864 11.25061       16.29613 
1 1 1 -6  2  23 o 128.4891 3.427402 201.3871       10.72209 204.7634       19.35006 199.8912       12.88027 129.4009 6.153970 127.9773 4.135486 1.423523       7.414418 
1 1 1 -6  2  24 o 424.8475 6.326138 2203.351       65.49496 2223.253       93.16924 2183.908       92.08797 426.3606 8.967252 422.5754 8.942576 3.785248       12.66417 
1 1 1 -6  2  25 o 408.2170 6.113333 2034.943       60.81423 2101.385       87.80744 1973.693       84.30788 414.3577 8.696005 401.5878 8.614927 12.76993       12.24081 
1 1 1 -6  2  26 o 104.8866 2.861874 134.2255       7.308033 135.2962       10.35647 133.1637       10.31390 105.2335 4.046053 104.3986 4.061830 0.8349686      5.733150 
1 1 1 -6  2  27 o 137.1597 3.004657 229.4175       10.04286 232.2628       14.25299 226.6121       14.15304 137.8845 4.246907 136.1933 4.269675 1.691147       6.022154 
1 1 1 -6  2  28 o 80.74368 2.925573 79.61738       5.746945 83.80042       8.081093 75.33704       8.174528 82.75964 4.018980 78.43459 4.293171 4.325043       5.880775 
1 1 1 -6  2  29 o 179.2892 3.840682 392.4075       16.78025 401.6244       28.57451 387.5559       20.73149 180.9505 6.490633 178.0209 4.783184 2.929550       8.062701 
1 1 1 -6  2  30 o 103.1413 3.296799 129.9564       8.275663 122.6268       9.991590 145.9709       14.76901 100.1145 4.104150 109.0670 5.575262 -8.952492      6.922976 
1 1 1 -6  2  31 o 171.9415 3.829432 361.1086       16.04542 346.8189       19.45446 391.5081       28.37534 168.3279 4.747455 178.4964 6.534451 -10.16849      8.076965 
1 1 1 -6  2  32 o 221.5689 3.854943 599.8597       20.81435 603.0511       29.51514 596.7023       29.35737 221.8433 5.459620 220.6725 5.459248 1.170761       7.720806 
1 1 1 -6  2  33 o 18.13988 6.468682 3.463707       3.606577 7.793258       4.931148 -1.516139      5.288526 25.00970 7.499083 15.89386 7.006266 9.115842       10.26275 
1 1 1 -6  2  34 o 226.5926 4.650129 628.9095       25.67715 635.3137       45.36227 625.8902       31.14748 226.3317 8.238317 225.6907 5.667831 0.6410522      9.999708 
1 1 1 -6  2  35 o 57.59122 3.935363 40.77082       5.489839 34.31590       8.440868 45.50303       7.227255 52.32243 6.779291 60.71367 4.927155 -8.391239      8.380671 
1 1 1 -6  2  36 o 56.23445 3.804390 38.88104       5.182742 41.45586       7.341131 36.32247       7.317933 57.84497 5.265537 54.04479 5.639343 3.800179       7.715443 
1 1 1 -6  2  37 o 78.26353 3.276610 75.05769       6.235316 80.42863       8.865411 69.79996       8.771477 80.81813 4.519469 75.21683 4.810654 5.601303       6.600605 
1 1 1 -6  2  38 f 134.4790 3.229506 221.3334       10.58343 222.5589       14.99728 220.1176       14.93737 134.4727 4.583293 133.7302 4.590426 0.7425079      6.486801 
1 1 1 -6  2  39 o 58.58853 5.300922 42.77672       7.486530 0.000000       0.000000 42.77672       7.486530 ?        ?        58.58853 5.300922 0.000000       5.300922 
1 1 1 -6  2  40 o 68.77010 4.023452 58.43974       6.713259 50.28294       8.164029 75.47168       11.79714 63.42991 5.330992 77.44452 6.305525 -14.01461      8.257065 
1 1 1 -6  2  41 o 51.61620 3.985474 33.09856       4.974251 31.63433       6.841141 34.74105       7.245574 49.94791 5.723777 52.35269 5.775195 -2.404781      8.131083 
1 1 1 -6  2  42 o 41.13120 4.540195 21.33698       4.475101 18.40221       5.885529 25.35898       6.890011 37.42418 6.699543 44.11429 6.612731 -6.690117      9.413400 
1 1 1 -6  2  43 o 16.59958 6.864648 1.478350       4.522502 4.162601       5.280564 -5.909429      8.760437 20.12357 7.704985 17.79045 8.287105 2.333122       11.31560 
1 1 1 -6  2  44 o 13.50008 6.199212 -2.607054      4.650247 0.7624087      8.902634 -3.871348      5.453337 20.76078 9.123204 14.07326 6.549792 6.687524       11.23088 
1 1 1 -6  2  45 o 23.51465 6.777888 7.793522       4.096073 3.893641       5.621175 12.20866       5.980999 19.49220 7.802739 28.67430 8.166615 -9.182098      11.29497 
1 1 1 -6  2  46 o 22.21862 6.801603 7.175105       4.027447 6.077827       5.568329 8.378828       5.832167 21.05223 7.946887 23.54030 8.241055 -2.488068      11.44849 
1 1 1 -6  2  47 o 19.61161 6.958634 5.655965       4.168773 4.818600       5.741749 6.589461       6.062380 19.25952 7.823061 20.95599 8.192207 -1.696468      11.32751 
1 1 1 -6  2  48 o 9.462150 4.684191 -7.541602      4.022128 -14.88895      5.960295 -1.398114      5.450170 10.27472 5.175780 14.21528 6.592596 -3.940562      8.381588 
1 1 1 -6  2  49 o 19.20821 7.223960 6.210124       4.591815 4.257267       5.524986 10.57161       8.256828 17.49847 7.433104 22.08777 9.216614 -4.589296      11.84048 
1 1 1 -6  2  50 o 12.50401 5.713283 -0.8708933E-01 3.884546 0.1763735      5.398522 -0.3699608     5.593837 14.11551 6.551476 13.98727 6.550363 0.1282396      9.264399 
1 1 1 -6  2  51 o 14.02595 6.011067 2.505574       3.670605 -1.082696      5.000102 6.699480       5.405621 12.68376 6.016422 17.89610 7.461695 -5.212339      9.585104 
1 1 1 -6  2  52 o 11.25426 5.382298 -1.786663      4.173058 -3.063907      4.869381 1.745867       8.098039 11.40526 5.542230 14.94711 7.235922 -3.541852      9.114543 
1 1 1 -6  3  1  o 118.8387 2.194096 172.0997       6.354037 185.7108       10.31965 163.7888       8.063872 123.3890 3.435385 115.9284 2.854418 7.460571       4.466494 
1 1 1 -6  3  2  o 350.3925 5.235562 1497.074       44.70481 1455.655       62.13156 1541.534       64.37228 345.3829 7.382022 355.4214 7.432231 -10.03857      10.47532 
1 1 1 -6  3  3  o 244.0019 3.847324 725.7249       22.87642 760.2166       33.29227 694.8716       31.48742 249.6803 5.471710 238.7106 5.412890 10.96967       7.696686 
1 1 1 -6  3  4  o 445.0176 7.523445 2416.968       81.58871 2361.075       139.3693 2446.111       100.6355 438.9320 13.04415 447.5079 9.228146 -8.575897      15.97838 
1 1 1 -6  3  5  o 93.81003 2.226681 107.2435       5.090300 108.4497       7.326890 106.1180       7.077146 94.27452 3.193867 93.25759 3.118525 1.016930       4.463852 
1 1 1 -6  3  6  o 254.8140 3.988890 791.5390       24.76917 761.6289       34.30902 824.0981       35.79607 249.8905 5.634074 259.9358 5.651103 -10.04533      7.979834 
1 1 1 -6  3  7  o 152.1362 2.771984 282.0856       10.27683 268.6038       14.30928 296.4473       14.76889 148.3838 3.960808 155.9419 3.886413 -7.558090      5.549073 
1 1 1 -6  3  8  o 113.0786 2.409701 155.8306       6.640180 151.9942       9.447479 159.5760       9.334800 111.6120 3.477757 114.3699 3.352945 -2.757874      4.830842 
1 1 1 -6  3  9  o 509.0728 8.550037 3165.271       106.0679 3188.424       184.9050 3153.916       129.4915 509.4704 14.90943 507.8553 10.46321 1.615082       18.21455 
1 1 1 -6  3  10 o 812.3297 13.45405 8085.502       266.3308 8027.817       324.6628 8204.190       465.7031 808.2952 16.48263 813.2831 23.52274 -4.987854      28.72275 
1 1 1 -6  3  11 o 528.1686 7.669353 3404.603       98.71142 3264.268       135.8435 3561.604       143.6843 516.7531 10.78747 539.7529 10.92391 -22.99988      15.35257 
1 1 1 -6  3  12 o 233.6901 3.755690 665.6307       21.38780 676.7382       30.56198 654.9698       29.94141 235.5918 5.323353 231.7723 5.301205 3.819412       7.512713 
1 1 1 -6  3  13 o 444.2418 6.524157 2406.696       70.62849 2364.527       98.78094 2450.801       101.0244 440.1436 9.209640 448.0979 9.251608 -7.954254      13.05411 
1 1 1 -6  3  14 o 477.7051 6.981159 2782.915       81.26875 2743.707       113.9510 2823.501       115.9375 474.1248 9.862550 480.9674 9.891730 -6.842590      13.96840 
1 1 1 -6  3  15 o 660.7411 9.509509 5327.213       153.1178 5270.570       215.0469 5385.458       218.0671 656.7438 13.43696 663.8570 13.47968 -7.113159      19.03296 
1 1 1 -6  3  16 o 117.6163 2.600486 168.5727       7.453463 160.4002       10.38377 177.2589       10.70515 114.6631 3.721094 120.5471 3.648379 -5.884018      5.211258 
1 1 1 -6  3  17 o 509.4410 10.49683 3167.902       130.3132 3314.308       189.6053 3036.833       179.3993 520.3865 14.96717 498.1341 14.79517 22.25244       21.04550 
1 1 1 -6  3  18 o 470.4480 7.977687 2699.679       91.45863 2805.471       114.8604 2516.400       151.1824 479.4390 9.831069 453.5031 13.69566 25.93585       16.85885 
1 1 1 -6  3  19 o 530.7465 7.733490 3436.189       100.0228 3617.410       146.4263 3277.654       136.9552 544.2394 11.04061 518.0720 10.84807 26.16742       15.47823 
1 1 1 -6  3  20 o 154.7894 3.022552 291.9935       11.40121 303.9068       16.38941 280.8226       15.87059 157.8427 4.264824 151.7237 4.296762 6.118973       6.053998 
1 1 1 -6  3  21 o 60.59443 2.994668 44.85663       4.408287 47.25993       6.130321 42.28313       6.343671 62.13344 4.071183 58.72499 4.466334 3.408451       6.043399 
1 1 1 -6  3  22 o 190.3059 3.932468 441.4797       18.23701 445.4660       22.44318 433.7314       31.28979 191.0802 4.823698 188.4180 6.825941 2.662155       8.358321 
1 1 1 -6  3  23 o 172.3264 3.787730 362.0291       15.90622 393.8771       29.60524 349.1049       18.85950 179.5126 6.779829 169.1395 4.579825 10.37306       8.181740 
1 1 1 -6  3  24 o 149.6788 3.050128 273.1002       11.12537 283.8305       16.00930 263.0783       15.47175 152.4959 4.312354 146.8096 4.329359 5.686310       6.110625 
1 1 1 -6  3  25 o 62.83565 3.078324 48.25132       4.699295 45.57798       6.580665 51.03319       6.712922 60.96149 4.460614 64.53923 4.292667 -3.577736      6.190643 
1 1 1 -6  3  26 f 92.08814 2.865509 103.4923       6.422627 99.94494       8.960093 107.2411       9.211039 90.41905 4.076947 93.67009 4.044793 -3.251038      5.742982 
1 1 1 -6  3  27 o 273.2401 4.400085 911.3820       29.29824 938.4825       42.12799 885.9965       40.77316 277.0132 6.240712 269.1595 6.216251 7.853699       8.808420 
1 1 1 -6  3  28 o 100.2204 2.891351 122.6005       7.054053 126.4298       10.00714 118.8186       9.945026 101.6892 4.046381 98.56686 4.149651 3.122375       5.795930 
1 1 1 -6  3  29 o 188.0920 3.940881 431.9403       18.06341 427.5999       30.28961 434.3358       22.50276 186.6770 6.669068 188.4454 4.904373 -1.768402      8.278245 
1 1 1 -6  3  30 o 134.8719 3.491739 222.1854       11.46658 226.0841       14.21315 214.9176       19.40588 135.9657 4.295068 132.3218 6.034070 3.643951       7.406592 
1 1 1 -6  3  31 o 87.85752 2.961513 94.29781       6.331513 85.42793       8.570259 104.9561       9.394640 83.50056 4.225543 92.58102 4.174850 -9.080460      5.940083 
1 1 1 -6  3  32 o 189.2274 3.529953 437.3376       16.27755 430.3982       22.80123 444.5497       23.24504 187.4291 4.996578 190.4845 5.012012 -3.055344      7.077150 
1 1 1 -6  3  33 o 181.2820 4.027296 401.8391       17.79116 390.3032       21.27874 428.6365       32.43148 178.4439 4.898002 186.3885 7.153498 -7.944550      8.669657 
1 1 1 -6  3  34 o 75.87374 3.847098 70.57858       7.089918 65.95718       12.85898 72.59708       8.498369 72.73525 7.355792 76.85957 4.557808 -4.124313      8.653398 
1 1 1 -6  3  35 o 80.24359 3.206549 78.80353       6.257617 84.23611       8.901853 73.49663       8.798270 82.80647 4.427533 77.29122 4.693349 5.515251       6.452176 
1 1 1 -6  3  36 o 116.3186 3.518072 165.6558       9.960711 156.1895       15.97968 171.6711       12.73823 112.4606 5.850964 118.2481 4.428402 -5.787460      7.337883 
1 1 1 -6  3  37 o 95.56777 3.231473 111.8424       7.514896 111.8811       10.48348 111.8016       10.77797 95.35612 4.524404 95.29496 4.655295 0.6116486E-01  6.491687 
1 1 1 -6  3  38 o 64.60401 4.446960 51.52798       6.958271 43.69227       12.63290 54.94057       8.336918 58.18375 9.216516 66.56740 5.180095 -8.383652      10.57249 
1 1 1 -6  3  39 o 65.76015 3.986830 53.33117       6.358892 56.78540       10.36196 51.24446       8.053741 67.24645 6.400277 64.18642 5.193261 3.060036       8.242178 
1 1 1 -6  3  40 o 94.80685 3.266015 110.4420       7.534335 108.9877       10.40926 112.0424       10.91934 93.80600 4.567311 95.05934 4.728585 -1.253342      6.574180 
1 1 1 -6  3  41 o 111.4321 3.194175 152.7944       8.664763 148.3403       11.96499 157.7060       12.56464 109.2666 4.503191 112.6277 4.587529 -3.361053      6.428386 
1 1 1 -6  3  42 o 38.26270 4.880204 18.60286       4.446978 17.43754       6.100383 19.92431       6.496217 36.21511 7.166250 38.78462 7.136175 -2.569511      10.11336 
1 1 1 -6  3  43 o 34.44073 6.142419 15.67474       4.966123 16.18705       5.803797 14.27426       9.595903 34.58693 7.123251 31.56398 10.58532 3.022947       12.75891 
1 1 1 -6  3  44 o 29.67438 8.865841 12.83645       6.901817 26.20140       10.86736 3.801533       8.935163 41.00695 10.74699 22.54309 9.508457 18.46386       14.34951 
1 1 1 -6  3  45 o 32.15221 5.882953 14.08730       4.439571 19.21931       6.240789 8.829329       6.316906 36.77840 7.221085 24.68669 8.580981 12.09172       11.21505 
1 1 1 -6  3  46 o 19.92452 6.813741 5.566577       3.977167 3.293266       5.292709 8.515260       6.027851 18.19152 7.464544 23.63584 8.369436 -5.444317      11.21458 
1 1 1 -6  3  47 o 10.06604 4.833646 -3.969868      3.442105 -6.917246      4.316235 1.179325       5.705014 10.30052 5.050872 16.40044 7.251155 -6.099922      8.836886 
1 1 1 -6  3  48 o 17.59072 6.842236 4.355351       4.212004 5.136643       6.414244 3.763044       5.584856 19.11871 8.059730 17.70480 7.494960 1.413914       11.00607 
1 1 1 -6  3  49 o 22.99467 6.751638 8.848846       4.030910 6.402520       5.279183 12.26909       6.242208 19.28086 7.612214 24.76058 8.533915 -5.479725      11.43562 
1 1 1 -6  3  50 f 12.39017 5.631144 0.6912623E-01  3.710161 0.5591710E-01  5.110741 0.8384389E-01  5.394687 13.78358 6.389486 14.03120 6.524888 -0.2476168     9.132344 
1 1 1 -6  3  51 o 9.227875 4.535157 -4.798565      3.542494 1.408475       4.760888 -12.49802      5.302440 13.85336 6.327983 9.385495 4.746325 4.467867       7.910182 
1 1 1 -6  3  52 o 10.49215 5.010550 -1.909551      3.588648 -6.972997      4.833654 4.309239       5.356800 10.03304 4.995146 15.50635 6.930595 -5.473310      8.543104 
1 1 1 -6  4  1  o 326.0002 4.938734 1295.878       39.23463 1309.199       55.69701 1282.757       55.27767 327.5505 6.977785 324.2245 6.996289 3.325928       9.881171 
1 1 1 -6  4  2  o 297.1484 4.067462 1076.391       29.45324 1015.313       44.91415 1122.473       39.01283 288.4890 6.388779 303.3908 5.276780 -14.90176      8.286187 
1 1 1 -6  4  3  o 234.2478 3.737339 668.8726       21.33410 674.5549       30.42787 663.3782       29.92047 235.1895 5.309059 233.2346 5.264284 1.954880       7.476549 
1 1 1 -6  4  4  o 224.4854 4.183390 614.3561       22.88508 566.7444       38.23971 640.9243       28.56529 215.3679 7.296677 229.2569 5.113051 -13.88902      8.909814 
1 1 1 -6  4  5  o 271.8132 4.866360 900.8976       32.23375 897.4926       55.92667 902.5914       39.44426 270.9589 8.480364 272.0177 5.950459 -1.058807      10.35976 
1 1 1 -6  4  6  o 344.2633 5.163260 1445.331       43.31625 1424.916       60.80839 1466.362       61.71862 341.6740 7.303238 346.6071 7.307061 -4.933075      10.33104 
1 1 1 -6  4  7  o 192.9667 3.246967 453.8649       15.26850 477.1573       22.27965 433.2382       20.96601 197.8199 4.621706 188.4978 4.564291 9.322021       6.495607 
1 1 1 -6  4  8  o 393.3855 6.728923 1888.411       64.50598 1931.442       113.5723 1867.918       78.37459 397.0596 11.75056 391.1001 8.223396 5.959442       14.34224 
1 1 1 -6  4  9  o 298.5529 4.569452 1086.780       33.24463 1074.870       46.78417 1098.928       47.24929 296.8120 6.468169 300.1158 6.460562 -3.303772      9.141995 
1 1 1 -6  4  10 o 595.6560 9.945136 4335.697       144.3585 4352.957       177.5601 4302.044       247.9335 596.4002 12.21719 591.3838 17.22236 5.016418       21.11562 
1 1 1 -6  4  11 o 147.9310 3.202804 266.7108       11.54584 258.8613       14.09287 282.7343       20.13538 145.6733 3.973648 152.1747 5.438514 -6.501419      6.735527 
1 1 1 -6  4  12 o 551.5443 7.994608 3711.827       107.4518 3797.815       154.3353 3630.937       149.6906 557.4905 11.36035 545.1172 11.26857 12.37323       16.00119 
1 1 1 -6  4  13 o 126.1614 2.603476 193.9613       8.004166 195.1765       11.44093 192.7964       11.20205 126.4929 3.715608 125.7207 3.660305 0.7721786      5.215704 
1 1 1 -6  4  14 o 502.7737 7.326416 3082.797       89.76359 3033.989       125.6521 3133.667       128.2784 498.5536 10.34241 506.6729 10.38939 -8.119293      14.65963 
1 1 1 -6  4  15 o 646.7828 9.317323 5104.070       146.8540 4920.811       202.5870 5307.004       213.1838 634.6424 13.09925 659.0522 13.27389 -24.40979      18.64904 
1 1 1 -6  4  16 f 195.2950 3.353607 464.7992       15.96024 475.3004       22.91127 454.8992       22.24582 197.4711 4.761124 193.1872 4.725349 4.283966       6.707997 
1 1 1 -6  4  17 o 296.2869 6.460045 1070.361       46.64275 1019.841       63.62863 1129.039       68.57428 288.9737 9.046767 304.0488 9.265929 -15.07507      12.94996 
1 1 1 -6  4  18 o 557.3841 8.097930 3789.859       109.9929 3987.004       160.9507 3617.107       150.6651 571.3512 11.55989 544.2246 11.36053 27.12659       16.20780 
1 1 1 -6  4  19 o 467.8336 6.874839 2669.255       78.37725 2655.048       110.5387 2683.618       111.1482 466.3715 9.726269 468.8738 9.727700 -2.502380      13.75603 
1 1 1 -6  4  20 o 111.4841 2.750215 151.4623       7.471634 152.0711       10.55614 150.8511       10.57687 111.6311 3.886392 111.1808 3.909919 0.4502869      5.512849 
1 1 1 -6  4  21 o 334.5691 5.121944 1364.804       41.75963 1295.316       57.23730 1443.889       61.06215 325.8330 7.208551 344.0076 7.283967 -18.17462      10.24790 
1 1 1 -6  4  22 o 243.8420 4.613316 724.9551       27.41308 710.1566       33.25498 756.3326       48.42366 241.3002 5.655394 248.7701 7.998123 -7.469894      9.795584 
1 1 1 -6  4  23 f 88.37875 3.339010 95.34789       7.178272 101.7892       13.70327 92.91192       8.426993 91.12087 6.208289 87.20622 3.975878 3.914650       7.372277 
1 1 1 -6  4  24 o 403.8036 6.049372 1990.445       59.52735 1970.222       83.73418 2011.109       84.64192 401.3750 8.560839 405.5178 8.565240 -4.142731      12.10997 
1 1 1 -6  4  25 o 98.64708 2.779050 118.7224       6.673962 115.2905       9.414046 122.1901       9.462959 97.14259 3.985233 100.0180 3.889929 -2.875374      5.568989 
1 1 1 -6  4  26 o 194.9990 3.494836 463.7629       16.60715 477.4124       23.86352 450.9442       23.12596 197.6881 4.957476 192.1279 4.943497 5.560257       7.001052 
1 1 1 -6  4  27 o 215.0797 3.725668 564.4184       19.52719 560.6093       27.53592 568.2719       27.69602 214.2052 5.275133 215.6647 5.269896 -1.459549      7.456463 
1 1 1 -6  4  28 o 86.45812 2.855061 91.26470       6.007049 92.97755       8.485667 89.54410       8.504866 87.18159 4.004855 85.54574 4.091606 1.635849       5.725391 
1 1 1 -6  4  29 o 83.54864 3.827200 85.39453       7.771441 81.89885       10.25383 90.11280       11.91274 81.67826 5.178276 85.62192 5.742609 -3.943657      7.732535 
1 1 1 -6  4  30 o 140.7133 3.542059 241.8615       12.13617 234.2112       14.72183 258.0871       21.43981 138.3772 4.371257 145.0121 6.080587 -6.634918      7.488753 
1 1 1 -6  4  31 o 76.47786 3.005316 71.48608       5.590049 70.02662       7.618277 73.18846       8.227921 75.58491 4.151996 77.25117 4.388734 -1.666267      6.041527 
1 1 1 -6  4  32 o 92.42467 2.953099 104.3681       6.642694 95.37123       9.050838 114.8726       9.779833 88.21731 4.222422 96.84433 4.153670 -8.627022      5.922991 
1 1 1 -6  4  33 o 146.1557 3.701916 261.2350       13.17434 256.2215       15.84975 272.4410       23.69607 144.6183 4.502904 148.6843 6.556078 -4.066025      7.953509 
1 1 1 -6  4  34 o 97.91956 3.057499 117.2140       7.286843 122.0809       10.31806 112.3714       10.29230 99.78200 4.253112 95.69902 4.425334 4.082977       6.137796 
1 1 1 -6  4  35 f 64.66462 4.298987 51.43690       6.735902 32.18837       12.09409 60.09296       8.110262 49.79967 10.30571 69.84087 4.794371 -20.04119      11.36634 
1 1 1 -6  4  36 o 133.2573 3.187469 217.0787       10.35078 213.4210       14.53200 220.8453       14.74679 131.8331 4.530130 134.1117 4.518718 -2.278641      6.398507 
1 1 1 -6  4  37 o 114.7890 4.562783 162.0608       12.73797 0.000000       0.000000 162.0608       12.73797 ?        ?        114.7890 4.562783 0.000000       4.562783 
1 1 1 -6  4  38 o 154.7315 3.352213 293.1857       12.63998 300.9891       17.96476 285.5353       17.78782 156.3239 4.721261 152.2263 4.801097 4.097595       6.733561 
1 1 1 -6  4  39 o 98.90238 3.562977 120.1713       8.573254 114.7245       13.75081 123.6350       10.96541 95.94274 5.910078 100.0744 4.507981 -4.131683      7.433096 
1 1 1 -6  4  40 f 92.71678 3.244370 105.6403       7.319056 106.5484       10.15950 104.6604       10.55314 92.75018 4.508418 91.84756 4.730901 0.9026184      6.535079 
1 1 1 -6  4  41 o 29.16948 6.225698 11.11305       4.290594 15.43064       5.779250 5.810810       6.404428 34.21327 7.161866 23.15717 8.566322 11.05610       11.16576 
1 1 1 -6  4  42 o 48.20448 3.993632 29.03922       4.649217 26.08002       6.355689 32.44524       6.818670 44.98411 5.943109 50.36800 5.652752 -5.383896      8.202082 
1 1 1 -6  4  43 o 34.76917 5.888971 15.89753       4.811729 15.39145       5.598517 17.32811       9.412712 33.70663 7.043192 34.31870 10.37647 -0.6120720     12.54104 
1 1 1 -6  4  44 o 38.96660 4.675996 19.58506       4.351614 17.74335       5.924078 21.74345       6.413209 35.87463 7.027870 39.91995 6.838347 -4.045322      9.805812 
1 1 1 -6  4  45 o 30.48105 6.910844 13.20936       5.014550 12.98078       5.832500 13.85722       9.819008 29.59659 7.927983 29.17917 10.63791 0.4174175      13.26718 
1 1 1 -6  4  46 o 13.55342 5.964569 -0.3556363E-01 3.817892 -1.769956      4.979100 2.439296       5.947747 14.04339 6.436057 18.01110 7.683596 -3.967709      10.02300 
1 1 1 -6  4  47 o 11.44255 5.324090 -2.086547      3.599696 -1.772453      4.696106 -2.534012      5.605160 13.32930 6.159904 14.08208 6.582478 -0.7527847     9.015178 
1 1 1 -6  4  48 o 15.32043 6.437195 2.272610       4.070276 -2.729288      6.254085 5.948012       5.361036 14.36708 6.789262 19.49265 7.678664 -5.125566      10.24968 
1 1 1 -6  4  49 f 23.75418 6.846611 9.549273       4.179647 9.785508       5.857090 9.304150       5.966250 22.36367 8.206032 21.80787 8.227304 0.5557976      11.62013 
1 1 1 -6  4  50 o 15.81984 6.473988 3.788942       3.967762 3.580535       5.406903 4.032132       5.840698 16.13221 7.098814 16.57751 7.332807 -0.4453011     10.20604 
1 1 1 -6  4  51 o 14.30706 6.375070 2.350046       4.496334 -0.2826554     5.334995 8.805398       8.353974 13.29832 6.280101 18.35433 8.383357 -5.056008      10.47475 
1 1 1 -6  5  1  o 21.45565 2.546990 5.689185       1.305744 3.027872       1.897661 8.082164       1.799451 15.65944 4.641622 25.58324 2.939704 -9.923800      5.494226 
1 1 1 -6  5  2  o 177.5719 3.112205 384.3173       13.46724 384.3799       18.94783 384.2534       19.14480 177.5594 4.379048 177.5290 4.425330 0.3039551E-01  6.225721 
1 1 1 -6  5  3  o 188.8269 3.208105 434.5883       14.76211 444.4674       21.22412 425.3304       20.54596 190.9287 4.561653 186.7745 4.514116 4.154251       6.417625 
1 1 1 -6  5  4  o 326.6598 5.704955 1301.543       45.41340 1317.421       79.67412 1293.901       55.27084 328.1385 9.975361 325.6147 6.965558 2.523743       12.16663 
1 1 1 -6  5  5  o 196.0599 3.297751 468.5337       15.75588 463.7233       22.28757 473.3394       22.27680 195.0148 4.689852 197.0279 4.639690 -2.013107      6.597078 
1 1 1 -6  5  6  o 321.4374 4.871749 1259.938       38.16080 1284.119       54.75587 1237.101       53.21227 324.3737 6.927059 318.3851 6.858402 5.988617       9.747913 
1 1 1 -6  5  7  o 261.5961 4.734465 834.4341       30.18132 805.8443       51.52341 849.3691       37.23923 256.7498 8.245594 263.8780 5.791105 -7.128174      10.07605 
1 1 1 -6  5  8  o 636.1862 10.59710 4949.407       164.2886 5053.099       288.9692 4899.884       199.7041 640.1667 18.54301 632.4275 12.95807 7.739258       22.62200 
1 1 1 -6  5  9  o 587.0757 8.487317 4208.583       121.4229 4081.278       168.2475 4346.960       175.4123 577.5134 11.95503 595.9880 12.07776 -18.47467      16.99397 
1 1 1 -6  5  10 o 120.4241 2.909740 176.7395       8.538932 179.1048       10.66322 172.5116       14.25642 121.1657 3.615418 118.8469 4.933234 2.318741       6.116212 
1 1 1 -6  5  11 o 588.9502 8.514912 4233.606       122.2066 4267.793       174.0152 4200.338       171.6614 590.8082 12.08661 586.1320 12.01825 4.676208       17.04478 
1 1 1 -6  5  12 o 131.5578 2.650578 210.9124       8.497544 211.9679       12.17586 209.9102       11.86486 131.8221 3.794261 131.1832 3.715232 0.6388550      5.310308 
1 1 1 -6  5  13 f 465.9639 6.826324 2647.727       77.51313 2630.995       109.3034 2664.655       109.9396 464.2950 9.660588 467.2560 9.655242 -2.961029      13.65835 
1 1 1 -6  5  14 o 964.2762 13.76845 11364.31       323.5359 11725.10       467.2596 11032.02       448.4196 977.9236 19.60727 948.6428 19.39750 29.28082       27.58094 
1 1 1 -6  5  15 o 536.8124 7.802492 3514.496       102.0686 3456.076       142.7633 3575.582       145.9841 532.0821 11.01036 541.1978 11.06913 -9.115723      15.61262 
1 1 1 -6  5  16 o 729.2557 10.47083 6491.176       186.0789 6394.896       260.6652 6591.224       265.7181 723.2003 14.79069 734.2072 14.85137 -11.00684      20.96014 
1 1 1 -6  5  17 o 233.0374 5.360357 662.0157       30.44076 649.6269       42.05608 675.6486       44.11731 230.6720 7.491594 235.2379 7.706410 -4.565948      10.74769 
1 1 1 -6  5  18 o 54.18646 2.821992 35.87789       3.713500 39.37811       5.232327 32.32539       5.271255 56.71407 3.807958 51.32306 4.252837 5.391003       5.708517 
1 1 1 -6  5  19 o 393.5163 5.882517 1888.142       56.41077 1904.677       80.24055 1871.984       79.32114 395.0968 8.334016 391.6928 8.310120 3.403961       11.76919 
1 1 1 -6  5  20 o 556.3840 8.092032 3777.542       109.7156 3843.175       157.0440 3714.965       153.3447 560.7678 11.49218 551.3461 11.41322 9.421631       16.19666 
1 1 1 -6  5  21 o 138.8976 2.923751 235.1231       9.896259 232.0795       13.96233 238.1956       14.02875 137.9168 4.159117 139.7255 4.124610 -1.808670      5.857531 
1 1 1 -6  5  22 o 205.2685 4.100995 513.6788       20.51387 511.4376       25.17836 518.1040       35.37952 204.7910 5.045223 205.9183 7.060963 -1.127228      8.678218 
1 1 1 -6  5  23 o 66.43410 3.626831 53.96572       5.849302 52.89952       11.27621 54.35823       6.841782 65.42831 7.190686 66.63353 4.235395 -1.205215      8.345330 
1 1 1 -6  5  24 o 164.4020 3.169566 329.4989       12.69822 324.1715       17.83082 334.9810       18.08793 162.9615 4.494334 165.6588 4.484748 -2.697357      6.349173 
1 1 1 -6  5  25 o 100.3502 2.791474 122.8585       6.819707 126.2570       9.682125 119.5123       9.607355 101.6671 3.915317 98.90492 3.994332 2.762131       5.593246 
1 1 1 -6  5  26 o 238.6379 3.982833 694.8098       23.16154 742.3386       34.02782 653.7803       31.61577 246.4964 5.664837 231.3327 5.608291 15.16365       7.971406 
1 1 1 -6  5  27 o 138.5312 2.990783 234.0457       10.09645 246.8032       14.60863 222.3794       13.96985 142.1295 4.222512 134.9043 4.254741 7.225159       5.994366 
1 1 1 -6  5  28 o 130.0672 3.357075 206.5457       10.63168 224.4036       18.02948 197.0258       13.16397 135.3572 5.477265 126.9532 4.261112 8.404015       6.939561 
1 1 1 -6  5  29 o 54.81419 3.284875 36.79385       4.367682 32.24584       5.994784 41.93956       6.376545 51.13279 4.869760 58.41576 4.514399 -7.282963      6.640358 
1 1 1 -6  5  30 o 108.7613 3.356144 144.5172       8.884460 140.6616       10.77194 152.7200       15.71203 107.2248 4.130240 111.5179 5.801597 -4.293068      7.121615 
1 1 1 -6  5  31 o 15.25496 6.025441 1.566393       3.309007 -0.1602860     4.451703 3.698333       4.946611 15.51431 6.633700 20.04160 7.506142 -4.527289      10.01739 
1 1 1 -6  5  32 o 97.46160 2.939237 116.0425       6.972807 116.5674       9.860892 115.5176       9.861185 97.55399 4.157498 97.11055 4.176795 0.4434357      5.893251 
1 1 1 -6  5  33 o 91.47643 3.484892 102.3851       7.754248 98.41763       9.320933 111.3027       13.97415 89.58775 4.281872 94.99362 6.068367 -5.405869      7.426945 
1 1 1 -6  5  34 o 85.91170 3.069432 90.26112       6.415759 84.89201       8.861614 96.17564       9.300818 83.15230 4.388772 88.52973 4.324259 -5.377434      6.161212 
1 1 1 -6  5  35 o 30.71288 7.161586 12.12146       5.260949 2.105888       9.636868 16.37364       6.279196 24.08125 9.995233 35.73149 7.452919 -11.65024      12.46799 
1 1 1 -6  5  36 o 61.83382 4.426423 47.12355       6.625714 42.39498       11.94442 49.22527       7.963194 57.65157 8.778682 63.06568 5.228482 -5.414112      10.21774 
1 1 1 -6  5  37 o 160.6931 3.381570 316.0160       13.24194 313.2633       18.66070 318.8082       18.79388 159.5655 4.804495 160.9754 4.796291 -1.409882      6.788783 
1 1 1 -6  5  38 o 68.32085 3.566157 57.36111       5.916757 58.31246       8.324858 56.38998       8.410921 68.60522 5.014099 67.42632 5.158074 1.178902       7.193533 
1 1 1 -6  5  39 o 134.0097 3.252345 220.1315       10.62108 217.3188       14.87111 223.0601       15.17445 132.6756 4.606548 134.4060 4.639914 -1.730408      6.538279 
1 1 1 -6  5  40 o 101.9208 3.171067 127.6146       7.866394 130.2848       10.96345 124.7812       11.29341 102.5985 4.395190 100.3177 4.632178 2.280762       6.385512 
1 1 1 -6  5  41 f 14.31086 6.266243 -0.6974573     4.166018 -5.216206      4.964950 10.05316       7.658128 12.86923 6.071670 28.04693 9.456666 -15.17770      11.23805 
1 1 1 -6  5  42 f 47.02660 4.632408 27.90618       5.239828 34.56912       6.373173 14.00685       9.204906 52.21666 5.072368 31.80239 10.35549 20.41427       11.53105 
1 1 1 -6  5  43 o 23.89161 6.452297 7.687643       3.844152 6.546690       5.075683 9.222495       5.886999 22.55774 7.697842 25.98049 8.265200 -3.422745      11.29470 
1 1 1 -6  5  44 o 63.26703 3.523675 50.22923       5.411159 45.90826       7.322893 55.42640       8.031116 59.54287 5.095749 65.47456 5.073015 -5.931694      7.190420 
1 1 1 -6  5  45 o 34.89373 6.291309 16.86124       5.152874 29.03566       10.22356 12.71529       5.966100 42.46474 10.03894 29.10181 8.110805 13.36293       12.90602 
1 1 1 -6  5  46 o 21.53029 7.341113 6.820489       4.615987 2.909312       5.226259 20.69504       9.843433 17.69435 7.353898 33.36908 10.69537 -15.67472      12.97963 
1 1 1 -6  5  47 o 16.24376 6.488983 3.055145       3.879490 8.013587       5.091741 -3.806837      5.989885 22.25780 7.705806 13.89518 6.589293 8.362613       10.13895 
1 1 1 -6  5  48 o 16.65574 6.570163 3.706791       3.929722 6.813325       5.347519 0.5953268E-01  5.794254 20.27465 7.755957 15.27343 6.978316 5.001229       10.43320 
1 1 1 -6  5  49 o 11.31900 5.296589 -1.732942      3.645281 -5.514786      4.931653 2.821830       5.412203 11.30962 5.514082 16.18946 7.113898 -4.879841      9.000702 
1 1 1 -6  5  50 o 19.69348 7.095257 7.348080       4.351171 4.214265       5.169919 14.95922       8.056971 16.44302 7.091437 23.41492 9.352143 -6.971903      11.73674 
1 1 1 -6  5  51 o 20.65429 7.460822 9.170194       4.814890 7.289656       5.694647 13.88548       9.017369 18.13662 7.616889 20.51748 9.091634 -2.380861      11.86064 
1 1 1 -6  6  1  o 222.4930 3.249557 603.3848       17.61881 595.8591       22.66479 614.8774       28.00860 221.0743 4.207046 224.5423 5.118671 -3.467957      6.625710 
1 1 1 -6  6  2  o 484.0585 6.323543 2858.833       74.59237 2859.495       118.0034 2858.392       96.26433 483.6226 10.01272 483.8032 8.165082 -0.1806641     12.91987 
1 1 1 -6  6  3  o 211.7611 3.517693 546.6144       18.15266 532.6805       25.29460 561.4115       26.06625 209.0011 4.966418 214.5628 4.985263 -5.561707      7.036914 
1 1 1 -6  6  4  o 115.7879 2.901707 163.5042       8.181075 166.7955       14.87300 162.0763       9.796244 116.8295 5.237397 115.2571 3.491860 1.572350       6.294713 
1 1 1 -6  6  5  o 79.37614 2.605841 76.86919       5.033673 77.88564       8.904324 76.39180       6.102303 79.79092 4.598913 79.10404 3.172054 0.6868820      5.586764 
1 1 1 -6  6  6  o 402.1765 6.875815 1973.853       67.38714 1970.662       116.7779 1975.446       82.51087 401.0448 11.96238 402.1829 8.418825 -1.138123      14.62789 
1 1 1 -6  6  7  o 334.4433 5.053966 1363.982       41.18992 1360.563       58.29646 1367.390       58.20633 333.8853 7.164878 334.7242 7.135871 -0.8389282     10.11218 
1 1 1 -6  6  8  o 532.3999 7.737727 3459.890       100.3893 3624.153       146.4510 3314.291       137.8802 544.3860 11.03950 520.6231 10.86782 23.76288       15.49129 
1 1 1 -6  6  9  o 608.2533 10.14759 4520.790       150.4123 4461.037       182.6951 4646.500       264.9920 603.7925 12.41661 614.6147 17.71115 -10.82220      21.63000 
1 1 1 -6  6  10 o 339.9231 5.131173 1408.790       42.50435 1397.115       59.93147 1420.605       60.29060 338.4024 7.267505 341.2364 7.250336 -2.833984      10.26567 
1 1 1 -6  6  11 o 482.4603 7.049609 2839.158       82.88248 2795.012       116.1175 2885.012       118.3412 478.4424 9.959373 486.0811 9.990586 -7.638702      14.10677 
1 1 1 -6  6  12 o 604.1578 8.734293 4453.734       128.5921 4640.634       187.3057 4287.105       176.8572 616.2496 12.47263 592.3413 12.25221 23.90826       17.48380 
1 1 1 -6  6  13 f 275.8229 4.314785 927.2606       29.00184 916.6431       40.87444 938.0251       41.15662 274.1963 6.117222 277.3766 6.088829 -3.180359      8.631004 
1 1 1 -6  6  14 o 395.5893 5.890586 1907.794       56.78572 1793.096       77.31754 2042.123       83.67269 383.4119 8.275159 409.1646 8.391692 -25.75278      11.78553 
1 1 1 -6  6  15 o 54.68084 2.581899 36.51646       3.430696 34.22138       4.956752 38.62684       4.753125 52.84829 3.875798 56.19083 3.488387 -3.342548      5.214466 
1 1 1 -6  6  16 o 213.5072 4.091766 555.5840       21.28921 590.2694       37.74453 539.4009       25.78162 219.8992 7.052714 210.3601 5.029337 9.539108       8.662274 
1 1 1 -6  6  17 o 100.7129 3.089335 123.7248       7.573077 122.4534       9.217263 126.3663       13.28523 100.1657 3.782929 101.6708 5.381286 -1.505180      6.577901 
1 1 1 -6  6  18 o 263.1922 4.200763 844.3021       26.94246 822.2702       37.63876 867.4540       38.58360 259.6918 5.947589 266.7318 5.935973 -7.039978      8.402951 
1 1 1 -6  6  19 o 462.4253 6.811105 2608.042       76.75299 2516.101       106.1166 2708.910       111.1484 453.9828 9.591969 471.0474 9.682837 -17.06464      13.62950 
1 1 1 -6  6  20 o 781.6517 11.23295 7467.219       213.9652 7820.688       312.1592 7153.989       293.8547 798.6742 16.03875 763.9476 15.78458 34.72656       22.50321 
1 1 1 -6  6  21 o 60.88120 3.262982 45.30536       4.823303 43.84295       5.950896 48.10577       8.234897 59.83054 4.106434 62.57066 5.455202 -2.740124      6.828032 
1 1 1 -6  6  22 o 405.8668 6.066592 2009.750       60.00181 2040.977       85.78631 1979.844       83.95411 408.7361 8.612693 402.5749 8.557742 6.161194       12.14139 
1 1 1 -6  6  23 o 56.62529 3.899671 39.28043       5.348282 34.92400       10.13820 40.96032       6.295564 52.85073 8.132092 57.77842 4.506921 -4.927685      9.297487 
1 1 1 -6  6  24 o 220.4587 3.749959 592.6660       20.14605 591.5780       28.49689 593.7529       28.48474 220.1672 5.311398 220.5723 5.299380 -0.4051514     7.502958 
1 1 1 -6  6  25 o 100.8964 2.771975 124.2005       6.809093 125.1255       9.584364 123.2579       9.675305 101.2079 3.893351 100.4441 3.960557 0.7637711      5.553754 
1 1 1 -6  6  26 o 52.41815 3.233199 33.63712       4.109903 33.63835       5.724281 33.63580       5.904467 52.29961 4.536265 52.28157 4.684006 0.1804352E-01  6.520553 
1 1 1 -6  6  27 o 122.3965 2.911350 182.7005       8.683598 178.8080       12.17342 186.7329       12.39038 120.9594 4.135957 123.6154 4.118915 -2.655998      5.837088 
1 1 1 -6  6  28 o 74.53296 3.198946 67.89671       5.796679 63.70047       8.865155 71.03077       7.661433 72.01226 5.084461 76.15910 4.143727 -4.146835      6.559132 
1 1 1 -6  6  29 o 206.6472 3.656439 521.2828       18.41298 511.4503       25.83555 531.4327       26.24915 204.4313 5.190219 208.4563 5.167305 -4.025009      7.323893 
1 1 1 -6  6  30 o 113.1028 3.373959 156.2876       9.288885 158.4325       11.30731 151.8358       16.29008 113.8061 4.083777 111.1474 6.037002 2.658730       7.288527 
1 1 1 -6  6  31 o 107.7098 2.939506 141.6825       7.708315 136.0722       10.65911 147.8331       11.16059 105.4316 4.156865 109.8980 4.174952 -4.466423      5.891498 
1 1 1 -6  6  32 o 112.6025 3.450294 155.0121       9.456440 157.9160       11.59013 149.2294       16.35533 113.5626 4.195312 110.0804 6.121064 3.482239       7.420786 
1 1 1 -6  6  33 o 115.1760 3.016053 162.0827       8.457910 166.5009       11.90452 157.5791       12.01889 116.5860 4.196994 113.3915 4.357692 3.194504       6.050144 
1 1 1 -6  6  34 o 121.5724 3.094924 180.6480       9.161528 178.6564       12.83790 182.7149       13.07815 120.7126 4.371426 122.0721 4.403580 -1.359558      6.204908 
1 1 1 -6  6  35 o 67.57497 4.172458 56.13388       6.837395 51.03212       12.87454 58.13808       8.069413 63.50862 8.534689 68.67020 4.853381 -5.161587      9.818158 
1 1 1 -6  6  36 o 43.11734 4.325580 23.02072       4.483662 20.05664       6.088771 26.53209       6.627089 39.79354 6.503279 45.99675 6.059587 -6.203205      8.888827 
1 1 1 -6  6  37 o 90.47298 3.138005 100.2396       6.907973 103.9676       9.853935 96.63689       9.686904 91.91829 4.412063 88.59286 4.501696 3.325432       6.303298 
1 1 1 -6  6  38 o 76.42551 3.566164 71.75415       6.623333 59.13667       9.959336 81.75980       8.868834 68.82882 5.997614 81.40351 4.488191 -12.57469      7.491011 
1 1 1 -6  6  39 o 50.06715 4.120784 31.05094       4.983229 36.35579       6.891809 25.23863       7.213920 53.92867 5.313109 44.41698 6.887676 9.511696       8.698805 
1 1 1 -6  6  40 o 30.85781 5.928003 12.28215       4.295723 19.56812       5.797906 3.414894       6.396205 39.04075 6.309291 21.05906 8.358401 17.98169       10.47235 
1 1 1 -6  6  41 o 28.80355 6.483648 10.91631       4.440848 9.070542       5.318429 15.16647       8.070437 26.23087 7.769405 33.29926 9.487312 -7.068394      12.26266 
1 1 1 -6  6  42 o 20.65881 7.000206 5.271030       4.196459 5.696418       4.861063 4.026574       8.314346 21.62773 7.526909 22.95541 9.380189 -1.327677      12.02673 
1 1 1 -6  6  43 o 16.56290 6.395442 2.598824       3.659592 2.547643       4.772952 2.671833       5.700626 17.86506 7.176723 19.03364 7.771108 -1.168583      10.57806 
1 1 1 -6  6  44 o 58.92611 3.651898 43.73508       5.218229 35.40932       6.912878 54.76292       7.955948 51.89532 5.552511 65.02003 5.061048 -13.12472      7.512961 
1 1 1 -6  6  45 o 35.94673 6.207503 17.88313       5.241143 8.613582       9.512683 21.92351       6.280360 24.93071 10.09031 39.44913 6.777101 -14.51842      12.15497 
1 1 1 -6  6  46 o 33.67131 5.393080 15.63350       4.275897 18.66486       5.778841 11.96593       6.356401 35.60346 6.909856 27.02348 8.587393 8.579981       11.02222 
1 1 1 -6  6  47 o 16.14325 6.854474 2.278845       4.694825 5.724036       5.813134 -4.183233      7.961405 19.81635 7.934051 15.69219 7.485323 4.124164       10.90776 
1 1 1 -6  6  48 o 23.09021 6.827703 8.678457       4.110112 5.487297       5.502732 12.70536       6.181443 18.92913 7.669608 26.07086 8.485838 -7.141729      11.43820 
1 1 1 -6  6  49 o 13.90818 6.002267 1.624064       3.708655 1.191262       4.974450 2.165671       5.564706 14.70204 6.616278 15.76199 7.052967 -1.059950      9.670547 
1 1 1 -6  6  50 o 18.42921 7.103665 6.431847       4.509304 5.475378       5.410575 8.607190       8.159657 17.36241 7.364730 19.07848 8.538513 -1.716068      11.27588 
1 1 1 -6  6  51 o 12.88652 5.784474 1.204817       3.775289 1.340085       5.185862 1.052293       5.506700 13.95980 6.458978 13.98934 6.534297 -0.2953815E-01 9.187788 
1 1 1 -6  7  1  o 237.7841 3.816473 689.2584       22.11471 758.0208       33.01719 633.3104       29.78223 249.3012 5.434750 227.8756 5.363192 21.42567       7.635465 
1 1 1 -6  7  2  o 254.7635 4.027634 791.2509       25.00479 832.2145       36.48051 754.9520       34.34066 261.2029 5.731216 248.7858 5.664311 12.41711       8.057994 
1 1 1 -6  7  3  o 287.6230 5.129618 1008.859       35.95380 1016.192       62.49833 1005.231       43.95549 288.2781 8.907215 287.0431 6.283910 1.235077       10.90073 
1 1 1 -6  7  4  o 322.2283 9.850691 1270.313       77.26026 0.000000       0.000000 1270.313       77.26026 ?        ?        322.2283 9.850691 0.000000       9.850691 
1 1 1 -6  7  5  o 86.76472 2.678380 91.83461       5.656281 89.55909       9.868615 92.94785       6.902580 85.57107 4.751180 87.26530 3.251576 -1.694237      5.757297 
1 1 1 -6  7  6  o 500.7872 7.304175 3060.752       89.13751 3086.351       126.9346 3035.848       125.2022 502.4577 10.36680 498.3388 10.30982 4.118835       14.62063 
1 1 1 -6  7  7  o 502.0192 7.326005 3075.569       89.62386 3156.563       128.9806 2999.951       124.6261 508.1815 10.41525 495.4283 10.32267 12.75320       14.66406 
1 1 1 -6  7  8  o 172.6425 3.076469 363.2562       12.94304 355.4987       18.26273 371.0846       18.34601 170.7099 4.393715 174.4712 4.315009 -3.761292      6.158249 
1 1 1 -6  7  9  o 433.4680 7.377112 2292.407       77.92550 2275.185       95.13021 2327.530       135.8568 431.6942 9.042868 436.0147 12.80013 -4.320526      15.67217 
1 1 1 -6  7  10 o 581.5321 8.416453 4126.805       119.2721 4055.783       166.8415 4201.040       170.5729 576.0714 11.88479 586.2885 11.93885 -10.21710      16.84590 
1 1 1 -6  7  11 o 413.0428 6.115730 2080.196       61.55728 2049.001       86.32808 2112.464       87.80089 409.7891 8.644814 416.0858 8.659242 -6.296783      12.23582 
1 1 1 -6  7  12 f 885.6811 12.66390 9584.021       273.3259 9206.314       376.0913 10006.83       397.9137 866.8991 17.80281 903.7305 18.06816 -36.83136      25.36530 
1 1 1 -6  7  13 o 281.3015 5.048747 964.5527       34.60921 965.6455       59.80910 964.0026       42.43571 281.2120 8.738254 281.1925 6.192864 0.1947021E-01  10.71021 
1 1 1 -6  7  14 o 306.2336 4.719089 1143.041       35.21657 1151.594       50.12283 1134.701       49.49069 307.3235 6.692737 305.0622 6.657313 2.261261       9.439944 
1 1 1 -6  7  15 o 456.8701 6.719053 2545.090       74.80608 2525.333       105.3953 2565.148       106.1927 454.9298 9.506939 458.5023 9.504237 -3.572449      13.44293 
1 1 1 -6  7  16 o 484.7545 10.03957 2868.043       118.5969 2752.037       162.6159 2999.853       173.3398 474.2541 14.08632 495.1214 14.38173 -20.86734      20.13103 
1 1 1 -6  7  17 o 299.6359 5.393847 1094.519       39.38479 1044.420       46.78201 1216.439       72.97989 292.6610 6.559608 315.5664 9.501042 -22.90536      11.54549 
1 1 1 -6  7  18 o 267.7220 4.259087 873.6358       27.78668 876.9294       39.50576 870.4111       39.09013 268.1773 6.045084 267.1801 6.003811 0.9972229      8.519906 
1 1 1 -6  7  19 o 800.5687 11.48810 7832.189       224.1211 7864.699       317.9699 7800.092       315.9500 801.0385 16.28908 797.7521 16.25228 3.286316       23.01023 
1 1 1 -6  7  20 o 304.8651 4.745686 1133.117       35.25679 1156.683       50.60514 1110.888       49.14804 307.9275 6.743883 301.7734 6.683272 6.154053       9.494530 
1 1 1 -6  7  21 o 160.0722 3.545872 312.3260       13.83169 305.4548       17.01282 325.7236       23.75590 158.2230 4.416677 163.3013 5.979702 -5.078339      7.433968 
1 1 1 -6  7  22 f 104.8196 3.936109 134.1418       10.03629 0.000000       0.000000 134.1418       10.03629 ?        ?        104.8196 3.936109 0.000000       3.936109 
1 1 1 -6  7  23 o 106.0952 3.319411 137.3595       8.571526 126.5100       15.64431 142.0136       10.24636 101.5979 6.350572 107.8485 3.905144 -6.250549      7.455194 
1 1 1 -6  7  24 o 280.8847 4.469285 962.4980       30.59161 967.1249       43.49622 957.9690       43.03362 281.3825 6.343344 280.0515 6.305708 1.330994       8.944270 
1 1 1 -6  7  25 o 176.4500 3.847263 379.7918       16.54282 387.9786       20.35065 363.8440       28.40368 178.2309 4.689610 172.3673 6.775330 5.863541       8.239996 
1 1 1 -6  7  26 o 290.1685 4.610659 1027.976       32.60238 1087.130       47.73265 976.2469       44.63638 298.0909 6.570990 282.4952 6.483982 15.59564       9.231463 
1 1 1 -6  7  27 o 131.4138 2.970052 210.6292       9.511333 200.5072       13.22096 221.4877       13.69360 128.0818 4.241691 134.6290 4.178968 -6.547241      5.954471 
1 1 1 -6  7  28 o 142.6678 3.062000 248.3004       10.64553 257.9350       15.29133 239.2390       14.82939 145.2591 4.324636 139.8876 4.355495 5.371567       6.137819 
1 1 1 -6  7  29 o 175.8199 3.338326 377.2566       14.30319 381.7606       20.36644 372.8733       20.09188 176.6608 4.735116 174.5921 4.726718 2.068665       6.690530 
1 1 1 -6  7  30 o 102.9118 3.355739 129.4205       8.404428 132.3271       10.18987 123.2363       14.86326 103.9960 4.028451 100.0758 6.123974 3.920197       7.330175 
1 1 1 -6  7  31 o 128.8914 3.028896 202.7661       9.513593 186.3510       12.92028 222.2060       14.06041 123.3828 4.303748 134.7460 4.287450 -11.36326      6.074905 
1 1 1 -6  7  32 o 178.0072 3.936503 387.3458       17.07593 394.5907       21.06662 373.4673       29.15749 179.4543 4.821682 174.0736 6.887143 5.380630       8.407221 
1 1 1 -6  7  33 o 73.13113 3.099904 65.42993       5.511889 61.82267       7.467640 69.74716       8.169540 70.94153 4.340407 75.34946 4.469272 -4.407936      6.230050 
1 1 1 -6  7  34 o 88.68443 3.750979 96.35809       8.088095 109.4922       15.91298 91.78315       9.391682 93.93530 7.001997 86.44833 4.473324 7.486969       8.308947 
1 1 1 -6  7  35 o 34.49104 6.284731 15.10998       5.087813 7.138325       10.31036 17.67599       5.849641 28.15393 10.76967 37.29381 6.682026 -9.139877      12.67420 
1 1 1 -6  7  36 o 72.04224 3.341565 63.62283       5.850440 62.84630       8.191680 64.43127       8.358382 71.38282 4.735937 72.27446 4.772421 -0.8916397     6.723474 
1 1 1 -6  7  37 o 40.81641 4.564264 20.71903       4.462217 24.34869       5.959744 16.08837       6.731566 44.06562 5.682106 35.20757 8.025029 8.858051       9.832976 
1 1 1 -6  7  38 o 81.95737 3.546069 82.50765       7.065491 79.45427       10.77670 84.80963       9.357207 79.95213 5.565959 82.85664 4.652980 -2.904510      7.254663 
1 1 1 -6  7  39 o 229.9894 4.061038 651.0854       22.76045 642.5397       31.94364 659.8978       32.43834 227.2359 5.773289 230.2768 5.785174 -3.040878      8.173072 
1 1 1 -6  7  40 o 71.11221 3.374786 62.31033       5.831571 60.25086       8.106373 64.51926       8.395391 69.52435 4.814423 71.95516 4.815598 -2.430817      6.809453 
1 1 1 -6  7  41 o 97.15073 3.591047 116.7079       8.487020 115.3714       10.34793 119.4543       14.83417 96.22873 4.424628 96.82494 6.321516 -0.5962143     7.716145 
1 1 1 -6  7  42 o 15.13767 6.395655 0.6150216      4.053565 -1.862693      4.594508 9.317719       8.610738 14.07221 6.343445 27.24392 9.957328 -13.17171      11.80626 
1 1 1 -6  7  43 o 36.52111 4.906929 17.21508       4.256668 13.79294       5.519088 22.23948       6.687442 31.60861 7.310785 40.51954 7.027282 -8.910925      10.14053 
1 1 1 -6  7  44 o 15.71059 6.302127 2.031202       3.674927 2.851276       4.722900 0.7727599      5.850581 17.81054 7.144448 17.35634 7.514676 0.4541969      10.36887 
1 1 1 -6  7  45 o 53.01548 4.876675 37.03266       6.229778 31.81650       11.26241 39.33228       7.477979 43.21461 10.74114 53.84512 5.789908 -10.63050      12.20226 
1 1 1 -6  7  46 o 35.72934 5.258910 17.54979       4.442020 20.92788       5.857070 12.97615       6.815153 37.93410 6.574090 27.68048 8.902060 10.25362       11.06641 
1 1 1 -6  7  47 o 12.51966 5.785551 -1.637631      4.142160 -6.169462      5.868497 2.861609       5.847358 12.70513 6.152785 17.43755 7.531157 -4.732415      9.724972 
1 1 1 -6  7  48 o 24.96268 6.613883 9.997511       4.087095 10.75912       5.655354 9.164840       5.913323 24.21286 8.126336 22.29685 8.234337 1.916006       11.56899 
1 1 1 -6  7  49 f 14.01540 6.064050 1.709623       3.804631 4.986668       5.390596 -1.543130      5.370581 17.64466 7.410549 13.43480 6.331249 4.209867       9.746843 
1 1 1 -6  7  50 o 23.83219 8.460297 13.15775       6.162799 13.15775       6.162799 0.000000       0.000000 23.83219 8.460297 ?        ?        0.000000       8.460297 
1 1 1 -6  7  51 o 15.83361 6.391617 4.447471       3.805753 5.391822       5.460989 3.555753       5.306624 16.55389 7.212781 15.27750 6.857850 1.276391       9.952603 
1 1 1 -6  8  1  f 488.2065 7.140554 2908.686       84.95161 2923.274       120.6589 2894.347       119.6272 489.0408 10.12461 486.6207 10.08796 2.420105       14.29246 
1 1 1 -6  8  2  o 373.6082 5.001391 1702.058       45.53478 1664.945       58.03600 1761.492       73.44222 369.4181 6.446786 379.8526 7.934043 -10.43457      10.22302 
1 1 1 -6  8  3  o 732.1266 10.52627 6553.090       187.8005 6544.670       375.6114 6555.896       216.8513 727.6162 21.20625 731.8710 12.15882 -4.254761      24.44467 
1 1 1 -6  8  4  o 321.1609 4.901224 1257.658       38.35865 1272.713       54.75641 1243.150       53.75217 322.9601 6.957448 319.1902 6.910513 3.769867       9.806186 
1 1 1 -6  8  5  o 328.1165 4.467570 1312.539       35.72198 1281.188       55.72211 1334.413       46.54456 324.0349 7.056667 330.7756 5.774299 -6.740692      9.118064 
1 1 1 -6  8  6  o 407.7804 6.047532 2028.135       60.09532 1970.438       83.54636 2089.992       86.50611 401.7377 8.533927 413.7411 8.579895 -12.00348      12.10134 
1 1 1 -6  8  7  o 408.4670 6.057673 2034.815       60.29744 2036.573       85.49050 2033.074       85.05807 408.4513 8.588978 408.1035 8.552816 0.3478088      12.12111 
1 1 1 -6  8  8  o 382.3693 6.594536 1783.240       61.44739 1753.411       74.57661 1846.305       108.4373 379.0627 8.073383 388.5089 11.46614 -9.446198      14.02326 
1 1 1 -6  8  9  o 221.3535 4.217567 597.2280       22.75016 593.9277       27.98619 603.6578       39.06316 220.7196 5.203156 222.3454 7.219037 -1.625748      8.898726 
1 1 1 -6  8  10 o 67.64999 2.477129 55.84359       4.076792 54.14812       5.911002 57.38177       5.630155 66.55482 3.658637 68.53458 3.381564 -1.979767      4.982028 
1 1 1 -6  8  11 o 145.3794 2.849919 257.5561       10.09651 264.0772       14.63624 251.6355       13.94600 147.1409 4.085835 143.6339 3.988204 3.507034       5.709625 
1 1 1 -6  8  12 o 497.6394 7.271297 3019.961       88.17850 2982.832       123.8395 3058.144       125.5853 494.3631 10.27962 500.5638 10.29540 -6.200714      14.54874 
1 1 1 -6  8  13 o 418.1958 6.197413 2132.175       63.15768 2110.667       88.89010 2154.103       89.75305 415.9577 8.769363 420.2162 8.764768 -4.258423      12.39850 
1 1 1 -6  8  14 o 664.9578 9.580089 5395.338       155.2386 5270.734       216.2258 5527.887       223.0126 656.7682 13.51012 672.5851 13.60649 -15.81689      19.17446 
1 1 1 -6  8  15 o 212.9663 3.594277 552.7387       18.65342 549.3005       26.44858 556.1414       26.31179 212.2798 5.112786 213.5986 5.054939 -1.318787      7.189784 
1 1 1 -6  8  16 o 792.5963 16.10521 7689.280       311.0674 8023.307       452.2826 7389.442       428.5109 807.4052 23.01047 774.9282 22.71607 32.47693       32.33421 
1 1 1 -6  8  17 o 567.0795 8.240386 3923.335       113.8748 3954.010       161.8905 3893.293       160.2093 568.9219 11.67703 564.5408 11.64545 4.381104       16.49150 
1 1 1 -6  8  18 o 340.1068 5.186111 1410.208       42.98266 1468.934       62.51821 1357.564       59.19145 347.0149 7.393027 333.6066 7.280955 13.40829       10.37638 
1 1 1 -6  8  19 o 313.8859 4.854591 1201.145       37.13305 1204.887       52.75338 1197.471       52.27795 314.2844 6.887973 313.3178 6.846953 0.9665527      9.712103 
1 1 1 -6  8  20 o 479.3904 8.138939 2805.395       95.08089 2762.692       115.5543 2894.916       167.3089 475.5060 9.972266 485.8638 14.14591 -10.35773      17.30760 
1 1 1 -6  8  21 o 434.2553 6.451689 2301.011       68.27390 2319.735       97.16992 2282.755       95.94938 435.7029 9.151774 432.2218 9.109603 3.481110       12.91278 
1 1 1 -6  8  22 o 357.2537 6.300405 1557.782       54.85059 1506.961       94.27143 1583.792       67.44154 350.5821 11.04834 360.0728 7.686013 -9.490692      13.45885 
1 1 1 -6  8  23 o 131.4020 2.900986 210.4790       9.289311 212.5853       13.31308 208.4805       12.96787 131.9615 4.145092 130.6841 4.077006 1.277405       5.814101 
1 1 1 -6  8  24 o 256.0502 4.846471 800.1022       30.24036 803.5801       37.04157 793.1519       52.36414 256.5055 5.925932 254.3849 8.458840 2.120544       10.32805 
1 1 1 -6  8  25 o 213.8811 3.694541 558.0181       19.25613 541.6641       26.96901 575.0266       27.50341 210.6004 5.254964 216.9943 5.201183 -6.393906      7.393710 
1 1 1 -6  8  26 o 158.6775 3.166056 307.0989       12.24250 308.6340       17.42721 305.6033       17.20201 158.9276 4.504335 158.1484 4.468006 0.7792206      6.344455 
1 1 1 -6  8  27 o 425.5201 7.347818 2220.227       76.19291 2250.393       132.2111 2205.226       93.23199 425.5188 12.76451 423.3958 9.036126 2.123016       15.63919 
1 1 1 -6  8  28 o 90.37292 2.863396 99.72140       6.298069 104.6037       8.945920 94.92356       8.868219 92.47339 3.979144 88.06720 4.143867 4.406189       5.745017 
1 1 1 -6  8  29 o 132.6405 2.996559 214.6556       9.685789 217.9449       13.79954 211.4616       13.59823 133.4954 4.247323 131.4926 4.249280 2.002823       6.008006 
1 1 1 -6  8  30 o 154.1003 3.691089 290.0183       13.86099 295.7561       17.05934 278.8713       23.77779 155.4638 4.507707 150.6062 6.494029 4.857529       7.905178 
1 1 1 -6  8  31 o 81.51699 3.027653 81.22140       6.003923 76.35721       8.152806 86.98514       8.874714 78.91076 4.255439 84.22840 4.338359 -5.317642      6.077016 
1 1 1 -6  8  32 o 102.5225 2.965702 128.4213       7.401609 117.1253       9.930607 142.5394       11.10199 97.77028 4.177679 107.8671 4.231741 -10.09682      5.946481 
1 1 1 -6  8  33 o 61.76713 4.210736 46.90133       6.300089 31.50346       11.70382 53.18327       7.475567 49.39399 10.06537 65.72462 4.698444 -16.33062      11.10798 
1 1 1 -6  8  34 o 45.33105 3.951306 25.33314       4.321307 26.64866       5.896972 23.80737       6.350727 46.28943 5.324574 43.56195 6.153642 2.727482       8.137468 
1 1 1 -6  8  35 o 96.16006 3.725293 113.3255       8.713024 116.2223       16.39380 112.1851       10.28608 96.68095 7.005820 95.55939 4.429182 1.121552       8.288496 
1 1 1 -6  8  36 f 117.6974 3.069060 169.4831       8.795033 172.2379       12.41348 166.7064       12.46278 118.4158 4.308962 116.4765 4.398669 1.939247       6.157552 
1 1 1 -6  8  37 o 114.9380 3.446941 161.9212       9.643678 168.7128       15.52384 157.6531       12.30629 116.8087 5.468841 113.1837 4.470563 3.624969       7.063579 
1 1 1 -6  8  38 o 112.7147 3.134075 155.7112       8.600112 150.8424       11.81872 161.1907       12.53791 110.6241 4.392876 114.3265 4.509150 -3.702400      6.295219 
1 1 1 -6  8  39 o 108.3760 3.111756 144.1350       8.209655 133.7709       11.13364 156.4852       12.15372 104.0320 4.401663 112.5180 4.441249 -8.485985      6.252946 
1 1 1 -6  8  40 o 41.27326 4.376884 21.31657       4.335180 24.87293       5.912417 17.18134       6.375476 44.27235 5.605669 36.10178 7.492451 8.170567       9.357368 
1 1 1 -6  8  41 o 62.23465 4.714223 48.61218       7.096370 48.61218       7.096370 0.000000       0.000000 62.23465 4.714223 ?        ?        0.000000       4.714223 
1 1 1 -6  8  42 o 42.18264 4.427895 22.52180       4.483863 25.08088       6.072261 19.45331       6.649224 43.97889 5.807733 37.91442 7.462472 6.064461       9.456122 
1 1 1 -6  8  43 o 37.66614 4.721260 18.26481       4.238619 18.97690       5.680555 17.37034       6.366553 37.59431 6.431615 35.30339 7.623727 2.290913       9.974311 
1 1 1 -6  8  44 o 19.08906 6.531588 4.736295       3.654711 4.322851       4.870931 5.268875       5.528351 19.39390 7.406400 20.83835 7.906456 -1.444448      10.83360 
1 1 1 -6  8  45 o 41.72100 5.550815 23.62743       5.503591 17.85617       9.821738 26.26896       6.644783 31.69928 10.70953 43.23758 6.508012 -11.53830      12.53189 
1 1 1 -6  8  46 o 26.69468 6.798538 10.75400       4.433936 6.673899       6.191006 15.05069       6.353204 21.25647 8.287602 30.24952 8.346803 -8.993048      11.76237 
1 1 1 -6  8  47 o 22.42629 6.659758 7.871408       3.903662 4.414873       5.263968 12.09509       5.818869 18.26137 7.463083 26.34148 8.195190 -8.080107      11.08417 
1 1 1 -6  8  48 o 13.26707 5.877224 0.5302227      3.765686 -0.6267765     5.220490 1.785217       5.437079 14.13143 6.517799 15.81963 7.032030 -1.688196      9.588073 
1 1 1 -6  8  49 o 25.71194 6.704534 11.27264       4.243559 13.34759       5.828269 8.931598       6.190715 25.70020 8.229098 20.74232 8.226136 4.957882       11.63561 
1 1 1 -6  8  50 o 18.64380 7.737628 7.427979       5.774428 7.427979       5.774428 0.000000       0.000000 18.64380 7.737628 ?        ?        0.000000       7.737628 
1 1 1 -6  8  51 o 9.576089 4.699268 -4.520108      3.758712 -10.07810      5.259670 1.280843       5.373398 9.771622 4.914454 13.90722 6.482261 -4.135598      8.134591 
1 1 1 -6  9  1  o 454.6822 5.471527 2520.994       60.62511 2609.638       87.74804 2440.036       83.85792 462.4159 7.786971 447.1457 7.695891 15.27023       10.94823 
1 1 1 -6  9  2  o 231.4429 3.096556 652.8392       17.46461 628.8153       24.21497 678.8835       25.21260 227.1153 4.375236 235.9837 4.384293 -8.868393      6.193925 
1 1 1 -6  9  3  f 542.1875 7.061286 3586.573       93.29737 3726.522       151.7671 3501.557       118.2882 552.0983 11.28041 535.4937 9.064648 16.60455       14.47120 
1 1 1 -6  9  4  o 414.5754 5.500817 2095.805       55.57338 2107.131       88.22460 2088.355       71.55343 415.4504 8.714339 413.7311 7.097023 1.719299       11.23866 
1 1 1 -6  9  5  o 357.9859 4.825993 1562.377       42.10064 1480.409       64.48004 1623.288       55.58410 348.3219 7.596410 364.8268 6.252126 -16.50485      9.838421 
1 1 1 -6  9  6  o 481.9789 6.317184 2833.103       74.19723 2959.901       120.8494 2756.388       93.99982 492.2969 10.07352 475.2662 8.116224 17.03070       12.93634 
1 1 1 -6  9  7  o 315.8406 5.598426 1216.281       43.08936 1230.481       53.30399 1189.504       73.19726 317.6242 6.886681 311.9908 9.639140 5.633423       11.84649 
1 1 1 -6  9  8  o 318.9839 5.643804 1240.556       43.87093 1246.069       54.05937 1229.920       75.08193 319.6407 6.940215 317.2699 9.722620 2.370758       11.94554 
1 1 1 -6  9  9  o 503.5544 7.358324 3092.602       90.29452 3075.018       127.3810 3110.362       128.0128 501.8744 10.41534 504.7512 10.40734 -2.876801      14.72387 
1 1 1 -6  9  10 f 316.5796 4.858926 1221.640       37.48515 1263.784       54.33105 1183.354       51.78460 321.9285 6.925523 311.5197 6.821486 10.40875       9.720881 
1 1 1 -6  9  11 o 239.9991 3.901646 701.9885       22.81884 681.3608       31.91082 723.5738       32.64307 236.4178 5.538875 243.6322 5.498197 -7.214340      7.804441 
1 1 1 -6  9  12 o 124.8354 2.717343 189.9027       8.266439 182.1044       11.72605 197.6073       11.65529 122.1741 3.943718 127.2804 3.761856 -5.106323      5.450181 
1 1 1 -6  9  13 o 224.7617 3.726552 615.6652       20.41106 633.6333       29.49917 599.1619       28.27118 227.9926 5.309491 221.7056 5.232765 6.287048       7.454698 
1 1 1 -6  9  14 f 323.8698 4.964293 1278.558       39.17996 1321.703       56.73204 1239.215       54.17408 329.2215 7.071380 318.7860 6.973586 10.43542       9.931531 
1 1 1 -6  9  15 o 608.3439 12.45997 4521.313       184.7151 4604.595       263.9427 4441.373       258.5927 612.8402 17.69217 601.8802 17.64979 10.95996       24.99055 
1 1 1 -6  9  16 o 421.4250 6.261803 2165.522       64.30664 2050.788       87.89389 2297.685       94.33389 409.9640 8.797856 433.9322 8.920922 -23.96817      12.52937 
1 1 1 -6  9  17 o 355.3671 5.386631 1539.627       46.64774 1598.295       67.73442 1486.699       64.33639 361.9647 7.679043 349.1058 7.562468 12.85895       10.77769 
1 1 1 -6  9  18 o 717.3866 10.32857 6285.879       180.5634 6501.705       261.5006 6089.213       249.6236 728.6873 14.72636 705.2403 14.52487 23.44696       20.68424 
1 1 1 -6  9  19 o 197.2319 3.478232 474.1307       16.71752 454.3712       23.31729 495.0311       23.98097 192.9830 4.962304 201.5012 4.883746 -8.518143      6.962430 
1 1 1 -6  9  20 o 305.9934 5.493258 1141.932       40.96172 1133.902       50.31054 1157.723       70.54877 304.8408 6.772512 307.6772 9.420413 -2.836456      11.60220 
1 1 1 -6  9  21 o 373.6725 5.649996 1703.437       51.44881 1721.970       73.39619 1685.533       72.13931 375.4638 8.021753 371.4763 7.969018 3.987579       11.30724 
1 1 1 -6  9  22 o 167.9093 3.757737 343.7593       15.37578 339.2044       27.89156 345.7479       18.42896 166.5166 6.888393 168.3093 4.497239 -1.792709      8.226488 
1 1 1 -6  9  23 o 113.7432 3.322160 157.8757       9.198487 159.3860       11.19897 154.7440       16.12647 114.2459 4.028856 112.4224 5.907134 1.823456       7.150239 
1 1 1 -6  9  24 o 92.98247 2.783689 105.4987       6.300407 97.93730       8.836755 113.3166       8.985346 89.50748 4.061914 96.30807 3.836240 -6.800598      5.587118 
1 1 1 -6  9  25 o 188.9944 3.434330 435.6845       15.81711 451.9147       22.90597 420.8923       21.86768 192.3142 4.891634 185.5973 4.839111 6.716888       6.880776 
1 1 1 -6  9  26 o 152.1426 3.115154 282.3342       11.54959 289.6610       16.66151 275.5571       16.02429 153.9567 4.445644 150.1649 4.383686 3.791870       6.243433 
1 1 1 -6  9  27 o 212.7252 4.215894 552.5807       21.85469 580.5396       37.97283 538.7325       26.72451 217.4735 7.175058 209.9197 5.224208 7.553772       8.875461 
1 1 1 -6  9  28 o 63.06325 3.018576 48.62895       4.625427 46.73086       6.374426 50.73973       6.722095 61.70603 4.265383 64.30526 4.314620 -2.599232      6.067079 
1 1 1 -6  9  29 o 226.6005 3.891165 627.1383       21.48704 603.7050       29.83210 652.4009       30.97462 222.0606 5.512852 230.8441 5.506189 -8.783569      7.791640 
1 1 1 -6  9  30 o 110.2412 3.430840 148.5319       9.205585 146.0031       11.01788 154.3790       16.75358 109.2207 4.147119 112.0183 6.161098 -2.797607      7.426824 
1 1 1 -6  9  31 f 172.0014 3.846693 361.5431       16.12336 370.7460       20.07684 344.8267       27.05861 173.9795 4.739867 167.3573 6.647980 6.622177       8.164679 
1 1 1 -6  9  32 o 131.3812 3.072451 210.7635       9.836811 205.6461       13.70523 216.2007       14.12706 129.5669 4.346819 132.8501 4.369633 -3.283249      6.163484 
1 1 1 -6  9  33 o 64.84908 3.274189 51.50931       5.157464 51.59022       7.054790 51.41643       7.558772 64.75063 4.498973 64.59167 4.837318 0.1589661      6.606089 
1 1 1 -6  9  34 o 68.06578 4.153590 56.93593       6.856713 68.53246       13.55329 52.94693       7.949004 74.01383 7.623338 65.49693 5.018528 8.516899       9.126932 
1 1 1 -6  9  35 o 78.44722 3.174269 75.35197       6.055634 67.59786       8.290018 84.22297       8.866987 74.08557 4.614743 82.76164 4.412487 -8.676071      6.384818 
1 1 1 -6  9  36 f 43.73409 4.216996 23.67468       4.438607 22.69986       5.830191 25.01865       6.845655 42.52163 5.775650 44.51385 6.502680 -1.992222      8.697297 
1 1 1 -6  9  37 o 58.41910 3.912928 42.05451       5.538361 30.51811       7.862453 53.41635       7.802738 49.11413 6.747394 65.67678 4.910828 -16.56265      8.345272 
1 1 1 -6  9  38 o 44.43191 4.158400 24.48995       4.450227 23.24491       5.895438 26.13910       6.785057 42.91887 5.783876 45.41909 6.299642 -2.500217      8.552117 
1 1 1 -6  9  39 o 91.71576 3.138521 103.3170       7.004301 100.8024       9.674119 106.0877       10.15448 90.24039 4.412585 92.54705 4.516193 -2.306664      6.314025 
1 1 1 -6  9  40 o 37.63298 4.709366 17.86069       4.224547 19.27605       5.633784 16.04250       6.385380 38.67377 6.186285 34.72725 7.742897 3.946518       9.910729 
1 1 1 -6  9  41 o 34.10253 6.596880 15.33304       5.284019 15.33304       5.284019 0.000000       0.000000 34.10253 6.596880 ?        ?        0.000000       6.596880 
1 1 1 -6  9  42 o 47.35906 3.961581 28.17829       4.530164 33.61294       6.388981 22.68320       6.424405 51.22698 5.189471 41.35506 6.596267 9.871914       8.392934 
1 1 1 -6  9  43 o 24.91178 6.168863 8.445433       3.725061 13.49092       5.209047 3.164763       5.329068 31.22073 7.017852 18.89832 7.586238 12.32240       10.33447 
1 1 1 -6  9  44 o 17.82234 6.439865 3.899320       3.587639 5.600325       4.724347 1.582090       5.514086 20.65241 7.399112 17.41695 7.413110 3.235458       10.47383 
1 1 1 -6  9  45 o 22.24883 7.561826 7.270350       4.897165 2.450658       8.968390 9.317955       5.845586 20.40704 9.053514 24.58139 8.261988 -4.174351      12.25669 
1 1 1 -6  9  46 o 23.98388 6.991877 8.892203       4.336339 11.11968       6.331968 6.924844       5.950786 25.51350 8.598957 21.26853 8.170228 4.244963       11.86148 
1 1 1 -6  9  47 o 24.33079 6.498272 9.212322       3.925688 12.81961       5.514900 5.506951       5.589372 27.41866 7.852650 19.25766 7.755769 8.160995       11.03703 
1 1 1 -6  9  48 o 11.36732 5.307743 -1.757380      3.628289 -1.120118      4.996365 -2.468380      5.277524 13.53699 6.289727 13.15302 6.221878 0.3839664      8.847171 
1 1 1 -6  9  49 o 10.37675 5.053847 -4.644738      4.111897 -5.216098      4.898183 -3.281142      7.566981 11.20031 5.468338 14.35365 6.959534 -3.153334      8.850865 
1 1 1 -6  9  50 o 28.70123 7.237226 15.54007       5.060006 13.67537       6.182285 19.32411       8.806884 23.96751 8.476994 24.72184 9.809228 -0.7543259     12.96458 
1 1 1 -6  9  51 o 17.01015 6.649237 5.669746       3.993568 5.195364       5.800163 6.097349       5.506768 16.24643 7.239835 16.90186 7.304192 -0.6554375     10.28428 
1 1 1 -6  10 1  o 209.0326 4.067467 532.5908       20.71926 559.4983       26.31114 488.6685       33.61596 214.2269 5.039989 200.0399 6.906287 14.18697       8.549754 
1 1 1 -6  10 2  o 222.7283 3.715439 604.6308       20.16609 559.2334       27.50181 657.4273       29.65846 214.1705 5.269454 232.2139 5.241120 -18.04349      7.432125 
1 1 1 -6  10 3  o 178.7451 3.678983 389.4063       16.02500 407.2147       28.28972 380.9920       19.44571 182.6220 6.366551 176.7323 4.518850 5.889633       7.807240 
1 1 1 -6  10 4  o 118.4020 2.680154 170.8403       7.733122 159.1785       10.83170 182.9637       11.04396 114.2133 3.897450 122.4666 3.704853 -8.253319      5.377365 
1 1 1 -6  10 5  f 251.8169 3.631988 772.8452       22.28770 725.6497       34.09879 808.0470       29.44909 243.9580 5.735718 257.4648 4.693727 -13.50682      7.411447 
1 1 1 -6  10 6  o 394.6746 5.270907 1898.967       50.69448 1804.502       77.71375 1968.939       66.88447 384.5808 8.292283 401.8071 6.830799 -17.22629      10.74345 
1 1 1 -6  10 7  o 685.2213 9.877976 5731.087       164.9434 5493.928       226.4576 5999.074       240.7260 670.3188 13.86339 700.4153 14.10364 -30.09644      19.77641 
1 1 1 -6  10 8  o 221.2438 4.262146 596.5998       22.97923 584.6684       28.01050 621.1583       40.18614 219.0027 5.248500 225.5649 7.320560 -6.562149      9.007627 
1 1 1 -6  10 9  o 277.7374 4.378088 940.1752       29.63159 910.7518       41.35815 971.2090       42.47495 273.3142 6.209589 282.2409 6.175566 -8.926727      8.757660 
1 1 1 -6  10 10 o 153.0361 2.976367 285.3998       11.09983 278.6219       15.71109 292.1544       15.68401 151.1367 4.270079 154.7704 4.162245 -3.633652      5.963041 
1 1 1 -6  10 11 o 530.7266 7.736997 3435.156       100.0644 3397.600       140.6276 3473.673       142.4141 527.5757 10.93829 533.4478 10.95532 -5.872070      15.48112 
1 1 1 -6  10 12 o 378.3392 5.681521 1744.964       52.38200 1796.650       75.70655 1697.496       72.55272 383.8023 8.094495 373.0666 7.980520 10.73572       11.36704 
1 1 1 -6  10 13 o 373.8286 5.625339 1703.621       51.24569 1679.446       72.02097 1728.411       72.93233 371.0717 7.964620 376.4430 7.950323 -5.371307      11.25357 
1 1 1 -6  10 14 o 370.3354 6.465408 1672.271       58.34818 1717.795       72.64359 1589.504       97.94996 375.2743 7.943510 360.6286 11.15914 14.64566       13.69766 
1 1 1 -6  10 15 o 612.9923 12.56379 4591.633       187.6772 4472.621       260.1497 4720.793       271.0150 603.8876 17.69701 620.3723 17.94575 -16.48462      25.20385 
1 1 1 -6  10 16 o 367.5624 5.555194 1647.149       49.75840 1572.891       68.56358 1729.779       72.32500 359.0733 7.835638 376.5529 7.881817 -17.47961      11.11397 
1 1 1 -6  10 17 o 440.6501 6.526299 2368.098       70.08046 2391.406       99.93620 2345.547       98.30149 442.6033 9.265570 438.3446 9.202554 4.258698       13.05901 
1 1 1 -6  10 18 o 426.0987 6.335011 2214.429       65.77998 2154.272       91.58446 2278.531       94.53980 420.0620 8.946895 432.0036 8.980309 -11.94162      12.67647 
1 1 1 -6  10 19 o 90.44708 3.298949 99.84137       7.259021 102.9896       14.29445 98.74739       8.426390 91.65678 6.440810 89.92226 3.854311 1.734520       7.505981 
1 1 1 -6  10 20 o 500.6559 8.483993 3061.949       103.5084 3069.538       127.3484 3047.176       177.6827 500.9478 10.43193 497.9726 14.65806 2.975189       17.99122 
1 1 1 -6  10 21 o 175.6346 3.834248 376.1052       16.41067 393.9019       30.68506 368.9758       19.42155 179.4672 7.029862 173.8772 4.587591 5.589981       8.394341 
1 1 1 -6  10 22 o 368.2450 8.012068 1658.084       71.89812 1750.769       105.7961 1578.543       98.00852 377.5210 11.51331 358.5251 11.23167 18.99591       16.08436 
1 1 1 -6  10 23 o 204.6145 3.597217 510.5728       17.93656 509.3864       25.54503 511.7267       25.19093 204.2199 5.137089 204.7591 5.048529 -0.5391388     7.202592 
1 1 1 -6  10 24 o 39.26321 3.683132 18.96948       3.482883 14.35006       4.851943 23.88021       5.002591 33.74886 6.125085 43.97615 4.743049 -10.22728      7.746818 
1 1 1 -6  10 25 o 134.7879 2.978440 221.5599       9.783087 211.8909       13.77866 231.3898       13.89279 131.6814 4.299613 137.6265 4.147125 -5.945114      5.973719 
1 1 1 -6  10 26 o 139.6509 3.359896 237.9347       11.43419 239.8498       19.15111 236.8739       14.25349 139.9360 5.627493 139.2249 4.205975 0.7111664      7.025589 
1 1 1 -6  10 27 o 106.5852 2.832166 138.6613       7.349653 135.8619       10.45248 141.3988       10.33645 105.4042 4.077038 107.5454 3.950775 -2.141174      5.677223 
1 1 1 -6  10 28 o 46.85566 3.465124 26.94260       3.928555 31.77997       5.558181 22.11344       5.553454 50.79472 4.538078 42.15133 5.540512 8.643398       7.161803 
1 1 1 -6  10 29 o 118.6323 3.478101 171.9696       10.04412 169.9522       12.03577 176.5976       18.22976 117.8570 4.197362 119.8406 6.263993 -1.983597      7.540256 
1 1 1 -6  10 30 o 108.8349 2.988097 144.6735       7.917493 151.6876       11.28404 137.8716       11.11199 111.3193 4.167018 106.1042 4.306521 5.215057       5.992509 
1 1 1 -6  10 31 o 40.25134 4.609202 20.08438       4.439638 17.69374       5.397922 25.08272       7.805187 37.48753 6.119803 44.53246 7.455671 -7.044930      9.645674 
1 1 1 -6  10 32 o 59.25291 3.350724 43.02736       4.818490 40.88949       6.453070 45.72145       7.244064 57.60104 4.636406 60.88846 4.924127 -3.287418      6.763378 
1 1 1 -6  10 33 o 134.1638 3.084697 219.8655       10.08519 211.6797       14.06140 228.5372       14.47271 131.4018 4.397475 136.5472 4.354983 -5.145447      6.188995 
1 1 1 -6  10 34 o 74.65182 4.034301 68.42666       7.311868 67.57055       14.14719 68.73871       8.541099 73.35427 8.046126 74.71819 4.714889 -1.363922      9.325788 
1 1 1 -6  10 35 o 25.03835 6.248489 8.042486       3.800159 5.137763       4.969863 12.13162       5.896682 21.61058 7.604205 30.65318 7.857977 -9.042603      10.93489 
1 1 1 -6  10 36 o 131.1664 3.145728 210.4485       10.05495 206.2799       13.95832 214.9448       14.49664 129.5397 4.428262 132.2149 4.505943 -2.675278      6.317676 
1 1 1 -6  10 37 o 23.60036 6.332156 7.154457       3.717024 4.480311       4.688724 11.67788       6.098119 20.48608 7.367302 29.98250 8.139180 -9.496422      10.97831 
1 1 1 -6  10 38 o 28.29608 5.904311 10.31052       3.939446 11.20211       5.202473 9.112162       6.031426 29.30051 7.310410 26.79525 8.344660 2.505257       11.09394 
1 1 1 -6  10 39 o 71.71616 3.246137 63.29053       5.658387 56.30112       7.607081 71.94738       8.465986 67.27192 4.669299 76.11102 4.585780 -8.839096      6.544595 
1 1 1 -6  10 40 o 19.27226 6.897503 4.155474       4.104377 4.065783       4.814935 4.393880       7.850047 19.86526 7.412535 23.12357 9.232776 -3.258307      11.84018 
1 1 1 -6  10 41 o 10.13373 4.904048 -5.791800      3.711462 -6.035289      4.230906 -4.978817      7.730970 11.05023 5.319761 17.06453 7.892238 -6.014297      9.517735 
1 1 1 -6  10 42 o 16.98798 6.458879 2.900480       3.693969 1.112166       4.735773 5.679105       5.903153 16.50320 6.939413 22.06841 8.212848 -5.565212      10.75204 
1 1 1 -6  10 43 o 42.34709 4.299860 22.93812       4.375796 17.61264       5.775412 30.11518       6.704660 35.75935 6.877316 47.65079 5.899835 -11.89145      9.061211 
1 1 1 -6  10 44 o 50.66917 3.917285 32.83253       4.799341 29.00062       6.382932 37.81685       7.279731 46.35579 5.775322 53.04211 5.722403 -6.686329      8.130206 
1 1 1 -6  10 45 o 16.92031 6.866279 2.852870       4.418218 -4.810740      8.238445 5.946862       5.234656 16.35334 7.746985 20.63427 7.722932 -4.280924      10.93890 
1 1 1 -6  10 46 o 16.27951 6.364070 3.218358       3.658575 3.613775       4.717559 2.621670       5.795125 17.45285 7.090397 17.40175 7.506473 0.5109787E-01  10.32574 
1 1 1 -6  10 47 o 11.89516 5.434050 -0.9535426     3.511921 3.040530       4.833157 -5.421355      5.111759 16.60471 6.997865 11.87416 5.748461 4.730546       9.056210 
1 1 1 -6  10 48 o 10.57184 5.041897 -2.960594      3.608456 -5.410995      5.039568 -0.3825548     5.169154 11.52001 5.607129 14.02394 6.474450 -2.503927      8.564952 
1 1 1 -6  10 49 o 22.89140 7.483288 10.18120       4.804535 8.673828       5.763473 13.61472       8.698491 20.29048 7.971159 22.15755 9.365586 -1.867077      12.29852 
1 1 1 -6  10 50 o 14.16003 6.314586 2.133774       4.420556 4.202836       5.610646 -1.253062      7.178327 16.03656 7.135034 14.12816 6.832994 1.908407       9.879196 
1 1 1 -6  11 1  o 666.6404 9.615823 5424.089       156.2119 5181.165       302.5948 5512.352       182.3961 649.6364 19.13501 671.8474 11.14061 -22.21106      22.14185 
1 1 1 -6  11 2  o 809.6627 10.38216 8003.388       204.8463 7860.333       320.1348 8102.569       266.5606 801.2112 16.39645 814.1210 13.43603 -12.90973      21.19836 
1 1 1 -6  11 3  o 389.4034 5.215182 1848.503       49.48861 1850.517       78.12436 1847.154       63.95729 389.4719 8.231411 389.1966 6.743495 0.2752991      10.64100 
1 1 1 -6  11 4  o 1009.572 12.89370 12455.58       317.2129 12329.87       406.9178 12650.31       506.4551 1003.479 16.64034 1015.157 20.47253 -11.67792      26.38229 
1 1 1 -6  11 5  o 382.9191 5.139172 1787.385       47.95526 1746.686       74.81778 1815.765       62.47643 378.4057 8.113553 385.8881 6.643834 -7.482391      10.48667 
1 1 1 -6  11 6  f 442.6823 6.549735 2389.461       70.65649 2424.481       100.9082 2355.775       98.96680 445.7540 9.289558 439.3958 9.242673 6.358246       13.10431 
1 1 1 -6  11 7  o 326.2367 5.005772 1297.316       39.79605 1236.185       54.75126 1365.787       57.94463 318.3945 7.056550 334.6671 7.105001 -16.27252      10.01379 
1 1 1 -6  11 8  o 126.3152 2.781889 194.4328       8.563107 208.1160       12.65014 182.8600       11.63374 130.6156 3.978972 122.4290 3.904402 8.186584       5.574637 
1 1 1 -6  11 9  o 671.4568 11.17903 5503.882       182.9187 5460.548       223.0257 5592.938       319.7201 668.4905 13.69063 675.2918 19.44890 -6.801331      23.78430 
1 1 1 -6  11 10 o 233.5579 3.864935 664.8054       21.99747 647.2161       30.86743 682.9566       31.35658 230.4205 5.497223 236.6983 5.436225 -6.277863      7.731236 
1 1 1 -6  11 11 o 172.3972 3.703367 362.2092       15.55833 358.8278       27.62884 363.7794       18.82719 171.4224 6.626401 172.7039 4.477273 -1.281555      7.997198 
1 1 1 -6  11 12 o 332.7631 5.100294 1349.771       41.35866 1310.737       57.69721 1391.026       59.31636 327.8467 7.221839 337.7392 7.207040 -9.892426      10.20276 
1 1 1 -6  11 13 o 586.5957 9.848783 4199.563       140.7854 4052.231       168.2009 4544.289       257.2871 575.9849 11.98343 608.8917 17.35743 -32.90686      21.09224 
1 1 1 -6  11 14 o 451.1463 9.433595 2483.960       103.7124 2402.575       143.0367 2574.178       150.5983 443.1478 13.26025 458.6824 13.48789 -15.53458      18.91447 
1 1 1 -6  11 15 o 418.8982 6.241588 2139.705       63.71470 2161.378       90.93062 2118.801       89.30379 420.8513 8.866360 416.6906 8.794680 4.160675       12.48834 
1 1 1 -6  11 16 o 343.0287 5.245364 1434.580       43.84724 1376.254       60.68300 1498.301       63.42667 335.8836 7.413822 350.4597 7.426731 -14.57611      10.49386 
1 1 1 -6  11 17 o 307.6408 4.795688 1153.816       35.95266 1164.561       51.39513 1143.519       50.31165 308.9815 6.825797 306.1815 6.743005 2.799988       9.594771 
1 1 1 -6  11 18 o 440.3015 6.536062 2364.976       70.12977 2308.725       97.86133 2424.360       100.5503 434.7742 9.236581 445.5264 9.261336 -10.75220      13.08001 
1 1 1 -6  11 19 o 221.6717 4.314625 599.0984       23.30716 620.4559       29.56595 564.0390       37.88075 225.5492 5.379159 214.8440 7.245711 10.70517       9.024172 
1 1 1 -6  11 20 o 254.5629 4.151744 790.1425       25.75501 776.1212       36.31481 804.3324       36.53233 252.2021 5.908795 256.7492 5.838916 -4.547073      8.307034 
1 1 1 -6  11 21 o 410.8519 8.808975 2064.874       88.19557 1973.734       121.6683 2165.792       128.0294 400.6993 12.47533 419.7434 12.53073 -19.04413      17.68200 
1 1 1 -6  11 22 o 339.6966 5.224028 1408.401       43.24469 1383.141       60.74667 1434.355       61.57622 336.3477 7.411361 342.5235 7.377116 -6.175781      10.45706 
1 1 1 -6  11 23 o 96.26259 2.807854 113.0707       6.579666 110.2893       9.480556 115.6553       9.138949 94.99089 4.105275 97.29555 3.862166 -2.304657      5.636454 
1 1 1 -6  11 24 o 290.0293 4.609584 1026.923       32.57915 1066.423       47.38292 991.5062       44.86766 295.2548 6.585500 284.7154 6.466755 10.53946       9.229720 
1 1 1 -6  11 25 o 223.9873 3.825877 612.2618       20.88288 612.6728       29.81985 611.8664       29.25400 223.8790 5.465827 223.7447 5.365328 0.1342926      7.659113 
1 1 1 -6  11 26 o 98.15004 3.112559 117.6347       7.435236 115.1217       12.06109 119.1751       9.442978 96.91263 5.125272 98.72743 3.932828 -1.814804      6.460305 
1 1 1 -6  11 27 o 110.4965 2.867738 149.0325       7.715374 148.7325       10.96910 149.3262       10.85418 110.2834 4.088626 110.5086 4.037341 -0.2251892     5.746041 
1 1 1 -6  11 28 o 123.8839 2.939087 187.2467       8.872851 180.8948       12.46136 193.7787       12.63669 121.6070 4.211404 125.8779 4.125102 -4.270905      5.895115 
1 1 1 -6  11 29 o 136.4309 3.633542 227.4751       12.06958 231.3565       14.73505 219.5613       21.04030 137.4948 4.403416 133.5965 6.482149 3.898300       7.836347 
1 1 1 -6  11 30 o 189.5036 4.054318 438.9711       18.72283 419.8863       22.76291 478.8865       32.91961 185.1068 5.050975 197.2280 6.859804 -12.12111      8.518760 
1 1 1 -6  11 31 o 168.4407 3.338677 346.5437       13.70432 337.8065       19.28022 355.4657       19.48305 166.0262 4.770345 170.3285 4.698385 -4.302338      6.695596 
1 1 1 -6  11 32 o 152.5018 3.230324 284.0959       12.00486 291.5962       17.21466 276.9952       16.74977 154.2354 4.585226 150.3223 4.577786 3.913040       6.479230 
1 1 1 -6  11 33 o 149.4073 3.228773 272.7661       11.75562 261.0595       16.31827 285.3961       16.94962 145.8817 4.595994 152.5431 4.564781 -6.661407      6.477684 
1 1 1 -6  11 34 o 44.81862 5.110422 24.98605       5.481893 25.99154       11.60098 24.69699       6.220158 44.52531 10.80319 44.40609 5.893446 0.1192207      12.30616 
1 1 1 -6  11 35 o 58.96969 3.520032 42.70978       5.035360 52.27201       7.015011 32.54657       7.232099 65.11747 4.447435 51.03112 5.925632 14.08635       7.408967 
1 1 1 -6  11 36 f 55.45300 4.011747 37.91356       5.384539 35.47184       7.790934 40.14640       7.450262 53.20588 6.120229 56.79732 5.449574 -3.591438      8.194819 
1 1 1 -6  11 37 o 15.30731 6.158347 1.386922       3.520055 -2.079237      4.491766 6.903616       5.666727 13.99045 6.292326 24.10058 8.134728 -10.11013      10.28432 
1 1 1 -6  11 38 o 72.92934 3.241423 65.36653       5.746291 61.25323       7.952735 69.86002       8.312138 70.26554 4.671009 75.08871 4.564129 -4.823166      6.530666 
1 1 1 -6  11 39 o 38.25069 4.519998 18.36364       4.131921 14.37088       5.490916 23.57626       6.273883 33.10426 7.024261 42.92626 6.175054 -9.821995      9.352621 
1 1 1 -6  11 40 o 52.12193 4.175252 33.92098       5.258898 30.55043       6.228790 42.28730       9.813418 49.08602 5.290733 56.96362 7.232273 -7.877598      8.960895 
1 1 1 -6  11 41 o 57.47277 4.138822 41.40325       5.757802 39.28406       6.715659 47.28349       11.18670 55.61657 5.008656 59.36567 7.930912 -3.749100      9.380084 
1 1 1 -6  11 42 f 26.69286 5.878182 9.540922       3.720017 13.23150       5.106793 5.368631       5.429854 31.10555 6.916107 21.31872 7.887405 9.786823       10.49017 
1 1 1 -6  11 43 o 16.68239 6.350672 2.950690       3.574028 3.689947       4.597708 1.821849       5.681463 18.55545 7.167479 17.95321 7.577796 0.6022377      10.43052 
1 1 1 -6  11 44 o 19.42972 6.597924 5.120686       3.728169 4.860905       4.774310 5.526628       5.968132 19.60686 7.367773 20.95349 8.146228 -1.346628      10.98386 
1 1 1 -6  11 45 f 26.69296 8.544056 11.73108       6.283347 0.000000       0.000000 11.73108       6.283347 ?        ?        26.69296 8.544056 0.000000       8.544056 
1 1 1 -6  11 46 o 36.94410 4.920799 18.86433       4.320066 19.26990       5.967640 18.41777       6.261975 35.10185 7.217690 33.63608 7.792582 1.465771       10.62165 
1 1 1 -6  11 47 o 15.55633 6.340621 2.840905       3.787271 5.441457       5.173640 -0.1616249     5.559135 18.80477 7.499707 14.85838 6.806218 3.946388       10.12770 
1 1 1 -6  11 48 o 28.49035 6.334056 13.07043       4.283739 14.02694       6.327702 12.26117       5.820299 26.14139 8.590368 24.84914 8.241889 1.292250       11.90475 
1 1 1 -6  11 49 o 16.52777 6.505672 4.570827       3.845603 7.469053       5.812320 2.314326       5.128627 18.95636 7.805057 15.00594 6.738427 3.950420       10.31142 
1 1 1 -6  11 50 o 15.87934 6.659994 4.377515       4.344726 2.948830       5.472805 6.812629       7.144985 15.08143 6.848349 17.46829 7.889100 -2.386859      10.44690 
1 1 1 -6  12 1  o 555.1155 8.084661 3758.616       109.3657 3797.452       220.2147 3745.901       126.0031 556.8570 16.24542 554.0793 9.331964 2.777649       18.73497 
1 1 1 -6  12 2  o 626.8862 7.407556 4792.533       113.1618 4941.344       163.3562 4655.238       156.9083 636.2586 10.53576 617.5754 10.42605 18.68317       14.82244 
1 1 1 -6  12 3  o 230.1209 3.133020 645.3363       17.56933 653.7906       25.09985 637.2146       24.60123 231.6050 4.447206 228.6506 4.415179 2.954361       6.266694 
1 1 1 -6  12 4  o 383.2597 5.155137 1790.500       48.14702 1832.695       77.37943 1763.844       61.50282 387.6255 8.191757 380.3438 6.635636 7.281708       10.54213 
1 1 1 -6  12 5  o 285.7937 4.033546 995.4543       28.09156 1019.636       45.19040 980.2251       35.86246 289.1883 6.412529 283.5757 5.189614 5.612671       8.249401 
1 1 1 -6  12 6  f 379.5167 5.717454 1755.838       52.87735 1775.214       75.50728 1737.191       74.07307 381.5081 8.121737 377.4034 8.054126 4.104675       11.43816 
1 1 1 -6  12 7  o 617.2209 7.989633 4646.319       120.1721 4769.583       193.6202 4569.083       153.2649 624.8900 12.71484 611.8749 10.27884 13.01508       16.34998 
1 1 1 -6  12 8  o 759.3482 9.749575 7035.871       180.4109 7084.623       286.8102 7003.952       232.0741 761.1390 15.46303 757.2595 12.57610 3.879517       19.93147 
1 1 1 -6  12 9  f 621.1072 8.038056 4705.146       121.6617 4653.199       191.0903 4740.556       157.7695 617.2076 12.70490 623.2316 10.38813 -6.023926      16.41121 
1 1 1 -6  12 10 o 608.0956 10.17505 4512.983       150.7803 4509.692       184.8516 4519.527       260.6403 607.6216 12.48400 607.2865 17.63079 0.3351440      21.60313 
1 1 1 -6  12 11 o 569.8638 9.584500 3962.842       133.0996 4089.713       166.4438 3737.813       221.6687 578.6877 11.80286 552.3861 16.48586 26.30157       20.27538 
1 1 1 -6  12 12 o 626.7507 12.84869 4799.959       196.2411 4576.284       268.2701 5057.410       287.8129 610.8652 18.04126 642.1154 18.41237 -31.25018      25.77795 
1 1 1 -6  12 13 o 687.6993 14.04986 5783.316       235.4543 5679.049       328.4973 5893.480       337.6570 679.9664 19.84601 692.6449 20.02558 -12.67853      28.19376 
1 1 1 -6  12 14 o 247.9177 4.692625 749.2200       28.35042 765.4899       35.66674 721.3000       46.72274 250.5653 5.841259 243.0301 7.899682 7.535202       9.824728 
1 1 1 -6  12 15 o 385.8074 5.807695 1814.942       54.60224 1821.253       77.64561 1808.769       76.79979 386.3349 8.247397 385.0128 8.185568 1.322144       11.61994 
1 1 1 -6  12 16 o 620.6609 8.995749 4702.831       136.0592 4653.496       191.3774 4753.252       193.4731 616.7960 12.73248 623.3714 12.73614 -6.575439      18.00903 
1 1 1 -6  12 17 o 233.6135 3.911432 665.2501       22.26742 635.0897       31.05912 697.1479       31.94117 228.2066 5.585022 239.1002 5.481948 -10.89359      7.825869 
1 1 1 -6  12 18 o 55.75895 3.517835 38.04807       4.755617 36.10812       6.603428 40.13834       6.854512 54.17997 5.059953 57.15723 4.970560 -2.977261      7.092925 
1 1 1 -6  12 19 o 170.2502 3.245525 353.3147       13.46507 340.6056       18.96896 366.2228       19.11686 167.0582 4.664070 173.2389 4.532191 -6.180725      6.503407 
1 1 1 -6  12 20 o 377.6822 6.621850 1741.727       60.94554 1726.589       106.3385 1749.133       74.37225 375.0287 11.64976 378.2902 8.067700 -3.261475      14.17056 
1 1 1 -6  12 21 o 223.9110 4.438682 611.5875       24.21952 660.0918       45.32100 592.1983       28.65429 232.1802 8.022157 220.2763 5.338088 11.90385       9.635880 
1 1 1 -6  12 22 f 163.6883 3.194045 326.7055       12.74074 327.7029       18.37950 325.7829       17.67727 163.8092 4.608835 163.3414 4.445155 0.4678497      6.403184 
1 1 1 -6  12 23 o 141.7262 3.007840 244.9316       10.38822 235.4771       14.74970 254.2376       14.63330 138.8358 4.365014 144.2820 4.166287 -5.446152      6.034178 
1 1 1 -6  12 24 o 261.4091 4.269642 834.1629       27.19870 820.2306       38.40778 848.1782       38.52203 258.9700 6.086024 263.3584 6.002413 -4.388428      8.548020 
1 1 1 -6  12 25 o 47.83558 3.572400 28.07715       4.134278 37.10477       6.767670 22.70246       5.221905 54.86429 5.121053 42.79998 5.107342 12.06432       7.232574 
1 1 1 -6  12 26 o 175.7855 3.341685 377.0490       14.31478 375.5342       20.44762 378.5049       20.04664 175.2338 4.792882 175.9412 4.679761 -0.7073669     6.698648 
1 1 1 -6  12 27 o 150.7986 3.133313 277.4698       11.51429 281.3958       16.56288 273.7978       16.01811 151.6833 4.485794 149.6307 4.397703 2.052643       6.281889 
1 1 1 -6  12 28 o 16.60598 6.560982 1.856192       3.924394 7.028383       9.264466 0.7251849      4.332273 27.41087 10.27113 16.11016 6.695473 11.30071       12.26073 
1 1 1 -6  12 29 o 167.2188 3.897202 341.6530       15.88086 343.7196       19.28593 337.3002       27.98885 167.5481 4.728240 165.5062 6.955104 2.041824       8.410097 
1 1 1 -6  12 30 o 139.6949 3.139380 238.2575       10.68712 231.4278       14.85457 245.5858       15.38722 137.4684 4.440086 141.6112 4.464466 -4.142853      6.296493 
1 1 1 -6  12 31 o 78.44604 3.052763 75.25429       5.824658 67.85334       8.076749 83.27446       8.407845 74.32012 4.480388 82.39799 4.201146 -8.077866      6.141946 
1 1 1 -6  12 32 o 160.5659 3.309977 315.0127       12.95133 309.6482       18.27479 320.4258       18.35738 158.8937 4.724898 161.6509 4.664993 -2.757202      6.639791 
1 1 1 -6  12 33 o 143.0374 3.193945 250.0243       11.13303 255.7644       15.90857 244.5151       15.58536 144.3868 4.526937 141.1707 4.536285 3.216125       6.408669 
1 1 1 -6  12 34 o 55.76958 4.470997 38.38707       6.025419 43.60100       12.68286 36.86723       6.847528 58.35284 9.225376 54.51945 5.217610 3.833389       10.59863 
1 1 1 -6  12 35 o 98.06656 3.105284 117.7235       7.411576 126.3518       10.64214 109.5970       10.32802 101.3851 4.317316 94.37378 4.503861 7.011337       6.238909 
1 1 1 -6  12 36 o 52.38414 3.813748 33.83148       4.835070 31.28764       6.613565 36.75219       7.086555 50.03802 5.515115 54.29783 5.428398 -4.259811      7.738475 
1 1 1 -6  12 37 o 68.76409 3.303060 58.09350       5.518772 53.96784       7.432344 63.16370       8.239335 66.00038 4.650856 71.39969 4.762665 -5.399307      6.656834 
1 1 1 -6  12 38 o 60.02813 3.486930 44.42353       5.078794 40.01176       6.875526 49.72171       7.534641 56.59301 5.038092 63.16273 4.934276 -6.569714      7.051911 
1 1 1 -6  12 39 o 30.43917 5.277020 11.88041       3.772536 8.854334       4.981064 15.95144       5.777419 25.96777 7.471038 34.84466 7.046408 -8.876892      10.26978 
1 1 1 -6  12 40 o 55.29704 3.679112 38.00259       4.929512 36.02534       6.638865 40.43235       7.359453 53.32434 5.173906 56.41628 5.419687 -3.091942      7.492818 
1 1 1 -6  12 41 o 21.41164 6.585226 6.018524       3.769761 8.296838       4.770181 2.228832       6.152194 24.79671 7.361453 19.27781 7.992498 5.518900       10.86605 
1 1 1 -6  12 42 o 36.78022 4.641835 17.42109       4.067968 17.00699       5.516576 17.91464       6.022625 35.39404 6.639760 36.09802 7.099555 -0.7039833     9.720602 
1 1 1 -6  12 43 o 55.61256 3.692801 39.16700       4.976199 41.71294       6.742665 36.12153       7.374522 56.57346 4.940346 51.88305 5.939673 4.690407       7.725719 
1 1 1 -6  12 44 o 22.63198 6.548678 7.371425       3.816875 7.585025       4.891829 7.039014       6.102496 22.72260 7.556567 22.27464 8.338230 0.4479580      11.25290 
1 1 1 -6  12 45 o 13.85589 6.246119 -0.6090935     4.454980 4.874538       8.895720 -2.444788      5.146918 20.92130 9.158799 13.67128 6.362847 7.250018       11.15210 
1 1 1 -6  12 46 o 24.94060 6.340745 9.495718       3.861614 10.16993       5.523355 8.851047       5.400994 24.32186 8.027429 22.84974 7.934993 1.472124       11.28733 
1 1 1 -6  12 47 o 20.20130 6.648718 6.617513       3.789950 2.813049       5.261200 10.72116       5.464157 16.45173 7.124561 24.23545 7.983635 -7.783718      10.70036 
1 1 1 -6  12 48 o 21.55359 7.367818 8.628373       4.650191 6.373616       5.687448 13.17546       8.076707 18.73218 7.717578 23.07615 9.312666 -4.343969      12.09491 
1 1 1 -6  12 49 o 12.96643 5.792029 1.024704       3.735615 3.411429       5.615833 -0.8695558     5.003027 15.80515 7.077822 12.96663 6.110663 2.838529       9.350710 
1 1 1 -6  12 50 o 18.60856 7.252507 7.407810       4.739690 6.075661       5.986692 9.645150       7.758481 17.00691 7.477216 18.67063 8.343112 -1.663725      11.20340 
1 1 1 -6  13 1  o 441.2286 6.540125 2373.657       70.32112 2246.873       95.93215 2520.901       103.3835 429.1473 9.173218 454.5536 9.333189 -25.40634      13.08649 
1 1 1 -6  13 2  o 702.9233 11.70652 6032.965       200.5266 0.000000       0.000000 6032.965       200.5266 ?        ?        702.9233 11.70652 0.000000       11.70652 
1 1 1 -6  13 3  o 395.3275 5.933778 1905.257       57.16425 1911.919       81.21571 1898.716       80.47430 395.9105 8.417962 394.5435 8.370015 1.366974       11.87094 
1 1 1 -6  13 4  o 107.4466 2.796523 140.7788       7.316071 141.5714       10.63373 140.0664       10.08133 107.7016 4.058868 107.1351 3.867794 0.5665054      5.606625 
1 1 1 -6  13 5  o 705.3441 10.16423 6071.450       174.7075 5981.110       244.6726 6165.425       249.5470 699.5298 14.35301 710.2162 14.41868 -10.68640      20.34471 
1 1 1 -6  13 6  o 581.6769 7.560068 4126.207       107.1627 4069.576       167.8979 4165.136       139.2049 577.2938 11.93472 584.2421 9.777450 -6.948303      15.42842 
1 1 1 -6  13 7  o 653.5502 8.447260 5210.107       134.5336 4958.759       205.6623 5398.109       177.8683 637.0746 13.24733 664.9828 10.97620 -27.90814      17.20374 
1 1 1 -6  13 8  o 720.7867 9.285884 6338.902       163.1046 5973.995       247.9687 6617.175       216.5416 699.0365 14.55663 736.0906 12.07185 -37.05414      18.91098 
1 1 1 -6  13 9  o 40.97147 3.829152 20.63703       3.778857 19.90256       5.794878 21.18043       4.984442 39.93998 6.151021 41.37841 5.047522 -1.438427      7.956917 
1 1 1 -6  13 10 o 303.6786 5.505363 1124.238       40.74143 1075.213       69.11841 1150.341       50.43447 296.6752 9.572940 307.1444 6.738276 -10.46921      11.70665 
1 1 1 -6  13 11 o 522.9324 8.854701 3336.593       112.8380 3366.175       139.0386 3279.516       193.1264 525.0602 10.86651 517.4960 15.33125 7.564209       18.79171 
1 1 1 -6  13 12 o 589.6000 8.580944 4241.512       123.2902 4131.614       171.0578 4360.320       177.8583 581.5192 12.07099 597.3774 12.21770 -15.85828      17.17501 
1 1 1 -6  13 13 o 551.3322 9.276509 3710.080       124.6333 3661.274       214.0673 3735.108       153.2939 546.5137 16.09112 552.9481 11.37639 -6.434387      19.70651 
1 1 1 -6  13 14 o 617.0513 8.949750 4647.411       134.5762 4532.068       187.4004 4770.231       193.3794 608.8165 12.63130 624.5958 12.70501 -15.77924      17.91555 
1 1 1 -6  13 15 o 388.7234 5.863256 1842.683       55.54124 1807.900       77.93124 1878.589       79.17795 384.8749 8.309137 392.3292 8.281663 -7.454285      11.73148 
1 1 1 -6  13 16 o 232.2101 3.898668 657.2802       22.06142 664.5838       31.74138 650.4549       30.68458 233.4454 5.579617 230.9551 5.452009 2.490341       7.801060 
1 1 1 -6  13 17 o 255.7545 4.187123 797.4401       26.09607 803.0963       37.37800 792.0612       36.45033 256.5847 5.977908 254.8210 5.869891 1.763687       8.378007 
1 1 1 -6  13 18 o 333.1440 7.320030 1355.101       59.42661 1355.101       59.42661 0.000000       0.000000 333.1440 7.320030 ?        ?        0.000000       7.320030 
1 1 1 -6  13 19 o 50.58757 3.866909 31.38505       4.730855 30.49368       10.02694 31.64030       5.365620 49.22147 8.676373 50.74739 4.381681 -1.525921      9.720009 
1 1 1 -6  13 20 o 315.8535 5.713281 1217.806       43.97515 1206.478       77.14305 1223.259       53.52300 313.6066 10.10749 316.4211 6.941270 -2.814514      12.26142 
1 1 1 -6  13 21 o 91.77017 2.817863 102.7665       6.294232 100.1454       9.235143 105.0402       8.601386 90.50822 4.198599 92.72452 3.814751 -2.216293      5.672791 
1 1 1 -6  13 22 o 641.0673 9.338664 5043.147       145.8896 5007.688       205.6287 5079.088       207.0166 636.5244 13.25661 641.0494 13.25188 -4.524963      18.74433 
1 1 1 -6  13 23 o 38.74108 3.736722 18.48148       3.484034 16.53088       5.212840 20.05628       4.683840 36.27781 6.113667 40.23334 4.876704 -3.955528      7.820433 
1 1 1 -6  13 24 o 354.2940 5.450598 1534.486       47.05915 1614.604       69.17904 1465.479       64.20262 362.7938 7.824896 345.6940 7.621225 17.09982       10.92301 
1 1 1 -6  13 25 o 232.2408 3.956300 658.4504       22.39050 665.4805       32.28130 651.9327       31.08261 233.2384 5.679562 230.8768 5.524603 2.361649       7.923299 
1 1 1 -6  13 26 o 221.3173 3.829938 598.0136       20.65586 609.9287       29.77566 586.9602       28.67879 223.2776 5.472431 219.0494 5.372577 4.228165       7.668903 
1 1 1 -6  13 27 o 133.3503 3.598583 217.2612       11.68327 222.1262       22.60141 215.4872       13.64821 134.3447 6.927047 132.7357 4.224792 1.608948       8.113745 
1 1 1 -6  13 28 o 64.81068 3.691182 51.46597       5.805621 52.45259       6.965013 49.21999       10.50871 65.35551 4.398864 62.91817 6.970689 2.437336       8.242603 
1 1 1 -6  13 29 o 125.0735 4.347226 191.5353       13.22979 191.5353       13.22979 0.000000       0.000000 125.0735 4.347226 ?        ?        0.000000       4.347226 
1 1 1 -6  13 30 o 95.59837 2.945063 111.6685       6.852719 111.4602       9.936045 111.8576       9.463622 95.35919 4.286735 95.55685 4.073399 -0.1976624     5.913432 
1 1 1 -6  13 31 o 252.5364 4.233765 780.4246       26.05474 778.4733       37.00362 782.3431       36.69230 251.6617 6.033801 252.3104 5.967654 -0.6487122     8.486440 
1 1 1 -6  13 32 o 31.87745 5.167084 12.78266       3.876593 8.732174       5.296121 17.45748       5.689672 26.33125 7.741112 37.11197 6.529566 -10.78072      10.12719 
1 1 1 -6  13 33 o 113.8171 3.061929 158.4078       8.484848 163.2517       12.16736 153.8224       11.83819 115.3397 4.336661 111.9525 4.347522 3.387276       6.140650 
1 1 1 -6  13 34 o 26.78119 7.325275 9.190023       4.917740 9.736670       10.22901 9.025693       5.608417 30.00025 10.86934 26.74202 7.992601 3.258223       13.49164 
1 1 1 -6  13 35 o 77.54410 3.567722 73.79612       6.723735 69.74386       10.29814 76.80710       8.876951 74.96387 5.679553 78.92137 4.636072 -3.957497      7.331472 
1 1 1 -6  13 36 o 94.83618 3.124699 110.2309       7.211490 105.1568       10.02672 115.6686       10.37961 92.34147 4.469073 96.87223 4.408444 -4.530762      6.277499 
1 1 1 -6  13 37 o 17.80161 6.451557 3.320799       3.604107 1.209097       4.816782 6.006924       5.432549 17.15320 7.088161 22.83723 7.956493 -5.684029      10.65588 
1 1 1 -6  13 38 o 33.04266 5.172968 13.88043       4.028793 8.461843       5.342655 21.02342       6.134142 25.63295 7.831356 40.44695 6.439127 -14.81400      10.13866 
1 1 1 -6  13 39 o 21.32049 6.827644 5.725854       4.012047 6.149384       4.928753 4.894073       6.907165 22.40186 7.586471 22.66543 8.776964 -0.2635765     11.60128 
1 1 1 -6  13 40 f 34.72395 5.717012 15.65675       4.669438 12.76989       5.487983 23.22732       8.887186 30.73315 7.413886 40.84398 9.155810 -10.11082      11.78111 
1 1 1 -6  13 41 o 22.28987 6.578501 6.639760       3.818553 5.233308       4.887405 8.843642       6.118010 20.87930 7.520114 25.56611 8.448947 -4.686813      11.31092 
1 1 1 -6  13 42 o 40.46875 4.364482 20.98973       4.236172 26.20881       5.838129 15.18644       6.156225 44.67515 5.476995 32.62283 7.841254 12.05232       9.564661 
1 1 1 -6  13 43 o 26.28494 5.901144 9.548358       3.687035 8.480443       4.692148 11.27211       5.961297 24.23513 7.325877 27.38355 8.253034 -3.148413      11.03544 
1 1 1 -6  13 44 o 21.58699 6.944016 6.811979       4.146661 8.589744       5.797372 4.949731       5.933526 23.62761 8.220084 20.02482 8.016376 3.602787       11.48181 
1 1 1 -6  13 45 o 21.97019 7.513407 7.627335       4.835893 16.30497       9.325617 4.435610       5.655743 28.40446 10.36540 18.81003 7.717094 9.594429       12.92265 
1 1 1 -6  13 46 o 23.61636 6.591767 8.772065       3.937484 8.975920       5.637889 8.577954       5.501502 22.67078 8.087362 22.29056 7.984704 0.3802204      11.36490 
1 1 1 -6  13 47 o 26.59985 6.201560 11.15199       3.945501 11.92085       6.154357 10.61548       5.140951 24.54737 8.473079 24.13099 7.728865 0.4163742      11.46858 
1 1 1 -6  13 48 o 13.79070 6.024562 1.608532       3.831408 5.049650       5.718327 -1.194782      5.161252 17.44261 7.489500 13.23144 6.226508 4.211170       9.739714 
1 1 1 -6  13 49 o 28.27309 6.471710 13.89451       4.362377 13.51180       6.512847 14.20592       5.875006 23.35518 8.638717 25.19598 8.277260 -1.840803      11.96413 
1 1 1 -6  13 50 o 21.23464 7.451856 9.859419       4.770489 8.148672       5.997834 12.80517       7.870457 18.37441 7.772248 20.30155 8.752561 -1.927145      11.70535 
1 1 1 -6  14 1  o 289.4901 5.260922 1021.561       37.11349 1046.865       64.96412 1009.300       45.21917 292.7839 9.116324 287.7161 6.449447 5.067841       11.16704 
1 1 1 -6  14 2  o 29.31162 5.167017 10.78358       3.555945 8.401114       5.905324 12.13887       4.453973 26.39528 8.262577 31.01574 6.110353 -4.620457      10.27651 
1 1 1 -6  14 3  o 396.0067 6.887668 1912.214       66.46773 2024.234       119.8449 1862.450       79.87878 406.9445 12.09848 390.7491 8.388752 16.19543       14.72224 
1 1 1 -6  14 4  f 167.7701 4.666643 343.3369       19.06045 326.2100       26.80337 360.8584       27.11034 163.4257 6.744773 171.9146 6.482834 -8.488922      9.355165 
1 1 1 -6  14 5  o 767.0439 11.02824 7182.789       206.1400 6909.047       283.8326 7488.362       299.8811 751.5727 15.49727 782.4027 15.72833 -30.83002      22.08044 
1 1 1 -6  14 6  o 256.5823 4.187980 802.3865       26.18589 793.9114       36.94564 810.9418       37.11987 255.1867 5.941130 257.9102 5.906115 -2.723419      8.377303 
1 1 1 -6  14 7  o 509.7753 7.480844 3169.339       92.93205 3142.159       130.7825 3197.060       132.0786 507.3485 10.57809 511.7604 10.59082 -4.411957      14.96868 
1 1 1 -6  14 8  o 37.80728 4.177977 17.63404       3.785125 11.28976       5.610036 22.93551       5.128295 29.86196 7.669556 43.09127 4.974922 -13.22931      9.141769 
1 1 1 -6  14 9  o 191.7770 4.946843 448.6175       23.09926 420.4778       31.86716 479.7721       33.53086 185.5509 7.060530 198.2266 6.952157 -12.67570      9.908762 
1 1 1 -6  14 10 o 690.3730 8.909182 5815.819       149.8848 5636.911       232.1815 5943.646       196.2569 678.9346 14.03342 697.5715 11.54516 -18.63690      18.17217 
1 1 1 -6  14 11 o 494.8909 6.511583 2986.647       78.52938 3060.445       126.4903 2940.364       100.1724 500.6504 10.36780 490.9088 8.373577 9.741577       13.32697 
1 1 1 -6  14 12 o 252.1323 5.803309 775.1191       35.65663 753.9619       50.25390 796.5687       50.60007 248.4373 8.312447 255.3811 8.141069 -6.943787      11.63502 
1 1 1 -6  14 13 o 541.5355 9.142032 3580.003       120.6440 3525.186       146.6045 3695.003       212.3436 537.1188 11.20059 548.8890 15.89191 -11.77020      19.44237 
1 1 1 -6  14 14 o 71.94485 3.049245 63.19541       5.333867 55.46317       8.050491 69.24551       7.121164 67.26637 4.945786 75.27142 3.895515 -8.005043      6.295700 
1 1 1 -6  14 15 o 362.8466 5.529947 1605.567       48.89677 1598.885       69.27892 1612.200       69.02276 361.9314 7.854865 363.4402 7.793333 -1.508850      11.06503 
1 1 1 -6  14 16 f 433.0087 6.458039 2287.674       68.14491 2244.244       95.48928 2332.747       97.27853 428.5844 9.142861 436.9543 9.135764 -8.369904      12.92494 
1 1 1 -6  14 17 o 331.5795 7.300589 1342.403       58.99045 1342.403       58.99045 0.000000       0.000000 331.5795 7.300589 ?        ?        0.000000       7.300589 
1 1 1 -6  14 18 o 365.1368 6.444249 1627.646       57.34084 1662.389       102.1040 1611.641       69.30128 368.0822 11.39686 363.1695 7.830615 4.912720       13.82776 
1 1 1 -6  14 19 o 76.77818 3.288244 72.00079       6.138057 88.37790       13.66905 67.86435       6.869618 84.80186 6.668102 74.50446 3.796192 10.29741       7.672983 
1 1 1 -6  14 20 o 150.0548 3.109234 274.5261       11.36945 279.4986       16.61389 270.1462       15.59234 151.2873 4.511472 148.7473 4.306095 2.539993       6.236653 
1 1 1 -6  14 21 o 521.5522 7.679393 3329.849       97.60246 3351.154       138.9945 3309.125       137.0868 521.9766 10.92724 518.7296 10.84472 3.247009       15.39521 
1 1 1 -6  14 22 o 60.17999 3.031218 44.27711       4.431031 41.87087       6.618551 46.23169       5.965114 58.37399 4.692220 61.42209 4.007151 -3.048100      6.170429 
1 1 1 -6  14 23 o 270.4875 4.391064 893.2960       28.94363 915.2027       41.88929 873.2825       40.03837 273.4889 6.285318 267.1760 6.149543 6.312866       8.793299 
1 1 1 -6  14 24 o 190.7585 3.953318 444.2069       18.37730 457.2336       31.83574 437.6968       22.50563 193.0694 6.777029 189.1999 4.885370 3.869476       8.354338 
1 1 1 -6  14 25 o 105.7801 2.888211 136.5888       7.438104 134.5523       10.79701 138.4283       10.26154 104.8764 4.233340 106.4043 3.964397 -1.527962      5.799794 
1 1 1 -6  14 26 o 128.4235 3.536871 201.4776       11.05824 193.6625       21.06832 204.4492       12.99168 125.4416 6.918908 129.3072 4.128223 -3.865608      8.056892 
1 1 1 -6  14 27 o 98.42992 2.898037 118.3153       6.943750 116.3931       10.13495 120.0159       9.532597 97.49635 4.276169 99.03944 3.957695 -1.543098      5.826575 
1 1 1 -6  14 28 o 85.17995 4.290396 88.93115       8.877083 88.93115       8.877083 0.000000       0.000000 85.17995 4.290396 ?        ?        0.000000       4.290396 
1 1 1 -6  14 29 o 122.4126 3.024857 182.9270       9.023332 177.3499       12.84221 188.3649       12.68115 120.3281 4.386965 124.0398 4.201349 -3.711792      6.074274 
1 1 1 -6  14 30 o 200.0068 3.669006 488.9195       17.88254 497.0379       25.80467 481.4182       24.80445 201.2643 5.265853 198.1067 5.142350 3.157608       7.360229 
1 1 1 -6  14 31 o 204.4290 3.720296 510.9918       18.53344 502.0739       26.25791 519.8452       26.16284 202.1954 5.333744 205.7785 5.221552 -3.583160      7.464143 
1 1 1 -6  14 32 f 57.12597 3.533698 40.05508       4.895171 42.79887       7.028613 37.47050       6.821659 58.85871 4.946012 55.01251 5.148336 3.846199       7.139216 
1 1 1 -6  14 33 o 160.4056 3.969296 315.1227       15.51562 318.5406       29.23127 313.7820       18.30742 160.0489 7.515773 159.8303 4.705492 0.2185669      8.867271 
1 1 1 -6  14 34 o 131.2434 4.449285 211.6612       14.20939 0.000000       0.000000 211.6612       14.20939 ?        ?        131.2434 4.449285 0.000000       4.449285 
1 1 1 -6  14 35 o 64.53035 4.121719 51.32552       6.447662 48.24681       7.436753 60.64537       12.93909 62.40076 4.930588 69.21410 7.807453 -6.813343      9.234015 
1 1 1 -6  14 36 o 81.96880 3.166458 82.42835       6.313074 77.64030       8.837908 87.41682       9.020976 79.24735 4.596171 84.14981 4.414544 -4.902458      6.372832 
1 1 1 -6  14 37 o 29.97486 5.573527 11.51367       3.921400 9.604895       5.332213 13.76198       5.787063 27.16122 7.702753 32.39169 7.482141 -5.230465      10.73847 
1 1 1 -6  14 38 o 38.09030 5.102093 18.37318       4.616866 17.63002       5.700474 19.79008       7.871150 36.85428 6.589149 38.40584 8.622025 -1.551559      10.85155 
1 1 1 -6  14 39 o 57.30983 3.619517 40.75379       5.029116 40.18789       6.923343 41.38596       7.317502 56.41710 5.090508 57.17010 5.313209 -0.7530022     7.358223 
1 1 1 -6  14 40 o 55.04742 4.373523 38.15516       5.818650 40.78776       6.862275 31.42022       10.97596 56.63985 5.023813 46.93367 9.908238 9.706188       11.10909 
1 1 1 -6  14 41 o 23.99912 6.351161 7.812256       3.771641 7.499199       5.031212 8.213897       5.698756 23.57830 7.654347 24.59410 8.155314 -1.015808      11.18473 
1 1 1 -6  14 42 o 15.82757 6.238913 2.293782       3.541144 8.784781       4.787772 -5.545447      5.261558 24.89638 7.370976 12.83414 6.111688 12.06224       9.575177 
1 1 1 -6  14 43 o 24.46074 6.267914 8.469666       3.752817 7.200844       4.925390 10.22575       5.794459 22.39774 7.583890 25.96198 8.192701 -3.564249      11.16404 
1 1 1 -6  14 44 o ?        ?        -12.85726      3.258610 -10.78672      4.524967 -15.08782      4.696561 9.458447 4.728292 8.681502 4.398880 0.7769451      6.458087 
1 1 1 -6  14 45 o 16.04152 6.460046 2.906451       3.877491 5.040229       5.519656 0.8275291      5.448243 19.11357 7.703896 15.77048 7.022944 3.343086       10.42457 
1 1 1 -6  14 46 o 24.62005 6.413999 9.511027       3.886079 5.544302       5.626228 13.12998       5.373939 19.04461 7.740932 27.65743 7.693878 -8.612822      10.91411 
1 1 1 -6  14 47 o 15.38315 6.597443 2.587819       4.427531 -0.4971662     5.438451 8.651258       7.624444 14.14813 6.569720 20.55614 8.731927 -6.408011      10.92739 
1 1 1 -6  14 48 o 10.23311 4.891347 -2.642670      3.436701 -3.426117      5.461768 -2.129173      4.421786 12.39578 5.986612 11.84829 5.630987 0.5474844      8.218731 
1 1 1 -6  14 49 o 18.18557 6.827327 6.395328       4.097533 13.58262       6.189545 0.7880205      5.467052 23.62080 8.468341 13.96313 6.518322 9.657677       10.68650 
1 1 1 -6  15 1  o 474.2478 6.267421 2742.261       72.43196 2835.046       116.9976 2684.599       92.23235 481.9570 9.961679 469.1316 8.067751 12.82535       12.81888 
1 1 1 -6  15 2  o 580.4174 7.557071 4108.752       106.8883 3953.927       164.4234 4222.070       140.6672 568.9718 11.85869 588.1702 9.814172 -19.19836      15.39307 
1 1 1 -6  15 3  o 299.5262 4.725013 1093.557       34.48847 1103.917       48.76749 1083.193       48.78064 300.8853 6.651099 298.0454 6.716283 2.839874       9.452278 
1 1 1 -6  15 4  o 645.4864 10.80505 5086.890       169.9613 4979.973       205.2831 5319.908       303.0573 638.3522 13.19644 658.4786 18.90588 -20.12640      23.05598 
1 1 1 -6  15 5  o 654.4460 7.728026 5224.036       123.2476 5301.234       176.0717 5149.871       172.5778 658.9164 10.96536 649.4490 10.90445 9.467468       15.46435 
1 1 1 -6  15 6  o 338.5575 4.666512 1397.138       38.50003 1430.043       61.89773 1376.375       49.16852 342.4200 7.417876 335.9898 6.005166 6.430176       9.543945 
1 1 1 -6  15 7  o 332.6098 5.939166 1348.824       48.13894 1310.671       82.16605 1368.765       59.40129 327.4989 10.30831 335.0055 7.276255 -7.506561      12.61765 
1 1 1 -6  15 8  o 315.1666 4.402876 1210.722       33.81526 1172.403       52.62724 1237.667       44.13086 310.0542 6.965252 318.6157 5.683805 -8.561493      8.990015 
1 1 1 -6  15 9  o 216.0613 3.739010 568.9568       19.68656 581.7898       40.53618 564.9958       22.52077 218.2567 7.633228 215.2985 4.292458 2.958145       8.757360 
1 1 1 -6  15 10 o 471.1739 6.232001 2707.184       71.55580 2635.006       111.4547 2757.796       93.33077 464.5714 9.844866 475.4298 8.055682 -10.85849      12.72067 
1 1 1 -6  15 11 o 190.7385 3.459564 443.4022       16.08036 433.1357       32.49776 446.7308       18.50448 188.3043 7.094706 191.4451 3.966400 -3.140778      8.128172 
1 1 1 -6  15 12 o 60.09805 2.905398 44.11922       4.242418 44.36683       7.671048 44.01012       5.092005 60.09057 5.292594 59.98919 3.498391 0.1013794      6.344312 
1 1 1 -6  15 13 o 383.3047 5.806509 1791.764       54.23696 1774.378       76.57018 1809.271       76.83581 381.2684 8.241242 385.0033 8.189608 -3.734894      11.61842 
1 1 1 -6  15 14 o 621.9623 10.43426 4728.676       158.1473 4805.631       196.2660 4586.210       267.0441 626.4788 12.85591 610.3281 17.97451 16.15063       22.09881 
1 1 1 -6  15 15 o 504.0332 7.424931 3101.311       91.19849 3052.603       127.8981 3151.693       130.0778 499.5871 10.50550 507.6290 10.51527 -8.041901      14.86393 
1 1 1 -6  15 16 o 390.1282 8.400132 1859.743       79.86004 1859.743       79.86004 0.000000       0.000000 390.1282 8.400132 ?        ?        0.000000       8.400132 
1 1 1 -6  15 17 o 357.8870 6.345488 1563.615       55.34100 1655.109       100.4442 1523.736       66.31399 367.2906 11.23543 353.1332 7.706027 14.15741       13.62416 
1 1 1 -6  15 18 f 119.5016 3.413951 174.2570       9.931656 179.1243       18.90918 172.4028       11.67111 120.9375 6.439382 118.8287 4.036319 2.108727       7.599836 
1 1 1 -6  15 19 o 359.4053 5.504140 1577.035       48.20700 1629.495       69.99425 1529.696       66.49060 364.9546 7.870231 353.6300 7.715694 11.32452       11.02145 
1 1 1 -6  15 20 o 386.0744 5.859445 1821.006       55.12690 1794.038       77.58670 1848.501       78.34120 382.6853 8.319735 388.4616 8.275725 -5.776306      11.73480 
1 1 1 -6  15 21 o 162.1089 3.206888 320.4999       12.66855 323.1032       18.38710 318.1474       17.47940 162.6163 4.644707 161.3819 4.448876 1.234390       6.431625 
1 1 1 -6  15 22 f 74.86682 2.892753 68.45582       5.267673 63.51350       7.738206 72.72395       7.191078 71.98947 4.432474 77.10218 3.839368 -5.112709      5.864092 
1 1 1 -6  15 23 o 216.2224 4.280465 570.8700       22.55422 547.2844       37.84330 583.8628       28.08772 211.1404 7.366264 218.5481 5.273918 -7.407684      9.059584 
1 1 1 -6  15 24 o 125.9028 2.955522 193.3587       9.067876 169.2748       12.59715 219.2583       13.06338 117.6392 4.402008 133.9476 4.006575 -16.30839      5.952337 
1 1 1 -6  15 25 o 186.6534 4.069869 425.5039       18.51196 471.3324       36.10143 409.1550       21.56259 195.7354 7.583002 182.8794 4.842642 12.85602       8.997395 
1 1 1 -6  15 26 o 32.68938 4.296660 13.28137       3.339954 15.13920       5.133810 11.91797       4.397930 34.60827 6.320099 30.65109 6.102564 3.957182       8.785497 
1 1 1 -6  15 27 o 242.4036 4.798289 718.8797       28.34403 696.1177       34.03303 770.4113       51.20732 238.2966 5.860661 249.7478 8.425907 -11.45113      10.26369 
1 1 1 -6  15 28 f 136.9999 4.496566 229.8475       14.99162 229.8475       14.99162 0.000000       0.000000 136.9999 4.496566 ?        ?        0.000000       4.496566 
1 1 1 -6  15 29 o 73.83167 3.058704 66.66845       5.491294 71.53986       8.077076 62.48163       7.488057 76.34345 4.359690 71.33412 4.327967 5.009331       6.143142 
1 1 1 -6  15 30 o 33.92767 4.749698 14.37154       3.819518 12.74965       5.579779 15.80165       5.239493 31.51944 7.393037 35.32257 6.318964 -3.803127      9.725549 
1 1 1 -6  15 31 o 24.86901 6.070955 7.912016       3.646544 9.297131       5.398034 6.749358       4.945600 27.08377 7.772888 23.62421 7.582007 3.459562       10.85839 
1 1 1 -6  15 32 o 55.72668 3.529051 38.13315       4.767829 36.72512       6.997661 39.35318       6.513773 54.40794 5.346811 56.43595 4.781269 -2.028015      7.172791 
1 1 1 -6  15 33 o 143.0923 3.832780 250.9453       13.35288 220.0333       24.30091 264.3153       15.98178 132.8628 7.536464 146.7030 4.475674 -13.84016      8.765269 
1 1 1 -6  15 34 o 216.7845 4.406101 577.0950       23.27656 582.4417       39.68394 574.2909       28.73955 216.0469 7.549158 215.7373 5.471030 0.3096008      9.323195 
1 1 1 -6  15 35 o 21.38367 6.595901 5.692617       3.778645 4.784772       5.173291 6.730869       5.532385 21.30854 7.728477 23.83039 8.037724 -2.521851      11.15053 
1 1 1 -6  15 36 o 28.28440 5.759656 10.28472       3.834849 3.458428       5.421703 17.11904       5.424889 20.10641 7.778795 36.56405 6.316710 -16.45764      10.02050 
1 1 1 -6  15 37 o 16.27411 6.358209 2.104738       3.650073 0.2053559      5.127100 4.056705       5.197587 16.70284 7.129913 20.38035 7.681181 -3.677513      10.48028 
1 1 1 -6  15 38 o 59.88933 3.916682 44.53479       5.684788 46.40508       7.248538 41.54625       9.162750 60.81179 4.933664 56.80305 6.751313 4.008743       8.361894 
1 1 1 -6  15 39 o 63.23017 3.504695 49.60219       5.379084 43.40537       7.322859 56.86442       7.927403 58.50732 5.189898 67.16815 4.876400 -8.660835      7.121398 
1 1 1 -6  15 40 o 30.33701 6.296408 12.30174       4.502229 9.728865       5.086523 21.61027       9.675017 26.64265 7.512097 38.31993 10.18661 -11.67728      12.65696 
1 1 1 -6  15 41 o 39.77008 4.352117 20.23747       4.149082 19.81447       5.515389 20.78894       6.297453 38.51379 6.077912 39.01314 6.875061 -0.4993477     9.176463 
1 1 1 -6  15 42 o 15.72130 6.264693 2.208004       3.607002 -1.859995      4.661803 8.276216       5.693690 13.79595 6.286402 24.02242 8.153776 -10.22647      10.29577 
1 1 1 -6  15 43 o 18.91197 6.706866 4.811181       3.872128 6.522601       5.892562 3.510553       5.136914 21.62727 8.172523 18.30435 7.412530 3.322916       11.03339 
1 1 1 -6  15 44 o 21.76273 7.568020 7.336639       4.913822 -1.586526      8.209237 12.31874       6.134082 17.24379 8.029002 27.10563 8.411222 -9.861843      11.62814 
1 1 1 -6  15 45 o 20.67533 6.702129 6.648706       3.858095 8.959617       5.547605 4.484110       5.369112 22.90688 8.036136 18.38785 7.528627 4.519030       11.01180 
1 1 1 -6  15 46 o 20.39417 6.744067 6.796209       3.897869 3.903352       5.544916 9.622231       5.480488 17.44237 7.429201 22.93701 7.991505 -5.494633      10.91133 
1 1 1 -6  15 47 o 14.25616 6.068636 2.104699       3.696237 -5.091576      5.214503 9.371875       5.240128 11.71485 5.702338 21.93250 7.799743 -10.21764      9.661918 
1 1 1 -6  15 48 o 14.72949 6.252398 2.880161       3.904384 1.503913       5.962845 3.913074       5.165795 14.91541 6.909796 16.06863 7.008013 -1.153222      9.841622 
1 1 1 -6  15 49 o 21.17183 7.022644 8.965513       4.225628 7.636925       6.316096 10.04202       5.685419 18.10718 7.823802 20.50488 7.956750 -2.397701      11.15893 
1 1 1 -6  16 1  o 515.4459 6.768872 3240.021       85.02280 3431.900       139.4613 3126.517       107.2614 530.1356 10.79520 506.1946 8.695403 23.94092       13.86169 
1 1 1 -6  16 2  o 542.8903 7.955075 3595.398       105.2428 3805.764       154.4708 3413.154       143.7757 558.2024 11.35582 528.6481 11.16048 29.55432       15.92203 
1 1 1 -6  16 3  o 104.4559 2.899001 133.0684       7.372202 135.0537       14.37554 132.3600       8.587401 105.0990 5.633516 104.1595 3.387699 0.9394684      6.573660 
1 1 1 -6  16 4  o 649.1705 8.411559 5141.713       133.0673 5194.512       211.4504 5107.093       171.2233 651.8363 13.31171 646.6909 10.86501 5.145386       17.18284 
1 1 1 -6  16 5  o 138.6493 3.125382 234.2737       10.55983 207.2060       21.36968 243.0186       12.14643 130.1737 6.759726 141.2096 3.529786 -11.03592      7.625830 
1 1 1 -6  16 6  o 245.4667 3.677065 734.3577       21.99531 723.6793       34.70250 741.5282       28.43693 243.6256 5.845232 246.6405 4.731319 -3.014908      7.520114 
1 1 1 -6  16 7  o 120.0825 2.700523 175.7238       7.902485 173.5400       12.84932 177.0522       10.02195 119.2368 4.429853 120.4818 3.416911 -1.244919      5.594541 
1 1 1 -6  16 8  o 510.6117 6.717077 3179.847       83.58092 3047.280       128.7506 3276.405       109.8818 499.4988 10.57740 518.1368 8.702519 -18.63806      13.69727 
1 1 1 -6  16 9  o 160.0968 3.247054 312.3739       12.66801 335.2549       18.86620 293.5874       17.09501 165.7697 4.674950 155.1247 4.527070 10.64507       6.507651 
1 1 1 -6  16 10 o 158.4444 3.681898 305.9857       14.21624 291.4603       25.00980 312.9193       17.27927 154.4377 6.661057 160.1566 4.431615 -5.718842      8.000556 
1 1 1 -6  16 11 o 438.0035 5.844194 2339.623       62.37899 2237.979       96.29408 2413.119       81.88226 428.1003 9.230346 444.6978 7.555944 -16.59744      11.92860 
1 1 1 -6  16 12 o 436.0276 5.820077 2318.755       61.84132 2430.609       101.1884 2252.070       78.13035 446.0839 9.308469 429.5778 7.463488 16.50607       11.93110 
1 1 1 -6  16 13 o 429.7376 5.744914 2252.543       60.16211 2308.645       97.06329 2217.544       76.66491 434.7010 9.162801 426.2392 7.380863 8.461853       11.76580 
1 1 1 -6  16 14 o 314.3489 4.942734 1205.093       37.86303 1167.129       52.84421 1245.144       54.27738 309.2172 7.012901 319.3878 6.973720 -10.17062      9.890074 
1 1 1 -6  16 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -6  16 16 o 197.6980 5.012673 477.1228       24.13000 505.3639       36.89120 456.0063       31.90024 203.2403 7.461303 193.1167 6.789132 10.12363       10.08778 
1 1 1 -6  16 17 o 138.2458 3.538023 233.1884       11.90945 217.4200       21.65536 240.0254       14.25949 133.2434 6.690763 140.2218 4.177698 -6.978394      7.887932 
1 1 1 -6  16 18 o 213.9637 3.747635 558.3353       19.54040 529.5706       27.28650 588.6148       27.99575 208.2061 5.382483 219.5910 5.231684 -11.38486      7.506106 
1 1 1 -6  16 19 o 229.1929 4.491807 641.0581       25.08756 659.9186       31.92129 610.5881       40.57318 232.4343 5.635650 223.2447 7.468503 9.189590       9.356233 
1 1 1 -6  16 20 o 305.0607 4.822714 1136.312       35.85204 1165.575       51.90054 1109.603       49.58365 308.6223 6.900943 301.1479 6.756511 7.474396       9.657818 
1 1 1 -6  16 21 o 76.69353 2.863638 71.82816       5.342561 70.01035       8.138695 73.20461       7.082068 75.59534 4.437495 77.36347 3.767872 -1.768135      5.821359 
1 1 1 -6  16 22 f 158.7846 3.232445 307.5707       12.50765 304.6327       18.21209 310.1936       17.20760 157.8448 4.740082 159.3143 4.436621 -1.469543      6.492455 
1 1 1 -6  16 23 f 67.72992 2.990506 56.06591       4.923675 48.57340       7.375426 62.08951       6.613046 62.86032 4.852291 71.21722 3.824515 -8.356895      6.178321 
1 1 1 -6  16 24 o 209.0293 3.740913 533.4132       19.05552 532.2002       27.49062 534.5351       26.43738 208.5007 5.415128 209.0616 5.189291 -0.5609741     7.500157 
1 1 1 -6  16 25 o 60.20052 3.078082 44.33805       4.500621 46.51491       6.865562 42.69769       5.959791 61.51326 4.613677 58.97043 4.174231 2.542831       6.221754 
1 1 1 -6  16 26 o 64.57320 3.103405 51.00640       4.869154 46.91144       7.187592 54.47961       6.619485 61.74121 4.815241 66.64677 4.095544 -4.905560      6.321394 
1 1 1 -6  16 27 o 79.73742 4.321882 77.97144       8.366520 77.97144       8.366520 0.000000       0.000000 79.73742 4.321882 ?        ?        0.000000       4.321882 
1 1 1 -6  16 28 o 91.37639 2.945664 102.0272       6.550667 99.91489       9.489345 103.9501       9.054062 90.27468 4.326134 92.11909 4.043122 -1.844406      5.921340 
1 1 1 -6  16 29 o 167.9528 3.355020 344.6049       13.73151 343.8822       19.67139 345.2917       19.17664 167.4737 4.825088 167.8450 4.693043 -0.3712769     6.730983 
1 1 1 -6  16 30 o 195.3914 3.629690 466.7529       17.28267 462.8514       24.70394 470.4928       24.18704 194.1526 5.226153 195.7929 5.073594 -1.640381      7.283820 
1 1 1 -6  16 31 o 77.29173 3.107123 73.11072       5.840386 73.14397       8.552009 73.08165       7.995185 77.11311 4.571483 77.12638 4.270594 -0.1326752E-01 6.255911 
1 1 1 -6  16 32 o 70.43409 3.254109 60.78745       5.570265 60.54385       7.960331 61.02118       7.797287 70.08180 4.688077 70.37866 4.571117 -0.2968597     6.547761 
1 1 1 -6  16 33 o 93.63421 4.300642 107.7887       9.786842 0.000000       0.000000 107.7887       9.786842 ?        ?        93.63421 4.300642 0.000000       4.300642 
1 1 1 -6  16 34 o 82.37521 3.228318 83.19272       6.467960 85.05567       9.330529 81.46940       8.974035 83.02598 4.629987 81.26907 4.549500 1.756912       6.491127 
1 1 1 -6  16 35 o 23.57700 6.503397 7.142773       3.857599 4.939124       5.470039 9.323099       5.441014 21.72802 7.937087 26.92058 7.827401 -5.192554      11.14745 
1 1 1 -6  16 36 o 21.48657 6.413474 5.862693       3.613006 2.760925       5.142972 8.885152       5.076796 19.04007 7.514543 26.18305 7.545425 -7.142981      10.64903 
1 1 1 -6  16 37 o 79.09744 3.646864 77.26144       7.010481 71.63863       8.780164 87.15048       11.64402 75.79494 4.777953 83.20192 5.778841 -7.406982      7.498256 
1 1 1 -6  16 38 o 53.66147 3.768019 35.79670       4.896011 39.14231       7.047081 32.67502       6.807162 55.61768 5.262055 50.64477 5.609576 4.972916       7.691331 
1 1 1 -6  16 39 o 18.21237 6.483511 3.825542       3.621656 2.930052       5.220521 4.656357       5.028466 18.90306 7.535364 20.48554 7.588244 -1.582483      10.69407 
1 1 1 -6  16 40 o 14.96542 6.388570 0.4689713      4.116687 0.2374323      4.694993 1.238993       8.561986 15.65353 6.754454 20.88492 9.066328 -5.231390      11.30579 
1 1 1 -6  16 41 o 17.83402 6.438189 3.815824       3.584756 8.479178       4.934549 -1.395473      5.216404 24.52437 7.532683 15.05387 6.774884 9.470506       10.13116 
1 1 1 -6  16 42 o 41.22040 4.324556 22.05946       4.279398 29.40937       6.216001 15.43718       5.900300 46.76855 5.562957 32.37968 7.607562 14.38886       9.424515 
1 1 1 -6  16 43 o 17.12198 6.548395 3.551625       3.811401 0.6499671      5.169209 7.008400       5.642046 15.80770 6.949047 21.78114 8.043356 -5.973433      10.62943 
1 1 1 -6  16 44 o 16.45696 6.866003 2.653378       4.581235 -2.116975      8.513083 4.598004       5.435376 17.04539 8.013612 18.78506 7.618404 -1.739672      11.05704 
1 1 1 -6  16 45 o 19.52788 6.804523 5.972664       3.973418 8.538941       5.766894 3.653327       5.482418 22.08353 8.135924 17.54332 7.426222 4.540207       11.01554 
1 1 1 -6  16 46 o 12.11527 5.665092 -1.724976      4.157654 -2.817518      5.409737 -0.1484240     6.498470 13.07756 6.218962 15.33177 7.140361 -2.254212      9.468908 
1 1 1 -6  16 47 o 23.06993 6.638334 9.267224       3.932303 5.705240       6.009928 11.93368       5.199851 17.91162 7.684263 24.67240 7.757641 -6.760784      10.91920 
1 1 1 -6  16 48 o 9.748133 4.772044 -4.637397      3.804153 -0.9692459     5.848786 -7.327001      5.008254 13.53737 6.445768 10.39636 5.160644 3.141009       8.257129 
1 1 1 -6  17 1  o 314.2251 6.999172 1204.341       53.59492 1189.398       74.86743 1220.047       76.75723 311.9518 9.860868 315.9375 9.982224 -3.985718      14.03145 
1 1 1 -6  17 2  o 326.3144 4.539408 1297.991       36.09703 1313.006       57.21125 1288.061       46.52702 328.0879 7.155750 325.0149 5.874433 3.072998       9.258170 
1 1 1 -6  17 3  o 507.7657 7.464671 3145.268       92.36558 3232.771       132.9467 3063.622       128.4202 514.4643 10.60440 500.8337 10.52213 13.63062       14.93883 
1 1 1 -6  17 4  o 299.7333 4.736238 1095.191       34.59431 1133.429       49.95780 1059.962       47.95134 304.8448 6.724941 294.8017 6.674745 10.04306       9.475076 
1 1 1 -6  17 5  o 502.6241 7.398566 3081.946       90.62061 3100.750       128.5097 3063.347       127.8070 503.8462 10.46651 500.7975 10.47264 3.048737       14.80622 
1 1 1 -6  17 6  f 431.3549 5.266724 2268.575       55.36195 2317.213       79.49676 2222.775       77.14350 435.8124 7.485378 426.8443 7.416410 8.968109       10.53727 
1 1 1 -6  17 7  o 28.20828 6.208241 10.08563       4.151645 9.853580       10.68674 10.12688       4.505533 30.99180 11.12536 28.24938 6.655070 2.742413       12.96394 
1 1 1 -6  17 8  o 120.0803 3.087285 175.8492       9.026599 198.2814       13.67323 158.5207       12.01752 127.4596 4.408762 113.9524 4.335589 13.50718       6.183406 
1 1 1 -6  17 9  f 241.2061 4.056393 709.2092       23.84319 685.3027       47.63362 717.2016       27.54192 236.7976 8.267361 242.5443 4.659797 -5.746658      9.490150 
1 1 1 -6  17 10 f 55.67552 3.607236 37.94162       4.867780 23.96557       10.79354 41.51002       5.453918 43.41640 10.34874 58.22716 3.865564 -14.81075      11.04713 
1 1 1 -6  17 11 o 115.5828 2.681487 162.8142       7.552749 169.7015       12.79908 159.1347       9.355227 117.8939 4.463097 114.2122 3.364956 3.681641       5.589469 
1 1 1 -6  17 12 o 238.5034 3.608324 693.4214       20.97182 649.1592       32.43093 725.2334       27.49402 230.6100 5.775466 243.8764 4.626286 -13.26637      7.399900 
1 1 1 -6  17 13 o 367.2675 6.501084 1646.319       58.18410 1598.698       70.28628 1750.011       103.7150 361.7609 7.972836 377.8433 11.27665 -16.08240      13.81046 
1 1 1 -6  17 14 o 398.8184 6.972975 1942.375       67.76874 2012.787       121.2859 1910.414       81.71458 404.8391 12.30826 395.3106 8.482521 9.528473       14.94812 
1 1 1 -6  17 15 o 139.9139 4.294211 238.9778       14.62399 231.6644       22.08925 244.6844       19.51251 137.5722 6.608243 141.4769 5.671167 -3.904694      8.708100 
1 1 1 -6  17 16 o 252.1128 4.203680 775.2831       25.82621 803.9566       37.88958 750.4011       35.29577 256.5849 6.059719 247.9108 5.842397 8.674088       8.417470 
1 1 1 -6  17 17 o 229.0658 4.521077 640.2436       25.23703 626.8718       31.22753 665.4221       42.85057 226.5701 5.655864 233.1089 7.553277 -6.538788      9.436143 
1 1 1 -6  17 18 f 195.7279 4.070030 467.4029       19.41272 452.9175       33.51617 474.7157       23.81397 192.2703 7.165834 197.1272 4.961287 -4.856934      8.715707 
1 1 1 -6  17 19 o 81.03571 2.919597 80.17921       5.756058 78.20840       8.696578 81.71567       7.678703 79.91788 4.483458 81.74632 3.865588 -1.828438      5.919811 
1 1 1 -6  17 20 o 168.1071 3.302825 344.7220       13.53031 345.6515       19.66060 343.8857       18.64895 168.1598 4.802679 167.7551 4.566113 0.4046783      6.626848 
1 1 1 -6  17 21 o 293.3299 4.696633 1051.030       33.57214 1007.809       46.74109 1097.090       48.25127 286.8642 6.686309 299.3172 6.615170 -12.45303      9.405701 
1 1 1 -6  17 22 o 58.30862 3.469943 41.63425       4.908204 46.66352       8.961966 39.47943       5.866187 61.45012 6.063665 56.69764 4.277298 4.752480       7.420465 
1 1 1 -6  17 23 o 305.4852 5.588243 1141.927       41.60079 1136.273       51.54295 1152.492       70.46178 304.3745 6.949040 305.5378 9.474968 -1.163300      11.75007 
1 1 1 -6  17 24 o 36.45359 4.024522 16.42763       3.515677 16.83281       5.687100 16.17702       4.472683 36.49015 6.640111 35.98786 5.255033 0.5022850      8.467966 
1 1 1 -6  17 25 f 190.9544 3.552967 445.2318       16.53320 430.3663       23.44846 459.9287       23.31505 187.4536 5.138003 193.8268 4.940154 -6.373260      7.127707 
1 1 1 -6  17 26 f 57.29669 5.021689 40.49174       6.940760 40.49174       6.940760 0.000000       0.000000 57.29669 5.021689 ?        ?        0.000000       5.021689 
1 1 1 -6  17 27 o 12.18533 5.701750 -4.212423      4.223592 -4.592714      4.750025 -2.776373      9.230445 12.99616 6.069861 20.85364 9.221562 -7.857482      11.03995 
1 1 1 -6  17 28 o 183.3754 3.487605 410.8484       15.58492 415.9656       22.62049 406.2245       21.50277 184.1702 5.044938 182.0436 4.851434 2.126526       6.999129 
1 1 1 -6  17 29 o 145.2514 3.187245 257.7155       11.28163 257.5240       16.38576 257.8881       15.55585 144.9194 4.645852 145.0682 4.405436 -0.1487885     6.402485 
1 1 1 -6  17 30 o 74.66985 3.122945 68.23729       5.670037 65.40496       8.391281 70.61698       7.691612 72.88652 4.750263 75.83250 4.178379 -2.945976      6.326440 
1 1 1 -6  17 31 o 95.75256 3.019833 112.1447       7.037624 101.7772       10.09403 121.9512       9.817151 90.98456 4.567218 99.70605 4.048854 -8.721497      6.103499 
1 1 1 -6  17 32 o 82.02398 3.687902 82.53776       7.352655 81.89208       15.22748 82.73407       8.396311 80.74818 7.836980 82.03664 4.214076 -1.288452      8.898129 
1 1 1 -6  17 33 o 44.75458 4.091579 24.77585       4.413048 18.80516       6.285102 30.58182       6.197798 38.33501 6.985195 49.55571 5.210090 -11.22070      8.714240 
1 1 1 -6  17 34 o 72.01613 3.344300 63.67902       5.853068 70.84962       8.442189 57.04192       8.122065 75.72203 4.596711 67.83588 4.947284 7.886147       6.753175 
1 1 1 -6  17 35 o 67.72642 3.344392 56.40409       5.502577 47.13166       7.766596 65.74957       7.797131 61.47162 5.234398 72.89876 4.409754 -11.42714      6.844330 
1 1 1 -6  17 36 o 32.62132 5.271099 13.55529       4.047415 15.96607       5.962040 11.49457       5.512206 34.91261 7.245265 29.51635 7.613589 5.396259       10.51002 
1 1 1 -6  17 37 o 116.5966 3.558345 167.8528       10.09861 173.7062       13.06092 159.1516       15.92410 118.1262 4.545722 112.2884 5.839545 5.837799       7.400262 
1 1 1 -6  17 38 o 67.08907 3.327596 55.72958       5.423268 49.36458       7.676731 62.07118       7.662606 62.46368 5.087287 70.36134 4.492424 -7.897659      6.786926 
1 1 1 -6  17 39 o 15.47010 6.553647 0.6767256      4.275225 2.140613       4.942126 -3.675967      8.521951 17.73674 7.237917 18.43864 8.439005 -0.7019024     11.11774 
1 1 1 -6  17 40 o 29.21592 5.732384 11.41684       3.935396 10.81982       5.332316 12.13105       5.832197 27.68700 7.649596 29.17085 7.976683 -1.483849      11.05187 
1 1 1 -6  17 41 o 45.88812 4.055596 26.95463       4.488507 23.21200       6.240700 30.96544       6.460416 41.11172 6.440515 48.20213 5.604319 -7.090408      8.537482 
1 1 1 -6  17 42 o 23.49315 7.013436 8.088438       4.320355 9.571448       6.644671 7.002317       5.686440 24.85626 8.788566 22.12004 8.090627 2.736229       11.94559 
1 1 1 -6  17 43 o 16.27765 6.472242 2.936713       3.841770 0.3259415      5.229825 5.996853       5.662046 15.47750 6.887321 20.47489 7.941686 -4.997396      10.51216 
1 1 1 -6  17 44 o 16.07299 6.690878 2.603420       4.336413 -1.138462      8.385872 3.969228       5.066381 17.14479 8.026196 17.85056 7.311504 -0.7057610     10.85716 
1 1 1 -6  17 45 o 13.53624 5.976339 0.6256465      3.862246 5.231609       5.562309 -3.662548      5.367007 18.66448 7.654755 12.85530 6.135901 5.809181       9.810431 
1 1 1 -6  17 46 o 14.20704 6.017232 2.055917       3.602675 0.9853435      5.315432 2.965616       4.899812 14.82813 6.739547 15.91550 6.883937 -1.087376      9.633800 
1 1 1 -6  17 47 o 15.39903 6.229864 3.553882       3.624454 6.634228       5.738408 1.509413       4.675004 18.37086 7.675915 14.22834 6.407625 4.142524       9.998866 
1 1 1 -6  17 48 o 13.83224 6.059557 2.137639       3.899854 1.417298       5.905639 2.694672       5.193240 14.52960 6.780111 14.91504 6.731854 -0.3854465     9.554463 
1 1 1 -6  18 1  o 329.1531 4.581294 1320.803       36.74702 1266.834       56.37107 1360.684       48.45819 322.2309 7.178818 334.0230 5.953259 -11.79205      9.326131 
1 1 1 -6  18 2  o 301.2101 5.511994 1106.331       40.45893 1020.817       66.68092 1156.156       50.89882 288.9592 9.482385 307.8562 6.784592 -18.89700      11.65960 
1 1 1 -6  18 3  o 136.6172 2.749976 227.4584       9.155253 217.1509       13.95438 235.2484       12.13119 133.3979 4.298261 138.8811 3.587466 -5.483246      5.598657 
1 1 1 -6  18 4  o 63.29561 3.250852 48.95725       4.997463 41.20801       8.425475 53.16324       6.207247 57.81012 6.071223 65.92748 3.880803 -8.117363      7.205579 
1 1 1 -6  18 5  o 22.52337 5.941193 6.409345       3.307331 4.302026       4.850411 8.240510       4.521443 20.69530 7.486573 25.59648 7.033049 -4.901175      10.27193 
1 1 1 -6  18 6  o 245.0264 3.689863 731.8086       22.03226 705.0773       27.97192 775.4974       35.76000 240.4787 4.773200 252.1628 5.819431 -11.68407      7.526567 
1 1 1 -6  18 7  o 227.3743 3.527626 630.1556       19.54610 600.4008       30.58804 650.6908       25.41103 221.8052 5.663686 231.0225 4.513692 -9.217255      7.242290 
1 1 1 -6  18 8  o 191.8999 3.573894 448.8786       16.71292 391.8153       32.44442 469.4897       19.49904 179.0140 7.453636 196.2444 4.077368 -17.23036      8.495976 
1 1 1 -6  18 9  o 493.2392 8.424388 2971.405       101.2586 3028.850       178.2658 2944.042       123.0338 496.5447 14.74875 490.6742 10.28952 5.870514       17.98332 
1 1 1 -6  18 10 o 163.7472 3.345317 326.8388       13.34896 298.4409       18.61445 356.9056       19.15365 156.3589 4.891319 171.0202 4.600050 -14.66130      6.714571 
1 1 1 -6  18 11 o 515.6130 8.787720 3249.550       110.4171 3499.537       201.8084 3142.738       131.9133 533.0731 15.55181 506.6871 10.68348 26.38593       18.86784 
1 1 1 -6  18 12 o 305.8195 6.926193 1142.053       51.61736 1256.921       77.59527 1050.877       69.13158 320.3059 9.953174 292.8923 9.699107 27.41357       13.89742 
1 1 1 -6  18 13 o 313.0550 4.930007 1195.599       37.61008 1238.912       78.09914 1182.522       42.91388 317.8896 10.09449 311.2772 5.657366 6.612427       11.57172 
1 1 1 -6  18 14 o 144.7184 3.650796 255.5414       12.86472 275.3471       16.95578 228.6731       19.74891 150.1629 4.639169 136.7281 5.941375 13.43477       7.538026 
1 1 1 -6  18 15 o 152.6135 2.851098 283.9363       10.60330 266.8348       16.96867 294.8917       13.58137 147.8036 4.717187 155.5061 3.583933 -7.702469      5.924224 
1 1 1 -6  18 16 o 66.20256 3.142283 53.56085       5.054926 52.42650       7.916389 54.34176       6.568343 65.34399 5.009681 66.61852 4.065346 -1.274529      6.451662 
1 1 1 -6  18 17 o 114.5478 3.412716 160.1730       9.515651 151.9196       12.33155 172.3207       14.96062 111.4723 4.549129 118.6762 5.185604 -7.203987      6.898193 
1 1 1 -6  18 18 o 280.5444 5.225229 961.4614       35.72261 959.8518       44.40517 964.4136       60.13967 280.1107 6.505306 280.1715 8.819465 -0.6079102E-01 10.95910 
1 1 1 -6  18 19 o 164.8861 3.297654 331.6431       13.25029 343.4394       19.64684 321.8009       17.94593 167.6160 4.814948 162.2747 4.542623 5.341278       6.619603 
1 1 1 -6  18 20 o 80.92441 2.965083 79.98058       5.837375 85.92397       8.979427 75.63045       7.682142 83.76655 4.414461 78.60986 4.023615 5.156693       5.973018 
1 1 1 -6  18 21 o 161.7715 4.517157 319.9262       17.79008 0.000000       0.000000 319.9262       17.79008 ?        ?        161.7715 4.517157 0.000000       4.517157 
1 1 1 -6  18 22 o 166.0499 3.312943 336.4590       13.40567 332.3601       19.44866 340.1693       18.50360 164.8244 4.847348 166.7902 4.556766 -1.965775      6.652886 
1 1 1 -6  18 23 o 89.23234 2.935286 97.24906       6.374078 101.5857       9.773828 94.03969       8.408152 91.06812 4.417327 87.66057 3.946164 3.407547       5.923258 
1 1 1 -6  18 24 o 194.4025 3.592652 461.4648       17.01974 445.4979       24.15320 477.2126       23.98677 190.7165 5.201828 197.4337 4.989563 -6.717194      7.207964 
1 1 1 -6  18 25 o 89.11913 3.693738 97.17854       8.004434 111.0729       9.948762 71.67563       13.47857 95.22057 4.298564 75.97484 7.372692 19.24574       8.534298 
1 1 1 -6  18 26 o 143.2062 4.610908 251.2027       16.07008 251.2027       16.07008 0.000000       0.000000 143.2062 4.610908 ?        ?        0.000000       4.610908 
1 1 1 -6  18 27 o 178.2912 3.476785 388.3510       15.10580 383.6926       21.76332 392.6816       20.98366 176.8856 5.054080 179.0000 4.814894 -2.114471      6.980467 
1 1 1 -6  18 28 o 95.79577 3.011436 112.1698       7.021281 107.8136       10.22399 116.0580       9.659238 93.73225 4.489103 97.31612 4.082136 -3.583870      6.067609 
1 1 1 -6  18 29 o 176.4714 3.460822 380.6712       14.88297 405.4822       22.22458 360.4983       20.03994 181.7414 5.022967 171.4117 4.802285 10.32971       6.949255 
1 1 1 -6  18 30 o 151.8095 3.261643 281.7059       12.06623 280.4619       17.48342 282.8373       16.67380 151.1294 4.753152 151.8267 4.511619 -0.6972809     6.553408 
1 1 1 -6  18 31 o 115.0920 3.100749 162.0452       8.688645 165.9389       12.70997 158.6292       11.90472 116.2132 4.496487 113.6604 4.305861 2.552750       6.225659 
1 1 1 -6  18 32 o 103.1230 4.220027 130.6861       10.58250 0.000000       0.000000 130.6861       10.58250 ?        ?        103.1230 4.220027 0.000000       4.220027 
1 1 1 -6  18 33 o 22.61691 6.383046 6.523370       3.670647 5.812155       5.475678 7.103807       4.946692 22.74770 7.983594 23.95340 7.571094 -1.205698      11.00269 
1 1 1 -6  18 34 o 39.38575 4.368923 19.32990       4.122788 18.45145       6.120024 20.05979       5.578533 37.86885 6.885410 39.77364 5.937094 -1.904789      9.091642 
1 1 1 -6  18 35 o 60.06924 3.395762 44.45744       4.950548 42.12375       7.222933 46.52496       6.798584 58.04408 5.160185 61.17893 4.593712 -3.134846      6.908669 
1 1 1 -6  18 36 o 125.5381 3.618294 194.4227       11.05763 188.9483       14.09371 203.1886       17.83408 123.2347 4.701686 127.1412 5.771150 -3.906517      7.443925 
1 1 1 -6  18 37 o 81.52348 3.214482 82.03594       6.373495 84.98586       9.358064 79.48376       8.704362 82.39099 4.680152 79.75340 4.496914 2.637589       6.490459 
1 1 1 -6  18 38 o 41.07576 4.489347 21.38119       4.420624 21.09996       6.377257 21.64131       6.133290 39.85269 6.811084 40.55094 6.420202 -0.6982460     9.360013 
1 1 1 -6  18 39 o 35.17463 5.993786 16.42298       4.953646 13.46939       5.671261 25.92864       10.17410 31.09807 7.558462 41.68837 10.11837 -10.59030      12.62979 
1 1 1 -6  18 40 o 39.04945 4.525314 19.68818       4.226626 22.12013       6.077221 17.40977       5.882251 40.36777 6.390337 35.32013 7.080912 5.047646       9.538118 
1 1 1 -6  18 41 f 17.50730 6.660295 3.521410       3.929402 4.269755       6.248696 3.031933       5.053645 20.09553 8.161674 18.02475 7.332727 2.070780       10.97186 
1 1 1 -6  18 42 o 36.22777 5.088160 17.80309       4.368348 20.40660       6.193121 15.22522       6.162545 37.16586 7.096754 31.12290 8.061548 6.042961       10.74023 
1 1 1 -6  18 43 o 11.27426 5.296269 -2.659770      3.705854 -3.807866      5.113259 -1.389456      5.378536 12.82974 6.085216 14.43462 6.642476 -1.604877      9.008459 
1 1 1 -6  18 44 o 26.04081 7.074491 10.96136       4.605019 3.728591       9.126577 13.43171       5.333776 19.38821 8.819564 28.40184 7.569591 -9.013630      11.62254 
1 1 1 -6  18 45 o 16.38784 6.665926 3.622453       4.175670 7.158156       5.683238 -0.5253933     6.155583 20.06345 7.905268 14.95046 6.958283 5.112985       10.53143 
1 1 1 -6  18 46 o 9.103532 4.471562 -5.141970      3.428571 -7.688517      5.183294 -3.161025      4.571578 10.73519 5.314962 11.66956 5.594929 -0.9343710     7.716998 
1 1 1 -6  18 47 o 15.39439 6.261534 3.654052       3.684196 8.849608       5.697505 -0.7952588E-01 4.829824 20.06212 7.911967 13.24405 6.163914 6.818070       10.02961 
1 1 1 -6  19 1  o 345.3835 5.326421 1454.833       44.83045 1475.671       63.89294 1434.627       62.91796 347.6859 7.541015 342.8173 7.531403 4.868561       10.65781 
1 1 1 -6  19 2  o 80.71072 2.995193 79.50470       5.880824 79.69981       8.040589 79.28029       8.623452 80.75114 4.099457 80.51785 4.411798 0.2332916      6.022418 
1 1 1 -6  19 3  o 119.0421 2.937989 172.7153       8.522892 174.2416       11.89884 171.1070       12.21371 119.4811 4.092708 118.3927 4.240221 1.088432       5.893194 
1 1 1 -6  19 4  o 388.3359 5.883165 1839.603       55.67429 1851.125       78.96462 1828.214       78.50802 389.3246 8.323092 386.9074 8.326661 2.417175       11.77315 
1 1 1 -6  19 5  o 354.8743 5.450608 1536.034       47.13631 1563.026       67.22556 1509.930       66.11005 357.7952 7.710167 351.6652 7.714399 6.130005       10.90682 
1 1 1 -6  19 6  o 497.1595 8.490731 3019.418       102.8672 2821.583       170.6907 3132.249       128.9057 479.1575 14.63541 506.0256 10.45354 -26.86810      17.98532 
1 1 1 -6  19 7  o 428.0696 9.089495 2239.732       94.81787 0.000000       0.000000 2239.732       94.81787 ?        ?        428.0696 9.089495 0.000000       9.089495 
1 1 1 -6  19 8  o 381.7009 8.217389 1780.087       76.43516 0.000000       0.000000 1780.087       76.43516 ?        ?        381.7009 8.217389 0.000000       8.217389 
1 1 1 -6  19 9  o 133.6294 3.602951 217.8574       11.72196 0.000000       0.000000 217.8574       11.72196 ?        ?        133.6294 3.602951 0.000000       3.602951 
1 1 1 -6  19 10 o 238.9395 4.060111 696.1815       23.64079 633.6799       45.85867 718.8034       27.58934 227.5303 8.284602 242.7601 4.663671 -15.22978      9.507074 
1 1 1 -6  19 11 o 156.7180 3.885694 299.4911       14.83964 280.2157       18.09483 339.0847       25.93373 151.4763 4.908483 166.5217 6.402769 -15.04538      8.067754 
1 1 1 -6  19 12 o 475.4361 6.325249 2760.484       73.28345 2757.503       116.0952 2762.459       94.48727 474.3546 10.04326 475.2453 8.158669 -0.8907776     12.93952 
1 1 1 -6  19 13 o 453.4035 6.770638 2512.106       74.80843 2479.914       105.4502 2544.722       106.1434 449.8246 9.619845 455.6813 9.558629 -5.856689      13.56130 
1 1 1 -6  19 14 o 526.5218 6.951466 3389.438       89.19260 3214.018       136.3559 3520.626       117.9182 511.4245 10.94098 535.9850 9.028008 -24.56055      14.18485 
1 1 1 -6  19 15 o 131.4176 2.742685 210.5591       8.783463 206.2417       14.50475 213.0589       11.03725 129.9127 4.588864 132.1287 3.430799 -2.216003      5.729578 
1 1 1 -6  19 16 o 139.0197 2.764947 235.6428       9.366969 269.8566       16.26038 218.6501       11.45937 148.6195 4.494880 133.8392 3.516557 14.78027       5.707024 
1 1 1 -6  19 17 o 83.36958 2.619078 84.82860       5.314386 88.25880       9.301712 83.16629       6.475292 84.90488 4.511866 82.51203 3.226591 2.392853       5.546875 
1 1 1 -6  19 18 o 61.53120 3.230017 46.31002       4.826283 53.92181       7.898225 41.77417       6.096986 66.25610 4.927055 58.33593 4.319516 7.920166       6.552411 
1 1 1 -6  19 19 o 115.3589 3.408541 162.5073       9.571486 171.2275       12.89730 151.8165       14.28037 118.3227 4.481054 111.3194 5.279246 7.003342       6.924614 
1 1 1 -6  19 20 o 248.3031 5.853168 754.4674       35.41679 0.000000       0.000000 754.4674       35.41679 ?        ?        248.3031 5.853168 0.000000       5.853168 
1 1 1 -6  19 21 o 232.4798 4.009174 659.9852       22.71309 671.1979       32.97926 649.8681       31.32673 234.1684 5.779316 230.4535 5.578218 3.714844       8.032248 
1 1 1 -6  19 22 f 154.2463 3.239396 290.3533       12.17629 292.7720       17.89483 288.2680       16.61594 154.6735 4.753257 153.5199 4.446129 1.153625       6.508573 
1 1 1 -6  19 23 o 119.6628 3.042543 174.8503       8.865016 167.2051       13.02542 181.4476       12.09975 116.8532 4.583087 121.7964 4.082440 -4.943275      6.137671 
1 1 1 -6  19 24 o 181.0692 4.155910 400.7316       18.33778 381.7899       21.85002 445.8584       33.72559 176.5291 5.084546 190.2417 7.288225 -13.71262      8.886553 
1 1 1 -6  19 25 o 82.68572 4.636637 83.91853       9.305217 83.91853       9.305217 0.000000       0.000000 82.68572 4.636637 ?        ?        0.000000       4.636637 
1 1 1 -6  19 26 o 39.11741 4.135946 18.91994       3.882949 22.23483       6.269529 16.85720       4.945642 42.08453 6.307379 36.63712 5.726781 5.447411       8.519334 
1 1 1 -6  19 27 o 64.35175 3.148941 50.69622       4.923120 56.12528       7.901471 47.25125       6.294172 67.51319 4.834679 62.00515 4.190182 5.508038       6.397792 
1 1 1 -6  19 28 f 218.7000 3.886687 585.0870       20.71402 582.6111       29.80200 587.4009       28.81122 217.6976 5.622370 218.7295 5.405281 -1.031921      7.799238 
1 1 1 -6  19 29 o 146.8486 3.249148 263.5637       11.62720 268.0933       17.07092 259.6438       15.88027 147.7725 4.746690 145.4820 4.484680 2.290512       6.530193 
1 1 1 -6  19 30 o 82.69604 3.119411 83.71201       6.275006 81.69068       9.357333 85.36383       8.458919 81.44382 4.735162 83.35754 4.177536 -1.913727      6.314552 
1 1 1 -6  19 31 o 134.8711 4.408009 223.4753       14.46817 0.000000       0.000000 223.4753       14.46817 ?        ?        134.8711 4.408009 0.000000       4.408009 
1 1 1 -6  19 32 o 46.93127 3.897615 27.19942       4.417371 28.78078       6.704111 25.98609       5.872397 47.89729 5.866035 45.58434 5.390625 2.312946       7.966756 
1 1 1 -6  19 33 o 47.41669 3.851805 27.78632       4.412438 27.09600       6.621629 28.33768       5.917782 46.35633 6.002429 47.62098 5.182991 -1.264652      7.930482 
1 1 1 -6  19 34 o 56.27570 3.611600 39.06974       4.926722 35.23969       7.189876 42.45994       6.764442 52.94961 5.659823 58.41037 4.794486 -5.460762      7.417593 
1 1 1 -6  19 35 o 71.57461 3.656820 63.26058       6.357067 63.30434       8.530091 63.20592       9.533938 71.21027 4.946326 70.93254 5.559978 0.2777328      7.441740 
1 1 1 -6  19 36 o 30.54213 5.487196 12.04068       3.933899 6.294673       5.804780 16.92120       5.349780 23.12324 8.210649 36.06889 6.316536 -12.94565      10.35922 
1 1 1 -6  19 37 o 16.32416 6.388647 2.250994       3.690289 -2.776393      5.384800 6.703125       5.067367 14.81983 6.754250 22.96696 7.692098 -8.147135      10.23661 
1 1 1 -6  19 38 o 62.56986 3.523190 48.82664       5.350315 44.98258       7.675632 52.45957       7.461871 59.14719 5.384256 64.24181 4.801161 -5.094616      7.213970 
1 1 1 -6  19 39 o 22.03806 7.147264 6.540376       4.387297 6.844404       5.026175 5.567319       8.991881 22.61258 7.661057 23.67818 9.724171 -1.065601      12.37947 
1 1 1 -6  19 40 o 25.66299 6.146078 9.144532       3.792869 6.651448       5.418316 11.53997       5.311143 22.13419 7.924644 28.14812 7.576546 -6.013927      10.96376 
1 1 1 -6  19 41 o 33.72813 5.388515 15.49373       4.279939 18.69278       6.457620 12.98763       5.715578 35.28493 7.724818 29.14361 7.866324 6.141325       11.02506 
1 1 1 -6  19 42 o 12.94060 5.734259 -0.1500477     3.587263 -2.289382      5.156911 1.855735       4.993352 13.78204 6.398932 16.35738 7.010628 -2.575337      9.491851 
1 1 1 -6  19 43 o 17.54763 6.987156 3.968508       4.483573 -6.050337      8.939182 7.336085       5.182600 15.85431 7.657404 21.33128 7.735612 -5.476969      10.88465 
1 1 1 -6  19 44 o 18.78329 7.061771 5.520370       4.387137 4.118045       5.766150 7.448054       6.760512 17.86778 7.591928 20.68354 8.455887 -2.815758      11.36395 
1 1 1 -6  19 45 o 16.64706 6.392167 4.210205       3.641448 10.04311       5.745291 0.2936378      4.707845 22.53048 8.148316 13.90309 6.328297 8.627392       10.31709 
1 1 1 -6  19 46 o 16.74175 6.589625 4.652872       3.945350 1.450318       5.987764 7.110061       5.244882 15.10650 6.972113 19.02978 7.563712 -3.923283      10.28689 
1 1 1 -6  19 47 o 12.17602 5.619228 -0.1483324     3.888516 2.918068       6.040644 -2.318115      5.081324 15.46795 7.088960 12.24643 5.878625 3.221512       9.209321 
1 1 1 -6  20 1  o 12.47003 5.454060 -0.7441046     3.148241 -3.070765      4.395298 1.707257       4.511548 13.26573 6.067369 17.40903 6.982975 -4.143295      9.250670 
1 1 1 -6  20 2  o 203.7506 3.288822 506.0646       16.32960 548.7769       26.56749 480.1309       20.70174 212.1038 5.140035 198.4293 4.281194 13.67448       6.689437 
1 1 1 -6  20 3  o 123.4829 2.716314 185.8484       8.173781 181.7948       12.38486 188.9766       10.87978 122.0313 4.170829 124.4513 3.591196 -2.419945      5.503863 
1 1 1 -6  20 4  o 205.2424 3.292551 513.5080       16.46780 529.6530       26.14130 502.8857       21.20409 208.3721 5.148156 203.0749 4.284769 5.297180       6.697967 
1 1 1 -6  20 5  o 130.7901 2.731132 208.4982       8.704696 207.2732       13.38323 209.3964       11.45994 130.3066 4.220184 131.0061 3.593063 -0.6995087     5.542567 
1 1 1 -6  20 6  o 444.0291 6.638879 2407.292       71.83602 2544.152       148.1795 2365.244       82.13302 454.8451 13.38323 439.9833 7.660295 14.86182       15.42048 
1 1 1 -6  20 7  o 106.9856 2.808389 139.6127       7.315486 135.5890       12.08109 141.9422       9.192375 105.3263 4.718863 107.8432 3.502476 -2.516899      5.876649 
1 1 1 -6  20 8  o 182.0854 4.928465 404.7843       21.84859 0.000000       0.000000 404.7843       21.84859 ?        ?        182.0854 4.928465 0.000000       4.928465 
1 1 1 -6  20 9  o 240.0983 3.673883 702.9289       21.49564 701.4750       34.49229 703.8521       27.48588 239.7069 5.904802 240.1985 4.695731 -0.4916229     7.544307 
1 1 1 -6  20 10 o 217.8483 3.467469 578.6669       18.40784 615.4233       30.49951 557.6059       23.08689 224.5320 5.574149 213.7982 4.431241 10.73375       7.120886 
1 1 1 -6  20 11 o 243.4385 4.767132 723.1522       28.28020 723.2844       49.81070 723.0892       34.35405 242.9341 8.426675 243.3418 5.793288 -0.4077301     10.22600 
1 1 1 -6  20 12 o 255.3395 4.896210 795.7707       30.46592 842.6752       55.47008 775.5099       36.45686 262.1313 8.695715 251.9664 5.937459 10.16495       10.52943 
1 1 1 -6  20 13 o 122.6945 3.609549 183.7710       10.78057 205.5096       20.12079 175.0176       12.76789 129.5060 6.395354 119.6791 4.385303 9.826836       7.754446 
1 1 1 -6  20 14 o 211.3607 3.379726 544.8606       17.40772 526.7166       27.67478 556.7392       22.39231 207.5730 5.475914 213.5866 4.302182 -6.013580      6.963793 
1 1 1 -6  20 15 o 93.60117 3.593600 107.0381       8.181626 99.38068       14.76604 110.4305       9.828242 89.86272 6.793240 95.02452 4.255074 -5.161797      8.015844 
1 1 1 -6  20 16 o 215.1027 3.401610 564.4384       17.83062 568.8027       28.94231 561.7686       22.63666 215.6538 5.511834 214.5139 4.330328 1.139893       7.009427 
1 1 1 -6  20 17 o 74.83026 2.690604 68.37075       4.898416 73.70500       8.871979 66.03160       5.875068 77.53756 4.717723 73.49857 3.288510 4.038994       5.750757 
1 1 1 -6  20 18 o 192.0711 3.194136 450.0465       14.95035 462.9514       24.74317 442.6260       18.76261 194.5384 5.224046 190.4115 4.043561 4.126968       6.606137 
1 1 1 -6  20 19 o 125.8820 4.158270 193.7159       12.73843 0.000000       0.000000 193.7159       12.73843 ?        ?        125.8820 4.158270 0.000000       4.158270 
1 1 1 -6  20 20 f 186.3956 3.556435 424.0779       16.15424 408.6734       23.07168 438.8928       22.62594 182.7244 5.186641 189.4096 4.906077 -6.685211      7.139387 
1 1 1 -6  20 21 o 138.8525 3.167573 235.2768       10.71806 236.1528       15.89505 234.5464       14.51416 138.9040 4.702598 138.4806 4.306209 0.4234467      6.376351 
1 1 1 -6  20 22 o 228.7998 3.993084 639.5310       22.26385 608.6462       31.27251 671.2732       31.70360 222.8160 5.764279 234.1208 5.556898 -11.30479      8.006624 
1 1 1 -6  20 23 f 185.7844 4.234422 421.9221       19.17076 408.0832       22.97252 453.6664       34.79299 182.4951 5.170819 191.8554 7.456057 -9.360291      9.073596 
1 1 1 -6  20 24 o 126.4963 4.571381 196.0228       14.06846 196.0228       14.06846 0.000000       0.000000 126.4963 4.571381 ?        ?        0.000000       4.571381 
1 1 1 -6  20 25 o 92.76649 3.052349 105.1782       6.890800 102.6051       10.54866 107.0935       9.100952 91.42237 4.751182 93.50555 4.003314 -2.083176      6.212910 
1 1 1 -6  20 26 f 143.5264 3.218505 251.6056       11.25699 252.6507       16.71692 250.7385       15.22678 143.5359 4.785940 143.0669 4.372632 0.4689636      6.482679 
1 1 1 -6  20 27 o 169.9404 3.422587 352.9462       14.17383 355.9140       20.82356 350.3842       19.34739 170.2852 5.023623 169.0328 4.701509 1.252426       6.880477 
1 1 1 -6  20 28 o 74.59579 3.203156 68.12402       5.809188 68.37540       8.922321 67.93904       7.653689 74.49084 4.943137 74.36165 4.241216 0.1291885      6.513257 
1 1 1 -6  20 29 o 147.8771 3.254908 267.3612       11.72940 275.7671       17.41885 260.3878       15.86549 149.8134 4.777364 145.6465 4.475412 4.166916       6.546184 
1 1 1 -6  20 30 o 126.5252 4.263125 196.5527       13.12564 0.000000       0.000000 196.5527       13.12564 ?        ?        126.5252 4.263125 0.000000       4.263125 
1 1 1 -6  20 31 o 85.36608 3.675740 89.46497       7.628644 90.70245       15.84572 89.09161       8.703697 84.87827 7.746172 85.08781 4.210673 -0.2095413     8.816629 
1 1 1 -6  20 32 o 56.45750 3.630149 39.25202       4.967920 39.19192       7.685299 39.29516       6.511180 55.98209 5.713479 56.26912 4.794079 -0.2870293     7.458353 
1 1 1 -6  20 33 o 35.23809 4.802836 15.61180       4.017025 17.42270       6.288700 14.36361       5.220994 36.62607 7.302193 33.33361 6.660527 3.292458       9.883554 
1 1 1 -6  20 34 o 39.72211 4.295126 19.71047       4.091566 19.24371       6.025495 20.10985       5.573588 38.60657 6.644270 39.69650 5.944295 -1.089928      8.915210 
1 1 1 -6  20 35 o 16.08927 6.398593 1.866188       3.755546 4.618049       5.492320 -0.5503163     5.146789 21.13832 7.910898 16.06397 7.000720 5.074350       10.56373 
1 1 1 -6  20 36 o 18.19273 6.520811 3.718760       3.669765 12.00849       5.615659 -2.459929      4.848178 29.80555 7.682911 14.16444 6.437354 15.64111       10.02331 
1 1 1 -6  20 37 o 29.11986 5.630307 11.14694       3.850834 13.63018       5.760451 9.140619       5.177825 31.52472 7.589920 25.93289 7.662143 5.591837       10.78496 
1 1 1 -6  20 38 o 45.11911 5.111926 26.32657       5.521665 25.47809       6.437088 28.68963       10.74251 43.80038 6.204253 43.63031 10.27461 0.1700745      12.00252 
1 1 1 -6  20 39 o 30.46676 5.534543 12.44868       3.957772 12.76568       5.622994 12.13745       5.571629 29.73740 7.699488 28.97028 7.743503 0.7671146      10.91989 
1 1 1 -6  20 40 o 14.49883 6.270553 0.4650551      4.064714 -3.763282      6.322223 3.444345       5.306906 14.96586 6.994038 18.57908 7.530399 -3.613221      10.27733 
1 1 1 -6  20 41 o 14.88192 6.206696 1.604322       3.741719 -0.8716548     5.290124 4.083045       5.293056 14.92032 6.758444 18.72396 7.545077 -3.803643      10.12940 
1 1 1 -6  20 42 o 19.97770 6.691533 5.979651       3.834802 9.399703       5.791268 3.309123       5.117477 23.72408 8.217869 17.49469 7.274445 6.229391       10.97501 
1 1 1 -6  20 43 o 18.90805 7.113426 5.428878       4.453174 6.039228       8.502330 5.198151       5.227551 20.37166 8.935096 18.84225 7.530651 1.529411       11.68532 
1 1 1 -6  20 44 o 13.96193 6.034004 1.426158       3.758448 0.7807624      5.517311 1.984966       5.133876 15.14165 6.875867 15.62638 6.895101 -0.4847326     9.737555 
1 1 1 -6  20 45 f 23.05996 6.729867 9.241564       4.015498 11.15482       6.072656 7.755039       5.352768 22.87551 8.361829 19.96853 7.728173 2.906981       11.38617 
1 1 1 -6  20 46 o 13.96539 6.026646 2.142850       3.738463 3.106654       6.065450 1.552402       4.747439 15.86215 7.205525 14.22385 6.426610 1.638299       9.655098 
1 1 1 -6  21 1  o 349.9213 4.848728 1493.882       41.34608 1459.712       64.10648 1518.219       54.10254 345.5648 7.612658 352.6017 6.296471 -7.036804      9.879175 
1 1 1 -6  21 2  o 141.2249 2.810917 243.1192       9.673763 257.0854       15.23331 233.6806       12.52301 145.1178 4.312406 138.3839 3.716896 6.733841       5.693168 
1 1 1 -6  21 3  o 174.6361 3.025536 371.7888       12.87575 338.8635       19.19025 398.7472       17.36446 166.5956 4.731743 180.8246 3.940650 -14.22897      6.157769 
1 1 1 -6  21 4  o 96.03992 2.690725 112.5197       6.291135 106.2785       9.374842 117.6328       8.485505 93.25752 4.135476 98.15717 3.553340 -4.899643      5.452374 
1 1 1 -6  21 5  o 319.9449 7.140835 1250.956       55.67500 0.000000       0.000000 1250.956       55.67500 ?        ?        319.9449 7.140835 0.000000       7.140835 
1 1 1 -6  21 6  o 167.1528 2.983979 340.6168       12.15474 324.3756       18.54330 352.8516       16.09443 162.9889 4.673492 170.0967 3.882787 -7.107834      6.075983 
1 1 1 -6  21 7  o 156.5223 3.284417 298.7123       12.52768 273.2564       24.23379 307.9961       14.63488 149.3985 6.673236 158.9185 3.779014 -9.520050      7.668965 
1 1 1 -6  21 8  o 191.5392 3.649251 447.4097       17.03325 455.7574       24.74208 439.8890       23.48440 193.1546 5.261382 189.7761 5.082683 3.378448       7.315450 
1 1 1 -6  21 9  o 315.2706 4.484015 1212.803       34.44980 1192.790       54.48511 1226.134       44.46624 312.3151 7.158941 316.8524 5.758871 -4.537354      9.187766 
1 1 1 -6  21 10 o 282.6454 4.615973 974.9724       31.79372 990.8793       45.93945 960.3495       44.04649 284.6986 6.621621 280.3025 6.448346 4.396179       9.242674 
1 1 1 -6  21 11 o 202.9183 3.712942 502.2704       18.36012 498.3985       26.50358 505.8430       25.45822 201.9375 5.390637 203.4695 5.138546 -1.532059      7.447391 
1 1 1 -6  21 12 o 230.8211 4.001743 650.0833       22.50924 646.9509       45.78211 651.0819       25.84930 229.6052 8.195493 230.9468 4.593047 -1.341537      9.394795 
1 1 1 -6  21 13 o 395.9735 6.030484 1917.052       58.19080 1918.151       82.86510 1915.982       81.73499 395.3849 8.600337 395.1975 8.487069 0.1874695      12.08289 
1 1 1 -6  21 14 o 244.2003 3.707258 727.6219       22.06150 747.7453       36.02005 715.5412       27.90874 247.2780 5.977543 242.0583 4.731339 5.219650       7.623424 
1 1 1 -6  21 15 o 226.3015 3.536906 624.8436       19.50505 604.8721       30.99686 637.9357       25.09671 222.3382 5.725707 228.5634 4.505822 -6.225204      7.286025 
1 1 1 -6  21 16 o 185.5548 3.161662 420.0018       14.29631 407.5197       22.91114 427.9608       18.29499 182.5303 5.155977 187.2391 4.009585 -4.708832      6.531529 
1 1 1 -6  21 17 o 283.8293 4.125486 983.6264       28.53438 1022.522       46.86793 960.7175       35.96902 288.9023 6.657156 280.3202 5.265482 8.582062       8.487816 
1 1 1 -6  21 18 o 226.8400 3.921758 628.2416       21.67886 622.4890       44.09077 630.0758       24.89614 224.9254 8.057034 227.0982 4.498651 -2.172745      9.227874 
1 1 1 -6  21 19 o 291.1328 4.671669 1035.982       33.14357 1064.107       67.96509 1027.207       37.96357 293.4646 9.516312 289.7497 5.376604 3.714935       10.93014 
1 1 1 -6  21 20 o 97.96008 3.055372 117.2075       7.284804 125.3276       11.39523 111.5952       9.473460 101.1451 4.635521 95.49157 4.080467 5.653519       6.175619 
1 1 1 -6  21 21 o 221.2653 3.926210 598.0775       21.17010 624.6823       31.35104 575.7785       28.70211 225.7384 5.703722 216.7769 5.437604 8.961502       7.880355 
1 1 1 -6  21 22 o 93.98254 4.732925 108.3318       10.80470 108.3318       10.80470 0.000000       0.000000 93.98254 4.732925 ?        ?        0.000000       4.732925 
1 1 1 -6  21 23 o 138.4388 4.767141 234.8412       16.05844 234.8412       16.05844 0.000000       0.000000 138.4388 4.767141 ?        ?        0.000000       4.767141 
1 1 1 -6  21 24 o 117.3643 3.098490 168.2961       8.854057 169.4030       13.40930 167.4404       11.78955 117.5421 4.690833 116.9387 4.143715 0.6033630      6.258936 
1 1 1 -6  21 25 o 75.01271 3.122382 68.83437       5.695166 70.90095       9.069709 67.48906       7.317746 75.91080 4.929567 74.17181 4.064107 1.738991       6.388865 
1 1 1 -6  21 26 o 188.6809 3.612180 435.2188       16.60862 426.5234       24.01628 443.1892       22.99337 186.3581 5.293728 190.0557 4.968877 -3.697571      7.260393 
1 1 1 -6  21 27 o 146.0500 3.256419 260.6806       11.58985 263.2834       17.29331 258.5581       15.61581 146.4317 4.852965 145.2058 4.418244 1.225876       6.562938 
1 1 1 -6  21 28 o 232.3138 4.085113 661.0933       23.12678 697.7927       34.42471 630.9054       31.22178 237.9754 5.936112 226.3973 5.659140 11.57816       8.201420 
1 1 1 -6  21 29 o 91.79753 3.113958 103.1442       6.955858 111.7421       10.86981 97.18159       9.051949 95.28186 4.695864 88.93621 4.188410 6.345650       6.292370 
1 1 1 -6  21 30 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -6  21 31 o 73.56658 3.242005 66.40477       5.797790 60.36794       8.759460 71.11148       7.734492 69.74958 5.190680 75.95971 4.194710 -6.210129      6.673736 
1 1 1 -6  21 32 o 52.94622 3.735426 34.60079       4.788667 26.07960       7.378919 40.80066       6.294107 45.16272 6.925225 57.35075 4.540619 -12.18803      8.281060 
1 1 1 -6  21 33 o 95.54390 3.114445 112.1162       7.241674 102.2987       10.58479 120.7551       9.929165 90.76158 4.802783 98.86678 4.130322 -8.105202      6.334531 
1 1 1 -6  21 34 o 36.61343 5.122161 17.01660       4.445265 22.78210       6.579200 12.17384       6.029779 41.96074 6.656134 30.20292 8.047748 11.75782       10.44368 
1 1 1 -6  21 35 o 64.72134 3.421356 51.84331       5.376955 55.28955       8.224031 49.27025       7.106184 66.21374 5.136991 62.66462 4.687445 3.549114       6.954194 
1 1 1 -6  21 36 o 22.88771 6.416944 6.959716       3.722540 7.281443       5.601937 6.705313       4.981452 23.82232 8.087788 22.85856 7.626076 0.9637623      11.11617 
1 1 1 -6  21 37 o 48.34330 3.903059 29.42053       4.559030 29.55811       6.794188 29.30786       6.148885 47.44973 6.010455 47.56988 5.399722 -0.1201515     8.079763 
1 1 1 -6  21 38 f 61.93759 4.382061 48.96236       6.571370 50.82613       7.858368 44.62859       11.98313 62.54016 5.203383 55.11683 9.249060 7.423328       10.61227 
1 1 1 -6  21 39 f 21.00351 7.037840 6.072138       4.241952 6.300515       6.948139 5.936434       5.355976 22.35524 8.761137 21.24189 7.838107 1.113354       11.75557 
1 1 1 -6  21 40 o 23.98344 6.680444 8.413078       4.048635 5.385420       5.417511 12.24297       6.093118 20.23162 7.789428 27.82198 8.334445 -7.590363      11.40781 
1 1 1 -6  21 41 o 25.17620 6.480068 9.464618       3.998926 5.223021       5.573091 13.96617       5.741333 19.64560 7.800565 29.50554 7.848786 -9.859945      11.06581 
1 1 1 -6  21 42 o 10.74640 5.103981 -3.188466      3.621150 -2.406858      5.399996 -3.827143      4.881349 13.76719 6.443604 12.38949 5.896206 1.377704       8.734144 
1 1 1 -6  21 43 o 21.09137 8.020156 7.859768       5.696177 12.19761       9.374487 5.320787       7.172005 23.45631 9.806560 19.14625 8.304776 4.310059       12.85060 
1 1 1 -6  21 44 o 19.29529 6.493652 6.187280       3.611019 8.150296       5.400304 4.599773       4.856396 20.74887 7.827462 17.33258 7.135235 3.416294       10.59154 
1 1 1 -6  21 45 o 13.57556 5.940326 1.547842       3.738428 5.624353       6.057753 -0.9597007     4.751070 17.72865 7.661191 12.86666 6.029179 4.861991       9.749095 
1 1 1 -6  21 46 o 10.88252 5.187742 -2.215792      3.811386 -4.265646      5.645911 -0.4994726     5.166204 12.05786 5.883501 13.20633 6.219274 -1.148470      8.561247 
1 1 1 -6  22 1  o 299.0478 4.777830 1091.429       34.81828 1064.537       48.29148 1120.544       50.24773 295.1062 6.715155 302.7558 6.810640 -7.649567      9.564420 
1 1 1 -6  22 2  o 139.6402 2.816269 237.7237       9.583426 228.5793       14.46586 244.8761       12.79369 136.8063 4.344634 141.6476 3.709576 -4.841339      5.712863 
1 1 1 -6  22 3  o 138.4375 2.814045 233.6465       9.493377 233.8774       14.65330 233.4795       12.46252 138.3833 4.350662 138.3101 3.700892 0.7325745E-01  5.711818 
1 1 1 -6  22 4  o 313.1816 4.968877 1197.228       37.92194 1148.904       73.36166 1214.848       44.29952 305.8383 9.856180 315.3802 5.764059 -9.541962      11.41791 
1 1 1 -6  22 5  o 198.2850 3.261667 479.4346       15.76034 447.7745       23.78463 504.2171       21.04326 191.4491 5.102633 203.2893 4.247785 -11.84019      6.639318 
1 1 1 -6  22 6  o 260.8610 3.874040 830.0881       24.62688 853.2530       39.29651 815.1060       31.60268 264.2509 6.102411 258.3954 5.018836 5.855438       7.901148 
1 1 1 -6  22 7  o 66.93906 3.175565 54.76314       5.165312 51.82489       6.811333 58.73975       7.923982 65.02642 4.322939 69.21050 4.726610 -4.184082      6.405361 
1 1 1 -6  22 8  o 212.3387 4.404187 550.2586       22.78930 596.2591       41.55202 530.4690       27.25400 220.5300 7.743958 208.3346 5.372734 12.19537       9.425241 
1 1 1 -6  22 9  o 212.4801 3.855699 550.8182       19.96445 543.3835       28.58433 557.8993       27.89624 210.8193 5.568805 213.6449 5.362416 -2.825516      7.730918 
1 1 1 -6  22 10 o 306.0191 4.915511 1143.600       36.65670 1137.747       52.11671 1149.330       51.56843 304.8824 7.014690 306.4520 6.905345 -1.569611      9.843255 
1 1 1 -6  22 11 o 223.7184 3.529185 610.5731       19.24032 644.7263       31.92280 591.0884       24.11197 229.6654 5.703866 220.0365 4.496782 9.628952       7.263273 
1 1 1 -6  22 12 o 201.5687 3.694451 495.7509       18.14717 434.2501       34.83584 518.6564       21.25965 188.0711 7.616711 206.1274 4.232377 -18.05626      8.713628 
1 1 1 -6  22 13 o 367.6725 5.668025 1652.897       50.78424 1614.675       100.8352 1665.887       58.78378 361.2786 11.46791 368.9016 6.538993 -7.622955      13.20119 
1 1 1 -6  22 14 o 195.5957 3.639777 466.8550       17.34883 479.2305       25.61882 456.3727       23.57795 197.9310 5.316216 193.1921 5.012423 4.738937       7.306609 
1 1 1 -6  22 15 o 235.7524 3.639726 678.2880       20.91033 683.6030       33.89654 675.0228       26.56793 236.3691 5.884758 235.0669 4.637993 1.302155       7.492754 
1 1 1 -6  22 16 o 68.17086 3.213586 56.82476       5.323541 54.44115       12.58788 57.34393       5.874760 66.10851 7.974667 68.45718 3.533517 -2.348671      8.722445 
1 1 1 -6  22 17 o 323.0940 4.584832 1275.634       36.09844 1344.281       59.94134 1236.569       45.21784 330.8925 7.433674 317.8218 5.838349 13.07065       9.452292 
1 1 1 -6  22 18 o 209.2775 3.736370 534.7533       19.05498 586.5164       40.94950 520.4473       21.52769 218.3032 7.709651 206.3923 4.280238 11.91093       8.818114 
1 1 1 -6  22 19 o 60.94726 2.922335 45.42531       4.327659 47.99867       8.009250 44.36419       5.143087 62.40063 5.317659 60.17923 3.522444 2.221394       6.378488 
1 1 1 -6  22 20 f 112.0450 2.724632 153.1608       7.439370 151.7849       12.62409 153.8929       9.208114 111.3064 4.664527 112.2240 3.370867 -0.9175949     5.755046 
1 1 1 -6  22 21 o 45.35482 4.239350 25.36473       4.631245 16.30232       6.835768 33.05381       6.296550 35.67175 8.054904 51.71844 5.060681 -16.04669      9.512727 
1 1 1 -6  22 22 o 89.59138 4.882646 98.55230       10.61972 98.55230       10.61972 0.000000       0.000000 89.59138 4.882646 ?        ?        0.000000       4.882646 
1 1 1 -6  22 23 o 91.20418 3.476594 101.7639       7.712744 108.9603       10.97462 94.74095       10.84153 94.21101 4.796041 87.78876 5.089578 6.422256       6.993269 
1 1 1 -6  22 24 f 111.7874 3.130380 152.7283       8.519191 161.5971       13.29503 146.5499       11.09668 114.7631 4.764271 109.3707 4.171121 5.392426       6.332182 
1 1 1 -6  22 25 o 37.31077 4.517080 17.29517       4.023507 15.90792       7.128417 17.94376       4.874145 35.12719 8.434212 37.85590 5.439600 -2.728710      10.03619 
1 1 1 -6  22 26 o 33.30339 5.115067 13.92185       4.018692 18.80164       6.947316 11.46795       4.926581 38.30493 7.709791 29.89364 6.902369 8.411287       10.34812 
1 1 1 -6  22 27 o 144.3963 3.278395 254.9136       11.53595 254.2873       17.26050 255.4192       15.50838 143.8287 4.931907 144.2741 4.416249 -0.4454041     6.620194 
1 1 1 -6  22 28 o 27.70155 5.704199 9.795445       3.722335 13.97608       6.745697 7.965162       4.463388 32.84765 8.396307 25.00675 7.032051 7.840900       10.95206 
1 1 1 -6  22 29 o 63.45750 4.464180 49.69941       6.859314 0.000000       0.000000 49.69941       6.859314 ?        ?        63.45750 4.464180 0.000000       4.464180 
1 1 1 -6  22 30 o 121.9650 3.180679 182.2380       9.445403 198.7472       14.72968 170.7083       12.30940 126.9492 4.769802 117.7764 4.296065 9.172798       6.419282 
1 1 1 -6  22 31 f 27.46012 5.934373 9.716808       3.855071 9.554819       6.522760 9.803766       4.779065 27.51026 8.693767 27.46740 7.091340 0.4286194E-01  11.21912 
1 1 1 -6  22 32 o 24.46343 6.179245 7.767755       3.684225 11.90869       6.048258 5.324809       4.645558 30.07168 8.081268 21.36457 7.362098 8.707102       10.93194 
1 1 1 -6  22 33 o 52.41633 4.187271 34.18649       5.304082 33.72786       7.662286 34.60847       7.349685 51.42122 6.242474 52.22664 5.876726 -0.8054199     8.573470 
1 1 1 -6  22 34 o 44.15885 4.147843 24.39091       4.411247 23.42866       6.868333 25.06652       5.755143 42.33831 6.894033 44.37164 5.435896 -2.033329      8.779331 
1 1 1 -6  22 35 o 45.22068 4.067981 25.65492       4.434965 28.32322       7.072831 23.92602       5.693260 46.60099 6.396815 43.13127 5.544794 3.469727       8.465459 
1 1 1 -6  22 36 o 47.59063 3.887232 28.46342       4.468907 23.82838       6.742023 32.09582       5.968429 42.22539 6.781644 50.09610 4.953784 -7.870716      8.398254 
1 1 1 -6  22 37 o 36.51331 5.869776 17.74328       5.045887 19.91880       6.105946 13.05773       8.960913 38.20922 6.807281 29.62233 10.22415 8.586899       12.28301 
1 1 1 -6  22 38 o 29.83481 5.750787 12.09305       4.029480 15.22182       6.162738 9.756581       5.325576 32.23565 7.906292 25.89255 7.799890 6.343100       11.10620 
1 1 1 -6  22 39 o 15.64969 6.326124 2.172355       3.733909 1.595750       5.701436 2.605394       4.940931 17.32530 7.459275 17.37951 7.180037 -0.5420303E-01 10.35344 
1 1 1 -6  22 40 o 40.08698 4.695894 21.55952       4.500459 25.08439       6.797087 18.80794       6.005405 41.11740 7.036422 35.32330 7.220603 5.794094       10.08208 
1 1 1 -6  22 41 o 13.03662 5.757905 0.1004328      3.588273 -2.933220      5.692262 2.100850       4.622344 13.96342 6.560947 15.99634 6.797083 -2.032912      9.447030 
1 1 1 -6  22 42 o 22.67559 8.014884 8.989784       5.525899 8.829217       8.378034 9.113422       7.351758 21.96117 9.231907 22.25442 8.918295 -0.2932491     12.83605 
1 1 1 -6  22 43 o 19.99166 6.859667 6.701975       4.031788 8.114644       5.900032 5.464394       5.522311 20.84476 8.100832 18.48094 7.608426 2.363815       11.11358 
1 1 1 -6  22 44 o 13.22505 5.915363 0.7623560      3.910101 3.897209       5.848410 -1.771527      5.258023 16.74658 7.375542 13.09249 6.198330 3.654083       9.634206 
1 1 1 -6  22 45 o 14.22489 6.138341 2.324645       3.877963 2.875811       5.987651 1.926403       5.089663 15.70129 7.142902 14.68777 6.643486 1.013519       9.754842 
1 1 1 -6  23 1  o 80.95296 2.786690 79.99919       5.489206 74.54842       7.980196 84.89423       7.562458 78.04494 4.211575 83.33600 3.733346 -5.291054      5.628076 
1 1 1 -6  23 2  o 204.4012 4.349959 509.9213       21.66730 0.000000       0.000000 509.9213       21.66730 ?        ?        204.4012 4.349959 0.000000       4.349959 
1 1 1 -6  23 3  o 42.34314 4.616569 22.14588       4.686574 11.87300       7.305572 29.32996       6.109332 30.86446 9.096629 48.72616 5.226710 -17.86170      10.49129 
1 1 1 -6  23 4  o 72.97527 2.817007 65.02995       5.000154 61.84659       7.442392 67.64906       6.750676 71.05488 4.318552 74.37199 3.736761 -3.317116      5.710803 
1 1 1 -6  23 5  o 241.7999 4.152208 713.5185       24.46647 639.3699       45.78222 743.1604       28.94669 228.2153 8.245752 246.7042 4.814888 -18.48889      9.548591 
1 1 1 -6  23 6  o 310.5817 4.942184 1178.021       37.40510 1106.789       50.61887 1263.706       55.51746 300.7173 6.907454 321.2897 7.090823 -20.57245      9.899126 
1 1 1 -6  23 7  o 134.5930 2.815962 220.8937       9.236032 245.2956       14.72981 205.0837       11.85634 141.6981 4.270638 129.5941 3.758274 12.10406       5.688846 
1 1 1 -6  23 8  o 232.8464 4.067825 661.7002       23.08171 602.2372       43.80668 684.5529       27.15726 221.4457 8.131583 236.7670 4.706831 -15.32124      9.395578 
1 1 1 -6  23 9  o 261.8277 5.043385 837.4838       32.17909 856.0713       56.84692 828.7195       39.03524 263.8541 8.853653 260.2874 6.154142 3.566711       10.78242 
1 1 1 -6  23 10 o 238.0653 4.136699 691.8237       23.99861 663.4271       33.68477 721.0947       34.19941 232.8266 5.941825 242.8376 5.779183 -10.01100      8.288802 
1 1 1 -6  23 11 o 150.3469 2.962678 275.6885       10.85463 264.8811       17.53707 282.4001       13.82002 147.1654 4.896890 152.1227 3.728024 -4.957214      6.154485 
1 1 1 -6  23 12 o 248.0731 3.786590 751.0818       22.89096 729.3292       36.28883 765.4576       29.50072 244.1314 6.099767 250.3048 4.836457 -6.173401      7.784502 
1 1 1 -6  23 13 o 252.7966 3.828462 780.0486       23.58477 783.2055       37.96756 778.0650       30.09542 252.9505 6.159438 252.3326 4.894304 0.6178589      7.867203 
1 1 1 -6  23 14 o 98.69856 2.771690 118.9038       6.659801 122.2264       11.34799 117.1582       8.225221 99.90870 4.673958 97.92287 3.452290 1.985832       5.810697 
1 1 1 -6  23 15 o 232.9824 4.627649 663.3173       26.27360 0.000000       0.000000 663.3173       26.27360 ?        ?        232.9824 4.627649 0.000000       4.627649 
1 1 1 -6  23 16 o 134.4771 2.851527 220.6060       9.344628 212.5517       15.46228 225.2405       11.72889 131.7670 4.823525 135.7923 3.547463 -4.025299      5.987561 
1 1 1 -6  23 17 o 300.8916 4.827393 1107.111       35.39637 1114.324       71.88954 1104.803       40.66748 300.0155 9.846336 300.4026 5.555301 -0.3870850     11.30538 
1 1 1 -6  23 18 o 30.86516 4.879019 11.93535       3.547928 5.202787       6.226823 15.17179       4.317284 23.00754 8.457932 34.82406 5.250446 -11.81652      9.955089 
1 1 1 -6  23 19 o 191.1151 3.694767 446.1137       17.20752 447.2495       24.74163 445.0497       23.94799 191.0382 5.319797 190.5997 5.160722 0.4384918      7.411699 
1 1 1 -6  23 20 o 96.43729 3.218215 113.6657       7.552442 103.1605       10.84105 123.5718       10.52739 91.68023 4.869903 100.4377 4.311221 -8.757446      6.504044 
1 1 1 -6  23 21 o 116.3569 2.759261 165.2210       7.823863 169.2408       13.46654 163.1728       9.612643 117.4961 4.712794 115.5354 3.417979 1.960693       5.821771 
1 1 1 -6  23 22 o 51.71368 3.407356 32.80841       4.270044 34.00734       7.498480 32.23306       5.194558 52.29136 5.992604 51.16441 4.203272 1.126949       7.319754 
1 1 1 -6  23 23 o 62.46062 3.487229 47.81836       5.286828 42.78782       8.528391 50.95808       6.737613 58.70560 6.047887 64.38651 4.319112 -5.680912      7.431801 
1 1 1 -6  23 24 o 120.6727 3.219862 178.0271       9.460065 168.7077       14.09550 185.6654       12.76094 117.1993 4.946488 123.0823 4.260951 -5.882973      6.528663 
1 1 1 -6  23 25 o 105.9354 3.170716 137.2487       8.176085 142.2510       12.71519 133.7224       10.67580 107.5826 4.862605 104.4164 4.204211 3.166191       6.428088 
1 1 1 -6  23 26 o 48.24027 3.857044 28.66707       4.496455 27.42138       7.596429 29.33890       5.578736 46.61237 6.895406 48.66862 4.764803 -2.056255      8.381525 
1 1 1 -6  23 27 o 109.8936 3.175153 147.7847       8.494107 155.7000       13.38934 142.4536       10.98834 112.4704 4.896964 107.7178 4.194108 4.752678       6.447542 
1 1 1 -6  23 28 f 38.44728 5.479221 18.58059       4.988485 0.000000       0.000000 18.58059       4.988485 ?        ?        38.44728 5.479221 0.000000       5.479221 
1 1 1 -6  23 29 o 124.5954 3.228944 190.1992       9.795635 166.4774       14.31447 211.0916       13.43369 116.0864 5.072327 131.0147 4.213124 -14.92825      6.593854 
1 1 1 -6  23 30 o 67.08579 3.392339 55.32431       5.527822 59.08385       9.028392 53.06978       6.991508 68.87337 5.422985 65.50149 4.405721 3.371880       6.987070 
1 1 1 -6  23 31 f 61.52163 3.507195 46.64499       5.236256 52.30444       8.578521 43.28428       6.610601 64.64689 5.497483 59.00412 4.634685 5.642765       7.190453 
1 1 1 -6  23 32 o 43.26192 4.696160 23.47925       4.871581 28.91589       7.634020 19.74440       6.327388 47.38459 6.806284 38.96929 6.916236 8.415295       9.703599 
1 1 1 -6  23 33 o 76.11506 3.249412 71.47549       6.013274 85.31835       9.829147 63.19546       7.601847 82.53675 4.909065 71.18983 4.403481 11.34692       6.594662 
1 1 1 -6  23 34 o 55.13760 3.690605 37.84316       4.930302 38.08627       7.716251 37.67544       6.409250 54.43618 5.911586 54.59281 4.868690 -0.1566277     7.658393 
1 1 1 -6  23 35 o 58.80978 3.619886 43.16671       5.162630 42.54445       8.036322 43.60396       6.736564 57.31872 5.834652 58.60890 4.757581 -1.290184      7.528462 
1 1 1 -6  23 36 o 69.19777 3.417663 59.82139       5.745285 54.31155       8.348118 64.77931       7.918977 64.78818 5.334803 71.32520 4.580275 -6.537025      7.031290 
1 1 1 -6  23 37 o 18.80830 7.341018 3.757642       4.861764 0.2392858      5.628564 14.09611       9.648413 16.65470 7.288283 29.87657 10.58780 -13.22187      12.85382 
1 1 1 -6  23 38 o 54.50543 4.309144 38.46245       5.677034 36.36441       9.952018 39.47447       6.911926 48.97868 8.654555 54.44215 5.275936 -5.463478      10.13592 
1 1 1 -6  23 39 o 13.97777 6.065546 0.5017291      3.829211 0.3283688      5.913706 0.6268929      5.024863 16.41742 7.313556 15.63245 6.862337 0.7849779      10.02895 
1 1 1 -6  23 40 o 28.23517 6.203906 11.71641       4.151852 6.236470       6.007285 16.72778       5.744721 20.61992 8.126595 32.79259 7.368886 -12.17268      10.97005 
1 1 1 -6  23 41 o 39.02724 5.009478 21.24912       4.654538 24.61495       7.024802 18.61503       6.214456 39.00075 7.664814 33.66207 7.737937 5.338680       10.89151 
1 1 1 -6  23 42 o 15.55785 6.714078 2.237646       4.640261 -1.817889      8.841822 3.779223       5.451303 16.48506 7.870382 17.30139 7.367589 -0.8163338     10.78074 
1 1 1 -6  23 43 o 20.53447 6.938836 7.399087       4.123074 11.25824       6.160794 4.268446       5.548904 23.23969 8.433189 17.15172 7.371352 6.087965       11.20069 
1 1 1 -6  23 44 o 21.07846 6.858791 8.089149       4.038433 5.434666       6.035440 10.24109       5.434175 17.57294 7.620378 22.14849 7.935474 -4.575552      11.00191 
1 1 1 -6  23 45 o 19.11453 6.754157 6.871054       3.923959 1.755633       5.779498 11.24561       5.344613 14.80770 6.839749 22.76471 7.894129 -7.957006      10.44507 
1 1 1 -6  24 1  o 67.51219 3.311356 55.73276       5.431218 71.87792       10.54431 49.90237       6.336450 76.46544 5.699699 63.80972 4.096599 12.65572       7.019166 
1 1 1 -6  24 2  o 89.50094 2.755716 97.77263       6.003167 93.48277       8.823487 101.4697       8.191245 87.41451 4.153986 91.11690 3.696728 -3.702393      5.560701 
1 1 1 -6  24 3  o 52.04858 3.200601 33.16836       4.039905 30.65662       5.794793 35.54359       5.635128 49.86768 4.828867 53.78388 4.336204 -3.916199      6.490040 
1 1 1 -6  24 4  o 230.7339 4.003683 649.7778       22.51164 668.9595       32.08529 631.1802       31.59296 233.9215 5.628590 227.1379 5.712279 6.783646       8.019423 
1 1 1 -6  24 5  o 93.76619 2.774171 107.3088       6.331955 97.32916       9.255455 116.0892       8.681545 89.18679 4.270956 97.47126 3.661484 -8.284470      5.625614 
1 1 1 -6  24 6  o 94.66520 3.019543 109.4100       6.956837 95.67960       9.098509 128.7355       10.79433 88.42806 4.234557 102.5939 4.327272 -14.16587      6.054482 
1 1 1 -6  24 7  o 224.3773 3.943389 614.4836       21.56178 648.7995       31.11613 582.7854       29.90580 230.3645 5.542861 218.2475 5.627721 12.11696       7.899023 
1 1 1 -6  24 8  o 140.3693 3.745153 240.6283       12.79940 279.5332       23.52471 224.2685       15.25498 150.9810 6.408476 135.4265 4.629253 15.55449       7.905602 
1 1 1 -6  24 9  o 90.37774 3.157007 99.76096       6.942338 121.7309       14.72862 93.48571       7.871611 99.55341 6.100429 87.44526 3.702330 12.10815       7.135999 
1 1 1 -6  24 10 o 140.4061 2.933954 240.4518       10.03865 230.9225       16.17026 246.4274       12.80503 137.3892 4.837338 142.0485 3.702357 -4.659302      6.091576 
1 1 1 -6  24 11 o 196.3605 3.314665 470.4456       15.86098 484.5161       26.08071 462.1874       19.98051 198.9803 5.383595 194.5473 4.214492 4.433060       6.837035 
1 1 1 -6  24 12 o 208.5109 3.418549 530.5531       17.37028 536.4843       28.29250 526.9648       22.00602 209.3386 5.550976 207.7065 4.347657 1.632050       7.050919 
1 1 1 -6  24 13 o 120.2219 2.840024 176.3025       8.320355 177.6428       14.09439 175.5856       10.30817 120.4573 4.811177 119.8889 3.532159 0.5684052      5.968548 
1 1 1 -6  24 14 o 284.3241 4.652727 988.1038       32.23720 991.2826       65.81692 987.1005       36.97630 283.1979 9.550657 284.0374 5.342098 -0.8395386     10.94317 
1 1 1 -6  24 15 o 196.1114 3.673657 469.5813       17.55648 526.5849       38.58624 454.6997       19.71542 206.8186 7.669370 192.9184 4.193690 13.90019       8.741069 
1 1 1 -6  24 16 o 256.5352 5.052328 805.1962       31.58454 815.8407       55.76085 800.1676       38.32560 256.9539 8.918605 255.4768 6.156040 1.477158       10.83690 
1 1 1 -6  24 17 o 189.9277 3.726782 440.5800       17.24878 432.6075       24.66886 448.2063       24.12708 187.8790 5.393671 191.2817 5.180782 -3.402695      7.478783 
1 1 1 -6  24 18 o 50.75377 4.144050 31.69313       5.080841 33.21832       8.039461 30.67884       6.556107 51.60983 6.538870 49.74241 5.500352 1.867416       8.544630 
1 1 1 -6  24 19 o 236.5798 3.683254 683.7738       21.23467 723.2258       35.58998 661.9661       26.46054 242.7740 6.015744 232.5900 4.668437 10.18401       7.614688 
1 1 1 -6  24 20 o 104.6105 2.792123 133.6510       7.111439 145.0587       12.62529 128.3497       8.606643 108.7485 4.775758 102.4493 3.452307 6.299156       5.892901 
1 1 1 -6  24 21 o 45.30352 3.860386 25.27069       4.221296 20.89229       7.457966 27.33462       5.120463 40.46622 7.846212 47.04352 4.522204 -6.577297      9.056123 
1 1 1 -6  24 22 o 180.0082 3.169648 395.7689       13.90399 394.0755       23.04020 396.7389       17.43691 179.1618 5.282984 180.1043 3.972915 -0.9425354     6.610141 
1 1 1 -6  24 23 o 92.51516 2.777822 104.5916       6.255489 98.86862       10.89977 107.4024       7.638722 89.64853 5.009202 93.68968 3.351143 -4.041153      6.026796 
1 1 1 -6  24 24 o 55.10846 3.156115 37.23012       4.220726 47.57954       8.326169 33.65085       4.896484 61.96983 5.572983 52.29900 3.869383 9.670822       6.784561 
1 1 1 -6  24 25 o 116.6126 3.202513 166.3543       9.092031 168.6265       14.01333 164.7024       11.94830 117.0903 4.922141 115.8578 4.239136 1.232460       6.495979 
1 1 1 -6  24 26 o 65.10310 3.907617 52.10283       6.170867 49.20530       9.212901 54.46055       8.310540 62.85811 6.090729 66.34789 5.181089 -3.489773      7.996291 
1 1 1 -6  24 27 o 34.26744 6.013144 14.92448       4.838289 0.000000       0.000000 14.92448       4.838289 ?        ?        34.26744 6.013144 0.000000       6.013144 
1 1 1 -6  24 28 o 125.0350 3.272831 191.5727       9.963633 179.7251       15.03511 200.8498       13.30448 120.6063 5.127343 127.7743 4.278894 -7.167961      6.678217 
1 1 1 -6  24 29 f 15.97203 6.229055 1.991663       3.498223 5.371794       6.676586 0.7125797      4.107117 23.27814 8.720030 15.58307 6.501182 7.695072       10.87678 
1 1 1 -6  24 30 o 49.41156 3.873132 30.22333       4.626415 21.59899       7.640349 35.21621       5.813344 40.61230 8.004764 53.21574 4.525698 -12.60344      9.195552 
1 1 1 -6  24 31 o 129.0906 3.303882 204.9953       10.38480 217.2235       15.94540 195.9882       13.68504 132.1059 4.961919 125.7231 4.473916 6.382751       6.681060 
1 1 1 -6  24 32 o 18.21171 6.455463 3.738615       3.586913 9.614610       6.169290 0.7379147      4.408651 27.06203 8.441317 15.94399 6.699328 11.11803       10.77668 
1 1 1 -6  24 33 o 34.91237 4.913744 15.56267       4.064986 14.52431       6.776040 16.14646       5.080783 32.51728 8.468664 35.14499 6.156667 -2.627705      10.47009 
1 1 1 -6  24 34 o 45.28445 4.013247 25.78313       4.382942 26.65401       7.189629 25.26806       5.529174 44.82545 6.794549 44.36437 5.213745 0.4610825      8.564405 
1 1 1 -6  24 35 o 56.54800 3.670751 40.10869       5.031008 27.33954       7.509274 50.50830       6.776811 44.88450 7.101410 63.08172 4.436746 -18.19722      8.373454 
1 1 1 -6  24 36 o 44.79446 5.271941 26.33067       5.644742 24.92537       6.782821 29.49657       10.18065 42.63781 6.752699 43.95696 9.758607 -1.319153      11.86716 
1 1 1 -6  24 37 o 13.72829 6.062760 -0.3527969     3.977309 -2.247902      7.316947 0.4419981      4.738499 16.95687 7.782709 15.47567 6.731168 1.481202       10.28976 
1 1 1 -6  24 38 o 19.09181 6.639907 5.018232       3.782550 1.676608       5.891873 7.361159       4.933486 17.40896 7.539298 22.28052 7.589533 -4.871552      10.69776 
1 1 1 -6  24 39 o 27.07671 6.308220 10.79106       4.084768 11.47550       6.286904 10.29106       5.373505 26.09834 8.561904 25.26090 7.877883 0.8374367      11.63474 
1 1 1 -6  24 40 o 47.73875 4.238581 30.47210       4.879713 35.57813       7.465751 26.66382       6.447578 49.00650 6.404598 42.32185 6.455711 6.684647       9.093684 
1 1 1 -6  24 41 o 11.84000 5.691798 -4.380757      4.803145 -4.892206      7.465942 -4.019594      6.273864 14.57314 7.028543 13.75268 6.583164 0.8204603      9.630082 
1 1 1 -6  24 42 o 19.00746 6.877889 6.054993       4.094122 8.560380       6.202479 4.120539       5.450133 20.97448 8.260260 17.22948 7.352801 3.745001       11.05873 
1 1 1 -6  24 43 o 11.30649 5.301794 -1.577021      3.684733 -1.660335      5.781732 -1.520038      4.781574 13.59104 6.453395 12.69171 5.978887 0.8993292      8.797351 
1 1 1 -6  24 44 o 17.99749 6.787277 5.933490       4.059633 1.998660       6.143575 8.983331       5.408749 15.26040 7.049931 20.46992 7.807681 -5.209528      10.51957 
1 1 1 -6  25 1  f 210.9853 5.397546 544.6241       27.72860 530.5829       37.98578 560.6407       40.56998 207.8457 7.512057 213.5918 7.807564 -5.746109      10.83462 
1 1 1 -6  25 2  o 50.14542 4.310340 30.93129       5.216134 24.47987       7.943685 35.82153       6.916070 44.04419 7.680223 53.86898 5.338621 -9.824787      9.353433 
1 1 1 -6  25 3  o 359.2896 6.479877 1580.734       56.73454 1545.617       96.12453 1599.507       70.28185 353.3782 11.17647 360.9503 7.990236 -7.572144      13.73890 
1 1 1 -6  25 4  o 131.5791 3.254445 211.2173       10.43518 203.2452       19.63767 214.3542       12.31827 128.6996 6.280437 132.4662 3.819993 -3.766525      7.350934 
1 1 1 -6  25 5  o 317.7350 5.857590 1235.184       45.35447 1130.029       74.20895 1297.882       57.30210 302.5265 10.08007 325.3489 7.227451 -22.82245      12.40338 
1 1 1 -6  25 6  o 179.9371 4.112094 395.3176       18.03100 377.1071       30.09540 405.5146       22.52037 175.2517 7.061418 182.0738 5.080620 -6.822144      8.699214 
1 1 1 -6  25 7  o 131.8151 3.211370 211.9801       10.31553 216.6094       20.52493 210.4156       11.93199 132.8479 6.358483 131.2453 3.734521 1.602646       7.374074 
1 1 1 -6  25 8  o 192.2400 4.225419 451.3243       19.79473 504.3384       36.34663 428.9701       23.60198 202.6122 7.373730 187.2405 5.177614 15.37177       9.009972 
1 1 1 -6  25 9  o 197.2393 3.705048 474.8810       17.80833 540.3171       38.30771 456.8410       20.11387 209.6661 7.509724 193.3990 4.267812 16.26704       8.637718 
1 1 1 -6  25 10 o 146.0768 3.813332 260.6958       13.56284 253.6460       23.61218 264.1671       16.56884 143.6724 6.763124 146.9536 4.632536 -3.281174      8.197575 
1 1 1 -6  25 11 o 219.5041 3.994856 588.4146       21.36879 590.7053       30.73622 586.2716       29.72900 219.5887 5.748810 218.7965 5.580310 0.7921906      8.011784 
1 1 1 -6  25 12 o 195.9141 3.785607 468.6680       18.07330 473.2939       26.31742 464.5391       24.86351 196.5701 5.499418 194.7889 5.242725 1.781158       7.598011 
1 1 1 -6  25 13 o 123.9131 3.307934 187.5364       9.979795 161.5845       13.97501 214.5436       14.25632 114.8277 5.006271 132.4208 4.424104 -17.59308      6.680976 
1 1 1 -6  25 14 o 128.9275 3.825475 203.1981       12.00567 182.3182       21.36549 212.8333       14.51376 121.5911 7.243493 131.8668 4.523263 -10.27573      8.539795 
1 1 1 -6  25 15 o 157.8591 3.476244 304.2623       13.37261 282.2652       18.75461 327.0122       19.07285 151.7835 5.077607 163.4319 4.794156 -11.64844      6.983267 
1 1 1 -6  25 16 o 118.2946 2.867195 170.7592       8.265292 170.4698       13.89648 170.9176       10.28160 117.9330 4.845731 118.2472 3.572169 -0.3142166     6.020092 
1 1 1 -6  25 17 o 130.9389 2.907886 209.2410       9.278596 211.8840       15.87336 207.8693       11.43578 131.4677 4.963572 130.4033 3.602112 1.064346       6.132883 
1 1 1 -6  25 18 o 65.98026 3.119225 53.26688       5.001099 47.40907       8.977902 55.90234       6.021922 61.86193 6.031990 67.54311 3.672440 -5.681179      7.061991 
1 1 1 -6  25 19 o 174.2542 3.162090 370.7744       13.42745 389.5941       22.73933 360.6992       16.63787 178.2109 5.241787 171.7630 3.974953 6.447891       6.578495 
1 1 1 -6  25 20 o 125.4600 3.162031 192.3467       9.659644 194.4957       15.03699 190.8369       12.60431 125.9014 4.910523 124.8349 4.149072 1.066528       6.428689 
1 1 1 -6  25 21 o 216.4177 3.512013 572.4266       18.52188 573.7617       30.40612 571.6389       23.35509 216.0317 5.780932 216.0726 4.435533 -0.4090881E-01 7.286503 
1 1 1 -6  25 22 f 50.77707 3.446765 31.65952       4.239686 29.07154       7.886007 32.71165       5.028172 48.06227 6.933358 51.54552 4.035115 -3.483250      8.022070 
1 1 1 -6  25 23 o 161.8323 3.058866 319.9939       12.06318 321.7868       20.30250 319.0156       14.99765 161.7928 5.155955 161.4611 3.811705 0.3316345      6.411939 
1 1 1 -6  25 24 o 173.8529 3.567138 369.7864       15.11256 354.2077       21.93671 383.8591       20.84948 169.6483 5.312776 176.7601 4.844898 -7.111816      7.190176 
1 1 1 -6  25 25 o 77.11588 3.733183 72.98949       6.994668 77.26409       14.93427 71.78829       7.916678 78.38052 7.927663 76.39156 4.269658 1.988960       9.004322 
1 1 1 -6  25 26 o 60.61324 4.458505 45.37015       6.539479 0.000000       0.000000 45.37015       6.539479 ?        ?        60.61324 4.458505 0.000000       4.458505 
1 1 1 -6  25 27 o 124.1604 3.681884 189.2045       11.12780 199.5644       15.56454 178.3721       15.91551 127.1205 5.034362 120.0295 5.455483 7.090965       7.423416 
1 1 1 -6  25 28 o 20.91774 6.458624 5.458461       3.621922 9.119796       7.163920 4.201230       4.197963 27.33499 9.145812 19.61440 6.980572 7.720589       11.50540 
1 1 1 -6  25 29 o 13.53919 5.759507 0.1088824      3.325322 6.530632       6.733650 -1.962336      3.824167 24.33909 8.818762 12.75012 5.763659 11.58897       10.53520 
1 1 1 -6  25 30 o 43.14043 4.287386 23.23280       4.447679 30.46547       8.126461 20.13977       5.314270 48.57629 7.072537 39.77858 5.640208 8.797714       9.046144 
1 1 1 -6  25 31 o 26.69397 6.356331 9.369754       4.075205 17.65852       6.999642 5.119560       5.012280 36.26867 8.122063 21.24250 7.619972 15.02617       11.13696 
1 1 1 -6  25 32 o 15.84547 6.176329 2.125525       3.437749 10.74445       6.475387 -1.257102      4.056639 28.20700 8.622420 13.59807 6.057487 14.60894       10.53752 
1 1 1 -6  25 33 o 59.91451 3.531158 44.69604       5.132811 51.06517       8.339545 40.81200       6.512449 63.13984 5.474076 56.75006 4.752757 6.389782       7.249427 
1 1 1 -6  25 34 o 57.73695 3.630498 41.75298       5.082203 37.72126       7.830732 44.68704       6.680234 53.55932 6.108816 59.22450 4.666319 -5.665180      7.687143 
1 1 1 -6  25 35 o 27.65061 7.478528 10.86930       5.159636 9.439329       6.254378 13.91588       9.129107 25.72026 8.544119 30.08586 10.32214 -4.365602      13.39958 
1 1 1 -6  25 36 o 34.36815 5.730887 16.01500       4.630782 23.33546       9.188486 13.52261       5.361456 38.22008 9.815028 30.59722 7.294027 7.622860       12.22856 
1 1 1 -6  25 37 o 13.33245 5.757400 0.3849912      3.416421 -2.347682      5.567601 2.035367       4.326788 14.56663 6.722980 16.13770 6.697728 -1.571074      9.489890 
1 1 1 -6  25 38 o 25.44397 6.312745 9.508390       3.895338 7.866449       5.846770 10.81890       5.223457 22.46093 8.205693 26.16175 7.686894 -3.700821      11.24374 
1 1 1 -6  25 39 o 35.87556 5.182490 17.93673       4.399622 16.67057       6.578586 18.96129       5.917758 31.32142 8.432928 34.99252 7.180688 -3.671095      11.07594 
1 1 1 -6  25 40 o 37.50214 5.826816 20.65081       5.152257 19.90026       6.805158 21.65890       7.886672 33.80464 8.318414 33.83195 9.285755 -0.2731705E-01 12.46681 
1 1 1 -6  25 41 o 13.78572 6.221051 0.2920603      4.432777 2.642274       8.530293 -0.5773613     5.188305 17.84242 8.265358 14.03355 6.481571 3.808864       10.50366 
1 1 1 -6  25 42 o 13.27836 5.883783 0.9391319      3.776550 0.6393324E-02  5.744869 1.648960       5.011603 14.47777 6.732820 14.88680 6.674891 -0.4090261     9.480772 
1 1 1 -6  25 43 o 18.12715 6.788232 5.907899       4.045366 6.225163       6.387935 5.695466       5.227106 18.02293 7.827465 17.66645 7.349409 0.3564816      10.73699 
1 1 1 -6  26 1  o 134.9995 2.887258 222.3137       9.498474 227.9776       14.63074 218.1874       12.48803 136.5348 4.403066 133.6275 3.838949 2.907303       5.841619 
1 1 1 -6  26 2  o 155.0227 3.302753 293.2533       12.47692 294.8798       17.36914 291.5191       17.93450 155.2767 4.595304 154.3657 4.773365 0.9109802      6.625845 
1 1 1 -6  26 3  o 101.4605 2.794964 125.6586       6.903915 124.9689       10.24571 126.2322       9.343728 101.0686 4.168916 101.6154 3.779914 -0.5468445     5.627398 
1 1 1 -6  26 4  o 220.1145 3.943846 591.6068       21.15460 644.3241       30.84527 544.7894       29.06801 229.4779 5.515841 210.9117 5.660715 18.56612       7.903683 
1 1 1 -6  26 5  o 88.75842 3.179220 96.24776       6.865374 92.34473       8.951980 101.8216       10.69784 86.84521 4.242809 91.13978 4.834017 -4.294563      6.431885 
1 1 1 -6  26 6  o 313.0948 5.008729 1198.656       38.21549 1188.151       53.29988 1209.769       54.82199 311.1878 7.028581 313.9632 7.165392 -2.775391      10.03712 
1 1 1 -6  26 7  o 146.3440 3.248589 261.3453       11.58526 256.4514       15.85278 266.9550       16.97253 144.7975 4.498167 147.7071 4.721361 -2.909668      6.521101 
1 1 1 -6  26 8  o 147.2366 3.251495 264.5532       11.66635 250.5586       15.72254 281.6982       17.40248 143.1158 4.513802 151.7306 4.712253 -8.614838      6.525315 
1 1 1 -6  26 9  o 78.93547 3.806732 76.26058       7.300934 73.59792       12.56286 77.61848       8.971468 77.16651 6.748569 79.55018 4.648175 -2.383667      8.194432 
1 1 1 -6  26 10 o 129.9716 3.757895 206.4503       11.88976 239.9493       22.21746 193.0063       14.07482 139.7178 6.543567 125.5679 4.607496 14.14994       8.002954 
1 1 1 -6  26 11 o 233.8634 4.107792 668.2179       23.41029 732.0970       49.60421 649.9132       26.55343 243.6026 8.368464 230.5361 4.726564 13.06651       9.611014 
1 1 1 -6  26 12 f 135.8905 2.951258 225.3303       9.773106 207.3539       15.72709 236.6391       12.47399 130.0894 4.970157 139.1539 3.681759 -9.064590      6.185290 
1 1 1 -6  26 13 o 174.5620 3.554477 372.1044       15.12034 399.7026       33.23286 364.9000       16.97959 180.0587 7.590891 172.8092 4.032035 7.249542       8.595285 
1 1 1 -6  26 14 o 125.3012 2.927301 191.6008       8.938377 179.7374       14.76343 198.4659       11.23066 121.0745 5.014640 127.4224 3.620462 -6.347900      6.185011 
1 1 1 -6  26 15 o 169.3203 3.156534 349.9883       13.02434 351.3877       21.52351 349.1798       16.35950 169.2989 5.223273 169.0307 3.971627 0.2681885      6.561738 
1 1 1 -6  26 16 o 158.9277 3.073771 308.3428       11.90440 302.0867       19.46041 312.0837       15.04844 156.9649 5.094350 159.8006 3.864357 -2.835632      6.394189 
1 1 1 -6  26 17 o 123.4745 2.907266 186.0976       8.747787 178.7684       14.66008 190.1502       10.90123 120.7060 4.994717 124.7017 3.591035 -3.995735      6.151645 
1 1 1 -6  26 18 o 51.48349 3.816355 32.57683       4.753940 26.36259       11.20651 33.94053       5.249708 45.10233 10.40757 52.51727 4.135354 -7.414948      11.19905 
1 1 1 -6  26 19 o 198.2276 4.261614 480.8712       20.58611 502.7896       38.75764 472.2575       24.29677 201.4781 7.909298 196.1986 5.086078 5.279541       9.403467 
1 1 1 -6  26 20 o 162.2342 3.084269 321.4816       12.19357 335.3835       20.81228 314.2155       15.04644 165.2587 5.174338 160.2804 3.852275 4.978302       6.450876 
1 1 1 -6  26 21 o 58.64103 3.252573 42.15175       4.629777 33.67826       8.267571 46.02293       5.588159 51.83561 6.701751 61.22316 3.763754 -9.387543      7.686306 
1 1 1 -6  26 22 o 178.0958 3.617916 388.0141       15.70176 393.4872       23.49880 383.5994       21.10487 178.8318 5.398366 176.7183 4.905526 2.113571       7.294281 
1 1 1 -6  26 23 o 47.19819 4.305937 27.53209       4.898069 25.91080       8.171951 28.44111       6.119008 45.07542 7.716942 47.79899 5.344606 -2.723572      9.387013 
1 1 1 -6  26 24 o 80.37450 3.109579 79.11475       6.079051 82.61713       15.00259 78.42674       6.649382 81.11266 7.681526 79.98115 3.419487 1.131508       8.408255 
1 1 1 -6  26 25 o 36.61678 4.751056 16.76081       4.139565 0.000000       0.000000 16.76081       4.139565 ?        ?        36.61678 4.751056 0.000000       4.751056 
1 1 1 -6  26 26 o 155.4958 3.055479 295.9513       11.57802 308.2519       20.24487 289.9728       14.11395 157.9043 5.268580 153.7357 3.767366 4.168564       6.476958 
1 1 1 -6  26 27 o 58.17762 3.140540 41.59172       4.435918 49.17051       9.247150 39.32642       5.055586 62.57129 6.143647 56.47350 3.693866 6.097797       7.168615 
1 1 1 -6  26 28 o 20.82545 6.457706 5.433238       3.616405 2.785068       7.105968 6.358869       4.201162 21.38497 8.696817 22.46389 6.959326 -1.078926      11.13853 
1 1 1 -6  26 29 o 20.20216 6.576275 5.017514       3.712399 7.318765       6.880813 4.072575       4.409198 25.07107 8.935459 19.54177 7.127928 5.529301       11.43021 
1 1 1 -6  26 30 o 57.44897 3.921891 41.00645       5.457598 48.35785       8.531093 35.91357       7.100705 61.76150 5.733745 53.22097 5.556754 8.540524       7.984569 
1 1 1 -6  26 31 f 68.14511 3.447690 57.53823       5.706707 58.83323       9.385448 56.77862       7.188121 67.93823 5.722116 67.34109 4.404425 0.5971451      7.220912 
1 1 1 -6  26 32 o 60.75879 3.555696 45.96825       5.241644 47.15274       8.608721 45.27042       6.607681 60.41742 5.923131 59.88217 4.562440 0.5352440      7.476585 
1 1 1 -6  26 33 o 38.43393 4.604208 18.92112       4.226551 24.12570       6.989324 15.92072       5.306791 42.22243 7.040700 34.36337 6.576729 7.859058       9.634563 
1 1 1 -6  26 34 o 20.01988 7.641779 4.541664       5.183841 5.805439       6.270370 1.812895       9.213859 22.01824 8.404567 21.40520 9.346967 0.6130314      12.56991 
1 1 1 -6  26 35 o 30.37498 7.479038 13.38381       5.498578 15.35311       6.654878 9.146985       9.761247 31.93621 8.429279 25.71514 10.28612 6.221071       13.29876 
1 1 1 -6  26 36 o 25.48022 6.055199 9.178147       3.704080 13.96638       6.141990 6.441267       4.643539 30.05297 8.172627 21.27781 7.359223 8.775164       10.99773 
1 1 1 -6  26 37 o 14.53278 6.069396 1.501827       3.585247 6.419084       5.679188 -1.756373      4.622891 21.05310 8.007577 13.42207 6.169837 7.631026       10.10882 
1 1 1 -6  26 38 o 21.65235 6.593440 7.104406       3.791219 5.501183       5.734952 8.348911       5.052788 19.80509 7.896927 22.81063 7.681408 -3.005541      11.01660 
1 1 1 -6  26 39 o 34.05577 6.048030 17.17084       4.835409 13.96439       6.350296 21.59518       7.459425 27.86899 8.542474 34.84655 8.787376 -6.977566      12.25528 
1 1 1 -6  26 40 o 16.72683 6.907931 3.656586       4.571327 6.741726       8.061318 2.194273       5.549949 19.99395 8.736533 16.17142 7.150820 3.822525       11.28987 
1 1 1 -6  26 41 o 10.39376 5.020791 -3.922977      3.846643 2.521837       6.178573 -8.002082      4.915474 16.27197 7.343673 10.38413 5.147277 5.887835       8.967942 
1 1 1 -6  26 42 o 13.30580 5.945114 0.9433031      3.938295 -7.684375      6.156495 6.919328       5.123806 11.75154 5.813526 18.99866 7.499805 -7.247116      9.489161 
1 1 1 -6  27 1  o 94.35182 2.816205 108.6991       6.467916 95.64384       9.215611 121.3728       9.079926 88.36877 4.292302 99.62778 3.746625 -11.25902      5.697460 
1 1 1 -6  27 2  o 231.1286 3.658490 652.2465       20.60590 604.4803       30.59319 691.9102       27.87799 222.1147 5.656722 237.8736 4.809271 -15.75883      7.424796 
1 1 1 -6  27 3  o 72.01192 3.423126 63.44191       5.989882 72.26443       7.810141 50.84058       9.334062 76.79462 4.189284 64.13527 6.043489 12.65935       7.353494 
1 1 1 -6  27 4  f 227.9199 3.611889 634.2388       20.06101 598.8114       30.22268 662.1418       26.82189 221.0752 5.614466 232.7108 4.729734 -11.63562      7.341159 
1 1 1 -6  27 5  o 150.1640 2.976134 275.1337       10.89066 256.2781       16.19918 290.6851       14.71152 144.7148 4.599344 154.2213 3.917678 -9.506577      6.041702 
1 1 1 -6  27 6  o 229.2859 3.619309 641.9088       20.22270 673.5818       32.27271 621.4321       25.94897 234.5218 5.646980 225.4329 4.723531 9.088882       7.362073 
1 1 1 -6  27 7  o 148.6328 2.948348 269.5580       10.67898 253.8783       16.00140 282.1500       14.33959 144.0310 4.564725 151.9372 3.876068 -7.906250      5.988374 
1 1 1 -6  27 8  o 49.85240 3.443567 30.48509       4.157708 36.03343       6.179066 25.89477       5.620342 54.07577 4.736826 45.71683 5.133462 8.358940       6.984981 
1 1 1 -6  27 9  o 146.3895 3.345401 261.6098       11.93423 267.1537       24.00791 259.7903       13.75393 147.3613 6.703064 145.7811 3.875027 1.580246       7.742538 
1 1 1 -6  27 10 o 174.7865 3.548156 373.0625       15.11286 419.9358       32.17913 359.7979       17.11819 184.6814 7.163737 171.5884 4.093870 13.09299       8.250994 
1 1 1 -6  27 11 o 71.77840 3.452698 63.05626       6.021615 67.74466       12.63175 61.67751       6.850035 73.89673 7.101929 70.93528 3.978675 2.961449       8.140470 
1 1 1 -6  27 12 o 234.2900 4.746678 671.6570       27.10064 0.000000       0.000000 671.6570       27.10064 ?        ?        234.2900 4.746678 0.000000       4.746678 
1 1 1 -6  27 13 o 160.7066 3.122780 315.2847       12.22957 337.3253       20.80792 303.6533       15.11591 165.8776 5.153853 157.6259 3.935235 8.251663       6.484465 
1 1 1 -6  27 14 o 193.5616 3.362615 457.5584       15.86107 479.3180       26.49410 445.4034       19.80158 197.6530 5.505958 190.8407 4.257873 6.812317       6.960248 
1 1 1 -6  27 15 o 150.1388 3.055250 275.2040       11.17830 260.5441       18.12564 284.2019       14.20029 145.7372 5.111632 152.4401 3.825648 -6.702881      6.384697 
1 1 1 -6  27 16 o 82.75401 3.019722 83.72225       6.079435 77.33043       10.59394 86.86072       7.423419 79.20834 5.523062 84.23160 3.625022 -5.023254      6.606436 
1 1 1 -6  27 17 o 70.97417 3.414446 61.68840       5.888176 58.85400       9.517216 63.44616       7.494774 69.00260 5.710996 71.87603 4.298601 -2.873428      7.147967 
1 1 1 -6  27 18 o 47.87756 4.129796 28.25599       4.771281 28.74455       8.017422 27.98808       5.937078 47.76769 7.103410 47.48471 5.216578 0.2829781      8.813122 
1 1 1 -6  27 19 o 48.53756 3.740446 28.98338       4.390124 27.60493       8.098104 29.55710       5.224456 46.71555 7.356575 48.92517 4.429961 -2.209618      8.587418 
1 1 1 -6  27 20 o 44.10495 5.107446 24.19580       5.388085 21.71062       11.27896 24.93064       6.133161 40.79245 11.06734 44.65549 5.770831 -3.863033      12.48153 
1 1 1 -6  27 21 o 40.87277 4.898269 20.79583       4.781738 11.74054       7.490600 27.02398       6.212198 30.50539 9.263544 46.54156 5.589002 -16.03617      10.81897 
1 1 1 -6  27 22 o 156.5628 3.382194 299.8537       12.90396 316.1320       28.80606 295.7671       14.43310 159.3853 7.437015 155.4091 3.811070 3.976166       8.356640 
1 1 1 -6  27 23 o 91.53782 3.156342 102.6169       7.030245 89.02222       16.43330 105.6624       7.777928 84.02880 8.126587 92.84324 3.443744 -8.814438      8.826142 
1 1 1 -6  27 24 o 19.88902 6.307840 4.833116       3.431089 -8.629873      10.32104 6.505819       3.637997 19.37875 9.016196 22.59056 6.347240 -3.211815      11.02630 
1 1 1 -6  27 25 o 75.94118 2.970418 70.69212       5.486465 69.08076       10.71866 71.26417       6.386530 74.39774 5.962004 76.16906 3.449681 -1.771324      6.888090 
1 1 1 -6  27 26 o 76.09004 2.948663 71.01578       5.457155 62.67274       10.21730 74.34577       6.454997 70.72968 5.983964 77.76924 3.414380 -7.039566      6.889544 
1 1 1 -6  27 27 f 115.5148 2.867521 163.5375       8.071981 165.7316       14.58492 162.5686       9.691599 115.4111 5.199208 114.9680 3.463201 0.4430618      6.247041 
1 1 1 -6  27 28 o 41.82928 3.788556 21.74870       3.819971 23.90573       8.070607 21.12595       4.336484 42.52345 8.083673 41.07958 4.400355 1.443867       9.203743 
1 1 1 -6  27 29 o 59.52003 3.322577 43.77878       4.800064 46.78407       8.904593 42.54780       5.698956 60.55471 6.118170 58.48375 4.023261 2.070965       7.322475 
1 1 1 -6  27 30 o 20.17264 6.683674 5.063872       3.827836 7.081295       6.644848 4.061898       4.682902 24.31131 8.766951 19.60189 7.311002 4.709415       11.41535 
1 1 1 -6  27 31 o 79.54639 3.333271 78.50693       6.447090 74.77785       10.32751 80.88813       8.252658 76.40613 5.585239 80.30912 4.231831 -3.902992      7.007374 
1 1 1 -6  27 32 o 28.41410 6.129521 10.84920       4.119382 15.05387       6.952974 8.575047       5.113451 32.42585 8.642726 24.99540 7.666287 7.430452       11.55286 
1 1 1 -6  27 33 o 20.26267 7.753276 4.650515       5.344690 9.010780       6.375264 -5.661721      9.804336 25.31898 8.627487 18.53353 8.677027 6.785448       12.23619 
1 1 1 -6  27 34 o 17.28842 7.250571 1.931660       5.148985 9.081690       6.323369 -12.13816      8.870311 24.96675 8.589845 15.14411 7.386152 9.822640       11.32875 
1 1 1 -6  27 35 o 12.65840 5.712015 -1.094246      3.736446 -4.640578      8.171976 -0.1569056     4.201322 16.59651 7.817724 14.12731 6.235407 2.469201       9.999856 
1 1 1 -6  27 36 o 39.94521 4.578239 21.25951       4.376117 22.65803       7.016610 20.36921       5.598350 38.42463 7.760981 37.72517 6.312498 0.6994591      10.00402 
1 1 1 -6  27 37 o 18.30504 6.600164 4.706572       3.766002 11.32660       5.915430 0.1946836      4.883549 26.01247 8.286247 14.90306 6.642063 11.10942       10.61974 
1 1 1 -6  27 38 o 13.01351 5.823966 -0.1775504     3.795832 -1.574149      5.508604 1.085137       5.237859 14.29702 6.629583 15.63358 6.928229 -1.336558      9.589147 
1 1 1 -6  27 39 o 17.56835 7.563762 3.766927       5.862053 10.41148       8.056617 -3.708219      8.545343 22.59876 9.233962 15.73673 7.571940 6.862029       11.94154 
1 1 1 -6  27 40 o 17.46906 6.683033 4.843136       3.970483 1.517210       5.923311 7.556901       5.350501 15.65492 7.115003 20.20739 7.751114 -4.552470      10.52155 
1 1 1 -6  27 41 o 23.25063 6.764553 9.460979       4.062574 9.358334       6.258201 9.535738       5.340911 20.92475 8.279633 21.77778 7.858983 -0.8530273     11.41560 
1 1 1 -6  27 42 o 16.45217 6.513319 4.496662       3.874749 1.507514       5.959452 6.685690       5.099860 14.99702 6.933639 18.50754 7.424077 -3.510522      10.15836 
1 1 1 -6  28 1  o 52.96224 4.433779 34.53318       5.669909 29.17334       6.266442 58.73225       13.31509 48.51380 5.391486 68.56843 8.126443 -20.05463      9.752292 
1 1 1 -6  28 2  o 186.0266 3.647864 422.6397       16.53673 424.4698       22.78155 420.6014       24.04229 186.1671 5.026223 185.2567 5.331109 0.9103241      7.326912 
1 1 1 -6  28 3  f 60.53788 4.327722 45.02734       6.342325 43.30771       9.058271 46.68110       8.883098 59.06910 6.394728 61.41407 6.012492 -2.344978      8.777391 
1 1 1 -6  28 4  o 55.98067 3.317784 38.39185       4.505781 31.07285       6.460834 45.32229       6.286994 50.08855 5.377240 60.74240 4.274614 -10.65386      6.869282 
1 1 1 -6  28 5  o 73.69322 3.010780 66.38700       5.395444 80.14092       8.135724 55.58881       7.208723 80.87194 4.142012 67.28387 4.421037 13.58807       6.058203 
1 1 1 -6  28 6  o 109.9183 3.255619 147.6231       8.710859 170.0190       17.62732 140.3869       10.01978 117.5638 6.174500 107.1285 3.844338 10.43525       7.273471 
1 1 1 -6  28 7  o 196.0242 3.329438 469.1435       15.90438 486.4647       25.18459 457.6533       20.51210 199.2552 5.191098 193.4703 4.350706 5.784851       6.773193 
1 1 1 -6  28 8  o 272.5135 4.063402 907.6561       26.98448 917.3246       42.58011 901.1668       34.88391 273.3414 6.392420 271.2511 5.277371 2.090302       8.289371 
1 1 1 -6  28 9  o 91.57819 3.264345 102.5241       7.273258 79.46612       13.24523 112.4785       8.702758 80.11395 6.850128 95.87952 3.731858 -15.76557      7.800706 
1 1 1 -6  28 10 f 190.0956 3.710634 441.4970       17.18923 457.4131       35.32039 436.5575       19.67658 192.5347 7.542606 188.9458 4.273427 3.588913       8.669088 
1 1 1 -6  28 11 o 123.0379 3.714261 185.1360       11.12371 0.000000       0.000000 185.1360       11.12371 ?        ?        123.0379 3.714261 0.000000       3.714261 
1 1 1 -6  28 12 o 122.8267 3.272577 184.3622       9.786596 189.7936       20.49921 182.7589       11.13785 124.0239 6.808708 122.2355 3.743520 1.788422       7.769971 
1 1 1 -6  28 13 o 61.11362 3.768584 45.81948       5.585149 42.72258       11.75504 46.72243       6.347362 58.16650 8.547836 61.65867 4.250386 -3.492172      9.546270 
1 1 1 -6  28 14 o 42.07032 4.261006 21.87358       4.308245 22.89846       7.735885 21.41279       5.187106 42.42019 7.769675 41.46695 5.250721 0.9532394      9.377522 
1 1 1 -6  28 15 o 77.54131 3.118516 73.54932       5.880718 67.23445       10.14196 76.74788       7.217993 73.78523 5.684273 79.14379 3.753208 -5.358559      6.811574 
1 1 1 -6  28 16 o 179.3596 5.048458 394.8129       22.04384 384.7301       32.50666 403.3972       29.99411 176.2567 7.585924 180.7667 6.821209 -4.509949      10.20172 
1 1 1 -6  28 17 o 153.9724 3.512093 289.8266       13.17786 284.2401       19.46292 294.5556       17.90681 152.0787 5.259660 154.9391 4.748253 -2.860458      7.085897 
1 1 1 -6  28 18 o 106.6040 3.336559 139.0529       8.657114 146.2297       13.41035 133.9250       11.33555 109.0296 5.061113 104.4436 4.464032 4.585960       6.748514 
1 1 1 -6  28 19 f 57.64145 4.435755 40.96572       6.182837 32.44851       12.18652 43.91803       7.174831 49.92654 10.35630 59.60501 4.985231 -9.678471      11.49371 
1 1 1 -6  28 20 o 146.2411 3.331236 261.5494       11.87165 295.8073       26.87194 253.2417       13.23306 154.3358 7.164454 143.7745 3.780240 10.56123       8.100593 
1 1 1 -6  28 21 o 52.45605 3.762903 33.87564       4.778152 28.97234       11.33213 34.93587       5.269476 47.01664 10.18565 53.22525 4.094128 -6.208614      10.97768 
1 1 1 -6  28 22 o 87.75704 3.198055 94.36008       6.827743 100.8612       16.93841 93.09882       7.460715 89.52452 7.843313 87.11632 3.521607 2.408203       8.597631 
1 1 1 -6  28 23 o 53.80970 3.653213 35.66201       4.761995 30.29049       12.35032 36.60006       5.161071 47.68118 10.87122 54.47340 3.914028 -6.792221      11.55435 
1 1 1 -6  28 24 o 104.2471 2.886030 133.1132       7.324581 127.2735       13.15214 135.7387       8.818722 101.2857 5.347535 105.1538 3.446128 -3.868118      6.361755 
1 1 1 -6  28 25 o 103.4206 2.883631 131.1074       7.260370 120.3146       12.79060 136.2380       8.818819 98.34474 5.357309 105.2935 3.441570 -6.948746      6.367509 
1 1 1 -6  28 26 o 46.66741 3.596069 26.94771       4.058053 31.44631       8.648276 25.67755       4.595367 49.31051 7.427355 45.42036 4.199302 3.890152       8.532276 
1 1 1 -6  28 27 o 14.70028 5.731291 1.732610       2.960735 -8.260256      6.996773 3.912242       3.267716 14.81744 7.053790 18.19813 6.177089 -3.380687      9.376161 
1 1 1 -6  28 28 o 25.07825 5.637430 8.213245       3.361188 5.495457       7.143342 8.986078       3.809222 23.34951 8.956147 26.15526 6.090495 -2.805748      10.83082 
1 1 1 -6  28 29 o 27.93348 5.048536 10.08726       3.310126 10.01053       6.940200 10.10985       3.766083 27.42125 8.995753 27.75958 5.756308 -0.3383255     10.67982 
1 1 1 -6  28 30 o 39.03089 3.815529 19.14088       3.582805 12.48411       7.105039 21.41075       4.148924 29.83519 9.013988 41.17572 4.193285 -11.34053      9.941610 
1 1 1 -6  28 31 o 37.83947 4.245079 18.22227       3.847000 17.04202       7.189057 18.69584       4.553865 34.52350 8.582062 38.01368 5.039976 -3.490181      9.952544 
1 1 1 -6  28 32 o 23.16476 8.136799 7.203463       5.688660 3.571590       6.670275 16.89134       10.89413 20.38783 8.374342 32.45765 11.26965 -12.06981      14.04046 
1 1 1 -6  28 33 o 19.69765 7.775478 4.234957       5.507239 5.444623       6.526444 1.243569       10.26314 21.49395 8.470657 21.45798 9.591716 0.3596878E-01  12.79660 
1 1 1 -6  28 34 o 15.82743 6.429033 2.172066       3.877815 4.677022       8.779942 1.565004       4.322232 21.75927 9.310371 15.76431 6.629160 5.994958       11.42929 
1 1 1 -6  28 35 o 35.17493 5.114784 16.84808       4.255897 15.89569       6.722292 17.48518       5.498090 31.24240 8.572092 34.55385 6.771734 -3.311447      10.92415 
1 1 1 -6  28 36 o 47.84328 4.158369 30.21192       4.800085 23.90018       7.219191 35.21358       6.426446 38.91734 7.882721 50.51109 5.299763 -11.59375      9.498672 
1 1 1 -6  28 37 o 14.74513 6.177854 1.839637       3.732478 11.91352       6.057431 -4.326288      4.739028 26.05990 8.393695 11.95557 5.722544 14.10433       10.15882 
1 1 1 -6  28 38 o 21.87416 7.884845 8.423582       5.374284 11.42146       6.535528 2.162832       9.444674 24.35841 8.705401 18.48243 8.607837 5.875980       12.24250 
1 1 1 -6  28 39 o 19.49545 7.055600 6.487522       4.308645 8.571676       8.291280 5.716489       5.043047 20.59596 8.931479 18.54946 7.402266 2.046507       11.60021 
1 1 1 -6  28 40 o 9.775986 4.732543 -3.825516      3.463885 -3.294601      5.885750 -4.106841      4.284430 13.08754 6.293878 10.89647 5.272164 2.191071       8.210275 
1 1 1 -6  28 41 o 9.379539 4.599403 -4.923975      3.579928 -1.727157      6.217320 -6.509552      4.378628 13.75746 6.576781 9.974133 4.928475 3.783323       8.218511 
1 1 1 -6  29 1  o 94.94262 3.163001 110.1714       7.307855 106.6143       9.609980 115.0489       11.25319 93.28014 4.238708 96.83513 4.783578 -3.554993      6.391343 
1 1 1 -6  29 2  f 65.79331 3.461342 53.01376       5.530087 41.84706       6.922333 72.71165       9.193899 58.26033 4.921769 76.90955 4.931486 -18.64922      6.967307 
1 1 1 -6  29 3  o 59.67735 3.664177 43.67139       5.303018 39.80827       6.751556 49.89302       8.568130 56.81265 4.925272 63.55384 5.589208 -6.741184      7.449668 
1 1 1 -6  29 4  o 135.4187 3.275064 223.9179       10.80773 234.1059       15.04592 213.0573       15.53467 138.2666 4.471330 131.8396 4.843494 6.426971       6.591830 
1 1 1 -6  29 5  o 21.33427 6.690685 5.536730       3.870350 7.397933       4.838064 2.228405       6.450283 24.45523 7.448595 20.51658 8.307025 3.938643       11.15743 
1 1 1 -6  29 6  o 186.2128 3.639431 423.6342       16.51502 398.2510       22.19932 455.0941       24.71409 180.2531 5.058835 192.6497 5.269241 -12.39662      7.304568 
1 1 1 -6  29 7  o 124.3084 3.194651 188.8000       9.669408 176.1485       12.91692 204.9268       14.58347 119.9143 4.427905 129.3197 4.635143 -9.405373      6.410218 
1 1 1 -6  29 8  o 131.3250 3.234137 210.5965       10.35004 222.9955       14.54162 197.8661       14.73462 134.9351 4.428335 127.0430 4.767856 7.892014       6.507119 
1 1 1 -6  29 9  o 64.76612 5.448356 51.78965       8.519377 0.000000       0.000000 51.78965       8.519377 ?        ?        64.76612 5.448356 0.000000       5.448356 
1 1 1 -6  29 10 o 19.26566 7.919492 1.504166       5.971292 0.000000       0.000000 1.504166       5.971292 ?        ?        19.26566 7.919492 0.000000       7.919492 
1 1 1 -6  29 11 o 137.5798 3.886935 231.6086       13.01855 220.5082       22.54016 237.1653       15.94745 133.6177 6.946251 139.0845 4.711987 -5.466721      8.393642 
1 1 1 -6  29 12 o 86.15256 3.989347 90.96886       8.352671 99.13386       14.76948 87.12949       10.12784 89.45708 6.826638 84.17485 4.959378 5.282227       8.437916 
1 1 1 -6  29 13 f 115.5960 3.817909 163.5772       10.74010 179.5286       19.77689 156.9052       12.79052 120.5220 6.760831 113.0826 4.651407 7.439354       8.206365 
1 1 1 -6  29 14 o 66.12387 4.229993 53.73826       6.780326 49.79633       12.26941 55.47135       8.135419 62.87922 8.202543 67.07091 5.013761 -4.191689      9.613506 
1 1 1 -6  29 15 o 75.77544 4.662714 70.64286       8.568309 71.87867       12.72248 69.61705       11.59121 75.99815 6.946344 74.90009 6.412161 1.098053       9.453439 
1 1 1 -6  29 16 o 151.1433 3.409667 279.2902       12.55848 296.0704       26.73314 274.5384       14.22593 154.5866 7.115549 149.7235 3.902339 4.863113       8.115374 
1 1 1 -6  29 17 o 158.5606 3.443690 307.4549       13.30624 307.3929       27.60785 307.4737       15.18655 157.4184 7.216019 158.4778 3.932373 -1.059326      8.217937 
1 1 1 -6  29 18 o 67.72527 3.493573 56.25972       5.746275 71.94630       13.74155 52.93539       6.325921 75.77972 7.541249 65.62305 3.974403 10.15667       8.524454 
1 1 1 -6  29 19 o 28.98630 5.620836 10.69970       3.827036 14.72003       7.577868 9.323228       4.434043 33.67433 9.043938 26.91823 6.767670 6.756104       11.29576 
1 1 1 -6  29 20 o 93.64534 2.956532 107.3345       6.738456 110.4708       12.19843 105.9572       8.083786 94.53498 5.316537 92.94501 3.575719 1.589966       6.407132 
1 1 1 -6  29 21 o 28.00475 5.656895 10.03048       3.727460 1.376518       7.566780 12.80334       4.283200 21.07143 8.810045 31.71059 5.754657 -10.63916      10.52297 
1 1 1 -6  29 22 o 33.50193 5.038611 14.14806       3.986290 21.24918       11.62906 13.20255       4.243383 39.88490 11.39663 32.21605 5.608759 7.668850       12.70202 
1 1 1 -6  29 23 o 62.56666 3.430073 48.16707       5.209762 71.85509       14.54123 44.67868       5.580197 74.98724 8.085164 60.17870 3.824935 14.80853       8.944272 
1 1 1 -6  29 24 o 110.5234 2.893788 149.7908       7.787237 161.8356       14.19582 144.6062       9.313626 114.1227 5.117507 108.4241 3.529685 5.698624       6.216716 
1 1 1 -6  29 25 o 81.29358 2.955043 81.19106       5.844305 80.22948       10.86087 81.58298       6.933759 79.96152 5.609333 81.35390 3.505700 -1.392372      6.614722 
1 1 1 -6  29 26 o 39.30972 3.971314 19.29007       3.752147 21.07560       7.877930 18.76618       4.267245 39.64866 8.414276 38.60209 4.628469 1.046574       9.603269 
1 1 1 -6  29 27 o 13.77717 5.742614 0.6595072      3.200374 -0.3147065     7.063483 0.9111637      3.590011 18.82770 8.203301 14.73663 6.107193 4.091073       10.22702 
1 1 1 -6  29 28 o 14.66780 5.722034 1.795556       2.952592 -4.379651      6.616908 3.330796       3.299267 15.80502 7.306814 17.23592 6.182285 -1.430901      9.571321 
1 1 1 -6  29 29 o 78.48424 2.939132 76.17944       5.611380 56.34300       9.694570 86.17353       6.881266 65.85432 6.110693 83.27601 3.398016 -17.42168      6.991930 
1 1 1 -6  29 30 o 11.41887 5.107358 -0.9897903     2.914669 10.77216       6.766731 -3.669122      3.229627 27.58584 8.870261 10.15707 4.822954 17.42877       10.09665 
1 1 1 -6  29 31 o 83.81993 4.168194 89.18510       8.487245 80.74866       15.99670 92.49034       10.01272 74.59626 8.980310 84.74915 4.868691 -10.15289      10.21519 
1 1 1 -6  29 32 o 35.64041 5.572802 17.07600       4.681667 18.91968       7.170310 15.70596       6.181044 35.57327 8.405638 32.71602 7.852827 2.857243       11.50311 
1 1 1 -6  29 33 o 16.27760 6.401911 2.738412       3.721220 -2.318986      8.354008 3.990285       4.156343 17.75760 8.209717 18.12360 6.860303 -0.3659973     10.69875 
1 1 1 -6  29 34 o 44.09061 4.497643 25.74763       4.764844 27.58057       7.513538 24.51458       6.162534 42.89302 7.458891 41.51803 6.287564 1.374985       9.755435 
1 1 1 -6  29 35 o 18.66337 6.704875 4.915517       3.882319 2.440654       6.110114 6.591182       5.027677 17.72409 7.676711 20.89984 7.613248 -3.175743      10.81173 
1 1 1 -6  29 36 o 17.69679 6.640474 4.362288       3.875275 13.29146       6.326756 -0.9993941     4.902596 27.46085 8.545663 13.97013 6.396468 13.49072       10.67442 
1 1 1 -6  29 37 o 21.79771 8.390034 8.573197       6.283913 8.573197       6.283913 0.000000       0.000000 21.79771 8.390034 ?        ?        0.000000       8.390034 
1 1 1 -6  29 38 o 22.56543 7.134847 8.825194       4.392715 18.68729       8.909154 5.657621       5.049113 27.69006 10.12713 18.57103 7.408099 9.119028       12.54746 
1 1 1 -6  29 39 o 12.73972 5.744073 0.2257277      3.769704 -8.448277      5.887804 6.251637       4.907438 11.39984 5.647690 18.75283 7.358913 -7.352990      9.276314 
1 1 1 -6  29 40 o 33.70586 5.732727 17.82882       4.540285 16.88901       7.357763 18.40674       5.769800 26.38156 9.254831 31.52097 7.600552 -5.139410      11.97582 
1 1 1 -6  30 1  o 64.96613 3.231106 51.67208       5.099285 47.57167       7.215538 55.76328       7.207426 62.14214 4.802048 67.36139 4.415028 -5.219250      6.523200 
1 1 1 -6  30 2  o 76.81275 3.069305 72.15568       5.733689 67.78434       7.929012 76.94692       8.301101 74.29845 4.398974 79.18768 4.318058 -4.889236      6.164138 
1 1 1 -6  30 3  o 21.13924 6.446612 5.512784       3.622489 8.641455       5.127622 2.395434       5.118337 26.19213 7.593682 18.88855 7.483360 7.303583       10.66136 
1 1 1 -6  30 4  o 55.99838 3.532082 38.46603       4.795393 36.99108       6.647967 40.06594       6.923863 54.71574 5.042550 56.96302 5.039865 -2.247280      7.129344 
1 1 1 -6  30 5  o 45.48027 3.976750 25.48410       4.363157 32.00813       6.220025 19.16405       6.122015 50.85606 5.087161 38.92754 6.694932 11.92852       8.408407 
1 1 1 -6  30 6  o 176.6907 3.189487 381.2812       13.73316 379.6767       21.14402 382.4519       18.06148 175.9653 4.935757 176.8122 4.191842 -0.8469543     6.475588 
1 1 1 -6  30 7  o 87.60832 2.895007 93.80251       6.172117 96.80628       9.237281 91.37982       8.295807 88.84418 4.279154 86.35445 3.952674 2.489738       5.825357 
1 1 1 -6  30 8  o 59.26583 4.577639 43.26226       6.560021 0.000000       0.000000 43.26226       6.560021 ?        ?        59.26583 4.577639 0.000000       4.577639 
1 1 1 -6  30 9  o 153.2202 3.514966 286.9115       13.12421 318.0861       27.21301 277.4629       14.98166 160.4756 6.975417 150.5416 4.087609 9.933960       8.084862 
1 1 1 -6  30 10 o 129.9314 3.357013 206.4219       10.62036 199.7985       21.36722 208.5950       12.23927 127.1048 6.924579 130.5419 3.851631 -3.437149      7.923689 
1 1 1 -6  30 11 o 111.3652 3.302427 151.6780       8.952390 159.7848       18.63250 149.2448       10.20785 113.6440 6.758566 110.4010 3.799909 3.243019       7.753549 
1 1 1 -6  30 12 o 156.7605 3.462673 300.4052       13.22769 299.9903       27.08489 300.5351       15.15839 155.6602 7.159419 156.6632 3.973751 -1.002960      8.188283 
1 1 1 -6  30 13 o 91.54576 3.399701 102.5912       7.571117 131.3884       16.49211 94.90164       8.522219 102.9971 6.605576 87.96483 3.986001 15.03223       7.715039 
1 1 1 -6  30 14 o 114.9874 3.748194 161.9505       10.48884 135.7104       18.05353 175.3207       12.88692 104.5128 7.131256 119.5223 4.432177 -15.00944      8.396368 
1 1 1 -6  30 15 o 51.61007 4.073145 32.82369       5.081220 39.35016       11.53837 31.25350       5.659548 55.51983 8.823131 50.26106 4.674343 5.258766       9.984844 
1 1 1 -6  30 16 o 32.05819 5.393809 12.98125       4.064316 12.66571       7.397057 13.11770       4.864379 31.44931 9.121424 32.03101 6.455174 -0.5817070     11.17451 
1 1 1 -6  30 17 o 33.88598 5.375086 14.47667       4.290560 9.545066       7.961001 16.49553       5.093623 28.40943 9.641540 36.09122 6.002201 -7.681787      11.35719 
1 1 1 -6  30 18 o 54.77935 3.603812 36.91057       4.784055 41.16331       9.026183 35.24916       5.641673 57.26779 6.587674 53.40608 4.373185 3.861713       7.907098 
1 1 1 -6  30 19 o 41.03673 4.305695 20.90885       4.241735 13.71227       7.908648 23.81503       5.025745 32.52716 9.430851 43.73377 4.794199 -11.20661      10.57948 
1 1 1 -6  30 20 o 54.52420 3.468649 36.58417       4.584883 39.29570       9.014541 35.63797       5.325084 55.77806 6.770463 53.70578 4.099817 2.072281       7.915028 
1 1 1 -6  30 21 o 44.31473 4.247409 24.38494       4.530703 17.66602       11.87710 25.52915       4.901326 36.73629 11.74567 45.30103 4.499261 -8.564732      12.57792 
1 1 1 -6  30 22 o 69.70459 3.120348 59.68931       5.286863 56.92770       9.930680 60.78160       6.245501 67.28750 6.123321 70.23320 3.661772 -2.945702      7.134678 
1 1 1 -6  30 23 o 86.45415 2.953937 91.77115       6.214194 112.6603       11.75665 83.67237       7.320370 95.10902 5.091095 82.37772 3.655697 12.73130       6.267645 
1 1 1 -6  30 24 o 105.7955 2.885425 137.4594       7.432028 141.7375       13.23817 135.4905       8.980886 106.5410 5.113813 104.8330 3.520478 1.708046       6.208450 
1 1 1 -6  30 25 o 34.58287 4.677559 15.14290       3.841025 27.13951       11.21529 13.54880       4.088264 43.99931 10.58863 32.49215 5.349254 11.50715       11.86312 
1 1 1 -6  30 26 o 58.14970 3.511336 41.94928       4.952535 35.84406       8.711131 44.86512       6.020127 52.35322 7.003545 59.93628 4.147307 -7.583061      8.139398 
1 1 1 -6  30 27 o 54.21952 3.283216 36.48577       4.317687 47.08967       8.540778 32.84538       5.004247 60.48521 5.868096 51.18914 4.044508 9.296074       7.126893 
1 1 1 -6  30 28 o 32.93060 4.598084 13.90768       3.589420 19.89881       7.279751 11.98328       4.125816 37.81323 8.141234 30.08070 5.839023 7.732531       10.01868 
1 1 1 -6  30 29 f 71.08678 3.062205 62.81842       5.292239 52.16520       9.276849 67.95818       6.443635 62.91457 6.128388 73.66647 3.600330 -10.75190      7.107708 
1 1 1 -6  30 30 o 13.35526 5.987266 -1.133694      4.030539 -3.518268      6.325944 0.4958480      5.229409 15.38721 7.124424 16.38751 7.099860 -1.000296      10.05810 
1 1 1 -6  30 31 o 22.19781 6.052126 6.846756       3.363130 6.387343       6.794985 6.995812       3.870446 22.37573 8.694176 22.30875 6.632978 0.6697655E-01  10.93550 
1 1 1 -6  30 32 o 31.27281 5.217846 13.25034       3.836420 6.490935       9.274189 14.64580       4.213861 23.03856 9.700619 32.75269 5.472495 -9.714128      11.13778 
1 1 1 -6  30 33 o 28.35975 5.153078 11.04945       3.430136 6.972695       6.178614 12.86571       4.124040 21.82061 8.339484 30.21417 5.812133 -8.393562      10.16503 
1 1 1 -6  30 34 o 21.24135 6.566936 6.741866       3.743012 7.277414       6.402393 6.463772       4.613586 21.75665 8.443265 20.72850 7.323733 1.028143       11.17702 
1 1 1 -6  30 35 o 16.21839 6.458697 3.117566       3.831486 -1.251574      5.766205 6.571752       5.127019 14.83209 6.844192 20.51194 7.649950 -5.679858      10.26473 
1 1 1 -6  30 36 o 50.05680 4.508524 34.35897       5.440758 34.72483       11.36425 34.25018       6.197148 39.18318 11.28827 49.00914 5.271739 -9.825966      12.45858 
1 1 1 -6  30 37 o 27.09177 7.171815 12.48737       4.808362 0.5544270      9.212897 16.95477       5.637023 17.27076 8.184750 31.42700 7.470831 -14.15624      11.08167 
1 1 1 -6  30 38 o 29.27694 5.968728 13.45760       4.113799 25.17160       7.212059 7.808205       5.008502 36.71901 8.260489 20.44416 7.573120 16.27485       11.20660 
1 1 1 -6  30 39 o 16.82742 6.532698 4.636351       3.833776 4.638023       6.465836 4.635444       4.760943 17.25600 7.669624 16.91597 7.023663 0.3400326      10.39976 
1 1 1 -6  31 1  o 96.21716 2.962363 113.1613       6.937601 107.6081       10.13364 118.0600       9.517792 93.63390 4.453927 98.15440 3.987451 -4.520500      5.978063 
1 1 1 -6  31 2  o 128.0486 2.972670 200.2342       9.275938 202.6019       13.91608 198.3411       12.44342 128.5479 4.449090 127.2606 4.017482 1.287254       5.994544 
1 1 1 -6  31 3  o 29.84218 5.514008 11.27683       3.862230 9.933366       5.294528 12.80485       5.646480 27.89282 7.589006 31.57244 7.458433 -3.679621      10.64055 
1 1 1 -6  31 4  o 12.20333 5.430307 -1.245718      3.251066 -3.713053      4.361536 1.839174       4.876917 12.74330 5.905642 17.99108 7.244994 -5.247782      9.347007 
1 1 1 -6  31 5  o 115.0607 2.917294 161.7706       8.173216 168.2397       12.41126 156.8170       10.86066 117.1373 4.355538 113.1500 3.944849 3.987305       5.876440 
1 1 1 -6  31 6  o 80.95483 4.154272 80.42610       8.168063 0.000000       0.000000 80.42610       8.168063 ?        ?        80.95483 4.154272 0.000000       4.154272 
1 1 1 -6  31 7  o 88.73271 3.328135 96.35618       7.183738 101.4750       12.76113 93.98148       8.691775 90.66532 5.806314 87.53316 4.086014 3.132164       7.099916 
1 1 1 -6  31 8  o 65.91187 3.212383 53.21063       5.144191 56.46246       7.500762 50.32286       7.068439 67.72530 4.571624 63.92036 4.567939 3.804943       6.462648 
1 1 1 -6  31 9  o 22.68522 7.195285 6.263762       4.464352 3.769698       8.590583 7.186538       5.225368 24.11322 9.648178 24.33289 7.791913 -0.2196693     12.40166 
1 1 1 -6  31 10 o 70.08794 3.614547 60.24004       6.152671 79.94758       13.26275 54.83575       6.945230 80.17435 6.853995 66.77068 4.291113 13.40367       8.086464 
1 1 1 -6  31 11 o 85.15525 3.464294 88.81908       7.173889 88.62347       14.57123 88.88166       8.241991 84.34750 7.156545 85.11356 3.984782 -0.7660599     8.191131 
1 1 1 -6  31 12 o 104.7082 3.849985 134.3905       9.806993 126.4016       17.24547 138.2088       11.92245 100.8280 7.063394 106.0482 4.624569 -5.220215      8.442640 
1 1 1 -6  31 13 o 107.6398 3.787143 142.0242       9.918447 170.2614       18.89707 131.2874       11.65252 117.1667 6.645669 103.3289 4.639499 13.83775       8.104928 
1 1 1 -6  31 14 o 138.1965 3.394385 233.6659       11.43127 280.5212       24.91582 221.1736       12.86520 150.3349 6.818852 134.2998 3.935261 16.03511       7.872931 
1 1 1 -6  31 15 o 198.8046 3.830358 484.2880       18.55675 529.5862       39.51410 471.4709       21.01874 205.8889 7.890193 195.9802 4.401073 9.908737       9.034633 
1 1 1 -6  31 16 f 183.1925 3.691427 411.2179       16.47927 419.9775       34.50001 408.6285       18.75747 183.2376 7.743704 182.4578 4.218672 0.7798309      8.818285 
1 1 1 -6  31 17 o 36.65164 5.780017 16.99952       4.991617 13.65627       7.560766 19.58258       6.645832 32.40989 9.165780 39.04212 7.252118 -6.632236      11.68780 
1 1 1 -6  31 18 o 113.7051 2.989382 158.3440       8.276004 158.1514       14.46718 158.4376       10.09003 113.0286 5.266903 113.5960 3.649701 -0.5674362     6.407854 
1 1 1 -6  31 19 o 53.84326 3.609789 35.73757       4.709045 36.18200       9.056134 35.57286       5.512968 53.30245 7.152383 53.59801 4.255773 -0.2955589     8.322751 
1 1 1 -6  31 20 o 19.79756 6.822115 4.517178       3.989080 -10.84166      12.41555 6.285217       4.212430 20.81182 9.750345 22.39186 6.973789 -1.580034      11.98762 
1 1 1 -6  31 21 o 48.14687 3.771234 28.70530       4.389454 23.92912       8.252130 30.58986       5.183602 42.64405 8.239156 49.58773 4.333132 -6.943687      9.309120 
1 1 1 -6  31 22 o 21.71680 6.196059 6.082253       3.439858 5.328616       6.583967 6.365205       4.034248 22.92232 8.643827 22.33236 6.801682 0.5899544      10.99903 
1 1 1 -6  31 23 o 35.18710 4.517317 15.61203       3.784223 11.47479       7.127493 17.23608       4.465615 29.39125 9.057646 36.83507 5.112533 -7.443823      10.40091 
1 1 1 -6  31 24 o 30.19279 5.213937 11.73570       3.697589 10.39661       7.164019 12.22196       4.317051 28.06854 9.135366 30.59029 6.005658 -2.521749      10.93265 
1 1 1 -6  31 25 o 23.26666 6.180490 7.161963       3.563174 7.431870       6.948915 7.065681       4.150331 24.78841 8.961781 23.15256 6.864823 1.635843       11.28890 
1 1 1 -6  31 26 o 63.98675 3.438442 50.91112       5.341828 47.52867       13.15278 51.57925       5.845651 58.07371 9.631247 64.28566 3.747745 -6.211952      10.33472 
1 1 1 -6  31 27 f 17.95934 6.167385 3.947917       3.259257 1.845532       6.122375 4.779359       3.850169 18.80561 7.897800 19.56599 6.703706 -0.7603836     10.35929 
1 1 1 -6  31 28 o 90.38751 3.578283 102.3517       7.866113 101.1272       11.50660 103.4260       10.77785 88.34866 5.369908 89.75298 4.946865 -1.404327      7.301190 
1 1 1 -6  31 29 o 30.43394 6.280554 12.72439       4.503381 2.735456       6.602605 21.41360       6.158090 19.53664 8.203060 39.47444 6.636937 -19.93780      10.55174 
1 1 1 -6  31 30 o 12.39391 5.409375 -0.1100737     3.082724 -12.16210      5.418828 5.656776       3.748390 10.62329 5.288992 20.27678 6.608595 -9.653492      8.464454 
1 1 1 -6  31 31 o 34.95933 4.738010 16.25970       3.932609 0.5271101      9.229722 19.74942       4.346937 19.67146 8.917139 38.58383 4.721454 -18.91236      10.08997 
1 1 1 -6  31 32 o 41.93747 3.940716 22.90213       3.980103 25.28313       7.014878 21.77174       4.833414 41.20101 7.251467 40.07375 5.062207 1.127254       8.843625 
1 1 1 -6  31 33 o 27.65255 5.461526 10.79916       3.549696 2.899255       6.066324 14.91245       4.377334 17.99723 7.720599 32.37667 5.759145 -14.37944      9.631998 
1 1 1 -6  31 34 o 14.15940 6.121049 1.028473       3.869799 -0.2695429     5.957148 1.976114       5.090027 15.55540 7.095127 16.21802 7.015534 -0.6626148     9.977903 
1 1 1 -6  31 35 o 13.78084 5.890769 1.312588       3.508556 -4.633860      5.934392 4.508136       4.350310 13.17926 6.333302 17.72116 6.936152 -4.541901      9.392599 
1 1 1 -6  31 36 o 14.55727 6.099613 2.188924       3.638959 4.683353       8.842782 1.680380       3.992706 18.84016 8.612803 14.40614 6.222574 4.434019       10.62548 
1 1 1 -6  31 37 o 19.17102 6.412580 6.100786       3.521889 7.401371       6.619058 5.587161       4.159587 19.66044 8.231376 18.25513 6.873400 1.405302       10.72377 
1 1 1 -6  31 38 o 21.51521 6.329479 7.832892       3.539683 7.882396       6.724876 7.813921       4.163041 19.51332 8.240723 20.75838 6.972257 -1.245056      10.79453 
1 1 1 -6  32 1  o 159.2185 3.154086 309.7976       12.23780 350.6620       19.53806 283.4151       15.69882 169.0132 4.748486 152.0487 4.241042 16.96457       6.366675 
1 1 1 -6  32 2  o 71.36262 3.231771 62.36950       5.605558 77.38662       8.406297 50.34529       7.522106 79.35292 4.363962 63.87434 4.869254 15.47858       6.538639 
1 1 1 -6  32 3  o 149.1532 3.080883 271.8278       11.19809 285.0451       17.21025 262.1238       14.74662 152.3959 4.639638 146.2431 4.142083 6.152740       6.219573 
1 1 1 -6  32 4  o 70.02361 3.180918 60.04687       5.413741 55.09874       7.762320 64.73334       7.554290 66.84877 4.796878 72.56503 4.291147 -5.716263      6.436146 
1 1 1 -6  32 5  f 71.47596 4.443421 62.85545       7.701237 0.000000       0.000000 62.85545       7.701237 ?        ?        71.47596 4.443421 0.000000       4.443421 
1 1 1 -6  32 6  o 51.12021 3.605544 32.12486       4.462771 27.98333       6.353840 36.15734       6.269627 47.37445 5.612622 54.07507 4.807899 -6.700619      7.390360 
1 1 1 -6  32 7  o 68.93796 3.240379 58.22284       5.428418 55.54685       7.795485 60.74202       7.563646 67.11049 4.798348 70.25220 4.440822 -3.141716      6.537970 
1 1 1 -6  32 8  o 15.89380 6.186342 1.938630       3.445004 5.342190       4.958255 -1.237912      4.790042 21.85728 7.602085 15.19758 6.684788 6.659702       10.12315 
1 1 1 -6  32 9  o 129.0795 3.410419 203.9454       10.71817 209.8138       21.40133 201.9808       12.38303 130.0565 6.775993 128.3528 3.963752 1.703735       7.850185 
1 1 1 -6  32 10 o 88.55602 3.473752 96.10352       7.481862 80.25864       14.27083 102.1096       8.786187 80.07274 7.397135 91.20799 3.962497 -11.13525      8.391603 
1 1 1 -6  32 11 o 121.9084 3.844145 182.2450       11.40582 184.6310       20.17347 181.1239       13.82816 121.8768 6.819603 121.3448 4.685154 0.5320053      8.273914 
1 1 1 -6  32 12 o 101.3108 3.381362 125.7517       8.336321 143.0554       17.16917 120.4141       9.535787 107.2605 6.600577 99.03315 3.959279 8.227371       7.696980 
1 1 1 -6  32 13 o 131.5317 3.370744 211.9207       10.79529 214.1976       22.34009 211.2271       12.33048 131.0894 7.018876 131.2079 3.860615 -0.1184845     8.010553 
1 1 1 -6  32 14 o 96.31927 3.332701 113.7275       7.810717 102.4539       15.59770 117.5006       9.023620 90.42661 7.136089 97.81936 3.792657 -7.392754      8.081337 
1 1 1 -6  32 15 o 82.14237 3.442616 82.82143       6.875876 85.58596       14.52251 82.02265       7.806279 82.46816 7.301731 81.65279 3.934749 0.8153687      8.294427 
1 1 1 -6  32 16 o 197.3532 4.427167 479.4230       21.29149 500.7350       38.55201 470.0697       25.53982 199.3123 7.953345 194.8759 5.383191 4.436386       9.603876 
1 1 1 -6  32 17 o 46.10630 4.411841 26.42258       4.896575 19.32789       10.40971 28.43840       5.548772 38.00560 10.75714 47.75674 4.834403 -9.751141      11.79354 
1 1 1 -6  32 18 o 56.07045 3.627975 38.78881       4.930566 48.13454       9.695205 35.52850       5.726370 61.68862 6.549308 53.48468 4.433328 8.203938       7.908719 
1 1 1 -6  32 19 o 120.4428 3.321318 178.3035       9.738957 184.9383       23.31252 176.9008       10.71912 120.2013 8.004341 119.8512 3.674466 0.3501205      8.807449 
1 1 1 -6  32 20 o 67.62749 3.277162 56.34250       5.384713 56.01780       9.937037 56.47748       6.406910 66.50625 6.202917 67.55314 3.908639 -1.046890      7.331687 
1 1 1 -6  32 21 o 69.32995 3.210819 59.24531       5.409932 64.33604       10.29130 57.30134       6.359522 71.27452 5.980246 68.00896 3.853031 3.265564       7.114013 
1 1 1 -6  32 22 o 102.4320 2.957703 129.1342       7.375154 127.7159       12.87877 129.8262       8.996358 100.7856 5.261951 102.4568 3.608849 -1.671196      6.380589 
1 1 1 -6  32 23 o 40.39837 4.135406 20.49708       4.013771 30.29255       7.951486 17.14771       4.649623 48.03812 6.997977 36.52645 5.385011 11.51167       8.830064 
1 1 1 -6  32 24 o 27.80902 5.761765 10.18623       3.776138 12.89669       6.694778 8.921571       4.573002 30.47413 8.627159 25.73386 7.073922 4.740278       11.15653 
1 1 1 -6  32 25 f 16.30123 6.107634 2.743856       3.275727 -3.627424      6.185044 5.227700       3.861816 15.43372 7.109793 20.25230 6.713388 -4.818587      9.778483 
1 1 1 -6  32 26 o 42.60207 4.865282 23.36396       4.960516 22.48733       7.344764 24.09919       6.726409 40.21474 7.776037 42.28491 6.754914 -2.070171      10.30027 
1 1 1 -6  32 27 o 61.75446 3.971463 48.27811       5.944927 41.29224       8.749339 54.26945       8.102648 55.29224 6.625196 64.65481 5.186147 -9.362564      8.413640 
1 1 1 -6  32 28 o 11.83706 5.365911 -1.398365      3.342388 -1.514032      9.382116 -1.381551      3.577079 19.54722 8.911357 12.29874 5.565548 7.248484       10.50655 
1 1 1 -6  32 29 o 39.89932 3.857749 20.44268       3.704170 20.05995       6.689406 20.61193       4.448429 36.93166 7.683325 39.58860 4.702846 -2.656944      9.008343 
1 1 1 -6  32 30 o 21.41553 6.294472 6.576478       3.501973 -6.717921      8.328337 9.431952       3.859784 15.83599 7.581597 25.64530 6.237040 -9.809307      9.817397 
1 1 1 -6  32 31 o 29.94626 5.042788 12.26413       3.549401 12.11028       6.090325 12.34326       4.367845 27.27954 8.366537 29.17180 6.326738 -1.892262      10.48935 
1 1 1 -6  32 32 o 37.12645 4.941462 18.86300       4.359782 14.08112       6.447408 22.89167       5.917894 28.78030 8.561856 39.64185 6.339498 -10.86155      10.65339 
1 1 1 -6  32 33 o 22.78221 7.540300 8.526116       4.872285 8.308993       6.007051 8.943623       8.329898 22.15949 8.277296 22.52086 9.315172 -0.3613739     12.46138 
1 1 1 -6  32 34 o 36.81700 5.585413 19.75710       4.854078 27.79921       10.27249 17.44519       5.507775 35.14735 10.88122 32.97023 7.067519 2.177124       12.97501 
1 1 1 -6  32 35 o 21.31567 7.112156 7.805850       4.332656 13.49794       8.584468 5.860309       5.018774 24.06193 9.638940 18.83877 7.426918 5.223162       12.16833 
1 1 1 -6  32 36 o 10.99775 5.108533 -1.336096      3.292535 4.900729       5.870672 -4.198103      3.976870 17.78667 7.611928 10.48392 5.074203 7.302751       9.148169 
1 1 1 -6  32 37 o 44.49725 4.412233 28.06269       4.721460 36.96304       7.864759 23.04760       5.903659 46.25785 7.212047 37.05923 6.787195 9.198616       9.903517 
1 1 1 -6  33 1  o 30.87704 5.475334 12.08279       3.969022 9.421015       5.592563 14.78392       5.633754 27.22035 7.941712 33.92398 7.045441 -6.703632      10.61645 
1 1 1 -6  33 2  o 55.97364 3.635358 38.51675       4.931864 39.50664       6.935857 37.50437       7.014221 56.45342 5.096490 54.95304 5.303652 1.500381       7.355470 
1 1 1 -6  33 3  o 157.0879 3.538684 302.0414       13.54630 277.2575       24.52689 312.9198       16.24952 149.4683 6.751184 159.6953 4.179128 -10.22707      7.940000 
1 1 1 -6  33 4  o 110.4899 2.975299 149.3377       8.003754 144.0791       12.01546 153.5321       10.73114 108.2352 4.565752 111.8661 3.942676 -3.630898      6.032477 
1 1 1 -6  33 5  o 36.41605 4.822174 16.57346       4.174216 23.13324       5.923240 10.10156       5.883428 42.93023 5.810935 28.13035 8.127694 14.79988       9.991315 
1 1 1 -6  33 6  o 48.07975 3.787649 28.49148       4.401989 30.43755       6.167078 26.47007       6.285308 49.46594 5.193436 45.98325 5.733269 3.482685       7.735771 
1 1 1 -6  33 7  o 38.22454 4.465547 18.17804       4.081332 17.76505       5.688544 18.61616       5.858979 37.37043 6.481345 38.26828 6.515982 -0.8978539     9.190530 
1 1 1 -6  33 8  f 52.64559 3.552092 34.09188       4.530357 27.36148       6.376156 40.95364       6.438079 46.75059 5.715457 57.54842 4.629823 -10.79784      7.355387 
1 1 1 -6  33 9  o 55.43520 4.212413 37.93125       5.647927 34.96191       10.69882 39.07845       6.650056 52.10961 8.734003 56.14484 4.909836 -4.035236      10.01945 
1 1 1 -6  33 10 o 36.52242 6.512541 17.02227       5.583628 18.56383       9.556126 16.22315       6.880296 37.55826 10.18591 35.30675 8.160296 2.251511       13.05156 
1 1 1 -6  33 11 o 140.6169 3.449635 242.2390       11.82080 261.8958       24.46407 236.2519       13.50153 144.8581 6.950544 138.6826 3.999249 6.175446       8.018981 
1 1 1 -6  33 12 o 102.9036 3.345507 129.8616       8.378206 120.9916       16.18884 133.1064       9.791453 98.32914 6.797966 104.0702 3.867593 -5.741089      7.821164 
1 1 1 -6  33 13 o 133.4352 3.383956 218.3815       10.99463 229.1863       23.01752 215.1875       12.51462 135.2539 7.007385 132.3166 3.885421 2.937332       8.012486 
1 1 1 -6  33 14 o 57.71606 3.969712 41.13747       5.549305 37.75458       11.37422 42.19425       6.357261 53.82301 8.988742 58.34525 4.506139 -4.522247      10.05499 
1 1 1 -6  33 15 o 66.77623 3.621759 54.92812       5.871500 63.88260       12.65142 52.47000       6.628592 70.85991 7.437309 65.13808 4.198259 5.721832       8.540429 
1 1 1 -6  33 16 o 70.94894 3.504066 61.99470       6.039606 62.36496       13.16280 61.89596       6.797380 69.69040 7.889262 70.78897 3.956135 -1.098572      8.825613 
1 1 1 -6  33 17 o 88.22405 3.317745 95.75678       7.120191 87.55190       15.00221 98.14232       8.089320 82.72150 7.524445 89.20555 3.729435 -6.484055      8.397974 
1 1 1 -6  33 18 o 28.86783 6.733252 10.93480       4.649389 0.000000       0.000000 10.93480       4.649389 ?        ?        28.86783 6.733252 0.000000       6.733252 
1 1 1 -6  33 19 o 55.06955 3.591469 37.54829       4.793401 31.31801       8.753295 40.21685       5.728711 48.92048 7.588169 56.84861 4.164129 -7.928139      8.655650 
1 1 1 -6  33 20 o 55.25798 3.530751 37.84212       4.729555 39.04406       8.825837 37.35792       5.601769 54.95770 6.730398 54.70079 4.235353 0.2569122      7.952137 
1 1 1 -6  33 21 o 44.54172 3.999949 24.82252       4.295492 31.47292       8.072284 22.19553       5.073433 49.02443 6.951620 41.75819 5.090774 7.266235       8.616322 
1 1 1 -6  33 22 o 10.28248 4.863900 -3.554258      3.224883 -9.616988      6.165306 -1.270700      3.783785 12.89402 6.258864 13.04027 5.826840 -0.1462526     8.551342 
1 1 1 -6  33 23 o 39.33267 4.714986 19.75051       4.429326 16.29233       7.103425 21.95045       5.665656 34.04214 8.569906 41.02628 5.830997 -6.984135      10.36551 
1 1 1 -6  33 24 o 29.83285 6.400693 12.01257       4.513861 14.17935       6.768845 10.27735       6.057374 31.51792 8.583098 27.11016 8.349230 4.407757       11.97411 
1 1 1 -6  33 25 o 42.80880 4.551928 23.51823       4.675867 26.24677       7.299710 21.61969       6.089064 43.79165 7.081964 40.03949 6.460437 3.752151       9.586004 
1 1 1 -6  33 26 o 42.20860 3.949064 22.69370       4.014760 23.89766       7.340015 22.17974       4.795730 41.09301 7.610004 41.27298 4.861319 -0.1799736     9.030204 
1 1 1 -6  33 27 o 30.44390 5.058531 12.35296       3.621199 21.48655       6.856673 8.820036       4.264423 38.58570 7.562582 24.87144 6.828795 13.71427       10.18946 
1 1 1 -6  33 28 o 34.64933 4.449986 15.77216       3.670777 9.902090       6.481429 18.54416       4.453946 25.32346 8.697124 37.25026 5.035421 -11.92680      10.04965 
1 1 1 -6  33 29 o 15.04206 6.035734 2.120644       3.371853 18.24878       9.015728 -0.5021094     3.635696 31.90357 10.23684 12.86241 5.731880 19.04116       11.73232 
1 1 1 -6  33 30 o 47.87048 3.771240 29.70639       4.363840 22.41941       7.313730 33.73474       5.437868 37.59184 8.213920 50.43132 4.471068 -12.83949      9.351948 
1 1 1 -6  33 31 o 21.08832 6.725945 6.741296       3.896457 -2.246546      6.137357 12.81015       5.043210 14.87896 6.932709 28.63948 7.227170 -13.76052      10.01471 
1 1 1 -6  33 32 o 20.33900 7.560138 6.546741       4.999281 4.830244       6.271780 9.537877       8.279180 19.06113 7.998616 22.82967 9.348239 -3.768538      12.30315 
1 1 1 -6  33 33 o 27.75770 6.556543 12.12053       4.363859 12.89065       8.880444 11.87536       5.010554 24.29716 9.779275 26.48453 7.451685 -2.187366      12.29479 
1 1 1 -6  33 34 o 15.48711 6.440901 2.835380       4.012986 -7.765371      7.122279 7.766092       4.857418 13.09382 6.434209 20.92969 7.502103 -7.835874      9.883349 
1 1 1 -6  33 35 o 22.35477 6.429237 8.292587       3.689381 6.620449       6.392468 9.127766       4.517748 19.12760 8.053777 22.55138 7.247488 -3.423786      10.83464 
1 1 1 -6  33 36 o 26.81063 5.903539 11.41370       3.752503 13.51671       6.959748 10.55177       4.455620 24.23102 8.935967 24.26169 7.091490 -0.3067780E-01 11.40792 
1 1 1 -6  34 1  o 20.58531 7.838105 3.822228       5.445006 0.000000       0.000000 3.822228       5.445006 ?        ?        20.58531 7.838105 0.000000       7.838105 
1 1 1 -6  34 2  o 47.86457 5.442295 28.63794       6.235343 0.000000       0.000000 28.63794       6.235343 ?        ?        47.86457 5.442295 0.000000       5.442295 
1 1 1 -6  34 3  o 30.29425 6.490795 11.81518       4.647555 8.874503       7.558648 13.60273       5.893188 27.42126 9.392911 32.36346 7.602453 -4.942205      12.08404 
1 1 1 -6  34 4  o 88.72519 3.053647 96.44194       6.592559 88.24572       9.513820 104.0129       9.143759 84.56278 4.634502 91.95110 4.090915 -7.388313      6.181763 
1 1 1 -6  34 5  o 41.04768 4.207244 20.91040       4.148964 19.75896       5.757921 22.15389       5.983627 39.47011 6.189712 41.87898 6.037319 -2.408871      8.646487 
1 1 1 -6  34 6  o 75.09386 3.122346 69.14643       5.701289 72.34097       8.464281 66.49342       7.713585 76.54261 4.558505 73.42099 4.330449 3.121620       6.287508 
1 1 1 -6  34 7  o 11.35135 5.233554 -2.590600      3.361334 -4.540964      4.418901 0.8756904E-01  5.178161 12.32281 5.787125 16.80162 7.168507 -4.478811      9.212942 
1 1 1 -6  34 8  o 62.44932 3.680552 48.00884       5.576309 44.56487       7.239954 53.03146       8.743222 59.89523 5.006038 65.23727 5.552420 -5.342041      7.475947 
1 1 1 -6  34 9  o 34.75706 5.864377 15.37653       4.790502 21.52432       9.036179 12.97319       5.649805 40.34196 9.371199 31.55603 7.464672 8.785927       11.98085 
1 1 1 -6  34 10 o 50.84247 4.354141 32.05570       5.342787 39.64857       10.75834 29.57004       6.155504 55.48015 8.204493 48.61280 5.280841 6.867355       9.757099 
1 1 1 -6  34 11 o 59.07148 3.977529 43.10535       5.692306 55.77236       11.77696 39.24399       6.502287 66.20561 7.427580 56.17342 4.795890 10.03219       8.841352 
1 1 1 -6  34 12 o 42.12873 4.841677 22.22341       4.880363 11.07587       9.455782 26.27122       5.697941 30.20553 10.49869 45.76146 5.201748 -15.55593      11.71668 
1 1 1 -6  34 13 o 99.36044 3.375296 121.3733       8.160758 122.4258       16.72606 121.0445       9.349065 98.35180 7.024966 99.08411 3.879432 -0.7323074     8.024970 
1 1 1 -6  34 14 o 72.00833 4.009491 64.12584       7.007931 86.04038       13.82646 56.54984       8.129522 82.29877 6.959338 67.32967 4.990231 14.96909       8.563574 
1 1 1 -6  34 15 o 47.79965 4.394985 28.50038       5.062125 27.79318       10.68090 28.70525       5.748782 45.21964 9.962115 47.80927 5.008575 -2.589622      11.15032 
1 1 1 -6  34 16 o 98.34421 3.779398 119.4971       9.040624 0.000000       0.000000 119.4971       9.040624 ?        ?        98.34421 3.779398 0.000000       3.779398 
1 1 1 -6  34 17 o 40.37186 4.833621 20.58048       4.660995 28.03400       10.36936 18.69320       5.217832 45.21614 9.701338 38.15908 5.793003 7.057060       11.29933 
1 1 1 -6  34 18 o 90.82853 3.323623 101.8637       7.344077 100.8612       15.30405 102.1637       8.370891 88.29095 7.174803 90.78219 3.792210 -2.491234      8.115335 
1 1 1 -6  34 19 o 37.73569 4.970582 18.14723       4.459798 9.476940       9.418066 20.65341       5.063498 27.96607 10.38015 40.18100 5.300369 -12.21493      11.65510 
1 1 1 -6  34 20 f 29.44260 6.045129 11.44694       4.191925 6.124947       8.746777 13.03379       4.776162 24.75359 9.790348 31.31333 6.473132 -6.559738      11.73679 
1 1 1 -6  34 21 o 81.28699 4.152478 82.85606       8.198286 80.81548       10.38787 86.22621       13.34977 79.51163 5.393089 81.02641 6.824374 -1.514778      8.698132 
1 1 1 -6  34 22 o 22.08149 6.899714 6.488101       4.119821 2.305472       5.912708 10.43488       5.743585 18.93826 7.842077 27.35530 8.066641 -8.417036      11.25028 
1 1 1 -6  34 23 o 49.12465 4.333564 30.72363       5.134633 29.10258       7.524325 32.13642       7.024362 46.36292 6.867140 49.33962 5.962996 -2.976696      9.094775 
1 1 1 -6  34 24 o 14.30127 5.935098 1.094628       3.397197 6.296303       6.364514 -0.9778740     4.017364 22.49110 8.494716 13.46669 6.011605 9.024404       10.40671 
1 1 1 -6  34 25 o 43.64002 3.903848 24.30587       4.107783 22.69799       7.104000 25.11352       5.034849 39.81073 7.599753 43.87858 4.786168 -4.067848      8.981295 
1 1 1 -6  34 26 o 13.99016 5.732244 1.371144       3.115436 -1.549947      5.907856 2.496364       3.666704 15.61997 7.101701 16.01803 6.337756 -0.3980618     9.518472 
1 1 1 -6  34 27 o 19.24460 6.184535 5.157458       3.289758 5.973406       5.907777 4.790729       3.960644 21.08858 8.130347 18.91793 6.775075 2.170645       10.58320 
1 1 1 -6  34 28 f 32.56285 5.248003 14.52493       4.022876 26.73134       9.863987 12.08958       4.405948 38.85688 10.26537 28.86932 6.427935 9.987553       12.11182 
1 1 1 -6  34 29 o 27.26072 6.242857 10.87151       4.057742 16.85347       6.222846 6.446485       5.352112 32.56139 7.919587 20.86186 7.808895 11.69953       11.12199 
1 1 1 -6  34 30 o 31.90110 5.697298 14.58274       4.266518 7.790351       6.264583 20.45879       5.826718 21.90752 8.391184 36.87572 6.732048 -14.96820      10.75790 
1 1 1 -6  34 31 o 22.97417 7.428332 8.747105       4.741288 -1.492846      9.335643 12.30635       5.503948 17.43816 8.256710 26.82604 7.892864 -9.387880      11.42237 
1 1 1 -6  34 32 o 14.06376 6.100688 1.252624       3.870884 1.448121       8.100620 1.194774       4.406537 17.45316 8.074347 14.58098 6.412657 2.872182       10.31102 
1 1 1 -6  34 33 o 31.05592 5.195843 14.08985       3.793410 8.840528       6.814521 16.44689       4.566321 21.21074 8.556148 32.80904 5.929508 -11.59830      10.40993 
1 1 1 -6  34 34 o 14.40357 5.927773 2.446841       3.350569 7.016458       6.250674 0.6044764      3.968942 19.41469 8.053349 13.31542 5.957458 6.099277       10.01737 
1 1 1 -6  35 1  o 86.40729 3.533156 91.79868       7.423903 85.54517       13.24069 94.66601       8.965775 82.46534 6.644971 87.58360 4.213127 -5.118263      7.868042 
1 1 1 -6  35 2  o 60.35086 3.662028 44.89232       5.360342 52.52658       7.282242 35.86446       7.919073 65.08856 4.621233 53.31158 6.211843 11.77698       7.742272 
1 1 1 -6  35 3  o 66.79190 3.505783 54.90214       5.686194 62.20529       7.801459 46.62553       8.305140 70.87710 4.540714 61.03671 5.647704 9.840385       7.246698 
1 1 1 -6  35 4  o 32.74475 5.441449 13.63239       4.189693 12.24145       5.491551 15.56961       6.480820 30.60080 7.437832 34.45886 7.888437 -3.858063      10.84199 
1 1 1 -6  35 5  o 39.18436 4.666362 19.21388       4.368379 18.31612       5.818838 20.37330       6.612659 37.77407 6.559119 39.73681 7.088900 -1.962738      9.657875 
1 1 1 -6  35 6  o 67.34108 5.076771 56.45401       8.269773 62.85310       11.88541 50.44871       11.51389 70.42056 7.019333 62.77318 7.687056 7.647381       10.40970 
1 1 1 -6  35 7  f 87.12048 4.677421 94.05577       9.893904 108.8117       14.65223 81.68871       13.41383 93.01807 6.504983 80.36768 6.916339 12.65039       9.494764 
1 1 1 -6  35 8  o 76.79916 3.667668 72.68158       6.844247 76.58230       12.83263 71.13087       8.091118 77.78326 6.839654 75.78687 4.399972 1.996399       8.132689 
1 1 1 -6  35 9  o 67.50571 3.824913 56.27388       6.266393 59.45750       11.78840 55.01997       7.398229 68.28077 7.192594 66.55240 4.589823 1.728371       8.532285 
1 1 1 -6  35 10 o 141.0006 4.034257 245.3688       13.84759 0.000000       0.000000 245.3688       13.84759 ?        ?        141.0006 4.034257 0.000000       4.034257 
1 1 1 -6  35 11 o 74.17469 3.676961 67.91237       6.625596 54.97661       12.36414 73.12337       7.847449 65.16050 7.950987 76.82381 4.207829 -11.66331      8.995778 
1 1 1 -6  35 12 o 63.02478 3.757506 49.13665       5.744750 47.68507       11.68371 49.59947       6.597314 60.45909 8.136542 63.17291 4.311327 -2.713821      9.208196 
1 1 1 -6  35 13 o 15.94701 6.564602 1.198708       4.110489 -6.688171      8.655368 3.495491       4.670818 17.73858 8.254293 19.12321 7.264692 -1.384634      10.99587 
1 1 1 -6  35 14 o 43.58987 4.897642 23.96721       5.112562 36.59495       10.48980 20.03304       5.855056 52.45874 8.495982 39.35315 6.319270 13.10559       10.58843 
1 1 1 -6  35 15 o 18.80015 7.661129 2.214285       5.527595 0.000000       0.000000 2.214285       5.527595 ?        ?        18.80015 7.661129 0.000000       7.661129 
1 1 1 -6  35 16 o 36.10497 6.110675 16.96737       5.184811 15.76054       9.005136 17.56582       6.341363 33.58619 10.14812 36.25227 7.428038 -2.666088      12.57617 
1 1 1 -6  35 17 o 36.18280 6.194153 17.13408       5.265330 13.87745       9.056540 18.79688       6.471414 31.59642 10.27050 37.45733 7.352290 -5.860916      12.63089 
1 1 1 -6  35 18 o 29.78740 6.742388 11.91291       4.779769 9.317678       8.880850 12.97124       5.671227 27.28970 10.08882 30.81295 7.600708 -3.523247      12.63151 
1 1 1 -6  35 19 o 52.06416 4.835695 34.50921       6.065148 34.83579       10.49374 34.34538       7.432301 49.88929 8.960838 51.32914 6.058475 -1.439857      10.81673 
1 1 1 -6  35 20 o 70.06056 4.050048 61.73560       6.885173 49.82100       11.91054 67.71535       8.437876 59.95394 8.380922 72.94982 4.772702 -12.99588      9.644612 
1 1 1 -6  35 21 o 26.05744 6.448565 9.286194       4.072380 -8.138121      7.444382 16.72724       4.864831 15.02498 7.186481 35.49106 5.826909 -20.46608      9.251939 
1 1 1 -6  35 22 o 15.69982 6.186546 2.211785       3.480942 0.9011731      6.126685 2.836531       4.230001 17.82958 7.704732 17.30911 6.820057 0.5204754      10.28961 
1 1 1 -6  35 23 o 42.74146 4.073823 23.38817       4.191881 18.61938       7.262464 25.77069       5.133308 35.34674 8.529830 44.47235 4.813272 -9.125610      9.794161 
1 1 1 -6  35 24 o 24.34803 6.167943 8.309617       3.663232 13.23534       6.923341 6.394430       4.317044 29.15300 8.916460 21.39896 7.098207 7.754036       11.39683 
1 1 1 -6  35 25 o 86.47588 3.021609 93.98822       6.357721 74.35302       10.27092 106.1851       8.094995 74.01366 5.739394 91.29181 3.646055 -17.27815      6.799585 
1 1 1 -6  35 26 o 37.91832 4.430272 18.97263       4.016635 24.05099       7.250321 16.72387       4.824667 39.93013 7.730500 34.56420 5.942173 5.365929       9.750388 
1 1 1 -6  35 27 o 63.22526 4.243774 52.43624       6.500645 47.03717       12.04010 54.65770       7.723060 52.75781 9.723138 63.67139 5.018006 -10.91357      10.94165 
1 1 1 -6  35 28 f 20.20486 6.781702 6.075092       3.938647 7.262792       6.064573 5.208705       5.179683 21.65064 8.265191 19.42629 7.578673 2.224348       11.21382 
1 1 1 -6  35 29 o 10.92077 5.084383 -1.965630      3.290666 6.435825       6.136603 -5.356499      3.898578 20.49418 8.169744 10.17251 4.946824 10.32166       9.550695 
1 1 1 -6  35 30 o 45.95027 4.285119 28.56847       4.742976 37.25491       10.87268 26.52699       5.270936 43.05659 10.46588 43.42791 5.076262 -0.3713112     11.63198 
1 1 1 -6  35 31 o 19.46319 7.176908 6.226753       4.489161 7.414455       8.747713 5.802143       5.230414 20.51428 9.028166 19.00156 7.553020 1.512720       11.77098 
1 1 1 -6  35 32 o 19.21687 6.468396 6.008501       3.582979 8.822390       6.375455 4.709484       4.331768 21.27732 8.376141 17.50711 6.900521 3.770205       10.85251 
1 1 1 -6  35 33 o 16.46327 6.337800 4.116039       3.586151 4.924960       6.564711 3.771964       4.281437 17.92314 7.856483 16.30501 6.704557 1.618124       10.32838 
1 1 1 -6  36 1  o 164.8271 3.219829 333.7583       12.93295 332.8874       19.61066 334.4286       17.20454 163.6489 4.923082 164.4140 4.297745 -0.7650452     6.535086 
1 1 1 -6  36 2  o 50.63832 3.818479 31.77746       4.677287 28.38617       6.370433 35.74376       6.889369 47.36927 5.628612 53.30349 5.377236 -5.934219      7.784339 
1 1 1 -6  36 3  o 61.06673 3.397893 45.99191       5.036567 43.48396       7.013320 48.66277       7.237533 58.98078 4.924418 62.45621 4.791911 -3.475430      6.871121 
1 1 1 -6  36 4  o 69.17072 3.230144 58.90950       5.429743 60.27286       7.772148 57.60973       7.588767 69.59846 4.608484 68.03836 4.604119 1.560097       6.514295 
1 1 1 -6  36 5  o 85.19320 3.361648 89.38104       6.965301 84.66240       9.219769 95.65495       10.63116 82.52715 4.602684 87.58242 5.001926 -5.055275      6.797349 
1 1 1 -6  36 6  o 51.70123 3.701463 33.10224       4.632627 26.48788       6.351789 40.61932       6.771371 45.64347 5.844527 56.96709 4.926072 -11.32362      7.643603 
1 1 1 -6  36 7  o 13.81712 5.820264 0.3944174      3.340802 3.068931       4.476866 -2.966568      5.018628 18.44541 7.086331 14.24656 6.503553 4.198853       9.618331 
1 1 1 -6  36 8  o 22.20179 6.286799 6.388579       3.554727 3.102750       4.734468 10.63437       5.381805 18.77615 7.267748 28.32480 7.627946 -9.548645      10.53592 
1 1 1 -6  36 9  o 118.6767 3.418554 173.6184       9.876227 155.9010       18.54159 180.6363       11.66942 110.4840 6.921479 120.8111 3.969140 -10.32706      7.978781 
1 1 1 -6  36 10 f 40.99144 5.210647 21.32738       5.087535 24.12884       9.473481 20.19199       6.031002 41.96236 9.487720 39.44153 6.501102 2.520836       11.50135 
1 1 1 -6  36 11 o 32.12199 6.101463 13.44544       4.601500 12.07373       8.641010 13.98839       5.436438 30.19393 10.04323 32.47845 7.069917 -2.284525      12.28211 
1 1 1 -6  36 12 o 22.94301 6.901029 6.858385       4.171135 2.019614       7.644678 8.909582       4.977317 21.05816 8.833324 25.89948 7.473404 -4.841328      11.57063 
1 1 1 -6  36 13 o 35.69333 5.677183 16.46459       4.772851 3.090866       9.386085 21.12874       5.542993 23.39878 9.799666 40.48823 5.782000 -17.08945      11.37827 
1 1 1 -6  36 14 o 67.20309 4.167925 56.46230       6.792077 0.000000       0.000000 56.46230       6.792077 ?        ?        67.20309 4.167925 0.000000       4.167925 
1 1 1 -6  36 15 o 51.54323 4.080124 33.31703       5.083072 27.73985       9.327107 35.67326       6.062463 44.72516 8.871089 53.08973 4.735665 -8.364574      10.05598 
1 1 1 -6  36 16 o 25.48748 6.585769 8.745144       4.119550 11.47479       8.365626 7.871321       4.733223 28.89441 9.882050 24.22299 7.365350 4.671417       12.32491 
1 1 1 -6  36 17 o 26.64492 5.971923 9.486465       3.781449 7.359285       7.126459 10.32011       4.461312 24.43653 9.036903 27.57333 6.705153 -3.136808      11.25276 
1 1 1 -6  36 18 o 77.15008 3.479518 74.29919       6.524878 66.74157       12.70228 77.00819       7.604901 70.10075 7.554869 78.24746 4.001583 -8.146706      8.549193 
1 1 1 -6  36 19 o 77.79993 3.886145 76.22504       7.344414 62.77625       11.93898 84.41290       9.315592 67.83450 7.339122 81.25974 4.724720 -13.42524      8.728442 
1 1 1 -6  36 20 f 46.61644 4.193590 27.73976       4.713018 27.20083       9.846537 27.89992       5.367858 42.25103 9.759886 46.42297 4.814787 -4.171940      10.88290 
1 1 1 -6  36 21 o 39.40716 4.571638 20.16036       4.308817 20.30046       9.203712 20.12104       4.876195 35.59430 10.12838 38.99062 5.266516 -3.396313      11.41579 
1 1 1 -6  36 22 o 41.96194 4.411213 22.86662       4.443382 6.581470       8.925274 28.23286       5.123429 23.44081 9.663773 46.56151 4.574401 -23.12070      10.69176 
1 1 1 -6  36 23 o 73.99758 3.219584 69.08788       5.791790 70.08047       9.991214 68.58553       7.107900 71.90646 5.749697 73.04453 4.008533 -1.138069      7.009091 
1 1 1 -6  36 24 o 72.14707 3.272158 65.96204       5.737955 47.70591       9.363786 76.93918       7.260915 57.81779 6.774201 77.34988 3.864321 -19.53208      7.798896 
1 1 1 -6  36 25 o 45.03571 5.278309 27.63121       5.683001 40.11391       11.93214 23.96888       6.463130 47.63670 10.55650 40.60607 6.769753 7.030628       12.54071 
1 1 1 -6  36 26 o 35.36774 5.174662 17.21666       4.327947 18.01503       6.318103 16.51084       5.940608 33.81519 7.822779 32.51006 7.630332 1.305130       10.92785 
1 1 1 -6  36 27 o 12.95768 5.662902 0.3445724      3.388139 -0.5359555     5.748418 0.8132988      4.194078 15.31192 6.978544 14.46062 6.310505 0.8513041      9.408642 
1 1 1 -6  36 28 o 19.32247 7.079168 5.693390       4.356296 4.306874       8.059851 6.265598       5.177756 19.44296 8.606450 20.02754 7.639092 -0.5845795     11.50768 
1 1 1 -6  36 29 o 15.43693 6.279570 2.758268       3.705961 12.91206       8.150839 0.1121886      4.160922 24.75134 9.547923 13.54971 6.078193 11.20163       11.31845 
1 1 1 -6  36 30 o 24.51749 7.734496 10.77244       5.164801 15.98271       6.888546 4.083043       7.805322 28.34443 8.931174 18.39922 8.283263 9.945210       12.18106 
1 1 1 -6  36 31 o 12.84531 5.631902 0.7683814      3.375093 4.286599       5.830222 -1.004914      4.139180 17.51106 7.541188 12.49853 5.778500 5.012528       9.500557 
1 1 1 -6  36 32 o 10.86022 5.068075 -1.541569      3.300381 7.522862       6.057720 -5.367973      3.935812 19.83935 8.043921 9.908432 4.851230 9.930920       9.393566 
1 1 1 -6  37 1  o 84.70810 3.017418 88.38549       6.218737 91.18601       9.009810 85.83741       8.594150 85.55319 4.335723 83.03099 4.261691 2.522202       6.079515 
1 1 1 -6  37 2  o 48.00328 3.672649 28.63702       4.263597 24.52508       5.775404 33.56208       6.320696 43.84850 5.527519 51.54711 5.098526 -7.698616      7.519869 
1 1 1 -6  37 3  o 17.59475 6.418269 3.312035       3.575046 2.914750       4.379262 4.105797       6.190060 18.06367 6.990388 21.23737 8.285015 -3.173700      10.84007 
1 1 1 -6  37 4  o 68.75596 3.149081 58.33287       5.262299 59.21065       7.440475 57.45435       7.443555 68.84267 4.459125 67.78221 4.532434 1.060455       6.358203 
1 1 1 -6  37 5  o 63.79657 3.219877 50.27599       4.989606 49.76928       7.124694 50.76373       6.989971 63.00224 4.673890 63.68431 4.533736 -0.6820717     6.511529 
1 1 1 -6  37 6  o 69.90022 3.181191 60.32661       5.404612 53.33230       7.671743 67.21806       7.615121 65.13564 4.868469 73.41208 4.275200 -8.276443      6.479146 
1 1 1 -6  37 7  o 53.60875 3.498789 35.65259       4.545796 30.02462       6.444942 41.22428       6.412633 48.50866 5.552003 57.29245 4.632545 -8.783791      7.230852 
1 1 1 -6  37 8  o 79.35439 3.035357 77.67670       5.858889 76.52119       8.525765 78.71067       8.064873 78.19523 4.493134 79.44944 4.180241 -1.254211      6.136992 
1 1 1 -6  37 9  o 21.89498 7.017200 6.145091       4.237292 13.74251       7.755027 2.911564       5.059278 31.48924 9.395450 18.78732 7.441076 12.70193       11.98516 
1 1 1 -6  37 10 o 86.10925 3.515522 91.95139       7.361420 95.94783       14.33836 90.52094       8.578292 85.87006 6.910376 85.14580 4.146766 0.7242584      8.059092 
1 1 1 -6  37 11 o 33.21706 5.756432 14.40555       4.490865 22.01085       7.898780 10.77286       5.459040 40.00710 8.371186 28.11255 7.729338 11.89454       11.39383 
1 1 1 -6  37 12 o 31.56860 6.794965 13.38974       5.072394 0.000000       0.000000 13.38974       5.072394 ?        ?        31.56860 6.794965 0.000000       6.794965 
1 1 1 -6  37 13 o 13.52269 5.954722 -0.6768795     3.810758 3.445330       7.518431 -2.102003      4.420674 21.56906 8.878491 13.55126 6.154082 8.017793       10.80279 
1 1 1 -6  37 14 o 42.83337 4.668670 23.42046       4.794386 5.329790       8.668814 31.39241       5.754594 23.74833 9.624879 49.58389 4.823421 -25.83555      10.76586 
1 1 1 -6  37 15 o 26.17645 6.435840 9.311939       4.076096 15.27772       8.490417 7.525132       4.646587 32.13004 9.882951 23.55514 7.322498 8.574900       12.30007 
1 1 1 -6  37 16 o 49.36523 4.143019 30.90784       4.938017 28.61667       10.19248 31.61056       5.644711 43.82294 9.791301 49.64001 4.723160 -5.817078      10.87096 
1 1 1 -6  37 17 o 54.16835 3.945967 37.14283       5.173046 32.06617       10.07663 38.95958       6.028017 46.70431 9.181104 55.16462 4.523830 -8.460308      10.23512 
1 1 1 -6  37 18 o 21.16694 7.179561 6.000145       4.414336 15.91515       8.105812 1.819780       5.263288 32.09123 9.612815 17.45446 7.326077 14.63677       12.08626 
1 1 1 -6  37 19 o 24.44774 6.416614 8.371655       3.870318 11.57297       8.067846 7.414702       4.411016 27.47421 9.686800 22.91887 7.136019 4.555338       12.03150 
1 1 1 -6  37 20 o 10.26255 4.907223 -4.102899      3.465871 -7.382924      7.178547 -3.105904      3.957714 14.58124 6.996208 11.77115 5.511639 2.810092       8.906464 
1 1 1 -6  37 21 o 25.71706 7.093759 9.715236       4.589734 2.629402       8.143605 13.01378       5.556256 20.13063 8.788939 29.42861 7.670800 -9.297981      11.66562 
1 1 1 -6  37 22 o 28.70768 6.901901 12.09506       4.768676 13.64636       8.635833 11.41453       5.719799 28.14538 10.01255 27.09341 8.065326 1.051970       12.85693 
1 1 1 -6  37 23 o 50.04006 4.802468 33.42131       5.784429 32.12624       10.34295 34.01074       6.977680 43.25451 10.01075 49.41937 5.911095 -6.164856      11.62567 
1 1 1 -6  37 24 o 35.78328 5.825778 18.07654       4.905476 0.000000       0.000000 18.07654       4.905476 ?        ?        35.78328 5.825778 0.000000       5.825778 
1 1 1 -6  37 25 o 13.66214 5.938371 0.6119031      3.682856 3.508250       7.557988 -0.2899474     4.217433 19.24020 8.431971 13.67656 6.128426 5.563638       10.42381 
1 1 1 -6  37 26 o 14.23809 6.027829 1.456452       3.612820 -5.643059      7.158718 3.882599       4.184846 14.36229 6.915648 17.27351 6.790403 -2.911225      9.692045 
1 1 1 -6  37 27 o 30.07223 6.852097 14.26719       4.909058 15.91680       8.643277 13.48166       5.964439 27.26039 9.974098 27.55813 8.243768 -0.2977448     12.93995 
1 1 1 -6  37 28 o 16.68964 6.426193 3.930434       3.687387 4.542789       6.577754 3.649811       4.452843 18.42101 7.971829 16.75177 6.857183 1.669233       10.51528 
1 1 1 -6  37 29 o 13.59796 6.025139 0.7271817      3.959764 2.864995       6.064906 -0.8612074     5.227784 16.83023 7.457030 13.93291 6.459931 2.897321       9.866003 
1 1 1 -6  37 30 o 29.33750 5.784513 13.19804       3.988439 18.29976       7.007750 10.75364       4.850724 29.97594 8.928266 24.44467 7.460902 5.531273       11.63525 
1 1 1 -6  38 1  o 44.31091 4.270492 24.75000       4.554261 24.46120       5.656119 25.28242       7.679851 43.60652 5.440726 43.35146 7.543470 0.2550621      9.300830 
1 1 1 -6  38 2  o 57.30401 3.639712 40.91399       5.056360 37.68227       6.103708 47.98288       9.027194 54.61219 4.629952 60.87611 6.170256 -6.263916      7.714176 
1 1 1 -6  38 3  o 14.57572 6.040678 0.9619275      3.512373 -0.9717633     4.201887 5.446814       6.399213 14.02459 6.210776 22.40034 8.504727 -8.375746      10.53110 
1 1 1 -6  38 4  o 46.73992 4.229367 27.50291       4.765173 31.96848       5.959471 19.58631       7.934847 50.13706 4.941853 37.40578 8.844930 12.73129       10.13186 
1 1 1 -6  38 5  o 36.61555 4.871850 17.15986       4.239287 16.98421       5.191893 17.51122       7.343094 35.93719 6.149437 35.42265 8.595192 0.5145416      10.56849 
1 1 1 -6  38 6  o 33.29165 5.241736 14.34844       4.112066 14.38042       5.194368 14.29475       6.730181 32.75871 6.732062 31.99716 8.491561 0.7615471      10.83639 
1 1 1 -6  38 7  o 19.32868 6.549074 4.625860       3.672999 5.882792       4.544261 2.257336       6.238011 21.54504 7.284618 19.39923 8.045907 2.145805       10.85368 
1 1 1 -6  38 8  o 34.32917 4.736514 15.11306       3.856917 11.65405       5.200454 19.34151       5.749840 29.17544 7.325943 38.20703 6.401823 -9.031591      9.728966 
1 1 1 -6  38 9  o 44.54185 4.678546 25.28692       5.002547 25.98433       9.184154 24.99272       5.965105 42.75966 9.093927 43.81461 5.723496 -1.054943      10.74514 
1 1 1 -6  38 10 o 60.74103 4.786161 46.99303       7.027240 0.000000       0.000000 46.99303       7.027240 ?        ?        60.74103 4.786161 0.000000       4.786161 
1 1 1 -6  38 11 o 66.40006 4.579875 56.02134       7.365287 0.000000       0.000000 56.02134       7.365287 ?        ?        66.40006 4.579875 0.000000       4.579875 
1 1 1 -6  38 12 o 27.96900 6.308469 10.61742       4.196918 5.586996       7.682299 12.75749       5.010749 22.99001 9.148732 30.45298 6.910966 -7.462971      11.46563 
1 1 1 -6  38 13 o 73.61195 3.720844 68.07803       6.652963 80.91311       13.13157 63.64580       7.716637 77.38439 7.040497 70.67596 4.503869 6.708435       8.357837 
1 1 1 -6  38 14 o 81.94560 4.139956 85.13177       8.240398 61.06369       13.13334 100.7592       10.58274 65.52782 8.418856 88.45975 4.928751 -22.93193      9.755496 
1 1 1 -6  38 15 o 77.11970 4.187980 75.72023       7.841033 64.20675       13.08552 82.17012       9.794086 67.14195 8.165305 79.55358 5.078574 -12.41163      9.615827 
1 1 1 -6  38 16 o 67.20307 5.311290 59.37925       8.627444 52.02174       11.99675 67.26019       12.41616 59.68214 8.487650 69.15870 7.486457 -9.476559      11.31756 
1 1 1 -6  38 17 o 26.96369 7.077217 10.47726       4.708141 8.704914       7.658672 11.55394       5.969306 24.66299 9.317676 27.71693 8.236514 -3.053942      12.43621 
1 1 1 -6  38 18 o 56.06080 4.573564 40.99650       6.193884 33.42445       10.49600 45.04230       7.672189 45.67533 9.728119 57.94986 5.498683 -12.27452      11.17461 
1 1 1 -6  38 19 o 11.81980 5.518504 -2.794734      3.920670 -2.151882      6.007290 -3.271744      5.174723 15.28651 7.029208 13.56436 6.335292 1.722153       9.462859 
1 1 1 -6  38 20 o 19.18715 6.702162 5.052138       3.856097 0.4487942      7.549179 6.677217       4.485392 18.20597 8.175391 21.45090 7.237310 -3.244936      10.91859 
1 1 1 -6  38 21 o 16.05662 6.250231 2.875651       3.516755 6.300529       7.716089 1.977686       3.950975 21.79549 8.985392 15.52379 6.417671 6.271701       11.04191 
1 1 1 -6  38 22 o 30.18373 6.122618 13.12511       4.349260 2.616176       8.210681 17.22389       5.127755 19.46371 8.647271 34.51151 6.330367 -15.04779      10.71676 
1 1 1 -6  38 23 o 14.98252 6.460442 1.224043       4.289363 0.000000       0.000000 1.224043       4.289363 ?        ?        14.98252 6.460442 0.000000       6.460442 
1 1 1 -6  38 24 o 12.36781 5.571593 -0.5757673     3.537988 0.9745254      7.187538 -1.071524      4.064504 17.32477 7.859589 12.81089 5.849930 4.513877       9.797694 
1 1 1 -6  38 25 o 23.92685 6.821676 9.107656       4.171058 4.090221       8.146348 10.89039       4.855848 19.23532 8.575375 25.69712 7.371341 -6.461803      11.30813 
1 1 1 -6  38 26 o 26.35840 6.445477 10.88387       4.105054 14.23661       7.241812 9.296487       4.982964 26.61499 9.191027 23.16992 7.623585 3.445063       11.94127 
1 1 1 -6  38 27 o 14.50406 6.246659 1.677573       4.000924 -2.638216      5.966850 5.203031       5.392905 13.88612 6.582543 18.43930 7.546983 -4.553175      10.01433 
1 1 1 -6  38 28 o 10.36066 4.929074 -2.771432      3.405725 -2.344488      5.904930 -2.984250      4.169014 13.80516 6.545373 11.44112 5.446051 2.364042       8.514774 
1 1 1 -6  39 1  o 78.54610 3.036150 76.59357       5.800498 64.79680       8.026970 89.48598       8.391451 71.34878 4.641871 84.27677 4.098237 -12.92799      6.192133 
1 1 1 -6  39 2  o 22.89477 6.131927 7.078032       3.489478 8.113433       4.633578 5.721449       5.303775 24.32418 7.263629 21.57543 7.825328 2.748749       10.67689 
1 1 1 -6  39 3  o 12.32921 5.396203 -0.3867567     3.086499 -0.1298846     4.039957 -0.7468988     4.783604 14.29559 6.216599 15.00382 6.636452 -0.7082281     9.093327 
1 1 1 -6  39 4  o 40.08274 4.159501 20.41519       4.003889 16.63080       5.333669 25.30111       6.060405 35.12949 6.468716 43.87067 5.811616 -8.741180      8.695929 
1 1 1 -6  39 5  o 42.57970 4.063962 22.98260       4.165758 26.50478       5.804498 19.24165       5.982055 45.12513 5.384620 37.66793 6.765566 7.457199       8.646792 
1 1 1 -6  39 6  f 44.57410 3.791563 25.06050       4.079429 19.15443       5.549397 32.00461       6.017341 37.83361 6.236193 49.80545 5.026534 -11.97184      8.009753 
1 1 1 -6  39 7  f 56.28470 3.375047 39.62448       4.607940 31.69465       6.595494 47.18597       6.440494 49.20318 5.600254 60.92253 4.367126 -11.71935      7.101734 
1 1 1 -6  39 8  o 25.84571 5.578430 8.954830       3.410332 10.10763       4.638430 7.598436       5.031375 26.95532 6.999985 23.55385 7.655073 3.401468       10.37304 
1 1 1 -6  39 9  o 24.14014 7.617170 8.108836       5.009037 0.000000       0.000000 8.108836       5.009037 ?        ?        24.14014 7.617170 0.000000       7.617170 
1 1 1 -6  39 10 o 24.15816 6.885382 8.128101       4.250009 7.063229       7.551518 8.621759       5.141606 23.78945 9.186653 24.72563 7.705256 -0.9361820     11.99023 
1 1 1 -6  39 11 f 11.76915 5.422853 -2.225574      3.601017 1.630480       6.927097 -3.653515      4.215361 19.09010 8.220601 12.02747 5.649640 7.062621       9.974804 
1 1 1 -6  39 12 o 50.55742 4.140228 32.69763       5.056242 45.15105       9.938094 28.34820       5.873204 56.79183 7.353391 46.36460 5.292899 10.42723       9.060195 
1 1 1 -6  39 13 o 40.86252 4.936788 21.93604       4.816403 19.43681       9.335489 22.84259       5.622473 34.43469 10.31656 41.19442 5.757909 -6.759727      11.81461 
1 1 1 -6  39 14 o 28.08036 6.388572 11.08254       4.272789 15.82783       8.581246 9.518229       4.926984 31.07879 9.988584 25.51723 7.456805 5.561560       12.46498 
1 1 1 -6  39 15 o 22.38188 7.463695 7.192487       4.771667 2.865920       7.912979 9.664748       5.981574 20.23228 8.749619 25.27138 8.354315 -5.039106      12.09754 
1 1 1 -6  39 16 o 26.42311 6.524888 10.02145       4.176061 1.410379       8.090359 13.14911       4.875832 19.38156 8.598722 30.18709 6.792793 -10.80553      10.95811 
1 1 1 -6  39 17 o 55.15067 3.998123 39.28076       5.336840 28.28275       10.18950 43.43827       6.264877 40.63190 10.28355 57.58205 4.500394 -16.95015      11.22519 
1 1 1 -6  39 18 o 12.35286 5.575138 -0.9892318     3.561361 2.571526       7.329176 -2.089847      4.074758 19.18194 8.356924 12.45272 5.748814 6.729218       10.14332 
1 1 1 -6  39 19 o 28.69604 6.297683 11.91881       4.282780 -6.826312      8.055324 19.30562       5.056702 15.34318 7.374617 37.16261 5.770849 -21.81943      9.364169 
1 1 1 -6  39 20 o 17.62931 6.732761 3.977514       4.025264 7.094891       8.245301 3.002081       4.612224 22.15174 9.224143 17.03179 6.976120 5.119953       11.56508 
1 1 1 -6  39 21 o 14.44333 6.086070 1.479227       3.654854 4.950871       7.301415 0.3185025      4.221862 20.04346 8.530665 14.14732 6.247158 5.896133       10.57352 
1 1 1 -6  39 22 o 24.03541 7.401790 9.354524       4.760733 0.000000       0.000000 9.354524       4.760733 ?        ?        24.03541 7.401790 0.000000       7.401790 
1 1 1 -6  39 23 o 16.55436 6.499891 3.540565       3.830459 11.54780       8.287542 1.365349       4.319522 24.14459 9.536014 14.85205 6.443575 9.292539       11.50892 
1 1 1 -6  39 24 o 57.97906 4.736783 46.56905       6.634257 67.23488       12.76213 38.91648       7.766051 61.82051 8.712728 50.51878 6.455589 11.30172       10.84372 
1 1 1 -6  39 25 o 20.20930 7.021821 6.742869       4.229688 4.124362       8.213863 7.687774       4.934174 18.72055 8.456269 21.08650 7.560806 -2.365957      11.34347 
1 1 1 -6  39 26 o 20.42147 7.983320 7.540557       5.757201 7.392728       8.115880 7.690299       8.168196 20.17775 8.792336 20.35644 8.845987 -0.1786880     12.47224 
1 1 1 -6  40 1  o 13.51829 5.626841 0.9212396      3.066412 1.293817       4.010938 0.3971645      4.757011 15.35724 6.417099 15.61613 6.768605 -0.2588978     9.327013 
1 1 1 -6  40 2  o 48.80062 3.584592 30.09328       4.233118 27.79396       5.891328 32.54747       6.086506 45.89254 5.369241 49.89447 5.076489 -4.001926      7.389147 
1 1 1 -6  40 3  o 29.55893 5.073422 11.58675       3.522918 10.09429       4.739178 13.43003       5.266804 26.63621 7.151442 30.77103 7.158974 -4.134823      10.11899 
1 1 1 -6  40 4  o 50.21730 4.002883 32.14629       4.857976 27.00117       6.128297 40.84676       7.969172 44.98252 5.719788 55.18726 6.023350 -10.20473      8.306426 
1 1 1 -6  40 5  o 21.20374 6.066825 6.174162       3.293305 2.849100       4.347501 10.65133       5.044769 17.32514 6.886269 27.21017 7.409742 -9.885036      10.11558 
1 1 1 -6  40 6  o 34.66624 4.515766 15.63447       3.724234 14.74586       5.337961 16.47727       5.198531 32.31478 6.982715 34.56774 6.407133 -2.252956      9.476796 
1 1 1 -6  40 7  o 14.85946 6.032938 1.672337       3.412787 2.003963       5.382580 1.449394       4.413290 17.61349 7.401715 15.98667 6.709147 1.626822       9.989897 
1 1 1 -6  40 8  o 79.17587 3.046725 78.44935       5.867472 77.80281       8.548244 79.02532       8.068258 77.61707 4.539241 78.51488 4.232531 -0.8978119     6.206370 
1 1 1 -6  40 9  o 20.72237 7.046813 5.875393       4.252888 0.5973434      7.395524 8.483232       5.198434 18.59929 8.238007 24.14494 7.775702 -5.545650      11.32812 
1 1 1 -6  40 10 o 31.11908 5.993495 13.37827       4.380225 14.96518       7.448831 12.53948       5.415505 30.68545 9.220373 29.14937 7.560576 1.536079       11.92382 
1 1 1 -6  40 11 o 47.32194 4.459743 29.17498       5.082260 21.46721       9.140739 32.62394       6.114501 35.90297 10.05159 49.55226 5.138107 -13.64928      11.28869 
1 1 1 -6  40 12 o 12.21380 5.574065 -1.590965      3.683338 -8.396134      5.947242 2.643627       4.691395 12.50956 6.089316 17.19911 7.039169 -4.689547      9.307506 
1 1 1 -6  40 13 o 14.90000 6.512571 0.3381701      4.482361 -3.590224      6.922782 3.173889       5.881726 15.66210 7.319176 18.68386 7.786223 -3.021770      10.68623 
1 1 1 -6  40 14 o 14.78515 6.239778 1.242990       3.851406 1.265452       6.242207 1.229183       4.893982 17.52991 7.673193 16.07418 6.915655 1.455730       10.32977 
1 1 1 -6  40 15 o 15.89016 6.555493 2.111957       4.110957 -0.4469742     7.424767 3.243242       4.936732 17.53902 7.969181 17.77826 7.241824 -0.2392349     10.76809 
1 1 1 -6  40 16 o 32.38885 5.644831 14.63462       4.293490 7.760009       8.169700 17.25783       5.046594 22.93986 9.326584 34.81654 6.174129 -11.87668      11.18504 
1 1 1 -6  40 17 o 50.83683 4.270870 34.05349       5.242044 34.13639       10.68603 34.02721       6.015572 43.87649 10.18990 50.14647 4.988765 -6.269985      11.34556 
1 1 1 -6  40 18 o 23.97335 6.913495 8.812099       4.260635 10.35811       8.542275 8.300129       4.915735 24.30670 9.655502 22.93382 7.573181 1.372881       12.27118 
1 1 1 -6  40 19 o 11.47824 5.393485 -2.705000      3.847473 -12.97079      7.475359 0.9944305      4.487488 12.65548 6.285933 14.95819 6.527578 -2.302710      9.062131 
1 1 1 -6  40 20 o 17.23237 6.955492 3.660100       4.506316 0.000000       0.000000 3.660100       4.506316 ?        ?        17.23237 6.955492 0.000000       6.955492 
1 1 1 -6  40 21 o 15.93681 6.551368 2.818709       4.086576 -6.114004      8.309032 5.668871       4.693465 15.10074 7.314898 19.22880 7.287498 -4.128060      10.32547 
1 1 1 -6  40 22 o 35.57058 5.303010 18.15587       4.456477 13.77550       8.863047 19.63807       5.155609 25.11088 9.878808 36.22866 6.053123 -11.11778      11.58582 
1 1 1 -6  40 23 o 24.10799 6.800495 9.481747       4.167529 11.13275       8.338162 8.931960       4.811651 23.04050 9.401712 22.71679 7.492187 0.3237171      12.02186 
1 1 1 -6  40 24 o 10.52615 5.013810 -2.973841      3.545341 -10.71117      7.369980 -0.6442466     4.043996 12.59927 6.255193 12.71261 5.816446 -0.1133394     8.541574 
1 1 1 -6  41 1  o 45.24638 3.955798 26.35786       4.317862 24.25920       6.177716 28.36231       6.037456 41.79501 6.257755 45.83820 5.515630 -4.043194      8.341563 
1 1 1 -6  41 2  f 42.32096 3.991710 23.09918       4.068084 26.26229       5.908047 20.24736       5.609810 44.00417 5.638953 38.14130 6.251964 5.862869       8.419313 
1 1 1 -6  41 3  o 19.97615 6.244738 5.553903       3.374368 10.01253       4.871177 1.440513       4.678788 26.02002 7.356489 16.11847 6.843306 9.901546       10.04733 
1 1 1 -6  41 4  o 12.45834 5.404017 0.9646703E-01  3.036991 2.926086       4.434710 -2.402586      4.167628 17.23260 6.919450 12.51903 5.791620 4.713570       9.023395 
1 1 1 -6  41 5  o 15.94182 6.296216 2.533875       3.612818 3.165126       6.012024 2.177069       4.519977 18.85840 7.866485 16.57836 6.859944 2.280037       10.43745 
1 1 1 -6  41 6  o 45.02682 5.173318 27.11280       5.573440 22.94441       8.383835 30.41381       7.460743 37.92312 9.173023 46.29900 6.816422 -8.375885      11.42838 
1 1 1 -6  41 7  o 28.63367 5.384187 11.21053       3.619062 9.794003       5.105840 12.64077       5.130502 25.52710 7.625278 29.26097 7.236035 -3.733868      10.51214 
1 1 1 -6  41 8  o 29.64657 5.178010 11.92631       3.604816 11.35914       5.174558 12.46110       5.024705 27.48629 7.512479 29.06560 7.145246 -1.579304      10.36783 
1 1 1 -6  41 9  o 37.28770 5.842367 19.23003       5.134503 17.20535       8.783963 20.28087       6.328181 31.44307 10.10590 37.17944 7.245073 -5.736370      12.43464 
1 1 1 -6  41 10 o 15.70160 6.385697 2.199942       3.831195 -3.082316      6.735672 4.726178       4.658092 15.58020 7.260560 19.14505 7.259011 -3.564850      10.26689 
1 1 1 -6  41 11 o 17.96200 7.113132 3.696993       4.622518 6.803733       7.050798 1.355089       6.121676 22.06621 8.770011 17.36145 7.599120 4.704765       11.60430 
1 1 1 -6  41 12 o 19.20352 7.117386 4.993093       4.424918 3.922527       6.351195 6.002910       6.168367 19.31670 8.073548 20.95546 8.242164 -1.638767      11.53757 
1 1 1 -6  41 13 o 12.43716 5.692923 -1.520569      3.879710 6.408300       7.380173 -4.548531      4.560749 21.60615 8.834213 11.81720 5.644765 9.788953       10.48364 
1 1 1 -6  41 14 o 34.83329 5.589510 16.99753       4.584221 23.47331       8.690437 14.50088       5.396033 36.54437 9.626392 30.70360 7.316287 5.840771       12.09113 
1 1 1 -6  41 15 o 35.54012 6.636746 18.71513       5.536586 21.66248       9.338200 17.11742       6.875366 33.53355 10.37342 31.84751 8.641007 1.686041       13.50092 
1 1 1 -6  41 16 o 20.91331 6.815351 6.670447       3.986654 1.520699       7.944423 8.403744       4.608991 18.30628 8.288179 23.03131 7.311619 -4.725035      11.05232 
1 1 1 -6  41 17 o 21.13679 6.933942 6.956268       4.123427 7.301900       8.125856 6.836402       4.785312 21.55132 9.077636 20.83961 7.448952 0.7117119      11.74267 
1 1 1 -6  41 18 o 24.01714 6.914660 9.184405       4.265389 1.610106       7.947542 12.24875       5.055110 17.94893 8.190044 27.37072 7.402201 -9.421791      11.03945 
1 1 1 -6  41 19 f 17.72145 7.044848 4.346093       4.550695 0.000000       0.000000 4.346093       4.550695 ?        ?        17.72145 7.044848 0.000000       7.044848 
1 1 1 -6  41 20 o 34.83938 5.655739 17.79470       4.637194 13.37629       8.367896 19.75297       5.570827 25.01879 9.668051 35.62199 6.662352 -10.60320      11.74130 
1 1 1 -6  41 21 o 13.08366 6.023598 -0.9592065     4.430218 -8.872989      8.007845 2.531284       5.318227 13.76382 6.775057 16.33039 7.116601 -2.566571      9.825854 
1 1 1 -6  41 22 o 11.70827 5.505396 -2.218376      4.021005 -0.5813687     8.801147 -2.650211      4.520360 16.80318 7.973827 12.17045 5.757442 4.632729       9.835144 
1 1 1 -6  42 1  o 14.14633 6.000772 1.046345       3.592296 2.503314       5.934337 0.2036693      4.513125 17.94113 7.664929 14.68162 6.472076 3.259507       10.03189 
1 1 1 -6  42 2  o 35.58940 5.549022 17.50427       4.655620 12.15523       8.496076 19.79971       5.565620 26.50694 9.855103 37.23281 6.362476 -10.72588      11.73048 
1 1 1 -6  42 3  o 14.25555 6.075995 0.9810612      3.713362 1.703554       6.092789 0.5540913      4.683796 17.51412 7.625061 15.17207 6.643767 2.342053       10.11342 
1 1 1 -6  42 4  o 15.83159 6.357209 2.484108       3.743498 3.391947       6.111648 1.938988       4.735871 18.75012 7.883687 16.35330 6.911314 2.396818       10.48422 
1 1 1 -6  42 5  o 17.74431 6.239414 4.241496       3.345572 -2.990203      4.382645 14.34084       5.179199 12.37269 5.795454 31.03472 7.013846 -18.66204      9.098424 
1 1 1 -6  42 6  o 53.52660 3.687375 36.91755       4.780368 34.38880       7.055608 39.06340       6.499503 49.57298 5.959938 53.86480 5.008923 -4.291828      7.785254 
1 1 1 -6  42 7  o 36.47883 4.723337 17.86908       4.100332 22.99465       6.205782 13.89772       5.462551 39.80352 6.631098 30.05500 7.486465 9.748520       10.00093 
1 1 1 -6  42 8  o 25.66001 6.105782 9.545343       3.762384 7.459469       4.791055 12.90116       6.076952 22.11715 7.479805 28.12603 8.298363 -6.008884      11.17185 
1 1 1 -6  42 9  o 11.66299 5.523827 -3.557072      4.184087 -3.049285      6.642889 -3.891000      5.386943 15.21302 7.128834 13.29243 6.287295 1.920583       9.505280 
1 1 1 -6  42 10 f 35.10153 6.776641 18.32849       5.586716 11.54027       8.664943 23.15799       7.308685 25.29842 9.821183 38.09419 8.121330 -12.79577      12.74408 
1 1 1 -6  42 11 o 22.70432 6.903788 7.907638       4.158538 9.449840       7.658254 7.262741       4.952270 23.57878 9.210448 21.61341 7.591902 1.965366       11.93605 
1 1 1 -6  42 12 o 21.86623 6.922702 7.369718       4.134181 11.07810       7.946467 5.993499       4.840896 24.70398 9.453600 20.04586 7.441645 4.658125       12.03115 
1 1 1 -6  42 13 o 67.21371 3.872751 59.24545       6.316418 77.55071       13.62541 54.23478       7.128682 69.00909 8.266577 63.32105 4.652297 5.688046       9.485787 
1 1 1 -6  42 14 o 28.23409 6.516964 12.14724       4.393009 15.13498       8.620855 11.09929       5.105635 27.28446 9.964582 25.94714 7.593122 1.337324       12.52790 
1 1 1 -6  42 15 o 20.66560 7.602834 6.889923       5.032984 5.992419       8.354650 7.401166       6.305564 20.46045 8.918046 21.13255 8.326745 -0.6721001     12.20108 
1 1 1 -6  42 16 o 12.57523 5.677567 -0.4649187     3.697343 -3.405425      6.433972 0.9849202      4.517811 14.30868 6.798044 14.71570 6.481724 -0.4070206     9.392878 
1 1 1 -6  42 17 o 23.85425 7.628932 9.767956       5.010257 0.000000       0.000000 9.767956       5.010257 ?        ?        23.85425 7.628932 0.000000       7.628932 
1 1 1 -6  42 18 o 20.98910 6.902751 7.205234       4.085388 8.050894       9.432960 7.009987       4.532535 21.14479 9.337512 20.53084 7.258640 0.6139545      11.82696 
1 1 1 -6  42 19 o 28.19647 6.752939 12.80968       4.578801 16.71711       9.925790 11.75340       5.160710 25.93590 10.37312 25.89650 7.648971 0.3940010E-01  12.88830 
1 1 1 -6  43 1  o 13.30941 5.960500 -0.3219481     3.983297 8.388068       6.569944 -5.384636      5.008905 22.56197 8.605207 11.97871 5.772174 10.58326       10.36183 
1 1 1 -6  43 2  o 15.11941 6.400840 1.689384       4.073675 2.106401       6.371351 1.401027       5.298084 17.56045 7.717372 16.15410 7.070102 1.406345       10.46634 
1 1 1 -6  43 3  o 33.72007 5.095374 15.75070       4.056502 24.68419       5.833910 7.388453       5.644308 41.49700 5.938158 21.61824 8.033557 19.87876       9.989983 
1 1 1 -6  43 4  o 14.98425 6.032332 2.298013       3.379859 2.017726       4.579780 2.633251       5.008646 15.93086 6.767352 16.84233 7.112252 -0.9114733     9.817391 
1 1 1 -6  43 5  o 17.69674 6.758169 4.185030       4.055571 6.262231       7.334364 3.270186       4.867397 20.88711 8.698789 17.27136 7.130012 3.615746       11.24749 
1 1 1 -6  43 6  o 21.63564 6.911747 7.236523       4.113393 4.829593       7.638071 8.219748       4.881780 19.97662 8.617491 22.63028 7.549385 -2.653666      11.45663 
1 1 1 -6  43 7  o 13.36720 5.903848 0.1937185      3.772388 2.277422       7.374701 -0.5447395     4.390251 18.24242 8.144164 13.66088 6.175435 4.581532       10.22073 
1 1 1 -6  43 8  o 17.48643 7.143236 3.669769       4.819830 -7.208384      7.089814 13.01730       6.572124 13.79265 6.698932 26.98625 8.747368 -13.19360      11.01781 
1 1 1 -6  43 9  o 13.01450 5.996773 -1.457495      4.403843 -1.143060      6.820686 -1.682285      5.767022 15.88766 7.370562 14.57091 6.765774 1.316750       10.00504 
1 1 1 -6  43 10 o 49.01892 5.526550 34.21934       6.486734 43.32418       10.69522 28.92116       8.158619 49.56832 9.192600 41.45061 8.365713 8.117710       12.42936 
1 1 1 -6  43 11 o 23.08607 6.900088 8.500988       4.179931 1.129668       7.626246 11.66632       4.997443 17.48126 7.994178 26.63142 7.423568 -9.150158      10.90946 
1 1 1 -6  43 12 o 19.25961 6.796249 5.723982       3.971967 6.246047       7.675089 5.533018       4.641913 20.31540 8.699002 19.06046 7.241868 1.254936       11.31889 
1 1 1 -6  43 13 o 29.87614 6.132027 13.46215       4.314697 24.07119       9.062373 10.35233       4.906494 34.20406 10.14459 24.78799 7.490982 9.416075       12.61061 
1 1 1 -6  43 14 o 37.73044 5.339546 20.44798       4.772424 22.30737       9.292678 19.78187       5.561950 31.85329 10.40692 35.70752 6.636131 -3.854221      12.34270 
1 1 1 -6  43 15 o 18.38554 7.269540 5.108586       4.821107 5.143663       7.930094 5.088021       6.072116 19.30555 8.541681 18.71159 7.862249 0.5939617      11.60927 
1 1 1 -6  43 16 o 27.90278 7.216809 12.98961       4.943618 0.000000       0.000000 12.98961       4.943618 ?        ?        27.90278 7.216809 0.000000       7.216809 
1 1 1 -6  44 1  o 17.93068 6.488403 4.734684       3.643589 5.850046       5.635734 3.933675       4.775965 19.55692 7.818174 17.46623 7.119849 2.090693       10.57431 
1 1 1 -6  44 2  o 25.14737 5.867713 9.436710       3.529792 6.776919       5.042315 11.99268       4.942927 20.45285 7.594477 27.04804 7.321596 -6.595190      10.54902 
1 1 1 -6  44 3  o 25.10414 6.200367 9.604820       3.770457 8.047059       5.571038 10.92144       5.121716 21.73408 7.998400 25.42316 7.647065 -3.689074      11.06580 
1 1 1 -6  44 4  o 11.48024 5.284326 -1.342603      3.407088 -0.2684437     4.842314 -2.395758      4.794737 14.21214 6.448944 12.89998 6.048644 1.312160       8.841660 
1 1 1 -6  44 5  o 14.82956 6.126329 2.178433       3.596936 5.304365       5.381912 -0.3450005     4.835515 18.98103 7.622267 14.14612 6.428994 4.834906       9.971505 
1 1 1 -6  44 6  o 18.98734 6.946568 5.535914       4.192358 5.761057       5.462205 5.213145       6.540096 19.40132 7.716402 19.24190 8.126439 0.1594238      11.20633 
1 1 1 -6  44 7  o 9.409436 4.593180 -5.106724      3.451506 -6.536996      4.761344 -3.522837      5.010514 10.96835 5.362885 12.58528 5.984928 -1.616937      8.036161 
1 1 1 -6  44 8  o 13.12036 5.761693 0.5145330      3.545211 -1.794945      4.692367 3.586216       5.411569 13.04348 6.072250 17.41790 7.375832 -4.374416      9.553802 
1 1 1 -6  44 9  o 21.73513 7.258189 7.864144       4.512249 13.94453       8.094267 5.122606       5.435119 25.74346 9.609845 18.67249 7.601388 7.070974       12.25276 
1 1 1 -6  44 10 o 14.87927 6.493103 1.451961       4.440161 3.845702       7.200347 -0.1684381E-01 5.640231 18.36591 8.131911 15.04551 6.878263 3.320404       10.65075 
1 1 1 -6  44 11 o 14.43876 6.397231 0.8955474      4.463163 7.326398       7.676733 -2.388059      5.485520 20.60319 8.757240 13.59571 6.404482 7.007476       10.84927 
1 1 1 -6  44 12 o 27.09494 7.471781 12.51435       5.092720 18.31129       8.734498 9.528618       6.268500 28.54735 10.07785 22.51900 8.446494 6.028349       13.14939 
1 1 1 -6  45 1  o 19.39027 6.488473 5.941486       3.605699 6.912162       4.912692 4.807985       5.308765 20.26682 7.501635 18.19920 7.472672 2.067619       10.58845 
1 1 1 -6  45 2  o 12.61373 5.686296 -0.2507439     3.692436 -3.186339      4.794200 4.029788       5.789178 12.35027 5.867766 17.75994 7.578584 -5.409666      9.584655 
1 1 1 -6  45 3  o 10.57775 4.967237 -2.147759      3.254487 -1.377311      4.667204 -2.876940      4.540491 13.15415 6.100556 12.16678 5.760023 0.9873676      8.390151 
1 1 1 -5  0  1  o 896.1298 18.12251 9826.918       395.3890 9826.918       395.3890 9826.918       395.3890 896.1298 18.12251 896.1298 18.12251 0.000000       0.000000 
1 1 1 -5  0  2  o 383.1102 8.021530 1791.786       74.81474 1791.786       74.81474 1791.786       74.81474 383.1102 8.021530 383.1102 8.021530 0.000000       0.000000 
1 1 1 -5  0  3  o 894.8499 18.09572 9799.132       394.2405 9799.132       394.2405 9799.132       394.2405 894.8499 18.09572 894.8499 18.09572 0.000000       0.000000 
1 1 1 -5  0  4  o 340.5108 7.209408 1415.375       59.76225 1415.375       59.76225 1415.375       59.76225 340.5108 7.209408 340.5108 7.209408 0.000000       0.000000 
1 1 1 -5  0  5  o 560.6912 16.26962 3850.547       221.8751 3850.547       221.8751 3850.547       221.8751 560.6912 16.26962 560.6912 16.26962 0.000000       0.000000 
1 1 1 -5  0  6  o 621.0933 12.66025 4714.389       191.4379 4714.389       191.4379 4714.389       191.4379 621.0933 12.66025 621.0933 12.66025 -0.000000      0.000000 
1 1 1 -5  0  7  o 374.8888 7.873354 1715.972       71.85646 1715.972       71.85646 1715.972       71.85646 374.8888 7.873354 374.8888 7.873354 0.000000       0.000000 
1 1 1 -5  0  8  o 306.0825 6.581157 1143.772       49.03694 1143.772       49.03694 1143.772       49.03694 306.0825 6.581157 306.0825 6.581157 0.000000       0.000000 
1 1 1 -5  0  9  o 48.28625 2.943401 28.72808       3.433663 28.72808       3.433663 28.72808       3.433663 48.28625 2.943401 48.28625 2.943401 -0.000000      0.000000 
1 1 1 -5  0  10 o 91.19648 3.156329 101.7162       6.995425 101.7162       6.995425 101.7162       6.995425 91.19648 3.156329 91.19648 3.156329 0.000000       0.000000 
1 1 1 -5  0  11 o 52.47493 4.615599 34.33520       5.792519 34.33520       5.792519 34.33520       5.792519 52.47493 4.615599 52.47493 4.615599 0.000000       0.000000 
1 1 1 -5  0  12 o 472.8195 9.787329 2731.594       112.6615 2731.594       112.6615 2731.594       112.6615 472.8195 9.787329 472.8195 9.787329 -0.000000      0.000000 
1 1 1 -5  0  13 o 211.9571 4.949544 548.4784       25.53372 548.4784       25.53372 548.4784       25.53372 211.9571 4.949544 211.9571 4.949544 -0.000000      0.000000 
1 1 1 -5  0  14 o 484.0883 10.01510 2862.284       118.0310 2862.284       118.0310 2862.284       118.0310 484.0883 10.01510 484.0883 10.01510 -0.000000      0.000000 
1 1 1 -5  0  15 o 65.11870 3.351320 52.08242       5.285787 52.08242       5.285787 52.08242       5.285787 65.11870 3.351320 65.11870 3.351320 -0.000000      0.000000 
1 1 1 -5  0  16 o 436.0036 9.106172 2320.890       96.65722 2320.890       96.65722 2320.890       96.65722 436.0036 9.106172 436.0036 9.106172 0.000000       0.000000 
1 1 1 -5  0  17 o 600.5571 12.30350 4405.391       179.8902 4405.391       179.8902 4405.391       179.8902 600.5571 12.30350 600.5571 12.30350 -0.000000      0.000000 
1 1 1 -5  0  18 o 387.1213 8.200937 1829.467       77.28702 1829.467       77.28702 1829.467       77.28702 387.1213 8.200937 387.1213 8.200937 -0.000000      0.000000 
1 1 1 -5  0  19 o 523.6514 15.31033 3356.620       194.9941 3356.620       194.9941 3356.620       194.9941 523.6514 15.31033 523.6514 15.31033 -0.000000      0.000000 
1 1 1 -5  0  20 o 344.0891 7.415716 1445.393       62.11615 1445.393       62.11615 1445.393       62.11615 344.0891 7.415716 344.0891 7.415716 -0.000000      0.000000 
1 1 1 -5  0  21 o 120.4135 4.002494 177.2837       11.71527 177.2837       11.71527 177.2837       11.71527 120.4135 4.002494 120.4135 4.002494 -0.000000      0.000000 
1 1 1 -5  0  22 o 184.6108 4.758657 416.2097       21.37593 416.2097       21.37593 416.2097       21.37593 184.6108 4.758657 184.6108 4.758657 -0.000000      0.000000 
1 1 1 -5  0  23 o 429.8152 9.060349 2256.925       94.80410 2256.925       94.80410 2256.925       94.80410 429.8152 9.060349 429.8152 9.060349 -0.000000      0.000000 
1 1 1 -5  0  24 o 121.9413 6.024968 182.6364       17.80350 182.6364       17.80350 182.6364       17.80350 121.9413 6.024968 121.9413 6.024968 -0.000000      0.000000 
1 1 1 -5  0  25 o 247.0424 5.760493 745.4883       34.63647 745.4883       34.63647 745.4883       34.63647 247.0424 5.760493 247.0424 5.760493 0.000000       0.000000 
1 1 1 -5  0  26 o 29.76398 8.616665 13.19888       5.421892 13.19888       5.421892 13.19888       5.421892 29.76398 8.616665 29.76398 8.616665 0.000000       0.000000 
1 1 1 -5  0  27 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -5  0  28 o 459.5993 9.698215 2590.081       108.5102 2590.081       108.5102 2590.081       108.5102 459.5993 9.698215 459.5993 9.698215 0.000000       0.000000 
1 1 1 -5  0  29 o 72.49156 4.293335 64.77370       7.522878 64.77370       7.522878 64.77370       7.522878 72.49156 4.293335 72.49156 4.293335 -0.000000      0.000000 
1 1 1 -5  0  30 o 138.7091 5.890221 236.2713       19.82820 236.2713       19.82820 236.2713       19.82820 138.7091 5.890221 138.7091 5.890221 0.000000       0.000000 
1 1 1 -5  0  31 o 232.5594 7.816876 664.4889       44.18640 664.4889       44.18640 664.4889       44.18640 232.5594 7.816876 232.5594 7.816876 0.000000       0.000000 
1 1 1 -5  0  32 o 66.34594 4.734532 54.55805       7.563393 54.55805       7.563393 54.55805       7.563393 66.34594 4.734532 66.34594 4.734532 -0.000000      0.000000 
1 1 1 -5  0  33 o 23.58466 9.760093 9.582272       5.572665 9.582272       5.572665 9.582272       5.572665 23.58466 9.760093 23.58466 9.760093 0.000000       0.000000 
1 1 1 -5  0  34 o 180.2681 4.956252 398.0212       21.73529 398.0212       21.73529 398.0212       21.73529 180.2681 4.956252 180.2681 4.956252 -0.000000      0.000000 
1 1 1 -5  0  35 o 91.87161 7.108010 105.3649       15.68855 105.3649       15.68855 105.3649       15.68855 91.87161 7.108010 91.87161 7.108010 0.000000       0.000000 
1 1 1 -5  0  36 o 93.55785 4.515987 107.7302       10.24109 107.7302       10.24109 107.7302       10.24109 93.55785 4.515987 93.55785 4.515987 0.000000       0.000000 
1 1 1 -5  0  37 o 88.48054 4.692912 96.57032       10.05332 96.57032       10.05332 96.57032       10.05332 88.48054 4.692912 88.48054 4.692912 0.000000       0.000000 
1 1 1 -5  0  38 o 16.09741 9.371271 3.929152       6.063933 3.929152       6.063933 3.929152       6.063933 16.09741 9.371271 16.09741 9.371271 0.000000       0.000000 
1 1 1 -5  0  39 o 38.85755 13.24381 24.51060       11.24664 24.51060       11.24664 24.51060       11.24664 38.85755 13.24381 38.85755 13.24381 0.000000       0.000000 
1 1 1 -5  0  40 o 105.2032 4.594450 136.5465       11.72748 136.5465       11.72748 136.5465       11.72748 105.2032 4.594450 105.2032 4.594450 0.000000       0.000000 
1 1 1 -5  0  41 o 12.53827 8.068700 0.2841526      5.664186 0.2841526      5.664186 0.2841526      5.664186 12.53827 8.068700 12.53827 8.068700 -0.000000      0.000000 
1 1 1 -5  0  42 o 30.37344 9.299963 14.40605       6.014782 14.40605       6.014782 14.40605       6.014782 30.37344 9.299963 30.37344 9.299963 0.000000       0.000000 
1 1 1 -5  0  43 o 16.40915 9.046044 4.942113       5.250482 4.942113       5.250482 4.942113       5.250482 16.40915 9.046044 16.40915 9.046044 0.000000       0.000000 
1 1 1 -5  0  44 o 26.04289 10.38859 12.25502       6.380776 12.25502       6.380776 12.25502       6.380776 26.04289 10.38859 26.04289 10.38859 0.000000       0.000000 
1 1 1 -5  0  45 o 23.51070 10.25580 10.64692       6.101685 10.64692       6.101685 10.64692       6.101685 23.51070 10.25580 23.51070 10.25580 -0.000000      0.000000 
1 1 1 -5  0  46 o 11.85646 7.816267 -0.5551588E-01 5.790281 -0.5551588E-01 5.790281 -0.5551588E-01 5.790281 11.85646 7.816267 11.85646 7.816267 0.000000       0.000000 
1 1 1 -5  0  47 o 15.32462 8.983455 4.798968       5.636474 4.798968       5.636474 4.798968       5.636474 15.32462 8.983455 15.32462 8.983455 0.000000       0.000000 
1 1 1 -5  0  48 o 24.72101 9.863008 12.22444       5.751132 12.22444       5.751132 12.22444       5.751132 24.72101 9.863008 24.72101 9.863008 0.000000       0.000000 
1 1 1 -5  0  49 o 8.727070 6.114649 -3.476722      4.895030 -3.476722      4.895030 -3.476722      4.895030 8.727070 6.114649 8.727070 6.114649 -0.000000      0.000000 
1 1 1 -5  0  50 o 11.90457 7.723413 2.119859       5.331924 2.119859       5.331924 2.119859       5.331924 11.90457 7.723413 11.90457 7.723413 -0.000000      0.000000 
1 1 1 -5  0  51 o 9.506968 6.493568 -0.6472915     4.703804 -0.6472915     4.703804 -0.6472915     4.703804 9.506968 6.493568 9.506968 6.493568 0.000000       0.000000 
1 1 1 -5  0  52 o 8.499052 5.999118 -3.091580      4.988005 -3.091580      4.988005 -3.091580      4.988005 8.499052 5.999118 8.499052 5.999118 0.000000       0.000000 
1 1 1 -5  1  1  o 190.1300 3.172325 440.5452       14.69821 449.9375       21.02959 431.5751       20.55147 192.1276 4.491640 188.1665 4.481924 3.961121       6.345271 
1 1 1 -5  1  2  o 844.6350 12.06273 8716.487       248.2852 8933.844       357.0895 8513.063       345.4559 853.8984 17.16069 833.5884 17.00611 20.31006       24.15982 
1 1 1 -5  1  3  o 172.0538 2.949368 360.7507       12.36600 372.7712       17.77642 349.4795       17.21350 174.8821 4.171217 169.3305 4.171554 5.551651       5.899230 
1 1 1 -5  1  4  o 504.3716 8.446836 3103.991       103.8199 3173.750       129.0575 2976.055       174.7740 509.8235 10.38789 492.9701 14.56453 16.85339       17.88949 
1 1 1 -5  1  5  o 422.6607 8.766870 2180.136       90.29684 2253.226       130.5221 2113.044       125.0515 429.1543 12.49387 415.5969 12.36128 13.55746       17.57550 
1 1 1 -5  1  6  o 225.9297 3.604686 622.1265       19.84618 628.8158       28.25284 615.6105       27.88426 227.1080 5.104974 224.7110 5.092120 2.396973       7.210440 
1 1 1 -5  1  7  o 548.9223 7.936352 3677.036       106.1617 3775.312       152.8139 3585.360       147.5929 555.7721 11.28314 541.6250 11.18229 14.14709       15.88561 
1 1 1 -5  1  8  o 370.3586 5.496929 1672.678       49.61107 1670.699       70.12913 1674.660       70.19221 369.9853 7.778179 370.4238 7.775959 -0.4385071     10.99844 
1 1 1 -5  1  9  o 269.8665 4.179030 887.8591       27.48278 891.8724       39.00676 883.9030       38.72777 270.4006 5.919652 269.1906 5.903730 1.209991       8.360402 
1 1 1 -5  1  10 o 361.1275 5.384876 1590.563       47.38844 1651.043       68.66955 1535.572       65.47900 367.7458 7.662675 354.6607 7.576224 13.08505       10.77570 
1 1 1 -5  1  11 o 242.4266 5.455689 716.8093       32.23042 733.5636       46.33650 701.1053       44.86071 244.9943 7.771070 239.5143 7.695956 5.479950       10.93697 
1 1 1 -5  1  12 o 115.2150 2.456044 161.7735       6.895748 152.0789       9.555943 172.3069       9.960770 111.6430 3.516804 118.8461 3.442944 -7.203117      4.921562 
1 1 1 -5  1  13 o 380.4663 5.659813 1765.317       52.47523 1728.971       73.21610 1803.709       75.24797 376.3646 7.982920 384.4088 8.032771 -8.044220      11.32486 
1 1 1 -5  1  14 o 215.4398 3.547557 565.6956       18.62479 553.0479       26.04918 578.9232       26.63961 212.9872 5.018854 217.9128 5.016595 -4.925568      7.096134 
1 1 1 -5  1  15 o 297.6063 4.582869 1079.602       33.23652 1044.084       46.08689 1118.093       47.97715 292.6120 6.463223 302.8039 6.501849 -10.19186      9.167731 
1 1 1 -5  1  16 o 101.4136 2.484199 125.3267       6.139299 115.2565       8.463588 136.5093       8.918851 97.18269 3.579912 105.7796 3.464633 -8.596916      4.981912 
1 1 1 -5  1  17 o 833.8244 11.93217 8490.688       242.4544 8293.169       337.2738 8701.913       348.7804 823.1478 16.81391 843.1525 16.97500 -20.00464      23.89264 
1 1 1 -5  1  18 o 436.7424 7.432468 2326.236       79.10329 2361.284       138.0008 2309.084       96.53696 439.4288 12.90112 435.0299 9.106227 4.398926       15.79121 
1 1 1 -5  1  19 o 434.0069 9.049690 2298.446       95.71201 2249.985       133.3297 2349.972       137.4802 428.9083 12.77057 438.3283 12.88476 -9.419983      18.14123 
1 1 1 -5  1  20 o 252.3696 4.074893 776.2867       25.06048 756.9830       34.92284 796.7798       35.98267 249.1716 5.751418 255.6368 5.776088 -6.465240      8.151196 
1 1 1 -5  1  21 o 297.5876 4.650692 1079.556       33.72628 1092.342       48.03424 1067.124       47.36512 299.2721 6.586407 295.7980 6.570938 3.474091       9.303655 
1 1 1 -5  1  22 o 56.79080 3.237864 39.43571       4.462409 46.20681       6.499654 33.39814       6.137505 61.41088 4.371778 52.11012 4.890336 9.300758       6.559560 
1 1 1 -5  1  23 o 184.3483 3.906367 414.2841       17.54884 426.8013       21.69377 390.5851       29.85010 187.0297 4.763674 178.7750 6.864528 8.254669       8.355497 
1 1 1 -5  1  24 o 427.5253 7.367785 2232.067       76.75997 2309.989       136.4808 2196.015       92.83427 433.7231 12.92730 423.8259 8.988448 9.897186       15.74508 
1 1 1 -5  1  25 o 127.7835 2.921012 199.0468       9.095868 199.5178       12.88501 198.5790       12.84209 127.8380 4.141544 127.5368 4.137511 0.3011856      5.854177 
1 1 1 -5  1  26 o 288.2284 4.574257 1013.685       32.12872 1002.974       45.18355 1024.640       45.69448 286.4957 6.471816 289.5731 6.475442 -3.077423      9.155095 
1 1 1 -5  1  27 o 254.3550 4.184457 789.4958       25.93675 775.0449       36.30017 804.5679       37.07222 251.8248 5.915264 256.5743 5.929244 -4.749588      8.375338 
1 1 1 -5  1  28 o 204.8380 3.632226 511.9659       18.13090 512.8976       25.68682 511.0407       25.59536 204.8139 5.150620 204.4438 5.141571 0.3700867      7.277681 
1 1 1 -5  1  29 o 234.4415 3.970950 671.0187       22.68637 711.6262       33.11950 635.1231       31.13878 241.1895 5.634940 227.8608 5.607842 13.32867       7.949871 
1 1 1 -5  1  30 o 86.04221 3.873830 90.57963       8.101641 97.10020       11.40534 83.93850       11.51028 88.93819 5.286249 82.60786 5.753759 6.330330       7.813461 
1 1 1 -5  1  31 f 76.11169 3.144719 70.81889       5.820132 67.03613       8.007166 75.05613       8.474523 73.91971 4.465941 78.23190 4.463767 -4.312195      6.314258 
1 1 1 -5  1  32 o 84.79863 3.426364 87.95106       7.065831 90.00854       11.45989 86.68917       8.974767 85.52873 5.527957 84.08330 4.395293 1.445435       7.062359 
1 1 1 -5  1  33 o 149.5628 3.206374 273.1533       11.68622 269.0824       16.43970 277.3117       16.61531 148.2095 4.557199 150.4644 4.536647 -2.254929      6.430337 
1 1 1 -5  1  34 o 120.1680 3.094450 176.4721       9.054136 180.1126       12.71523 172.7275       12.89564 121.2337 4.310786 118.6940 4.466358 2.539764       6.207353 
1 1 1 -5  1  35 o 62.54504 4.265317 48.11983       6.462100 63.54837       12.35057 42.30390       7.582881 71.36905 7.199664 58.45103 5.384065 12.91801       8.990178 
1 1 1 -5  1  36 o 30.91275 6.083004 12.17643       4.419120 13.85056       6.237687 10.48947       6.261541 32.75716 7.905299 28.74613 8.407903 4.011030       11.54065 
1 1 1 -5  1  37 o 22.24957 7.026198 6.066411       4.261162 3.108677       5.894632 9.303761       6.166974 20.47849 8.056402 27.27258 8.428841 -6.794090      11.65980 
1 1 1 -5  1  38 o 85.83761 3.946677 90.55524       8.233445 69.40675       14.26385 101.1226       10.08277 74.07238 8.030447 90.58582 4.582438 -16.51344      9.245908 
1 1 1 -5  1  39 o 102.6226 3.217024 129.1390       8.035203 120.6373       11.25500 137.9766       11.47518 98.82961 4.686639 105.7733 4.461942 -6.943741      6.470974 
1 1 1 -5  1  40 o 16.82026 7.313584 -0.6307409     5.590116 2.920896       7.190106 -6.058425      8.888496 21.60750 8.762563 18.47177 8.514301 3.135733       12.21785 
1 1 1 -5  1  41 o 62.64519 4.118011 48.70674       6.251674 52.14812       7.900195 42.94151       10.22539 64.53451 5.064075 57.60861 7.458673 6.925900       9.015357 
1 1 1 -5  1  42 o 83.93762 3.324337 87.04926       6.786378 94.76596       9.770823 79.85714       9.432874 87.03109 4.623617 79.75444 4.876793 7.276649       6.720190 
1 1 1 -5  1  43 o 54.80190 3.815601 37.55822       5.063766 38.81920       7.345209 36.41611       6.990447 54.94511 5.562325 53.25076 5.464388 1.694344       7.797370 
1 1 1 -5  1  44 o 25.49212 7.593631 9.053018       5.069021 12.61768       6.000927 0.1743173      9.470733 29.76385 8.071635 20.98356 9.306757 8.780287       12.31938 
1 1 1 -5  1  45 o 13.00620 6.004432 -2.590286      4.445462 -4.986956      8.237266 -1.605405      5.280447 16.90179 7.926010 14.90666 6.752259 1.995131       10.41224 
1 1 1 -5  1  46 o 60.43883 3.783662 46.87248       5.544728 54.60330       7.857383 39.20413       7.825574 63.98933 5.080559 53.11872 6.159555 10.87061       7.984498 
1 1 1 -5  1  47 o 16.33618 6.513410 3.024359       3.901280 5.549935       5.254478 -0.7819217E-01 5.823833 19.74932 7.653193 15.75317 7.117745 3.996146       10.45149 
1 1 1 -5  1  48 o 14.60026 6.167323 1.805952       3.768023 2.713132       5.114056 0.7286175      5.573061 16.56890 7.097937 15.54891 6.999739 1.019986       9.968803 
1 1 1 -5  1  49 o 15.05757 6.457742 2.227761       4.241927 4.669938       6.755066 0.6377016      5.450641 18.15331 7.963121 14.92594 6.799831 3.227367       10.47134 
1 1 1 -5  1  50 o 15.28563 6.550109 3.017502       4.357440 0.7461776      5.300961 7.749941       7.651693 14.31228 6.589161 19.05421 8.412257 -4.741934      10.68565 
1 1 1 -5  1  51 o 12.97138 5.741350 1.445441       3.586119 3.749190       5.141855 -0.7364585     5.004029 15.53237 6.874859 12.80056 6.056152 2.731813       9.161914 
1 1 1 -5  1  52 o 15.18719 6.248601 4.123209       3.721767 4.144677       5.174215 4.100195       5.357306 15.27514 6.820448 15.26610 6.868478 0.9042740E-02  9.679592 
1 1 1 -5  2  1  o 106.9943 2.301111 139.4993       5.999764 139.2195       8.495936 139.7776       8.474002 106.8314 3.267284 107.0461 3.252263 -0.2146912     4.610028 
1 1 1 -5  2  2  o 201.6059 3.308975 495.3421       16.25672 471.8936       22.42053 521.3362       23.60622 196.7554 4.676093 206.8060 4.684111 -10.05064      6.618666 
1 1 1 -5  2  3  o 235.4675 4.296591 675.8127       24.65421 699.4775       30.84927 633.9797       41.01596 239.5323 5.284998 227.8621 7.396399 11.67012       9.090541 
1 1 1 -5  2  4  o 158.3309 3.235796 305.5135       12.48484 296.1749       15.11625 325.5553       22.14471 155.8329 3.983869 163.3126 5.572511 -7.479721      6.850116 
1 1 1 -5  2  5  o 203.3799 3.845958 504.1503       19.06113 473.1078       31.99029 521.2377       23.73437 196.8431 6.678691 206.7814 4.710100 -9.938293      8.172513 
1 1 1 -5  2  6  o 356.3168 6.129935 1548.301       53.22655 1403.182       86.60522 1636.386       67.47377 338.7621 10.50360 366.2297 7.560410 -27.46759      12.94162 
1 1 1 -5  2  7  o 269.6143 4.169899 886.1017       27.39710 860.4973       38.09488 913.5328       39.43033 265.6324 5.885041 273.6948 5.911910 -8.062439      8.341725 
1 1 1 -5  2  8  o 283.7018 4.356221 981.2200       30.11675 968.3394       42.29918 994.4631       42.89001 281.7571 6.160572 285.5322 6.164032 -3.775116      8.714811 
1 1 1 -5  2  9  o 312.4468 5.469968 1190.624       41.64827 1177.242       50.69936 1218.395       73.03583 310.6116 6.698055 315.6222 9.506652 -5.010620      11.62929 
1 1 1 -5  2  10 o 154.8603 2.812951 292.2828       10.61545 295.3704       15.12919 289.2886       14.89849 155.6036 3.993180 153.9932 3.973449 1.610428       5.633275 
1 1 1 -5  2  11 f 288.9506 6.297915 1018.663       44.34621 968.9741       61.11006 1073.938       64.45345 281.4871 8.920036 296.3538 8.935026 -14.86670      12.62544 
1 1 1 -5  2  12 o 158.7743 2.882327 307.2401       11.15217 310.1630       15.88426 304.3987       15.66122 159.4546 4.091219 157.9658 4.071819 1.488739       5.772156 
1 1 1 -5  2  13 o 505.9702 7.367022 3123.816       90.83495 3219.086       131.1172 3035.896       125.9581 513.2468 10.48328 498.4449 10.36986 14.80194       14.74562 
1 1 1 -5  2  14 o 362.5022 5.431867 1602.179       47.98393 1561.854       66.83846 1645.067       68.92887 357.7953 7.665768 367.2007 7.703029 -9.405426      10.86741 
1 1 1 -5  2  15 o 223.6104 3.660573 609.3941       19.94698 602.9289       28.06760 615.9916       28.35314 222.3932 5.179021 224.7895 5.175937 -2.396286      7.322061 
1 1 1 -5  2  16 f 443.2263 6.522393 2395.315       70.44800 2420.009       100.3353 2371.306       98.93649 445.3471 9.245255 440.8454 9.209458 4.501709       13.04948 
1 1 1 -5  2  17 o 357.8701 5.388669 1561.201       46.99407 1648.440       68.78111 1484.820       64.35844 367.6451 7.677224 348.9272 7.568931 18.71790       10.78093 
1 1 1 -5  2  18 o 134.0451 3.177601 218.9681       10.37974 237.5435       18.05046 209.7912       12.68722 139.4926 5.319828 131.1397 3.974639 8.352875       6.640657 
1 1 1 -5  2  19 o 222.3536 4.278449 602.6117       23.18284 589.0610       28.08350 631.5989       41.07468 219.8212 5.242587 227.4427 7.420750 -7.621506      9.085827 
1 1 1 -5  2  20 o 381.4507 5.723235 1774.049       53.20055 1783.205       75.48038 1765.010       74.99584 382.3090 8.101836 380.3543 8.091197 1.954712       11.45021 
1 1 1 -5  2  21 o 574.0140 8.340159 4020.999       116.6629 4133.699       167.9941 3916.024       162.1346 581.5367 11.85443 566.0333 11.75432 15.50348       16.69406 
1 1 1 -5  2  22 o 341.6430 5.218727 1423.201       43.44833 1438.860       61.85572 1407.952       61.04279 343.3920 7.391858 339.6849 7.374321 3.707092       10.44127 
1 1 1 -5  2  23 o 632.0278 10.58596 4885.107       163.0432 5059.651       204.3636 4579.477       270.4270 642.6077 13.05033 609.4824 18.22809 33.12531       22.41817 
1 1 1 -5  2  24 o 73.19790 3.576447 65.47449       6.360186 66.91138       11.91325 64.90168       7.521832 73.73245 6.703541 72.83160 4.256620 0.9008560      7.940798 
1 1 1 -5  2  25 o 121.6812 2.885227 180.4893       8.555385 187.8642       12.24953 173.4659       11.95416 124.0484 4.057672 119.1908 4.121871 4.857590       5.783988 
1 1 1 -5  2  26 o 474.6812 7.019995 2754.880       81.20353 2748.840       114.6990 2760.949       114.9798 473.3441 9.943665 474.3847 9.946146 -1.040649      14.06422 
1 1 1 -5  2  27 o 226.1642 3.852684 624.0571       21.23359 646.6900       30.61031 603.0659       29.47926 230.0766 5.459580 222.1825 5.444659 7.894089       7.710468 
1 1 1 -5  2  28 o 88.97038 2.903093 96.63953       6.285801 105.3869       9.036402 88.43884       8.749471 92.83499 4.003777 85.00817 4.236976 7.826820       5.829425 
1 1 1 -5  2  29 o 144.2680 3.113749 253.9100       10.94687 257.8929       15.48710 249.9332       15.47532 145.2424 4.380639 142.9740 4.447079 2.268356       6.242316 
1 1 1 -5  2  30 o 166.0518 3.732143 336.6368       15.10213 345.7909       25.47367 331.6757       18.75316 167.8803 6.237512 164.6641 4.678212 3.216263       7.796937 
1 1 1 -5  2  31 o 137.9238 3.533195 232.4148       11.86548 227.0685       14.51223 243.1963       20.60840 136.2280 4.377195 140.7299 6.023200 -4.501953      7.445722 
1 1 1 -5  2  32 o 193.2003 3.573073 455.8965       16.82231 466.2567       24.04178 445.9586       23.54664 195.0828 5.061491 190.7847 5.069138 4.298096       7.163438 
1 1 1 -5  2  33 o 168.3461 3.821660 346.3968       15.67803 343.7593       26.09151 347.8872       19.61385 167.1087 6.419075 168.4921 4.781745 -1.383469      8.004349 
1 1 1 -5  2  34 o 163.1069 3.896452 325.3543       15.48738 333.9152       18.92306 307.9854       26.95364 165.0325 4.710101 157.8897 7.022888 7.142868       8.456122 
1 1 1 -5  2  35 o 122.6800 3.713214 184.2422       11.08816 192.1630       20.53466 180.9822       13.17381 124.6188 6.787510 121.4632 4.458287 3.155647       8.120751 
1 1 1 -5  2  36 o 64.65622 3.529346 51.28564       5.539757 49.58935       7.600450 53.20815       8.091373 63.36192 4.961927 65.62221 5.099831 -2.260288      7.115406 
1 1 1 -5  2  37 o 113.2993 3.776812 157.4030       10.41313 149.0605       18.78022 161.1064       12.51274 109.3818 7.083717 114.4764 4.494127 -5.094513      8.389054 
1 1 1 -5  2  38 o 109.1692 3.188647 145.9664       8.473776 153.7615       12.10249 138.4700       11.86839 111.7780 4.451968 106.0282 4.604380 5.749825       6.404712 
1 1 1 -5  2  39 o 99.16164 3.242637 120.6021       7.825170 120.7972       10.94470 120.3979       11.19238 98.92799 4.552127 98.73225 4.665059 0.1957397      6.518023 
1 1 1 -5  2  40 o 94.77503 3.584614 110.5319       8.263973 108.9598       13.14247 111.5599       10.62798 93.35744 5.805593 94.91223 4.608850 -1.554794      7.412584 
1 1 1 -5  2  41 o 29.06816 8.076706 11.21535       5.925875 11.21535       5.925875 0.000000       0.000000 29.06816 8.076706 ?        ?        0.000000       8.076706 
1 1 1 -5  2  42 o 17.22046 6.577745 2.788506       3.842470 4.422660       5.196898 0.8178070      5.706998 20.53813 7.693368 17.83471 7.564370 2.703421       10.78924 
1 1 1 -5  2  43 o 41.66604 4.512461 22.03338       4.508713 21.64304       6.229312 22.46286       6.534174 40.43908 6.544723 41.11025 6.756898 -0.6711731     9.406862 
1 1 1 -5  2  44 o 29.47021 6.929664 11.99764       4.892384 8.447180       5.637058 22.83577       9.848889 24.74417 8.106754 38.64402 10.28001 -13.89985      13.09191 
1 1 1 -5  2  45 o 16.53275 6.966215 1.524931       4.788077 -5.266984      9.204611 4.044533       5.606286 17.77747 8.349907 19.61757 7.812562 -1.840099      11.43491 
1 1 1 -5  2  46 o 24.29017 6.833718 8.661133       4.214145 9.522402       5.769309 7.675985       6.170280 24.82072 8.204720 22.80723 8.413373 2.013489       11.75169 
1 1 1 -5  2  47 o 39.73032 4.801110 21.48304       4.554205 22.89172       6.036912 19.62251       6.937913 39.41420 6.512548 34.46107 8.350228 4.953133       10.58960 
1 1 1 -5  2  48 o 12.28558 5.560025 -0.5677991     3.570808 -6.380178      4.930091 5.845955       5.178860 11.26337 5.496289 19.38646 7.573754 -8.123086      9.357935 
1 1 1 -5  2  49 o 15.08069 6.409634 2.383091       4.112184 7.071021       6.254149 -1.187078      5.457855 19.79163 8.116922 13.90798 6.499231 5.883658       10.39829 
1 1 1 -5  2  50 o 11.45482 5.477942 -2.751230      4.321525 -2.885575      5.245024 -2.467239      7.625856 12.44634 5.974058 14.50768 7.022860 -2.061341      9.220082 
1 1 1 -5  2  51 o 18.72751 6.663504 6.726605       3.825075 6.890633       5.451070 6.567491       5.368814 17.90664 7.481560 17.66585 7.405958 0.2407932      10.52720 
1 1 1 -5  2  52 o 18.82022 7.158572 7.910079       4.538864 8.454070       5.463306 6.698052       8.154846 18.49713 7.586246 16.54789 7.799343 1.949242       10.88030 
1 1 1 -5  3  1  o 380.3232 5.633343 1763.574       52.21017 1715.186       72.56027 1815.522       75.18218 374.9492 7.941278 385.7568 7.997703 -10.80762      11.27063 
1 1 1 -5  3  2  o 624.8134 10.38695 4767.208       158.1519 4609.875       189.3076 5130.729       287.7542 614.0898 12.65028 646.4532 18.28458 -32.36340      22.23410 
1 1 1 -5  3  3  o 540.2343 9.025502 3562.093       118.8200 3527.800       144.6586 3633.209       208.3182 537.4015 11.04611 544.4427 15.71787 -7.041260      19.21114 
1 1 1 -5  3  4  o 731.8159 10.48553 6540.866       186.9942 6798.143       271.5600 6308.875       257.8703 745.1614 14.95475 717.8947 14.74024 27.26666       20.99808 
1 1 1 -5  3  5  o 292.6900 5.161999 1044.442       36.81815 1083.100       65.28672 1026.414       44.58417 297.7380 9.008536 290.1098 6.306409 7.628235       10.99657 
1 1 1 -5  3  6  o 171.3273 3.427445 357.7538       14.30979 351.2914       24.63706 361.0438       17.57896 169.6186 5.969763 172.1011 4.191540 -2.482468      7.294318 
1 1 1 -5  3  7  o 519.5610 7.537477 3294.151       95.43301 3265.043       134.2604 3323.876       135.6761 516.8656 10.65944 521.4990 10.67612 -4.633423      15.08652 
1 1 1 -5  3  8  o 333.7969 5.019474 1358.645       40.82974 1341.408       57.33768 1376.376       58.15493 331.5450 7.096783 335.8379 7.105927 -4.292908      10.04283 
1 1 1 -5  3  9  o 408.2739 6.021025 2033.412       59.90431 2013.443       84.23697 2053.844       85.20633 406.0232 8.513649 410.0751 8.526531 -4.051849      12.04923 
1 1 1 -5  3  10 o 184.8981 3.659834 416.7456       16.49036 431.5789       29.40649 409.9413       19.91661 187.9603 6.429552 183.3621 4.457279 4.598221       7.823456 
1 1 1 -5  3  11 o 362.7989 7.677294 1606.880       67.87505 1561.518       94.62909 1654.948       97.41100 357.1267 10.88613 367.6653 10.88423 -10.53857      15.39397 
1 1 1 -5  3  12 o 150.1157 2.801068 274.6372       10.24674 278.4161       14.62792 270.9966       14.35800 151.0747 3.976789 149.0476 3.956555 2.027115       5.609739 
1 1 1 -5  3  13 o 203.3692 3.401756 504.0851       16.85872 516.8740       24.20374 492.0335       23.49567 205.9023 4.823753 200.8943 4.799370 5.008041       6.804597 
1 1 1 -5  3  14 o 490.7191 7.161600 2937.256       85.64049 2857.659       119.0011 3022.767       123.3435 483.7664 10.09437 497.5372 10.17313 -13.77078      14.33139 
1 1 1 -5  3  15 o 137.3380 2.734684 229.8506       9.152374 213.5048       12.61101 248.0410       13.30356 132.2973 3.915987 142.6083 3.831604 -10.31100      5.478699 
1 1 1 -5  3  16 o 495.1793 7.234633 2990.207       87.30018 2870.764       120.2204 3123.456       126.9789 484.9869 10.17213 505.8710 10.30044 -20.88403      14.47657 
1 1 1 -5  3  17 o 649.5219 9.360682 5147.578       148.1622 5161.059       209.9707 5134.208       209.0980 649.9138 13.25766 648.2238 13.23697 1.689941       18.73454 
1 1 1 -5  3  18 o 205.8085 4.008615 516.2381       20.10453 524.2178       34.55983 512.1564       24.71723 207.2263 6.853121 204.9788 4.948286 2.247513       8.452858 
1 1 1 -5  3  19 o 80.61153 3.017303 79.30134       5.916775 81.43568       7.289060 75.17822       10.13098 81.66058 3.672278 78.34764 5.338155 3.312935       6.479315 
1 1 1 -5  3  20 o 394.4636 5.898891 1897.253       56.70397 1977.869       82.39270 1824.712       78.15783 402.6117 8.397814 386.7163 8.293615 15.89539       11.80285 
1 1 1 -5  3  21 o 326.6450 5.019282 1300.802       39.95340 1369.597       58.35475 1240.097       54.81638 335.0710 7.146662 318.8415 7.055038 16.22949       10.04233 
1 1 1 -5  3  22 o 269.0480 4.306918 882.4419       28.23791 872.9893       39.74110 892.0807       40.13061 267.5350 6.095693 270.4449 6.089209 -2.909851      8.616029 
1 1 1 -5  3  23 o 228.4002 4.434654 636.0464       24.68268 641.5229       30.38384 625.4187       42.32624 229.3429 5.436522 226.2029 7.689664 3.140060       9.417362 
1 1 1 -5  3  24 o 612.4299 10.30074 4591.307       153.7308 4583.586       266.1343 4595.174       188.3288 608.7913 17.95856 611.9749 12.62836 -3.183655      21.95416 
1 1 1 -5  3  25 o 202.1443 3.560373 498.2426       17.53853 509.7275       25.12140 487.3217       24.49684 204.3871 5.043758 199.7819 5.035751 4.605240       7.127292 
1 1 1 -5  3  26 o 165.9462 3.222167 335.7874       13.03021 339.6602       18.55413 332.0186       18.30342 166.7753 4.569644 164.8879 4.559575 1.887314       6.455337 
1 1 1 -5  3  27 o 178.1830 3.354593 387.2423       14.56606 396.5580       20.82820 378.3248       20.37821 180.1589 4.748306 175.9647 4.756670 4.194244       6.721035 
1 1 1 -5  3  28 o 45.80124 3.747954 25.77019       4.146639 30.23680       5.762818 20.97472       5.971198 49.51767 4.837337 40.95221 6.175213 8.565456       7.844303 
1 1 1 -5  3  29 o 112.7960 2.928876 155.2971       8.043835 148.1622       11.10507 163.1724       11.66713 110.0730 4.147460 115.5213 4.151188 -5.448341      5.868032 
1 1 1 -5  3  30 o 122.1854 2.986451 182.1409       8.892237 184.9129       12.58129 179.3741       12.56976 122.9622 4.204910 121.0978 4.266124 1.864426       5.990082 
1 1 1 -5  3  31 o 89.85564 3.393393 98.70755       7.417107 96.29750       8.997005 103.8202       13.10416 88.67348 4.175317 91.85599 5.885133 -3.182503      7.215820 
1 1 1 -5  3  32 o 169.6913 3.351604 351.6040       13.85953 354.6282       19.58939 348.5731       19.61130 170.1749 4.728358 168.7063 4.775030 1.468567       6.719991 
1 1 1 -5  3  33 o 175.7056 3.431508 377.1273       14.69288 383.9351       20.97724 370.5711       20.58602 176.9899 4.868291 173.8811 4.863071 3.108841       6.881113 
1 1 1 -5  3  34 o 111.5206 4.191689 152.4050       11.37121 142.8165       14.75941 166.4087       17.83676 107.6979 5.643439 116.1259 6.326952 -8.427994      8.478132 
1 1 1 -5  3  35 o 103.2860 3.722024 130.6497       9.352890 137.8875       17.27310 127.6474       11.12487 105.5076 6.753621 101.9724 4.487880 3.535233       8.108789 
1 1 1 -5  3  36 o 75.58839 4.046082 70.17609       7.425752 78.50904       14.40389 67.15965       8.666167 79.21699 7.552796 73.81233 4.844729 5.404655       8.973079 
1 1 1 -5  3  37 o 189.6360 3.626400 440.3309       16.75840 452.0154       23.95905 429.1386       23.44908 191.5976 5.136121 186.6738 5.159684 4.923843       7.280253 
1 1 1 -5  3  38 o 110.8441 3.170217 150.4755       8.554438 152.8410       12.08024 148.0961       12.11544 111.4349 4.457541 109.6673 4.543258 1.767555       6.364815 
1 1 1 -5  3  39 o 90.46697 3.215420 100.3981       7.077383 95.99589       9.681400 105.4509       10.37212 88.16721 4.521136 92.39056 4.621521 -4.223351      6.465225 
1 1 1 -5  3  40 o 41.33157 5.102684 21.48262       5.030436 14.58031       7.437413 27.30289       6.829607 33.13203 8.986308 46.36126 6.200430 -13.22923      10.91783 
1 1 1 -5  3  41 o 137.3043 3.730912 232.6916       12.47190 228.0474       15.28733 241.9347       21.56691 135.4535 4.638169 138.2896 6.417240 -2.836090      7.917927 
1 1 1 -5  3  42 o 59.29974 4.404263 44.03903       6.319030 52.78840       7.568501 23.90518       11.48113 64.78038 4.829097 40.65712 11.22138 24.12326       12.21637 
1 1 1 -5  3  43 o 12.55057 5.651299 -1.480890      3.635128 -2.944418      4.831094 0.4291034      5.519007 13.72982 6.309814 17.08409 7.346998 -3.354262      9.684633 
1 1 1 -5  3  44 o 58.04127 3.781687 42.41122       5.319701 42.57183       7.136628 42.21040       7.980248 57.37190 5.159610 56.65761 5.864616 0.7142906      7.811229 
1 1 1 -5  3  45 o 36.11219 6.576736 18.11789       5.574464 45.50987       11.33429 9.377947       6.402314 55.44184 8.673254 25.26918 8.644950 30.17266       12.24584 
1 1 1 -5  3  46 o 12.36370 5.627030 -1.377379      3.721051 -1.791779      4.882581 -0.8032104     5.747236 13.91324 6.375273 15.64435 7.069469 -1.731110      9.519533 
1 1 1 -5  3  47 o 19.31865 6.860968 5.482087       4.053399 11.85603       5.435384 -2.503973      6.084047 26.93031 7.821351 14.67266 6.858331 12.25764       10.40241 
1 1 1 -5  3  48 o 22.18046 6.715847 7.864979       3.940964 5.840273       5.309076 10.34983       5.881507 19.36677 7.637578 23.91577 8.281781 -4.549004      11.26590 
1 1 1 -5  3  49 o 17.52299 6.742023 4.805655       4.056608 -0.6344404     5.393528 11.89145       6.155511 14.10821 6.548211 24.34703 8.470194 -10.23882      10.70623 
1 1 1 -5  3  50 o 14.83722 6.502458 2.433804       4.494853 5.503347       5.500349 -3.736875      7.798657 17.57081 7.438131 14.18633 6.920471 3.384483       10.15966 
1 1 1 -5  3  51 o 13.88112 5.964810 2.467023       3.632277 7.344176       4.953935 -3.203247      5.341571 18.52139 7.354397 12.00302 5.826223 6.518370       9.382539 
1 1 1 -5  3  52 o 10.60696 5.146152 -2.999351      4.154446 -5.240230      4.849846 3.177405       8.051910 10.53463 5.201993 15.23564 7.335728 -4.701013      8.992977 
1 1 1 -5  4  1  o 561.6786 7.267389 3848.462       99.47235 3692.097       152.7521 3963.593       131.0735 549.6825 11.40353 569.7906 9.439816 -20.10815      14.80373 
1 1 1 -5  4  2  o 715.9567 9.185326 6257.287       160.2572 6162.158       250.4937 6323.202       208.5133 709.5152 14.48769 719.2662 11.89619 -9.750977      18.74600 
1 1 1 -5  4  3  f 815.2383 11.66184 8122.640       231.6795 7863.071       320.4407 8406.936       335.3565 800.9122 16.41825 828.0864 16.61862 -27.17426      23.36102 
1 1 1 -5  4  4  o 429.3936 6.304254 2248.633       65.96680 2201.561       92.06015 2298.310       94.57288 424.6812 8.895544 433.9080 8.944022 -9.226746      12.61452 
1 1 1 -5  4  5  o 202.5301 3.864332 499.9709       19.07217 504.7355       33.34086 497.6535       23.25226 203.3053 6.738953 202.0418 4.722671 1.263504       8.229041 
1 1 1 -5  4  6  o 240.4049 3.816377 704.4670       22.35788 696.9085       31.49532 712.1453       31.74378 239.0652 5.406219 241.6650 5.390249 -2.599808      7.634264 
1 1 1 -5  4  7  o 231.6260 3.709710 653.9689       20.93936 648.0648       29.52720 659.9420       29.69901 230.5310 5.256019 232.6345 5.238799 -2.103500      7.420967 
1 1 1 -5  4  8  f 152.4810 2.795846 283.3653       10.38879 291.4984       14.96847 275.8065       14.43025 154.5829 3.976864 150.3633 3.941581 4.219543       5.599242 
1 1 1 -5  4  9  o 240.2347 3.826332 703.5470       22.40033 676.2673       31.05781 733.1232       32.33871 235.4727 5.412453 245.1714 5.412735 -9.698730      7.654564 
1 1 1 -5  4  10 o 196.5582 3.827631 470.9802       18.33401 492.6440       32.95867 461.2726       22.06259 200.8111 6.744699 194.4991 4.654820 6.312088       8.195018 
1 1 1 -5  4  11 o 191.0717 3.740375 445.0330       17.41597 438.6427       21.30366 457.9094       30.24062 189.6731 4.609060 193.6266 6.417856 -3.953552      7.901412 
1 1 1 -5  4  12 f 166.6285 2.984967 338.3874       12.12062 363.1309       17.80708 317.0276       16.54475 172.5912 4.233875 161.2086 4.215105 11.38254       5.974346 
1 1 1 -5  4  13 o 480.3781 7.025672 2815.005       82.24456 2689.195       112.8055 2957.769       120.1659 469.2550 9.864726 492.1122 10.02031 -22.85712      14.06127 
1 1 1 -5  4  14 o 362.4758 5.433686 1601.837       47.99651 1596.726       67.79820 1606.973       67.95671 361.7910 7.689965 362.9503 7.683322 -1.159393      10.87056 
1 1 1 -5  4  15 o 915.4489 13.07763 10241.18       291.7421 10249.23       412.8076 10233.15       412.3640 914.4597 18.52452 913.7436 18.51912 0.7161255      26.19381 
1 1 1 -5  4  16 o 53.95284 2.576518 35.55246       3.377744 31.17158       4.744644 40.05433       4.809723 50.42381 3.891371 57.22501 3.465279 -6.801197      5.210656 
1 1 1 -5  4  17 o 245.7705 3.959101 736.1649       23.71169 714.5739       33.02010 759.1526       34.07139 242.1091 5.596689 249.5467 5.602760 -7.437607      7.919208 
1 1 1 -5  4  18 o 214.8547 4.134748 562.6301       21.64861 624.2194       39.08739 535.3777       26.00074 226.1334 7.101899 209.5708 5.091184 16.56265       8.738256 
1 1 1 -5  4  19 o 170.9147 3.660341 356.0194       15.24534 351.2540       18.52740 366.0116       26.82842 169.6972 4.484195 173.1358 6.369616 -3.438599      7.789737 
1 1 1 -5  4  20 o 167.4557 3.145688 341.7395       12.83665 351.3766       18.38095 332.5645       17.93481 169.7248 4.447960 165.1152 4.461407 4.609650       6.299881 
1 1 1 -5  4  21 o 372.6326 5.622756 1693.152       51.05827 1685.323       72.02445 1701.061       72.39153 371.6297 7.953045 373.3605 7.956522 -1.730835      11.24976 
1 1 1 -5  4  22 o 201.5007 3.530455 494.8955       17.33578 501.1400       24.69596 488.8293       24.34090 202.7318 4.998823 200.2266 4.988602 2.505280       7.062180 
1 1 1 -5  4  23 o 55.79443 3.623324 38.10794       4.899806 36.68469       5.952708 41.09829       8.628479 54.66557 4.508576 57.70329 6.235075 -3.037716      7.694376 
1 1 1 -5  4  24 o 71.82385 3.548138 63.04520       6.190973 52.17184       11.46033 67.52591       7.356797 64.94073 7.372054 74.30432 4.078565 -9.363586      8.425074 
1 1 1 -5  4  25 o 258.5209 4.202701 815.1737       26.47648 802.8914       37.11772 827.8967       37.77779 256.4326 5.939800 260.3940 5.953462 -3.961304      8.409812 
1 1 1 -5  4  26 o 220.3287 4.368155 592.3362       23.45337 573.6221       28.27859 633.5747       41.97829 216.7426 5.353988 227.4178 7.585290 -10.67525      9.284493 
1 1 1 -5  4  27 o 214.2899 3.725644 560.2430       19.45535 573.0433       27.87673 548.0878       27.16512 216.5815 5.281830 211.8150 5.262825 4.766495       7.456209 
1 1 1 -5  4  28 o 66.82374 3.051298 54.57917       4.955687 51.00448       6.866038 58.46650       7.160000 64.48028 4.395904 69.06800 4.274978 -4.587723      6.131835 
1 1 1 -5  4  29 f 49.22691 3.883397 29.76738       4.620842 29.07237       7.022038 30.29821       6.136775 48.35379 6.094409 49.51474 5.161619 -1.160954      7.986497 
1 1 1 -5  4  30 o 161.8814 3.248337 319.7989       12.81428 327.4543       18.30938 312.4488       17.94050 163.6160 4.596662 159.8181 4.611335 3.797806       6.511045 
1 1 1 -5  4  31 o 102.9163 3.336359 129.4358       8.356388 130.7937       10.35046 126.8937       14.16144 103.3762 4.116921 101.6050 5.742855 1.771141       7.066075 
1 1 1 -5  4  32 o 92.03038 2.978956 103.4826       6.672042 97.64351       9.190021 109.9907       9.702183 89.26500 4.236825 94.75571 4.212256 -5.490707      5.974428 
1 1 1 -5  4  33 o 152.9402 3.246069 285.6662       12.09806 295.2248       17.33836 276.5967       16.88897 155.2315 4.588483 150.2445 4.618323 4.986954       6.510230 
1 1 1 -5  4  34 o 90.19830 3.562037 99.59759       7.814084 97.87140       9.364450 103.5551       14.17915 89.31351 4.315351 91.50563 6.398998 -2.192116      7.718123 
1 1 1 -5  4  35 o 66.20982 4.909180 54.06320       7.864419 0.000000       0.000000 54.06320       7.864419 ?        ?        66.20982 4.909180 0.000000       4.909180 
1 1 1 -5  4  36 o 144.8197 3.258970 256.4194       11.50123 259.1980       16.19707 253.5936       16.33418 145.2892 4.580467 143.6862 4.671150 1.603027       6.542195 
1 1 1 -5  4  37 o 43.38220 4.457076 23.34155       4.644969 18.51402       6.204085 29.49929       7.006893 38.07077 6.943027 48.50748 6.059419 -10.43670      9.215323 
1 1 1 -5  4  38 o 147.4289 3.315627 266.1190       11.91199 263.7117       16.72478 268.5974       16.97009 146.3321 4.696210 147.6742 4.721738 -1.342102      6.659519 
1 1 1 -5  4  39 o 42.75420 5.072013 22.88749       5.181558 21.82929       7.708911 23.75957       6.998196 40.96857 8.008739 43.10673 6.894203 -2.138157      10.56740 
1 1 1 -5  4  40 o 68.83858 3.462934 58.36272       5.790488 54.95499       7.818021 62.50383       8.618321 66.44678 4.861869 70.83594 5.025298 -4.389160      6.992238 
1 1 1 -5  4  41 o 55.35851 4.374165 38.21258       5.852944 36.05684       7.022531 43.11657       10.59181 53.42065 5.471695 57.50513 7.755917 -4.084476      9.491770 
1 1 1 -5  4  42 f 72.27988 3.385232 64.66434       5.946122 60.34036       8.058154 69.83313       8.810260 69.26951 4.803478 74.50532 4.879348 -5.235809      6.847002 
1 1 1 -5  4  43 o 89.65454 4.472800 101.2763       9.741241 107.9031       12.74335 91.96045       15.10923 91.58720 5.738530 82.94096 7.558403 8.646248       9.490005 
1 1 1 -5  4  44 o 58.04726 3.735484 42.41885       5.255973 38.35115       7.208493 47.03613       7.680032 54.15355 5.540378 60.19320 5.289494 -6.039650      7.659930 
1 1 1 -5  4  45 o 17.57136 7.145947 2.718040       4.797612 -11.57099      8.805444 8.750671       5.721414 15.19156 7.398120 24.50408 8.172825 -9.312524      11.02394 
1 1 1 -5  4  46 o 33.21218 5.424448 15.14215       4.238843 14.89948       5.683495 15.44633       6.363182 31.36270 7.531510 31.33615 8.228967 0.2654266E-01  11.15525 
1 1 1 -5  4  47 o 9.985076 4.828291 -4.600811      3.579865 -2.023234      4.742100 -8.016082      5.458552 13.23084 6.140664 11.59659 5.685093 1.634253       8.368276 
1 1 1 -5  4  48 o 20.32631 7.165970 6.722300       4.415090 6.588207       6.834445 6.818339       5.783967 20.17417 8.399102 20.28123 7.979925 -0.1070557     11.58551 
1 1 1 -5  4  49 o 16.94050 6.642236 4.351995       3.995314 -1.241536      5.402863 11.10164       5.935009 13.75456 6.440156 23.60530 8.309524 -9.850743      10.51303 
1 1 1 -5  4  50 o 11.48244 5.474045 -2.414171      4.244951 -4.764961      5.096821 2.908834       7.669569 11.48567 5.601184 16.45039 7.692874 -4.964711      9.515965 
1 1 1 -5  4  51 o 13.97094 6.064987 2.472119       3.831623 3.917435       5.367304 0.9700490      5.471668 15.61492 6.961046 13.93016 6.508894 1.684763       9.530050 
1 1 1 -5  4  52 o 11.45235 5.353907 -0.3937037     3.709979 -2.344720      5.011664 1.971668       5.518248 11.73668 5.684292 14.04396 6.553648 -2.307275      8.675337 
1 1 1 -5  5  1  o 742.0087 8.693159 6720.876       157.1892 6910.694       227.0234 6546.076       217.8581 751.6987 12.39341 731.6379 12.21916 20.06085       17.40415 
1 1 1 -5  5  2  o 288.9055 3.977421 1017.386       28.00229 1028.460       44.61557 1010.188       35.96918 290.3888 6.304789 287.8450 5.127854 2.543762       8.126822 
1 1 1 -5  5  3  o 644.0286 9.268493 5064.578       145.4623 5057.190       205.6021 5071.981       205.8275 642.8703 13.12406 643.8107 13.11925 -0.9404297     18.55682 
1 1 1 -5  5  4  o 471.4453 6.885821 2711.441       79.10851 2700.852       111.6339 2722.123       112.1203 470.2360 9.741910 472.0835 9.746068 -1.847504      13.78008 
1 1 1 -5  5  5  o 476.2658 8.029232 2768.672       93.18789 2689.652       158.5180 2810.403       115.1953 468.3925 13.90316 479.6273 9.855864 -11.23480      17.04218 
1 1 1 -5  5  6  o 364.2977 5.437093 1618.460       48.26801 1629.076       68.63292 1608.072       67.89559 365.3278 7.709277 362.9677 7.676044 2.360046       10.87909 
1 1 1 -5  5  7  o 554.6768 8.034440 3756.483       108.6005 3676.786       151.4536 3840.827       155.8074 548.2021 11.33712 560.2827 11.41155 -12.08063      16.08583 
1 1 1 -5  5  8  f 197.4989 3.317914 475.4395       15.96856 463.1377       22.36207 488.2398       22.81052 194.8906 4.708526 200.1034 4.677830 -5.212830      6.637191 
1 1 1 -5  5  9  o 533.6593 8.956620 3479.486       116.4781 3501.574       203.0488 3468.652       142.2020 533.6477 15.63069 532.4685 10.95912 1.179199       19.08980 
1 1 1 -5  5  10 o 275.2728 6.062058 924.3917       40.66488 932.7040       58.37461 916.5549       56.68045 276.1974 8.683769 273.8128 8.504922 2.384583       12.15490 
1 1 1 -5  5  11 o 569.5048 8.246965 3959.818       114.4531 3916.121       160.7299 4004.768       163.0166 565.7861 11.65758 572.1472 11.69198 -6.361084      16.51065 
1 1 1 -5  5  12 o 308.5980 4.721416 1161.023       35.50598 1151.514       50.07234 1170.639       50.35492 307.2433 6.687739 309.7852 6.670295 -2.541901      9.445565 
1 1 1 -5  5  13 o 234.8461 3.798521 672.2156       21.73873 638.8774       29.95471 709.3107       31.59743 228.9128 5.369809 241.2012 5.375715 -12.28831      7.598234 
1 1 1 -5  5  14 o 473.6846 6.935235 2736.344       80.05465 2702.301       112.3713 2771.427       114.0767 470.5207 9.800324 476.4986 9.824249 -5.977936      13.87668 
1 1 1 -5  5  15 o 881.7472 12.60257 9497.988       270.7943 9542.428       384.3027 9454.164       381.6330 882.6425 17.86704 878.5617 17.82533 4.080750       25.23833 
1 1 1 -5  5  16 o 919.4667 13.13230 10329.19       294.2476 10259.40       414.2247 10400.27       418.0598 915.1058 18.57499 921.3545 18.61982 -6.248718      26.30072 
1 1 1 -5  5  17 o 530.1425 8.898756 3428.893       114.9630 3562.559       203.7574 3366.470       139.2431 539.4443 15.51609 525.1263 10.88112 14.31799       18.95119 
1 1 1 -5  5  18 o 133.4126 3.264639 216.9106       10.61373 201.3624       12.55223 255.9137       19.88064 128.4733 4.014257 144.7747 5.645922 -16.30142      6.927532 
1 1 1 -5  5  19 o 375.5405 6.526454 1719.791       59.72693 1686.098       72.18055 1792.957       106.3672 371.7690 7.967295 382.9547 11.41061 -11.18564      13.91689 
1 1 1 -5  5  20 o 176.8988 3.235656 381.3764       13.94837 386.1283       19.84305 376.7351       19.61094 177.9185 4.580497 175.7395 4.583147 2.178955       6.479675 
1 1 1 -5  5  21 o 164.3057 3.142983 329.0172       12.58435 344.8330       18.17485 314.4516       17.44170 168.1293 4.439883 160.5456 4.462473 7.583664       6.294937 
1 1 1 -5  5  22 o 158.0797 3.566568 304.5962       13.73924 296.9824       16.71229 320.4712       24.13198 156.0140 4.400178 161.9711 6.124948 -5.957123      7.541654 
1 1 1 -5  5  23 o 79.92097 2.853938 77.94975       5.549370 70.67960       7.553988 86.47322       8.179239 76.02897 4.092272 84.12325 4.001359 -8.094284      5.723422 
1 1 1 -5  5  24 o 132.5120 3.466982 214.2246       11.18587 206.3775       20.14105 217.7246       13.45104 129.8595 6.384187 133.5551 4.137934 -3.695633      7.607913 
1 1 1 -5  5  25 o 257.1318 4.848448 806.7779       30.38048 792.8560       36.84937 836.3237       53.68203 254.8107 5.934392 261.2751 8.442389 -6.464371      10.31944 
1 1 1 -5  5  26 o 112.7205 2.863896 155.0145       7.860394 153.6376       11.06821 156.4155       11.16497 112.1454 4.056729 113.1561 4.055520 -1.010712      5.736226 
1 1 1 -5  5  27 o 336.5364 5.202085 1383.639       42.66243 1407.251       61.01480 1361.053       59.67508 338.9395 7.387149 333.3393 7.346329 5.600189       10.41818 
1 1 1 -5  5  28 o 131.8992 2.994825 212.2002       9.626084 216.4252       13.68302 208.0601       13.54471 133.0702 4.224895 130.4665 4.265979 2.603638       6.004025 
1 1 1 -5  5  29 o 119.0414 3.271728 173.0407       9.481987 164.7293       15.15396 178.3884       12.15553 115.9272 5.378860 120.7906 4.135668 -4.863373      6.784975 
1 1 1 -5  5  30 o 181.0112 3.409713 399.9259       15.04040 401.7807       21.26534 398.0694       21.27533 181.2085 4.819961 180.3651 4.844859 0.8433685      6.834082 
1 1 1 -5  5  31 o 194.7901 4.132498 463.6967       19.61623 441.0845       23.42542 516.7673       35.88742 189.7720 5.070006 204.8931 7.198700 -15.12112      8.804899 
1 1 1 -5  5  32 o 22.34857 6.365127 6.285150       3.633286 6.305232       4.870104 6.259943       5.456183 23.05402 7.534038 23.43430 7.981484 -0.3802795     10.97569 
1 1 1 -5  5  33 o 208.5401 4.330921 532.1288       22.00928 534.5714       26.90312 527.1859       38.27140 208.7357 5.293225 206.5268 7.617398 2.208908       9.275936 
1 1 1 -5  5  34 o 54.08798 4.549575 36.08221       5.941102 22.48485       11.09870 41.54327       7.033688 41.57816 10.84325 57.99194 5.026729 -16.41378      11.95174 
1 1 1 -5  5  35 o 108.0513 3.124438 142.7708       8.218294 142.1008       11.55721 143.4562       11.68875 107.6033 4.416879 108.1109 4.446212 -0.5076370     6.267186 
1 1 1 -5  5  36 o 157.7619 3.755366 304.6709       14.43745 302.4506       23.85323 305.9546       18.13690 156.4178 6.270557 157.8125 4.721437 -1.394730      7.849322 
1 1 1 -5  5  37 o 191.8764 3.639595 450.8842       17.01809 445.2210       23.86075 456.7478       24.27913 190.1140 5.155074 192.5513 5.178990 -2.437332      7.307306 
1 1 1 -5  5  38 o 94.93394 3.166062 110.4358       7.314238 99.85049       9.887752 123.2278       10.86961 89.99545 4.523091 100.0129 4.471173 -10.01743      6.360011 
1 1 1 -5  5  39 o 82.06774 3.593922 82.81717       7.170062 67.48621       10.67460 95.42023       9.678431 73.44439 6.016965 87.87266 4.535100 -14.42827      7.534653 
1 1 1 -5  5  40 o 73.64017 3.410459 66.76572       6.103552 57.26361       8.193189 78.61459       9.149170 67.77568 4.995811 79.55045 4.741082 -11.77477      6.887379 
1 1 1 -5  5  41 o 13.19343 5.842436 -1.044326      3.717863 2.238397       4.994149 -5.125210      5.568287 18.20561 7.331495 13.95368 6.534877 4.251933       9.821173 
1 1 1 -5  5  42 o 34.92812 5.131343 15.63854       4.237480 18.60755       5.580997 11.59706       6.511421 37.73349 6.290796 29.16827 8.585675 8.565218       10.64368 
1 1 1 -5  5  43 o 25.64706 7.053655 8.960641       4.545522 11.04756       5.345296 3.509680       8.638844 28.28475 7.595422 22.52398 9.415145 5.760765       12.09692 
1 1 1 -5  5  44 o 43.66659 5.029779 24.77610       5.254560 22.61948       6.068665 31.23555       10.50278 41.01727 6.270234 45.59198 9.748498 -4.574718      11.59090 
1 1 1 -5  5  45 o 14.80030 6.593096 -0.6076112     4.805837 -2.688258      8.153416 0.5000978      5.949127 17.64871 8.141992 17.02340 7.470075 0.6253071      11.04962 
1 1 1 -5  5  46 o 30.97272 5.694761 13.39295       4.139902 16.25429       5.624969 10.01122       6.115104 33.00677 7.196655 25.05586 8.450430 7.950912       11.09962 
1 1 1 -5  5  47 f 14.84812 6.223696 1.817700       3.790582 0.5209143      4.953642 3.649831       5.888013 15.07132 6.705004 18.17125 7.694208 -3.099934      10.20578 
1 1 1 -5  5  48 o 15.10131 6.486369 1.887416       4.291806 -3.411770      6.212388 6.725727       5.936095 13.95032 6.642593 20.12296 8.030715 -6.172640      10.42192 
1 1 1 -5  5  49 o 21.48434 6.736287 7.880763       3.923502 8.741282       5.382577 6.905180       5.731153 21.36637 7.862142 19.43678 7.844452 1.929594       11.10625 
1 1 1 -5  5  50 o 17.55870 6.669483 5.470279       3.936482 7.479401       5.525051 3.398920       5.609972 19.06102 7.698790 15.92227 7.106130 3.138751       10.47704 
1 1 1 -5  5  51 o 11.31485 5.427579 -2.268628      4.314225 -1.094834      5.301151 -4.570848      7.424164 12.78756 6.102067 13.08021 6.454729 -0.2926559     8.882497 
1 1 1 -5  6  1  o 281.0066 3.896338 962.5494       26.68144 974.2393       34.75993 945.7830       41.62868 282.6673 5.046231 278.4613 6.134676 4.205994       7.943470 
1 1 1 -5  6  2  o 148.6141 3.181463 269.1836       11.52187 276.6917       14.38331 255.7374       19.24845 150.6104 3.922272 144.7119 5.468112 5.898468       6.729373 
1 1 1 -5  6  3  o 531.8408 6.907419 3451.108       89.52278 3431.648       140.9841 3464.257       115.8834 529.8011 10.91997 532.6108 8.928432 -2.809753      14.10541 
1 1 1 -5  6  4  f 306.8207 4.687356 1147.780       35.04683 1141.416       49.47368 1154.191       49.65422 305.8687 6.637478 307.5763 6.624714 -1.707672      9.377790 
1 1 1 -5  6  5  o 175.2245 3.543773 374.2548       15.13202 395.9106       27.18930 364.5371       18.21339 180.0429 6.206343 172.9181 4.322295 7.124832       7.563129 
1 1 1 -5  6  6  o 306.8563 4.690600 1148.115       35.07515 1144.151       49.61018 1152.077       49.59732 306.2162 6.648237 307.2766 6.623576 -1.060394      9.384605 
1 1 1 -5  6  7  o 135.0758 2.661577 222.3641       8.760980 216.3079       12.34233 228.5145       12.43801 133.1527 3.807652 136.8645 3.732756 -3.711792      5.332137 
1 1 1 -5  6  8  o 310.3807 5.475420 1174.997       41.41410 1186.799       72.55915 1169.294       50.43645 311.4654 9.571104 309.5495 6.686183 1.915894       11.67523 
1 1 1 -5  6  9  o 352.5703 6.123957 1516.467       52.61554 1642.534       96.38467 1462.953       62.79783 366.2981 10.80967 346.1917 7.443752 20.10641       13.12473 
1 1 1 -5  6  10 o 126.7704 2.990726 195.8663       9.239121 199.1925       11.57053 190.0141       15.34767 127.7788 3.719810 124.7284 5.059921 3.050407       6.280110 
1 1 1 -5  6  11 f 403.1400 5.975695 1982.149       58.70572 1938.365       81.93274 2028.342       84.15679 398.4721 8.437689 407.6123 8.472388 -9.140198      11.95726 
1 1 1 -5  6  12 o 349.5637 5.265215 1489.827       44.85166 1443.791       62.29197 1539.387       64.63240 344.0117 7.430580 355.2159 7.466581 -11.20419      10.53391 
1 1 1 -5  6  13 o 527.7460 7.678728 3397.483       98.75300 3513.770       142.8581 3291.063       136.6634 536.3843 10.92931 519.1217 10.80306 17.26263       15.36737 
1 1 1 -5  6  14 o 142.0749 2.789830 245.9796       9.658980 244.7906       13.72082 247.1476       13.59971 141.6656 3.978413 142.3485 3.924236 -0.6829376     5.588149 
1 1 1 -5  6  15 o 263.9095 4.178539 848.8619       26.87296 835.8818       37.78213 862.1516       38.23004 261.8472 5.921101 265.9305 5.899301 -4.083313      8.358300 
1 1 1 -5  6  16 o 778.6630 11.16383 7402.298       211.8356 7194.566       293.9240 7626.828       305.5773 766.9117 15.72728 789.5839 15.88132 -22.67218      22.35092 
1 1 1 -5  6  17 o 811.4014 13.41900 8046.092       265.3335 8174.437       464.1349 7983.784       323.3876 815.0274 23.39297 807.6478 16.43105 7.379639       28.58689 
1 1 1 -5  6  18 o 103.3697 3.089535 130.3332       7.773824 122.5450       9.215201 149.5536       14.47659 100.2028 3.780668 110.6287 5.386038 -10.42596      6.580491 
1 1 1 -5  6  19 o 143.0064 2.916573 249.2243       10.16399 250.2309       14.43892 248.2356       14.31007 143.2227 4.141358 142.6510 4.120845 0.5717926      5.842278 
1 1 1 -5  6  20 o 396.2968 5.925903 1915.100       57.22836 1938.759       81.66229 1892.268       80.22313 398.5773 8.407617 393.7730 8.360216 4.804260       11.85670 
1 1 1 -5  6  21 o 192.1361 3.411587 449.9432       15.97355 457.6114       22.83942 442.6010       22.34860 193.7364 4.837688 190.4721 4.818721 3.264267       6.828125 
1 1 1 -5  6  22 o 361.5995 6.323489 1595.220       55.72123 1611.174       68.80703 1564.822       94.97722 363.2839 7.772318 357.5185 10.91424 5.765350       13.39887 
1 1 1 -5  6  23 o 367.5825 5.569860 1648.421       49.89249 1675.003       71.33521 1622.965       69.80690 370.2957 7.905313 364.5038 7.858872 5.791962       11.14701 
1 1 1 -5  6  24 o 73.93673 4.485550 66.92316       8.043854 67.75499       12.29252 66.30024       10.63756 74.16213 6.880228 73.45335 5.994938 0.7087860      9.125613 
1 1 1 -5  6  25 o 183.9514 3.379991 412.6125       15.15147 402.4941       21.19062 423.1961       21.67232 181.5492 4.793950 186.1638 4.781165 -4.614609      6.770635 
1 1 1 -5  6  26 o 110.3408 3.426653 148.6358       9.202710 145.1741       17.14688 150.0363       10.90661 108.7701 6.498669 110.8177 4.045513 -2.047668      7.654990 
1 1 1 -5  6  27 o 34.97969 4.363156 15.16832       3.638586 11.65077       4.887981 19.53982       5.449105 30.25785 6.795688 39.55838 5.826984 -9.300531      8.951822 
1 1 1 -5  6  28 o 236.8982 4.552569 685.5159       26.28176 707.8814       45.41203 674.2521       32.22730 240.0342 7.773828 234.7880 5.632638 5.246140       9.599949 
1 1 1 -5  6  29 o 111.5025 2.923256 151.7684       7.936207 155.8977       11.30850 147.7610       11.14037 112.9085 4.116897 109.9136 4.166769 2.994911       5.857543 
1 1 1 -5  6  30 f 184.7612 3.452966 416.7122       15.54673 428.5603       22.29434 405.4968       21.69089 187.1309 4.893119 182.0222 4.894533 5.108704       6.920915 
1 1 1 -5  6  31 f 228.4571 4.549861 638.3010       25.33022 639.9512       31.04247 635.0129       43.81844 228.5406 5.573871 226.8777 7.937770 1.662857       9.699290 
1 1 1 -5  6  32 o 105.1275 2.986055 135.0135       7.642053 133.7259       10.60299 136.4054       11.02430 104.4942 4.172287 105.5214 4.296189 -1.027191      5.988758 
1 1 1 -5  6  33 o 92.52051 3.514535 104.7454       7.909547 102.7566       9.599850 108.9493       13.95720 91.53732 4.315735 93.96065 6.129048 -2.423332      7.496053 
1 1 1 -5  6  34 o 135.6356 3.150832 224.7363       10.41442 221.7070       14.53600 227.9313       14.92827 134.4755 4.441831 136.3412 4.499264 -1.865692      6.322439 
1 1 1 -5  6  35 o 84.49382 3.118480 87.35413       6.410005 79.41732       8.793312 96.35416       9.363789 80.36948 4.507848 88.57505 4.351465 -8.205574      6.265456 
1 1 1 -5  6  36 o 187.5086 4.246834 431.0222       19.40541 414.9081       34.66134 438.3790       23.41982 182.4949 7.812038 188.7830 5.095442 -6.288055      9.326921 
1 1 1 -5  6  37 o 91.13361 3.502164 101.8340       7.763225 86.61018       11.56652 114.3143       10.47253 83.58588 5.712845 96.37952 4.471115 -12.79364      7.254479 
1 1 1 -5  6  38 o 90.79118 3.645205 101.2314       8.048556 100.7954       9.603004 102.2610       14.75521 90.44031 4.370150 90.40316 6.746342 0.3714752E-01  8.038118 
1 1 1 -5  6  39 o 31.48207 6.258866 12.76310       4.632557 15.78383       6.705036 10.00416       6.407909 34.67623 8.084409 27.96012 8.583138 6.716108       11.79101 
1 1 1 -5  6  40 o 45.12989 4.273159 25.37088       4.643500 28.05425       6.250770 22.06654       6.936421 47.14121 5.547287 41.24229 7.161365 5.898918       9.058561 
1 1 1 -5  6  41 o 33.70554 5.204194 14.51582       4.137059 11.92915       5.404769 18.17575       6.428995 29.91392 7.444138 37.06556 7.377159 -7.151638      10.48035 
1 1 1 -5  6  42 o 34.82673 5.133877 15.56956       4.226533 17.12952       5.491677 13.30306       6.619515 36.06134 6.487760 31.08216 8.497534 4.979179       10.69108 
1 1 1 -5  6  43 o 36.75381 4.932213 17.40868       4.306132 14.38633       5.575058 21.87834       6.779756 32.38839 7.245178 40.16747 7.190372 -7.779076      10.20755 
1 1 1 -5  6  44 o 42.42067 4.488675 23.14406       4.569841 21.12353       6.073425 25.78079       6.937986 39.38086 6.559274 43.43634 6.775618 -4.055473      9.430433 
1 1 1 -5  6  45 o 43.05030 4.622250 24.24863       4.773298 27.64884       6.309977 19.69990       7.298283 45.08797 5.883074 35.98016 8.465974 9.107811       10.30938 
1 1 1 -5  6  46 f 16.47675 6.478001 3.028480       3.809060 2.236592       4.903378 4.233560       6.048831 16.73797 7.050964 19.31626 7.958683 -2.578295      10.63281 
1 1 1 -5  6  47 o 20.49039 6.648202 6.445416       3.795763 9.049061       5.042609 3.041378       5.765829 23.40030 7.667458 17.54717 7.527229 5.853125       10.74472 
1 1 1 -5  6  48 o 23.85037 6.770048 9.243000       4.117161 5.887385       5.535905 13.39635       6.158880 19.23340 7.728144 26.78872 8.445449 -7.555326      11.44770 
1 1 1 -5  6  49 o 14.65231 6.224734 2.316269       3.875332 1.881919       5.364329 2.790411       5.604660 15.39164 6.903167 16.13284 7.157182 -0.7411995     9.943790 
1 1 1 -5  6  50 o 11.84195 5.507531 -0.7536936     3.845470 0.6127046      5.367494 -2.194664      5.512017 14.05297 6.525938 12.82852 6.148712 1.224447       8.966299 
1 1 1 -5  6  51 o 14.80885 6.496426 3.246467       4.496444 -0.9801084     5.314951 13.88726       8.433192 12.80871 6.111563 20.57121 8.963194 -7.762504      10.84850 
1 1 1 -5  7  1  o 268.9244 3.450055 881.5194       22.60957 906.2088       32.53240 858.4532       31.44486 272.6118 4.897060 265.3329 4.863204 7.278900       6.901590 
1 1 1 -5  7  2  o 860.1221 11.01837 9049.139       230.9476 8918.379       295.0533 9255.971       371.0841 852.7981 14.19770 867.3218 17.55723 -14.52368      22.57944 
1 1 1 -5  7  3  o 367.0931 4.913649 1643.219       43.95582 1660.864       70.01827 1631.742       56.46991 368.8424 7.789947 365.7149 6.336338 3.127502       10.04154 
1 1 1 -5  7  4  o 270.3107 4.887206 890.9854       32.19289 866.8904       55.11844 903.4608       39.66082 266.2858 8.504917 272.1439 5.980355 -5.858093      10.39703 
1 1 1 -5  7  5  o 212.3281 3.521538 549.5417       18.22116 555.8209       26.03650 543.5144       25.50882 213.4928 5.004531 211.1177 4.958265 2.375092       7.044837 
1 1 1 -5  7  6  o 503.8981 8.489071 3101.439       104.2411 3216.997       185.2675 3047.910       126.0939 511.6852 14.87378 499.2289 10.36474 12.45639       18.12890 
1 1 1 -5  7  7  o 334.9445 5.855762 1368.518       47.79609 1437.786       85.78818 1337.338       57.55666 342.7544 10.28252 331.0148 7.135297 11.73962       12.51570 
1 1 1 -5  7  8  o 254.6519 4.669385 790.6954       28.97629 831.2037       52.11444 772.5683       34.86190 260.7711 8.211151 251.6728 5.684320 9.098312       9.986716 
1 1 1 -5  7  9  o 80.52841 2.683166 79.11892       5.258064 80.27147       6.659205 77.21058       8.568780 81.08243 3.377627 79.45650 4.443107 1.625931       5.581179 
1 1 1 -5  7  10 o 372.8757 5.579483 1695.523       50.69839 1648.485       70.47713 1745.969       72.98533 367.5125 7.869369 378.2190 7.918741 -10.70645      11.16393 
1 1 1 -5  7  11 o 362.7391 5.445607 1604.348       48.13675 1671.997       70.04765 1543.814       66.26134 370.1741 7.765179 355.7094 7.644141 14.46469       10.89637 
1 1 1 -5  7  12 o 470.3265 6.896190 2697.890       79.03961 2776.820       113.9815 2624.779       109.6992 476.9218 9.807337 463.6904 9.708215 13.23135       13.79976 
1 1 1 -5  7  13 o 483.9062 7.080442 2855.722       83.49446 2824.051       117.3369 2888.208       118.8353 481.0011 10.01043 486.4329 10.02505 -5.431793      14.16722 
1 1 1 -5  7  14 o 98.76437 2.509514 118.9410       6.034957 108.9588       8.403747 129.5706       8.672010 94.48351 3.656803 103.0538 3.458083 -8.570251      5.032946 
1 1 1 -5  7  15 o 758.1431 10.87677 7016.476       200.9497 6812.198       278.5988 7238.003       290.1230 746.3414 15.31813 769.2839 15.47603 -22.94244      21.77504 
1 1 1 -5  7  16 o 612.1694 8.849008 4571.956       132.0086 4652.882       189.0113 4494.890       184.4490 617.1644 12.56756 606.6069 12.47765 10.55756       17.70975 
1 1 1 -5  7  17 o 228.4637 4.319980 636.1818       24.05111 641.3907       41.29793 633.5084       29.58620 229.2060 7.403486 227.9640 5.325825 1.242050       9.120089 
1 1 1 -5  7  18 o 562.2061 9.449981 3857.711       129.4680 3825.544       157.6163 3924.433       227.0038 559.6235 11.55764 565.8385 16.48039 -6.215027      20.12914 
1 1 1 -5  7  19 o 244.4942 3.988289 728.5980       23.76246 728.7565       33.71268 728.4417       33.49872 244.4796 5.658672 244.4278 5.623952 0.5181885E-01  7.978058 
1 1 1 -5  7  20 o 209.8028 3.599727 536.4927       18.40420 526.4746       25.84449 546.7997       26.21439 207.8021 5.103662 211.7760 5.079571 -3.973877      7.200654 
1 1 1 -5  7  21 o 92.12926 3.101551 103.5646       6.953333 106.0594       8.759323 99.31403       11.43355 93.19804 3.865194 90.09592 5.230112 3.102119       6.503368 
1 1 1 -5  7  22 o 275.1985 4.388908 923.4050       29.43329 921.4093       41.63865 925.3981       41.61127 274.8074 6.217733 275.4026 6.200217 -0.5952148     8.780826 
1 1 1 -5  7  23 o 259.1998 4.869861 819.4799       30.76007 808.3233       37.26666 843.3290       54.48681 257.3624 5.942090 262.5187 8.528483 -5.156311      10.39440 
1 1 1 -5  7  24 o 87.97396 3.425473 94.50644       7.329596 93.39563       14.00718 94.92528       8.601153 87.19044 6.642426 88.13317 4.015352 -0.9427261     7.761757 
1 1 1 -5  7  25 o 185.9404 3.404064 421.6132       15.42437 422.3055       21.85913 420.9266       21.76787 185.9526 4.827941 185.6497 4.815623 0.3029480      6.819036 
1 1 1 -5  7  26 o 184.6732 3.393775 415.9712       15.27295 407.3145       21.37666 424.9979       21.82887 182.5835 4.808619 186.5077 4.806849 -3.924164      6.799163 
1 1 1 -5  7  27 o 282.7166 4.527072 976.0549       31.18925 975.6608       44.17368 976.4466       44.04312 282.3428 6.420234 282.4607 6.398586 -0.1179199     9.064287 
1 1 1 -5  7  28 o 199.0318 4.049808 483.6664       19.64233 475.5394       32.62101 488.2890       24.60234 196.8671 6.809931 199.8024 5.056952 -2.935318      8.482212 
1 1 1 -5  7  29 o 161.6568 3.226953 318.8853       12.71226 311.6825       17.75256 326.4657       18.21194 159.6379 4.568099 163.3815 4.578738 -3.743561      6.467795 
1 1 1 -5  7  30 o 129.6977 3.027570 205.2660       9.568914 209.7848       13.63356 200.8787       13.43364 130.9514 4.278053 128.1349 4.308322 2.816528       6.071521 
1 1 1 -5  7  31 f 190.9939 4.095930 445.8488       19.06374 420.9364       22.59911 507.3167       35.49828 185.3731 5.007333 202.9607 7.188620 -17.58762      8.760687 
1 1 1 -5  7  32 o 92.47421 3.391415 104.5857       7.629593 105.9205       9.308450 101.8532       13.31804 92.98135 4.118360 90.88499 6.047694 2.096359       7.316795 
1 1 1 -5  7  33 o 30.62469 5.012219 11.78944       3.611291 7.378925       4.815806 17.45605       5.458663 24.39672 7.431574 37.18815 6.244565 -12.79143      9.706848 
1 1 1 -5  7  34 o 30.86016 5.256351 12.00846       3.811377 9.509389       5.215333 14.87302       5.583705 27.31894 7.571873 34.11874 6.951981 -6.799801      10.27927 
1 1 1 -5  7  35 o 80.77508 3.110819 79.84901       6.111892 70.56712       8.246351 91.16254       9.104223 75.74120 4.487916 86.14318 4.351054 -10.40198      6.250845 
1 1 1 -5  7  36 o 118.4380 3.798022 171.9573       10.94770 165.8877       20.46286 174.3912       12.95815 115.3847 7.315157 119.1358 4.471324 -3.751060      8.573462 
1 1 1 -5  7  37 o 53.26749 3.733372 34.93535       4.815496 37.39564       6.520229 31.98303       7.142514 54.91660 4.924399 50.54839 5.909801 4.368210       7.692559 
1 1 1 -5  7  38 o 67.43464 3.758831 55.96553       6.152476 52.77296       9.142735 58.60778       8.317522 65.01771 5.832331 68.75499 4.998386 -3.737282      7.681143 
1 1 1 -5  7  39 o 72.58035 3.347814 64.76218       5.905343 65.22328       8.085496 64.23499       8.645428 72.55560 4.596614 71.90274 4.964543 0.6528549      6.765763 
1 1 1 -5  7  40 o 56.53935 3.704980 39.53442       5.076605 35.63417       6.794433 44.46354       7.638227 53.24540 5.307029 59.52630 5.321670 -6.280903      7.515633 
1 1 1 -5  7  41 o 44.39088 4.267055 24.67652       4.559127 21.23832       6.088017 29.06674       6.879435 40.47161 6.384283 47.59942 6.068637 -7.127804      8.808372 
1 1 1 -5  7  42 o 55.77022 5.080050 39.51651       6.828387 39.51651       6.828387 0.000000       0.000000 55.77022 5.080050 ?        ?        0.000000       5.080050 
1 1 1 -5  7  43 o 19.68785 6.593981 4.932283       3.723813 2.672175       4.835424 8.226234       5.837523 18.02167 7.229085 24.69442 8.255726 -6.672758      10.97345 
1 1 1 -5  7  44 o 30.72296 5.765152 12.72141       4.157787 13.11418       5.457972 12.17833       6.417993 30.33432 7.440811 28.72381 8.541627 1.610506       11.32806 
1 1 1 -5  7  45 o 58.21145 3.775983 43.29671       5.327517 44.10432       7.179883 42.30733       7.946855 57.61475 5.168710 55.69347 5.947310 1.921288       7.879471 
1 1 1 -5  7  46 o 20.20089 6.884727 5.956511       4.059814 9.351100       5.406552 1.567838       6.147427 24.26346 7.938686 17.31147 7.595107 6.951990       10.98674 
1 1 1 -5  7  47 o 16.92140 6.805322 3.537275       4.296893 4.076066       6.430613 3.102672       5.775490 18.60649 7.964812 17.52188 7.525241 1.084608       10.95753 
1 1 1 -5  7  48 o 20.42937 6.825377 6.845354       3.990082 7.655596       5.384374 5.858441       5.942472 20.85906 7.827301 19.15621 7.890127 1.702847       11.11399 
1 1 1 -5  7  49 o 14.13964 6.059393 1.962114       3.729410 1.721569       5.267030 2.203971       5.281365 15.13570 6.810040 15.46216 6.898219 -0.3264532     9.693403 
1 1 1 -5  7  50 o 11.74844 5.478746 -0.8265160     3.846077 -4.750616      5.232264 3.786108       5.672750 11.50171 5.623277 15.98308 7.138669 -4.481371      9.087455 
1 1 1 -5  7  51 o 14.07193 6.270671 2.442742       4.350945 2.928061       5.331004 1.474509       7.529825 14.78850 6.732400 14.85864 7.138695 -0.7014084E-01 9.812552 
1 1 1 -5  8  1  o 226.8924 3.326283 627.4957       18.39142 629.1552       23.88673 625.0798       28.82158 227.1628 4.315026 226.3922 5.224205 0.7705688      6.775823 
1 1 1 -5  8  2  o 182.0528 2.869503 403.9459       12.73035 385.2415       19.68168 417.3999       16.69226 177.6919 4.548996 185.0424 3.701757 -7.350449      5.864842 
1 1 1 -5  8  3  o 148.9178 3.277164 270.3080       11.89271 288.1282       14.89373 238.9543       19.75569 153.6833 3.980214 139.8396 5.809955 13.84364       7.042562 
1 1 1 -5  8  4  o 357.6333 7.617733 1561.477       66.38957 0.000000       0.000000 1561.477       66.38957 ?        ?        357.6333 7.617733 0.000000       7.617733 
1 1 1 -5  8  5  o 144.7945 3.227275 255.5414       11.38739 270.6256       20.37259 248.6870       13.73303 148.8479 5.626649 142.7724 3.950970 6.075531       6.875270 
1 1 1 -5  8  6  o 289.4527 5.184450 1021.749       36.56927 976.1808       61.86399 1046.224       45.33863 282.5322 8.996798 292.8342 6.353464 -10.30200      11.01403 
1 1 1 -5  8  7  o 689.5505 9.929211 5811.482       166.8464 5865.534       237.4879 5758.803       234.4543 691.6638 14.08998 685.3577 14.03798 6.306030       19.88951 
1 1 1 -5  8  8  o 624.0200 9.014647 4755.931       137.0829 4865.937       197.0012 4652.663       190.8731 630.4302 12.82318 616.4866 12.70530 13.94360       18.05156 
1 1 1 -5  8  9  o 464.3673 7.865651 2631.745       89.00869 2634.049       109.2531 2627.198       153.4950 464.3772 9.654432 463.0092 13.61886 1.367981       16.69375 
1 1 1 -5  8  10 f 621.2562 8.972623 4711.559       135.8396 4573.872       188.3755 4860.721       196.0676 611.5458 12.64036 630.4078 12.76286 -18.86200      17.96300 
1 1 1 -5  8  11 o 218.9674 3.630515 584.3619       19.37242 600.1849       27.92367 569.6794       26.89855 221.8816 5.164343 216.1706 5.106180 5.710983       7.262473 
1 1 1 -5  8  12 o 636.2870 9.187055 4940.521       142.4510 4743.388       195.7934 5162.233       207.6403 623.0040 12.89648 649.8955 13.11089 -26.89154      18.39061 
1 1 1 -5  8  13 o 324.3275 4.954586 1282.177       39.15860 1283.247       55.54879 1281.121       55.21000 324.3967 7.026873 324.1293 6.989777 0.2673645      9.911304 
1 1 1 -5  8  14 o 611.9332 8.847674 4568.220       131.9378 4510.859       185.2598 4627.256       187.9457 607.7070 12.50981 615.4951 12.53059 -7.788086      17.70625 
1 1 1 -5  8  15 o 387.9729 5.802431 1835.025       54.85895 1781.784       76.31793 1891.945       78.91160 382.2013 8.194044 393.8377 8.222189 -11.63638      11.60805 
1 1 1 -5  8  16 o 688.0034 11.43399 5780.169       191.7010 5496.812       320.1530 5938.548       239.3528 669.2126 19.65297 696.9689 14.09253 -27.75623      24.18344 
1 1 1 -5  8  17 o 186.0719 3.882954 421.9746       17.60675 412.9294       21.21181 442.0112       31.57043 183.9938 4.734778 190.2622 6.820167 -6.268433      8.302578 
1 1 1 -5  8  18 o 457.9532 7.816044 2558.431       87.22565 2513.573       105.4587 2655.577       155.1937 453.7867 9.536617 465.7865 13.68745 -11.99976      16.68213 
1 1 1 -5  8  19 o 79.28246 2.732344 76.69160       5.271072 86.57893       7.684165 67.90424       7.244125 84.19842 3.754484 74.53204 4.003163 9.666374       5.488303 
1 1 1 -5  8  20 o 440.4161 6.528383 2365.978       70.06561 2373.176       99.47057 2358.889       98.70928 440.8402 9.259282 439.5157 9.216105 1.324463       13.06411 
1 1 1 -5  8  21 o 345.5042 6.078375 1456.168       51.17724 1456.159       62.96227 1456.184       87.85650 345.4012 7.480325 344.9607 10.46334 0.4404907      12.86223 
1 1 1 -5  8  22 o 458.1431 7.847608 2563.602       87.61421 2570.509       107.4185 2549.875       151.4329 458.4846 9.614312 455.6092 13.65470 2.875397       16.69987 
1 1 1 -5  8  23 o 37.02166 5.138969 17.04118       4.511419 24.06126       9.792878 15.14993       5.082921 43.50355 9.503864 34.70260 6.239949 8.800953       11.36927 
1 1 1 -5  8  24 o 235.5564 4.596949 676.9706       26.38765 741.4661       49.42133 651.2520       31.20852 246.0244 8.254972 230.9693 5.544761 15.05510       9.944292 
1 1 1 -5  8  25 o 122.9517 2.887689 184.3139       8.652086 174.3492       11.99245 195.1308       12.49480 119.4705 4.125375 126.4028 4.061631 -6.932350      5.789263 
1 1 1 -5  8  26 o 246.4232 4.086470 741.0870       24.53952 730.4766       34.54960 751.8893       34.86074 244.4533 5.799772 248.0147 5.767972 -3.561386      8.179662 
1 1 1 -5  8  27 o 221.3966 3.805102 598.2284       20.52926 597.7740       29.07948 598.6799       28.98626 221.1276 5.396443 221.2980 5.375001 -0.1704102     7.616577 
1 1 1 -5  8  28 f 97.76770 3.163306 116.7388       7.526631 122.6982       12.09042 112.9678       9.617503 100.0662 4.973719 96.09489 4.116549 3.971336       6.456304 
1 1 1 -5  8  29 o 102.3231 2.874025 127.8263       7.159285 129.2128       10.01242 126.3759       10.24096 102.7808 4.005188 101.6307 4.143730 1.150139       5.762988 
1 1 1 -5  8  30 o 113.5919 2.935668 157.5517       8.119442 161.8002       11.41941 153.2078       11.54690 115.0015 4.081250 111.8838 4.242772 3.117760       5.887081 
1 1 1 -5  8  31 o 155.9208 3.738919 297.0111       14.20647 290.5845       17.05022 311.6031       25.69205 154.0603 4.546515 159.1142 6.640632 -5.053909      8.047906 
1 1 1 -5  8  32 o 57.07245 3.779517 39.98345       5.226917 41.27458       6.329588 37.21530       9.267972 57.90009 4.521847 54.51617 7.148318 3.383911       8.458461 
1 1 1 -5  8  33 o 81.89777 2.984138 82.01007       5.945664 77.50726       8.116778 87.22371       8.733984 79.47533 4.205951 84.31483 4.264665 -4.839508      5.989774 
1 1 1 -5  8  34 o 103.2513 3.031501 130.3343       7.619367 138.0345       10.73275 122.5105       10.81858 106.1055 4.158908 99.90438 4.454956 6.201073       6.094518 
1 1 1 -5  8  35 o 12.08947 5.491849 -2.109469      3.523655 -7.910209      4.393801 8.344760       5.898542 10.71185 5.218653 26.07440 8.270729 -15.36255      9.779534 
1 1 1 -5  8  36 o 146.4429 3.902668 262.9438       13.91486 255.6038       25.56086 266.0351       16.58826 143.2502 7.346784 147.1145 4.632879 -3.864288      8.685551 
1 1 1 -5  8  37 o 46.52054 4.058888 26.74955       4.555348 27.84301       6.089253 25.35986       6.864701 47.22021 5.388067 44.79050 6.477109 2.429714       8.425213 
1 1 1 -5  8  38 o 23.63694 6.934710 7.109020       4.253914 0.2976301E-01  5.836905 15.12876       6.212536 17.74294 7.591533 34.08068 7.666573 -16.33774      10.78924 
1 1 1 -5  8  39 o 62.05281 3.797273 47.52784       5.714586 37.32726       8.529343 55.83637       7.697772 54.22673 6.589654 67.04686 4.742000 -12.82013      8.118504 
1 1 1 -5  8  40 o 40.31492 4.320704 20.33079       4.178654 19.18983       5.572149 21.79700       6.316642 38.65738 6.118434 41.12060 6.520989 -2.463219      8.941954 
1 1 1 -5  8  41 o 42.12027 4.390224 22.29805       4.440169 25.25054       6.065934 18.89014       6.516996 44.39656 5.741045 37.71143 7.355767 6.685131       9.330965 
1 1 1 -5  8  42 o 25.61187 7.697079 8.854054       5.190602 8.854054       5.190602 0.000000       0.000000 25.61187 7.697079 ?        ?        0.000000       7.697079 
1 1 1 -5  8  43 o 18.26629 6.523187 3.971974       3.668927 4.729569       4.755862 2.858312       5.766163 20.07024 7.389402 19.14890 7.816606 0.9213390      10.75651 
1 1 1 -5  8  44 o 49.49680 4.055842 31.26306       4.849221 28.86652       6.423308 34.43904       7.394447 46.48779 5.795530 50.57459 6.124428 -4.086803      8.431891 
1 1 1 -5  8  45 o 12.28566 5.515494 -0.8848910     3.433609 -3.509064      4.540307 2.620957       5.247900 12.46922 5.859094 17.68797 7.361649 -5.218754      9.408658 
1 1 1 -5  8  46 o 39.77114 5.922481 22.45496       5.565125 24.73815       10.09023 21.45680       6.671601 35.72158 10.73085 37.21068 7.614240 -1.489098      13.15781 
1 1 1 -5  8  47 o 20.35255 7.152890 6.569198       4.396499 10.44744       6.969584 4.005986       5.666062 23.73377 8.905440 18.06312 7.592605 5.670645       11.70276 
1 1 1 -5  8  48 o 10.16713 4.898155 -3.848251      3.602159 -0.4367853     4.962965 -7.646089      5.236475 13.93491 6.400862 11.08181 5.459476 2.853090       8.412902 
1 1 1 -5  8  49 o 12.81427 5.788946 0.3027860      3.850539 4.323508       5.319464 -4.122873      5.580907 16.89559 7.238509 12.41698 6.010098 4.478616       9.408362 
1 1 1 -5  8  50 o 14.30321 6.366286 2.187739       4.471179 5.432528       5.515687 -4.030825      7.635744 17.00319 7.328821 13.62119 6.687064 3.382003       9.921111 
1 1 1 -5  8  51 o 22.81650 7.647241 11.66886       5.008338 11.72832       6.224412 11.55968       8.434689 20.91877 8.263532 18.96558 8.567860 1.953192       11.90354 
1 1 1 -5  9  1  o 124.6527 3.021029 189.3825       9.176830 179.2838       15.31617 195.0383       11.46202 121.1367 5.200572 126.4357 3.724164 -5.299034      6.396510 
1 1 1 -5  9  2  o 444.5912 6.550316 2411.787       70.96745 2320.588       97.78749 2513.270       103.1536 435.8053 9.207774 453.5201 9.333660 -17.71475      13.11108 
1 1 1 -5  9  3  o 32.06574 3.186268 12.65594       2.456868 11.28489       4.644661 13.18861       2.895056 29.83161 6.567310 32.68435 3.699788 -2.852737      7.537772 
1 1 1 -5  9  4  o 515.1503 8.686462 3241.352       109.0468 3232.266       133.3783 3259.668       189.3759 514.1156 10.64605 515.1287 15.10227 -1.013062      18.47747 
1 1 1 -5  9  5  o 491.0889 6.426929 2942.252       76.91299 2893.065       120.3312 2976.228       100.0092 486.5041 10.14976 493.7047 8.312593 -7.200684      13.11933 
1 1 1 -5  9  6  o 555.5984 8.071294 3768.410       109.2799 3711.031       153.0873 3828.028       156.0454 550.8284 11.40477 559.4362 11.44628 -8.607727      16.15816 
1 1 1 -5  9  7  o 505.4205 7.383020 3117.219       90.93332 3146.069       129.5902 3089.235       127.6304 507.3657 10.48130 502.7713 10.41712 4.594360       14.77748 
1 1 1 -5  9  8  o 280.3196 5.066265 958.0569       34.60807 947.1727       42.28164 980.1516       60.24159 278.6772 6.226074 283.2205 8.738877 -4.543274      10.72996 
1 1 1 -5  9  9  o 356.9737 5.384941 1553.677       46.84392 1503.242       65.04813 1608.011       67.51535 351.0185 7.604466 363.0431 7.631471 -12.02460      10.77345 
1 1 1 -5  9  10 o 559.6043 8.129869 3820.662       110.8666 3619.021       151.2187 4055.015       163.0240 544.2921 11.40086 576.1184 11.61191 -31.82635      16.27317 
1 1 1 -5  9  11 o 402.5404 5.990861 1975.619       58.76717 1952.470       82.61620 1999.328       83.61139 400.0469 8.474581 404.8188 8.475564 -4.771973      11.98556 
1 1 1 -5  9  12 o 181.1511 3.231839 399.9098       14.26681 388.5730       20.05683 411.5209       20.29796 178.4895 4.615065 183.7469 4.533110 -5.257355      6.468997 
1 1 1 -5  9  13 o 392.4305 5.860052 1877.432       56.04028 1910.856       80.32992 1845.743       78.21812 395.8002 8.328470 389.0021 8.251242 6.798065       11.72375 
1 1 1 -5  9  14 o 252.0914 4.059559 774.5239       24.93865 791.0311       35.89588 759.1223       34.67306 254.7296 5.782680 249.5408 5.701832 5.188751       8.120977 
1 1 1 -5  9  15 o 470.9875 6.925559 2705.003       79.48777 2572.126       108.9087 2856.472       116.2782 459.0970 9.734688 483.7983 9.862746 -24.70126      13.85777 
1 1 1 -5  9  16 o 537.2653 9.021552 3522.142       118.1153 3558.875       205.6350 3504.056       144.2929 539.0557 15.67070 535.6915 11.05336 3.364197       19.17675 
1 1 1 -5  9  17 o 443.0968 7.589475 2394.871       81.94952 2436.848       101.3830 2315.746       139.1926 446.8389 9.310613 435.0399 13.14466 11.79892       16.10806 
1 1 1 -5  9  18 o 178.6684 3.272843 389.0454       14.24981 380.0415       20.07226 398.1944       20.23326 176.5063 4.670696 180.6786 4.599134 -4.172287      6.554955 
1 1 1 -5  9  19 o 493.6237 7.248622 2972.690       87.19418 3085.572       126.4926 2870.492       120.3584 502.5799 10.32818 484.7641 10.18849 17.81577       14.50781 
1 1 1 -5  9  20 o 337.0054 5.949318 1385.212       48.85851 1384.034       60.14501 1387.496       83.77991 336.7747 7.328650 336.8000 10.21961 -0.2529907E-01 12.57575 
1 1 1 -5  9  21 o 464.9903 7.955054 2640.279       90.14116 2632.396       110.0487 2656.353       157.1370 464.0423 9.731754 465.1570 13.87805 -1.114716      16.95015 
1 1 1 -5  9  22 o 277.4705 4.426989 938.8888       29.93377 944.8992       42.63789 933.0474       42.03405 278.2353 6.288506 276.4886 6.238611 1.746674       8.858080 
1 1 1 -5  9  23 o 139.1451 3.517856 236.2200       11.91883 227.7835       21.63894 239.8942       14.28031 136.4122 6.528435 140.1856 4.184896 -3.773438      7.754600 
1 1 1 -5  9  24 o 211.8147 3.676062 547.1711       18.97470 515.9636       26.17568 581.7297       27.54523 205.5214 5.230677 218.3012 5.177908 -12.77974      7.360075 
1 1 1 -5  9  25 o 34.11372 4.157309 14.41024       3.384738 18.32095       4.676847 10.10907       4.904768 38.39611 5.126358 28.20013 7.133338 10.19598       8.784307 
1 1 1 -5  9  26 f 175.5927 3.311401 376.1092       14.16950 379.3603       20.15767 372.9337       19.92179 176.1862 4.699162 174.6881 4.684047 1.498093       6.634939 
1 1 1 -5  9  27 o 112.9373 3.216551 155.7305       8.843444 161.2883       14.34894 152.3263       11.22975 114.7559 5.144157 111.6198 4.135659 3.136169       6.600457 
1 1 1 -5  9  28 o 105.5530 2.886423 136.0074       7.417525 136.5658       10.37395 135.4232       10.60996 105.6754 4.035832 105.2211 4.145967 0.4542847      5.785930 
1 1 1 -5  9  29 f 99.19262 2.866315 120.1367       6.921237 111.6075       9.472779 129.9043       10.13718 95.49805 4.079893 103.0458 4.044784 -7.547707      5.745067 
1 1 1 -5  9  30 o 134.9895 3.048776 222.3909       10.02909 226.0740       14.20391 218.7292       14.16274 135.9265 4.293515 133.6900 4.353027 2.236404       6.114173 
1 1 1 -5  9  31 o 98.28017 3.459944 118.1166       8.273573 116.2078       9.721070 123.1329       15.75893 97.40986 4.104397 99.89825 6.508846 -2.488388      7.694879 
1 1 1 -5  9  32 o 113.8941 3.006243 158.4854       8.336456 155.8774       11.54987 161.3216       12.04475 112.8050 4.208961 114.7452 4.315207 -1.940193      6.027965 
1 1 1 -5  9  33 o 17.92188 6.305195 3.474981       3.416810 6.637639       4.431346 -1.162247      5.365854 23.19468 7.140831 16.25949 7.115728 6.935184       10.08092 
1 1 1 -5  9  34 o 57.08103 3.485965 39.98381       4.825863 37.81281       6.444732 42.75491       7.281160 55.31874 4.829118 58.79837 5.132995 -3.479622      7.047554 
1 1 1 -5  9  35 o 79.55410 3.207018 77.49670       6.204532 71.42844       8.482859 84.47776       9.098522 76.16850 4.591472 82.86919 4.522629 -6.700684      6.444827 
1 1 1 -5  9  36 o 95.63628 3.781324 112.2188       8.795201 111.5886       17.13637 112.4442       10.24794 94.41576 7.509811 95.61367 4.410136 -1.197914      8.708993 
1 1 1 -5  9  37 o 37.50651 5.137318 17.65210       4.572210 12.26889       6.450535 23.08751       6.481741 30.74691 8.381217 42.68926 6.430094 -11.94235      10.56366 
1 1 1 -5  9  38 o 13.39731 5.847950 -0.6526058     3.603712 0.8692172      4.649393 -2.942670      5.703454 16.61252 6.922809 15.52098 7.025306 1.091549       9.863073 
1 1 1 -5  9  39 f 87.76771 3.149279 94.62203       6.724771 100.4676       9.349401 88.35606       9.679721 90.14130 4.268342 84.38003 4.726355 5.761276       6.368452 
1 1 1 -5  9  40 o 95.32209 3.511922 112.0902       8.143881 99.00235       12.12820 122.8370       10.99010 88.71256 5.639350 99.38393 4.549912 -10.67137      7.245963 
1 1 1 -5  9  41 o 45.49372 4.703704 26.12550       5.139557 24.22563       6.036739 31.13042       9.798034 43.37934 5.860383 47.88402 8.717844 -4.504681      10.50452 
1 1 1 -5  9  42 o 14.68451 6.229677 0.5070385      3.872231 1.178396       4.404391 -1.778456      8.126417 16.13848 6.732582 18.95600 8.499557 -2.817520      10.84298 
1 1 1 -5  9  43 o 55.85233 3.638905 39.18820       4.925803 37.73298       6.639628 40.96957       7.346094 54.02794 5.103481 56.09876 5.441903 -2.070824      7.460551 
1 1 1 -5  9  44 o 24.48075 6.257114 8.356837       3.746471 10.76570       4.948517 5.121893       5.734589 27.32653 7.294755 20.70827 8.003213 6.618261       10.82889 
1 1 1 -5  9  45 o 22.67568 6.490918 7.433065       3.768997 7.561374       4.810935 7.229183       6.064466 22.60452 7.493084 22.33839 8.322169 0.2661304      11.19843 
1 1 1 -5  9  46 o 38.51744 7.421943 22.94458       6.713820 0.000000       0.000000 22.94458       6.713820 ?        ?        38.51744 7.421943 0.000000       7.421943 
1 1 1 -5  9  47 o 20.37611 6.612040 6.505817       3.754507 6.343863       5.350687 6.662899       5.269593 19.95620 7.725782 20.27844 7.713298 -0.3222370     10.91708 
1 1 1 -5  9  48 o 13.03454 5.762832 0.5946380      3.603186 -2.251801      5.042278 3.564925       5.150804 12.96327 6.116868 16.79292 7.156698 -3.829657      9.414585 
1 1 1 -5  9  49 o 11.06715 5.194556 -1.612368      3.551789 2.672302       5.042793 -5.830380      5.003414 15.42896 6.819681 11.07432 5.431902 4.354646       8.718578 
1 1 1 -5  9  50 o 25.29530 7.529285 12.96823       4.984962 12.08041       6.060906 14.82456       8.764048 22.32386 8.319145 21.50446 9.253270 0.8194008      12.44312 
1 1 1 -5  9  51 f 10.19088 5.007280 -4.638674      4.310447 -3.377130      5.314553 -7.063981      7.368834 11.69832 5.708106 12.21329 6.094400 -0.5149736     8.350101 
1 1 1 -5  10 1  o 198.1462 3.396169 478.5445       16.39876 473.9929       23.04388 483.2145       23.34170 197.1689 4.796020 199.0772 4.811436 -1.908310      6.793506 
1 1 1 -5  10 2  o 335.8709 4.580603 1375.351       37.49136 1360.833       58.94207 1385.216       48.58720 333.9420 7.242997 337.0052 5.916285 -3.063263      9.352189 
1 1 1 -5  10 3  f 125.1229 2.706019 190.7963       8.250945 186.6529       11.72182 194.8653       11.61610 123.6818 3.893987 126.3813 3.775971 -2.699425      5.424122 
1 1 1 -5  10 4  o 153.3810 3.370132 286.7387       12.59664 283.0085       15.40929 294.2528       21.87029 152.3110 4.155478 155.2223 5.791977 -2.911240      7.128464 
1 1 1 -5  10 5  o 544.2736 7.925159 3615.412       105.1142 3639.010       149.4632 3592.317       147.8577 545.5917 11.24166 542.0880 11.19278 3.503784       15.86358 
1 1 1 -5  10 6  o 388.1999 5.190143 1837.403       49.09880 1835.039       77.71502 1838.973       63.34121 387.7563 8.224508 388.2805 6.694292 -0.5241699     10.60453 
1 1 1 -5  10 7  o 325.7886 4.459206 1293.822       35.40214 1284.001       55.77520 1300.448       45.81409 324.4396 7.054580 326.5726 5.756828 -2.132996      9.105392 
1 1 1 -5  10 8  o 369.1939 6.413790 1662.207       57.70392 1632.107       70.04671 1725.770       101.7900 365.7578 7.858834 375.7015 11.13025 -9.943726      13.62512 
1 1 1 -5  10 9  o 266.2771 4.233338 864.2117       27.46964 862.0394       38.96312 866.3585       38.73376 265.8966 6.013187 266.5634 5.962838 -0.6667786     8.468404 
1 1 1 -5  10 10 o 253.4933 4.076941 783.1837       25.18472 780.5928       35.74987 785.7363       35.48475 253.0365 5.797692 253.8704 5.735793 -0.8338623     8.155523 
1 1 1 -5  10 11 o 254.9866 4.101322 792.4260       25.48457 760.6324       35.37203 826.7424       36.74862 249.7849 5.811093 260.4142 5.790823 -10.62930      8.203806 
1 1 1 -5  10 12 o 220.1200 3.683140 590.4955       19.75667 593.3279       28.21029 587.7690       27.67764 220.6233 5.247108 219.5887 5.172290 1.034592       7.367816 
1 1 1 -5  10 13 o 410.6915 6.113352 2056.325       61.18307 2014.664       85.57394 2099.894       87.51041 406.3912 8.640943 414.8976 8.655312 -8.506378      12.23030 
1 1 1 -5  10 14 o 226.7418 3.774223 626.5711       20.85429 596.9331       28.91464 658.7023       30.10627 221.2880 5.361962 232.4564 5.314708 -11.16835      7.549620 
1 1 1 -5  10 15 o 232.1504 4.392233 656.8865       24.84797 721.7389       45.10196 628.6240       29.77401 243.1395 7.621500 227.0823 5.380442 16.05722       9.329331 
1 1 1 -5  10 16 o 268.7375 4.994033 880.3705       32.70512 839.1848       38.81510 981.1821       60.72708 262.3469 6.071398 283.4318 8.802876 -21.08493      10.69357 
1 1 1 -5  10 17 o 633.1275 10.59760 4895.375       163.5065 5020.683       203.5794 4667.641       274.4477 640.8022 13.03688 616.5632 18.28631 24.23901       22.45772 
1 1 1 -5  10 18 o 293.3656 4.609126 1049.149       32.95064 1042.736       46.61662 1055.553       46.58188 292.3948 6.542369 294.1884 6.497634 -1.793610      9.220729 
1 1 1 -5  10 19 o 274.2819 4.382212 917.1121       29.29049 891.4219       40.88538 944.1994       41.98241 270.3435 6.206059 278.2321 6.191902 -7.888550      8.766688 
1 1 1 -5  10 20 o 614.5250 10.29152 4616.919       154.1187 4677.536       190.7858 4503.071       261.4653 618.0095 12.66819 604.6337 17.76465 13.37579       21.81894 
1 1 1 -5  10 21 o 414.3318 6.195252 2094.908       62.55231 2069.272       87.93906 2121.162       88.99505 411.4743 8.770068 416.6021 8.766137 -5.127777      12.39997 
1 1 1 -5  10 22 o 226.6532 3.831251 626.3961       21.16111 618.0825       29.88794 634.7526       29.96488 225.0594 5.449574 228.0779 5.391298 -3.018417      7.665765 
1 1 1 -5  10 23 o 203.6269 4.182550 505.7654       20.75451 525.8017       38.35120 497.4672       24.68092 207.2232 7.607504 201.9014 5.016326 5.321793       9.112499 
1 1 1 -5  10 24 o 90.78740 2.789905 100.5835       6.165033 101.1977       8.799369 99.99128       8.640158 90.99235 3.977968 90.45077 3.929258 0.5415802      5.591359 
1 1 1 -5  10 25 o 141.3098 3.013665 243.5133       10.37775 258.0927       15.14968 230.6235       14.24480 145.3524 4.281723 137.3947 4.259665 7.957748       6.039693 
1 1 1 -5  10 26 o 234.9518 3.963429 673.7894       22.69269 660.2742       31.91562 687.6082       32.27198 232.3758 5.636067 237.1447 5.584395 -4.768814      7.934149 
1 1 1 -5  10 27 o 69.88889 3.245983 59.72195       5.513186 65.61906       8.584529 55.58228       7.192511 73.11806 4.845207 67.31452 4.408925 5.803535       6.550928 
1 1 1 -5  10 28 o 192.9094 4.158248 454.5491       19.54789 426.1390       34.51059 467.9706       23.72003 186.0920 7.626229 195.5695 4.981173 -9.477570      9.108867 
1 1 1 -5  10 29 o 78.89619 2.929476 76.05383       5.622470 74.67278       7.744841 77.59267       8.175364 78.07282 4.084980 79.57327 4.231242 -1.500450      5.881366 
1 1 1 -5  10 30 o 149.0008 3.162875 271.0071       11.48436 287.4384       16.62136 255.9971       15.88625 153.2490 4.455474 144.6087 4.513597 8.640259       6.342224 
1 1 1 -5  10 31 o 37.13326 5.696753 17.29725       4.990674 17.29725       4.990674 0.000000       0.000000 37.13326 5.696753 ?        ?        0.000000       5.696753 
1 1 1 -5  10 32 o 38.93678 4.038586 18.73958       3.776413 19.48311       5.127510 17.85814       5.582800 39.48184 5.476611 37.61269 6.314446 1.869152       8.358559 
1 1 1 -5  10 33 o 24.86095 5.898423 7.901912       3.519302 8.479456       4.603442 7.089623       5.459404 25.80979 7.098469 24.37304 7.977566 1.436741       10.67848 
1 1 1 -5  10 34 o 110.2921 3.042700 148.7352       8.170045 148.5066       11.44431 148.9728       11.66729 110.0202 4.276703 110.1793 4.354016 -0.1590195     6.103085 
1 1 1 -5  10 35 o 101.6236 3.790540 126.6240       9.370653 111.5711       17.62388 132.5569       11.06424 94.43718 7.725587 103.8727 4.380871 -9.435471      8.881257 
1 1 1 -5  10 36 o 110.9723 3.116810 150.7418       8.420359 143.7717       11.61510 158.4626       12.22464 108.1226 4.417593 113.5186 4.427582 -5.395988      6.254488 
1 1 1 -5  10 37 o 81.01034 3.549614 80.59479       6.990401 81.49318       10.53082 79.88708       9.346622 81.05797 5.361395 80.39451 4.792562 0.6634598      7.191190 
1 1 1 -5  10 38 o 70.13693 3.312024 60.45375       5.644790 61.86924       7.645846 58.75785       8.368947 70.71239 4.459762 68.76099 5.029290 1.951408       6.721848 
1 1 1 -5  10 39 f 21.87935 6.484012 6.116443       3.703401 6.890968       4.972587 5.151741       5.549591 23.51486 7.607717 21.89238 7.994989 1.622484       11.03618 
1 1 1 -5  10 40 f 29.37275 5.772220 11.19863       3.984243 14.76509       5.398224 6.931172       5.904954 33.50496 6.843167 23.92138 8.297505 9.583578       10.75535 
1 1 1 -5  10 41 o 71.02433 4.310965 63.12056       7.426220 55.03067       9.381053 76.69968       12.15391 65.52775 5.939197 77.05706 6.533978 -11.52931      8.829887 
1 1 1 -5  10 42 o 40.01822 5.267893 20.71325       5.012614 20.85390       5.853571 20.32650       9.706435 39.70461 6.256718 36.95215 10.36250 2.752464       12.10487 
1 1 1 -5  10 43 o 44.17975 4.121756 24.85577       4.386326 25.61959       5.790920 23.82773       6.718277 44.14113 5.502707 41.75047 6.839933 2.390663       8.778637 
1 1 1 -5  10 44 o 19.69326 6.591890 5.247736       3.721517 5.940195       4.775024 4.176330       5.939581 20.96466 7.446578 19.85090 7.994924 1.113756       10.92567 
1 1 1 -5  10 45 o 37.71662 4.586569 18.90754       4.129014 18.12866       5.331419 20.07489       6.526923 35.62018 6.376146 36.43272 7.597941 -0.8125381     9.918868 
1 1 1 -5  10 46 o 28.86293 8.400332 14.26699       6.263949 0.000000       0.000000 14.26699       6.263949 ?        ?        28.86293 8.400332 0.000000       8.400332 
1 1 1 -5  10 47 o 13.95710 5.964704 1.383212       3.595647 1.505820       5.017503 1.253777       5.155324 15.50444 6.829894 15.44932 6.858547 0.5512047E-01  9.679211 
1 1 1 -5  10 48 o 13.16566 5.840127 0.6737361      3.730627 5.679660       5.394275 -3.915691      5.164998 18.46509 7.551622 12.24735 5.891389 6.217742       9.577863 
1 1 1 -5  10 49 o 18.70118 7.099380 6.530707       4.458755 6.734178       5.467299 6.126638       7.704608 18.56321 7.598413 18.01760 8.159339 0.5456104      11.14947 
1 1 1 -5  10 50 o 19.77477 6.590940 7.390004       3.721065 7.612252       5.696009 7.224541       4.914763 18.41483 7.667269 18.47722 7.328992 -0.6239319E-01 10.60666 
1 1 1 -5  11 1  o 55.12398 2.751242 37.12313       3.684093 40.19715       7.396377 36.10883       4.248641 57.16658 5.372309 54.33609 3.223155 2.830490       6.265017 
1 1 1 -5  11 2  o 62.62496 2.763205 47.88761       4.206551 42.79688       5.859542 53.30140       6.042603 59.11264 4.092957 66.02175 3.771477 -6.909107      5.565639 
1 1 1 -5  11 3  o 407.9850 4.962586 2029.278       49.33878 2018.530       69.52692 2040.181       70.02689 406.7878 7.013730 408.9628 7.026596 -2.175018      9.928013 
1 1 1 -5  11 4  o 480.7224 5.760888 2817.847       67.48697 2792.249       94.86017 2844.082       96.03261 478.3574 8.137582 482.7746 8.162783 -4.417206      11.52611 
1 1 1 -5  11 5  o 117.0258 2.709970 166.8928       7.728270 170.2023       11.11297 163.7932       10.75468 118.1077 3.866354 115.8624 3.814268 2.245255       5.431144 
1 1 1 -5  11 6  o 178.4702 3.226305 388.1758       14.03160 375.1071       27.94765 392.5802       16.22472 175.2608 6.555268 179.4739 3.709709 -4.213058      7.532163 
1 1 1 -5  11 7  o 385.1067 5.771977 1808.169       54.16787 1787.332       76.16679 1829.493       77.05073 382.7618 8.165842 387.2499 8.164871 -4.488129      11.54756 
1 1 1 -5  11 8  o 261.7891 3.745701 835.2490       23.89575 849.8143       38.31194 825.9750       30.57085 264.0122 5.954895 260.3107 4.819250 3.701508       7.660675 
1 1 1 -5  11 9  o 1045.101 14.91875 13356.76       379.9503 13077.74       529.6069 13652.67       545.4028 1032.272 21.05346 1054.658 21.22119 -22.38562      29.89292 
1 1 1 -5  11 10 o 548.1675 7.981322 3664.954       106.6164 3672.916       151.1742 3657.074       150.3858 548.4854 11.31036 547.3047 11.27565 1.180664       15.97074 
1 1 1 -5  11 11 o 469.6815 6.912380 2689.888       79.11652 2641.842       110.7083 2740.038       113.1055 465.2967 9.763695 473.8631 9.794783 -8.566406      13.82995 
1 1 1 -5  11 12 o 670.7518 9.671830 5489.929       158.0908 5413.795       221.6593 5568.752       225.5395 665.5989 13.66587 675.0509 13.71040 -9.452026      19.35797 
1 1 1 -5  11 13 o 134.6092 2.859142 220.8073       9.378786 219.1129       13.51327 222.3820       13.02729 134.0180 4.142695 135.0219 3.963547 -1.003967      5.733379 
1 1 1 -5  11 14 f 446.0201 7.597359 2426.318       82.57587 2497.111       145.5156 2392.693       100.2873 451.8310 13.23017 442.8092 9.293794 9.021759       16.16824 
1 1 1 -5  11 15 o 464.0520 7.925297 2626.906       89.62275 2628.984       109.7109 2622.737       155.3844 464.1011 9.700659 462.9354 13.78908 1.165710       16.85946 
1 1 1 -5  11 16 o 539.6217 9.112457 3553.928       119.8288 3527.425       145.9152 3608.824       210.0016 537.3844 11.14241 542.6216 15.89857 -5.237244      19.41437 
1 1 1 -5  11 17 o 522.8943 7.647448 3335.823       97.44658 3370.354       138.9879 3302.437       136.6621 525.2446 10.85874 519.9346 10.78607 5.309998       15.30527 
1 1 1 -5  11 18 o 423.4604 7.318300 2187.892       75.51949 2192.314       92.50085 2179.054       130.7789 423.7437 8.957903 421.8296 12.73685 1.914124       15.57150 
1 1 1 -5  11 19 o 610.2394 10.22368 4551.711       152.0350 4597.095       187.8952 4465.653       258.7368 612.7783 12.58277 602.3204 17.64668 10.45789       21.67328 
1 1 1 -5  11 20 o 308.7501 4.821502 1162.501       36.27652 1182.102       51.97540 1143.883       50.65554 311.2060 6.853522 306.1386 6.790048 5.067383       9.647565 
1 1 1 -5  11 21 o 180.7700 3.343518 398.3664       14.72876 389.3713       20.83498 407.3522       20.82424 178.6049 4.791328 182.6924 4.681342 -4.087494      6.698641 
1 1 1 -5  11 22 f 67.20502 3.470258 55.21556       5.664039 53.22865       11.98899 55.78645       6.426441 65.54597 7.649502 67.52142 3.922534 -1.975449      8.596579 
1 1 1 -5  11 23 o 319.2605 5.774992 1244.834       44.92961 1199.921       77.66122 1267.430       55.08384 312.5103 10.21145 321.9653 7.020677 -9.455078      12.39208 
1 1 1 -5  11 24 o 49.17625 3.207546 29.61696       3.822855 31.87938       5.641357 27.69587       5.198430 50.89822 4.597783 47.41701 4.554811 3.481205       6.471932 
1 1 1 -5  11 25 o 278.9524 4.479748 950.0941       30.45227 939.8627       43.01189 960.3773       43.12035 277.1534 6.368428 280.1714 6.315711 -3.018036      8.969118 
1 1 1 -5  11 26 o 128.3940 3.294731 201.2526       10.30011 204.3822       17.03096 199.4477       12.93354 129.1758 5.422364 127.7425 4.160308 1.433342       6.834486 
1 1 1 -5  11 27 o 160.1674 3.800679 313.1784       14.83445 294.9792       26.80852 321.2101       17.80953 154.9098 7.120671 162.0819 4.513411 -7.172104      8.430590 
1 1 1 -5  11 28 o 105.8409 2.861238 136.7617       7.373012 140.5922       10.56627 133.1267       10.29312 107.2096 4.051673 104.3197 4.056703 2.889923       5.733489 
1 1 1 -5  11 29 o 99.24415 2.903932 120.2858       7.015525 128.4992       10.09807 112.6230       9.753788 102.4706 4.051909 95.90695 4.183435 6.563698       5.824010 
1 1 1 -5  11 30 o 151.4485 4.572164 280.8577       16.85487 280.8577       16.85487 0.000000       0.000000 151.4485 4.572164 ?        ?        0.000000       4.572164 
1 1 1 -5  11 31 o 129.9959 3.071756 206.3274       9.730891 208.5670       13.69681 204.0450       13.82723 130.4993 4.312927 129.0614 4.402902 1.437912       6.163350 
1 1 1 -5  11 32 o 128.5404 3.078214 201.7851       9.642166 202.4308       13.56811 201.1263       13.70509 128.5276 4.338202 128.1024 4.396758 0.4251709      6.176688 
1 1 1 -5  11 33 o 165.7317 3.368056 335.7025       13.60257 343.3257       19.37656 328.2952       19.10029 167.2807 4.758130 163.5657 4.797126 3.714981       6.756643 
1 1 1 -5  11 34 o 38.43954 4.463983 18.35390       4.103868 14.92969       5.494171 22.67561       6.172337 34.17171 6.836705 42.46911 6.142213 -8.297401      9.190610 
1 1 1 -5  11 35 o 112.0574 3.776500 153.9616       10.29781 177.5350       20.55515 146.0624       11.89871 119.4243 7.095021 108.9998 4.489197 10.42447       8.395964 
1 1 1 -5  11 36 o 154.6863 3.714210 293.2195       14.00085 275.7607       22.28823 304.5992       17.99423 149.1533 6.145225 157.3222 4.698878 -8.168930      7.735841 
1 1 1 -5  11 37 o 29.18835 5.690503 10.89901       3.902114 12.13249       5.032323 9.039037       6.179528 30.60306 6.911750 26.83988 8.459330 3.763182       10.92394 
1 1 1 -5  11 38 o 37.79867 4.523469 17.87391       4.083985 14.16249       5.485205 22.49057       6.117672 32.99268 7.037222 42.05317 6.151635 -9.060497      9.346931 
1 1 1 -5  11 39 o 30.53698 5.438931 11.95755       3.898990 9.819408       5.154544 14.81703       5.960952 27.32608 7.509721 33.51134 7.488229 -6.185255      10.60516 
1 1 1 -5  11 40 o 57.90777 3.964414 41.72247       5.560633 41.02164       6.707899 43.26203       9.942198 57.12010 4.865314 57.63478 7.238056 -0.5146828     8.721281 
1 1 1 -5  11 41 o 34.45673 5.130187 15.27746       4.176517 17.13604       5.467163 12.67275       6.472192 36.01730 6.466584 30.28101 8.450902 5.736284       10.64117 
1 1 1 -5  11 42 o 13.79035 6.182669 -1.363311      4.298579 -0.3740910     5.001607 -4.158931      8.408187 15.63899 6.856377 17.94615 8.275270 -2.307158      10.74663 
1 1 1 -5  11 43 o 21.52622 6.449244 6.341263       3.648246 4.402715       4.656638 9.422194       5.870502 19.39163 7.278625 25.62124 8.264133 -6.229607      11.01246 
1 1 1 -5  11 44 o 21.34951 6.506111 6.434780       3.690532 7.467091       4.740636 4.846715       5.879841 22.72774 7.433578 20.26408 8.023155 2.463667       10.93751 
1 1 1 -5  11 45 o 19.95836 6.502562 5.764078       3.629231 6.987357       4.838737 4.190935       5.487230 21.56656 7.509360 18.85902 7.652365 2.707546       10.72144 
1 1 1 -5  11 46 f 12.81039 5.950561 -1.946248      4.467507 -5.605444      7.302829 0.2421430      5.647559 14.51544 6.988254 15.53764 7.015825 -1.022197      9.902398 
1 1 1 -5  11 47 o 35.99526 5.078859 18.47388       4.331335 13.73393       6.169496 23.08079       6.082300 27.15504 8.436917 38.29216 6.765470 -11.13712      10.81449 
1 1 1 -5  11 48 o 8.844507 4.372084 -6.051008      3.458331 -11.17289      4.867754 -0.8308868     4.914213 9.445497 4.747404 13.37485 6.222336 -3.929355      7.826577 
1 1 1 -5  11 49 o 16.59118 6.912907 4.668573       4.635120 6.019558       5.858627 2.407911       7.578590 17.70180 7.590447 16.02652 7.542825 1.675272       10.70089 
1 1 1 -5  11 50 o 13.42982 5.931077 1.889364       3.806609 2.700167       5.537600 1.163000       5.241325 14.86361 6.802759 13.86038 6.440697 1.003227       9.368036 
1 1 1 -5  12 1  o 389.8184 5.850881 1852.735       55.58015 1751.570       107.1930 1889.934       65.00037 378.4854 11.63583 393.6687 6.775617 -15.18326      13.46483 
1 1 1 -5  12 2  o 478.2947 7.027961 2789.998       81.91454 2699.313       113.3324 2889.194       118.5317 470.2418 9.890014 486.4901 9.998260 -16.24838      14.06334 
1 1 1 -5  12 3  o 509.9663 6.093894 3170.955       75.73079 3095.627       105.4417 3251.213       108.8380 503.7003 8.590219 516.1979 8.652232 -12.49759      12.19233 
1 1 1 -5  12 4  o 146.9970 2.928686 263.3243       10.49101 267.9857       14.84929 258.6789       14.82381 148.2241 4.115015 145.6228 4.181617 2.601212       5.866794 
1 1 1 -5  12 5  o 509.9823 7.466558 3172.069       92.79224 3176.133       131.6125 3168.052       130.8469 510.0559 10.58871 509.4112 10.54044 0.6447449      14.94061 
1 1 1 -5  12 6  o 1119.782 18.49032 15366.48       504.5613 15229.94       614.7042 15648.45       883.3551 1113.193 22.65999 1122.966 32.31354 -9.772827      39.46695 
1 1 1 -5  12 7  o 531.6384 6.939568 3446.490       89.90520 3442.050       142.1477 3449.451       116.0698 530.9844 10.98556 531.7287 8.957627 -0.7443237     14.17468 
1 1 1 -5  12 8  o 742.1467 10.66767 6722.991       192.9281 6457.664       265.6286 7019.230       280.6759 726.7205 14.99931 757.6237 15.20252 -30.90320      21.35640 
1 1 1 -5  12 9  o 92.10473 2.615443 103.4584       5.864397 118.0424       12.55076 99.38498       6.633010 98.26595 5.260375 90.25765 3.019969 8.008293       6.065621 
1 1 1 -5  12 10 o 414.6377 6.179729 2096.043       62.44165 2047.104       87.15563 2147.654       89.50282 409.6482 8.730685 419.5869 8.753440 -9.938660      12.36315 
1 1 1 -5  12 11 o 587.1094 8.522113 4204.776       121.9277 4117.173       170.1812 4297.172       174.7742 580.6308 12.02750 593.1802 12.09078 -12.54944      17.05426 
1 1 1 -5  12 12 o 516.2188 7.552450 3249.984       95.00748 3160.983       132.1408 3345.229       136.6967 508.8650 10.65610 523.4798 10.71574 -14.61478      15.11223 
1 1 1 -5  12 13 o 234.3944 3.895318 669.5995       22.24981 662.0641       31.55941 677.0464       31.37337 233.0400 5.557281 235.6641 5.463005 -2.624176      7.792804 
1 1 1 -5  12 14 o 686.7593 14.04657 5767.697       235.0774 6299.107       352.1941 5340.730       315.6923 716.0270 20.20463 659.4105 19.66789 56.61652       28.19669 
1 1 1 -5  12 15 o 422.0655 7.290960 2172.840       74.98954 2298.010       95.06062 1966.608       122.0190 433.9323 8.989646 400.9300 12.50414 33.00229       15.40024 
1 1 1 -5  12 16 o 125.7123 2.861754 192.5929       8.766902 188.4409       12.64107 196.4406       12.16895 124.2668 4.180336 126.8904 3.940167 -2.623581      5.744573 
1 1 1 -5  12 17 o 289.6995 5.326899 1023.317       37.60610 1026.749       46.02694 1016.427       65.22345 290.1339 6.509947 288.3645 9.293803 1.769409       11.34699 
1 1 1 -5  12 18 o 174.0673 3.256174 369.2963       13.81214 369.5569       19.81744 369.0501       19.26106 174.0374 4.676950 173.9244 4.548379 0.1130371      6.523926 
1 1 1 -5  12 19 o 101.6848 3.138448 126.1483       7.767600 137.9482       10.44196 111.5288       11.62276 106.2963 4.038485 95.50002 5.011787 10.79624       6.436409 
1 1 1 -5  12 20 o 295.9694 4.667772 1068.342       33.66608 1105.428       48.85217 1034.798       46.45992 300.9153 6.661982 291.1529 6.548191 9.762482       9.341349 
1 1 1 -5  12 21 o 310.2138 4.849120 1174.018       36.65728 1166.912       51.89499 1181.095       51.78762 309.0757 6.890084 310.9547 6.834280 -1.878967      9.704672 
1 1 1 -5  12 22 o 154.9879 3.675601 292.9445       13.88232 299.7073       26.09711 290.2757       16.39432 156.4460 6.861981 154.1906 4.367542 2.255402       8.134016 
1 1 1 -5  12 23 o 189.1584 3.453345 436.3872       15.91848 435.0950       22.73043 437.6310       22.30001 188.7189 4.946871 189.2793 4.838626 -0.5603638     6.919815 
1 1 1 -5  12 24 o 243.5244 4.052533 723.7336       24.04945 721.9630       34.22574 725.4604       33.80037 243.0277 5.779110 243.6272 5.693243 -0.5994720     8.112406 
1 1 1 -5  12 25 o 75.32489 3.123441 69.32700       5.720903 72.76814       9.324583 67.24979       7.244657 77.01167 4.995589 74.11589 4.026282 2.895775       6.416140 
1 1 1 -5  12 26 o 215.6680 4.407971 568.1255       23.16651 569.4135       41.98504 567.5617       27.77794 215.1575 8.021638 215.4446 5.290885 -0.2870483     9.609377 
1 1 1 -5  12 27 f 171.4296 3.324072 358.6377       13.88649 353.4076       19.64735 363.8583       19.62958 169.9715 4.748075 172.4786 4.674555 -2.507126      6.663008 
1 1 1 -5  12 28 o 86.72360 2.893768 91.86457       6.107008 95.25832       8.803256 88.71616       8.479092 88.20486 4.106847 85.11610 4.099970 3.088768       5.803098 
1 1 1 -5  12 29 o 165.7056 3.290602 335.2204       13.28767 328.8575       18.75780 341.6293       18.82559 163.8922 4.701501 167.0591 4.628721 -3.166977      6.597664 
1 1 1 -5  12 30 f 182.6066 4.935083 408.6022       21.94061 408.6022       21.94061 0.000000       0.000000 182.6066 4.935083 ?        ?        0.000000       4.935083 
1 1 1 -5  12 31 o 173.8101 3.403788 369.0637       14.41695 377.4303       20.69249 361.1711       20.09782 175.4667 4.843926 171.6502 4.809465 3.816513       6.826022 
1 1 1 -5  12 32 o 195.3495 3.621724 466.5330       17.24106 482.8174       24.88771 451.5068       23.90693 198.3253 5.153935 191.7919 5.119718 6.533447       7.264610 
1 1 1 -5  12 33 o 113.4283 3.050134 157.2971       8.423297 162.6366       11.94199 152.0104       11.88291 115.1547 4.262941 111.3017 4.389723 3.852982       6.119014 
1 1 1 -5  12 34 o 42.70907 4.152705 22.55821       4.267522 22.54362       5.829263 22.57505       6.264602 42.40227 5.792717 42.33448 6.261022 0.6778336E-01  8.529711 
1 1 1 -5  12 35 o 83.94243 3.934244 86.54578       8.025442 71.11996       15.24414 92.46056       9.439481 74.94172 8.497025 86.66806 4.484692 -11.72634      9.607908 
1 1 1 -5  12 36 o 21.99982 6.860494 5.994143       4.075265 6.528802       5.754170 5.456079       5.772465 23.78291 8.193663 22.62358 8.169512 1.159323       11.57052 
1 1 1 -5  12 37 o 28.84048 5.675122 10.65630       3.846426 8.540458       5.037263 13.61534       5.957023 25.80725 7.539301 32.28776 7.682907 -6.480511      10.76421 
1 1 1 -5  12 38 o 47.32244 3.968434 27.76864       4.534271 29.41048       6.101945 25.74421       6.775702 48.40372 5.257481 44.93669 6.365497 3.467033       8.255946 
1 1 1 -5  12 39 o 29.32078 5.546236 11.08972       3.817751 7.455366       5.112803 15.66984       5.739628 24.19532 7.703181 34.53497 7.058629 -10.33965      10.44812 
1 1 1 -5  12 40 o 44.46217 4.555348 24.90199       4.865990 24.42682       5.881134 25.93325       8.664080 43.65079 5.662111 43.78394 8.426097 -0.1331406     10.15178 
1 1 1 -5  12 41 o 41.79703 4.232853 22.06672       4.251993 21.91474       5.774222 22.24676       6.284598 40.96643 5.958554 41.03061 6.501932 -0.6417465E-01 8.819267 
1 1 1 -5  12 42 o 39.60756 5.336337 20.48494       5.019674 19.75690       5.790893 22.68521       10.06719 38.33401 6.426273 38.42154 10.46924 -0.8752441E-01 12.28422 
1 1 1 -5  12 43 o 19.96041 6.757335 5.299573       3.910266 7.139401       5.333623 3.161506       5.749690 22.73494 7.885890 19.00017 7.786423 3.734774       11.08222 
1 1 1 -5  12 44 o 51.65179 3.796641 34.24029       4.745432 33.21124       6.266577 35.62370       7.265871 49.75172 5.247720 50.87553 5.974319 -1.123810      7.951795 
1 1 1 -5  12 45 o 16.63503 6.640179 3.114219       4.059250 2.017449       5.623636 4.307269       5.865280 17.03995 7.372595 19.00750 7.834795 -1.967546      10.75821 
1 1 1 -5  12 46 o 17.41056 7.052158 3.868164       4.650761 -5.992368      8.374957 8.264737       5.592288 15.26104 7.380828 22.06644 8.030688 -6.805396      10.90727 
1 1 1 -5  12 47 o 14.24228 6.030831 1.820765       3.617647 -2.511578      4.977392 6.672198       5.267147 12.83607 6.063061 19.78456 7.663625 -6.948491      9.771994 
1 1 1 -5  12 48 o 13.90336 6.189931 1.203727       4.229719 -1.637901      5.280841 6.289189       7.064555 13.21161 6.241863 18.57827 8.146691 -5.366656      10.26301 
1 1 1 -5  12 49 o 21.31045 6.523675 8.215518       3.705017 9.718501       5.466423 6.938380       5.039007 20.95162 7.881469 18.48273 7.391364 2.468891       10.80508 
1 1 1 -5  12 50 o 12.02504 5.686206 -0.8995995     4.400289 -0.9838359     5.372682 -0.7279692     7.668988 12.80627 6.119798 14.20332 6.914021 -1.397050      9.233397 
1 1 1 -5  13 1  o 612.2855 7.932548 4572.531       118.3594 4607.961       187.9827 4549.260       152.3492 614.1818 12.55986 610.5182 10.24013 3.663574       16.20525 
1 1 1 -5  13 2  o 421.9998 6.282913 2171.240       64.61143 2179.432       129.1434 2168.504       74.62217 422.2059 12.56595 421.6888 7.261724 0.5171509      14.51330 
1 1 1 -5  13 3  o 463.7048 6.120346 2621.504       69.15978 2625.461       89.49911 2615.637       108.9612 463.9608 7.915918 462.9783 9.657733 0.9825134      12.48734 
1 1 1 -5  13 4  o 584.1699 7.592544 4161.808       108.0843 4120.231       169.5404 4190.276       140.2892 580.8492 11.97771 585.9837 9.824323 -5.134521      15.49138 
1 1 1 -5  13 5  o 372.8848 5.639193 1695.007       51.24220 1627.940       70.65730 1769.415       74.42415 365.3442 7.936313 380.8846 8.018338 -15.54044      11.28179 
1 1 1 -5  13 6  o 625.3661 8.095418 4769.924       123.3700 4664.617       192.1499 4843.781       160.9184 617.9635 12.75973 629.9748 10.48206 -12.01129      16.51315 
1 1 1 -5  13 7  o 918.8184 11.74785 10308.22       263.0414 10174.16       412.3000 10400.25       341.5908 911.3839 18.56419 922.2543 15.19915 -10.87042      23.99257 
1 1 1 -5  13 8  o 734.8017 9.456367 6587.858       169.3287 6805.437       274.1642 6453.679       215.2999 746.0462 15.08026 726.9545 12.15348 19.09174       19.36805 
1 1 1 -5  13 9  o 286.6031 4.517777 1001.167       31.55309 1011.541       45.20565 991.3118       44.06193 288.0366 6.440341 285.1448 6.341062 2.891815       9.038089 
1 1 1 -5  13 10 o 778.6870 10.00494 7399.997       189.8512 7581.967       305.0223 7284.920       242.5638 787.2372 15.89974 772.1986 12.89024 15.03857       20.46851 
1 1 1 -5  13 11 o 439.4692 6.530531 2354.910       69.93797 2165.684       93.75658 2592.298       105.0122 421.2986 9.132204 460.9145 9.349387 -39.61588      13.06936 
1 1 1 -5  13 12 o 283.7022 4.501546 981.0410       31.12150 975.0618       44.10836 986.9684       43.91714 282.7845 6.400725 284.5080 6.334372 -1.723450      9.005196 
1 1 1 -5  13 13 o 472.1710 9.865384 2721.440       113.5140 2532.429       152.5042 2956.252       169.9800 454.8789 13.77370 491.4347 14.20863 -36.55582      19.78888 
1 1 1 -5  13 14 o 270.8565 5.068199 894.3564       33.45254 945.1263       42.22328 808.7571       54.82572 278.4015 6.223638 257.2877 8.757150 21.11383       10.74343 
1 1 1 -5  13 15 o 606.9978 8.809887 4497.090       130.3147 4377.674       181.2052 4625.006       187.5439 598.3730 12.42690 615.0296 12.51327 -16.65662      17.63547 
1 1 1 -5  13 16 o 401.4950 6.988213 1966.513       68.37265 1940.181       82.92699 2022.414       120.8268 398.6783 8.535663 406.4713 12.21209 -7.792999      14.89942 
1 1 1 -5  13 17 o 81.43868 2.785929 80.92307       5.520735 73.13852       8.199396 87.37889       7.466907 77.33212 4.368735 84.58990 3.630768 -7.257782      5.680521 
1 1 1 -5  13 18 o 428.5459 7.368773 2241.868       76.95354 2291.990       96.19866 2152.798       128.2399 433.0963 9.114826 419.0164 12.57326 14.07999       15.52955 
1 1 1 -5  13 19 o 66.13071 3.023367 53.41761       4.859368 50.96398       7.383859 55.29217       6.453990 64.47059 4.732851 67.22595 3.957130 -2.755363      6.169178 
1 1 1 -5  13 20 o 375.9209 5.699845 1724.737       52.21505 1803.197       76.28255 1655.568       71.62388 384.0423 8.150985 368.0107 7.986589 16.03162       11.41158 
1 1 1 -5  13 21 o 225.5138 4.476827 620.4317       24.60251 668.0333       46.24205 601.6375       29.05623 233.5299 8.138095 222.0111 5.370671 11.51883       9.750523 
1 1 1 -5  13 22 o 59.10909 3.635155 42.77418       5.210836 30.89513       10.78215 46.39419       5.952086 49.40144 9.297417 61.54041 3.990439 -12.13897      10.11759 
1 1 1 -5  13 23 o 413.7813 6.222592 2093.522       62.74488 2058.978       88.11765 2129.051       89.36483 409.6249 8.827556 416.5449 8.803772 -6.919983      12.46724 
1 1 1 -5  13 24 o 48.29003 3.287428 28.57732       3.845497 36.04750       5.814614 22.76991       5.126802 54.15391 4.445199 42.88423 4.999496 11.26968       6.689900 
1 1 1 -5  13 25 o 155.1367 4.414153 294.1768       16.67080 0.000000       0.000000 294.1768       16.67080 ?        ?        155.1367 4.414153 0.000000       4.414153 
1 1 1 -5  13 26 o 74.32656 2.924949 67.49382       5.287491 62.02515       7.518456 72.84532       7.437483 71.12444 4.358776 77.13773 3.969963 -6.013290      5.895722 
1 1 1 -5  13 27 o 149.3248 3.126180 272.0900       11.37580 268.9038       16.26388 275.1418       15.91733 148.2619 4.506745 149.9924 4.359394 -1.730469      6.270173 
1 1 1 -5  13 28 o 240.2217 4.064428 705.1134       23.79292 676.4433       33.16716 735.5096       34.15096 234.9453 5.793025 245.0058 5.719925 -10.06053      8.141049 
1 1 1 -5  13 29 o 171.5728 3.833910 359.6958       16.02974 359.7106       20.11043 359.6700       26.54518 171.3686 4.820430 171.0223 6.380562 0.3462372      7.996757 
1 1 1 -5  13 30 o 185.9070 4.116901 422.6490       18.65101 410.6641       22.27067 450.7950       34.12909 183.0276 4.997898 191.1054 7.342167 -8.077789      8.881802 
1 1 1 -5  13 31 o 114.4486 3.017424 160.0576       8.408216 169.1469       12.17066 151.7582       11.62980 117.4907 4.257877 111.2737 4.296956 6.217072       6.049243 
1 1 1 -5  13 32 o 150.4926 3.242098 276.7281       11.88988 271.4930       16.78677 281.9983       16.84303 148.7742 4.635896 151.6436 4.563042 -2.869354      6.504835 
1 1 1 -5  13 33 f 29.36684 5.682017 10.96355       3.919237 14.69280       5.282996 6.399050       5.844756 33.93613 6.626086 23.81980 8.255486 10.11633       10.58575 
1 1 1 -5  13 34 o 41.96171 4.373128 21.82745       4.406247 13.57336       5.779576 33.28354       6.808939 32.43139 7.467424 51.71123 5.486934 -19.27983      9.266545 
1 1 1 -5  13 35 o 65.90604 4.715352 53.66173       7.523092 0.000000       0.000000 53.66173       7.523092 ?        ?        65.90604 4.715352 0.000000       4.715352 
1 1 1 -5  13 36 o 25.93714 6.075537 8.671035       3.772343 7.855954       4.977205 9.771306       5.782762 24.93000 7.547091 27.60141 8.081998 -2.671408      11.05791 
1 1 1 -5  13 37 o 48.56131 3.945947 29.18626       4.629375 35.51957       6.498882 22.66216       6.596047 53.35731 5.058559 42.10276 6.649399 11.25455       8.354851 
1 1 1 -5  13 38 o 90.10300 3.138330 99.77795       6.880350 100.8388       9.829543 98.75890       9.633972 90.17925 4.487008 89.25726 4.443173 0.9219894      6.314668 
1 1 1 -5  13 39 o 79.64159 3.649105 78.45927       7.063285 75.41733       8.628396 84.63874       12.29786 77.74678 4.574408 81.58066 6.233144 -3.833878      7.731578 
1 1 1 -5  13 40 o 18.05907 6.471920 3.680999       3.614793 1.612666       4.843786 6.280803       5.430566 17.26896 7.119231 22.68825 7.951558 -5.419294      10.67290 
1 1 1 -5  13 41 o 37.83648 4.689529 18.32428       4.231417 20.90170       5.798049 15.38722       6.189353 39.79087 6.179880 33.32096 7.766522 6.469906       9.925209 
1 1 1 -5  13 42 o 11.33852 5.243759 -2.366545      3.412301 0.5292061      4.343547 -7.034885      5.514995 15.24957 6.537257 12.65081 6.086047 2.598761       8.931725 
1 1 1 -5  13 43 o 24.97373 6.179171 8.719720       3.739772 2.623596       4.778016 18.36062       6.008687 17.43329 7.115728 35.88778 7.122047 -18.45450      10.06763 
1 1 1 -5  13 44 o 49.77311 4.389088 32.52187       5.269112 34.64626       7.912917 30.82950       7.062658 49.07566 6.799004 46.68868 6.373801 2.386974       9.319431 
1 1 1 -5  13 45 o 23.30176 6.683675 8.316691       3.992268 4.810059       5.080908 13.97499       6.454153 18.85299 7.460171 28.44503 8.590589 -9.592035      11.37771 
1 1 1 -5  13 46 o 14.58582 6.280962 1.473205       4.043858 2.362096       7.868629 1.154174       4.714015 18.07565 8.209435 15.02120 6.618448 3.054442       10.54508 
1 1 1 -5  13 47 o 10.61479 5.049603 -2.813429      3.572998 3.081456       5.217787 -8.018215      4.902868 16.39837 7.098287 10.45731 5.175915 5.941052       8.784975 
1 1 1 -5  13 48 o 14.60202 6.390414 2.168527       4.327790 4.406090       5.496988 -1.479826      7.019166 16.85182 7.290151 14.53666 6.959722 2.315162       10.07889 
1 1 1 -5  13 49 o 9.753401 4.766280 -4.324583      3.746059 -8.265417      5.371629 -0.5933932     5.226796 10.49191 5.230367 13.14064 6.208788 -2.648738      8.118238 
1 1 1 -5  13 50 o 15.46300 6.402135 4.244367       3.939958 4.020183       5.735227 4.444722       5.421853 15.46928 7.018993 15.69759 6.997216 -0.2283115     9.910969 
1 1 1 -5  14 1  o 760.5693 12.62864 7065.590       234.0623 7501.996       422.1831 6871.926       281.2423 781.4027 22.19371 749.6274 15.39569 31.77533       27.01089 
1 1 1 -5  14 2  o 902.0306 11.55531 9934.330       254.0031 9221.275       380.8264 10505.74       340.9085 867.7874 18.00851 926.9402 15.09211 -59.15283      23.49634 
1 1 1 -5  14 3  o 427.6784 5.695694 2229.754       59.36084 2193.101       92.71361 2255.218       77.27686 423.9924 8.973240 430.0411 7.374004 -6.048737      11.61443 
1 1 1 -5  14 4  o 550.3371 8.036886 3693.976       107.7836 3509.190       147.3481 3906.644       158.0746 536.1384 11.27799 565.6672 11.46740 -29.52887      16.08398 
1 1 1 -5  14 5  o 398.4820 4.881997 1935.452       47.40697 1961.394       67.67204 1910.452       66.43232 401.0693 6.923947 395.8283 6.887102 5.241058       9.765921 
1 1 1 -5  14 6  o 527.8700 6.910769 3397.676       88.89747 3346.796       139.3512 3432.591       115.4382 523.6122 10.92106 530.4437 8.930464 -6.831421      14.10754 
1 1 1 -5  14 7  f 713.7926 11.87773 6221.813       206.6054 6241.360       358.6297 6212.102       252.7649 713.0159 20.66185 712.8387 14.55089 0.1771851      25.27133 
1 1 1 -5  14 8  o 466.1564 6.163148 2649.328       70.01166 2715.518       112.9388 2608.017       89.22383 471.7207 9.824761 462.4155 7.917944 9.305206       12.61823 
1 1 1 -5  14 9  o 381.0000 6.626966 1770.006       61.52843 1652.143       102.2920 1836.823       77.01891 367.6538 11.43128 388.0521 8.144627 -20.39835      14.03599 
1 1 1 -5  14 10 o 583.5400 8.483325 4154.229       120.6349 4080.014       168.8430 4231.622       172.4201 577.9441 11.98840 588.5800 12.02116 -10.63586      16.97734 
1 1 1 -5  14 11 o 693.7028 10.01563 5874.188       169.3120 5683.563       234.1714 6083.001       245.0882 681.7432 14.09538 705.2628 14.26052 -23.51953      20.05099 
1 1 1 -5  14 12 o 519.2377 10.78019 3292.390       136.4045 3132.551       186.2046 3477.501       200.3852 505.7061 15.12671 532.7864 15.45024 -27.08023      21.62239 
1 1 1 -5  14 13 o 334.1196 5.986505 1361.237       48.74290 1394.119       60.55397 1300.719       82.14963 338.0671 7.350275 326.2036 10.34738 11.86349       12.69231 
1 1 1 -5  14 14 o 268.8237 4.344182 880.9034       28.45848 857.2023       39.98951 905.2234       40.50824 265.1238 6.189580 272.4522 6.101223 -7.328400      8.691135 
1 1 1 -5  14 15 o 145.2314 3.658472 257.2473       12.93751 254.9653       15.77166 261.9414       22.62070 144.5500 4.482793 146.4092 6.355317 -1.859238      7.777241 
1 1 1 -5  14 16 o 129.7686 2.969187 205.2376       9.389515 194.4969       13.57638 215.0856       12.99993 126.2304 4.420330 132.7703 4.022584 -6.539986      5.976663 
1 1 1 -5  14 17 o 527.5475 8.925005 3400.315       114.7377 3409.938       141.3119 3381.697       196.5589 527.9219 10.98432 524.4656 15.39608 3.456299       18.91281 
1 1 1 -5  14 18 o 453.0902 6.727787 2506.058       74.28361 2456.158       103.9505 2558.131       106.1911 448.1357 9.518771 457.3421 9.528201 -9.206390      13.46824 
1 1 1 -5  14 19 o 239.0882 3.991796 697.0608       23.25748 707.4231       33.49313 687.4115       32.32031 240.7579 5.708723 237.3363 5.588241 3.421585       7.988615 
1 1 1 -5  14 20 o 551.7889 8.091490 3724.514       108.8022 3603.614       151.0272 3854.964       156.8786 541.6920 11.44107 560.2458 11.49076 -18.55383      16.21529 
1 1 1 -5  14 21 o 457.8716 7.887970 2565.983       88.01264 2560.551       153.8417 2568.626       107.3083 455.0367 13.88994 457.6045 9.622923 -2.567841      16.89766 
1 1 1 -5  14 22 o 280.2614 4.503365 958.7428       30.75647 1000.485       44.91832 921.8982       42.20116 286.0323 6.444249 274.5899 6.306722 11.44241       9.016823 
1 1 1 -5  14 23 o 132.8660 2.971740 215.2913       9.621899 215.5017       13.88445 215.0970       13.34633 132.7965 4.296136 132.6861 4.132667 0.1104126      5.961185 
1 1 1 -5  14 24 o 133.0442 4.156359 216.3172       13.45897 0.000000       0.000000 216.3172       13.45897 ?        ?        133.0442 4.156359 0.000000       4.156359 
1 1 1 -5  14 25 o 134.2415 3.000992 219.8289       9.817200 223.7586       14.17468 216.2063       13.60978 135.2848 4.305082 132.9903 4.204758 2.294525       6.017784 
1 1 1 -5  14 26 o 26.24190 5.247494 8.721797       3.238360 8.936118       4.699600 8.528028       4.468593 26.53382 7.120444 25.92193 6.937478 0.6118927      9.941294 
1 1 1 -5  14 27 o 116.4320 2.954652 165.5193       8.376520 163.9235       11.98561 167.0429       11.71152 115.7402 4.256771 116.8535 4.119222 -1.113335      5.923520 
1 1 1 -5  14 28 o 46.84041 3.596268 26.95255       4.073560 24.51467       5.876096 29.20818       5.652193 44.39117 5.553104 48.62101 4.834401 -4.229843      7.362635 
1 1 1 -5  14 29 o 169.0485 4.804510 350.1178       19.77224 350.1178       19.77224 0.000000       0.000000 169.0485 4.804510 ?        ?        0.000000       4.804510 
1 1 1 -5  14 30 o 43.36470 4.666737 23.28828       4.854043 21.13512       5.695390 29.00413       9.279504 41.08648 5.853750 47.76617 8.271451 -6.679688      10.13328 
1 1 1 -5  14 31 o 43.42248 3.933099 23.25038       4.116753 19.95194       5.815636 26.56322       5.828320 39.81570 6.195291 46.23735 5.266429 -6.421650      8.131230 
1 1 1 -5  14 32 f 135.8417 3.147604 225.4737       10.41956 211.8806       14.56141 239.7368       14.91594 131.4039 4.554243 139.8203 4.383098 -8.416397      6.320813 
1 1 1 -5  14 33 o 85.67947 3.138880 89.85049       6.542637 86.91492       9.136195 92.94070       9.373750 84.06943 4.475681 86.94909 4.438657 -2.879662      6.303443 
1 1 1 -5  14 34 o 68.25468 3.320695 57.12987       5.506711 56.29778       7.571730 58.06414       8.023197 67.55058 4.627658 68.56890 4.832531 -1.018318      6.690933 
1 1 1 -5  14 35 o 65.93333 5.018690 53.85168       8.003063 0.000000       0.000000 53.85168       8.003063 ?        ?        65.93333 5.018690 0.000000       5.018690 
1 1 1 -5  14 36 o 144.4607 3.262044 255.7148       11.48354 248.9765       16.05336 262.7762       16.43368 142.0621 4.643391 145.9566 4.626195 -3.894409      6.554598 
1 1 1 -5  14 37 o 59.37390 3.550161 43.46233       5.113189 41.09421       6.945477 46.26451       7.555226 57.39069 5.016585 60.88438 5.140174 -3.493687      7.182445 
1 1 1 -5  14 38 o 30.72429 5.263905 12.07928       3.799465 11.75185       5.288480 12.42859       5.462242 29.81531 7.330899 30.65075 7.398036 -0.8354416     10.41504 
1 1 1 -5  14 39 o 20.26156 6.847237 4.997365       4.014938 5.982195       4.924979 3.046062       6.932440 22.13513 7.581948 21.07200 8.582349 1.063137       11.45175 
1 1 1 -5  14 40 o 43.79597 4.190919 24.15623       4.418302 20.16172       5.881064 29.33217       6.694516 39.13823 6.386230 47.59125 5.898563 -8.453018      8.693502 
1 1 1 -5  14 41 o 23.53662 6.961319 7.535168       4.272149 7.576252       4.863341 7.396334       8.940271 23.64896 7.511011 25.24373 9.924581 -1.594774      12.44639 
1 1 1 -5  14 42 o 22.39956 6.455108 6.921699       3.715601 4.173124       4.803258 11.01706       5.863114 19.23726 7.352758 27.49726 8.160854 -8.260002      10.98465 
1 1 1 -5  14 43 f 58.16831 3.753570 43.19661       5.292274 38.71261       6.980233 49.25916       8.116423 53.77096 5.400065 60.53685 5.564038 -6.765892      7.753659 
1 1 1 -5  14 44 o 16.00643 6.546173 2.411469       4.053524 -2.516333      5.765469 7.228310       5.700187 14.52444 6.751245 21.88814 8.084369 -7.363703      10.53263 
1 1 1 -5  14 45 o 31.35503 6.490761 14.82312       4.796026 13.72402       7.463733 15.59613       6.259326 26.93407 9.329352 30.25955 8.259226 -3.325481      12.46000 
1 1 1 -5  14 46 o 10.80419 5.115385 -2.731808      3.582532 -2.219553      5.393457 -3.136275      4.792541 13.58427 6.383937 12.39512 5.882621 1.189152       8.681007 
1 1 1 -5  14 47 o 14.69856 6.399310 1.934904       4.291439 5.902711       5.390623 -4.931326      7.091250 18.55964 7.564675 13.74305 6.680530 4.816585       10.09226 
1 1 1 -5  14 48 o 16.09202 6.404717 4.177889       3.765609 1.111269       5.495878 6.891428       5.169817 14.51167 6.691137 18.68741 7.482125 -4.175741      10.03761 
1 1 1 -5  14 49 o 21.04540 7.030131 8.834757       4.233093 13.36239       6.439356 5.389156       5.617455 22.81005 8.559748 16.72421 7.300688 6.085835       11.25030 
1 1 1 -5  15 1  o 444.1081 7.606687 2405.387       82.32284 2310.883       138.6882 2456.799       102.2932 434.7054 13.10704 448.7229 9.354753 -14.01752      16.10298 
1 1 1 -5  15 2  o 709.0640 10.23005 6136.229       176.7663 5771.594       338.3036 6273.166       207.3177 685.7108 20.26779 716.7253 11.86992 -31.01447      23.48783 
1 1 1 -5  15 3  o 757.8392 15.45082 7024.474       285.3412 7436.474       419.2354 6668.895       389.4732 777.8849 22.13851 736.7323 21.71731 41.15259       31.01218 
1 1 1 -5  15 4  o 151.7464 2.800714 280.6064       10.35674 263.6866       16.18296 292.3435       13.47845 147.0159 4.522457 154.8813 3.571121 -7.865448      5.762424 
1 1 1 -5  15 5  o 287.6609 4.105676 1008.526       28.78071 978.6527       44.62873 1029.796       37.65760 283.3109 6.464206 290.6515 5.316723 -7.340546      8.369797 
1 1 1 -5  15 6  o 580.3815 9.768500 4110.758       138.1585 3950.375       164.6335 4492.645       254.0422 568.7312 11.87887 605.4872 17.23482 -36.75604      20.93195 
1 1 1 -5  15 7  o 504.6865 7.420619 3106.395       91.26367 3079.293       128.3939 3134.071       129.7494 502.2451 10.49041 506.6911 10.50814 -4.446014      14.84823 
1 1 1 -5  15 8  o 608.0960 8.840300 4511.764       131.0012 4431.101       182.9013 4596.733       187.7200 602.2281 12.46291 613.3674 12.55896 -11.13928      17.69327 
1 1 1 -5  15 9  o 576.9838 8.410519 4061.569       118.2558 4076.686       167.7731 4046.643       166.7100 577.6813 11.91785 575.5527 11.88613 2.128601       16.83197 
1 1 1 -5  15 10 o 327.1839 5.085474 1304.981       40.54708 1319.898       57.98576 1290.707       56.71965 328.9658 7.233267 325.3113 7.154813 3.654541       10.17406 
1 1 1 -5  15 11 o 439.9285 7.533781 2360.853       80.76647 2453.506       143.8222 2318.174       97.61147 447.7549 13.19543 435.8118 9.191063 11.94315       16.08089 
1 1 1 -5  15 12 o 129.7948 2.649869 205.2992       8.381425 222.2420       14.17272 196.1871       10.39370 134.9585 4.314945 126.8311 3.365830 8.127434       5.472437 
1 1 1 -5  15 13 o 159.6132 3.210593 310.4920       12.48792 295.1314       17.64440 325.9091       17.67682 155.5242 4.660830 163.4493 4.442095 -7.925171      6.438598 
1 1 1 -5  15 14 o 428.8536 6.410060 2243.347       66.98959 2319.207       97.09837 2174.440       92.54103 435.7996 9.143007 421.9934 8.998964 13.80615       12.82872 
1 1 1 -5  15 15 o 102.6948 2.918534 128.6369       7.296402 125.2931       10.85808 131.3899       9.852412 101.2797 4.409981 103.7459 3.904010 -2.466255      5.889756 
1 1 1 -5  15 16 o 543.7744 9.189721 3613.622       121.7747 3632.185       150.1585 3577.958       208.1330 544.7505 11.31140 539.2684 15.85520 5.482117       19.47653 
1 1 1 -5  15 17 o 454.4893 6.765047 2521.692       74.92565 2422.386       103.3764 2631.588       108.7494 445.0275 9.532317 463.8297 9.621265 -18.80219      13.54377 
1 1 1 -5  15 18 o 304.3091 4.794831 1129.641       35.55695 1175.677       51.88728 1088.882       48.82275 310.2592 6.862780 298.6028 6.709533 11.65646       9.597687 
1 1 1 -5  15 19 o 152.0299 3.122909 281.7856       11.56977 281.3872       16.80539 282.1446       15.95217 151.8047 4.547966 152.0256 4.310281 -0.2208405     6.265981 
1 1 1 -5  15 20 o 259.1484 4.938157 819.7087       31.18526 834.4521       56.16278 813.1367       37.49702 260.8197 8.849148 258.0045 5.963942 2.815247       10.67127 
1 1 1 -5  15 21 o 113.0362 2.862714 155.8917       7.879201 158.7227       11.58692 153.4565       10.74625 113.9732 4.178929 112.0818 3.940597 1.891449       5.743845 
1 1 1 -5  15 22 o 106.4973 2.845160 138.4019       7.377209 142.2980       10.89346 135.1014       10.02630 107.8959 4.150839 105.1465 3.919860 2.749336       5.709182 
1 1 1 -5  15 23 o 50.51157 3.409029 31.26967       4.171636 40.10698       7.689585 27.58402       4.965920 56.99934 5.608579 47.33086 4.354219 9.668484       7.100379 
1 1 1 -5  15 24 o 104.8827 2.886291 134.2748       7.369989 137.2847       10.89105 131.7322       10.01007 105.9447 4.226950 103.8008 3.964598 2.143860       5.795269 
1 1 1 -5  15 25 o 191.6580 3.510585 448.3352       16.39617 426.6102       22.98591 470.8402       23.39487 186.7176 5.056386 196.2515 4.891834 -9.533844      7.035416 
1 1 1 -5  15 26 o 126.8195 2.978220 196.2378       9.204047 198.6526       13.27708 194.0036       12.77066 127.4316 4.281603 125.9433 4.166780 1.488281       5.974460 
1 1 1 -5  15 27 o 167.1871 3.304302 341.2238       13.46228 340.0454       19.23228 342.3560       18.85054 166.6638 4.740178 167.2477 4.629623 -0.5838470     6.625911 
1 1 1 -5  15 28 o 74.12719 3.263964 67.22006       5.881567 65.54496       7.676416 69.60130       9.152506 73.08398 4.329629 75.22993 5.021190 -2.145958      6.630086 
1 1 1 -5  15 29 o 112.2623 3.607185 154.1495       9.855403 150.7969       11.64114 162.6324       18.51729 110.9417 4.314129 114.7958 6.647786 -3.854134      7.924946 
1 1 1 -5  15 30 o 67.11057 3.202718 55.13692       5.222646 47.42520       7.348010 63.00994       7.424457 62.01831 4.901818 71.62855 4.272881 -9.610237      6.502717 
1 1 1 -5  15 31 o 64.65626 3.323061 51.22050       5.218259 51.50571       7.419206 50.94129       7.340883 64.65173 4.742125 64.29833 4.717877 0.3534012      6.689253 
1 1 1 -5  15 32 o 87.75578 3.095168 94.22217       6.608692 93.10286       9.336483 95.34610       9.355749 87.04631 4.415887 88.09866 4.371513 -1.052345      6.213710 
1 1 1 -5  15 33 o 23.25401 6.440912 6.885844       3.775115 4.711987       5.154278 9.401517       5.544716 21.29207 7.715426 27.19355 7.900151 -5.901478      11.04265 
1 1 1 -5  15 34 o 101.7347 4.404613 127.3152       10.89389 0.000000       0.000000 127.3152       10.89389 ?        ?        101.7347 4.404613 0.000000       4.404613 
1 1 1 -5  15 35 o 122.3173 3.800974 183.7417       11.31597 165.8323       20.70301 191.3718       13.51316 114.9204 7.432514 124.6516 4.455765 -9.731194      8.665801 
1 1 1 -5  15 36 o 51.32615 3.825879 32.54905       4.750844 28.04420       6.500975 37.71237       6.959896 47.18561 5.773857 54.94974 5.261783 -7.764130      7.811772 
1 1 1 -5  15 37 o 105.0607 3.103370 135.5643       7.936587 122.4410       10.91446 150.2897       11.56152 99.39753 4.517807 110.2230 4.312663 -10.82550      6.245770 
1 1 1 -5  15 38 o 99.54121 3.542880 122.3327       8.580297 115.6685       10.62152 134.8502       14.55702 96.38525 4.534813 103.3976 5.800568 -7.012360      7.362821 
1 1 1 -5  15 39 o 49.60609 3.887047 30.71360       4.661342 36.93415       6.514885 24.18903       6.672195 54.02399 5.005535 43.01980 6.572734 11.00418       8.261732 
1 1 1 -5  15 40 o 23.56219 6.330448 7.446509       3.711958 4.182148       4.849225 12.06615       5.768690 19.70185 7.420645 29.50313 7.876251 -9.801279      10.82134 
1 1 1 -5  15 41 o 20.86851 7.040594 5.691098       4.244873 5.515946       4.755244 6.378183       9.418251 20.90573 7.430580 24.52252 9.997514 -3.616785      12.45648 
1 1 1 -5  15 42 o 38.58762 4.660545 19.42562       4.293821 20.32205       5.717624 18.26615       6.502586 38.48057 6.316257 35.47096 7.740738 3.009605       9.990703 
1 1 1 -5  15 43 o 26.08423 6.622141 9.875095       4.216144 5.228714       6.369124 13.49923       5.625022 20.65045 8.292184 29.82682 7.689787 -9.176373      11.30898 
1 1 1 -5  15 44 o 31.06346 5.684238 13.70161       4.144354 11.88867       5.595538 15.90464       6.168228 27.01318 7.961010 31.33409 8.039149 -4.320911      11.31396 
1 1 1 -5  15 45 o 19.80170 7.157426 6.107613       4.432139 4.665752       7.894584 6.771234       5.355838 19.54644 8.590320 20.53068 7.783872 -0.9842377     11.59234 
1 1 1 -5  15 46 o 28.52185 6.503362 12.90019       4.419499 16.15128       7.668772 11.28351       5.407838 27.51370 9.459870 24.91681 7.921103 2.596889       12.33827 
1 1 1 -5  15 47 o 17.38996 6.955599 4.966903       4.463172 0.2551044      5.515570 13.90445       7.596374 14.41497 6.666609 23.99239 9.227308 -9.577428      11.38362 
1 1 1 -5  15 48 o 22.48327 6.915460 9.467626       4.157211 10.16856       6.009542 8.824378       5.756958 20.97121 8.168416 19.93203 7.923692 1.039177       11.38015 
1 1 1 -5  15 49 o 11.90316 5.461730 0.1586249      3.600224 2.255492       5.444941 -1.470234      4.798986 14.53618 6.687079 12.16438 5.805015 2.371809       8.855237 
1 1 1 -5  16 1  o 184.6684 4.791146 415.9650       21.54275 415.9650       21.54275 0.000000       0.000000 184.6684 4.791146 ?        ?        0.000000       4.791146 
1 1 1 -5  16 2  o 85.83836 3.363540 89.93321       7.022191 90.48781       8.538574 88.77422       12.34349 86.06796 4.082701 85.12069 5.988906 0.9472733      7.248134 
1 1 1 -5  16 3  o 734.9853 12.23621 6599.287       219.1601 6202.117       363.5886 6825.942       274.6659 710.4160 21.02517 746.9938 15.08869 -36.57782      25.87908 
1 1 1 -5  16 4  o 147.7291 3.079316 265.9566       11.08553 258.9967       15.41362 273.4140       15.95500 145.7065 4.345855 149.7092 4.378032 -4.002716      6.168762 
1 1 1 -5  16 5  o 410.5135 5.511838 2054.457       55.13914 2014.252       70.25127 2118.965       88.98550 406.4043 7.093487 416.7355 8.762391 -10.33124      11.27373 
1 1 1 -5  16 6  o 208.1804 3.660606 528.1926       18.57073 508.0084       25.56070 550.7582       27.02651 204.0749 5.143909 212.5540 5.217766 -8.479111      7.326997 
1 1 1 -5  16 7  o 493.5777 6.508319 2970.723       78.28174 2911.253       122.3140 3011.983       101.8803 488.3227 10.27858 496.8611 8.414326 -8.538361      13.28345 
1 1 1 -5  16 8  o 438.6504 5.848132 2346.023       62.51321 2330.899       98.64877 2356.172       80.80994 437.0148 9.263165 439.5010 7.545166 -2.486206      11.94721 
1 1 1 -5  16 9  o 247.2199 3.678553 744.8915       22.16137 695.8666       34.00625 781.0818       29.21776 238.8958 5.841362 253.1312 4.736583 -14.23537      7.520421 
1 1 1 -5  16 10 o 533.9293 7.821273 3478.161       101.7647 3205.173       192.9313 3583.388       119.7830 511.3255 15.50140 541.8217 9.071989 -30.49625      17.96091 
1 1 1 -5  16 11 o 148.3227 2.801645 268.1024       10.12644 264.2764       16.42592 270.4480       12.86123 147.1666 4.585794 148.9619 3.543000 -1.795319      5.795029 
1 1 1 -5  16 12 o 366.9121 5.614262 1641.640       50.19852 1794.696       75.22449 1518.765       67.40096 383.4732 8.049856 352.7794 7.840192 30.69379       11.23694 
1 1 1 -5  16 13 o 362.6792 5.530181 1604.084       48.87627 1588.726       69.23354 1619.343       69.00999 360.7786 7.874803 364.2463 7.774647 -3.467743      11.06606 
1 1 1 -5  16 14 o 236.9474 4.005803 684.4377       23.13011 653.6987       32.28272 716.8635       33.15661 231.5034 5.722379 242.4351 5.612270 -10.93169      8.015185 
1 1 1 -5  16 15 o 473.2456 7.017627 2733.877       80.93065 2883.582       118.8202 2604.322       110.5349 485.5626 10.04174 461.4883 9.828849 24.07434       14.05143 
1 1 1 -5  16 16 o 338.6502 6.033332 1399.603       49.79029 1415.584       61.99075 1370.553       83.57941 340.4326 7.472393 334.4547 10.26693 5.977875       12.69829 
1 1 1 -5  16 17 o 173.4026 3.331406 366.5785       14.07729 372.4320       20.53931 361.3928       19.33208 174.6596 4.830303 172.0646 4.614698 2.595047       6.680364 
1 1 1 -5  16 18 o 370.9961 5.668674 1680.330       51.24917 1634.367       71.65561 1728.465       73.32787 365.5247 8.044469 375.9072 8.004834 -10.38251      11.34861 
1 1 1 -5  16 19 o 162.5349 3.753986 322.2098       14.86878 339.5286       28.24195 315.5685       17.48881 166.4950 6.976229 160.7554 4.468687 5.739548       8.284741 
1 1 1 -5  16 20 o 165.0278 3.252769 332.1317       13.08117 326.4001       18.80693 337.5034       18.20679 163.4483 4.726698 166.2284 4.498747 -2.780136      6.525366 
1 1 1 -5  16 21 o 36.92666 3.884299 16.82218       3.443054 20.60365       5.674001 14.61822       4.331730 40.63342 5.902739 34.17902 5.378249 6.454403       7.985479 
1 1 1 -5  16 22 o 229.5567 3.923162 643.1741       21.94635 628.6881       31.03331 657.6667       31.04034 226.7537 5.616136 231.9386 5.491835 -5.184845      7.855013 
1 1 1 -5  16 23 o 163.9432 3.646454 328.0212       14.56801 326.2862       24.96911 328.9166       17.93746 163.1265 6.293001 164.0366 4.491517 -0.9101105     7.731467 
1 1 1 -5  16 24 o 370.9444 5.690038 1683.932       51.43516 1677.701       72.95065 1690.092       72.53175 369.4289 8.103304 370.8216 8.026516 -1.392670      11.40563 
1 1 1 -5  16 25 o 105.4021 2.889954 135.6377       7.415943 136.4661       10.83664 134.9080       10.17048 105.6038 4.219432 105.0230 3.981145 0.5808334      5.801132 
1 1 1 -5  16 26 f 73.02495 2.944689 65.17603       5.229441 62.28728       7.587786 67.78951       7.217214 71.24834 4.391571 74.38268 3.996309 -3.134338      5.937708 
1 1 1 -5  16 27 o 198.0904 4.113655 479.6457       19.85762 500.3575       25.50373 447.7570       31.64561 202.0674 5.183585 190.7427 6.819129 11.32466       8.565633 
1 1 1 -5  16 28 o 104.4682 2.968430 133.3281       7.549295 134.3857       10.86008 132.3391       10.50158 104.7357 4.263938 103.9482 4.154100 0.7875290      5.952959 
1 1 1 -5  16 29 o 49.82215 4.601877 30.64811       5.524083 35.05088       6.369712 17.28996       11.09506 53.25584 4.965355 36.99841 11.28201 16.25743       12.32633 
1 1 1 -5  16 30 o 86.59995 3.008220 91.69897       6.338745 94.06054       9.259023 89.61582       8.696112 87.54343 4.353819 85.46832 4.188015 2.075111       6.041126 
1 1 1 -5  16 31 o 201.1095 3.717466 494.7561       18.21862 475.4937       25.56983 514.6181       25.96475 196.6722 5.340120 204.6521 5.210570 -7.979950      7.461027 
1 1 1 -5  16 32 o 13.28338 5.754008 -0.4576948     3.433541 -7.828990      4.839481 7.013625       4.872205 11.58659 5.605398 23.88673 7.509071 -12.30014      9.370520 
1 1 1 -5  16 33 o 71.12131 3.568044 62.07788       6.164199 58.53670       9.709091 64.46917       7.978482 68.63408 5.861039 72.32153 4.550124 -3.687454      7.419933 
1 1 1 -5  16 34 o 53.02429 4.717017 34.85909       6.031513 12.05827       11.80399 42.91576       7.016675 32.54969 11.69150 58.83081 4.939878 -26.28112      12.69227 
1 1 1 -5  16 35 o 47.45155 4.083660 27.87721       4.676221 21.86996       6.472305 34.43749       6.763663 41.40234 6.639346 52.50315 5.361589 -11.10080      8.533906 
1 1 1 -5  16 36 o 30.13745 5.636376 11.64319       3.987312 7.493179       5.406433 16.59257       5.904211 24.53850 7.932136 35.75283 7.027325 -11.21433      10.59727 
1 1 1 -5  16 37 o 65.57790 3.459003 53.06976       5.508153 51.85422       7.673250 54.36200       7.911627 64.40379 4.926528 65.93980 4.959949 -1.536011      6.990834 
1 1 1 -5  16 38 o 107.9080 3.170577 143.5406       8.328312 145.8411       11.87195 141.3115       11.68627 108.1302 4.515398 106.4347 4.515903 1.695457       6.386094 
1 1 1 -5  16 39 f 20.48309 6.567590 5.369284       3.711400 7.213812       4.973752 3.051873       5.574975 23.50690 7.608892 19.42069 7.771796 4.086205       10.87640 
1 1 1 -5  16 40 o 26.28816 6.020927 9.285805       3.773956 12.51959       5.263574 5.864587       5.413962 30.11381 7.258350 21.85718 7.909178 8.256634       10.73493 
1 1 1 -5  16 41 o 39.54780 5.114005 20.47517       4.813278 22.00813       5.777151 16.99597       8.703382 40.49773 6.038195 33.06115 9.973856 7.436581       11.65923 
1 1 1 -5  16 42 o 14.43120 6.109166 0.9374269      3.710556 -3.561254      4.778469 7.769763       5.888854 12.89526 6.043850 23.24940 8.268421 -10.35414      10.24182 
1 1 1 -5  16 43 o 17.81834 6.868277 3.901802       4.215445 10.98720       6.511019 -1.211518      5.531188 25.90773 8.719644 15.02138 6.845852 10.88635       11.08593 
1 1 1 -5  16 44 o 29.29342 6.017301 12.56306       4.151614 10.54009       5.765494 14.74161       5.983086 24.93294 8.200210 29.78331 8.052301 -4.850376      11.49274 
1 1 1 -5  16 45 o 24.49527 7.332364 10.02027       4.717346 4.620148       9.731905 11.67879       5.393325 19.83107 9.054237 25.92648 7.857826 -6.095417      11.98852 
1 1 1 -5  16 46 o 13.85744 6.161272 0.8725178      4.176433 -2.079553      5.259541 5.910761       6.871065 13.23409 6.245451 18.91710 8.166968 -5.683002      10.28129 
1 1 1 -5  16 47 o 17.82158 6.913414 5.593312       4.291166 13.33185       7.695704 2.101544       5.169419 22.85731 9.136498 15.06981 6.766295 7.787502       11.36918 
1 1 1 -5  16 48 o 13.70713 6.046074 1.875936       3.944061 -8.450191      5.688679 11.43409       5.473055 10.79754 5.382696 22.62976 7.978441 -11.83222      9.624393 
1 1 1 -5  17 1  o 389.5510 5.901514 1850.240       56.02267 1771.118       76.75909 1940.428       81.95162 381.0071 8.267242 398.7919 8.432864 -17.78482      11.80934 
1 1 1 -5  17 2  o 171.4032 2.965485 358.0288       12.38656 345.9786       19.04709 366.8595       16.30526 168.4092 4.645599 173.4939 3.856623 -5.084702      6.037809 
1 1 1 -5  17 3  o 106.5467 2.614505 138.3387       6.788369 139.3546       10.49336 137.6075       8.902110 106.8512 4.037207 106.2037 3.444227 0.6474457      5.306764 
1 1 1 -5  17 4  o 502.1043 7.395981 3075.124       90.49527 2992.679       177.2065 3104.211       105.2549 494.3217 14.72714 504.3808 8.563427 -10.05902      17.03587 
1 1 1 -5  17 5  o 60.31541 3.288702 44.46778       4.815515 35.57795       6.455359 55.62148       7.230745 53.79334 4.980988 67.40614 4.426469 -13.61280      6.663623 
1 1 1 -5  17 6  o 615.2396 8.001750 4618.167       119.9680 4843.964       195.8946 4482.662       151.7546 629.4565 12.77087 605.8858 10.27815 23.57074       16.39315 
1 1 1 -5  17 7  o 161.2740 3.840969 317.0097       15.09528 301.9859       26.24347 324.4381       18.45362 157.2019 6.867147 163.0745 4.648393 -5.872559      8.292483 
1 1 1 -5  17 8  o 311.8970 4.392764 1185.816       33.38760 1166.974       52.56247 1198.560       43.22864 309.3071 6.973484 313.5237 5.658029 -4.216614      8.980131 
1 1 1 -5  17 9  o 318.5172 5.738214 1237.123       44.53954 0.000000       0.000000 1237.123       44.53954 ?        ?        318.5172 5.738214 0.000000       5.738214 
1 1 1 -5  17 10 o 275.7423 3.998517 926.8093       26.86820 896.8619       42.20255 947.2209       34.84154 271.1650 6.386589 278.7255 5.129612 -7.560486      8.191546 
1 1 1 -5  17 11 o 564.8361 8.268163 3894.753       113.8066 3811.138       158.6904 3983.298       163.3024 558.2130 11.66580 570.6674 11.74285 -12.45447      16.55251 
1 1 1 -5  17 12 o 202.5902 3.659146 500.2918       18.06485 495.9505       25.89686 504.4064       25.21201 201.5953 5.275990 203.3185 5.092563 -1.723129      7.332821 
1 1 1 -5  17 13 o 104.5435 3.000654 133.3201       7.636593 136.3081       11.43518 130.9149       10.25973 105.6383 4.452051 103.5450 4.073983 2.093323       6.034741 
1 1 1 -5  17 14 o 300.1367 4.746418 1098.603       34.71532 1146.495       51.02848 1057.340       47.36564 306.4590 6.832886 294.3205 6.603995 12.13846       9.502688 
1 1 1 -5  17 15 o 152.9064 3.664699 285.0570       13.65526 281.4302       17.36015 290.9423       22.11451 151.8273 4.697755 154.2876 5.892628 -2.460342      7.536045 
1 1 1 -5  17 16 o 207.0134 3.695880 522.5472       18.64457 524.3895       26.92893 520.8510       25.83961 207.2262 5.337034 206.6060 5.132241 0.6202087      7.404312 
1 1 1 -5  17 17 o 236.0009 4.629738 679.5490       26.62601 681.0524       47.61823 678.8651       32.11580 235.7650 8.301107 235.8092 5.588843 -0.4423523E-01 10.00718 
1 1 1 -5  17 18 o 132.9156 3.527876 215.6061       11.41672 228.6062       22.17298 210.9163       13.31777 136.5886 6.681797 131.4189 4.163763 5.169739       7.872949 
1 1 1 -5  17 19 o 135.3838 3.045364 223.5040       10.04713 219.4571       14.58596 227.1579       13.85944 134.0167 4.472485 136.3746 4.175300 -2.357941      6.118517 
1 1 1 -5  17 20 o 105.1015 3.382167 134.8839       8.651157 133.2337       17.06843 135.4545       10.03576 104.1187 6.763719 105.2851 3.918372 -1.166382      7.816747 
1 1 1 -5  17 21 o 157.5308 3.196662 302.7102       12.27152 302.6524       17.83417 302.7621       16.91165 157.3479 4.656223 157.4025 4.413337 -0.5455017E-01 6.415446 
1 1 1 -5  17 22 o 246.7692 4.713298 743.9753       28.34340 757.1369       49.39608 737.5148       34.60747 248.1401 8.180001 245.5283 5.784052 2.611816       10.01837 
1 1 1 -5  17 23 o 106.0011 2.899567 137.1629       7.482923 140.7264       11.06219 134.1568       10.16016 107.2577 4.240661 104.7445 3.987744 2.513184       5.821109 
1 1 1 -5  17 24 o 319.7341 5.033146 1250.305       39.21612 1249.499       55.91560 1251.085       55.01528 319.0081 7.192756 319.2513 7.071550 -0.2432251     10.08675 
1 1 1 -5  17 25 o 100.0743 2.904773 122.2983       7.076379 133.8533       10.74924 113.4605       9.400785 104.5732 4.226854 96.28703 4.015266 8.286171       5.829979 
1 1 1 -5  17 26 o 181.3427 3.448183 401.5625       15.23795 405.7884       21.98830 397.6577       21.13638 182.0157 4.961946 180.2087 4.817351 1.806976       6.915763 
1 1 1 -5  17 27 o 23.56455 5.947122 7.078295       3.414699 2.452342       4.899125 11.44895       4.762021 18.65475 7.342916 29.93727 6.695468 -11.28252      9.937189 
1 1 1 -5  17 28 o 111.2471 3.632426 151.3996       9.834200 154.7692       11.86296 143.9964       17.58389 112.3842 4.339791 107.9637 6.716721 4.420464       7.996757 
1 1 1 -5  17 29 o 93.60495 3.029056 107.1116       6.900332 94.49932       9.650612 120.3044       9.870180 87.72980 4.529440 99.07743 4.096870 -11.34763      6.107387 
1 1 1 -5  17 30 o 49.77232 3.567858 30.44399       4.298739 25.73444       6.250826 34.66998       5.921227 45.39330 5.781832 52.98767 4.632178 -7.594376      7.408553 
1 1 1 -5  17 31 o 50.66655 3.654113 31.56952       4.481383 30.58759       6.444534 32.48890       6.235880 49.59080 5.420990 51.18988 5.065272 -1.599083      7.419172 
1 1 1 -5  17 32 o 124.7036 3.133146 190.2593       9.513750 183.6785       13.53442 196.6869       13.37593 122.2481 4.551141 126.5568 4.343570 -4.308693      6.291223 
1 1 1 -5  17 33 o 55.74153 3.965036 38.28938       5.350785 43.47048       8.956347 35.41376       6.672455 58.92820 6.336381 53.37546 5.195563 5.552738       8.194119 
1 1 1 -5  17 34 o 57.83320 4.403770 41.37139       6.159710 42.85723       12.32582 40.87679       7.111390 57.53801 9.092460 57.32864 5.144998 0.2093658      10.44719 
1 1 1 -5  17 35 o 48.03199 3.962986 28.56187       4.597388 26.75706       6.685493 30.18100       6.332256 45.97295 6.119370 49.06654 5.384205 -3.093590      8.150850 
1 1 1 -5  17 36 o 13.47845 5.829247 -0.3129695     3.512710 6.751064       5.168492 -6.376901      4.788667 23.44323 7.766382 12.03897 5.759761 11.40426       9.669103 
1 1 1 -5  17 37 o 24.20919 6.786029 7.679918       4.163534 3.381268       5.301120 14.60089       6.726440 19.67789 7.669813 32.90706 8.369827 -13.22917      11.35253 
1 1 1 -5  17 38 o 51.57795 3.882843 33.18877       4.844507 35.81594       6.857666 30.57154       6.844687 53.04105 5.379857 48.76175 5.878683 4.279297       7.968800 
1 1 1 -5  17 39 o 68.32518 3.385688 58.04902       5.619646 50.56373       7.743246 66.37917       8.168557 62.95805 5.090403 72.44243 4.651763 -9.484383      6.895730 
1 1 1 -5  17 40 o 45.93141 4.108078 26.77857       4.549669 25.71386       6.279027 27.95545       6.601484 44.03193 6.008364 45.91276 6.047148 -1.880829      8.524579 
1 1 1 -5  17 41 o 21.19768 7.262662 6.087962       4.518988 0.4838346      5.185479 23.78189       9.213975 16.20309 7.044590 38.92336 9.738839 -22.72027      12.01962 
1 1 1 -5  17 42 o 16.68855 6.624616 2.860794       4.018392 6.044684       6.047323 0.3434013      5.377242 21.28984 8.221066 16.03330 7.066378 5.256542       10.84065 
1 1 1 -5  17 43 o 22.35439 6.703041 7.518434       3.939780 9.755159       5.433277 5.038322       5.721251 24.60143 7.951747 19.59514 7.862334 5.006289       11.18242 
1 1 1 -5  17 44 o 29.91568 5.777743 13.04093       4.059547 18.65572       6.081312 8.527746       5.452206 34.06448 7.526695 22.52357 7.961252 11.54091       10.95594 
1 1 1 -5  17 45 o 17.71566 6.905037 4.649383       4.296670 -0.1538086     8.162582 6.490366       5.053446 16.78037 7.875723 19.76300 7.544732 -2.982630      10.90642 
1 1 1 -5  17 46 o 30.63248 5.931282 14.65450       4.267577 16.39699       6.310220 13.18576       5.793379 28.73195 8.450584 25.83498 8.196897 2.896965       11.77291 
1 1 1 -5  17 47 o 22.67806 6.906012 9.480722       4.159150 9.670510       6.268878 9.331494       5.558787 20.56498 8.237354 20.79346 7.919045 -0.2284775     11.42652 
1 1 1 -5  17 48 o 13.12703 6.215315 -0.5052478     5.289455 2.010847       7.610919 -2.855880      7.356411 15.36709 7.327037 13.61610 6.659300 1.750988       9.901098 
1 1 1 -5  18 1  o 219.9372 3.830289 589.5869       20.52893 537.2485       38.34637 610.6137       24.30532 209.7150 7.515563 223.8116 4.456385 -14.09657      8.737451 
1 1 1 -5  18 2  o 269.1438 3.922342 882.9294       25.72563 865.7622       39.96802 895.0724       33.61441 266.4467 6.155541 270.9560 5.090853 -4.509369      7.987958 
1 1 1 -5  18 3  o 183.7886 3.086126 411.6590       13.82192 414.9500       21.72456 409.4207       17.91574 184.4293 4.837936 183.2746 4.011405 1.154739       6.284663 
1 1 1 -5  18 4  o 372.1750 5.072663 1688.724       46.00651 1705.640       72.99346 1677.574       59.25881 373.8684 8.011782 370.8705 6.556840 2.997925       10.35282 
1 1 1 -5  18 5  o 182.5910 3.435344 406.3369       15.28571 478.1957       32.37067 385.7156       17.34083 197.8873 6.722466 177.8887 4.000236 19.99866       7.822623 
1 1 1 -5  18 6  o 570.9687 7.460500 3977.610       103.8045 3917.969       162.6364 4018.608       134.8426 566.0953 11.78941 573.6415 9.646073 -7.546204      15.23276 
1 1 1 -5  18 7  o 381.9541 5.202008 1778.806       48.41927 1805.833       77.63547 1761.601       61.94225 384.6409 8.282636 380.0166 6.688800 4.624298       10.64622 
1 1 1 -5  18 8  o 181.4444 3.483464 401.2694       15.40249 393.6275       31.67483 403.6360       17.62684 179.4637 7.257688 181.9696 3.975022 -2.505890      8.274952 
1 1 1 -5  18 9  o 338.1228 5.259216 1394.136       43.33428 1354.688       60.51208 1435.663       62.08608 333.1694 7.453167 342.9843 7.428206 -9.814819      10.52273 
1 1 1 -5  18 10 f 177.7549 4.016045 385.1872       17.39627 406.7202       22.13405 350.3925       28.13614 182.5630 4.979869 169.3171 6.833145 13.24586       8.455234 
1 1 1 -5  18 11 o 499.1190 7.383882 3041.234       89.81005 3028.118       127.1481 3054.293       126.8735 497.5555 10.48654 499.7138 10.41870 -2.158295      14.78231 
1 1 1 -5  18 12 o 372.6251 5.093030 1693.544       46.24709 1677.088       73.11842 1704.518       59.70728 370.5195 8.098033 373.7043 6.556364 -3.184753      10.41941 
1 1 1 -5  18 13 o 137.8586 2.788133 231.6467       9.366632 235.1758       15.62285 229.6662       11.70332 138.7854 4.625809 137.2095 3.503032 1.575882       5.802529 
1 1 1 -5  18 14 o 216.7044 4.379508 572.7531       23.12752 577.6212       29.06453 564.3498       38.18619 217.4937 5.488172 214.7980 7.305880 2.695679       9.137609 
1 1 1 -5  18 15 f 429.8293 9.132179 2262.081       95.65475 2279.732       137.5750 2245.562       133.0891 430.1951 13.13854 427.0732 12.80249 3.121918       18.34462 
1 1 1 -5  18 16 o 232.3853 4.598066 658.9247       26.03873 666.6069       46.76929 655.4739       31.34624 233.2291 8.241859 231.7012 5.551637 1.527847       9.937249 
1 1 1 -5  18 17 o 337.7760 6.082858 1394.125       50.06942 1294.743       84.31662 1448.259       62.22947 324.3825 10.68101 344.0320 7.422686 -19.64951      13.00693 
1 1 1 -5  18 18 o 206.7204 3.699092 521.3123       18.63437 521.3506       26.84131 521.2766       25.89036 206.5247 5.337769 206.5970 5.142544 -0.7229614E-01 7.411985 
1 1 1 -5  18 19 o 193.6817 4.130961 457.8504       19.49736 458.8578       35.77392 457.4247       23.25472 193.3544 7.607195 193.4586 4.936759 -0.1041718     9.068683 
1 1 1 -5  18 20 o 265.1034 4.357799 858.1251       28.15260 823.9905       39.38074 893.8037       40.26146 259.4930 6.227619 270.2836 6.112709 -10.79056      8.726307 
1 1 1 -5  18 21 o 131.6452 3.402859 211.5992       10.90739 201.1827       18.87558 216.8211       13.36464 128.0700 6.065304 133.1970 4.122398 -5.127060      7.333626 
1 1 1 -5  18 22 o 166.1932 3.314113 337.0266       13.42198 335.1401       19.52047 338.7183       18.48494 165.5206 4.844732 166.4397 4.561783 -0.9191284     6.654418 
1 1 1 -5  18 23 o 138.1605 3.084778 232.9061       10.38589 236.6286       15.31645 229.7375       14.13083 139.0755 4.525326 137.0679 4.235624 2.007629       6.198313 
1 1 1 -5  18 24 o 114.2477 2.957338 159.3705       8.226576 156.8120       12.09767 161.5713       11.22010 113.1832 4.394505 114.9341 4.012159 -1.750961      5.950553 
1 1 1 -5  18 25 o 64.18888 3.081617 50.40335       4.806225 47.31279       7.284344 52.78608       6.396025 61.99500 4.860508 65.60273 4.020154 -3.607735      6.307629 
1 1 1 -5  18 26 o 90.51471 3.265390 100.1660       7.190814 98.90710       9.594570 101.7793       10.86157 89.81918 4.396854 91.04816 4.913574 -1.228981      6.593598 
1 1 1 -5  18 27 o 127.6337 3.719285 199.2547       11.55573 195.0844       13.83227 208.8898       21.02516 126.1762 4.505862 130.1443 6.651519 -3.968155      8.034021 
1 1 1 -5  18 28 o 54.47602 4.410676 36.56208       5.805231 31.26180       6.636992 53.82208       11.97684 50.17415 5.519233 65.58189 7.636864 -15.40773      9.422505 
1 1 1 -5  18 29 o 90.78865 3.043308 100.7907       6.723559 105.1746       9.918159 97.06286       9.145828 92.56570 4.409562 88.94260 4.231795 3.623108       6.111654 
1 1 1 -5  18 30 o 99.12300 3.059370 120.1641       7.381120 116.9697       10.56289 123.2123       10.31836 97.59132 4.453296 100.2041 4.235157 -2.612801      6.145600 
1 1 1 -5  18 31 o 67.85441 4.124938 56.63005       6.788521 56.48592       7.817108 57.07219       13.69118 67.66093 4.771625 67.10409 8.567661 0.5568390      9.806795 
1 1 1 -5  18 32 o 91.68040 3.451149 103.0259       7.696623 110.2829       13.05161 99.15668       9.530035 94.38454 5.701075 89.77827 4.369112 4.606277       7.182715 
1 1 1 -5  18 33 o 73.17920 3.827019 65.86513       6.800995 58.01193       13.32835 68.62968       7.907978 67.49142 8.276926 74.59913 4.369190 -7.107712      9.359344 
1 1 1 -5  18 34 o 72.30170 3.288048 64.20444       5.778093 62.18578       8.399318 66.01798       7.961189 70.81065 4.897713 73.06934 4.492743 -2.258690      6.646227 
1 1 1 -5  18 35 o 11.42506 5.270086 -2.605088      3.414316 3.307507       4.985256 -7.828676      4.685791 19.39406 7.470840 11.23375 5.453766 8.160310       9.249704 
1 1 1 -5  18 36 o 19.09106 6.981318 3.866943       4.233675 6.913294       5.600235 -0.1961775     6.467644 23.80062 8.086480 18.27613 7.906979 5.524487       11.30980 
1 1 1 -5  18 37 o 53.97635 3.772885 36.22253       4.931396 29.38946       6.911172 43.31003       7.038670 47.81812 6.067336 58.63263 4.973105 -10.81450      7.845020 
1 1 1 -5  18 38 o 27.39486 5.847783 9.912179       3.785011 9.666721       5.134953 10.20421       5.600986 26.69095 7.555390 27.35444 7.938164 -0.6634903     10.95894 
1 1 1 -5  18 39 o 13.29801 5.767787 -0.1323613     3.459064 0.7281557      4.664741 -1.183563      5.155739 16.01639 6.817704 15.29265 6.819594 0.7237434      9.643026 
1 1 1 -5  18 40 o 28.84934 6.981385 11.67091       4.854550 12.75957       5.576209 8.262557       9.866525 29.85947 7.634594 25.70107 10.32058 4.158392       12.83750 
1 1 1 -5  18 41 o 46.80247 4.247445 28.31677       4.791618 26.18940       6.534280 30.79146       7.047532 43.52775 6.346918 47.30840 6.267131 -3.780643      8.919659 
1 1 1 -5  18 42 o 15.23525 6.254268 1.955005       3.717669 2.013410       5.195885 1.893741       5.321523 16.88991 7.192659 16.91895 7.244028 -0.2904129E-01 10.20834 
1 1 1 -5  18 43 o 20.29241 6.797564 6.228176       3.957283 6.620006       5.652453 5.851500       5.542068 20.78753 7.968551 20.01631 7.830457 0.7712269      11.17201 
1 1 1 -5  18 44 o 9.637038 4.689365 -4.884929      3.518327 -8.695610      5.105525 -1.438711      4.855238 10.72961 5.305452 13.48780 6.243778 -2.758187      8.193448 
1 1 1 -5  18 45 f 13.99071 6.381188 0.2554972E-01  4.817986 6.990864       7.879635 -4.133499      6.088815 19.84069 8.654147 13.27170 6.387317 6.568998       10.75603 
1 1 1 -5  18 46 o 13.36626 5.857440 1.301590       3.646829 -5.793767      5.229403 8.019160       5.088281 11.38744 5.578813 20.27439 7.608803 -8.886955      9.434884 
1 1 1 -5  18 47 o 18.76373 7.388572 7.160807       4.961866 1.063083       6.106130 19.01475       8.513607 14.65647 6.857274 25.23903 9.752211 -10.58256      11.92174 
1 1 1 -5  18 48 o 10.99862 5.221498 -1.645521      3.781687 -3.841132      5.734975 0.4365740E-01  5.030273 12.06293 5.895426 13.11549 6.164139 -1.052559      8.529517 
1 1 1 -5  19 1  o 490.7718 7.270160 2938.998       86.94801 2894.112       171.6312 2954.494       100.8464 485.7399 14.51590 491.9424 8.412211 -6.202484      16.77726 
1 1 1 -5  19 2  o 386.0025 5.245946 1816.838       49.34578 1766.040       76.41805 1853.167       64.62576 380.3559 8.244602 389.7417 6.804444 -9.385864      10.68990 
1 1 1 -5  19 3  o 200.1918 3.247403 488.4571       15.84232 500.7189       25.17353 480.4163       20.38534 202.5811 5.103345 198.5173 4.213892 4.063812       6.618234 
1 1 1 -5  19 4  o 288.1847 4.137661 1012.417       29.05774 942.6308       43.99306 1066.424       38.70137 277.9761 6.494423 295.7221 5.370397 -17.74600      8.427259 
1 1 1 -5  19 5  o 262.2835 3.859687 838.5667       24.66943 819.9675       38.31075 851.7417       32.24405 259.2754 6.063498 264.2965 5.006361 -5.021057      7.863183 
1 1 1 -5  19 6  f 286.4978 4.116082 1000.629       28.73700 913.9639       42.92551 1071.017       38.68499 273.7078 6.435645 296.3501 5.356749 -22.64227      8.373308 
1 1 1 -5  19 7  o 362.0860 4.970349 1598.734       43.85657 1585.149       68.99284 1607.946       56.81182 360.3289 7.857219 363.0307 6.421837 -2.701813      10.14770 
1 1 1 -5  19 8  o 511.1358 6.756768 3188.347       84.16109 3154.173       132.3918 3211.523       109.0256 507.7847 10.69905 512.7196 8.725947 -4.934937      13.80623 
1 1 1 -5  19 9  o 178.0505 3.105685 386.4114       13.47525 380.1571       21.72331 390.3233       17.18005 176.4787 5.056448 178.9297 3.940087 -2.451050      6.410301 
1 1 1 -5  19 10 o 233.5794 4.028978 665.2211       22.93325 662.8749       32.92680 667.4316       31.95985 233.0837 5.796975 233.8939 5.607248 -0.8101654     8.065120 
1 1 1 -5  19 11 o 409.2220 6.188051 2044.011       61.70907 2053.603       87.90524 2034.692       86.64794 409.8150 8.802193 407.9377 8.716223 1.877258       12.38754 
1 1 1 -5  19 12 o 314.7986 4.977577 1208.975       38.18447 1230.917       55.02025 1188.586       53.03638 317.4349 7.112656 311.9440 6.976878 5.490875       9.963267 
1 1 1 -5  19 13 o 146.7560 4.466302 262.9595       15.95417 246.4844       23.36934 277.3410       21.83404 141.8849 6.778474 150.6015 5.961112 -8.716629      9.026769 
1 1 1 -5  19 14 o 155.4594 3.746965 294.7330       14.19491 292.4372       25.73513 295.7368       17.01776 154.5407 6.850592 155.6290 4.491901 -1.088318      8.191935 
1 1 1 -5  19 15 o 263.2193 4.337010 845.3401       27.81918 887.6981       58.74108 833.0928       31.58595 268.9882 8.973897 261.2509 4.961351 7.737274       10.25406 
1 1 1 -5  19 16 o 321.1189 4.513138 1258.530       35.31673 1246.744       56.04633 1266.291       45.48278 319.1993 7.205251 321.9328 5.797565 -2.733521      9.248103 
1 1 1 -5  19 17 o 143.1881 2.779079 249.9940       9.697149 265.8568       16.40993 241.4824       12.02044 147.5012 4.570878 140.6998 3.505830 6.801346       5.760535 
1 1 1 -5  19 18 o 76.99630 3.441250 72.46640       6.440557 89.86468       13.74479 67.57152       7.290480 85.43063 6.654653 74.29794 4.041865 11.13269       7.785954 
1 1 1 -5  19 19 o 305.1589 4.866013 1137.668       36.18557 1092.421       50.45019 1185.609       51.93013 298.6198 6.932789 311.1159 6.849534 -12.49609      9.745752 
1 1 1 -5  19 20 o 318.3849 5.768616 1240.141       44.75692 1284.450       79.42860 1219.526       54.17690 322.5186 10.11867 315.4132 7.048522 7.105408       12.33164 
1 1 1 -5  19 21 o 322.2122 5.085735 1269.345       39.93299 1341.276       58.93110 1208.274       54.30024 330.6117 7.314595 313.8561 7.099620 16.75558       10.19352 
1 1 1 -5  19 22 o 144.1068 3.147394 253.3999       11.05278 262.1335       16.51926 246.3212       14.87216 146.3719 4.637084 141.9252 4.305075 4.446747       6.327418 
1 1 1 -5  19 23 o 84.63159 2.944633 87.49889       6.063700 89.77339       9.366638 85.85796       7.955793 85.57836 4.507312 83.74963 3.908988 1.828735       5.966242 
1 1 1 -5  19 24 f 180.9390 3.466271 399.7576       15.28378 391.4097       21.98895 407.5603       21.25861 178.7554 5.052952 182.4585 4.785308 -3.703049      6.959274 
1 1 1 -5  19 25 o 110.8276 3.344262 150.1205       9.021680 146.2494       11.90312 155.3461       13.82970 109.2538 4.480339 112.5220 5.056500 -3.268242      6.755858 
1 1 1 -5  19 26 o 130.0833 3.111540 206.6078       9.863545 191.2095       13.99045 221.8256       13.90823 124.9051 4.604254 134.6031 4.245454 -9.698013      6.262830 
1 1 1 -5  19 27 o 150.4808 3.878140 277.0673       14.20949 284.5092       17.34913 261.9023       24.76608 152.3456 4.678718 145.6128 6.999961 6.732834       8.419611 
1 1 1 -5  19 28 o 76.88428 3.066345 72.31326       5.733539 74.84609       8.716097 70.38126       7.612406 78.02912 4.604303 75.72311 4.141079 2.306015       6.192588 
1 1 1 -5  19 29 o 108.1168 3.050983 142.9221       8.030350 145.4995       11.90158 140.7680       10.88028 108.8687 4.495738 107.1361 4.175421 1.732559       6.135617 
1 1 1 -5  19 30 o 122.8704 3.117235 184.6546       9.326146 181.0562       13.54776 187.8957       12.85762 121.3965 4.587830 123.7389 4.270408 -2.342438      6.267740 
1 1 1 -5  19 31 o 43.71332 4.271153 23.65711       4.491846 20.05445       7.760398 25.47221       5.508374 39.36317 8.349266 45.23185 5.085385 -5.868687      9.776062 
1 1 1 -5  19 32 o 101.4380 3.092371 126.0109       7.635205 128.1148       11.25454 124.2170       10.39252 101.9862 4.539837 100.4862 4.253651 1.500015       6.221228 
1 1 1 -5  19 33 o 94.73870 3.696363 110.2968       8.517340 114.1900       17.04946 109.0021       9.832138 95.20393 7.407097 94.03886 4.301861 1.165070       8.565693 
1 1 1 -5  19 34 o 48.20005 3.856425 28.75109       4.491932 33.45018       6.837942 25.18392       5.957734 51.62292 5.521229 44.69641 5.591828 6.926502       7.858277 
1 1 1 -5  19 35 o 54.67078 3.622664 36.95387       4.799136 31.89981       7.015660 41.39883       6.579338 50.17938 5.846694 57.59621 4.729235 -7.416836      7.519939 
1 1 1 -5  19 36 o 105.9560 3.163263 138.2916       8.158505 134.7347       11.65256 141.7119       11.42651 103.9510 4.611461 106.7202 4.403160 -2.769165      6.376001 
1 1 1 -5  19 37 o 46.41342 3.961610 26.95597       4.437962 28.64400       6.405780 25.39792       6.154225 47.22533 5.680121 44.37261 5.832524 2.852715       8.141382 
1 1 1 -5  19 38 o 27.58088 5.690943 10.07035       3.698030 7.639347       4.978435 13.06286       5.523547 23.89775 7.600462 30.82246 7.439408 -6.924717      10.63540 
1 1 1 -5  19 39 o 29.65255 5.635561 11.73028       3.923434 6.326460       5.381563 17.86113       5.732166 22.16308 7.901909 36.16471 6.752527 -14.00163      10.39407 
1 1 1 -5  19 40 o 37.54026 5.759346 19.00151       5.100804 20.11034       6.004056 16.12531       9.669908 38.00652 6.728834 31.28647 10.62600 6.720041       12.57732 
1 1 1 -5  19 41 o 9.921682 4.846114 -6.289543      3.858649 -20.58790      6.472782 1.593041       4.805983 10.15560 5.147797 16.31151 6.930887 -6.155905      8.633482 
1 1 1 -5  19 42 o 33.58952 5.376797 15.69717       4.252737 13.43980       5.900153 18.13805       6.135292 28.76369 8.083786 34.18052 7.565962 -5.416838      11.07210 
1 1 1 -5  19 43 o 13.82536 5.979514 0.9155326      3.696438 0.5515032      5.487476 1.217925       5.001379 15.56808 6.982155 15.54474 6.834314 0.2334023E-01  9.770279 
1 1 1 -5  19 44 o 13.52803 5.907419 0.8765981      3.680624 -1.881649      5.206188 3.632728       5.204189 13.52402 6.328860 17.17419 7.250938 -3.650163      9.624477 
1 1 1 -5  19 45 o 9.009137 4.479631 -7.405881      3.837185 -3.248644      7.929497 -8.677063      4.384772 14.91526 7.205852 9.453683 4.714816 5.461579       8.611259 
1 1 1 -5  19 46 o 19.06101 7.168800 6.907058       4.522028 6.533534       5.788016 7.492245       7.244658 18.29380 7.680749 18.75588 8.236452 -0.4620800     11.26202 
1 1 1 -5  19 47 o 11.17168 5.227299 -1.017942      3.549532 -0.4842842     5.539800 -1.389615      4.623209 13.39729 6.348409 12.18028 5.779818 1.217010       8.585371 
1 1 1 -5  20 1  o 336.8548 5.236485 1383.944       42.98518 1426.559       61.78344 1343.964       59.84341 341.8328 7.416897 331.7910 7.401430 10.04181       10.47815 
1 1 1 -5  20 2  o 98.00517 3.022076 117.1813       7.208936 103.3064       9.566008 135.4177       10.96693 91.94943 4.280941 105.3013 4.282744 -13.35191      6.055440 
1 1 1 -5  20 3  o 203.7386 3.664710 506.0160       18.19488 493.1190       25.20954 520.0391       26.28717 201.0121 5.150680 206.4244 5.229938 -5.412277      7.340419 
1 1 1 -5  20 4  o 231.8574 3.963514 655.3915       22.39430 629.8759       30.78478 684.0698       32.63697 227.2354 5.559349 236.8046 5.655666 -9.569138      7.930506 
1 1 1 -5  20 5  o 215.1810 4.398436 564.5936       23.06419 670.0624       43.84401 524.2403       27.11990 234.1151 7.695470 207.2413 5.374551 26.87381       9.386482 
1 1 1 -5  20 6  o 475.9692 8.152914 2767.710       94.56442 2990.108       171.7933 2671.030       113.2691 493.1576 14.31014 467.2786 9.947171 25.87906       17.42774 
1 1 1 -5  20 7  f 180.0493 3.948203 395.2545       17.32316 395.7650       21.10985 394.2016       30.31308 180.0724 4.814950 179.5519 6.941011 0.5204773      8.447567 
1 1 1 -5  20 8  o 86.80753 4.361810 92.12727       9.197431 0.000000       0.000000 92.12727       9.197431 ?        ?        86.80753 4.361810 0.000000       4.361810 
1 1 1 -5  20 9  o 398.3998 6.991304 1938.576       67.87556 1825.489       113.8372 2000.958       84.54874 385.4934 12.13311 404.5153 8.577013 -19.02188      14.85859 
1 1 1 -5  20 10 f 424.6530 7.390770 2203.595       76.48214 2350.688       138.9915 2139.713       91.59647 437.0677 13.06445 418.1631 8.988702 18.90460       15.85801 
1 1 1 -5  20 11 f 62.12024 3.453290 47.19651       5.207026 55.69122       11.56851 45.03830       5.831091 67.12664 7.183632 60.64079 3.967719 6.485851       8.206544 
1 1 1 -5  20 12 f 505.5731 8.643589 3129.269       106.4913 3138.002       185.7007 3124.990       129.9886 503.5877 15.14944 504.6335 10.57044 -1.045776      18.47267 
1 1 1 -5  20 13 o 323.3321 4.553487 1275.685       35.87806 1283.069       57.60896 1271.005       45.85688 323.8928 7.298820 322.5864 5.833408 1.306366       9.343523 
1 1 1 -5  20 14 o 186.2624 3.152883 423.0570       14.31097 390.8873       22.33100 445.4768       18.64233 178.8516 5.128943 191.0881 4.003414 -12.23647      6.506411 
1 1 1 -5  20 15 o 170.4959 3.011073 354.4716       12.51040 349.7720       20.24586 357.3745       15.91173 169.1783 4.916051 171.1511 3.815060 -1.972855      6.222720 
1 1 1 -5  20 16 o 278.3946 4.050818 945.8499       27.48145 950.2492       44.10998 943.0590       35.13331 278.6918 6.494962 277.8413 5.189029 0.8504333      8.313275 
1 1 1 -5  20 17 o 147.4558 2.847832 265.1582       10.23322 259.2818       16.85331 268.5900       12.87920 145.6231 4.755558 148.3707 3.562087 -2.747589      5.941700 
1 1 1 -5  20 18 f 306.4078 4.853154 1147.053       36.23765 1191.688       53.32913 1108.766       49.39252 311.8521 7.017455 300.8733 6.736612 10.97885       9.727621 
1 1 1 -5  20 19 o 121.1938 3.422143 179.3672       10.09671 181.2627       18.34367 178.5433       12.09348 121.5218 6.214996 120.8547 4.112300 0.6670380      7.452328 
1 1 1 -5  20 20 o 89.69040 3.013060 98.24618       6.576169 100.9800       10.35112 96.39601       8.515513 90.78161 4.694955 88.76598 3.946530 2.015633       6.133327 
1 1 1 -5  20 21 f 280.1750 4.583675 959.4410       31.29531 967.7515       45.06231 951.6984       43.49577 280.9219 6.582514 278.6293 6.405958 2.292572       9.185085 
1 1 1 -5  20 22 o 171.9734 3.415442 361.0347       14.31344 347.4841       20.56983 373.7553       19.92987 168.4576 5.016353 174.7696 4.683756 -6.311951      6.863044 
1 1 1 -5  20 23 o 69.18877 3.143396 58.55038       5.286094 53.55243       8.142837 62.19079       6.949512 65.94855 5.106565 71.22841 4.020049 -5.279854      6.499061 
1 1 1 -5  20 24 o 57.70291 3.593719 40.82752       5.028249 37.08908       7.277157 44.24303       6.955762 54.73662 5.531488 59.93545 4.802547 -5.198833      7.325422 
1 1 1 -5  20 25 o 152.7424 3.272027 284.9100       12.17903 306.4513       18.35849 267.9779       16.27637 158.1399 4.769315 147.9143 4.520863 10.22562       6.571496 
1 1 1 -5  20 26 o 195.9529 4.345210 469.8986       20.74907 465.1554       25.17509 479.9452       36.63887 194.6812 5.311497 196.9975 7.646643 -2.316269      9.310379 
1 1 1 -5  20 27 o 89.35645 3.036900 97.62640       6.603299 106.7985       10.27065 91.16360       8.621330 93.27200 4.532236 86.21694 4.115297 7.055054       6.121832 
1 1 1 -5  20 28 o 103.1744 3.039414 130.1524       7.633509 135.1171       11.50271 126.2451       10.20436 104.9104 4.509837 101.4626 4.135754 3.447815       6.119076 
1 1 1 -5  20 29 o 76.42837 3.150571 71.51770       5.855281 75.96037       9.027740 68.29179       7.692779 78.53718 4.739069 74.53215 4.253144 4.005028       6.367732 
1 1 1 -5  20 30 o 53.97986 3.620407 35.82708       4.734855 41.04049       7.445025 32.28632       6.135543 57.49860 5.375719 51.01173 4.999826 6.486874       7.341431 
1 1 1 -5  20 31 o 76.13273 3.528526 71.13862       6.528568 70.94217       11.59714 71.22975       7.899117 75.41647 6.369783 76.05240 4.279421 -0.6359253     7.673825 
1 1 1 -5  20 32 o 43.22084 4.852853 23.30224       5.023052 13.82952       10.86624 25.87652       5.664607 33.41486 11.26461 45.49871 5.202397 -12.08385      12.40792 
1 1 1 -5  20 33 o 140.1848 3.268548 240.9691       11.16585 236.9667       16.22120 244.5732       15.39312 138.4244 4.816109 140.7652 4.493161 -2.340805      6.586608 
1 1 1 -5  20 34 o 51.48268 3.755695 32.79774       4.679397 30.05658       6.875633 35.16293       6.386714 48.71492 5.912723 53.01120 5.003124 -4.296288      7.745421 
1 1 1 -5  20 35 o 18.51514 6.759465 3.652903       3.966419 2.550608       5.428599 4.915301       5.809476 19.05267 7.653796 21.74777 8.136689 -2.695101      11.17078 
1 1 1 -5  20 36 o 35.90587 4.759310 16.38037       4.061879 11.08971       5.933796 21.04552       5.571987 28.64216 8.126639 40.40154 5.827751 -11.75938      10.00025 
1 1 1 -5  20 37 o 55.55113 3.579564 38.47089       4.819936 32.73676       6.873262 44.01918       6.760963 50.34903 5.702167 58.94773 4.746680 -8.598694      7.419277 
1 1 1 -5  20 38 o 12.59579 5.543845 -0.5511587     3.299258 -0.3749861     4.480781 -0.7597745     4.875936 14.80838 6.490979 15.13351 6.696697 -0.3251228     9.326229 
1 1 1 -5  20 39 o 34.97960 4.839343 15.99309       4.014747 13.00468       5.569503 19.22558       5.792478 30.09261 7.595496 37.41066 6.594677 -7.318050      10.05889 
1 1 1 -5  20 40 o 39.04399 6.894060 21.64058       6.319655 22.42603       7.992025 20.32993       10.32378 38.10709 8.786015 33.97233 10.95933 4.134762       14.04639 
1 1 1 -5  20 41 o 21.41220 6.725112 6.732504       3.908840 1.668565       5.362618 12.47285       5.709547 16.75661 7.224504 28.10683 7.970541 -11.35022      10.75746 
1 1 1 -5  20 42 o 16.46740 6.436675 3.311675       3.742125 -1.126578      5.308703 7.695045       5.275777 14.48375 6.640775 21.91879 7.822868 -7.435041      10.26144 
1 1 1 -5  20 43 o 18.06945 6.642605 4.836603       3.840740 0.5418295      5.338206 9.445745       5.530129 15.22886 6.853589 23.22660 8.031204 -7.997742      10.55803 
1 1 1 -5  20 44 o 14.11919 6.407025 0.2680566      4.780158 -1.513818      8.309565 1.149368       5.843922 16.05704 7.655989 15.58603 7.077189 0.4710026      10.42597 
1 1 1 -5  20 45 o 25.32393 7.607691 12.15781       5.071445 11.72883       6.248433 12.98591       8.681521 23.18560 8.480906 22.22073 9.372511 0.9648743      12.64001 
1 1 1 -5  20 46 o 12.43741 5.671535 0.2274235      3.803402 3.985579       5.770419 -2.659437      5.057465 16.21883 7.224791 12.18112 5.851835 4.037709       9.297397 
1 1 1 -5  20 47 o 12.87374 5.793318 1.116118       3.813597 -2.398649      6.073647 3.403681       4.899906 12.90691 6.252624 15.17604 6.714442 -2.269129      9.174913 
1 1 1 -5  21 1  o 147.9741 2.869255 266.8994       10.34644 270.1776       16.01261 264.5499       13.55637 148.7745 4.421602 147.2517 3.780997 1.522842       5.817775 
1 1 1 -5  21 2  o 32.29148 4.617457 12.97549       3.530196 10.44265       4.897002 15.71589       5.093708 28.67558 7.056551 35.37834 6.130277 -6.702761      9.347471 
1 1 1 -5  21 3  o 248.8153 4.186818 754.9628       25.38618 773.8884       36.01657 736.2772       35.78748 251.8126 5.869332 245.6097 5.979289 6.202957       8.378601 
1 1 1 -5  21 4  o 79.33318 3.111996 76.84016       6.004637 68.90051       10.79439 80.39793       7.225804 74.89742 5.963398 81.12132 3.664696 -6.223907      6.999436 
1 1 1 -5  21 5  o 51.87419 3.568038 32.96342       4.482947 19.15243       7.569476 40.42459       5.563614 38.84966 8.250556 57.43774 3.999868 -18.58808      9.169003 
1 1 1 -5  21 6  o 232.5667 3.988020 659.5731       22.60169 671.1708       32.02896 648.0694       31.89867 234.5073 5.604674 230.4310 5.680618 4.076309       7.980087 
1 1 1 -5  21 7  o 195.3755 3.238863 465.3689       15.42051 486.0704       24.51716 451.8190       19.83521 199.5281 5.046367 192.4710 4.228978 7.057037       6.584077 
1 1 1 -5  21 8  o 292.1704 4.722742 1041.464       33.62532 1082.904       69.90489 1028.989       38.35389 297.1558 9.666419 290.3553 5.420552 6.800415       11.08251 
1 1 1 -5  21 9  o 481.8618 7.172728 2838.213       84.22538 2961.866       174.2114 2800.494       96.21768 489.5699 14.61882 478.4009 8.253284 11.16891       16.78769 
1 1 1 -5  21 10 o 88.73617 2.840455 96.09209       6.134298 97.57606       10.57776 95.34011       7.529789 89.28448 4.880182 88.35166 3.504244 0.9328232      6.007987 
1 1 1 -5  21 11 o 301.2860 4.823435 1107.913       35.41371 1092.206       50.27960 1123.377       49.88780 298.8754 6.903440 303.1329 6.753442 -4.257538      9.657456 
1 1 1 -5  21 12 o 371.1761 5.104866 1682.189       46.17431 1734.758       74.94582 1650.027       58.62170 376.3168 8.172552 367.3629 6.548277 8.953979       10.47237 
1 1 1 -5  21 13 o 70.74445 2.887367 61.12650       4.967259 66.22794       8.759470 58.70844       6.030661 73.48402 4.919923 69.28265 3.584125 4.201370       6.087002 
1 1 1 -5  21 14 o 237.7072 3.640860 689.3512       21.09028 617.8446       31.95133 744.5618       28.07547 224.7426 5.838961 246.9426 4.665464 -22.20006      7.473956 
1 1 1 -5  21 15 o 73.75402 3.085390 66.46024       5.533139 60.03677       12.83119 67.92759       6.132640 69.56568 7.697579 74.54480 3.384766 -4.979118      8.408886 
1 1 1 -5  21 16 o 116.4329 2.715542 165.3158       7.704926 166.1853       12.93211 164.8372       9.593571 116.5631 4.561541 116.1883 3.391931 0.3748245      5.684439 
1 1 1 -5  21 17 o 65.27496 2.842706 52.06380       4.510993 39.80832       7.655285 58.58300       5.583328 56.78031 5.605630 69.21531 3.319885 -12.43500      6.514962 
1 1 1 -5  21 18 o 326.8856 5.117652 1306.310       40.76643 1238.147       79.45517 1330.664       47.49429 316.4720 10.31648 329.7355 5.910708 -13.26352      11.88975 
1 1 1 -5  21 19 o 266.6996 4.388128 868.9722       28.51922 887.7791       41.89698 852.7341       38.93071 269.1704 6.387330 263.8795 6.054115 5.290985       8.800585 
1 1 1 -5  21 20 o 380.9783 5.863538 1777.717       54.43724 1762.714       77.14946 1792.593       76.82336 378.3528 8.367579 381.5964 8.261385 -3.243652      11.75869 
1 1 1 -5  21 21 o 60.68727 3.320989 45.08945       4.892634 44.20560       7.916589 45.63568       6.223458 59.83826 5.490173 60.96689 4.214859 -1.128624      6.921491 
1 1 1 -5  21 22 o 242.1353 4.148970 716.5709       24.48130 732.2681       35.67682 702.6024       33.65512 244.3658 5.991142 239.4206 5.768376 4.945251       8.316727 
1 1 1 -5  21 23 o 154.2106 3.728865 290.5392       14.01287 291.2690       18.25977 289.4936       21.85591 154.1829 4.865945 153.5218 5.852735 0.6610565      7.611302 
1 1 1 -5  21 24 o 205.1779 3.763414 514.4763       18.81693 537.4139       27.92166 495.3908       25.46938 209.2822 5.479572 200.9967 5.204259 8.285507       7.557117 
1 1 1 -5  21 25 o 30.11532 6.962131 11.61472       5.007164 18.85981       6.280481 -1.023538      8.294968 38.56041 6.938787 20.61580 8.936803 17.94461       11.31429 
1 1 1 -5  21 26 o 116.3181 3.068331 165.3575       8.689730 169.3039       13.13213 162.2835       11.59009 117.4784 4.595998 115.0873 4.139341 2.391151       6.185252 
1 1 1 -5  21 27 f 57.26337 3.458810 40.23121       4.804080 48.49932       8.077542 35.70590       5.975862 62.62077 5.344306 53.78250 4.603803 8.838276       7.053837 
1 1 1 -5  21 28 o 146.7651 3.272624 263.3299       11.70455 265.2810       17.30835 261.6858       15.88816 146.9397 4.840315 146.0288 4.470032 0.9108276      6.588614 
1 1 1 -5  21 29 o 112.8898 3.102787 155.9181       8.527674 156.2431       12.71704 155.6525       11.49521 112.7233 4.639437 112.6028 4.196550 0.1205597      6.255830 
1 1 1 -5  21 30 o 19.42416 6.633720 4.319183       3.769527 8.723393       7.593044 2.878719       4.342432 27.35599 9.412767 18.26567 6.988740 9.090315       11.72359 
1 1 1 -5  21 31 o 73.09560 3.261132 65.55669       5.794299 56.26680       8.748193 72.81740       7.733969 67.29036 5.379710 76.88580 4.143118 -9.595436      6.790192 
1 1 1 -5  21 32 o 103.5960 3.651221 131.9148       9.203176 142.6435       18.73363 128.5018       10.56610 106.3884 7.269571 102.0856 4.256649 4.302818       8.424115 
1 1 1 -5  21 33 o 65.91213 3.401995 53.49984       5.445818 47.96619       8.211391 57.84485       7.276229 61.86399 5.504227 68.30750 4.394527 -6.443508      7.043322 
1 1 1 -5  21 34 o 107.6846 3.548482 143.0052       9.299056 136.6026       12.08402 152.3024       14.56147 104.7489 4.746307 110.2542 5.436449 -5.505371      7.216814 
1 1 1 -5  21 35 o 65.82128 3.472805 53.62478       5.550644 52.58445       8.344602 54.45038       7.433717 64.49121 5.358037 65.92167 4.657432 -1.430458      7.099312 
1 1 1 -5  21 36 o 60.77685 3.485167 45.90671       5.140119 37.49323       7.483042 53.42287       7.072749 53.97247 5.779316 65.17412 4.480510 -11.20165      7.312692 
1 1 1 -5  21 37 o 42.38788 4.263103 22.79204       4.343819 32.67417       6.683078 15.56332       5.715870 50.18920 5.557243 33.72436 7.175727 16.46484       9.076013 
1 1 1 -5  21 38 o 25.70518 6.073942 9.011425       3.743995 4.567463       5.301938 13.43156       5.287708 20.15178 7.719367 30.97954 7.149305 -10.82776      10.52146 
1 1 1 -5  21 39 o 28.21164 6.857337 11.34610       4.667701 9.404115       5.564661 15.95613       8.573679 25.26945 8.035359 31.34319 9.974844 -6.073736      12.80877 
1 1 1 -5  21 40 f 11.82040 5.419434 -1.676566      3.535128 -3.212199      4.993674 -0.1338384     5.005197 13.26803 6.205577 15.16894 6.744633 -1.900916      9.165112 
1 1 1 -5  21 41 o 44.08188 4.380976 25.87868       4.643947 23.95873       6.644042 27.71268       6.493608 39.84629 7.102911 43.81458 6.259488 -3.968292      9.467445 
1 1 1 -5  21 42 o 11.20232 5.253864 -2.404012      3.621097 -1.121459      5.124448 -3.683123      5.117567 14.12896 6.495193 12.77124 6.066235 1.357717       8.887448 
1 1 1 -5  21 43 o 17.86583 6.942979 4.768416       4.333902 -0.2806382     5.460183 13.36563       7.124937 14.64554 6.722327 25.66243 9.098074 -11.01690      11.31215 
1 1 1 -5  21 44 o 17.29107 7.565799 4.135682       6.063655 14.66413       9.387312 -3.402415      7.943096 23.57934 9.832268 14.87080 7.191103 8.708534       12.18136 
1 1 1 -5  21 45 o 11.95794 5.479833 -0.2894030     3.608462 4.799765       5.694032 -3.705004      4.664768 17.02133 7.391305 11.41595 5.518094 5.605380       9.223923 
1 1 1 -5  21 46 o 15.28004 6.315307 3.682263       3.824629 6.662091       6.126143 1.778998       4.895998 17.76726 7.691103 14.23498 6.469258 3.532283       10.05009 
1 1 1 -5  22 1  o 308.6946 4.902024 1162.804       36.87572 1153.467       51.65151 1172.510       52.66350 307.2303 6.898950 309.7457 6.976994 -2.515442      9.811929 
1 1 1 -5  22 2  o 309.1411 4.926013 1166.185       37.10979 1192.152       52.78724 1140.811       52.18036 312.3354 6.935401 305.5264 7.008452 6.809021       9.859928 
1 1 1 -5  22 3  o 183.4995 3.518815 410.5910       15.73503 436.3523       31.54392 402.0574       18.15510 188.8416 6.866026 181.5576 4.103440 7.284058       7.998783 
1 1 1 -5  22 4  o 203.1875 3.312936 503.3859       16.40387 488.7987       25.19667 514.1168       21.61107 200.0559 5.172736 205.2921 4.319842 -5.236221      6.739305 
1 1 1 -5  22 5  o 396.9503 5.400820 1923.535       52.24347 1907.090       81.77707 1934.875       67.90780 394.6990 8.502164 397.8625 7.004072 -3.163483      11.01562 
1 1 1 -5  22 6  o 95.64151 3.015388 111.6338       7.019122 126.7604       9.897595 96.32890       9.955734 101.8645 3.994972 88.73154 4.620168 13.13294       6.107843 
1 1 1 -5  22 7  o 227.1540 3.527361 629.2576       19.52569 670.4304       31.74967 604.2137       24.76195 234.3148 5.560366 222.5217 4.566426 11.79311       7.195131 
1 1 1 -5  22 8  o 46.05507 4.030560 26.07276       4.478001 17.98463       9.300261 28.51378       5.109245 37.61818 9.981541 48.14039 4.403963 -10.52221      10.90991 
1 1 1 -5  22 9  o 324.9942 5.141291 1289.641       40.71777 1286.650       58.09300 1292.528       57.08740 324.2624 7.351758 325.0292 7.207453 -0.7668457     10.29542 
1 1 1 -5  22 10 o 454.6368 6.823040 2528.394       75.59249 2592.701       109.2198 2469.266       104.7294 459.4408 9.755193 448.4333 9.583729 11.00754       13.67522 
1 1 1 -5  22 11 o 171.8469 3.117819 360.1405       13.05656 354.7607       21.06110 363.4986       16.63995 170.3596 5.078827 172.6000 3.956173 -2.240356      6.437840 
1 1 1 -5  22 12 o 38.78392 4.038628 18.55463       3.761149 27.06457       6.922650 14.99054       4.480056 46.63128 6.249156 34.60307 5.496501 12.02821       8.322468 
1 1 1 -5  22 13 o 169.8211 3.053351 351.7288       12.63585 358.5144       20.79214 347.7551       15.91117 171.2418 4.987885 168.8099 3.867836 2.431870       6.311827 
1 1 1 -5  22 14 o 204.8553 3.735255 512.1138       18.64676 545.5329       40.21870 502.9631       21.04538 210.7408 7.845165 202.9706 4.254882 7.770264       8.924721 
1 1 1 -5  22 15 o 24.08410 5.653756 7.378755       3.261014 12.62743       6.402693 5.540314       3.789331 31.49631 8.246482 21.32552 6.609888 10.17079       10.56859 
1 1 1 -5  22 16 o 265.2290 3.934496 858.7762       25.42999 822.5942       39.89528 883.5377       33.00378 259.1908 6.316344 268.8612 5.037319 -9.670410      8.079034 
1 1 1 -5  22 17 o 274.3943 4.482975 919.8343       29.97626 976.3746       62.80997 903.1577       34.11177 281.3708 9.172637 271.7802 5.150511 9.590668       10.51974 
1 1 1 -5  22 18 o 96.31492 2.696960 113.2365       6.323776 114.2247       11.11936 112.7641       7.688174 96.55161 4.740389 96.07091 3.288789 0.4807053      5.769526 
1 1 1 -5  22 19 o 182.2079 3.134017 405.1368       13.91569 421.2390       23.30987 396.2204       17.34581 185.4811 5.162102 180.1108 3.952016 5.370270       6.501210 
1 1 1 -5  22 20 o 179.4449 3.436186 393.1183       15.02601 396.0592       22.43032 390.7241       20.23831 179.8267 5.123755 178.6915 4.651614 1.135132       6.920287 
1 1 1 -5  22 21 o 88.02272 2.686121 94.61622       5.755033 108.0580       10.54249 88.91029       6.868751 93.87878 4.622504 85.27404 3.311702 8.604744       5.686380 
1 1 1 -5  22 22 o 72.39807 3.562928 64.17725       6.266631 61.74309       9.011780 66.45640       8.720124 70.80167 5.260723 73.51956 4.895134 -2.717896      7.185927 
1 1 1 -5  22 23 o 87.09654 4.003890 92.93798       8.475314 96.21387       10.36380 86.32395       14.72609 88.51375 4.822989 83.38725 7.321128 5.126503       8.766992 
1 1 1 -5  22 24 o 75.62601 4.103409 70.15942       7.533941 65.24953       9.094959 80.89548       13.44892 72.77686 5.161773 80.75636 6.900035 -7.979492      8.617099 
1 1 1 -5  22 25 o 126.9327 3.138276 196.7996       9.707355 212.8603       15.03992 185.3312       12.70909 131.7282 4.692724 122.9807 4.247113 8.747551       6.329267 
1 1 1 -5  22 26 o 200.7473 3.744805 492.9292       18.31956 490.0687       26.67550 495.4825       25.20272 199.6489 5.488095 200.8560 5.153300 -1.207047      7.528326 
1 1 1 -5  22 27 o 183.8666 3.571893 413.5438       16.00433 408.7566       23.35633 417.7811       21.97394 182.3065 5.262851 184.4254 4.893675 -2.118805      7.186491 
1 1 1 -5  22 28 o 111.2826 3.114011 151.5110       8.436382 160.2392       13.04443 145.2353       11.06108 114.1506 4.699378 108.7718 4.180754 5.378876       6.289901 
1 1 1 -5  22 29 o 24.07718 6.542030 7.418054       3.937558 14.40326       8.494613 5.506433       4.443805 33.41229 9.798695 21.60155 7.202699 11.81074       12.16114 
1 1 1 -5  22 30 o 98.05734 3.147389 117.8113       7.511103 111.9711       11.36228 122.3444       10.01031 95.21138 4.913739 99.73023 4.127857 -4.518852      6.417479 
1 1 1 -5  22 31 o 40.44340 4.908595 20.47595       4.738805 27.24825       11.94258 19.21040       5.162629 44.98178 10.99021 38.99920 5.592032 5.982590       12.33108 
1 1 1 -5  22 32 f 85.24368 3.190843 89.26398       6.616625 93.64386       10.25978 86.14526       8.657565 86.85094 4.867077 83.47038 4.270444 3.380562       6.474963 
1 1 1 -5  22 33 o 72.70529 3.656225 65.28630       6.457122 70.00365       8.906528 60.05969       9.374969 74.89658 4.906918 69.09305 5.616396 5.803528       7.457999 
1 1 1 -5  22 34 o 16.18755 6.258990 2.276558       3.508580 4.285137       5.635773 1.005424       4.483373 20.88405 7.968831 16.28984 6.793970 4.594202       10.47188 
1 1 1 -5  22 35 o 72.59142 3.313204 65.25346       5.845517 64.08726       8.727878 66.20211       7.871854 71.18256 5.064598 72.64565 4.468254 -1.463097      6.753921 
1 1 1 -5  22 36 o 60.09073 3.541571 45.04442       5.163089 44.01080       7.704286 45.88707       6.956292 58.46880 5.470718 60.08141 4.790835 -1.612606      7.271923 
1 1 1 -5  22 37 o 57.84290 3.510737 41.94076       4.925323 38.13735       7.348618 45.04284       6.636595 53.95142 5.674263 59.35316 4.624927 -5.401749      7.320328 
1 1 1 -5  22 38 o 23.10753 6.499643 7.457116       3.812603 7.825388       5.606587 7.140320       5.200010 23.56701 8.089071 22.69115 7.790191 0.8758659      11.23032 
1 1 1 -5  22 39 f 15.16356 6.875514 -1.269842      5.491568 -0.5346112     6.970121 -2.473221      8.917226 17.29403 7.802884 18.21523 8.442466 -0.9211998     11.49610 
1 1 1 -5  22 40 o 40.49685 4.762542 22.04989       4.610239 17.46926       6.424110 26.91418       6.620026 33.22356 8.025527 43.17502 6.492876 -9.951458      10.32311 
1 1 1 -5  22 41 o 14.63562 6.173119 1.607400       3.766052 2.986093       5.311110 0.2131353      5.341021 17.29728 7.315071 15.30950 6.875496 1.987778       10.03906 
1 1 1 -5  22 42 o 14.85836 6.493059 1.311137       4.453581 1.583496       5.549094 0.8181609      7.465600 16.05540 7.122285 17.03379 7.833914 -0.9783955     10.58759 
1 1 1 -5  22 43 o 16.37364 6.887636 3.409292       4.668248 0.9307223      5.648549 8.750072       8.291606 15.26022 6.940467 20.83050 8.982166 -5.570283      11.35118 
1 1 1 -5  22 44 o 15.00698 6.449449 2.644380       4.247553 -4.807383      7.949071 5.622328       5.025109 14.14245 6.917919 17.89614 7.300142 -3.753688      10.05732 
1 1 1 -5  22 45 o 15.26577 6.343685 3.472965       3.888246 5.673751       5.941334 1.824261       5.142406 17.39545 7.551961 14.59841 6.632710 2.797032       10.05112 
1 1 1 -5  23 1  o 461.0571 6.919837 2599.920       77.74755 2960.162       168.9391 2503.122       87.57230 488.8113 14.19754 452.1201 7.948349 36.69122       16.27103 
1 1 1 -5  23 2  o 120.8585 3.131196 178.2329       9.214200 149.7657       16.70243 190.6867       11.04736 110.5242 6.226530 124.9822 3.631071 -14.45802      7.207937 
1 1 1 -5  23 3  o 492.9272 7.332284 2973.242       88.07613 2895.267       122.1808 3057.597       127.0806 485.4013 10.32918 498.7716 10.45542 -13.37033      14.69720 
1 1 1 -5  23 4  o 90.87412 2.753501 100.7745       6.090603 105.8087       9.277297 96.96121       8.074290 93.03418 4.102154 89.07863 3.727827 3.955551       5.542956 
1 1 1 -5  23 5  f 65.35888 3.271476 52.22560       5.193995 50.31910       6.801622 54.89266       8.044705 64.06336 4.383199 66.86844 4.972474 -2.805077      6.628569 
1 1 1 -5  23 6  o 99.93234 3.012131 121.8843       7.326896 101.6521       12.52693 132.4048       9.033156 91.03845 5.674775 104.1261 3.565207 -13.08768      6.701774 
1 1 1 -5  23 7  o 230.2870 3.567711 646.8950       20.02143 646.1403       31.34991 647.4149       26.01868 229.9640 5.594230 230.2903 4.636322 -0.3263245     7.265734 
1 1 1 -5  23 8  o 71.65883 3.185725 62.74903       5.549157 66.67979       7.587492 58.22870       8.136642 73.79448 4.237091 68.88277 4.878856 4.911713       6.461902 
1 1 1 -5  23 9  o 336.3955 5.287435 1382.538       43.34423 1236.266       81.47277 1440.281       51.18961 316.6569 10.57297 343.1916 6.120812 -26.53473      12.21687 
1 1 1 -5  23 10 o 303.4552 4.367619 1124.173       32.29799 1084.459       50.51308 1151.637       42.00679 297.6049 6.965106 306.9465 5.615917 -9.341644      8.947135 
1 1 1 -5  23 11 o 99.69998 2.800673 121.3106       6.797716 128.4635       11.73819 117.7013       8.338212 102.4520 4.714225 98.15984 3.491364 4.292114       5.866306 
1 1 1 -5  23 12 o 26.48453 6.272769 8.928505       3.985667 20.94530       9.962557 6.638711       4.348853 40.44819 10.13034 23.23098 7.059194 17.21721       12.34731 
1 1 1 -5  23 13 o 271.3247 4.488174 899.0878       29.67530 841.9791       58.39649 918.9695       34.45579 261.4379 9.180294 274.2055 5.156439 -12.76761      10.52932 
1 1 1 -5  23 14 o 166.8854 3.052464 339.7346       12.41381 335.5300       20.21805 342.2789       15.72744 165.6134 5.015435 167.4522 3.854171 -1.838852      6.325284 
1 1 1 -5  23 15 o 113.4803 2.744967 157.0626       7.590909 156.6065       12.80036 157.3100       9.427529 113.1169 4.653579 113.4883 3.412749 -0.3714600     5.770845 
1 1 1 -5  23 16 o 239.8837 4.092033 702.7878       23.92081 718.0639       49.35573 698.0978       27.34739 241.4291 8.401837 238.9934 4.695631 2.435699       9.624958 
1 1 1 -5  23 17 f 41.71498 3.679459 21.40981       3.702048 17.68996       7.113584 22.79149       4.335403 37.21665 8.076062 42.99094 4.191412 -5.774288      9.098940 
1 1 1 -5  23 18 o 311.1101 4.452030 1183.072       33.75269 1134.324       52.68509 1217.007       43.95836 303.8871 7.114418 315.2155 5.722659 -11.32840      9.130376 
1 1 1 -5  23 19 o 93.15311 2.722420 105.9565       6.173373 99.98091       10.55061 109.0674       7.612551 90.27707 4.813231 94.46412 3.312072 -4.187050      5.842689 
1 1 1 -5  23 20 o 191.4117 3.227317 447.2811       15.05380 463.9762       25.08473 437.8844       18.81933 194.5635 5.295611 189.2814 4.080001 5.282120       6.685051 
1 1 1 -5  23 21 o 148.7412 3.189281 270.1140       11.56007 301.5349       18.46664 249.8665       14.82392 156.8753 4.836333 142.8818 4.262221 13.99356       6.446445 
1 1 1 -5  23 22 o 87.36796 3.632447 93.42966       7.716835 98.78241       10.34807 86.72373       11.58246 89.69872 4.751040 83.88357 5.700004 5.815155       7.420406 
1 1 1 -5  23 23 o 53.86253 5.020130 35.85794       6.513402 39.88698       8.003365 27.95531       11.20877 56.69261 5.878294 46.48154 10.17821 10.21107       11.75374 
1 1 1 -5  23 24 o 113.0208 3.142472 156.1487       8.646575 158.6096       13.27434 154.3351       11.39573 113.6630 4.803280 112.2223 4.174307 1.440689       6.363674 
1 1 1 -5  23 25 o 201.9353 3.777171 498.8235       18.58724 489.4519       26.84541 507.4532       25.76079 199.5065 5.527078 203.2495 5.205366 -3.743011      7.592392 
1 1 1 -5  23 26 o 69.24894 3.305013 58.75932       5.561181 65.67278       9.404102 55.04155       6.896221 72.90617 5.330012 66.89132 4.252652 6.014847       6.818657 
1 1 1 -5  23 27 o 39.27593 4.477062 19.16419       4.208624 10.52202       7.519588 23.10620       5.078567 29.20276 9.346800 43.09608 4.924062 -13.89332      10.56452 
1 1 1 -5  23 28 o 52.15626 4.021633 33.54848       5.072011 29.06047       10.46662 34.92582       5.798295 47.25860 9.419208 53.13999 4.520441 -5.881390      10.44777 
1 1 1 -5  23 29 o 170.6942 3.527924 357.0248       14.67486 336.4501       20.95885 376.8120       20.55385 165.0725 5.216774 174.8666 4.827988 -9.794052      7.108038 
1 1 1 -5  23 30 o 71.82624 3.763930 63.50825       6.565117 72.89980       14.28987 60.99562       7.391346 75.73797 7.856438 70.26874 4.337578 5.469231       8.974308 
1 1 1 -5  23 31 o 91.76688 3.180385 103.4055       7.101414 105.4066       11.10639 102.0216       9.236109 92.14530 4.964437 90.89501 4.180975 1.250290       6.490469 
1 1 1 -5  23 32 o 106.1727 3.564630 138.9123       9.209739 147.1407       12.68337 129.7349       13.39481 108.7850 4.796209 101.8532 5.416139 6.931793       7.234513 
1 1 1 -5  23 33 o 58.50417 3.602128 42.39689       5.110591 50.13313       8.235983 37.55297       6.517026 63.01776 5.415576 54.64627 4.947422 8.371483       7.335219 
1 1 1 -5  23 34 o 65.20816 3.384320 52.67983       5.359458 59.16785       8.448589 48.31079       6.932992 68.41737 5.104139 61.99382 4.622464 6.423546       6.886175 
1 1 1 -5  23 35 o 81.67562 3.196145 82.68547       6.349154 82.17879       9.621791 83.07626       8.450016 80.49271 4.928906 81.32581 4.278816 -0.8330994     6.527050 
1 1 1 -5  23 36 o 74.49540 3.370959 69.24127       6.103687 63.93208       8.848255 74.06121       8.430708 70.45612 5.189932 76.32282 4.553575 -5.866707      6.904378 
1 1 1 -5  23 37 o 49.49909 3.933775 31.15327       4.706072 23.73551       6.892922 37.62992       6.440836 41.27651 7.109257 53.78550 4.970263 -12.50899      8.674390 
1 1 1 -5  23 38 o 42.96741 6.880812 26.09578       6.961654 26.50126       9.135254 25.53411       10.75157 40.97019 9.355971 38.31296 10.96168 2.657230       14.41155 
1 1 1 -5  23 39 o 28.39377 6.159881 11.54878       4.139370 11.92243       5.997376 11.20884       5.720351 27.29029 8.289307 26.60538 8.098514 0.6849079      11.58872 
1 1 1 -5  23 40 o 35.46304 5.070604 17.35160       4.257408 17.56245       6.166759 17.15958       5.884894 33.18472 7.764397 33.09508 7.474172 0.8963776E-01  10.77725 
1 1 1 -5  23 41 o 21.32040 6.666164 7.117544       3.844995 5.793872       5.487454 8.394222       5.389166 19.57062 7.750117 22.26702 7.910788 -2.696402      11.07452 
1 1 1 -5  23 42 o 12.86159 5.932486 -1.034699      4.325943 -0.7742396     5.487387 -1.462349      7.031359 14.31915 6.631836 15.34887 7.236662 -1.029712      9.815830 
1 1 1 -5  23 43 o 14.54823 6.433545 1.637051       4.493213 7.733033       8.309432 -0.8819286     5.341482 19.63810 8.713351 13.73838 6.423113 5.899718       10.82492 
1 1 1 -5  23 44 o 14.58770 6.174634 2.676871       3.789708 6.426388       5.912555 0.6233206E-01  4.937249 18.21405 7.711182 13.55377 6.281966 4.660275       9.946126 
1 1 1 -5  23 45 o 32.50447 5.811121 17.21158       4.434013 12.26027       6.878991 20.73092       5.799562 21.64900 8.643258 33.22026 7.358069 -11.57126      11.35108 
1 1 1 -5  24 1  o 157.1447 2.963826 301.1450       11.34981 288.5609       17.13629 310.9794       15.14892 153.6677 4.581243 159.6407 3.894053 -5.973007      6.012607 
1 1 1 -5  24 2  o 68.55814 3.237174 57.45506       5.393030 61.43154       7.360949 52.84708       7.923923 70.81381 4.285657 65.59014 4.995101 5.223671       6.581633 
1 1 1 -5  24 3  o 80.00697 2.806837 78.14965       5.463964 63.54538       7.634885 93.48235       7.822972 72.01827 4.370924 87.45689 3.678855 -15.43861      5.713051 
1 1 1 -5  24 4  o 60.80672 3.104028 45.21131       4.584311 35.92058       6.294379 55.70692       6.690089 54.01993 4.832473 67.43757 4.090164 -13.41764      6.331053 
1 1 1 -5  24 5  o 90.16530 2.736859 99.22223       6.006547 93.25542       8.931885 104.1484       8.115729 87.30679 4.210573 92.32276 3.614286 -5.015968      5.549053 
1 1 1 -5  24 6  o 32.29017 4.541140 12.97942       3.474722 10.32831       4.748372 16.03563       5.098261 28.48070 6.912379 35.72023 6.074201 -7.239527      9.202005 
1 1 1 -5  24 7  o 212.8510 3.802918 552.8591       19.72554 517.7230       26.71044 595.0091       29.25516 205.7579 5.331563 220.6414 5.441008 -14.88354      7.617750 
1 1 1 -5  24 8  o 227.3622 3.545944 630.7123       19.64655 612.4917       30.30148 643.9274       25.80569 223.8336 5.555234 229.6243 4.611707 -5.790634      7.220005 
1 1 1 -5  24 9  o 228.0486 4.002219 634.7938       22.24151 637.5013       44.88281 633.9125       25.60671 227.7688 8.099187 227.8239 4.612309 -0.5506897E-01 9.320419 
1 1 1 -5  24 10 o 349.3539 5.459452 1492.177       46.47835 1583.324       97.13900 1465.115       52.93044 357.7679 11.15545 345.9814 6.277934 11.78656       12.80065 
1 1 1 -5  24 11 o 77.58039 3.242838 73.55472       6.117228 67.04990       12.99409 75.40681       6.933620 73.58651 7.344205 78.52319 3.633330 -4.936684      8.193805 
1 1 1 -5  24 12 o 159.9390 3.031106 312.0414       11.81385 333.8827       20.04301 300.4134       14.62431 165.2063 4.984222 156.8774 3.825416 8.328827       6.283015 
1 1 1 -5  24 13 f 114.2813 3.112244 159.4520       8.659253 186.9412       19.76313 152.9208       9.633156 123.3392 6.599371 111.8813 3.537702 11.45792       7.487792 
1 1 1 -5  24 14 o 205.6292 3.382728 516.0242       16.95071 519.1104       27.60975 514.1572       21.47417 205.8991 5.507596 205.1565 4.295314 0.7425995      6.984507 
1 1 1 -5  24 15 o 247.0951 4.200416 745.8810       25.29254 776.5931       52.57240 736.6317       28.85083 250.9418 8.609786 245.4562 4.823344 5.485626       9.868793 
1 1 1 -5  24 16 o 101.6143 2.785405 126.0578       6.890800 127.3818       11.87852 125.3863       8.459733 101.9517 4.794575 101.2915 3.432221 0.6601639      5.896447 
1 1 1 -5  24 17 o 195.4097 3.287628 466.1077       15.65542 474.5844       25.73150 461.1257       19.72661 196.8089 5.370197 194.2557 4.167184 2.553238       6.797385 
1 1 1 -5  24 18 o 46.23330 3.476225 26.24719       3.887824 20.20194       7.065357 28.87260       4.656135 39.87745 7.546920 48.44860 3.978765 -8.571159      8.531505 
1 1 1 -5  24 19 o 153.1024 2.957313 286.0852       11.03355 287.0010       18.37210 285.5685       13.79918 153.0415 4.932660 152.8915 3.703684 0.1499634      6.168339 
1 1 1 -5  24 20 f 99.29246 3.280029 120.5219       7.925628 130.1532       11.83259 112.6845       10.67383 103.0108 4.726284 95.85339 4.582858 7.157387       6.583338 
1 1 1 -5  24 21 o 186.5320 4.206882 425.5962       19.12273 412.9709       23.63636 449.5176       32.53518 183.4629 5.292372 190.9246 7.004741 -7.461655      8.779271 
1 1 1 -5  24 22 o 64.09515 2.972378 50.26698       4.630001 55.42921       8.644842 48.19062       5.482635 67.01589 5.337576 62.69143 3.603953 4.324467       6.440357 
1 1 1 -5  24 23 o 42.75978 3.838934 22.54004       3.957675 26.67527       7.552944 20.97491       4.646665 46.00929 6.953222 41.10729 4.724380 4.902004       8.406371 
1 1 1 -5  24 24 o 125.8137 2.805369 193.2961       8.601101 200.3736       14.94489 189.7908       10.51753 127.7341 4.809791 124.5472 3.468702 3.186935       5.930091 
1 1 1 -5  24 25 o 58.68532 3.566412 42.28380       5.076239 43.13277       8.535898 41.81927       6.314099 58.86458 6.035977 58.23232 4.484008 0.6322632      7.519265 
1 1 1 -5  24 26 o 84.78580 3.213981 88.02450       6.628505 93.56168       10.72413 84.60129       8.432083 87.10124 5.074419 82.97486 4.183655 4.126381       6.576678 
1 1 1 -5  24 27 o 19.40427 6.670914 4.272738       3.813489 3.060580       9.341795 4.515126       4.177406 24.26681 9.932613 20.07576 6.978122 4.191055       12.13882 
1 1 1 -5  24 28 o 91.88646 3.197385 103.4761       7.148589 107.2463       11.59713 101.1658       9.078434 93.12682 5.130040 90.67957 4.119087 2.447258       6.579072 
1 1 1 -5  24 29 o 49.05923 4.313100 29.83841       5.103961 42.91071       12.07651 26.99565       5.631647 57.55236 8.897485 46.49166 5.051903 11.06070       10.23166 
1 1 1 -5  24 30 f 35.29950 5.382136 15.79688       4.483533 15.55328       11.07543 15.84462       4.903266 34.60803 11.36459 35.21763 5.923356 -0.6095963     12.81562 
1 1 1 -5  24 31 o 69.25716 3.423185 59.12586       5.759479 63.60911       9.313333 56.34957       7.328944 71.24242 5.404841 67.32609 4.492771 3.916328       7.028321 
1 1 1 -5  24 32 f 61.41272 3.502116 46.64712       5.219404 48.04687       8.308012 45.73446       6.708559 61.63566 5.592124 60.48769 4.585360 1.147968       7.231692 
1 1 1 -5  24 33 o 17.92957 6.391212 3.635270       3.520376 4.679216       5.983353 3.082555       4.353681 21.48484 8.207759 18.16085 6.985282 3.323997       10.77782 
1 1 1 -5  24 34 o 25.13544 6.153164 8.433157       3.738060 14.12045       6.497909 5.620063       4.569964 31.86486 8.290202 21.24533 7.302694 10.61953       11.04793 
1 1 1 -5  24 35 o 60.14930 3.540349 45.25299       5.166399 51.98669       8.156493 40.74123       6.676514 63.48346 5.321301 56.39276 4.907182 7.090702       7.238555 
1 1 1 -5  24 36 o 46.51374 3.973616 27.50038       4.460955 21.73696       6.661745 32.18578       6.006499 39.52241 7.181287 49.75414 5.022693 -10.23173      8.763465 
1 1 1 -5  24 37 o 62.06853 4.055798 49.34151       6.100963 40.67991       10.53557 53.71146       7.483375 52.23445 8.574071 64.13441 4.823525 -11.89996      9.837738 
1 1 1 -5  24 38 f 42.67915 5.712093 25.07176       5.791803 24.69167       6.850588 26.02427       10.84484 41.14862 7.087562 37.46608 11.09381 3.682545       13.16458 
1 1 1 -5  24 39 o 17.24324 6.564138 3.802923       3.818321 10.05355       5.610678 -1.589433      5.211258 24.82340 8.084914 14.22478 6.543162 10.59862       10.40090 
1 1 1 -5  24 40 o 12.66107 5.647132 -0.1863953     3.537065 -1.877013      5.624066 0.9198709      4.549436 14.32480 6.661671 14.86404 6.527181 -0.5392408     9.326411 
1 1 1 -5  24 41 o 11.56597 5.527160 -3.674333      4.382799 -6.258513      5.489642 0.8683800      7.278471 11.98683 5.838339 16.77477 7.722178 -4.787940      9.680818 
1 1 1 -5  24 42 o 18.17879 6.815396 5.400700       4.080250 11.80715       6.087488 0.1747168      5.498109 24.23041 8.423639 14.60929 6.720322 9.621125       10.77592 
1 1 1 -5  24 43 f 13.30702 6.099208 0.1625662      4.473103 6.606076       8.780837 -2.095551      5.198139 18.56080 8.521418 12.80907 6.092661 5.751729       10.47545 
1 1 1 -5  24 44 o 16.88154 6.736351 5.040119       4.176305 -2.657306      6.274557 11.16250       5.595907 13.24123 6.400231 22.44227 8.051266 -9.201041      10.28522 
1 1 1 -5  25 1  o 48.44249 3.532552 28.78438       4.141482 35.26620       6.254205 23.72248       5.526880 53.51149 4.848679 43.74011 5.292700 9.771385       7.177908 
1 1 1 -5  25 2  o 44.43118 3.996408 24.29030       4.280881 28.82818       5.741639 18.61009       6.423794 48.32520 4.945238 38.36702 7.133128 9.958172       8.679683 
1 1 1 -5  25 3  o 123.7784 3.178176 187.0132       9.578548 174.7921       17.84669 191.9581       11.35215 119.3629 6.156330 125.3643 3.720053 -6.001305      7.192996 
1 1 1 -5  25 4  o 104.3711 2.794444 132.9410       7.101019 122.2402       10.41929 142.2223       9.703582 99.96735 4.287008 107.8929 3.696108 -7.925591      5.660358 
1 1 1 -5  25 5  o 190.5007 3.614968 442.8396       16.78175 470.9225       24.09603 416.3877       23.38584 196.2459 5.042767 184.5033 5.206515 11.74254       7.248261 
1 1 1 -5  25 6  o 130.3199 3.132966 207.1679       9.949533 196.5109       13.39714 220.2748       14.85742 126.7835 4.342651 134.2181 4.549088 -7.434624      6.289104 
1 1 1 -5  25 7  o 146.0086 2.880270 260.0102       10.24820 261.3146       15.85654 259.0745       13.43010 146.2069 4.455656 145.6445 3.787196 0.5623932      5.847711 
1 1 1 -5  25 8  o 48.98392 3.421872 29.41946       4.058948 28.43464       5.834157 30.34332       5.650677 47.96909 5.067425 49.61258 4.731044 -1.643490      6.932645 
1 1 1 -5  25 9  o 23.51264 6.515145 6.972749       3.861784 5.829244       8.000240 7.320138       4.409532 25.33912 9.534106 24.20777 7.048780 1.131350       11.85683 
1 1 1 -5  25 10 o 114.4638 3.155821 159.9684       8.794314 156.3699       17.91371 161.1111       10.09447 112.7842 6.545934 114.8358 3.611690 -2.051666      7.476199 
1 1 1 -5  25 11 o 49.40975 4.053010 30.01188       4.837218 23.35167       10.20359 31.94264       5.493798 42.64995 9.993237 50.93781 4.471162 -8.287865      10.94788 
1 1 1 -5  25 12 o 164.0752 3.075525 328.4585       12.29697 339.2966       20.52709 322.3918       15.35771 166.4911 5.065307 162.4879 3.878548 4.003174       6.379692 
1 1 1 -5  25 13 o 52.70568 4.104916 34.13657       5.230724 40.94353       8.192348 29.45172       6.796405 57.51693 5.929785 48.69661 5.843829 8.820320       8.325424 
1 1 1 -5  25 14 o 27.99463 5.948653 9.964172       3.932889 24.95950       10.88766 7.713917       4.217670 44.03061 10.32690 24.69296 6.795807 19.33765       12.36236 
1 1 1 -5  25 15 o 83.58484 3.174588 85.39143       6.454474 66.81465       13.73338 90.65809       7.312403 73.27692 7.811122 86.10009 3.492389 -12.82317      8.556308 
1 1 1 -5  25 16 o 42.48541 3.884094 22.23403       3.976856 23.98723       7.488538 21.54536       4.693371 43.59155 7.307911 41.70918 4.699306 1.882366       8.688443 
1 1 1 -5  25 17 o 62.63385 3.166271 48.01075       4.817062 55.91255       8.876647 44.71247       5.734953 67.33700 5.456226 60.36485 3.919805 6.972145       6.718279 
1 1 1 -5  25 18 o 68.83131 3.558473 58.02518       5.948519 60.21891       9.094478 56.38491       7.863990 69.89779 5.380606 67.70482 4.797436 2.192970       7.208766 
1 1 1 -5  25 19 o 154.7843 3.940734 293.0641       14.85206 322.3525       19.50548 252.6553       22.91113 162.1607 4.941765 143.1976 6.583218 18.96313       8.231634 
1 1 1 -5  25 20 o 232.7890 4.079820 662.7590       23.14406 671.9383       33.97731 654.8132       31.61184 233.8243 5.967856 231.0038 5.615579 2.820496       8.194512 
1 1 1 -5  25 21 o 83.24832 2.881050 84.71240       5.835893 77.53178       10.22071 88.18594       7.108631 79.32345 5.318139 84.88271 3.443763 -5.559258      6.335780 
1 1 1 -5  25 22 o 230.6149 3.642933 650.2672       20.47268 683.0947       34.32351 632.1387       25.50663 235.5971 5.983251 227.1410 4.608096 8.456116       7.552075 
1 1 1 -5  25 23 o 102.5447 2.819798 128.5143       7.039711 124.9757       12.30408 130.2364       8.583414 100.7884 5.025444 103.1568 3.419218 -2.368317      6.078334 
1 1 1 -5  25 24 o 58.66595 3.306001 42.21266       4.707219 50.13319       8.648787 38.87888       5.611084 63.58240 5.640363 56.18717 4.126804 7.395226       6.988863 
1 1 1 -5  25 25 o 72.76991 2.919835 64.81708       5.167299 54.73485       9.359504 69.23757       6.197410 66.38235 5.845456 75.15588 3.392598 -8.773529      6.758629 
1 1 1 -5  25 26 o 95.70660 3.560380 112.3266       8.289277 103.6838       15.77479 115.6235       9.742826 91.04964 7.167421 96.99605 4.131337 -5.946404      8.272839 
1 1 1 -5  25 27 o 79.16778 3.344616 76.89402       6.438006 69.91090       10.45818 81.15508       8.169408 74.96472 5.769186 81.18919 4.142804 -6.224464      7.102558 
1 1 1 -5  25 28 o 104.8782 3.616916 135.1262       9.230159 130.2012       18.40150 136.7819       10.66946 101.5955 7.485192 105.3803 4.162962 -3.784798      8.564949 
1 1 1 -5  25 29 o 59.67279 4.005494 44.02684       5.790896 35.16085       13.19899 46.14029       6.444245 50.94917 10.95656 61.01319 4.363030 -10.06401      11.79331 
1 1 1 -5  25 30 o 74.56194 3.375103 68.48457       6.116638 69.46435       9.881759 67.87602       7.787882 74.43821 5.486108 73.96742 4.339652 0.4707870      6.994995 
1 1 1 -5  25 31 o 27.74773 6.351126 10.10713       4.201509 6.156251       6.775608 12.57539       5.355460 23.74406 8.805975 30.77811 7.258949 -7.034056      11.41217 
1 1 1 -5  25 32 o 33.93847 4.945620 14.71099       3.970044 10.40168       6.770719 16.96887       4.900961 27.90401 8.862329 36.23030 5.742296 -8.326288      10.56006 
1 1 1 -5  25 33 o 21.69900 6.532739 6.192814       3.736577 6.019202       6.360603 6.284301       4.617301 22.89217 8.524018 22.13868 7.340814 0.7534828      11.24929 
1 1 1 -5  25 34 o 14.40912 6.001315 0.9337459      3.491236 9.566452       6.118230 -3.234439      4.251339 26.27722 8.433070 12.46865 5.796245 13.80856       10.23294 
1 1 1 -5  25 35 o 20.89298 6.484550 5.890817       3.645597 7.119045       6.033351 5.184501       4.575288 23.20075 8.355463 20.31439 7.281043 2.886358       11.08275 
1 1 1 -5  25 36 o 64.77399 3.934553 53.47377       6.181289 45.10540       11.44300 56.92172       7.345132 54.92521 8.850012 66.33308 4.571912 -11.40787      9.961179 
1 1 1 -5  25 37 f 69.07976 4.344464 62.11419       7.276427 64.01321       8.912418 58.31781       12.60130 69.02676 5.339859 61.57539 8.634922 7.451378       10.15263 
1 1 1 -5  25 38 o 29.31646 6.159133 12.43601       4.260023 15.29334       6.164813 9.824650       5.893506 30.84053 8.100102 24.57333 8.295904 6.267204       11.59455 
1 1 1 -5  25 39 f 24.12543 6.800983 9.013913       4.169528 10.58081       6.274246 7.774648       5.579854 24.68797 8.553583 21.90784 8.014215 2.780132       11.72141 
1 1 1 -5  25 40 o 16.34295 6.763969 3.055629       4.395666 1.631546       5.756243 5.047739       6.808137 16.27553 7.235035 19.17002 8.200406 -2.894499      10.93583 
1 1 1 -5  25 41 o 14.05968 6.087244 1.468287       3.838894 5.579401       5.798707 -1.739371      5.122069 18.64620 7.747557 13.31769 6.246799 5.328506       9.952244 
1 1 1 -5  25 42 o 21.61835 7.373523 8.756540       4.656899 -2.080643      8.933977 12.79965       5.456879 15.62942 7.574318 25.59918 7.931629 -9.969759      10.96727 
1 1 1 -5  25 43 o 11.48235 5.384566 -1.338080      3.801606 -14.23467      5.986960 7.374931       4.920996 9.945011 5.030903 19.28403 7.424081 -9.339014      8.968108 
1 1 1 -5  26 1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -5  26 2  o 138.7427 3.769992 235.1403       12.73456 224.9024       21.23134 240.8931       15.91522 135.3521 6.455504 140.3378 4.660200 -4.985764      7.961846 
1 1 1 -5  26 3  o 173.6808 3.535827 368.1291       14.96507 363.3985       28.77317 369.8834       17.52141 172.0465 6.876724 174.0436 4.131186 -1.997086      8.022222 
1 1 1 -5  26 4  o 154.7562 3.904444 292.5679       14.71283 267.4132       23.77993 308.1693       18.72764 147.5830 6.629003 158.7217 4.847524 -11.13876      8.212318 
1 1 1 -5  26 5  o 110.4071 3.172516 148.8424       8.526806 155.1960       16.68294 146.5957       9.920477 112.4222 6.112533 109.5258 3.722301 2.896378       7.156716 
1 1 1 -5  26 6  f 104.0120 3.165055 132.1148       8.013000 148.1548       16.19329 126.9136       9.221081 109.8349 6.073692 101.8977 3.719723 7.937164       7.122224 
1 1 1 -5  26 7  o 99.72803 3.153963 121.4678       7.655324 109.6841       14.68338 125.8664       8.971045 94.39939 6.421165 101.4811 3.633485 -7.081673      7.377911 
1 1 1 -5  26 8  o 102.0770 3.153060 127.2564       7.833848 127.4427       15.72609 127.1949       9.034595 101.7861 6.372069 102.0126 3.640118 -0.2265320     7.338510 
1 1 1 -5  26 9  o 235.9293 4.113352 679.8757       23.64906 696.1288       48.12337 674.7009       27.15412 237.6976 8.320808 234.9353 4.742980 2.762238       9.577668 
1 1 1 -5  26 10 o 282.6393 4.655776 976.5046       32.06718 1008.788       65.69791 966.4078       36.74111 285.6898 9.449715 281.0257 5.365005 4.664093       10.86648 
1 1 1 -5  26 11 o 150.8085 3.324748 277.5866       12.21857 256.1421       24.17257 284.9462       14.16084 144.3000 6.894113 152.7543 3.804166 -8.454269      7.874037 
1 1 1 -5  26 12 o 154.0443 3.332281 289.6511       12.50902 298.8257       26.25418 286.9566       14.22777 155.8517 6.930084 153.2841 3.808937 2.567581       7.907848 
1 1 1 -5  26 13 o 187.9889 3.664201 431.5742       16.78602 403.3644       34.35182 440.4230       19.23943 180.8530 7.812924 189.8445 4.158706 -8.991455      8.850798 
1 1 1 -5  26 14 o 358.1958 5.650039 1572.150       49.31829 1549.968       69.50295 1594.646       69.99281 354.6392 8.042303 359.7434 7.984073 -5.104218      11.33243 
1 1 1 -5  26 15 o 186.8105 3.735939 426.3203       17.00737 422.5423       24.35857 429.9140       23.75683 185.6440 5.390075 187.2958 5.210106 -1.651733      7.496540 
1 1 1 -5  26 16 o 205.0779 4.477109 514.4576       22.37447 507.0194       39.08545 518.0831       27.28794 202.5933 7.932205 205.5337 5.452999 -2.940399      9.625751 
1 1 1 -5  26 17 o 116.4112 3.359925 165.6421       9.521507 151.2095       13.59185 179.5501       13.34250 110.9958 5.038133 121.0505 4.531080 -10.05475      6.775948 
1 1 1 -5  26 18 o 146.4897 3.307010 262.0966       11.80535 260.2103       17.84679 263.5640       15.74130 145.6464 5.035912 146.6976 4.408334 -1.051178      6.692818 
1 1 1 -5  26 19 o 122.2090 2.889746 182.3303       8.605957 201.4882       15.09497 173.1045       10.47513 128.1540 4.842233 118.9570 3.617749 9.197060       6.044446 
1 1 1 -5  26 20 o 238.5878 3.730076 696.0135       21.68713 714.7139       35.65128 685.0287       27.32417 241.0049 6.075185 236.4439 4.742231 4.560944       7.706921 
1 1 1 -5  26 21 o 194.1156 3.318209 460.4987       15.69640 470.5723       26.04184 454.7509       19.67118 195.6515 5.467370 192.7293 4.188385 2.922180       6.887285 
1 1 1 -5  26 22 o 23.41074 5.895306 7.008462       3.360733 0.4029129      6.655670 9.269032       3.893554 19.30993 8.178569 26.90926 6.081196 -7.599335      10.19166 
1 1 1 -5  26 23 o 18.59820 6.134491 4.075975       3.225745 1.421197       7.178214 4.747746       3.610879 20.72326 8.616083 19.93664 6.485442 0.7866192      10.78415 
1 1 1 -5  26 24 o 136.1045 2.921172 226.4019       9.688706 223.1233       16.67248 228.0736       11.90525 134.6035 5.092036 136.4546 3.583358 -1.851089      6.226499 
1 1 1 -5  26 25 o 74.40583 3.755346 68.01778       6.787137 60.71247       13.81200 70.34332       7.792912 69.13929 8.367829 75.58410 4.248000 -6.444809      9.384353 
1 1 1 -5  26 26 o 124.8919 3.734580 191.4701       11.35335 195.1073       15.75766 187.5437       16.37208 125.6543 5.157058 123.0822 5.472169 2.572128       7.519300 
1 1 1 -5  26 27 o 91.68910 3.065078 103.0776       6.838873 103.5398       16.81573 102.9860       7.485927 90.41832 7.705070 91.59076 3.359653 -1.172440      8.405674 
1 1 1 -5  26 28 o 79.30832 3.394256 77.35582       6.544762 69.39997       10.71263 82.09372       8.266954 74.38596 5.959564 81.51389 4.175682 -7.127937      7.276862 
1 1 1 -5  26 29 o 59.24253 3.661924 43.38139       5.260791 38.83750       8.848082 45.86607       6.542907 55.10638 6.728227 60.71890 4.452885 -5.612514      8.068285 
1 1 1 -5  26 30 o 39.37318 4.793049 19.56973       4.504199 18.56439       7.130186 20.23732       5.810324 37.24284 8.088466 39.59822 6.226587 -2.355385      10.20753 
1 1 1 -5  26 31 o 108.8998 3.217265 146.3779       8.528517 144.0491       13.13748 148.0742       11.21230 107.0290 5.051282 109.0229 4.228293 -1.993851      6.587406 
1 1 1 -5  26 32 o 78.54390 3.315725 76.48485       6.332119 67.43291       9.655719 83.31518       8.387539 72.65221 5.494536 81.54447 4.235405 -8.892265      6.937476 
1 1 1 -5  26 33 o 19.34647 6.387941 4.776055       3.497494 4.455665       6.367769 4.914464       4.185316 21.20007 8.363281 19.95826 6.981647 1.241814       10.89440 
1 1 1 -5  26 34 f 17.95178 6.560285 3.766781       3.737476 2.937670       6.136690 4.255659       4.712245 19.42579 8.011300 19.36335 7.310266 0.6243515E-01  10.84532 
1 1 1 -5  26 35 o 49.35128 4.091730 31.18989       4.876672 32.22889       7.703665 30.49511       6.299592 48.28777 6.729275 47.88688 5.497944 0.4008865      8.689680 
1 1 1 -5  26 36 o 56.89159 4.731615 42.59042       6.500520 42.93364       7.926459 41.88543       11.36028 56.01207 5.895423 51.30185 9.434543 4.710220       11.12504 
1 1 1 -5  26 37 o 21.30108 6.912264 6.734036       4.103193 7.441977       5.742262 5.995439       5.865275 22.11366 8.123379 20.70299 8.068113 1.410669       11.44918 
1 1 1 -5  26 38 o 51.27132 4.038037 34.64045       5.004535 34.50913       7.687943 34.73702       6.592608 48.16605 6.733629 49.76797 5.529107 -1.601929      8.712793 
1 1 1 -5  26 39 o 25.88723 7.168885 10.86337       4.677188 10.91150       6.259338 10.80251       7.038007 24.52908 8.540854 24.00160 8.960658 0.5274811      12.37900 
1 1 1 -5  26 40 o 24.49878 6.801999 9.879090       4.204697 14.19560       6.586921 6.910619       5.462389 26.83698 8.761398 20.00318 7.788730 6.833796       11.72290 
1 1 1 -5  26 41 o 12.90157 5.796575 0.3600855      3.800811 -4.290275      5.949898 3.565978       4.940156 12.84633 6.214948 16.35171 6.989871 -3.505376      9.353281 
1 1 1 -5  26 42 o 13.17189 5.984036 0.4687470      4.184576 -7.225048      8.047747 3.319703       4.898908 13.44139 6.649004 15.76956 6.851721 -2.328168      9.547530 
1 1 1 -5  26 43 o 26.28306 6.725150 12.35412       4.324624 9.031327       6.739000 14.68058       5.638876 19.51761 8.246298 26.43175 8.039618 -6.914133      11.51681 
1 1 1 -5  27 1  o 262.6905 3.966048 842.7465       25.38858 846.4760       39.63644 840.1517       33.06115 262.8369 6.188312 262.0733 5.176771 0.7636108      8.068096 
1 1 1 -5  27 2  o 109.2165 3.171461 145.6756       8.431861 153.9488       11.41492 135.7405       12.50893 112.1837 4.182811 105.2517 4.890394 6.932007       6.435205 
1 1 1 -5  27 3  o 31.57295 4.980604 12.48451       3.705188 4.829501       5.128069 20.84586       5.359439 21.52415 7.709092 40.90728 5.516786 -19.38313      9.479716 
1 1 1 -5  27 4  o 117.1931 3.097259 167.6982       8.837608 166.2814       12.04402 169.3508       13.00812 116.5882 4.246262 117.6267 4.546646 -1.038559      6.221152 
1 1 1 -5  27 5  o 207.7803 3.830032 527.1907       19.39291 569.2454       28.30206 489.9695       26.62604 215.6780 5.384880 200.0100 5.467972 15.66800       7.674350 
1 1 1 -5  27 6  o 107.2627 3.124175 140.5118       8.157500 131.7266       10.91251 151.6391       12.28131 103.7395 4.326120 111.2931 4.537873 -7.553558      6.269578 
1 1 1 -5  27 7  o 221.2766 3.957887 598.0352       21.34199 636.0799       30.82966 563.0269       29.57376 227.9407 5.550227 214.3571 5.666482 13.58353       7.931837 
1 1 1 -5  27 8  o 220.9861 3.952071 596.5020       21.28265 578.3530       29.25770 616.8973       31.01560 217.2716 5.530371 224.3666 5.677210 -7.094955      7.925637 
1 1 1 -5  27 9  o 110.8892 3.730141 150.3363       10.06542 138.2132       16.87857 157.0269       12.53899 105.9309 6.570828 113.2397 4.553174 -7.308754      7.994197 
1 1 1 -5  27 10 o 58.48391 4.191547 42.01135       5.934135 46.65922       10.09961 39.56077       7.333516 61.26195 6.884148 56.59120 5.382473 4.670753       8.738564 
1 1 1 -5  27 11 o 200.6577 4.417158 492.2611       21.59905 511.9772       39.19132 483.6603       25.88489 203.7264 7.909195 198.6683 5.351522 5.058075       9.549563 
1 1 1 -5  27 12 o 222.8336 5.722386 609.0111       31.04806 0.000000       0.000000 609.0111       31.04806 ?        ?        222.8336 5.722386 0.000000       5.722386 
1 1 1 -5  27 13 o 157.8520 4.018755 304.7244       15.44630 305.8066       27.20795 304.2097       18.76311 157.5188 7.106358 157.5790 4.892116 -0.6018066E-01 8.627463 
1 1 1 -5  27 14 o 90.30560 3.035322 99.65889       6.670187 90.31749       11.17037 104.8355       8.315458 85.68495 5.376775 92.55964 3.694040 -6.874687      6.523469 
1 1 1 -5  27 15 o 174.2025 3.196087 370.5405       13.56779 395.5534       23.08350 357.3382       16.77048 179.5814 5.280514 170.9649 4.025340 8.616501       6.639819 
1 1 1 -5  27 16 o 69.59949 3.105360 59.26338       5.253626 67.24075       9.602251 55.85516       6.276349 73.86414 5.371323 67.49079 3.831903 6.373344       6.598075 
1 1 1 -5  27 17 o 53.64800 3.891497 35.37326       5.052937 43.53106       8.976336 31.58915       6.113560 59.17323 6.322848 50.52495 5.032218 8.648281       8.080942 
1 1 1 -5  27 18 o 78.08734 3.015704 74.57261       5.727806 69.39598       10.08116 77.04034       6.960414 74.98340 5.556566 79.30791 3.610965 -4.324516      6.626802 
1 1 1 -5  27 19 o 260.1976 3.970802 828.3538       25.17779 905.6736       42.84006 787.5540       31.11953 271.1361 6.483754 253.3884 5.039764 17.74777       8.212082 
1 1 1 -5  27 20 o 121.9894 2.881559 181.7526       8.566151 193.1293       15.14224 176.3981       10.38822 125.3610 4.966517 120.0529 3.554765 5.308060       6.107589 
1 1 1 -5  27 21 o 198.1597 3.374631 480.1400       16.29588 465.1271       26.41041 489.3696       20.70781 194.3667 5.581708 199.8488 4.252033 -5.482010      7.016783 
1 1 1 -5  27 22 o 108.8272 2.888467 144.8105       7.653445 143.9683       13.38783 145.2194       9.327984 108.1126 5.095910 108.8888 3.519973 -0.7762680     6.193424 
1 1 1 -5  27 23 o 98.17426 3.214499 118.0215       7.679999 111.7814       11.80828 122.5963       10.11059 95.17783 5.109868 99.89497 4.162454 -4.717140      6.590658 
1 1 1 -5  27 24 o 120.8668 3.695352 179.2057       10.87147 173.0048       20.53006 181.6221       12.81582 117.6557 7.194866 121.5267 4.334458 -3.870926      8.399620 
1 1 1 -5  27 25 o 71.51388 3.236609 62.76031       5.625868 53.10202       13.72891 64.70945       6.167476 64.19891 9.024283 72.57529 3.497542 -8.376381      9.678351 
1 1 1 -5  27 26 o 155.9244 3.381737 298.1758       12.84961 288.2709       28.50322 300.7022       14.39541 151.0438 7.769928 156.4580 3.775636 -5.414261      8.638704 
1 1 1 -5  27 27 o 70.65031 3.214023 61.36874       5.518998 70.81548       10.49097 57.75395       6.489575 75.18475 5.770077 68.38492 3.910517 6.799835       6.970361 
1 1 1 -5  27 28 o 13.57319 5.500062 1.023949       2.830198 -1.090191      6.824593 1.463060       3.110260 18.20626 7.994628 14.62134 5.820317 3.584920       9.888891 
1 1 1 -5  27 29 o 15.30765 5.726952 2.280950       2.877924 4.392693       6.326782 1.729997       3.231614 21.69614 8.400533 15.11161 5.958987 6.584530       10.29944 
1 1 1 -5  27 30 o 63.05879 3.450223 49.27778       5.281667 44.56697       8.570461 52.16237       6.706542 58.93723 6.053255 64.59418 4.284804 -5.656960      7.416295 
1 1 1 -5  27 31 o 44.69168 4.026124 25.09131       4.337842 22.64386       7.415836 26.36428       5.348267 40.85806 7.731192 45.49977 4.900756 -4.641708      9.153619 
1 1 1 -5  27 32 o 104.9902 3.239838 136.9221       8.279200 135.8983       12.75348 137.6678       10.88449 103.1672 5.088540 104.5358 4.281807 -1.368607      6.650347 
1 1 1 -5  27 33 o 18.50654 6.578613 4.185393       3.727417 -0.2091835     6.410450 6.430104       4.581526 17.46967 7.706783 21.91486 7.313600 -4.445194      10.62465 
1 1 1 -5  27 34 o 29.45257 5.918976 11.86138       4.100673 5.710209       6.563627 15.79942       5.251757 21.78817 8.522218 33.67759 6.635337 -11.88942      10.80074 
1 1 1 -5  27 35 o 15.56909 7.114685 -1.746925      6.026469 0.6519622E-01  8.929863 -3.262517      8.166617 19.38528 8.780898 17.18853 8.004906 2.196751       11.88203 
1 1 1 -5  27 36 o 19.14083 7.414974 4.755244       4.931248 4.224537       5.724604 6.281799       9.708990 19.10331 7.792018 22.42526 9.694907 -3.321951      12.43812 
1 1 1 -5  27 37 o 41.12854 4.516292 22.71491       4.452108 23.86478       6.878743 21.88599       5.840382 39.28881 7.457318 38.65197 6.426145 0.6368370      9.844131 
1 1 1 -5  27 38 o 19.86765 6.709503 6.075166       3.855026 5.788463       6.015456 6.274972       5.021768 19.75708 8.013892 20.05031 7.551593 -0.2932243     11.01131 
1 1 1 -5  27 39 o 27.22539 6.276373 11.52665       4.078807 14.04204       6.440388 9.842082       5.270508 27.08964 8.647963 23.45524 7.844590 3.634405       11.67582 
1 1 1 -5  27 40 o 11.70942 5.452295 -1.414107      3.786150 -6.654728      5.992312 2.068227       4.884704 12.14587 5.954827 15.27596 6.733693 -3.130090      8.989026 
1 1 1 -5  27 41 o 25.94503 7.294449 12.33070       4.803200 18.56718       9.895020 10.40821       5.493872 24.63969 10.16834 22.50526 7.988087 2.134434       12.93077 
1 1 1 -5  27 42 o 25.40834 6.665748 11.42738       4.177911 11.99157       6.715734 11.07116       5.336241 22.10660 8.628050 22.85396 7.889772 -0.7473602     11.69153 
1 1 1 -5  28 1  o 121.1452 3.225922 179.2582       9.515018 185.0959       12.90315 172.3000       14.08721 122.9867 4.311954 118.5803 4.885484 4.406410       6.516203 
1 1 1 -5  28 2  o 266.0986 4.005642 865.0710       25.97472 819.5121       39.22789 900.6416       34.66197 258.5086 6.227073 271.2561 5.243698 -12.74750      8.140811 
1 1 1 -5  28 3  o 149.5960 2.996578 273.0845       10.92400 276.2905       16.67693 270.6750       14.45744 150.2551 4.559882 148.7953 3.990786 1.459808       6.059612 
1 1 1 -5  28 4  o 100.7185 2.841624 123.8678       6.967512 115.8607       10.13804 131.0352       9.591741 97.26968 4.287545 103.5071 3.809191 -6.237381      5.735240 
1 1 1 -5  28 5  o 21.72927 6.006289 5.962495       3.286554 5.348613       4.473449 6.682430       4.844469 21.53779 7.227456 23.53987 7.498746 -2.002077      10.41476 
1 1 1 -5  28 6  o 120.1502 2.859968 176.1434       8.373782 165.7334       12.38752 184.9032       11.36330 116.3545 4.376632 122.9775 3.796322 -6.623032      5.793701 
1 1 1 -5  28 7  o 293.4010 4.286249 1052.273       30.64609 1030.894       47.51529 1067.501       40.10193 289.7234 6.729979 295.1882 5.574811 -5.464874      8.739058 
1 1 1 -5  28 8  o 36.38412 5.362302 16.55554       4.612050 20.16095       8.747800 15.16755       5.427689 39.59919 9.235536 34.56904 6.684862 5.030155       11.40099 
1 1 1 -5  28 9  o 258.1793 4.399539 815.0678       27.67992 798.8067       55.09495 820.5580       32.01348 254.0455 8.913282 258.8957 5.074252 -4.850204      10.25644 
1 1 1 -5  28 10 f 59.25903 4.389280 43.17620       6.293466 0.000000       0.000000 43.17620       6.293466 ?        ?        59.25903 4.389280 0.000000       4.389280 
1 1 1 -5  28 11 o 134.6160 3.313967 221.2768       10.87128 239.6205       23.27239 216.1567       12.29522 139.4259 6.870700 132.9507 3.798876 6.475189       7.850986 
1 1 1 -5  28 12 o 45.79445 4.259909 25.86577       4.699377 26.29454       10.20199 25.75029       5.294533 45.21637 9.558218 45.61103 4.837101 -0.3946571     10.71247 
1 1 1 -5  28 13 o 104.0198 3.201148 132.2467       8.104768 128.4118       16.88531 133.3947       9.238578 101.9355 6.837014 104.4240 3.636068 -2.488518      7.743755 
1 1 1 -5  28 14 o 88.77993 3.057660 96.34711       6.605282 99.81683       11.70003 94.72388       8.002551 90.07102 5.354638 87.95706 3.742098 2.113960       6.532645 
1 1 1 -5  28 15 o 69.02189 3.235002 58.31481       5.426096 42.96532       9.422872 65.92968       6.636938 58.70733 6.706690 73.34755 3.725381 -14.64022      7.671907 
1 1 1 -5  28 16 o 194.3540 3.767560 461.8484       17.84389 452.9546       26.17311 469.5725       24.39117 191.9922 5.600154 195.6199 5.121028 -3.627701      7.588587 
1 1 1 -5  28 17 o 139.3227 3.020460 237.0739       10.25490 238.1286       17.34843 236.5075       12.71392 139.2301 5.121907 139.0158 3.756449 0.2143402      6.351758 
1 1 1 -5  28 18 o 265.5758 4.044893 863.3221       26.17771 864.3519       42.41744 862.6887       33.26902 264.7423 6.574836 265.1024 5.149800 -0.3600464     8.351582 
1 1 1 -5  28 19 o 47.64088 4.114609 27.99945       4.730111 40.68985       12.36859 25.82551       5.119251 56.36419 9.331144 45.65562 4.666831 10.70857       10.43310 
1 1 1 -5  28 20 o 184.9045 3.306769 418.0562       14.90004 415.4567       24.53150 419.5759       18.75615 183.6827 5.486645 185.0505 4.159271 -1.367828      6.884970 
1 1 1 -5  28 21 o 87.27055 3.355606 93.30861       7.123031 99.71536       11.40064 89.20620       9.122837 89.87830 5.227776 85.15671 4.411211 4.721596       6.840206 
1 1 1 -5  28 22 f 86.02502 3.293773 90.69318       6.892098 105.5453       11.62862 82.65099       8.556990 92.43244 5.183354 81.94624 4.300097 10.48620       6.734834 
1 1 1 -5  28 23 o 106.7182 3.476284 139.6700       9.028383 0.000000       0.000000 139.6700       9.028383 ?        ?        106.7182 3.476284 0.000000       3.476284 
1 1 1 -5  28 24 o 89.54134 3.100775 98.29446       6.755757 102.7321       16.13484 97.35108       7.439263 90.27106 7.399545 89.04805 3.434665 1.223007       8.157830 
1 1 1 -5  28 25 o 22.42178 5.869552 6.480515       3.244021 1.692365       7.217581 7.692667       3.631502 20.75212 8.634834 24.38391 6.121395 -3.631798      10.58451 
1 1 1 -5  28 26 o 57.40802 3.160439 40.56322       4.404303 42.48010       8.458068 39.85009       5.158916 57.99238 6.075051 56.78353 3.749187 1.208851       7.138813 
1 1 1 -5  28 27 o 61.01180 3.076133 45.83496       4.558811 44.75011       8.921441 46.21833       5.303511 59.32221 6.265942 61.15587 3.574262 -1.833660      7.213694 
1 1 1 -5  28 28 o 65.32589 3.228863 52.66817       5.124166 55.87386       9.397528 51.31180       6.112845 66.33935 5.873713 64.28298 3.920864 2.056366       7.062130 
1 1 1 -5  28 29 o 26.97840 4.987145 9.402865       3.157979 10.65851       6.685972 9.042296       3.582822 28.12683 8.789858 26.24081 5.761087 1.886021       10.50960 
1 1 1 -5  28 30 o 16.22454 5.847013 2.924769       2.955103 6.170438       6.528418 2.088380       3.314058 23.13661 8.631667 15.54717 6.063013 7.589439       10.54826 
1 1 1 -5  28 31 o 65.79539 3.048145 53.73074       4.873999 45.55191       8.904260 57.22967       5.823975 58.82376 6.310195 67.69320 3.542850 -8.869442      7.236736 
1 1 1 -5  28 32 o 21.31066 6.646662 6.132106       3.825018 -0.5428030E-01 6.366017 9.627381       4.785089 17.51125 7.704301 26.19268 7.250198 -8.681429      10.57930 
1 1 1 -5  28 33 o 26.81165 6.335109 10.00874       4.073032 12.08685       6.941321 8.917493       5.030012 28.20853 8.974952 24.88441 7.598004 3.324121       11.75923 
1 1 1 -5  28 34 o 28.27620 6.886443 11.59416       4.700412 11.19004       9.174501 11.73799       5.473320 26.44968 10.14873 27.90139 7.765796 -1.451708      12.77905 
1 1 1 -5  28 35 o 32.82328 7.286465 16.21965       5.676171 14.93329       6.682983 19.55038       10.75368 30.20168 8.642649 31.45137 11.17464 -1.249691      14.12685 
1 1 1 -5  28 36 o 21.78542 7.665534 7.384101       5.050329 15.83900       6.341895 -7.272140      8.349803 31.03494 8.246087 15.25426 7.375653 15.78068       11.06337 
1 1 1 -5  28 37 o 38.49326 4.697312 20.30000       4.315105 18.89125       6.496115 21.41247       5.772698 33.71491 8.023358 37.76441 6.507665 -4.049503      10.33073 
1 1 1 -5  28 38 o 27.32176 6.487229 11.71572       4.254409 20.56892       6.633161 5.528453       5.545231 34.50568 8.038424 18.96344 7.693447 15.54224       11.12679 
1 1 1 -5  28 39 o 35.56956 5.435780 18.79520       4.562359 7.901787       7.059174 26.60955       5.978860 20.25941 8.492639 41.48270 6.096166 -21.22330      10.45410 
1 1 1 -5  28 40 o 22.59269 7.023931 9.175847       4.275286 -1.113986      8.384465 12.79127       4.969932 15.62689 7.514276 26.41266 7.417864 -10.78577      10.55884 
1 1 1 -5  28 41 o 14.37713 6.335698 2.076149       4.321490 6.626373       9.430685 0.8667324      4.861999 18.20406 8.518661 13.93611 6.376766 4.267944       10.64099 
1 1 1 -5  29 1  o 115.7385 3.198403 163.6544       9.012197 177.7524       12.45669 148.1705       13.05467 120.5038 4.248600 109.9212 4.885791 10.58263       6.474686 
1 1 1 -5  29 2  o 67.08818 3.086444 55.05391       5.032402 51.45235       7.125208 58.63871       7.108603 64.69944 4.548171 69.12739 4.240263 -4.427948      6.218174 
1 1 1 -5  29 3  o 92.53444 2.907153 104.5998       6.547390 95.67677       9.332082 113.2501       9.188406 88.35045 4.347801 96.18937 3.928183 -7.838921      5.859521 
1 1 1 -5  29 4  o 66.22963 3.115691 53.66179       5.014454 58.32797       7.510516 49.90879       6.735617 68.91158 4.496975 63.73813 4.362835 5.173443       6.265550 
1 1 1 -5  29 5  o 75.80968 3.009436 70.25711       5.548583 71.21400       8.110920 69.41541       7.607055 76.18478 4.387392 75.23943 4.165172 0.9453506      6.049617 
1 1 1 -5  29 6  o 184.4275 3.254571 415.2912       14.62701 405.3641       22.33725 422.7433       19.35353 181.8786 5.044658 185.9366 4.271292 -4.058014      6.610031 
1 1 1 -5  29 7  o 15.96441 6.112255 2.118018       3.322978 5.235216       4.739285 -0.8964129     4.660508 21.60697 7.436381 15.27332 6.658882 6.333654       9.982007 
1 1 1 -5  29 8  o 127.0511 3.194795 197.2110       9.883553 185.0810       13.27468 212.2991       14.80513 122.9237 4.438806 131.6350 4.622525 -8.711334      6.408645 
1 1 1 -5  29 9  o 104.0534 3.126836 132.3079       7.919626 124.8911       13.89377 135.8776       9.638850 100.7496 5.682039 105.3813 3.759430 -4.631622      6.813141 
1 1 1 -5  29 10 o 133.7778 3.300903 218.5637       10.76101 242.6023       22.56766 211.4896       12.24242 140.3028 6.619274 131.4881 3.824781 8.814697       7.644850 
1 1 1 -5  29 11 o 81.07654 3.413912 80.43840       6.729930 76.98734       13.78522 81.51830       7.711334 78.71302 7.268788 81.56800 3.890697 -2.854980      8.244562 
1 1 1 -5  29 12 o 96.87184 3.297309 114.7564       7.772484 111.6469       15.89567 115.7335       8.910320 94.96333 6.916307 97.23022 3.767720 -2.266891      7.875977 
1 1 1 -5  29 13 o 105.7471 3.228639 136.7167       8.310266 149.9777       17.51567 132.8645       9.440440 110.1946 6.552328 104.1863 3.724300 6.008339       7.536804 
1 1 1 -5  29 14 o 142.4670 3.370558 248.0088       11.70178 245.5806       24.18320 248.7511       13.37142 140.9218 7.064587 142.5668 3.852310 -1.644974      8.046656 
1 1 1 -5  29 15 o 142.0698 3.433882 246.6960       11.88840 279.3051       19.09385 226.0512       15.19251 150.7766 5.204453 135.7515 4.599138 15.02515       6.945387 
1 1 1 -5  29 16 o 16.81877 6.528227 2.207336       3.828030 1.203455       7.037889 2.629111       4.561855 20.41571 8.513280 18.33786 7.124122 2.077854       11.10086 
1 1 1 -5  29 17 o 141.3978 3.063132 244.2943       10.55467 252.9807       18.05206 239.7824       13.01015 143.4262 5.173376 139.9258 3.819045 3.500443       6.430313 
1 1 1 -5  29 18 o 160.7533 3.571333 316.1481       13.99028 305.8464       20.63254 324.9156       19.03443 157.6185 5.379554 162.6301 4.808173 -5.011551      7.215132 
1 1 1 -5  29 19 o 195.8557 3.834199 469.7891       18.29983 470.8091       26.95301 468.9169       24.92548 195.3990 5.666409 195.1715 5.245476 0.2274475      7.721607 
1 1 1 -5  29 20 o 76.36352 4.081512 71.71198       7.567677 89.03147       16.57589 67.15140       8.505881 84.02322 8.199678 73.76482 4.757248 10.25840       9.479775 
1 1 1 -5  29 21 o 40.01999 4.446787 19.91632       4.263569 20.79181       10.55037 19.74544       4.661127 39.65708 10.68032 39.75713 4.915650 -0.1000519     11.75725 
1 1 1 -5  29 22 o 108.4644 3.530240 144.3631       9.318559 0.000000       0.000000 144.3631       9.318559 ?        ?        108.4644 3.530240 0.000000       3.530240 
1 1 1 -5  29 23 o 20.90018 6.271134 5.501915       3.447571 9.782718       7.426781 4.326066       3.892367 28.14496 9.309196 19.48316 6.737779 8.661808       11.49168 
1 1 1 -5  29 24 o 61.69143 3.155452 46.79025       4.728000 60.88218       9.529548 42.18875       5.445487 69.75481 5.654558 58.44138 3.845028 11.31343       6.838001 
1 1 1 -5  29 25 o 79.43650 2.974415 77.51392       5.747645 89.52117       11.00152 73.00626       6.740719 84.62839 5.362154 76.94170 3.605102 7.686684       6.461382 
1 1 1 -5  29 26 o 95.14143 2.845610 111.1934       6.590112 103.6299       11.51599 114.8764       8.035997 90.97686 5.216252 96.53231 3.421514 -5.555450      6.238272 
1 1 1 -5  29 27 o 43.86840 3.855603 23.99315       4.079847 31.29957       8.134837 21.53776       4.715816 49.00257 7.011934 41.29116 4.774522 7.711414       8.483117 
1 1 1 -5  29 28 o 25.89085 5.173732 8.720000       3.150025 15.40178       7.039281 7.046950       3.522385 33.39290 8.598810 23.08720 6.150596 10.30571       10.57210 
1 1 1 -5  29 29 o 24.04340 5.347624 7.614809       3.052280 5.444113       6.227462 8.301155       3.501734 22.18230 8.397202 24.99034 5.853438 -2.808037      10.23600 
1 1 1 -5  29 30 o 41.71476 3.911299 21.96863       3.929629 20.14139       7.128657 22.76624       4.709843 37.97386 7.958486 42.17096 4.660752 -4.197102      9.222803 
1 1 1 -5  29 31 o 13.44322 5.500779 1.100749       2.864110 11.98136       6.565400 -1.456604      3.182950 28.61582 8.669041 11.53788 5.232701 17.07794       10.12588 
1 1 1 -5  29 32 o 47.27850 3.527632 28.27713       4.034980 22.30810       7.496558 30.71171       4.787652 39.00584 8.149801 49.00359 4.045207 -9.997746      9.098514 
1 1 1 -5  29 33 o 28.00592 7.041435 11.46121       4.799882 -1.218196      9.000788 16.49989       5.674002 18.85941 8.646999 33.69595 7.132586 -14.83655      11.20912 
1 1 1 -5  29 34 o 27.96387 7.755185 12.18748       5.469140 17.85356       6.775483 1.592071       9.265265 33.48243 8.336342 19.84661 8.971513 13.63582       12.24674 
1 1 1 -5  29 35 o 27.17298 7.505450 11.65749       5.134062 12.81698       6.433486 9.624193       8.519446 27.46219 8.628123 23.81330 9.580573 3.648897       12.89310 
1 1 1 -5  29 36 o 15.95049 6.369844 2.953630       3.737170 -2.706506      5.768483 7.047684       4.905971 14.07991 6.612227 21.03877 7.539706 -6.958858      10.02840 
1 1 1 -5  29 37 o 36.07682 5.876342 19.30562       4.988553 17.98039       6.722778 20.92941       7.441619 31.47762 8.546236 33.52793 8.943442 -2.050314      12.37026 
1 1 1 -5  29 38 o 13.09112 5.802723 0.5840996      3.676185 1.931249       6.060410 -0.2001530     4.624046 16.14039 7.279719 13.61720 6.226278 2.523188       9.579188 
1 1 1 -5  29 39 o 11.90759 5.463370 -0.5901617     3.601504 -2.338478      5.989278 0.4000784      4.507490 13.59845 6.488191 13.63382 6.200447 -0.3536987E-01 8.974528 
1 1 1 -5  29 40 o 24.42324 7.239480 11.14465       4.616252 -0.4962273     9.005491 15.29365       5.376330 15.79346 7.642020 28.39438 7.614166 -12.60092      10.78777 
1 1 1 -5  30 1  o 164.7563 3.483081 331.5931       13.98433 368.9292       20.08482 296.4626       19.48258 173.5283 4.754129 155.4645 5.149666 18.06384       7.008624 
1 1 1 -5  30 2  o 155.8095 3.440748 296.5381       13.06420 309.0140       18.08323 282.9175       18.89460 158.8172 4.677521 151.8755 5.112500 6.941696       6.929420 
1 1 1 -5  30 3  o 60.12805 3.710996 44.34660       5.411061 43.82398       6.913745 45.17283       8.693043 59.63751 4.797722 60.37043 5.987784 -0.7329178     7.672790 
1 1 1 -5  30 4  o 156.9109 3.414050 300.7380       13.05447 317.4258       18.37143 283.7179       18.55352 160.9620 4.688638 152.1077 5.012249 8.854309       6.863379 
1 1 1 -5  30 5  o 140.5894 3.929608 241.8155       13.44967 226.4916       22.39204 250.4642       16.82227 135.5026 6.803011 142.9346 4.836564 -7.432022      8.347054 
1 1 1 -5  30 6  o 101.1211 3.196852 124.9924       7.867818 129.3656       10.78788 120.0230       11.49976 102.7425 4.318364 98.88979 4.786223 3.852692       6.446409 
1 1 1 -5  30 7  o 18.40747 6.596848 3.533716       3.755703 -0.9977990     5.870147 6.674158       4.886778 17.20080 7.486604 23.52257 7.535524 -6.321774      10.62230 
1 1 1 -5  30 8  o 48.05483 4.049259 28.44020       4.697781 21.76298       7.487760 32.77467       6.032840 41.34047 7.716321 51.49984 4.864713 -10.15937      9.121790 
1 1 1 -5  30 9  o 124.1197 2.890530 188.0770       8.742872 181.4246       13.23523 193.2271       11.64537 121.6586 4.471904 125.6605 3.807323 -4.001892      5.873128 
1 1 1 -5  30 10 o 63.55438 3.736493 49.54917       5.761366 54.94285       11.92354 47.90631       6.580552 66.29589 7.512719 62.41177 4.354035 3.884121       8.683235 
1 1 1 -5  30 11 o 15.27120 6.732629 -1.397937      4.884929 -1.378333      8.367176 -1.408074      6.016792 20.48195 8.926116 17.13404 7.515716 3.347910       11.66883 
1 1 1 -5  30 12 o 91.14610 3.856714 101.7969       8.546907 98.59543       14.70595 103.4298       10.50286 89.16372 6.819887 91.74902 4.713330 -2.585297      8.290134 
1 1 1 -5  30 13 o 102.1497 4.644415 128.1534       11.53099 124.1722       17.10362 131.4708       15.61274 100.0277 7.062071 103.1411 6.240912 -3.113388      9.424533 
1 1 1 -5  30 14 o 16.70488 7.302524 -1.133552      5.637498 2.121797       8.479424 -3.712351      7.547035 22.81026 9.413107 18.02688 8.127741 4.783381       12.43651 
1 1 1 -5  30 15 o 79.47519 3.898808 77.49976       7.527868 84.99042       14.28748 74.62117       8.856980 82.57903 7.170880 77.85950 4.689818 4.719521       8.568309 
1 1 1 -5  30 16 o 91.43919 3.856889 102.5440       8.574903 115.4048       16.36559 97.67722       10.06747 96.31503 7.020927 89.10556 4.652503 7.209465       8.422542 
1 1 1 -5  30 17 o 34.90903 6.348027 15.50767       5.201368 28.01328       10.13055 11.03086       6.061288 46.48912 9.267586 29.31332 8.177283 17.17580       12.35945 
1 1 1 -5  30 18 f 135.4477 3.783021 224.9445       12.47444 233.7123       24.26215 221.7938       14.54407 136.9126 7.298300 134.3341 4.449009 2.578552       8.547447 
1 1 1 -5  30 19 o 56.64523 3.692440 39.48544       5.069199 44.09782       12.07315 38.49828       5.585385 58.65228 8.711140 55.85964 4.132427 2.792641       9.641623 
1 1 1 -5  30 20 o 34.25743 5.106493 14.77923       4.132939 12.70084       10.45814 15.16389       4.499172 32.34029 11.04934 34.62051 5.517971 -2.280228      12.35055 
1 1 1 -5  30 21 f 54.17706 3.836836 36.22005       5.032757 54.95179       14.91603 33.81362       5.346266 64.93383 9.725327 52.26399 4.233928 12.66984       10.60699 
1 1 1 -5  30 22 o 28.51876 5.897997 10.47544       3.963547 5.336844       11.69222 11.14260       4.213000 27.55838 11.17473 29.39512 6.082088 -1.836735      12.72267 
1 1 1 -5  30 23 o 73.27390 3.059447 65.96670       5.450945 70.49536       10.28289 64.19676       6.428486 75.01297 5.667180 72.15124 3.668228 2.861732       6.750764 
1 1 1 -5  30 24 o 22.47274 5.972410 6.557533       3.326301 9.021463       6.788651 5.779108       3.815731 26.77518 8.901787 21.38160 6.633798 5.393578       11.10176 
1 1 1 -5  30 25 o 15.26103 5.859661 2.049614       3.059903 -6.139582      6.675643 4.227822       3.442882 15.21011 7.133518 18.79402 6.340712 -3.583911      9.544197 
1 1 1 -5  30 26 o 45.83552 3.773592 26.17940       4.177658 29.17668       7.586122 24.87477       5.004951 47.31490 6.772295 44.40092 4.696754 2.913982       8.241571 
1 1 1 -5  30 27 o 32.39347 4.512869 13.36337       3.465846 11.21529       6.968227 14.06945       3.995056 28.64874 8.976507 33.05680 5.125177 -4.408068      10.33659 
1 1 1 -5  30 28 o 61.80188 3.111187 47.37297       4.670516 49.72963       8.775516 46.44161       5.516757 61.96043 5.882420 60.95518 3.731845 1.005249       6.966314 
1 1 1 -5  30 29 o 20.49178 5.933530 5.599729       3.132478 7.958146       6.703895 4.940978       3.543051 24.60785 8.814248 19.56756 6.427914 5.040291       10.90913 
1 1 1 -5  30 30 f 18.13411 5.959176 4.257976       3.045048 7.384203       6.200170 3.264230       3.495676 23.49677 8.469139 17.03052 6.323432 6.466251       10.56940 
1 1 1 -5  30 31 o 15.06154 5.910933 2.133123       3.166456 4.897829       5.996350 1.064075       3.728732 20.64205 8.124133 14.66028 6.160596 5.981773       10.19581 
1 1 1 -5  30 32 o 37.66010 5.890162 19.53758       5.228628 13.38294       9.405462 22.29032       6.290155 28.08761 10.38276 39.58038 6.764269 -11.49277      12.39182 
1 1 1 -5  30 33 o 37.45523 4.887761 18.89618       4.354943 14.20955       6.115753 23.71718       6.202809 29.88572 8.166718 40.66434 6.476517 -10.77862      10.42308 
1 1 1 -5  30 34 o 66.74527 3.680761 57.65661       5.963613 49.50334       8.362536 66.09394       8.506963 59.24735 5.869109 69.73421 5.040026 -10.48687      7.736168 
1 1 1 -5  30 35 o 71.67111 3.430211 66.43333       5.973633 54.82568       13.03881 69.51694       6.720413 54.36204 10.21753 72.84544 3.798926 -18.48340      10.90090 
1 1 1 -5  30 36 o 26.47102 6.050931 10.64067       3.817917 11.35248       6.321186 10.23188       4.790397 24.60037 8.581844 24.64444 7.391679 -0.4406738E-01 11.32630 
1 1 1 -5  30 37 o 31.50745 5.950897 15.20224       4.401693 18.03798       7.115729 13.44459       5.602136 29.90603 9.017588 27.06651 7.962780 2.839527       12.03008 
1 1 1 -5  30 38 o 40.16319 4.762349 23.21808       4.570457 21.97850       7.217003 24.04812       5.905637 33.05861 8.802529 38.49655 6.528187 -5.437939      10.95909 
1 1 1 -5  30 39 o 36.52676 5.680894 20.80425       4.892358 31.22393       10.68845 18.04262       5.502632 32.25513 11.16470 31.75330 7.268561 0.5018311      13.32225 
1 1 1 -5  31 1  o 155.2211 3.087188 294.2440       11.67750 292.7514       17.56183 295.4270       15.63463 154.5291 4.668980 155.3370 4.133928 -0.8079376     6.236083 
1 1 1 -5  31 2  o 91.79330 3.436595 103.1020       7.673756 114.5493       14.79271 98.88726       8.975945 96.29176 6.339355 89.81194 4.112102 6.479820       7.556242 
1 1 1 -5  31 3  o 161.1851 3.117538 317.3047       12.24539 283.2458       17.78497 348.0048       16.88524 151.9684 4.808512 168.6568 4.108348 -16.68843      6.324579 
1 1 1 -5  31 4  o 81.74114 3.514655 81.80655       6.984632 73.51588       12.51960 85.55311       8.416121 76.96568 6.743144 83.51760 4.148195 -6.551918      7.916913 
1 1 1 -5  31 5  o 115.7880 3.293746 163.9241       9.284284 128.9691       15.91244 181.9655       11.43186 102.1676 6.423787 121.9224 3.852500 -19.75480      7.490447 
1 1 1 -5  31 6  o 177.4132 3.622337 384.7736       15.66069 363.6926       29.00739 393.4461       18.60519 171.5959 6.951292 179.2892 4.258375 -7.693268      8.151945 
1 1 1 -5  31 7  o 39.94224 4.145394 19.73129       3.976307 22.72511       5.715442 16.92294       5.535566 42.65344 5.636521 36.55036 6.450643 6.103081       8.566280 
1 1 1 -5  31 8  o 106.2980 3.200027 138.1697       8.279806 144.4410       11.51032 131.4448       11.91921 108.5215 4.361349 103.4534 4.740481 5.068100       6.441546 
1 1 1 -5  31 9  o 48.53549 3.605278 28.96106       4.233716 24.99772       5.877294 33.23589       6.103889 44.78375 5.500852 51.83421 4.890095 -7.050457      7.360190 
1 1 1 -5  31 10 o 97.51508 3.378869 116.3755       8.017199 117.9946       16.29529 115.8584       9.208840 97.52053 6.901517 97.22783 3.894556 0.2927017      7.924551 
1 1 1 -5  31 11 o 99.64978 3.355571 121.5248       8.136899 142.1306       17.32854 115.6963       9.216134 107.1138 6.671791 97.15241 3.900703 9.961342       7.728407 
1 1 1 -5  31 12 o 205.8058 4.481113 519.2109       22.47397 546.9744       40.57524 506.9239       26.99271 209.7422 7.952923 202.9884 5.461778 6.753799       9.647798 
1 1 1 -5  31 13 o 165.7766 3.545919 336.1830       14.32479 308.4137       28.10812 345.9259       16.64912 157.5991 7.338988 168.0570 4.065358 -10.45787      8.389749 
1 1 1 -5  31 14 o 215.0719 3.983110 566.6239       20.87575 562.4514       42.30603 567.9669       24.00129 212.3115 8.192349 215.1427 4.577960 -2.831192      9.384685 
1 1 1 -5  31 15 o 143.2660 3.398901 251.1439       11.86637 230.8388       23.78990 257.8690       13.69115 136.1808 7.194224 145.0288 3.877390 -8.847946      8.172577 
1 1 1 -5  31 16 o 146.5871 3.402140 263.0114       12.15301 259.4453       25.27846 264.0834       13.85987 144.2807 7.212494 146.7352 3.879446 -2.454514      8.189638 
1 1 1 -5  31 17 o 132.6163 3.322844 215.4365       10.73002 206.7627       22.45653 218.0027       12.21456 128.6603 7.191069 133.3040 3.763861 -4.643661      8.116534 
1 1 1 -5  31 18 o 105.4156 2.993819 136.0811       7.682926 132.6281       13.56656 137.7113       9.321790 103.4860 5.398293 105.9243 3.616639 -2.438316      6.497819 
1 1 1 -5  31 19 o 77.96739 3.153556 74.57697       5.979331 90.00473       11.56898 68.95370       6.984540 85.06634 5.612216 74.83975 3.842605 10.22659       6.801661 
1 1 1 -5  31 20 o 89.05403 3.326184 97.40012       7.205631 116.5891       19.43207 94.34098       7.758767 95.49059 8.437411 87.57300 3.643646 7.917595       9.190542 
1 1 1 -5  31 21 o 17.81573 6.404700 3.402973       3.543162 -8.433297      6.883193 7.669889       4.132754 14.65885 6.983357 24.33709 6.738413 -9.678243      9.704303 
1 1 1 -5  31 22 o 54.17901 3.444391 36.24046       4.524026 36.60921       8.539957 36.09660       5.333962 53.50958 6.695336 53.92710 4.089369 -0.4175148     7.845411 
1 1 1 -5  31 23 o 26.62797 6.010396 9.252870       3.807308 18.19038       10.39375 7.867768       4.091707 36.30394 10.88768 24.51403 6.672243 11.78990       12.76951 
1 1 1 -5  31 24 o 45.17530 3.743294 25.39564       4.083927 24.03119       7.858245 25.90052       4.780162 42.48690 7.879944 45.45627 4.369060 -2.969364      9.010117 
1 1 1 -5  31 25 f 68.95183 3.360083 58.86858       5.628884 55.19117       9.524191 60.84256       6.977972 65.61217 6.023897 69.82380 4.119302 -4.211624      7.297669 
1 1 1 -5  31 26 o 28.84446 4.952600 10.75941       3.355865 25.89427       7.215923 6.582598       3.790751 44.17326 6.931335 22.30347 6.547077 21.86979       9.534549 
1 1 1 -5  31 27 o 72.25297 2.976785 64.66996       5.230078 58.32815       9.364533 67.54483       6.305056 67.10336 5.783085 73.60304 3.525507 -6.499680      6.772981 
1 1 1 -5  31 28 o 14.97648 5.776643 2.118101       2.983345 -1.818506      6.514430 3.162819       3.355945 16.70534 7.539816 16.84218 6.206186 -0.1368389     9.765530 
1 1 1 -5  31 29 f 21.59414 5.890946 6.361176       3.185309 1.548279       6.573077 7.838303       3.641450 18.69075 8.027660 23.84899 6.206711 -5.158247      10.14725 
1 1 1 -5  31 30 o 13.47511 5.604999 0.9854720      3.039636 1.932566       5.946080 0.6504127      3.536673 18.06724 7.694231 13.93119 5.933451 4.136048       9.716328 
1 1 1 -5  31 31 f 21.01660 7.151596 6.272253       4.380398 8.686849       8.066927 5.262586       5.216448 24.17889 9.450641 20.12910 7.670053 4.049789       12.17146 
1 1 1 -5  31 32 o 18.36742 6.724873 4.515707       3.930172 5.187799       5.644095 3.883068       5.475926 19.93837 7.871185 18.65427 7.616339 1.284100       10.95282 
1 1 1 -5  31 33 o 20.91084 6.284519 6.456640       3.460223 17.24827       6.159288 1.480085       4.182649 32.99196 7.787084 15.13374 6.449348 17.85822       10.11102 
1 1 1 -5  31 34 o 18.63624 6.259633 5.116444       3.355532 0.1604529      5.982867 7.390837       4.053003 15.84807 7.182141 21.76469 6.849691 -5.916621      9.924788 
1 1 1 -5  31 35 o 25.76632 6.093015 10.12480       3.765260 8.022294       6.048216 11.45527       4.811296 21.38661 8.231344 26.28067 7.268288 -4.894066      10.98103 
1 1 1 -5  31 36 o 25.05463 6.380210 10.06013       3.905340 4.698120       5.630079 15.03272       5.421778 17.90903 7.550459 29.42476 7.530612 -11.51573      10.66394 
1 1 1 -5  31 37 o 12.38017 5.465249 0.5726082      3.228950 0.3122510      5.622347 0.7007440      3.944283 14.64374 6.757637 13.33770 5.955168 1.306037       9.007202 
1 1 1 -5  31 38 o 11.39709 5.257830 -0.7883782     3.399954 0.1535051      8.250141 -0.9810663     3.731560 15.84484 7.575037 11.72405 5.443358 4.120791       9.327986 
1 1 1 -5  32 1  o 37.48061 4.655589 17.48122       4.160855 20.74943       5.729394 13.83392       6.052571 40.64514 5.961600 32.77833 7.707721 7.866806       9.744210 
1 1 1 -5  32 2  o 39.94111 4.377470 19.77323       4.190966 19.62214       5.856278 19.93185       6.000184 39.43460 6.306465 39.72908 6.416107 -0.2944794     8.996551 
1 1 1 -5  32 3  o 102.1196 2.946970 127.4824       7.325990 118.4742       10.58410 135.7677       10.15052 98.23574 4.432703 105.2511 3.964631 -7.015350      5.947029 
1 1 1 -5  32 4  o 69.22954 3.589709 58.76672       6.035328 48.25511       9.991802 64.80492       7.572908 62.19017 6.698562 72.61309 4.298923 -10.42292      7.959363 
1 1 1 -5  32 5  o 114.2826 2.948034 159.6385       8.203250 169.0730       12.57288 152.6452       10.82471 117.3888 4.402936 111.6028 3.986603 5.786003       5.939600 
1 1 1 -5  32 6  o 57.64821 3.467674 40.78006       4.848951 41.34441       6.886022 40.22497       6.829235 57.84104 4.932371 57.04207 4.962265 0.7989655      6.996595 
1 1 1 -5  32 7  o 60.26388 3.310705 44.52711       4.843307 48.36948       6.965140 40.92979       6.739380 62.64514 4.594492 57.55832 4.849884 5.086826       6.680624 
1 1 1 -5  32 8  o 47.30157 3.648466 27.53261       4.173063 23.00865       5.893632 32.08114       5.909606 42.86241 5.790454 50.91037 4.820820 -8.047958      7.534565 
1 1 1 -5  32 9  o 36.93807 4.547617 16.97980       4.007182 15.74257       5.596048 18.28184       5.740746 35.11896 6.784474 37.98677 6.430761 -2.867809      9.347929 
1 1 1 -5  32 10 f 70.90746 4.219495 61.83202       7.258053 66.36024       13.16427 59.85435       8.699807 72.76112 7.533245 69.59892 5.166295 3.162209       9.134571 
1 1 1 -5  32 11 o 189.8977 4.334672 442.2430       20.05913 439.9619       35.06062 443.3531       24.45743 187.9711 7.670182 189.7633 5.294039 -1.792191      9.319793 
1 1 1 -5  32 12 o 66.09610 3.691991 53.65982       5.923019 57.54507       11.66761 52.31097       6.874718 67.73004 7.178249 65.15479 4.354848 2.575249       8.395949 
1 1 1 -5  32 13 o 35.31248 5.399342 15.70559       4.498908 25.22143       10.06748 13.33113       5.028981 43.90556 9.671201 32.23621 6.623441 11.66935       11.72186 
1 1 1 -5  32 14 o 89.25556 3.374255 97.66425       7.325993 89.47218       14.90577 100.2734       8.412126 84.46445 7.313763 90.36293 3.828818 -5.898483      8.255360 
1 1 1 -5  32 15 o 130.8808 3.331828 209.8897       10.61796 195.2632       21.59650 214.5523       12.19346 124.9907 7.119831 132.2197 3.788284 -7.229027      8.064929 
1 1 1 -5  32 16 o 109.2066 3.321024 146.2314       8.827792 138.7385       18.32064 148.4971       10.07447 105.1551 7.192787 109.9519 3.765515 -4.796829      8.118823 
1 1 1 -5  32 17 o 90.98314 3.277446 101.5781       7.254749 92.31597       15.37389 104.2314       8.228524 85.47099 7.455784 92.08245 3.674361 -6.611458      8.312018 
1 1 1 -5  32 18 o 119.0063 3.364871 173.8747       9.748509 160.9299       21.26490 177.3191       10.96904 112.6427 7.794908 120.0698 3.753465 -7.427124      8.651537 
1 1 1 -5  32 19 f 91.00632 3.375722 101.8352       7.473449 95.57310       18.30881 103.0872       8.186514 85.90391 8.873607 91.48723 3.679504 -5.583321      9.606230 
1 1 1 -5  32 20 o 12.48142 5.591811 -1.450765      3.509362 -2.602058      7.063153 -1.073390      4.043819 17.66145 7.921182 13.83495 6.111403 3.826505       10.00472 
1 1 1 -5  32 21 o 46.51201 3.871598 26.88173       4.348496 34.91643       8.495990 24.02976       5.061763 52.07957 6.861113 43.71556 4.832043 8.364010       8.391871 
1 1 1 -5  32 22 o 45.91702 3.831394 26.24000       4.248091 29.15616       8.108571 25.13679       4.987317 47.21724 7.280814 44.71460 4.644592 2.502636       8.636115 
1 1 1 -5  32 23 o 33.54402 4.842952 14.34635       3.844290 14.29251       7.172318 14.36805       4.553635 32.25068 8.856626 33.25719 5.831200 -1.006516      10.60390 
1 1 1 -5  32 24 o 19.41942 6.348678 4.732571       3.458039 4.630781       6.237578 4.777738       4.155007 21.56344 8.343286 19.95923 6.958053 1.604212       10.86393 
1 1 1 -5  32 25 o 19.15382 6.417112 4.582528       3.526696 1.015271       10.06465 5.081832       3.765429 22.38256 9.771457 20.02019 6.628814 2.362366       11.80773 
1 1 1 -5  32 26 o 45.33847 3.684952 25.82047       4.036245 14.99731       7.202354 30.77577       4.873410 32.24983 8.882577 49.35839 4.088328 -17.10856      9.778272 
1 1 1 -5  32 27 o 15.66715 5.932581 2.535092       3.108876 4.008530       6.097939 2.017611       3.613801 20.30853 8.127788 15.67894 6.263012 4.629580       10.26091 
1 1 1 -5  32 28 o 34.00830 4.407158 14.98714       3.566603 17.01106       7.069204 14.29604       4.130900 33.75842 8.577229 32.75247 5.360945 1.005951       10.11477 
1 1 1 -5  32 29 o 33.42067 5.507491 15.11986       4.329333 13.77154       6.279471 16.34138       5.976930 30.07248 8.298334 33.41580 7.521870 -3.343323      11.20004 
1 1 1 -5  32 30 o 18.71461 7.020501 4.479756       4.330904 1.596773       8.026894 5.663690       5.143872 19.26674 8.555408 20.44022 7.654569 -1.173475      11.47987 
1 1 1 -5  32 31 o 34.01653 4.491187 15.42517       3.632079 11.97662       6.168674 17.25511       4.493573 27.08685 8.439631 35.38006 5.381270 -8.293203      10.00927 
1 1 1 -5  32 32 o 20.49943 6.191596 6.187979       3.352610 2.939952       5.845856 7.779839       4.092520 17.84216 7.614686 22.57115 6.845784 -4.728985      10.23954 
1 1 1 -5  32 33 o 41.43063 4.583914 23.35422       4.550691 23.15916       6.921881 23.50270       6.039319 37.85809 7.763687 39.65292 6.473063 -1.794834      10.10818 
1 1 1 -5  32 34 o 16.59652 6.429750 3.760748       3.708062 -1.149983      5.999247 6.796605       4.716982 14.80641 6.883825 20.32112 7.378414 -5.514709      10.09099 
1 1 1 -5  32 35 o 12.90882 5.830046 -0.5171059E-01 3.902249 7.650783       6.168806 -5.190012      5.038430 20.40353 8.171799 11.66173 5.660079 8.741801       9.940563 
1 1 1 -5  32 36 o 28.81093 5.556890 12.63260       3.760057 17.63794       6.916871 10.53305       4.479777 29.06688 8.916492 24.48558 7.097447 4.581299       11.39638 
1 1 1 -5  32 37 o 23.50302 6.660118 9.580066       3.987957 12.25543       9.270922 8.972631       4.417547 21.39064 9.357454 22.02602 7.173959 -0.6353817     11.79100 
1 1 1 -5  33 1  o 41.71107 5.223765 21.71568       5.193597 28.41538       9.521164 18.87780       6.196690 47.02218 8.626863 38.50945 6.854511 8.512726       11.01849 
1 1 1 -5  33 2  o 133.4343 3.410667 217.9229       11.08120 217.6753       20.63773 218.0231       13.13528 132.6074 6.405372 133.3426 4.047037 -0.7352142     7.576760 
1 1 1 -5  33 3  o 53.26560 3.644450 34.88401       4.702085 27.67423       6.664885 42.02868       6.634722 47.01951 5.949713 58.32964 4.707601 -11.31012      7.586870 
1 1 1 -5  33 4  o 132.8492 3.023386 215.7091       9.787877 188.7609       14.07018 240.9785       13.62486 123.9236 4.667520 140.1983 3.992048 -16.27462      6.141840 
1 1 1 -5  33 5  f 32.87594 5.124684 13.59603       3.971829 7.498477       5.523015 20.12710       5.715983 24.84097 8.016113 39.95734 6.060180 -15.11638      10.04907 
1 1 1 -5  33 6  o 134.0905 3.008569 219.7797       9.830922 214.7175       14.69065 223.8851       13.22986 132.1860 4.567436 135.1091 4.022708 -2.923080      6.086349 
1 1 1 -5  33 7  o 47.36316 3.820267 27.65285       4.371926 23.50081       6.017962 32.29325       6.362052 43.27212 5.857216 50.97752 5.193792 -7.705399      7.828310 
1 1 1 -5  33 8  o 49.75762 3.644884 30.47610       4.388901 26.47092       5.990359 35.11754       6.448632 46.04685 5.443603 53.20386 5.033655 -7.157009      7.414208 
1 1 1 -5  33 9  o 31.85510 5.854293 12.90912       4.377118 12.75095       5.651938 13.14613       6.918808 31.39728 7.491789 31.85983 8.678253 -0.4625492     11.46468 
1 1 1 -5  33 10 o 62.39782 3.920617 47.91990       5.931427 37.74288       11.27683 51.81234       6.974092 54.17015 8.847752 64.80272 4.443184 -10.63256      9.900737 
1 1 1 -5  33 11 o 50.45032 4.279496 31.47333       5.211699 36.66227       11.07368 29.99696       5.906771 53.33791 8.828169 49.10978 5.005571 4.228134       10.14851 
1 1 1 -5  33 12 o 155.2018 3.514667 295.1399       13.29282 276.8636       26.20070 301.4748       15.42551 148.8136 7.246725 156.6664 4.043811 -7.852768      8.298640 
1 1 1 -5  33 13 o 29.17512 6.494106 10.98499       4.498274 -0.1151575     8.837605 14.86628       5.225865 21.59763 9.292674 34.03582 6.538223 -12.43819      11.36231 
1 1 1 -5  33 14 o 78.10035 3.406623 74.91483       6.467959 75.44056       12.91499 74.73882       7.472597 77.43174 6.917224 77.90250 3.949145 -0.4707642     7.965158 
1 1 1 -5  33 15 o 82.09823 3.416384 82.81561       6.820032 88.15680       14.72509 81.35693       7.695154 83.49733 7.310518 81.26863 3.896958 2.228699       8.284320 
1 1 1 -5  33 16 f 33.02042 5.751165 13.93099       4.459725 11.25312       9.622199 14.66362       5.032948 30.44522 10.59016 33.74774 6.352914 -3.302526      12.34953 
1 1 1 -5  33 17 o 44.07080 5.115610 24.40667       5.391993 0.000000       0.000000 24.40667       5.391993 ?        ?        44.07080 5.115610 0.000000       5.115610 
1 1 1 -5  33 18 o 66.95370 3.540255 55.30865       5.755711 43.07782       12.11380 58.87492       6.541234 57.10649 9.002633 68.99235 3.906617 -11.88585      9.813718 
1 1 1 -5  33 19 o 78.53934 3.404964 76.06252       6.501339 74.11929       13.98458 76.59830       7.343104 75.72694 7.684432 78.68920 3.840984 -2.962265      8.590905 
1 1 1 -5  33 20 f 60.57935 3.407176 45.36948       5.009582 44.54126       9.008593 45.74025       6.027489 58.98241 6.368405 60.63180 4.103610 -1.649384      7.576028 
1 1 1 -5  33 21 o 40.66052 4.130992 20.73254       4.036443 19.33603       7.337499 21.33854       4.833536 37.79055 8.203447 41.01456 4.935091 -3.224010      9.573488 
1 1 1 -5  33 22 o 54.22400 3.834683 36.67764       5.034388 39.26783       8.559939 35.30789       6.224793 54.95982 6.518064 52.81455 4.892139 2.145264       8.149736 
1 1 1 -5  33 23 o 24.21266 6.065311 7.814939       3.570813 14.32660       6.961297 5.489799       4.159764 31.95515 8.705126 20.83775 6.969126 11.11740       11.15114 
1 1 1 -5  33 24 o 41.52250 3.928316 21.73879       3.927637 20.34140       7.182163 22.33498       4.691262 38.28178 7.958773 41.80314 4.685705 -3.521366      9.235686 
1 1 1 -5  33 25 o 52.49279 3.468050 34.51957       4.411446 35.20577       7.889447 34.20743       5.321013 51.36364 6.444600 51.90443 4.243835 -0.5407829     7.716412 
1 1 1 -5  33 26 o 46.36728 4.108920 27.40868       4.594737 0.5474002      10.17359 34.29158       5.149876 21.43350 9.567405 51.90051 4.105236 -30.46702      10.41096 
1 1 1 -5  33 27 o 28.05218 5.387890 10.61414       3.549327 9.880672       6.337782 10.94929       4.284172 25.81918 8.601565 27.98726 6.418567 -2.168081      10.73242 
1 1 1 -5  33 28 o 13.39467 5.940400 -0.4496816     3.857717 -2.667213      5.968341 1.141576       5.055789 15.02970 6.945233 16.32895 7.027202 -1.299252      9.880174 
1 1 1 -5  33 29 o 16.01726 6.701259 1.914416       4.382221 1.926779       8.253765 1.909562       5.171300 19.50373 8.667209 16.85624 7.176880 2.647495       11.25292 
1 1 1 -5  33 30 o 15.07607 6.234236 1.861728       3.729692 -1.359761      5.670302 4.318341       4.951608 15.02570 6.879515 18.63818 7.367950 -3.612477      10.08040 
1 1 1 -5  33 31 o 26.73303 5.538296 10.18554       3.489216 6.403862       6.108754 12.01674       4.250877 20.77277 8.192442 28.52520 6.285115 -7.752428      10.32564 
1 1 1 -5  33 32 o 18.30562 6.718277 4.893660       3.926128 6.482048       6.079684 3.757401       5.142109 20.39096 8.130717 17.64840 7.311070 2.742558       10.93436 
1 1 1 -5  33 33 o 12.25248 5.701138 -1.751362      4.128159 -4.392394      5.819181 0.9242924      5.857200 13.11651 6.294898 15.79191 7.136405 -2.675391      9.515987 
1 1 1 -5  33 34 o 33.67073 5.458102 16.78291       4.325281 17.48569       6.678621 16.27520       5.676561 30.06876 8.650949 30.49053 7.652706 -0.4217644     11.55001 
1 1 1 -5  33 35 o 10.71500 4.991421 -1.466818      3.178577 -1.375492      6.185923 -1.499582      3.705129 14.30468 6.757481 11.51248 5.371597 2.792197       8.632358 
1 1 1 -5  33 36 o 12.87902 5.677186 0.9349855      3.472249 1.085026       8.777239 0.9071481      3.780659 16.49523 7.865911 13.18897 5.863182 3.306259       9.810681 
1 1 1 -5  34 1  o 75.08793 3.181145 69.10947       5.807705 69.17758       8.599710 69.05235       7.874758 74.85507 4.738723 74.86676 4.334842 -0.1168823E-01 6.422332 
1 1 1 -5  34 2  o 177.7766 3.695979 387.2680       16.01180 401.4876       22.22171 371.9135       23.09154 180.4992 5.057015 173.5537 5.466694 6.945480       7.447022 
1 1 1 -5  34 3  f 45.60216 3.971315 25.69376       4.369248 19.31302       5.919104 33.33296       6.476557 38.98571 6.456143 51.76048 5.205235 -12.77478      8.293145 
1 1 1 -5  34 4  o 90.68620 3.022589 100.7008       6.670358 100.5368       9.798152 100.8424       9.106409 90.35037 4.464008 90.55584 4.137554 -0.2054672     6.086601 
1 1 1 -5  34 5  o 79.26370 3.086398 76.97909       5.950201 69.94253       8.508471 83.71426       8.324263 75.27507 4.661224 82.48218 4.154802 -7.207108      6.244149 
1 1 1 -5  34 6  o 63.67297 3.306436 49.76731       5.112825 54.20879       7.530753 45.96948       6.963742 66.21970 4.697246 60.94783 4.725547 5.271862       6.662951 
1 1 1 -5  34 7  o 108.2161 3.280359 143.5131       8.640674 139.9013       11.55856 148.0884       13.00917 106.5845 4.459997 109.5493 4.885373 -2.964821      6.615016 
1 1 1 -5  34 8  o 15.11789 6.313860 0.6091278      3.879971 3.642048       4.901582 -4.480206      6.349453 19.76782 7.457293 15.72636 7.229692 4.041465       10.38651 
1 1 1 -5  34 9  o 86.36537 2.928078 91.36990       6.153609 82.55224       8.805965 99.78504       8.602632 81.80080 4.434145 90.07139 3.928749 -8.270584      5.924248 
1 1 1 -5  34 10 o 42.24496 4.883539 22.29401       4.934964 20.38986       9.346652 23.03002       5.810974 39.20130 9.808891 42.75565 5.720662 -3.554352      11.35519 
1 1 1 -5  34 11 o 70.27298 3.610301 60.75747       6.161829 49.31231       11.31763 65.57937       7.346038 62.21328 7.624293 72.90418 4.152064 -10.69090      8.681560 
1 1 1 -5  34 12 o 69.85314 3.735333 60.10728       6.335329 53.40662       12.44174 62.45282       7.361112 64.53464 8.088563 71.09007 4.268779 -6.555428      9.145891 
1 1 1 -5  34 13 o 39.12770 4.799184 19.19687       4.480306 35.51766       9.651080 14.71338       5.058403 52.48929 7.780380 33.79919 6.375161 18.69010       10.05868 
1 1 1 -5  34 14 o 41.67636 4.700121 21.74639       4.690317 17.40654       9.613521 23.10213       5.373219 35.97068 10.38840 42.83228 5.258047 -6.861607      11.64328 
1 1 1 -5  34 15 o 20.25069 6.788205 4.914590       3.946322 6.477731       7.499660 4.316050       4.640762 24.79363 9.251163 20.09838 7.315467 4.695259       11.79407 
1 1 1 -5  34 16 f 90.55981 3.782496 101.2816       8.328999 0.000000       0.000000 101.2816       8.328999 ?        ?        90.55981 3.782496 0.000000       3.782496 
1 1 1 -5  34 17 f 48.29361 4.030260 29.03032       4.699860 36.54030       10.28445 27.04796       5.283868 52.61403 8.295778 46.41536 4.737851 6.198669       9.553385 
1 1 1 -5  34 18 f 80.70675 3.404604 80.44478       6.680914 86.71525       14.58452 78.77956       7.515853 81.82232 7.394213 79.70553 3.881157 2.116791       8.350914 
1 1 1 -5  34 19 o 63.17623 3.534859 49.48010       5.420341 50.26893       11.79807 49.26906       6.102502 61.56243 8.057492 62.88949 4.002704 -1.327065      8.996934 
1 1 1 -5  34 20 o 38.11759 4.758391 18.47546       4.323992 10.62201       9.001819 20.83101       4.929993 28.63158 10.21854 40.37866 5.125570 -11.74708      11.43197 
1 1 1 -5  34 21 o 76.87729 3.439286 73.40416       6.426899 72.16660       10.14536 74.23367       8.306087 75.07540 5.585427 76.82117 4.456024 -1.745766      7.145149 
1 1 1 -5  34 22 o 12.86552 5.581400 -0.1875348     3.240539 -11.12298      5.737264 4.935534       3.926917 11.65310 5.735805 19.86551 6.771091 -8.212404      8.873958 
1 1 1 -5  34 23 o 43.35109 3.901677 23.73923       4.077751 32.89086       7.460707 19.84076       4.869435 49.79854 6.287817 39.04079 5.251324 10.75775       8.192255 
1 1 1 -5  34 24 o 34.79193 4.743731 15.71850       3.917284 16.12631       7.106125 15.54047       4.695085 33.10138 8.697823 34.06138 5.868240 -0.9600067     10.49230 
1 1 1 -5  34 25 o 24.98004 6.887002 8.808904       4.327305 7.313748       6.597025 9.938060       5.733001 23.36670 8.684786 26.10475 8.136535 -2.738049      11.90079 
1 1 1 -5  34 26 o 18.77709 6.732250 4.532787       3.911922 3.295213       5.795551 5.568525       5.301931 18.94536 7.796458 20.74696 7.770903 -1.801600      11.00780 
1 1 1 -5  34 27 o 12.00650 5.553788 -2.227024      3.830535 -4.122979      5.877322 -0.8269501     5.050576 14.10180 6.638669 14.81547 6.667070 -0.7136726     9.408600 
1 1 1 -5  34 28 o 21.15667 6.619312 6.514851       3.790493 -1.450415      7.925687 8.877013       4.316102 17.43804 8.038585 24.38465 6.935016 -6.946608      10.61665 
1 1 1 -5  34 29 o 31.02415 5.974236 13.77600       4.352814 14.08191       6.269269 13.49128       6.048294 29.24771 8.371245 28.75431 8.219942 0.4934063      11.73223 
1 1 1 -5  34 30 o 14.56466 5.870021 2.111479       3.204340 2.997383       5.641932 1.689644       3.893191 17.60906 7.496842 14.89692 6.279519 2.712139       9.779315 
1 1 1 -5  34 31 o 15.45042 6.016938 2.934672       3.260272 -2.748511      5.714432 5.677360       3.969771 13.89001 6.541150 19.25978 6.794540 -5.369770      9.431459 
1 1 1 -5  34 32 o 26.39843 7.238487 11.65000       4.795074 14.94868       6.483272 7.666523       7.124511 28.16430 8.631161 20.79907 8.610036 7.365227       12.19138 
1 1 1 -5  34 33 o 18.25570 6.648578 5.349382       3.833986 14.25746       6.192505 -0.1879034     4.882281 27.09872 8.457862 13.91107 6.374578 13.18764       10.59107 
1 1 1 -5  34 34 o 34.85253 5.113974 17.85013       4.214261 14.89139       9.500508 18.57492       4.702191 23.56993 9.864444 34.82889 5.739970 -11.25895      11.41291 
1 1 1 -5  34 35 o 11.63525 5.301688 -0.3641983     3.315426 -1.327014      7.983263 -0.1635304     3.644583 15.32415 7.359263 12.22749 5.566543 3.096656       9.227413 
1 1 1 -5  35 1  o 34.50306 5.882931 15.16373       4.769122 12.16134       8.414715 16.58454       5.788591 30.93975 9.885876 35.87888 6.870720 -4.939131      12.03899 
1 1 1 -5  35 2  o 85.07768 3.537140 88.93673       7.317382 99.16281       13.54518 84.72250       8.695397 89.06697 6.280959 82.86258 4.321138 6.204391       7.623823 
1 1 1 -5  35 3  o 82.22089 3.546223 83.08067       7.088626 82.48752       12.94575 83.33467       8.471478 81.07833 6.609481 82.19553 4.243730 -1.117203      7.854584 
1 1 1 -5  35 4  o 67.67394 3.695421 56.38169       6.071140 59.18060       7.891502 52.32285       9.503140 69.11959 4.713340 64.60484 6.108782 4.514755       7.715750 
1 1 1 -5  35 5  o 92.09115 3.348632 104.1139       7.502357 91.77572       9.620819 123.2582       11.98415 86.16376 4.598617 99.78380 4.943855 -13.62004      6.751961 
1 1 1 -5  35 6  o 39.77976 4.679309 19.77976       4.449414 25.12716       5.653756 11.07933       7.211675 44.76118 5.285011 29.40974 9.119162 15.35144       10.53995 
1 1 1 -5  35 7  o 83.52293 3.067322 85.58572       6.232509 84.68435       9.109459 86.37898       8.545722 82.74652 4.534926 83.65920 4.205269 -0.9126816     6.184646 
1 1 1 -5  35 8  o 84.51687 3.018247 87.63403       6.206353 85.19197       9.000616 89.84774       8.569466 82.99174 4.466882 85.32574 4.133630 -2.334007      6.086044 
1 1 1 -5  35 9  o 69.31272 3.179224 59.04333       5.355649 56.28756       7.799833 61.50159       7.366770 67.30556 4.786761 70.49474 4.308875 -3.189178      6.440456 
1 1 1 -5  35 10 o 103.5572 3.382536 131.8337       8.524633 128.7693       16.77145 132.9012       9.898662 100.9704 6.856847 103.8191 3.919616 -2.848709      7.898085 
1 1 1 -5  35 11 o 84.81741 3.448317 88.55792       7.112493 77.67114       13.65528 92.61105       8.331938 78.05456 7.262358 86.60079 3.958568 -8.546234      8.271161 
1 1 1 -5  35 12 o 43.81898 4.672639 24.04759       4.912652 37.54940       10.35646 20.12739       5.580449 53.61669 8.185416 39.69823 5.951709 13.91846       10.12047 
1 1 1 -5  35 13 o 68.30605 3.616118 57.62558       5.997742 60.83022       12.36705 56.64003       6.858273 68.70782 7.508323 67.56337 4.186062 1.144447       8.596396 
1 1 1 -5  35 14 o 65.69041 4.190363 53.61983       6.672976 0.000000       0.000000 53.61983       6.672976 ?        ?        65.69041 4.190363 0.000000       4.190363 
1 1 1 -5  35 15 o 59.93970 4.357979 44.82141       6.322065 0.000000       0.000000 44.82141       6.322065 ?        ?        59.93970 4.357979 0.000000       4.357979 
1 1 1 -5  35 16 o 68.86864 3.555554 58.73777       5.946920 73.02103       12.28010 54.36180       6.797125 75.29457 6.764746 66.01801 4.247538 9.276558       7.987701 
1 1 1 -5  35 17 o 25.87474 6.641392 8.906316       4.208506 8.626185       8.974066 8.985292       4.764969 27.06400 10.11546 25.93660 7.255807 1.127394       12.44867 
1 1 1 -5  35 18 o 18.05023 6.786801 3.335921       4.052342 11.81221       8.820216 1.067998       4.562370 29.56080 10.14588 16.34666 6.838240 13.21415       12.23521 
1 1 1 -5  35 19 o 19.94691 6.769629 4.942252       3.924685 7.646391       8.335208 4.171949       4.448697 25.53405 9.703566 19.37498 7.144469 6.159073       12.05001 
1 1 1 -5  35 20 o 15.78913 6.428249 1.630038       3.887414 3.051386       7.539246 1.115293       4.537051 21.20990 8.825219 16.22435 6.805323 4.985548       11.14437 
1 1 1 -5  35 21 f 26.45313 6.271339 9.491761       3.980811 6.606518       8.380547 10.33245       4.523739 24.26912 9.588068 27.42903 6.801541 -3.159916      11.75551 
1 1 1 -5  35 22 o 43.96986 5.069753 25.13506       5.332888 21.00376       8.612017 27.70450       6.791729 37.39693 9.448183 45.45123 6.301228 -8.054302      11.35666 
1 1 1 -5  35 23 o 15.07655 6.377866 0.9385971      4.039412 3.512828       6.014925 -1.176112      5.451698 19.61517 7.992288 15.48030 6.949755 4.134865       10.59131 
1 1 1 -5  35 24 o 51.46006 4.284403 34.13247       5.324055 23.10140       7.568182 44.94000       7.491110 39.56984 8.120970 58.24878 5.336682 -18.67895      9.717526 
1 1 1 -5  35 25 o 77.25116 3.121956 75.10750       5.865058 70.35756       9.875144 77.69612       7.290104 72.20127 5.657735 77.93173 3.850616 -5.730461      6.843772 
1 1 1 -5  35 26 o 48.62461 4.086424 30.72070       4.797362 28.86190       10.29159 31.23673       5.422531 40.73223 10.34911 48.61067 4.633549 -7.878445      11.33904 
1 1 1 -5  35 27 o 29.66433 5.326215 12.17238       3.708762 15.48553       6.408735 10.50410       4.547630 31.02976 8.309729 26.42822 6.964570 4.601538       10.84236 
1 1 1 -5  35 28 o 35.62158 4.641287 17.13308       3.933194 29.40925       7.322834 12.15554       4.662889 44.31865 7.013590 28.32994 6.833702 15.98870       9.792341 
1 1 1 -5  35 29 o 21.74283 6.408614 7.195277       3.625856 12.60826       6.204921 4.388504       4.468089 26.86540 8.477926 18.01796 7.036089 8.847439       11.01734 
1 1 1 -5  35 30 o 19.98891 6.851287 6.295237       4.021655 6.691733       6.318560 6.025229       5.214187 20.36278 8.230045 19.62494 7.618606 0.7378349      11.21502 
1 1 1 -5  35 31 o 26.51827 7.388116 12.00386       4.951242 13.26817       6.646973 10.42794       7.421027 25.90578 8.809730 22.71071 9.006609 3.195063       12.59882 
1 1 1 -5  35 32 o 10.80047 5.037105 -1.631675      3.252135 -3.141706      6.142708 -1.043578      3.833466 13.68105 6.539422 12.08647 5.578403 1.594581       8.595500 
1 1 1 -5  35 33 o 23.25186 6.497108 9.039137       3.822974 9.455129       8.568892 8.935759       4.271668 20.63685 9.012623 22.49914 7.025038 -1.862291      11.42710 
1 1 1 -5  36 1  o 44.15572 4.060077 24.23318       4.319879 21.32796       5.843833 27.73342       6.414419 40.89946 6.045235 46.83236 5.740401 -5.932896      8.336491 
1 1 1 -5  36 2  o 36.30798 4.940788 16.62651       4.258227 12.30803       5.396528 23.75160       6.931767 30.61044 7.331256 42.95416 6.852283 -12.34372      10.03499 
1 1 1 -5  36 3  o 112.7688 3.727800 156.6703       10.23011 151.7836       12.07048 169.1315       19.27504 110.7228 4.482806 115.6767 6.868676 -4.953835      8.202089 
1 1 1 -5  36 4  o 70.60043 3.846861 61.56616       6.593348 59.26580       7.882957 66.92278       12.02921 69.03019 4.714423 72.57117 6.884336 -3.540977      8.343852 
1 1 1 -5  36 5  o 36.10724 5.079824 16.48702       4.346298 13.94609       5.562124 20.47136       6.965016 32.61562 7.191795 39.58769 7.494162 -6.972073      10.38674 
1 1 1 -5  36 6  o 78.01120 4.078249 75.29079       7.726023 80.30544       12.79869 72.41579       9.690915 79.59594 6.659379 76.12306 5.256386 3.472878       8.483922 
1 1 1 -5  36 7  o 58.93095 4.120418 43.08237       5.879981 48.30040       10.71344 40.83298       7.034089 61.30135 7.315948 57.09007 5.110030 4.211285       8.923872 
1 1 1 -5  36 8  o 99.67912 3.446034 122.3823       8.358074 131.1627       16.33490 119.2683       9.727941 101.7493 6.623939 98.19095 4.074347 3.558342       7.776688 
1 1 1 -5  36 9  o 40.59882 5.201513 20.85570       5.028044 13.34373       8.967279 24.30044       6.072427 31.75639 10.21120 43.67089 5.853288 -11.91450      11.76986 
1 1 1 -5  36 10 o 74.07133 3.584252 67.77990       6.450507 72.95137       12.94493 66.07161       7.440009 75.37249 7.132607 72.94240 4.203398 2.430092       8.279048 
1 1 1 -5  36 11 o 36.97510 5.311286 17.42665       4.648516 21.46692       9.133914 16.01439       5.400175 39.54147 9.580895 35.02652 6.567889 4.514954       11.61597 
1 1 1 -5  36 12 o 20.47997 6.934965 5.082174       4.118560 11.93192       7.222881 1.782052       5.013470 29.79977 9.105960 17.76372 7.274271 12.03605       11.65476 
1 1 1 -5  36 13 o 48.53360 4.957498 29.76512       5.781024 0.000000       0.000000 29.76512       5.781024 ?        ?        48.53360 4.957498 0.000000       4.957498 
1 1 1 -5  36 14 o 30.41187 5.852101 12.08194       4.179604 8.463882       8.344105 13.29379       4.829107 26.59517 9.788465 31.73510 6.464197 -5.139927      11.73030 
1 1 1 -5  36 15 o 74.51117 3.497734 68.87702       6.333307 49.22796       11.55300 77.31886       7.572554 60.67155 8.009455 78.76043 3.958152 -18.08888      8.934111 
1 1 1 -5  36 16 o 36.46429 5.360732 17.17870       4.621446 26.95934       9.699951 14.30659       5.256381 43.71262 9.386413 32.66613 6.823578 11.04649       11.60457 
1 1 1 -5  36 17 o 11.32722 5.373199 -4.440336      3.988985 -4.998953      6.695550 -4.132964      4.966627 15.50201 7.229048 13.27203 6.201332 2.229988       9.524477 
1 1 1 -5  36 18 o 23.69090 7.763155 7.501331       5.169231 6.577877       7.161169 8.505980       7.469362 23.67134 8.994590 25.58389 9.285447 -1.912556      12.92757 
1 1 1 -5  36 19 o 35.93160 7.254918 17.81653       6.133408 16.25771       8.596696 19.43267       8.753324 32.90298 9.909545 36.03266 9.738708 -3.129684      13.89394 
1 1 1 -5  36 20 f 48.64683 4.922373 30.61843       5.755116 44.19365       10.34397 24.53219       6.926099 56.32693 7.740368 42.29932 6.961165 14.02761       10.41014 
1 1 1 -5  36 21 o 57.36119 4.506326 42.30787       6.248535 43.03706       10.87781 41.94876       7.633624 54.51266 8.462867 56.30025 5.639816 -1.787582      10.16994 
1 1 1 -5  36 22 o 31.81297 5.540522 13.67087       4.139283 9.448940       9.160357 14.75411       4.640014 25.69292 10.06246 32.79683 6.027712 -7.103909      11.72973 
1 1 1 -5  36 23 o 45.35276 4.328134 26.73113       4.725496 38.26091       10.50267 23.80460       5.291340 49.79387 8.985977 42.16299 5.264272 7.630871       10.41443 
1 1 1 -5  36 24 o 69.05743 3.205429 60.31099       5.379555 64.29562       9.166242 58.21744       6.644146 68.92894 5.502651 67.08995 4.083260 1.838989       6.852166 
1 1 1 -5  36 25 o 34.43613 5.360568 16.28021       4.352087 20.58825       10.33867 15.35242       4.797894 32.74175 10.98744 32.79983 6.230399 -0.5807495E-01 12.63098 
1 1 1 -5  36 26 o 15.48002 6.446164 1.969700       4.026931 4.953959       5.771078 -0.8621103     5.621739 19.60267 7.885691 15.20345 6.918284 4.399229       10.49032 
1 1 1 -5  36 27 o 29.09965 5.458220 11.99584       3.728424 13.06901       6.589352 11.49045       4.521904 27.34804 8.749208 27.41197 6.801825 -0.6393433E-01 11.08212 
1 1 1 -5  36 28 o 28.57725 6.362903 12.36162       4.317247 8.285814       6.377333 15.80971       5.865723 22.03043 8.459239 30.89973 7.792460 -8.869308      11.50135 
1 1 1 -5  36 29 o 37.22371 5.395427 19.96177       4.751685 11.99885       7.285670 25.85608       6.268298 24.56937 9.127770 41.12749 6.467620 -16.55812      11.18688 
1 1 1 -5  36 30 o 12.84396 5.656785 0.5447616      3.440293 -1.154253      6.070866 1.348481       4.175459 14.64683 6.847773 14.37305 6.283880 0.2737846      9.294038 
1 1 1 -5  36 31 o 16.03573 6.518876 3.480782       3.990710 0.000000       0.000000 3.480782       3.990710 ?        ?        16.03573 6.518876 0.000000       6.518876 
1 1 1 -5  36 32 o 13.96766 5.965031 1.857886       3.591516 4.898843       8.325113 1.162507       3.981031 18.22983 8.342509 13.73027 6.064529 4.499561       10.31387 
1 1 1 -5  37 1  o 61.53277 3.667493 46.88693       5.474406 49.27621       7.071876 43.31427       8.647643 62.78384 4.655343 58.27492 6.183753 4.508915       7.740221 
1 1 1 -5  37 2  o 64.09770 3.620383 50.84248       5.632017 49.32367       7.304270 53.06949       8.844737 62.76108 4.812562 64.78758 5.658921 -2.026505      7.428603 
1 1 1 -5  37 3  o 61.43372 3.355843 46.61719       5.004863 45.39121       7.025881 47.88020       7.131184 60.18307 4.831155 61.84223 4.768761 -1.659157      6.788309 
1 1 1 -5  37 4  o 35.79068 4.691590 16.19451       3.993484 17.55258       5.461693 14.63435       5.853969 36.78455 6.320638 33.18113 7.425471 3.603416       9.751311 
1 1 1 -5  37 5  o 51.72813 3.593167 33.17426       4.501243 37.90290       6.559101 28.96488       6.188490 54.90071 4.955950 47.78868 5.409010 7.112034       7.336132 
1 1 1 -5  37 6  o 16.54197 6.278275 2.579128       3.486534 9.053038       4.868905 -4.234221      4.994917 26.14906 7.341460 13.42059 6.253555 12.72847       9.643857 
1 1 1 -5  37 7  o 45.24121 3.861572 25.50574       4.216641 21.11923       5.791564 30.45382       6.151126 40.46358 6.059701 49.03852 5.227834 -8.574940      8.003139 
1 1 1 -5  37 8  o 61.80748 3.283229 47.22644       4.927395 48.31120       6.935664 46.12097       7.001582 62.08447 4.617315 60.59280 4.780453 1.491665       6.646226 
1 1 1 -5  37 9  o 56.06852 3.750321 39.08696       5.094706 39.85915       6.788976 38.09150       7.708264 56.18787 5.010737 54.55857 5.891021 1.629295       7.733797 
1 1 1 -5  37 10 o 15.30303 6.523661 0.3298731      4.282102 -3.500818      7.026886 2.592741       5.400748 16.88387 7.702917 18.90824 7.620701 -2.024368      10.83559 
1 1 1 -5  37 11 o 25.57346 8.233557 8.628041       5.828915 0.000000       0.000000 8.628041       5.828915 ?        ?        25.57346 8.233557 0.000000       8.233557 
1 1 1 -5  37 12 o 16.95052 7.447539 -0.6708925     5.930350 0.000000       0.000000 -0.6708925     5.930350 ?        ?        16.95052 7.447539 0.000000       7.447539 
1 1 1 -5  37 13 o 43.94462 5.441099 24.87166       5.702412 32.84119       9.763881 20.74612       7.025001 48.88476 8.504908 39.08036 7.650482 9.804401       11.43955 
1 1 1 -5  37 14 o 39.82878 5.633592 20.63111       5.315412 18.59752       8.287356 22.05235       6.928176 35.98746 9.362188 40.38976 7.307964 -4.402302      11.87674 
1 1 1 -5  37 15 o 76.34396 4.163574 73.33472       7.716673 65.83076       13.19623 77.23406       9.512621 69.52786 7.930133 77.78443 5.045698 -8.256569      9.399259 
1 1 1 -5  37 16 o 21.62215 6.742274 6.244009       3.936095 13.57240       8.949430 4.486445       4.382749 30.37148 10.22285 19.50798 7.107902 10.86349       12.45106 
1 1 1 -5  37 17 o 25.25044 7.386583 8.895875       4.832413 3.535044       8.360488 11.58544       5.921840 21.89467 9.214176 28.44972 8.133781 -6.555042      12.29062 
1 1 1 -5  37 18 o 17.94666 6.633726 3.724110       3.839360 9.767447       8.240710 2.048630       4.339062 26.35587 9.722894 16.60893 6.780335 9.746937       11.85359 
1 1 1 -5  37 19 o 36.48608 4.931751 17.46807       4.272774 29.56453       9.908124 14.70461       4.735753 43.94231 9.527871 32.79626 6.151461 11.14605       11.34111 
1 1 1 -5  37 20 o 15.76703 6.297174 2.233373       3.652735 1.866909       7.540708 2.345725       4.175292 19.52468 8.491826 16.50806 6.683638 3.016619       10.80658 
1 1 1 -5  37 21 o 22.22427 6.623120 7.045532       3.855454 4.728269       7.907517 7.768191       4.415898 21.39847 8.980489 23.14307 7.128986 -1.744600      11.46611 
1 1 1 -5  37 22 o 15.13029 6.243310 1.735878       3.729780 -1.726480      7.641027 2.818887       4.273479 17.24375 7.928627 16.86130 6.784797 0.3824482      10.43535 
1 1 1 -5  37 23 o 51.09251 4.018860 33.89955       4.963502 47.42604       11.16632 30.56879       5.541011 55.06355 8.602919 47.87206 4.815084 7.191486       9.858765 
1 1 1 -5  37 24 o 14.19364 6.193536 0.4930559      4.039394 0.000000       0.000000 0.4930559      4.039394 ?        ?        14.19364 6.193536 0.000000       6.193536 
1 1 1 -5  37 25 o 25.92692 6.624887 10.14049       4.200641 17.58304       6.413553 4.549327       5.558897 32.96251 8.054087 18.96770 7.700078 13.99481       11.14269 
1 1 1 -5  37 26 o 29.05933 6.292890 12.62456       4.327011 22.59546       6.820464 5.908228       5.597744 37.52030 7.717282 19.92299 7.846916 17.59731       11.00593 
1 1 1 -5  37 27 o 21.06310 6.940986 7.094099       4.130008 6.461167       6.505122 7.521495       5.345554 20.23551 8.286219 21.21021 7.829761 -0.9747009     11.40029 
1 1 1 -5  37 28 o 9.231912 4.541678 -5.955432      3.581584 -1.692869      5.823829 -8.548181      4.542066 14.26293 6.680815 9.879338 4.905806 4.383592       8.288560 
1 1 1 -5  37 29 o 25.23480 6.478586 10.25514       4.004086 14.25966       8.689518 9.175637       4.511613 24.63488 9.753555 23.03313 7.223765 1.601746       12.13732 
1 1 1 -5  37 30 o 11.76281 5.418836 -0.9389220     3.593112 -5.443448      7.385242 0.4579935      4.112683 13.88018 6.763021 13.42315 6.030411 0.4570332      9.061143 
1 1 1 -5  38 1  o 69.33013 3.118826 59.41479       5.255764 53.91349       7.467203 64.81578       7.398817 65.43447 4.714509 71.99255 4.236061 -6.558075      6.338045 
1 1 1 -5  38 2  o 11.05938 5.053503 -1.856963      3.039737 -0.6701683     4.009034 -3.461972      4.662198 13.95994 6.128808 13.19950 6.113138 0.7604408      8.656371 
1 1 1 -5  38 3  o 28.45975 5.183815 10.49562       3.462734 6.290799       4.706501 15.45772       5.112782 22.28279 7.412092 34.26324 6.357414 -11.98045      9.765030 
1 1 1 -5  38 4  o 46.51376 3.809786 27.02962       4.280547 25.50895       5.942754 28.66929       6.170905 44.54826 5.597471 47.32266 5.450551 -2.774403      7.812822 
1 1 1 -5  38 5  o 22.36809 6.220845 6.609142       3.513682 5.714984       4.722816 7.717607       5.258416 21.54391 7.423098 24.27388 7.820725 -2.729963      10.78268 
1 1 1 -5  38 6  o 15.54630 6.142852 1.911889       3.440410 -1.618186      4.438256 7.226703       5.445834 13.97343 6.272145 23.72729 7.974483 -9.753858      10.14555 
1 1 1 -5  38 7  o 17.24171 6.179165 3.357635       3.295186 1.391347       4.531404 5.564316       4.800417 16.57409 6.864354 21.36487 7.476859 -4.790781      10.15001 
1 1 1 -5  38 8  o 28.69328 5.434330 10.76688       3.660736 9.112331       4.947409 12.76876       5.441984 25.93584 7.440731 30.61412 7.381220 -4.678280      10.48079 
1 1 1 -5  38 9  o 21.75020 6.100722 6.275345       3.363906 4.633976       4.689112 8.015757       4.828514 20.11239 7.348429 24.42864 7.441388 -4.316252      10.45819 
1 1 1 -5  38 10 o 56.87652 4.715497 41.06485       6.477074 0.000000       0.000000 41.06485       6.477074 ?        ?        56.87652 4.715497 0.000000       4.715497 
1 1 1 -5  38 11 o 10.84464 5.144829 -4.086086      3.659011 -5.530226      6.558318 -3.433399      4.409003 15.01237 7.050214 12.65965 5.891027 2.352724       9.187476 
1 1 1 -5  38 12 o 65.70605 3.803876 54.15283       6.064671 54.81380       11.29402 53.88503       7.189083 63.66257 7.418807 65.14104 4.557549 -1.478462      8.706891 
1 1 1 -5  38 13 o 92.98161 3.425164 107.8872       7.747679 106.7262       14.48604 108.3524       9.169340 89.58348 6.683855 92.73587 4.067353 -3.152390      7.824147 
1 1 1 -5  38 14 o 75.15244 3.519865 70.74422       6.428313 80.08282       12.50549 67.39042       7.494245 77.30275 6.704730 72.90204 4.236697 4.400711       7.931141 
1 1 1 -5  38 15 o 40.39597 5.597965 21.59962       5.362750 18.61306       9.352034 23.06279       6.545897 34.41605 10.32909 41.04388 6.781227 -6.627827      12.35618 
1 1 1 -5  38 16 o 44.86235 4.952679 26.25926       5.324479 21.73566       8.775663 28.89466       6.698248 37.53806 9.566807 46.34501 6.077207 -8.806942      11.33385 
1 1 1 -5  38 17 o 23.98570 6.627321 8.110112       4.002230 -0.1072486     7.846370 10.99993       4.653050 18.74499 8.382302 27.80845 6.899492 -9.063457      10.85661 
1 1 1 -5  38 18 o 48.92967 4.090033 30.79772       4.832229 23.57023       9.933329 33.03834       5.530768 37.44525 10.47648 50.37643 4.554428 -12.93119      11.42363 
1 1 1 -5  38 19 o 33.73451 5.334555 15.40540       4.239740 19.91475       9.184698 14.18435       4.779415 34.10757 10.23621 31.66511 6.413926 2.442459       12.07967 
1 1 1 -5  38 20 o 15.92629 6.265710 2.633003       3.565546 3.395200       6.855444 2.350368       4.174610 19.52201 8.285750 16.27147 6.647552 3.250542       10.62279 
1 1 1 -5  38 21 o 24.88858 6.494599 9.045497       3.980039 1.553089       8.193151 11.35963       4.553388 19.19241 8.575140 27.75643 6.788930 -8.564024      10.93721 
1 1 1 -5  38 22 f 14.05367 6.253849 -0.1685142     4.312229 -0.3811694     7.398296 -0.5909391E-01 5.306921 17.32550 7.904195 15.39407 6.888049 1.931427       10.48435 
1 1 1 -5  38 23 o 23.26560 8.280863 8.818250       5.907700 0.000000       0.000000 8.818250       5.907700 ?        ?        23.26560 8.280863 0.000000       8.280863 
1 1 1 -5  38 24 o 43.76020 5.110287 26.53760       5.347079 23.85133       9.441538 27.80600       6.487797 34.73577 10.36752 43.51873 6.300769 -8.782955      12.13199 
1 1 1 -5  38 25 o 17.38806 6.585732 4.219087       3.831622 4.353394       7.176904 4.165545       4.531467 19.05732 8.286547 17.64513 7.024902 1.412191       10.86352 
1 1 1 -5  38 26 o 12.51882 5.635177 -0.2777893     3.611099 -5.375930      8.121152 0.9786097      4.031582 14.99300 7.255279 14.07164 6.162829 0.9213572      9.519429 
1 1 1 -5  38 27 o 31.45671 6.812793 15.92051       5.071026 18.87547       9.396423 14.70620       6.023507 27.91309 10.36676 28.27574 8.239852 -0.3626499     13.24254 
1 1 1 -5  38 28 o 26.77425 6.720737 11.79489       4.377775 13.64807       9.208725 11.25379       4.976029 23.62914 9.785822 25.10683 7.534263 -1.477682      12.35020 
1 1 1 -5  38 29 o 17.85313 6.486057 5.152318       3.645734 3.407352       6.269875 6.043673       4.481161 16.95720 7.543731 18.80059 7.121786 -1.843391      10.37438 
1 1 1 -5  39 1  o 39.36235 4.101761 19.61454       3.876828 13.19826       5.170744 27.85209       5.858824 31.09785 6.993324 46.46069 5.267586 -15.36284      8.755230 
1 1 1 -5  39 2  o 38.31100 4.185187 18.61816       3.843798 12.04938       5.053849 27.63237       5.920296 29.65508 7.089662 46.23533 5.353322 -16.58025      8.883770 
1 1 1 -5  39 3  o 57.67501 3.683012 41.63565       5.149342 43.30276       6.582511 39.00657       8.266300 58.36177 4.667225 54.42622 6.351840 3.935543       7.882186 
1 1 1 -5  39 4  o 50.55169 4.094169 32.23747       5.000438 28.32025       6.279559 39.02596       8.266602 46.65340 5.637632 54.42034 6.352829 -7.766941      8.493606 
1 1 1 -5  39 5  o 14.49934 6.090825 0.7722728      3.642751 4.030001       4.467787 -5.688006      6.291594 19.09413 7.137209 14.52702 6.848022 4.567108       9.891167 
1 1 1 -5  39 6  o 59.92826 3.657315 44.98048       5.315660 42.58513       6.644145 49.24041       8.860451 57.76384 4.762322 61.35051 6.003294 -3.586666      7.662848 
1 1 1 -5  39 7  o 58.80038 3.763517 43.41261       5.364438 39.57668       6.710487 50.20423       8.929056 55.49867 5.015843 61.89883 5.994469 -6.400166      7.816159 
1 1 1 -5  39 8  o 21.04228 6.816154 5.847919       3.990913 9.353602       6.331436 3.536781       5.140777 25.92750 8.596060 19.11882 7.522978 6.808681       11.42311 
1 1 1 -5  39 9  o 17.99708 6.087040 4.072759       3.172951 3.430423       4.095179 5.037539       5.018867 17.92729 6.804199 20.54221 7.586101 -2.614914      10.19049 
1 1 1 -5  39 10 o 42.22731 4.676780 22.96941       4.731985 22.06589       8.962352 23.31863       5.571931 38.28909 9.618966 42.09246 5.568539 -3.803371      11.11455 
1 1 1 -5  39 11 o 31.49990 6.076994 13.43574       4.495789 21.98528       8.629580 10.25085       5.267027 38.25430 9.339657 26.82591 7.671354 11.42839       12.08631 
1 1 1 -5  39 12 o 20.76118 7.037323 5.730505       4.241106 20.23018       8.138162 0.3243953      4.969236 36.61284 9.148050 15.89437 6.903384 20.71847       11.46052 
1 1 1 -5  39 13 o 38.10353 5.173740 19.16730       4.680041 15.47957       7.920756 21.14526       5.800920 31.52539 9.515799 39.39314 6.251381 -7.867746      11.38553 
1 1 1 -5  39 14 o 62.64251 4.256885 50.38251       6.459657 50.49622       10.67621 50.31684       8.113246 59.67782 7.506933 61.60901 5.460478 -1.931187      9.282825 
1 1 1 -5  39 15 o 39.97179 4.790675 21.01639       4.573596 13.13610       8.904172 23.84058       5.330519 28.42957 10.16111 42.27510 5.289730 -13.84553      11.45554 
1 1 1 -5  39 16 o 64.46080 4.210780 53.66974       6.578250 43.68776       10.85520 59.46297       8.269696 53.68355 8.587012 66.99088 5.104105 -13.30732      9.989428 
1 1 1 -5  39 17 o 24.72283 7.338447 9.095370       4.740689 0.5590926      8.069268 13.59467       5.858309 18.83696 8.456044 29.82001 7.926465 -10.98305      11.59023 
1 1 1 -5  39 18 o 38.89020 5.939737 21.03905       5.450909 20.37288       9.162866 21.40393       6.781372 34.00876 10.22800 37.77918 7.629023 -3.770424      12.75986 
1 1 1 -5  39 19 o 18.97677 7.339694 4.602949       4.825878 -0.5332646     8.160850 7.364822       5.984333 18.04807 8.259505 22.21394 8.268716 -4.165873      11.68722 
1 1 1 -5  39 20 o 18.50505 7.084535 4.479977       4.464049 -4.035069      7.091508 10.06877       5.745186 15.30982 7.233186 24.96938 8.184341 -9.659563      10.92256 
1 1 1 -5  39 21 o 14.43016 6.424183 0.8102154E-01  4.555403 0.000000       0.000000 0.8102154E-01  4.555403 ?        ?        14.43016 6.424183 0.000000       6.424183 
1 1 1 -5  39 22 o 49.66453 4.925892 33.83982       5.883188 35.90488       10.55008 32.90784       7.087492 44.12957 10.03775 47.38733 6.292952 -3.257755      11.84726 
1 1 1 -5  39 23 o 35.74681 5.448488 18.24405       4.596397 12.03158       9.210375 20.30435       5.304091 24.37134 9.904942 37.11008 6.075227 -12.73874      11.61965 
1 1 1 -5  39 24 o 14.28729 6.380718 0.4881451      4.531062 9.737339       7.965946 -3.935555      5.509069 22.48425 9.183879 12.98213 6.201964 9.502123       11.08188 
1 1 1 -5  39 25 o 10.23399 4.935785 -4.067721      3.681806 8.764131       7.813568 -7.730012      4.174275 21.43968 8.957455 9.568801 4.743167 11.87088       10.13576 
1 1 1 -5  39 26 o 23.97641 7.477841 10.15480       4.841530 9.231986       8.541915 10.59158       5.876658 21.28239 9.146184 23.47996 8.268309 -2.197573      12.32954 
1 1 1 -5  39 27 o 16.14794 6.371962 3.712759       3.697303 8.543235       7.887846 2.352605       4.185597 20.59350 8.818430 15.06479 6.436698 5.528711       10.91768 
1 1 1 -5  40 1  o 43.29482 3.898758 23.80064       4.069359 24.28770       5.720560 23.30168       5.789953 42.84826 5.613461 41.82684 5.839409 1.021416       8.099977 
1 1 1 -5  40 2  o 13.37536 5.580930 0.8102043      3.027309 -0.2051696     4.143290 1.973065       4.434004 14.29091 6.253524 16.65504 6.832949 -2.364130      9.262600 
1 1 1 -5  40 3  o 43.32201 3.784285 23.77813       3.955044 18.71533       5.405102 29.61292       5.802580 37.23058 6.173715 47.69360 5.070187 -10.46302      7.988839 
1 1 1 -5  40 4  o 23.66835 5.800241 7.622884       3.318867 9.717452       4.572509 5.290780       4.824823 26.30134 7.008092 20.54441 7.461877 5.756927       10.23684 
1 1 1 -5  40 5  o 16.35244 6.071621 2.983354       3.222800 0.2240946      4.351688 6.334979       4.796110 14.94392 6.475545 21.75478 7.481075 -6.810863      9.894402 
1 1 1 -5  40 6  o 17.44255 6.537545 3.425572       3.753794 -6.049669      6.230927 8.823732       4.703059 14.05654 6.681593 24.96226 7.282783 -10.90573      9.883451 
1 1 1 -5  40 7  o 50.53141 3.495412 32.19746       4.277709 29.52567       5.810958 35.35813       6.320270 47.49074 5.101008 52.04467 5.046639 -4.553932      7.175573 
1 1 1 -5  40 8  o 44.39824 3.789286 25.06694       4.060618 21.31291       5.444746 29.77169       6.095332 39.83854 5.776714 47.46618 5.363429 -7.627640      7.882689 
1 1 1 -5  40 9  o 53.46439 3.515075 36.12022       4.554277 28.24646       6.388462 44.25700       6.494284 45.82283 5.854634 58.48687 4.593390 -12.66404      7.441504 
1 1 1 -5  40 10 o 18.18877 6.768710 3.970165       4.009578 11.00114       7.316373 0.9520825      4.793509 26.82425 9.239297 15.99945 6.863285 10.82479       11.50953 
1 1 1 -5  40 11 o 32.53006 5.883581 14.51542       4.492404 18.32300       8.227711 12.89813       5.362275 33.74654 9.567532 29.68067 7.431299 4.065874       12.11453 
1 1 1 -5  40 12 o 32.81989 6.712805 15.32261       5.187580 19.38443       7.793305 12.09102       6.951364 35.02889 9.061787 27.70177 8.997506 7.327120       12.76993 
1 1 1 -5  40 13 o 33.38069 5.675025 15.27695       4.451278 13.95557       7.628220 15.95920       5.481239 29.21267 9.420257 33.22038 6.992372 -4.007706      11.73177 
1 1 1 -5  40 14 o 40.23965 4.915534 21.57617       4.720212 13.87556       7.972929 25.73176       5.856954 28.79010 9.648648 43.39983 5.673652 -14.60973      11.19316 
1 1 1 -5  40 15 o 36.21881 5.445568 17.92752       4.657706 2.477971       8.498750 24.55994       5.568433 20.05514 8.859401 42.41676 5.517813 -22.36162      10.43720 
1 1 1 -5  40 16 o 28.78781 6.201058 11.87337       4.221618 17.67446       7.851546 9.514268       5.006965 32.23930 9.411031 24.89168 7.576689 7.347616       12.08196 
1 1 1 -5  40 17 o 14.56785 6.217663 1.105744       3.898045 5.542700       8.112516 -0.2261578     4.444769 21.28674 9.023215 14.21205 6.335207 7.074688       11.02512 
1 1 1 -5  40 18 o 16.73670 6.622993 3.226271       4.004673 -4.388754      8.116731 5.676425       4.604073 16.10693 7.647504 19.84298 7.276429 -3.736050      10.55608 
1 1 1 -5  40 19 o 12.42892 5.681882 -1.267555      3.848398 -13.20475      7.898686 2.448194       4.406835 13.09213 6.495722 16.17497 6.740088 -3.082832      9.360725 
1 1 1 -5  40 20 o 39.33973 6.001916 22.47894       5.571926 0.000000       0.000000 22.47894       5.571926 ?        ?        39.33973 6.001916 0.000000       6.001916 
1 1 1 -5  40 21 o 35.13485 5.747785 17.94303       4.751237 23.55268       9.784872 16.21234       5.434967 33.07264 10.66949 31.94480 7.159310 1.127842       12.84888 
1 1 1 -5  40 22 o 35.68430 5.554344 18.49841       4.672875 12.82760       9.055240 20.55665       5.455373 24.39819 9.855510 36.83040 6.304873 -12.43221      11.69968 
1 1 1 -5  40 23 o 11.64840 5.450665 -2.028229      3.860258 -1.417671      7.694298 -2.233604      4.462522 15.97947 7.544962 12.39596 5.819624 3.583508       9.528614 
1 1 1 -5  40 24 o 16.57671 6.644291 3.793149       4.081435 8.832749       8.169896 2.117131       4.711484 21.17789 9.018974 15.44835 6.715698 5.729535       11.24467 
1 1 1 -5  40 25 o 12.87961 5.890771 -0.4742304     4.143167 2.562090       7.492980 -1.811388      4.972469 17.24971 7.901711 13.07746 6.140705 4.172246       10.00726 
1 1 1 -5  41 1  o 64.11926 3.289062 51.84490       5.122041 49.84054       7.276236 53.81377       7.211518 61.63143 4.884637 64.27790 4.635058 -2.646469      6.733755 
1 1 1 -5  41 2  o 35.11449 4.442345 16.11508       3.716393 13.85005       5.112761 18.65253       5.411500 31.08238 6.927152 36.66964 6.281697 -5.587261      9.351211 
1 1 1 -5  41 3  o 13.40705 5.801178 0.2376058      3.482336 2.710783       4.429363 -3.765196      5.635024 17.08585 6.896028 14.06999 6.584357 3.015863       9.534618 
1 1 1 -5  41 4  o 19.41690 6.716728 5.056842       3.868193 15.57554       7.082472 0.5853338      4.617756 31.53518 8.854673 15.38566 6.668753 16.14952       11.08501 
1 1 1 -5  41 5  o 37.81205 4.219632 18.55994       3.821939 14.88396       5.418825 22.19874       5.391357 32.07244 7.119054 40.49555 5.614110 -8.423107      9.066376 
1 1 1 -5  41 6  o 34.78943 4.579704 15.92139       3.788382 14.78339       5.299201 17.11095       5.417935 32.02337 6.987460 34.77594 6.635231 -2.752571      9.635916 
1 1 1 -5  41 7  o 41.02112 4.030295 21.73493       3.976886 18.87798       5.361760 25.22869       5.929298 36.85045 6.189988 42.99222 5.807901 -6.141773      8.488090 
1 1 1 -5  41 8  o 59.31686 3.376395 44.58804       4.860380 43.83006       7.086025 45.26149       6.679228 57.40811 5.118797 58.71898 4.707191 -1.310871      6.954116 
1 1 1 -5  41 9  o 35.74283 4.404178 16.76792       3.755068 17.29838       5.394699 16.26935       5.230063 34.86957 6.590107 33.79377 6.587674 1.075806       9.318098 
1 1 1 -5  41 10 o 19.31483 7.277618 4.807168       4.665075 4.720134       7.270899 4.868066       6.081984 20.78384 8.658848 20.19759 8.105602 0.5862541      11.86071 
1 1 1 -5  41 11 o 30.85335 6.617504 13.74795       4.826238 9.522610       6.913272 17.76493       6.740663 24.62772 8.933873 33.76234 8.261429 -9.134621      12.16821 
1 1 1 -5  41 12 o 24.37434 6.873929 8.810075       4.258563 7.676339       7.688132 9.311898       5.114936 22.95424 9.146382 24.63021 7.686746 -1.675976      11.94748 
1 1 1 -5  41 13 o 38.63291 5.215550 20.34045       4.784830 35.74889       9.608006 15.25871       5.517725 47.53927 8.610572 31.81895 7.274885 15.72032       11.27235 
1 1 1 -5  41 14 o 16.74425 6.485008 3.320212       3.771209 -5.616589      6.413482 8.043212       4.662424 13.91882 6.660896 22.93120 7.361951 -9.012377      9.928034 
1 1 1 -5  41 15 o 15.53557 6.402899 2.181183       3.916660 2.693191       7.592210 1.995508       4.572004 18.99290 8.382587 16.04265 6.785872 2.950256       10.78498 
1 1 1 -5  41 16 o 14.82016 6.264786 1.560340       3.892715 0.7198419E-01  7.368373 2.136569       4.584749 17.24193 7.874520 16.08342 6.798844 1.158508       10.40348 
1 1 1 -5  41 17 o 14.20760 6.146972 0.9586563      3.909091 2.625368       7.338481 0.2983640      4.618958 18.43130 8.182600 14.55307 6.474485 3.878225       10.43427 
1 1 1 -5  41 18 o 11.68423 5.523812 -3.067024      4.148194 0.000000       0.000000 -3.067024      4.148194 ?        ?        11.68423 5.523812 0.000000       5.523812 
1 1 1 -5  41 19 o 22.93199 7.648181 8.900956       5.010442 9.302350       9.317337 8.737659       5.942871 22.35101 9.577910 22.32480 8.253053 0.2620316E-01  12.64315 
1 1 1 -5  41 20 o 18.48845 6.953548 5.207797       4.254575 11.57638       9.077416 3.414892       4.816365 23.47412 9.718178 16.87625 7.040393 6.597872       12.00042 
1 1 1 -5  41 21 o 30.21170 7.194971 15.03141       5.220915 14.87987       9.372533 15.09959       6.286602 25.24646 10.08576 28.57176 8.443004 -3.325300      13.15321 
1 1 1 -5  41 22 o 12.75392 5.811990 -0.4908551     3.985627 -4.197495      8.355318 0.6010240      4.534820 15.29317 7.390474 14.16496 6.350479 1.128215       9.744110 
1 1 1 -5  41 23 o 10.82701 5.293888 -5.948812      4.640327 8.901569       8.022981 -13.41382      5.688294 21.04283 8.948642 10.07814 5.074119 10.96469       10.28712 
1 1 1 -5  42 1  f 25.93926 5.659672 9.418415       3.476729 1.980586       4.669214 18.67379       5.208559 16.40653 6.894116 36.48435 6.071640 -20.07782      9.186602 
1 1 1 -5  42 2  o 23.80233 6.713785 8.308469       4.062083 -0.1712552     7.058988 12.50664       4.966854 17.38873 7.848409 29.02197 7.085595 -11.63324      10.57370 
1 1 1 -5  42 3  o 17.48770 6.260409 3.990401       3.381412 7.859624       5.041673 0.8268659      4.558784 22.88611 7.672675 15.29970 6.628783 7.586411       10.13956 
1 1 1 -5  42 4  o 15.77797 6.105119 2.742345       3.340010 0.5885085      4.654899 5.027974       4.795200 15.22245 6.645458 19.51588 7.372889 -4.293433      9.925804 
1 1 1 -5  42 5  o 53.55235 3.945106 37.11523       5.112271 29.88064       6.364567 50.27091       8.582587 46.55512 5.730833 60.26797 5.920121 -13.71285      8.239555 
1 1 1 -5  42 6  o 48.50746 3.809512 30.38343       4.467018 32.55923       6.471371 28.40315       6.173765 48.75163 5.545628 45.36055 5.711500 3.391079       7.960855 
1 1 1 -5  42 7  o 41.29881 3.932637 22.17036       3.910114 19.49820       5.453139 24.99810       5.609655 37.02218 6.267748 42.64261 5.528278 -5.620426      8.357424 
1 1 1 -5  42 8  o 13.69429 5.792553 0.9878265      3.331474 -4.134296      4.603892 6.618055       4.826843 12.11183 5.753226 21.21184 7.491394 -9.100010      9.445665 
1 1 1 -5  42 9  o 23.17096 7.222082 8.163804       4.516774 14.31979       7.511539 4.677330       5.652929 28.72353 9.354722 19.41930 7.807122 9.304226       12.18450 
1 1 1 -5  42 10 o 16.30271 6.340128 3.091425       3.616005 0.1133589      5.973209 4.814135       4.543040 16.19239 7.271594 18.89708 7.167924 -2.704687      10.21054 
1 1 1 -5  42 11 f 18.48173 6.781690 4.717672       4.000309 5.058767       7.538764 4.583989       4.719559 20.44370 8.683388 18.65431 7.246451 1.789391       11.30983 
1 1 1 -5  42 12 o 21.65185 6.923217 7.152195       4.126337 1.360281       7.994041 9.255887       4.817773 18.40530 8.325376 24.17583 7.446171 -5.770531      11.16948 
1 1 1 -5  42 13 o 19.69722 6.876693 5.782186       4.059235 -1.882926      8.165007 8.298647       4.678346 16.91119 7.917793 22.86570 7.377629 -5.954510      10.82224 
1 1 1 -5  42 14 o 18.12226 6.662591 4.664765       3.864021 0.8205686      7.404757 6.103279       4.529654 17.44308 7.938413 20.01109 7.235379 -2.568008      10.74100 
1 1 1 -5  42 15 o 11.88602 5.540077 -2.096198      3.924636 -5.795113      7.628273 -0.7646604     4.576840 14.72430 7.102218 13.66307 6.227010 1.061230       9.445484 
1 1 1 -5  42 16 o 24.95980 6.767661 9.855648       4.219073 3.906388       8.095491 12.07409       4.943510 19.10768 8.531505 27.18010 7.306846 -8.072412      11.23283 
1 1 1 -5  42 17 o 15.72803 6.803391 2.016569       4.786586 0.000000       0.000000 2.016569       4.786586 ?        ?        15.72803 6.803391 0.000000       6.803391 
1 1 1 -5  42 18 o 23.36193 7.179116 9.111643       4.481515 7.636826       8.922548 9.609228       5.182670 20.96985 9.176512 23.40445 7.777802 -2.434599      12.02924 
1 1 1 -5  42 19 o 22.88622 7.239221 8.913817       4.521761 5.855266       8.989428 9.949810       5.231816 19.78427 8.899587 23.57513 7.813947 -3.790863      11.84316 
1 1 1 -5  42 20 o 33.17056 6.577826 17.41892       5.129196 18.45230       8.538239 16.83543       6.415903 28.43559 9.970084 30.04603 8.424541 -1.610434      13.05280 
1 1 1 -5  43 1  o 28.01258 6.085906 11.41847       4.035404 2.303250       7.957026 14.57469       4.682215 18.93720 8.456612 31.56841 6.307226 -12.63121      10.54966 
1 1 1 -5  43 2  o 13.63465 5.924937 0.5509536      3.664300 -9.583065      6.456391 5.366260       4.450522 12.48511 6.133284 19.37946 7.145968 -6.894352      9.417113 
1 1 1 -5  43 3  o 12.87909 5.719253 -0.1894557     3.587562 -3.661784      6.867505 1.113790       4.207283 15.10043 7.129355 14.83713 6.398043 0.2633057      9.579283 
1 1 1 -5  43 4  o 18.61300 6.292998 4.965133       3.391289 5.919757       4.867218 4.064404       4.727831 20.09232 7.461291 18.06093 7.180375 2.031389       10.35513 
1 1 1 -5  43 5  f 25.89194 5.771287 9.663363       3.548404 4.754201       5.072320 14.36846       4.965778 18.90884 7.462750 30.88013 6.784621 -11.97129      10.08582 
1 1 1 -5  43 6  o 10.43538 4.917621 -2.664709      3.239657 -2.799922      4.634851 -2.535541      4.530080 12.69736 5.951493 12.69052 5.927295 0.6834984E-02  8.399589 
1 1 1 -5  43 7  o 23.88804 6.450213 8.603071       3.842070 6.917145       4.685056 12.06522       6.713804 21.14036 7.387302 26.18551 8.854403 -5.045145      11.53138 
1 1 1 -5  43 8  o 24.68319 5.945262 8.949518       3.533308 7.243662       5.055352 10.57864       4.940337 21.42855 7.656609 25.67040 7.457029 -4.241848      10.68789 
1 1 1 -5  43 9  o 20.33382 6.815252 6.309628       3.977844 3.495998       7.489577 7.415170       4.694738 19.00531 8.359281 21.62164 7.402700 -2.616327      11.16591 
1 1 1 -5  43 10 o 33.49485 6.093504 16.49632       4.790552 22.16396       9.053714 14.29252       5.645617 33.38660 10.19355 29.46491 7.757596 3.921688       12.80971 
1 1 1 -5  43 11 o 13.57367 6.044356 0.1183727      4.035180 1.321787       7.644395 -0.3464648     4.751011 17.67808 8.053299 14.14394 6.405988 3.534140       10.29040 
1 1 1 -5  43 12 o 30.87141 5.989673 14.11918       4.343455 18.37072       8.842847 12.76729       4.986422 29.54758 10.15827 28.10569 7.237086 1.441895       12.47261 
1 1 1 -5  43 13 o 36.11193 5.479006 18.76484       4.670393 23.55656       9.445107 17.21404       5.373268 33.24661 10.45557 33.14576 6.877893 0.1008530      12.51496 
1 1 1 -5  43 14 o 18.19709 6.801759 4.956788       4.057638 2.920913       8.017379 5.657828       4.704663 18.36485 8.319278 19.09358 7.282010 -0.7287273     11.05613 
1 1 1 -5  43 15 o 15.30778 6.496919 2.205132       4.214698 0.000000       0.000000 2.205132       4.214698 ?        ?        15.30778 6.496919 0.000000       6.496919 
1 1 1 -5  43 16 o 19.81354 7.412333 6.515201       4.820930 17.61477       9.030227 2.090619       5.701402 27.56874 10.17665 16.30303 7.226428 11.26570       12.48140 
1 1 1 -5  43 17 o 14.07501 6.138196 1.220966       3.962577 2.048690       8.385816 0.9830137      4.496221 17.72240 8.204629 14.44037 6.408185 3.282030       10.41061 
1 1 1 -5  44 1  o 10.74384 4.981542 -1.674448      3.109271 1.367395       4.514260 -4.419971      4.288749 15.09067 6.566764 11.19268 5.380039 3.897984       8.489242 
1 1 1 -5  44 2  o 18.83631 6.456026 5.336156       3.571003 1.635255       5.023289 9.117325       5.077470 15.79560 6.899388 23.29963 7.696874 -7.504030      10.33651 
1 1 1 -5  44 3  o 18.96811 6.583067 5.436790       3.717116 2.379257       5.023105 9.137811       5.526466 16.36835 7.023704 23.07471 8.025847 -6.706356      10.66521 
1 1 1 -5  44 4  o 24.28356 6.525218 9.150188       3.943530 9.582944       5.484423 8.686930       5.674417 23.59212 8.002587 22.49754 8.102996 1.094580       11.38859 
1 1 1 -5  44 5  o 11.29632 5.329888 -2.764093      3.826943 -1.325722      4.945821 -4.910221      6.041305 13.72627 6.335606 13.32513 6.399944 0.4011450      9.005508 
1 1 1 -5  44 6  o 35.94998 5.231109 18.30592       4.448437 12.33609       8.164999 20.82593       5.304887 24.80878 9.559869 37.60311 5.989935 -12.79433      11.28142 
1 1 1 -5  44 7  o 18.01464 6.705777 4.751059       3.935891 3.641501       7.278143 5.209659       4.679108 18.55857 8.198408 18.71982 7.230735 -0.1612415     10.93149 
1 1 1 -5  44 8  o 29.61779 6.297929 13.34457       4.405519 12.94326       8.140286 13.51080       5.239087 25.14651 9.581552 28.59631 7.446068 -3.449791      12.13466 
1 1 1 -5  44 9  o 15.95800 6.562857 2.892280       4.103178 2.247486       7.670863 3.150713       4.856333 17.88218 8.115270 16.73367 7.031199 1.148516       10.73757 
1 1 1 -5  44 10 o 13.68131 6.070351 0.4551739      4.033005 0.2810971      7.527488 0.5252612      4.776384 16.76508 7.765613 14.57752 6.527794 2.187565       10.14479 
1 1 1 -5  44 11 o 18.92340 7.262243 5.598860       4.698463 -0.7758868     7.900401 9.087292       5.844304 16.47579 7.737650 22.40939 8.201252 -5.933605      11.27527 
1 1 1 -5  44 12 o 14.70143 6.248205 1.902190       3.907405 -2.132034      7.525126 3.391412       4.572077 15.58781 7.390105 16.60189 6.887197 -1.014080      10.10184 
1 1 1 -5  44 13 o 16.01534 6.911748 2.493725       4.917845 0.000000       0.000000 2.493725       4.917845 ?        ?        16.01534 6.911748 0.000000       6.911748 
1 1 1 -5  45 1  o 14.40387 5.814266 2.299756       3.149142 0.6860213      5.259714 3.201491       3.931749 15.08530 6.794779 16.03705 6.488369 -0.9517488     9.395103 
1 1 1 -5  45 2  o 12.28875 5.646778 -1.079527      3.867327 9.445692       5.725218 -9.912333      5.244762 22.80597 8.148182 10.48982 5.219395 12.31616       9.676516 
1 1 1 -5  45 3  o 21.59868 6.844213 7.610810       4.040158 7.246064       5.045209 8.262824       6.745471 20.67045 7.610786 21.34146 8.545978 -0.6710072     11.44368 
1 1 1 -5  45 4  o 16.82125 6.164323 4.099685       3.303432 3.948993       4.739333 4.242079       4.606996 17.23501 7.066855 17.45789 7.037638 -0.2228813     9.973404 
1 1 1 -5  45 5  o 13.32940 5.715203 1.139315       3.321016 2.618341       4.761453 -0.2618176     4.634376 16.06304 6.864269 13.81384 6.284186 2.249200       9.306406 
1 1 1 -5  45 6  o 14.67704 6.037704 2.288008       3.474027 3.093215       5.141479 1.611551       4.712531 16.69310 7.133214 15.20755 6.661583 1.485557       9.760094 
1 1 1 -5  45 7  o 25.60883 6.553432 10.43856       4.106249 8.745526       5.797540 12.14282       5.816735 21.94661 8.144464 25.69870 8.220158 -3.752087      11.57166 
1 1 1 -4  0  1  o 472.7955 9.744155 2729.282       112.1598 2729.282       112.1598 2729.282       112.1598 472.7955 9.744155 472.7955 9.744155 -0.000000      0.000000 
1 1 1 -4  0  2  o 273.8830 5.955598 915.5441       39.70660 915.5441       39.70660 915.5441       39.70660 273.8830 5.955598 273.8830 5.955598 -0.000000      0.000000 
1 1 1 -4  0  3  o 788.4105 15.96075 7599.084       306.3655 7599.084       306.3655 7599.084       306.3655 788.4105 15.96075 788.4105 15.96075 -0.000000      0.000000 
1 1 1 -4  0  4  o 813.5378 16.46103 8092.335       326.0390 8092.335       326.0390 8092.335       326.0390 813.5378 16.46103 813.5378 16.46103 -0.000000      0.000000 
1 1 1 -4  0  5  o 169.1597 4.122131 349.3304       16.96961 349.3304       16.96961 349.3304       16.96961 169.1597 4.122131 169.1597 4.122131 -0.000000      0.000000 
1 1 1 -4  0  6  o 831.5136 23.91020 8489.532       483.5883 8489.532       483.5883 8489.532       483.5883 831.5136 23.91020 831.5136 23.91020 -0.000000      0.000000 
1 1 1 -4  0  7  o 13.75718 5.788490 3.259562       1.953179 3.259562       1.953179 3.259562       1.953179 13.75718 5.788490 13.75718 5.788490 -0.000000      0.000000 
1 1 1 -4  0  8  o 66.88061 2.897661 54.81260       4.702410 54.81260       4.702410 54.81260       4.702410 66.88061 2.897661 66.88061 2.897661 -0.000000      0.000000 
1 1 1 -4  0  9  o 262.4416 5.789037 840.7904       36.98262 840.7904       36.98262 840.7904       36.98262 262.4416 5.789037 262.4416 5.789037 -0.000000      0.000000 
1 1 1 -4  0  10 o 342.6394 7.282557 1433.548       60.74553 1433.548       60.74553 1433.548       60.74553 342.6394 7.282557 342.6394 7.282557 -0.000000      0.000000 
1 1 1 -4  0  11 o 430.6320 8.969863 2265.508       94.03788 2265.508       94.03788 2265.508       94.03788 430.6320 8.969863 430.6320 8.969863 0.000000       0.000000 
1 1 1 -4  0  12 o 12.47088 6.940940 2.572816       3.125195 2.572816       3.125195 2.572816       3.125195 12.47088 6.940940 12.47088 6.940940 0.000000       0.000000 
1 1 1 -4  0  13 o 308.2876 6.673459 1160.479       50.08222 1160.479       50.08222 1160.479       50.08222 308.2876 6.673459 308.2876 6.673459 -0.000000      0.000000 
1 1 1 -4  0  14 f 25.48971 5.155405 8.823057       2.836381 8.823057       2.836381 8.823057       2.836381 25.48971 5.155405 25.48971 5.155405 -0.000000      0.000000 
1 1 1 -4  0  15 o 48.11026 3.623830 28.68326       4.191802 28.68326       4.191802 28.68326       4.191802 48.11026 3.623830 48.11026 3.623830 0.000000       0.000000 
1 1 1 -4  0  16 o 449.8867 9.377519 2471.327       102.7073 2471.327       102.7073 2471.327       102.7073 449.8867 9.377519 449.8867 9.377519 -0.000000      0.000000 
1 1 1 -4  0  17 o 1192.096 24.09394 17419.64       699.2856 17419.64       699.2856 17419.64       699.2856 1192.096 24.09394 1192.096 24.09394 -0.000000      0.000000 
1 1 1 -4  0  18 o 436.0757 9.125832 2321.638       96.88152 2321.638       96.88152 2321.638       96.88152 436.0757 9.125832 436.0757 9.125832 0.000000       0.000000 
1 1 1 -4  0  19 o 12.60539 7.840050 1.218740       4.852741 1.218740       4.852741 1.218740       4.852741 12.60539 7.840050 12.60539 7.840050 0.000000       0.000000 
1 1 1 -4  0  20 o 421.2215 12.53076 2170.821       128.3668 2170.821       128.3668 2170.821       128.3668 421.2215 12.53076 421.2215 12.53076 -0.000000      0.000000 
1 1 1 -4  0  21 o 172.5306 4.571871 363.5367       19.19139 363.5367       19.19139 363.5367       19.19139 172.5306 4.571871 172.5306 4.571871 -0.000000      0.000000 
1 1 1 -4  0  22 o 514.3869 10.67097 3232.665       133.6312 3232.665       133.6312 3232.665       133.6312 514.3869 10.67097 514.3869 10.67097 0.000000       0.000000 
1 1 1 -4  0  23 o 861.2495 17.52308 9090.897       367.4258 9090.897       367.4258 9090.897       367.4258 861.2495 17.52308 861.2495 17.52308 0.000000       0.000000 
1 1 1 -4  0  24 o 173.3178 6.773626 368.0067       28.50942 368.0067       28.50942 368.0067       28.50942 173.3178 6.773626 173.3178 6.773626 0.000000       0.000000 
1 1 1 -4  0  25 o 112.4975 4.145530 154.8969       11.32966 154.8969       11.32966 154.8969       11.32966 112.4975 4.145530 112.4975 4.145530 0.000000       0.000000 
1 1 1 -4  0  26 o 14.79460 8.576618 3.255544       5.045269 3.255544       5.045269 3.255544       5.045269 14.79460 8.576618 14.79460 8.576618 -0.000000      0.000000 
1 1 1 -4  0  27 o 304.9759 6.808440 1137.163       50.54292 1137.163       50.54292 1137.163       50.54292 304.9759 6.808440 304.9759 6.808440 0.000000       0.000000 
1 1 1 -4  0  28 o 192.1294 4.996943 451.2701       23.35984 451.2701       23.35984 451.2701       23.35984 192.1294 4.996943 192.1294 4.996943 0.000000       0.000000 
1 1 1 -4  0  29 o 457.7765 9.688983 2571.671       107.9763 2571.671       107.9763 2571.671       107.9763 457.7765 9.688983 457.7765 9.688983 0.000000       0.000000 
1 1 1 -4  0  30 o 129.5144 4.290358 205.3193       13.50720 205.3193       13.50720 205.3193       13.50720 129.5144 4.290358 129.5144 4.290358 -0.000000      0.000000 
1 1 1 -4  0  31 o 170.5013 6.506789 356.9682       26.94570 356.9682       26.94570 356.9682       26.94570 170.5013 6.506789 170.5013 6.506789 -0.000000      0.000000 
1 1 1 -4  0  32 o 143.2139 4.501974 251.1195       15.67655 251.1195       15.67655 251.1195       15.67655 143.2139 4.501974 143.2139 4.501974 -0.000000      0.000000 
1 1 1 -4  0  33 o 82.46344 4.401149 83.73278       8.786395 83.73278       8.786395 83.73278       8.786395 82.46344 4.401149 82.46344 4.401149 0.000000       0.000000 
1 1 1 -4  0  34 o 49.03869 5.729173 30.58972       6.602471 30.58972       6.602471 30.58972       6.602471 49.03869 5.729173 49.03869 5.729173 -0.000000      0.000000 
1 1 1 -4  0  35 o 162.9709 7.135451 327.7214       28.21396 327.7214       28.21396 327.7214       28.21396 162.9709 7.135451 162.9709 7.135451 -0.000000      0.000000 
1 1 1 -4  0  36 o 93.73911 4.455153 108.1203       10.12439 108.1203       10.12439 108.1203       10.12439 93.73911 4.455153 93.73911 4.455153 -0.000000      0.000000 
1 1 1 -4  0  37 o 36.19860 13.15078 21.65539       10.66335 21.65539       10.66335 21.65539       10.66335 36.19860 13.15078 36.19860 13.15078 -0.000000      0.000000 
1 1 1 -4  0  38 o 30.23793 10.16018 14.54742       6.683954 14.54742       6.683954 14.54742       6.683954 30.23793 10.16018 30.23793 10.16018 0.000000       0.000000 
1 1 1 -4  0  39 o 91.30670 4.711464 102.9780       10.41915 102.9780       10.41915 102.9780       10.41915 91.30670 4.711464 91.30670 4.711464 -0.000000      0.000000 
1 1 1 -4  0  40 o 68.26434 5.165569 58.23589       8.477154 58.23589       8.477154 58.23589       8.477154 68.26434 5.165569 68.26434 5.165569 0.000000       0.000000 
1 1 1 -4  0  41 o 38.91365 9.568517 22.01706       7.856489 22.01706       7.856489 22.01706       7.856489 38.91365 9.568517 38.91365 9.568517 -0.000000      0.000000 
1 1 1 -4  0  42 o 10.50765 7.059604 -1.833276      5.119090 -1.833276      5.119090 -1.833276      5.119090 10.50765 7.059604 10.50765 7.059604 0.000000       0.000000 
1 1 1 -4  0  43 o 10.70364 7.105558 -1.028939      4.921034 -1.028939      4.921034 -1.028939      4.921034 10.70364 7.105558 10.70364 7.105558 0.000000       0.000000 
1 1 1 -4  0  44 o 24.57073 9.475733 10.62706       5.377234 10.62706       5.377234 10.62706       5.377234 24.57073 9.475733 24.57073 9.475733 0.000000       0.000000 
1 1 1 -4  0  45 o 32.83414 13.54687 21.57982       10.74362 21.57982       10.74362 21.57982       10.74362 32.83414 13.54687 32.83414 13.54687 -0.000000      0.000000 
1 1 1 -4  0  46 o 10.77429 7.176206 -0.6909712     5.089810 -0.6909712     5.089810 -0.6909712     5.089810 10.77429 7.176206 10.77429 7.176206 0.000000       0.000000 
1 1 1 -4  0  47 o 14.03012 8.493121 3.604866       5.351793 3.604866       5.351793 3.604866       5.351793 14.03012 8.493121 14.03012 8.493121 -0.000000      0.000000 
1 1 1 -4  0  48 o 18.49925 9.356457 7.765002       5.238439 7.765002       5.238439 7.765002       5.238439 18.49925 9.356457 18.49925 9.356457 0.000000       0.000000 
1 1 1 -4  0  49 o 14.41145 8.607959 4.712993       5.352322 4.712993       5.352322 4.712993       5.352322 14.41145 8.607959 14.41145 8.607959 -0.000000      0.000000 
1 1 1 -4  0  50 o 11.96216 8.105163 0.7788909      7.027901 0.7788909      7.027901 0.7788909      7.027901 11.96216 8.105163 11.96216 8.105163 0.000000       0.000000 
1 1 1 -4  0  51 o 11.23363 7.370779 1.908156       5.056754 1.908156       5.056754 1.908156       5.056754 11.23363 7.370779 11.23363 7.370779 0.000000       0.000000 
1 1 1 -4  0  52 o 9.417382 6.515520 -1.001937      5.103331 -1.001937      5.103331 -1.001937      5.103331 9.417382 6.515520 9.417382 6.515520 0.000000       0.000000 
1 1 1 -4  1  1  o 950.7207 15.66830 11058.27       363.0035 10956.32       442.0064 11269.49       636.2348 945.3658 19.18636 955.3989 27.35546 -10.03302      33.41313 
1 1 1 -4  1  2  o 580.6204 8.363234 4112.410       118.3321 4044.750       165.4610 4183.246       169.2987 575.4927 11.79831 585.2542 11.87061 -9.761475      16.73653 
1 1 1 -4  1  3  o 731.9771 10.47678 6540.242       186.8793 6675.167       268.0749 6412.682       260.6558 738.8020 14.88991 724.1518 14.77072 14.65021       20.97340 
1 1 1 -4  1  4  o 376.7532 5.567074 1730.401       51.11167 1708.616       71.70782 1752.898       72.87187 374.2771 7.862074 379.0948 7.888164 -4.817719      11.13712 
1 1 1 -4  1  5  o 473.4437 6.887907 2733.405       79.46788 2791.247       113.9186 2678.577       110.9108 478.2252 9.775211 468.4787 9.715117 9.746460       13.78181 
1 1 1 -4  1  6  o 283.4849 6.131165 979.8702       42.35542 907.5734       57.10782 1068.262       63.14542 272.5990 8.607555 295.7578 8.771009 -23.15881      12.28904 
1 1 1 -4  1  7  o 290.8704 5.123423 1031.415       36.31582 968.0856       60.37506 1067.317       45.45899 281.5173 8.811532 295.8496 6.305400 -14.33228      10.83518 
1 1 1 -4  1  8  o 568.0708 8.202911 3937.876       113.5551 3888.278       159.2565 3989.173       161.9599 564.0619 11.58602 571.3263 11.63288 -7.264404      16.41828 
1 1 1 -4  1  9  o 200.8086 3.322011 491.4656       16.25621 486.0265       22.90405 496.9870       23.07644 199.6659 4.707304 201.9051 4.690135 -2.239212      6.645004 
1 1 1 -4  1  10 o 461.0029 6.741516 2593.056       75.73512 2563.067       106.3279 2623.939       107.9007 458.0150 9.526454 463.4182 9.554657 -5.403198      13.49240 
1 1 1 -4  1  11 o 65.29327 2.154480 52.00956       3.423356 49.92010       4.796495 54.17906       4.887500 63.92333 3.088270 66.60410 3.019121 -2.680763      4.318854 
1 1 1 -4  1  12 o 503.0358 10.38606 3094.645       127.3168 2973.820       175.4343 3229.090       185.0572 492.0070 14.64843 512.6552 14.82863 -20.64816      20.84382 
1 1 1 -4  1  13 o 404.4830 5.984875 1995.729       58.99178 1980.121       83.02153 2011.645       83.83842 402.6695 8.460692 405.8604 8.476769 -3.190857      11.97660 
1 1 1 -4  1  14 o 127.5190 2.613998 198.1692       8.122994 202.4415       11.59304 194.0488       11.38508 128.8213 3.696773 126.1201 3.708410 2.701271       5.236262 
1 1 1 -4  1  15 o 77.96877 2.371025 74.14852       4.499746 72.27995       6.344873 76.03933       6.382498 76.93595 3.392553 78.91837 3.326223 -1.982422      4.751124 
1 1 1 -4  1  16 o 535.8781 7.789776 3502.860       101.7249 3506.454       143.9653 3499.276       143.7563 535.8532 11.02493 535.3050 11.02020 0.5482178      15.58826 
1 1 1 -4  1  17 o 156.0247 2.955654 296.6575       11.23784 301.9709       16.03607 291.5300       15.75312 157.3487 4.185860 154.6026 4.185173 2.746124       5.919214 
1 1 1 -4  1  18 o 383.2641 5.736938 1790.755       53.58145 1694.428       73.17463 1902.109       78.67525 372.7159 8.056501 394.8910 8.175697 -22.17505      11.47821 
1 1 1 -4  1  19 o 583.6116 9.764891 4156.949       138.8761 3907.057       230.3039 4299.737       174.0886 564.6436 16.75604 593.2942 12.04105 -28.65057      20.63375 
1 1 1 -4  1  20 o 435.2692 7.438870 2310.906       78.90435 2254.823       95.14954 2434.392       141.1898 429.8433 9.083652 446.0747 13.00240 -16.23141      15.86112 
1 1 1 -4  1  21 o 704.6471 10.15471 6063.318       174.3714 5936.490       243.1768 6197.544       250.1685 696.4764 14.32780 711.6036 14.42641 -15.12726      20.33242 
1 1 1 -4  1  22 o 552.1373 8.047605 3720.533       108.2804 3732.266       153.4165 3708.887       152.8483 552.5573 11.39354 550.8249 11.38704 1.732361       16.10830 
1 1 1 -4  1  23 o 110.1736 2.878428 148.0358       7.721413 143.1570       10.70613 153.3242       11.14664 108.2902 4.064233 112.0737 4.088203 -3.783524      5.764668 
1 1 1 -4  1  24 o 275.8386 5.106527 928.0200       34.32550 927.5159       41.93666 929.0432       59.74900 275.6945 6.242083 275.5623 8.909348 0.1322327      10.87842 
1 1 1 -4  1  25 o 99.42380 3.400802 120.6563       8.227502 120.0380       14.84737 120.9304       9.883783 98.96709 6.187296 99.49812 4.085045 -0.5310287     7.414191 
1 1 1 -4  1  26 f 40.04033 4.117711 19.76222       3.960605 22.35754       5.566102 17.10051       5.636850 42.44016 5.512020 36.87064 6.511679 5.569519       8.531373 
1 1 1 -4  1  27 o 19.64231 6.787596 4.252588       3.949835 2.733530       4.756498 7.627050       7.089283 18.80845 7.283444 26.27073 9.092688 -7.462282      11.65013 
1 1 1 -4  1  28 f 136.1801 3.051205 226.1818       10.12561 216.4324       14.03220 236.7735       14.62580 133.0768 4.332779 139.1977 4.316945 -6.120911      6.116289 
1 1 1 -4  1  29 o 29.05175 5.658651 10.67729       3.861999 10.40290       5.474646 10.94910       5.448828 28.62862 7.686337 29.32525 7.572460 -0.6966324     10.78990 
1 1 1 -4  1  30 o 157.3189 3.231751 302.0038       12.38953 286.5757       17.11258 318.9999       17.96109 153.0639 4.593019 161.5016 4.568318 -8.437729      6.478067 
1 1 1 -4  1  31 o 202.2215 5.020508 500.3158       24.74064 503.3611       34.94817 497.2564       35.02908 202.3006 7.100109 201.0525 7.161060 1.248138       10.08426 
1 1 1 -4  1  32 o 146.5504 3.174314 262.1821       11.33634 263.0712       16.09250 261.3062       15.97219 146.5888 4.510281 146.0987 4.491571 0.4901428      6.365285 
1 1 1 -4  1  33 o 194.4197 3.620892 461.8583       17.15505 469.5468       24.44535 454.3976       24.08056 195.6884 5.130620 192.5018 5.137882 3.186554       7.260930 
1 1 1 -4  1  34 o 69.99146 3.357195 59.98955       5.709389 59.08924       7.971563 60.93781       8.181104 69.28872 4.749849 70.36173 4.800074 -1.073013      6.752908 
1 1 1 -4  1  35 o 146.3838 3.844608 262.3346       13.70267 265.2000       16.50080 255.9686       24.59505 147.0294 4.611074 143.7954 7.040259 3.233963       8.415893 
1 1 1 -4  1  36 o 53.78547 4.774863 35.77451       6.193411 32.70407       11.32765 37.08377       7.396930 50.30873 9.589711 54.61348 5.638955 -4.304752      11.12476 
1 1 1 -4  1  37 o 76.58680 3.351255 71.89958       6.239430 65.30064       8.682019 78.94817       8.972944 72.72054 4.928342 80.05072 4.619362 -7.330177      6.754780 
1 1 1 -4  1  38 o 83.76239 3.435596 86.06202       6.997849 91.07480       9.627197 80.44640       10.18964 85.94495 4.613579 80.62444 5.214244 5.320511       6.962288 
1 1 1 -4  1  39 o 73.91923 3.491235 67.15224       6.271097 62.35988       8.593700 72.61111       9.171844 70.90190 5.005958 76.54987 4.943154 -5.647972      7.035224 
1 1 1 -4  1  40 o 71.60899 3.511983 63.13791       6.109832 67.32423       8.497722 58.65770       8.790953 73.63535 4.761177 68.55488 5.303337 5.080467       7.127004 
1 1 1 -4  1  41 o 103.3393 3.632417 131.7528       9.133169 136.4895       14.92181 128.9152       11.54921 104.1353 5.904326 101.8090 4.667528 2.326294       7.526412 
1 1 1 -4  1  42 o 33.32367 5.347441 14.28623       4.195613 8.562978       5.872313 20.25435       5.996626 25.62383 8.265448 39.39540 6.470799 -13.77157      10.49709 
1 1 1 -4  1  43 o 19.97809 6.701643 5.004999       3.846251 4.513507       5.086488 5.661299       5.877749 20.31779 7.611127 22.14559 8.203897 -1.827803      11.19076 
1 1 1 -4  1  44 o 34.67335 5.127642 15.70086       4.202125 18.16821       5.968516 13.27574       5.917219 36.39507 6.983496 30.57315 7.889443 5.821920       10.53625 
1 1 1 -4  1  45 o 26.89772 8.751102 10.86060       6.574328 18.49979       9.759171 4.513398       8.895710 33.37759 10.64438 22.31502 9.453460 11.06257       14.23625 
1 1 1 -4  1  46 o 11.99510 5.466513 -1.417419      3.526543 -1.425336      4.867559 -1.408672      5.116304 14.12725 6.432044 14.48170 6.593781 -0.3544483     9.211359 
1 1 1 -4  1  47 o 12.99720 5.797011 -0.2394318     3.727236 3.477113       5.282837 -3.923150      5.259455 17.77235 7.390564 12.98090 6.161173 4.791459       9.621876 
1 1 1 -4  1  48 o 14.05694 6.009129 1.419010       3.651335 -1.408880      5.037305 4.549846       5.300259 13.66429 6.337379 18.13392 7.458502 -4.469625      9.787319 
1 1 1 -4  1  49 o 13.55808 5.920385 1.163300       3.696585 0.2989506      5.216794 2.034955       5.238797 14.44691 6.608547 15.57701 6.914618 -1.130100      9.564771 
1 1 1 -4  1  50 o 13.31080 6.164016 -0.4273052E-01 4.738202 -0.1400612     6.755795 0.5149586E-01  6.647185 14.74883 6.995214 14.76511 6.983944 -0.1627922E-01 9.884761 
1 1 1 -4  1  51 o 20.36468 6.672184 7.990856       3.818500 7.532319       5.337401 8.471617       5.465215 18.35845 7.510290 19.12203 7.680290 -0.7635765     10.74203 
1 1 1 -4  1  52 o 11.67049 5.391685 0.1985662      3.593853 7.464983       5.119616 -6.860749      5.046131 17.69970 7.310167 10.20048 5.082582 7.499217       8.903436 
1 1 1 -4  2  1  o 165.9562 2.882273 335.6241       11.65640 333.4861       16.45718 337.7765       16.51224 165.4152 4.082667 166.4760 4.070225 -1.060791      5.764972 
1 1 1 -4  2  2  o 207.0898 4.787883 522.7442       24.16230 527.1896       34.39352 518.4122       33.95207 207.8171 6.800555 206.0797 6.769939 1.737411       9.595814 
1 1 1 -4  2  3  o 244.2204 3.829007 726.9032       22.78789 719.9183       32.07601 734.0211       32.38004 243.0143 5.416420 245.3831 5.414978 -2.368713      7.658956 
1 1 1 -4  2  4  f 222.5896 3.560029 603.8245       19.31055 603.2666       27.33800 604.3801       27.28057 222.4623 5.042828 222.6678 5.027590 -0.2054901     7.120869 
1 1 1 -4  2  5  o 734.6400 12.17092 6593.390       217.8883 6211.176       255.5525 7610.996       416.9815 712.5923 14.71645 786.7128 21.77119 -74.12042      26.27848 
1 1 1 -4  2  6  o 190.2335 4.486658 441.1093       20.79917 448.2285       29.61003 434.1751       29.22273 191.6208 6.349805 188.5885 6.367848 3.032242       8.992748 
1 1 1 -4  2  7  o 209.1870 3.928460 533.3518       20.02595 550.0685       35.19250 525.3467       24.35329 212.2632 6.812431 207.5947 4.813992 4.668549       8.341687 
1 1 1 -4  2  8  o 425.1900 6.243974 2204.766       64.69643 2149.297       90.06985 2263.889       92.98910 419.6208 8.808184 430.6573 8.860621 -11.03644      12.49379 
1 1 1 -4  2  9  o 227.3951 3.650398 630.2626       20.22821 596.8735       27.75829 668.0722       29.53866 221.2512 5.148384 234.0746 5.178456 -12.82346      7.302210 
1 1 1 -4  2  10 o 110.6440 2.390742 149.1903       6.446097 147.1442       9.106836 151.2448       9.125507 109.8197 3.407038 111.3425 3.367125 -1.522858      4.790140 
1 1 1 -4  2  11 o 123.8068 2.521665 186.8054       7.607956 194.6407       10.94280 179.4745       10.58468 126.3130 3.558586 121.2869 3.585130 5.026123       5.051404 
1 1 1 -4  2  12 o 492.5350 10.17970 2966.273       122.1823 2929.666       171.6534 3003.868       173.9533 488.4095 14.43807 494.5582 14.44924 -6.148712      20.42642 
1 1 1 -4  2  13 o 379.9153 5.658522 1760.400       52.38728 1721.896       73.03155 1801.213       75.18916 375.5529 7.980006 384.1003 8.032941 -8.547333      11.32293 
1 1 1 -4  2  14 o 757.3851 10.86960 7011.049       200.6163 7209.346       289.3625 6827.513       278.3844 766.8029 15.48540 746.2736 15.30773 20.52930       21.77439 
1 1 1 -4  2  15 o 384.7451 5.736831 1804.921       53.78749 1791.090       75.71379 1819.013       76.42519 383.1336 8.109399 386.1077 8.122542 -2.974060      11.47772 
1 1 1 -4  2  16 o 397.9864 5.919824 1931.155       57.41339 1897.304       80.28007 1966.594       82.14152 394.3594 8.353710 401.4933 8.395534 -7.133911      11.84354 
1 1 1 -4  2  17 o 239.9583 3.888963 701.7548       22.74080 678.8915       31.58563 726.3614       32.76763 235.9879 5.492419 244.0986 5.508629 -8.110687      7.778924 
1 1 1 -4  2  18 o 688.0715 9.900987 5777.920       166.0153 5850.354       236.7455 5707.842       232.8648 691.8090 14.04299 683.3402 13.98398 8.468750       19.81810 
1 1 1 -4  2  19 o 24.11063 5.390596 7.368358       3.087619 3.265738       4.877911 10.11101       3.988305 19.57172 7.426576 28.26536 5.977321 -8.693638      9.533226 
1 1 1 -4  2  20 o 276.5560 5.054778 932.3673       34.06601 924.8927       41.56207 947.6680       59.46486 275.4112 6.192692 278.5403 8.771584 -3.129089      10.73732 
1 1 1 -4  2  21 o 928.1304 13.28629 10536.29       300.5031 10700.01       429.2290 10378.90       420.8463 933.5009 18.86854 919.4186 18.78340 14.08228       26.62400 
1 1 1 -4  2  22 o 253.9167 4.134707 785.9183       25.58421 802.4252       36.62004 770.1791       35.75843 256.5132 5.858319 251.3070 5.838990 5.206207       8.271257 
1 1 1 -4  2  23 o 463.2411 6.846976 2618.490       77.29332 2567.754       108.0144 2671.734       110.6518 458.4006 9.669418 467.5840 9.710976 -9.183411      13.70404 
1 1 1 -4  2  24 o 192.6158 4.007722 452.3423       18.81159 447.7162       22.84935 462.0742       33.14093 191.5356 4.899423 194.4238 7.006319 -2.888153      8.549436 
1 1 1 -4  2  25 o 157.0274 3.685480 300.6522       14.10281 301.5750       25.09127 300.2260       17.05099 157.0106 6.572323 156.8267 4.466177 0.1839142      7.946205 
1 1 1 -4  2  26 o 83.26388 3.324763 84.67023       6.732547 78.93005       8.194895 96.58945       11.80877 80.32877 4.200956 88.77759 5.485185 -8.448814      6.909072 
1 1 1 -4  2  27 o 285.9527 4.566789 998.0867       31.82301 980.0641       44.50049 1016.950       45.52610 283.1086 6.450235 288.3825 6.478216 -5.273865      9.141817 
1 1 1 -4  2  28 o 242.5541 4.055399 718.0948       23.97057 724.4175       34.10175 711.9200       33.70082 243.4053 5.749241 241.2992 5.731238 2.106079       8.117934 
1 1 1 -4  2  29 o 125.6931 2.981241 192.7145       9.131554 178.6528       12.56739 208.4419       13.29090 120.8745 4.273246 130.5845 4.182030 -9.709961      5.979131 
1 1 1 -4  2  30 o 178.6009 3.864971 389.4951       16.82155 391.2452       28.36293 388.5456       20.89265 178.5313 6.530298 178.2137 4.815204 0.3176117      8.113629 
1 1 1 -4  2  31 o 238.8346 4.080308 696.9324       23.74796 683.1254       33.07433 711.6256       34.11943 236.1393 5.747603 241.0006 5.809617 -4.861389      8.172306 
1 1 1 -4  2  32 o 175.1849 3.421632 374.7676       14.60717 385.7559       20.85717 364.1900       20.46375 177.4754 4.827081 172.4305 4.874960 5.044876       6.860463 
1 1 1 -4  2  33 o 184.9600 3.532835 417.9583       15.92345 443.4709       23.16051 395.0882       21.92830 190.1998 5.001255 179.5138 5.017614 10.68605       7.084420 
1 1 1 -4  2  34 o 139.3327 3.184525 237.1326       10.81269 245.4204       15.42255 229.1208       15.16365 141.5054 4.478105 136.7062 4.558136 4.799194       6.389838 
1 1 1 -4  2  35 o 197.2167 4.300467 476.3407       20.66786 500.2025       25.77165 433.3361       34.59770 201.7784 5.245659 186.9416 7.610518 14.83678       9.243210 
1 1 1 -4  2  36 o 156.5772 3.955538 300.3925       15.08073 332.6327       28.54427 287.9087       17.76208 163.7450 7.170827 153.0936 4.766836 10.65134       8.610662 
1 1 1 -4  2  37 o 44.65589 4.522964 24.72652       4.854160 16.62530       6.290296 36.65334       7.632346 35.93984 7.427905 54.19657 5.872697 -18.25673      9.469021 
1 1 1 -4  2  38 o 68.31905 3.561873 57.33479       5.909543 55.05704       8.095100 59.93364       8.646870 66.67683 5.018929 69.55652 5.137610 -2.879692      7.182248 
1 1 1 -4  2  39 o 99.47323 3.311918 121.4024       8.017076 117.0551       10.86225 126.6041       11.88196 97.36381 4.591038 101.1943 4.832289 -3.830452      6.665482 
1 1 1 -4  2  40 o 87.27147 3.296279 93.60645       6.997632 92.51129       9.754233 94.76774       10.04444 86.39179 4.650377 87.41552 4.732861 -1.023727      6.635208 
1 1 1 -4  2  41 o 39.37940 5.353333 19.69095       5.004335 23.00672       7.786576 17.35760       6.531980 41.72340 7.948422 36.22241 7.640762 5.500992       11.02536 
1 1 1 -4  2  42 o 70.11864 3.806742 61.08296       6.480243 56.16737       8.014093 70.36783       11.01425 66.78048 4.959989 74.16401 6.149565 -7.383530      7.900547 
1 1 1 -4  2  43 o 45.82414 4.292261 26.51940       4.737316 35.11676       6.715231 18.00175       6.684030 52.31223 5.342642 36.20394 7.806093 16.10829       9.459329 
1 1 1 -4  2  44 o 19.19272 6.768116 4.551519       3.938647 1.334267       5.204924 8.862088       6.024751 17.15183 7.246978 25.24892 8.385752 -8.097088      11.08330 
1 1 1 -4  2  45 o 17.02237 6.425655 3.259821       3.640532 4.255738       5.076919 2.205696       5.223176 19.37499 7.518739 17.59362 7.335066 1.781374       10.50403 
1 1 1 -4  2  46 o 20.04301 6.765524 5.674683       3.919666 3.682383       5.485178 7.753635       5.603194 18.66362 7.621778 22.76941 8.068610 -4.105793      11.09928 
1 1 1 -4  2  47 o 24.43427 6.569434 9.076471       3.995777 4.994529       5.432289 13.88860       5.898182 19.18203 7.673247 28.94495 8.063549 -9.762928      11.13102 
1 1 1 -4  2  48 o 15.33121 6.191016 2.739002       3.572023 3.217739       5.163634 2.299670       4.946563 16.92034 7.186657 16.03330 6.925751 0.8870392      9.980684 
1 1 1 -4  2  49 o 10.76225 5.124588 -2.845758      3.697541 -4.312885      5.383205 -1.535368      5.087537 12.34540 5.957613 13.28360 6.229182 -0.9382057     8.619505 
1 1 1 -4  2  50 o 10.97610 5.205935 -2.097675      3.742038 -4.128141      5.201999 0.7972034E-01  5.386927 11.83323 5.745155 13.90585 6.484550 -2.072618      8.663499 
1 1 1 -4  2  51 o 24.02132 6.634592 10.74279       4.011884 8.544646       5.579913 13.09512       5.772298 19.07526 7.725244 23.38100 8.197659 -4.305737      11.26415 
1 1 1 -4  2  52 o 11.88308 5.442992 0.5646195      3.554553 -4.042888      4.838252 5.968000       5.239481 10.87440 5.335406 16.40463 7.106988 -5.530230      8.886835 
1 1 1 -4  3  1  o 499.8267 6.489921 3046.191       79.04874 2985.667       123.3574 3088.361       102.9684 494.5720 10.23528 503.1525 8.397851 -8.580536      13.23952 
1 1 1 -4  3  2  o 414.0641 6.083844 2090.338       61.38776 2097.191       87.04372 2083.556       86.58887 414.6104 8.615118 413.2614 8.598072 1.348938       12.17157 
1 1 1 -4  3  3  o 475.6765 6.924277 2759.253       80.26427 2776.645       114.0289 2742.174       112.9997 476.9732 9.810360 474.0055 9.782681 2.967682       13.85439 
1 1 1 -4  3  4  o 170.3503 4.172131 353.6938       17.31957 346.5334       24.32380 361.0578       24.66694 168.4861 5.933481 171.9871 5.894208 -3.501022      8.363485 
1 1 1 -4  3  5  o 864.8475 14.27719 9148.228       300.8974 9316.280       373.2525 8836.298       508.5202 871.9048 17.56700 846.4402 24.67970 25.46460       30.29334 
1 1 1 -4  3  6  o 430.4591 7.285223 2260.101       76.42066 2271.094       132.7027 2254.646       93.47689 430.8632 12.65246 429.8258 8.924330 1.037354       15.48317 
1 1 1 -4  3  7  o 829.2932 11.85687 8405.191       239.6152 8636.184       345.2583 8190.546       332.8181 839.2991 16.88073 817.4091 16.70827 21.89008       23.75132 
1 1 1 -4  3  8  o 317.7248 4.806586 1230.704       37.21551 1274.894       53.84289 1190.281       51.49683 323.2854 6.834492 312.3769 6.764964 10.90848       9.616392 
1 1 1 -4  3  9  o 572.5106 8.274209 4001.388       115.4373 3977.343       162.6494 4025.794       163.8633 570.2382 11.70469 573.6979 11.72094 -3.459778      16.56443 
1 1 1 -4  3  10 o 297.2844 4.551926 1077.562       32.97641 1140.330       48.29361 1022.729       45.13758 305.7148 6.482420 289.5270 6.397542 16.18781       9.107706 
1 1 1 -4  3  11 o 289.2213 4.453278 1019.923       31.38674 996.7084       43.79103 1044.447       45.00915 285.8127 6.287348 292.5757 6.312864 -6.763031      8.909714 
1 1 1 -4  3  12 o 227.4698 5.224929 631.0327       28.96279 648.2977       42.08887 615.5038       39.91653 230.3266 7.508753 224.4370 7.308053 5.889664       10.47803 
1 1 1 -4  3  13 o 643.6306 9.275989 5060.526       145.4899 5071.036       206.1589 5050.098       205.3512 643.4659 13.14742 642.1423 13.12290 1.323608       18.57593 
1 1 1 -4  3  14 o 85.77586 2.355185 89.72707       4.918299 89.72971       6.989823 89.72447       6.921728 85.73793 3.351928 85.73693 3.319187 0.9994507E-03  4.717247 
1 1 1 -4  3  15 o 186.0399 3.237535 421.8046       14.67765 417.7036       20.70514 425.9472       20.80993 185.1132 4.589913 186.9313 4.568276 -1.818100      6.475836 
1 1 1 -4  3  16 o 258.7801 4.110369 816.1992       25.92076 829.1343       37.00135 803.7339       36.32305 260.7839 5.822383 256.7588 5.805250 4.025146       8.221987 
1 1 1 -4  3  17 o 204.6626 3.478034 510.4672       17.34636 527.3968       24.98621 494.7163       24.10065 208.0081 4.929285 201.4607 4.909104 6.547409       6.956807 
1 1 1 -4  3  18 o 347.0902 5.259728 1468.553       44.48788 1452.963       62.57449 1484.488       63.26188 345.1639 7.439365 348.8882 7.440801 -3.724335      10.52187 
1 1 1 -4  3  19 o 622.7490 12.73063 4738.980       193.1963 4977.289       282.0401 4528.311       265.1804 637.0059 18.18763 607.6302 17.92838 29.37567       25.53853 
1 1 1 -4  3  20 o 37.51088 4.319775 17.37769       3.876683 12.33321       4.612935 29.50664       7.152872 31.24718 6.276152 48.80771 6.150155 -17.56053      8.787178 
1 1 1 -4  3  21 o 247.2196 4.036710 744.9534       24.31905 752.5380       34.61741 737.5629       34.17158 248.4297 5.718142 245.9460 5.701500 2.483704       8.074915 
1 1 1 -4  3  22 o 292.4518 4.598202 1042.687       32.77015 1074.898       47.20203 1012.716       45.53110 296.8519 6.525064 288.1396 6.484389 8.712250       9.199118 
1 1 1 -4  3  23 o 68.90662 3.028357 57.98191       5.072734 61.11621       7.090719 54.69604       7.260139 70.68320 4.134647 66.82856 4.484018 3.854637       6.099322 
1 1 1 -4  3  24 o 289.4615 5.288993 1022.086       37.30782 995.2233       44.94035 1081.647       66.91739 285.5516 6.458263 297.2822 9.248315 -11.73062      11.28009 
1 1 1 -4  3  25 o 348.5181 7.596349 1484.579       64.51584 1543.549       94.09364 1432.259       88.62966 354.6275 10.90104 341.6469 10.65852 12.98056       15.24588 
1 1 1 -4  3  26 o 142.2017 3.031255 246.5418       10.50421 247.3559       14.85463 245.7275       14.85575 142.3269 4.287798 141.8562 4.302417 0.4707489      6.074208 
1 1 1 -4  3  27 o 133.9958 3.002449 218.9436       9.803990 202.3325       13.40340 238.0574       14.37768 128.6891 4.279982 139.6041 4.231130 -10.91498      6.018364 
1 1 1 -4  3  28 o 75.77611 3.022397 70.14380       5.569906 72.28175       7.874345 68.00293       7.879729 76.83182 4.221917 74.50346 4.359134 2.328362       6.068495 
1 1 1 -4  3  29 o 96.09837 2.908884 112.7465       6.804219 110.6237       9.678735 114.8208       9.567469 95.08636 4.187266 96.88850 4.061185 -1.802139      5.833218 
1 1 1 -4  3  30 o 86.57059 3.300167 91.59262       6.949386 96.75935       11.33007 88.47657       8.798862 88.78144 5.260480 84.99607 4.261664 3.785370       6.770113 
1 1 1 -4  3  31 o 44.20877 3.949028 24.06433       4.209616 26.52163       5.983968 21.65677       5.923092 46.23084 5.413981 41.61254 6.015359 4.618305       8.092943 
1 1 1 -4  3  32 o 200.4049 5.035120 492.0337       24.57028 504.7064       34.61829 479.1698       34.87841 202.4510 7.027625 197.1833 7.271010 5.267700       10.11213 
1 1 1 -4  3  33 o 120.3400 3.057272 176.9259       8.958359 172.5395       12.48845 181.5755       12.85768 118.6780 4.325431 121.7477 4.340714 -3.069656      6.127900 
1 1 1 -4  3  34 o 99.89740 3.084403 121.9972       7.499647 108.8089       10.18557 137.6132       11.08343 94.16436 4.451372 105.9446 4.301929 -11.78029      6.190421 
1 1 1 -4  3  35 o 115.9082 3.102775 164.2528       8.756079 159.1171       12.15656 169.7898       12.62251 113.8859 4.388520 117.6447 4.410693 -3.758827      6.222003 
1 1 1 -4  3  36 o 151.4757 3.910202 281.1258       14.42165 281.1886       26.11104 281.0982       17.29977 150.5274 7.138579 151.2829 4.698304 -0.7555542     8.545957 
1 1 1 -4  3  37 o 53.80881 3.986188 35.68081       5.189818 36.90305       6.966175 34.15626       7.780118 54.49443 5.313130 52.21033 6.238261 2.284100       8.194221 
1 1 1 -4  3  38 o 171.9143 3.504322 362.0409       14.68088 353.9728       20.38356 370.7372       21.16212 169.4716 4.940958 173.4126 5.013010 -3.941071      7.038702 
1 1 1 -4  3  39 o 99.95145 3.264154 122.5577       7.939863 125.8388       11.16312 119.1983       11.29537 100.9619 4.548926 98.20324 4.733905 2.758667       6.565257 
1 1 1 -4  3  40 o 147.2859 3.805629 267.1082       13.64771 272.6734       22.45217 263.8470       17.18754 147.5102 6.260207 145.9139 4.840413 1.596298       7.913267 
1 1 1 -4  3  41 o 100.4002 3.226271 124.0849       7.883290 122.1266       11.08523 126.0887       11.21319 99.08359 4.603577 100.6909 4.581867 -1.607292      6.495108 
1 1 1 -4  3  42 o 25.22441 6.876815 8.458858       4.342310 7.870592       5.358153 9.584490       7.411847 24.59987 7.891594 27.22485 9.301911 -2.624971      12.19848 
1 1 1 -4  3  43 o 27.05046 6.280535 9.807610       4.060365 8.670180       5.605455 11.06324       5.889516 25.34441 8.065402 28.26241 8.121507 -2.918001      11.44594 
1 1 1 -4  3  44 o 27.41934 7.002289 10.45695       4.694705 10.22994       5.563181 11.01859       8.750308 26.85418 7.944162 27.79600 10.05550 -0.9418163     12.81495 
1 1 1 -4  3  45 o 25.51611 6.537282 9.183616       4.082767 10.05484       5.429645 8.050122       6.193220 26.13841 7.876124 23.79255 8.477527 2.345865       11.57159 
1 1 1 -4  3  46 o 23.28701 7.666714 8.201854       5.039222 -0.2358552     8.876213 12.21481       6.121354 18.88670 8.632179 27.69576 8.366581 -8.809057      12.02141 
1 1 1 -4  3  47 o 17.41205 6.603362 4.057154       3.855137 1.296617       5.071388 7.836074       5.933540 15.79831 6.915717 21.96816 8.222301 -6.169847      10.74399 
1 1 1 -4  3  48 o 41.09988 4.639297 23.39022       4.565421 22.71540       6.459778 24.06368       6.453187 37.37659 7.354267 38.86140 7.074837 -1.484806      10.20483 
1 1 1 -4  3  49 o 13.82734 6.160693 0.8882588      4.197932 3.741206       6.743901 -0.9165093     5.363831 17.38392 7.772582 13.86111 6.465994 3.522817       10.11049 
1 1 1 -4  3  50 o 17.79967 6.633655 5.624058       3.853907 4.131254       5.418799 7.152025       5.482249 16.39044 7.162394 18.81773 7.644002 -2.427286      10.47524 
1 1 1 -4  3  51 o 15.21708 6.420913 3.833408       4.077072 4.020493       5.262732 3.552581       6.447788 15.56732 6.919209 15.53557 7.192973 0.3175640E-01  9.980698 
1 1 1 -4  3  52 o 14.35309 6.107645 3.419889       3.741507 0.2899315      5.133926 6.965343       5.464072 12.90915 6.115431 17.06109 7.323317 -4.151938      9.540936 
1 1 1 -4  4  1  o 90.02567 1.972165 98.75731       4.326590 95.57949       5.588112 103.5134       6.836336 88.52518 2.593167 92.11301 3.049759 -3.587837      4.003192 
1 1 1 -4  4  2  f 96.92991 2.247979 114.4884       5.309898 121.2743       7.721907 108.4015       7.313396 99.70587 3.182177 94.25978 3.188468 5.446091       4.504728 
1 1 1 -4  4  3  o 203.3559 3.871399 504.0103       19.18496 497.1705       23.39348 518.0592       33.52711 201.9573 4.753345 206.0062 6.687374 -4.048889      8.204587 
1 1 1 -4  4  4  o 415.6388 7.067237 2106.925       71.58167 2019.530       85.23490 2316.078       131.8577 406.8349 8.597322 435.1723 12.44671 -28.33740      15.12728 
1 1 1 -4  4  5  o 286.8797 4.404465 1003.167       30.79137 984.7762       43.09703 1022.343       44.00842 284.1833 6.223183 289.5526 6.236949 -5.369232      8.810650 
1 1 1 -4  4  6  o 246.9384 4.490731 743.3107       27.02351 722.4395       46.01780 754.2967       33.38656 243.2186 7.774118 248.7296 5.508181 -5.510941      9.527695 
1 1 1 -4  4  7  o 139.0132 2.647307 235.4995       8.968019 235.1063       12.73220 235.8866       12.63376 138.8344 3.766794 139.0661 3.731365 -0.2317505     5.302059 
1 1 1 -4  4  8  o 206.6958 3.409582 520.7187       17.17390 522.2564       24.38961 519.2065       24.18678 206.9685 4.835759 206.3639 4.809591 0.6045380      6.820317 
1 1 1 -4  4  9  o 466.3840 6.816921 2654.104       77.47614 2649.605       109.5082 2658.613       109.6275 465.6526 9.650472 466.4443 9.644588 -0.7916870     13.64367 
1 1 1 -4  4  10 o 225.8656 3.653959 621.8713       20.11175 618.4319       28.40455 625.3292       28.48022 225.1895 5.176112 226.4423 5.161188 -1.252853      7.309582 
1 1 1 -4  4  11 o 440.5417 9.174220 2371.561       98.49003 2266.430       135.6802 2488.661       143.1954 429.8565 12.96742 450.4351 13.05928 -20.57861      18.40377 
1 1 1 -4  4  12 o 353.9578 6.148353 1528.417       53.03303 1655.919       97.23659 1474.431       63.27205 367.7897 10.86100 347.5490 7.470674 20.24072       13.18228 
1 1 1 -4  4  13 o 346.4386 5.219620 1463.505       44.06576 1411.878       60.89606 1520.253       63.84529 340.1443 7.346659 352.9521 7.422958 -12.80780      10.44384 
1 1 1 -4  4  14 o 714.1489 10.26234 6229.428       178.5957 6379.984       256.8596 6088.520       248.4931 721.8226 14.60257 705.1757 14.46042 16.64691       20.55088 
1 1 1 -4  4  15 o 185.9512 3.244534 421.3977       14.70237 392.0586       20.10365 455.1318       21.55692 179.2836 4.605301 193.2314 4.577969 -13.94785      6.493581 
1 1 1 -4  4  16 o 717.3675 10.30672 6281.572       180.1765 6142.034       251.0817 6429.713       258.7053 708.7269 14.53784 725.1163 14.64069 -16.38940      20.63247 
1 1 1 -4  4  17 o 686.4560 9.878792 5750.654       165.2542 5827.188       235.9714 5676.993       231.5023 690.4560 14.02450 681.5128 13.93944 8.943237       19.77358 
1 1 1 -4  4  18 o 233.3123 4.386927 663.4703       24.94216 685.3295       43.35515 652.6567       30.49374 236.9315 7.518512 231.3837 5.408065 5.547836       9.261490 
1 1 1 -4  4  19 o 382.1468 5.731584 1780.434       53.37539 1772.299       75.29806 1788.650       75.67171 381.1590 8.106652 382.9130 8.109561 -1.754028      11.46659 
1 1 1 -4  4  20 o 381.4635 6.621151 1774.575       61.54922 1780.167       75.48669 1763.483       106.3124 381.9801 8.109491 379.7601 11.50109 2.220001       14.07263 
1 1 1 -4  4  21 o 210.3143 3.613553 539.1052       18.51993 562.4572       26.76945 517.6674       25.64876 214.7888 5.114363 206.0595 5.107844 8.729294       7.228193 
1 1 1 -4  4  22 o 215.3654 3.681754 565.3492       19.32265 559.4785       27.13767 571.3862       27.51903 214.2052 5.198840 216.4722 5.216688 -2.266983      7.364901 
1 1 1 -4  4  23 o 137.2787 3.404358 229.7103       11.38871 225.5826       13.90023 238.1396       19.86381 135.9612 4.200414 139.5998 5.852021 -3.638565      7.203445 
1 1 1 -4  4  24 o 155.5493 3.598250 294.9751       13.63940 282.6703       16.34535 323.1880       24.75028 152.1852 4.412091 162.6063 6.257745 -10.42119      7.656756 
1 1 1 -4  4  25 o 284.7186 5.265871 989.2695       36.53609 1019.349       65.37579 975.6081       44.05866 288.3889 9.314775 282.6411 6.396756 5.747742       11.29971 
1 1 1 -4  4  26 o 267.8849 4.336670 875.5641       28.31005 844.3095       39.22910 909.5309       40.89582 262.8842 6.123613 272.8458 6.150714 -9.961578      8.679281 
1 1 1 -4  4  27 o 407.7980 6.143725 2033.234       61.05383 1997.816       85.50065 2070.085       87.21108 403.5375 8.694596 410.7657 8.712473 -7.228180      12.30866 
1 1 1 -4  4  28 o 30.77270 4.849346 11.84808       3.516264 10.20757       4.769961 13.80059       5.203813 28.31006 6.963112 32.98274 6.703185 -4.672682      9.665279 
1 1 1 -4  4  29 o 274.0998 4.441550 917.7805       29.66739 916.2174       41.91345 919.3499       41.99873 273.5142 6.288362 273.9809 6.290423 -0.4667053     8.894544 
1 1 1 -4  4  30 o 128.7434 3.390091 202.4377       10.62660 211.0707       17.65996 197.5376       13.30492 131.2050 5.535799 127.0816 4.302495 4.123405       7.011172 
1 1 1 -4  4  31 o 170.2142 3.344943 353.6930       13.87460 358.2819       19.72672 349.2005       19.51825 171.0863 4.736107 168.9007 4.746835 2.185593       6.705457 
1 1 1 -4  4  32 o 72.74351 3.518150 64.78039       6.218063 57.33536       7.517864 80.90325       11.06324 68.31178 4.541888 81.04358 5.636932 -12.73180      7.239043 
1 1 1 -4  4  33 o 118.3906 3.433886 171.3711       9.896462 162.6667       15.86870 176.9114       12.66008 114.9954 5.680296 120.1697 4.330278 -5.174339      7.142624 
1 1 1 -4  4  34 o 127.6829 3.615527 199.4556       11.23836 198.2921       13.50396 202.0770       20.26997 127.1914 4.363256 127.9362 6.523184 -0.7447586     7.847925 
1 1 1 -4  4  35 o 86.01858 3.108653 90.51931       6.505579 87.80026       8.883699 93.66370       9.553307 84.55474 4.325791 87.31120 4.505250 -2.756454      6.245778 
1 1 1 -4  4  36 o 50.87295 4.773778 32.04071       5.848995 37.34373       11.41007 30.15051       6.812109 53.98904 8.988427 49.14668 5.799451 4.842361       10.69698 
1 1 1 -4  4  37 o 92.51699 3.218659 104.8322       7.245537 109.0528       10.04439 100.2535       10.46182 94.15693 4.389675 90.19009 4.777098 3.966843       6.487673 
1 1 1 -4  4  38 o 35.43420 5.300333 15.81727       4.436407 5.971870       5.859921 29.03789       6.790489 23.25573 8.250364 48.09995 5.917823 -24.84422      10.15328 
1 1 1 -4  4  39 o 79.66726 3.304434 77.93221       6.401315 78.77762       8.908487 77.02970       9.204415 79.81348 4.599760 78.86529 4.812231 0.9481888      6.656978 
1 1 1 -4  4  40 o 77.35546 3.854615 73.84572       7.243322 80.52303       11.37220 69.28777       9.395691 80.13512 5.864117 74.53372 5.205693 5.601395       7.841372 
1 1 1 -4  4  41 o 87.92960 3.305787 95.28086       7.070856 92.20972       9.535579 99.03231       10.53894 86.06022 4.563137 89.06298 4.874413 -3.002762      6.676985 
1 1 1 -4  4  42 o 22.80387 7.139781 6.746538       4.409204 7.453831       5.239551 5.030255       8.161850 24.02234 7.812163 23.65180 9.424080 0.3705349      12.24104 
1 1 1 -4  4  43 f 75.91379 3.395711 71.66009       6.265948 80.90168       8.927122 62.68577       8.797088 80.01093 4.597892 70.05149 5.190168 9.959435       6.933863 
1 1 1 -4  4  44 o 31.20454 6.679239 13.38985       4.925704 17.01849       5.959266 5.564279       8.751430 34.96948 7.231948 23.47681 9.611954 11.49267       12.02875 
1 1 1 -4  4  45 o 24.78293 6.679825 8.729140       4.124945 8.832387       5.456086 8.591396       6.302039 24.56703 7.970664 24.31091 8.562212 0.2561131      11.69799 
1 1 1 -4  4  46 o 16.58496 6.999486 2.032155       4.846488 -1.966192      9.374681 3.490547       5.661788 18.46043 8.590277 18.54498 7.676054 -0.8454514E-01 11.52018 
1 1 1 -4  4  47 o 15.93906 6.355800 2.916553       3.715180 3.766293       4.940428 1.810632       5.636166 17.68914 7.229761 16.64074 7.287407 1.048405       10.26527 
1 1 1 -4  4  48 f 23.37820 6.726792 8.822970       4.037869 3.013438       5.466352 15.79974       5.990376 16.88302 7.286616 30.01131 8.032558 -13.12829      10.84513 
1 1 1 -4  4  49 o 13.20486 5.994427 0.9345619E-01  4.189248 1.929344       6.777456 -1.041667      5.329238 16.32805 7.492694 13.71799 6.414288 2.610064       9.863242 
1 1 1 -4  4  50 o 11.22318 5.299220 -1.720787      3.795631 -5.041471      5.276784 1.839398       5.463763 11.52734 5.638219 14.85506 6.783058 -3.327723      8.820396 
1 1 1 -4  4  51 f 9.170897 4.545969 -5.910364      3.834716 -6.156325      4.867140 -5.507775      6.226902 10.40535 5.151419 11.91021 5.883698 -1.504864      7.820167 
1 1 1 -4  4  52 o 10.18235 4.963725 -3.395811      3.992084 -2.315115      4.540685 -7.075033      8.378142 11.24120 5.436196 12.57871 6.309163 -1.337513      8.328131 
1 1 1 -4  5  1  o 259.3585 4.060410 819.8718       25.66294 852.7767       37.20530 790.0078       35.44445 264.4687 5.772907 254.5512 5.713958 9.917496       8.122547 
1 1 1 -4  5  2  o 242.5956 3.851444 717.2943       22.76893 709.0165       32.03558 725.7443       32.36724 241.1568 5.451262 243.9852 5.443849 -2.828400      7.704008 
1 1 1 -4  5  3  o 273.2212 3.794928 909.8276       25.26702 944.0726       40.99151 888.8438       32.08771 278.2544 6.045270 270.0270 4.876357 8.227448       7.766862 
1 1 1 -4  5  4  o 498.0686 7.246143 3025.898       87.94926 3024.806       124.4221 3026.989       124.3360 497.7085 10.25856 497.8892 10.24774 -0.1807251     14.50015 
1 1 1 -4  5  5  o 93.12103 2.272681 105.6697       5.157299 101.9684       7.291343 109.3755       7.295703 91.41132 3.278501 94.68188 3.166471 -3.270561      4.557972 
1 1 1 -4  5  6  o 376.9806 6.468261 1733.297       59.42136 1746.556       103.4395 1726.766       72.59467 377.8770 11.24562 376.1771 7.919108 1.699921       13.75414 
1 1 1 -4  5  7  o 312.3918 4.750054 1189.765       36.16048 1158.274       50.35820 1223.285       51.95654 308.1398 6.706351 316.6678 6.732869 -8.528046      9.502982 
1 1 1 -4  5  8  o 555.8915 8.053032 3772.450       109.0902 3641.538       150.7011 3916.568       158.1197 545.6460 11.33364 565.8506 11.46695 -20.20459      16.12273 
1 1 1 -4  5  9  o 330.9348 5.000541 1335.508       40.32697 1343.499       57.31278 1327.672       56.75323 331.7865 7.088538 329.8286 7.061000 1.957886       10.00525 
1 1 1 -4  5  10 o 448.9549 6.591343 2459.621       72.11286 2491.070       102.9853 2429.367       101.0094 451.4691 9.360759 445.8521 9.296829 5.617096       13.19298 
1 1 1 -4  5  11 o 575.9684 11.81830 4060.974       165.8784 4045.324       234.6376 4076.610       234.5374 573.2535 16.81452 575.4931 16.74163 -2.239624      23.72784 
1 1 1 -4  5  12 o 459.0609 6.733310 2571.234       75.32429 2575.202       106.6527 2567.285       106.3970 459.0995 9.532988 458.3944 9.524758 0.7051086      13.47586 
1 1 1 -4  5  13 o 605.8550 8.751371 4481.236       129.2055 4534.628       184.2343 4429.559       181.2505 608.8475 12.41726 601.7635 12.35996 7.083984       17.52019 
1 1 1 -4  5  14 o 738.5731 10.60087 6662.424       190.7967 6615.249       268.5398 6710.515       271.1335 735.0758 14.99134 740.3409 15.02849 -5.265137      21.22724 
1 1 1 -4  5  15 o 610.7186 8.825370 4550.944       131.3440 4399.497       181.5761 4717.159       190.2222 600.0563 12.41740 621.3215 12.56345 -21.26526      17.66443 
1 1 1 -4  5  16 o 1048.382 14.95922 13441.24       382.1770 13678.25       546.7296 13214.77       534.4398 1055.616 21.25350 1037.620 21.13608 17.99622       29.97408 
1 1 1 -4  5  17 o 401.1474 5.971184 1961.848       58.37145 1987.990       83.33253 1936.666       81.78851 403.6930 8.470855 398.4505 8.423292 5.242554       11.94601 
1 1 1 -4  5  18 o 361.3281 6.267671 1591.847       55.18792 1599.012       95.25819 1588.227       67.70873 361.7392 10.81830 360.8553 7.699729 0.8839111      13.27861 
1 1 1 -4  5  19 o 132.2415 2.814434 213.1111       9.069743 213.3157       12.79219 212.9043       12.86120 132.2356 3.974233 132.1069 3.999634 0.1287079      5.638404 
1 1 1 -4  5  20 o 477.4090 8.115440 2780.859       94.41453 2792.708       115.9048 2757.491       162.7721 478.2617 9.944880 474.5420 14.09128 3.719666       17.24717 
1 1 1 -4  5  21 o 317.1505 4.905267 1226.270       37.91090 1250.676       54.28213 1203.030       52.97017 320.1982 6.956679 314.0415 6.921627 6.156647       9.813476 
1 1 1 -4  5  22 o 370.3839 5.600939 1673.000       50.55325 1696.001       72.12414 1650.787       70.87833 372.7543 7.940026 367.7547 7.908955 4.999573       11.20694 
1 1 1 -4  5  23 o 356.9912 7.688475 1556.077       66.88578 1556.077       66.88578 0.000000       0.000000 356.9912 7.688475 ?        ?        0.000000       7.688475 
1 1 1 -4  5  24 o 220.9482 3.764091 595.2106       20.26687 576.6382       28.18048 615.1080       29.16842 217.4030 5.319204 224.5372 5.330752 -7.134186      7.530661 
1 1 1 -4  5  25 o 207.2024 4.233730 523.6692       21.37736 559.6368       39.38165 508.6435       25.45391 213.8181 7.570057 204.0939 5.121906 9.724152       9.140005 
1 1 1 -4  5  26 o 91.05542 2.859244 101.1843       6.336574 95.05415       8.735815 107.9907       9.205130 88.17560 4.076578 93.99993 4.027859 -5.824333      5.730806 
1 1 1 -4  5  27 o 147.4387 3.087412 265.1084       11.09282 255.4978       15.38329 275.5191       16.01076 144.6100 4.370321 150.1732 4.379733 -5.563202      6.187226 
1 1 1 -4  5  28 o 126.7670 2.946977 195.9988       9.103725 190.8028       12.65555 201.5708       13.10546 124.9444 4.162312 128.4225 4.193315 -3.478104      5.908361 
1 1 1 -4  5  29 o 212.2733 4.247612 550.3484       21.97234 578.0806       38.07313 536.4998       26.90489 216.9502 7.211512 209.3836 5.277140 7.566605       8.936112 
1 1 1 -4  5  30 o 146.1323 3.120686 260.5771       11.11303 260.2003       15.72397 260.9532       15.70843 145.8515 4.429133 146.0639 4.418282 -0.2124329     6.256072 
1 1 1 -4  5  31 o 123.9836 3.013400 187.5965       9.104521 183.7265       12.81115 191.5455       12.94131 122.5230 4.297415 125.1120 4.250836 -2.588982      6.044616 
1 1 1 -4  5  32 o 212.8689 4.371487 554.2136       22.67658 571.2344       28.23763 523.3007       38.05464 215.9058 5.366955 205.9266 7.596335 9.979218       9.300995 
1 1 1 -4  5  33 o 128.3227 3.095371 201.0732       9.679483 206.4671       13.73514 195.7513       13.64304 129.8241 4.347653 126.3923 4.436375 3.431778       6.211562 
1 1 1 -4  5  34 o 150.1411 4.480069 276.3231       16.37322 292.5630       22.69341 258.6904       23.64645 154.1163 6.054258 144.7211 6.723362 9.395172       9.047521 
1 1 1 -4  5  35 o 154.3017 3.297911 291.0094       12.40069 308.1723       17.82685 274.9182       17.26126 158.4824 4.620848 149.6528 4.739139 8.829544       6.619038 
1 1 1 -4  5  36 f 57.13514 4.733544 40.34021       6.531516 26.26491       12.29309 45.87650       7.709771 44.64499 11.29312 60.86232 5.249501 -16.21733      12.45359 
1 1 1 -4  5  37 o 75.15987 3.354484 69.26873       6.128471 72.78695       8.524443 65.50498       8.816889 76.84372 4.572883 72.80027 5.000251 4.043449       6.775970 
1 1 1 -4  5  38 o 101.7999 3.159538 126.9699       7.828541 129.2652       10.93902 124.5601       11.20836 102.4554 4.391532 100.5215 4.587684 1.933899       6.350779 
1 1 1 -4  5  39 o 77.60658 3.342806 73.98578       6.307049 72.06487       8.631213 76.18664       9.238778 76.29686 4.664548 78.40416 4.859359 -2.107300      6.735828 
1 1 1 -4  5  40 o 53.35786 3.851604 35.23914       4.974432 33.48639       6.701234 37.39036       7.423970 51.61550 5.407873 54.48982 5.673949 -2.874317      7.838290 
1 1 1 -4  5  41 o 42.25873 4.475573 22.40715       4.538970 24.33608       6.185273 20.15625       6.681563 43.59009 5.980326 39.15281 7.270510 4.437279       9.414064 
1 1 1 -4  5  42 o 14.74371 6.278285 0.3222046      3.958348 -0.7387645E-02 4.677076 1.154268       7.431290 15.63270 6.743487 20.12403 8.586876 -4.491325      10.91829 
1 1 1 -4  5  43 o 24.26698 7.254730 7.978525       4.620233 5.229960       5.388566 15.60812       8.977825 21.23373 7.857106 32.62135 10.18423 -11.38762      12.86284 
1 1 1 -4  5  44 o 31.93081 5.714552 13.63780       4.283329 15.57824       5.775316 11.26556       6.385647 33.31763 7.314132 27.82978 8.572775 5.487850       11.26894 
1 1 1 -4  5  45 o 46.61992 4.176310 28.02868       4.694399 25.61672       6.276407 31.09122       7.072411 43.23565 6.128629 47.58349 6.250201 -4.347847      8.753577 
1 1 1 -4  5  46 o 17.08939 7.059800 2.736979       4.776484 -6.698616      8.550158 7.017544       5.758906 15.91625 7.636400 21.80332 8.112329 -5.887067      11.14112 
1 1 1 -4  5  47 o 10.51916 5.027658 -3.654477      3.629303 1.253826       4.918245 -9.522646      5.377690 15.51606 6.800839 10.95191 5.420728 4.564150       8.696879 
1 1 1 -4  5  48 o 22.26230 6.966476 8.198730       4.198328 11.54754       5.654436 4.084471       6.267436 25.19161 8.109279 18.01333 7.788449 7.178288       11.24368 
1 1 1 -4  5  49 o 10.95961 5.201536 -2.502788      3.747731 -2.877808      5.141474 -2.077636      5.474358 12.57670 6.003659 13.29412 6.302826 -0.7174225     8.704570 
1 1 1 -4  5  50 f 10.18318 4.922209 -3.422429      3.711673 -5.427374      4.978882 -0.9143217     5.568697 11.01984 5.407909 13.42574 6.362787 -2.405902      8.350482 
1 1 1 -4  5  51 o 14.98635 6.469758 3.603311       4.311718 -0.2455078     5.212686 11.94167       7.672524 13.02249 6.167068 19.84275 8.598351 -6.820261      10.58132 
1 1 1 -4  6  1  o 449.6096 5.898946 2464.931       64.63178 2482.821       102.5941 2453.159       83.22243 450.9827 9.335260 448.4221 7.615831 2.560577       12.04774 
1 1 1 -4  6  2  o 367.0224 4.900704 1642.171       43.83158 1594.410       68.02412 1676.079       57.31659 361.5057 7.721678 370.7267 6.344397 -9.220978      9.993782 
1 1 1 -4  6  3  o 638.3998 9.192074 4975.175       143.0021 5020.758       203.5540 4930.754       200.9423 640.7090 13.03715 634.9496 12.98662 5.759460       18.40162 
1 1 1 -4  6  4  o 61.47456 2.240063 46.11303       3.350156 43.05524       4.765853 49.09995       4.710307 59.34463 3.308613 63.39955 3.057802 -4.054920      4.505227 
1 1 1 -4  6  5  o 657.7360 10.93509 5286.791       175.2710 5386.844       307.5682 5238.675       213.2922 661.6663 19.09505 654.2570 13.37798 7.409363       23.31504 
1 1 1 -4  6  6  o 264.7276 4.146869 854.2897       26.75196 840.7294       37.53822 868.2846       38.13480 262.5574 5.866962 266.8255 5.864864 -4.268097      8.295653 
1 1 1 -4  6  7  o 100.4594 2.376687 122.9875       5.818334 123.9848       8.316885 122.0315       8.142616 100.8001 3.390645 100.0040 3.345974 0.7961044      4.763613 
1 1 1 -4  6  8  o 211.2653 3.492879 544.0452       17.98241 544.9940       25.50609 543.1075       25.35651 211.4071 4.950945 211.0416 4.930434 0.3655090      6.987206 
1 1 1 -4  6  9  o 327.1636 4.961662 1305.282       39.55745 1271.466       55.11558 1341.208       56.80818 322.7618 7.007389 331.4936 7.032336 -8.731842      9.927600 
1 1 1 -4  6  10 o 500.0280 10.33535 3057.430       125.9377 3202.884       184.3697 2930.199       172.4343 510.6032 14.83305 488.4543 14.50257 22.14896       20.74473 
1 1 1 -4  6  11 o 210.0453 4.056223 537.8443       20.76208 534.1342       36.39305 539.6344       25.27952 209.0840 7.153219 210.3686 4.931190 -1.284607      8.688221 
1 1 1 -4  6  12 o 230.6384 4.296532 648.4711       24.14825 610.6484       40.14176 669.9215       30.23003 223.5792 7.377754 234.3911 5.292507 -10.81189      9.079751 
1 1 1 -4  6  13 o 698.3309 10.04485 5955.792       170.9389 6053.608       244.4087 5862.129       239.1649 703.2120 14.26246 692.0193 14.18218 11.19263       20.11348 
1 1 1 -4  6  14 f 353.2633 5.321987 1521.392       45.81507 1546.244       65.53062 1497.630       64.07838 356.0379 7.552869 350.3987 7.504348 5.639252       10.64712 
1 1 1 -4  6  15 o 312.7462 4.801332 1192.229       36.59231 1187.478       51.73525 1196.986       51.76345 312.0610 6.803165 313.3086 6.779767 -1.247620      9.604597 
1 1 1 -4  6  16 o 603.9209 8.730949 4449.361       128.4925 4436.893       181.4460 4461.903       181.9867 602.7051 12.35397 604.4011 12.35601 -1.695984      17.47260 
1 1 1 -4  6  17 o 535.5355 7.796917 3497.975       101.7530 3581.123       146.3060 3420.079       141.6099 541.5867 11.08557 529.2792 10.97925 12.30750       15.60236 
1 1 1 -4  6  18 o 305.7472 5.433885 1139.613       40.48639 1181.497       71.02348 1119.451       49.27657 311.0139 9.381727 302.9904 6.673834 8.023499       11.51333 
1 1 1 -4  6  19 o 286.3767 5.214098 999.7927       36.38757 1011.552       44.74049 976.8171       62.53875 288.0185 6.374473 282.7704 9.087478 5.248016       11.10028 
1 1 1 -4  6  20 o 391.0264 6.779918 1864.876       64.60507 1846.386       78.49093 1903.716       113.7591 388.9881 8.280318 394.4991 11.84667 -5.510986      14.45362 
1 1 1 -4  6  21 o 261.0854 4.212064 830.9309       26.79870 797.7173       37.04040 867.4134       38.82039 255.7577 5.943069 266.6953 5.973218 -10.93758      8.426114 
1 1 1 -4  6  22 o 143.7558 4.262149 252.1600       14.91455 252.1600       14.91455 0.000000       0.000000 143.7558 4.262149 ?        ?        0.000000       4.262149 
1 1 1 -4  6  23 o 546.1820 7.979891 3643.685       106.2112 3816.208       154.9477 3490.776       145.8734 558.2578 11.38975 533.9656 11.21055 24.29211       15.98133 
1 1 1 -4  6  24 o 103.2728 2.812235 130.0979       7.070810 124.8280       9.820819 135.7698       10.18859 101.0981 3.994148 105.4438 3.972228 -4.345718      5.633100 
1 1 1 -4  6  25 o 442.0505 7.631102 2389.748       82.20444 2458.821       146.1798 2357.801       99.41300 446.4697 13.45101 438.6944 9.299189 7.775360       16.35251 
1 1 1 -4  6  26 o 269.3203 4.354185 885.1290       28.57670 889.4382       40.57639 880.8883       40.25267 269.7678 6.172304 268.4706 6.152645 1.297150       8.715066 
1 1 1 -4  6  27 o 145.8166 3.065036 259.3164       10.89127 261.8793       15.46471 256.7943       15.34121 146.4022 4.339478 144.9719 4.347411 1.430313       6.142561 
1 1 1 -4  6  28 o 94.81937 2.859346 109.7536       6.599385 109.6412       9.165664 109.8746       9.509723 94.68715 3.981135 94.77512 4.127432 -0.8796692E-01 5.734556 
1 1 1 -4  6  29 o 84.90115 3.221396 88.07848       6.652812 93.67654       10.47066 84.28848       8.615373 87.39926 4.936273 82.95998 4.275995 4.439278       6.530768 
1 1 1 -4  6  30 o 247.0968 4.147141 745.9308       24.97192 745.0565       35.31022 746.8057       35.32104 246.6214 5.875349 246.9118 5.870234 -0.2904663     8.305382 
1 1 1 -4  6  31 o 69.66541 3.084479 59.35086       5.223445 54.18394       7.019569 65.76180       7.819070 66.43090 4.360253 73.20735 4.403281 -6.776451      6.196829 
1 1 1 -4  6  32 o 46.06553 4.349391 26.18432       4.824679 29.23058       5.909022 20.09192       8.356528 48.59315 5.064274 39.52813 8.891298 9.065022       10.23240 
1 1 1 -4  6  33 o 224.3600 4.540642 616.2659       24.82554 606.9550       30.14330 635.8971       43.76904 222.3243 5.568133 226.6676 7.936190 -4.343307      9.694700 
1 1 1 -4  6  34 o 135.6407 3.150393 224.7585       10.41336 227.2990       14.56533 222.1021       14.89359 136.1682 4.395192 134.5720 4.548134 1.596207       6.324811 
1 1 1 -4  6  35 o 216.9403 4.419660 576.7626       23.36497 550.1099       38.03520 592.9160       29.61064 210.6429 7.421332 219.5286 5.539463 -8.885681      9.260767 
1 1 1 -4  6  36 o 27.64087 7.720865 9.774810       5.399734 -0.9717305     10.29286 13.85548       6.342608 22.94122 9.949899 32.72659 8.017303 -9.785372      12.77801 
1 1 1 -4  6  37 o 55.19601 3.806731 37.51014       5.088946 40.10134       7.010072 34.62311       7.399414 56.85023 5.114664 52.63353 5.868700 4.216705       7.784692 
1 1 1 -4  6  38 o 33.16286 5.425625 13.92639       4.233198 11.63593       5.510006 17.22577       6.613126 29.92586 7.555596 36.44164 7.688973 -6.515781      10.77995 
1 1 1 -4  6  39 o 76.48409 3.695870 72.01602       6.868100 68.12303       10.28448 75.14973       9.227222 73.84026 5.761051 77.83907 4.889184 -3.998810      7.556046 
1 1 1 -4  6  40 o 12.48067 5.608737 -1.588737      3.560714 -5.824217      4.753098 3.828290       5.375340 12.23285 5.820692 20.33047 7.776404 -8.097619      9.713543 
1 1 1 -4  6  41 o 83.11136 3.229845 85.16784       6.529059 90.36060       9.092802 79.64079       9.380904 85.18919 4.394887 79.77612 4.848316 5.413071       6.543791 
1 1 1 -4  6  42 o 23.81039 7.117702 7.504511       4.447472 8.138470       5.245270 5.882896       8.389019 24.81170 7.790055 24.38531 9.605611 0.4263897      12.36741 
1 1 1 -4  6  43 o 23.58179 7.209719 7.513545       4.527116 6.699922       5.210127 10.02082       9.146143 22.73830 7.798049 27.53083 10.22720 -4.792530      12.86099 
1 1 1 -4  6  44 o 21.75306 6.663000 6.471439       3.864253 6.790371       5.012506 6.004201       6.067008 22.41077 7.649738 22.02758 8.299485 0.3831921      11.28716 
1 1 1 -4  6  45 o 13.62125 5.878944 0.3492556      3.558422 0.3302275      4.688510 0.3751083      5.464995 15.26741 6.667163 16.28601 7.152672 -1.018599      9.778128 
1 1 1 -4  6  46 f 16.75344 6.928633 2.615575       4.607529 1.575911       7.430295 3.265116       5.873037 18.43302 8.205512 18.36384 7.725181 0.6917572E-01  11.26982 
1 1 1 -4  6  47 o 14.17096 6.026745 1.387754       3.639485 2.654814       4.653303 -0.6085035     5.840783 16.34623 6.876384 15.19014 6.965014 1.156098       9.787547 
1 1 1 -4  6  48 o 14.10411 6.216753 0.9650878      4.162896 0.3039875E-01  6.069842 1.795183       5.720156 15.32054 7.052443 16.07865 7.175772 -0.7581120     10.06124 
1 1 1 -4  6  49 o 13.71610 6.036311 1.289896       3.910513 6.815035       5.573537 -4.067065      5.488056 19.13792 7.731550 12.40825 5.994690 6.729668       9.783311 
1 1 1 -4  6  50 o 11.16613 5.277702 -1.659239      3.782857 1.590447       5.331287 -4.954376      5.368441 14.47777 6.644282 11.56375 5.662541 2.914021       8.729883 
1 1 1 -4  6  51 o 16.13049 7.208024 5.052233       5.790976 5.052233       5.790976 0.000000       0.000000 16.13049 7.208024 ?        ?        0.000000       7.208024 
1 1 1 -4  7  1  o 184.3798 2.613378 414.2927       11.74226 405.3266       16.44400 423.6211       16.77300 182.3580 3.700383 186.4281 3.692014 -4.070099      5.227218 
1 1 1 -4  7  2  o 126.9333 2.131699 196.3391       6.593825 190.5351       9.237597 202.3683       9.415089 125.0357 3.031718 128.8602 2.998261 -3.824501      4.263905 
1 1 1 -4  7  3  o 213.9985 3.165973 558.1365       16.51027 523.2828       25.23013 584.2396       21.83436 207.1690 4.997568 218.9265 4.092664 -11.75748      6.459534 
1 1 1 -4  7  4  o 335.7724 4.544705 1374.482       37.18663 1350.838       58.19698 1390.797       48.34301 332.7329 7.177424 337.6960 5.874510 -4.963104      9.274981 
1 1 1 -4  7  5  o 181.7827 3.650807 402.7904       16.17251 381.9820       27.36897 413.9541       20.04676 176.8414 6.361308 184.2670 4.464374 -7.425568      7.771543 
1 1 1 -4  7  6  o 329.3304 4.994490 1322.550       40.08290 1325.790       56.83595 1319.345       56.53679 329.6026 7.076139 328.8021 7.056031 0.8005676      9.992963 
1 1 1 -4  7  7  o 318.8060 4.857595 1239.356       37.73843 1265.031       54.13348 1215.080       52.63832 321.9642 6.899573 315.5475 6.845437 6.416656       9.719265 
1 1 1 -4  7  8  o 330.0945 5.006080 1328.799       40.26913 1341.361       57.35896 1316.589       56.54800 331.5060 7.100252 328.4335 7.065351 3.072510       10.01662 
1 1 1 -4  7  9  o 368.9086 6.386646 1660.501       57.41531 1619.610       98.37891 1681.623       70.70579 363.6652 11.11410 371.1207 7.818145 -7.455505      13.58847 
1 1 1 -4  7  10 o 488.0544 10.10617 2911.719       120.1963 3018.075       174.8205 2816.372       165.5265 495.8368 14.48382 479.0380 14.19518 16.79880       20.28014 
1 1 1 -4  7  11 o 577.6152 8.367345 4073.316       117.7775 3996.340       164.5257 4154.225       168.6769 571.5672 11.81219 582.7355 11.87813 -11.16827      16.75165 
1 1 1 -4  7  12 o 535.7436 7.793306 3502.317       101.7454 3554.934       145.2500 3451.625       142.5669 539.3546 11.05111 531.4659 11.00797 7.888672       15.59815 
1 1 1 -4  7  13 o 744.0585 10.67954 6761.277       193.6402 6661.162       271.1714 6865.446       276.6067 737.6783 15.08484 748.8878 15.15688 -11.20947      21.38419 
1 1 1 -4  7  14 o 201.1008 3.428750 492.8606       16.80296 476.3023       23.40590 510.4694       24.13689 197.6731 4.858942 204.6406 4.840090 -6.967468      6.858264 
1 1 1 -4  7  15 o 470.4663 6.902950 2698.981       79.14060 2664.439       111.0711 2734.601       112.7922 467.2657 9.754411 473.3762 9.777696 -6.110504      13.81129 
1 1 1 -4  7  16 o 466.9263 6.863021 2658.473       78.09079 2604.787       109.0099 2715.065       111.9218 462.0143 9.682211 471.6889 9.736946 -9.674652      13.73147 
1 1 1 -4  7  17 o 530.8414 8.914979 3438.096       115.3244 3411.855       198.1286 3451.543       141.8260 527.8856 15.41832 531.6976 10.94599 -3.812012      18.90871 
1 1 1 -4  7  18 o 164.0226 3.081668 327.8604       12.31759 325.8793       17.40624 329.8477       17.43318 163.4534 4.373865 164.4471 4.354082 -0.9936829     6.171606 
1 1 1 -4  7  19 o 318.9833 5.698128 1240.584       44.29312 1242.956       54.18905 1235.808       76.88484 319.2366 6.965668 318.0028 9.933599 1.233765       12.13247 
1 1 1 -4  7  20 o 253.7549 4.122972 784.8812       25.49534 765.2288       35.46761 805.8936       36.67439 250.5099 5.809930 257.0784 5.854114 -6.568451      8.247783 
1 1 1 -4  7  21 o 413.1078 6.166219 2081.498       62.07525 2070.280       87.52028 2092.854       88.05750 411.7831 8.721759 414.0215 8.727852 -2.238403      12.33874 
1 1 1 -4  7  22 f 124.6892 3.272234 189.6335       9.934219 182.6485       12.17820 203.5260       17.17471 122.3330 4.090861 129.0638 5.473130 -6.730881      6.833030 
1 1 1 -4  7  23 o 246.7076 4.057949 742.1155       24.39637 749.3228       34.70836 735.0773       34.29863 247.8165 5.747352 245.4503 5.734256 2.366165       8.118728 
1 1 1 -4  7  24 o 262.6384 4.253172 841.2943       27.22120 844.3048       38.59710 838.3148       38.39687 262.9786 6.022797 262.0449 6.012900 0.9336853      8.510527 
1 1 1 -4  7  25 o 256.3320 4.889588 801.9048       30.54296 808.6675       54.39897 798.7914       36.90982 256.8100 8.705041 255.7361 5.922618 1.073883       10.52878 
1 1 1 -4  7  26 o 231.2872 3.908138 652.6544       22.02712 639.9301       30.82083 665.9391       31.49211 228.8705 5.526095 233.4742 5.535116 -4.603729      7.821460 
1 1 1 -4  7  27 o 406.9830 6.134290 2026.244       60.83825 2084.494       87.67249 1972.143       84.49216 411.9500 8.733386 400.7242 8.652363 11.22580       12.29371 
1 1 1 -4  7  28 o 160.1723 3.229310 313.0002       12.60472 304.6948       17.71171 321.5231       17.94206 157.8601 4.609111 162.1722 4.544522 -4.312057      6.472757 
1 1 1 -4  7  29 o 81.17757 3.006328 80.50529       5.936872 78.21313       8.285678 82.92374       8.510859 79.90328 4.270788 82.28210 4.259048 -2.378815      6.031510 
1 1 1 -4  7  30 o 24.41425 5.813834 7.594752       3.409111 5.986987       4.408128 9.987399       5.377523 22.34154 7.156950 28.04921 7.655157 -5.707668      10.47966 
1 1 1 -4  7  31 f 215.5190 3.801848 567.4635       19.96717 582.9536       28.55407 552.6412       27.93189 218.1510 5.371242 212.3295 5.402649 5.821472       7.618324 
1 1 1 -4  7  32 o 142.9980 3.660845 250.0182       12.74648 241.1027       15.23169 270.8509       23.28344 140.3053 4.460567 148.3082 6.457853 -8.002869      7.848601 
1 1 1 -4  7  33 o 92.84660 3.419323 105.4693       7.723245 100.1884       9.253058 117.5981       14.02311 90.39160 4.212278 97.66144 5.920107 -7.269836      7.265739 
1 1 1 -4  7  34 o 158.3150 3.309690 306.2864       12.76866 315.7525       18.20716 297.1251       17.91170 160.4447 4.661668 155.6211 4.728642 4.823639       6.640121 
1 1 1 -4  7  35 o 94.46301 3.102654 109.1618       7.132498 116.1274       10.02932 102.0339       10.14543 97.26749 4.241437 91.10457 4.584503 6.162918       6.245595 
1 1 1 -4  7  36 o 88.24596 3.565528 95.46442       7.651729 87.43999       11.51237 101.8146       10.24119 84.05625 5.653163 90.95131 4.635966 -6.895058      7.310980 
1 1 1 -4  7  37 o 57.90006 3.758432 41.25391       5.274347 41.98221       7.303551 40.46011       7.624929 58.15092 5.209085 57.00453 5.559532 1.146389       7.618593 
1 1 1 -4  7  38 o 80.57107 3.274839 79.65133       6.416514 76.09184       8.662189 83.97922       9.551496 78.49242 4.548077 82.41730 4.776188 -3.924873      6.595224 
1 1 1 -4  7  39 o 19.81490 7.028734 4.338338       4.252917 5.952939       5.993114 2.700447       6.036184 23.21126 8.331511 20.11741 8.074474 3.093845       11.60221 
1 1 1 -4  7  40 o 41.21111 4.483549 21.25933       4.430192 17.37298       5.849730 26.48630       6.784066 36.55859 6.816852 45.52718 6.282073 -8.968597      9.270054 
1 1 1 -4  7  41 o 32.25706 5.376497 13.38032       4.077621 16.13162       5.743495 10.58424       5.790039 34.95230 6.987593 28.12412 8.043421 6.828184       10.65472 
1 1 1 -4  7  42 f 12.69923 5.698945 -1.402033      3.661878 -2.665550      4.774647 0.4027307      5.706382 13.85307 6.331371 17.39791 7.476161 -3.544839      9.796899 
1 1 1 -4  7  43 o 48.51498 4.180032 29.79064       4.893730 31.21465       6.504315 27.93292       7.429071 48.99738 5.544772 45.55524 6.908526 3.442135       8.858456 
1 1 1 -4  7  44 o 35.91722 4.964803 16.90779       4.229423 13.98505       5.391697 21.58320       6.819296 31.45251 7.191482 39.12083 7.424630 -7.668318      10.33647 
1 1 1 -4  7  45 o 36.87116 4.795324 18.01332       4.206669 22.16754       5.767725 13.29203       6.148799 40.02667 6.106173 29.37190 8.251527 10.65477       10.26514 
1 1 1 -4  7  46 o 29.52409 7.340076 13.44591       5.258419 13.43219       9.105970 13.45277       6.440885 26.85365 10.15671 28.36075 8.585318 -1.507092      13.29911 
1 1 1 -4  7  47 o 14.45781 6.135946 1.585899       3.759125 -5.562782      4.895957 11.85264       5.867334 11.59513 5.616347 25.94963 8.250920 -14.35449      9.981033 
1 1 1 -4  7  48 o 19.19593 6.733265 5.970367       3.894500 9.261183       5.497727 2.655673       5.517638 22.41808 7.987394 16.43513 7.203518 5.982943       10.75589 
1 1 1 -4  7  49 o 12.98830 5.787353 0.7275687      3.705369 1.258994       4.944624 0.4691213E-01  5.595983 14.51797 6.559180 14.32008 6.654559 0.1978865      9.343768 
1 1 1 -4  7  50 o 14.13606 6.079537 2.503126       3.779439 1.791171       5.054750 3.405788       5.691616 14.35091 6.541865 15.62197 7.049516 -1.271068      9.617259 
1 1 1 -4  7  51 o 14.07746 6.525952 1.904385       5.332107 1.904385       5.332107 0.000000       0.000000 14.07746 6.525952 ?        ?        0.000000       6.525952 
1 1 1 -4  8  1  f 298.2711 3.759894 1084.463       27.32895 1064.792       38.26912 1104.935       39.04036 295.4904 5.314581 301.0084 5.322297 -5.518036      7.521410 
1 1 1 -4  8  2  o 297.5233 3.749891 1079.033       27.18790 1080.669       38.51117 1077.407       38.38812 297.6847 5.308774 297.2354 5.299810 0.4493103      7.501404 
1 1 1 -4  8  3  o 254.3738 3.303897 788.6784       20.48024 787.5385       28.99738 789.8131       28.92960 254.1459 4.682087 254.5134 4.664400 -0.3674164     6.608976 
1 1 1 -4  8  4  o 26.96365 3.386463 9.001235       2.176203 4.718781       4.784803 10.11813       2.443563 21.11482 7.458558 28.58750 3.586324 -7.472677      8.275978 
1 1 1 -4  8  5  o 309.9923 4.251407 1171.561       32.11587 1131.243       49.79848 1200.272       42.02257 304.4771 6.711588 313.7053 5.496986 -9.228210      8.675383 
1 1 1 -4  8  6  o 456.9967 6.713704 2548.559       74.76725 2524.950       105.2093 2572.648       106.2724 454.5282 9.498549 458.8003 9.505187 -4.272156      13.43767 
1 1 1 -4  8  7  o 122.4476 2.610340 182.7290       7.789029 188.5887       11.30346 177.4308       10.74821 124.3242 3.735185 120.5903 3.661771 3.733963       5.230696 
1 1 1 -4  8  8  o 271.3861 4.930427 898.1158       32.60681 898.6373       56.95645 897.8615       39.76857 271.1027 8.632308 271.2943 6.015384 -0.1915894     10.52148 
1 1 1 -4  8  9  o 357.9939 7.621511 1564.388       66.48946 1527.070       93.27789 1602.934       94.80119 353.2054 10.85002 361.8938 10.76166 -8.688416      15.28189 
1 1 1 -4  8  10 o 121.8899 2.620161 181.0613       7.782723 173.7858       10.94520 188.5020       11.06870 119.3440 3.768180 124.3039 3.658040 -4.959908      5.251708 
1 1 1 -4  8  11 o 312.5105 5.522637 1190.852       42.05787 1176.790       51.34933 1219.512       73.30775 310.6013 6.784149 315.8738 9.534493 -5.272491      11.70176 
1 1 1 -4  8  12 o 306.2394 4.716768 1143.219       35.19992 1113.178       49.12165 1174.928       50.46599 302.1188 6.672045 310.3853 6.672086 -8.266418      9.435725 
1 1 1 -4  8  13 o 441.9833 6.516021 2382.059       70.18179 2380.999       99.34458 2383.115       99.15976 441.7138 9.229264 441.9117 9.207971 -0.1978149     13.03710 
1 1 1 -4  8  14 o 481.8982 7.064977 2831.874       82.96638 2706.965       114.0696 2972.169       120.8918 470.9611 9.939138 493.4832 10.05283 -22.52209      14.13668 
1 1 1 -4  8  15 o 423.4184 6.272336 2185.840       64.71951 2157.951       90.87032 2214.549       92.19854 420.5768 8.866262 426.0556 8.880177 -5.478790      12.54863 
1 1 1 -4  8  16 o 864.6483 12.37848 9132.274       260.8212 9086.403       368.0401 9178.555       369.6791 861.3846 17.53323 865.7441 17.52263 -4.359558      24.78824 
1 1 1 -4  8  17 o 621.9832 10.37174 4722.645       157.2050 4800.402       274.7689 4684.806       191.6762 625.6307 18.04128 619.1939 12.70297 6.436768       22.06475 
1 1 1 -4  8  18 o 178.9242 3.255171 390.1509       14.19316 382.1673       19.95951 398.3174       20.18674 177.0051 4.631280 180.7108 4.587723 -3.705673      6.518893 
1 1 1 -4  8  19 o 379.4749 6.615370 1756.215       61.17490 1714.726       73.63480 1848.651       109.9104 374.8810 8.060344 388.7842 11.61398 -13.90317      14.13696 
1 1 1 -4  8  20 o 162.4843 3.135742 321.7613       12.41618 328.1284       17.77527 315.6948       17.35068 164.0036 4.451727 160.8650 4.430293 3.138641       6.280555 
1 1 1 -4  8  21 f 146.4027 3.403455 261.2470       12.14242 262.9601       15.17270 258.1956       20.25002 146.8069 4.245576 145.3879 5.726792 1.419022       7.128890 
1 1 1 -4  8  22 o 45.71592 3.475462 25.62303       3.842814 27.91498       5.343054 23.16706       5.530935 47.61859 4.664198 43.25232 5.362274 4.366264       7.106949 
1 1 1 -4  8  23 o 299.7495 4.706634 1095.902       34.37992 1138.373       49.83569 1057.336       47.49018 305.3409 6.697603 294.2790 6.622293 11.06189       9.418739 
1 1 1 -4  8  24 o 33.47008 4.457267 13.90631       3.545187 13.86809       4.835292 13.95074       5.213327 33.16482 6.211058 33.20471 6.674592 -0.3988647E-01 9.117424 
1 1 1 -4  8  25 o 281.3015 5.240183 966.1407       35.92151 928.4249       62.07174 985.1323       44.04663 275.0029 9.275609 283.9145 6.366329 -8.911560      11.25020 
1 1 1 -4  8  26 o 164.4965 3.209012 330.0180       12.86365 330.2834       18.22692 329.7547       18.15717 164.4199 4.553459 164.2895 4.539613 0.1303864      6.429780 
1 1 1 -4  8  27 o 77.22435 2.876001 72.83144       5.402813 74.76295       7.487466 70.73327       7.803811 78.16486 3.943598 75.99843 4.230418 2.166435       5.783459 
1 1 1 -4  8  28 o 203.7267 5.147263 507.7699       25.53362 0.000000       0.000000 507.7699       25.53362 ?        ?        203.7267 5.147263 0.000000       5.147263 
1 1 1 -4  8  29 o 142.8575 3.077182 249.0084       10.71253 254.5547       15.16157 243.4793       15.13808 144.2789 4.317117 141.0915 4.408258 3.187424       6.170109 
1 1 1 -4  8  30 o 277.0784 4.498341 938.6251       30.37324 941.4236       43.02040 935.8436       42.88840 277.0167 6.372830 276.1947 6.372184 0.8219910      9.012086 
1 1 1 -4  8  31 o 177.5200 3.417303 384.8297       14.78315 393.6064       21.03249 376.2600       20.78280 179.2720 4.818771 175.2645 4.870744 4.007446       6.851620 
1 1 1 -4  8  32 o 117.1120 4.207171 167.9687       11.98731 167.9687       11.98731 0.000000       0.000000 117.1120 4.207171 ?        ?        0.000000       4.207171 
1 1 1 -4  8  33 f 44.75198 4.076398 24.70243       4.396800 27.90300       5.951386 20.85632       6.524020 47.41230 5.238231 40.60506 6.835808 6.807240       8.612045 
1 1 1 -4  8  34 o 104.7731 3.028484 134.2040       7.724231 129.1161       10.60728 139.9477       11.27026 102.5978 4.251792 106.8072 4.339125 -4.209396      6.075009 
1 1 1 -4  8  35 o 117.7060 3.119816 169.4473       8.940886 173.6655       12.52936 165.0706       12.76251 118.9580 4.329364 115.9342 4.526094 3.023804       6.263299 
1 1 1 -4  8  36 o 92.94614 3.104190 105.7517       7.021113 95.79118       9.581235 117.3038       10.31840 88.23135 4.470749 97.68491 4.345474 -9.453568      6.234641 
1 1 1 -4  8  37 o 91.33595 4.611272 102.8193       10.23037 0.000000       0.000000 102.8193       10.23037 ?        ?        91.33595 4.611272 0.000000       4.611272 
1 1 1 -4  8  38 o 24.44145 6.899078 7.665172       4.287786 7.560317       5.827160 7.788979       6.331932 24.94724 8.245722 25.49912 8.598941 -0.5518837     11.91359 
1 1 1 -4  8  39 o 42.88608 4.211951 22.87938       4.345132 21.01090       5.722992 25.42234       6.676507 40.65946 5.952254 44.69711 6.304517 -4.037647      8.670424 
1 1 1 -4  8  40 o 27.15353 6.260894 9.631345       4.058130 9.840687       5.281019 9.329478       6.341565 27.33291 7.635768 26.92392 8.579848 0.4089870      11.48559 
1 1 1 -4  8  41 o 40.37598 4.463111 20.53358       4.318124 19.85567       5.721568 21.43069       6.581919 39.11695 6.209484 40.38478 6.937962 -1.267826      9.310907 
1 1 1 -4  8  42 o 54.80541 4.285281 37.79313       5.677727 36.32147       6.684828 41.60357       10.75657 53.32222 5.210967 55.32801 8.228038 -2.005791      9.739342 
1 1 1 -4  8  43 o 27.07416 6.128317 9.911284       3.948731 9.459843       5.051131 10.62077       6.332258 26.05862 7.531430 27.36034 8.554769 -1.301714      11.39765 
1 1 1 -4  8  44 o 12.74058 5.647371 -0.6255437     3.482023 1.535969       4.666291 -3.341376      5.230515 16.43218 6.897616 13.84346 6.433250 2.588719       9.432063 
1 1 1 -4  8  45 o 13.29609 5.784892 0.1740045      3.502058 1.463982       4.414650 -2.015809      5.751867 15.74770 6.664922 15.02223 6.896822 0.7254763      9.591003 
1 1 1 -4  8  46 o 16.34803 6.380880 3.161612       3.673241 3.208963       4.709211 3.088039       5.870005 17.22646 7.051693 18.00205 7.654896 -0.7755890     10.40787 
1 1 1 -4  8  47 o 18.24901 6.847533 4.919007       4.120667 -0.3972532     6.342488 8.802028       5.420525 15.64010 7.203002 22.58975 7.942088 -6.949651      10.72194 
1 1 1 -4  8  48 o 13.81699 5.938977 1.463112       3.602858 0.4249833      4.892758 2.692798       5.325070 14.34006 6.497225 16.24391 7.099232 -1.903851      9.623566 
1 1 1 -4  8  49 o 16.71468 6.487782 4.534383       3.780725 -1.515140      5.246600 11.06893       5.452869 13.13793 6.211415 23.26748 7.977698 -10.12955      10.11065 
1 1 1 -4  8  50 o 12.57918 5.640310 0.9275541      3.578620 -3.704198      5.217418 5.042496       4.917732 11.75878 5.719236 16.56929 7.024506 -4.810512      9.058330 
1 1 1 -4  8  51 f 11.42095 5.377818 -0.7845716     3.860690 2.162955       5.615156 -3.427132      5.316739 14.26146 6.640368 11.64432 5.687730 2.617136       8.743270 
1 1 1 -4  9  1  o 65.66079 2.799371 52.64059       4.468945 51.37186       5.279909 55.84555       8.391776 64.83331 3.353285 67.47528 5.142290 -2.641975      6.139028 
1 1 1 -4  9  2  o 280.0936 4.377273 956.5168       29.87741 908.7497       41.00789 1010.560       43.61894 272.9237 6.165809 287.8031 6.219329 -14.87936      8.757697 
1 1 1 -4  9  3  o 383.7178 5.128333 1795.635       47.95393 1783.862       75.53668 1803.584       62.06493 382.2017 8.110156 384.4514 6.624740 -2.249664      10.47195 
1 1 1 -4  9  4  o 300.9151 4.161081 1103.959       30.51310 1029.664       46.26314 1161.163       40.59449 290.4863 6.535418 308.5501 5.398901 -18.06381      8.477017 
1 1 1 -4  9  5  o 344.5856 5.220651 1448.110       43.83872 1415.012       61.23900 1482.899       62.78450 340.4680 7.381009 348.5385 7.392062 -8.070526      10.44614 
1 1 1 -4  9  6  o 588.5939 9.855876 4234.861       141.3667 4229.422       244.9472 4237.578       173.1053 586.0541 17.16987 588.3082 12.07451 -2.254089      20.99043 
1 1 1 -4  9  7  o 223.2031 4.259907 607.3813       23.17056 631.5942       41.48477 596.4032       27.93373 227.3459 7.498254 221.1456 5.183397 6.200226       9.115449 
1 1 1 -4  9  8  o 345.9749 6.056873 1460.062       51.06569 1456.484       88.71587 1461.834       62.44851 345.0052 10.56456 346.0912 7.404495 -1.085907      12.90103 
1 1 1 -4  9  9  o 422.4521 7.217403 2177.588       74.30097 2179.683       91.28535 2173.477       127.8965 422.5031 8.866151 421.2796 12.47184 1.223511       15.30214 
1 1 1 -4  9  10 o 204.4070 3.470610 509.2391       17.28771 498.4800       24.29944 520.2662       24.60036 202.2066 4.931339 206.5792 4.886736 -4.372574      6.942499 
1 1 1 -4  9  11 o 320.1035 4.904414 1249.116       38.25725 1305.169       55.76595 1199.281       52.58215 327.1228 6.995555 313.5777 6.881086 13.54510       9.812601 
1 1 1 -4  9  12 o 299.0603 4.632953 1090.168       33.76391 1094.870       48.01644 1085.569       47.48674 299.6452 6.575768 298.3714 6.530991 1.273834       9.267932 
1 1 1 -4  9  13 o 314.0634 4.834890 1202.288       37.00327 1171.010       51.66948 1235.220       53.01763 309.8912 6.842088 318.2743 6.835695 -8.383026      9.671654 
1 1 1 -4  9  14 f 215.4546 3.625073 565.7287       19.03306 572.0817       27.23582 559.6649       26.60876 216.6379 5.159053 214.2750 5.095854 2.362823       7.251451 
1 1 1 -4  9  15 o 301.4660 4.677722 1107.736       34.36441 1109.281       48.79412 1106.217       48.40543 301.6221 6.638474 301.2066 6.594677 0.4154663      9.357302 
1 1 1 -4  9  16 o 290.0277 5.210402 1025.385       36.82534 1005.123       62.43716 1036.193       45.60129 286.8798 8.942064 291.5172 6.419139 -4.637451      11.00754 
1 1 1 -4  9  17 o 258.5829 4.157291 814.9756       26.19669 805.7685       36.90670 824.3249       37.19035 257.0767 5.891237 260.0206 5.869302 -2.943909      8.315971 
1 1 1 -4  9  18 o 288.7607 5.279804 1016.548       37.15284 1040.507       45.97044 971.4270       63.08617 292.1028 6.458130 281.9686 9.193443 10.13422       11.23507 
1 1 1 -4  9  19 o 302.6245 5.492281 1116.645       40.50354 1078.272       48.42303 1206.034       73.90617 297.3298 6.683091 314.1285 9.666168 -16.79874      11.75153 
1 1 1 -4  9  20 o 185.9846 3.363209 421.5911       15.24288 411.3878       21.40341 432.0921       21.71330 183.6294 4.787128 188.1990 4.738249 -4.569611      6.735548 
1 1 1 -4  9  21 o 308.3238 5.523203 1159.443       41.49866 1166.831       51.34609 1145.527       70.46953 309.2247 6.813920 306.0307 9.460676 3.194031       11.65907 
1 1 1 -4  9  22 o 59.59353 2.995507 43.39687       4.336214 34.33365       5.919067 53.89510       6.370447 52.85693 4.642427 66.36874 3.956819 -13.51182      6.099881 
1 1 1 -4  9  23 o 328.6714 5.078036 1318.000       40.67183 1301.620       57.17159 1334.784       57.87212 326.4020 7.187725 330.5344 7.184832 -4.132446      10.16293 
1 1 1 -4  9  24 o 297.8730 5.470836 1083.233       39.71192 1068.088       69.66464 1090.523       48.33403 295.0061 9.703685 298.7350 6.639429 -3.728973      11.75770 
1 1 1 -4  9  25 o 196.7020 4.154443 472.1060       19.91396 437.5440       34.80998 488.9199       24.27938 188.9041 7.577193 200.1122 4.978837 -11.20802      9.066568 
1 1 1 -4  9  26 o 299.0226 4.729554 1091.933       34.46358 1118.209       49.52953 1067.271       47.98488 302.2506 6.724514 295.2972 6.668205 6.953339       9.470166 
1 1 1 -4  9  27 o 128.5304 3.603044 201.7574       11.27413 238.0107       23.18534 190.5307       12.90221 139.2083 6.855677 124.8427 4.247149 14.36554       8.064651 
1 1 1 -4  9  28 o 163.7850 3.257495 327.3228       13.00152 330.6040       18.47449 324.1031       18.30058 164.4212 4.615390 162.7950 4.617709 1.626175       6.528788 
1 1 1 -4  9  29 o 96.78203 2.888329 114.3758       6.804422 118.7218       9.620971 110.0263       9.624842 98.50759 4.016287 94.80906 4.176135 3.698532       5.794020 
1 1 1 -4  9  30 o 168.9874 3.327002 348.6266       13.70072 344.8095       19.25489 352.5411       19.49891 167.8302 4.712647 169.7017 4.719653 -1.871429      6.669645 
1 1 1 -4  9  31 o 147.6644 3.161488 266.2107       11.37636 254.2679       15.67023 279.5200       16.54239 144.1024 4.467792 151.0902 4.497898 -6.987793      6.339736 
1 1 1 -4  9  32 o 92.12824 4.112374 104.0160       9.209276 104.0160       9.209276 0.000000       0.000000 92.12824 4.112374 ?        ?        0.000000       4.112374 
1 1 1 -4  9  33 o 33.07663 4.873985 13.69332       3.811011 17.06575       4.967290 8.867719       5.941871 36.84892 5.716822 26.76302 8.273960 10.08591       10.05686 
1 1 1 -4  9  34 o 167.7489 3.397938 343.9962       13.89028 345.6923       19.55331 342.2682       19.73561 167.8243 4.786006 166.9726 4.855464 0.8516388      6.817725 
1 1 1 -4  9  35 f 84.36966 3.097499 87.12128       6.357637 92.58781       8.996064 81.66692       8.986057 86.80941 4.265614 81.46915 4.544272 5.340263       6.232646 
1 1 1 -4  9  36 o 48.13105 4.044536 28.59978       4.700000 26.03395       6.334635 31.74205       7.010193 45.57065 5.838205 50.39404 5.814921 -4.823383      8.240021 
1 1 1 -4  9  37 o 22.13301 7.584116 5.654185       4.927912 16.72608       10.81354 2.752097       5.536204 35.97163 11.16869 19.65308 7.783928 16.31855       13.61357 
1 1 1 -4  9  38 o 92.06635 3.507095 104.1274       7.853978 106.0554       11.96732 102.6687       10.40934 92.42507 5.336067 91.12212 4.703656 1.302956       7.113226 
1 1 1 -4  9  39 o 96.21307 3.155040 113.6928       7.387328 114.4188       10.27349 112.9155       10.63015 96.16309 4.395656 95.46481 4.582794 0.6982803      6.350102 
1 1 1 -4  9  40 o 36.61895 4.851395 16.95729       4.222806 13.92225       5.605162 20.94097       6.421662 32.44388 7.270077 40.13354 6.809162 -7.689659      9.960858 
1 1 1 -4  9  41 o 26.00549 6.107934 8.927862       3.804412 6.965384       5.080724 11.43258       5.739879 23.36900 7.698435 29.06337 7.899346 -5.694372      11.03021 
1 1 1 -4  9  42 f 20.77749 7.022970 5.447953       4.223674 7.313556       4.895548 0.1602155E-01  8.353508 23.49513 7.543832 20.17444 8.852336 3.320683       11.63070 
1 1 1 -4  9  43 o 54.39062 4.090705 37.48489       5.382253 37.52000       6.419827 37.40181       9.874125 53.95110 4.937693 51.61039 8.118860 2.340706       9.502458 
1 1 1 -4  9  44 o 67.69730 3.471423 57.81994       5.707716 62.37366       7.715676 52.31601       8.482574 69.44958 4.584630 62.68945 5.611908 6.760139       7.246541 
1 1 1 -4  9  45 o 19.90681 6.573286 5.597315       3.703382 5.681514       4.587506 5.439775       6.275063 20.21331 7.285030 20.69153 8.257087 -0.4782181     11.01141 
1 1 1 -4  9  46 o 25.47779 6.398691 9.739515       3.966766 7.795200       5.109982 12.68788       6.292552 22.11203 7.715835 27.15853 8.533147 -5.046503      11.50429 
1 1 1 -4  9  47 o 30.85013 6.733677 14.92174       4.919830 17.36943       7.791204 13.29850       6.344820 29.39777 9.523776 26.80162 8.586458 2.596157       12.82301 
1 1 1 -4  9  48 o 19.57050 6.778263 6.409877       3.939910 10.22033       5.532881 2.490084       5.611702 23.13815 8.031507 16.17441 7.169390 6.963739       10.76593 
1 1 1 -4  9  49 o 10.79294 5.129110 -2.300065      3.667590 -5.034032      5.084935 0.6643970      5.294948 11.40849 5.570333 14.22757 6.562849 -2.819080      8.608112 
1 1 1 -4  9  50 o 17.70149 7.047496 6.295771       4.560762 5.033150       5.417264 9.368859       8.451447 16.45185 7.175828 18.49922 8.442884 -2.047375      11.08038 
1 1 1 -4  9  51 o 9.928077 4.810784 -2.969971      3.601377 1.493744       5.309997 -6.772247      4.900810 13.72194 6.411739 10.11834 5.036327 3.603607       8.153219 
1 1 1 -4  10 1  o 627.8406 9.080749 4816.095       138.9335 4955.635       200.3890 4686.931       192.7944 635.9775 12.92993 618.5319 12.79075 17.44562       18.18753 
1 1 1 -4  10 2  o 670.6672 11.19420 5503.291       182.9517 6250.357       345.9591 5213.262       215.5590 711.2599 19.97979 652.1237 13.56439 59.13629       24.14921 
1 1 1 -4  10 3  o 472.6519 9.825875 2730.667       113.1746 2686.705       158.3024 2776.630       161.8630 467.8874 13.89927 475.6400 13.97992 -7.752594      19.71364 
1 1 1 -4  10 4  o 130.4945 2.711758 207.5367       8.623415 220.2943       12.40825 195.6185       11.99304 134.3767 3.793020 126.6164 3.891519 7.760323       5.434236 
1 1 1 -4  10 5  o 258.2794 4.760116 813.3807       29.96012 871.4664       54.15069 787.7560       35.96653 267.0182 8.332185 254.1345 5.807630 12.88376       10.15647 
1 1 1 -4  10 6  o 403.1078 5.370778 1981.619       52.75874 1890.740       81.05521 2048.426       69.49580 393.5072 8.452636 409.7274 6.960292 -16.22015      10.94955 
1 1 1 -4  10 7  o 236.0112 3.445140 678.9145       19.81415 681.3987       31.55756 677.2979       25.45774 236.3827 5.478374 235.7044 4.432167 0.6782684      7.046750 
1 1 1 -4  10 8  o 330.9208 5.827641 1335.439       46.99515 1312.472       57.12096 1383.552       82.67511 327.9926 7.146532 336.3926 10.09681 -8.399994      12.37006 
1 1 1 -4  10 9  o 738.4519 10.61225 6661.100       190.9702 6645.019       269.8069 6677.244       270.3391 736.6272 15.03036 738.4128 15.02358 -1.785645      21.25134 
1 1 1 -4  10 10 o 516.1622 7.540385 3249.885       94.84529 3250.011       134.1671 3249.760       134.0959 515.8807 10.67236 515.8613 10.66710 0.1934814E-01  15.08928 
1 1 1 -4  10 11 o 727.4123 10.45498 6459.699       185.3276 6328.132       258.5571 6598.717       265.7777 719.2744 14.75115 734.4722 14.84934 -15.19788      20.93082 
1 1 1 -4  10 12 o 432.6947 6.405268 2282.766       67.53905 2272.151       95.38354 2293.439       95.64629 431.5417 9.070151 433.5598 9.052803 -2.018005      12.81487 
1 1 1 -4  10 13 o 677.4118 9.762380 5599.686       161.1553 5363.684       221.4179 5865.540       235.0044 662.4995 13.71485 692.7691 13.92039 -30.26965      19.54161 
1 1 1 -4  10 14 o 345.4210 5.255075 1454.439       44.23476 1370.167       60.40129 1551.918       64.96222 335.1920 7.394629 356.7281 7.472870 -21.53607      10.51305 
1 1 1 -4  10 15 o 90.82071 2.853665 100.6152       6.307899 93.26751       10.44099 104.8386       7.915822 87.33430 4.925890 92.68329 3.511111 -5.348991      6.049156 
1 1 1 -4  10 16 o 545.9866 7.953217 3636.354       105.8183 3610.958       149.0966 3662.130       150.2089 543.7659 11.25174 547.6048 11.25622 -3.838867      15.91553 
1 1 1 -4  10 17 o 111.6052 3.265824 151.9279       8.872500 149.4011       10.61436 157.7880       16.16449 110.6451 3.942942 113.6089 5.858452 -2.963783      7.061746 
1 1 1 -4  10 18 o 187.9214 3.954909 430.4350       18.11127 426.8512       21.87506 438.2461       32.29457 187.0607 4.802750 189.4203 7.008359 -2.359543      8.496088 
1 1 1 -4  10 19 o 272.0096 4.352435 901.9478       28.85046 928.1874       41.56982 877.5642       40.07276 275.8711 6.183521 268.2449 6.130300 7.626251       8.707268 
1 1 1 -4  10 20 o 137.4761 3.347119 230.3594       11.21333 222.9734       13.99382 243.6098       18.74340 135.1736 4.253527 141.2306 5.456338 -6.056976      6.918390 
1 1 1 -4  10 21 o 174.4094 3.278597 370.7816       13.93458 391.2972       20.31781 352.5618       19.14720 179.0729 4.659937 169.9741 4.626906 9.098785       6.566832 
1 1 1 -4  10 22 o 82.68577 2.805595 83.43086       5.644979 84.20120       8.093291 82.70106       7.877492 83.00165 4.013205 82.26177 3.941114 0.7398758      5.624784 
1 1 1 -4  10 23 o 233.7666 3.932785 666.4475       22.40365 634.8888       31.01336 700.8895       32.39914 228.0596 5.580387 239.6232 5.548409 -11.56358      7.869279 
1 1 1 -4  10 24 o 171.0768 3.845736 356.9922       16.03270 333.9843       28.54190 367.5988       19.37899 165.1048 7.110600 173.4996 4.587518 -8.394730      8.462030 
1 1 1 -4  10 25 o 325.1538 5.059593 1291.210       40.09041 1284.858       56.72144 1297.551       56.67141 323.9696 7.184670 325.5749 7.142941 -1.605255      10.13119 
1 1 1 -4  10 26 o 159.7955 3.775523 311.6104       14.70204 330.7664       28.08464 304.3791       17.25528 164.1699 7.036353 157.8161 4.491348 6.353867       8.347603 
1 1 1 -4  10 27 o 72.06212 3.130091 63.47049       5.483565 52.53596       8.205140 72.29607       7.371530 65.34847 5.195190 76.85260 3.949316 -11.50413      6.525879 
1 1 1 -4  10 28 o 175.7254 3.349076 376.8479       14.34154 369.3044       20.12851 384.6259       20.43906 173.7528 4.758310 177.3266 4.734125 -3.573761      6.712187 
1 1 1 -4  10 29 o 183.3335 3.437315 410.3173       15.35668 428.3846       22.18242 393.6888       21.28087 187.0840 4.869737 179.3419 4.873874 7.742096       6.889774 
1 1 1 -4  10 30 o 81.05846 2.933931 80.28894       5.785852 78.44558       7.984313 82.32733       8.396070 80.00956 4.108815 81.95798 4.218053 -1.948425      5.888492 
1 1 1 -4  10 31 f 130.0695 3.453472 206.7942       10.93661 213.3339       13.68019 195.2125       18.20542 132.0033 4.258336 125.9752 5.947130 6.028160       7.314491 
1 1 1 -4  10 32 o 36.19840 5.215238 16.39065       4.467880 16.40647       5.028060 16.33131       9.740227 36.08770 5.922773 35.80426 10.49046 0.2834396      12.04695 
1 1 1 -4  10 33 o 98.74168 3.049278 119.2019       7.328463 132.8097       10.47234 106.1429       10.25898 104.0866 4.136932 92.97250 4.541818 11.11413       6.143477 
1 1 1 -4  10 34 o 136.0434 3.176334 226.1884       10.53028 225.4470       14.79837 226.9488       14.98756 135.5447 4.486359 135.9868 4.529021 -0.4420471     6.374908 
1 1 1 -4  10 35 o 12.40456 5.600416 -1.893378      3.597365 -4.743846      4.604895 2.570310       5.762468 12.60334 5.915319 19.83566 7.913615 -7.232326      9.880095 
1 1 1 -4  10 36 o 26.34111 6.454114 8.931043       4.109869 6.404873       5.628638 11.81597       6.015049 23.58840 8.104667 30.22112 8.031214 -6.632719      11.40991 
1 1 1 -4  10 37 o 76.33373 3.534188 71.57246       6.556348 69.05723       10.02937 73.44943       8.663923 74.53456 5.561890 77.11024 4.632050 -2.575684      7.238128 
1 1 1 -4  10 38 f 162.6335 3.413676 324.4864       13.52909 331.9732       19.25388 317.1847       19.01440 163.8741 4.826645 160.1549 4.877675 3.719162       6.862085 
1 1 1 -4  10 39 f 79.30156 3.539442 77.49494       6.822709 76.53448       10.38206 78.22503       9.051706 78.19789 5.482939 79.33667 4.702983 -1.138779      7.223619 
1 1 1 -4  10 40 o 98.16286 3.161010 118.6854       7.551661 104.3694       10.09349 136.8881       11.38146 91.51962 4.539927 104.8781 4.463456 -13.35851      6.366582 
1 1 1 -4  10 41 o 52.77175 4.254178 34.92402       5.424502 30.96369       6.431755 44.68210       10.09593 49.21875 5.453861 58.26691 7.267894 -9.048161      9.086633 
1 1 1 -4  10 42 o 22.45836 6.419572 6.762072       3.689147 5.381316       4.893528 8.580024       5.615065 21.04153 7.531376 25.13855 8.079949 -4.097015      11.04569 
1 1 1 -4  10 43 o 38.66299 5.203804 19.58883       4.778519 18.47440       5.404502 23.58094       10.22891 36.99910 6.214243 38.65832 10.56089 -1.659225      12.25354 
1 1 1 -4  10 44 f 31.52973 5.295962 13.37576       3.925009 13.16943       5.131329 13.66672       6.093444 30.21993 7.090737 30.11644 8.119296 0.1034946      10.77968 
1 1 1 -4  10 45 o 14.48820 6.086607 1.331376       3.638138 0.4646808      4.579782 2.813812       5.989626 14.96455 6.560783 18.21304 7.738100 -3.248484      10.14505 
1 1 1 -4  10 46 o 40.79844 5.060670 23.08146       4.923583 24.26024       7.400227 22.14521       6.595109 38.38332 8.163004 37.42817 7.492433 0.9551468      11.08022 
1 1 1 -4  10 47 o 20.98884 6.808035 7.137002       3.980626 11.46543       5.851778 3.409104       5.430688 25.00743 8.263019 17.17131 7.334151 7.836124       11.04840 
1 1 1 -4  10 48 o 29.97916 5.942885 14.00007       4.188172 24.81672       6.287384 5.372099       5.615363 38.71532 6.918164 18.11822 7.583384 20.59710       10.26493 
1 1 1 -4  10 49 o 17.34778 6.636091 5.290658       3.914690 -1.226384      5.393715 12.54494       5.690625 13.21849 6.263819 24.11544 8.151838 -10.89695      10.28046 
1 1 1 -4  10 50 o 16.19669 6.379330 4.730032       3.699720 3.142848       5.390373 6.143683       5.087171 15.07298 6.825428 17.24901 7.218634 -2.176027      9.934543 
1 1 1 -4  11 1  o 341.9604 5.206492 1425.941       43.38675 1293.774       81.70954 1477.837       51.20108 325.1882 10.32411 348.0801 6.036203 -22.89194      11.95922 
1 1 1 -4  11 2  o 433.2240 5.742366 2289.007       60.62329 2446.313       100.0555 2197.761       76.20364 447.5304 9.174497 424.3702 7.368765 23.16019       11.76733 
1 1 1 -4  11 3  o 348.9461 4.324650 1484.413       36.77438 1526.243       52.89925 1445.291       51.15811 353.7328 6.136745 344.2263 6.098660 9.506500       8.651780 
1 1 1 -4  11 4  o 465.4117 6.125612 2642.004       69.47410 2651.173       89.93716 2628.437       109.4000 466.0557 7.918907 463.8537 9.678323 2.201965       12.50516 
1 1 1 -4  11 5  o 400.3671 5.343453 1954.554       52.13346 1917.225       81.50836 1980.398       67.82024 396.3042 8.439901 402.9043 6.907506 -6.600128      10.90622 
1 1 1 -4  11 6  o 41.25285 2.801863 20.83506       2.799962 19.03511       4.547964 21.93370       3.553168 39.21438 4.863386 42.27899 3.479464 -3.064610      5.979899 
1 1 1 -4  11 7  o 198.1864 3.425205 478.7054       16.54232 472.6731       23.43774 484.6932       23.35124 196.9069 4.884486 199.3965 4.805697 -2.489655      6.852221 
1 1 1 -4  11 8  o 1033.838 13.21539 13069.47       332.9419 12126.82       499.2737 13824.34       446.7880 993.3236 20.62585 1061.941 17.26493 -68.61755      26.89802 
1 1 1 -4  11 9  o 501.0724 7.335023 3062.253       89.56494 3085.691       127.4455 3039.381       125.8966 502.7325 10.40283 498.9503 10.35430 3.782166       14.67755 
1 1 1 -4  11 10 o 560.1343 8.144549 3827.203       111.1720 3790.246       156.3297 3865.015       158.1275 557.1089 11.51504 562.5748 11.53430 -5.465942      16.29835 
1 1 1 -4  11 11 o 678.1573 9.774545 5612.215       161.5337 5469.374       224.5956 5765.282       232.4955 668.9651 13.77722 686.8058 13.89135 -17.84064      19.56480 
1 1 1 -4  11 12 o 365.9087 5.522950 1632.148       49.24702 1609.632       69.20643 1655.245       70.09366 363.2888 7.817328 368.4007 7.807684 -5.111877      11.04855 
1 1 1 -4  11 13 o 289.8167 5.231325 1023.864       36.94632 1051.578       46.37514 975.7110       61.12931 293.6787 6.480025 282.6642 8.885512 11.01453       10.99741 
1 1 1 -4  11 14 o 216.4948 3.664263 571.2137       19.33171 571.8672       27.58258 570.5827       27.10208 216.5936 5.225806 216.3518 5.140509 0.2417908      7.330339 
1 1 1 -4  11 15 o 239.7430 4.502986 700.5757       26.30768 681.5416       44.48188 710.8150       32.62522 236.2541 7.736663 241.4661 5.544485 -5.211945      9.518260 
1 1 1 -4  11 16 o 433.2053 7.451237 2289.070       78.66077 2250.554       95.15934 2372.173       139.7773 429.4327 9.093272 440.3214 13.04095 -10.88870      15.89824 
1 1 1 -4  11 17 o 135.6517 3.471486 224.4152       11.46621 231.6905       14.00904 209.6494       19.95767 137.8070 4.176404 130.9683 6.271501 6.838730       7.534857 
1 1 1 -4  11 18 o 349.8023 6.194486 1492.292       52.80365 1509.781       64.97749 1458.284       90.60982 351.7650 7.580087 345.3022 10.78133 6.462799       13.17933 
1 1 1 -4  11 19 o 204.7751 3.579961 511.1130       17.86453 502.7267       25.19862 519.5873       25.33041 202.9867 5.098202 206.4293 5.035409 -3.442596      7.165683 
1 1 1 -4  11 20 o 231.9137 4.447777 655.7702       25.13653 640.7162       30.82187 685.6680       43.43638 229.1946 5.518468 236.8731 7.534502 -7.678482      9.339283 
1 1 1 -4  11 21 o 269.8617 4.342088 888.0524       28.55459 892.2572       40.68248 883.9695       40.08865 270.3885 6.174234 269.1342 6.112466 1.254333       8.688119 
1 1 1 -4  11 22 o 131.4796 2.940427 210.7292       9.421169 209.6971       13.51065 211.7060       13.14401 131.0562 4.235974 131.6914 4.100756 -0.6351624     5.895734 
1 1 1 -4  11 23 o 176.8640 3.329070 381.4219       14.34823 371.7273       20.17758 391.3385       20.40730 174.4708 4.750230 179.0228 4.681812 -4.552063      6.669636 
1 1 1 -4  11 24 o 250.9056 4.834446 768.5380       29.55924 811.0602       54.47624 750.7943       35.19016 257.0528 8.709162 247.8843 5.825540 9.168518       10.47790 
1 1 1 -4  11 25 o 83.39365 3.519925 84.99272       7.137149 106.0140       15.06247 78.90652       8.104753 92.83028 6.703558 80.29707 4.156085 12.53320       7.887379 
1 1 1 -4  11 26 o 224.5497 4.381759 615.7596       23.97713 638.0508       41.28852 604.4170       29.45222 227.9755 7.441960 222.3370 5.435885 5.638550       9.215835 
1 1 1 -4  11 27 f 76.28008 2.879699 71.07583       5.343353 72.43968       7.626838 69.76105       7.488349 76.91283 4.083843 75.47310 4.086777 1.439735       5.777502 
1 1 1 -4  11 28 o 54.74793 3.231804 36.70453       4.292522 31.43069       5.814744 43.02051       6.363370 50.47968 4.784009 59.16788 4.445832 -8.688210      6.530863 
1 1 1 -4  11 29 o 121.4839 2.959728 180.0925       8.762070 179.9876       12.41969 180.1964       12.36337 121.2833 4.208547 121.3564 4.186868 -0.7304382E-01 5.936474 
1 1 1 -4  11 30 f 42.66944 3.790806 22.41941       3.900725 20.57988       5.222137 24.74123       5.866903 40.63233 5.408177 44.59782 5.515772 -3.965485      7.724773 
1 1 1 -4  11 31 o 52.04510 3.776056 33.27892       4.756533 34.01761       5.935351 31.95293       7.952182 52.50687 4.687936 50.55257 6.613602 1.954296       8.106570 
1 1 1 -4  11 32 o 131.4610 3.596871 211.3976       11.51197 207.7350       13.76045 219.9397       21.01428 130.1997 4.343050 133.5145 6.478105 -3.314835      7.799226 
1 1 1 -4  11 33 o 142.3584 3.167907 247.6088       10.98985 251.1438       15.59201 244.1188       15.49245 143.1066 4.476521 141.0818 4.512030 2.024841       6.355915 
1 1 1 -4  11 34 o 87.81729 3.103562 94.36424       6.631217 94.15098       9.126081 94.60280       9.651910 87.54948 4.290613 87.71934 4.530601 -0.1698532     6.239848 
1 1 1 -4  11 35 o 26.36547 6.179241 8.926217       3.900500 11.92761       5.112935 4.747771       6.032760 30.42242 7.036792 22.20566 8.294899 8.216763       10.87758 
1 1 1 -4  11 36 o 80.50255 4.015159 79.68938       7.851914 82.54147       15.61612 78.72435       9.083680 80.85721 8.031399 79.88056 4.687024 0.9766464      9.299008 
1 1 1 -4  11 37 o 81.78657 3.531476 82.17329       7.021819 80.46962       10.71150 83.45712       9.298448 80.46715 5.495539 82.17689 4.662406 -1.709740      7.206870 
1 1 1 -4  11 38 f 10.24297 4.893318 -4.565685      3.429231 -5.631392      4.320578 -2.751447      5.637283 11.53226 5.504658 15.49439 7.001630 -3.962137      8.906407 
1 1 1 -4  11 39 o 76.67953 3.263201 72.38937       6.083664 72.72449       8.280824 71.99639       8.967325 76.51633 4.460364 75.99318 4.867904 0.5231552      6.602374 
1 1 1 -4  11 40 o 48.96392 4.302298 30.00510       5.081349 29.06321       7.334517 30.87444       7.046369 47.38986 6.524055 49.07269 6.018207 -1.682827      8.875928 
1 1 1 -4  11 41 o 27.50661 6.540193 10.12598       4.319404 10.10383       5.150565 10.17848       7.929791 27.27978 7.510706 27.73071 9.615644 -0.4509220     12.20128 
1 1 1 -4  11 42 o 24.71675 6.466105 8.300270       3.938628 5.871645       5.072869 11.98621       6.249530 21.64411 7.676562 29.07155 8.369786 -7.427443      11.35707 
1 1 1 -4  11 43 o 19.91283 6.918875 5.139478       4.106580 3.013524       4.652590 12.63584       8.736613 17.88166 7.118464 28.77700 10.08558 -10.89534      12.34469 
1 1 1 -4  11 44 o 13.87894 5.889675 0.8007628      3.462832 -0.6783860     4.340693 3.389918       5.742913 13.97524 6.243029 18.84876 7.759282 -4.873521      9.959009 
1 1 1 -4  11 45 o 27.80330 5.984711 11.10412       3.934700 7.261210       4.959236 17.63335       6.464213 21.83851 7.602396 33.31567 8.052274 -11.47716      11.07409 
1 1 1 -4  11 46 o 14.66602 6.226545 1.631536       3.873318 1.115689       5.758167 2.057837       5.234589 16.13241 7.199682 16.33373 7.089824 -0.2013245     10.10451 
1 1 1 -4  11 47 o 24.25279 8.559987 11.37759       6.301307 -2.244365      9.173951 23.54452       8.670161 16.56667 7.938291 33.42052 9.925247 -16.85386      12.70933 
1 1 1 -4  11 48 o 27.69945 6.223335 12.39523       4.098029 14.07945       5.930997 10.85659       5.668862 26.51525 8.277592 23.16843 8.123821 3.346817       11.59806 
1 1 1 -4  11 49 o 11.78866 5.592860 -1.759021      4.324698 -2.918999      5.306588 0.5350894      7.462730 12.28531 5.925245 15.11377 7.219782 -2.828464      9.339903 
1 1 1 -4  11 50 o 18.00258 6.771502 6.499970       4.034943 3.859577       5.712008 9.129784       5.700552 15.46369 7.011819 19.33392 7.816131 -3.870227      10.50036 
1 1 1 -4  12 1  o 92.17120 2.318022 103.5919       5.202405 101.9528       7.993399 104.7964       6.852330 91.38927 3.596241 92.68087 3.038081 -1.291595      4.707748 
1 1 1 -4  12 2  o 332.7539 4.553329 1349.776       36.92226 1347.158       58.22939 1351.536       47.74852 332.3115 7.190528 332.9170 5.885561 -0.6055298     9.292122 
1 1 1 -4  12 3  o 237.8992 3.907885 689.8315       22.65535 699.0758       32.17011 680.7359       31.91048 239.4467 5.513249 236.2841 5.541953 3.162598       7.817235 
1 1 1 -4  12 4  o 332.3957 4.154454 1346.732       33.65158 1306.108       46.70803 1390.578       48.52499 327.2827 5.856422 337.6985 5.896580 -10.41574      8.310676 
1 1 1 -4  12 5  o 367.6585 4.961657 1647.851       44.45364 1704.217       58.64978 1571.750       68.14783 373.8281 6.438109 358.9338 7.791150 14.89435       10.10699 
1 1 1 -4  12 6  o 707.9873 10.19381 6119.840       175.8726 6247.094       252.4414 5999.820       245.1612 714.5686 14.49708 700.3097 14.36566 14.25891       20.40925 
1 1 1 -4  12 7  o 224.5869 3.762027 614.7343       20.58933 601.5448       28.90221 628.3246       29.33810 222.1352 5.339217 227.0268 5.302967 -4.891525      7.525204 
1 1 1 -4  12 8  o 432.5069 5.735200 2280.538       60.44741 2267.376       95.33623 2289.387       78.16846 431.0740 9.075489 433.2636 7.403605 -2.189636      11.71230 
1 1 1 -4  12 9  o 656.5573 8.473764 5258.446       135.5767 5335.614       216.7694 5208.864       173.7560 660.7710 13.46204 653.2037 10.91579 7.567322       17.33150 
1 1 1 -4  12 10 o 115.1220 2.760220 161.5007       7.743513 151.3962       11.00171 171.4209       10.90095 111.3808 4.060139 118.5386 3.778535 -7.157829      5.546355 
1 1 1 -4  12 11 o 246.1376 4.026516 738.3668       24.15147 725.6733       34.05953 751.2042       34.25195 243.9810 5.728575 248.2373 5.662160 -4.256271      8.054603 
1 1 1 -4  12 12 o 657.2173 9.487889 5270.473       151.9549 5338.787       216.9649 5204.703       212.8866 660.9801 13.46992 652.6389 13.38564 8.341187       18.98984 
1 1 1 -4  12 13 o 220.2934 3.728722 591.4391       20.01693 602.4994       28.80289 581.1074       27.83818 222.3169 5.316520 218.3361 5.232139 3.980789       7.459267 
1 1 1 -4  12 14 o 146.7637 3.389717 262.5019       12.12323 289.8181       21.58825 249.9198       14.65163 154.0737 5.759942 143.1336 4.205128 10.94011       7.131622 
1 1 1 -4  12 15 o 144.2233 3.534496 253.5019       12.42222 248.1871       14.92572 265.4806       22.40773 142.6306 4.299151 147.4217 6.251546 -4.791122      7.587129 
1 1 1 -4  12 16 o 463.7602 6.854606 2623.139       77.46616 2643.521       110.1737 2603.210       108.9440 465.3270 9.715913 461.7687 9.681504 3.558289       13.71607 
1 1 1 -4  12 17 o 295.1979 5.403717 1062.508       38.87246 1091.030       48.20253 1009.457       65.73891 299.0826 6.613672 287.3808 9.399686 11.70181       11.49325 
1 1 1 -4  12 18 o 334.3924 5.143582 1363.423       41.91391 1330.988       58.59700 1397.404       59.97755 330.2722 7.280601 338.4126 7.272875 -8.140350      10.29086 
1 1 1 -4  12 19 o 145.0747 3.411133 256.5389       12.05942 260.3789       15.42268 250.4971       19.34556 146.0752 4.337390 143.2043 5.554096 2.870941       7.047052 
1 1 1 -4  12 20 o 538.5818 7.882341 3543.156       103.4530 3619.289       148.5977 3471.547       144.1145 543.6454 11.21658 532.4598 11.10669 11.18555       15.78512 
1 1 1 -4  12 21 o 52.56316 3.098581 33.79731       3.951387 31.73350       5.949572 35.42606       5.285411 50.77141 4.868308 53.74561 4.065675 -2.974205      6.342723 
1 1 1 -4  12 22 o 132.3682 2.947214 213.6027       9.506739 203.8758       13.50845 223.1478       13.38157 129.2091 4.296161 135.1997 4.066203 -5.990601      5.915319 
1 1 1 -4  12 23 o 158.4877 3.176536 306.2883       12.26833 293.3464       17.33307 319.2811       17.36705 154.9705 4.594838 161.6968 4.411583 -6.726303      6.369820 
1 1 1 -4  12 24 o 172.2525 3.871196 362.0283       16.24975 383.5279       30.93887 353.8382       19.09566 176.8474 7.194112 170.1815 4.608784 6.665970       8.543777 
1 1 1 -4  12 25 o 177.3110 3.350494 383.5428       14.47707 382.8223       20.65355 384.2386       20.29840 176.9657 4.793688 177.3039 4.702090 -0.3381958     6.714841 
1 1 1 -4  12 26 o 59.61100 3.326149 43.49166       4.812587 36.64352       7.234213 48.92855       6.445856 54.45884 5.527629 63.15945 4.212067 -8.700611      6.949546 
1 1 1 -4  12 27 o 139.3488 3.059774 236.9104       10.39032 235.8497       14.76318 237.9515       14.62603 138.8737 4.367814 139.4987 4.307656 -0.6249695     6.134631 
1 1 1 -4  12 28 o 86.80072 2.894716 92.02683       6.114450 89.13934       8.581588 95.00426       8.714215 85.31627 4.139978 88.09180 4.070354 -2.775528      5.805791 
1 1 1 -4  12 29 o 171.4324 3.349225 358.8165       13.99179 355.0359       19.73880 362.6345       19.83631 170.2852 4.761397 172.1039 4.734201 -1.818756      6.714429 
1 1 1 -4  12 30 o 46.13777 3.941504 26.20691       4.389138 24.33677       5.401383 29.84222       7.530753 44.28724 5.097720 48.86498 6.484063 -4.577740      8.248019 
1 1 1 -4  12 31 o 90.05655 3.522004 99.24847       7.714416 100.3295       9.069123 96.41899       14.67249 90.47399 4.124289 88.22171 6.879182 2.252281       8.020780 
1 1 1 -4  12 32 o 121.8265 3.636349 181.6119       10.78343 201.9768       13.27425 142.0933       18.49137 128.3835 4.248770 107.0661 7.127895 21.31743       8.298128 
1 1 1 -4  12 33 o 48.35196 3.825483 28.78307       4.470803 31.11122       6.082816 26.04773       6.593338 50.09813 5.051403 45.60372 6.084619 4.494411       7.908176 
1 1 1 -4  12 34 o 91.32826 3.107417 102.0701       6.905701 110.8899       9.725917 93.10295       9.806857 95.02895 4.210349 86.98264 4.643418 8.046310       6.268044 
1 1 1 -4  12 35 o 131.0480 3.172785 210.0578       10.13228 201.7759       13.97631 219.2323       14.71028 128.1171 4.483520 133.5392 4.526938 -5.422028      6.371429 
1 1 1 -4  12 36 o 48.56795 5.971301 29.61787       6.918738 0.000000       0.000000 29.61787       6.918738 ?        ?        48.56795 5.971301 0.000000       5.971301 
1 1 1 -4  12 37 o 57.41724 3.649953 40.62326       5.080560 36.42860       6.787288 45.96869       7.661957 54.03474 5.219397 60.75297 5.226045 -6.718227      7.386045 
1 1 1 -4  12 38 o 127.3046 3.172556 198.8439       9.842138 190.4143       13.61091 208.0821       14.24876 124.0611 4.509606 129.6935 4.515290 -5.632370      6.381566 
1 1 1 -4  12 39 o 25.84476 6.013948 8.721982       3.716216 7.997414       4.879920 9.722294       5.733776 24.81702 7.464292 27.18912 8.070575 -2.372105      10.99317 
1 1 1 -4  12 40 o 42.11872 4.769207 22.44716       4.809016 19.94322       5.751125 28.26774       8.768465 39.15970 6.235573 45.88409 8.140046 -6.724384      10.25391 
1 1 1 -4  12 41 o 46.05700 4.450958 26.85307       4.933400 22.16070       6.914131 31.71974       7.041370 40.56178 7.261608 49.39323 5.971016 -8.831448      9.401275 
1 1 1 -4  12 42 o 46.84023 4.076590 27.81057       4.606901 26.33431       5.988127 29.95156       7.211349 44.81686 5.605170 47.34059 6.415948 -2.523735      8.519526 
1 1 1 -4  12 43 o 19.15080 6.700408 4.739054       3.855024 2.924590       4.326283 11.73295       8.493771 17.35636 6.878844 27.67677 9.920444 -10.32040      12.07202 
1 1 1 -4  12 44 o 15.25433 6.134914 2.113199       3.492028 1.376203       4.379796 3.399213       5.785543 15.60911 6.623801 18.74507 7.759242 -3.135962      10.20199 
1 1 1 -4  12 45 o 29.76617 6.471725 13.12791       4.560246 12.85202       6.304892 13.43058       6.603812 27.55194 8.523833 27.95904 8.735423 -0.4070950     12.20505 
1 1 1 -4  12 46 o 19.41739 6.684490 5.819808       3.829438 3.040523       5.207725 9.091945       5.650635 16.96321 7.211541 22.84361 8.101937 -5.880404      10.84655 
1 1 1 -4  12 47 o 12.37444 5.819863 -2.158545      4.497651 -0.5445856E-01 8.650153 -2.938146      5.265359 16.84656 7.968029 12.92431 6.143033 3.922252       10.06113 
1 1 1 -4  12 48 o 18.97345 7.203417 6.592263       4.590654 5.092829       5.595181 9.680559       8.029892 17.49108 7.456783 20.38058 8.813887 -2.889502      11.54505 
1 1 1 -4  12 49 o 19.26088 7.177273 7.498761       4.511141 7.999277       5.562276 6.536805       7.711191 19.04342 7.712779 17.55686 8.032456 1.486559       11.13586 
1 1 1 -4  12 50 o 11.27464 5.306186 -0.9116686     3.749892 -7.097895      5.397165 4.861527       5.213879 10.61904 5.285495 15.93685 6.993266 -5.317810      8.765969 
1 1 1 -4  13 1  o 372.8418 5.035459 1694.573       45.75091 1874.946       77.05840 1596.378       56.85649 392.0382 8.065949 361.8234 6.448329 30.21475       10.32669 
1 1 1 -4  13 2  o 54.78775 2.510374 36.65508       3.342737 32.59243       4.970165 40.01060       4.516956 51.55826 3.986770 57.20594 3.253592 -5.647678      5.145891 
1 1 1 -4  13 3  o 295.9331 4.630414 1067.488       33.39254 1095.177       47.84103 1041.181       46.63059 299.6880 6.550810 292.2069 6.548538 7.481079       9.262637 
1 1 1 -4  13 4  o 581.4567 6.902861 4122.952       97.80984 4053.229       136.6765 4196.140       140.0325 576.2786 9.732520 586.3431 9.800338 -10.06451      13.81190 
1 1 1 -4  13 5  o 365.3927 5.533267 1627.623       49.26942 1669.506       57.85014 1517.009       94.01256 370.0307 6.415500 352.3182 10.96336 17.71246       12.70251 
1 1 1 -4  13 6  o 521.4879 7.626647 3316.726       96.92012 3229.841       134.7384 3409.885       139.5180 514.3698 10.74929 528.5040 10.83293 -14.13422      15.26105 
1 1 1 -4  13 7  o 1065.324 13.60148 13869.25       353.1050 14364.06       572.0264 13564.64       448.8220 1081.696 21.70075 1052.542 17.49840 29.15332       27.87682 
1 1 1 -4  13 8  o 771.3676 9.906137 7260.910       186.2095 7192.496       292.5650 7307.497       241.4230 766.8504 15.65581 773.4423 12.80899 -6.591858      20.22806 
1 1 1 -4  13 9  o 944.0563 12.07227 10883.88       277.7301 10693.75       433.6877 11016.05       361.6051 934.2039 19.05019 949.0457 15.63548 -14.84180      24.64504 
1 1 1 -4  13 10 o 620.1208 8.031758 4690.277       121.3733 4398.487       183.8927 4915.505       161.5626 600.0812 12.57530 634.6132 10.44710 -34.53198      16.34870 
1 1 1 -4  13 11 o 607.4203 8.811320 4501.230       130.4267 4283.818       178.4935 4750.303       191.0482 592.2081 12.36835 623.5936 12.57202 -31.38550      17.63610 
1 1 1 -4  13 12 o 198.9630 4.033056 482.4709       19.55432 497.4150       24.75531 457.6754       31.88740 202.0054 5.028857 193.6164 6.768765 8.389053       8.432413 
1 1 1 -4  13 13 o 383.1658 6.643949 1790.297       62.03676 1722.988       104.6088 1826.810       77.04745 375.4270 11.44759 386.9746 8.170331 -11.54761      14.06420 
1 1 1 -4  13 14 o 391.8774 5.894645 1872.395       56.29166 1872.532       79.79974 1872.259       79.41848 391.7593 8.358842 391.7332 8.319461 0.2612305E-01  11.79337 
1 1 1 -4  13 15 o 366.9670 5.576890 1641.891       49.87181 1534.638       67.71088 1769.067       73.73197 354.6659 7.834349 380.7857 7.945827 -26.11978      11.15855 
1 1 1 -4  13 16 o 463.2796 7.936235 2618.997       89.59707 2608.428       109.2848 2640.665       156.4799 462.1748 9.703248 464.2877 13.84589 -2.112885      16.90744 
1 1 1 -4  13 17 o 279.8086 4.464048 954.4648       30.43870 936.7367       42.84212 972.5358       43.25447 277.1226 6.343998 282.3710 6.286005 -5.248474      8.930856 
1 1 1 -4  13 18 o 233.0651 4.475132 662.2708       25.41670 654.2072       31.45998 677.4261       43.12945 231.6015 5.574181 235.4609 7.526225 -3.859467      9.365658 
1 1 1 -4  13 19 o 448.1733 6.652989 2451.540       72.66058 2514.346       104.7132 2393.217       100.9076 453.4805 9.475599 442.4411 9.359060 11.03946       13.31837 
1 1 1 -4  13 20 f 223.5937 3.805480 609.5730       20.73505 620.9875       29.92582 599.0330       28.75669 225.5958 5.443510 221.5788 5.325675 4.017044       7.615419 
1 1 1 -4  13 21 o 328.0251 5.084977 1313.039       40.64735 1354.569       58.85791 1275.172       56.20207 332.9117 7.255039 323.0234 7.139737 9.888245       10.17897 
1 1 1 -4  13 22 o 167.7294 3.245814 343.0451       13.26689 333.5604       18.75828 352.5377       18.76615 165.2630 4.662466 169.9131 4.536289 -4.650177      6.505114 
1 1 1 -4  13 23 o 99.45788 3.359545 120.7830       8.130773 114.2742       15.84837 123.1081       9.472367 96.41409 6.788805 100.3766 3.879793 -3.962486      7.819250 
1 1 1 -4  13 24 o 183.1686 3.396668 409.2874       15.16143 408.4755       21.71278 410.0600       21.18014 182.8060 4.878398 183.1756 4.748882 -0.3696747     6.808132 
1 1 1 -4  13 25 o 42.85977 3.758051 22.59140       3.885402 28.00930       6.247894 19.17489       4.961455 47.54747 5.493142 39.24943 5.324456 8.298042       7.650126 
1 1 1 -4  13 26 o 30.63056 4.537719 11.70992       3.284804 13.52989       4.666684 9.922765       4.624432 32.72603 6.075268 27.90061 6.852276 4.825424       9.157651 
1 1 1 -4  13 27 o 77.26406 2.917938 72.93416       5.484141 68.50718       7.681833 77.53572       7.831835 74.76427 4.233631 79.57135 4.052314 -4.807076      5.860451 
1 1 1 -4  13 28 o 232.9856 3.980962 663.1902       22.60233 645.1344       31.63782 682.0116       32.30155 229.4765 5.657600 235.9530 5.617742 -6.476517      7.972920 
1 1 1 -4  13 29 o 108.0351 2.945417 142.5540       7.747159 136.4404       10.76426 149.1237       11.15866 105.5599 4.192895 110.3691 4.156281 -4.809258      5.903816 
1 1 1 -4  13 30 o 83.04206 3.275904 84.34801       6.616259 76.10810       8.175972 99.98199       11.26193 78.76421 4.275686 90.18436 5.145784 -11.42015      6.690335 
1 1 1 -4  13 31 o 124.8434 3.611279 190.6615       10.97504 186.3401       12.95909 201.6228       20.63931 123.3137 4.319149 127.7887 6.650647 -4.474983      7.930079 
1 1 1 -4  13 32 o 65.53120 3.205748 52.59303       5.103801 50.07004       6.998133 55.45978       7.459685 63.77011 4.532827 67.12264 4.588118 -3.352528      6.449601 
1 1 1 -4  13 33 o 20.40585 6.427672 5.075441       3.568219 9.402444       4.800200 -0.2682640     5.334418 27.08661 7.163520 16.85233 7.234845 10.23429       10.18131 
1 1 1 -4  13 34 o 23.51485 6.327905 7.064145       3.705345 6.018476       4.833993 8.553740       5.769566 22.57122 7.511917 26.22922 8.160419 -3.657997      11.09150 
1 1 1 -4  13 35 o 95.33345 3.143044 111.2990       7.291852 107.0974       10.04307 115.9833       10.60427 93.28155 4.430758 97.06838 4.495185 -3.786835      6.311759 
1 1 1 -4  13 36 o 51.42517 4.889946 32.88270       6.054300 32.98339       11.82109 32.84689       7.048985 50.01564 10.04788 51.20267 5.748506 -1.187035      11.57606 
1 1 1 -4  13 37 o 101.2757 3.131056 125.8268       7.718098 128.7482       10.84757 122.8315       10.98378 102.1199 4.369086 99.69161 4.533098 2.428329       6.295863 
1 1 1 -4  13 38 o 84.33665 3.155090 87.44186       6.472883 82.46941       8.921001 92.97007       9.406348 81.52139 4.508170 86.58185 4.473353 -5.060455      6.350944 
1 1 1 -4  13 39 o 52.48027 3.705389 34.17949       4.708307 30.72289       6.335574 38.44331       7.036562 49.24651 5.365966 55.17068 5.298865 -5.924171      7.541324 
1 1 1 -4  13 40 o 69.84119 3.421457 60.46474       5.805439 54.82581       7.721214 67.79859       8.805485 65.93322 4.839284 73.29342 4.959261 -7.360199      6.929137 
1 1 1 -4  13 41 o 28.19571 5.938237 10.59566       3.951046 12.74599       5.217927 7.705827       6.048975 30.51089 7.144423 24.26941 8.399131 6.241474       11.02670 
1 1 1 -4  13 42 o 26.91012 6.515255 9.988519       4.226364 13.83524       5.762144 5.509370       6.217793 31.19269 7.641703 21.72255 8.349744 9.470139       11.31874 
1 1 1 -4  13 43 o 15.53725 6.183469 2.204331       3.509694 3.478621       4.406662 -0.6238968E-02 5.804006 17.91529 6.989988 16.51068 7.306179 1.404604       10.11139 
1 1 1 -4  13 44 o 17.35135 6.317236 3.889689       3.460980 3.465699       4.564003 4.463441       5.309218 17.66079 7.043820 19.16808 7.612785 -1.507288      10.37159 
1 1 1 -4  13 45 o 15.45215 6.431100 2.173661       4.005021 1.603533       5.533136 2.801086       5.804514 16.44207 7.209892 17.52439 7.535471 -1.082314      10.42909 
1 1 1 -4  13 46 f 23.72876 6.502532 8.869768       3.870925 8.745881       5.600071 8.983120       5.356667 22.27762 8.046327 22.66098 7.900370 -0.3833656     11.27649 
1 1 1 -4  13 47 o 20.27485 6.787234 6.960692       3.945341 5.559077       5.670116 8.276206       5.493197 18.43344 7.660334 20.98175 7.899036 -2.548315      11.00343 
1 1 1 -4  13 48 o 11.96572 5.634580 -1.544599      4.238957 2.690830       5.221805 -9.729302      7.258944 15.42978 6.873072 12.19662 6.080188 3.233163       9.176480 
1 1 1 -4  13 49 o 14.52079 6.397421 2.708256       4.403548 1.331655       5.482814 5.210033       7.391349 14.20483 6.596189 16.71080 7.724510 -2.505966      10.15765 
1 1 1 -4  13 50 o 13.30266 5.974051 1.834351       4.031988 -7.069407      5.732903 10.54924       5.671773 10.90659 5.431671 20.31060 7.928536 -9.404011      9.610658 
1 1 1 -4  14 1  o 150.2577 3.043592 275.1337       11.14446 300.8040       22.93466 267.1988       12.75107 156.9626 6.007064 148.0713 3.533783 8.891327       6.969393 
1 1 1 -4  14 2  o 267.9535 4.298933 875.0902       28.07088 934.5107       41.22764 823.7360       38.32729 276.8597 6.110723 259.9346 6.050732 16.92508       8.599552 
1 1 1 -4  14 3  o 138.4211 2.618325 233.4845       8.832062 230.6148       13.74442 235.5029       11.52697 137.4957 4.106656 139.0129 3.402702 -1.517242      5.333199 
1 1 1 -4  14 4  o 538.3702 7.036091 3534.311       92.30996 3360.360       115.0939 3847.984       154.5532 524.8251 8.999154 561.4098 11.29697 -36.58472      14.44321 
1 1 1 -4  14 5  o 248.3539 3.322178 751.6608       20.10620 772.9046       28.90010 731.7329       27.99062 251.8174 4.709530 245.0190 4.687882 6.798401       6.644992 
1 1 1 -4  14 6  o 691.6313 8.918355 5835.629       150.3126 5803.873       236.9492 5857.015       194.4455 689.1127 14.11006 692.6138 11.52048 -3.501099      18.21580 
1 1 1 -4  14 7  o 159.6079 2.815074 310.4331       10.94915 312.4912       17.67670 309.1519       13.94677 160.0562 4.536603 159.2720 3.593339 0.7841644      5.787301 
1 1 1 -4  14 8  o 250.0850 3.666099 762.2068       22.34230 761.8489       35.51898 762.4412       28.74031 249.9861 5.830537 250.1062 4.715534 -0.1201630     7.498761 
1 1 1 -4  14 9  o 765.3209 9.841539 7147.737       183.5451 7407.196       297.1938 6987.752       233.3703 778.1595 15.67238 756.3226 12.66200 21.83698       20.14820 
1 1 1 -4  14 10 o 671.0867 8.665550 5494.219       141.7134 5466.871       223.4347 5512.625       183.2987 668.7871 13.70966 671.9293 11.19437 -3.142212      17.69939 
1 1 1 -4  14 11 o 721.8926 9.297967 6359.252       163.5674 6131.690       252.6833 6523.381       214.5943 708.0695 14.64416 730.7751 12.05031 -22.70557      18.96474 
1 1 1 -4  14 12 o 477.1577 9.970491 2779.241       115.9350 2950.686       169.9974 2630.169       158.5176 490.9861 14.22313 463.5559 14.04885 27.43011       19.99169 
1 1 1 -4  14 13 o 438.2953 6.520676 2342.625       69.64589 2328.023       98.36398 2357.303       98.62486 436.7433 9.242166 439.4839 9.208892 -2.740601      13.04689 
1 1 1 -4  14 14 o 418.7176 7.260489 2138.646       74.08379 2206.518       92.48691 2017.128       123.7537 425.1871 8.926148 406.0044 12.52308 19.18265       15.37867 
1 1 1 -4  14 15 o 408.7301 7.105564 2037.988       70.77360 2069.170       87.41201 1978.645       120.5877 411.7206 8.712292 402.0640 12.32209 9.656555       15.09099 
1 1 1 -4  14 16 o 173.5115 3.290119 366.9351       13.91156 353.8197       19.70167 379.9769       19.64629 170.2892 4.752308 176.4850 4.571961 -6.195816      6.594488 
1 1 1 -4  14 17 o 473.6135 8.071590 2738.715       93.15781 2700.890       113.5476 2816.599       162.9352 470.0865 9.912064 479.1206 13.97005 -9.034119      17.12925 
1 1 1 -4  14 18 o 272.7181 4.396543 906.8880       29.21874 923.1224       42.02423 891.6957       40.65295 275.0438 6.269918 270.3278 6.171139 4.716003       8.797433 
1 1 1 -4  14 19 o 426.5767 6.381413 2221.395       66.33611 2159.708       92.54439 2286.586       95.13615 420.2110 9.037464 432.3795 9.029098 -12.16855      12.77499 
1 1 1 -4  14 20 o 608.6149 8.866958 4533.350       131.5084 4501.594       185.4202 4565.493       186.5467 605.1262 12.57405 609.4112 12.56149 -4.285034      17.77351 
1 1 1 -4  14 21 o 387.7943 5.877036 1836.692       55.53872 1810.851       78.22058 1862.964       78.87066 384.5949 8.346058 390.1006 8.296650 -5.505646      11.76822 
1 1 1 -4  14 22 o 136.1359 3.533282 226.2008       11.71170 224.7989       22.13834 226.7457       13.80108 135.4090 6.730150 136.2548 4.161351 -0.8458862     7.912759 
1 1 1 -4  14 23 o 71.20336 3.386647 61.98372       5.859491 75.14679       12.92022 58.57541       6.574467 78.05444 6.862389 69.17255 3.916231 8.881889       7.901218 
1 1 1 -4  14 24 o 171.3004 3.709479 358.1017       15.48486 362.5442       26.38967 355.7689       19.12306 171.9902 6.307107 170.6075 4.603842 1.382736       7.808647 
1 1 1 -4  14 25 o 122.3970 2.917764 182.7346       8.702760 166.3958       12.13646 200.0285       12.48611 116.6462 4.276822 127.9335 4.009989 -11.28734      5.862697 
1 1 1 -4  14 26 o 112.6419 2.880722 154.8828       7.900980 143.1797       11.13873 166.7339       11.20894 108.1816 4.233361 116.7835 3.944307 -8.601860      5.786096 
1 1 1 -4  14 27 o 148.0356 3.143299 267.4450       11.33934 272.9910       16.35322 262.3092       15.73703 149.3703 4.497776 146.4273 4.415307 2.942993       6.302771 
1 1 1 -4  14 28 o 17.04026 5.912839 3.193528       2.998692 2.953291       4.196678 3.444139       4.286325 18.25356 6.897109 18.95052 7.008434 -0.6969604     9.833019 
1 1 1 -4  14 29 o 142.8027 3.515840 249.0995       12.23493 251.4935       15.49946 245.1415       19.92961 143.3117 4.443487 141.2411 5.802664 2.070541       7.308589 
1 1 1 -4  14 30 o 125.7089 3.045728 192.9541       9.330248 195.3496       13.32838 190.6520       13.06547 126.2767 4.337739 124.7526 4.304182 1.524094       6.110806 
1 1 1 -4  14 31 o 109.2128 3.622928 145.9738       9.628707 145.5457       11.40118 147.0388       17.98083 108.9538 4.302550 109.0082 6.802754 -0.5441284E-01 8.049186 
1 1 1 -4  14 32 o 72.00984 3.178553 63.48600       5.563986 59.13803       7.649347 68.37099       8.107996 69.31586 4.553734 74.56284 4.482965 -5.246979      6.390108 
1 1 1 -4  14 33 o 51.84658 3.698174 33.06325       4.641759 26.84139       6.091935 41.67548       7.167255 46.39385 5.494946 58.01702 5.122006 -11.62318      7.511950 
1 1 1 -4  14 34 o 86.62408 3.142816 91.88718       6.623282 79.68555       8.809311 107.7533       10.04541 80.43946 4.512124 93.59589 4.416739 -13.15643      6.314020 
1 1 1 -4  14 35 o 17.37137 6.709722 2.481247       4.029021 7.579217       5.902105 -1.967532      5.513516 25.08261 8.298898 15.86998 7.066217 9.212629       10.89968 
1 1 1 -4  14 36 o 84.89024 3.845439 88.67474       7.934338 87.28027       15.54419 89.16609       9.226888 82.98013 7.777664 84.97969 4.471310 -1.999565      8.971326 
1 1 1 -4  14 37 o 42.73432 4.127457 22.70462       4.244859 20.17100       5.734755 25.77504       6.313110 39.77235 6.112246 45.12561 5.880721 -5.353264      8.481888 
1 1 1 -4  14 38 f 32.32054 5.113900 13.30604       3.893917 8.439913       5.282753 19.09527       5.762074 25.52831 7.784971 38.47179 6.368742 -12.94348      10.05816 
1 1 1 -4  14 39 o 31.55666 5.908993 12.96513       4.377069 10.16621       5.196817 19.79776       8.119634 27.56535 7.526392 37.99388 8.922827 -10.42853      11.67319 
1 1 1 -4  14 40 f 35.65494 4.881253 16.28258       4.129957 17.27134       5.424334 14.91885       6.370334 36.15517 6.390258 32.90303 8.019179 3.252140       10.25391 
1 1 1 -4  14 41 o 14.83868 6.036645 1.445304       3.425071 2.316916       4.389527 0.8863715E-01  5.476371 17.10191 6.878157 16.62211 7.232978 0.4797993      9.981234 
1 1 1 -4  14 42 o 52.51739 4.400668 35.39596       5.580197 29.47256       6.333999 55.93346       11.79414 47.14760 5.623666 62.92002 7.863224 -15.77242      9.667259 
1 1 1 -4  14 43 o 27.56544 6.572479 10.87203       4.352554 9.060634       5.962290 12.93877       6.368668 24.52760 8.343630 28.84108 8.491484 -4.313478      11.90468 
1 1 1 -4  14 44 o 23.38150 6.983457 8.286534       4.282707 8.973639       6.025154 7.584867       6.088669 23.65563 8.368399 22.22517 8.326912 1.430452       11.80540 
1 1 1 -4  14 45 o 17.09450 6.407474 4.006857       3.606021 1.449522       4.820549 7.256127       5.433699 15.52260 6.769827 21.14953 7.877838 -5.626929      10.38705 
1 1 1 -4  14 46 o 20.22815 6.662925 6.596825       3.805883 5.586088       5.577310 7.477620       5.206468 18.92929 7.702322 20.79169 7.717707 -1.862396      10.90361 
1 1 1 -4  14 47 o 11.24493 5.283357 -1.864360      3.690443 -4.620069      5.250255 0.8268429      5.188442 11.97132 5.802699 14.58368 6.640171 -2.612355      8.818343 
1 1 1 -4  14 48 o 11.85503 5.505751 -0.6993660     3.821811 2.354261       5.392812 -3.780428      5.416984 15.08797 6.830114 12.11182 5.876274 2.976151       9.010053 
1 1 1 -4  14 49 o 14.04918 6.269881 2.259528       4.366774 2.758281       5.419626 1.336496       7.372840 14.84680 6.770205 14.90556 7.135420 -0.5876923E-01 9.836152 
1 1 1 -4  15 1  o 107.9904 3.347147 142.2554       8.797750 138.2219       14.71968 144.4971       10.97345 106.3295 5.701639 108.8063 4.146184 -2.476791      7.049790 
1 1 1 -4  15 2  o 763.0359 10.98046 7107.301       204.1746 7017.486       285.8617 7200.836       291.7205 757.5027 15.48587 767.3137 15.60120 -9.810974      21.98203 
1 1 1 -4  15 3  o 272.8028 4.379264 907.0528       29.11295 945.2748       41.98111 871.6420       40.40779 278.4502 6.186860 267.3849 6.201432 11.06528       8.759851 
1 1 1 -4  15 4  o 795.9238 10.22077 7731.315       198.2400 7687.121       312.5123 7761.073       256.4382 792.6794 16.17832 797.0223 13.20311 -4.342957      20.88205 
1 1 1 -4  15 5  o 340.6020 4.270565 1413.919       35.44611 1468.275       51.28996 1364.223       49.04228 347.0367 6.064860 334.5157 6.016141 12.52103       8.542627 
1 1 1 -4  15 6  o 216.7459 3.040697 572.4950       16.06054 574.0495       22.76504 570.9546       22.66137 217.0239 4.304521 216.4382 4.296513 0.5857086      6.081852 
1 1 1 -4  15 7  o 162.8190 3.193828 323.0639       12.67222 314.1018       17.95872 331.9515       17.88397 160.4647 4.597351 164.9705 4.452652 -4.505798      6.400137 
1 1 1 -4  15 8  o 612.6714 7.952344 4578.478       118.7296 4584.782       187.9765 4574.294       153.1443 612.6047 12.59178 612.1756 10.26571 0.4291382      16.24616 
1 1 1 -4  15 9  o 258.0403 4.202440 811.5484       26.42562 838.3572       38.41508 787.4670       36.40855 262.2257 6.011604 254.1457 5.878742 8.079971       8.408269 
1 1 1 -4  15 10 o 175.6389 2.967711 375.9387       12.70218 367.3322       20.19351 381.5736       16.33960 173.5289 4.779888 176.9414 3.789447 -3.412491      6.099773 
1 1 1 -4  15 11 o 265.8906 4.969380 861.8209       32.19892 782.1075       52.59505 909.6069       40.72206 253.0355 8.541819 273.1295 6.118220 -20.09393      10.50692 
1 1 1 -4  15 12 o 193.3068 4.118527 455.4608       19.40105 456.0587       23.71308 454.2504       33.74134 193.3516 5.037027 192.8476 7.192395 0.5039215      8.780785 
1 1 1 -4  15 13 o 507.6692 10.61763 3148.154       131.3544 3095.462       183.9608 3202.962       187.6195 502.5493 15.03832 511.2009 15.07735 -8.651672      21.29502 
1 1 1 -4  15 14 o 153.1777 3.765873 285.9887       14.05715 286.6826       17.17624 284.5814       24.46256 153.2812 4.603580 152.6035 6.593673 0.6777496      8.041733 
1 1 1 -4  15 15 o 547.5157 8.007884 3659.083       106.8441 3684.694       152.0666 3634.114       150.1522 548.9332 11.36785 545.1638 11.30235 3.769409       16.03032 
1 1 1 -4  15 16 o 47.63989 3.536640 27.81675       4.076515 24.40429       6.371534 30.18171       5.304229 44.31857 6.057997 49.55634 4.439224 -5.237774      7.510396 
1 1 1 -4  15 17 o 520.7665 8.823137 3314.323       111.9701 3365.771       139.0857 3219.573       188.7513 524.3832 10.88423 511.5576 15.15788 12.82556       18.66086 
1 1 1 -4  15 18 o 145.9576 3.088252 259.6887       10.98438 240.4841       15.48173 279.1562       15.58733 140.3480 4.532597 151.2409 4.233445 -10.89290      6.202136 
1 1 1 -4  15 19 o 178.4955 3.358856 388.4498       14.61015 365.3918       20.46132 412.4345       20.86844 172.9892 4.858575 183.8109 4.662657 -10.82162      6.733953 
1 1 1 -4  15 20 o 248.6365 4.791977 754.4071       29.03459 721.5180       50.69567 770.4609       35.41889 242.5934 8.588982 251.1794 5.786486 -8.586014      10.35635 
1 1 1 -4  15 21 o 225.0309 3.856310 617.7502       21.14707 636.3617       30.73497 601.0184       29.14154 228.2511 5.525657 221.8353 5.390708 6.415817       7.719625 
1 1 1 -4  15 22 o 50.89491 3.780953 31.77816       4.655844 33.74993       10.53529 31.29961       5.190170 51.76100 8.657871 50.46097 4.260523 1.300026       9.649393 
1 1 1 -4  15 23 o 138.0895 3.021125 232.5765       10.16636 218.4845       14.38383 246.6435       14.37099 133.6911 4.421134 142.0800 4.155128 -8.388870      6.067249 
1 1 1 -4  15 24 o 247.5197 4.699540 748.5383       28.34661 762.1320       49.00193 741.7015       34.75140 248.9626 8.087600 246.2121 5.791975 2.750473       9.947676 
1 1 1 -4  15 25 f 54.52591 3.123168 36.39240       4.132511 30.73254       5.909035 41.81069       5.781555 49.89927 4.923526 58.36946 4.090542 -8.470196      6.401065 
1 1 1 -4  15 26 o 132.8356 3.021771 215.3026       9.781649 204.7029       13.82301 225.9341       13.84370 129.3490 4.391712 135.9238 4.184447 -6.574799      6.066031 
1 1 1 -4  15 27 o 90.00333 2.878459 98.94440       6.305157 91.41315       8.952534 106.3567       8.881566 86.37553 4.266436 93.22231 3.918349 -6.846779      5.792748 
1 1 1 -4  15 28 o 180.9232 3.913282 400.0306       17.25327 403.1628       21.76435 394.7333       28.30393 181.4057 4.927891 179.1383 6.494440 2.267456       8.152414 
1 1 1 -4  15 29 o 81.18034 2.973758 80.56012       5.872973 81.68870       8.372516 79.46688       8.240338 81.61398 4.224115 80.49452 4.215596 1.119453       5.967780 
1 1 1 -4  15 30 o 136.2206 3.125039 226.6302       10.37372 218.3822       14.51091 235.2516       14.83578 133.4810 4.467366 138.5583 4.399391 -5.077255      6.269928 
1 1 1 -4  15 31 o 79.52466 3.826756 77.53590       7.394218 83.47110       8.706281 62.17466       14.00644 82.44680 4.348718 70.31876 8.335683 12.12804       9.401859 
1 1 1 -4  15 32 o 44.33173 3.981230 24.25224       4.255229 21.10894       5.947910 27.54775       6.090219 40.95016 6.150219 47.03853 5.411521 -6.088371      8.192055 
1 1 1 -4  15 33 o 36.15950 4.822739 16.33775       4.143775 16.53590       5.674813 16.11141       6.064991 35.99961 6.715675 35.41492 7.271306 0.5846901      9.898089 
1 1 1 -4  15 34 o 43.76048 4.615807 23.78543       4.848208 16.92806       7.047570 29.94613       6.679991 36.10535 8.197845 48.93989 5.708195 -12.83454      9.989403 
1 1 1 -4  15 35 o 36.20434 4.877609 16.43443       4.193947 15.44499       5.733835 17.57283       6.150316 34.59872 7.040428 36.94881 7.088395 -2.350098      9.990644 
1 1 1 -4  15 36 o 41.29149 5.172668 21.41315       5.090993 16.50204       10.03796 23.11389       5.907096 35.35010 10.72133 42.76271 5.819416 -7.412613      12.19887 
1 1 1 -4  15 37 o 9.496326 4.594879 -5.222311      3.255069 -4.655048      4.527742 -5.829118      4.682903 12.41230 5.838177 12.10358 5.764364 0.3087187      8.204401 
1 1 1 -4  15 38 o 23.51018 6.782763 7.207388       4.100222 9.635649       5.052636 2.524350       7.016721 26.97058 7.444201 20.86196 8.581208 6.108616       11.36016 
1 1 1 -4  15 39 o 18.88210 6.464273 4.281814       3.579880 5.441304       4.866860 2.914894       5.284293 21.36427 7.524370 19.05816 7.586495 2.306108       10.68509 
1 1 1 -4  15 40 o 46.73585 3.993906 27.48197       4.505113 21.36021       5.915374 35.93672       6.951750 40.24223 6.233449 52.79818 5.482789 -12.55595      8.301618 
1 1 1 -4  15 41 o 41.99080 4.250226 22.49595       4.289306 16.68996       5.610175 30.66512       6.654682 34.87288 6.846147 48.23862 5.775716 -13.36574      8.957044 
1 1 1 -4  15 42 o 33.18393 5.679220 14.89382       4.427525 14.27836       5.253513 16.40258       8.225514 31.70815 6.987674 32.09180 9.699380 -0.3836498     11.95431 
1 1 1 -4  15 43 o 32.03616 5.477894 14.08746       4.122954 16.09182       5.551264 11.62169       6.157172 33.09834 7.095682 27.10578 8.429590 5.992558       11.01847 
1 1 1 -4  15 44 o 16.75353 6.697019 3.229794       4.134973 -3.131601      5.897329 9.381608       5.799370 14.20613 6.675961 23.83503 8.225178 -9.628896      10.59349 
1 1 1 -4  15 45 o 32.67290 5.338099 15.25404       4.103586 18.59234       6.016859 12.35084       5.611062 33.82274 7.497054 26.72581 7.996073 7.096937       10.96098 
1 1 1 -4  15 46 o 14.79323 6.486044 1.558337       4.476609 0.8441686      8.315908 1.849737       5.311960 17.04770 7.984581 15.69222 6.964414 1.355474       10.59512 
1 1 1 -4  15 47 o 14.36553 6.332346 1.764704       4.319733 -0.6861362     5.366940 6.273098       7.279141 13.72165 6.422796 18.47973 8.179593 -4.758074      10.39991 
1 1 1 -4  15 48 o 21.03291 7.403335 9.093308       4.711042 6.606630       5.839318 13.72960       7.973292 17.88820 7.621637 21.80148 9.073891 -3.913280      11.85010 
1 1 1 -4  15 49 o 19.20273 6.725239 7.350234       3.884250 8.960456       5.736457 5.986896       5.278404 19.10324 7.797020 16.88269 7.221235 2.220543       10.62731 
1 1 1 -4  16 1  o 703.0392 14.36436 6042.718       246.0946 6110.694       350.2912 5976.469       345.8127 705.4861 20.39674 697.6978 20.36115 7.788330       28.82019 
1 1 1 -4  16 2  o 1689.744 21.57134 35055.03       888.2477 35889.53       1429.274 34529.92       1133.779 1699.732 34.50634 1672.849 27.81221 26.88293       44.31937 
1 1 1 -4  16 3  o 621.5075 9.016067 4712.817       136.5525 4897.846       198.0361 4545.104       188.5422 633.1557 12.83506 609.9490 12.68466 23.20673       18.04548 
1 1 1 -4  16 4  o 409.7129 5.497021 2046.370       54.88367 2080.752       87.43945 2024.018       70.50156 412.9847 8.688350 407.4005 7.101353 5.584229       11.22126 
1 1 1 -4  16 5  o 375.0088 5.085670 1714.270       46.47567 1834.333       76.68592 1644.570       58.42875 387.7877 8.114944 367.2539 6.528659 20.53378       10.41517 
1 1 1 -4  16 6  o 218.5072 3.793373 581.8963       20.19888 542.1088       27.67666 627.2399       29.54595 210.8091 5.391938 226.8331 5.345095 -16.02408      7.592301 
1 1 1 -4  16 7  o 797.3842 10.24793 7761.611       199.1315 7414.380       305.1331 8019.201       262.8112 778.2819 16.08853 809.9885 13.31462 -31.70660      20.88349 
1 1 1 -4  16 8  o 737.3782 9.502297 6636.026       170.7477 6705.050       271.9346 6591.101       219.3872 740.2718 15.07430 734.4732 12.25743 5.798584       19.42882 
1 1 1 -4  16 9  o 225.2747 4.498790 618.5850       24.69701 595.7073       29.67935 670.0909       44.53249 221.0483 5.509739 234.2446 7.812305 -13.19637      9.559777 
1 1 1 -4  16 10 o 586.1306 12.07398 4198.312       172.4570 4111.257       240.5763 4290.334       247.3467 578.9246 17.07141 591.3834 17.18152 -12.45886      24.22060 
1 1 1 -4  16 11 o 377.7146 6.658314 1740.005       61.28641 1654.731       72.60796 1951.293       114.2916 368.2586 8.090869 399.4140 11.75514 -31.15533      14.27044 
1 1 1 -4  16 12 o 164.3895 3.277053 329.3550       13.12786 307.1005       18.22306 353.3651       18.92819 158.6469 4.718853 170.1947 4.567935 -11.54779      6.567617 
1 1 1 -4  16 13 o 428.1767 5.723348 2235.739       59.71855 2130.113       91.94560 2312.809       78.53955 417.6755 9.033497 435.3698 7.402766 -17.69431      11.67926 
1 1 1 -4  16 14 o 515.2142 7.578022 3239.761       95.14365 3202.938       133.7608 3277.471       135.3604 511.8463 10.72391 517.7668 10.72806 -5.920471      15.16883 
1 1 1 -4  16 15 o 462.9531 6.877954 2615.634       77.59476 2715.818       112.9203 2526.006       106.8059 471.3418 9.831054 454.6006 9.641154 16.74118       13.76958 
1 1 1 -4  16 16 o 150.6426 3.595049 276.6476       13.19741 273.9573       16.84743 280.9203       21.23194 149.8120 4.620301 151.6312 5.756446 -1.819214      7.381318 
1 1 1 -4  16 17 o 150.2193 3.139968 275.0823       11.49442 270.5052       16.65553 279.2448       15.88309 148.8534 4.597106 151.2586 4.313428 -2.405197      6.303892 
1 1 1 -4  16 18 o 356.9647 5.481167 1555.239       47.67980 1593.553       68.84462 1519.921       66.09806 361.0159 7.825418 352.5972 7.692610 8.418701       10.97331 
1 1 1 -4  16 19 o 345.4540 6.182041 1457.814       52.04250 1379.928       88.61034 1498.828       64.30115 335.0302 10.86774 350.0613 7.537695 -15.03104      13.22591 
1 1 1 -4  16 20 o 17.87432 5.822033 3.756423       2.909442 -0.3204892     4.896699 5.981067       3.617162 16.18610 6.939935 21.91849 6.384685 -5.732388      9.430106 
1 1 1 -4  16 21 o 128.8221 3.471037 202.5791       10.88654 217.5229       21.55513 197.4619       12.61349 133.1699 6.663314 127.1383 4.076474 6.031624       7.811363 
1 1 1 -4  16 22 o 165.6342 3.268016 334.6637       13.19077 337.6329       19.22301 332.0214       18.13375 166.1930 4.751366 164.8307 4.518803 1.362320       6.557062 
1 1 1 -4  16 23 o 279.6206 5.150020 955.7430       35.09249 925.3326       59.19110 972.2256       43.57692 274.1322 8.872225 281.7870 6.345990 -7.654816      10.90816 
1 1 1 -4  16 24 o 49.98762 3.272373 30.61977       3.964303 27.59424       5.945479 33.04162       5.319370 47.21336 5.256599 51.83967 4.248000 -4.626312      6.758501 
1 1 1 -4  16 25 o 78.42091 2.877069 75.12572       5.488851 67.94566       7.869040 81.92934       7.659995 74.44360 4.356730 81.81974 3.852615 -7.376137      5.815818 
1 1 1 -4  16 26 o 142.2202 3.099786 246.8481       10.74309 258.8451       15.73592 236.3748       14.70269 145.4442 4.444978 138.9950 4.346060 6.449188       6.216596 
1 1 1 -4  16 27 o 85.91566 3.209217 90.23808       6.707235 93.60680       8.877350 85.75709       10.23853 87.40784 4.179816 83.54410 5.052669 3.863739       6.557463 
1 1 1 -4  16 28 o 55.82224 3.231434 38.17743       4.377018 40.55426       6.416439 36.10878       5.986028 57.38023 4.627995 54.12900 4.581061 3.251232       6.511870 
1 1 1 -4  16 29 o 135.7074 3.109168 224.8987       10.28215 239.2245       15.09115 212.4863       14.04722 139.7314 4.437551 131.6919 4.383294 8.039413       6.237397 
1 1 1 -4  16 30 o 159.9640 3.934022 313.0203       15.33540 305.3798       18.21711 331.6043       28.41102 157.7882 4.743100 163.7544 7.136775 -5.966187      8.569162 
1 1 1 -4  16 31 o 104.0263 3.061729 132.3237       7.753064 142.8330       11.33884 123.0961       10.62493 107.8956 4.321238 100.1441 4.364236 7.751427       6.141633 
1 1 1 -4  16 32 o 113.7732 3.080006 158.3251       8.531551 156.9509       12.20411 159.6386       11.93138 113.0455 4.438761 114.0382 4.301137 -0.9926758     6.180807 
1 1 1 -4  16 33 o 63.04288 3.415421 48.77873       5.227470 41.79136       7.181540 56.65318       7.623784 58.05999 5.128476 67.75898 4.645183 -9.698994      6.919465 
1 1 1 -4  16 34 o 70.77124 3.645213 61.54435       6.265418 58.07267       9.724115 64.00864       8.192679 68.27113 5.902827 71.98141 4.696208 -3.710274      7.543059 
1 1 1 -4  16 35 o 54.97368 3.726160 37.26125       4.962247 39.70644       7.286572 35.14640       6.776510 56.41213 5.364983 53.05731 5.312506 3.354820       7.550216 
1 1 1 -4  16 36 o 31.30403 6.735956 12.73944       4.986044 26.44267       10.84817 9.069296       5.614186 44.27218 10.25656 26.55173 8.010652 17.72045       13.01413 
1 1 1 -4  16 37 o 46.86129 4.063294 27.32308       4.594301 26.75845       6.323863 27.95422       6.685886 45.89055 5.783020 46.85013 5.993210 -0.9595795     8.328379 
1 1 1 -4  16 38 o 50.74366 4.196251 32.17860       5.142600 25.90533       6.216731 45.77581       9.152503 44.96261 5.809456 59.68797 6.391823 -14.72536      8.637429 
1 1 1 -4  16 39 o 30.77494 5.413872 12.32186       3.911966 9.960786       5.131300 15.59868       6.045031 27.08873 7.511597 33.88852 7.516850 -6.799786      10.62672 
1 1 1 -4  16 40 o 30.33316 5.512039 12.13487       3.924390 9.576361       5.118885 15.78259       6.112129 26.29124 7.576648 33.69767 7.622161 -7.406427      10.74723 
1 1 1 -4  16 41 o 56.59665 3.685075 40.42340       5.054813 43.02593       6.875046 37.36112       7.457608 57.62112 4.943925 53.03129 5.868835 4.589828       7.673697 
1 1 1 -4  16 42 o 27.58752 6.971211 11.01322       4.687763 12.01692       5.425645 8.057559       9.310539 28.41826 7.661482 24.40932 9.944381 4.008940       12.55345 
1 1 1 -4  16 43 o 17.10098 6.795998 3.261848       4.233563 3.269775       6.286457 3.255270       5.726912 18.72526 7.940474 18.29671 7.658230 0.4285488      11.03175 
1 1 1 -4  16 44 o 15.31738 6.248569 2.390367       3.681908 2.390060       4.932810 2.390752       5.532674 16.46360 7.009562 16.95725 7.324719 -0.4936447     10.13832 
1 1 1 -4  16 45 o 14.60285 6.265595 1.626513       3.996652 -1.228528      6.391011 3.460086       5.121679 15.12759 7.057194 17.07904 7.201065 -1.951456      10.08262 
1 1 1 -4  16 46 o 18.34402 7.134529 5.587668       4.579195 4.946613       9.186651 5.799606       5.282194 18.71262 8.636272 18.56125 7.516599 0.1513634      11.44921 
1 1 1 -4  16 47 o 12.04365 5.688505 -1.683816      4.380485 -2.816557      5.385459 0.5308352      7.530263 12.58403 6.043632 15.46845 7.350594 -2.884412      9.516129 
1 1 1 -4  16 48 o 18.77769 6.633057 6.679338       3.784274 8.295607       5.761249 5.452809       5.018786 19.04335 7.798057 16.89298 7.125799 2.150366       10.56346 
1 1 1 -4  17 1  o 348.4082 7.593050 1480.595       64.46749 0.000000       0.000000 1480.595       64.46749 ?        ?        348.4082 7.593050 0.000000       7.593050 
1 1 1 -4  17 2  o 686.2181 9.921769 5747.838       165.9157 5706.848       233.5143 5789.629       235.7825 683.1597 14.02669 688.0906 14.06144 -4.930908      19.86132 
1 1 1 -4  17 3  o 723.3865 12.06223 6392.894       212.6347 7021.520       392.7102 6132.156       252.9168 755.6971 21.34635 708.0347 14.65842 47.66241       25.89471 
1 1 1 -4  17 4  f 499.2710 8.500599 3041.286       103.4241 2802.671       169.6245 3182.488       130.4849 478.4500 14.56539 510.5523 10.48779 -32.10226      17.94838 
1 1 1 -4  17 5  o 532.7361 9.025348 3463.323       117.1688 3363.944       199.0104 3516.048       144.9554 524.0144 15.60200 536.5678 11.08597 -12.55341      19.13952 
1 1 1 -4  17 6  o 894.2383 12.82779 9774.256       279.5383 9567.370       389.5554 9993.872       401.3627 883.3464 18.09681 902.7748 18.24406 -19.42847      25.69709 
1 1 1 -4  17 7  o 694.4924 10.04297 5888.608       169.9675 5683.935       234.6625 6114.481       246.5159 681.6477 14.12692 706.9568 14.30922 -25.30914      20.10780 
1 1 1 -4  17 8  o 246.4158 4.782000 740.2015       28.71536 710.9174       34.56962 805.3777       51.57302 241.4630 5.875000 256.7829 8.252483 -15.31995      10.13011 
1 1 1 -4  17 9  o 806.1650 13.40499 7950.041       263.3459 8003.566       458.0646 7923.615       321.8534 805.3195 23.36586 804.0296 16.42669 1.289856       28.56221 
1 1 1 -4  17 10 o 505.9918 7.477502 3123.662       92.20110 2988.583       126.5083 3276.702       134.6570 494.6152 10.49579 517.8865 10.66985 -23.27124      14.96688 
1 1 1 -4  17 11 o 347.3422 5.344084 1471.084       45.23420 1527.684       65.99976 1420.946       62.11818 353.8257 7.654500 341.2533 7.469746 12.57248       10.69525 
1 1 1 -4  17 12 o 336.8672 4.666265 1383.534       38.30576 1453.748       62.84978 1342.037       48.31703 345.1438 7.472528 331.7117 5.977277 13.43213       9.569040 
1 1 1 -4  17 13 o 297.7647 4.714155 1081.083       34.20685 1017.775       47.19902 1151.123       49.64522 288.8105 6.706315 307.1529 6.632644 -18.34241      9.432212 
1 1 1 -4  17 14 o 406.1121 5.469687 2011.749       54.13081 2001.261       85.73612 2018.702       69.80247 404.7140 8.693196 406.6667 7.043623 -1.952637      11.18858 
1 1 1 -4  17 15 o 58.39406 3.781173 41.74674       5.351679 41.11631       7.714849 42.33148       7.430018 57.78783 5.546433 58.67415 5.251937 -0.8863220     7.638440 
1 1 1 -4  17 16 o 231.3468 3.959826 652.6424       22.32419 617.7545       31.14005 689.5316       32.02072 224.9130 5.686135 237.7064 5.527822 -12.79346      7.930255 
1 1 1 -4  17 17 o 36.88159 4.326748 16.81946       3.814869 21.92742       6.745499 14.41750       4.625660 41.82436 6.855648 33.89099 5.809828 7.933365       8.986323 
1 1 1 -4  17 18 o 223.5813 4.483783 609.9259       24.42959 662.4665       45.95761 589.2326       28.84196 232.5064 8.123705 219.6885 5.387425 12.81787       9.747766 
1 1 1 -4  17 19 o 57.30539 3.186447 40.16908       4.432256 37.19106       6.952647 42.20790       5.752761 54.93711 5.257427 58.67850 4.047909 -3.741390      6.635217 
1 1 1 -4  17 20 o 94.36075 3.866474 108.8244       8.872004 116.7330       15.47802 104.9545       10.82724 97.46503 6.554858 92.58496 4.815443 4.880066       8.133552 
1 1 1 -4  17 21 o 189.8874 4.089434 440.1277       18.92324 454.8838       35.32507 434.1891       22.40987 192.4845 7.545590 188.4673 4.883524 4.017273       8.988033 
1 1 1 -4  17 22 o 160.2599 3.622724 313.4286       14.14804 305.2967       24.02373 317.7466       17.50579 157.7991 6.259828 161.2336 4.459718 -3.434525      7.685995 
1 1 1 -4  17 23 o 233.8020 3.988944 667.4381       22.72701 680.2758       32.90684 655.7298       31.42597 235.7785 5.727246 231.5126 5.570292 4.265930       7.989336 
1 1 1 -4  17 24 o 188.5638 3.524691 434.0199       16.19628 426.6947       23.11301 441.0873       22.70251 186.7148 5.084477 189.8683 4.910774 -3.153595      7.068777 
1 1 1 -4  17 25 o 145.6335 3.130901 258.8362       11.11134 239.4889       15.57214 278.9038       15.85942 139.8839 4.574347 151.0039 4.314281 -11.12003      6.287899 
1 1 1 -4  17 26 o 146.9812 3.142328 263.6974       11.25510 271.6154       16.46956 256.7592       15.41678 148.9583 4.542436 144.8484 4.372617 4.109924       6.305038 
1 1 1 -4  17 27 o 200.7691 4.165773 492.8501       20.38114 488.0254       25.48232 501.4163       33.95462 199.5129 5.245764 201.7755 6.915711 -2.262558      8.680156 
1 1 1 -4  17 28 o 80.13768 2.978253 78.51165       5.806016 80.54761       8.467987 76.70541       7.975978 81.02593 4.304085 79.08339 4.153245 1.942543       5.981186 
1 1 1 -4  17 29 o 43.77527 3.796227 23.60604       4.009652 16.61012       5.672347 30.59288       5.668663 36.16534 6.682364 49.74951 4.732741 -13.58417      8.188579 
1 1 1 -4  17 30 o 25.55051 6.862076 8.332397       4.362593 7.030564       4.977103 12.64940       9.063382 23.99977 7.595419 32.04258 10.26210 -8.042814      12.76719 
1 1 1 -4  17 31 o 77.59769 3.130682 73.70966       5.907875 71.83633       8.516167 75.44760       8.202643 76.39783 4.595571 78.34715 4.312937 -1.949318      6.302436 
1 1 1 -4  17 32 o 65.91673 3.334449 53.28608       5.338791 49.71367       7.518902 56.91858       7.581874 63.41950 4.903194 67.93820 4.606835 -4.518703      6.727871 
1 1 1 -4  17 33 o 44.61306 4.455943 24.68335       4.779635 32.10669       7.856750 20.32199       6.022189 50.49918 6.537716 40.03811 6.386694 10.46106       9.139563 
1 1 1 -4  17 34 o 46.26694 3.982750 26.47510       4.446789 28.23512       6.442661 24.87379       6.145292 47.44092 5.685976 44.45763 5.811293 2.983295       8.130280 
1 1 1 -4  17 35 o 40.76680 5.591405 20.98820       5.408543 14.54182       10.66582 23.21963       6.275196 33.73107 11.15598 42.75286 6.204210 -9.021793      12.76511 
1 1 1 -4  17 36 o 44.71750 4.198065 24.89473       4.521201 20.48179       6.280785 29.64067       6.513446 39.84264 6.706863 48.44968 5.620948 -8.607048      8.750834 
1 1 1 -4  17 37 o 35.61263 5.383459 16.20945       4.526310 15.04324       5.720080 18.16276       7.402881 33.72884 7.179767 36.70057 8.451917 -2.971737      11.08981 
1 1 1 -4  17 38 o 42.55670 4.105807 22.71922       4.205167 20.63461       5.844484 24.95679       6.055116 39.80574 6.229201 44.03226 5.782696 -4.226521      8.499560 
1 1 1 -4  17 39 o 13.17452 5.727218 -0.2529377     3.426594 2.656766       4.829269 -3.203156      4.862774 18.09244 7.235696 13.61354 6.283080 4.478899       9.582922 
1 1 1 -4  17 40 o 62.93367 3.522234 49.63500       5.380233 53.66889       7.555429 45.48509       7.663314 64.67641 4.828617 59.16172 5.374024 5.514690       7.224657 
1 1 1 -4  17 41 o 16.58503 6.316157 2.983206       3.536180 0.8709347      4.761583 5.580843       5.280387 15.94494 6.840155 20.92186 7.771115 -4.976924      10.35268 
1 1 1 -4  17 42 o 15.96504 6.891785 1.056730       4.891903 3.015614       5.952412 -3.019403      8.586433 18.57715 7.793705 17.58535 8.195856 0.9917927      11.30990 
1 1 1 -4  17 43 o 16.69695 6.422033 3.435173       3.679808 6.226282       5.040702 0.2505312      5.384346 20.50713 7.597245 15.56299 6.952676 4.944140       10.29844 
1 1 1 -4  17 44 o 12.81765 5.718160 -0.1017845     3.628572 1.233452       5.056631 -1.519220      5.209954 15.54103 6.850828 13.96187 6.464845 1.579161       9.419558 
1 1 1 -4  17 45 o 37.49905 4.835045 19.85773       4.315595 19.33396       6.098890 20.38297       6.107466 33.78317 7.593502 35.00306 7.392292 -1.219883      10.59751 
1 1 1 -4  17 46 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -4  17 47 o 9.619839 4.710155 -4.692152      3.711549 -4.914767      5.546038 -4.511579      4.994955 11.81439 5.778974 11.37397 5.546317 0.4404202      8.009879 
1 1 1 -4  17 48 o 21.42609 6.940156 9.113094       4.137470 8.597970       6.102827 9.551249       5.628451 18.79959 7.889587 19.97700 7.868341 -1.177402      11.14255 
1 1 1 -4  18 1  o 256.5881 3.794333 802.4308       23.72510 763.9194       36.22602 831.3553       31.39490 250.3014 5.939108 261.1450 4.933342 -10.84355      7.720808 
1 1 1 -4  18 2  o 181.6401 3.075861 402.0813       13.61490 446.0491       22.42384 376.4087       17.13474 191.2261 4.815843 175.7338 4.001163 15.49236       6.261122 
1 1 1 -4  18 3  o 122.9541 3.464561 184.3930       10.37036 207.9768       18.55161 173.6740       12.50696 130.4714 5.849735 119.2883 4.309554 11.18310       7.265786 
1 1 1 -4  18 4  o 175.2334 3.911845 374.2659       16.70455 384.3639       29.13270 369.3196       20.38932 177.3970 6.751367 173.9908 4.813468 3.406265       8.291587 
1 1 1 -4  18 5  o 387.8888 5.878256 1834.616       55.56380 1778.175       76.89104 1896.299       80.38341 381.7365 8.265631 394.2047 8.367745 -12.46829      11.76180 
1 1 1 -4  18 6  o 650.6159 8.434598 5165.896       133.7289 5136.697       210.8547 5185.545       172.9662 648.0001 13.35279 651.5065 10.89448 -3.506409      17.23330 
1 1 1 -4  18 7  o 378.6492 5.158749 1748.033       47.60115 1773.025       61.97040 1712.065       74.34228 381.2670 6.669895 374.5599 8.144763 6.707031       10.52733 
1 1 1 -4  18 8  o 507.2426 7.481395 3139.318       92.47715 3158.478       185.7230 3133.001       106.6367 507.5103 15.03363 506.6161 8.637569 0.8942261      17.33832 
1 1 1 -4  18 9  o 373.9530 5.106661 1705.053       46.53612 1693.904       73.55071 1712.496       60.09387 372.5349 8.101842 374.6835 6.581571 -2.148529      10.43824 
1 1 1 -4  18 10 o 175.7507 3.065512 376.4584       13.12914 402.1777       22.00610 362.2441       16.35971 181.5470 4.978837 172.3866 3.894361 9.160461       6.320986 
1 1 1 -4  18 11 o 489.9669 6.481184 2928.969       77.38508 2996.195       124.5799 2886.733       98.74610 495.0541 10.32665 486.2112 8.334103 8.842896       13.27015 
1 1 1 -4  18 12 o 205.8356 3.305118 516.4354       16.57844 508.5468       26.46936 521.5276       21.26636 204.1249 5.325770 206.8226 4.219481 -2.697678      6.794693 
1 1 1 -4  18 13 o 384.8591 5.231840 1806.724       49.06732 1763.355       76.80695 1836.629       63.77847 379.8928 8.296661 387.8884 6.747317 -7.995636      10.69396 
1 1 1 -4  18 14 o 393.7862 5.954124 1892.547       57.13662 1948.451       83.02675 1842.255       78.74957 399.2115 8.534515 388.2122 8.324208 10.99936       11.92185 
1 1 1 -4  18 15 o 228.5868 3.509183 637.0819       19.54759 626.9302       31.24815 643.6086       25.05536 226.6385 5.657889 229.7071 4.476000 -3.068573      7.214311 
1 1 1 -4  18 16 o 398.9387 6.045572 1943.577       58.77324 1915.452       82.77155 1972.177       83.46866 395.5869 8.586241 401.4131 8.532884 -5.826141      12.10511 
1 1 1 -4  18 17 o 89.41542 3.063893 97.59611       6.666226 86.75297       10.27077 105.4889       8.762733 84.15392 5.031299 92.91564 3.878562 -8.761726      6.352733 
1 1 1 -4  18 18 o 279.2812 4.534814 951.9976       30.86294 938.6895       43.83448 965.0803       43.46149 277.0727 6.492111 280.9623 6.347759 -3.889618      9.079734 
1 1 1 -4  18 19 o 160.1462 3.758425 312.9155       14.66759 338.9804       28.32873 303.3687       17.14457 166.2591 7.007783 157.5773 4.469264 8.681808       8.311639 
1 1 1 -4  18 20 o 247.4294 4.817086 747.8179       29.04503 718.6870       51.15002 761.6809       35.28569 241.7281 8.697434 249.5718 5.801858 -7.843719      10.45500 
1 1 1 -4  18 21 o 291.8813 5.364437 1041.617       38.15633 1087.097       67.69452 1020.439       46.19350 297.0038 9.364800 288.6526 6.567035 8.351166       11.43789 
1 1 1 -4  18 22 o 265.7071 4.373863 862.3743       28.32073 907.3187       41.73990 824.0314       38.55280 272.1805 6.293009 259.4281 6.098216 12.75235       8.763001 
1 1 1 -4  18 23 o 291.5835 4.689583 1039.217       33.32217 997.5767       46.42452 1083.468       47.85748 285.2190 6.679329 297.2648 6.606482 -12.04578      9.394629 
1 1 1 -4  18 24 o 43.94164 3.612449 23.73414       3.834118 29.01964       6.224339 20.50232       4.867142 48.39817 5.367645 40.63300 5.022191 7.765171       7.350783 
1 1 1 -4  18 25 o 189.3563 3.544629 437.8562       16.35636 448.7859       23.83717 428.1316       22.48480 191.4078 5.115034 186.9820 4.938938 4.425781       7.110322 
1 1 1 -4  18 26 o 72.91833 3.705224 65.12687       6.562380 62.60419       9.917087 67.09197       8.752793 71.21966 5.763299 73.87196 4.889696 -2.652306      7.558092 
1 1 1 -4  18 27 o 205.0388 3.712448 513.7760       18.54952 512.3932       26.53877 515.0969       25.93753 204.3710 5.333309 204.9447 5.197641 -0.5737457     7.447124 
1 1 1 -4  18 28 o 173.4515 3.409196 367.5977       14.41007 344.9899       20.06361 391.6848       20.70958 167.7110 4.914507 178.7461 4.758663 -11.03511      6.840852 
1 1 1 -4  18 29 o 80.05638 3.788395 78.56007       7.369764 74.34860       8.564326 90.57729       14.46701 77.77312 4.538568 85.38987 7.014203 -7.616745      8.354499 
1 1 1 -4  18 30 o 100.9484 3.029339 124.6168       7.443747 136.2897       11.01815 114.8156       10.09625 105.3860 4.299349 96.71394 4.294569 8.672028       6.076818 
1 1 1 -4  18 31 o 38.82532 4.323796 18.70782       4.021548 18.31524       6.026776 19.02292       5.399452 37.93036 6.768543 38.86224 5.885483 -0.9318810     8.969509 
1 1 1 -4  18 32 o 51.00133 4.061305 32.09192       5.005919 31.93052       8.018139 32.19502       6.408271 50.34085 6.702461 50.87473 5.243996 -0.5338707     8.510139 
1 1 1 -4  18 33 o 64.73633 3.337747 51.45762       5.247696 58.46574       7.832228 45.74873       7.069039 68.76671 4.702103 60.76915 4.812821 7.997559       6.728523 
1 1 1 -4  18 34 o 81.80928 3.207998 82.13338       6.383077 81.50741       9.067626 82.74826       8.986980 81.19134 4.601819 81.82866 4.524453 -0.6373215     6.453481 
1 1 1 -4  18 35 o 41.37077 5.228284 21.55920       5.153448 18.08952       10.22298 22.74132       5.967107 36.64583 10.75009 42.31090 5.951564 -5.665070      12.28761 
1 1 1 -4  18 36 o 25.10781 6.697204 8.259624       4.173047 8.819025       5.388445 7.421352       6.596214 26.01968 7.847471 24.95455 8.762137 1.065130       11.76256 
1 1 1 -4  18 37 o 17.06992 6.385749 2.921132       3.577984 1.049492       4.981693 4.915313       5.142189 17.03506 7.137231 21.04848 7.694501 -4.013422      10.49502 
1 1 1 -4  18 38 o 40.30079 4.362289 20.54060       4.215926 16.26902       5.783447 25.38443       6.158667 34.79822 7.061766 44.25153 5.854637 -9.453312      9.173076 
1 1 1 -4  18 39 o 27.46271 5.648884 10.03139       3.654186 11.72653       5.339819 8.538359       5.011400 29.02932 7.496478 24.93000 7.578362 4.099319       10.65968 
1 1 1 -4  18 40 o 64.60145 3.396240 52.35391       5.327807 43.57158       7.417901 61.71179       7.657105 57.71156 5.334873 69.37525 4.554413 -11.66370      7.014524 
1 1 1 -4  18 41 o 22.41936 6.631519 7.140647       3.876787 6.933524       5.383516 7.363755       5.587376 22.21464 7.905148 22.73828 8.057249 -0.5236416     11.28763 
1 1 1 -4  18 42 f 32.88324 7.364350 16.34339       5.754272 14.01821       7.122005 20.71504       9.765553 28.82588 9.081038 33.23561 10.65302 -4.409731      13.99829 
1 1 1 -4  18 43 o 16.47438 6.430698 3.350257       3.731056 -2.518874      4.861658 11.76029       5.819643 13.10232 6.126422 26.33027 8.196374 -13.22794      10.23297 
1 1 1 -4  18 44 o 14.54023 6.137523 1.812655       3.727305 6.690015       5.271411 -3.063941      5.270998 20.21740 7.708751 13.11178 6.207019 7.105621       9.897067 
1 1 1 -4  18 45 o 16.54066 7.271797 2.978909       5.661498 2.978909       5.661498 0.000000       0.000000 16.54066 7.271797 ?        ?        0.000000       7.271797 
1 1 1 -4  18 46 o 14.74326 6.396081 2.404569       4.255678 -0.9333443E-01 7.717013 3.496205       5.101528 15.45924 7.372907 16.04309 6.981038 -0.5838556     10.15355 
1 1 1 -4  18 47 o 13.21060 6.019645 0.8444638      4.274493 -4.168947      7.325817 3.432347       5.263344 13.37779 6.563990 15.52632 6.909184 -2.148529      9.530099 
1 1 1 -4  18 48 o 10.80856 5.147048 -1.786651      3.731530 -3.025522      5.675947 -0.8435951     4.952151 12.22527 5.950452 12.53412 5.957558 -0.3088474     8.420236 
1 1 1 -4  19 1  o 208.7930 3.737422 531.3573       19.01622 490.1808       35.97665 547.3217       22.40131 200.3051 7.383061 211.8938 4.338295 -11.58868      8.563316 
1 1 1 -4  19 2  o 274.7413 3.997598 920.0770       26.76450 1006.759       44.40867 870.6312       33.54039 287.3065 6.342875 267.2224 5.150616 20.08417       8.170735 
1 1 1 -4  19 3  o 57.69641 3.121249 40.68897       4.372132 35.47234       6.536160 44.91328       5.881745 53.70244 5.053922 60.56904 4.007451 -6.866604      6.449944 
1 1 1 -4  19 4  o 422.9711 6.354074 2182.080       65.49362 2374.378       137.8052 2125.971       74.43774 440.3357 12.85615 417.4282 7.317712 22.90750       14.79289 
1 1 1 -4  19 5  o 305.5812 4.839941 1138.477       36.04150 1168.589       51.57211 1109.731       50.38923 309.5020 6.837782 301.6061 6.855853 7.895905       9.682871 
1 1 1 -4  19 6  o 502.6512 7.419849 3083.107       90.88618 3103.551       128.9818 3062.945       128.0878 503.9374 10.50306 500.6304 10.49916 3.307068       14.85081 
1 1 1 -4  19 7  o 568.8566 9.596322 3953.289       133.0282 3971.885       230.5154 3944.003       162.8890 568.4479 16.65873 567.8103 11.77206 0.6376343      20.39840 
1 1 1 -4  19 8  o 238.7531 5.776584 695.2604       33.60904 674.3543       47.80472 715.6934       47.26067 234.8566 8.366160 241.9890 8.025451 -7.132339      11.59312 
1 1 1 -4  19 9  o 388.1772 5.286858 1837.682       50.01080 1891.580       81.01516 1804.499       63.56821 393.5443 8.447662 384.5410 6.783616 9.003326       10.83423 
1 1 1 -4  19 10 o 609.9107 7.953027 4543.028       118.2047 4530.044       186.8985 4551.684       152.6014 607.9724 12.61496 610.0212 10.26544 -2.048889      16.26396 
1 1 1 -4  19 11 o 457.9421 6.115306 2559.123       68.24406 2481.164       105.8877 2614.512       89.25358 450.4012 9.647388 462.6326 7.916865 -12.23145      12.47994 
1 1 1 -4  19 12 o 302.8153 4.310881 1118.236       31.81120 1181.159       52.45940 1081.641       40.00591 311.0086 6.921731 297.7383 5.513829 13.27032       8.849445 
1 1 1 -4  19 13 o 420.3267 6.319728 2157.142       64.73236 2202.780       93.41428 2114.983       89.78436 424.2922 9.034667 415.7840 8.861287 8.508209       12.65494 
1 1 1 -4  19 14 o 194.7355 3.560456 462.4021       16.89611 470.1373       24.89471 455.7960       23.00628 196.2052 5.211288 193.2141 4.890134 2.991180       7.146393 
1 1 1 -4  19 15 o 314.2200 4.983603 1205.018       38.16044 1275.454       56.45362 1145.756       51.78246 322.9866 7.172510 306.1579 6.940665 16.82870       9.980868 
1 1 1 -4  19 16 o 270.9425 4.437060 895.8098       29.29602 919.6251       42.55170 874.3483       40.39410 274.3017 6.365791 267.4857 6.196998 6.816010       8.884035 
1 1 1 -4  19 17 o 275.2826 5.202155 925.5325       34.89780 911.8517       61.49986 932.0298       42.38199 272.3846 9.278762 276.0949 6.299220 -3.710358      11.21497 
1 1 1 -4  19 18 o 129.4691 3.518172 204.6393       11.08962 202.7804       20.98078 205.3600       13.06359 128.5461 6.721063 129.6484 4.140153 -1.102341      7.893894 
1 1 1 -4  19 19 o 173.3280 3.392880 366.5152       14.33090 363.5757       20.81010 369.1667       19.76422 172.4374 4.957441 173.7934 4.670939 -1.355957      6.811306 
1 1 1 -4  19 20 f 228.9745 4.517945 640.3862       25.20949 676.2497       45.16019 624.1517       30.38421 234.5774 7.911438 225.9177 5.519015 8.659714       9.646262 
1 1 1 -4  19 21 o 298.6485 4.789886 1090.003       34.85954 1030.803       48.17494 1155.070       50.50525 289.9806 6.817358 306.9804 6.751337 -16.99979      9.594629 
1 1 1 -4  19 22 o 228.1433 3.955126 635.6202       21.98893 636.8353       31.70304 634.4937       30.52452 228.0135 5.710132 227.7023 5.501047 0.3111877      7.928879 
1 1 1 -4  19 23 o 98.27162 2.928049 117.9342       7.004190 124.8579       10.70069 112.7442       9.264625 100.9828 4.358651 95.99109 3.969161 4.991730       5.895089 
1 1 1 -4  19 24 o 116.7584 3.005551 166.4773       8.544513 161.6037       12.54017 170.7007       11.67382 114.8765 4.488206 118.1230 4.061522 -3.246544      6.053094 
1 1 1 -4  19 25 o 155.8113 3.673967 296.5768       13.94987 309.5585       18.32991 278.7094       21.50434 158.9782 4.736651 150.6286 5.869683 8.349548       7.542483 
1 1 1 -4  19 26 o 146.7739 3.182533 263.0502       11.38303 258.2994       16.39155 267.4752       15.81975 145.1942 4.638658 147.7944 4.397325 -2.600250      6.391683 
1 1 1 -4  19 27 o 221.3770 3.901989 599.2661       21.05012 615.2630       30.59522 584.8868       29.00697 223.8178 5.613913 218.3353 5.451829 5.482513       7.825501 
1 1 1 -4  19 28 o 114.3417 3.754968 160.0468       10.44859 161.4960       12.54072 156.7576       18.89393 114.7434 4.493646 112.5303 6.923484 2.213173       8.253938 
1 1 1 -4  19 29 o 115.0440 3.772795 162.0937       10.56271 165.5214       12.61607 154.0584       19.31620 116.1366 4.466109 111.4101 7.152558 4.726479       8.432391 
1 1 1 -4  19 30 o 87.48272 3.067744 93.65065       6.529875 86.02797       9.447708 100.6225       9.035363 83.60458 4.655634 90.53468 4.106071 -6.930099      6.207636 
1 1 1 -4  19 31 o 35.12008 5.078489 15.47522       4.220319 12.64840       6.973257 17.10910       5.301496 31.32334 8.782903 36.74438 6.136968 -5.421043      10.71456 
1 1 1 -4  19 32 o 31.80289 5.277557 12.79209       3.946809 13.83525       6.023660 12.00736       5.224517 32.64845 7.697439 30.46367 7.159506 2.184774       10.51233 
1 1 1 -4  19 33 o 56.82771 3.552669 39.75566       4.895229 41.61823       7.211264 38.16383       6.666573 57.82541 5.172037 55.39552 4.991961 2.429893       7.188160 
1 1 1 -4  19 34 o 98.19770 3.769288 118.7145       9.003049 117.4837       17.51419 119.1565       10.49595 96.22636 7.528856 98.19884 4.397261 -1.972481      8.718921 
1 1 1 -4  19 35 o 98.24872 3.686836 119.0411       8.811417 114.9521       16.82017 120.5877       10.34441 94.88609 7.331126 98.66906 4.312599 -3.782967      8.505524 
1 1 1 -4  19 36 o 54.00035 4.008184 36.29443       5.236881 37.53236       6.923824 34.63949       8.005511 54.50639 5.278694 51.88528 6.471859 2.621113       8.351620 
1 1 1 -4  19 37 o 41.27139 4.322161 21.46403       4.282571 19.38894       6.030199 23.57566       6.083086 38.33780 6.698251 42.64963 6.020151 -4.311829      9.006042 
1 1 1 -4  19 38 o 21.00895 6.400867 5.817247       3.572371 3.904439       5.017539 7.783674       5.087377 19.54087 7.503362 24.09949 7.685275 -4.558624      10.74076 
1 1 1 -4  19 39 o 14.13524 5.950674 0.7477005      3.488837 1.166190       4.946894 0.3335589      4.921129 16.65794 7.052946 15.94768 6.898375 0.7102594      9.865679 
1 1 1 -4  19 40 o 28.70713 5.753453 11.23970       3.884580 6.426549       5.435715 16.26357       5.553427 21.88488 7.924242 33.93782 6.949015 -12.05294      10.53956 
1 1 1 -4  19 41 o 60.00225 5.179925 48.17136       7.499942 45.06528       9.629078 52.96199       11.95844 55.74894 7.260113 58.67865 8.619672 -2.929714      11.26978 
1 1 1 -4  19 42 o 11.02090 5.205084 -3.062170      3.666445 -4.020451      5.006764 -1.954030      5.384039 12.66161 6.010128 14.23521 6.584589 -1.573599      8.915068 
1 1 1 -4  19 43 o 13.27022 5.855279 0.3001535      3.701939 0.5526598      5.346960 0.6768504E-01  5.130418 15.38780 6.897447 14.84843 6.697385 0.5393753      9.614038 
1 1 1 -4  19 44 o 13.02801 5.995556 -0.9469931     4.382855 -6.941365      5.233527 13.12917       8.019822 11.36840 5.571877 24.67019 9.482804 -13.30179      10.99861 
1 1 1 -4  19 45 o 17.87933 6.627507 5.279977       3.836999 3.477008       5.667940 6.805251       5.213208 16.60525 7.288844 19.30198 7.581616 -2.696735      10.51704 
1 1 1 -4  19 46 o 11.83022 5.605460 -1.818136      4.317627 -5.755383      8.311725 -0.3630690     5.052850 13.81458 6.819471 13.34309 6.241190 0.4714870      9.244330 
1 1 1 -4  19 47 o 12.19647 5.595013 0.2133231      3.775095 -2.740572      5.781666 2.408582       4.984233 12.57055 6.092237 14.54825 6.577933 -1.977707      8.965744 
1 1 1 -4  20 1  o 340.6320 6.094858 1415.387       50.59238 1455.536       63.07402 1342.953       84.71957 345.3280 7.495189 331.2623 10.50813 14.06577       12.90731 
1 1 1 -4  20 2  o 180.3578 3.093085 396.4650       13.59449 378.2785       20.67872 410.3080       18.04110 176.0693 4.824067 183.4604 4.035380 -7.391083      6.289350 
1 1 1 -4  20 3  o 130.4875 3.628613 207.7106       11.52720 226.3179       19.64442 197.9389       14.23573 136.0833 5.938066 127.3317 4.595361 8.751526       7.508527 
1 1 1 -4  20 4  o 239.1840 4.082376 697.4350       23.79476 655.4144       45.71044 713.0540       27.86831 231.5421 8.113740 241.8252 4.729039 -10.28314      9.391304 
1 1 1 -4  20 5  o 379.1729 6.677071 1754.399       61.69633 1743.155       105.6628 1760.216       75.99692 377.2293 11.50770 379.6557 8.214290 -2.426361      14.13866 
1 1 1 -4  20 6  f 250.6887 4.815245 766.3551       29.41638 769.8488       50.35203 764.5448       36.24495 250.9274 8.245615 250.3391 5.941317 0.5882721      10.16314 
1 1 1 -4  20 7  f 173.2798 3.360876 366.0038       14.19177 315.7023       25.60268 388.3144       17.05103 160.7048 6.551366 178.4694 3.920582 -17.76463      7.634878 
1 1 1 -4  20 8  o 178.1328 3.467562 386.8159       15.05235 379.0221       30.23378 389.3844       17.35633 176.0545 7.061406 178.7094 3.985423 -2.654907      8.108456 
1 1 1 -4  20 9  o 90.34968 3.069327 99.61827       6.747997 99.90856       14.24860 99.53434       7.661688 90.23365 6.523943 90.29094 3.488688 -0.5728912E-01 7.398160 
1 1 1 -4  20 10 o 375.6212 5.147100 1721.306       47.11386 1772.220       76.36011 1690.009       59.86769 380.7599 8.229609 372.0382 6.603419 8.721680       10.55138 
1 1 1 -4  20 11 o 249.6809 4.815238 760.5140       29.29808 722.6343       50.50688 779.7245       35.96804 242.9164 8.545442 252.7420 5.839870 -9.825592      10.35030 
1 1 1 -4  20 12 o 62.32288 3.393466 47.49816       5.134350 52.23251       8.358904 44.62972       6.506413 65.20555 5.306350 60.32241 4.457651 4.883141       6.930223 
1 1 1 -4  20 13 o 222.4766 3.912058 603.6826       21.20927 613.3903       30.78781 594.9147       29.25939 224.0669 5.643009 220.7523 5.439062 3.314575       7.837534 
1 1 1 -4  20 14 o 284.2000 5.326777 986.1873       36.89136 964.0484       64.25330 997.0745       45.05833 280.2162 9.422894 285.6226 6.473608 -5.406403      11.43235 
1 1 1 -4  20 15 o 173.5627 4.760514 368.0101       20.11573 366.5994       30.19319 369.1361       26.97409 172.9404 7.179959 173.6465 6.385352 -0.7060699     9.608565 
1 1 1 -4  20 16 o 371.8067 5.701948 1689.463       51.66264 1664.421       104.0337 1697.660       59.52038 367.1179 11.64346 372.5272 6.556494 -5.409302      13.36255 
1 1 1 -4  20 17 o 173.7477 3.021061 368.1728       12.79130 379.3790       21.28737 361.8401       16.00245 176.1625 4.963702 172.1991 3.813461 3.963379       6.259459 
1 1 1 -4  20 18 o 39.65558 3.450216 19.33105       3.301005 15.58074       6.090716 20.89080       3.927917 35.00317 7.373622 41.18151 3.962900 -6.178337      8.371074 
1 1 1 -4  20 19 o 131.7268 3.462143 211.8777       11.10398 228.4391       20.31797 204.8248       13.25924 136.4785 6.124744 129.4474 4.208884 7.031097       7.431500 
1 1 1 -4  20 20 o 241.7066 4.124860 713.4400       24.29594 739.3020       35.72719 691.1907       33.13801 245.7480 5.965858 237.6618 5.721778 8.086197       8.266209 
1 1 1 -4  20 21 o 89.02127 2.978282 96.79129       6.451843 102.1575       10.17553 93.18351       8.343388 91.31203 4.587610 87.26536 3.933529 4.046669       6.043080 
1 1 1 -4  20 22 o 142.6763 3.544086 248.5315       12.32232 227.3298       21.06654 259.5579       15.19232 136.0045 6.374023 145.6773 4.284186 -9.672760      7.680001 
1 1 1 -4  20 23 o 119.7867 3.012136 175.2199       8.785665 170.3512       12.90827 179.4218       11.99189 117.9483 4.499218 121.1059 4.069147 -3.157608      6.066376 
1 1 1 -4  20 24 o 74.20403 3.372798 67.37492       6.082990 71.92666       8.644185 62.90962       8.561702 76.53300 4.656930 71.51902 4.942905 5.013977       6.791120 
1 1 1 -4  20 25 o 46.45150 3.614127 26.52110       4.058921 30.34118       6.774355 24.38168       5.069663 49.40710 5.732854 44.37651 4.762447 5.030586       7.452954 
1 1 1 -4  20 26 o 81.33800 3.038357 80.89445       6.011798 92.18138       9.535733 73.44892       7.744864 86.65798 4.531280 77.38070 4.122066 9.277283       6.125678 
1 1 1 -4  20 27 o 81.23911 3.121671 80.73044       6.168499 84.20065       9.510343 78.21036       8.104488 82.76279 4.735232 79.83424 4.180384 2.928551       6.316490 
1 1 1 -4  20 28 o 16.81135 6.968626 0.9222193      4.675708 -0.7251581     5.324626 6.472092       9.773140 16.50020 7.156376 27.24695 10.46949 -10.74676      12.68164 
1 1 1 -4  20 29 o 86.70911 3.072997 91.99629       6.482996 87.51197       9.612715 95.73768       8.780396 84.32669 4.696387 88.31514 4.090952 -3.988449      6.228317 
1 1 1 -4  20 30 o 49.11757 3.808307 29.72215       4.522735 24.35606       6.756684 34.07827       6.087721 43.92612 6.508764 52.45344 4.816325 -8.527313      8.096974 
1 1 1 -4  20 31 f 123.6816 3.509185 187.4797       10.56594 182.6849       17.98176 190.0081       13.05797 121.3759 6.098985 124.3285 4.316464 -2.952599      7.471912 
1 1 1 -4  20 32 o 156.6261 3.358273 300.5558       12.81788 297.8489       18.62466 302.9917       17.66762 155.3538 4.925831 156.8067 4.628633 -1.452911      6.759295 
1 1 1 -4  20 33 o 66.19064 3.461389 53.90491       5.563798 62.03573       8.523052 47.86708       7.344604 70.66883 4.981065 62.05426 4.896569 8.614567       6.984798 
1 1 1 -4  20 34 o 117.6150 3.688401 170.3968       10.55844 176.2808       20.48917 168.2694       12.32025 117.8861 7.166087 116.6344 4.342259 1.251671       8.379022 
1 1 1 -4  20 35 o 33.85201 5.507442 14.69278       4.387258 12.30486       5.936220 17.56711       6.512831 30.34311 7.938380 36.40499 7.587661 -6.061874      10.98137 
1 1 1 -4  20 36 o 33.09057 4.935177 13.99267       3.858130 11.11854       5.743394 16.35613       5.208220 28.69169 7.943528 35.37590 6.271085 -6.684210      10.12058 
1 1 1 -4  20 37 o 68.37695 3.317164 58.03883       5.510806 52.30252       7.760313 63.87419       7.827028 64.14787 5.003894 71.17925 4.535999 -7.031380      6.753831 
1 1 1 -4  20 38 o 21.24974 6.394708 6.043543       3.580911 6.151541       5.107670 5.939147       5.021770 21.94042 7.709832 21.64697 7.641512 0.2934475      10.85515 
1 1 1 -4  20 39 o 29.59394 5.534705 11.75800       3.844775 9.558652       5.467727 13.90912       5.407440 25.76463 7.932029 31.33676 7.228422 -5.572130      10.73160 
1 1 1 -4  20 40 o 28.82120 6.450940 11.76329       4.417548 9.149644       6.742747 13.72880       5.847230 24.69804 8.840548 30.24170 7.862321 -5.543659      11.83095 
1 1 1 -4  20 41 o 16.37373 6.732446 2.475989       4.316826 4.057066       5.058444 -1.761590      8.281317 18.51707 7.405434 17.52191 8.126225 0.9951611      10.99436 
1 1 1 -4  20 42 o 10.35043 4.925246 -3.266187      3.404068 -9.130142      4.595965 3.859994       5.066521 9.956293 4.942450 17.88313 7.316698 -7.926840      8.829602 
1 1 1 -4  20 43 o 32.11700 6.477244 15.85317       4.894305 17.27090       5.966000 12.93533       8.558892 32.10410 7.720804 24.78651 9.720860 7.317591       12.41394 
1 1 1 -4  20 44 o 22.14543 7.372223 8.712351       4.655811 10.35822       6.033756 6.290238       7.319597 22.92109 8.341660 19.27664 8.375346 3.644451       11.82073 
1 1 1 -4  20 45 f 12.82555 5.720012 0.7120304      3.628154 5.283361       5.805995 -2.216738      4.647270 17.59432 7.550532 12.16291 5.778288 5.431407       9.507847 
1 1 1 -4  20 46 f 15.52076 6.516609 3.748644       4.166584 2.504610       7.976101 4.215526       4.886281 15.99387 7.590099 16.08198 6.914499 -0.8810425E-01 10.26742 
1 1 1 -4  20 47 o 15.00219 6.337989 3.611543       3.980360 5.588310       6.107388 2.151947       5.248005 16.65627 7.425360 14.39213 6.600230 2.264141       9.934737 
1 1 1 -4  21 1  o 51.63083 3.709658 32.66648       4.636333 25.65644       5.960773 43.40265       7.376789 45.53204 5.482350 59.42973 5.144237 -13.89769      7.517934 
1 1 1 -4  21 2  o 286.8234 4.616446 1003.269       32.26699 962.1116       44.28778 1049.835       47.10746 280.7592 6.473124 293.2701 6.591523 -12.51099      9.238480 
1 1 1 -4  21 3  o 128.8444 4.465063 202.6840       13.99820 216.8973       20.62085 190.5363       19.06362 133.1560 6.373418 124.7896 6.289167 8.366364       8.953999 
1 1 1 -4  21 4  o 142.4622 4.562990 247.7639       15.82066 0.000000       0.000000 247.7639       15.82066 ?        ?        142.4622 4.562990 0.000000       4.562990 
1 1 1 -4  21 5  o 135.0353 3.098673 222.2731       10.19669 199.5631       13.57241 251.7007       15.44993 127.8500 4.362715 143.5968 4.420416 -15.74681      6.210745 
1 1 1 -4  21 6  o 168.4667 3.352777 345.9890       13.76432 326.4727       18.75419 368.7758       20.26483 163.5369 4.710850 173.8126 4.788943 -10.27571      6.717595 
1 1 1 -4  21 7  o 316.3194 4.990332 1220.652       38.46727 1228.776       54.49123 1212.582       54.31108 317.1762 7.050012 315.0766 7.073530 2.099670       9.986866 
1 1 1 -4  21 8  o 278.5492 4.524288 946.4050       30.71060 1028.936       45.53480 877.5383       41.59482 290.2810 6.437077 268.0820 6.367010 22.19901       9.053992 
1 1 1 -4  21 9  o 203.3063 3.745911 504.0260       18.55857 500.2531       26.69446 507.5555       25.81899 202.3841 5.417504 203.8758 5.201064 -1.491653      7.510021 
1 1 1 -4  21 10 o 53.26185 4.694174 34.87949       6.030441 28.03391       8.130640 43.25000       8.990737 47.34641 7.279721 59.17035 6.333686 -11.82393      9.649348 
1 1 1 -4  21 11 o 149.3124 3.775398 272.0761       13.72607 266.9934       23.88769 274.5815       16.77126 147.6609 6.655645 149.9415 4.595372 -2.280548      8.087957 
1 1 1 -4  21 12 o 106.5572 3.507419 138.6232       9.095244 124.5095       16.08108 145.2616       11.02870 100.7127 6.588492 109.0386 4.158193 -8.325890      7.790944 
1 1 1 -4  21 13 o 148.7008 3.217460 269.6507       11.65903 246.2208       23.21564 277.5530       13.48257 141.7314 6.741008 150.8447 3.667808 -9.113281      7.674243 
1 1 1 -4  21 14 o 113.1435 2.999146 156.2150       8.261907 156.3700       17.90279 156.1730       9.312897 112.8806 6.536218 113.1050 3.382634 -0.2244263     7.359644 
1 1 1 -4  21 15 o 281.8479 4.097129 969.5238       28.14042 948.4281       44.51620 983.5641       36.31700 278.4026 6.561585 283.7295 5.252539 -5.326935      8.404972 
1 1 1 -4  21 16 o 141.6324 3.112481 244.6723       10.74250 237.4578       15.92007 250.7032       14.55581 139.3575 4.694603 143.2472 4.174242 -3.889679      6.282005 
1 1 1 -4  21 17 o 72.24341 2.746750 63.73944       4.826826 60.68537       8.448803 65.21924       5.881071 70.29909 4.963759 73.04057 3.312746 -2.741478      5.967680 
1 1 1 -4  21 18 o 169.3837 3.312014 350.0609       13.67099 315.0150       26.59862 362.6426       15.93716 160.1828 6.829752 172.3640 3.794269 -12.18120      7.812937 
1 1 1 -4  21 19 o 341.1021 4.763117 1421.996       39.59239 1428.928       63.44279 1417.574       50.67028 341.1202 7.632008 340.2370 6.111330 0.8831482      9.777316 
1 1 1 -4  21 20 o 156.0412 3.276810 297.1496       12.46025 310.8578       18.69497 286.1927       16.71389 159.3808 4.818943 152.9657 4.488667 6.415085       6.585616 
1 1 1 -4  21 21 o 207.8420 3.778147 527.5621       19.13588 518.9905       27.54471 535.5583       26.60422 205.8101 5.496985 209.1927 5.218766 -3.382675      7.579734 
1 1 1 -4  21 22 o 95.79446 3.016869 112.1013       7.033819 112.0929       10.87068 112.1073       9.225267 95.61757 4.679546 95.70732 3.964047 -0.8975220E-01 6.132848 
1 1 1 -4  21 23 o 151.1343 3.679090 279.0349       13.55001 301.6928       18.26863 251.3270       20.20214 156.9388 4.782407 143.0430 5.807627 13.89581       7.523293 
1 1 1 -4  21 24 o 35.00544 4.411122 15.22547       3.679509 13.74882       6.488172 15.92553       4.467365 32.72974 8.162707 35.66770 5.300644 -2.937958      9.732760 
1 1 1 -4  21 25 o 113.6865 3.053171 157.9289       8.450900 151.0250       12.42463 163.8726       11.52839 110.9691 4.604578 115.6774 4.096093 -4.708351      6.162801 
1 1 1 -4  21 26 o 162.7669 3.359264 323.7111       13.32436 324.5795       19.55474 322.9585       18.20461 162.6469 4.939394 162.3131 4.607138 0.3338165      6.754505 
1 1 1 -4  21 27 o 80.22417 4.088368 78.98149       7.966305 70.13148       9.341969 102.5695       15.25149 75.42600 5.112763 90.89407 6.938009 -15.46806      8.618371 
1 1 1 -4  21 28 o 128.1325 3.164711 200.6645       9.881651 206.7052       14.78829 195.7915       13.28224 129.7251 4.685671 126.3259 4.320983 3.399185       6.373885 
1 1 1 -4  21 29 o 159.9441 3.368167 312.9382       13.12798 311.8752       19.17035 313.8769       18.01499 159.2347 4.946333 159.8382 4.629937 -0.6035309     6.775141 
1 1 1 -4  21 30 o 89.98373 3.445732 99.26566       7.541859 96.09702       13.26033 100.7807       9.169342 87.92434 6.229170 90.54156 4.166967 -2.617226      7.494410 
1 1 1 -4  21 31 f 18.07318 6.480542 3.467427       3.624971 -1.250962      5.582886 6.906571       4.766363 16.45385 7.227798 23.60214 7.428087 -7.148293      10.36424 
1 1 1 -4  21 32 o 15.32455 6.165825 1.401704       3.528944 5.797299       5.772253 -1.221786      4.459398 22.90664 8.181872 14.54248 6.421123 8.364161       10.40067 
1 1 1 -4  21 33 f 32.71380 6.059544 13.76669       4.652812 13.17986       10.52288 13.90930       5.187455 32.34887 11.08264 32.71910 6.730778 -0.3702316     12.96643 
1 1 1 -4  21 34 o 46.60044 5.241693 27.40841       5.849369 40.48698       11.46856 22.80999       6.800377 55.25369 8.813375 41.92377 6.895908 13.32991       11.19058 
1 1 1 -4  21 35 o 26.59634 5.906528 9.271487       3.728500 11.13456       5.984534 8.089538       4.766661 28.76680 8.161077 24.79350 7.358296 3.973305       10.98853 
1 1 1 -4  21 36 o 40.65623 4.315416 20.87079       4.210266 22.07566       6.219953 19.85187       5.719864 40.99738 6.437683 38.92025 6.241693 2.077133       8.966743 
1 1 1 -4  21 37 o 41.86769 4.228046 22.22939       4.254707 20.22032       6.037442 24.21157       5.996891 38.84920 6.614029 42.96613 5.881711 -4.116932      8.850984 
1 1 1 -4  21 38 o 31.13218 5.095917 12.75251       3.732421 14.12694       5.507815 11.58535       5.075527 31.71032 7.281484 28.68026 7.257360 3.030064       10.28053 
1 1 1 -4  21 39 o 10.49752 4.944158 -3.033969      3.266571 -3.863430      4.597187 -2.188112      4.642404 12.47993 5.873965 13.51906 6.202768 -1.039126      8.542705 
1 1 1 -4  21 40 o 37.49374 4.948865 18.86398       4.411384 25.95108       6.259756 11.87171       6.217735 43.06778 6.137925 27.29515 8.468111 15.77263       10.45863 
1 1 1 -4  21 41 o 16.89882 6.794087 3.243909       4.281267 6.296061       5.211597 -3.090646      7.508028 20.54529 7.702545 15.95108 7.507413 4.594218       10.75595 
1 1 1 -4  21 42 o 42.64695 5.275042 25.63495       5.365382 29.66844       6.656409 18.15364       9.065433 44.71690 6.281406 29.31780 10.27373 15.39910       12.04183 
1 1 1 -4  21 43 o 22.70398 7.163941 8.727416       4.430694 7.124820       5.565266 11.50145       7.321995 20.29583 7.873166 23.67238 9.070614 -3.376551      12.01094 
1 1 1 -4  21 44 o 17.69440 6.657675 5.138062       3.901101 7.288601       5.838778 3.403913       5.243142 19.61135 7.916746 16.36397 7.099328 3.247372       10.63369 
1 1 1 -4  21 45 o 13.58539 6.084014 1.234905       4.149945 -2.696966      8.384390 2.510716       4.776007 14.71455 7.177601 14.95743 6.622808 -0.2428780     9.766245 
1 1 1 -4  21 46 o 15.97913 6.466330 4.427423       3.906036 0.2020008      5.646428 8.305178       5.409148 13.75348 6.484611 19.25106 7.671544 -5.497585      10.04504 
1 1 1 -4  22 1  o 234.1264 3.609731 668.3659       20.59498 694.7653       32.77289 651.1368       26.47584 238.5840 5.636863 231.0320 4.702636 7.551926       7.340913 
1 1 1 -4  22 2  o 173.7441 3.957489 368.1258       16.75582 354.6703       27.77344 375.8259       21.01014 170.2725 6.706554 175.4424 4.919117 -5.169891      8.317186 
1 1 1 -4  22 3  o 200.5882 3.295460 490.5427       16.10859 468.5708       24.49251 507.2920       21.38446 195.8939 5.135126 203.9410 4.302865 -8.047119      6.699564 
1 1 1 -4  22 4  o 242.6642 4.121559 718.1799       24.37268 691.4131       33.47229 748.3873       35.55859 237.9898 5.771530 247.5913 5.893495 -9.601501      8.248869 
1 1 1 -4  22 5  f 80.11762 2.763566 78.33772       5.387451 75.81602       7.967539 80.46185       7.312543 78.73224 4.167592 81.14591 3.707788 -2.413673      5.578218 
1 1 1 -4  22 6  o 602.6596 7.879739 4442.041       115.7231 4595.042       187.0286 4347.128       147.3069 611.1881 12.55732 595.4498 10.15177 15.73828       16.14760 
1 1 1 -4  22 7  o 226.2422 3.960995 624.2911       21.83805 680.4240       46.13477 608.0819       24.79139 235.6915 8.044246 223.2497 4.556946 12.44183       9.245304 
1 1 1 -4  22 8  o 63.41355 3.152056 49.15089       4.855665 39.73186       8.178524 54.27842       6.034283 56.71985 6.008283 66.60813 3.732528 -9.888279      7.073275 
1 1 1 -4  22 9  o 124.8416 3.537753 190.2245       10.75189 166.7737       18.39968 202.3844       13.24940 116.6354 6.499271 128.7273 4.229407 -12.09189      7.754251 
1 1 1 -4  22 10 o 337.1735 5.277436 1388.222       43.36232 1287.028       83.56810 1425.506       50.72545 323.4119 10.61787 341.5474 6.094511 -18.13553      12.24264 
1 1 1 -4  22 11 f 83.78564 2.796585 85.68707       5.701968 82.23515       9.730710 87.49216       7.036616 81.92504 4.896410 84.62794 3.419078 -2.702904      5.972012 
1 1 1 -4  22 12 o 159.4494 2.975734 310.0298       11.56253 297.0141       18.62952 318.1853       14.74658 155.8811 4.910371 161.4947 3.747114 -5.613632      6.176780 
1 1 1 -4  22 13 o 177.2154 3.093129 383.0181       13.35782 376.2500       21.49905 387.2737       17.04769 175.4345 5.034049 178.1457 3.926939 -2.711166      6.384551 
1 1 1 -4  22 14 o 146.2170 2.872498 260.7246       10.23514 269.2513       17.09149 255.9571       12.78010 148.4026 4.732143 144.7913 3.624909 3.611282       5.960968 
1 1 1 -4  22 15 o 55.08474 3.095064 37.12820       4.137964 31.90606       7.138238 39.77121       5.078270 50.73724 5.882221 56.97057 3.677524 -6.233326      6.937197 
1 1 1 -4  22 16 o 143.5665 2.835860 251.3815       9.921424 262.9625       16.69256 245.0556       12.33705 146.6402 4.677240 141.6632 3.576560 4.977020       5.887984 
1 1 1 -4  22 17 o 210.8848 3.750983 542.8555       19.27642 568.0388       40.08654 535.2806       21.98517 214.9698 7.664444 209.3476 4.309490 5.622208       8.792918 
1 1 1 -4  22 18 o 345.4430 5.375472 1459.852       45.25109 1456.990       64.86333 1462.565       63.16005 344.3660 7.729350 345.1039 7.510286 -0.7379456     10.77716 
1 1 1 -4  22 19 o 140.7367 2.820819 241.6281       9.674284 223.4180       15.59667 253.0157       12.33365 135.0976 4.744855 143.9667 3.515552 -8.869080      5.905316 
1 1 1 -4  22 20 o 131.6303 2.766818 211.3801       8.875089 203.7565       14.72368 215.7309       11.12292 128.9987 4.691576 132.8885 3.437637 -3.889832      5.816205 
1 1 1 -4  22 21 o 62.45356 2.846848 47.69234       4.321295 51.48146       7.995982 46.12907       5.135919 64.65034 5.117040 61.36801 3.448184 3.282330       6.170419 
1 1 1 -4  22 22 o 65.11187 3.591555 51.94197       5.676664 55.56325       8.441072 48.95190       7.670209 67.15578 5.198408 63.03186 5.035408 4.123920       7.237319 
1 1 1 -4  22 23 o 108.1518 3.080005 142.9186       8.109213 143.8273       12.45842 142.2506       10.68180 108.2903 4.732463 107.7857 4.074080 0.5046539      6.244545 
1 1 1 -4  22 24 o 62.10089 3.260845 47.23271       4.917446 58.55772       8.482911 41.50098       6.034874 68.93725 5.085374 58.08258 4.294062 10.85467       6.655824 
1 1 1 -4  22 25 o 124.2966 3.139328 188.8243       9.501328 196.3297       14.46500 183.1287       12.60086 126.5060 4.700319 122.2519 4.236092 4.254066       6.327517 
1 1 1 -4  22 26 o 156.3451 4.066855 299.3836       15.48140 297.3633       18.70360 303.7794       27.58934 155.6255 4.938082 156.6138 7.248610 -0.9882355     8.770804 
1 1 1 -4  22 27 o 78.81475 3.199043 76.04808       6.131407 77.65925       9.471963 74.88602       8.044176 79.39220 4.920002 78.06804 4.244326 1.324158       6.497747 
1 1 1 -4  22 28 o 75.35016 3.277827 69.56425       6.004352 68.27428       9.337809 70.47359       7.840079 74.33710 5.187246 75.69742 4.267422 -1.360313      6.717024 
1 1 1 -4  22 29 o 82.68526 3.526443 83.85426       7.089289 80.99491       13.01881 85.05952       8.452374 80.57346 6.690763 83.16781 4.183931 -2.594345      7.891234 
1 1 1 -4  22 30 o 124.9703 3.180259 191.2959       9.677261 197.6421       14.64176 186.3734       12.89541 126.6204 4.753631 123.0815 4.306015 3.538849       6.413951 
1 1 1 -4  22 31 o 114.2654 3.156458 160.0683       8.780807 151.6863       12.97047 167.1601       11.93049 110.7791 4.816157 116.4953 4.209479 -5.716148      6.396491 
1 1 1 -4  22 32 o 24.06676 6.385197 7.504268       3.806061 8.325848       6.147164 6.993509       4.846835 25.87216 8.464976 23.63584 7.497225 2.236317       11.30771 
1 1 1 -4  22 33 o 58.33931 4.673462 42.47408       6.588573 43.91629       12.18105 41.87766       7.833327 57.60129 8.969893 57.61387 5.651998 -0.1258087E-01 10.60208 
1 1 1 -4  22 34 o 36.51384 4.643617 16.85340       4.038563 12.20282       6.392365 19.94276       5.210051 30.08267 8.399755 39.47939 5.570056 -9.396725      10.07876 
1 1 1 -4  22 35 o 68.64922 3.356220 58.39318       5.597625 66.28536       8.556030 52.48738       7.401384 72.50173 4.870968 64.54144 4.738888 7.960289       6.795836 
1 1 1 -4  22 36 o 37.23511 4.399793 17.64228       3.915256 14.03553       5.758813 20.74234       5.339004 31.93004 7.525148 39.90359 5.648198 -7.973553      9.409038 
1 1 1 -4  22 37 o 38.23250 4.494447 18.77092       4.107520 15.05492       6.105640 21.84315       5.551623 32.60428 7.791152 40.65122 5.765728 -8.046944      9.692557 
1 1 1 -4  22 38 o 11.56837 5.325209 -2.067677      3.460738 -1.396392      5.105427 -2.638332      4.707232 14.78779 6.674534 13.40621 6.185384 1.381581       9.099911 
1 1 1 -4  22 39 o 34.62922 5.554791 16.36765       4.529123 22.06158       7.987309 13.66922       5.498575 37.41333 8.892272 30.28954 7.491521 7.123789       11.62736 
1 1 1 -4  22 40 o 21.85689 7.350783 7.250473       4.627244 6.141472       5.491909 9.964313       8.591117 20.66520 7.871009 24.35479 9.680322 -3.689587      12.47643 
1 1 1 -4  22 41 o 41.89764 5.574249 24.90792       5.550227 30.15821       6.820701 14.61743       9.548953 45.22676 6.364480 26.58150 10.31258 18.64527       12.11841 
1 1 1 -4  22 42 o 14.80893 6.244489 1.987517       3.851921 -0.4632775     5.502024 4.343410       5.394446 14.70127 6.747955 17.98823 7.473261 -3.286961      10.06899 
1 1 1 -4  22 43 o 18.49352 6.464437 5.537642       3.587772 4.643866       5.624508 6.150805       4.658633 17.72098 7.512536 19.02052 7.248191 -1.299538      10.43908 
1 1 1 -4  22 44 o 18.50466 6.755992 6.048866       3.962419 2.463561       5.993217 8.833136       5.281443 15.76961 7.163096 20.89892 7.770121 -5.129310      10.56810 
1 1 1 -4  22 45 o 13.95350 6.215151 1.804372       4.269377 6.359463       8.466127 0.2509231      4.944070 17.66057 8.199428 13.45858 6.254464 4.201990       10.31256 
1 1 1 -4  23 1  o 225.4557 5.615939 620.7182       30.85458 662.1298       44.46099 582.2472       42.85334 232.4767 7.859385 217.9505 8.082461 14.52615       11.27369 
1 1 1 -4  23 2  o 258.5507 4.304838 815.5794       27.12305 813.7814       38.00842 817.4451       38.71698 258.1016 6.043005 258.6709 6.142113 -0.5693359     8.616465 
1 1 1 -4  23 3  o 174.5816 3.451944 371.6830       14.68582 374.4141       20.40966 368.7508       21.14778 175.0878 4.787971 173.7388 5.000157 1.348999       6.922878 
1 1 1 -4  23 4  o 86.56743 2.784638 91.45539       5.866702 83.02576       8.494302 99.14408       8.112407 82.38432 4.245357 90.08398 3.703336 -7.699661      5.633627 
1 1 1 -4  23 5  f 516.2684 7.642447 3261.838       96.14884 3105.038       131.4059 3442.514       141.0564 502.6404 10.72807 529.1609 10.93878 -26.52060      15.32150 
1 1 1 -4  23 6  o 111.0341 2.745614 150.3055       7.429030 153.9453       11.41374 147.6300       9.785645 112.2496 4.179904 109.9558 3.657124 2.293709       5.553931 
1 1 1 -4  23 7  o 301.2696 4.808439 1107.991       35.30170 1111.817       49.94084 1104.170       49.90746 301.5059 6.797105 300.4640 6.816114 1.041901       9.626009 
1 1 1 -4  23 8  o 181.1924 3.455310 400.4342       15.25679 396.2656       21.34789 404.7862       21.81232 180.0906 4.868850 182.0124 4.922251 -1.921768      6.923457 
1 1 1 -4  23 9  o 175.4086 3.969650 375.4285       16.96833 0.000000       0.000000 375.4285       16.96833 ?        ?        175.4086 3.969650 0.000000       3.969650 
1 1 1 -4  23 10 o 135.7476 3.169788 224.7445       10.48573 223.2514       21.61308 225.2041       11.99154 134.9211 6.593528 135.8180 3.626353 -0.8968658     7.524961 
1 1 1 -4  23 11 f 306.0036 4.392258 1143.163       32.75295 1136.865       52.24174 1147.242       42.04165 304.6939 7.035871 306.3565 5.631403 -1.662598      9.012002 
1 1 1 -4  23 12 o 267.7166 3.981348 874.7702       25.97416 856.4327       41.21397 886.8525       33.45414 264.5417 6.393140 269.4133 5.095593 -4.871613      8.175409 
1 1 1 -4  23 13 o 316.3399 4.502615 1222.106       34.71003 1234.693       55.83639 1214.178       44.31230 317.3951 7.219065 315.0807 5.771204 2.314453       9.242387 
1 1 1 -4  23 14 o 138.0448 2.836487 232.4145       9.541950 253.7868       16.28237 221.2353       11.77597 144.0621 4.644077 134.5972 3.593465 9.464966       5.872005 
1 1 1 -4  23 15 o 38.45562 3.848546 18.23215       3.558151 14.70263       6.378363 19.82674       4.287219 33.93384 7.866831 40.04149 4.469835 -6.107651      9.048008 
1 1 1 -4  23 16 o 125.9542 3.048543 193.5431       9.357093 193.2119       19.64668 193.6402       10.64153 125.4096 6.450357 125.9147 3.471410 -0.5050659     7.325148 
1 1 1 -4  23 17 o 395.4998 5.411822 1914.081       52.15860 1919.980       83.21967 1910.265       66.93746 394.7983 8.649971 394.5531 6.961898 0.2451477      11.10360 
1 1 1 -4  23 18 o 42.81755 3.625261 22.54377       3.747142 18.88391       6.989398 24.02000       4.438989 38.51889 7.715304 44.14410 4.176085 -5.625210      8.773005 
1 1 1 -4  23 19 o 212.3894 3.792432 550.9677       19.62848 542.9677       28.62966 558.0634       26.96298 210.4705 5.586927 213.5284 5.181746 -3.057831      7.619990 
1 1 1 -4  23 20 o 201.0881 3.314028 493.6842       16.23972 500.4856       26.68775 489.6849       20.46471 202.0574 5.424931 200.1511 4.195769 1.906296       6.858160 
1 1 1 -4  23 21 f 120.2426 2.979194 176.4746       8.729575 175.2920       13.56762 177.3100       11.40346 119.5979 4.664206 120.3903 3.892066 -0.7924042     6.074784 
1 1 1 -4  23 22 o 161.1802 2.985637 317.1430       11.72694 325.7270       19.65356 312.3972       14.61342 163.0018 4.953557 159.8819 3.750738 3.119904       6.213353 
1 1 1 -4  23 23 o 177.3050 3.508271 384.1297       15.15829 392.3625       22.43742 377.2172       20.55959 178.8296 5.154075 175.4188 4.814078 3.410873       7.052647 
1 1 1 -4  23 24 o 56.82011 3.554193 39.61467       4.896645 32.66937       7.964274 43.83566       6.208797 51.10551 6.545069 59.69073 4.297152 -8.585228      7.829651 
1 1 1 -4  23 25 o 152.1069 4.075684 283.3920       15.09365 293.2698       18.62428 264.4889       25.76423 154.5453 4.951632 146.1075 7.258893 8.437759       8.786933 
1 1 1 -4  23 26 o 190.5585 3.673759 444.2771       17.05985 458.8087       25.40802 432.3479       23.02077 193.1144 5.404399 187.5764 5.040801 5.538010       7.390346 
1 1 1 -4  23 27 o 51.77805 3.688136 32.98148       4.623129 33.52521       7.842065 32.69184       5.723488 51.72810 6.354462 51.40947 4.617729 0.3186340      7.855101 
1 1 1 -4  23 28 o 29.90564 5.825022 11.40569       4.092397 14.56845       9.335427 10.65332       4.553212 33.77311 10.35845 28.76743 6.630965 5.005686       12.29908 
1 1 1 -4  23 29 o 116.6356 3.189206 166.6396       9.056118 165.2513       13.73185 167.7081       12.04741 115.7379 4.879694 116.7722 4.240722 -1.034279      6.464916 
1 1 1 -4  23 30 o 61.04874 3.488892 45.85073       5.168782 51.14385       8.481459 42.72343       6.519272 64.05414 5.486380 58.71307 4.592996 5.341072       7.155136 
1 1 1 -4  23 31 o 57.69790 3.542037 41.04053       4.956224 36.59084       7.807220 44.04431       6.414534 53.85388 6.053707 59.58447 4.449831 -5.730591      7.513213 
1 1 1 -4  23 32 o 62.98261 4.453763 49.33070       6.791628 51.45313       12.56995 48.45563       8.071165 62.76590 8.431186 62.13110 5.383868 0.6347961      10.00355 
1 1 1 -4  23 33 o 13.81269 5.910572 0.4937155E-01  3.538904 5.877575       6.138958 -2.851381      4.330945 22.95809 8.404908 13.04494 5.987399 9.913150       10.31947 
1 1 1 -4  23 34 o 57.40269 3.547064 40.91833       4.937541 42.04411       7.532481 40.07018       6.538099 57.47408 5.442971 56.36337 4.805927 1.110710       7.261051 
1 1 1 -4  23 35 o 57.29751 3.578224 40.94096       4.971255 28.22230       7.388197 51.46318       6.720039 46.13871 6.772559 63.93256 4.339049 -17.79385      8.043314 
1 1 1 -4  23 36 o 59.53558 3.532871 44.37872       5.102504 45.11220       7.654268 43.79207       6.845361 59.00488 5.382484 58.45599 4.849012 0.5488815      7.244588 
1 1 1 -4  23 37 o 44.11634 4.024211 24.83151       4.278716 22.08525       6.442945 26.99824       5.722888 39.94877 6.865656 45.30779 5.282268 -5.359016      8.662539 
1 1 1 -4  23 38 o 26.93479 6.903333 10.48191       4.551618 13.60511       8.142875 9.062625       5.489245 28.88493 9.751372 24.67669 7.993955 4.208237       12.60923 
1 1 1 -4  23 39 o 35.83796 5.196426 17.51247       4.405977 15.53657       6.167022 19.57254       6.296997 31.46297 8.020514 36.06475 7.412883 -4.601774      10.92151 
1 1 1 -4  23 40 o 16.13513 6.710620 2.472483       4.356320 1.994935       5.392840 3.369318       7.390347 16.67537 7.217287 19.03037 8.339031 -2.354998      11.02854 
1 1 1 -4  23 41 o 27.85919 6.221714 11.74516       4.117078 5.450951       5.760139 18.31918       5.886782 19.27499 7.833275 33.73475 7.367660 -14.45976      10.75373 
1 1 1 -4  23 42 o 13.61401 6.121359 0.2745332      4.247750 -1.307238      5.465659 2.687075       6.750069 13.97414 6.521491 17.14838 7.713033 -3.174238      10.10053 
1 1 1 -4  23 43 o 9.304156 4.565670 -5.215461      3.547104 3.186144       5.527126 -11.09888      4.625229 16.25902 7.165090 9.102421 4.581907 7.156601       8.504845 
1 1 1 -4  23 44 o 9.824190 4.761175 -3.678492      3.530964 -8.401631      5.546272 -0.4594820     4.578750 10.79536 5.370749 12.86843 5.993286 -2.073071      8.047634 
1 1 1 -4  23 45 o 15.46596 6.580672 3.824702       4.342886 10.54032       9.440105 2.021824       4.891217 18.92358 8.741091 14.32615 6.493026 4.597430       10.88880 
1 1 1 -4  24 1  o 193.2771 4.198708 455.8793       19.77571 451.3408       33.39701 458.3299       24.54064 191.8944 7.154354 193.6448 5.205207 -1.750412      8.847539 
1 1 1 -4  24 2  f 188.4281 3.218925 433.0117       14.78062 465.3776       23.79226 412.6700       18.86190 195.1514 5.007105 183.8886 4.209152 11.26286       6.541258 
1 1 1 -4  24 3  o 165.4583 3.031644 333.8435       12.22371 314.1260       18.35427 349.5598       16.38647 160.3360 4.702617 169.2579 3.972834 -8.921890      6.156137 
1 1 1 -4  24 4  o 247.1367 4.209100 745.3924       25.34910 741.0782       35.49109 749.8851       36.21806 246.2261 5.914924 247.6733 6.000811 -1.447174      8.425916 
1 1 1 -4  24 5  o 87.30481 2.780573 93.03275       5.908189 90.85519       8.766726 94.84476       7.997092 86.18005 4.186934 88.09119 3.733787 -1.911133      5.609954 
1 1 1 -4  24 6  o 97.29595 3.030850 115.5578       7.177370 102.1466       9.465524 133.6998       11.00913 91.38200 4.262320 104.5686 4.329682 -13.18661      6.075650 
1 1 1 -4  24 7  o 129.5840 2.802377 204.7610       8.849404 221.4891       13.96390 193.5335       11.43998 134.6375 4.261396 125.8882 3.733226 8.749359       5.665375 
1 1 1 -4  24 8  o 53.93595 3.193677 35.60677       4.178852 37.31790       6.211009 34.19154       5.648532 55.08398 4.671015 52.73471 4.436548 2.349270       6.442153 
1 1 1 -4  24 9  o 327.8303 5.183090 1313.251       41.40702 1206.411       79.19658 1353.443       48.57517 312.6928 10.40778 332.6491 5.992276 -19.95636      12.00955 
1 1 1 -4  24 10 o 85.37640 3.207817 89.04055       6.662090 88.30396       14.28802 89.24518       7.530831 84.61806 6.991372 85.44453 3.625021 -0.8264694     7.875281 
1 1 1 -4  24 11 o 81.68703 2.891140 81.48412       5.746099 75.42235       9.487350 84.99593       7.221220 78.40692 4.991317 83.38434 3.561982 -4.977417      6.131962 
1 1 1 -4  24 12 o 263.3132 4.434101 846.8034       28.45210 815.0684       39.84754 879.8113       40.63883 258.0133 6.337577 268.0885 6.220522 -10.07523      8.880302 
1 1 1 -4  24 13 o 223.2949 3.549530 608.4966       19.31460 590.6855       30.76734 620.0809       24.81307 219.6431 5.753211 225.2987 4.519453 -5.655579      7.316071 
1 1 1 -4  24 14 o 55.75135 3.297544 38.05942       4.460031 35.66514       7.972845 39.14992       5.380688 53.60981 6.218051 56.48944 3.933289 -2.879631      7.357644 
1 1 1 -4  24 15 o 147.5751 3.793352 266.0845       13.63052 263.3004       24.41398 267.3453       16.42956 146.3467 6.864860 147.8343 4.565998 -1.487579      8.244674 
1 1 1 -4  24 16 o 310.8781 4.454387 1181.161       33.74537 1202.995       54.63223 1167.691       42.90970 312.9848 7.162912 308.8008 5.702181 4.183960       9.155445 
1 1 1 -4  24 17 o 42.67944 3.685027 22.40814       3.795116 31.87840       7.591101 19.25235       4.382055 50.60564 6.291020 39.41013 4.652400 11.19551       7.824433 
1 1 1 -4  24 18 o 158.8995 2.991000 308.1305       11.58177 315.1070       19.28929 304.1975       14.48299 160.3954 4.940905 157.8096 3.766074 2.585876       6.212556 
1 1 1 -4  24 19 o 152.3665 2.939873 283.3289       10.91577 289.9904       18.30974 279.6558       13.59617 153.8503 4.889895 151.3053 3.687451 2.545013       6.124408 
1 1 1 -4  24 20 o 129.9434 3.082352 206.1321       9.760512 199.7274       14.81918 211.0392       12.97151 127.6506 4.772333 131.3270 4.058090 -3.676445      6.264443 
1 1 1 -4  24 21 o 118.0302 2.754856 170.0232       7.923703 177.5965       13.72039 166.2333       9.705883 120.3528 4.687110 116.6057 3.419388 3.747055       5.801829 
1 1 1 -4  24 22 o 103.5704 2.722491 131.0165       6.865327 146.3467       12.27237 124.0339       8.282565 109.2262 4.621129 100.7040 3.379855 8.522202       5.725229 
1 1 1 -4  24 23 o 208.0025 4.456227 529.8214       22.58769 524.7686       28.16886 538.9218       37.80355 206.6343 5.599267 208.7180 7.444452 -2.083694      9.315130 
1 1 1 -4  24 24 o 120.3322 3.275751 177.0853       9.596757 177.9030       14.00547 176.3615       13.17619 120.3579 4.784683 119.8856 4.518188 0.4723206      6.580822 
1 1 1 -4  24 25 o 167.4711 3.487020 343.0178       14.23083 329.3796       20.84242 354.9285       19.47770 163.6429 5.233274 170.0287 4.705404 -6.385803      7.037612 
1 1 1 -4  24 26 o 105.4219 3.182104 136.0060       8.165518 134.0549       12.76193 137.3584       10.62508 104.3220 5.034875 105.7887 4.129449 -1.466690      6.511706 
1 1 1 -4  24 27 o 119.9388 3.578445 176.2982       10.44730 186.6612       20.13630 172.4812       12.22081 122.5155 6.770876 118.4936 4.239058 4.021851       7.988390 
1 1 1 -4  24 28 o 122.2500 3.212116 183.0670       9.560920 188.4009       14.87056 179.3084       12.48302 123.5732 4.948184 120.7478 4.248951 2.825432       6.522124 
1 1 1 -4  24 29 o 102.5006 3.270872 128.8654       8.159615 126.2406       12.45757 130.8376       10.79835 100.9808 5.078725 103.0335 4.310254 -2.052696      6.661212 
1 1 1 -4  24 30 o 39.09463 4.561297 19.11319       4.263968 18.11227       7.443316 19.60211       5.202154 37.04184 8.435369 39.35535 5.580612 -2.313507      10.11428 
1 1 1 -4  24 31 o 58.00090 3.985411 41.68562       5.598816 47.13783       12.71742 40.37484       6.235621 59.79771 9.006527 56.93825 4.531423 2.859467       10.08223 
1 1 1 -4  24 32 o 64.14825 3.922796 51.06268       6.102883 64.25172       13.19042 47.47031       6.884030 70.21043 7.843230 61.62609 4.617548 8.584343       9.101539 
1 1 1 -4  24 33 o 40.00673 4.349448 20.15725       4.172195 21.75364       6.782836 19.18560       5.291704 40.55357 7.123300 38.53615 5.815851 2.017414       9.195952 
1 1 1 -4  24 34 o 70.29167 3.310120 61.31115       5.654082 67.35258       8.838489 57.12619       7.356194 72.84963 5.009174 67.32478 4.509767 5.524849       6.740164 
1 1 1 -4  24 35 o 49.11014 3.833946 30.35527       4.551979 31.07534       6.978793 29.82208       6.005278 48.59897 6.021444 48.03728 5.213513 0.5616875      7.964829 
1 1 1 -4  24 36 o 17.66210 6.466116 3.654147       3.633433 1.485290       5.739323 5.104796       4.693820 17.77926 7.565007 20.24619 7.358956 -2.466934      10.55384 
1 1 1 -4  24 37 o 15.15492 6.403100 1.131779       4.063169 6.797532       7.793208 -0.9832779     4.761551 23.09542 9.206679 14.47357 6.496611 8.621855       11.26805 
1 1 1 -4  24 38 o 19.49367 6.697840 5.299587       3.844172 1.349114       5.599694 8.820854       5.286755 16.88028 7.329939 24.01519 7.849800 -7.134914      10.73999 
1 1 1 -4  24 39 o 36.79227 6.282566 19.65373       5.430799 18.60091       6.319664 22.62671       10.61969 34.34964 7.736349 33.00539 11.13610 1.344250       13.55964 
1 1 1 -4  24 40 o 15.55183 6.369814 2.527063       3.845258 3.852940       5.769410 1.467369       5.157866 18.13189 7.643806 15.86558 6.958987 2.266301       10.33708 
1 1 1 -4  24 41 o 14.09443 6.223662 0.8466600      4.189941 -1.712679      5.349308 4.909301       6.739660 13.77059 6.434784 18.77015 8.095926 -4.999563      10.34169 
1 1 1 -4  24 42 o 12.74707 5.770605 -0.2094906E-01 3.849842 4.748741       5.495347 -4.618101      5.395038 17.64182 7.449827 12.20536 5.908029 5.436464       9.508140 
1 1 1 -4  24 43 o 11.51608 5.351902 -1.014532      3.620501 -4.587946      5.314685 2.079725       4.945544 11.84996 5.765561 14.89796 6.658918 -3.047993      8.808115 
1 1 1 -4  24 44 o 11.74412 5.527235 -1.242623      4.069151 9.809845       8.827524 -4.224782      4.585372 19.10731 8.684772 10.94970 5.333789 8.157608       10.19189 
1 1 1 -4  25 1  f 162.2567 3.397868 321.1761       13.43523 289.5244       24.83007 334.2791       15.97594 153.6470 6.647318 165.4970 3.961323 -11.85002      7.738147 
1 1 1 -4  25 2  o 138.1652 2.877235 232.8011       9.687465 224.7107       14.59677 239.1698       12.95074 135.5903 4.423577 139.9452 3.801044 -4.354828      5.832322 
1 1 1 -4  25 3  o 111.9444 2.776406 152.8159       7.573935 140.6035       11.11882 163.3882       10.34529 107.2342 4.263396 115.6582 3.675207 -8.423973      5.628827 
1 1 1 -4  25 4  o 72.80207 3.204818 64.77575       5.671759 73.30058       7.848059 55.45541       8.206069 77.37738 4.177588 67.18324 5.049259 10.19415       6.553415 
1 1 1 -4  25 5  o 160.1664 3.331693 312.9512       13.00387 343.3685       18.75517 284.7913       18.04583 167.6153 4.596014 152.6096 4.858616 15.00572       6.688011 
1 1 1 -4  25 6  o 297.3767 4.291766 1079.717       31.10134 1045.993       47.95339 1104.203       40.86091 292.2590 6.733104 300.5176 5.579587 -8.258606      8.744513 
1 1 1 -4  25 7  o 107.5501 2.752189 141.1516       7.207229 163.0710       11.53252 127.1045       9.232152 115.5041 4.103755 101.9878 3.720893 13.51630       5.539481 
1 1 1 -4  25 8  o 103.4819 3.170368 130.7527       7.985417 135.1163       16.34932 129.3856       9.151229 104.8583 6.429155 102.9031 3.655149 1.955132       7.395549 
1 1 1 -4  25 9  f 277.7151 4.593621 942.1315       31.08785 952.7606       63.02553 938.7139       35.73797 278.0277 9.315497 277.0956 5.292541 0.9321594      10.71399 
1 1 1 -4  25 10 f 295.0934 4.794275 1064.077       34.47614 961.7339       65.62323 1103.093       40.51835 279.1596 9.661041 300.3111 5.536614 -21.15152      11.13507 
1 1 1 -4  25 11 o 123.0553 3.142910 184.8628       9.417006 204.1542       20.12325 179.4536       10.65578 128.9373 6.424713 121.2024 3.611793 7.734879       7.370345 
1 1 1 -4  25 12 o 130.3852 3.194172 207.4312       10.14899 194.2746       21.29709 211.2968       11.54408 125.6594 6.982324 131.5201 3.605297 -5.860672      7.858181 
1 1 1 -4  25 13 o 224.7812 3.579221 616.7897       19.60580 627.7954       32.02080 610.1894       24.79743 226.3595 5.809738 223.4463 4.554047 2.913177       7.381896 
1 1 1 -4  25 14 o 191.3763 3.644966 447.1649       16.99878 399.3587       33.70059 463.4786       19.68667 180.0643 7.697986 194.7776 4.147603 -14.71327      8.744232 
1 1 1 -4  25 15 o 75.45879 2.886266 69.57331       5.297620 75.60878       9.593223 66.92524       6.354387 78.45272 5.044618 73.95383 3.536202 4.498886       6.160592 
1 1 1 -4  25 16 o 79.63007 2.850407 77.46817       5.522285 74.10689       9.494266 79.18673       6.788777 77.65559 5.044396 80.45825 3.470623 -2.802666      6.123002 
1 1 1 -4  25 17 o 23.60851 5.721769 7.104408       3.257032 9.469494       6.580499 6.337022       3.748367 27.81589 8.724298 22.47841 6.485244 5.337479       10.87068 
1 1 1 -4  25 18 o 104.7522 2.774022 133.9944       7.075008 140.6771       12.34439 130.7255       8.633739 107.1125 4.741004 103.4051 3.431014 3.707420       5.852263 
1 1 1 -4  25 19 o 151.5698 3.246666 280.5350       11.99186 301.5736       18.64880 265.7024       15.65853 156.8581 4.884694 147.3138 4.366679 9.544357       6.551955 
1 1 1 -4  25 20 f 70.55932 2.914404 60.87964       5.000395 66.32497       8.955926 58.41328       6.027358 73.40241 5.037384 69.04722 3.594534 4.355194       6.188369 
1 1 1 -4  25 21 o 43.73161 3.644222 23.53636       3.848352 26.25744       7.298849 22.48864       4.529033 45.69898 6.757569 42.63680 4.423165 3.062180       8.076455 
1 1 1 -4  25 22 o 92.94649 3.338023 105.7011       7.548359 97.69093       10.61131 113.9066       10.73984 89.13153 4.904316 96.31756 4.588883 -7.186028      6.716411 
1 1 1 -4  25 23 o 97.17717 3.304111 115.5519       7.813090 115.7613       11.50447 115.3725       10.64435 97.02341 4.881479 96.92346 4.519092 0.9994507E-01  6.652145 
1 1 1 -4  25 24 o 137.6298 3.283473 231.5840       11.01240 221.1154       16.33424 240.3074       14.91069 134.0903 5.007593 139.9462 4.377590 -5.855835      6.651262 
1 1 1 -4  25 25 o 149.2481 2.967734 272.2321       10.79369 269.5503       18.45594 273.6262       13.30662 147.9819 5.125632 149.5135 3.652171 -1.531586      6.293684 
1 1 1 -4  25 26 o 162.5163 3.338865 323.2231       13.22306 352.1712       29.38560 315.8732       14.80685 168.1638 7.187351 160.5581 3.784377 7.605698       8.122778 
1 1 1 -4  25 27 o 75.61562 3.354832 70.15846       6.166459 63.06427       10.02256 74.47967       7.822219 71.16922 5.830023 77.77385 4.142185 -6.604630      7.151704 
1 1 1 -4  25 28 o 83.40595 3.274656 85.37296       6.642843 75.20258       10.44344 92.28403       8.608905 77.74155 5.549057 86.55014 4.093326 -8.808586      6.895459 
1 1 1 -4  25 29 o 23.30265 6.338386 7.008439       3.693897 10.56186       7.183834 5.731235       4.306883 28.77215 9.127575 21.67828 7.085040 7.093872       11.55467 
1 1 1 -4  25 30 o 98.91694 3.631383 120.5979       8.738584 114.0279       17.53778 122.7678       10.07886 94.32239 7.696842 99.62689 4.160599 -5.304504      8.749397 
1 1 1 -4  25 31 o 63.73558 4.358712 50.61070       6.729059 48.74914       12.25876 51.41350       8.050308 60.73041 8.517113 63.94285 5.211511 -3.212444      9.985042 
1 1 1 -4  25 32 f 39.88675 4.322670 20.02168       4.134540 19.76032       6.781709 20.17628       5.216015 38.47318 7.503036 39.64600 5.550770 -1.172825      9.333092 
1 1 1 -4  25 33 o 48.42750 3.949065 29.39945       4.619967 40.23949       7.766297 23.46249       5.747521 55.87445 5.787508 42.57782 5.681015 13.29663       8.109820 
1 1 1 -4  25 34 o 30.03227 5.520083 11.89682       3.891068 2.632206       6.142278 18.10699       5.028834 19.42539 8.013422 37.10807 5.746758 -17.68267      9.861043 
1 1 1 -4  25 35 o 57.49888 3.634231 41.61678       5.066177 35.33574       7.621415 46.58935       6.781265 51.41752 6.208106 60.24601 4.655066 -8.828487      7.759524 
1 1 1 -4  25 36 o 28.69080 6.377831 11.50154       4.343619 3.520726       8.348206 14.46411       5.086324 21.23828 9.082798 32.05294 6.726598 -10.81466      11.30240 
1 1 1 -4  25 37 o 22.95242 6.564195 7.621360       3.856269 10.18944       5.917107 5.725288       5.084316 25.59935 8.300194 20.51531 7.624453 5.084036       11.27056 
1 1 1 -4  25 38 o 14.69306 6.556924 -0.5617745E-01 4.775174 -0.6130319     5.848498 1.057385       8.270483 15.59389 7.080442 18.62992 8.443432 -3.036036      11.01927 
1 1 1 -4  25 39 o 21.47099 7.632714 7.353408       5.017661 6.730508       6.164763 8.576004       8.636716 20.85444 8.228283 22.54699 9.418587 -1.692547      12.50658 
1 1 1 -4  25 40 o 23.30382 7.337326 9.087743       4.650124 17.28688       6.469275 0.3228365      6.688752 31.24999 8.340018 16.21015 7.440404 15.03984       11.17656 
1 1 1 -4  25 41 o 17.68654 6.822855 4.897699       4.162231 4.893573       6.211176 4.901062       5.607563 18.14043 7.797597 17.98614 7.556352 0.1542950      10.85822 
1 1 1 -4  25 42 o 16.96822 6.615273 4.692088       3.944371 11.19541       6.109516 0.4405085E-01  5.165045 22.78201 8.377399 13.92863 6.445062 8.853388       10.56975 
1 1 1 -4  25 43 o 14.95033 6.310259 3.088308       3.939689 6.069402       6.178871 1.046140       5.114074 17.73223 7.699786 14.15027 6.498973 3.581966       10.07588 
1 1 1 -4  26 1  o 139.1370 2.894539 236.1188       9.814273 228.4584       14.79271 242.1418       13.11687 136.6957 4.446673 140.7955 3.826556 -4.099823      5.866467 
1 1 1 -4  26 2  o 65.85816 3.072257 53.02253       4.917051 58.02395       7.152107 48.53986       6.771051 68.79931 4.287238 62.88602 4.447092 5.913292       6.177138 
1 1 1 -4  26 3  o 92.87174 3.148851 105.3397       7.116121 110.6983       9.681264 99.04198       10.49539 95.12381 4.186700 89.90516 4.807956 5.218651       6.375335 
1 1 1 -4  26 4  f 53.17412 3.276380 34.62700       4.224901 32.53930       5.957124 36.73981       5.992861 51.38166 4.813695 54.65608 4.540413 -3.274418      6.617176 
1 1 1 -4  26 5  o 137.3569 2.865638 230.1171       9.591971 211.4773       14.21134 245.7140       12.99969 131.5083 4.440884 141.8335 3.764456 -10.32520      5.821733 
1 1 1 -4  26 6  o 31.64630 4.805865 12.51395       3.589847 18.40247       5.222908 7.241108       4.942325 38.36218 5.765062 24.35022 7.549042 14.01196       9.498631 
1 1 1 -4  26 7  o 160.4258 3.005025 313.9517       11.74785 314.1886       18.17360 313.7816       15.39736 160.2878 4.657630 160.3148 3.941272 -0.2697754E-01 6.101406 
1 1 1 -4  26 8  o 178.1375 3.560809 387.3055       15.45753 385.4450       30.89157 387.9269       17.85335 177.1088 7.172376 178.2301 4.110575 -1.121323      8.266788 
1 1 1 -4  26 9  o 273.5875 4.548417 914.6300       30.32443 921.3696       61.28179 912.4446       34.89632 273.2300 9.216990 273.1318 5.242896 0.9817505E-01  10.60381 
1 1 1 -4  26 10 o 102.1850 3.152440 127.5307       7.840621 115.3980       15.80804 131.4892       9.029557 96.77110 6.745651 103.7253 3.577639 -6.954147      7.635661 
1 1 1 -4  26 11 o 180.4278 4.142060 397.6768       18.21193 362.0445       30.67583 417.0723       22.63212 171.5273 7.355928 184.5942 5.035899 -13.06685      8.914593 
1 1 1 -4  26 12 f 120.7048 3.572353 178.0320       10.49631 0.000000       0.000000 178.0320       10.49631 ?        ?        120.7048 3.572353 0.000000       3.572353 
1 1 1 -4  26 13 o 140.6014 3.266858 241.2942       11.19325 233.2259       23.93981 243.5515       12.66258 137.5908 7.164632 141.1763 3.683797 -3.585449      8.056197 
1 1 1 -4  26 14 o 160.3201 3.058941 313.6781       11.95075 313.0790       19.73070 314.0252       15.01921 159.8622 5.071196 160.3339 3.844019 -0.4716797     6.363451 
1 1 1 -4  26 15 o 146.0552 2.974619 260.3391       10.58728 239.0404       17.15448 273.4431       13.45565 139.6521 5.049045 149.6210 3.690423 -9.968826      6.253965 
1 1 1 -4  26 16 o 41.98003 3.965075 21.72788       4.008243 19.52282       7.163647 22.73284       4.836124 39.13091 7.786376 42.84833 4.709085 -3.717415      9.099623 
1 1 1 -4  26 17 o 55.56147 3.292159 37.82906       4.437511 28.25710       7.786239 42.43369       5.400389 47.43894 6.940641 58.80655 3.788612 -11.36761      7.907343 
1 1 1 -4  26 18 o 139.7792 3.755311 238.9606       12.78000 249.5137       16.88946 224.8239       19.54787 142.6544 4.865537 135.1920 5.948079 7.462372       7.684601 
1 1 1 -4  26 19 o 243.9966 4.286008 728.4555       25.48431 731.3076       36.47138 725.7345       35.62407 243.8591 6.142184 243.0458 6.014775 0.8133545      8.596740 
1 1 1 -4  26 20 o 94.29916 3.360565 108.7884       7.710123 108.8427       11.34048 108.7417       10.51389 94.09869 4.963068 94.11326 4.598258 -0.1457214E-01 6.765798 
1 1 1 -4  26 21 o 146.1015 3.440323 260.9100       12.24870 268.5008       17.94102 254.2829       16.76343 147.8723 4.985926 143.9435 4.785626 3.928802       6.910983 
1 1 1 -4  26 22 o 219.3609 3.554332 588.4806       18.99999 588.9968       31.00828 588.1702       24.04195 218.7027 5.823365 219.0582 4.503748 -0.3554688     7.361747 
1 1 1 -4  26 23 o 87.01907 3.076886 92.66012       6.514452 89.46313       10.61259 94.59311       8.252108 85.17619 5.136769 87.81561 3.865650 -2.639427      6.428813 
1 1 1 -4  26 24 o 57.56210 3.127914 40.62952       4.371120 48.37115       8.653768 37.97778       5.064713 62.38787 5.756945 55.56527 3.762566 6.822609       6.877450 
1 1 1 -4  26 25 o 66.12101 3.200904 53.61508       5.142284 50.64394       12.56283 54.21308       5.636069 63.07659 8.380177 66.44907 3.492842 -3.372486      9.078949 
1 1 1 -4  26 26 o 124.0277 2.875185 188.1497       8.690015 174.9052       14.86083 195.0319       10.71246 118.9793 5.137600 126.1147 3.489031 -7.135345      6.210336 
1 1 1 -4  26 27 o 100.4216 3.220709 123.6896       7.871413 128.2415       12.60629 120.7809       10.07732 101.7542 5.100181 99.00743 4.186223 2.746765       6.598205 
1 1 1 -4  26 28 o 86.97834 3.290106 92.95172       6.961030 81.17229       11.05417 100.6923       8.960905 80.60452 5.663746 90.33318 4.081235 -9.728661      6.981010 
1 1 1 -4  26 29 o 77.71623 3.640537 74.51475       6.875504 73.43204       14.53577 74.82681       7.803679 75.38437 8.036391 77.74044 4.134097 -2.356071      9.037386 
1 1 1 -4  26 30 o 24.66412 6.880136 7.981035       4.290892 6.642364       9.818807 8.297037       4.770532 26.44082 10.39910 25.16168 7.333098 1.279133       12.72460 
1 1 1 -4  26 31 o 55.95229 3.627651 38.88177       4.919627 36.55704       8.056023 40.26432       6.212593 53.22988 6.334657 56.64425 4.538658 -3.414371      7.792772 
1 1 1 -4  26 32 o 13.19879 5.676709 -0.4876116E-02 3.295476 -0.5492808     6.277422 0.2022405      3.871934 17.47361 7.670347 14.43612 6.180002 3.037488       9.850211 
1 1 1 -4  26 33 o 41.63987 4.341431 22.03751       4.340699 21.66231       7.074899 22.26400       5.496871 39.70155 7.589225 41.30664 5.605346 -1.605095      9.434842 
1 1 1 -4  26 34 o 99.61977 3.295282 123.8906       7.988702 110.8458       11.87733 134.6673       10.79547 92.48971 5.291826 102.9970 4.310643 -10.50726      6.825325 
1 1 1 -4  26 35 o 14.36836 6.056597 0.9220959      3.621568 3.390832       6.086188 -0.4312198     4.506171 19.42938 7.991960 14.55314 6.438927 4.876239       10.26310 
1 1 1 -4  26 36 o 19.03365 6.694183 4.867240       3.851182 -3.500287      6.112334 10.37586       4.959408 14.73177 6.882123 26.36310 7.412157 -11.63133      10.11453 
1 1 1 -4  26 37 o 26.22941 6.460516 10.12861       4.101872 13.36728       6.313831 7.763434       5.395631 28.51336 8.470296 22.44148 7.920954 6.071875       11.59687 
1 1 1 -4  26 38 o 42.54714 5.859520 25.88788       5.914154 28.01193       7.425911 22.20396       9.779629 42.47492 7.445615 33.03093 10.66755 9.443996       13.00899 
1 1 1 -4  26 39 o 17.68439 7.061550 4.243580       4.592405 12.92486       6.530447 -4.249886      6.459419 26.40818 8.729165 14.01043 6.699313 12.39775       11.00360 
1 1 1 -4  26 40 o 18.05405 6.522913 5.105664       3.680647 5.285580       5.622630 4.970757       4.868813 18.48059 7.649441 18.02994 7.246534 0.4506531      10.53690 
1 1 1 -4  26 41 o 26.20584 6.857396 11.79729       4.429004 5.400119       6.616770 16.99011       5.961473 18.08622 7.908770 29.98189 8.007999 -11.89567      11.25507 
1 1 1 -4  26 42 o 18.59743 7.141514 6.475795       4.545450 -5.687646      8.585842 11.21253       5.357896 14.10851 6.958237 23.26223 7.909496 -9.153725      10.53457 
1 1 1 -4  26 43 o 10.39209 5.031100 -3.487681      3.916210 -6.920646      7.954960 -2.389533      4.499183 13.09592 6.501245 11.63074 5.569422 1.465180       8.560645 
1 1 1 -4  27 1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -4  27 2  o 20.22512 7.059918 4.461174       4.278335 4.637762       6.594465 4.332821       5.622148 22.85846 8.643824 21.51022 8.013068 1.348248       11.78664 
1 1 1 -4  27 3  o 94.00610 3.263834 107.9664       7.465535 120.4451       14.40959 103.3879       8.728320 98.99477 6.001339 91.93446 3.904869 7.060318       7.159894 
1 1 1 -4  27 4  o 164.1606 3.993567 329.0988       15.97593 340.9558       27.41811 323.0040       19.65776 166.6051 6.767337 162.4573 4.971300 4.147797       8.397063 
1 1 1 -4  27 5  o 81.27474 3.335767 80.74907       6.592702 87.77627       13.04879 78.34047       7.639442 84.39149 6.392604 79.99989 3.930681 4.391602       7.504375 
1 1 1 -4  27 6  o 127.2905 3.284268 197.8653       10.17906 236.6978       22.24479 187.5805       11.44792 138.7836 6.596276 123.8886 3.796400 14.89498       7.610750 
1 1 1 -4  27 7  o 258.2570 4.390101 815.0027       27.62884 778.9917       53.75576 827.9307       32.20864 251.2546 8.793159 260.1706 5.080168 -8.916000      10.15518 
1 1 1 -4  27 8  o 144.2641 3.317230 254.0114       11.66192 209.1255       21.77410 272.0661       13.80958 130.3605 6.878565 149.2159 3.800870 -18.85541      7.858834 
1 1 1 -4  27 9  o 59.46480 3.715237 43.34585       5.356823 66.35703       11.44889 36.89627       6.061217 73.27570 6.478281 54.74834 4.585182 18.52736       7.936751 
1 1 1 -4  27 10 o 139.4153 3.280070 237.2427       11.14370 237.3804       22.68547 237.1989       12.79368 138.9060 6.721741 139.3122 3.771986 -0.4062195     7.707767 
1 1 1 -4  27 11 o 81.20340 3.770403 80.71036       7.440650 0.000000       0.000000 80.71036       7.440650 ?        ?        81.20340 3.770403 0.000000       3.770403 
1 1 1 -4  27 12 o 168.2670 3.476411 345.7248       14.25497 347.3415       29.56153 345.2350       16.27179 167.9120 7.241545 168.0930 3.972370 -0.1810150     8.259521 
1 1 1 -4  27 13 o 67.50167 3.433111 55.78199       5.628723 76.46910       13.04656 51.05075       6.239268 78.58493 6.882113 64.51200 3.988281 14.07293       7.954236 
1 1 1 -4  27 14 o 134.2309 2.958259 219.9099       9.676642 207.6125       15.98034 227.0296       12.15934 130.1173 5.049403 136.2761 3.664786 -6.158783      6.239161 
1 1 1 -4  27 15 o 130.8935 3.799948 209.5468       12.10798 246.8211       24.01383 196.8404       14.02065 141.4574 6.987889 126.7551 4.546430 14.70225       8.336703 
1 1 1 -4  27 16 o 195.2616 3.824867 466.0161       18.19991 459.1521       26.03547 472.5757       25.45158 193.4113 5.529597 196.2720 5.326254 -2.860687      7.677592 
1 1 1 -4  27 17 o 248.2231 5.024597 755.0212       30.39342 803.4573       38.99120 680.0184       48.52005 255.6621 6.258411 234.1852 8.516273 21.47699       10.56857 
1 1 1 -4  27 18 o 168.5583 3.605429 347.2707       14.80960 360.1256       21.60834 335.8835       20.33727 171.2874 5.182746 165.4473 5.050164 5.840027       7.236367 
1 1 1 -4  27 19 o 224.7286 4.112269 618.0412       22.52040 619.4610       32.32164 616.7016       31.39583 224.3891 5.916089 223.9454 5.757768 0.4437103      8.255422 
1 1 1 -4  27 20 o 89.19489 2.894987 97.26530       6.284157 102.0150       11.30477 95.14123       7.559808 91.02797 5.116848 88.14202 3.526707 2.885948       6.214483 
1 1 1 -4  27 21 o 117.8298 2.863996 169.5937       8.223633 161.8466       13.82201 173.8387       10.23158 114.7154 4.956090 119.1665 3.527204 -4.451065      6.083091 
1 1 1 -4  27 22 o 188.7702 3.290132 435.7382       15.13501 430.4275       24.86111 438.8654       19.07766 186.9539 5.462809 189.2504 4.136683 -2.296478      6.852331 
1 1 1 -4  27 23 o 79.02890 2.969713 76.45327       5.709042 83.75729       10.45844 73.35294       6.813805 82.33241 5.239856 77.31870 3.626443 5.013710       6.372376 
1 1 1 -4  27 24 o 93.13555 3.417574 106.3507       7.743412 93.19565       15.59328 110.6565       8.921112 86.14034 7.503187 94.92341 3.864725 -8.783066      8.440019 
1 1 1 -4  27 25 o 204.4738 3.437087 512.3146       17.12633 486.5657       27.67626 528.2931       21.80195 198.1953 5.736341 207.3013 4.315760 -9.105942      7.178537 
1 1 1 -4  27 26 o 13.30398 5.725223 -0.2152700     3.355704 -10.51652      6.709401 3.221219       3.875220 13.65614 6.605028 18.01457 6.663585 -4.358433      9.382418 
1 1 1 -4  27 27 o 92.19398 3.199775 104.3912       7.177930 114.5654       11.81939 98.44624       9.034850 96.02447 5.068949 89.28075 4.164138 6.743721       6.560052 
1 1 1 -4  27 28 f 46.23054 3.629116 26.47376       4.055764 32.88879       11.25792 25.51700       4.347702 49.41744 9.694958 45.30735 3.978158 4.110088       10.47941 
1 1 1 -4  27 29 o 25.55399 5.766601 8.518187       3.505420 1.915771       9.125124 9.661190       3.796742 22.66356 9.586619 27.21472 5.895716 -4.551155      11.25445 
1 1 1 -4  27 30 o 94.93258 3.237023 111.2810       7.477587 95.11327       11.42290 123.4043       9.891468 86.71253 5.433083 99.59024 4.084420 -12.87771      6.797123 
1 1 1 -4  27 31 o 71.32596 3.338938 63.10599       5.787421 57.30787       9.135194 66.99336       7.480012 66.86034 5.659898 73.11440 4.216081 -6.254059      7.057605 
1 1 1 -4  27 32 o 43.29525 4.373111 23.81793       4.550709 21.10883       7.545073 25.36691       5.705232 38.81651 8.232038 44.23302 5.405005 -5.416504      9.847870 
1 1 1 -4  27 33 o 106.7891 3.272940 142.2664       8.507232 150.6987       13.28889 136.4108       11.07383 108.1881 5.054466 103.6011 4.396285 4.587029       6.698876 
1 1 1 -4  27 34 f 22.43468 6.529753 7.022554       3.784770 10.17263       6.242965 5.192004       4.759056 26.21284 8.527671 20.21394 7.400250 5.998898       11.29092 
1 1 1 -4  27 35 o 48.18699 4.553823 30.40631       5.283962 30.84275       10.93063 30.27322       6.036091 42.49862 10.59248 47.50877 5.304081 -5.010159      11.84626 
1 1 1 -4  27 36 o 34.25499 5.214833 16.07280       4.215934 21.10722       6.679141 12.73849       5.435617 37.18862 7.626294 28.62714 7.646887 8.561485       10.79978 
1 1 1 -4  27 37 o 24.91193 7.642162 9.998227       5.081010 8.259416       6.189410 13.59171       8.897764 22.52964 8.404697 26.55333 10.04064 -4.023682      13.09402 
1 1 1 -4  27 38 o 24.15983 7.788160 9.891543       5.214253 7.327405       6.334791 15.27862       9.182020 21.08981 8.334796 26.73631 10.17885 -5.646494      13.15590 
1 1 1 -4  27 39 o 15.58275 6.290928 3.006703       3.687164 -2.250054      5.470708 7.382171       4.991107 13.57747 6.395872 20.68982 7.577867 -7.112344      9.916211 
1 1 1 -4  27 40 o 22.33002 6.949353 8.694479       4.183809 9.631253       6.560257 8.052261       5.431806 21.51302 8.488123 20.57539 7.829962 0.9376297      11.54801 
1 1 1 -4  27 41 o 15.30360 6.479827 3.109340       4.175921 11.50948       9.337747 1.009363       4.668809 20.76159 9.222915 14.00623 6.346298 6.755365       11.19543 
1 1 1 -4  27 42 o 17.00731 6.652269 5.128868       3.999263 1.431184       6.253780 7.687356       5.201989 14.95532 6.978216 19.21354 7.565379 -4.258221      10.29225 
1 1 1 -4  28 1  o 157.0546 3.431564 301.1070       13.13345 338.3934       26.51577 288.9858       15.11821 165.9547 6.569577 153.7531 4.038465 12.20160       7.711585 
1 1 1 -4  28 2  o 127.9114 2.886157 199.6182       8.996331 175.5650       13.00803 221.6711       12.45542 119.7650 4.464848 134.6734 3.799047 -14.90845      5.862390 
1 1 1 -4  28 3  o 152.6085 3.035391 284.1864       11.28832 256.5135       16.43072 308.9247       15.53510 144.7688 4.663505 158.9744 4.013268 -14.20555      6.152609 
1 1 1 -4  28 4  o 79.54652 3.190213 77.34946       6.171564 67.07758       8.158488 91.09023       9.436054 73.93464 4.550244 86.20530 4.507459 -12.27066      6.404835 
1 1 1 -4  28 5  o 220.9747 4.619726 597.0521       24.87683 633.1661       44.07404 580.1675       30.13623 226.6352 7.992817 217.5583 5.689182 9.076859       9.810806 
1 1 1 -4  28 6  o 68.12701 3.365323 56.79559       5.569752 64.53034       7.728504 48.43724       8.034015 72.52631 4.393447 62.68203 5.309510 9.844280       6.891536 
1 1 1 -4  28 7  o 37.93640 4.361281 17.82177       3.958608 17.02452       5.165325 18.95650       6.162350 36.80819 5.962396 38.74221 6.773682 -1.934013      9.024020 
1 1 1 -4  28 8  o 176.5739 3.518274 380.7071       15.13883 373.0560       20.90032 389.1520       21.95788 174.5437 4.918649 178.2467 5.060256 -3.702957      7.056862 
1 1 1 -4  28 9  o 196.3917 4.268029 471.4809       20.42616 478.5134       34.26863 467.6055       25.43920 197.1496 7.144694 195.3300 5.349430 1.819534       8.925416 
1 1 1 -4  28 10 o 202.7783 5.457412 504.1231       26.94321 0.000000       0.000000 504.1231       26.94321 ?        ?        202.7783 5.457412 0.000000       5.457412 
1 1 1 -4  28 11 o 143.5335 3.940835 251.9539       13.77103 230.8785       23.16337 263.4752       17.12639 136.8493 6.968756 146.6515 4.798754 -9.802170      8.461182 
1 1 1 -4  28 12 o 207.2323 4.508508 525.3801       22.76808 519.8224       39.58577 528.1274       27.83239 205.1215 7.934357 207.4958 5.509213 -2.374298      9.659474 
1 1 1 -4  28 13 o 85.16191 3.914174 88.83397       8.101374 100.0986       14.54427 83.76675       9.754784 89.98260 6.680461 82.57110 4.869517 7.411499       8.266847 
1 1 1 -4  28 14 o 196.0256 4.400735 470.1574       21.02201 437.0032       35.61194 487.8894       26.04382 188.0001 7.790109 199.4158 5.364184 -11.41574      9.458344 
1 1 1 -4  28 15 o 12.27961 5.702015 -3.617998      4.096597 3.859535       6.706608 -8.068509      5.174027 22.20248 8.634481 12.12093 5.847161 10.08155       10.42802 
1 1 1 -4  28 16 o 127.3536 3.743902 198.4545       11.60647 191.5237       22.82216 200.8724       13.47982 124.2998 7.570323 128.0377 4.326477 -3.737862      8.719414 
1 1 1 -4  28 17 o 129.0195 2.973316 203.2804       9.348294 194.9635       15.75220 207.8021       11.61475 125.9678 5.142325 130.3200 3.660948 -4.352180      6.312373 
1 1 1 -4  28 18 o 293.4042 4.329490 1054.299       30.95560 1104.671       51.29993 1025.455       38.81965 299.0784 7.038753 288.9041 5.513938 10.17432       8.941339 
1 1 1 -4  28 19 o 63.55825 3.249757 49.50362       5.016662 46.40726       9.286293 50.77967       5.961412 61.03510 6.335534 64.30496 3.821480 -3.269859      7.398830 
1 1 1 -4  28 20 o 77.55573 3.006687 73.60902       5.671718 83.79842       10.51196 69.42461       6.736372 82.40382 5.262301 75.23180 3.685636 7.172020       6.424619 
1 1 1 -4  28 21 o 170.3396 3.173459 354.7748       13.17300 379.4943       22.69407 342.2138       16.17730 175.5465 5.311094 167.1321 3.972007 8.414368       6.632085 
1 1 1 -4  28 22 o 117.0224 2.889052 167.4048       8.238737 199.7926       15.16625 153.8461       9.812870 127.3618 4.895672 112.0254 3.599212 15.33637       6.076342 
1 1 1 -4  28 23 f 51.99573 3.657422 33.29655       4.604680 29.48929       12.01667 33.95181       4.985206 47.15559 10.70303 52.46492 3.927730 -5.309326      11.40096 
1 1 1 -4  28 24 o 96.51025 3.295016 114.2422       7.738017 120.1467       12.42404 110.5003       9.890604 98.49999 5.194317 94.69532 4.297258 3.804672       6.741466 
1 1 1 -4  28 25 o 76.32008 3.415125 71.59902       6.335488 80.80037       10.50181 66.33417       7.943861 80.57932 5.378963 73.22237 4.473312 7.356949       6.995982 
1 1 1 -4  28 26 o 69.35485 3.494557 59.25264       5.887127 66.79272       13.67694 57.53790       6.522277 72.10910 7.913131 68.24085 3.938837 3.868248       8.839235 
1 1 1 -4  28 27 o 77.83788 3.125499 74.54186       5.916467 82.35018       14.19909 72.90134       6.508380 80.12941 7.353567 76.88551 3.482743 3.243904       8.136612 
1 1 1 -4  28 28 o 35.94050 4.166235 16.21149       3.581401 17.39731       7.213140 15.82351       4.125893 35.89943 8.395807 35.29903 4.930790 0.6003952      9.736646 
1 1 1 -4  28 29 o 87.09811 2.819454 93.41138       5.976367 85.48308       10.64764 97.05795       7.221131 82.20306 5.344289 88.59332 3.350824 -6.390266      6.307888 
1 1 1 -4  28 30 o 61.17869 3.013798 46.31240       4.479316 39.76567       8.187332 49.10910       5.351216 55.33260 6.177155 62.83463 3.508695 -7.502029      7.104096 
1 1 1 -4  28 31 o 22.83754 5.930874 6.994145       3.329684 5.903790       9.570160 7.144311       3.551576 24.67177 10.07047 23.03868 6.193223 1.633083       11.82245 
1 1 1 -4  28 32 o 51.87444 3.892457 34.02740       4.884661 30.36979       7.798318 36.38899       6.266218 47.15200 6.998848 53.10407 4.897319 -5.952068      8.542109 
1 1 1 -4  28 33 o 20.11447 6.651770 5.450577       3.791901 3.684213       6.163364 6.526361       4.809946 19.77803 8.078334 21.83856 7.492489 -2.060535      11.01802 
1 1 1 -4  28 34 o 60.29801 4.093444 46.86433       5.979234 46.49037       12.08401 46.98557       6.880561 54.20628 9.493755 59.80903 4.760104 -5.602749      10.62026 
1 1 1 -4  28 35 o 27.07836 6.300319 10.62744       4.078918 3.790360       6.368493 15.38295       5.311287 19.20114 8.058881 32.19887 6.971347 -12.99773      10.65576 
1 1 1 -4  28 36 o 54.39473 3.924294 38.71566       5.166843 49.47130       8.191589 31.60938       6.658421 59.29841 5.740481 47.13343 5.927840 12.16498       8.251812 
1 1 1 -4  28 37 o 14.01243 6.390887 -0.7206270     4.832150 -3.522051      5.871548 5.158917       8.506188 13.77333 6.529275 20.16904 8.888426 -6.395713      11.02885 
1 1 1 -4  28 38 o 25.84197 6.557745 10.60865       4.135827 10.82154       6.600946 10.47106       5.306555 23.64252 8.705419 24.25581 7.859978 -0.6132908     11.72875 
1 1 1 -4  28 39 o 10.11396 4.904511 -4.340558      3.761145 -4.935662      6.026594 -3.960896      4.813641 12.80585 6.209498 11.79860 5.678576 1.007246       8.414516 
1 1 1 -4  28 40 o 28.17919 6.903347 13.77297       4.702490 19.58394       10.61633 12.35454       5.245113 24.65631 10.38014 25.23809 7.768690 -0.5817852     12.96533 
1 1 1 -4  28 41 o 15.05229 6.285767 3.217765       3.844890 10.62305       6.542659 -0.6887734     4.752031 21.12980 8.431532 12.88519 6.035266 8.244610       10.36895 
1 1 1 -4  29 1  o 201.2766 3.395464 494.6499       16.65438 484.4585       25.37758 502.3596       22.07247 198.8381 5.241956 202.6846 4.468832 -3.846497      6.888292 
1 1 1 -4  29 2  o 70.91119 3.059480 61.48560       5.274429 60.53573       7.676539 62.33501       7.259276 70.21379 4.510347 71.29006 4.197145 -1.076271      6.161109 
1 1 1 -4  29 3  o 120.5022 2.913521 177.2004       8.555574 196.0575       13.29060 163.8567       11.18008 126.5629 4.315568 115.7326 3.970055 10.83028       5.863912 
1 1 1 -4  29 4  o 66.88757 3.676143 54.81092       5.968990 55.92284       10.86412 54.33014       7.143830 67.14203 6.730598 66.51022 4.432949 0.6318054      8.059279 
1 1 1 -4  29 5  o 220.4235 3.558632 593.3854       19.11512 569.3722       29.11450 611.5789       25.34212 215.4876 5.548971 223.5924 4.651037 -8.104874      7.240388 
1 1 1 -4  29 6  o 166.0301 3.111168 336.4865       12.58770 320.8850       18.97956 348.7382       16.81902 161.8599 4.817195 168.9148 4.085985 -7.054916      6.316696 
1 1 1 -4  29 7  o 184.7740 3.248460 416.8365       14.62698 456.1857       23.63248 392.4023       18.62260 192.9621 5.030042 179.1457 4.265774 13.81636       6.595313 
1 1 1 -4  29 8  o 84.70808 3.192327 87.72757       6.577950 85.69638       11.28677 88.77235       8.094798 83.42631 5.583912 85.13948 3.912020 -1.713173      6.817916 
1 1 1 -4  29 9  f 199.2953 3.358711 485.0486       16.31194 472.2372       25.06599 494.4594       21.48334 196.2571 5.245816 201.0590 4.384725 -4.801895      6.836987 
1 1 1 -4  29 10 o 63.41208 3.661525 49.29326       5.634033 68.34292       11.78977 43.65556       6.413767 74.27757 6.581508 59.57109 4.450321 14.70647       7.944910 
1 1 1 -4  29 11 o 127.9877 3.300482 200.1886       10.28536 229.7636       22.06958 191.9827       11.62499 136.5193 6.653862 125.2725 3.812472 11.24688       7.668691 
1 1 1 -4  29 12 o 72.06548 3.541714 63.60648       6.200755 71.47926       13.41697 61.46823       6.992297 75.79759 7.356177 70.78153 4.070987 5.016060       8.407514 
1 1 1 -4  29 13 o 255.2489 4.379899 797.3807       27.24357 765.1306       54.17635 808.2963       31.51867 248.1258 8.974653 256.8064 5.036466 -8.680618      10.29128 
1 1 1 -4  29 14 o 201.0123 4.371807 494.6162       21.41507 444.4152       36.42725 521.1294       26.47288 189.3861 7.910419 206.0454 5.276667 -16.65933      9.508835 
1 1 1 -4  29 15 o 158.4965 3.464622 307.0346       13.38171 339.4985       29.14256 298.3608       15.06369 165.6570 7.236537 156.1179 3.962722 9.539093       8.250492 
1 1 1 -4  29 16 o 38.99003 4.615608 18.88667       4.300547 23.97170       8.258215 16.99452       5.037520 43.29485 8.125696 36.73936 5.820405 6.555496       9.995202 
1 1 1 -4  29 17 o 91.47105 2.977921 102.3215       6.629088 104.0443       11.84728 101.5363       7.998418 91.87467 5.314276 91.04037 3.612410 0.8342972      6.425810 
1 1 1 -4  29 18 o 150.4435 3.103780 276.6074       11.37890 286.6736       19.52098 271.4268       14.00413 152.6395 5.255899 148.8554 3.863872 3.784134       6.523341 
1 1 1 -4  29 19 o 182.8821 3.297333 409.0174       14.69502 418.1286       24.55526 403.9337       18.34212 184.2372 5.475367 181.5490 4.145905 2.688202       6.867909 
1 1 1 -4  29 20 o 149.1640 3.061087 272.0630       11.12694 266.3137       18.62020 275.2563       13.87721 147.0003 5.206147 149.8457 3.803406 -2.845474      6.447469 
1 1 1 -4  29 21 o 116.8509 2.941932 167.0772       8.370577 187.0314       15.19136 158.3775       10.03066 123.1305 5.073720 113.6400 3.626758 9.490479       6.236667 
1 1 1 -4  29 22 o 91.40439 3.748127 102.6424       8.330962 98.03876       16.54129 104.2070       9.643323 88.13579 7.781444 91.97737 4.314412 -3.841583      8.897473 
1 1 1 -4  29 23 o 120.0716 3.296746 176.8303       9.637193 202.1883       15.52981 160.9493       12.28986 127.8632 4.993674 114.2456 4.422751 13.61766       6.670645 
1 1 1 -4  29 24 o 130.0701 2.956091 207.2732       9.369824 219.8038       16.72949 201.5459       11.31021 133.1028 5.167555 128.0331 3.628694 5.069687       6.314353 
1 1 1 -4  29 25 o 37.19952 4.472136 17.34582       3.972838 28.86923       11.08476 15.64742       4.255551 46.16649 10.13159 35.14950 5.118448 11.01699       11.35110 
1 1 1 -4  29 26 o 87.08883 3.100750 93.30854       6.570096 105.0769       15.88987 90.88168       7.215806 90.53849 7.262839 85.84739 3.456292 4.691101       8.043306 
1 1 1 -4  29 27 o 88.31506 3.119954 96.11028       6.704033 83.21263       10.91568 103.9217       8.494967 81.17916 5.551259 91.58707 3.814549 -10.40791      6.735522 
1 1 1 -4  29 28 o 22.57797 5.521813 6.693318       3.012494 14.85512       6.632452 4.571857       3.381417 32.92349 8.276825 19.16049 6.278780 13.76300       10.38888 
1 1 1 -4  29 29 o 16.40962 5.690171 3.171160       2.776877 2.175078       5.712111 3.479415       3.177635 18.74582 7.729867 17.27275 6.080206 1.473074       9.834620 
1 1 1 -4  29 30 o 29.28543 4.594507 11.07600       3.171094 9.013453       6.367774 11.75619       3.656779 25.69027 8.623015 29.96957 5.195240 -4.279306      10.06712 
1 1 1 -4  29 31 o 20.44601 5.787435 5.630618       3.013025 1.616866       5.892052 7.051875       3.506127 18.12271 7.686255 22.72838 6.172269 -4.605673      9.857759 
1 1 1 -4  29 32 o 14.76523 5.713947 2.131596       2.925980 -0.4623961     5.781874 3.024609       3.392449 16.30039 7.248311 16.49862 6.208328 -0.1982307     9.543654 
1 1 1 -4  29 33 o 66.34580 4.920611 58.05370       7.898890 0.000000       0.000000 58.05370       7.898890 ?        ?        66.34580 4.920611 0.000000       4.920611 
1 1 1 -4  29 34 o 34.56211 4.270317 15.76365       3.520217 9.360624       6.239337 18.75361       4.263621 24.24513 8.521116 37.38206 4.790309 -13.13693      9.775299 
1 1 1 -4  29 35 o 18.00793 6.564741 4.461579       3.739207 -0.7788340     5.633272 8.588966       4.999372 15.17839 6.914055 23.26960 7.635072 -8.091208      10.30041 
1 1 1 -4  29 36 o 32.40744 6.815082 16.14980       5.211130 12.64330       6.296141 23.77640       9.285449 26.69692 8.553512 34.50895 10.27704 -7.812023      13.37087 
1 1 1 -4  29 37 o 18.31959 6.983201 5.100271       4.325054 7.792631       5.990673 2.169102       6.250711 21.08040 8.171006 16.82870 7.506466 4.251701       11.09560 
1 1 1 -4  29 38 o 15.00311 6.236763 2.596550       3.760187 -1.131106      6.000233 5.007173       4.825195 14.42592 6.764870 17.86950 7.202794 -3.443585      9.881483 
1 1 1 -4  29 39 o 15.96565 6.670136 3.574713       4.332339 -5.210331      8.776801 6.404771       4.981521 14.65836 7.190760 18.76889 7.399323 -4.110536      10.31780 
1 1 1 -4  29 40 o 15.55218 6.412849 3.609408       3.931373 2.442774       6.419868 4.309401       4.972854 15.75555 7.252779 16.46440 7.024805 -0.7088556     10.09706 
1 1 1 -4  30 1  o 61.44130 3.318043 46.23350       4.949533 41.89813       6.884980 50.87035       7.120346 58.29605 4.891560 64.31702 4.572785 -6.020969      6.696097 
1 1 1 -4  30 2  o 115.3381 2.918907 162.4735       8.197473 158.1846       12.15423 166.0525       11.10292 113.6327 4.397530 116.4926 3.916706 -2.859901      5.888875 
1 1 1 -4  30 3  o 98.67868 2.944011 118.9618       7.071524 137.4664       11.03004 106.0478       9.214375 105.9330 4.281593 93.04646 4.073650 12.88655       5.909879 
1 1 1 -4  30 4  o 106.1972 2.869827 137.7478       7.420044 131.9468       10.87894 142.7938       10.14637 103.7757 4.311233 108.0216 3.860673 -4.245895      5.787186 
1 1 1 -4  30 5  o 178.2056 3.221678 387.7811       13.99071 393.1882       21.69449 383.9312       18.30598 179.1085 4.975286 177.1790 4.239792 1.929489       6.536767 
1 1 1 -4  30 6  o 154.5047 3.408385 291.5770       12.83295 278.1908       23.93648 296.9766       15.20242 150.2832 6.551770 155.8050 4.007338 -5.521774      7.680133 
1 1 1 -4  30 7  o 51.32221 4.032649 32.40189       5.003015 33.22676       8.438565 31.95479       6.212653 51.51537 6.894928 50.82106 5.084662 0.6943169      8.567019 
1 1 1 -4  30 8  o 55.02483 3.524373 37.14191       4.700968 37.96518       6.906966 36.43142       6.416447 55.42117 5.173965 54.32127 4.899789 1.099899       7.125857 
1 1 1 -4  30 9  o 95.04303 2.875550 110.3708       6.652387 115.4052       10.12829 106.5512       8.822162 97.02543 4.294293 93.27390 3.889852 3.751534       5.794127 
1 1 1 -4  30 10 o 154.3357 3.455093 291.0397       12.99458 280.8239       25.97810 294.4488       15.00697 150.7683 7.090543 155.1169 3.973338 -4.348633      8.127928 
1 1 1 -4  30 11 o 135.7903 3.349997 225.2798       11.08535 214.6474       22.12039 228.8454       12.80998 131.7923 6.911739 136.7481 3.847895 -4.955795      7.910653 
1 1 1 -4  30 12 o 96.98871 3.325599 115.0720       7.848456 109.6207       15.84104 116.8454       9.035379 94.02750 6.962821 97.67496 3.803276 -3.647469      7.933838 
1 1 1 -4  30 13 o 67.79031 4.007390 56.42682       6.590576 53.64427       11.65015 57.73640       7.992393 65.47226 7.433356 68.45915 4.821653 -2.986893      8.860198 
1 1 1 -4  30 14 o 76.55190 3.498633 71.79796       6.509397 81.73605       14.56336 69.31680       7.276739 80.94184 7.467469 75.15230 3.987638 5.789543       8.465480 
1 1 1 -4  30 15 o 139.8125 3.341274 238.9683       11.38398 254.5345       24.18787 234.5391       12.90231 143.3470 6.944920 138.3866 3.829615 4.960342       7.930817 
1 1 1 -4  30 16 o 33.81936 5.460500 14.41332       4.346963 4.095604       9.313132 17.28728       4.915234 25.04734 10.03764 37.07896 5.615348 -12.03161      11.50158 
1 1 1 -4  30 17 o 110.0865 2.993986 148.2186       8.024470 131.2646       13.49892 157.4838       9.979065 103.1532 5.388756 113.3814 3.616327 -10.22816      6.489724 
1 1 1 -4  30 18 o 30.87751 5.532878 12.09477       4.010304 27.90135       8.219618 7.156689       4.594217 46.82793 7.452454 23.91404 7.253304 22.91389       10.39950 
1 1 1 -4  30 19 o 105.8222 3.876197 137.4684       9.978942 142.4082       20.63503 135.9606       11.40068 106.4368 8.014551 105.1127 4.460958 1.324097       9.172414 
1 1 1 -4  30 20 o 134.4717 3.430341 221.6521       11.23181 208.4000       16.77277 232.4260       15.12333 129.8434 5.312110 137.4022 4.522826 -7.558807      6.976709 
1 1 1 -4  30 21 o 49.61112 4.918261 30.64841       5.867837 11.72469       12.44632 36.05658       6.653691 32.49172 11.95553 53.79932 5.137479 -21.30760      13.01263 
1 1 1 -4  30 22 o 30.37149 5.550328 11.78282       3.956583 7.013845       9.297495 12.83745       4.372238 26.83154 10.23602 31.65748 5.884027 -4.825935      11.80669 
1 1 1 -4  30 23 o 72.77569 3.291161 65.14114       5.821652 62.55487       13.37116 65.74607       6.466759 69.73837 8.013391 73.03661 3.644891 -3.298233      8.803391 
1 1 1 -4  30 24 o 14.41619 5.832747 1.193982       3.177416 3.594982       9.138839 0.8638321      3.388838 23.94240 9.814740 14.41735 5.950319 9.525059       11.47761 
1 1 1 -4  30 25 o 41.95504 3.820736 21.91216       3.863504 17.53339       7.818687 23.32672       4.443957 35.93760 8.959467 43.18568 4.278936 -7.248089      9.928814 
1 1 1 -4  30 26 o 93.87833 3.132342 108.6676       7.155864 106.6468       11.75688 109.8568       9.018824 92.01595 5.265138 94.06780 3.943092 -2.051849      6.577967 
1 1 1 -4  30 27 o 35.33235 4.127810 15.74769       3.487198 18.92124       7.236072 14.78769       3.979838 37.17451 8.207476 33.97208 4.953044 3.202435       9.586204 
1 1 1 -4  30 28 o 25.82386 5.442441 8.788739       3.316746 14.84479       6.853174 6.936351       3.790205 32.49243 8.543436 22.78433 6.505016 9.708101       10.73804 
1 1 1 -4  30 29 o 43.86744 3.630188 24.17566       3.845963 26.18178       7.727294 23.51507       4.434192 43.65749 7.535540 43.00674 4.288080 0.6507454      8.670178 
1 1 1 -4  30 30 o 15.30341 5.764313 2.454583       2.926158 4.920957       6.260246 1.765087       3.309999 21.17259 8.310627 14.93179 5.984012 6.240800       10.24085 
1 1 1 -4  30 31 o 28.40673 4.936128 10.71934       3.293048 9.317681       6.222504 11.26461       3.881082 25.20937 8.524279 28.74652 5.741358 -3.537148      10.27748 
1 1 1 -4  30 32 o 19.89841 7.199940 5.313660       4.486439 -11.61950      8.827058 11.21156       5.209497 14.98382 7.321023 27.35562 7.562124 -12.37180      10.52536 
1 1 1 -4  30 33 o 14.84847 5.813747 2.304085       3.057164 3.393170       5.853374 1.895553       3.584992 18.52752 7.747696 14.99183 6.146587 3.535697       9.889759 
1 1 1 -4  30 34 o 64.92088 3.177487 53.76428       5.011677 40.80412       8.112550 61.76297       6.373260 53.06634 6.402640 68.92693 3.809155 -15.86059      7.450064 
1 1 1 -4  30 35 o 36.28712 5.022104 18.30544       4.322020 14.11592       6.246035 22.15431       5.986726 28.49656 8.414407 38.31157 6.653717 -9.815010      10.72726 
1 1 1 -4  30 36 o 21.03699 6.293519 6.914933       3.476101 4.723787       5.483028 8.387444       4.494839 18.31228 7.564366 22.40787 7.231627 -4.095585      10.46499 
1 1 1 -4  30 37 o 35.21135 5.128837 17.99851       4.271633 22.38462       6.611615 14.85586       5.596494 35.79112 7.801214 28.79616 7.788836 6.994959       11.02383 
1 1 1 -4  30 38 o 29.79068 6.425518 14.51315       4.527446 15.80032       9.072244 14.08627       5.224518 24.14794 9.824358 27.78848 7.529478 -3.640535      12.37785 
1 1 1 -4  30 39 o 34.61671 5.283760 18.23993       4.316218 26.64277       7.392383 13.89364       5.316557 36.57059 8.462820 26.73026 7.727148 9.840336       11.45985 
1 1 1 -4  31 1  o 115.1656 3.877893 162.3488       10.86763 181.8779       18.12212 151.3814       13.58058 121.4955 6.140773 111.0263 5.032537 10.46922       7.939492 
1 1 1 -4  31 2  o 149.7594 3.985533 274.4689       14.53216 279.1500       24.37145 271.8863       18.10235 150.4466 6.664109 148.8669 4.997083 1.579666       8.329536 
1 1 1 -4  31 3  o 134.9377 3.325982 222.4271       10.93677 209.9123       14.49156 238.9875       16.67012 130.8624 4.551198 139.5753 4.908748 -8.712906      6.693968 
1 1 1 -4  31 4  o 102.2926 3.776338 128.0936       9.397344 122.2274       14.71975 132.1295       12.20925 99.54287 6.097374 103.7394 4.842946 -4.196495      7.786661 
1 1 1 -4  31 5  o 90.40565 3.833661 100.1097       8.426718 103.9089       13.46151 97.66164       10.80578 91.75571 6.054218 89.12788 4.995142 2.627838       7.848885 
1 1 1 -4  31 6  o 51.50530 3.724597 32.59829       4.643267 44.35220       6.981639 23.27591       6.217696 59.97598 4.817360 43.10185 6.089074 16.87413       7.764263 
1 1 1 -4  31 7  o 117.2195 2.908844 167.7680       8.309144 163.0629       12.42334 171.5764       11.17703 115.3225 4.428902 118.3839 3.879579 -3.061401      5.887810 
1 1 1 -4  31 8  o 180.9202 3.251808 399.8887       14.33666 439.7363       23.12672 375.0173       18.27101 189.3070 5.017580 175.0322 4.283597 14.27483       6.597371 
1 1 1 -4  31 9  o 57.79301 3.435945 40.96442       4.817180 48.48325       7.076659 34.47202       6.575911 62.73266 4.662455 52.75746 5.181664 9.975204       6.970519 
1 1 1 -4  31 10 o 110.4655 3.351849 149.2704       9.012482 166.0625       18.72629 144.2085       10.28153 115.8654 6.660328 108.4992 3.894936 7.366219       7.715600 
1 1 1 -4  31 11 o 144.2348 3.926689 254.7763       13.78886 295.7310       26.20424 239.0938       16.21539 154.5783 6.974402 139.5508 4.775286 15.02753       8.452552 
1 1 1 -4  31 12 o 98.04845 3.860006 117.8283       9.204820 126.7048       16.80831 114.0258       11.00111 101.0533 6.866333 96.31319 4.701416 4.740067       8.321649 
1 1 1 -4  31 13 o 141.0345 3.392429 243.2136       11.65929 277.5914       24.79949 233.4588       13.21031 149.7272 6.814692 138.0390 3.931132 11.68819       7.867262 
1 1 1 -4  31 14 o 97.17403 3.880547 115.7981       9.170754 143.3789       17.38423 105.1629       10.79503 107.5078 6.668412 92.43472 4.808934 15.07312       8.221531 
1 1 1 -4  31 15 o 150.2402 3.994855 276.7590       14.61294 294.5872       26.76917 269.1912       17.44082 153.9583 7.154593 147.9527 4.843883 6.005585       8.640104 
1 1 1 -4  31 16 o 40.63248 5.420650 20.68760       5.233583 32.95414       10.68383 16.81475       6.003185 50.53888 9.005148 36.21544 7.055978 14.32345       11.44026 
1 1 1 -4  31 17 f 48.20365 4.784068 28.85155       5.545628 31.33326       11.39560 28.08144       6.348024 48.93136 9.897250 47.38369 5.606062 1.547665       11.37469 
1 1 1 -4  31 18 o 79.15543 3.751442 77.00050       7.215684 68.23475       10.84454 83.96437       9.665895 73.98085 6.068574 82.43864 4.832635 -8.457794      7.757703 
1 1 1 -4  31 19 o 112.5932 3.658674 155.6764       10.02524 0.000000       0.000000 155.6764       10.02524 ?        ?        112.5932 3.658674 0.000000       3.658674 
1 1 1 -4  31 20 o 101.8164 3.275301 127.2184       8.115953 143.1800       19.49892 123.8737       8.925877 106.4228 7.568026 100.3797 3.655062 6.043152       8.404433 
1 1 1 -4  31 21 o 15.99391 6.248121 2.002468       3.524486 -14.96380      9.086308 5.007288       3.823873 15.55783 7.562564 20.33635 6.677654 -4.778519      10.08878 
1 1 1 -4  31 22 f 49.56270 3.859720 30.44644       4.624998 45.73338       12.03732 27.79883       5.009525 59.11039 8.609388 47.22200 4.404058 11.88839       9.670434 
1 1 1 -4  31 23 o 75.34390 3.026084 69.83266       5.544735 67.04556       10.00844 71.06691       6.660241 72.95432 5.674210 75.85500 3.613434 -2.900681      6.727077 
1 1 1 -4  31 24 o 28.15966 5.615298 10.29482       3.718102 3.206780       7.003911 13.07613       4.387352 21.33845 8.650221 31.74511 5.888141 -10.40666      10.46406 
1 1 1 -4  31 25 o 60.57894 3.243080 45.40224       4.770124 47.11817       8.895525 44.70967       5.651362 60.58111 6.108919 59.91500 3.891685 0.6661110      7.243210 
1 1 1 -4  31 26 o 51.43054 3.395320 32.88601       4.231570 35.43884       8.062268 31.91536       4.971370 52.08222 6.492931 50.44016 4.079263 1.642059       7.668021 
1 1 1 -4  31 27 o 44.59420 3.717511 24.94716       4.003150 20.30116       7.661668 26.69178       4.694980 37.99881 8.488416 45.94303 4.241367 -7.944214      9.489067 
1 1 1 -4  31 28 o 25.36025 5.408216 8.562002       3.240213 7.894943       6.472451 8.785088       3.743015 24.39013 8.669035 25.46181 6.110469 -1.071686      10.60613 
1 1 1 -4  31 29 o 19.84098 5.832303 5.307938       3.006455 0.8702405      6.493094 6.518974       3.391965 18.16130 7.889560 21.82692 6.127496 -3.665625      9.989563 
1 1 1 -4  31 30 o 29.41476 5.060052 11.54632       3.496305 16.32781       6.411994 9.523110       4.170923 33.18882 8.018471 25.94877 6.585871 7.240049       10.37640 
1 1 1 -4  31 31 o 13.87321 6.192763 -0.5911200     4.262568 6.823832       8.265739 -3.277419      4.975133 22.85637 9.347758 13.26314 6.200275 9.593227       11.21713 
1 1 1 -4  31 32 o 16.36464 6.032382 3.356469       3.171090 11.92615       5.941607 -0.5682732E-01 3.749804 27.22811 8.246572 13.35815 5.893590 13.86995       10.13609 
1 1 1 -4  31 33 o 20.54888 6.104579 6.187341       3.279446 5.091177       5.519317 6.785521       4.077214 19.48088 7.753828 21.19261 6.891337 -1.711731      10.37364 
1 1 1 -4  31 34 o 11.32800 5.297189 -2.273006      3.635813 3.207990       5.488481 -6.559141      4.853503 17.49594 7.419304 11.20188 5.463463 6.294053       9.213876 
1 1 1 -4  31 35 o 47.43973 3.987442 30.14754       4.567077 29.52992       7.294724 30.54571       5.857035 42.92650 7.230103 46.22874 5.294527 -3.302242      8.961384 
1 1 1 -4  31 36 o 18.97065 6.122613 5.701176       3.221904 7.521029       5.681075 4.838322       3.911841 20.34477 7.937005 17.62645 6.659208 2.718323       10.36055 
1 1 1 -4  31 37 o 21.25660 6.092321 7.365263       3.318310 1.180441       6.159307 9.894509       3.938799 15.44729 7.108404 24.31139 6.516284 -8.864101      9.643203 
1 1 1 -4  31 38 o 11.42147 5.297800 -0.9639793     3.521781 3.611786       5.843407 -3.574216      4.413409 16.36479 7.281273 11.20472 5.403964 5.160072       9.067511 
1 1 1 -4  32 1  o 38.89755 4.504650 18.77941       4.191078 19.40282       5.779242 18.08785       6.086877 39.22907 6.255348 37.72442 6.874385 1.504650       9.294436 
1 1 1 -4  32 2  f 172.2365 3.621790 362.7321       15.20144 338.5571       28.12037 372.7138       18.06920 165.4659 6.989655 174.4747 4.249820 -9.008759      8.180235 
1 1 1 -4  32 3  o 186.6869 3.733287 426.2528       16.98405 376.5766       30.76647 448.0262       20.36888 174.4211 7.254235 191.2627 4.370195 -16.84158      8.468916 
1 1 1 -4  32 4  o 150.7447 3.074591 277.5944       11.29446 263.5771       16.88996 288.9327       15.19042 146.5555 4.735446 153.5920 4.062061 -7.036530      6.238974 
1 1 1 -4  32 5  o 181.1351 3.274246 400.9614       14.45273 404.3238       22.34737 398.5438       18.94898 181.4509 5.058890 180.3920 4.310547 1.058884       6.646291 
1 1 1 -4  32 6  o 109.7848 3.217431 147.4105       8.598419 145.4429       11.57680 149.8313       12.84126 108.8754 4.372272 110.4335 4.783017 -1.558113      6.480279 
1 1 1 -4  32 7  o 85.25996 3.006619 88.91149       6.237052 90.49200       9.223869 87.58009       8.465849 85.82590 4.425145 84.47578 4.124936 1.350128       6.049546 
1 1 1 -4  32 8  f 36.54416 4.452464 16.60439       3.883351 19.44460       5.284534 13.27013       5.725735 39.37111 5.671359 32.11258 7.459708 7.258537       9.370782 
1 1 1 -4  32 9  o 80.60194 3.346323 79.56135       6.558490 82.38451       8.795019 76.02494       9.843501 81.86900 4.424845 78.50774 5.174029 3.361267       6.808071 
1 1 1 -4  32 10 o 108.3262 4.694107 144.2289       12.36205 156.7766       18.12836 133.3224       16.90124 112.4706 6.643889 103.6641 6.726753 8.806480       9.454654 
1 1 1 -4  32 11 o 119.2108 3.908093 174.2052       11.33781 192.8275       20.33057 165.7994       13.65902 124.7110 6.714487 116.1087 4.838058 8.602303       8.275937 
1 1 1 -4  32 12 o 184.2505 3.725868 415.6497       16.72909 391.3885       32.56341 424.3489       19.49899 177.3139 7.553478 186.0191 4.301487 -8.705124      8.692400 
1 1 1 -4  32 13 o 64.92088 3.786767 51.80107       5.964851 52.46861       12.57962 51.60746       6.774895 64.33894 8.210180 64.71491 4.320729 -0.3759766     9.277702 
1 1 1 -4  32 14 o 183.8398 3.705676 414.0517       16.60134 383.7845       32.87064 424.4158       19.23478 175.2527 7.715663 185.9687 4.244349 -10.71605      8.806019 
1 1 1 -4  32 15 o 107.3671 3.299973 141.2474       8.623867 147.0584       18.42787 139.6179       9.758384 108.5101 7.006428 106.6566 3.760402 1.853523       7.951771 
1 1 1 -4  32 16 o 35.11753 5.191463 15.53046       4.309006 2.019770       8.936408 19.62334       4.918568 23.06265 9.603155 39.54881 5.231711 -16.48616      10.93578 
1 1 1 -4  32 17 o 94.99708 3.289842 110.7047       7.604408 100.2639       15.99407 113.7542       8.643909 89.16512 7.428264 96.21416 3.693537 -7.049042      8.295861 
1 1 1 -4  32 18 o 23.74604 7.005260 7.190420       4.330825 0.000000       0.000000 7.190420       4.330825 ?        ?        23.74604 7.005260 0.000000       7.005260 
1 1 1 -4  32 19 o 71.87798 3.288160 63.52346       5.744246 65.05264       10.64214 62.89478       6.823636 71.95202 6.127705 71.38107 3.938065 0.5709534      7.284032 
1 1 1 -4  32 20 o 37.32856 4.585902 17.48945       4.084038 12.31320       7.680510 19.52998       4.822295 30.62238 9.396210 39.33354 5.154948 -8.711157      10.71738 
1 1 1 -4  32 21 o 32.93954 4.799616 13.74203       3.739457 21.69187       7.960052 11.49072       4.235979 40.36132 8.368022 29.75127 6.049002 10.61006       10.32542 
1 1 1 -4  32 22 o 27.67581 6.023335 10.00661       3.946686 5.550634       11.02976 10.66091       4.226524 26.58756 10.82669 28.52859 6.252468 -1.941021      12.50243 
1 1 1 -4  32 23 o 45.69602 4.078486 26.11229       4.493961 30.52403       8.043783 24.11039       5.418470 48.30330 7.040545 43.54245 5.209837 4.760853       8.758520 
1 1 1 -4  32 24 o 52.92214 3.424737 34.78570       4.393012 35.36650       8.065983 34.54077       5.238048 52.12902 6.489663 52.51146 4.126483 -0.3824348     7.690487 
1 1 1 -4  32 25 o 27.85124 5.235249 10.12944       3.422779 14.37452       6.598276 8.566586       4.003564 32.08599 8.357090 25.24869 6.476080 6.837297       10.57263 
1 1 1 -4  32 26 o 45.13846 3.690606 25.58483       4.024166 29.55276       7.695406 24.09138       4.721120 46.90030 6.942598 43.47126 4.522673 3.429035       8.285785 
1 1 1 -4  32 27 o 63.54405 3.115985 50.32181       4.810387 53.80560       8.922863 48.89445       5.711444 64.02206 5.781478 62.30848 3.779285 1.713577       6.907133 
1 1 1 -4  32 28 o 20.18300 6.123839 5.527382       3.274416 4.672210       6.383175 5.832780       3.814545 20.88564 8.330117 20.73485 6.659202 0.1507931      10.66470 
1 1 1 -4  32 29 o 15.88287 5.926054 2.873148       3.077303 4.402726       6.099835 2.350951       3.564096 20.12639 8.103400 15.75855 6.244208 4.367842       10.23011 
1 1 1 -4  32 30 o 23.78114 6.196383 8.087012       3.626494 13.01186       8.794499 7.078022       3.980690 27.60993 10.06737 22.08985 6.761972 5.520082       12.12750 
1 1 1 -4  32 31 o 31.62821 6.349149 14.46059       4.723358 15.92049       6.477995 12.80342       6.901804 31.43862 8.325212 27.54063 8.966840 3.897989       12.23574 
1 1 1 -4  32 32 o 11.25541 5.277368 -2.585111      3.649456 -0.4222007     5.276485 -4.568670      5.052987 14.96443 6.766883 12.44140 5.942559 2.523028       9.005816 
1 1 1 -4  32 33 o 46.85009 4.415261 29.60020       4.981399 31.90750       7.632010 27.88772       6.575080 45.43415 7.127485 43.28322 6.428670 2.150936       9.598377 
1 1 1 -4  32 34 o 24.49879 6.108949 9.215452       3.634443 2.946306       5.727829 13.44071       4.702324 17.03799 7.405740 29.10706 6.759355 -12.06907      10.02666 
1 1 1 -4  32 35 o 11.23237 5.105536 -0.6114621     3.050971 -1.900338      5.682588 -0.8945874E-01 3.616406 13.81313 6.510469 12.49277 5.629990 1.320363       8.607148 
1 1 1 -4  32 36 o 41.40196 4.047798 23.62388       4.031793 21.06123       6.918202 24.94187       4.961414 32.79465 8.565016 41.30633 5.032696 -8.511673      9.934160 
1 1 1 -4  32 37 o 15.81834 6.430004 3.732720       3.882287 0.1864160      6.181250 6.043022       4.989106 14.69467 6.882956 18.21344 7.330195 -3.518767      10.05519 
1 1 1 -4  33 1  o 60.45094 3.976397 44.93604       5.825196 49.74969       10.50367 42.79790       7.000377 63.06106 6.950216 58.84249 4.927159 4.218567       8.519531 
1 1 1 -4  33 2  o 86.83472 3.061205 92.25648       6.467584 99.18742       9.579148 86.45003       8.767712 89.84956 4.388240 83.88165 4.303654 5.967903       6.146389 
1 1 1 -4  33 3  o 80.25536 3.133811 78.83998       6.117126 86.79540       9.013338 72.04677       8.328979 84.02958 4.417182 76.52573 4.485977 7.503845       6.295672 
1 1 1 -4  33 4  o 126.7231 3.004831 196.2272       9.279233 174.1546       13.41880 216.4544       12.84560 119.0613 4.633797 132.8945 3.970988 -13.83324      6.102526 
1 1 1 -4  33 5  o 95.68873 2.963116 111.9866       6.901156 111.8593       10.31774 112.0896       9.283411 95.40945 4.449951 95.58614 3.994245 -0.1766815     5.979637 
1 1 1 -4  33 6  o 58.44955 3.532762 41.94884       5.008404 51.44624       7.436754 34.06585       6.775275 64.56618 4.759992 52.35678 5.387074 12.20941       7.188748 
1 1 1 -4  33 7  o 90.35529 2.980546 99.88482       6.553765 103.1957       9.825917 97.23151       8.796188 91.62048 4.413914 88.98773 4.067036 2.632751       6.001951 
1 1 1 -4  33 8  o 88.69994 3.247712 96.34995       7.008146 93.38331       9.211369 100.4273       10.79889 87.14606 4.351273 90.26732 4.927913 -3.121262      6.574032 
1 1 1 -4  33 9  o 88.37849 2.959508 95.58385       6.364865 91.20063       9.371460 99.33698       8.671762 86.08268 4.482852 89.94563 3.966069 -3.862953      5.985454 
1 1 1 -4  33 10 o 15.93841 6.599205 0.8837662      4.186457 -9.910627      7.326786 6.116381       5.101217 14.87720 7.119492 22.86623 7.718161 -7.989022      10.50034 
1 1 1 -4  33 11 o 102.4088 3.332762 128.4957       8.306136 124.0422       16.66380 129.9679       9.581245 99.71355 6.900341 102.9041 3.827460 -3.190544      7.890764 
1 1 1 -4  33 12 o 89.41528 3.437820 98.05463       7.476893 108.4900       15.75836 95.02287       8.493855 93.13793 6.994108 87.92323 3.974564 5.214699       8.044545 
1 1 1 -4  33 13 o 82.07967 3.419919 82.67225       6.825507 108.5782       14.71924 75.57573       7.703860 93.27358 6.516755 78.35823 4.048205 14.91535       7.671770 
1 1 1 -4  33 14 o 85.22420 3.351367 89.13042       6.946620 100.9030       14.79579 85.80163       7.867667 89.72276 6.818098 83.51443 3.876454 6.208321       7.843045 
1 1 1 -4  33 15 o 54.21896 3.936348 36.30735       5.165505 31.83686       10.20224 37.84841       5.990026 49.42892 8.792147 55.25437 4.487214 -5.825443      9.871015 
1 1 1 -4  33 16 o 78.32220 3.366693 75.38972       6.410754 81.95568       14.47395 73.78728       7.150368 80.36136 7.476784 77.39222 3.803006 2.969139       8.388394 
1 1 1 -4  33 17 f 83.39518 3.760719 85.71638       7.623055 0.000000       0.000000 85.71638       7.623055 ?        ?        83.39518 3.760719 0.000000       3.760719 
1 1 1 -4  33 18 o 127.9546 3.310977 201.2729       10.31533 178.7245       20.89899 208.5355       11.86079 118.5718 7.267741 130.0835 3.745480 -11.51176      8.176105 
1 1 1 -4  33 19 o 53.79909 3.805706 35.87034       4.957174 31.67321       10.47199 37.08246       5.627645 48.62780 9.173347 54.58920 4.264235 -5.961399      10.11603 
1 1 1 -4  33 20 o 47.96363 4.041205 28.65889       4.679549 33.36007       10.73287 27.55544       5.199812 49.73189 9.194749 46.86933 4.612327 2.862560       10.28674 
1 1 1 -4  33 21 o 41.44141 4.054820 21.49376       4.042547 23.05368       7.652741 20.88999       4.761034 41.55405 7.844809 40.60150 4.911696 0.9525528      9.255581 
1 1 1 -4  33 22 o 57.69652 3.684787 41.41172       5.153738 43.32125       8.768329 40.40384       6.370269 57.90237 6.316495 56.64246 4.656155 1.259914       7.847158 
1 1 1 -4  33 23 o 84.05009 3.003728 87.30842       6.142371 94.00228       10.91138 84.20314       7.431760 86.00512 5.230917 82.23153 3.718282 3.773590       6.417796 
1 1 1 -4  33 24 o 21.65198 5.962458 6.248598       3.245596 2.394902       5.929816 7.896845       3.878053 19.07594 7.871869 24.19374 6.457401 -5.117794      10.18157 
1 1 1 -4  33 25 o 18.02448 6.043373 4.092492       3.127799 7.260736       6.203825 3.012678       3.621802 23.64571 8.478004 16.95111 6.406797 6.694599       10.62655 
1 1 1 -4  33 26 o 28.85011 4.994631 10.97047       3.384354 7.142130       6.313161 12.51434       4.009102 23.29972 8.524390 30.59192 5.583466 -7.292202      10.19021 
1 1 1 -4  33 27 o 32.65996 4.611224 13.94954       3.568022 8.896330       6.612438 16.02518       4.237927 24.83082 8.768344 34.76171 5.159119 -9.930887      10.17351 
1 1 1 -4  33 28 o 52.34140 4.766415 35.98007       6.012953 33.52785       11.38518 36.92866       7.081074 44.58662 10.62919 52.29325 5.646113 -7.706638      12.03571 
1 1 1 -4  33 29 o 19.08085 6.074047 5.096945       3.178975 9.941763       6.201501 3.370087       3.702427 25.07123 8.509624 16.89031 6.455506 8.180920       10.68116 
1 1 1 -4  33 30 o 26.62949 6.269656 10.33399       4.000732 10.90029       6.070210 9.899082       5.319585 25.81567 8.409586 25.00852 7.844079 0.8071499      11.50003 
1 1 1 -4  33 31 o 14.17787 6.072444 1.084637       3.741712 -2.046985      5.452077 3.872856       5.144472 14.19341 6.586348 18.06620 7.379955 -3.872785      9.891598 
1 1 1 -4  33 32 o 17.81936 6.316582 4.606918       3.434259 3.034174       5.906943 5.409987       4.220949 17.54623 7.573726 18.99094 6.966590 -1.444706      10.29052 
1 1 1 -4  33 33 o 24.26975 6.365774 9.233667       3.810837 11.39274       6.351597 8.019309       4.763460 24.49661 8.598384 21.71667 7.456010 2.779940       11.38087 
1 1 1 -4  33 34 o 15.52697 5.967644 3.344995       3.175877 5.844950       5.864481 2.307593       3.777784 18.81845 7.802830 14.75933 6.201527 4.059120       9.967100 
1 1 1 -4  33 35 o 18.87538 6.362581 5.900892       3.466678 5.282044       6.113020 6.194261       4.208918 18.03081 7.742885 18.93292 6.954768 -0.9021130     10.40774 
1 1 1 -4  33 36 o 10.85604 5.141759 -2.172207      3.625707 -1.760477      6.014545 -2.407238      4.544206 13.72160 6.534328 11.95553 5.689476 1.766068       8.664154 
1 1 1 -4  34 1  o 148.3401 3.137881 269.1417       11.34309 289.4452       17.66559 254.8982       14.79622 153.3910 4.731642 144.0797 4.218711 9.311249       6.339240 
1 1 1 -4  34 2  o 42.61428 4.200700 22.48951       4.305612 23.13347       5.968536 21.79078       6.217182 42.90765 5.861231 41.51323 6.346984 1.394428       8.639342 
1 1 1 -4  34 3  o 159.9022 3.531664 313.0591       13.76163 328.8128       19.17987 296.3437       19.75671 163.4655 4.820123 155.0394 5.236732 8.426117       7.117369 
1 1 1 -4  34 4  o 74.50211 3.189022 68.02523       5.776387 68.75492       8.458557 67.38754       7.907361 74.65495 4.672886 73.95643 4.407516 0.6985168      6.423555 
1 1 1 -4  34 5  o 106.8276 2.980600 139.6554       7.751730 150.2532       11.84064 131.7063       10.25478 110.5309 4.404796 103.5446 4.072026 6.986328       5.998635 
1 1 1 -4  34 6  o 80.68975 3.401856 79.84902       6.674135 78.53555       8.691576 81.73639       10.41878 79.83078 4.485828 81.27034 5.289502 -1.439560      6.935524 
1 1 1 -4  34 7  o 100.7599 3.272548 124.3958       8.024788 116.6228       10.44670 135.5848       12.53380 97.33347 4.415840 104.8380 4.919726 -7.504501      6.610851 
1 1 1 -4  34 8  o 114.9627 2.977538 161.7723       8.334595 146.6829       12.00625 175.8072       11.57914 109.1369 4.524209 119.6381 3.977174 -10.50126      6.023818 
1 1 1 -4  34 9  o 94.52556 2.952353 109.4131       6.792361 105.9160       10.01039 112.3970       9.246694 92.70876 4.443864 95.61491 3.977168 -2.906158      5.963706 
1 1 1 -4  34 10 o 22.10293 7.348012 5.829515       4.625623 4.874000       8.895008 6.183688       5.415461 24.99521 9.877025 23.11132 7.949381 1.883884       12.67865 
1 1 1 -4  34 11 o 39.33496 5.102427 19.41135       4.775793 12.75308       9.307439 21.79090       5.564120 31.84060 10.41596 41.59042 5.634737 -9.749815      11.84240 
1 1 1 -4  34 12 o 56.53239 4.007758 39.47915       5.485424 31.41914       10.64845 42.39063       6.399928 48.91788 9.271955 58.48309 4.525838 -9.565201      10.31758 
1 1 1 -4  34 13 o 63.96575 3.713264 50.43043       5.763261 39.53022       11.73703 53.89363       6.615759 55.00134 9.072949 66.04485 4.131286 -11.04351      9.969250 
1 1 1 -4  34 14 o 49.18749 4.138782 30.01349       4.914957 50.65203       11.47798 25.37947       5.438822 62.87217 7.648728 44.99723 5.046889 17.87494       9.163740 
1 1 1 -4  34 15 o 78.95497 3.952378 76.99869       7.580378 0.000000       0.000000 76.99869       7.580378 ?        ?        78.95497 3.952378 0.000000       3.952378 
1 1 1 -4  34 16 o 69.97440 3.520162 60.39390       5.983300 49.77746       12.52422 63.53349       6.810797 61.66644 8.565140 71.67297 3.914336 -10.00653      9.417199 
1 1 1 -4  34 17 o 97.72240 3.341211 117.6276       7.945016 116.4407       16.92204 117.9632       8.998481 95.29073 7.343905 97.71245 3.786220 -2.421715      8.262469 
1 1 1 -4  34 18 o 53.14236 3.950164 35.11952       5.078963 43.56740       11.65381 33.13871       5.643079 57.25251 8.620027 51.44385 4.548195 5.808666       9.746329 
1 1 1 -4  34 19 o 76.93631 3.370429 73.16307       6.303730 67.23814       13.72278 74.74770       7.096806 71.43536 8.021447 77.63145 3.762568 -6.196091      8.860053 
1 1 1 -4  34 20 o 59.25305 3.754408 43.69595       5.393234 65.38290       12.51738 38.75223       5.976418 70.58289 7.386687 55.54736 4.452364 15.03553       8.624772 
1 1 1 -4  34 21 o 35.53223 5.720890 16.44251       4.785460 12.22308       8.586523 18.34358       5.763556 29.78079 10.01337 37.20688 6.598275 -7.426092      11.99187 
1 1 1 -4  34 22 o 76.16825 3.072236 71.88350       5.690791 74.29626       9.890430 70.68938       6.957946 76.16658 5.362899 75.19770 3.809408 0.9688797      6.578167 
1 1 1 -4  34 23 f 33.51867 4.587853 14.45353       3.649180 15.06286       6.657537 14.19184       4.362988 32.51288 8.357328 32.77431 5.667807 -0.2614288     10.09797 
1 1 1 -4  34 24 o 56.48065 3.357190 39.94371       4.599894 43.82531       8.058158 38.06750       5.602360 57.68009 5.812061 54.70127 4.235768 2.978813       7.191785 
1 1 1 -4  34 25 o 18.12516 6.379910 4.113042       3.498583 -1.721035      8.364029 5.350281       3.851733 18.58170 8.448935 20.05379 6.706118 -1.472084      10.78687 
1 1 1 -4  34 26 o 34.06720 4.614517 15.22755       3.732474 18.37442       7.008047 13.98143       4.409989 34.91686 8.349223 31.93925 5.882696 2.977604       10.21350 
1 1 1 -4  34 27 o 32.74484 6.861356 15.49126       5.299549 16.37869       10.49412 15.18747       6.140004 30.06212 10.99167 31.53968 7.982897 -1.477564      13.58467 
1 1 1 -4  34 28 o 16.44893 6.217986 3.249061       3.411789 5.222300       6.162152 2.376766       4.097077 20.30348 8.155134 16.10446 6.583164 4.199020       10.48066 
1 1 1 -4  34 29 o 32.75915 5.800638 15.19286       4.461228 18.65005       6.630985 12.33393       6.030007 34.21101 8.083065 27.39782 8.309731 6.813194       11.59257 
1 1 1 -4  34 30 o 25.19794 6.639020 9.683844       4.132955 12.55468       6.183185 7.365324       5.556650 27.04993 8.452836 21.54814 7.977746 5.501799       11.62303 
1 1 1 -4  34 31 o 28.02760 5.448875 11.33619       3.587521 19.26232       6.628696 8.052822       4.266353 33.66396 8.165109 22.38293 7.025360 11.28103       10.77148 
1 1 1 -4  34 32 o 15.79693 6.252372 3.214681       3.569678 -1.257408      5.947587 5.732712       4.462890 14.61577 6.814951 18.99307 7.126316 -4.377302      9.860423 
1 1 1 -4  34 33 o 66.88031 4.182326 61.26064       6.782236 68.17001       13.30322 58.83409       7.883739 58.62509 9.647144 63.84754 5.109627 -5.222446      10.91676 
1 1 1 -4  34 34 o 10.77839 5.133456 -2.744803      3.714722 -1.236765      5.994110 -3.685132      4.733238 14.16446 6.679271 11.73393 5.643228 2.430532       8.744066 
1 1 1 -4  34 35 o 24.60679 6.777244 10.56313       4.192860 6.277761       6.745951 13.26070       5.352238 18.40063 8.017015 26.17535 7.804273 -7.774717      11.18835 
1 1 1 -4  35 1  o 107.5859 3.016773 141.7782       7.901420 157.8044       12.03957 129.6530       10.47224 113.1860 4.373209 102.6237 4.196362 10.56232       6.060892 
1 1 1 -4  35 2  o 72.66972 3.229498 64.80337       5.704772 59.28502       8.025573 70.43931       8.110631 69.20145 4.788631 75.54133 4.425273 -6.339882      6.520278 
1 1 1 -4  35 3  o 163.0496 3.197249 325.5821       12.70376 337.4477       19.77615 317.2458       16.57615 165.3522 4.913351 160.5849 4.239580 4.767288       6.489611 
1 1 1 -4  35 4  o 95.79467 3.328894 112.5737       7.759200 114.0651       10.42567 110.7218       11.61710 96.17065 4.460770 94.58480 5.058511 1.585854       6.744405 
1 1 1 -4  35 5  f 70.89999 4.135342 61.99541       7.113846 64.59435       8.203653 54.11647       14.28377 72.25440 4.684402 64.62794 9.340163 7.626457       10.44903 
1 1 1 -4  35 6  o 77.21130 3.110655 73.13000       5.840888 69.40772       8.457753 76.52383       8.075990 74.90306 4.656640 78.76561 4.222927 -3.862549      6.286287 
1 1 1 -4  35 7  o 22.37015 6.407197 6.387648       3.671362 1.972516       4.895625 12.06173       5.549886 18.00761 7.256332 30.40656 7.529877 -12.39895      10.45722 
1 1 1 -4  35 8  o 162.9923 3.161202 325.5575       12.55612 322.2175       19.06805 328.1146       16.68389 161.4605 4.851733 163.2235 4.197968 -1.762955      6.415781 
1 1 1 -4  35 9  o 143.4946 3.046020 252.2958       10.65134 253.3369       16.21577 251.5057       14.12607 143.1855 4.653500 142.9042 4.060512 0.2812958      6.175988 
1 1 1 -4  35 10 o 85.25864 4.005619 89.67531       8.299047 91.98830       14.37499 88.51897       10.16400 85.30392 6.976035 84.42863 4.962009 0.8752975      8.560760 
1 1 1 -4  35 11 o 34.70145 5.481928 15.31615       4.481948 23.32248       9.292359 12.88890       5.116427 41.76609 9.361953 31.44358 6.869814 10.32251       11.61209 
1 1 1 -4  35 12 o 118.3860 3.350774 172.3171       9.657054 171.8269       19.53931 172.4755       11.10865 116.5329 6.911616 118.2672 3.859607 -1.734245      7.916249 
1 1 1 -4  35 13 o 84.98645 3.453486 88.98110       7.137366 79.24186       14.08190 92.34798       8.279661 78.62994 7.437547 86.43978 3.941004 -7.809845      8.417162 
1 1 1 -4  35 14 o 17.56886 6.950011 2.339706       4.408574 0.000000       0.000000 2.339706       4.408574 ?        ?        17.56886 6.950011 0.000000       6.950011 
1 1 1 -4  35 15 o 81.35983 3.484069 81.72009       6.891696 79.64641       14.25034 82.35316       7.873703 78.47045 7.545058 81.51507 3.975730 -3.044617      8.528442 
1 1 1 -4  35 16 o 40.60318 4.767719 20.82270       4.627669 21.39776       9.858421 20.66017       5.240974 39.10679 10.22962 40.21605 5.491086 -1.109261      11.61022 
1 1 1 -4  35 17 f 28.48966 6.081051 10.66842       4.093264 21.02692       9.032541 7.991430       4.591822 38.81249 9.603053 24.59109 7.202201 14.22140       12.00376 
1 1 1 -4  35 18 o 32.50183 5.523684 13.69972       4.218543 1.786467       9.135108 16.92891       4.756037 22.26227 9.510471 36.19190 5.571015 -13.92963      11.02204 
1 1 1 -4  35 19 o 13.05419 5.860476 -1.456308      3.876490 2.258039       7.834045 -2.660667      4.460903 21.13976 8.909212 13.28923 6.090991 7.850534       10.79232 
1 1 1 -4  35 20 o 10.37586 4.952556 -4.345218      3.496903 -8.876143      7.196566 -2.944750      4.000999 14.57760 6.997217 12.21782 5.660092 2.359771       8.999871 
1 1 1 -4  35 21 o 31.02813 5.447576 12.67227       3.968839 8.917962       8.016902 13.89110       4.567873 26.06978 9.594706 32.27072 6.030246 -6.200937      11.33235 
1 1 1 -4  35 22 o 11.73870 5.365481 -1.873899      3.429921 -2.093939      7.168108 -1.808559      3.906121 17.31608 7.852993 12.69911 5.774055 4.616967       9.747267 
1 1 1 -4  35 23 o 70.08206 3.160657 61.38913       5.383953 55.90340       8.975293 64.47266       6.729081 65.04375 5.720709 71.37089 3.883631 -6.327141      6.914412 
1 1 1 -4  35 24 o 50.83824 3.603472 32.76158       4.435310 26.12360       7.527682 36.29139       5.489332 42.74566 7.499974 53.10712 4.277773 -10.36146      8.634173 
1 1 1 -4  35 25 o 15.06806 6.075382 1.946405       3.433996 1.474998       6.297305 2.145911       4.096707 17.91188 7.775545 16.09440 6.581409 1.817480       10.18695 
1 1 1 -4  35 26 o 32.28982 5.889450 14.57174       4.463520 22.27726       10.84352 12.99977       4.897695 34.21578 11.24546 29.76538 6.888674 4.450397       13.18766 
1 1 1 -4  35 27 o 35.06654 5.680489 17.15587       4.688246 18.99715       6.896941 15.57424       6.392157 34.54370 8.297440 31.16261 8.278098 3.381090       11.72068 
1 1 1 -4  35 28 o 38.29277 5.049441 20.09745       4.597184 23.27497       7.055681 17.75339       6.060097 38.53664 7.781621 33.73056 7.560074 4.806084       10.84935 
1 1 1 -4  35 29 o 26.99704 5.629622 10.52757       3.583547 16.25226       6.453024 7.974929       4.309058 30.87088 8.369452 22.48309 7.060946 8.387794       10.95010 
1 1 1 -4  35 30 o 20.55958 6.366047 6.549821       3.515926 9.917880       6.286300 5.016631       4.241343 23.34672 8.511743 18.37143 6.935478 4.975292       10.97955 
1 1 1 -4  35 31 o 12.02003 5.369685 -0.6544065E-01 3.211334 -8.524696      5.989866 3.346827       3.804281 11.78025 5.810318 16.02278 6.417300 -4.242529      8.656878 
1 1 1 -4  35 32 o 42.77039 4.447566 25.53588       4.567937 43.69809       11.33543 22.01468       4.991139 44.57490 10.59258 38.50309 5.473478 6.071812       11.92316 
1 1 1 -4  35 33 f 17.72901 6.564761 5.167321       3.762868 2.283397       5.673006 7.432879       5.028158 15.79848 7.091261 19.98078 7.549560 -4.182301      10.35769 
1 1 1 -4  36 1  o 60.42039 3.943032 45.12354       5.773921 50.32528       10.03514 42.54930       7.059505 63.03924 6.631666 58.40726 5.008176 4.631973       8.310284 
1 1 1 -4  36 2  o 62.76096 4.577275 48.90686       6.952429 60.13355       11.35703 42.17797       8.792459 68.87812 6.857235 57.74886 6.352651 11.12926       9.347612 
1 1 1 -4  36 3  o 74.74426 4.280165 69.12123       7.763452 78.54985       12.73756 63.54851       9.792552 78.86209 6.691094 71.24036 5.687914 7.621735       8.781977 
1 1 1 -4  36 4  o 46.95722 3.919276 27.32903       4.443951 29.82697       6.364574 24.95268       6.207750 48.70138 5.456510 44.37634 5.885427 4.325047       8.025693 
1 1 1 -4  36 5  o 39.17244 4.445213 19.18524       4.168417 16.58702       5.807599 21.94603       5.986537 35.75055 6.916296 41.50073 6.101478 -5.750175      9.222971 
1 1 1 -4  36 6  o 69.24928 3.223146 58.98760       5.424232 51.86206       7.683834 66.06582       7.658275 64.50723 4.925267 73.02708 4.322731 -8.519852      6.553187 
1 1 1 -4  36 7  o 64.96219 3.215793 51.93613       5.074962 62.16010       7.360052 42.66920       7.007108 70.82227 4.284608 58.44779 4.966647 12.37448       6.559379 
1 1 1 -4  36 8  o 30.20051 5.324744 11.66835       3.775610 17.60513       5.372943 5.877026       5.306711 37.01961 6.173114 22.48367 7.861769 14.53594       9.995737 
1 1 1 -4  36 9  o 77.95305 3.056572 74.71114       5.795105 73.05412       8.420068 76.20247       7.988022 76.67339 4.526594 78.42019 4.195259 -1.746803      6.171731 
1 1 1 -4  36 10 o 86.33051 3.959360 92.20367       8.307447 110.6725       15.01489 84.05576       9.972987 93.36265 6.642921 82.04427 5.012082 11.31838       8.321621 
1 1 1 -4  36 11 o 41.81062 4.857579 22.02538       4.857261 25.98398       9.614530 20.66880       5.628329 43.79947 9.295856 40.16507 5.928337 3.634396       11.02534 
1 1 1 -4  36 12 o 26.78021 7.605783 9.491984       5.194993 0.000000       0.000000 9.491984       5.194993 ?        ?        26.78021 7.605783 0.000000       7.605783 
1 1 1 -4  36 13 o 24.78543 6.565385 8.101555       4.027973 8.470070       8.360366 7.990154       4.596649 26.79072 9.808343 24.65382 7.201933 2.136904       12.16846 
1 1 1 -4  36 14 o 89.71920 3.372989 99.49349       7.361434 106.6681       15.26217 97.31833       8.403576 90.86346 6.945360 88.51778 3.905421 2.345680       7.968082 
1 1 1 -4  36 15 o 73.12373 3.511284 66.29639       6.238633 69.79951       12.34967 65.09612       7.228821 73.20856 7.007861 72.22128 4.124542 0.9872742      8.131541 
1 1 1 -4  36 16 o 19.19279 6.616511 4.445797       3.752396 2.976356       7.874506 4.877501       4.268156 21.73722 9.029848 20.15706 7.050458 1.580156       11.45631 
1 1 1 -4  36 17 o 33.79728 5.194448 14.77637       4.141447 13.21364       8.162749 15.31808       4.805943 30.57235 9.733248 34.11289 6.000248 -3.540535      11.43412 
1 1 1 -4  36 18 o 33.38409 6.130627 14.80565       4.803736 19.95512       9.118440 12.82748       5.651589 36.83815 9.932583 30.43084 7.634801 6.407303       12.52782 
1 1 1 -4  36 19 o 51.41204 4.093060 33.41184       5.085707 51.06821       11.09523 28.71550       5.722237 61.17296 7.606722 47.19216 5.054403 13.98080       9.132864 
1 1 1 -4  36 20 o 34.47221 5.135226 15.55957       4.182386 12.66137       8.588560 16.46050       4.788528 29.20212 10.01211 35.16056 5.790059 -5.958437      11.56578 
1 1 1 -4  36 21 o 22.88294 6.357684 7.224602       3.671960 2.118243       7.179104 9.033779       4.273220 19.68233 8.420239 25.40941 6.776863 -5.727079      10.80862 
1 1 1 -4  36 22 o 40.67939 4.617615 21.54752       4.496607 19.50540       9.751830 22.09895       5.067478 34.25274 10.60148 40.85805 5.207731 -6.605316      11.81151 
1 1 1 -4  36 23 o 23.80765 6.508915 8.074051       3.883753 3.772960       7.988032 9.405513       4.444419 20.89285 8.908458 25.48096 6.961481 -4.588114      11.30588 
1 1 1 -4  36 24 o 36.29948 5.935273 18.30298       5.068945 22.92651       9.460474 16.44113       6.003416 36.38172 10.24027 33.08593 7.605354 3.295795       12.75557 
1 1 1 -4  36 25 o 12.14084 5.706659 -3.233855      4.313293 -7.900026      8.504212 -1.617764      5.004799 15.51459 7.487259 14.12152 6.464660 1.393076       9.891960 
1 1 1 -4  36 26 o 44.39412 5.658444 27.48695       5.982575 29.21673       7.426368 24.28902       10.09752 44.25066 7.129024 35.57321 10.74549 8.677452       12.89529 
1 1 1 -4  36 27 f 35.07770 4.567719 16.63323       3.811862 24.49648       6.845008 13.09852       4.589333 39.91329 7.306709 29.58727 6.539384 10.32603       9.805689 
1 1 1 -4  36 28 o 43.22917 4.454134 25.31622       4.625111 30.28916       10.91312 24.22744       5.106386 37.60538 11.12705 41.60984 5.145478 -4.004452      12.25917 
1 1 1 -4  36 29 o 24.42101 6.579145 9.440924       4.002689 15.13938       6.720244 6.307862       4.983000 28.32610 8.806203 19.77002 7.505142 8.556082       11.57050 
1 1 1 -4  36 30 o 11.37306 5.209590 -0.9210082     3.256678 5.721498       6.389050 -3.252712      3.785358 18.99345 8.027308 10.77597 5.146075 8.217488       9.535185 
1 1 1 -4  36 31 o 30.67361 6.214494 14.81828       4.485864 9.550030       6.852786 18.76843       5.933905 21.56192 8.620643 32.78895 7.578278 -11.22703      11.47806 
1 1 1 -4  36 32 o 17.15829 6.625760 4.721977       3.928102 -2.540918      6.032276 10.06907       5.175894 13.58752 6.490796 22.83576 7.773842 -9.248248      10.12734 
1 1 1 -4  37 1  o 28.60206 5.531334 10.55770       3.715892 10.73393       5.116427 10.36098       5.405619 28.48619 7.328627 27.98254 7.690569 0.5036545      10.62326 
1 1 1 -4  37 2  o 63.99143 3.523652 50.58584       5.473578 52.46638       7.373013 48.27690       8.169775 64.83410 4.698533 61.91473 5.471008 2.919369       7.211667 
1 1 1 -4  37 3  o 18.94495 6.594916 4.139079       3.731906 3.385714       4.812194 5.275818       5.911134 19.17118 7.351571 22.23916 8.229248 -3.067972      11.03477 
1 1 1 -4  37 4  o 84.77265 3.324830 88.56508       6.855172 81.31106       9.033329 98.41524       10.52641 80.79865 4.606925 88.79920 4.883262 -8.000557      6.713420 
1 1 1 -4  37 5  o 73.50230 3.440783 66.68601       6.145926 67.93680       8.308557 65.17463       9.133145 73.80389 4.643193 72.05646 5.237041 1.747437       6.998988 
1 1 1 -4  37 6  o 92.96294 3.545940 106.7033       8.018264 134.2640       15.67627 96.93796       9.331277 102.8955 6.281812 88.30592 4.349643 14.58955       7.640717 
1 1 1 -4  37 7  o 48.69126 4.567595 29.72082       5.356414 24.71955       9.697149 31.91678       6.425649 42.43661 9.602105 50.22583 5.331266 -7.789215      10.98284 
1 1 1 -4  37 8  o 43.58170 4.634120 23.89956       4.846242 23.67908       8.226337 24.01675       5.997448 41.99786 8.332143 43.30069 5.831895 -1.302826      10.17033 
1 1 1 -4  37 9  o 60.03484 4.007748 44.86452       5.829690 41.01255       10.63774 46.51793       6.969434 55.63396 8.082755 60.88490 4.734527 -5.250935      9.367319 
1 1 1 -4  37 10 o 50.96564 5.894598 33.28147       7.186164 0.000000       0.000000 33.28147       7.186164 ?        ?        50.96564 5.894598 0.000000       5.894598 
1 1 1 -4  37 11 o 33.44110 7.019011 14.90054       5.537361 0.000000       0.000000 14.90054       5.537361 ?        ?        33.44110 7.019011 0.000000       7.019011 
1 1 1 -4  37 12 o 24.10584 6.863648 7.725960       4.225298 8.496041       7.681101 7.391826       5.059598 26.16471 9.427029 23.82398 7.671058 2.340729       12.15376 
1 1 1 -4  37 13 o 39.43711 5.007775 19.89015       4.704298 29.93650       9.252108 16.38729       5.463207 46.77742 8.426367 35.12749 6.624989 11.64993       10.71887 
1 1 1 -4  37 14 o 66.90032 3.728215 55.84022       6.054024 65.86649       12.14948 52.52840       6.982665 70.55825 7.165270 64.55200 4.466440 6.006248       8.443351 
1 1 1 -4  37 15 o 38.09192 5.047847 18.69287       4.570480 19.01838       8.295745 18.55100       5.476625 36.33611 9.323337 37.44287 6.220331 -1.106770      11.20790 
1 1 1 -4  37 16 o 56.92821 4.550765 41.19568       6.260649 50.31902       11.80752 37.62763       7.384090 60.30758 8.250422 53.75122 5.725330 6.556362       10.04235 
1 1 1 -4  37 17 o 48.18909 4.982530 29.96145       5.766770 27.40019       10.58537 31.04244       6.876872 42.41744 10.33664 48.50983 5.941227 -6.092392      11.92243 
1 1 1 -4  37 18 o 19.58311 6.644954 4.953163       3.781440 11.31353       8.036476 3.144524       4.285492 27.82661 9.678340 17.72759 6.899920 10.09902       11.88609 
1 1 1 -4  37 19 o 18.80611 6.644510 4.455167       3.797514 4.220253       7.820258 4.527655       4.344080 21.60893 8.989470 19.26605 7.067479 2.342886       11.43503 
1 1 1 -4  37 20 f 52.59676 4.743076 36.02370       6.014074 27.28744       10.76373 39.98891       7.251586 40.54689 10.72871 54.84545 5.499844 -14.29855      12.05627 
1 1 1 -4  37 21 o 14.14163 6.251111 -0.2912753     4.237702 0.6482066      7.624266 -0.7112597     5.097655 18.70739 8.320738 15.07051 6.746513 3.636882       10.71215 
1 1 1 -4  37 22 o 27.60577 6.964739 11.18721       4.684359 18.29858       8.819410 8.392625       5.528684 32.56076 10.08261 23.62262 8.034529 8.938139       12.89235 
1 1 1 -4  37 23 f 19.74607 7.361235 5.283741       4.746353 6.858559       8.847068 4.647294       5.624258 22.71838 9.514375 19.55479 7.812598 3.163591       12.31097 
1 1 1 -4  37 24 o 19.32136 7.049204 5.209358       4.312713 0.000000       0.000000 5.209358       4.312713 ?        ?        19.32136 7.049204 0.000000       7.049204 
1 1 1 -4  37 25 o 17.13026 6.613449 3.684013       3.912877 4.288173       7.958533 3.491414       4.493488 20.04948 8.721952 17.32764 6.962543 2.721838       11.16017 
1 1 1 -4  37 26 o 36.66993 4.586812 18.29072       4.009400 19.68414       6.668563 17.50185       5.017588 34.53384 8.070071 34.46420 6.202397 0.6964493E-01  10.17820 
1 1 1 -4  37 27 o 17.32197 6.338671 4.303059       3.491003 12.40349       6.399057 0.8705840      4.165484 25.96026 8.642905 14.25318 6.252713 11.70708       10.66753 
1 1 1 -4  37 28 o 25.31120 6.435463 10.12002       3.977628 7.503075       5.978219 12.19878       5.328166 20.68644 8.120831 26.35837 7.768600 -5.671926      11.23829 
1 1 1 -4  37 29 o 13.82616 6.263402 0.1774855      4.544784 2.233478       8.766056 -0.5783011     5.314875 17.75992 8.278524 14.15671 6.546124 3.603208       10.55394 
1 1 1 -4  37 30 o 35.18929 6.390525 19.72600       5.278253 19.04110       10.93649 19.93398       6.026603 25.28774 10.58357 33.83401 7.505863 -8.546268      12.97497 
1 1 1 -4  38 1  o 51.19252 3.520928 32.54480       4.365629 35.01851       6.337420 30.31085       6.022475 52.62186 5.002171 48.87865 5.132627 3.743214       7.166977 
1 1 1 -4  38 2  o 74.15857 3.068438 67.86620       5.533189 69.33685       7.948755 66.48363       7.707063 74.46725 4.399847 72.93230 4.356287 1.534943       6.191598 
1 1 1 -4  38 3  o 72.10428 3.101944 64.18789       5.437685 57.77249       7.652169 70.73191       7.728496 67.83981 4.657002 75.28135 4.229819 -7.441544      6.291188 
1 1 1 -4  38 4  o 28.00065 5.462650 10.20440       3.593524 9.948025       5.026620 10.47239       5.139273 27.21837 7.389924 27.90069 7.427685 -0.6823139     10.47767 
1 1 1 -4  38 5  o 42.20399 4.068372 22.33807       4.132384 24.44394       5.731157 20.05766       5.963938 43.67376 5.507198 39.12982 6.481127 4.543945       8.504953 
1 1 1 -4  38 6  o 22.71352 6.024941 6.809122       3.389133 6.936908       4.472283 6.636748       5.194253 23.05132 7.186678 22.96860 7.788042 0.8272171E-01  10.59726 
1 1 1 -4  38 7  o 43.78292 4.083841 24.06212       4.306965 24.49043       5.811940 23.54039       6.414474 43.63142 5.594792 42.42738 6.403265 1.204044       8.503147 
1 1 1 -4  38 8  o 40.69562 4.347682 20.91752       4.244917 24.08782       5.881153 17.46963       6.133216 43.17547 5.731123 36.05588 7.232174 7.119591       9.227682 
1 1 1 -4  38 9  o 52.97710 4.424417 35.38158       5.659787 42.70591       8.523610 29.60539       7.569381 57.36186 6.195876 47.38783 6.744991 9.974033       9.158809 
1 1 1 -4  38 10 o 35.01875 6.392726 16.27030       5.254399 18.79267       8.490788 14.70484       6.689065 36.20264 9.505049 32.45114 8.395470 3.751503       12.68187 
1 1 1 -4  38 11 o 36.00543 5.776086 16.98343       4.896702 17.17853       7.626636 16.84659       6.387053 34.74278 8.952406 34.98846 7.700210 -0.2456856     11.80842 
1 1 1 -4  38 12 o 44.70971 5.299487 25.82913       5.661780 28.60604       9.150161 24.10635       7.207154 45.12955 8.634640 42.15527 7.278822 2.974277       11.29328 
1 1 1 -4  38 13 o 86.21973 5.007822 95.06242       10.47655 98.07213       14.34258 91.61962       15.33982 85.77982 6.919979 81.99770 7.769524 3.782127       10.40440 
1 1 1 -4  38 14 o 20.81805 7.173975 5.566647       4.411187 4.708764       7.456166 6.028604       5.471443 22.09252 8.936277 21.93582 7.949185 0.1566982      11.96021 
1 1 1 -4  38 15 o 66.68904 5.103884 57.51734       8.231496 63.29041       11.41836 51.27077       11.87739 68.34177 6.952871 60.20452 8.317713 8.137241       10.84098 
1 1 1 -4  38 16 o 33.83125 6.322428 15.62415       5.020797 13.01739       8.446337 17.04859       6.243657 29.20438 9.930822 34.59334 7.613301 -5.388956      12.51334 
1 1 1 -4  38 17 o 18.50433 6.874916 4.083897       4.133195 1.524061       7.499620 5.200580       4.953341 19.43464 8.460463 20.35584 7.532967 -0.9211998     11.32806 
1 1 1 -4  38 18 o 35.28701 5.997175 17.05023       4.972640 18.03549       9.286918 16.65422       5.887779 32.88145 10.37128 33.98083 7.326099 -1.099380      12.69784 
1 1 1 -4  38 19 o 53.87965 3.981078 37.31495       5.190189 40.86537       11.40194 36.38699       5.829131 50.75104 9.570167 52.76553 4.578607 -2.014488      10.60904 
1 1 1 -4  38 20 o 14.24444 5.989868 1.133252       3.528636 -3.711504      7.678769 2.430189       3.972967 16.39404 7.676552 16.15185 6.526791 0.2421932      10.07613 
1 1 1 -4  38 21 o 11.45533 5.311110 -2.162330      3.533469 4.473041       7.612113 -3.984754      3.989306 20.59593 8.735871 11.20087 5.330472 9.395059       10.23374 
1 1 1 -4  38 22 o 35.09118 6.259350 17.65839       5.156228 0.000000       0.000000 17.65839       5.156228 ?        ?        35.09118 6.259350 0.000000       6.259350 
1 1 1 -4  38 23 o 26.28574 6.605919 10.35974       4.225879 13.66152       8.503013 9.276711       4.869879 27.07095 9.894731 24.25597 7.489057 2.814976       12.40934 
1 1 1 -4  38 24 o 11.89230 5.472917 -1.517387      3.652084 -2.748804      7.201676 -1.091075      4.237356 15.64031 7.358509 13.08561 5.974479 2.554705       9.478505 
1 1 1 -4  38 25 o 28.21361 6.282519 12.03469       4.208518 10.26651       8.480827 12.61237       4.847485 23.26727 9.486495 28.13710 7.077299 -4.869825      11.83561 
1 1 1 -4  38 26 o 12.66370 5.678677 -0.1314883     3.628289 2.070739       7.195970 -0.8822146     4.201449 17.39698 7.881138 12.91493 5.916361 4.482050       9.854728 
1 1 1 -4  38 27 o 25.10913 8.274999 11.87124       5.870040 9.371406       8.752166 13.91517       7.913958 21.56260 9.262206 25.21822 9.483856 -3.655626      13.25639 
1 1 1 -4  38 28 o 14.37364 6.336330 1.320184       4.325828 -3.196925      7.415208 3.650535       5.326032 14.76276 7.090425 16.88482 7.238616 -2.122067      10.13270 
1 1 1 -4  38 29 o 13.99004 5.983185 1.800480       3.622783 5.507424       6.556210 0.1711062      4.346655 18.35435 7.950845 13.42690 6.099468 4.927454       10.02095 
1 1 1 -4  39 1  o 79.43477 3.394127 78.41867       6.554998 83.64624       8.558845 71.00206       10.19455 81.55374 4.322038 74.28308 5.674688 7.270660       7.133169 
1 1 1 -4  39 2  o 54.76846 3.483462 37.39162       4.625100 31.33442       6.455139 43.78168       6.630130 49.30143 5.464569 58.77211 4.667604 -9.470680      7.186657 
1 1 1 -4  39 3  o 32.75741 4.791363 13.80286       3.711656 15.07441       5.122798 12.39773       5.385173 33.58710 6.493842 30.05877 7.401710 3.528330       9.846587 
1 1 1 -4  39 4  f 23.16937 5.876816 7.161067       3.322607 7.379343       4.335688 6.850478       5.171884 23.44781 7.031973 22.98808 7.771409 0.4597282      10.48062 
1 1 1 -4  39 5  o 53.50066 3.457296 35.70331       4.483326 41.28659       6.240926 29.74940       6.444747 57.09266 4.522649 47.89866 5.628660 9.193996       7.220538 
1 1 1 -4  39 6  o 31.15499 4.792399 12.53605       3.522039 7.437912       4.540041 20.24161       5.581568 23.50699 7.226233 39.19165 6.037823 -15.68466      9.416675 
1 1 1 -4  39 7  o 12.57076 5.674640 -1.538001      3.691803 -3.005851      5.609799 -0.4166200     4.903238 14.87097 6.821355 15.47715 6.786929 -0.6061821     9.622540 
1 1 1 -4  39 8  o 7.934488 3.939156 -6.837838      2.922017 -8.397151      3.773068 -4.501220      4.618721 9.125039 4.520777 12.41071 5.855584 -3.285668      7.397654 
1 1 1 -4  39 9  o 98.56703 2.946478 120.4563       7.069411 119.3894       10.19736 121.4435       9.809246 97.17487 4.317010 98.17561 4.109199 -1.000748      5.960042 
1 1 1 -4  39 10 o 73.18974 3.677813 67.20911       6.538557 68.28924       12.08226 66.76177       7.775542 71.11379 7.065361 72.48198 4.423207 -1.368187      8.335711 
1 1 1 -4  39 11 o 61.78229 3.830289 48.12680       5.738398 52.21279       10.96152 46.58427       6.735025 61.63358 7.449166 60.32591 4.616482 1.307671       8.763675 
1 1 1 -4  39 12 o 59.69491 4.661611 45.79656       6.727509 32.30897       10.22032 56.10882       8.936639 46.62341 9.321506 65.32101 5.670282 -18.69760      10.91066 
1 1 1 -4  39 13 o 59.61430 4.526275 45.68367       6.526337 48.28780       11.13013 44.31914       8.056751 58.21878 8.061192 57.76688 5.801748 0.4518967      9.931923 
1 1 1 -4  39 14 o 43.52890 4.696052 24.65466       4.902603 15.88397       9.160577 28.17513       5.803717 31.31316 10.33813 46.21065 5.246563 -14.89749      11.59325 
1 1 1 -4  39 15 f 89.75386 3.441786 101.5885       7.513937 91.61341       14.39387 105.3250       8.809547 80.45590 7.425200 90.86937 3.988035 -10.41347      8.428406 
1 1 1 -4  39 16 f 44.41361 4.491252 25.73399       4.794205 26.90191       9.577742 25.34353       5.537929 40.79849 9.763911 43.50132 5.335674 -2.702831      11.12670 
1 1 1 -4  39 17 o 9.722631 4.702107 -4.797183      3.398452 -8.913724      5.863843 -2.715136      4.170242 12.19316 5.959550 12.30770 5.727942 -0.1145353     8.265926 
1 1 1 -4  39 18 o 29.02090 5.902780 11.81362       4.032200 16.23570       8.624053 10.57648       4.561492 30.54281 10.02827 26.78625 6.934443 3.756557       12.19232 
1 1 1 -4  39 19 o 11.79842 5.407950 -1.607412      3.517073 2.872908       7.859069 -2.729398      3.932877 19.68426 8.613150 11.79776 5.514406 7.886496       10.22717 
1 1 1 -4  39 20 o 22.33410 7.387885 7.594242       4.677497 4.730981       8.514816 8.831725       5.597761 20.91321 9.060131 23.63335 8.083580 -2.720139      12.14209 
1 1 1 -4  39 21 o 19.03399 7.135932 5.057858       4.473046 0.000000       0.000000 5.057858       4.473046 ?        ?        19.03399 7.135932 0.000000       7.135932 
1 1 1 -4  39 22 o 33.51425 6.773668 17.02092       5.341586 5.366470       8.396898 24.94297       6.922960 20.57373 8.954366 40.05909 7.363016 -19.48536      11.59287 
1 1 1 -4  39 23 o 16.69028 6.614034 3.509634       3.999139 8.530028       7.906527 1.783675       4.635879 22.14168 9.108491 15.57629 6.716399 6.565389       11.31701 
1 1 1 -4  39 24 o 39.30052 5.804814 22.69398       5.392238 22.64544       9.848959 22.71475       6.443800 31.48138 10.72342 37.53847 7.307132 -6.057091      12.97636 
1 1 1 -4  39 25 o 13.52528 6.198948 -0.6188867     4.619846 2.998997       8.102706 -2.361494      5.623446 18.12974 8.271420 13.70830 6.465785 4.421433       10.49870 
1 1 1 -4  39 26 o 16.44748 6.616147 3.720057       4.062260 4.129687       7.182487 3.527397       4.925775 18.09163 8.059656 16.69437 7.051641 1.397259       10.70905 
1 1 1 -4  39 27 o 24.79931 6.767323 10.32481       4.202818 1.802751       8.617303 12.98464       4.814220 17.26548 8.099816 27.53240 7.122100 -10.26692      10.78570 
1 1 1 -4  40 1  o 34.02900 4.520720 14.93830       3.656153 14.11558       5.165951 15.76397       5.175223 31.99989 6.832567 34.05242 6.473101 -2.052525      9.411961 
1 1 1 -4  40 2  o 39.82103 4.129477 20.20666       3.949121 20.59725       5.501576 19.79147       5.672131 39.34218 5.921862 38.35372 6.286393 0.9884605      8.636387 
1 1 1 -4  40 3  o 24.96047 6.456069 8.561286       3.956206 12.77863       4.938388 1.005519       6.610054 30.40227 6.832517 18.51668 8.002276 11.88559       10.52234 
1 1 1 -4  40 4  o 27.36030 6.297643 10.24008       4.111811 12.64510       5.133310 5.934473       6.868397 30.08452 7.114436 22.55493 8.747329 7.529596       11.27524 
1 1 1 -4  40 5  o 22.07135 7.357009 6.557833       4.636322 -1.526868      6.151404 17.19057       7.054477 16.31115 7.347457 34.33484 8.481642 -18.02369      11.22156 
1 1 1 -4  40 6  o 63.33916 3.612994 50.47436       5.553548 45.97913       7.051531 57.81681       9.012136 59.66595 4.892704 66.36073 5.625858 -6.694786      7.455791 
1 1 1 -4  40 7  o 54.05624 4.034787 37.13901       5.276652 32.96615       6.606207 44.49301       8.769950 50.03281 5.509362 57.51593 6.363398 -7.483120      8.417001 
1 1 1 -4  40 8  o 69.72048 3.177115 60.79844       5.383771 54.76480       7.536217 67.08710       7.693833 65.10752 4.783306 72.41655 4.380305 -7.309029      6.485915 
1 1 1 -4  40 9  o 33.85625 4.678751 14.96937       3.757083 13.79438       5.350181 16.11252       5.277206 31.14907 7.193517 34.10632 6.587903 -2.957249      9.754340 
1 1 1 -4  40 10 o 36.50957 5.246519 17.70066       4.533923 20.26195       8.431583 16.65879       5.377575 36.00632 9.480649 34.59521 6.619816 1.411106       11.56307 
1 1 1 -4  40 11 o 14.14341 6.280568 -0.5632795     4.326085 -3.267056      6.487263 1.601980       5.805387 15.52937 7.198742 17.68589 7.569159 -2.156528      10.44577 
1 1 1 -4  40 12 o 29.14819 7.098548 12.29587       4.994561 21.50652       7.703189 5.615368       6.560392 37.55067 8.603145 21.43850 8.478985 16.11217       12.07921 
1 1 1 -4  40 13 o 12.56549 5.607541 -0.7071071     3.492587 0.8971812      5.937836 -1.555745      4.318653 17.14577 7.494907 13.32783 6.064363 3.817937       9.641065 
1 1 1 -4  40 14 o 64.28927 3.819878 52.95742       5.957469 63.63509       12.21783 49.62684       6.823628 65.77943 7.771896 61.57456 4.580362 4.204868       9.021202 
1 1 1 -4  40 15 o 17.25148 6.614474 3.488883       3.895217 8.256834       7.407799 1.666774       4.579419 23.58371 9.101048 16.08307 6.796606 7.500635       11.35883 
1 1 1 -4  40 16 o 17.01771 6.645289 3.288332       3.985442 -0.7522143     7.305164 5.000609       4.755509 17.27259 7.870128 19.44634 7.343270 -2.173744      10.76395 
1 1 1 -4  40 17 o 27.08553 6.504813 10.75453       4.239343 6.346664       7.514600 12.81230       5.134402 21.67567 8.894328 29.03798 7.272423 -7.362316      11.48900 
1 1 1 -4  40 18 o 32.55012 7.166496 16.05739       5.530376 23.92924       10.08907 12.67612       6.612304 35.24122 10.76079 27.38413 8.764815 7.857090       13.87864 
1 1 1 -4  40 19 o 21.38135 8.167862 7.054184       5.925156 0.000000       0.000000 7.054184       5.925156 ?        ?        21.38135 8.167862 0.000000       8.167862 
1 1 1 -4  40 20 o 8.844256 4.451371 -11.72190      4.357813 -14.25592      7.437411 -10.39712      5.377622 12.27332 6.124093 10.72120 5.326249 1.552117       8.116245 
1 1 1 -4  40 21 o 44.46168 5.547218 28.24073       5.879928 18.67510       9.925916 33.41221       7.298296 28.90701 10.66964 47.13680 6.528757 -18.22978      12.50863 
1 1 1 -4  40 22 o 18.45456 7.235632 5.051405       4.740920 12.03545       8.529474 1.929101       5.703037 24.07427 9.620130 16.38908 7.247838 7.685190       12.04483 
1 1 1 -4  40 23 o 40.19801 5.171229 23.12076       4.948426 42.09226       11.11663 18.43269       5.526113 45.65771 10.24389 33.95071 6.914523 11.70701       12.35912 
1 1 1 -4  40 24 o 16.46178 6.907797 3.353069       4.677726 8.885214       8.441836 0.9018539      5.619283 21.19326 9.099928 15.34989 6.958013 5.843373       11.45524 
1 1 1 -4  40 25 o 19.53754 6.851129 6.407001       4.031847 10.29399       8.542454 5.292957       4.573276 21.67885 9.226978 18.13398 7.107558 3.544876       11.64708 
1 1 1 -4  41 1  o 14.31883 5.817850 1.528672       3.176586 2.208572       4.445552 0.8193573      4.540701 16.68812 6.843659 15.55512 6.676389 1.133003       9.560850 
1 1 1 -4  41 2  o 14.95089 6.128987 1.597790       3.563890 6.007952       6.294782 -0.4827703     4.323581 21.77781 8.393382 14.19995 6.293656 7.577852       10.49090 
1 1 1 -4  41 3  o 27.56525 6.036031 10.52592       3.942024 18.43945       7.150353 7.070463       4.724925 34.92999 8.485355 22.38401 7.425999 12.54598       11.27594 
1 1 1 -4  41 4  o 39.23615 4.120238 19.85169       3.880826 19.55119       5.398181 20.17314       5.583125 37.78427 6.068120 38.30713 6.191967 -0.5228653     8.669633 
1 1 1 -4  41 5  o 42.74516 3.990899 23.46892       4.109083 15.96520       5.550420 32.56901       6.112384 33.41229 7.039387 49.62773 5.127945 -16.21544      8.709122 
1 1 1 -4  41 6  o 33.74285 4.712446 15.01306       3.769392 17.25736       5.260614 12.64500       5.403715 35.19601 6.367832 29.29665 7.528680 5.899366       9.860542 
1 1 1 -4  41 7  o 35.08688 4.558530 16.16499       3.805622 17.27483       5.302885 14.98639       5.464686 35.12067 6.433021 32.16452 7.156477 2.956154       9.622833 
1 1 1 -4  41 8  o 16.64792 6.198299 3.276502       3.363047 6.782770       4.646918 -0.5796893     4.873286 21.82994 7.366471 14.82734 6.619915 7.002599       9.903947 
1 1 1 -4  41 9  o 16.91601 6.218412 3.494798       3.365829 4.093488       4.742682 2.887282       4.777512 18.68718 7.262796 17.50947 7.127169 1.177711       10.17569 
1 1 1 -4  41 10 o 29.16555 7.379137 12.65627       5.247804 23.65716       8.465927 5.791523       6.687641 38.45006 9.165387 21.37992 8.526731 17.07014       12.51836 
1 1 1 -4  41 11 o 53.56747 4.191304 37.26765       5.427716 33.44722       9.728827 38.99415       6.540142 46.04638 8.992917 54.09260 5.018735 -8.046223      10.29856 
1 1 1 -4  41 12 o 47.73713 4.400540 29.89533       5.061578 29.10691       9.580086 30.20065       5.961597 41.97023 9.578682 47.27993 5.263405 -5.309708      10.92953 
1 1 1 -4  41 13 o 26.40609 6.799270 10.32026       4.401431 19.94884       8.325000 6.584641       5.185422 34.13464 9.605501 21.30188 7.735885 12.83276       12.33327 
1 1 1 -4  41 14 o 25.52297 6.781721 9.717184       4.289391 14.24280       7.506923 7.523369       5.226645 28.70156 9.352142 22.24955 7.800610 6.452015       12.17834 
1 1 1 -4  41 15 o 33.50113 5.798946 15.86219       4.562838 13.97391       8.603726 16.60109       5.382041 27.55440 9.970538 33.41614 6.839847 -5.861740      12.09112 
1 1 1 -4  41 16 o 14.76465 6.205341 1.605021       3.783936 -2.294011      6.696468 3.433945       4.586330 15.51628 7.233650 17.33251 7.009426 -1.816234      10.07262 
1 1 1 -4  41 17 o 17.12341 6.893179 3.473764       4.413109 -1.010391      7.537280 5.812887       5.443784 16.75031 7.762903 19.94082 7.772322 -3.190514      10.98506 
1 1 1 -4  41 18 o 12.04663 5.680406 -2.967069      4.334676 0.000000       0.000000 -2.967069      4.334676 ?        ?        12.04663 5.680406 0.000000       5.680406 
1 1 1 -4  41 19 o 38.02096 6.027633 21.33750       5.398696 12.45702       8.597906 27.11778       6.936636 24.70225 9.726300 41.60921 7.095346 -16.90696      12.03930 
1 1 1 -4  41 20 o 15.70629 6.419280 2.840487       3.894787 3.167307       8.329932 2.749049       4.406074 18.59094 8.444718 16.00893 6.710102 2.582006       10.78604 
1 1 1 -4  41 21 o 16.54961 6.636874 3.634963       4.074528 -1.585724      7.888343 5.534672       4.758450 16.05609 7.598593 18.77936 7.281443 -2.723269      10.52416 
1 1 1 -4  41 22 o 30.61845 6.318557 14.63459       4.558094 15.01392       9.699673 14.52708       5.163764 24.69063 10.11530 29.39696 7.253430 -4.706331      12.44715 
1 1 1 -4  41 23 o 25.58281 7.803308 11.94993       5.307284 17.09405       9.570354 9.665386       6.377818 25.79103 10.22810 22.08073 8.464379 3.710297       13.27629 
1 1 1 -4  42 1  o 29.78764 5.704511 12.30484       3.990126 17.80799       7.698953 10.28384       4.665625 32.96392 9.223448 26.34635 7.105390 6.617567       11.64296 
1 1 1 -4  42 2  f 20.72290 6.656993 6.114905       3.811851 7.429331       4.805230 3.883737       6.260548 22.47690 7.489767 19.48472 8.069005 2.992180       11.00933 
1 1 1 -4  42 3  o 37.78341 4.218821 18.64846       3.818229 15.73944       5.317652 21.74443       5.485859 32.95497 6.845568 39.68603 5.847507 -6.731056      9.003063 
1 1 1 -4  42 4  f 40.16635 4.120024 20.99901       3.975623 17.84645       5.758291 23.87054       5.495659 35.00790 6.994658 41.84157 5.524706 -6.833668      8.913340 
1 1 1 -4  42 5  o 49.26773 3.682708 31.14183       4.389472 32.77505       6.489709 29.76460       5.959438 49.07189 5.522737 46.93348 5.303376 2.138416       7.656789 
1 1 1 -4  42 6  o 45.66743 3.830422 26.91096       4.223502 28.87421       6.331789 25.33727       5.668906 45.74168 5.811396 43.05304 5.530920 2.688644       8.022679 
1 1 1 -4  42 7  f 12.79406 5.580943 0.1052199      3.277488 1.433561       4.536949 -1.344585      4.739841 15.75823 6.716261 13.95699 6.351641 1.801241       9.243998 
1 1 1 -4  42 8  o 10.11469 4.842712 -3.931248      3.398820 -2.990387      4.247263 -5.606652      5.667693 12.17386 5.703259 13.04072 6.246294 -0.8668642     8.458331 
1 1 1 -4  42 9  o 10.97297 5.015122 -1.361519      2.995893 -0.2098503     4.103268 -2.676374      4.384350 13.77789 6.117558 12.55248 5.852328 1.225410       8.466064 
1 1 1 -4  42 10 o 20.82192 6.842467 6.367451       4.014643 3.598783       7.113585 7.661424       4.863128 19.47693 8.358028 22.42391 7.535775 -2.946981      11.25364 
1 1 1 -4  42 11 o 16.43164 6.589416 2.899477       4.016372 -2.655684      7.319001 5.293171       4.804386 16.11013 7.527621 19.52828 7.379417 -3.418148      10.54139 
1 1 1 -4  42 12 o 53.56591 4.325417 38.01729       5.598173 40.08680       11.06011 37.30446       6.491085 47.95344 9.796023 52.18047 5.172749 -4.227028      11.07788 
1 1 1 -4  42 13 o 17.53571 6.794835 3.955615       4.141672 9.280673       8.125924 2.086787       4.813880 23.35781 9.370748 16.25382 6.922540 7.103983       11.65043 
1 1 1 -4  42 14 o 29.77139 6.179872 13.07250       4.336556 20.76175       9.136075 10.83623       4.926966 32.34216 10.29726 25.98904 7.415548 6.353125       12.68952 
1 1 1 -4  42 15 o 12.64143 5.695707 -0.5236189     3.698948 -2.335788      6.311101 0.4246259      4.565265 14.84577 6.954099 14.51029 6.447190 0.3354845      9.482920 
1 1 1 -4  42 16 o 16.51908 6.960111 2.820168       4.779316 0.000000       0.000000 2.820168       4.779316 ?        ?        16.51908 6.960111 0.000000       6.960111 
1 1 1 -4  42 17 o 11.31998 5.366412 -3.040961      3.966886 -9.821385      7.645227 -0.5429584     4.640432 13.35940 6.584443 13.75479 6.269315 -0.3953838     9.091711 
1 1 1 -4  42 18 o 49.36367 4.537128 33.51367       5.396884 42.32872       11.69073 31.12634       6.083954 44.91040 10.81254 46.38882 5.488073 -1.478416      12.12560 
1 1 1 -4  42 19 o 39.95808 5.280078 23.02463       5.015690 41.79841       11.15066 18.26264       5.615895 45.14019 10.35706 33.51900 7.096671 11.62119       12.55514 
1 1 1 -4  42 20 o 25.20093 6.645676 10.32475       4.138895 11.85956       8.346914 9.824331       4.766099 23.20057 9.429190 23.70255 7.423406 -0.5019798     12.00069 
1 1 1 -4  43 1  o 13.50458 5.737556 0.9329330      3.292871 -4.567222      4.658874 6.423414       4.654775 11.91714 5.695961 20.77813 7.354957 -8.860990      9.302654 
1 1 1 -4  43 2  o 17.88880 6.373137 4.385590       3.500025 -2.117139      5.012443 10.57303       4.889416 13.70547 6.344370 26.06823 7.370293 -12.36277      9.724827 
1 1 1 -4  43 3  o 12.54035 5.533076 -0.9873360E-01 3.305502 -2.356658      4.696065 2.118533       4.653594 13.12029 6.096684 16.26371 6.861072 -3.143417      9.178445 
1 1 1 -4  43 4  o 42.61996 4.575190 24.31491       4.677500 21.26475       6.024024 28.94607       7.422851 37.93852 6.763927 43.89656 7.187648 -5.958038      9.869802 
1 1 1 -4  43 5  f 14.18240 6.037350 1.127212       3.658344 1.528152       4.575109 0.4163105      6.092085 15.64351 6.707750 16.42291 7.361825 -0.7794046     9.959437 
1 1 1 -4  43 6  o 20.20653 6.639258 6.042895       3.779784 6.035713       4.724650 6.055665       6.299828 20.22942 7.378543 20.65426 8.262902 -0.4248352     11.07784 
1 1 1 -4  43 7  o 18.89200 6.248073 5.161404       3.345583 4.038267       4.932189 6.118585       4.553236 18.14091 7.292707 20.25622 7.263084 -2.115309      10.29252 
1 1 1 -4  43 8  o 29.54213 5.423137 12.31610       3.760338 13.69041       5.422812 11.04322       5.218891 29.34719 7.542130 26.13853 7.684465 3.208656       10.76730 
1 1 1 -4  43 9  o 39.10808 4.266770 20.42303       4.000443 12.71119       5.354047 30.16985       6.019141 28.06289 7.629990 46.43037 5.421746 -18.36748      9.360132 
1 1 1 -4  43 10 f 21.89931 7.030618 7.506858       4.252197 -2.228404      8.656938 10.60254       4.881676 17.04852 8.035471 25.66936 7.399500 -8.620840      10.92343 
1 1 1 -4  43 11 o 16.26616 6.413072 3.236218       3.742270 3.361775       8.151016 3.202684       4.212484 19.12948 8.549619 16.57387 6.712232 2.555607       10.86968 
1 1 1 -4  43 12 o 34.82471 5.730976 17.58071       4.694502 17.07660       9.305775 17.75279       5.437051 28.13731 10.34036 33.90973 6.816298 -5.772421      12.38487 
1 1 1 -4  43 13 o 21.75268 7.034285 7.628206       4.251528 6.876638       8.211068 7.903506       4.969561 20.84954 8.963836 21.77110 7.608256 -0.9215603     11.75738 
1 1 1 -4  43 14 o 19.38225 7.675167 5.814703       5.381599 0.000000       0.000000 5.814703       5.381599 ?        ?        19.38225 7.675167 0.000000       7.675167 
1 1 1 -4  43 15 o 31.17412 7.005917 15.59765       5.192269 0.000000       0.000000 15.59765       5.192269 ?        ?        31.17412 7.005917 0.000000       7.005917 
1 1 1 -4  43 16 o 29.71702 7.319741 14.70619       5.265387 10.61604       9.304215 16.63325       6.386436 22.50065 9.604805 30.22729 8.379377 -7.726641      12.74622 
1 1 1 -4  43 17 o 22.88417 6.856561 8.675159       4.123517 14.35886       7.830894 6.494580       4.850445 25.71904 9.479783 19.68892 7.420315 6.030113       12.03858 
1 1 1 -4  43 18 o 16.30764 6.566995 3.578252       4.006794 10.24739       8.388892 1.607140       4.560635 22.05026 9.251643 14.92019 6.544028 7.130071       11.33213 
1 1 1 -4  44 1  o 16.43995 6.393835 3.437344       3.677677 8.901672       7.099682 1.433375       4.299480 22.57454 8.853464 14.98436 6.464690 7.590183       10.96248 
1 1 1 -4  44 2  o 16.56776 6.602603 3.353967       4.006975 7.217479       7.740183 1.939475       4.683390 21.30493 8.909245 15.79247 6.779407 5.512464       11.19531 
1 1 1 -4  44 3  o 25.86726 7.433637 10.92477       4.933987 5.228235       7.149796 16.10407       6.817481 19.76517 8.427876 29.99847 8.772948 -10.23330      12.16527 
1 1 1 -4  44 4  o 32.24823 5.646137 15.00652       4.275465 16.40430       5.860479 13.41611       6.251265 31.67359 7.674327 27.54813 8.481389 4.125460       11.43806 
1 1 1 -4  44 5  o 12.54373 5.515713 0.2177604      3.258736 1.107243       4.695894 -0.6084899     4.525903 15.10343 6.631886 13.68686 6.220077 1.416566       9.092375 
1 1 1 -4  44 6  f 18.97840 6.442182 5.432886       3.554209 0.9002711      4.900715 10.46229       5.162302 15.13933 6.705762 24.92861 7.713014 -9.789285      10.22046 
1 1 1 -4  44 7  o 27.59262 5.646480 11.12043       3.668667 9.395401       5.379448 12.62032       5.016142 23.40146 7.925740 27.87141 7.300003 -4.469946      10.77531 
1 1 1 -4  44 8  o 13.87310 5.790042 1.611535       3.259601 -0.9390023     4.709160 3.957566       4.516423 13.63825 6.253651 17.36806 6.979767 -3.729813      9.371514 
1 1 1 -4  44 9  o 27.05687 6.720186 11.52823       4.410880 -4.754625      7.848752 19.04469       5.332640 15.10978 7.266811 35.40680 6.416646 -20.29702      9.694323 
1 1 1 -4  44 10 o 30.70334 6.312829 14.37643       4.565434 19.60291       9.082786 12.60952       5.281061 29.89970 10.29456 27.27202 7.641992 2.627684       12.82100 
1 1 1 -4  44 11 o 27.40317 6.426566 11.67378       4.216796 21.74940       8.990786 8.832377       4.774500 31.79091 10.22479 22.80669 7.460124 8.984219       12.65701 
1 1 1 -4  44 12 o 15.22104 6.557020 1.938873       4.410398 -6.001057      6.650080 8.173517       5.892837 13.39165 6.500382 21.41616 8.154158 -8.024515      10.42810 
1 1 1 -4  44 13 f 17.69315 7.093132 4.530412       4.652404 0.000000       0.000000 4.530412       4.652404 ?        ?        17.69315 7.093132 0.000000       7.093132 
1 1 1 -4  44 14 o 22.97915 7.195386 8.985752       4.478034 26.45767       9.428040 3.895901       5.088662 34.69024 10.36158 17.22217 7.214390 17.46807       12.62576 
1 1 1 -4  45 1  o 16.95154 6.579231 3.999929       3.887838 8.460213       5.479340 -0.5224082     5.517323 21.94675 7.954669 14.65819 6.738885 7.288565       10.42542 
1 1 1 -4  45 2  o 18.42095 6.455492 5.193660       3.579266 4.416472       4.858124 6.116408       5.293553 17.79684 7.208009 19.54722 7.651138 -1.750381      10.51167 
1 1 1 -4  45 3  o 19.13980 6.450919 5.699224       3.563611 7.269940       5.061765 4.155592       5.017934 20.76390 7.626981 17.61683 7.252664 3.147068       10.52483 
1 1 1 -4  45 4  o 19.85126 6.591904 6.236798       3.722902 4.243341       4.929995 8.882055       5.679066 17.64327 7.217872 22.28655 8.095408 -4.643284      10.84589 
1 1 1 -4  45 5  o 18.13642 6.547951 5.010287       3.708131 1.191527       5.346836 8.548997       5.147047 15.51465 6.929933 22.14784 7.742718 -6.633186      10.39104 
1 1 1 -4  45 6  o 23.72073 7.164514 9.407786       4.489024 16.57807       8.726662 6.827744       5.234718 27.21298 10.01128 20.18543 7.685399 7.027544       12.62106 
1 1 1 -4  45 7  o 13.32945 5.970468 0.1476653      3.998430 3.908651       7.621941 -1.280344      4.696564 18.48437 8.263956 13.25110 6.136545 5.233273       10.29321 
1 1 1 -4  45 8  o 21.45531 6.893827 7.578588       4.087739 -4.256710      6.868607 14.06941       5.086615 14.18723 6.816623 29.16062 7.201365 -14.97339      9.915947 
1 1 1 -4  45 9  o 21.06380 7.038972 7.387570       4.243686 4.732907       8.074079 8.400829       4.988255 19.00624 8.500812 21.91216 7.624815 -2.905922      11.41935 
1 1 1 -3  0  1  o 480.3145 9.883453 2816.841       115.5727 2816.841       115.5727 2816.841       115.5727 480.3145 9.883453 480.3145 9.883453 -0.000000      0.000000 
1 1 1 -3  0  2  o 232.2638 5.188969 658.4396       29.33655 658.4396       29.33655 658.4396       29.33655 232.2638 5.188969 232.2638 5.188969 0.000000       0.000000 
1 1 1 -3  0  3  o 310.7109 6.629000 1178.340       50.14114 1178.340       50.14114 1178.340       50.14114 310.7109 6.629000 310.7109 6.629000 0.000000       0.000000 
1 1 1 -3  0  4  o 320.1043 6.812778 1250.681       53.08938 1250.681       53.08938 1250.681       53.08938 320.1043 6.812778 320.1043 6.812778 -0.000000      0.000000 
1 1 1 -3  0  5  o 225.1761 5.077237 618.8785       27.82832 618.8785       27.82832 618.8785       27.82832 225.1761 5.077237 225.1761 5.077237 0.000000       0.000000 
1 1 1 -3  0  6  o 140.4652 3.683918 240.9281       12.59039 240.9281       12.59039 240.9281       12.59039 140.4652 3.683918 140.4652 3.683918 0.000000       0.000000 
1 1 1 -3  0  7  o 442.5884 9.168812 2391.592       98.79349 2391.592       98.79349 2391.592       98.79349 442.5884 9.168812 442.5884 9.168812 0.000000       0.000000 
1 1 1 -3  0  8  o 256.5564 8.036948 804.8533       50.13526 804.8533       50.13526 804.8533       50.13526 256.5564 8.036948 256.5564 8.036948 -0.000000      0.000000 
1 1 1 -3  0  9  o 508.4714 10.46663 3157.982       129.5669 3157.982       129.5669 3157.982       129.5669 508.4714 10.46663 508.4714 10.46663 0.000000       0.000000 
1 1 1 -3  0  10 o 566.1275 11.59945 3916.780       159.8734 3916.780       159.8734 3916.780       159.8734 566.1275 11.59945 566.1275 11.59945 0.000000       0.000000 
1 1 1 -3  0  11 o 179.9745 4.408601 395.4946       19.30896 395.4946       19.30896 395.4946       19.30896 179.9745 4.408601 179.9745 4.408601 0.000000       0.000000 
1 1 1 -3  0  12 o 143.3710 3.881393 251.0700       13.53833 251.0700       13.53833 251.0700       13.53833 143.3710 3.881393 143.3710 3.881393 0.000000       0.000000 
1 1 1 -3  0  13 o 245.7955 7.904456 739.1959       47.23486 739.1959       47.23486 739.1959       47.23486 245.7955 7.904456 245.7955 7.904456 0.000000       0.000000 
1 1 1 -3  0  14 o 117.7454 3.621513 169.4376       10.36903 169.4376       10.36903 169.4376       10.36903 117.7454 3.621513 117.7454 3.621513 0.000000       0.000000 
1 1 1 -3  0  15 o 145.3324 3.989596 257.9864       14.10545 257.9864       14.10545 257.9864       14.10545 145.3324 3.989596 145.3324 3.989596 0.000000       0.000000 
1 1 1 -3  0  16 o 508.8711 10.51827 3162.716       130.3074 3162.716       130.3074 3162.716       130.3074 508.8711 10.51827 508.8711 10.51827 -0.000000      0.000000 
1 1 1 -3  0  17 o 241.3326 5.548425 710.9527       32.59140 710.9527       32.59140 710.9527       32.59140 241.3326 5.548425 241.3326 5.548425 -0.000000      0.000000 
1 1 1 -3  0  18 o 24.15700 7.723319 8.990439       4.006227 8.990439       4.006227 8.990439       4.006227 24.15700 7.723319 24.15700 7.723319 0.000000       0.000000 
1 1 1 -3  0  19 o 151.5831 4.230995 280.6643       15.60140 280.6643       15.60140 280.6643       15.60140 151.5831 4.230995 151.5831 4.230995 0.000000       0.000000 
1 1 1 -3  0  20 o 60.18488 5.817052 45.37226       8.336447 45.37226       8.336447 45.37226       8.336447 60.18488 5.817052 60.18488 5.817052 0.000000       0.000000 
1 1 1 -3  0  21 o 109.7963 4.012095 147.4987       10.70226 147.4987       10.70226 147.4987       10.70226 109.7963 4.012095 109.7963 4.012095 0.000000       0.000000 
1 1 1 -3  0  22 o 523.8168 10.85950 3352.342       138.4854 3352.342       138.4854 3352.342       138.4854 523.8168 10.85950 523.8168 10.85950 -0.000000      0.000000 
1 1 1 -3  0  23 o 616.2419 12.66881 4643.883       190.0679 4643.883       190.0679 4643.883       190.0679 616.2419 12.66881 616.2419 12.66881 0.000000       0.000000 
1 1 1 -3  0  24 o 356.0008 7.706876 1548.103       66.78912 1548.103       66.78912 1548.103       66.78912 356.0008 7.706876 356.0008 7.706876 -0.000000      0.000000 
1 1 1 -3  0  25 o 174.7965 6.787395 374.3849       28.81242 374.3849       28.81242 374.3849       28.81242 174.7965 6.787395 174.7965 6.787395 0.000000       0.000000 
1 1 1 -3  0  26 o 324.2919 10.06394 1289.234       79.35818 1289.234       79.35818 1289.234       79.35818 324.2919 10.06394 324.2919 10.06394 -0.000000      0.000000 
1 1 1 -3  0  27 o 185.1972 4.868977 419.1766       21.93963 419.1766       21.93963 419.1766       21.93963 185.1972 4.868977 185.1972 4.868977 0.000000       0.000000 
1 1 1 -3  0  28 o 47.14858 5.849151 28.35643       6.442211 28.35643       6.442211 28.35643       6.442211 47.14858 5.849151 47.14858 5.849151 -0.000000      0.000000 
1 1 1 -3  0  29 o 71.68308 4.549550 63.44239       7.873023 63.44239       7.873023 63.44239       7.873023 71.68308 4.549550 71.68308 4.549550 0.000000       0.000000 
1 1 1 -3  0  30 o 20.01394 9.499236 7.198532       5.267996 7.198532       5.267996 7.198532       5.267996 20.01394 9.499236 20.01394 9.499236 -0.000000      0.000000 
1 1 1 -3  0  31 o 200.4431 5.167524 491.5876       25.20327 491.5876       25.20327 491.5876       25.20327 200.4431 5.167524 200.4431 5.167524 0.000000       0.000000 
1 1 1 -3  0  32 o 75.17704 6.128879 70.46345       11.05068 70.46345       11.05068 70.46345       11.05068 75.17704 6.128879 75.17704 6.128879 -0.000000      0.000000 
1 1 1 -3  0  33 o 69.01200 4.780914 59.00300       7.950144 59.00300       7.950144 59.00300       7.950144 69.01200 4.780914 69.01200 4.780914 0.000000       0.000000 
1 1 1 -3  0  34 o 78.71241 4.592222 76.45246       8.739283 76.45246       8.739283 76.45246       8.739283 78.71241 4.592222 78.71241 4.592222 -0.000000      0.000000 
1 1 1 -3  0  35 o 102.3616 4.397931 128.7172       10.92419 128.7172       10.92419 128.7172       10.92419 102.3616 4.397931 102.3616 4.397931 -0.000000      0.000000 
1 1 1 -3  0  36 o 75.11780 7.733290 71.53954       13.78273 71.53954       13.78273 71.53954       13.78273 75.11780 7.733290 75.11780 7.733290 -0.000000      0.000000 
1 1 1 -3  0  37 o 64.17552 5.231163 51.42459       8.051795 51.42459       8.051795 51.42459       8.051795 64.17552 5.231163 64.17552 5.231163 -0.000000      0.000000 
1 1 1 -3  0  38 o 169.8537 4.932579 354.2766       20.37770 354.2766       20.37770 354.2766       20.37770 169.8537 4.932579 169.8537 4.932579 -0.000000      0.000000 
1 1 1 -3  0  39 o 55.49109 5.689222 38.99998       7.492299 38.99998       7.492299 38.99998       7.492299 55.49109 5.689222 55.49109 5.689222 0.000000       0.000000 
1 1 1 -3  0  40 o 63.81850 5.266197 51.08339       8.057183 51.08339       8.057183 51.08339       8.057183 63.81850 5.266197 63.81850 5.266197 0.000000       0.000000 
1 1 1 -3  0  41 o 70.74249 5.075834 62.59191       8.644762 62.59191       8.644762 62.59191       8.644762 70.74249 5.075834 70.74249 5.075834 0.000000       0.000000 
1 1 1 -3  0  42 o 36.44550 10.09863 20.21425       7.757111 20.21425       7.757111 20.21425       7.757111 36.44550 10.09863 36.44550 10.09863 -0.000000      0.000000 
1 1 1 -3  0  43 o 10.24531 6.948725 -2.341386      5.191152 -2.341386      5.191152 -2.341386      5.191152 10.24531 6.948725 10.24531 6.948725 -0.000000      0.000000 
1 1 1 -3  0  44 o 17.62677 9.228107 6.071599       5.210263 6.071599       5.210263 6.071599       5.210263 17.62677 9.228107 17.62677 9.228107 0.000000       0.000000 
1 1 1 -3  0  45 o 28.96183 9.411191 13.98205       5.875360 13.98205       5.875360 13.98205       5.875360 28.96183 9.411191 28.96183 9.411191 0.000000       0.000000 
1 1 1 -3  0  46 o 11.21826 7.494902 -0.7933863     5.626193 -0.7933863     5.626193 -0.7933863     5.626193 11.21826 7.494902 11.21826 7.494902 -0.000000      0.000000 
1 1 1 -3  0  47 o 18.84535 9.760906 7.983063       5.784852 7.983063       5.784852 7.983063       5.784852 18.84535 9.760906 18.84535 9.760906 -0.000000      0.000000 
1 1 1 -3  0  48 o 12.10198 7.744728 1.870838       5.127644 1.870838       5.127644 1.870838       5.127644 12.10198 7.744728 12.10198 7.744728 -0.000000      0.000000 
1 1 1 -3  0  49 o 34.62655 8.665997 20.11535       6.325696 20.11535       6.325696 20.11535       6.325696 34.62655 8.665997 34.62655 8.665997 0.000000       0.000000 
1 1 1 -3  0  50 o 13.27324 8.161545 4.109768       5.115417 4.109768       5.115417 4.109768       5.115417 13.27324 8.161545 13.27324 8.161545 0.000000       0.000000 
1 1 1 -3  0  51 o 11.76565 7.675756 2.617339       5.369807 2.617339       5.369807 2.617339       5.369807 11.76565 7.675756 11.76565 7.675756 0.000000       0.000000 
1 1 1 -3  0  52 o 11.67221 7.621715 2.945941       5.311799 2.945941       5.311799 2.945941       5.311799 11.67221 7.621715 11.67221 7.621715 0.000000       0.000000 
1 1 1 -3  1  1  o 282.7938 4.313581 974.7229       29.72651 1019.485       43.20134 934.4717       40.96686 289.1683 6.130705 276.8510 6.072263 12.31735       8.628901 
1 1 1 -3  1  2  o 326.4891 4.887693 1299.323       38.88739 1305.002       55.15992 1293.712       54.83169 327.1362 6.919247 325.7185 6.908013 1.417755       9.777352 
1 1 1 -3  1  3  o 857.2927 14.13382 8984.890       295.2737 8778.068       503.2760 9093.451       364.6246 844.2152 24.48929 861.7261 17.36363 -17.51086      30.02035 
1 1 1 -3  1  4  o 762.6078 10.90487 7100.215       202.6552 6981.883       283.2768 7224.264       290.0384 755.4836 15.38685 768.4653 15.48799 -12.98169      21.83193 
1 1 1 -3  1  5  o 613.4727 8.823512 4591.581       131.9085 4732.880       190.2817 4460.854       183.0236 622.4270 12.54505 604.2898 12.42870 18.13721       17.65930 
1 1 1 -3  1  6  o 818.9061 11.70251 8189.737       233.5334 8620.434       342.1200 7813.958       319.5648 839.1609 16.73005 799.0140 16.41226 40.14691       23.43623 
1 1 1 -3  1  7  o 728.2650 12.05824 6479.058       213.9979 6814.810       271.1378 5924.387       348.4963 746.3858 14.90701 694.3671 20.61837 52.01868       25.44280 
1 1 1 -3  1  8  o 484.3360 9.972128 2863.797       117.6984 2886.804       167.1966 2841.195       165.7148 485.5985 14.14415 481.7461 14.13112 3.852478       19.99364 
1 1 1 -3  1  9  o 705.3942 10.12573 6076.516       174.0582 6490.019       257.4238 5728.243       236.2482 728.1326 14.50782 684.1392 14.17059 43.99335       20.28010 
1 1 1 -3  1  10 o 321.9309 4.869076 1263.570       38.19841 1267.411       54.11451 1259.754       53.92740 322.3204 6.889533 321.3455 6.886542 0.9749756      9.741157 
1 1 1 -3  1  11 o 464.7483 6.796925 2635.603       76.97795 2644.494       109.0960 2626.787       108.6320 465.1884 9.623736 463.6297 9.615026 1.558685       13.60386 
1 1 1 -3  1  12 o 347.4694 5.223467 1472.487       44.22945 1539.807       64.37417 1412.292       60.87240 355.1504 7.438121 340.1355 7.343996 15.01492       10.45275 
1 1 1 -3  1  13 o 319.0932 6.884821 1242.639       53.53606 1314.718       78.57466 1180.187       73.13997 327.7935 9.847792 310.5772 9.675630 17.21631       13.80568 
1 1 1 -3  1  14 o 209.8785 3.494047 536.9110       17.87034 547.1131       25.53115 527.1121       25.02151 211.8239 4.946060 207.9162 4.938432 3.907684       6.989393 
1 1 1 -3  1  15 o 114.0752 2.544353 158.5835       7.073015 160.7327       10.03769 156.4639       9.968175 114.7803 3.593070 113.2434 3.616796 1.536942       5.098173 
1 1 1 -3  1  16 o 184.3330 3.237243 414.0980       14.54167 421.2919       20.72224 407.1184       20.41135 185.9078 4.574071 182.6961 4.588283 3.211761       6.478770 
1 1 1 -3  1  17 o 720.8186 11.96068 6346.399       210.0960 6556.727       371.7067 6247.661       254.6803 730.5313 20.90124 714.7549 14.62184 15.77637       25.50804 
1 1 1 -3  1  18 f 180.9818 3.236277 399.1635       14.27304 409.2206       20.43596 389.5856       19.94331 183.2317 4.576763 178.7230 4.582887 4.508667       6.476852 
1 1 1 -3  1  19 f 435.0841 6.437871 2308.148       68.25768 2321.390       96.92331 2295.118       96.14329 436.1733 9.118704 433.6995 9.096910 2.473755       12.88039 
1 1 1 -3  1  20 o 415.8750 8.724186 2110.361       88.41456 2138.603       125.9765 2082.947       124.1183 418.1627 12.37618 412.6833 12.35584 5.479431       17.48818 
1 1 1 -3  1  21 o 478.3009 8.121650 2791.343       94.66328 2761.901       115.1969 2852.567       166.1210 475.6071 9.939313 482.6320 14.13972 -7.024933      17.28356 
1 1 1 -3  1  22 o 249.8354 4.090593 760.8389       24.90442 784.7378       35.83047 738.5015       34.64002 253.6764 5.796107 246.0904 5.776268 7.585983       8.182917 
1 1 1 -3  1  23 o 242.6389 4.017837 717.6866       23.75685 714.2336       33.52476 721.1696       33.67022 241.9965 5.684869 243.1688 5.682010 -1.172272      8.037598 
1 1 1 -3  1  24 o 105.3958 2.898160 135.4935       7.436512 133.5748       10.46507 137.4505       10.56934 104.5889 4.114039 106.0987 4.095607 -1.509811      5.805111 
1 1 1 -3  1  25 o 98.13873 6.134908 118.0278       14.59845 118.0278       14.59845 0.000000       0.000000 98.13873 6.134908 ?        ?        0.000000       6.134908 
1 1 1 -3  1  26 o 194.1532 3.511346 459.6647       16.61323 434.3395       22.86608 487.9795       24.17809 188.5876 4.979926 199.9642 4.961736 -11.37662      7.029828 
1 1 1 -3  1  27 o 114.1345 3.303332 158.9996       9.177998 153.3851       15.25761 162.1831       11.48907 111.9129 5.612531 115.2189 4.098430 -3.305962      6.949650 
1 1 1 -3  1  28 o 223.5080 3.856563 609.6330       21.00533 581.0952       28.97615 641.2388       30.49398 217.9761 5.459309 229.0492 5.463227 -11.07310      7.723400 
1 1 1 -3  1  29 o 139.3859 3.069954 237.0048       10.42766 227.7737       14.60920 246.5925       14.88864 136.4893 4.398037 142.0313 4.306622 -5.541962      6.155463 
1 1 1 -3  1  30 o 59.08973 3.357455 42.74883       4.814681 43.96208       6.735458 41.48112       6.884978 59.79439 4.659185 58.04155 4.913873 1.752838       6.771570 
1 1 1 -3  1  31 o 65.91100 3.592235 53.20155       5.747964 48.64482       9.000669 56.33978       7.469484 62.72427 5.960006 67.73243 4.551837 -5.008163      7.499393 
1 1 1 -3  1  32 o 262.6404 5.006535 844.5060       32.04313 860.7357       39.89826 815.0179       53.78027 264.8213 6.182512 256.6826 8.610048 8.138702       10.59983 
1 1 1 -3  1  33 o 77.81524 3.192475 74.06713       6.040947 75.89680       8.516083 72.21398       8.570556 78.62826 4.462847 76.67127 4.608392 1.956985       6.415161 
1 1 1 -3  1  34 o 60.98191 3.566317 45.60804       5.276639 47.27083       7.402048 43.88999       7.524037 61.90517 4.947847 59.59112 5.234364 2.314053       7.202761 
1 1 1 -3  1  35 o 18.15145 6.776231 3.090974       4.024713 3.128724       5.451731 3.045756       5.966666 20.00701 7.783697 20.56410 8.100773 -0.5570927     11.23425 
1 1 1 -3  1  36 o 52.86353 6.320933 34.95800       7.981594 40.58030       11.41471 29.57919       11.16479 56.45600 8.565517 47.69368 9.929473 8.762318       13.11345 
1 1 1 -3  1  37 o 52.29481 4.015553 33.71712       5.078138 25.14100       6.899098 43.85725       7.501848 44.61816 6.539221 59.46766 5.229902 -14.84950      8.373367 
1 1 1 -3  1  38 o 59.64425 3.781639 43.78869       5.468179 51.55320       7.826393 36.38340       7.643207 64.50308 5.018496 53.92543 5.913154 10.57766       7.755687 
1 1 1 -3  1  39 o 95.27177 3.239003 111.3509       7.508958 116.7668       10.71555 106.1253       10.52554 97.25069 4.534014 92.66449 4.676284 4.586205       6.513442 
1 1 1 -3  1  40 o 48.24549 4.271654 28.92873       4.970298 23.99141       7.081430 33.72265       6.977841 43.17337 6.968026 51.77058 5.621089 -8.597206      8.952655 
1 1 1 -3  1  41 o 71.14062 3.457186 62.46175       5.975500 60.51813       8.426542 64.42776       8.474931 69.53819 5.006178 71.80901 4.871921 -2.270821      6.985516 
1 1 1 -3  1  42 o 27.08492 6.929368 9.793512       4.591695 5.771100       5.818513 16.43390       7.475932 22.45861 8.188777 34.52077 8.847073 -12.06215      12.05515 
1 1 1 -3  1  43 o 51.17920 3.943612 32.87497       4.880495 26.29441       6.646500 40.57483       7.189569 44.73974 6.267986 56.25509 5.307234 -11.51535      8.213061 
1 1 1 -3  1  44 o 18.77245 6.577036 4.370109       3.715167 8.235523       5.425574 0.9576156      5.097809 24.39130 7.950859 16.68351 7.115230 7.707787       10.66971 
1 1 1 -3  1  45 o 35.38773 6.132842 17.18703       5.097175 20.18131       5.922928 8.638040       10.00802 38.06946 6.624949 25.36391 10.31877 12.70555       12.26242 
1 1 1 -3  1  46 o 29.26815 7.221373 12.84758       5.118367 11.78796       9.798468 13.24521       6.002382 26.22203 10.36503 28.97854 8.156819 -2.756512      13.18967 
1 1 1 -3  1  47 o 32.58895 5.424091 15.02779       4.156238 14.16776       5.888730 15.88148       5.866948 29.16122 8.031760 31.30517 7.735854 -2.143955      11.15135 
1 1 1 -3  1  48 o 11.91364 5.458660 -0.9943308     3.578713 -1.179432      5.188384 -0.8263459     4.942681 13.89715 6.440642 13.82449 6.363866 0.7266045E-01  9.054317 
1 1 1 -3  1  49 o 15.57476 6.392301 3.202564       3.882537 8.690289       5.624286 -1.793212      5.366271 21.14503 7.985651 13.37500 6.310899 7.770034       10.17831 
1 1 1 -3  1  50 o 20.25296 7.155112 7.973351       4.403512 1.414129       7.096998 12.07935       5.615107 15.42374 7.271471 23.58144 8.095175 -8.157701      10.88146 
1 1 1 -3  1  51 o 19.60467 7.037477 8.039328       4.276102 8.009085       5.421814 8.089096       6.955297 18.50524 7.569789 17.83594 7.939363 0.6692944      10.96974 
1 1 1 -3  1  52 o 15.07852 6.245823 4.260963       3.752297 -1.235859      5.173154 10.36371       5.450827 12.16341 5.862401 19.81284 7.761353 -7.649425      9.726579 
1 1 1 -3  2  1  o 228.6031 3.628541 636.8926       20.21391 644.3022       28.77918 629.6777       28.39819 229.9036 5.136845 227.2797 5.127363 2.623978       7.257894 
1 1 1 -3  2  2  o 446.2930 6.514693 2428.591       70.85168 2400.899       99.52279 2457.050       100.8900 443.5844 9.206832 448.7402 9.226076 -5.155853      13.03404 
1 1 1 -3  2  3  o 136.8430 2.555131 228.1912       8.520633 234.4179       12.20851 222.2777       11.89750 138.6428 3.616597 135.0024 3.619681 3.640411       5.116822 
1 1 1 -3  2  4  o 439.3521 6.426563 2353.593       68.80621 2257.820       94.55436 2461.390       100.3142 430.1762 9.019845 449.1406 9.165244 -18.96442      12.85921 
1 1 1 -3  2  5  o 357.5726 5.316479 1558.619       46.32596 1605.715       66.78170 1514.934       64.31737 362.8474 7.552616 352.4440 7.488625 10.40341       10.63586 
1 1 1 -3  2  6  o 572.4675 8.260468 3997.719       115.2369 4070.692       164.8091 3927.916       161.1904 577.3298 11.71443 567.1205 11.66346 10.20923       16.53071 
1 1 1 -3  2  7  o 480.2372 9.890106 2815.102       115.7425 2860.987       165.2722 2770.939       162.1419 483.4951 14.04209 475.8256 13.99858 7.669525       19.82777 
1 1 1 -3  2  8  o 277.0063 4.941125 935.4019       33.35429 897.4724       39.78901 1025.057       61.17339 271.2999 6.018349 289.7008 8.674936 -18.40085      10.55817 
1 1 1 -3  2  9  o 246.1166 3.885380 738.3087       23.30293 740.4509       33.02848 736.1854       32.88266 246.4307 5.499936 245.7201 5.491488 0.7105865      7.772113 
1 1 1 -3  2  10 o 401.4305 5.931034 1965.343       58.01989 1977.104       82.36759 1953.760       81.74102 402.4383 8.398872 400.0567 8.384602 2.381592       11.86771 
1 1 1 -3  2  11 o 470.3788 6.873552 2700.025       78.78891 2684.343       111.0099 2715.944       111.8435 468.6519 9.720201 471.4000 9.736097 -2.748108      13.75768 
1 1 1 -3  2  12 f 348.2208 5.236111 1478.890       44.43239 1430.453       61.49455 1531.800       64.27115 342.3082 7.371964 354.2201 7.445721 -11.91190      10.47781 
1 1 1 -3  2  13 o 750.5532 15.30681 6918.439       279.9641 6935.217       396.9042 6901.825       394.9610 748.1373 21.79372 746.3640 21.73854 1.773254       30.78199 
1 1 1 -3  2  14 o 129.4263 2.646485 204.1462       8.346958 209.0443       11.90279 199.4068       11.70837 130.9032 3.735141 127.8464 3.762224 3.056793       5.301472 
1 1 1 -3  2  15 o 442.3110 6.511786 2386.178       70.18816 2408.543       99.87780 2364.357       98.65559 444.1516 9.227874 440.0614 9.199672 4.090179       13.03026 
1 1 1 -3  2  16 o 713.4609 10.25103 6214.946       178.2271 6264.016       253.4120 6166.917       250.7122 715.5317 14.53323 709.9728 14.49098 5.558899       20.52323 
1 1 1 -3  2  17 o 362.7874 5.460178 1604.470       48.27198 1596.353       68.01270 1612.710       68.52396 361.7769 7.714594 363.6248 7.733086 -1.847961      10.92317 
1 1 1 -3  2  18 o 73.45704 2.593672 65.83580       4.635562 70.23124       6.595236 61.54426       6.516818 75.82863 3.579221 70.96168 3.782224 4.866951       5.207306 
1 1 1 -3  2  19 o 599.6844 8.684640 4387.537       126.9143 4541.725       183.7046 4246.748       175.5415 609.7209 12.36383 589.6068 12.21747 20.11414       17.38191 
1 1 1 -3  2  20 o 489.4016 8.280220 2922.167       98.75141 3094.588       177.1700 2844.457       118.9409 502.7521 14.47613 482.6954 10.11165 20.05667       17.65797 
1 1 1 -3  2  21 o 405.5729 6.994518 2006.307       69.12940 1960.823       83.43355 2105.908       123.4662 400.8466 8.541348 414.8954 12.22495 -14.04874      14.91322 
1 1 1 -3  2  22 o 97.17169 2.807314 115.1683       6.640662 106.1346       9.145346 125.2437       9.658259 93.22482 4.035173 101.2901 3.920274 -8.065315      5.625937 
1 1 1 -3  2  23 o 389.0727 5.857137 1846.361       55.53313 1822.335       77.83501 1871.273       79.25568 386.3348 8.267517 391.4838 8.307693 -5.149017      11.72048 
1 1 1 -3  2  24 o 215.0066 4.293075 563.6618       22.49347 565.4732       27.53808 560.0306       38.99008 215.3140 5.248380 214.0277 7.487167 1.286316       9.143476 
1 1 1 -3  2  25 o 274.0109 5.095220 916.0430       34.02255 925.2911       41.85892 898.0404       58.40224 275.2998 6.239448 270.7999 8.861968 4.499878       10.83814 
1 1 1 -3  2  26 o 249.7765 4.796010 761.3193       29.19227 750.8900       50.83831 766.4498       35.65675 247.5256 8.440549 250.5252 5.840557 -2.999542      10.26426 
1 1 1 -3  2  27 o 248.4470 4.119407 753.1752       24.94046 773.8278       35.80051 733.7007       34.76457 251.6485 5.837928 245.0390 5.821912 6.609573       8.244760 
1 1 1 -3  2  28 o 38.93733 4.695806 18.78304       4.365803 17.54175       6.657053 19.71981       5.783130 37.16119 7.607536 39.68432 6.181358 -2.523132      9.802234 
1 1 1 -3  2  29 o 94.14779 2.943633 108.2244       6.745216 106.3420       9.472631 110.1608       9.607144 93.22588 4.180268 94.88973 4.164839 -1.663857      5.900892 
1 1 1 -3  2  30 o 167.5265 3.317843 342.5031       13.54489 347.2535       19.26384 337.8581       19.04870 168.4851 4.696443 166.1867 4.708373 2.298370       6.650215 
1 1 1 -3  2  31 o 115.9141 3.371367 164.1588       9.512985 166.1714       15.77771 163.0093       11.92420 116.3490 5.581020 115.4148 4.246908 0.9341354      7.013131 
1 1 1 -3  2  32 o 111.6629 3.472480 152.4214       9.437493 147.0182       11.57430 163.1398       16.30186 109.5619 4.343708 115.1921 5.826276 -5.630119      7.267275 
1 1 1 -3  2  33 o 91.64079 3.067784 102.6512       6.841275 112.9076       9.883550 93.21692       9.479164 95.98140 4.236048 87.16175 4.477814 8.819649       6.164002 
1 1 1 -3  2  34 o 181.9713 3.514677 404.7142       15.58563 429.0355       22.60318 382.6691       21.51955 187.0091 4.964265 176.5976 5.005537 10.41153       7.049775 
1 1 1 -3  2  35 o 133.6419 3.725827 218.6383       12.12209 230.5340       14.94705 195.7794       20.71997 137.0906 4.480178 125.7673 6.785731 11.32335       8.131307 
1 1 1 -3  2  36 f 133.1187 3.240520 216.6512       10.51211 221.3065       14.78342 211.8900       14.95073 134.2504 4.525270 131.3248 4.679227 2.925568       6.509473 
1 1 1 -3  2  37 o 32.28481 7.453053 13.46933       5.744955 34.57024       11.42134 6.322296       6.647057 51.67361 9.416952 24.32657 8.768936 27.34704       12.86753 
1 1 1 -3  2  38 o 106.8632 3.206958 139.8996       8.341914 137.6140       11.62391 142.3270       11.97858 105.7034 4.523060 107.4859 4.583698 -1.782555      6.439593 
1 1 1 -3  2  39 o 37.80478 5.264523 18.00046       4.718613 17.52639       6.412454 18.56030       6.968414 36.76454 7.413652 37.75253 7.831458 -0.9879913     10.78397 
1 1 1 -3  2  40 o 73.59661 3.449081 66.68004       6.168614 64.01311       8.468623 69.69443       9.003389 71.74004 4.873047 74.84087 4.964701 -3.100838      6.956640 
1 1 1 -3  2  41 o 51.63032 4.497378 33.30563       5.602076 32.56453       8.760739 33.81829       7.286489 50.01966 7.411162 51.57777 5.903455 -1.558113      9.475024 
1 1 1 -3  2  42 o 13.74765 6.069045 -0.8989422     3.982009 -1.906084      4.848370 1.188513       6.980055 14.52775 6.535375 19.67109 8.355332 -5.143331      10.60767 
1 1 1 -3  2  43 o 78.07259 3.339964 75.72075       6.339746 82.34370       8.997845 69.19144       8.934005 80.74252 4.591918 73.75014 5.000612 6.992386       6.789097 
1 1 1 -3  2  44 o 23.89295 6.547307 7.845445       3.924493 9.827117       5.584158 5.911431       5.516602 26.32069 7.999434 21.75245 7.966850 4.568237       11.28989 
1 1 1 -3  2  45 o 41.62997 5.515724 23.21402       5.458023 21.40573       6.260884 28.93949       11.14056 39.05801 6.826296 41.49164 10.88474 -2.433632      12.84818 
1 1 1 -3  2  46 o 22.43357 7.392950 7.523698       4.685351 10.32128       8.875558 6.442905       5.516654 25.10695 9.883183 21.24335 7.932808 3.863602       12.67307 
1 1 1 -3  2  47 o 20.89218 6.692319 6.689188       3.854389 6.298730       5.349015 7.110890       5.558901 20.30937 7.760051 21.15699 7.950177 -0.8476219     11.10962 
1 1 1 -3  2  48 o 22.97749 6.813935 8.613254       4.088780 14.03258       5.774890 3.165620       5.789955 28.09985 8.031736 17.14907 7.449983 10.95078       10.95496 
1 1 1 -3  2  49 o 19.58934 6.772851 6.569738       3.932897 10.61998       5.542046 2.460767       5.582083 23.24915 8.039811 15.93871 7.102585 7.310444       10.72778 
1 1 1 -3  2  50 o 34.10699 6.304295 19.44673       5.046853 11.71044       8.218802 24.12968       6.394428 20.68287 8.930706 36.00927 7.529650 -15.32640      11.68132 
1 1 1 -3  2  51 o 17.34528 6.782922 6.050337       4.157120 5.450079       5.173662 7.143991       6.983433 16.46395 7.097186 17.26600 7.798415 -0.8020515     10.54445 
1 1 1 -3  2  52 o 17.34829 6.542769 6.280000       3.772516 10.90144       5.261421 1.390152       5.412054 20.62860 7.738129 13.47987 6.353460 7.148729       10.01225 
1 1 1 -3  3  1  o 926.8190 11.81805 10490.83       266.9174 10443.06       343.6538 10563.48       423.7688 923.9872 15.26227 928.3868 18.73113 -4.399658      24.16179 
1 1 1 -3  3  2  o 399.0431 5.882480 1941.318       57.20267 1935.137       80.59904 1947.592       81.19785 398.2929 8.304073 399.5706 8.339018 -1.277679      11.76847 
1 1 1 -3  3  3  o 831.7135 11.87686 8448.440       240.7195 8342.324       337.4926 8558.331       343.4430 825.5078 16.77672 836.1083 16.85606 -10.60052      23.78203 
1 1 1 -3  3  4  o 534.0503 7.725794 3478.593       100.5452 3491.470       142.5778 3465.854       141.8101 534.7699 10.94079 532.8064 10.92199 1.963501       15.45933 
1 1 1 -3  3  5  o 936.4642 13.36235 10717.27       304.9369 10929.98       436.6540 10514.78       426.0339 944.2827 18.97577 926.2032 18.87564 18.07953       26.76508 
1 1 1 -3  3  6  f 1712.795 24.48442 36124.33       1021.954 35589.47       1431.589 36680.12       1459.332 1691.100 34.73865 1716.666 34.88448 -25.56580      49.23109 
1 1 1 -3  3  7  o 474.9534 9.794301 2753.604       113.3602 2747.044       159.7881 2760.250       160.8482 473.7546 13.85548 474.8839 13.91430 -1.129242      19.63624 
1 1 1 -3  3  8  o 408.1458 6.014860 2031.273       59.82420 1985.627       83.38065 2079.700       85.88321 403.3816 8.482289 412.8226 8.537067 -9.440948      12.03456 
1 1 1 -3  3  9  o 582.2941 8.407397 4138.418       119.2999 4142.293       168.8528 4134.556       168.5785 582.0666 11.90418 581.5240 11.89593 0.5425415      16.82922 
1 1 1 -3  3  10 o 100.4011 2.323825 122.8431       5.685624 124.3836       8.093494 121.3420       7.988899 100.9672 3.293831 99.72380 3.291907 1.243393       4.656820 
1 1 1 -3  3  11 f 139.1336 2.682964 235.9249       9.096679 241.8885       13.02821 230.2516       12.70710 140.8129 3.800171 137.3815 3.799260 3.431396       5.373609 
1 1 1 -3  3  12 o 248.5732 4.547575 753.4067       27.54674 771.4517       34.28905 720.5631       46.25953 251.4855 5.595081 242.7967 7.828715 8.688873       9.622563 
1 1 1 -3  3  13 o 237.4001 4.429932 687.1470       25.62797 674.5601       44.34368 693.4598       31.40376 234.9314 7.756223 238.4504 5.404399 -3.519012      9.453387 
1 1 1 -3  3  14 o 293.9303 4.539433 1053.290       32.51487 1056.118       46.05426 1050.479       45.91202 294.2389 6.422937 293.4524 6.420259 0.7864685      9.081511 
1 1 1 -3  3  15 o 601.3622 8.694777 4413.944       127.4180 4456.892       181.5170 4372.224       178.9039 603.7542 12.33733 598.0020 12.27668 5.752136       17.40479 
1 1 1 -3  3  16 f 590.4650 8.545468 4253.950       122.9607 4321.042       175.7571 4189.631       172.0862 594.6883 12.12795 585.5849 12.05925 9.103394       17.10300 
1 1 1 -3  3  17 o 478.0620 7.010083 2786.975       81.66640 2728.337       113.9852 2848.823       117.0637 472.8126 9.892898 483.1357 9.942993 -10.32309      14.02614 
1 1 1 -3  3  18 o 724.4996 10.40992 6407.100       183.7900 6404.771       259.8641 6409.432       259.9724 723.7175 14.73469 723.9807 14.73548 -0.2631226     20.83856 
1 1 1 -3  3  19 o 223.6266 4.278685 609.5271       23.31684 627.6292       40.38087 600.4727       28.55898 226.7349 7.317967 221.9407 5.280436 4.794235       9.024170 
1 1 1 -3  3  20 o 599.0249 8.680475 4378.552       126.7140 4360.258       178.6830 4397.059       179.7227 597.3365 12.27519 599.8491 12.29490 -2.512573      17.37368 
1 1 1 -3  3  21 o 158.3985 3.580888 305.7944       13.82222 306.4022       16.89058 304.5623       24.04969 158.4845 4.377619 157.9099 6.262190 0.5746460      7.640587 
1 1 1 -3  3  22 o 199.9044 3.522317 487.0668       17.15880 480.1405       24.03418 494.2672       24.50509 198.3845 4.975405 201.3444 4.994370 -2.959915      7.049708 
1 1 1 -3  3  23 f 189.1523 3.965607 436.1555       18.27921 418.0843       21.87598 477.9625       33.27343 185.1062 4.853838 197.7915 6.913886 -12.68529      8.447577 
1 1 1 -3  3  24 o 63.74522 3.701755 49.70485       5.725574 47.16864       7.026102 54.71828       9.878474 62.01572 4.683806 66.68169 6.148401 -4.665966      7.729222 
1 1 1 -3  3  25 o 388.3583 5.864777 1841.014       55.50348 1818.642       77.83096 1864.165       79.17382 385.6451 8.281872 390.4351 8.321405 -4.790009      11.74032 
1 1 1 -3  3  26 f 165.7221 3.804264 334.9604       15.36339 344.8510       27.91944 330.6648       18.39965 167.8291 6.840918 164.5553 4.592896 3.273834       8.239712 
1 1 1 -3  3  27 o 294.1791 4.673430 1056.463       33.50300 1047.981       47.12802 1065.128       47.63687 292.7190 6.606816 295.1010 6.624247 -2.381989      9.355783 
1 1 1 -3  3  28 o 300.0291 4.754455 1099.501       34.76163 1147.474       50.43323 1056.083       47.97927 306.1225 6.760603 293.6911 6.703888 12.43140       9.520917 
1 1 1 -3  3  29 o 174.9378 3.819170 373.5825       16.28129 400.3746       28.28265 360.3033       19.91140 180.6794 6.433825 171.6458 4.764891 9.033600       8.006141 
1 1 1 -3  3  30 o 123.5076 3.003592 186.1089       9.040047 186.7068       12.79152 185.5123       12.77761 123.5511 4.254885 123.1538 4.264041 0.3973465      6.023794 
1 1 1 -3  3  31 o 121.5240 3.408492 180.4353       10.08396 173.1844       16.44177 184.8074       12.76711 118.7608 5.697811 122.8936 4.269601 -4.132805      7.120010 
1 1 1 -3  3  32 o 37.89797 4.817725 17.85777       4.348899 17.61309       5.474145 18.27642       7.160590 37.39053 6.226722 37.79689 8.022671 -0.4063606     10.15556 
1 1 1 -3  3  33 o 85.79498 3.070265 89.98914       6.408746 87.58049       8.913391 92.56698       9.221109 84.49438 4.343492 86.86904 4.369976 -2.374664      6.161380 
1 1 1 -3  3  34 o 39.14619 4.691813 19.03952       4.386694 21.78968       6.051929 15.99503       6.367542 41.65704 6.146086 35.31441 7.622878 6.342628       9.791968 
1 1 1 -3  3  35 o 136.7931 3.715125 229.0652       12.37290 232.0742       14.96019 222.5517       22.01110 137.5468 4.469177 134.1138 6.756680 3.432953       8.101004 
1 1 1 -3  3  36 o 50.65021 4.021255 31.61835       4.922686 28.38346       6.699276 35.41497       7.257662 47.64465 5.895700 53.34213 5.670061 -5.697479      8.179785 
1 1 1 -3  3  37 o 192.3649 4.328265 454.1325       20.28971 474.4720       37.04601 445.4171       24.25022 194.9074 7.815530 190.1237 5.239109 4.783691       9.409080 
1 1 1 -3  3  38 o 16.45503 6.628178 1.581296       4.083025 1.418706       5.580476 1.768610       5.989763 18.51977 7.638830 19.37160 7.943951 -0.8518276     11.02080 
1 1 1 -3  3  39 o 93.30785 3.232934 106.8246       7.339973 101.7818       10.10268 112.4624       10.68213 90.75674 4.582782 95.40359 4.608326 -4.646851      6.499121 
1 1 1 -3  3  40 o 62.65414 3.667176 48.44269       5.574613 46.64241       7.644834 50.48696       8.146437 61.08979 5.184183 63.53577 5.310062 -2.445976      7.421085 
1 1 1 -3  3  41 o 39.29684 5.397728 19.64697       5.032549 18.35487       7.560062 20.67514       6.743864 36.91758 8.568845 39.71209 7.235152 -2.794510      11.21484 
1 1 1 -3  3  42 o 68.92545 3.513766 58.90399       5.882382 58.50256       8.058619 59.36184       8.606245 68.14503 4.885188 68.50072 5.194356 -0.3556900     7.130666 
1 1 1 -3  3  43 o 56.50570 3.835364 40.00370       5.249930 44.55761       7.114111 34.55813       7.779469 59.10412 4.985767 51.28238 6.361406 7.821743       8.082411 
1 1 1 -3  3  44 o 26.10850 6.502117 9.389828       4.121120 12.17511       5.567307 6.013681       6.129451 29.24446 7.705533 22.18132 8.345400 7.063137       11.35874 
1 1 1 -3  3  45 o 22.29974 6.768941 7.028116       4.000047 7.869624       5.472684 6.062915       5.861112 23.39814 7.993023 21.56650 8.150434 1.831636       11.41569 
1 1 1 -3  3  46 o 45.90083 5.250896 28.61429       5.767832 53.81512       12.01139 21.06172       6.575570 58.42766 8.701070 37.42286 7.472210 21.00481       11.46920 
1 1 1 -3  3  47 o 23.39549 6.648734 8.461135       3.968592 7.306573       5.526317 9.690578       5.702712 21.30291 7.942787 23.85672 8.159032 -2.553810      11.38673 
1 1 1 -3  3  48 f 18.72023 6.707501 5.505195       3.882532 4.237875       5.438246 6.822645       5.544762 17.75754 7.449652 20.08884 7.840041 -2.331306      10.81497 
1 1 1 -3  3  49 o 14.93788 6.246793 2.671739       3.805354 3.872743       5.376440 1.466127       5.386742 16.78788 7.235863 15.13395 6.840988 1.653923       9.957752 
1 1 1 -3  3  50 o 15.73349 6.424819 3.949044       3.897353 1.326460       5.368557 6.871231       5.666917 14.41693 6.635053 18.30557 7.636739 -3.888641      10.11651 
1 1 1 -3  3  51 o 14.06153 6.161406 2.674036       4.034095 0.6000982      5.020536 6.452769       6.776810 13.26364 6.209590 16.88016 7.647466 -3.616520      9.851027 
1 1 1 -3  3  52 o 10.98649 5.180016 -0.7601783     3.603057 1.145793       4.983880 -2.846985      5.214954 13.14211 6.163651 11.55947 5.643409 1.582641       8.356953 
1 1 1 -3  4  1  o 145.5457 2.204380 258.1309       7.818471 266.2308       11.21707 250.4774       10.90357 147.8056 3.114242 143.3659 3.120950 4.439697       4.408949 
1 1 1 -3  4  2  o 944.4542 12.04550 10894.82       277.2310 11035.02       441.8054 10803.77       356.0543 948.7721 19.10878 939.7421 15.54789 9.029968       24.63498 
1 1 1 -3  4  3  o 229.2193 3.667079 640.3329       20.48366 633.5231       28.80277 647.3016       29.13664 227.9716 5.184627 230.4372 5.188607 -2.465637      7.334984 
1 1 1 -3  4  4  o 722.1319 10.34617 6365.342       182.0674 6325.693       256.4258 6405.651       258.5517 719.2325 14.63040 723.7587 14.65945 -4.526245      20.71106 
1 1 1 -3  4  5  o 812.2837 11.61224 8058.459       229.8582 8038.642       324.6603 8078.377       325.4784 810.3202 16.44131 812.3203 16.44216 -2.000061      23.25212 
1 1 1 -3  4  6  o 384.0382 6.578456 1798.483       61.56508 1776.609       74.77608 1844.513       108.4715 381.6193 8.040745 388.4330 11.47202 -6.813660      14.00931 
1 1 1 -3  4  7  o 521.6686 10.71531 3323.586       136.2183 3220.230       188.3115 3437.028       197.2852 512.6888 15.08898 529.6395 15.30149 -16.95068      21.48983 
1 1 1 -3  4  8  o 292.7764 4.490340 1044.907       32.03696 1027.089       44.79045 1063.571       45.84206 290.2035 6.333542 295.3110 6.370132 -5.107483      8.982892 
1 1 1 -3  4  9  o 498.9660 7.263900 3037.737       88.32363 3119.893       127.1735 2961.184       122.7603 505.3109 10.32766 492.3031 10.23267 13.00772       14.53851 
1 1 1 -3  4  10 o 229.3224 3.700700 641.0421       20.68076 642.0502       29.31922 640.0438       29.17533 229.4527 5.243522 229.0946 5.225945 0.3581390      7.403042 
1 1 1 -3  4  11 o 308.5325 4.711045 1160.750       35.42046 1173.161       50.42943 1148.664       49.76146 310.0588 6.674271 306.8059 6.655694 3.252960       9.425717 
1 1 1 -3  4  12 o 64.00195 2.538305 50.00009       3.951036 48.97096       4.930627 51.84661       6.604556 63.30438 3.206632 65.07757 4.186842 -1.773186      5.273721 
1 1 1 -3  4  13 o 417.6339 7.142681 2128.575       72.69308 2005.202       121.6138 2197.159       90.67455 404.5245 12.35125 424.1372 8.772895 -19.61267      15.14982 
1 1 1 -3  4  14 o 157.7771 2.926448 303.3832       11.25177 304.9036       15.93769 301.8725       15.88725 158.1001 4.140295 157.3114 4.147932 0.7886963      5.860663 
1 1 1 -3  4  15 o 753.6605 10.81429 6938.091       198.6141 7068.201       284.5443 6814.468       277.3590 759.7307 15.36930 745.9971 15.25700 13.73364       21.65621 
1 1 1 -3  4  16 o 374.6336 5.614234 1711.064       51.25467 1654.584       70.98460 1772.584       74.08484 368.2959 7.909175 381.1990 7.975198 -12.90314      11.23205 
1 1 1 -3  4  17 o 245.6379 3.967508 735.3758       23.74922 718.1982       33.14190 753.5070       34.04941 242.7208 5.603178 248.6152 5.620122 -5.894485      7.936080 
1 1 1 -3  4  18 o 276.1259 4.355251 929.3047       29.30600 926.8220       41.36987 931.8056       41.52042 275.7132 6.157301 276.4534 6.163165 -0.7401428     8.711885 
1 1 1 -3  4  19 o 875.4542 14.47803 9373.570       308.8724 10037.80       560.4811 9083.867       370.1511 902.0347 25.52340 861.0371 17.64091 40.99762       31.02653 
1 1 1 -3  4  20 o 64.42168 2.880702 50.67676       4.510935 50.51548       6.262107 50.85071       6.503595 64.25285 4.019509 64.45670 4.162726 -0.2038574     5.786600 
1 1 1 -3  4  21 o 540.9044 9.117702 3571.548       120.1827 3582.893       147.4543 3549.097       207.4297 541.5098 11.17416 537.9628 15.84003 3.546997       19.38474 
1 1 1 -3  4  22 o 305.8187 4.785743 1140.241       35.66560 1106.599       49.43113 1176.773       51.51065 301.1843 6.734915 310.5832 6.805859 -9.398956      9.574904 
1 1 1 -3  4  23 o 179.4717 3.331558 392.6041       14.57067 403.8073       20.85353 381.9174       20.36716 181.9209 4.707886 176.9169 4.728405 5.004013       6.672481 
1 1 1 -3  4  24 o 160.8737 3.652746 315.5148       14.31992 301.7864       17.17880 346.7765       25.92323 157.2487 4.487602 168.4429 6.326635 -11.19426      7.756602 
1 1 1 -3  4  25 o 402.5428 6.051894 1978.360       59.36623 1978.352       83.95737 1978.367       83.95567 402.1358 8.567418 402.1374 8.567212 -0.1556396E-02 12.11601 
1 1 1 -3  4  26 o 251.5868 4.829474 772.4984       29.60900 822.7967       54.03044 750.9100       35.39738 259.0508 8.570688 247.9503 5.858285 11.10054       10.38153 
1 1 1 -3  4  27 o 175.7869 3.341305 376.8922       14.31327 372.8114       20.08174 381.1059       20.40619 174.6815 4.721901 176.6129 4.745665 -1.931458      6.694602 
1 1 1 -3  4  28 f 230.0228 3.923104 645.7931       21.99058 638.7729       30.92261 652.9761       31.27921 228.5726 5.551570 231.0995 5.554190 -2.526840      7.852958 
1 1 1 -3  4  29 f 55.54085 3.336814 37.77649       4.495451 34.21942       6.052014 42.15498       6.714532 52.70359 4.763574 58.54264 4.747300 -5.839050      6.725214 
1 1 1 -3  4  30 o 122.1233 3.396225 182.1729       10.09739 186.8653       16.77296 179.5057       12.64556 123.4278 5.591004 121.1353 4.290595 2.292465       7.047591 
1 1 1 -3  4  31 o 76.86592 3.059356 72.22011       5.719151 66.96167       7.778994 78.40612       8.437248 73.88674 4.339474 79.97100 4.345774 -6.084259      6.141399 
1 1 1 -3  4  32 o 68.43135 3.209038 57.29864       5.336478 53.66825       7.181576 61.77482       7.974370 66.08633 4.485944 70.90360 4.640721 -4.817276      6.454455 
1 1 1 -3  4  33 o 154.2054 3.759413 290.6602       14.12719 291.6680       17.34285 288.6725       24.35525 154.2800 4.618106 153.0491 6.545300 1.230835       8.010485 
1 1 1 -3  4  34 o 163.9631 3.360943 328.5156       13.42899 335.3783       19.04260 321.7260       18.94073 165.3661 4.730316 161.9458 4.804756 3.420303       6.742519 
1 1 1 -3  4  35 o 78.23466 3.727723 75.04424       7.086435 75.51607       8.441513 73.91819       13.04094 78.37947 4.437718 77.03529 7.023950 1.344177       8.308383 
1 1 1 -3  4  36 o 158.6143 3.369311 307.7003       13.02326 324.8714       18.69542 291.5129       18.15194 162.6182 4.722699 154.0031 4.842813 8.615097       6.764371 
1 1 1 -3  4  37 o 12.53549 5.920337 -5.346829      4.743047 -3.055681      9.026851 -6.220621      5.574597 20.28334 9.035761 13.60239 6.422449 6.680954       11.08570 
1 1 1 -3  4  38 o 96.52888 3.202799 114.1874       7.523523 110.8335       10.32697 117.9809       10.98305 94.83829 4.481083 97.82077 4.620458 -2.982475      6.436516 
1 1 1 -3  4  39 o 25.78772 6.540334 8.614531       4.115508 12.70202       5.711126 4.199134       5.935788 31.17981 7.589089 21.41881 8.176896 9.760998       11.15598 
1 1 1 -3  4  40 o 45.29398 4.887628 25.70492       5.309470 24.33959       7.981124 26.78889       7.111363 43.14778 7.880789 45.76489 6.564202 -2.617107      10.25649 
1 1 1 -3  4  41 o 82.42078 3.245674 83.72276       6.506207 88.50810       9.190795 78.91575       9.211573 84.31522 4.489306 79.48909 4.777483 4.826134       6.555778 
1 1 1 -3  4  42 o 41.33316 4.459564 21.56209       4.420851 22.27223       6.033356 20.73878       6.496339 41.39169 6.169692 39.57457 6.991853 1.817123       9.324758 
1 1 1 -3  4  43 o 68.69521 3.837690 59.08435       6.398860 53.82574       7.693446 70.88654       11.52569 65.01405 4.891868 73.49221 6.502638 -8.478157      8.137239 
1 1 1 -3  4  44 o 38.45614 5.634182 19.60267       5.123409 17.37878       5.913077 26.30086       10.26207 35.35698 7.109525 41.18739 10.26214 -5.830414      12.48427 
1 1 1 -3  4  45 o 29.11321 6.035873 11.75506       4.141496 11.77650       5.411793 11.72476       6.433826 28.19232 7.673457 27.62884 8.620747 0.5634804      11.54120 
1 1 1 -3  4  46 o 34.18668 5.134024 15.93768       4.145098 16.77064       5.422096 14.76625       6.430054 33.78367 6.821304 30.22236 8.419217 3.561308       10.83575 
1 1 1 -3  4  47 o 14.63550 6.105560 1.848239       3.622196 2.484451       4.919685 1.095076       5.352795 16.45863 7.003588 15.80010 7.002836 0.6585302      9.904037 
1 1 1 -3  4  48 o 16.96884 6.535702 4.140829       3.814962 2.626387       5.309080 5.757646       5.485590 16.38787 7.126457 19.03929 7.677918 -2.651419      10.47553 
1 1 1 -3  4  49 o 13.50569 6.095407 0.5434403      4.256997 6.675851       6.567440 -3.900183      5.590480 18.96750 8.082225 12.59632 6.076848 6.371174       10.11190 
1 1 1 -3  4  50 o 13.07479 5.826370 1.190458       3.756295 3.381897       5.242246 -1.121993      5.385039 15.58467 6.917517 13.12497 6.230929 2.459695       9.310022 
1 1 1 -3  4  51 o 12.17211 5.528157 0.7164405      3.567949 6.023763       4.966053 -4.946221      5.129605 16.90115 7.106400 11.00687 5.418857 5.894281       8.936718 
1 1 1 -3  5  1  o 138.2461 2.364297 232.8913       7.965098 248.9201       10.59592 212.0659       12.07768 142.9199 3.042354 131.8571 3.762600 11.06282       4.838706 
1 1 1 -3  5  2  o 316.6062 4.294915 1221.749       33.13676 1267.036       53.56811 1193.678       42.17413 322.3433 6.819485 312.9154 5.530739 9.427917       8.780344 
1 1 1 -3  5  3  o 744.0569 9.534302 6756.273       172.8746 6537.439       267.1152 6913.997       226.7720 731.0550 14.99383 752.2845 12.37004 -21.22955      19.43792 
1 1 1 -3  5  4  o 406.0110 6.923202 2010.283       68.49847 1964.904       82.63837 2109.915       122.4487 401.3173 8.450019 415.4060 12.10902 -14.08871      14.76588 
1 1 1 -3  5  5  o 1048.067 17.28184 13459.63       441.3825 13607.76       544.6678 13176.27       753.3174 1052.309 21.23989 1030.731 30.02339 21.57861       36.77685 
1 1 1 -3  5  6  o 362.0062 7.645056 1598.645       67.44235 1652.707       97.17422 1548.404       93.67764 367.6961 10.85680 355.8986 10.81378 11.79752       15.32344 
1 1 1 -3  5  7  o 395.7702 5.859971 1909.964       56.51643 1990.927       82.20008 1837.378       77.83133 403.9121 8.351207 388.0325 8.230954 15.87961       11.72567 
1 1 1 -3  5  8  o 208.5343 3.443822 530.0185       17.50065 528.9312       24.77532 531.1013       24.72408 208.2888 4.881094 208.7161 4.861027 -0.4273529     6.888735 
1 1 1 -3  5  9  o 254.8918 4.019435 791.9983       24.96646 807.4694       35.75671 777.2803       34.87558 257.3074 5.702552 252.4530 5.668980 4.854416       8.040922 
1 1 1 -3  5  10 o 35.99550 2.423381 15.86170       2.113332 15.05015       3.040988 16.61975       2.939025 34.95070 3.622932 36.77691 3.314924 -1.826210      4.910637 
1 1 1 -3  5  11 o 396.3337 6.781966 1917.020       65.50172 1890.420       79.64574 1972.611       115.1395 393.4162 8.307574 401.2175 11.78907 -7.801300      14.42213 
1 1 1 -3  5  12 o 374.3588 5.590231 1709.372       50.99809 1674.905       71.23814 1745.605       73.03998 370.3729 7.892913 378.1057 7.927045 -7.732819      11.18643 
1 1 1 -3  5  13 o 317.4063 5.611189 1228.673       43.40168 1208.899       74.96090 1238.644       53.23178 314.3950 9.796103 318.6196 6.855868 -4.224548      11.95686 
1 1 1 -3  5  14 f 507.5356 7.399829 3142.743       91.52174 3108.308       128.5344 3178.156       130.3472 504.4178 10.45666 510.0499 10.48704 -5.632111      14.80945 
1 1 1 -3  5  15 o 323.2434 4.931226 1273.720       38.84371 1279.525       55.10293 1267.986       54.76523 323.9012 6.981136 322.4379 6.969840 1.463287       9.864833 
1 1 1 -3  5  16 o 561.3648 8.148854 3844.065       111.4751 3872.329       158.5207 3816.414       156.7927 563.1016 11.55216 559.0260 11.50953 4.075562       16.30711 
1 1 1 -3  5  17 o 341.9674 5.192781 1425.500       43.27338 1426.521       61.29192 1424.486       61.10411 342.0139 7.353996 341.7706 7.336682 0.2432861      10.38789 
1 1 1 -3  5  18 o 712.0427 11.81989 6192.247       205.0952 6458.043       364.9149 6069.518       247.9651 725.1099 20.67260 704.5397 14.44272 20.57013       25.21802 
1 1 1 -3  5  19 o 465.0799 6.858192 2637.775       77.72725 2745.001       113.0687 2541.703       107.0259 474.2260 9.784104 456.3403 9.624184 17.88568       13.72420 
1 1 1 -3  5  20 f 451.4065 6.673317 2485.055       73.40839 2522.924       104.7776 2448.547       102.8787 454.6249 9.457561 447.8762 9.426088 6.748718       13.35277 
1 1 1 -3  5  21 o 779.5147 12.95532 7432.792       246.0982 7239.862       295.8724 7865.941       443.3256 768.6021 15.79672 798.3295 22.81130 -29.72742      27.74692 
1 1 1 -3  5  22 o 436.1306 6.477236 2320.296       68.84024 2327.463       97.55969 2313.188       97.15120 436.5494 9.170667 435.2098 9.160378 1.339630       12.96201 
1 1 1 -3  5  23 o 46.74939 4.036995 26.84239       4.554057 25.26875       5.629631 29.82197       7.746502 45.22113 5.203333 48.98830 6.661413 -3.767162      8.452757 
1 1 1 -3  5  24 o 308.9404 4.830360 1164.149       36.36557 1178.299       51.80607 1150.404       51.05942 310.6492 6.843438 306.9516 6.826056 3.697601       9.665799 
1 1 1 -3  5  25 o 256.2067 4.190410 800.6282       26.16273 820.9931       37.54090 781.3969       36.48123 259.3110 5.940837 252.9825 5.917563 6.328491       8.385172 
1 1 1 -3  5  26 o 19.06295 6.975964 3.555653       4.228313 8.576322       8.748601 2.025417       4.829887 28.42637 10.08122 18.19139 7.249186 10.23498       12.41699 
1 1 1 -3  5  27 o 101.6005 2.875993 125.9751       7.113485 130.5652       10.03170 121.3328       10.08852 103.3622 3.990186 99.62137 4.164834 3.740822       5.767792 
1 1 1 -3  5  28 o 411.9168 6.210733 2076.620       62.34311 2115.370       89.27243 2039.733       87.10063 414.8023 8.831614 407.3424 8.774566 7.459900       12.44951 
1 1 1 -3  5  29 o 241.8105 4.765711 714.6257       28.08270 739.0236       50.73904 703.8513       33.71812 244.9459 8.513276 239.8109 5.769767 5.134918       10.28426 
1 1 1 -3  5  30 o 183.2325 3.921237 410.0411       17.50901 420.0560       29.59021 404.6455       21.71940 184.9508 6.575779 181.8374 4.905976 3.113388       8.204235 
1 1 1 -3  5  31 o 111.3737 2.966913 151.4796       8.045196 154.9933       11.45695 148.0616       11.29992 112.5341 4.185102 109.9808 4.224064 2.553345       5.946242 
1 1 1 -3  5  32 o 86.64827 3.038844 91.76196       6.406659 86.66029       8.839811 97.40661       9.298337 84.06625 4.329629 89.14372 4.292960 -5.077469      6.097147 
1 1 1 -3  5  33 o 50.66650 4.283422 31.63173       5.239183 30.56011       6.150678 34.46503       10.00116 49.66771 5.156706 52.20003 8.126606 -2.532318      9.624622 
1 1 1 -3  5  34 o 156.2437 3.811208 298.5777       14.51113 301.2350       17.72318 293.1734       25.27507 156.7259 4.645629 154.0599 6.748725 2.666031       8.193116 
1 1 1 -3  5  35 o 105.3890 3.089846 135.8261       7.926823 132.3783       11.06743 139.4577       11.35868 103.8494 4.383133 106.5950 4.382097 -2.745621      6.197954 
1 1 1 -3  5  36 o 125.0466 3.186283 191.3051       9.701493 203.5977       13.91275 179.6709       13.53501 128.7594 4.440670 120.9122 4.601993 7.847267       6.395145 
1 1 1 -3  5  37 o 91.42760 3.907337 102.6552       8.685437 115.0060       16.32942 97.78261       10.25660 95.96696 7.031337 89.06078 4.742965 6.906189       8.481475 
1 1 1 -3  5  38 o 81.89925 3.293951 82.27494       6.560640 75.01440       8.926722 90.80308       9.674637 77.91724 4.723535 85.77063 4.646055 -7.853394      6.625527 
1 1 1 -3  5  39 o 50.44919 4.085704 31.51195       4.979985 33.74878       6.997543 29.21635       7.088870 51.86459 5.626575 48.06256 6.196526 3.802029       8.369903 
1 1 1 -3  5  40 o 137.3208 3.723720 232.3049       12.44940 211.5257       19.37840 246.9082       16.24530 129.8096 6.143402 141.1031 4.731182 -11.29350      7.754062 
1 1 1 -3  5  41 o 32.56768 5.645459 13.67402       4.318161 7.329014       5.824775 21.41623       6.434209 24.31412 8.247166 40.55443 6.747592 -16.24031      10.65578 
1 1 1 -3  5  42 o 47.32943 4.206607 28.12313       4.801269 23.51630       6.408943 34.01569       7.248308 42.42460 6.397919 51.40302 5.892863 -8.978420      8.698230 
1 1 1 -3  5  43 o 42.86748 4.748494 23.51384       4.877351 22.72942       6.071288 24.94134       8.190193 41.46671 6.198113 42.29290 8.243104 -0.8261833     10.31336 
1 1 1 -3  5  44 o 12.77426 5.852831 -2.178772      4.113850 1.809044       4.754148 -14.06448      8.207625 16.88834 7.015972 14.01078 6.889224 2.877556       9.832866 
1 1 1 -3  5  45 o 26.14705 6.444258 9.710045       4.079349 16.11361       5.547256 2.168991       6.019817 33.48334 7.023082 18.19064 7.744119 15.29270       10.45443 
1 1 1 -3  5  46 o 13.42847 5.863660 0.2763211      3.625917 0.8599990E-03  4.649448 0.7038915      5.792620 14.64292 6.506227 16.44446 7.286828 -1.801546      9.768769 
1 1 1 -3  5  47 o 11.89512 5.672869 -3.864453      4.567626 -3.138083      8.372454 -4.172252      5.450137 16.27930 7.740155 12.95643 6.183913 3.322868       9.907107 
1 1 1 -3  5  48 o 11.48638 5.334302 -1.547747      3.586872 -3.482586      4.808733 0.8788770      5.385296 12.17149 5.809099 15.19700 6.857518 -3.025512      8.987279 
1 1 1 -3  5  49 o 21.36824 7.308279 8.475088       4.575466 6.937199       7.072138 9.582216       6.000494 19.01275 8.246811 21.44448 8.212766 -2.431738      11.63870 
1 1 1 -3  5  50 o 13.83075 6.003342 2.154747       3.753120 5.911106       5.255602 -1.754379      5.361406 17.41073 7.315038 12.76260 6.102853 4.648135       9.526521 
1 1 1 -3  5  51 o 19.28964 6.648155 7.424926       3.788288 10.92855       5.543759 4.355669       5.188742 20.95420 7.924983 15.54033 6.890828 5.413862       10.50185 
1 1 1 -3  6  1  o 379.2156 5.645090 1753.214       52.16668 1633.287       70.44363 1898.850       77.62820 365.9126 7.900022 394.5302 8.074268 -28.61758      11.29620 
1 1 1 -3  6  2  o 580.1977 8.386040 4107.029       118.5684 4069.664       166.5341 4145.442       168.8521 577.1766 11.84018 582.5184 11.89489 -5.341797      16.78328 
1 1 1 -3  6  3  o 325.3016 4.928323 1289.970       39.06803 1402.390       58.22608 1197.915       52.68902 339.0984 7.046210 313.4101 6.898759 25.68832       9.861134 
1 1 1 -3  6  4  o 422.4569 7.191835 2176.783       74.03860 2210.271       91.58472 2113.617       125.7853 425.5836 8.830842 415.6760 12.43160 9.907593       15.24889 
1 1 1 -3  6  5  o 421.1802 6.207381 2163.183       63.71071 2157.956       89.96051 2168.443       90.24126 420.5010 8.779075 421.5211 8.785162 -1.020050      12.41979 
1 1 1 -3  6  6  o 139.8066 3.760599 238.4048       12.80048 241.4317       18.29226 235.5003       17.91874 140.6176 5.347907 138.8794 5.304358 1.738205       7.532351 
1 1 1 -3  6  7  o 376.9980 5.615473 1733.129       51.58952 1698.865       72.07942 1769.116       73.87075 373.1050 7.927643 380.7386 7.961767 -7.633606      11.23554 
1 1 1 -3  6  8  o 450.5168 6.612639 2476.147       72.59754 2583.796       105.6333 2379.790       99.93996 459.9063 9.425303 441.3928 9.291328 18.51352       13.23500 
1 1 1 -3  6  9  f 211.1185 3.496598 543.2901       17.98904 542.5602       25.45292 544.0186       25.42778 210.9343 4.951701 211.2180 4.940166 -0.2836609     6.994610 
1 1 1 -3  6  10 o 459.3722 6.738735 2575.277       75.43609 2614.242       107.7694 2537.845       105.6283 462.4632 9.562733 455.6633 9.512623 6.799927       13.48836 
1 1 1 -3  6  11 o 115.3807 2.864562 162.2533       8.054296 161.7881       10.05737 163.0851       13.44882 115.1503 3.588508 115.5485 4.786580 -0.3982010     5.982369 
1 1 1 -3  6  12 o 629.8102 10.52422 4849.536       161.5235 4681.292       273.2946 4939.854       200.2387 616.4478 18.21273 635.0978 12.93812 -18.65009      22.34052 
1 1 1 -3  6  13 o 453.1776 7.709230 2506.199       85.13645 2764.033       158.1317 2400.956       101.0287 474.9358 13.67730 443.3989 9.350050 31.53693       16.56780 
1 1 1 -3  6  14 f 481.9604 7.053509 2833.308       82.84240 2822.762       116.9032 2843.945       117.4122 480.8052 9.977485 482.6052 9.983552 -1.799988      14.11458 
1 1 1 -3  6  15 o 422.7234 6.261003 2178.862       64.49651 2048.457       87.62579 2333.035       95.27758 409.7368 8.775882 437.2608 8.941576 -27.52393      12.52868 
1 1 1 -3  6  16 o 287.7009 4.489932 1008.866       31.47872 996.0831       44.21354 1022.008       44.82808 285.8247 6.347744 289.5201 6.353826 -3.695435      8.981367 
1 1 1 -3  6  17 o 525.6394 7.668470 3369.779       98.22742 3223.490       134.9911 3534.403       143.2012 513.8613 10.78011 538.0589 10.92146 -24.19757      15.34566 
1 1 1 -3  6  18 o 209.1424 4.058315 533.1075       20.68349 499.8245       33.85290 552.9328       26.12724 202.3379 6.875654 212.9792 5.034080 -10.64139      8.521536 
1 1 1 -3  6  19 o 634.1119 10.59832 4909.833       163.7718 5037.316       203.9294 4678.272       274.8448 641.9399 13.03615 617.4102 18.28759 24.52972       22.45835 
1 1 1 -3  6  20 o 301.9180 4.713508 1111.190       34.67922 1162.686       50.39736 1064.878       47.79379 308.7605 6.698075 295.4910 6.637294 13.26947       9.429627 
1 1 1 -3  6  21 o 363.9651 6.391657 1615.701       56.69037 1661.092       70.53301 1532.867       95.28154 368.9487 7.844953 353.9881 11.05903 14.96060       13.55896 
1 1 1 -3  6  22 o 406.4487 6.083662 2015.070       60.25691 2070.074       86.69585 1963.667       83.80971 411.7309 8.640697 401.0158 8.576237 10.71506       12.17430 
1 1 1 -3  6  23 o 247.2730 4.678489 745.6101       28.19151 741.7219       34.54922 753.3572       48.76760 246.5764 5.749774 248.2251 8.072864 -1.648727      9.911157 
1 1 1 -3  6  24 o 319.2328 4.962092 1243.190       38.60187 1255.995       54.97484 1230.736       54.21566 320.6803 7.034862 317.4421 7.008484 3.238190       9.930162 
1 1 1 -3  6  25 o 251.3402 4.134826 770.5350       25.32534 788.8675       36.29818 753.1464       35.35147 254.1762 5.860219 248.3565 5.841115 5.819687       8.274103 
1 1 1 -3  6  26 o 416.1928 7.250564 2119.344       73.53642 2126.107       128.8153 2116.073       89.56471 414.8683 12.75667 415.4505 8.846704 -0.5821838     15.52407 
1 1 1 -3  6  27 o 117.1439 2.912399 167.3450       8.313934 175.8319       11.83751 159.0833       11.67944 119.9618 4.055141 114.0860 4.208219 5.875839       5.844081 
1 1 1 -3  6  28 o 75.40612 3.732202 69.56666       6.836853 57.43228       12.41486 74.84845       8.190754 68.00238 7.622768 78.17132 4.316478 -10.16894      8.760056 
1 1 1 -3  6  29 o 41.39678 4.075304 21.12933       4.057895 24.16317       6.122969 18.75318       5.418796 44.04883 5.848544 38.69801 5.935266 5.350822       8.332638 
1 1 1 -3  6  30 o 140.7722 3.117467 241.8240       10.69436 245.0467       15.13730 238.6125       15.11095 141.5336 4.394194 139.6547 4.445840 1.878860       6.250955 
1 1 1 -3  6  31 o 68.64246 3.066586 57.62273       5.116655 58.37664       7.136338 56.82517       7.340047 68.97310 4.266688 68.02527 4.452316 0.9478302      6.166664 
1 1 1 -3  6  32 o 194.2638 3.608187 461.0665       17.08115 463.2902       24.15395 458.8419       24.15884 194.4038 5.102971 193.4617 5.128949 0.9421387      7.235083 
1 1 1 -3  6  33 o 48.88859 4.399772 29.48790       5.185703 29.68811       6.085150 28.95679       9.910891 48.93893 5.181063 47.58195 8.873753 1.356976       10.27555 
1 1 1 -3  6  34 o 174.9806 3.979878 374.6439       16.97054 377.9402       20.82585 368.1292       29.27813 175.4977 4.874343 172.5656 6.976686 2.932068       8.510778 
1 1 1 -3  6  35 o 94.87660 3.126192 110.1214       7.218011 117.9831       10.10874 101.9437       10.30985 98.04640 4.240896 91.05426 4.661910 6.992142       6.302270 
1 1 1 -3  6  36 o 39.74505 4.720554 19.66299       4.482861 15.54191       5.886838 25.35146       6.916306 34.78776 7.182233 44.83604 6.521111 -10.04828      9.700998 
1 1 1 -3  6  37 o 26.63935 7.950143 8.993378       5.552146 -3.203640      10.52195 13.70000       6.536184 21.99278 9.778872 32.46823 8.246505 -10.47545      12.79184 
1 1 1 -3  6  38 o 54.87751 3.827661 37.13295       5.086662 32.72290       6.868060 42.49102       7.570364 51.13972 5.602719 58.40402 5.379499 -7.264294      7.767205 
1 1 1 -3  6  39 o 133.0426 3.248573 217.0508       10.53221 214.0599       14.67338 220.2293       15.12654 131.6327 4.581345 133.4878 4.657231 -1.855118      6.532880 
1 1 1 -3  6  40 o 120.1348 3.258430 177.4324       9.530420 178.2637       13.36021 176.5710       13.59907 119.8965 4.581105 119.2762 4.687766 0.6203003      6.554515 
1 1 1 -3  6  41 o 49.72213 3.999023 30.80807       4.804678 29.83903       6.613635 31.89110       6.991808 48.37434 5.720919 49.98027 5.851191 -1.605930      8.183236 
1 1 1 -3  6  42 o 51.85229 3.975141 33.64135       4.984622 33.67776       6.758709 33.59794       7.380962 51.28214 5.493831 50.95810 6.062504 0.3240356      8.181450 
1 1 1 -3  6  43 o 23.74637 7.873136 7.546926       5.311266 7.546926       5.311266 0.000000       0.000000 23.74637 7.873136 ?        ?        0.000000       7.873136 
1 1 1 -3  6  44 o 16.94439 6.443052 3.083170       3.676153 6.186084       4.995872 -0.5808229     5.428800 21.62899 7.622950 15.86426 7.040688 5.764738       10.37693 
1 1 1 -3  6  45 o 21.95841 6.695154 6.885293       3.907441 6.947572       5.026959 6.790226       6.210827 22.05453 7.655501 22.19342 8.389461 -0.1388893     11.35737 
1 1 1 -3  6  46 o 18.06282 6.597852 4.419337       3.779762 6.800994       5.045018 1.371964       5.706712 21.26608 7.642810 16.73449 7.330551 4.531591       10.59007 
1 1 1 -3  6  47 o 26.59243 7.841532 12.03740       5.427539 9.847803       9.292925 13.17099       6.686491 22.81589 9.663777 26.62680 8.833997 -3.810915      13.09306 
1 1 1 -3  6  48 o 11.58036 5.375789 -1.478136      3.637279 -4.502217      4.943768 2.090486       5.370462 11.85722 5.718857 15.91715 7.036504 -4.059934      9.067398 
1 1 1 -3  6  49 o 25.01081 6.583789 10.65095       4.066835 9.093321       5.566852 12.43369       5.955552 21.12854 7.952352 24.29223 8.337045 -3.163692      11.52155 
1 1 1 -3  6  50 o 17.24803 6.719905 5.553450       4.067981 0.7313914      5.569225 11.06899       5.956244 14.02017 6.556083 21.48236 8.193447 -7.462195      10.49356 
1 1 1 -3  6  51 o 10.37865 4.994355 -2.412418      3.719982 -2.362721      5.234456 -2.463129      5.287645 11.97010 5.800177 11.97534 5.809039 -0.5243301E-02 8.208957 
1 1 1 -3  7  1  o 588.1222 6.940730 4218.689       99.47383 4307.524       142.6624 4134.632       138.7728 593.9791 9.856031 581.9451 9.785568 12.03400       13.88880 
1 1 1 -3  7  2  o 382.0580 4.645908 1779.353       43.25497 1788.650       61.40350 1770.194       60.94262 382.9673 6.579536 380.9872 6.564091 1.980103       9.293954 
1 1 1 -3  7  3  o 547.1270 6.478034 3650.705       86.37090 3782.937       125.1552 3530.463       119.3456 556.6879 9.225733 537.8032 9.106407 18.88470       12.96306 
1 1 1 -3  7  4  o 109.0384 2.198638 144.8814       5.842104 142.7258       9.246449 146.3137       7.537090 108.1580 3.512826 109.5357 2.826017 -1.377716      4.508471 
1 1 1 -3  7  5  o 546.6662 9.156604 3648.662       121.9811 3545.617       207.2160 3703.306       150.8966 537.5769 15.83508 550.4598 11.24910 -12.88293      19.42400 
1 1 1 -3  7  6  o 444.2438 6.530575 2407.351       70.69829 2347.781       98.40331 2470.904       101.6402 438.4684 9.209484 449.8117 9.272539 -11.34329      13.06884 
1 1 1 -3  7  7  o 424.1471 6.258519 2194.548       64.68806 2174.085       91.00919 2215.442       91.96376 421.9193 8.851560 425.9124 8.860543 -3.993103      12.52435 
1 1 1 -3  7  8  f 155.7671 2.892565 295.7169       10.97981 289.1651       15.46517 302.3760       15.59120 153.9549 4.125882 157.4377 4.067227 -3.482758      5.793551 
1 1 1 -3  7  9  o 304.0156 4.669156 1127.005       34.59157 1077.262       47.65012 1182.428       50.29685 297.1199 6.581065 311.2816 6.630576 -14.16171      9.342106 
1 1 1 -3  7  10 o 516.6609 8.686667 3260.840       109.3692 3286.705       134.8660 3211.157       186.9177 518.3677 10.67649 511.1953 15.02100 7.172333       18.42872 
1 1 1 -3  7  11 o 277.3587 4.333488 937.8790       29.28974 920.4811       41.06651 955.8925       41.78679 274.6926 6.134861 279.9270 6.125733 -5.234406      8.669551 
1 1 1 -3  7  12 o 72.91251 2.781286 64.88341       4.932724 74.85812       9.972773 61.65274       5.675604 78.17546 5.265628 71.04684 3.287077 7.128624       6.207392 
1 1 1 -3  7  13 o 116.7099 2.585636 165.9923       7.353789 170.6705       10.62599 161.6923       10.18752 118.2761 3.691205 115.1223 3.635948 3.153839       5.181227 
1 1 1 -3  7  14 o 704.8136 10.14607 6064.785       174.2642 6355.688       254.7641 5808.994       238.8943 720.7747 14.50449 689.1316 14.22550 31.64313       20.31613 
1 1 1 -3  7  15 o 475.1610 6.970250 2753.252       80.70961 2901.688       118.2289 2623.708       110.4491 487.5930 9.950163 463.6632 9.775149 23.92984       13.94845 
1 1 1 -3  7  16 o 826.0572 11.83062 8333.224       238.1517 8559.786       343.0380 8122.429       330.8855 836.2397 16.83353 814.6326 16.66786 21.60712       23.68936 
1 1 1 -3  7  17 o 1015.965 16.75567 12635.83       414.8364 12471.29       711.2712 12720.65       510.6902 1004.196 29.09638 1018.156 20.58292 -13.96075      35.64065 
1 1 1 -3  7  18 o 132.9124 3.341560 215.4264       10.81450 227.3748       13.25808 191.6702       18.69445 136.5276 3.989237 125.2291 6.144681 11.29855       7.326057 
1 1 1 -3  7  19 f 311.1010 4.820587 1179.803       36.54580 1255.948       53.75358 1114.354       49.83565 320.9068 6.873729 302.2812 6.765391 18.62561       9.644618 
1 1 1 -3  7  20 o 164.0844 3.142495 328.1228       12.56544 329.2194       17.71602 327.0126       17.82493 164.2808 4.429347 163.7270 4.471756 0.5537720      6.294102 
1 1 1 -3  7  21 o 215.1791 4.279232 564.4352       22.43892 564.7232       27.26458 563.8305       39.50292 215.2095 5.198777 214.8227 7.557706 0.3867950      9.173124 
1 1 1 -3  7  22 o 94.14171 3.150331 108.1417       7.217091 100.5203       8.797226 123.8292       12.62137 90.71834 3.989125 100.6363 5.163809 -9.918007      6.525186 
1 1 1 -3  7  23 o 252.4354 4.134749 776.9766       25.43522 792.8280       36.35570 761.7790       35.59793 254.9087 5.852641 249.8678 5.846263 5.040909       8.272375 
1 1 1 -3  7  24 o 280.3586 4.478865 958.7242       30.59975 993.9193       44.26415 926.5095       42.34856 285.3042 6.366603 275.4647 6.308651 9.839508       8.962852 
1 1 1 -3  7  25 o 303.0003 4.772324 1120.360       35.23782 1151.535       50.72366 1091.280       48.98919 306.9477 6.781257 298.8163 6.727594 8.131317       9.552276 
1 1 1 -3  7  26 o 107.7746 3.461236 141.8173       9.078630 151.8795       17.51145 138.1187       10.61686 111.2603 6.486843 106.3136 4.105710 4.946671       7.676978 
1 1 1 -3  7  27 o 226.5679 4.542823 626.8301       25.08190 617.5323       44.49118 631.1617       30.36749 224.1940 8.157152 227.2363 5.483970 -3.042343      9.829194 
1 1 1 -3  7  28 o 193.4200 3.525253 456.5452       16.61605 451.3753       23.38394 461.8178       23.61505 192.1066 4.999291 194.3188 4.991117 -2.212112      7.064287 
1 1 1 -3  7  29 o 99.36095 3.243718 120.6001       7.843548 113.9609       12.08982 125.4257       10.30714 96.39120 5.165778 101.2469 4.186570 -4.855652      6.649258 
1 1 1 -3  7  30 o 260.4996 4.305264 829.3323       27.33021 845.1957       39.05371 814.1071       38.26003 262.5808 6.103279 257.7091 6.092274 4.871674       8.623562 
1 1 1 -3  7  31 o 108.0026 2.970713 142.4686       7.811211 140.1337       10.82846 145.0016       11.27874 106.9892 4.161208 108.8220 4.261359 -1.832748      5.956075 
1 1 1 -3  7  32 o 110.6129 2.997783 149.4747       8.073120 147.3725       11.13911 151.8007       11.71704 109.6952 4.174650 111.3122 4.327798 -1.617043      6.013114 
1 1 1 -3  7  33 o 222.1581 5.530949 605.7964       29.94317 605.7964       29.94317 0.000000       0.000000 222.1581 5.530949 ?        ?        0.000000       5.530949 
1 1 1 -3  7  34 o 25.09056 6.138043 8.055810       3.721602 8.716006       5.097008 7.301932       5.446653 26.24469 7.559583 24.61224 7.962054 1.632456       10.97914 
1 1 1 -3  7  35 o 93.47027 3.101920 106.8876       7.055669 99.95689       9.433919 115.6855       10.62910 90.21301 4.303691 97.03030 4.507561 -6.817291      6.232163 
1 1 1 -3  7  36 o 64.54748 3.470770 51.13087       5.439277 51.05077       7.361491 51.22717       8.072129 64.30019 4.731176 64.32524 5.193691 -0.2505493E-01 7.025557 
1 1 1 -3  7  37 o 60.40469 4.627069 45.11214       6.759180 41.74986       12.55845 46.48332       8.019854 56.82442 9.397294 61.15494 5.438097 -4.330521      10.85735 
1 1 1 -3  7  38 o 15.51393 6.331109 1.174327       3.781536 3.886529       5.026701 -2.361920      5.739755 20.15191 7.562666 15.95242 7.148741 4.199493       10.40665 
1 1 1 -3  7  39 o 19.50598 6.996619 4.120826       4.225689 1.317218       6.013308 6.855968       5.939430 18.92177 7.878101 24.13297 8.324086 -5.211208      11.46102 
1 1 1 -3  7  40 o 56.42392 3.720122 39.39475       5.086588 37.78284       6.857340 41.36668       7.584550 54.85499 5.191614 57.31879 5.497267 -2.463799      7.561269 
1 1 1 -3  7  41 o 24.77245 6.621009 8.106008       4.073558 14.33599       5.471699 0.3596729      6.101362 32.86473 7.043869 18.05139 7.743329 14.81335       10.46782 
1 1 1 -3  7  42 o 54.60928 3.829595 37.26640       5.063997 41.43351       6.980725 32.63765       7.357249 57.07529 5.071747 50.10577 6.154614 6.969524       7.975080 
1 1 1 -3  7  43 o 26.16424 7.891654 9.546472       5.449148 9.546472       5.449148 0.000000       0.000000 26.16424 7.891654 ?        ?        0.000000       7.891654 
1 1 1 -3  7  44 o 24.97751 6.349451 8.669380       3.872514 10.79790       5.114090 5.808526       5.928938 27.40778 7.459204 21.61212 8.190698 5.795654       11.07823 
1 1 1 -3  7  45 o 48.72364 4.110662 30.73759       4.835275 36.23905       6.510941 23.97237       7.220143 52.03986 5.203908 40.24401 7.641597 11.79586       9.245251 
1 1 1 -3  7  46 o 21.76100 6.651960 7.117195       3.853959 8.736547       5.225929 5.186427       5.706345 23.39534 7.811093 19.67012 7.865796 3.725222       11.08530 
1 1 1 -3  7  47 o 33.68855 7.003711 17.91424       5.561948 18.49167       10.26033 17.67394       6.618806 28.01366 10.73663 31.63713 8.432469 -3.623474      13.65217 
1 1 1 -3  7  48 f 12.55966 5.766586 -0.7642984     4.021958 -1.939371      5.883696 0.2664157      5.510448 14.00462 6.608034 14.79869 6.777927 -0.7940636     9.466066 
1 1 1 -3  7  49 o 15.33898 6.263161 3.344241       3.703290 5.727108       5.302416 1.075032       5.174415 17.90067 7.420639 14.46236 6.602700 3.438307       9.932851 
1 1 1 -3  7  50 o 15.56452 6.377210 4.056650       3.855865 4.072819       5.484636 4.040849       5.421938 15.83570 7.049523 15.80230 7.023400 0.3340721E-01  9.951077 
1 1 1 -3  7  51 o 16.47346 6.874420 5.660856       4.593982 7.416497       5.631388 2.167951       7.943117 17.50098 7.471520 14.86721 7.189789 2.633770       10.36903 
1 1 1 -3  8  1  o 191.1337 3.280817 445.2417       15.28113 427.3310       29.68713 451.6978       17.82374 187.0633 6.522417 192.5057 3.799435 -5.442444      7.548352 
1 1 1 -3  8  2  o 228.5162 3.737082 636.4897       20.81065 637.3058       29.46771 635.6776       29.39384 228.6228 5.289210 228.3307 5.282700 0.2920380      7.475470 
1 1 1 -3  8  3  o 279.0627 3.891034 949.2458       26.46080 916.2811       33.44949 1004.372       43.25576 274.1394 5.007049 286.9663 6.185530 -12.82690      7.958097 
1 1 1 -3  8  4  o 339.7579 5.135062 1407.520       42.51589 1441.761       86.38553 1396.574       48.84064 343.3388 10.33658 338.3944 5.922732 4.944366       11.91317 
1 1 1 -3  8  5  o 317.5641 4.847774 1229.607       37.51543 1240.383       53.40085 1219.105       52.71545 318.8426 6.872832 316.0979 6.843531 2.744690       9.698956 
1 1 1 -3  8  6  f 444.6219 6.548048 2412.018       70.94778 2315.322       97.84081 2519.245       103.0309 435.3264 9.222932 454.0810 9.311039 -18.75458      13.10564 
1 1 1 -3  8  7  o 226.7588 3.709066 626.8057       20.49579 635.1602       29.29027 618.7901       28.68991 228.2120 5.266825 225.2535 5.226628 2.958481       7.420046 
1 1 1 -3  8  8  o 60.32732 2.390871 44.42238       3.507885 46.98639       5.158801 42.21727       4.784153 61.99147 3.428271 58.75581 3.355269 3.235661       4.796965 
1 1 1 -3  8  9  o 261.5767 4.766221 834.3278       30.38151 830.0194       37.31731 842.7973       52.32154 260.8488 5.870640 262.5783 8.186844 -1.729523      10.07417 
1 1 1 -3  8  10 o 472.3671 7.992285 2724.189       91.99976 2690.433       111.9865 2794.267       161.3545 469.1953 9.794356 477.2402 13.88897 -8.044952      16.99509 
1 1 1 -3  8  11 o 615.9882 10.29545 4637.002       154.5446 4651.792       268.9600 4629.713       188.8297 614.8566 17.96983 615.0515 12.59861 -0.1948242     21.94629 
1 1 1 -3  8  12 o 834.7870 13.83700 8529.373       281.4841 7948.344       465.1079 8865.183       353.5911 801.9743 23.82533 850.0638 17.06922 -48.08948      29.30878 
1 1 1 -3  8  13 o 750.5027 10.77493 6878.845       197.0620 7068.646       284.0521 6702.733       273.6164 759.8852 15.33959 739.9932 15.17324 19.89197       21.57615 
1 1 1 -3  8  14 o 750.4852 10.77456 6876.517       197.0507 6696.869       273.7896 7069.576       283.8248 739.8806 15.18516 760.1629 15.32172 -20.28235      21.57184 
1 1 1 -3  8  15 o 364.7548 5.496379 1621.888       48.85553 1594.871       68.43961 1649.960       69.76373 361.6158 7.766478 367.8073 7.783470 -6.191559      10.99548 
1 1 1 -3  8  16 o 963.3481 13.77443 11342.70       323.3650 12321.81       484.0374 10553.51       434.5666 1002.411 19.81513 927.8741 19.21901 74.53687       27.60453 
1 1 1 -3  8  17 o 38.32154 4.460506 18.14164       4.087694 16.30070       4.795329 23.03521       7.818289 36.13815 5.628472 42.79657 7.783267 -6.658428      9.605152 
1 1 1 -3  8  18 f 407.5887 6.077111 2025.597       60.36086 2086.971       87.11143 1968.915       83.71606 413.5700 8.643509 401.7083 8.551886 11.86172       12.15915 
1 1 1 -3  8  19 o 196.2362 3.459106 469.3241       16.54166 446.4689       22.83042 494.5816       24.00030 191.3117 4.901104 201.4224 4.889594 -10.11064      6.923074 
1 1 1 -3  8  20 f 540.6202 9.130017 3568.262       120.2818 3561.341       146.9614 3582.307       209.3439 539.8284 11.17150 540.3571 15.91537 -0.5286865     19.44483 
1 1 1 -3  8  21 o 282.5804 5.213950 973.6962       35.90418 983.8613       44.02279 953.5023       62.04902 283.9984 6.361004 279.2654 9.129896 4.733002       11.12733 
1 1 1 -3  8  22 o 339.2819 5.998094 1404.347       49.59182 1395.380       60.76349 1422.234       85.82170 338.0881 7.375249 340.8575 10.34406 -2.769409      12.70409 
1 1 1 -3  8  23 o 104.9492 2.842783 134.3510       7.263715 135.0164       10.14350 133.6506       10.40644 105.1546 3.965539 104.6135 4.089931 0.5410995      5.696756 
1 1 1 -3  8  24 o 450.3113 6.691823 2477.182       73.43336 2496.378       104.4562 2458.426       103.2551 451.4608 9.494634 448.0250 9.457428 3.435822       13.40116 
1 1 1 -3  8  25 o 162.3302 3.202930 321.3155       12.67019 307.7924       17.54437 336.0563       18.31731 158.7528 4.539692 165.8877 4.535436 -7.134933      6.417086 
1 1 1 -3  8  26 o 187.8355 4.074885 430.5547       18.65216 411.0546       33.18829 439.5576       22.55046 183.0540 7.455542 189.6634 4.883118 -6.609360      8.912348 
1 1 1 -3  8  27 o 204.3185 3.625077 509.4046       18.04933 507.2967       25.49811 511.5217       25.55318 203.6791 5.141297 204.5275 5.130980 -0.8483887     7.263601 
1 1 1 -3  8  28 o 94.61439 3.150349 109.3359       7.253471 106.8676       11.40793 111.0110       9.397741 93.36395 5.032683 95.26255 4.057523 -1.898598      6.464626 
1 1 1 -3  8  29 f 161.4708 3.239018 318.1757       12.74511 322.7599       18.08037 313.6479       17.96875 162.4414 4.572006 160.1250 4.609722 2.316360       6.492517 
1 1 1 -3  8  30 o 128.7706 3.038012 202.3582       9.533275 198.9794       13.17714 206.0689       13.80923 127.5257 4.246131 129.7639 4.373211 -2.238213      6.095458 
1 1 1 -3  8  31 o 106.0558 2.975178 137.3909       7.681640 143.8198       10.73267 130.6387       10.99919 108.3948 4.070385 103.2624 4.380973 5.132416       5.980047 
1 1 1 -3  8  32 o 118.4676 3.032293 171.4616       8.746807 169.5770       12.16656 173.4776       12.58369 117.6625 4.250183 118.9956 4.346817 -1.333038      6.079381 
1 1 1 -3  8  33 o 32.03196 6.585341 13.09062       4.968568 13.09062       4.968568 0.000000       0.000000 32.03196 6.585341 ?        ?        0.000000       6.585341 
1 1 1 -3  8  34 o 71.02140 3.207898 61.76130       5.537623 65.42134       7.612570 57.64796       8.070215 72.96088 4.300665 68.38604 4.874594 4.574844       6.500568 
1 1 1 -3  8  35 o 96.48538 3.126875 113.9047       7.342336 108.3871       9.982357 120.4082       10.83754 93.92818 4.373154 98.98635 4.504631 -5.058167      6.278230 
1 1 1 -3  8  36 o 91.32861 3.171506 102.1352       7.047723 100.9304       9.718100 103.4719       10.23603 90.57729 4.416079 91.67691 4.596454 -1.099617      6.374099 
1 1 1 -3  8  37 o 54.30478 4.969413 36.61060       6.503445 50.56857       13.33104 32.25126       7.450119 62.77002 8.969935 50.67881 6.158830 12.09121       10.88076 
1 1 1 -3  8  38 o 25.90303 6.531599 8.681808       4.121428 10.35808       5.506773 6.547113       6.214314 28.25007 7.761435 24.07643 8.500432 4.173645       11.51074 
1 1 1 -3  8  39 f 59.02801 4.116034 43.13747       5.883606 31.65720       8.426873 54.05674       8.218395 49.66759 7.169665 65.82955 5.164384 -16.16196      8.836004 
1 1 1 -3  8  40 o 32.70847 5.313751 13.66992       4.090199 8.947654       5.462957 19.69411       6.170235 26.20018 7.901462 38.94719 6.745347 -12.74701      10.38907 
1 1 1 -3  8  41 o 22.64208 6.756666 6.690546       4.010418 8.248461       5.273204 4.553194       6.176474 25.06745 7.801902 21.57494 8.314412 3.492512       11.40172 
1 1 1 -3  8  42 o 38.31763 4.816219 18.77470       4.398078 24.15801       5.907625 12.08124       6.587396 43.13124 5.764855 29.43620 8.627822 13.69503       10.37655 
1 1 1 -3  8  43 o 27.04882 6.929951 10.12606       4.587976 9.959311       5.297150 10.62676       9.179010 26.61575 7.718691 27.65964 10.25108 -1.043892      12.83210 
1 1 1 -3  8  44 o 15.80534 6.340424 2.144750       3.719903 -0.1668866     4.690856 6.061715       6.106145 15.03514 6.614211 21.85110 8.305003 -6.815953      10.61701 
1 1 1 -3  8  45 o 23.64464 6.775208 8.178960       4.104349 14.75739       5.369346 -1.068071      6.365921 31.63317 7.135780 16.23092 7.376496 15.40225       10.26314 
1 1 1 -3  8  46 o 17.80374 6.548974 4.355368       3.734171 4.612362       4.867391 3.987730       5.821632 18.61892 7.322052 18.57649 7.744291 0.4242516E-01  10.65770 
1 1 1 -3  8  47 o 13.06659 6.060619 -1.555844      4.608238 -9.016204      8.271142 1.802376       5.549325 14.12450 6.939293 16.18332 7.153510 -2.058817      9.966268 
1 1 1 -3  8  48 o 13.46895 5.967116 0.7836742      3.882493 -4.045498      5.360460 6.112343       5.630865 12.46142 5.996272 18.94903 7.728384 -6.487615      9.781779 
1 1 1 -3  8  49 o 17.56815 6.572512 5.337340       3.790445 6.051525       5.527854 4.703541       5.207477 18.01455 7.530894 16.90602 7.200137 1.108528       10.41904 
1 1 1 -3  8  50 o 21.22828 6.855033 8.805254       4.038498 4.925248       5.742803 12.60127       5.680307 16.32875 7.244431 23.13098 8.130352 -6.802229      10.88965 
1 1 1 -3  8  51 o 25.58727 7.420101 14.00537       4.895345 13.72104       5.921932 14.61894       8.699409 22.75104 8.266324 19.72889 8.823956 3.022154       12.09108 
1 1 1 -3  9  1  o 882.3032 12.65803 9531.431       272.1575 10069.06       399.6134 9066.340       371.6804 904.5370 18.12916 858.4863 17.76643 46.05078       25.38331 
1 1 1 -3  9  2  o 546.8077 7.105765 3648.820       94.68509 3645.242       122.1783 3654.198       149.8200 546.2553 9.178304 546.5699 11.24832 -0.3146362     14.51778 
1 1 1 -3  9  3  f 370.7459 4.970103 1676.096       44.90325 1643.089       70.11243 1699.049       58.46756 366.8633 7.842501 373.1775 6.429296 -6.314178      10.14104 
1 1 1 -3  9  4  o 232.0422 3.388647 656.2984       19.16150 616.3413       29.29057 686.1915       25.33473 224.8056 5.346686 237.2383 4.382232 -12.43277      6.913104 
1 1 1 -3  9  5  o 400.4127 5.327068 1955.379       51.97950 1978.151       82.95251 1940.657       66.69795 402.4494 8.458282 398.7785 6.863484 3.670868       10.89266 
1 1 1 -3  9  6  o 551.3093 7.161928 3709.911       96.21910 3717.587       152.4577 3704.830       124.0440 551.1448 11.35135 550.6082 9.244790 0.5366211      14.63965 
1 1 1 -3  9  7  o 305.3344 4.707627 1136.804       35.02788 1103.024       48.65295 1173.155       50.47087 300.6514 6.640639 310.0593 6.679747 -9.407898      9.418976 
1 1 1 -3  9  8  o 569.7745 8.269053 3964.568       114.8140 3900.045       160.6547 4031.926       164.1446 564.4839 11.67900 573.9360 11.73619 -9.452087      16.55709 
1 1 1 -3  9  9  o 317.0310 5.600229 1225.816       43.26568 1224.616       53.19886 1228.162       74.35632 316.7977 6.891030 316.8913 9.639995 -0.9359741E-01 11.84972 
1 1 1 -3  9  10 o 640.6463 10.69818 5016.491       167.0184 5055.203       291.2061 4997.515       203.8854 640.8084 18.66807 638.9370 13.09459 1.871460       22.80275 
1 1 1 -3  9  11 o 673.3182 11.22029 5540.249       184.1029 5205.277       306.3087 5729.691       230.3530 650.4775 19.34522 684.2128 13.81550 -33.73529      23.77195 
1 1 1 -3  9  12 o 421.8067 6.254349 2169.574       64.28827 2061.786       88.15187 2292.036       93.96057 411.0370 8.800646 433.3735 8.897074 -22.33652      12.51436 
1 1 1 -3  9  13 o 562.2147 8.165317 3855.865       111.8694 3802.789       156.7212 3911.003       159.7363 558.0062 11.52531 565.8832 11.58353 -7.877014      16.34047 
1 1 1 -3  9  14 o 178.2837 3.205956 387.3489       13.92853 392.0930       19.94050 382.8288       19.46398 179.2986 4.567482 177.1684 4.511935 2.130127       6.420238 
1 1 1 -3  9  15 o 294.2370 4.588055 1055.233       32.89743 1040.327       46.29774 1070.434       46.75358 292.1013 6.504145 296.2987 6.475139 -4.197388      9.177762 
1 1 1 -3  9  16 o 382.3083 8.104634 1782.849       75.50630 1749.327       104.5590 1819.382       109.1532 378.3264 11.35404 385.8059 11.62323 -7.479584      16.24850 
1 1 1 -3  9  17 o 447.1259 6.608463 2437.870       72.00562 2481.435       103.1779 2396.508       100.5361 450.9209 9.389666 443.1433 9.309834 7.777588       13.22266 
1 1 1 -3  9  18 o 528.0087 7.711693 3400.969       99.22632 3415.085       140.9149 3387.086       139.7468 528.7869 10.93554 526.6202 10.88951 2.166748       15.43267 
1 1 1 -3  9  19 o 140.2565 2.934395 239.7374       10.02946 233.3360       14.15512 246.1909       14.21266 138.2934 4.205143 142.0592 4.109856 -3.765808      5.879978 
1 1 1 -3  9  20 o 279.5384 5.169299 952.7753       35.21350 1003.837       44.22424 864.3190       58.20710 286.8817 6.325886 265.9079 8.995687 20.97382       10.99724 
1 1 1 -3  9  21 o 421.2716 7.241290 2165.926       74.33857 2156.677       91.11422 2184.339       128.5652 420.1955 8.898129 422.1894 12.51006 -1.993896      15.35182 
1 1 1 -3  9  22 o 113.9412 2.816660 158.2354       7.820800 148.3000       10.87258 168.8878       11.25805 110.2131 4.055125 117.6309 3.932937 -7.417725      5.649074 
1 1 1 -3  9  23 o 208.8491 3.636158 531.8177       18.50595 528.2696       26.14125 535.3823       26.20158 208.0806 5.155355 209.4780 5.132784 -1.397369      7.274830 
1 1 1 -3  9  24 o 112.5078 2.862046 154.4118       7.840478 145.7818       10.78735 164.0761       11.41552 109.2497 4.058952 115.9117 4.047616 -6.662003      5.732214 
1 1 1 -3  9  25 o 146.0198 3.666532 260.2401       13.03646 249.2723       23.41556 265.1668       15.69363 142.6108 6.756984 147.3432 4.375611 -4.732330      8.050019 
1 1 1 -3  9  26 o 101.3197 3.449196 125.3757       8.503822 109.0461       15.89061 131.9290       10.06657 94.11802 6.978016 103.8973 3.983334 -9.779236      8.034903 
1 1 1 -3  9  27 o 317.3555 4.974586 1230.778       38.47150 1241.724       54.72920 1220.086       54.09027 318.2894 7.056036 315.5095 7.035105 2.779907       9.963952 
1 1 1 -3  9  28 f 95.63908 3.163265 111.7224       7.362226 108.6954       11.37483 113.9048       9.658071 94.16168 4.974829 96.48856 4.116971 -2.326874      6.457428 
1 1 1 -3  9  29 o 55.44971 3.248463 37.65202       4.370257 35.52584       5.817941 40.40524       6.620500 53.72891 4.484355 57.28765 4.786044 -3.558743      6.558633 
1 1 1 -3  9  30 o 61.19633 3.175039 45.83477       4.718706 45.49413       6.310213 46.26690       7.107160 60.85654 4.282351 61.31137 4.794958 -0.4548340     6.428854 
1 1 1 -3  9  31 o 83.56861 2.968758 85.35119       6.036200 81.56462       8.127812 90.00819       9.013707 81.57727 4.101701 85.67805 4.331205 -4.100784      5.965173 
1 1 1 -3  9  32 f 11.98077 5.366927 -1.463298      3.231804 -0.7003120     3.859449 -3.253779      5.912238 13.93774 6.068367 15.80946 7.154620 -1.871719      9.381560 
1 1 1 -3  9  33 o 165.9323 3.902825 336.8032       15.78142 333.5688       18.98558 344.0344       28.38764 164.9157 4.729058 166.8396 6.997766 -1.923935      8.445869 
1 1 1 -3  9  34 o 99.55761 3.069942 121.2130       7.439117 118.8967       10.16924 123.8795       10.91087 98.43530 4.249382 100.4435 4.468790 -2.008224      6.166630 
1 1 1 -3  9  35 o 30.62800 5.580916 11.89857       4.012013 12.14113       5.216165 11.54721       6.277908 30.70903 7.110546 29.98308 8.306426 0.7259502      10.93419 
1 1 1 -3  9  36 o 100.9908 3.103523 124.8563       7.628817 113.9250       10.28525 138.2252       11.37433 96.23346 4.397460 106.0167 4.412306 -9.783249      6.229454 
1 1 1 -3  9  37 o 140.4524 3.962472 242.2749       13.54869 254.5587       25.53759 237.4629       15.98363 142.6028 7.373836 138.8160 4.731894 3.786713       8.761523 
1 1 1 -3  9  38 o 15.49500 6.617857 0.3554712E-01  4.421328 -1.038410      6.758429 0.8390413      5.845795 18.30135 7.998128 18.35236 7.713007 -0.5101204E-01 11.11128 
1 1 1 -3  9  39 o 56.51901 3.782437 39.49011       5.179587 35.32233       6.923118 44.78898       7.806221 53.02542 5.434546 59.77585 5.417715 -6.750431      7.673717 
1 1 1 -3  9  40 o 47.00472 4.042514 27.52353       4.585578 24.10945       6.263567 31.46698       6.731682 43.35834 6.096192 49.79248 5.647460 -6.434139      8.310076 
1 1 1 -3  9  41 o 85.62227 3.296527 90.64744       6.865424 93.57431       9.368398 87.25228       10.09007 86.47691 4.460661 83.21804 4.998584 3.258865       6.699503 
1 1 1 -3  9  42 o 15.70020 6.510519 1.241955       4.083339 0.5408132      4.726889 3.303851       8.105989 16.02085 6.842589 21.94753 9.143036 -5.926683      11.41999 
1 1 1 -3  9  43 o 27.42691 6.657126 10.39091       4.403903 12.90211       5.137738 3.435289       8.550650 30.42735 7.064962 21.91117 9.274697 8.516180       11.65906 
1 1 1 -3  9  44 o 16.40464 6.424428 2.709107       3.733819 4.184723       4.818078 0.4904820      5.907846 19.03557 7.341410 16.99083 7.450289 2.044735       10.45959 
1 1 1 -3  9  45 o 58.79255 3.799473 44.54222       5.414395 50.49331       7.356544 37.50839       7.997811 61.47073 4.952890 51.30973 6.545199 10.16100       8.207969 
1 1 1 -3  9  46 o 13.33175 5.827045 0.4590946      3.588291 -5.804203      4.872295 7.882643       5.304419 11.56308 5.601281 22.04549 7.846660 -10.48241      9.640769 
1 1 1 -3  9  47 o 21.55404 8.296574 8.321861       6.144866 0.000000       0.000000 8.321861       6.144866 ?        ?        21.55404 8.296574 0.000000       8.296574 
1 1 1 -3  9  48 o 16.31128 6.448270 3.885942       3.792717 -0.4016544     5.101256 9.185413       5.671349 13.87288 6.414293 21.69660 8.054651 -7.823723      10.29663 
1 1 1 -3  9  49 o 10.40677 4.973798 -2.597975      3.551429 -3.127537      5.200268 -2.135113      4.861760 12.20549 5.881439 12.29230 5.859608 -0.8680820E-01 8.302188 
1 1 1 -3  9  50 o 9.048506 4.463436 -5.068063      3.538014 -2.821096      5.130859 -7.105010      4.885191 11.87782 5.752371 10.14812 5.047381 1.729699       7.652832 
1 1 1 -3  9  51 o 12.10035 5.543487 0.7187074      3.689191 0.5074100E-01  5.126767 1.436033       5.312812 12.78568 6.072687 13.56793 6.363499 -0.7822495     8.796115 
1 1 1 -3  10 1  o 178.9079 2.853185 390.1087       12.43929 403.2313       19.89108 381.6804       15.94110 181.8549 4.488457 176.9481 3.696889 4.906891       5.814915 
1 1 1 -3  10 2  o 274.8188 4.991102 921.0192       33.42558 883.3426       56.46819 941.3413       41.47172 268.7738 8.632658 277.7742 6.126664 -9.000427      10.58578 
1 1 1 -3  10 3  o 210.2600 2.894096 538.8219       14.82879 547.4066       21.15320 530.5266       20.79357 211.8975 4.096512 208.6050 4.090422 3.292465       5.789038 
1 1 1 -3  10 4  o 319.6875 4.899450 1246.276       38.16885 1195.930       52.63461 1302.116       55.43175 313.0373 6.899843 326.6340 6.964037 -13.59668      9.803349 
1 1 1 -3  10 5  o 258.6609 3.690976 815.5808       23.26527 801.0341       36.49246 825.5422       30.19816 256.2552 5.843788 260.1960 4.762596 -3.940857      7.538712 
1 1 1 -3  10 6  o 303.0708 4.194369 1119.816       30.97753 1056.286       47.35050 1167.353       40.95896 294.2218 6.604100 309.3757 5.432837 -15.15390      8.551600 
1 1 1 -3  10 7  o 291.5227 4.546073 1036.171       32.29571 1007.175       45.03104 1066.882       46.34329 287.3218 6.431425 295.7157 6.430968 -8.393860      9.095085 
1 1 1 -3  10 8  o 290.3784 6.396788 1028.604       45.26498 1060.713       65.85911 999.8578       62.31642 294.5487 9.186582 285.9909 8.952602 8.557800       12.82741 
1 1 1 -3  10 9  o 93.68939 3.806885 107.1678       8.673430 103.7671       12.17477 110.6725       12.35949 92.08816 5.449630 95.11996 5.353638 -3.031807      7.639366 
1 1 1 -3  10 10 o 847.5007 12.14367 8780.696       250.7992 8883.579       357.7784 8681.298       351.6677 851.0154 17.25204 841.3028 17.15316 9.712646       24.32825 
1 1 1 -3  10 11 o 409.0159 6.084161 2039.869       60.64248 2009.316       85.06451 2071.443       86.47573 405.7939 8.602145 412.0189 8.612734 -6.225037      12.17276 
1 1 1 -3  10 12 o 304.5329 4.717136 1130.430       35.00650 1114.112       49.23549 1147.113       49.78238 302.2675 6.684220 306.7125 6.660520 -4.444977      9.436171 
1 1 1 -3  10 13 o 248.7439 4.017326 754.0935       24.35150 740.7949       34.23616 767.7108       34.64389 246.5080 5.699254 250.9471 5.665110 -4.439102      8.035855 
1 1 1 -3  10 14 o 50.28205 2.742582 30.90111       3.347814 27.60960       4.864583 33.86272       4.614368 47.40479 4.256280 52.58777 3.622876 -5.182980      5.589378 
1 1 1 -3  10 15 o 182.1638 4.639249 404.7315       20.57749 404.3889       28.13320 405.1255       30.17601 182.0067 6.352756 182.1470 6.810346 -0.1403503     9.313340 
1 1 1 -3  10 16 o 454.3849 7.720524 2518.333       85.48831 2545.980       148.5205 2504.635       104.5432 456.1962 13.37420 453.0266 9.469697 3.169556       16.38732 
1 1 1 -3  10 17 o 48.72058 2.968454 29.03442       3.507623 29.22627       5.092244 28.86120       4.838530 48.77570 4.329119 48.48541 4.134525 0.2902870      5.986282 
1 1 1 -3  10 18 o 353.8311 5.377873 1526.392       46.37059 1542.905       66.17978 1510.467       64.99218 355.6282 7.636477 351.8733 7.579467 3.754883       10.75937 
1 1 1 -3  10 19 o 206.8366 3.578487 521.4307       18.03694 521.9374       25.67385 520.9368       25.34549 206.9039 5.091975 206.7070 5.031638 0.1968842      7.158603 
1 1 1 -3  10 20 o 210.8217 5.176219 541.9656       26.59280 541.9656       26.59280 0.000000       0.000000 210.8217 5.176219 ?        ?        0.000000       5.176219 
1 1 1 -3  10 21 o 459.1909 6.798167 2573.378       76.07137 2563.323       107.3961 2583.502       107.7671 457.9170 9.624225 459.7166 9.619667 -1.799622      13.60749 
1 1 1 -3  10 22 o 139.6740 2.979471 237.7996       10.14123 232.4083       14.33049 243.2081       14.35327 137.9868 4.266873 141.1645 4.177027 -3.177719      5.971077 
1 1 1 -3  10 23 o 206.0595 3.613457 517.7455       18.14478 504.2374       25.39574 531.8321       25.93393 203.2120 5.132431 208.7667 5.097661 -5.554718      7.233809 
1 1 1 -3  10 24 o 198.8550 4.173363 482.4161       20.22362 487.6513       36.74260 480.1408       24.22303 199.5042 7.571301 198.2673 5.017534 1.236908       9.082965 
1 1 1 -3  10 25 o 67.50347 2.989989 55.67440       4.906285 46.31372       6.619374 67.08656       7.308815 61.43785 4.451437 74.03580 4.066682 -12.59795      6.029361 
1 1 1 -3  10 26 o 326.7619 5.928717 1305.957       47.20938 1280.263       82.28539 1318.565       57.63945 322.0576 10.49866 328.0358 7.210451 -5.978180      12.73626 
1 1 1 -3  10 27 o 167.4600 3.693639 342.2766       15.07307 344.2136       24.87554 341.1528       18.94766 167.5744 6.101751 167.0354 4.659458 0.5389709      7.677364 
1 1 1 -3  10 28 o 297.2728 4.737811 1080.203       34.32172 1082.246       48.64647 1078.179       48.43074 297.0743 6.719703 296.5205 6.702399 0.5538025      9.490867 
1 1 1 -3  10 29 o 106.5057 2.929297 138.5112       7.595557 130.4769       10.40213 147.6876       11.11694 103.2552 4.142447 109.8626 4.159916 -6.607376      5.870670 
1 1 1 -3  10 30 o 48.89418 3.459139 29.33849       4.094950 26.36708       5.333856 33.60393       6.390609 46.17287 4.810917 52.14584 5.093942 -5.972973      7.006651 
1 1 1 -3  10 31 o 60.98749 3.212306 45.54351       4.757290 46.48985       6.522659 44.46799       6.953653 61.49133 4.381567 60.07865 4.789214 1.412682       6.491125 
1 1 1 -3  10 32 o 124.5706 3.452214 189.7560       10.46961 181.3208       12.66902 207.9242       18.59309 121.6503 4.280269 129.9682 5.885818 -8.317978      7.277606 
1 1 1 -3  10 33 o 10.65080 5.053234 -4.330297      3.531128 -4.092940      4.027798 -5.118611      7.340359 11.84432 5.550508 17.01420 7.803880 -5.169880      9.576465 
1 1 1 -3  10 34 o 61.23027 3.338205 45.97087       4.962145 40.90191       6.696912 52.14183       7.389102 57.53839 4.820448 65.03346 4.694085 -7.495068      6.728384 
1 1 1 -3  10 35 o 137.6971 3.192272 231.8482       10.71175 230.2563       14.92765 233.5380       15.37989 136.9160 4.480086 137.8633 4.584301 -0.9473114     6.409913 
1 1 1 -3  10 36 o 63.34512 3.439682 49.26934       5.289749 47.88027       7.053658 51.05452       7.996388 62.23787 4.685153 64.18496 5.155730 -1.947086      6.966506 
1 1 1 -3  10 37 o 45.65246 4.436824 25.87309       4.873788 26.75939       6.638892 24.83706       7.177759 46.07777 6.059143 44.14812 6.897247 1.929657       9.180699 
1 1 1 -3  10 38 o 127.4943 3.290344 199.4781       10.21421 218.6381       14.99302 182.8838       13.95314 133.0201 4.632323 121.6129 4.717158 11.40723       6.611354 
1 1 1 -3  10 39 o 46.76215 4.079474 27.18151       4.602242 24.15407       6.030506 31.40393       7.121904 43.60476 5.820469 49.75563 5.994410 -6.150879      8.355287 
1 1 1 -3  10 40 o 28.84082 5.795848 10.82177       3.931962 15.66410       5.219289 4.466945       5.979100 34.64719 6.417985 21.40669 8.198157 13.24050       10.41155 
1 1 1 -3  10 41 o 31.89062 5.290151 13.14904       3.967191 10.24138       5.145330 17.41165       6.229867 27.51736 7.479009 35.99075 7.351898 -8.473383      10.48742 
1 1 1 -3  10 42 o 37.23294 4.802158 17.82400       4.255762 17.92747       5.405288 17.65527       6.902787 36.70201 6.268466 35.46106 8.157887 1.240952       10.28809 
1 1 1 -3  10 43 o 39.49573 4.505348 20.11422       4.258794 19.44136       5.454793 21.16470       6.815688 37.99116 6.098237 38.79299 7.480886 -0.8018341     9.651536 
1 1 1 -3  10 44 f 25.58500 6.894498 9.456754       4.394918 9.581298       4.934727 8.979090       9.664102 25.49683 7.465951 25.13410 10.17114 0.3627357      12.61715 
1 1 1 -3  10 45 o 14.96572 6.113019 1.958984       3.529468 6.211854       4.636190 -3.903351      5.443215 20.64833 7.337189 13.43209 6.343332 7.216243       9.699083 
1 1 1 -3  10 46 o 11.43900 5.280745 -1.562822      3.438040 -4.674908      4.396616 3.335268       5.515769 11.27357 5.426174 17.56122 7.441957 -6.287653      9.210108 
1 1 1 -3  10 47 o 17.00679 6.997797 3.822354       4.668207 1.188532       8.622474 4.914482       5.552331 17.56710 8.195886 18.32401 7.594581 -0.7569103     11.17364 
1 1 1 -3  10 48 o 12.60565 5.618253 0.4732168      3.494253 6.285599       5.106526 -4.644619      4.791723 18.76815 7.462125 11.38110 5.522916 7.387054       9.283637 
1 1 1 -3  10 49 o 13.95428 5.980909 2.289418       3.634487 -1.594778      5.197936 6.004973       5.083844 12.76938 6.079094 17.66832 7.289655 -4.898939      9.491810 
1 1 1 -3  10 50 o 16.29365 6.859175 5.126254       4.635292 8.941587       5.591885 -3.252966      8.286933 19.21736 7.751162 13.75081 6.791954 5.466547       10.30588 
1 1 1 -3  11 1  o 17.26308 6.439802 2.727560       3.633653 4.307830       4.745016 0.4868394      5.650226 20.58307 7.410229 18.07306 7.588467 2.510008       10.60643 
1 1 1 -3  11 2  o 65.86040 2.546350 52.94144       4.079055 49.82784       5.522521 56.67939       6.050934 63.83626 3.564197 68.09078 3.660135 -4.254524      5.108824 
1 1 1 -3  11 3  o 331.3538 5.061976 1338.911       40.87410 1389.995       59.25381 1292.536       56.45697 337.4716 7.205149 325.4323 7.119030 12.03931       10.12891 
1 1 1 -3  11 4  o 298.6786 4.636354 1087.696       33.74557 1133.886       48.88051 1045.634       46.64484 304.8502 6.579807 292.7489 6.538410 12.10129       9.276026 
1 1 1 -3  11 5  o 350.3318 6.119704 1497.109       52.24515 1558.223       92.50096 1468.481       63.31032 356.8470 10.64913 346.8690 7.489847 9.978027       13.01929 
1 1 1 -3  11 6  o 139.5173 3.307390 237.2453       11.24475 226.8119       19.50878 242.4361       13.76057 136.2421 5.889926 140.9681 4.009783 -4.725983      7.125278 
1 1 1 -3  11 7  o 249.7826 5.702919 760.8489       34.71326 813.8596       51.65677 717.1987       46.87481 258.0894 8.223859 242.2852 7.949959 15.80423       11.43826 
1 1 1 -3  11 8  o 389.9774 5.220459 1854.228       49.61172 1779.873       76.49526 1908.210       65.17874 381.8977 8.219612 395.5276 6.762279 -13.62988      10.64380 
1 1 1 -3  11 9  o 791.5087 11.35692 7654.008       219.0546 7572.057       307.6207 7738.312       312.0058 786.2032 16.05627 794.7733 16.10954 -8.570068      22.74470 
1 1 1 -3  11 10 o 249.0507 4.036940 755.9870       24.50057 768.6664       35.14178 743.9946       34.17646 251.0914 5.743225 247.0306 5.677279 4.060776       8.075650 
1 1 1 -3  11 11 o 382.4925 5.743287 1783.591       53.53274 1731.557       74.45914 1839.265       77.01921 376.7670 8.109779 388.3066 8.139321 -11.53958      11.48987 
1 1 1 -3  11 12 f 626.2582 9.055462 4785.042       138.1975 4780.492       195.5880 4789.578       195.2939 625.5452 12.83061 626.1434 12.79908 -0.5982056     18.12294 
1 1 1 -3  11 13 o 257.2397 4.145560 806.4938       25.98707 811.2440       37.06174 801.8995       36.44846 257.9600 5.895727 256.4715 5.831818 1.488464       8.292749 
1 1 1 -3  11 14 o 585.6135 8.499941 4183.551       121.3006 4235.539       172.9844 4133.258       170.1409 588.8870 12.05422 581.7393 12.00174 7.147705       17.01017 
1 1 1 -3  11 15 o 401.0137 6.899125 1961.040       67.42010 1966.440       116.4037 1958.313       82.70466 401.0581 11.92356 400.6503 8.470879 0.4078674      14.62624 
1 1 1 -3  11 16 o 461.9657 6.816934 2602.598       76.74231 2529.220       106.5810 2681.599       110.5900 455.2097 9.607984 468.7153 9.682126 -13.50568      13.64027 
1 1 1 -3  11 17 o 109.0510 2.738482 145.0128       7.271632 139.7997       10.38222 150.0326       10.18782 107.0231 3.987829 110.8854 3.775765 -3.862244      5.491737 
1 1 1 -3  11 18 o 267.0532 4.286657 869.3380       27.89669 857.7735       39.33505 881.0408       39.56976 265.2131 6.086235 268.7877 6.041126 -3.574646      8.575398 
1 1 1 -3  11 19 o 224.4766 4.428124 614.2988       24.22295 615.7507       29.52477 611.3093       42.36636 224.7129 5.391660 223.6706 7.784644 1.042297       9.469460 
1 1 1 -3  11 20 o 417.2004 8.851250 2126.222       89.98817 2126.222       89.98817 0.000000       0.000000 417.2004 8.851250 ?        ?        0.000000       8.851250 
1 1 1 -3  11 21 o 296.0970 4.666722 1069.209       33.67302 1054.224       47.39928 1084.478       47.84555 293.8820 6.618546 298.0716 6.586957 -4.189575      9.337728 
1 1 1 -3  11 22 o 511.7251 7.521380 3200.054       93.79298 3266.889       134.6010 3136.971       130.7686 516.2657 10.69890 505.9218 10.60679 10.34387       15.06554 
1 1 1 -3  11 23 o 200.5753 4.170669 490.7408       20.38540 494.7809       37.09181 488.9923       24.40101 200.9957 7.586393 200.1680 5.002384 0.8276825      9.087200 
1 1 1 -3  11 24 o 96.52074 2.814056 113.6826       6.611889 114.2660       9.449313 113.1229       9.254961 96.69378 4.018958 96.21263 3.955794 0.4811478      5.639177 
1 1 1 -3  11 25 o 128.1739 3.557919 200.5789       11.10226 222.9325       21.68915 192.6421       12.92378 134.8102 6.622393 125.5572 4.229924 9.253014       7.858012 
1 1 1 -3  11 26 o 161.1914 3.810255 317.1247       14.96691 301.7185       27.31716 323.7332       17.89128 156.7276 7.171439 162.7442 4.515646 -6.016541      8.474703 
1 1 1 -3  11 27 o 192.6726 3.983611 453.2779       18.70394 448.2754       30.99734 456.1422       23.45513 191.1295 6.665394 193.1008 4.988632 -1.971329      8.325499 
1 1 1 -3  11 28 f 35.12196 4.180224 15.28086       3.507665 11.74855       4.630387 20.03753       5.373275 30.38908 6.452287 40.06684 5.660742 -9.677757      8.583473 
1 1 1 -3  11 29 o 198.4630 3.627814 481.0097       17.54530 462.2087       24.27833 501.5626       25.38419 194.2578 5.133162 202.3604 5.151752 -8.102615      7.272544 
1 1 1 -3  11 30 o 191.8924 3.557395 449.7706       16.63511 446.8294       23.46603 452.7419       23.58563 190.9605 5.047087 192.2223 5.039442 -1.261749      7.132255 
1 1 1 -3  11 31 o 90.30578 3.277333 99.73179       7.200313 98.95338       8.856477 101.2494       12.36606 89.86464 4.054676 90.67073 5.624341 -0.8060913     6.933514 
1 1 1 -3  11 32 o 124.8956 3.072463 190.5118       9.351254 189.4110       13.00407 191.6906       13.45689 124.3213 4.298844 125.0470 4.423030 -0.7257309     6.167922 
1 1 1 -3  11 33 o 104.9200 3.593900 134.7680       9.175268 136.9144       10.83657 129.3328       17.24418 105.6593 4.217173 102.1095 6.971935 3.549782       8.148154 
1 1 1 -3  11 34 o 64.11650 3.413340 50.41536       5.313952 53.09711       7.204231 47.21508       7.869945 65.64668 4.531180 61.75780 5.279902 3.888878       6.957655 
1 1 1 -3  11 35 o 64.47729 3.433798 51.01843       5.375868 46.61011       7.226563 56.48079       8.044254 61.39233 4.870265 67.60821 4.916182 -6.215874      6.920139 
1 1 1 -3  11 36 o 12.24239 5.523191 -1.791597      3.491477 -1.853882      4.606420 -1.707501      5.352544 14.38555 6.428458 15.78337 6.998662 -1.397812      9.502965 
1 1 1 -3  11 37 o 67.77563 4.974029 56.98703       8.157981 0.000000       0.000000 56.98703       8.157981 ?        ?        67.77563 4.974029 0.000000       4.974029 
1 1 1 -3  11 38 o 70.64410 3.707186 61.51460       6.359659 64.09344       9.868126 59.68264       8.317259 71.56179 5.705932 69.26701 4.960233 2.294777       7.560527 
1 1 1 -3  11 39 o 38.90720 4.634082 19.02396       4.307447 18.50449       5.604274 19.77379       6.733234 37.89520 6.289120 38.84227 7.383303 -0.9470673     9.698772 
1 1 1 -3  11 40 o 66.42152 3.450344 54.60119       5.565650 46.63475       7.272809 65.86044       8.646188 60.86677 4.945853 72.40325 4.929793 -11.53648      6.983146 
1 1 1 -3  11 41 f 27.05146 6.475759 9.800346       4.212138 7.664236       4.894171 15.90247       8.271947 24.03451 7.521767 33.40733 9.632747 -9.372818      12.22157 
1 1 1 -3  11 42 o 36.05517 4.879877 16.80702       4.177617 13.34865       5.238622 22.84837       6.923861 31.13108 7.067467 40.89722 7.210752 -9.766136      10.09673 
1 1 1 -3  11 43 o 21.82811 6.554768 6.575842       3.765368 5.992941       4.688091 7.635349       6.320487 21.21904 7.391342 23.62881 8.546349 -2.409767      11.29920 
1 1 1 -3  11 44 o 25.39458 6.432714 9.237078       3.984636 8.430417       4.968453 10.69113       6.670621 23.82707 7.594530 26.09699 8.825877 -2.269913      11.64358 
1 1 1 -3  11 45 o 14.04691 6.123279 0.5489766      3.939679 -0.5884558     4.537049 4.035359       7.943250 13.99222 6.305854 20.01109 8.709311 -6.018875      10.75248 
1 1 1 -3  11 46 o 10.63162 5.102005 -3.972089      3.821234 -3.321429      5.829269 -4.462366      5.060078 13.74051 6.511374 12.27518 5.885550 1.465327       8.777112 
1 1 1 -3  11 47 o 27.99875 6.273175 12.28677       4.173825 8.990594       5.755022 15.94436       6.062321 21.93971 8.119597 29.57035 8.151178 -7.630638      11.50520 
1 1 1 -3  11 48 o 13.34811 5.891888 1.121719       3.751759 6.205637       5.316933 -3.919794      5.294712 18.47009 7.518552 12.18861 5.888471 6.281480       9.550011 
1 1 1 -3  11 49 o 45.24245 4.550341 30.13403       4.948731 32.24736       7.047775 28.07871       6.950366 42.13010 7.118047 38.09790 7.750455 4.032204       10.52312 
1 1 1 -3  11 50 o 14.55597 6.345716 3.265747       4.231858 3.645969       5.207634 2.526480       7.261429 15.06878 6.776440 15.01137 7.157264 0.5740452E-01  9.856297 
1 1 1 -3  12 1  o 237.7646 3.489210 689.0469       20.21671 678.7274       31.54804 696.2375       26.33452 235.9182 5.487504 238.9743 4.522078 -3.056137      7.110689 
1 1 1 -3  12 2  o 303.8910 4.723533 1125.927       34.98008 1208.005       51.54807 1055.871       47.62332 314.6730 6.722283 294.1962 6.642728 20.47678       9.450657 
1 1 1 -3  12 3  o 499.2698 6.540432 3040.718       79.57523 3102.546       127.4435 3001.210       101.8748 503.8807 10.37896 495.8271 8.431416 8.053528       13.37204 
1 1 1 -3  12 4  o 338.6790 4.220394 1398.239       34.83191 1371.841       48.68324 1425.925       49.85727 335.3906 5.956518 341.9365 5.983385 -6.545929      8.442807 
1 1 1 -3  12 5  o 136.4577 3.321484 226.9438       11.04501 215.6938       18.97236 232.7113       13.58430 132.8652 5.874201 138.1129 4.040492 -5.247650      7.129643 
1 1 1 -3  12 6  o 502.1584 7.354780 3076.231       90.00083 2972.937       124.4768 3189.386       130.2824 493.3596 10.35353 510.9910 10.46252 -17.63135      14.71938 
1 1 1 -3  12 7  o 784.8682 10.07577 7521.667       192.7131 7209.249       295.9430 7751.680       253.9304 767.2115 15.82912 796.2033 13.08744 -28.99176      20.53880 
1 1 1 -3  12 8  o 604.5756 7.841582 4458.760       115.5288 4320.008       178.5791 4558.628       151.5040 594.5848 12.32482 611.0653 10.17420 -16.48053      15.98173 
1 1 1 -3  12 9  o 355.6598 4.822520 1541.887       41.79699 1585.564       67.44707 1514.657       53.25554 360.5494 7.676483 352.4585 6.200415 8.090912       9.867803 
1 1 1 -3  12 10 o 229.2951 5.310490 640.9091       29.67327 612.8643       41.26017 670.9536       42.70584 224.0415 7.568162 234.4354 7.484881 -10.39397      10.64427 
1 1 1 -3  12 11 o 87.34466 2.652252 93.05226       5.638762 98.44323       8.345340 88.52350       7.648922 89.79395 3.822572 85.14738 3.695116 4.646568       5.316571 
1 1 1 -3  12 12 o 366.4776 6.428944 1637.518       57.41471 1604.985       69.31370 1708.638       102.4827 362.7609 7.840838 373.9294 11.25951 -11.16849      13.72062 
1 1 1 -3  12 13 o 915.1651 13.09175 10233.61       291.9667 10153.05       410.7678 10315.87       415.0725 910.2748 18.51773 917.5318 18.56379 -7.256958      26.22062 
1 1 1 -3  12 14 o 324.6796 5.743829 1285.186       45.44568 1263.746       77.56451 1296.394       56.07965 321.6254 9.908203 326.0444 7.058177 -4.418945      12.16513 
1 1 1 -3  12 15 o 360.0860 5.465906 1580.745       47.96279 1556.877       67.37836 1605.263       68.29008 357.2566 7.739344 362.7665 7.724927 -5.509888      10.93490 
1 1 1 -3  12 16 o 317.1865 4.912553 1226.448       37.97153 1197.784       53.14343 1256.344       54.27413 313.3806 6.958914 320.9507 6.939345 -7.570129      9.827563 
1 1 1 -3  12 17 o 361.3620 5.491073 1592.172       48.35438 1543.874       67.29956 1643.712       69.52140 355.7167 7.763756 367.0375 7.772701 -11.32083      10.98594 
1 1 1 -3  12 18 o 528.1813 7.730317 3404.485       99.49848 3468.287       142.6045 3343.961       138.8931 532.6833 10.98571 523.0621 10.89661 9.621216       15.47326 
1 1 1 -3  12 19 o 356.1741 7.704630 1548.576       66.87292 1548.576       66.87292 0.000000       0.000000 356.1741 7.704630 ?        ?        0.000000       7.704630 
1 1 1 -3  12 20 o 147.0716 3.026649 263.6430       10.84743 246.9556       15.16177 281.1415       15.52588 142.2464 4.379152 151.7911 4.201376 -9.544724      6.068652 
1 1 1 -3  12 21 o 472.6289 6.989824 2728.169       80.50497 2793.251       115.8467 2667.386       111.9554 477.6552 9.952520 466.7941 9.842007 10.86115       13.99706 
1 1 1 -3  12 22 o 198.4747 3.536342 480.3333       17.10392 461.7914       23.87269 499.8903       24.51738 194.4659 5.041831 202.4008 4.970795 -7.934921      7.080174 
1 1 1 -3  12 23 o 175.6155 3.312017 376.0847       14.17397 359.2783       19.79184 393.7794       20.30818 171.5084 4.740033 179.5689 4.644814 -8.060532      6.636431 
1 1 1 -3  12 24 o 348.4649 5.364768 1483.438       45.55605 1506.987       65.26446 1461.062       63.61900 350.7464 7.635675 345.3790 7.558835 5.367401       10.74428 
1 1 1 -3  12 25 o 200.2900 4.216831 489.7442       20.58171 483.6636       37.20160 492.4263       24.70745 198.4453 7.707461 200.6893 5.056076 -2.243988      9.217855 
1 1 1 -3  12 26 o 116.0598 3.206644 164.4605       9.060499 162.1619       14.63529 165.8890       11.53728 115.0482 5.233889 116.4903 4.070478 -1.442162      6.630413 
1 1 1 -3  12 27 o 24.99712 5.260104 7.930001       3.102587 8.181328       4.256004 7.644961       4.532476 25.38881 6.759491 24.69929 7.133006 0.6895256      9.827029 
1 1 1 -3  12 28 o 290.5316 4.670103 1032.073       33.06404 1032.189       46.92431 1031.959       46.59664 290.0318 6.639206 290.0136 6.593258 0.1818848E-01  9.356822 
1 1 1 -3  12 29 f 30.90292 4.827490 11.96181       3.516606 10.68199       4.622761 13.71969       5.417787 28.91999 6.692190 32.79771 6.992361 -3.877726      9.678766 
1 1 1 -3  12 30 o 98.45581 3.283863 118.5043       7.867818 118.2777       9.832201 118.9079       13.11913 98.26849 4.114930 98.33055 5.496836 -0.6205750E-01 6.866429 
1 1 1 -3  12 31 o 161.5672 3.293808 318.8624       12.96843 315.2473       18.18162 322.6063       18.50287 160.3814 4.656961 162.2384 4.684944 -1.856995      6.605754 
1 1 1 -3  12 32 o 109.5911 3.027725 146.7986       8.078142 145.7564       11.15723 147.9469       11.71134 109.0419 4.206706 109.8309 4.384494 -0.7889709     6.076196 
1 1 1 -3  12 33 o 58.45131 4.018079 42.02043       5.688513 40.48451       6.425010 47.59130       12.23634 57.27722 4.642931 61.33098 8.408325 -4.053757      9.605037 
1 1 1 -3  12 34 o 163.0522 3.364375 325.1697       13.36802 314.9318       18.57300 336.1744       19.25597 160.0902 4.766121 165.4010 4.782417 -5.310837      6.751845 
1 1 1 -3  12 35 o 105.6541 3.074843 136.6287       7.908302 138.6988       11.02686 134.4362       11.34811 106.2314 4.268231 104.5410 4.464800 1.690384       6.176750 
1 1 1 -3  12 36 o 43.93468 4.550427 23.98861       4.801423 24.10791       6.699363 23.86261       6.884912 43.61218 6.502014 43.32501 6.740240 0.2871704      9.365202 
1 1 1 -3  12 37 o 72.48726 4.172194 64.85646       7.338776 54.03308       13.42960 69.46465       8.762890 64.71030 8.739565 74.86620 4.828897 -10.15591      9.984900 
1 1 1 -3  12 38 o 48.18438 4.017256 28.80368       4.674188 25.67801       6.250657 32.76878       7.040142 45.01993 5.834605 50.95978 5.770584 -5.939850      8.206233 
1 1 1 -3  12 39 o 21.95346 6.749715 6.155522       3.960827 6.447328       5.408677 5.818060       5.816436 23.10963 7.944563 22.69963 8.200087 0.4099922      11.41742 
1 1 1 -3  12 40 o 59.16275 3.958021 43.63339       5.673580 38.76847       6.690058 56.09418       10.70693 55.37200 5.012193 65.77018 6.777277 -10.39818      8.429328 
1 1 1 -3  12 41 o 93.42853 3.713210 108.8340       8.437218 96.12130       9.641919 150.3849       17.43148 87.29635 4.548118 107.1839 6.707350 -19.88757      8.103945 
1 1 1 -3  12 42 o 47.90065 3.955233 29.03981       4.575782 27.06596       5.887484 32.05104       7.271832 45.50610 5.415234 49.05986 6.222250 -3.553764      8.248707 
1 1 1 -3  12 43 o 26.32037 6.120090 9.611242       3.850880 5.050887       4.705379 18.86085       6.701266 19.97808 7.351002 35.93249 7.871251 -15.95441      10.77004 
1 1 1 -3  12 44 o 23.60977 6.501264 8.088368       3.858795 11.09866       4.837986 2.824741       6.397395 27.26774 7.182355 18.71611 7.976063 8.551628       10.73330 
1 1 1 -3  12 45 o 11.76953 5.362183 -1.124751      3.390136 2.750074       4.383747 -6.890179      5.347309 16.43802 6.774299 11.87465 5.778850 4.563377       8.904282 
1 1 1 -3  12 46 o 16.23083 6.579476 3.197109       4.051849 1.901664       4.940336 5.859119       7.081932 15.77921 6.867991 19.78850 8.411058 -4.009290      10.85888 
1 1 1 -3  12 47 o 14.63288 6.148581 2.245919       3.713729 5.235702       5.182762 -0.9091583     5.324102 18.17638 7.414032 13.92692 6.478316 4.249460       9.845631 
1 1 1 -3  12 48 o 13.30696 5.876597 1.213556       3.736659 -2.277046      5.344769 4.550873       5.226096 12.82940 6.123436 16.85607 7.196956 -4.026670      9.449479 
1 1 1 -3  12 49 o 14.29297 6.621880 1.506724       5.477644 1.506724       5.477644 0.000000       0.000000 14.29297 6.621880 ?        ?        0.000000       6.621880 
1 1 1 -3  12 50 o 15.70938 6.371110 4.623734       3.801346 1.618965       5.369983 7.641816       5.381866 13.83661 6.459568 17.87621 7.448705 -4.039600      9.859474 
1 1 1 -3  13 1  o 305.0525 4.245691 1134.293       31.56161 1109.316       49.11518 1151.862       41.19248 301.5882 6.682906 307.3652 5.499550 -5.777039      8.654841 
1 1 1 -3  13 2  o 493.6307 6.479015 2971.677       77.93764 2969.664       123.0416 2973.026       100.7202 493.1312 10.23890 493.5938 8.373569 -0.4625854     13.22693 
1 1 1 -3  13 3  o 429.1806 6.373471 2246.235       66.65799 2248.241       94.22596 2244.225       94.31136 429.1903 9.009165 428.8054 9.025424 0.3849182      12.75239 
1 1 1 -3  13 4  o 808.2109 10.36592 7976.174       204.1591 7939.741       262.7706 8031.662       324.2863 805.7831 13.38204 809.6947 16.43506 -3.911560      21.19411 
1 1 1 -3  13 5  o 356.4554 4.838600 1548.858       42.03016 1559.935       54.51623 1532.625       65.99425 357.6740 6.254641 354.4639 7.640081 3.210114       9.873772 
1 1 1 -3  13 6  o 606.5947 8.801134 4489.669       130.0988 4618.588       187.3826 4369.688       180.7705 614.8017 12.50714 598.0200 12.40440 16.78168       17.61527 
1 1 1 -3  13 7  o 794.7880 10.19832 7710.513       197.5222 7450.412       305.0703 7898.251       259.1829 780.2428 16.04479 803.9167 13.22998 -23.67389      20.79586 
1 1 1 -3  13 8  o 905.9515 11.59008 10022.30       255.8747 10364.01       414.3917 9811.738       325.2946 919.7125 18.48940 895.7439 14.90242 23.96863       23.74743 
1 1 1 -3  13 9  o 143.9057 2.935231 252.3603       10.29334 257.7021       20.82838 250.6340       11.84028 145.2714 5.895798 143.4094 3.388037 1.862000       6.799943 
1 1 1 -3  13 10 o 336.3427 4.609044 1378.843       37.77712 1396.150       60.35861 1367.698       48.43711 338.3610 7.320198 334.9438 5.934309 3.417145       9.423445 
1 1 1 -3  13 11 o 619.6183 10.38690 4685.996       156.8361 4502.042       186.7160 5126.784       289.0294 607.0861 12.62104 646.6699 18.35960 -39.58380      22.27926 
1 1 1 -3  13 12 o 288.8846 4.564645 1017.197       32.13420 1005.495       45.38547 1028.960       45.50402 287.1675 6.485529 290.5008 6.427859 -3.333282      9.131235 
1 1 1 -3  13 13 o 709.9816 11.80334 6156.914       204.2152 6218.039       355.8286 6126.893       249.3729 711.4449 20.54559 707.8160 14.45749 3.628967       25.12250 
1 1 1 -3  13 14 o 743.4977 10.69789 6749.949       193.8268 6922.344       279.0190 6589.168       269.4561 752.1036 15.22369 733.8134 15.06837 18.29028       21.42000 
1 1 1 -3  13 15 o 274.6968 4.394545 919.7803       29.41735 921.7462       41.88464 917.8665       41.32582 274.9348 6.251567 274.3581 6.181127 0.5767517      8.791384 
1 1 1 -3  13 16 o 389.7659 5.870359 1852.477       55.75767 1865.902       79.36733 1839.395       78.34903 391.0211 8.329242 388.2373 8.281334 2.783813       11.74550 
1 1 1 -3  13 17 o 637.1017 9.229620 4956.516       143.2942 4969.302       203.1786 4943.861       202.1228 637.2183 13.08440 635.5924 13.04970 1.625854       18.47961 
1 1 1 -3  13 18 o 424.8301 8.998770 2204.447       93.16109 2204.447       93.16109 0.000000       0.000000 424.8301 8.998770 ?        ?        0.000000       8.998770 
1 1 1 -3  13 19 o 610.9159 8.878789 4560.644       132.1817 4571.395       187.4223 4550.005       186.4477 610.7432 12.59292 609.3227 12.55664 1.420471       17.78345 
1 1 1 -3  13 20 o 270.3748 5.071840 891.7635       33.41704 897.5981       59.68472 889.0994       40.33121 270.7598 9.058466 269.8974 6.132060 0.8623962      10.93883 
1 1 1 -3  13 21 o 574.6140 8.394799 4039.128       117.5500 4164.940       169.9695 3923.780       162.7472 582.2974 11.97816 565.2494 11.81510 17.04803       16.82477 
1 1 1 -3  13 22 o 168.4387 3.255256 345.9472       13.36174 354.3600       19.31422 338.2250       18.50449 170.3455 4.657127 166.4265 4.566983 3.919022       6.522742 
1 1 1 -3  13 23 o 157.7985 3.165334 303.6575       12.17190 296.1566       17.23728 311.1175       17.19016 155.7003 4.547877 159.5989 4.424182 -3.898590      6.344807 
1 1 1 -3  13 24 o 87.55260 2.818617 93.57227       6.005857 88.02397       8.565409 98.93824       8.423497 84.81931 4.156635 89.96072 3.851320 -5.141411      5.666593 
1 1 1 -3  13 25 o 74.80543 4.005183 68.50738       7.274538 0.000000       0.000000 68.50738       7.274538 ?        ?        74.80543 4.005183 0.000000       4.005183 
1 1 1 -3  13 26 o 103.0602 2.860945 129.6571       7.178206 143.3423       10.57857 117.9784       9.772334 108.2729 4.016283 98.20606 4.092387 10.06683       5.733948 
1 1 1 -3  13 27 o 42.38342 3.613708 22.08882       3.696808 22.95597       5.309336 21.27279       5.150437 43.01408 5.168581 41.37547 5.224422 1.638615       7.349069 
1 1 1 -3  13 28 o 36.57558 4.048062 16.54411       3.547746 17.87399       4.951857 15.14156       5.085347 37.80769 5.538912 34.61377 6.259202 3.193916       8.358059 
1 1 1 -3  13 29 o 187.9176 3.511812 431.2950       16.08180 441.3785       23.09536 421.8040       22.40649 189.8057 4.997552 185.5540 4.959720 4.251740       7.040905 
1 1 1 -3  13 30 o 103.3738 3.291604 130.6434       8.281334 131.8913       10.40182 128.4833       13.68570 103.7684 4.121666 102.2043 5.515357 1.564056       6.885295 
1 1 1 -3  13 31 o 87.09118 2.974265 92.72499       6.303071 94.03288       8.817093 91.35804       9.013944 87.56833 4.143581 86.28970 4.300217 1.278625       5.971694 
1 1 1 -3  13 32 o 106.1884 3.053784 137.8544       7.894053 135.1483       10.82584 140.9271       11.53569 104.9760 4.240627 107.1697 4.426614 -2.193626      6.130075 
1 1 1 -3  13 33 o 69.44436 3.799476 59.19622       6.405293 59.77962       7.472818 57.58061       12.43567 69.69614 4.422679 67.72235 7.670196 1.973793       8.853926 
1 1 1 -3  13 34 o 133.5406 3.177047 218.0725       10.33887 208.3440       14.20657 229.0264       15.07476 130.2200 4.483565 136.5242 4.537414 -6.304199      6.378909 
1 1 1 -3  13 35 o 73.98571 3.278369 67.12054       5.896062 60.25544       7.880385 75.85069       8.886580 69.86128 4.655431 78.41362 4.671758 -8.552338      6.595329 
1 1 1 -3  13 36 o 29.75093 6.143409 11.37574       4.306371 5.940810       5.867278 17.72267       6.340466 23.18670 8.252516 37.04914 7.282505 -13.86244      11.00631 
1 1 1 -3  13 37 o 17.19216 6.989928 1.613112       4.589006 -17.47195      9.525740 7.381016       5.236740 15.45159 7.561399 24.35073 7.800669 -8.899141      10.86394 
1 1 1 -3  13 38 o 73.25885 3.299103 66.07851       5.874572 57.12755       7.783564 77.92603       8.954822 67.72195 4.746479 79.17205 4.662035 -11.45010      6.653091 
1 1 1 -3  13 39 o 66.19082 3.455277 54.17656       5.554058 49.17176       7.399518 60.63478       8.405560 62.58807 4.890294 69.49519 4.996715 -6.907112      6.991576 
1 1 1 -3  13 40 o 46.52671 4.996466 27.52388       5.576365 26.78652       6.979686 28.82516       9.272185 45.25232 6.517001 45.88393 8.608626 -0.6316109     10.79721 
1 1 1 -3  13 41 o 26.35389 6.050799 9.320652       3.803712 9.528110       4.797740 8.969599       6.241074 26.32991 7.248777 25.67402 8.535214 0.6558876      11.19798 
1 1 1 -3  13 42 o 15.41654 6.132580 2.013697       3.450607 3.659894       4.331737 -0.8446993     5.707979 18.31620 6.986978 16.11442 7.181472 2.201786       10.01955 
1 1 1 -3  13 43 o 27.52460 6.061279 10.55861       3.955411 7.408175       4.948342 16.13383       6.582715 22.72707 7.601055 32.61567 8.271389 -9.888599      11.23352 
1 1 1 -3  13 44 o 18.47376 6.574420 4.657973       3.723645 2.836927       4.709733 7.694242       6.081432 17.11119 7.033542 22.51547 8.344110 -5.404276      10.91306 
1 1 1 -3  13 45 o 23.01799 6.959511 8.344762       4.234241 9.846320       5.995091 6.850168       5.981173 23.88523 8.355833 20.86526 8.142823 3.019970       11.66728 
1 1 1 -3  13 46 o 17.33057 6.360264 4.429545       3.518799 2.870363       4.959549 6.010015       4.993289 16.43577 7.014076 19.35876 7.471676 -2.922997      10.24808 
1 1 1 -3  13 47 o 11.44522 5.432072 -2.579453      4.087514 -1.970783      4.889869 -3.991290      7.447292 12.77618 6.027104 14.33023 6.937724 -1.554047      9.190103 
1 1 1 -3  13 48 o 16.79758 6.960186 4.815974       4.661842 6.464156       5.658255 1.332626       8.225805 18.15948 7.607268 15.92406 7.599434 2.235419       10.75276 
1 1 1 -3  13 49 o 26.88547 6.615880 13.17188       4.304554 11.61420       6.111104 14.70579       6.064284 21.37923 8.261971 24.61623 8.413844 -3.236998      11.79207 
1 1 1 -3  13 50 o 11.48510 5.358459 -0.2759605     3.686014 -2.345141      5.094327 1.997573       5.339964 11.78870 5.714581 13.95628 6.490612 -2.167575      8.647802 
1 1 1 -3  14 1  o 302.4038 5.462840 1114.824       40.25704 1203.183       72.94890 1076.132       48.27321 313.8471 9.549267 297.0719 6.668198 16.77515       11.64703 
1 1 1 -3  14 2  o 322.8203 4.460140 1270.215       35.08693 1316.893       56.60177 1241.084       44.71451 328.6129 7.068209 319.0607 5.750943 9.552155       9.112240 
1 1 1 -3  14 3  o 815.5693 11.71343 8123.446       232.7990 8275.555       334.2000 7980.064       324.4705 822.1863 16.68015 807.4171 16.49078 14.76917       23.45577 
1 1 1 -3  14 4  o 392.4716 5.905445 1877.904       56.48029 1908.056       80.43188 1848.573       79.32990 395.4958 8.345459 389.2814 8.362520 6.214447       11.81433 
1 1 1 -3  14 5  o 120.0004 2.508747 175.4752       7.336276 172.1385       9.397985 180.6804       11.73798 118.8055 3.249152 121.6934 3.963418 -2.887947      5.125004 
1 1 1 -3  14 6  o 223.8512 3.083512 610.6473       16.82059 604.7070       23.66902 616.7084       23.90859 222.7429 4.360541 224.9424 4.361608 -2.199478      6.167490 
1 1 1 -3  14 7  o 515.3453 7.545509 3238.818       94.75954 3300.213       191.8701 3219.012       108.9774 519.2891 15.17848 513.6920 8.705575 5.597107       17.49781 
1 1 1 -3  14 8  o 471.0632 6.214970 2705.366       71.34348 2739.595       113.8999 2683.266       91.52164 473.8171 9.864531 469.0420 8.007113 4.775116       12.70523 
1 1 1 -3  14 9  o 713.5582 9.194541 6212.178       159.8805 6105.505       250.2718 6285.727       207.8125 706.7001 14.53251 717.4490 11.88624 -10.74890      18.77436 
1 1 1 -3  14 10 o 163.0583 3.202612 324.0143       12.72575 297.6187       17.38877 354.4549       18.67370 156.1951 4.573337 170.4727 4.499033 -14.27765      6.415349 
1 1 1 -3  14 11 o 190.9422 3.445365 444.3219       16.03147 434.8804       22.69361 453.7274       22.65029 188.8182 4.936241 192.9341 4.817578 -4.115845      6.897502 
1 1 1 -3  14 12 o 673.4377 11.22446 5538.354       184.2039 5586.691       320.7852 5514.575       224.9969 674.5527 19.53530 671.6120 13.74744 2.940735       23.88766 
1 1 1 -3  14 13 o 529.0496 7.746119 3414.264       99.86577 3390.132       140.7776 3438.709       141.6899 526.8735 10.96455 530.6357 10.95737 -3.762146      15.50114 
1 1 1 -3  14 14 o 336.0548 5.176785 1376.788       42.39418 1333.141       59.00344 1423.366       60.95293 330.5933 7.323980 341.5974 7.322239 -11.00409      10.35644 
1 1 1 -3  14 15 o 369.5334 5.609040 1665.047       50.51012 1652.696       71.39318 1677.425       71.47108 368.0259 7.960534 370.7724 7.910188 -2.746460      11.22235 
1 1 1 -3  14 16 o 236.7474 3.964665 683.2083       22.87325 673.2113       32.39488 693.1470       32.30064 234.9595 5.657796 238.4164 5.559540 -3.456940      7.932159 
1 1 1 -3  14 17 o 328.4319 7.231018 1316.375       57.87364 1316.375       57.87364 0.000000       0.000000 328.4319 7.231018 ?        ?        0.000000       7.231018 
1 1 1 -3  14 18 o 208.9510 4.318533 532.3387       21.98958 544.6931       26.98012 507.8944       37.95102 211.3282 5.239023 203.8075 7.654904 7.520706       9.276040 
1 1 1 -3  14 19 o 386.4045 6.769385 1822.951       63.74226 1796.665       110.8811 1835.926       77.90126 382.6129 11.90668 387.5862 8.247837 -4.973358      14.48433 
1 1 1 -3  14 20 o 93.30268 3.323361 106.2688       7.544207 86.75065       14.26316 113.8504       8.889490 83.97372 7.034647 96.55209 3.785484 -12.57837      7.988501 
1 1 1 -3  14 21 o 148.6313 3.093687 269.3416       11.20528 267.4022       16.12121 271.1543       15.58568 147.9764 4.475779 149.0249 4.296196 -1.048523      6.204022 
1 1 1 -3  14 22 o 143.0977 3.042630 249.6879       10.61006 257.1248       15.46822 243.0799       14.58086 145.0890 4.379930 141.0777 4.246030 4.011261       6.100210 
1 1 1 -3  14 23 o 73.88747 2.868328 66.67281       5.154778 63.62132       7.496279 69.41003       7.099782 72.06863 4.287765 75.32098 3.881146 -3.252357      5.783444 
1 1 1 -3  14 24 o 175.1832 4.678812 375.1268       19.95608 0.000000       0.000000 375.1268       19.95608 ?        ?        175.1832 4.678812 0.000000       4.678812 
1 1 1 -3  14 25 o 36.07248 3.943812 16.07481       3.410372 19.07828       5.152347 13.73289       4.549671 39.10612 5.563352 33.01167 5.870726 6.094456       8.088035 
1 1 1 -3  14 26 o 47.37950 3.356123 27.53267       3.849856 30.44423       5.596669 24.91752       5.304138 49.69089 4.676854 44.87677 4.931329 4.814121       6.796393 
1 1 1 -3  14 27 o 95.36332 2.869740 111.0560       6.661402 114.1158       9.586352 108.1990       9.263245 96.55996 4.083209 94.02200 4.052458 2.537964       5.752826 
1 1 1 -3  14 28 o 104.8003 2.910405 134.1334       7.425598 122.0228       10.30655 147.2051       10.70770 99.81916 4.246751 109.6811 4.012921 -9.861984      5.842811 
1 1 1 -3  14 29 o 65.16502 3.387652 52.00237       5.361123 52.21005       6.798002 51.66072       8.719180 65.19527 4.302929 64.67066 5.587386 0.5246124      7.052239 
1 1 1 -3  14 30 o 104.1013 2.975325 132.4203       7.540169 135.7783       10.76553 129.1867       10.56414 105.2663 4.205182 102.6715 4.231358 2.594742       5.965563 
1 1 1 -3  14 31 o 69.25466 3.183085 58.71463       5.357601 67.93785       7.544154 49.33005       7.609858 74.38808 4.178500 63.23491 4.978496 11.15318       6.499637 
1 1 1 -3  14 32 o 26.76828 6.610360 9.187674       4.286071 6.452390       4.842160 19.08665       9.211555 23.16738 7.508250 38.32710 9.819406 -15.15972      12.36101 
1 1 1 -3  14 33 o 144.0123 3.239172 253.5764       11.36762 259.3105       16.07758 247.8441       16.07491 145.3187 4.545665 142.0406 4.650351 3.278091       6.502986 
1 1 1 -3  14 34 o 87.26141 3.103161 93.23675       6.588258 94.31861       9.181736 92.08860       9.458852 87.56730 4.316055 86.48719 4.503490 1.080109       6.237768 
1 1 1 -3  14 35 o 109.4306 3.472463 146.8380       9.248307 141.6972       14.43080 150.4211       12.04760 106.9686 5.555058 110.5277 4.482242 -3.559074      7.137867 
1 1 1 -3  14 36 o 116.0517 3.151663 165.1059       8.904817 158.3959       12.23876 172.6541       12.98058 113.3267 4.440279 118.3020 4.510890 -4.975357      6.329629 
1 1 1 -3  14 37 o 104.7222 3.850001 135.1433       9.808348 153.2952       19.30654 128.8285       11.38734 110.0136 7.241754 101.9999 4.593060 8.013771       8.575500 
1 1 1 -3  14 38 o 36.83227 4.614478 17.08243       4.051134 16.24600       5.503157 18.07193       5.985530 35.32566 6.636324 37.23584 6.848669 -1.910175      9.536512 
1 1 1 -3  14 39 o 27.76986 6.401089 10.19469       4.242954 8.404181       5.053298 14.47362       7.811860 25.23041 7.597321 32.40221 9.366522 -7.171804      12.06031 
1 1 1 -3  14 40 o 17.93837 6.455573 3.657209       3.600763 4.182308       4.602842 2.829033       5.780522 19.53828 7.255771 19.39637 7.860125 0.1419144      10.69709 
1 1 1 -3  14 41 o 54.03315 4.068626 36.89852       5.317924 27.61963       7.302408 47.37613       7.759774 45.24105 6.836716 60.52853 5.314715 -15.28748      8.659496 
1 1 1 -3  14 42 f 29.85631 5.493912 11.97137       3.849935 13.70628       5.052784 9.570055       5.944523 31.28134 6.821097 25.66572 8.319220 5.615620       10.75810 
1 1 1 -3  14 43 o 20.83239 6.488892 6.140081       3.646883 5.461914       4.650538 7.223144       5.877076 20.13099 7.323789 22.45669 8.223306 -2.325699      11.01184 
1 1 1 -3  14 44 o 30.92158 6.497103 14.06975       4.739871 9.272936       6.554824 19.32685       6.862108 23.75346 8.686709 34.60343 8.253774 -10.84997      11.98264 
1 1 1 -3  14 45 f 21.17608 6.530837 6.959610       3.704639 10.11582       4.842464 2.505477       5.752613 24.75345 7.433427 17.01381 7.408165 7.739641       10.49461 
1 1 1 -3  14 46 o 21.32520 6.660497 7.436538       3.839538 7.993751       5.393499 6.864013       5.467102 21.14225 7.853731 19.97503 7.788008 1.167225       11.06048 
1 1 1 -3  14 47 o 11.57572 5.531600 -2.949442      4.388915 -5.332439      5.323898 2.105186       7.753763 11.72500 5.719370 16.61923 7.759737 -4.894231      9.639747 
1 1 1 -3  14 48 o 15.14395 6.533313 3.243093       4.390947 2.294688       5.596246 4.762143       7.082489 15.01609 6.859716 16.78666 7.686833 -1.770566      10.30258 
1 1 1 -3  14 49 o 14.96250 6.303038 3.687913       3.918305 7.697716       5.716605 0.1347930      5.381231 18.07489 7.613647 13.29827 6.288233 4.776622       9.874689 
1 1 1 -3  15 1  o 112.6097 2.823468 154.6265       7.741979 155.0623       10.65842 154.1397       11.26431 112.7306 3.885660 112.3843 4.120011 0.3462601      5.663289 
1 1 1 -3  15 2  o 164.1383 3.174456 328.3171       12.69742 332.4557       17.86189 324.0894       18.05335 165.0975 4.443713 163.0013 4.549416 2.096191       6.359542 
1 1 1 -3  15 3  o 394.2477 5.927434 1894.874       56.94715 2005.421       117.9109 1861.243       65.03503 405.0724 11.95807 390.6987 6.830764 14.37366       13.77152 
1 1 1 -3  15 4  o 208.5597 3.240455 530.0754       16.46920 509.5165       25.36094 545.0676       21.65708 204.4509 5.090263 211.4768 4.202435 -7.025925      6.600852 
1 1 1 -3  15 5  o 275.8351 3.607122 927.2410       24.24635 927.7893       34.33240 926.6954       34.24679 275.8886 5.106628 275.7262 5.096896 0.1624756      7.214984 
1 1 1 -3  15 6  f 174.5168 4.668635 371.4826       19.83687 367.9843       28.31391 374.8551       27.80029 173.5947 6.705708 175.2205 6.522091 -1.625748      9.354368 
1 1 1 -3  15 7  o 283.2835 5.234265 978.2220       36.13376 1092.064       67.12797 931.7805       42.87525 299.0355 9.222829 276.4485 6.364382 22.58694       11.20562 
1 1 1 -3  15 8  o 792.0227 10.17910 7656.170       196.4640 8127.489       323.4880 7380.728       247.2957 814.9697 16.28848 777.2239 13.05673 37.74579       20.87565 
1 1 1 -3  15 9  o 173.7007 3.314270 367.6964       14.02896 357.7124       19.79391 377.7738       19.88631 171.2438 4.747882 175.9881 4.641025 -4.744293      6.639390 
1 1 1 -3  15 10 o 687.9694 9.932734 5776.933       166.5229 5922.918       239.7385 5640.835       231.4767 695.9900 14.13510 679.2396 13.98454 16.75043       19.88387 
1 1 1 -3  15 11 o 584.4520 9.824614 4169.467       139.9266 4123.529       240.0089 4193.121       172.2242 579.9459 17.00094 585.8417 12.06362 -5.895813      20.84617 
1 1 1 -3  15 12 o 474.7155 6.271409 2747.951       72.54955 2630.197       111.7758 2833.671       95.36771 464.1670 9.881836 481.9368 8.120358 -17.76987      12.79027 
1 1 1 -3  15 13 o 282.4207 4.518815 972.2727       31.09976 949.0798       43.71051 996.0502       44.25801 278.9696 6.429732 285.7923 6.354849 -6.822693      9.040218 
1 1 1 -3  15 14 o 955.3812 13.69562 11170.53       318.8559 11053.38       447.7984 11291.01       454.1288 948.2714 19.37822 958.3813 19.44485 -10.10986      27.45210 
1 1 1 -3  15 15 o 137.7505 3.059045 231.2596       10.26869 219.6291       14.62083 242.5813       14.42538 134.1483 4.478783 141.0041 4.202857 -6.855759      6.141947 
1 1 1 -3  15 16 o 511.7379 10.68318 3201.962       133.2245 3201.962       133.2245 0.000000       0.000000 511.7379 10.68318 ?        ?        0.000000       10.68318 
1 1 1 -3  15 17 o 322.3992 7.152290 1268.835       56.19210 1268.835       56.19210 0.000000       0.000000 322.3992 7.152290 ?        ?        0.000000       7.152290 
1 1 1 -3  15 18 o 195.9895 4.110399 468.3788       19.63147 541.9445       38.51812 442.5634       22.81745 210.5016 7.520941 190.4175 4.921394 20.08401       8.988029 
1 1 1 -3  15 19 o 210.3808 3.683498 539.6794       18.88438 534.0781       26.93764 545.0925       26.48130 209.1385 5.289785 211.3601 5.141385 -2.221558      7.376698 
1 1 1 -3  15 20 o 300.4827 4.755742 1101.749       34.82361 1079.375       48.98000 1124.620       49.52049 297.1931 6.763072 303.3665 6.698558 -6.173370      9.518919 
1 1 1 -3  15 21 o 171.3632 3.291135 358.1051       13.74356 350.0366       19.57764 365.9448       19.29803 169.2774 4.750670 173.0997 4.578910 -3.822281      6.598127 
1 1 1 -3  15 22 o 126.8841 2.929410 196.3230       9.057816 191.7702       12.99142 200.6297       12.63537 125.2757 4.261735 128.1574 4.050923 -2.881660      5.879827 
1 1 1 -3  15 23 o 86.56085 2.817904 91.47152       5.936147 92.31281       8.779109 90.76289       8.057227 86.86045 4.159645 86.15264 3.847494 0.7078094      5.666203 
1 1 1 -3  15 24 o 127.2959 4.128624 198.0648       12.79031 0.000000       0.000000 198.0648       12.79031 ?        ?        127.2959 4.128624 0.000000       4.128624 
1 1 1 -3  15 25 o 35.84365 3.890044 15.87020       3.343422 17.00809       4.936837 14.90613       4.544161 36.85678 5.678731 34.46593 5.602614 2.390846       7.977297 
1 1 1 -3  15 26 o 69.28920 2.900453 58.67594       4.886591 51.36980       6.989738 65.66065       6.834252 64.67882 4.462029 73.22516 3.843420 -8.546341      5.889107 
1 1 1 -3  15 27 o 104.6552 2.894139 133.7502       7.373930 125.6703       10.37884 141.9860       10.47850 101.3137 4.213017 107.7250 3.998532 -6.411278      5.808423 
1 1 1 -3  15 28 o 118.8833 3.347806 172.7222       9.689128 174.1429       12.38247 170.4785       15.56071 119.2607 4.267508 117.8201 5.434321 1.440628       6.909665 
1 1 1 -3  15 29 o 66.74488 3.067903 54.50651       4.976598 53.33196       7.092474 55.64564       6.984708 65.86880 4.444594 67.30958 4.280467 -1.440781      6.170641 
1 1 1 -3  15 30 o 29.56161 5.256926 11.03567       3.648219 8.798290       5.031813 13.51521       5.297129 26.35497 7.485498 32.51517 6.899141 -6.160196      10.17992 
1 1 1 -3  15 31 o 166.3710 3.355333 338.2903       13.60346 316.3324       18.75413 362.6712       19.76180 160.5547 4.798721 171.9415 4.720857 -11.38681      6.731583 
1 1 1 -3  15 32 o 62.53768 4.056576 48.09245       6.148763 46.17968       6.911947 55.34755       13.46140 61.18366 4.671159 66.14729 8.550939 -4.963627      9.743628 
1 1 1 -3  15 33 o 62.77245 3.393137 48.34717       5.171174 45.40899       7.054404 51.75977       7.602618 60.61145 4.815617 64.72837 4.855219 -4.116924      6.838371 
1 1 1 -3  15 34 o 88.13295 3.165778 95.14817       6.788108 99.80634       9.615735 90.52068       9.584014 90.04817 4.395268 85.70358 4.605860 4.344597       6.366500 
1 1 1 -3  15 35 o 25.54461 6.275198 8.420431       3.877603 5.716108       5.240391 11.69277       5.764523 22.42893 7.814492 29.98074 7.812511 -7.551805      11.04996 
1 1 1 -3  15 36 o 65.10107 3.416463 52.14107       5.401051 46.82830       7.269547 58.68724       8.069392 61.36637 4.901893 68.75497 4.847223 -7.388607      6.893775 
1 1 1 -3  15 37 o 55.08447 4.501670 37.77742       5.990156 34.12168       11.31877 39.19964       7.059845 50.51820 9.543897 55.91016 5.242816 -5.391964      10.88913 
1 1 1 -3  15 38 o 47.00205 3.975262 27.52294       4.510564 24.36950       6.060028 31.44004       6.754064 43.64480 5.844559 49.72134 5.675791 -6.076538      8.146992 
1 1 1 -3  15 39 o 33.41794 5.200801 14.36727       4.097578 16.70973       5.390582 11.16140       6.306261 35.63995 6.443850 28.63478 8.454787 7.005177       10.63046 
1 1 1 -3  15 40 f 49.83801 3.852104 31.18056       4.642085 37.77454       6.319407 23.45220       6.841422 54.45343 4.811742 41.79119 6.962621 12.66223       8.463508 
1 1 1 -3  15 41 o 52.82956 3.746716 35.19582       4.792220 36.40506       6.463281 33.71934       7.141859 53.01073 5.064765 50.46520 5.919833 2.545528       7.790781 
1 1 1 -3  15 42 o 42.98550 4.680756 24.12795       4.824036 22.51760       7.077222 25.52544       6.592929 39.45578 7.636709 42.97284 6.498505 -3.517056      10.02746 
1 1 1 -3  15 43 o 18.95000 6.988549 4.763062       4.256844 4.813188       5.088090 4.646130       7.771226 19.44516 7.532215 20.84643 8.833748 -1.401278      11.60902 
1 1 1 -3  15 44 o 22.40958 7.235847 7.885853       4.499722 2.101494       6.155540 14.52404       6.594220 17.37111 7.611290 28.95901 8.669303 -11.58790      11.53640 
1 1 1 -3  15 45 o 21.17574 6.483750 7.032648       3.659569 6.333721       4.953879 7.872254       5.429598 19.88203 7.497718 21.47606 7.897446 -1.594038      10.88969 
1 1 1 -3  15 46 o 15.82928 6.578083 3.108937       4.181102 3.123644       4.991737 3.074359       7.653812 16.32155 7.002647 17.59664 8.032347 -1.275089      10.65625 
1 1 1 -3  15 47 o 20.52469 8.074697 8.912599       5.921511 17.18240       9.571474 3.784734       7.537018 23.88723 9.941869 17.01898 7.843102 6.868250       12.66314 
1 1 1 -3  15 48 o 11.94799 5.559975 -0.4982625     3.927697 -3.780521      5.659857 2.550706       5.455010 12.15549 5.922198 14.94150 6.805232 -2.786018      9.021286 
1 1 1 -3  15 49 o 20.63484 6.848830 8.668262       4.018883 12.25702       5.982497 5.716795       5.425375 21.59412 8.217375 16.47895 7.184531 5.115168       10.91525 
1 1 1 -3  16 1  o 758.6902 9.762782 7024.090       180.4987 7246.523       291.3903 6885.603       229.9218 769.7212 15.53479 750.8022 12.56662 18.91901       19.98124 
1 1 1 -3  16 2  o 256.1326 4.860631 799.6476       30.33847 0.000000       0.000000 799.6476       30.33847 ?        ?        256.1326 4.860631 0.000000       4.860631 
1 1 1 -3  16 3  o 1003.020 12.82147 12290.28       313.3889 11901.49       484.2350 12570.49       411.0912 985.1313 20.17093 1013.483 16.64508 -28.35120      26.15196 
1 1 1 -3  16 4  o 636.9752 9.227763 4950.457       143.2370 4816.140       198.7236 5095.694       206.6438 627.8536 12.98838 645.7992 13.13072 -17.94562      18.46927 
1 1 1 -3  16 5  o 65.24548 2.795245 51.97069       4.434033 50.54363       6.741989 53.05843       5.886126 64.25105 4.331286 65.87943 3.681071 -1.628380      5.684217 
1 1 1 -3  16 6  o 452.9492 5.485854 2501.053       60.55218 2439.515       84.23707 2566.849       87.10222 447.2317 7.729201 458.7515 7.791402 -11.51984      10.97481 
1 1 1 -3  16 7  o 341.0929 7.435935 1418.937       61.80796 1328.340       84.02846 1525.739       91.23490 329.7055 10.47165 353.3657 10.60700 -23.66019      14.90516 
1 1 1 -3  16 8  o 684.9234 9.896126 5725.903       165.1746 5597.951       230.1601 5861.781       237.1825 676.6472 13.95827 692.3918 14.05706 -15.74463      19.80996 
1 1 1 -3  16 9  o 341.6065 4.709960 1422.449       39.20844 1385.487       61.17284 1448.221       51.08016 337.0352 7.448131 344.6401 6.082056 -7.604889      9.615927 
1 1 1 -3  16 10 o 146.9637 3.547875 263.2283       12.70617 273.0181       22.54722 258.6725       15.38107 149.5059 6.202157 145.6130 4.339453 3.892838       7.569518 
1 1 1 -3  16 11 o 152.9834 3.107685 285.2210       11.58557 284.9181       16.98972 285.4843       15.83961 152.8163 4.567393 152.9816 4.252954 -0.1653442     6.240890 
1 1 1 -3  16 12 o 309.5378 4.340148 1167.931       32.73817 1112.086       50.62011 1208.085       42.92357 301.9504 6.879413 314.7698 5.595859 -12.81940      8.867917 
1 1 1 -3  16 13 o 273.8314 3.944599 913.9858       26.32220 907.9249       41.92217 917.9302       33.81976 272.8404 6.305201 274.3877 5.057895 -1.547241      8.083184 
1 1 1 -3  16 14 o 408.1837 7.122884 2032.954       70.85126 2024.598       86.45857 2050.039       123.6271 407.2021 8.712883 409.1247 12.41437 -1.922546      15.16677 
1 1 1 -3  16 15 o 182.7294 4.079773 407.0551       18.16689 375.1373       21.22920 494.3709       35.11259 175.3261 4.973819 201.1373 7.175142 -25.81117      8.730494 
1 1 1 -3  16 16 o 266.2126 4.986753 864.3134       32.35061 857.0260       40.04218 878.0102       54.89655 265.0200 6.200161 267.9500 8.417716 -2.929962      10.45466 
1 1 1 -3  16 17 o 461.5959 9.703444 2607.247       109.1500 2520.129       152.6962 2698.271       156.0825 452.6116 13.86049 468.4041 13.68874 -15.79254      19.48062 
1 1 1 -3  16 18 o 502.3171 7.412628 3083.591       90.73738 3072.631       128.3740 3094.533       128.2702 500.6680 10.52183 502.4623 10.47577 -1.794342      14.84758 
1 1 1 -3  16 19 o 132.4695 3.016892 213.9411       9.738942 211.8666       14.26957 215.7500       13.32480 131.7050 4.452435 132.9309 4.118346 -1.225922      6.065059 
1 1 1 -3  16 20 f 265.2032 4.331899 858.2148       27.99582 834.2785       39.30912 882.8530       39.88121 261.2827 6.173715 268.7924 6.088571 -7.509674      8.670955 
1 1 1 -3  16 21 o 38.64302 3.691851 18.38326       3.434360 12.71171       5.352518 22.35221       4.477591 31.60546 7.120926 42.56989 4.378610 -10.96442      8.359415 
1 1 1 -3  16 22 o 52.83105 3.079103 34.15807       3.946965 38.68092       6.207407 31.08839       5.113876 56.09519 4.580821 50.28936 4.211545 5.805824       6.222622 
1 1 1 -3  16 23 o 73.02799 3.893301 65.28380       6.903528 0.000000       0.000000 65.28380       6.903528 ?        ?        73.02799 3.893301 0.000000       3.893301 
1 1 1 -3  16 24 o 86.78658 2.845030 91.97002       6.008806 103.7813       9.172151 83.08971       7.953101 92.09649 4.097137 82.39708 3.972556 9.699409       5.706815 
1 1 1 -3  16 25 o 71.49155 2.912325 62.45716       5.063147 58.21364       7.257328 66.48126       7.067201 68.88808 4.345252 73.67538 3.950754 -4.787308      5.872791 
1 1 1 -3  16 26 o 135.8217 3.069614 225.1307       10.15989 220.3876       14.49189 229.7155       14.24774 134.1947 4.437630 137.0300 4.271940 -2.835266      6.159710 
1 1 1 -3  16 27 o 213.9597 3.795400 559.2997       19.78908 573.3301       28.53207 546.2944       27.47010 216.2571 5.418374 211.1111 5.343950 5.146011       7.610294 
1 1 1 -3  16 28 o 117.7559 3.336986 169.4854       9.566100 168.0766       12.26657 171.6720       15.28216 117.1434 4.304359 118.2308 5.317791 -1.087364      6.841521 
1 1 1 -3  16 29 o 108.1284 2.969664 142.8589       7.817571 154.3586       11.47921 132.9124       10.67588 112.2445 4.204156 104.1423 4.215399 8.102165       5.953530 
1 1 1 -3  16 30 o 103.8628 2.985345 131.8518       7.548135 142.9499       11.11491 122.3530       10.28292 107.9824 4.232129 99.88763 4.234038 8.094734       5.986485 
1 1 1 -3  16 31 o 134.4919 3.130872 221.0248       10.26118 214.1978       14.40564 228.0562       14.61974 132.1263 4.480597 136.3538 4.405617 -4.227478      6.283726 
1 1 1 -3  16 32 o 82.29366 3.740397 83.06839       7.481408 78.32394       8.703670 96.49213       14.64017 79.78455 4.494768 88.04537 6.877986 -8.260818      8.216425 
1 1 1 -3  16 33 o 81.89883 3.168727 82.16055       6.312166 74.34052       8.678438 90.94435       9.197676 77.66366 4.606199 85.96625 4.405189 -8.302589      6.373599 
1 1 1 -3  16 34 o 28.42167 6.184727 10.38619       4.161577 6.793144       6.138142 13.44282       5.661436 24.35628 8.459122 32.20799 7.372740 -7.851707      11.22114 
1 1 1 -3  16 35 o 43.90351 4.140123 23.90779       4.377138 21.08049       5.926947 27.29986       6.491984 40.74946 6.160741 46.56044 5.850542 -5.810982      8.496091 
1 1 1 -3  16 36 o 51.43344 3.726414 32.69946       4.638928 34.01780       6.451516 31.28817       6.675064 52.13641 5.144888 49.86060 5.589782 2.275803       7.597075 
1 1 1 -3  16 37 o 26.60461 7.330213 9.311163       4.903953 15.34785       9.536898 7.141255       5.717793 33.72279 10.49164 24.13917 8.171218 9.583622       13.29825 
1 1 1 -3  16 38 o 42.01521 4.725608 22.29737       4.754587 20.72687       5.869444 25.29484       8.108781 39.97907 6.227367 43.51179 7.939844 -3.532719      10.09065 
1 1 1 -3  16 39 o 15.16881 6.029974 1.747773       3.333935 -1.417119      4.535570 5.467865       4.917328 14.26274 6.375834 21.31009 7.557972 -7.047340      9.888083 
1 1 1 -3  16 40 o 13.70824 5.852737 0.3175782      3.455973 1.203128       4.444993 -1.035954      5.495394 16.10228 6.743804 15.86989 7.061093 0.2323933      9.764114 
1 1 1 -3  16 41 o 24.25423 6.324609 8.139574       3.776176 13.70674       5.048919 1.071870       5.688799 31.35104 6.804353 17.36046 7.462416 13.99058       10.09886 
1 1 1 -3  16 42 o 58.92006 3.686172 44.26176       5.266154 41.33381       7.067488 47.91658       7.896158 55.66783 5.272692 59.75748 5.483423 -4.089657      7.607181 
1 1 1 -3  16 43 o 25.24451 8.070019 10.20864       5.606838 13.97695       6.917220 2.990251       9.573663 28.71849 8.935308 20.51653 9.210271 8.201965       12.83233 
1 1 1 -3  16 44 o 16.07979 6.392301 3.076410       3.746735 5.526006       4.942359 -0.2336158     5.745168 19.32633 7.440228 15.34991 6.988387 3.976420       10.20757 
1 1 1 -3  16 45 o 10.95416 5.137332 -2.126728      3.461835 0.7179628      4.973094 -4.801135      4.821951 14.81409 6.645205 11.66065 5.629968 3.153448       8.709494 
1 1 1 -3  16 46 o 15.53148 6.245002 3.307242       3.617625 4.514992       5.394087 2.319916       4.877079 17.34667 7.355583 15.40373 6.761343 1.942942       9.991014 
1 1 1 -3  16 47 o 21.89574 8.197521 10.76939       5.898691 14.10375       9.347585 8.563012       7.603846 21.55844 9.414203 19.17332 8.428351 2.385118       12.63583 
1 1 1 -3  16 48 o 25.09192 6.614017 11.54513       4.100714 10.65322       6.073810 12.29224       5.558908 20.63024 8.158748 23.00109 8.046151 -2.370852      11.45887 
1 1 1 -3  17 1  o 730.2491 10.53221 6509.949       187.4246 6298.387       365.5828 6585.380       218.2951 715.9621 20.97626 734.2283 12.20048 -18.26617      24.26634 
1 1 1 -3  17 2  o 422.8260 6.332430 2179.868       65.24816 2302.892       134.9845 2142.359       74.53412 433.9463 12.77866 419.1250 7.297523 14.82135       14.71557 
1 1 1 -3  17 3  o 259.2923 3.796197 819.3969       23.98692 783.1722       36.80969 846.1327       31.62322 253.4495 5.959840 263.4660 4.925444 -10.01651      7.731733 
1 1 1 -3  17 4  f 494.2337 6.516442 2978.488       78.48362 3128.911       128.1185 2888.133       99.29562 506.2688 10.38471 486.5609 8.374458 19.70782       13.34068 
1 1 1 -3  17 5  o 651.1207 9.425144 5173.950       149.5497 5187.699       211.8402 5160.291       211.1519 651.4637 13.34388 649.7418 13.33577 1.721924       18.86536 
1 1 1 -3  17 6  o 283.6368 5.231535 980.7321       36.15995 1030.340       45.54958 896.1883       59.46366 290.6844 6.430232 270.8516 9.021746 19.83273       11.07880 
1 1 1 -3  17 7  o 567.0952 7.400601 3922.560       102.2726 3926.563       132.1462 3916.582       161.5004 567.1873 9.560751 566.2214 11.70445 0.9659424      15.11298 
1 1 1 -3  17 8  o 592.8981 7.721281 4288.236       111.5592 4405.881       179.8297 4214.635       142.2375 600.4335 12.29024 587.5611 9.934017 12.87238       15.80300 
1 1 1 -3  17 9  o 118.8643 2.998566 172.2927       8.678696 152.5226       17.61727 178.6279       9.972737 111.6449 6.503510 121.0180 3.384972 -9.373085      7.331690 
1 1 1 -3  17 10 o 439.6047 5.863663 2356.481       62.81558 2413.774       101.2328 2320.610       80.10130 444.6544 9.342493 436.1370 7.536688 8.517395       12.00349 
1 1 1 -3  17 11 o 273.9029 4.461050 914.5501       29.77623 861.9969       40.79568 974.4667       43.56002 265.8535 6.297029 282.6645 6.323837 -16.81100      8.924320 
1 1 1 -3  17 12 o 377.0122 5.756971 1733.395       52.89146 1779.304       76.25431 1690.828       73.42549 381.8006 8.195807 372.1950 8.095435 9.605560       11.51987 
1 1 1 -3  17 13 o 389.9080 5.919461 1854.316       56.24455 1917.879       81.45055 1796.381       77.76125 396.3216 8.433546 383.5735 8.319140 12.74802       11.84621 
1 1 1 -3  17 14 o 97.19080 3.766371 115.3236       8.903516 106.8066       10.52044 136.8206       16.71404 93.47707 4.632849 105.6904 6.521237 -12.21335      7.999363 
1 1 1 -3  17 15 o 172.3464 3.840300 362.1329       16.12885 353.1122       20.30083 377.5728       26.55941 170.0842 4.903061 175.7890 6.209738 -5.704865      7.912070 
1 1 1 -3  17 16 f 139.5559 3.571926 237.6021       12.13751 209.2093       21.46138 250.9540       14.71726 130.7194 6.760199 143.3914 4.216378 -12.67206      7.967317 
1 1 1 -3  17 17 o 153.5038 3.181946 287.2704       11.90277 276.2335       17.14613 297.5364       16.53653 150.4038 4.683828 156.1237 4.350740 -5.719940      6.392745 
1 1 1 -3  17 18 o 231.2895 3.950477 652.4783       22.26597 642.0276       31.63123 662.7429       31.34835 229.3053 5.660643 232.9872 5.521364 -3.681931      7.907486 
1 1 1 -3  17 19 o 92.31853 2.900043 104.0153       6.516141 104.6744       9.776098 103.4884       8.740971 92.51649 4.348377 92.02248 3.906780 0.4940186      5.845623 
1 1 1 -3  17 20 o 22.49989 5.520427 6.432183       3.003698 3.855481       5.141035 7.767631       3.701109 20.48976 7.656660 24.72288 6.164662 -4.233126      9.829928 
1 1 1 -3  17 21 o 98.55157 2.852941 118.5417       6.844395 121.1840       10.25022 116.4156       9.194488 99.54431 4.235202 97.59262 3.873808 1.951691       5.739628 
1 1 1 -3  17 22 o 140.7204 4.235466 242.0126       14.50774 0.000000       0.000000 242.0126       14.50774 ?        ?        140.7204 4.235466 0.000000       4.235466 
1 1 1 -3  17 23 o 118.4668 3.434077 171.4091       9.903395 164.3681       18.95756 174.0518       11.61414 115.6064 6.758693 119.3269 3.999692 -3.720535      7.853500 
1 1 1 -3  17 24 o 96.32295 2.864907 113.2834       6.717281 114.2463       9.930557 112.4712       9.120406 96.61452 4.228127 95.89077 3.911233 0.7237549      5.759757 
1 1 1 -3  17 25 o 93.56718 2.874335 106.9179       6.546086 110.9811       9.782644 103.6233       8.808867 95.20535 4.227105 92.01939 3.937401 3.185951       5.776811 
1 1 1 -3  17 26 o 159.6250 3.253612 311.0587       12.65619 311.5852       18.15480 310.5610       17.65286 159.5296 4.675013 159.2867 4.552448 0.2428741      6.525376 
1 1 1 -3  17 27 o 61.55464 3.405067 46.41565       5.087767 47.12555       6.872317 45.55469       7.568309 61.89082 4.589253 60.76640 5.159661 1.124424       6.905313 
1 1 1 -3  17 28 o 148.9031 3.187461 270.7727       11.56604 269.9139       16.56879 271.5890       16.15284 148.4159 4.586650 148.8996 4.456648 -0.4836884     6.395238 
1 1 1 -3  17 29 o 20.68019 6.103992 5.339443       3.287428 8.093384       4.737528 2.781878       4.565494 25.31936 7.286613 18.52279 7.145661 6.796576       10.20565 
1 1 1 -3  17 30 o 36.88029 4.434216 16.89928       3.905330 15.87327       5.477265 17.96027       5.569840 35.32719 6.605142 37.69770 6.284158 -2.370518      9.116938 
1 1 1 -3  17 31 f 167.6629 4.046907 344.2812       16.53470 350.9948       20.02806 329.9107       29.30176 169.0279 4.867398 162.9923 7.396455 6.035599       8.854327 
1 1 1 -3  17 32 o 122.6668 3.110828 184.1019       9.291560 194.7176       13.58158 174.7622       12.73933 125.8906 4.434038 119.2669 4.390684 6.623688       6.240096 
1 1 1 -3  17 33 o 19.21015 6.896603 3.906211       4.106743 1.072216       6.231961 6.081539       5.459935 19.15863 8.001705 23.08015 7.980095 -3.921513      11.30085 
1 1 1 -3  17 34 o 58.99811 3.575070 42.83518       5.115825 39.31291       7.084663 46.67284       7.395053 56.18616 5.234549 61.31579 4.992340 -5.129627      7.233530 
1 1 1 -3  17 35 o 18.16203 6.497556 3.556135       3.641817 6.854663       5.025084 -0.9297328E-01 5.285384 23.58574 7.649142 16.77491 7.201561 6.810825       10.50580 
1 1 1 -3  17 36 o 22.09356 6.567799 6.242781       3.795027 4.197104       5.223781 8.529223       5.522638 20.54902 7.709956 25.77615 7.978072 -5.227129      11.09473 
1 1 1 -3  17 37 f 66.90658 4.664574 55.96876       7.557678 47.21861       11.85536 61.95927       9.809326 59.76069 8.369912 69.93558 5.808158 -10.17489      10.18774 
1 1 1 -3  17 38 o 56.72022 3.577933 39.98194       4.920255 33.66688       6.661639 47.56211       7.298467 51.37799 5.401380 61.36920 4.921508 -9.991215      7.307266 
1 1 1 -3  17 39 o 41.36012 4.326442 21.69366       4.296193 20.84914       5.862465 22.67332       6.314111 39.71759 6.264426 41.34303 6.479963 -1.625435      9.012932 
1 1 1 -3  17 40 o 32.59065 5.088816 13.91778       3.909503 18.40205       5.424732 9.071837       5.639250 36.97816 6.241985 25.40191 8.090359 11.57626       10.21843 
1 1 1 -3  17 41 o 22.67770 6.539800 7.217237       3.812498 11.98738       5.212233 1.728526       5.591052 28.75109 7.396998 17.58411 7.473749 11.16698       10.51535 
1 1 1 -3  17 42 o 38.52486 4.806926 19.77949       4.414868 13.20202       5.845818 28.51108       6.735387 29.20658 7.985804 45.05746 6.306718 -15.85088      10.17584 
1 1 1 -3  17 43 f 22.40005 7.302254 7.832423       4.576441 5.511622       5.151469 16.52173       9.967924 19.68714 7.591566 28.41472 10.65256 -8.727579      13.08086 
1 1 1 -3  17 44 o 12.26507 5.674660 -1.596566      4.002374 -2.083815      6.331074 -1.272206      5.165538 14.82889 6.952252 13.99512 6.465066 0.8337746      9.493729 
1 1 1 -3  17 45 o 16.97528 6.563894 4.234047       3.858884 8.716537       5.618838 0.2324148      5.308911 21.70869 8.024971 14.66332 6.691965 7.045377       10.44905 
1 1 1 -3  17 46 o 16.47997 6.771848 4.138207       4.363928 7.329058       5.618994 -0.7117437     6.927459 19.43673 7.794163 14.91395 7.076438 4.522774       10.52734 
1 1 1 -3  17 47 o 20.96629 7.340105 8.931595       4.626690 16.28650       9.374074 6.562884       5.319806 22.19911 9.561216 18.00172 7.444918 4.197388       12.11791 
1 1 1 -3  17 48 o 14.52065 6.178802 3.231969       3.829036 3.869836       6.025292 2.799854       4.959211 15.50819 7.097102 14.57607 6.578683 0.9321165      9.677186 
1 1 1 -3  18 1  o 273.8848 4.430426 914.3364       29.56988 903.3214       41.36653 925.8458       42.28483 272.1796 6.236737 275.5501 6.297206 -3.370544      8.862939 
1 1 1 -3  18 2  o 167.3381 3.807985 341.2852       15.52838 354.9543       27.07377 334.5839       18.95636 170.4854 6.528730 165.6083 4.701933 4.877136       8.045650 
1 1 1 -3  18 3  o 362.1250 6.407973 1599.082       56.54775 1738.054       103.1280 1539.334       67.61943 377.0542 11.23625 355.2265 7.811421 21.82773       13.68472 
1 1 1 -3  18 4  o 241.3167 4.696656 709.8569       27.61927 717.7151       48.12662 705.9978       33.72588 242.4050 8.158813 240.6335 5.751367 1.771515       9.982206 
1 1 1 -3  18 5  o 120.7133 3.496269 177.7413       10.27397 170.4993       17.74538 181.3928       12.60066 118.0852 6.188315 121.9170 4.247730 -3.831825      7.505895 
1 1 1 -3  18 6  o 451.9618 9.547566 2493.681       105.1551 2385.427       144.4502 2615.724       153.3744 441.4260 13.44406 462.2323 13.63111 -20.80627      19.14549 
1 1 1 -3  18 7  o 417.7065 7.259172 2128.387       73.89149 2110.532       127.3542 2137.449       90.72331 415.2792 12.59910 418.4734 8.896413 -3.194183      15.42347 
1 1 1 -3  18 8  o 190.6028 5.015368 443.2180       23.27505 475.4875       34.61507 416.5890       31.44465 197.2952 7.211806 184.6690 7.000089 12.62616       10.05044 
1 1 1 -3  18 9  o 97.78915 3.133637 116.6643       7.457864 96.20074       10.47232 137.7223       10.62332 88.69701 4.863660 106.2145 4.112082 -17.51749      6.369020 
1 1 1 -3  18 10 o 241.5074 4.726979 711.0919       27.81956 709.2319       34.29929 714.6681       47.56038 241.1537 5.836535 241.8412 8.081449 -0.6875763     9.968699 
1 1 1 -3  18 11 o 483.3056 7.168667 2850.399       84.42991 2805.420       118.2875 2897.114       120.5485 479.1166 10.13121 486.8794 10.16024 -7.762756      14.34824 
1 1 1 -3  18 12 o 34.16773 4.531404 14.48326       3.680054 22.28321       7.230832 11.75670       4.275143 42.12583 7.308615 30.52146 5.961818 11.60437       9.431814 
1 1 1 -3  18 13 o 615.2078 8.952017 4625.554       134.2081 4565.103       188.7450 4687.375       190.8707 610.2439 12.69217 618.3700 12.66645 -8.126099      17.93126 
1 1 1 -3  18 14 o 102.1359 3.245138 127.2918       8.066704 158.6452       17.39628 118.7036       9.104727 113.8346 6.295647 98.59862 3.796402 15.23603       7.351724 
1 1 1 -3  18 15 o 237.9903 3.600569 690.5763       20.88174 678.8173       33.37392 698.1415       26.76900 235.8307 5.807253 239.2409 4.591564 -3.410187      7.403151 
1 1 1 -3  18 16 o 100.5320 2.982651 123.3175       7.298984 127.7223       11.17270 120.0378       9.640586 102.2241 4.496064 99.12859 3.999086 3.095459       6.017249 
1 1 1 -3  18 17 o 324.3407 5.086207 1284.048       40.20052 1266.980       56.84207 1301.128       56.86216 321.8835 7.246612 326.2076 7.153082 -4.324036      10.18234 
1 1 1 -3  18 18 o 80.36124 2.965116 78.84915       5.796678 69.34922       8.701372 86.42915       7.772521 75.22337 4.771367 84.08756 3.802940 -8.864197      6.101500 
1 1 1 -3  18 19 o 219.0587 3.834559 585.4966       20.46973 558.6103       28.68418 613.3975       29.22040 213.7431 5.511588 224.0716 5.351348 -10.32851      7.682091 
1 1 1 -3  18 20 o 184.5944 3.468754 415.7176       15.60372 401.5350       22.19333 429.5818       21.94278 181.2213 5.030341 187.4759 4.806937 -6.254547      6.957800 
1 1 1 -3  18 21 o 207.6963 5.169415 527.2762       26.16413 0.000000       0.000000 527.2762       26.16413 ?        ?        207.6963 5.169415 0.000000       5.169415 
1 1 1 -3  18 22 o 355.5339 6.374500 1548.304       55.22849 1535.803       97.10277 1554.282       67.14700 351.9279 11.33728 355.7746 7.744895 -3.846741      13.73016 
1 1 1 -3  18 23 o 95.72679 2.883746 111.8878       6.719411 117.3123       10.19367 107.7197       8.935512 97.90102 4.283112 93.84107 3.916029 4.059952       5.803475 
1 1 1 -3  18 24 o 212.0416 3.767959 549.0870       19.46988 509.6062       26.84936 592.8720       28.27506 203.9592 5.406769 220.0932 5.271825 -16.13402      7.551509 
1 1 1 -3  18 25 o 80.96541 2.938448 80.10135       5.788057 74.34288       8.386798 85.33845       7.998124 77.85043 4.439182 83.48164 3.942666 -5.631210      5.937251 
1 1 1 -3  18 26 o 128.8474 3.411015 202.8886       10.70073 204.6532       13.89894 200.3204       16.76783 129.2764 4.418401 127.7414 5.398703 1.535034       6.976264 
1 1 1 -3  18 27 o 16.12688 5.921052 2.542578       3.050114 5.238148       4.738419 0.6354665      3.985622 21.59807 7.435608 15.40809 6.414356 6.189986       9.819992 
1 1 1 -3  18 28 o 193.2946 3.594217 456.6703       16.93012 471.4144       24.65672 443.5182       23.28752 195.9976 5.166868 190.1414 5.030280 5.856201       7.211119 
1 1 1 -3  18 29 o 105.5675 3.004615 136.2256       7.721704 130.8338       11.05391 141.3640       10.79111 103.2645 4.402775 107.3904 4.131193 -4.125809      6.037481 
1 1 1 -3  18 30 o 87.02573 3.063849 92.65269       6.487436 97.79780       9.490109 88.13911       8.888638 89.22823 4.377848 84.70577 4.320391 4.522461       6.150717 
1 1 1 -3  18 31 o 135.7336 3.835924 225.7962       12.67529 234.8354       15.35580 206.4683       22.45439 138.2598 4.563898 128.8459 7.179851 9.413925       8.507609 
1 1 1 -3  18 32 o 66.68494 3.642505 54.62206       5.896737 47.21329       9.385551 59.45379       7.579463 61.45514 6.358840 69.43745 4.503578 -7.982311      7.792115 
1 1 1 -3  18 33 o 45.50355 3.998793 25.60760       4.389098 28.93376       6.214965 22.29818       6.199308 48.11750 5.392974 41.96699 6.252335 6.150513       8.256867 
1 1 1 -3  18 34 o 27.97717 5.881357 10.07099       3.882259 17.89373       5.688116 3.248924       5.311862 37.38684 6.477876 19.79255 7.687975 17.59429       10.05325 
1 1 1 -3  18 35 o 44.10587 4.186063 24.19780       4.445368 18.77634       6.115596 30.27148       6.473019 38.11697 6.835016 49.04152 5.511648 -10.92455      8.780416 
1 1 1 -3  18 36 o 29.91959 6.633124 11.74281       4.709283 25.12435       9.993963 7.923509       5.339205 42.88226 9.780925 24.87328 7.866234 18.00899       12.55166 
1 1 1 -3  18 37 o 86.87093 3.211897 93.14584       6.787718 95.39706       9.659828 90.95020       9.539862 87.35506 4.553519 85.26330 4.608514 2.091766       6.478652 
1 1 1 -3  18 38 o 26.62973 5.830185 9.384300       3.678291 11.95180       5.213279 6.839121       5.190573 29.64801 7.271888 23.08912 7.785462 6.558891       10.65335 
1 1 1 -3  18 39 o 14.18574 5.956301 0.7537810      3.481088 4.518248       4.744877 -3.634274      5.122822 19.83985 7.367038 13.71812 6.372160 6.121721       9.740518 
1 1 1 -3  18 40 o 23.89217 6.347290 7.897981       3.757857 4.851325       4.903109 12.23546       5.850301 20.04775 7.480204 28.98833 8.013840 -8.940575      10.96244 
1 1 1 -3  18 41 o 34.47901 4.925399 15.81430       4.020930 16.94814       5.630922 14.63460       5.743662 34.37067 6.961811 31.42974 7.586324 2.940931       10.29656 
1 1 1 -3  18 42 o 40.21189 5.280971 22.14400       5.049977 20.33948       7.594305 23.57446       6.761512 35.08738 8.876602 39.69630 7.257024 -4.608917      11.46553 
1 1 1 -3  18 43 o 16.05223 6.668692 2.570936       4.295210 0.3818796      4.879626 10.10286       9.051300 14.86626 6.631631 23.46366 9.708119 -8.597391      11.75696 
1 1 1 -3  18 44 o 17.53771 6.501586 4.539146       3.692764 1.752621       5.109282 7.586764       5.343288 15.72169 6.910029 21.02987 7.816117 -5.308187      10.43265 
1 1 1 -3  18 45 o 17.19959 6.458803 4.626694       3.667618 5.469510       5.585968 3.988043       4.862545 18.28200 7.600833 16.83540 7.052321 1.446598       10.36860 
1 1 1 -3  18 46 o 21.04654 6.637233 7.900442       3.803634 7.179177       5.604516 8.516332       5.178955 18.92089 7.712775 20.43859 7.675061 -1.517700      10.88088 
1 1 1 -3  18 47 o 10.72467 5.198507 -3.479744      4.214275 1.339227       8.009329 -5.324687      4.955762 15.33322 7.365608 10.89063 5.354666 4.442592       9.106297 
1 1 1 -3  19 1  o 556.5494 8.154537 3779.772       110.5959 4012.143       229.8455 3709.762       126.1611 571.8400 16.51127 551.2361 9.391863 20.60388       18.99550 
1 1 1 -3  19 2  o 89.35842 3.111323 97.43124       6.764779 89.20335       9.080118 107.6946       10.14128 85.43288 4.376023 93.88824 4.445091 -8.455360      6.237661 
1 1 1 -3  19 3  o 550.2367 11.41491 3700.020       153.0588 3560.900       210.9186 3854.777       222.4576 538.7660 16.08293 560.5240 16.30342 -21.75800      22.90113 
1 1 1 -3  19 4  o 256.0164 3.795985 798.8929       23.68255 802.4586       37.30983 796.4868       30.64851 256.5234 5.968432 255.6013 4.920512 0.9221039      7.735219 
1 1 1 -3  19 5  o 163.3890 3.289881 325.3611       13.09903 354.0323       19.10498 299.9259       17.99451 170.3525 4.606390 156.7802 4.715269 13.57231       6.591858 
1 1 1 -3  19 6  o 224.8882 3.867191 616.4568       21.19328 594.8962       40.87184 624.3857       24.78575 220.6705 7.611928 226.3149 4.494204 -5.644409      8.839644 
1 1 1 -3  19 7  f 311.0269 4.380845 1179.296       33.20411 1195.373       52.83326 1168.800       42.68792 313.0204 6.926257 309.5872 5.658300 3.433258       8.943679 
1 1 1 -3  19 8  f 624.3573 8.135520 4758.672       123.7812 4687.836       193.6435 4807.614       160.9592 618.8301 12.84090 627.1635 10.53171 -8.333313      16.60740 
1 1 1 -3  19 9  o 63.09797 3.155356 48.64663       4.836370 52.92787       8.415061 46.53498       5.909942 65.66659 5.303772 61.65851 3.954114 4.008080       6.615513 
1 1 1 -3  19 10 o 74.48846 3.291164 67.76244       5.959382 63.49292       8.952269 71.15999       7.985945 71.97234 5.138039 76.27573 4.313977 -4.303391      6.708938 
1 1 1 -3  19 11 o 293.8286 4.701442 1052.827       33.66366 1053.878       48.34639 1051.838       46.90168 293.8450 6.751646 293.5749 6.555916 0.2701111      9.410885 
1 1 1 -3  19 12 o 282.8240 4.557936 975.4952       31.41381 955.9945       44.53840 994.7999       44.31413 279.8518 6.530860 285.4879 6.369693 -5.636047      9.122781 
1 1 1 -3  19 13 o 208.6084 4.357619 530.7280       22.15222 557.9525       39.89026 518.5885       26.63709 213.5474 7.677925 206.0947 5.308178 7.452728       9.334200 
1 1 1 -3  19 14 o 111.1955 2.658849 150.7131       7.204716 151.6729       12.25571 150.2062       8.906164 111.4161 4.523332 110.9477 3.297757 0.4683762      5.597833 
1 1 1 -3  19 15 o 90.60608 2.661707 100.1591       5.870603 91.56826       10.08387 104.5637       7.220366 86.49399 4.803016 92.55194 3.206225 -6.057953      5.774845 
1 1 1 -3  19 16 o 477.9320 6.352222 2791.389       73.98231 2909.459       120.7215 2720.375       93.62347 486.8125 10.17623 471.3645 8.150640 15.44794       13.03796 
1 1 1 -3  19 17 o 40.85771 3.374246 20.49813       3.329670 23.95969       6.326401 19.17187       3.915920 43.86210 6.082227 39.42290 4.137733 4.439205       7.356244 
1 1 1 -3  19 18 o 233.9309 4.002614 667.8070       22.81747 657.0561       32.47292 678.2917       32.06842 231.8506 5.747474 235.5882 5.585834 -3.737534      8.014673 
1 1 1 -3  19 19 o 152.6550 3.209187 284.2570       11.93829 295.2255       17.74553 275.1884       16.13564 155.4039 4.691249 150.0610 4.417282 5.342865       6.443616 
1 1 1 -3  19 20 o 196.6888 5.018114 473.0942       24.03264 0.000000       0.000000 473.0942       24.03264 ?        ?        196.6888 5.018114 0.000000       5.018114 
1 1 1 -3  19 21 o 145.1910 3.663285 257.4644       12.95089 277.9053       25.44917 250.3209       15.04465 150.3926 6.962919 143.0947 4.319366 7.297943       8.193850 
1 1 1 -3  19 22 o 148.7482 3.164767 269.9789       11.47174 280.6481       17.08419 261.2181       15.48102 151.4651 4.634009 146.1578 4.351363 5.307266       6.356761 
1 1 1 -3  19 23 o 145.9306 3.171782 259.8943       11.27940 271.1417       16.78751 250.6382       15.22908 148.8482 4.633785 143.1392 4.371075 5.709045       6.370106 
1 1 1 -3  19 24 o 78.98157 2.933653 76.22688       5.636574 78.06553       8.625031 74.85625       7.446774 79.78204 4.453966 78.17823 3.921345 1.603806       5.934202 
1 1 1 -3  19 25 o 19.72644 6.084356 4.764218       3.215324 -1.413120      5.115463 8.798621       4.134033 15.68121 6.902437 26.25114 6.497603 -10.56993      9.479582 
1 1 1 -3  19 26 o 21.68909 5.978610 5.952288       3.261380 13.05978       5.385204 1.835517       4.098474 31.95174 7.100511 16.83661 6.688067 15.11514       9.754357 
1 1 1 -3  19 27 o 136.9282 3.134348 228.9809       10.45867 234.8822       15.30336 223.8089       14.32650 138.4318 4.542586 135.1582 4.355409 3.273590       6.293224 
1 1 1 -3  19 28 o 99.01202 3.012691 119.8400       7.260611 133.2683       11.02878 109.5684       9.645747 104.2377 4.351336 94.52094 4.198138 9.716774       6.046361 
1 1 1 -3  19 29 o 176.6348 3.468729 381.4801       14.93079 375.4039       21.31684 387.3318       20.91940 174.8227 5.008837 177.6283 4.837329 -2.805603      6.963347 
1 1 1 -3  19 30 o 87.78116 3.834209 94.51926       8.182092 94.88249       9.637151 93.58138       15.48560 87.83652 4.517507 86.55887 7.412717 1.277657       8.680798 
1 1 1 -3  19 31 o 86.98524 3.886532 92.89472       8.217615 98.56767       9.751909 78.99984       15.26205 89.49667 4.485733 79.20090 8.017965 10.29577       9.187468 
1 1 1 -3  19 32 o 40.27956 4.394693 20.16543       4.243803 20.88996       6.256176 19.54789       5.775847 40.54152 6.556135 39.26185 6.245830 1.279663       9.055015 
1 1 1 -3  19 33 o 44.51359 4.015453 24.53841       4.308972 26.06051       6.513655 23.35397       5.745913 45.44503 6.030390 43.08492 5.605416 2.360111       8.233243 
1 1 1 -3  19 34 o 90.50386 3.116915 100.5393       6.864035 100.2040       9.893244 100.8506       9.531294 89.98857 4.525970 90.33395 4.342488 -0.3453751     6.272289 
1 1 1 -3  19 35 o 80.06769 3.217568 78.88647       6.265211 76.23935       9.081504 81.29056       8.654595 78.24635 4.785638 80.93708 4.404563 -2.690727      6.504038 
1 1 1 -3  19 36 o 18.63674 7.351584 2.816418       4.920059 13.88235       9.124597 -1.719860      5.842105 32.01612 10.30092 16.29358 7.263079 15.72254       12.60401 
1 1 1 -3  19 37 o 57.71262 3.577168 41.41240       5.006177 33.57012       6.851174 50.39644       7.332966 51.19109 5.582398 63.20267 4.796932 -12.01159      7.360280 
1 1 1 -3  19 38 o 46.68596 3.899858 27.40785       4.396318 20.67968       6.211419 34.16171       6.223264 39.30025 6.727499 51.66431 5.005653 -12.36406      8.385451 
1 1 1 -3  19 39 o 16.32717 6.381026 2.505698       3.677303 0.4169678      5.034694 4.894160       5.383827 16.14811 6.981287 20.57714 7.803564 -4.429035      10.47062 
1 1 1 -3  19 40 o 58.40375 3.715564 43.31108       5.260704 46.45661       7.375452 40.05341       7.505778 59.42354 5.143844 54.68378 5.716866 4.739758       7.690363 
1 1 1 -3  19 41 o 18.37149 6.976710 4.211205       4.306934 3.543939       6.607987 4.704025       5.678894 19.40983 8.181396 19.73839 7.862228 -0.3285580     11.34680 
1 1 1 -3  19 42 o 24.52807 6.515748 9.048628       3.960155 7.719746       5.239397 10.81952       6.048307 22.11074 7.805325 25.35519 8.401500 -3.244448      11.46771 
1 1 1 -3  19 43 o 16.75835 6.832657 3.375009       4.399503 -0.2697364     5.170438 12.93698       8.374665 14.62040 6.645860 25.25504 9.694749 -10.63464      11.75396 
1 1 1 -3  19 44 o 13.22596 5.763251 0.8969862      3.487234 -2.060416      5.061400 3.569532       4.811473 13.16676 6.186648 16.75946 7.017485 -3.592702      9.355197 
1 1 1 -3  19 45 o 10.86445 5.205932 -3.157035      3.945417 -1.920735      5.129560 -4.947889      6.173739 12.94306 6.125969 12.76141 6.210167 0.1816454      8.723168 
1 1 1 -3  19 46 o 13.01554 5.807184 1.091358       3.743678 0.3253055      5.568272 1.723259       5.057262 14.00482 6.551059 14.45600 6.571755 -0.4511843     9.279243 
1 1 1 -3  19 47 o 13.83430 6.215435 1.984809       4.369535 -2.618798      8.866934 3.461314       5.021598 14.28056 7.048385 15.14718 6.744055 -0.8666258     9.755102 
1 1 1 -3  20 1  o 356.9688 5.502172 1553.935       47.86307 1506.420       66.11111 1606.272       69.38469 351.3254 7.721982 362.7723 7.848621 -11.44693      11.01044 
1 1 1 -3  20 2  o 349.3246 5.397965 1488.054       45.95104 1392.176       62.14922 1603.671       68.24714 337.7515 7.550962 362.4864 7.726036 -24.73486      10.80318 
1 1 1 -3  20 3  f 285.2686 5.358301 992.3599       37.24923 1065.519       66.95364 959.5652       44.82714 295.2071 9.318707 280.4583 6.558985 14.74878       11.39555 
1 1 1 -3  20 4  o 256.5969 4.261382 802.6746       26.64637 800.9511       52.67129 803.2674       30.89103 255.9833 8.455174 256.6683 4.938829 -0.6850281     9.791936 
1 1 1 -3  20 5  o 79.41452 3.135055 76.98588       6.055180 76.49731       11.00865 77.19781       7.250500 78.98679 5.758877 79.49206 3.753500 -0.5052643     6.874113 
1 1 1 -3  20 6  o 60.21419 3.118377 44.30988       4.560174 44.10194       6.987695 44.46412       6.018427 59.94689 4.824039 60.25195 4.123844 -0.3050575     6.346451 
1 1 1 -3  20 7  o 273.7021 3.986444 913.2665       26.58887 938.6395       42.59995 897.0740       34.03148 277.3657 6.302608 271.2158 5.149081 6.149841       8.138544 
1 1 1 -3  20 8  o 479.0100 6.352172 2799.882       74.14860 2740.538       115.5044 2841.482       96.70602 473.3857 10.01261 482.3131 8.227887 -8.927399      12.95957 
1 1 1 -3  20 9  o 81.59577 3.128105 81.27354       6.208404 95.10535       13.35961 77.46365       7.011496 88.05741 6.266706 79.63120 3.622683 8.426216       7.238469 
1 1 1 -3  20 10 o 184.9107 3.554983 416.8448       16.01901 418.7843       23.18884 415.0745       22.15510 185.2123 5.142727 184.4037 4.934673 0.8085938      7.127316 
1 1 1 -3  20 11 o 429.1489 6.448119 2248.604       67.43372 2276.076       96.83045 2222.734       93.96544 431.3024 9.212849 426.2504 9.046222 5.052032       12.91165 
1 1 1 -3  20 12 o 176.3655 4.792790 379.7532       20.57952 409.8091       31.67658 357.8021       27.07080 183.0029 7.116604 171.0414 6.506635 11.96152       9.642736 
1 1 1 -3  20 13 o 155.4988 2.913290 294.7732       11.03944 262.6920       17.33337 316.6668       14.31916 146.6450 4.857126 161.1462 3.646377 -14.50116      6.073528 
1 1 1 -3  20 14 o 217.3766 3.415157 576.2158       18.09088 606.6860       29.91431 558.6462       22.71552 222.9051 5.507100 213.9824 4.356208 8.922668       7.021731 
1 1 1 -3  20 15 o 475.1061 6.326229 2759.090       73.24392 2692.936       114.4395 2804.991       95.32555 468.2544 10.02901 478.5343 8.174480 -10.27994      12.93844 
1 1 1 -3  20 16 o 37.42295 3.759162 17.25730       3.381809 16.58712       6.292778 17.52945       4.010111 36.15693 7.391644 37.63468 4.459061 -1.477745      8.632475 
1 1 1 -3  20 17 o 200.4872 3.665490 490.4173       17.90832 514.0055       26.44963 470.4506       24.33473 205.0338 5.298124 196.1747 5.094659 8.859055       7.350216 
1 1 1 -3  20 18 o 277.0677 5.242800 938.2116       35.39854 930.6941       62.73169 941.7236       42.87717 274.8825 9.378650 277.3903 6.343058 -2.507813      11.32226 
1 1 1 -3  20 19 o 93.35284 3.940711 106.5718       8.944587 0.000000       0.000000 106.5718       8.944587 ?        ?        93.35284 3.940711 0.000000       3.940711 
1 1 1 -3  20 20 o 182.5756 4.034804 407.0226       17.95152 396.5966       32.71329 411.5149       21.47351 179.6016 7.490874 183.4359 4.807920 -3.834305      8.901083 
1 1 1 -3  20 21 o 52.56458 3.359196 33.85767       4.280416 35.36844       7.276777 33.05835       5.292999 53.45789 5.672345 51.85088 4.225598 1.607018       7.073272 
1 1 1 -3  20 22 o 85.51727 2.981894 89.34173       6.204646 82.01714       9.343187 95.12028       8.298760 81.76594 4.708986 88.16573 3.872021 -6.399796      6.096482 
1 1 1 -3  20 23 o 165.1493 3.344328 332.9702       13.45928 321.7436       19.26553 343.6734       18.81118 162.0904 4.882959 167.5732 4.610929 -5.482819      6.715948 
1 1 1 -3  20 24 o 185.0769 3.999447 418.6443       18.03800 436.2403       23.51033 393.4640       28.12445 188.6736 5.118148 178.8693 6.462887 9.804276       8.244049 
1 1 1 -3  20 25 o 75.77083 3.034463 70.20128       5.591658 75.08719       8.799299 66.89187       7.241873 78.18877 4.638997 73.85778 4.039008 4.330994       6.150925 
1 1 1 -3  20 26 o 110.5571 3.025864 149.3568       8.144486 156.2256       12.33151 144.0424       10.84688 112.8807 4.491882 108.4384 4.112192 4.442337       6.089920 
1 1 1 -3  20 27 o 92.77581 3.023901 105.2303       6.827438 108.7785       10.18563 102.3354       9.200296 94.14582 4.452283 91.35349 4.143551 2.792336       6.082091 
1 1 1 -3  20 28 o 102.4711 3.033356 128.3856       7.566283 128.8666       11.17210 127.9780       10.28370 102.4532 4.485670 102.1558 4.139527 0.2974167      6.103845 
1 1 1 -3  20 29 o 114.1361 3.090906 159.3263       8.589047 161.6785       12.67447 157.3288       11.67989 114.7275 4.542403 113.2301 4.240417 1.497353       6.214062 
1 1 1 -3  20 30 o 182.9809 4.246286 410.6178       18.93438 403.6930       22.75726 426.1943       34.13118 181.0802 5.162455 184.9652 7.588366 -3.885025      9.177920 
1 1 1 -3  20 31 o 65.92769 3.650445 53.41183       5.841858 49.15107       10.01471 55.60943       7.192308 62.60571 6.666724 67.14405 4.420252 -4.538342      7.998990 
1 1 1 -3  20 32 o 63.30244 3.458955 49.25824       5.315547 41.04578       7.809205 56.34816       7.255894 57.32179 5.664474 67.53562 4.433329 -10.21383      7.193099 
1 1 1 -3  20 33 o 186.3870 3.616744 426.6074       16.42743 433.5143       23.81234 420.3351       22.69191 187.0288 5.229787 184.2620 5.058367 2.766830       7.275834 
1 1 1 -3  20 34 o 37.56806 4.525500 17.69796       4.059712 26.94725       6.402115 11.47739       5.250300 46.11154 5.827314 29.54215 7.328511 16.56939       9.362941 
1 1 1 -3  20 35 o 60.49115 4.825577 45.83850       7.054467 37.63066       12.25468 49.90643       8.627283 52.50439 9.941818 62.80451 5.698970 -10.30012      11.45941 
1 1 1 -3  20 36 o 89.53181 3.672021 99.39621       7.994586 109.4311       15.58084 95.81014       9.314153 91.89738 7.010384 87.57929 4.378095 4.318092       8.265180 
1 1 1 -3  20 37 o 35.98684 4.644139 16.54067       3.977865 11.63041       5.603990 21.52723       5.647360 29.05363 7.766037 40.62007 5.875658 -11.56644      9.738310 
1 1 1 -3  20 38 o 60.37489 3.481388 45.60611       5.100341 40.51642       7.090469 51.06339       7.342052 55.96335 5.260886 63.16741 4.805737 -7.204056      7.125450 
1 1 1 -3  20 39 o 23.65901 6.176118 7.735860       3.598353 7.129136       4.978061 8.399766       5.207359 22.69973 7.624268 24.29772 7.778251 -1.597992      10.89177 
1 1 1 -3  20 40 o 24.01391 6.705897 8.306970       4.073978 5.115979       6.312200 10.58523       5.333596 20.72227 8.277431 26.53966 7.759189 -5.817394      11.34552 
1 1 1 -3  20 41 o 19.55935 6.625923 5.486675       3.759692 5.978281       5.071981 4.887093       5.601361 20.43233 7.611030 19.55136 7.801536 0.8809681      10.89916 
1 1 1 -3  20 42 o 15.85514 6.704821 2.190789       4.461532 3.663115       5.247797 -1.648173      8.473873 17.75014 7.372376 17.07881 8.018546 0.6713314      10.89261 
1 1 1 -3  20 43 o 12.11597 5.545277 -0.9633887     3.679696 0.5783045      5.326814 -2.370538      5.089074 15.12871 6.824036 13.18584 6.198102 1.942864       9.218673 
1 1 1 -3  20 44 o 12.79503 5.853332 -0.4222588     4.093549 -3.956182      5.327631 4.671140       6.396014 12.42479 5.978451 17.89662 7.801727 -5.471835      9.828979 
1 1 1 -3  20 45 o 14.74180 6.199903 2.792701       3.781295 0.1239389      5.586566 5.049058       5.136817 14.15817 6.602680 17.20353 7.230180 -3.045355      9.791368 
1 1 1 -3  20 46 o 19.28608 6.837995 7.176874       4.024824 6.951863       5.864739 7.377192       5.533604 18.02683 7.657919 18.48654 7.614030 -0.4597054     10.79894 
1 1 1 -3  21 1  o 194.7168 3.594811 462.1879       17.05750 468.8235       24.03821 455.4578       24.20861 196.0003 5.036969 193.1775 5.147121 2.822800       7.201660 
1 1 1 -3  21 2  o 312.1670 5.704942 1188.780       43.39846 1093.859       71.06890 1245.223       54.80309 298.9409 9.768814 319.3916 7.041180 -20.45074      12.04192 
1 1 1 -3  21 3  o 249.0624 4.189176 756.3260       25.42570 673.8952       47.12019 790.1850       30.19943 234.7320 8.250389 254.5469 4.868496 -19.81494      9.579727 
1 1 1 -3  21 4  o 323.7285 5.866371 1278.635       46.27927 1291.743       79.99898 1272.043       56.73680 324.8011 10.11955 322.7829 7.213038 2.018158       12.42711 
1 1 1 -3  21 5  o 116.3486 3.040298 165.1152       8.612738 171.8656       12.03112 158.0193       12.33506 118.6512 4.167473 113.7484 4.458635 4.902794       6.103053 
1 1 1 -3  21 6  o 250.4818 3.753361 764.9252       22.91040 789.5449       36.79183 749.3325       29.28005 254.3665 5.935473 247.8661 4.847508 6.500412       7.663431 
1 1 1 -3  21 7  o 350.7776 4.851408 1500.837       41.47016 1418.203       63.12614 1563.577       55.00445 340.7195 7.602847 357.9025 6.306625 -17.18304      9.878097 
1 1 1 -3  21 8  o 122.4965 3.019267 182.9138       9.012835 166.4875       12.06610 203.6463       13.55570 116.7644 4.247608 129.1508 4.313188 -12.38637      6.053575 
1 1 1 -3  21 9  o 292.3619 4.707292 1042.686       33.53729 1129.453       71.07092 1017.831       38.03880 303.5727 9.619260 288.8028 5.404921 14.76990       11.03374 
1 1 1 -3  21 10 o 411.9622 6.250453 2072.501       62.74873 2183.322       92.64548 1978.578       85.29033 422.3251 9.002046 402.0963 8.704295 20.22882       12.52204 
1 1 1 -3  21 11 o 186.9831 3.526608 426.3354       16.06925 455.7457       34.07142 417.9220       18.22336 192.9451 7.259315 185.1062 4.039906 7.838852       8.307737 
1 1 1 -3  21 12 o 262.3821 3.899632 839.7228       24.93412 802.7298       39.03669 865.2162       32.40611 256.3242 6.249528 266.2447 4.994705 -9.920471      8.000230 
1 1 1 -3  21 13 o 224.6262 3.511480 615.3821       19.22148 603.2798       30.66920 623.2111       24.66721 222.1631 5.669560 225.9825 4.479290 -3.819305      7.225507 
1 1 1 -3  21 14 o 428.5530 7.463311 2248.602       77.94212 2247.846       96.05080 2250.057       133.3718 427.9423 9.210425 426.4949 12.84723 1.447357       15.80770 
1 1 1 -3  21 15 o 284.9250 4.629906 991.2027       32.14688 981.1121       45.62733 1001.149       45.29955 283.1681 6.612181 286.0654 6.498190 -2.897369      9.270782 
1 1 1 -3  21 16 o 98.28389 3.495483 117.9987       8.358600 133.1342       16.45190 112.7324       9.704406 104.0959 6.518261 96.01106 4.157595 8.084816       7.731321 
1 1 1 -3  21 17 o 254.8537 4.255185 793.0305       26.42686 864.9375       57.76360 773.9958       29.71949 265.0692 8.955359 251.6991 4.845332 13.37007       10.18213 
1 1 1 -3  21 18 o 130.4774 3.413191 207.8719       10.84323 0.000000       0.000000 207.8719       10.84323 ?        ?        130.4774 3.413191 0.000000       3.413191 
1 1 1 -3  21 19 o 91.68641 2.613561 102.6039       5.833515 108.7774       10.45690 99.81454       7.028896 94.24492 4.566711 90.39155 3.196003 3.853371       5.573983 
1 1 1 -3  21 20 o 159.6176 3.300835 310.9289       12.83928 308.3470       18.76839 313.2000       17.60259 158.7324 4.857768 160.0248 4.518438 -1.292358      6.634319 
1 1 1 -3  21 21 o 114.4540 3.032764 159.9608       8.451290 158.9903       12.74970 160.7215       11.28733 113.9448 4.601118 114.6290 4.047086 -0.6841965     6.127739 
1 1 1 -3  21 22 f 91.11349 3.027749 101.4249       6.713284 92.60545       10.20805 108.1463       8.911516 86.86851 4.841341 94.00612 3.898549 -7.137611      6.215888 
1 1 1 -3  21 23 o 157.1723 3.731331 301.7996       14.29144 310.3400       18.80517 290.1233       21.98840 159.1608 4.854147 153.6876 5.881947 5.473175       7.626274 
1 1 1 -3  21 24 o 145.7919 3.222583 259.5485       11.44916 260.4666       16.95523 258.7789       15.52256 145.7824 4.779142 145.3755 4.386653 0.4068909      6.487135 
1 1 1 -3  21 25 o 59.46513 3.287418 43.32346       4.745261 54.03415       7.968724 37.43864       5.906725 66.22184 4.974362 55.13147 4.433903 11.09037       6.663616 
1 1 1 -3  21 26 o 155.9132 3.316860 297.0079       12.60219 276.1735       17.97927 317.1298       17.66915 150.0177 4.924731 160.8578 4.511974 -10.84007      6.679138 
1 1 1 -3  21 27 f 69.61248 3.240583 59.34428       5.482176 60.89886       8.582231 58.27269       7.125377 70.27152 5.045274 68.85146 4.267748 1.420067       6.608212 
1 1 1 -3  21 28 o 126.4673 3.158659 195.4843       9.734582 201.2448       14.55438 190.8215       13.09460 127.9978 4.673959 124.7093 4.315312 3.288574       6.361431 
1 1 1 -3  21 29 o 178.7154 4.249571 391.6396       18.50730 415.8198       23.05688 347.8417       31.03119 183.8066 5.152668 167.0863 7.641396 16.72032       9.216340 
1 1 1 -3  21 30 o 69.71879 3.591745 59.68447       6.081700 52.65346       10.47546 63.25923       7.469423 64.82673 6.728819 71.66537 4.296755 -6.838638      7.983678 
1 1 1 -3  21 31 o 47.28365 3.886486 27.61761       4.438712 26.98612       6.740591 28.10110       5.898022 46.27036 6.128602 47.45068 5.184965 -1.180317      8.027678 
1 1 1 -3  21 32 o 43.28421 4.165537 23.25905       4.339570 22.80445       6.571201 23.61065       5.778997 42.27828 6.593113 43.29405 5.609299 -1.015766      8.656406 
1 1 1 -3  21 33 o 30.45998 5.407436 11.85976       3.866799 15.95806       6.090590 9.092393       5.004852 34.92025 7.388157 26.42715 7.451617 8.493097       10.49340 
1 1 1 -3  21 34 o 48.52379 4.220706 29.34979       4.941263 32.90918       6.982448 25.77906       6.993566 50.94554 5.723118 44.71460 6.617761 6.230942       8.749220 
1 1 1 -3  21 35 o 62.92410 4.066380 49.32039       6.201966 48.50961       12.58001 49.58072       7.128464 60.06596 8.860144 62.86743 4.686733 -2.801468      10.02335 
1 1 1 -3  21 36 o 17.92861 6.424119 3.659912       3.561438 1.119748       5.200413 5.903505       4.887413 17.26198 7.265958 21.82865 7.549987 -4.566677      10.47838 
1 1 1 -3  21 37 o 19.27691 6.383820 4.737515       3.492197 -1.205682      5.198076 9.626697       4.714662 15.34874 6.845878 26.44933 7.146709 -11.10059      9.896540 
1 1 1 -3  21 38 o 14.56376 5.922673 1.469643       3.295559 -0.1627763     4.555534 3.261890       4.773341 14.96849 6.553457 18.31924 7.236536 -3.350751      9.762953 
1 1 1 -3  21 39 o 16.66709 6.339872 3.092815       3.560142 7.436825       5.207140 -0.7201885     4.878513 22.84281 7.796850 14.81626 6.618631 8.026548       10.22727 
1 1 1 -3  21 40 o 23.07251 7.093455 7.925041       4.374583 7.186975       7.000921 8.397808       5.603136 22.38651 8.788096 23.41582 8.084629 -1.029305      11.94118 
1 1 1 -3  21 41 o 26.97335 6.290633 10.79575       4.058604 4.647320       5.816440 16.63020       5.665983 19.10661 7.830930 32.72343 7.291859 -13.61682      10.70022 
1 1 1 -3  21 42 o 30.19420 6.922468 14.34612       4.984591 14.81104       6.114577 13.42508       8.606254 29.14285 8.243003 25.48207 9.815975 3.660782       12.81798 
1 1 1 -3  21 43 o 36.23632 5.935019 19.85326       5.059587 10.29985       6.292927 37.32008       8.509036 22.99082 8.493831 46.98567 7.697873 -23.99485      11.46309 
1 1 1 -3  21 44 o 10.36835 4.941920 -2.676481      3.456152 -0.9555936     5.372396 -3.891543      4.514304 13.66407 6.405553 11.30916 5.457080 2.354917       8.414917 
1 1 1 -3  21 45 o 10.45987 4.983542 -2.309379      3.507358 -0.1722613     5.399820 -3.869008      4.612918 13.66501 6.411056 11.18927 5.427268 2.475735       8.399814 
1 1 1 -3  21 46 o 17.34736 6.634382 5.743159       3.912073 7.412151       5.714379 4.270937       5.366962 18.12840 7.622771 15.84539 7.018054 2.283019       10.36145 
1 1 1 -3  22 1  o 312.8577 5.727145 1194.538       43.66376 1255.659       77.51500 1166.130       52.84529 320.0897 9.949602 308.9904 7.018191 11.09927       12.17578 
1 1 1 -3  22 2  o 213.8699 3.808124 557.7208       19.84709 550.4820       27.63075 565.4366       28.52674 212.3367 5.344126 215.1952 5.444178 -2.858490      7.628811 
1 1 1 -3  22 3  o 114.7389 3.526092 160.6598       9.847467 138.5860       15.38317 175.9857       12.81799 106.3885 5.957354 120.0429 4.389136 -13.65446      7.399633 
1 1 1 -3  22 4  o 48.34539 3.941829 28.69017       4.603694 22.48622       5.952599 37.92414       7.262176 42.51715 5.904334 55.48262 5.441124 -12.96547      8.029134 
1 1 1 -3  22 5  o 241.3576 4.726694 710.6346       27.80062 646.3273       44.94487 750.4862       35.38120 229.7798 8.038993 247.9537 5.855524 -18.17390      9.945479 
1 1 1 -3  22 6  o 108.5232 3.019758 143.6840       7.978268 138.3162       10.82823 150.0589       11.80028 106.4110 4.183908 110.8301 4.377777 -4.419121      6.055578 
1 1 1 -3  22 7  o 233.3723 4.012567 664.2294       22.81959 677.1028       32.44564 651.6284       32.10066 235.5127 5.653351 231.0362 5.701615 4.476517       8.029246 
1 1 1 -3  22 8  o 239.9341 4.690856 702.4116       27.42711 676.6986       32.97219 760.1645       49.41491 235.4198 5.747364 249.1235 8.150651 -13.70364      9.973229 
1 1 1 -3  22 9  o 303.8111 6.858444 1128.226       50.77680 1150.067       73.40005 1108.181       70.31757 306.0651 9.854007 300.4886 9.615218 5.576477       13.76786 
1 1 1 -3  22 10 o 163.9287 3.869299 327.7889       15.45694 343.0008       27.99374 321.1171       18.53928 167.3508 6.878976 162.1420 4.696987 5.208862       8.329585 
1 1 1 -3  22 11 o 276.5487 4.549766 933.4065       30.66174 912.0289       43.22575 955.0563       43.50005 273.1284 6.494406 279.5126 6.386344 -6.384125      9.108387 
1 1 1 -3  22 12 o 245.9380 4.204439 738.1248       25.19822 726.5052       35.79507 749.5397       35.47836 243.7960 6.025049 247.6495 5.878817 -3.853546      8.417940 
1 1 1 -3  22 13 o 45.90180 4.651784 25.98759       5.131615 17.31693       9.421390 29.64499       6.118929 36.94459 10.15270 48.98883 5.205154 -12.04424      11.40925 
1 1 1 -3  22 14 f 350.2951 6.306630 1501.263       53.83536 1556.175       96.56357 1476.497       64.84869 354.9219 11.17857 347.0541 7.667749 7.867798       13.55562 
1 1 1 -3  22 15 o 74.47691 3.431818 67.81652       6.211738 64.80829       12.56423 68.78970       7.146210 72.36847 7.220715 74.97140 3.925179 -2.602928      8.218622 
1 1 1 -3  22 16 o 113.2747 3.009865 156.6193       8.301013 140.6787       17.69901 161.1146       9.398868 106.9410 6.827199 114.8650 3.361392 -7.923988      7.609837 
1 1 1 -3  22 17 o 250.3950 4.184946 765.6454       25.53593 740.5167       50.62832 774.2193       29.57322 245.2598 8.483701 251.7012 4.821444 -6.441376      9.758048 
1 1 1 -3  22 18 f 19.59161 5.575033 4.811551       2.788490 6.659004       5.673478 4.223119       3.201921 24.10889 8.139570 18.87019 6.104736 5.238705       10.17450 
1 1 1 -3  22 19 o 255.5852 3.826656 797.6948       23.83368 786.1432       38.12573 805.1048       30.53574 253.2796 6.177062 256.5916 4.883485 -3.312057      7.874295 
1 1 1 -3  22 20 o 115.3483 2.684582 162.3082       7.546124 146.1158       12.47274 171.6573       9.477454 109.2110 4.697603 118.5440 3.283936 -9.333023      5.731641 
1 1 1 -3  22 21 o 51.21663 3.027370 32.12502       3.761585 28.78955       7.071514 33.44123       4.442195 48.05880 6.181103 52.21420 3.511606 -4.155399      7.108967 
1 1 1 -3  22 22 o 71.02792 3.548042 61.77231       6.121766 58.46238       8.796014 64.88163       8.525301 68.88414 5.280246 72.64857 4.843216 -3.764435      7.165036 
1 1 1 -3  22 23 o 74.44232 3.160919 67.78500       5.721103 57.35764       8.907054 75.10827       7.464479 68.19207 5.404150 78.28884 3.925103 -10.09677      6.679167 
1 1 1 -3  22 24 o 73.56268 3.189437 66.21307       5.703934 68.98786       9.133677 64.43906       7.303102 74.86207 5.035955 72.46207 4.153206 2.400002       6.527631 
1 1 1 -3  22 25 o 152.4841 3.284607 284.0677       12.20518 281.5482       17.99663 286.2134       16.60829 151.4839 4.881530 152.8212 4.464481 -1.337296      6.615204 
1 1 1 -3  22 26 o 133.9734 3.183193 219.3086       10.39245 210.2611       15.28367 227.0893       14.17333 130.8623 4.800803 136.1102 4.278433 -5.247971      6.430606 
1 1 1 -3  22 27 o 173.5318 3.508654 368.3046       14.83733 365.2027       21.50228 371.1241       20.49990 172.3568 5.125104 173.8317 4.844068 -1.474976      7.052070 
1 1 1 -3  22 28 o 64.64771 5.815945 51.91943       9.064564 43.09903       12.81394 60.75441       12.82452 57.92215 9.400213 69.50477 7.700691 -11.58262      12.15173 
1 1 1 -3  22 29 o 148.2718 4.796528 270.5436       17.30812 267.2774       23.52722 274.3964       25.55281 146.7290 6.596756 148.4649 7.083262 -1.735840      9.679349 
1 1 1 -3  22 30 o 55.57950 3.613485 38.02258       4.867615 41.12036       8.002214 36.20318       6.132661 57.36981 5.803614 54.03569 4.704115 3.334122       7.470652 
1 1 1 -3  22 31 o 34.86324 4.751819 15.25750       3.932074 17.91849       6.332165 13.58743       5.016453 37.22635 7.240912 32.46055 6.567485 4.765800       9.775616 
1 1 1 -3  22 32 o 37.49492 4.501693 17.60000       4.031088 15.72187       6.249038 18.93850       5.275460 34.62729 7.613318 38.59756 5.786886 -3.970276      9.562984 
1 1 1 -3  22 33 o 40.59036 4.640908 20.68656       4.508105 18.50114       6.323678 22.94501       6.428459 37.61184 7.160844 42.23457 6.450247 -4.622734      9.637602 
1 1 1 -3  22 34 o 39.26318 5.233997 19.62955       4.883267 19.62190       10.19603 19.63183       5.562767 37.34358 10.67164 38.99372 6.050032 -1.650135      12.26730 
1 1 1 -3  22 35 o 21.12981 7.076412 5.589395       4.288640 11.57059       8.910701 3.786214       4.892576 29.40398 10.19318 19.46348 7.425304 9.940500       12.61095 
1 1 1 -3  22 36 o 58.46102 3.514987 42.64109       4.984431 46.87829       7.617160 39.46803       6.591630 60.47841 5.219429 55.61809 4.913903 4.860325       7.168604 
1 1 1 -3  22 37 o 28.43657 5.605654 10.80616       3.746388 14.97815       5.600303 7.426891       5.040232 32.79618 7.204646 23.33143 7.666789 9.464746       10.52077 
1 1 1 -3  22 38 o 24.50688 6.280372 8.380296       3.767487 8.779377       5.533578 8.035454       5.143811 24.61730 8.029945 23.71598 7.742377 0.9013138      11.15457 
1 1 1 -3  22 39 o 20.62126 7.704955 5.737144       5.205808 2.315949       6.878422 10.32426       7.964703 18.87235 8.159559 25.52537 9.531786 -6.653013      12.54725 
1 1 1 -3  22 40 o 12.10239 5.527264 -1.329782      3.630331 -5.158957      4.957303 3.098773       5.331187 12.09397 5.805701 17.69387 7.396196 -5.599905      9.402653 
1 1 1 -3  22 41 o 19.04900 6.677635 5.420945       3.830029 3.658782       5.492207 7.089161       5.343798 17.85354 7.488003 21.03696 7.816921 -3.183418      10.82471 
1 1 1 -3  22 42 o 27.77863 7.012772 12.56461       4.747061 14.86878       6.003471 8.720436       7.754372 28.85048 8.170316 21.60685 8.966903 7.243635       12.13093 
1 1 1 -3  22 43 o 30.61343 5.867785 14.45966       4.218194 11.42946       6.157006 17.14001       5.790688 23.65829 8.450179 30.95468 7.706588 -7.296383      11.43665 
1 1 1 -3  22 44 o 15.69412 6.324806 3.750623       3.719819 -0.6557304     5.414649 7.688970       5.119029 13.60924 6.395921 19.64458 7.569606 -6.035332      9.909932 
1 1 1 -3  22 45 o 15.07858 6.252677 3.489926       3.766252 -1.666104      5.922468 6.990794       4.880146 13.22167 6.346715 18.46679 7.310050 -5.245116      9.680786 
1 1 1 -3  23 1  o 343.4052 4.792906 1438.997       40.10901 1474.214       63.96273 1416.176       51.49018 347.2019 7.559774 340.5018 6.205387 6.700043       9.780440 
1 1 1 -3  23 2  o 224.6374 3.946562 615.4693       21.60415 542.5939       39.69193 646.1480       25.75314 210.4767 7.751838 230.1271 4.592259 -19.65042      9.009986 
1 1 1 -3  23 3  o 347.7726 5.409997 1476.483       45.84886 1452.112       90.02705 1485.018       53.27536 343.7555 10.76025 348.6619 6.270264 -4.906342      12.45388 
1 1 1 -3  23 4  o 304.3442 4.862238 1130.382       36.06097 1071.243       49.13416 1199.429       53.09121 296.0505 6.810542 313.2420 6.955150 -17.19150      9.734351 
1 1 1 -3  23 5  o 157.6079 3.332812 302.8985       12.80044 317.2457       26.08770 298.3490       14.69043 160.9747 6.664727 156.3994 3.854456 4.575272       7.699053 
1 1 1 -3  23 6  o 343.0036 4.786569 1435.901       40.00913 1415.135       62.47735 1450.337       52.09116 340.0970 7.538480 344.5291 6.204432 -4.432190      9.763383 
1 1 1 -3  23 7  o 142.1291 3.643873 246.5455       12.61026 229.6447       14.85138 290.2134       23.87233 137.1100 4.450794 153.9620 6.376558 -16.85202      7.776249 
1 1 1 -3  23 8  o 117.6222 2.704793 168.6717       7.752816 190.4533       12.44206 154.8467       9.912422 124.8717 4.094299 112.6146 3.616700 12.25712       5.462949 
1 1 1 -3  23 9  o 75.99759 3.284470 70.56944       6.068408 57.72483       12.06188 74.92242       7.021794 68.28065 7.365455 78.28311 3.691210 -10.00246      8.238626 
1 1 1 -3  23 10 o 115.7052 3.066854 163.3770       8.639706 160.7543       17.72061 164.1948       9.895501 114.4735 6.377609 115.9669 3.505633 -1.493454      7.277593 
1 1 1 -3  23 11 o 177.1720 3.460684 382.9183       14.94146 396.6967       31.25875 378.8380       17.01057 179.8477 7.146548 176.1934 3.961803 3.654236       8.171232 
1 1 1 -3  23 12 o 95.76683 3.030340 111.9659       7.063105 112.6175       15.04470 111.7817       7.999475 95.71207 6.488672 95.66116 3.437132 0.5091858E-01  7.342802 
1 1 1 -3  23 13 o 162.1757 3.339457 320.8594       13.19769 328.7130       27.81941 318.5785       14.99215 163.6599 6.991517 161.5683 3.807779 2.091644       7.961186 
1 1 1 -3  23 14 o 124.0178 2.778280 187.5716       8.396456 193.0527       14.17669 184.6100       10.42083 125.6302 4.638642 122.9540 3.481454 2.676170       5.799786 
1 1 1 -3  23 15 o 193.7862 3.250461 458.1673       15.34984 441.7114       24.51919 468.7733       19.68443 189.9937 5.300971 195.9378 4.122575 -5.944138      6.715349 
1 1 1 -3  23 16 o 308.6832 5.635584 1165.896       42.39241 1228.455       77.06539 1138.753       50.76268 315.2658 10.04387 304.7676 6.835018 10.49820       12.14894 
1 1 1 -3  23 17 o 136.5116 2.822725 227.3235       9.390189 246.1445       16.05104 217.5304       11.57827 141.8354 4.650182 133.4460 3.563616 8.389420       5.858630 
1 1 1 -3  23 18 o 307.8632 4.404394 1158.332       33.04303 1152.043       52.71859 1162.401       42.40662 306.3015 7.062826 308.1042 5.648068 -1.802673      9.043462 
1 1 1 -3  23 19 f 66.83515 2.846231 54.59938       4.625042 51.14888       8.182178 56.21954       5.606695 64.43116 5.256837 67.77596 3.405563 -3.344795      6.263561 
1 1 1 -3  23 20 o 262.2624 3.910511 840.3992       24.99227 813.4828       39.58665 858.2374       32.22673 257.4560 6.309713 264.7993 4.994168 -7.343384      8.046999 
1 1 1 -3  23 21 o 162.6067 3.295460 322.8564       13.05842 310.9134       19.40939 332.7329       17.65045 159.2714 5.007002 164.8802 4.396823 -5.608780      6.663492 
1 1 1 -3  23 22 o 123.7808 2.758301 186.9892       8.320149 184.2525       14.02969 188.4737       10.33335 122.5935 4.704914 124.1707 3.418215 -1.577278      5.815531 
1 1 1 -3  23 23 o 66.32313 3.292005 53.86180       5.303982 54.84735       8.591853 53.25495       6.742007 66.66536 5.333164 65.84230 4.224207 0.8230591      6.803423 
1 1 1 -3  23 24 o 103.6348 3.089401 131.2902       7.793465 129.5431       11.93953 132.5872       10.28734 102.7087 4.783420 104.0225 4.066092 -1.313835      6.278073 
1 1 1 -3  23 25 o 104.8091 3.114693 134.3205       7.946363 132.3039       12.13879 135.8327       10.51171 103.7639 4.813691 105.2614 4.105839 -1.497498      6.326890 
1 1 1 -3  23 26 o 141.1813 3.258307 243.6540       11.20999 228.8540       16.50097 256.3388       15.27639 136.4441 4.971017 144.5638 4.341276 -8.119736      6.599825 
1 1 1 -3  23 27 f 46.78452 5.739494 27.35972       6.406600 25.01233       7.633926 32.95082       11.78159 44.34981 7.318552 50.34496 9.955975 -5.995148      12.35648 
1 1 1 -3  23 28 o 107.2703 4.731428 141.6797       12.33781 120.5357       15.91419 173.5342       19.53331 98.40709 6.675760 118.1044 6.815889 -19.69727      9.540551 
1 1 1 -3  23 29 o 56.72318 3.574554 39.58471       4.915916 46.10052       8.104400 35.79181       6.183331 60.85032 5.525586 53.71645 4.773320 7.133865       7.301827 
1 1 1 -3  23 30 o 116.5201 3.190001 166.4507       9.049384 168.9354       13.75262 164.5534       12.01765 116.9231 4.837130 115.5716 4.274463 1.351547       6.455142 
1 1 1 -3  23 31 o 67.87729 3.392117 56.69428       5.593104 49.79062       8.539048 61.88171       7.401947 63.04933 5.616401 70.71259 4.316052 -7.663261      7.083238 
1 1 1 -3  23 32 o 37.81434 5.082022 18.08050       4.564606 15.74019       6.643679 20.17303       6.282138 34.41135 8.064257 39.47044 6.775222 -5.059093      10.53261 
1 1 1 -3  23 33 o 102.6710 3.212655 129.8917       8.028108 123.0023       11.85465 135.7279       10.91089 99.16444 4.921026 104.4990 4.293763 -5.334579      6.530919 
1 1 1 -3  23 34 o 47.74739 4.450072 28.69123       5.118269 35.48957       11.06295 26.83980       5.773302 50.73347 9.290556 45.88036 5.258623 4.853104       10.67556 
1 1 1 -3  23 35 o 18.04241 6.356877 3.840306       3.473979 8.391080       5.698256 1.148303       4.382653 25.03162 8.147423 16.07207 6.711244 8.959553       10.55563 
1 1 1 -3  23 36 o 47.47947 3.903974 28.46844       4.477121 22.33456       6.630304 33.60934       6.069950 40.49040 6.971096 51.09811 4.936034 -10.60771      8.541698 
1 1 1 -3  23 37 o 54.21708 3.738430 37.22358       4.909017 44.48697       7.570833 31.95442       6.448289 58.14123 5.405381 49.16698 5.474639 8.974247       7.693492 
1 1 1 -3  23 38 o 34.47196 7.302571 17.30905       5.943433 14.76980       7.780292 20.86728       9.209996 30.10459 9.492456 35.19317 10.16931 -5.088581      13.91120 
1 1 1 -3  23 39 o 15.11342 6.340363 1.608150       3.939237 2.193102       5.711416 1.077412       5.440310 17.45394 7.489509 16.37466 7.165558 1.079275       10.36523 
1 1 1 -3  23 40 o 27.94606 6.089853 11.49391       4.029822 9.409931       5.894975 13.32214       5.521408 23.63017 8.284365 28.61417 7.735043 -4.983994      11.33409 
1 1 1 -3  23 41 o 10.71164 5.186467 -4.945235      4.165206 -4.380823      4.904346 -6.405922      7.889717 12.05819 5.784872 14.59989 7.085357 -2.541702      9.146968 
1 1 1 -3  23 42 o 16.73904 6.798046 3.909640       4.334792 -0.2857690     5.618874 10.07751       6.812862 14.59745 6.743130 22.31624 8.695846 -7.718792      11.00398 
1 1 1 -3  23 43 o 10.65012 5.062931 -2.473006      3.579531 -9.329407      5.392360 2.928410       4.786131 10.52189 5.244541 15.59931 6.775119 -5.077418      8.567815 
1 1 1 -3  23 44 f 10.30330 4.953718 -2.972551      3.640991 2.835972       5.722794 -6.922702      4.719349 15.50438 7.025555 10.21069 5.058168 5.293690       8.656990 
1 1 1 -3  23 45 o 11.86381 5.479191 -0.1481571     3.707012 2.585765       5.663176 -2.197812      4.903513 14.91700 6.846639 11.99747 5.763212 2.919530       8.949362 
1 1 1 -3  24 1  o 224.7514 3.540240 616.1160       19.38970 571.8131       29.02866 651.8050       26.05422 216.2904 5.511981 231.0842 4.626703 -14.79381      7.196410 
1 1 1 -3  24 2  o 290.9973 4.220588 1033.304       29.92939 1021.174       46.52705 1041.867       39.09066 288.9736 6.607105 292.0503 5.492617 -3.076691      8.592012 
1 1 1 -3  24 3  o 185.4558 3.177616 419.4274       14.36078 419.0348       22.30915 419.7052       18.76579 185.1912 4.947844 185.4615 4.152190 -0.2702637     6.459244 
1 1 1 -3  24 4  o 128.1090 2.801168 200.1052       8.744900 197.0862       13.42118 202.3326       11.52792 127.0049 4.342835 128.7362 3.678406 -1.731270      5.691299 
1 1 1 -3  24 5  o 55.81678 3.602569 38.16203       4.874022 46.33115       6.771552 29.37988       7.021033 61.44028 4.555112 48.65527 6.051987 12.78502       7.574667 
1 1 1 -3  24 6  o 273.7300 4.490907 914.6403       29.95660 901.3799       41.91010 928.4925       42.83511 271.4916 6.334703 275.5373 6.379453 -4.045715      8.990321 
1 1 1 -3  24 7  o 260.3568 3.883808 827.1136       24.64125 906.0950       40.82473 781.8486       30.90597 272.2105 6.154353 253.0120 5.012623 19.19847       7.937408 
1 1 1 -3  24 8  o 209.0214 4.382020 533.3483       22.32036 0.000000       0.000000 533.3483       22.32036 ?        ?        209.0214 4.382020 0.000000       4.382020 
1 1 1 -3  24 9  o 71.79108 3.796771 63.06676       6.618721 64.91237       11.37687 62.12252       8.137572 72.54397 6.504510 71.16676 4.718906 1.377205       8.035965 
1 1 1 -3  24 10 o 79.43353 3.161551 77.08460       6.107617 78.58618       12.86498 76.64770       6.939511 79.84395 6.672940 79.17603 3.606125 0.6679153      7.585003 
1 1 1 -3  24 11 o 100.1491 3.085500 122.4554       7.521258 119.9253       15.62680 123.2183       8.580494 98.75914 6.529813 100.4311 3.511371 -1.671944      7.414052 
1 1 1 -3  24 12 o 44.41197 3.603415 24.22740       3.866400 19.80335       6.693920 26.44228       4.736373 39.59005 7.203681 46.34340 4.240898 -6.753357      8.359320 
1 1 1 -3  24 13 o 295.4847 4.286257 1066.278       30.86380 1064.839       49.42953 1067.198       39.51301 294.7542 6.881616 295.3960 5.489077 -0.6418457     8.802648 
1 1 1 -3  24 14 o 157.9725 3.305941 304.5050       12.72661 328.2750       27.70103 298.1454       14.32829 163.4723 6.969691 156.2810 3.762289 7.191299       7.920316 
1 1 1 -3  24 15 o 189.5031 3.569734 438.3509       16.48498 476.3060       35.54157 427.9475       18.60757 196.8118 7.423840 187.1893 4.079178 9.622513       8.470719 
1 1 1 -3  24 16 o 82.87975 2.794408 83.88971       5.635766 82.14268       9.839005 84.74280       6.875431 81.80630 4.958755 83.25491 3.395990 -1.448616      6.010158 
1 1 1 -3  24 17 o 225.7282 3.566038 622.1154       19.61588 615.6281       31.60372 626.1807       25.01828 224.0977 5.792004 226.3208 4.536248 -2.223053      7.356960 
1 1 1 -3  24 18 o 159.9614 2.998482 312.2614       11.68834 328.1147       19.59892 303.5106       14.56119 163.6817 4.919136 157.6301 3.790720 6.051620       6.210270 
1 1 1 -3  24 19 o 74.12284 3.051168 67.17310       5.499521 97.44810       14.14395 61.78074       5.969229 88.83429 6.580343 71.04429 3.458276 17.79000       7.433747 
1 1 1 -3  24 20 o 107.8889 2.970799 142.1858       7.803194 155.7109       12.65728 133.8937       9.910627 112.7117 4.618025 104.5968 3.894988 8.114914       6.041282 
1 1 1 -3  24 21 o 204.5527 3.353491 511.0655       16.71624 492.2191       26.78403 523.0903       21.39446 200.2615 5.493546 206.7934 4.245498 -6.531891      6.942860 
1 1 1 -3  24 22 o 62.91787 2.904207 48.43132       4.440835 49.16988       8.083877 48.11210       5.314573 63.10004 5.306308 62.65246 3.494771 0.4475861      6.353765 
1 1 1 -3  24 23 o 133.7139 2.827185 218.2929       9.212275 214.8785       15.53141 220.1461       11.44239 132.3219 4.824706 134.1624 3.502850 -1.840530      5.962193 
1 1 1 -3  24 24 o 69.56783 2.817252 59.19525       4.766186 64.22295       9.291386 57.39984       5.552358 72.12567 5.323858 68.44940 3.338750 3.676270       6.284163 
1 1 1 -3  24 25 o 75.68813 3.233634 70.15313       5.950491 69.33228       9.535491 70.67667       7.615210 74.93494 5.255144 75.85019 4.135568 -0.9152451     6.687261 
1 1 1 -3  24 26 o 117.6615 3.973141 169.7885       11.37577 162.6019       13.69743 185.7648       20.42286 114.9457 4.901265 122.3010 6.880266 -7.355286      8.447512 
1 1 1 -3  24 27 f 160.2314 5.091242 316.2585       19.85436 349.7669       28.56660 284.9472       27.61422 167.7116 7.005135 151.1110 7.522604 16.60063       10.27918 
1 1 1 -3  24 28 o 18.47387 6.407253 3.831791       3.520949 2.410328       6.435868 4.438958       4.206234 20.47194 8.294545 19.97714 6.998289 0.4947929      10.85244 
1 1 1 -3  24 29 o 101.4793 3.187081 126.2731       7.871688 124.8177       12.11410 127.3368       10.35600 100.4415 4.964665 101.6739 4.188684 -1.232368      6.495611 
1 1 1 -3  24 30 o 23.28353 6.299413 6.999232       3.660188 0.3931695      6.527062 10.02952       4.420672 18.91095 8.057710 27.76660 6.625834 -8.855652      10.43208 
1 1 1 -3  24 31 o 14.14195 5.903565 0.6009963      3.389790 3.979702       6.064633 -0.9341955     4.087998 21.19275 8.219438 14.02567 6.172190 7.167087       10.27887 
1 1 1 -3  24 32 o 73.35277 3.325836 66.39637       5.929557 67.77020       9.205225 65.42206       7.752087 73.46066 5.175255 72.46680 4.410676 0.9938583      6.799803 
1 1 1 -3  24 33 o 40.00232 4.918132 20.33598       4.693467 33.49651       10.70161 17.20169       5.222540 49.37061 9.234351 36.33495 6.115164 13.03565       11.07558 
1 1 1 -3  24 34 o 31.59373 5.311924 12.97695       3.944710 15.53525       6.623591 11.57083       4.910540 33.44817 8.192296 29.22154 6.989975 4.226629       10.76910 
1 1 1 -3  24 35 o 27.74100 5.754048 10.27521       3.762163 5.199787       6.212234 13.21477       4.727731 21.66709 8.341450 31.26322 6.420660 -9.596123      10.52638 
1 1 1 -3  24 36 o 32.95945 4.988939 14.26733       3.881853 15.20263       6.184902 13.65943       4.986267 32.45032 7.897153 31.36979 6.724729 1.080528       10.37242 
1 1 1 -3  24 37 o 38.38436 7.290477 21.16660       6.570111 22.77629       8.443952 18.69683       10.45931 38.15714 9.190899 32.69985 11.05165 5.457287       14.37399 
1 1 1 -3  24 38 o 32.29234 5.533428 14.41173       4.197827 12.49821       6.248133 15.98614       5.667498 27.89254 8.458465 32.68296 7.300415 -4.790424      11.17326 
1 1 1 -3  24 39 o 16.02666 6.452320 2.765647       3.867093 -2.299666      5.411545 8.051522       5.528109 14.02696 6.527029 22.42166 8.007159 -8.394704      10.33038 
1 1 1 -3  24 40 o 20.86715 6.815333 6.826091       3.985543 7.460011       5.999218 6.325271       5.332348 21.24164 8.192058 20.11038 7.731796 1.131258       11.26457 
1 1 1 -3  24 41 o 15.51858 6.987456 1.105354       5.556622 1.105354       5.556622 0.000000       0.000000 15.51858 6.987456 ?        ?        0.000000       6.987456 
1 1 1 -3  24 42 o 17.87750 6.715262 5.263203       3.965258 12.50738       6.129704 0.5028423E-01  5.199784 24.64034 8.458010 14.15621 6.520445 10.48413       10.67961 
1 1 1 -3  24 43 o 8.767032 4.342011 -6.002264      3.470179 -9.521263      5.511493 -3.690967      4.466709 10.49138 5.240645 11.16716 5.398284 -0.6757774     7.523685 
1 1 1 -3  24 44 o 14.55644 6.195545 2.946299       3.851454 6.806946       5.978045 0.2066534      5.035890 17.87785 7.666705 13.39653 6.254543 4.481318       9.894325 
1 1 1 -3  25 1  o 97.30891 2.766826 115.5573       6.554347 107.6105       9.597319 122.5034       8.972670 93.79965 4.209403 100.1339 3.683369 -6.334236      5.593414 
1 1 1 -3  25 2  o 124.5883 3.183809 189.4478       9.658386 199.0240       18.92959 186.0775       11.23016 127.4193 6.114193 123.4350 3.737767 3.984283       7.166189 
1 1 1 -3  25 3  o 136.6495 3.180481 227.7567       10.59100 206.6596       14.02546 255.7473       16.15519 130.0284 4.432800 144.6501 4.588884 -14.62163      6.380249 
1 1 1 -3  25 4  o 223.3671 4.590492 609.2450       24.98702 688.4468       45.87492 575.8365       29.79449 236.7940 7.961346 216.9636 5.640030 19.83040       9.756688 
1 1 1 -3  25 5  o 343.8603 4.815609 1444.211       40.35239 1365.348       61.27354 1504.610       53.62252 333.7512 7.533798 350.6785 6.274831 -16.92728      9.804673 
1 1 1 -3  25 6  o 266.7665 3.969480 868.5744       25.80483 814.6256       39.06584 910.3342       34.37049 258.0317 6.212810 272.9432 5.167463 -14.91153      8.080946 
1 1 1 -3  25 7  o 270.1591 4.010720 890.8782       26.40450 899.6864       41.91228 885.0816       34.00015 271.1296 6.343490 269.1183 5.184437 2.011322       8.192573 
1 1 1 -3  25 8  o 158.6667 2.976045 307.0544       11.50698 293.1357       17.55731 317.5349       15.23526 154.8463 4.658167 161.2952 3.876077 -6.448959      6.059908 
1 1 1 -3  25 9  o 53.98456 3.539496 35.71399       4.630682 42.14600       8.047576 32.53019       5.661931 58.42411 5.725902 51.40621 4.567227 7.017906       7.324310 
1 1 1 -3  25 10 o 174.4991 3.494754 371.5705       14.86093 373.7892       30.45882 370.8773       17.02481 174.4558 7.179940 174.2952 4.008304 0.1605225      8.223019 
1 1 1 -3  25 11 o 268.7665 4.479278 882.3998       29.33724 813.5256       56.79435 907.4655       34.26224 256.8906 9.086682 272.4434 5.160638 -15.55280      10.44988 
1 1 1 -3  25 12 o 95.81090 3.105268 112.1121       7.240626 116.6196       15.66269 110.8870       8.165524 97.32159 6.644061 95.25324 3.523850 2.068352       7.520709 
1 1 1 -3  25 13 o 124.5635 3.155007 189.4442       9.569238 161.6385       19.58375 198.1654       10.96773 114.5603 7.049101 127.3670 3.537076 -12.80672      7.886744 
1 1 1 -3  25 14 o 70.56698 2.999195 60.86660       5.145775 52.12648       8.705226 65.56073       6.379678 65.02357 5.546711 73.19467 3.587636 -8.171097      6.605842 
1 1 1 -3  25 15 o 65.83773 3.019057 53.00238       4.830863 45.85395       8.295094 56.67116       5.942609 60.93334 5.650752 68.03427 3.597157 -7.100933      6.698548 
1 1 1 -3  25 16 o 33.07613 4.457275 13.61444       3.501336 6.433404       6.319939 16.79463       4.205772 24.35100 8.574530 36.74462 4.812507 -12.39362      9.832741 
1 1 1 -3  25 17 o 72.31758 2.906570 63.92294       5.111814 66.83871       9.193160 62.61794       6.150276 73.71028 5.150411 71.51972 3.539846 2.190559       6.249579 
1 1 1 -3  25 18 o 55.23076 3.228853 37.36947       4.326804 35.06065       7.799916 38.39574       5.200272 53.10292 6.140479 55.92525 3.839056 -2.822334      7.241811 
1 1 1 -3  25 19 o 20.26088 6.125524 5.073428       3.280302 2.138891       6.228478 6.199819       3.858839 20.14988 8.161352 22.30656 6.620718 -2.156679      10.50912 
1 1 1 -3  25 20 o 162.9656 3.031810 324.2538       12.04021 342.9764       20.41128 314.2625       14.91064 167.2348 5.014160 160.3397 3.816095 6.895172       6.301141 
1 1 1 -3  25 21 o 43.88826 3.507939 23.68698       3.720565 28.08589       7.209271 22.09005       4.343714 47.36320 6.410605 42.27449 4.275139 5.088703       7.705367 
1 1 1 -3  25 22 o 135.2983 2.869853 223.5206       9.462111 233.4758       16.23983 218.4040       11.64246 137.9245 4.839242 133.6144 3.578877 4.310165       6.018856 
1 1 1 -3  25 23 o 153.9328 2.975234 289.4396       11.16062 298.3892       18.94420 284.6822       13.81202 155.8619 4.994145 152.5557 3.715289 3.306229       6.224536 
1 1 1 -3  25 24 o 94.70599 2.752925 109.6383       6.346684 113.5212       11.29299 107.8457       7.673084 96.05040 4.840340 93.85365 3.360347 2.196747       5.892438 
1 1 1 -3  25 25 f 120.3558 3.301481 177.2948       9.673897 196.2417       14.81466 163.2100       12.77314 126.3127 4.821776 115.2353 4.557569 11.07733       6.634829 
1 1 1 -3  25 26 o 147.5645 3.872766 267.0608       13.91438 250.6997       24.19468 275.1463       17.00852 141.9137 7.017929 149.5622 4.672418 -7.648529      8.431063 
1 1 1 -3  25 27 o 64.89934 3.454475 51.74178       5.443661 47.76502       9.048656 53.99742       6.814813 61.80974 6.086335 66.16693 4.248917 -4.357189      7.422720 
1 1 1 -3  25 28 o 75.90002 3.275867 70.72138       6.044780 69.25371       9.971206 71.57417       7.600684 74.59435 5.524578 76.19489 4.108659 -1.600540      6.884914 
1 1 1 -3  25 29 o 48.06343 4.126930 28.65446       4.786932 26.41004       8.111394 29.85386       5.929601 45.17039 7.641148 48.85571 5.053374 -3.685314      9.160990 
1 1 1 -3  25 30 o 39.17274 4.590722 19.24918       4.299248 16.68593       7.306627 20.60658       5.317119 35.34328 8.572512 40.29033 5.563873 -4.947048      10.21982 
1 1 1 -3  25 31 o 50.90115 4.125474 32.28203       5.073438 37.92628       7.796173 28.13593       6.681877 54.58199 5.957958 46.91996 5.979604 7.662029       8.441145 
1 1 1 -3  25 32 o 13.61798 5.909419 -0.3035270     3.634623 -2.201058      8.778510 0.8905874E-01  3.992949 19.76950 8.851444 14.61423 6.266440 5.155269       10.84511 
1 1 1 -3  25 33 o 12.78572 5.741622 -1.421381      3.723854 0.6946645      7.972640 -2.011840      4.211477 20.25889 8.771819 13.26583 6.017433 6.993061       10.63740 
1 1 1 -3  25 34 o 25.76939 5.951846 8.919015       3.662240 8.128099       5.992646 9.390474       4.626750 24.60800 8.364937 26.12824 7.088195 -1.520239      10.96425 
1 1 1 -3  25 35 o 34.69065 4.720178 15.63506       3.886903 20.15249       6.573808 13.20685       4.819633 37.94345 7.375320 30.96255 6.590097 6.980892       9.890639 
1 1 1 -3  25 36 o 38.60973 7.729680 21.67394       7.018765 17.07852       9.018145 28.73436       11.17815 32.18399 10.22871 41.26319 10.94031 -9.079197      14.97721 
1 1 1 -3  25 37 o 46.04251 4.280414 27.68723       4.747646 22.35373       6.937583 32.38509       6.511066 38.67365 7.632454 48.72887 5.583887 -10.05522      9.456963 
1 1 1 -3  25 38 o 37.75561 4.850992 19.35553       4.360210 17.52955       6.386557 20.94963       5.967308 33.09294 8.007097 37.61133 6.759076 -4.518391      10.47849 
1 1 1 -3  25 39 o 23.71231 6.744041 8.747584       4.081592 18.13587       6.399906 2.311087       5.299139 33.09345 8.020613 16.67122 7.184605 16.42223       10.76795 
1 1 1 -3  25 40 o 15.20975 6.898117 0.4019051      5.531774 0.4019051      5.531774 0.000000       0.000000 15.20975 6.898117 ?        ?        0.000000       6.898117 
1 1 1 -3  25 41 o 17.08860 6.682972 4.455024       4.035719 8.949317       6.147174 1.050547       5.350200 21.33843 8.275391 15.01865 6.800475 6.319773       10.71114 
1 1 1 -3  25 42 o 13.44322 5.921348 1.298944       3.770563 -0.1035346     5.818382 2.314365       4.950820 14.29734 6.690709 15.12127 6.716562 -0.8239298     9.480390 
1 1 1 -3  25 43 o 14.21359 6.058772 2.531209       3.693048 -1.587288      5.704668 5.502468       4.845418 13.19966 6.307310 17.24002 7.115172 -4.040362      9.508304 
1 1 1 -3  26 1  o 62.81465 3.487695 48.29149       5.317741 50.90485       6.974003 44.66145       8.219360 64.40776 4.471077 60.16698 5.672836 4.240780       7.222991 
1 1 1 -3  26 2  o 171.5561 3.467954 359.1080       14.49825 374.1912       20.41829 343.7699       20.59003 174.9456 4.793910 167.6466 5.045693 7.299026       6.959928 
1 1 1 -3  26 3  o 101.9590 2.799191 126.8765       6.948370 113.5544       10.11358 138.7863       9.562517 96.33696 4.318985 106.5778 3.687432 -10.24086      5.678977 
1 1 1 -3  26 4  o 289.0891 4.213334 1020.424       29.68203 948.0358       44.61158 1077.922       39.75962 278.2275 6.579781 296.9041 5.495280 -18.67661      8.572725 
1 1 1 -3  26 5  o 138.1316 3.274656 232.7833       11.02288 271.8128       23.07961 221.2496       12.54630 148.8612 6.377026 134.5802 3.829483 14.28102       7.438509 
1 1 1 -3  26 6  o 136.9568 2.860339 228.7750       9.546350 216.7024       14.40201 238.2363       12.74966 133.1263 4.445625 139.6599 3.749590 -6.533646      5.815755 
1 1 1 -3  26 7  o 59.78484 3.162769 43.72615       4.591417 48.78260       6.942631 39.79549       6.121162 63.03004 4.550658 56.90673 4.449367 6.123314       6.364382 
1 1 1 -3  26 8  o 180.5946 3.152491 397.8996       13.87378 399.5941       21.72338 396.7324       18.02978 180.7435 4.936686 180.2490 4.104700 0.4944763      6.420236 
1 1 1 -3  26 9  o 65.16441 3.015415 51.91385       4.775455 59.57561       7.307687 46.20333       6.308891 69.70424 4.323422 61.35915 4.245449 8.345089       6.059358 
1 1 1 -3  26 10 o 129.5392 3.658985 205.0079       11.53885 192.8543       20.67251 210.5080       13.90686 125.2212 6.800045 131.1943 4.355925 -5.973091      8.075562 
1 1 1 -3  26 11 o 76.32674 3.281984 71.22690       6.090223 65.12222       12.87466 72.98671       6.912529 72.44989 7.395884 77.23186 3.683478 -4.781967      8.262390 
1 1 1 -3  26 12 f 157.5241 3.830204 303.0254       14.70297 0.000000       0.000000 303.0254       14.70297 ?        ?        157.5241 3.830204 0.000000       3.830204 
1 1 1 -3  26 13 o 140.1549 3.252298 239.7514       11.10797 255.7378       23.69946 235.2508       12.57473 144.1906 6.763591 138.7471 3.722470 5.443512       7.720294 
1 1 1 -3  26 14 o 147.5430 2.970383 265.6434       10.67990 264.8871       17.71497 266.0753       13.38609 147.0536 4.950489 147.5525 3.725792 -0.4988403     6.195875 
1 1 1 -3  26 15 o 79.04374 2.897687 76.34431       5.572108 77.22390       9.904624 75.93702       6.739811 79.25657 5.156210 78.77906 3.519644 0.4775085      6.242948 
1 1 1 -3  26 16 o 81.52639 2.908377 81.21793       5.768842 84.30247       10.21929 79.77526       6.988895 82.82163 5.087943 80.73989 3.560851 2.081741       6.210219 
1 1 1 -3  26 17 o 88.58334 2.818608 95.86165       6.076727 82.10349       10.31945 103.1648       7.518526 81.70029 5.210337 91.84953 3.364762 -10.14923      6.202357 
1 1 1 -3  26 18 o 83.62800 3.097308 85.50621       6.301169 86.99596       10.15008 84.57205       8.037525 84.12959 4.973089 83.07632 3.981761 1.053261       6.370717 
1 1 1 -3  26 19 o 110.2940 2.817483 148.5871       7.566476 159.3583       13.26850 143.3963       9.210949 113.9646 4.788334 108.2766 3.495450 5.688011       5.928433 
1 1 1 -3  26 20 o 128.7563 3.128797 202.4841       9.817073 208.0413       15.37872 198.6621       12.75371 130.2018 4.855442 127.3580 4.114761 2.843796       6.364478 
1 1 1 -3  26 21 o 176.9837 3.174292 382.6814       13.69040 409.0695       23.24908 368.6741       16.93861 182.4913 5.233306 173.5770 4.004510 8.914337       6.589658 
1 1 1 -3  26 22 o 90.24725 2.831603 99.56662       6.219631 104.6158       11.13655 97.27782       7.497935 92.19682 4.975200 89.12997 3.458652 3.066856       6.059281 
1 1 1 -3  26 23 o 147.3104 3.441428 265.4162       12.35402 267.4813       17.98695 263.5721       16.99744 147.4855 5.011914 146.4660 4.768589 1.019470       6.918000 
1 1 1 -3  26 24 o 111.2879 3.343582 151.6339       9.057393 142.3000       13.14891 160.0616       12.49432 107.4749 5.034486 114.1211 4.501563 -6.646202      6.753526 
1 1 1 -3  26 25 o 74.81265 3.068735 68.56866       5.582744 59.66360       13.35024 70.45592       6.145917 68.62354 8.141727 75.79988 3.335391 -7.176338      8.798441 
1 1 1 -3  26 26 o 34.01357 4.120561 14.40949       3.345867 18.87955       6.971465 13.07172       3.813812 38.18958 7.756090 32.19680 5.024874 5.992779       9.241551 
1 1 1 -3  26 27 o 30.78675 4.464104 11.90703       3.251561 16.38617       6.836974 10.59782       3.696342 35.38223 8.104068 28.80453 5.465826 6.577698       9.775028 
1 1 1 -3  26 28 o 19.31148 5.692952 4.717903       2.861057 12.00629       6.819307 3.160901       3.151877 30.27102 8.751518 17.03521 6.050063 13.23582       10.63919 
1 1 1 -3  26 29 o 35.63258 4.642761 15.98210       3.935657 15.39538       6.772530 16.28126       4.836043 34.00508 8.256556 35.67701 5.758476 -1.671925      10.06632 
1 1 1 -3  26 30 o 57.61030 3.964752 41.23174       5.532176 46.59125       8.551622 37.37457       7.254725 60.59406 5.864609 54.32987 5.557796 6.264191       8.079774 
1 1 1 -3  26 31 o 57.69680 3.987200 41.49886       5.571558 22.05004       11.68609 47.22025       6.338310 38.98497 11.50898 61.46780 4.257768 -22.48283      12.27132 
1 1 1 -3  26 32 o 45.06557 4.455243 25.67874       4.828791 19.29645       9.846472 27.69973       5.540827 36.35075 10.51813 46.62759 4.951994 -10.27683      11.62555 
1 1 1 -3  26 33 o 25.18676 6.089725 8.540781       3.696189 16.65863       6.588196 4.811961       4.465106 34.47985 7.996419 20.01926 7.190710 14.46060       10.75402 
1 1 1 -3  26 34 o 43.84132 4.263385 24.55292       4.497396 21.34553       7.275280 26.53667       5.721582 38.73510 7.973318 45.03893 5.315324 -6.303833      9.582612 
1 1 1 -3  26 35 o 64.99635 4.680050 54.78879       7.363056 61.43909       9.197151 42.91828       12.28761 67.97563 5.601861 52.28199 10.00890 15.69365       11.46992 
1 1 1 -3  26 36 o 16.77176 6.351840 3.297924       3.564140 4.823049       5.566072 2.237975       4.640220 19.87654 7.825890 16.69953 6.933940 3.177013       10.45582 
1 1 1 -3  26 37 o 32.09053 5.730994 14.52566       4.317238 15.06951       6.315086 14.04846       5.915478 30.43837 8.290958 29.62578 8.005381 0.8125916      11.52502 
1 1 1 -3  26 38 o 49.92022 4.205174 33.14626       5.068078 38.76572       7.752522 28.95235       6.697380 51.46667 6.313404 44.36080 6.378563 7.105869       8.974694 
1 1 1 -3  26 39 o 16.54833 6.834936 3.211046       4.475865 8.108648       6.279294 -1.847450      6.381603 21.55653 8.362781 14.91685 6.989144 6.639675       10.89882 
1 1 1 -3  26 40 o 12.67757 5.916406 -1.577041      4.498486 -8.151421      5.542911 11.10871       7.699608 11.27232 5.565335 22.73953 9.121997 -11.46721      10.68568 
1 1 1 -3  26 41 o 22.11243 6.903213 8.682477       4.124968 0.7945454      6.314174 14.55538       5.448304 15.22737 7.073625 27.81636 7.750222 -12.58899      10.49295 
1 1 1 -3  26 42 o 28.26829 6.132943 13.22197       4.103076 15.10229       6.366708 11.88627       5.366026 25.81554 8.621643 23.87768 7.913512 1.937859       11.70284 
1 1 1 -3  26 43 o 11.58759 5.415334 -0.8475437     3.790424 -5.597909      5.915392 2.461620       4.937182 11.80236 5.812162 14.67575 6.599044 -2.873391      8.793669 
1 1 1 -3  27 1  o 132.7701 2.868512 215.0222       9.280965 216.5955       14.20882 213.8515       12.25696 133.0856 4.387174 132.2987 3.805770 0.7869110      5.807855 
1 1 1 -3  27 2  o 99.52857 2.806558 120.9213       6.800237 125.1290       10.37219 117.7491       9.005876 101.1313 4.217966 98.13961 3.772725 2.991692       5.659036 
1 1 1 -3  27 3  o 152.1282 2.968471 282.3199       11.00471 297.5934       17.31832 271.9761       14.25200 155.9972 4.560572 149.1981 3.923319 6.799133       6.015917 
1 1 1 -3  27 4  o 142.1946 3.318162 246.7315       11.49786 252.1065       22.56075 244.8456       13.36357 143.2894 6.477804 141.5586 3.877569 1.730865       7.549668 
1 1 1 -3  27 5  o 133.2645 2.862010 216.6353       9.294408 213.6057       14.21320 218.8986       12.28514 132.1522 4.419702 133.8502 3.770144 -1.697998      5.809281 
1 1 1 -3  27 6  o 118.3273 2.807191 170.7899       8.094559 167.9119       12.36067 172.9509       10.71067 117.1557 4.337035 118.9674 3.698968 -1.811737      5.700196 
1 1 1 -3  27 7  o 81.47031 3.199529 81.11782       6.339810 77.36519       8.599498 85.58578       9.383393 79.44501 4.459821 83.55373 4.626545 -4.108711      6.426113 
1 1 1 -3  27 8  f 77.21104 2.853520 72.82546       5.359801 68.13110       7.896562 76.83569       7.298519 74.54453 4.366079 79.23550 3.790883 -4.690971      5.782166 
1 1 1 -3  27 9  o 90.22342 2.775357 99.39594       6.094773 92.07252       9.152143 105.2317       8.169872 86.69455 4.345923 92.76924 3.620845 -6.074692      5.656639 
1 1 1 -3  27 10 o 91.46093 3.652323 102.3025       8.123940 0.000000       0.000000 102.3025       8.123940 ?        ?        91.46093 3.652323 0.000000       3.652323 
1 1 1 -3  27 11 o 44.01537 4.912674 23.99166       5.179629 0.000000       0.000000 23.99166       5.179629 ?        ?        44.01537 4.912674 0.000000       4.912674 
1 1 1 -3  27 12 o 65.43752 3.955278 52.50595       6.277801 0.000000       0.000000 52.50595       6.277801 ?        ?        65.43752 3.955278 0.000000       3.955278 
1 1 1 -3  27 13 o 85.99438 3.204040 90.39728       6.702610 87.69627       14.34881 91.15112       7.580473 84.16912 7.060648 86.31499 3.611892 -2.145874      7.930858 
1 1 1 -3  27 14 o 41.68592 4.476129 21.49573       4.475891 42.47597       10.60194 16.94533       4.937478 58.23617 7.655859 36.75483 5.696807 21.48134       9.542839 
1 1 1 -3  27 15 o 175.2602 3.195313 375.0303       13.64686 348.5027       21.76438 392.2173       17.51850 168.5622 5.305071 179.1249 4.013330 -10.56274      6.652112 
1 1 1 -3  27 16 o 152.3067 3.350791 283.3221       12.43662 290.4682       18.96592 277.9314       16.47255 153.8984 5.064023 150.6417 4.492261 3.256699       6.769397 
1 1 1 -3  27 17 o 49.32980 3.892412 29.93384       4.641231 37.20436       8.067815 26.33753       5.674165 54.68887 6.160769 46.07570 5.141008 8.613163       8.024029 
1 1 1 -3  27 18 o 153.5647 3.018553 287.9612       11.29604 281.0494       18.67787 291.9472       14.18404 151.3275 5.072097 154.5303 3.766606 -3.202789      6.317712 
1 1 1 -3  27 19 o 28.82713 5.188139 10.50129       3.510591 13.78217       7.070540 9.427861       4.044314 32.74039 8.710450 27.14770 6.243634 5.592691       10.71704 
1 1 1 -3  27 20 o 169.5443 3.148890 351.2129       13.00999 349.8439       21.57331 351.9954       16.30945 168.7199 5.253443 169.5999 3.946187 -0.8800049     6.570468 
1 1 1 -3  27 21 o 162.8246 3.593536 324.3077       14.25865 306.0118       20.12671 342.7426       20.20304 157.7306 5.243545 167.0171 4.969389 -9.286514      7.224237 
1 1 1 -3  27 22 o 54.68757 4.208322 36.86657       5.565229 29.80928       8.415919 42.35075       7.418878 48.51448 7.348417 58.45860 5.264118 -9.944126      9.039368 
1 1 1 -3  27 23 o 107.9396 2.833954 142.4743       7.447903 142.1095       12.93682 142.6552       9.108897 107.4042 4.956128 107.9115 3.468378 -0.5073166     6.049202 
1 1 1 -3  27 24 o 64.76723 3.307727 51.47749       5.203319 40.31131       13.13599 53.55557       5.666853 55.59423 10.06662 66.03208 3.534567 -10.43785      10.66912 
1 1 1 -3  27 25 o 105.3084 2.803588 135.7267       7.188312 139.8174       12.89070 133.8807       8.659719 106.3784 4.986514 104.4789 3.405806 1.899567       6.038612 
1 1 1 -3  27 26 o 101.1922 2.778672 125.3980       6.845562 140.9679       12.78860 119.1450       8.104415 106.7306 4.930293 98.51532 3.380850 8.215279       5.978121 
1 1 1 -3  27 27 o 23.92656 5.314137 7.375664       3.017857 11.91837       6.570885 6.161293       3.397366 30.12638 8.553136 21.89783 6.126975 8.228550       10.52121 
1 1 1 -3  27 28 o 43.78767 4.073501 23.86873       4.296808 24.20054       7.406094 23.70037       5.275432 43.13065 7.306998 43.37722 5.087240 -0.2465782     8.903496 
1 1 1 -3  27 29 o 49.60282 4.003331 30.63254       4.798016 29.93785       7.457147 31.12328       6.267653 48.20713 6.514396 49.62339 5.263171 -1.416264      8.374863 
1 1 1 -3  27 30 o 8.811416 4.220763 -3.541016      2.588675 -1.914948      7.037682 -3.795446      2.783843 17.78459 7.946719 9.137194 4.376859 8.647396       9.072333 
1 1 1 -3  27 31 o 53.03038 4.124300 35.30065       5.287926 24.22059       10.59968 38.97192       6.101406 40.66383 10.59267 55.56399 4.545795 -14.90016      11.52688 
1 1 1 -3  27 32 o 57.69540 3.566502 41.61922       4.989895 38.84190       8.117851 43.30585       6.326131 54.33448 6.244350 58.43589 4.476532 -4.101402      7.683180 
1 1 1 -3  27 33 o 16.18049 6.199237 2.642267       3.419796 5.317157       6.342311 1.545773       4.060669 21.65882 8.404038 15.78600 6.514171 5.872825       10.63307 
1 1 1 -3  27 34 o 60.12474 3.641123 45.76174       5.309874 48.14565       8.344004 44.13930       6.883568 60.02659 5.775398 58.17463 4.901153 1.851959       7.574729 
1 1 1 -3  27 35 o 15.06449 6.198596 1.710163       3.662809 6.663240       6.223693 -0.9144864     4.530501 21.99459 8.378614 14.05456 6.320428 7.940035       10.49519 
1 1 1 -3  27 36 o 19.27395 6.643189 5.273299       3.782653 0.2472070E-01  5.657999 9.515107       5.086483 15.86022 7.103272 24.67456 7.659787 -8.814342      10.44647 
1 1 1 -3  27 37 o 47.74826 4.254325 30.32409       4.898431 29.43005       7.509028 30.98638       6.462928 43.76490 7.297616 46.66188 5.809140 -2.896976      9.327449 
1 1 1 -3  27 38 o 17.19000 6.628993 4.050472       3.928076 6.493434       6.276725 2.477744       5.036184 20.27643 8.200020 16.40328 7.035663 3.873146       10.80467 
1 1 1 -3  27 39 o 29.70860 7.411622 14.98855       5.347844 20.90673       6.981976 6.588099       8.318312 33.73988 8.497730 19.90558 8.780309 13.83430       12.21905 
1 1 1 -3  27 40 f 17.93443 6.691882 5.344162       3.924168 5.469031       6.184389 5.260002       5.077201 18.14099 7.789040 17.83650 7.314056 0.3044910      10.68478 
1 1 1 -3  27 41 o 37.12535 5.087557 20.67916       4.481796 18.87753       7.123607 21.85949       5.765952 28.70487 9.087146 35.57294 6.900461 -6.868073      11.41020 
1 1 1 -3  27 42 o 11.37950 5.336293 -1.164570      3.733618 -0.3063154     5.883077 -1.743360      4.831223 13.83272 6.551027 12.29751 5.856220 1.535213       8.786995 
1 1 1 -3  28 1  o 141.0567 3.766822 243.1331       12.93648 232.7602       21.31205 249.1849       16.27845 137.6416 6.371168 142.6908 4.687817 -5.049210      7.909956 
1 1 1 -3  28 2  o 235.1588 4.781420 676.1607       27.40023 595.2760       43.67591 728.6550       35.18558 219.7625 8.169755 243.8893 5.920192 -24.12688      10.08928 
1 1 1 -3  28 3  o 52.83453 4.012234 34.29214       5.127209 32.62875       9.278622 35.02333       6.151732 50.95813 7.712904 53.30742 4.786489 -2.349293      9.077410 
1 1 1 -3  28 4  o 54.62383 3.807184 36.61313       5.036108 37.64330       9.738914 36.23711       5.883868 54.85287 7.480477 54.26614 4.489501 0.5867348      8.724285 
1 1 1 -3  28 5  o 118.0854 3.229913 170.3088       9.285704 169.1295       18.11060 170.7294       10.81551 117.2729 6.361033 118.1811 3.760242 -0.9081726     7.389328 
1 1 1 -3  28 6  o 77.56553 3.381832 73.58105       6.376935 72.80176       12.34675 73.86457       7.447122 76.73959 6.668471 77.66273 3.947906 -0.9231491     7.749482 
1 1 1 -3  28 7  o 122.1590 2.832149 182.0687       8.430968 177.9020       12.75221 185.3043       11.23733 120.5667 4.347443 123.1213 3.749732 -2.554611      5.741145 
1 1 1 -3  28 8  o 186.5181 3.233352 424.6375       14.69637 430.2281       23.00007 420.7800       19.10527 187.4377 5.040000 185.5526 4.225226 1.885071       6.576787 
1 1 1 -3  28 9  o 105.5357 3.075367 136.0468       7.900758 133.4460       14.23777 137.2040       9.497168 104.2153 5.627146 105.9267 3.684806 -1.711380      6.726259 
1 1 1 -3  28 10 o 232.8792 4.115006 662.8205       23.35271 725.1680       49.80017 645.2462       26.43994 242.2579 8.448548 229.6596 4.724324 12.59827       9.679731 
1 1 1 -3  28 11 o 48.41867 4.063827 28.85296       4.750750 38.47941       10.00776 26.05263       5.397696 55.39566 7.614805 45.87957 4.903795 9.516094       9.057177 
1 1 1 -3  28 12 f 113.9826 3.178350 158.7358       8.819667 166.4314       18.90016 156.5936       9.971984 116.1758 6.704434 113.1640 3.620734 3.011871       7.619656 
1 1 1 -3  28 13 o 162.6879 4.717958 324.2260       18.68472 0.000000       0.000000 324.2260       18.68472 ?        ?        162.6879 4.717958 0.000000       4.717958 
1 1 1 -3  28 14 o 99.58166 3.218008 121.2204       7.798876 123.7139       17.00801 120.5566       8.775867 99.99926 7.024116 99.26398 3.634092 0.7352829      7.908529 
1 1 1 -3  28 15 o 212.6439 4.483654 553.4291       23.23384 535.8893       41.11497 561.6578       28.16133 208.0338 8.125797 213.9347 5.406099 -5.900864      9.759840 
1 1 1 -3  28 16 o 187.1386 3.296486 427.8114       15.03317 449.0815       25.27827 416.1721       18.69932 191.2376 5.429723 184.4346 4.160517 6.803040       6.840453 
1 1 1 -3  28 17 o 60.95398 3.280346 45.52315       4.854616 38.76888       8.618048 48.66257       5.875502 55.75399 6.462591 62.96304 3.847706 -7.209057      7.521297 
1 1 1 -3  28 18 o 51.04405 4.387289 32.14380       5.404403 31.96437       8.406559 32.27020       7.055656 50.41650 7.033612 50.91364 5.789495 -0.4971313     9.109882 
1 1 1 -3  28 19 o 181.2211 4.283327 402.3130       18.91586 415.3555       24.21769 381.9063       30.29272 183.7628 5.413930 175.6084 7.093351 8.154449       8.923355 
1 1 1 -3  28 20 o 67.81688 3.787888 56.46627       6.235076 54.58223       9.239326 58.04180       8.449036 66.33732 5.772827 68.55240 5.094052 -2.215080      7.699019 
1 1 1 -3  28 21 o 114.5688 2.903274 160.5003       8.099169 172.3924       14.47120 155.0762       9.773197 118.3283 5.030042 112.5129 3.569010 5.815414       6.167589 
1 1 1 -3  28 22 f 112.8122 2.903053 155.6778       7.974184 158.8095       14.11267 154.2090       9.664910 113.4764 5.116655 112.1712 3.540173 1.305237       6.221975 
1 1 1 -3  28 23 o 137.5232 3.652461 231.9499       12.22962 248.6655       24.85765 226.6118       14.04730 141.0637 7.255548 135.7737 4.250859 5.290070       8.409089 
1 1 1 -3  28 24 o 19.74128 6.067457 4.843753       3.200921 -4.568799      6.952007 7.376019       3.605878 16.59003 7.603858 23.92949 6.150365 -7.339462      9.779860 
1 1 1 -3  28 25 o 51.34751 3.307017 32.46182       4.116011 35.98372       8.414649 31.35412       4.719110 53.28841 6.622344 50.36193 3.874996 2.926479       7.672747 
1 1 1 -3  28 26 o 80.14924 2.866026 78.81519       5.588766 84.58336       10.50009 76.53513       6.601567 82.37604 5.258103 78.85901 3.443562 3.517029       6.285361 
1 1 1 -3  28 27 o 55.50283 3.620390 38.10081       4.870009 41.66984       8.439139 36.31885       5.963093 57.28986 6.140525 53.94265 4.579561 3.347218       7.660185 
1 1 1 -3  28 28 o 33.32806 5.515692 14.27588       4.323118 12.35436       7.203632 15.35747       5.404557 30.30356 9.058516 34.21419 6.722013 -3.910625      11.28017 
1 1 1 -3  28 29 o 15.78777 5.805350 2.598780       2.933873 -5.984767      8.035793 3.918926       3.151421 17.05294 7.941346 18.00669 6.066374 -0.9537525     9.993292 
1 1 1 -3  28 30 o 107.5662 3.054985 143.0088       7.999830 151.1189       18.29874 141.0925       8.894882 107.3815 7.031554 106.6473 3.427033 0.7341995      7.822232 
1 1 1 -3  28 31 o 63.53842 2.957447 50.05968       4.566636 47.79373       8.439983 50.99765       5.430160 60.62352 5.782991 63.91159 3.499917 -3.288074      6.759616 
1 1 1 -3  28 32 o 29.96200 4.574091 11.65624       3.234048 16.27935       6.395688 10.06806       3.748610 33.76810 7.911504 27.31864 5.809777 6.449463       9.815569 
1 1 1 -3  28 33 o 24.83120 6.381780 8.622521       3.882475 9.366331       6.148103 8.129161       5.007173 25.29880 8.472742 23.85032 7.626468 1.448479       11.39958 
1 1 1 -3  28 34 o 34.43762 5.121615 15.92909       4.167460 8.878910       6.340485 21.29150       5.529716 24.25933 8.584344 39.29824 5.961066 -15.03892      10.45109 
1 1 1 -3  28 35 o 67.68258 3.524884 58.70361       5.793736 52.44684       8.659290 63.77470       7.795738 61.38778 5.859484 69.32538 4.641284 -7.937595      7.474963 
1 1 1 -3  28 36 o 26.43206 6.061545 10.23833       3.821012 6.984876       5.929335 12.54903       4.996960 21.28224 8.160577 28.36755 7.213362 -7.085312      10.89163 
1 1 1 -3  28 37 o 25.16354 6.556374 9.811335       4.060194 7.709103       6.186598 11.40186       5.381233 21.45114 8.306598 25.91739 7.847738 -4.466251      11.42745 
1 1 1 -3  28 38 o 19.13275 7.021884 5.898480       4.289011 4.998588       6.504323 6.590811       5.705109 18.66631 8.000793 19.80708 7.883386 -1.140762      11.23212 
1 1 1 -3  28 39 o 20.03910 7.561894 7.337250       5.040907 3.498533       6.348076 13.88944       8.293589 17.02451 7.581109 23.90286 9.507792 -6.878345      12.16023 
1 1 1 -3  28 40 o 26.89696 6.434464 12.15195       4.160773 1.855330       6.663016 18.73358       5.327095 15.76870 7.304792 33.10258 6.830456 -17.33387      10.00076 
1 1 1 -3  28 41 f 29.05598 6.168467 14.10835       4.232470 13.30775       6.891884 14.59313       5.362921 22.91743 8.795401 27.01241 7.746040 -4.094980      11.72008 
1 1 1 -3  29 1  f 112.5429 3.280893 154.7483       8.988403 148.9514       16.53148 157.1812       10.70978 110.0269 6.190589 113.3635 3.882510 -3.336670      7.307344 
1 1 1 -3  29 2  o 128.6003 2.910401 201.8059       9.120760 206.2623       13.91270 198.4472       12.07834 129.8146 4.404344 127.3920 3.895287 2.422600       5.879754 
1 1 1 -3  29 3  o 74.66322 3.324211 68.18960       6.033108 53.54690       7.770021 90.42001       9.573824 65.97799 4.866927 85.86418 4.592191 -19.88619      6.691427 
1 1 1 -3  29 4  o 191.0681 3.675914 445.8866       17.11550 452.3091       23.98587 439.2240       24.43020 192.1544 5.126928 189.3176 5.300632 2.836823       7.374422 
1 1 1 -3  29 5  o 131.2169 3.225513 210.1841       10.31394 218.4757       14.35470 201.3353       14.82911 133.5988 4.415221 128.1974 4.755028 5.401382       6.488795 
1 1 1 -3  29 6  o 181.6377 4.127185 403.2478       18.26822 379.2353       29.65168 417.9383       23.19264 175.5133 6.946433 184.6844 5.158335 -9.171127      8.652246 
1 1 1 -3  29 7  o 289.2913 6.807569 1028.535       47.99140 0.000000       0.000000 1028.535       47.99140 ?        ?        289.2913 6.807569 0.000000       6.807569 
1 1 1 -3  29 8  o 148.3723 4.831797 269.7143       17.44689 292.8618       25.77519 250.1403       23.70222 154.1881 6.877162 142.4825 6.846430 11.70558       9.704069 
1 1 1 -3  29 9  o 308.8924 5.825016 1170.377       43.84705 1143.488       74.92049 1184.385       54.07512 303.1089 10.15733 310.2104 7.153275 -7.101501      12.42340 
1 1 1 -3  29 10 o 76.36488 3.949997 71.46928       7.325682 80.28847       12.85170 67.22459       8.915999 80.55508 6.604785 73.92687 4.978186 6.628204       8.270763 
1 1 1 -3  29 11 o 127.4722 3.869257 198.7934       12.00538 200.1111       21.24625 198.1752       14.55108 127.3416 6.872074 127.1505 4.704253 0.1911316      8.327989 
1 1 1 -3  29 12 o 218.1386 5.702859 584.3040       30.28925 628.1951       45.07275 548.1611       40.90137 225.2580 8.224840 210.4960 7.988158 14.76201       11.46554 
1 1 1 -3  29 13 o 102.8379 3.850799 129.4730       9.633243 130.4310       17.22836 129.0372       11.61939 102.6783 6.925917 102.5514 4.661685 0.1269913      8.348631 
1 1 1 -3  29 14 o 71.44801 4.977877 62.86793       8.612823 55.73437       12.57070 69.17948       11.82428 66.69295 7.887145 74.68532 6.563549 -7.992371      10.26096 
1 1 1 -3  29 15 f 225.0489 5.792671 622.7643       31.74174 0.000000       0.000000 622.7643       31.74174 ?        ?        225.0489 5.792671 0.000000       5.792671 
1 1 1 -3  29 16 o 128.9657 3.929248 203.6868       12.33425 207.6449       21.72142 201.8031       14.98439 129.5338 6.906240 128.2065 4.804653 1.327286       8.413136 
1 1 1 -3  29 17 o 121.1899 3.446414 179.7162       10.16784 180.8888       14.98346 178.7153       13.84313 121.2840 5.080838 120.6281 4.718330 0.6559601      6.933798 
1 1 1 -3  29 18 o 72.98898 3.152093 65.23246       5.593291 66.75823       10.28593 64.59187       6.664809 73.41558 5.796352 72.55033 3.782814 0.8652496      6.921516 
1 1 1 -3  29 19 o 108.6628 2.925496 144.3848       7.739648 146.6096       13.75021 143.3530       9.363889 109.0828 5.187560 108.1812 3.556797 0.9015884      6.289800 
1 1 1 -3  29 20 o 43.49210 4.056313 23.38604       4.249527 20.08144       7.954199 24.70599       5.027081 39.34608 8.541328 44.60700 4.694941 -5.260925      9.746629 
1 1 1 -3  29 21 o 106.8913 2.937703 139.8205       7.644947 123.9373       13.23205 147.7791       9.366433 100.0973 5.445116 109.7942 3.505224 -9.696838      6.475792 
1 1 1 -3  29 22 o 110.9372 3.176753 150.7839       8.579251 180.6117       20.97046 144.7880       9.402079 120.1046 7.197964 108.6314 3.556463 11.47321       8.028644 
1 1 1 -3  29 23 f 112.9115 2.919159 156.1519       8.025418 161.6676       14.32239 153.6274       9.689466 114.2655 5.156856 111.8529 3.559342 2.412628       6.265945 
1 1 1 -3  29 24 o 115.8569 3.140198 164.6739       8.857568 177.7962       14.60651 157.0418       11.13949 119.7616 5.015975 112.8802 4.056189 6.881409       6.450788 
1 1 1 -3  29 25 o 53.97861 3.766593 36.04202       4.923488 38.53676       8.536984 34.79870       6.026754 55.04574 6.488747 52.80530 4.733659 2.240440       8.031897 
1 1 1 -3  29 26 o 59.09356 3.946131 43.31208       5.650044 39.36123       8.656934 46.24385       7.457327 55.47357 6.528726 60.72423 5.086157 -5.250656      8.276065 
1 1 1 -3  29 27 o 73.01727 2.950232 65.65067       5.238689 60.05316       9.652208 67.98808       6.237297 68.79299 5.811990 74.16269 3.460781 -5.369698      6.764336 
1 1 1 -3  29 28 o 45.35669 3.663921 25.64378       4.015266 10.37053       9.190021 29.24727       4.463875 28.55032 10.30821 48.41313 3.814458 -19.86281      10.99133 
1 1 1 -3  29 29 o 112.8815 3.084563 157.5889       8.477059 163.8660       19.24776 156.0783       9.442112 111.6271 7.112780 112.1251 3.459794 -0.4979706     7.909602 
1 1 1 -3  29 30 o 46.81882 3.372190 27.39214       3.821636 23.60572       7.362838 28.78839       4.471070 41.43969 7.569949 47.81723 3.870037 -6.377533      8.501842 
1 1 1 -3  29 31 o 26.68592 6.187717 9.732649       3.945513 12.37483       6.307621 8.034357       5.056976 29.15630 8.413016 24.03237 7.662101 5.123926       11.37922 
1 1 1 -3  29 32 o 62.66429 3.103948 49.18771       4.725163 42.30931       8.206857 52.59857       5.779167 55.96325 6.117322 64.44301 3.695543 -8.479755      7.146935 
1 1 1 -3  29 33 o 41.00470 4.429924 21.99752       4.356370 22.89120       6.584262 21.30171       5.809833 39.91365 7.025871 39.03244 6.324261 0.8812141      9.452996 
1 1 1 -3  29 34 o 39.29247 3.917279 20.10640       3.700926 14.06420       6.300601 23.28935       4.572985 29.48631 8.376702 41.85464 4.557026 -12.36833      9.536017 
1 1 1 -3  29 35 o 30.82758 5.443354 13.37170       3.939762 7.663552       5.829384 18.17129       5.345360 22.00119 8.166409 35.11728 6.485100 -13.11609      10.42817 
1 1 1 -3  29 36 o 10.95370 5.161758 -2.652670      3.568949 -9.661926      5.495750 2.458994       4.693233 11.04099 5.467513 16.20872 6.866558 -5.167726      8.777432 
1 1 1 -3  29 37 o 21.67293 7.231076 7.908620       4.478764 11.60781       8.589849 6.527482       5.248687 23.36547 9.539432 19.83825 7.659406 3.527224       12.23386 
1 1 1 -3  29 38 o 17.01329 7.088120 4.149261       4.872392 4.691305       6.190010 3.266424       7.899765 17.85925 7.731007 17.61861 8.086540 0.2406387      11.18752 
1 1 1 -3  29 39 o 30.90290 5.879250 15.07284       4.265759 14.30959       6.661004 15.60351       5.554121 25.25102 8.809455 28.78570 7.747809 -3.534678      11.73180 
1 1 1 -3  29 40 o 14.09219 6.025011 2.320253       3.671557 -6.304287      5.796312 8.099552       4.744838 11.65727 5.743154 20.13634 7.386363 -8.479071      9.356397 
1 1 1 -3  30 1  o 130.0226 3.218828 206.4121       10.19889 207.8428       14.11193 204.8477       14.75646 130.2756 4.451700 129.2962 4.691164 0.9793549      6.467198 
1 1 1 -3  30 2  o 144.3948 3.009109 254.5007       10.58829 268.3788       16.36882 244.5160       13.88426 148.0410 4.542691 141.3760 4.034179 6.665054       6.075413 
1 1 1 -3  30 3  o 207.7186 3.883501 527.3032       19.65779 517.5626       26.91749 538.4353       28.77613 205.4389 5.381335 209.4769 5.642297 -4.037994      7.797068 
1 1 1 -3  30 4  o 196.9847 3.368622 473.8715       16.17040 471.9774       24.94228 475.2448       21.23845 196.2095 5.221149 197.1078 4.421636 -0.8983154     6.841876 
1 1 1 -3  30 5  o 62.67221 3.584242 48.13887       5.451219 56.99142       9.910307 44.29848       6.527405 67.87518 6.055073 60.00688 4.496486 7.868305       7.542035 
1 1 1 -3  30 6  o 111.4591 3.225261 151.8210       8.751038 130.1458       15.34660 162.2647       10.65267 102.7684 6.156191 115.1667 3.800939 -12.39833      7.235042 
1 1 1 -3  30 7  o 136.6359 2.963393 227.8964       9.867111 223.0743       14.98550 231.5871       13.11018 134.9359 4.563869 137.5883 3.914107 -2.652374      6.012415 
1 1 1 -3  30 8  o 222.4146 3.581249 604.4092       19.41038 587.3867       29.81663 616.9290       25.57076 218.7556 5.597836 224.4889 4.674257 -5.733246      7.292767 
1 1 1 -3  30 9  o 184.4148 3.253615 415.3466       14.62170 399.2684       22.27461 427.5203       19.38221 180.4401 5.070746 186.9432 4.254588 -6.503174      6.619214 
1 1 1 -3  30 10 o 43.02594 5.550592 23.08306       5.684316 32.78587       10.46759 19.02512       6.769404 50.73728 8.784048 38.63617 7.460001 12.10111       11.52437 
1 1 1 -3  30 11 o 43.87851 4.565894 23.82623       4.810860 20.73066       9.870474 24.79073       5.509590 40.00065 10.11991 44.67512 5.155221 -4.674469      11.35733 
1 1 1 -3  30 12 o 71.22176 4.052886 62.25625       7.005141 49.87202       12.48861 67.94154       8.461660 62.91508 8.351692 74.32427 4.695855 -11.40919      9.581326 
1 1 1 -3  30 13 o 201.8887 3.843134 498.5450       18.90748 470.7493       37.50593 508.0158       21.89294 194.8156 7.916726 203.6730 4.410974 -8.857407      9.062629 
1 1 1 -3  30 14 o 94.98297 3.322969 110.3944       7.679600 109.3322       16.26596 110.6991       8.711666 93.80016 7.170422 95.05649 3.768294 -1.256332      8.100308 
1 1 1 -3  30 15 o 40.23874 4.891819 20.15372       4.698360 32.08847       10.58282 17.22389       5.243435 50.00791 9.015742 36.93752 6.033298 13.07039       10.84824 
1 1 1 -3  30 16 o 126.4040 3.728437 195.6937       11.47226 0.000000       0.000000 195.6937       11.47226 ?        ?        126.4040 3.728437 0.000000       3.728437 
1 1 1 -3  30 17 o 27.46267 6.500669 9.686485       4.282517 16.65317       9.701447 8.000397       4.772695 35.92120 10.45408 25.15222 7.336019 10.76897       12.77126 
1 1 1 -3  30 18 o 53.54622 3.592462 35.25607       4.660547 38.31620       8.927230 34.10956       5.464296 55.22274 6.775631 52.55906 4.303953 2.663681       8.027029 
1 1 1 -3  30 19 o 57.55153 3.418968 40.68908       4.773384 36.82727       8.802056 42.29797       5.681364 54.06432 6.833306 58.59531 4.002853 -4.530983      7.919401 
1 1 1 -3  30 20 o 49.97052 3.950332 30.82558       4.771321 25.26261       13.20958 31.66026       5.116765 43.42989 12.05558 50.60677 4.186493 -7.176888      12.76181 
1 1 1 -3  30 21 o 56.01539 3.423816 38.59998       4.651299 37.12116       8.647037 39.20208       5.517528 54.20230 6.688278 56.34675 4.045191 -2.144451      7.816434 
1 1 1 -3  30 22 o 72.98461 3.080532 65.37663       5.466576 84.62622       10.89635 58.90207       6.319390 82.45692 5.453346 69.14352 3.764688 13.31340       6.626602 
1 1 1 -3  30 23 o 71.15073 3.505101 62.34142       6.058668 68.02902       9.992210 59.03467       7.618989 73.74478 5.602164 68.98019 4.558037 4.764587       7.222184 
1 1 1 -3  30 24 o 54.04940 3.938936 36.21844       5.152458 29.75624       8.551111 39.90201       6.456048 47.82655 7.590222 56.53741 4.729206 -8.710865      8.942978 
1 1 1 -3  30 25 o 64.72459 3.888897 51.94104       6.105540 59.63750       9.235175 45.96519       8.137661 68.77374 5.557746 60.30882 5.601115 8.464924       7.890566 
1 1 1 -3  30 26 o 33.69926 4.558397 14.39036       3.647520 8.299976       9.177074 15.53299       3.974980 27.05698 10.20458 34.96616 4.790831 -7.909180      11.27322 
1 1 1 -3  30 27 o 28.19344 5.036259 10.28000       3.333143 5.992998       7.851662 11.22240       3.681318 24.06262 9.346842 29.39393 5.335825 -5.331306      10.76264 
1 1 1 -3  30 28 f 110.4917 2.874004 150.7829       7.731864 136.3210       13.32217 158.1284       9.494535 103.3918 5.305268 112.8147 3.457682 -9.422874      6.332570 
1 1 1 -3  30 29 o 17.05383 5.686639 3.628460       2.769968 3.677925       6.306765 3.616637       3.083270 20.39816 8.230202 17.28004 5.995667 3.118116       10.18255 
1 1 1 -3  30 30 o 17.31709 6.508151 3.306137       3.725484 1.975961       6.038228 4.123720       4.733921 18.51126 7.812655 19.18977 7.308002 -0.6785030     10.69787 
1 1 1 -3  30 31 o 36.03205 4.112680 16.72924       3.546597 16.57674       6.654137 16.78975       4.191596 33.35792 8.235774 35.67660 4.954803 -2.318680      9.611349 
1 1 1 -3  30 32 f 24.94313 5.567518 8.620580       3.298309 9.672120       6.098776 8.185885       3.921228 25.09233 8.439054 23.84496 6.548759 1.247375       10.68194 
1 1 1 -3  30 33 o 10.97965 4.985580 -1.104359      2.900147 0.9679661      5.120939 -2.082851      3.518837 15.95028 6.966557 11.43827 5.302128 4.512012       8.754740 
1 1 1 -3  30 34 o 38.86988 4.091276 19.96279       3.817281 10.63657       6.360684 25.21253       4.772213 25.01574 8.614820 43.30145 4.592464 -18.28571      9.762472 
1 1 1 -3  30 35 o 27.66588 5.019262 10.74953       3.259339 3.753707       5.217442 15.22698       4.174015 17.72470 7.355482 32.68759 5.430517 -14.96289      9.142955 
1 1 1 -3  30 36 o 25.41609 6.411818 10.13857       3.970324 17.27558       8.597240 8.203822       4.476242 27.97524 9.986048 22.10972 7.222807 5.865522       12.32437 
1 1 1 -3  30 37 o 28.80297 7.322419 14.32236       5.150017 10.33281       6.215671 23.05870       9.197943 22.68975 8.430629 30.89168 10.36354 -8.201923      13.35959 
1 1 1 -3  30 38 o 14.58223 6.162219 2.457948       3.764298 6.073256       6.213764 0.3619267      4.731294 18.38133 7.847885 13.77501 6.298297 4.606314       10.06270 
1 1 1 -3  30 39 o 25.89865 6.632970 11.69684       4.204176 6.794535       6.524738 15.17712       5.497554 18.36487 7.943584 27.81632 7.797973 -9.451458      11.13144 
1 1 1 -3  31 1  o 38.41103 4.413732 18.28967       4.056417 18.16856       5.576147 18.42579       5.911842 37.96629 6.243844 38.17422 6.593328 -0.2079315     9.080615 
1 1 1 -3  31 2  o 153.4202 3.432039 287.5499       12.83131 310.1208       18.06776 264.5827       18.22569 159.0835 4.665656 146.8460 5.100890 12.23749       6.912845 
1 1 1 -3  31 3  o 71.50027 3.618938 62.63242       6.285074 74.27177       11.65272 57.85716       7.463822 77.49480 6.222739 68.60890 4.488863 8.885895       7.672833 
1 1 1 -3  31 4  o 220.9735 4.033520 597.1605       21.72003 663.7589       44.61904 576.4782       24.86495 231.6257 7.916554 216.9694 4.702763 14.65630       9.208030 
1 1 1 -3  31 5  o 143.9321 2.999454 252.9426       10.52049 241.3198       15.62245 262.5874       14.23113 140.3203 4.574815 146.4800 3.990522 -6.159714      6.070683 
1 1 1 -3  31 6  o 140.5009 3.004197 241.0367       10.28593 225.5332       15.27941 253.8856       13.90987 135.6327 4.629597 144.0300 3.966867 -8.397339      6.096655 
1 1 1 -3  31 7  o 185.4715 3.283060 420.2226       14.83857 384.4592       22.03040 449.9203       20.07541 177.0070 5.112708 191.7377 4.296560 -14.73062      6.678339 
1 1 1 -3  31 8  o 126.7410 2.912988 196.1310       8.996879 200.2892       13.73180 193.0035       11.90901 127.8298 4.414808 125.5635 3.896749 2.266319       5.888563 
1 1 1 -3  31 9  o 112.4206 2.912697 154.4272       7.972812 180.1197       12.52537 136.9264       10.33753 121.2333 4.246233 105.7159 4.020057 15.51736       5.847338 
1 1 1 -3  31 10 o 68.86427 4.253950 58.27595       7.103906 57.62285       12.55650 58.58341       8.615252 67.81820 7.735951 68.90826 5.168165 -1.090057      9.303487 
1 1 1 -3  31 11 o 220.3826 4.632981 595.2866       24.88135 624.0446       44.89045 582.5339       29.89332 224.0805 8.234801 217.6292 5.641404 6.451340       9.981853 
1 1 1 -3  31 12 o 102.4937 3.292092 128.5311       8.211859 113.6441       15.99708 133.8576       9.568830 95.67706 6.907652 104.5322 3.762543 -8.855179      7.865901 
1 1 1 -3  31 13 o 117.2696 3.303515 168.2478       9.431153 144.6843       18.68496 176.3033       10.92494 107.9144 7.145445 119.9780 3.741215 -12.06356      8.065611 
1 1 1 -3  31 14 o 64.45792 3.718778 51.01348       5.816546 56.58154       12.38283 49.43712       6.588657 67.09822 7.713213 63.36978 4.291889 3.728439       8.826889 
1 1 1 -3  31 15 o 102.1634 3.303701 127.7777       8.214113 139.4180       17.90643 124.6755       9.244102 105.8762 6.979165 100.8422 3.768347 5.033989       7.931531 
1 1 1 -3  31 16 o 33.75496 5.713906 14.42533       4.532577 1.823586       9.714435 17.93213       5.124578 23.88366 9.983829 37.71582 5.757899 -13.83216      11.52520 
1 1 1 -3  31 17 o 158.9970 3.493248 309.5514       13.53489 307.3625       28.41564 310.1937       15.39327 156.9001 7.453179 159.0471 3.971632 -2.147018      8.445338 
1 1 1 -3  31 18 o 109.6737 3.296771 147.4008       8.801044 166.8140       20.81613 143.1752       9.711783 115.3665 7.444038 108.0095 3.695226 7.356972       8.310740 
1 1 1 -3  31 19 o 141.3193 3.386322 244.7288       11.66180 290.6288       28.89553 235.7979       12.74595 151.9540 7.829774 138.5701 3.778087 13.38397       8.693636 
1 1 1 -3  31 20 o 17.80441 6.493146 3.262326       3.658620 -0.3969461     7.000677 4.637276       4.291273 19.05377 8.234863 20.25888 7.070659 -1.205111      10.85390 
1 1 1 -3  31 21 o 56.65086 3.956956 39.68346       5.428310 37.82484       9.128695 40.70018       6.751713 54.44770 7.045062 57.15774 4.894395 -2.710037      8.578345 
1 1 1 -3  31 22 o 50.80755 4.242186 32.08899       5.204463 33.24373       8.628836 31.42871       6.524914 50.82625 7.165298 49.95985 5.447563 0.8663979      9.000969 
1 1 1 -3  31 23 o 89.55627 2.985579 98.58501       6.506584 85.52878       11.16054 105.3076       8.008373 82.50129 5.584120 92.39289 3.563565 -9.891602      6.624303 
1 1 1 -3  31 24 o 16.01346 6.184410 2.227831       3.422514 -0.7984948     8.305291 2.846877       3.756283 20.11815 8.827219 17.23335 6.522136 2.884798       10.97534 
1 1 1 -3  31 25 o 45.80871 3.907193 26.20968       4.320038 42.06600       11.00205 23.31932       4.697304 56.05093 8.305762 42.99950 4.551829 13.05143       9.471264 
1 1 1 -3  31 26 o 23.00032 5.753531 6.996654       3.216409 -3.179716      6.480975 10.32214       3.704859 16.19899 7.393210 28.04701 5.616639 -11.84801      9.284729 
1 1 1 -3  31 27 o 34.49362 4.316095 15.15438       3.548795 13.23726       6.908284 15.84164       4.136274 30.54338 8.801809 35.03506 4.985257 -4.491678      10.11556 
1 1 1 -3  31 28 o 14.46792 5.647808 1.844939       2.878031 -1.430744      6.155262 2.761453       3.255857 16.48415 7.393762 16.20150 6.085144 0.2826424      9.575839 
1 1 1 -3  31 29 o 14.59022 6.061347 1.163991       3.548498 6.239015       5.925041 -1.674379      4.431053 22.14430 8.230560 13.64073 6.181450 8.503567       10.29332 
1 1 1 -3  31 30 o 10.22941 4.761372 -2.218879      2.883120 -6.436968      5.768394 -0.8142488     3.328726 13.10736 6.284404 12.24452 5.468670 0.8628416      8.330671 
1 1 1 -3  31 31 f 17.73502 5.983150 4.209491       3.065531 -0.4349575     5.464277 6.342645       3.703196 15.61123 6.987010 21.09708 6.533539 -5.485852      9.565848 
1 1 1 -3  31 32 o 17.41193 6.029788 4.106352       3.117791 0.4492904      5.427514 5.907457       3.808942 15.90774 7.050991 20.19156 6.666266 -4.283816      9.703380 
1 1 1 -3  31 33 o 28.44852 5.218596 11.29887       3.484559 3.488218       5.942871 15.39103       4.301590 18.32144 7.742550 33.05526 5.535699 -14.73381      9.517933 
1 1 1 -3  31 34 o 30.53078 4.815626 12.91215       3.464223 10.86918       5.776736 14.05944       4.329002 25.05480 8.206463 30.94609 5.956606 -5.891287      10.14037 
1 1 1 -3  31 35 o 37.30643 4.953172 19.64166       4.391852 15.52812       8.601727 21.09215       5.107806 26.51190 9.904541 37.86794 5.712683 -11.35604      11.43393 
1 1 1 -3  31 36 o 11.88347 5.393275 -0.4275512     3.388642 -3.746728      5.291595 1.879845       4.411969 12.52023 6.007161 14.88412 6.484203 -2.363890      8.839167 
1 1 1 -3  31 37 o 15.96082 5.944128 3.880840       3.093301 1.775454       5.910290 4.675122       3.630200 15.55035 7.082921 17.04306 6.420245 -1.492706      9.559670 
1 1 1 -3  31 38 o 22.11465 6.164340 8.244443       3.445894 12.14530       6.447489 6.684651       4.077032 22.91081 8.571845 19.12226 6.870803 3.788546       10.98565 
1 1 1 -3  32 1  o 187.9200 4.380898 432.4135       20.06191 419.6615       32.52512 440.2444       25.48807 184.2001 7.260132 189.2579 5.532395 -5.057861      9.127810 
1 1 1 -3  32 2  o 109.4987 3.846816 146.8289       10.24876 159.6346       16.91053 139.3947       12.88471 113.7518 6.123031 106.5049 4.978201 7.246918       7.891387 
1 1 1 -3  32 3  f 18.66305 6.814432 3.490058       4.031400 -2.144501      4.969888 14.33029       6.893437 14.89069 6.664060 33.35012 8.467998 -18.45943      10.77575 
1 1 1 -3  32 4  o 84.23566 4.091238 87.03896       8.373096 71.18213       12.95526 98.41422       10.97282 75.61130 7.114716 89.43227 5.055453 -13.82097      8.727932 
1 1 1 -3  32 5  o 165.1751 3.521606 333.5283       14.17494 329.3137       19.42203 338.3322       20.73513 163.8103 4.870798 165.9747 5.132760 -2.164459      7.076008 
1 1 1 -3  32 6  o 134.6237 2.999157 221.3682       9.839128 219.5026       14.84069 222.8314       13.14277 133.7640 4.559467 134.8801 4.002983 -1.116104      6.067340 
1 1 1 -3  32 7  o 43.98101 3.956374 23.86101       4.195048 20.55910       5.632825 27.97333       6.286192 40.47157 5.883563 47.39563 5.547523 -6.924068      8.086490 
1 1 1 -3  32 8  o 151.4404 3.061280 280.1953       11.29746 274.7687       17.06715 284.4275       15.07223 149.6244 4.686605 152.3704 4.062827 -2.746017      6.202486 
1 1 1 -3  32 9  o 125.2452 3.208837 191.8367       9.785592 196.5569       13.47958 186.5774       14.22862 126.5784 4.376577 123.2450 4.746460 3.333344       6.456262 
1 1 1 -3  32 10 o 76.04989 3.580971 70.90071       6.617807 73.10471       13.08843 70.14373       7.670555 76.55922 7.096178 75.55826 4.182214 1.000961       8.236908 
1 1 1 -3  32 11 o 78.36252 3.558371 75.27577       6.777368 96.01213       14.68291 69.66157       7.639935 87.84236 6.914896 75.28893 4.180526 12.55343       8.080382 
1 1 1 -3  32 12 o 109.6563 3.337483 147.1974       8.908054 147.3173       18.21951 147.1597       10.21187 108.8771 6.902484 109.5614 3.830719 -0.6842804     7.894219 
1 1 1 -3  32 13 o 99.80587 3.343934 121.9997       8.121500 103.6137       16.06492 128.3119       9.412938 91.06384 7.300408 102.2853 3.782898 -11.22148      8.222303 
1 1 1 -3  32 14 o 44.54810 4.662366 24.64391       4.986537 24.46135       10.57355 24.69612       5.654889 43.11728 10.22003 44.46983 5.323902 -1.352547      11.52358 
1 1 1 -3  32 15 o 19.81622 7.014297 4.280681       4.233550 5.311889       9.125609 3.997877       4.778934 25.61854 10.04039 20.05275 7.403047 5.565788       12.47456 
1 1 1 -3  32 16 f 29.31415 7.231467 11.13510       5.133348 16.61033       9.713987 9.013675       6.046596 35.65403 10.48444 26.80293 8.356410 8.851099       13.40720 
1 1 1 -3  32 17 o 84.95299 3.921116 88.80246       8.095647 94.67585       15.63844 86.65222       9.462210 86.63762 7.480341 83.74856 4.654692 2.889061       8.810315 
1 1 1 -3  32 18 o 62.64524 4.978451 48.77784       7.537620 0.000000       0.000000 48.77784       7.537620 ?        ?        62.64524 4.978451 0.000000       4.978451 
1 1 1 -3  32 19 o 71.11964 4.624645 62.71896       7.971544 0.000000       0.000000 62.71896       7.971544 ?        ?        71.11964 4.624645 0.000000       4.624645 
1 1 1 -3  32 20 o 82.53219 3.112535 83.69837       6.248773 86.03543       11.34520 82.68065       7.486727 82.89056 5.650351 81.86972 3.762663 1.020844       6.788527 
1 1 1 -3  32 21 o 40.42355 4.565857 20.49834       4.419102 37.40433       10.97073 17.22398       4.828120 53.15823 8.774830 36.74571 5.565898 16.41251       10.39119 
1 1 1 -3  32 22 o 81.92298 3.223534 82.70676       6.422817 79.18562       14.52087 83.56321       7.161455 78.10993 7.729957 82.23832 3.582068 -4.128387      8.519592 
1 1 1 -3  32 23 o 28.49312 5.935561 10.62596       3.987360 18.32019       9.489889 8.976381       4.394047 36.10820 10.28795 26.00197 6.842968 10.10623       12.35589 
1 1 1 -3  32 24 o 14.40366 5.817374 1.318210       3.154427 1.783089       6.599192 1.180535       3.591275 19.59201 8.211970 14.97243 6.146777 4.619574       10.25765 
1 1 1 -3  32 25 o 33.84165 4.358267 14.56947       3.510839 19.56298       6.694170 12.67480       4.123443 37.94971 7.504551 31.09015 5.650609 6.859554       9.394023 
1 1 1 -3  32 26 o 49.14003 3.375582 30.15105       4.017668 26.77571       7.560533 31.47927       4.742732 44.44120 7.229462 50.00703 3.923289 -5.565834      8.225407 
1 1 1 -3  32 27 o 27.65345 5.061859 10.07872       3.285444 7.945641       6.645957 10.76861       3.779579 24.38157 8.770842 28.36055 5.667161 -3.978971      10.44243 
1 1 1 -3  32 28 o 12.18948 5.356017 -0.3793842     3.067615 -1.750160      5.716512 0.1749921      3.635382 15.47606 7.016295 13.73010 5.934105 1.745958       9.189234 
1 1 1 -3  32 29 o 19.69823 6.933485 5.158281       4.132041 8.043760       8.483320 4.260788       4.731210 24.24221 9.624633 18.99443 7.288013 5.247787       12.07264 
1 1 1 -3  32 30 o 14.80298 5.757193 2.262624       2.981760 0.9192098      5.492574 2.823977       3.550493 16.51420 7.213843 16.13421 6.280222 0.3799896      9.564556 
1 1 1 -3  32 31 o 18.20184 5.996289 4.633214       3.082375 0.7948264      5.449005 6.439431       3.737901 16.14200 7.113868 20.94885 6.575974 -4.806849      9.687649 
1 1 1 -3  32 32 o 46.59976 3.594934 28.15857       4.050817 23.63141       7.016423 30.42195       4.961145 38.81375 7.690105 47.83766 4.301638 -9.023911      8.811459 
1 1 1 -3  32 33 f 15.04833 5.824018 2.720400       3.039995 1.249112       5.191791 3.488024       3.750097 15.72924 6.937462 16.53280 6.448931 -0.8035545     9.471910 
1 1 1 -3  32 34 o 13.32912 5.624395 1.362603       3.128392 -1.874514      5.766294 2.712844       3.724117 14.16317 6.638466 15.37592 6.279797 -1.212751      9.138112 
1 1 1 -3  32 35 o 16.48655 6.336621 3.996710       3.580812 7.168966       5.592349 1.792341       4.661784 19.94556 7.847002 15.02302 6.601800 4.922549       10.25472 
1 1 1 -3  32 36 o 13.99774 5.760617 2.285115       3.164170 6.766242       5.835288 0.4187467      3.765887 19.06454 7.831938 12.87033 5.777232 6.194215       9.732198 
1 1 1 -3  32 37 o 14.17331 5.821168 2.565809       3.222627 4.479136       6.150481 1.841746       3.783577 16.97561 7.516052 13.87350 6.024732 3.102109       9.632674 
1 1 1 -3  33 1  o 129.2620 3.003971 204.1384       9.462432 218.0098       14.52293 193.9057       12.47347 133.2877 4.477597 125.7728 4.075097 7.514862       6.054361 
1 1 1 -3  33 2  o 191.4961 3.373127 448.3434       15.74087 457.6910       24.38589 441.6667       20.60949 192.9641 5.190637 189.8238 4.455337 3.140320       6.840521 
1 1 1 -3  33 3  o 168.4507 3.200575 346.8134       13.13823 325.4527       19.40513 364.8925       17.85237 162.7717 4.897743 172.5833 4.244839 -9.811584      6.481245 
1 1 1 -3  33 4  o 145.2723 3.055610 257.8750       10.81725 260.7186       16.44847 255.7078       14.35928 145.7289 4.637642 144.4424 4.083549 1.286423       6.179247 
1 1 1 -3  33 5  o 166.1480 3.177806 337.4092       12.86645 336.9750       19.71240 337.7315       16.98295 165.6169 4.889616 165.9809 4.202118 -0.3640900     6.447181 
1 1 1 -3  33 6  o 21.89409 6.462753 6.010779       3.685112 -0.6734015     5.124422 13.16961       5.303246 16.19505 7.022305 32.02591 6.991797 -15.83086      9.909491 
1 1 1 -3  33 7  o 122.3254 3.273224 183.0892       9.748503 176.9152       13.08223 190.7982       14.61823 120.0232 4.480675 124.5728 4.824555 -4.549576      6.584283 
1 1 1 -3  33 8  o 86.29189 3.334874 91.20711       6.999503 96.76835       9.275314 83.85091       10.66767 88.73595 4.302185 82.38898 5.342102 6.346970       6.859070 
1 1 1 -3  33 9  o 121.2890 3.263066 180.0555       9.635818 165.7379       12.63147 199.9848       14.90264 116.1313 4.471783 127.5010 4.804976 -11.36968      6.563888 
1 1 1 -3  33 10 o 130.1358 3.960801 207.7482       12.54614 240.4974       22.71841 193.3780       15.04908 139.1670 6.718783 125.3144 4.937690 13.85264       8.338035 
1 1 1 -3  33 11 o 148.5389 4.042723 270.7621       14.61996 286.7174       26.18265 263.5336       17.62327 151.7441 7.100218 146.2811 4.950951 5.463013       8.655924 
1 1 1 -3  33 12 o 147.8393 4.059517 268.3427       14.61131 315.8380       27.62663 249.8981       17.21623 159.1622 7.141005 142.3940 4.969086 16.76823       8.699757 
1 1 1 -3  33 13 o 169.9037 4.170291 354.4729       17.26654 363.3306       30.70628 350.3771       20.88044 170.4489 7.410301 168.5265 5.090183 1.922409       8.990134 
1 1 1 -3  33 14 o 62.36671 4.363102 48.05782       6.589254 43.55979       11.55455 50.22562       8.021443 58.27548 8.376789 63.57786 5.223409 -5.302376      9.871909 
1 1 1 -3  33 15 o 57.76181 4.268191 41.26212       5.965433 0.000000       0.000000 41.26212       5.965433 ?        ?        57.76181 4.268191 0.000000       4.268191 
1 1 1 -3  33 16 o 75.04353 3.919917 69.41745       7.143613 0.000000       0.000000 69.41745       7.143613 ?        ?        75.04353 3.919917 0.000000       3.919917 
1 1 1 -3  33 17 o 21.84795 6.885294 5.950120       4.093914 7.327264       9.671835 5.649524       4.518679 27.26487 10.43054 21.70267 7.263649 5.562202       12.71050 
1 1 1 -3  33 18 o 118.2562 3.294495 171.8909       9.484739 175.6893       20.33011 170.8342       10.72325 117.7021 7.121245 117.7433 3.742020 -0.4119873E-01 8.044554 
1 1 1 -3  33 19 o 62.92336 3.609833 48.91913       5.511994 48.05945       12.24988 49.13737       6.172119 60.51284 8.544583 62.95349 4.044662 -2.440647      9.453528 
1 1 1 -3  33 20 o 52.58519 3.884638 34.34548       4.942800 33.36186       11.35975 34.57519       5.489714 49.48301 9.767438 52.64521 4.317008 -3.162201      10.67892 
1 1 1 -3  33 21 o 33.05509 5.032969 13.95856       3.926348 14.08967       7.730452 13.91298       4.558037 32.07796 9.330836 32.72463 5.934128 -0.6466713     11.05796 
1 1 1 -3  33 22 o 39.02252 4.488354 19.24757       4.190502 24.26580       7.707560 17.14172       4.992926 42.55334 7.716799 36.34952 5.833949 6.203827       9.673880 
1 1 1 -3  33 23 o 12.08526 5.331144 -0.6944058     3.067086 7.908397       6.117563 -3.582835      3.544780 24.73067 8.450781 10.94406 5.153214 13.78661       9.898046 
1 1 1 -3  33 24 o 34.77786 4.432777 15.43631       3.671507 15.40836       6.823416 15.44770       4.355818 33.04902 8.442817 34.44321 5.364176 -1.394184      10.00278 
1 1 1 -3  33 25 o 32.40192 4.540741 13.52515       3.487086 3.560032       6.290510 17.94581       4.189750 20.24597 8.201304 37.32917 4.710462 -17.08319      9.457792 
1 1 1 -3  33 26 o 15.05717 6.284588 1.164585       3.840541 0.7084626      5.988426 1.483260       5.005479 17.52129 7.594340 16.92613 7.126759 0.5951519      10.41464 
1 1 1 -3  33 27 o 14.58632 5.784593 1.855872       3.061145 4.143729       5.909516 1.016846       3.578699 19.94576 7.994886 14.40649 6.043486 5.539268       10.02207 
1 1 1 -3  33 28 o 34.41276 5.739762 16.20950       4.643936 14.37337       9.579836 16.77352       5.309501 29.07337 10.52083 34.46349 6.561653 -5.390114      12.39932 
1 1 1 -3  33 29 f 45.91465 3.716142 27.13676       4.122449 24.44460       7.372475 28.36143       4.972470 40.17603 7.811653 46.42000 4.450166 -6.243969      8.990322 
1 1 1 -3  33 30 o 20.68061 6.479172 6.267830       3.630431 7.190310       5.906607 5.707744       4.602425 21.81532 8.195579 19.96723 7.282543 1.848093       10.96371 
1 1 1 -3  33 31 o 21.82033 6.160475 7.073277       3.418486 9.248074       6.318866 6.173386       4.064668 23.44638 8.535924 20.24594 6.889045 3.200449       10.96909 
1 1 1 -3  33 32 o 11.66764 5.231661 -0.4307352     3.078966 2.857677       5.698868 -1.786310      3.658956 17.24689 7.441797 11.63442 5.397751 5.612473       9.193262 
1 1 1 -3  33 33 o 14.57041 6.047368 2.133892       3.527407 8.622482       5.490865 -2.425603      4.602819 21.99763 7.964440 12.49528 5.880064 9.502349       9.899872 
1 1 1 -3  33 34 o 14.25479 6.055364 1.923835       3.666800 2.514647       5.570858 1.472206       4.870665 16.16465 7.155254 14.94609 6.648993 1.218555       9.767639 
1 1 1 -3  33 35 o 11.06391 5.070765 -0.7361176     3.091115 0.7018116      5.352586 -1.455639      3.786316 14.59278 6.682316 11.60842 5.420906 2.984363       8.604624 
1 1 1 -3  33 36 o 12.84237 5.565450 1.279451       3.215092 2.980684       6.478045 0.7234506      3.703393 16.23870 7.403731 12.88500 5.760528 3.353704       9.380774 
1 1 1 -3  34 1  o 72.94877 3.175350 65.20349       5.631241 68.93120       8.381894 62.13673       7.602575 74.78075 4.622150 71.02229 4.414509 3.758461       6.391570 
1 1 1 -3  34 2  o 86.69887 3.077658 92.02301       6.492029 91.49281       9.512795 92.48521       8.881873 86.20789 4.544244 86.73744 4.214672 -0.5295563     6.197872 
1 1 1 -3  34 3  o 128.5694 3.020199 202.0966       9.462571 217.0043       14.63568 191.3889       12.40376 132.8708 4.526702 124.8766 4.081504 7.994225       6.095056 
1 1 1 -3  34 4  o 122.3663 3.008565 183.0694       8.971345 191.0770       13.61222 176.9200       11.92862 124.6747 4.487697 120.0532 4.083317 4.621513       6.067364 
1 1 1 -3  34 5  o 51.50352 4.120282 32.73566       5.128206 38.58939       6.684409 24.36128       7.995073 55.79779 4.967868 43.58720 7.814147 12.21059       9.259623 
1 1 1 -3  34 6  o 75.33756 3.491675 69.63570       6.392911 71.72277       8.564998 67.01035       9.606205 76.26385 4.630455 73.54688 5.397426 2.716980       7.111492 
1 1 1 -3  34 7  o 28.14934 5.852061 10.14238       3.883230 8.940760       5.427409 11.40269       5.558366 26.53470 7.845845 29.68503 7.639376 -3.150331      10.95068 
1 1 1 -3  34 8  o 216.5395 3.582242 574.4279       18.90288 574.9579       29.29155 574.0497       24.74526 215.7417 5.576175 216.0471 4.700106 -0.3053894     7.292786 
1 1 1 -3  34 9  o 45.54849 3.801855 25.61394       4.181482 24.53328       6.103300 26.56990       5.740388 44.18133 5.809405 46.14147 5.195409 -1.960136      7.793681 
1 1 1 -3  34 10 o 78.99259 3.595768 76.64474       6.903571 62.07537       13.26159 82.06057       8.085514 69.95105 7.918856 81.64954 4.076558 -11.69849      8.906549 
1 1 1 -3  34 11 o 88.88755 3.418927 96.97060       7.391905 113.1330       15.47644 92.19390       8.413614 95.07244 6.723428 86.55114 3.999904 8.521301       7.823280 
1 1 1 -3  34 12 o 93.56031 3.349128 107.4319       7.623568 128.4612       16.41215 101.6461       8.608665 101.2697 6.687874 90.88622 3.895931 10.38345       7.739892 
1 1 1 -3  34 13 o 63.67923 3.812386 49.99712       5.888948 83.47871       13.04856 41.43327       6.599245 81.49538 6.627586 57.75563 4.730228 23.73975       8.142479 
1 1 1 -3  34 14 o 43.12785 5.383471 23.41314       5.535042 12.22030       9.649010 28.90265       6.757396 31.30234 10.61470 47.83785 5.922989 -16.53551      12.15540 
1 1 1 -3  34 15 o 148.8589 3.964659 273.1471       14.36912 0.000000       0.000000 273.1471       14.36912 ?        ?        148.8589 3.964659 0.000000       3.964659 
1 1 1 -3  34 16 o 68.74001 3.608653 58.30781       6.023750 51.19868       13.03334 60.23890       6.792789 62.48075 8.803756 69.76944 4.012196 -7.288689      9.674908 
1 1 1 -3  34 17 o 85.72172 3.382154 90.54641       7.051267 73.89513       14.31494 95.88097       8.102422 75.54542 7.892087 88.09200 3.783169 -12.54659      8.751994 
1 1 1 -3  34 18 o 98.95223 3.293913 120.6694       7.931734 127.9060       17.20640 118.7167       8.938044 99.85366 7.117822 97.98351 3.750212 1.870148       8.045339 
1 1 1 -3  34 19 o 17.11771 6.440404 2.882074       3.650545 13.28327       8.624972 0.6121246      4.029248 31.29076 10.00974 15.18549 6.394008 16.10527       11.87764 
1 1 1 -3  34 20 o 33.13844 6.065151 14.36437       4.717462 18.52569       9.625784 13.04894       5.411956 36.06823 10.38846 31.16124 7.261924 4.906982       12.67500 
1 1 1 -3  34 21 o 27.55355 5.951248 10.04233       3.878954 9.228677       8.232668 10.27450       4.397686 26.96152 9.753555 27.68764 6.609621 -0.7261238     11.78214 
1 1 1 -3  34 22 o 53.72459 4.158674 36.33987       5.402215 0.000000       0.000000 36.33987       5.402215 ?        ?        53.72459 4.158674 0.000000       4.158674 
1 1 1 -3  34 23 o 11.82618 5.298182 -1.102884      3.150357 0.4961069      6.085735 -1.688230      3.682109 17.71995 7.668164 12.42328 5.631795 5.296669       9.514087 
1 1 1 -3  34 24 o 32.26012 4.661151 13.50051       3.558220 21.07621       6.692064 10.51461       4.201324 38.96440 7.316451 27.71787 6.355787 11.24653       9.691567 
1 1 1 -3  34 25 o 38.30212 5.091101 19.27750       4.634365 16.40124       6.809641 21.75900       6.325111 33.31678 8.392776 39.68825 6.783390 -6.371471      10.79134 
1 1 1 -3  34 26 o 40.15787 4.001889 20.72949       3.864182 17.38013       6.833792 22.30375       4.685100 33.95700 8.323903 41.24556 4.747796 -7.288555      9.582741 
1 1 1 -3  34 27 o 88.53608 3.296714 99.11469       7.100329 99.06882       15.68566 99.12652       7.962855 81.70757 7.979364 88.10909 3.716967 -6.401512      8.802618 
1 1 1 -3  34 28 f 18.54855 6.179795 4.787753       3.271365 5.586744       5.654855 4.385852       4.010606 20.37980 7.927757 18.28359 6.776073 2.096209       10.42902 
1 1 1 -3  34 29 o 56.18459 3.338345 40.40995       4.550113 46.06708       7.951699 37.65580       5.548235 57.38955 5.763745 53.39424 4.300417 3.995308       7.191268 
1 1 1 -3  34 30 o 41.31547 4.081339 22.62629       4.055525 25.50747       7.138002 21.25289       4.928224 40.34025 7.538201 38.97509 5.328151 1.365158       9.231125 
1 1 1 -3  34 31 o 26.78058 6.599710 11.15279       4.278865 10.07166       9.039090 11.46501       4.857589 22.92942 9.610879 26.47952 7.295375 -3.550102      12.06613 
1 1 1 -3  34 32 o 30.26891 6.072094 13.95473       4.322959 24.03524       7.003434 7.749731       5.494656 37.47385 7.917538 20.99676 7.901077 16.47709       11.18546 
1 1 1 -3  34 33 o 13.81503 5.993303 1.389304       3.736466 9.361781       5.840248 -4.135262      4.861650 21.94220 8.168372 11.80984 5.689767 10.13236       9.954685 
1 1 1 -3  34 34 o 19.79815 6.314280 6.534336       3.434103 12.74341       6.398646 4.022330       4.069912 24.38017 8.623950 16.40076 6.613567 7.979414       10.86792 
1 1 1 -3  34 35 o 10.93478 5.066102 -1.023309      3.206256 -9.138714      5.663438 2.804593       3.889605 10.83309 5.395649 14.88208 6.275128 -4.048994      8.275884 
1 1 1 -3  35 1  o 21.48484 6.586031 5.755781       3.774549 12.25201       5.414699 -0.3850521     5.264504 30.72958 7.333133 16.57920 7.153128 14.15038       10.24412 
1 1 1 -3  35 2  o 110.0561 2.984432 148.3058       7.996702 164.0850       12.21943 136.4859       10.57587 115.4556 4.350887 105.3392 4.127924 10.11642       5.997498 
1 1 1 -3  35 3  o 170.4085 3.600606 355.9949       14.95213 346.6764       20.26133 367.1382       22.15654 167.6326 4.965376 172.3739 5.280886 -4.741287      7.248636 
1 1 1 -3  35 4  o 65.21481 3.325361 52.22821       5.267263 53.80051       7.573138 50.75491       7.330839 65.92882 4.745476 64.02891 4.731741 1.899910       6.701412 
1 1 1 -3  35 5  o 28.50767 5.876917 10.42642       3.946956 9.804469       5.487341 11.09314       5.681392 27.57926 7.811522 29.22896 7.822432 -1.649696      11.05488 
1 1 1 -3  35 6  o 76.88499 3.497400 72.61874       6.535581 83.31079       8.849296 59.78875       9.693732 82.16462 4.436099 69.23316 5.798898 12.93146       7.301108 
1 1 1 -3  35 7  o 135.0040 3.025759 223.1435       9.954444 219.8145       14.97083 225.7818       13.32746 133.4951 4.608889 135.4871 4.041094 -1.992035      6.129624 
1 1 1 -3  35 8  f 55.27379 3.407289 37.60235       4.567181 39.39973       6.812233 36.13482       6.155517 56.26256 5.021316 53.92789 4.731885 2.334671       6.899591 
1 1 1 -3  35 9  o 89.74903 3.270471 98.87859       7.140841 98.27415       9.563908 99.64003       10.73451 89.20292 4.413375 89.67345 4.931252 -0.4705353     6.617789 
1 1 1 -3  35 10 o 68.85807 3.815949 58.46130       6.378109 82.96504       13.27883 51.11268       7.271876 81.12316 6.778975 64.17441 4.682168 16.94875       8.238763 
1 1 1 -3  35 11 f 123.2954 3.386014 186.7618       10.16390 195.1701       20.54001 184.0354       11.69626 124.5133 6.795130 122.2163 3.932307 2.297035       7.850913 
1 1 1 -3  35 12 o 72.86739 3.606036 65.44875       6.383342 72.71206       12.94352 63.11447       7.337736 75.60609 7.108616 71.39634 4.236498 4.209747       8.275285 
1 1 1 -3  35 13 o 26.32345 8.474479 8.793185       6.175091 0.000000       0.000000 8.793185       6.175091 ?        ?        26.32345 8.474479 0.000000       8.474479 
1 1 1 -3  35 14 o 45.25002 4.378207 25.57137       4.767581 26.42501       9.701767 25.29960       5.474149 44.29837 9.284697 44.81310 5.103586 -0.5147285     10.59491 
1 1 1 -3  35 15 o 55.01310 3.995745 37.59885       5.320218 14.01648       10.27171 46.24474       6.219481 32.57144 10.95199 60.97823 4.211327 -28.40680      11.73377 
1 1 1 -3  35 16 o 25.15446 6.618773 8.339044       4.111304 19.90892       9.509993 5.679658       4.559386 37.82497 10.11949 21.57427 7.296722 16.25070       12.47583 
1 1 1 -3  35 17 o 94.12853 3.302984 109.4139       7.564676 119.8126       16.49887 106.6460       8.512106 96.25996 7.083117 92.74021 3.774341 3.519753       8.025970 
1 1 1 -3  35 18 o 25.18494 6.297615 8.415770       3.854557 9.218035       8.128941 8.183063       4.378041 27.08685 9.705520 24.78948 6.962206 2.297373       11.94443 
1 1 1 -3  35 19 o 30.19762 6.261297 12.10283       4.456226 3.673017       8.492304 15.30594       5.234832 22.74541 9.406559 33.93173 6.568248 -11.18632      11.47280 
1 1 1 -3  35 20 o 49.78666 3.967621 31.14172       4.773908 39.10073       10.57614 29.10514       5.349940 53.27246 8.426816 47.85405 4.646094 5.418415       9.622756 
1 1 1 -3  35 21 o 16.28361 6.349751 2.418307       3.634723 2.717594       7.433348 2.324263       4.166839 20.76690 8.710711 16.85686 6.727976 3.910036       11.00646 
1 1 1 -3  35 22 f 68.28107 3.425804 58.33066       5.682108 71.54903       12.52462 54.90496       6.376029 72.59765 7.173204 65.93665 3.986770 6.661003       8.206655 
1 1 1 -3  35 23 o 14.00312 5.942539 0.6221917      3.525445 0.3161731      7.974213 0.6965366      3.930424 19.34538 8.562060 14.71623 6.260978 4.629154       10.60701 
1 1 1 -3  35 24 o 27.16053 5.681593 10.07004       3.639441 19.80732       7.214520 6.746260       4.215075 36.50379 8.298803 21.96664 6.994358 14.53715       10.85316 
1 1 1 -3  35 25 o 13.90864 6.038054 0.2685757      3.797814 -0.3620237     6.180011 0.6512308      4.814113 16.60495 7.431236 15.65517 6.797173 0.9497757      10.07099 
1 1 1 -3  35 26 o 33.77816 5.278652 15.54491       4.202951 11.69636       9.998707 16.37086       4.632055 26.29153 10.44550 34.36847 5.732458 -8.076935      11.91510 
1 1 1 -3  35 27 o 21.82438 6.207006 6.923518       3.457455 6.981827       6.088279 6.895762       4.200495 21.74960 8.286561 21.54183 6.993996 0.2077713      10.84357 
1 1 1 -3  35 28 o 22.33075 6.020995 7.306732       3.350676 13.43653       6.040446 4.582287       4.027031 28.50043 8.235682 18.27841 6.786983 10.22202       10.67191 
1 1 1 -3  35 29 o 19.15042 6.220573 5.442095       3.322625 -1.175564      5.821012 8.640167       4.046601 14.94893 6.890405 23.60696 6.715400 -8.658026      9.621552 
1 1 1 -3  35 30 o 17.14144 7.190648 3.450104       5.066090 6.939170       9.151968 1.908654       6.083094 20.90139 9.215072 16.70463 7.430994 4.196764       11.83796 
1 1 1 -3  35 31 o 14.85926 6.249191 2.222679       3.841550 -0.9530603     5.841683 4.642473       5.099231 14.56432 6.778559 17.85629 7.326897 -3.291961      9.981597 
1 1 1 -3  35 32 o 14.60371 5.917935 2.599751       3.276772 0.2373016      5.917419 3.644546       3.935198 14.99404 6.924065 16.15644 6.507372 -1.162399      9.502029 
1 1 1 -3  35 33 o 12.35601 5.461555 0.5876895      3.234460 1.018065       5.628366 0.3754763      3.952251 14.95769 6.850494 13.04449 5.881494 1.913197       9.028912 
1 1 1 -3  36 1  o 37.40745 5.109337 17.62736       4.535962 21.89856       5.770167 10.71851       7.338652 41.57555 5.857414 29.01229 9.227966 12.56326       10.92999 
1 1 1 -3  36 2  o 36.53245 4.573639 16.71782       3.982731 19.75554       5.605046 13.62001       5.660223 39.40468 6.028441 32.28819 7.358172 7.116493       9.512350 
1 1 1 -3  36 3  o 128.7940 3.005209 203.2583       9.432056 212.8321       14.36108 195.9958       12.50798 131.2617 4.496293 126.1111 4.075381 5.150604       6.068392 
1 1 1 -3  36 4  o 61.85708 3.340360 47.08728       5.016545 49.90790       7.298554 44.56147       6.906594 63.37225 4.760892 59.85913 4.774292 3.513119       6.742400 
1 1 1 -3  36 5  o 121.9545 3.001889 182.2890       8.921306 199.5661       13.84419 170.0193       11.66669 127.0711 4.477795 117.4172 4.083581 9.653809       6.060222 
1 1 1 -3  36 6  o 144.8213 3.062285 257.1711       10.80722 274.7109       16.82660 244.8553       14.09983 149.0012 4.639809 140.8969 4.110940 8.104309       6.199004 
1 1 1 -3  36 7  o 62.30961 3.279868 47.79300       4.962669 52.23661       7.094681 43.53579       6.944283 64.86176 4.516793 59.09476 4.865223 5.766998       6.638661 
1 1 1 -3  36 8  o 97.77138 2.935695 117.3155       6.986610 102.2607       9.866364 132.4573       9.894816 90.84167 4.470664 103.6068 3.926176 -12.76516      5.949933 
1 1 1 -3  36 9  o 124.8753 2.977845 191.3040       9.061807 187.4851       13.42578 194.4996       12.28123 123.0148 4.486151 125.5013 4.020856 -2.486443      6.024354 
1 1 1 -3  36 10 o 61.13499 3.984296 46.31736       5.903437 47.95072       10.45320 45.55245       7.153404 61.10454 7.155400 60.36599 4.905006 0.7385521      8.675184 
1 1 1 -3  36 11 o 33.81939 6.762239 14.94902       5.378148 0.000000       0.000000 14.94902       5.378148 ?        ?        33.81939 6.762239 0.000000       6.762239 
1 1 1 -3  36 12 o 13.46434 6.177270 -3.004531      4.603314 0.000000       0.000000 -3.004531      4.603314 ?        ?        13.46434 6.177270 0.000000       6.177270 
1 1 1 -3  36 13 o 39.19241 5.016298 19.47853       4.681257 17.27252       8.972501 20.30360       5.487295 35.32589 9.982983 39.76297 5.836585 -4.437077      11.56398 
1 1 1 -3  36 14 o 34.11156 5.310653 14.93128       4.270903 21.65659       9.125791 13.04514       4.832833 39.48568 9.582400 31.46594 6.517262 8.019735       11.58866 
1 1 1 -3  36 15 o 83.57632 3.416640 86.44883       6.943876 66.88733       13.22340 93.89671       8.159398 71.22505 7.743050 86.92286 3.861655 -15.69781      8.652583 
1 1 1 -3  36 16 o 86.43700 3.399022 92.57677       7.145660 88.82983       14.78080 93.71959       8.162957 82.11250 7.468366 86.75618 3.870847 -4.643677      8.411893 
1 1 1 -3  36 17 o 27.69389 6.890371 10.36772       4.631205 6.190166       8.467433 12.15084       5.531979 24.48020 9.648121 29.77783 7.599233 -5.297628      12.28147 
1 1 1 -3  36 18 o 43.53806 4.390177 24.04460       4.594324 22.46165       9.670695 24.50600       5.221153 39.07079 10.08782 43.71198 4.990840 -4.641182      11.25489 
1 1 1 -3  36 19 o 28.34498 5.999571 10.77457       4.014753 5.835729       8.711070 12.10656       4.523855 23.96873 9.671973 29.92293 6.397774 -5.954203      11.59649 
1 1 1 -3  36 20 o 38.30627 4.837709 19.00020       4.415389 23.52717       9.642465 17.79914       4.966702 39.29734 10.03509 36.62514 5.754378 2.672199       11.56788 
1 1 1 -3  36 21 o 33.68822 5.015099 14.89871       3.991788 11.02675       8.379856 16.03519       4.539978 27.41102 9.850227 34.70360 5.555716 -7.292576      11.30898 
1 1 1 -3  36 22 o 22.30769 7.170114 6.963983       4.421699 9.103693       8.775354 6.235864       5.119038 25.47245 9.884995 21.56830 7.704894 3.904146       12.53310 
1 1 1 -3  36 23 o 32.18707 5.239419 13.93424       3.968391 27.00080       9.727768 11.32560       4.346508 40.78762 9.890324 28.29227 6.448290 12.49535       11.80673 
1 1 1 -3  36 24 o 15.75289 6.950474 0.2725942      5.215867 0.000000       0.000000 0.2725942      5.215867 ?        ?        15.75289 6.950474 0.000000       6.950474 
1 1 1 -3  36 25 o 23.92533 7.052415 8.586547       4.390810 0.000000       0.000000 8.586547       4.390810 ?        ?        23.92533 7.052415 0.000000       7.052415 
1 1 1 -3  36 26 o 10.87117 5.029725 -1.822194      3.144274 3.538789       5.733600 -4.127822      3.760104 18.38445 7.676488 10.63346 5.091761 7.750999       9.211650 
1 1 1 -3  36 27 f 24.99931 5.959482 9.154149       3.579059 5.087507       6.108287 11.28023       4.416638 19.58987 8.026540 27.24390 6.699895 -7.654026      10.45533 
1 1 1 -3  36 28 o 29.67020 6.166479 13.14710       4.312850 20.55936       6.606057 7.640838       5.693713 35.33963 7.872612 21.46741 8.050380 13.87222       11.25996 
1 1 1 -3  36 29 o 11.02248 5.318475 -4.577971      4.286561 -4.679086      5.774275 -4.453839      6.397786 12.96856 6.235973 13.74533 6.597663 -0.7767658     9.078355 
1 1 1 -3  36 30 o 28.59576 5.601209 12.24292       3.763494 21.42045       6.852893 8.279611       4.503392 34.41418 8.273818 21.86842 7.249648 12.54576       11.00061 
1 1 1 -3  36 31 o 16.30944 6.216938 3.955948       3.427953 3.207777       6.069237 4.306426       4.153975 16.78444 7.446996 16.90877 6.727838 -0.1243286     10.03601 
1 1 1 -3  36 32 o 13.93131 5.888610 2.021625       3.438842 1.369911       6.155401 2.317324       4.146232 15.48021 7.117199 14.76789 6.359672 0.7123203      9.544629 
1 1 1 -3  37 1  o 54.13426 4.140806 36.41343       5.421061 46.01006       9.760767 32.13285       6.518926 59.97909 6.797740 50.48932 5.381178 9.489769       8.669853 
1 1 1 -3  37 2  o 84.86240 3.494329 88.77995       7.210828 112.7654       13.87867 79.91111       8.439315 94.60281 6.051894 80.25204 4.331391 14.35077       7.442202 
1 1 1 -3  37 3  o 23.12469 6.984372 6.864025       4.266146 15.79285       7.533720 2.649356       5.175997 34.24879 8.934533 18.88718 7.511648 15.36161       11.67265 
1 1 1 -3  37 4  o 52.55918 4.257017 34.38855       5.405802 45.21770       9.934284 29.83307       6.443272 59.33875 7.004952 48.56367 5.543693 10.77508       8.933189 
1 1 1 -3  37 5  o 62.91439 3.274708 48.80553       5.003354 45.59428       7.233669 51.75100       6.927856 60.33936 4.963352 64.47807 4.436143 -4.138706      6.656893 
1 1 1 -3  37 6  f 64.88341 3.234705 51.90086       5.098386 56.58432       7.315818 47.47840       7.109042 67.40209 4.479451 61.62395 4.771106 5.778145       6.544382 
1 1 1 -3  37 7  f 35.38852 4.749098 15.83874       3.992236 20.07574       5.672845 11.68138       5.619284 39.50267 6.088370 29.60690 7.712656 9.895769       9.826155 
1 1 1 -3  37 8  o 54.03682 3.501645 36.14978       4.586202 29.44824       6.458488 42.96618       6.513600 48.13213 5.611428 58.61150 4.597155 -10.47937      7.254099 
1 1 1 -3  37 9  o 73.70483 3.458764 67.14919       6.194980 68.74834       10.81112 66.36742       7.559075 73.49898 6.090699 73.00266 4.267681 0.4963150      7.437050 
1 1 1 -3  37 10 o 22.02591 7.663444 5.827617       5.038844 0.000000       0.000000 5.827617       5.038844 ?        ?        22.02591 7.663444 0.000000       7.663444 
1 1 1 -3  37 11 o 19.40960 6.759281 4.443757       3.920445 11.21861       6.934250 1.260751       4.753007 28.84048 8.941939 16.86909 7.012156 11.97139       11.36348 
1 1 1 -3  37 12 o 33.09433 5.732355 14.23732       4.455605 12.08797       8.412163 15.07543       5.252959 29.87074 9.908537 33.75810 6.622103 -3.887363      11.91769 
1 1 1 -3  37 13 o 58.01113 3.925078 42.03521       5.516086 43.78904       10.83140 41.42106       6.409523 57.12552 7.999684 57.31172 4.628643 -0.1861992     9.242255 
1 1 1 -3  37 14 o 76.39054 3.552989 72.56657       6.595963 97.87902       13.99897 65.34350       7.478079 86.62611 6.683126 72.15533 4.272023 14.47078       7.931857 
1 1 1 -3  37 15 o 99.89664 3.353998 123.9117       8.153302 108.8905       15.52057 129.6370       9.581939 90.76303 7.072981 101.8689 3.866918 -11.10583      8.061025 
1 1 1 -3  37 16 o 28.80316 7.006364 11.36929       4.870000 0.8348516      8.560695 16.40966       5.921540 20.70181 9.025231 34.61029 7.253337 -13.90848      11.57867 
1 1 1 -3  37 17 o 10.60908 5.052524 -4.215668      3.597448 -6.499747      7.503901 -3.534049      4.099231 15.76377 7.445508 11.97776 5.608684 3.786011       9.321637 
1 1 1 -3  37 18 o 16.72928 6.437454 2.822624       3.698702 -7.993154      7.551360 6.236447       4.242451 15.14915 7.243719 21.55545 7.031003 -6.406294      10.09487 
1 1 1 -3  37 19 o 14.94642 6.125696 1.493998       3.558989 3.196007       8.748888 1.156499       3.895906 21.66991 9.283490 15.09073 6.316397 6.579181       11.22854 
1 1 1 -3  37 20 o 14.82090 6.079766 1.520783       3.509860 -0.9602824     7.651659 2.181941       3.949928 18.09441 8.168681 16.11310 6.509019 1.981310       10.44484 
1 1 1 -3  37 21 o 18.00023 6.872713 3.768948       4.193674 11.52917       8.260149 1.074049       4.867681 26.98526 9.768762 16.10251 6.911987 10.88275       11.96680 
1 1 1 -3  37 22 o 31.18608 5.573648 13.37558       4.080336 9.359905       8.707998 14.50531       4.618771 24.77301 9.777813 32.14569 6.119604 -7.372681      11.53495 
1 1 1 -3  37 23 o 16.47439 6.684011 2.621918       4.185814 0.000000       0.000000 2.621918       4.185814 ?        ?        16.47439 6.684011 0.000000       6.684011 
1 1 1 -3  37 24 o 41.23275 4.669685 22.75616       4.609586 24.01617       9.785966 22.39688       5.225627 35.95004 10.51005 40.26318 5.467019 -4.313145      11.84692 
1 1 1 -3  37 25 o 38.41031 5.118099 20.30695       4.671512 21.79800       9.514149 19.83328       5.362430 33.44218 10.49044 37.05810 6.153779 -3.615913      12.16217 
1 1 1 -3  37 26 o 17.63631 7.162694 3.834112       4.812497 11.71024       8.274920 -0.1913857     5.915852 24.77671 9.603406 15.59223 7.095880 9.184482       11.94056 
1 1 1 -3  37 27 o 21.31732 7.605189 7.550809       4.985765 22.72593       11.03416 3.657716       5.588827 30.45696 11.24814 17.66706 7.489129 12.78990       13.51324 
1 1 1 -3  37 28 o 14.21501 6.084119 1.580604       3.751335 6.637041       6.228872 -1.297170      4.699108 19.88976 8.122222 13.21542 6.126339 6.674337       10.17362 
1 1 1 -3  37 29 o 17.19995 6.407491 4.522213       3.594876 10.57783       6.794127 2.167686       4.236492 22.71390 8.728827 15.02533 6.448931 7.688562       10.85270 
1 1 1 -3  37 30 o 33.78769 5.025414 16.65596       4.011990 17.03598       7.353463 16.49490       4.787286 27.77362 9.265497 32.12751 6.339939 -4.353886      11.22694 
1 1 1 -3  37 31 o 12.87012 5.664751 0.8902199      3.444965 -0.4174676     6.192932 1.476196       4.145569 14.61123 6.858403 14.06840 6.202292 0.5428362      9.246952 
1 1 1 -3  38 1  f 127.6517 3.004795 200.5499       9.347117 189.7171       13.63657 210.1501       12.83725 123.2865 4.546718 130.0793 4.054697 -6.792770      6.092062 
1 1 1 -3  38 2  o 54.30956 3.780898 36.68136       4.972638 38.18573       6.791749 34.94316       7.300526 54.95969 5.130363 52.28051 5.829369 2.679180       7.765447 
1 1 1 -3  38 3  o 107.3682 3.202161 142.2119       8.368919 130.0584       11.05717 158.5117       12.80519 102.0853 4.455450 112.5840 4.677567 -10.49867      6.459929 
1 1 1 -3  38 4  o 11.53541 5.280889 -2.121987      3.339960 -3.156707      4.286572 -0.5231405     5.328463 12.73088 5.884001 16.28265 7.109126 -3.551776      9.228279 
1 1 1 -3  38 5  o 35.33180 5.008617 15.93683       4.191677 14.93023       5.468729 17.37042       6.526378 33.53427 6.921645 35.94197 7.684182 -2.407700      10.34194 
1 1 1 -3  38 6  o 60.95783 4.517933 46.62473       6.663573 43.08997       9.988665 49.45937       8.944921 57.27119 7.324488 62.13466 5.981358 -4.863468      9.456467 
1 1 1 -3  38 7  o 83.85334 4.196109 87.77028       8.547146 0.000000       0.000000 87.77028       8.547146 ?        ?        83.85334 4.196109 0.000000       4.196109 
1 1 1 -3  38 8  o 111.5287 4.051598 155.0124       10.99327 0.000000       0.000000 155.0124       10.99327 ?        ?        111.5287 4.051598 0.000000       4.051598 
1 1 1 -3  38 9  o 44.45922 4.810221 25.11054       5.128602 28.52540       9.535164 23.72050       6.083514 45.36097 8.944016 42.71856 6.009813 2.642414       10.77559 
1 1 1 -3  38 10 o 23.83854 6.826391 7.600822       4.167886 12.46377       7.078850 5.020534       5.156404 29.88919 8.990129 20.96490 7.698429 8.924288       11.83589 
1 1 1 -3  38 11 o 22.80778 6.968717 6.910776       4.230372 3.160428       7.769246 8.491282       5.043606 21.61298 8.972998 25.06165 7.599440 -3.448664      11.75866 
1 1 1 -3  38 12 o 120.3620 3.433599 180.0948       10.06077 164.3136       18.96943 186.2713       11.86736 111.5084 7.016456 121.9812 3.997717 -10.47276      8.075419 
1 1 1 -3  38 13 o 116.9208 3.384143 170.1199       9.632069 158.6645       18.61169 174.3104       11.25681 109.2091 7.030795 117.9322 3.922395 -8.723122      8.050917 
1 1 1 -3  38 14 o 117.7404 3.906079 174.1045       11.19183 175.0197       19.53427 173.6573       13.65520 114.2909 7.048022 116.6935 4.812251 -2.402580      8.534188 
1 1 1 -3  38 15 o 27.21435 6.372626 10.13823       4.151393 18.01472       8.248822 7.466577       4.804139 34.61825 9.494558 23.33452 7.471154 11.28373       12.08159 
1 1 1 -3  38 16 o 11.71944 5.428265 -2.547551      3.677578 8.020135       7.557415 -5.826370      4.209612 24.59419 9.263748 10.93268 5.273996 13.66151       10.65983 
1 1 1 -3  38 17 o 47.27822 4.307152 28.72023       4.907922 25.55339       10.61698 29.58089       5.534801 39.53316 10.74268 47.67598 4.830530 -8.142822      11.77876 
1 1 1 -3  38 18 o 14.02174 6.034508 0.4193592      3.728535 -5.106697      7.458268 2.260589       4.305111 15.87100 7.473680 16.57544 6.758631 -0.7044344     10.07646 
1 1 1 -3  38 19 o 19.15797 6.737831 4.878802       3.901559 16.23066       8.402622 1.758651       4.405236 31.25917 9.865887 16.09882 6.725914 15.16035       11.94042 
1 1 1 -3  38 20 o 16.67217 6.511989 3.026366       3.827935 3.156695       8.175979 2.989777       4.332075 20.34066 8.844552 17.11005 6.849621 3.230608       11.18675 
1 1 1 -3  38 21 o 9.444022 4.681766 -8.480819      4.070597 -13.20059      7.035173 -6.105475      4.990882 12.38319 6.141619 11.86557 5.728619 0.5176229      8.398604 
1 1 1 -3  38 22 o 15.13905 6.792006 -0.2845259     5.197418 0.000000       0.000000 -0.2845259     5.197418 ?        ?        15.13905 6.792006 0.000000       6.792006 
1 1 1 -3  38 23 o 39.30691 5.867287 21.91960       5.448257 47.85672       10.72584 12.90012       6.325012 54.84251 8.283571 27.66571 8.533699 27.17681       11.89292 
1 1 1 -3  38 24 o 21.41687 7.436819 7.239581       4.744068 -0.2626897     8.546865 10.58027       5.703330 17.79408 8.253500 25.01049 8.151777 -7.216406      11.60051 
1 1 1 -3  38 25 o 29.55605 6.238481 13.14262       4.351910 21.18315       9.647292 11.08842       4.876240 31.19493 10.61329 26.02038 7.361585 5.174551       12.91646 
1 1 1 -3  38 26 o 25.09120 7.186090 10.45687       4.618383 18.86544       9.351337 7.744290       5.311336 28.63995 10.39030 21.20950 7.808991 7.430450       12.99764 
1 1 1 -3  38 27 o 11.25036 5.306128 -2.408209      3.786138 -3.417272      7.548013 -2.068961      4.376555 14.95957 7.176751 12.29823 5.770429 2.661341       9.208887 
1 1 1 -3  38 28 o 16.07476 6.713539 3.291831       4.386785 0.000000       0.000000 3.291831       4.386785 ?        ?        16.07476 6.713539 0.000000       6.713539 
1 1 1 -3  38 29 o 17.66637 6.495692 5.069936       3.673020 6.577493       6.791428 4.446673       4.366765 19.03399 8.167242 16.99350 6.851248 2.040491       10.66037 
1 1 1 -3  39 1  o 94.35177 2.997597 110.0328       6.883478 106.9905       9.967326 112.8068       9.517652 92.25447 4.446680 94.93726 4.123767 -2.682785      6.064521 
1 1 1 -3  39 2  o 62.41090 3.257596 48.33958       4.937281 41.17295       6.923309 55.75607       7.042967 56.85552 5.049413 66.57049 4.365570 -9.714970      6.674936 
1 1 1 -3  39 3  o 16.89038 6.247445 3.040566       3.406246 1.612888       4.504684 4.946814       5.205215 16.70447 6.873848 20.89008 7.723665 -4.185606      10.33948 
1 1 1 -3  39 4  o 47.62239 3.696485 28.37113       4.256224 25.94016       5.919701 30.97272       6.123911 44.80567 5.539501 49.17262 5.188715 -4.366943      7.590048 
1 1 1 -3  39 5  f 52.87188 4.035075 35.11632       5.159638 31.42229       8.470217 37.29575       6.506032 48.32031 7.430980 54.07542 4.993570 -5.755112      8.952944 
1 1 1 -3  39 6  o 30.68140 5.860674 12.44608       4.222129 5.465620       6.597915 17.28681       5.494398 22.41055 8.604524 36.00909 6.500556 -13.59854      10.78402 
1 1 1 -3  39 7  o 28.25901 5.457137 10.51367       3.621938 8.814304       4.761520 12.84713       5.579588 25.40509 7.303103 30.48854 7.549895 -5.083450      10.50411 
1 1 1 -3  39 8  o 55.39647 4.163669 38.72399       5.579618 35.12599       8.062653 42.03073       7.729434 51.45313 6.580717 56.93005 5.645767 -5.476917      8.670671 
1 1 1 -3  39 9  o 56.66005 3.756144 40.29557       5.156995 35.37942       6.386562 49.50699       8.742142 52.45267 5.059174 61.56944 5.898674 -9.116764      7.771074 
1 1 1 -3  39 10 o 84.18641 4.020295 89.25707       8.223926 90.49805       13.50605 88.52584       10.36749 82.35622 6.789968 82.98289 5.152245 -0.6266708     8.523455 
1 1 1 -3  39 11 o 95.34423 3.953640 114.5180       9.166094 118.0630       15.02465 112.4165       11.56828 94.12846 6.591758 93.45720 5.098801 0.6712570      8.333610 
1 1 1 -3  39 12 o 78.81692 4.951797 80.02132       9.462764 83.61596       12.97556 75.93767       13.83001 78.70009 6.833396 73.92462 7.794276 4.775467       10.36562 
1 1 1 -3  39 13 o 31.14198 7.977603 14.05979       6.080564 14.38496       8.247925 13.67265       8.999593 30.56727 9.789561 29.75691 10.24723 0.8103600      14.17184 
1 1 1 -3  39 14 o 46.51858 4.794872 28.15453       5.357723 33.01650       8.908669 25.39957       6.706007 48.03153 7.884482 42.98391 6.613785 5.047615       10.29112 
1 1 1 -3  39 15 o 66.21941 4.302412 56.36883       6.905191 68.54404       12.19858 50.62799       8.376422 69.83837 7.274174 61.60752 5.641991 8.230846       9.205741 
1 1 1 -3  39 16 o 25.09079 7.093259 9.138292       4.528980 15.68092       7.996604 6.048542       5.495296 31.07944 9.596827 21.29795 7.924449 9.781492       12.44572 
1 1 1 -3  39 17 o 18.23903 6.808226 4.138483       4.062601 5.777578       7.380112 3.425842       4.866272 21.75920 8.857782 18.09011 7.253627 3.669094       11.44882 
1 1 1 -3  39 18 o 24.46505 7.212721 8.915670       4.592369 8.151374       7.896901 9.306231       5.645078 23.58188 9.310182 24.60446 8.115168 -1.022575      12.35052 
1 1 1 -3  39 19 o 14.52118 6.352859 0.3717867      4.273851 -3.043243      7.634518 1.930462       5.157773 16.48116 7.696775 16.82339 7.165343 -0.3422241     10.51582 
1 1 1 -3  39 20 o 20.67641 9.016852 4.263573       8.550272 0.000000       0.000000 4.263573       8.550272 ?        ?        20.67641 9.016852 0.000000       9.016852 
1 1 1 -3  39 21 o 16.36349 6.501029 3.013049       3.872958 4.159104       7.483347 2.593774       4.526298 19.79188 8.533726 16.51939 6.852772 3.272484       10.94463 
1 1 1 -3  39 22 o 22.60841 6.805578 7.903374       4.055416 15.56997       8.269901 5.476031       4.653337 28.36083 9.820442 19.36091 7.274152 8.999920       12.22106 
1 1 1 -3  39 23 o 17.63624 6.660735 4.364720       3.912903 -3.617061      7.492677 7.357846       4.588277 15.36570 7.310450 21.37395 7.318274 -6.008251      10.34407 
1 1 1 -3  39 24 o 19.29922 6.666337 5.815465       3.809819 7.614344       7.973728 5.283316       4.336877 21.04607 8.934459 18.61693 7.016452 2.429138       11.36024 
1 1 1 -3  39 25 o 25.80149 7.328179 11.32596       4.822571 14.01591       9.141869 10.28875       5.676691 24.61002 9.916205 23.59012 8.137845 1.019892       12.82792 
1 1 1 -3  39 26 o 22.01178 6.952945 8.216217       4.172521 14.79380       8.918359 6.372980       4.721093 24.78956 9.859762 19.39950 7.318626 5.390059       12.27914 
1 1 1 -3  39 27 o 17.40260 6.592099 4.786070       3.839331 -0.3018603     7.272530 6.751993       4.520621 15.65389 7.374092 19.64339 7.209037 -3.989498      10.31249 
1 1 1 -3  40 1  o 42.43823 4.463768 23.04007       4.547272 25.90191       5.713058 18.09279       7.511551 44.57024 5.367968 35.27835 8.774025 9.291889       10.28584 
1 1 1 -3  40 2  o 31.71798 4.975890 13.12702       3.719598 9.907491       5.084412 16.83410       5.455816 26.59319 7.514831 35.21318 6.600413 -8.619991      10.00191 
1 1 1 -3  40 3  o 15.36478 6.274206 1.568563       3.716732 1.991979       5.927566 1.294240       4.771163 18.54036 7.777792 16.56490 6.965322 1.975456       10.44077 
1 1 1 -3  40 4  o 9.232101 4.500610 -5.602964      3.282505 -7.010391      4.624350 -4.173641      4.660184 11.20734 5.435550 12.60336 5.926454 -1.396029      8.041645 
1 1 1 -3  40 5  o 53.97739 3.481616 36.54219       4.555189 24.53316       6.025170 52.56387       6.959363 43.01567 5.903419 64.20786 4.475824 -21.19218      7.408330 
1 1 1 -3  40 6  o 35.86343 4.579453 16.60447       3.911042 11.61005       5.155116 23.37777       6.003387 28.71561 7.339897 41.84587 6.063663 -13.13027      9.520614 
1 1 1 -3  40 7  o 23.24506 6.204583 7.400646       3.580193 10.52987       4.826424 3.572134       5.338534 27.36684 7.157107 19.18609 7.629282 8.180746       10.46089 
1 1 1 -3  40 8  o 14.35844 5.799609 1.515439       3.135491 -0.1073136E-02 4.236850 3.351651       4.662099 14.59205 6.355631 18.27438 7.172175 -3.682330      9.583014 
1 1 1 -3  40 9  o 13.24285 5.626499 0.4914145      3.166765 -0.8645501     4.202164 2.273661       4.817623 13.82288 6.160927 17.32909 7.117358 -3.506206      9.413490 
1 1 1 -3  40 10 o 34.24139 6.561599 16.24182       5.275932 17.88663       8.303739 15.12830       6.832256 33.78191 9.623018 31.71949 8.617064 2.062412       12.91729 
1 1 1 -3  40 11 f 18.93493 7.248072 4.139953       4.672076 -1.347890      7.119032 8.291791       6.192134 17.31283 7.841365 24.08459 8.486823 -6.771769      11.55479 
1 1 1 -3  40 12 o 30.86953 6.046849 13.15845       4.385989 12.28419       8.186550 13.51043       5.194372 27.85244 9.762819 30.64822 7.095125 -2.795782      12.06870 
1 1 1 -3  40 13 o 19.57473 6.785624 5.165423       3.948850 11.29516       7.750590 3.016429       4.589144 26.74698 9.488487 17.52042 7.037557 9.226566       11.81349 
1 1 1 -3  40 14 o 36.88196 5.243782 18.31677       4.580323 16.76477       8.385221 18.97678       5.468192 31.58028 9.839783 36.79702 6.326095 -5.216743      11.69790 
1 1 1 -3  40 15 o 33.43233 5.556746 15.33803       4.368281 9.371663       7.237022 18.75769       5.478940 24.58487 9.104007 36.40680 6.409582 -11.82194      11.13399 
1 1 1 -3  40 16 o 22.15030 7.000242 7.213376       4.228992 8.762922       7.964564 6.604973       4.990628 23.93634 9.380298 21.37045 7.610542 2.565889       12.07933 
1 1 1 -3  40 17 o 31.93819 6.025743 14.47432       4.517920 16.48304       8.979815 13.79353       5.227761 29.99227 10.23886 30.25513 7.196007 -0.2628651     12.51466 
1 1 1 -3  40 18 o 17.31308 6.730241 3.648684       4.073356 0.6514765E-01  7.622115 5.081275       4.819264 17.68932 8.051878 19.31555 7.369320 -1.626230      10.91511 
1 1 1 -3  40 19 o 18.60919 7.153413 4.693044       4.563864 0.000000       0.000000 4.693044       4.563864 ?        ?        18.60919 7.153413 0.000000       7.153413 
1 1 1 -3  40 20 o 18.21324 6.751914 4.689236       3.982571 -5.024220      7.424253 8.613563       4.718984 14.94033 7.154259 23.15872 7.403578 -8.218388      10.29545 
1 1 1 -3  40 21 o 26.96187 6.498683 11.15384       4.219424 14.16711       8.907575 10.28212       4.791033 26.11204 10.00484 25.07491 7.360297 1.037136       12.42058 
1 1 1 -3  40 22 o 39.49447 4.887809 21.81684       4.603904 19.42096       9.465479 22.55929       5.269178 29.24177 10.47359 39.35389 5.656722 -10.11212      11.90356 
1 1 1 -3  40 23 o 33.79284 5.836274 17.04968       4.632431 17.71470       9.333459 16.83232       5.336061 27.36785 10.29782 32.29495 6.983923 -4.927097      12.44268 
1 1 1 -3  40 24 o 15.47048 6.708783 2.189903       4.677993 13.68620       7.960117 -3.875223      5.781765 24.82242 9.470849 13.11331 6.288427 11.70911       11.36843 
1 1 1 -3  40 25 o 16.72434 6.884902 3.929459       4.521660 6.569970       7.936224 2.660334       5.502018 19.42885 8.572893 16.20552 7.144863 3.223331       11.15991 
1 1 1 -3  41 1  o 21.38237 6.473802 6.330847       3.662090 0.9316797      6.459578 8.888047       4.445525 17.98844 7.841097 24.97667 7.015972 -6.988232      10.52172 
1 1 1 -3  41 2  o 19.00217 6.278800 4.802349       3.378807 1.974657       4.547822 8.286127       5.047922 16.64004 6.882839 24.04095 7.654161 -7.400906      10.29367 
1 1 1 -3  41 3  o 45.60351 3.744483 26.45230       4.124654 24.59966       5.717004 28.46351       5.956658 42.88492 5.604485 46.32460 5.376346 -3.439682      7.766295 
1 1 1 -3  41 4  o 43.36314 4.352124 24.29786       4.536835 22.07642       5.703557 28.12485       7.486123 40.32917 5.984766 44.72586 7.105908 -4.396687      9.290391 
1 1 1 -3  41 5  o 21.84115 6.543739 6.671699       3.755907 4.147990       4.628522 11.53771       6.427013 18.87685 7.217093 27.58125 8.617743 -8.704399      11.24064 
1 1 1 -3  41 6  o 63.49085 3.596905 51.08310       5.542377 47.29629       7.134744 56.84547       8.801215 60.09594 4.914776 65.26740 5.587327 -5.171455      7.441320 
1 1 1 -3  41 7  o 24.28916 6.461648 8.359550       3.891116 9.738827       4.844503 5.852076       6.531933 25.81397 7.349180 21.65035 8.491767 4.163622       11.23034 
1 1 1 -3  41 8  o 15.37874 6.228646 1.977848       3.627652 -0.5657108     4.402455 7.357823       6.402716 14.18462 6.315110 22.90538 8.547616 -8.720759      10.62743 
1 1 1 -3  41 9  o 13.88142 5.890841 0.7982441      3.464318 1.780202       4.551271 -0.5543946     5.341671 16.27347 6.820294 15.46218 6.915119 0.8112879      9.712635 
1 1 1 -3  41 10 o 18.90244 6.857399 4.669185       4.073162 5.461050       6.076599 4.023110       5.488789 20.82794 8.184068 19.14720 7.694604 1.680738       11.23325 
1 1 1 -3  41 11 o 41.90382 4.640635 23.17214       4.659455 22.46420       8.822135 23.44601       5.487212 36.73911 9.709168 41.48412 5.568427 -4.745010      11.19265 
1 1 1 -3  41 12 o 48.95931 4.197223 31.20645       4.959373 35.39804       9.542383 29.65527       5.804943 47.89520 8.486388 46.97355 5.155813 0.9216499      9.929813 
1 1 1 -3  41 13 o 18.16303 6.683006 4.305064       3.889032 10.10065       7.436815 2.123578       4.562623 24.98511 9.233058 16.38531 6.845263 8.599808       11.49378 
1 1 1 -3  41 14 o 42.22179 4.764650 23.86319       4.816818 36.30750       9.258390 19.24470       5.640271 48.47765 8.124336 36.44666 6.593113 12.03099       10.46298 
1 1 1 -3  41 15 o 24.22181 7.450724 9.106232       4.825559 0.3945778      8.200959 13.71986       5.968092 18.33695 8.348748 29.20639 8.101768 -10.86944      11.63358 
1 1 1 -3  41 16 o 44.36762 4.685369 26.51937       4.989355 41.91409       10.76012 22.30279       5.631341 49.95437 9.177173 39.46284 6.048320 10.49152       10.99103 
1 1 1 -3  41 17 o 17.90800 7.442501 3.603504       5.352757 0.000000       0.000000 3.603504       5.352757 ?        ?        17.90800 7.442501 0.000000       7.442501 
1 1 1 -3  41 18 o 14.61556 6.134860 1.730389       3.691142 0.4040195      7.040669 2.233114       4.334574 16.88764 7.706869 15.75653 6.632999 1.131104       10.16821 
1 1 1 -3  41 19 o 28.42131 7.215712 13.03035       5.005720 1.027294       7.692061 21.84766       6.592722 17.45298 7.998996 36.64859 7.630312 -19.19561      11.05466 
1 1 1 -3  41 20 o 45.68251 5.351845 29.88448       5.845035 33.68567       10.48149 28.16888       7.041583 40.26544 10.55534 42.11335 7.114603 -1.847912      12.72921 
1 1 1 -3  41 21 o 23.23183 7.538042 9.373250       4.879829 10.01056       8.377768 9.045995       6.003361 22.26521 9.286742 22.15626 8.275021 0.1089535      12.43863 
1 1 1 -3  41 22 o 12.52796 6.001014 -3.798220      5.232866 -5.067019      6.809083 -1.967765      8.178467 13.71857 6.639728 15.91963 7.591830 -2.201052      10.08573 
1 1 1 -3  41 23 o 20.54950 7.630603 7.597251       5.090476 9.758100       8.576580 6.422014       6.325062 21.38356 9.176792 19.28845 8.058981 2.095106       12.21314 
1 1 1 -3  42 1  o 19.52491 6.378938 5.291511       3.491354 12.51055       4.980507 -1.683570      4.895628 29.19905 7.074728 14.06815 6.422588 15.13091       9.555177 
1 1 1 -3  42 2  o 53.18866 3.548601 36.06223       4.573208 34.75050       6.545610 37.31316       6.392108 50.80703 5.367827 52.97727 5.010839 -2.170238      7.343165 
1 1 1 -3  42 3  o 22.62610 6.138037 7.273888       3.469501 5.584015       4.882629 8.997379       4.930958 20.32785 7.486722 24.52470 7.529419 -4.196846      10.61806 
1 1 1 -3  42 4  o 18.46874 6.247055 4.624370       3.341965 3.049828       4.729633 6.194418       4.722878 17.55082 7.110711 20.97353 7.410003 -3.422716      10.26988 
1 1 1 -3  42 5  o 16.37948 6.014412 3.279284       3.147187 0.4872241      4.293809 6.520578       4.626361 14.73460 6.408205 21.33041 7.347013 -6.595807      9.749035 
1 1 1 -3  42 6  o 39.56002 4.520443 20.63354       4.279725 18.11710       5.357885 25.06927       7.113492 35.76115 6.382336 41.32577 7.332091 -5.564621      9.720790 
1 1 1 -3  42 7  o 45.50984 4.156461 26.97581       4.558790 24.47809       5.762050 31.15572       7.453999 42.13475 5.762616 46.64896 6.753325 -4.514217      8.877789 
1 1 1 -3  42 8  o 13.04362 5.580029 0.5757646      3.152659 -1.347153      4.496193 2.435580       4.421804 13.60072 6.188231 16.54142 6.808908 -2.940696      9.200838 
1 1 1 -3  42 9  o 44.33704 3.909929 25.50424       4.181225 24.01880       5.927985 26.97490       5.898416 41.34543 6.063734 44.26650 5.592535 -2.921070      8.248959 
1 1 1 -3  42 10 o 23.89037 6.787431 8.507901       4.136487 11.21405       8.185895 7.579941       4.793521 25.63158 9.644109 22.37778 7.481148 3.253801       12.20559 
1 1 1 -3  42 11 o 14.00763 6.071794 0.6096469      3.828461 -6.677120      6.355712 4.759275       4.796246 13.43285 6.480165 19.00535 7.326076 -5.572505      9.780794 
1 1 1 -3  42 12 o 29.64590 6.200415 12.77701       4.335166 12.23686       7.222783 13.08118       5.420010 26.44979 9.176682 28.81400 7.608030 -2.364210      11.92030 
1 1 1 -3  42 13 o 44.22554 6.236688 28.27481       6.535067 26.21471       8.873501 30.71657       9.660540 38.61236 9.497213 41.69392 9.692525 -3.081562      13.56990 
1 1 1 -3  42 14 f 20.33091 7.344025 6.289463       4.665322 6.953790       7.874722 5.930192       5.791025 21.48848 8.986194 20.15180 7.967493 1.336678       12.00969 
1 1 1 -3  42 15 o 29.25540 8.450022 14.82557       6.360284 0.000000       0.000000 14.82557       6.360284 ?        ?        29.25540 8.450022 0.000000       8.450022 
1 1 1 -3  42 16 o 19.34835 7.363236 5.682036       4.803643 0.000000       0.000000 5.682036       4.803643 ?        ?        19.34835 7.363236 0.000000       7.363236 
1 1 1 -3  42 17 o 12.39324 5.706940 -1.288514      3.979625 -6.055849      8.055502 0.2506624      4.577189 14.84024 7.191967 14.21988 6.377203 0.6203613      9.612134 
1 1 1 -3  42 18 o 14.20704 6.191308 1.150987       4.025247 0.2787463E-01  7.762869 1.564004       4.707550 16.74553 7.800581 15.22797 6.664611 1.517558       10.25993 
1 1 1 -3  42 19 o 16.08541 6.538072 3.253378       4.013524 11.03046       8.021354 0.6561053      4.635516 23.03911 9.286728 14.39621 6.439865 8.642900       11.30111 
1 1 1 -3  42 20 o 26.35603 6.749274 11.35275       4.353273 11.90444       8.779252 11.17288       5.012965 23.01968 9.546091 25.16150 7.564788 -2.141821      12.18006 
1 1 1 -3  42 21 f 16.54607 6.924030 3.576708       4.679979 9.413258       7.977545 0.5140278      5.778858 21.34228 8.992270 15.14084 6.937033 6.201433       11.35708 
1 1 1 -3  43 1  o 15.44734 6.191687 2.386466       3.544366 1.180081       4.729251 3.932403       5.353591 15.63729 6.763330 18.54806 7.546612 -2.910777      10.13380 
1 1 1 -3  43 2  o 21.79730 5.948962 6.852390       3.247533 5.516822       4.562387 8.224058       4.623637 19.77241 7.244577 23.18714 7.318506 -3.414732      10.29779 
1 1 1 -3  43 3  o 29.54349 5.260354 12.07307       3.648303 11.87045       5.291060 12.25672       5.037252 27.54761 7.623361 28.29633 7.267505 -0.7487144     10.53244 
1 1 1 -3  43 4  o 27.95474 6.272524 11.37743       4.167706 8.401314       5.234122 16.53333       6.889239 23.17309 7.818058 31.55177 8.686189 -8.378681      11.68640 
1 1 1 -3  43 5  o 41.19140 4.785467 22.87684       4.714291 24.74553       6.162683 20.24065       7.319629 41.49623 6.291366 35.08947 8.622663 6.406757       10.67387 
1 1 1 -3  43 6  o 24.78476 6.000010 8.920253       3.584639 8.125044       5.116415 9.686917       5.023746 22.76346 7.729346 24.76114 7.599546 -1.997684      10.83955 
1 1 1 -3  43 7  o 17.16696 6.115872 3.994139       3.223144 3.176299       4.578067 4.797946       4.538617 17.11362 6.972782 18.77655 7.154459 -1.662928      9.990294 
1 1 1 -3  43 8  o 21.69157 6.004107 6.901737       3.281663 4.852528       4.587992 9.048411       4.695832 18.80030 7.186018 23.98074 7.344966 -5.180433      10.27557 
1 1 1 -3  43 9  o 12.07050 5.369010 -0.2931421     3.174787 -2.862259      4.299576 2.786978       4.707796 12.14280 5.704438 16.74430 6.971014 -4.601499      9.007533 
1 1 1 -3  43 10 o 56.12855 4.154233 41.74879       5.641850 53.54821       11.78836 38.24310       6.425536 56.46302 8.858733 52.70127 5.065564 3.761749       10.20476 
1 1 1 -3  43 11 o 28.12486 6.396172 11.91239       4.284384 0.2819248      8.345108 16.07518       4.992588 17.81170 8.224302 32.72682 6.489464 -14.91512      10.47627 
1 1 1 -3  43 12 o 16.96427 6.717288 3.675193       4.121929 -1.993635      7.845459 5.836617       4.844419 16.33261 7.683023 19.58497 7.408017 -3.252359      10.67275 
1 1 1 -3  43 13 o 16.76362 6.982890 3.168035       4.727604 0.000000       0.000000 3.168035       4.727604 ?        ?        16.76362 6.982890 0.000000       6.982890 
1 1 1 -3  43 14 o 20.52781 8.190899 6.955047       6.174225 0.000000       0.000000 6.955047       6.174225 ?        ?        20.52781 8.190899 0.000000       8.190899 
1 1 1 -3  43 15 o 17.49782 6.749522 4.403728       4.073008 -5.954677      7.763594 8.337424       4.784283 14.52542 7.044360 22.16205 7.474555 -7.636638      10.27093 
1 1 1 -3  43 16 o 22.02609 6.928508 7.996838       4.147309 6.642369       7.565240 8.578789       4.958858 20.10168 8.622579 22.21383 7.608009 -2.112144      11.49916 
1 1 1 -3  43 17 o 11.17277 5.272402 -2.463474      3.747451 -0.3677474     6.733749 -3.403766      4.510460 15.61341 7.270498 11.80533 5.632049 3.808075       9.196745 
1 1 1 -3  43 18 o 21.69763 6.910470 7.916232       4.114359 8.342861       7.850471 7.754673       4.830974 20.83105 8.855000 21.00734 7.487113 -0.1762943     11.59603 
1 1 1 -3  44 1  o 19.23125 6.575150 5.514868       3.703468 4.615921       5.001298 6.606248       5.510662 18.51013 7.376536 20.62286 7.877267 -2.112726      10.79188 
1 1 1 -3  44 2  o 34.06229 5.110368 16.18243       4.111184 17.03577       5.611715 15.19383       6.040073 33.02930 7.177543 30.15029 8.064048 2.879013       10.79565 
1 1 1 -3  44 3  o 21.08930 6.872372 6.901335       4.053668 9.059122       5.298763 3.856402       6.294469 23.33636 7.866178 18.52127 7.902902 4.815086       11.15045 
1 1 1 -3  44 4  o 15.43728 5.996089 2.867988       3.231088 9.479662       4.961894 -1.999657      4.257466 24.02000 7.581500 12.48941 5.804031 11.53059       9.548084 
1 1 1 -3  44 5  o 28.40224 5.412634 11.53611       3.609525 10.80686       5.045197 12.30077       5.166233 25.62730 7.561171 27.46063 7.506827 -1.833330      10.65475 
1 1 1 -3  44 6  o 41.73770 4.310868 23.46266       4.321574 20.41507       6.242354 26.26768       5.988787 35.82676 7.395218 42.47051 5.949459 -6.643749      9.491328 
1 1 1 -3  44 7  o 23.43536 6.280975 8.392493       3.659647 4.127671       5.378271 12.06981       4.994102 18.05897 7.478740 27.22247 7.355387 -9.163500      10.48967 
1 1 1 -3  44 8  o 14.98482 5.969809 2.554918       3.274663 7.530403       5.094279 -0.9487149     4.274884 21.34478 7.678912 13.08801 5.985176 8.256765       9.735914 
1 1 1 -3  44 9  o 14.47205 5.856401 2.207444       3.203892 0.6220953      4.438167 3.932719       4.629885 14.36569 6.371315 17.38441 7.038217 -3.018714      9.493690 
1 1 1 -3  44 10 o 8.168270 4.122031 -11.03591      3.875973 -11.56786      6.866817 -10.78718      4.695488 12.09448 6.010212 9.520648 4.767817 2.573830       7.671684 
1 1 1 -3  44 11 o 16.96361 6.628733 3.952189       3.967839 -3.775106      7.659574 6.786334       4.638760 15.20448 7.276990 20.35658 7.327032 -5.152099      10.32666 
1 1 1 -3  44 12 o 25.64178 8.578232 12.42072       6.302364 0.000000       0.000000 12.42072       6.302364 ?        ?        25.64178 8.578232 0.000000       8.578232 
1 1 1 -3  44 13 o 14.82175 6.278869 2.039050       3.924121 -1.349524      7.975850 3.121269       4.507401 16.18415 7.653661 16.28202 6.803029 -0.9786415E-01 10.24010 
1 1 1 -3  44 14 o 15.17067 6.288147 2.552121       3.806813 11.42697       7.498808 -0.5291404     4.418511 23.44659 9.126856 13.30879 6.085666 10.13780       10.96972 
1 1 1 -3  45 1  o 12.91236 5.603295 0.7116258      3.267899 -2.779790      4.992058 3.329709       4.322854 12.89605 6.085510 16.52185 6.758930 -3.625798      9.094865 
1 1 1 -3  45 2  o 19.82867 6.593708 6.170696       3.724632 6.421307       7.236178 6.080368       4.344323 20.16317 8.533308 19.57440 7.084672 0.5887699      11.09098 
1 1 1 -3  45 3  o 14.15962 6.065226 1.420175       3.733498 -2.968243      7.500556 2.865617       4.304671 15.38644 7.318602 16.05158 6.672868 -0.6651487     9.903994 
1 1 1 -3  45 4  o 23.91940 6.899207 9.284238       4.242678 13.80916       8.029484 7.531580       4.997245 25.69343 9.575233 21.12653 7.604790 4.566895       12.22775 
1 1 1 -3  45 5  o 10.79705 5.066916 -2.194282      3.376905 -1.893394      5.004343 -2.445835      4.575719 13.33839 6.229876 12.49238 5.873713 0.8460140      8.562235 
1 1 1 -3  45 6  o 13.44607 5.824146 0.9763291      3.517347 -1.574159      5.069168 3.344404       4.884529 13.56711 6.314446 16.80544 7.055857 -3.238325      9.468757 
1 1 1 -3  45 7  o 13.41435 5.815655 0.9678609      3.513527 -5.251605      5.113210 6.531500       4.836114 11.87784 5.750012 19.90616 7.428616 -8.028312      9.393987 
1 1 1 -3  45 8  o 14.33366 6.190396 1.456963       3.950425 -5.173194      5.407269 9.046750       5.785366 12.26554 5.931740 22.27602 8.158610 -10.01048      10.08704 
1 1 1 -3  45 9  o 31.64355 5.275876 14.50986       3.925166 16.91455       5.767180 12.43470       5.357480 31.57811 7.589000 26.57239 7.778707 5.005714       10.86744 
1 1 1 -3  45 10 o 22.96443 7.792465 9.438615       5.200236 0.000000       0.000000 9.438615       5.200236 ?        ?        22.96443 7.792465 0.000000       7.792465 
1 1 1 -2  0  1  o 24.38972 2.561632 7.485228       1.480454 7.485228       1.480454 7.485228       1.480454 24.38972 2.561632 24.38972 2.561632 0.000000       0.000000 
1 1 1 -2  0  2  o 144.3330 3.685642 254.3520       12.94418 254.3520       12.94418 254.3520       12.94418 144.3330 3.685642 144.3330 3.685642 -0.000000      0.000000 
1 1 1 -2  0  3  o 342.8052 7.233308 1434.401       60.36482 1434.401       60.36482 1434.401       60.36482 342.8052 7.233308 342.8052 7.233308 -0.000000      0.000000 
1 1 1 -2  0  4  o 95.89988 3.030735 112.4019       7.066720 112.4019       7.066720 112.4019       7.066720 95.89988 3.030735 95.89988 3.030735 0.000000       0.000000 
1 1 1 -2  0  5  o 713.6515 14.48017 6224.107       251.5893 6224.107       251.5893 6224.107       251.5893 713.6515 14.48017 713.6515 14.48017 -0.000000      0.000000 
1 1 1 -2  0  6  o 250.9155 5.554030 768.4419       33.92276 768.4419       33.92276 768.4419       33.92276 250.9155 5.554030 250.9155 5.554030 -0.000000      0.000000 
1 1 1 -2  0  7  o 188.8388 4.487498 435.3083       20.62421 435.3083       20.62421 435.3083       20.62421 188.8388 4.487498 188.8388 4.487498 -0.000000      0.000000 
1 1 1 -2  0  8  o 16.72502 5.188845 4.261831       1.852129 4.261831       1.852129 4.261831       1.852129 16.72502 5.188845 16.72502 5.188845 -0.000000      0.000000 
1 1 1 -2  0  9  o 373.8656 11.15837 1709.773       101.4555 1709.773       101.4555 1709.773       101.4555 373.8656 11.15837 373.8656 11.15837 -0.000000      0.000000 
1 1 1 -2  0  10 o 146.8250 3.893957 263.2682       13.91029 263.2682       13.91029 263.2682       13.91029 146.8250 3.893957 146.8250 3.893957 -0.000000      0.000000 
1 1 1 -2  0  11 o 395.3577 8.300015 1908.917       79.88643 1908.917       79.88643 1908.917       79.88643 395.3577 8.300015 395.3577 8.300015 -0.000000      0.000000 
1 1 1 -2  0  12 o 560.6158 11.51365 3842.867       157.1451 3842.867       157.1451 3842.867       157.1451 560.6158 11.51365 560.6158 11.51365 -0.000000      0.000000 
1 1 1 -2  0  13 o 395.3928 8.327945 1909.721       80.16183 1909.721       80.16183 1909.721       80.16183 395.3928 8.327945 395.3928 8.327945 -0.000000      0.000000 
1 1 1 -2  0  14 o 256.8241 8.219045 807.0063       51.31965 807.0063       51.31965 807.0063       51.31965 256.8241 8.219045 256.8241 8.219045 0.000000       0.000000 
1 1 1 -2  0  15 o 427.9819 8.960452 2237.121       93.36016 2237.121       93.36016 2237.121       93.36016 427.9819 8.960452 427.9819 8.960452 -0.000000      0.000000 
1 1 1 -2  0  16 o 838.6379 17.02058 8606.463       347.5210 8606.463       347.5210 8606.463       347.5210 838.6379 17.02058 838.6379 17.02058 -0.000000      0.000000 
1 1 1 -2  0  17 o 149.8782 4.141136 274.3734       15.09885 274.3734       15.09885 274.3734       15.09885 149.8782 4.141136 149.8782 4.141136 0.000000       0.000000 
1 1 1 -2  0  18 o 569.1110 11.70745 3955.907       162.2110 3955.907       162.2110 3955.907       162.2110 569.1110 11.70745 569.1110 11.70745 -0.000000      0.000000 
1 1 1 -2  0  19 o 113.0102 3.853582 156.1734       10.58451 156.1734       10.58451 156.1734       10.58451 113.0102 3.853582 113.0102 3.853582 -0.000000      0.000000 
1 1 1 -2  0  20 o 49.23055 4.772329 30.36069       5.593564 30.36069       5.593564 30.36069       5.593564 49.23055 4.772329 49.23055 4.772329 -0.000000      0.000000 
1 1 1 -2  0  21 o 298.6355 9.333011 1090.824       67.76992 1090.824       67.76992 1090.824       67.76992 298.6355 9.333011 298.6355 9.333011 -0.000000      0.000000 
1 1 1 -2  0  22 o 47.59201 5.085919 28.53907       5.728826 28.53907       5.728826 28.53907       5.728826 47.59201 5.085919 47.59201 5.085919 -0.000000      0.000000 
1 1 1 -2  0  23 o 343.9778 7.474544 1444.901       62.58757 1444.901       62.58757 1444.901       62.58757 343.9778 7.474544 343.9778 7.474544 -0.000000      0.000000 
1 1 1 -2  0  24 o 222.1393 7.571230 603.9922       40.87724 603.9922       40.87724 603.9922       40.87724 222.1393 7.571230 222.1393 7.571230 -0.000000      0.000000 
1 1 1 -2  0  25 o 535.4987 11.13764 3509.334       145.1989 3509.334       145.1989 3509.334       145.1989 535.4987 11.13764 535.4987 11.13764 -0.000000      0.000000 
1 1 1 -2  0  26 o 51.12893 8.385358 34.37350       9.604292 34.37350       9.604292 34.37350       9.604292 51.12893 8.385358 51.12893 8.385358 -0.000000      0.000000 
1 1 1 -2  0  27 o 165.6490 4.624309 335.4167       18.63398 335.4167       18.63398 335.4167       18.63398 165.6490 4.624309 165.6490 4.624309 -0.000000      0.000000 
1 1 1 -2  0  28 o 67.55500 4.477393 56.39341       7.295484 56.39341       7.295484 56.39341       7.295484 67.55500 4.477393 67.55500 4.477393 -0.000000      0.000000 
1 1 1 -2  0  29 o 78.16471 4.247588 75.18571       8.035794 75.18571       8.035794 75.18571       8.035794 78.16471 4.247588 78.16471 4.247588 -0.000000      0.000000 
1 1 1 -2  0  30 o 127.7459 4.318270 199.7891       13.40804 199.7891       13.40804 199.7891       13.40804 127.7459 4.318270 127.7459 4.318270 -0.000000      0.000000 
1 1 1 -2  0  31 o 8.572921 6.002225 -4.847561      4.691493 -4.847561      4.691493 -4.847561      4.691493 8.572921 6.002225 8.572921 6.002225 -0.000000      0.000000 
1 1 1 -2  0  32 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -2  0  33 o 71.23164 4.701562 62.77727       8.078391 62.77727       8.078391 62.77727       8.078391 71.23164 4.701562 71.23164 4.701562 -0.000000      0.000000 
1 1 1 -2  0  34 o 117.5845 4.447923 169.6067       12.70364 169.6067       12.70364 169.6067       12.70364 117.5845 4.447923 117.5845 4.447923 -0.000000      0.000000 
1 1 1 -2  0  35 o 108.1813 4.448029 143.7230       11.68100 143.7230       11.68100 143.7230       11.68100 108.1813 4.448029 108.1813 4.448029 -0.000000      0.000000 
1 1 1 -2  0  36 o 65.12207 5.131401 52.84793       8.023654 52.84793       8.023654 52.84793       8.023654 65.12207 5.131401 65.12207 5.131401 -0.000000      0.000000 
1 1 1 -2  0  37 o 65.70108 8.343400 55.73783       12.77164 55.73783       12.77164 55.73783       12.77164 65.70108 8.343400 65.70108 8.343400 -0.000000      0.000000 
1 1 1 -2  0  38 o 20.32480 10.16737 7.574351       6.150702 7.574351       6.150702 7.574351       6.150702 20.32480 10.16737 20.32480 10.16737 -0.000000      0.000000 
1 1 1 -2  0  39 o 11.42912 7.628600 -1.801374      5.804813 -1.801374      5.804813 -1.801374      5.804813 11.42912 7.628600 11.42912 7.628600 -0.000000      0.000000 
1 1 1 -2  0  40 o 39.92168 7.826027 21.84744       6.778178 21.84744       6.778178 21.84744       6.778178 39.92168 7.826027 39.92168 7.826027 0.000000       0.000000 
1 1 1 -2  0  41 o 152.0378 4.843401 285.5681       17.90349 285.5681       17.90349 285.5681       17.90349 152.0378 4.843401 152.0378 4.843401 -0.000000      0.000000 
1 1 1 -2  0  42 o 27.88304 11.64380 14.14618       7.915168 14.14618       7.915168 14.14618       7.915168 27.88304 11.64380 27.88304 11.64380 -0.000000      0.000000 
1 1 1 -2  0  43 o 18.01858 9.418231 6.239303       5.420763 6.239303       5.420763 6.239303       5.420763 18.01858 9.418231 18.01858 9.418231 -0.000000      0.000000 
1 1 1 -2  0  44 o 13.61392 8.354425 2.437255       5.335543 2.437255       5.335543 2.437255       5.335543 13.61392 8.354425 13.61392 8.354425 0.000000       0.000000 
1 1 1 -2  0  45 o 7.191945 5.202731 -8.706841      4.798067 -8.706841      4.798067 -8.706841      4.798067 7.191945 5.202731 7.191945 5.202731 -0.000000      0.000000 
1 1 1 -2  0  46 o 13.40649 9.086986 -1.509851      8.849251 -1.509851      8.849251 -1.509851      8.849251 13.40649 9.086986 13.40649 9.086986 -0.000000      0.000000 
1 1 1 -2  0  47 o 48.14511 6.348509 32.35453       7.088487 32.35453       7.088487 32.35453       7.088487 48.14511 6.348509 48.14511 6.348509 -0.000000      0.000000 
1 1 1 -2  0  48 o 19.55098 9.790535 8.974930       5.706166 8.974930       5.706166 8.974930       5.706166 19.55098 9.790535 19.55098 9.790535 0.000000       0.000000 
1 1 1 -2  0  49 o 12.47894 7.877413 2.838287       5.095719 2.838287       5.095719 2.838287       5.095719 12.47894 7.877413 12.47894 7.877413 -0.000000      0.000000 
1 1 1 -2  0  50 o 12.41574 7.951520 3.118679       5.417798 3.118679       5.417798 3.118679       5.417798 12.41574 7.951520 12.41574 7.951520 -0.000000      0.000000 
1 1 1 -2  0  51 o 15.72311 9.560379 8.183529       6.845604 8.183529       6.845604 8.183529       6.845604 15.72311 9.560379 15.72311 9.560379 -0.000000      0.000000 
1 1 1 -2  1  1  o 241.1124 4.355842 708.5712       25.59338 723.4863       31.71927 680.7444       43.32524 243.6172 5.342926 236.1356 7.538768 7.481674       9.240123 
1 1 1 -2  1  2  o 724.4373 11.98064 6409.921       211.5032 7052.587       391.3603 6144.783       251.3740 757.6536 21.21768 708.8915 14.55139 48.76208       25.72805 
1 1 1 -2  1  3  o 121.4410 2.370336 179.7123       7.014735 169.9473       9.718203 190.3342       10.13563 118.0414 3.381921 124.9282 3.332283 -6.886826      4.747789 
1 1 1 -2  1  4  o 65.18768 1.914159 51.82485       3.037449 57.22803       4.386825 46.84885       4.209843 68.47865 2.633718 61.94069 2.796244 6.537968       3.841283 
1 1 1 -2  1  5  o 317.2309 4.777132 1226.659       36.92996 1182.486       51.06242 1275.104       53.47474 311.4079 6.728770 323.3714 6.785955 -11.96353      9.556439 
1 1 1 -2  1  6  o 527.9965 7.640160 3400.127       98.30364 3324.947       136.9751 3479.976       141.1642 521.8735 10.77061 533.8937 10.85010 -12.02014      15.28825 
1 1 1 -2  1  7  o 430.2545 6.305155 2257.088       66.10851 2283.237       94.18853 2231.700       92.80981 432.5934 8.934743 427.6852 8.904993 4.908203       12.61462 
1 1 1 -2  1  8  o 280.8594 4.983657 961.5706       34.10933 959.6060       58.83131 962.5655       41.86367 280.3135 8.622737 280.9724 6.114170 -0.6589661     10.57046 
1 1 1 -2  1  9  o 962.4297 15.88774 11344.36       372.6208 11677.09       465.4996 10750.88       621.6915 975.1402 19.58918 931.8182 27.40816 43.32202       33.68892 
1 1 1 -2  1  10 o 306.9618 4.677650 1148.688       34.99033 1116.865       48.63561 1182.831       50.37799 302.6018 6.595486 311.4079 6.638579 -8.806091      9.357946 
1 1 1 -2  1  11 o 619.3954 8.935153 4685.410       134.8671 4510.720       185.8134 4879.899       196.0608 607.0544 12.56068 631.3659 12.74305 -24.31152      17.89291 
1 1 1 -2  1  12 o 249.6466 3.963635 759.7824       24.11323 778.4453       34.58672 742.1318       33.63568 252.6261 5.618172 246.6644 5.595741 5.961685       7.929450 
1 1 1 -2  1  13 o 132.1392 3.062107 212.8201       9.860254 205.9115       16.57785 216.6021       12.26575 129.8294 5.250685 133.2431 3.781403 -3.413635      6.470603 
1 1 1 -2  1  14 o 578.5336 11.88579 4096.555       167.5686 4086.125       236.7270 4107.029       237.2295 576.2432 16.87617 577.7191 16.86868 -1.475891      23.86122 
1 1 1 -2  1  15 o 282.5719 4.406723 973.3879       30.34455 938.5996       41.97512 1011.471       43.91814 277.4066 6.209249 287.9718 6.258322 -10.56519      8.815971 
1 1 1 -2  1  16 o 202.3134 3.448139 498.8436       16.99987 494.9933       23.96127 502.7460       24.12243 201.5058 4.879623 203.0778 4.874414 -1.572006      6.897147 
1 1 1 -2  1  17 o 209.8783 3.551427 536.8318       18.16379 534.4991       25.63732 539.1828       25.73793 209.3983 5.024159 210.3138 5.021920 -0.9154968     7.103651 
1 1 1 -2  1  18 o 827.2722 11.85081 8358.354       238.9090 8456.768       340.7652 8263.216       335.0441 831.1409 16.82459 821.5953 16.73431 9.545654       23.72981 
1 1 1 -2  1  19 o 279.9009 4.417472 954.9086       30.13104 963.8106       42.82254 946.1799       42.40401 281.1548 6.250156 278.5715 6.246462 2.583313       8.836444 
1 1 1 -2  1  20 o 71.49134 2.861176 62.38428       4.974576 63.02797       7.007718 61.73043       7.062831 71.79887 4.021256 71.04892 4.096667 0.7499466      5.740486 
1 1 1 -2  1  21 o 635.1857 12.99675 4933.550       201.1739 4873.833       281.9223 4995.506       287.1554 629.9442 18.38469 637.7344 18.49695 -7.790222      26.07938 
1 1 1 -2  1  22 o 536.3030 7.835205 3509.808       102.3992 3515.411       144.9486 3504.225       144.6805 536.3243 11.09048 535.4708 11.08762 0.8535156      15.68228 
1 1 1 -2  1  23 o 538.5870 7.875535 3540.934       103.3647 3582.814       147.2916 3500.295       145.0926 541.2597 11.16699 534.9970 11.12904 6.262695       15.76570 
1 1 1 -2  1  24 o 218.2514 3.759830 580.7023       19.99684 560.2108       27.71580 602.9510       28.87971 214.3090 5.307022 222.3329 5.330318 -8.023880      7.521753 
1 1 1 -2  1  25 o 213.1799 5.235072 554.4944       27.19600 583.3646       38.97392 527.0956       37.96773 218.3925 7.333590 207.5596 7.518890 10.83290       10.50311 
1 1 1 -2  1  26 o 123.4687 3.483542 186.0414       10.47079 173.9531       17.96371 192.2620       12.88628 119.1742 6.206930 125.4717 4.220503 -6.297440      7.505906 
1 1 1 -2  1  27 o 214.5186 3.743569 561.3711       19.56982 566.4185       27.81540 556.4237       27.53849 215.3529 5.300276 213.4450 5.294415 1.907913       7.491579 
1 1 1 -2  1  28 o 159.7730 3.219097 311.3818       12.53354 316.5172       17.82735 306.3626       17.62458 160.9325 4.550332 158.3255 4.572853 2.607040       6.451085 
1 1 1 -2  1  29 o 70.70483 3.090961 61.10279       5.312857 68.12879       7.630267 54.49095       7.401963 74.57291 4.215946 66.62817 4.586813 7.944740       6.230012 
1 1 1 -2  1  30 o 171.8015 3.357433 360.2283       14.05628 362.5244       19.93320 357.9572       19.82440 172.1401 4.756369 171.0509 4.760596 1.089203       6.729511 
1 1 1 -2  1  31 f 225.0113 4.563816 619.0712       25.02468 595.9294       43.09954 630.8408       30.73640 219.8078 8.059895 226.9480 5.557641 -7.140213      9.790264 
1 1 1 -2  1  32 o 26.61779 6.466209 9.049153       4.152237 11.38898       6.439358 7.383835       5.432498 29.96198 8.453716 24.76100 7.946436 5.200979       11.60221 
1 1 1 -2  1  33 o 162.6950 4.765072 324.4325       18.87173 324.4325       18.87173 0.000000       0.000000 162.6950 4.765072 ?        ?        0.000000       4.765072 
1 1 1 -2  1  34 o 19.43415 6.665192 4.257959       3.806299 4.785252       5.404860 3.739141       5.361245 21.68554 7.894533 20.52772 7.786635 1.157816       11.08852 
1 1 1 -2  1  35 o 19.14009 6.669665 4.046155       3.817503 -0.2401472     5.314934 8.613963       5.486690 16.84989 7.227496 26.23587 7.920000 -9.385973      10.72208 
1 1 1 -2  1  36 o 96.65276 3.730305 114.5178       8.769577 116.8104       10.55184 109.3978       15.76891 97.49226 4.453180 93.76082 6.950948 3.731438       8.255089 
1 1 1 -2  1  37 o 105.8784 3.788981 137.5277       9.760341 142.6073       18.10981 135.4482       11.58723 106.9573 6.986362 104.9174 4.542830 2.039856       8.333460 
1 1 1 -2  1  38 o 69.38152 3.564052 59.14462       6.005734 58.01249       8.307053 60.38436       8.692859 68.43397 5.016105 69.79629 5.147070 -1.362320      7.187047 
1 1 1 -2  1  39 o 65.97328 3.643495 53.58896       5.834889 53.45280       8.062819 53.73867       8.454679 65.56866 5.085821 65.68129 5.327964 -0.1126251     7.365649 
1 1 1 -2  1  40 o 43.37571 4.530551 23.50090       4.718345 18.85078       6.510978 28.64370       6.847208 38.04254 7.288539 47.51717 6.050282 -9.474628      9.472524 
1 1 1 -2  1  41 o 93.90405 3.214181 108.6032       7.344296 103.3829       10.27858 114.0484       10.49769 91.08700 4.645982 95.74042 4.512177 -4.653419      6.476488 
1 1 1 -2  1  42 o 104.3924 3.632373 135.1248       9.226418 116.5334       14.47770 147.8390       11.97259 95.31075 6.268144 108.6808 4.530568 -13.37004      7.734059 
1 1 1 -2  1  43 o 38.08503 5.606662 18.92372       5.047944 20.96192       6.395435 15.55553       8.221375 39.49757 6.895248 32.73580 9.650436 6.761765       11.86066 
1 1 1 -2  1  44 o 14.90671 6.205493 1.163376       3.730169 4.183361       5.276075 -1.854736      5.274438 19.73361 7.662882 14.88581 6.745049 4.847802       10.20860 
1 1 1 -2  1  45 f 30.12205 5.703584 12.41315       4.033413 16.99296       5.704818 7.835632       5.703398 34.47424 7.029233 23.32710 8.150758 11.14714       10.76313 
1 1 1 -2  1  46 o 44.09404 5.459792 26.71423       5.741448 24.98156       6.808339 30.98006       10.68279 41.17437 7.038109 41.47266 10.54760 -0.2982979     12.68018 
1 1 1 -2  1  47 o 14.01708 6.057870 1.010874       3.788273 5.227243       5.332712 -3.284575      5.382489 19.11115 7.616699 13.30491 6.290656 5.806234       9.878586 
1 1 1 -2  1  48 o 24.69485 6.523659 9.776525       3.983821 7.335174       5.432390 12.61715       5.859804 20.49101 7.822537 26.04618 8.241275 -5.555166      11.36269 
1 1 1 -2  1  49 o 14.13101 6.052053 1.981229       3.716264 4.723648       5.203391 -0.8740647     5.309394 17.29276 7.272835 13.65194 6.389552 3.640814       9.680935 
1 1 1 -2  1  50 o 13.75643 5.976273 2.080718       3.726023 3.232655       5.274284 0.9330438      5.264513 15.42578 6.887009 14.02114 6.494491 1.404642       9.466219 
1 1 1 -2  1  51 o 18.03957 7.196350 7.279274       4.764763 5.778272       6.613956 8.898800       6.870128 16.33997 7.461798 18.06419 7.973293 -1.724218      10.92025 
1 1 1 -2  2  1  o 134.3692 2.528247 220.0149       8.278567 220.1695       11.68102 219.8588       11.73449 134.3618 3.570705 134.2663 3.589640 0.9558105E-01  5.063146 
1 1 1 -2  2  2  o 376.1354 5.559361 1724.725       50.95715 1665.106       70.47032 1790.060       73.77156 369.4833 7.826640 383.0922 7.902228 -13.60895      11.12212 
1 1 1 -2  2  3  o 136.8642 2.552560 228.2619       8.513379 223.6488       11.94711 233.0208       12.13455 135.4182 3.623600 138.2291 3.605446 -2.810852      5.111723 
1 1 1 -2  2  4  o 456.9091 6.661154 2545.594       74.16779 2580.901       105.8493 2511.541       103.9545 459.8938 9.444839 453.6749 9.402914 6.218842       13.32741 
1 1 1 -2  2  5  o 183.0129 3.082924 408.1679       13.74930 403.9790       19.35630 412.4340       19.53381 182.0568 4.362941 183.9521 4.357587 -1.895370      6.166346 
1 1 1 -2  2  6  o 239.1392 3.776207 696.9664       22.00608 694.6794       31.05091 699.2741       31.19215 238.7179 5.337690 239.5059 5.344326 -0.7880096     7.553328 
1 1 1 -2  2  7  o 768.2755 10.99469 7206.739       205.8429 7051.989       287.0228 7370.620       295.3683 759.2048 15.51392 776.1457 15.61653 -16.94092      22.01267 
1 1 1 -2  2  8  o 977.3762 16.11141 11695.96       383.7351 11387.51       652.0978 11859.35       474.6115 959.3763 27.92222 982.9619 19.81370 -23.58563      34.23789 
1 1 1 -2  2  9  o 401.2310 6.849021 1963.470       66.96673 1968.242       82.12743 1954.001       115.6797 401.6189 8.391468 399.6900 11.88998 1.928955       14.55295 
1 1 1 -2  2  10 o 514.8127 7.482234 3233.752       93.86781 3345.713       135.8452 3131.447       129.8556 523.2767 10.65312 506.2605 10.52569 17.01620       14.97595 
1 1 1 -2  2  11 o 352.7920 5.289857 1517.786       45.47773 1500.787       63.86693 1535.270       64.77309 350.6635 7.473937 354.6674 7.494406 -4.003998      10.58423 
1 1 1 -2  2  12 o 232.3810 3.751111 658.2910       21.24206 657.2214       30.04969 659.3594       30.03194 232.1356 5.312049 232.5134 5.300287 -0.3777618     7.504060 
1 1 1 -2  2  13 o 355.3780 6.161262 1540.854       53.35760 1534.932       65.20907 1552.853       92.81898 354.5771 7.546771 356.1249 10.70759 -1.547760      13.09986 
1 1 1 -2  2  14 o 294.7595 5.271771 1059.542       37.86696 1073.397       66.44263 1052.877       46.08366 296.2747 9.213920 293.7685 6.437329 2.506226       11.23991 
1 1 1 -2  2  15 o 81.28553 2.404439 80.58911       4.757573 84.99393       6.794969 76.35320       6.663409 83.44102 3.348534 79.07286 3.466487 4.368164       4.819669 
1 1 1 -2  2  16 f 408.0457 6.060616 2030.260       60.26451 2025.932       85.11108 2034.611       85.34319 407.4568 8.571729 408.3282 8.576763 -0.8713989     12.12582 
1 1 1 -2  2  17 o 589.6833 8.539645 4242.270       122.7142 4262.653       174.1027 4222.147       172.9908 590.7194 12.09450 587.9085 12.07473 2.810913       17.09023 
1 1 1 -2  2  18 o 385.0082 5.768120 1807.123       54.11784 1749.809       74.97333 1869.471       78.19675 378.7502 8.123026 391.4826 8.196720 -12.73245      11.53992 
1 1 1 -2  2  19 o 338.2283 5.161225 1394.531       42.54013 1390.385       60.01735 1398.717       60.30533 337.6468 7.294208 338.6564 7.307357 -1.009583      10.32487 
1 1 1 -2  2  20 o 503.3015 8.504936 3090.750       104.3123 3124.542       181.3420 3074.041       127.5218 505.1322 14.74764 501.7643 10.42914 3.367828       18.06266 
1 1 1 -2  2  21 o 279.4597 5.122511 952.1133       34.88496 960.8928       42.94151 935.0734       59.82428 280.7057 6.277548 276.6497 8.885353 4.055908       10.87921 
1 1 1 -2  2  22 o 285.8178 5.226950 996.0500       36.40607 990.3420       44.44487 1007.690       63.46836 284.9491 6.400563 287.1427 9.081758 -2.193573      11.11060 
1 1 1 -2  2  23 o 336.1836 5.174089 1378.197       42.38836 1436.676       61.48972 1325.243       58.51334 343.1001 7.354371 329.5305 7.286571 13.56961       10.35282 
1 1 1 -2  2  24 o 270.7360 4.368236 893.7573       28.81962 928.9656       41.67187 861.4792       39.90004 275.9138 6.197743 265.7050 6.162225 10.20880       8.739854 
1 1 1 -2  2  25 o 251.4932 4.788065 771.5613       29.34421 768.6076       35.79765 777.6115       51.23316 250.9382 5.853985 252.0374 8.353156 -1.099106      10.20021 
1 1 1 -2  2  26 o 288.9114 6.521294 1019.920       45.91288 0.000000       0.000000 1019.920       45.91288 ?        ?        288.9114 6.521294 0.000000       6.521294 
1 1 1 -2  2  27 o 233.3287 3.958278 664.2427       22.50664 678.9112       32.19541 650.2231       31.47519 235.7318 5.604537 230.6982 5.598712 5.033646       7.921894 
1 1 1 -2  2  28 o 63.29143 3.230032 48.99036       4.965343 45.22506       6.828501 53.21504       7.233060 60.67582 4.653730 65.85868 4.534526 -5.182861      6.497625 
1 1 1 -2  2  29 f 129.7440 3.027961 205.3501       9.573565 222.3977       13.91517 190.0286       13.19190 134.8795 4.238830 124.6563 4.349333 10.22315       6.073251 
1 1 1 -2  2  30 o 161.6498 3.846313 319.0845       15.15151 332.0023       27.37421 313.3792       18.19232 164.3609 6.849515 160.0480 4.669456 4.312866       8.289734 
1 1 1 -2  2  31 o 186.1956 3.510879 423.3084       15.93021 444.8427       23.08098 403.7184       22.01429 190.6079 4.973344 181.5763 4.979887 9.031525       7.037999 
1 1 1 -2  2  32 o 171.8938 3.874345 361.0846       16.22911 369.2111       27.44300 356.7141       20.12547 173.2328 6.512374 170.6410 4.844696 2.591797       8.116778 
1 1 1 -2  2  33 o 66.45276 3.789676 54.15403       6.111487 56.61184       7.480511 49.22062       10.59817 67.85481 4.550218 62.82803 7.043262 5.026787       8.385226 
1 1 1 -2  2  34 o 96.41036 3.611124 113.7905       8.469034 114.4584       10.15649 112.2663       15.34289 96.59462 4.325714 95.22557 6.653627 1.369049       7.936155 
1 1 1 -2  2  35 o 69.80354 3.350445 59.69872       5.682587 54.98323       7.796775 65.04196       8.299551 66.77966 4.823600 72.67850 4.711501 -5.898842      6.742801 
1 1 1 -2  2  36 o 185.3657 4.194232 421.1224       18.94601 412.0109       22.72759 441.8758       34.30077 183.0246 5.100721 188.5418 7.480367 -5.517212      9.053907 
1 1 1 -2  2  37 f 22.68556 7.791592 5.905555       5.202039 10.54450       10.20664 4.277642       6.046290 30.56838 10.88402 21.73679 8.263577 8.831594       13.66560 
1 1 1 -2  2  38 o 84.22003 3.313288 86.99136       6.786761 88.32533       9.576709 85.64551       9.619291 84.59607 4.663517 83.27676 4.759878 1.319313       6.663695 
1 1 1 -2  2  39 o 53.51124 3.963714 35.38921       5.132027 34.53122       7.146358 36.30288       7.374587 52.46653 5.679881 53.80140 5.711993 -1.334869      8.055304 
1 1 1 -2  2  40 o 121.1021 3.246147 180.1794       9.571147 181.1283       13.38076 179.1853       13.69604 120.9425 4.548207 120.2331 4.683453 0.7094116      6.528470 
1 1 1 -2  2  41 o 94.61568 3.255394 110.2979       7.494719 104.5334       10.23593 116.9598       11.00396 91.60197 4.600221 96.87133 4.675217 -5.269363      6.558939 
1 1 1 -2  2  42 o 109.9843 3.657468 150.0371       9.789100 159.4119       16.07280 144.5091       12.34231 111.7966 5.920768 107.3015 4.731773 4.495178       7.579259 
1 1 1 -2  2  43 o 28.75989 6.800767 11.24639       4.690873 9.333808       5.780772 14.93384       8.026733 26.07467 8.176831 32.11230 9.553114 -6.037632      12.57468 
1 1 1 -2  2  44 o 36.87271 4.878202 17.69909       4.275867 15.45041       5.831018 20.31478       6.288887 33.09987 7.413622 38.35871 6.985071 -5.258839      10.18592 
1 1 1 -2  2  45 o 17.60079 6.686087 3.584012       3.956329 0.5631491      5.199569 7.737948       6.097218 16.13073 7.033061 23.26366 8.396767 -7.132925      10.95306 
1 1 1 -2  2  46 o 18.86892 6.526528 4.981633       3.652184 2.111874       4.762073 9.080422       5.691164 16.47899 6.945621 23.97515 8.151777 -7.496162      10.70949 
1 1 1 -2  2  47 o 31.02050 7.106965 15.17355       5.256878 21.33529       9.769367 12.66228       6.236788 31.41247 10.68034 26.67996 8.509404 4.732513       13.65576 
1 1 1 -2  2  48 o 14.07839 6.009759 1.605471       3.642802 1.879755       5.164207 1.333828       5.139285 15.68217 6.917759 15.28207 6.812191 0.4001017      9.708827 
1 1 1 -2  2  49 o 19.96444 6.826907 7.019197       3.992536 6.828618       5.564367 7.221430       5.731959 19.08037 7.719116 19.39306 7.838498 -0.3126984     11.00122 
1 1 1 -2  2  50 o 13.32189 6.009742 1.168333       4.132784 6.574615       6.655573 -2.224387      5.272421 17.69920 7.828366 12.47359 5.987791 5.225614       9.855808 
1 1 1 -2  2  51 o 14.97744 6.188760 3.888479       3.671695 10.74365       5.150463 -3.195495      5.235710 21.23590 7.710077 11.65605 5.682661 9.579857       9.577991 
1 1 1 -2  3  1  o 104.8325 2.021658 133.9144       5.164635 134.6456       6.693003 132.8384       8.119841 105.1158 2.612864 104.3561 3.196729 0.7596893      4.128697 
1 1 1 -2  3  2  o 248.6730 3.892649 753.6574       23.58903 740.5906       33.03109 767.2578       33.69878 246.4767 5.499343 250.8747 5.512152 -4.398010      7.786308 
1 1 1 -2  3  3  o 361.0515 5.366734 1589.111       47.21884 1605.941       67.25191 1572.748       66.31303 362.8700 7.605319 359.1016 7.577840 3.768402       10.73613 
1 1 1 -2  3  4  o 516.4388 7.484270 3252.761       94.18991 3364.679       136.2757 3150.391       130.3323 524.9953 10.65189 508.0137 10.52787 16.98163       14.97661 
1 1 1 -2  3  5  o 299.2704 4.552236 1091.653       33.19897 1092.660       46.99292 1090.651       46.90806 299.3560 6.441817 299.0808 6.436100 0.2751770      9.106064 
1 1 1 -2  3  6  o 316.9406 4.787982 1224.418       36.97997 1282.248       53.83262 1172.743       50.88676 324.2749 6.812337 310.1221 6.733425 14.15283       9.578463 
1 1 1 -2  3  7  o 704.8737 10.10996 6064.823       173.6588 5832.306       238.9583 6325.074       252.8077 690.6202 14.19864 719.1624 14.42538 -28.54218      20.24088 
1 1 1 -2  3  8  o 642.8282 13.09165 5051.806       205.0811 5118.313       292.2245 4987.261       287.8811 645.6906 18.59125 637.3733 18.55435 8.317261       26.26592 
1 1 1 -2  3  9  o 698.7334 11.59991 5966.578       197.5160 6143.284       246.6925 5650.998       329.6750 708.4586 14.28911 677.7332 19.98323 30.72540       24.56641 
1 1 1 -2  3  10 o 264.1174 4.129453 850.3436       26.57820 862.2496       37.91098 838.8358       37.27168 265.9001 5.850737 262.2658 5.831780 3.634277       8.260798 
1 1 1 -2  3  11 o 362.2835 5.418743 1600.722       47.83912 1545.597       66.14752 1661.173       69.26991 355.8249 7.628534 368.8820 7.705858 -13.05710      10.84319 
1 1 1 -2  3  12 o 411.8024 6.089959 2068.958       61.11380 2102.571       87.36260 2036.747       85.52271 414.8593 8.641489 408.3196 8.594985 6.539764       12.18807 
1 1 1 -2  3  13 o 267.8711 4.847198 875.0005       31.64118 857.0915       38.36722 913.0778       55.94461 265.0619 5.939870 273.2874 8.410460 -8.225494      10.29650 
1 1 1 -2  3  14 o 488.3149 8.256830 2911.357       98.25381 2874.170       169.0412 2930.330       120.7449 483.9789 14.34861 489.6521 10.11917 -5.673248      17.55791 
1 1 1 -2  3  15 o 118.9280 2.604118 172.3637       7.547110 166.5304       10.52138 178.5462       10.83184 116.8299 3.700247 120.9763 3.678499 -4.146423      5.217584 
1 1 1 -2  3  16 o 445.7130 6.568348 2422.628       71.34237 2478.732       102.4308 2369.770       99.42309 450.6493 9.327297 440.6385 9.259098 10.01080       13.14265 
1 1 1 -2  3  17 o 204.5127 3.490380 509.7271       17.39518 513.2173       24.65742 506.2689       24.54399 205.1902 4.931225 203.7962 4.942115 1.393951       6.981510 
1 1 1 -2  3  18 o 793.9883 11.38434 7697.958       220.2713 7737.598       312.6442 7658.889       310.3894 795.1622 16.13461 791.1149 16.10020 4.047302       22.79347 
1 1 1 -2  3  19 o 272.1994 4.326854 903.0756       28.70090 886.6493       40.17304 920.2006       41.01859 269.6681 6.113206 274.7225 6.127034 -5.054413      8.655162 
1 1 1 -2  3  20 o 214.6781 5.107870 561.8261       26.72167 563.4325       37.27896 560.1285       38.32296 214.8151 7.131243 214.1695 7.353773 0.6456451      10.24366 
1 1 1 -2  3  21 o 128.2044 2.891470 200.3048       9.033537 202.5979       12.75474 197.9969       12.79606 128.8606 4.066865 127.3848 4.127585 1.475723       5.794510 
1 1 1 -2  3  22 o 431.6140 7.420581 2273.049       78.04939 2229.348       94.38314 2367.569       138.8070 427.2969 9.064181 439.6726 12.96943 -12.37567      15.82294 
1 1 1 -2  3  23 o 72.49970 3.016524 64.17298       5.317767 67.12768       7.363848 60.95285       7.687506 74.09236 4.094370 70.56352 4.493987 3.528839       6.079456 
1 1 1 -2  3  24 o 552.1773 8.070200 3724.771       108.5923 3719.949       153.4117 3729.614       153.7342 551.0975 11.42336 551.8106 11.43258 -0.7130737     16.16159 
1 1 1 -2  3  25 o 187.4920 3.979957 428.6837       18.18432 442.6622       22.59572 402.9897       30.63454 190.4223 4.873370 181.4992 6.939070 8.923065       8.479412 
1 1 1 -2  3  26 o 354.9303 5.443028 1538.071       47.07819 1511.503       65.83555 1565.875       67.34742 351.4963 7.686057 357.7551 7.725009 -6.258820      10.89730 
1 1 1 -2  3  27 o 195.6055 5.037681 467.5492       23.99310 0.000000       0.000000 467.5492       23.99310 ?        ?        195.6055 5.037681 0.000000       5.037681 
1 1 1 -2  3  28 o 217.9157 3.792176 579.5257       20.13785 584.7030       28.54576 574.3964       28.41315 218.7145 5.355845 216.7753 5.378651 1.939148       7.590452 
1 1 1 -2  3  29 f 67.32139 3.881114 55.51366       6.340170 61.71277       12.30746 53.27428       7.397227 70.56003 7.261242 65.86900 4.638067 4.691032       8.616107 
1 1 1 -2  3  30 o 188.3013 3.518282 432.8296       16.14433 441.7088       23.01523 424.2283       22.65216 189.9829 4.975523 186.1795 4.997291 3.803375       7.051861 
1 1 1 -2  3  31 o 228.3386 4.509704 637.5167       25.09363 648.5534       42.90848 631.7800       30.93530 229.4168 7.685913 227.0953 5.589976 2.321442       9.503741 
1 1 1 -2  3  32 o 63.93609 3.338614 50.05341       5.183715 39.25182       6.985500 63.29086       7.733140 56.37988 5.140863 71.79575 4.441737 -15.41587      6.793931 
1 1 1 -2  3  33 o 95.07568 3.505264 110.5972       8.107409 112.9321       9.926082 105.9176       14.05215 95.98236 4.254326 92.61645 6.262969 3.365913       7.571266 
1 1 1 -2  3  34 o 117.5662 3.095917 168.9465       8.861960 164.0411       12.30729 174.2285       12.77097 115.6623 4.374395 119.1995 4.404138 -3.537201      6.207396 
1 1 1 -2  3  35 o 69.96289 3.911361 60.09301       6.642006 58.31551       7.955381 64.18320       12.06781 68.78901 4.775407 71.74027 6.991465 -2.951263      8.466705 
1 1 1 -2  3  36 o 116.2065 3.862854 165.5464       10.92372 176.1900       20.12823 161.1028       13.00564 119.0858 6.966431 114.4728 4.672040 4.612953       8.388034 
1 1 1 -2  3  37 o 113.8703 3.847846 159.1006       10.66203 175.1155       19.95575 152.7027       12.61323 118.5588 6.937453 111.3729 4.657685 7.185875       8.355973 
1 1 1 -2  3  38 o 170.0620 3.509698 354.4030       14.54498 344.7371       20.23619 364.7336       20.92030 167.1775 4.972762 171.9512 4.997901 -4.773666      7.050346 
1 1 1 -2  3  39 f 69.75262 3.480921 59.84340       5.898156 56.26720       8.169933 63.73613       8.523820 67.28819 5.018601 71.66592 4.910410 -4.377731      7.021288 
1 1 1 -2  3  40 o 79.32345 3.315352 77.41788       6.394534 78.45840       9.058601 76.38438       9.027949 79.47047 4.698528 78.39359 4.748029 1.076889       6.679816 
1 1 1 -2  3  41 f 72.04522 3.862960 64.33256       6.757259 61.49451       10.70711 66.21113       8.711161 69.41943 6.401342 72.70397 4.946245 -3.284538      8.089655 
1 1 1 -2  3  42 o 27.79843 6.245279 10.24084       4.127146 7.056399       5.569687 14.11855       6.146126 23.64398 8.063855 32.17876 7.897611 -8.534775      11.28707 
1 1 1 -2  3  43 o 25.33371 7.044728 8.761455       4.506320 9.281990       5.585345 7.790721       7.627371 25.97164 8.020617 25.03996 9.332258 0.9316730      12.30534 
1 1 1 -2  3  44 o 70.35033 3.513579 62.14977       6.004478 70.18044       8.479172 54.07179       8.504114 73.89034 4.733912 64.25278 5.483625 9.637550       7.244313 
1 1 1 -2  3  45 o 43.40143 5.136850 25.05310       5.327772 23.79029       6.111199 29.05296       10.87626 41.49488 6.236321 41.36886 10.70680 0.1260185      12.39061 
1 1 1 -2  3  46 o 30.39298 5.659244 12.97300       4.037288 15.00763       5.531820 10.65406       5.905674 31.35947 7.365046 25.65390 8.290082 5.705570       11.08916 
1 1 1 -2  3  47 o 18.64446 7.269369 5.011879       4.763260 3.894114       8.938552 5.455175       5.629101 19.59431 8.838911 19.33833 7.785029 0.2559795      11.77850 
1 1 1 -2  3  48 o 21.46997 6.683359 7.565076       3.869396 9.722672       5.417827 5.318719       5.528146 23.01796 7.949700 18.53650 7.619883 4.481461       11.01183 
1 1 1 -2  3  49 o 12.28315 5.595820 -0.1714570     3.691227 -1.046299      5.110801 0.7825044      5.336905 13.31881 6.244962 14.52245 6.658472 -1.203640      9.128789 
1 1 1 -2  3  50 o 11.39878 5.411870 -1.772077      4.063955 -2.769927      6.521341 -1.138518      5.196341 13.23533 6.427437 12.85966 6.109532 0.3756618      8.867826 
1 1 1 -2  3  51 o 13.70312 5.894824 2.651074       3.554973 2.447328       4.938396 2.870215       5.121587 14.13316 6.451625 14.45954 6.588911 -0.3263788     9.221562 
1 1 1 -2  4  1  o 907.2675 11.57506 10051.99       255.9145 9828.161       398.1165 10209.61       334.0819 895.6208 18.24105 913.6560 15.00494 -18.03516      23.61957 
1 1 1 -2  4  2  o 539.0854 6.980292 3543.856       91.69957 3799.757       151.8854 3397.077       115.0300 557.8542 11.17273 527.6652 8.945745 30.18903       14.31280 
1 1 1 -2  4  3  o 159.2308 2.840102 308.9718       11.02039 311.1074       15.66850 306.8810       15.50320 159.7184 4.028869 158.6297 4.013744 1.088745       5.686996 
1 1 1 -2  4  4  o 647.7112 9.313105 5119.185       146.9982 4955.373       203.0987 5299.410       213.0304 636.8125 13.08758 658.5204 13.27505 -21.70789      18.64167 
1 1 1 -2  4  5  o 843.1827 12.04392 8683.747       247.4717 8551.104       346.3032 8822.172       353.7720 835.7090 17.00455 848.8278 17.10282 -13.11871      24.11766 
1 1 1 -2  4  6  f 993.1932 14.16390 12061.16       342.8093 12097.55       486.1377 12025.17       483.4843 992.9416 20.09091 989.9839 20.04094 2.957703       28.37753 
1 1 1 -2  4  7  o 174.2345 3.465855 369.9749       14.71569 372.8511       25.35766 368.5145       18.06969 174.7702 5.962689 173.8801 4.264467 0.8901062      7.330712 
1 1 1 -2  4  8  o 194.5270 3.792502 461.2072       17.97802 473.0567       22.21378 438.7109       30.60764 196.9956 4.627323 189.5490 6.636556 7.446609       8.090487 
1 1 1 -2  4  9  o 613.9321 8.850663 4601.121       132.4135 4562.039       186.2130 4641.096       188.3269 610.7465 12.51160 616.0093 12.54553 -5.262878      17.71808 
1 1 1 -2  4  10 o 228.3871 3.689557 635.7968       20.53439 599.5857       28.11974 677.1691       30.05700 221.7453 5.203801 235.6544 5.234004 -13.90901      7.380673 
1 1 1 -2  4  11 o 291.0746 4.486162 1033.015       31.82111 1002.092       44.19652 1066.299       45.85284 286.5895 6.328369 295.6260 6.364841 -9.036530      8.975492 
1 1 1 -2  4  12 o 196.9314 3.831690 472.7824       18.38829 469.2499       22.56324 479.7686       31.73087 196.1679 4.719949 198.1722 6.579694 -2.004272      8.097548 
1 1 1 -2  4  13 o 331.1357 5.021162 1337.154       40.51785 1362.475       57.98322 1312.991       56.64210 334.1150 7.121479 327.9941 7.086587 6.120880       10.04665 
1 1 1 -2  4  14 o 372.0880 6.449884 1688.912       58.48354 1695.670       102.1002 1685.611       71.34823 372.2153 11.26930 371.6170 7.878644 0.5982361      13.75028 
1 1 1 -2  4  15 o 331.8698 5.047338 1342.743       40.81936 1331.523       57.44148 1354.189       58.01742 330.3850 7.134594 333.1845 7.145580 -2.799561      10.09761 
1 1 1 -2  4  16 o 545.2343 7.928962 3626.488       105.3503 3686.935       150.7198 3568.742       147.3141 549.4298 11.25698 540.5599 11.18316 8.869873       15.86766 
1 1 1 -2  4  17 o 838.4274 12.00917 8586.045       245.3661 8243.571       337.4638 8970.163       357.3934 820.5651 16.87633 855.9008 17.13511 -35.33563      24.05042 
1 1 1 -2  4  18 o 355.5627 5.380625 1541.166       46.62137 1549.001       66.12806 1533.423       65.73882 356.3787 7.614440 354.5824 7.607968 1.796295       10.76387 
1 1 1 -2  4  19 o 423.9441 8.878235 2193.000       91.72155 2195.079       129.1112 2190.883       130.3250 423.6654 12.51934 423.2436 12.64996 0.4218445      17.79762 
1 1 1 -2  4  20 o 179.8358 3.292913 394.1415       14.43087 386.8230       20.21145 401.7524       20.61109 178.0782 4.661484 181.4843 4.664293 -3.406113      6.594320 
1 1 1 -2  4  21 o 543.2692 7.923845 3601.212       104.9028 3582.108       147.7966 3620.608       148.9198 541.4456 11.20143 544.3441 11.22646 -2.898499      15.85892 
1 1 1 -2  4  22 o 530.6523 8.969421 3438.350       115.9873 3386.360       140.5201 3549.496       205.4593 526.3502 10.95538 537.7598 15.69518 -11.40961      19.14051 
1 1 1 -2  4  23 o 431.4311 6.426139 2270.978       67.56125 2307.884       96.51839 2235.523       94.60249 434.6273 9.112906 427.7642 9.075320 6.863129       12.86105 
1 1 1 -2  4  24 o 204.3524 4.150036 509.1918       20.66654 508.1602       25.31070 511.2554       35.79704 204.1080 5.088714 204.4915 7.194703 -0.3835297     8.812420 
1 1 1 -2  4  25 o 167.7967 3.260304 343.2648       13.33146 338.0562       18.67626 348.6761       19.03594 166.4061 4.610024 169.0004 4.626571 -2.594376      6.531270 
1 1 1 -2  4  26 o 102.5041 2.924930 128.2056       7.298746 126.9787       10.20988 129.4879       10.43787 101.9403 4.118447 102.9407 4.169543 -1.000328      5.860605 
1 1 1 -2  4  27 o 147.1315 3.689443 264.2606       13.21783 259.7592       23.73582 266.2840       15.91363 145.5566 6.709747 147.6333 4.428329 -2.076782      8.039329 
1 1 1 -2  4  28 o 42.18805 6.035972 22.21218       6.028816 0.000000       0.000000 22.21218       6.028816 ?        ?        42.18805 6.035972 0.000000       6.035972 
1 1 1 -2  4  29 o 126.4452 3.007502 195.0456       9.267110 196.2107       13.05790 193.8632       13.15397 126.6767 4.235959 125.9098 4.293359 0.7669678      6.031275 
1 1 1 -2  4  30 o 67.79647 3.154469 56.20991       5.197295 66.02175       7.440561 46.86121       7.262831 73.39523 4.177330 61.71497 4.868654 11.68026       6.415128 
1 1 1 -2  4  31 o 87.45823 3.363824 93.52165       7.155824 88.87853       11.10194 96.82163       9.359439 85.02206 5.386036 88.89030 4.333813 -3.868240      6.913127 
1 1 1 -2  4  32 o 75.65427 3.122294 69.99402       5.743929 63.03403       7.868608 77.93355       8.404092 71.63615 4.530646 79.70741 4.343101 -8.071251      6.276088 
1 1 1 -2  4  33 o 26.26966 6.729461 8.818596       4.326730 10.64678       5.126361 4.290901       8.067471 28.83083 7.292598 24.02356 9.432870 4.807276       11.92313 
1 1 1 -2  4  34 o 70.09599 3.299904 60.17146       5.620950 53.72406       7.566841 68.10950       8.396128 66.04074 4.733213 74.41022 4.653611 -8.369484      6.637726 
1 1 1 -2  4  35 f 39.42736 5.515186 19.47184       5.154240 17.24271       6.025286 25.55321       9.951989 36.76814 6.979872 44.40473 9.485171 -7.636593      11.77655 
1 1 1 -2  4  36 o 49.09173 4.859381 29.88423       5.737144 24.40307       6.712224 44.74619       11.05270 43.99382 6.452633 59.50516 7.810537 -15.51133      10.13119 
1 1 1 -2  4  37 o 118.0493 3.220008 170.6378       9.254453 171.7991       12.89759 169.4054       13.28662 118.1780 4.486685 117.3075 4.657109 0.8704224      6.466762 
1 1 1 -2  4  38 o 108.4201 3.862997 144.4192       10.19003 136.6115       18.19009 147.9901       12.30146 104.3839 7.194992 109.5612 4.617839 -5.177345      8.549406 
1 1 1 -2  4  39 o 69.26351 3.550805 59.04107       5.973318 55.30744       8.174083 63.31978       8.750433 66.68507 5.068027 71.37793 5.063586 -4.692856      7.164133 
1 1 1 -2  4  40 o 58.53778 3.805245 42.38029       5.398771 42.67427       7.409062 42.04752       7.882987 58.35052 5.267186 57.79028 5.670502 0.5602493      7.739370 
1 1 1 -2  4  41 o 75.54411 3.767534 70.68893       6.913869 63.77859       10.70811 75.62932       9.054077 70.72486 6.278212 77.75600 4.801733 -7.031136      7.903961 
1 1 1 -2  4  42 o 50.98302 4.001514 32.52401       4.931671 45.37410       7.132291 20.75177       6.826618 59.88845 4.930721 39.35501 7.389483 20.53344       8.883494 
1 1 1 -2  4  43 o 61.14495 4.114220 47.10997       6.094651 43.29520       7.412940 55.06748       10.70644 57.97669 5.305631 64.26041 6.947329 -6.283722      8.741572 
1 1 1 -2  4  44 o 24.92488 6.437068 8.604087       3.936994 12.49759       5.419102 4.252022       5.729344 29.58479 7.505925 20.09324 7.931003 9.491554       10.91969 
1 1 1 -2  4  45 o 42.45284 5.338674 24.18677       5.401170 29.54470       6.338084 9.975498       10.32228 46.68970 5.687821 25.83317 10.49069 20.85653       11.93339 
1 1 1 -2  4  46 o 18.97339 6.492615 5.109518       3.611247 2.119299       4.712563 9.363380       5.620790 16.36499 6.904136 24.18807 8.101258 -7.823072      10.64413 
1 1 1 -2  4  47 o 16.85845 6.971666 3.299807       4.664579 -1.472006      7.685008 6.083283       5.869435 16.32047 7.654136 19.88728 7.968998 -3.566813      11.04947 
1 1 1 -2  4  48 o 13.63332 5.970919 0.9923023      3.784482 0.5770090      5.202983 1.458856       5.514747 14.77619 6.696904 15.59547 6.996565 -0.8192806     9.685062 
1 1 1 -2  4  49 o 12.96567 5.802065 0.6549315      3.766482 -2.342752      5.158958 4.076615       5.511745 12.69858 6.048448 16.71916 7.265956 -4.020584      9.453985 
1 1 1 -2  4  50 o 15.79563 6.437417 4.225014       3.903245 0.5614743      5.496279 7.952548       5.544075 13.86184 6.492066 18.89503 7.682697 -5.033183      10.05837 
1 1 1 -2  4  51 o 9.064355 4.461098 -4.506794      3.467401 -1.329822      4.854269 -7.816398      4.954560 12.04766 5.773318 9.886648 4.943148 2.161016       7.600389 
1 1 1 -2  5  1  o 503.6011 6.550047 3092.373       80.38356 3089.554       103.8111 3096.594       127.0308 503.2503 8.464937 503.6738 10.34960 -0.4234924     13.37047 
1 1 1 -2  5  2  o 439.6185 5.261364 2355.915       56.36511 2350.856       79.59958 2361.002       79.82552 439.0445 7.439884 439.9906 7.444957 -0.9461670     10.52517 
1 1 1 -2  5  3  o 286.1009 4.402373 997.6671       30.69320 1012.056       43.83274 983.8240       42.99292 288.1094 6.243171 284.0634 6.210773 4.046021       8.806297 
1 1 1 -2  5  4  o 673.0605 9.664477 5528.338       158.5143 5483.684       222.9614 5573.978       225.4048 669.8140 13.65965 675.3002 13.69715 -5.486206      19.34419 
1 1 1 -2  5  5  o 529.8837 7.680970 3424.653       99.18197 3449.050       140.9724 3400.740       139.5672 531.4909 10.88434 527.7588 10.85205 3.732117       15.36996 
1 1 1 -2  5  6  o 42.84127 2.397255 22.43545       2.492740 18.12296       4.058627 25.04754       3.158712 38.30471 4.429540 45.24477 2.879821 -6.940060      5.283388 
1 1 1 -2  5  7  o 346.8507 7.364031 1467.476       62.24354 1509.954       89.17864 1427.125       86.91628 351.4870 10.42307 341.6991 10.45038 9.787933       14.75977 
1 1 1 -2  5  8  o 88.93484 2.658330 96.47351       5.754786 96.50097       6.946712 96.41345       10.27440 88.92598 3.210909 88.80334 4.765236 0.1226349      5.746078 
1 1 1 -2  5  9  o 268.5903 4.193434 879.4085       27.44708 887.4855       39.07473 871.5419       38.56242 269.7571 5.944113 267.3241 5.919569 2.432983       8.388907 
1 1 1 -2  5  10 o 171.1463 3.027194 357.0010       12.62536 342.1571       17.52979 372.9997       18.19891 167.4702 4.298949 174.9136 4.269587 -7.443390      6.058906 
1 1 1 -2  5  11 o 284.3673 4.405640 985.9599       30.52986 949.9749       42.25217 1025.273       44.16267 279.0365 6.213723 289.8819 6.251700 -10.84537      8.814426 
1 1 1 -2  5  12 o 304.5657 5.378949 1131.359       39.92220 1156.979       49.73369 1084.942       66.94346 307.9153 6.628013 297.8218 9.235080 10.09351       11.36738 
1 1 1 -2  5  13 o 408.3188 6.052175 2033.744       60.22086 2076.452       86.31506 1993.239       84.06001 412.3474 8.589884 404.0061 8.538181 8.341248       12.11143 
1 1 1 -2  5  14 o 351.8964 6.145275 1510.276       52.69778 1607.306       95.56454 1467.878       63.17036 362.4951 10.83043 346.8415 7.473881 15.65363       13.15892 
1 1 1 -2  5  15 o 890.7656 12.74575 9700.739       276.6719 10024.36       400.1132 9404.215       382.9942 903.9267 18.16409 875.5905 17.94961 28.33624       25.53669 
1 1 1 -2  5  16 o 519.0278 7.568505 3285.709       95.72752 3355.214       137.2716 3219.909       133.5629 524.2182 10.74564 513.5464 10.67260 10.67175       15.14507 
1 1 1 -2  5  17 o 476.1028 6.986615 2764.129       81.05945 2774.722       114.9402 2753.647       114.3330 476.8209 9.891915 475.0078 9.877222 1.813110       13.97890 
1 1 1 -2  5  18 o 349.7114 6.139631 1491.092       52.32246 1517.413       64.64477 1441.097       89.09293 352.7278 7.520688 343.4123 10.65903 9.315552       13.04514 
1 1 1 -2  5  19 o 227.2167 4.337808 629.2704       24.01854 612.5439       40.15019 638.5921       29.97320 223.9826 7.365944 228.8721 5.374079 -4.889572      9.117996 
1 1 1 -2  5  20 o 409.1466 6.109224 2041.248       60.91175 2031.139       85.93636 2051.454       86.34957 407.9762 8.643826 410.0115 8.642275 -2.035278      12.22312 
1 1 1 -2  5  21 o 704.0508 10.15319 6054.222       174.1978 6416.019       256.2552 5743.403       237.5163 723.8728 14.52695 684.9474 14.22984 38.92542       20.33521 
1 1 1 -2  5  22 o 615.5888 10.32188 4630.924       154.8409 4621.322       189.2601 4650.363       269.2784 614.4988 12.63869 614.7817 17.99335 -0.2828979     21.98856 
1 1 1 -2  5  23 o 188.1137 3.423217 431.3425       15.69245 409.7346       21.57128 455.6320       22.87064 183.2410 4.835003 193.2370 4.860677 -9.996002      6.855905 
1 1 1 -2  5  24 o 48.71154 4.008513 29.12776       4.716226 27.37808       5.683461 32.99674       8.451454 47.10878 5.028452 51.52827 6.904114 -4.419498      8.541202 
1 1 1 -2  5  25 o 260.4353 4.253683 827.3087       26.99610 811.3015       37.73063 844.0988       38.64221 257.7674 6.006617 262.9237 6.031095 -5.156311      8.511965 
1 1 1 -2  5  26 o 288.2206 4.597023 1013.789       32.28775 1002.529       45.33793 1025.376       45.99265 286.3885 6.496358 289.6307 6.516400 -3.242188      9.201421 
1 1 1 -2  5  27 o 258.6696 4.964773 817.1971       31.29543 855.6476       56.64064 800.3004       37.54721 263.8682 8.820962 255.8387 6.022480 8.029480       10.68081 
1 1 1 -2  5  28 o 67.54105 3.089475 55.76142       5.071506 57.77827       6.962619 53.48205       7.401906 68.66493 4.180851 66.00800 4.631005 2.656929       6.239048 
1 1 1 -2  5  29 o 279.2969 5.179275 953.9611       35.25098 996.8671       61.51791 932.9855       43.01305 284.3643 8.888412 275.9442 6.396508 8.420105       10.95076 
1 1 1 -2  5  30 o 150.5471 3.585167 276.7064       13.15279 259.2490       21.01552 287.9477       16.86395 145.3473 5.945864 153.4191 4.515615 -8.071732      7.466195 
1 1 1 -2  5  31 o 14.47009 5.914643 0.9029061      3.306916 3.438427       4.326232 -2.660791      5.128928 18.99287 7.037893 14.85745 6.699387 4.135425       9.716673 
1 1 1 -2  5  32 o 63.36059 3.326317 49.16108       5.117939 52.77538       7.058871 45.15545       7.431193 65.53067 4.446665 60.50542 5.087038 5.025246       6.756536 
1 1 1 -2  5  33 o 91.77896 3.051225 102.9726       6.814742 103.5771       9.366291 102.2927       9.933721 91.91470 4.192680 91.30208 4.478394 0.6126175      6.134703 
1 1 1 -2  5  34 o 83.60674 3.173074 85.52238       6.453103 77.72591       8.630934 95.40551       9.717523 79.53268 4.471244 88.12952 4.540089 -8.596848      6.372160 
1 1 1 -2  5  35 o 27.49414 6.811064 9.704576       4.539670 14.37674       5.477362 -0.5464503     8.113272 33.50834 6.936491 20.61123 8.886312 12.89711       11.27304 
1 1 1 -2  5  36 o 135.7761 3.230777 225.4459       10.68972 244.0761       15.42946 208.2495       14.82383 140.9635 4.497426 130.1519 4.681467 10.81163       6.491762 
1 1 1 -2  5  37 o 47.25385 4.971089 27.77713       5.638694 32.10347       6.643314 16.62887       10.66419 50.73798 5.458755 35.92686 11.08059 14.81111       12.35222 
1 1 1 -2  5  38 o 62.27757 4.526927 47.97568       6.823321 39.17477       12.89454 51.39848       8.041439 54.61471 10.05912 64.32872 5.173296 -9.714012      11.31145 
1 1 1 -2  5  39 o 179.6926 3.602448 396.5451       15.77481 394.7503       22.12015 398.4024       22.50266 178.5193 5.089914 179.3061 5.155301 -0.7867584     7.244608 
1 1 1 -2  5  40 o 47.45536 4.614326 28.14408       5.268875 21.30857       7.856585 33.73105       7.102915 40.09494 8.314034 51.66286 5.738558 -11.56792      10.10219 
1 1 1 -2  5  41 o 48.58685 4.191034 29.49187       4.913763 28.08183       6.719034 31.11305       7.204566 46.79194 6.032733 49.24595 6.136207 -2.454010      8.605051 
1 1 1 -2  5  42 o 21.16558 6.817776 5.740361       3.996338 6.082342       5.371427 5.316367       5.980927 22.36694 7.902404 21.99022 8.249990 0.3767223      11.42411 
1 1 1 -2  5  43 o 45.02655 4.317212 25.75319       4.679088 30.35399       6.395491 20.45401       6.863756 48.31521 5.531529 38.48695 7.588154 9.828262       9.390308 
1 1 1 -2  5  44 o 42.24438 6.231176 24.14709       6.222307 24.14709       6.222307 0.000000       0.000000 42.24438 6.231176 ?        ?        0.000000       6.231176 
1 1 1 -2  5  45 o 14.42780 6.093382 1.050825       3.677139 0.9669337      4.822851 1.167302       5.682860 15.87787 6.848499 17.01840 7.387086 -1.140528      10.07328 
1 1 1 -2  5  46 o 14.24400 5.978821 1.378785       3.505693 2.802389       4.797007 -0.2530863     5.135925 16.99096 7.052109 14.98915 6.736042 2.001808       9.752256 
1 1 1 -2  5  47 o 10.69912 5.029857 -2.363045      3.353377 -2.757690      4.843049 -1.999585      4.647759 12.76844 6.015697 12.91779 6.023618 -0.1493502     8.513083 
1 1 1 -2  5  48 o 12.95866 5.780004 0.3324975      3.705699 2.661333       5.106707 -2.257766      5.385717 16.08237 6.991504 13.35757 6.308625 2.724797       9.416999 
1 1 1 -2  5  49 o 15.86360 6.610803 3.643804       4.239826 -3.580702      6.641619 8.612956       5.508216 13.51670 6.545744 20.54314 7.868396 -7.026436      10.23516 
1 1 1 -2  5  50 o 11.78047 5.460902 -0.3520892     3.733127 -0.3708625     5.208431 -0.3322561     5.353432 13.13810 6.204655 13.26498 6.272336 -0.1268797     8.822695 
1 1 1 -2  5  51 o 11.62362 5.361272 0.1783602      3.532542 2.758788       4.924512 -2.557019      5.070212 14.23536 6.476713 11.68000 5.671028 2.555360       8.608622 
1 1 1 -2  6  1  o 338.1115 4.157771 1393.327       34.25757 1378.886       48.09098 1408.204       48.81210 336.3060 5.868039 339.8616 5.893717 -3.555634      8.316837 
1 1 1 -2  6  2  o 487.6426 5.804274 2899.075       68.97403 2958.219       98.90768 2843.085       96.23524 492.4475 8.242026 482.7735 8.180024 9.673981       11.61223 
1 1 1 -2  6  3  o 126.3184 2.081271 194.4342       6.406659 205.2074       9.259468 184.5401       8.873612 129.7660 2.928122 123.0578 2.959070 6.708183       4.162931 
1 1 1 -2  6  4  o 564.1571 7.298054 3881.740       100.3329 3884.414       158.6901 3879.960       129.5020 563.9414 11.54728 563.8456 9.424975 0.9576416E-01  14.90537 
1 1 1 -2  6  5  o 193.1903 3.761808 454.8775       17.70998 480.1826       22.41306 412.8175       28.89557 198.4773 4.633980 183.8804 6.458542 14.59686       7.948996 
1 1 1 -2  6  6  o 253.0706 5.653495 780.8648       34.86541 776.5668       48.80602 785.3439       49.82401 252.1669 7.952293 253.5806 8.073100 -1.413605      11.33199 
1 1 1 -2  6  7  o 616.0080 10.27351 4634.757       154.2202 4774.070       192.5481 4385.458       257.5747 624.8098 12.64606 597.5376 17.70848 27.27216       21.76036 
1 1 1 -2  6  8  o 321.6785 4.884366 1261.596       38.28831 1301.216       55.24405 1224.972       53.11443 326.5869 6.941456 316.8781 6.878349 9.708893       9.772180 
1 1 1 -2  6  9  o 328.3836 4.976228 1314.920       39.82151 1256.692       54.79023 1380.119       57.97704 320.9106 7.006208 336.2958 7.074545 -15.38519      9.956714 
1 1 1 -2  6  10 o 168.2782 3.013217 345.1404       12.35647 342.3827       17.47413 347.8984       17.47525 167.5236 4.283906 168.8702 4.249908 -1.346558      6.034366 
1 1 1 -2  6  11 o 16.19095 4.035891 3.322197       1.586706 3.527364       2.152850 3.078218       2.347668 16.86343 4.929447 16.15637 5.227375 0.7070656      7.185046 
1 1 1 -2  6  12 o 424.5748 6.269569 2199.240       64.86762 2195.205       91.65682 2203.288       91.81673 423.9123 8.872637 424.6921 8.871795 -0.7798462     12.54721 
1 1 1 -2  6  13 f 264.0318 4.164436 849.8279       26.79468 847.4437       37.86582 852.2191       37.92104 263.5964 5.894836 264.3384 5.886860 -0.7420044     8.330919 
1 1 1 -2  6  14 o 157.2121 3.447022 301.2290       13.20584 285.4087       23.07699 308.9323       16.10315 152.8555 6.208215 159.1455 4.155775 -6.290039      7.470770 
1 1 1 -2  6  15 o 105.7317 2.865172 136.3337       7.375501 140.7937       9.319874 128.8600       12.06462 107.4229 3.565161 102.7020 4.834139 4.720871       6.006603 
1 1 1 -2  6  16 o 568.1213 8.242564 3937.221       114.1141 3856.571       159.1463 4022.568       163.7142 561.9521 11.62147 573.9090 11.70596 -11.95691      16.49510 
1 1 1 -2  6  17 o 584.3722 9.792835 4167.500       139.4550 4217.049       172.0277 4072.526       238.1708 587.6002 12.01380 576.5125 16.97136 11.08771       20.79323 
1 1 1 -2  6  18 o 579.3589 9.692670 4096.489       136.8445 4098.255       236.3353 4095.599       167.8438 578.2998 16.78801 579.0567 11.89456 -0.7568970     20.57469 
1 1 1 -2  6  19 f 265.0078 4.245363 855.9974       27.41634 859.7780       38.88243 852.2594       38.66361 265.5466 6.008647 264.3831 6.001123 1.163422       8.492192 
1 1 1 -2  6  20 o 330.5563 5.081342 1332.094       40.93172 1365.652       58.79109 1300.525       57.02184 334.6013 7.210207 326.5276 7.166141 8.073761       10.16566 
1 1 1 -2  6  21 o 549.3999 8.014457 3683.563       107.2998 3667.553       151.3705 3699.731       152.1219 547.7725 11.33978 550.1692 11.34643 -2.396667      16.04158 
1 1 1 -2  6  22 o 245.6171 4.696475 735.5372       28.11038 735.9569       34.25506 734.6718       49.18920 245.6486 5.722349 245.1695 8.244900 0.4790344      10.03612 
1 1 1 -2  6  23 o 184.0688 3.880177 413.0562       17.40475 413.0924       21.43730 412.9863       29.81237 183.9880 4.785346 183.8328 6.665874 0.1552124      8.205694 
1 1 1 -2  6  24 o 492.8311 7.264156 2966.981       87.24075 3062.952       125.9832 2878.559       120.9262 500.0829 10.33795 484.8212 10.23535 15.26163       14.54770 
1 1 1 -2  6  25 o 321.6550 5.012069 1262.620       39.28651 1249.108       55.17560 1276.515       55.95156 319.6780 7.082690 323.1628 7.104846 -3.484833      10.03212 
1 1 1 -2  6  26 o 393.2784 6.912501 1891.777       66.24780 2056.299       122.1688 1823.248       78.84690 408.1597 12.29673 385.7414 8.387881 22.41830       14.88510 
1 1 1 -2  6  27 o 232.1325 4.625348 657.9908       26.16474 624.5465       45.27801 674.7581       32.05953 225.4755 8.254399 234.9531 5.599378 -9.477631      9.974374 
1 1 1 -2  6  28 o 189.1076 3.496372 436.3878       16.11249 445.9816       23.01921 427.1725       22.56071 190.9683 4.950617 186.8942 4.957978 4.074127       7.006437 
1 1 1 -2  6  29 o 146.9405 3.141415 263.4457       11.24872 271.3446       16.00569 255.7366       15.81225 148.9618 4.414105 144.6008 4.492768 4.360947       6.298356 
1 1 1 -2  6  30 o 326.0427 5.871840 1302.402       46.65356 1340.341       81.00597 1283.572       57.06851 328.8361 10.12089 323.2141 7.245531 5.622070       12.44709 
1 1 1 -2  6  31 o 57.34193 3.417912 40.29226       4.754383 35.62690       6.382347 46.10888       7.126452 53.72996 4.929354 61.19744 4.817455 -7.467480      6.892489 
1 1 1 -2  6  32 o 116.4201 3.044717 165.5825       8.630542 174.0961       12.19572 157.0417       12.21516 119.2363 4.203808 113.2053 4.436473 6.031036       6.111816 
1 1 1 -2  6  33 o 116.9176 3.094059 167.0596       8.807708 164.4337       12.20541 169.9129       12.72264 115.8273 4.331827 117.7261 4.442715 -1.898773      6.205034 
1 1 1 -2  6  34 o 86.65215 4.394217 92.20489       9.248618 92.20489       9.248618 0.000000       0.000000 86.65215 4.394217 ?        ?        0.000000       4.394217 
1 1 1 -2  6  35 o 68.21149 3.404134 57.03650       5.640605 52.03388       7.627213 63.07512       8.379842 64.93396 4.855271 71.52943 4.835877 -6.595474      6.852691 
1 1 1 -2  6  36 o 42.75792 4.552405 22.69011       4.670594 19.11660       6.197002 27.38943       7.106432 38.74535 6.811892 46.64918 6.421510 -7.903824      9.361498 
1 1 1 -2  6  37 o 36.94086 5.255949 17.14487       4.598109 10.01459       6.006344 27.23975       7.146738 28.01105 8.246213 46.44774 6.491050 -18.43669      10.49446 
1 1 1 -2  6  38 o 108.5294 4.929109 145.5838       13.00220 147.1261       19.98820 144.4525       17.11917 108.0413 7.641146 107.5191 6.565024 0.5222855      10.07406 
1 1 1 -2  6  39 o 73.42699 3.497792 66.34748       6.240729 73.81564       8.739151 58.57590       8.914920 77.16866 4.669053 68.51107 5.382949 8.657593       7.125742 
1 1 1 -2  6  40 o 32.40108 6.289629 13.61575       4.787035 13.81760       7.219049 13.45733       6.395327 32.12644 8.910015 31.78201 8.202289 0.3444309      12.11057 
1 1 1 -2  6  41 o 43.88544 4.545834 24.23023       4.791182 26.00078       6.506664 22.13318       7.081254 44.93726 6.099052 40.90427 7.375313 4.032986       9.570459 
1 1 1 -2  6  42 o 41.55005 4.604099 21.90825       4.583646 20.67584       6.098346 23.50853       6.949181 39.57028 6.553399 42.01651 7.035515 -2.446228      9.614859 
1 1 1 -2  6  43 o 55.90578 3.713305 39.23877       5.030196 44.45227       7.062855 33.87217       7.165805 58.85218 4.971168 50.79851 5.898181 8.053673       7.713693 
1 1 1 -2  6  44 o 26.84713 7.623167 10.41395       5.219325 10.41395       5.219325 0.000000       0.000000 26.84713 7.623167 ?        ?        0.000000       7.623167 
1 1 1 -2  6  45 o 22.24221 6.633316 7.127014       3.866233 9.911760       5.034189 3.122732       6.036692 25.67444 7.547054 18.75858 7.857847 6.915855       10.89513 
1 1 1 -2  6  46 o 11.92045 5.491104 -1.678563      3.688754 -6.250973      4.856791 4.554588       5.670623 11.44579 5.555702 19.06091 7.762525 -7.615118      9.545816 
1 1 1 -2  6  47 o 26.30288 6.431738 10.73071       4.087651 12.50382       5.624788 8.746250       5.950583 26.73587 8.007428 22.22673 8.250727 4.509140       11.49754 
1 1 1 -2  6  48 o 24.52150 7.606688 10.85847       5.017243 25.09426       10.24486 6.366947       5.754560 30.97029 10.91609 19.22181 7.822859 11.74849       13.42975 
1 1 1 -2  6  49 o 16.14141 6.575371 4.052940       4.070129 3.800868       6.797135 4.193848       5.081957 16.74781 7.615647 16.51940 7.076156 0.2284088      10.39567 
1 1 1 -2  6  50 o 14.64295 6.155035 3.251812       3.723635 1.682679       5.307721 4.772577       5.225276 14.21351 6.561502 16.18674 7.054065 -1.973228      9.633958 
1 1 1 -2  6  51 o 13.19432 5.852977 2.092407       3.747280 4.911990       5.352348 -0.6184086     5.248097 15.63058 6.960738 12.57497 6.019838 3.055606       9.202735 
1 1 1 -2  7  1  f 280.3616 6.139876 958.4061       41.94829 931.7466       58.34117 986.9406       60.35789 276.2018 8.678641 284.2692 8.723330 -8.067383      12.30509 
1 1 1 -2  7  2  o 855.7767 12.23740 8948.655       255.2029 9004.757       362.3396 8893.430       359.5000 857.2321 17.34528 851.9245 17.31656 5.307556       24.50963 
1 1 1 -2  7  3  o 140.9065 3.160892 241.9651       10.85368 245.8983       13.37586 234.3831       18.57111 141.9876 3.869370 138.5445 5.511631 3.443146       6.734248 
1 1 1 -2  7  4  o 388.0382 5.773330 1835.902       54.59300 1733.167       74.35792 1956.038       80.40895 376.9013 8.095868 400.3923 8.241050 -23.49103      11.55240 
1 1 1 -2  7  5  o 489.4103 10.11568 2924.943       120.6436 2748.061       163.3300 3137.329       178.9727 473.6675 14.16592 506.0657 14.52759 -32.39813      20.29098 
1 1 1 -2  7  6  o 336.1909 5.884570 1378.274       48.20995 1454.555       60.96821 1250.992       78.75471 345.2957 7.245631 319.8756 10.11593 25.42004       12.44312 
1 1 1 -2  7  7  o 303.8987 4.662164 1125.940       34.52650 1111.909       48.43769 1140.432       49.22758 301.9125 6.583642 305.7592 6.606826 -3.846649      9.327084 
1 1 1 -2  7  8  o 522.1989 7.600400 3328.507       96.71825 3348.581       137.3340 3308.754       136.2331 523.3033 10.76933 520.1858 10.74702 3.117554       15.21437 
1 1 1 -2  7  9  o 194.7404 3.322036 462.2523       15.76509 482.3353       22.84043 443.9786       21.78725 198.8885 4.712577 190.8174 4.685418 8.071091       6.645413 
1 1 1 -2  7  10 o 248.7949 4.561794 754.7538       27.65752 769.7119       34.48848 727.8008       46.29563 251.2001 5.634015 244.0180 7.795422 7.182144       9.618250 
1 1 1 -2  7  11 o 874.5826 12.53463 9369.076       267.1460 9599.915       384.2926 9153.200       371.6285 882.9031 17.86129 862.2050 17.68733 20.69812       25.13698 
1 1 1 -2  7  12 o 355.4966 5.350431 1541.149       46.35112 1556.756       66.05898 1526.013       65.05337 357.1391 7.590291 353.5982 7.549594 3.540833       10.70555 
1 1 1 -2  7  13 o 159.9874 3.476937 311.9659       13.55560 322.3290       24.78243 307.5417       16.19270 162.4478 6.272066 158.7831 4.188498 3.664749       7.542037 
1 1 1 -2  7  14 o 527.6132 8.894537 3397.335       114.3602 3124.983       188.1153 3556.996       144.0317 504.9969 15.30385 539.6440 10.95254 -34.64703      18.81930 
1 1 1 -2  7  15 o 495.8337 7.252093 2998.335       87.62652 3067.082       125.8726 2933.688       122.0606 501.2497 10.30483 490.2362 10.21725 11.01355       14.51143 
1 1 1 -2  7  16 o 337.2978 5.949314 1387.028       48.90086 1371.312       59.30269 1420.420       86.44009 335.3339 7.257063 340.9713 10.41528 -5.637390      12.69421 
1 1 1 -2  7  17 o 822.6033 11.79414 8264.194       236.4248 8345.125       336.9677 8185.725       331.8024 825.6437 16.74787 817.7426 16.65048 7.901123       23.61630 
1 1 1 -2  7  18 o 337.5599 5.917966 1389.256       48.68099 1424.216       84.79329 1372.067       59.45584 341.4166 10.20301 335.4110 7.274130 6.005585       12.53054 
1 1 1 -2  7  19 o 496.2262 7.275983 3003.463       87.98476 3009.339       124.5867 2997.616       124.2723 496.4496 10.29818 495.4824 10.29225 0.9672546      14.55963 
1 1 1 -2  7  20 f 371.2128 5.610444 1680.186       50.75235 1697.575       72.25654 1663.253       71.30231 372.9966 7.949433 369.2083 7.924942 3.788361       11.22489 
1 1 1 -2  7  21 o 283.9263 4.506159 982.7605       31.17800 997.1552       44.45153 968.8220       43.74174 285.9219 6.379742 281.8311 6.368997 4.090851       9.014723 
1 1 1 -2  7  22 o 290.2671 5.321954 1027.526       37.64479 1008.629       45.38813 1069.177       67.38419 287.5232 6.477887 295.6659 9.364157 -8.142700      11.38642 
1 1 1 -2  7  23 o 152.7893 3.530095 284.5849       13.14363 295.0269       16.51314 266.5331       21.71199 155.4852 4.362484 147.6685 6.046376 7.816757       7.455866 
1 1 1 -2  7  24 o 34.21761 4.488208 14.52554       3.652337 15.05275       4.952012 13.89665       5.408491 34.60777 6.094322 33.11506 6.925227 1.492710       9.224941 
1 1 1 -2  7  25 o 233.1619 4.602780 663.3556       26.15254 697.6379       47.72443 648.6426       31.26483 238.5960 8.220354 230.4850 5.566437 8.110992       9.927711 
1 1 1 -2  7  26 o 245.6668 4.093971 736.4241       24.50910 749.8002       34.97303 723.5148       34.35736 247.7082 5.793711 243.3275 5.794188 4.380692       8.193882 
1 1 1 -2  7  27 o 25.71703 7.037208 8.357387       4.537446 1.035220       9.061004 10.80810       5.242073 22.95574 9.622257 29.13871 7.376619 -6.182970      12.12445 
1 1 1 -2  7  28 o 49.33127 3.437877 29.83989       4.106978 30.99955       5.691198 28.57976       5.932611 50.15011 4.712095 48.07896 5.143363 2.071152       6.975530 
1 1 1 -2  7  29 o 87.17895 3.255252 92.87498       6.903492 100.2124       10.81785 87.83390       8.966673 90.39749 4.929410 84.67597 4.360135 5.721519       6.581023 
1 1 1 -2  7  30 o 138.9825 3.102988 235.7337       10.50936 234.7872       14.68172 236.7284       15.05009 138.5282 4.354543 139.0881 4.446019 -0.5599213     6.223274 
1 1 1 -2  7  31 o 122.5688 3.383313 183.5889       10.09584 181.4070       16.05096 185.0171       12.98640 121.5553 5.432376 122.9283 4.341936 -1.373009      6.954360 
1 1 1 -2  7  32 o 81.08389 3.051385 80.38396       6.018553 75.35090       8.093883 86.60877       9.001286 78.37058 4.254014 84.01677 4.411915 -5.646187      6.128755 
1 1 1 -2  7  33 o 89.48954 3.059926 97.91747       6.663156 91.86624       9.000242 105.2566       9.911827 86.53036 4.281544 92.61865 4.404181 -6.088287      6.142347 
1 1 1 -2  7  34 o 153.5914 4.622355 289.4176       17.28113 289.4176       17.28113 0.000000       0.000000 153.5914 4.622355 ?        ?        0.000000       4.622355 
1 1 1 -2  7  35 o 76.50835 3.224952 71.68563       5.999196 71.45975       8.264928 71.93716       8.721785 76.20990 4.469949 76.42495 4.705929 -0.2150497     6.490471 
1 1 1 -2  7  36 o 72.52496 3.338118 64.48906       5.883815 57.99763       7.920087 72.48409       8.789618 68.54084 4.771609 76.66863 4.727522 -8.127792      6.716972 
1 1 1 -2  7  37 o 40.63243 4.752870 20.58115       4.617327 24.58831       6.217799 15.65468       6.894238 44.21378 5.919485 34.66354 8.276299 9.550240       10.17533 
1 1 1 -2  7  38 o 21.73771 7.923051 4.963728       5.446307 9.523781       11.53387 3.655184       6.178518 30.35600 11.44203 21.19517 8.274771 9.160833       14.12062 
1 1 1 -2  7  39 o 37.35490 5.798100 17.76023       5.106975 17.52596       6.176637 18.26646       9.079636 36.73077 7.157943 36.88792 9.896356 -0.1571503     12.21368 
1 1 1 -2  7  40 o 65.66241 3.523340 53.24126       5.617126 54.52715       7.738342 51.80912       8.166579 66.06889 4.839925 64.24879 5.262079 1.820091       7.149431 
1 1 1 -2  7  41 o 42.70300 4.600017 22.99718       4.711475 22.70840       6.306309 23.36200       7.088060 41.79509 6.394780 42.08365 7.168283 -0.2885551     9.606117 
1 1 1 -2  7  42 o 40.74158 4.628161 21.11493       4.513632 14.55495       5.930583 30.14569       6.958383 32.59506 7.605947 48.10989 6.070088 -15.51483      9.731207 
1 1 1 -2  7  43 o 15.20100 6.473574 0.6380202      4.209069 -1.028991      4.895155 5.366149       8.244073 14.93722 6.654086 23.15534 9.385550 -8.218118      11.50502 
1 1 1 -2  7  44 o 44.73544 4.889264 26.17167       5.243365 24.84112       6.056594 30.15240       10.47596 42.89073 5.955102 43.67629 10.05140 -0.7855568     11.68306 
1 1 1 -2  7  45 o 37.15444 5.072526 18.58308       4.472926 19.71503       5.859779 17.00268       6.923898 37.02430 6.743038 32.72704 8.578890 4.297268       10.91173 
1 1 1 -2  7  46 o 15.20194 6.275349 2.105317       3.770150 2.902402       4.902964 0.9521625      5.897262 17.00879 7.100130 16.42684 7.311456 0.5819569      10.19163 
1 1 1 -2  7  47 o 23.10518 6.841269 8.645408       4.124212 14.77184       5.774958 2.268490       5.891832 29.21294 7.916504 16.70870 7.379020 12.50424       10.82224 
1 1 1 -2  7  48 o 22.82026 8.062914 10.07239       5.591895 0.000000       0.000000 10.07239       5.591895 ?        ?        22.82026 8.062914 0.000000       8.062914 
1 1 1 -2  7  49 o 12.21220 5.574131 -0.4133166E-01 3.685124 -0.3235306     5.316113 0.2197080      5.112929 13.65107 6.390582 13.77640 6.387782 -0.1253281     9.035668 
1 1 1 -2  7  50 o 9.771596 4.738527 -3.298565      3.511060 -6.382551      5.128110 -0.5771591     4.817235 10.63911 5.270802 12.61176 5.959401 -1.972648      7.955866 
1 1 1 -2  7  51 o 10.45280 5.004586 -1.842235      3.629807 -3.807977      5.255834 -0.4966195E-01 5.018996 11.30969 5.551396 12.63444 6.003060 -1.324750      8.176475 
1 1 1 -2  8  1  o 566.4440 8.211030 3915.179       113.3420 3605.343       214.4618 4035.257       133.5105 542.1818 16.25023 574.9199 9.529544 -32.73810      18.83831 
1 1 1 -2  8  2  o 126.7474 2.146430 195.7618       6.629668 207.4084       9.597129 185.1309       9.169048 130.4568 3.018828 123.2515 3.052784 7.205360       4.293345 
1 1 1 -2  8  3  o 384.3997 5.120889 1801.484       47.96942 1768.573       75.02241 1824.245       62.38924 380.7032 8.086644 386.7433 6.619892 -6.040039      10.45068 
1 1 1 -2  8  4  o 286.5389 3.969138 1000.777       27.71507 1021.958       44.29509 987.1497       35.52893 289.4733 6.279298 284.5456 5.123822 4.927643       8.104513 
1 1 1 -2  8  5  o 357.5045 5.376028 1558.450       46.83593 1567.519       66.65900 1549.607       65.82097 358.4077 7.632122 356.3578 7.579524 2.049927       10.75632 
1 1 1 -2  8  6  o 169.2467 3.048174 349.1094       12.57176 364.7956       18.24698 334.9347       17.34557 172.9297 4.333387 165.6979 4.299346 7.231842       6.104312 
1 1 1 -2  8  7  o 103.7150 2.453174 131.0909       6.200201 127.6925       8.781584 134.4690       8.755293 102.2905 3.528192 104.9773 3.427060 -2.686790      4.918625 
1 1 1 -2  8  8  o 160.8779 2.964489 315.4480       11.62204 322.0215       16.64687 309.1973       16.23302 162.4666 4.208218 159.1974 4.187979 3.269150       5.937025 
1 1 1 -2  8  9  o 325.8800 4.972476 1295.075       39.48813 1247.648       54.46829 1347.619       57.33091 319.7232 6.990906 332.2785 7.080282 -12.55527      9.950033 
1 1 1 -2  8  10 o 235.3992 4.383196 675.6094       25.14385 683.3009       31.24680 661.4798       42.35104 236.6951 5.417266 232.6619 7.479409 4.033188       9.235168 
1 1 1 -2  8  11 o 330.6412 5.032672 1333.059       40.55008 1380.938       58.64215 1289.190       56.13304 336.3965 7.153563 325.0341 7.086855 11.36234       10.06961 
1 1 1 -2  8  12 o 575.5178 8.342649 4042.899       117.0035 4023.198       165.0014 4062.825       165.9385 573.6057 11.80424 576.4220 11.81328 -2.816345      16.70011 
1 1 1 -2  8  13 o 510.8588 8.626871 3184.902       107.3965 3118.996       184.1947 3218.848       132.1919 504.5186 14.99845 513.3707 10.56666 -8.852081      18.34687 
1 1 1 -2  8  14 o 482.3762 7.071084 2837.755       83.12047 2775.320       115.8849 2903.911       119.2892 476.8248 9.973140 487.7407 10.03636 -10.91586      14.14892 
1 1 1 -2  8  15 f 665.9779 11.09884 5415.222       180.1248 5438.291       221.0924 5369.688       310.6256 667.0521 13.60122 661.5289 19.28930 5.523254       23.60233 
1 1 1 -2  8  16 o 373.5706 5.618148 1701.285       51.14486 1670.962       71.60593 1732.866       73.07597 370.1307 7.938854 376.9236 7.955825 -6.792908      11.23924 
1 1 1 -2  8  17 o 1036.405 17.09907 13153.99       431.8551 13490.67       760.4858 12993.74       524.6563 1043.767 29.92956 1028.783 20.92738 14.98328       36.52031 
1 1 1 -2  8  18 o 785.2533 11.26933 7531.205       215.6473 7519.670       304.7208 7542.776       305.2225 783.7119 15.95547 784.9146 15.95725 -1.202759      22.56570 
1 1 1 -2  8  19 o 435.4728 6.456342 2312.626       68.51469 2336.441       97.60959 2289.496       96.19469 437.5174 9.155057 433.1031 9.114309 4.414307       12.91843 
1 1 1 -2  8  20 o 282.3449 4.471796 971.7919       30.76791 984.3201       43.91249 959.7102       43.12304 284.0905 6.343009 280.5180 6.308302 3.572418       8.945861 
1 1 1 -2  8  21 o 198.5626 3.510952 480.5652       16.98863 471.2628       23.81214 490.2088       24.24481 196.5341 4.975925 200.5102 4.961879 -3.976120      7.027096 
1 1 1 -2  8  22 o 117.4932 4.005568 168.4917       11.45190 168.4917       11.45190 0.000000       0.000000 117.4932 4.005568 ?        ?        0.000000       4.005568 
1 1 1 -2  8  23 o 66.07539 2.996167 53.32767       4.811832 56.75539       6.669312 49.60617       6.949232 68.10534 4.036604 63.61789 4.511786 4.487453       6.053957 
1 1 1 -2  8  24 o 79.93824 3.544922 78.07008       6.888360 97.82923       14.24238 72.03672       7.870070 89.25017 6.595026 76.73490 4.225021 12.51527       7.832315 
1 1 1 -2  8  25 o 197.0953 3.553793 473.7672       17.06886 454.0571       23.64055 495.2318       24.67041 192.7958 5.036120 201.4166 5.026260 -8.620804      7.115181 
1 1 1 -2  8  26 o 202.8815 3.617661 502.1389       17.88573 507.5314       25.40971 496.8432       25.18032 203.7789 5.120928 201.6194 5.129153 2.159500       7.247904 
1 1 1 -2  8  27 o 169.0212 3.897275 348.6919       16.05234 368.8550       29.83715 340.4786       19.04314 173.3524 7.077918 166.8889 4.687113 6.463593       8.489166 
1 1 1 -2  8  28 o 150.8954 3.147429 277.7991       11.57359 282.1766       16.41306 273.4698       16.32236 151.9165 4.438278 149.5470 4.483944 2.369522       6.309047 
1 1 1 -2  8  29 o 156.5880 3.622921 299.3516       13.82463 299.0364       22.58669 299.5405       17.48174 156.1332 5.947245 156.4774 4.589513 -0.3441925     7.512213 
1 1 1 -2  8  30 o 149.1796 3.183210 271.6373       11.57206 279.8893       16.44925 263.5516       16.28275 151.2342 4.468239 146.7369 4.559105 4.497375       6.383620 
1 1 1 -2  8  31 o 28.09149 5.353997 9.988139       3.531365 8.011839       4.629519 12.73817       5.461078 25.20639 7.186911 31.54992 7.254706 -6.343527      10.21188 
1 1 1 -2  8  32 o 77.13273 3.361086 72.81248       6.302467 65.66096       9.441409 78.56057       8.464473 72.98260 5.345697 80.00868 4.357821 -7.026077      6.896889 
1 1 1 -2  8  33 o 89.48744 3.487471 98.02482       7.590608 94.81608       9.123487 105.2408       13.68176 87.90617 4.271767 92.29820 6.117449 -4.392036      7.461312 
1 1 1 -2  8  34 o 153.5976 3.828912 288.6757       14.33164 286.2600       17.22603 294.1079       25.83150 152.7352 4.633536 154.1617 6.893455 -1.426498      8.305984 
1 1 1 -2  8  35 o 96.83158 3.114789 114.7293       7.340344 116.7888       10.20130 112.5182       10.57015 97.51224 4.303596 95.66460 4.547144 1.847633       6.260787 
1 1 1 -2  8  36 o 92.53503 3.192137 104.8685       7.187419 104.3272       9.821815 105.4926       10.54586 92.08629 4.389478 92.53717 4.691905 -0.4508820     6.425067 
1 1 1 -2  8  37 o 75.33363 3.295340 69.61762       6.034945 71.57959       8.398390 67.52290       8.677873 76.16100 4.545774 73.89941 4.845500 2.261581       6.644015 
1 1 1 -2  8  38 o 82.35040 4.064409 83.58782       8.131213 85.24348       15.71959 82.98300       9.501028 81.85539 7.981852 81.87130 4.782978 -0.1590729E-01 9.305205 
1 1 1 -2  8  39 f 154.4240 3.824191 293.5421       14.39098 293.1142       23.36905 293.8035       18.26518 152.8774 6.286211 153.9316 4.875375 -1.054214      7.955233 
1 1 1 -2  8  40 o 16.66134 6.813940 1.491576       4.391860 -0.1843930     5.112588 6.210735       8.579066 16.30587 7.042246 25.23839 9.779411 -8.932524      12.05115 
1 1 1 -2  8  41 o 73.97670 3.401564 67.74973       6.115695 63.13618       8.031610 74.11589       9.434599 70.91119 4.673907 76.65265 5.079451 -5.741455      6.902625 
1 1 1 -2  8  42 o 24.91249 6.570099 8.372137       4.045098 7.108624       5.281052 10.16577       6.292122 23.35268 7.852941 27.15902 8.532793 -3.806341      11.59643 
1 1 1 -2  8  43 o 36.62295 5.587685 17.73544       4.829124 16.49324       5.621042 21.23588       9.435901 34.60846 6.907111 37.14966 10.14102 -2.541199      12.26982 
1 1 1 -2  8  44 o 24.28572 7.098278 8.459199       4.464218 8.436342       5.227436 8.520781       8.580468 24.12592 7.799801 24.80406 9.731504 -0.6781368     12.47153 
1 1 1 -2  8  45 o 12.27766 5.606126 -1.483424      3.732103 0.3936768      4.666628 -4.814545      6.216623 15.06550 6.613337 14.12376 6.702098 0.9417419      9.415644 
1 1 1 -2  8  46 o 34.77398 5.346368 17.01015       4.385684 19.78478       5.989467 13.80285       6.439549 35.81091 7.114184 28.11894 8.599111 7.691971       11.16048 
1 1 1 -2  8  47 o 15.74087 6.395589 2.979575       3.838780 5.843271       5.313833 -0.1462241     5.551686 19.20972 7.620352 14.85912 6.804719 4.350607       10.21636 
1 1 1 -2  8  48 o 29.10732 8.558123 16.81496       6.472759 0.000000       0.000000 16.81496       6.472759 ?        ?        29.10732 8.558123 0.000000       8.558123 
1 1 1 -2  8  49 o 10.62530 5.047122 -2.145704      3.543197 -0.8283710E-01 5.095891 -4.076375      4.929905 13.51220 6.302966 11.50112 5.585990 2.011074       8.422034 
1 1 1 -2  8  50 o 14.83325 6.246791 3.547445       3.846918 2.729286       5.608344 4.274431       5.286625 14.77438 6.793013 15.65367 6.947517 -0.8792820     9.716637 
1 1 1 -2  8  51 o 13.22132 6.098652 1.624884       4.572311 -0.7343616     5.238890 9.166618       9.366735 12.43048 5.967521 16.82086 8.049682 -4.390383      10.02041 
1 1 1 -2  9  1  o 159.7700 2.651473 311.0832       10.32330 304.8169       16.08888 315.4684       13.45924 158.0758 4.180282 160.8822 3.433022 -2.806320      5.409288 
1 1 1 -2  9  2  o 461.8865 6.782606 2602.610       76.34277 2599.948       152.4272 2603.501       88.20293 460.6020 13.59490 461.8708 7.836577 -1.268799      15.69182 
1 1 1 -2  9  3  o 360.6645 6.267920 1586.665       55.08876 1654.943       69.40237 1470.381       90.57190 368.2383 7.734089 346.6682 10.73413 21.57007       13.23018 
1 1 1 -2  9  4  o 202.5568 2.797869 500.0345       13.81053 477.9480       19.07096 524.3888       20.02611 198.0101 3.952292 207.4069 3.962207 -9.396820      5.596400 
1 1 1 -2  9  5  o 286.1856 3.987291 998.4393       27.80749 945.0188       42.54234 1038.289       36.74335 278.3204 6.272495 291.7906 5.167392 -13.47018      8.126878 
1 1 1 -2  9  6  o 92.88437 2.165356 105.1377       4.901263 107.0381       7.951652 103.9734       6.224248 93.64347 3.490636 92.32255 2.769711 1.320923       4.455989 
1 1 1 -2  9  7  o 216.5734 3.604520 571.7574       19.02342 584.2215       27.30803 560.0059       26.51582 218.8711 5.119952 214.2887 5.077731 4.582458       7.210913 
1 1 1 -2  9  8  o 438.6489 6.474682 2347.808       69.21043 2307.683       96.85088 2389.681       98.93918 434.5749 9.145403 442.2233 9.181012 -7.648438      12.95876 
1 1 1 -2  9  9  o 84.85876 2.734180 87.85297       5.646673 84.29777       7.106724 93.94071       9.299619 83.08607 3.517945 87.66998 4.366638 -4.583908      5.607448 
1 1 1 -2  9  10 o 283.8136 4.436040 982.0303       30.68066 937.0993       42.25550 1032.128       44.61892 277.1653 6.256167 290.8772 6.294673 -13.71194      8.874826 
1 1 1 -2  9  11 o 528.1233 7.693542 3403.533       99.01426 3376.363       139.3687 3431.224       140.6954 525.6161 10.88079 529.8669 10.89625 -4.250732      15.39869 
1 1 1 -2  9  12 o 202.7881 4.887289 501.3196       24.15163 509.5987       35.69172 494.3268       32.80209 204.2690 7.181333 201.2121 6.699111 3.056870       9.820877 
1 1 1 -2  9  13 o 361.9038 6.321864 1597.038       55.75378 1589.116       97.16293 1600.927       68.07684 360.5596 11.07139 362.2785 7.711177 -1.718933      13.49215 
1 1 1 -2  9  14 o 433.7136 6.413213 2293.571       67.78206 2338.752       97.20263 2250.806       94.56826 437.8107 9.110780 429.5050 9.035269 8.305664       12.83131 
1 1 1 -2  9  15 o 317.7072 4.885362 1230.352       37.82334 1196.820       52.69610 1265.983       54.32149 313.2873 6.902391 322.2119 6.918215 -8.924561      9.772651 
1 1 1 -2  9  16 o 365.4453 6.337122 1628.340       56.43526 1745.622       101.5600 1575.948       67.88031 377.9565 11.03851 359.4577 7.749255 18.49884       13.48701 
1 1 1 -2  9  17 o 453.2634 6.692879 2505.304       73.92644 2516.271       104.9599 2494.507       104.1404 454.0684 9.485628 452.1030 9.452483 1.965424       13.39129 
1 1 1 -2  9  18 o 325.7859 5.012719 1293.862       39.79622 1250.211       55.19978 1341.106       57.42696 320.1639 7.075040 331.5967 7.106725 -11.43283      10.02805 
1 1 1 -2  9  19 o 224.0237 3.766124 611.6903       20.56008 612.0404       29.18287 611.3453       28.97098 224.0519 5.344945 223.9256 5.309129 0.1263123      7.533610 
1 1 1 -2  9  20 o 277.4735 4.423291 938.5754       29.90909 921.5272       41.94459 956.2103       42.66018 274.8721 6.261944 279.9974 6.252196 -5.125305      8.848836 
1 1 1 -2  9  21 o 305.0540 6.761483 1135.478       50.26374 1135.478       50.26374 0.000000       0.000000 305.0540 6.761483 ?        ?        0.000000       6.761483 
1 1 1 -2  9  22 o 179.2299 3.899781 391.6401       17.03283 389.9076       20.57249 395.4162       30.37161 178.7455 4.727124 179.8418 6.943169 -1.096252      8.399601 
1 1 1 -2  9  23 o 433.5286 6.463774 2294.903       68.28731 2370.710       98.68541 2225.257       94.59039 440.1517 9.200564 426.4549 9.102020 13.69681       12.94207 
1 1 1 -2  9  24 o 477.5382 7.069247 2787.556       82.26543 2869.137       118.6371 2711.999       114.1731 483.6761 10.06537 470.2755 9.962659 13.40054       14.16214 
1 1 1 -2  9  25 o 207.0470 3.655278 522.8992       18.44274 532.2482       26.36072 513.9354       25.81189 208.7748 5.181352 205.0882 5.168793 3.686569       7.318663 
1 1 1 -2  9  26 o 157.4880 3.178838 302.5154       12.19978 296.7694       17.04156 308.5559       17.47270 155.8410 4.492055 158.9056 4.516744 -3.064606      6.370207 
1 1 1 -2  9  27 o 191.6682 4.165688 448.5595       19.45686 449.0447       35.15919 448.3454       23.35982 191.1648 7.562278 191.4676 5.010852 -0.3027802     9.071752 
1 1 1 -2  9  28 o 249.5554 4.741887 761.1870       28.83728 750.7083       48.17813 767.0370       35.99794 246.9940 8.014986 250.2992 5.901768 -3.305145      9.953435 
1 1 1 -2  9  29 o 108.2346 2.914172 143.0310       7.679309 143.3623       10.67273 142.6753       11.05788 108.2565 4.052778 107.9795 4.210440 0.2769928      5.844040 
1 1 1 -2  9  30 o 108.3920 2.955234 143.4862       7.798657 140.5110       10.72579 146.8234       11.35940 107.1441 4.115603 109.5098 4.264787 -2.365715      5.926770 
1 1 1 -2  9  31 o 208.3312 3.756564 530.3734       19.07133 553.2239       27.52526 509.2752       26.44881 212.3948 5.322230 203.7763 5.330764 8.618515       7.532806 
1 1 1 -2  9  32 o 151.7189 3.229065 281.1557       11.93858 288.9814       16.91956 273.3961       16.84807 153.5695 4.526077 149.3467 4.634943 4.222809       6.478277 
1 1 1 -2  9  33 o 104.5513 3.395175 133.7348       8.638761 121.0736       12.75689 144.4586       11.74041 99.17632 5.297603 108.5108 4.449351 -9.334435      6.918188 
1 1 1 -2  9  34 o 121.5949 3.621408 181.0149       10.71877 172.5916       12.55408 203.6724       20.58973 118.6032 4.350997 128.2924 6.608147 -9.689117      7.911940 
1 1 1 -2  9  35 o 46.29041 4.155545 26.47150       4.637821 29.67900       6.122048 22.15146       7.104883 48.85449 5.223238 41.69101 7.256701 7.163475       8.941024 
1 1 1 -2  9  36 o 97.81636 3.141963 117.1646       7.479712 116.0730       10.25001 118.4080       10.93943 97.13968 4.341004 98.05920 4.590686 -0.9195175     6.318125 
1 1 1 -2  9  37 o 56.55066 3.777588 39.40100       5.175957 40.71713       6.924460 37.73447       7.791897 57.25539 5.013409 54.89327 5.918318 2.362122       7.756336 
1 1 1 -2  9  38 o 66.68291 5.310499 55.40737       8.558268 0.000000       0.000000 55.40737       8.558268 ?        ?        66.68291 5.310499 0.000000       5.310499 
1 1 1 -2  9  39 o 96.12594 3.268625 113.6139       7.645565 117.4843       10.77446 109.6884       10.85087 97.34067 4.554818 93.97580 4.753628 3.364868       6.583566 
1 1 1 -2  9  40 o 47.07584 4.145185 27.65859       4.706784 23.80469       6.238306 32.75199       7.171660 43.03524 6.120871 50.67398 5.918979 -7.638741      8.514656 
1 1 1 -2  9  41 o 19.65798 6.994331 4.488401       4.214282 4.206198       4.804168 5.430526       8.777925 19.85158 7.404874 24.36089 9.750937 -4.509306      12.24389 
1 1 1 -2  9  42 o 36.86811 5.555459 17.75775       4.836354 17.65244       5.637643 18.05124       9.411627 36.27007 6.622364 34.80214 10.34228 1.467937       12.28082 
1 1 1 -2  9  43 o 51.16795 3.975836 33.22107       4.918621 28.40421       6.360059 40.38903       7.758494 46.29562 5.761824 55.22927 5.853650 -8.933659      8.213637 
1 1 1 -2  9  44 o 23.29291 7.117687 7.815722       4.413021 7.881605       5.087037 7.615343       8.871617 23.31441 7.704219 24.01251 9.735039 -0.6981068     12.41475 
1 1 1 -2  9  45 o 19.71143 6.621964 5.559728       3.755224 5.259353       4.895424 5.989172       5.853443 19.65734 7.444298 20.76437 8.069011 -1.107035      10.97846 
1 1 1 -2  9  46 o 30.16726 5.935986 13.35922       4.208311 14.42102       5.587952 11.96789       6.396572 29.63621 7.676559 25.83229 8.642111 3.803919       11.55922 
1 1 1 -2  9  47 o 15.13101 6.427563 2.192893       4.131407 6.837567       6.194963 -1.527487      5.544402 20.03069 8.129756 14.02956 6.554247 6.001133       10.44275 
1 1 1 -2  9  48 o 25.93153 7.515733 12.34966       5.023621 17.21821       9.800506 10.61458       5.850708 24.55498 10.12515 22.75080 8.223447 1.804184       13.04392 
1 1 1 -2  9  49 o 14.37613 6.022087 2.788319       3.545588 7.751695       5.235441 -1.416618      4.818861 19.20804 7.581499 12.48312 5.916899 6.724921       9.617111 
1 1 1 -2  9  50 o 13.47557 6.079637 1.799248       4.230609 -0.1545931     5.254681 5.399344       7.132779 13.02382 6.174790 16.28738 7.549528 -3.263562      9.753123 
1 1 1 -2  10 1  o 124.9092 2.680801 190.1499       8.160094 177.6741       15.84082 194.6562       9.520457 120.5785 5.404768 126.3758 3.091417 -5.797386      6.226426 
1 1 1 -2  10 2  f 475.3005 6.979141 2756.956       80.83629 2854.438       117.1520 2668.363       111.6835 483.2364 9.948414 467.2413 9.808708 15.99515       13.97074 
1 1 1 -2  10 3  o 518.3890 6.173459 3278.410       77.98668 3216.460       108.8892 3343.652       111.7459 513.1494 8.707727 523.1884 8.764709 -10.03900      12.35494 
1 1 1 -2  10 4  o 270.8741 3.488524 894.3746       23.02743 908.6741       32.94666 880.7179       32.19767 272.9741 4.952834 268.7438 4.916430 4.230347       6.978671 
1 1 1 -2  10 5  o 345.5895 4.685252 1456.327       39.45750 1390.261       60.63260 1504.858       51.96699 337.4696 7.372850 351.2095 6.071908 -13.73987      9.551282 
1 1 1 -2  10 6  o 204.1100 3.106002 507.7827       15.44907 528.8671       25.08101 494.8921       19.61108 208.2520 4.942194 201.4809 3.994216 6.771057       6.354451 
1 1 1 -2  10 7  o 478.4538 6.275598 2792.903       73.16969 2867.943       117.9217 2745.924       93.30354 484.3517 9.990718 474.2090 8.074063 10.14267       12.84542 
1 1 1 -2  10 8  o 74.85982 2.825675 68.39577       5.145490 66.07298       6.529191 72.20269       8.358770 73.53322 3.655133 76.82470 4.484331 -3.291481      5.785258 
1 1 1 -2  10 9  o 161.7628 3.460503 318.9414       13.64124 347.4313       24.32923 305.8780       16.47446 168.6738 5.928164 158.3437 4.273382 10.33018       7.307867 
1 1 1 -2  10 10 o 404.3196 6.019950 1993.615       59.31353 1964.162       83.14788 2024.133       84.63593 401.1445 8.505782 407.2206 8.528821 -6.076050      12.04529 
1 1 1 -2  10 11 o 316.0690 5.631184 1218.038       43.37282 1273.495       78.04017 1193.252       52.17266 322.8043 9.932529 312.7866 6.844768 10.01767       12.06259 
1 1 1 -2  10 12 o 244.6671 5.745359 729.8312       34.25539 666.8196       46.14671 807.1671       51.12355 233.6555 8.116873 257.0944 8.170416 -23.43889      11.51691 
1 1 1 -2  10 13 o 674.4723 9.723506 5551.658       159.8171 5470.377       223.5876 5636.567       228.5241 668.9927 13.71482 679.0639 13.80973 -10.07117      19.46292 
1 1 1 -2  10 14 o 648.2338 9.354862 5127.243       147.7764 5106.239       208.5623 5148.419       209.4152 646.4467 13.23936 649.1112 13.23894 -2.664551      18.72298 
1 1 1 -2  10 15 o 151.4541 2.975671 279.5323       10.98252 273.1843       15.58564 285.7931       15.47818 149.6517 4.278119 153.0739 4.153212 -3.422180      5.962505 
1 1 1 -2  10 16 o 228.9490 4.340186 638.8931       24.21493 642.5421       41.43371 637.0002       29.84166 229.4089 7.421289 228.5897 5.357106 0.8191681      9.152821 
1 1 1 -2  10 17 o 259.8328 4.184850 822.8870       26.49780 822.9576       37.60448 822.8173       37.34398 259.7996 5.939708 259.7786 5.899037 0.2093506E-01  8.371306 
1 1 1 -2  10 18 o 507.3653 7.435715 3140.200       91.93472 3234.563       132.7526 3053.237       127.4407 514.6222 10.58567 500.0037 10.45921 14.61847       14.88125 
1 1 1 -2  10 19 o 151.8076 3.034339 280.8604       11.22519 266.7919       15.64435 295.7896       16.11579 147.8756 4.346067 155.7154 4.250993 -7.839813      6.079412 
1 1 1 -2  10 20 o 714.5530 10.30595 6240.079       179.4562 6449.909       259.7020 6048.327       248.2630 725.3363 14.69264 702.4483 14.50313 22.88800       20.64496 
1 1 1 -2  10 21 o 386.0534 8.264163 1820.302       77.74677 1820.302       77.74677 0.000000       0.000000 386.0534 8.264163 ?        ?        0.000000       8.264163 
1 1 1 -2  10 22 o 369.3318 5.608341 1664.386       50.47626 1654.187       71.21503 1674.683       71.55460 367.9368 7.942593 370.2108 7.931447 -2.273926      11.22464 
1 1 1 -2  10 23 o 62.56105 2.995485 47.82233       4.553483 46.21474       6.346085 49.52830       6.537369 61.40699 4.267390 63.58250 4.243482 -2.175503      6.018119 
1 1 1 -2  10 24 o 213.6718 3.718489 556.8447       19.36198 561.2429       27.47501 552.5057       27.28987 214.4069 5.258514 212.7310 5.264225 1.675888       7.440701 
1 1 1 -2  10 25 o 122.4127 2.906342 182.7225       8.669807 185.7898       12.33617 179.7290       12.18711 123.3205 4.110706 121.2886 4.129317 2.031883       5.826591 
1 1 1 -2  10 26 o 102.5322 2.867717 128.3098       7.158238 123.9347       9.893091 133.1172       10.37032 100.6827 4.040396 104.3478 4.086137 -3.665100      5.746418 
1 1 1 -2  10 27 o 321.9693 7.150982 1271.399       56.10690 0.000000       0.000000 1271.399       56.10690 ?        ?        321.9693 7.150982 0.000000       7.150982 
1 1 1 -2  10 28 o 203.8505 3.664997 507.3138       18.20629 487.6581       25.22835 528.6752       26.30025 199.6002 5.191113 207.8942 5.191362 -8.294052      7.341519 
1 1 1 -2  10 29 o 48.16567 3.416017 28.46343       3.983516 30.70547       5.468376 25.92845       5.814640 49.91006 4.545918 45.71930 5.318146 4.190765       6.996288 
1 1 1 -2  10 30 o 57.96680 3.274659 41.15505       4.606932 32.26964       5.922447 54.76956       7.331008 51.12790 4.809935 66.76288 4.532894 -15.63498      6.609282 
1 1 1 -2  10 31 o 90.84685 3.000238 100.8647       6.632933 96.73855       9.099752 105.5422       9.688689 88.83484 4.215518 92.78712 4.296569 -3.952286      6.019227 
1 1 1 -2  10 32 o 30.34318 5.614466 11.65814       3.998638 11.75374       4.765814 11.43082       7.349186 30.31956 6.634998 30.21568 9.175710 0.1038876      11.32329 
1 1 1 -2  10 33 o 136.5677 3.146208 227.8685       10.47060 221.5931       14.35925 234.9938       15.30090 134.4310 4.389134 138.4095 4.542593 -3.978516      6.316617 
1 1 1 -2  10 34 o 88.14816 4.102766 95.37556       8.788872 105.5182       11.38250 80.40041       13.83085 92.55331 5.066045 80.29170 7.143235 12.26160       8.757318 
1 1 1 -2  10 35 o 79.04686 3.226400 76.54526       6.201907 80.63116       8.422494 71.70585       9.166278 80.96947 4.283822 76.21884 4.962059 4.750626       6.555392 
1 1 1 -2  10 36 o 53.96939 3.734670 35.86457       4.881453 30.11381       6.253985 44.83046       7.808919 49.15007 5.305486 60.05975 5.392805 -10.90968      7.565086 
1 1 1 -2  10 37 o 23.19884 6.610438 6.874029       3.917814 9.905904       4.995132 2.027465       6.315508 27.64551 7.305741 19.96757 8.169147 7.677942       10.95942 
1 1 1 -2  10 38 o 105.7630 4.663002 138.4090       11.98855 0.000000       0.000000 138.4090       11.98855 ?        ?        105.7630 4.663002 0.000000       4.663002 
1 1 1 -2  10 39 o 57.78855 3.663656 41.28913       5.132761 36.82900       6.783915 47.26094       7.849826 54.15825 5.204178 61.37685 5.300188 -7.218601      7.428019 
1 1 1 -2  10 40 o 60.86356 3.616378 45.91812       5.339552 45.65533       6.984025 46.28782       8.283786 60.30403 4.791890 60.36040 5.699190 -0.5636597E-01 7.446003 
1 1 1 -2  10 41 o 60.52282 3.566869 45.56752       5.237362 39.33465       6.775819 54.81812       8.254725 55.63714 5.052639 65.67197 5.200488 -10.03484      7.250810 
1 1 1 -2  10 42 o 90.92567 3.690651 103.4196       8.160602 95.24955       9.614252 124.4771       15.43493 86.65725 4.568901 97.12598 6.559765 -10.46873      7.994083 
1 1 1 -2  10 43 o 14.96809 6.130208 1.518261       3.561039 2.383160       4.418123 -0.8549557E-01 6.016226 16.97856 6.874843 16.93345 7.468314 0.4510880E-01  10.15082 
1 1 1 -2  10 44 o 12.93499 5.850049 -1.221670      3.945274 1.192248       4.469279 -9.743073      8.397145 15.63268 6.664470 15.08988 7.319993 0.5428047      9.899366 
1 1 1 -2  10 45 o 20.86140 6.733345 6.456381       3.896687 8.749743       4.993507 2.885161       6.231287 23.61494 7.622316 18.23381 7.823528 5.381126       10.92279 
1 1 1 -2  10 46 o 12.91971 5.711514 0.2122415      3.538483 3.011207       4.711929 -3.407630      5.358541 16.62212 6.951157 13.14246 6.232348 3.479657       9.335992 
1 1 1 -2  10 47 o 9.486549 4.670606 -6.210434      3.812325 -9.345303      5.718582 -3.702690      5.114703 11.17018 5.539520 12.42064 5.945122 -1.250463      8.125932 
1 1 1 -2  10 48 o 13.06416 5.951842 0.1573509      4.176345 -2.650185      7.745340 1.308243       4.959012 14.71661 7.112764 14.54057 6.569117 0.1760426      9.682185 
1 1 1 -2  10 49 o 13.75558 6.100461 1.864596       4.068408 1.808636       5.272293 1.946965       6.396494 14.45274 6.623354 15.05994 7.037022 -0.6072006     9.663773 
1 1 1 -2  10 50 o 13.94637 6.270172 2.412463       4.455541 5.017050       5.385575 -3.236866      7.931605 15.94690 7.048177 13.41737 6.630482 2.529537       9.676782 
1 1 1 -2  11 1  o 245.5445 3.557325 734.9446       21.28580 707.2521       32.84773 754.9914       27.94775 240.7971 5.597807 248.8342 4.608935 -8.037094      7.251050 
1 1 1 -2  11 2  o 795.4582 11.43711 7744.117       221.7021 7126.024       418.6142 7985.067       261.3667 757.8108 22.69377 807.1119 13.28864 -49.30115      26.29819 
1 1 1 -2  11 3  o 450.9350 5.954337 2480.583       65.43098 2446.033       102.2413 2504.548       85.15190 447.3876 9.377913 452.9241 7.714944 -5.536499      12.14354 
1 1 1 -2  11 4  o 185.5855 2.679733 419.7573       12.11913 401.1144       16.74119 440.2839       17.56668 181.3958 3.787241 190.0462 3.793102 -8.650391      5.360114 
1 1 1 -2  11 5  o 300.3088 3.803307 1099.380       27.83335 1059.997       38.44685 1142.752       40.34644 294.8123 5.351543 306.1012 5.408839 -11.28882      7.608847 
1 1 1 -2  11 6  o 356.5263 5.387159 1550.162       46.80449 1578.200       67.27480 1523.860       65.15899 359.5707 7.677715 353.3353 7.567480 6.235443       10.78026 
1 1 1 -2  11 7  o 331.0662 5.046135 1336.453       40.71082 1378.008       58.92461 1298.501       56.31181 336.0468 7.195497 326.2158 7.083671 9.830994       10.09721 
1 1 1 -2  11 8  o 375.6021 5.647537 1720.359       51.69198 1653.608       71.34331 1794.131       75.00075 368.0943 7.953496 383.4100 8.027237 -15.31564      11.30020 
1 1 1 -2  11 9  o 286.9531 5.209367 1003.916       36.42772 927.9260       60.83776 1046.387       45.48220 275.5570 9.072313 292.9150 6.371825 -17.35794      11.08634 
1 1 1 -2  11 10 o 432.5734 7.413342 2282.469       78.14658 2180.505       132.1517 2337.295       96.90526 422.1398 12.86137 437.6168 9.086931 -15.47705      15.74761 
1 1 1 -2  11 11 o 600.7086 12.37909 4408.865       181.2126 4821.317       272.2484 4080.771       242.8163 627.0051 17.83609 576.9184 17.29090 50.08667       24.84153 
1 1 1 -2  11 12 o 321.6891 4.944657 1261.406       38.76222 1270.051       55.20142 1252.997       54.44257 322.7232 7.019140 320.5511 6.969559 2.172180       9.891566 
1 1 1 -2  11 13 o 752.2750 10.81080 6908.349       198.1848 7230.102       289.0554 6622.922       272.2503 768.8474 15.42783 735.9002 15.18145 32.94714       21.64473 
1 1 1 -2  11 14 o 326.5669 5.015329 1299.959       39.91238 1310.568       56.91819 1289.696       55.98268 327.8278 7.124743 325.2091 7.064068 2.618683       10.03310 
1 1 1 -2  11 15 o 407.4516 6.993702 2024.545       69.44153 2022.880       119.6800 2025.390       85.26134 406.7626 12.08722 407.4487 8.587032 -0.6861572     14.82694 
1 1 1 -2  11 16 o 323.3289 4.983917 1274.377       39.26914 1257.676       55.27269 1291.399       55.80099 321.1276 7.063126 325.4057 7.036888 -4.278107      9.970233 
1 1 1 -2  11 17 o 418.2285 6.231757 2132.947       63.51265 2206.002       91.99908 2066.424       87.78960 425.1557 8.879724 411.4951 8.754722 13.66061       12.46975 
1 1 1 -2  11 18 o 171.7836 3.221479 359.6449       13.48568 345.4056       18.89157 374.4402       19.25695 168.2642 4.611584 175.2030 4.514104 -6.938858      6.453204 
1 1 1 -2  11 19 o 418.2693 6.247082 2133.902       63.67504 2213.950       92.36570 2061.407       87.90037 425.8117 8.901374 410.8925 8.778622 14.91916       12.50195 
1 1 1 -2  11 20 o 294.9969 6.580799 1061.823       47.30773 1154.180       72.14198 992.1455       62.66170 307.1602 9.649973 284.8339 9.039086 22.32626       13.22222 
1 1 1 -2  11 21 o 384.9651 6.746385 1809.069       63.28905 1770.385       76.24899 1894.750       113.4788 380.6560 8.219877 393.0387 11.86153 -12.38275      14.43129 
1 1 1 -2  11 22 o 203.2292 3.585671 503.5803       17.75794 481.1335       24.65135 527.7931       25.60270 198.5151 5.100010 207.9892 5.051368 -9.474091      7.178190 
1 1 1 -2  11 23 o 165.1457 3.218024 332.5327       12.95068 339.8487       18.62337 325.6820       18.02151 166.8318 4.585171 163.3189 4.532512 3.512894       6.447283 
1 1 1 -2  11 24 o 103.1484 2.819138 129.8182       7.079578 128.5792       9.999467 131.0635       10.02465 102.5813 4.007826 103.5711 3.979268 -0.9897766     5.647765 
1 1 1 -2  11 25 o 221.3005 3.816020 597.5947       20.57923 615.1084       29.60503 581.2196       28.62649 224.3536 5.414972 218.0892 5.386391 6.264420       7.637744 
1 1 1 -2  11 26 o 271.5914 4.409335 900.8306       29.18268 877.0815       40.69656 925.9683       41.86952 267.6777 6.238920 275.0348 6.247039 -7.357117      8.828909 
1 1 1 -2  11 27 o 288.4938 6.547335 1019.992       46.02959 0.000000       0.000000 1019.992       46.02959 ?        ?        288.4938 6.547335 0.000000       6.547335 
1 1 1 -2  11 28 o 237.5194 4.033752 689.1017       23.34772 687.6029       32.97625 690.6083       33.06123 236.9660 5.710567 237.4828 5.712822 -0.5168152     8.077556 
1 1 1 -2  11 29 o 206.2947 3.695784 519.7912       18.57936 528.5790       26.41744 511.1902       26.13520 207.7175 5.223075 204.2633 5.254847 3.454178       7.409044 
1 1 1 -2  11 30 o 99.50236 2.918590 120.9429       7.069244 117.6791       9.735847 124.5826       10.28128 98.02888 4.084474 100.8548 4.192399 -2.825897      5.853131 
1 1 1 -2  11 31 f 122.3108 3.409396 182.8981       10.15207 175.9511       12.31827 197.6073       17.92459 119.8542 4.224156 126.7354 5.819370 -6.881142      7.190866 
1 1 1 -2  11 32 o 73.85618 3.064639 66.73615       5.503737 67.89568       7.503609 65.38590       8.097154 74.36952 4.156912 72.91891 4.579891 1.450615       6.185088 
1 1 1 -2  11 33 o 122.0998 3.105156 182.2675       9.231703 167.7665       12.39056 200.3613       13.84067 116.9445 4.355464 127.7967 4.451077 -10.85214      6.227532 
1 1 1 -2  11 34 o 20.33684 6.861624 4.786175       4.031808 5.490448       4.574049 2.332851       8.537043 21.71769 7.308434 22.98331 9.460755 -1.265623      11.95488 
1 1 1 -2  11 35 o 57.56413 3.607702 40.73257       5.035348 36.35202       6.567372 46.98087       7.843473 54.13224 5.036284 61.54877 5.280391 -7.416527      7.297032 
1 1 1 -2  11 36 o 25.73059 6.350875 8.530213       3.957677 8.473602       5.051428 8.620201       6.368755 25.79680 7.553696 26.51319 8.612263 -0.7163849     11.45554 
1 1 1 -2  11 37 o 34.38308 5.670424 15.02052       4.585648 13.44642       6.340082 16.74732       6.640515 32.04499 8.112536 35.83085 7.824877 -3.785866      11.27129 
1 1 1 -2  11 38 o 25.54342 7.698163 8.375604       5.186727 6.887474       10.50202 8.855682       5.964974 27.52726 10.77615 26.39398 8.310154 1.133272       13.60824 
1 1 1 -2  11 39 o 19.55390 6.764244 4.456998       3.923124 4.688220       5.164881 4.141654       6.031698 20.95812 7.703276 21.24814 8.208974 -0.2900219     11.25734 
1 1 1 -2  11 40 o 12.69248 5.607933 -0.8551497     3.406734 -2.216545      4.299455 1.441556       5.584367 13.36583 6.069574 18.16640 7.579967 -4.800575      9.710593 
1 1 1 -2  11 41 o 43.04002 4.684563 23.56417       4.834162 16.59886       5.518657 46.53380       10.02167 35.26289 6.666312 59.27087 7.078200 -24.00798      9.723201 
1 1 1 -2  11 42 o 52.01339 3.836160 34.09945       4.828156 35.19268       6.246610 32.47717       7.609409 52.27143 4.963406 49.27889 6.494504 2.992538       8.173982 
1 1 1 -2  11 43 o 39.77068 5.020421 20.79742       4.757424 14.87919       5.447014 39.83252       9.768779 32.38636 7.098123 52.78963 7.830756 -20.40327      10.56902 
1 1 1 -2  11 44 o 19.15670 6.683734 5.005024       3.834281 4.720869       4.766955 5.525780       6.453269 19.26062 7.333822 20.94395 8.368264 -1.683325      11.12712 
1 1 1 -2  11 45 o 21.81170 6.551213 7.163516       3.760992 4.809577       4.734701 11.18857       6.191288 18.80013 7.270391 25.67293 8.499987 -6.872795      11.18518 
1 1 1 -2  11 46 o 19.04606 6.866264 5.616061       4.075598 3.273790       5.786457 7.921948       5.741338 17.42041 7.507586 21.44728 8.075219 -4.026873      11.02602 
1 1 1 -2  11 47 f 15.09475 6.262002 2.650523       3.779705 1.106759       5.068168 4.585099       5.673532 14.89315 6.692299 17.75609 7.537048 -2.862947      10.07938 
1 1 1 -2  11 48 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -2  11 49 o 11.66461 5.404274 -0.3671518     3.648693 4.674722       5.271268 -5.004808      5.055550 16.18793 7.069257 11.07389 5.437460 5.114038       8.918541 
1 1 1 -2  11 50 o 11.62803 5.540594 -1.187568      4.337253 -0.5349234     5.213983 -2.653727      7.814868 12.65159 6.041180 13.39570 6.612658 -0.7441063     8.956735 
1 1 1 -2  12 1  o 596.9396 8.660367 4351.773       125.9803 4113.939       171.3771 4631.398       185.8248 579.7579 12.13026 615.0782 12.39759 -35.32025      17.34484 
1 1 1 -2  12 2  f 336.5761 5.135422 1381.402       42.12069 1399.202       60.02435 1364.134       59.12123 338.6013 7.274493 334.3326 7.256525 4.268738       10.27499 
1 1 1 -2  12 3  o 357.9375 5.419556 1562.423       47.27232 1531.065       66.08714 1595.278       67.64645 354.1738 7.657102 361.5228 7.678443 -7.349060      10.84388 
1 1 1 -2  12 4  o 429.5308 6.370262 2250.608       66.67878 2208.391       93.15826 2294.955       95.48069 425.2382 8.989863 433.4868 9.038651 -8.248596      12.74813 
1 1 1 -2  12 5  o 415.6767 7.139264 2108.224       72.31779 2109.075       88.76848 2106.546       124.7046 415.6152 8.764584 414.7599 12.35190 0.8552856      15.14554 
1 1 1 -2  12 6  o 73.61773 3.731316 66.22695       6.672091 55.57031       9.657550 75.95793       9.228582 67.24110 5.955323 78.78510 4.830000 -11.54400      7.667775 
1 1 1 -2  12 7  o 320.1706 5.704568 1249.948       44.50822 1250.976       77.55450 1249.443       54.34936 319.9048 9.960467 320.0473 6.968578 -0.1425781     12.15615 
1 1 1 -2  12 8  o 652.4406 10.89554 5199.349       173.2311 4969.336       291.3922 5325.075       215.4349 636.0363 18.82080 659.8698 13.39744 -23.83356      23.10224 
1 1 1 -2  12 9  o 192.2933 3.388329 450.6375       15.87763 521.7410       35.30248 432.6071       17.77713 206.7168 7.018166 188.4009 3.872063 18.31583       8.015455 
1 1 1 -2  12 10 o 163.9904 3.662121 327.7497       14.63482 310.2597       17.37473 370.4615       27.15170 159.4832 4.475038 174.1901 6.407345 -14.70697      7.815372 
1 1 1 -2  12 11 o 583.7278 8.479571 4156.545       120.6203 4155.256       170.8270 4157.826       170.3397 583.2950 12.01800 583.4797 11.97993 -0.1847534     16.96912 
1 1 1 -2  12 12 o 409.8852 6.116141 2048.284       61.09080 2034.024       86.29189 2062.612       86.49936 408.3326 8.672009 411.1944 8.632361 -2.861755      12.23607 
1 1 1 -2  12 13 o 324.4990 5.002730 1283.545       39.56003 1229.741       54.68634 1342.609       57.29763 317.5602 7.066700 331.8127 7.086104 -14.25250      10.00755 
1 1 1 -2  12 14 o 547.4010 9.194974 3656.387       122.6569 3697.799       213.6277 3636.022       149.8116 549.4542 15.97170 545.6746 11.26615 3.779602       19.54536 
1 1 1 -2  12 15 o 522.1232 7.639784 3325.245       97.20535 3475.230       141.6964 3191.912       133.5989 533.4688 10.89968 511.2792 10.72281 22.18964       15.28992 
1 1 1 -2  12 16 o 42.47992 3.482617 22.14046       3.573545 20.37160       6.168575 23.03395       4.384157 40.36554 6.491045 43.26717 4.211291 -2.901627      7.737483 
1 1 1 -2  12 17 o 275.4279 4.396428 924.7236       29.50829 968.1599       43.13934 886.5300       40.45221 281.7583 6.282909 269.6234 6.156708 12.13489       8.796590 
1 1 1 -2  12 18 o 331.0241 5.104212 1336.039       41.17413 1361.299       59.17134 1312.326       57.33030 334.0226 7.269414 327.9652 7.173322 6.057404       10.21278 
1 1 1 -2  12 19 o 95.80724 3.887608 112.0774       9.057618 98.92145       14.77226 120.0032       11.46583 89.78349 6.802333 99.09279 4.762121 -9.309296      8.303585 
1 1 1 -2  12 20 o 369.2167 6.511173 1663.674       58.58369 1598.236       69.66195 1821.751       108.2718 361.7450 7.902363 385.5266 11.53755 -23.78162      13.98437 
1 1 1 -2  12 21 o 219.3359 4.409612 586.7196       23.56927 589.5908       28.64933 580.7072       41.45852 219.8236 5.348155 217.8522 7.822062 1.971451       9.475621 
1 1 1 -2  12 22 o 305.4106 4.796853 1138.082       35.70069 1143.934       50.83217 1132.386       50.15150 305.9796 6.817265 304.4384 6.760026 1.541138       9.600679 
1 1 1 -2  12 23 o 121.7484 2.915642 180.7204       8.650344 166.2339       12.06911 196.0236       12.40466 116.6480 4.252942 126.6986 4.022792 -10.05057      5.854090 
1 1 1 -2  12 24 f 64.04214 2.974815 50.12175       4.629922 53.67550       6.618704 46.71652       6.478932 66.19229 4.123746 61.71529 4.335573 4.477001       5.983518 
1 1 1 -2  12 25 o 136.2626 3.003531 226.4608       9.973435 219.7753       13.98664 233.3768       14.22553 134.0988 4.285587 138.1955 4.229118 -4.096756      6.020938 
1 1 1 -2  12 26 o 295.0815 6.658653 1066.950       47.88113 0.000000       0.000000 1066.950       47.88113 ?        ?        295.0815 6.658653 0.000000       6.658653 
1 1 1 -2  12 27 o 205.4341 4.330395 515.6086       21.67885 515.2927       39.27023 515.7472       25.99957 204.5862 7.891621 205.2746 5.201696 -0.6884003     9.451736 
1 1 1 -2  12 28 o 86.63417 2.866198 91.67278       6.042730 92.33259       8.503191 90.99961       8.588876 86.84331 4.028976 86.20543 4.100268 0.6378784      5.748465 
1 1 1 -2  12 29 o 200.4046 3.644253 490.5625       17.79723 492.0543       25.19033 489.0757       25.14790 200.3950 5.162651 199.7856 5.169713 0.6093903      7.306087 
1 1 1 -2  12 30 o 81.71999 2.989297 81.63139       5.942935 80.91608       8.142083 82.44701       8.694219 81.24261 4.126102 81.97961 4.367763 -0.7369919     6.008500 
1 1 1 -2  12 31 f 120.0848 3.409995 176.3292       9.968685 173.5106       12.31616 181.6833       16.97494 119.0029 4.253836 121.5032 5.749341 -2.500259      7.151926 
1 1 1 -2  12 32 o 164.4291 3.343120 330.4129       13.39574 328.9694       18.77687 331.9092       19.11658 163.7634 4.710009 164.4790 4.774452 -0.7155762     6.706681 
1 1 1 -2  12 33 o 102.2237 3.058380 127.7959       7.610102 122.3606       10.27745 134.3933       11.32298 99.85399 4.233214 104.6184 4.451541 -4.764374      6.142990 
1 1 1 -2  12 34 o 68.07098 3.837355 56.92346       6.339689 53.67610       7.198339 68.15128       13.38488 65.99100 4.503204 73.70026 7.559659 -7.709259      8.799278 
1 1 1 -2  12 35 o 86.05354 3.186292 90.71875       6.670214 80.87144       8.866507 103.5582       10.12436 81.01711 4.508749 91.70189 4.544733 -10.68478      6.401829 
1 1 1 -2  12 36 o 35.54716 4.843623 15.84443       4.086731 12.94656       5.383857 19.78421       6.277546 31.61118 7.156208 39.34058 6.793592 -7.729399      9.867331 
1 1 1 -2  12 37 o 40.79276 4.830426 20.82584       4.708734 18.70826       6.535700 23.11133       6.789883 38.00216 7.322991 42.49989 6.783943 -4.497723      9.982388 
1 1 1 -2  12 38 o 74.44507 5.008418 69.07079       9.033124 0.000000       0.000000 69.07079       9.033124 ?        ?        74.44507 5.008418 0.000000       5.008418 
1 1 1 -2  12 39 o 34.70778 5.124881 15.34530       4.204360 13.32306       5.491164 18.21046       6.536157 31.68555 7.266669 37.08437 7.490812 -5.398815      10.43632 
1 1 1 -2  12 40 o 50.94894 3.818985 32.37775       4.707034 26.80871       6.292503 39.45302       7.092587 45.63918 5.787798 55.70896 5.287801 -10.06978      7.839608 
1 1 1 -2  12 41 f 62.10957 4.438329 48.76229       6.673326 51.02263       8.446866 45.00858       10.88526 62.90239 5.567964 57.43272 7.993918 5.469669       9.741918 
1 1 1 -2  12 42 o 26.17370 6.058162 9.327544       3.787562 9.065394       4.752605 9.783850       6.270253 25.42578 7.292257 26.18919 8.548090 -0.7634106     11.23596 
1 1 1 -2  12 43 o 39.82822 4.505091 20.66411       4.295833 16.05748       5.390752 28.67952       7.110830 33.70574 6.797963 45.44798 6.614469 -11.74224      9.484909 
1 1 1 -2  12 44 o 19.19703 6.787551 5.094194       3.963356 7.284743       4.467177 -3.006970      8.590737 22.14478 7.214250 17.38418 8.133524 4.760592       10.87196 
1 1 1 -2  12 45 o 39.83392 4.589313 21.52014       4.373559 21.89155       5.532357 20.90122       7.141574 38.82332 6.044325 35.25376 8.427487 3.569561       10.37094 
1 1 1 -2  12 46 o 17.54238 6.703109 4.491441       3.991259 2.903302       5.737846 5.980271       5.555552 16.98955 7.398111 19.40866 7.761196 -2.419109      10.72232 
1 1 1 -2  12 47 o 16.89793 6.723014 4.311430       4.147717 2.227990       4.853396 9.954244       7.987356 15.38979 6.750375 21.34253 8.995387 -5.952736      11.24654 
1 1 1 -2  12 48 o 10.14225 4.989690 -5.738785      4.324222 -5.673366      8.379790 -5.762527      5.048295 13.91893 6.866532 11.04963 5.427157 2.869302       8.752331 
1 1 1 -2  12 49 o 14.98364 6.507965 3.471175       4.416464 -0.5686170     5.268458 13.02056       8.100127 12.97715 6.161435 20.37370 8.831542 -7.396556      10.76845 
1 1 1 -2  12 50 o 12.96927 5.857234 1.662733       3.938505 -1.003315      5.528751 4.409629       5.611955 12.59570 6.068178 15.30514 6.943975 -2.709443      9.221798 
1 1 1 -2  13 1  o 346.7324 7.482015 1466.859       63.21920 1343.569       84.26261 1625.631       95.62174 331.4633 10.44494 364.5903 10.77438 -33.12704      15.00613 
1 1 1 -2  13 2  o 192.0478 3.398587 449.5162       15.90537 435.7613       31.23881 454.3300       18.48011 188.8860 6.797783 193.0643 3.927954 -4.178284      7.851030 
1 1 1 -2  13 3  o 205.7247 3.170954 515.7995       15.89690 531.6714       25.48315 505.6880       20.33975 208.8292 5.007555 203.6822 4.097855 5.147064       6.470550 
1 1 1 -2  13 4  o 569.3067 8.277892 3955.162       114.8424 4089.618       165.9626 3831.628       159.0793 578.4498 11.77357 559.9240 11.65866 18.52588       16.56929 
1 1 1 -2  13 5  o 344.6604 4.696934 1448.074       39.44954 1400.515       61.07022 1482.130       51.67863 338.8369 7.396099 348.6349 6.082806 -9.798035      9.576159 
1 1 1 -2  13 6  o 563.0117 6.685390 3865.652       91.72343 3801.348       128.2512 3932.982       131.2332 558.0666 9.430601 567.6409 9.487110 -9.574280      13.37690 
1 1 1 -2  13 7  o 855.7662 10.96094 8942.778       228.5804 8729.455       355.5822 9093.014       298.4059 844.1186 17.28624 862.2814 14.20111 -18.16284      22.37153 
1 1 1 -2  13 8  o 122.0969 2.493581 181.6608       7.419318 175.0735       11.81418 185.9506       9.533797 119.7837 4.053177 123.4853 3.170837 -3.701599      5.146110 
1 1 1 -2  13 9  o 753.2346 9.678346 6923.552       177.6509 7089.184       285.6583 6819.091       226.8569 761.3035 15.39760 747.1565 12.45961 14.14697       19.80727 
1 1 1 -2  13 10 o 291.8134 4.099179 1037.844       29.14998 1011.761       45.61792 1055.844       37.89628 288.0654 6.498429 294.3073 5.283958 -6.241974      8.375547 
1 1 1 -2  13 11 o 590.9710 8.580606 4260.374       123.5720 4113.993       170.8303 4421.034       178.9681 580.3961 12.07826 601.6500 12.20662 -21.25385      17.17225 
1 1 1 -2  13 12 o 307.3266 5.504192 1151.392       41.22206 1171.844       71.88900 1141.374       50.31581 309.7432 9.535470 305.9481 6.748708 3.795074       11.68205 
1 1 1 -2  13 13 o 433.7134 7.420197 2294.184       78.42497 2272.124       134.6226 2305.516       96.48837 431.0231 12.83114 434.6777 9.109016 -3.654602      15.73570 
1 1 1 -2  13 14 o 400.2254 5.999164 1953.020       58.51019 1954.671       82.99340 1951.390       82.50061 400.2587 8.508768 399.9254 8.465295 0.3333130      12.00251 
1 1 1 -2  13 15 o 336.2943 5.168142 1378.729       42.35357 1403.520       60.77204 1355.317       59.05869 339.2108 7.351873 333.3389 7.270456 5.871887       10.33971 
1 1 1 -2  13 16 o 269.5456 4.332630 885.6315       28.45901 879.1702       40.29403 892.0629       40.20039 268.5030 6.158225 270.4667 6.099305 -1.963776      8.667482 
1 1 1 -2  13 17 o 326.6430 5.053168 1300.873       40.22289 1312.926       57.42238 1289.261       56.36000 328.0441 7.183115 325.0783 7.114540 2.965790       10.11009 
1 1 1 -2  13 18 o 246.5800 5.760190 741.5681       34.61233 700.1992       49.42348 781.3863       48.48836 239.3157 8.488176 252.8829 7.877929 -13.56720      11.58063 
1 1 1 -2  13 19 o 496.4504 7.311067 3008.839       88.44895 3037.674       126.1732 2980.977       124.0259 498.3323 10.38992 493.6746 10.30945 4.657684       14.63677 
1 1 1 -2  13 20 o 388.9494 6.823314 1847.173       64.67323 1867.450       79.52769 1807.579       111.1298 390.8739 8.349214 383.7545 11.89778 7.119415       14.53501 
1 1 1 -2  13 21 o 312.4883 4.893754 1191.406       37.26594 1212.436       53.57074 1171.688       51.87418 315.0146 6.978480 309.6884 6.873695 5.326202       9.795247 
1 1 1 -2  13 22 o 346.0290 5.326855 1461.799       44.91790 1458.453       63.62069 1465.124       63.42678 345.2879 7.561028 346.0839 7.520647 -0.7959595     10.66439 
1 1 1 -2  13 23 o 207.9225 3.657111 527.3607       18.53001 531.7438       26.49774 523.1658       25.92251 208.6614 5.211115 206.9781 5.139450 1.683289       7.319130 
1 1 1 -2  13 24 o 210.3263 3.693901 539.7677       18.93280 536.8091       26.88653 542.6777       26.66490 209.5303 5.269828 210.7474 5.192084 -1.217041      7.397893 
1 1 1 -2  13 25 o 183.0231 3.855792 408.8810       17.19711 409.8736       28.84198 408.3334       21.42151 182.8328 6.483700 182.7461 4.814423 0.8665466E-01  8.075706 
1 1 1 -2  13 26 o 81.35153 3.563164 80.93063       7.046655 91.65491       14.46616 77.59435       8.068637 86.17521 6.947503 79.59898 4.174236 6.576225       8.105063 
1 1 1 -2  13 27 o 119.2844 2.942026 173.5988       8.551970 176.8206       12.17920 170.4653       12.01118 120.2353 4.162999 118.0501 4.181863 2.185196       5.900723 
1 1 1 -2  13 28 o 164.2617 3.288522 329.3829       13.16356 332.6099       18.70974 326.2198       18.52382 164.8420 4.662302 163.2497 4.661081 1.592239       6.592627 
1 1 1 -2  13 29 o 71.80778 3.007338 63.04914       5.250823 64.91880       7.301370 61.04637       7.556783 72.75440 4.135243 70.51020 4.420173 2.244202       6.052947 
1 1 1 -2  13 30 o 156.9529 3.710227 301.0736       14.19077 290.2861       17.31920 323.1110       24.75407 153.9174 4.622708 162.0164 6.281672 -8.098984      7.799284 
1 1 1 -2  13 31 o 98.80740 2.995430 119.3318       7.204154 123.3240       10.07234 115.1504       10.30818 100.3073 4.129441 96.88451 4.377385 3.422829       6.017788 
1 1 1 -2  13 32 o 80.95535 3.111347 80.18722       6.126619 78.06593       8.265483 82.77385       9.127157 79.72851 4.269779 82.05609 4.582657 -2.327583      6.263526 
1 1 1 -2  13 33 o 175.4654 3.467300 376.5676       14.82583 351.5348       20.19015 405.8607       21.84077 169.1425 4.903536 181.7427 4.936024 -12.60019      6.957657 
1 1 1 -2  13 34 o 84.15717 3.694344 86.89458       7.557967 83.28472       8.663589 98.39206       15.46156 82.27913 4.336186 88.73872 7.212087 -6.459595      8.415267 
1 1 1 -2  13 35 o 82.23470 3.201299 82.87960       6.403053 82.81263       8.692514 82.95905       9.467627 81.99727 4.365945 81.98737 4.759145 0.9895325E-02  6.458400 
1 1 1 -2  13 36 o 57.98483 3.961885 41.48751       5.564617 37.27555       7.879382 45.67854       7.859769 54.48558 6.035459 60.54784 5.382959 -6.062260      8.087214 
1 1 1 -2  13 37 o 88.35241 3.154891 95.83679       6.781740 90.83815       9.295203 101.5261       9.916583 85.68841 4.466865 90.58978 4.506219 -4.901367      6.344989 
1 1 1 -2  13 38 o 73.65492 4.223720 67.27170       7.549325 61.83208       14.07211 69.46989       8.945580 68.76980 8.583383 74.61371 4.947821 -5.843910      9.907340 
1 1 1 -2  13 39 o 58.06862 3.684680 41.84172       5.187185 42.06818       6.988741 41.56394       7.740265 57.78822 5.012281 57.19809 5.625862 0.5901337      7.534805 
1 1 1 -2  13 40 o 28.13392 6.138553 10.49829       4.089954 9.627056       4.756318 12.97056       8.012232 26.69980 7.162531 30.50029 9.634962 -3.800488      12.00560 
1 1 1 -2  13 41 o 16.17876 6.239345 2.498231       3.479995 3.494404       4.308251 0.6280321      5.903063 18.30451 6.971502 17.59398 7.582623 0.7105331      10.30039 
1 1 1 -2  13 42 o 62.76741 3.485904 49.53971       5.311002 43.97687       6.757749 58.52629       8.589167 58.32514 4.796917 66.91197 5.311122 -8.586830      7.156705 
1 1 1 -2  13 43 o 24.98545 6.279736 8.849890       3.818596 6.704445       4.745337 12.79168       6.432134 21.73753 7.442483 28.66173 8.557801 -6.924200      11.34136 
1 1 1 -2  13 44 o 27.76487 6.022449 11.08332       3.957307 12.30456       4.913934 8.829732       6.675219 28.46498 7.106422 23.46146 8.733007 5.003521       11.25907 
1 1 1 -2  13 45 o 12.38116 5.740014 -1.777899      4.126278 -2.262748      4.892417 -0.5831616     7.679912 13.16868 6.153629 16.78134 7.797443 -3.612657      9.933140 
1 1 1 -2  13 46 o 9.085844 4.455714 -5.309351      3.361663 -5.816289      4.468117 -4.648077      5.103137 10.70256 5.224765 12.05198 5.812170 -1.349416      7.815337 
1 1 1 -2  13 47 o 15.00303 6.224135 2.840360       3.734286 4.791986       5.158235 0.6910839      5.413136 17.37195 7.269397 14.61674 6.703247 2.755215       9.888258 
1 1 1 -2  13 48 o 14.34713 6.333498 2.253004       4.336283 4.322007       7.764737 1.315278       5.227382 16.73075 7.796312 14.27595 6.561790 2.454797       10.19017 
1 1 1 -2  13 49 o 12.88954 5.811233 1.289981       3.857631 -5.276280      5.308877 8.635362       5.615014 11.11235 5.478833 18.90291 7.714504 -7.790567      9.462092 
1 1 1 -2  14 1  o 437.5871 7.505256 2335.605       80.03246 2268.816       135.8035 2371.143       99.06286 430.6371 12.95560 440.7836 9.222513 -10.14651      15.90290 
1 1 1 -2  14 2  o 326.7628 5.035686 1301.602       40.09843 1321.682       57.22333 1282.229       56.20584 329.1949 7.133193 324.2453 7.113308 4.949585       10.07381 
1 1 1 -2  14 3  o 248.8421 4.700098 754.7966       28.50144 848.7570       52.93130 716.4295       33.82357 263.6367 8.249078 242.4114 5.725723 21.22533       10.04147 
1 1 1 -2  14 4  o 414.1477 5.526682 2090.994       55.77709 1974.699       84.90950 2179.270       73.97715 402.3069 8.660892 422.7203 7.181388 -20.41336      11.25093 
1 1 1 -2  14 5  o 353.3592 4.392453 1521.887       37.82331 1498.234       52.94972 1546.530       54.04767 350.5452 6.198457 356.1492 6.227430 -5.604034      8.786452 
1 1 1 -2  14 6  o 430.0228 5.217860 2254.154       54.67893 2188.944       75.82769 2324.791       78.92037 423.6642 7.344631 436.6087 7.417552 -12.94455      10.43857 
1 1 1 -2  14 7  o 395.1390 5.944011 1903.494       57.23552 1871.358       80.09029 1937.036       81.82404 391.6794 8.390987 398.4915 8.426084 -6.812164      11.89149 
1 1 1 -2  14 8  o 389.2633 5.865344 1847.256       55.63820 1792.600       77.38916 1905.731       80.04672 383.3586 8.283976 395.2691 8.310259 -11.91049      11.73391 
1 1 1 -2  14 9  f 597.4725 7.756279 4353.654       112.9295 4297.375       177.3418 4392.041       146.4645 593.1761 12.26849 599.9108 10.01866 -6.734680      15.83949 
1 1 1 -2  14 10 o 596.3569 7.744116 4337.487       112.5419 4611.313       185.7241 4178.598       141.4744 614.4285 12.40397 585.1511 9.921416 29.27740       15.88374 
1 1 1 -2  14 11 o 372.1950 5.033714 1688.619       45.65572 1755.260       74.28194 1648.160       57.87868 379.3435 8.035530 367.6585 6.460080 11.68494       10.31030 
1 1 1 -2  14 12 o 51.78401 3.512573 32.83102       4.406351 34.21449       8.016403 32.23207       5.274642 52.58680 6.386322 51.24791 4.262122 1.338886       7.677942 
1 1 1 -2  14 13 o 415.3144 6.212337 2103.183       62.87356 2198.767       91.79256 2018.705       86.29514 424.4860 8.873767 406.7451 8.706185 17.74094       12.43147 
1 1 1 -2  14 14 o 228.0271 3.857904 633.7391       21.43749 619.7299       30.26699 647.8416       30.36763 225.4571 5.508954 230.5166 5.405958 -5.059433      7.718352 
1 1 1 -2  14 15 o 367.0005 5.585195 1642.269       49.95064 1631.506       70.70830 1652.992       70.57364 365.6651 7.935070 368.0694 7.868225 -2.404236      11.17472 
1 1 1 -2  14 16 o 354.3795 5.419148 1531.328       46.79890 1499.454       65.54531 1564.474       66.84100 350.5403 7.673041 358.0607 7.660378 -7.520325      10.84237 
1 1 1 -2  14 17 o 189.3008 4.847937 437.2163       22.34539 429.2420       33.52235 443.5929       29.97644 187.3998 7.354843 190.5780 6.463982 -3.178253      9.791669 
1 1 1 -2  14 18 o 344.4428 5.301974 1447.019       44.50317 1507.988       64.73841 1392.394       61.27802 351.4433 7.559109 337.7151 7.445915 13.72818       10.61046 
1 1 1 -2  14 19 o 154.1713 3.744395 289.7877       14.06764 304.1519       17.28288 261.5865       24.21632 157.8607 4.497268 146.2160 6.815123 11.64473       8.165251 
1 1 1 -2  14 20 o 416.9923 7.269009 2124.738       73.86511 2225.460       92.89960 1951.614       121.7953 426.4493 8.939441 398.3206 12.56334 28.12863       15.41918 
1 1 1 -2  14 21 o 178.9439 3.365689 390.4505       14.67665 385.5774       20.93213 395.1630       20.58408 177.6871 4.838670 179.8953 4.699457 -2.208267      6.745193 
1 1 1 -2  14 22 o 157.9301 3.163057 304.1507       12.17330 319.2175       17.91959 291.2390       16.58862 161.6605 4.553244 154.4196 4.412834 7.240952       6.340751 
1 1 1 -2  14 23 o 201.4662 3.600269 495.1801       17.67556 477.2346       24.76322 513.8197       25.23756 197.5842 5.147411 205.0968 5.049547 -7.512589      7.210670 
1 1 1 -2  14 24 o 40.76767 3.604829 20.43856       3.544401 17.44616       5.081737 23.27335       4.946094 37.33646 5.771180 43.39053 4.755503 -6.054077      7.478056 
1 1 1 -2  14 25 o 41.36597 3.840604 21.06814       3.827281 14.17061       5.830841 26.28945       5.073106 33.34121 7.372519 46.16393 4.569455 -12.82273      8.673751 
1 1 1 -2  14 26 o 172.6138 3.945106 363.8636       16.59473 363.6929       30.65215 363.9344       19.73749 171.9452 7.332178 172.4856 4.700109 -0.5404358     8.709297 
1 1 1 -2  14 27 o 102.3527 2.888964 127.9230       7.198516 123.8210       10.10747 132.1452       10.25460 100.5816 4.132509 103.9213 4.057078 -3.339630      5.791158 
1 1 1 -2  14 28 o 92.51349 2.875401 104.5447       6.474585 100.7210       9.104978 108.4560       9.208796 90.68227 4.131070 94.11896 4.024327 -3.436684      5.767231 
1 1 1 -2  14 29 o 107.8161 3.290320 142.0892       8.634738 145.2259       10.95756 136.9504       14.02531 108.9006 4.136543 105.5472 5.471608 3.353424       6.859262 
1 1 1 -2  14 30 o 77.70917 3.012114 73.84527       5.693201 75.50667       8.052778 72.18501       8.050026 78.44381 4.228234 76.68117 4.325506 1.762642       6.048798 
1 1 1 -2  14 31 o 157.1149 3.270875 301.6239       12.52326 301.3559       17.69650 301.8928       17.72467 156.7548 4.637758 156.8938 4.641024 -0.1390076     6.561090 
1 1 1 -2  14 32 o 43.06720 3.936476 22.89000       4.085701 18.08273       5.419077 29.22195       6.219345 37.85757 6.079810 48.47997 5.353422 -10.62240      8.100816 
1 1 1 -2  14 33 o 99.67265 3.111533 121.5630       7.548388 112.0623       10.14071 133.3682       11.30383 95.49487 4.369224 104.1767 4.462994 -8.681870      6.245673 
1 1 1 -2  14 34 o 35.52315 5.929612 15.98921       4.952214 12.64261       5.527221 29.60965       11.15066 31.27052 7.374003 47.56854 9.940114 -16.29802      12.37666 
1 1 1 -2  14 35 o 191.4688 4.130692 450.1993       19.27334 481.1861       32.96209 434.1017       23.75786 196.4710 6.895314 187.5160 5.204187 8.954941       8.638803 
1 1 1 -2  14 36 o 28.95698 5.807822 10.76434       3.955562 7.571450       5.084488 15.65947       6.295603 24.55498 7.663920 34.64372 7.660843 -10.08874      10.83624 
1 1 1 -2  14 37 o 77.21539 3.191650 73.29063       5.992639 66.39414       8.202562 81.18551       8.776235 73.12798 4.626600 80.94153 4.466711 -7.813553      6.430936 
1 1 1 -2  14 38 o 46.91189 5.266697 27.80753       5.916986 21.42678       10.83452 30.51942       7.063332 39.17984 10.93396 48.90334 6.056322 -9.723503      12.49922 
1 1 1 -2  14 39 o 61.50047 3.874344 47.08178       5.776970 43.79715       7.101581 53.50763       9.932935 58.89535 4.995167 64.44372 6.409898 -5.548370      8.126407 
1 1 1 -2  14 40 o 38.07709 4.470619 18.43679       4.069349 15.56225       5.324368 22.47446       6.310286 34.10102 6.646081 41.21794 6.497343 -7.116920      9.294399 
1 1 1 -2  14 41 o 22.97178 6.343844 7.183595       3.668243 5.730083       4.468087 10.18899       6.424850 21.04146 7.221247 26.78907 8.645935 -5.747608      11.26493 
1 1 1 -2  14 42 o 33.32202 5.153286 14.73904       4.049670 9.550881       5.091050 23.67750       6.682394 25.68275 7.600095 41.20606 6.898433 -15.52331      10.26401 
1 1 1 -2  14 43 o 58.83918 3.720487 44.35065       5.307292 39.90500       6.876213 50.90165       8.347103 54.51830 5.240182 61.15318 5.665604 -6.634880      7.717421 
1 1 1 -2  14 44 o 11.18098 5.198047 -2.059782      3.420116 0.7727325      4.417801 -6.296790      5.403185 14.78878 6.464695 12.20981 5.910738 2.578965       8.759516 
1 1 1 -2  14 45 o 9.727256 4.696769 -4.085395      3.357115 -2.062112      4.366188 -7.011320      5.250562 12.48625 5.827664 11.49480 5.622705 0.9914551      8.097931 
1 1 1 -2  14 46 o 9.589871 4.681099 -4.961602      3.584024 -6.103738      4.807247 -3.532293      5.377750 11.00723 5.383339 12.76319 6.105576 -1.755959      8.139926 
1 1 1 -2  14 47 o 22.14619 6.826544 8.739912       4.048335 18.33689       5.922667 0.3239822      5.546271 31.25828 7.800671 14.34111 6.650784 16.91717       10.25102 
1 1 1 -2  14 48 o 15.40962 6.911362 3.345323       5.377348 5.721049       8.359328 1.668272       7.023383 17.09175 8.005273 15.14463 7.168032 1.947124       10.74547 
1 1 1 -2  14 49 o 16.70464 6.604958 5.536992       3.979926 2.482403       5.561348 8.743621       5.698074 14.42976 6.680728 18.67575 7.712579 -4.245993      10.20372 
1 1 1 -2  15 1  o 316.8683 5.684953 1224.022       43.89769 1217.451       53.51727 1237.534       76.74409 315.9760 6.950303 318.2907 9.906355 -2.314758      12.10135 
1 1 1 -2  15 2  o 401.9131 6.025341 1969.349       59.01329 1905.416       81.63261 2039.337       85.41029 395.2231 8.475890 408.8709 8.572113 -13.64783      12.05495 
1 1 1 -2  15 3  o 225.8870 3.426537 621.8266       18.86178 598.9722       28.94759 638.6887       24.86470 221.6672 5.358891 228.9144 4.457323 -7.247223      6.970325 
1 1 1 -2  15 4  o 400.7202 5.381840 1957.426       52.55428 2040.530       85.47672 1906.918       66.63793 408.9955 8.576168 395.4581 6.914885 13.53741       11.01664 
1 1 1 -2  15 5  o 468.9971 6.192248 2681.669       70.77088 2612.763       109.8724 2730.528       92.51996 462.7290 9.743745 473.1546 8.024098 -10.42554      12.62247 
1 1 1 -2  15 6  o 121.5324 2.558181 179.9842       7.576340 185.9534       9.851707 171.3439       11.85280 123.4838 3.276796 118.4986 4.110834 4.985214       5.257029 
1 1 1 -2  15 7  o 340.3575 5.246119 1412.096       43.51205 1316.893       58.92983 1526.219       64.52011 328.6152 7.358875 353.7647 7.484184 -25.14954      10.49600 
1 1 1 -2  15 8  o 224.0024 3.410895 611.4944       18.61903 611.2166       29.70774 611.6742       23.89418 223.9191 5.444304 224.0218 4.376893 -0.1026611     6.985530 
1 1 1 -2  15 9  o 205.0391 3.607580 512.3577       18.02556 472.9602       35.58317 525.9578       20.90658 196.7895 7.433410 207.7357 4.129866 -10.94618      8.503610 
1 1 1 -2  15 10 o 515.9354 6.763525 3245.942       85.03633 3245.954       134.6832 3245.933       109.6573 515.6279 10.71867 515.7991 8.724107 -0.1712646     13.82027 
1 1 1 -2  15 11 o 512.0906 7.497133 3198.489       93.55739 3051.077       181.2828 3252.005       109.2275 499.1740 14.91957 516.2666 8.682040 -17.09256      17.26184 
1 1 1 -2  15 12 o 546.4659 7.137378 3642.174       95.04687 3716.345       152.6062 3595.168       121.4871 551.5859 11.35332 542.7525 9.185279 8.833435       14.60367 
1 1 1 -2  15 13 o 921.6157 13.21018 10387.00       296.6844 10056.49       410.6581 10747.87       429.0993 905.2106 18.61636 935.7364 18.81777 -30.52582      26.47031 
1 1 1 -2  15 14 o 227.6497 3.875851 631.6710       21.50157 640.8395       30.97058 623.1398       29.87466 229.2543 5.543650 226.0696 5.422814 3.184662       7.754931 
1 1 1 -2  15 15 o 538.1926 7.882267 3534.932       103.3772 3420.622       143.3045 3658.962       149.2731 528.9984 11.11653 547.1050 11.19630 -18.10669      15.77766 
1 1 1 -2  15 16 o 145.5108 3.511483 258.0816       12.45150 248.1472       15.85217 274.0837       20.11903 142.5914 4.567935 149.8120 5.520364 -7.220505      7.165225 
1 1 1 -2  15 17 o 251.5433 4.169422 771.4387       25.55788 742.6964       35.52487 802.2769       36.79730 246.7356 5.908326 256.4426 5.888296 -9.706985      8.341484 
1 1 1 -2  15 18 o 238.7984 4.698092 695.4830       27.33941 702.2321       33.45302 681.9103       47.44064 239.8985 5.722313 236.0767 8.259064 3.821823       10.04774 
1 1 1 -2  15 19 o 347.6361 6.232323 1475.552       52.79720 1429.999       63.15160 1581.321       96.22762 342.0590 7.576128 358.9272 11.01467 -16.86829      13.36864 
1 1 1 -2  15 20 o 181.6911 3.389719 402.5277       15.00837 413.4068       21.87942 392.8593       20.62607 183.9921 4.884101 179.3713 4.722862 4.620789       6.794106 
1 1 1 -2  15 21 o 203.6137 3.626677 505.6704       17.99500 487.5338       25.32200 524.1748       25.57748 199.7524 5.206433 207.2043 5.065507 -7.451874      7.264042 
1 1 1 -2  15 22 o 219.9735 3.804403 590.3919       20.39356 617.1957       29.83156 566.8749       27.94271 224.7505 5.446772 215.4072 5.323195 9.343369       7.616017 
1 1 1 -2  15 23 o 110.2412 2.864322 148.3133       7.688364 163.3510       11.55685 136.3738       10.29773 115.6060 4.108791 105.6249 4.007998 9.981087       5.739879 
1 1 1 -2  15 24 o 93.91010 3.085789 107.7003       7.052199 102.4175       11.42369 110.9532       8.964240 91.38623 5.150518 95.25833 3.869719 -3.872101      6.442248 
1 1 1 -2  15 25 f 134.4774 3.588087 220.8984       11.74790 225.1551       22.45234 219.2937       13.78558 135.3276 6.830394 133.9224 4.229419 1.405212       8.033821 
1 1 1 -2  15 26 o 214.5161 4.428576 562.4233       23.15048 537.0727       41.21402 574.1092       27.98211 208.7169 8.118585 216.5890 5.301611 -7.872101      9.696314 
1 1 1 -2  15 27 o 50.43204 3.368853 31.19000       4.116489 31.05091       5.920400 31.32018       5.727578 50.13785 4.908434 50.38245 4.719995 -0.2446060     6.809631 
1 1 1 -2  15 28 f 108.9044 3.290534 144.9551       8.722672 142.3879       11.09980 149.1004       14.10456 107.8261 4.232526 110.1904 5.267922 -2.364334      6.757609 
1 1 1 -2  15 29 o 28.62336 5.150175 10.34425       3.460274 5.283076       4.713793 16.25855       5.095613 21.62921 7.417333 35.90588 6.037682 -14.27666      9.564017 
1 1 1 -2  15 30 o 102.6525 2.991204 128.7902       7.474606 123.6011       10.44085 134.2456       10.70550 100.3988 4.277279 104.6507 4.206436 -4.251938      5.999101 
1 1 1 -2  15 31 o 65.21281 3.225069 52.09265       5.109267 46.78641       6.952111 58.32453       7.534120 61.60717 4.665408 68.84638 4.515640 -7.239212      6.492845 
1 1 1 -2  15 32 o 21.09119 6.412436 5.518675       3.587824 3.287868       4.828735 8.268145       5.360767 19.37794 7.380547 25.73158 7.841308 -6.353640      10.76841 
1 1 1 -2  15 33 o 37.47322 5.510210 17.65587       4.881694 18.03463       5.522518 16.30207       10.44080 37.73043 6.223098 35.67788 10.95676 2.052547       12.60070 
1 1 1 -2  15 34 o 145.3601 3.262586 258.5987       11.55695 254.5202       16.16641 262.8614       16.52757 143.8175 4.618803 146.1488 4.646543 -2.331314      6.551618 
1 1 1 -2  15 35 o 71.74072 3.577140 63.27178       6.233984 62.07091       9.577497 64.15456       8.211639 70.59859 5.613164 72.00943 4.705327 -1.410843      7.324460 
1 1 1 -2  15 36 o 61.17361 3.505465 46.09233       5.203838 51.18307       7.169435 40.42408       7.565177 64.23047 4.611128 56.80721 5.534978 7.423260       7.204061 
1 1 1 -2  15 37 o 54.38251 3.646472 36.57113       4.804531 48.34804       6.930349 25.67359       6.666590 62.31371 4.596240 44.81939 6.275572 17.49433       7.778703 
1 1 1 -2  15 38 o 87.64130 3.923255 95.25315       8.357747 97.46564       15.99743 94.42255       9.801805 86.58190 7.661034 86.95497 4.642508 -0.3730698     8.957920 
1 1 1 -2  15 39 o 18.02202 6.691294 3.429389       3.914146 4.344242       4.702384 1.365741       7.062531 19.89462 7.343719 19.80142 8.407378 0.9320068E-01  11.16307 
1 1 1 -2  15 40 o 78.30795 3.305943 76.26329       6.294470 70.97764       8.433163 82.91198       9.458211 74.80256 4.649327 80.74342 4.828970 -5.940857      6.703372 
1 1 1 -2  15 41 o 38.11114 4.584768 18.76334       4.172585 15.90313       5.275059 23.54432       6.820034 34.04685 6.596183 41.31615 7.025004 -7.269306      9.636406 
1 1 1 -2  15 42 o 26.02982 5.977394 9.426776       3.711466 7.403925       4.855050 12.27112       5.757089 22.73872 7.526991 28.60305 7.965857 -5.864334      10.95949 
1 1 1 -2  15 43 o 49.78870 4.024598 32.25108       4.841445 25.13969       6.152350 43.81714       7.846150 42.19521 6.165315 56.24727 5.807673 -14.05206      8.469956 
1 1 1 -2  15 44 o 23.76492 7.785136 9.337212       5.198712 8.332348       6.165139 11.81010       9.671445 22.33546 8.376795 24.58614 10.08967 -2.250679      13.11381 
1 1 1 -2  15 45 o 9.940897 4.778669 -3.691210      3.384908 -1.907076      4.582401 -5.833788      5.021665 12.78924 5.969454 11.55102 5.616531 1.238220       8.196328 
1 1 1 -2  15 46 o 14.03344 5.982085 1.823905       3.600266 -0.6313581     5.170212 4.135221       5.016363 13.82807 6.415786 17.01376 7.147327 -3.185698      9.604509 
1 1 1 -2  15 47 o 28.29817 6.446092 13.56516       4.345551 19.07280       6.144190 8.052683       6.146886 31.11932 8.043908 19.41251 8.013088 11.70681       11.35403 
1 1 1 -2  15 48 o 18.10062 7.132638 6.779261       4.627041 1.514719       8.450238 9.033621       5.529684 15.36345 7.426363 19.65814 7.781433 -4.294694      10.75647 
1 1 1 -2  15 49 o 14.46508 6.219704 3.404731       3.954112 6.644646       5.652678 0.3003794      5.533154 16.89524 7.350199 13.23377 6.292177 3.661477       9.675584 
1 1 1 -2  16 1  o 242.3157 4.651522 715.6744       27.46709 750.6689       48.43478 699.0853       33.34790 247.9573 8.026328 239.4703 5.714533 8.486984       9.852809 
1 1 1 -2  16 2  o 789.4647 11.36356 7609.284       218.6167 9038.095       493.5748 7260.563       243.8399 857.2202 23.65047 770.9271 12.97942 86.29309       26.97795 
1 1 1 -2  16 3  o 458.9381 6.801135 2568.199       76.06268 2431.930       103.6344 2727.323       111.9884 446.4411 9.525849 472.7637 9.720594 -26.32263      13.60999 
1 1 1 -2  16 4  o 553.1330 8.082613 3731.755       108.9475 3942.611       159.9935 3549.449       148.7684 568.2396 11.55406 539.1855 11.32234 29.05408       16.17689 
1 1 1 -2  16 5  o 333.1565 7.246304 1353.530       58.83028 1329.477       81.88514 1379.191       84.57732 329.8903 10.19815 335.9951 10.34195 -6.104797      14.52440 
1 1 1 -2  16 6  o 782.0316 11.24210 7467.057       214.2436 7621.457       306.9454 7320.374       299.1763 789.2513 15.95915 773.5222 15.87151 15.72919       22.50776 
1 1 1 -2  16 7  o 125.1845 2.394940 190.9630       7.306030 189.7247       10.37005 192.1835       10.29493 124.7251 3.415074 125.5329 3.368390 -0.8077927     4.796747 
1 1 1 -2  16 8  o 95.78506 2.626203 111.8871       6.124240 101.4302       9.851161 118.4743       7.818774 91.11485 4.450182 98.54431 3.260389 -7.429466      5.516725 
1 1 1 -2  16 9  f 493.8628 7.263884 2974.638       87.42009 3043.337       177.5446 2952.652       100.4392 498.5932 14.62834 491.9566 8.378000 6.636597       16.85761 
1 1 1 -2  16 10 o 696.9764 10.05708 5930.329       170.8150 5775.395       335.2588 5984.650       198.5137 685.5547 20.08957 699.9328 11.63853 -14.37805      23.21737 
1 1 1 -2  16 11 o 361.0306 4.927731 1588.941       43.35379 1578.350       68.59563 1595.985       55.94382 359.6908 7.825840 361.7714 6.345733 -2.080597      10.07532 
1 1 1 -2  16 12 o 676.0266 9.781940 5580.123       161.1480 5360.026       221.8344 5826.042       234.4869 661.8839 13.75343 690.0174 13.94513 -28.13348      19.58631 
1 1 1 -2  16 13 o 224.3363 3.426236 613.3779       18.73065 589.4924       29.51336 629.4869       24.23740 219.8065 5.514231 227.2427 4.376832 -7.436188      7.040128 
1 1 1 -2  16 14 o 283.6572 5.266485 981.1118       36.40415 966.3311       63.70016 988.2805       44.36244 281.1363 9.310802 284.6411 6.395605 -3.504883      11.29579 
1 1 1 -2  16 15 o 303.6302 5.510829 1124.364       40.77538 1089.575       49.60390 1196.853       71.60371 298.8215 6.811893 312.8426 9.403008 -14.02106      11.61113 
1 1 1 -2  16 16 o 420.7614 7.268956 2161.345       74.53223 2177.070       92.40241 2132.063       126.0926 422.0727 8.983798 416.9410 12.42407 5.131714       15.33186 
1 1 1 -2  16 17 o 298.7049 5.527149 1088.630       40.23274 1122.314       49.98484 1026.659       67.79901 303.1884 6.765339 289.5219 9.622983 13.66647       11.76315 
1 1 1 -2  16 18 o 283.3451 5.316681 979.7047       36.71067 1016.420       45.74695 913.2974       61.52395 288.4969 6.507062 272.9989 9.261397 15.49799       11.31880 
1 1 1 -2  16 19 o 201.7666 4.219944 496.5940       20.74876 492.3881       37.42703 498.4601       24.93049 200.5011 7.674232 202.0311 5.067799 -1.529984      9.196545 
1 1 1 -2  16 20 o 250.8466 4.158737 767.7188       25.42176 785.9791       36.77826 751.0121       35.17867 253.6351 5.950392 247.9435 5.822248 5.691666       8.325006 
1 1 1 -2  16 21 o 345.7169 5.341984 1460.128       45.00484 1441.650       63.51318 1478.761       63.78056 343.0615 7.597239 347.4645 7.532545 -4.403046      10.69847 
1 1 1 -2  16 22 o 188.7350 3.484260 434.5892       16.02504 415.4654       22.52538 454.1870       22.80282 184.3385 5.019083 192.7639 4.858171 -8.425446      6.985200 
1 1 1 -2  16 23 o 244.4127 4.658265 729.7980       27.74495 713.5438       46.90264 738.5474       34.41136 240.9263 7.999808 245.7039 5.747164 -4.777634      9.850220 
1 1 1 -2  16 24 o 88.99773 3.388605 96.79761       7.335707 114.5005       15.79949 91.93252       8.282591 96.40813 6.768014 86.68314 3.931220 9.724991       7.826909 
1 1 1 -2  16 25 o 75.53506 3.505764 69.79723       6.435484 65.98438       13.12686 71.00359       7.383698 72.90677 7.495152 76.14171 3.993336 -3.234940      8.492587 
1 1 1 -2  16 26 o 87.51151 2.877630 93.54464       6.128375 93.36893       8.840914 93.70716       8.502642 87.31008 4.167275 87.48643 3.998775 -0.1763535     5.775498 
1 1 1 -2  16 27 o 84.03866 2.907350 86.29427       5.945083 89.98105       8.692776 83.05448       8.148798 85.69219 4.175326 82.33139 4.074207 3.360802       5.833739 
1 1 1 -2  16 28 o 61.90635 3.501397 46.96654       5.260640 42.89188       6.840002 52.86689       8.230947 58.99425 4.799268 65.47836 5.201116 -6.484112      7.077045 
1 1 1 -2  16 29 o 85.85826 2.969395 90.11553       6.203432 90.62595       8.859704 89.62461       8.688749 85.95491 4.242840 85.48550 4.183596 0.4694061      5.958537 
1 1 1 -2  16 30 o 15.07134 5.969059 1.511070       3.255465 0.2161653      4.640250 2.766204       4.568436 16.13006 6.830212 18.50270 7.145288 -2.372641      9.884682 
1 1 1 -2  16 31 o 145.1445 3.216624 257.4828       11.37724 261.3810       16.16720 253.6583       16.01360 145.9443 4.551376 143.7644 4.576728 2.179962       6.454569 
1 1 1 -2  16 32 o 80.00376 3.135809 78.36792       6.101747 77.62653       8.570597 79.12992       8.688968 79.42947 4.445593 80.19409 4.463821 -0.7646179     6.299920 
1 1 1 -2  16 33 o 115.0490 3.703830 162.3081       10.37059 171.3566       12.53942 142.7226       18.44827 118.0711 4.365623 106.9503 7.118966 11.12080       8.350948 
1 1 1 -2  16 34 o 66.52438 3.668022 54.41938       5.923314 47.41879       8.958158 59.85791       7.895730 61.58432 6.047037 69.58532 4.683554 -8.001003      7.648682 
1 1 1 -2  16 35 o 96.20438 3.132233 113.5091       7.333407 108.8522       10.06041 118.7889       10.71226 93.90771 4.408516 98.08484 4.493641 -4.177124      6.295063 
1 1 1 -2  16 36 f 52.31087 3.787967 33.84686       4.796035 29.25348       6.480134 39.41062       7.131845 48.16396 5.627011 56.09557 5.279265 -7.931606      7.715821 
1 1 1 -2  16 37 o 53.66990 3.729654 35.69935       4.847581 39.52180       6.675599 31.43514       7.050808 56.14200 4.929388 49.69391 5.939869 6.448093       7.718867 
1 1 1 -2  16 38 o 34.36713 7.469225 15.83254       6.076388 11.23103       10.02579 18.50416       7.639344 29.72971 10.76229 36.74113 8.672610 -7.011425      13.82176 
1 1 1 -2  16 39 o 64.99435 3.476844 52.54884       5.486729 51.43653       7.450264 53.86703       8.110530 63.69609 4.835934 65.01794 5.161261 -1.321846      7.072826 
1 1 1 -2  16 40 o 19.99390 6.321127 5.263925       3.447964 6.710217       4.637118 3.475547       5.156436 22.40891 7.353284 19.06859 7.524817 3.340324       10.52111 
1 1 1 -2  16 41 o 22.16695 6.434862 6.806106       3.679924 5.438322       4.694361 8.986439       5.926919 20.52582 7.372956 24.97718 8.318009 -4.451361      11.11529 
1 1 1 -2  16 42 o 28.70415 5.966085 11.52095       4.036853 13.00591       5.387278 9.619481       6.096163 29.52748 7.479754 25.03462 8.437324 4.492857       11.27542 
1 1 1 -2  16 43 o 21.09708 7.047181 6.684293       4.253656 6.660107       6.243766 6.705240       5.810708 21.26488 8.313597 21.21439 8.092368 0.5049133E-01  11.60182 
1 1 1 -2  16 44 o 16.67670 6.748968 3.367682       4.255206 5.114391       5.003586 -1.196730      8.088419 18.80171 7.414632 16.77747 7.863345 2.024239       10.80782 
1 1 1 -2  16 45 o 10.69675 5.047287 -2.393161      3.432782 -5.419598      4.706285 1.047560       5.018075 11.19069 5.440403 14.97930 6.700542 -3.788614      8.631063 
1 1 1 -2  16 46 o 10.99975 5.170809 -1.839463      3.542801 -1.626485      5.034874 -2.048329      4.986037 13.00199 6.128174 12.74019 6.032826 0.2617979      8.599390 
1 1 1 -2  16 47 f 11.80386 5.587923 -1.603726      4.272179 0.9067113      5.437317 -5.653907      6.906326 14.18017 6.579246 12.73331 6.272459 1.446854       9.090117 
1 1 1 -2  16 48 o 10.19367 5.005980 -4.733015      4.289939 6.948974       8.213553 -9.115306      5.030641 17.08434 7.980058 9.742148 4.886761 7.342187       9.357444 
1 1 1 -2  17 1  o 131.5001 4.283530 210.9848       13.70832 214.7548       19.44211 207.2577       19.33134 132.5831 6.033351 130.2390 6.107960 2.344101       8.585365 
1 1 1 -2  17 2  o 583.5609 7.600435 4153.350       108.0838 4104.312       169.3120 4187.079       140.4180 579.6892 11.98551 585.7345 9.837527 -6.045288      15.50578 
1 1 1 -2  17 3  o 350.6940 6.214187 1499.500       53.10664 1551.611       93.50433 1474.685       64.52367 356.3402 10.78029 347.7233 7.614637 8.616943       13.19839 
1 1 1 -2  17 4  o 209.8134 4.237328 536.5450       21.66513 535.9533       26.45579 537.7499       37.75006 209.6817 5.177546 209.8530 7.393421 -0.1712494     9.026054 
1 1 1 -2  17 5  o 572.9390 7.478229 4003.570       104.4103 4265.021       171.9244 3850.797       131.4213 590.9037 11.93946 561.7233 9.600794 29.18042       15.32077 
1 1 1 -2  17 6  o 265.6756 4.977635 860.4045       32.22633 849.1808       39.16080 883.9507       56.72123 263.9079 6.089239 269.0261 8.663267 -5.118195      10.58919 
1 1 1 -2  17 7  o 825.4756 9.677122 8317.046       194.6644 8211.788       273.2881 8425.457       277.3510 819.5250 13.68429 830.1129 13.71060 -10.58789      19.37113 
1 1 1 -2  17 8  f 244.0848 5.737401 726.3787       34.12653 682.8313       47.35335 773.4374       49.22548 236.4332 8.231313 251.6628 8.036964 -15.22957      11.50423 
1 1 1 -2  17 9  o 761.8193 9.806731 7085.295       182.0591 7142.433       289.7159 7048.006       234.0435 763.7541 15.56620 759.3209 12.64839 4.433167       20.05713 
1 1 1 -2  17 10 o 194.4695 3.176270 460.8974       15.05238 426.7268       23.38635 485.0655       19.66786 187.0184 5.136336 199.4895 4.045767 -12.47113      6.538362 
1 1 1 -2  17 11 o 566.0107 7.390063 3908.513       101.9316 3888.355       161.0101 3921.995       131.6793 564.0035 11.71481 566.7451 9.534406 -2.741577      15.10436 
1 1 1 -2  17 12 o 98.86345 2.620147 119.1953       6.306880 115.5970       10.66497 121.1304       7.820983 97.27264 4.511464 99.64102 3.225222 -2.368385      5.545752 
1 1 1 -2  17 13 o 479.0884 7.093615 2800.710       82.81698 2628.205       160.0728 2863.762       96.77579 462.8754 14.20796 484.3332 8.199482 -21.45779      16.40420 
1 1 1 -2  17 14 o 292.8498 4.638380 1045.696       33.10147 1010.659       46.62526 1081.303       47.00212 287.7937 6.648196 297.6930 6.479070 -9.899323      9.283149 
1 1 1 -2  17 15 o 244.6884 4.123785 729.9971       24.58927 690.4411       33.94279 773.6824       35.67046 237.8866 5.855196 251.8212 5.812733 -13.93454      8.250526 
1 1 1 -2  17 16 o 310.9005 5.716814 1179.531       43.31234 1192.665       53.25023 1153.856       74.45287 312.5089 6.992347 306.8632 9.969592 5.645782       12.17726 
1 1 1 -2  17 17 o 349.7494 6.285459 1493.704       53.57104 1534.616       66.62492 1418.873       90.10565 354.3117 7.716407 339.9668 10.89031 14.34491       13.34697 
1 1 1 -2  17 18 o 147.1447 3.139716 263.9823       11.25825 255.7783       16.26394 271.5301       15.59996 144.7126 4.617845 149.1299 4.297104 -4.417206      6.307899 
1 1 1 -2  17 19 o 211.3523 3.731971 544.8663       19.22124 554.6014       27.83627 535.9944       26.57356 213.0421 5.366056 209.5176 5.204669 3.524551       7.475502 
1 1 1 -2  17 20 o 390.2923 5.929308 1862.035       56.39364 1814.672       78.83028 1911.682       80.70818 384.6701 8.409468 394.8246 8.388364 -10.15448      11.87787 
1 1 1 -2  17 21 o 165.4601 3.277084 333.9557       13.21347 341.2953       19.28175 327.4571       18.14349 167.0976 4.740010 163.6925 4.552793 3.405029       6.572337 
1 1 1 -2  17 22 o 395.7022 6.902592 1918.750       66.56054 1957.222       116.3590 1900.039       81.14819 397.1809 12.03585 393.2039 8.468860 3.977051       14.71677 
1 1 1 -2  17 23 o 193.5837 3.556713 457.3741       16.77852 471.8819       24.44096 444.4429       23.07477 196.3892 5.111330 190.6112 4.971915 5.777939       7.130612 
1 1 1 -2  17 24 o 64.98116 3.599842 51.70463       5.678145 53.51469       12.30752 51.21518       6.399964 65.51884 7.865539 64.62582 4.084727 0.8930206      8.862940 
1 1 1 -2  17 25 o 232.9710 4.667272 663.7171       26.49726 698.0577       49.14162 649.6403       31.46284 237.7839 8.494330 230.3029 5.606121 7.481033       10.17754 
1 1 1 -2  17 26 o 175.4389 3.403584 375.8240       14.55119 378.4912       20.94092 373.3337       20.23424 175.7935 4.893046 174.6150 4.759645 1.178543       6.826135 
1 1 1 -2  17 27 o 66.14900 3.284649 53.56482       5.278224 52.67159       7.003047 54.73957       8.031207 65.46996 4.415259 66.67362 4.978951 -1.203667      6.654658 
1 1 1 -2  17 28 o 47.38799 3.593978 27.59880       4.119356 33.44508       6.113713 22.73776       5.574809 52.02570 4.879201 42.70985 5.482611 9.315857       7.339321 
1 1 1 -2  17 29 o 172.9964 3.406124 365.7331       14.35931 370.7872       20.64944 361.0009       19.98130 173.8507 4.878938 171.5619 4.783998 2.288834       6.833057 
1 1 1 -2  17 30 o 84.74731 3.035868 87.85102       6.259543 88.74960       9.068555 87.03331       8.650871 85.00089 4.392931 84.19765 4.229772 0.8032455      6.098263 
1 1 1 -2  17 31 o 72.61317 3.193640 64.57903       5.637335 65.57784       8.079568 63.63149       7.869380 72.97822 4.566048 71.89135 4.514670 1.086868       6.421140 
1 1 1 -2  17 32 o 46.28776 4.018356 26.45611       4.487770 17.83405       6.121277 36.47628       6.598937 37.34672 6.982599 54.23025 5.051496 -16.88353      8.618254 
1 1 1 -2  17 33 o 100.2406 4.303221 123.6130       10.48723 114.9578       13.26155 138.0608       17.13390 96.31799 5.675183 105.2446 6.715710 -8.926628      8.792523 
1 1 1 -2  17 34 o 99.57649 3.095265 121.5256       7.501759 110.2374       10.38592 133.8390       10.84729 94.51699 4.522314 104.2311 4.279693 -9.714142      6.226322 
1 1 1 -2  17 35 o 84.64101 3.133836 87.94849       6.452717 88.53916       9.226566 87.38300       9.027721 84.59364 4.491857 84.05750 4.422791 0.5361481      6.303797 
1 1 1 -2  17 36 o 75.99500 3.190998 71.05959       5.896306 66.56095       8.241198 75.77745       8.439614 73.14512 4.647514 78.12794 4.451238 -4.982826      6.435287 
1 1 1 -2  17 37 o 37.21545 5.348239 17.69044       4.711174 13.77652       5.869698 24.77712       7.898263 32.08261 7.621337 43.21878 7.785656 -11.13617      10.89501 
1 1 1 -2  17 38 o 54.26641 4.692155 37.16948       6.144068 48.91147       12.41818 33.36346       7.070051 59.96881 8.755752 50.92867 5.799941 9.040138       10.50250 
1 1 1 -2  17 39 o 16.79604 6.431550 2.769475       3.679560 6.983108       4.972990 -2.328076      5.469782 23.01229 7.617878 15.07303 6.845292 7.939262       10.24159 
1 1 1 -2  17 40 o 42.95002 4.198972 23.54947       4.338757 21.23285       5.915280 26.24714       6.383268 39.65347 6.334556 44.32904 6.068176 -4.675571      8.772079 
1 1 1 -2  17 41 o 37.92411 4.689257 18.85759       4.241440 16.54611       5.688622 21.75121       6.364771 34.01740 7.092409 39.27608 6.901709 -5.258686      9.896254 
1 1 1 -2  17 42 o 14.84444 6.128336 1.694904       3.596016 -0.5410087     4.619227 5.134541       5.729255 14.31893 6.415186 20.06200 7.927113 -5.743074      10.19773 
1 1 1 -2  17 43 o 12.98985 5.778320 -0.1319810     3.677917 -3.901893      4.827616 5.082959       5.677953 12.36785 5.879570 19.34369 7.807575 -6.975839      9.773821 
1 1 1 -2  17 44 o 18.15161 6.969048 4.852675       4.328016 -0.5973192     5.106783 18.74687       8.153913 14.24508 6.524586 30.32426 9.735796 -16.07919      11.71990 
1 1 1 -2  17 45 o 10.94266 5.111746 -1.724275      3.371437 0.3915150      4.722355 -3.923761      4.814853 14.10142 6.386696 11.87112 5.704683 2.230303       8.563486 
1 1 1 -2  17 46 o 17.46097 6.962245 5.258051       4.457709 5.309242       5.614326 5.170732       7.332563 17.53846 7.473018 17.66575 7.983834 -0.1272869     10.93561 
1 1 1 -2  17 47 o 18.22403 6.667893 6.289070       3.862863 3.723440       5.595054 8.625872       5.339715 15.71041 7.047790 19.67910 7.689781 -3.968697      10.43092 
1 1 1 -2  17 48 o 17.05878 7.057197 6.208639       4.782223 5.714302       8.819197 6.414533       5.691657 16.33033 7.813839 16.92478 7.369113 -0.5944500     10.74057 
1 1 1 -2  18 1  o 436.2225 7.524696 2321.018       79.98953 2479.825       144.4169 2250.738       96.07233 450.2201 13.17725 429.4572 9.179992 20.76282       16.05964 
1 1 1 -2  18 2  o 351.5408 6.234209 1506.857       53.40638 1538.720       66.16794 1447.302       90.46280 355.1732 7.644892 344.1061 10.80139 11.06708       13.23308 
1 1 1 -2  18 3  o 318.5396 5.750396 1237.095       44.63723 1307.469       56.43777 1119.533       72.94479 327.4225 7.073352 302.6805 9.902818 24.74200       12.16956 
1 1 1 -2  18 4  o 555.3530 7.265090 3761.685       98.32098 3667.111       152.7138 3828.641       128.4952 547.9191 11.43736 560.0819 9.414540 -12.16278      14.81373 
1 1 1 -2  18 5  o 211.3357 3.322175 544.3095       17.10927 522.3660       26.34747 560.3098       22.49823 206.9330 5.229029 214.4037 4.306060 -7.470642      6.773839 
1 1 1 -2  18 6  o 341.0722 4.711410 1418.058       39.15915 1363.607       60.36390 1457.624       51.45555 334.3489 7.408687 345.7447 6.107178 -11.39578      9.601368 
1 1 1 -2  18 7  o 472.7998 8.058290 2727.451       92.84451 2885.229       166.5543 2656.319       111.8318 485.3955 14.09562 466.4367 9.838676 18.95877       17.18971 
1 1 1 -2  18 8  o 447.9347 5.975067 2446.706       65.22192 2488.257       104.4716 2420.167       83.49127 451.4479 9.496305 445.3821 7.692583 6.065826       12.22111 
1 1 1 -2  18 9  o 334.8212 4.657651 1366.646       38.00283 1345.061       59.94844 1381.148       49.13772 332.0354 7.408963 336.5361 5.991661 -4.500702      9.528522 
1 1 1 -2  18 10 o 310.0238 4.374667 1171.682       33.05036 1183.590       53.07092 1164.138       42.24151 311.4760 6.991911 308.9751 5.610220 2.500977       8.964452 
1 1 1 -2  18 11 o 229.5900 3.923764 642.5416       21.95290 569.5436       41.76405 670.4112       25.80550 215.8636 7.952984 234.4997 4.515791 -18.63608      9.145618 
1 1 1 -2  18 12 o 322.2089 5.041809 1265.992       39.58768 1162.694       76.49107 1303.783       46.26592 308.2336 10.19748 326.9396 5.807077 -18.70602      11.73502 
1 1 1 -2  18 13 o 500.2663 8.542941 3057.479       104.1465 3012.031       126.6415 3152.432       183.0505 496.2029 10.47324 506.4053 14.84930 -10.20242      18.17114 
1 1 1 -2  18 14 o 257.7070 4.283003 809.8347       26.89743 807.2600       38.13438 812.3837       37.94375 257.1953 6.084398 258.0135 6.034785 -0.8182068     8.569629 
1 1 1 -2  18 15 o 227.8167 3.943019 632.8672       21.89024 605.3210       30.44277 662.3585       31.49921 222.6448 5.615420 232.9763 5.548197 -10.33145      7.894012 
1 1 1 -2  18 16 o 510.0462 6.727933 3178.069       83.62330 3264.444       135.0891 3124.409       106.4759 515.8850 10.74562 505.2911 8.647164 10.59390       13.79282 
1 1 1 -2  18 17 o 174.4959 3.901735 371.3849       16.59125 365.5514       30.17612 373.9125       19.86292 172.7597 7.183455 174.9883 4.662139 -2.228577      8.563735 
1 1 1 -2  18 18 o 275.4465 4.484949 925.9285       30.10446 908.2279       42.62630 943.5427       42.52216 272.5722 6.417413 277.8401 6.280355 -5.267944      8.979201 
1 1 1 -2  18 19 o 182.1278 3.438605 404.6096       15.26141 403.0554       22.12121 406.0212       21.08205 181.5977 5.003530 182.2928 4.749823 -0.6950531     6.898995 
1 1 1 -2  18 20 o 228.6587 3.929914 638.1104       21.89812 625.1071       31.10331 650.8907       30.83566 226.1195 5.644592 230.7577 5.483539 -4.638199      7.869601 
1 1 1 -2  18 21 o 294.6674 5.394235 1061.633       38.73451 1076.593       67.46160 1054.276       47.31018 295.5608 9.378292 293.3887 6.617214 2.172119       11.47780 
1 1 1 -2  18 22 o 177.4494 3.403090 384.2499       14.71581 409.9099       21.90814 363.1544       19.86425 183.0627 4.915443 172.3231 4.734830 10.73969       6.824968 
1 1 1 -2  18 23 o 121.8714 4.074590 181.6066       12.08400 0.000000       0.000000 181.6066       12.08400 ?        ?        121.8714 4.074590 0.000000       4.074590 
1 1 1 -2  18 24 o 212.5548 4.413533 552.2362       22.86091 582.9169       43.01258 540.1572       26.98846 217.4098 8.132920 210.0092 5.277738 7.400604       9.695304 
1 1 1 -2  18 25 o 88.41278 2.914629 95.49259       6.271052 99.69805       9.428255 92.15594       8.398084 90.20488 4.301485 86.75330 3.983075 3.451576       5.862393 
1 1 1 -2  18 26 o 62.35053 3.409482 47.61949       5.160702 45.17859       7.105495 50.34461       7.507780 60.55776 4.855569 63.94727 4.854111 -3.389515      6.865781 
1 1 1 -2  18 27 o 109.9186 2.968751 147.6089       7.944803 141.4746       11.36562 153.4705       11.11004 107.4421 4.349920 111.9498 4.079272 -4.507721      5.963410 
1 1 1 -2  18 28 o 64.94807 3.150390 51.64314       4.971293 49.70867       7.222049 53.38514       6.853370 63.52901 4.698253 65.90516 4.290580 -2.376144      6.362598 
1 1 1 -2  18 29 o 33.14004 4.634418 13.71603       3.640502 13.66431       5.272494 13.76315       5.032763 32.68748 6.839135 32.85983 6.515232 -0.1723480     9.445741 
1 1 1 -2  18 30 o 236.8176 4.103406 686.8715       23.68071 705.3539       34.26606 669.9743       32.76360 239.3367 5.875146 233.3035 5.762809 6.033249       8.229661 
1 1 1 -2  18 31 o 147.5557 3.250515 266.2775       11.68811 261.3843       16.55139 271.1448       16.50766 145.8346 4.663336 148.5616 4.565187 -2.727005      6.525919 
1 1 1 -2  18 32 o 176.9373 4.968220 385.5076       21.40061 414.2153       29.64861 354.2818       30.92156 182.6474 6.672450 168.4544 7.551768 14.19298       10.07724 
1 1 1 -2  18 33 o 58.75749 4.297971 42.65810       6.111507 40.33923       7.025624 49.87032       12.39030 56.96271 5.115681 62.44710 8.351211 -5.484386      9.793513 
1 1 1 -2  18 34 o 71.81387 3.273201 63.35502       5.713126 70.13994       8.332192 57.33477       7.848632 75.28766 4.562922 67.99255 4.767133 7.295113       6.598925 
1 1 1 -2  18 35 o 17.41039 6.435528 3.047054       3.613374 2.559959       4.930811 3.612041       5.310448 18.54769 7.346050 20.06174 7.715176 -1.514046      10.65309 
1 1 1 -2  18 36 o 46.51144 4.033667 26.94512       4.526735 29.21539       6.533763 24.84946       6.277467 47.94675 5.703674 44.07165 6.000783 3.875103       8.278967 
1 1 1 -2  18 37 o 57.91076 3.608707 41.64047       5.067378 36.33888       7.048738 47.31129       7.290062 53.42170 5.492660 61.26559 4.924351 -7.843895      7.376893 
1 1 1 -2  18 38 o 44.50779 5.099097 25.37381       5.430779 18.12083       9.734909 28.65093       6.543653 35.13153 10.53717 46.98604 5.840709 -11.85451      12.04765 
1 1 1 -2  18 39 f 24.89818 6.150588 8.408420       3.709669 9.025270       5.104037 7.717681       5.401085 25.47195 7.627495 23.86727 7.940244 1.604683       11.01027 
1 1 1 -2  18 40 o 25.97299 6.129625 9.306520       3.816739 9.332397       5.116043 9.274041       5.731627 25.47854 7.638083 25.32378 8.165586 0.1547661      11.18111 
1 1 1 -2  18 41 o 28.99249 5.856745 11.68067       3.995272 10.79237       5.338713 12.81142       6.023380 26.74324 7.746919 28.84058 8.189373 -2.097338      11.27300 
1 1 1 -2  18 42 o 21.99902 7.173599 7.348872       4.416440 1.847917       6.588564 11.83744       5.951490 17.82930 7.841247 26.87949 8.275532 -9.050190      11.40042 
1 1 1 -2  18 43 o 10.51585 4.978405 -2.855793      3.391746 2.728339       4.985310 -7.667965      4.627910 16.67442 7.070990 10.43435 5.138943 6.240071       8.741146 
1 1 1 -2  18 44 o 11.58394 5.464505 -2.534898      4.019030 -5.471719      4.770971 4.642171       7.458331 11.29441 5.487808 18.77383 8.296125 -7.479419      9.946946 
1 1 1 -2  18 45 o 16.09724 6.422829 3.775093       3.796277 2.345530       5.507139 5.069474       5.240290 15.77718 7.041084 17.72110 7.364282 -1.943913      10.18869 
1 1 1 -2  18 46 o 12.55600 5.646331 0.6122272      3.615311 3.157386       5.425149 -1.420954      4.848889 15.63842 6.983182 12.58505 5.956375 3.053367       9.178411 
1 1 1 -2  18 47 o 14.66209 6.476287 2.940878       4.540283 12.12560       8.883167 -0.3069231     5.282379 19.51831 8.807430 13.15560 6.223586 6.362716       10.78443 
1 1 1 -2  19 1  o 749.5664 10.82070 6862.991       197.6521 6709.897       274.4483 7027.954       284.8885 740.2556 15.21397 757.5430 15.43233 -17.28735      21.67076 
1 1 1 -2  19 2  o 339.3346 7.435308 1404.686       61.48415 1367.896       85.48755 1444.108       88.49380 334.5002 10.50047 343.6926 10.57850 -9.192413      14.90518 
1 1 1 -2  19 3  f 507.7336 8.649310 3146.212       107.0172 2980.124       178.7048 3239.079       133.6275 493.1389 14.88773 514.9555 10.64854 -21.81659      18.30399 
1 1 1 -2  19 4  o 291.1990 6.605468 1034.212       46.87373 1066.782       67.57916 1004.014       65.07089 295.4528 9.398130 286.6265 9.328530 8.826294       13.24184 
1 1 1 -2  19 5  o 399.8703 8.569284 1951.554       83.50256 0.000000       0.000000 1951.554       83.50256 ?        ?        399.8703 8.569284 0.000000       8.569284 
1 1 1 -2  19 6  o 154.4293 4.588876 290.9833       17.25005 0.000000       0.000000 290.9833       17.25005 ?        ?        154.4293 4.588876 0.000000       4.588876 
1 1 1 -2  19 7  o 269.6563 5.117830 886.5747       33.63044 942.7466       60.83915 861.8583       40.35670 277.7301 9.001152 265.8285 6.229856 11.90161       10.94677 
1 1 1 -2  19 8  o 172.2329 4.854803 361.9586       20.35590 329.5970       28.20139 397.1581       29.41193 164.2088 7.064069 180.3085 6.705461 -16.09969      9.739829 
1 1 1 -2  19 9  o 171.8704 3.942948 360.0858       16.51423 352.8944       28.77935 363.6162       20.16438 169.9214 6.964954 172.6255 4.798057 -2.704025      8.457656 
1 1 1 -2  19 10 f 360.6280 5.569404 1586.203       48.94453 1541.691       68.17260 1633.553       70.31307 355.3551 7.872473 365.7874 7.888078 -10.43231      11.14440 
1 1 1 -2  19 11 o 710.4797 10.29766 6174.109       178.2898 6288.242       255.5118 6065.809       248.8979 715.6152 14.65195 702.8892 14.53110 12.72607       20.63571 
1 1 1 -2  19 12 o 882.5149 14.71333 9574.135       316.4237 9523.477       386.4220 9677.230       551.2607 878.2186 18.05606 878.9306 25.76531 -0.7119751     31.46224 
1 1 1 -2  19 13 o 242.4897 4.130218 717.0382       24.40632 725.1149       34.97575 709.3729       34.07343 243.7503 5.888243 241.0958 5.799493 2.654495       8.264716 
1 1 1 -2  19 14 o 223.8017 3.470090 610.6824       18.92519 613.2021       30.63910 609.1280       24.06472 224.0751 5.615502 223.4715 4.418985 0.6035461      7.145719 
1 1 1 -2  19 15 o 243.0548 3.654849 720.4026       21.64760 736.9516       35.25360 710.3855       27.42757 245.6680 5.888691 241.2961 4.664455 4.371872       7.512245 
1 1 1 -2  19 16 o 257.6804 3.804770 809.8798       23.89164 815.7394       38.57660 806.2337       30.43013 258.3972 6.126326 257.0155 4.858568 1.381653       7.819051 
1 1 1 -2  19 17 o 222.5977 3.445898 604.3345       18.69214 636.7726       31.05005 585.8970       23.40919 228.3103 5.580855 219.1086 4.384205 9.201630       7.096985 
1 1 1 -2  19 18 o 106.3446 3.409364 138.0907       8.823956 118.1768       16.63069 145.8934       10.41011 98.00640 7.009656 109.2746 3.915642 -11.26815      8.029168 
1 1 1 -2  19 19 o 228.9862 3.956149 639.9682       22.07588 632.2718       31.53959 647.3604       30.90994 227.3285 5.697818 230.1221 5.511930 -2.793671      7.927579 
1 1 1 -2  19 20 o 125.1122 3.373106 191.1222       10.27470 161.5561       17.26459 207.3369       12.78539 114.7198 6.198660 130.2584 4.032697 -15.53863      7.395000 
1 1 1 -2  19 21 o 77.49639 3.003024 73.37193       5.660485 74.32003       8.695383 72.67467       7.456852 77.85712 4.603595 77.04813 3.985067 0.8089981      6.088830 
1 1 1 -2  19 22 o 120.8113 3.513264 178.3017       10.33220 152.7445       19.19683 188.7246       12.25934 111.3383 7.112556 124.2423 4.054559 -12.90396      8.187057 
1 1 1 -2  19 23 o 56.00037 3.757647 38.46898       5.098261 26.51775       10.78243 41.91026       5.785895 45.42511 10.01088 58.42806 4.089439 -13.00295      10.81394 
1 1 1 -2  19 24 o 29.79509 4.865816 11.14072       3.411117 12.30122       5.705177 10.49504       4.255536 31.00634 7.608535 28.70016 6.261167 2.306175       9.853529 
1 1 1 -2  19 25 o 143.2646 3.544302 250.7012       12.37387 250.7740       16.01296 250.5935       19.49498 143.0920 4.598162 142.8607 5.610726 0.2312927      7.254195 
1 1 1 -2  19 26 o 60.51951 3.172770 44.84652       4.662841 53.89404       7.381316 38.83853       6.014971 66.19700 4.604420 56.16653 4.430457 10.03047       6.389807 
1 1 1 -2  19 27 f 109.6034 3.028072 146.8043       8.079974 147.6626       11.81801 146.0510       11.07205 109.7398 4.428300 109.1773 4.169256 0.5624619      6.082149 
1 1 1 -2  19 28 o 95.64835 3.021220 111.8501       7.033168 112.5031       10.28833 111.2771       9.636446 95.74291 4.421567 95.25806 4.161292 0.4848557      6.071788 
1 1 1 -2  19 29 o 140.4075 3.225634 240.9470       11.03676 239.6762       15.97056 242.1087       15.26968 139.7194 4.697268 140.4784 4.466183 -0.7589874     6.481598 
1 1 1 -2  19 30 o 162.7878 3.371771 324.1225       13.37569 335.5098       19.51165 314.0267       18.37191 165.2165 4.851490 159.8721 4.720866 5.344467       6.769309 
1 1 1 -2  19 31 o 47.05961 3.873342 27.31856       4.402629 26.35371       6.321128 28.22758       6.135534 45.86693 5.783671 47.57575 5.386799 -1.708820      7.903698 
1 1 1 -2  19 32 o 62.83468 4.264280 48.71666       6.490835 45.84127       7.525244 57.07227       12.82808 60.77097 5.129304 67.04756 8.009564 -6.276588      9.511198 
1 1 1 -2  19 33 o 85.71272 3.114639 90.09886       6.494807 88.42364       9.369367 91.64845       9.011189 84.59770 4.561680 86.19563 4.303647 -1.597931      6.271388 
1 1 1 -2  19 34 o 158.9869 3.383620 310.3162       13.10928 314.6528       18.86302 306.2649       18.23174 159.3871 4.862171 157.2987 4.761758 2.088409       6.805515 
1 1 1 -2  19 35 o 19.08671 6.460187 4.322918       3.573917 0.1314420      4.996015 8.715795       5.114635 16.40684 7.021738 25.85626 7.608887 -9.449421      10.35374 
1 1 1 -2  19 36 f 56.30025 4.048663 39.48823       5.517577 39.32515       7.164308 39.72598       8.650067 55.73732 5.339859 55.52793 6.516368 0.2093887      8.424794 
1 1 1 -2  19 37 o 48.44899 4.645513 29.68409       5.417603 38.22049       11.25627 27.11050       6.180541 52.59554 9.112297 45.88587 5.646194 6.709663       10.71977 
1 1 1 -2  19 38 o 14.24998 5.997464 0.6824310      3.542500 2.291389       5.075886 -0.8454407     4.946329 17.96670 7.333903 15.23413 6.742864 2.732570       9.962547 
1 1 1 -2  19 39 o 36.13309 4.756604 16.95511       4.086684 15.91602       5.739698 18.02349       5.820028 33.72746 7.202471 36.15523 6.856504 -2.427773      9.944206 
1 1 1 -2  19 40 o 26.23094 6.198178 9.631676       3.898719 5.166927       5.165282 15.54313       5.943505 20.26927 7.653314 32.54925 7.627220 -12.27998      10.80499 
1 1 1 -2  19 41 o 20.10755 7.162468 5.689263       4.420525 6.996964       6.714018 4.688605       5.873153 22.12144 8.628930 19.73207 7.949025 2.389380       11.73224 
1 1 1 -2  19 42 o 23.47498 6.715767 8.455548       4.035792 12.30876       5.538205 4.092421       5.893274 27.36648 7.879131 18.63414 7.781836 8.732346       11.07419 
1 1 1 -2  19 43 o 15.95467 6.306654 3.185801       3.627619 4.751405       5.178136 1.676826       5.083625 18.37115 7.441258 15.76718 6.912477 2.603975       10.15651 
1 1 1 -2  19 44 o 16.43103 6.691661 3.667579       4.214092 8.920045       5.088947 -7.793096      7.517119 22.14026 7.701557 13.44690 6.608197 8.693361       10.14802 
1 1 1 -2  19 45 o 11.38091 5.392226 -2.184582      3.994174 -6.281827      5.015967 4.915309       6.602897 10.95773 5.387545 17.51290 7.768996 -6.555167      9.454256 
1 1 1 -2  19 46 o 9.534754 4.737158 -6.941567      4.256781 -19.85329      8.757350 -2.947052      4.870939 11.32935 5.767164 11.77201 5.677464 -0.4426565     8.092822 
1 1 1 -2  19 47 o 11.01874 5.224672 -1.440310      3.763818 -0.8201171     5.475211 -1.995969      5.182525 12.91050 6.171867 12.18369 5.871053 0.7268038      8.518287 
1 1 1 -2  20 1  f 153.2270 3.706187 286.1749       13.83881 280.7800       16.75614 297.7507       24.54456 151.6946 4.537914 156.1051 6.466115 -4.410461      7.899576 
1 1 1 -2  20 2  o 559.0833 7.325128 3813.900       99.79937 3625.831       152.6016 3954.449       131.9214 544.5649 11.49935 569.0175 9.513789 -24.45258      14.92472 
1 1 1 -2  20 3  o 708.2094 10.24346 6128.375       176.7846 6243.380       357.5280 6091.158       203.3881 711.4969 20.64241 705.7272 11.82640 5.769653       23.79018 
1 1 1 -2  20 4  o 53.32911 4.544052 34.92339       5.849129 30.64019       8.794021 38.32157       7.832974 49.55064 7.518639 55.74969 5.852817 -6.199051      9.528137 
1 1 1 -2  20 5  o 360.2659 5.538610 1582.827       48.62505 1516.799       66.74248 1657.518       70.98595 352.5220 7.769266 368.5006 7.904932 -15.97858      11.08375 
1 1 1 -2  20 6  o 763.2130 9.844378 7118.080       183.0923 6919.567       283.7628 7259.674       239.6533 750.8788 15.50777 770.0016 12.77191 -19.12286      20.09011 
1 1 1 -2  20 7  o 397.6231 5.389186 1928.209       52.21928 1985.860       83.90172 1891.757       66.71598 403.2399 8.538297 393.7248 6.953461 9.515106       11.01150 
1 1 1 -2  20 8  o 191.3931 3.171279 446.4891       14.79098 446.8117       23.15317 446.2666       19.22537 191.3491 4.969533 191.3223 4.123568 0.2684021E-01  6.457560 
1 1 1 -2  20 9  o 53.30748 3.737447 34.81286       4.824349 32.86902       9.710573 35.44987       5.558921 51.26421 8.037082 53.75067 4.279256 -2.486462      9.105312 
1 1 1 -2  20 10 o 462.6410 6.892226 2613.176       77.70335 2618.799       110.6222 2607.699       109.1704 462.6612 9.811675 461.7003 9.703062 0.9609070      13.79922 
1 1 1 -2  20 11 f 203.9118 3.683768 506.9561       18.30504 521.9277       27.07034 494.3430       24.84681 206.7560 5.377351 201.2375 5.070744 5.518478       7.391099 
1 1 1 -2  20 12 o 281.7560 4.085478 968.1394       28.05124 974.0146       45.03193 964.4141       35.85802 282.4137 6.543328 281.1335 5.234048 1.280212       8.379165 
1 1 1 -2  20 13 o 147.4985 2.859361 265.2127       10.27762 246.9731       16.62821 276.4883       13.07398 142.1917 4.805736 150.5809 3.562887 -8.389206      5.982412 
1 1 1 -2  20 14 o 347.6749 4.818244 1475.155       40.82237 1549.274       67.10394 1431.609       51.43478 355.8599 7.738075 342.3329 6.165555 13.52692       9.894032 
1 1 1 -2  20 15 f 352.7532 4.880517 1518.981       41.95396 1542.708       67.72345 1504.206       53.44420 354.9813 7.828841 350.8255 6.251343 4.155792       10.01849 
1 1 1 -2  20 16 o 180.3533 3.076895 396.6604       13.52300 413.4436       22.41839 387.0605       16.95498 183.9347 5.006204 178.1119 3.906325 5.822845       6.349917 
1 1 1 -2  20 17 f 127.4825 2.682780 198.1616       8.334352 196.7723       13.82381 198.9550       10.44643 126.8750 4.478134 127.6673 3.360702 -0.7923355     5.598929 
1 1 1 -2  20 18 o 30.61435 4.003313 11.63393       2.915141 9.745461       5.685587 12.30743       3.395411 27.85832 7.971544 31.42025 4.568245 -3.561926      9.187730 
1 1 1 -2  20 19 o 207.2589 4.245678 524.5411       21.44354 571.5788       39.02124 504.1906       25.66641 215.7424 7.433249 203.0235 5.192055 12.71887       9.067007 
1 1 1 -2  20 20 o 90.52310 2.958014 100.0662       6.516468 86.67572       9.622419 111.4099       8.856506 84.08826 4.714716 95.45486 3.815083 -11.36661      6.064933 
1 1 1 -2  20 21 o 161.4299 3.835023 318.1976       15.08649 319.6320       28.45184 317.6365       17.79395 161.1921 7.261848 161.1562 4.535461 0.3590393E-01  8.561825 
1 1 1 -2  20 22 o 131.4053 3.593576 210.9874       11.49656 217.8805       22.59863 208.5805       13.35370 133.0204 6.996124 130.5855 4.201808 2.434891       8.160940 
1 1 1 -2  20 23 o 156.9436 3.277218 300.6868       12.53386 273.9540       17.68009 327.6963       17.77139 149.5579 4.857530 163.6491 4.460430 -14.09123      6.594773 
1 1 1 -2  20 24 o 86.47321 3.290644 91.43398       6.921583 89.59711       9.584976 93.43567       10.00577 85.45134 4.620130 87.25423 4.723350 -1.802895      6.607241 
1 1 1 -2  20 25 f 41.46413 3.766758 21.18355       3.764573 22.92599       6.276269 20.20439       4.704881 42.76903 6.202728 40.32820 4.887037 2.440830       7.896643 
1 1 1 -2  20 26 o 163.8663 3.344896 328.0424       13.35698 332.6628       19.53516 323.9860       18.30413 164.7025 4.872574 162.5905 4.624441 2.112061       6.717696 
1 1 1 -2  20 27 o 156.6328 3.298745 299.7719       12.59121 310.4646       18.54536 290.6279       17.14975 159.0844 4.789239 153.9593 4.576126 5.125076       6.624027 
1 1 1 -2  20 28 o 57.53671 3.419466 40.61358       4.772831 40.60162       7.445930 40.62191       6.218333 57.23757 5.402188 57.40258 4.480833 -0.1650162     7.018653 
1 1 1 -2  20 29 o 68.56416 3.288633 57.61174       5.478739 66.11395       8.299021 51.04391       7.294103 73.25661 4.673200 64.32865 4.685099 8.927956       6.617322 
1 1 1 -2  20 30 o 57.01638 3.508390 39.93819       4.851046 37.47197       7.239029 41.94841       6.535601 54.88844 5.485470 58.26403 4.641423 -3.375599      7.185624 
1 1 1 -2  20 31 o 105.1862 4.517147 136.2236       11.55170 142.6121       15.18351 127.4438       17.79979 107.2629 5.830723 100.8936 7.288743 6.369339       9.333975 
1 1 1 -2  20 32 o 117.7017 3.832951 170.2363       10.97924 157.9160       12.85785 203.4013       21.09583 113.1239 4.674274 127.5382 6.812381 -14.41424      8.261803 
1 1 1 -2  20 33 o 103.7313 3.095616 131.9987       7.816405 125.7078       11.21052 137.9502       10.90399 100.8232 4.574693 105.7359 4.240417 -4.912651      6.237704 
1 1 1 -2  20 34 o 65.83662 3.401695 53.42102       5.439059 61.63453       8.183270 46.92111       7.279746 70.34654 4.802424 61.30330 4.914124 9.043243       6.871091 
1 1 1 -2  20 35 o 52.30828 4.068840 34.07442       5.145767 27.04131       6.558487 45.33728       8.299538 45.95871 5.999038 59.77954 5.768825 -13.82084      8.322728 
1 1 1 -2  20 36 o 20.90372 6.483332 5.626307       3.644949 4.764600       5.168217 6.479081       5.141360 20.82576 7.696836 22.77590 7.747958 -1.950134      10.92118 
1 1 1 -2  20 37 f 63.80148 4.105406 51.12571       6.349094 50.63340       11.96175 51.31880       7.491488 60.84507 8.282198 63.53741 4.875661 -2.692341      9.610768 
1 1 1 -2  20 38 o 97.97417 3.155430 119.4502       7.523839 114.6710       10.65226 124.2080       10.62840 94.86744 4.621655 98.92482 4.420026 -4.057381      6.395023 
1 1 1 -2  20 39 o 29.64570 5.383341 11.79478       3.745907 10.06912       5.168263 13.70456       5.436970 26.35800 7.618344 30.91874 7.328558 -4.560743      10.57104 
1 1 1 -2  20 40 o 35.03275 4.900374 16.37835       4.069214 9.144171       5.373945 26.10071       6.229951 24.60335 7.904240 43.44780 6.047820 -18.84444      9.952544 
1 1 1 -2  20 41 o 13.82621 6.018476 0.5090593      3.794476 4.902222       5.195622 -4.512433      5.554760 19.25650 7.567290 13.22696 6.293352 6.029538       9.842264 
1 1 1 -2  20 42 o 9.974314 4.796453 -3.917603      3.417217 -2.816947      4.714954 -5.135481      4.959678 12.65180 5.952954 11.90090 5.736954 0.7509022      8.267424 
1 1 1 -2  20 43 o 23.48221 6.539674 8.826576       3.880179 13.05517       5.634131 5.011489       5.351568 27.02292 7.994809 18.38229 7.520171 8.640629       10.97588 
1 1 1 -2  20 44 o 10.50184 5.200067 -7.867278      4.967224 -7.867278      4.967224 0.000000       0.000000 10.50184 5.200067 ?        ?        0.000000       5.200067 
1 1 1 -2  20 45 o 14.24888 6.321718 1.907279       4.373137 11.92147       8.745748 -1.431321      5.049764 20.72315 9.076423 12.81006 6.067488 7.913093       10.91769 
1 1 1 -2  20 46 o 14.62411 6.246090 3.097554       3.938745 -0.7555290     5.812954 6.368142       5.355568 13.38848 6.389103 17.49959 7.370196 -4.111115      9.753996 
1 1 1 -2  21 1  o 129.2730 3.138890 203.6883       9.888261 234.5817       20.10330 193.8286       11.35711 138.5421 5.968559 126.0429 3.701553 12.49919       7.023189 
1 1 1 -2  21 2  o 186.2242 3.545646 422.7316       16.09043 432.6820       31.66975 419.2694       18.68121 188.1634 6.918524 185.4458 4.133824 2.717651       8.059434 
1 1 1 -2  21 3  o 186.5460 3.521298 424.1953       16.00754 388.8261       21.49489 468.2360       23.98552 178.4937 4.946467 195.8822 5.028951 -17.38847      7.053926 
1 1 1 -2  21 4  o 412.2591 5.568715 2073.157       55.94500 1953.271       84.93625 2165.027       74.35228 399.8375 8.717129 421.1314 7.245036 -21.29391      11.33485 
1 1 1 -2  21 5  o 307.5337 5.623024 1153.746       42.14041 1150.167       51.43460 1161.053       73.49680 306.9657 6.875898 307.9770 9.805458 -1.011322      11.97602 
1 1 1 -2  21 6  o 76.12806 2.823082 70.73431       5.228190 62.90227       7.836811 77.01573       7.018279 71.68007 4.509320 79.39946 3.636904 -7.719391      5.793189 
1 1 1 -2  21 7  o 458.1348 6.842994 2562.494       76.39686 2731.476       159.7917 2512.422       86.98226 471.3188 13.92772 453.4901 7.870944 17.82877       15.99791 
1 1 1 -2  21 8  o 59.82582 3.006996 43.73807       4.369814 42.05392       6.448714 45.16796       5.942034 58.54432 4.555987 60.72852 4.038132 -2.184200      6.087983 
1 1 1 -2  21 9  o 153.8929 3.726437 288.7670       13.97490 293.3235       25.23335 286.7510       16.78400 154.8372 6.703375 153.2645 4.498710 1.572723       8.073019 
1 1 1 -2  21 10 o 139.6007 3.177936 237.5875       10.81108 282.3991       24.09706 226.2946       12.09686 151.9224 6.524083 136.1818 3.648456 15.74062       7.474950 
1 1 1 -2  21 11 o 172.5907 3.428346 363.2049       14.41910 338.1885       20.67419 386.8992       20.12045 166.3906 5.104789 178.0180 4.642033 -11.62747      6.899807 
1 1 1 -2  21 12 o 193.5443 3.219705 456.7429       15.18562 446.1638       24.27841 463.5414       19.46272 191.1100 5.218041 194.9371 4.097065 -3.827164      6.634297 
1 1 1 -2  21 13 o 395.8081 5.387216 1913.074       51.96192 1904.588       82.48355 1918.657       66.90762 394.2625 8.585109 396.0998 6.931622 -1.837372      11.03411 
1 1 1 -2  21 14 o 175.9528 3.074151 377.5272       13.18128 373.3270       21.35050 380.1142       16.75583 174.7827 5.017913 176.5116 3.895439 -1.728912      6.352472 
1 1 1 -2  21 15 f 187.9694 3.154019 430.9138       14.44733 431.4423       23.43504 430.5898       18.34891 187.8701 5.123628 187.8442 4.008449 0.2592468E-01  6.505323 
1 1 1 -2  21 16 o 164.4712 2.964232 329.9026       11.88060 312.0009       18.99444 341.4070       15.22681 159.7463 4.885062 167.2691 3.735572 -7.522720      6.149661 
1 1 1 -2  21 17 o 108.4297 2.623613 143.3655       6.932407 161.7617       12.28298 134.7665       8.397751 115.0118 4.390600 105.0531 3.284370 9.958702       5.483107 
1 1 1 -2  21 18 o 171.9009 3.858195 360.7118       16.16213 352.6939       28.03705 364.7022       19.77918 169.5184 6.800830 172.7086 4.703951 -3.190247      8.269126 
1 1 1 -2  21 19 o 137.4903 3.121757 230.6307       10.45941 226.8647       15.28955 233.9434       14.33978 136.1806 4.613929 138.3315 4.258953 -2.150940      6.279094 
1 1 1 -2  21 20 o 144.5071 3.143212 254.8090       11.06876 267.6164       24.99481 251.6846       12.34526 147.5143 6.972857 143.5914 3.528060 3.922897       7.814598 
1 1 1 -2  21 21 f 68.54218 3.542571 57.51140       5.897073 69.85086       13.46105 54.58081       6.560074 75.01795 7.462236 66.71864 4.053965 8.299316       8.492326 
1 1 1 -2  21 22 o 75.54320 3.073279 69.76444       5.645804 69.94408       9.038268 69.64950       7.229865 75.44350 4.943407 75.39983 3.948570 0.4367065E-01  6.326806 
1 1 1 -2  21 23 o 74.08968 3.376361 67.17007       6.079946 69.24188       8.816916 65.29169       8.395256 75.05929 4.846224 72.89014 4.752297 2.169151       6.787505 
1 1 1 -2  21 24 o 25.61941 5.412836 8.348348       3.273302 7.269516       5.968287 8.812460       3.914572 24.95801 8.347749 26.26525 6.213748 -1.307243      10.40652 
1 1 1 -2  21 25 o 220.7462 3.916913 595.8596       21.07042 618.8110       30.96551 576.0701       28.75345 224.4509 5.665889 216.6210 5.451278 7.829895       7.862489 
1 1 1 -2  21 26 o 154.9188 3.315008 293.2429       12.51482 296.6631       18.39557 290.2959       17.07535 155.4959 4.860621 153.8809 4.558560 1.615021       6.663791 
1 1 1 -2  21 27 o 68.97297 3.261156 58.26786       5.465815 55.07890       8.363039 60.64576       7.221624 66.78516 5.179086 70.24585 4.238412 -3.460686      6.692314 
1 1 1 -2  21 28 o 123.4796 3.152120 186.4854       9.477177 193.1501       14.15773 181.0742       12.75696 125.3931 4.641236 121.4719 4.316443 3.921211       6.338198 
1 1 1 -2  21 29 o 20.07656 6.470499 4.856989       3.599260 8.253831       5.715406 2.624503       4.633443 25.83847 8.134344 18.39455 7.170285 7.443922       10.84346 
1 1 1 -2  21 30 o 100.2837 3.415982 123.2604       8.335805 132.6916       14.64719 118.7425       10.13762 103.4839 5.831850 98.26923 4.243335 5.214699       7.212237 
1 1 1 -2  21 31 o 70.98282 4.199813 62.13003       7.232257 63.47679       8.614514 58.91409       13.31189 71.58254 4.969264 67.98946 8.199957 3.593086       9.588163 
1 1 1 -2  21 32 o 45.90267 3.931762 26.08932       4.355745 28.56955       6.710991 24.28397       5.725603 47.59701 5.913009 43.94217 5.464650 3.654835       8.051463 
1 1 1 -2  21 33 o 86.12743 3.132631 91.14235       6.563911 78.61654       9.496216 102.6020       9.083102 79.48653 4.926755 91.12324 4.100939 -11.63670      6.410196 
1 1 1 -2  21 34 o 33.71032 5.613901 14.59202       4.449616 17.60082       6.315122 11.62556       6.270532 36.53569 7.347887 29.51597 8.347093 7.019722       11.12049 
1 1 1 -2  21 35 o 72.38725 3.306261 64.77554       5.816841 62.48147       8.550731 66.75169       7.936120 70.43795 5.014291 73.05225 4.479523 -2.614304      6.723782 
1 1 1 -2  21 36 o 25.21535 6.163412 8.481897       3.754803 5.717569       5.411758 11.04784       5.213952 21.91613 7.910667 28.45724 7.437238 -6.541111      10.85777 
1 1 1 -2  21 37 o 38.47573 5.335829 19.29092       4.868456 29.90904       9.921469 15.92337       5.587391 45.49216 9.264710 34.14807 6.951015 11.34409       11.58238 
1 1 1 -2  21 38 o 57.33536 3.540680 41.38482       4.922905 33.17286       6.855754 50.12651       7.073424 50.02328 5.727148 62.38976 4.686694 -12.36647      7.400360 
1 1 1 -2  21 39 o 34.90152 4.905586 16.16087       4.057261 20.33454       5.805132 12.17530       5.672822 38.15453 6.474739 28.47353 7.898937 9.680996       10.21349 
1 1 1 -2  21 40 o 12.62059 5.723828 -1.143212      3.808655 1.341964       5.558268 -3.342904      5.229278 16.72491 7.282167 13.45243 6.310585 3.272479       9.636049 
1 1 1 -2  21 41 o 34.64246 5.207895 16.75285       4.260578 16.09990       5.815289 17.50948       6.259991 31.70246 7.621672 32.77549 7.925526 -1.073032      10.99563 
1 1 1 -2  21 42 o 23.57927 6.425670 8.674815       3.792163 11.65206       5.349243 5.666910       5.376719 26.00498 7.813500 19.25774 7.656927 6.747238       10.93980 
1 1 1 -2  21 43 o 12.49129 5.948226 -3.052310      4.983025 -3.052310      4.983025 0.000000       0.000000 12.49129 5.948226 ?        ?        0.000000       5.948226 
1 1 1 -2  21 44 o 19.80833 7.201680 7.281632       4.495734 8.924459       8.532525 6.650282       5.289527 19.81446 8.808413 18.81237 7.555862 1.002098       11.60514 
1 1 1 -2  21 45 o 24.52603 6.503851 10.66717       3.950056 10.94106       5.910516 10.44611       5.310050 21.64435 8.183622 21.86270 7.842978 -0.2183475     11.33508 
1 1 1 -2  21 46 o 10.51214 5.041173 -2.335111      3.716206 -11.48302      5.378314 6.022509       5.140750 9.589357 4.841166 17.01168 7.195662 -7.422327      8.672626 
1 1 1 -2  22 1  o 222.6273 3.931552 604.3234       21.32940 557.7719       40.34250 622.3848       25.12877 213.5226 7.766172 225.9019 4.564731 -12.37936      9.008340 
1 1 1 -2  22 2  o 224.9961 3.519624 617.1686       19.29778 593.1525       29.66099 634.7962       25.41151 220.4138 5.526540 228.1419 4.570770 -7.728088      7.171791 
1 1 1 -2  22 3  o 561.1505 7.370551 3846.560       100.7895 3811.900       158.5580 3870.061       130.5621 557.5474 11.66999 562.3818 9.526857 -4.834412      15.06485 
1 1 1 -2  22 4  o 537.8434 7.086364 3533.247       92.87854 3590.083       148.0818 3496.388       119.2510 541.1598 11.22898 534.5967 9.153760 6.563110       14.48728 
1 1 1 -2  22 5  o 408.5683 5.536310 2037.073       55.12152 2168.237       90.59469 1959.975       69.45763 421.0150 8.830170 400.5605 7.115670 20.45456       11.34040 
1 1 1 -2  22 6  o 131.5928 3.105162 211.1019       9.957550 230.2422       19.33847 204.1963       11.61576 137.2204 5.796245 129.3565 3.688645 7.863831       6.870411 
1 1 1 -2  22 7  o 80.10689 3.040074 78.34216       5.923813 67.35179       7.877782 92.64322       8.986318 74.17977 4.377411 87.04991 4.249045 -12.87014      6.100501 
1 1 1 -2  22 8  o 412.1196 8.858445 2079.227       88.96453 2009.899       123.3704 2154.335       128.4106 404.0469 12.54497 418.3032 12.61159 -14.25626      17.78844 
1 1 1 -2  22 9  o 198.2100 4.282828 479.2642       20.68675 485.2199       36.16505 476.3679       25.22015 199.0574 7.468709 197.4821 5.245277 1.575272       9.126585 
1 1 1 -2  22 10 o 576.5317 8.471697 4070.598       119.0227 4310.738       247.8937 3998.653       135.6857 588.3442 17.30893 570.9440 9.752240 17.40021       19.86719 
1 1 1 -2  22 11 o 234.5439 3.631549 670.9659       20.75641 649.7600       32.79503 685.1373       26.80935 230.5466 5.842023 236.9306 4.643323 -6.384094      7.462552 
1 1 1 -2  22 12 o 317.7668 5.025668 1232.994       38.91692 1264.513       56.63361 1204.795       53.56793 321.4321 7.230176 313.7932 7.005275 7.638916       10.06724 
1 1 1 -2  22 13 o 436.7936 5.883783 2332.199       62.62807 2395.833       101.2177 2292.724       79.72097 441.6031 9.405638 432.6255 7.561785 8.977509       12.06841 
1 1 1 -2  22 14 o 214.9247 3.426900 563.5073       17.94832 583.2440       29.50763 551.9169       22.61241 218.3741 5.549439 212.6236 4.364146 5.750443       7.059890 
1 1 1 -2  22 15 o 336.6070 4.715376 1383.946       38.67903 1402.302       62.26677 1372.413       49.35653 338.1821 7.555611 334.9368 6.047080 3.245361       9.677522 
1 1 1 -2  22 16 f 107.4100 3.045865 140.8387       7.964398 150.2819       12.13437 133.6917       10.55648 110.8340 4.502075 104.5600 4.151274 6.274040       6.123868 
1 1 1 -2  22 17 o 301.8050 5.566985 1114.225       40.94328 1129.461       71.76855 1106.873       49.85153 302.4819 9.749142 300.5148 6.807325 1.967041       11.89056 
1 1 1 -2  22 18 o 40.59398 4.556582 20.38674       4.429790 26.63260       10.38888 18.99880       4.897306 45.62369 9.646247 39.06310 5.279676 6.560593       10.99659 
1 1 1 -2  22 19 o 129.3902 3.053777 204.2776       9.628858 206.5197       21.68979 203.7272       10.74579 129.5458 6.895459 129.1479 3.417406 0.3979034      7.695844 
1 1 1 -2  22 20 f 229.6745 3.979761 644.4100       22.27439 667.1597       47.63435 638.0434       25.19915 232.4976 8.421388 228.4499 4.526462 4.047729       9.560786 
1 1 1 -2  22 21 o 71.74252 2.694963 62.88307       4.703193 59.28788       8.348560 64.55453       5.692451 69.42733 4.967343 72.64941 3.223397 -3.222076      5.921552 
1 1 1 -2  22 22 o 111.3911 3.423809 151.6721       9.282825 146.6415       12.40686 158.0695       13.99128 109.3746 4.665607 113.5035 5.071193 -4.128883      6.890928 
1 1 1 -2  22 23 o 118.7243 3.080617 172.2065       8.905252 163.2830       13.25544 179.5471       12.02249 115.3941 4.723826 121.1092 4.079451 -5.715111      6.241510 
1 1 1 -2  22 24 o 277.4562 4.589991 942.5767       31.03433 940.1866       44.58010 944.8241       43.22942 276.3781 6.619134 277.1496 6.400722 -0.7714844     9.207724 
1 1 1 -2  22 25 o 92.19540 3.071491 103.9290       6.891091 107.6676       10.85136 101.4023       8.920782 93.61401 4.772466 90.95119 4.034975 2.662811       6.249597 
1 1 1 -2  22 26 o 63.40683 3.389560 49.28318       5.218364 46.00274       8.268042 51.45515       6.727628 60.92252 5.632911 64.67797 4.292736 -3.755451      7.082180 
1 1 1 -2  22 27 o 123.8041 3.180083 187.4702       9.586278 195.4551       14.37523 181.0756       12.86434 126.1367 4.684814 121.4702 4.352956 4.666496       6.394976 
1 1 1 -2  22 28 o 49.20476 3.807236 29.82511       4.529641 30.88279       7.222107 29.13926       5.815691 49.66367 6.095104 48.43987 4.998467 1.223797       7.882574 
1 1 1 -2  22 29 f 73.61570 3.542996 66.51117       6.337242 49.52761       11.02552 74.89025       7.744319 62.68478 7.357632 78.03558 4.086680 -15.35080      8.416395 
1 1 1 -2  22 30 o 83.22411 4.045114 85.24075       8.179246 87.47550       9.735535 79.87842       15.08072 84.14934 4.767086 79.45094 7.893373 4.698402       9.221195 
1 1 1 -2  22 31 o 40.89877 4.581273 20.86893       4.487591 24.20699       7.045647 18.59038       5.821079 43.51249 6.872544 38.11655 6.499865 5.395943       9.459393 
1 1 1 -2  22 32 o 101.3912 3.124368 126.2185       7.710454 123.5434       11.43179 128.4510       10.44355 99.82714 4.712564 101.9696 4.211893 -2.142494      6.320467 
1 1 1 -2  22 33 o 33.06248 5.474313 13.99617       4.256424 12.64243       6.019628 15.34978       6.019358 30.80718 7.961304 34.07998 7.455768 -3.272799      10.90738 
1 1 1 -2  22 34 o 47.84204 3.889882 28.52215       4.495955 30.00026       6.806053 27.37778       5.988586 48.40453 5.891148 46.39397 5.397629 2.010551       7.989995 
1 1 1 -2  22 35 o 74.42051 3.258679 68.58758       5.895440 70.58219       8.783393 66.95223       7.953122 74.77688 4.846234 72.99988 4.492502 1.777000       6.608219 
1 1 1 -2  22 36 o 13.92482 6.128942 -0.6172646     4.032635 -8.131749      8.097785 1.860868       4.650278 15.99067 7.605546 17.04694 6.996097 -1.056273      10.33391 
1 1 1 -2  22 37 o 28.98442 5.524288 11.21524       3.759506 12.46599       5.682997 10.24193       5.013253 29.53712 7.786387 26.93500 7.407601 2.602116       10.74711 
1 1 1 -2  22 38 o 44.32587 4.121180 25.25870       4.400596 25.97021       6.361055 24.60562       6.094278 43.62418 6.154438 42.52054 6.052170 1.103642       8.631679 
1 1 1 -2  22 39 o 32.51333 5.998457 14.81134       4.577614 13.01437       7.014469 16.14433       6.041410 28.20630 9.027367 32.62973 7.719290 -4.423433      11.87774 
1 1 1 -2  22 40 o 46.25515 4.286798 28.38222       4.777052 24.19997       6.735764 32.61452       6.775959 39.95356 7.182244 47.92328 5.928435 -7.969719      9.312946 
1 1 1 -2  22 41 o 11.87682 5.425266 -1.071813      3.499729 -5.170562      4.880279 3.267529       5.021470 11.75694 5.673356 17.13214 7.170946 -5.375202      9.143820 
1 1 1 -2  22 42 o 16.95523 6.531060 4.134316       3.809790 4.351491       5.421963 3.922520       5.354386 17.79613 7.450323 17.41483 7.353799 0.3813019      10.46832 
1 1 1 -2  22 43 o 15.72786 7.114858 1.958366       5.839791 12.40155       8.700802 -6.602666      7.877816 22.36348 9.404965 13.80719 6.781170 8.556285       11.59473 
1 1 1 -2  22 44 o 37.40980 4.999296 21.00595       4.443555 23.68605       6.681746 18.88073       5.949987 34.89299 8.025506 31.21212 7.835423 3.680868       11.21618 
1 1 1 -2  22 45 o 17.62265 6.637695 5.883445       3.879982 4.340307       5.833506 7.107696       5.195920 16.05739 7.200477 18.22340 7.427115 -2.166012      10.34451 
1 1 1 -2  23 1  o 61.24431 3.471172 45.88189       5.159367 47.12465       6.875128 44.27978       7.806113 61.98230 4.584179 59.99018 5.397366 1.992115       7.081402 
1 1 1 -2  23 2  o 214.1789 3.816917 559.4263       19.92166 564.3673       28.01498 554.3718       28.33471 215.0314 5.346287 213.0411 5.462326 1.990356       7.643284 
1 1 1 -2  23 3  o 329.9363 5.182547 1328.572       41.66865 1369.132       59.77348 1290.229       58.11813 334.6580 7.329449 324.8700 7.341181 9.787964       10.37370 
1 1 1 -2  23 4  o 257.7384 4.970032 810.6701       31.21580 750.8575       51.13676 846.1968       39.41068 247.5336 8.489971 263.2167 6.144186 -15.68304      10.48001 
1 1 1 -2  23 5  o 227.2482 3.969212 629.8789       21.98067 629.7970       30.94307 629.9624       31.22964 227.1177 5.590829 227.1433 5.641973 -0.2554321E-01 7.942873 
1 1 1 -2  23 6  o 96.64719 3.047085 113.9970       7.167488 112.2258       9.872839 115.9708       10.42217 95.81898 4.238679 97.39570 4.402575 -1.576721      6.111388 
1 1 1 -2  23 7  o 272.6814 5.192360 907.7600       34.50297 0.000000       0.000000 907.7600       34.50297 ?        ?        272.6814 5.192360 0.000000       5.192360 
1 1 1 -2  23 8  o 293.8809 4.226772 1053.787       30.27027 988.1572       45.87140 1104.410       40.28738 284.2954 6.621190 300.7126 5.497704 -16.41718      8.606097 
1 1 1 -2  23 9  o 480.3706 7.171950 2823.686       83.95563 3182.358       182.3649 2727.224       94.57377 506.2574 14.79790 471.7766 8.226180 34.48077       16.93068 
1 1 1 -2  23 10 o 160.9241 3.918703 315.9687       15.36737 299.4044       26.20332 324.6527       18.97268 156.2743 6.897693 162.9962 4.781728 -6.721832      8.393038 
1 1 1 -2  23 11 o 163.3849 3.884397 325.7309       15.46577 331.0059       27.69635 323.3408       18.64315 164.2987 6.933133 162.6615 4.708209 1.637253       8.380666 
1 1 1 -2  23 12 o 198.1254 3.712603 478.9626       17.92481 467.3797       25.51863 490.2435       25.18372 195.4920 5.361701 200.2464 5.165135 -4.754379      7.444894 
1 1 1 -2  23 13 o 194.5219 3.678359 461.7300       17.43648 457.7595       25.11864 465.4226       24.22353 193.4529 5.333343 195.0988 5.099400 -1.645950      7.378918 
1 1 1 -2  23 14 o 137.2720 3.206057 229.8747       10.72480 235.1805       15.89653 225.4420       14.52978 138.6716 4.710962 135.7998 4.396393 2.871780       6.443713 
1 1 1 -2  23 15 o 184.6352 4.945805 416.9276       22.23291 0.000000       0.000000 416.9276       22.23291 ?        ?        184.6352 4.945805 0.000000       4.945805 
1 1 1 -2  23 16 o 151.5496 4.684407 280.9237       17.27920 0.000000       0.000000 280.9237       17.27920 ?        ?        151.5496 4.684407 0.000000       4.684407 
1 1 1 -2  23 17 o 226.5784 3.963281 626.9377       21.88313 636.9180       45.94662 624.0096       24.88707 227.3591 8.306841 225.9722 4.519420 1.386902       9.456678 
1 1 1 -2  23 18 o 198.0620 3.660594 478.9784       17.66805 511.2457       38.43370 470.3324       19.89482 203.7408 7.755176 196.2064 4.160933 7.534409       8.800916 
1 1 1 -2  23 19 o 125.3051 2.756716 191.5573       8.417768 182.4157       14.03910 196.6886       10.51822 122.0368 4.729720 126.8844 3.404791 -4.847603      5.827765 
1 1 1 -2  23 20 o 57.60009 2.943120 40.59454       4.117420 32.90031       7.621699 43.76543       4.892827 51.41723 6.208386 59.77576 3.372592 -8.358532      7.065299 
1 1 1 -2  23 21 o 173.5483 3.364173 367.8064       14.22771 358.7602       21.00645 375.4733       19.33886 171.0891 5.043925 175.1299 4.535238 -4.040756      6.783035 
1 1 1 -2  23 22 o 96.85641 2.667655 114.5654       6.290431 115.2380       10.93583 114.2328       7.689979 96.91741 4.643862 96.66034 3.269386 0.2570724      5.679290 
1 1 1 -2  23 23 o 226.2004 3.547602 625.2682       19.55529 654.2587       32.53097 608.8651       24.47005 230.7527 5.789717 223.0142 4.502629 7.738449       7.334473 
1 1 1 -2  23 24 o 119.3009 3.116522 173.9606       9.052697 168.3009       13.62483 178.4340       12.11301 117.0938 4.784944 120.6856 4.124763 -3.591820      6.317386 
1 1 1 -2  23 25 o 79.69805 3.186960 77.73518       6.177088 77.73136       9.869765 77.73765       7.919996 79.41970 5.127069 79.58518 4.097522 -0.1654816     6.563271 
1 1 1 -2  23 26 o 39.25528 4.413935 19.12335       4.149323 16.62765       7.374800 20.27931       5.019109 35.83615 8.562235 40.29633 5.234835 -4.460182      10.03570 
1 1 1 -2  23 27 o 53.01029 3.770780 34.58058       4.839303 36.73185       8.012208 33.34505       6.071966 54.21026 6.175013 51.87850 4.859485 2.331760       7.857822 
1 1 1 -2  23 28 o 64.59608 3.731973 51.28625       5.849624 54.81501       11.36136 50.01338       6.823563 66.04658 7.174125 63.67410 4.425098 2.372482       8.429090 
1 1 1 -2  23 29 o 116.7524 3.959041 167.4827       11.24769 177.7456       13.87476 147.8099       19.20977 120.0624 4.751609 108.5796 7.302483 11.48282       8.712294 
1 1 1 -2  23 30 o 80.47673 4.106798 79.84210       8.027335 83.40416       9.811653 72.63101       13.96022 82.04914 4.929919 75.64584 7.679366 6.403297       9.125610 
1 1 1 -2  23 31 o 97.63531 3.166319 117.0460       7.523553 118.8873       11.58098 115.7014       9.896343 97.89346 4.869913 96.78983 4.205782 1.103630       6.434645 
1 1 1 -2  23 32 o 75.53278 3.625983 70.42789       6.654678 73.50214       9.298787 67.20045       9.527658 76.72540 5.000620 73.20975 5.378022 3.515648       7.343658 
1 1 1 -2  23 33 o 25.19323 6.089793 8.334938       3.696973 9.066175       5.911365 7.865210       4.737864 26.32204 8.270697 24.52129 7.350185 1.800745       11.06479 
1 1 1 -2  23 34 o 75.21771 3.289883 70.02718       6.015684 68.58504       8.961127 71.21024       8.116385 73.68169 5.020759 75.37466 4.438413 -1.692970      6.701308 
1 1 1 -2  23 35 o 55.83012 3.584145 38.91989       4.850540 38.37429       7.397974 39.33129       6.424062 54.47677 5.654865 55.60712 4.787265 -1.130352      7.409143 
1 1 1 -2  23 36 o 54.11642 4.403748 37.31844       5.757323 42.13762       11.04050 35.51846       6.747382 54.43636 8.608625 52.23460 5.377541 2.201767       10.15019 
1 1 1 -2  23 37 o 18.36568 6.514574 4.243404       3.653452 0.9804366      5.358704 7.077422       4.994070 16.80864 7.234157 22.57318 7.636623 -5.764540      10.51908 
1 1 1 -2  23 38 o 28.31082 6.667469 11.53608       4.523467 16.15393       7.635055 9.038495       5.615030 31.47803 9.305249 24.47320 8.094450 7.004835       12.33320 
1 1 1 -2  23 39 o 27.99435 6.094068 11.30216       4.039099 12.06858       5.680641 10.51850       5.744185 27.44191 8.003340 25.51428 8.169518 1.927628       11.43654 
1 1 1 -2  23 40 f 14.02925 5.995955 1.177783       3.633883 1.028252       5.539371 1.290748       4.814671 15.99500 7.104622 15.47050 6.756052 0.5244961      9.804075 
1 1 1 -2  23 41 o 34.04203 5.201696 16.55367       4.178421 13.78540       6.158374 18.91520       5.687976 27.48755 8.409904 34.47322 7.009844 -6.985676      10.94826 
1 1 1 -2  23 42 o 20.10358 7.691983 7.298300       5.260330 15.52250       9.083684 3.148719       6.452342 24.84251 9.927538 17.01881 7.606491 7.823696       12.50659 
1 1 1 -2  23 43 o 25.75262 7.681515 12.79724       5.184326 19.17063       6.442714 1.089537       8.732112 30.89634 8.357005 16.33232 7.804017 14.56402       11.43426 
1 1 1 -2  23 44 o 16.49501 6.542202 4.740148       3.915866 -1.246511      5.630442 10.34866       5.449720 13.23427 6.307857 21.58390 7.916241 -8.349626      10.12205 
1 1 1 -2  23 45 o 14.80908 6.212280 3.473372       3.781310 6.548772       5.828082 1.237634       4.969185 17.31107 7.497633 13.69591 6.331851 3.615154       9.813604 
1 1 1 -2  24 1  o 47.57031 3.581093 27.75617       4.120854 28.75769       5.810719 26.74282       5.844966 48.27650 5.012070 46.50566 5.249126 1.770847       7.257697 
1 1 1 -2  24 2  o 210.7962 3.407794 541.9127       17.50541 525.3348       26.86541 554.1448       23.07698 207.3426 5.321425 213.0936 4.443983 -5.751053      6.933004 
1 1 1 -2  24 3  o 237.6461 3.664717 688.8672       21.22302 661.8378       32.46847 709.0308       28.04322 232.7567 5.724315 241.0085 4.774846 -8.251770      7.454323 
1 1 1 -2  24 4  o 310.7932 4.951696 1179.297       37.50261 1193.397       53.27979 1165.451       52.79691 312.3323 7.000185 308.6502 7.019495 3.682098       9.913421 
1 1 1 -2  24 5  o 156.9027 4.742036 300.8069       18.11059 0.000000       0.000000 300.8069       18.11059 ?        ?        156.9027 4.742036 0.000000       4.742036 
1 1 1 -2  24 6  o 357.6325 4.962040 1561.784       43.24475 1506.143       66.58208 1602.381       56.87363 350.6485 7.792006 361.9814 6.447459 -11.33295      10.11361 
1 1 1 -2  24 7  o 236.9282 4.069861 685.0157       23.49808 693.4246       33.29671 676.6726       33.16629 238.1993 5.736205 235.2986 5.784176 2.900787       8.146211 
1 1 1 -2  24 8  o 137.7298 3.583032 231.5750       12.01561 244.6501       14.98347 208.0167       20.11229 141.5044 4.350334 130.2545 6.355437 11.24986       7.701752 
1 1 1 -2  24 9  o 48.41426 3.781025 28.77450       4.425509 35.68297       5.957137 20.26612       6.611045 53.86581 4.581687 40.10748 7.019657 13.75833       8.382567 
1 1 1 -2  24 10 o 249.4329 4.910048 760.0230       29.84527 745.0021       51.63887 767.5574       36.57222 246.1531 8.621967 250.5096 5.990883 -4.356476      10.49900 
1 1 1 -2  24 11 o 82.03991 3.152378 82.22011       6.290581 95.52481       13.94830 78.82307       7.048051 88.09289 6.544216 80.29156 3.611404 7.801331       7.474557 
1 1 1 -2  24 12 f 200.0345 3.698065 488.3287       18.02667 502.2213       37.57528 484.1753       20.54541 202.1902 7.639906 199.1324 4.233862 3.057724       8.734630 
1 1 1 -2  24 13 o 177.4185 3.478497 384.1087       15.03927 362.0600       30.44293 391.2269       17.29738 171.6638 7.293948 179.0148 3.965111 -7.351044      8.302034 
1 1 1 -2  24 14 o 254.7415 4.915523 793.1906       30.51445 0.000000       0.000000 793.1906       30.51445 ?        ?        254.7415 4.915523 0.000000       4.915523 
1 1 1 -2  24 15 o 171.5991 3.895340 359.5525       16.28908 306.2572       28.14502 386.3953       19.97431 157.7769 7.340304 177.7536 4.615140 -19.97672      8.670616 
1 1 1 -2  24 16 o 134.4265 2.836705 220.4478       9.292553 213.9734       15.25902 224.2644       11.71557 132.2088 4.743893 135.4920 3.551307 -3.283234      5.925900 
1 1 1 -2  24 17 o 140.6016 2.867408 241.1936       9.824624 227.9360       16.03904 249.1553       12.42937 136.4312 4.831865 142.8510 3.570505 -6.419754      6.007947 
1 1 1 -2  24 18 f 93.90121 2.708419 107.6625       6.191119 122.3928       11.25769 101.2758       7.412734 99.93108 4.635510 91.01931 3.347722 8.911766       5.717971 
1 1 1 -2  24 19 o 69.42786 2.806572 58.91436       4.738601 67.76421       8.933992 55.45008       5.589642 74.24027 4.966785 67.30018 3.419459 6.940094       6.030063 
1 1 1 -2  24 20 o 141.9615 3.143227 246.0452       10.87383 237.1287       16.32477 253.1563       14.57876 139.0953 4.823431 143.8306 4.163807 -4.735275      6.372031 
1 1 1 -2  24 21 o 91.11208 2.739021 101.4054       6.074548 97.34290       10.61102 103.3858       7.408691 89.01389 4.910768 91.94481 3.311984 -2.930916      5.923249 
1 1 1 -2  24 22 o 174.0399 3.390328 370.0659       14.37893 368.3923       21.51606 371.4165       19.32906 173.2767 5.101050 174.1083 4.559626 -0.8316193     6.841849 
1 1 1 -2  24 23 o 157.3893 2.965672 302.5060       11.37455 314.0227       19.24649 296.3245       14.10052 159.9628 4.943309 155.6730 3.716942 4.289841       6.184817 
1 1 1 -2  24 24 f 165.8748 3.031523 336.1159       12.25399 353.6776       20.83302 326.8257       15.15241 169.6933 5.043520 163.4453 3.804288 6.248001       6.317413 
1 1 1 -2  24 25 o 72.62615 3.237228 64.60527       5.714913 65.36128       9.185083 64.12773       7.300024 72.75026 5.215593 72.23305 4.164832 0.5172119      6.674447 
1 1 1 -2  24 26 o 9.772414 4.693237 -4.745947      3.247351 -4.437118      6.282950 -4.858519      3.793301 15.69622 7.206970 10.91033 5.193806 4.785889       8.883470 
1 1 1 -2  24 27 o 104.8442 3.479562 134.7164       8.877748 119.6184       16.42137 140.9515       10.55285 97.93562 6.925362 107.1366 4.049282 -9.200996      8.022302 
1 1 1 -2  24 28 f 42.91204 6.123704 23.25656       6.222246 21.65402       7.415337 27.06976       11.43859 40.97987 7.708320 45.14270 10.58307 -4.162827      13.09273 
1 1 1 -2  24 29 f 80.03597 4.332898 79.06593       8.419327 83.28249       10.37246 70.92239       14.41482 81.91388 5.223441 74.60975 8.055827 7.304131       9.601078 
1 1 1 -2  24 30 o 85.15865 3.212296 89.08099       6.654282 90.48625       10.62455 88.17396       8.535807 85.29826 5.135116 84.49339 4.158359 0.8048706      6.607675 
1 1 1 -2  24 31 o 73.13632 3.671145 66.04169       6.521987 65.88647       9.233989 66.19621       9.213013 72.55333 5.258395 72.73375 5.232896 -0.1804199     7.418485 
1 1 1 -2  24 32 o 51.76144 3.768030 33.27541       4.720329 32.08774       7.242107 34.15263       6.224063 50.08499 6.056501 52.08729 4.963432 -2.002304      7.830509 
1 1 1 -2  24 33 o 8.943055 4.381754 -6.161528      3.228623 -0.9106373E-01 5.543209 -9.278215      3.971887 16.87287 7.309961 9.268265 4.599829 7.604609       8.636780 
1 1 1 -2  24 34 o 50.77440 3.781885 32.27596       4.645782 26.97366       7.178519 36.09731       6.094119 45.09645 6.738509 53.31705 4.739735 -8.220596      8.238482 
1 1 1 -2  24 35 o 59.81974 5.889048 46.90165       8.473516 42.25453       11.53504 52.34866       12.48838 54.32172 9.030787 60.89927 8.658791 -6.577553      12.51119 
1 1 1 -2  24 36 f 29.21813 5.826018 11.57947       4.002617 7.840374       6.204145 14.24536       5.238656 23.83631 8.485865 31.87470 6.941414 -8.038393      10.96326 
1 1 1 -2  24 37 o 29.56961 6.159375 12.21410       4.294014 11.97276       7.646000 12.32528       5.189723 27.43771 9.445354 28.97891 7.341622 -1.541204      11.96303 
1 1 1 -2  24 38 o 42.54642 4.422013 23.91456       4.517984 27.02084       6.598695 21.17334       6.198825 43.51129 6.415568 37.97235 6.955166 5.538940       9.462233 
1 1 1 -2  24 39 o 49.90026 4.102775 32.91954       4.945008 30.62740       6.956464 35.26087       7.030723 45.68226 6.426321 49.64697 5.928287 -3.964706      8.743122 
1 1 1 -2  24 40 o 31.91825 5.700202 14.86256       4.270988 16.46196       6.378909 13.56294       5.750095 30.67350 8.323488 28.04610 8.013863 2.627399       11.55433 
1 1 1 -2  24 41 o 15.44158 6.871615 1.587411       5.206530 -7.580441      8.737847 6.634356       6.483133 14.56982 7.152899 19.66624 8.183421 -5.096420      10.86887 
1 1 1 -2  24 42 o 20.67872 7.361645 7.941620       4.669153 6.850722       5.717838 10.12498       8.089144 19.12346 7.792235 20.94021 8.947668 -1.816748      11.86506 
1 1 1 -2  24 43 f 15.17509 6.290218 3.363245       3.809521 8.366603       5.984598 -0.4524580E-01 4.939526 19.55776 7.970907 13.39919 6.235240 6.158573       10.11996 
1 1 1 -2  24 44 o 13.42464 5.932263 1.785389       3.813474 -6.247053      5.830862 7.789204       5.041069 11.46419 5.668885 18.95250 7.452054 -7.488312      9.363192 
1 1 1 -2  25 1  o 245.1887 3.753643 733.5026       22.42794 676.8334       33.48718 779.5995       30.20236 235.2982 5.840148 252.6534 4.905459 -17.35515      7.626982 
1 1 1 -2  25 2  o 41.32667 4.366879 21.07970       4.331388 21.53121       5.702935 20.46421       6.658495 41.57448 5.785593 40.30853 7.034388 1.265945       9.108002 
1 1 1 -2  25 3  o 78.71992 3.130304 75.69716       5.992949 69.23860       7.931065 84.29269       9.149552 75.18758 4.347154 82.96678 4.542760 -7.779205      6.287640 
1 1 1 -2  25 4  o 167.3661 3.432921 341.7080       14.00127 313.0263       26.79797 352.4774       16.42080 159.7545 6.899821 169.9495 3.964957 -10.19495      7.957916 
1 1 1 -2  25 5  o 61.93947 3.028007 46.90115       4.556615 40.62785       6.551150 52.78027       6.341993 57.48661 4.717908 65.64252 3.983396 -8.155903      6.174634 
1 1 1 -2  25 6  o 148.6365 2.912255 269.4296       10.54851 274.2538       16.50002 266.0951       13.71797 149.7988 4.525206 147.6175 3.816634 2.181305       5.919813 
1 1 1 -2  25 7  o 118.4212 3.105731 171.1660       8.954766 172.2907       12.36992 169.9276       12.97999 118.7175 4.282805 117.8767 4.527082 0.8408051      6.231925 
1 1 1 -2  25 8  o 196.6421 3.270542 471.7153       15.67229 487.5710       24.92335 461.3452       20.15595 199.6802 5.126188 194.3880 4.254983 5.292267       6.662033 
1 1 1 -2  25 9  o 288.6655 4.193942 1017.375       29.50213 967.6279       45.09583 1054.597       39.00782 281.1008 6.583218 293.6927 5.450326 -12.59192      8.546626 
1 1 1 -2  25 10 o 140.8645 3.239510 242.0803       11.12031 265.2222       23.78053 235.6036       12.58056 146.9964 6.655903 138.8898 3.720360 8.106567       7.625098 
1 1 1 -2  25 11 o 265.6169 5.094668 862.4582       32.97674 881.3160       59.01064 853.8950       39.76530 267.4113 9.068663 264.0920 6.178925 3.319275       10.97359 
1 1 1 -2  25 12 o 66.47289 3.250692 54.04259       5.249736 62.11116       11.87356 52.08205       5.852890 70.83434 6.968749 65.21607 3.697967 5.618263       7.889132 
1 1 1 -2  25 13 f 83.63241 3.534343 85.52473       7.186860 0.000000       0.000000 85.52473       7.186860 ?        ?        83.63241 3.534343 0.000000       3.534343 
1 1 1 -2  25 14 o 175.1750 3.136965 374.4490       13.39115 376.5214       22.00067 373.2294       16.87768 175.3643 5.153829 174.8126 3.961904 0.5516357      6.500664 
1 1 1 -2  25 15 o 78.90073 3.293938 76.11518       6.319407 84.13815       10.06621 70.89646       8.118586 82.78287 5.013373 76.03633 4.400301 6.746536       6.670574 
1 1 1 -2  25 16 o 110.7768 3.053662 149.8716       8.235524 161.3214       13.21612 142.6033       10.52990 114.7497 4.736427 107.9625 4.009317 6.787262       6.205511 
1 1 1 -2  25 17 o 142.2596 2.893518 246.9620       10.03099 245.4134       16.68646 247.8383       12.55224 141.5372 4.845052 142.4050 3.620031 -0.8677979     6.048070 
1 1 1 -2  25 18 o 188.3163 3.568746 433.1686       16.37720 459.1275       24.98596 413.6158       21.68496 193.5167 5.303360 183.7623 4.846691 9.754318       7.184430 
1 1 1 -2  25 19 o 47.56044 3.621893 27.79524       4.166191 32.37971       7.475999 25.73019       5.017526 50.99191 6.139729 45.62856 4.574111 5.363346       7.656288 
1 1 1 -2  25 20 o 19.36772 5.994860 4.589395       3.118192 1.088664       5.974176 5.900180       3.655649 18.92766 7.864155 21.75058 6.441117 -2.822916      10.16528 
1 1 1 -2  25 21 o 53.68251 3.179085 35.32082       4.140207 35.86386       7.960982 35.11950       4.847290 53.65961 6.202147 53.46786 3.743892 0.1917572      7.244539 
1 1 1 -2  25 22 o 103.2625 3.029104 130.3478       7.614179 167.8164       19.25082 123.3991       8.290201 116.4610 6.812920 100.4280 3.392330 16.03306       7.610767 
1 1 1 -2  25 23 o 109.9975 3.057390 147.9335       8.187448 142.4554       18.75965 149.2224       9.099856 107.0954 7.230545 110.4333 3.385412 -3.337944      7.983846 
1 1 1 -2  25 24 o 125.9137 2.797995 193.6582       8.585313 191.1895       14.62663 194.9559       10.60422 124.7118 4.821916 126.2063 3.451196 -1.494499      5.929724 
1 1 1 -2  25 25 o 49.34438 3.246818 29.90436       3.882504 22.65322       7.331749 32.73012       4.576909 42.12983 7.411882 51.57930 3.665213 -9.449478      8.268602 
1 1 1 -2  25 26 o 81.87427 2.983534 82.07391       5.942753 70.49265       13.58640 84.81390       6.608458 74.86530 7.550143 83.19200 3.266083 -8.326706      8.226296 
1 1 1 -2  25 27 o 90.79531 4.137062 101.4449       9.129539 109.1415       11.14211 85.72113       15.92560 94.00537 4.880547 82.29964 8.043313 11.70573       9.408221 
1 1 1 -2  25 28 o 79.33850 4.285203 77.67657       8.254232 69.16035       9.792628 98.57581       15.34055 74.56049 5.426725 88.45499 7.178404 -13.89451      8.998824 
1 1 1 -2  25 29 o 61.17598 3.482615 46.10533       5.170406 44.87935       8.545692 46.81326       6.493835 59.73135 5.950012 61.45527 4.364568 -1.723919      7.379167 
1 1 1 -2  25 30 o 64.16779 3.859570 50.94203       6.007309 45.63054       8.721663 55.73646       8.286284 60.05201 6.041883 66.75146 5.133448 -6.699455      7.928218 
1 1 1 -2  25 31 o 38.11845 4.607549 18.31710       4.193231 16.68245       6.847793 19.29777       5.303935 35.23501 8.139091 38.78264 5.789082 -3.547634      9.987906 
1 1 1 -2  25 32 o 71.51328 3.334432 63.28299       5.794919 63.92258       9.150008 62.85464       7.488070 71.04339 5.323926 70.88918 4.355679 0.1542053      6.878672 
1 1 1 -2  25 33 o 29.64598 5.385453 11.47778       3.747406 10.52727       6.101305 12.05355       4.748647 27.65871 8.352324 29.93814 6.678810 -2.279430      10.69429 
1 1 1 -2  25 34 o 45.89171 6.829084 28.34197       7.404835 23.65764       10.00404 34.01828       11.01248 39.57282 10.28193 48.20317 9.711100 -8.630352      14.14296 
1 1 1 -2  25 35 o 21.19974 7.111632 6.018901       4.331252 8.412629       9.034357 5.304523       4.935418 25.44242 9.984493 20.61141 7.537661 4.831013       12.51025 
1 1 1 -2  25 36 o 56.64113 4.171530 41.26532       5.717495 34.52059       9.805021 44.74030       7.037898 47.82748 8.734441 58.33376 4.999082 -10.50628      10.06386 
1 1 1 -2  25 37 o 15.86743 6.260485 2.627023       3.568662 -1.123912      5.244498 5.861373       4.869986 14.78805 6.710723 20.47153 7.487367 -5.683485      10.05457 
1 1 1 -2  25 38 o 20.46261 6.623215 6.246440       3.768615 4.864634       5.607113 7.384965       5.089639 19.27350 7.765982 21.75421 7.691744 -2.480715      10.93039 
1 1 1 -2  25 39 o 29.45409 6.225563 12.99161       4.328447 12.27299       6.561281 13.54532       5.759489 25.96799 8.753281 28.25374 8.002997 -2.285755      11.86035 
1 1 1 -2  25 40 o 38.78444 7.067159 24.15997       6.433399 18.60579       9.877511 28.25206       8.478330 27.56146 10.54164 38.83677 9.115761 -11.27531      13.93640 
1 1 1 -2  25 41 o 18.03553 6.613592 5.331076       3.803464 9.065024       5.960442 2.766250       4.939957 21.34639 8.182769 15.81074 6.874883 5.535648       10.68746 
1 1 1 -2  25 42 o 33.10070 6.913283 19.03125       5.396264 20.73870       6.698537 15.87455       9.107994 31.81018 8.485150 23.18284 9.677275 8.627340       12.87041 
1 1 1 -2  25 43 o 11.17990 5.218672 -0.9674751     3.503282 -6.347157      5.604124 2.483316       4.488371 11.30704 5.584988 14.51820 6.424701 -3.211159      8.512865 
1 1 1 -2  26 1  o 112.5394 2.809901 154.4550       7.706045 160.2084       11.74626 150.1078       10.21042 114.4751 4.217892 110.8398 3.785730 3.635338       5.667659 
1 1 1 -2  26 2  o 129.4438 2.859883 204.3484       9.021229 215.9784       14.11758 196.3223       11.72805 132.9235 4.364271 126.7747 3.800561 6.148781       5.787152 
1 1 1 -2  26 3  o 136.4935 3.254075 227.2767       10.82370 204.1112       20.36761 236.3933       12.77720 128.9563 6.502272 139.1244 3.772222 -10.16814      7.517260 
1 1 1 -2  26 4  o 158.9046 3.002457 307.9861       11.62651 296.5032       17.78117 316.5620       15.36657 155.7274 4.690885 161.0430 3.915606 -5.315674      6.110349 
1 1 1 -2  26 5  o 119.7801 2.805080 174.9756       8.187779 186.2148       12.89063 167.3747       10.60085 123.4165 4.292661 117.0497 3.721230 6.366829       5.681064 
1 1 1 -2  26 6  o 210.8135 3.419907 542.2672       17.56907 514.5606       26.82682 563.0752       23.24843 205.0762 5.372693 214.7163 4.443165 -9.640106      6.971911 
1 1 1 -2  26 7  o 140.0860 2.865481 239.3512       9.782019 216.7972       14.58205 257.8051       13.19016 133.1484 4.500607 145.2876 3.728590 -12.13916      5.844471 
1 1 1 -2  26 8  o 112.9024 3.057889 155.6128       8.405449 165.3604       15.74974 151.7307       9.939261 116.1344 5.581482 111.4372 3.665043 4.697243       6.677236 
1 1 1 -2  26 9  o 227.0839 3.560482 629.3703       19.70294 625.1179       30.82072 632.3092       25.62226 226.0375 5.595336 227.4830 4.622026 -1.445496      7.257473 
1 1 1 -2  26 10 o 65.58114 3.401845 52.62841       5.418043 43.35212       10.52435 55.97343       6.319860 58.95810 7.494258 67.59940 3.852390 -8.641293      8.426435 
1 1 1 -2  26 11 o 135.7022 3.676740 224.9838       12.14746 0.000000       0.000000 224.9838       12.14746 ?        ?        135.7022 3.676740 0.000000       3.676740 
1 1 1 -2  26 12 f 90.73130 3.139080 100.5749       6.930123 105.9583       14.95693 99.10319       7.820208 92.70544 6.665145 90.02839 3.571621 2.677048       7.561788 
1 1 1 -2  26 13 o 262.2022 5.065207 841.1222       32.36456 0.000000       0.000000 841.1222       32.36456 ?        ?        262.2022 5.065207 0.000000       5.065207 
1 1 1 -2  26 14 o 82.50706 3.128382 83.20144       6.278553 78.11731       12.97435 84.75611       7.174571 79.48139 6.762764 83.23928 3.545089 -3.757889      7.635616 
1 1 1 -2  26 15 o 163.3309 3.068381 325.5940       12.21275 337.5467       20.60722 319.1231       15.16238 165.9777 5.100927 161.6214 3.849749 4.356339       6.390621 
1 1 1 -2  26 16 o 158.0034 3.035683 304.7206       11.68851 313.5008       19.61492 299.8860       14.55497 159.9395 5.038915 156.6657 3.812424 3.273727       6.318643 
1 1 1 -2  26 17 o 75.17464 3.192603 69.12269       5.835290 77.26695       9.762709 64.59579       7.278548 79.26627 5.080877 72.56967 4.132879 6.696594       6.549504 
1 1 1 -2  26 18 o 78.67731 2.892712 75.66121       5.536697 77.80472       9.912226 74.68913       6.675098 79.51943 5.142771 78.11070 3.515812 1.408730       6.229689 
1 1 1 -2  26 19 o 136.0114 2.897534 225.8374       9.603730 221.1734       16.05848 228.4344       11.98278 134.2680 4.916200 136.6725 3.600967 -2.404465      6.093931 
1 1 1 -2  26 20 o 62.18782 3.101398 47.35004       4.685180 47.70798       8.675241 47.20264       5.566830 62.05148 5.804473 62.02731 3.699702 0.2416992E-01  6.883292 
1 1 1 -2  26 21 o 102.2878 2.799881 127.8466       6.972539 129.8210       12.26812 126.9046       8.474267 102.7741 4.912671 101.8389 3.419550 0.9352417      5.985621 
1 1 1 -2  26 22 o 34.37582 4.354183 14.70581       3.565802 18.83686       7.134524 13.33029       4.116872 38.29181 7.907784 32.51818 5.383430 5.773632       9.566314 
1 1 1 -2  26 23 o 100.5090 2.792402 123.4952       6.832788 134.8044       12.45286 118.6239       8.172953 104.6641 4.895989 98.42444 3.412695 6.239655       5.968014 
1 1 1 -2  26 24 o 82.02820 2.799662 82.30853       5.588148 90.30859       10.56546 79.20136       6.584518 85.55038 5.090953 80.39171 3.368527 5.158669       6.104488 
1 1 1 -2  26 25 o 80.16091 2.998029 78.69087       5.846133 97.50861       14.75381 75.18598       6.367335 88.34624 6.907873 78.30413 3.344555 10.04211       7.674943 
1 1 1 -2  26 26 o 66.22828 3.652388 53.93788       5.871806 47.31105       8.796824 59.26301       7.885668 61.53412 5.940185 69.22829 4.702231 -7.694172      7.576066 
1 1 1 -2  26 27 o 112.9173 3.292805 156.4118       9.051041 149.4907       13.24966 162.4673       12.39340 109.9175 4.959317 114.7697 4.439635 -4.852173      6.656214 
1 1 1 -2  26 28 o 19.31534 5.583835 4.741642       2.776199 4.981764       6.232012 4.682193       3.100876 22.40774 8.418271 19.36812 5.975310 3.039614       10.32335 
1 1 1 -2  26 29 o 23.84706 6.407647 7.402323       3.802803 13.92102       6.509679 4.025278       4.685410 32.32688 8.240099 19.78313 7.325420 12.54375       11.02547 
1 1 1 -2  26 30 f 30.76767 5.256083 12.14949       3.799460 14.92032       6.594796 10.77283       4.648465 33.29437 8.186435 28.55737 6.781273 4.736998       10.63031 
1 1 1 -2  26 31 o 70.64188 3.319106 61.73658       5.697750 67.11001       9.176409 58.36516       7.268653 72.87511 5.201422 68.29488 4.390729 4.580231       6.806857 
1 1 1 -2  26 32 o 34.09290 4.802945 14.90043       3.879870 18.24197       6.603922 13.13907       4.794598 36.57444 7.655548 31.37289 6.485759 5.201551       10.03357 
1 1 1 -2  26 33 o 39.76520 6.292485 21.05198       5.894938 19.08964       7.159977 25.18107       10.38609 36.79955 8.194654 40.84508 10.40661 -4.045532      13.24575 
1 1 1 -2  26 34 o 33.56784 5.756589 15.08009       4.539528 18.71640       9.755536 14.07511       5.128610 34.31154 10.60073 31.86551 6.811081 2.446033       12.60025 
1 1 1 -2  26 35 o 86.29480 3.722480 94.44670       7.809630 96.20393       14.23403 93.68992       9.341146 82.94075 7.111010 85.16403 4.517144 -2.223282      8.424431 
1 1 1 -2  26 36 o 27.82051 5.923905 10.88704       3.892927 11.14873       5.840896 10.67788       5.221834 26.71234 8.193577 26.47052 7.659783 0.2418175      11.21637 
1 1 1 -2  26 37 o 16.00855 6.313133 2.874093       3.627375 1.418145       5.333206 4.127403       4.948171 16.35132 7.126155 18.32812 7.326155 -1.976795      10.22030 
1 1 1 -2  26 38 o 19.07295 6.682699 5.415630       3.835531 5.778702       5.954302 5.158126       5.014490 19.89983 8.008262 19.02559 7.446801 0.8742409      10.93559 
1 1 1 -2  26 39 o 21.13551 7.869735 7.660863       5.421566 16.54800       9.788365 3.727890       6.511630 26.54702 10.40028 18.03409 7.866615 8.512928       13.04030 
1 1 1 -2  26 40 o 45.42593 4.385487 28.69189       4.794361 32.76080       7.269171 25.55915       6.378338 44.90988 6.859337 39.63613 6.851353 5.273746       9.694923 
1 1 1 -2  26 41 o 11.66844 5.450267 -1.291767      3.831268 -3.357695      5.802875 0.3047245      5.101161 12.87835 6.207479 13.97622 6.445016 -1.097873      8.948241 
1 1 1 -2  26 42 o 15.80712 6.800706 3.802057       4.732574 -1.115759      5.782475 13.77924       8.236290 13.49671 6.421514 21.91543 9.179225 -8.418718      11.20241 
1 1 1 -2  27 1  o 185.0780 3.232661 417.9276       14.57979 441.6282       23.19879 402.4550       18.74413 190.0083 5.014601 181.5320 4.237171 8.476273       6.565047 
1 1 1 -2  27 2  o 274.2304 4.072855 918.2687       27.21765 947.1159       43.49694 899.7053       34.89289 278.0623 6.419194 271.2467 5.278815 6.815674       8.310952 
1 1 1 -2  27 3  o 61.43697 3.211742 46.17759       4.791768 57.41574       7.381510 37.99252       6.299541 68.41335 4.451777 55.56359 4.696397 12.84976       6.471048 
1 1 1 -2  27 4  o 199.6388 3.344104 486.3404       16.26900 486.2916       25.35967 486.3746       21.20851 199.3484 5.224796 199.5422 4.361535 -0.1938324     6.805988 
1 1 1 -2  27 5  o 199.0098 3.331997 483.2902       16.15902 500.8540       25.59734 471.6534       20.83537 202.3102 5.196377 196.4951 4.351243 5.815063       6.777585 
1 1 1 -2  27 6  o 149.8263 2.955198 273.8476       10.78974 280.5020       16.83844 269.2119       14.05418 151.4401 4.567952 148.4364 3.888687 3.003693       5.999006 
1 1 1 -2  27 7  o 257.8811 3.893663 812.0570       24.46888 770.4441       37.30060 843.4908       32.41906 250.7916 6.103329 262.6281 5.065508 -11.83652      7.931582 
1 1 1 -2  27 8  o 159.2259 2.993908 309.3189       11.61685 298.1092       17.71846 317.7704       15.38497 156.0985 4.663137 161.3111 3.913778 -5.212616      6.087899 
1 1 1 -2  27 9  o 92.94258 3.050160 105.5154       6.898980 108.6064       12.35925 104.1163       8.314989 94.04791 5.415609 92.26886 3.705567 1.779053       6.562016 
1 1 1 -2  27 10 o 60.08697 4.097798 44.31102       5.964308 0.000000       0.000000 44.31102       5.964308 ?        ?        60.08697 4.097798 0.000000       4.097798 
1 1 1 -2  27 11 o 136.5377 3.259559 227.5473       10.84545 244.8242       23.09950 222.6618       12.28351 141.0657 6.739113 134.9754 3.738094 6.090286       7.706425 
1 1 1 -2  27 12 o 185.3443 3.627863 419.5190       16.38575 409.5698       33.27840 422.7031       18.82601 182.3057 7.506822 185.9807 4.153884 -3.674973      8.579459 
1 1 1 -2  27 13 o 120.1797 3.172759 176.4248       9.283769 168.2124       19.07540 178.9738       10.62732 116.8303 6.728576 121.0011 3.608143 -4.170799      7.634948 
1 1 1 -2  27 14 o 11.18080 5.195464 -3.065494      3.410361 0.2525112E-01  8.190332 -3.713762      3.751002 21.16420 9.022245 11.50738 5.380867 9.656824       10.50498 
1 1 1 -2  27 15 o 193.8290 3.678410 459.0109       17.37461 482.3122       36.96462 452.4030       19.68464 197.6430 7.689500 192.3497 4.199521 5.293304       8.761529 
1 1 1 -2  27 16 o 60.79352 3.497253 45.29720       5.159217 48.53604       8.690901 43.53473       6.411077 62.63555 5.758265 59.48441 4.455108 3.151146       7.280495 
1 1 1 -2  27 17 o 49.39796 3.560310 29.97010       4.257058 32.20462       8.146147 29.13060       4.993107 50.71872 6.759053 48.61303 4.257791 2.105698       7.988340 
1 1 1 -2  27 18 o 45.46181 3.713361 25.43221       4.078057 29.84786       7.783465 23.76141       4.787822 48.78738 6.725547 43.82013 4.549759 4.967255       8.119931 
1 1 1 -2  27 19 o 166.9017 3.446509 340.4528       14.01768 332.0534       20.98367 347.2219       18.83754 164.4183 5.243859 168.2907 4.597639 -3.872467      6.973976 
1 1 1 -2  27 20 o 77.53484 2.946902 73.53187       5.557859 72.71383       10.14354 73.88282       6.643943 76.74281 5.459604 77.65631 3.520008 -0.9134979     6.495978 
1 1 1 -2  27 21 o 25.49837 5.690891 8.311719       3.446398 16.90425       7.177855 5.737325       3.928906 36.16619 8.317945 21.61430 6.735538 14.55190       10.70307 
1 1 1 -2  27 22 o 103.8212 2.828056 131.7818       7.148342 130.5476       12.59619 132.3681       8.681777 102.9547 5.035890 103.9688 3.431347 -1.014114      6.093794 
1 1 1 -2  27 23 o 95.13092 2.808234 110.6833       6.503026 120.7120       11.96916 106.4830       7.746042 98.96219 4.979158 93.22241 3.415531 5.739777       6.038035 
1 1 1 -2  27 24 o 42.40811 5.394355 22.52515       5.448750 27.97226       11.40528 20.91427       6.202322 46.02338 10.41340 40.59262 6.488435 5.430752       12.26942 
1 1 1 -2  27 25 o 39.71853 5.074615 19.76386       4.799669 16.91337       7.504570 21.73691       6.243586 35.91917 8.672654 41.37453 6.398785 -5.455353      10.77773 
1 1 1 -2  27 26 o 74.75673 3.522077 68.72046       6.398268 68.90308       9.625648 68.57589       8.564125 74.41839 5.343355 74.40202 4.748260 0.1636505E-01  7.148246 
1 1 1 -2  27 27 o 37.12714 3.721173 17.11659       3.321390 28.26660       7.573801 14.46171       3.695718 46.99731 6.811400 33.91772 4.588935 13.07959       8.213008 
1 1 1 -2  27 28 o 59.95789 3.190662 44.28933       4.645117 44.45914       8.696681 44.22154       5.494545 59.22070 6.114001 59.77712 3.791441 -0.5564270     7.194167 
1 1 1 -2  27 29 o 47.71112 3.378407 28.18465       3.902562 26.57015       7.878237 28.70964       4.492478 44.97950 7.447927 48.03760 3.870416 -3.058105      8.393554 
1 1 1 -2  27 30 o 26.68198 4.937663 9.189174       3.092304 10.07612       6.613938 8.941051       3.498201 27.48652 8.762504 26.12325 5.659110 1.363272       10.43106 
1 1 1 -2  27 31 o 34.40001 4.825981 15.17087       3.934457 14.90343       6.427610 15.33112       4.975499 32.82129 8.089098 34.05973 6.223862 -1.238434      10.20637 
1 1 1 -2  27 32 o 55.46449 5.110288 39.54465       6.829508 37.27806       8.034501 45.44707       12.96547 53.11678 6.331641 55.86575 9.885353 -2.748974      11.73925 
1 1 1 -2  27 33 o 44.59148 4.732811 25.67828       5.064445 31.04614       9.715112 23.67525       5.934598 46.03131 8.983393 42.13295 5.945112 3.898361       10.77245 
1 1 1 -2  27 34 o 37.77614 5.428604 19.08328       4.854021 29.46891       10.23461 16.06919       5.513572 43.07179 9.950977 33.68888 6.946843 9.382908       12.13592 
1 1 1 -2  27 35 o 15.49987 6.271643 2.133815       3.673880 5.818102       6.023305 -0.4889623E-01 4.636137 21.03363 8.181994 14.79164 6.538412 6.241989       10.47358 
1 1 1 -2  27 36 o 41.21857 4.445957 22.60289       4.395185 26.26735       6.666750 19.78576       5.845387 42.40762 6.671200 36.59830 6.804539 5.809319       9.529253 
1 1 1 -2  27 37 o 35.82632 4.916452 17.67847       4.179214 14.81143       6.273133 19.96643       5.603923 29.50684 8.350299 36.61333 6.519875 -7.106493      10.59416 
1 1 1 -2  27 38 o 11.88864 5.619190 -2.909464      4.288177 -4.216516      5.879663 -1.424189      6.267716 13.34559 6.384171 15.01452 6.999236 -1.668922      9.473486 
1 1 1 -2  27 39 o 36.98720 5.224642 19.89479       4.578181 27.12364       7.134883 14.83532       5.969040 39.94455 7.607564 28.25292 8.193637 11.69162       11.18082 
1 1 1 -2  27 40 o 24.43187 6.703599 10.24663       4.111068 12.71964       6.352513 8.464553       5.392574 24.23992 8.591053 20.71884 7.820592 3.521080       11.61757 
1 1 1 -2  27 41 o 14.09783 6.373516 1.368589       4.677622 3.642019       5.952024 -2.303446      7.564448 16.20922 7.270540 14.37701 6.967910 1.832205       10.07038 
1 1 1 -2  27 42 o 40.62037 4.959730 25.10778       4.807816 31.23561       7.739206 21.25665       6.135319 38.78848 8.428957 32.74968 7.799790 6.038792       11.48408 
1 1 1 -2  28 1  o 258.7594 4.379837 818.1710       27.61786 782.2231       37.68973 859.8558       40.58601 252.6662 6.121243 264.8670 6.287998 -12.20076      8.775451 
1 1 1 -2  28 2  o 112.7706 2.847072 155.2394       7.817775 161.8011       11.93449 150.3075       10.34673 115.0004 4.266010 110.8793 3.835049 4.121063       5.736413 
1 1 1 -2  28 3  f 172.7692 3.128396 364.2349       13.17116 327.6189       19.45471 395.2200       17.89639 163.6092 4.885035 179.8744 4.082817 -16.26524      6.366550 
1 1 1 -2  28 4  o 150.7380 2.984244 277.2315       10.96209 308.6772       17.65942 257.5185       13.98210 158.8476 4.566787 145.1517 3.956574 13.69586       6.042353 
1 1 1 -2  28 5  o 330.2624 5.233656 1334.647       42.12117 1273.834       57.60170 1404.538       61.75122 321.9919 7.340983 338.0480 7.496025 -16.05609      10.49192 
1 1 1 -2  28 6  o 163.5918 3.061521 326.5675       12.20492 319.1006       18.66376 332.1462       16.13235 161.4738 4.748243 164.8954 4.014699 -3.421539      6.218008 
1 1 1 -2  28 7  o 93.25197 2.830394 106.1908       6.424479 93.16488       9.449623 117.3864       8.760618 87.18827 4.462388 97.97724 3.675735 -10.78897      5.781343 
1 1 1 -2  28 8  o 166.4098 3.413332 338.0759       13.84183 334.6489       26.08307 339.4193       16.33118 165.0160 6.499003 166.6769 4.020740 -1.660965      7.642211 
1 1 1 -2  28 9  o 17.18154 6.128453 3.091272       3.237365 4.309930       4.526105 1.814706       4.632395 20.27574 7.244739 17.64469 7.076438 2.631046       10.12730 
1 1 1 -2  28 10 o 187.9167 3.697629 431.3202       16.93265 399.4257       32.95881 442.7572       19.73643 179.9918 7.530835 190.3164 4.255557 -10.32454      8.650043 
1 1 1 -2  28 11 o 61.66417 3.664209 46.60955       5.481338 52.41330       12.20000 45.14169       6.135465 64.75063 7.894812 60.62658 4.178426 4.124050       8.932373 
1 1 1 -2  28 12 o 95.56218 3.223279 111.6202       7.495455 114.7801       15.93240 110.7220       8.494158 96.38827 6.827167 95.13210 3.670903 1.256172       7.751499 
1 1 1 -2  28 13 o 176.0647 3.546017 378.6707       15.21420 379.9102       31.64053 378.2979       17.35185 175.4464 7.417272 175.9099 4.047804 -0.4635010     8.449889 
1 1 1 -2  28 14 o 45.84895 4.690300 25.99820       5.166655 30.41451       10.69821 24.65483       5.900363 48.73074 9.348867 44.49773 5.562497 4.233013       10.87854 
1 1 1 -2  28 15 f 105.3911 3.548840 135.8704       9.101370 132.1600       17.18083 137.3178       10.73072 103.3840 6.858304 105.8732 4.167312 -2.489136      8.025137 
1 1 1 -2  28 16 o 83.31352 3.211014 84.90550       6.506987 64.43904       13.80893 90.74705       7.377386 71.74951 8.035660 86.10252 3.523457 -14.35301      8.774199 
1 1 1 -2  28 17 o 31.44473 5.069881 12.42732       3.752828 9.042181       7.198726 13.69064       4.397696 27.60859 9.166336 32.92807 5.686026 -5.319481      10.78669 
1 1 1 -2  28 18 o 143.8663 2.989817 252.8009       10.48189 262.8673       18.03995 247.6703       12.87897 146.2849 5.068228 142.2567 3.718304 4.028214       6.285914 
1 1 1 -2  28 19 o 75.20198 3.030694 69.20504       5.542644 65.86968       10.00451 70.68214       6.657773 72.96692 5.670935 75.93401 3.608284 -2.967094      6.721549 
1 1 1 -2  28 20 o 118.9243 3.185413 173.0067       9.223189 172.3258       14.63350 173.4554       11.87991 118.3293 5.086690 118.9239 4.105438 -0.5945816     6.536745 
1 1 1 -2  28 21 o 85.41917 2.985194 89.28567       6.204345 93.32683       11.21744 87.50452       7.447156 86.93490 5.320449 84.47546 3.626071 2.459442       6.438600 
1 1 1 -2  28 22 o 175.5409 4.256783 378.1268       18.20941 344.6198       31.04166 395.7064       22.48442 166.0971 7.690015 179.2093 5.153903 -13.11226      9.257378 
1 1 1 -2  28 23 o 71.45757 3.710928 62.76046       6.439859 64.04524       9.827878 61.79372       8.525104 71.77909 5.664448 70.65781 4.983079 1.121277       7.544339 
1 1 1 -2  28 24 o 90.09378 3.477769 99.65105       7.621058 96.60686       11.18939 102.2852       10.40853 88.28693 5.224200 90.99511 4.709945 -2.708183      7.033906 
1 1 1 -2  28 25 f 96.28019 2.852190 113.5905       6.684553 123.6085       12.25567 109.3482       7.975276 99.84704 5.053359 94.33392 3.475239 5.513115       6.133003 
1 1 1 -2  28 26 o 49.18056 3.318300 29.83005       3.953624 38.71292       8.401062 27.30306       4.480834 55.25842 6.354303 46.91954 3.955756 8.338886       7.484996 
1 1 1 -2  28 27 o 55.70860 3.419946 38.32795       4.620398 34.68569       8.501061 39.85495       5.504381 51.92443 6.888139 56.67088 4.011702 -4.746445      7.971211 
1 1 1 -2  28 28 o 59.70294 3.020602 43.94053       4.380382 47.48465       8.568612 42.68662       5.096702 61.13990 5.821250 58.70490 3.579713 2.434994       6.833835 
1 1 1 -2  28 29 o 78.64454 2.814638 76.19005       5.385504 84.21358       10.18888 73.07933       6.344159 81.66835 5.145763 76.82914 3.396933 4.839211       6.165877 
1 1 1 -2  28 30 o 32.13649 5.275146 13.40121       3.987921 15.89901       6.722348 12.04482       4.953752 33.84156 8.231519 29.84748 6.942156 3.994083       10.76807 
1 1 1 -2  28 31 o 42.43658 3.628320 22.62120       3.716202 17.01758       6.897173 24.91341       4.411272 34.66387 8.279153 44.35891 4.128200 -9.695042      9.251292 
1 1 1 -2  28 32 o 24.29876 6.744155 8.188294       4.134264 15.26213       9.090850 6.343834       4.642069 31.38633 10.29560 21.78315 7.362606 9.603182       12.65731 
1 1 1 -2  28 33 o 14.36804 6.163238 0.5423143      3.865258 -3.171350      8.691956 1.457725       4.315432 18.06685 8.360226 15.84537 6.641080 2.221480       10.67695 
1 1 1 -2  28 34 o 37.11521 4.635009 18.20873       4.101041 24.48598       6.843625 14.69155       5.122702 41.17802 7.074875 31.90342 6.797269 9.274597       9.811051 
1 1 1 -2  28 35 o 47.13424 4.106732 29.11064       4.669984 30.30884       7.426809 28.32706       6.005898 45.37583 6.936409 45.21829 5.567827 0.1575394      8.894631 
1 1 1 -2  28 36 o 10.79813 5.107041 -2.996926      3.552812 -5.241214      5.558292 -1.446562      4.619754 12.78457 6.139917 13.42359 6.169510 -0.6390190     8.704104 
1 1 1 -2  28 37 o 16.17366 6.454439 3.216044       3.834399 3.161666       5.781513 3.258746       5.123278 17.43612 7.509277 17.09155 7.204037 0.3445702      10.40612 
1 1 1 -2  28 38 o 22.63765 6.726365 8.433843       3.981230 7.483263       6.069618 9.151652       5.274384 20.44934 8.133840 22.45887 7.838832 -2.009533      11.29631 
1 1 1 -2  28 39 f 22.45954 6.668570 8.620045       3.914248 8.312675       6.074785 8.838254       5.118428 20.42749 8.133322 21.49615 7.701514 -1.068651      11.20108 
1 1 1 -2  28 40 o 12.18422 5.779319 -1.944708      4.613193 -4.674344      5.736968 3.049675       7.760164 12.22859 5.958836 16.61439 7.759274 -4.385796      9.783356 
1 1 1 -2  28 41 o 15.46840 6.775373 3.458038       4.874138 6.963719       6.081127 -2.840533      8.151150 18.12179 7.751060 14.28767 6.992405 3.834128       10.43900 
1 1 1 -2  29 1  o 177.8235 3.553626 386.1183       15.39916 374.2697       21.12694 399.5481       22.49255 174.8255 4.964045 180.6098 5.115627 -5.784378      7.128211 
1 1 1 -2  29 2  o 258.1096 5.076953 815.3198       31.93328 830.5854       55.16935 807.6284       39.16015 259.2550 8.744936 256.5953 6.262671 2.659729       10.75616 
1 1 1 -2  29 3  o 187.5730 3.683343 429.6968       16.83638 418.3367       32.55128 433.8458       19.67214 184.3179 7.261310 188.3987 4.284869 -4.080780      8.431294 
1 1 1 -2  29 4  o 62.62646 3.821962 48.08673       5.805068 52.19579       10.96488 46.48647       6.842715 64.79762 7.057919 61.48441 4.600311 3.313210       8.424789 
1 1 1 -2  29 5  o 245.6762 4.919239 738.5667       29.45080 730.7897       50.57253 742.5575       36.22753 243.1900 8.546900 246.0723 6.041431 -2.882339      10.46654 
1 1 1 -2  29 6  o 215.3758 3.912192 566.7587       20.53303 582.1571       40.44687 561.4126       23.83237 217.3081 7.649813 214.2509 4.564659 3.057144       8.908184 
1 1 1 -2  29 7  o 95.13974 2.876784 110.5574       6.662023 118.7868       10.21724 104.4710       8.786785 98.48035 4.267563 92.38408 3.911838 6.096268       5.789176 
1 1 1 -2  29 8  o 248.2893 3.817900 753.2115       23.10035 788.6306       37.07668 730.7391       29.53299 253.5483 6.000731 244.3265 4.960218 9.221817       7.785405 
1 1 1 -2  29 9  o 223.4734 3.580736 610.0212       19.49998 621.9556       30.74945 601.9933       25.21971 225.2416 5.602124 221.8046 4.665877 3.436935       7.290693 
1 1 1 -2  29 10 f 243.2440 4.252903 723.5635       25.20947 702.8480       50.22403 730.5405       29.14720 238.2218 8.665993 244.2690 4.896574 -6.047241      9.953686 
1 1 1 -2  29 11 o 169.8403 3.533697 352.3892       14.62535 362.7863       30.29074 349.2285       16.70107 171.4583 7.266094 169.0070 4.055119 2.451263       8.321064 
1 1 1 -2  29 12 o 77.67722 4.482751 74.08146       8.449397 0.000000       0.000000 74.08146       8.449397 ?        ?        77.67722 4.482751 0.000000       4.482751 
1 1 1 -2  29 13 o 59.19194 4.222880 43.07794       6.051254 47.79615       11.78788 41.38969       7.051247 61.68740 8.032135 57.90062 5.047842 3.786777       9.486617 
1 1 1 -2  29 14 o 170.2158 3.527404 354.0785       14.63158 327.2883       29.32247 362.9605       16.88372 162.6619 7.416909 172.2606 4.022038 -9.598648      8.437258 
1 1 1 -2  29 15 o 67.26553 3.491329 55.44760       5.703357 48.97487       12.33004 57.20947       6.432920 62.33496 8.324964 68.28326 3.881956 -5.948307      9.185565 
1 1 1 -2  29 16 o 81.12379 3.302743 80.55515       6.515535 85.98601       14.56879 79.19733       7.284638 83.11195 7.266232 80.38535 3.728893 2.726608       8.167176 
1 1 1 -2  29 17 o 108.8152 3.161948 144.8134       8.375670 141.1334       18.13454 145.8113       9.443213 106.6433 7.017082 109.1361 3.555456 -2.492767      7.866429 
1 1 1 -2  29 18 o 63.48336 3.255944 49.39583       5.020186 44.67989       9.280910 51.34637       5.968758 59.83131 6.468111 64.65957 3.804862 -4.828255      7.504227 
1 1 1 -2  29 19 o 80.57410 3.039360 79.46056       5.957093 74.64844       10.74614 81.59536       7.157513 77.64394 5.719629 81.57640 3.609426 -3.932465      6.763292 
1 1 1 -2  29 20 o 98.86476 3.458157 119.7683       8.318654 125.2850       12.57737 115.4785       11.09102 100.7807 5.138215 96.84089 4.713933 3.939804       6.972978 
1 1 1 -2  29 21 o 97.40858 3.964198 116.5591       9.390319 110.7505       17.49365 118.9103       11.12967 93.88593 7.714148 98.23567 4.662494 -4.349747      9.013707 
1 1 1 -2  29 22 o 86.91304 3.582046 92.74932       7.570428 98.34001       11.39902 88.33755       10.12607 89.10789 5.273044 84.52470 4.937607 4.583183       7.223916 
1 1 1 -2  29 23 o 117.4026 2.897985 168.7051       8.291061 169.0765       14.47644 168.5239       10.11419 116.8750 5.095056 117.1554 3.546770 -0.2804642     6.207993 
1 1 1 -2  29 24 o 135.3030 2.968339 224.2971       9.787166 237.6871       17.21649 217.9038       11.89640 138.4449 5.111847 133.1173 3.670792 5.327576       6.293305 
1 1 1 -2  29 25 o 112.2900 2.861255 154.6722       7.823118 155.3835       13.73312 154.3305       9.518507 111.7577 5.055704 111.9822 3.492329 -0.2244492     6.144632 
1 1 1 -2  29 26 o 26.65857 5.258009 9.161345       3.294403 17.35248       6.994174 6.825912       3.734635 36.04127 8.154605 22.91485 6.428366 13.12642       10.38371 
1 1 1 -2  29 27 o 43.15391 3.529500 23.13472       3.679275 24.97537       7.407660 22.53193       4.239134 43.60906 7.223203 42.42807 4.153174 1.180992       8.332077 
1 1 1 -2  29 28 o 61.62551 3.516795 47.14740       5.259409 33.60798       8.253816 56.40298       6.824279 50.64601 6.864176 67.16793 4.190127 -16.52192      8.042020 
1 1 1 -2  29 29 o 50.33443 3.896968 31.76378       4.742797 27.56553       7.651117 34.38369       6.044134 45.39478 7.152938 52.00177 4.824591 -6.606995      8.627932 
1 1 1 -2  29 30 o 93.83543 2.836694 108.9867       6.479126 110.2202       11.66931 108.4370       7.790236 92.69398 5.186725 93.26080 3.433662 -0.5668182     6.220302 
1 1 1 -2  29 31 o 16.35408 6.530613 2.288609       3.927953 -2.037749      8.047500 3.641658       4.500456 18.24656 8.293013 18.46032 7.101643 -0.2137604     10.91821 
1 1 1 -2  29 32 o 10.55874 4.910135 -2.294701      3.055055 1.412779       8.226465 -2.887819      3.290365 19.91043 8.759000 10.65318 5.000088 9.257249       10.08568 
1 1 1 -2  29 33 o 64.27225 3.063132 52.02558       4.783806 45.18698       8.274718 55.45863       5.862870 57.31374 6.014065 65.90604 3.664904 -8.592297      7.042762 
1 1 1 -2  29 34 o 17.75602 5.896662 4.367558       2.978996 4.470156       5.386852 4.322359       3.575483 19.05481 7.634727 17.89740 6.433872 1.157413       9.984176 
1 1 1 -2  29 35 o 20.92212 6.586761 6.600969       3.747515 3.350471       5.625544 9.194272       5.024768 17.91409 7.549721 23.87944 7.640284 -5.965349      10.74115 
1 1 1 -2  29 36 o 22.90226 6.592001 8.198041       3.877072 6.077119       5.809763 9.900936       5.205831 19.89028 7.942483 24.14765 7.781655 -4.257368      11.11923 
1 1 1 -2  29 37 o 33.39790 5.560856 16.44149       4.366752 19.80725       6.728721 13.99253       5.739592 33.14304 8.339282 27.91171 8.016450 5.231323       11.56750 
1 1 1 -2  29 38 o 23.33282 6.652579 9.184333       3.966757 3.995956       6.150804 12.87891       5.190374 17.23775 7.578849 26.55356 7.622286 -9.315804      10.74887 
1 1 1 -2  29 39 o 17.55090 6.542855 5.245827       3.749662 6.857382       6.167819 4.301019       4.722597 18.71250 7.896735 16.57515 6.947154 2.137348       10.51767 
1 1 1 -2  29 40 o 27.79593 7.861713 15.58611       5.562101 14.07940       6.855520 18.48832       9.514600 23.65393 8.841142 23.66864 9.886300 -0.1470184E-01 13.26291 
1 1 1 -2  30 1  o 67.90063 3.183265 56.40964       5.252574 50.52842       7.422765 62.30832       7.433770 64.07836 4.788170 71.25452 4.301179 -7.176163      6.436359 
1 1 1 -2  30 2  o 187.8291 3.305939 430.7789       15.13191 466.9608       24.21970 407.6125       19.37994 195.2080 5.095730 182.5663 4.356079 12.64175       6.703871 
1 1 1 -2  30 3  o 286.3978 4.748005 1003.828       33.13728 1036.140       47.52296 973.2504       46.23016 290.3321 6.716953 281.3739 6.742260 8.958221       9.517118 
1 1 1 -2  30 4  o 139.7569 4.573601 239.2244       15.55545 231.1178       21.08916 248.8977       23.03713 137.0398 6.332160 142.1482 6.669040 -5.108398      9.196322 
1 1 1 -2  30 5  o 216.7235 3.949402 574.0816       20.85804 566.8021       28.88003 582.0190       30.15681 214.9570 5.517841 217.7798 5.687265 -2.822815      7.924112 
1 1 1 -2  30 6  f 172.6857 3.538314 364.2729       14.88980 366.0761       20.69255 362.3368       21.44216 172.8387 4.917890 171.9110 5.124056 0.9276733      7.102224 
1 1 1 -2  30 7  o 318.9638 7.363934 1253.631       57.23838 1330.604       83.54920 1185.551       78.57426 326.5650 10.51242 308.2593 10.47513 18.30576       14.84046 
1 1 1 -2  30 8  o 217.8431 4.666971 580.9036       24.77508 588.6826       42.98135 577.0329       30.31861 218.1420 8.099524 216.7842 5.744184 1.357803       9.929650 
1 1 1 -2  30 9  o 52.62526 4.270270 34.09841       5.429266 47.61783       11.53467 30.25073       6.153552 61.62270 7.859837 49.41526 5.187334 12.20744       9.417296 
1 1 1 -2  30 10 o 84.71857 3.412285 87.82214       7.030246 99.03797       14.57833 84.42345       8.025034 89.45293 6.737219 82.99639 3.979410 6.456535       7.824693 
1 1 1 -2  30 11 o 120.5409 3.773878 177.8101       11.07192 189.8636       20.51198 172.8543       13.15256 123.9691 6.816048 118.7299 4.554283 5.239174       8.197561 
1 1 1 -2  30 12 o 336.6844 7.573375 1400.708       62.13675 0.000000       0.000000 1400.708       62.13675 ?        ?        336.6844 7.573375 0.000000       7.573375 
1 1 1 -2  30 13 o 60.40216 4.385482 44.90732       6.411177 0.000000       0.000000 44.90732       6.411177 ?        ?        60.40216 4.385482 0.000000       4.385482 
1 1 1 -2  30 14 o 111.6093 3.334884 152.3755       9.060031 159.2933       18.90208 150.3122       10.32313 113.4061 6.871952 110.7809 3.829694 2.625153       7.867037 
1 1 1 -2  30 15 o 76.43192 4.103889 71.73531       7.615721 76.87400       13.96348 69.55950       9.086085 78.47224 7.388961 75.11997 4.991787 3.352264       8.917101 
1 1 1 -2  30 16 o 63.13037 4.443861 49.09585       6.792840 41.55919       11.95423 52.68989       8.255114 57.08080 8.882862 65.27816 5.233227 -8.197361      10.30980 
1 1 1 -2  30 17 o 51.25091 4.913708 32.54913       6.061789 44.41688       11.33590 27.79656       7.173587 59.23416 8.062285 47.02497 6.428046 12.20919       10.31117 
1 1 1 -2  30 18 f 38.59138 5.819448 18.76520       5.302779 11.40834       9.570394 22.02439       6.369992 30.99636 10.57044 41.72902 6.473816 -10.73266      12.39534 
1 1 1 -2  30 19 o 142.5751 3.498177 248.9120       12.15407 277.1848       18.53220 227.5730       16.10015 149.9616 5.078528 135.9280 4.868408 14.03360       7.035115 
1 1 1 -2  30 20 o 81.43227 3.374325 81.34967       6.681554 85.51759       17.51895 80.64021       7.227879 81.88908 8.923192 81.02550 3.670135 0.8635788      9.648484 
1 1 1 -2  30 21 o 24.25588 5.933029 7.582525       3.477511 7.310972       7.483070 7.657323       3.927353 25.80668 9.303845 24.38117 6.494195 1.425514       11.34619 
1 1 1 -2  30 22 o 29.93139 5.092239 11.37530       3.581366 6.322644       7.520287 12.85731       4.072871 24.85029 9.265542 31.78345 5.454892 -6.933159      10.75203 
1 1 1 -2  30 23 o 56.37273 3.500628 39.18946       4.785231 48.08746       8.787192 35.43828       5.705424 61.83363 5.903189 53.40086 4.423999 8.432762       7.376951 
1 1 1 -2  30 24 o 50.82581 3.407882 31.90814       4.196507 36.43532       8.384229 30.39485       4.847403 53.40135 6.581920 49.45941 4.057473 3.941940       7.732060 
1 1 1 -2  30 25 o 35.35248 4.527713 15.75870       3.811207 32.10837       7.674731 10.40709       4.390870 50.00091 6.448682 28.13413 6.530457 21.86679       9.177820 
1 1 1 -2  30 26 o 36.12554 4.060886 16.38533       3.513122 28.31654       7.433286 12.95375       3.986448 46.63628 6.735567 31.70969 5.349031 14.92659       8.601163 
1 1 1 -2  30 27 o 54.21223 3.637389 36.59948       4.777521 36.70007       7.884762 36.54113       6.005480 53.22753 6.194376 53.81541 4.624153 -0.5878754     7.730012 
1 1 1 -2  30 28 o 12.70511 6.002154 -4.929884      4.881472 -6.566097      5.619861 0.9830830E-01  9.851711 13.16832 6.283501 21.67338 9.557925 -8.505058      11.43837 
1 1 1 -2  30 29 o 70.55012 3.148921 61.91516       5.400074 73.30112       12.92917 59.50924       5.943286 73.63657 7.301157 68.97298 3.547917 4.663582       8.117549 
1 1 1 -2  30 30 o 12.92109 5.503130 0.3753371      3.042179 12.11758       7.826391 -1.714623      3.301832 28.44558 9.559849 11.56149 5.276804 16.88409       10.91949 
1 1 1 -2  30 31 o 8.976804 4.383076 -5.380797      3.148570 -7.755119      8.810479 -5.033175      3.371189 16.38825 7.832984 9.610306 4.656258 6.777948       9.112430 
1 1 1 -2  30 32 o 43.09618 3.607235 23.77078       3.753620 26.10931       6.817007 22.75326       4.496688 42.80245 6.759802 41.61010 4.506480 1.192356       8.124240 
1 1 1 -2  30 33 o 31.51740 4.603732 13.34303       3.431546 14.72708       6.202095 12.73241       4.119553 30.25034 8.206758 29.95831 5.852801 0.2920303      10.07999 
1 1 1 -2  30 34 o 31.73698 4.480221 13.59649       3.368714 13.61862       5.953672 13.58607       4.085628 28.64787 8.144251 30.89716 5.633819 -2.249292      9.902966 
1 1 1 -2  30 35 o 16.41697 6.004556 3.697593       3.132094 6.878932       5.583924 2.237195       3.783294 20.66739 7.920702 15.14427 6.272177 5.523121       10.10335 
1 1 1 -2  30 36 o 22.54593 5.971387 7.837609       3.332365 11.26021       5.985017 6.299853       4.011723 24.47006 8.358804 19.72092 6.839263 4.749142       10.80024 
1 1 1 -2  30 37 f 29.05471 5.027701 12.33741       3.430959 17.59320       6.352136 10.17253       4.076789 30.35698 8.334177 24.71152 6.632061 5.645454       10.65095 
1 1 1 -2  30 38 o 38.41840 4.878499 21.63897       4.464472 29.67883       7.307756 16.85147       5.639163 40.51053 7.683584 30.12182 7.664735 10.38871       10.85291 
1 1 1 -2  30 39 o 19.96148 7.563567 8.191211       5.055162 6.755378       6.332960 10.71272       8.392373 18.20865 7.850755 20.10015 8.844513 -1.891500      11.82623 
1 1 1 -2  31 1  o 156.6060 3.503457 299.6276       13.37031 313.6963       25.98920 294.5640       15.59189 159.5404 6.699675 155.1427 4.127790 4.397781       7.869199 
1 1 1 -2  31 2  f 117.8934 3.310089 169.8876       9.500256 169.9323       17.42644 169.8687       11.33236 117.4639 6.108904 117.8076 3.952998 -0.3436890     7.276325 
1 1 1 -2  31 3  o 106.0150 2.881243 137.2933       7.436703 145.1526       11.34915 131.3796       9.844734 108.8439 4.287200 103.5929 3.906759 5.250908       5.800246 
1 1 1 -2  31 4  o 54.71580 3.481102 36.72290       4.617508 38.22148       6.764307 35.41525       6.318726 55.62676 5.044835 53.55075 4.896148 2.076004       7.030123 
1 1 1 -2  31 5  o 109.2052 3.361897 145.8174       8.936062 161.9561       17.81185 140.3891       10.33015 114.5868 6.404270 107.0776 3.965731 7.509285       7.532708 
1 1 1 -2  31 6  f 42.47305 4.145422 22.27471       4.236053 23.73754       6.074409 20.88983       5.910328 43.58323 5.868358 40.78772 6.136214 2.795513       8.490627 
1 1 1 -2  31 7  o 115.0008 2.902749 161.5647       8.128288 162.9013       12.20591 160.4997       10.89563 115.2882 4.352409 114.4987 3.910692 0.7894516      5.851237 
1 1 1 -2  31 8  o 176.3870 3.195069 380.0251       13.73355 370.2330       20.94052 387.4158       18.19247 173.7303 4.951296 177.9350 4.195602 -4.204620      6.489870 
1 1 1 -2  31 9  o 148.4673 3.032129 269.1959       10.97020 284.1139       17.12799 258.8197       14.28464 152.2248 4.622622 145.3935 4.035602 6.831284       6.136344 
1 1 1 -2  31 10 o 150.9245 3.378508 278.3671       12.42570 262.3566       16.70440 298.2003       18.59194 146.2443 4.693305 155.8777 4.900546 -9.633453      6.785459 
1 1 1 -2  31 11 o 196.1957 4.450454 471.5451       21.27795 507.1707       38.33708 455.6849       25.57953 202.2104 7.794593 192.5325 5.457463 9.677917       9.515229 
1 1 1 -2  31 12 o 193.5072 4.433434 458.8308       20.90613 421.1869       35.08113 479.5623       26.03401 184.1445 7.835607 197.4853 5.414772 -13.34082      9.524521 
1 1 1 -2  31 13 o 174.6851 4.238325 373.8199       18.04207 355.3227       30.80719 383.4760       22.25855 169.1870 7.490780 176.6192 5.177163 -7.432190      9.105757 
1 1 1 -2  31 14 o 118.2669 3.289474 171.1389       9.471173 156.6665       19.26628 175.7509       10.87609 112.2946 7.076476 119.7800 3.730630 -7.485466      7.999632 
1 1 1 -2  31 15 o 51.73204 4.649709 33.10430       5.799201 0.000000       0.000000 33.10430       5.799201 ?        ?        51.73204 4.649709 0.000000       4.649709 
1 1 1 -2  31 16 o 87.43166 3.286077 93.64474       6.988901 91.51495       14.91460 94.24400       7.911247 85.55557 7.220996 87.64651 3.712435 -2.090935      8.119419 
1 1 1 -2  31 17 f 71.48515 3.407463 62.69674       5.918763 64.82584       13.42501 62.18306       6.594222 71.66864 7.813240 71.12830 3.818386 0.5403442      8.696366 
1 1 1 -2  31 18 o 105.7400 3.638890 137.1964       9.362602 0.000000       0.000000 137.1964       9.362602 ?        ?        105.7400 3.638890 0.000000       3.638890 
1 1 1 -2  31 19 o 98.65602 4.240215 119.8665       10.17027 0.000000       0.000000 119.8665       10.17027 ?        ?        98.65602 4.240215 0.000000       4.240215 
1 1 1 -2  31 20 o 37.88695 4.454330 17.91955       4.034044 19.17149       7.978498 17.48957       4.675745 38.13744 8.768364 37.23872 5.302141 0.8987160      10.24680 
1 1 1 -2  31 21 o 49.55959 3.605355 30.33249       4.324455 30.62752       8.477069 30.22869       5.027887 48.80769 7.355514 49.35258 4.221097 -0.5448990     8.480639 
1 1 1 -2  31 22 o 46.16467 3.864302 26.43556       4.307422 43.84485       8.804448 20.95751       4.938835 58.83316 6.235903 40.78420 5.079068 18.04896       8.042600 
1 1 1 -2  31 23 o 53.43214 3.429429 35.28326       4.441825 28.77501       8.694705 37.58165       5.166952 46.79692 7.905649 55.04649 3.876635 -8.249573      8.804975 
1 1 1 -2  31 24 o 55.37217 3.590815 37.99907       4.819170 57.20718       9.039029 30.37083       5.696285 67.26467 5.564136 49.13166 4.819616 18.13301       7.361271 
1 1 1 -2  31 25 o 29.62667 5.519832 11.40534       3.838562 15.13248       6.579893 9.482478       4.726124 33.31353 8.168798 26.62245 7.138867 6.691088       10.84863 
1 1 1 -2  31 26 o 24.28754 6.233922 7.861290       3.707968 13.37357       6.308125 4.951209       4.583396 31.10892 8.204761 20.46311 7.292784 10.64582       10.97738 
1 1 1 -2  31 27 f 16.57369 6.576050 2.271188       3.957994 2.233796       6.558058 2.292612       4.964003 19.62080 8.202554 17.86052 7.266850 1.760283       10.95851 
1 1 1 -2  31 28 o 9.795163 4.632735 -3.127525      2.923695 -9.483163      6.972209 -1.771486      3.220526 13.91408 6.730598 11.40392 5.207386 2.510153       8.509867 
1 1 1 -2  31 29 o 28.44448 5.161073 10.75445       3.445743 12.88397       8.319200 10.31347       3.785742 29.02112 9.855976 27.55312 5.820915 1.468004       11.44654 
1 1 1 -2  31 30 o 34.34089 4.632638 15.47486       3.778033 7.748245       9.263889 17.01633       4.137767 24.38984 9.925791 35.91519 4.851689 -11.52535      11.04809 
1 1 1 -2  31 31 o 20.69092 5.802123 6.017024       3.043083 7.820997       5.362470 5.160148       3.695804 22.93197 7.909472 19.33066 6.569156 3.601316       10.28171 
1 1 1 -2  31 32 o 26.90176 5.198695 10.02555       3.284751 5.450979       5.591121 12.43665       4.059114 20.06227 7.860146 29.60347 5.834230 -9.541193      9.788775 
1 1 1 -2  31 33 o 17.85980 6.277316 4.487667       3.386086 15.20530       8.121981 2.232958       3.725269 28.39294 9.736306 15.29570 6.267813 13.09723       11.57934 
1 1 1 -2  31 34 o 15.24768 5.935276 2.810694       3.171233 3.760621       5.137831 2.226068       4.030641 17.62214 7.304815 15.37774 6.429772 2.244396       9.731510 
1 1 1 -2  31 35 o 17.92675 6.027575 4.882176       3.111299 3.669299       5.711761 5.393894       3.710026 17.43126 7.484922 18.58348 6.567373 -1.152212      9.957633 
1 1 1 -2  31 36 o 15.24392 5.929146 3.194989       3.162730 7.739760       5.896620 1.359474       3.747366 20.26444 8.031001 13.76564 5.986686 6.498794       10.01686 
1 1 1 -2  31 37 o 17.06013 6.125221 4.708388       3.239518 9.825231       6.011336 2.614197       3.845724 21.54995 8.228326 14.75986 6.232451 6.790091       10.32225 
1 1 1 -2  31 38 o 24.76982 6.729647 10.90098       4.166856 5.890313       6.038582 15.45545       5.757137 17.72306 7.653885 27.52328 8.065434 -9.800224      11.11905 
1 1 1 -2  32 1  o 73.63581 3.185643 66.35840       5.702871 79.78677       8.521292 55.46464       7.675077 80.61352 4.353876 67.11807 4.722679 13.49545       6.423389 
1 1 1 -2  32 2  o 132.1967 3.011216 213.4224       9.700602 232.3559       15.06900 200.0237       12.67656 137.6704 4.497704 127.7944 4.075765 9.876030       6.069695 
1 1 1 -2  32 3  o 49.81207 3.774765 30.51412       4.547949 24.08718       6.277645 37.61338       6.597838 43.86063 6.033010 55.17021 4.960411 -11.30958      7.810434 
1 1 1 -2  32 4  o 104.5801 2.951941 133.6660       7.515504 152.0663       11.66901 120.6230       9.824476 111.3676 4.307831 99.20332 4.072598 12.16430       5.928192 
1 1 1 -2  32 5  o 148.1714 3.939907 268.7806       14.21350 311.0816       24.79584 248.0791       17.34622 158.8047 6.420601 142.1358 5.015874 16.66893       8.147584 
1 1 1 -2  32 6  o 206.4215 3.876709 521.2640       19.50089 498.7977       36.68276 530.1144       23.02376 200.6860 7.514090 208.0114 4.542060 -7.325409      8.780197 
1 1 1 -2  32 7  o 171.5164 3.187428 359.4431       13.32239 377.6413       21.02584 347.2362       17.22030 175.3982 4.924045 168.4068 4.196092 6.991440       6.469421 
1 1 1 -2  32 8  o 28.36430 6.058767 10.27615       4.060611 11.56259       5.398430 8.599957       6.162211 29.98706 7.426674 26.52814 8.458087 3.458914       11.25588 
1 1 1 -2  32 9  o 316.5263 4.578009 1228.243       35.31202 1219.038       55.02264 1234.689       46.04544 313.9346 7.192273 316.6813 5.966616 -2.746735      9.345014 
1 1 1 -2  32 10 o 147.4390 3.026566 265.6044       10.87423 273.4401       16.76882 259.9181       14.28504 149.2543 4.615958 145.6418 4.028810 3.612534       6.126857 
1 1 1 -2  32 11 o 130.5646 3.378248 208.5948       10.73960 214.6321       21.62908 206.6192       12.37257 131.6098 6.766656 129.8501 3.914515 1.759781       7.817357 
1 1 1 -2  32 12 o 232.3164 4.178916 661.4152       23.65808 732.2667       50.60908 641.6028       26.76223 242.0620 8.593205 228.5989 4.804100 13.46315       9.844925 
1 1 1 -2  32 13 o 71.60387 4.138545 63.05997       7.190613 48.09330       12.65158 70.20161       8.739387 61.44418 8.691842 75.44968 4.777753 -14.00549      9.918420 
1 1 1 -2  32 14 o 19.96992 6.996358 4.411193       4.203971 2.721265       9.156364 4.862586       4.732238 23.85540 9.806524 21.03858 7.418726 2.816818       12.29656 
1 1 1 -2  32 15 o 102.2128 3.273791 127.9930       8.143887 133.1630       17.12560 126.4822       9.257627 103.3284 6.839767 101.5212 3.748463 1.807198       7.799576 
1 1 1 -2  32 16 o 61.06015 4.135186 45.98478       6.116733 0.000000       0.000000 45.98478       6.116733 ?        ?        61.06015 4.135186 0.000000       4.135186 
1 1 1 -2  32 17 o 93.11346 3.703158 106.5335       8.385979 0.000000       0.000000 106.5335       8.385979 ?        ?        93.11346 3.703158 0.000000       3.703158 
1 1 1 -2  32 18 o 86.73172 3.290411 92.34380       6.941860 90.35386       15.28328 92.86106       7.792022 84.48784 7.500999 86.89196 3.688276 -2.404121      8.358729 
1 1 1 -2  32 19 o 84.12349 3.274975 86.94125       6.700866 93.82969       15.18724 85.27611       7.466973 86.02929 7.313563 83.22027 3.691146 2.809021       8.192238 
1 1 1 -2  32 20 o 37.67186 4.686018 17.82435       4.209139 28.98152       9.804788 15.30360       4.660434 46.76456 8.929272 34.60315 5.726964 12.16142       10.60802 
1 1 1 -2  32 21 o 67.44981 3.197276 56.02864       5.240333 54.85558       9.673688 56.51585       6.234294 65.82629 6.099926 67.59573 3.800004 -1.769440      7.186732 
1 1 1 -2  32 22 f 71.30477 3.987363 63.07909       6.900922 64.20222       9.868456 62.00426       9.653839 71.27004 5.730323 70.04332 5.705211 1.226723       8.086163 
1 1 1 -2  32 23 o 34.44593 5.817647 15.36554       4.709651 25.00883       7.512186 9.120794       6.045209 43.51985 7.344560 26.34869 8.374733 17.17117       11.13906 
1 1 1 -2  32 24 o 40.59736 4.469151 20.83357       4.348338 25.80662       7.511009 18.32656       5.332909 44.07163 7.245183 37.49113 6.042492 6.580502       9.434214 
1 1 1 -2  32 25 o 9.719737 4.574232 -2.837257      2.786241 2.829267       5.914544 -4.453425      3.158684 19.50825 7.934048 9.595324 4.613494 9.912930       9.177878 
1 1 1 -2  32 26 o 29.88643 5.046289 11.64929       3.544482 18.80933       8.802738 10.26378       3.872266 35.63056 9.822430 27.69945 5.916449 7.931114       11.46667 
1 1 1 -2  32 27 o 25.52424 6.367222 8.936961       3.947089 11.28348       8.680791 8.325391       4.431702 27.94099 10.02739 24.48610 7.047713 3.454891       12.25638 
1 1 1 -2  32 28 o 68.12475 3.016276 57.95793       4.994984 56.68164       8.965571 58.53239       6.014967 65.39217 5.682580 68.08813 3.638360 -2.695961      6.747545 
1 1 1 -2  32 29 o 26.89120 5.554724 9.906974       3.519527 16.74612       8.928790 8.648855       3.829593 31.61035 10.19157 24.73335 6.328512 6.877001       11.99659 
1 1 1 -2  32 30 o 13.94799 5.542894 1.788672       2.816215 8.165453       5.255289 -0.7802655     3.335590 23.25803 7.833826 12.13906 5.444005 11.11896       9.539707 
1 1 1 -2  32 31 o 15.88908 5.921737 3.114134       3.071131 2.538666       5.344174 3.397887       3.752668 17.30427 7.328829 16.79311 6.478407 0.5111599      9.781692 
1 1 1 -2  32 32 o 11.36637 5.248040 -1.686661      3.397521 -3.108663      7.478542 -1.316846      3.813808 15.83035 7.463539 12.32989 5.644025 3.500468       9.357320 
1 1 1 -2  32 33 o 20.05245 6.362685 6.143097       3.490656 7.663410       5.571125 5.160506       4.478810 21.45858 7.979952 18.71161 7.112521 2.746973       10.68960 
1 1 1 -2  32 34 o 10.86231 4.962662 -0.9225569     2.929912 1.101194       5.099942 -1.919552      3.579589 15.16185 6.770493 11.26690 5.264513 3.894957       8.576403 
1 1 1 -2  32 35 o 10.93070 5.004624 -0.8227808     3.000788 6.536912       5.763529 -3.559763      3.514752 19.23167 7.828176 10.08541 4.853595 9.146259       9.210739 
1 1 1 -2  32 36 o 10.11028 4.747611 -1.735125      2.972761 -1.099096      5.607584 -1.983748      3.505965 13.76592 6.481782 10.83068 5.107531 2.935234       8.252295 
1 1 1 -2  32 37 f 13.88751 6.013333 1.957985       3.747028 5.627233       5.569654 -1.075851      5.064490 17.60458 7.470029 13.05431 6.150784 4.550276       9.676439 
1 1 1 -2  33 1  f 135.9756 3.457274 226.2187       11.44665 220.2581       20.95116 228.7550       13.66671 133.4840 6.460022 136.6199 4.109679 -3.135880      7.656458 
1 1 1 -2  33 2  o 133.5826 3.366873 218.2868       10.95131 216.9813       14.77115 219.8804       16.31931 132.9618 4.565581 133.7481 5.015893 -0.7863007     6.782603 
1 1 1 -2  33 3  o 101.8880 3.286107 127.0249       8.148399 126.4664       10.94891 127.7182       12.19940 101.4873 4.437867 101.8988 4.927454 -0.4114380     6.631324 
1 1 1 -2  33 4  o 145.7847 3.406498 259.8599       12.10197 260.8852       16.45314 258.6514       17.86323 145.7842 4.637191 145.0557 5.061218 0.7285461      6.864362 
1 1 1 -2  33 5  o 91.79381 3.339175 103.1505       7.457003 94.97001       9.625779 115.4286       11.79271 87.90084 4.508792 96.83510 5.014488 -8.934258      6.743463 
1 1 1 -2  33 6  o 61.55751 3.710814 46.53448       5.540704 53.86345       7.507246 37.76593       8.211507 66.09962 4.691122 55.00307 6.236247 11.09656       7.803679 
1 1 1 -2  33 7  o 61.88950 3.423197 46.98648       5.142685 46.16504       7.276915 47.80609       7.268802 61.12337 4.927161 62.22337 4.831562 -1.099995      6.900790 
1 1 1 -2  33 8  o 137.8050 2.999697 232.0759       10.07345 247.2103       15.63892 221.3440       13.16931 141.8869 4.528821 134.3615 4.026637 7.525360       6.060034 
1 1 1 -2  33 9  o 255.5762 3.942329 800.1981       24.55327 837.0382       39.29844 776.6087       31.44658 260.3633 6.193831 251.3089 5.134871 9.054443       8.045524 
1 1 1 -2  33 10 o 164.9937 3.152447 332.9088       12.67509 310.6251       18.91149 351.0829       17.07885 158.8966 4.889812 169.2139 4.141775 -10.31726      6.408164 
1 1 1 -2  33 11 o 199.5404 3.875606 487.9696       18.84545 470.8234       37.34282 493.8287       21.82910 194.0802 7.912271 200.5440 4.466733 -6.463806      9.086020 
1 1 1 -2  33 12 o 63.41478 3.865606 49.47990       5.945332 51.63314       11.64971 48.72158       6.913404 63.91610 7.629943 62.80781 4.547719 1.108284       8.882442 
1 1 1 -2  33 13 o 39.22819 5.075154 19.26685       4.737993 22.45068       9.656744 18.25741       5.437457 41.28235 9.754858 37.94910 6.085340 3.333244       11.49733 
1 1 1 -2  33 14 f 37.69448 5.068167 17.82711       4.537628 8.284224       9.217720 20.87930       5.213019 27.94514 10.28765 40.77771 5.376925 -12.83257      11.60806 
1 1 1 -2  33 15 o 58.51062 4.252648 42.32446       6.022203 0.000000       0.000000 42.32446       6.022203 ?        ?        58.51062 4.252648 0.000000       4.252648 
1 1 1 -2  33 16 o 83.78742 3.785095 86.42133       7.708482 0.000000       0.000000 86.42133       7.708482 ?        ?        83.78742 3.785095 0.000000       3.785095 
1 1 1 -2  33 17 o 198.9148 3.859794 486.7586       18.70972 461.1711       37.63506 495.1584       21.56311 190.3606 8.131695 200.3274 4.417076 -9.966797      9.253919 
1 1 1 -2  33 18 o 114.1927 4.523746 161.5159       12.56355 0.000000       0.000000 161.5159       12.56355 ?        ?        114.1927 4.523746 0.000000       4.523746 
1 1 1 -2  33 19 o 14.14492 6.288692 -1.381706      4.350266 -2.817493      8.266621 -0.8318008     5.115955 19.10307 8.568481 15.85695 6.943594 3.246120       11.02871 
1 1 1 -2  33 20 o 11.64778 5.487809 -4.221995      4.030691 -2.858824      8.742955 -4.589925      4.542192 19.58607 8.796363 12.43077 5.847060 7.155300       10.56239 
1 1 1 -2  33 21 o 38.51087 6.501411 19.33592       5.884367 25.12186       10.17439 16.42786       7.213109 42.43679 10.00305 34.72337 8.575797 7.713428       13.17594 
1 1 1 -2  33 22 o 60.00059 3.327181 44.60235       4.845785 41.42069       8.538398 46.11402       5.885423 56.62438 6.294030 60.79268 3.994878 -4.168301      7.454788 
1 1 1 -2  33 23 o 31.16742 5.236034 12.59607       3.835981 0.9413283      7.807311 16.30495       4.404251 20.25307 8.724394 35.54971 5.240974 -15.29665      10.17757 
1 1 1 -2  33 24 o 25.98104 7.003783 9.209026       4.534348 3.712424       7.315564 12.63808       5.778135 21.49223 8.792462 30.14518 7.804937 -8.652948      11.75689 
1 1 1 -2  33 25 o 26.56176 5.566004 9.409366       3.487291 12.31744       7.444705 8.591897       3.947119 29.12680 9.297777 25.09431 6.427004 4.032492       11.30288 
1 1 1 -2  33 26 o 37.15090 4.874857 17.98481       4.306961 15.37516       6.702862 19.81997       5.620909 32.37547 8.418377 38.28523 6.239432 -5.909763      10.47853 
1 1 1 -2  33 27 o 22.96168 6.230390 7.343286       3.574243 12.01609       6.545895 5.358281       4.266394 28.17115 8.679985 20.13445 7.048541 8.036703       11.18142 
1 1 1 -2  33 28 o 39.90521 4.301481 20.74116       4.116960 23.13421       10.19862 20.27528       4.499897 36.34396 10.75735 39.13692 4.819940 -2.792965      11.78781 
1 1 1 -2  33 29 o 37.31705 3.978642 18.13746       3.562347 14.84348       6.420165 19.60274       4.281985 30.48367 8.382551 38.35511 4.677935 -7.871435      9.599491 
1 1 1 -2  33 30 o 12.80535 5.406347 0.8507717      2.893101 0.3932707      4.940418 1.089540       3.569080 15.22242 6.738202 14.05578 5.972604 1.166642       9.004186 
1 1 1 -2  33 31 o 26.63264 5.365437 10.06532       3.361710 12.85282       5.792844 8.649887       4.127899 27.75011 8.078790 23.66833 6.798600 4.081776       10.55878 
1 1 1 -2  33 32 f 36.04400 4.725458 17.95067       4.050753 28.92192       6.744614 11.76033       5.066248 43.71071 6.531940 26.62614 7.493498 17.08457       9.940762 
1 1 1 -2  33 33 o 19.78452 6.101989 6.098908       3.234032 -0.4031180     5.787040 9.051660       3.899830 14.86037 6.856995 23.76252 6.532752 -8.902142      9.470757 
1 1 1 -2  33 34 o 12.61776 5.463985 0.9376274      3.094203 -0.1610208     5.369692 1.483777       3.785958 14.29250 6.598583 13.91260 6.034265 0.3798981      8.941680 
1 1 1 -2  33 35 o 20.89804 6.187520 7.241564       3.373708 16.73610       6.464289 3.687363       3.955077 28.47898 8.596570 15.94111 6.486253 12.53787       10.76905 
1 1 1 -2  33 36 o 13.51826 5.956688 1.425738       3.819134 2.729978       5.692789 0.3583321      5.150045 15.66749 7.061934 13.92634 6.441085 1.741143       9.558164 
1 1 1 -2  34 1  o 113.7051 2.989359 158.1417       8.275936 154.0903       12.17955 161.6167       11.28003 111.9698 4.472689 114.7664 4.039588 -2.796539      6.026875 
1 1 1 -2  34 2  f 129.3420 3.023752 204.5066       9.530637 217.6826       14.66999 194.8840       12.53673 133.0981 4.529551 126.0271 4.087511 7.070923       6.101194 
1 1 1 -2  34 3  o 135.3512 3.347115 224.1243       11.04000 206.3580       14.42853 249.2153       17.14681 129.5695 4.576838 142.3015 4.952222 -12.73198      6.743289 
1 1 1 -2  34 4  o 21.51096 7.046811 5.530556       4.259398 4.459667       5.276808 7.533044       7.215790 21.12791 7.782771 25.97516 9.160774 -4.847244      12.02045 
1 1 1 -2  34 5  o 105.5711 2.953221 136.3491       7.590143 132.9429       11.11911 139.3213       10.38647 103.9870 4.397811 106.5366 4.007819 -2.549530      5.950072 
1 1 1 -2  34 6  o 73.82938 3.117716 66.78097       5.596586 78.89649       8.406091 57.13496       7.500614 80.06622 4.324374 68.05845 4.548613 12.00777       6.276153 
1 1 1 -2  34 7  o 102.7440 2.965338 129.1792       7.416725 143.1852       11.39704 118.8908       9.768047 107.9148 4.342730 98.37169 4.083635 9.543091       5.961156 
1 1 1 -2  34 8  o 76.26708 3.457058 71.36758       6.408395 72.37599       8.421751 69.98061       9.876855 76.61608 4.530956 75.13916 5.430709 1.476921       7.072635 
1 1 1 -2  34 9  f 158.2194 3.489713 306.6289       13.45505 316.2165       18.66784 296.2632       19.41052 160.2343 4.786186 154.9619 5.147297 5.272385       7.028673 
1 1 1 -2  34 10 o 49.35799 4.060545 30.10520       4.840873 28.36024       6.215431 32.79587       7.718065 47.62373 5.453911 51.04378 6.341133 -3.420052      8.363917 
1 1 1 -2  34 11 o 53.03782 4.961920 34.97786       6.338706 34.47701       10.64830 35.25275       7.888677 51.59179 8.784073 52.94529 6.233535 -1.353493      10.77111 
1 1 1 -2  34 12 o 79.71104 4.090712 78.29770       7.919513 90.15427       13.76550 72.43175       9.682372 84.77299 6.718337 76.38280 5.233377 8.390198       8.516119 
1 1 1 -2  34 13 f 57.55995 4.722029 41.14392       6.565285 54.69437       12.05547 35.43076       7.827907 65.50051 7.699594 53.01918 6.174040 12.48133       9.869271 
1 1 1 -2  34 14 o 118.9594 4.645571 174.9927       13.44121 0.000000       0.000000 174.9927       13.44121 ?        ?        118.9594 4.645571 0.000000       4.645571 
1 1 1 -2  34 15 o 108.4978 3.885267 145.1055       10.25596 132.8094       17.58806 151.4408       12.62449 102.4219 7.090522 110.5522 4.696790 -8.130341      8.505018 
1 1 1 -2  34 16 o 120.0408 3.909211 177.8093       11.42022 135.2503       18.90782 202.2523       14.32922 102.8681 7.596252 127.7237 4.611350 -24.85565      8.886372 
1 1 1 -2  34 17 o 125.4915 3.361294 193.8623       10.26989 207.5827       22.22535 190.1374       11.58033 127.5812 7.177624 124.0885 3.834201 3.492729       8.137529 
1 1 1 -2  34 18 o 82.53794 3.362543 84.03178       6.749123 99.89879       15.32670 80.21490       7.517185 88.15633 7.197001 80.48769 3.843673 7.668640       8.159083 
1 1 1 -2  34 19 o 71.44613 3.839211 63.35872       6.659763 0.000000       0.000000 63.35872       6.659763 ?        ?        71.44613 3.839211 0.000000       3.839211 
1 1 1 -2  34 20 o 38.74020 4.965890 19.11695       4.580407 23.64825       9.563068 17.76795       5.217862 41.02420 9.716450 36.96730 5.997481 4.056900       11.41837 
1 1 1 -2  34 21 o 80.46978 3.277972 80.21496       6.414519 63.21909       13.57281 85.10269       7.278667 68.44045 8.307996 82.74184 3.618613 -14.30138      9.061852 
1 1 1 -2  34 22 o 12.40061 5.464824 -0.6464511     3.215305 -0.8960505     7.286241 -0.5860923     3.583042 18.42253 8.167424 13.16862 5.787309 5.253908       10.00998 
1 1 1 -2  34 23 o 12.59841 5.772811 -2.295129      4.003406 1.734324       6.685042 -4.548283      4.998924 19.28399 8.183321 13.03546 6.132266 6.248537       10.22602 
1 1 1 -2  34 24 o 28.50469 5.171535 10.73992       3.460038 14.93628       6.251624 8.886854       4.154335 32.27904 7.990691 25.35655 6.644375 6.922483       10.39225 
1 1 1 -2  34 25 o 80.51376 2.999621 80.86306       5.875063 90.06091       10.35414 76.49564       7.134830 83.15268 5.134824 77.78085 3.775496 5.371826       6.373444 
1 1 1 -2  34 26 o 22.19217 6.250120 6.905100       3.523154 8.879980       6.441460 6.062129       4.208433 24.55442 8.655686 20.93232 7.009922 3.622095       11.13822 
1 1 1 -2  34 27 o 12.73142 5.586411 -0.1165215     3.326738 4.244039       8.158382 -0.9861802     3.643404 21.00794 8.981483 12.55612 5.655421 8.451823       10.61371 
1 1 1 -2  34 28 o 59.18111 3.519850 44.87188       5.053322 51.61488       8.287696 40.88137       6.375603 61.26123 5.613869 55.36367 4.772167 5.897568       7.368114 
1 1 1 -2  34 29 o 60.11733 3.256162 46.18115       4.752453 54.01971       8.277098 42.32612       5.804616 62.46099 5.493846 56.64793 4.235540 5.813068       6.937012 
1 1 1 -2  34 30 o 31.65049 4.768068 13.76111       3.563489 11.05668       6.139547 15.13504       4.376028 25.24088 8.467021 32.43545 5.746689 -7.194576      10.23303 
1 1 1 -2  34 31 o 47.83170 3.875519 30.37536       4.478669 27.65207       6.859139 32.39931       5.913201 42.15427 6.916847 47.97232 5.138145 -5.818050      8.616456 
1 1 1 -2  34 32 o 16.84168 6.090246 4.193952       3.209450 1.959108       5.793687 5.183376       3.854985 16.21139 7.229256 18.22451 6.662197 -2.013119      9.830921 
1 1 1 -2  34 33 o 12.16217 5.353979 0.4897383      3.078452 5.662324       5.476882 -1.899220      3.722063 18.43463 7.581925 11.33172 5.318383 7.102909       9.261251 
1 1 1 -2  34 34 o 20.93987 6.300477 7.345794       3.476352 1.601427       6.171008 10.01620       4.207498 15.57942 7.149328 23.93590 6.860180 -8.356477      9.908328 
1 1 1 -2  34 35 o 11.67568 5.446731 -1.138486      3.806647 -10.10153      5.704206 6.058093       5.111289 10.59587 5.298677 18.10448 7.370974 -7.508608      9.077844 
1 1 1 -2  35 1  f 77.62009 3.463276 73.94788       6.534348 71.44898       8.354090 77.88605       10.48750 76.09794 4.525389 79.24355 5.464360 -3.145615      7.094954 
1 1 1 -2  35 2  o 53.90165 4.007659 35.84830       5.226491 36.91505       6.834167 34.34544       8.111688 54.47159 5.211976 52.21640 6.516256 2.255188       8.344236 
1 1 1 -2  35 3  o 41.99816 4.246867 21.88274       4.286792 22.03593       6.157259 21.73864       5.971869 41.72369 6.247726 41.47338 6.090170 0.2503128      8.724921 
1 1 1 -2  35 4  o 46.25036 3.868877 26.42359       4.320583 24.66427       5.991683 28.32937       6.236098 44.31742 5.678319 47.58890 5.477153 -3.271481      7.889392 
1 1 1 -2  35 5  o 77.80995 3.116400 74.22707       5.897188 73.21417       8.550067 75.14615       8.144475 77.00214 4.577144 78.07558 4.297242 -1.073433      6.278259 
1 1 1 -2  35 6  o 127.3847 2.996444 198.5855       9.301640 211.7628       14.41738 189.1896       12.17428 131.1021 4.519500 124.0506 4.032607 7.051590       6.057045 
1 1 1 -2  35 7  o 52.67593 3.544147 34.17587       4.522985 29.70324       6.600676 38.13485       6.210107 48.66456 5.672167 55.45433 4.637882 -6.789772      7.326898 
1 1 1 -2  35 8  f 65.51950 3.178298 52.70919       5.059456 41.69867       6.893756 65.56385       7.448731 57.92422 4.930642 72.89230 4.211312 -14.96807      6.484318 
1 1 1 -2  35 9  o 67.54918 3.177630 56.03348       5.216035 55.74965       7.576668 56.28919       7.191565 67.07701 4.664255 67.46410 4.398341 -0.3870926     6.410981 
1 1 1 -2  35 10 o 35.04868 4.708434 15.42520       3.919830 16.63294       5.426613 14.10751       5.668231 36.00308 6.420713 32.90533 7.263473 3.097744       9.694513 
1 1 1 -2  35 11 o 38.27781 4.939765 18.41659       4.500434 16.87758       8.410592 19.03403       5.327255 35.56706 9.517128 38.70168 5.829314 -3.134621      11.16049 
1 1 1 -2  35 12 o 76.18703 4.035225 71.72004       7.465061 0.000000       0.000000 71.72004       7.465061 ?        ?        76.18703 4.035225 0.000000       4.035225 
1 1 1 -2  35 13 o 37.85463 5.222811 18.13212       4.689669 14.04122       9.810008 19.34396       5.339284 32.75830 10.69204 38.96140 5.800144 -6.203102      12.16394 
1 1 1 -2  35 14 o 58.50576 3.836604 42.38615       5.439746 45.02508       11.23195 41.57750       6.217589 58.78463 8.052094 57.78314 4.449800 1.001488       9.199834 
1 1 1 -2  35 15 o 34.85434 5.468878 15.53257       4.492328 18.24702       9.484264 14.74741       5.100819 36.41917 10.25395 33.65496 6.454241 2.764210       12.11614 
1 1 1 -2  35 16 o 108.5956 3.309686 145.3959       8.748382 119.8608       17.15315 154.3732       10.17059 96.37048 7.359724 111.7202 3.741032 -15.34968      8.255959 
1 1 1 -2  35 17 o 21.46543 6.556360 5.940455       3.744952 -0.5004767E-02 7.666896 7.803488       4.291777 19.75249 8.577001 24.31812 6.915230 -4.565638      11.01750 
1 1 1 -2  35 18 o 21.66196 6.967777 5.999196       4.175124 8.356394       8.637013 5.280418       4.769389 26.59622 9.927076 21.08950 7.446811 5.506720       12.40975 
1 1 1 -2  35 19 o 104.7579 3.239827 135.8225       8.260800 121.5939       16.75699 140.3905       9.494706 96.22374 7.198410 106.2731 3.671767 -10.04933      8.080778 
1 1 1 -2  35 20 o 35.93649 4.917626 16.60662       4.193684 29.30924       9.920135 13.84251       4.627519 45.43641 9.273590 32.30825 6.101149 13.12816       11.10061 
1 1 1 -2  35 21 o 63.90036 3.941226 51.33093       6.107343 0.000000       0.000000 51.33093       6.107343 ?        ?        63.90036 3.941226 0.000000       3.941226 
1 1 1 -2  35 22 o 34.58713 4.999593 15.59704       4.091785 35.40379       9.442485 11.01779       4.540215 50.29048 7.970321 28.27166 6.694217 22.01882       10.40858 
1 1 1 -2  35 23 o 18.08818 7.199168 3.102894       4.757710 0.2904084      7.224943 5.256286       6.321946 18.56046 8.185126 21.42516 8.368613 -2.864698      11.70598 
1 1 1 -2  35 24 o 45.93508 4.179352 27.13539       4.627145 30.96371       9.962724 26.08246       5.224861 44.76272 9.431359 44.60749 4.886388 0.1552353      10.62202 
1 1 1 -2  35 25 o 27.51803 6.002204 10.58856       3.911413 6.025930       8.795440 11.71333       4.367001 22.70504 9.496125 28.74274 6.399241 -6.037701      11.45106 
1 1 1 -2  35 26 f 60.60339 3.295065 46.65045       4.847974 50.63649       8.470982 44.70902       5.911863 60.65716 5.801413 58.61986 4.165645 2.037300       7.142058 
1 1 1 -2  35 27 o 30.67150 5.019468 12.85471       3.622053 11.41647       6.150510 13.61833       4.481609 26.39241 8.453813 30.76119 6.193057 -4.368776      10.47955 
1 1 1 -2  35 28 o 29.84699 5.535103 12.60494       3.877692 20.01874       8.713583 10.77414       4.330091 32.61611 10.00824 26.69772 6.674156 5.918394       12.02952 
1 1 1 -2  35 29 o 9.741525 4.669045 -3.523589      3.178067 1.124338       5.619946 -5.708717      3.853372 16.08209 7.148967 9.936475 4.851053 6.145616       8.639470 
1 1 1 -2  35 30 o 22.14375 6.396745 7.682472       3.644625 7.614050       5.879351 7.725175       4.644736 21.06023 8.113037 21.52578 7.363359 -0.4655514     10.95630 
1 1 1 -2  35 31 o 10.92581 5.001196 -0.9210299     2.994313 2.573037       5.524009 -2.374825      3.563202 16.35452 7.186697 10.90147 5.143395 5.453050       8.837597 
1 1 1 -2  35 32 o 18.55668 6.269843 5.584702       3.366363 0.4074420      5.824328 8.181856       4.125198 14.94975 6.891351 21.74033 6.919055 -6.790578      9.765450 
1 1 1 -2  35 33 o 20.51442 6.844389 7.455515       4.012566 7.805100       6.001122 7.172854       5.396208 19.78475 8.011903 19.40022 7.684530 0.3845310      11.10147 
1 1 1 -2  36 1  o 114.0751 2.984640 159.4949       8.289831 157.8148       12.26416 160.9084       11.24873 113.0638 4.459963 114.2999 4.044888 -1.236160      6.020996 
1 1 1 -2  36 2  o 35.41848 4.815294 15.76534       4.048591 22.17326       5.852539 9.884817       5.606524 41.84554 5.903101 27.62151 7.919794 14.22402       9.877739 
1 1 1 -2  36 3  o 47.47015 3.615039 27.82763       4.150412 23.36381       5.608909 33.22976       6.170312 43.08060 5.465537 51.61534 4.966852 -8.534737      7.385236 
1 1 1 -2  36 4  o 79.31491 3.058336 77.20171       5.900130 74.69889       8.580356 79.44662       8.126240 77.67932 4.552730 80.21768 4.171363 -2.538361      6.174757 
1 1 1 -2  36 5  o 58.03405 3.439594 41.48389       4.842547 46.20485       7.101500 37.38072       6.620558 60.95396 4.820137 54.73769 5.019134 6.216263       6.958838 
1 1 1 -2  36 6  o 16.56642 6.269496 2.523561       3.470839 2.385391       4.750099 2.681832       5.083901 18.16711 7.205432 18.89855 7.467341 -0.7314396     10.37687 
1 1 1 -2  36 7  o 100.4770 2.953488 123.8464       7.223811 110.9550       10.41069 135.8167       10.03186 94.66407 4.526038 104.9556 3.929229 -10.29152      5.993651 
1 1 1 -2  36 8  o 33.66449 4.574851 14.25891       3.656031 18.53819       5.224170 10.15136       5.118274 38.14887 5.802110 27.83051 7.414085 10.31836       9.414517 
1 1 1 -2  36 9  o 44.36755 3.773969 24.41114       4.041684 21.19128       5.318041 28.81392       6.218655 40.90768 5.471812 47.81410 5.433331 -6.906422      7.711148 
1 1 1 -2  36 10 o 19.44988 6.702890 4.403380       3.850899 10.13013       6.028724 0.4563667      5.005020 27.81801 8.280079 16.70109 7.083738 11.11692       10.89675 
1 1 1 -2  36 11 f 15.84521 6.812241 -0.5769369E-01 4.742218 0.000000       0.000000 -0.5769369E-01 4.742218 ?        ?        15.84521 6.812241 0.000000       6.812241 
1 1 1 -2  36 12 o 59.85497 3.756282 44.38268       5.451290 41.04312       10.35084 45.66447       6.412672 56.06125 7.786551 60.54074 4.376191 -4.479488      8.932045 
1 1 1 -2  36 13 o 23.49698 6.775471 7.210182       4.092395 12.29243       8.402278 5.629586       4.685753 30.41448 9.893022 21.60260 7.395630 8.811884       12.35181 
1 1 1 -2  36 14 o 83.94538 3.431977 87.10502       7.005846 109.2743       15.01545 80.93595       7.920853 92.24141 6.726224 80.68985 4.041117 11.55156       7.846829 
1 1 1 -2  36 15 o 26.06252 6.453838 9.014562       4.077165 5.093821       7.962365 10.40792       4.746668 23.55363 9.333020 27.89454 6.996048 -4.340912      11.66405 
1 1 1 -2  36 16 o 50.06186 3.986792 31.36198       4.823548 31.66416       9.824720 31.26600       5.536786 48.08248 8.705297 49.76354 4.618432 -1.681061      9.854548 
1 1 1 -2  36 17 o 54.87205 4.293728 37.89196       5.695764 41.29356       10.63040 36.52219       6.745776 55.16174 8.153524 53.45115 5.246436 1.710598       9.695620 
1 1 1 -2  36 18 o 92.78552 3.275469 106.8697       7.394485 96.54715       15.03501 110.1632       8.492594 85.12074 7.319234 93.95831 3.716436 -8.837563      8.208719 
1 1 1 -2  36 19 o 14.89036 6.065411 1.431307       3.463058 -0.4688270     8.188160 1.845232       3.821684 19.51575 8.654813 15.87165 6.405690 3.644097       10.76748 
1 1 1 -2  36 20 o 17.06238 6.796265 2.532388       4.243359 -2.609726      7.272387 5.186784       5.225033 17.17953 7.837234 20.81356 7.730392 -3.634035      11.00823 
1 1 1 -2  36 21 o 19.30597 6.535287 4.844904       3.657500 6.658559       8.428905 4.424197       4.059605 23.84673 9.551725 18.98144 6.851487 4.865295       11.75493 
1 1 1 -2  36 22 o 40.96392 6.792753 23.35705       6.543421 0.000000       0.000000 23.35705       6.543421 ?        ?        40.96392 6.792753 0.000000       6.792753 
1 1 1 -2  36 23 o 29.03915 5.601883 11.54516       3.820544 9.996313       8.359529 11.95410       4.295392 25.62967 9.722882 29.20487 6.225822 -3.575201      11.54536 
1 1 1 -2  36 24 o 18.22419 6.719470 4.265109       3.935003 0.000000       0.000000 4.265109       3.935003 ?        ?        18.22419 6.719470 0.000000       6.719470 
1 1 1 -2  36 25 o 31.95083 5.467601 14.12871       4.104163 23.75327       8.883199 11.51674       4.627680 37.19774 9.700783 27.83225 6.866157 9.365484       11.88484 
1 1 1 -2  36 26 o 16.52759 6.409534 3.255790       3.687604 9.721269       7.564506 1.240347       4.223431 24.06593 9.220057 15.01829 6.442324 9.047631       11.24780 
1 1 1 -2  36 27 o 45.40857 3.922732 27.11672       4.298205 34.70528       7.777496 23.77991       5.157336 48.13367 6.821507 41.36367 5.233417 6.769997       8.597768 
1 1 1 -2  36 28 o 39.28046 4.223376 20.76815       3.979275 22.34032       6.780863 19.94233       4.914485 36.93933 7.779067 37.23770 5.588035 -0.2983627     9.578100 
1 1 1 -2  36 29 o 24.58579 6.426990 9.513443       3.893051 12.19257       6.095807 7.668038       5.059182 25.58575 8.432654 21.16229 7.647288 4.423454       11.38379 
1 1 1 -2  36 30 o 11.66622 5.257265 -0.2905648     3.153018 3.365597       5.636891 -1.955375      3.803727 16.89083 7.344196 11.49757 5.389901 5.393267       9.109789 
1 1 1 -2  36 31 o 19.91354 6.605315 6.685307       3.738323 5.452099       6.222612 7.381753       4.676258 18.27827 7.829857 20.24303 7.347008 -1.964764      10.73709 
1 1 1 -2  36 32 o 19.22062 6.938898 6.569715       4.164048 6.241722       6.449379 6.804188       5.452946 18.48853 7.946447 19.02273 7.660750 -0.5342026     11.03780 
1 1 1 -2  37 1  o 20.39280 6.403323 5.203144       3.543943 6.717232       4.951728 3.613168       5.074304 23.25421 7.596750 19.75773 7.555965 3.496475       10.71463 
1 1 1 -2  37 2  o 56.85702 3.445474 39.90273       4.751448 40.59193       6.897511 39.28033       6.554712 56.94195 5.022193 56.05953 4.845612 0.8824196      6.978709 
1 1 1 -2  37 3  o 34.21340 4.763906 14.78486       3.864296 10.02997       5.242189 20.44353       5.718735 27.60607 7.567969 39.96402 6.062131 -12.35795      9.696576 
1 1 1 -2  37 4  o 15.92810 6.171563 2.121836       3.416567 1.395945       4.855073 2.833949       4.808771 17.28708 7.127195 18.62091 7.291259 -1.333826      10.19605 
1 1 1 -2  37 5  o 34.66079 4.489978 15.11963       3.703412 15.06709       5.174118 15.17484       5.303094 34.05878 6.470575 34.14184 6.612841 -0.8306122E-01 9.251919 
1 1 1 -2  37 6  o 20.86725 6.327039 5.543824       3.496164 6.101598       4.865030 4.948144       5.027622 22.38600 7.537334 21.13081 7.625069 1.255194       10.72162 
1 1 1 -2  37 7  o 19.85927 6.225971 4.953347       3.351666 6.680948       4.440551 2.666054       5.109472 22.89795 7.164510 18.78514 7.465773 4.112812       10.34737 
1 1 1 -2  37 8  o 57.62211 3.756311 41.16419       5.245816 39.46147       8.810946 42.09919       6.529128 55.40968 6.658559 58.01120 4.657677 -2.601521      8.125907 
1 1 1 -2  37 9  o 11.11534 5.188807 -3.145172      3.464038 0.6900187      5.335031 -5.940567      4.554756 17.28745 7.322168 11.75718 5.622883 5.530270       9.232061 
1 1 1 -2  37 10 o 52.19232 3.515606 33.77452       4.445309 27.71500       6.210452 40.14069       6.365653 46.62813 5.576032 56.56710 4.659152 -9.938976      7.266349 
1 1 1 -2  37 11 o 24.32903 6.761721 7.825675       4.152744 15.57356       8.168988 5.125688       4.822337 33.50634 9.544652 21.00546 7.481062 12.50088       12.12710 
1 1 1 -2  37 12 o 25.86275 6.620289 8.902116       4.189638 16.12716       8.276937 6.413200       4.857965 33.95183 9.586006 22.55521 7.531090 11.39662       12.19052 
1 1 1 -2  37 13 o 97.14195 3.404343 116.8885       8.046453 123.0663       16.04756 114.8137       9.300020 97.34881 6.807505 95.98569 3.984618 1.363113       7.887922 
1 1 1 -2  37 14 o 76.00546 3.552231 71.82111       6.561137 79.24930       13.23336 69.39994       7.555126 77.63254 7.072615 74.42451 4.182545 3.208023       8.216786 
1 1 1 -2  37 15 o 26.78119 6.989705 9.751536       4.609457 11.95593       7.948577 8.634581       5.657992 29.22482 9.629143 25.30272 8.108626 3.922106       12.58850 
1 1 1 -2  37 16 o 46.06130 4.278164 26.87830       4.747196 26.65199       9.611215 26.95133       5.459648 42.94452 9.441723 45.82530 4.968434 -2.880779      10.66918 
1 1 1 -2  37 17 o 23.05013 6.612531 7.224976       3.907437 0.4910048      7.289758 9.939734       4.628529 19.04949 8.316203 26.82031 7.006232 -7.770821      10.87412 
1 1 1 -2  37 18 o 28.51417 5.991820 11.00173       4.030955 13.79095       8.825696 10.26653       4.531170 30.18176 10.15190 27.18457 6.845165 2.997190       12.24407 
1 1 1 -2  37 19 o 22.57236 6.694849 7.053601       3.946861 -3.511906      8.207670 10.23167       4.501493 17.63315 8.146985 27.00595 6.835180 -9.372799      10.63452 
1 1 1 -2  37 20 o 19.96013 6.441956 5.408751       3.566765 10.63688       8.110324 4.155133       3.971434 26.58908 9.671944 18.42954 6.758054 8.159542       11.79906 
1 1 1 -2  37 21 o 37.42948 4.794403 18.49205       4.272764 28.87697       9.545194 15.88970       4.778222 42.77845 9.412378 33.94862 5.994882 8.829834       11.15937 
1 1 1 -2  37 22 o 16.73806 6.539350 3.059678       3.860952 4.474223       7.921093 2.618876       4.421795 20.99703 8.908926 16.81857 6.852676 4.178455       11.23958 
1 1 1 -2  37 23 o 42.20197 5.226254 24.16935       5.260002 0.000000       0.000000 24.16935       5.260002 ?        ?        42.20197 5.226254 0.000000       5.226254 
1 1 1 -2  37 24 o 28.84283 6.884522 12.46984       4.771574 0.000000       0.000000 12.46984       4.771574 ?        ?        28.84283 6.884522 0.000000       6.884522 
1 1 1 -2  37 25 o 14.41899 6.130637 1.290307       3.764358 -6.093243      8.048687 3.357601       4.258862 15.31748 7.364666 16.98533 6.794269 -1.667849      10.02000 
1 1 1 -2  37 26 o 21.62891 6.694872 7.251066       3.888905 24.72025       8.963305 3.200042       4.316326 36.03518 9.902815 16.65528 6.776313 19.37990       11.99934 
1 1 1 -2  37 27 o 15.77415 6.636068 2.487949       4.334092 5.471614       8.391279 1.402397       5.061491 19.94369 8.806996 15.53768 6.851541 4.406012       11.15826 
1 1 1 -2  37 28 o 15.90948 6.160182 3.440970       3.402251 3.996994       5.802310 3.149630       4.200053 17.63922 7.558553 16.06029 6.625963 1.578932       10.05162 
1 1 1 -2  37 29 o 43.54194 4.051243 25.87799       4.249333 37.63285       7.743916 20.81360       5.082945 48.38062 6.751962 37.04318 5.822715 11.33744       8.915884 
1 1 1 -2  37 30 o 28.42808 6.710480 13.48310       4.573582 22.60366       7.253289 7.463367       5.892680 33.81912 8.738820 19.79225 7.966104 14.02687       11.82480 
1 1 1 -2  38 1  o 143.2455 3.412942 253.1246       11.91369 252.4594       16.33045 253.8814       17.41920 142.1907 4.719466 142.3582 5.029124 -0.1674652     6.896771 
1 1 1 -2  38 2  o 53.59092 4.049559 35.80075       5.249396 46.83872       9.934383 31.52493       6.183098 60.14969 6.902451 49.91549 5.157356 10.23421       8.616388 
1 1 1 -2  38 3  o 84.24569 3.438219 87.72925       7.043749 81.54748       12.71448 90.46662       8.460752 79.70455 6.605318 85.30468 4.081896 -5.600128      7.764799 
1 1 1 -2  38 4  o 39.25089 5.041484 19.58654       4.710968 24.90807       8.160060 16.92619       5.769585 43.11782 8.062386 35.82770 6.858008 7.290127       10.58463 
1 1 1 -2  38 5  o 88.92043 2.999854 97.43318       6.491059 104.9176       9.715521 91.39872       8.723832 91.71172 4.359638 85.66194 4.191833 6.049774       6.047967 
1 1 1 -2  38 6  o 69.36508 3.514617 59.61863       5.921577 62.51509       10.22938 58.15886       7.262057 69.91153 6.064251 68.19025 4.393581 1.721275       7.488571 
1 1 1 -2  38 7  o 75.76822 3.486753 71.12529       6.420642 78.53564       11.46571 67.73991       7.749702 78.35685 6.051513 73.60534 4.339815 4.751511       7.446798 
1 1 1 -2  38 8  o 59.07064 3.340125 43.25204       4.788476 41.82135       6.704438 44.74184       6.841498 57.55414 4.824600 59.57243 4.752065 -2.018288      6.771918 
1 1 1 -2  38 9  o 69.30327 3.109529 59.39644       5.238139 58.25662       7.404029 60.53862       7.411670 68.09480 4.486885 69.46001 4.401334 -1.365211      6.285211 
1 1 1 -2  38 10 o 19.08299 6.104635 4.626699       3.207969 7.512627       4.288090 0.9586047      4.834386 23.73506 6.962242 16.61003 6.999355 7.125036       9.872375 
1 1 1 -2  38 11 o 110.7950 3.392655 152.3219       9.149214 136.3077       17.28932 158.5507       10.78271 101.8462 7.008953 112.6917 3.932474 -10.84555      8.036776 
1 1 1 -2  38 12 o 72.31934 3.556642 65.18218       6.248799 57.13918       11.41633 68.62260       7.466605 65.41949 7.284574 73.90570 4.162633 -8.486206      8.390026 
1 1 1 -2  38 13 o 97.66502 3.853303 119.4295       9.152823 120.7282       15.50800 118.7353       11.33818 95.65663 6.695072 96.64458 4.829565 -0.9879532     8.255222 
1 1 1 -2  38 14 o 17.99254 6.741014 3.533213       3.990264 8.025242       7.339401 1.648279       4.754308 24.90893 9.178118 16.90428 7.018784 8.004658       11.55427 
1 1 1 -2  38 15 o 18.08867 6.671857 3.750306       3.880018 1.726490       7.182363 4.584308       4.610686 19.62563 8.409635 19.69841 7.271681 -0.7278633E-01 11.11752 
1 1 1 -2  38 16 o 22.72263 6.597977 7.113744       3.868371 16.58456       7.796896 4.021176       4.455411 33.11784 9.287497 18.83356 7.108700 14.28428       11.69578 
1 1 1 -2  38 17 o 37.43836 5.801759 18.84569       5.121995 22.89273       8.831105 16.79418       6.287586 38.55822 9.468870 34.10367 7.743133 4.454552       12.23175 
1 1 1 -2  38 18 f 11.73872 5.379051 -1.824800      3.476253 9.735729       7.289521 -5.227767      3.954932 25.57910 9.187678 10.65905 5.134451 14.92004       10.52502 
1 1 1 -2  38 19 o 15.95907 6.692233 1.633708       4.385679 -3.445316      7.035643 4.861440       5.608703 15.96591 7.433651 20.10389 7.873663 -4.137980      10.82838 
1 1 1 -2  38 20 o 11.59368 5.369443 -2.199222      3.596870 3.864580       7.420867 -4.061242      4.112201 20.27265 8.613152 11.42353 5.429450 8.849120       10.18162 
1 1 1 -2  38 21 o 17.04068 6.715372 3.230127       4.101727 0.000000       0.000000 3.230127       4.101727 ?        ?        17.04068 6.715372 0.000000       6.715372 
1 1 1 -2  38 22 o 42.40512 4.549655 23.94508       4.628035 17.03838       9.853724 25.89987       5.242211 29.69581 10.68014 43.73591 5.008840 -14.04010      11.79635 
1 1 1 -2  38 23 o 39.66609 4.695217 21.24572       4.450593 49.09626       11.23829 16.06542       4.846865 54.86307 8.695535 33.26778 6.206867 21.59529       10.68352 
1 1 1 -2  38 24 o 18.86728 6.580518 5.241165       3.716593 8.559449       8.150606 4.370084       4.176018 22.50586 9.252069 17.89435 6.851810 4.611509       11.51295 
1 1 1 -2  38 25 o 17.52118 6.654805 4.320583       3.919022 3.640537       9.940203 4.445745       4.264446 19.75594 9.068793 17.79940 6.895412 1.956541       11.39253 
1 1 1 -2  38 26 o 18.21839 7.035789 5.010641       4.429625 16.60718       9.146825 1.457671       5.062931 26.87765 10.17636 15.43739 6.827881 11.44026       12.25473 
1 1 1 -2  38 27 o 45.10280 5.553375 30.01600       5.975020 36.57025       11.20215 27.40992       7.063717 39.50481 11.15139 40.50735 7.429593 -1.002544      13.39972 
1 1 1 -2  38 28 o 30.86084 7.231183 16.25282       5.342543 34.80722       10.80256 10.24512       6.146917 37.80910 11.03936 22.56590 8.384012 15.24321       13.86215 
1 1 1 -2  38 29 o 58.44954 6.097091 53.58921       8.556854 51.83444       12.31401 55.22772       11.89909 46.99546 10.95546 51.14936 9.904270 -4.153900      14.76877 
1 1 1 -2  39 1  o 58.44308 3.403897 42.44430       4.826829 39.85238       6.845200 45.00759       6.807292 55.96230 5.074539 59.66233 4.720513 -3.700035      6.930671 
1 1 1 -2  39 2  o 69.50799 3.208620 59.86242       5.420208 49.26828       7.414286 72.02362       7.943736 62.33618 4.920703 75.75726 4.320849 -13.42109      6.548516 
1 1 1 -2  39 3  o 19.06994 6.367669 4.521999       3.472953 6.265465       4.336848 1.405192       5.798592 21.99064 7.103951 18.24636 7.675931 3.744278       10.45878 
1 1 1 -2  39 4  o 17.05312 6.818201 2.244993       4.286879 1.323183       6.346445 3.018527       5.813656 18.83451 7.982166 19.59544 7.903473 -0.7609386     11.23298 
1 1 1 -2  39 5  o 15.52029 6.502173 0.9382271      4.134215 3.036736       6.079406 -0.8670969     5.638756 19.87063 8.057683 16.33658 7.216558 3.534044       10.81688 
1 1 1 -2  39 6  o 25.14788 6.919966 8.556784       4.373563 -0.7267312     6.966204 14.59678       5.618990 18.16367 8.022517 32.74566 7.234661 -14.58199      10.80283 
1 1 1 -2  39 7  o 21.33450 6.991333 5.890106       4.192443 -0.2482598     6.530650 10.19323       5.467919 17.88939 7.839036 27.18596 7.829534 -9.296574      11.07935 
1 1 1 -2  39 8  o 39.19650 4.984259 19.77920       4.653322 10.21992       7.546951 25.64246       5.910558 27.30235 9.384535 44.41993 5.583323 -17.11759      10.91984 
1 1 1 -2  39 9  f 64.97873 3.784606 52.93359       5.966837 48.79050       10.56709 54.87293       7.229708 60.09975 7.369206 65.76215 4.539221 -5.662399      8.655041 
1 1 1 -2  39 10 o 73.15434 3.632873 66.99834       6.456029 72.08577       12.31320 65.06950       7.581746 73.35161 6.972248 71.67045 4.361683 1.681160       8.224142 
1 1 1 -2  39 11 o 54.49587 4.692436 38.03931       6.170952 34.31592       9.772227 40.50883       7.958479 49.20498 8.454405 55.42875 5.986827 -6.223770      10.35949 
1 1 1 -2  39 12 o 48.23806 4.954094 30.11288       5.740906 34.58227       9.382506 27.43823       7.258189 49.54297 8.047316 44.87502 6.854310 4.667957       10.57075 
1 1 1 -2  39 13 o 16.23782 6.527043 2.176529       3.950495 0.7311593      7.496875 2.732166       4.648216 19.14367 8.393511 17.62949 7.082243 1.514181       10.98222 
1 1 1 -2  39 14 o 29.25262 5.837038 11.63396       4.015054 11.79072       7.832878 11.57809       4.676097 27.88275 9.561451 28.70342 6.791799 -0.8206692     11.72817 
1 1 1 -2  39 15 o 13.72181 5.949147 0.1619360      3.676925 -7.943273      6.772809 3.549159       4.378331 13.93594 6.714474 18.02939 6.986231 -4.093448      9.689767 
1 1 1 -2  39 16 o 48.87688 4.937557 31.47531       5.800455 34.90033       10.44401 29.94763       6.975115 47.26689 9.398227 46.61093 6.302148 0.6559639      11.31564 
1 1 1 -2  39 17 o 19.34775 6.815546 5.042980       3.993248 1.856014       7.806252 6.172513       4.647328 19.41277 8.536487 20.99349 7.355957 -1.580719      11.26862 
1 1 1 -2  39 18 o 13.40133 5.893340 -0.7227115E-01 3.720985 -11.64604      7.259803 4.051541       4.333481 13.12327 6.458016 18.22242 6.979202 -5.099149      9.508693 
1 1 1 -2  39 19 o 13.11732 5.834905 -0.4016402     3.750107 1.478806       7.887365 -0.9508988     4.262751 18.91456 8.434805 13.50115 6.095868 5.413413       10.40699 
1 1 1 -2  39 20 o 13.11875 6.012825 -1.585781      4.347081 0.000000       0.000000 -1.585781      4.347081 ?        ?        13.11875 6.012825 0.000000       6.012825 
1 1 1 -2  39 21 o 14.96856 6.269539 1.723006       3.842291 10.18109       7.814122 -0.9740900     4.412580 24.28178 9.353408 13.52839 6.145565 10.75339       11.19170 
1 1 1 -2  39 22 o 26.13968 6.415631 10.30523       4.055825 22.08110       8.883776 7.204477       4.558637 33.89830 10.04166 21.41462 7.295491 12.48367       12.41206 
1 1 1 -2  39 23 o 14.09601 6.039431 1.254695       3.703445 5.944597       8.210144 0.5664657E-01  4.149599 20.43683 8.874902 13.65625 6.102049 6.780584       10.77028 
1 1 1 -2  39 24 o 19.01155 7.169014 5.638308       4.528884 8.766843       7.924827 4.121032       5.518886 21.76585 9.051615 17.85050 7.497680 3.915352       11.75359 
1 1 1 -2  39 25 o 11.50065 5.569562 -5.015060      4.809111 3.651480       7.553041 -10.92398      6.236674 18.14369 8.159959 11.39343 5.672691 6.750264       9.938025 
1 1 1 -2  39 26 o 19.69833 7.379472 6.701810       4.781705 9.431746       8.598191 5.479444       5.753493 21.24131 9.152913 18.51726 7.707561 2.724056       11.96588 
1 1 1 -2  39 27 o 15.67968 6.667285 2.952512       4.452957 0.000000       0.000000 2.952512       4.452957 ?        ?        15.67968 6.667285 0.000000       6.667285 
1 1 1 -2  40 1  o 12.52114 5.590561 -1.030502      3.476057 -0.7146226     5.681977 -1.219433      4.394307 16.31853 7.224673 14.02233 6.271531 2.296196       9.567027 
1 1 1 -2  40 2  f 30.75255 5.576252 12.52649       4.025036 3.675176       6.454321 18.15941       5.148891 20.48806 8.304479 37.00678 5.908034 -16.51873      10.19163 
1 1 1 -2  40 3  o 35.79033 4.486160 16.44222       3.826976 14.45240       5.104516 18.99626       5.783105 32.57431 6.655560 37.51330 6.565176 -4.938988      9.348691 
1 1 1 -2  40 4  o 37.38541 4.489914 17.93393       4.008744 15.20532       5.366251 21.37937       6.030077 33.31818 6.838604 39.89967 6.419534 -6.581490      9.379601 
1 1 1 -2  40 5  o 63.67495 3.276922 50.61060       5.067661 42.38908       6.916640 60.13906       7.446126 57.35122 4.998890 68.73681 4.469577 -11.38559      6.705671 
1 1 1 -2  40 6  o 28.10005 5.205765 10.43827       3.433496 7.700350       4.360252 14.90697       5.570475 23.63746 7.043155 32.73509 7.180906 -9.097630      10.05840 
1 1 1 -2  40 7  o 13.37600 5.615757 0.6838180      3.093940 -0.4206374     3.738472 3.084609       5.511847 13.46031 5.913631 18.93985 7.675227 -5.479547      9.689177 
1 1 1 -2  40 8  o 11.35232 5.160709 -1.509939      3.118501 -5.689531      3.655767 9.658011       5.975832 9.939056 4.823349 25.96974 8.334352 -16.03069      9.629440 
1 1 1 -2  40 9  o 10.72387 5.090973 -3.884748      3.594678 -5.796828      4.065402 2.967389       7.695972 10.66630 5.154679 20.70761 8.783576 -10.04132      10.18440 
1 1 1 -2  40 10 o 22.78480 7.791366 7.174103       5.200297 13.93358       7.384779 0.5249655      7.324256 30.17191 9.205062 18.71345 8.247352 11.45846       12.35929 
1 1 1 -2  40 11 o 49.07218 5.789270 32.28785       6.789911 24.77949       8.972938 42.34741       10.38609 40.06200 9.360597 54.06102 8.135658 -13.99903      12.40200 
1 1 1 -2  40 12 o 14.80290 6.383347 0.5268670      4.188058 -1.640386      6.384941 2.163420       5.548392 16.24071 7.383515 17.83261 7.505575 -1.591906      10.52853 
1 1 1 -2  40 13 o 11.65611 5.456185 -3.013555      3.873754 -8.707800      6.321484 0.4104902      4.901970 12.96584 6.303821 15.61725 6.818642 -2.651410      9.286120 
1 1 1 -2  40 14 o 22.83058 7.263257 7.597380       4.546198 9.873310       7.143189 6.047874       5.893990 25.25120 9.091840 21.30609 8.144571 3.945110       12.20638 
1 1 1 -2  40 15 o 20.14573 7.222034 5.587802       4.501671 8.921995       7.792259 3.917581       5.515121 24.24590 9.340123 18.97521 7.681879 5.270697       12.09335 
1 1 1 -2  40 16 o 48.22513 6.294446 32.72607       7.220822 43.24073       10.58095 23.56071       9.878748 52.81442 8.510377 36.19556 10.55354 16.61885       13.55743 
1 1 1 -2  40 17 o 19.56982 7.271439 5.255993       4.623920 -1.522470      7.895926 8.793838       5.704359 17.32257 7.998968 23.70059 8.158408 -6.378023      11.42555 
1 1 1 -2  40 18 o 16.93944 7.262952 2.078196       5.363160 0.000000       0.000000 2.078196       5.363160 ?        ?        16.93944 7.262952 0.000000       7.262952 
1 1 1 -2  40 19 o 19.47225 7.096884 5.500298       4.369613 1.767643       6.953972 7.935679       5.617041 17.87848 7.949635 22.30634 8.058266 -4.427855      11.31956 
1 1 1 -2  40 20 o 21.02217 7.233735 6.904492       4.484438 5.761406       7.637456 7.505940       5.539980 20.49250 8.723376 21.58541 7.970415 -1.092916      11.81629 
1 1 1 -2  40 21 o 24.58067 7.525522 10.02801       4.930205 20.33113       9.776354 6.514102       5.709367 30.37368 10.66704 20.32084 7.948302 10.05285       13.30268 
1 1 1 -2  40 22 o 17.25110 6.889254 4.040249       4.371500 6.339775       7.814446 2.992856       5.273924 20.18631 8.712232 16.83208 7.209297 3.354231       11.30827 
1 1 1 -2  40 23 o 12.88461 5.965569 -1.283252      4.435018 5.469856       7.568972 -4.814079      5.472972 19.26820 8.441337 12.46113 6.011878 6.807076       10.36334 
1 1 1 -2  40 24 o 15.01537 6.290115 2.435499       3.868458 6.000822       8.365975 1.465842       4.362908 19.43803 8.676349 14.59717 6.401525 4.840863       10.78233 
1 1 1 -2  40 25 o 18.87379 6.835238 5.956254       4.044591 4.686296       8.232024 6.360376       4.643742 18.41103 8.375495 19.20417 7.255430 -0.7931442     11.08107 
1 1 1 -2  41 1  o 31.78721 5.478943 13.54758       4.090890 13.17898       4.969584 14.32242       7.205159 30.61552 6.834300 30.61549 9.036691 0.2670288E-04  11.33002 
1 1 1 -2  41 2  o 16.74976 6.345627 3.074970       3.557873 1.148122       4.381191 6.806540       6.096972 15.70543 6.642973 22.63352 8.360770 -6.928093      10.67856 
1 1 1 -2  41 3  o 20.46898 6.213052 5.732198       3.370061 7.155281       4.582068 4.055260       4.973992 22.60917 7.301882 19.14111 7.438194 3.468063       10.42325 
1 1 1 -2  41 4  o 20.78873 6.152477 5.941304       3.336193 3.315398       4.551333 8.990705       4.904631 17.98156 7.077619 24.98990 7.475580 -7.008347      10.29451 
1 1 1 -2  41 5  o 40.85275 4.112730 21.44897       4.038713 30.98256       5.958577 13.34702       5.492995 48.52287 5.116097 30.34581 7.477258 18.17706       9.060013 
1 1 1 -2  41 6  o 44.84315 3.875648 25.69086       4.193697 28.19726       6.100677 23.44544       5.774336 45.91861 5.565425 41.63657 5.852344 4.282040       8.076131 
1 1 1 -2  41 7  o 16.42059 6.141900 3.084875       3.309681 2.916827       4.208754 3.357197       5.357700 17.12313 6.785288 18.64981 7.563692 -1.526686      10.16118 
1 1 1 -2  41 8  o 14.17984 5.991528 0.9112865      3.558015 0.6207135      4.360522 1.490151       6.154595 15.07946 6.508094 17.86857 7.721923 -2.789112      10.09868 
1 1 1 -2  41 9  o 22.98800 6.125946 7.447294       3.493574 8.750827       4.942677 6.145886       4.938646 24.35566 7.549077 21.12854 7.565609 3.227123       10.68770 
1 1 1 -2  41 10 o 37.03862 4.925116 18.26226       4.335289 15.19362       7.111314 20.07729       5.469127 30.85275 8.942070 38.04889 6.104876 -7.196146      10.82729 
1 1 1 -2  41 11 o 38.54757 4.998652 19.86577       4.585080 23.81913       8.524553 18.25650       5.438813 38.49312 9.210976 35.92512 6.449554 2.568001       11.24450 
1 1 1 -2  41 12 o 22.11036 6.595745 7.072113       3.822167 11.28202       7.413163 5.547741       4.460801 26.31079 9.284683 20.05074 7.189034 6.260052       11.74255 
1 1 1 -2  41 13 o 15.84348 6.373980 2.422374       3.770831 4.728194       6.267040 1.113863       4.721047 20.02040 8.157817 15.70871 6.775686 4.311686       10.60471 
1 1 1 -2  41 14 o 29.40652 6.197280 12.41673       4.300716 11.09184       8.115072 12.93417       5.071488 25.58399 9.607388 29.29475 7.164503 -3.710758      11.98466 
1 1 1 -2  41 15 f 33.95326 5.791756 16.24961       4.620338 4.419566       8.263635 21.62969       5.572790 20.56384 8.917069 39.02765 6.055682 -18.46380      10.77893 
1 1 1 -2  41 16 o 15.34890 6.635531 1.237993       4.548028 0.000000       0.000000 1.237993       4.548028 ?        ?        15.34890 6.635531 0.000000       6.635531 
1 1 1 -2  41 17 o 27.06483 6.394001 10.96094       4.149593 17.39842       8.785184 9.112256       4.707868 29.74394 10.12784 23.92485 7.359292 5.819092       12.51928 
1 1 1 -2  41 18 o 25.53141 6.598990 10.02631       4.135315 17.32816       9.114639 8.133678       4.640403 28.87912 10.28503 22.46526 7.354986 6.413858       12.64427 
1 1 1 -2  41 19 o 13.20619 5.860124 0.1853433      3.759434 7.628993       7.659160 -2.177223      4.314994 21.32874 8.886537 12.38098 5.783426 8.947755       10.60276 
1 1 1 -2  41 20 o 17.93141 6.774642 4.773887       4.048713 -1.376723      7.914971 6.953586       4.711818 16.29679 7.681847 20.51255 7.384335 -4.215761      10.65548 
1 1 1 -2  41 21 o 14.57970 6.249415 1.740609       3.968674 8.601065       8.322364 -0.2786778     4.515119 21.29827 9.087500 13.62362 6.199661 7.674651       11.00084 
1 1 1 -2  41 22 f 14.61566 6.402959 1.474019       4.354707 2.961063       7.598678 0.7467859      5.313896 17.66691 8.040827 14.97516 6.779412 2.691748       10.51738 
1 1 1 -2  41 23 o 15.62070 6.450870 3.063671       3.986210 15.86395       8.663833 -0.3736690     4.489641 25.50678 9.842617 13.33078 6.110238 12.17600       11.58500 
1 1 1 -2  42 1  o 22.26440 5.928364 6.971365       3.273491 8.036744       4.717307 5.981847       4.546260 23.37850 7.393990 20.73426 7.274743 2.644234       10.37270 
1 1 1 -2  42 2  o 45.77058 3.631632 26.77442       4.017466 19.51781       6.074793 32.41528       5.355965 36.77129 7.035565 49.81768 4.458924 -13.04639      8.329537 
1 1 1 -2  42 3  o 52.03968 3.593876 34.54660       4.529583 36.46798       6.742159 32.96594       6.115226 52.06514 5.391879 49.71009 5.121352 2.355053       7.436438 
1 1 1 -2  42 4  o 17.21192 6.485426 3.539081       3.704785 2.512625       4.640178 5.343961       6.153022 16.97672 6.980174 20.72182 8.206458 -3.745098      10.77352 
1 1 1 -2  42 5  o 13.04146 5.853358 -0.8483443     3.864524 -3.415265      4.242505 11.66210       9.365966 12.00853 5.649208 26.58847 10.24062 -14.57994      11.69546 
1 1 1 -2  42 6  o 14.08792 5.966846 0.9581782      3.542652 -3.316860      4.374418 9.105808       6.039013 12.27099 5.761250 24.35637 8.393899 -12.08539      10.18084 
1 1 1 -2  42 7  o 23.32867 6.680860 7.934206       3.991933 4.748041       5.041203 13.29104       6.536637 19.41792 7.503983 28.80779 8.633075 -9.389870      11.43852 
1 1 1 -2  42 8  o 11.72895 5.367891 -1.562261      3.447507 -0.7820300     4.492478 -2.679922      5.376866 13.99456 6.293614 14.07565 6.534811 -0.8108711E-01 9.072670 
1 1 1 -2  42 9  o 11.11939 5.107133 -1.615671      3.158542 -1.227839      4.498536 -1.992766      4.435829 13.66367 6.206276 13.07631 6.022820 0.5873604      8.648250 
1 1 1 -2  42 10 o 16.00818 6.265346 2.821764       3.549387 3.442640       5.720197 2.433051       4.526093 18.46999 7.686340 16.56096 6.859753 1.909029       10.30223 
1 1 1 -2  42 11 o 16.75753 6.749514 2.974353       4.233532 0.3471194E-02  6.700950 4.947914       5.461587 16.90928 7.638013 19.54659 7.734605 -2.637310      10.87030 
1 1 1 -2  42 12 o 18.70858 6.726259 4.893539       3.907972 3.769749       7.271787 5.349916       4.634046 19.51333 8.412917 19.50018 7.272824 0.1315308E-01  11.12075 
1 1 1 -2  42 13 o 24.57344 7.329935 9.493679       4.720580 7.844906       7.225127 10.72171       6.235486 22.28453 8.870913 25.17522 8.533032 -2.890690      12.30877 
1 1 1 -2  42 14 o 34.45845 6.623362 17.76270       5.359727 0.000000       0.000000 17.76270       5.359727 ?        ?        34.45845 6.623362 0.000000       6.623362 
1 1 1 -2  42 15 o 27.22519 7.400838 11.94564       5.037837 0.000000       0.000000 11.94564       5.037837 ?        ?        27.22519 7.400838 0.000000       7.400838 
1 1 1 -2  42 16 o 11.35185 5.295497 -2.062557      3.597726 3.936386       6.864249 -4.334678      4.224462 18.66987 8.111193 11.13445 5.348813 7.535428       9.716031 
1 1 1 -2  42 17 o 22.23507 6.865031 7.961094       4.092139 2.377209       7.780256 10.09657       4.811414 18.02182 8.176379 24.54857 7.417920 -6.526754      11.03987 
1 1 1 -2  42 18 o 13.70504 6.023347 0.7602140      3.881707 1.388309       7.409503 0.5226246      4.557113 17.13759 7.853050 14.29467 6.390471 2.842920       10.12465 
1 1 1 -2  42 19 o 45.13457 4.763751 28.54114       5.160607 40.51127       10.90511 25.08693       5.858070 44.53060 10.26032 40.71941 6.090396 3.811188       11.93177 
1 1 1 -2  42 20 o 13.68814 6.210063 0.2910354E-01  4.487774 -3.494649      7.544353 1.958803       5.582954 14.87162 7.145096 15.95057 7.105805 -1.078952      10.07695 
1 1 1 -2  42 21 o 48.52830 5.236727 34.31470       6.094910 25.84959       9.888658 39.50061       7.739868 32.25522 10.74425 49.99998 6.506423 -17.74476      12.56075 
1 1 1 -2  43 1  o 24.04602 5.996728 8.317588       3.501850 1.844740       4.947305 14.81698       4.957439 16.45215 7.012762 31.85440 6.603358 -15.40225      9.632402 
1 1 1 -2  43 2  o 8.519134 4.217869 -6.783261      3.264814 -1.997239      4.260514 -13.59155      5.081519 12.75157 5.883784 9.602482 4.829537 3.149090       7.612052 
1 1 1 -2  43 3  o 38.60342 4.954445 20.15346       4.553442 20.01546       5.932087 20.35140       7.104377 36.91073 6.847106 35.77007 8.309429 1.140667       10.76705 
1 1 1 -2  43 4  o 49.36269 3.586687 31.36619       4.285046 24.36723       5.793084 39.82194       6.367504 41.68525 5.864781 54.49158 4.845650 -12.80634      7.607626 
1 1 1 -2  43 5  o 22.08193 6.326695 7.155951       3.579127 4.736129       5.050172 9.597897       5.073205 19.09901 7.473921 24.74519 7.644438 -5.646185      10.69097 
1 1 1 -2  43 6  o 20.71531 6.309924 6.281902       3.471851 3.670712       4.901168 8.911867       4.918758 17.91175 7.245176 23.87005 7.550314 -5.958298      10.46422 
1 1 1 -2  43 7  o 12.34715 5.390520 0.1503391      3.063181 -0.3354916E-01 4.228835 0.3533325      4.443086 13.97110 6.206498 14.55011 6.417571 -0.5790129     8.927813 
1 1 1 -2  43 8  o 10.92362 5.032429 -1.583699      3.099352 -0.8205312     4.363022 -2.361110      4.403548 13.55443 6.138934 12.63588 5.882466 0.9185524      8.502348 
1 1 1 -2  43 9  o 25.90652 6.018560 9.820994       3.726856 10.51620       4.945786 8.907578       5.669085 25.70312 7.459566 23.31214 8.127486 2.390984       11.03182 
1 1 1 -2  43 10 o 50.87832 4.841822 35.27743       5.930847 38.78995       10.55484 33.65664       7.169788 46.96817 9.547478 48.05278 6.272398 -1.084606      11.42354 
1 1 1 -2  43 11 o 17.91412 6.881670 4.379797       4.221773 0.5165612      7.388657 6.252463       5.144227 17.27247 7.887279 20.22667 7.637595 -2.954199      10.97916 
1 1 1 -2  43 12 o 26.59139 8.729749 12.78699       6.535342 0.000000       0.000000 12.78699       6.535342 ?        ?        26.59139 8.729749 0.000000       8.729749 
1 1 1 -2  43 13 o 29.62680 8.664404 15.83591       6.649774 0.000000       0.000000 15.83591       6.649774 ?        ?        29.62680 8.664404 0.000000       8.664404 
1 1 1 -2  43 14 o 17.48875 7.198296 3.927494       4.941509 2.489638       8.638211 4.626899       6.024635 18.51793 8.483195 18.57247 7.819253 -0.5453682E-01 11.53713 
1 1 1 -2  43 15 o 15.63444 6.733104 2.125895       4.647796 3.605858       8.023600 1.378511       5.701846 18.62459 8.390319 15.96888 7.142894 2.655704       11.01900 
1 1 1 -2  43 16 o 32.44458 7.069045 17.05918       5.430671 14.83005       8.761395 18.44995       6.920455 25.64696 9.897570 31.43383 8.726027 -5.786875      13.19490 
1 1 1 -2  43 17 o 12.13179 5.751779 -2.864800      4.559051 14.22668       7.989032 -11.11870      5.551804 25.41235 9.534684 10.50466 5.249185 14.90769       10.88412 
1 1 1 -2  43 18 o 17.09979 7.461953 3.442236       5.863809 5.832783       7.709512 0.1612156      9.031976 19.22050 8.466513 17.10523 8.105624 2.115271       11.72105 
1 1 1 -2  44 1  o 11.00169 5.021027 -1.131212      2.988969 1.432127       4.622406 -2.973186      3.918382 15.43328 6.680790 11.42988 5.392991 4.003403       8.585878 
1 1 1 -2  44 2  o 15.42342 5.936178 2.868558       3.145557 2.803273       4.800562 2.917676       4.164018 16.75133 7.011486 16.33817 6.652553 0.4131660      9.665268 
1 1 1 -2  44 3  o 13.77481 5.777627 1.370323       3.270003 1.368339       4.636566 1.372287       4.612495 15.37893 6.673989 15.35677 6.660551 0.2216434E-01  9.428948 
1 1 1 -2  44 4  o 31.78438 5.094584 14.10079       3.812762 15.63331       5.641769 12.81245       5.172820 31.26256 7.501479 28.26070 7.418541 3.001858       10.55021 
1 1 1 -2  44 5  o 33.39388 5.075469 15.55582       4.000432 19.62151       6.092331 12.47407       5.304141 35.32986 7.317236 27.60054 7.630769 7.729322       10.57216 
1 1 1 -2  44 6  o 23.04585 6.144941 8.004188       3.513995 8.549828       5.566062 7.642587       4.531158 22.54916 8.036582 21.83408 7.272974 0.7150841      10.83895 
1 1 1 -2  44 7  o 43.70002 4.142606 25.53761       4.358873 18.40674       6.279373 32.16904       6.055477 33.38741 7.850711 47.81161 5.285450 -14.42421      9.464125 
1 1 1 -2  44 8  o 15.25587 6.155370 2.582600       3.527698 11.81890       5.271580 -4.908000      4.747338 26.51741 7.702934 11.65499 5.617000 14.86242       9.533408 
1 1 1 -2  44 9  o 15.08143 6.016087 2.614313       3.329895 1.688110       4.958869 3.374924       4.493775 15.70701 6.857962 16.77621 6.880332 -1.069207      9.714454 
1 1 1 -2  44 10 o 15.31121 7.007212 -0.1418297     5.874334 0.000000       0.000000 -0.1418297     5.874334 ?        ?        15.31121 7.007212 0.000000       7.007212 
1 1 1 -2  44 11 o 10.47592 5.125875 -6.236372      4.373519 0.000000       0.000000 -6.236372      4.373519 ?        ?        10.47592 5.125875 0.000000       5.125875 
1 1 1 -2  44 12 o 17.79602 6.758067 4.696780       4.041176 4.890729       7.805527 4.625754       4.723526 19.19345 8.484041 17.91869 7.159458 1.274763       11.10121 
1 1 1 -2  44 13 o 19.68485 7.002508 6.312855       4.223948 -3.282830      8.149151 9.837963       4.939245 15.59265 7.474278 23.75460 7.572257 -8.161951      10.63973 
1 1 1 -2  44 14 o 30.27194 6.326639 14.27419       4.516560 31.06654       9.980919 9.950099       5.064802 37.81552 10.47243 23.65179 7.679981 14.16373       12.98669 
1 1 1 -2  44 15 o 12.61546 5.740874 -0.4612394     3.871581 -0.1870432     7.906127 -0.5477327     4.440423 16.42189 7.721163 13.27565 6.081864 3.146239       9.828806 
1 1 1 -2  45 1  o 12.18946 5.412974 -0.7623282E-02 3.213557 -2.208439      4.917313 1.633010       4.245625 13.11637 6.142188 14.92183 6.430792 -1.805458      8.892781 
1 1 1 -2  45 2  o 12.76724 5.669776 0.1222496      3.526059 3.184679       4.670780 -3.935634      5.376580 16.63889 6.936638 12.85176 6.136180 3.787131       9.261190 
1 1 1 -2  45 3  o 16.15446 6.143355 3.517275       3.342342 10.30555       5.245176 -1.123521      4.336872 24.37665 7.806743 12.98326 5.970975 11.39339       9.828417 
1 1 1 -2  45 4  o 14.77456 6.099716 2.212085       3.562687 8.331704       5.318977 -2.767458      4.798004 21.96318 7.853019 12.65134 5.968824 9.311838       9.863913 
1 1 1 -2  45 5  o 11.23095 5.187991 -1.431493      3.325968 1.714124       4.939513 -4.040604      4.498601 15.59151 6.825197 11.59750 5.557648 3.994008       8.801748 
1 1 1 -2  45 6  o 19.17678 6.666265 5.764371       3.812411 9.110415       5.343482 2.295128       5.440965 22.74095 7.892889 16.38165 7.167365 6.359308       10.66156 
1 1 1 -2  45 7  o 25.16768 6.213761 9.806545       3.787804 10.87348       5.660588 8.941441       5.097136 24.47839 8.128320 22.62791 7.714257 1.850477       11.20622 
1 1 1 -2  45 8  o 15.31001 6.568958 2.089770       4.392966 -4.051741      6.812467 6.461331       5.747580 14.23006 6.824488 19.77317 7.898477 -5.543110      10.43837 
1 1 1 -2  45 9  f 21.91454 6.936537 7.957569       4.150917 1.976936       7.212728 10.91926       5.075696 17.17969 7.824848 24.98410 7.633206 -7.804409      10.93134 
1 1 1 -2  45 10 o 32.98536 5.908185 16.39268       4.574683 28.99316       9.641527 12.73179       5.196921 36.71733 10.33887 27.11223 7.574947 9.605093       12.81686 
1 1 1 -1  0  1  o 103.3683 3.072243 130.5460       7.723416 130.5460       7.723416 130.5460       7.723416 103.3683 3.072243 103.3683 3.072243 0.000000       0.000000 
1 1 1 -1  0  2  o 374.3115 11.09496 1713.410       101.0020 1713.410       101.0020 1713.410       101.0020 374.3115 11.09496 374.3115 11.09496 0.000000       0.000000 
1 1 1 -1  0  3  f 260.4421 5.696894 827.8836       36.11736 827.8836       36.11736 827.8836       36.11736 260.4421 5.696894 260.4421 5.696894 0.000000       0.000000 
1 1 1 -1  0  4  o 258.9974 5.682941 818.7312       35.82882 818.7312       35.82882 818.7312       35.82882 258.9974 5.682941 258.9974 5.682941 0.000000       0.000000 
1 1 1 -1  0  5  o 26.03478 2.920743 8.566475       1.793211 8.566475       1.793211 8.566475       1.793211 26.03478 2.920743 26.03478 2.920743 0.000000       0.000000 
1 1 1 -1  0  6  o 388.6988 8.134854 1844.356       76.97852 1844.356       76.97852 1844.356       76.97852 388.6988 8.134854 388.6988 8.134854 0.000000       0.000000 
1 1 1 -1  0  7  o 87.78896 3.071507 94.25629       6.552678 94.25629       6.552678 94.25629       6.552678 87.78896 3.071507 87.78896 3.071507 0.000000       0.000000 
1 1 1 -1  0  8  o 749.1433 15.20149 6860.520       277.2577 6860.520       277.2577 6860.520       277.2577 749.1433 15.20149 749.1433 15.20149 0.000000       0.000000 
1 1 1 -1  0  9  o 306.5051 9.366603 1148.865       69.81298 1148.865       69.81298 1148.865       69.81298 306.5051 9.366603 306.5051 9.366603 0.000000       0.000000 
1 1 1 -1  0  10 o 227.1514 5.207886 629.8771       28.79368 629.8771       28.79368 629.8771       28.79368 227.1514 5.207886 227.1514 5.207886 0.000000       0.000000 
1 1 1 -1  0  11 o 234.6061 5.350854 671.9471       30.55541 671.9471       30.55541 671.9471       30.55541 234.6061 5.350854 234.6061 5.350854 0.000000       0.000000 
1 1 1 -1  0  12 o 55.43798 3.322526 37.85622       4.451329 37.85622       4.451329 37.85622       4.451329 55.43798 3.322526 55.43798 3.322526 0.000000       0.000000 
1 1 1 -1  0  13 o 265.4563 5.926658 860.4233       38.29570 860.4233       38.29570 860.4233       38.29570 265.4563 5.926658 265.4563 5.926658 0.000000       0.000000 
1 1 1 -1  0  14 o 79.80892 4.956136 78.53339       9.552836 78.53339       9.552836 78.53339       9.552836 79.80892 4.956136 79.80892 4.956136 0.000000       0.000000 
1 1 1 -1  0  15 o 277.8773 8.789375 944.6310       59.38289 944.6310       59.38289 944.6310       59.38289 277.8773 8.789375 277.8773 8.789375 0.000000       0.000000 
1 1 1 -1  0  16 o 144.9019 4.063896 256.4802       14.32450 256.4802       14.32450 256.4802       14.32450 144.9019 4.063896 144.9019 4.063896 0.000000       0.000000 
1 1 1 -1  0  17 o 227.0225 5.334696 629.1779       29.47629 629.1779       29.47629 629.1779       29.47629 227.0225 5.334696 227.0225 5.334696 0.000000       0.000000 
1 1 1 -1  0  18 o 358.0107 7.679434 1564.632       66.92833 1564.632       66.92833 1564.632       66.92833 358.0107 7.679434 358.0107 7.679434 0.000000       0.000000 
1 1 1 -1  0  19 o 261.3148 5.958114 833.5767       37.89647 833.5767       37.89647 833.5767       37.89647 261.3148 5.958114 261.3148 5.958114 0.000000       0.000000 
1 1 1 -1  0  20 o 151.2311 4.305686 279.3954       15.83881 279.3954       15.83881 279.3954       15.83881 151.2311 4.305686 151.2311 4.305686 0.000000       0.000000 
1 1 1 -1  0  21 o 1084.316 31.27640 14511.95       824.8784 14511.95       824.8784 14511.95       824.8784 1084.316 31.27640 1084.316 31.27640 0.000000       0.000000 
1 1 1 -1  0  22 o 420.5705 12.57768 2165.232       128.6456 2165.232       128.6456 2165.232       128.6456 420.5705 12.57768 420.5705 12.57768 0.000000       0.000000 
1 1 1 -1  0  23 o 656.0485 13.46504 5265.302       215.0636 5265.302       215.0636 5265.302       215.0636 656.0485 13.46504 656.0485 13.46504 0.000000       0.000000 
1 1 1 -1  0  24 o 267.7424 6.147258 875.4814       40.06060 875.4814       40.06060 875.4814       40.06060 267.7424 6.147258 267.7424 6.147258 0.000000       0.000000 
1 1 1 -1  0  25 o 253.8057 5.928547 786.8923       36.62269 786.8923       36.62269 786.8923       36.62269 253.8057 5.928547 253.8057 5.928547 0.000000       0.000000 
1 1 1 -1  0  26 o 147.1216 6.425676 265.6027       22.93703 265.6027       22.93703 265.6027       22.93703 147.1216 6.425676 147.1216 6.425676 0.000000       0.000000 
1 1 1 -1  0  27 o 307.4666 6.881117 1155.984       51.49934 1155.984       51.49934 1155.984       51.49934 307.4666 6.881117 307.4666 6.881117 0.000000       0.000000 
1 1 1 -1  0  28 o 127.2601 4.264247 198.1903       13.19056 198.1903       13.19056 198.1903       13.19056 127.2601 4.264247 127.2601 4.264247 0.000000       0.000000 
1 1 1 -1  0  29 o 49.07643 5.257856 30.39384       6.106144 30.39384       6.106144 30.39384       6.106144 49.07643 5.257856 49.07643 5.257856 0.000000       0.000000 
1 1 1 -1  0  30 o 19.90869 11.09069 6.636236       7.987792 6.636236       7.987792 6.636236       7.987792 19.90869 11.09069 19.90869 11.09069 0.000000       0.000000 
1 1 1 -1  0  31 o 58.23312 4.960931 42.29722       6.917807 42.29722       6.917807 42.29722       6.917807 58.23312 4.960931 58.23312 4.960931 0.000000       0.000000 
1 1 1 -1  0  32 o 19.63795 9.366033 6.951011       5.127531 6.951011       5.127531 6.951011       5.127531 19.63795 9.366033 19.63795 9.366033 0.000000       0.000000 
1 1 1 -1  0  33 o 38.91396 9.603543 21.64236       7.883655 21.64236       7.883655 21.64236       7.883655 38.91396 9.603543 38.91396 9.603543 0.000000       0.000000 
1 1 1 -1  0  34 o 54.65900 5.305331 37.54970       6.903486 37.54970       6.903486 37.54970       6.903486 54.65900 5.305331 54.65900 5.305331 0.000000       0.000000 
1 1 1 -1  0  35 o 34.67651 8.205916 16.99999       6.020740 16.99999       6.020740 16.99999       6.020740 34.67651 8.205916 34.67651 8.205916 0.000000       0.000000 
1 1 1 -1  0  36 o 102.2715 4.597636 128.6740       11.40557 128.6740       11.40557 128.6740       11.40557 102.2715 4.597636 102.2715 4.597636 0.000000       0.000000 
1 1 1 -1  0  37 o 32.82882 13.00318 18.52471       10.02130 18.52471       10.02130 18.52471       10.02130 32.82882 13.00318 32.82882 13.00318 0.000000       0.000000 
1 1 1 -1  0  38 o 89.40327 4.703813 98.70220       10.18284 98.70220       10.18284 98.70220       10.18284 89.40327 4.703813 89.40327 4.703813 0.000000       0.000000 
1 1 1 -1  0  39 o 83.91190 4.789832 87.20594       9.720852 87.20594       9.720852 87.20594       9.720852 83.91190 4.789832 83.91190 4.789832 0.000000       0.000000 
1 1 1 -1  0  40 o 84.84863 4.654827 89.21909       9.557971 89.21909       9.557971 89.21909       9.557971 84.84863 4.654827 84.84863 4.654827 0.000000       0.000000 
1 1 1 -1  0  41 o 30.33384 9.246863 14.29592       5.968387 14.29592       5.968387 14.29592       5.968387 30.33384 9.246863 30.33384 9.246863 0.000000       0.000000 
1 1 1 -1  0  42 o 102.2448 4.584724 129.9083       11.37083 129.9083       11.37083 129.9083       11.37083 102.2448 4.584724 102.2448 4.584724 0.000000       0.000000 
1 1 1 -1  0  43 o 33.63931 10.95708 18.70899       7.949957 18.70899       7.949957 18.70899       7.949957 33.63931 10.95708 33.63931 10.95708 0.000000       0.000000 
1 1 1 -1  0  44 o 44.59595 6.472322 26.78410       6.602514 26.78410       6.602514 26.78410       6.602514 44.59595 6.472322 44.59595 6.472322 0.000000       0.000000 
1 1 1 -1  0  45 o 12.86307 7.967736 2.179320       4.961617 2.179320       4.961617 2.179320       4.961617 12.86307 7.967736 12.86307 7.967736 0.000000       0.000000 
1 1 1 -1  0  46 o 17.80983 9.344562 6.836474       5.351496 6.836474       5.351496 6.836474       5.351496 17.80983 9.344562 17.80983 9.344562 0.000000       0.000000 
1 1 1 -1  0  47 o 18.17946 9.545293 7.609295       5.586909 7.609295       5.586909 7.609295       5.586909 18.17946 9.545293 18.17946 9.545293 0.000000       0.000000 
1 1 1 -1  0  48 o 14.45234 8.613475 4.660122       5.336930 4.660122       5.336930 4.660122       5.336930 14.45234 8.613475 14.45234 8.613475 0.000000       0.000000 
1 1 1 -1  0  49 o 16.23723 9.133197 6.847093       5.481947 6.847093       5.481947 6.847093       5.481947 16.23723 9.133197 16.23723 9.133197 0.000000       0.000000 
1 1 1 -1  0  50 o 7.863366 5.617072 -4.909062      4.863323 -4.909062      4.863323 -4.909062      4.863323 7.863366 5.617072 7.863366 5.617072 0.000000       0.000000 
1 1 1 -1  0  51 o 10.32712 6.900784 1.113937       4.773365 1.113937       4.773365 1.113937       4.773365 10.32712 6.900784 10.32712 6.900784 0.000000       0.000000 
1 1 1 -1  1  1  o 38.02971 1.999412 17.67176       1.846431 20.54154       3.240801 16.29247       2.246755 40.92487 3.276954 36.47657 2.543520 4.448296       4.148243 
1 1 1 -1  1  2  o 365.5016 7.650090 1629.341       68.13839 1567.509       94.04156 1697.677       98.86366 358.1638 10.78691 372.7408 10.89582 -14.57703      15.33220 
1 1 1 -1  1  3  o 206.4572 3.340137 519.4548       16.80469 505.0714       23.40331 534.7642       24.14487 203.5598 4.717905 209.4577 4.730342 -5.897903      6.680925 
1 1 1 -1  1  4  o 526.9760 7.618797 3386.979       97.83931 3438.138       139.7584 3337.811       137.0137 530.6784 10.80713 522.8835 10.75284 7.794861       15.24525 
1 1 1 -1  1  5  o 452.6996 6.604132 2498.883       72.85542 2547.478       104.3530 2452.671       101.7621 456.9096 9.372135 448.3309 9.314322 8.578766       13.21338 
1 1 1 -1  1  6  o 410.9397 6.041111 2058.878       60.49662 2002.193       84.02494 2119.889       87.17210 405.1201 8.511151 416.8531 8.581404 -11.73300      12.08636 
1 1 1 -1  1  7  o 330.1317 4.963061 1328.502       39.92759 1294.290       55.54681 1365.077       57.43267 325.7859 6.996658 334.5744 7.044176 -8.788452      9.928426 
1 1 1 -1  1  8  o 679.4938 9.753553 5635.260       161.5044 5700.546       230.2398 5572.018       226.6070 682.8328 13.83662 675.1014 13.77426 7.731384       19.52389 
1 1 1 -1  1  9  o 564.7657 9.428471 3893.244       129.7615 3904.158       225.0281 3887.807       158.8279 564.3167 16.38089 564.1210 11.55363 0.1956787      20.04545 
1 1 1 -1  1  10 o 101.7131 2.727620 126.1673       6.754676 122.8348       8.181739 133.3006       11.97031 100.3365 3.350890 104.4623 4.714445 -4.125763      5.783982 
1 1 1 -1  1  11 o 314.2216 4.787294 1203.816       36.65745 1216.265       52.13165 1191.641       51.55608 315.7393 6.775428 312.5271 6.769492 3.212189       9.577706 
1 1 1 -1  1  12 o 132.2653 2.655725 213.2073       8.559833 214.9734       12.12233 211.4510       12.08860 132.7433 3.751226 131.6495 3.771974 1.093811       5.319726 
1 1 1 -1  1  13 o 297.1020 4.582002 1076.321       33.17393 1076.076       46.90709 1076.565       46.92295 296.9572 6.481993 297.0245 6.482714 -0.6735229E-01 9.167432 
1 1 1 -1  1  14 o 189.5885 3.789586 438.1600       17.50813 427.4570       21.15564 461.4241       31.19003 187.2369 4.636589 194.3532 6.595041 -7.116287      8.061794 
1 1 1 -1  1  15 o 498.0076 8.411714 3027.603       102.0837 3024.892       176.9314 3028.955       124.9852 496.6233 14.63577 497.8840 10.30135 -1.260773      17.89759 
1 1 1 -1  1  16 o 158.6372 2.989670 306.6897       11.55751 307.7812       16.33774 305.5963       16.35186 158.8481 4.224346 158.2821 4.243176 0.5659790      5.987457 
1 1 1 -1  1  17 o 737.3353 10.59193 6637.556       190.3164 6678.573       270.2664 6597.210       268.0434 738.8632 15.01039 734.3550 14.97831 4.508179       21.20523 
1 1 1 -1  1  18 o 428.0563 6.348261 2234.104       66.22040 2210.349       92.93095 2258.609       94.38556 425.6308 8.959654 430.2495 9.002209 -4.618713      12.70099 
1 1 1 -1  1  19 o 344.5740 5.250340 1447.378       44.08654 1507.257       63.93450 1393.096       60.87362 351.5424 7.463139 337.9703 7.391193 13.57208       10.50372 
1 1 1 -1  1  20 f 784.8118 13.02084 7529.338       249.0237 7728.436       310.4797 7170.267       416.9561 794.4506 16.03726 763.0985 22.44636 31.35211       27.58682 
1 1 1 -1  1  21 o 386.4754 6.705058 1821.680       63.14814 1835.342       109.4657 1814.865       77.30863 387.3739 11.60919 385.6572 8.226032 1.716675       14.22817 
1 1 1 -1  1  22 o 807.3952 13.40886 7978.997       263.8239 7943.506       322.2446 8051.146       459.4543 804.6841 16.43328 806.9926 23.38811 -2.308472      28.58419 
1 1 1 -1  1  23 o 135.7729 3.007789 224.6743       9.951687 226.8209       14.02602 222.4981       14.12209 136.3362 4.226805 135.0260 4.297331 1.310135       6.027680 
1 1 1 -1  1  24 o 198.1591 3.553388 478.6862       17.15903 469.3185       24.00323 488.4766       24.53871 196.0975 5.027128 200.0618 5.037291 -3.964310      7.116622 
1 1 1 -1  1  25 o 487.9550 7.210112 2909.042       85.73495 2945.732       122.1581 2873.427       120.3570 490.3482 10.22308 484.2993 10.19815 6.048920       14.44000 
1 1 1 -1  1  26 o 110.9539 3.420301 150.2624       9.236856 156.1857       11.37730 138.8088       15.82080 113.0771 4.135813 106.4233 6.126248 6.653763       7.391608 
1 1 1 -1  1  27 o 97.64916 3.438689 116.4480       8.169946 130.6248       15.16281 110.6485       9.698137 103.1978 6.056005 95.12917 4.193795 8.068619       7.366350 
1 1 1 -1  1  28 o 61.35978 3.247179 46.05655       4.838126 47.38020       6.784959 44.68732       6.900797 62.12574 4.512427 60.30135 4.734017 1.824387       6.540101 
1 1 1 -1  1  29 o 75.84000 3.622783 70.36245       6.676042 75.83736       12.15270 67.99611       7.989570 78.42196 6.415160 74.47662 4.422083 3.945335       7.791605 
1 1 1 -1  1  30 o 83.50859 3.039027 85.20177       6.174146 83.03042       8.646612 87.46061       8.819064 82.32034 4.325429 84.49679 4.297091 -2.176445      6.097075 
1 1 1 -1  1  31 o 16.37911 6.675634 1.233519       4.197794 -1.160308      5.006897 6.897499       7.701640 15.68631 6.869020 25.96177 9.427835 -10.27546      11.66480 
1 1 1 -1  1  32 o 98.31493 3.105786 118.1196       7.431594 125.7602       10.79657 111.2400       10.24485 101.3036 4.383832 95.25920 4.425383 6.044411       6.229125 
1 1 1 -1  1  33 o 71.57867 3.797939 62.81055       6.601011 65.83286       8.229812 57.35890       11.05309 73.17794 4.638898 67.92619 6.767394 5.251755       8.204694 
1 1 1 -1  1  34 o 56.48706 3.718758 39.18741       5.090501 33.57702       7.104699 45.10606       7.297276 51.96800 5.703764 60.44156 4.999043 -8.473564      7.584415 
1 1 1 -1  1  35 o 90.61082 3.209551 100.4722       7.075775 107.4459       10.09683 93.74225       9.918860 93.52536 4.442863 87.30379 4.679314 6.221565       6.452519 
1 1 1 -1  1  36 o 82.97155 3.340942 84.33941       6.741325 85.93279       9.484225 82.71236       9.583904 83.53701 4.677620 81.92465 4.821880 1.612358       6.717935 
1 1 1 -1  1  37 o 22.68899 7.670950 6.020861       5.039040 3.638208       6.041120 11.46975       9.135685 21.11171 8.199199 30.76759 10.32848 -9.655872      13.18728 
1 1 1 -1  1  38 f 36.18840 5.466300 16.53015       4.670443 23.55010       6.802410 10.26980       6.423843 43.02744 6.706084 28.37654 8.570499 14.65090       10.88233 
1 1 1 -1  1  39 o 70.97384 3.510948 61.97547       6.053529 72.15514       8.740899 52.59282       8.391737 76.30733 4.723765 64.93838 5.350333 11.36896       7.137228 
1 1 1 -1  1  40 o 79.61736 3.395173 78.05080       6.572151 76.93150       9.171262 79.23232       9.422688 78.63239 4.809210 79.78291 4.869702 -1.150520      6.844158 
1 1 1 -1  1  41 o 54.54596 3.979345 37.01476       5.253059 37.69365       7.243374 36.26155       7.629555 54.53546 5.526585 53.30744 5.975960 1.228020       8.139732 
1 1 1 -1  1  42 o 67.02999 3.576584 55.82949       5.821013 48.23791       7.975636 64.48286       8.515133 61.53888 5.372188 71.44874 4.920634 -9.909863      7.285124 
1 1 1 -1  1  43 o 12.43890 5.751691 -2.841613      4.102848 0.3854930      5.158161 -8.399944      6.769561 16.44454 7.087664 14.09608 6.771391 2.348459       9.802383 
1 1 1 -1  1  44 o 42.77728 4.529355 23.60909       4.649920 22.44640       6.411817 24.89897       6.753434 40.39922 6.750902 42.60316 6.728079 -2.203934      9.531093 
1 1 1 -1  1  45 o 18.60711 6.568125 4.562349       3.710028 -0.5990376     5.086426 10.43007       5.423306 15.08470 6.746975 26.28409 7.860504 -11.19939      10.35902 
1 1 1 -1  1  46 o 11.56794 5.447254 -3.055087      3.961739 -2.842373      4.539119 -3.735299      8.116995 12.61684 5.906002 16.39545 7.743810 -3.778605      9.738966 
1 1 1 -1  1  47 o 17.95493 7.095755 4.518517       4.591272 12.11360       8.554242 1.445251       5.441459 24.36664 9.667759 15.94486 7.064124 8.421784       11.97361 
1 1 1 -1  1  48 o 16.09766 6.434940 3.534637       3.817731 6.980485       5.334148 -0.8427379E-01 5.466458 19.91381 7.712618 14.56143 6.699272 5.352380       10.21591 
1 1 1 -1  1  49 o 14.90829 6.222905 2.908385       3.765927 0.9940251      5.227304 4.974192       5.430137 14.44174 6.609579 17.27219 7.354150 -2.830458      9.887874 
1 1 1 -1  1  50 o 20.14579 6.794277 7.905151       3.953055 8.634220       5.464265 7.104613       5.725830 19.39835 7.716996 17.94239 7.591948 1.455957       10.82542 
1 1 1 -1  1  51 o 12.61187 5.763165 1.134776       3.954018 -1.422722      6.227371 2.862278       5.118071 12.87838 6.260252 14.29978 6.542931 -1.421399      9.055425 
1 1 1 -1  2  1  o 524.3796 7.583564 3353.649       96.90703 3404.639       138.4358 3304.654       135.6997 528.0928 10.75727 520.2857 10.70288 7.807129       15.17467 
1 1 1 -1  2  2  o 921.6710 13.14727 10380.52       295.2892 10741.52       427.2504 10050.38       408.5792 936.1647 18.72812 905.6064 18.51402 30.55829       26.33460 
1 1 1 -1  2  3  o 259.3355 4.016410 819.6873       25.38261 797.6619       35.32022 843.2110       36.50180 255.7932 5.666283 262.9944 5.695498 -7.201218      8.034019 
1 1 1 -1  2  4  o 176.0714 2.993250 377.7890       12.84304 363.5095       17.82098 393.2191       18.52508 172.6988 4.234540 179.6175 4.232289 -6.918747      5.986953 
1 1 1 -1  2  5  o 178.9912 3.036837 390.4245       13.24614 380.1087       18.48438 401.3143       18.99166 176.5970 4.295220 181.4561 4.294920 -4.859146      6.074147 
1 1 1 -1  2  6  o 328.0114 4.929740 1311.483       39.40480 1330.478       56.24673 1293.174       55.22102 330.3098 6.987787 325.6474 6.958582 4.662415       9.861594 
1 1 1 -1  2  7  o 549.1068 7.938705 3677.766       106.2289 3671.201       150.0471 3684.363       150.4142 548.3234 11.22936 549.3047 11.23672 -0.9812622     15.88591 
1 1 1 -1  2  8  o 675.7388 9.704833 5573.275       159.8096 5603.058       226.8887 5543.952       225.1315 676.9557 13.75360 673.3815 13.71952 3.574280       19.42645 
1 1 1 -1  2  9  o 791.6493 13.08954 7662.928       252.5186 7801.006       442.4433 7596.222       307.5246 795.5890 22.84455 787.5090 16.02464 8.080017       27.90453 
1 1 1 -1  2  10 o 379.3382 6.518803 1755.109       60.26019 1762.542       73.94393 1740.410       103.9795 380.0434 7.984234 377.1886 11.32518 2.854767       13.85669 
1 1 1 -1  2  11 f 554.3494 8.035702 3751.446       108.5534 3694.940       151.9913 3810.281       155.0911 549.6401 11.34760 558.1427 11.40264 -8.502563      16.08690 
1 1 1 -1  2  12 o 181.6661 3.163549 402.2570       14.00505 394.4966       19.59062 410.3685       20.02891 179.8744 4.469333 183.4569 4.480094 -3.582504      6.328205 
1 1 1 -1  2  13 o 322.9037 4.918599 1271.519       38.70352 1309.277       55.71484 1236.305       53.80518 327.5212 6.980642 318.2666 6.937403 9.254608       9.841591 
1 1 1 -1  2  14 o 276.6159 4.995145 933.0485       33.67142 937.7755       41.38815 923.7958       57.90521 277.2604 6.125648 274.8881 8.655002 2.372345       10.60343 
1 1 1 -1  2  15 o 279.4956 5.069965 952.4568       34.53154 947.8427       59.99729 954.7424       42.22672 278.4881 8.851989 279.7849 6.193369 -1.296753      10.80350 
1 1 1 -1  2  16 o 211.9712 3.564697 547.6143       18.41347 550.7552       26.07770 544.4911       26.00362 212.5504 5.034674 211.3378 5.049175 1.212524       7.130365 
1 1 1 -1  2  17 o 154.0445 2.972354 289.1786       11.15791 289.3820       15.73466 288.9727       15.82506 154.0296 4.195866 153.9195 4.223050 0.1100922      5.953104 
1 1 1 -1  2  18 o 578.2385 8.393044 4078.845       118.2667 4270.959       172.4278 3908.173       162.5204 591.3363 11.96566 565.6843 11.78956 25.65204       16.79794 
1 1 1 -1  2  19 o 107.2087 3.137509 140.1889       8.188112 142.0621       10.04800 136.4863       14.12712 107.8964 3.827590 105.6665 5.505296 2.229866       6.705127 
1 1 1 -1  2  20 o 623.6741 9.027257 4746.906       137.1986 4773.553       194.7271 4720.638       193.3365 624.9238 12.78684 621.4536 12.76642 3.470215       18.06889 
1 1 1 -1  2  21 o 211.3908 4.190219 544.6843       21.58534 539.8931       36.63184 547.2327       26.71618 210.2602 7.159780 211.8634 5.174665 -1.603241      8.834003 
1 1 1 -1  2  22 o 60.83592 3.767956 45.28402       5.558598 47.79860       6.885071 40.57696       9.419987 62.45092 4.555443 57.26226 6.888847 5.188663       8.258830 
1 1 1 -1  2  23 o 305.9711 4.798761 1141.509       35.78044 1132.149       50.34016 1151.066       50.86630 304.6049 6.781747 307.1383 6.796105 -2.533356      9.600997 
1 1 1 -1  2  24 o 367.8206 5.599074 1650.546       50.18667 1652.779       71.01298 1648.318       70.93642 367.8363 7.922223 367.3394 7.924387 0.4969177      11.20525 
1 1 1 -1  2  25 o 254.3727 4.192713 789.1434       25.98973 819.5644       37.58087 761.2569       35.98134 259.1056 5.951876 249.7217 5.912689 9.383911       8.389560 
1 1 1 -1  2  26 o 227.9715 4.506823 634.1340       25.03728 625.7320       30.37555 651.9392       44.21869 226.3775 5.506238 230.6827 7.877573 -4.305206      9.611182 
1 1 1 -1  2  27 o 56.88603 4.117460 39.69492       5.669200 37.77759       10.31033 40.52583       6.787355 54.97306 7.924979 57.40264 4.898907 -2.429577      9.316898 
1 1 1 -1  2  28 o 193.0889 4.130462 455.1489       19.43534 444.9974       33.93252 460.1051       23.70972 190.3941 7.327199 193.9844 5.019825 -3.590317      8.881806 
1 1 1 -1  2  29 o 62.66520 3.251111 48.04338       4.947738 42.95704       6.810297 53.72894       7.200296 59.09631 4.769488 66.16479 4.492317 -7.068478      6.552017 
1 1 1 -1  2  30 o 103.2320 2.996694 130.1353       7.530658 136.1945       10.73365 124.2613       10.56820 105.5014 4.183260 100.7520 4.314375 4.749435       6.009450 
1 1 1 -1  2  31 o 80.21639 3.086268 78.65084       6.021739 77.21324       8.411031 80.16253       8.625051 79.35271 4.366451 80.85529 4.393920 -1.502571      6.194548 
1 1 1 -1  2  32 o 39.12577 6.184951 19.24598       5.701282 18.23380       7.295397 20.83397       9.137878 37.72054 8.173189 40.19785 9.482886 -2.477314      12.51903 
1 1 1 -1  2  33 o 53.92157 3.746484 35.71244       4.892301 37.28675       6.815052 34.03852       7.027347 54.91241 5.153082 52.37277 5.592619 2.539635       7.604712 
1 1 1 -1  2  34 o 63.25832 3.476073 49.06079       5.337896 46.66703       7.338378 51.75043       7.778702 61.49349 4.938545 64.77182 4.966037 -3.278332      7.003624 
1 1 1 -1  2  35 o 142.5798 3.266417 248.4946       11.34921 250.8191       16.02072 246.1530       16.07985 142.9462 4.605114 141.5950 4.666506 1.351242       6.556170 
1 1 1 -1  2  36 o 47.41476 5.056914 27.94069       5.752919 22.99766       6.830836 40.00143       10.66999 42.59851 6.809471 56.14440 8.026862 -13.54589      10.52613 
1 1 1 -1  2  37 f 30.43129 6.191759 11.86238       4.435248 13.68598       6.170039 9.912555       6.380005 32.47076 7.878718 28.01299 8.557823 4.457773       11.63231 
1 1 1 -1  2  38 o 28.02689 7.528585 10.16803       5.250612 8.561714       9.829087 10.80945       6.211068 28.59254 10.60582 28.95428 8.346442 -0.3617363     13.49616 
1 1 1 -1  2  39 o 175.0995 3.568856 376.4385       15.22825 374.1870       21.34190 378.7739       21.73549 173.8474 5.042989 174.8757 5.105862 -1.028397      7.176459 
1 1 1 -1  2  40 o 68.48386 3.543296 57.84700       5.893218 51.81993       8.113141 64.57906       8.574523 64.34599 5.218818 71.97666 4.918124 -7.630669      7.171053 
1 1 1 -1  2  41 o 116.9670 3.240141 168.6094       9.226668 166.8445       12.92354 170.4442       13.17711 115.6942 4.593015 116.9137 4.634255 -1.219543      6.524731 
1 1 1 -1  2  42 o 64.22210 4.011802 51.53196       6.247201 50.87296       9.887161 51.96989       8.059959 62.52633 6.587808 63.95563 5.216795 -1.429295      8.403223 
1 1 1 -1  2  43 o 47.11126 4.333172 28.17400       4.919011 23.52708       6.593631 34.00617       7.386808 41.88131 6.685163 50.86284 6.079927 -8.981537      9.036422 
1 1 1 -1  2  44 o 16.22223 6.407657 2.422214       3.742211 -2.607000      4.984366 8.919577       5.665371 13.92204 6.402165 24.98572 8.123262 -11.06368      10.34288 
1 1 1 -1  2  45 o 16.12171 6.393981 2.570169       3.740349 -3.432600      5.088918 9.623233       5.516181 13.38232 6.260802 25.22357 7.997847 -11.84126      10.15693 
1 1 1 -1  2  46 o 11.52123 5.472752 -3.753637      4.166188 -4.411782      4.831261 -1.844616      8.228205 12.24326 5.837617 17.23948 8.030777 -4.996217      9.928301 
1 1 1 -1  2  47 o 14.29660 6.424118 0.1845721      4.669869 -2.549724      8.335717 1.435264       5.637616 16.29045 7.739059 16.08158 7.153787 0.2088680      10.53896 
1 1 1 -1  2  48 o 11.18436 5.253634 -2.056058      3.645208 -2.452001      5.025104 -1.616318      5.295743 12.83375 6.070972 13.55354 6.355638 -0.7197895     8.789245 
1 1 1 -1  2  49 o 15.71319 6.367821 3.686447       3.794111 1.470484       5.296781 6.021585       5.437345 14.75829 6.715576 18.10155 7.510119 -3.343263      10.07476 
1 1 1 -1  2  50 o 14.47495 6.082634 3.098793       3.634877 4.803903       5.216869 1.490005       5.067376 16.23093 7.061185 13.98745 6.440607 2.243482       9.557288 
1 1 1 -1  2  51 o 15.76693 6.537982 4.909554       4.117678 4.030283       6.489282 5.502200       5.327610 15.17083 7.088521 16.01848 7.047750 -0.8476543     9.995894 
1 1 1 -1  3  1  o 286.9474 3.920674 1003.513       27.41569 1050.871       36.38173 941.2844       41.70429 293.6144 5.084753 277.8554 6.159221 15.75897       7.986909 
1 1 1 -1  3  2  o 123.9114 2.437148 187.0992       7.359177 181.2183       10.25333 193.3475       10.56873 121.8934 3.455310 125.9100 3.447750 -4.016624      4.881203 
1 1 1 -1  3  3  f 231.0223 3.669946 650.4478       20.66092 643.2405       29.04402 657.8314       29.39709 229.7128 5.188424 232.3035 5.192931 -2.590637      7.340727 
1 1 1 -1  3  4  o 492.3829 7.150897 2956.556       85.80242 2935.133       120.7646 2978.394       121.9297 490.3853 10.10569 493.9840 10.12886 -3.598694      14.30800 
1 1 1 -1  3  5  o 850.9332 12.15085 8844.599       251.9638 8637.127       350.4960 9066.484       362.4666 839.8644 17.12528 860.4462 17.28655 -20.58179      24.33311 
1 1 1 -1  3  6  o 47.13292 1.972151 27.11708       2.260164 25.82282       3.171333 28.45301       3.221979 45.94492 2.846467 48.24230 2.752100 -2.297375      3.959347 
1 1 1 -1  3  7  o 320.0192 4.833745 1248.343       37.69606 1283.193       54.22714 1215.754       52.43840 324.3889 6.859849 315.7513 6.815035 8.637604       9.669656 
1 1 1 -1  3  8  o 919.7737 15.17369 10352.99       340.1012 10294.42       586.4251 10382.67       417.4828 912.7821 26.39159 920.0773 18.61994 -7.295166      32.29889 
1 1 1 -1  3  9  o 108.7702 2.385139 144.1714       6.322075 142.6972       8.907778 145.6676       8.974122 108.1531 3.383991 109.2744 3.374102 -1.121323      4.778698 
1 1 1 -1  3  10 o 183.9489 3.669170 412.4295       16.44754 415.3783       20.12298 406.4948       28.54784 184.5898 4.473510 182.4426 6.431180 2.147202       7.834052 
1 1 1 -1  3  11 o 466.7589 6.832369 2658.457       77.71414 2661.726       109.9713 2655.196       109.8376 466.7022 9.669488 466.1294 9.669596 0.5728149      13.67480 
1 1 1 -1  3  12 o 241.6079 3.873142 711.6360       22.80399 737.5550       32.91211 687.7035       31.62576 245.9028 5.492322 237.4484 5.465572 8.454468       7.748425 
1 1 1 -1  3  13 o 480.6905 8.120624 2821.843       95.12421 2799.774       115.9706 2867.220       166.2971 478.5334 9.944880 483.2155 14.13757 -4.682098      17.28501 
1 1 1 -1  3  14 o 284.1780 4.427436 984.5717       30.66048 972.5170       43.00433 997.0341       43.72559 282.3491 6.250140 285.8845 6.276376 -3.535400      8.857604 
1 1 1 -1  3  15 o 135.3376 3.229791 223.2313       10.65195 206.8897       18.32149 231.5755       13.09197 130.1241 5.792376 137.7804 3.903187 -7.656281      6.984732 
1 1 1 -1  3  16 o 204.9141 3.490145 511.7472       17.42816 511.3919       24.62236 512.1039       24.67199 204.8181 4.933160 204.9605 4.939670 -0.1423950     6.981146 
1 1 1 -1  3  17 o 284.1521 4.455602 984.1423       30.85271 981.9681       43.53241 986.3367       43.73293 283.7892 6.294783 284.4193 6.309768 -0.6301270     8.912769 
1 1 1 -1  3  18 o 136.5357 3.291389 227.1841       10.95119 223.3618       13.22384 235.5277       19.53753 135.3167 4.014677 138.8734 5.785844 -3.556732      7.042274 
1 1 1 -1  3  19 o 153.0953 3.026201 285.6283       11.29005 283.2067       15.83375 288.1330       16.10273 152.3729 4.268431 153.6920 4.303679 -1.319153      6.061448 
1 1 1 -1  3  20 o 409.6820 7.047143 2047.042       70.35519 2055.274       121.4954 2042.889       86.29649 409.9265 12.17585 409.1641 8.654849 0.7623596      14.93847 
1 1 1 -1  3  21 o 322.1927 4.983276 1265.547       39.12612 1299.447       56.17979 1233.617       54.52279 326.3882 7.063331 318.0148 7.035495 8.373383       9.969395 
1 1 1 -1  3  22 o 306.1416 5.534348 1142.879       41.28810 1138.813       50.41400 1151.161       71.95293 305.5355 6.771009 306.8483 9.634457 -1.312805      11.77579 
1 1 1 -1  3  23 o 534.0482 9.032034 3484.234       117.5444 3495.621       144.2273 3461.709       202.8486 534.5679 11.07155 530.6872 15.70273 3.880737       19.21341 
1 1 1 -1  3  24 o 338.0375 5.217182 1393.894       42.97708 1401.838       60.97829 1386.054       60.58120 338.8061 7.385637 336.8940 7.379187 1.912079       10.44031 
1 1 1 -1  3  25 o 275.2969 5.126899 924.7839       34.39476 933.8756       42.37267 907.2223       58.89045 276.5457 6.287570 272.1306 8.892318 4.415070       10.89068 
1 1 1 -1  3  26 o 269.4021 4.377795 885.5314       28.74038 903.2053       41.05673 868.5491       40.24548 271.8903 6.196616 266.6233 6.194168 5.266968       8.761607 
1 1 1 -1  3  27 o 107.7822 3.494594 141.8549       9.166543 136.4714       16.16349 144.4072       11.12932 105.4510 6.318955 108.6958 4.209605 -3.244835      7.592758 
1 1 1 -1  3  28 o 14.29756 5.893074 0.7147526      3.318083 4.478389       4.692924 -3.047453      4.692031 20.68567 7.378613 13.83136 6.304163 6.854310       9.704967 
1 1 1 -1  3  29 o 53.80843 3.451194 35.47976       4.501528 33.74360       6.130085 37.51168       6.631710 52.31783 4.863887 55.17007 4.986492 -2.852249      6.965809 
1 1 1 -1  3  30 o 22.25463 6.277939 6.231753       3.551591 6.128453       4.911413 6.344977       5.141929 22.88761 7.570337 23.32674 7.747024 -0.4391289     10.83173 
1 1 1 -1  3  31 o 30.31420 5.297177 11.57715       3.770790 10.15694       5.158718 13.20653       5.525569 28.22341 7.408263 32.14641 7.229413 -3.922997      10.35117 
1 1 1 -1  3  32 o 215.2991 4.381801 567.0266       22.98958 574.2192       38.83055 563.1448       28.52651 215.7544 7.396402 214.2577 5.468033 1.496643       9.198160 
1 1 1 -1  3  33 o 16.33452 6.643504 1.292848       4.147084 2.326524       4.935201 -1.190767      7.649882 18.56172 7.350046 19.65481 8.550696 -1.093086      11.27553 
1 1 1 -1  3  34 o 50.58131 4.280890 31.54807       5.227170 30.14290       6.288192 34.69044       9.403539 49.27073 5.321549 52.43974 7.578111 -3.169014      9.259949 
1 1 1 -1  3  35 o 263.8184 4.424937 853.0949       28.44777 841.0029       39.78218 865.7487       40.69584 261.1729 6.250638 264.9613 6.302769 -3.788483      8.876677 
1 1 1 -1  3  36 o 30.28066 6.995531 11.80801       5.058197 8.790427       5.886178 20.32801       9.890625 26.56309 8.238951 39.39848 10.21688 -12.83539      13.12497 
1 1 1 -1  3  37 o 254.0707 4.342694 792.7093       26.88747 811.7645       38.39066 774.3638       37.66885 256.1035 6.151399 250.1160 6.180232 5.987549       8.719804 
1 1 1 -1  3  38 o 41.29089 6.070961 21.57219       5.926459 19.07478       11.69210 22.43569       6.875096 38.06342 11.57655 41.89235 6.980014 -3.828934      13.51803 
1 1 1 -1  3  39 f 206.0677 3.850972 522.0958       19.33821 515.9203       27.06991 528.5320       27.63558 203.8565 5.454018 206.3010 5.501981 -2.444534      7.747135 
1 1 1 -1  3  40 o 84.02431 3.355048 86.91714       6.855920 80.54363       9.409971 94.12824       10.00922 80.43699 4.822758 87.00835 4.738552 -6.571358      6.761128 
1 1 1 -1  3  41 o 27.15375 6.513800 9.734013       4.254832 7.508615       5.766671 12.39311       6.303596 24.44474 8.205942 30.30651 8.295038 -5.861773      11.66813 
1 1 1 -1  3  42 o 33.05944 6.225971 14.41422       4.831808 14.09793       7.264150 14.66520       6.470860 31.76665 8.984302 32.62925 8.159913 -0.8626041     12.13680 
1 1 1 -1  3  43 o 14.35015 6.149905 0.2930759      3.842005 1.345856       5.254198 -0.9166838     5.632318 17.31447 7.296611 16.14904 7.169020 1.165430       10.22914 
1 1 1 -1  3  44 o 20.68076 6.962082 5.721548       4.150771 4.014506       5.044985 9.298170       7.302547 19.23568 7.486548 25.52735 9.192513 -6.291676      11.85541 
1 1 1 -1  3  45 o 39.91197 4.813308 21.11703       4.587065 21.00492       6.290254 21.24435       6.703641 38.17848 7.019632 37.98476 7.508360 0.1937256      10.27865 
1 1 1 -1  3  46 o 33.18289 5.520614 15.43983       4.307356 24.86353       6.097569 6.053420       6.085493 41.58162 6.207343 20.62237 8.163130 20.95926       10.25513 
1 1 1 -1  3  47 o 12.16743 5.552919 -0.9046487     3.655482 -0.3761905     4.926384 -1.552098      5.452881 14.19313 6.465430 14.10407 6.559186 0.8905697E-01  9.210033 
1 1 1 -1  3  48 o 10.45325 5.006842 -3.319531      3.641186 -7.397044      5.024456 1.190441       5.284188 10.82109 5.334245 15.12333 6.811358 -4.302240      8.651519 
1 1 1 -1  3  49 o 11.37446 5.293375 -1.100610      3.560834 0.8873551      4.975739 -3.187509      5.098047 14.13887 6.462499 12.16823 5.853266 1.970643       8.719211 
1 1 1 -1  3  50 o 17.15316 6.596567 5.588844       3.882155 7.534945       5.565398 3.744487       5.417964 18.25910 7.588693 15.47643 6.939675 2.782674       10.28335 
1 1 1 -1  3  51 o 16.94377 6.543039 5.905144       3.830682 7.832145       5.325947 3.839859       5.513736 17.78098 7.409535 14.90978 6.810318 2.871198       10.06388 
1 1 1 -1  4  1  o 417.8698 5.013381 2128.490       51.05143 2179.515       73.30277 2080.430       71.14098 422.7583 7.115283 413.0392 7.067935 9.719116       10.02911 
1 1 1 -1  4  2  o 393.8871 4.748483 1891.098       45.57878 1825.203       63.05184 1963.219       65.96292 386.8916 6.687633 401.2502 6.746033 -14.35864      9.499126 
1 1 1 -1  4  3  o 549.6758 7.948307 3685.367       106.4676 3669.541       150.1568 3701.368       150.9824 548.2034 11.24002 550.5743 11.25315 -2.370911      15.90508 
1 1 1 -1  4  4  o 216.0969 3.503875 569.1059       18.45157 580.0865       26.39445 558.6106       25.80446 218.1490 4.965046 214.0731 4.946485 4.075912       7.008523 
1 1 1 -1  4  5  o 722.3353 10.35004 6368.956       182.1869 6367.449       257.6955 6370.461       257.6068 721.5959 14.65469 721.7681 14.64615 -0.1722412     20.71882 
1 1 1 -1  4  6  o 213.2512 3.475501 554.2146       18.06114 564.7831       25.81859 544.0866       25.27471 215.2528 4.922067 211.2722 4.909165 3.980560       6.951737 
1 1 1 -1  4  7  o 1222.876 20.15324 18356.19       600.5694 18058.25       1027.917 18510.61       740.0118 1203.463 35.08755 1225.702 24.77523 -22.23877      42.95286 
1 1 1 -1  4  8  o 604.7406 8.719896 4462.835       128.5040 4466.640       181.8780 4459.042       181.5865 604.5328 12.34594 604.0198 12.33662 0.5130005      17.45321 
1 1 1 -1  4  9  o 492.0843 8.290518 2955.148       99.41622 2929.120       120.9159 3009.455       174.6569 489.7195 10.13211 495.5665 14.47816 -5.847046      17.67136 
1 1 1 -1  4  10 o 438.9037 7.459215 2350.796       79.78081 2313.458       96.55450 2431.145       141.6403 435.2398 9.103487 445.4434 13.06254 -10.20355      15.92179 
1 1 1 -1  4  11 o 297.9070 4.577323 1082.108       33.22985 1056.471       46.31153 1109.313       47.70778 294.2553 6.458456 301.5222 6.492826 -7.266876      9.157972 
1 1 1 -1  4  12 o 239.3919 3.846726 698.6429       22.44072 673.0829       31.04705 726.6045       32.47289 234.9105 5.423528 244.0698 5.459724 -9.159332      7.695664 
1 1 1 -1  4  13 o 143.3255 3.178194 250.3812       11.10044 254.3495       13.77951 243.0454       18.73513 144.3909 3.919764 141.0579 5.460651 3.332993       6.721849 
1 1 1 -1  4  14 o 356.3762 5.365693 1548.757       46.59835 1561.971       66.24907 1535.819       65.55643 357.7441 7.599258 354.7378 7.583535 3.006317       10.73586 
1 1 1 -1  4  15 o 694.9352 11.57078 5902.469       195.9490 6393.806       359.0000 5693.977       233.8564 720.6432 20.46341 682.0490 14.07011 38.59430       24.83383 
1 1 1 -1  4  16 o 237.1062 3.866983 685.1971       22.34351 679.2941       31.40948 691.2444       31.79095 236.0493 5.460368 238.1161 5.478714 -2.066803      7.735110 
1 1 1 -1  4  17 o 381.1024 6.608806 1770.976       61.37632 1787.152       75.50610 1739.470       105.3759 382.7678 8.094884 377.2414 11.47602 5.526398       14.04372 
1 1 1 -1  4  18 o 762.3721 10.94572 7096.154       203.3515 7059.017       286.4805 7133.869       288.6971 759.6044 15.47646 763.6134 15.51432 -4.009033      21.91381 
1 1 1 -1  4  19 o 157.2619 3.057156 301.3889       11.71594 292.1716       16.27867 311.2940       16.87511 154.7651 4.320510 159.7525 4.338754 -4.987457      6.123038 
1 1 1 -1  4  20 o 159.3823 3.536539 309.5967       13.73582 307.0436       22.86626 311.0381       17.18111 158.5770 5.927671 159.6805 4.419582 -1.103500      7.393916 
1 1 1 -1  4  21 o 455.7166 6.740294 2533.080       74.85311 2508.731       105.1574 2558.089       106.5734 453.2861 9.519874 457.7200 9.554607 -4.433899      13.48772 
1 1 1 -1  4  22 f 437.0677 6.498777 2330.245       69.21760 2467.725       101.5445 2210.924       94.60082 449.5097 9.270036 425.4940 9.123581 24.01569       13.00666 
1 1 1 -1  4  23 o 321.8299 5.782030 1263.419       45.34640 1293.074       56.23819 1208.305       76.66737 325.4929 7.090123 314.2198 10.02529 11.27304       12.27910 
1 1 1 -1  4  24 o 301.0238 4.747394 1105.191       34.82509 1076.719       48.44476 1135.638       50.09701 296.9760 6.694056 304.9890 6.740490 -8.013031      9.499716 
1 1 1 -1  4  25 o 285.5222 5.265763 994.9075       36.63847 986.2378       44.66827 1012.733       64.05026 284.1615 6.450566 287.4596 9.155080 -3.298065      11.19934 
1 1 1 -1  4  26 o 173.0064 4.734108 365.5772       19.94013 0.000000       0.000000 365.5772       19.94013 ?        ?        173.0064 4.734108 0.000000       4.734108 
1 1 1 -1  4  27 o 193.4039 3.550522 456.3100       16.73376 457.5326       23.72566 455.0999       23.60501 193.4798 5.036351 192.9658 5.024088 0.5139618      7.113810 
1 1 1 -1  4  28 o 71.85339 3.847906 63.19684       6.713067 69.83620       12.60775 60.56971       7.930775 75.17656 6.961116 70.26277 4.658146 4.913788       8.375886 
1 1 1 -1  4  29 o 44.26936 3.874229 24.11026       4.137424 25.18425       5.569086 22.78727       6.181047 45.08948 5.161321 42.71030 6.112825 2.379177       8.000366 
1 1 1 -1  4  30 o 65.01911 3.173979 51.71358       5.013799 52.47348       6.831049 50.82612       7.382139 65.38832 4.311028 64.29951 4.744697 1.088814       6.410703 
1 1 1 -1  4  31 o 205.1666 4.225447 514.5645       21.12591 499.2690       34.89133 523.4173       26.54467 201.3680 7.121561 206.6695 5.274969 -5.301483      8.862389 
1 1 1 -1  4  32 o 63.32501 3.374743 49.11478       5.188967 45.80295       6.939207 53.31564       7.815274 60.99194 4.705105 65.80334 4.909089 -4.811394      6.799791 
1 1 1 -1  4  33 o 75.71265 3.163114 70.13507       5.823199 59.62094       7.757037 83.71099       8.814423 69.62578 4.597558 82.58085 4.395881 -12.95507      6.360920 
1 1 1 -1  4  34 o 100.2819 4.341060 123.3902       10.58338 123.3902       10.58338 0.000000       0.000000 100.2819 4.341060 ?        ?        0.000000       4.341060 
1 1 1 -1  4  35 o 20.24323 6.884860 4.693109       4.059668 7.374116       5.368988 1.113932       6.203475 24.62962 7.899413 19.21672 8.001368 5.412905       11.24378 
1 1 1 -1  4  36 o 19.03980 6.865535 3.781327       4.075005 7.605299       5.465306 -1.006068      6.115146 24.92833 7.967362 17.50252 7.629238 7.425816       11.03105 
1 1 1 -1  4  37 o 173.0931 3.516388 366.9654       14.83244 378.8050       21.08603 355.3692       20.86815 175.3539 4.939424 169.7968 5.048950 5.557053       7.063271 
1 1 1 -1  4  38 o 48.11297 5.498933 28.98771       6.331625 46.30188       12.82720 23.41013       7.280376 59.82539 9.083669 42.72610 7.251339 17.09929       11.62304 
1 1 1 -1  4  39 o 129.8673 3.281725 207.0136       10.37743 203.4168       14.45687 210.8370       14.90521 128.2679 4.632700 130.5649 4.692264 -2.296997      6.593880 
1 1 1 -1  4  40 o 44.34190 4.520369 24.58949       4.816309 25.68502       6.710574 23.42562       6.916680 44.80159 6.322055 42.55662 6.906038 2.244976       9.362784 
1 1 1 -1  4  41 o 25.58831 7.122410 8.673361       4.603829 3.382661       6.746439 13.28444       6.298240 21.16841 8.522382 31.34021 8.165878 -10.17180      11.80307 
1 1 1 -1  4  42 o 43.47719 4.491456 23.91471       4.690233 21.23909       6.401301 27.01609       6.891808 40.01163 6.808821 45.42679 6.403059 -5.415165      9.346615 
1 1 1 -1  4  43 o 23.38638 6.704351 7.442529       4.018042 3.340690       5.311091 12.93226       6.144268 19.12599 7.608255 30.17305 8.161056 -11.04706      11.15744 
1 1 1 -1  4  44 o 31.10607 6.191628 13.27367       4.528301 12.69672       5.481105 14.51419       8.037065 29.66652 7.560678 30.53094 9.650554 -0.8644257     12.25957 
1 1 1 -1  4  45 o 20.38900 7.249524 5.752327       4.526705 5.460782       5.153030 6.737714       9.473558 20.30213 7.648952 23.23235 9.794501 -2.930220      12.42734 
1 1 1 -1  4  46 o 32.89276 5.365353 15.11190       4.152544 14.59385       5.735282 15.68270       6.020243 30.23944 7.748520 31.23274 7.904359 -0.9933014     11.06881 
1 1 1 -1  4  47 o 17.96835 6.468678 4.828516       3.615774 4.025301       4.874682 5.810964       5.391195 17.49819 7.170043 19.34053 7.674536 -1.842337      10.50276 
1 1 1 -1  4  48 o 11.60547 5.514058 -2.797274      4.234231 -4.870120      8.496678 -2.112421      4.883873 14.96741 7.284075 12.78963 6.030379 2.177782       9.456385 
1 1 1 -1  4  49 o 12.23337 5.580259 -0.4768556E-01 3.685709 3.327440       5.111230 -3.703856      5.319780 15.80950 6.931119 12.15964 5.881260 3.649863       9.090085 
1 1 1 -1  4  50 o 15.32535 6.459544 3.940835       4.119029 3.474252       6.481065 4.257007       5.335107 15.50689 7.190739 15.74235 6.983501 -0.2354593     10.02377 
1 1 1 -1  4  51 o 12.39406 5.609762 1.243892       3.636218 0.6466004      5.029245 1.898129       5.263530 12.95637 6.112195 13.71709 6.400946 -0.7607241     8.850482 
1 1 1 -1  5  1  o 534.8168 6.935333 3487.924       90.38751 3421.755       141.1777 3533.887       117.6652 529.4012 10.94322 538.1827 8.971851 -8.781555      14.15091 
1 1 1 -1  5  2  o 362.8176 4.836923 1604.550       42.76550 1583.822       54.75608 1636.970       68.47871 360.4196 6.234303 366.3555 7.670378 -5.935913      9.884393 
1 1 1 -1  5  3  o 867.3631 11.08702 9185.547       234.3430 9863.235       390.0797 8802.842       293.1368 897.3203 17.83897 848.5466 14.17616 48.77368       22.78579 
1 1 1 -1  5  4  f 280.1668 4.324833 956.7010       29.52719 978.4792       42.35293 936.1055       41.18698 283.2925 6.134967 277.0916 6.099589 6.200989       8.651174 
1 1 1 -1  5  5  o 554.7045 8.025517 3753.212       108.4853 3811.614       155.0840 3697.250       151.8111 558.6948 11.39085 550.2567 11.32145 8.438049       16.06010 
1 1 1 -1  5  6  o 653.8141 9.404742 5216.859       149.8433 5490.044       219.3943 4978.012       205.1436 670.1577 13.43422 638.1790 13.19105 31.97876       18.82769 
1 1 1 -1  5  7  o 524.1569 8.778937 3352.639       112.1345 3499.642       199.5560 3284.802       135.5605 534.4784 15.33727 518.6335 10.72597 15.84491       18.71572 
1 1 1 -1  5  8  o 331.7342 5.006588 1341.614       40.47326 1342.340       57.29077 1340.891       57.18505 331.7315 7.086990 331.5529 7.077723 0.1786194      10.01597 
1 1 1 -1  5  9  o 497.6638 8.391455 3023.202       101.7676 3173.485       128.5105 2770.466       166.6546 509.6424 10.34753 475.3543 14.40340 34.28806       17.73498 
1 1 1 -1  5  10 o 64.11017 2.636980 50.17504       4.110946 49.59364       4.849197 51.66043       7.750900 63.71175 3.132911 64.90242 4.937725 -1.190670      5.847756 
1 1 1 -1  5  11 f 225.4171 3.671944 619.4169       20.17061 605.4708       28.19619 634.0342       28.86673 222.8129 5.192947 228.0080 5.195310 -5.195023      7.345607 
1 1 1 -1  5  12 o 362.7489 6.269019 1605.513       55.41684 1603.411       67.97638 1609.679       95.69016 362.3853 7.697530 362.5649 10.84260 -0.1796570     13.29714 
1 1 1 -1  5  13 o 200.7309 3.404113 491.1263       16.65154 517.1240       24.16357 467.6155       22.97873 205.9376 4.814923 195.8316 4.815121 10.10600       6.809469 
1 1 1 -1  5  14 o 84.03224 2.377518 86.12108       4.863727 84.17162       6.801804 88.16083       6.957536 83.03452 3.368463 84.98267 3.366271 -1.948143      4.762176 
1 1 1 -1  5  15 o 437.9830 7.485812 2340.111       79.89734 2182.114       132.8524 2429.635       100.0031 422.2472 12.92642 446.1472 9.198119 -23.90005      15.86499 
1 1 1 -1  5  16 o 176.3546 3.698220 379.0412       15.89336 374.3201       19.17820 389.3926       28.39807 175.1850 4.496078 178.5806 6.536599 -3.395630      7.933589 
1 1 1 -1  5  17 o 281.4579 4.422532 965.5510       30.33337 940.7626       42.23680 991.9545       43.59097 277.7766 6.239637 285.2332 6.271341 -7.456604      8.846625 
1 1 1 -1  5  18 o 204.9349 3.526249 511.8366       17.61023 520.7990       25.11401 503.1669       24.70040 206.6992 4.985873 203.1701 4.988939 3.529175       7.053257 
1 1 1 -1  5  19 o 290.9431 5.241684 1031.920       37.16337 1031.518       63.51474 1032.129       45.82690 290.6038 8.979633 290.9336 6.463839 -0.3298340     11.06413 
1 1 1 -1  5  20 o 348.4449 5.311091 1480.231       45.09766 1460.339       63.20775 1500.857       64.36341 345.9949 7.496603 350.7603 7.529958 -4.765320      10.62541 
1 1 1 -1  5  21 o 316.4252 4.909934 1220.670       37.86019 1191.621       52.70168 1251.649       54.42467 312.5488 6.919433 320.3217 6.972257 -7.772858      9.822979 
1 1 1 -1  5  22 o 591.8685 8.605704 4277.320       124.1217 4304.083       176.2021 4250.958       174.8746 593.0889 12.19144 589.4207 12.17490 3.668213       17.22961 
1 1 1 -1  5  23 o 277.0746 5.145874 936.2870       34.74497 945.6830       42.65651 917.7637       59.89246 278.3968 6.287602 273.9099 8.984964 4.486877       10.96647 
1 1 1 -1  5  24 o 75.00537 3.460763 68.73150       6.308531 71.19634       7.800847 64.07265       10.72471 76.29334 4.212188 72.19151 6.154903 4.101830       7.458241 
1 1 1 -1  5  25 o 33.44677 6.001398 14.07515       4.711779 2.839613       9.067229 18.23151       5.514853 24.21686 9.833014 38.16103 6.138469 -13.94417      11.59176 
1 1 1 -1  5  26 f 222.4558 3.837737 603.6641       20.80439 575.9066       28.66429 634.5630       30.24286 217.1568 5.416659 227.9448 5.444488 -10.78798      7.680016 
1 1 1 -1  5  27 o 49.01865 3.951082 29.51237       4.679735 20.75196       6.919423 36.89742       6.353076 40.55721 7.268057 54.75667 4.809967 -14.19947      8.715528 
1 1 1 -1  5  28 o 136.1768 3.675476 226.4861       12.18585 211.0539       21.58888 233.7018       14.76236 131.0721 6.782085 138.2619 4.386996 -7.189774      8.077278 
1 1 1 -1  5  29 o 116.9704 3.000241 167.0298       8.544949 162.2263       11.77289 172.3775       12.42199 115.1677 4.201892 118.7104 4.301153 -3.542679      6.012970 
1 1 1 -1  5  30 o 150.7887 3.199740 277.4969       11.75762 279.8063       16.56122 275.1499       16.69517 151.2273 4.498929 149.9521 4.574148 1.275146       6.415855 
1 1 1 -1  5  31 o 180.4182 3.931426 397.7619       17.28489 407.7314       29.01818 392.2795       21.51899 182.0838 6.550448 178.9539 4.939240 3.129898       8.203930 
1 1 1 -1  5  32 o 157.0769 3.298321 301.3319       12.62529 297.0296       17.61433 305.8775       18.10551 155.7044 4.647459 157.9972 4.707712 -2.292770      6.615242 
1 1 1 -1  5  33 o 57.43958 3.552496 40.47701       4.948237 33.13846       6.587703 49.97773       7.495610 51.70801 5.303114 63.67816 4.867256 -11.97015      7.198139 
1 1 1 -1  5  34 o 61.90014 3.980451 47.08294       5.972443 44.04145       7.014121 55.10272       11.38968 59.73179 4.860697 66.41150 7.150249 -6.679707      8.645949 
1 1 1 -1  5  35 o 54.48852 4.340711 36.61707       5.716096 34.32283       6.800136 42.14190       10.55256 52.56744 5.384413 57.79739 7.682342 -5.229950      9.381380 
1 1 1 -1  5  36 o 17.34974 6.753212 2.343104       4.105361 -1.838010      5.425531 7.943663       6.279311 15.84034 7.033849 25.77897 8.561056 -9.938622      11.08001 
1 1 1 -1  5  37 o 69.47146 3.523010 59.26849       5.944787 57.53513       8.145473 61.24401       8.695890 68.18825 4.935370 70.32481 5.109065 -2.136559      7.103550 
1 1 1 -1  5  38 o 43.06505 4.675770 23.11250       4.828319 19.68871       6.456241 27.45741       7.273050 39.14712 7.025909 46.51681 6.601258 -7.369694      9.640539 
1 1 1 -1  5  39 o 41.39465 5.898666 21.74270       5.782084 36.86481       12.28537 17.43989       6.553266 52.62799 9.943631 36.53168 7.608708 16.09631       12.52071 
1 1 1 -1  5  40 o 85.30024 3.312080 89.59906       6.871652 92.50050       9.523603 86.44802       9.924772 86.27499 4.545855 83.25970 4.913429 3.015289       6.693772 
1 1 1 -1  5  41 o 42.85596 5.138474 23.33253       5.259506 26.54001       7.808856 20.66933       7.115528 44.83671 7.405180 39.33852 7.698310 5.498192       10.68179 
1 1 1 -1  5  42 o 41.27197 4.565101 21.62154       4.514705 18.73650       5.979154 25.44803       6.885958 37.49459 6.793965 43.90811 6.642908 -6.413521      9.501904 
1 1 1 -1  5  43 o 14.62998 6.149912 0.8316864      3.717748 3.197121       4.830129 -2.606732      5.823481 18.46103 7.283525 15.33783 7.003228 3.123191       10.10420 
1 1 1 -1  5  44 f 15.31619 6.429572 1.221832       4.054906 0.8930843      4.845339 1.990180       7.407495 16.09281 6.901755 19.64204 8.479862 -3.549231      10.93354 
1 1 1 -1  5  45 o 18.24685 6.559696 4.375436       3.716731 5.432693       5.054995 3.131277       5.483633 20.16446 7.580416 18.24076 7.552615 1.923700       10.70069 
1 1 1 -1  5  46 o 24.06478 6.424077 8.699730       3.837723 3.253990       5.040093 16.21353       5.920249 17.43918 7.232524 31.88297 7.706049 -14.44379      10.56847 
1 1 1 -1  5  47 o 15.13395 6.159761 2.572672       3.568262 1.565973       4.823269 3.789770       5.303401 15.35222 6.731773 17.45419 7.341661 -2.101970      9.960761 
1 1 1 -1  5  48 f 11.54750 5.524179 -3.322769      4.403004 -5.501812      8.899637 -2.616552      5.066508 14.99272 7.330863 12.71529 6.038574 2.277427       9.497681 
1 1 1 -1  5  49 o 11.47880 5.325478 -0.8585449     3.561446 6.711047       5.439296 -6.539039      4.711937 18.47375 7.572310 10.38386 5.127535 8.089887       9.145026 
1 1 1 -1  5  50 o 13.54596 5.854080 2.297485       3.537466 -0.5603480E-01 4.980331 4.693832       5.025440 12.96316 6.105257 15.96615 6.938367 -3.002988      9.242028 
1 1 1 -1  5  51 o 9.897708 4.792069 -2.690584      3.554404 -1.515736      4.911863 -3.982091      5.149958 11.83982 5.707940 11.11068 5.462008 0.7291346      7.900260 
1 1 1 -1  6  1  o 341.4595 5.930977 1421.481       49.35163 1309.507       81.18900 1487.101       62.15232 327.3887 10.18888 349.1987 7.303795 -21.81003      12.53629 
1 1 1 -1  6  2  o 801.8538 9.363319 7845.772       182.9621 8245.854       267.5590 7494.374       250.7528 821.4175 13.36656 783.1334 13.13935 38.28412       18.74320 
1 1 1 -1  6  3  o 589.7164 6.950487 4240.774       99.88368 4275.510       141.9241 4206.684       140.5989 591.8855 9.839712 587.1035 9.827233 4.782043       13.90663 
1 1 1 -1  6  4  o 319.1349 4.328166 1241.357       33.66002 1204.007       52.26945 1267.820       43.99715 314.2208 6.826168 322.4831 5.598627 -8.262329      8.828431 
1 1 1 -1  6  5  o 617.4176 8.902731 4651.555       133.9487 4580.829       187.6732 4724.995       191.2412 612.2610 12.57852 621.8147 12.62073 -9.553711      17.81858 
1 1 1 -1  6  6  o 275.2042 4.922546 923.2607       33.01269 899.1607       55.95285 936.1302       40.88782 271.3292 8.472706 277.0815 6.055505 -5.752258      10.41422 
1 1 1 -1  6  7  o 335.6250 5.065308 1373.281       41.42822 1331.650       57.44340 1418.405       59.80462 330.4072 7.134353 340.9967 7.196949 -10.58957      10.13386 
1 1 1 -1  6  8  o 636.9289 10.61530 4956.959       164.7629 5031.927       203.7363 4815.254       280.1080 641.2673 13.03747 625.7317 18.38962 15.53558       22.54226 
1 1 1 -1  6  9  o 378.2502 6.528780 1745.466       60.17932 1776.604       74.39165 1686.504       102.3678 381.4886 8.002149 371.1661 11.33098 10.32242       13.87175 
1 1 1 -1  6  10 o 148.7691 2.804782 269.7406       10.16829 272.3708       14.49317 267.1909       14.26970 149.4195 3.983894 147.9919 3.960329 1.427567       5.617439 
1 1 1 -1  6  11 o 154.1729 3.273304 289.7258       12.29789 292.2708       15.32445 285.1218       20.61156 154.7794 4.066419 152.7887 5.545036 1.990662       6.876277 
1 1 1 -1  6  12 o 372.8082 5.576194 1695.232       50.65932 1661.590       70.72108 1730.687       72.60214 368.9004 7.866902 376.4880 7.913384 -7.587616      11.15840 
1 1 1 -1  6  13 o 284.3383 4.425274 985.6503       30.66279 997.6955       43.71397 973.9836       43.02177 285.9887 6.272421 282.5710 6.247764 3.417694       8.853125 
1 1 1 -1  6  14 o 628.7676 9.080562 4826.441       139.1358 4721.779       193.8066 4937.754       199.8690 621.3199 12.80021 635.3499 12.90911 -14.02997      18.17940 
1 1 1 -1  6  15 o 650.2906 10.85093 5164.317       171.9532 5333.308       305.0342 5085.602       208.1840 659.0218 19.01371 644.9551 13.24591 14.06665       23.17273 
1 1 1 -1  6  16 o 154.0552 2.963956 289.2173       11.12715 283.5688       15.58330 295.0929       15.89363 152.4741 4.197984 155.5438 4.196927 -3.069717      5.936099 
1 1 1 -1  6  17 o 370.4573 5.577100 1673.050       50.34805 1664.311       70.94587 1681.916       71.46274 369.3926 7.881391 371.3403 7.897169 -1.947754      11.15713 
1 1 1 -1  6  18 o 358.4464 5.425204 1566.319       47.38888 1569.661       67.10743 1562.994       66.92891 358.7354 7.676447 357.9728 7.672335 0.7625732      10.85323 
1 1 1 -1  6  19 o 295.9025 5.311556 1067.432       38.30067 1020.126       63.58499 1094.371       47.98206 288.9810 9.040318 299.5695 6.572720 -10.58850      11.17712 
1 1 1 -1  6  20 f 116.2119 2.777425 164.5810       7.865551 151.3308       10.78863 179.6146       11.49178 111.3548 3.982179 121.3316 3.891700 -9.976707      5.568041 
1 1 1 -1  6  21 o 210.7657 3.648314 541.4408       18.73821 541.4337       26.44674 541.4479       26.55325 210.7293 5.150046 210.7315 5.170733 -0.2197266E-02 7.297908 
1 1 1 -1  6  22 o 381.3767 5.764712 1773.991       53.57571 1808.822       76.71260 1740.825       74.85648 384.9067 8.178528 377.6067 8.134926 7.299988       11.53539 
1 1 1 -1  6  23 o 317.3627 5.747704 1228.767       44.45150 1301.359       55.96942 1104.756       73.15399 326.4995 7.034483 300.3705 10.00810 26.12897       12.23299 
1 1 1 -1  6  24 o 141.2664 4.411989 243.6311       15.16968 227.6440       21.96945 258.1991       20.97166 136.3749 6.630592 145.3211 5.934482 -8.946182      8.898473 
1 1 1 -1  6  25 o 335.7632 5.194804 1376.061       42.50484 1408.367       60.95268 1345.480       59.30310 339.3793 7.370065 331.7211 7.336151 7.658234       10.39889 
1 1 1 -1  6  26 o 135.3143 3.026473 223.2681       9.979684 230.1162       14.14515 216.4812       14.08187 137.2586 4.234008 133.1171 4.346837 4.141510       6.068098 
1 1 1 -1  6  27 o 400.6777 6.066338 1963.722       59.23220 1975.326       84.05508 1952.277       83.48183 401.0770 8.600034 398.7332 8.591589 2.343750       12.15631 
1 1 1 -1  6  28 o 183.9802 4.945065 414.0010       22.15058 0.000000       0.000000 414.0010       22.15058 ?        ?        183.9802 4.945065 0.000000       4.945065 
1 1 1 -1  6  29 o 217.6755 3.817723 578.5508       20.25117 596.9285       29.01739 561.1004       28.27595 220.8744 5.391095 214.0700 5.424695 6.804398       7.647955 
1 1 1 -1  6  30 o 206.5506 4.228585 521.3708       21.28422 558.0027       36.74837 502.8791       26.10939 212.9986 7.089750 202.6168 5.292456 10.38181       8.847296 
1 1 1 -1  6  31 o 109.1433 3.038737 145.5141       8.074269 142.0249       11.16522 149.3393       11.69036 107.6925 4.262892 110.4233 4.352938 -2.730812      6.092644 
1 1 1 -1  6  32 o 126.4286 3.090218 195.1691       9.520736 186.8744       13.03263 204.6618       13.94203 123.5119 4.336723 129.2481 4.433118 -5.736198      6.201589 
1 1 1 -1  6  33 o 70.44800 3.277044 60.76281       5.610420 55.89130       7.440424 67.18324       8.541768 67.40199 4.556686 73.89442 4.768978 -6.492432      6.595949 
1 1 1 -1  6  34 o 100.4269 3.155103 123.3553       7.711886 113.6772       10.14966 136.5743       11.86194 96.23695 4.339024 105.4520 4.627254 -9.215073      6.343391 
1 1 1 -1  6  35 o 23.28566 6.839483 6.823477       4.135865 10.87788       5.437160 1.256309       6.371269 29.07711 7.592568 19.54666 8.121321 9.530458       11.11769 
1 1 1 -1  6  36 o 47.97883 4.804483 28.56684       5.541873 27.12058       6.521656 32.32481       10.51265 46.52185 5.884000 50.06750 8.944560 -3.545654      10.70638 
1 1 1 -1  6  37 o 52.41171 4.043841 33.90664       5.124947 32.85091       6.868999 35.23223       7.697009 51.28358 5.586616 53.01823 6.066555 -1.734646      8.247022 
1 1 1 -1  6  38 o 48.77974 4.264629 29.49266       5.018474 28.61119       6.736858 30.59164       7.522315 47.66410 5.927746 49.17382 6.431413 -1.509716      8.746499 
1 1 1 -1  6  39 o 23.41393 7.913459 6.583198       5.362670 10.51055       11.30463 5.442773       6.091721 30.66262 11.37399 22.72674 8.363808 7.935877       14.11811 
1 1 1 -1  6  40 o 79.67027 3.717628 78.43369       7.197790 80.24612       11.23856 77.17326       9.372172 79.79182 5.819864 78.61732 4.916607 1.174507       7.618651 
1 1 1 -1  6  41 o 19.32763 6.810731 4.338450       3.987855 1.656383       5.233170 8.052860       6.158500 17.88286 7.388785 25.13918 8.480362 -7.256321      11.24770 
1 1 1 -1  6  42 o 14.98200 6.244483 0.9557135      3.783913 -2.417239      4.818088 6.384456       6.112504 14.03758 6.394341 23.02926 8.393675 -8.991673      10.55184 
1 1 1 -1  6  43 o 31.90947 5.567329 13.49883       4.171778 15.19361       5.542137 11.28306       6.337008 33.15083 7.075866 28.02820 8.522287 5.122629       11.07688 
1 1 1 -1  6  44 o 15.44646 6.546994 1.077613       4.270227 2.080437       4.816239 -2.608169      9.233378 17.03221 7.067470 18.84285 8.682667 -1.810642      11.19544 
1 1 1 -1  6  45 o 22.61405 6.647203 7.462173       3.905344 5.487577       5.061158 10.36811       6.139792 20.15069 7.582934 25.58598 8.464312 -5.435287      11.36422 
1 1 1 -1  6  46 o 18.53378 6.587135 4.954867       3.736929 9.582514       5.159847 -0.1499185     5.419328 24.20833 7.741961 15.19349 6.865368 9.014848       10.34752 
1 1 1 -1  6  47 o 25.22745 6.387153 9.978489       3.929793 13.39186       5.586951 6.635991       5.528643 27.61770 7.901904 19.98502 7.820161 7.632681       11.11733 
1 1 1 -1  6  48 o 12.63913 5.885260 -1.215048      4.411523 -10.49854      9.075913 1.656818       5.047970 13.82901 6.878410 15.08775 6.736756 -1.258742      9.627897 
1 1 1 -1  6  49 o 11.99333 5.549453 -0.5257036     3.829029 -5.078260      6.190223 2.295703       4.873169 12.40948 6.077480 14.80660 6.614614 -2.397121      8.982698 
1 1 1 -1  6  50 o 16.43585 6.499853 5.112970       3.854908 8.500203       5.652546 2.167826       5.270780 18.74745 7.705716 14.28670 6.574838 4.460758       10.12949 
1 1 1 -1  6  51 o 12.28018 5.560318 1.233984       3.576438 4.257706       5.231466 -1.419185      4.900440 14.98118 6.759614 11.83951 5.706163 3.141666       8.846055 
1 1 1 -1  7  1  o 978.5386 12.49617 11699.40       297.9828 10873.75       447.2466 12358.47       399.5911 941.5162 19.49320 1004.745 16.32015 -63.22827      25.42306 
1 1 1 -1  7  2  o 1243.241 15.84886 18918.10       480.1638 19909.08       642.3503 17663.11       722.8667 1273.364 20.70061 1197.410 24.77303 75.95398       32.28341 
1 1 1 -1  7  3  o 959.3463 12.23768 11245.05       286.0953 11145.89       367.0992 11398.44       456.5834 954.2300 15.78680 963.8365 19.43930 -9.606506      25.04216 
1 1 1 -1  7  4  o 372.1276 5.547695 1688.297       50.30841 1753.185       102.8899 1667.910       57.67265 378.7044 11.16118 369.8376 6.399157 8.866852       12.86550 
1 1 1 -1  7  5  o 927.4780 15.34249 10532.28       346.7653 9558.933       560.4308 11136.10       441.4077 879.1440 26.18848 952.4567 19.01772 -73.31274      32.36526 
1 1 1 -1  7  6  f 437.0259 6.429563 2329.307       68.47384 2355.953       97.59484 2303.474       96.09582 439.3110 9.116302 434.3939 9.077885 4.917053       12.86526 
1 1 1 -1  7  7  o 456.1720 7.742331 2539.367       86.06696 2515.289       104.6122 2589.805       151.4088 453.8339 9.459087 459.7654 13.52855 -5.931580      16.50746 
1 1 1 -1  7  8  o 291.3386 5.219968 1035.023       37.05971 1020.253       44.85883 1066.774       65.77122 289.1960 6.365311 295.3881 9.148093 -6.192139      11.14472 
1 1 1 -1  7  9  o 581.2744 8.418558 4126.588       119.2491 4216.667       171.0871 4041.478       166.3020 586.8813 11.96274 574.5799 11.87711 12.30145       16.85744 
1 1 1 -1  7  10 o 220.5950 4.156969 593.2858       22.34645 587.1896       27.44545 605.2762       38.49080 219.4234 5.132765 222.5689 7.105803 -3.145538      8.765712 
1 1 1 -1  7  11 o 279.2658 4.364619 950.8756       29.70299 909.7890       40.82343 997.0953       43.29849 273.0793 6.134578 285.8771 6.215231 -12.79782      8.732821 
1 1 1 -1  7  12 o 408.3291 6.055448 2033.800       60.25494 2083.904       86.61285 1986.809       83.87959 413.0950 8.603918 403.3640 8.533419 9.731049       12.11803 
1 1 1 -1  7  13 o 346.2233 6.065920 1461.912       51.17868 1458.970       62.42398 1467.945       89.38419 345.7960 7.407904 346.4468 10.59984 -0.6508179     12.93188 
1 1 1 -1  7  14 o 591.2563 8.560756 4265.979       123.3457 4397.717       178.1193 4144.599       170.9743 599.8483 12.18522 582.3500 12.04788 17.49835       17.13567 
1 1 1 -1  7  15 o 657.7997 10.97134 5283.536       175.8691 5599.236       317.8104 5144.188       211.1449 675.3761 19.33007 648.7327 13.35607 26.64343       23.49545 
1 1 1 -1  7  16 o 404.6445 6.032711 1996.251       59.48701 1892.962       81.41100 2114.575       87.13509 393.9211 8.480819 416.3352 8.588430 -22.41415      12.07002 
1 1 1 -1  7  17 o 264.3345 4.216098 851.6180       27.15818 824.7085       37.69801 880.6529       39.15855 260.0859 5.947926 268.7618 5.978923 -8.675934      8.433584 
1 1 1 -1  7  18 o 353.3383 6.158716 1522.260       53.02944 1487.605       89.57681 1540.959       65.79839 348.9010 10.54766 355.4376 7.596539 -6.536652      12.99848 
1 1 1 -1  7  19 o 574.7014 8.354060 4029.973       116.9973 4188.904       169.8333 3886.423       161.4065 585.5000 11.90310 563.9858 11.74402 21.51422       16.72142 
1 1 1 -1  7  20 o 454.8508 6.730332 2523.435       74.60046 2588.632       107.4121 2462.679       103.6884 460.4464 9.572776 449.1146 9.474078 11.33188       13.46834 
1 1 1 -1  7  21 o 261.0914 4.233167 830.9964       26.93358 828.6415       38.08022 833.3536       38.09945 260.6584 5.995032 261.3991 5.981064 -0.7406921     8.468384 
1 1 1 -1  7  22 o 384.7070 5.808337 1805.287       54.45253 1849.340       78.20811 1763.839       75.86053 389.1542 8.246963 380.0576 8.190877 9.096619       11.62337 
1 1 1 -1  7  23 o 164.6837 4.543698 330.9898       18.21717 330.9898       18.21717 0.000000       0.000000 164.6837 4.543698 ?        ?        0.000000       4.543698 
1 1 1 -1  7  24 o 587.7764 8.575102 4226.556       122.8252 4318.338       176.2016 4139.806       171.3041 592.9020 12.19525 580.5500 12.10855 12.35205       17.18549 
1 1 1 -1  7  25 o 287.5015 4.585664 1008.626       32.12761 1006.539       45.35094 1010.729       45.52011 286.9914 6.484572 287.5866 6.495291 -0.5952148     9.178152 
1 1 1 -1  7  26 o 370.6205 5.659253 1678.481       51.11222 1692.049       72.63950 1665.177       71.93288 371.5762 8.022115 368.6176 8.007837 2.958557       11.33489 
1 1 1 -1  7  27 o 94.74377 2.929785 109.5815       6.756166 110.5643       9.259928 108.4627       9.879459 95.08971 4.005083 94.15274 4.317393 0.9369736      5.889021 
1 1 1 -1  7  28 o 57.34578 4.252404 40.38338       5.900254 36.54072       11.51945 41.75003       6.869814 53.75035 9.120216 58.24240 4.885245 -4.492050      10.34621 
1 1 1 -1  7  29 o 158.7520 3.668697 307.6944       14.19277 324.0409       23.76088 298.6270       17.69660 162.5301 6.009536 156.2312 4.653400 6.298935       7.600569 
1 1 1 -1  7  30 o 219.5756 4.392306 589.4116       23.50242 596.5290       39.53677 585.5222       29.22691 220.1116 7.381368 218.5779 5.491420 1.533768       9.200015 
1 1 1 -1  7  31 o 43.52769 3.969944 23.34795       4.164710 24.81135       5.486968 21.35905       6.396724 44.72116 5.127430 41.19093 6.595063 3.530228       8.353765 
1 1 1 -1  7  32 o 90.42167 3.064496 99.94673       6.742790 105.1006       9.421439 94.53497       9.654315 92.59816 4.186039 87.76443 4.529377 4.833733       6.167511 
1 1 1 -1  7  33 o 150.3333 3.275428 276.1291       11.99939 270.5479       16.64588 282.1668       17.31320 148.5370 4.604270 151.6780 4.689655 -3.141022      6.572075 
1 1 1 -1  7  34 o 72.51402 3.723197 64.49476       6.557189 64.36762       7.935165 64.76849       11.64350 72.32883 4.524696 72.14149 6.699671 0.1873398      8.084458 
1 1 1 -1  7  35 o 194.5577 4.260157 464.0022       20.19809 453.9321       24.27296 486.6727       36.41977 192.0877 5.190214 197.8409 7.568097 -5.753174      9.176841 
1 1 1 -1  7  36 o 54.91936 3.939191 37.15859       5.236901 31.22075       6.866497 45.41498       8.096848 49.98410 5.741375 60.44260 5.559372 -10.45850      7.991871 
1 1 1 -1  7  37 o 93.67401 3.672838 107.7322       8.367863 107.0930       10.05769 109.1696       15.08277 93.23288 4.439589 93.49676 6.663533 -0.2638779     8.007035 
1 1 1 -1  7  38 o 54.27148 3.993247 36.39910       5.244236 39.01387       6.957407 32.95893       7.980317 55.94224 5.161712 51.00651 6.572986 4.935730       8.357476 
1 1 1 -1  7  39 o 18.20019 7.475384 1.631791       5.314725 10.36514       10.30826 -1.530265      6.202690 29.94253 10.90221 17.10739 7.562403 12.83514       13.26832 
1 1 1 -1  7  40 o 59.81822 4.138856 44.48406       5.996031 32.99596       8.797120 54.45161       8.194276 50.34216 7.390810 65.86910 5.145773 -15.52694      9.005724 
1 1 1 -1  7  41 o 53.65554 3.923972 35.91608       5.095224 30.82748       6.748681 42.66195       7.770310 49.02312 5.758829 57.84495 5.581588 -8.821835      8.019865 
1 1 1 -1  7  42 o 10.84602 5.158479 -4.346364      3.724653 -2.890045      4.841054 -6.459097      5.830880 13.75782 6.320344 13.54275 6.444814 0.2150698      9.026759 
1 1 1 -1  7  43 o 28.55358 6.138015 11.07886       4.143816 11.26102       5.383339 10.81400       6.491473 28.16086 7.648414 27.36415 8.676063 0.7967167      11.56600 
1 1 1 -1  7  44 o 19.60603 7.145808 4.925124       4.430102 4.265981       5.131704 6.853434       8.777283 19.34935 7.544971 23.60841 9.641302 -4.259062      12.24260 
1 1 1 -1  7  45 o 16.52029 6.581855 2.876384       3.980741 3.144065       4.662424 2.156453       7.646246 17.41144 7.057908 19.10165 8.422230 -1.690205      10.98854 
1 1 1 -1  7  46 o 18.72001 6.640196 5.145989       3.795704 11.03156       5.213256 -1.493877      5.537255 25.86561 7.699940 14.46741 6.686924 11.39820       10.19824 
1 1 1 -1  7  47 o 12.17476 5.544032 -0.6775803     3.618247 0.9343475      4.998542 -2.451871      5.244244 14.95433 6.688567 13.25256 6.248732 1.701771       9.153337 
1 1 1 -1  7  48 o 21.95488 6.607644 8.183963       3.823205 7.465333       5.339343 8.940108       5.476941 19.94112 7.718228 21.38815 7.919990 -1.447035      11.05881 
1 1 1 -1  7  49 o 13.12216 5.744229 1.488402       3.498774 7.404877       5.466670 -2.616671      4.553568 18.81584 7.636851 11.64598 5.583694 7.169865       9.460398 
1 1 1 -1  7  50 o 14.66690 6.357372 3.380999       4.196804 5.141490       5.413763 0.7297757      6.643630 16.12622 7.099484 14.13883 6.769716 1.987393       9.809777 
1 1 1 -1  7  51 o 11.47104 5.363793 -0.9204997E-01 3.726993 2.015159       5.193211 -2.330006      5.351899 13.61545 6.355013 11.79515 5.749347 1.820297       8.569783 
1 1 1 -1  8  1  o 457.1418 7.750050 2549.368       86.33594 2361.099       142.1365 2659.443       108.6829 439.2247 13.29484 466.7602 9.555010 -27.53543      16.37226 
1 1 1 -1  8  2  o 336.7111 5.097401 1382.141       41.82561 1418.094       85.01929 1370.662       48.04112 340.6327 10.25392 335.2803 5.879887 5.352325       11.82015 
1 1 1 -1  8  3  o 456.2715 7.731506 2539.834       85.96538 2527.344       148.3081 2546.155       105.4955 454.3732 13.40885 456.6928 9.479243 -2.319672      16.42112 
1 1 1 -1  8  4  o 635.5417 9.166223 4930.782       141.9615 4478.782       265.9021 5110.980       167.8912 603.7972 18.09192 646.8365 10.65117 -43.03931      20.99441 
1 1 1 -1  8  5  o 409.8427 6.075431 2048.478       60.67788 2117.350       87.65611 1985.113       84.07860 416.4842 8.636694 403.2758 8.555536 13.20844       12.15688 
1 1 1 -1  8  6  o 249.9526 5.703441 761.9071       34.74007 754.6148       48.89456 769.3414       49.36864 248.5131 8.084507 250.9288 8.084099 -2.415771      11.43293 
1 1 1 -1  8  7  o 104.9635 2.907964 134.3781       7.430955 134.7368       8.982963 133.6003       13.22547 105.0789 3.513006 104.5402 5.207885 0.5387421      6.281981 
1 1 1 -1  8  8  o 290.1351 4.497650 1026.361       31.79963 1068.397       46.14605 988.3480       43.88225 295.9146 6.399293 284.6175 6.326902 11.29712       8.998924 
1 1 1 -1  8  9  o 360.6043 6.244267 1586.594       54.87170 1561.515       66.75504 1638.839       96.34931 357.6187 7.659983 365.8319 10.81953 -8.213196      13.25661 
1 1 1 -1  8  10 o 483.0821 8.157262 2849.906       96.02878 2838.123       117.5498 2873.544       166.4996 481.8068 10.01182 483.7852 14.13809 -1.978333      17.32403 
1 1 1 -1  8  11 o 232.3028 3.780904 657.8179       21.40357 664.5460       30.49526 651.2857       30.04813 233.4360 5.360785 231.0963 5.335664 2.339752       7.563552 
1 1 1 -1  8  12 o 407.8679 7.014165 2029.572       69.71587 2067.683       86.22313 1957.614       118.4787 411.5465 8.597432 399.8720 12.17277 11.67447       14.90275 
1 1 1 -1  8  13 o 274.6951 4.317447 919.7809       28.90108 941.1773       41.50467 899.6406       40.26798 277.8145 6.130641 271.6167 6.083693 6.197845       8.636903 
1 1 1 -1  8  14 o 327.9850 5.014511 1311.345       40.07916 1398.601       59.11268 1237.105       54.52577 338.6390 7.163209 318.4939 7.025295 20.14508       10.03326 
1 1 1 -1  8  15 o 496.2749 8.406905 3004.468       101.6704 2950.179       174.8176 3032.216       124.9806 490.9638 14.62798 498.4137 10.29003 -7.449890      17.88470 
1 1 1 -1  8  16 o 281.4500 4.426726 965.4954       30.36128 934.5485       42.19765 998.7114       43.71732 276.8577 6.254541 286.2036 6.268193 -9.345886      8.854916 
1 1 1 -1  8  17 o 383.9045 6.625860 1797.158       61.98713 1966.374       112.9644 1724.254       74.14742 401.0907 11.56956 375.9661 8.093033 25.12463       14.11920 
1 1 1 -1  8  18 o 1071.069 15.29468 14040.34       399.2032 14317.48       572.3218 13777.76       557.1028 1079.130 21.76358 1058.668 21.59431 20.46167       30.65889 
1 1 1 -1  8  19 o 174.8819 3.243458 372.7283       13.82258 368.1353       19.46524 377.4002       19.63198 173.7206 4.602091 175.8953 4.583994 -2.174728      6.495556 
1 1 1 -1  8  20 o 794.3444 11.41500 7712.599       220.9637 7775.242       314.0707 7651.201       310.9325 796.2914 16.18525 789.9242 16.15268 6.367249       22.86638 
1 1 1 -1  8  21 o 130.3739 2.925841 207.1546       9.295600 206.1463       13.11773 208.1717       13.17438 129.9740 4.146888 130.6117 4.144406 -0.6377106     5.862830 
1 1 1 -1  8  22 o 257.3449 4.817985 807.6082       30.21462 788.3704       36.72102 847.9349       53.16588 254.2068 5.927771 263.3460 8.294918 -9.139206      10.19530 
1 1 1 -1  8  23 o 163.3930 3.717581 325.5024       14.80233 319.2914       17.74879 339.6914       26.82661 161.7395 4.507547 166.6689 6.618193 -4.929428      8.007401 
1 1 1 -1  8  24 o 363.6496 5.546862 1614.282       49.15487 1609.767       69.41531 1618.822       69.61609 362.8030 7.851423 363.8217 7.852083 -1.018768      11.10406 
1 1 1 -1  8  25 o 207.9778 3.677630 527.5839       18.63894 529.5424       26.38266 525.6323       26.33629 208.2555 5.198594 207.4189 5.214524 0.8366699      7.363194 
1 1 1 -1  8  26 o 175.7848 3.363671 376.9185       14.40891 381.0866       20.34523 372.7241       20.40946 176.5959 4.731918 174.6388 4.800283 1.957108       6.740458 
1 1 1 -1  8  27 o 192.0262 3.520754 449.9493       16.47526 450.6888       23.24650 449.2029       23.35293 191.9803 4.973140 191.6590 5.004351 0.3212585      7.055185 
1 1 1 -1  8  28 o 209.7884 4.388291 537.6676       22.43432 548.3262       40.61576 532.9879       26.91228 211.0895 7.909713 208.6817 5.296406 2.407822       9.519216 
1 1 1 -1  8  29 o 98.41480 3.224454 118.3291       7.722645 118.7640       12.11606 118.0315       10.02235 98.40247 5.069742 98.19952 4.197855 0.2029572      6.582117 
1 1 1 -1  8  30 o 234.6884 4.581656 673.6432       26.20295 670.9229       43.77943 675.1617       32.70846 233.2861 7.711561 234.7060 5.718733 -1.419846      9.600629 
1 1 1 -1  8  31 o 50.89215 3.618736 31.80095       4.458630 30.44947       5.875176 33.63631       6.846630 49.62768 4.922854 52.10051 5.474287 -2.472828      7.362222 
1 1 1 -1  8  32 o 73.36150 3.171530 65.85179       5.656476 67.76124       7.617614 63.50493       8.445173 74.30058 4.224584 71.83533 4.852781 2.465256       6.434018 
1 1 1 -1  8  33 o 182.5073 4.054781 407.6251       18.03366 404.2728       21.99202 414.5061       31.50807 181.4885 4.977257 183.0976 7.074912 -1.609085      8.650288 
1 1 1 -1  8  34 o 16.93355 6.473147 2.436722       3.723110 4.795363       4.762894 -1.268610      5.969714 21.03518 7.440452 17.13100 7.501081 3.904181       10.56535 
1 1 1 -1  8  35 o 89.22111 4.202511 97.79569       9.111510 92.10234       11.30868 108.3305       15.38298 86.34570 5.401522 93.31176 6.811926 -6.966064      8.693605 
1 1 1 -1  8  36 o 34.70762 5.328809 15.17762       4.363224 16.10829       5.672655 13.82937       6.827706 35.45976 6.812203 32.61602 8.504113 2.843739       10.89615 
1 1 1 -1  8  37 o 110.2005 3.190555 148.8036       8.559107 143.6608       11.68522 154.7567       12.57220 107.9914 4.449827 112.0455 4.614355 -4.054153      6.410400 
1 1 1 -1  8  38 o 142.2556 3.832693 248.8763       13.27437 241.2091       15.97136 266.0049       23.87177 139.7211 4.697446 145.6782 6.742697 -5.957108      8.217662 
1 1 1 -1  8  39 o 101.4160 4.758135 127.6988       11.72646 0.000000       0.000000 127.6988       11.72646 ?        ?        101.4160 4.758135 0.000000       4.758135 
1 1 1 -1  8  40 f 119.4115 3.273547 175.6897       9.516795 169.9851       13.02298 182.2273       13.94148 116.8345 4.582963 120.8831 4.741881 -4.048546      6.594618 
1 1 1 -1  8  41 o 46.69956 4.210438 27.38441       4.740148 23.01010       6.240198 33.35162       7.288352 42.00685 6.289153 50.84925 5.996997 -8.842407      8.690076 
1 1 1 -1  8  42 o 50.14938 4.088354 31.71309       4.953005 33.59321       6.509415 29.12770       7.633270 51.04996 5.310019 46.62852 6.927976 4.421436       8.728868 
1 1 1 -1  8  43 o 47.47082 4.712332 29.08474       5.379394 24.84659       6.233624 41.44773       10.64667 43.04074 6.115156 53.81625 8.391943 -10.77550      10.38363 
1 1 1 -1  8  44 o 23.21867 6.743105 7.708739       4.040124 9.989261       5.110770 3.909346       6.596694 25.98016 7.595313 20.02886 8.287501 5.951302       11.24151 
1 1 1 -1  8  45 o 37.95383 5.728540 20.10932       5.133474 24.08395       6.121127 10.68639       9.424877 41.04717 6.322091 25.07055 10.08016 15.97662       11.89867 
1 1 1 -1  8  46 o 19.77112 6.726385 5.997009       3.874968 1.536697       5.150249 11.81587       5.882536 15.87915 6.959707 26.01498 8.260415 -10.13583      10.80148 
1 1 1 -1  8  47 o 40.98909 4.718238 23.56216       4.626984 27.07787       6.509673 19.97231       6.577948 41.48178 6.665439 33.55727 8.130405 7.924503       10.51340 
1 1 1 -1  8  48 o 14.78032 6.222725 2.593479       3.815602 -1.826111      5.876051 5.815647       5.017284 13.70156 6.505856 18.23403 7.346515 -4.532470      9.813126 
1 1 1 -1  8  49 o 19.04728 7.742414 7.953058       5.628722 6.954820       8.766443 8.653259       7.342058 17.79673 8.290001 18.86246 8.287172 -1.065735      11.72183 
1 1 1 -1  8  50 o 10.76104 5.121400 -1.607508      3.683401 -6.910969      5.350431 3.170446       5.078437 10.58443 5.267333 14.67702 6.637627 -4.092587      8.473658 
1 1 1 -1  8  51 o 18.39707 6.700070 7.350774       3.893605 11.84254       5.594793 3.132107       5.422046 20.76574 7.935861 14.25027 6.597241 6.515471       10.31996 
1 1 1 -1  9  1  o 192.2691 3.820085 450.5866       17.89858 447.9038       30.80306 451.9542       21.99228 191.5148 6.610085 192.5434 4.687114 -1.028671      8.103226 
1 1 1 -1  9  2  o 162.6256 3.445685 322.3380       13.65528 335.8505       23.97510 315.8498       16.61329 165.8450 5.941886 160.9126 4.240413 4.932434       7.299802 
1 1 1 -1  9  3  o 283.1670 3.947500 977.3856       27.23961 968.2016       34.93191 991.6345       43.51104 281.7961 5.086878 285.1367 6.261959 -3.340668      8.067741 
1 1 1 -1  9  4  o 249.2758 3.565356 757.3870       21.65804 713.9006       26.96591 836.4223       36.35372 241.9865 4.572859 261.8884 5.696349 -19.90190      7.304754 
1 1 1 -1  9  5  f 418.9373 6.209101 2140.952       63.38898 2027.513       86.48856 2272.610       93.17559 407.4594 8.710404 431.3674 8.863774 -23.90808      12.42729 
1 1 1 -1  9  6  o 733.7874 9.431899 6579.633       168.6574 6280.488       258.4793 6801.424       222.5649 715.3954 14.82666 745.3128 12.25412 -29.91736      19.23521 
1 1 1 -1  9  7  o 296.7026 4.593240 1073.400       33.21059 1065.705       46.82098 1081.191       47.11412 295.5305 6.501329 297.6703 6.495004 -2.139862      9.189796 
1 1 1 -1  9  8  o 169.6408 4.232866 350.8629       17.49851 370.3154       25.59168 333.7831       23.98012 174.1195 6.040509 165.3026 5.962764 8.816910       8.487773 
1 1 1 -1  9  9  o 323.5129 5.688664 1276.621       44.84747 1286.588       55.45687 1257.783       76.24090 324.6819 7.009084 320.6301 9.769098 4.051727       12.02342 
1 1 1 -1  9  10 o 302.1992 4.666313 1113.474       34.36396 1116.504       48.75206 1110.482       48.44536 302.5092 6.613299 301.6938 6.589458 0.8153992      9.335774 
1 1 1 -1  9  11 o 94.45675 2.968762 108.8431       6.825035 108.1758       8.146989 110.4138       12.49838 94.14132 3.557647 95.00294 5.421094 -0.8616257     6.484221 
1 1 1 -1  9  12 o 268.7115 4.248592 880.1406       27.82065 897.2491       39.88324 863.9265       38.82671 271.2554 6.033593 266.1724 5.985929 5.083008       8.499152 
1 1 1 -1  9  13 o 356.8141 5.386307 1552.133       46.83486 1550.829       66.24202 1553.436       66.22697 356.5659 7.623556 356.8659 7.615418 -0.2999878     10.77558 
1 1 1 -1  9  14 o 581.4073 9.750880 4125.428       138.1530 4178.727       242.4060 4099.787       168.1313 583.9363 17.05326 579.3679 11.90853 4.568481       20.79967 
1 1 1 -1  9  15 o 320.3840 5.714331 1251.357       44.61412 1297.852       80.17263 1230.500       53.69606 325.9398 10.10596 317.6625 6.936500 8.277313       12.25747 
1 1 1 -1  9  16 o 542.9969 9.112028 3597.620       120.5726 3660.995       210.5624 3566.701       147.0720 546.7551 15.82008 540.4669 11.16670 6.288208       19.36415 
1 1 1 -1  9  17 o 529.6219 7.735381 3421.487       99.83521 3569.302       145.4044 3289.654       137.3189 540.6342 11.03667 519.0421 10.85654 21.59204       15.48136 
1 1 1 -1  9  18 o 203.2044 3.527127 503.2470       17.46587 494.8712       24.61477 511.7404       24.78707 201.4805 5.013336 204.8867 4.964497 -3.406281      7.055478 
1 1 1 -1  9  19 o 483.1144 7.107359 2847.104       83.67474 2858.415       118.7400 2835.947       117.9321 483.7941 10.07164 481.8922 10.04259 1.901917       14.22293 
1 1 1 -1  9  20 o 282.2810 5.226795 971.5886       35.95449 923.1227       61.64551 996.5755       44.26282 274.7879 9.218985 285.8385 6.354513 -11.05057      11.19685 
1 1 1 -1  9  21 o 168.3760 3.659803 345.5835       15.01669 339.7520       18.50144 356.8418       25.70714 166.8678 4.554107 170.9174 6.182261 -4.049698      7.678557 
1 1 1 -1  9  22 o 195.3741 3.980701 465.3932       18.95234 466.3013       23.46889 463.6908       32.13366 195.4690 4.930890 194.7800 6.780200 0.6890411      8.383602 
1 1 1 -1  9  23 o 104.2199 3.326084 132.5566       8.436519 129.9380       9.941011 139.2975       15.94980 103.1493 3.962202 106.6388 6.163942 -3.489510      7.327566 
1 1 1 -1  9  24 o 274.7957 4.419329 921.2864       29.59392 911.3049       41.57699 931.5365       42.13278 273.1248 6.246775 276.1383 6.261198 -3.013489      8.844478 
1 1 1 -1  9  25 o 242.7100 4.055328 718.7651       23.98556 720.1047       33.95721 717.4313       33.88431 242.7664 5.739938 242.3156 5.738273 0.4508514      8.116321 
1 1 1 -1  9  26 o 202.9713 3.620868 502.6617       17.90951 516.9695       25.58157 488.9078       25.08156 205.6996 5.103376 199.9681 5.151331 5.731552       7.251253 
1 1 1 -1  9  27 o 201.6244 3.625594 496.1439       17.81388 499.3664       25.21800 492.9343       25.16733 202.0479 5.125911 200.7380 5.149085 1.309875       7.265538 
1 1 1 -1  9  28 o 126.5094 4.320944 195.7532       13.30147 0.000000       0.000000 195.7532       13.30147 ?        ?        126.5094 4.320944 0.000000       4.320944 
1 1 1 -1  9  29 o 103.2307 2.929321 130.1297       7.361603 125.2543       10.02564 135.8338       10.84423 101.1718 4.074798 105.3471 4.232775 -4.175323      5.875402 
1 1 1 -1  9  30 o 227.7395 3.949646 633.8016       21.91960 635.0322       30.94777 632.5628       31.05047 227.6298 5.579101 227.1797 5.608703 0.4500580      7.911000 
1 1 1 -1  9  31 o 100.6826 3.294762 123.9334       8.072896 114.3444       12.26732 131.2585       10.72173 96.44952 5.238984 103.5029 4.259962 -7.053352      6.752350 
1 1 1 -1  9  32 o 251.7549 4.252626 775.6455       26.08983 755.1252       36.22786 797.7542       37.60378 247.8675 5.997730 254.7458 6.057430 -6.878311      8.524390 
1 1 1 -1  9  33 o 36.03404 5.024290 16.23089       4.292077 12.63863       5.109612 24.84064       7.910415 31.40892 6.867600 44.20259 7.618732 -12.79367      10.25714 
1 1 1 -1  9  34 o 41.70119 4.288687 21.53059       4.296159 19.90866       5.630569 23.79052       6.646377 39.77162 5.995725 43.44976 6.474538 -3.678139      8.824305 
1 1 1 -1  9  35 o 52.83058 4.297708 34.45472       5.485219 33.00855       6.247794 39.31783       11.45710 51.57598 5.035038 55.42371 8.774755 -3.847725      10.11672 
1 1 1 -1  9  36 o 108.6009 3.180920 144.4372       8.409191 138.5009       11.31885 151.7502       12.56301 106.1004 4.387196 111.0013 4.654729 -4.900871      6.396404 
1 1 1 -1  9  37 o 62.52925 3.620610 48.11162       5.493382 45.99684       7.239739 50.98159       8.433904 60.87997 4.921844 63.98442 5.461171 -3.104446      7.351799 
1 1 1 -1  9  38 o 50.32040 3.951198 31.33784       4.806334 30.13030       6.369228 32.93494       7.324891 48.99927 5.424859 51.09679 5.996610 -2.097527      8.086311 
1 1 1 -1  9  39 o 58.01099 8.058698 43.80032       11.08508 0.000000       0.000000 43.80032       11.08508 ?        ?        58.01099 8.058698 0.000000       8.058698 
1 1 1 -1  9  40 o 65.58501 3.578458 53.26835       5.697549 50.42950       7.661653 56.78049       8.521932 63.32114 5.005908 67.10852 5.252867 -3.787384      7.256151 
1 1 1 -1  9  41 o 26.62853 6.282215 9.443073       4.010213 6.589066       5.150846 13.83544       6.389992 22.82387 7.755239 31.67648 8.211004 -8.852613      11.29444 
1 1 1 -1  9  42 o 41.77225 4.573458 22.30801       4.579517 25.11582       6.129508 18.76047       6.889786 43.70401 5.906346 36.60955 7.950955 7.094463       9.904676 
1 1 1 -1  9  43 o 28.35482 6.318154 11.08961       4.253958 8.952371       5.504455 14.25901       6.703114 25.01727 7.995852 30.95098 8.586369 -5.933704      11.73283 
1 1 1 -1  9  44 o 41.24231 4.687216 22.41576       4.627324 21.05394       6.013958 24.39192       7.244565 38.57714 6.636543 40.76711 7.570976 -2.189960      10.06794 
1 1 1 -1  9  45 o 19.17785 7.033350 5.164619       4.301799 7.238532       4.989443 -0.8423188     8.491481 21.74977 7.621834 17.90556 8.277720 3.844213       11.25224 
1 1 1 -1  9  46 o 27.55172 6.445005 11.67760       4.249766 7.354141       5.461224 18.31488       6.766578 21.03360 7.885014 32.22329 8.497211 -11.18968      11.59207 
1 1 1 -1  9  47 o 14.08913 6.057891 1.571655       3.750854 -0.2992532     4.967609 4.052901       5.720791 13.98376 6.416117 17.48107 7.498303 -3.497311      9.868693 
1 1 1 -1  9  48 o 10.32311 5.035763 -4.817139      4.128608 -5.413654      5.042522 -3.604029      7.190966 11.29520 5.521898 13.96698 6.774957 -2.671785      8.740217 
1 1 1 -1  9  49 o 21.52981 7.526365 9.877958       4.863391 2.763092       9.365953 12.50460       5.690742 16.13875 7.805316 23.25799 8.140646 -7.119246      11.27799 
1 1 1 -1  9  50 o 12.44196 5.636925 1.086478       3.682236 -3.031171      5.116974 5.508860       5.302940 11.56989 5.635582 16.19327 7.080618 -4.623377      9.049582 
1 1 1 -1  10 1  o 359.5695 6.259744 1577.222       54.84986 1548.853       93.76289 1591.980       67.62870 355.7337 10.82869 361.1382 7.684604 -5.404510      13.27831 
1 1 1 -1  10 2  o 152.1333 2.599084 282.0635       9.635640 311.1177       15.90267 265.2090       12.11222 159.6992 4.089673 147.5073 3.369567 12.19196       5.299000 
1 1 1 -1  10 3  o 111.7380 2.579314 152.1601       7.023301 146.1345       13.98267 154.1933       8.122226 109.3400 5.263231 112.4391 2.966890 -3.099098      6.041857 
1 1 1 -1  10 4  o 474.0977 5.677233 2741.594       65.59046 2675.568       91.27271 2812.102       94.32016 468.1092 8.001248 479.8962 8.065311 -11.78702      11.36086 
1 1 1 -1  10 5  o 201.3979 2.798053 494.3471       13.73242 508.7751       19.72900 480.7874       19.12617 204.2884 3.963012 198.5902 3.952155 5.698151       5.596873 
1 1 1 -1  10 6  o 328.3877 4.479967 1314.870       35.85071 1301.541       56.45524 1323.879       46.40939 326.5473 7.094505 329.4343 5.780973 -2.887024      9.151593 
1 1 1 -1  10 7  o 202.1525 3.428159 498.1239       16.88792 466.6973       23.35392 532.5696       24.45002 195.5697 4.904163 208.9852 4.800954 -13.41554      6.862942 
1 1 1 -1  10 8  o 215.3826 4.141720 565.5453       21.73839 578.4032       27.19803 542.8033       36.17152 217.7853 5.124752 210.7797 7.052024 7.005600       8.717461 
1 1 1 -1  10 9  o 466.2688 7.904665 2653.826       89.81646 2528.748       150.3529 2723.226       111.9955 454.1360 13.60127 472.1035 9.734805 -17.96744      16.72606 
1 1 1 -1  10 10 o 211.2850 4.166844 544.1705       21.45419 562.8948       26.55506 508.9770       36.40616 214.8666 5.071568 204.1133 7.331172 10.75325       8.914420 
1 1 1 -1  10 11 o 450.6471 6.642146 2476.830       72.94257 2453.946       102.6505 2500.172       103.6699 448.3451 9.395338 452.5477 9.400522 -4.202637      13.29068 
1 1 1 -1  10 12 o 136.6217 2.803462 227.4625       9.333628 222.6862       13.24243 232.1778       13.15747 135.1091 4.026538 137.9652 3.917478 -2.856094      5.617797 
1 1 1 -1  10 13 o 471.0523 8.012129 2706.562       91.97149 2709.794       160.4426 2704.980       112.2438 470.6005 14.00602 470.7887 9.783636 -0.1882019     17.08473 
1 1 1 -1  10 14 o 765.6541 12.70755 7161.664       237.0994 7154.877       411.5039 7165.036       290.0922 762.9356 22.15697 765.3336 15.55425 -2.398010      27.07150 
1 1 1 -1  10 15 o 212.7963 3.614421 551.8605       18.74300 546.0842       26.54588 557.6028       26.46749 211.6560 5.146719 213.8779 5.078212 -2.221848      7.230280 
1 1 1 -1  10 16 o 255.4003 4.715158 795.0988       29.34632 834.1509       51.52044 776.3429       35.70468 261.3712 8.098599 252.3441 5.806251 9.027115       9.964931 
1 1 1 -1  10 17 o 547.7307 7.982555 3659.977       106.5480 3753.449       153.3446 3572.727       148.1526 554.3301 11.35178 540.8337 11.24112 13.49646       15.97578 
1 1 1 -1  10 18 o 267.5982 4.290498 872.8600       27.97866 882.1430       39.93497 863.9108       39.21059 268.9632 6.092905 266.1708 6.045145 2.792358       8.582964 
1 1 1 -1  10 19 o 293.0516 5.373549 1047.138       38.37438 1077.343       68.89466 1033.553       46.20570 296.8686 9.535621 291.0956 6.513640 5.772980       11.54797 
1 1 1 -1  10 20 o 293.0875 4.621446 1047.302       33.00740 1066.540       47.26330 1028.985       46.11683 295.6736 6.559569 290.4238 6.516151 5.249847       9.245981 
1 1 1 -1  10 21 o 577.6341 9.710167 4079.361       136.6833 4157.961       169.8972 3935.152       230.1283 582.6586 11.96564 565.2040 16.72657 17.45459       20.56586 
1 1 1 -1  10 22 o 123.8506 2.892406 186.9695       8.729580 179.5098       12.12861 194.9878       12.57443 121.2612 4.110375 126.3880 4.088070 -5.126740      5.797198 
1 1 1 -1  10 23 o 66.16393 3.539352 53.53148       5.685883 54.19747       6.599250 51.61263       11.20159 66.53574 4.089849 64.58299 7.242070 1.952744       8.317118 
1 1 1 -1  10 24 o 282.2477 4.525957 972.1467       31.12985 963.1708       43.87107 981.2490       44.17905 280.7255 6.412987 283.3498 6.398194 -2.624298      9.058879 
1 1 1 -1  10 25 o 159.7518 3.197144 311.2538       12.44641 315.4892       17.65240 307.0666       17.55179 160.6955 4.512258 158.5308 4.548001 2.164703       6.406621 
1 1 1 -1  10 26 o 166.3214 3.257008 337.4643       13.20089 342.5134       18.76289 332.5151       18.57626 167.3972 4.603922 164.9315 4.626449 2.465775       6.526877 
1 1 1 -1  10 27 o 163.0629 3.241914 324.4301       12.88228 303.8505       17.66438 347.8099       18.82781 157.6283 4.603559 168.6570 4.585243 -11.02873      6.497477 
1 1 1 -1  10 28 o 17.14060 7.025435 1.207296       4.681651 0.000000       0.000000 1.207296       4.681651 ?        ?        17.14060 7.025435 0.000000       7.025435 
1 1 1 -1  10 29 o 59.42948 3.148177 43.22746       4.543024 36.68130       5.832612 53.32487       7.243947 54.59938 4.421482 65.88364 4.539674 -11.28426      6.337045 
1 1 1 -1  10 30 o 149.1510 3.187247 271.5953       11.58452 273.3598       16.21986 269.7580       16.55113 149.4270 4.459315 148.4187 4.581665 1.008224       6.393523 
1 1 1 -1  10 31 o 176.2370 3.436037 379.4396       14.75676 380.8473       20.69832 377.9845       21.04441 176.2742 4.823013 175.5883 4.923047 0.6859436      6.891868 
1 1 1 -1  10 32 o 72.79625 3.921345 65.00494       6.930654 62.05529       8.915927 69.50856       11.01698 70.93837 5.193610 74.94074 6.084966 -4.002373      8.000025 
1 1 1 -1  10 33 o 75.50410 3.191792 69.78645       5.859499 71.79597       7.816134 67.20801       8.853683 76.45543 4.211418 73.85026 4.948223 2.605171       6.497765 
1 1 1 -1  10 34 o 53.62559 3.616903 35.34531       4.698910 32.15647       6.172861 39.73914       7.245893 50.92059 5.040658 56.60850 5.314762 -5.687908      7.324953 
1 1 1 -1  10 35 f 86.70755 3.687848 92.23855       7.774511 86.63262       8.925647 109.8643       15.82666 83.90659 4.380404 93.85692 6.969430 -9.950333      8.231700 
1 1 1 -1  10 36 o 126.9839 3.236048 197.4971       10.00566 200.1402       13.99767 194.7357       14.30771 127.5208 4.511526 125.7378 4.677629 1.782906       6.498775 
1 1 1 -1  10 37 f 161.2897 3.437019 318.9778       13.50905 312.7028       18.69873 325.8289       19.53827 159.1391 4.827270 162.3959 4.942890 -3.256805      6.909029 
1 1 1 -1  10 38 o 39.52035 5.213036 19.68801       4.898194 11.71510       6.599562 29.46665       7.308791 29.89188 8.599448 48.14441 6.387067 -18.25252      10.71192 
1 1 1 -1  10 39 o 100.0060 4.754609 124.4842       11.55398 0.000000       0.000000 124.4842       11.55398 ?        ?        100.0060 4.754609 0.000000       4.754609 
1 1 1 -1  10 40 o 20.84969 7.065724 5.315914       4.275388 4.586555       4.970418 7.390559       8.382899 20.51437 7.554018 25.78563 9.746830 -5.271261      12.33142 
1 1 1 -1  10 41 o 99.00999 3.232140 121.4260       7.787946 111.2608       10.39001 134.4607       11.76542 94.01993 4.548310 103.2766 4.687089 -9.256630      6.531150 
1 1 1 -1  10 42 o 57.77168 4.179301 42.26119       5.843981 37.28451       6.780431 56.63798       11.52440 53.66323 5.252121 64.43140 7.478575 -10.76817      9.138593 
1 1 1 -1  10 43 f 29.19629 5.948974 11.66080       4.088750 9.516550       5.219471 15.06671       6.578186 25.63332 7.721797 31.78321 8.376632 -6.149887      11.39272 
1 1 1 -1  10 44 o 16.47114 6.455431 2.911119       3.772378 8.398881       4.961333 -4.609643      5.808067 23.68041 7.593465 13.76243 6.515191 9.917985       10.00542 
1 1 1 -1  10 45 o 17.44467 6.842399 3.800425       4.241045 1.739731       4.859664 10.38398       8.686199 16.03352 6.894679 24.20852 9.696489 -8.174994      11.89784 
1 1 1 -1  10 46 o 15.90996 6.413229 3.061180       3.825491 1.076386       5.070452 5.683840       5.828544 15.27521 6.790370 19.31849 7.868957 -4.043287      10.39373 
1 1 1 -1  10 47 o 12.00393 5.757819 -3.699370      4.853744 -3.438555      6.479323 -4.032898      7.327042 13.86475 6.650934 14.37786 6.941417 -0.5131111     9.613439 
1 1 1 -1  10 48 o 11.05346 5.197851 -1.652013      3.585388 -1.478917      5.081287 -1.823647      5.059791 12.91926 6.109452 12.73121 6.042788 0.1880550      8.593060 
1 1 1 -1  10 49 o 10.81290 5.244957 -3.397486      4.309540 -1.580933      9.065878 -3.927796      4.898361 14.67481 7.220597 11.26038 5.491258 3.414430       9.071435 
1 1 1 -1  10 50 o 12.19062 5.590981 0.7415036      3.766582 4.103705       5.236423 -2.863128      5.421923 15.09210 6.790340 11.81432 5.764875 3.277779       8.907441 
1 1 1 -1  11 1  o 491.1262 7.201719 2944.214       86.19168 2979.650       122.6745 2909.666       121.1271 493.6295 10.19805 487.7995 10.18976 5.830017       14.41636 
1 1 1 -1  11 2  o 383.3595 5.746912 1792.741       53.68796 1928.764       112.5929 1752.712       61.07886 396.7595 11.65786 378.9849 6.613524 17.77466       13.40315 
1 1 1 -1  11 3  o 311.2346 4.289794 1181.020       32.53572 1172.678       51.21395 1186.666       42.12979 309.9864 6.779685 311.9114 5.542707 -1.925079      8.757039 
1 1 1 -1  11 4  o 195.7569 3.025071 467.0628       14.43074 465.1760       18.63295 469.8909       22.81161 195.3406 3.914290 196.3033 4.768617 -0.9626923     6.169390 
1 1 1 -1  11 5  o 167.7072 3.075702 342.8048       12.56991 338.3160       17.52900 347.5565       18.03486 166.5239 4.323267 168.7810 4.388557 -2.257080      6.160363 
1 1 1 -1  11 6  o 506.9820 7.409390 3137.300       91.54004 3146.476       129.8566 3128.236       129.0614 507.2722 10.50478 505.8056 10.47072 1.466614       14.83194 
1 1 1 -1  11 7  o 356.1692 4.815950 1546.746       41.79983 1556.392       66.46504 1540.435       53.76276 357.0912 7.637972 355.3606 6.208351 1.730591       9.842877 
1 1 1 -1  11 8  o 485.9216 6.371530 2880.145       75.44770 3015.777       123.1231 2798.592       95.47302 496.8105 10.16981 478.8223 8.182201 17.98822       13.05272 
1 1 1 -1  11 9  o 170.6522 3.146658 354.9213       13.08572 344.1576       18.35219 366.0536       18.66375 167.9643 4.487702 173.2315 4.424778 -5.267197      6.302232 
1 1 1 -1  11 10 o 243.6055 3.965143 723.3054       23.53867 717.7576       33.27428 728.8628       33.30315 242.6293 5.627678 244.5002 5.589462 -1.870865      7.931762 
1 1 1 -1  11 11 o 193.1247 3.383774 454.5410       15.92485 453.9960       22.66715 455.0723       22.37790 192.9880 4.819818 193.2178 4.752654 -0.2297821     6.768926 
1 1 1 -1  11 12 o 628.2871 10.50545 4818.668       160.8455 4619.437       271.6281 4926.251       199.6034 613.7650 18.18090 634.9638 12.89980 -21.19879      22.29237 
1 1 1 -1  11 13 o 571.1671 9.598248 3980.888       133.5953 3988.785       232.6377 3977.002       163.1857 570.6226 16.74809 570.6780 11.73424 -0.5535889E-01 20.44971 
1 1 1 -1  11 14 o 353.6474 5.370104 1524.594       46.27956 1511.220       65.20832 1538.167       65.69273 352.0086 7.601750 355.1336 7.590833 -3.124969      10.74278 
1 1 1 -1  11 15 o 792.9120 13.13274 7683.639       253.7562 7436.880       429.0893 7816.354       314.6814 777.4379 22.67306 799.1116 16.15948 -21.67377      27.84235 
1 1 1 -1  11 16 o 528.2801 7.728240 3404.292       99.49035 3305.008       137.8175 3512.343       143.7726 520.2314 10.87105 536.2867 11.00127 -16.05530      15.46635 
1 1 1 -1  11 17 o 56.53171 3.655567 39.11303       5.008968 38.57887       5.745034 40.80610       10.22816 56.09953 4.233644 57.35213 7.497680 -1.252609      8.610397 
1 1 1 -1  11 18 o 186.9218 3.958200 425.8792       18.02992 435.2944       33.05951 421.8932       21.51053 188.7596 7.200262 185.9694 4.750391 2.790222       8.626122 
1 1 1 -1  11 19 o 329.4848 5.082826 1323.686       40.81095 1292.002       57.01326 1356.979       58.44414 325.4023 7.189839 333.4843 7.191665 -8.081970      10.16926 
1 1 1 -1  11 20 o 343.2921 6.050276 1437.680       50.61452 1476.458       63.44034 1369.768       83.95396 347.7789 7.485591 334.5420 10.31034 13.23697       12.74117 
1 1 1 -1  11 21 o 250.8448 4.114863 767.2286       25.15340 747.1309       35.18959 788.2250       35.96773 247.4488 5.835698 254.1646 5.807134 -6.715836      8.232750 
1 1 1 -1  11 22 o 243.6110 4.720862 723.9667       28.02556 731.0997       34.23986 709.4875       48.78281 244.7383 5.741085 240.7171 8.328726 4.021194       10.11572 
1 1 1 -1  11 23 o 225.5999 4.493470 620.9756       24.70341 616.3839       29.83610 630.9854       44.05252 224.6925 5.449007 226.9410 7.978068 -2.248550      9.661327 
1 1 1 -1  11 24 o 203.1391 3.615746 503.3524       17.89896 512.3340       25.60522 494.7694       25.03046 204.7649 5.135465 201.2250 5.108602 3.539871       7.243674 
1 1 1 -1  11 25 o 324.3178 5.062401 1285.000       40.00953 1272.852       56.35669 1297.344       56.81009 322.3496 7.174344 325.4388 7.163414 -3.089142      10.13833 
1 1 1 -1  11 26 o 84.34715 2.824379 86.86751       5.797175 80.04712       7.953353 94.59855       8.467686 80.87108 4.048594 87.93943 3.961517 -7.068352      5.664339 
1 1 1 -1  11 27 o 98.66546 3.136584 118.8963       7.531928 114.3011       11.61690 122.2288       9.893064 96.56441 4.953252 99.96001 4.069842 -3.395599      6.410797 
1 1 1 -1  11 28 o 60.61972 3.980926 45.07854       5.848224 53.15883       11.95138 42.53458       6.705940 65.31747 7.653464 58.79347 4.720152 6.524006       8.991961 
1 1 1 -1  11 29 o 282.9376 4.585698 979.1392       31.61784 981.4458       44.72188 976.8342       44.70688 282.7308 6.490988 282.0614 6.504210 0.6694031      9.188997 
1 1 1 -1  11 30 o 141.4728 3.108477 244.3530       10.71660 258.6136       15.40884 230.9930       14.91437 145.3388 4.355544 137.3345 4.462373 8.004288       6.235667 
1 1 1 -1  11 31 o 69.41022 3.124087 58.95410       5.270697 57.31301       7.105107 60.96225       7.859661 68.30457 4.290263 70.41138 4.605911 -2.106812      6.294503 
1 1 1 -1  11 32 o 209.1212 3.793081 534.8687       19.32975 562.1051       27.75459 509.2142       26.93654 213.9878 5.322427 203.5688 5.434795 10.41898       7.606920 
1 1 1 -1  11 33 o 13.80729 5.895601 -0.7069634E-01 3.507390 0.4298653      4.532563 -0.8177902     5.537359 16.12642 6.785408 16.76842 7.285132 -0.6419907     9.955647 
1 1 1 -1  11 34 o 139.5947 3.226822 238.2758       10.97691 245.9692       15.34258 230.2081       15.71138 141.5360 4.453858 136.8572 4.718029 4.678741       6.488193 
1 1 1 -1  11 35 o 113.4527 3.611665 157.8052       9.972515 165.5107       12.05090 141.0637       17.76309 116.0517 4.268475 106.3859 6.888736 9.665779       8.103984 
1 1 1 -1  11 36 o 70.67155 3.355258 61.30631       5.761886 63.35030       7.701448 58.70764       8.683781 71.64877 4.432608 68.79259 5.218956 2.856178       6.847300 
1 1 1 -1  11 37 o 32.06149 5.792789 13.13498       4.359397 6.643592       5.925702 20.79281       6.436116 23.94005 8.311624 40.27206 6.800076 -16.33200      10.73891 
1 1 1 -1  11 38 o 63.88439 3.493435 50.30915       5.417857 40.85631       6.958561 64.86050       8.633557 57.17567 5.046004 72.17043 4.938782 -14.99476      7.060717 
1 1 1 -1  11 39 o 38.60942 6.146224 19.21410       5.589126 -0.2803377     9.531069 29.43127       6.900041 21.83658 9.521432 48.00185 6.031552 -26.16527      11.27108 
1 1 1 -1  11 40 o 13.54764 5.852863 -0.1592031     3.533674 1.168444       4.584441 -2.102654      5.546666 16.51428 6.877473 15.51500 6.983923 0.9992771      9.801777 
1 1 1 -1  11 41 o 12.82161 5.732808 -1.196984      3.668892 -3.478364      4.164923 6.705901       7.751770 12.20110 5.693645 24.27036 9.324559 -12.06926      10.92543 
1 1 1 -1  11 42 o 50.12098 3.871581 31.76051       4.692093 26.75401       5.869594 40.62335       7.809577 45.18522 5.439893 55.49146 5.863760 -10.30624      7.998507 
1 1 1 -1  11 43 o 43.61961 4.336834 24.61194       4.548892 23.07495       5.857995 26.94640       7.219506 41.16542 6.017319 43.76543 7.005426 -2.600014      9.234941 
1 1 1 -1  11 44 o 33.06336 5.255248 14.92799       4.092709 15.62521       5.337770 13.93335       6.375417 32.60824 6.931095 29.48471 8.442691 3.123528       10.92333 
1 1 1 -1  11 45 o 33.85611 5.962728 16.62790       4.739840 15.56642       5.446221 19.94221       9.623569 31.52789 7.241413 30.99206 10.59904 0.5358315      12.83657 
1 1 1 -1  11 46 o 17.66538 6.525280 4.656157       3.713746 5.354985       4.841200 3.656897       5.789047 18.66878 7.314089 17.54300 7.534184 1.125780       10.50047 
1 1 1 -1  11 47 o 16.82780 6.514579 4.334089       3.804463 -0.4040788     5.027963 10.68028       5.818933 13.79405 6.374383 23.15024 8.220612 -9.356193      10.40246 
1 1 1 -1  11 48 o 21.92608 6.776211 8.768047       3.985793 9.658644       5.724259 7.929895       5.553161 20.97860 8.024697 19.44838 7.765410 1.530224       11.16680 
1 1 1 -1  11 49 o 10.58870 5.153941 -3.656309      4.258455 -5.431778      8.740448 -3.103673      4.876372 13.50655 6.723284 11.49430 5.576361 2.012251       8.734893 
1 1 1 -1  11 50 f 14.86704 6.486882 4.013389       4.430361 7.736020       5.640540 -1.981900      7.158150 17.43163 7.460644 13.10262 6.440897 4.329010       9.856285 
1 1 1 -1  12 1  o 436.5204 6.464357 2324.908       68.76477 2364.861       98.32584 2286.660       96.20498 439.9525 9.171191 432.6232 9.125395 7.329346       12.93768 
1 1 1 -1  12 2  o 301.8917 4.693449 1111.258       34.52863 1166.863       50.25029 1061.520       47.52529 309.2414 6.668141 294.9557 6.611984 14.28568       9.390551 
1 1 1 -1  12 3  o 602.0564 7.805176 4424.912       114.5133 4679.209       188.0444 4275.021       144.3699 618.2026 12.48227 591.4088 10.01735 26.79382       16.00482 
1 1 1 -1  12 4  o 88.89019 2.861573 96.39842       6.190540 105.7938       10.66792 91.62832       7.601293 93.03034 4.721076 86.62654 3.608715 6.403801       5.942338 
1 1 1 -1  12 5  o 268.1931 3.803870 876.7607       24.86047 873.6936       32.07393 881.3762       39.34617 267.6865 4.916880 268.8151 6.006380 -1.128601      7.762236 
1 1 1 -1  12 6  o 429.8675 5.702750 2253.447       59.73860 2173.590       92.30476 2311.003       78.36320 421.9150 8.977657 435.1961 7.389091 -13.28113      11.62743 
1 1 1 -1  12 7  o 713.7638 10.28528 6223.177       178.8985 6430.791       258.7738 6033.108       247.5976 724.6312 14.65437 701.9116 14.47532 22.71967       20.59819 
1 1 1 -1  12 8  o 443.8183 6.567402 2402.250       71.02887 2402.058       100.5322 2402.441       100.3680 443.5944 9.300005 443.6312 9.284038 -0.3680420E-01 13.14091 
1 1 1 -1  12 9  o 161.0844 2.733176 316.2101       10.72895 309.0371       17.07885 320.8861       13.78952 159.1677 4.407434 162.2638 3.487316 -3.096100      5.620217 
1 1 1 -1  12 10 o 929.0332 13.28786 10548.91       300.8308 10228.45       416.4814 10898.50       435.0006 913.4324 18.71040 942.8081 18.93348 -29.37567      26.61871 
1 1 1 -1  12 11 o 104.9541 3.117732 134.3561       7.965127 135.4119       15.08557 133.9480       9.379050 105.2250 5.906817 104.7730 3.679154 0.4520340      6.958927 
1 1 1 -1  12 12 o 453.0774 7.747681 2503.632       85.54217 2338.442       142.6687 2596.352       106.8862 437.2510 13.40526 461.2780 9.508740 -24.02701      16.43524 
1 1 1 -1  12 13 o 129.3627 2.817635 203.9300       8.882392 190.7899       12.53354 217.1885       12.58985 125.0486 4.118619 133.4377 3.875844 -8.389137      5.655545 
1 1 1 -1  12 14 o 490.9074 8.302388 2939.856       99.32046 3024.812       174.7921 2899.347       120.6991 497.1393 14.44336 487.3679 10.16275 9.771362       17.66047 
1 1 1 -1  12 15 o 254.0712 4.124524 786.7839       25.53674 769.2433       35.91319 804.7231       36.31903 251.1821 5.867177 256.9113 5.801161 -5.729187      8.250893 
1 1 1 -1  12 16 o 1069.069 15.28683 13992.18       398.2534 13787.56       558.2097 14204.29       568.3581 1058.705 21.63647 1074.553 21.70491 -15.84839      30.64702 
1 1 1 -1  12 17 o 539.3079 9.125329 3550.640       119.9282 3408.946       203.2630 3626.307       148.5377 527.1953 15.83958 544.7633 11.18904 -17.56799      19.39296 
1 1 1 -1  12 18 o 508.0297 7.456744 3149.346       92.31546 3278.331       134.2362 3033.604       127.1587 517.9369 10.63547 498.2525 10.47274 19.68439       14.92620 
1 1 1 -1  12 19 o 399.9977 6.911598 1952.413       67.37086 2039.722       85.31772 1807.801       109.8029 408.6795 8.566833 384.1802 11.74229 24.49930       14.53520 
1 1 1 -1  12 20 o 243.7297 4.038295 724.2673       23.98516 715.6051       33.85173 733.0000       33.98897 242.1897 5.735736 245.1180 5.690189 -2.928375      8.079413 
1 1 1 -1  12 21 o 320.6301 4.985759 1254.145       38.95576 1235.244       54.73696 1273.544       55.45357 318.0085 7.063270 322.9028 7.047282 -4.894226      9.977673 
1 1 1 -1  12 22 o 302.6045 5.549549 1117.849       40.92316 1113.647       49.72253 1126.671       72.04821 301.8966 6.758632 303.0381 9.769173 -1.141418      11.87922 
1 1 1 -1  12 23 o 355.5548 5.452371 1543.872       47.24198 1537.566       66.77761 1550.192       66.84293 354.4193 7.731743 355.8766 7.707614 -1.457306      10.91729 
1 1 1 -1  12 24 o 247.1813 4.111448 745.6531       24.76546 765.6089       35.63267 727.0055       34.44484 250.2618 5.842754 243.8772 5.795846 6.384598       8.229799 
1 1 1 -1  12 25 o 226.7793 3.887273 627.7143       21.48249 632.0491       30.57287 623.4868       30.19235 227.3623 5.518000 225.8215 5.486503 1.540833       7.781391 
1 1 1 -1  12 26 o 68.61994 3.195007 57.57387       5.328002 55.48140       8.020215 59.22681       7.128269 67.19289 4.932459 69.51057 4.228206 -2.317688      6.496683 
1 1 1 -1  12 27 o 90.15943 2.887225 99.26733       6.335306 99.10392       8.783469 99.44453       9.146504 89.99063 4.015391 90.12954 4.175743 -0.1389084     5.793116 
1 1 1 -1  12 28 o 95.15252 3.571405 110.7103       8.266544 113.8659       16.13866 109.5879       9.625083 96.03592 6.942880 94.60554 4.185315 1.430382       8.106814 
1 1 1 -1  12 29 o 115.0816 2.948011 161.7424       8.260631 160.2818       11.44708 163.3296       11.93264 114.4351 4.111551 115.5021 4.246688 -1.066978      5.910941 
1 1 1 -1  12 30 o 82.02744 2.977785 82.24874       5.942474 84.49534       8.223317 79.79333       8.596986 83.02586 4.076876 80.63762 4.391517 2.388245       5.992190 
1 1 1 -1  12 31 o 133.6100 3.517756 218.3203       11.44360 218.8314       14.10267 217.3349       19.58103 133.6382 4.336207 132.8244 6.065536 0.8137207      7.456100 
1 1 1 -1  12 32 o 117.9640 3.064681 170.1058       8.802437 157.1875       11.84941 186.0126       13.14880 113.2119 4.302884 123.1537 4.388309 -9.941803      6.145899 
1 1 1 -1  12 33 o 60.74153 3.407130 45.25830       5.023036 38.75475       6.532141 54.66826       7.857308 55.98950 4.834867 66.56135 4.878002 -10.57185      6.868104 
1 1 1 -1  12 34 o 68.45891 3.633294 57.53400       6.039606 56.05925       8.693051 58.91009       8.397213 67.27947 5.346098 69.04267 5.025336 -1.763199      7.337218 
1 1 1 -1  12 35 o 21.96416 7.112926 5.839507       4.346171 4.024633       4.808422 13.94059       10.15900 20.11650 7.425981 33.39041 10.87938 -13.27391      13.17217 
1 1 1 -1  12 36 o 107.2785 3.145912 141.0434       8.215347 134.3748       11.10532 149.1040       12.20954 104.4264 4.373680 109.9555 4.566592 -5.529099      6.323198 
1 1 1 -1  12 37 o 120.2423 3.550335 177.6855       10.39171 174.0379       15.97723 180.3598       13.68075 118.2691 5.559185 120.7742 4.657089 -2.505005      7.252104 
1 1 1 -1  12 38 o 32.62382 5.149329 13.53839       3.958107 13.78279       5.198823 13.20136       6.104941 32.49112 6.785343 31.54633 7.946579 0.9447937      10.44935 
1 1 1 -1  12 39 o 66.35807 4.505539 55.01283       7.242582 29.69714       12.43333 68.01486       8.910425 45.66177 11.24846 73.61338 4.996746 -27.95161      12.30834 
1 1 1 -1  12 40 o 44.29668 4.288867 24.70641       4.571817 19.22931       5.808902 33.62101       7.410874 38.23169 6.465221 50.97582 6.085886 -12.74414      8.879025 
1 1 1 -1  12 41 o 24.59021 6.788939 8.235032       4.201681 8.559163       4.914848 7.354905       8.098835 24.98870 7.485265 24.84264 9.534441 0.1460648      12.12167 
1 1 1 -1  12 42 o 36.61004 5.235593 17.65217       4.538073 15.91903       5.232347 22.91394       9.116877 34.04715 6.544065 38.65374 9.696458 -4.606586      11.69812 
1 1 1 -1  12 43 o 18.35756 6.485201 4.384475       3.617506 5.004564       4.518019 3.276839       6.038368 19.63473 7.206779 19.05379 7.910544 0.5809422      10.70114 
1 1 1 -1  12 44 o 12.62329 5.595243 -0.2692818     3.417826 0.8905755      4.357958 -2.122693      5.508922 14.96308 6.482039 14.41842 6.666225 0.5446634      9.298139 
1 1 1 -1  12 45 o 14.72503 6.303876 1.503208       4.028938 1.317491       4.581232 2.137148       8.464116 15.15943 6.605729 18.57634 8.466978 -3.416910      10.73897 
1 1 1 -1  12 46 o 16.65911 6.696556 3.757993       4.158467 4.168742       6.095082 3.400288       5.687928 17.89744 7.709111 17.15105 7.417638 0.7463894      10.69821 
1 1 1 -1  12 47 o 13.61302 5.903351 1.494784       3.622244 -0.7698437     4.935441 4.138809       5.332863 13.36315 6.223244 16.88387 7.240829 -3.520721      9.547688 
1 1 1 -1  12 48 o 14.30767 6.107471 2.607732       3.762043 3.493897       5.314920 1.717948       5.325762 15.68663 6.963899 14.56608 6.668386 1.120548       9.641746 
1 1 1 -1  12 49 o 11.53022 5.517209 -1.760317      4.397501 4.669909       8.430453 -4.163892      5.154263 16.05151 7.669346 11.30134 5.537041 4.750169       9.459265 
1 1 1 -1  12 50 o 10.65468 5.086169 -1.513787      3.690137 2.236001       5.353180 -4.908947      5.093762 13.86658 6.465563 10.74704 5.311371 3.119541       8.367447 
1 1 1 -1  13 1  o 355.6492 7.640475 1543.535       66.21834 1658.544       97.81393 1446.232       89.97069 368.2071 10.91320 343.8320 10.75109 24.37509       15.31940 
1 1 1 -1  13 2  o 96.78983 2.652507 114.2537       6.250469 107.2207       8.526311 122.4240       9.189943 93.71577 3.740985 100.1482 3.772339 -6.432404      5.312768 
1 1 1 -1  13 3  o 236.9396 5.503028 684.5552       31.77426 684.5552       31.77426 0.000000       0.000000 236.9396 5.503028 ?        ?        0.000000       5.503028 
1 1 1 -1  13 4  o 354.2394 5.379312 1530.021       46.43652 1576.376       66.78231 1486.628       64.61369 359.4413 7.624256 349.0611 7.596036 10.38019       10.76239 
1 1 1 -1  13 5  o 209.6812 3.210142 535.8269       16.40287 531.2535       21.04317 542.9085       26.18513 208.7686 4.136279 211.0255 5.091945 -2.256927      6.560236 
1 1 1 -1  13 6  o 345.7621 5.272950 1457.503       44.42905 1497.439       52.04993 1350.286       85.28418 350.4333 6.095068 332.3505 10.54353 18.08282       12.17850 
1 1 1 -1  13 7  o 206.7590 4.981243 521.1224       25.09795 513.0216       35.47235 529.2429       35.51540 204.9725 7.112409 208.1980 7.010096 -3.225433      9.986381 
1 1 1 -1  13 8  o 561.3497 9.446173 3845.526       129.2187 3728.180       219.8547 3907.456       159.7175 551.6116 16.37371 565.6276 11.58740 -14.01605      20.05907 
1 1 1 -1  13 9  o 470.4970 8.016652 2700.113       91.91492 2744.074       161.6142 2679.095       111.7474 473.5884 14.01912 468.5400 9.787112 5.048401       17.09746 
1 1 1 -1  13 10 o 632.0357 9.146685 4873.797       140.8774 4574.057       270.9600 4984.837       164.9203 610.8195 18.22393 639.0504 10.59017 -28.23083      21.07756 
1 1 1 -1  13 11 o 313.4965 6.979842 1198.425       53.32298 1136.314       73.14503 1268.872       77.89950 304.9881 9.854541 322.2982 9.930223 -17.31018      13.99004 
1 1 1 -1  13 12 o 531.8023 8.961946 3450.515       116.1418 3440.708       142.4354 3469.970       200.6257 530.8664 11.01023 532.3760 15.48081 -1.509644      18.99686 
1 1 1 -1  13 13 o 327.9900 5.801284 1311.543       46.36826 1346.810       81.29822 1294.540       56.45005 332.0231 10.05953 325.8088 7.109931 6.214264       12.31850 
1 1 1 -1  13 14 o 390.2431 5.881635 1856.770       55.93316 1761.515       76.48441 1966.277       82.00690 379.9816 8.259889 401.4518 8.382641 -21.47015      11.76837 
1 1 1 -1  13 15 o 320.0419 4.963569 1248.639       38.71123 1198.517       53.62010 1303.203       55.94582 313.4743 7.019232 326.8779 7.023376 -13.40363      9.929625 
1 1 1 -1  13 16 o 300.2468 5.479069 1099.152       40.08864 1078.217       70.06345 1109.341       48.88079 297.0023 9.693436 301.5869 6.651042 -4.584656      11.75581 
1 1 1 -1  13 17 o 398.1814 5.981640 1933.607       58.04133 1928.688       82.23730 1938.488       81.92924 397.4891 8.489997 398.5023 8.436688 -1.013153      11.96903 
1 1 1 -1  13 18 o 258.5713 4.830501 815.2176       30.43747 799.4130       37.38067 846.3129       52.43279 256.0039 5.991897 263.1563 8.186188 -7.152344      10.14478 
1 1 1 -1  13 19 o 493.4316 7.275515 2972.421       87.48363 2919.012       122.6575 3027.721       124.8117 488.4984 10.30374 497.5132 10.29472 -9.014801      14.56531 
1 1 1 -1  13 20 o 295.4413 4.670717 1064.604       33.62720 1039.885       47.04835 1090.419       48.08055 291.8427 6.615449 298.8510 6.602047 -7.008240      9.346187 
1 1 1 -1  13 21 o 43.09302 3.514965 22.79307       3.659134 24.08817       5.366765 21.66800       5.002059 44.13993 5.082002 41.84328 5.004680 2.296650       7.132570 
1 1 1 -1  13 22 o 278.5266 5.225533 947.0815       35.46773 964.1109       43.58932 913.7170       61.01304 280.8867 6.368143 272.8688 9.188670 8.017944       11.17966 
1 1 1 -1  13 23 o 70.29903 2.842288 60.35636       4.859114 56.53178       6.854784 64.21922       6.888994 67.93634 4.160479 72.44422 3.916824 -4.507881      5.714114 
1 1 1 -1  13 24 o 153.8646 3.140715 288.7626       11.77615 274.2196       16.40989 304.2043       16.90932 149.7899 4.500700 157.7840 4.402017 -7.994171      6.295558 
1 1 1 -1  13 25 o 113.7873 3.198142 158.0831       8.859241 162.1536       14.39653 155.6022       11.23933 115.0585 5.147594 112.8158 4.095016 2.242714       6.577756 
1 1 1 -1  13 26 o 223.1792 3.860342 608.1569       20.99499 601.5058       29.57582 614.9130       29.80833 221.7231 5.473811 224.1835 5.456295 -2.460419      7.728762 
1 1 1 -1  13 27 o 64.86927 3.071058 51.46306       4.840924 51.38737       6.921640 51.53553       6.772981 64.69347 4.416980 64.79850 4.313789 -0.1050262     6.174017 
1 1 1 -1  13 28 f 119.2132 3.586938 173.7205       10.40855 201.0026       20.61186 164.3822       12.05905 127.7634 6.643070 115.8822 4.277659 11.88126       7.901186 
1 1 1 -1  13 29 o 35.57140 4.182505 15.68328       3.556347 16.97560       4.837648 14.16358       5.246003 36.80407 5.567695 33.36251 6.685696 3.441563       8.700446 
1 1 1 -1  13 30 o 69.66859 3.385991 59.43430       5.731343 58.51348       7.070111 61.19921       9.788145 69.03001 4.223141 70.37421 5.757857 -1.344200      7.140577 
1 1 1 -1  13 31 o 96.09917 2.962893 112.8857       6.930309 110.1863       9.544193 115.8964       10.07958 94.79659 4.141519 97.20814 4.265426 -2.411545      5.945253 
1 1 1 -1  13 32 o 112.6912 3.033504 155.2562       8.322917 147.7464       11.35423 163.9776       12.23592 109.7502 4.253431 115.6126 4.350816 -5.862457      6.084511 
1 1 1 -1  13 33 o 44.31726 4.008281 24.25042       4.282043 20.36184       5.574197 29.84887       6.688375 40.24736 5.854964 48.91003 5.719466 -8.662670      8.184918 
1 1 1 -1  13 34 o 139.0588 3.208108 236.5502       10.87135 227.7056       14.93066 246.5304       15.86023 136.0996 4.508020 141.5932 4.602654 -5.493607      6.442567 
1 1 1 -1  13 35 o 68.69983 4.450807 58.24710       7.411170 66.25966       9.126311 42.73125       12.69982 73.13937 5.153439 57.45061 9.395719 15.68876       10.71622 
1 1 1 -1  13 36 o 123.4313 3.546948 187.0538       10.65775 181.0732       16.46523 191.3666       13.98204 120.7532 5.610765 124.5212 4.615763 -3.767982      7.265393 
1 1 1 -1  13 37 f 19.40900 6.507615 4.473165       3.626801 3.074495       4.588513 6.801758       5.920538 18.67215 7.173967 24.02846 8.309791 -5.356314      10.97809 
1 1 1 -1  13 38 o 98.27024 3.156384 118.7998       7.548912 114.1725       10.14100 124.5505       11.30518 95.92415 4.349588 100.0704 4.648623 -4.146217      6.366208 
1 1 1 -1  13 39 o 107.9473 3.953769 144.6909       10.38305 120.6223       18.48313 155.7883       12.55050 95.81554 7.988580 111.6348 4.623453 -15.81925      9.230044 
1 1 1 -1  13 40 o 30.03077 6.128330 11.96356       4.332814 10.89451       5.135930 14.60272       8.069633 28.26167 7.379057 32.03570 9.590210 -3.774027      12.10052 
1 1 1 -1  13 41 o 39.79185 4.379106 20.22482       4.176236 15.78689       5.247680 27.89050       6.896869 34.14302 6.545211 45.74321 6.358825 -11.60019      9.125484 
1 1 1 -1  13 42 o 13.25356 5.685481 0.3134205      3.289563 -2.535416      3.952525 6.734249       5.933848 12.19504 5.641186 22.51354 8.259858 -10.31850      10.00241 
1 1 1 -1  13 43 f 27.73750 5.770021 10.71361       3.772951 13.59831       4.890927 6.474062       5.929253 30.70428 6.723364 21.65115 8.194237 9.053135       10.59949 
1 1 1 -1  13 44 o 13.76552 5.877838 0.9587380      3.486363 0.9867392      4.300689 0.9050657      5.954221 14.84999 6.436158 16.56008 7.360147 -1.710089      9.777316 
1 1 1 -1  13 45 o 33.68810 6.997871 17.89627       5.556892 20.85619       7.003177 12.86476       9.130702 34.64750 8.385671 24.66598 9.920167 9.981524       12.98958 
1 1 1 -1  13 46 o 8.972260 4.414226 -5.592867      3.385171 -7.550263      4.538254 -3.137784      5.082561 10.12169 5.004342 12.60014 6.002103 -2.478443      7.814645 
1 1 1 -1  13 47 o 10.50142 5.009471 -2.652424      3.566479 -0.5187358     4.920601 -5.013957      5.176661 13.35832 6.218603 11.59555 5.652583 1.762776       8.403732 
1 1 1 -1  13 48 o 8.125801 4.062594 -6.940592      3.345112 -3.101330      4.956677 -10.15166      4.533059 11.73128 5.674783 8.972300 4.518938 2.758980       7.254238 
1 1 1 -1  13 49 o 18.55914 7.685457 8.669337       5.679269 0.9684005E-01  8.096815 16.97151       7.968130 14.34295 7.008704 22.32132 9.158978 -7.978371      11.53294 
1 1 1 -1  14 1  o 36.16968 4.095809 16.14983       3.546649 12.30794       4.119846 27.14697       6.970256 31.29987 5.607298 46.76643 6.274308 -15.46656      8.414793 
1 1 1 -1  14 2  f 390.6302 5.863043 1860.519       55.81166 1847.725       78.49030 1873.603       79.37637 389.1530 8.276742 391.8664 8.312221 -2.713348      11.73020 
1 1 1 -1  14 3  o 544.3029 7.934741 3614.218       105.2469 3606.459       148.6072 3622.025       149.0773 543.3889 11.22258 544.5589 11.23390 -1.170044      15.87913 
1 1 1 -1  14 4  o 320.8765 4.431762 1254.990       34.65376 1251.102       54.60989 1257.611       44.83800 320.2919 6.996634 321.1720 5.728915 -0.8800964     9.042863 
1 1 1 -1  14 5  o 653.5839 10.91610 5215.882       173.8622 5097.898       209.7622 5474.841       310.7647 645.8147 13.32856 667.8877 19.11345 -22.07300      23.30182 
1 1 1 -1  14 6  o 218.1206 3.701149 579.8293       19.67295 593.1211       28.09554 567.0433       27.55580 220.5811 5.226764 215.6772 5.242914 4.903961       7.403189 
1 1 1 -1  14 7  o 178.8511 3.843344 389.8466       16.75085 383.7890       29.21401 392.8135       20.44565 177.2820 6.774704 179.4590 4.679185 -2.176987      8.233552 
1 1 1 -1  14 8  o 518.1487 7.592562 3274.240       95.86915 2917.421       178.4889 3418.918       113.6552 488.2258 15.02005 529.3892 8.810043 -41.16342      17.41318 
1 1 1 -1  14 9  o 765.3910 9.835391 7148.885       183.4472 6992.709       285.6859 7258.463       239.3008 756.1252 15.50454 770.8349 12.73934 -14.70972      20.06693 
1 1 1 -1  14 10 f 339.5173 4.652415 1405.017       38.49253 1360.172       59.83054 1436.688       50.27993 333.9677 7.351608 343.2825 6.010450 -9.314728      9.495875 
1 1 1 -1  14 11 o 596.6791 8.649534 4343.427       125.7678 4614.005       261.8538 4262.292       143.3897 613.5428 17.53168 590.9594 9.956900 22.58344       20.16183 
1 1 1 -1  14 12 o 74.43266 3.138566 67.63633       5.680088 62.69021       9.982094 70.00471       6.907408 71.47522 5.780269 75.69595 3.756343 -4.220726      6.893593 
1 1 1 -1  14 13 o 339.6825 5.217763 1406.620       43.19104 1442.591       62.29933 1373.331       59.93214 343.9069 7.433723 335.5547 7.329264 8.352173       10.43927 
1 1 1 -1  14 14 o 307.2034 4.812782 1150.439       36.02950 1149.045       51.19673 1151.807       50.71354 306.9428 6.844609 307.3146 6.771807 -0.3718262     9.628398 
1 1 1 -1  14 15 o 639.4155 10.69082 4994.557       166.5828 4880.721       283.2793 5054.729       205.9570 630.2089 18.46557 642.8300 13.14754 -12.62103      22.66793 
1 1 1 -1  14 16 o 284.5630 4.532659 987.1708       31.43168 1001.439       45.11065 973.7075       43.81967 286.5341 6.460508 282.5434 6.364259 3.990723       9.068735 
1 1 1 -1  14 17 o 146.3341 4.266590 261.2773       15.19842 267.5393       24.23252 257.2167       19.51354 147.9271 6.739960 145.1224 5.527902 2.804718       8.716924 
1 1 1 -1  14 18 o 271.9606 4.389474 901.8208       29.09073 948.9377       42.61177 860.6924       39.81181 278.8737 6.270265 265.5977 6.151081 13.27600       8.783623 
1 1 1 -1  14 19 o 286.3780 4.565728 1000.208       31.86293 1012.914       45.56492 988.0488       44.57341 288.0542 6.491131 284.5017 6.429170 3.552460       9.136138 
1 1 1 -1  14 20 o 167.3585 3.245762 341.4724       13.23734 347.2718       19.09121 336.1026       18.37043 168.6581 4.649484 165.9287 4.547486 2.729370       6.503640 
1 1 1 -1  14 21 o 92.41940 4.763299 104.5077       10.69152 108.8932       15.50860 100.5356       14.75939 94.14451 6.805862 90.44711 6.744901 3.697395       9.581933 
1 1 1 -1  14 22 o 128.8060 2.939989 202.2980       9.228218 190.5410       12.91812 214.5503       13.18739 124.8860 4.250921 132.5419 4.087793 -7.655968      5.897490 
1 1 1 -1  14 23 o 371.6320 5.679056 1688.281       51.43103 1716.063       73.73166 1661.952       71.77667 374.0531 8.088809 368.1346 8.000932 5.918518       11.37733 
1 1 1 -1  14 24 o 231.2077 3.938504 652.5366       22.19063 641.6788       31.30402 663.5037       31.46115 229.0611 5.608061 232.9340 5.542499 -3.872879      7.884773 
1 1 1 -1  14 25 o 120.5190 3.235952 177.3511       9.495119 158.1348       14.93668 190.3825       12.30028 113.5740 5.412407 124.7986 4.049904 -11.22454      6.759872 
1 1 1 -1  14 26 o 54.26715 3.172815 36.05839       4.177527 39.24461       5.972405 33.00616       5.845472 56.50488 4.371346 51.75260 4.685740 4.752285       6.408184 
1 1 1 -1  14 27 o 217.6990 4.494300 579.4466       23.84266 581.4719       43.21376 578.5602       28.58771 217.0688 8.184028 217.3675 5.396953 -0.2987518     9.803336 
1 1 1 -1  14 28 o 21.94738 5.960268 6.102240       3.269382 5.623892       4.492998 6.640553       4.766304 21.90189 7.240549 23.42391 7.435244 -1.522026      10.37827 
1 1 1 -1  14 29 o 38.93920 4.274719 18.76812       3.989691 17.60261       4.940203 20.95380       6.765223 37.48299 5.578192 40.68046 7.081442 -3.197475      9.014602 
1 1 1 -1  14 30 o 70.50785 3.055131 60.82352       5.236866 56.65622       7.192054 65.52654       7.640355 67.89438 4.370143 73.04411 4.311498 -5.149734      6.138987 
1 1 1 -1  14 31 o 19.14874 6.238684 4.356575       3.340661 0.7974169      4.434520 9.026827       5.079760 16.30854 6.775641 26.65095 7.504539 -10.34241      10.11076 
1 1 1 -1  14 32 o 62.38911 3.347525 47.72564       5.070789 47.91179       6.905287 47.50777       7.470358 62.34222 4.577216 62.01033 4.985559 0.3318863      6.768065 
1 1 1 -1  14 33 f 111.0167 3.094716 150.7922       8.364139 146.4438       11.54499 155.5960       12.13436 109.1830 4.347823 112.5301 4.433664 -3.347130      6.209746 
1 1 1 -1  14 34 o 99.39812 3.095931 120.9679       7.489894 124.3244       10.43411 117.3998       10.75793 100.5517 4.267947 97.64877 4.533280 2.902893       6.226234 
1 1 1 -1  14 35 o 154.2048 4.608112 292.9768       17.29695 283.2337       22.36071 307.4925       27.29323 150.9945 6.089479 156.7663 7.163335 -5.771835      9.401869 
1 1 1 -1  14 36 o 62.23035 3.813734 47.76595       5.755696 56.07913       8.725854 41.36317       7.657878 67.06340 5.384538 57.49411 5.534024 9.569294       7.721313 
1 1 1 -1  14 37 o 17.13446 6.367033 2.908517       3.545352 5.245243       4.572688 -0.6132685     5.613699 21.17510 7.303820 16.82651 7.322500 4.348591       10.34238 
1 1 1 -1  14 38 o 60.53999 3.486412 45.32959       5.121727 39.96741       6.775447 52.47898       7.823506 56.39210 4.981593 64.66525 5.003614 -8.273144      7.060625 
1 1 1 -1  14 39 o 29.14116 7.381189 11.46110       5.246584 5.768023       9.543602 13.92691       6.280853 25.20832 10.14070 31.93023 8.069657 -6.721910      12.95967 
1 1 1 -1  14 40 o 16.26765 6.325653 2.402838       3.599139 -4.069161      4.657887 11.99286       5.669953 12.75287 5.973900 29.39112 7.791336 -16.63825      9.817963 
1 1 1 -1  14 41 o 60.38120 3.479889 45.72968       5.098703 44.36853       6.573270 47.78564       8.078616 58.83841 4.621489 60.43419 5.547355 -1.595787      7.220201 
1 1 1 -1  14 42 o 36.10635 4.735857 17.12339       4.066594 16.60415       5.095932 18.03385       6.747887 34.65616 6.264544 34.82417 8.104208 -0.1680069     10.24318 
1 1 1 -1  14 43 o 14.97429 6.157021 1.798513       3.610430 6.785047       4.575698 -6.427514      5.876964 21.51547 7.309465 13.01484 6.266624 8.500630       9.628024 
1 1 1 -1  14 44 o 22.53510 6.675531 7.794865       3.926076 11.12411       4.976016 2.304424       6.390168 26.33496 7.431683 17.62490 7.737772 8.710064       10.72861 
1 1 1 -1  14 45 o 11.81690 5.555066 -2.415944      4.089334 0.9750657      5.757760 -5.867535      5.808964 15.76580 7.104549 12.55028 6.088103 3.215518       9.356260 
1 1 1 -1  14 46 o 28.03757 5.988944 12.25620       3.967578 13.02857       5.457582 11.39043       5.778136 26.50242 7.875553 24.10593 8.213528 2.396486       11.37921 
1 1 1 -1  14 47 o 16.27899 6.467816 4.289404       3.833690 0.9103695      5.361653 7.824049       5.483720 14.36450 6.618108 19.52559 7.742632 -5.161096      10.18566 
1 1 1 -1  14 48 o 16.37628 6.838027 5.010353       4.549560 -2.058684      5.413105 22.01777       8.396254 12.47824 6.009768 26.70749 9.820846 -14.22925      11.51374 
1 1 1 -1  14 49 o 11.47318 5.495691 -1.540192      4.388375 -8.169767      7.719966 1.624685       5.333975 12.03554 6.039456 13.71607 6.414612 -1.680537      8.810351 
1 1 1 -1  15 1  o 600.9944 10.07864 4408.316       147.6075 4458.072       182.1223 4313.060       251.9936 604.1210 12.37095 593.2243 17.45046 10.89667       21.39063 
1 1 1 -1  15 2  o 443.2281 5.884119 2395.007       63.55429 2301.659       97.75415 2463.354       83.64490 434.3246 9.236016 449.4207 7.637483 -15.09613      11.98479 
1 1 1 -1  15 3  o 875.3101 11.22004 9354.381       239.3273 9383.738       379.1121 9334.930       308.5897 875.3387 17.77278 873.8053 14.49208 1.533386       22.93234 
1 1 1 -1  15 4  o 78.90198 2.815299 75.96075       5.404455 73.22199       7.282366 79.31835       8.063255 77.41470 3.872524 80.56718 4.120606 -3.152481      5.654718 
1 1 1 -1  15 5  o 459.4944 6.075588 2574.055       68.03065 2596.922       108.0729 2559.047       87.55441 461.3302 9.613222 458.0645 7.843596 3.265656       12.40710 
1 1 1 -1  15 6  o 235.2509 3.504339 674.4540       20.08970 650.9776       31.01250 691.4288       26.37082 231.0878 5.507109 238.1774 4.543464 -7.089615      7.139420 
1 1 1 -1  15 7  o 572.0750 6.793437 3990.501       94.70623 4048.802       135.2735 3934.451       132.6352 576.0272 9.636816 567.8389 9.585116 8.188293       13.59201 
1 1 1 -1  15 8  f 538.7866 7.041569 3539.847       92.45327 3508.774       145.5218 3560.878       119.7198 536.0970 11.13906 540.2415 9.093727 -4.144531      14.37966 
1 1 1 -1  15 9  o 483.9743 6.374339 2855.894       75.17848 2827.296       118.3788 2875.224       97.32384 481.3017 10.09300 485.5010 8.226081 -4.199310      13.02064 
1 1 1 -1  15 10 o 566.6472 8.244455 3916.895       113.8442 3901.688       226.9585 3922.008       131.5973 564.3094 16.52193 566.9054 9.525775 -2.595947      19.07130 
1 1 1 -1  15 11 o 195.4897 3.125005 465.7266       14.88711 458.9406       23.94253 470.0038       19.00836 193.9659 5.069686 196.3745 3.972129 -2.408615      6.440461 
1 1 1 -1  15 12 o 216.1307 3.318477 569.2877       17.47799 561.4319       27.86052 574.3856       22.44375 214.5981 5.327547 217.0815 4.242643 -2.483444      6.810490 
1 1 1 -1  15 13 o 481.7164 8.219721 2831.421       96.49051 2858.755       169.3928 2818.292       117.3987 483.1162 14.40431 480.4322 10.02756 2.683990       17.55096 
1 1 1 -1  15 14 o 396.4409 5.973172 1916.561       57.70582 1884.648       81.02200 1949.414       82.20763 392.9630 8.460872 399.6597 8.440842 -6.696625      11.95132 
1 1 1 -1  15 15 o 246.3698 4.089463 739.8961       24.55217 707.1005       34.21884 774.6941       35.24806 240.7935 5.831554 252.0435 5.738834 -11.24994      8.181763 
1 1 1 -1  15 16 o 652.7842 10.92222 5210.876       173.7467 5317.315       216.3884 5017.732       291.4915 658.7980 13.47862 638.0684 18.76700 20.72968       23.10571 
1 1 1 -1  15 17 o 302.8325 4.769900 1118.326       35.20042 1105.777       49.75642 1130.899       49.80544 301.0020 6.783340 304.4072 6.714068 -3.405121      9.544234 
1 1 1 -1  15 18 o 269.1541 4.360659 883.4336       28.60153 861.0760       40.13895 906.4948       40.76567 265.6122 6.201287 272.5320 6.138201 -6.919739      8.725450 
1 1 1 -1  15 19 o 320.6300 4.999430 1254.308       39.06256 1251.368       55.49194 1257.196       54.99701 320.0314 7.115432 320.7856 7.035388 -0.7542419     10.00630 
1 1 1 -1  15 20 o 181.4361 4.028486 401.5305       17.81155 404.7509       21.61714 394.7217       31.43277 182.0519 4.877061 179.5380 7.198992 2.513977       8.695472 
1 1 1 -1  15 21 o 406.1326 7.128331 2017.954       70.54914 2044.258       86.86694 1966.988       120.9180 408.3563 8.729296 399.1251 12.44735 9.231201       15.20320 
1 1 1 -1  15 22 o 231.6514 3.943273 654.8317       22.26014 687.5626       32.58189 626.1802       30.48392 237.1842 5.637084 226.3629 5.526237 10.82130       7.894049 
1 1 1 -1  15 23 o 221.9913 3.838644 601.4541       20.76586 594.1121       29.40109 608.7625       29.33374 220.4426 5.473080 223.1549 5.394175 -2.712234      7.684512 
1 1 1 -1  15 24 o 113.0581 3.191446 156.0710       8.783962 145.7917       14.12767 162.5490       11.21532 109.0584 5.332042 115.3147 3.997128 -6.256233      6.663911 
1 1 1 -1  15 25 o 175.2823 3.356961 374.9580       14.33905 379.1665       20.53494 370.9533       20.03138 176.0517 4.790946 174.1426 4.724666 1.909012       6.728716 
1 1 1 -1  15 26 o 176.4397 3.385975 380.0184       14.55848 369.7922       20.44750 390.5321       20.73307 173.8163 4.832093 178.6384 4.766955 -4.822113      6.787708 
1 1 1 -1  15 27 o 124.8408 3.587591 190.5006       10.90297 179.0445       20.45466 195.0474       12.88621 120.4848 6.996747 126.2502 4.194309 -5.765381      8.157616 
1 1 1 -1  15 28 o 130.8636 3.420280 209.3075       10.89793 208.3134       13.71605 211.0096       17.94746 130.4324 4.321229 131.0507 5.633040 -0.6182861     7.099588 
1 1 1 -1  15 29 o 212.9033 3.802804 554.1347       19.72979 560.6503       28.10273 547.8019       27.70577 213.7242 5.400162 211.2636 5.385968 2.460617       7.626953 
1 1 1 -1  15 30 o 56.11622 3.416109 38.62579       4.649368 40.63179       6.423215 36.41801       6.738509 57.40525 4.630879 54.24529 5.159659 3.159962       6.933046 
1 1 1 -1  15 31 o 155.2272 3.291647 294.5033       12.45137 289.5434       17.49595 299.5934       17.72406 153.6018 4.679636 156.2518 4.660017 -2.650040      6.604147 
1 1 1 -1  15 32 o 51.81643 3.651753 33.01821       4.581573 28.58305       6.104793 38.73755       6.932490 47.92737 5.316300 55.91294 5.145596 -7.985569      7.398662 
1 1 1 -1  15 33 o 114.3408 3.110043 160.0020       8.657656 151.2834       11.87242 169.9037       12.65231 110.9333 4.400519 117.5665 4.424106 -6.633263      6.239974 
1 1 1 -1  15 34 o 52.46066 3.749259 33.90726       4.761489 39.16304       6.559685 28.05405       6.922478 56.20665 4.836134 47.21588 6.163397 8.990772       7.834262 
1 1 1 -1  15 35 o 67.32936 4.492158 56.06807       7.328315 56.06363       9.125793 56.07612       12.29719 67.04278 5.637949 66.38214 7.747321 0.6606369      9.581621 
1 1 1 -1  15 36 o 18.68864 6.516136 3.950559       3.644064 2.194213       4.844256 6.239895       5.530659 18.10206 7.244421 23.14082 8.030035 -5.038759      10.81495 
1 1 1 -1  15 37 f 54.70057 4.046922 37.15006       5.356316 39.00590       7.874352 35.55187       7.307336 55.48784 5.914518 53.00457 5.749269 2.483269       8.248371 
1 1 1 -1  15 38 o 50.55689 3.820863 31.81177       4.672521 31.30459       6.298054 32.43268       6.968593 49.68086 5.283049 50.38734 5.779793 -0.7064781     7.830493 
1 1 1 -1  15 39 o 76.55043 4.927999 74.12637       9.144101 80.13734       14.50966 70.16623       11.77716 77.55196 7.782736 73.37236 6.659218 4.179596       10.24286 
1 1 1 -1  15 40 f 58.85098 3.602174 43.36052       5.141252 40.25997       6.782207 47.54919       7.882980 55.99839 5.023350 60.66314 5.388490 -4.664749      7.366808 
1 1 1 -1  15 41 o 31.62941 5.186541 13.24828       3.859216 11.03437       4.946731 16.69136       6.168956 27.87279 7.224168 34.18430 7.601970 -6.311502      10.48707 
1 1 1 -1  15 42 o 12.79435 5.654488 -0.3762977     3.465804 0.4982232      4.408947 -1.790669      5.607013 14.98846 6.506298 15.04184 6.869510 -0.5337811E-01 9.461611 
1 1 1 -1  15 43 o 21.04266 6.684654 6.539666       3.851912 8.437778       4.829518 3.221340       6.385612 23.35320 7.492248 18.65576 7.960087 4.697447       10.93146 
1 1 1 -1  15 44 o 31.82807 6.277925 15.17096       4.696192 15.35286       6.811805 15.00618       6.483209 29.05780 8.835874 29.06829 8.569917 -0.1048470E-01 12.30919 
1 1 1 -1  15 45 o 20.58482 7.181696 7.115102       4.426873 7.011894       5.218472 7.380006       8.360434 20.23489 7.680702 20.49859 8.928102 -0.2637005     11.77727 
1 1 1 -1  15 46 o 23.92007 6.689484 9.765029       4.050885 7.766959       5.696251 11.80945       5.761946 20.01321 7.905369 24.15816 8.202473 -4.144945      11.39190 
1 1 1 -1  15 47 o 15.04528 6.218352 3.348677       3.708152 3.125581       5.156403 3.587627       5.336469 15.42009 6.851640 15.80173 6.998436 -0.3816395     9.794033 
1 1 1 -1  15 48 o 13.86489 6.301567 1.928672       4.646611 4.092125       8.094079 0.8651975      5.674885 15.93119 7.584773 13.83275 6.515508 2.098443       9.999031 
1 1 1 -1  16 1  o 943.5126 13.51067 10877.61       310.6423 10230.75       420.7585 11652.64       460.5644 913.7928 18.89509 975.0874 19.38254 -61.29456      27.06857 
1 1 1 -1  16 2  o 787.6927 16.03571 7590.236       307.8088 7927.918       448.1472 7288.660       423.5115 803.0358 22.92421 770.0516 22.59327 32.98413       32.18657 
1 1 1 -1  16 3  o 158.9377 4.530695 308.1425       17.53011 336.7273       25.70442 283.2871       23.96909 166.0661 6.363485 152.2921 6.473360 13.77403       9.077353 
1 1 1 -1  16 4  o 244.0693 4.675909 726.0747       27.81091 720.7842       33.78704 737.1907       48.97474 243.1581 5.701975 245.7073 8.190784 -2.549149      9.980054 
1 1 1 -1  16 5  o 559.8501 7.315524 3822.252       99.80523 3640.739       152.2528 3959.021       132.1617 546.0593 11.44167 569.6103 9.521201 -23.55096      14.88506 
1 1 1 -1  16 6  o 166.9429 2.875389 339.6255       11.69771 344.1643       18.55435 336.6314       15.07000 167.9767 4.536891 166.1979 3.720931 1.778854       5.867599 
1 1 1 -1  16 7  o 1105.652 12.88657 14936.33       347.2100 15531.72       504.3085 14399.76       478.7463 1125.868 18.38116 1084.150 18.12091 41.71790       25.81152 
1 1 1 -1  16 8  o 147.4890 3.132667 265.0935       11.25926 258.9655       16.10950 270.9458       15.74284 145.6900 4.543049 149.0334 4.339363 -3.343445      6.282465 
1 1 1 -1  16 9  o 685.7224 9.897310 5739.449       165.3871 5895.656       336.7703 5689.801       189.8591 692.8346 19.96740 682.5511 11.41458 10.28351       22.99977 
1 1 1 -1  16 10 o 186.0910 3.399265 422.0387       15.41510 416.8650       22.28563 426.7849       21.34526 184.8579 4.951560 187.0573 4.686328 -2.199478      6.817597 
1 1 1 -1  16 11 o 447.9006 5.954278 2446.134       64.99005 2622.209       108.0487 2346.320       81.35132 463.4786 9.566514 438.5677 7.611879 24.91095       12.22534 
1 1 1 -1  16 12 o 137.0330 3.012453 228.8457       10.05962 209.2635       21.27854 234.4820       11.41592 130.8170 6.697140 138.7067 3.377361 -7.889771      7.500550 
1 1 1 -1  16 13 o 663.3625 8.588254 5371.323       138.8327 5150.874       213.4605 5532.939       182.7710 648.7584 13.50201 672.8589 11.14672 -24.10046      17.50867 
1 1 1 -1  16 14 o 274.2262 4.432078 916.7580       29.61778 942.5988       42.95735 893.3438       40.89075 277.9869 6.341282 270.6329 6.200238 7.354004       8.868755 
1 1 1 -1  16 15 o 463.1262 7.931984 2618.544       89.51942 2520.435       107.5131 2840.304       161.6404 454.1441 9.714746 481.1862 13.79906 -27.04208      16.87573 
1 1 1 -1  16 16 o 269.8401 4.374741 887.8275       28.76702 894.1378       41.32144 881.8928       40.07272 270.6962 6.264080 268.8453 6.116602 1.850830       8.755085 
1 1 1 -1  16 17 o 131.5460 3.008621 210.9299       9.644531 210.0827       14.07143 211.6805       13.24492 131.1770 4.408205 131.6914 4.132318 -0.5143433     6.042211 
1 1 1 -1  16 18 o 320.6585 5.009341 1254.541       39.14348 1290.998       56.69384 1221.329       54.11093 325.0535 7.157230 316.1774 7.022926 8.876099       10.02733 
1 1 1 -1  16 19 o 223.2824 3.861023 608.0492       21.00840 559.5694       28.72099 663.8362       30.80957 214.0177 5.511570 233.1900 5.421751 -19.17236      7.731287 
1 1 1 -1  16 20 o 93.61788 3.516406 107.0428       8.007950 100.9818       9.358195 123.6184       15.47588 90.87444 4.237520 100.3658 6.360234 -9.491394      7.642588 
1 1 1 -1  16 21 o 129.0072 2.966516 202.9530       9.326033 211.3399       13.75295 195.8133       12.68919 131.5161 4.296989 126.6023 4.118454 4.913704       5.951956 
1 1 1 -1  16 22 f 442.8170 6.633080 2400.805       71.57735 2442.759       102.6735 2361.136       99.83739 445.5601 9.456184 438.1000 9.351556 7.460144       13.29929 
1 1 1 -1  16 23 o 415.7461 7.214225 2119.713       73.08933 2062.267       123.5583 2150.634       90.65034 407.2922 12.46352 418.0642 8.897959 -10.77197      15.31382 
1 1 1 -1  16 24 o 145.2696 3.125336 257.4799       11.06388 245.4062       15.59340 269.7201       15.70053 141.6464 4.523311 148.5261 4.342522 -6.879715      6.270394 
1 1 1 -1  16 25 o 57.25428 3.110804 40.11880       4.323967 39.87627       6.232478 40.34388       6.003947 56.93891 4.529043 57.29655 4.332135 -0.3576355     6.267346 
1 1 1 -1  16 26 o 150.2790 3.776708 276.0336       13.81985 289.4583       26.46051 270.9980       16.20579 153.2926 7.102691 148.8070 4.474085 4.485611       8.394382 
1 1 1 -1  16 27 o 78.22646 3.580449 74.90477       6.807289 84.91700       14.58857 72.11802       7.696557 82.73603 7.310875 76.69499 4.133337 6.041039       8.398415 
1 1 1 -1  16 28 o 108.7756 3.279888 144.6396       8.684205 153.2919       11.34451 132.3932       13.49657 111.8743 4.168496 103.7765 5.355002 8.097847       6.786192 
1 1 1 -1  16 29 o 42.50456 3.853899 22.27267       3.948487 24.60786       5.674670 20.08098       5.497549 44.47157 5.343158 40.02615 5.805476 4.445415       7.890049 
1 1 1 -1  16 30 o 202.7989 3.725556 503.0175       18.41165 505.8207       26.23831 500.2982       25.84223 202.8996 5.311193 201.8046 5.259364 1.095093       7.474602 
1 1 1 -1  16 31 o 151.2507 3.275821 279.6638       12.07407 278.3219       17.06793 281.0081       17.08270 150.5633 4.657449 151.2934 4.638887 -0.7300568     6.573515 
1 1 1 -1  16 32 o 62.19559 3.360699 47.45761       5.074686 42.93643       6.970434 52.55655       7.402411 58.91445 4.899442 65.25948 4.685912 -6.345032      6.779551 
1 1 1 -1  16 33 o 94.80408 3.082899 110.0482       7.112865 109.5846       9.920553 110.5388       10.20364 94.38172 4.324816 94.77029 4.430478 -0.3885727     6.191379 
1 1 1 -1  16 34 o 107.7766 4.322755 143.0390       11.33024 153.9261       14.77361 127.4901       17.65557 111.4663 5.455420 100.7771 7.237446 10.68915       9.063235 
1 1 1 -1  16 35 o 16.72870 6.341782 2.542701       3.554944 2.992671       4.802708 1.997405       5.287015 18.89246 7.317985 18.55037 7.517179 0.3420887      10.49099 
1 1 1 -1  16 36 o 73.85546 3.249574 67.10648       5.834192 54.10265       7.835818 83.28285       8.739553 65.87653 4.916554 81.98074 4.390646 -16.10421      6.591682 
1 1 1 -1  16 37 o 14.31225 6.053232 0.3692064      3.637364 2.544872       4.951234 -2.181680      5.361211 18.44178 7.342739 15.27773 6.872578 3.164059       10.05724 
1 1 1 -1  16 38 o 34.03280 6.328354 15.21355       5.055248 11.30923       6.659550 20.52250       7.765633 28.84945 8.729108 38.73782 8.463529 -9.888369      12.15848 
1 1 1 -1  16 39 o 25.30285 7.617959 8.705224       5.081076 21.39936       10.40764 4.732836       5.822059 37.80626 10.77465 21.11515 8.088958 16.69111       13.47310 
1 1 1 -1  16 40 o 25.87103 6.062047 9.089877       3.754609 8.688906       5.051094 9.584999       5.612864 24.95027 7.613087 26.04906 8.039626 -1.098789      11.07225 
1 1 1 -1  16 41 o 32.15053 5.309045 13.82786       4.014441 16.60808       5.328192 10.17741       6.105397 34.54302 6.569719 26.17286 8.426568 8.370163       10.68495 
1 1 1 -1  16 42 o 26.65049 5.991288 10.04251       3.796158 14.37066       5.063136 4.485741       5.736932 31.44328 6.805571 19.59139 7.868865 11.85188       10.40360 
1 1 1 -1  16 43 o 12.55440 5.775888 -1.605011      4.063365 -0.4889759     5.552534 -2.891825      5.962249 15.21466 6.904582 14.39116 6.746924 0.8235025      9.653717 
1 1 1 -1  16 44 o 34.15884 5.062076 16.46746       4.086405 10.92577       5.616191 22.70202       5.956952 24.87575 8.087958 38.50744 6.584535 -13.63169      10.42934 
1 1 1 -1  16 45 o 29.15998 7.022882 14.16839       4.930631 18.84700       5.907466 3.424861       8.951926 33.21688 7.478731 18.28970 8.470678 14.92718       11.29973 
1 1 1 -1  16 46 o 36.88021 5.103792 20.28219       4.464128 30.95507       6.569509 11.12621       6.084779 43.55486 6.378592 22.60842 8.352243 20.94644       10.50935 
1 1 1 -1  16 47 o 9.502313 4.777750 -10.17790      4.954092 -20.41307      7.465728 -2.125010      6.622169 10.19598 5.202335 13.48734 6.532628 -3.291363      8.351019 
1 1 1 -1  16 48 o 17.29493 6.668604 6.047775       3.974796 12.59311       5.793725 0.2278542      5.463243 22.18786 8.158172 13.26062 6.289713 8.927232       10.30127 
1 1 1 -1  17 1  o 630.0291 10.55525 4845.291       162.0560 4874.992       199.2529 4787.254       278.5332 631.6670 12.94436 624.8369 18.31231 6.830078       22.42536 
1 1 1 -1  17 2  o 506.7315 7.460200 3131.554       92.12223 3226.798       132.5423 3042.545       128.1307 514.1417 10.57878 499.2511 10.53169 14.89066       14.92739 
1 1 1 -1  17 3  o 388.5247 5.875048 1840.318       55.62450 1882.533       79.75668 1800.338       77.61682 392.8416 8.331315 384.1719 8.290755 8.669617       11.75361 
1 1 1 -1  17 4  o 461.8567 6.123219 2600.736       68.91650 2698.879       111.6396 2540.309       87.59995 470.2621 9.741870 456.3649 7.876904 13.89719       12.52796 
1 1 1 -1  17 5  o 39.35581 3.696241 19.04308       3.503416 18.46954       5.191219 19.52278       4.747604 38.50725 5.704389 39.70464 5.018711 -1.197392      7.597863 
1 1 1 -1  17 6  o 1020.025 14.58508 12725.23       362.5396 12510.77       506.5869 12950.38       519.0575 1009.507 20.59248 1027.035 20.73930 -17.52814      29.22617 
1 1 1 -1  17 7  o 194.0191 4.030042 458.8017       19.05418 519.2388       34.15773 431.4996       22.95807 206.2338 6.805944 188.0757 5.013650 18.15808       8.453258 
1 1 1 -1  17 8  o 275.4652 4.433461 924.9173       29.76088 888.8683       58.54999 937.4760       34.55822 269.7424 8.919471 277.3118 5.113837 -7.569397      10.28145 
1 1 1 -1  17 9  o 156.9924 3.193359 300.3675       12.21694 269.4861       24.51683 310.5688       14.09106 148.4946 6.793121 159.6314 3.622338 -11.13683      7.698560 
1 1 1 -1  17 10 o 177.4030 3.014860 383.5422       13.03360 405.3237       21.66279 371.1838       16.31742 182.2767 4.881332 174.5109 3.837008 7.765762       6.208868 
1 1 1 -1  17 11 o 212.9301 3.726559 552.6130       19.33665 607.6614       42.15205 537.9412       21.76147 223.0284 7.767583 210.0742 4.250886 12.95416       8.854681 
1 1 1 -1  17 12 o 509.1622 6.703371 3162.417       83.17361 3027.465       128.0236 3260.977       109.4083 497.7559 10.55450 516.8334 8.686876 -19.07748      13.66965 
1 1 1 -1  17 13 o 176.0128 2.989099 377.5780       12.82097 375.8368       20.83930 378.6385       16.26309 175.5013 4.877394 176.2461 3.786583 -0.7447968     6.174722 
1 1 1 -1  17 14 o 407.0197 6.105307 2021.036       60.55625 2045.338       86.88233 1998.076       84.44846 409.1974 8.712895 404.4589 8.568035 4.738495       12.21989 
1 1 1 -1  17 15 o 221.6349 3.772566 598.8591       20.37563 635.0059       30.66046 570.2690       27.26795 228.1534 5.514620 216.2264 5.174967 11.92696       7.562494 
1 1 1 -1  17 16 o 298.9426 4.742745 1090.035       34.55045 1070.896       48.75631 1109.341       48.96780 296.1457 6.755995 301.4231 6.666502 -5.277405      9.491349 
1 1 1 -1  17 17 o 170.8868 3.320050 356.0327       13.82576 337.0764       19.59801 374.8143       19.50747 166.1472 4.845595 175.2285 4.572263 -9.081284      6.662236 
1 1 1 -1  17 18 o 156.8850 3.865044 300.1923       14.77652 294.9796       17.72904 312.0515       26.74125 155.4104 4.686681 159.6347 6.890368 -4.224213      8.333196 
1 1 1 -1  17 19 o 224.9802 4.569510 617.7487       25.05244 635.0241       30.85285 584.3125       42.92297 228.0147 5.552598 218.2767 8.083459 9.738052       9.806817 
1 1 1 -1  17 20 o 122.8954 2.960503 184.1766       8.866197 178.3026       12.84313 189.5249       12.25493 120.7827 4.370657 124.5575 4.042783 -3.774849      5.953717 
1 1 1 -1  17 21 o 391.6967 5.951180 1876.613       56.80534 1906.975       81.53926 1847.980       79.18233 394.0710 8.490948 387.9683 8.375214 6.102722       11.92646 
1 1 1 -1  17 22 o 122.2412 3.263752 182.4383       9.713644 200.5319       17.05746 173.7546       11.81687 127.9371 5.483922 119.2265 4.073164 8.710670       6.831110 
1 1 1 -1  17 23 o 108.2481 2.905385 143.0390       7.657151 143.5172       11.21011 142.6207       10.48402 108.3141 4.255344 108.0006 3.990366 0.3134232      5.833607 
1 1 1 -1  17 24 o 263.2707 4.338708 846.9177       27.83550 857.0667       39.88977 837.2853       38.86108 264.4565 6.189723 261.4084 6.100413 3.048187       8.690668 
1 1 1 -1  17 25 o 174.1996 3.387240 370.4666       14.37902 376.3827       20.72175 364.9725       19.96913 175.3384 4.854354 172.6757 4.750118 2.662704       6.791788 
1 1 1 -1  17 26 o 148.3767 3.752275 269.1340       13.55651 279.3409       26.12532 265.3730       15.85866 150.5237 7.142681 147.2409 4.424813 3.282852       8.402194 
1 1 1 -1  17 27 o 37.19722 4.416117 17.16322       3.924987 14.77544       5.286387 20.09655       5.859249 34.10056 6.600118 39.98862 6.214403 -5.888054      9.065338 
1 1 1 -1  17 28 o 82.06356 2.956776 82.33043       5.903295 79.49470       8.424406 85.06624       8.274647 80.48299 4.311086 83.29247 4.089189 -2.809486      5.941964 
1 1 1 -1  17 29 o 136.6151 3.154441 228.0005       10.50164 225.1700       14.98026 230.7357       14.72613 135.5003 4.543156 137.1920 4.410505 -1.691711      6.331890 
1 1 1 -1  17 30 o 124.3556 3.077101 188.9484       9.324876 173.8590       12.84490 205.7617       13.55877 119.0277 4.436158 129.5290 4.301501 -10.50128      6.179191 
1 1 1 -1  17 31 o 83.67980 3.148656 85.72138       6.409242 78.05674       8.890327 94.01577       9.248343 79.62833 4.601161 87.45873 4.353031 -7.830399      6.334001 
1 1 1 -1  17 32 o 91.04285 3.123179 101.4900       6.918872 98.49533       9.612247 104.7097       9.966914 89.46770 4.422529 92.24855 4.446784 -2.780853      6.271575 
1 1 1 -1  17 33 o 51.33247 4.147059 32.55645       5.143497 25.66369       7.597873 38.38758       6.988305 44.86071 7.193082 55.55907 5.222812 -10.69836      8.889217 
1 1 1 -1  17 34 o 137.4973 3.816718 232.3333       12.77615 229.1236       15.17477 240.1481       23.67791 136.2899 4.575499 138.3894 7.044259 -2.099487      8.399808 
1 1 1 -1  17 35 f 71.90182 3.304788 63.57980       5.775061 59.62476       8.018292 67.84284       8.324660 69.27293 4.779167 73.95197 4.642776 -4.679047      6.663018 
1 1 1 -1  17 36 o 73.32002 3.284703 66.22474       5.853972 62.50299       8.101043 70.29198       8.468726 70.81264 4.721523 75.13816 4.647856 -4.325516      6.625356 
1 1 1 -1  17 37 o 16.67116 6.578868 2.185893       3.941552 5.205471       5.021331 -2.661389      6.362018 21.28714 7.627940 16.46317 7.438872 4.823975       10.65468 
1 1 1 -1  17 38 f 34.89879 4.905248 15.60528       4.056663 11.00869       5.372371 21.70271       6.187590 28.41711 7.607414 40.61589 6.468312 -12.19878      9.985579 
1 1 1 -1  17 39 o 58.37883 5.253543 43.90166       7.393980 0.000000       0.000000 43.90166       7.393980 ?        ?        58.37883 5.253543 0.000000       5.253543 
1 1 1 -1  17 40 o 37.53188 4.622926 18.25448       4.138935 16.57062       5.503331 20.44710       6.279925 34.60950 6.767801 38.40941 6.965798 -3.799915      9.712130 
1 1 1 -1  17 41 o 23.18262 6.348269 7.615372       3.690977 7.481284       4.744726 7.820874       5.873855 22.76680 7.436188 23.24804 8.258914 -0.4812355     11.11335 
1 1 1 -1  17 42 o 13.77194 5.897210 0.7922530      3.527374 5.904344       4.694821 -5.834126      5.345126 20.30581 7.362749 12.44121 5.986839 7.864605       9.489590 
1 1 1 -1  17 43 f 21.96974 7.219055 7.698206       4.468748 9.081340       6.347688 6.339147       6.292204 22.93417 8.520022 20.42712 8.228181 2.507048       11.84457 
1 1 1 -1  17 44 o 13.48195 5.752674 1.264770       3.335245 -0.7753734     4.807568 3.157719       4.630891 13.70468 6.296854 16.45671 6.887197 -2.752030      9.331874 
1 1 1 -1  17 45 o 14.63617 6.422678 1.745146       4.398036 0.8611439      5.253047 3.817305       8.042597 14.72993 6.696861 17.79236 8.163707 -3.062428      10.55907 
1 1 1 -1  17 46 o 15.55127 7.050413 2.643212       5.772292 3.143723       9.103119 2.306632       7.464968 16.86158 8.032211 16.06452 7.537174 0.7970638      11.01478 
1 1 1 -1  17 47 o 11.77828 5.468651 -0.3390186     3.766630 -0.9648602     5.305186 0.2971364      5.348721 12.86482 6.129296 13.49503 6.346818 -0.6302156     8.823286 
1 1 1 -1  17 48 o 15.62579 6.520931 4.662896       4.133905 17.87135       6.272746 -5.478163      5.496338 26.53295 8.541160 11.07437 5.481135 15.45858       10.14861 
1 1 1 -1  18 1  o 909.7237 15.07580 10125.50       334.2151 10350.70       415.5438 9712.965       562.4193 918.8105 18.55901 887.0153 26.04736 31.79523       31.98283 
1 1 1 -1  18 2  o 415.7295 5.587040 2107.055       56.60160 2163.431       90.82777 2071.260       72.37293 421.0729 8.851670 412.1051 7.206628 8.967865       11.41436 
1 1 1 -1  18 3  o 744.8814 9.599816 6772.067       174.2554 6653.945       272.2669 6854.023       226.7884 737.4201 15.15109 748.9441 12.42611 -11.52399      19.59499 
1 1 1 -1  18 4  o 396.6815 6.003386 1918.602       58.03291 2044.530       121.4414 1881.335       66.06422 408.8783 12.20177 392.7672 6.902319 16.11115       14.01874 
1 1 1 -1  18 5  o 688.8400 8.906042 5790.381       149.4993 5930.654       240.0103 5701.455       191.0994 696.3240 14.14433 683.1849 11.47849 13.13910       18.21587 
1 1 1 -1  18 6  o 250.7976 4.135710 766.6575       25.27608 773.9374       50.03924 764.1637       29.28705 251.7289 8.168019 250.3746 4.800090 1.354370       9.474038 
1 1 1 -1  18 7  o 531.6457 6.967539 3447.392       90.26882 3421.816       142.0022 3464.735       116.9364 529.2690 11.00988 532.8004 9.006358 -3.531433      14.22435 
1 1 1 -1  18 8  o 240.5566 4.704768 705.4279       27.57983 752.7271       50.18959 684.9666       33.01056 248.2239 8.308958 237.0147 5.715333 11.20918       10.08483 
1 1 1 -1  18 9  o 593.5759 8.650510 4300.554       125.1279 4239.071       248.6904 4321.394       144.7903 587.4941 17.38992 594.8377 9.988604 -7.343567      20.05446 
1 1 1 -1  18 10 o 359.1824 5.510538 1573.158       48.23310 1619.223       99.28918 1558.930       55.18163 363.7904 11.21330 357.5100 6.333887 6.280457       12.87852 
1 1 1 -1  18 11 o 408.4370 5.506517 2034.350       54.80726 2120.861       89.75999 1982.923       69.20627 416.7516 8.838314 403.1322 7.044688 13.61935       11.30236 
1 1 1 -1  18 12 o 219.5355 3.416534 587.4566       18.27792 583.1188       29.37167 590.1981       23.34998 218.5893 5.518373 220.0218 4.354964 -1.432571      7.029805 
1 1 1 -1  18 13 o 246.4643 4.669005 740.7277       28.04235 730.6332       49.24475 745.5719       34.11366 244.4323 8.279279 247.2227 5.662443 -2.790390      10.03044 
1 1 1 -1  18 14 o 359.6098 4.927091 1577.309       43.17757 1583.456       68.96381 1573.347       55.37357 360.0234 7.860577 359.0377 6.328874 0.9857178      10.09175 
1 1 1 -1  18 15 o 242.6793 3.629462 718.0542       21.46402 695.2885       33.90574 733.2790       27.72732 238.6773 5.829428 245.1874 4.640595 -6.510040      7.450996 
1 1 1 -1  18 16 o 278.7892 4.016926 947.9117       27.29015 928.3428       43.22272 960.8843       35.19175 275.6931 6.433541 280.6056 5.146460 -4.912445      8.238719 
1 1 1 -1  18 17 o 64.07510 4.038691 50.27890       6.274095 48.33194       7.396562 55.27343       11.84675 62.74227 4.875889 66.82393 7.398772 -4.081657      8.860932 
1 1 1 -1  18 18 o 209.2925 4.402669 534.5587       22.45462 513.3651       26.70838 585.6569       41.47134 204.9555 5.352093 218.5641 7.798836 -13.60861      9.458686 
1 1 1 -1  18 19 o 206.3742 3.685744 519.6078       18.53603 531.3491       26.98954 509.1256       25.50152 208.4809 5.316767 204.0950 5.131475 4.385925       7.389185 
1 1 1 -1  18 20 o 132.8136 3.026983 215.1408       9.796902 213.4325       14.36241 216.6273       13.39767 132.1331 4.466881 133.1507 4.134055 -1.017624      6.086332 
1 1 1 -1  18 21 o 345.6216 6.142938 1462.160       51.73842 1483.465       90.17718 1451.706       63.16988 346.3699 10.69649 343.9877 7.535830 2.382263       13.08448 
1 1 1 -1  18 22 o 90.09417 2.884102 99.11177       6.323879 100.3538       9.526496 98.13329       8.455600 90.53747 4.330416 89.57010 3.883097 0.9673691      5.816438 
1 1 1 -1  18 23 f 185.4882 3.491419 419.9728       15.78172 438.7307       23.20539 403.8310       21.52651 189.3355 5.033917 181.6701 4.866821 7.665421       7.001876 
1 1 1 -1  18 24 o 117.8072 2.958815 169.4558       8.487541 170.4215       12.45998 168.6198       11.59323 118.0013 4.340455 117.4081 4.058107 0.5931854      5.942035 
1 1 1 -1  18 25 o 132.1738 3.623754 213.5356       11.66085 206.3655       22.02538 216.3281       13.74525 129.3716 7.012531 132.9577 4.247767 -3.586044      8.198727 
1 1 1 -1  18 26 o 93.17809 4.075537 106.3496       9.231728 85.65822       15.08380 118.7422       11.67339 83.03293 7.536614 98.35798 4.885543 -15.32505      8.981597 
1 1 1 -1  18 27 o 118.5744 2.999218 171.7723       8.659372 180.9719       12.78765 163.9810       11.76818 121.5371 4.324526 115.7049 4.180574 5.832222       6.014876 
1 1 1 -1  18 28 o 63.91655 3.193353 50.02951       4.958138 42.14832       6.976559 58.07229       7.047716 58.42907 4.946202 68.75345 4.226903 -10.32438      6.506275 
1 1 1 -1  18 29 o 141.5665 3.180016 244.8832       10.97048 243.3255       15.67113 246.3802       15.36268 140.8299 4.572412 141.7370 4.453352 -0.9070740     6.382734 
1 1 1 -1  18 30 o 98.70701 3.062018 119.1808       7.356416 119.1089       10.44885 119.2515       10.35882 98.47871 4.364863 98.54498 4.324124 -0.6626892E-01 6.144109 
1 1 1 -1  18 31 o 126.0311 3.135762 194.2332       9.630681 195.2681       13.74712 193.2357       13.49603 126.0528 4.482444 125.4084 4.423072 0.6444626      6.297291 
1 1 1 -1  18 32 o 96.26955 3.442080 113.6206       8.062069 111.4350       13.00380 114.9853       10.27514 94.84557 5.651857 96.66550 4.373270 -1.819931      7.146256 
1 1 1 -1  18 33 o 41.21427 4.389034 21.12480       4.340381 21.67930       6.102836 20.55724       6.174237 41.34295 6.252611 40.16666 6.532085 1.176292       9.042305 
1 1 1 -1  18 34 o 41.90581 5.320143 22.09191       5.310639 24.96418       6.176564 13.94815       10.40032 44.45089 5.843417 33.12397 11.01831 11.32692       12.47192 
1 1 1 -1  18 35 o 89.33980 3.167033 98.11263       6.884083 90.67062       9.560466 106.1259       9.920648 85.45930 4.607789 92.54473 4.411685 -7.085426      6.379239 
1 1 1 -1  18 36 o 31.03218 5.536919 12.41602       4.033517 13.05165       5.700569 11.77874       5.707947 31.27566 7.563272 29.68070 7.793558 1.594955       10.86014 
1 1 1 -1  18 37 o 23.05547 6.508630 7.015490       3.815959 12.75443       5.225842 0.4600543      5.585230 30.84324 7.099952 17.34404 7.423583 13.49920       10.27224 
1 1 1 -1  18 38 o 51.00286 3.793708 32.59941       4.681371 27.48048       6.233319 39.22214       7.090031 46.01204 5.679625 55.25777 5.331364 -9.245731      7.789838 
1 1 1 -1  18 39 o 24.77758 7.165286 8.526529       4.570733 0.9543520      9.018152 11.14411       5.302217 20.89834 9.182978 28.09335 7.573812 -7.195007      11.90335 
1 1 1 -1  18 40 o 25.58210 6.861963 9.303505       4.365792 10.34605       6.511457 8.452089       5.884379 26.32172 8.717076 24.23738 8.288005 2.084337       12.02824 
1 1 1 -1  18 41 o 43.76165 4.299859 25.02212       4.526325 25.15432       5.963153 24.84243       6.952522 42.67978 5.890362 41.30726 7.166567 1.372513       9.276640 
1 1 1 -1  18 42 o 12.78623 5.784265 -0.8453401     3.860000 1.270277       5.669207 -2.673720      5.270321 16.50608 7.265943 13.67563 6.389325 2.830455       9.675609 
1 1 1 -1  18 43 o 22.97854 6.418822 8.190544       3.731996 4.147178       4.969767 13.41905       5.651365 17.78971 7.258660 28.01098 7.925235 -10.22126      10.74698 
1 1 1 -1  18 44 o 23.10592 6.277906 8.494827       3.626107 19.38978       5.556002 0.4107481      4.785915 34.73697 6.807009 14.27672 6.451347 20.46025       9.378447 
1 1 1 -1  18 45 f 15.51450 7.038594 1.966264       5.765014 2.836689       8.290465 1.151284       8.022079 17.05453 7.982796 16.27348 7.689876 0.7810478      11.08419 
1 1 1 -1  18 46 o 19.79184 6.826251 7.460275       3.994232 10.62678       5.927913 4.827242       5.405551 21.29669 8.161242 16.58492 7.201719 4.711769       10.88442 
1 1 1 -1  18 47 f 19.97920 7.328665 8.783182       4.670987 8.540029       5.944665 9.175547       7.551494 18.58397 7.792081 18.21151 8.177362 0.3724594      11.29539 
1 1 1 -1  19 1  o 300.9378 5.522222 1104.167       40.49735 1152.032       71.74570 1081.786       49.06019 307.0455 9.600439 297.8251 6.759768 9.220367       11.74150 
1 1 1 -1  19 2  o 451.2281 6.015089 2482.720       66.14153 2303.284       99.36589 2625.472       88.62872 434.3800 9.387099 463.8963 7.840025 -29.51633      12.23044 
1 1 1 -1  19 3  o 595.5119 8.682991 4327.975       126.0074 3938.093       236.6927 4482.176       148.8545 566.4802 17.16586 605.8585 10.08218 -39.37823      19.90771 
1 1 1 -1  19 4  f 350.2478 5.387846 1495.659       45.98611 1523.565       92.44565 1486.483       53.01001 353.0032 10.75917 349.1345 6.230588 3.868713       12.43302 
1 1 1 -1  19 5  o 106.9287 3.033221 139.4550       7.895787 129.7955       10.90010 150.1195       11.45307 103.0976 4.348324 110.8943 4.245997 -7.796722      6.077534 
1 1 1 -1  19 6  o 632.1143 9.172445 4878.185       141.2918 4955.956       202.0917 4803.820       197.6169 636.4921 13.02925 626.6635 12.94058 9.828613       18.36355 
1 1 1 -1  19 7  o 559.6442 7.318774 3821.275       99.81285 3991.143       162.4322 3718.219       126.5175 571.3627 11.66606 551.8066 9.408657 19.55609       14.98732 
1 1 1 -1  19 8  o 401.0836 6.038064 1961.986       59.01586 2031.459       85.46912 1898.679       81.58813 407.9204 8.598005 394.3736 8.489519 13.54684       12.08295 
1 1 1 -1  19 9  o 826.8025 10.63895 8356.543       214.3565 8073.639       331.3609 8560.127       281.0949 810.7277 16.77220 835.8847 13.79973 -25.15698      21.71956 
1 1 1 -1  19 10 o 194.5340 3.577521 461.2898       16.95953 453.5739       34.76890 463.6988       19.42745 192.6287 7.420735 195.0292 4.087710 -2.400467      8.472112 
1 1 1 -1  19 11 o 701.7393 10.15942 6022.306       173.7324 6342.312       255.1823 5745.831       237.1923 718.7428 14.56938 684.2309 14.22531 34.51190       20.36237 
1 1 1 -1  19 12 o 266.4032 4.975126 865.6137       32.29830 937.0222       59.80499 836.2105       38.37605 276.7274 8.879975 261.7784 6.015759 14.94901       10.72582 
1 1 1 -1  19 13 o 320.3340 4.491219 1251.483       35.05931 1260.964       56.22003 1245.449       44.84799 321.3079 7.180152 319.4630 5.760846 1.844818       9.205538 
1 1 1 -1  19 14 o 316.4367 4.444472 1221.362       34.27229 1190.503       53.83150 1242.397       44.44334 312.1574 7.076635 319.0384 5.716467 -6.880981      9.097075 
1 1 1 -1  19 15 f 252.7504 4.242565 779.2534       26.13102 759.1343       36.60575 800.1587       37.31413 249.3237 6.024897 255.9760 5.981883 -6.652359      8.490129 
1 1 1 -1  19 16 o 173.9542 3.401370 369.0117       14.41866 374.6072       20.74621 363.7835       20.05354 175.1241 4.866066 172.5818 4.772845 2.542282       6.816059 
1 1 1 -1  19 17 o 246.2248 4.166466 739.7861       24.99976 747.2491       35.80112 732.6838       34.92514 247.2766 5.941245 244.8656 5.852942 2.411041       8.339984 
1 1 1 -1  19 18 o 108.0090 2.929358 142.3659       7.703131 138.0747       11.39196 145.9809       10.45588 106.2609 4.408930 109.3050 3.931812 -3.044098      5.907436 
1 1 1 -1  19 19 f 398.7012 6.059290 1944.679       58.87154 1933.264       83.41207 1956.010       83.10264 396.7119 8.628147 399.0697 8.545351 -2.357788      12.14364 
1 1 1 -1  19 20 o 35.17312 4.462423 15.35123       3.738910 26.45543       8.023791 12.27136       4.225729 45.86957 7.432374 31.18074 5.773927 14.68883       9.411611 
1 1 1 -1  19 21 o 373.7958 5.744133 1709.933       52.32328 1758.956       75.77628 1665.261       72.33612 378.2497 8.220884 368.0997 8.064057 10.14999       11.51573 
1 1 1 -1  19 22 o 215.6078 3.812849 567.6237       20.03319 537.9113       28.01940 598.6966       28.65367 209.5786 5.490983 221.2085 5.315478 -11.62994      7.642330 
1 1 1 -1  19 23 o 161.6649 3.295906 319.0174       12.98454 314.9412       18.74536 322.7772       18.00296 160.3970 4.801209 162.4198 4.552999 -2.022827      6.616752 
1 1 1 -1  19 24 o 142.0483 3.155550 246.2983       10.92313 237.6505       15.75399 254.3048       15.15850 139.3091 4.647113 144.1611 4.319785 -4.852020      6.344778 
1 1 1 -1  19 25 o 111.4086 4.080264 151.9408       11.05882 165.2592       19.36031 145.4906       13.47317 115.7077 6.897459 108.8720 5.092401 6.835754       8.573651 
1 1 1 -1  19 26 o 114.9920 2.998341 161.5483       8.394870 176.7431       12.64852 149.5852       11.22316 120.1121 4.328400 110.5083 4.175089 9.603828       6.013852 
1 1 1 -1  19 27 o 63.92323 3.235756 50.04313       5.024071 53.68302       7.652663 47.28591       6.660442 66.01978 4.789225 61.98970 4.438446 4.030087       6.529662 
1 1 1 -1  19 28 o 38.26867 4.283232 18.15321       3.925954 22.47019       5.980891 14.88481       5.204082 42.33785 5.961854 34.21089 6.479440 8.126961       8.804934 
1 1 1 -1  19 29 o 105.7601 3.059413 136.7878       7.876611 137.8291       11.38055 135.8304       10.91260 105.9521 4.417446 105.2069 4.265296 0.7452011      6.140568 
1 1 1 -1  19 30 o 88.52805 3.113499 95.93211       6.706394 103.3914       9.774760 89.29801       9.218235 91.70698 4.386606 85.20033 4.455353 6.506645       6.252398 
1 1 1 -1  19 31 o 36.65528 4.665326 16.77020       4.073003 16.71129       5.997174 16.82063       5.549080 36.08681 7.072641 36.32926 6.506968 -0.2424507     9.610561 
1 1 1 -1  19 32 o 31.44930 5.343778 12.53776       3.949003 12.14399       5.545410 12.94290       5.624906 30.57707 7.500068 31.57388 7.434417 -0.9968090     10.56038 
1 1 1 -1  19 33 o 64.70416 4.220228 51.73428       6.618017 53.64913       7.721708 46.43517       12.84538 65.74989 4.853495 59.77324 9.105951 5.976646       10.31866 
1 1 1 -1  19 34 o 47.71585 4.832154 28.46461       5.541376 25.87674       6.290833 37.42580       11.70630 45.20212 5.847927 53.16902 9.377543 -7.966904      11.05154 
1 1 1 -1  19 35 o 81.17896 3.197529 81.14368       6.313115 81.39456       8.858123 80.88473       8.999748 80.88867 4.511721 80.60120 4.601089 0.2874756      6.444040 
1 1 1 -1  19 36 o 43.82217 4.619761 24.20647       4.859291 20.81879       6.194583 29.62594       7.835009 39.91489 6.598944 47.60859 6.958889 -7.693695      9.590215 
1 1 1 -1  19 37 o 55.89408 3.705180 38.98233       5.018257 38.62770       7.073056 39.34179       7.120961 54.95001 5.349705 55.46728 5.333922 -0.5172691     7.554474 
1 1 1 -1  19 38 o 77.04884 3.294219 73.92175       6.170937 69.10667       8.484959 79.32839       8.991061 73.64207 4.753502 78.96122 4.693807 -5.319145      6.680389 
1 1 1 -1  19 39 o 41.38627 5.384379 22.60100       5.301734 15.84383       9.247770 25.90920       6.470687 31.63971 10.38437 43.80877 6.237100 -12.16906      12.11349 
1 1 1 -1  19 40 o 43.59200 4.300344 24.67199       4.508775 29.94614       6.252985 18.96000       6.507360 47.14716 5.548578 35.85369 7.679266 11.29347       9.474062 
1 1 1 -1  19 41 o 22.73968 7.077537 7.784861       4.339461 9.549158       6.199930 6.090502       6.075802 24.36917 8.499269 20.91808 8.194253 3.451090       11.80607 
1 1 1 -1  19 42 o 15.58600 6.323466 2.600284       3.746342 1.525363       5.067724 3.895632       5.563114 15.88190 6.933604 18.12730 7.564732 -2.245394      10.26158 
1 1 1 -1  19 43 o 21.14824 6.626029 7.149065       3.796820 10.53636       5.556844 4.182921       5.199936 24.23467 8.053677 17.71544 7.346638 6.519230       10.90114 
1 1 1 -1  19 44 o 12.58884 5.834036 -1.034987      4.256345 -7.533327      8.083003 1.458253       5.006723 13.84207 6.812244 14.96904 6.694673 -1.126975      9.551194 
1 1 1 -1  19 45 f 13.51411 6.286915 -0.1704314     5.016102 -0.1704314     5.016102 0.000000       0.000000 13.51411 6.286915 ?        ?        0.000000       6.286915 
1 1 1 -1  19 46 o 10.52328 5.039356 -2.409075      3.684509 -1.428224      5.491229 -3.212289      4.969163 12.88394 6.165042 11.66886 5.653515 1.215074       8.364806 
1 1 1 -1  19 47 o 14.49420 6.243852 3.324663       3.999107 10.07283       6.015524 -2.019709      5.353389 19.49709 7.974264 12.21057 5.904418 7.286520       9.922250 
1 1 1 -1  20 1  o 333.9715 6.034979 1360.259       49.11581 1271.662       80.87386 1412.031       61.82272 322.4672 10.30492 340.1859 7.457542 -17.71872      12.72031 
1 1 1 -1  20 2  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -1  20 3  o 270.6846 5.136070 893.3646       33.87899 967.8333       61.67157 861.1782       40.54473 281.3990 9.005044 265.7198 6.261445 15.67926       10.96798 
1 1 1 -1  20 4  o 594.0811 10.02608 4311.818       145.1487 4055.147       241.2227 4457.495       181.7296 574.3707 17.25371 603.6150 12.35462 -29.24426      21.22092 
1 1 1 -1  20 5  o 438.4337 6.578153 2344.962       70.28197 2514.303       148.0092 2295.663       79.85976 452.9326 13.42451 433.7173 7.555882 19.21533       15.40483 
1 1 1 -1  20 6  o 387.5767 5.905452 1832.171       55.77594 2069.217       121.2244 1768.513       62.82032 411.0365 12.11568 380.7228 6.771036 30.31363       13.87936 
1 1 1 -1  20 7  o 284.9956 5.301100 990.5236       36.81632 897.5117       60.90066 1044.093       46.21787 270.8861 9.239220 292.5369 6.483257 -21.65076      11.28697 
1 1 1 -1  20 8  o 670.9933 9.742340 5503.583       159.3007 5097.955       303.0750 5658.425       187.2533 642.4556 19.38062 679.9883 11.30035 -37.53265      22.43449 
1 1 1 -1  20 9  o 284.8607 4.599921 989.5002       31.93147 1045.876       66.87388 972.8508       36.34200 292.3455 9.399156 282.4183 5.280558 9.927124       10.78093 
1 1 1 -1  20 10 o 150.2540 3.628399 275.2309       13.28548 296.9494       25.07040 266.7503       15.66604 155.8304 6.617021 147.8392 4.353179 7.991180       7.920552 
1 1 1 -1  20 11 o 121.8230 2.796342 180.8941       8.301483 179.7755       13.94071 181.5088       10.33337 121.3127 4.724695 121.9679 3.480202 -0.6552277     5.868096 
1 1 1 -1  20 12 o 346.4733 5.401846 1464.929       45.60875 1561.365       67.28593 1382.957       62.03463 357.4076 7.725461 336.3904 7.567535 21.01718       10.81436 
1 1 1 -1  20 13 o 287.1391 4.666515 1005.908       32.65285 1026.922       46.93690 986.1989       45.45495 289.9287 6.643349 284.1307 6.564883 5.798004       9.339795 
1 1 1 -1  20 14 o 434.2318 6.541452 2304.170       69.22005 2419.337       101.1901 2202.883       94.89658 444.2789 9.346442 423.9819 9.184746 20.29700       13.10403 
1 1 1 -1  20 15 o 268.7168 4.441944 881.1829       29.08734 862.5151       40.80380 900.4706       41.47585 265.6476 6.303165 271.4340 6.270395 -5.786407      8.890880 
1 1 1 -1  20 16 o 315.0427 4.444356 1211.467       34.12042 1181.617       53.72993 1231.639       44.16980 310.7130 7.096118 317.4728 5.709300 -6.759827      9.107744 
1 1 1 -1  20 17 o 98.30451 2.568607 117.9066       6.148015 118.9020       10.57280 117.3981       7.557013 98.59012 4.411863 98.05778 3.166663 0.5323410      5.430681 
1 1 1 -1  20 18 o 103.6260 2.576173 130.9386       6.505490 120.7067       10.95201 136.5170       8.086725 99.31430 4.537271 105.7448 3.141663 -6.430450      5.518775 
1 1 1 -1  20 19 o 78.95150 2.735791 76.11067       5.255604 85.24052       11.70601 73.80576       5.881721 83.26939 5.805184 77.72084 3.111786 5.548553       6.586605 
1 1 1 -1  20 20 o 74.15583 3.002029 67.19382       5.413743 65.07598       8.452295 68.66704       7.049571 72.81365 4.790100 74.89583 3.875687 -2.082176      6.161656 
1 1 1 -1  20 21 o 74.28870 3.036052 67.44701       5.484689 65.03631       8.614712 69.09023       7.112440 72.76913 4.886322 75.11724 3.898806 -2.348106      6.251146 
1 1 1 -1  20 22 o 190.7392 3.577178 444.2183       16.62710 438.6691       23.92413 449.4030       23.12479 189.2547 5.192351 191.6013 4.956878 -2.346619      7.178520 
1 1 1 -1  20 23 o 136.0835 3.108591 226.0323       10.30873 220.4872       15.10193 230.8704       14.10642 134.1841 4.625354 137.3679 4.219011 -3.183746      6.260508 
1 1 1 -1  20 24 o 220.0732 5.491218 593.6629       29.44910 541.2285       42.28933 643.0298       41.03369 209.1672 8.313178 228.3760 7.382866 -19.20883      11.11826 
1 1 1 -1  20 25 o 61.44219 3.262412 46.23417       4.867232 48.50950       7.716843 44.73102       6.272178 62.71655 5.092979 60.31749 4.295266 2.399059       6.662414 
1 1 1 -1  20 26 f 197.9821 3.663907 479.1418       17.67691 481.9260       25.50184 476.5669       24.52465 198.1414 5.286257 197.0835 5.110731 1.057938       7.352828 
1 1 1 -1  20 27 o 93.11416 3.025187 106.0092       6.855311 95.40876       9.900587 115.7722       9.501473 88.12054 4.626706 97.18637 4.020577 -9.065834      6.129555 
1 1 1 -1  20 28 o 122.3101 3.106206 182.9140       9.250751 197.8299       13.81052 170.7752       12.45874 126.9691 4.470480 117.9812 4.340762 8.987869       6.231164 
1 1 1 -1  20 29 o 23.65330 6.282856 7.150589       3.682309 9.082137       5.662755 5.735444       4.847026 26.84446 8.033114 22.23680 7.523355 4.607658       11.00599 
1 1 1 -1  20 30 o 51.48058 3.763368 32.63618       4.688624 24.33217       6.846934 39.96824       6.433766 43.86003 6.611307 56.84861 4.685751 -12.98857      8.103435 
1 1 1 -1  20 31 o 44.33204 4.419237 24.38665       4.710672 26.75188       7.956337 23.11002       5.845305 45.76961 7.384742 42.87529 5.738495 2.894318       9.352259 
1 1 1 -1  20 32 o 65.74162 3.371266 53.11431       5.382906 44.67987       7.566408 61.75781       7.659606 59.90367 5.235799 70.68406 4.469703 -10.78039      6.884173 
1 1 1 -1  20 33 o 57.34020 4.468585 40.81459       6.194767 37.20533       7.105687 52.24654       12.64613 54.48874 5.423276 63.59042 8.363276 -9.101677      9.967764 
1 1 1 -1  20 34 o 104.4233 3.140868 134.0424       7.983423 128.4419       11.27661 139.6702       11.30397 101.7204 4.560793 106.1572 4.379043 -4.436768      6.322724 
1 1 1 -1  20 35 o 25.18368 6.683542 8.370730       4.169249 6.558089       5.482465 10.85665       6.420419 23.20191 7.997694 28.50544 8.559092 -5.303526      11.71414 
1 1 1 -1  20 36 o 37.87805 4.585507 18.20126       4.146568 17.53265       5.946667 18.83399       5.784943 36.27616 6.980276 37.82653 6.510572 -1.550373      9.545250 
1 1 1 -1  20 37 o 27.12162 5.907174 9.811406       3.793397 13.65012       5.320339 5.842017       5.410135 31.62283 7.080600 21.90550 7.909129 9.717321       10.61552 
1 1 1 -1  20 38 o 17.01422 6.980577 2.048715       4.627896 -1.058109      8.801015 3.236075       5.440835 19.57965 8.806831 19.01197 7.653706 0.5676785      11.66788 
1 1 1 -1  20 39 o 62.84741 3.569619 49.97488       5.444474 39.81113       7.238005 63.21991       8.262630 54.69386 5.505375 69.60186 4.902853 -14.90800      7.372051 
1 1 1 -1  20 40 o 19.39852 6.583166 5.228132       3.711454 5.459186       5.021670 4.949976       5.509802 20.14892 7.559439 19.87352 7.797843 0.2753944      10.86055 
1 1 1 -1  20 41 o 16.31277 6.330874 3.203923       3.599668 1.852249       4.931410 4.745526       5.266492 16.20504 6.956561 18.99163 7.569196 -2.786585      10.28039 
1 1 1 -1  20 42 f 14.34919 6.215259 1.180729       4.005521 -1.284254      6.288132 2.863909       5.196129 15.18403 7.055377 16.83902 7.182592 -1.654990      10.06817 
1 1 1 -1  20 43 f 14.53865 6.167773 1.959462       3.795631 -0.6724039E-01 5.775018 3.500758       5.036180 14.93888 6.877583 16.79955 7.114764 -1.860674      9.895504 
1 1 1 -1  20 44 o 14.89477 6.379011 2.501794       4.128475 6.825907       5.322453 -4.029592      6.541329 19.12650 7.613793 13.40525 6.492811 5.721251       10.00632 
1 1 1 -1  20 45 o 15.33359 6.662688 3.321870       4.632887 4.865264       5.621411 0.5383350E-01  8.179946 16.71586 7.300028 15.24549 7.353847 1.470367       10.36192 
1 1 1 -1  20 46 o 14.68089 6.239978 3.332889       3.897660 9.106084       5.749478 -1.576500      5.301931 19.33852 7.838150 12.52108 6.009000 6.817443       9.876471 
1 1 1 -1  21 1  o 283.7736 4.593671 981.8505       31.76640 1059.698       46.79126 915.2953       43.26465 294.7075 6.515347 273.8947 6.482065 20.81271       9.190588 
1 1 1 -1  21 2  o 341.9944 4.752326 1426.149       39.60603 1396.269       61.62495 1447.176       51.69674 338.2088 7.477140 344.4200 6.159404 -6.211182      9.687408 
1 1 1 -1  21 3  o 556.5825 8.163327 3782.984       110.7217 3754.832       219.6754 3792.572       128.1962 552.4256 16.33612 557.0774 9.443297 -4.651794      18.86915 
1 1 1 -1  21 4  o 147.5664 3.207336 265.4220       11.53369 270.4557       16.19619 260.2429       16.42849 148.8671 4.469615 146.0185 4.622758 2.848633       6.430191 
1 1 1 -1  21 5  o 215.3652 3.802262 565.4402       19.95509 556.3226       27.75136 575.2019       28.71482 213.5673 5.332285 217.1569 5.426208 -3.589569      7.607693 
1 1 1 -1  21 6  o 290.1366 4.670609 1026.548       33.02266 1000.962       45.70580 1054.490       47.76439 286.3809 6.549243 293.9297 6.668447 -7.548737      9.346698 
1 1 1 -1  21 7  o 528.4047 9.028376 3413.635       116.2552 3030.967       186.2050 3658.087       148.8252 496.0621 15.42223 546.5035 11.17499 -50.44147      19.04535 
1 1 1 -1  21 8  o 106.1337 3.354580 137.4573       8.665266 127.8450       10.24540 161.6114       16.24092 102.3107 4.117749 114.9335 5.817585 -12.62276      7.127423 
1 1 1 -1  21 9  o 365.1426 7.961986 1629.661       70.84676 1641.519       101.2602 1618.291       99.15771 365.6977 11.37652 363.1353 11.21872 2.562408       15.97763 
1 1 1 -1  21 10 o 111.1712 3.589926 150.8507       9.712790 119.8652       16.01349 168.8843       12.21651 98.83949 6.687814 117.5954 4.270142 -18.75591      7.934795 
1 1 1 -1  21 11 o 153.6085 3.325247 287.6918       12.44731 280.2668       17.81536 294.7733       17.39835 151.4803 4.832349 155.3723 4.600201 -3.891998      6.671840 
1 1 1 -1  21 12 o 386.8275 5.286017 1826.662       49.82898 1725.129       76.33369 1902.053       65.77657 375.3968 8.344294 394.4789 6.842445 -19.08203      10.79103 
1 1 1 -1  21 13 o 363.9302 5.015440 1616.854       44.47984 1537.701       68.61538 1674.225       58.41631 354.4011 7.944934 370.0953 6.477158 -15.69418      10.25064 
1 1 1 -1  21 14 o 169.2633 3.012154 349.3566       12.42442 326.5293       19.75208 364.3018       15.98221 163.4563 4.964537 172.8065 3.795252 -9.350189      6.249045 
1 1 1 -1  21 15 o 188.0736 3.152214 431.3941       14.44707 400.9623       22.65531 452.2503       18.75529 181.1040 5.138602 192.5107 3.997908 -11.40666      6.510645 
1 1 1 -1  21 16 o 159.2162 2.905662 309.1497       11.27376 331.8509       19.08033 296.9736       13.97384 164.7667 4.757022 156.0075 3.675649 8.759171       6.011627 
1 1 1 -1  21 17 f 82.73393 2.816808 83.57452       5.670784 101.0506       12.84986 79.34779       6.319449 90.70302 5.844650 80.58553 3.224510 10.11749       6.675133 
1 1 1 -1  21 18 o 263.6095 4.312253 848.6671       27.70138 892.8251       57.33388 835.2195       31.63946 269.2708 8.749091 261.4136 4.966663 7.857147       10.06053 
1 1 1 -1  21 19 o 80.64281 2.584448 79.39186       5.072341 88.96175       9.241247 75.26563       6.068114 85.21597 4.465724 78.47705 3.179620 6.738922       5.482031 
1 1 1 -1  21 20 o 41.08449 3.224419 20.72474       3.202388 21.87470       6.155346 20.29796       3.749838 41.80058 6.232985 40.59099 3.836458 1.209587       7.319052 
1 1 1 -1  21 21 o 173.9535 3.421515 369.4107       14.50400 351.9342       20.59914 386.5938       20.42546 169.5322 4.991533 177.7368 4.720010 -8.204544      6.869782 
1 1 1 -1  21 22 o 223.0361 3.927303 607.7998       21.34547 599.2054       30.58366 615.9624       29.80549 221.0476 5.682347 224.2406 5.454386 -3.193008      7.876509 
1 1 1 -1  21 23 o 187.8683 4.939615 432.4173       22.59466 465.5495       36.23586 411.3404       28.90125 194.1944 7.672225 182.8620 6.496024 11.33240       10.05293 
1 1 1 -1  21 24 o 82.13232 3.439231 82.54707       6.868302 91.94598       14.81846 79.97545       7.751170 86.11128 7.125388 80.78474 3.949298 5.326538       8.146662 
1 1 1 -1  21 25 o 207.3688 3.782489 525.7422       19.11425 507.5365       27.05761 543.8781       27.00573 203.2989 5.466540 210.5803 5.262619 -7.281448      7.588032 
1 1 1 -1  21 26 o 166.1896 3.406974 337.5407       13.79777 355.2020       20.52026 322.9664       18.64083 170.1254 4.954967 162.2702 4.719023 7.855194       6.842578 
1 1 1 -1  21 27 o 17.82508 6.308574 3.409697       3.424407 7.522906       5.838155 1.252308       4.228141 25.09945 8.251556 16.40541 6.694677 8.694040       10.62576 
1 1 1 -1  21 28 f 58.36277 3.426278 41.80396       4.851545 46.13997       7.540403 38.74099       6.337543 61.06800 5.113846 55.99494 4.687443 5.073059       6.937114 
1 1 1 -1  21 29 o 117.2300 3.115171 168.1679       8.891432 158.3583       12.81028 177.2868       12.35106 113.4589 4.643042 120.1554 4.224750 -6.696541      6.277447 
1 1 1 -1  21 30 o 63.90548 3.721529 50.21946       5.770485 49.81165       9.988844 50.42373       7.069471 63.03273 6.600758 63.88810 4.570987 -0.8553696     8.028943 
1 1 1 -1  21 31 o 64.56253 3.424473 51.23115       5.368516 50.99200       7.970425 51.42974       7.263218 64.06487 5.148668 64.45352 4.655680 -0.3886566     6.941480 
1 1 1 -1  21 32 o 44.07372 4.211208 24.13503       4.468024 30.44372       6.687522 19.04847       6.004930 49.19540 5.682674 38.51951 6.636735 10.67588       8.737222 
1 1 1 -1  21 33 o 15.03406 6.539068 -0.5421613     4.471864 0.6216577      5.237556 -3.672671      8.590006 17.20430 7.269429 19.12714 8.643091 -1.922838      11.29370 
1 1 1 -1  21 34 o 60.09271 3.830431 44.79587       5.580059 39.49112       7.168117 52.95471       8.889691 55.93891 5.322479 64.69177 5.697137 -8.752861      7.796548 
1 1 1 -1  21 35 o 64.49512 3.390064 51.52181       5.309372 49.63050       7.576986 53.34634       7.442006 62.70098 5.000306 65.14007 4.720216 -2.439083      6.876300 
1 1 1 -1  21 36 o 48.01458 3.943593 28.94707       4.573622 26.52448       6.436580 31.41767       6.500043 45.08218 6.008330 49.37257 5.495522 -4.290390      8.142529 
1 1 1 -1  21 37 o 18.92792 6.533026 4.474371       3.658699 10.49025       5.358233 -0.7805213     5.007879 27.31353 7.713205 15.29055 6.775411 12.02297       10.26644 
1 1 1 -1  21 38 o 14.94111 6.480647 0.2549876      4.367205 -5.178113      8.348202 2.302058       5.124311 17.00578 7.976186 17.66209 7.305873 -0.6563072     10.81644 
1 1 1 -1  21 39 o 42.17760 4.406118 23.22347       4.461982 18.58838       6.067438 28.68244       6.584634 35.78202 7.207793 45.63849 6.071026 -9.856464      9.423887 
1 1 1 -1  21 40 o 53.23748 4.301848 37.33995       5.533463 30.98943       8.472398 42.06388       7.307241 44.55089 8.102317 55.25049 5.500249 -10.69960      9.792869 
1 1 1 -1  21 41 o 34.62597 5.143414 16.77625       4.208345 17.61641       5.755374 15.81096       6.169145 33.44289 7.269962 30.63467 8.129905 2.808224       10.90631 
1 1 1 -1  21 42 o 14.71896 6.388834 1.491467       4.250533 -9.973232      8.395740 5.442772       4.928877 13.90793 6.863356 18.79116 7.374666 -4.883234      10.07429 
1 1 1 -1  21 43 o 19.23386 6.975924 6.318690       4.214838 1.515576       6.787833 9.332722       5.377043 16.19848 7.457060 22.10524 7.896678 -5.906757      10.86118 
1 1 1 -1  21 44 f 21.74651 6.687223 8.440718       3.887621 8.803999       5.675590 8.119612       5.335968 20.40129 7.940539 19.94582 7.716942 0.4554710      11.07264 
1 1 1 -1  21 45 o 16.46856 6.844353 4.914606       4.527014 2.932799       5.552737 8.842910       7.817700 15.19416 6.899002 18.58479 8.334561 -3.390625      10.81948 
1 1 1 -1  21 46 o 9.110915 4.511622 -5.561904      3.741193 -3.546350      5.633353 -7.152305      5.004066 11.93134 5.833651 10.18890 5.074320 1.742440       7.731766 
1 1 1 -1  22 1  o 123.0191 3.063317 184.4714       9.183340 168.9430       12.40412 203.3064       13.66110 117.6238 4.334890 129.0468 4.350343 -11.42303      6.141397 
1 1 1 -1  22 2  o 143.7886 3.191548 252.0290       11.18309 232.1873       15.04021 276.5621       16.72401 137.9097 4.481257 150.5200 4.564702 -12.61029      6.396731 
1 1 1 -1  22 3  o 298.2716 4.798708 1085.133       34.87967 1126.139       71.30416 1072.234       39.99090 303.2208 9.662166 296.4425 5.535855 6.778351       11.13567 
1 1 1 -1  22 4  o 391.5443 5.331188 1870.453       50.86757 1892.165       80.77798 1856.185       65.48166 393.4180 8.425635 389.8738 6.892227 3.544220       10.88550 
1 1 1 -1  22 5  o 251.4509 4.237817 771.0727       25.96758 687.3423       48.78585 804.1730       30.67386 236.9452 8.462680 256.7531 4.902490 -19.80788      9.780151 
1 1 1 -1  22 6  o 354.6271 5.470985 1534.696       47.27957 1441.759       64.25320 1644.433       69.81997 343.4646 7.676738 366.7924 7.811297 -23.32785      10.95211 
1 1 1 -1  22 7  o 198.1576 3.604261 478.7832       17.40456 463.2975       24.16825 495.4659       25.08487 194.7907 5.095820 201.4427 5.114175 -6.651962      7.219569 
1 1 1 -1  22 8  o 103.1091 2.662271 129.6796       6.683778 131.2600       10.27700 128.5212       8.798800 103.6609 4.076270 102.6051 3.524225 1.055756       5.388519 
1 1 1 -1  22 9  o 231.9282 4.018072 656.0900       22.70949 665.9568       46.34209 652.9717       26.05196 233.1465 8.169252 231.3377 4.621233 1.808731       9.385759 
1 1 1 -1  22 10 o 333.8059 5.238354 1360.286       42.61132 1358.737       85.74561 1360.793       49.10389 332.4641 10.59708 333.7629 6.037285 -1.298798      12.19618 
1 1 1 -1  22 11 o 384.4096 5.891909 1805.346       55.19329 1976.867       117.6580 1756.953       62.49627 400.3672 12.07323 379.0606 6.765646 21.30658       13.83968 
1 1 1 -1  22 12 o 177.8565 3.108942 385.7480       13.47468 398.3689       22.25490 378.4435       16.93079 180.5491 5.063179 176.1202 3.944864 4.428940       6.418546 
1 1 1 -1  22 13 o 212.0113 3.837117 548.4337       19.82441 536.1090       28.19446 560.4850       27.88007 209.3876 5.530407 214.1894 5.341457 -4.801865      7.688730 
1 1 1 -1  22 14 o 190.1895 3.192981 441.1984       14.79854 427.1903       23.75009 450.0885       18.92041 186.9102 5.219412 192.0355 4.043087 -5.125259      6.602182 
1 1 1 -1  22 15 o 71.80124 3.049343 62.99408       5.323341 42.45425       11.33906 68.80092       6.029048 58.24968 8.216096 75.02575 3.305749 -16.77607      8.856195 
1 1 1 -1  22 16 o 109.7177 2.926017 146.9307       7.816309 156.4013       16.71834 144.2816       8.842201 112.8826 6.100238 108.6945 3.342206 4.188080       6.955806 
1 1 1 -1  22 17 o 117.9790 2.680427 169.7531       7.706279 168.0831       12.93990 170.6710       9.593004 117.2088 4.538962 118.2208 3.333176 -1.012070      5.631362 
1 1 1 -1  22 18 o 148.4880 2.855329 268.9565       10.33198 264.1522       17.01239 271.7641       13.00508 146.9315 4.757593 149.2128 3.576605 -2.281326      5.952042 
1 1 1 -1  22 19 o 85.89774 3.030389 90.14032       6.333377 80.86089       9.561073 97.39559       8.454208 81.17379 4.855615 89.21746 3.897951 -8.043671      6.226638 
1 1 1 -1  22 20 o 116.9064 3.033707 166.8941       8.635366 177.6662       13.17308 158.7771       11.43503 120.4671 4.495160 113.9178 4.125983 6.549240       6.101655 
1 1 1 -1  22 21 o 162.3474 3.869103 322.0203       15.30706 367.1877       30.36988 306.6385       17.72283 172.6256 7.235455 158.2674 4.600094 14.35822       8.573953 
1 1 1 -1  22 22 o 272.2736 6.302916 910.4079       41.81991 953.1076       63.48200 877.6697       55.58601 277.1002 9.414750 266.3142 8.576335 10.78601       12.73542 
1 1 1 -1  22 23 o 22.59062 5.840198 6.498630       3.238497 9.980166       6.141452 5.157666       3.811484 28.19586 8.348315 20.73392 6.656299 7.461946       10.67711 
1 1 1 -1  22 24 o 75.68131 3.120723 70.06786       5.743112 71.26608       9.073592 69.26696       7.418179 76.10390 4.918908 75.14196 4.066303 0.9619446      6.382043 
1 1 1 -1  22 25 o 93.27030 3.060027 106.3666       6.945706 106.7816       10.66863 106.0613       9.150606 93.23116 4.711089 93.01528 4.046689 0.2158737      6.210479 
1 1 1 -1  22 26 o 213.4433 3.872281 557.4868       20.14120 550.4214       28.96752 564.0993       28.02384 211.5117 5.625051 214.2161 5.372572 -2.704346      7.778543 
1 1 1 -1  22 27 o 101.9699 3.092651 127.1981       7.676030 136.0190       11.83674 120.7964       10.08383 105.1946 4.628787 99.20357 4.180582 5.991058       6.237221 
1 1 1 -1  22 28 o 89.32116 3.119006 97.67140       6.778594 93.59889       10.22192 100.8681       9.056323 87.14730 4.832215 90.61687 4.111874 -3.469566      6.344904 
1 1 1 -1  22 29 o 76.06902 3.607806 71.04041       6.668800 73.51262       12.22042 69.99197       7.958239 76.72015 6.600531 75.37525 4.351128 1.344902       7.905651 
1 1 1 -1  22 30 o 68.89954 3.336975 58.29105       5.586143 66.58862       8.766385 52.61839       7.248335 73.32964 4.934472 65.22296 4.589689 8.106682       6.739010 
1 1 1 -1  22 31 o 78.51800 3.186456 75.68732       6.084292 80.32738       9.250854 72.15005       8.077071 80.53365 4.734658 76.40728 4.355983 4.126373       6.433628 
1 1 1 -1  22 32 o 61.33904 4.422581 46.72097       6.566338 44.92012       7.673610 51.64549       12.68941 59.89018 5.312917 63.01708 8.478065 -3.126900      10.00523 
1 1 1 -1  22 33 o 61.77337 3.791516 47.27343       5.680060 44.95500       7.610338 50.18914       8.534497 59.77314 5.278906 63.05458 5.612851 -3.281433      7.705254 
1 1 1 -1  22 34 f 88.62109 3.164577 96.90102       6.823247 98.87990       10.06975 95.22112       9.277880 88.87836 4.665626 87.35595 4.372229 1.522408       6.394095 
1 1 1 -1  22 35 o 25.25572 6.190144 8.506412       3.779653 11.17704       5.871546 6.616692       4.939058 28.51516 8.081639 22.71216 7.593884 5.802999       11.08963 
1 1 1 -1  22 36 o 24.60736 6.728003 8.259148       4.149444 4.709311       7.057937 10.13421       5.129578 21.93040 8.755173 27.01013 7.518077 -5.079727      11.54013 
1 1 1 -1  22 37 o 42.82364 4.351752 23.52800       4.478331 22.52756       6.340800 24.52373       6.325859 40.60973 6.636339 42.63403 6.276353 -2.024303      9.134199 
1 1 1 -1  22 38 o 48.00139 4.838677 30.25533       5.582839 26.43814       10.75103 31.66471       6.532681 39.32578 10.86059 48.51905 5.629508 -9.193275      12.23290 
1 1 1 -1  22 39 o 43.84787 4.740577 25.61510       4.984976 29.20068       8.186505 23.50213       6.284426 43.73414 7.975183 40.45378 6.602373 3.280354       10.35350 
1 1 1 -1  22 40 o 18.46081 6.564585 4.883291       3.711826 8.475715       5.082270 0.7764285      5.433992 22.92740 7.703681 15.83821 7.035750 7.089191       10.43305 
1 1 1 -1  22 41 o 26.50149 7.230236 11.45749       4.798075 -1.008237      8.992416 16.41894       5.673116 17.35239 8.182062 31.70887 7.466213 -14.35648      11.07657 
1 1 1 -1  22 42 o 16.32975 6.261226 3.808714       3.490334 3.423110       5.395223 4.086252       4.577193 16.88421 7.262630 17.06654 6.965133 -0.1823311     10.06275 
1 1 1 -1  22 43 o 27.17105 6.192245 11.98797       4.008455 2.361461       5.869442 20.40222       5.487442 15.81958 7.146862 35.05213 6.667782 -19.23255      9.774301 
1 1 1 -1  22 44 o 10.22170 4.968208 -3.954147      3.918838 -8.411774      6.539270 -1.456149      4.895235 11.70158 5.823267 12.54540 5.951432 -0.8438158     8.326462 
1 1 1 -1  22 45 o 14.33929 6.186032 2.908529       3.936377 -0.2842000     5.652767 5.914324       5.484787 13.36974 6.357682 16.92829 7.302481 -3.558553      9.682269 
1 1 1 -1  23 1  o 229.1855 4.617770 640.7897       25.79025 698.4254       46.24350 614.7700       31.07112 238.8504 7.956008 224.3411 5.688037 14.50931       9.780175 
1 1 1 -1  23 2  o 243.5655 4.821203 723.8152       28.61589 694.8687       48.18583 739.5859       35.56693 238.1833 8.314546 246.1189 5.930144 -7.935654      10.21265 
1 1 1 -1  23 3  o 301.1158 4.318617 1106.004       31.68942 1086.844       49.43181 1119.371       41.29026 298.2509 6.801250 302.8158 5.595424 -4.564911      8.807143 
1 1 1 -1  23 4  o 350.0239 6.296196 1496.446       53.70466 1740.227       102.5686 1404.369       63.03619 376.3066 11.19746 338.8905 7.632986 37.41611       13.55159 
1 1 1 -1  23 5  o 152.9765 3.244821 285.3308       12.09627 297.7591       17.26970 273.3610       16.94825 156.1562 4.543090 149.6080 4.654390 6.548264       6.504077 
1 1 1 -1  23 6  f 272.3156 4.008276 904.5279       26.59906 940.9853       42.83453 881.6464       33.93462 277.5244 6.333689 268.7516 5.181505 8.772858       8.183130 
1 1 1 -1  23 7  o 228.4006 3.943553 636.3329       21.94932 682.7953       32.24184 596.2006       29.96509 236.4588 5.595363 220.8888 5.571249 15.57005       7.896005 
1 1 1 -1  23 8  o 396.1393 5.393468 1916.330       52.06575 1954.315       82.98230 1891.667       66.86487 399.3802 8.526345 393.2872 6.976732 6.092957       11.01696 
1 1 1 -1  23 9  o 190.9783 3.194225 444.7747       14.86571 476.4120       24.07475 425.2782       18.89904 197.4698 5.006976 186.6914 4.154122 10.77841       6.505886 
1 1 1 -1  23 10 o 136.2475 3.180728 226.3883       10.56067 193.7567       20.59858 238.0239       12.30024 125.6696 6.750994 139.6399 3.617708 -13.97030      7.659225 
1 1 1 -1  23 11 o 72.73327 4.580446 64.84121       8.077294 56.97387       12.13661 71.09664       10.82211 67.79671 7.469675 76.03607 5.886391 -8.239357      9.510291 
1 1 1 -1  23 12 o 168.6566 3.363515 346.9911       13.82397 403.5994       30.90434 332.8310       15.45654 181.4097 7.003896 165.1503 3.840581 16.25940       7.987779 
1 1 1 -1  23 13 o 251.4219 3.801740 771.4427       23.29280 799.0315       38.17579 755.0809       29.39936 255.5531 6.130144 248.6170 4.852561 6.936172       7.818313 
1 1 1 -1  23 14 o 212.5740 3.420443 551.3442       17.71857 535.8648       28.28372 561.3433       22.73200 209.2614 5.551304 214.4020 4.350834 -5.140625      7.053136 
1 1 1 -1  23 15 o 78.74360 3.050077 75.75137       5.841712 42.53992       12.30532 85.41383       6.637321 58.13793 8.974099 83.60697 3.263994 -25.46904      9.549247 
1 1 1 -1  23 16 o 88.76481 2.706276 96.18684       5.847113 110.8506       10.53098 89.65162       7.030340 95.14169 4.555388 85.64655 3.375060 9.495148       5.669444 
1 1 1 -1  23 17 o 61.12337 3.354323 45.73305       4.977145 51.98165       8.205127 42.09539       6.260441 64.98005 5.225692 58.52929 4.422015 6.450760       6.845588 
1 1 1 -1  23 18 o 153.7084 3.288280 288.3657       12.31693 275.5935       17.73862 300.2565       17.11562 150.0367 4.858016 156.6665 4.487744 -6.629807      6.613634 
1 1 1 -1  23 19 o 190.5368 3.611178 443.3320       16.76733 459.7071       24.82171 429.5884       22.73999 193.7119 5.263104 187.3064 4.986411 6.405502       7.250142 
1 1 1 -1  23 20 o 113.2024 2.986704 156.5087       8.231980 136.1877       17.70724 162.1115       9.297821 105.0261 6.957818 115.1811 3.316013 -10.15502      7.707604 
1 1 1 -1  23 21 o 26.00750 5.343637 8.590239       3.273315 15.85510       9.284682 7.559119       3.497906 35.31216 10.21249 24.34089 5.948323 10.97128       11.81852 
1 1 1 -1  23 22 o 176.5370 3.080889 380.5220       13.25403 382.8209       21.98142 379.2088       16.61389 176.6760 5.110916 176.1264 3.870890 0.5495758      6.411337 
1 1 1 -1  23 23 o 233.8311 3.623060 668.2925       20.64495 701.7405       34.43359 649.5212       25.79552 238.9926 5.912372 230.3051 4.596260 8.687515       7.488775 
1 1 1 -1  23 24 o 124.9207 3.138516 190.7437       9.546644 192.3728       14.30033 189.4339       12.82227 125.2093 4.695086 124.3289 4.238302 0.8803558      6.325111 
1 1 1 -1  23 25 o 25.60651 5.769249 8.380834       3.513407 7.872193       6.182128 8.623491       4.270010 25.71260 8.492929 25.95394 6.704274 -0.2413368     10.82022 
1 1 1 -1  23 26 o 194.8160 3.707811 464.4743       17.60266 484.8352       26.13620 447.5716       23.81345 198.4791 5.408747 190.7909 5.126516 7.688248       7.452229 
1 1 1 -1  23 27 o 86.69936 3.161079 92.03666       6.667450 91.56644       10.49227 92.35515       8.635126 86.15896 5.019001 86.70604 4.098399 -0.5470810     6.479756 
1 1 1 -1  23 28 o 90.07304 3.500713 99.49393       7.669371 106.6117       14.60821 96.78555       9.011131 92.52737 6.520495 88.71496 4.179933 3.812416       7.745237 
1 1 1 -1  23 29 o 13.08289 5.713076 -0.6587214     3.442487 -0.7251046     5.930243 -0.6249828     4.227735 17.35537 7.539652 14.62297 6.359193 2.732395       9.863351 
1 1 1 -1  23 30 o 23.71137 6.254880 7.253715       3.665678 7.381129       6.309853 7.188807       4.503606 25.00320 8.581437 23.80773 7.172942 1.195467       11.18446 
1 1 1 -1  23 31 o 74.54001 4.179387 68.73013       7.561281 74.82211       9.288789 56.76471       13.01798 77.55694 4.940444 66.27235 8.238063 11.28458       9.605918 
1 1 1 -1  23 32 o 120.5711 4.698843 180.7927       13.77965 180.7927       13.77965 0.000000       0.000000 120.5711 4.698843 ?        ?        0.000000       4.698843 
1 1 1 -1  23 33 o 39.06571 4.458084 19.22406       4.168168 17.92779       6.298591 20.23403       5.559676 36.75648 7.289437 39.61330 5.942440 -2.856819      9.404706 
1 1 1 -1  23 34 o 60.46816 3.519511 45.44861       5.163736 46.45702       7.688743 44.62007       6.969389 60.40819 5.275932 59.38728 4.858186 1.020916       7.171989 
1 1 1 -1  23 35 o 12.30017 5.512134 -1.200861      3.412627 1.505836       5.205647 -3.240776      4.519192 17.45156 7.302722 12.96685 6.010000 4.484719       9.457793 
1 1 1 -1  23 36 o 50.14485 3.832758 31.77820       4.648043 32.22348       6.938451 31.41570       6.260374 49.33748 5.886993 49.06015 5.321556 0.2773323      7.935719 
1 1 1 -1  23 37 o 62.41899 4.124779 49.88388       6.238961 52.03489       12.68666 49.19774       7.165263 58.64858 9.177417 61.44798 4.823715 -2.799400      10.36789 
1 1 1 -1  23 38 o 14.06296 6.196841 -0.5237307E-01 4.133500 2.874475       6.817436 -1.753797      5.197892 19.14694 8.198621 14.41212 6.594116 4.734823       10.52139 
1 1 1 -1  23 39 o 15.61882 6.220505 2.609666       3.554414 2.668092       4.992131 2.549594       5.061998 17.00538 7.136054 16.96544 7.156388 0.3994560E-01  10.10629 
1 1 1 -1  23 40 o 21.87519 7.407214 7.756373       4.698579 10.28613       8.881847 6.773308       5.536755 23.37867 9.639403 20.63764 7.892695 2.741024       12.45844 
1 1 1 -1  23 41 o 15.70528 6.325842 3.055454       3.718826 2.456577       5.481237 3.566254       5.062154 16.42399 7.189670 17.02213 7.167074 -0.5981388     10.15176 
1 1 1 -1  23 42 o 17.57268 6.751441 4.978467       4.063887 8.220215       5.573918 1.299734       5.937725 20.69029 7.917573 15.47785 7.068847 5.212446       10.61398 
1 1 1 -1  23 43 o 24.07882 6.485474 10.04662       3.890061 9.641397       5.930103 10.35270       5.153944 20.91043 8.122820 22.46242 7.753871 -1.551989      11.22955 
1 1 1 -1  23 44 o 11.01874 5.367485 -4.038616      4.643888 -1.887780      5.587872 -8.840986      8.349694 12.81280 6.154192 12.81706 6.409615 -0.4257202E-02 8.885789 
1 1 1 -1  24 1  o 182.0023 4.047310 404.1082       17.95062 396.1391       21.60571 421.8686       32.25454 180.0780 4.928110 185.5799 7.145555 -5.501938      8.680162 
1 1 1 -1  24 2  o 32.51126 6.291707 13.35612       4.804481 10.30731       5.424116 24.45992       10.35141 28.53506 7.646175 43.78166 9.931244 -15.24660      12.53370 
1 1 1 -1  24 3  o 192.2037 5.180210 451.3882       24.24092 506.4411       36.04885 405.9458       32.75156 203.3245 7.287332 181.9921 7.400311 21.33234       10.38604 
1 1 1 -1  24 4  o 42.05614 4.265276 21.80312       4.310935 19.22151       5.438991 26.16527       7.070070 39.23605 5.868477 45.80901 6.517023 -6.572968      8.769870 
1 1 1 -1  24 5  o 259.6295 3.883225 822.3519       24.56873 784.7286       37.55920 850.4910       32.48202 253.3907 6.082606 263.9200 5.050502 -10.52937      7.906052 
1 1 1 -1  24 6  o 143.9720 3.655250 253.0132       12.81386 253.8445       15.60516 251.2925       22.45124 144.1464 4.447832 143.2094 6.449834 0.9369507      7.834767 
1 1 1 -1  24 7  o 290.1655 4.200855 1027.524       29.70431 975.5062       45.27372 1066.842       39.36068 282.3978 6.578833 295.5013 5.465968 -13.10355      8.553236 
1 1 1 -1  24 8  o 83.93160 2.746743 85.98721       5.610408 97.64656       8.601448 77.35365       7.401666 89.36691 3.959481 79.53028 3.830360 9.836632       5.509006 
1 1 1 -1  24 9  o 31.87403 4.391211 12.63558       3.320270 10.75515       4.681043 14.53953       4.710234 29.06662 6.739924 34.00134 5.898490 -4.934717      8.956492 
1 1 1 -1  24 10 o 187.9224 3.584000 430.8791       16.41280 430.4662       33.40472 431.0105       18.84422 187.2852 7.333455 187.9103 4.115205 -0.6250916     8.409189 
1 1 1 -1  24 11 o 78.24174 3.190062 74.79910       6.069628 98.97985       13.93633 69.13877       6.742709 89.69736 6.418186 75.18069 3.691663 14.51667       7.404153 
1 1 1 -1  24 12 o 198.5760 4.211900 481.4658       20.38173 541.1091       39.05555 459.1429       23.89338 209.8785 7.649021 193.7624 5.064591 16.11603       9.173745 
1 1 1 -1  24 13 o 113.9804 4.276888 158.8763       11.85832 0.000000       0.000000 158.8763       11.85832 ?        ?        113.9804 4.276888 0.000000       4.276888 
1 1 1 -1  24 14 o 87.70464 4.231202 94.16212       9.016527 0.000000       0.000000 94.16212       9.016527 ?        ?        87.70464 4.231202 0.000000       4.231202 
1 1 1 -1  24 15 o 77.53532 3.225575 73.48392       6.081256 79.43401       9.506545 69.36267       7.911794 80.46111 4.871243 75.22628 4.334229 5.234833       6.520318 
1 1 1 -1  24 16 o 205.3176 3.790696 514.7708       18.96624 539.0038       28.06463 494.3993       25.73161 209.7702 5.494820 200.9420 5.259367 8.828201       7.606181 
1 1 1 -1  24 17 o 106.3351 3.530283 138.2044       9.135239 134.1470       17.44888 139.7364       10.72212 104.2972 6.904149 106.8627 4.125103 -2.565536      8.042621 
1 1 1 -1  24 18 o 142.6881 3.170418 248.5159       11.02403 230.0642       23.39925 253.7798       12.49798 136.6338 7.051466 144.1582 3.557660 -7.524429      7.898109 
1 1 1 -1  24 19 o 98.88566 3.284928 119.5197       7.904821 118.2652       16.18210 119.9129       9.059256 97.85523 6.828868 99.00002 3.761941 -1.144791      7.796515 
1 1 1 -1  24 20 o 24.70355 5.096796 7.748853       2.966416 6.710914       6.386430 8.034390       3.349688 24.66647 8.624587 25.10830 5.615503 -0.4418259     10.29162 
1 1 1 -1  24 21 o 200.3299 3.314336 490.1837       16.17999 484.0484       26.29606 493.9217       20.52538 198.5895 5.438855 200.9453 4.191574 -2.355865      6.866617 
1 1 1 -1  24 22 o 198.4037 3.294902 480.8788       15.93046 479.4930       25.98167 481.7137       20.16585 197.6130 5.400363 198.4207 4.170551 -0.8077240     6.823299 
1 1 1 -1  24 23 o 64.16539 2.811731 50.36550       4.385862 58.90807       8.483747 47.24967       5.123658 69.11745 5.072230 62.08648 3.399439 7.030964       6.106038 
1 1 1 -1  24 24 o 98.74287 2.689866 119.1356       6.466477 132.0462       11.78994 113.5807       7.733469 103.6724 4.678785 96.34255 3.298840 7.329857       5.724803 
1 1 1 -1  24 25 o 44.89106 3.377793 24.78196       3.668020 30.50473       7.387369 22.90943       4.225723 49.34140 6.286428 43.05739 4.075850 6.284008       7.492111 
1 1 1 -1  24 26 o 247.5890 4.277433 751.7952       25.80779 738.7668       36.92102 764.2429       36.08865 244.4852 6.202057 248.8753 5.950490 -4.390106      8.594990 
1 1 1 -1  24 27 o 180.2642 4.053899 398.5763       17.80814 419.9761       32.56688 389.4482       21.26975 183.5490 7.295484 177.8467 4.912434 5.702301       8.795231 
1 1 1 -1  24 28 o 29.82025 5.374317 11.30671       3.761812 14.04965       6.617194 9.996953       4.572577 32.80283 8.278893 27.79860 6.805634 5.004234       10.71712 
1 1 1 -1  24 29 o 30.76649 5.394063 12.04806       3.896811 12.20998       6.506948 11.95752       4.865862 30.56491 8.452372 30.37118 6.749589 0.1937237      10.81663 
1 1 1 -1  24 30 o 90.14267 3.190566 99.81697       6.997594 99.19225       10.67171 100.2882       9.268227 89.36329 4.919461 90.07874 4.234043 -0.7154465     6.490625 
1 1 1 -1  24 31 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 -1  24 32 o 44.53306 4.055241 24.77213       4.352613 22.63181       6.733301 26.30854       5.704810 41.60861 6.880919 45.54469 5.235140 -3.936081      8.646025 
1 1 1 -1  24 33 o 101.4085 3.988128 128.0868       9.836302 130.8074       11.89025 122.1880       17.50783 101.9889 4.797565 96.42538 7.510016 5.563553       8.911621 
1 1 1 -1  24 34 o 80.34614 3.240701 80.12843       6.332105 79.61311       9.528939 80.53593       8.473576 79.11748 4.967449 79.95741 4.365385 -0.8399277     6.613028 
1 1 1 -1  24 35 o 38.84366 4.546277 19.38903       4.222088 20.54353       6.553820 18.56997       5.520208 38.57954 7.236868 37.14519 6.324844 1.434349       9.611239 
1 1 1 -1  24 36 o 54.82943 3.742902 38.11654       4.971027 41.72822       7.558264 35.36332       6.599133 56.06743 5.607048 51.80601 5.301917 4.261425       7.716820 
1 1 1 -1  24 37 o 25.36832 7.773253 9.679321       5.258722 0.000000       0.000000 9.679321       5.258722 ?        ?        25.36832 7.773253 0.000000       7.773253 
1 1 1 -1  24 38 f 23.69304 6.471483 8.293306       3.841305 10.14943       5.776080 6.821409       5.143612 25.09623 8.205155 21.37529 7.712627 3.720938       11.26096 
1 1 1 -1  24 39 o 15.78574 6.654046 2.180753       4.371297 -11.27825      7.939571 8.035214       5.236413 13.51627 6.670872 22.20356 7.806066 -8.687293      10.26816 
1 1 1 -1  24 40 o 10.04732 4.829968 -3.781418      3.458554 -1.857246      5.195859 -5.312220      4.634415 13.61979 6.356906 11.24430 5.450644 2.375494       8.373755 
1 1 1 -1  24 41 o 13.38866 5.944531 0.6699368      3.874108 5.039226       5.474967 -3.711661      5.482673 18.05663 7.517489 12.76059 6.120426 5.296037       9.693929 
1 1 1 -1  24 42 o 12.97632 5.714851 1.027884       3.510963 0.7107031      5.807833 1.210553       4.407500 14.74701 6.827458 13.98049 6.264779 0.7665272      9.266155 
1 1 1 -1  24 43 o 11.88493 5.442716 -0.9073140E-01 3.551744 -0.4463608     5.545392 0.1566277      4.624847 13.56393 6.404688 13.13963 6.086523 0.4243011      8.835485 
1 1 1 -1  24 44 o 11.77823 5.611793 -1.577563      4.447935 -6.014367      5.429742 7.473639       7.755274 11.07117 5.473793 17.52914 8.033115 -6.457966      9.720769 
1 1 1 -1  25 1  o 95.69170 3.578169 111.8630       8.329245 114.5211       10.14725 106.3730       14.58299 96.76717 4.313972 93.02866 6.473086 3.738510       7.778895 
1 1 1 -1  25 2  o 232.9862 3.624907 662.2350       20.58084 659.5113       32.12511 664.1312       26.80371 232.2951 5.675033 233.2181 4.716247 -0.9230042     7.378955 
1 1 1 -1  25 3  o 75.09602 2.883800 68.86975       5.267569 70.97141       7.888849 67.17880       7.076172 76.13380 4.269167 74.09341 3.933158 2.040390       5.804784 
1 1 1 -1  25 4  o 113.8939 3.097975 158.3211       8.590350 136.5661       15.31841 168.3012       10.37531 105.5148 5.982004 117.3954 3.631086 -11.88057      6.997797 
1 1 1 -1  25 5  o 182.7893 3.168436 407.5206       14.11341 385.3331       21.44313 424.4783       18.74634 177.5439 4.961033 186.4878 4.125059 -8.943817      6.451973 
1 1 1 -1  25 6  o 93.67939 3.477071 107.2106       7.923908 106.4015       9.490129 109.0731       14.39910 93.26948 4.186052 94.21016 6.308287 -0.9406815     7.570833 
1 1 1 -1  25 7  o 59.01484 3.416401 42.63060       4.892216 38.72710       6.356954 48.30063       7.661514 56.11642 4.691503 62.67263 5.059468 -6.556213      6.899885 
1 1 1 -1  25 8  o 148.3396 3.240017 268.4292       11.71225 246.5056       15.81927 295.0264       17.42402 141.9967 4.577621 155.3542 4.607543 -13.35751      6.494926 
1 1 1 -1  25 9  o 189.0393 3.558712 436.0607       16.39385 423.9254       22.56735 449.6203       23.85502 186.1940 4.978157 191.7395 5.109984 -5.545486      7.134002 
1 1 1 -1  25 10 o 140.8862 3.762383 242.4333       12.90561 267.9911       23.73496 231.7054       15.37747 147.7713 6.607883 137.6493 4.590740 10.12193       8.046056 
1 1 1 -1  25 11 o 178.1591 4.079997 387.5566       17.71349 406.9594       31.93976 378.9380       21.28709 182.0185 7.215084 176.0085 4.967995 6.009933       8.760046 
1 1 1 -1  25 12 o 211.0499 5.398041 545.1756       27.73964 0.000000       0.000000 545.1756       27.73964 ?        ?        211.0499 5.398041 0.000000       5.398041 
1 1 1 -1  25 13 o 115.7948 3.154468 163.7261       8.892964 164.9093       18.46750 163.3689       10.14692 115.8003 6.571257 115.6303 3.605431 0.1699829      7.495368 
1 1 1 -1  25 14 o 160.5988 3.339489 314.7917       13.06948 356.9796       29.04348 304.0796       14.63498 170.3929 7.009539 157.8029 3.805759 12.59000       7.976054 
1 1 1 -1  25 15 o 243.9063 4.176107 726.8901       24.82165 798.8261       53.71681 707.3602       27.98899 254.3698 8.678506 240.5038 4.775612 13.86603       9.905703 
1 1 1 -1  25 16 o 20.87266 6.164579 5.421261       3.352165 8.090808       8.172318 4.881247       3.675610 27.43156 9.742029 20.24594 6.539968 7.185614       11.73364 
1 1 1 -1  25 17 o 106.2332 3.022009 137.8493       7.815388 164.6486       18.46153 131.9979       8.626505 115.6035 6.580490 103.9164 3.411171 11.68703       7.412080 
1 1 1 -1  25 18 o 110.4811 3.034291 149.1058       8.161494 147.2543       12.68961 150.4120       10.65846 109.5869 4.763125 110.8660 3.951439 -1.279076      6.188799 
1 1 1 -1  25 19 f 75.81479 2.814361 70.24827       5.190574 79.43150       9.721048 66.58594       6.138951 80.37750 4.987552 73.75412 3.424990 6.623383       6.050308 
1 1 1 -1  25 20 o 108.9103 2.747904 144.8653       7.287186 129.9861       12.20897 153.0996       9.082450 102.8944 4.883063 111.9037 3.334318 -9.009338      5.912866 
1 1 1 -1  25 21 o 107.3865 2.739701 140.8577       7.163643 135.0768       12.31091 143.8171       8.808499 104.8828 4.829666 108.4450 3.337133 -3.562149      5.870445 
1 1 1 -1  25 22 o 36.25317 4.000321 16.27496       3.475389 18.50352       7.117932 15.57738       3.982345 37.96735 7.948570 35.33987 4.743924 2.627487       9.256597 
1 1 1 -1  25 23 o 78.51852 2.802981 75.38703       5.354649 61.71917       9.385061 81.98369       6.520019 70.65266 5.494109 81.83434 3.276090 -11.18168      6.396718 
1 1 1 -1  25 24 o 92.37989 2.730345 104.3265       6.139801 98.72686       10.87533 106.9462       7.438662 89.51257 5.005595 93.46709 3.270920 -3.954521      5.979540 
1 1 1 -1  25 25 o 125.6248 2.805219 192.8327       8.587731 195.7406       15.01388 191.4188       10.46948 126.1140 4.894620 125.0283 3.439487 1.085648       5.982255 
1 1 1 -1  25 26 o 222.0591 3.920269 604.6125       21.21390 623.0007       44.44984 599.1888       24.14059 222.9272 8.196174 220.8467 4.485603 2.080460       9.343334 
1 1 1 -1  25 27 o 117.5157 2.806368 168.8983       8.036678 160.5008       13.65215 173.3516       9.941833 114.0118 4.925391 118.8955 3.434952 -4.883629      6.004862 
1 1 1 -1  25 28 o 47.59406 3.955788 28.02887       4.546549 26.81420       7.587576 28.70932       5.678983 45.79983 7.021948 47.97357 4.927701 -2.173740      8.578462 
1 1 1 -1  25 29 o 13.69340 5.876090 -0.1098304     3.515976 -1.373187      6.503836 0.4118418      4.179319 17.66120 7.778127 15.38118 6.496097 2.280018       10.13403 
1 1 1 -1  25 30 o 99.10854 4.887793 122.3456       11.76842 122.3456       11.76842 0.000000       0.000000 99.10854 4.887793 ?        ?        0.000000       4.887793 
1 1 1 -1  25 31 o 67.13589 3.385355 55.70028       5.520662 49.45085       8.409140 60.43407       7.318731 62.49020 5.580763 69.63093 4.334677 -7.140728      7.066423 
1 1 1 -1  25 32 o 99.72353 4.057812 123.8952       9.840511 128.8993       12.01248 113.6859       17.15805 101.2255 4.884164 92.96528 7.641137 8.260216       9.068740 
1 1 1 -1  25 33 o 55.03511 3.642549 37.83234       4.857701 47.80801       7.781173 31.46150       6.218308 61.11153 5.276629 49.51524 5.232494 11.59629       7.431138 
1 1 1 -1  25 34 o 12.41673 5.547800 -1.035764      3.429373 -2.886472      5.506667 0.1367663      4.383106 14.70527 6.750164 15.04323 6.508755 -0.3379583     9.377025 
1 1 1 -1  25 35 o 14.51846 6.050303 1.118061       3.551406 4.894901       5.616718 -1.397663      4.584055 20.54705 7.925961 14.04670 6.333702 6.500354       10.14577 
1 1 1 -1  25 36 o 23.75223 7.663288 8.270587       5.047688 0.000000       0.000000 8.270587       5.047688 ?        ?        23.75223 7.663288 0.000000       7.663288 
1 1 1 -1  25 37 f 24.52497 7.170823 9.100003       4.555208 18.30431       9.503251 6.354409       5.190328 31.32211 10.53437 20.99390 7.721247 10.32821       13.06103 
1 1 1 -1  25 38 o 53.05146 4.612904 37.92897       5.904364 45.58784       11.95207 35.45654       6.790840 50.14649 10.12975 50.11308 5.659700 0.3341675E-01  11.60362 
1 1 1 -1  25 39 o 50.51941 4.011488 34.00558       4.898035 34.55544       7.399832 33.57682       6.534356 47.80785 6.521491 48.24368 5.665972 -0.4358253     8.639045 
1 1 1 -1  25 40 o 12.54788 5.785575 -1.043673      4.108720 3.312891       5.394417 -7.063047      6.340861 16.83868 7.252768 12.58471 6.160715 4.253968       9.516147 
1 1 1 -1  25 41 o 17.49970 6.550727 5.010653       3.766487 2.604395       6.084296 6.505742       4.795928 16.18077 7.296343 19.03008 7.328395 -2.849300      10.34128 
1 1 1 -1  25 42 o 30.56625 5.756394 14.92342       4.130473 19.95302       6.639494 11.74790       5.275642 30.66114 8.560328 23.82417 7.844544 6.836967       11.61103 
1 1 1 -1  25 43 o 16.86430 6.569943 5.236803       3.888226 6.161604       6.041618 4.582941       5.080098 17.26663 7.553644 16.15065 6.997503 1.115978       10.29673 
1 1 1 -1  26 1  o 48.64409 3.698725 29.04136       4.351614 23.70753       5.681749 36.60963       6.768011 43.70315 5.453322 54.49247 5.158091 -10.78933      7.506306 
1 1 1 -1  26 2  o 52.93014 3.422872 34.32294       4.391317 41.88602       6.577262 28.24022       5.898550 58.37621 4.662242 47.79862 5.144924 10.57759       6.943108 
1 1 1 -1  26 3  o 142.4807 2.891414 247.5871       10.03928 247.2410       15.49396 247.8375       13.18036 142.2177 4.476247 142.4536 3.800196 -0.2359009     5.871820 
1 1 1 -1  26 4  o 153.3913 2.960214 286.9740       11.06522 317.3051       17.91096 268.2523       14.07174 161.1184 4.566421 148.1978 3.899848 12.92061       6.005082 
1 1 1 -1  26 5  o 95.59892 3.081519 111.5942       7.169456 106.3400       12.66718 114.0706       8.696426 93.08362 5.610364 96.60976 3.700731 -3.526146      6.720982 
1 1 1 -1  26 6  o 74.68749 3.170637 68.17124       5.757598 61.15277       7.673754 77.21138       8.709113 70.61865 4.482284 79.38007 4.520908 -8.761421      6.366277 
1 1 1 -1  26 7  o 274.0515 4.045887 916.9433       27.01980 978.4647       44.07299 879.8958       34.20102 282.6708 6.398165 268.2775 5.231410 14.39334       8.264633 
1 1 1 -1  26 8  o 175.5269 3.103152 375.8571       13.27342 360.0034       20.18348 387.9389       17.61956 171.5688 4.832304 178.2487 4.056323 -6.679901      6.309114 
1 1 1 -1  26 9  o 179.3576 3.133716 392.4703       13.69668 378.9865       21.03808 402.3901       18.04472 176.0167 4.909538 181.5287 4.079140 -5.512054      6.383020 
1 1 1 -1  26 10 o 124.2550 3.645457 188.6264       11.02636 0.000000       0.000000 188.6264       11.02636 ?        ?        124.2550 3.645457 0.000000       3.645457 
1 1 1 -1  26 11 o 173.3403 3.993765 366.9561       16.87012 0.000000       0.000000 366.9561       16.87012 ?        ?        173.3403 3.993765 0.000000       3.993765 
1 1 1 -1  26 12 o 76.26431 3.200449 71.10316       5.934744 63.41391       12.58445 73.30235       6.730137 71.48419 7.327784 77.40532 3.577611 -5.921127      8.154490 
1 1 1 -1  26 13 o 108.7326 3.094791 144.3924       8.191911 142.1861       17.37549 145.0229       9.289086 107.4392 6.669368 108.9341 3.503792 -1.494858      7.533726 
1 1 1 -1  26 14 o 210.4069 3.832953 540.7742       19.65304 534.3420       40.25111 542.7877       22.51986 208.1457 7.950116 210.7167 4.385618 -2.570984      9.079536 
1 1 1 -1  26 15 o 155.4571 3.326206 295.0505       12.60073 276.9867       18.42249 310.9308       17.27323 150.3461 5.035392 159.3984 4.451217 -9.052307      6.720752 
1 1 1 -1  26 16 o 91.87982 2.831658 103.1161       6.332547 101.3400       11.07749 103.9783       7.717995 90.84125 5.023616 92.20917 3.440778 -1.367920      6.088980 
1 1 1 -1  26 17 o 56.84367 3.495337 39.61680       4.818390 42.59233       8.455902 38.18608       5.863461 58.60820 6.005433 55.70633 4.353862 2.901878       7.417636 
1 1 1 -1  26 18 o 145.8413 2.931060 259.6472       10.41697 264.4114       17.65970 257.1049       12.90033 146.8376 4.942304 145.0046 3.653666 1.832977       6.146189 
1 1 1 -1  26 19 o 65.68576 2.974967 52.78722       4.749640 66.90810       9.039276 47.40165       5.582376 73.71227 5.062946 62.16412 3.701813 11.54815       6.271909 
1 1 1 -1  26 20 o 87.12183 2.790533 92.75844       5.916838 90.32980       10.54127 93.87556       7.149300 85.67773 5.071494 87.58764 3.355744 -1.909912      6.081206 
1 1 1 -1  26 21 o 79.95821 2.849252 78.17012       5.542877 87.33857       10.42753 74.55920       6.543979 84.21383 5.105127 78.02314 3.450307 6.190689       6.161732 
1 1 1 -1  26 22 o 100.8630 2.743101 124.3279       6.736064 129.2360       12.00952 122.0751       8.136444 102.5204 4.820557 99.87106 3.347906 2.649384       5.869092 
1 1 1 -1  26 23 o 65.77056 2.932776 52.96174       4.688704 60.56577       8.935210 50.07228       5.507960 69.98733 5.277903 63.87434 3.552569 6.112988       6.362154 
1 1 1 -1  26 24 o 90.46792 2.975350 100.1522       6.550549 120.6523       16.15408 96.11793       7.166171 98.46772 6.773390 88.57735 3.325833 9.890366       7.545858 
1 1 1 -1  26 25 o 96.11674 2.766268 113.0202       6.472579 107.7335       11.50884 115.4659       7.827854 93.39301 5.075943 97.06744 3.314138 -3.674423      6.062071 
1 1 1 -1  26 26 o 193.8601 3.311376 460.3414       15.64346 459.8728       25.84012 460.6125       19.65443 192.7912 5.505747 193.6199 4.165569 -0.8287201     6.904000 
1 1 1 -1  26 27 o 86.40788 2.752819 91.45703       5.789120 114.4997       11.33537 83.32610       6.733482 96.17908 4.852037 82.36464 3.361836 13.81444       5.902898 
1 1 1 -1  26 28 o 50.85397 3.340636 31.88387       4.116978 34.50800       7.917582 30.91143       4.819808 52.15023 6.361686 49.94307 3.993457 2.207161       7.511241 
1 1 1 -1  26 29 o 47.23526 6.387393 28.56230       7.164105 28.56230       7.164105 0.000000       0.000000 47.23526 6.387393 ?        ?        0.000000       6.387393 
1 1 1 -1  26 30 o 17.61022 6.308953 3.425122       3.434731 4.670794       5.746465 2.732729       4.284252 21.38423 8.072825 17.76255 6.903025 3.621679       10.62178 
1 1 1 -1  26 31 o 51.40298 5.098884 33.53395       6.302945 34.16182       7.665685 32.22362       11.07417 51.38625 6.250028 47.96932 9.804877 3.416924       11.62749 
1 1 1 -1  26 32 o 96.08043 3.225317 114.4169       7.540973 108.7830       11.24591 119.0198       10.16492 92.58839 5.002858 97.36431 4.294752 -4.775917      6.593442 
1 1 1 -1  26 33 o 53.22876 3.772272 35.63070       4.861414 33.47282       7.461438 37.22242       6.408271 50.27624 6.222805 53.82515 4.940687 -3.548908      7.945671 
1 1 1 -1  26 34 o 70.18617 3.401888 61.81827       5.801126 56.52585       8.635612 66.17074       7.831297 65.63864 5.447836 71.85366 4.495000 -6.215019      7.062857 
1 1 1 -1  26 35 o 19.89193 6.993320 5.286715       4.202772 10.63858       8.480075 3.544145       4.838850 26.30292 9.832683 18.33339 7.272097 7.969526       12.22968 
1 1 1 -1  26 36 o 28.13492 6.488549 11.48003       4.357850 3.479931       8.747593 14.12091       5.025919 20.64307 9.058329 31.03404 6.831157 -10.39097      11.34540 
1 1 1 -1  26 37 o 15.05669 6.455185 1.362494       4.235917 18.46390       8.688191 -3.970168      4.851606 31.13410 10.05466 12.42669 5.903706 18.70741       11.65975 
1 1 1 -1  26 38 o 22.93900 6.707834 8.235324       3.985788 4.575570       5.987170 11.14823       5.341444 18.77134 7.841687 25.70409 7.826011 -6.932751      11.07874 
1 1 1 -1  26 39 o 16.12877 6.716970 3.035253       4.373000 11.63087       5.762011 -8.641071      6.715660 25.15927 8.193149 12.60027 6.202720 12.55900       10.27626 
1 1 1 -1  26 40 o 8.952504 4.419892 -5.981153      3.495296 -5.381648      5.102883 -6.511035      4.797436 11.54967 5.626197 10.74515 5.280207 0.8045216      7.715872 
1 1 1 -1  26 41 o 16.09197 6.412588 4.088873       3.779426 8.364490       6.182817 1.538117       4.775528 19.76643 8.084400 14.37973 6.475945 5.386700       10.35835 
1 1 1 -1  26 42 o 15.41601 6.274466 3.797543       3.702324 4.350014       5.933076 3.445223       4.737986 16.29836 7.288565 15.37521 6.708467 0.9231539      9.905892 
1 1 1 -1  27 1  o 136.7743 2.911517 228.1818       9.704208 241.6992       15.22710 218.9369       12.59278 140.5968 4.449927 133.8649 3.864323 6.731903       5.893627 
1 1 1 -1  27 2  o 107.8775 2.822810 142.0379       7.414388 121.8991       10.73849 160.3848       10.24963 99.80064 4.426453 114.5733 3.675795 -14.77264      5.753690 
1 1 1 -1  27 3  o 289.9240 4.237120 1026.544       29.93581 956.8594       45.02370 1081.760       40.07787 279.4485 6.611550 297.3779 5.530442 -17.92935      8.619651 
1 1 1 -1  27 4  o 98.64367 2.798799 118.7786       6.721059 123.4563       10.29901 115.3088       8.870238 100.4545 4.216549 97.11920 3.755028 3.335251       5.646195 
1 1 1 -1  27 5  o 112.1409 2.808347 153.4841       7.668473 153.6327       11.71175 153.3726       10.14576 112.0693 4.296394 112.0291 3.721525 0.4026794E-01  5.684079 
1 1 1 -1  27 6  o 343.5017 4.833746 1442.309       40.46214 1482.568       64.69173 1416.440       51.85754 347.4290 7.640935 340.0388 6.258169 7.390228       9.876668 
1 1 1 -1  27 7  o 71.84490 2.964182 63.07765       5.178490 61.95258       7.714153 64.00054       6.986740 71.06525 4.477213 72.28485 3.981732 -1.219604      5.991630 
1 1 1 -1  27 8  o 236.5734 4.086470 683.5977       23.55864 625.5955       43.67403 707.4010       27.97816 225.4086 7.963417 240.5499 4.772851 -15.14128      9.284186 
1 1 1 -1  27 9  o 151.3297 3.252563 279.4813       11.99461 272.7693       22.24651 282.2322       14.24203 149.0714 6.137071 151.9755 3.848679 -2.904144      7.244030 
1 1 1 -1  27 10 o 185.0285 3.616954 418.0027       16.30864 397.5874       32.37125 424.9470       18.87967 179.7148 7.407498 186.4978 4.154172 -6.783066      8.492831 
1 1 1 -1  27 11 o 78.44315 3.251626 75.23399       6.202248 83.43225       13.03721 72.83575       7.051302 82.20184 6.562750 77.13487 3.762658 5.066963       7.564872 
1 1 1 -1  27 12 o 35.50571 4.861284 15.70700       4.095826 4.375757       8.242610 19.42225       4.719767 24.33419 9.540722 39.52742 5.012434 -15.19322      10.77728 
1 1 1 -1  27 13 o 219.2356 3.941200 587.2900       21.05599 610.1360       44.05321 580.5253       23.97145 222.2941 8.146078 217.8736 4.514958 4.420532       9.313616 
1 1 1 -1  27 14 o 92.97913 3.128049 105.6525       7.077441 108.1326       15.20499 104.9665       7.996525 93.56743 6.713069 92.63656 3.548843 0.9308701      7.593391 
1 1 1 -1  27 15 o 55.80729 4.028619 38.26873       5.441897 37.26683       11.43014 38.56240       6.188258 54.18187 8.970498 55.95412 4.578371 -1.772247      10.07131 
1 1 1 -1  27 16 o 246.6212 4.243555 743.9509       25.50330 736.7566       37.02862 750.4436       35.17680 244.8105 6.211870 247.2701 5.837794 -2.459534      8.524504 
1 1 1 -1  27 17 o 40.14159 4.138682 19.91643       3.990522 37.37572       8.350461 14.74922       4.542816 54.77362 6.375093 34.22815 5.642815 20.54548       8.513705 
1 1 1 -1  27 18 o 82.19840 2.885972 82.59246       5.771879 85.98516       10.46983 81.11118       6.918097 83.57934 5.165736 81.39516 3.495954 2.184174       6.237510 
1 1 1 -1  27 19 o 18.86959 6.207481 4.193285       3.303755 10.00660       6.861366 2.438725       3.769492 28.45815 8.906042 17.01616 6.511209 11.44199       11.03238 
1 1 1 -1  27 20 o 91.55406 2.837025 102.4632       6.321970 117.7223       11.80926 96.33342       7.484841 97.82726 4.969949 88.69826 3.469524 9.128998       6.061187 
1 1 1 -1  27 21 o 110.1509 2.809819 148.2977       7.536118 144.3418       13.25219 150.1883       9.161717 108.2979 5.035262 110.7719 3.398012 -2.474045      6.074565 
1 1 1 -1  27 22 o 97.80019 2.802231 116.9493       6.671628 129.4820       12.41623 111.8620       7.910664 102.5360 4.984025 95.56815 3.402178 6.967834       6.034511 
1 1 1 -1  27 23 o 73.79542 3.115523 66.71395       5.590083 77.62225       14.05468 64.66401       6.092741 78.67660 7.418156 72.60558 3.453451 6.071022       8.182626 
1 1 1 -1  27 24 o 51.32819 3.316236 32.38676       4.125788 26.28440       8.102441 34.52290       4.793825 45.31028 7.607428 52.93911 3.740021 -7.628822      8.477070 
1 1 1 -1  27 25 o 49.56444 3.330557 30.23135       3.999400 21.60427       7.621037 33.51023       4.698348 40.82705 7.946022 52.13322 3.722734 -11.30618      8.774851 
1 1 1 -1  27 26 o 96.78162 2.774311 114.7342       6.536356 129.5111       12.20701 108.7944       7.739353 102.2661 4.912621 94.11990 3.379814 8.146248       5.962968 
1 1 1 -1  27 27 o 92.78267 3.315356 105.8270       7.484013 114.3408       11.49300 99.55891       9.861359 95.94095 4.932343 89.64504 4.528804 6.295906       6.696124 
1 1 1 -1  27 28 o 14.58273 6.259869 -0.5183155E-01 3.992812 -4.440573      5.941478 3.562463       5.391830 14.94482 6.914314 20.02461 7.754568 -5.079786      10.38947 
1 1 1 -1  27 29 o 60.85321 2.981165 45.63843       4.407394 41.61628       8.413589 47.15956       5.174121 57.05419 6.148379 61.74306 3.452595 -4.688866      7.051452 
1 1 1 -1  27 30 o 34.87241 5.313640 15.65077       4.373052 2.803927       6.639088 25.49604       5.811976 20.45103 8.372401 44.62246 5.458340 -24.17143      9.994528 
1 1 1 -1  27 31 o 76.06259 3.320326 71.81993       6.139603 63.43726       9.266834 78.37837       8.196730 70.38356 5.445181 78.99356 4.273988 -8.610001      6.922208 
1 1 1 -1  27 32 o 13.19435 5.680576 0.7596419E-01  3.306391 1.576727       5.542881 -0.7530196     4.119576 17.83491 7.503920 13.91768 6.157210 3.917231       9.706701 
1 1 1 -1  27 33 o 53.32252 3.786248 35.97251       4.887892 36.17794       7.706843 35.83427       6.322078 51.91482 6.215221 52.51235 5.000702 -0.5975342     7.977217 
1 1 1 -1  27 34 o 15.29237 6.446327 1.222275       4.102890 9.775812       8.925334 -1.069505      4.619959 25.75488 9.976109 14.20227 6.385052 11.55261       11.84448 
1 1 1 -1  27 35 o 25.49556 6.892197 9.601850       4.383620 2.742018       8.065777 12.47745       5.222203 19.88202 8.712006 28.76509 7.405866 -8.883076      11.43442 
1 1 1 -1  27 36 o 22.84186 7.150924 8.048253       4.423095 13.24675       8.725568 6.250498       5.131214 26.62470 9.969704 20.55239 7.655423 6.072311       12.56982 
1 1 1 -1  27 37 o 41.96998 4.517022 23.86476       4.547195 24.57065       7.032138 23.35750       5.961164 39.25297 7.626431 39.66535 6.383736 -0.4123840     9.945580 
1 1 1 -1  27 38 o 20.43568 7.178020 6.840226       4.427009 4.174677       5.994067 10.03919       6.566488 18.08374 7.713986 23.08540 8.647833 -5.001661      11.58838 
1 1 1 -1  27 39 o 11.93627 5.480926 -0.8201111     3.634632 2.086220       5.781083 -2.719840      4.673933 15.99373 7.170292 12.22358 5.803572 3.770149       9.224670 
1 1 1 -1  27 40 o 33.71652 5.319735 17.23026       4.226123 18.36960       6.477803 16.38598       5.576286 29.97803 8.486033 29.62259 7.666267 0.3554382      11.43610 
1 1 1 -1  27 41 o 17.28862 6.641707 5.339967       3.932613 7.550535       6.081892 3.751626       5.155356 18.74081 7.871182 15.89144 6.964177 2.849373       10.50977 
1 1 1 -1  28 1  f 324.2594 4.625948 1285.167       36.55354 1270.847       56.88900 1295.237       47.70440 321.7095 7.256518 325.1727 6.020164 -3.463196      9.428649 
1 1 1 -1  28 2  o 265.6718 3.991624 862.0276       25.84231 903.4338       41.49111 835.7844       33.03167 271.5086 6.270979 261.3849 5.185776 10.12363       8.137411 
1 1 1 -1  28 3  o 206.7704 3.412471 521.8417       17.19465 494.7608       26.02005 542.8352       22.90966 201.0151 5.316486 210.7587 4.460639 -9.743576      6.939909 
1 1 1 -1  28 4  o 228.8299 4.704595 640.1569       26.23440 748.6963       49.27041 597.2084       30.99320 246.4948 8.213898 220.7612 5.766065 25.73360       10.03572 
1 1 1 -1  28 5  o 134.8628 2.899851 221.8977       9.530245 239.5165       15.07502 210.1684       12.30002 139.9250 4.426630 131.1290 3.853387 8.796051       5.868871 
1 1 1 -1  28 6  o 342.6603 5.392405 1437.188       45.02797 1475.994       90.28127 1424.338       51.95067 344.7680 10.75887 340.8575 6.254351 3.910492       12.44468 
1 1 1 -1  28 7  o 66.35484 3.393181 53.88725       5.468538 73.53498       10.18471 45.92821       6.482207 77.31297 5.440538 61.14562 4.379321 16.16735       6.984118 
1 1 1 -1  28 8  o 228.2241 4.020197 636.3643       22.35862 613.4969       42.35750 645.1969       26.32487 223.1204 7.802320 229.6880 4.703184 -6.567520      9.110221 
1 1 1 -1  28 9  o 220.0178 3.520544 591.0864       18.87573 576.9365       29.14799 601.3061       24.77146 216.9622 5.517483 221.7470 4.584138 -4.784836      7.173350 
1 1 1 -1  28 10 o 145.1214 3.346002 257.1222       11.83297 244.5306       23.51593 261.3914       13.69278 140.9079 6.869125 146.2241 3.846040 -5.316269      7.872541 
1 1 1 -1  28 11 o 111.9216 3.189559 153.0414       8.690354 165.4710       18.77862 149.6539       9.803286 115.8660 6.679068 110.6294 3.641306 5.236626       7.607171 
1 1 1 -1  28 12 o 101.7190 3.190956 126.4427       7.899896 113.0051       16.09682 130.7062       9.066928 95.60987 6.956366 103.3797 3.604572 -7.769852      7.834792 
1 1 1 -1  28 13 f 71.94563 3.331308 63.34670       5.824715 70.43418       12.79171 61.49274       6.542329 75.32925 7.050247 70.83488 3.804040 4.494362       8.011036 
1 1 1 -1  28 14 o 212.9030 4.454615 554.6487       23.11149 548.7756       41.34823 557.3173       27.87194 210.6063 8.071495 213.1432 5.370388 -2.536835      9.694849 
1 1 1 -1  28 15 o 22.52025 6.459419 6.381269       3.728885 8.556299       8.268844 5.826040       4.177806 27.85869 9.808052 21.93419 6.960958 5.924503       12.02717 
1 1 1 -1  28 16 o 66.29712 3.424181 53.84648       5.513323 40.54642       11.45829 57.85337       6.289222 56.58733 8.577897 68.68748 3.771841 -12.10015      9.370544 
1 1 1 -1  28 17 o 59.82643 3.323487 43.86752       4.826285 43.52190       9.000309 44.00701       5.717885 59.13338 6.344920 59.85067 3.942353 -0.7172890     7.469950 
1 1 1 -1  28 18 o 27.54133 5.639630 9.657962       3.657557 5.991275       7.061179 11.00249       4.275884 24.46211 9.004373 29.35771 6.172944 -4.895597      10.91714 
1 1 1 -1  28 19 o 110.7321 2.876886 149.8712       7.756471 147.7930       13.55940 150.8820       9.456480 109.5948 5.090996 111.0217 3.499679 -1.426933      6.177863 
1 1 1 -1  28 20 o 67.42693 3.096890 55.68390       5.074977 59.26657       9.800105 54.37109       5.932372 69.11618 5.874150 66.55516 3.671951 2.561020       6.927399 
1 1 1 -1  28 21 o 53.74023 3.319421 35.45881       4.325866 34.11702       8.598120 35.91357       5.005527 52.03671 6.954383 54.01787 3.827346 -1.981159      7.938012 
1 1 1 -1  28 22 o 14.40072 5.914284 0.8584870      3.326346 6.225572       10.84523 0.3011707      3.494785 27.78971 10.92928 14.12519 5.951620 13.66452       12.44471 
1 1 1 -1  28 23 o 44.27363 3.885998 24.22752       4.150115 38.75995       8.272903 19.34054       4.797435 55.59034 6.213048 39.28681 5.133715 16.30353       8.059590 
1 1 1 -1  28 24 o 86.63156 2.816438 91.91792       5.937928 108.6597       11.27672 85.49502       6.984688 93.71162 4.955643 83.43928 3.442502 10.27235       6.034005 
1 1 1 -1  28 25 o 12.09566 5.223958 -0.2718148     2.813348 -1.153715      6.502264 -0.6869296E-01 3.120564 17.83770 7.819029 12.96080 5.548235 4.876908       9.587499 
1 1 1 -1  28 26 o 70.94633 3.625439 62.07083       6.247183 55.49491       9.203159 67.69017       8.507495 66.46836 5.737924 73.78548 4.756800 -7.317116      7.453249 
1 1 1 -1  28 27 o 69.84239 4.045845 60.48190       6.856484 76.13441       9.753635 45.19065       9.640422 77.98168 5.161651 59.37515 6.784414 18.60653       8.524724 
1 1 1 -1  28 28 o 51.11700 3.214377 32.30486       3.983767 24.50902       7.445478 35.43196       4.715550 43.14434 7.344511 53.43602 3.643068 -10.29168      8.198401 
1 1 1 -1  28 29 o 30.48635 4.511924 11.84841       3.250916 7.628193       6.670435 13.16306       3.722991 24.82849 8.803041 32.03800 4.926111 -7.209509      10.08762 
1 1 1 -1  28 30 o 19.82261 6.427163 5.022192       3.547902 0.9676542      6.237027 6.961809       4.313849 18.39997 7.859388 22.89190 7.045149 -4.491934      10.55481 
1 1 1 -1  28 31 o 12.77058 5.390001 0.4536086      2.874189 7.988153       6.016900 -1.773945      3.271586 24.38850 8.379537 11.52478 5.257185 12.86372       9.892150 
1 1 1 -1  28 32 o 47.57469 3.992872 28.78297       4.586439 32.13428       7.245008 26.54178       5.924771 48.90435 6.219852 44.82388 5.542005 4.080475       8.330689 
1 1 1 -1  28 33 o 15.72354 5.998520 2.647111       3.192987 -1.323809      8.274994 3.341756       3.461017 18.42722 8.388487 16.91265 6.289657 1.514565       10.48458 
1 1 1 -1  28 34 o 18.90209 6.757761 4.803456       3.938656 0.4128764      7.584697 6.424585       4.608781 18.23870 8.191978 21.15868 7.330943 -2.919985      10.99324 
1 1 1 -1  28 35 o 46.00556 4.594390 28.32459       5.081981 30.11766       9.900419 27.68312       5.921650 41.15583 9.976521 44.57626 5.572752 -3.420422      11.42745 
1 1 1 -1  28 36 o 29.47480 5.727401 12.54651       3.965553 12.92197       6.126277 12.27573       5.202543 27.36153 8.391104 27.53427 7.535679 -0.1727409     11.27817 
1 1 1 -1  28 37 o 13.97374 6.145998 0.7658727      4.048292 -0.2690659     5.469024 2.020260       6.020995 14.81942 6.774209 16.70001 7.413007 -1.880584      10.04204 
1 1 1 -1  28 38 o 31.27612 5.850018 14.88568       4.294813 17.39289       6.680881 13.11978       5.606872 29.95645 8.662738 26.65229 7.997499 3.304161       11.78995 
1 1 1 -1  28 39 o 15.55984 6.326080 3.421044       3.758613 1.285553       5.662989 5.102462       5.024983 15.06111 6.887941 17.52253 7.240155 -2.461427      9.993176 
1 1 1 -1  28 40 o 17.62137 6.660692 5.512946       3.914739 10.79784       6.129055 1.871244       5.087771 21.72554 8.305276 14.69073 6.643785 7.034816       10.63567 
1 1 1 -1  28 41 o 14.65740 6.190158 3.089938       3.794674 3.080031       5.701996 3.097814       5.083980 15.37582 6.985274 15.16744 6.767320 0.2083845      9.725774 
1 1 1 -1  29 1  o 67.17159 3.171792 55.19181       5.177237 60.74931       7.700158 50.60677       6.994100 70.34617 4.515677 64.18138 4.500367 6.164787       6.375315 
1 1 1 -1  29 2  o 280.7153 4.156074 962.9551       28.43056 975.9908       44.78890 954.1580       36.79366 282.0099 6.517333 279.1480 5.408816 2.861877       8.469411 
1 1 1 -1  29 3  o 100.0161 2.848860 122.1513       6.936407 122.9790       10.39042 121.4860       9.316355 100.2191 4.264227 99.65359 3.843544 0.5655289      5.740773 
1 1 1 -1  29 4  f 195.8371 3.729070 468.4235       17.79638 514.8404       36.02418 453.4385       20.46843 204.5086 7.239894 192.5943 4.361189 11.91425       8.451984 
1 1 1 -1  29 5  o 107.4656 3.188609 141.0911       8.341158 132.2862       14.99171 145.0389       10.03840 103.7064 5.957184 108.9011 3.788420 -5.194717      7.059757 
1 1 1 -1  29 6  o 136.0842 2.906581 225.9848       9.638873 228.6319       14.80214 224.0360       12.70073 136.6683 4.450411 135.3641 3.854175 1.304214       5.887344 
1 1 1 -1  29 7  o 123.8353 2.859243 187.1318       8.628423 172.9707       12.83413 198.8118       11.65568 118.8498 4.439109 127.5172 3.754967 -8.667458      5.814247 
1 1 1 -1  29 8  f 44.66325 3.741070 24.53920       4.034383 25.04033       5.790952 24.06660       5.623684 44.89187 5.401964 44.00554 5.354249 0.8863335      7.605866 
1 1 1 -1  29 9  o 117.8573 3.133098 169.6894       8.990448 172.8730       16.38537 168.3181       10.75377 118.6066 5.685624 117.3116 3.766578 1.294983       6.820076 
1 1 1 -1  29 10 o 187.9074 3.608945 431.3581       16.52571 409.3778       30.52695 440.4698       19.65479 182.2995 6.884029 189.7851 4.249816 -7.485550      8.090166 
1 1 1 -1  29 11 o 162.6786 3.510865 323.2888       13.91812 369.1215       31.30085 311.9934       15.53880 172.8938 7.446633 159.7511 3.991514 13.14275       8.448936 
1 1 1 -1  29 12 o 14.47680 6.337956 -0.9744650     4.260511 -1.359295      7.672158 -0.8028754     5.123047 19.59516 8.543379 16.13502 7.008644 3.460144       11.05036 
1 1 1 -1  29 13 o 107.1230 3.260395 140.2880       8.501255 147.7291       17.97902 138.1452       9.647944 109.3362 6.781237 106.2459 3.732172 3.090294       7.740432 
1 1 1 -1  29 14 o 87.58887 3.260182 93.84518       6.946535 83.08777       14.10186 97.29182       7.982162 81.77576 7.148243 89.13735 3.682655 -7.361588      8.041102 
1 1 1 -1  29 15 o 146.9094 3.331390 263.7129       11.92645 281.5502       25.59334 258.7650       13.47948 150.9226 6.977721 145.4127 3.807223 5.509857       7.948807 
1 1 1 -1  29 16 o 107.2970 3.194381 140.7895       8.343083 172.6027       19.32290 133.4996       9.249714 118.1048 6.741811 104.4221 3.640530 13.68269       7.661950 
1 1 1 -1  29 17 o 94.30840 3.180715 108.8143       7.299437 102.8693       15.50894 110.5059       8.273053 90.96049 7.051742 94.98791 3.580466 -4.027420      7.908653 
1 1 1 -1  29 18 o 164.6456 3.170347 331.3492       12.72017 335.7618       21.76095 329.0589       15.67752 165.1509 5.414373 163.9372 3.924312 1.213654       6.686977 
1 1 1 -1  29 19 o 75.27725 3.304107 69.43365       6.046371 69.24123       10.14207 69.53976       7.531041 74.78197 5.606169 75.21783 4.124424 -0.4358521     6.959886 
1 1 1 -1  29 20 o 36.20174 4.402956 16.31723       3.804494 17.93400       7.614691 15.77938       4.391955 37.13739 8.585723 35.43260 5.244685 1.704792       10.06088 
1 1 1 -1  29 21 o 31.04210 5.331972 12.20715       3.888157 10.73253       11.91467 12.38291       4.113343 31.67293 11.68989 31.21290 5.614248 0.4600258      12.96817 
1 1 1 -1  29 22 o 40.32153 3.946841 20.14419       3.828518 24.34247       7.875671 18.84510       4.380995 43.48391 7.714803 38.84326 4.725404 4.640652       9.046968 
1 1 1 -1  29 23 o 72.80660 2.961522 65.00663       5.243418 86.34120       10.51841 57.95182       6.048538 83.40235 5.201189 68.62154 3.629956 14.78081       6.342629 
1 1 1 -1  29 24 o 97.73363 3.459845 117.4288       8.227181 134.5113       12.56873 104.6223       10.88256 104.1286 4.967521 91.83498 4.880329 12.29357       6.963754 
1 1 1 -1  29 25 o 63.78544 3.848922 50.31507       5.954858 49.29241       8.803555 51.17764       8.085121 62.53563 5.844594 63.93701 5.234968 -1.401375      7.846283 
1 1 1 -1  29 26 o 61.08455 3.300225 46.04776       4.894353 57.10923       8.884804 41.22874       5.864363 67.34448 5.460703 57.55745 4.210152 9.787037       6.895263 
1 1 1 -1  29 27 o 15.19344 5.773159 2.145256       2.950173 -0.8672749     6.484145 2.931673       3.312939 17.72816 7.788417 16.76532 6.168283 0.9628334      9.935147 
1 1 1 -1  29 28 o 15.78494 5.734590 2.688956       2.849874 2.918150       6.201541 2.627598       3.208756 20.02805 8.132092 16.14983 6.046119 3.878222       10.13343 
1 1 1 -1  29 29 o 13.38953 5.677829 0.3741662      3.214219 -4.615528      5.722254 2.674152       3.885016 14.24201 6.655151 16.97183 6.579672 -2.729823      9.358585 
1 1 1 -1  29 30 o 38.94213 3.789501 19.15380       3.550722 26.62096       6.879318 16.44209       4.145611 44.58926 6.524142 35.62862 4.904792 8.960644       8.162193 
1 1 1 -1  29 31 o 33.54460 5.173094 14.84644       4.092932 22.59155       6.747865 10.33845       5.148060 40.29728 7.132503 26.89203 7.548605 13.40526       10.38528 
1 1 1 -1  29 32 f 36.15169 4.446939 17.03178       3.835201 9.145276       9.221485 18.68122       4.217235 25.37888 10.04782 37.75285 4.684411 -12.37397      11.08613 
1 1 1 -1  29 33 o 47.11477 3.831116 28.59929       4.360713 35.81337       11.12232 27.28894       4.740235 46.06709 10.17914 45.69359 4.307886 0.3735008      11.05318 
1 1 1 -1  29 34 o 25.30523 5.779425 9.174031       3.485518 14.60927       8.769674 8.154367       3.798419 27.96315 10.07318 23.43718 6.448812 4.525965       11.96060 
1 1 1 -1  29 35 o 13.40681 5.556539 1.389757       2.972147 -1.153527      5.245411 2.592417       3.607062 14.36741 6.592492 15.50428 6.235246 -1.136868      9.074098 
1 1 1 -1  29 36 o 41.93616 5.002034 24.63695       5.011113 27.64516       6.927271 21.33478       7.257849 42.01949 7.012064 34.68864 8.622973 7.330849       11.11417 
1 1 1 -1  29 37 o 14.85792 6.145481 2.459162       3.625424 -0.9500921     5.669139 4.818159       4.715755 14.33555 6.673974 17.82340 7.142659 -3.487856      9.775454 
1 1 1 -1  29 38 o 19.96436 6.740109 6.912108       3.890274 9.087243       6.052151 5.380585       5.078417 21.05825 8.198740 17.88902 7.322908 3.169237       10.99292 
1 1 1 -1  29 39 o 21.98487 6.766985 8.709121       3.979750 10.96930       6.190519 7.116992       5.195709 22.02123 8.363939 19.00358 7.536268 3.017647       11.25837 
1 1 1 -1  29 40 o 10.70919 5.091378 -2.048610      3.621162 -11.36797      5.854756 3.725125       4.608335 10.28884 5.175959 15.58209 6.707447 -5.293252      8.472331 
1 1 1 -1  30 1  o 117.6119 3.183975 168.9913       9.117111 187.7367       13.00339 150.8662       12.78644 123.8341 4.315632 110.9361 4.740706 12.89804       6.410848 
1 1 1 -1  30 2  o 139.2639 4.743721 237.6023       16.07531 0.000000       0.000000 237.6023       16.07531 ?        ?        139.2639 4.743721 0.000000       4.743721 
1 1 1 -1  30 3  o 158.9936 4.053771 309.1895       15.69353 0.000000       0.000000 309.1895       15.69353 ?        ?        158.9936 4.053771 0.000000       4.053771 
1 1 1 -1  30 4  o 204.7065 3.860188 512.0798       19.25644 492.1632       37.20632 519.3667       22.50510 199.6909 7.659993 206.0533 4.481933 -6.362305      8.874865 
1 1 1 -1  30 5  o 59.31328 3.856539 43.17265       5.544017 32.68846       10.15301 47.62676       6.617708 50.77368 8.506399 62.24815 4.390768 -11.47447      9.572757 
1 1 1 -1  30 6  o 179.4314 3.208351 393.1056       14.02866 399.6301       21.83738 388.5209       18.30565 180.5843 4.967032 178.2472 4.214309 2.337128       6.513970 
1 1 1 -1  30 7  o 157.8919 3.066959 304.3497       11.80060 298.2963       18.05274 308.8661       15.59323 156.0295 4.753431 158.8961 4.030302 -2.866577      6.232049 
1 1 1 -1  30 8  o 134.4270 2.918575 220.5799       9.560785 224.2850       14.66395 217.8403       12.60942 135.3166 4.453031 133.4409 3.881788 1.875610       5.907433 
1 1 1 -1  30 9  o 196.0559 3.340555 469.4901       15.96007 473.6997       25.01893 466.6016       20.72459 196.5175 5.228987 195.2854 4.354919 1.232117       6.804970 
1 1 1 -1  30 10 o 10.23201 4.852987 -3.983134      3.251741 -5.316239      4.043211 -1.541730      5.471597 11.21011 5.343707 16.17793 7.129192 -4.967811      8.909578 
1 1 1 -1  30 11 o 234.2632 5.803146 674.0087       33.12865 0.000000       0.000000 674.0087       33.12865 ?        ?        234.2632 5.803146 0.000000       5.803146 
1 1 1 -1  30 12 o 155.9888 3.928308 297.7960       14.92070 317.0561       27.55218 289.8037       17.74852 160.1721 7.076303 153.7238 4.743567 6.448303       8.519125 
1 1 1 -1  30 13 o 155.4693 3.435590 295.4136       13.01614 320.9699       27.80293 288.2402       14.73005 161.0982 7.099562 153.4456 3.942518 7.652679       8.120790 
1 1 1 -1  30 14 o 143.2786 3.361792 250.9130       11.73784 242.7669       24.31810 253.3874       13.40246 139.9926 7.152043 143.8670 3.826247 -3.874390      8.111219 
1 1 1 -1  30 15 o 131.4709 3.300175 211.4156       10.56475 211.0279       22.25698 211.5284       12.00317 130.4703 7.026249 131.4323 3.751478 -0.9619293     7.965034 
1 1 1 -1  30 16 o 38.18410 4.943214 18.19256       4.491850 -2.946596      9.558876 24.18338       5.088692 21.07274 9.347941 44.13549 4.809007 -23.06275      10.51240 
1 1 1 -1  30 17 o 115.7860 3.204610 164.0376       9.033362 166.1995       19.38880 163.4382       10.20910 115.6709 6.909952 115.5053 3.631528 0.1655426      7.806115 
1 1 1 -1  30 18 f 159.0758 3.426363 309.6712       13.28231 286.1054       26.93892 317.2401       15.26704 151.5737 7.314826 160.9066 3.893541 -9.332870      8.286516 
1 1 1 -1  30 19 o 54.59065 4.194436 36.78502       5.537172 0.000000       0.000000 36.78502       5.537172 ?        ?        54.59065 4.194436 0.000000       4.194436 
1 1 1 -1  30 20 o 182.0823 3.650301 406.4341       16.19692 406.8333       24.55853 406.1268       21.54751 181.3625 5.563303 181.5182 4.875669 -0.1557159     7.397465 
1 1 1 -1  30 21 o 94.57932 2.959095 109.5951       6.811716 115.0929       12.44788 107.2451       8.138352 96.34181 5.322742 93.43945 3.580755 2.902367       6.415091 
1 1 1 -1  30 22 o 24.24624 7.116219 7.523109       4.478772 6.190881       7.042202 8.427979       5.803795 24.32272 8.985387 25.89098 8.202995 -1.568254      12.16661 
1 1 1 -1  30 23 f 36.38341 5.600168 16.83710       4.806237 10.22728       7.416524 21.62276       6.310689 28.43382 9.297666 41.06090 6.524891 -12.62708      11.35873 
1 1 1 -1  30 24 o 35.59171 5.597088 16.18442       4.694441 22.21752       7.306562 11.94314       6.126204 41.17360 7.560659 29.98283 8.165676 11.19077       11.12842 
1 1 1 -1  30 25 o 62.26405 3.283395 47.85926       4.964309 52.38274       8.669812 45.65269       6.055240 64.38226 5.581027 60.57895 4.126425 3.803307       6.940839 
1 1 1 -1  30 26 o 60.83520 3.922130 46.07444       5.783526 50.12330       8.768889 42.95709       7.694336 62.69237 5.805703 58.13882 5.496102 4.553547       7.994581 
1 1 1 -1  30 27 o 17.18606 5.747479 3.601632       2.829227 8.000575       6.365959 2.518899       3.158278 24.97553 8.617660 15.91899 5.990223 9.056538       10.49509 
1 1 1 -1  30 28 o 18.43553 5.885046 4.346233       2.982547 1.931678       6.053258 5.120348       3.427470 18.84954 7.880363 19.87649 6.304592 -1.026949      10.09198 
1 1 1 -1  30 29 f 37.09673 4.523053 17.67229       4.004436 25.69011       6.945747 13.68041       4.900937 43.60805 6.754277 31.69830 6.560976 11.90975       9.416298 
1 1 1 -1  30 30 o 24.08284 6.074101 7.975260       3.563671 4.026390       5.764659 10.41783       4.533779 19.87060 7.919237 27.23741 6.840808 -7.366812      10.46475 
1 1 1 -1  30 31 o 35.17028 4.628036 16.22954       3.870349 14.15191       9.779628 16.61538       4.214434 29.20149 10.62098 35.37151 5.031033 -6.170027      11.75230 
1 1 1 -1  30 32 o 32.27255 4.863773 13.97329       3.706383 8.867304       8.609601 15.13482       4.106371 24.23996 9.672267 33.38889 5.217466 -9.148928      10.98975 
1 1 1 -1  30 33 o 14.38296 5.881201 1.772567       3.271120 0.4680725      8.301265 2.012358       3.559091 18.38776 8.382607 14.99719 6.133751 3.390574       10.38706 
1 1 1 -1  30 34 o 15.65425 5.907595 3.069906       3.076691 2.283863       5.509505 3.426114       3.708870 16.93662 7.312562 16.56894 6.427321 0.3676834      9.735708 
1 1 1 -1  30 35 o 28.14072 5.608035 11.56361       3.710689 10.15521       6.224480 12.34009       4.621738 23.68132 8.491946 27.95406 6.841170 -4.272734      10.90480 
1 1 1 -1  30 36 o 23.08344 5.715283 8.118446       3.197756 3.781457       5.538615 10.28701       3.916456 17.27938 7.394145 25.49689 6.332139 -8.217512      9.734957 
1 1 1 -1  30 37 o 12.38830 5.363187 0.9305843      2.979493 9.746136       5.368353 -2.993779      3.581797 22.34417 7.899615 10.43475 4.989305 11.90942       9.343290 
1 1 1 -1  30 38 o 20.94670 6.593759 7.732436       3.755582 10.19722       6.031421 6.171654       4.799559 21.57862 8.241379 18.30097 7.247846 3.277647       10.97504 
1 1 1 -1  30 39 f 11.52228 5.326154 -0.5628549     3.514105 0.1526731      5.352966 -1.104765      4.658484 13.74317 6.426875 12.49124 5.889658 1.251930       8.717384 
1 1 1 -1  31 1  o 75.67039 3.069392 70.02402       5.648228 70.86095       8.300431 69.30228       7.708026 75.96326 4.504172 75.15559 4.225699 0.8076706      6.176091 
1 1 1 -1  31 2  o 95.47833 2.953500 111.3900       6.863652 107.2178       9.926079 115.2126       9.501196 93.51276 4.367897 96.98779 4.028763 -3.475029      5.942176 
1 1 1 -1  31 3  o 65.94901 3.478961 53.27961       5.571280 51.73880       7.457877 55.22527       8.380550 64.83296 4.753489 66.93188 5.178356 -2.098923      7.029298 
1 1 1 -1  31 4  o 111.3590 3.204113 151.5628       8.685954 156.7820       11.95442 145.7260       12.64199 113.1176 4.344808 108.9865 4.771561 4.131088       6.453305 
1 1 1 -1  31 5  o 146.4638 3.337971 262.0289       11.91376 273.5320       16.75179 250.2560       16.94711 149.4061 4.606553 142.8525 4.875383 6.553589       6.707436 
1 1 1 -1  31 6  o 26.73600 6.360817 9.140355       4.083761 10.84027       5.531097 7.103145       6.055020 29.11137 7.685153 24.81813 8.408673 4.293240       11.39155 
1 1 1 -1  31 7  o 215.6179 4.623700 569.3218       24.29465 672.1063       45.67754 528.7749       28.68913 232.9554 8.058391 207.4576 5.680161 25.49771       9.859102 
1 1 1 -1  31 8  o 171.9029 4.147768 361.5565       17.37536 398.5237       31.59171 345.5244       20.80467 179.5792 7.233870 167.7962 5.093846 11.78305       8.847381 
1 1 1 -1  31 9  o 81.45580 4.033280 81.36985       7.981118 102.7317       14.71689 72.46983       9.499313 91.07952 6.677097 76.70438 5.111176 14.37514       8.408790 
1 1 1 -1  31 10 o 160.0996 3.517155 313.3182       13.72201 313.6753       27.73644 313.2025       15.78972 159.2313 7.166391 159.9348 4.054577 -0.7034607     8.233879 
1 1 1 -1  31 11 o 147.0170 3.401979 264.1865       12.18808 279.0974       25.36915 259.7122       13.89694 150.2064 6.949603 145.6397 3.919205 4.566666       7.978543 
1 1 1 -1  31 12 o 40.51091 5.669565 20.56153       5.443989 0.000000       0.000000 20.56153       5.443989 ?        ?        40.51091 5.669565 0.000000       5.669565 
1 1 1 -1  31 13 o 83.20415 3.397039 84.78632       6.873334 99.71217       14.88908 80.74406       7.748360 89.57260 6.873655 81.12173 3.931256 8.450867       7.918454 
1 1 1 -1  31 14 o 36.09748 5.167825 16.32740       4.416374 20.77467       9.912492 15.22597       4.933042 39.88838 10.16856 34.66070 6.060959 5.227684       11.83786 
1 1 1 -1  31 15 o 131.5608 3.311909 211.8104       10.60952 232.4727       23.09525 206.2838       11.94443 136.8422 6.948492 129.7462 3.781798 7.095917       7.910975 
1 1 1 -1  31 16 o 94.23784 3.244980 108.7609       7.440893 101.7410       15.77208 110.7707       8.439081 90.22712 7.233804 95.04172 3.650506 -4.814598      8.102722 
1 1 1 -1  31 17 o 102.7667 3.273400 129.3739       8.187158 116.0507       16.69872 133.5901       9.393667 96.33671 7.164328 104.3523 3.699856 -8.015587      8.063283 
1 1 1 -1  31 18 o 12.57922 6.038126 -7.632748      5.359557 0.000000       0.000000 -7.632748      5.359557 ?        ?        12.57922 6.038126 0.000000       6.038126 
1 1 1 -1  31 19 o 101.9889 3.898996 127.8957       9.672556 143.8202       17.60575 121.0110       11.57612 107.2086 6.773526 98.96601 4.814441 8.242599       8.310204 
1 1 1 -1  31 20 o 13.60499 6.217305 -2.936710      4.602501 -2.572172      8.197824 -3.104502      5.561771 19.33424 8.612037 15.18064 6.897482 4.153608       11.03370 
1 1 1 -1  31 21 f 54.45119 4.416472 36.81974       5.810024 40.50539       9.205549 34.37956       7.490370 56.42453 6.834036 52.18633 5.998912 4.238201       9.093459 
1 1 1 -1  31 22 o 37.64429 4.327671 17.73508       3.897856 19.53338       7.725873 17.12105       4.514542 38.30792 8.498454 36.76923 5.181937 1.538692       9.953703 
1 1 1 -1  31 23 o 34.65945 4.757172 15.19295       3.912073 7.259587       6.695411 19.30532       4.820532 24.82881 8.817883 39.01794 5.199121 -14.18913      10.23650 
1 1 1 -1  31 24 o 13.21784 5.560755 0.4067965      3.043389 -5.201716      6.140685 2.232980       3.504009 14.80104 6.909073 16.12459 6.249398 -1.323545      9.316129 
1 1 1 -1  31 25 f 47.42568 4.386230 28.27933       5.011801 33.59664       7.595038 24.17816       6.670195 50.96856 6.245279 42.99631 6.574617 7.972252       9.068026 
1 1 1 -1  31 26 f 17.71289 6.236975 3.666323       3.343788 5.625659       5.965574 2.768751       4.037684 22.21185 8.258092 17.31883 6.709485 4.893024       10.64017 
1 1 1 -1  31 27 f 27.92225 4.810568 10.12900       3.155150 8.560968       6.386924 10.63518       3.628857 25.25699 8.634718 28.40355 5.440801 -3.146557      10.20591 
1 1 1 -1  31 28 o 39.62900 4.265112 20.06081       4.054115 25.47402       7.228203 17.57636       4.896861 43.09897 7.131379 36.41714 5.705124 6.681835       9.132634 
1 1 1 -1  31 29 o 16.23350 6.133937 2.851951       3.319362 -2.660199      5.871814 5.440770       4.024043 15.15876 6.962769 20.23195 6.854897 -5.073189      9.770863 
1 1 1 -1  31 30 o 15.12178 5.934568 2.212457       3.191825 7.442927       9.000199 1.459988       3.413705 23.94059 9.768268 14.53768 5.983205 9.402917       11.45503 
1 1 1 -1  31 31 o 26.61417 5.534989 9.846335       3.472627 9.462484       7.627908 9.946689       3.900241 24.52774 9.291620 26.37761 6.176962 -1.849867      11.15747 
1 1 1 -1  31 32 o 17.24260 5.951787 4.064061       3.036657 1.651837       5.432166 5.160509       3.662337 16.65892 7.226733 19.01981 6.537423 -2.360895      9.744925 
1 1 1 -1  31 33 o 34.45550 4.279095 15.90967       3.515728 22.65644       6.629353 13.26966       4.146919 38.11750 7.403835 30.30504 5.826918 7.812454       9.421770 
1 1 1 -1  31 34 o 14.35112 5.822930 2.118528       3.177027 5.026305       5.216807 0.4043377      4.005472 18.70504 7.506853 13.69219 6.063709 5.012855       9.649943 
1 1 1 -1  31 35 o 23.55879 5.825220 8.499239       3.325234 12.29039       6.080176 6.881437       3.971854 25.34396 8.424445 20.43407 6.809392 4.909885       10.83232 
1 1 1 -1  31 36 o 12.99314 5.497791 1.466110       3.002690 3.242777       5.192012 0.5732489      3.680652 16.26792 7.061098 12.95619 5.770850 3.311734       9.119309 
1 1 1 -1  31 37 o 20.97346 6.141561 7.361734       3.339229 15.31985       6.290367 4.239215       3.940247 26.77748 8.546466 16.37799 6.540603 10.39949       10.76204 
1 1 1 -1  31 38 o 10.60191 4.915108 -0.9299480     3.025436 -6.162967      5.602018 1.224825       3.594753 11.47188 5.650711 13.01504 5.755058 -1.543159      8.065434 
1 1 1 -1  32 1  o 144.3998 3.066629 254.6535       10.79106 273.1816       16.75108 241.5098       14.10861 149.2724 4.610500 140.4319 4.127182 8.840530       6.187919 
1 1 1 -1  32 2  o 67.98886 3.159271 56.58315       5.220014 55.31173       7.499865 57.77780       7.269932 67.04205 4.618833 68.56133 4.374071 -1.519272      6.361298 
1 1 1 -1  32 3  o 60.23937 3.416085 44.48547       4.994150 45.14212       7.168541 43.86618       6.961593 60.49049 4.905087 59.63498 4.831746 0.8555031      6.885176 
1 1 1 -1  32 4  f 138.6894 3.011261 234.9062       10.17719 218.6631       14.90471 249.0945       13.93010 133.5281 4.587334 142.6335 4.011698 -9.105408      6.094042 
1 1 1 -1  32 5  o 184.9142 3.294938 417.8001       14.84751 404.2135       22.53757 428.2182       19.73543 181.4566 5.101871 187.0145 4.330471 -5.557846      6.691940 
1 1 1 -1  32 6  o 79.69466 3.389878 77.76125       6.568349 87.79893       9.036529 66.51756       9.563995 84.55749 4.400586 73.41231 5.383501 11.14518       6.953218 
1 1 1 -1  32 7  o 43.56353 4.506878 23.49561       4.715467 25.26399       6.104867 20.88009       7.424499 44.98784 5.696069 40.40215 7.823678 4.585693       9.677558 
1 1 1 -1  32 8  o 330.8253 4.750736 1342.068       38.29973 1304.542       58.78875 1369.740       50.48304 324.6776 7.430291 333.4665 6.212369 -8.788879      9.685183 
1 1 1 -1  32 9  o 177.2353 3.599245 384.1954       15.54525 413.4843       22.19452 355.9905       21.77995 183.4874 4.968247 170.1618 5.258723 13.32562       7.234477 
1 1 1 -1  32 10 o 224.2123 4.060547 615.5898       22.18605 620.0855       30.98633 610.8607       31.78037 224.4303 5.670227 222.6751 5.861772 1.755203       8.155479 
1 1 1 -1  32 11 o 156.4058 4.102921 299.8502       15.62453 296.6600       27.16326 301.4276       19.10073 154.6072 7.229702 156.5882 5.012041 -1.981018      8.797110 
1 1 1 -1  32 12 o 124.4489 3.945146 189.8711       11.94926 194.3038       20.92638 187.7265       14.55558 125.1164 6.890074 123.5513 4.843827 1.565063       8.422338 
1 1 1 -1  32 13 o 69.92729 4.251647 60.18354       7.210790 54.83409       12.25892 63.01353       8.916409 65.94630 7.777706 71.39252 5.159902 -5.446220      9.333665 
1 1 1 -1  32 14 o 24.85720 7.723713 7.683811       5.170387 6.219217       8.913290 8.426555       6.347442 26.16652 10.01246 26.33529 8.600852 -0.1687660     13.19940 
1 1 1 -1  32 15 o 101.5125 3.901535 126.5414       9.633452 136.0369       17.70275 122.5465       11.48248 104.3777 7.000280 99.71027 4.739195 4.667397       8.453631 
1 1 1 -1  32 16 o 202.7273 5.568376 508.2436       27.48308 0.000000       0.000000 508.2436       27.48308 ?        ?        202.7273 5.568376 0.000000       5.568376 
1 1 1 -1  32 17 o 32.05190 8.136188 13.42517       6.364992 0.000000       0.000000 13.42517       6.364992 ?        ?        32.05190 8.136188 0.000000       8.136188 
1 1 1 -1  32 18 f 77.62855 3.354240 74.03170       6.330319 73.31717       13.55550 74.23099       7.158879 76.06579 7.406595 77.64449 3.795036 -1.578697      8.322256 
1 1 1 -1  32 19 o 53.39682 3.748218 35.22242       4.846284 39.18621       10.95255 34.25741       5.404105 54.91213 8.455807 52.55232 4.256232 2.359810       9.466582 
1 1 1 -1  32 20 o 57.25667 3.619768 40.48960       5.024747 62.03539       12.55483 36.38017       5.483034 69.55042 7.527385 54.13485 4.188876 15.41557       8.614418 
1 1 1 -1  32 21 f 31.60307 5.506533 12.81645       4.086709 26.12304       9.847446 10.04788       4.491775 43.92797 9.477710 27.65673 6.729596 16.27125       11.62387 
1 1 1 -1  32 22 o 39.77121 4.437057 19.87161       4.227148 15.48710       7.329905 22.05646       5.174261 33.77005 8.814428 41.70139 5.204680 -7.931343      10.23635 
1 1 1 -1  32 23 o 113.4566 3.200090 158.8116       8.838816 160.9411       13.96296 157.3876       11.41765 113.1608 5.076363 112.4597 4.173473 0.7010498      6.571707 
1 1 1 -1  32 24 o 34.48583 4.426906 15.09409       3.634591 14.82386       6.901730 15.19779       4.275483 32.70222 8.561634 34.32717 5.279978 -1.624947      10.05881 
1 1 1 -1  32 25 o 59.43682 3.621794 44.09012       5.220944 48.83593       8.380975 41.08046       6.674179 61.55309 5.650371 56.82478 4.866552 4.728306       7.457212 
1 1 1 -1  32 26 o 19.89039 6.356853 5.165015       3.479157 6.752907       5.888793 4.313537       4.312235 23.03555 8.259858 19.25605 7.045135 3.779505       10.85630 
1 1 1 -1  32 27 o 25.62330 5.804472 8.891743       3.540066 6.314608       6.042952 10.23827       4.368062 22.39041 8.313946 27.18868 6.648897 -4.798275      10.64563 
1 1 1 -1  32 28 o 14.42638 5.630414 1.943792       2.859845 1.154204       5.572526 2.226109       3.332118 17.18564 7.386492 15.41948 6.059922 1.766152       9.554210 
1 1 1 -1  32 29 o 13.64426 5.759539 0.8400151      3.282537 0.000000       0.000000 0.8400151      3.282537 ?        ?        13.64426 5.759539 0.000000       5.759539 
1 1 1 -1  32 30 o 14.07684 5.738598 1.597499       3.102889 3.220804       7.630822 1.275924       3.396352 19.77559 8.572081 14.13052 5.904807 5.645077       10.40900 
1 1 1 -1  32 31 f 30.18816 4.740371 12.37376       3.372487 12.98017       5.994842 12.09298       4.079195 28.14710 8.225277 29.00364 5.970545 -0.8565311     10.16379 
1 1 1 -1  32 32 o 20.74521 5.849303 6.330135       3.083938 -0.9107805     4.995690 10.78857       3.920033 14.20880 6.487217 27.02490 6.097784 -12.81610      8.903199 
1 1 1 -1  32 33 o 25.11132 5.969466 9.479190       3.599010 12.54800       5.924335 7.684197       4.530916 26.56421 8.269859 21.65449 7.273800 4.909719       11.01357 
1 1 1 -1  32 34 o 27.40436 5.284801 10.99685       3.401355 17.43716       6.106905 8.100477       4.095386 31.41458 7.966879 22.06325 6.876966 9.351332       10.52444 
1 1 1 -1  32 35 f 18.79671 6.235685 5.765807       3.331612 10.14795       6.100458 3.903335       3.977076 22.26644 8.336493 16.34258 6.555935 5.923855       10.60554 
1 1 1 -1  32 36 o 14.74551 5.903421 2.993148       3.218102 2.047698       6.032197 3.369283       3.804768 15.61132 7.127918 15.44437 6.332166 0.1669483      9.534335 
1 1 1 -1  32 37 o 12.16509 5.355714 0.8446096      3.081049 -1.993804      5.770151 1.976654       3.644023 13.18599 6.312291 13.75681 5.943389 -0.5708189     8.669999 
1 1 1 -1  33 1  f 87.90972 3.447336 94.63133       7.370786 92.00842       9.541984 98.51191       11.60635 86.52260 4.541468 89.38985 5.352602 -2.867249      7.019636 
1 1 1 -1  33 2  f 41.60231 4.331578 21.42890       4.327134 16.42528       5.982534 26.91846       6.266308 35.84793 7.099547 46.45481 5.651495 -10.60688      9.074303 
1 1 1 -1  33 3  o 116.1643 2.972032 164.9525       8.406309 161.7559       12.47025 167.6151       11.38092 114.7985 4.466137 116.9460 3.999406 -2.147522      5.995134 
1 1 1 -1  33 4  o 126.6106 3.303398 196.0860       10.18347 202.9657       14.01479 188.3906       14.82233 128.6051 4.478740 123.8031 4.922835 4.801956       6.655330 
1 1 1 -1  33 5  o 49.53399 4.213487 30.26964       5.037829 32.73671       6.619975 26.87492       7.765477 51.33825 5.370888 46.09446 7.144304 5.243786       8.937982 
1 1 1 -1  33 6  o 11.74588 5.335993 -1.998536      3.326919 -4.349977      4.404226 1.126358       5.077153 12.44215 5.822074 17.60526 7.276305 -5.163110      9.318861 
1 1 1 -1  33 7  f 228.8298 3.705108 640.7968       20.66091 600.6454       30.84688 673.4648       27.82422 220.8038 5.737687 234.2189 4.874893 -13.41512      7.528986 
1 1 1 -1  33 8  o 121.7093 2.924719 180.9975       8.674491 174.7855       12.97264 186.0213       11.66625 119.2974 4.470235 123.1936 3.890919 -3.896202      5.926403 
1 1 1 -1  33 9  o 59.26591 3.316838 43.09338       4.771217 34.61166       6.758376 51.52083       6.736716 52.77850 5.327563 64.67930 4.298513 -11.90079      6.845447 
1 1 1 -1  33 10 o 98.85858 2.951782 119.5651       7.103103 119.6412       10.56945 119.5024       9.592126 98.64424 4.408013 98.66571 3.997723 -0.2146912E-01 5.950830 
1 1 1 -1  33 11 o 195.1631 3.831557 466.7341       18.22255 405.9917       34.54195 490.1582       21.45028 180.2177 7.884343 199.8184 4.405157 -19.60074      9.031516 
1 1 1 -1  33 12 o 70.60568 3.690656 61.24645       6.328035 46.25688       12.31872 66.61983       7.375554 60.13784 8.654755 73.57142 4.130445 -13.43357      9.589857 
1 1 1 -1  33 13 o 46.89781 4.468514 27.27331       5.045182 32.45975       10.74239 25.80558       5.714642 49.98983 9.155557 45.45238 5.256104 4.537449       10.55703 
1 1 1 -1  33 14 o 15.27662 6.378246 0.6360776      3.957756 -1.785603      8.385578 1.330130       4.489218 20.08110 8.838356 16.82122 6.885318 3.259872       11.20376 
1 1 1 -1  33 15 o 40.65821 5.414073 20.79509       5.231040 0.000000       0.000000 20.79509       5.231040 ?        ?        40.65821 5.414073 0.000000       5.414073 
1 1 1 -1  33 16 o 85.57230 3.310439 89.92654       6.890250 103.3412       15.79534 86.77400       7.657196 90.45970 7.225371 83.96282 3.751845 6.496880       8.141397 
1 1 1 -1  33 17 o 93.41706 3.306495 107.2239       7.515274 83.07104       15.28607 114.9229       8.630334 80.60764 7.882496 96.62392 3.671960 -16.01627      8.695806 
1 1 1 -1  33 18 o 49.17343 4.052613 30.01695       4.813190 32.44525       10.62636 29.39016       5.398756 49.42118 9.160631 48.51945 4.621827 0.9017220      10.26053 
1 1 1 -1  33 19 o 35.95263 4.879451 16.33845       4.164777 15.94783       9.160424 16.44023       4.676001 34.30094 10.20579 35.89116 5.523083 -1.590214      11.60442 
1 1 1 -1  33 20 o 117.0850 3.686805 169.3598       10.50620 162.5105       19.68880 172.0864       12.42266 112.5309 7.217838 117.7154 4.337992 -5.184479      8.421126 
1 1 1 -1  33 21 o 33.56163 5.811778 14.59470       4.581152 22.10034       9.912647 12.55622       5.165932 39.64633 10.20132 30.70836 7.052207 8.937971       12.40163 
1 1 1 -1  33 22 f 56.28994 4.688728 39.94121       6.373291 43.66049       11.08103 38.10268       7.790876 57.02476 8.210391 54.41243 5.973713 2.612328       10.15361 
1 1 1 -1  33 23 o 66.00260 3.568388 54.22997       5.718093 50.87173       8.699544 56.78438       7.587293 62.87387 5.741213 67.04295 4.673317 -4.169079      7.402798 
1 1 1 -1  33 24 o 21.79800 6.816500 6.297547       4.020221 14.46263       6.270348 0.5983481      5.238637 32.12484 8.031766 16.75072 7.180011 15.37413       10.77320 
1 1 1 -1  33 25 o 18.06544 6.309235 3.998359       3.417122 7.056516       5.563576 2.145899       4.330107 23.10954 8.051840 16.79751 6.804392 6.312027       10.54191 
1 1 1 -1  33 26 o 24.48677 5.532432 8.106163       3.223202 12.08304       6.030495 6.515735       3.813634 28.74651 8.204646 21.78543 6.608610 6.961081       10.53518 
1 1 1 -1  33 27 o 17.06022 6.174105 3.535988       3.299264 8.811098       8.667485 2.642149       3.567853 25.07257 9.797228 16.15711 6.293736 8.915459       11.64460 
1 1 1 -1  33 28 o 12.21972 5.431486 -0.5484210     3.243200 6.886909       7.708294 -2.147772      3.575032 22.73005 9.124061 11.61166 5.369114 11.11839       10.58659 
1 1 1 -1  33 29 o 14.54047 5.869857 1.901634       3.209922 3.958664       7.397756 1.424522       3.562785 19.98960 8.549496 14.47391 6.047989 5.515690       10.47244 
1 1 1 -1  33 30 o 33.12616 4.388769 14.67266       3.455746 23.67559       6.494131 11.11628       4.081620 39.84101 6.941022 27.56199 6.224578 12.27902       9.323259 
1 1 1 -1  33 31 o 17.23650 5.911788 4.200846       2.994449 2.937457       5.423615 4.754836       3.591461 17.30521 7.358313 18.17360 6.457803 -0.8683949     9.790198 
1 1 1 -1  33 32 o 15.63897 6.022525 3.152337       3.239020 4.622298       5.273264 2.261734       4.104578 18.27127 7.468700 15.36199 6.460043 2.909280       9.874899 
1 1 1 -1  33 33 o 32.15449 4.600933 14.49203       3.502518 13.54198       5.916630 15.00458       4.345806 26.97000 8.241579 31.49976 5.877574 -4.529760      10.12272 
1 1 1 -1  33 34 o 26.31670 5.635401 10.63838       3.505082 11.94254       6.203622 10.02683       4.248137 24.01254 8.491731 24.14755 6.884357 -0.1350174     10.93178 
1 1 1 -1  33 35 o 26.34936 5.541583 10.77274       3.445269 10.83924       6.218219 10.74328       4.138578 22.28587 8.401080 24.98205 6.672118 -2.696178      10.72825 
1 1 1 -1  33 36 o 10.80779 4.978498 -0.7214394     3.032059 2.723704       5.859468 -1.981286      3.543344 15.63669 7.094816 10.74713 5.088061 4.889555       8.730680 
1 1 1 -1  34 1  o 80.94698 3.506648 80.32877       6.900769 77.96446       8.996917 83.70742       10.75507 79.55713 4.661065 82.29755 5.392490 -2.740425      7.127726 
1 1 1 -1  34 2  f 59.59541 3.957992 43.70110       5.715522 46.01399       7.359894 40.18703       9.071928 60.98694 4.995955 56.60849 6.706429 4.378456       8.362761 
1 1 1 -1  34 3  o 24.13652 6.967675 7.381196       4.325612 5.623527       5.296574 10.90131       7.495569 22.45804 7.854155 29.57123 9.316195 -7.113190      12.18521 
1 1 1 -1  34 4  o 89.23490 3.327292 97.54620       7.222716 98.30251       9.552836 96.53685       11.03584 89.40246 4.398270 88.44289 5.142611 0.9595642      6.766921 
1 1 1 -1  34 5  o 106.1370 3.768720 138.1532       9.732113 134.1590       11.35233 149.2272       18.90271 104.4516 4.470330 109.4221 7.127760 -4.970543      8.413610 
1 1 1 -1  34 6  o 63.59877 3.289437 49.61771       5.080753 50.03391       7.199074 49.20468       7.171545 63.64918 4.673980 63.11263 4.696612 0.5365448      6.626029 
1 1 1 -1  34 7  o 82.40680 3.066509 83.16372       6.147311 81.19283       9.005404 84.88347       8.412110 81.17178 4.571097 83.07913 4.168373 -1.907349      6.186296 
1 1 1 -1  34 8  o 94.41465 2.966328 109.1128       6.816406 107.5134       10.21832 110.3952       9.149675 93.44140 4.500731 94.79786 3.969476 -1.356461      6.001110 
1 1 1 -1  34 9  o 26.31635 5.871249 8.892846       3.669495 5.281410       5.026523 13.01366       5.369322 21.77837 7.648704 31.73282 7.119050 -9.954454      10.44909 
1 1 1 -1  34 10 o 32.49148 4.998913 13.30086       3.831376 4.795416       5.211750 23.30296       5.651721 21.37695 7.756599 43.10091 5.506534 -21.72397      9.512453 
1 1 1 -1  34 11 o 87.19305 3.451063 93.31552       7.318334 119.5729       15.62523 85.93688       8.283023 97.82314 6.593149 83.54600 4.080778 14.27714       7.753860 
1 1 1 -1  34 12 o 17.00750 6.662815 2.205723       4.017215 -3.757377      7.821057 4.342758       4.682041 18.23760 8.243577 20.29334 7.353497 -2.055742      11.04674 
1 1 1 -1  34 13 o 89.76076 3.888901 99.19740       8.486289 0.000000       0.000000 99.19740       8.486289 ?        ?        89.76076 3.888901 0.000000       3.888901 
1 1 1 -1  34 14 o 43.49580 4.704196 23.62951       4.906940 42.35686       11.24496 19.22478       5.453558 57.22715 8.305835 38.88027 5.944442 18.34687       10.21388 
1 1 1 -1  34 15 f 51.48502 4.069270 32.86472       5.063958 41.33719       11.02736 30.60057       5.700576 56.41447 8.266510 49.50282 4.785139 6.911648       9.551583 
1 1 1 -1  34 16 o 47.38694 4.296532 27.96712       4.907629 19.16767       10.48785 30.43404       5.553105 37.45477 10.86056 49.35411 4.672828 -11.89934      11.82316 
1 1 1 -1  34 17 o 37.53232 5.025980 17.82580       4.481431 16.93314       10.20408 18.03912       4.988242 35.23608 10.83381 37.59226 5.617208 -2.356182      12.20346 
1 1 1 -1  34 18 o 99.82988 3.277159 122.8140       7.961690 129.3097       17.30085 121.0688       8.967684 100.3816 7.118751 98.95456 3.725500 1.427078       8.034673 
1 1 1 -1  34 19 o 112.9826 3.722160 158.0651       10.23409 163.2889       19.43420 156.0606       12.03853 112.4806 7.126754 111.8950 4.423676 0.5856476      8.388059 
1 1 1 -1  34 20 o 106.3141 3.783068 140.3559       9.785395 138.4020       17.48730 141.2466       11.80696 103.2670 6.990237 106.1931 4.573247 -2.926117      8.353323 
1 1 1 -1  34 21 f 25.71159 8.791123 8.641712       6.620440 12.59870       8.786907 3.445832       10.06892 30.14529 10.12949 23.90612 10.08908 6.239166       14.29672 
1 1 1 -1  34 22 o 75.94300 3.917365 72.22643       7.225162 66.82894       12.87927 74.70517       8.727921 70.46799 7.621164 76.79543 4.686103 -6.327438      8.946603 
1 1 1 -1  34 23 o 22.31348 6.373928 6.723405       3.638051 5.246410       7.995104 7.109085       4.085524 22.99464 9.270560 22.89649 6.816514 0.9815407E-01  11.50687 
1 1 1 -1  34 24 o 20.84430 6.353279 5.868128       3.518977 3.140125       7.641418 6.602378       3.964362 20.91146 8.805206 21.99398 6.750995 -1.082525      11.09539 
1 1 1 -1  34 25 o 17.44857 6.297032 3.688174       3.428953 4.141056       7.368438 3.562990       3.873984 21.11634 8.750131 17.66558 6.637130 3.450754       10.98254 
1 1 1 -1  34 26 o 32.40361 5.656332 14.31713       4.304065 0.000000       0.000000 14.31713       4.304065 ?        ?        32.40361 5.656332 0.000000       5.656332 
1 1 1 -1  34 27 o 17.01952 6.271621 3.604184       3.427105 0.3130308      7.715558 4.413119       3.825162 18.30547 8.238757 18.34201 6.646595 -0.3653526E-01 10.58557 
1 1 1 -1  34 28 o 19.77055 5.950643 5.588023       3.100640 2.283103       5.333626 7.275082       3.810722 17.15295 7.295416 22.19498 6.577227 -5.042032      9.822577 
1 1 1 -1  34 29 o 13.73073 5.686201 1.439304       3.108999 3.920426       5.392740 0.2041109      3.804984 18.33458 7.530257 13.52400 5.952944 4.810583       9.599079 
1 1 1 -1  34 30 o 30.14161 4.795257 12.55091       3.404332 10.91239       5.914198 13.36284       4.163215 25.09795 8.307526 30.28701 5.852558 -5.189056      10.16206 
1 1 1 -1  34 31 o 14.70733 5.944726 2.383151       3.296964 4.177795       5.485227 1.368062       4.125319 17.91711 7.496808 14.54433 6.303625 3.372779       9.794785 
1 1 1 -1  34 32 o 14.52856 5.841778 2.502134       3.165566 -1.314616      5.459101 4.435654       3.885515 13.94420 6.510839 17.21503 6.604780 -3.270826      9.274381 
1 1 1 -1  34 33 o 14.10893 5.847406 2.221344       3.291356 7.820308       5.917929 -0.2861636     3.960381 20.15927 8.027268 12.65922 5.778320 7.500043       9.890704 
1 1 1 -1  34 34 o 34.54481 4.695448 17.29935       3.850491 23.50784       6.845025 14.42534       4.657208 35.11882 8.155100 29.16395 6.694859 5.954874       10.55115 
1 1 1 -1  35 1  o 43.29820 4.242447 23.23693       4.418942 30.25585       6.377461 16.75507       6.128620 49.23445 5.404206 36.06739 7.224920 13.16706       9.022468 
1 1 1 -1  35 2  o 85.70460 3.072480 89.98380       6.406576 92.56761       9.515177 87.84113       8.664927 86.65827 4.521427 84.47374 4.222662 2.184532       6.186613 
1 1 1 -1  35 3  o 69.36282 3.227683 59.01967       5.440781 59.96122       7.901776 58.17085       7.502586 69.65854 4.682137 68.64088 4.510295 1.017662       6.501167 
1 1 1 -1  35 4  o 19.75664 6.543651 4.629016       3.669215 9.584342       5.122140 -0.5939750     5.258659 27.26603 7.483240 16.41656 7.116041 10.84948       10.32652 
1 1 1 -1  35 5  o 149.4646 3.078497 273.4040       11.21278 291.7317       17.55206 260.7674       14.57438 153.8772 4.686238 145.6618 4.110010 8.215408       6.233218 
1 1 1 -1  35 6  o 78.11909 3.102379 74.81884       5.894183 71.11264       8.600229 78.10160       8.094047 75.85668 4.675147 79.61813 4.186455 -3.761452      6.275620 
1 1 1 -1  35 7  o 73.84947 3.150917 66.90285       5.657455 67.74545       8.282850 66.16598       7.745822 74.03022 4.614232 73.21489 4.361185 0.8153305      6.349100 
1 1 1 -1  35 8  o 29.26650 5.979571 11.00360       4.120358 11.98325       5.113494 9.189985       6.957558 30.37998 7.044316 27.33829 9.008953 3.041689       11.43607 
1 1 1 -1  35 9  o 15.81123 6.355104 1.518222       3.744813 -1.740052      4.555620 8.307597       6.576103 14.33410 6.400054 26.16870 8.762674 -11.83460      10.85104 
1 1 1 -1  35 10 o 86.44886 3.306477 91.78216       6.952797 87.30734       9.083546 98.11293       10.80429 84.04205 4.451169 88.94046 5.005144 -4.898415      6.698088 
1 1 1 -1  35 11 o 71.71091 5.168590 64.04159       8.971601 0.000000       0.000000 64.04159       8.971601 ?        ?        71.71091 5.168590 0.000000       5.168590 
1 1 1 -1  35 12 o 59.95149 4.563715 44.67268       6.617271 37.86400       11.06524 48.46334       8.256328 53.75121 8.748229 62.18695 5.504985 -8.435745      10.33617 
1 1 1 -1  35 13 o 65.88632 4.387090 53.89002       7.003688 72.90085       12.58173 45.35431       8.430625 75.72029 6.894068 59.97900 5.841933 15.74129       9.036390 
1 1 1 -1  35 14 o 37.28418 5.891317 17.80807       5.175096 9.577602       7.987651 23.76214       6.793814 27.88361 9.651594 42.91235 6.716881 -15.02874      11.75882 
1 1 1 -1  35 15 o 13.52177 6.155188 -2.506494      4.454836 0.9325779      7.202267 -4.637513      5.669467 19.96791 8.484574 14.38318 6.688716 5.584727       10.80402 
1 1 1 -1  35 16 o 14.48779 6.451968 -1.439133      4.598786 -9.679492      7.900253 2.784139       5.655779 15.51030 7.414437 19.49532 7.818956 -3.985018      10.77543 
1 1 1 -1  35 17 o 81.33298 4.671628 82.84205       9.220197 78.14149       13.96627 86.47334       12.27541 77.36251 7.502291 82.29000 6.166272 -4.927490      9.711194 
1 1 1 -1  35 18 o 46.09287 7.865837 28.50493       8.518356 0.000000       0.000000 28.50493       8.518356 ?        ?        46.09287 7.865837 0.000000       7.865837 
1 1 1 -1  35 19 o 77.77302 3.435145 75.08652       6.494375 71.00253       13.50033 76.31615       7.407823 72.98603 7.706702 78.20122 3.899539 -5.215187      8.637110 
1 1 1 -1  35 20 o 29.79238 5.767787 11.73054       4.036113 17.75403       9.118235 10.26276       4.501081 34.75008 10.14119 27.50305 6.763649 7.247030       12.18978 
1 1 1 -1  35 21 o 14.43404 6.285716 -0.1813540     4.142625 4.339171       7.748015 -1.990955      4.902159 22.17567 9.057555 14.34989 6.502391 7.825784       11.14991 
1 1 1 -1  35 22 o 12.57076 5.607566 -0.9472632     3.488831 2.528896       8.158248 -1.725263      3.859552 21.02004 8.983898 12.66529 5.751152 8.354753       10.66706 
1 1 1 -1  35 23 o 19.92952 6.681887 5.258293       3.823655 18.83966       9.366571 2.542414       4.188553 34.31285 10.34587 16.87277 6.741751 17.44007       12.34862 
1 1 1 -1  35 24 o 20.04624 6.490414 5.492618       3.618837 15.21774       8.770928 3.497417       3.972751 30.52193 10.11739 17.57424 6.694269 12.94769       12.13156 
1 1 1 -1  35 25 o 36.82858 5.315935 18.31186       4.632982 0.000000       0.000000 18.31186       4.632982 ?        ?        36.82858 5.315935 0.000000       5.315935 
1 1 1 -1  35 26 o 57.60046 3.601678 42.53524       5.030231 55.63373       11.58118 39.48954       5.584515 60.43303 8.065144 55.00871 4.197690 5.424320       9.092147 
1 1 1 -1  35 27 o 25.32028 6.105139 9.311896       3.722855 11.81911       6.330753 7.986545       4.602832 26.64534 8.580858 22.81712 7.313706 3.828222       11.27481 
1 1 1 -1  35 28 o 16.48173 6.073327 3.574609       3.213789 6.556103       5.816241 2.264230       3.855882 20.81218 8.055498 15.45053 6.358909 5.361645       10.26288 
1 1 1 -1  35 29 o 13.36325 5.678257 1.117757       3.225885 0.9727016E-01  5.758420 1.584486       3.894326 15.49476 7.031590 14.63781 6.230047 0.8569460      9.394506 
1 1 1 -1  35 30 o 15.88005 6.040478 3.406654       3.231826 5.212160       5.454212 2.429746       4.011986 18.69375 7.612977 15.34091 6.414660 3.352842       9.955163 
1 1 1 -1  35 31 o 14.65182 5.905826 2.592671       3.243953 6.363124       5.578427 0.6661760      3.987484 19.28968 7.755332 13.54622 6.021744 5.743464       9.818686 
1 1 1 -1  35 32 o 16.90878 6.216262 4.481615       3.363615 7.912253       5.863796 2.799189       4.106383 20.22410 8.010653 15.27892 6.445317 4.945173       10.28167 
1 1 1 -1  35 33 o 12.34940 5.470953 0.6289027      3.263432 7.933265       6.385084 -1.953870      3.796808 19.62766 8.140387 11.24021 5.305071 8.387453       9.716464 
1 1 1 -1  36 1  o 14.28760 5.885987 0.8260536      3.307886 0.3062609      4.316434 1.565716       5.149046 15.55296 6.586792 17.97643 7.367876 -2.423468      9.882885 
1 1 1 -1  36 2  o 68.93307 3.246330 58.37603       5.437943 55.99635       7.839682 60.58272       7.549357 67.17731 4.821001 69.97842 4.450056 -2.801117      6.560872 
1 1 1 -1  36 3  f 16.59488 6.293387 2.495210       3.501671 3.728572       4.809448 1.103822       5.108273 19.69650 7.396238 17.50209 7.271900 2.194416       10.37231 
1 1 1 -1  36 4  o 110.5527 2.945046 149.7953       7.927034 140.7980       11.56288 157.7739       10.88852 106.7746 4.453654 113.1970 3.953351 -6.422310      5.955167 
1 1 1 -1  36 5  o 81.55050 3.020136 81.59892       5.991537 74.24770       8.553290 88.68148       8.395537 77.43879 4.552591 84.78368 4.075433 -7.344894      6.110257 
1 1 1 -1  36 6  f 97.01492 2.944446 115.4223       6.953049 110.4820       10.21015 119.6948       9.494948 94.52412 4.444998 98.54055 3.962123 -4.016434      5.954529 
1 1 1 -1  36 7  o 75.25071 3.085438 69.55273       5.646007 74.11946       8.260607 65.54903       7.734638 77.37200 4.399319 72.75103 4.383124 4.620972       6.210135 
1 1 1 -1  36 8  o 80.07332 3.023854 78.73962       5.889844 61.26780       8.141921 97.91969       8.530667 70.18740 4.788959 89.07317 3.939815 -18.88577      6.201312 
1 1 1 -1  36 9  o 18.49955 6.609391 3.746123       3.766955 4.554846       5.646943 3.097703       5.056402 21.35634 8.015464 19.22971 7.491952 2.126633       10.97165 
1 1 1 -1  36 10 o 109.3984 3.295786 147.2137       8.776283 142.0949       15.27178 149.7378       10.72393 106.3694 5.914939 110.0868 4.004117 -3.717377      7.142790 
1 1 1 -1  36 11 o 57.19764 4.031238 40.60389       5.582927 44.12925       11.04913 39.39525       6.469553 58.16505 8.007511 56.12959 4.775129 2.035461       9.323201 
1 1 1 -1  36 12 o 121.7629 3.388573 182.6840       10.04489 174.5061       19.78617 185.5235       11.65909 116.9184 6.976253 122.4803 3.911286 -5.561905      7.997890 
1 1 1 -1  36 13 o 40.26512 4.940782 20.51338       4.746485 20.11427       9.229124 20.65690       5.534524 38.11784 9.861481 40.12585 5.830549 -2.008011      11.45618 
1 1 1 -1  36 14 o 48.17504 4.251221 29.04750       4.939663 22.56207       9.740149 31.29308       5.731392 40.15736 9.993324 49.84761 4.776610 -9.690250      11.07621 
1 1 1 -1  36 15 o 97.34256 3.329432 117.1320       7.886227 135.8217       16.66443 111.7384       8.952108 102.6504 6.698425 94.82830 3.882133 7.822052       7.742084 
1 1 1 -1  36 16 o 46.69863 4.679665 27.59471       5.253755 34.89165       9.692618 24.55891       6.251830 50.87332 8.088849 43.48653 6.064229 7.386791       10.10962 
1 1 1 -1  36 17 o 59.90463 3.607786 44.72384       5.242276 33.15783       9.813065 49.34277       6.201313 49.09145 8.511134 62.74142 4.078052 -13.64997      9.437686 
1 1 1 -1  36 18 o 56.83364 4.359489 40.81388       5.991684 37.20743       10.11863 42.76123       7.435400 51.95858 8.268285 57.67086 5.351738 -5.712284      9.849144 
1 1 1 -1  36 19 o 14.43864 6.090881 0.6968806      3.667201 11.78575       8.533318 -1.814983      4.061367 28.73776 9.974305 13.03097 5.910236 15.70678       11.59386 
1 1 1 -1  36 20 o 32.46976 5.380557 13.92743       4.108413 8.670769       9.209930 15.23333       4.590454 25.97795 10.11400 33.79833 5.781088 -7.820379      11.64964 
1 1 1 -1  36 21 o 30.74334 5.778740 12.75211       4.170433 0.6831211      9.508382 15.62693       4.640623 20.88601 9.290808 34.10200 5.791102 -13.21598      10.94788 
1 1 1 -1  36 22 o 11.02981 5.141674 -2.595788      3.382257 -6.845414      8.154125 -1.712697      3.717106 16.02002 7.623044 12.28374 5.603522 3.736277       9.460986 
1 1 1 -1  36 23 o 35.29158 5.473395 16.87443       4.554855 0.000000       0.000000 16.87443       4.554855 ?        ?        35.29158 5.473395 0.000000       5.473395 
1 1 1 -1  36 24 o 18.16306 6.789851 4.190967       4.043688 0.000000       0.000000 4.190967       4.043688 ?        ?        18.16306 6.789851 0.000000       6.789851 
1 1 1 -1  36 25 o 12.21528 5.601346 -1.615370      3.778407 -4.726275      7.201510 -0.4337302     4.438363 15.22256 7.220593 14.07067 6.297312 1.151888       9.580872 
1 1 1 -1  36 26 o 31.58303 5.478926 13.99344       4.064012 22.62077       9.461988 12.04186       4.500256 34.46033 10.40021 28.38942 6.626251 6.070911       12.33173 
1 1 1 -1  36 27 o 62.32651 4.304049 51.79229       6.496969 51.64199       11.84018 51.85704       7.771450 54.79068 9.193087 61.08106 5.272637 -6.290375      10.59781 
1 1 1 -1  36 28 o 16.93603 6.511476 3.907790       3.782005 5.598518       6.235018 2.923599       4.757081 19.50374 8.062427 16.54580 6.956027 2.957943       10.64843 
1 1 1 -1  36 29 o 15.90843 6.166841 3.403644       3.412551 12.70408       6.055268 -0.9250956     4.131068 26.04787 8.392411 12.72514 5.843195 13.32274       10.22622 
1 1 1 -1  36 30 o 22.62281 6.136997 8.161308       3.468375 3.854105       5.880080 10.45949       4.295139 17.25987 7.502840 24.95095 6.854427 -7.691076      10.16247 
1 1 1 -1  36 31 o 27.93208 5.601946 11.95443       3.680295 10.07826       6.508177 12.83642       4.462281 21.82371 8.500525 27.71873 6.684339 -5.895023      10.81385 
1 1 1 -1  36 32 o 14.55395 5.910174 2.796086       3.276128 -3.263507      5.572066 5.997563       4.050137 12.70866 6.114793 18.47299 6.816035 -5.764331      9.156912 
1 1 1 -1  37 1  o 63.37397 3.395021 49.50866       5.223980 41.64683       7.353077 57.52087       7.423068 57.61676 5.296230 68.03627 4.502532 -10.41951      6.951463 
1 1 1 -1  37 2  o 78.64957 3.096407 76.04706       5.922990 70.39835       8.502898 81.37163       8.255333 75.24127 4.660275 81.06429 4.193219 -5.823013      6.269071 
1 1 1 -1  37 3  o 84.86104 2.985813 88.46957       6.164953 87.12463       9.096627 89.61205       8.384025 83.78802 4.471342 85.11584 4.053741 -1.327812      6.035372 
1 1 1 -1  37 4  o 29.22475 5.507936 10.98618       3.778775 13.61614       5.412374 8.485043       5.278144 32.20014 7.089774 25.61699 7.775434 6.583145       10.52246 
1 1 1 -1  37 5  o 92.21152 2.981136 104.4722       6.690090 88.77394       9.429785 120.3815       9.492965 84.50325 4.596534 98.68488 3.955450 -14.18163      6.064133 
1 1 1 -1  37 6  o 98.92165 2.910560 120.1957       7.008604 118.0382       10.27390 122.0737       9.585226 97.55450 4.332479 99.35193 3.967016 -1.797424      5.874316 
1 1 1 -1  37 7  o 26.00305 6.439141 8.867557       4.058604 8.299825       6.321505 9.265691       5.293750 25.72265 8.590989 26.55605 7.720555 -0.8333931     11.55041 
1 1 1 -1  37 8  o 37.75196 4.864399 18.02179       4.371223 10.68239       6.702601 23.45374       5.766221 28.44797 8.786426 42.89956 5.653172 -14.45158      10.44795 
1 1 1 -1  37 9  o 129.9412 3.006606 207.5831       9.520495 197.4915       14.03673 216.1807       12.95612 125.9249 4.581872 132.0780 4.030110 -6.153099      6.102077 
1 1 1 -1  37 10 o 30.71435 4.976356 12.07159       3.597340 6.549367       5.034466 17.83236       5.142055 22.91735 7.666955 37.18042 5.869816 -14.26307      9.655928 
1 1 1 -1  37 11 o 75.21780 3.551420 70.07786       6.491284 57.87447       12.07238 75.04102       7.698956 66.42093 7.594888 77.64028 4.083554 -11.21935      8.623093 
1 1 1 -1  37 12 o 43.60880 4.575563 24.00275       4.790118 22.78601       9.770253 24.38777       5.495982 40.12288 10.02257 43.72189 5.264130 -3.599010      11.32091 
1 1 1 -1  37 13 o 28.87693 6.153160 11.03207       4.197409 10.68079       8.608394 11.14164       4.807643 28.49292 10.00935 28.79365 6.934795 -0.3007298     12.17697 
1 1 1 -1  37 14 f 51.20092 4.681854 33.20581       5.777018 47.53445       10.82997 27.50710       6.829877 59.62929 7.627418 45.86933 6.274477 13.75996       9.876566 
1 1 1 -1  37 15 o 15.82713 6.320580 1.914093       3.679588 -0.9807140     6.692142 3.168481       4.405259 17.64972 7.825956 18.14230 7.013728 -0.4925728     10.50895 
1 1 1 -1  37 16 o 11.89030 5.442353 -2.070532      3.545148 1.090627       6.748296 -3.275505      4.166388 18.96443 8.139396 12.29736 5.723861 6.667066       9.950495 
1 1 1 -1  37 17 o 38.00753 4.935028 18.69969       4.463013 7.486783       8.691676 22.71474       5.201036 25.05362 9.804732 41.80457 5.218757 -16.75095      11.10712 
1 1 1 -1  37 18 o 22.61090 7.361102 6.963431       4.651304 13.77878       8.758761 4.286522       5.489281 30.13331 10.11314 20.03207 7.805633 10.10124       12.77512 
1 1 1 -1  37 19 o 19.64325 6.724832 5.035884       3.874288 6.078066       8.523086 4.764455       4.349643 23.38173 9.518741 19.56083 7.087720 3.820904       11.86770 
1 1 1 -1  37 20 o 23.88551 6.402036 8.008611       3.801930 11.29253       7.734806 6.962427       4.365731 27.12895 9.491064 22.25641 7.121706 4.872545       11.86588 
1 1 1 -1  37 21 o 17.48149 6.802834 3.360407       4.165116 0.000000       0.000000 3.360407       4.165116 ?        ?        17.48149 6.802834 0.000000       6.802834 
1 1 1 -1  37 22 o 18.86779 6.967035 4.652649       4.232969 0.000000       0.000000 4.652649       4.232969 ?        ?        18.86779 6.967035 0.000000       6.967035 
1 1 1 -1  37 23 f 22.24583 6.655197 7.275803       3.887104 18.14545       8.607996 4.491579       4.356586 31.94682 9.972048 18.59700 7.027191 13.34982       12.19931 
1 1 1 -1  37 24 o 20.88411 6.732666 6.464561       3.896652 12.67670       8.600670 4.860065       4.371001 26.42809 9.897680 18.86009 7.057497 7.567999       12.15616 
1 1 1 -1  37 25 o 42.53524 4.565158 24.37432       4.657999 40.63529       10.21224 20.10259       5.234185 49.42035 8.802431 37.41830 5.938350 12.00205       10.61823 
1 1 1 -1  37 26 o 31.86268 5.632657 14.64554       4.213588 20.54372       9.130256 13.04940       4.749622 31.52298 10.31660 28.95300 6.841085 2.569975       12.37872 
1 1 1 -1  37 27 o 29.66135 6.510133 13.65037       4.576239 20.56209       9.279910 11.42950       5.260327 30.38737 10.40763 25.72328 7.752637 4.664095       12.97775 
1 1 1 -1  37 28 f 35.04000 5.276038 17.85398       4.365513 32.20244       9.734909 14.24223       4.884144 39.24902 10.11480 29.50989 6.913574 9.739130       12.25181 
1 1 1 -1  37 29 f 19.80609 6.529371 6.500681       3.654567 5.478818       6.433221 6.987575       4.440677 18.47913 7.939362 20.01565 7.173234 -1.536520      10.69994 
1 1 1 -1  37 30 o 20.32618 6.808620 7.214583       3.970171 15.29035       6.701252 2.846960       4.928182 26.62779 8.844045 15.72911 6.852674 10.89868       11.18822 
1 1 1 -1  38 1  f 111.4050 3.003300 152.7463       8.145973 150.7634       12.09419 154.3928       11.02078 109.9868 4.521964 111.5452 4.061167 -1.558372      6.077930 
1 1 1 -1  38 2  o 65.77390 3.285207 53.43623       5.248987 45.63076       7.332491 61.64019       7.517336 60.20547 5.044133 70.28344 4.411343 -10.07797      6.700986 
1 1 1 -1  38 3  f 53.22722 3.661786 35.16977       4.720723 32.33710       6.595596 38.14511       6.759646 50.46163 5.449961 54.97982 5.103531 -4.518192      7.466465 
1 1 1 -1  38 4  o 123.8263 3.913712 190.1174       11.79484 199.0573       19.21184 184.7094       14.94237 124.9817 6.328524 121.3447 5.064286 3.636955       8.105382 
1 1 1 -1  38 5  o 30.14832 5.777962 11.83370       4.090507 16.09403       7.041165 9.663399       5.025531 34.35417 8.466071 26.90032 7.423974 7.453856       11.26010 
1 1 1 -1  38 6  o 37.25868 4.315604 17.49250       3.845992 10.49658       5.100005 26.71675       5.856168 27.97605 7.376829 45.79625 5.348001 -17.82021      9.111461 
1 1 1 -1  38 7  o 94.87920 2.966970 110.9491       6.851509 111.0768       9.967123 110.8347       9.433846 94.32114 4.348051 94.33727 4.113530 -0.1612091E-01 5.985539 
1 1 1 -1  38 8  o 66.85177 3.135675 55.24636       5.094108 50.00544       7.311982 60.18914       7.100963 62.98663 4.799917 69.38885 4.219385 -6.402218      6.390807 
1 1 1 -1  38 9  o 56.77947 3.374795 40.01279       4.648482 29.17880       6.273897 53.19929       6.921622 47.70719 5.496940 65.10836 4.388126 -17.40117      7.033634 
1 1 1 -1  38 10 o 44.93343 3.776327 25.26380       4.096772 18.77718       5.632800 32.54847       5.969250 37.76349 6.345742 50.61629 4.900656 -12.85280      8.017784 
1 1 1 -1  38 11 o 18.02150 6.798786 3.350886       4.074244 13.55824       7.729178 -0.5766440     4.794425 30.94414 9.412596 15.27801 6.705054 15.66613       11.55659 
1 1 1 -1  38 12 o 68.86956 4.124296 59.58314       6.889997 72.23886       12.27572 53.76270       8.324947 73.94861 6.891434 64.76257 5.321898 9.186043       8.707150 
1 1 1 -1  38 13 o 64.65353 4.196470 52.71283       6.575967 61.67036       11.47635 48.33413       8.023833 67.97401 7.029586 61.20401 5.436296 6.770000       8.886416 
1 1 1 -1  38 14 o 21.15982 6.704296 5.947892       3.876767 11.70915       7.515249 3.858904       4.525355 28.52667 9.361165 18.87996 7.155681 9.646702       11.78283 
1 1 1 -1  38 15 o 14.66652 6.366254 0.3945272E-01  4.220787 9.352397       7.540280 -4.210220      5.093563 26.00847 9.344065 13.29541 6.234130 12.71306       11.23281 
1 1 1 -1  38 16 o 15.87108 6.365182 2.072790       3.748019 -1.687088      7.166129 3.488590       4.397426 17.41605 7.879745 18.17302 7.012326 -0.7569695     10.54813 
1 1 1 -1  38 17 o 27.47894 7.037792 10.72994       4.732970 9.178111       7.440601 11.78458       6.133919 25.34145 9.257001 28.18545 8.342673 -2.844002      12.46163 
1 1 1 -1  38 18 o 20.43641 6.577940 5.749174       3.720587 4.541384       7.251392 6.180748       4.334645 21.10376 8.706458 21.15510 7.114577 -0.5134010E-01 11.24365 
1 1 1 -1  38 19 o 26.13152 6.402071 9.718197       4.044184 11.46909       7.940963 9.105039       4.699260 26.79205 9.593497 24.88063 7.285687 1.911421       12.04643 
1 1 1 -1  38 20 o 12.57251 5.775252 -1.885712      4.040693 0.000000       0.000000 -1.885712      4.040693 ?        ?        12.57251 5.775252 0.000000       5.775252 
1 1 1 -1  38 21 o 22.47248 7.042339 7.508094       4.288695 0.000000       0.000000 7.508094       4.288695 ?        ?        22.47248 7.042339 0.000000       7.042339 
1 1 1 -1  38 22 f 37.28923 5.065488 18.96054       4.484090 29.26985       10.32609 16.56470       4.977937 40.00988 10.47120 33.91412 6.253618 6.095760       12.19646 
1 1 1 -1  38 23 o 12.08952 5.518633 -1.237621      3.613161 -5.227994      7.916543 -0.1876921     4.060774 15.50288 7.413926 13.56445 6.050372 1.938423       9.569394 
1 1 1 -1  38 24 o 18.53580 6.753968 4.998212       3.957203 4.491802       8.737752 5.128881       4.438473 20.04972 8.913311 18.81133 7.096308 1.238392       11.39319 
1 1 1 -1  38 25 o 15.88633 6.751411 2.361460       4.561678 20.17476       9.508605 -2.963976      5.199029 30.15633 10.52507 13.12192 6.197628 17.03441       12.21424 
1 1 1 -1  38 26 o 30.74378 6.408101 14.70043       4.645041 13.34681       8.944976 15.20022       5.435354 24.36551 9.811951 30.04138 7.458985 -5.675873      12.32521 
1 1 1 -1  38 27 o 30.19875 5.996984 14.02831       4.257576 35.97734       10.54818 9.756438       4.653487 40.28989 10.60193 23.60722 7.326192 16.68267       12.88697 
1 1 1 -1  38 28 f 16.78925 6.489792 4.307068       3.771318 13.78965       8.813658 2.181727       4.172604 23.50384 9.637153 14.83173 6.383438 8.672107       11.55954 
1 1 1 -1  38 29 o 22.75157 6.722641 8.945730       3.985793 2.194549       8.706999 10.73551       4.483097 17.04587 8.041692 24.56937 7.093606 -7.523504      10.72325 
1 1 1 -1  39 1  o 63.10073 3.295104 49.37995       5.049312 52.78032       7.395642 46.41097       6.910618 64.65613 4.726511 60.61471 4.715530 4.041420       6.676537 
1 1 1 -1  39 2  f 26.89640 7.935803 9.833459       5.557475 0.000000       0.000000 9.833459       5.557475 ?        ?        26.89640 7.935803 0.000000       7.935803 
1 1 1 -1  39 3  o 17.50299 7.082616 2.155725       4.685777 0.000000       0.000000 2.155725       4.685777 ?        ?        17.50299 7.082616 0.000000       7.082616 
1 1 1 -1  39 4  o 21.36284 6.746793 5.929076       3.928917 3.041392       5.977376 8.125707       5.213319 19.80595 8.004845 24.68077 7.768698 -4.874821      11.15483 
1 1 1 -1  39 5  o 17.49024 6.706515 2.961788       4.004574 4.458585       6.606077 2.092209       5.035202 21.61334 8.520802 17.85484 7.298284 3.758503       11.21914 
1 1 1 -1  39 6  f 12.49060 5.484660 -0.5535234     3.211845 -0.2151254     4.275153 -0.9920238     4.866568 14.71626 6.397312 15.07555 6.679689 -0.3592834     9.248991 
1 1 1 -1  39 7  o 26.39316 5.674788 9.229764       3.541296 7.491517       4.696555 11.52033       5.391320 23.66058 7.362799 28.91567 7.565435 -5.255091      10.55683 
1 1 1 -1  39 8  o 51.03783 3.551214 32.55929       4.389225 30.32110       6.043290 35.05809       6.385433 48.55771 5.187414 52.30404 5.073432 -3.746326      7.255961 
1 1 1 -1  39 9  o 14.52346 5.805732 1.578791       3.107676 2.263813       4.111263 0.6656306      4.746753 16.73026 6.681118 16.09260 6.864623 0.6376591      9.579164 
1 1 1 -1  39 10 o 29.44300 5.601138 11.49989       3.871978 14.47723       4.952493 6.818510       6.210078 32.74490 6.436044 23.23787 8.461809 9.507029       10.63132 
1 1 1 -1  39 11 f 22.72729 7.225482 7.002676       4.499670 7.810375       6.940990 6.417166       5.909682 24.43892 8.938684 22.57175 8.249166 1.867167       12.16342 
1 1 1 -1  39 12 o 24.54134 7.225009 8.392150       4.610751 13.51285       7.427336 5.181504       5.881180 30.14253 9.238381 21.21433 8.129178 8.928200       12.30574 
1 1 1 -1  39 13 o 21.29103 6.723841 6.159986       3.902268 10.25859       7.169763 4.434834       4.651583 26.58875 9.146726 19.43854 7.279151 7.150211       11.68968 
1 1 1 -1  39 14 o 52.62284 4.161207 35.41103       5.292766 42.89328       10.33303 32.74968       6.162582 54.77905 7.974589 49.99128 5.131388 4.787769       9.482891 
1 1 1 -1  39 15 o 15.26684 6.613983 0.4581636      4.537667 -6.227508      7.241849 4.779787       5.822378 15.17642 7.210854 20.38637 8.010898 -5.209956      10.77826 
1 1 1 -1  39 16 o 27.20744 6.273933 10.41449       4.074723 13.95117       8.489881 9.355972       4.644641 29.15992 9.955606 25.33763 7.190142 3.822290       12.28056 
1 1 1 -1  39 17 f 12.46183 5.644053 -1.238956      3.687876 -6.600687      6.775362 1.018330       4.396158 14.24230 6.823861 15.35894 6.580285 -1.116641      9.479727 
1 1 1 -1  39 18 o 30.09857 5.947240 12.72101       4.207372 12.42629       8.430683 12.81875       4.855199 27.08789 9.859966 29.58525 6.866926 -2.497358      12.01556 
1 1 1 -1  39 19 o 16.53270 6.893006 2.271771       4.612829 0.000000       0.000000 2.271771       4.612829 ?        ?        16.53270 6.893006 0.000000       6.893006 
1 1 1 -1  39 20 o 16.08489 6.363223 2.834768       3.695704 9.222757       7.614592 0.8663288      4.226934 23.77924 9.213508 14.74507 6.385735 9.034164       11.21010 
1 1 1 -1  39 21 o 25.42847 6.415820 9.644788       3.974894 22.09239       8.781606 6.437358       4.457688 34.65610 9.903872 20.65640 7.206650 13.99969       12.24837 
1 1 1 -1  39 22 o 18.74334 6.682903 5.149526       3.849272 8.429706       7.596041 4.016159       4.465022 22.35553 9.027935 17.63841 6.989023 4.717121       11.41710 
1 1 1 -1  39 23 o 20.57588 6.736419 6.634818       3.892693 4.848761       7.421284 7.312739       4.572154 19.42802 8.437284 21.23345 7.304226 -1.805429      11.15973 
1 1 1 -1  39 24 o 22.17442 7.840382 8.633835       5.288256 0.000000       0.000000 8.633835       5.288256 ?        ?        22.17442 7.840382 0.000000       7.840382 
1 1 1 -1  39 25 o 19.31905 6.688646 6.051363       3.836263 4.412470       7.463288 6.639874       4.472318 18.44636 8.216816 19.87273 7.188882 -1.426367      10.91770 
1 1 1 -1  39 26 o 13.86634 6.019262 1.390238       3.773660 8.067689       8.198589 -0.4047202     4.250705 20.33791 8.849911 13.03500 5.963686 7.302914       10.67176 
1 1 1 -1  39 27 o 12.08922 5.592447 -0.9723277     3.885062 1.296739       8.570840 -1.559122      4.358558 16.83352 7.952721 12.34142 5.780390 4.492100       9.831514 
1 1 1 -1  40 1  o 22.48628 6.117945 6.818289       3.440894 2.651239       4.452152 12.99937       5.422354 17.51689 6.966649 30.58922 7.363263 -13.07232      10.13666 
1 1 1 -1  40 2  o 37.82093 4.372858 18.27234       3.956116 18.52770       5.259938 17.93974       6.002997 37.37669 5.976098 36.21658 7.055554 1.160118       9.246329 
1 1 1 -1  40 3  o 56.28830 3.728861 39.79652       5.085988 37.51608       6.508401 43.37333       8.151036 54.00561 5.002215 57.52793 5.897714 -3.522316      7.733381 
1 1 1 -1  40 4  o 32.97934 5.189884 14.23027       4.033286 14.32895       5.071620 14.06047       6.652723 32.43828 6.639643 31.24457 8.509362 1.193712       10.79324 
1 1 1 -1  40 5  o 64.27298 3.559015 51.76381       5.552588 43.47285       6.981529 66.03588       9.159925 58.11757 4.977426 71.46174 5.297633 -13.34417      7.269091 
1 1 1 -1  40 6  o 14.73112 5.980200 1.495824       3.352966 1.561718       4.538605 1.416649       4.975005 16.47937 6.851336 16.91681 7.112882 -0.4374371     9.875925 
1 1 1 -1  40 7  o 28.80227 6.335413 11.33165       4.325600 14.13643       7.283088 9.803076       5.376614 30.87849 9.077801 26.30169 7.817165 4.576801       11.97975 
1 1 1 -1  40 8  o 43.96960 5.259629 25.30430       5.523980 32.76025       8.196373 19.09931       7.477234 48.82398 7.096574 36.09294 8.620136 12.73104       11.16549 
1 1 1 -1  40 9  o 55.74302 4.036706 39.50253       5.446299 33.95969       8.973050 42.73560       6.853009 49.05473 7.764441 57.40514 4.947068 -8.350414      9.206520 
1 1 1 -1  40 10 o 43.84694 4.404121 24.77407       4.642154 24.10121       7.590631 25.17608       5.867268 40.94868 7.892956 43.45388 5.676354 -2.505199      9.722127 
1 1 1 -1  40 11 o 15.42680 6.328209 1.701821       3.802491 12.52206       6.989642 -2.846631      4.531774 28.61066 8.993941 12.98103 6.017195 15.62962       10.82117 
1 1 1 -1  40 12 f 50.73444 4.696037 33.56245       5.740037 45.24287       10.28453 28.27779       6.917727 56.07884 7.731238 45.26828 6.453463 10.81056       10.07071 
1 1 1 -1  40 13 o 12.22709 5.577744 -1.616642      3.683127 -4.349487      6.534791 -0.3443465     4.458801 14.97114 7.032964 14.43204 6.394187 0.5390959      9.505168 
1 1 1 -1  40 14 o 19.39946 7.266921 4.828031       4.636760 6.266842       7.235069 3.825206       6.040225 22.07152 8.846472 19.38399 7.966275 2.687536       11.90469 
1 1 1 -1  40 15 f 12.78194 5.695545 -0.5660150     3.588969 -2.185132      6.771861 0.6639827E-01  4.232232 16.10670 7.426870 14.29745 6.286375 1.809249       9.730206 
1 1 1 -1  40 16 o 23.50930 7.021036 8.219060       4.329063 23.49520       8.780837 3.313721       4.975808 37.36765 9.594164 17.88229 7.275568 19.48537       12.04084 
1 1 1 -1  40 17 o 36.11602 6.317804 18.68428       5.357955 0.000000       0.000000 18.68428       5.357955 ?        ?        36.11602 6.317804 0.000000       6.317804 
1 1 1 -1  40 18 o 17.57116 6.720530 3.927912       4.014548 2.753073       7.559100 4.389463       4.737955 19.07493 8.393654 18.51085 7.240540 0.5640774      11.08507 
1 1 1 -1  40 19 o 18.46935 6.668274 4.829856       3.845684 8.117813       7.219975 3.527549       4.543907 22.41958 8.886127 17.34647 6.990499 5.073109       11.30621 
1 1 1 -1  40 20 o 15.77258 6.273926 2.865315       3.611341 8.360166       7.074462 0.9288135      4.199760 22.26511 8.805236 14.50126 6.321739 7.763845       10.83958 
1 1 1 -1  40 21 o 13.83050 6.008345 0.9030427      3.765989 1.100703       7.732745 0.8415828      4.311912 17.52582 8.027797 14.43217 6.345454 3.093647       10.23281 
1 1 1 -1  40 22 o 12.86022 5.893011 -0.9003793     4.172412 0.8278252      7.652012 -1.631620      4.977464 17.04535 7.872200 13.44089 6.256160 3.604463       10.05540 
1 1 1 -1  40 23 o 16.26361 6.589926 3.445973       4.062723 3.897563       7.803963 3.278080       4.758389 18.37628 8.276903 16.50831 6.949606 1.867970       10.80760 
1 1 1 -1  40 24 o 22.84428 6.781675 8.728587       4.048421 8.290706       8.951159 8.841192       4.539217 20.59996 9.096463 22.48420 7.268180 -1.884245      11.64354 
1 1 1 -1  40 25 o 17.00380 6.711872 4.424534       4.103491 10.36429       9.207456 2.952360       4.583898 21.26824 9.314101 15.78602 6.740185 5.482214       11.49707 
1 1 1 -1  41 1  o 14.22423 5.782028 1.434875       3.139258 0.4339991      4.497758 2.385590       4.383605 15.27951 6.602130 16.90891 6.847465 -1.629404      9.511882 
1 1 1 -1  41 2  o 55.15347 3.321611 38.22504       4.443655 44.77817       6.886381 33.54959       5.816722 58.72900 4.855080 50.85818 4.748209 7.870823       6.790972 
1 1 1 -1  41 3  o 11.77662 5.382432 -1.766675      3.450823 -2.688797      4.240164 0.4211064E-01  5.938573 12.60885 5.836196 16.85951 7.428462 -4.250666      9.446864 
1 1 1 -1  41 4  o 29.86132 5.009609 11.82569       3.516453 8.872110       4.890470 14.98746       5.059887 24.86057 7.471221 32.84389 6.551760 -7.983322      9.937037 
1 1 1 -1  41 5  o 46.91059 3.744185 27.97421       4.244704 26.00138       5.952698 30.01504       6.054431 44.06813 5.674682 47.64358 5.304595 -3.575447      7.767931 
1 1 1 -1  41 6  o 84.06068 3.336951 88.86706       6.822051 89.14233       9.087103 88.51154       10.32708 83.14024 4.501956 82.11018 5.187646 1.030052       6.868717 
1 1 1 -1  41 7  o 41.70236 4.371762 22.54671       4.376803 22.46568       5.736749 22.65956       6.770338 40.61942 5.973851 39.86846 7.234961 0.7509613      9.382513 
1 1 1 -1  41 8  o 14.53675 5.935482 1.566511       3.325846 -2.970624      4.289915 8.401922       5.265507 12.43074 5.793365 23.96282 7.834092 -11.53208      9.743515 
1 1 1 -1  41 9  f 33.86661 4.967711 15.28584       3.977992 17.47045       5.287245 12.43600       6.038836 35.33392 6.374974 28.50456 8.233893 6.829361       10.41332 
1 1 1 -1  41 10 o 18.29879 6.120865 4.509793       3.208748 4.743546       3.881359 4.005119       5.703100 18.91684 6.714236 19.30917 7.813643 -0.3923264     10.30213 
1 1 1 -1  41 11 o 26.05480 7.109060 10.02935       4.638332 11.03905       7.428867 9.384249       5.937963 26.21687 9.290537 24.73353 8.327097 1.483341       12.47616 
1 1 1 -1  41 12 o 16.70850 7.063495 1.938227       4.949101 5.688254       6.753704 -2.411037      7.273319 21.18325 8.527456 16.51248 7.643288 4.670767       11.45152 
1 1 1 -1  41 13 o 25.92994 6.299040 9.701911       3.940353 6.603936       7.315857 10.96786       4.676651 22.00836 8.869752 27.13104 7.020278 -5.122684      11.31180 
1 1 1 -1  41 14 o 17.86471 6.668594 4.127551       3.897695 2.816429       7.131311 4.686065       4.654412 19.03867 8.269479 18.93546 7.237805 0.1032085      10.98954 
1 1 1 -1  41 15 o 21.20016 7.668238 6.713255       5.088457 0.000000       0.000000 6.713255       5.088457 ?        ?        21.20016 7.668238 0.000000       7.668238 
1 1 1 -1  41 16 o 15.64386 6.735554 1.480941       4.649045 0.000000       0.000000 1.480941       4.649045 ?        ?        15.64386 6.735554 0.000000       6.735554 
1 1 1 -1  41 17 o 13.39362 5.875485 0.3531569      3.677823 -2.839879      6.684804 1.739226       4.404323 15.12637 7.108195 15.48430 6.608973 -0.3579359     9.705924 
1 1 1 -1  41 18 o 12.75826 5.684783 -0.1276636     3.575073 0.9682338      6.167660 -0.6821947     4.387311 16.45045 7.388120 13.49607 6.129724 2.954388       9.599887 
1 1 1 -1  41 19 o 10.66298 5.132312 -4.266157      3.933408 -4.083375      6.406393 -4.376752      4.983285 14.02221 6.695869 12.19017 5.843712 1.832035       8.887274 
1 1 1 -1  41 20 o 20.80277 7.191800 7.154469       4.434466 9.653767       8.641973 6.261192       5.166507 22.19570 9.355960 19.65549 7.596433 2.540215       12.05155 
1 1 1 -1  41 21 o 13.24057 6.169347 -1.541457      4.860283 -1.431480      7.429590 -1.623730      6.426059 15.69841 7.412797 14.80380 6.960580 0.8946123      10.16854 
1 1 1 -1  41 22 o 12.19630 5.726079 -2.029525      4.320834 -4.393466      7.600794 -0.9008522     5.251997 14.57199 7.043650 13.91465 6.459525 0.6573362      9.557117 
1 1 1 -1  41 23 o 11.69373 5.549108 -2.666954      4.262125 -9.163746      7.697947 0.2050640      5.118220 13.13289 6.497574 14.29626 6.541965 -1.163373      9.220400 
1 1 1 -1  42 1  o 9.972955 4.780977 -4.088896      3.336170 -2.119680      4.504571 -6.481333      4.965089 13.23903 6.087406 11.76765 5.689276 1.471384       8.332129 
1 1 1 -1  42 2  o 44.51798 4.056425 25.61022       4.352346 27.54478       6.017833 23.48843       6.302310 45.07020 5.599559 40.84730 6.552917 4.222897       8.619501 
1 1 1 -1  42 3  o 30.64846 6.222222 13.21554       4.488291 14.12707       5.054465 9.816859       9.759882 31.30920 6.818316 25.44358 10.24808 5.865620       12.30904 
1 1 1 -1  42 4  o 14.22354 6.044588 0.8894469      3.656351 -1.427493      4.589770 4.913693       6.048892 13.79208 6.266288 20.29924 8.104790 -6.507162      10.24471 
1 1 1 -1  42 5  o 18.27235 6.302551 4.467455       3.404897 3.592109       4.831067 5.331431       4.799590 18.18392 7.248795 20.00877 7.413189 -1.824846      10.36824 
1 1 1 -1  42 6  o 15.87748 6.083271 2.806005       3.293094 -0.8751961     4.515745 6.987281       4.812704 14.02346 6.307973 21.93869 7.495556 -7.915234      9.796627 
1 1 1 -1  42 7  o 15.28282 5.939288 2.463147       3.171483 3.742381       4.666159 1.364794       4.323700 18.13600 7.157730 15.50337 6.580184 2.632624       9.722753 
1 1 1 -1  42 8  o 16.39620 6.138106 3.232434       3.307067 0.9826827E-01  4.574057 6.665220       4.787006 14.75321 6.509130 21.43059 7.468667 -6.677388      9.907056 
1 1 1 -1  42 9  o 16.52674 6.060583 3.421298       3.194042 -0.2961445     4.273446 8.126379       4.807725 13.99775 6.227513 23.18615 7.478765 -9.188399      9.732103 
1 1 1 -1  42 10 o 29.33703 6.162174 12.33997       4.265043 9.995059       7.828857 13.32965       5.086056 24.67552 9.397824 29.80082 7.104255 -5.125299      11.78090 
1 1 1 -1  42 11 o 22.18533 7.443439 7.479789       4.744828 13.68442       7.713188 3.702403       6.018270 27.90702 9.490033 18.79844 7.858173 9.108580       12.32119 
1 1 1 -1  42 12 o 22.77692 6.914655 7.870184       4.173938 8.333642       7.782175 7.683022       4.945435 22.94981 9.182889 22.28018 7.598533 0.6696281      11.91903 
1 1 1 -1  42 13 o 28.63711 7.288615 12.79219       5.098477 0.000000       0.000000 12.79219       5.098477 ?        ?        28.63711 7.288615 0.000000       7.288615 
1 1 1 -1  42 14 o 26.85248 7.545143 11.61793       5.140604 0.000000       0.000000 11.61793       5.140604 ?        ?        26.85248 7.545143 0.000000       7.545143 
1 1 1 -1  42 15 o 22.57774 6.950289 8.028046       4.198127 17.82499       8.527329 4.893891       4.823120 29.91697 9.977609 18.66877 7.304441 11.24820       12.36558 
1 1 1 -1  42 16 o 23.46428 6.928621 8.792192       4.234942 5.575910       8.024593 10.03378       4.985789 20.11549 8.754283 24.50060 7.579903 -4.385105      11.57983 
1 1 1 -1  42 17 o 22.23238 6.784934 7.937162       4.011721 6.415120       7.240846 8.611305       4.818944 20.18084 8.538202 22.57055 7.499887 -2.389706      11.36438 
1 1 1 -1  42 18 o 15.45113 6.418183 2.596564       3.977880 -0.3131891     7.594000 3.696868       4.669807 16.42580 7.672697 16.96743 6.992089 -0.5416317     10.38073 
1 1 1 -1  42 19 o 13.54608 6.216829 -0.6241165     4.667723 17.66133       8.786050 -7.814481      5.509552 27.66353 10.06621 11.41122 5.617541 16.25231       11.52759 
1 1 1 -1  42 20 o 18.51455 6.833225 5.539462       4.071065 -11.37047      7.846696 11.76782       4.762147 12.84399 6.389662 26.21279 7.223921 -13.36880      9.644316 
1 1 1 -1  42 21 o 21.40907 6.933651 7.855680       4.129806 4.753211       8.500300 8.814261       4.724927 18.58787 8.477167 22.15579 7.427744 -3.567924      11.27093 
1 1 1 -1  43 1  o 32.03397 5.283723 14.10259       3.980971 10.35825       5.342770 18.77618       5.969033 25.71346 7.826603 35.51917 7.143939 -9.805704      10.59677 
1 1 1 -1  43 2  o 37.34975 4.275593 18.39346       3.821475 17.39957       5.682631 19.21401       5.163372 34.22969 7.047481 36.96811 5.932107 -2.738419      9.211780 
1 1 1 -1  43 3  o 31.08037 4.666157 12.98306       3.425089 10.75875       4.979806 14.97996       4.718374 26.44260 7.424858 32.34066 6.212708 -5.898066      9.681232 
1 1 1 -1  43 4  f 17.64553 6.234322 4.200745       3.343106 3.522836       4.653101 4.924042       4.806353 17.68424 7.092258 19.23212 7.354057 -1.547878      10.21676 
1 1 1 -1  43 5  o 22.90520 6.545732 7.768462       3.836020 4.345879       4.727256 14.36754       6.564079 18.54306 7.238391 29.47685 8.604991 -10.93379      11.24456 
1 1 1 -1  43 6  o 16.11028 6.198770 3.062107       3.429319 4.643750       4.377630 0.5496901      5.517354 18.63097 7.043221 15.99786 7.099046 2.633108       10.00017 
1 1 1 -1  43 7  o 24.88701 6.863414 9.409304       4.296989 14.81589       5.220482 -1.948557      7.566537 31.28804 7.019999 16.60258 7.722967 14.68546       10.43670 
1 1 1 -1  43 8  f 11.62060 5.273029 -1.015056      3.237453 0.1650999E-01  4.114169 -2.692557      5.246441 13.82173 6.131973 13.64626 6.375352 0.1754646      8.845689 
1 1 1 -1  43 9  o 29.21366 5.989893 12.38419       4.120950 6.906775       5.166014 21.96833       6.833522 21.15758 7.715735 37.27209 7.775509 -16.11450      10.95405 
1 1 1 -1  43 10 o 39.22611 4.918460 21.11786       4.598464 30.08005       9.714581 18.52984       5.220362 40.53047 9.917974 35.55062 6.254083 4.979851       11.72518 
1 1 1 -1  43 11 o 24.52672 7.497235 9.780576       4.895679 0.000000       0.000000 9.780576       4.895679 ?        ?        24.52672 7.497235 0.000000       7.497235 
1 1 1 -1  43 12 o 27.29742 7.431229 12.12901       5.074978 0.000000       0.000000 12.12901       5.074978 ?        ?        27.29742 7.431229 0.000000       7.431229 
1 1 1 -1  43 13 o 18.15886 6.636368 4.863297       3.824757 13.18855       7.571185 2.010720       4.431839 25.88370 9.354891 15.50281 6.623578 10.38089       11.46236 
1 1 1 -1  43 14 o 12.06548 5.576211 -1.475400      3.849196 2.193155       7.484939 -2.794426      4.488151 17.74613 8.038713 12.22753 5.770091 5.518593       9.895193 
1 1 1 -1  43 15 o 22.56522 7.127051 8.460093       4.384203 19.47439       8.622577 4.619758       5.091470 30.05871 10.03336 18.05364 7.354277 12.00507       12.44000 
1 1 1 -1  43 16 o 21.12203 6.944125 7.367982       4.134643 3.497538       7.777893 8.892539       4.881501 18.27068 8.243167 22.60795 7.549323 -4.337271      11.17775 
1 1 1 -1  43 17 o 13.72506 6.238465 -0.7928257E-01 4.555038 1.215372       7.898940 -0.7243073     5.575451 17.04118 7.914649 14.39922 6.674449 2.641958       10.35326 
1 1 1 -1  43 18 o 20.21543 7.321211 7.075628       4.640182 1.792080       7.466903 10.39972       5.922626 16.94013 7.806680 23.16842 8.286355 -6.228294      11.38455 
1 1 1 -1  44 1  o 16.20559 6.078484 3.383387       3.246405 -0.1938749     4.974542 6.037114       4.284556 14.66306 6.606002 20.00465 7.058661 -5.341586      9.667676 
1 1 1 -1  44 2  o 67.05822 3.159875 57.53377       5.149141 61.86692       8.283123 54.80461       6.573642 67.04320 5.108407 64.26121 4.221166 2.781990       6.626769 
1 1 1 -1  44 3  o 12.41688 5.436524 0.2003376      3.135287 5.113071       4.977741 -3.030374      4.036638 19.06082 7.431367 11.59290 5.471084 7.467919       9.228107 
1 1 1 -1  44 4  o 10.89991 5.028848 -1.555116      3.111110 -4.512029      4.244967 1.876233       4.572855 11.16027 5.361362 15.72849 6.724273 -4.568221      8.600003 
1 1 1 -1  44 5  o 14.55490 5.909304 2.091358       3.274351 0.2236592E-02  4.216779 5.263983       5.196470 13.79588 6.158747 19.20754 7.561869 -5.411663      9.752540 
1 1 1 -1  44 6  o 20.43039 6.242806 6.300515       3.394859 9.110560       4.733825 3.324964       4.871236 23.67071 7.395978 17.15945 7.112873 6.511265       10.26126 
1 1 1 -1  44 7  o 9.226684 4.460399 -3.975430      3.050120 -4.922997      4.299154 -3.015090      4.328034 10.99894 5.311846 11.97856 5.656729 -0.9796133     7.759787 
1 1 1 -1  44 8  o 10.98092 5.099541 -1.769740      3.278046 -4.821500      4.625879 1.308497       4.645902 11.51687 5.548988 15.16691 6.629751 -3.650043      8.645512 
1 1 1 -1  44 9  o 17.89829 6.648518 4.668140       3.865120 0.2424160      6.623690 6.953212       4.759461 16.23192 7.433142 20.69450 7.425079 -4.462572      10.50635 
1 1 1 -1  44 10 o 23.33845 7.679385 9.314766       5.056154 0.000000       0.000000 9.314766       5.056154 ?        ?        23.33845 7.679385 0.000000       7.679385 
1 1 1 -1  44 11 o 17.92541 6.858713 4.729319       4.182418 2.085502       7.976865 5.731693       4.911695 17.88369 8.177326 19.15829 7.406076 -1.274605      11.03262 
1 1 1 -1  44 12 o 12.95836 5.994946 -1.326986      4.465618 -5.064240      7.603324 0.6410545      5.517525 14.62922 7.064817 15.30818 6.921275 -0.6789570     9.890182 
1 1 1 -1  44 13 o 28.51384 7.177559 13.48829       4.983064 10.41741       7.674788 15.72632       6.551906 22.68054 9.104201 28.82002 8.644630 -6.139479      12.55453 
1 1 1 -1  44 14 o 25.85949 7.685403 11.82999       5.196981 8.952758       8.593797 13.48887       6.525380 21.30687 9.165535 26.15700 8.728265 -4.850138      12.65660 
1 1 1 -1  44 15 o 12.44103 5.851149 -2.165012      4.546029 1.081948       7.151114 -4.367125      5.889183 16.49265 7.614538 13.02162 6.270714 3.471027       9.864230 
1 1 1 -1  45 1  o 18.07858 6.275793 4.885919       3.378303 10.14892       5.393960 1.488869       4.333533 24.11578 7.931602 14.90300 6.459905 9.212771       10.22940 
1 1 1 -1  45 2  o 19.86766 6.471410 6.135810       3.594656 4.225677       5.163599 7.932003       5.007227 17.86568 7.356360 21.68883 7.632654 -3.823151      10.60063 
1 1 1 -1  45 3  o 36.51695 4.408011 18.22206       3.843324 18.29381       6.036496 18.17316       4.984035 33.24340 7.615396 34.87329 6.086050 -1.629898      9.748551 
1 1 1 -1  45 4  o 16.18168 6.112610 3.560158       3.295778 7.322116       4.850009 0.3325456      4.492378 20.97944 7.499115 14.15503 6.335258 6.824411       9.816935 
1 1 1 -1  45 5  o 27.95261 5.884963 11.68679       3.881721 19.13625       5.839116 5.787613       5.196135 34.50583 7.178224 19.26799 7.568912 15.23784       10.43146 
1 1 1 -1  45 6  o 24.54485 6.952472 9.823357       4.346663 7.810523       5.793263 12.41596       6.574876 21.19054 8.080952 25.47199 8.759182 -4.281450      11.91743 
1 1 1 -1  45 7  o 13.54337 5.977521 0.6059730      3.860755 6.472440       7.116810 -1.840405      4.595776 20.00522 8.464368 12.82662 5.984005 7.178594       10.36599 
1 1 1 -1  45 8  o 20.19257 6.366257 6.437570       3.499609 4.120165       5.093033 8.510492       4.816893 17.52237 7.269014 22.21555 7.499984 -4.693180      10.44454 
1 1 1 -1  45 9  o 31.37120 5.343347 14.32549       3.938618 10.27838       5.633056 18.19646       5.509107 23.64449 8.108390 33.62329 6.953343 -9.978794      10.68152 
1 1 1 -1  45 10 o 13.01709 5.955309 -0.6371243     4.238342 -0.2729878     7.366827 -0.8172894     5.181837 16.13272 7.542751 13.99840 6.469655 2.134312       9.937280 
1 1 1 0   0  1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   0  2  o 714.6512 14.49416 6241.594       252.1855 6241.594       252.1855 6241.594       252.1855 714.6512 14.49416 714.6512 14.49416 0.000000       0.000000 
1 1 1 0   0  3  o 164.4792 5.726043 330.9186       22.88786 330.9186       22.88786 330.9186       22.88786 164.4792 5.726043 164.4792 5.726043 0.000000       0.000000 
1 1 1 0   0  4  o 712.1094 14.45149 6197.253       250.5484 6197.253       250.5484 6197.253       250.5484 712.1094 14.45149 712.1094 14.45149 0.000000       0.000000 
1 1 1 0   0  5  o 234.2053 5.261384 669.5110       29.99423 669.5110       29.99423 669.5110       29.99423 234.2053 5.261384 234.2053 5.261384 0.000000       0.000000 
1 1 1 0   0  6  o 707.3973 14.36636 6115.444       247.4240 6115.444       247.4240 6115.444       247.4240 707.3973 14.36636 707.3973 14.36636 0.000000       0.000000 
1 1 1 0   0  7  o 146.0709 3.840853 260.5477       13.65049 260.5477       13.65049 260.5477       13.65049 146.0709 3.840853 146.0709 3.840853 0.000000       0.000000 
1 1 1 0   0  8  f 194.5033 4.628166 461.8275       21.90868 461.8275       21.90868 461.8275       21.90868 194.5033 4.628166 194.5033 4.628166 0.000000       0.000000 
1 1 1 0   0  9  o 459.5510 9.527863 2578.865       106.5967 2578.865       106.5967 2578.865       106.5967 459.5510 9.527863 459.5510 9.527863 0.000000       0.000000 
1 1 1 0   0  10 o 721.7293 20.85222 6395.300       366.0508 6395.300       366.0508 6395.300       366.0508 721.7293 20.85222 721.7293 20.85222 0.000000       0.000000 
1 1 1 0   0  11 o 661.7368 13.50505 5356.316       217.5751 5356.316       217.5751 5356.316       217.5751 661.7368 13.50505 661.7368 13.50505 0.000000       0.000000 
1 1 1 0   0  12 o 260.0903 5.826130 825.9631       36.88487 825.9631       36.88487 825.9631       36.88487 260.0903 5.826130 260.0903 5.826130 0.000000       0.000000 
1 1 1 0   0  13 o 200.5674 4.825202 491.2010       23.55287 491.2010       23.55287 491.2010       23.55287 200.5674 4.825202 200.5674 4.825202 0.000000       0.000000 
1 1 1 0   0  14 o 22.12137 6.642299 7.372602       3.119551 7.372602       3.119551 7.372602       3.119551 22.12137 6.642299 22.12137 6.642299 0.000000       0.000000 
1 1 1 0   0  15 o 79.58739 5.106951 78.15318       9.809981 78.15318       9.809981 78.15318       9.809981 79.58739 5.106951 79.58739 5.106951 0.000000       0.000000 
1 1 1 0   0  16 o 574.3711 11.81026 4030.605       165.1481 4030.605       165.1481 4030.605       165.1481 574.3711 11.81026 574.3711 11.81026 0.000000       0.000000 
1 1 1 0   0  17 o 236.3754 5.498592 682.0735       31.63435 682.0735       31.63435 682.0735       31.63435 236.3754 5.498592 236.3754 5.498592 0.000000       0.000000 
1 1 1 0   0  18 o 176.5841 4.588037 380.7721       19.71295 380.7721       19.71295 380.7721       19.71295 176.5841 4.588037 176.5841 4.588037 0.000000       0.000000 
1 1 1 0   0  19 o 224.5923 7.520427 616.9807       41.05513 616.9807       41.05513 616.9807       41.05513 224.5923 7.520427 224.5923 7.520427 0.000000       0.000000 
1 1 1 0   0  20 o 1183.783 23.95435 17192.74       690.3848 17192.74       690.3848 17192.74       690.3848 1183.783 23.95435 1183.783 23.95435 0.000000       0.000000 
1 1 1 0   0  21 o 311.1107 6.874585 1181.681       52.06172 1181.681       52.06172 1181.681       52.06172 311.1107 6.874585 311.1107 6.874585 0.000000       0.000000 
1 1 1 0   0  22 o 904.6421 26.16125 10086.29       575.6367 10086.29       575.6367 10086.29       575.6367 904.6421 26.16125 904.6421 26.16125 0.000000       0.000000 
1 1 1 0   0  23 o 243.0179 5.725817 721.1650       33.86623 721.1650       33.86623 721.1650       33.86623 243.0179 5.725817 243.0179 5.725817 0.000000       0.000000 
1 1 1 0   0  24 o 64.53818 4.663015 51.56358       7.243876 51.56358       7.243876 51.56358       7.243876 64.53818 4.663015 64.53818 4.663015 0.000000       0.000000 
1 1 1 0   0  25 o 190.9697 4.978948 445.5738       23.13505 445.5738       23.13505 445.5738       23.13505 190.9697 4.978948 190.9697 4.978948 0.000000       0.000000 
1 1 1 0   0  26 o 253.9114 5.964737 787.8598       36.86108 787.8598       36.86108 787.8598       36.86108 253.9114 5.964737 253.9114 5.964737 0.000000       0.000000 
1 1 1 0   0  27 o 170.4147 6.884188 356.3643       28.48256 356.3643       28.48256 356.3643       28.48256 170.4147 6.884188 170.4147 6.884188 0.000000       0.000000 
1 1 1 0   0  28 o 144.3614 6.517201 256.1030       22.82035 256.1030       22.82035 256.1030       22.82035 144.3614 6.517201 144.3614 6.517201 0.000000       0.000000 
1 1 1 0   0  29 o 71.31210 4.413547 62.75443       7.601789 62.75443       7.601789 62.75443       7.601789 71.31210 4.413547 71.31210 4.413547 0.000000       0.000000 
1 1 1 0   0  30 o 59.48843 4.834023 44.04470       6.897827 44.04470       6.897827 44.04470       6.897827 59.48843 4.834023 59.48843 4.834023 0.000000       0.000000 
1 1 1 0   0  31 o 15.54297 8.729891 3.966785       4.999183 3.966785       4.999183 3.966785       4.999183 15.54297 8.729891 15.54297 8.729891 0.000000       0.000000 
1 1 1 0   0  32 o 22.81015 9.660494 9.045718       5.433757 9.045718       5.433757 9.045718       5.433757 22.81015 9.660494 22.81015 9.660494 0.000000       0.000000 
1 1 1 0   0  33 o 21.92063 10.93943 8.733824       7.112056 8.733824       7.112056 8.733824       7.112056 21.92063 10.93943 21.92063 10.93943 0.000000       0.000000 
1 1 1 0   0  34 o 91.77116 4.544954 103.6605       10.10704 103.6605       10.10704 103.6605       10.10704 91.77116 4.544954 91.77116 4.544954 0.000000       0.000000 
1 1 1 0   0  35 o 20.65193 10.07528 7.758555       5.975676 7.758555       5.975676 7.758555       5.975676 20.65193 10.07528 20.65193 10.07528 0.000000       0.000000 
1 1 1 0   0  36 o 49.97388 6.119927 31.96383       7.154244 31.96383       7.154244 31.96383       7.154244 49.97388 6.119927 49.97388 6.119927 0.000000       0.000000 
1 1 1 0   0  37 o 48.43997 6.164496 30.16293       6.955442 30.16293       6.955442 30.16293       6.955442 48.43997 6.164496 48.43997 6.164496 0.000000       0.000000 
1 1 1 0   0  38 o 40.72584 11.99670 25.37786       10.34762 25.37786       10.34762 25.37786       10.34762 40.72584 11.99670 40.72584 11.99670 0.000000       0.000000 
1 1 1 0   0  39 o 46.72579 6.604388 28.48095       7.087802 28.48095       7.087802 28.48095       7.087802 46.72579 6.604388 46.72579 6.604388 0.000000       0.000000 
1 1 1 0   0  40 o 51.87108 5.927304 34.49035       7.239446 34.49035       7.239446 34.49035       7.239446 51.87108 5.927304 51.87108 5.927304 0.000000       0.000000 
1 1 1 0   0  41 o 11.09844 7.427217 -1.725827      5.565861 -1.725827      5.565861 -1.725827      5.565861 11.09844 7.427217 11.09844 7.427217 0.000000       0.000000 
1 1 1 0   0  42 o 44.26784 6.857739 26.23451       6.869623 26.23451       6.869623 26.23451       6.869623 44.26784 6.857739 44.26784 6.857739 0.000000       0.000000 
1 1 1 0   0  43 o 34.66413 10.83095 19.64235       8.023371 19.64235       8.023371 19.64235       8.023371 34.66413 10.83095 34.66413 10.83095 0.000000       0.000000 
1 1 1 0   0  44 o 43.06918 6.533981 25.20138       6.390828 25.20138       6.390828 25.20138       6.390828 43.06918 6.533981 43.06918 6.533981 0.000000       0.000000 
1 1 1 0   0  45 o 18.45233 9.459105 7.112279       5.396217 7.112279       5.396217 7.112279       5.396217 18.45233 9.459105 18.45233 9.459105 0.000000       0.000000 
1 1 1 0   0  46 o 9.412241 6.516389 -3.038414      5.126508 -3.038414      5.126508 -3.038414      5.126508 9.412241 6.516389 9.412241 6.516389 0.000000       0.000000 
1 1 1 0   0  47 o 10.09636 7.211511 -8.234578      8.008878 -8.234578      8.008878 -8.234578      8.008878 10.09636 7.211511 10.09636 7.211511 0.000000       0.000000 
1 1 1 0   0  48 o 18.19609 9.595446 8.221049       5.664825 8.221049       5.664825 8.221049       5.664825 18.19609 9.595446 18.19609 9.595446 0.000000       0.000000 
1 1 1 0   0  49 o 11.99698 7.773010 2.372500       5.376144 2.372500       5.376144 2.372500       5.376144 11.99698 7.773010 11.99698 7.773010 0.000000       0.000000 
1 1 1 0   0  50 o 12.50202 7.877148 3.735480       5.068830 3.735480       5.068830 3.735480       5.068830 12.50202 7.877148 12.50202 7.877148 0.000000       0.000000 
1 1 1 0   0  51 o 10.66131 7.134329 1.551109       5.134394 1.551109       5.134394 1.551109       5.134394 10.66131 7.134329 10.66131 7.134329 0.000000       0.000000 
1 1 1 0   1  1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   1  2  o 869.0374 14.32830 9233.855       303.4376 9455.233       377.8528 8831.807       509.2076 878.6103 17.64779 846.6838 24.70599 31.92651       30.36166 
1 1 1 0   1  3  o 346.2160 5.956178 1461.370       50.25171 1467.317       87.33996 1458.428       61.43978 346.5565 10.35357 345.8157 7.290693 0.7407227      12.66296 
1 1 1 0   1  4  o 271.5504 4.177461 898.7424       27.64388 914.6497       39.49971 883.4717       38.70123 273.9024 5.917822 269.1941 5.899607 4.708313       8.356194 
1 1 1 0   1  5  o 103.7612 2.252772 131.1937       5.696239 141.2554       8.254389 122.0457       7.870698 107.6160 3.150938 100.0214 3.233367 7.594582       4.514761 
1 1 1 0   1  6  f 134.9374 2.570717 221.8807       8.453232 213.6611       11.75984 230.6685       12.15953 132.3566 3.649508 137.5280 3.631361 -5.171432      5.148368 
1 1 1 0   1  7  o 985.9855 14.06006 11885.24       337.8266 11427.33       464.7931 12398.07       491.8743 965.2256 19.76035 1005.280 20.07849 -40.05438      28.17121 
1 1 1 0   1  8  o 342.2593 5.136292 1427.986       42.83917 1411.133       60.12311 1445.366       61.05513 340.1530 7.253224 344.2530 7.277936 -4.100067      10.27510 
1 1 1 0   1  9  o 171.7555 3.022200 359.5075       12.64940 365.4513       18.07242 353.7991       17.71096 173.1533 4.283014 170.3172 4.270614 2.836075       6.048335 
1 1 1 0   1  10 o 257.9013 5.732837 811.0647       36.02958 788.1807       49.91351 835.9605       52.06136 254.0108 8.073869 261.5958 8.176780 -7.584946      11.49117 
1 1 1 0   1  11 o 625.5244 9.025718 4778.991       137.5822 4801.254       195.2160 4757.021       193.9314 626.2234 12.79234 623.3381 12.76699 2.885376       18.07318 
1 1 1 0   1  12 o 583.1666 8.444654 4153.970       120.0081 4152.471       169.6548 4155.471       169.7795 582.3411 11.95508 582.5505 11.95957 -0.2093506     16.91021 
1 1 1 0   1  13 f 377.5943 5.645945 1739.197       51.95151 1706.772       72.59507 1773.234       74.37845 373.8483 7.968483 381.0531 8.009871 -7.204865      11.29844 
1 1 1 0   1  14 o 389.2283 5.807082 1847.906       55.08057 1826.124       77.29924 1870.373       78.50616 386.7216 8.202396 391.3759 8.231398 -4.654358      11.62047 
1 1 1 0   1  15 o 81.77734 3.579093 81.66682       7.115230 81.13377       10.01776 82.20949       10.10775 81.41673 5.074407 81.95592 5.086085 -0.5391998     7.184557 
1 1 1 0   1  16 o 447.9452 7.638834 2447.818       83.38503 2468.857       145.3906 2437.506       101.7898 449.1226 13.29885 446.8668 9.347382 2.255798       16.25524 
1 1 1 0   1  17 o 648.2742 9.357363 5128.579       147.8251 5038.292       206.5425 5223.398       211.6641 642.0500 13.20093 653.7249 13.28667 -11.67487      18.72966 
1 1 1 0   1  18 o 268.6382 4.942501 879.6767       32.35569 887.1564       39.85326 865.2131       55.41901 269.7495 6.062715 266.1728 8.555065 3.576691       10.48550 
1 1 1 0   1  19 o 588.2174 8.539966 4221.362       122.4137 4241.643       173.6281 4201.317       172.6146 589.2400 12.09182 586.4340 12.07876 2.805969       17.09118 
1 1 1 0   1  20 o 274.1544 5.038183 916.2547       33.65931 935.3548       58.62517 906.8625       41.11040 276.7220 8.704519 272.7106 6.186053 4.011383       10.67876 
1 1 1 0   1  21 o 205.1172 3.594547 512.7863       17.96728 517.3801       25.48992 508.2499       25.32997 206.0041 5.077577 204.1780 5.090843 1.826065       7.190165 
1 1 1 0   1  22 o 196.2016 4.036478 469.2442       19.29928 443.0443       32.01073 484.2061       24.19012 190.4413 6.909057 199.2824 4.981188 -8.841171      8.517470 
1 1 1 0   1  23 o 426.0339 7.343201 2215.433       76.23698 2201.885       93.05977 2243.082       132.9396 424.5424 8.995074 427.7366 12.76816 -3.194183      15.61849 
1 1 1 0   1  24 o 541.1940 7.930232 3578.259       104.5863 3637.240       149.5654 3521.823       146.3034 544.8973 11.26368 536.1994 11.19675 8.697937       15.88199 
1 1 1 0   1  25 o 40.83504 4.342751 20.56835       4.255291 22.40582       6.067595 18.78987       5.969389 42.41600 6.040699 38.69152 6.565529 3.724483       8.921672 
1 1 1 0   1  26 o 68.88781 3.302307 58.00055       5.527507 55.31791       7.597189 61.01791       8.057230 67.16470 4.670788 70.55222 4.713432 -3.387527      6.635714 
1 1 1 0   1  27 o 127.8658 3.581772 199.6097       11.14963 207.6135       19.81754 195.9028       13.48659 130.1434 6.267146 126.6094 4.377783 3.534050       7.644743 
1 1 1 0   1  28 o 227.9443 3.920103 634.2339       21.77521 622.7978       30.51281 646.1028       31.08473 225.6753 5.548328 229.8587 5.549452 -4.183426      7.847315 
1 1 1 0   1  29 o 117.3871 3.497476 168.3324       9.993702 162.5304       11.93722 181.9277       18.27287 115.2721 4.256860 121.7158 6.180846 -6.443619      7.504912 
1 1 1 0   1  30 o 184.4921 3.506446 415.5359       15.76453 425.6136       22.52109 405.8539       22.07445 186.4689 4.960583 182.0827 4.979585 4.386276       7.028773 
1 1 1 0   1  31 o 52.29811 3.637994 33.56746       4.607529 34.07957       6.437273 33.02950       6.597749 52.51775 5.093797 51.66201 5.316500 0.8557396      7.362875 
1 1 1 0   1  32 o 165.0946 3.362352 332.8967       13.52733 333.2303       19.04602 332.5571       19.21618 164.9152 4.744158 164.7392 4.791769 0.1760101      6.743003 
1 1 1 0   1  33 o 65.85999 3.738014 53.19889       5.974642 52.72367       9.583369 53.50102       7.641456 65.20958 6.101594 65.90953 4.790341 -0.6999512     7.757372 
1 1 1 0   1  34 o 55.25799 4.250878 37.60857       5.680171 43.45655       7.194014 27.92740       9.256195 59.30517 5.025120 46.73918 8.437113 12.56599       9.820219 
1 1 1 0   1  35 o 130.6161 3.201594 208.5416       10.19059 211.0798       14.41560 206.0061       14.40774 131.1244 4.518167 129.5254 4.571790 1.598984       6.427682 
1 1 1 0   1  36 o 73.59233 3.455723 66.42063       6.180064 70.86578       8.770150 62.03623       8.710019 75.80246 4.771963 70.84475 5.078862 4.957710       6.968965 
1 1 1 0   1  37 o 43.31520 5.490192 23.51061       5.665146 21.70571       6.626860 28.41073       10.91904 41.28258 6.825578 46.49918 9.937614 -5.216599      12.05590 
1 1 1 0   1  38 o 55.01797 4.803322 37.59194       6.375439 34.70185       11.74612 38.79894       7.590878 51.38897 9.735991 55.69780 5.671695 -4.308830      11.26755 
1 1 1 0   1  39 o 50.47341 4.127944 31.58180       5.032986 21.86974       7.000424 41.97318       7.241111 41.13033 7.249125 57.97697 5.179734 -16.84665      8.909514 
1 1 1 0   1  40 o 21.17735 6.932948 5.519075       4.123164 8.210575       5.878366 2.912551       5.784828 25.48002 8.273859 19.87393 7.928930 5.606083       11.45970 
1 1 1 0   1  41 o 38.05190 5.035345 18.42108       4.554702 15.56984       6.316673 21.50904       6.573652 34.01513 7.788642 40.48119 6.911656 -6.466057      10.41316 
1 1 1 0   1  42 o 46.09056 4.373062 26.82028       4.852960 30.07498       6.910770 23.65383       6.816443 48.11423 6.025880 42.20667 6.862916 5.907558       9.132954 
1 1 1 0   1  43 o 112.5358 3.730191 158.6787       10.21545 160.5357       16.70968 157.5704       12.90871 110.5173 6.229653 111.1696 4.776116 -0.6523361     7.849832 
1 1 1 0   1  44 o 24.96560 6.973251 8.849841       4.404760 11.23666       5.536401 4.733431       7.270713 27.70644 7.845964 21.45318 8.769683 6.253254       11.76718 
1 1 1 0   1  45 o 15.68089 6.269696 2.370389       3.624973 -0.8982651     5.138495 5.608664       5.114561 14.84831 6.699507 20.37142 7.631920 -5.523113      10.15527 
1 1 1 0   1  46 o 29.75224 5.883488 12.78514       4.114510 16.79782       5.851834 8.861823       5.786312 32.66254 7.509217 23.18826 8.201060 9.474289       11.11961 
1 1 1 0   1  47 o 19.27884 7.351223 5.922409       4.793919 3.463580       5.803127 11.20618       8.506874 17.42588 7.514231 23.25105 9.493046 -5.825172      12.10709 
1 1 1 0   1  48 o 15.77618 6.418381 3.369637       3.872193 0.4732274      5.375633 6.493183       5.582434 14.62270 6.696268 19.12333 7.733388 -4.500631      10.22963 
1 1 1 0   1  49 o 11.29561 5.282791 -1.218000      3.618189 -3.680253      5.098803 1.279506       5.135175 11.85842 5.740921 14.33765 6.557842 -2.479224      8.715702 
1 1 1 0   1  50 o 13.19677 5.813032 1.900674       3.634227 5.727534       5.227347 -1.679523      5.056076 16.64511 7.154117 12.20056 5.858535 4.444553       9.246828 
1 1 1 0   1  51 o 13.12932 5.753699 2.354162       3.518920 -1.554212      4.860416 6.659586       5.101329 11.71732 5.656109 16.67245 7.114312 -4.955127      9.088730 
1 1 1 0   2  0  o 553.3591 16.01037 3742.113       215.6689 3742.113       215.6689 0.000000       0.000000 553.3591 16.01037 ?        ?        0.000000       16.01037 
1 1 1 0   2  1  o 481.3850 6.996835 2825.849       82.07867 2890.663       96.27792 2653.436       157.0289 486.8049 8.115880 465.7051 13.85210 21.09985       16.05453 
1 1 1 0   2  2  o 192.9589 4.500816 453.8203       21.16373 442.0306       29.70228 465.9786       30.16309 190.2947 6.414285 195.3910 6.343240 -5.096329      9.021072 
1 1 1 0   2  3  o 466.6906 7.849496 2656.534       89.27029 2754.291       158.5690 2611.175       108.0134 474.4963 13.72797 462.5715 9.582141 11.92484       16.74140 
1 1 1 0   2  4  o 379.5216 5.611436 1755.942       51.89753 1844.765       75.74392 1677.345       71.25040 388.8957 7.992424 370.8345 7.884443 18.06119       11.22690 
1 1 1 0   2  5  o 201.1674 3.305139 493.1759       16.20255 507.1989       23.25811 479.9534       22.58447 203.9884 4.678782 198.4341 4.670437 5.554367       6.610899 
1 1 1 0   2  6  o 1024.237 14.60010 12828.53       364.4118 13117.08       523.2290 12556.71       507.8283 1033.785 20.76947 1011.521 20.60183 22.26385       29.25417 
1 1 1 0   2  7  o 227.3457 3.647140 629.9096       20.20577 626.4630       28.47571 633.4050       28.67588 226.6973 5.154565 227.9497 5.162281 -1.252426      7.295114 
1 1 1 0   2  8  o 496.6404 7.223912 3008.222       87.42800 2990.255       123.1284 3026.492       124.1618 494.9167 10.20916 497.9041 10.23308 -2.987457      14.45485 
1 1 1 0   2  9  o 650.5734 10.80907 5169.643       171.3645 5416.598       306.1540 5056.972       206.7938 663.9910 18.94025 643.0597 13.19624 20.93134       23.08405 
1 1 1 0   2  10 o 470.5115 6.880484 2700.582       78.89061 2670.079       110.7280 2732.028       112.4278 467.5735 9.717877 472.9622 9.754637 -5.388794      13.76917 
1 1 1 0   2  11 o 517.0054 8.695601 3264.391       109.5547 3237.731       133.3753 3319.685       192.0829 514.5947 10.63590 519.9201 15.17683 -5.325378      18.53263 
1 1 1 0   2  12 f 72.48799 2.314265 64.10060       4.082802 69.08624       5.851729 59.37149       5.699201 75.21813 3.199771 69.70998 3.364864 5.508156       4.643366 
1 1 1 0   2  13 o 303.9350 4.678134 1126.424       34.64890 1115.913       48.70897 1137.192       49.29822 302.3975 6.609897 305.2659 6.626997 -2.868408      9.359905 
1 1 1 0   2  14 o 334.6224 5.867617 1365.779       47.84681 1405.299       59.65124 1294.481       80.12158 339.3365 7.213611 325.2724 10.12033 14.06412       12.42809 
1 1 1 0   2  15 o 331.3523 5.050268 1338.640       40.77937 1313.151       56.95188 1365.458       58.41751 328.0788 7.123507 334.5467 7.165561 -6.467926      10.10394 
1 1 1 0   2  16 o 563.3731 9.461357 3874.204       129.8930 3714.429       218.9817 3960.938       161.3420 550.4113 16.34428 569.3824 11.62806 -18.97113      20.05859 
1 1 1 0   2  17 f 588.1245 9.852240 4221.670       141.2018 4301.792       175.1394 4072.873       238.6745 593.4211 12.11113 576.4494 17.00920 16.97168       20.88043 
1 1 1 0   2  18 o 437.7576 6.483973 2336.607       69.16891 2360.194       98.46285 2313.627       97.18883 439.8022 9.187109 435.4439 9.158998 4.358276       12.97267 
1 1 1 0   2  19 o 377.5932 5.692496 1738.242       52.37970 1719.958       73.60161 1757.005       74.55986 375.4919 8.043602 379.5133 8.061986 -4.021332      11.38838 
1 1 1 0   2  20 o 272.6744 4.360528 906.2770       28.97474 885.1209       40.38377 928.7223       41.59604 269.4219 6.150889 275.9769 6.185050 -6.554993      8.722859 
1 1 1 0   2  21 o 343.6197 6.060021 1439.877       50.74442 1489.989       89.31060 1415.988       61.66499 349.0981 10.51028 340.6857 7.427603 8.412415       12.86994 
1 1 1 0   2  22 o 793.8270 11.41425 7705.104       220.8052 7734.042       313.0581 7676.458       311.4794 793.9166 16.18132 790.9630 16.15984 2.953674       22.86866 
1 1 1 0   2  23 o 559.2413 9.434881 3821.990       128.5795 3822.100       157.4773 3821.771       222.7056 558.8348 11.56374 557.3236 16.41576 1.511230       20.07978 
1 1 1 0   2  24 o 249.2337 4.129436 757.4277       25.08035 774.4407       35.88459 741.1808       35.06748 251.9237 5.845246 246.4551 5.838895 5.468628       8.261937 
1 1 1 0   2  25 o 237.2508 4.003499 686.4709       23.14641 693.9756       32.91747 679.1313       32.55349 238.4340 5.665291 235.8703 5.663544 2.563721       8.010696 
1 1 1 0   2  26 o 302.4192 6.824431 1118.230       50.29350 1143.499       72.40023 1094.666       69.91630 305.1153 9.749845 298.5540 9.622482 6.561371       13.69860 
1 1 1 0   2  27 f 21.91853 6.434915 5.972206       3.661777 8.364367       4.948395 3.076778       5.444093 25.85380 7.449044 20.05720 7.785216 5.796600       10.77487 
1 1 1 0   2  28 o 28.70168 6.604480 10.49191       4.523336 7.711597       8.521125 11.58276       5.337438 27.42962 9.922949 30.13969 7.337025 -2.710062      12.34086 
1 1 1 0   2  29 o 107.7681 2.984668 141.7948       7.830760 137.1249       10.88070 146.8127       11.27876 105.8691 4.225953 109.5501 4.232827 -3.680969      5.981263 
1 1 1 0   2  30 o 82.44131 3.558039 83.13361       7.131289 84.19818       8.646750 80.86941       12.61020 82.89581 4.295046 80.94891 6.445757 1.946892       7.745657 
1 1 1 0   2  31 o 190.5318 3.582150 443.3833       16.63211 433.4510       23.21243 453.8626       23.84295 188.0934 5.068820 192.4704 5.087929 -4.376938      7.181919 
1 1 1 0   2  32 o 102.3506 3.091454 128.0160       7.701780 129.1665       10.84416 126.8449       10.94040 102.6637 4.344363 101.7243 4.423966 0.9393387      6.200401 
1 1 1 0   2  33 o 188.2475 3.604134 433.1547       16.53355 422.5587       23.06690 444.3500       23.71033 185.5661 5.105843 190.2911 5.117731 -4.724991      7.229163 
1 1 1 0   2  34 o 125.7331 3.609692 193.4797       11.04857 188.7026       13.47204 203.2926       19.30878 124.0238 4.464794 128.3393 6.192163 -4.315514      7.633955 
1 1 1 0   2  35 o 96.01095 3.206565 112.8067       7.491817 118.1611       10.61231 107.4870       10.57783 98.07118 4.452116 93.49024 4.657620 4.580940       6.443195 
1 1 1 0   2  36 o 81.25076 3.317964 80.89653       6.555724 92.00967       9.352605 70.16209       9.191874 86.47179 4.453357 75.37005 5.033447 11.10174       6.720713 
1 1 1 0   2  37 o 81.41979 3.935616 81.50020       7.785575 77.51791       9.201982 91.53239       14.60537 79.22984 4.788379 85.47891 7.074917 -6.249077      8.543010 
1 1 1 0   2  38 o 80.86327 4.102276 80.57017       8.057328 74.83553       14.57388 83.09460       9.669487 76.76889 7.903077 81.94020 4.864398 -5.171310      9.280140 
1 1 1 0   2  39 o 126.7118 3.285632 197.1301       10.13691 204.3284       14.43054 190.1179       14.24282 128.5343 4.614588 123.9339 4.724606 4.600311       6.604265 
1 1 1 0   2  40 o 66.25410 3.581850 54.21175       5.761537 44.00532       7.879000 65.94189       8.446676 59.10504 5.534667 72.72115 4.793109 -13.61612      7.321641 
1 1 1 0   2  41 o 35.33334 5.288328 15.99612       4.413631 14.43012       6.190431 17.61521       6.294505 32.69485 7.865837 36.37408 7.354346 -3.679222      10.76837 
1 1 1 0   2  42 o 68.96777 3.577024 59.19793       5.991250 51.55749       8.244847 67.74635       8.721004 63.51140 5.377648 73.12299 4.922827 -9.611591      7.290633 
1 1 1 0   2  43 o 35.79053 5.274393 16.75405       4.462450 15.92112       6.223007 17.63573       6.402536 33.64120 7.750444 35.52153 7.624557 -1.880329      10.87213 
1 1 1 0   2  44 o 18.88355 6.977115 4.341709       4.246354 5.566686       5.391324 2.340034       6.891730 20.97931 7.840578 19.38575 8.270486 1.593557       11.39630 
1 1 1 0   2  45 o 17.68337 6.607908 3.901528       3.829112 7.670869       5.210941 -0.5226857     5.645488 22.70262 7.798227 15.70852 7.060566 6.994101       10.51969 
1 1 1 0   2  46 o 22.28514 7.321902 7.815405       4.597034 7.080513       5.455774 9.614400       8.536099 21.28238 7.900234 23.49553 9.540473 -2.213148      12.38686 
1 1 1 0   2  47 o 22.66614 6.819477 8.365453       4.072756 14.87895       5.646713 1.302996       5.879853 29.41055 7.765495 16.01113 7.200349 13.39942       10.58999 
1 1 1 0   2  48 o 13.46730 6.183589 -0.2454037     4.625379 3.518636       8.827685 -1.669829      5.430498 17.90885 8.334379 13.51379 6.367857 4.395064       10.48864 
1 1 1 0   2  49 o 12.25326 5.598522 0.2475681E-01  3.729646 0.8904747E-01  5.267337 -0.3988557E-01 5.281725 13.74109 6.409198 13.68450 6.394375 0.5659103E-01  9.053500 
1 1 1 0   2  50 o 16.21475 6.403458 4.917211       3.736649 2.844726       5.417141 6.798340       5.160999 14.69606 6.726933 17.51863 7.296551 -2.822574      9.924277 
1 1 1 0   2  51 o 11.98522 5.562890 0.5126704      3.892627 3.145708       6.043966 -1.353694      5.088523 14.40326 6.765404 11.96564 5.778768 2.437624       8.897463 
1 1 1 0   3  1  o 364.1134 5.404172 1616.192       47.95147 1588.669       67.07607 1644.959       68.57606 360.9119 7.626588 367.2485 7.662605 -6.336548      10.81112 
1 1 1 0   3  2  o 85.21318 2.403206 88.55377       4.985399 0.000000       0.000000 88.55377       4.985399 ?        ?        85.21318 2.403206 0.000000       2.403206 
1 1 1 0   3  3  o 435.5828 6.378179 2313.372       67.70232 2457.235       99.55053 2189.578       92.34593 448.7630 9.103123 423.6277 8.945350 25.13531       12.76268 
1 1 1 0   3  4  o 246.5826 3.868870 741.0386       23.24785 787.9527       34.08180 700.2158       31.79232 254.2354 5.501111 239.6648 5.443546 14.57060       7.739148 
1 1 1 0   3  5  o 410.9926 6.043208 2059.409       60.52541 2059.850       85.60487 2058.969       85.58685 410.9095 8.549018 410.8216 8.549047 0.8792114E-01  12.09016 
1 1 1 0   3  6  o 251.1702 3.939500 768.8767       24.11267 784.8688       34.51729 753.6344       33.69838 253.7351 5.582388 248.6356 5.561728 5.099533       7.880093 
1 1 1 0   3  7  o 889.9371 12.71791 9677.234       275.8107 9117.811       373.9306 10344.76       408.4637 862.6689 17.78733 918.7490 18.24402 -56.08008      25.48005 
1 1 1 0   3  8  o 287.0009 5.081549 1004.128       35.53984 1001.070       61.09285 1005.691       43.69409 286.2892 8.767210 287.1878 6.243392 -0.8985901     10.76308 
1 1 1 0   3  9  o 283.2166 4.373415 977.7472       30.18391 976.9380       42.65853 978.5585       42.71451 283.0396 6.184755 283.2742 6.187745 -0.2345276     8.748679 
1 1 1 0   3  10 o 391.0720 5.804070 1865.111       55.31277 1838.193       77.48676 1893.079       78.98285 388.0689 8.193748 393.8169 8.230048 -5.748016      11.61341 
1 1 1 0   3  11 o 516.2566 8.688294 3255.468       109.3040 3245.287       133.4823 3276.190       190.4301 515.1314 10.63333 516.3780 15.14961 -1.246582      18.50888 
1 1 1 0   3  12 o 362.2298 5.434501 1600.427       47.97113 1543.936       66.32497 1662.397       69.46689 355.5939 7.653970 368.9763 7.725798 -13.38239      10.87526 
1 1 1 0   3  13 o 91.34850 2.752250 101.7927       6.119696 101.7834       7.559263 101.8105       10.42478 91.31608 3.402957 91.25397 4.703780 0.6211090E-01  5.805658 
1 1 1 0   3  14 f 180.2516 3.673333 396.0406       16.13524 403.2325       20.00571 382.6551       27.29277 181.8621 4.514147 176.9956 6.337977 4.866486       7.781226 
1 1 1 0   3  15 o 154.8231 2.950684 292.1245       11.13255 282.4825       15.45679 302.5175       16.04741 152.1737 4.172091 157.4810 4.185293 -5.307358      5.909570 
1 1 1 0   3  16 o 807.8694 13.39272 7980.016       263.6612 7776.579       449.0190 8087.074       325.7303 794.4072 23.21944 812.5509 16.45021 -18.14368      28.45614 
1 1 1 0   3  17 f 883.1442 12.64066 9529.451       272.0429 9454.569       382.6864 9605.951       386.8002 878.4578 17.87665 885.4491 17.92615 -6.991272      25.31642 
1 1 1 0   3  18 o 291.1684 4.564698 1033.355       32.38861 1024.703       45.53733 1042.213       46.07626 289.8954 6.445997 292.3611 6.467277 -2.465698      9.131077 
1 1 1 0   3  19 o 144.6464 2.978742 254.9719       10.49969 258.6016       14.85479 251.3481       14.84283 145.6004 4.191021 143.5399 4.248016 2.060516       5.967436 
1 1 1 0   3  20 o 86.81477 2.767368 91.93951       5.847114 96.14322       8.297358 87.79265       8.241066 88.73263 3.846388 84.77592 4.000382 3.956711       5.549573 
1 1 1 0   3  21 o 49.91927 4.021245 30.57111       4.850397 26.85191       7.663151 33.05705       6.265107 46.40167 6.994118 51.82933 5.023310 -5.427662      8.611116 
1 1 1 0   3  22 o 299.7713 5.424871 1095.819       39.62923 1086.729       67.62564 1100.573       48.90659 298.1448 9.319265 300.3579 6.681781 -2.213043      11.46712 
1 1 1 0   3  23 o 185.9834 3.979947 421.6875       18.03797 425.8496       22.13374 413.4568       31.12536 186.8107 4.866167 183.9258 6.956953 2.884842       8.489923 
1 1 1 0   3  24 o 147.6996 3.132603 265.9233       11.27511 263.8910       15.77511 268.0458       16.12135 147.0365 4.407598 148.1868 4.469432 -1.150345      6.277160 
1 1 1 0   3  25 o 171.3364 3.345484 357.9268       13.96834 369.0810       20.02583 347.3580       19.49335 173.8638 4.730959 168.6645 4.747435 5.199265       6.702247 
1 1 1 0   3  26 o 134.3707 3.503759 220.3528       11.46315 216.0580       13.96215 229.2348       20.07894 132.9980 4.313660 136.8399 6.036177 -3.841904      7.419103 
1 1 1 0   3  27 o 232.1525 3.960018 657.6948       22.40302 651.8939       31.45283 663.6683       31.91759 230.9495 5.588645 233.0217 5.620792 -2.072235      7.926302 
1 1 1 0   3  28 f 62.70766 4.007085 48.20047       6.091257 47.20230       11.07094 48.63383       7.294643 61.58068 7.534148 62.90938 4.794421 -1.328701      8.930278 
1 1 1 0   3  29 o 147.2865 3.170126 264.6979       11.37825 263.4271       15.93164 266.0210       16.25582 146.7632 4.459759 147.4762 4.528621 -0.7129364     6.355931 
1 1 1 0   3  30 o 46.57024 3.842329 26.66741       4.321766 24.07771       6.009956 29.44059       6.219215 43.96936 5.746369 48.75855 5.320405 -4.789188      7.831185 
1 1 1 0   3  31 o 24.12013 6.991165 7.300159       4.346714 4.260731       5.154273 14.78480       8.088296 20.88864 7.692353 34.03537 9.428064 -13.14673      12.16802 
1 1 1 0   3  32 o 184.8079 4.030833 417.6099       18.15313 395.1034       29.63196 431.1313       22.96766 179.0552 6.803433 187.5268 5.030486 -8.471588      8.461235 
1 1 1 0   3  33 o 49.39995 3.930844 30.03456       4.693044 29.64173       6.434672 30.48100       6.859626 48.83867 5.502273 49.48129 5.798712 -0.6426239     7.993752 
1 1 1 0   3  34 o 154.8760 3.818159 293.4640       14.41034 289.0854       17.49344 302.7079       25.41759 153.4881 4.682443 156.5009 6.680079 -3.012833      8.157740 
1 1 1 0   3  35 f 45.37579 4.398426 25.47458       4.802670 28.91271       6.789039 22.03045       6.794968 48.09454 5.917228 41.67048 6.935133 6.424057       9.116449 
1 1 1 0   3  36 f 207.4444 4.441780 528.1897       22.45406 533.1156       27.36463 518.0377       39.28458 207.9778 5.403865 203.6792 7.929940 4.298599       9.596129 
1 1 1 0   3  37 o 54.10344 4.032802 36.11423       5.278770 35.40637       7.316963 36.88256       7.623059 53.23167 5.730765 54.31388 5.851696 -1.082211      8.190484 
1 1 1 0   3  38 o 98.45507 3.252332 118.8975       7.792425 114.6678       10.68648 123.7000       11.38717 96.37598 4.563152 100.0736 4.682374 -3.697609      6.538117 
1 1 1 0   3  39 o 52.45868 5.096316 34.40647       6.432925 47.83636       12.81467 29.88193       7.438032 60.53368 8.957099 48.47157 6.457520 12.06211       11.04216 
1 1 1 0   3  40 o 77.68182 3.406099 74.39317       6.432145 69.70877       8.875308 79.57533       9.334941 74.72478 4.901021 79.88950 4.817351 -5.164726      6.872181 
1 1 1 0   3  41 o 103.9170 3.291803 133.3328       8.325464 129.0929       11.46238 138.0673       12.11246 101.5908 4.642304 105.0086 4.745645 -3.417786      6.638685 
1 1 1 0   3  42 o 25.45177 7.108235 8.761321       4.577220 4.079797       6.758220 12.72864       6.221385 21.42230 8.562257 30.27684 8.221848 -8.854532      11.87059 
1 1 1 0   3  43 o 64.66537 3.607839 52.43631       5.662780 47.67679       7.754929 57.87322       8.288426 60.66782 5.298575 67.00948 5.114385 -6.341667      7.364227 
1 1 1 0   3  44 o 13.78791 6.130085 -0.6738061     4.133796 0.9141394E-01  5.016570 -2.292618      7.296455 15.66568 6.867393 17.03513 7.801164 -1.369451      10.39323 
1 1 1 0   3  45 o 17.12045 6.511893 3.509898       3.755805 3.733075       5.051555 3.234039       5.616225 18.37441 7.382562 18.37473 7.628856 -0.3166199E-03 10.61610 
1 1 1 0   3  46 o 21.49584 7.310750 7.235244       4.577453 6.380070       5.383157 9.467999       8.698215 20.49396 7.795805 23.30056 9.566028 -2.806604      12.34032 
1 1 1 0   3  47 o 13.79664 5.953105 1.218351       3.646921 6.275171       5.281000 -3.391712      5.042325 19.59732 7.650407 12.58253 5.989367 7.014793       9.716030 
1 1 1 0   3  48 o 13.11955 6.016638 -0.3069359     4.361006 -0.9838956     7.895171 -0.9704922E-02 5.231512 15.67688 7.471356 14.17451 6.532997 1.502373       9.924777 
1 1 1 0   3  49 o 11.59105 5.392811 -0.8573934     3.692212 -1.587423      5.164758 -0.9433152E-01 5.280313 12.78919 6.080314 13.62250 6.374558 -0.8333044     8.809381 
1 1 1 0   3  50 o 8.518770 4.232657 -5.783896      3.400525 -8.797440      4.685717 -2.430733      4.942705 9.377398 4.705542 11.75209 5.680460 -2.374696      7.376297 
1 1 1 0   3  51 o 13.04738 5.802240 2.186375       3.705712 -1.764375      5.061903 6.749062       5.439817 11.76332 5.700879 16.52960 7.200542 -4.766280      9.184107 
1 1 1 0   4  0  o 794.1829 16.05406 7701.719       310.7003 7695.081       439.1164 7708.374       439.6771 792.6537 22.75673 793.3369 22.76614 -0.6831665     32.18953 
1 1 1 0   4  1  o 750.7207 10.74958 6880.286       196.6554 6974.574       281.0258 6789.808       275.2883 755.1013 15.27232 745.0533 15.16227 10.04797       21.52065 
1 1 1 0   4  2  o 187.3814 2.568017 427.8655       11.72628 443.8192       16.90270 413.0625       16.28167 190.8322 3.634698 184.1012 3.629160 6.730988       5.136325 
1 1 1 0   4  3  f 295.5867 4.510984 1064.939       32.49319 1029.733       44.98983 1103.328       46.97932 290.6107 6.352820 300.8146 6.408727 -10.20383      9.023863 
1 1 1 0   4  4  o 176.7632 3.031702 380.7651       13.05914 387.0767       18.64951 374.6928       18.29248 178.2083 4.294410 175.3345 4.281236 2.873734       6.063904 
1 1 1 0   4  5  o 349.8252 5.228257 1491.795       44.57015 1457.622       62.12816 1528.032       63.97588 345.7161 7.374504 353.9655 7.416845 -8.249420      10.45911 
1 1 1 0   4  6  o 967.1708 13.79037 11434.41       325.0240 11494.83       461.2704 11374.84       458.0531 968.1488 19.55138 963.0934 19.51692 5.055359       27.62547 
1 1 1 0   4  7  o 648.4192 10.76410 5133.880       170.0864 5438.825       306.0848 4997.653       204.5799 665.6615 18.88824 639.4259 13.12915 26.23560       23.00305 
1 1 1 0   4  8  o 536.2805 8.973439 3510.003       117.2700 3664.131       208.5315 3438.716       141.8203 546.7840 15.66635 530.5903 10.96839 16.19366       19.12433 
1 1 1 0   4  9  o 88.64674 2.260377 95.82232       4.878938 95.49596       6.899544 96.14874       6.900176 88.46092 3.205912 88.76361 3.195201 -0.3026886     4.526277 
1 1 1 0   4  10 o 152.5917 2.826149 283.7705       10.50901 291.5055       15.03896 276.3892       14.69112 154.5881 3.995488 150.5233 4.008683 4.064804       5.659811 
1 1 1 0   4  11 o 506.2280 8.535253 3130.183       105.2928 3142.255       129.2310 3106.344       181.6041 506.8896 10.46206 502.8320 14.83686 4.057556       18.15453 
1 1 1 0   4  12 o 261.4701 4.129622 833.5181       26.31288 833.5194       37.17755 833.5168       37.24661 261.3908 5.836524 261.3898 5.847388 0.1007080E-02  8.261777 
1 1 1 0   4  13 o 326.4178 5.727395 1299.649       45.55825 1297.651       55.84706 1303.625       78.76882 326.0771 7.028197 326.4137 9.914106 -0.3366699     12.15257 
1 1 1 0   4  14 o 294.3225 5.251038 1056.297       37.66212 1061.427       64.71686 1053.670       46.31216 294.6788 9.022863 293.8981 6.466394 0.7806702      11.10073 
1 1 1 0   4  15 o 415.8335 6.168574 2108.693       62.50869 2102.237       88.20528 2115.207       88.59727 415.0207 8.721451 416.2980 8.733332 -1.277283      12.34240 
1 1 1 0   4  16 o 345.8135 6.082602 1458.105       51.25868 1379.003       86.26095 1501.283       63.73107 335.9060 10.55114 350.8358 7.454375 -14.92972      12.91875 
1 1 1 0   4  17 o 731.2589 10.51128 6527.701       187.3108 6625.459       267.6402 6433.849       262.2375 736.0167 14.92202 725.3113 14.83660 10.70544       21.04260 
1 1 1 0   4  18 o 128.5544 2.806109 201.3906       8.790783 194.5874       12.21984 208.6877       12.65570 126.2932 3.975491 130.7933 3.975291 -4.500137      5.622052 
1 1 1 0   4  19 o 817.9784 11.73097 8173.578       233.8363 8282.185       333.6294 8068.710       327.8356 822.3192 16.64899 811.6711 16.57448 10.64807       23.49260 
1 1 1 0   4  20 o 100.5630 3.162066 123.3680       7.739365 128.6123       12.66619 120.2435       9.776726 102.5863 5.082469 99.24123 4.051157 3.345116       6.499490 
1 1 1 0   4  21 o 342.1032 5.247941 1426.944       43.75041 1418.786       61.58479 1435.256       62.16412 341.0121 7.410843 342.9841 7.437547 -1.972046      10.49941 
1 1 1 0   4  22 o 126.3736 2.945930 194.6377       9.072250 197.1071       12.75042 192.1056       12.91129 127.0909 4.122387 125.4613 4.229073 1.629669       5.905855 
1 1 1 0   4  23 f 98.26177 4.042215 117.9132       9.658549 112.5559       12.67563 125.3300       14.91431 95.90779 5.445879 101.1716 6.077362 -5.263802      8.160387 
1 1 1 0   4  24 o 184.5752 3.455050 415.3342       15.54045 391.5127       21.23583 442.8009       22.80279 179.0881 4.870458 190.4624 4.917066 -11.37428      6.920903 
1 1 1 0   4  25 o 389.2748 6.803930 1851.668       64.54346 1838.688       78.72497 1878.280       112.7271 387.6307 8.334091 390.7517 11.85205 -3.121033      14.48890 
1 1 1 0   4  26 o 248.4048 4.136162 752.8685       25.03765 702.5531       33.99374 812.5291       37.01621 239.8007 5.817179 257.8787 5.890341 -18.07802      8.278628 
1 1 1 0   4  27 o 210.8689 3.725818 542.5587       19.14566 564.6370       27.51065 521.8223       26.66142 214.9665 5.251629 206.5830 5.300435 8.383499       7.461516 
1 1 1 0   4  28 o 76.12664 3.739476 70.90471       6.915960 88.48001       13.31244 64.40782       8.093920 84.74888 6.495464 72.46451 4.607362 12.28437       7.963595 
1 1 1 0   4  29 o 227.5065 3.933494 632.0640       21.80762 609.9328       30.11559 656.4625       31.62070 223.2445 5.535723 231.5909 5.602914 -8.346344      7.876349 
1 1 1 0   4  30 o 51.15883 3.677335 32.12420       4.553894 30.16418       6.173586 34.46356       6.744585 49.37551 5.209281 52.79821 5.314250 -3.422703      7.441630 
1 1 1 0   4  31 o 34.10335 4.894008 14.52237       3.950835 9.618929       5.302793 20.64030       5.923196 27.53444 7.636428 40.55645 6.188950 -13.02201      9.829452 
1 1 1 0   4  32 o 37.28274 5.403832 17.39253       4.766641 17.48799       5.705185 17.17184       8.674484 37.17929 6.535415 36.51371 9.617189 0.6655846      11.62764 
1 1 1 0   4  33 o 199.9489 3.710584 488.8140       18.07996 478.5070       25.10931 499.9118       26.05473 197.4284 5.223611 201.7756 5.303451 -4.347229      7.443971 
1 1 1 0   4  34 o 54.42936 3.789983 36.41852       4.995569 42.79202       6.900494 29.39965       7.241436 58.86883 4.853221 48.45902 6.279694 10.40981       7.936517 
1 1 1 0   4  35 o 123.5490 3.655969 186.9592       10.99512 188.9036       13.42099 182.9907       19.17399 124.0363 4.447368 121.5498 6.496849 2.486481       7.873253 
1 1 1 0   4  36 o 106.6411 3.729058 139.4622       9.675891 133.3094       11.52792 154.1310       17.79964 104.0936 4.555582 111.3752 6.587657 -7.281601      8.009404 
1 1 1 0   4  37 o 19.47557 6.923954 4.106368       4.129146 5.754060       5.543384 2.052682       6.188762 22.75451 8.028918 19.86998 8.102878 2.884531       11.40702 
1 1 1 0   4  38 o 22.24739 7.090338 6.102477       4.330737 -1.819154      5.840635 15.77658       6.454434 16.44717 7.300935 34.76432 7.809965 -18.31715      10.69108 
1 1 1 0   4  39 o 53.54211 4.940989 35.79027       6.374143 43.65859       11.97735 32.68129       7.528847 57.82682 8.774715 50.78574 6.212670 7.041084       10.75141 
1 1 1 0   4  40 o 171.4543 3.565540 362.1750       14.89738 365.8503       21.03577 358.4771       21.10052 171.3096 5.044451 169.5203 5.113664 1.789368       7.183038 
1 1 1 0   4  41 o 44.84515 4.514310 25.32190       4.866306 24.94403       6.669903 25.75197       7.115701 43.79781 6.441549 44.36156 6.798619 -0.5637512     9.365617 
1 1 1 0   4  42 o 51.68535 4.137075 33.60786       5.167237 27.49067       6.902591 41.40578       7.793381 45.73157 6.366191 56.62825 5.726099 -10.89668      8.562511 
1 1 1 0   4  43 o 26.22585 6.381597 9.410889       4.039149 14.87130       5.425016 2.618830       6.050467 32.80967 6.998770 19.14937 7.931512 13.66029       10.57789 
1 1 1 0   4  44 o 27.85074 6.271387 10.80596       4.153587 12.17641       5.566951 9.085025       6.238335 28.76788 7.762712 24.90779 8.533174 3.860088       11.53580 
1 1 1 0   4  45 o 12.18561 5.814478 -4.751826      4.811744 -4.751826      4.811744 0.000000       0.000000 12.18561 5.814478 ?        ?        0.000000       5.814478 
1 1 1 0   4  46 f 17.21143 6.501236 3.968580       3.728059 4.994860       5.215882 2.896688       5.330529 19.01003 7.547007 17.22843 7.309061 1.781605       10.50617 
1 1 1 0   4  47 o 30.55847 5.812557 13.97705       4.170350 9.268188       5.814416 18.96594       5.984805 22.46264 8.186557 33.71280 7.480412 -11.25017      11.08947 
1 1 1 0   4  48 o 11.78479 5.605449 -2.684360      4.399975 -0.9578078     8.828983 -3.254850      5.075102 16.13419 7.745925 12.34212 5.911427 3.792069       9.743937 
1 1 1 0   4  49 o 8.248752 4.117126 -6.864715      3.372035 -1.365990      4.955117 -11.60764      4.601995 12.66088 6.000806 8.790173 4.442512 3.870708       7.466297 
1 1 1 0   4  50 o 12.69745 5.745486 1.182689       3.811147 3.944499       6.152087 -0.5372572     4.854929 15.40265 7.093797 12.50128 5.929449 2.901364       9.245558 
1 1 1 0   4  51 o 13.48073 5.873779 2.762937       3.621630 2.029967       4.916913 3.632190       5.354544 13.45170 6.246482 14.48078 6.650492 -1.029072      9.124011 
1 1 1 0   5  1  o 291.0143 5.148539 1032.353       36.51189 1073.736       45.81197 960.2955       60.45150 296.7557 6.334958 280.4126 8.857651 16.34317       10.88989 
1 1 1 0   5  2  o 748.8745 8.753576 6842.015       159.7462 6570.219       219.7162 7146.807       232.6705 733.3903 12.29393 764.8638 12.48306 -31.47357      17.52049 
1 1 1 0   5  3  o 708.0748 9.082234 6117.412       156.7141 5883.821       241.0628 6288.394       206.2429 693.7194 14.25970 717.5601 11.79464 -23.84076      18.50547 
1 1 1 0   5  4  o 907.9988 12.97961 10074.19       287.1991 10729.80       424.8926 9522.670       389.7063 935.6716 18.63458 881.6034 18.13961 54.06818       26.00564 
1 1 1 0   5  5  o 817.7239 11.69125 8166.306       232.9719 7999.296       324.9147 8343.026       334.2267 808.3932 16.49342 825.5513 16.61350 -17.15802      23.41028 
1 1 1 0   5  6  o 409.5322 8.544611 2046.251       85.27397 0.000000       0.000000 2046.251       85.27397 ?        ?        409.5322 8.544611 0.000000       8.544611 
1 1 1 0   5  7  o 314.1348 5.492409 1203.091       42.04506 1219.426       73.01027 1194.985       51.42906 315.9302 9.494012 313.0273 6.742024 2.902924       11.64436 
1 1 1 0   5  8  o 249.2289 3.944577 757.1031       23.95713 743.3418       33.53860 771.4403       34.23309 246.9103 5.574034 251.5333 5.584888 -4.623016      7.890553 
1 1 1 0   5  9  o 407.0298 6.017424 2020.572       59.68606 2012.215       84.20627 2029.011       84.61286 405.9927 8.511186 407.6831 8.516821 -1.690430      12.04062 
1 1 1 0   5  10 o 220.4945 3.606026 592.6309       19.37594 599.9333       27.58761 585.5220       27.21953 221.8021 5.104020 219.1221 5.097514 2.679993       7.213575 
1 1 1 0   5  11 o 279.2389 5.042514 950.9291       34.31304 1017.227       43.54685 842.3550       55.72736 288.7435 6.188829 262.4358 8.725968 26.30765       10.69786 
1 1 1 0   5  12 o 592.7273 9.904736 4295.350       143.0652 4255.844       174.2561 4377.045       250.5866 589.4933 12.13035 596.0266 17.27088 -6.533325      21.10518 
1 1 1 0   5  13 o 166.8712 3.530631 339.4190       14.35720 338.8473       17.37064 340.6516       25.50551 166.6606 4.280617 166.9867 6.278997 -0.3260956     7.599308 
1 1 1 0   5  14 o 139.2046 2.781842 236.1558       9.436744 222.7074       13.00120 251.1298       13.71885 135.1116 3.952954 143.4825 3.927275 -8.370834      5.572193 
1 1 1 0   5  15 o 78.70823 2.465972 75.56603       4.723981 70.64888       6.578890 80.79985       6.787426 76.05333 3.559630 81.35119 3.431481 -5.297859      4.944293 
1 1 1 0   5  16 o 415.8481 7.153954 2108.961       72.49650 2197.428       129.7235 2068.783       87.42249 423.8958 12.57198 411.7780 8.712121 12.11771       15.29561 
1 1 1 0   5  17 f 633.5301 9.155119 4897.288       141.3407 4835.655       198.1970 4961.066       201.6188 629.0886 12.92853 637.1862 12.98460 -8.097656      18.32339 
1 1 1 0   5  18 o 512.6580 7.496506 3205.472       93.65322 3252.950       133.7417 3159.792       131.1865 516.1820 10.63232 508.7419 10.58171 7.440125       15.00062 
1 1 1 0   5  19 f 546.8773 9.191940 3650.004       122.4992 3824.146       218.0535 3569.700       148.0740 558.6167 16.03477 540.6101 11.23980 18.00659       19.58180 
1 1 1 0   5  20 o 748.1609 12.42969 6842.857       226.6164 6702.680       385.8006 6916.701       280.0146 737.7303 21.48285 751.5483 15.28930 -13.81793      26.36808 
1 1 1 0   5  21 o 495.6604 7.285430 2997.436       87.99854 3041.285       125.6627 2955.242       123.2693 498.9382 10.33531 491.8361 10.28486 7.102112       14.58070 
1 1 1 0   5  22 o 617.3156 8.963908 4654.425       134.8468 4805.331       194.8497 4515.718       186.8088 626.4698 12.76332 607.3304 12.62223 19.13940       17.95057 
1 1 1 0   5  23 o 523.0672 7.676934 3341.161       97.85463 3423.953       140.6462 3263.483       136.2339 528.9025 10.91230 516.3781 10.82633 12.52435       15.37165 
1 1 1 0   5  24 o 185.4633 6.586810 420.5446       29.72206 420.5446       29.72206 0.000000       0.000000 185.4633 6.586810 ?        ?        0.000000       6.586810 
1 1 1 0   5  25 o 44.66426 3.910739 24.51694       4.213624 16.83490       5.785941 33.19189       6.148500 36.54155 6.746027 51.92070 4.918142 -15.37915      8.348474 
1 1 1 0   5  26 o 190.6244 3.507557 443.2131       16.29368 451.9178       23.14408 434.6593       22.94274 192.3261 4.942260 188.6099 4.996056 3.716263       7.027554 
1 1 1 0   5  27 o 36.95757 4.407714 16.91200       3.891508 15.38223       5.264117 18.75543       5.778644 34.90984 6.424540 38.65123 6.355902 -3.741398      9.037268 
1 1 1 0   5  28 o 131.5303 3.632138 211.3108       11.63076 204.8580       20.65980 214.3047       14.07265 129.1410 6.586620 132.3876 4.368048 -3.246597      7.903380 
1 1 1 0   5  29 o 73.17178 3.159564 65.45396       5.620594 69.19768       7.841079 61.49738       8.060919 75.13613 4.300397 70.77424 4.700470 4.361893       6.370858 
1 1 1 0   5  30 o 84.10261 3.059585 86.43367       6.260136 79.96119       8.402735 94.50747       9.384787 80.77193 4.284304 87.81783 4.399374 -7.045898      6.140827 
1 1 1 0   5  31 o 111.7621 3.394493 152.6767       9.234254 157.6232       14.80643 149.5279       11.81317 113.2921 5.378445 110.4835 4.396436 2.808533       6.946677 
1 1 1 0   5  32 o 53.85633 3.625985 35.60468       4.731080 33.52689       6.392664 38.12090       7.034862 52.05821 5.104697 55.51746 5.262676 -3.459244      7.331691 
1 1 1 0   5  33 o 67.14600 3.788864 55.30939       6.174469 56.52572       7.448644 52.63796       11.03886 67.78442 4.535418 64.94151 7.090403 2.842918       8.416878 
1 1 1 0   5  34 o 46.97204 4.092146 27.21582       4.637396 25.62309       6.214636 29.21697       6.966032 45.28653 5.761588 48.34908 6.044027 -3.062546      8.350219 
1 1 1 0   5  35 o 64.74174 4.851286 51.75198       7.598146 51.75198       7.598146 0.000000       0.000000 64.74174 4.851286 ?        ?        0.000000       4.851286 
1 1 1 0   5  36 o 62.63710 3.649531 48.21128       5.546506 54.02134       7.670033 41.84269       8.030250 66.12334 4.792519 57.95560 5.762122 8.167747       7.494684 
1 1 1 0   5  37 o 53.92998 3.976661 35.88021       5.189428 30.37878       6.980204 42.67845       7.759403 49.20238 5.941833 58.53696 5.504127 -9.334572      8.099432 
1 1 1 0   5  38 o 41.35972 4.788820 21.37914       4.737532 25.58808       6.420415 16.34833       7.019339 45.00455 6.003880 35.28608 8.302579 9.718475       10.24594 
1 1 1 0   5  39 o 74.67721 4.314178 69.05046       7.817530 81.75896       14.86212 64.18929       9.191878 79.94331 7.725034 71.69936 5.298244 8.243958       9.367366 
1 1 1 0   5  40 o 20.38665 6.990770 4.929902       4.187195 6.116363       5.672472 3.509439       6.206699 22.92456 8.118841 20.82859 8.244257 2.095966       11.57080 
1 1 1 0   5  41 o 90.00068 3.729890 100.5248       8.162735 107.6463       12.90246 95.77220       10.54020 91.98334 5.785391 87.22549 4.979404 4.757843       7.633165 
1 1 1 0   5  42 o 53.69510 3.921000 36.17411       5.095229 35.96014       6.827954 36.44298       7.654087 52.87848 5.373320 52.87377 6.049174 0.4707336E-02  8.091048 
1 1 1 0   5  43 o 43.75987 4.394374 24.51087       4.622714 22.32883       6.142964 27.35993       7.019350 40.68799 6.407149 44.98673 6.598983 -4.298744      9.197724 
1 1 1 0   5  44 o 20.63140 6.644289 5.875428       3.795677 4.037310       4.922637 8.570753       5.960967 18.95696 7.390336 24.25259 8.340219 -5.295624      11.14344 
1 1 1 0   5  45 o 22.59402 7.786923 7.720360       5.197231 7.720360       5.197231 0.000000       0.000000 22.59402 7.786923 ?        ?        0.000000       7.786923 
1 1 1 0   5  46 o 23.05557 6.542284 8.167420       3.845432 8.011967       5.125525 8.367598       5.816253 22.15088 7.727681 22.37167 8.182487 -0.2207909     11.25478 
1 1 1 0   5  47 o 12.57745 5.644653 -0.7401406E-01 3.593069 -2.795564      4.893293 3.110237       5.292937 12.63134 5.979856 16.72002 7.192747 -4.088673      9.353838 
1 1 1 0   5  48 o 14.50010 6.093425 2.380994       3.647995 1.446786       5.003798 3.440857       5.329700 14.79553 6.648948 16.39113 7.133929 -1.595597      9.751998 
1 1 1 0   5  49 o 13.92062 6.185966 1.833942       4.204144 -1.580538      8.940019 2.803440       4.763756 15.03477 7.350582 14.96549 6.620932 0.6927681E-01  9.892815 
1 1 1 0   5  50 o 17.13506 6.720618 5.990336       4.091246 1.573459       6.412264 9.022925       5.313253 14.29629 6.790546 19.24905 7.625049 -4.952759      10.21043 
1 1 1 0   5  51 o 8.852972 4.366371 -4.367892      3.381738 -0.2023562     4.826519 -8.384853      4.739664 12.22388 5.830150 9.320739 4.684676 2.903146       7.479094 
1 1 1 0   6  0  o 356.0252 7.533844 1545.165       65.36324 1605.208       94.66466 1490.457       90.36062 362.6299 10.72421 349.4225 10.62422 13.20746       15.09579 
1 1 1 0   6  1  o 693.5353 9.963802 5870.396       168.3952 5942.120       239.7790 5800.593       236.5475 697.1748 14.11346 688.8257 14.09201 8.349060       19.94428 
1 1 1 0   6  2  o 251.7645 3.974014 772.5212       24.38147 720.5953       33.09047 834.1923       36.06210 243.1245 5.585191 261.5852 5.657203 -18.46068      7.949736 
1 1 1 0   6  3  o 775.0447 9.053399 7329.239       170.9915 7429.970       244.1761 7232.307       239.5278 779.8073 12.84931 769.3768 12.77558 10.43048       18.11961 
1 1 1 0   6  4  o 688.8682 8.841212 5789.876       148.4171 5725.013       232.9267 5834.210       192.5715 684.3032 13.96801 691.1848 11.43304 -6.881592      18.05048 
1 1 1 0   6  5  o 234.5984 4.326826 670.8203       24.73606 670.0787       42.55549 671.1987       30.39898 234.2702 7.463747 234.6439 5.316351 -0.3736572     9.163574 
1 1 1 0   6  6  o 238.8402 4.387694 695.3245       25.53759 706.7963       44.29163 689.6116       31.25616 240.5931 7.563840 237.8337 5.392945 2.759323       9.289539 
1 1 1 0   6  7  f 156.8070 2.871070 299.6515       10.97098 290.0677       15.32184 309.7350       15.71629 154.2107 4.080770 159.3576 4.050356 -5.146927      5.749615 
1 1 1 0   6  8  o 631.0599 9.097404 4862.565       139.9021 5019.134       202.1952 4718.763       193.7761 640.4442 12.95548 621.0156 12.80447 19.42865       18.21535 
1 1 1 0   6  9  o 312.9359 4.772758 1194.036       36.39662 1171.289       50.87877 1217.877       52.08771 309.8344 6.738618 315.9344 6.765536 -6.100037      9.548899 
1 1 1 0   6  10 o 342.3795 5.984982 1430.057       49.93520 1397.401       60.08199 1503.002       89.79588 338.3478 7.286934 350.3979 10.52814 -12.05011      12.80395 
1 1 1 0   6  11 o 263.6022 5.876553 847.6841       37.74920 847.6841       37.74920 0.000000       0.000000 263.6022 5.876553 ?        ?        0.000000       5.876553 
1 1 1 0   6  12 o 436.4721 7.448248 2325.474       79.22218 2330.481       96.97686 2315.428       137.3589 436.7442 9.111814 434.5307 12.98637 2.213440       15.86414 
1 1 1 0   6  13 o 588.3506 8.518862 4226.313       122.1389 4253.208       173.4417 4199.853       172.0278 589.6165 12.07113 585.9109 12.04844 3.705505       17.05512 
1 1 1 0   6  14 o 146.4820 2.852044 261.4902       10.18068 264.0602       14.41328 258.9313       14.38207 147.1317 4.023727 145.6935 4.054785 1.438217       5.712413 
1 1 1 0   6  15 o 711.5393 10.23437 6181.132       177.4582 6298.252       254.1015 6069.624       247.9395 717.5244 14.53231 704.3979 14.44413 13.12653       20.48953 
1 1 1 0   6  16 o 386.5305 6.706365 1821.828       63.16945 1740.579       107.0402 1865.247       78.24818 377.3417 11.65459 391.0343 8.211514 -13.69266      14.25688 
1 1 1 0   6  17 o 50.50129 2.791167 31.17400       3.421622 27.43775       4.704030 35.37174       4.986088 47.26750 4.125154 53.73660 3.832784 -6.469097      5.630908 
1 1 1 0   6  18 o 786.9057 11.29269 7562.283       216.5490 7715.341       310.5222 7417.374       302.1428 793.8970 16.05064 778.4436 15.92755 15.45343       22.61216 
1 1 1 0   6  19 o 288.1682 5.203715 1012.355       36.54228 982.0942       61.25707 1029.073       45.53081 283.5441 8.876359 290.4964 6.431740 -6.952362      10.96162 
1 1 1 0   6  20 o 144.0986 2.990350 253.0537       10.50069 246.0116       14.59971 260.6008       15.11407 142.0025 4.223721 146.1550 4.248081 -4.152512      5.990493 
1 1 1 0   6  21 o 498.8650 8.492004 3038.058       103.2356 3006.690       178.4033 3053.849       126.5815 495.1102 14.80311 499.9244 10.39034 -4.814240      18.08566 
1 1 1 0   6  22 o 210.9238 3.669188 542.3062       18.85956 529.0151       26.26670 556.4494       27.09552 208.2786 5.175172 213.6098 5.205232 -5.331268      7.340085 
1 1 1 0   6  23 o 61.48423 3.221320 46.20706       4.809680 39.78391       6.494148 54.01061       7.158042 56.91999 4.724418 66.40324 4.449203 -9.483257      6.489648 
1 1 1 0   6  24 f 223.1527 5.388064 607.7070       29.30023 607.7070       29.30023 0.000000       0.000000 223.1527 5.388064 ?        ?        0.000000       5.388064 
1 1 1 0   6  25 o 46.46143 3.704435 26.49419       4.159506 20.06391       5.521778 34.92981       6.324441 40.11853 5.817568 53.27060 4.927739 -13.15206      7.624088 
1 1 1 0   6  26 o 174.3230 3.356566 370.6412       14.25890 377.7440       20.19512 363.5804       20.13527 175.8361 4.717314 172.4979 4.794672 3.338181       6.726213 
1 1 1 0   6  27 o 163.7339 3.272505 327.0417       13.05735 320.8231       18.15203 333.7097       18.79660 162.0102 4.602428 165.2265 4.673045 -3.216309      6.558940 
1 1 1 0   6  28 o 55.01869 3.438119 37.08432       4.586603 31.90567       6.078910 43.92909       6.988707 50.84888 4.969129 59.75783 4.840572 -8.908943      6.937102 
1 1 1 0   6  29 o 241.8577 4.799906 715.2188       28.28972 733.5923       50.74512 706.9335       34.07636 243.8795 8.551762 240.2563 5.820260 3.623215       10.34447 
1 1 1 0   6  30 o 203.2878 4.194437 505.0813       20.77883 512.0339       34.80857 501.2321       25.89967 204.0049 7.012222 202.2673 5.258973 1.737579       8.765162 
1 1 1 0   6  31 f 228.7809 3.983433 639.7787       22.20819 638.9642       31.25109 640.6098       31.56553 228.2762 5.617826 228.5572 5.667376 -0.2809906     7.979920 
1 1 1 0   6  32 o 115.8785 3.081587 164.0835       8.694163 166.3365       12.09211 161.6723       12.50930 116.5189 4.265829 114.8391 4.478583 1.679825       6.185063 
1 1 1 0   6  33 o 225.8483 3.986331 624.0816       21.93947 630.0425       30.97736 618.0822       31.07708 226.4640 5.613181 224.2080 5.692517 2.256027       7.994533 
1 1 1 0   6  34 o 121.4003 3.611687 180.4266       10.67291 174.2999       12.84274 194.1042       19.18883 119.1769 4.429820 125.3273 6.303229 -6.150368      7.704155 
1 1 1 0   6  35 o 137.3060 4.554838 231.5811       15.21938 231.5811       15.21938 0.000000       0.000000 137.3060 4.554838 ?        ?        0.000000       4.554838 
1 1 1 0   6  36 o 155.9156 3.398363 297.5661       12.91206 279.8618       17.51800 318.6256       19.10598 150.7966 4.773139 160.8754 4.879169 -10.07881      6.825624 
1 1 1 0   6  37 f 57.56502 3.811015 40.82245       5.315982 38.89786       7.167868 43.17502       7.924869 55.89123 5.327075 58.84737 5.593403 -2.956146      7.724240 
1 1 1 0   6  38 o 144.1632 3.351711 254.8708       11.77489 262.9275       16.61529 246.7422       16.68939 145.9071 4.679046 141.2672 4.855221 4.639816       6.742896 
1 1 1 0   6  39 o 43.91922 4.615939 24.11577       4.866515 25.39585       6.790617 22.76416       6.977783 44.57154 6.438313 41.95372 7.076641 2.617825       9.567169 
1 1 1 0   6  40 o 59.61323 3.842011 44.08064       5.551606 33.83131       7.402363 57.25654       8.392917 51.50604 6.010450 67.52859 5.138810 -16.02256      7.907773 
1 1 1 0   6  41 o 87.21281 3.310562 94.09074       7.023100 82.87608       9.464046 107.8356       10.47741 81.16479 4.806423 92.70687 4.652605 -11.54208      6.689427 
1 1 1 0   6  42 o 57.05935 3.738839 40.76438       5.170119 39.66620       6.964642 42.11239       7.716303 55.59468 5.201162 57.05834 5.622476 -1.463661      7.659264 
1 1 1 0   6  43 o 23.98885 6.510273 7.942443       3.902165 5.995397       5.090800 10.71599       6.075976 21.54386 7.685004 27.22257 8.358088 -5.678715      11.35416 
1 1 1 0   6  44 o 21.54114 6.803225 6.535794       3.994901 10.82773       5.233261 0.5419726      6.184399 27.04924 7.617218 17.26402 7.594635 9.785223       10.75642 
1 1 1 0   6  45 o 23.35759 7.097381 8.238342       4.396091 11.06297       5.269784 1.774440       7.971852 26.61551 7.692813 19.00049 8.476049 7.615019       11.44652 
1 1 1 0   6  46 o 17.33296 6.463194 4.182581       3.659353 7.934668       4.905109 -0.5266302     5.495236 22.01510 7.565790 14.88660 6.799405 7.128502       10.17217 
1 1 1 0   6  47 o 25.77753 6.317390 10.47850       3.936944 13.97859       5.474547 6.729664       5.665733 28.21046 7.733962 19.82525 7.867312 8.385208       11.03217 
1 1 1 0   6  48 o 11.99059 5.468441 -0.3347773     3.537245 -5.184158      4.868430 5.087800       5.148119 11.22888 5.475578 17.56799 7.299822 -6.339107      9.125205 
1 1 1 0   6  49 o 13.87620 6.609550 -0.5263427     6.161431 0.000000       0.000000 -0.5263427     6.161431 ?        ?        13.87620 6.609550 0.000000       6.609550 
1 1 1 0   6  50 o 14.61576 6.099955 3.586053       3.617848 2.764775       5.213786 4.348718       5.024293 14.39688 6.593543 15.38968 6.804513 -0.9928007     9.475030 
1 1 1 0   6  51 o 28.82044 6.334522 15.61507       4.327306 12.70107       6.067438 18.63174       6.173408 20.55161 8.145958 26.39964 8.470880 -5.848032      11.75212 
1 1 1 0   7  1  f 549.8174 9.214540 3688.819       123.4606 3458.545       204.4942 3820.894       154.8708 531.3831 15.80958 559.3581 11.36171 -27.97498      19.46872 
1 1 1 0   7  2  o 91.29480 2.295751 101.6280       5.103431 107.1171       7.362514 96.55146       7.080432 93.69759 3.229321 88.94908 3.272073 4.748505       4.597280 
1 1 1 0   7  3  o 326.4953 4.034887 1299.242       32.10291 1288.116       45.14606 1310.622       45.65902 325.0459 5.699532 327.8726 5.714592 -2.826752      8.071012 
1 1 1 0   7  4  o 668.6041 9.612838 5456.558       156.6234 5506.121       314.7668 5440.249       180.5635 669.5530 19.31176 667.4058 11.10207 2.147278       22.27555 
1 1 1 0   7  5  o 332.0479 4.488637 1343.967       36.32046 1336.113       57.23551 1349.263       46.99501 330.9727 7.096387 332.6551 5.797241 -1.682404      9.163335 
1 1 1 0   7  6  o 342.3275 5.160494 1428.740       43.04960 1424.361       60.80714 1433.139       60.95579 341.6986 7.302561 342.7502 7.297954 -1.051544      10.32412 
1 1 1 0   7  7  o 219.4546 3.598710 587.0031       19.24543 568.2699       26.79256 606.9725       27.66258 215.8883 5.092710 223.1190 5.087682 -7.230728      7.198625 
1 1 1 0   7  8  o 155.1830 2.867149 293.4957       10.84253 289.3430       15.27610 297.7115       15.39185 154.0081 4.073938 156.2222 4.046484 -2.214081      5.742039 
1 1 1 0   7  9  o 39.44455 2.358572 19.02876       2.256754 22.23459       3.324143 16.28793       3.073623 42.58864 3.226962 36.38576 3.509948 6.202881       4.767916 
1 1 1 0   7  10 o 224.6157 5.199347 615.3232       28.45935 615.3232       28.45935 0.000000       0.000000 224.6157 5.199347 ?        ?        0.000000       5.199347 
1 1 1 0   7  11 o 313.4816 5.568340 1198.641       42.53770 1152.875       50.59757 1308.958       78.55654 307.3623 6.755275 327.0735 9.867290 -19.71115      11.95814 
1 1 1 0   7  12 o 152.9529 2.886577 285.1213       10.75913 277.5949       15.04906 292.9905       15.38801 150.8461 4.097714 154.9766 4.078101 -4.130447      5.781191 
1 1 1 0   7  13 o 175.2084 3.137006 374.1287       13.39388 370.1708       18.83794 378.1750       19.04741 174.2015 4.441193 176.0760 4.442697 -1.874451      6.281858 
1 1 1 0   7  14 o 586.7416 8.502460 4200.837       121.5703 4129.434       169.8306 4275.877       174.1018 581.3137 11.98862 591.5187 12.07810 -10.20502      17.01786 
1 1 1 0   7  15 o 147.6107 2.885850 265.5249       10.38072 258.2156       14.47129 273.2727       14.89918 145.4968 4.085524 149.6820 4.088496 -4.185165      5.779906 
1 1 1 0   7  16 f 645.5906 10.78396 5088.210       169.6569 4794.034       283.0306 5253.193       211.9579 625.1809 18.59836 655.6468 13.26611 -30.46588      22.84488 
1 1 1 0   7  17 o 282.3352 4.447608 971.5948       30.60044 1024.290       44.69324 925.0930       41.98475 289.8395 6.327733 275.4497 6.254795 14.38980       8.897340 
1 1 1 0   7  18 o 296.1866 5.305938 1069.465       38.29691 1079.221       65.83035 1064.474       47.08444 297.2434 9.098911 295.4542 6.539600 1.789276       11.20520 
1 1 1 0   7  19 o 231.6415 3.859838 653.9938       21.78821 626.5944       30.06463 684.3025       31.62058 226.7026 5.442061 236.9111 5.477070 -10.20859      7.721032 
1 1 1 0   7  20 o 433.4004 7.471095 2291.709       78.90592 2232.250       135.2906 2322.361       97.13831 426.9708 13.01790 436.1460 9.139503 -9.175171      15.90585 
1 1 1 0   7  21 o 409.0230 6.125072 2040.605       61.05132 2000.921       85.21983 2082.445       87.50473 404.8158 8.638675 412.9745 8.695051 -8.158752      12.25686 
1 1 1 0   7  22 o 116.2601 2.864244 164.7370       8.114779 158.1915       11.16683 172.0613       11.81242 113.8398 4.031681 118.7286 4.088801 -4.888832      5.742190 
1 1 1 0   7  23 o 92.08388 3.223643 103.4923       7.222643 97.21777       8.803248 116.4144       12.63329 89.19894 4.060576 97.53832 5.335338 -8.339386      6.704783 
1 1 1 0   7  24 o 127.5549 3.454101 198.5286       10.72675 192.0317       12.74940 214.2719       19.84652 125.4065 4.177728 132.3196 6.171947 -6.913124      7.452942 
1 1 1 0   7  25 o 273.9256 4.425674 915.6135       29.54257 893.3440       41.12590 939.3573       42.46529 270.3768 6.241800 277.2468 6.285378 -6.869995      8.858107 
1 1 1 0   7  26 o 111.2395 2.955274 151.0059       8.004017 148.4805       11.07772 153.7643       11.57760 110.2231 4.131528 112.1607 4.243515 -1.937546      5.922580 
1 1 1 0   7  27 o 65.73611 3.136285 52.83245       5.009578 52.02596       6.762354 53.81336       7.457819 65.13395 4.284227 66.21087 4.651778 -1.076920      6.324052 
1 1 1 0   7  28 o 230.2275 3.965656 647.2331       22.24889 653.5009       31.55591 641.0374       31.37424 231.0907 5.603535 228.8726 5.625270 2.218109       7.939980 
1 1 1 0   7  29 o 51.99074 4.638793 33.30577       5.815488 40.83107       12.03456 31.01316       6.642534 56.86530 8.982465 50.02980 5.541186 6.835499       10.55412 
1 1 1 0   7  30 o 218.3431 4.380557 582.9014       23.30800 545.8536       37.54780 606.1270       29.72943 210.5103 7.330581 222.4316 5.484714 -11.92133      9.155299 
1 1 1 0   7  31 o 166.5410 3.361337 338.7361       13.64173 331.8097       18.97646 346.1436       19.62449 164.5736 4.736646 168.0822 4.796063 -3.508545      6.740774 
1 1 1 0   7  32 o 147.3254 3.246630 265.1208       11.65592 259.9772       16.07903 270.8173       16.92110 145.6474 4.535769 148.6285 4.677691 -2.981155      6.515673 
1 1 1 0   7  33 o 71.48470 3.367054 62.59069       5.848938 58.69654       7.872158 67.38952       8.738861 69.04376 4.706934 73.97530 4.874828 -4.931541      6.776370 
1 1 1 0   7  34 o 142.0510 3.713740 247.0599       12.84456 242.9419       15.50086 256.0831       22.94540 140.6959 4.526930 143.8922 6.560947 -3.196304      7.971143 
1 1 1 0   7  35 o 100.7366 4.376101 124.7051       10.71700 124.7051       10.71700 0.000000       0.000000 100.7366 4.376101 ?        ?        0.000000       4.376101 
1 1 1 0   7  36 o 114.7869 3.225085 161.3589       9.012368 162.0634       12.40182 160.5706       13.11924 114.7778 4.442345 114.1757 4.725402 0.6021347      6.485665 
1 1 1 0   7  37 o 66.51572 3.654694 54.41463       5.901186 55.27650       7.996463 53.38391       8.744719 66.78592 4.948497 65.48876 5.531194 1.297157       7.421707 
1 1 1 0   7  38 o 56.08390 3.830764 38.83734       5.204085 33.51799       6.856246 46.06731       7.993279 51.69929 5.527774 60.71600 5.460664 -9.016708      7.770144 
1 1 1 0   7  39 o 84.47257 3.331754 87.81252       6.844979 81.54230       9.247724 95.41035       10.17979 80.99552 4.705565 87.60371 4.786669 -6.608185      6.712269 
1 1 1 0   7  40 o 96.61842 4.793973 116.6349       11.25209 0.000000       0.000000 116.6349       11.25209 ?        ?        96.61842 4.793973 0.000000       4.793973 
1 1 1 0   7  41 o 16.02413 6.403257 1.886522       3.778863 2.857278       4.939010 0.5159280      5.868664 18.55100 7.350629 17.72596 7.598803 0.8250370      10.57230 
1 1 1 0   7  42 o 16.85328 6.462234 2.795267       3.718142 4.276955       4.826005 0.6312827      5.832253 19.69352 7.406014 17.53347 7.546583 2.160044       10.57355 
1 1 1 0   7  43 o 27.93891 6.000235 10.63952       3.963215 10.41368       5.213266 10.94876       6.100361 26.97342 7.605026 27.38868 8.368380 -0.4152641     11.30779 
1 1 1 0   7  44 o 15.44502 6.482681 1.444294       4.121211 -0.9564390E-01 4.814310 5.667457       7.972625 15.09387 6.667851 22.10297 9.124966 -7.009103      11.30156 
1 1 1 0   7  45 o 24.99997 6.954681 9.475528       4.390907 11.16061       5.318328 5.867515       7.782126 26.56520 7.742844 21.25919 8.914672 5.306009       11.80775 
1 1 1 0   7  46 o 17.46649 6.553049 4.318684       3.773600 5.712207       4.970483 2.422588       5.797910 19.36011 7.459239 16.95226 7.408287 2.407848       10.51299 
1 1 1 0   7  47 o 9.464001 4.607944 -4.594354      3.411330 -1.500549      4.712810 -7.999419      4.944201 13.01174 6.066827 10.56247 5.222470 2.449268       8.005035 
1 1 1 0   7  48 o 12.31616 5.670933 -0.4959764     3.928316 2.438240       4.909691 -5.716518      6.548862 15.24419 6.733948 12.76861 6.252878 2.475581       9.189371 
1 1 1 0   7  49 o 16.03734 7.024504 4.348757       5.239056 0.000000       0.000000 4.348757       5.239056 ?        ?        16.03734 7.024504 0.000000       7.024504 
1 1 1 0   7  50 o 18.95834 6.785062 7.535011       3.971637 7.483177       5.648670 7.585689       5.585352 17.47795 7.472892 17.59048 7.472948 -0.1125240     10.56831 
1 1 1 0   8  0  o 338.8008 7.244007 1399.324       59.80801 1313.082       81.20398 1501.570       88.41839 327.9553 10.17307 350.7139 10.35690 -22.75854      14.51746 
1 1 1 0   8  1  o 661.4608 9.527939 5340.623       153.5816 5384.983       218.7280 5297.483       215.6980 663.5998 13.52577 658.2000 13.44783 5.399841       19.07330 
1 1 1 0   8  2  o 548.3842 9.194955 3670.440       122.8770 0.000000       0.000000 3670.440       122.8770 ?        ?        548.3842 9.194955 0.000000       9.194955 
1 1 1 0   8  3  o 814.0609 11.65892 8097.731       231.2870 8710.586       486.2539 7918.535       262.9355 840.1960 23.77296 804.6320 13.40960 35.56409       27.29415 
1 1 1 0   8  4  o 203.1128 3.417833 502.7989       16.91703 496.9220       23.80995 508.7900       24.04030 201.8957 4.839443 204.2926 4.828932 -2.396942      6.836578 
1 1 1 0   8  5  o 172.6603 2.742952 363.3046       11.54109 357.1719       18.21896 367.4148       14.91538 171.1168 4.372711 173.6239 3.525242 -2.507034      5.616755 
1 1 1 0   8  6  o 252.7412 3.585951 778.5916       22.08597 817.4869       36.06113 755.2439       27.93917 258.9077 5.715552 248.8947 4.606401 10.01306       7.340741 
1 1 1 0   8  7  o 607.0229 8.777987 4500.470       129.8483 4328.858       178.8283 4691.851       188.8474 594.6419 12.34084 619.0293 12.51883 -24.38739      17.57889 
1 1 1 0   8  8  o 37.29321 2.579407 17.03076       2.329709 19.28116       3.479312 15.20177       3.136675 39.60376 3.646024 35.11731 3.721917 4.486454       5.210197 
1 1 1 0   8  9  o 547.6236 11.28431 3670.465       150.5890 3670.465       150.5890 0.000000       0.000000 547.6236 11.28431 ?        ?        0.000000       11.28431 
1 1 1 0   8  10 o 597.4013 10.01171 4363.326       145.7507 4465.122       181.1373 4176.381       245.4709 603.8044 12.31049 582.2449 17.31973 21.55951       21.24903 
1 1 1 0   8  11 o 761.6502 10.94105 7094.003       203.0724 7152.975       288.8925 7036.403       285.5127 763.4097 15.52897 757.1831 15.47349 6.226563       21.92209 
1 1 1 0   8  12 o 395.1592 5.886165 1904.298       56.68140 1837.988       78.35915 1977.073       82.09017 388.0497 8.286408 402.4571 8.370193 -14.40744      11.77814 
1 1 1 0   8  13 o 867.1107 12.41453 9191.294       262.3258 9279.466       373.2927 9105.269       368.7190 869.8223 17.61095 861.6355 17.56046 8.186829       24.86997 
1 1 1 0   8  14 o 83.94718 2.987363 85.98811       6.101510 88.73209       11.98665 85.02847       7.088585 85.11275 5.814104 83.45472 3.493285 1.658035       6.782835 
1 1 1 0   8  15 o 292.0747 4.553810 1039.788       32.41193 1087.380       47.11696 997.0364       44.65671 298.6311 6.474498 285.9584 6.408371 12.67267       9.109684 
1 1 1 0   8  16 o 70.32569 3.176544 60.39381       5.429781 46.04432       10.55484 65.55798       6.331889 61.01973 7.239036 73.25755 3.557502 -12.23783      8.065945 
1 1 1 0   8  17 o 207.7282 4.050174 525.9261       20.50243 535.1858       34.88159 521.0385       25.34209 209.3802 6.845556 206.7442 5.030058 2.635971       8.494887 
1 1 1 0   8  18 o 188.0674 3.361970 431.0521       15.40790 425.0118       21.64734 437.2544       21.93565 186.6635 4.762816 189.3348 4.758040 -2.671310      6.732263 
1 1 1 0   8  19 o 310.5771 5.625898 1176.106       42.57919 1185.658       75.24272 1171.605       51.64370 311.4506 9.926455 309.9310 6.837796 1.519592       12.05363 
1 1 1 0   8  20 o 285.7614 4.531138 995.4965       31.55345 981.0991       44.28897 1010.337       44.96535 283.6134 6.408152 287.8083 6.411190 -4.194855      9.064643 
1 1 1 0   8  21 o 304.9666 4.777186 1134.000       35.50263 1129.428       50.07500 1138.621       50.34267 304.2455 6.753996 305.4806 6.762645 -1.235107      9.557710 
1 1 1 0   8  22 o 101.0174 3.145437 124.5043       7.733636 116.2025       9.425496 141.6077       13.52876 97.54688 3.973422 107.6260 5.173428 -10.07914      6.523223 
1 1 1 0   8  23 o 343.6184 5.283181 1440.679       44.23928 1434.937       62.33627 1446.505       62.79381 342.6942 7.464454 344.0696 7.489182 -1.375458      10.57383 
1 1 1 0   8  24 o 14.56923 5.982734 0.8033462      3.403234 -0.6914717     3.772687 7.333693       7.885418 13.81757 6.008098 26.64203 9.557495 -12.82446      11.28906 
1 1 1 0   8  25 o 214.8182 3.742369 562.9214       19.59088 572.8604       27.89496 553.2478       27.52020 216.5826 5.285258 212.8409 5.305918 3.741699       7.489107 
1 1 1 0   8  26 o 52.34526 3.293135 33.55492       4.179425 35.20822       5.621457 31.51155       6.249503 53.52760 4.346961 50.52637 5.147453 3.001225       6.737384 
1 1 1 0   8  27 o 96.91338 2.900491 114.6608       6.842305 114.7383       9.499184 114.5772       9.864090 96.85879 4.033319 96.77612 4.192608 0.8267212E-01  5.817699 
1 1 1 0   8  28 o 191.5141 3.556008 447.7036       16.59585 427.0689       22.82996 470.8264       24.16724 186.8150 5.019391 196.1520 5.060124 -9.336945      7.127351 
1 1 1 0   8  29 o 117.1780 4.323547 168.0338       12.32472 0.000000       0.000000 168.0338       12.32472 ?        ?        117.1780 4.323547 0.000000       4.323547 
1 1 1 0   8  30 o 79.03947 3.053933 76.36604       5.871130 81.43292       8.117459 70.80779       8.501943 81.52079 4.099318 75.94134 4.615935 5.579453       6.173432 
1 1 1 0   8  31 o 245.9511 4.168492 739.8218       24.98411 724.8655       34.80973 755.7123       35.88031 243.0045 5.878280 248.1036 5.934539 -5.099060      8.353020 
1 1 1 0   8  32 f 94.21060 3.085156 108.5120       7.073380 114.2123       9.832272 102.3972       10.18351 96.52048 4.190195 91.32420 4.590610 5.196281       6.215418 
1 1 1 0   8  33 f 149.4645 3.293059 273.0152       11.99427 266.1900       16.50220 280.6587       17.46350 147.3034 4.602845 151.2256 4.744687 -3.922211      6.610464 
1 1 1 0   8  34 o 65.75412 3.834182 53.10091       6.117072 58.57034       7.440396 41.69358       10.74527 68.97755 4.450162 57.43609 7.884979 11.54147       9.054106 
1 1 1 0   8  35 o 13.22373 5.873215 -1.337833      3.784792 0.9938694      4.807653 -5.138183      6.137739 17.04925 7.066667 15.09033 6.997612 1.958924       9.945066 
1 1 1 0   8  36 o 123.5132 4.465947 187.6960       13.41985 187.6960       13.41985 0.000000       0.000000 123.5132 4.465947 ?        ?        0.000000       4.465947 
1 1 1 0   8  37 o 25.34406 6.709380 8.289858       4.208182 3.308985       5.387519 16.08421       6.739473 19.97120 7.746643 35.09297 8.051990 -15.12177      11.17341 
1 1 1 0   8  38 f 133.7135 3.288785 219.3366       10.71635 217.3118       14.73469 221.6103       15.61391 132.6032 4.566671 133.8129 4.796018 -1.209686      6.622406 
1 1 1 0   8  39 o 86.73551 3.295965 92.59891       6.953840 94.09911       9.788220 91.07017       9.880863 87.01125 4.632982 85.54945 4.758347 1.461807       6.641264 
1 1 1 0   8  40 o 20.50010 7.685544 4.354393       5.188598 5.443281       10.65399 4.015833       5.940712 26.07875 10.63272 20.90098 8.127022 5.177773       13.38295 
1 1 1 0   8  41 o 24.59282 6.730567 8.096878       4.150280 6.048547       5.425190 10.98699       6.444251 22.33499 7.936955 28.29975 8.591897 -5.964760      11.69683 
1 1 1 0   8  42 o 20.01978 6.695709 5.147490       3.839767 8.827373       4.964668 -0.3305882     6.057415 25.27529 7.511637 17.09598 7.518645 8.179304       10.62802 
1 1 1 0   8  43 f 16.77714 6.658604 2.608872       4.059051 3.967018       4.720122 -1.246743      7.952923 18.89816 7.272162 18.39255 8.313277 0.5056095      11.04513 
1 1 1 0   8  44 o 25.55196 6.365344 9.334735       3.948737 10.60125       5.355410 7.825844       5.845424 26.43946 7.787363 23.06380 8.234062 3.375662       11.33326 
1 1 1 0   8  45 o 16.59631 6.412917 3.345647       3.681534 7.294026       4.926714 -1.646985      5.540038 21.74410 7.576935 14.60058 6.727033 7.143519       10.13227 
1 1 1 0   8  46 o 31.60909 5.650461 14.60374       4.192667 12.95609       5.495691 16.89800       6.485023 27.47533 7.829312 30.85066 8.401156 -3.375326      11.48380 
1 1 1 0   8  47 o 21.98065 6.963829 8.253682       4.182798 7.514164       5.086846 9.797613       7.350017 20.47299 7.622954 21.74853 8.844814 -1.275541      11.67648 
1 1 1 0   8  48 o 14.33851 6.204238 2.180743       3.983071 12.54844       6.695288 -3.498482      4.955332 23.16966 8.721054 11.88918 5.732089 11.28049       10.43617 
1 1 1 0   8  49 o 10.39504 5.079873 -4.267144      4.255430 -8.621956      8.641314 -2.872963      4.889389 12.91577 6.468039 11.67822 5.645965 1.237551       8.585595 
1 1 1 0   8  50 o 14.41406 6.184843 3.464460       3.894589 7.773489       5.744928 -0.1998854     5.297769 17.51995 7.514525 12.77891 6.098543 4.741035       9.677826 
1 1 1 0   9  1  o 54.04168 3.500289 35.74422       4.584862 0.000000       0.000000 35.74422       4.584862 ?        ?        54.04168 3.500289 0.000000       3.500289 
1 1 1 0   9  2  o 336.4952 4.565898 1380.334       37.44047 1344.781       58.16150 1405.493       48.92578 332.0089 7.188691 339.4896 5.913917 -7.480652      9.308689 
1 1 1 0   9  3  o 142.3158 2.784532 246.8302       9.656982 276.5482       14.32685 222.0857       13.07316 150.5746 3.907780 134.9214 3.980510 15.65321       5.578101 
1 1 1 0   9  4  o 543.3188 6.442842 3600.875       85.30379 3509.986       118.5362 3698.509       122.8553 536.1194 9.073049 550.3167 9.161046 -14.19727      12.89360 
1 1 1 0   9  5  o 510.6371 6.664280 3181.341       82.92809 3156.362       130.3464 3198.327       107.4876 508.1222 10.52676 511.7690 8.618829 -3.646790      13.60503 
1 1 1 0   9  6  f 205.9052 3.443782 516.7841       17.27982 519.9246       24.71646 513.7814       24.16749 206.4885 4.911954 205.2677 4.831421 1.220871       6.889842 
1 1 1 0   9  7  o 475.4221 9.877442 2763.252       114.4353 2763.252       114.4353 0.000000       0.000000 475.4221 9.877442 ?        ?        0.000000       9.877442 
1 1 1 0   9  8  o 54.66766 3.602642 36.58830       4.772656 36.58830       4.772656 0.000000       0.000000 54.66766 3.602642 ?        ?        0.000000       3.602642 
1 1 1 0   9  9  f 121.2445 3.116156 179.2911       9.199353 186.8820       11.22316 163.7483       16.05954 123.7607 3.725556 115.7232 5.712431 8.037529       6.819944 
1 1 1 0   9  10 o 220.6172 3.654988 593.2793       19.64994 588.6605       27.77962 597.9046       27.79882 219.7119 5.188438 221.4316 5.151702 -1.719696      7.311629 
1 1 1 0   9  11 o 251.8638 4.032417 773.2488       24.74955 749.7246       34.45574 798.3239       35.57330 247.9512 5.702422 255.8613 5.705365 -7.910141      8.066524 
1 1 1 0   9  12 o 789.1653 11.31961 7609.338       217.6885 7396.042       302.0053 7840.010       314.0648 776.9662 15.95057 799.9016 16.11189 -22.93542      22.67188 
1 1 1 0   9  13 o 820.2209 13.59806 8225.523       271.7965 8234.663       333.0687 8207.306       470.2369 819.9683 16.66866 816.1376 23.66880 3.830750       28.94920 
1 1 1 0   9  14 o 135.6081 3.128640 224.1040       10.33898 200.8688       16.46261 239.2373       13.28591 128.2578 5.278468 140.0515 3.896636 -11.79366      6.560945 
1 1 1 0   9  15 o 497.7802 7.288166 3021.792       88.40807 3000.585       124.4940 3043.366       125.5687 495.8121 10.30375 499.3328 10.31942 -3.520630      14.58278 
1 1 1 0   9  16 o 201.0552 4.901923 492.7399       24.01695 0.000000       0.000000 492.7399       24.01695 ?        ?        201.0552 4.901923 0.000000       4.901923 
1 1 1 0   9  17 o 160.0617 3.084880 312.2187       12.03267 316.5237       17.24563 308.1348       16.79676 161.0866 4.397339 158.9383 4.340779 2.148315       6.178913 
1 1 1 0   9  18 o 216.6698 4.326133 572.2309       22.84201 523.8282       39.12998 597.2502       28.13279 207.0693 7.768345 221.3363 5.215837 -14.26695      9.356930 
1 1 1 0   9  19 o 627.4639 9.087280 4806.488       138.9501 4769.731       195.5391 4843.980       197.4855 624.4545 12.84981 629.2907 12.87798 -4.836243      18.19231 
1 1 1 0   9  20 o 221.7107 3.774513 599.1705       20.39312 629.5269       29.61234 571.7861       28.12552 227.2126 5.348157 216.5425 5.329927 10.67007       7.550557 
1 1 1 0   9  21 o 347.9165 5.333076 1476.301       45.21566 1487.705       64.13566 1465.031       63.75524 349.0900 7.539214 346.4182 7.552296 2.671753       10.67131 
1 1 1 0   9  22 o 188.8032 3.902472 434.6223       17.95499 424.3598       21.92492 455.5194       31.28638 186.4658 4.829124 193.0527 6.660308 -6.586899      8.226794 
1 1 1 0   9  23 o 212.0297 3.681981 548.1888       19.02454 529.9932       26.37638 567.9192       27.46624 208.4026 5.193689 215.7284 5.224634 -7.325790      7.366899 
1 1 1 0   9  24 o 71.91342 3.445858 63.21020       6.021128 61.61490       6.984913 67.82415       11.87890 70.95436 4.056573 74.19833 6.639813 -3.243965      7.780932 
1 1 1 0   9  25 o 90.21893 2.832561 99.34444       6.219774 93.94620       8.394656 105.9147       9.261232 87.65883 3.939876 93.07408 4.093241 -5.415253      5.681306 
1 1 1 0   9  26 o 245.0885 4.101753 733.2731       24.49788 759.1848       35.28313 709.1541       34.04074 249.1465 5.811339 240.7987 5.801078 8.347748       8.211222 
1 1 1 0   9  27 o 264.3285 4.338425 853.4222       27.94552 825.3451       38.75297 883.8408       40.33646 259.6270 6.125182 268.6622 6.161055 -9.035187      8.687718 
1 1 1 0   9  28 o 74.65128 3.225461 68.13314       5.853818 64.56383       8.793051 70.97422       7.844937 72.48724 5.008647 76.10201 4.247011 -3.614777      6.566860 
1 1 1 0   9  29 o 214.9175 4.510591 564.7479       23.62334 551.8231       42.37884 570.5746       28.45424 211.4360 8.240746 215.7918 5.415257 -4.355865      9.860776 
1 1 1 0   9  30 o 92.41141 3.002487 104.3470       6.752522 109.6490       9.336232 98.53122       9.778100 94.62467 4.058279 89.63753 4.490698 4.987144       6.052768 
1 1 1 0   9  31 o 235.1825 4.054576 676.4083       23.23735 695.0226       33.22457 658.5837       32.51216 237.9628 5.729466 231.6319 5.759852 6.330963       8.124204 
1 1 1 0   9  32 o 126.7276 3.119788 196.1624       9.634569 195.5826       13.31954 196.7988       13.95321 126.3230 4.333256 126.6817 4.527132 -0.3586731     6.266740 
1 1 1 0   9  33 o 29.62615 6.006067 11.18652       4.187516 9.915757       4.911849 14.56738       8.011738 27.80539 7.194582 33.65952 9.405619 -5.854136      11.84178 
1 1 1 0   9  34 o 48.40440 3.987911 28.88757       4.662301 24.46944       6.012810 35.54903       7.383169 44.22413 5.712654 53.42630 5.761910 -9.202175      8.113817 
1 1 1 0   9  35 o 141.3294 3.281132 244.3651       11.30036 242.3332       15.55528 246.6357       16.44396 140.4051 4.552325 141.5857 4.772787 -1.180588      6.595693 
1 1 1 0   9  36 o 28.35458 6.904995 10.39149       4.726052 8.998386       5.285115 15.95100       10.55797 26.54372 7.713468 35.24353 11.05028 -8.699814      13.47614 
1 1 1 0   9  37 o 90.53448 3.679374 100.7609       8.100621 97.85016       9.705563 107.4446       14.70700 89.02266 4.488358 92.62130 6.558352 -3.598640      7.947159 
1 1 1 0   9  38 o 32.73954 5.591455 13.68207       4.300961 15.20826       5.667342 11.60932       6.604630 34.18624 7.037522 29.76592 8.614814 4.420315       11.12393 
1 1 1 0   9  39 o 57.06387 4.140743 40.46475       5.718879 40.22553       8.375197 40.67373       7.827941 56.21994 6.216942 56.71002 5.743474 -0.4900818     8.463916 
1 1 1 0   9  40 o 20.04359 7.713055 3.841918       5.309868 -5.086563      10.62042 6.817568       6.131176 20.50409 9.398005 23.80127 8.439625 -3.297174      12.63130 
1 1 1 0   9  41 o 46.83392 4.277417 27.66981       4.827947 25.64668       6.308356 30.53020       7.500968 44.36280 5.988035 48.16512 6.561116 -3.802319      8.882837 
1 1 1 0   9  42 o 35.57955 5.084012 16.49008       4.282833 15.74072       5.554111 17.58921       6.726595 33.84607 6.966311 35.23285 8.015737 -1.386780      10.61986 
1 1 1 0   9  43 o 23.10862 7.015389 7.534357       4.296429 5.436699       4.947436 13.96880       8.664995 20.59214 7.544229 29.65317 10.05887 -9.061031      12.57363 
1 1 1 0   9  44 f 17.58225 6.652516 3.770372       3.907391 1.611235       4.906911 7.512119       6.459596 16.38746 6.984597 22.68545 8.560192 -6.297989      11.04814 
1 1 1 0   9  45 o 26.18945 6.620419 10.39142       4.226727 16.62677       5.724057 2.914992       6.267879 32.63086 7.372802 18.04269 7.794904 14.58817       10.72934 
1 1 1 0   9  46 o 26.38162 6.875759 11.22250       4.464537 9.243787       5.304918 16.02633       8.265738 22.92674 7.868471 27.36748 9.789083 -4.440737      12.55942 
1 1 1 0   9  47 o 11.11985 5.192720 -1.642240      3.474176 -2.188985      4.677422 -0.9694320     5.188715 12.46898 5.885993 13.68153 6.374668 -1.212553      8.676480 
1 1 1 0   9  48 o 15.73427 6.531960 3.736161       4.116746 1.721994       6.722523 4.944715       5.207362 15.53234 7.243324 17.01534 7.221617 -1.483004      10.22827 
1 1 1 0   9  49 o 15.63597 6.323610 4.301142       3.732951 6.234519       5.452138 2.595001       5.121721 17.12176 7.331658 14.55669 6.615952 2.565063       9.875425 
1 1 1 0   9  50 o 17.16080 6.679100 6.286828       4.015479 7.720999       6.006418 5.127870       5.399442 17.18692 7.524872 15.62369 6.972286 1.563229       10.25848 
1 1 1 0   10 0  o 384.8217 8.137607 1806.130       76.31192 1972.047       114.1197 1671.930       102.6344 401.7336 11.66935 369.9011 11.39961 31.83249       16.31333 
1 1 1 0   10 1  o 121.9062 2.636296 181.1120       7.831696 182.7004       11.07429 179.5229       11.07709 122.3706 3.717978 121.2993 3.751921 1.071304       5.282071 
1 1 1 0   10 2  o 242.3313 3.930526 715.8663       23.21113 774.0950       34.34826 666.9289       31.48882 251.9327 5.594793 233.8473 5.525707 18.08542       7.863533 
1 1 1 0   10 3  o 478.3456 8.113718 2793.868       94.57967 2991.351       171.5089 2707.569       113.3772 493.6728 14.27143 470.6598 9.885131 23.01297       17.36057 
1 1 1 0   10 4  o 355.1261 6.205400 1538.587       53.70175 1622.357       96.45857 1500.960       64.64709 364.0259 10.88581 350.6487 7.565552 13.37720       13.25663 
1 1 1 0   10 5  o 715.3664 10.30954 6258.020       179.7231 6464.646       260.1414 6069.342       248.5859 725.7223 14.70967 703.2550 14.50533 22.46729       20.65862 
1 1 1 0   10 6  o 332.0232 5.834468 1344.802       47.20693 1240.362       77.39739 1406.671       59.57042 318.3506 9.989007 339.4695 7.201015 -21.11890      12.31401 
1 1 1 0   10 7  o 361.0534 6.276218 1590.485       55.22116 1575.913       67.42024 1620.187       96.25288 359.2742 7.700664 363.7629 10.87043 -4.488647      13.32166 
1 1 1 0   10 8  o 222.9850 3.697295 606.1050       20.09074 633.9688       29.18690 581.0137       27.69681 228.0021 5.253070 218.2737 5.207057 9.728409       7.396498 
1 1 1 0   10 9  o 262.0374 4.169160 837.0515       26.62244 857.9615       38.30389 817.5110       37.02815 265.2217 5.926491 258.8966 5.869075 6.325165       8.340823 
1 1 1 0   10 10 o 424.0166 6.283530 2192.807       64.92660 2192.779       91.95123 2192.834       91.68949 423.8033 8.903423 423.8110 8.877919 -0.7690430E-02 12.57332 
1 1 1 0   10 11 f 320.2958 4.914829 1250.642       38.36152 1246.067       54.24534 1255.219       54.25741 319.6263 6.964403 320.7990 6.940488 -1.172699      9.832257 
1 1 1 0   10 12 o 658.0548 9.492179 5285.167       152.2173 5539.529       222.2954 5060.609       208.8672 673.1185 13.55199 643.4005 13.32149 29.71796       19.00311 
1 1 1 0   10 13 o 1008.939 14.40653 12446.87       354.2098 12838.34       511.7948 12086.96       490.7258 1022.836 20.53306 992.5368 20.28879 30.29956       28.86592 
1 1 1 0   10 14 o 542.5898 7.909580 3590.844       104.5830 3549.560       146.6305 3633.592       149.2087 539.1870 11.15960 545.5256 11.22388 -6.338562      15.82757 
1 1 1 0   10 15 o 266.8265 5.999086 868.0206       39.00768 0.000000       0.000000 868.0206       39.00768 ?        ?        266.8265 5.999086 0.000000       5.999086 
1 1 1 0   10 16 o 318.6650 6.941808 1238.389       53.90674 0.000000       0.000000 1238.389       53.90674 ?        ?        318.6650 6.941808 0.000000       6.941808 
1 1 1 0   10 17 o 278.4007 5.137862 944.8783       34.85691 942.8229       61.63054 945.8450       42.26646 277.7917 9.116522 278.5087 6.227606 -0.7169800     11.04056 
1 1 1 0   10 18 o 463.4560 6.842975 2619.848       77.28400 2576.373       108.1797 2665.166       110.4477 459.3565 9.664068 467.2014 9.701000 -7.844879      13.69320 
1 1 1 0   10 19 o 316.4389 4.912952 1220.832       37.88511 1252.579       54.46836 1191.080       52.72921 320.4258 6.975585 312.4635 6.924939 7.962372       9.829220 
1 1 1 0   10 20 o 243.4990 4.024730 722.7977       23.88197 724.8470       33.85014 720.7667       33.69878 243.7830 5.697979 243.0963 5.688525 0.6867065      8.051476 
1 1 1 0   10 21 o 284.3783 5.189128 986.3917       35.96061 997.9752       44.67334 965.0701       60.60928 285.9652 6.410606 280.8702 8.866285 5.095032       10.94106 
1 1 1 0   10 22 o 121.2057 2.874890 179.0732       8.491425 171.1034       11.72812 187.8541       12.31040 118.3836 4.071435 124.0493 4.077862 -5.665657      5.762425 
1 1 1 0   10 23 o 196.5483 3.513187 471.0677       16.82700 459.6210       23.50161 483.1085       24.10376 194.0061 4.975131 198.9667 4.971281 -4.960556      7.033176 
1 1 1 0   10 24 f 90.56477 3.302603 100.1560       7.276521 98.45760       8.524690 104.7157       13.96756 89.75288 3.906930 92.35292 6.243004 -2.600037      7.364727 
1 1 1 0   10 25 o 79.11770 2.858705 76.43148       5.502558 75.78876       7.610915 77.13536       7.964720 78.70540 3.981154 79.39091 4.131047 -0.6855087     5.737172 
1 1 1 0   10 26 o 33.07748 4.183760 13.57095       3.297057 12.34774       4.387959 15.15703       4.996591 31.25048 5.979728 34.68407 6.136096 -3.433592      8.567895 
1 1 1 0   10 27 o 186.8615 3.480720 426.1578       15.84985 415.8526       22.02825 437.2200       22.82302 184.3721 4.907213 189.0449 4.958464 -4.672745      6.976181 
1 1 1 0   10 28 o 261.2776 4.914242 834.9177       31.28923 812.4587       51.82689 847.7986       39.24930 256.7206 8.295235 263.0126 6.123774 -6.291992      10.31075 
1 1 1 0   10 29 o 58.08883 4.224751 41.46224       5.939517 49.46592       11.80655 38.75035       6.872485 62.89233 7.875716 56.03633 5.088198 6.856007       9.376389 
1 1 1 0   10 30 o 283.8094 4.622627 985.7160       31.97067 1013.097       45.91425 959.9451       44.54361 287.0911 6.562836 279.4668 6.540622 7.624329       9.265557 
1 1 1 0   10 31 o 85.34493 3.081826 89.06005       6.398945 93.74459       9.048492 84.37348       9.050457 87.42724 4.259932 82.89952 4.496881 4.527718       6.194268 
1 1 1 0   10 32 o 20.08420 6.641963 4.738324       3.780720 7.230743       4.469403 -1.532000      7.088984 24.02759 7.123703 18.64402 8.168552 5.383574       10.83847 
1 1 1 0   10 33 o 119.9356 3.088097 175.8790       9.018076 174.6198       12.38254 177.3011       13.15990 119.3173 4.265495 120.1861 4.501224 -0.8688049     6.201247 
1 1 1 0   10 34 o 61.10488 3.521399 45.83562       5.221363 48.50058       6.879565 42.21486       8.018936 62.71283 4.532192 58.26759 5.721149 4.445236       7.298789 
1 1 1 0   10 35 o 26.71326 6.264053 9.178192       4.006598 9.478113       5.053129 8.670396       6.575100 27.15498 7.424577 26.71489 8.755485 0.4400864      11.47967 
1 1 1 0   10 36 o 42.26381 5.162904 22.34599       5.207136 20.32004       5.841222 30.18716       11.49158 40.04279 6.185155 47.82353 10.17358 -7.780743      11.90621 
1 1 1 0   10 37 f 74.18820 3.329669 67.62016       6.004320 74.04872       8.309253 60.59535       8.686056 77.40302 4.423644 69.81438 5.141610 7.588638       6.782682 
1 1 1 0   10 38 o 99.52641 3.584095 121.9607       8.678492 125.3496       13.28441 119.4375       11.46261 100.2208 5.459986 98.08287 4.810399 2.137932       7.276770 
1 1 1 0   10 39 o 51.36378 3.980105 32.80610       4.942970 36.27851       6.625355 28.44684       7.423338 53.68630 5.126360 46.94483 6.677018 6.741470       8.417966 
1 1 1 0   10 40 o 28.13761 7.821994 10.70733       5.556513 1.353143       10.10410 14.76260       6.652808 22.97747 9.911727 32.82824 8.309864 -9.850769      12.93430 
1 1 1 0   10 41 o 41.06660 4.434582 21.42696       4.367603 18.85120       5.856946 24.65362       6.555335 37.56016 6.641853 43.17869 6.425504 -5.618530      9.241283 
1 1 1 0   10 42 o 22.38076 6.953356 6.836004       4.190587 10.16711       4.942550 -1.681671      7.903464 26.87986 7.340258 18.33867 8.288301 8.541197       11.07137 
1 1 1 0   10 43 o 16.60524 6.355693 3.000821       3.592223 2.288709       4.508752 4.238451       5.943987 16.82359 6.894879 19.93648 8.008867 -3.112886      10.56794 
1 1 1 0   10 44 o 12.68077 5.697414 -0.7932181     3.671961 -3.596514      4.614010 4.049040       6.064124 12.43674 5.863200 19.29129 7.960603 -6.854550      9.886775 
1 1 1 0   10 45 o 11.72173 5.410912 -1.638411      3.608770 -2.808214      4.517049 0.4257554      6.000268 12.43767 5.844206 16.06598 7.245073 -3.628310      9.308374 
1 1 1 0   10 46 o 19.48098 7.052442 6.141731       4.305196 8.441084       5.046566 -0.5256763E-02 8.251337 21.98279 7.668001 16.92675 7.936137 5.056034       11.03542 
1 1 1 0   10 47 o 24.67126 6.892478 10.46593       4.302827 4.141063       6.282521 16.05392       5.905222 17.34277 7.641004 29.19437 8.043826 -11.85160      11.09451 
1 1 1 0   10 48 o 17.65910 6.483107 5.531439       3.656548 1.572860       4.976695 10.17537       5.390314 14.35122 6.522191 21.71398 7.886992 -7.362760      10.23443 
1 1 1 0   10 49 o 13.54012 5.875686 2.326563       3.593309 -2.142727      5.077637 6.810208       5.085784 12.01669 5.795770 17.57725 7.275275 -5.560556      9.301643 
1 1 1 0   10 50 o 14.24528 6.403129 3.283713       4.643601 1.078035       8.760062 4.145707       5.476314 14.34181 7.064705 14.90843 6.801079 -0.5666246     9.806362 
1 1 1 0   11 1  o 286.4392 4.483214 1000.391       31.29378 1012.829       44.59954 988.3287       43.92045 288.1146 6.352272 284.6098 6.332582 3.504822       8.969557 
1 1 1 0   11 2  o 134.5198 3.203511 220.5633       10.50144 250.7112       18.93657 207.1741       12.61972 143.2685 5.433784 130.2998 3.979050 12.96873       6.734897 
1 1 1 0   11 3  o 82.05975 2.230373 82.12244       4.455956 80.12521       6.877615 83.56731       5.849770 81.00037 3.492500 82.75313 2.905310 -1.752754      4.542949 
1 1 1 0   11 4  f 300.7595 4.167438 1102.815       30.54391 1064.965       47.25951 1129.966       40.02704 295.4235 6.564596 304.3783 5.396395 -8.954773      8.497941 
1 1 1 0   11 5  o 296.9522 4.114276 1075.043       29.77256 1042.809       37.82251 1127.553       48.27391 292.4113 5.307867 303.9879 6.516586 -11.57654      8.404722 
1 1 1 0   11 6  o 482.9408 8.183563 2847.923       96.31023 2881.911       119.0385 2783.511       163.8722 485.5474 10.06051 476.2286 14.13627 9.318787       17.35073 
1 1 1 0   11 7  o 331.4325 5.064723 1339.454       40.90598 1342.463       57.97560 1336.471       57.72481 331.6772 7.172879 330.9373 7.157818 0.7398987      10.13334 
1 1 1 0   11 8  o 85.11658 2.676215 88.37851       5.544104 100.0611       10.22919 83.51932       6.597093 90.47544 4.655186 82.71555 3.279374 7.759895       5.694300 
1 1 1 0   11 9  o 179.6262 3.233193 393.2350       14.15264 415.4882       20.69839 373.6964       19.39485 184.6155 4.600788 175.0266 4.551083 9.588898       6.471446 
1 1 1 0   11 10 o 181.6943 3.250024 402.3303       14.39011 407.9642       20.64066 397.0022       20.07260 182.8830 4.635155 180.4104 4.569364 2.472565       6.508744 
1 1 1 0   11 11 o 786.5126 11.28383 7554.777       216.2711 7481.100       303.9070 7630.374       307.8379 781.7670 15.95244 789.5170 16.00017 -7.750061      22.59393 
1 1 1 0   11 12 o 368.3959 5.555038 1654.475       49.86984 1726.210       72.60278 1590.396       68.61893 376.1973 7.919568 361.1008 7.797931 15.09653       11.11428 
1 1 1 0   11 13 o 326.5910 5.009724 1300.147       39.87072 1274.740       55.85188 1326.549       56.93516 323.3178 7.088789 329.8228 7.083759 -6.505035      10.02151 
1 1 1 0   11 14 o 335.6655 5.885934 1373.638       48.14578 1337.709       81.38636 1392.981       59.71546 330.9058 10.10463 337.9697 7.250582 -7.063934      12.43682 
1 1 1 0   11 15 o 351.0859 7.541346 1503.401       64.52059 0.000000       0.000000 1503.401       64.52059 ?        ?        351.0859 7.541346 0.000000       7.541346 
1 1 1 0   11 16 o 497.3265 7.301101 3016.752       88.48428 2985.813       124.4612 3048.371       125.8212 494.5132 10.32809 499.6663 10.33327 -5.153046      14.60979 
1 1 1 0   11 17 o 197.1591 3.477568 473.7536       16.70816 451.6795       23.19908 497.5431       24.08355 192.4219 4.951550 202.0230 4.891967 -9.601135      6.960545 
1 1 1 0   11 18 o 319.2758 4.952740 1242.793       38.53432 1255.073       55.04584 1230.992       53.96184 320.7510 7.042394 317.6629 6.970825 3.088165       9.908972 
1 1 1 0   11 19 o 530.3397 7.761624 3432.915       100.3097 3431.293       141.9445 3434.533       141.7743 529.7552 10.99530 530.0083 10.97688 -0.2530518     15.53668 
1 1 1 0   11 20 o 330.0092 5.850998 1328.556       47.05351 1343.407       58.43125 1301.158       79.36233 331.7438 7.227801 326.0613 9.999831 5.682526       12.33847 
1 1 1 0   11 21 o 157.4866 3.137074 302.3320       12.03939 285.9998       16.62365 320.3482       17.45963 153.0746 4.461190 162.0155 4.426388 -8.940933      6.284515 
1 1 1 0   11 22 o 210.5540 3.666801 540.5870       18.81425 531.0434       26.40944 550.4222       26.80981 208.6067 5.195111 212.3797 5.180177 -3.773071      7.336444 
1 1 1 0   11 23 o 352.0423 5.404572 1513.220       46.36521 1507.464       65.48493 1519.006       65.65602 351.0042 7.655843 352.3471 7.646589 -1.342957      10.82046 
1 1 1 0   11 24 o 127.9784 3.447857 199.9202       10.74302 194.6881       12.69172 213.1430       20.17641 126.2418 4.131107 131.8783 6.296380 -5.636429      7.530634 
1 1 1 0   11 25 o 219.4319 3.800965 587.6145       20.32496 581.1135       28.56144 594.2842       28.92977 218.0425 5.375301 220.4985 5.383978 -2.455963      7.607962 
1 1 1 0   11 26 o 241.4570 4.060569 711.8734       23.89256 725.4818       34.09559 698.7434       33.49091 243.4966 5.746047 238.9664 5.751139 4.530182       8.129739 
1 1 1 0   11 27 o 262.4404 4.928947 842.1627       31.52252 892.2456       54.92727 817.5668       38.49240 269.1106 8.385936 258.3351 6.114422 10.77542       10.37835 
1 1 1 0   11 28 o 102.7068 2.899609 128.8108       7.250032 126.8966       9.996686 130.9347       10.53030 101.8358 4.036274 103.4295 4.186574 -1.593712      5.815403 
1 1 1 0   11 29 o 155.3971 3.872713 295.0703       14.66541 313.9889       27.84834 287.8104       17.25134 159.5945 7.178910 153.3124 4.622809 6.282074       8.538567 
1 1 1 0   11 30 o 91.17526 2.964422 101.5876       6.577720 99.41348       8.964656 104.1231       9.681216 90.07224 4.094907 92.15610 4.322966 -2.083862      5.954519 
1 1 1 0   11 31 o 55.09148 3.723439 37.27300       4.969424 35.81171       6.955057 38.79709       7.102931 53.76191 5.380959 55.99749 5.266993 -2.235580      7.529671 
1 1 1 0   11 32 o 97.71591 3.367799 116.8423       8.007519 112.8935       9.670764 125.4533       14.28106 95.94189 4.146129 100.8345 5.836804 -4.892654      7.159516 
1 1 1 0   11 33 o 31.70744 5.232625 12.67189       3.902213 11.57898       4.943770 14.47812       6.355571 30.02005 6.902291 33.49204 7.913574 -3.471989      10.50078 
1 1 1 0   11 34 o 107.0867 3.108203 140.3263       8.102539 136.7514       10.87516 144.7866       12.14758 105.5183 4.237952 108.5019 4.604741 -2.983551      6.258105 
1 1 1 0   11 35 o 63.71099 3.464596 49.85000       5.358778 49.08346       6.958584 50.96707       8.400287 63.03595 4.560824 64.06131 5.432159 -1.025356      7.092916 
1 1 1 0   11 36 o 133.0883 3.732884 217.4778       12.09460 216.5707       14.30533 219.7514       22.64748 132.6029 4.433226 132.5021 7.039182 0.1007385      8.318869 
1 1 1 0   11 37 o 43.77855 4.260700 23.82646       4.488029 21.12306       5.829930 27.75931       7.031723 40.77134 6.051062 46.76876 6.332311 -5.997414      8.758625 
1 1 1 0   11 38 f 44.56768 4.249498 24.75345       4.559432 26.55192       5.898442 22.08354       7.186779 45.87691 5.378004 41.13839 7.442786 4.738514       9.182482 
1 1 1 0   11 39 o 57.06433 3.752912 40.41349       5.189814 43.25631       6.817691 36.49627       8.002983 58.71084 4.807277 53.34450 6.276354 5.366341       7.905854 
1 1 1 0   11 40 o 65.54570 4.345112 53.88128       6.901171 52.94331       13.40395 54.21960       8.050138 62.11986 9.126443 65.40928 5.090477 -3.289421      10.45012 
1 1 1 0   11 41 o 61.84248 3.665196 47.86557       5.498801 44.08984       7.305113 52.80186       8.352705 58.58416 5.169940 63.99629 5.406476 -5.412132      7.480525 
1 1 1 0   11 42 o 20.12084 6.884956 5.290045       4.060870 7.603778       4.630183 -2.421267      8.452897 23.36546 7.316641 18.43515 8.425049 4.930307       11.15861 
1 1 1 0   11 43 o 31.96187 5.551044 13.91079       4.166793 14.17932       5.314180 13.48222       6.713620 31.26046 7.133855 29.35788 8.737598 1.902584       11.27996 
1 1 1 0   11 44 o 36.84996 5.038949 18.47193       4.406541 18.99652       5.693026 17.68795       6.959646 35.98734 6.739290 32.87373 8.593066 3.113609       10.92057 
1 1 1 0   11 45 o 32.58706 5.601659 15.31151       4.288037 19.45786       5.721380 9.997489       6.477088 35.51090 6.859873 23.61335 8.635114 11.89755       11.02828 
1 1 1 0   11 46 o 25.31125 7.039753 10.70834       4.499516 9.673171       5.344763 13.22703       8.337016 23.05556 7.898430 24.35933 9.581766 -1.303766      12.41755 
1 1 1 0   11 47 o 12.97504 5.891200 0.1623659      4.048533 -1.274035      6.016695 1.350832       5.472850 14.06268 6.649534 15.00684 6.827742 -0.9441624     9.530706 
1 1 1 0   11 48 o 10.83931 5.133595 -1.797334      3.613390 -0.7775474     5.101587 -2.823961      5.118665 13.00359 6.140996 12.09055 5.828327 0.9130373      8.466476 
1 1 1 0   11 49 o 15.86497 6.445773 4.730933       3.899089 0.4264566      5.611374 8.749476       5.421799 13.43802 6.374016 18.91857 7.631759 -5.480555      9.943431 
1 1 1 0   11 50 f 12.61291 6.129990 -1.099415      5.962949 9.706476       9.563455 -7.972449      7.627088 16.66653 8.017020 11.79594 5.930608 4.870587       9.972198 
1 1 1 0   12 0  o 366.8335 7.826693 1641.283       69.96542 1657.608       99.52322 1625.330       98.37881 368.2989 11.10156 364.6941 11.08258 3.604858       15.68656 
1 1 1 0   12 1  o 177.5025 3.207397 384.0273       13.87373 364.3399       19.05401 406.2430       20.24055 172.8044 4.528662 182.5331 4.550345 -9.728729      6.419846 
1 1 1 0   12 2  o 378.9093 6.570862 1751.806       60.67276 1738.641       73.96658 1778.881       106.0763 377.3510 8.043664 381.1155 11.43450 -3.764496      13.98028 
1 1 1 0   12 3  o 325.9138 4.990935 1295.247       39.63883 1361.975       57.76648 1235.869       54.49223 334.0697 7.095822 318.2332 7.026725 15.83646       9.986268 
1 1 1 0   12 4  o 170.3253 3.597939 353.6180       14.93375 359.9663       18.49720 341.7334       25.30844 171.7734 4.422577 167.2584 6.220118 4.514984       7.632106 
1 1 1 0   12 5  o 379.9999 5.716622 1761.086       52.93697 1695.428       72.95345 1834.104       76.93335 372.6785 8.032955 387.6104 8.144851 -14.93185      11.43971 
1 1 1 0   12 6  o 479.1367 5.740885 2799.642       67.03080 2746.570       93.59712 2855.522       96.04188 474.3699 8.096723 483.6818 8.148258 -9.311890      11.48699 
1 1 1 0   12 7  o 376.2263 5.058570 1725.716       46.37810 1679.069       72.20497 1758.476       60.51079 370.9378 7.987850 379.7029 6.539625 -8.765045      10.32339 
1 1 1 0   12 8  o 177.2412 2.878152 382.8356       12.43125 367.9512       19.51796 392.9948       16.12488 173.6762 4.615759 179.5674 3.684962 -5.891144      5.906283 
1 1 1 0   12 9  o 83.88628 2.586072 85.83330       5.280179 80.84531       7.497224 90.74245       7.437733 81.35682 3.791987 86.21502 3.547728 -4.858200      5.192836 
1 1 1 0   12 10 o 499.2146 7.314935 3039.373       88.98849 3084.114       127.1882 2996.468       124.5507 502.6388 10.38376 495.4512 10.31595 7.187592       14.63698 
1 1 1 0   12 11 o 487.0098 7.150168 2892.317       84.85746 2881.376       119.8529 2903.314       120.1609 485.8833 10.12233 487.7305 10.10990 -1.847168      14.30635 
1 1 1 0   12 12 o 666.0623 9.615613 5413.612       156.0731 5335.088       218.7650 5495.008       222.7297 660.7211 13.58700 670.5441 13.63059 -9.822998      19.24577 
1 1 1 0   12 13 o 313.7245 5.566602 1199.853       42.55737 1169.012       72.03172 1216.391       52.74785 309.3626 9.566257 315.8370 6.853392 -6.474426      11.76785 
1 1 1 0   12 14 o 105.7047 3.705580 136.3431       9.530468 0.000000       0.000000 136.3431       9.530468 ?        ?        105.7047 3.705580 0.000000       3.705580 
1 1 1 0   12 15 f 279.7079 5.160867 953.7562       35.17738 910.5040       60.67418 975.6565       43.17427 272.9915 9.133361 282.8669 6.263352 -9.875397      11.07465 
1 1 1 0   12 16 o 277.5932 4.421370 939.2943       29.90899 946.3975       42.67300 932.4356       41.93214 278.5826 6.285837 276.5223 6.222726 2.060242       8.845001 
1 1 1 0   12 17 o 657.8477 9.515368 5284.292       152.5412 5474.545       221.0469 5111.317       210.7714 668.8480 13.56191 646.3156 13.38231 22.53247       19.05286 
1 1 1 0   12 18 o 105.4187 3.300651 135.5803       8.468724 136.3056       16.85672 135.3354       9.794527 105.5002 6.589577 105.3004 3.823306 0.1998749      7.618411 
1 1 1 0   12 19 o 138.9180 3.351627 235.2253       11.34620 230.9281       14.30278 242.5202       18.63547 137.5612 4.271844 140.9085 5.437295 -3.347336      6.914682 
1 1 1 0   12 20 f 288.3650 4.577979 1014.066       32.17010 977.6112       44.62529 1053.510       46.41844 283.0123 6.470527 293.7921 6.483572 -10.77975      9.159936 
1 1 1 0   12 21 o 317.4218 4.946750 1229.238       38.26422 1226.626       54.12746 1231.848       54.10010 316.8801 7.009493 317.5559 6.991039 -0.6758728     9.899880 
1 1 1 0   12 22 o 75.34935 2.829653 69.31125       5.186524 62.00606       7.180172 77.28169       7.499982 71.17566 4.157789 79.50703 3.882701 -8.331367      5.688811 
1 1 1 0   12 23 o 120.2712 3.458115 176.5674       10.12479 179.1809       12.08940 170.4286       18.52835 121.1147 4.102031 117.8909 6.474268 3.223778       7.664385 
1 1 1 0   12 24 o 98.98788 3.364345 119.6641       8.103768 117.9544       9.504073 124.2178       15.51074 98.23235 3.978493 100.5661 6.361747 -2.333740      7.503348 
1 1 1 0   12 25 f 125.1702 2.935523 191.0976       8.954116 189.6501       12.58771 192.5803       12.73972 124.5624 4.152707 125.5203 4.170741 -0.9579315     5.885581 
1 1 1 0   12 26 o 108.2472 3.182602 143.0909       8.386163 144.2562       13.27447 142.3170       10.81847 108.5060 5.033990 107.8718 4.123080 0.6341858      6.506984 
1 1 1 0   12 27 f 156.1862 3.201684 297.6975       12.18589 305.7493       17.34820 289.8552       17.12096 158.0987 4.507475 153.9228 4.569518 4.175980       6.418553 
1 1 1 0   12 28 o 32.23369 4.390037 12.93469       3.358843 13.66171       4.389270 11.90736       5.217656 32.93171 5.674216 30.52024 7.142620 2.411469       9.122157 
1 1 1 0   12 29 o 101.6277 3.635722 126.3351       8.989565 146.5810       18.09440 119.7002       10.35835 108.9649 6.848949 98.84030 4.310883 10.12457       8.092702 
1 1 1 0   12 30 o 197.9911 3.648532 479.0755       17.60354 456.9179       24.20556 503.9513       25.64727 193.0032 5.151136 202.6881 5.196789 -9.684952      7.317159 
1 1 1 0   12 31 o 149.0369 3.640505 271.5589       13.22183 270.9440       16.27561 272.7522       22.67345 148.6690 4.497595 148.7428 6.269320 -0.7379150E-01 7.715745 
1 1 1 0   12 32 o 224.8248 4.504315 619.4637       24.67795 616.6943       40.79194 621.0623       30.99281 223.0528 7.515386 224.6673 5.665415 -1.614487      9.411587 
1 1 1 0   12 33 o 142.3001 3.213519 247.5595       11.14352 247.6231       15.46199 247.4908       16.07447 142.0258 4.473053 141.9443 4.653395 0.8145142E-01  6.454633 
1 1 1 0   12 34 o 34.91290 5.019485 15.29070       4.147920 15.29545       5.309607 15.28326       6.644454 34.60756 6.535342 34.32820 8.078252 0.2793579      10.39081 
1 1 1 0   12 35 o 135.2698 3.191226 223.9449       10.51949 216.2711       14.30551 232.9798       15.52251 132.5864 4.433836 137.5566 4.637306 -4.970276      6.415879 
1 1 1 0   12 36 o 86.49361 3.612474 91.94797       7.597449 92.79713       8.931687 89.72547       14.44972 86.75256 4.237709 84.41003 7.090195 2.342529       8.260087 
1 1 1 0   12 37 o 61.27327 3.875864 46.37929       5.757638 38.55362       8.032496 54.64894       8.257214 55.27576 6.062567 66.19992 5.159177 -10.92416      7.960642 
1 1 1 0   12 38 o 28.26867 5.801419 10.35648       3.862406 9.757051       4.884891 11.35630       6.308809 27.21434 7.239955 29.26210 8.404652 -2.047754      11.09302 
1 1 1 0   12 39 f 88.83561 3.255043 97.42532       7.034691 94.33259       9.395146 101.3717       10.61290 86.92208 4.450259 89.90712 4.862088 -2.985039      6.591259 
1 1 1 0   12 40 o 35.18297 6.819704 16.55425       5.635881 15.26575       9.922382 17.16793       6.847716 32.60442 10.75920 35.26006 8.134941 -2.655640      13.48842 
1 1 1 0   12 41 o 34.45631 5.528647 15.62728       4.485244 11.88506       5.338942 24.60367       8.268771 29.16094 7.478004 41.64172 8.437879 -12.48078      11.27468 
1 1 1 0   12 42 o 14.56936 6.005638 1.334304       3.446456 2.682326       4.292327 -1.111745      5.781986 17.09776 6.827062 15.92930 7.153782 1.168458       9.888649 
1 1 1 0   12 43 o 27.35942 5.888110 10.47687       3.809313 6.679512       4.651082 18.21421       6.639094 21.57489 7.368686 34.58931 8.031040 -13.01442      10.89932 
1 1 1 0   12 44 o 14.86715 6.745359 -0.6709068     5.295760 3.511241       9.540724 -2.533212      6.366593 20.44827 9.185820 15.08079 7.038123 5.367476       11.57214 
1 1 1 0   12 45 o 16.62401 6.476829 3.679442       3.779025 7.602021       4.928243 -1.918738      5.887484 21.35512 7.567093 14.40315 6.737008 6.951970       10.13154 
1 1 1 0   12 46 o 39.00624 6.408084 23.85887       5.879805 23.31728       7.542794 24.69768       9.387114 34.84416 8.863546 32.38787 10.45054 2.456284       13.70315 
1 1 1 0   12 47 o 22.87360 6.651678 9.140185       3.928970 5.861060       5.384351 12.87470       5.746076 18.01731 7.474148 24.91112 8.186049 -6.893805      11.08487 
1 1 1 0   12 48 o 11.93147 5.451425 0.1800488      3.536082 -2.788143      5.210732 2.713794       4.814312 12.07237 5.834579 14.70010 6.570265 -2.627733      8.786962 
1 1 1 0   12 49 o 16.85561 7.027099 6.198399       4.793508 -1.926774      9.414276 9.042199       5.569550 14.17014 7.040949 18.84414 7.685970 -4.673996      10.42349 
1 1 1 0   13 1  o 220.2518 4.271483 591.3687       22.92632 595.7305       28.15784 582.7900       39.48900 221.0355 5.227586 218.4140 7.430059 2.621490       9.084792 
1 1 1 0   13 2  o 155.9638 3.473647 296.4772       13.20218 295.8565       16.13472 297.7348       22.96559 155.7301 4.255595 156.1273 6.047625 -0.3972015     7.394853 
1 1 1 0   13 3  f 366.6234 4.962859 1638.763       44.33923 1682.193       71.46098 1611.577       56.53841 371.2731 7.898404 363.4958 6.382754 7.777344       10.15501 
1 1 1 0   13 4  o 377.7563 5.688140 1740.064       52.36222 1741.175       74.01910 1738.952       74.08369 377.7310 8.041277 377.4890 8.053453 0.2420349      11.38070 
1 1 1 0   13 5  o 341.9683 4.664528 1425.572       38.87136 1394.355       60.52567 1447.486       50.71196 338.0817 7.346523 344.5300 6.040144 -6.448273      9.510770 
1 1 1 0   13 6  o 402.1769 4.900474 1971.767       48.02765 1940.413       67.20911 2004.486       68.65673 398.8687 6.914521 405.3986 6.949680 -6.529877      9.803501 
1 1 1 0   13 7  o 282.9837 3.998583 976.0247       27.57425 956.4788       43.26477 989.3954       35.78353 280.0716 6.339125 284.8868 5.154360 -4.815277      8.170185 
1 1 1 0   13 8  o 750.3320 9.640167 6871.034       176.2683 6801.377       276.9531 6918.462       228.5300 745.6073 15.24263 752.5054 12.46228 -6.898132      19.68873 
1 1 1 0   13 9  o 107.0294 4.192696 139.8313       10.91420 126.6564       15.11183 154.1967       15.77984 101.7401 6.123557 112.3156 5.784852 -10.57545      8.423923 
1 1 1 0   13 10 o 649.1388 8.383050 5140.071       132.6098 5106.173       209.0176 5162.907       171.5590 646.4488 13.26822 650.3355 10.82530 -3.886719      17.12404 
1 1 1 0   13 11 o 346.0625 5.283214 1459.860       44.55423 1497.958       64.18642 1424.433       61.89444 350.4683 7.515508 341.7625 7.431751 8.705811       10.56947 
1 1 1 0   13 12 o 489.3794 8.283075 2921.441       98.78100 2901.251       169.9544 2931.741       121.3904 486.9180 14.33883 490.0989 10.16400 -3.180878      17.57581 
1 1 1 0   13 13 o 334.3859 7.236989 1363.662       58.97148 0.000000       0.000000 1363.662       58.97148 ?        ?        334.3859 7.236989 0.000000       7.236989 
1 1 1 0   13 14 o 453.4171 7.773032 2507.863       85.88640 2510.731       149.9308 2506.462       104.7821 452.9355 13.59911 453.1621 9.488493 -0.2265930     16.58213 
1 1 1 0   13 15 o 121.3038 2.813445 179.3192       8.316661 164.3996       11.74342 194.3312       11.77973 116.0622 4.158820 126.2123 3.834438 -10.15007      5.656739 
1 1 1 0   13 16 o 405.9399 6.084766 2009.574       60.19241 2020.885       85.71030 1998.568       84.55136 406.9022 8.643845 404.6549 8.574321 2.247284       12.17518 
1 1 1 0   13 17 o 370.7787 5.623114 1676.496       50.80749 1713.832       73.03549 1641.484       70.72545 374.7227 7.998119 366.7347 7.913846 7.987915       11.25162 
1 1 1 0   13 18 o 263.2473 4.877765 845.0099       31.29110 861.0444       39.29016 817.2020       51.74168 265.6783 6.068645 258.5702 8.222016 7.108093       10.21910 
1 1 1 0   13 19 o 214.4499 3.709396 560.6498       19.38497 583.3428       28.18369 540.2755       26.70503 218.6862 5.288595 210.4623 5.206940 8.223877       7.421689 
1 1 1 0   13 20 o 419.3397 6.280375 2146.745       64.17822 2187.992       92.01976 2107.679       89.55388 422.9309 8.928440 415.1099 8.852893 7.820984       12.57341 
1 1 1 0   13 21 o 214.3515 3.719668 560.3083       19.42973 559.5305       27.63237 561.0688       27.32577 214.1096 5.295974 214.4083 5.229916 -0.2986908     7.443075 
1 1 1 0   13 22 o 89.12180 2.813065 96.93162       6.101766 98.60111       8.717287 95.32794       8.543732 89.81507 3.992850 88.30964 3.980349 1.505432       5.637910 
1 1 1 0   13 23 o 248.2516 4.834475 752.5563       29.24674 792.2928       36.50151 681.2979       48.88034 254.5878 5.883520 235.5123 8.531054 19.07547       10.36314 
1 1 1 0   13 24 o 191.9123 3.502512 449.3739       16.38017 442.0398       23.04142 456.8676       23.29072 190.1423 4.977003 193.3110 4.948201 -3.168716      7.018209 
1 1 1 0   13 25 o 78.84244 3.105499 75.95164       5.954937 67.00030       8.926593 83.12952       7.993554 73.86895 4.988177 82.41817 3.991850 -8.549225      6.388801 
1 1 1 0   13 26 o 168.9995 3.313059 348.5520       13.64428 354.2367       19.44133 343.0343       19.15374 170.1720 4.692633 167.4568 4.698338 2.715240       6.640420 
1 1 1 0   13 27 o 88.85078 2.876770 96.42122       6.220561 94.26834       8.620178 98.76050       8.985599 87.74870 4.042106 89.81159 4.116565 -2.062897      5.769291 
1 1 1 0   13 28 o 69.26017 3.044829 58.66272       5.126488 51.29129       6.820143 68.23734       7.772813 64.62103 4.356412 74.58422 4.294726 -9.963196      6.117434 
1 1 1 0   13 29 o 162.2691 3.922753 321.8835       15.51182 347.9364       29.59959 312.0194       18.21311 167.8956 7.251629 159.5839 4.688457 8.311661       8.635262 
1 1 1 0   13 30 o 146.3653 3.605697 261.8361       12.86066 268.4953       16.09630 250.0808       21.38617 148.0259 4.467346 142.4864 6.173838 5.539429       7.620594 
1 1 1 0   13 31 o 92.81171 3.013134 105.3234       6.805836 106.9833       9.428774 103.5179       9.833809 93.39582 4.153166 91.82948 4.407307 1.566345       6.055835 
1 1 1 0   13 32 o 76.47286 3.116160 71.58240       5.794989 70.67384       7.802837 72.69991       8.653763 75.83787 4.238987 76.85674 4.642119 -1.018875      6.286357 
1 1 1 0   13 33 o 80.99706 3.443506 80.40807       6.781317 71.09223       9.729853 89.20772       9.456451 75.83742 5.298183 85.13689 4.574801 -9.299469      6.999968 
1 1 1 0   13 34 o 56.15975 3.553594 38.77639       4.838338 33.15777       6.289309 46.92270       7.573004 51.66079 5.060659 61.53130 5.096186 -9.870506      7.182018 
1 1 1 0   13 35 o 45.05518 4.109214 25.13230       4.462090 20.80834       5.784228 31.48729       7.012315 40.56056 6.035626 50.10947 5.852648 -9.548912      8.407274 
1 1 1 0   13 36 o 122.4864 4.306335 184.9860       12.83381 177.4286       16.10843 198.1199       21.23549 119.4905 5.547157 125.5850 6.966155 -6.094582      8.904957 
1 1 1 0   13 37 o 17.19290 6.381609 2.934008       3.559746 5.376677       4.478951 -1.254933      5.865381 21.28153 7.231753 16.77209 7.386527 4.509445       10.33727 
1 1 1 0   13 38 o 32.03609 5.295417 13.14575       3.989746 11.37405       5.090689 15.96678       6.423711 29.29165 7.186722 34.59814 7.805312 -5.306482      10.60999 
1 1 1 0   13 39 o 13.41077 5.800926 -0.1959926     3.479798 2.280008       4.348361 -4.605579      5.802953 17.27015 6.879570 14.49939 6.750935 2.770758       9.638652 
1 1 1 0   13 40 o 12.83366 6.134454 -6.526909      5.405828 -19.04612      8.073971 3.645152       7.277851 12.86224 6.412082 21.45383 8.772443 -8.591585      10.86603 
1 1 1 0   13 41 f 10.59320 4.983995 -3.162757      3.303963 -3.897705      4.141407 -1.876034      5.479769 11.81224 5.564486 15.20638 6.884214 -3.394136      8.851887 
1 1 1 0   13 42 o 24.69897 6.049551 8.478755       3.611770 5.502559       4.578749 13.38076       5.876285 20.41010 7.287421 30.05158 7.915647 -9.641476      10.75937 
1 1 1 0   13 43 o 11.75259 5.390208 -1.659247      3.501187 1.896964       4.291400 -8.738585      6.054824 15.89936 6.640207 12.43122 6.071574 3.468144       8.997575 
1 1 1 0   13 44 o 12.60235 5.622522 -0.2836708     3.508876 -0.9406606     4.390725 0.8774983      5.837201 13.42030 6.109671 16.26119 7.253588 -2.840896      9.483809 
1 1 1 0   13 45 f 13.15210 5.792103 0.5083026      3.606286 1.894075       4.897823 -1.132575      5.329607 15.64767 6.824133 14.11118 6.535613 1.536491       9.448970 
1 1 1 0   13 46 o 19.37224 7.025559 6.436707       4.274919 3.415196       5.024992 14.35255       8.133398 16.43731 7.038589 24.56468 9.521011 -8.127367      11.84025 
1 1 1 0   13 47 o 24.25106 6.657185 10.37485       4.053226 6.777685       5.563970 14.44229       5.916513 18.50939 7.630332 26.03384 8.286319 -7.524452      11.26433 
1 1 1 0   13 48 o 13.62875 6.246125 1.401205       4.689811 13.74210       9.714893 -2.348610      5.355125 19.68195 9.008904 12.27215 5.927145 7.409803       10.78385 
1 1 1 0   13 49 o 11.75142 5.570895 -0.6778885     4.274785 -0.1389658     5.260473 -1.725701      7.335053 12.75646 6.084839 13.29933 6.534079 -0.5428696     8.928575 
1 1 1 0   14 0  o 123.3406 5.535538 185.7930       16.59564 185.7930       16.59564 0.000000       0.000000 123.3406 5.535538 ?        ?        0.000000       5.535538 
1 1 1 0   14 1  o 135.0398 3.304363 222.2425       10.87391 221.4190       13.18675 223.9922       19.22191 134.7221 4.021139 135.4125 5.838797 -0.6903687     7.089507 
1 1 1 0   14 2  o 313.6293 5.619581 1199.267       42.94935 1182.957       52.03537 1234.126       76.07493 311.4410 6.856253 317.7951 9.835157 -6.354126      11.98910 
1 1 1 0   14 3  o 159.9765 3.098613 311.8890       12.07980 320.3452       17.15824 303.5788       17.00956 162.0578 4.348699 157.7534 4.429028 4.304382       6.207050 
1 1 1 0   14 4  o 362.8624 6.332815 1605.520       55.99831 1563.852       94.99726 1627.709       69.32301 357.6938 10.91118 365.2911 7.787575 -7.597321      13.40523 
1 1 1 0   14 5  o 138.6841 2.597227 234.3754       8.777539 235.8584       13.86103 233.3825       11.34130 139.0495 4.095088 138.3844 3.363097 0.6651001      5.299072 
1 1 1 0   14 6  o 401.7852 5.376924 1967.916       52.64582 1978.801       83.38668 1960.702       67.88616 402.7474 8.496260 400.9824 6.947361 1.765015       10.97507 
1 1 1 0   14 7  o 293.2475 4.125599 1048.082       29.48203 1031.609       46.35037 1059.276       38.20736 290.8727 6.539042 294.7821 5.318753 -3.909424      8.429010 
1 1 1 0   14 8  o 541.0649 7.901771 3570.540       104.1861 3615.546       148.7947 3527.250       145.9299 544.1913 11.22018 537.5128 11.14088 6.678467       15.81176 
1 1 1 0   14 9  o 460.0085 9.565392 2582.088       107.2271 2582.854       152.0282 2581.330       151.2589 459.5369 13.59081 459.4095 13.52564 0.1274109      19.17428 
1 1 1 0   14 10 f 657.2737 10.98182 5274.136       175.8964 5167.419       301.2465 5329.341       216.6668 649.0343 19.06731 660.3790 13.46366 -11.34467      23.34164 
1 1 1 0   14 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   14 12 o 390.2089 6.803230 1856.790       64.69168 1830.522       112.1321 1869.896       79.20157 386.9245 11.90652 391.5038 8.301600 -4.579254      14.51488 
1 1 1 0   14 13 f 321.8609 4.994185 1262.850       39.17138 1233.704       54.88740 1293.104       55.92045 318.0474 7.081817 325.6157 7.047406 -7.568237      9.990899 
1 1 1 0   14 14 f 306.6866 4.797885 1146.583       35.85756 1119.379       50.27447 1174.750       51.15756 302.9525 6.809839 310.3569 6.764136 -7.404388      9.598305 
1 1 1 0   14 15 o 101.3376 3.250823 125.2856       8.017481 137.9039       16.21111 121.1998       9.224619 106.1511 6.295164 99.64564 3.805863 6.505424       7.356200 
1 1 1 0   14 16 f 190.1432 3.438860 440.6603       15.93424 435.7250       22.74034 445.4208       22.33397 188.9792 4.942193 191.0788 4.800222 -2.099564      6.889659 
1 1 1 0   14 17 o 560.5865 9.434376 3839.703       128.8819 3850.501       158.7024 3818.790       220.8692 560.9742 11.60926 557.2993 16.28082 3.674866       19.99600 
1 1 1 0   14 18 o 240.7349 4.011518 706.5616       23.53336 671.7280       32.57418 744.5928       34.03635 234.6528 5.696546 247.0543 5.653461 -12.40152      8.025724 
1 1 1 0   14 19 o 304.5211 4.787360 1131.126       35.52627 1143.612       50.81299 1119.186       49.68933 306.0276 6.813622 302.7493 6.735096 3.278229       9.580552 
1 1 1 0   14 20 o 285.1222 4.558825 991.7329       31.67525 1018.190       45.74755 967.3690       43.90063 288.7195 6.502130 281.4325 6.401186 7.286987       9.124301 
1 1 1 0   14 21 f 197.7229 3.549253 476.7734       17.10134 480.5654       24.43390 473.1322       23.94344 198.3511 5.059140 196.8162 4.996211 1.534927       7.110346 
1 1 1 0   14 22 o 143.0965 3.036460 249.6992       10.58845 239.1335       14.84114 260.6529       15.11118 139.9085 4.358299 146.0831 4.249367 -6.174561      6.087026 
1 1 1 0   14 23 o 62.97822 3.680542 48.56044       5.623949 46.53659       6.382877 55.58517       11.89168 61.59356 4.279115 66.94633 7.413288 -5.352772      8.559652 
1 1 1 0   14 24 o 223.3759 3.871348 609.0858       21.07341 650.4696       31.15021 574.1630       28.61547 230.6172 5.542851 216.6185 5.425140 13.99864       7.755988 
1 1 1 0   14 25 o 63.33168 3.229633 49.06763       4.967914 55.80885       7.878035 44.61712       6.401082 67.39878 4.828550 60.27463 4.388010 7.124153       6.524533 
1 1 1 0   14 26 o 136.8683 3.055421 228.5807       10.19084 220.9432       14.24888 236.5782       14.58090 134.3922 4.356571 139.0769 4.307421 -4.684708      6.126466 
1 1 1 0   14 27 o 124.3753 3.006274 188.7866       9.111685 192.9482       12.92317 184.6728       12.84889 125.5696 4.229301 122.8354 4.299086 2.734253       6.030682 
1 1 1 0   14 28 f 149.5204 3.179285 272.9493       11.58420 272.2710       16.35641 273.6319       16.40878 149.1160 4.506366 149.4880 4.509523 -0.3720093     6.375197 
1 1 1 0   14 29 o 218.6734 5.534883 587.0247       29.47076 546.9557       42.11406 625.4759       41.25510 210.1164 8.240889 225.0145 7.534319 -14.89806      11.16594 
1 1 1 0   14 30 o 130.7186 3.076373 208.6994       9.799693 213.6965       13.84947 203.6887       13.86827 132.0532 4.309534 128.9011 4.421534 3.152115       6.174305 
1 1 1 0   14 31 o 158.7363 3.322510 307.9738       12.85224 299.4094       17.81125 317.2770       18.56371 156.2047 4.684413 160.7879 4.742971 -4.583160      6.666296 
1 1 1 0   14 32 o 114.0271 3.063922 159.0152       8.506055 149.9034       11.59497 169.6329       12.51657 110.5061 4.314023 117.5512 4.377050 -7.045074      6.145679 
1 1 1 0   14 33 o 37.91176 4.492167 17.88460       4.069617 14.71006       5.314837 22.38379       6.327266 33.90225 6.670867 42.09506 6.366744 -8.192810      9.221491 
1 1 1 0   14 34 o 105.1639 3.450931 135.5808       8.831827 136.5910       13.70694 134.8637       11.54871 105.1025 5.369491 104.6525 4.539229 0.4500275      7.031076 
1 1 1 0   14 35 o 76.80517 3.202653 72.38175       5.981119 75.21619       8.123473 69.02608       8.838901 78.08451 4.285575 74.65299 4.885487 3.431519       6.498780 
1 1 1 0   14 36 o 33.44656 6.035056 14.34330       4.737962 12.77951       5.291717 20.66385       10.63863 31.29906 7.101431 39.10459 10.80528 -7.805527      12.92998 
1 1 1 0   14 37 o 100.8977 3.168305 125.1686       7.780471 117.8218       10.40788 134.4751       11.71406 97.48370 4.392495 104.0593 4.631054 -6.575623      6.382843 
1 1 1 0   14 38 o 62.80198 3.557306 48.84982       5.421896 50.34617       7.183089 46.86835       8.265854 63.38778 4.683252 60.76830 5.646397 2.619480       7.335847 
1 1 1 0   14 39 o 24.60292 6.227051 8.053222       3.736093 7.867303       4.750409 8.354700       6.049197 24.32038 7.375367 25.25996 8.403140 -0.9395752     11.18073 
1 1 1 0   14 40 o 31.96701 8.217216 14.45898       6.436070 3.761272       9.683234 22.92505       8.614220 23.34948 9.876036 39.89976 9.066223 -16.55028      13.40643 
1 1 1 0   14 41 o 20.24706 6.495942 5.498131       3.630456 7.241473       4.613014 2.661278       5.884531 22.87001 7.320888 18.84297 7.814857 4.027037       10.70829 
1 1 1 0   14 42 o 18.57121 6.663688 4.458465       3.833475 4.711208       4.196265 3.183470       9.424913 19.09781 6.955554 21.45399 9.408669 -2.356180      11.70055 
1 1 1 0   14 43 o 35.13541 4.992869 16.77633       4.154747 20.37073       5.292888 11.00605       6.706218 38.03579 5.901495 25.69676 8.845864 12.33903       10.63377 
1 1 1 0   14 44 o 11.83390 5.394931 -1.008196      3.438607 -1.248677      4.179252 -0.5042295     6.050061 12.80891 5.880005 15.45805 7.088171 -2.649146      9.209594 
1 1 1 0   14 45 o 14.48067 6.192232 1.745548       3.879468 8.349503       5.888532 -3.319099      5.156791 21.42950 8.153095 12.71160 6.052547 8.717895       10.15413 
1 1 1 0   14 46 o 14.71560 6.360935 2.180044       4.178337 6.001874       4.986609 -6.827168      7.655347 18.49971 7.367899 13.53053 6.653142 4.969187       9.927247 
1 1 1 0   14 47 o 11.31212 5.432242 -2.804400      4.348498 -3.108589      8.565964 -2.698793      5.047213 14.51336 7.116398 12.13377 5.833431 2.379596       9.201741 
1 1 1 0   14 48 o 11.72429 5.551428 -1.051843      4.220814 -5.633064      5.164288 8.165481       7.325246 10.83752 5.354600 17.69657 7.990490 -6.859055      9.618714 
1 1 1 0   14 49 o 10.93536 5.204238 -1.236255      3.803052 -1.598615      5.331157 -0.8607816     5.426772 12.11938 5.867977 12.47909 6.011988 -0.3597069     8.401021 
1 1 1 0   15 1  o 449.2017 7.688788 2461.025       84.16574 2533.449       104.8842 2330.040       141.0517 455.6494 9.445899 436.4593 13.27712 19.19009       16.29438 
1 1 1 0   15 2  o 449.0103 7.689686 2458.905       84.13972 2505.416       104.2357 2371.924       142.5446 453.1252 9.439785 440.3719 13.29820 12.75330       16.30803 
1 1 1 0   15 3  o 147.2801 3.009584 264.3372       10.80157 249.2791       14.72599 281.8744       15.89200 142.9508 4.231947 152.0150 4.294291 -9.064224      6.029122 
1 1 1 0   15 4  o 200.6870 3.535690 490.8306       17.29137 455.5139       23.36765 533.5715       25.70676 193.2496 4.966154 209.2207 5.042043 -15.97108      7.077067 
1 1 1 0   15 5  o 418.4896 6.244490 2135.217       63.68215 2228.716       92.54527 2051.127       87.76506 427.4197 8.885126 410.0432 8.783264 17.37650       12.49365 
1 1 1 0   15 6  o 212.0081 3.646049 547.7742       18.83697 585.5333       27.46256 514.2252       25.88626 219.1707 5.141885 205.3262 5.177682 13.84454       7.297080 
1 1 1 0   15 7  o 677.1229 9.780147 5594.968       161.3797 5692.079       230.7141 5501.937       225.8155 682.4526 13.87285 670.9663 13.81074 11.48633       19.57530 
1 1 1 0   15 8  o 565.7027 8.244567 3903.541       113.6560 3934.499       229.1238 3893.437       130.8954 566.7529 16.60768 564.8679 9.509141 1.885010       19.13737 
1 1 1 0   15 9  o 260.8451 4.938688 829.3699       31.39283 746.0583       52.08894 876.8909       39.34012 247.1418 8.662339 268.1875 6.019510 -21.04562      10.54849 
1 1 1 0   15 10 o 636.0685 10.62890 4939.373       164.7511 0.000000       0.000000 4939.373       164.7511 ?        ?        636.0685 10.62890 0.000000       10.62890 
1 1 1 0   15 11 o 255.2102 4.167892 793.8560       25.92093 765.4834       52.15508 803.1631       29.87136 250.3328 8.562142 256.6890 4.775421 -6.356186      9.803822 
1 1 1 0   15 12 o 52.95103 2.745068 34.25978       3.530029 32.19169       6.570122 35.09906       4.185472 51.10697 5.354832 53.56944 3.221084 -2.462475      6.248969 
1 1 1 0   15 13 o 99.96245 2.497318 121.7694       6.083406 125.4563       10.46219 119.8860       7.477415 101.3630 4.244920 99.13443 3.099021 2.228546       5.255786 
1 1 1 0   15 14 o 159.4683 3.177702 309.9267       12.34876 294.3505       17.42856 325.6296       17.49924 155.3204 4.609752 163.3811 4.399230 -8.060638      6.372051 
1 1 1 0   15 15 o 399.8088 6.020915 1949.554       58.66120 1901.934       82.06478 1999.310       83.88407 394.7014 8.532023 404.6818 8.506085 -9.980408      12.04778 
1 1 1 0   15 16 o 124.8826 4.009203 190.3165       12.18521 198.3347       19.97629 185.5652       15.37733 127.3374 6.458673 123.2510 5.131039 4.086441       8.248759 
1 1 1 0   15 17 o 331.5280 5.136107 1340.545       41.49448 1398.587       60.52735 1289.078       56.99587 338.4528 7.338673 324.9450 7.197761 13.50778       10.27929 
1 1 1 0   15 18 o 278.7220 4.471386 947.4429       30.37033 922.0096       42.51535 973.9438       43.39854 274.8256 6.348227 282.4632 6.304884 -7.637634      8.947153 
1 1 1 0   15 19 o 326.0770 5.086079 1297.438       40.41470 1330.473       58.13543 1266.542       56.22258 329.9539 7.230219 321.9374 7.166435 8.016541       10.18007 
1 1 1 0   15 20 o 432.7978 6.479961 2288.969       68.34291 2274.824       96.57994 2303.155       96.72318 430.8234 9.199232 433.5098 9.155783 -2.686432      12.97899 
1 1 1 0   15 21 o 61.85379 2.965438 46.75806       4.456813 44.92527       6.501433 48.38288       6.121484 60.50915 4.440034 62.84410 4.018254 -2.334949      5.988344 
1 1 1 0   15 22 o 98.81092 3.467448 119.2554       8.336377 118.2605       9.761515 121.9363       16.02331 98.35087 4.081764 99.59686 6.639845 -1.245987      7.794122 
1 1 1 0   15 23 o 116.4624 3.492368 165.6499       9.900361 176.6910       11.94782 141.4571       17.68578 120.2343 4.083711 107.2436 6.802380 12.99076       7.934045 
1 1 1 0   15 24 o 21.72435 5.823431 5.974180       3.145545 5.009737       4.883524 6.658027       4.112201 21.50318 7.540118 23.13268 6.826635 -1.629503      10.17135 
1 1 1 0   15 25 o 137.4533 3.047323 230.5231       10.20727 225.4174       14.42842 235.6385       14.44211 135.7546 4.367105 138.8124 4.274489 -3.057800      6.110881 
1 1 1 0   15 26 o 139.2374 3.069501 236.5965       10.41501 239.5240       14.88734 233.7903       14.57570 139.9143 4.371719 138.2331 4.332293 1.681213       6.154729 
1 1 1 0   15 27 o 190.8111 3.552554 444.6850       16.51887 448.0194       23.53576 441.4476       23.19049 191.2254 5.055074 189.8245 5.017676 1.400940       7.122559 
1 1 1 0   15 28 o 229.3982 5.672626 645.6021       31.71101 628.5630       46.51095 660.4027       43.34820 225.2466 8.488650 231.2234 7.703889 -5.976746      11.46329 
1 1 1 0   15 29 o 205.4201 4.405276 516.5365       22.05222 535.2080       40.43936 508.6342       26.30805 207.8547 7.998704 203.5630 5.307920 4.291687       9.599649 
1 1 1 0   15 30 o 152.1788 3.246168 282.9698       12.03819 272.8124       16.70673 293.9387       17.36127 149.1407 4.602345 154.8119 4.607069 -5.671127      6.512040 
1 1 1 0   15 31 o 72.88179 3.166797 65.03765       5.610965 58.58038       7.616220 72.70222       8.297716 68.97539 4.556685 76.89012 4.447431 -7.914734      6.367340 
1 1 1 0   15 32 o 93.29346 3.077554 106.5094       6.987121 98.51564       9.512593 115.8749       10.29646 89.51988 4.373810 97.10625 4.362292 -7.586365      6.177362 
1 1 1 0   15 33 o 119.8686 3.139022 175.8771       9.161402 168.2002       12.56473 184.5912       13.38665 116.9583 4.416384 122.5134 4.491466 -5.555054      6.299025 
1 1 1 0   15 34 o 20.09490 6.517131 4.873523       3.647789 3.437017       4.763530 6.910283       5.672114 19.38501 7.342837 24.14926 8.138583 -4.764256      10.96147 
1 1 1 0   15 35 f 15.09503 6.234766 0.8837686      3.724401 2.300709       5.036037 -0.8267412     5.533193 18.50885 7.393425 16.63217 7.253379 1.876678       10.35733 
1 1 1 0   15 36 o 28.98611 6.512490 10.93779       4.487646 18.26823       5.160938 -11.78703      9.086857 37.87730 5.773599 16.51309 7.909392 21.36421       9.792494 
1 1 1 0   15 37 o 16.38606 6.258145 2.437863       3.477826 1.387883       4.509210 3.979531       5.463932 16.73672 6.881172 20.48546 7.839098 -3.748741      10.43082 
1 1 1 0   15 38 o 91.06939 3.201931 102.4013       7.094867 107.0759       9.800459 97.25359       10.28434 92.61446 4.354611 88.02114 4.812923 4.593315       6.490522 
1 1 1 0   15 39 o 102.7616 3.597253 131.3851       8.994306 126.9599       10.82274 141.2651       16.17132 100.4786 4.430950 104.2772 6.394604 -3.798561      7.779735 
1 1 1 0   15 40 o 40.39131 5.830736 21.57544       5.573207 18.82357       9.685717 22.93753       6.814305 34.90474 10.51984 40.94491 7.085868 -6.040169      12.68372 
1 1 1 0   15 41 o 23.78197 6.916041 7.989843       4.247424 8.493285       4.710950 5.802603       9.819341 24.38685 7.333704 23.70776 9.981981 0.6790924      12.38641 
1 1 1 0   15 42 o 34.28316 5.408370 16.01994       4.368773 15.63504       4.963082 17.34454       9.207061 33.21231 6.363780 31.34488 10.36497 1.867428       12.16266 
1 1 1 0   15 43 o 30.34073 5.732985 13.12308       4.083510 12.59436       5.199367 13.97422       6.596880 28.29162 7.442785 28.56962 8.696968 -0.2779999     11.44693 
1 1 1 0   15 44 o 21.89524 6.828402 7.673529       4.037146 1.014250       5.959419 13.32173       5.488396 16.07825 7.238147 28.00016 7.770181 -11.92191      10.61916 
1 1 1 0   15 45 o 19.67538 6.565503 6.326293       3.692205 6.176945       5.100264 6.490744       5.351957 19.14703 7.505524 19.44127 7.667926 -0.2942390     10.72986 
1 1 1 0   15 46 o 25.23905 8.192055 13.11634       5.763054 10.36751       8.609342 15.34808       7.757445 20.53952 9.000427 24.64891 9.362620 -4.109392      12.98716 
1 1 1 0   15 47 o 14.71166 6.239390 3.143313       3.882419 4.801165       5.503374 1.500801       5.477855 16.40015 7.191023 14.33995 6.636082 2.060200       9.785111 
1 1 1 0   15 48 o 13.09256 5.973941 1.389832       4.228101 1.840115       5.213706 0.5248268      7.226250 13.90775 6.449290 14.18246 6.858409 -0.2747021     9.414411 
1 1 1 0   16 0  o 648.3911 13.27994 5129.507       209.8309 4771.742       282.0334 5573.054       314.0299 624.6914 18.54728 675.0804 19.10806 -50.38898      26.62930 
1 1 1 0   16 1  f 587.3187 8.553809 4207.732       122.4248 4010.440       167.5177 4433.899       179.3578 573.0693 11.99547 602.5403 12.21513 -29.47095      17.12019 
1 1 1 0   16 2  o 243.4005 4.037132 722.0371       23.94587 723.7297       33.75962 720.3234       33.97050 243.6552 5.685724 243.0801 5.734775 0.5751190      8.075587 
1 1 1 0   16 3  o 520.0079 6.821745 3297.173       86.44534 3281.866       136.3672 3307.457       111.7728 518.5163 10.79224 520.6920 8.808850 -2.175659      13.93084 
1 1 1 0   16 4  f 188.3549 3.062673 432.3387       14.05768 404.3238       21.37762 453.6826       18.65956 182.0665 4.822538 192.9387 3.968678 -10.87215      6.245581 
1 1 1 0   16 5  o 117.6427 2.801509 168.6516       8.031435 183.6136       11.73768 155.4795       11.01323 122.6798 3.931280 112.8767 4.010192 9.803162       5.615746 
1 1 1 0   16 6  o 387.6904 5.226530 1832.186       49.37812 1884.260       79.42011 1799.373       63.04429 393.0286 8.292210 384.1467 6.734611 8.881836       10.68250 
1 1 1 0   16 7  o 269.2800 3.871248 883.7377       25.40336 830.0970       38.68947 924.3885       33.68065 260.9315 6.084572 275.3801 5.018939 -14.44852      7.887443 
1 1 1 0   16 8  f 414.9138 6.199605 2099.001       62.68417 2180.572       128.5803 2073.571       71.79353 422.2815 12.50879 412.3474 7.144732 9.934113       14.40545 
1 1 1 0   16 9  o 183.2336 3.365333 409.1721       15.02689 408.1062       30.48997 409.5141       17.26999 182.8071 6.856432 183.3041 3.866195 -0.4970245     7.871348 
1 1 1 0   16 10 o 451.2972 5.989590 2483.313       65.87125 2490.508       104.6875 2478.597       84.75139 451.7135 9.510336 450.7660 7.715420 0.9474792      12.24640 
1 1 1 0   16 11 o 290.1926 4.117579 1026.432       29.11819 1009.999       46.03575 1037.390       37.59368 287.7830 6.564384 291.7046 5.288536 -3.921600      8.429694 
1 1 1 0   16 12 f 277.5444 3.979361 938.9114       26.91422 911.4323       42.31839 957.5760       34.87680 273.3780 6.352278 280.2574 5.106736 -6.879425      8.150472 
1 1 1 0   16 13 o 414.7419 5.552542 2097.456       56.11847 2073.610       88.49108 2113.498       72.58016 412.1392 8.810884 416.2201 7.155810 -4.080902      11.35065 
1 1 1 0   16 14 o 89.23830 3.222950 97.18520       6.997246 111.0904       13.05436 91.57969       8.288486 95.27576 5.647940 86.58733 3.938432 8.688431       6.885526 
1 1 1 0   16 15 o 144.6569 3.494162 255.0683       12.31738 236.7252       15.38548 287.8111       20.55570 139.2656 4.539537 153.5180 5.503512 -14.25243      7.134147 
1 1 1 0   16 16 o 247.7636 4.117907 748.4572       24.86280 754.8636       35.63443 742.3800       34.70655 248.7367 5.878869 246.6773 5.773594 2.059464       8.239872 
1 1 1 0   16 17 o 210.7953 3.698605 541.7615       18.99919 526.6148       26.91237 556.8108       26.82566 207.6881 5.321844 213.6382 5.152707 -5.950089      7.407592 
1 1 1 0   16 18 o 351.2799 5.400923 1506.030       46.23356 1477.958       64.98142 1534.808       65.79443 347.6977 7.669223 354.3293 7.619840 -6.631683      10.81106 
1 1 1 0   16 19 o 145.7021 3.082765 258.8339       10.94567 263.4744       15.98487 254.7372       15.01925 146.8819 4.471062 144.4383 4.271763 2.443604       6.183717 
1 1 1 0   16 20 o 54.17433 3.075621 35.90271       4.043661 36.92162       6.134406 35.11980       5.377296 54.80392 4.636771 53.48848 4.158053 1.315437       6.228086 
1 1 1 0   16 21 o 173.1295 3.328366 365.6147       14.04230 361.3542       20.00805 369.7504       19.71286 171.9519 4.779505 173.9532 4.654485 -2.001221      6.671424 
1 1 1 0   16 22 o 99.58501 3.496209 121.1531       8.471362 119.1818       9.876927 126.6385       16.47600 98.72034 4.114644 101.4699 6.700638 -2.749588      7.863132 
1 1 1 0   16 23 o 245.5406 4.683030 736.6847       28.02118 719.2540       47.05769 746.2607       34.87904 241.8362 7.995961 246.9459 5.795976 -5.109665      9.875664 
1 1 1 0   16 24 o 282.2696 4.563691 973.7139       31.39182 1011.053       45.59533 940.0635       43.28424 287.1867 6.515081 276.9470 6.413529 10.23975       9.142190 
1 1 1 0   16 25 o 103.7127 3.199148 131.4013       8.075748 141.2307       13.41432 125.8137       10.11393 107.3104 5.144672 101.3955 4.101688 5.914955       6.579627 
1 1 1 0   16 26 o 99.15834 2.902799 120.0887       7.006716 113.2833       9.874292 126.9905       9.944060 96.17464 4.223472 101.8618 4.013906 -5.687202      5.826591 
1 1 1 0   16 27 o 103.4849 2.947062 130.8230       7.424373 131.9724       10.62101 129.7247       10.38235 103.8002 4.207583 102.9186 4.148170 0.8815689      5.908559 
1 1 1 0   16 28 o 80.00523 4.287025 78.54016       8.327636 74.19393       14.19081 80.82304       10.28474 77.15670 7.647939 81.02541 5.236827 -3.868706      9.269053 
1 1 1 0   16 29 o 213.9191 3.812758 559.6485       19.87581 559.6555       28.19682 559.6415       28.02130 213.4489 5.425282 213.4570 5.391249 -0.8132935E-02 7.648480 
1 1 1 0   16 30 o 163.3178 3.359361 326.0326       13.36984 333.7140       19.09771 318.6493       18.72347 164.8990 4.757527 161.1270 4.773766 3.772034       6.739652 
1 1 1 0   16 31 o 239.5536 4.141730 703.0789       24.17801 667.9672       33.24916 742.4803       35.22178 232.7817 5.865997 245.4871 5.887712 -12.70537      8.311142 
1 1 1 0   16 32 o 49.46948 3.754364 30.14440       4.492156 30.88472       6.158787 29.30280       6.566535 49.84444 5.144217 48.43234 5.670970 1.412094       7.656557 
1 1 1 0   16 33 o 54.91874 3.607627 37.10896       4.801386 33.92144       6.484049 40.97861       7.144227 52.22279 5.162540 57.44574 5.158282 -5.222950      7.297924 
1 1 1 0   16 34 o 39.64735 4.720096 19.63592       4.470950 12.99201       6.506685 25.57875       6.153816 31.52852 8.341114 45.09549 5.728967 -13.56697      10.11905 
1 1 1 0   16 35 o 22.21724 6.450391 6.305383       3.697466 10.42808       4.935401 1.031419       5.582132 28.26626 7.158600 18.10165 7.567576 10.16461       10.41699 
1 1 1 0   16 36 o 23.74326 7.610732 7.092664       4.984266 6.744092       5.875404 7.987481       9.413656 23.83867 8.276281 27.38549 10.33378 -3.546822      13.23948 
1 1 1 0   16 37 o 90.17601 3.181301 100.2415       6.979928 91.73164       9.456002 110.4289       10.34617 85.74178 4.541831 94.10370 4.524923 -8.361923      6.411174 
1 1 1 0   16 38 f 69.12823 3.767418 59.48875       6.322528 58.40515       7.712708 61.70878       11.03957 68.10622 4.675486 68.90240 6.657617 -0.7961807     8.135357 
1 1 1 0   16 39 o 58.06031 3.623683 42.16694       5.101467 36.28455       6.653644 50.55722       7.946403 53.10871 5.208012 62.73740 5.245633 -9.628693      7.391891 
1 1 1 0   16 40 o 16.58998 7.279757 -0.2822266E-01 5.649632 5.712553       8.377559 -4.816810      7.651311 23.21526 9.442282 16.49684 7.704472 6.718414       12.18670 
1 1 1 0   16 41 o 63.99953 3.586690 51.95265       5.571417 51.62730       7.304987 52.40507       8.614244 62.82908 4.807663 62.43036 5.725909 0.3987198      7.476608 
1 1 1 0   16 42 o 18.08913 6.637804 4.308009       3.832402 9.063880       4.880969 -3.337202      6.188505 24.32900 7.495116 14.71642 6.891159 9.612586       10.18159 
1 1 1 0   16 43 o 22.07324 7.089335 7.675257       4.323209 7.084391       4.973102 9.503146       8.746969 21.14693 7.589595 23.13912 9.555776 -1.992182      12.20307 
1 1 1 0   16 44 o 21.60820 6.512772 7.427254       3.712246 8.800290       5.127281 5.914531       5.381779 22.46087 7.734616 19.31664 7.666939 3.144232       10.89065 
1 1 1 0   16 45 o 14.67605 6.144573 2.399320       3.688414 4.308447       5.165084 0.4126952      5.268874 17.21134 7.242740 14.51758 6.641094 2.693751       9.826567 
1 1 1 0   16 46 o 15.91820 6.688913 3.852224       4.395391 -0.6760782     5.150802 15.98379       8.430737 13.31462 6.251364 23.72194 9.535180 -10.40732      11.40172 
1 1 1 0   16 47 o 16.25612 6.797873 4.896831       4.506181 6.860355       5.658880 1.494102       7.449482 17.66047 7.513039 14.99556 7.176863 2.664917       10.39005 
1 1 1 0   16 48 o 17.44552 6.739915 6.426365       4.066047 4.360665       5.715833 8.542591       5.785314 15.31541 6.971841 18.14392 7.651903 -2.828515      10.35172 
1 1 1 0   17 1  o 513.2349 8.712997 3213.483       108.9732 3067.112       129.2064 3574.165       202.8240 501.2631 10.57748 540.3427 15.41908 -39.07953      18.69842 
1 1 1 0   17 2  o 92.82253 2.861871 105.0954       6.465774 106.9249       9.025154 103.1663       9.267637 93.58168 3.966557 91.91003 4.148499 1.671646       5.739653 
1 1 1 0   17 3  o 225.2117 3.437573 618.1205       18.86596 611.7980       29.52252 622.4846       24.52748 224.0244 5.407816 225.9902 4.453763 -1.965805      7.005746 
1 1 1 0   17 4  o 562.7054 7.348160 3861.584       100.7618 3774.155       156.4575 3923.545       131.7132 555.9255 11.54898 567.0250 9.532156 -11.09949      14.97468 
1 1 1 0   17 5  o 332.7287 4.596454 1349.415       37.26913 1313.406       57.90193 1374.886       48.69796 328.1702 7.240320 335.8127 5.950831 -7.642426      9.372012 
1 1 1 0   17 6  o 427.7213 6.371342 2230.706       66.40914 2069.337       125.8444 2292.988       78.18124 411.3396 12.56918 433.5964 7.399131 -22.25681      14.58532 
1 1 1 0   17 7  o 339.4796 5.206698 1404.919       43.07370 1346.784       83.11713 1426.265       50.36434 331.9814 10.28644 342.0190 6.042780 -10.03754      11.93005 
1 1 1 0   17 8  o 305.6740 4.820508 1138.985       35.90768 1247.652       76.82341 1108.608       40.61758 319.5428 9.877574 301.5490 5.527389 17.99377       11.31894 
1 1 1 0   17 9  o 182.7964 3.065676 407.2157       13.65620 372.4585       21.27595 431.5680       17.80886 174.7219 5.002103 188.1719 3.883696 -13.44994      6.332782 
1 1 1 0   17 10 o 272.0242 3.938946 901.9210       26.11101 910.9379       42.02251 896.2503       33.32497 273.3080 6.309480 271.1383 5.043625 2.169708       8.077604 
1 1 1 0   17 11 o 184.5960 3.068536 415.2868       13.80351 414.0514       22.35623 416.0479       17.54783 184.2201 4.984534 184.7524 3.897600 -0.5322876     6.327469 
1 1 1 0   17 12 o 374.0100 5.667422 1705.843       51.65410 1801.678       76.33053 1624.880       70.15894 384.1991 8.152781 364.8820 7.890318 19.31714       11.34570 
1 1 1 0   17 13 o 168.2233 3.220262 344.9152       13.20120 355.8692       19.81039 336.1657       17.70514 170.7761 4.764908 165.9965 4.380704 4.779602       6.472628 
1 1 1 0   17 14 o 125.4006 2.869558 191.6587       8.769014 191.5801       13.34695 191.7183       11.63175 125.2750 4.378747 125.3487 3.812363 -0.7368469E-01 5.805820 
1 1 1 0   17 15 o 169.7080 2.930469 351.0452       12.11924 355.4869       19.92302 348.4362       15.26922 170.6609 4.795298 169.0584 3.706328 1.602539       6.060672 
1 1 1 0   17 16 o 119.2951 2.949863 173.4747       8.575521 163.1222       12.49333 182.6978       11.79225 115.5644 4.444558 122.3405 3.960618 -6.776108      5.953201 
1 1 1 0   17 17 o 319.3813 5.004887 1244.680       38.95290 1281.272       56.47128 1211.467       53.80111 323.7958 7.156825 314.8706 7.011694 8.925140       10.01918 
1 1 1 0   17 18 o 125.5268 2.971619 192.1077       9.090039 183.5097       13.24580 199.7616       12.49734 122.5592 4.442375 127.9080 4.014411 -5.348770      5.987503 
1 1 1 0   17 19 o 82.06970 2.810526 82.21744       5.612615 92.21685       8.771528 75.28504       7.303477 86.83537 4.157247 78.46435 3.831211 8.371017       5.653396 
1 1 1 0   17 20 o 158.5913 3.191293 306.7590       12.33338 326.8000       18.39441 290.3907       16.62374 163.5357 4.620327 154.1678 4.429448 9.367935       6.400580 
1 1 1 0   17 21 o 227.7977 4.603973 633.7841       25.55749 632.1394       30.97708 637.2902       45.22915 227.3734 5.590682 227.7027 8.164274 -0.3293610     9.895003 
1 1 1 0   17 22 o 251.6423 4.791092 773.8106       29.38016 772.0884       50.00832 774.7184       36.30676 250.5310 8.202202 251.5974 5.921684 -1.066406      10.11644 
1 1 1 0   17 23 o 47.78104 3.338196 27.99615       3.862452 25.17430       5.753636 30.31102       5.211219 45.05256 5.344680 49.62172 4.353612 -4.569157      6.893442 
1 1 1 0   17 24 o 116.4254 2.944505 165.4885       8.347330 163.5156       12.04101 167.3139       11.58217 115.6003 4.281729 116.9606 4.069831 -1.360352      5.907345 
1 1 1 0   17 25 o 129.3805 3.028517 204.2896       9.548493 211.4412       13.87283 197.8518       13.16238 131.4432 4.336963 127.1552 4.253791 4.288040       6.074865 
1 1 1 0   17 26 o 153.3714 3.207372 287.1943       11.98753 278.5408       16.89093 295.9761       17.01563 150.8123 4.601390 155.4826 4.495586 -4.670349      6.432969 
1 1 1 0   17 27 o 206.6878 4.237023 522.5724       21.34085 526.2429       26.83265 516.2539       35.20578 207.1106 5.320897 204.5996 7.071744 2.511078       8.849944 
1 1 1 0   17 28 o 37.96053 5.360652 18.02305       4.821044 42.40008       11.73927 13.07767       5.287502 57.87860 8.582775 31.96438 6.983817 25.91422       11.06516 
1 1 1 0   17 29 o 159.8012 3.308670 312.0734       12.88456 316.1362       18.40113 308.1654       18.04706 160.5262 4.709036 158.4951 4.677675 2.031128       6.637444 
1 1 1 0   17 30 o 68.15324 3.241975 56.90427       5.368900 58.26329       7.650149 55.58526       7.536665 68.77884 4.590631 67.16573 4.633023 1.613113       6.522177 
1 1 1 0   17 31 o 117.6827 3.116992 169.4353       8.931039 168.2165       12.58288 170.6726       12.67846 117.0178 4.420523 117.8699 4.421792 -0.8520966     6.252460 
1 1 1 0   17 32 o 127.7323 3.153436 199.5877       9.815688 197.0960       13.85968 202.0952       13.90338 126.5947 4.499797 128.2032 4.457040 -1.608536      6.333513 
1 1 1 0   17 33 o 48.99751 4.237682 29.71461       5.010172 24.14068       7.403149 34.42482       6.805434 43.43392 7.249785 52.52895 5.392948 -9.095024      9.035666 
1 1 1 0   17 34 o 66.46904 3.377586 54.32098       5.453006 47.16426       7.451577 62.57229       8.001150 61.58095 5.008744 71.07813 4.644790 -9.497181      6.830929 
1 1 1 0   17 35 o 66.26178 3.991398 54.29341       6.415138 50.28469       7.433435 65.99214       12.69860 63.53917 4.837134 71.89210 7.351740 -8.352928      8.800338 
1 1 1 0   17 36 o 91.00527 3.743866 102.3674       8.285040 98.55083       9.718072 112.5218       15.85159 89.01064 4.494796 93.80779 6.984343 -4.797150      8.305675 
1 1 1 0   17 37 o 43.82288 5.241868 24.46218       5.486965 22.92400       7.166676 26.64099       8.529526 41.56897 7.343234 44.48980 8.168267 -2.920830      10.98379 
1 1 1 0   17 38 o 31.59118 5.450453 13.02077       4.044428 9.036097       5.408608 18.07512       6.091457 25.80365 7.878775 36.63629 7.079189 -10.83264      10.59198 
1 1 1 0   17 39 o 46.58274 4.615772 27.78634       5.170863 31.15584       6.142604 19.59140       9.579491 49.02911 5.221408 35.74376 10.38404 13.28534       11.62288 
1 1 1 0   17 40 o 18.86828 7.189053 4.070397       4.582470 -5.086821      7.597081 9.307610       5.745331 16.17051 7.592189 25.33606 8.175855 -9.165545      11.15733 
1 1 1 0   17 41 o 15.75595 6.267242 2.412140       3.603613 -2.395025      4.515792 10.84085       5.979568 13.05982 6.037177 26.43593 8.319900 -13.37611      10.27950 
1 1 1 0   17 42 o 17.62505 6.615539 4.081786       3.846841 4.608732       4.900448 3.235684       6.209604 18.78217 7.358651 18.42209 7.854675 0.3600788      10.76316 
1 1 1 0   17 43 f 14.73193 6.280529 1.641404       3.969236 0.3473398      5.713140 2.848842       5.518608 15.54592 7.034457 17.07421 7.344791 -1.528286      10.17003 
1 1 1 0   17 44 o 16.70346 6.640564 3.898244       4.043613 9.487882       5.111259 -5.452430      6.610855 22.99238 7.725623 13.41406 6.504208 9.578326       10.09901 
1 1 1 0   17 45 o 28.19819 6.162902 12.81346       4.116367 21.00743       5.990022 5.481207       5.666302 34.65956 7.321813 17.94912 7.571431 16.71044       10.53259 
1 1 1 0   17 46 o 15.92200 7.074647 3.814166       5.497515 3.814166       5.497515 0.000000       0.000000 15.92200 7.074647 ?        ?        0.000000       7.074647 
1 1 1 0   17 47 o 15.50139 6.356030 4.251951       3.833869 3.557062       5.287875 5.022049       5.566683 15.13096 6.814354 16.12488 7.144359 -0.9939270     9.873058 
1 1 1 0   18 0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   18 1  o 419.2481 7.272017 2143.697       74.29543 2143.436       128.3524 2143.828       91.11066 418.6351 12.59582 419.1599 8.919764 -0.5248413     15.43428 
1 1 1 0   18 2  o 296.8997 6.647893 1074.919       48.09832 1074.919       48.09832 0.000000       0.000000 296.8997 6.647893 ?        ?        0.000000       6.647893 
1 1 1 0   18 3  o 219.6233 3.397251 587.8352       18.18202 598.5694       28.90837 580.8098       23.38695 221.5844 5.353630 218.2912 4.396440 3.293106       6.927485 
1 1 1 0   18 4  o 230.3883 3.904273 646.9217       21.91980 616.0552       42.10689 658.3959       25.67276 224.5998 7.704618 232.4108 4.532940 -7.811005      8.939166 
1 1 1 0   18 5  o 172.3119 3.766640 361.8729       15.81633 383.2902       27.71390 351.5279       19.26099 177.1749 6.429543 169.7549 4.660488 7.420059       7.940980 
1 1 1 0   18 6  o 355.2814 5.435849 1538.894       47.06261 1516.087       66.06496 1562.392       67.05934 352.5343 7.690130 357.8775 7.689336 -5.343170      10.87492 
1 1 1 0   18 7  o 541.6132 9.128435 3580.510       120.4818 3450.964       203.1700 3650.776       149.6306 530.5823 15.73079 546.6561 11.23234 -16.07379      19.32934 
1 1 1 0   18 8  o 378.9997 5.764762 1751.480       53.24224 1700.799       105.3963 1768.844       61.69263 372.8752 11.61330 380.8272 6.647666 -7.952057      13.38134 
1 1 1 0   18 9  o 273.9576 4.439508 914.9073       29.63837 1017.519       64.16010 887.0706       33.41759 288.5491 9.136014 269.7379 5.083900 18.81119       10.45528 
1 1 1 0   18 10 o 279.3459 4.036454 951.2052       27.47757 888.7628       42.24949 996.9770       36.17268 269.9339 6.422852 285.9484 5.191069 -16.01450      8.258343 
1 1 1 0   18 11 f 169.2249 2.978743 349.0160       12.28382 332.9007       19.62129 359.4032       15.75280 165.1646 4.880352 171.7116 3.764627 -6.547012      6.163623 
1 1 1 0   18 12 o 477.3653 7.055655 2781.047       82.07754 2828.746       118.0423 2736.401       114.2032 481.0399 10.06979 473.1481 9.904788 7.891846       14.12464 
1 1 1 0   18 13 o 199.9454 3.624764 487.3525       17.66149 515.3160       26.06394 463.6111       24.01581 205.4819 5.209318 194.9033 5.060687 10.57858       7.262751 
1 1 1 0   18 14 o 306.4154 4.320826 1144.944       32.26365 1140.822       51.47485 1147.612       41.40653 305.6678 6.910499 306.6910 5.540279 -1.023254      8.857183 
1 1 1 0   18 15 o 126.5884 2.637671 195.3218       8.136744 197.2791       13.75607 194.2684       10.09142 127.1013 4.448139 126.1914 3.284395 0.9098587      5.529303 
1 1 1 0   18 16 o 145.8117 2.758734 259.1742       9.802536 240.0862       15.80707 271.1019       12.49536 140.2044 4.632873 149.1102 3.438788 -8.905762      5.769642 
1 1 1 0   18 17 o 173.3759 3.339600 366.5468       14.10975 373.6020       20.60760 360.3206       19.35926 174.8934 4.839893 171.7721 4.629095 3.121246       6.697245 
1 1 1 0   18 18 o 150.2762 3.148041 275.3912       11.52834 256.6328       16.32819 294.0366       16.27898 144.9239 4.629344 155.1638 4.309444 -10.23993      6.324725 
1 1 1 0   18 19 o 180.9895 3.417027 399.5875       15.07086 412.3285       22.17096 388.6433       20.54824 183.6694 4.958028 178.3375 4.732383 5.331955       6.854013 
1 1 1 0   18 20 o 71.96152 4.356295 63.46118       7.603523 60.49047       9.734881 68.10872       12.17623 70.09694 5.749441 74.26624 6.803498 -4.169296      8.907505 
1 1 1 0   18 21 o 128.5276 4.378714 201.9953       13.69445 191.4951       17.79980 217.2256       21.43724 124.9604 5.861633 132.9926 6.635583 -8.032249      8.853796 
1 1 1 0   18 22 o 152.9893 3.189485 285.5865       11.89098 278.0085       17.05585 292.7534       16.58673 150.7561 4.648164 154.7367 4.403249 -3.980560      6.402658 
1 1 1 0   18 23 o 50.84158 3.261312 31.67569       4.019307 33.90832       6.226017 30.08037       5.262910 52.42686 4.931173 49.41740 4.416802 3.009468       6.620016 
1 1 1 0   18 24 o 16.48669 5.805200 2.914636       2.896843 7.753120       4.719831 -0.9583137E-02 3.669245 24.89880 7.304528 14.21258 6.048136 10.68622       9.483462 
1 1 1 0   18 25 o 109.8552 2.955384 147.3958       7.904529 146.4527       11.49858 148.2408       10.88410 109.3541 4.323441 110.0531 4.065381 -0.6989517     5.934598 
1 1 1 0   18 26 o 126.4922 3.412143 195.5794       10.50825 189.4368       13.45373 205.1897       16.82802 124.3490 4.446971 129.2671 5.353650 -4.918091      6.959678 
1 1 1 0   18 27 o 132.7696 3.692749 215.6425       11.93610 207.4780       22.47155 218.8514       14.08775 129.5215 7.147299 133.6551 4.331055 -4.133621      8.357148 
1 1 1 0   18 28 o 222.2473 4.596986 605.1759       24.89693 615.2188       45.50200 600.8843       29.74447 222.4999 8.407105 221.1890 5.518317 1.310898       10.05640 
1 1 1 0   18 29 o 43.09465 3.889666 22.91093       4.040884 22.85253       5.799773 22.96603       5.633214 42.73645 5.711880 42.88111 5.518614 -0.1446609     7.942334 
1 1 1 0   18 30 o 192.2666 3.641261 452.3994       17.06050 466.8283       24.68214 439.1989       23.60806 194.7964 5.204213 188.9650 5.131507 5.831314       7.308639 
1 1 1 0   18 31 o 48.83759 3.782906 29.39169       4.467031 30.35345       6.213554 28.36289       6.426497 49.38514 5.243090 47.63852 5.645401 1.746620       7.704579 
1 1 1 0   18 32 o 71.46008 3.592725 62.72572       6.236317 58.22597       9.730561 65.86241       8.124177 68.36951 5.897962 73.04747 4.587078 -4.677963      7.471763 
1 1 1 0   18 33 o 57.92443 3.530301 41.30089       4.959550 36.46758       6.860625 46.59150       7.177850 54.06634 5.274134 61.27327 4.846591 -7.206928      7.162816 
1 1 1 0   18 34 o 31.72400 5.266950 12.79665       3.929043 8.399068       5.347515 17.95581       5.792086 25.64547 7.834867 37.35508 6.604343 -11.70961      10.24707 
1 1 1 0   18 35 o 36.94917 5.602561 17.41261       4.886583 15.51349       5.566743 23.79082       10.20173 34.47186 6.868040 41.70771 10.13769 -7.235855      12.24511 
1 1 1 0   18 36 o 71.79060 3.356133 63.67683       5.855166 62.63161       8.194900 64.76688       8.368748 70.69698 4.784901 71.88881 4.804669 -1.191833      6.780864 
1 1 1 0   18 37 o 70.39722 3.424526 61.47421       5.857161 56.21274       7.879802 67.97058       8.755836 66.69957 4.881737 73.35070 4.927012 -6.651131      6.935907 
1 1 1 0   18 38 o 31.83003 7.241413 13.92231       5.489881 8.382566       6.661747 25.64704       9.691586 25.15985 8.807713 41.91919 9.682478 -16.75934      13.08916 
1 1 1 0   18 39 f 20.27502 6.552287 5.477698       3.689211 5.453968       4.909255 5.508484       5.591792 20.81372 7.531514 21.28437 7.978778 -0.4706497     10.97199 
1 1 1 0   18 40 o 39.76333 5.616659 21.33345       5.291103 23.98038       9.558455 20.16405       6.353279 38.26293 10.10357 37.51837 7.210850 0.7445602      12.41284 
1 1 1 0   18 41 o 13.07624 5.724177 0.7707619E-01  3.474454 1.035928       4.465020 -1.394726      5.531876 15.30521 6.595425 14.95354 6.826950 0.3516674      9.492464 
1 1 1 0   18 42 o 12.52166 5.763255 -1.534781      4.051581 4.184287       5.733600 -7.238719      5.726010 18.56234 7.707577 12.21675 5.953084 6.345584       9.738889 
1 1 1 0   18 43 f 24.39978 6.437789 9.324596       3.882692 7.072711       5.401649 11.73181       5.584843 20.55702 7.811684 25.73268 8.032271 -5.175665      11.20445 
1 1 1 0   18 44 o 15.30602 6.099127 3.091078       3.418821 4.151077       4.926298 2.106217       4.748490 17.09644 7.125342 15.31282 6.697833 1.783624       9.779135 
1 1 1 0   18 45 o 21.73263 7.130163 8.834513       4.360054 8.671243       5.482985 9.115320       7.190645 20.48064 7.848874 20.00097 8.487342 0.4796696      11.56027 
1 1 1 0   18 46 o 19.06285 7.717181 8.253506       5.565779 8.253506       5.565779 0.000000       0.000000 19.06285 7.717181 ?        ?        0.000000       7.717181 
1 1 1 0   18 47 o 11.04427 5.244946 -1.352316      3.822102 -5.062323      5.507752 2.093856       5.308300 11.25430 5.554793 14.07540 6.520257 -2.821101      8.565598 
1 1 1 0   19 1  o 179.5529 3.418700 392.9123       14.95855 380.2986       20.68342 406.7445       21.65947 176.5610 4.811680 182.5985 4.871950 -6.037537      6.847493 
1 1 1 0   19 2  o 513.5898 8.727935 3219.056       109.2355 3122.545       184.9871 3270.725       135.3542 504.8209 15.05406 517.4849 10.73341 -12.66406      18.48866 
1 1 1 0   19 3  o 164.0293 3.749593 327.9284       14.98794 315.2703       24.99999 335.0307       18.72646 160.6595 6.398333 165.7180 4.641707 -5.058548      7.904688 
1 1 1 0   19 4  o 200.4257 3.235940 489.5673       15.80484 505.0124       25.28118 479.6581       20.24977 203.4643 5.102886 198.3717 4.188942 5.092621       6.602021 
1 1 1 0   19 5  o 113.0664 2.669129 155.7914       7.354264 169.5822       11.67480 146.7191       9.469151 117.8819 4.070223 109.6608 3.548098 8.221153       5.399603 
1 1 1 0   19 6  o 428.9284 5.741103 2243.442       60.00898 2231.287       94.50957 2251.653       77.67628 427.5151 9.071689 429.6002 7.419725 -2.085052      11.71955 
1 1 1 0   19 7  o 244.9931 4.788490 731.7515       28.58832 790.0803       52.10396 706.6284       34.19519 254.2790 8.420222 240.7175 5.829366 13.56149       10.24117 
1 1 1 0   19 8  o 303.6691 4.814756 1124.289       35.62961 1232.566       53.07042 1035.437       48.07489 317.8544 6.851541 291.3341 6.771595 26.52029       9.633177 
1 1 1 0   19 9  o 255.3504 4.236215 794.8911       26.36032 805.4135       54.21628 791.6336       30.16594 256.6734 8.680367 254.8055 4.858160 1.867874       9.947387 
1 1 1 0   19 10 o 295.6909 4.233642 1065.944       30.50620 1012.321       47.24352 1104.293       39.95196 288.0295 6.730838 300.9054 5.448438 -12.87592      8.659657 
1 1 1 0   19 11 o 170.8975 3.327026 356.0035       13.85569 353.7637       20.43138 357.9108       18.85341 170.2465 4.929933 171.2657 4.521300 -1.019180      6.689274 
1 1 1 0   19 12 o 120.5426 2.689416 177.1003       7.900136 161.1884       12.88752 186.6791       9.999186 114.8737 4.613142 123.7052 3.319963 -8.831482      5.683593 
1 1 1 0   19 13 o 154.1390 2.866009 289.6039       10.76530 287.1669       17.68635 291.0382       13.56828 153.3632 4.738080 154.5023 3.603742 -1.139160      5.952844 
1 1 1 0   19 14 o 223.0754 3.455005 606.7354       18.78177 578.9072       29.62929 625.4286       24.28400 217.7110 5.589386 226.4388 4.400816 -8.727844      7.113959 
1 1 1 0   19 15 o 246.5605 3.687716 741.3710       22.15731 747.1107       35.85563 737.8251       28.18243 247.3388 5.948796 245.9024 4.703050 1.436401       7.583327 
1 1 1 0   19 16 o 76.30209 2.581062 71.05467       4.792315 71.33939       8.450545 70.91970       5.818402 76.32208 4.564436 76.19942 3.140129 0.1226578      5.540260 
1 1 1 0   19 17 o 220.6042 3.837911 593.7382       20.63217 587.9833       29.47544 599.2667       28.88994 219.3124 5.519583 221.4938 5.352407 -2.181366      7.688566 
1 1 1 0   19 18 o 287.7954 4.633903 1011.373       32.49877 1018.557       46.58405 1004.561       45.36076 288.4911 6.626265 286.5266 6.496498 1.964508       9.279648 
1 1 1 0   19 19 o 77.35156 4.495853 73.31473       8.438039 82.54751       11.34841 61.89911       12.61881 81.96060 5.717760 70.67135 7.438631 11.28925       9.382218 
1 1 1 0   19 20 o 120.7483 4.403630 178.3170       12.93600 197.7528       17.94600 157.2958       18.66363 126.9972 5.814217 113.0923 6.803617 13.90482       8.949543 
1 1 1 0   19 21 o 44.52069 3.459554 24.33561       3.723903 30.68825       6.336242 20.98351       4.602707 49.81218 5.301213 41.17593 4.669393 8.636253       7.064424 
1 1 1 0   19 22 o 129.0593 3.019942 203.2295       9.497824 191.0366       13.63016 214.7381       13.24214 124.9441 4.483880 132.5224 4.105416 -7.578262      6.079442 
1 1 1 0   19 23 o 132.1320 3.080075 213.0697       9.917572 204.0989       14.26634 221.4595       13.79658 129.1196 4.541098 134.5487 4.213001 -5.429016      6.194428 
1 1 1 0   19 24 o 165.7369 3.346769 335.3947       13.51703 354.3044       20.06755 319.6900       18.28806 170.0814 4.846682 161.5867 4.649194 8.494751       6.716050 
1 1 1 0   19 25 o 44.92870 3.944287 24.86301       4.274673 20.64894       6.105609 28.91461       5.986746 40.51458 6.396165 48.30971 5.165413 -7.795135      8.221461 
1 1 1 0   19 26 o 109.2051 3.016197 145.7234       8.019045 146.2801       11.70393 145.2308       11.00922 109.2381 4.405683 108.8811 4.156869 0.3570328      6.057195 
1 1 1 0   19 27 o 156.3178 3.858829 298.8619       14.69942 292.4937       27.29443 301.4635       17.44545 153.7267 7.306907 156.8118 4.570152 -3.085159      8.618422 
1 1 1 0   19 28 o 91.90845 3.048208 103.3069       6.817654 99.20834       9.704112 107.3015       9.580318 89.87563 4.444542 93.51455 4.214852 -3.638916      6.125270 
1 1 1 0   19 29 o 75.79411 3.148026 70.33736       5.801808 68.16378       8.315540 72.39909       8.098745 74.40422 4.608866 76.73216 4.348964 -2.327942      6.336808 
1 1 1 0   19 30 o 22.47508 6.233414 6.428845       3.533217 4.706639       5.126522 7.987040       4.876308 21.24898 7.695350 25.14732 7.437167 -3.898340      10.70186 
1 1 1 0   19 31 o 18.21562 6.677524 3.332889       3.876874 1.307091       5.721835 5.052218       5.271291 18.64271 7.716593 21.74814 7.812785 -3.105431      10.98114 
1 1 1 0   19 32 o 76.82220 3.201795 72.39790       5.980856 77.49548       8.602800 67.62920       8.320668 79.23554 4.473540 73.96626 4.639610 5.269279       6.445040 
1 1 1 0   19 33 o 109.6576 3.140958 147.4990       8.384730 139.6119       11.69701 155.8352       12.02541 106.3006 4.525828 112.3590 4.400441 -6.058449      6.312448 
1 1 1 0   19 34 o 26.53627 5.924770 9.134947       3.734279 5.505992       5.138816 13.19551       5.435826 21.93908 7.731322 31.70912 7.199680 -9.770037      10.56450 
1 1 1 0   19 35 o 61.91027 4.133880 47.66410       6.200992 47.87878       7.237123 47.07125       12.02682 61.82008 4.842593 59.65146 8.514955 2.168613       9.795671 
1 1 1 0   19 36 o 35.59149 5.463211 16.31738       4.587241 14.60605       5.684373 19.51288       7.767572 33.01216 7.263540 37.69593 8.640882 -4.683773      11.28822 
1 1 1 0   19 37 o 48.03852 4.832726 29.40432       5.580621 32.45433       6.509986 20.95091       10.83790 50.22462 5.403889 37.32822 11.09962 12.89640       12.34519 
1 1 1 0   19 38 o 48.26292 4.022796 29.48874       4.688284 27.22474       6.359597 32.18380       6.938653 45.41322 5.884846 49.42929 5.875245 -4.016064      8.315643 
1 1 1 0   19 39 o 36.27582 5.433067 17.54181       4.655225 12.30178       6.905392 21.90716       6.302765 28.49517 8.937032 39.75711 6.746399 -11.26194      11.19752 
1 1 1 0   19 40 o 18.41591 7.083677 4.062850       4.477324 0.3579937      7.717068 5.942761       5.497123 18.45343 8.277802 20.98360 7.901398 -2.530170      11.44352 
1 1 1 0   19 41 o 43.35386 4.837158 25.41555       5.023429 14.81684       7.500775 34.03573       6.764535 28.90424 9.343002 49.28177 5.740003 -20.37753      10.96537 
1 1 1 0   19 42 o 40.92200 4.519882 22.81455       4.432319 18.17586       6.059952 28.15074       6.499609 33.39642 7.615611 43.46571 6.321405 -10.06929      9.897358 
1 1 1 0   19 43 o 24.31207 6.361631 9.364974       3.811835 5.132577       5.322655 13.82110       5.461524 18.39547 7.509630 28.10947 7.732127 -9.714003      10.77870 
1 1 1 0   19 44 o 24.46163 6.686718 10.18236       4.099187 9.663487       5.870235 10.67617       5.726682 21.75519 8.170875 22.93909 8.154217 -1.183893      11.54359 
1 1 1 0   19 45 o 15.11988 6.446347 3.217672       4.182082 -1.084693      5.258984 10.61874       6.897562 13.08376 6.195585 20.68660 8.508444 -7.602840      10.52516 
1 1 1 0   19 46 o 23.89247 8.389991 14.12972       6.047897 14.12972       6.047897 0.000000       0.000000 23.89247 8.389991 ?        ?        0.000000       8.389991 
1 1 1 0   20 0  o 420.6141 12.69280 2161.873       129.9512 0.000000       0.000000 2161.873       129.9512 ?        ?        420.6141 12.69280 0.000000       12.69280 
1 1 1 0   20 1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   20 2  o 327.7796 5.121422 1309.956       40.90804 1328.158       58.18935 1292.170       57.52182 329.9404 7.237223 325.4388 7.253160 4.501617       10.24625 
1 1 1 0   20 3  o 212.3148 4.313047 549.5087       22.31519 611.6597       40.54866 522.5077       26.72650 223.7707 7.446332 206.9398 5.304203 16.83095       9.142343 
1 1 1 0   20 4  o 170.1440 4.666633 353.1969       19.33063 377.6081       27.82199 330.4146       26.87773 175.8236 6.504654 164.4388 6.721533 11.38477       9.353584 
1 1 1 0   20 5  o 323.3451 5.085078 1274.827       40.06821 1171.807       76.40284 1313.909       47.05872 309.5088 10.14349 328.2241 5.883470 -18.71530      11.72628 
1 1 1 0   20 6  o 238.7347 3.614842 694.7117       21.03008 711.7661       33.49885 683.6182       27.01753 241.5784 5.690307 236.7900 4.682160 4.788467       7.369003 
1 1 1 0   20 7  o 307.4838 4.347611 1152.684       32.57684 1143.853       51.11754 1158.723       42.27346 306.1680 6.851316 308.2260 5.628109 -2.057983      8.866574 
1 1 1 0   20 8  o 435.7679 6.502181 2317.129       69.04787 2247.730       95.88421 2391.882       99.51379 428.8829 9.174285 442.4139 9.230355 -13.53094      13.01411 
1 1 1 0   20 9  o 335.7551 6.009977 1375.465       49.17355 1431.753       88.52972 1350.350       59.13465 341.8915 10.63882 332.5673 7.296700 9.324249       12.90063 
1 1 1 0   20 10 o 256.2162 4.255913 800.4890       26.57269 860.4648       56.40998 783.3848       30.12438 265.1690 8.741603 253.4335 4.877733 11.73552       10.01039 
1 1 1 0   20 11 o 108.9095 3.574300 144.7677       9.473367 136.0380       16.70439 148.9065       11.50188 105.3542 6.538658 110.4172 4.282728 -5.062996      7.816381 
1 1 1 0   20 12 o 271.2600 3.966365 897.3220       26.21890 863.2829       41.09632 920.6870       34.04842 265.8887 6.342596 274.6934 5.086424 -8.804718      8.130205 
1 1 1 0   20 13 o 177.5304 3.397018 384.2915       14.69626 366.7890       30.19285 389.7258       16.82373 173.0804 7.174022 178.7626 3.861974 -5.682220      8.147481 
1 1 1 0   20 14 o 125.7607 2.707770 192.8058       8.298370 180.8625       13.52204 200.0214       10.51031 121.6600 4.569101 128.0299 3.371680 -6.369896      5.678461 
1 1 1 0   20 15 o 215.2253 3.381486 564.9294       17.73524 530.2495       27.69477 589.0380       23.09106 208.2888 5.460980 219.7061 4.312864 -11.41730      6.958671 
1 1 1 0   20 16 o 158.6067 2.877122 306.7473       11.12028 288.7300       17.79465 318.2922       14.24423 153.7034 4.756560 161.5279 3.618723 -7.824493      5.976623 
1 1 1 0   20 17 o 190.6699 3.576490 443.5559       16.61786 435.1708       23.54194 451.8832       23.46069 188.6578 5.125472 192.2634 5.011623 -3.605576      7.168460 
1 1 1 0   20 18 o 104.6744 3.363729 133.8135       8.569061 132.8269       14.68050 134.3233       10.55346 104.0464 5.813104 104.8111 4.140062 -0.7646942     7.136686 
1 1 1 0   20 19 f 164.7837 2.924920 331.2095       11.74530 303.5821       18.55206 349.6903       15.17343 157.5406 4.838144 169.2655 3.678571 -11.72496      6.077788 
1 1 1 0   20 20 o 12.43228 5.218206 0.2466015      2.670330 2.254660       5.381858 -0.4092085     3.075623 19.16110 7.646702 12.61660 5.455520 6.544497       9.393335 
1 1 1 0   20 21 o 147.0440 3.221512 263.8680       11.54365 242.2072       16.13944 286.5555       16.51750 140.6746 4.714664 153.0637 4.432961 -12.38908      6.471414 
1 1 1 0   20 22 o 154.6725 3.244250 292.0147       12.22823 281.1701       17.58558 302.1672       17.01518 151.5433 4.767873 157.1534 4.447476 -5.610184      6.520174 
1 1 1 0   20 23 o 17.49228 5.777428 3.571033       2.860842 0.6806139      5.186972 4.834713       3.429667 17.44383 7.293846 19.98706 6.302433 -2.543232      9.639546 
1 1 1 0   20 24 o 51.05716 3.618970 32.00671       4.473567 25.75481       6.350245 38.16628       6.303175 45.44664 5.870969 55.64735 4.691803 -10.20070      7.515404 
1 1 1 0   20 25 o 121.4091 3.049461 180.0913       9.015020 170.5059       12.99576 188.9821       12.51609 117.9360 4.530306 124.2309 4.140091 -6.294876      6.137103 
1 1 1 0   20 26 o 147.3611 3.783801 265.7079       13.57650 248.8799       25.04230 272.7128       16.15699 141.8078 7.270933 149.1726 4.449601 -7.364761      8.524401 
1 1 1 0   20 27 o 64.82360 3.270065 51.48002       5.148973 52.93980       7.805068 50.35521       6.851297 65.51663 4.924697 63.96458 4.422616 1.552055       6.619077 
1 1 1 0   20 28 o 19.23398 6.329572 4.369195       3.434878 0.9662316      5.099481 7.195364       4.647254 17.49808 7.267545 24.02904 7.296474 -6.530966      10.29834 
1 1 1 0   20 29 o 26.53919 5.891662 9.021351       3.710941 7.103108       5.432474 10.69957       5.081241 24.30621 7.957996 28.81468 7.244925 -4.508478      10.76191 
1 1 1 0   20 30 o 33.09655 5.092914 13.78684       3.976080 14.01611       5.885590 13.59436       5.392734 32.91943 7.504100 32.48592 7.017444 0.4335060      10.27405 
1 1 1 0   20 31 o 52.96827 3.701400 34.56989       4.747622 32.45606       6.821587 36.55561       6.611637 50.94727 5.585989 54.22075 5.062399 -3.273479      7.538645 
1 1 1 0   20 32 o 108.5781 3.137243 144.5580       8.292218 140.2777       11.82773 148.6955       11.62874 106.5813 4.564480 109.8031 4.354557 -3.221855      6.308458 
1 1 1 0   20 33 o 119.5527 3.168205 175.4815       9.222013 180.5467       13.24138 170.7104       12.85117 120.8014 4.505955 117.4634 4.497871 3.338013       6.366669 
1 1 1 0   20 34 o 14.29015 6.002934 0.5042807      3.538368 8.938994       5.000295 -7.955536      5.007730 26.10436 7.477647 11.72904 5.680941 14.37533       9.390862 
1 1 1 0   20 35 o 45.82781 5.648195 26.84984       6.174445 26.84984       6.174445 0.000000       0.000000 45.82781 5.648195 ?        ?        0.000000       5.648195 
1 1 1 0   20 36 o 27.34958 6.121419 9.937916       3.977843 7.265513       5.345454 13.25430       5.954785 23.69289 7.899682 31.07151 7.860018 -7.378622      11.14383 
1 1 1 0   20 37 o 33.63598 5.124403 14.71821       4.067816 17.39372       5.540384 11.58917       5.991596 35.95782 6.564630 28.66866 8.176745 7.289158       10.48587 
1 1 1 0   20 38 o 12.77415 5.650700 -0.6129299     3.468771 1.545112       4.675207 -3.255766      5.173757 16.54053 6.921021 13.87142 6.429703 2.669111       9.446777 
1 1 1 0   20 39 f 39.30099 4.539732 20.19625       4.267975 22.70666       5.996698 17.61925       6.075733 40.52682 6.274636 34.82120 7.389105 5.705624       9.693809 
1 1 1 0   20 40 o 31.32772 8.087565 15.45767       6.216368 0.000000       0.000000 15.45767       6.216368 ?        ?        31.32772 8.087565 0.000000       8.087565 
1 1 1 0   20 41 o 8.833093 4.368314 -6.767596      3.465652 -5.497073      4.758885 -8.202306      5.057035 11.52540 5.571605 10.95124 5.389304 0.5741692      7.751605 
1 1 1 0   20 42 o 19.46965 6.577985 5.915751       3.705385 12.96872       5.567396 0.3072530      4.964658 27.32187 7.910078 14.64447 6.598371 12.67739       10.30087 
1 1 1 0   20 43 o 18.59045 6.548717 5.606599       3.686689 5.918673       5.431836 5.340052       5.020014 18.80224 7.619368 18.23137 7.347432 0.5708618      10.58487 
1 1 1 0   20 44 o 16.23505 6.645016 4.078712       4.181043 2.322637       5.471995 6.542130       6.481019 15.40052 6.934192 18.44871 7.948027 -3.048197      10.54771 
1 1 1 0   20 45 f 13.79780 5.991990 2.201654       3.742732 3.699001       5.450654 0.8658093      5.148319 15.67003 6.998282 13.81370 6.406729 1.856334       9.487999 
1 1 1 0   20 46 o 9.259172 4.626707 -7.490013      4.312048 -6.374634      5.576363 -9.148865      6.800545 10.98142 5.450104 11.34441 5.689237 -0.3629827     7.878519 
1 1 1 0   21 1  o 208.1490 4.297256 528.2135       21.79725 558.6107       27.34368 475.2251       36.10190 214.0237 5.242746 197.1704 7.527500 16.85336       9.173311 
1 1 1 0   21 2  o 162.1401 3.312828 320.4359       13.08957 297.8211       17.72941 347.5331       19.40703 156.2173 4.662463 168.7596 4.723694 -12.54237      6.637156 
1 1 1 0   21 3  f 220.2876 4.501846 591.6701       24.16667 605.4904       42.24512 584.9474       29.46390 222.5593 7.801297 218.9256 5.527199 3.633743       9.560866 
1 1 1 0   21 4  o 177.7714 4.022158 385.2779       17.42437 330.8599       28.03108 419.5459       22.24403 164.4966 7.008793 185.4175 4.927332 -20.92085      8.567484 
1 1 1 0   21 5  o 173.1615 3.431105 365.5073       14.47843 364.6902       29.08518 365.7765       16.69378 172.7156 6.924450 173.2130 3.954923 -0.4974060     7.974298 
1 1 1 0   21 6  o 95.82735 3.520841 112.0935       8.207919 98.08361       14.24296 119.0595       10.04330 89.40472 6.583555 98.72834 4.183928 -9.323616      7.800542 
1 1 1 0   21 7  o 344.0529 6.157381 1444.611       51.62467 1403.156       88.68253 1465.859       63.49145 338.3557 10.76916 346.4378 7.520624 -8.082153      13.13524 
1 1 1 0   21 8  o 397.4555 6.953909 1929.074       67.35249 1912.249       116.9072 1937.432       82.40191 394.6317 12.17118 398.0982 8.493974 -3.466583      14.84201 
1 1 1 0   21 9  o 365.1354 5.618680 1627.068       49.99474 1608.020       99.84703 1633.442       57.75644 361.9350 11.33455 365.7538 6.480008 -3.818787      13.05613 
1 1 1 0   21 10 o 489.7886 7.267745 2931.560       86.74500 2786.990       168.6293 2983.582       101.1553 475.2416 14.57795 493.8709 8.405024 -18.62936      16.82739 
1 1 1 0   21 11 o 359.4970 5.552010 1577.697       48.63866 1493.575       94.94855 1607.625       56.63374 348.5925 11.19173 362.7765 6.406191 -14.18402      12.89551 
1 1 1 0   21 12 o 56.33359 3.121528 38.81163       4.268442 35.02522       7.579631 40.57010       5.165372 53.22164 5.945638 57.55732 3.702324 -4.335674      7.004128 
1 1 1 0   21 13 o 149.4783 2.858403 272.4204       10.41209 261.2584       16.81012 279.3682       13.26245 146.2275 4.723630 151.3444 3.596014 -5.116913      5.936666 
1 1 1 0   21 14 o 122.0060 3.600801 181.7357       10.69402 161.6557       18.52461 191.7724       13.09673 114.7707 6.651917 125.2807 4.296213 -10.50996      7.918677 
1 1 1 0   21 15 o 94.75136 3.097581 109.6096       7.142663 100.7867       10.21857 118.0387       9.987881 90.73565 4.636803 98.25303 4.181049 -7.517380      6.243485 
1 1 1 0   21 16 o 120.4304 3.099412 177.0182       9.088466 166.2443       12.86384 187.7559       12.84224 116.5896 4.536329 123.9402 4.258320 -7.350609      6.221862 
1 1 1 0   21 17 o 157.6238 3.779281 303.2397       14.51667 315.8366       25.58414 297.2585       17.62939 160.4597 6.556689 155.9255 4.644814 4.534180       8.035202 
1 1 1 0   21 18 o 139.0856 2.760040 235.9362       9.354779 234.3655       15.53154 236.8305       11.71891 138.4247 4.610746 139.3105 3.451973 -0.8858032     5.759783 
1 1 1 0   21 19 o 109.3097 2.590455 145.7234       6.900343 131.9237       11.40272 153.6969       8.667551 103.8088 4.518346 112.1894 3.173547 -8.380638      5.521490 
1 1 1 0   21 20 f 170.9471 2.983945 356.5547       12.43050 375.2620       20.93694 346.3708       15.44780 175.1010 4.911542 168.4198 3.763893 6.681137       6.187902 
1 1 1 0   21 21 o 251.8007 4.245912 774.9016       26.05338 765.2247       37.13188 784.2852       36.56475 249.8187 6.099383 252.9538 5.931784 -3.135147      8.508145 
1 1 1 0   21 22 o 189.4450 3.585505 438.3402       16.55273 453.9711       24.40413 425.0219       22.52662 192.4689 5.207940 186.2753 4.966981 6.193680       7.196773 
1 1 1 0   21 23 o 68.86457 3.366612 58.05378       5.632574 56.22848       8.111125 59.75377       7.827755 67.58360 4.959507 69.72484 4.633236 -2.141243      6.787015 
1 1 1 0   21 24 o 70.94672 3.081968 61.57520       5.315685 71.38940       8.571775 55.44246       6.775954 76.22243 4.636724 67.19868 4.158209 9.023743       6.228154 
1 1 1 0   21 25 o 35.49305 5.130986 15.76174       4.309291 8.601351       9.742687 17.50330       4.804854 28.92996 10.58874 37.38533 5.432940 -8.455374      11.90119 
1 1 1 0   21 26 o 95.89333 3.515950 112.5654       8.202219 120.1316       16.51968 110.0899       9.449235 98.42482 6.931823 94.75179 4.102072 3.673035       8.054636 
1 1 1 0   21 27 o 58.14598 3.513166 41.49735       4.954773 42.13745       7.618301 41.02812       6.522777 58.30445 5.424134 57.65170 4.683141 0.6527481      7.166103 
1 1 1 0   21 28 o 58.21312 3.529657 41.61631       4.983608 38.07262       7.619145 44.26609       6.588443 55.30239 5.736857 59.89425 4.547999 -4.591854      7.320917 
1 1 1 0   21 29 o 19.06196 6.467690 4.182472       3.582374 12.81118       5.810112 -1.109809      4.550227 31.46087 7.652773 14.84812 6.523723 16.61275       10.05604 
1 1 1 0   21 30 o 24.11286 6.662148 7.447846       4.044509 7.354414       6.859309 7.497643       5.007640 25.45814 8.935467 24.50138 7.599233 0.9567547      11.72992 
1 1 1 0   21 31 o 61.83601 3.455879 47.03062       5.186863 50.66172       7.805865 44.15976       6.940772 63.85447 5.057698 59.64605 4.816104 4.208427       6.983922 
1 1 1 0   21 32 f 16.34608 6.274854 2.307580       3.508347 3.697255       5.193295 1.140958       4.758298 20.05744 7.650535 16.98425 7.034157 3.073196       10.39279 
1 1 1 0   21 33 o 11.54240 5.325162 -2.634374      3.488286 -8.382479      4.987937 2.868078       4.880190 11.53732 5.607065 18.74790 7.343958 -7.210587      9.239745 
1 1 1 0   21 34 o 14.25469 6.479659 -2.577300      4.915147 -2.577300      4.915147 0.000000       0.000000 14.25469 6.479659 ?        ?        0.000000       6.479659 
1 1 1 0   21 35 o 37.46781 4.770755 17.86736       4.257284 24.28378       6.056369 11.59987       5.985671 43.33406 5.887296 29.14100 8.124973 14.19306       10.03372 
1 1 1 0   21 36 o 57.06621 3.622192 40.70044       5.011174 34.99720       6.865436 47.20378       7.331213 52.05202 5.495307 60.81038 4.991115 -8.758358      7.423586 
1 1 1 0   21 37 o 27.80165 5.823520 10.41159       3.818827 12.21439       5.379126 8.579662       5.422407 29.41259 7.486824 24.78725 7.937469 4.625336       10.91128 
1 1 1 0   21 38 o 36.32777 4.851610 17.34787       4.187695 19.65447       5.928304 15.05060       5.916304 37.53069 6.729186 32.13450 7.663244 5.396191       10.19839 
1 1 1 0   21 39 o 39.95284 4.765887 21.19983       4.548715 28.10248       6.418889 14.23678       6.446910 45.05184 5.995398 30.02659 8.454045 15.02526       10.36415 
1 1 1 0   21 40 o 36.19207 7.317943 20.06135       6.232025 0.000000       0.000000 20.06135       6.232025 ?        ?        36.19207 7.317943 0.000000       7.317943 
1 1 1 0   21 41 o 11.31857 5.291891 -2.181584      3.626019 -6.638946      5.811130 0.6604140      4.640166 12.40813 6.035251 14.67840 6.512095 -2.270267      8.878718 
1 1 1 0   21 42 o 18.35327 6.501591 5.271344       3.637873 4.089028       5.457051 6.217047       4.880547 17.54325 7.416788 19.39597 7.412107 -1.852724      10.48561 
1 1 1 0   21 43 o 16.22408 6.576667 3.857502       4.048338 9.258791       5.219445 -4.298526      6.413793 21.84087 7.782523 13.25770 6.423215 8.583172       10.09086 
1 1 1 0   21 44 o 11.94264 5.460491 -0.8252481E-01 3.556295 1.256305       5.102622 -1.347134      4.959168 14.23082 6.519506 12.69997 6.014597 1.530855       8.870137 
1 1 1 0   21 45 o 15.28957 6.373868 3.888594       3.943417 4.251374       5.809698 3.578661       5.369897 15.85343 7.140942 15.34429 6.892349 0.5091410      9.924592 
1 1 1 0   22 0  f 218.3322 5.435092 581.1869       28.91751 540.8939       39.07433 629.9777       42.99769 210.4255 7.632680 227.1042 7.780828 -16.67865      10.89950 
1 1 1 0   22 1  o 184.1674 4.044904 413.5589       18.15336 416.9168       22.13543 406.6615       31.72478 184.8172 4.919214 182.3495 7.153214 2.467697       8.681424 
1 1 1 0   22 2  o 223.6811 4.539750 610.1785       24.74557 641.3680       43.57864 595.3359       30.06236 228.9910 7.820907 220.8219 5.591062 8.169067       9.613873 
1 1 1 0   22 3  o 135.5196 3.171364 223.8757       10.47332 239.7332       21.31827 218.8306       12.02448 140.0057 6.264283 133.9225 3.687993 6.083176       7.269287 
1 1 1 0   22 4  o 132.6955 2.829810 214.6256       9.150601 200.4265       13.55683 226.5086       12.40196 128.1248 4.348293 136.2492 3.738788 -8.124466      5.734648 
1 1 1 0   22 5  o 408.0146 7.125303 2033.484       70.84597 2001.335       85.80879 2102.323       125.5649 404.5285 8.704556 413.6182 12.47180 -9.089691      15.20904 
1 1 1 0   22 6  o 185.8708 4.027573 421.3035       18.24277 402.1316       21.79820 466.1213       33.32829 181.4874 4.933340 195.2149 7.017319 -13.72745      8.577914 
1 1 1 0   22 7  o 258.6336 4.937357 816.1401       31.11828 800.5482       37.66901 849.6470       55.22058 256.0654 6.036667 263.3858 8.615037 -7.320465      10.51952 
1 1 1 0   22 8  o 309.9456 4.915536 1172.213       37.12723 1171.876       52.24286 1172.557       52.77282 309.6807 6.922719 309.7619 6.991111 -0.8120728E-01 9.838682 
1 1 1 0   22 9  o 112.5850 3.004230 154.6431       8.234958 153.0455       11.25576 156.4833       12.07984 111.9363 4.133466 113.1706 4.388491 -1.234344      6.028631 
1 1 1 0   22 10 o 186.3690 4.139811 423.7264       18.80141 427.5119       33.13184 421.9284       22.83409 186.8189 7.291607 185.8499 5.046466 0.9690857      8.867601 
1 1 1 0   22 11 o 79.10702 3.721643 76.50111       7.154291 55.97195       12.33400 86.91050       8.782759 67.19118 7.670005 84.28658 4.290098 -17.09540      8.788283 
1 1 1 0   22 12 o 262.5295 5.089377 841.6722       32.55959 754.3776       53.67588 892.4931       40.95494 247.8112 8.902836 270.1888 6.220179 -22.37756      10.86053 
1 1 1 0   22 13 o 103.2540 3.110733 130.1416       7.818259 132.3291       11.36012 128.1730       10.77634 104.0165 4.492310 102.3810 4.329096 1.635521       6.238743 
1 1 1 0   22 14 o 78.29563 3.246174 74.90392       6.180197 73.81608       9.232467 75.78715       8.318974 77.58252 4.908513 78.66872 4.356430 -1.086197      6.562925 
1 1 1 0   22 15 o 130.8385 2.761108 208.7633       8.803493 201.7480       14.63126 212.7444       11.02187 128.4322 4.682734 132.0047 3.429239 -3.572540      5.804108 
1 1 1 0   22 16 o 246.9339 4.141051 744.5237       24.91882 759.8277       51.12459 739.7549       28.53829 248.4953 8.454900 246.0591 4.759403 2.436264       9.702435 
1 1 1 0   22 17 o 144.9795 2.822601 256.3751       9.972225 257.8229       16.64338 255.5642       12.45561 145.1765 4.710690 144.7070 3.532152 0.4694824      5.887843 
1 1 1 0   22 18 o 165.3854 2.971648 333.6950       11.97651 334.2664       19.73655 333.3620       15.06783 165.2747 4.905797 165.2416 3.741925 0.3306580E-01  6.169996 
1 1 1 0   22 19 o 130.5363 2.735069 207.8650       8.700325 198.5365       14.39892 213.2293       10.91899 127.3479 4.647625 132.1245 3.394086 -4.776566      5.755019 
1 1 1 0   22 20 o 20.57358 5.268230 5.379288       2.652447 0.6444299      5.593266 6.753026       3.012756 18.04156 7.561038 23.02530 5.453848 -4.983736      9.322755 
1 1 1 0   22 21 o 261.2024 4.306143 834.2125       27.40953 862.0627       40.74721 811.1959       37.04290 264.9975 6.309865 257.1778 5.910652 7.819641       8.645820 
1 1 1 0   22 22 o 80.50872 3.015287 79.23276       5.905267 79.31062       9.173569 79.17767       7.716722 80.36167 4.704974 80.38718 3.951325 -0.2551270E-01 6.144083 
1 1 1 0   22 23 o 145.4365 3.230363 258.3250       11.44882 260.9869       16.94992 256.0915       15.52581 145.9061 4.773569 144.5945 4.411381 1.311584       6.499788 
1 1 1 0   22 24 o 140.2095 3.706650 240.5023       12.65360 240.0358       24.11547 240.6796       14.86417 139.3183 7.126838 140.1532 4.357421 -0.8348999     8.353379 
1 1 1 0   22 25 o 89.66668 3.498368 98.43304       7.629542 109.7753       15.96848 95.07790       8.684982 94.04961 7.017990 88.04976 4.058583 5.999847       8.107051 
1 1 1 0   22 26 o 84.62901 3.100619 87.63192       6.383648 78.01455       9.514178 95.50670       8.609192 79.58088 4.930198 88.23344 4.014508 -8.652557      6.357918 
1 1 1 0   22 27 o 21.93843 6.296052 6.080285       3.541705 4.897124       5.975405 6.721047       4.397377 22.31940 8.271125 23.24720 7.105319 -0.9278049     10.90399 
1 1 1 0   22 28 o 70.73539 3.594589 61.41706       6.175838 64.05985       11.19756 60.26170       7.403731 71.66564 6.481750 69.94254 4.365601 1.723099       7.814830 
1 1 1 0   22 29 f 66.97454 3.385202 55.06598       5.507061 58.46152       8.653185 52.75443       7.139577 68.67174 5.209719 65.35903 4.510265 3.312706       6.890839 
1 1 1 0   22 30 o 62.97606 3.458444 48.76527       5.287154 49.37486       8.028708 48.29849       7.025620 62.99498 5.278514 62.44514 4.650279 0.5498352      7.034757 
1 1 1 0   22 31 o 48.26860 3.900132 28.83841       4.548507 29.32547       6.874101 28.45907       6.066458 48.18042 5.983280 47.63119 5.317038 0.5492287      8.004407 
1 1 1 0   22 32 o 59.33804 3.492033 43.44957       5.027170 45.64858       7.584105 41.72613       6.714111 60.37167 5.205877 57.81809 4.808773 2.553585       7.086992 
1 1 1 0   22 33 o 32.75893 5.666419 13.83267       4.359852 19.31134       5.944748 7.456106       6.413414 38.53815 6.565157 24.78760 8.644416 13.75056       10.85483 
1 1 1 0   22 34 o 29.20509 7.074829 11.43035       4.981387 12.77374       5.753073 7.406145       9.957254 30.71608 7.701173 26.70143 10.48103 4.014650       13.00615 
1 1 1 0   22 35 o 69.76905 3.380555 60.49966       5.730500 67.90276       8.432201 54.14613       7.811631 73.23775 4.750280 65.26303 4.948658 7.974724       6.859619 
1 1 1 0   22 36 o 10.99892 5.121570 -2.695818      3.341035 -3.854451      4.822703 -1.626594      4.632886 13.07506 6.109799 14.11813 6.366498 -1.043063      8.823941 
1 1 1 0   22 37 o 41.22355 4.432480 21.93072       4.382877 19.12853       6.302628 24.55478       6.099033 36.80853 7.284438 42.69075 6.030349 -5.882221      9.456646 
1 1 1 0   22 38 o 50.23939 4.036911 32.51978       4.900736 33.68021       7.129104 31.48011       6.747966 49.55420 6.027443 48.01059 5.890982 1.543617       8.428151 
1 1 1 0   22 39 o 48.40905 5.709300 32.58175       6.605717 0.000000       0.000000 32.58175       6.605717 ?        ?        48.40905 5.709300 0.000000       5.709300 
1 1 1 0   22 40 o 20.60959 6.675301 6.508731       3.827734 5.650943       5.512145 7.307598       5.319462 19.66593 7.773943 21.32903 7.821342 -1.663095      11.02758 
1 1 1 0   22 41 o 33.71038 5.069852 16.13554       4.035967 18.59388       6.143280 14.26876       5.353349 33.24135 7.730386 29.20115 7.487968 4.040201       10.76237 
1 1 1 0   22 42 o 19.52042 6.654881 6.355843       3.793314 7.643823       5.967127 5.482359       4.914035 20.20552 8.055656 18.28074 7.302980 1.924789       10.87323 
1 1 1 0   22 43 f 14.01159 5.966524 2.154023       3.574987 5.518433       5.328981 -0.5992305     4.820730 17.66008 7.389263 13.15190 6.133417 4.508181       9.603126 
1 1 1 0   22 44 o 12.62947 5.656184 0.9475942      3.587269 4.789493       5.451633 -1.986186      4.763952 16.44386 7.184935 12.05098 5.759905 4.392882       9.208680 
1 1 1 0   22 45 o 13.91595 6.022357 2.663859       3.754160 -1.145315      5.583539 5.806629       5.071664 12.82168 6.156725 16.71423 7.111598 -3.892550      9.406385 
1 1 1 0   23 1  o 186.0862 3.554080 422.2287       16.11675 437.1292       22.93561 407.6944       22.65207 189.2103 4.978597 182.7153 5.092380 6.495041       7.121710 
1 1 1 0   23 2  o 278.4422 4.553596 945.7984       30.89766 976.0574       44.21878 916.9295       43.19113 282.6936 6.418813 273.9922 6.468749 8.701385       9.112950 
1 1 1 0   23 3  o 306.3352 4.877482 1145.022       36.41068 1172.155       52.11717 1119.152       50.88971 309.7239 6.905100 302.6409 6.900272 7.083038       9.761872 
1 1 1 0   23 4  o 282.9163 4.587917 976.5269       31.63075 1038.889       46.26774 921.8057       43.34085 291.6188 6.510684 274.6990 6.474470 16.91983       9.181927 
1 1 1 0   23 5  o 335.8470 5.239764 1376.749       42.88342 1327.084       59.22748 1431.476       62.17225 329.4488 7.377331 342.1483 7.456691 -12.69949      10.48939 
1 1 1 0   23 6  o 221.8914 3.486301 600.4058       18.85130 669.0713       31.30101 561.3242       23.61428 234.0939 5.486964 214.4882 4.517886 19.60573       7.107606 
1 1 1 0   23 7  o 90.94202 2.687279 100.9114       5.948903 101.0109       9.026120 100.8350       7.909976 90.90402 4.085007 90.85858 3.579511 0.4544067E-01  5.431407 
1 1 1 0   23 8  o 317.1699 5.006110 1228.100       38.69264 1229.818       55.01092 1226.417       54.43298 317.0772 7.119471 316.6498 7.054184 0.4274292      10.02239 
1 1 1 0   23 9  o 127.5948 3.057861 198.5232       9.507945 195.3582       12.98250 202.1845       13.96356 126.4590 4.218724 128.6324 4.461366 -2.173424      6.140148 
1 1 1 0   23 10 o 304.0385 4.867625 1128.732       36.06465 1136.073       73.19284 1126.378       41.44506 303.8543 9.897991 303.6162 5.601595 0.2380371      11.37313 
1 1 1 0   23 11 o 155.5707 3.286536 295.2014       12.45954 310.4641       26.31623 290.7917       14.14542 159.1239 6.802290 154.3793 3.760026 4.744675       7.772319 
1 1 1 0   23 12 o 151.7875 3.235758 281.0308       11.96873 302.5572       26.06179 275.2773       13.47359 157.0510 6.825994 150.2015 3.681062 6.849533       7.755282 
1 1 1 0   23 13 o 130.8105 2.795060 208.6757       8.909839 199.1013       14.60125 214.3558       11.24640 127.5860 4.704304 132.5010 3.486066 -4.914986      5.855180 
1 1 1 0   23 14 o 33.79818 4.679148 14.21861       3.750604 -2.017029      9.508916 17.20983       4.081509 21.69108 9.483119 37.25607 4.592708 -15.56498      10.53672 
1 1 1 0   23 15 o 251.8132 3.806875 774.0444       23.36056 757.2936       37.25403 784.8990       29.98903 248.7047 6.146857 253.4259 4.855962 -4.721207      7.833532 
1 1 1 0   23 16 o 81.20856 2.694742 80.52241       5.325413 82.92850       9.510602 79.42344       6.427545 82.23477 4.766301 80.61120 3.278845 1.623573       5.785192 
1 1 1 0   23 17 o 113.1782 2.970828 156.3873       8.186544 166.3429       18.73705 154.0384       9.101200 116.2741 6.640361 112.2955 3.329507 3.978569       7.428325 
1 1 1 0   23 18 o 245.9294 3.738491 738.6002       22.40489 724.1540       35.78785 747.9117       28.73214 243.0702 6.041821 247.2998 4.767692 -4.229599      7.696394 
1 1 1 0   23 19 o 129.4701 2.754877 204.5130       8.691762 222.8003       15.20700 195.6403       10.59250 134.8927 4.633017 126.5373 3.438323 8.355453       5.769481 
1 1 1 0   23 20 o 234.9809 4.010575 674.8406       22.96547 708.7625       34.55008 647.9894       30.73909 240.3874 5.897953 229.9527 5.485502 10.43471       8.054600 
1 1 1 0   23 21 o 45.18780 3.665418 25.11168       4.001651 21.74366       6.722760 26.95981       4.979974 41.50440 6.888244 46.73761 4.425148 -5.233215      8.187176 
1 1 1 0   23 22 o 44.66278 3.650610 24.53933       3.938629 33.81699       6.924779 20.10273       4.788639 52.21746 5.525680 40.20228 4.995362 12.01518       7.448945 
1 1 1 0   23 23 o 96.55363 2.936943 113.9351       6.902319 112.3119       16.05158 114.3034       7.645248 95.19939 6.967315 96.67696 3.249752 -1.477577      7.687936 
1 1 1 0   23 24 o 20.19019 6.395179 4.942363       3.527745 0.5863427      8.441594 5.864069       3.883074 21.76533 9.214272 21.79212 6.680006 -0.2679253E-01 11.38092 
1 1 1 0   23 25 o 166.7774 3.431515 340.0902       13.94631 338.5327       20.36916 341.4648       19.13477 165.9862 5.041605 166.7921 4.712455 -0.8059235     6.901087 
1 1 1 0   23 26 o 104.5980 3.112275 133.8545       7.924174 141.0699       12.18730 128.5700       10.42979 107.1101 4.680487 102.3393 4.190991 4.770752       6.282624 
1 1 1 0   23 27 o 147.0452 3.732275 264.9870       13.36317 271.4102       24.10777 262.1380       16.05551 147.8733 6.707541 146.0564 4.516373 1.816925       8.086330 
1 1 1 0   23 28 o 80.74733 3.245062 79.93015       6.372382 85.10977       9.849509 76.20127       8.357096 83.01251 4.890615 78.64050 4.378151 4.372009       6.564017 
1 1 1 0   23 29 o 109.5699 3.123922 147.1187       8.332669 145.9603       12.34369 148.0885       11.29444 108.7567 4.668370 109.6705 4.234043 -0.9137878     6.302444 
1 1 1 0   23 30 o 40.69431 4.282858 20.61856       4.183608 19.99114       6.447636 21.07481       5.498175 39.39491 6.971245 40.82563 5.680110 -1.430717      8.992326 
1 1 1 0   23 31 o 24.07697 6.365413 7.534278       3.790996 12.71661       5.976809 4.045910       4.903631 31.01480 7.890273 20.06658 7.481912 10.94822       10.87361 
1 1 1 0   23 32 o 45.12718 4.401922 25.48686       4.779326 20.67538       6.311665 31.95363       7.317254 39.87864 6.734397 50.00731 6.132761 -10.12867      9.108395 
1 1 1 0   23 33 o 72.27592 4.174731 65.13387       7.321604 64.91307       8.689567 65.67424       13.59427 71.80166 4.997428 70.46315 8.061902 1.338509       9.485175 
1 1 1 0   23 34 o 18.81925 7.346733 3.267117       4.870112 2.408566       5.589406 5.973723       9.924197 18.82267 7.691142 25.34693 10.28891 -6.524258      12.84583 
1 1 1 0   23 35 o 33.43047 5.067287 14.53362       3.998888 13.93005       5.929650 15.03711       5.415783 31.52831 7.768855 33.18680 6.921090 -1.658489      10.40464 
1 1 1 0   23 36 o 21.55932 6.519166 6.351140       3.715233 4.570665       5.443221 7.904045       5.083473 20.19247 7.799019 23.79129 7.691651 -3.598816      10.95382 
1 1 1 0   23 37 o 41.55627 4.600305 22.57617       4.580721 23.82371       6.580890 21.40363       6.380015 41.15793 6.798532 38.81891 7.001942 2.339024       9.759469 
1 1 1 0   23 38 o 46.20845 4.697712 28.37456       5.216397 23.48400       8.802024 31.02206       6.476213 37.24284 9.628301 47.42431 5.719151 -10.18147      11.19879 
1 1 1 0   23 39 o 12.62838 5.811561 -1.581735      4.117764 -1.676277      8.217523 -1.550036      4.758265 17.06659 7.975120 13.56566 6.244464 3.500927       10.12896 
1 1 1 0   23 40 o 40.93157 4.585399 22.95925       4.495218 21.32634       6.604123 24.36890       6.136048 35.97984 7.760518 40.10722 6.500450 -4.127377      10.12331 
1 1 1 0   23 41 o 35.24660 5.021355 17.80099       4.191120 25.28028       6.680965 12.94772       5.381790 39.15950 7.268634 26.98033 7.766797 12.17917       10.63749 
1 1 1 0   23 42 o 13.42041 5.999587 0.8151738      4.016597 8.805309       5.507050 -8.266149      5.871060 21.02187 7.910100 11.39927 5.646031 9.622606       9.718403 
1 1 1 0   23 43 o 16.06975 6.405425 4.269804       3.771971 8.215639       5.941427 1.605686       4.882003 19.32346 7.916626 14.28133 6.478352 5.042127       10.22947 
1 1 1 0   23 44 o 11.33586 5.292125 -0.7176848     3.604395 2.978973       5.587992 -3.351542      4.716798 15.03695 6.863676 11.27804 5.474457 3.758908       8.779506 
1 1 1 0   24 0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 0   24 1  f 23.68186 6.763763 7.018190       4.096983 4.404558       4.729790 14.87235       8.199163 20.65828 7.403117 34.30846 9.488151 -13.65018      12.03458 
1 1 1 0   24 2  o 85.00519 3.143901 88.22971       6.501318 77.43513       8.592221 102.6869       9.943618 79.53609 4.450830 91.62478 4.466899 -12.08869      6.305797 
1 1 1 0   24 3  o 140.5670 2.870063 240.9078       9.831298 239.4229       15.14931 241.9881       12.92193 140.0003 4.446097 140.7990 3.769492 -0.7987061     5.828967 
1 1 1 0   24 4  o 258.4019 3.869085 814.5504       24.36352 803.0969       37.89951 822.6172       31.80632 256.3549 6.066747 259.5712 5.028296 -3.216309      7.879669 
1 1 1 0   24 5  o 217.0335 3.845324 574.6368       20.33742 552.5146       27.96761 599.4620       29.62696 212.6196 5.402166 221.5309 5.488033 -8.911316      7.700773 
1 1 1 0   24 6  o 452.7469 6.075447 2505.588       67.03009 2607.504       108.5426 2442.760       85.22207 460.7346 9.667479 446.5620 7.831306 14.17267       12.44144 
1 1 1 0   24 7  o 291.3557 4.213070 1035.993       29.91289 1076.703       48.18991 1010.476       38.15298 296.6642 6.665841 287.5893 5.444019 9.074890       8.606439 
1 1 1 0   24 8  o 316.0872 4.476037 1219.714       34.47757 1175.872       53.09287 1251.683       45.33765 309.9166 7.030000 319.9908 5.814138 -10.07428      9.122779 
1 1 1 0   24 9  o 121.3534 3.055766 179.7201       9.029473 195.4071       12.81209 164.2395       12.72753 126.4593 4.163185 115.8934 4.515245 10.56589       6.141624 
1 1 1 0   24 10 o 222.2381 3.937105 602.7906       21.32218 634.7468       44.61264 593.3300       24.27410 227.3089 8.066673 220.4290 4.518958 6.879868       9.246200 
1 1 1 0   24 11 o 317.1470 5.047629 1229.088       39.01074 1130.753       75.13025 1265.386       45.64648 302.6862 10.20016 321.6424 5.823685 -18.95618      11.74558 
1 1 1 0   24 12 o 211.4243 3.809635 545.5916       19.62793 574.9705       41.66071 537.2098       22.25238 216.2807 7.917836 209.7385 4.353737 6.542130       9.035882 
1 1 1 0   24 13 o 72.32806 3.590523 64.00149       6.308712 0.000000       0.000000 64.00149       6.308712 ?        ?        72.32806 3.590523 0.000000       3.590523 
1 1 1 0   24 14 o 115.0483 2.763795 161.4399       7.748581 153.3925       13.03943 165.8330       9.634111 111.9279 4.791708 116.5235 3.396455 -4.595604      5.873361 
1 1 1 0   24 15 f 184.8122 3.184956 416.7788       14.34400 419.3842       23.55833 415.2439       18.08214 185.0860 5.228418 184.3909 4.024151 0.6950531      6.597738 
1 1 1 0   24 16 o 53.06059 3.184256 34.48180       4.098391 34.57471       7.731300 34.44548       4.833392 52.76716 6.126202 52.97789 3.768477 -0.2107353     7.192480 
1 1 1 0   24 17 o 228.6640 3.577837 638.4570       19.93676 656.2289       32.80179 628.0458       25.10629 231.3451 5.822995 226.6431 4.545732 4.702011       7.387216 
1 1 1 0   24 18 o 131.0483 2.797399 209.5496       8.933508 227.3264       15.56652 200.8195       10.90875 136.2381 4.695768 128.1911 3.495317 8.047028       5.853843 
1 1 1 0   24 19 f 183.6514 4.039998 412.2645       18.08054 424.7249       23.49856 394.1828       28.30708 186.1439 5.185369 179.0131 6.499738 7.130829       8.314725 
1 1 1 0   24 20 o 69.20361 3.165965 58.59757       5.324992 63.57205       8.623075 55.53130       6.770073 71.87906 4.953216 67.26135 4.150614 4.617706       6.462348 
1 1 1 0   24 21 o 45.76355 3.524759 25.74061       3.900573 16.73645       10.46811 27.19232       4.203266 36.35572 10.93188 47.02398 3.697747 -10.66825      11.54034 
1 1 1 0   24 22 o 74.01273 2.988569 67.00039       5.379126 68.95291       13.12072 66.60591       5.897530 74.38928 7.333132 73.76443 3.289127 0.6248474      8.036988 
1 1 1 0   24 23 o 86.47974 2.963567 91.44717       6.236243 79.88832       14.52767 94.05826       6.904779 80.02296 7.538629 87.67752 3.237216 -7.654564      8.204298 
1 1 1 0   24 24 o 149.8438 2.921114 274.2755       10.66654 267.3619       17.82779 278.1303       13.31212 147.5081 4.966670 150.7902 3.622746 -3.282074      6.147528 
1 1 1 0   24 25 f 135.2873 2.821568 223.6021       9.302155 213.1638       15.40305 229.5947       11.67076 131.6733 4.808423 136.9460 3.500015 -5.272675      5.947355 
1 1 1 0   24 26 o 193.2116 4.234341 457.8681       19.93679 456.7747       35.03765 458.3916       24.24426 191.4884 7.523196 192.9472 5.160887 -1.458817      9.123225 
1 1 1 0   24 27 o 95.90197 3.184320 112.6707       7.431521 108.5507       11.28906 115.8215       9.872355 93.76897 4.958025 97.04642 4.184339 -3.277451      6.487735 
1 1 1 0   24 28 o 151.8418 3.375789 282.5208       12.49116 287.9787       18.53629 277.9806       16.90635 152.7136 4.987605 150.1762 4.625201 2.537384       6.802109 
1 1 1 0   24 29 f 125.0498 3.214105 191.8287       9.786308 206.6737       15.02100 180.8804       12.89978 129.2796 4.776173 121.0755 4.379312 8.204063       6.479984 
1 1 1 0   24 30 o 18.01873 6.473580 3.500232       3.619133 -0.8212435     5.942675 6.047947       4.562904 17.18431 7.505146 22.21259 7.294494 -5.028273      10.46599 
1 1 1 0   24 31 o 84.13168 3.607350 87.41270       7.378596 90.63234       9.832977 83.26324       11.16291 85.25517 4.751710 81.31136 5.669164 3.943810       7.397173 
1 1 1 0   24 32 o 120.9986 3.183917 180.5260       9.379955 171.2906       13.60406 188.8954       12.95057 116.9940 4.781731 123.1635 4.321600 -6.169479      6.445244 
1 1 1 0   24 33 o 64.61442 4.343249 52.43008       6.799080 54.66436       8.051438 46.87657       12.69371 65.63237 5.073431 58.15987 9.267017 7.472496       10.56491 
1 1 1 0   24 34 o 65.90240 3.456642 54.16736       5.531855 63.06963       8.463293 47.52711       7.309387 70.28217 4.973618 60.97495 4.962045 9.307228       7.025579 
1 1 1 0   24 35 o 15.92950 6.310896 2.218187       3.640064 -1.346022      5.539921 4.925996       4.828710 15.59549 7.003269 20.19118 7.443726 -4.595686      10.22031 
1 1 1 0   24 36 o 45.58537 4.153814 26.72267       4.563696 27.15924       6.862384 26.37647       6.110871 44.33003 6.549379 44.22155 5.811143 0.1084824      8.755784 
1 1 1 0   24 37 o 72.14553 3.881457 66.91763       6.798895 88.21942       12.71506 58.38845       8.045702 79.02251 6.664929 66.22611 5.022838 12.79639       8.345668 
1 1 1 0   24 38 o 14.79125 6.134746 1.788104       3.626528 -4.943822      5.159958 8.359262       5.097972 12.45766 5.965125 22.99626 7.715465 -10.53860      9.752493 
1 1 1 0   24 39 o 23.88064 7.250944 9.230582       4.589539 6.845175       8.860312 10.10532       5.365449 21.23024 9.219528 24.41537 7.902815 -3.185135      12.14307 
1 1 1 0   24 40 o 13.07569 5.769947 0.4849511      3.595564 2.522117       5.594671 -0.9485493     4.693105 16.55463 7.254824 13.43857 6.191603 3.116058       9.537737 
1 1 1 0   24 41 o 21.90133 7.137446 8.508775       4.372370 4.890359       6.020700 12.54676       6.360189 17.83792 7.672457 24.52573 8.604537 -6.687807      11.52843 
1 1 1 0   24 42 o 18.44216 6.539901 6.001815       3.681694 5.729435       5.816852 6.183862       4.755456 17.68961 7.573822 18.20433 7.212911 -0.5147209     10.45891 
1 1 1 0   24 43 o 16.35620 6.467863 4.711193       3.816791 6.435707       5.997717 3.537501       4.947998 17.57673 7.609343 15.42713 6.789633 2.149599       10.19810 
1 1 1 0   25 1  o 132.1539 3.709961 213.2406       11.93591 232.3052       20.47137 203.4215       14.69155 137.7017 6.115844 128.9922 4.681544 8.709549       7.701973 
1 1 1 0   25 2  o 90.80073 3.162593 100.6753       6.987233 85.89832       8.992028 123.1954       11.10068 83.76946 4.420545 100.3513 4.551160 -16.58189      6.344625 
1 1 1 0   25 3  f 123.6907 3.122189 186.7093       9.403405 175.1089       12.57670 201.4155       14.16060 119.6957 4.318818 128.3638 4.534040 -8.668159      6.261765 
1 1 1 0   25 4  o 72.07040 3.347660 63.49410       5.863356 68.41364       7.827468 57.20452       8.850536 74.73956 4.316044 68.21307 5.367556 6.526482       6.887590 
1 1 1 0   25 5  o 275.6029 4.053061 927.0397       27.22093 936.2130       43.04733 920.9277       35.13812 276.6216 6.385929 274.5375 5.252194 2.084045       8.268352 
1 1 1 0   25 6  o 160.2801 2.976435 313.3063       11.62552 336.6875       18.61994 298.3687       14.88279 165.9820 4.607883 156.3602 3.905909 9.621841       6.040588 
1 1 1 0   25 7  o 182.7104 3.151722 407.1932       14.03289 411.0084       21.98428 404.5699       18.22986 183.3565 4.924626 182.0523 4.109141 1.304214       6.413812 
1 1 1 0   25 8  o 260.0167 3.878949 825.1716       24.57828 833.9590       38.80961 819.2871       31.75885 261.0722 6.100178 258.9382 5.033066 2.134064       7.908472 
1 1 1 0   25 9  o 113.9985 2.707159 158.4806       7.520539 148.1310       11.23063 166.8947       10.12620 110.0679 4.194718 116.8952 3.558933 -6.827286      5.501060 
1 1 1 0   25 10 o 352.8255 5.517489 1522.428       47.43922 1489.616       94.22127 1533.570       54.90634 346.8517 11.16181 353.8971 6.366626 -7.045380      12.84990 
1 1 1 0   25 11 o 196.0164 5.058249 469.9984       24.14157 0.000000       0.000000 469.9984       24.14157 ?        ?        196.0164 5.058249 0.000000       5.058249 
1 1 1 0   25 12 o 110.8824 3.092231 150.1164       8.347308 151.4862       17.99299 149.7407       9.422647 110.9703 6.684654 110.7116 3.496944 0.2586594      7.544085 
1 1 1 0   25 13 o 219.7951 3.913971 589.9322       20.96388 610.5109       43.86148 583.8392       23.86643 222.6479 8.097530 218.5821 4.480607 4.065796       9.254503 
1 1 1 0   25 14 f 141.4870 3.218970 244.3047       11.09864 249.4763       23.66170 242.8459       12.56683 142.4185 6.837765 140.9838 3.660902 1.434662       7.756109 
1 1 1 0   25 15 o 48.58206 4.085055 29.03839       4.791507 30.32632       7.485868 28.14452       6.236395 49.32439 6.377036 47.63635 5.471508 1.688046       8.402618 
1 1 1 0   25 16 o 90.00809 3.160334 99.00629       6.921118 103.1030       10.76867 96.12303       9.034101 91.67401 4.837483 88.58453 4.196891 3.089485       6.404306 
1 1 1 0   25 17 f 53.54640 4.077775 35.24553       5.280940 44.33273       8.138802 28.63757       6.940311 59.88042 5.644073 47.93980 6.077183 11.94062       8.293836 
1 1 1 0   25 18 o 147.3880 3.722634 265.5923       13.35983 281.2426       17.89129 245.8670       20.08587 151.4924 4.852609 141.4489 5.839694 10.04355       7.592749 
1 1 1 0   25 19 o 97.56968 2.988430 116.3270       7.097114 132.1302       16.89329 112.9400       7.820760 103.4143 6.740164 96.10238 3.344577 7.311913       7.524361 
1 1 1 0   25 20 o 128.0064 3.095820 200.0962       9.657032 196.9251       21.37949 200.9091       10.82418 126.2295 6.977393 128.1832 3.468383 -1.953743      7.791899 
1 1 1 0   25 21 o 83.97928 2.966141 86.22665       6.060626 95.51939       14.71996 84.32978       6.650480 87.75021 6.940177 83.01586 3.293964 4.734344       7.682204 
1 1 1 0   25 22 o 59.93653 2.960292 43.98257       4.310389 45.28325       8.384659 43.51536       5.025273 60.42183 5.764274 59.56202 3.477340 0.8598137      6.731920 
1 1 1 0   25 23 o 104.8390 2.709499 134.3082       6.916462 137.6445       12.27589 132.7567       8.371699 105.8169 4.772887 104.1585 3.302419 1.658470       5.804001 
1 1 1 0   25 24 o 42.37017 3.469600 22.10802       3.551066 19.97480       7.082994 22.82424       4.104120 39.46432 7.641205 42.98768 3.962337 -3.523357      8.607446 
1 1 1 0   25 25 o 231.7585 4.024953 658.3936       22.73174 703.5126       48.32945 645.5764       25.75892 237.0779 8.378534 229.2775 4.610311 7.800354       9.563201 
1 1 1 0   25 26 o 52.14256 3.130713 33.38575       3.959741 33.25017       7.743936 33.43375       4.607662 51.43528 6.310294 52.10780 3.651740 -0.6725159     7.290748 
1 1 1 0   25 27 o 58.02790 3.042657 41.32914       4.287517 35.32188       8.083449 43.68076       5.057566 52.94439 6.394670 59.59201 3.498095 -6.647621      7.288928 
1 1 1 0   25 28 f 93.24544 3.159257 106.6876       7.168379 119.3824       11.40399 98.39519       9.216928 98.20955 4.779395 89.28899 4.248147 8.920555       6.394480 
1 1 1 0   25 29 o 113.1945 3.183475 157.3763       8.772658 161.6990       13.35058 154.0916       11.63785 114.1592 4.809805 111.6444 4.285553 2.514763       6.442064 
1 1 1 0   25 30 o 92.63107 4.795943 106.9566       10.78911 106.9566       10.78911 0.000000       0.000000 92.63107 4.795943 ?        ?        0.000000       4.795943 
1 1 1 0   25 31 o 98.59954 3.171529 119.8746       7.610519 130.3789       11.74150 112.2640       9.994205 102.1019 4.731909 94.92875 4.331721 7.173126       6.415198 
1 1 1 0   25 32 o 59.86049 4.636680 45.17994       6.710991 48.02221       8.046016 38.68237       12.16533 61.34588 5.438487 52.39066 9.891183 8.955223       11.28772 
1 1 1 0   25 33 o 17.52010 6.386219 3.447833       3.538466 2.783343       5.449942 3.932081       4.652443 18.87182 7.637679 19.19662 7.260060 -0.3248062     10.53768 
1 1 1 0   25 34 o 18.64789 6.456175 4.352032       3.574224 0.8690608      5.584273 6.769066       4.651928 17.22952 7.399647 22.40155 7.365764 -5.172029      10.44075 
1 1 1 0   25 35 o 16.54563 6.365058 2.882501       3.615291 6.242747       5.629403 0.5237523      4.716475 21.80164 8.037260 15.60656 6.752117 6.195073       10.49708 
1 1 1 0   25 36 o 17.48288 6.861949 3.352734       4.267735 11.92738       8.355134 0.3257784      4.964189 26.98334 9.816614 15.53896 6.821055 11.44438       11.95377 
1 1 1 0   25 37 o 48.86467 4.131757 31.31800       4.873940 29.21303       7.081958 33.21219       6.718018 44.76337 6.697786 48.76627 5.764384 -4.002895      8.836768 
1 1 1 0   25 38 f 23.85174 7.146502 9.045325       4.479622 8.439600       8.113471 9.310945       5.372771 22.37177 9.217491 23.62442 7.920615 -1.252644      12.15312 
1 1 1 0   25 39 o 17.40359 6.571648 4.370181       3.808529 0.7150553      5.728077 7.266350       5.098820 15.61917 7.057923 20.81900 7.653564 -5.199837      10.41112 
1 1 1 0   25 40 f 16.47842 6.524927 3.897402       3.889244 2.731173       5.411378 5.143491       5.593588 16.24230 7.125976 18.16360 7.583069 -1.921303      10.40589 
1 1 1 0   25 41 o 19.65800 6.620158 6.761099       3.753064 9.030778       5.662875 4.983302       5.011826 20.91604 7.986280 17.30208 7.197040 3.613966       10.75072 
1 1 1 0   25 42 o 30.36716 5.866750 15.02687       4.184329 11.37293       6.329852 17.86285       5.576542 21.68892 8.401252 30.53320 7.540123 -8.844284      11.28869 
1 1 1 0   25 43 f 15.81745 6.305628 4.403988       3.655795 6.404937       5.782121 3.071407       4.718631 17.26652 7.473189 14.78794 6.563467 2.478580       9.946238 
1 1 1 0   26 0  o 167.6600 4.828899 343.2284       19.70883 368.7689       28.30943 319.2060       27.45519 173.6259 6.703434 161.4890 6.993204 12.13689       9.687153 
1 1 1 0   26 1  o 139.3157 3.200840 236.7551       10.86676 240.3911       15.20160 232.9555       15.53982 140.2368 4.453920 138.0311 4.626442 2.205643       6.421944 
1 1 1 0   26 2  o 94.60916 2.827467 109.2562       6.511474 109.6993       9.915215 108.9202       8.634320 94.68998 4.308254 94.39877 3.760935 0.2912140      5.718889 
1 1 1 0   26 3  o 205.7326 3.386068 516.3848       16.97598 519.6559       26.52149 514.1144       22.09537 206.1252 5.284318 205.1867 4.418918 0.9385376      6.888458 
1 1 1 0   26 4  o 144.2593 2.904597 253.8127       10.21094 231.2352       15.17875 272.4758       13.80037 137.5241 4.535399 149.3702 3.794394 -11.84607      5.913313 
1 1 1 0   26 5  o 31.40862 4.752063 12.32169       3.523639 13.98248       4.959173 10.62834       5.007535 33.24971 6.352016 28.88237 7.152544 4.367338       9.565928 
1 1 1 0   26 6  o 120.1954 3.531568 176.4426       10.33286 179.8853       12.58076 169.3062       18.11306 121.2988 4.262749 117.4252 6.353526 3.873566       7.651034 
1 1 1 0   26 7  o 102.9871 3.018202 129.4885       7.566558 124.2747       10.24144 135.7551       11.22792 100.7977 4.178469 105.3386 4.383548 -4.540939      6.055996 
1 1 1 0   26 8  o 82.64953 3.049688 83.44312       6.131779 84.41689       8.251456 82.24224       9.163343 83.04749 4.089837 81.91751 4.608889 1.129974       6.161868 
1 1 1 0   26 9  o 90.02055 3.425782 99.03577       7.501434 98.86685       11.49009 99.16124       9.903176 89.75947 5.276266 89.97687 4.531142 -0.2173996     6.954871 
1 1 1 0   26 10 o 256.5223 6.142025 806.0169       38.39484 0.000000       0.000000 806.0169       38.39484 ?        ?        256.5223 6.142025 0.000000       6.142025 
1 1 1 0   26 11 o 163.1620 3.959570 325.1240       15.74356 320.7463       27.58183 327.2395       19.17391 161.5102 7.024684 163.5311 4.816679 -2.020905      8.517428 
1 1 1 0   26 12 o 133.1968 4.459465 217.0766       14.45439 242.8834       22.58853 199.1822       18.80959 140.5589 6.613221 127.3492 6.078583 13.20964       8.982420 
1 1 1 0   26 13 o 199.9167 4.336554 488.4676       21.12661 469.7788       36.65829 497.7618       25.85150 195.2600 7.719326 201.5954 5.266732 -6.335358      9.344863 
1 1 1 0   26 14 o 75.83360 3.714121 70.40514       6.842752 78.00775       13.23541 67.63170       7.994024 79.39185 6.909858 74.24415 4.438686 5.147705       8.212678 
1 1 1 0   26 15 o 147.4269 3.299075 265.3569       11.85237 247.0861       24.11141 271.1786       13.61028 141.5951 7.009554 148.9447 3.752769 -7.349564      7.950920 
1 1 1 0   26 16 o 142.6126 3.614469 248.6057       12.55129 255.8362       23.99689 245.8828       14.72622 144.0818 6.854203 141.7396 4.268341 2.342178       8.074579 
1 1 1 0   26 17 o 190.5151 3.626994 443.4655       16.83885 484.9431       36.95737 432.5990       18.91644 198.1405 7.668534 188.0904 4.127023 10.05017       8.708544 
1 1 1 0   26 18 o 118.4902 3.079034 171.5469       8.883105 194.7752       20.54773 166.2077       9.851266 125.6224 6.736775 116.5861 3.471308 9.036270       7.578530 
1 1 1 0   26 19 o 66.46721 3.153302 54.07791       5.092945 48.73269       11.67803 55.33331       5.659507 62.31307 7.865390 67.20411 3.467510 -4.891037      8.595812 
1 1 1 0   26 20 o 149.5527 2.955165 273.1338       10.76991 289.3118       18.59129 264.9625       13.21274 153.5217 4.975970 147.1606 3.687292 6.361069       6.193254 
1 1 1 0   26 21 o 82.54093 2.800367 83.29102       5.624593 90.76571       10.57815 80.34478       6.641221 85.85142 5.078919 81.00472 3.371724 4.846695       6.096223 
1 1 1 0   26 22 o 29.17563 4.656522 10.69588       3.199458 8.866222       6.644186 11.24823       3.650588 27.05343 8.797164 29.83562 5.210522 -2.782183      10.22446 
1 1 1 0   26 23 o 67.51891 2.888095 55.80589       4.740984 67.78373       9.294544 51.59343       5.511969 74.07107 5.181930 64.84294 3.501238 9.228127       6.253884 
1 1 1 0   26 24 o 148.8661 3.273739 271.1158       11.87616 272.5673       25.35729 270.7079       13.44153 148.0228 7.049984 148.6687 3.710165 -0.6458740     7.966655 
1 1 1 0   26 25 o 64.81888 2.932404 51.48986       4.619928 60.07489       8.966568 48.38707       5.390523 69.58902 5.328007 62.74714 3.539692 6.841877       6.396646 
1 1 1 0   26 26 o 81.48791 2.747176 81.30869       5.447464 79.66906       9.902340 82.02022       6.523235 80.18076 5.094285 81.75861 3.280774 -1.577850      6.059308 
1 1 1 0   26 27 o 40.95332 3.581613 20.74573       3.538470 13.97018       7.305038 22.82284       4.044642 32.55562 8.937326 42.91043 3.910887 -10.35481      9.755554 
1 1 1 0   26 28 o 18.37665 5.833517 4.159381       2.933906 8.194401       6.418086 3.093440       3.298750 25.80991 8.656945 17.08874 6.175096 8.721165       10.63365 
1 1 1 0   26 29 o 93.95068 3.678652 109.0046       8.405906 97.11619       10.78463 127.4064       13.41758 88.15158 5.041431 100.7794 5.484109 -12.62777      7.449261 
1 1 1 0   26 30 o 48.04141 3.825603 28.73756       4.441731 28.26301       7.282141 29.01871       5.605125 46.68962 6.582808 47.96621 4.862380 -1.276592      8.183893 
1 1 1 0   26 31 o 13.00535 6.101549 -4.508049      4.890947 -1.921243      5.791715 -10.93874      9.131752 15.95490 7.162982 16.49307 7.907527 -0.5381660     10.66946 
1 1 1 0   26 32 o 49.78854 5.195445 31.84241       6.210944 30.02971       7.331436 36.45070       11.68947 47.67630 6.477705 50.22218 9.903401 -2.545883      11.83377 
1 1 1 0   26 33 o 31.65658 5.268100 13.18844       3.921240 15.19191       6.258199 11.89348       5.031360 32.68264 7.937710 29.22530 7.129148 3.457336       10.66921 
1 1 1 0   26 34 o 25.47656 6.290988 9.017939       3.882100 12.38677       6.273068 6.926949       4.942154 28.83753 8.410309 22.40042 7.596685 6.437105       11.33327 
1 1 1 0   26 35 o 43.35307 5.747804 25.59141       5.922894 0.000000       0.000000 25.59141       5.922894 ?        ?        43.35307 5.747804 0.000000       5.747804 
1 1 1 0   26 36 o 36.18362 4.809026 17.62252       4.135491 28.55292       6.657035 10.75341       5.277317 44.82124 6.265795 26.21383 7.732872 18.60741       9.952763 
1 1 1 0   26 37 o 13.64195 5.863084 0.8872530      3.510623 -6.175278      5.109591 7.202218       4.831604 11.78228 5.714215 21.40672 7.500406 -9.624441      9.429122 
1 1 1 0   26 38 o 11.83626 5.528862 -2.121662      3.943157 2.430411       7.444736 -3.896629      4.648788 17.95307 8.085406 11.94020 5.702275 6.012870       9.893925 
1 1 1 0   26 39 f 15.64414 6.537113 2.834038       4.162492 6.341954       5.508569 -1.834834      6.355069 19.38486 7.736131 14.55049 6.866221 4.834367       10.34373 
1 1 1 0   26 40 o 16.69774 6.321951 4.386502       3.530065 4.997570       5.702270 4.006800       4.494943 17.63348 7.522958 16.49462 6.834538 1.138855       10.16395 
1 1 1 0   26 41 o 9.310316 4.560152 -4.646257      3.487863 -1.367089      5.395884 -6.999697      4.571223 13.13960 6.237680 10.02453 4.968102 3.115072       7.974377 
1 1 1 0   26 42 o 14.37722 6.051638 2.950340       3.607372 3.247797       5.612926 2.741012       4.708587 15.35286 6.957252 14.68451 6.534734 0.6683521      9.544951 
1 1 1 0   27 1  o 83.58055 3.162691 85.34590       6.430044 80.08792       8.633264 91.89632       9.636068 80.85660 4.398064 86.61054 4.581850 -5.753944      6.351088 
1 1 1 0   27 2  o 212.9098 3.457592 553.1661       17.93929 529.4070       27.30648 571.2068       23.79455 207.9927 5.391974 216.2383 4.515532 -8.245529      7.033023 
1 1 1 0   27 3  o 62.80933 3.159238 48.25075       4.819987 62.51088       7.429611 37.88704       6.333766 71.41447 4.288937 55.48331 4.729549 15.93116       6.384639 
1 1 1 0   27 4  o 69.70872 3.325076 59.42804       5.632107 78.71776       10.64444 51.92797       6.637318 80.03336 5.491046 65.07216 4.208200 14.96120       6.918131 
1 1 1 0   27 5  o 200.8774 3.349081 492.4040       16.39430 512.2300       26.08254 479.4553       21.07872 204.5934 5.235752 198.1145 4.366083 6.478989       6.817315 
1 1 1 0   27 6  o 169.6333 3.407133 351.1760       14.08433 375.0212       20.34009 329.2112       19.52162 175.0988 4.771322 164.0315 4.889198 11.06732       6.831527 
1 1 1 0   27 7  o 173.1697 3.443961 366.0042       14.53337 371.4084       27.90708 363.9931       17.02412 173.9284 6.596228 172.6377 4.046627 1.290695       7.738566 
1 1 1 0   27 8  o 166.1744 3.378962 337.0286       13.68307 347.3510       26.23615 333.1719       16.03679 168.2120 6.412140 165.1666 3.984366 3.045395       7.549219 
1 1 1 0   27 9  o 73.66410 2.825467 66.29572       5.062632 59.62047       7.354778 72.30672       6.979259 69.71547 4.350855 76.86211 3.737358 -7.146637      5.735660 
1 1 1 0   27 10 o 100.3834 3.159583 123.0973       7.719456 127.2806       15.97131 121.8221       8.817835 101.6644 6.480405 99.82033 3.631041 1.844101       7.428331 
1 1 1 0   27 11 o 74.45210 3.307114 67.79604       5.985178 68.77914       12.63991 67.51191       6.795268 74.49953 7.046050 74.25376 3.767678 0.2457657      7.990132 
1 1 1 0   27 12 o 182.4490 3.585712 406.5081       15.94237 384.4374       32.05811 413.7595       18.37566 176.6113 7.465587 184.0056 4.098037 -7.394226      8.516390 
1 1 1 0   27 13 o 27.54393 5.996034 9.663082       3.910182 21.87726       8.824846 6.679317       4.361715 41.28529 9.024007 23.25431 7.070307 18.03098       11.46394 
1 1 1 0   27 14 o 74.57686 3.617061 68.09757       6.553887 68.32657       12.86355 68.01730       7.616593 74.17155 7.207617 74.46810 4.214350 -0.2965469     8.349280 
1 1 1 0   27 15 o 121.2490 3.525692 179.7377       10.40632 187.0353       20.13788 177.0791       12.15501 123.1419 6.736417 120.2687 4.153543 2.873169       7.913990 
1 1 1 0   27 16 o 75.27387 3.212206 69.32006       5.878738 66.77682       13.24943 69.94347       6.559798 73.20503 7.534588 75.57616 3.571908 -2.371124      8.338378 
1 1 1 0   27 17 o 177.1058 3.185838 383.0836       13.74968 368.8679       22.42349 391.6493       17.40594 173.3461 5.314548 178.9551 3.991327 -5.609024      6.646436 
1 1 1 0   27 18 o 133.8082 2.920313 218.6211       9.522441 206.8319       16.02597 225.0549       11.83903 129.7756 5.077315 135.6433 3.584781 -5.867676      6.215286 
1 1 1 0   27 19 o 38.85111 4.030717 18.66694       3.760733 31.32475       8.181715 15.27622       4.234584 49.93179 6.908977 34.92261 5.128544 15.00918       8.604413 
1 1 1 0   27 20 o 55.08295 3.287076 37.21655       4.392212 33.25234       8.400447 38.70799       5.152627 51.45165 6.871521 56.11958 3.789944 -4.667927      7.847387 
1 1 1 0   27 21 o 44.24714 3.573687 24.10716       3.820585 27.18130       7.693334 23.10083       4.401727 46.36609 7.029040 43.21415 4.234137 3.151932       8.205811 
1 1 1 0   27 22 o 50.50583 3.367378 31.34060       4.120800 31.18623       8.204188 31.39268       4.765557 49.71555 6.962469 50.47605 3.904628 -0.7605019     7.982612 
1 1 1 0   27 23 f 87.76470 3.068416 94.31455       6.552419 82.69160       15.18687 96.97308       7.263231 81.07372 7.782380 88.95200 3.356741 -7.878288      8.475444 
1 1 1 0   27 24 o 38.65305 3.784809 18.49367       3.519392 28.72057       7.455072 15.56092       3.992252 47.66071 6.595384 35.24631 4.770368 12.41440       8.139749 
1 1 1 0   27 25 o 17.51204 5.867510 3.588776       2.948462 -3.005973      6.530700 5.277135       3.304403 16.79439 7.567381 20.48961 6.137606 -3.695227      9.743484 
1 1 1 0   27 26 o 55.23948 3.168108 37.52966       4.246786 30.95415       8.305110 39.85772       4.941715 49.17733 7.138571 56.85980 3.584696 -7.682472      7.988069 
1 1 1 0   27 27 o 62.97113 2.938035 48.72686       4.496097 56.18323       8.586080 45.90980       5.277520 67.01798 5.300488 60.99667 3.566038 6.021317       6.388412 
1 1 1 0   27 28 o 49.41133 4.441419 30.50617       5.290909 29.28440       7.493536 31.72076       7.471463 47.69151 6.626537 49.78984 6.298552 -2.098324      9.142360 
1 1 1 0   27 29 o 50.23073 3.889974 31.42472       4.724512 30.95166       7.832142 31.69532       5.923602 48.81071 6.766339 50.12970 4.912010 -1.318985      8.361291 
1 1 1 0   27 30 o 39.49307 4.811222 19.85159       4.534890 15.38684       7.073517 22.96732       5.909032 33.29471 8.643306 42.08596 5.925429 -8.791248      10.47938 
1 1 1 0   27 31 o 15.69898 6.282930 1.859781       3.643842 4.052618       5.891915 0.5015925      4.636960 20.50533 8.058307 15.84868 6.773336 4.656651       10.52684 
1 1 1 0   27 32 o 37.81878 4.582236 18.39499       4.136968 19.18075       6.684862 17.90727       5.266639 37.02004 7.662669 36.58583 6.123458 0.4342155      9.808834 
1 1 1 0   27 33 o 37.10539 4.641044 17.90811       4.104990 24.20380       6.713446 14.14870       5.187806 41.83278 6.820326 31.74573 6.903127 10.08705       9.704123 
1 1 1 0   27 34 o 32.32031 6.905389 14.98427       5.273617 0.000000       0.000000 14.98427       5.273617 ?        ?        32.32031 6.905389 0.000000       6.905389 
1 1 1 0   27 35 o 51.68552 3.923073 34.62909       4.904282 32.21352       7.537539 36.40242       6.458273 47.24287 6.737933 51.87983 5.177430 -4.636951      8.497383 
1 1 1 0   27 36 o 56.26834 3.800308 41.30518       5.180407 32.57239       7.395133 49.71980       7.259162 46.93094 6.652439 60.37047 4.978514 -13.43953      8.309064 
1 1 1 0   27 37 o 11.48084 5.415257 -2.797281      3.944879 -4.617863      6.916296 -1.919397      4.802718 14.40457 6.899704 13.22335 6.151681 1.181219       9.243868 
1 1 1 0   27 38 o 41.11038 5.263368 24.36694       5.152120 23.51354       6.761770 25.54819       7.955251 37.31261 7.692243 36.99969 8.926580 0.3129196      11.78365 
1 1 1 0   27 39 o 19.96511 6.715775 6.806197       3.862305 11.62493       5.957950 3.313306       5.072513 23.92642 8.332591 16.27674 7.022050 7.649681       10.89685 
1 1 1 0   27 40 o 19.12497 6.723738 6.588112       3.885002 5.708673       6.031917 7.211555       5.078679 17.71640 7.650329 19.16045 7.495859 -1.444046      10.71053 
1 1 1 0   27 41 o 16.01414 6.339891 4.349494       3.671146 1.208419       5.864117 6.373986       4.707838 14.49019 6.759903 17.95045 7.155740 -3.460269      9.843826 
1 1 1 0   28 0  o 496.8635 10.52743 3032.445       127.4664 3177.384       185.3297 2902.335       175.5934 506.2698 15.03864 483.9142 14.90809 22.35568       21.17574 
1 1 1 0   28 1  f 297.1385 4.828518 1079.466       34.96302 1046.046       48.22003 1116.512       50.76873 292.0201 6.776083 301.6564 6.906334 -9.636383      9.675368 
1 1 1 0   28 2  o 294.5830 4.799970 1060.959       34.45739 1016.584       47.08048 1112.147       50.56625 287.8907 6.710845 301.0636 6.892335 -13.17291      9.619757 
1 1 1 0   28 3  o 146.7932 3.362724 262.9975       12.02911 249.4658       22.95996 268.1171       14.12249 142.4691 6.631433 148.1193 3.916020 -5.650177      7.701372 
1 1 1 0   28 4  o 317.3006 4.543688 1230.570       35.13302 1209.012       54.52473 1245.875       45.94170 313.7932 7.130401 318.9230 5.911329 -5.129822      9.262096 
1 1 1 0   28 5  o 153.4823 3.843107 287.8605       14.36267 257.1056       22.64642 308.5547       18.57663 144.6591 6.440327 158.7790 4.806600 -14.11996      8.036244 
1 1 1 0   28 6  o 154.9118 3.336748 292.9124       12.59633 268.5884       22.92965 303.4257       15.07470 147.8619 6.378635 157.6144 3.924792 -9.752548      7.489391 
1 1 1 0   28 7  o 43.73211 3.704568 23.52103       3.910864 23.07441       5.648491 23.93228       5.420166 43.06649 5.508077 43.92584 5.161972 -0.8593445     7.548832 
1 1 1 0   28 8  o 332.1511 4.701440 1349.268       38.05421 1335.289       59.51539 1358.936       49.49347 329.5157 7.411687 332.9152 6.100679 -3.399506      9.599551 
1 1 1 0   28 9  o 30.44360 4.750463 11.60494       3.409233 10.18447       4.620471 13.30247       5.051014 28.23853 6.796790 32.33740 6.632424 -4.098875      9.496600 
1 1 1 0   28 10 f 130.3740 2.809116 207.3997       8.924763 204.1197       13.59234 209.8856       11.83283 129.1410 4.325210 131.0314 3.709494 -1.890335      5.698051 
1 1 1 0   28 11 o 91.81206 3.219021 103.0351       7.190964 95.02473       14.58448 105.6079       8.265497 87.65709 6.882762 92.91019 3.657792 -5.253105      7.794348 
1 1 1 0   28 12 o 55.92912 3.751493 38.38985       5.083457 35.82007       10.95645 39.09480       5.738500 53.15180 8.764131 56.39104 4.206218 -3.239243      9.721228 
1 1 1 0   28 13 o 68.57523 3.773979 57.64004       6.282394 60.98877       11.88647 56.34196       7.400520 70.04399 7.060022 67.70943 4.510875 2.334557       8.378060 
1 1 1 0   28 14 o 19.04450 6.606431 4.011597       3.743341 -7.840543      8.290339 7.046833       4.195369 17.18324 8.023298 23.68613 6.869263 -6.502892      10.56220 
1 1 1 0   28 15 o 80.73486 3.576592 79.80775       7.019196 82.02289       13.99118 79.06269       8.114215 81.27190 7.136842 80.28719 4.161490 0.9847107      8.261508 
1 1 1 0   28 16 o 68.37917 3.362265 57.26522       5.585451 51.91064       12.23878 58.67384       6.277279 64.30475 7.981384 69.17568 3.737643 -4.870934      8.813198 
1 1 1 0   28 17 o 159.5530 3.402104 311.1186       13.22783 335.4547       29.00456 304.7276       14.86359 164.6484 7.246657 157.8368 3.864376 6.811661       8.212639 
1 1 1 0   28 18 o 45.51799 3.781193 25.51910       4.156353 23.21052       8.096768 26.34510       4.843171 42.58119 8.098804 46.17429 4.355675 -3.593102      9.195788 
1 1 1 0   28 19 f 67.56239 3.115890 55.90202       5.116255 52.64288       9.655111 57.17447       6.032897 65.07005 6.162346 68.26613 3.639629 -3.196075      7.156913 
1 1 1 0   28 20 o 13.42378 5.674647 0.1774552      3.194001 -10.82684      6.828829 3.258927       3.613634 13.80682 6.674424 17.82844 6.460247 -4.021615      9.288850 
1 1 1 0   28 21 o 49.51861 3.789059 30.20627       4.537583 37.73962       12.87543 29.13794       4.848668 53.84702 10.18513 48.57858 4.135093 5.268444       10.99254 
1 1 1 0   28 22 o 101.3864 3.076647 125.8537       7.592600 119.3697       17.31120 127.3980       8.448567 97.63854 7.329106 101.9519 3.405347 -4.313400      8.081595 
1 1 1 0   28 23 o 41.96378 3.707716 21.75995       3.752587 17.54170       7.589717 23.12481       4.317204 36.60297 8.647331 43.19566 4.152441 -6.592693      9.592658 
1 1 1 0   28 24 o 144.9463 2.962220 257.2122       10.46311 241.1684       17.39801 266.3028       13.09606 139.6037 5.122756 147.3045 3.648285 -7.700775      6.289087 
1 1 1 0   28 25 o 82.17695 2.832168 82.80251       5.663116 91.85064       10.63665 79.22301       6.690169 85.96511 5.100387 80.26097 3.428453 5.704140       6.145587 
1 1 1 0   28 26 o 31.84109 4.364037 12.75579       3.297200 12.63715       6.871558 12.79128       3.758094 30.85696 8.741947 31.72869 5.027920 -0.8717346     10.08472 
1 1 1 0   28 27 o 66.75370 3.135633 54.90611       5.086525 59.50695       9.072375 52.79685       6.142808 68.74335 5.460532 65.26273 3.879987 3.480621       6.698635 
1 1 1 0   28 28 o 65.14865 3.363821 52.49865       5.322324 51.53048       8.690537 53.07972       6.732629 63.68581 5.658589 65.21811 4.259548 -1.532295      7.082612 
1 1 1 0   28 29 o 10.74394 5.090233 -3.989585      3.558644 -3.838382      5.810838 -4.080327      4.501556 14.86793 6.864260 12.53713 5.872824 2.330799       9.033722 
1 1 1 0   28 30 o 28.82839 6.076857 11.09328       4.134321 13.03386       6.600480 9.840360       5.303617 30.38725 8.553634 26.72519 7.715341 3.662066       11.51916 
1 1 1 0   28 31 o 30.11083 4.740249 11.78679       3.363381 10.63990       6.606539 12.18804       3.907691 27.29374 8.763517 30.32577 5.489824 -3.032030      10.34105 
1 1 1 0   28 32 o 12.70294 5.367974 0.5223147      2.856400 -1.536057      5.743752 1.198640       3.292393 15.63841 7.067005 14.19701 5.862762 1.441401       9.182295 
1 1 1 0   28 33 o 35.37644 4.904407 16.60178       4.114437 0.000000       0.000000 16.60178       4.114437 ?        ?        35.37644 4.904407 0.000000       4.904407 
1 1 1 0   28 34 o 25.02030 6.296670 9.061072       3.835644 4.427975       6.073264 12.13530       4.947143 19.60919 8.015373 28.44794 7.146431 -8.838751      10.73861 
1 1 1 0   28 35 o 63.79294 3.610339 52.64383       5.589595 49.63739       8.369143 55.06483       7.510194 59.20918 5.877895 63.76439 4.870070 -4.555214      7.633298 
1 1 1 0   28 36 o 15.55782 6.463059 2.369828       4.034197 -0.7963548     7.204769 3.815887       4.869060 16.35458 7.583050 17.56729 7.178346 -1.212713      10.44181 
1 1 1 0   28 37 o 20.02887 7.628430 6.678105       5.158522 7.282476       8.797322 6.361411       6.368228 20.68334 9.079772 19.78274 8.160025 0.9006004      12.20771 
1 1 1 0   28 38 o 28.48773 6.265966 12.92059       4.231441 14.60288       6.472563 11.66494       5.591891 26.76333 8.681306 24.60959 8.074862 2.153738       11.85616 
1 1 1 0   28 39 o 12.02054 5.521090 -0.4385138     3.691458 -4.510536      5.636166 2.620495       4.885051 12.24678 5.953790 15.29053 6.737266 -3.043744      8.991016 
1 1 1 0   28 40 o 19.00499 6.733545 6.727657       3.902210 8.791413       5.964959 5.183681       5.159393 19.74785 7.991065 16.95567 7.191954 2.792177       10.75088 
1 1 1 0   29 1  o 108.1897 3.128282 142.9724       8.238941 142.5498       11.30300 143.4516       12.03463 107.9101 4.306937 108.2192 4.573752 -0.3090973     6.282429 
1 1 1 0   29 2  o 132.6612 3.273953 214.8225       10.58407 201.1563       19.56447 220.4770       12.58460 127.9090 6.296041 134.2947 3.849400 -6.385712      7.379568 
1 1 1 0   29 3  o 366.7841 5.730367 1648.368       51.21876 1718.849       103.9007 1625.742       58.86857 371.2606 11.49814 363.9115 6.638218 7.349060       13.27679 
1 1 1 0   29 4  o 41.83806 4.166202 21.60181       4.191247 22.35104       6.168891 20.95943       5.712069 42.25521 6.173061 40.94093 5.895006 1.314278       8.535677 
1 1 1 0   29 5  o 110.8757 3.134785 150.1670       8.461435 139.3588       11.33593 163.7649       12.71501 106.6781 4.369845 115.6378 4.520830 -8.959686      6.287563 
1 1 1 0   29 6  o 192.2685 3.323110 451.3211       15.57001 434.8763       23.56937 464.0543       20.73970 188.4042 5.138388 194.8211 4.368479 -6.416931      6.744379 
1 1 1 0   29 7  o 116.7552 2.845421 166.3446       8.095782 183.7165       12.80415 154.7742       10.44966 122.5088 4.295560 112.4900 3.817524 10.01881       5.746767 
1 1 1 0   29 8  f 55.01848 3.641196 37.13621       4.854434 47.81448       6.660085 25.03304       7.090529 62.37445 4.410075 44.65076 6.725002 17.72369       8.042041 
1 1 1 0   29 9  o 172.5138 3.122012 363.3178       13.12486 344.0488       19.86589 378.2434       17.48410 167.5772 4.869877 175.9027 4.078822 -8.325455      6.352361 
1 1 1 0   29 10 o 105.1541 2.783456 135.0357       7.126308 136.1214       10.77188 134.1907       9.503179 105.4235 4.201347 104.7294 3.729563 0.6940384      5.617914 
1 1 1 0   29 11 o 44.13132 4.992480 24.15505       5.274896 24.87117       9.422968 23.82822       6.365776 44.01700 9.086080 43.62806 6.158650 0.3889389      10.97660 
1 1 1 0   29 12 o 66.87805 3.962331 54.87594       6.428648 60.38901       11.92158 52.61552       7.633623 69.66035 7.122993 65.37016 4.826009 4.290199       8.603917 
1 1 1 0   29 13 o 133.0149 3.280341 216.1146       10.63299 226.4723       22.51816 213.1424       12.06247 135.4365 6.844969 131.9937 3.753949 3.442795       7.806775 
1 1 1 0   29 14 o 132.1971 3.270922 213.4959       10.53728 187.7640       21.10357 222.0418       12.16183 123.1916 7.059288 134.7162 3.708140 -11.52464      7.973948 
1 1 1 0   29 15 o 99.49593 3.193982 121.0624       7.734118 122.4852       16.83189 120.6817       8.707809 99.39681 6.993673 99.28944 3.604883 0.1073685      7.868077 
1 1 1 0   29 16 o 115.4907 3.604265 163.2628       10.13137 157.7657       19.24697 165.3698       11.91582 112.8041 7.036713 116.1369 4.217349 -3.332817      8.203741 
1 1 1 0   29 17 o 152.3148 3.364644 283.6427       12.48870 289.1165       26.72077 282.1128       14.12658 152.6879 7.201679 151.7810 3.822337 0.9068909      8.153187 
1 1 1 0   29 18 o 85.76054 3.186953 90.03227       6.648798 89.07229       14.95786 90.26865       7.422373 84.46634 7.339705 85.82452 3.556620 -1.358177      8.156030 
1 1 1 0   29 19 o 144.2894 3.008186 254.4769       10.57731 271.1195       18.51410 246.4127       12.88763 148.4014 5.127214 141.8158 3.732417 6.585602       6.341866 
1 1 1 0   29 20 o 105.0346 3.167588 135.0734       8.098423 127.0681       18.97208 136.8570       8.955285 100.6461 7.796123 105.6735 3.482338 -5.027328      8.538513 
1 1 1 0   29 21 o 74.00614 2.962522 67.09717       5.331959 73.98753       10.11405 64.44512       6.274728 77.24722 5.407011 72.43751 3.565594 4.809715       6.476822 
1 1 1 0   29 22 o 50.77734 3.451077 31.74557       4.244946 24.33002       8.292369 34.37890       4.941504 43.32615 8.153155 52.78274 3.868639 -9.456596      9.024428 
1 1 1 0   29 23 o 125.5271 2.885873 192.9162       8.827765 182.6909       15.05634 198.2727       10.89736 121.4368 5.099185 127.0609 3.522837 -5.624153      6.197747 
1 1 1 0   29 24 o 26.49415 5.327633 9.014171       3.320345 15.41336       7.217299 7.296173       3.739585 34.06982 8.672141 23.73551 6.343760 10.33431       10.74473 
1 1 1 0   29 25 f 99.48038 3.812587 122.1781       9.225475 125.4327       12.10033 117.6599       14.25690 100.3466 4.963734 96.65062 6.084061 3.695992       7.852035 
1 1 1 0   29 26 o 78.39509 2.880477 75.58259       5.493516 68.43320       9.714165 78.94404       6.660928 73.71030 5.446529 79.96962 3.425951 -6.259315      6.434424 
1 1 1 0   29 27 f 94.67359 2.857322 110.3386       6.584559 116.1520       11.80576 107.7137       7.933063 96.10295 5.058866 93.30314 3.495240 2.799812       6.148888 
1 1 1 0   29 28 o 50.00188 4.163358 31.40297       5.027029 33.14258       7.677338 30.09733       6.651157 50.39653 6.395155 48.29369 5.765331 2.102837       8.610288 
1 1 1 0   29 29 o 30.15206 4.924028 11.79052       3.493284 17.72063       6.706456 9.582481       4.092281 35.71326 7.914198 26.64484 6.385882 9.068419       10.16927 
1 1 1 0   29 30 o 11.52969 5.128779 -0.7970420     2.897502 -5.197846      5.908396 0.5964698      3.324749 14.09281 6.641145 13.71571 5.793421 0.3771009      8.812975 
1 1 1 0   29 31 o 30.97530 4.655851 12.55154       3.405772 15.00233       6.750463 11.71468       3.944616 31.69057 8.546745 29.42229 5.707613 2.268286       10.27734 
1 1 1 0   29 32 o 33.15238 5.198907 14.75013       4.062131 0.000000       0.000000 14.75013       4.062131 ?        ?        33.15238 5.198907 0.000000       5.198907 
1 1 1 0   29 33 o 20.04789 6.372119 5.732415       3.499745 -0.1299822     5.607009 9.474086       4.479467 15.83645 7.083480 25.17424 7.032361 -9.337788      9.981472 
1 1 1 0   29 34 o 48.51221 4.003211 30.88235       4.690472 26.04949       7.267623 34.33248       6.140560 41.08648 7.536315 50.08710 5.102058 -9.000626      9.100936 
1 1 1 0   29 35 o 22.41168 6.158473 7.570086       3.466697 5.891766       7.916960 7.968229       3.856032 20.51458 8.810567 22.71282 6.585191 -2.198235      10.99958 
1 1 1 0   29 36 o 57.13809 4.068164 43.84563       5.627431 48.02435       11.98744 42.66442       6.373353 49.09893 10.34580 55.42567 4.764886 -6.326744      11.39034 
1 1 1 0   29 37 o 22.89849 6.650210 8.728008       3.929550 10.78890       6.235534 7.370405       5.060960 23.14966 8.471448 20.26960 7.592226 2.880060       11.37573 
1 1 1 0   29 38 o 9.630952 4.672246 -3.919359      3.422699 -8.813090      5.286566 -0.3876789     4.491013 10.51810 5.234567 13.02806 6.021822 -2.509954      7.978912 
1 1 1 0   29 39 o 19.82428 6.698563 7.195687       3.842475 4.101502       5.916167 9.453223       5.053412 16.41711 7.314141 21.36699 7.652773 -4.949884      10.58592 
1 1 1 0   30 0  o 182.7101 7.327148 409.4716       32.55757 0.000000       0.000000 409.4716       32.55757 ?        ?        182.7101 7.327148 0.000000       7.327148 
1 1 1 0   30 1  o 26.35987 7.354320 8.798953       4.902324 0.000000       0.000000 8.798953       4.902324 ?        ?        26.35987 7.354320 0.000000       7.354320 
1 1 1 0   30 2  o 177.0729 3.204939 382.7925       13.82955 362.8737       20.71460 398.8101       18.57563 172.1015 4.944316 180.6096 4.220528 -8.508102      6.500701 
1 1 1 0   30 3  o 102.3608 2.895803 127.9745       7.216090 125.5831       10.67007 129.9901       9.796046 101.2468 4.334670 103.0629 3.907506 -1.816086      5.835920 
1 1 1 0   30 4  o 138.5897 2.942502 234.4261       9.937652 242.2755       15.38329 228.8043       13.01873 140.6609 4.493630 136.7736 3.909995 3.887329       5.956574 
1 1 1 0   30 5  o 112.4013 2.842189 154.2857       7.778787 148.6562       11.57848 158.9170       10.50188 110.1666 4.321243 113.9787 3.786263 -3.812073      5.745340 
1 1 1 0   30 6  o 87.99118 3.371751 94.69380       7.216496 104.7316       14.50342 91.39096       8.319468 92.09238 6.504499 86.37801 3.962916 5.714378       7.616641 
1 1 1 0   30 7  f 45.60602 3.787703 25.59190       4.171579 23.13221       5.846252 28.14329       5.954236 43.05738 5.712592 47.64593 5.213182 -4.588543      7.733756 
1 1 1 0   30 8  o 124.6075 3.200231 189.7276       9.709615 190.3696       17.70901 189.4516       11.61034 124.4046 5.857919 124.4399 3.833250 -0.3535461E-01 7.000644 
1 1 1 0   30 9  o 74.45139 3.221585 67.81901       5.831085 69.50729       7.823710 65.70925       8.745944 75.25611 4.283831 73.07555 4.940363 2.180565       6.538991 
1 1 1 0   30 10 o 25.67459 6.117681 8.423326       3.772949 12.85019       4.845607 1.606809       6.012864 31.75882 6.480721 19.40291 7.958299 12.35591       10.26325 
1 1 1 0   30 11 o 131.8109 3.307383 212.3822       10.61522 202.5648       21.32162 215.6176       12.24000 128.0396 6.858470 132.7450 3.787662 -4.705414      7.834858 
1 1 1 0   30 12 o 187.1333 3.693545 428.1445       16.84343 426.2525       34.17734 428.7514       19.35740 185.5615 7.574046 187.1638 4.244134 -1.602280      8.682099 
1 1 1 0   30 13 f 288.7869 4.780553 1022.314       33.64277 1068.533       69.99488 1008.428       38.36493 292.2542 9.842141 286.5423 5.494265 5.711884       11.27185 
1 1 1 0   30 14 o 106.7028 3.249929 139.2663       8.440718 128.3634       17.15488 142.7489       9.695532 101.7203 6.962584 107.9698 3.690388 -6.249474      7.880136 
1 1 1 0   30 15 o 45.17293 4.321689 25.22831       4.699443 16.34862       9.652391 27.98710       5.380167 35.67830 10.44015 47.53995 4.705769 -11.86164      11.45168 
1 1 1 0   30 16 o 112.4675 3.219015 154.7577       8.813311 142.1108       18.46814 158.4872       10.02897 106.9030 7.129952 113.7536 3.622504 -6.850624      7.997422 
1 1 1 0   30 17 o 254.7337 4.399439 795.9102       27.30988 798.6217       56.07016 795.0668       31.26972 252.2651 9.136004 254.3335 5.045269 -2.068359      10.43654 
1 1 1 0   30 18 o 160.2888 3.450996 314.4754       13.47981 300.9598       28.07232 318.5256       15.36740 155.3618 7.436364 161.2136 3.911674 -5.851761      8.402422 
1 1 1 0   30 19 o 73.69852 3.695871 66.72730       6.616425 0.000000       0.000000 66.72730       6.616425 ?        ?        73.69852 3.695871 0.000000       3.695871 
1 1 1 0   30 20 o 37.45496 4.556437 17.50766       4.073364 30.28897       10.07074 15.00763       4.453960 48.27618 8.887762 34.44230 5.490840 13.83389       10.44709 
1 1 1 0   30 21 o 73.03309 2.997726 65.41411       5.323823 64.38898       9.818405 65.84103       6.336144 71.86591 5.651823 73.17374 3.564035 -1.307831      6.681725 
1 1 1 0   30 22 o 16.94510 6.087430 3.055283       3.200183 -1.823165      6.757082 4.465935       3.633526 17.77246 7.872961 19.42367 6.513659 -1.651207      10.21818 
1 1 1 0   30 23 o 40.17531 3.906213 20.06676       3.776071 16.94054       7.452721 21.14648       4.379882 35.64675 8.665034 41.13567 4.439493 -5.488918      9.736114 
1 1 1 0   30 24 f 24.18435 7.210680 7.572914       4.569012 9.764775       6.739179 5.708374       6.215644 27.51726 8.852558 22.94608 8.447778 4.571184       12.23653 
1 1 1 0   30 25 o 68.73062 2.990510 58.18825       4.996788 56.89587       9.205792 58.72805       5.949477 67.02229 5.690190 68.89583 3.555670 -1.873543      6.709773 
1 1 1 0   30 26 o 38.81661 5.150609 19.24686       4.751931 20.97353       7.354851 18.00961       6.225858 39.42194 7.930974 36.75940 7.207872 2.662544       10.71699 
1 1 1 0   30 27 o 84.13403 3.491899 87.92268       7.143721 100.1763       10.70810 78.09509       9.589673 88.96998 4.958544 78.47484 5.041277 10.49514       7.071184 
1 1 1 0   30 28 o 13.46686 5.488300 1.082491       2.837102 -0.1396064E-01 5.988612 1.399792       3.221565 17.28357 7.541569 14.49673 5.870307 2.786846       9.556975 
1 1 1 0   30 29 o 38.02814 3.885397 18.34986       3.550068 26.91516       7.144072 15.54126       4.090914 44.51982 6.800385 34.51279 5.010413 10.00703       8.446861 
1 1 1 0   30 30 o 10.50965 4.825709 -1.699214      2.817296 3.701202       5.900520 -3.293915      3.206390 19.60952 7.943185 10.24583 4.847569 9.363691       9.305542 
1 1 1 0   30 31 o 43.72265 4.001705 24.61736       4.216482 26.98241       10.43112 24.15545       4.609883 39.88282 10.56569 43.03222 4.460644 -3.149391      11.46870 
1 1 1 0   30 32 o 24.74221 6.189842 8.819182       3.722478 8.134832       6.035788 9.239266       4.728931 23.08015 8.351135 24.69160 7.329381 -1.611450      11.11131 
1 1 1 0   30 33 o 29.41715 5.673417 12.29986       3.919672 13.44526       6.255101 11.55929       5.029657 28.33235 8.434330 27.13791 7.402172 1.194439       11.22186 
1 1 1 0   30 34 o 20.78821 5.942103 6.425693       3.160797 3.795003       5.924123 7.472603       3.737181 18.24072 7.720423 22.07037 6.506541 -3.829657      10.09653 
1 1 1 0   30 35 o 44.89964 4.477974 27.62230       4.834330 36.60919       10.80017 25.37052       5.406162 42.20670 10.53445 42.00190 5.407127 0.2047997      11.84110 
1 1 1 0   30 36 o 11.89981 5.179651 0.5586557      2.810166 -1.807078      5.421775 1.427655       3.286005 13.58206 6.388456 13.40661 5.714967 0.1754541      8.571652 
1 1 1 0   30 37 o 17.89382 5.980140 5.196076       3.062994 6.313725       5.501830 4.694085       3.687251 18.59748 7.618542 17.02382 6.457551 1.573656       9.987100 
1 1 1 0   30 38 o 13.87304 5.676121 2.468891       3.049254 1.626091       5.446010 2.853758       3.680203 14.79775 6.762647 14.67152 6.139859 0.1262331      9.134071 
1 1 1 0   30 39 f 15.01984 6.193191 3.437638       3.666546 8.305353       5.883033 0.3459882      4.688498 19.17949 7.869868 13.24393 6.132545 5.935557       9.977120 
1 1 1 0   31 1  o 46.68449 4.184481 26.86647       4.710037 25.95148       6.258577 28.06154       7.152582 45.63582 5.755485 47.37375 6.355896 -1.737934      8.574556 
1 1 1 0   31 2  o 49.85035 4.708748 30.69070       5.652399 35.91218       8.755775 26.95978       7.401261 53.59587 6.861038 46.34107 6.752354 7.254803       9.626429 
1 1 1 0   31 3  o 89.43925 3.442308 97.86290       7.488632 117.3530       14.70240 91.03513       8.702038 97.53706 6.217985 86.17649 4.156026 11.36057       7.479030 
1 1 1 0   31 4  o 190.8048 4.311133 445.4086       20.04550 486.6381       35.78551 426.5565       24.19824 198.5182 7.410267 186.4476 5.331349 12.07062       9.128819 
1 1 1 0   31 5  o 105.5573 3.322777 136.2338       8.536587 132.8347       16.59594 137.4567       9.954467 103.7026 6.601408 105.9666 3.861354 -2.264038      7.647787 
1 1 1 0   31 6  o 165.9238 3.119734 336.1992       12.61427 337.2413       19.57139 335.4586       16.49826 165.8487 4.847744 165.6080 4.088091 0.2406921      6.341381 
1 1 1 0   31 7  f 124.3066 3.211643 188.8609       9.720614 190.0464       13.33921 187.5184       14.19469 124.5274 4.402639 123.6418 4.719788 0.8855515      6.454427 
1 1 1 0   31 8  o 81.23922 3.248939 80.74960       6.418987 84.82116       8.710053 75.90961       9.496483 83.13663 4.314003 78.53772 4.987672 4.598907       6.594505 
1 1 1 0   31 9  o 97.60514 3.167738 116.4943       7.524583 113.7739       13.09940 117.8339       9.192472 96.08866 5.618783 98.08176 3.853487 -1.993095      6.813229 
1 1 1 0   31 10 o 227.4848 3.629735 632.7291       20.12164 617.0139       30.95936 644.2225       26.47626 224.0121 5.675894 229.2621 4.739018 -5.249924      7.394192 
1 1 1 0   31 11 o 49.61330 4.332834 30.37305       5.185983 23.97002       9.838370 32.83669       6.102649 42.99517 9.629789 51.51128 4.921368 -8.516109      10.81447 
1 1 1 0   31 12 o 283.3679 4.733501 984.8068       32.68656 1034.857       67.90317 969.7113       37.29140 287.3356 9.711562 280.8902 5.447985 6.445343       11.13530 
1 1 1 0   31 13 o 129.3793 3.804249 205.0373       11.98113 0.000000       0.000000 205.0373       11.98113 ?        ?        129.3793 3.804249 0.000000       3.804249 
1 1 1 0   31 14 f 60.65588 3.656529 45.18343       5.379683 42.52465       11.08424 46.00273       6.152971 57.95093 8.067325 61.13610 4.154694 -3.185169      9.074316 
1 1 1 0   31 15 o 83.87771 3.377452 86.20099       6.889422 73.39982       13.91838 90.35529       7.928899 76.50758 7.564203 85.81586 3.800914 -9.308289      8.465466 
1 1 1 0   31 16 o 104.5102 3.251187 133.7510       8.270050 114.7894       16.98883 139.6397       9.467530 95.81529 7.331686 106.7203 3.645791 -10.90500      8.188127 
1 1 1 0   31 17 o 215.9594 4.549978 573.2129       23.94514 0.000000       0.000000 573.2129       23.94514 ?        ?        215.9594 4.549978 0.000000       4.549978 
1 1 1 0   31 18 o 99.18269 3.206809 120.5582       7.740587 131.2366       17.61629 118.0033       8.617008 102.3582 7.106583 98.04855 3.612621 4.309639       7.972111 
1 1 1 0   31 19 o 36.88306 5.159769 17.11676       4.510885 10.91399       10.02164 18.69276       5.051548 30.54343 10.79378 38.48491 5.546290 -7.941473      12.13536 
1 1 1 0   31 20 o 86.81079 3.214044 92.51341       6.787521 104.9959       15.65328 89.62293       7.532504 91.21730 7.097762 85.35410 3.629707 5.863205       7.972013 
1 1 1 0   31 21 o 55.79382 3.589612 38.41878       4.854665 36.34904       10.98742 38.92085       5.411541 52.60309 8.887632 56.07619 3.986089 -3.473099      9.740581 
1 1 1 0   31 22 o 32.41305 4.721829 13.28726       3.620093 14.71101       7.062724 12.77992       4.216031 33.15321 8.651732 31.52803 5.697078 1.625174       10.35901 
1 1 1 0   31 23 o 55.65878 4.665958 38.76730       6.270447 42.15957       8.479885 34.67465       9.314223 57.52315 6.144423 51.48685 7.656250 6.036301       9.816929 
1 1 1 0   31 24 o 69.28400 4.601158 60.09138       7.724466 56.02471       9.240072 69.52867       14.07601 66.38406 5.769063 72.62515 8.090682 -6.241089      9.936862 
1 1 1 0   31 25 o 48.63701 4.467096 29.80131       5.235454 29.65638       7.866455 29.91656       7.014644 47.42299 7.018623 48.05714 6.129075 -0.6341515     9.318081 
1 1 1 0   31 26 o 36.04586 4.236475 16.47330       3.650352 15.46943       7.527112 16.78199       4.174043 32.99284 9.078034 36.17131 4.858121 -3.178467      10.29622 
1 1 1 0   31 27 o 16.09049 5.780718 2.951194       2.885871 -1.901001      5.558655 4.741606       3.376580 15.41763 6.961126 19.20519 6.273131 -3.787561      9.370670 
1 1 1 0   31 28 o 50.72174 3.290216 32.22083       4.044873 39.86700       7.855253 29.46195       4.718512 54.83218 5.975361 48.15230 4.058923 6.679874       7.223558 
1 1 1 0   31 29 f 33.33613 4.264971 14.38496       3.385457 16.76622       6.617129 13.54065       3.940190 33.68888 8.149768 31.86067 5.258148 1.828213       9.698806 
1 1 1 0   31 30 o 12.10184 5.400461 -0.7028269     3.239130 -2.297147      8.435713 -0.4271101     3.508049 17.90997 8.269375 12.82157 5.676604 5.088403       10.03027 
1 1 1 0   31 31 o 13.01284 5.691133 0.1036774      3.427433 4.987646       5.785908 -2.536678      4.254185 19.89046 7.931614 12.44217 5.788762 7.448294       9.819382 
1 1 1 0   31 32 o 20.29313 5.972252 5.995777       3.150899 7.120119       5.763857 5.516567       3.762936 21.52503 8.093932 19.45469 6.628264 2.070341       10.46163 
1 1 1 0   31 33 o 15.06489 5.894572 2.633241       3.141023 4.576415       6.350453 2.003891       3.614057 19.06001 8.026403 14.81406 6.132380 4.245944       10.10095 
1 1 1 0   31 34 o 19.07211 6.556943 5.644989       3.684307 6.758474       8.367944 5.377230       4.103447 20.53185 8.937491 18.69246 6.866969 1.839388       11.27094 
1 1 1 0   31 35 o 12.08740 5.243182 0.6592621      2.858980 0.3562633      5.615711 0.7652715      3.321672 14.94045 6.842671 12.82864 5.606782 2.111811       8.846364 
1 1 1 0   31 36 o 13.54013 5.580553 2.044296       2.975251 1.617835       5.542078 2.216970       3.526520 15.23088 6.906444 14.20097 5.980785 1.029906       9.136124 
1 1 1 0   31 37 o 14.88051 5.853628 3.233637       3.111667 7.338212       6.006403 1.727923       3.637907 18.95229 7.880779 13.61329 5.909705 5.338995       9.850447 
1 1 1 0   31 38 o 13.22404 5.595373 1.973790       3.110118 -1.906633      5.632473 3.675895       3.730378 12.97698 6.218717 15.35198 6.279326 -2.375004      8.837555 
1 1 1 0   32 0  o 57.00108 5.659962 40.13100       7.758252 34.48441       10.33272 47.42834       11.74638 52.33731 8.384483 61.64367 8.008646 -9.306351      11.59474 
1 1 1 0   32 1  o 192.6694 3.366934 453.5692       15.80824 447.9057       24.06711 457.8668       20.96499 191.0320 5.174662 193.3792 4.448863 -2.347198      6.824185 
1 1 1 0   32 2  o 50.38198 3.791631 31.21226       4.621031 32.34347       6.484843 30.04528       6.586593 51.07802 5.286211 49.15694 5.598080 1.921085       7.699515 
1 1 1 0   32 3  o 116.8478 3.232987 166.9223       9.196931 169.2771       12.57201 164.2114       13.48922 117.5020 4.398359 115.6599 4.796359 1.842125       6.507735 
1 1 1 0   32 4  o 42.04112 4.458115 21.88346       4.497793 19.15080       6.059248 25.23706       6.712471 38.90405 6.628704 44.85800 6.315111 -5.953949      9.155345 
1 1 1 0   32 5  o 185.5181 4.190110 421.2679       18.94296 431.1886       23.15431 401.1881       32.94140 187.4239 5.074233 179.9835 7.527194 7.440475       9.077802 
1 1 1 0   32 6  o 91.35619 3.643476 102.2109       8.095021 103.1676       9.684123 99.99209       14.74847 91.68517 4.346739 89.79315 6.790450 1.892014       8.062528 
1 1 1 0   32 7  o 145.8046 3.983784 260.3508       14.14151 302.6476       26.00037 242.5820       16.85214 156.4578 6.835902 140.5466 4.928006 15.91121       8.427028 
1 1 1 0   32 8  o 161.0661 3.553603 317.2341       13.94791 325.1699       28.05815 314.6293       16.07478 162.0415 7.122938 160.2523 4.119695 1.789230       8.228495 
1 1 1 0   32 9  o 123.8782 3.325612 187.7250       10.03020 169.8462       19.25168 194.3863       11.75110 117.0866 6.776180 125.9771 3.832268 -8.890564      7.784786 
1 1 1 0   32 10 o 133.6298 3.381260 218.4773       11.00193 224.0838       22.22742 216.6580       12.66177 134.4979 6.803782 132.9792 3.911532 1.518723       7.848027 
1 1 1 0   32 11 o 17.14260 7.042894 1.224077       4.719182 0.000000       0.000000 1.224077       4.719182 ?        ?        17.14260 7.042894 0.000000       7.042894 
1 1 1 0   32 12 o 63.96165 3.781929 50.26060       5.868488 34.14874       11.08001 56.54266       6.918605 51.50576 9.163594 67.79105 4.208791 -16.28528      10.08392 
1 1 1 0   32 13 o 95.63191 3.298603 112.0083       7.675706 107.7537       15.65674 113.3544       8.806635 92.97158 6.961127 96.13077 3.766629 -3.159187      7.914846 
1 1 1 0   32 14 o 124.4102 3.315680 189.5433       10.04332 214.5491       21.89630 182.8808       11.30237 131.3071 6.866862 122.1053 3.803020 9.201805       7.849634 
1 1 1 0   32 15 o 149.5106 3.906776 274.3295       14.22179 0.000000       0.000000 274.3295       14.22179 ?        ?        149.5106 3.906776 0.000000       3.906776 
1 1 1 0   32 16 o 126.3865 3.729252 196.0693       11.47317 0.000000       0.000000 196.0693       11.47317 ?        ?        126.3865 3.729252 0.000000       3.729252 
1 1 1 0   32 17 o 88.62921 3.257835 96.36990       7.024289 83.97802       14.93342 99.89056       7.959828 81.47215 7.609697 90.16185 3.630225 -8.689697      8.431252 
1 1 1 0   32 18 o 21.45771 6.676937 5.743462       3.862375 5.901594       9.232307 5.709914       4.252388 25.93275 10.11775 21.63827 7.037933 4.294485       12.32483 
1 1 1 0   32 19 o 15.07146 6.232970 0.8830931      3.728701 0.1336897      8.593414 1.056908       4.138587 21.29130 9.162163 15.93080 6.575390 5.360500       11.27745 
1 1 1 0   32 20 o 19.95557 7.688636 3.571040       5.280891 1.581347       8.595886 4.777267       6.692865 22.09718 9.323592 22.55685 8.664804 -0.4596672     12.72824 
1 1 1 0   32 21 o 75.26339 4.781833 70.68647       8.724944 58.34692       12.26885 83.31204       12.41023 67.11983 7.636602 81.03677 6.334672 -13.91694      9.921984 
1 1 1 0   32 22 o 32.29972 6.694314 13.73156       5.095907 15.54509       9.121666 12.90876       6.144111 33.60864 10.22586 30.96483 8.063991 2.643810       13.02291 
1 1 1 0   32 23 o 42.53877 6.105064 23.43229       6.147528 21.47013       7.380655 27.87745       11.10892 39.94771 7.861785 44.25737 10.46584 -4.309658      13.08975 
1 1 1 0   32 24 o 123.8216 2.944244 189.0851       8.883958 179.4390       14.79727 194.5217       11.10889 119.0910 5.110680 125.1377 3.646782 -6.046684      6.278381 
1 1 1 0   32 25 f 13.60400 5.581888 0.9993191      2.959433 6.580363       6.074449 -0.7376719     3.388816 23.10760 8.375501 12.65405 5.591959 10.45355       10.07070 
1 1 1 0   32 26 o 16.46969 5.864723 3.168516       2.963532 4.471998       5.802508 2.708515       3.447012 20.61582 8.027474 16.36298 6.234955 4.252840       10.16440 
1 1 1 0   32 27 o 13.93405 5.519389 1.613238       2.783805 6.046784       5.569207 0.1365187      3.214154 21.78029 8.000183 12.99087 5.596951 8.789421       9.763646 
1 1 1 0   32 28 o 20.11539 6.425296 5.529182       3.554850 0.000000       0.000000 5.529182       3.554850 ?        ?        20.11539 6.425296 0.000000       6.425296 
1 1 1 0   32 29 o 22.41516 6.136964 7.124611       3.449724 6.734047       5.690889 7.351499       4.337503 21.88420 8.078686 22.49438 7.086927 -0.6101818     10.74661 
1 1 1 0   32 30 o 29.07187 5.492102 11.77134       3.748323 16.82477       6.177233 8.826282       4.715719 32.93223 7.815337 24.03242 7.360448 8.899813       10.73572 
1 1 1 0   32 31 o 10.47194 4.824292 -1.518647      2.848181 -5.915540      4.944612 0.6646252      3.484280 11.71325 5.666500 13.47147 5.815852 -1.758217      8.119936 
1 1 1 0   32 32 o 16.14548 6.056803 3.414623       3.223531 10.27828       7.646166 1.931010       3.554891 23.70710 9.219524 14.66253 6.076934 9.044569       11.04214 
1 1 1 0   32 33 o 17.69317 6.498768 4.639439       3.674948 21.47825       8.356713 0.6022528      4.091845 32.56807 9.761568 13.85892 6.133579 18.70915       11.52862 
1 1 1 0   32 34 o 22.40503 5.877668 7.805684       3.248480 12.97524       6.181227 5.833076       3.818286 25.73177 8.492014 18.93408 6.665006 6.797686       10.79521 
1 1 1 0   32 35 o 19.71021 5.980340 6.304655       3.122765 6.968896       5.731479 6.024224       3.724063 19.25821 7.818443 18.83800 6.585990 0.4202175      10.22269 
1 1 1 0   32 36 o 21.52933 6.046050 7.721243       3.301791 16.62483       6.594849 4.742886       3.814264 27.43648 8.750216 16.86409 6.524502 10.57239       10.91492 
1 1 1 0   32 37 o 16.50960 6.000798 4.559413       3.121130 7.545571       5.959888 3.430986       3.663688 18.76856 7.830907 15.13305 6.210107 3.635508       9.994426 
1 1 1 0   33 1  o 22.18899 6.599596 6.154603       3.831074 7.726463       5.354794 4.506329       5.483409 25.07087 7.870900 21.44394 7.927567 3.626932       11.17128 
1 1 1 0   33 2  o 66.82329 3.652947 54.78016       5.925874 52.90487       7.667352 57.56202       9.338510 65.49640 4.838029 68.18587 5.671439 -2.689468      7.454646 
1 1 1 0   33 3  f 53.49570 4.008783 35.22747       5.187970 32.80584       6.515072 39.42410       8.576601 51.41601 5.274472 56.20116 6.374768 -4.785152      8.273918 
1 1 1 0   33 4  o 27.20949 6.069833 9.473340       3.922299 15.72875       5.551092 3.236484       5.542854 35.12480 6.730191 20.21455 7.852949 14.91026       10.34235 
1 1 1 0   33 5  o 67.91165 3.187998 56.49053       5.261197 55.02924       7.624602 57.81871       7.269040 66.81672 4.712932 68.55065 4.374224 -1.733932      6.430052 
1 1 1 0   33 6  o 37.37933 4.516325 17.37585       4.030588 19.77444       5.899034 15.27556       5.520046 39.56625 6.331538 34.58337 6.792439 4.982887       9.285774 
1 1 1 0   33 7  o 22.56874 6.232382 6.474641       3.540525 1.662416       4.887647 11.78766       5.135673 17.80899 7.223696 30.26867 7.088014 -12.45967      10.12036 
1 1 1 0   33 8  o 20.89988 6.699287 5.282158       3.861943 5.621004       5.024965 4.793197       6.036283 22.24276 7.657152 22.27900 8.302268 -0.3624725E-01 11.29423 
1 1 1 0   33 9  o 126.3313 3.263413 195.3144       10.03819 181.7453       13.37869 212.7937       15.18444 121.6139 4.522218 131.5507 4.744400 -9.936859      6.554372 
1 1 1 0   33 10 o 48.52430 3.985421 29.04948       4.671201 25.86973       5.964694 34.09277       7.511863 45.50603 5.489550 52.21688 6.013036 -6.710850      8.141975 
1 1 1 0   33 11 o 61.67232 4.454835 46.94227       6.649994 47.04667       11.73370 46.89287       8.071415 60.86290 8.113163 61.44696 5.446662 -0.5840569     9.771875 
1 1 1 0   33 12 o 139.7760 4.909775 240.7455       16.69765 0.000000       0.000000 240.7455       16.69765 ?        ?        139.7760 4.909775 0.000000       4.909775 
1 1 1 0   33 13 o 31.30996 7.031313 12.67508       5.233245 19.16845       9.348313 9.711404       6.315589 38.12035 9.956487 27.72098 8.523166 10.39937       13.10633 
1 1 1 0   33 14 o 53.80009 5.952356 36.29461       7.673466 0.000000       0.000000 36.29461       7.673466 ?        ?        53.80009 5.952356 0.000000       5.952356 
1 1 1 0   33 15 o 64.10059 4.450974 50.83718       6.909511 51.88272       12.04200 50.32402       8.436453 63.74136 7.923010 63.52071 5.504425 0.2206497      9.647424 
1 1 1 0   33 16 o 74.92789 4.167319 69.32719       7.579178 88.64725       14.60178 62.20237       8.867246 83.70763 7.228981 70.69981 5.182778 13.00781       8.894906 
1 1 1 0   33 17 o 33.20510 6.688215 14.29874       5.224580 14.41109       9.244195 14.24602       6.333042 33.10944 10.33384 32.86335 7.987161 0.2460976      13.06074 
1 1 1 0   33 18 o 22.09950 7.535811 5.824924       4.864097 11.67105       9.117086 3.498790       5.750945 30.38150 10.31780 20.41202 7.979168 9.969475       13.04316 
1 1 1 0   33 19 o 49.84840 4.987827 31.21975       5.977682 30.48805       10.28211 31.59331       7.346825 47.63850 9.190027 49.75207 6.193440 -2.113571      11.08221 
1 1 1 0   33 20 o 38.22355 6.727313 19.07091       6.037529 20.99764       9.567765 17.79604       7.782729 38.90092 10.02888 36.15536 8.895240 2.745552       13.40536 
1 1 1 0   33 21 o 71.35685 3.400138 63.00176       5.895452 57.90342       12.44089 64.47819       6.694881 66.26316 7.857226 72.04440 3.827079 -5.781242      8.739711 
1 1 1 0   33 22 o 39.03133 4.486372 19.28685       4.189710 25.12593       9.022006 17.68139       4.730758 42.55424 8.982619 37.04134 5.399700 5.512905       10.48066 
1 1 1 0   33 23 o 67.80428 3.336667 57.11217       5.496297 72.80312       12.37505 53.25631       6.134564 74.35164 6.909044 65.25126 3.875425 9.100380       7.921730 
1 1 1 0   33 24 o 13.27839 5.544057 0.6941739      2.990295 3.051216       5.501777 -0.2940422     3.562421 19.10720 7.694901 13.34341 5.819565 5.763789       9.647738 
1 1 1 0   33 25 o 46.56372 3.442093 27.21742       3.878154 33.43026       7.018252 24.48647       4.653083 50.33559 5.829231 43.73407 4.426909 6.601513       7.319663 
1 1 1 0   33 26 o 16.67674 5.903653 3.383446       2.999076 5.949515       5.673887 2.388539       3.532953 21.62603 8.051092 15.90301 6.242904 5.723022       10.18793 
1 1 1 0   33 27 o 31.17615 6.792341 13.82441       5.014067 0.000000       0.000000 13.82441       5.014067 ?        ?        31.17615 6.792341 0.000000       6.792341 
1 1 1 0   33 28 o 11.22949 5.153587 -1.656135      3.207495 -3.978410      5.077450 -0.1139924     4.137625 13.02020 6.142037 14.01748 6.187402 -0.9972801     8.718289 
1 1 1 0   33 29 o 9.896359 4.725107 -3.508932      3.188130 -5.221202      5.211692 -2.485032      4.030151 12.49380 5.985774 12.05845 5.618309 0.4353504      8.209438 
1 1 1 0   33 30 o 24.16210 5.619823 8.382194       3.246307 10.27523       5.888637 7.555690       3.890971 24.82123 8.291672 22.33709 6.652783 2.484140       10.63068 
1 1 1 0   33 31 o 48.63591 3.773903 31.08499       4.437870 37.97750       10.28840 29.50942       4.919017 46.00581 9.492032 46.82048 4.361447 -0.8146629     10.44609 
1 1 1 0   33 32 o 40.95509 4.675228 23.27217       4.582539 44.32452       10.57770 18.40803       5.084449 49.36008 9.130059 34.84951 6.215003 14.51058       11.04465 
1 1 1 0   33 33 o 18.35431 6.206641 5.322886       3.298857 6.537477       5.923442 4.776805       3.971803 19.43524 7.926647 17.56082 6.692434 1.874413       10.37403 
1 1 1 0   33 34 o 21.78872 5.946549 7.638872       3.244923 5.357645       5.779201 8.689183       3.921412 17.95250 7.613104 22.50807 6.672587 -4.555571      10.12338 
1 1 1 0   33 35 o 12.73314 5.495405 1.299617       3.109014 3.937218       6.209878 0.4173350      3.591553 16.66503 7.454296 12.50416 5.624982 4.160871       9.338467 
1 1 1 0   34 0  f 135.7546 4.933341 225.7900       16.29329 245.8054       22.15985 202.2359       24.03909 141.3825 6.448816 127.9432 7.746474 13.43929       10.07944 
1 1 1 0   34 1  o 110.0162 3.385353 148.2004       9.065248 165.5773       12.38247 128.1290       13.30789 116.1050 4.384309 101.8986 5.378304 14.20641       6.938900 
1 1 1 0   34 2  o 64.28157 3.373816 50.68573       5.266485 52.76093       7.616636 48.78473       7.289968 65.36638 4.815395 62.84493 4.796371 2.521446       6.796558 
1 1 1 0   34 3  o 92.29625 3.012373 104.2391       6.766231 111.8752       10.21882 98.27768       9.029044 95.39301 4.407816 89.44131 4.153893 5.951706       6.056705 
1 1 1 0   34 4  o 14.20515 6.011031 0.1903906      3.589883 3.772018       4.961363 -3.745312      5.200821 20.03688 7.514640 14.25728 6.550233 5.779600       9.968719 
1 1 1 0   34 5  o 61.82154 3.404185 46.90825       5.108689 48.66172       7.426311 45.33300       7.038807 62.73133 4.896713 60.55066 4.809776 2.180679       6.863800 
1 1 1 0   34 6  o 21.19918 6.356994 5.620529       3.543423 6.552242       4.724213 4.422203       5.357666 23.16712 7.407828 21.16219 7.833832 2.004932       10.78169 
1 1 1 0   34 7  o 43.24541 4.045942 23.13117       4.214291 22.11513       5.952005 24.15262       5.967841 41.89937 6.000427 43.88408 5.716238 -1.984715      8.287371 
1 1 1 0   34 8  o 86.96468 2.974308 92.59409       6.293978 92.47182       9.252514 92.69941       8.586780 86.66156 4.395597 86.83295 4.069297 -0.1713867     5.990029 
1 1 1 0   34 9  o 74.40432 3.351043 67.91853       6.060358 63.09167       7.878819 74.91244       9.483939 71.49694 4.545611 77.82602 5.027565 -6.329079      6.777831 
1 1 1 0   34 10 o 82.38749 2.970865 83.14866       5.954822 81.23000       8.692556 84.84527       8.174112 81.16864 4.411216 83.03563 4.051848 -1.866989      5.989683 
1 1 1 0   34 11 o 61.77568 3.880393 47.02570       5.812058 64.43756       12.47845 42.20192       6.567986 71.45448 7.267313 58.36008 4.656883 13.09439       8.631362 
1 1 1 0   34 12 o 123.2027 3.855814 186.5947       11.56211 0.000000       0.000000 186.5947       11.56211 ?        ?        123.2027 3.855814 0.000000       3.855814 
1 1 1 0   34 13 o 23.05673 6.936776 6.735781       4.214118 5.054904       8.313494 7.317032       4.888743 24.48543 9.587087 24.12819 7.512508 0.3572350      12.17990 
1 1 1 0   34 14 o 62.35274 4.223300 48.12323       6.379305 0.000000       0.000000 48.12323       6.379305 ?        ?        62.35274 4.223300 0.000000       4.223300 
1 1 1 0   34 15 o 28.11547 6.419426 10.28950       4.301243 11.82586       9.243458 9.864897       4.859404 30.65962 10.38930 27.45226 7.182529 3.207355       12.63037 
1 1 1 0   34 16 o 28.55603 6.207797 10.61070       4.196373 12.71793       8.490862 9.929648       4.827105 31.13832 9.928460 27.48870 7.142153 3.649614       12.23048 
1 1 1 0   34 17 o 42.60825 4.579441 22.77417       4.680363 23.36992       10.50069 22.62647       5.228447 41.08978 10.46114 42.30126 5.180018 -1.211475      11.67339 
1 1 1 0   34 18 o 66.90665 3.922710 55.56064       6.367692 54.54062       12.36056 55.92914       7.429409 64.46018 8.043375 66.90681 4.584375 -2.446625      9.258099 
1 1 1 0   34 19 o 67.28539 3.519915 56.08675       5.751435 50.07411       11.99936 57.88009       6.553261 61.36810 8.231158 68.20777 3.959668 -6.839668      9.134054 
1 1 1 0   34 20 o 59.48837 4.193256 44.30613       6.039876 47.81428       11.04674 42.81019       7.213586 59.97814 7.738101 58.07846 5.150166 1.899673       9.295290 
1 1 1 0   34 21 o 36.96962 4.770081 17.46909       4.197354 15.48846       8.850219 18.04387       4.767652 32.81633 10.08948 37.34842 5.394497 -4.532093      11.44108 
1 1 1 0   34 22 o 41.64466 4.429921 22.06105       4.426730 28.01412       9.617166 20.46070       4.986369 44.25105 9.218079 39.74320 5.278986 4.507851       10.62265 
1 1 1 0   34 23 o 34.01699 5.614874 15.29719       4.492240 20.65884       9.453745 13.73346       5.105468 36.82224 10.19011 31.63853 6.822806 5.183708       12.26332 
1 1 1 0   34 24 o 18.62790 6.395841 4.421968       3.505148 7.099935       8.190837 3.821614       3.878194 24.09654 9.491590 18.08945 6.670614 6.007093       11.60118 
1 1 1 0   34 25 o 18.88388 6.856907 4.456451       4.073822 2.594810       7.916121 5.127095       4.751276 20.39364 8.784965 20.10571 7.388665 0.2879276      11.47902 
1 1 1 0   34 26 o 59.63903 4.155496 45.89255       6.001560 49.73461       12.45938 44.73176       6.848425 56.27136 9.418583 58.28383 4.866136 -2.012474      10.60137 
1 1 1 0   34 27 o 43.21484 4.217942 24.42863       4.385432 23.19264       6.995983 25.22866       5.628554 39.32547 7.575022 42.93363 5.506371 -3.608162      9.364885 
1 1 1 0   34 28 o 16.26423 5.968575 3.369015       3.098670 8.184228       5.627307 1.273621       3.712152 22.83467 8.086507 14.44183 6.111925 8.392838       10.13643 
1 1 1 0   34 29 o 10.81338 5.009049 -1.777249      3.132553 -7.174565      7.249917 -0.5382965     3.473534 14.09433 6.828678 12.36272 5.548989 1.731616       8.798984 
1 1 1 0   34 30 o 39.80497 4.658190 21.70783       4.433105 33.50679       9.673269 18.57093       4.987710 42.91423 9.500991 35.60264 5.959310 7.311584       11.21527 
1 1 1 0   34 31 o 11.68338 5.194562 -0.6255849E-01 2.968558 -4.643933      5.266645 2.070712       3.593843 12.32304 5.933217 14.57741 6.081493 -2.254370      8.496330 
1 1 1 0   34 32 o 19.68908 6.058915 6.162094       3.190701 5.877151       5.528152 6.304434       3.907197 18.77750 7.657895 19.46487 6.749623 -0.6873703     10.20788 
1 1 1 0   34 33 o 30.46910 5.180707 13.81222       3.709100 20.43200       6.828649 11.04183       4.417570 32.14281 8.564120 25.16300 6.966606 6.979809       11.03983 
1 1 1 0   34 34 o 15.95556 6.114380 3.991423       3.327296 8.793208       6.377162 2.195311       3.900254 20.12611 8.218489 14.29233 6.161622 5.833779       10.27176 
1 1 1 0   35 1  o 195.2416 3.429898 466.8350       16.31886 506.1436       26.00920 441.3139       20.95719 202.5284 5.274420 189.4686 4.538997 13.05983       6.958591 
1 1 1 0   35 2  o 79.49851 3.447854 77.55000       6.663620 90.64337       8.945992 61.23102       9.987328 85.80085 4.292222 70.12085 5.899409 15.68000       7.295629 
1 1 1 0   35 3  o 15.38736 6.311630 1.033332       3.782289 1.924651       4.865551 -0.3278024     6.012651 17.96926 7.236427 17.77930 7.657500 0.1899605      10.53580 
1 1 1 0   35 4  o 12.01055 5.435938 -1.868526      3.413916 -5.535971      4.110355 6.288307       6.129969 11.19529 5.350728 23.80522 8.439011 -12.60992      9.992356 
1 1 1 0   35 5  o 43.06982 4.697327 23.09752       4.850336 21.74089       6.075603 25.48157       8.054090 41.43702 6.207662 44.53130 7.700427 -3.094280      9.890988 
1 1 1 0   35 6  o 75.92817 3.479832 70.80317       6.421568 66.96413       8.306033 76.50724       10.12453 73.60531 4.654557 78.52945 5.322054 -4.924141      7.070301 
1 1 1 0   35 7  o 142.5243 3.040122 248.6660       10.55884 235.8683       15.72140 259.1825       14.25148 138.2934 4.671728 145.1955 4.031730 -6.902054      6.170890 
1 1 1 0   35 8  f 62.34126 3.257174 47.74971       4.931098 46.80270       7.034825 48.66447       6.913994 61.43501 4.735476 62.69159 4.556787 -1.256580      6.571837 
1 1 1 0   35 9  o 70.76138 3.109975 61.45962       5.349673 55.75508       7.632883 66.96730       7.500027 67.06969 4.699847 73.65424 4.195940 -6.584557      6.300355 
1 1 1 0   35 10 o 47.51179 4.122617 27.98829       4.726011 28.73125       7.542912 27.50813       6.063799 47.49266 6.703641 46.80788 5.415859 0.6847801      8.618024 
1 1 1 0   35 11 o 96.28265 3.382557 113.9340       7.924175 126.6463       16.37039 110.0438       9.055814 100.2712 6.738692 94.47684 3.942042 5.794357       7.807027 
1 1 1 0   35 12 o 95.84989 3.393606 112.9951       7.914134 109.3101       15.73672 114.2426       9.156279 92.87467 7.004769 96.23101 3.912681 -3.356339      8.023457 
1 1 1 0   35 13 o 20.18112 6.968994 4.740713       4.163496 5.606314       8.339484 4.453329       4.805194 24.72752 9.625038 20.41018 7.441676 4.317337       12.16634 
1 1 1 0   35 14 o 71.75984 3.548956 63.56281       6.186837 52.61021       12.28300 67.28616       7.161653 63.53442 8.118647 73.70929 4.002092 -10.17487      9.051473 
1 1 1 0   35 15 o 45.15963 5.146087 25.76158       5.562289 0.000000       0.000000 25.76158       5.562289 ?        ?        45.15963 5.146087 0.000000       5.146087 
1 1 1 0   35 16 f 14.39276 6.152090 0.1226903      3.826468 10.11892       8.357828 -2.528270      4.304047 28.28355 9.867893 13.19360 6.022840 15.08995       11.56071 
1 1 1 0   35 17 o 27.49778 7.910847 10.15912       5.584910 25.80428       9.188217 0.9918687      7.033324 43.37524 8.988308 19.61846 8.361934 23.75679       12.27647 
1 1 1 0   35 18 f 55.94670 3.727833 38.99275       5.053384 50.42884       10.94335 35.89320       5.697188 61.80575 7.413605 53.43034 4.414959 8.375416       8.628639 
1 1 1 0   35 19 o 25.71998 6.958050 8.935560       4.465796 4.834235       7.632453 11.07056       5.506824 22.79861 9.103618 28.40416 7.744433 -5.605545      11.95208 
1 1 1 0   35 20 o 17.34126 6.521981 3.143789       3.742816 19.22177       8.814301 -0.3929525     4.134031 36.22711 9.764536 14.29208 6.250461 21.93503       11.59372 
1 1 1 0   35 21 o 53.72421 4.633796 36.85980       6.007335 29.11915       10.25375 40.90528       7.412739 44.38893 9.746700 56.10949 5.491574 -11.72056      11.18729 
1 1 1 0   35 22 o 27.76575 7.002365 10.78628       4.736427 14.06287       9.193191 9.602239       5.526341 30.28894 10.35930 25.96996 7.970645 4.318977       13.07082 
1 1 1 0   35 23 o 38.61359 5.444101 19.82740       4.980743 17.57686       9.213489 20.75667       5.920403 33.00293 10.31909 38.88317 6.475834 -5.880241      12.18277 
1 1 1 0   35 24 o 20.09743 8.017841 4.530229       5.915103 0.000000       0.000000 4.530229       5.915103 ?        ?        20.09743 8.017841 0.000000       8.017841 
1 1 1 0   35 25 o 45.19365 4.046741 26.45453       4.409638 38.03233       10.31430 23.86504       4.877903 49.31155 8.911206 42.40414 4.805103 6.907413       10.12416 
1 1 1 0   35 26 o 28.28706 5.427567 11.11900       3.605319 20.19969       8.798705 9.286718       3.952354 33.69958 9.996161 25.20242 6.418849 8.497158       11.87960 
1 1 1 0   35 27 o 10.82227 5.010207 -1.823132      3.127097 -5.510109      6.828084 -0.8445742     3.517684 14.35838 6.871670 12.26607 5.537956 2.092302       8.825463 
1 1 1 0   35 28 o 11.08293 5.125689 -1.698426      3.260677 -1.478031      7.338442 -1.752642      3.639701 16.32889 7.599039 11.71309 5.416522 4.615797       9.331886 
1 1 1 0   35 29 o 16.61874 6.178354 3.815310       3.339095 2.279125       5.249475 4.859213       4.327373 16.40490 7.110411 18.25761 6.978848 -1.852711      9.963045 
1 1 1 0   35 30 o 20.04545 6.072498 6.249392       3.221502 8.709278       5.866682 5.187452       3.854649 21.83610 8.175237 18.28284 6.665256 3.553263       10.54799 
1 1 1 0   35 31 o 10.38225 4.852258 -1.685562      3.043744 -4.359433      5.113016 -0.2179157     3.788067 12.02049 5.802150 12.56866 5.703468 -0.5481644     8.136000 
1 1 1 0   35 32 o 35.37220 4.514393 17.79813       3.802766 30.74434       7.103918 12.59837       4.502134 42.59261 7.093652 27.19714 6.809119 15.39547       9.832803 
1 1 1 0   35 33 o 31.80045 4.987400 15.04918       3.737943 22.37313       6.807247 11.88751       4.472569 33.61743 8.347711 25.83850 6.951806 7.778931       10.86333 
1 1 1 0   36 0  o 133.5226 3.994449 218.4026       12.98253 220.8442       21.02865 216.8988       16.50314 133.6866 6.474116 132.8352 5.107720 0.8513947      8.246392 
1 1 1 0   36 1  o 44.31701 4.109802 24.36075       4.387846 21.70037       6.104428 27.20464       6.311453 41.31067 6.259716 46.49996 5.688102 -5.189297      8.458047 
1 1 1 0   36 2  o 65.45100 3.249866 52.63940       5.167224 48.10443       7.411024 56.92968       7.208309 62.21434 4.928468 67.84445 4.383426 -5.630108      6.595773 
1 1 1 0   36 3  o 88.00362 3.010036 94.97237       6.445679 98.58748       9.547974 91.94526       8.737043 89.34346 4.398957 86.33481 4.165101 3.008652       6.057961 
1 1 1 0   36 4  f 69.96139 3.196899 60.12565       5.435933 54.51283       7.771986 65.50107       7.605846 66.25364 4.847324 72.79350 4.306895 -6.539856      6.484281 
1 1 1 0   36 5  f 80.85442 3.050623 80.22613       5.999966 86.79272       8.935696 74.83479       8.096679 83.78930 4.391597 77.81426 4.286398 5.975037       6.136720 
1 1 1 0   36 6  o 102.6644 2.917909 129.2327       7.292674 121.4710       10.64562 136.0959       10.01045 99.12869 4.418025 105.0964 3.915524 -5.967697      5.903412 
1 1 1 0   36 7  o 99.73120 2.998882 122.0371       7.280026 116.3002       10.72535 126.9384       9.913529 96.91705 4.553983 101.4383 4.018374 -4.521255      6.073392 
1 1 1 0   36 8  o 86.29542 3.909274 91.90997       8.199562 97.66092       12.56894 87.64912       10.81875 88.26244 5.877165 83.80988 5.324724 4.452560       7.930558 
1 1 1 0   36 9  o 132.4823 3.328971 215.7841       10.73890 198.8712       14.13788 238.8513       16.51096 126.6713 4.587625 138.6764 4.893446 -12.00510      6.707616 
1 1 1 0   36 10 o 79.72030 3.384276 78.28834       6.559664 86.88096       8.756547 67.30004       9.902283 83.71204 4.306965 73.20432 5.593242 10.50772       7.059342 
1 1 1 0   36 11 o 125.2554 3.962155 193.9369       12.07862 184.5291       20.29038 199.1006       15.03227 120.4065 6.944654 126.4439 4.887753 -6.037376      8.492252 
1 1 1 0   36 12 o 39.10409 5.885903 19.61483       5.435082 27.41487       9.262949 15.51946       6.711930 45.22615 8.720816 34.00388 8.196610 11.22227       11.96817 
1 1 1 0   36 13 o 36.17483 6.265077 16.99840       5.322972 19.36787       8.895167 15.67655       6.643843 37.42790 9.680619 34.11201 8.111599 3.315895       12.62982 
1 1 1 0   36 14 o 84.92572 3.991254 89.63670       8.236980 82.46513       14.02470 93.41317       10.17722 79.64049 7.307817 86.29633 4.859130 -6.655846      8.775838 
1 1 1 0   36 15 o 19.25069 7.620183 3.097822       5.302905 -2.460013      7.268744 9.421842       7.753596 17.74565 7.990868 27.13636 9.501942 -9.390707      12.41535 
1 1 1 0   36 16 o 38.17690 7.645062 19.72503       6.864198 19.73217       9.325418 19.71659       10.14062 37.05821 10.06720 36.79808 10.68194 0.2601280      14.67830 
1 1 1 0   36 17 o 37.63576 7.300764 19.16490       6.454200 0.000000       0.000000 19.16490       6.454200 ?        ?        37.63576 7.300764 0.000000       7.300764 
1 1 1 0   36 18 f 45.00513 5.164345 26.09314       5.561375 34.13419       9.956383 22.44653       6.704856 49.43991 8.574642 40.80590 6.994209 8.634007       11.06542 
1 1 1 0   36 19 o 21.88325 7.295978 6.317545       4.559669 -2.819618      7.793509 11.07288       5.622349 17.77870 8.111572 28.01301 7.897648 -10.23431      11.32124 
1 1 1 0   36 20 o 44.74899 5.058769 26.04113       5.419893 20.11697       9.238387 29.15022       6.692667 36.03581 10.11102 46.79634 6.007212 -10.76053      11.76092 
1 1 1 0   36 21 o 16.44330 6.505782 2.512428       3.863574 18.72282       9.066504 -1.084428      4.270754 34.27831 10.14190 13.75685 6.165523 20.52147       11.86895 
1 1 1 0   36 22 o 22.01824 6.474853 6.804698       3.704778 16.00974       8.384352 4.571388       4.129819 31.41227 9.847069 18.99072 6.902682 12.42155       12.02546 
1 1 1 0   36 23 o 12.58775 5.666331 -1.000464      3.651358 0.000000       0.000000 -1.000464      3.651358 ?        ?        12.58775 5.666331 0.000000       5.666331 
1 1 1 0   36 24 o 39.17096 4.473434 20.27904       4.193663 27.52906       9.786739 18.64840       4.641371 39.97366 10.05693 36.98502 5.301097 2.988636       11.36853 
1 1 1 0   36 25 f 19.96119 6.542009 5.773195       3.670832 5.138411       7.876059 5.949352       4.149026 20.85993 8.868427 20.21898 6.957933 0.6409435      11.27217 
1 1 1 0   36 26 o 23.57793 6.385764 8.317421       3.758867 27.94501       8.846113 3.992721       4.152380 40.34506 9.202025 17.60585 6.808609 22.73921       11.44703 
1 1 1 0   36 27 f 30.08498 5.674851 13.07444       4.007933 20.37532       9.384027 11.44550       4.432556 31.26710 10.46756 27.22103 6.722493 4.046064       12.44033 
1 1 1 0   36 28 o 23.91082 6.663516 9.085959       4.027063 28.32255       9.289427 4.634173       4.468812 37.85715 9.943266 17.94593 7.028262 19.91121       12.17641 
1 1 1 0   36 29 o 23.08990 6.103508 8.349958       3.485797 13.57183       6.242903 5.984463       4.201793 26.56714 8.517810 19.15322 6.962451 7.413923       11.00131 
1 1 1 0   36 30 o 20.55013 6.249093 6.877735       3.407154 3.564299       5.828721 8.597574       4.199309 16.91914 7.410047 22.28860 6.966188 -5.369459      10.17038 
1 1 1 0   36 31 o 18.97285 6.264888 5.991619       3.364032 6.816007       5.987038 5.611262       4.066697 19.03288 7.887139 18.14153 6.803516 0.8913479      10.41608 
1 1 1 0   36 32 o 19.26382 6.314475 6.347715       3.419865 8.409472       6.184595 5.439623       4.104473 19.93506 8.111101 17.69949 6.788917 2.235567       10.57730 
1 1 1 0   37 1  o 41.15698 4.046806 21.09123       4.006315 24.39147       6.087384 18.56949       5.321172 43.81692 5.846817 38.11760 5.920595 5.699318       8.320980 
1 1 1 0   37 2  o 40.70358 4.128625 20.65384       4.038603 22.73606       5.825330 18.72685       5.603991 42.28658 5.806172 38.18382 6.237735 4.102753       8.521794 
1 1 1 0   37 3  o 23.13952 6.140179 6.954784       3.519208 0.5566555      4.727460 14.90734       5.270535 16.36237 6.909658 33.86375 6.624178 -17.50138      9.571996 
1 1 1 0   37 4  o 14.69109 5.935031 1.270116       3.284283 3.219125       4.575432 -0.8015113     4.717164 18.75266 7.174105 15.23211 6.668792 3.520556       9.794926 
1 1 1 0   37 5  o 48.65200 4.137022 29.45108       4.858365 38.89785       8.838594 25.36101       5.815769 55.11974 6.718885 44.77258 5.442017 10.34716       8.646327 
1 1 1 0   37 6  o 99.97588 3.810641 123.4758       9.266882 124.3214       14.60205 122.9056       11.99104 99.28835 6.063951 99.26947 4.972676 0.1887512E-01  7.842131 
1 1 1 0   37 7  o 111.0104 2.974633 151.4522       8.039733 157.6902       12.13044 146.5654       10.73654 112.6930 4.425770 108.8027 4.056481 3.890282       6.003539 
1 1 1 0   37 8  o 108.7866 2.929275 145.4743       7.758474 135.3835       11.31200 154.4374       10.66118 104.3395 4.459204 111.7044 3.922594 -7.364922      5.938960 
1 1 1 0   37 9  o 37.06731 4.363501 17.28218       3.866085 13.76291       5.396830 20.99193       5.540957 32.23835 7.065085 40.46623 5.783247 -8.227879      9.130245 
1 1 1 0   37 10 o 110.8651 2.919307 151.2372       7.880116 142.6897       11.60317 158.5544       10.73565 106.9883 4.460234 113.0858 3.901532 -6.097488      5.925845 
1 1 1 0   37 11 o 44.94315 4.485703 25.41618       4.847260 34.43906       9.947658 22.60674       5.550841 50.64621 8.350845 42.00354 5.559335 8.642673       10.03209 
1 1 1 0   37 12 o 88.89545 3.411203 97.81890       7.375926 120.0733       15.45313 91.25291       8.393799 96.48804 6.612108 85.58735 4.035877 10.90070       7.746500 
1 1 1 0   37 13 o 62.95964 4.234725 49.68246       6.459369 48.82454       11.23549 50.10602       7.894434 60.47150 7.806328 62.78748 5.206318 -2.315979      9.383204 
1 1 1 0   37 14 o 42.67794 5.296448 23.42245       5.390235 31.53563       8.947472 18.80063       6.753235 48.23553 7.884079 37.10809 7.719778 11.12745       11.03420 
1 1 1 0   37 15 o 58.52131 3.781119 42.86705       5.363394 39.87710       10.38768 43.95388       6.262763 53.94615 8.156101 58.99339 4.387807 -5.047245      9.261471 
1 1 1 0   37 16 o 14.55043 6.367332 -0.3635316     4.295837 5.189100       6.660493 -4.318666      5.621311 22.05430 8.596833 14.16738 6.612342 7.886918       10.84567 
1 1 1 0   37 17 o 27.79312 6.323084 10.51636       4.185715 9.849384       8.257778 10.74698       4.855729 26.75472 9.755363 27.79129 7.134086 -1.036570      12.08562 
1 1 1 0   37 18 o 18.85465 7.117721 4.017705       4.467104 0.000000       0.000000 4.017705       4.467104 ?        ?        18.85465 7.117721 0.000000       7.117721 
1 1 1 0   37 19 o 38.89216 4.871566 19.77593       4.516067 29.78801       9.584375 16.91868       5.120074 44.50722 9.142955 35.21891 6.191641 9.288311       11.04219 
1 1 1 0   37 20 f 12.66819 5.635300 -0.6710779     3.498204 2.611788       7.456995 -1.597397      3.961116 19.90697 8.550220 12.77754 5.811607 7.129428       10.33833 
1 1 1 0   37 21 o 17.08376 6.685094 3.147782       4.040293 0.000000       0.000000 3.147782       4.040293 ?        ?        17.08376 6.685094 0.000000       6.685094 
1 1 1 0   37 22 o 11.96197 5.477623 -1.620819      3.596633 -8.097310      8.036132 0.1420748E-02  4.021932 15.05268 7.267786 13.90040 6.119402 1.152274       9.500937 
1 1 1 0   37 23 o 29.57253 5.774470 12.33006       4.012014 20.31026       8.905150 10.29778       4.493931 33.61146 10.07737 26.19821 6.932469 7.413252       12.23162 
1 1 1 0   37 24 o 15.84409 6.220719 2.833934       3.508346 0.4881321E-01  7.395350 3.642769       3.985353 17.38615 7.920590 17.17546 6.662587 0.2106934      10.35016 
1 1 1 0   37 25 o 13.93589 5.896837 1.272059       3.454535 2.789056       7.756917 0.8967471      3.858276 18.81920 8.380270 14.10586 6.104920 4.713338       10.36817 
1 1 1 0   37 26 o 12.38980 5.629552 -0.7827594     3.705165 -1.098401      7.618495 -0.6849734     4.240431 16.43976 7.681134 13.22590 6.014552 3.213858       9.755750 
1 1 1 0   37 27 o 16.59091 6.561784 3.701542       3.929054 4.480239       8.357086 3.480580       4.451739 19.11903 8.592230 16.65195 6.840769 2.467077       10.98283 
1 1 1 0   37 28 o 15.14804 6.213223 2.743034       3.665083 29.66223       9.430295 -2.046536      3.977796 37.09833 10.14250 11.70262 5.494231 25.39571       11.53503 
1 1 1 0   37 29 o 17.97275 6.508200 5.254873       3.666685 11.18888       7.960194 3.656715       4.131041 22.12892 9.124990 16.17810 6.611490 5.950819       11.26842 
1 1 1 0   37 30 f 30.17854 6.047591 14.50914       4.292435 20.57276       10.36866 13.25502       4.715483 25.80310 10.50096 27.56685 7.005904 -1.763748      12.62351 
1 1 1 0   38 0  o 190.3367 4.461380 445.9372       20.69320 494.1064       36.08031 422.3258       25.26078 198.4162 7.475397 184.5992 5.621955 13.81706       9.353499 
1 1 1 0   38 1  o 51.33684 3.502014 32.66274       4.354866 39.01030       6.525337 27.56515       5.847662 55.71435 4.854605 46.64227 5.235026 9.072079       7.139516 
1 1 1 0   38 2  o 78.97289 3.488651 77.09849       6.697282 89.40986       12.44597 72.08063       7.945753 83.83630 6.134473 76.06874 4.303959 7.767563       7.493719 
1 1 1 0   38 3  o 118.8430 3.368886 174.2947       9.746698 154.9645       17.33565 183.2294       11.78592 110.1790 6.485302 121.5483 3.984426 -11.36933      7.611491 
1 1 1 0   38 4  f 20.00533 6.803013 4.833195       3.963703 0.2650951      6.131066 8.113466       5.195449 18.02263 7.747057 24.92185 7.742185 -6.899218      10.95255 
1 1 1 0   38 5  o 52.34785 3.458419 33.97839       4.387049 32.54589       6.047446 35.56972       6.373863 50.76811 4.950989 53.08065 4.985921 -2.312534      7.026500 
1 1 1 0   38 6  o 19.60714 6.298534 4.830111       3.412393 8.420279       4.638224 0.5939462      5.038262 25.18538 7.197810 16.70938 7.098037 8.476004       10.10894 
1 1 1 0   38 7  o 25.70207 5.677313 8.664039       3.460874 7.219327       4.829695 10.18887       4.961809 23.58204 7.484415 27.54933 7.281805 -3.967291      10.44228 
1 1 1 0   38 8  o 69.54311 3.051358 59.73687       5.158518 57.14731       7.297915 62.32264       7.292580 67.49725 4.461899 70.58725 4.259359 -3.090004      6.168523 
1 1 1 0   38 9  o 35.82616 4.317602 16.24436       3.693551 10.68917       4.963896 23.13525       5.528548 28.12457 7.209692 42.41730 5.476153 -14.29273      9.053613 
1 1 1 0   38 10 o 51.38685 3.431808 32.85786       4.272821 21.50148       5.649267 48.03909       6.531693 40.65665 5.871885 61.80648 4.364734 -21.14984      7.316416 
1 1 1 0   38 11 o 45.22868 5.112978 26.21313       5.536694 34.98277       9.672995 21.93997       6.752199 50.63267 8.113495 40.42120 7.114591 10.21147       10.79102 
1 1 1 0   38 12 o 19.86481 7.270635 4.546381       4.593372 -6.674560      7.005699 13.00760       6.083498 15.16094 7.170763 30.51328 8.061927 -15.35234      10.78956 
1 1 1 0   38 13 o 22.81573 7.211351 6.977877       4.487795 5.206631       7.385976 8.014524       5.650461 22.61223 8.979597 24.39780 8.121611 -1.785570      12.10759 
1 1 1 0   38 14 o 37.97374 4.857430 18.63897       4.392177 22.85676       8.148509 16.91170       5.214531 39.91397 8.629358 35.49794 6.256560 4.416027       10.65882 
1 1 1 0   38 15 o 23.14240 6.739902 7.366012       4.031191 8.232179       7.576695 7.024004       4.760994 24.93946 9.299945 22.72706 7.450476 2.212399       11.91632 
1 1 1 0   38 16 o 38.21066 4.807192 19.00548       4.377388 24.31331       8.833551 17.27784       5.039680 40.22535 9.210479 35.79903 5.988245 4.426315       10.98599 
1 1 1 0   38 17 o 19.04864 6.624294 4.702199       3.764740 9.123407       7.148363 3.005203       4.428701 25.15857 9.090310 17.54332 6.957599 7.615253       11.44735 
1 1 1 0   38 18 o 44.66727 4.285422 25.81280       4.607496 36.74672       9.488614 22.43925       5.270581 50.07219 8.048968 40.92666 5.417579 9.145531       9.702374 
1 1 1 0   38 19 o 13.74130 5.972376 0.2434124      3.724630 -3.397666      7.473744 1.446543       4.296151 16.40338 7.645455 15.62559 6.592114 0.7777853      10.09500 
1 1 1 0   38 20 o 19.87549 7.070507 5.477102       4.306405 0.000000       0.000000 5.477102       4.306405 ?        ?        19.87549 7.070507 0.000000       7.070507 
1 1 1 0   38 21 o 29.38168 5.825308 12.18333       4.023518 14.41548       8.226025 11.48137       4.612982 28.54576 9.798151 27.78629 6.855498 0.7594700      11.95833 
1 1 1 0   38 22 o 10.66362 5.049084 -3.156803      3.491106 4.449611       8.417034 -4.737228      3.836685 20.54332 8.952767 10.46153 5.043778 10.08178       10.27578 
1 1 1 0   38 23 o 25.89871 6.249480 9.959438       3.898616 13.65063       8.684585 9.027845       4.362938 26.62316 9.950916 24.09277 7.010332 2.530390       12.17233 
1 1 1 0   38 24 o 17.25247 6.489943 4.099581       3.706556 5.351385       7.918162 3.748306       4.194497 20.09649 8.721464 17.09876 6.774373 2.997736       11.04337 
1 1 1 0   38 25 o 14.74049 6.331257 1.625327       4.088840 -1.240862      7.907345 2.671416       4.777081 16.41112 7.717868 16.25001 6.907584 0.1611099      10.35762 
1 1 1 0   38 26 o 15.47388 6.323876 2.875757       3.779572 8.036344       8.077674 1.429240       4.276600 20.79801 8.915326 14.56379 6.363570 6.234220       10.95345 
1 1 1 0   38 27 o 14.48468 6.223449 1.885331       3.953246 3.845423       8.497655 1.343946       4.465950 18.19582 8.364511 14.50550 6.414354 3.690321       10.54082 
1 1 1 0   38 28 o 30.01999 6.188767 14.35745       4.376895 20.70021       10.15227 12.90938       4.850862 26.74783 10.55748 27.10084 7.216946 -0.3530121     12.78846 
1 1 1 0   38 29 o 36.63464 5.425935 20.33219       4.697734 26.15382       10.33523 18.81622       5.274036 29.79410 10.90583 33.60556 6.675531 -3.811460      12.78671 
1 1 1 0   39 1  o 58.52882 4.407716 43.08763       6.240459 0.000000       0.000000 43.08763       6.240459 ?        ?        58.52882 4.407716 0.000000       4.407716 
1 1 1 0   39 2  o 59.01335 3.451069 43.28235       4.941293 41.38911       6.974721 45.19013       7.001441 57.06207 5.068514 59.74372 4.850742 -2.681656      7.015664 
1 1 1 0   39 3  o 20.06660 6.232062 5.202130       3.366622 1.902163       4.364239 10.05174       5.290627 16.82804 6.825903 27.17277 7.661249 -10.34473      10.26098 
1 1 1 0   39 4  o 18.19320 6.260307 3.985945       3.358724 1.263414       4.453641 7.576466       5.114551 16.32359 6.786764 23.96593 7.712220 -7.642338      10.27319 
1 1 1 0   39 5  o 37.40998 4.400762 17.76562       3.935260 17.14283       5.438772 18.44995       5.701087 35.95316 6.444379 37.30057 6.508612 -1.347408      9.159260 
1 1 1 0   39 6  o 44.38383 3.925896 24.75428       4.202450 28.65267       5.917570 20.78771       5.969090 47.24907 5.226702 39.65699 6.394044 7.592087       8.258463 
1 1 1 0   39 7  o 40.80337 4.023754 21.00158       3.948941 19.15321       5.448735 23.04659       5.731264 38.14277 6.064844 42.06001 5.741442 -3.917240      8.351437 
1 1 1 0   39 8  o 24.08002 6.048115 7.781162       3.543808 6.079762       4.810045 9.801131       5.241050 21.82980 7.492464 26.65058 7.662306 -4.820778      10.71671 
1 1 1 0   39 9  o 17.19697 6.240670 3.359944       3.373814 4.867853       4.079117 0.9471111E-01  6.002549 19.81120 6.894981 17.35190 7.561205 2.459301       10.23292 
1 1 1 0   39 10 o 32.26501 4.687713 13.45597       3.578015 18.37804       5.009179 8.328629       5.112561 37.35042 5.682345 24.60087 7.686080 12.74956       9.558497 
1 1 1 0   39 11 o 13.15072 5.901208 -1.257260      3.925781 4.259265       6.467928 -4.474968      4.939758 20.90472 8.369261 12.92076 6.083755 7.983969       10.34682 
1 1 1 0   39 12 o 32.24104 5.599219 13.84413       4.239670 16.88968       7.932026 12.62606       5.016363 33.49169 9.358708 30.10652 6.974431 3.385176       11.67168 
1 1 1 0   39 13 o 13.75726 6.193660 -1.342383      4.364356 -0.6697212     6.655450 -1.849864      5.780817 17.35790 7.743888 15.54831 7.051673 1.809591       10.47348 
1 1 1 0   39 14 o 13.83113 5.958135 0.3027595      3.641394 -2.864707      6.584369 1.698372       4.370595 15.94991 7.343287 16.19300 6.727046 -0.2430925     9.958766 
1 1 1 0   39 15 o 21.08689 6.745904 6.174683       3.917313 -7.625815      7.026400 12.39874       4.718700 14.34977 6.894658 29.59902 6.698758 -15.24924      9.612995 
1 1 1 0   39 16 o 23.85604 6.593281 8.141951       3.960626 12.91870       7.388366 6.215781       4.691693 28.41510 9.279273 21.15190 7.392450 7.263203       11.86395 
1 1 1 0   39 17 o 48.88640 4.205303 31.04818       4.961172 34.97615       9.782777 29.68821       5.756304 47.45016 8.783773 47.13099 5.092665 0.3191681      10.15332 
1 1 1 0   39 18 o 14.45978 6.416043 -0.1602438     4.505930 0.000000       0.000000 -0.1602438     4.505930 ?        ?        14.45978 6.416043 0.000000       6.416043 
1 1 1 0   39 19 o 30.19974 5.933635 12.92441       4.210944 16.76034       9.040644 11.86164       4.758661 30.19131 10.27414 28.15678 6.972352 2.034527       12.41659 
1 1 1 0   39 20 o 9.685393 4.725423 -5.641457      3.639503 -13.06289      7.208990 -3.102843      4.216275 12.47724 6.193222 11.96059 5.628228 0.5166578      8.368568 
1 1 1 0   39 21 f 11.17592 5.325425 -3.787128      4.007909 0.000000       0.000000 -3.787128      4.007909 ?        ?        11.17592 5.325425 0.000000       5.325425 
1 1 1 0   39 22 o 11.29467 5.241318 -1.829914      3.452942 7.217957       7.079008 -4.654667      3.955391 21.24981 8.665897 10.58028 5.106046 10.66953       10.05830 
1 1 1 0   39 23 o 10.09657 4.931577 -5.747582      3.996186 -1.497627      6.921873 -7.872307      4.894211 15.59743 7.298636 10.69973 5.272548 4.897700       9.003880 
1 1 1 0   39 24 o 17.44781 6.629638 4.504059       3.890405 19.18969       8.867438 1.003524       4.329314 29.13148 10.16425 14.34459 6.330563 14.78689       11.97447 
1 1 1 0   39 25 o 18.04510 6.740373 5.145518       3.983366 14.02893       8.329742 2.511703       4.535594 24.68053 9.615819 15.58343 6.680292 9.097107       11.70856 
1 1 1 0   39 26 o 20.00041 6.685803 6.744020       3.828482 6.177272       8.339293 6.895368       4.309461 19.12654 8.590364 19.92013 7.074383 -0.7935905     11.12840 
1 1 1 0   39 27 f 20.62312 7.415980 7.886594       4.750776 17.46740       9.690306 4.855176       5.450789 24.84081 10.13575 17.51849 7.409725 7.322327       12.55537 
1 1 1 0   40 0  o 96.29303 4.661279 115.5207       10.90546 129.2511       14.84918 99.44353       16.06815 101.1171 6.053895 87.73895 7.589704 13.37817       9.708411 
1 1 1 0   40 1  o 21.58365 6.273299 6.251981       3.495503 5.609984       4.602664 7.126874       5.373040 21.04350 7.324091 23.22297 7.920223 -2.179464      10.78760 
1 1 1 0   40 2  o 13.32923 5.616008 0.5557254      3.111548 -1.200116      4.196584 2.699541       4.637106 13.71146 6.130917 17.77811 7.096881 -4.066648      9.378372 
1 1 1 0   40 3  o 39.23772 4.961440 19.90723       4.638154 18.07361       7.766277 20.92381       5.782660 35.22204 9.012203 39.63979 6.188439 -4.417751      10.93236 
1 1 1 0   40 4  o 21.37194 6.762020 6.092302       3.945038 10.63111       6.691397 3.674108       4.884176 27.34636 8.823255 19.00277 7.374541 8.343590       11.49929 
1 1 1 0   40 5  o 16.08806 6.714060 1.342697       4.382606 3.134129       6.420693 -0.2200412     5.996871 19.96203 8.209598 17.02360 7.484097 2.938435       11.10897 
1 1 1 0   40 6  o 64.40690 3.529665 52.00135       5.518723 54.19485       7.271243 49.02090       8.475808 65.12000 4.611869 61.13410 5.757113 3.985901       7.376563 
1 1 1 0   40 7  o 74.34340 3.380065 69.13934       6.107535 65.58931       7.876152 74.49371       9.672803 71.66781 4.532990 75.79498 5.269736 -4.127174      6.951124 
1 1 1 0   40 8  o 70.50370 3.054712 61.95888       5.235841 53.35770       7.277718 71.18716       7.538354 64.45609 4.664915 74.88430 4.147143 -10.42821      6.241813 
1 1 1 0   40 9  o 47.82231 3.589074 28.87054       4.152111 26.07376       5.838871 31.73166       5.905642 44.40614 5.514147 49.38337 4.975128 -4.977226      7.426824 
1 1 1 0   40 10 o 38.22110 4.273779 18.82328       3.912564 21.64650       5.452788 15.82716       5.617278 40.20280 5.727578 33.47550 7.105950 6.727295       9.126865 
1 1 1 0   40 11 o 18.99166 6.713969 4.639128       3.877777 -1.863337      6.244368 8.720892       4.947359 16.00312 7.285736 24.58290 7.540937 -8.579775      10.48559 
1 1 1 0   40 12 o 18.23887 6.748428 4.063673       3.975019 9.141679       7.235612 1.868620       4.757198 24.92202 9.124654 16.69660 6.983540 8.225422       11.49039 
1 1 1 0   40 13 o 16.31077 6.418937 2.700042       3.743070 1.550516       6.719258 3.217275       4.507181 18.38831 8.006540 17.63275 7.010599 0.7555523      10.64205 
1 1 1 0   40 14 o 34.07713 5.512578 15.85071       4.421536 11.14260       7.567597 18.29098       5.448209 26.34494 9.372764 35.98272 6.450265 -9.637777      11.37781 
1 1 1 0   40 15 o 14.84958 6.205858 1.454749       3.752015 -5.126237      6.700429 4.460920       4.528601 14.65420 6.955026 18.79809 7.150398 -4.143889      9.974998 
1 1 1 0   40 16 o 12.93927 6.027290 -2.736350      4.633934 0.000000       0.000000 -2.736350      4.633934 ?        ?        12.93927 6.027290 0.000000       6.027290 
1 1 1 0   40 17 o 15.22447 6.296096 1.905786       3.804485 0.7949768      6.844336 2.402467       4.576678 17.50339 7.827816 16.52900 6.876654 0.9743919      10.41936 
1 1 1 0   40 18 o 14.68802 6.155348 1.578339       3.706640 6.098598       7.021892 -0.1677531     4.364214 20.99131 8.603900 14.05299 6.270049 6.938319       10.64615 
1 1 1 0   40 19 o 33.46285 5.489871 15.81881       4.321629 25.08539       9.252332 13.23298       4.887547 36.53479 10.06953 29.33449 6.945344 7.200304       12.23247 
1 1 1 0   40 20 o 24.74467 6.443342 9.362519       3.922976 2.314361       6.945457 12.66451       4.753913 17.83671 7.937088 28.47598 6.919624 -10.63927      10.52989 
1 1 1 0   40 21 o 18.68998 6.734931 5.296199       3.920664 6.923307       7.960901 4.775178       4.504864 20.78696 8.879169 18.18884 7.075765 2.598118       11.35368 
1 1 1 0   40 22 o 16.32842 6.898756 2.975306       4.716388 9.242645       7.674800 -0.8277318     5.978480 21.92136 8.991168 14.87054 6.899330 7.050818       11.33322 
1 1 1 0   40 23 o 16.68452 6.902437 3.659400       4.574845 0.000000       0.000000 3.659400       4.574845 ?        ?        16.68452 6.902437 0.000000       6.902437 
1 1 1 0   40 24 o 25.48006 6.792538 10.83918       4.294258 23.94910       8.768559 6.702858       4.925330 32.58350 10.04730 19.58510 7.455303 12.99839       12.51118 
1 1 1 0   40 25 o 13.22202 5.882463 0.7027014      3.813111 13.18604       8.033034 -2.928146      4.332297 23.47201 9.350413 11.59454 5.528210 11.87747       10.86238 
1 1 1 0   41 1  o 13.68751 5.687756 0.9819131      3.125669 -1.384931      4.307921 3.613070       4.542096 13.60251 6.136101 18.35994 7.115311 -4.757431      9.395711 
1 1 1 0   41 2  o 17.69552 6.002245 4.011307       3.085299 1.615733       4.430386 6.267026       4.299117 16.21912 6.758247 21.43039 7.082522 -5.211271      9.789588 
1 1 1 0   41 3  o 14.32363 5.882148 1.329817       3.289953 2.770253       4.196241 -0.9681607     5.300128 17.08003 6.772962 15.36608 6.878983 1.713952       9.653673 
1 1 1 0   41 4  o 45.88718 4.591615 27.29179       5.065550 26.51250       5.973970 29.28572       9.555891 44.57504 5.624635 43.90726 9.224721 0.6677742      10.80426 
1 1 1 0   41 5  o 26.85748 6.528657 10.12851       4.230734 12.99606       4.964307 2.519218       8.086781 30.30419 6.880083 20.49620 8.854425 9.807991       11.21322 
1 1 1 0   41 6  o 55.24640 3.452656 38.55025       4.625053 27.77836       6.239269 51.68920       6.890779 45.44248 5.763716 63.24900 4.500125 -17.80652      7.312424 
1 1 1 0   41 7  o 25.02995 6.235307 8.783543       3.789046 7.555387       5.653434 9.785134       5.105415 23.07309 8.111010 25.82309 7.602797 -2.750006      11.11715 
1 1 1 0   41 8  o 40.35349 5.081843 21.62932       4.886756 29.41572       8.056241 17.09665       6.146690 45.04855 7.609393 34.14053 7.585187 10.90802       10.74420 
1 1 1 0   41 9  o 34.32586 5.412457 15.94670       4.377613 19.64535       7.788090 14.23840       5.292881 35.25403 9.027205 31.31401 7.100301 3.940016       11.48498 
1 1 1 0   41 10 o 29.56784 6.610436 12.52781       4.643288 6.668339       6.344737 19.28507       6.813496 22.05908 8.445831 35.71194 8.025311 -13.65285      11.65065 
1 1 1 0   41 11 o 32.69234 5.682511 14.73793       4.362888 10.66306       7.367140 16.93896       5.414461 25.82288 9.241088 34.35445 6.708267 -8.531567      11.41922 
1 1 1 0   41 12 o 28.34988 6.103003 11.40036       4.091396 13.20020       7.870183 10.73381       4.789453 27.95226 9.584228 26.80001 7.186563 1.152250       11.97932 
1 1 1 0   41 13 o 32.18392 5.711084 14.43857       4.315097 15.00550       8.314164 14.22956       5.048249 29.22185 9.853399 31.11425 6.844372 -1.892397      11.99729 
1 1 1 0   41 14 o 19.93348 7.356298 5.585504       4.718019 0.000000       0.000000 5.585504       4.718019 ?        ?        19.93348 7.356298 0.000000       7.356298 
1 1 1 0   41 15 o 18.13298 7.090951 4.135650       4.543262 0.000000       0.000000 4.135650       4.543262 ?        ?        18.13298 7.090951 0.000000       7.090951 
1 1 1 0   41 16 f 27.86574 6.410951 11.54528       4.262775 11.33310       7.891610 11.63269       5.065332 25.08838 9.462756 27.10458 7.442703 -2.016203      12.03900 
1 1 1 0   41 17 o 10.50473 5.041175 -4.080755      3.730911 -0.9541544E-01 6.631642 -5.926285      4.512829 16.37043 7.474205 10.96833 5.331185 5.402098       9.180701 
1 1 1 0   41 18 o 17.33121 6.714165 4.049417       4.043266 7.856885       8.320280 2.872307       4.626242 21.72563 9.170181 16.51266 6.895225 5.212973       11.47329 
1 1 1 0   41 19 o 25.06816 6.720392 9.972590       4.188926 15.49652       8.637306 8.273752       4.789945 26.86915 9.946588 22.20626 7.478952 4.662889       12.44465 
1 1 1 0   41 20 o 13.28617 6.092645 -0.7752379     4.470878 1.310771       7.256256 -2.051752      5.676327 16.94110 7.766144 13.95997 6.556941 2.981131       10.16398 
1 1 1 0   41 21 o 12.13583 5.594740 -1.119429      3.840072 12.59231       8.123673 -5.064866      4.357664 23.93818 9.445379 10.82125 5.254858 13.11694       10.80873 
1 1 1 0   41 22 o 12.16251 5.610979 -1.021450      3.872105 7.746228       8.085508 -3.630614      4.410783 20.22837 8.795608 11.46404 5.496197 8.764330       10.37164 
1 1 1 0   41 23 o 15.12460 6.355874 2.653399       3.969019 14.55116       8.700791 -0.4729526     4.460104 24.17487 9.697234 13.16755 6.055539 11.00732       11.43267 
1 1 1 0   42 0  o 27.84799 8.227049 10.75387       5.969738 11.62046       7.171434 8.798191       10.77326 28.80460 9.117460 27.52596 10.87215 1.278646       14.18914 
1 1 1 0   42 1  o 24.36336 6.257964 8.429403       3.734747 5.892193       4.933595 11.83489       5.715770 20.78118 7.545860 27.87290 7.998068 -7.091721      10.99587 
1 1 1 0   42 2  o 15.59630 6.151877 2.404500       3.445098 1.246710       4.520999 4.007802       5.320189 15.73996 6.706330 19.02995 7.599960 -3.289983      10.13579 
1 1 1 0   42 3  o 29.75649 4.824873 11.83276       3.378961 12.26114       5.077367 11.49220       4.526997 28.83678 7.237502 28.24811 6.681697 0.5886707      9.850204 
1 1 1 0   42 4  o 26.20894 5.678352 9.539781       3.521655 9.884383       5.049402 9.213399       4.914098 25.67238 7.561651 24.84798 7.494111 0.8244038      10.64614 
1 1 1 0   42 5  o 13.76842 5.706440 1.217315       3.134697 0.4461858      4.187456 2.200309       4.727830 14.57444 6.333549 16.76653 6.983495 -2.192088      9.427781 
1 1 1 0   42 6  o 38.50953 4.528126 19.54671       4.168242 24.11692       5.611123 13.91940       6.226329 42.01462 5.621335 29.85519 8.272705 12.15944       10.00185 
1 1 1 0   42 7  o 63.62349 3.535820 51.63519       5.460498 62.29668       7.756935 41.16194       7.688146 68.79876 4.654114 54.70250 5.858517 14.09626       7.482178 
1 1 1 0   42 8  o 40.99241 5.053824 22.61349       4.941700 20.33672       5.648277 30.04402       10.20388 37.86810 6.345030 41.89643 10.11089 -4.028336      11.93690 
1 1 1 0   42 9  o 38.40943 4.714343 19.69684       4.320173 16.58247       5.631370 24.15149       6.734978 33.40284 7.135025 40.55626 7.071609 -7.153416      10.04571 
1 1 1 0   42 10 o 11.53391 5.204794 -0.9163232     3.102664 -1.755668      3.921541 0.4884090      5.073216 12.36421 5.683199 15.55232 6.858674 -3.188110      8.907310 
1 1 1 0   42 11 o 13.20432 5.966430 -0.8818348     4.092829 0.5501130      6.556943 -1.795892      5.238711 17.05947 7.643091 14.23020 6.551004 2.829275       10.06640 
1 1 1 0   42 12 o 25.98075 7.403585 10.57063       4.914218 0.000000       0.000000 10.57063       4.914218 ?        ?        25.98075 7.403585 0.000000       7.403585 
1 1 1 0   42 13 o 12.92537 5.985280 -1.974924      4.466704 0.000000       0.000000 -1.974924      4.466704 ?        ?        12.92537 5.985280 0.000000       5.985280 
1 1 1 0   42 14 o 21.22892 6.898529 6.958864       4.086101 8.564727       8.073096 6.405799       4.737769 22.56736 9.234879 20.42055 7.397475 2.146812       11.83240 
1 1 1 0   42 15 o 25.62778 6.826271 10.27799       4.339257 -2.506235      7.936180 15.72976       5.182542 16.24195 7.667002 31.90456 6.869211 -15.66261      10.29412 
1 1 1 0   42 16 f 14.45385 6.116748 1.662967       3.717747 -4.930185      7.021762 4.231151       4.382407 14.33498 6.888803 17.58909 6.938296 -3.254102      9.777298 
1 1 1 0   42 17 o 16.09907 6.468990 3.228685       3.879079 3.218160       7.546848 3.232464       4.522177 18.23958 8.183610 16.52718 6.852264 1.712397       10.67356 
1 1 1 0   42 18 o 13.01274 6.023897 -1.285845      4.519383 -0.5548411     8.352991 -1.588405      5.373881 16.75534 7.896016 13.84540 6.463093 2.909942       10.20385 
1 1 1 0   42 19 o 13.78292 6.071300 0.8975536      3.964448 16.15414       8.496238 -3.348751      4.482327 26.52478 9.856445 11.77582 5.616996 14.74897       11.34461 
1 1 1 0   42 20 o 16.41331 6.435101 3.865967       3.749804 1.432823       7.328566 4.728898       4.364387 16.64012 7.691768 17.54725 6.923327 -0.9071312     10.34871 
1 1 1 0   43 1  o 21.15698 6.086042 6.442715       3.305681 11.52187       5.022395 2.560584       4.390869 27.47010 7.356149 16.55492 6.796605 10.91518       10.01533 
1 1 1 0   43 2  f 12.69197 5.556324 0.4960307E-01  3.274147 0.5461485      4.178590 -0.7400892     5.269619 14.48584 6.310542 14.97555 6.768100 -0.4897089     9.253654 
1 1 1 0   43 3  o 53.49886 3.754427 36.96148       4.863605 32.35810       6.654233 42.24128       7.126368 48.24908 5.773942 55.68578 5.315996 -7.436691      7.848453 
1 1 1 0   43 4  o 18.38542 6.305543 4.696184       3.406613 7.328635       4.926790 2.284672       4.715508 22.01502 7.581853 16.57251 6.943717 5.442509       10.28104 
1 1 1 0   43 5  o 16.10403 6.070444 3.152611       3.246577 -1.289553      4.207918 9.686173       5.103229 13.10414 5.971694 24.86590 7.664459 -11.76176      9.716227 
1 1 1 0   43 6  o 22.78568 6.074505 7.561476       3.434275 4.905050       4.814605 10.31311       4.900120 19.11617 7.347551 25.74306 7.411230 -6.626888      10.43613 
1 1 1 0   43 7  o 29.03165 5.549645 11.88955       3.783139 14.86697       5.426546 9.074066       5.276924 31.07904 7.291547 23.83642 7.845347 7.242617       10.71056 
1 1 1 0   43 8  o 29.86263 5.194265 12.39972       3.642786 21.40383       5.565243 5.650007       4.818437 38.55428 6.128325 19.78290 7.408462 18.77138       9.614659 
1 1 1 0   43 9  f 12.46466 5.485181 0.4234269E-01  3.228509 -5.500368      4.522069 5.804772       4.610827 11.20682 5.420894 19.82838 7.279996 -8.621559      9.076587 
1 1 1 0   43 10 o 16.83840 7.023558 2.892511       4.792308 0.000000       0.000000 2.892511       4.792308 ?        ?        16.83840 7.023558 0.000000       7.023558 
1 1 1 0   43 11 o 12.27363 5.775127 -2.861688      4.437849 0.000000       0.000000 -2.861688      4.437849 ?        ?        12.27363 5.775127 0.000000       5.775127 
1 1 1 0   43 12 o 18.01384 6.783885 4.636972       4.052390 8.479039       7.582568 3.100849       4.794538 22.10259 8.985561 16.83194 7.023357 5.270649       11.40473 
1 1 1 0   43 13 o 17.97368 6.898107 4.650048       4.239247 16.75948       8.424721 0.5443513      4.905543 28.34292 9.906041 14.82017 6.627488 13.52275       11.91861 
1 1 1 0   43 14 o 15.59554 6.577453 2.400280       4.274981 3.904194       7.949395 1.788386       5.070618 18.82857 8.427142 15.77259 6.909544 3.055982       10.89764 
1 1 1 0   43 15 o 24.84437 7.447351 10.53302       4.863877 18.81972       8.671703 6.729436       5.875028 29.26106 10.05950 20.07041 7.996068 9.190653       12.85032 
1 1 1 0   43 16 o 15.34211 6.992451 0.5195770      5.771749 2.522356       8.209156 -1.438295      8.116602 17.90948 8.228631 16.19016 7.675491 1.719315       11.25271 
1 1 1 0   43 17 o 15.19397 6.890122 0.8293145      5.516924 6.542956       7.953377 -4.469416      7.659157 19.71865 8.645456 14.63540 7.073408 5.083252       11.17036 
1 1 1 0   43 18 o 12.68444 5.855154 -0.9472376     4.225241 0.2902136      7.514010 -1.519450      5.109593 16.23123 7.598192 13.39364 6.268500 2.837589       9.850208 
1 1 1 0   44 0  o 27.14075 7.494820 10.52773       5.120189 18.06863       8.163297 5.637080       6.574109 34.34117 9.455802 21.93125 8.543172 12.40993       12.74355 
1 1 1 0   44 1  o 28.46643 5.057248 11.29088       3.379666 7.465253       4.915864 14.71982       4.654017 21.71504 7.568474 31.59734 6.265619 -9.882301      9.825466 
1 1 1 0   44 2  o 19.23684 6.252851 5.453835       3.356885 5.625406       5.051000 5.318101       4.492612 19.63794 7.531466 19.15588 7.157672 0.4820576      10.39015 
1 1 1 0   44 3  o 22.77882 6.276917 7.802008       3.595627 4.131801       5.032843 11.62835       5.138781 18.12613 7.338255 26.82113 7.546447 -8.694994      10.52610 
1 1 1 0   44 4  o 15.01393 5.916999 2.532125       3.184570 1.479253       4.706563 3.421173       4.324927 15.53534 6.733106 16.95602 6.824604 -1.420679      9.586967 
1 1 1 0   44 5  o 18.85466 6.663003 5.249581       3.818836 4.777341       4.916942 5.967506       6.062519 18.61445 7.347250 20.10445 8.084163 -1.490000      10.92409 
1 1 1 0   44 6  o 20.62729 6.694468 6.563128       3.848626 3.405091       4.805044 12.21485       6.428048 17.17740 7.087016 26.10805 8.661580 -8.930649      11.19146 
1 1 1 0   44 7  o 10.00311 4.770870 -3.208912      3.231670 -2.432071      3.948890 -4.784255      5.623368 11.71313 5.491220 12.91421 6.195251 -1.201076      8.278564 
1 1 1 0   44 8  o 27.43855 7.282490 12.23651       4.949765 6.702347       7.156754 17.31112       6.853162 20.61984 8.590573 31.04225 8.707968 -10.42241      12.23220 
1 1 1 0   44 9  o 20.64010 6.559162 6.661199       3.708360 4.896091       5.239383 8.433100       5.249458 18.55920 7.496756 22.24225 7.816094 -3.683050      10.83017 
1 1 1 0   44 10 o 14.90499 6.332601 1.885992       4.011371 12.84674       8.055330 -1.728359      4.625710 24.98817 9.528961 13.00111 6.044549 11.98706       11.28440 
1 1 1 0   44 11 f 35.49569 5.390492 18.18180       4.516326 19.49291       9.286776 17.77566       5.168711 29.30973 10.38743 33.96351 6.481407 -4.653780      12.24366 
1 1 1 0   44 12 o 28.66241 6.470531 12.85057       4.412035 24.47407       8.955116 9.124725       5.070088 34.15868 10.07239 22.83060 7.694566 11.32808       12.67515 
1 1 1 0   44 13 f 15.50040 6.423655 2.737375       3.971651 4.574501       7.926591 2.121548       4.589298 18.81714 8.419047 15.43509 6.669165 3.382052       10.74049 
1 1 1 0   44 14 o 16.45027 6.824293 3.449288       4.488934 4.013931       7.400957 3.120672       5.646050 18.19497 8.138300 16.83168 7.333894 1.363298       10.95527 
1 1 1 0   45 1  o 22.80577 6.463494 8.138815       3.755681 6.292098       5.425730 9.837603       5.203884 19.88095 7.756431 23.89177 7.786640 -4.010817      10.99063 
1 1 1 0   45 2  o 11.17414 5.115737 -1.091121      3.134806 5.899991       5.238986 -4.990203      3.912508 19.46268 7.613492 10.27155 4.985904 9.191130       9.100797 
1 1 1 0   45 3  o 14.91133 6.410006 1.679258       4.197817 3.477511       4.973358 -2.775948      7.828135 17.09115 7.143918 15.76749 7.493235 1.323659       10.35298 
1 1 1 0   45 4  o 31.30888 5.142440 13.96194       3.787396 10.84758       5.863678 16.19135       4.961121 24.48126 8.274861 32.42112 6.505782 -7.939863      10.52609 
1 1 1 0   45 5  o 18.23587 6.733527 5.020514       3.953936 -0.4001411     6.941575 7.623881       4.810606 16.01879 7.432840 21.30848 7.482707 -5.289696      10.54694 
1 1 1 0   45 6  o 11.91213 5.519785 -1.552177      3.808491 -6.695382      6.682664 0.9218442      4.634837 13.23334 6.444595 14.68275 6.511494 -1.449411      9.161461 
1 1 1 0   45 7  f 12.67821 5.618288 0.2386631      3.444078 -1.049476      5.128123 1.297095       4.648454 13.90622 6.430221 14.93545 6.576786 -1.029233      9.197927 
1 1 1 0   45 8  o 21.72819 6.556864 7.585952       3.761045 10.27763       5.610546 5.389243       5.068503 23.71917 8.093295 18.66751 7.430310 5.051668       10.98685 
1 1 1 0   45 9  o 18.04246 6.316762 5.013451       3.426556 1.854384       4.673316 8.686387       5.039093 15.30150 6.669648 22.18853 7.666640 -6.887025      10.16177 
1 1 1 0   45 10 o 15.82585 6.488091 3.073529       3.994077 12.47808       8.453165 0.3704919      4.531857 23.73790 9.545676 14.03188 6.314852 9.706028       11.44540 
1 1 1 1   0  0  o 62.87829 2.621968 48.42704       4.001656 48.42704       4.001656 48.42704       4.001656 62.87829 2.621968 62.87829 2.621968 0.000000       0.000000 
1 1 1 1   0  1  o 33.38146 2.510760 13.80715       2.015225 13.80715       2.015225 13.80715       2.015225 33.38146 2.510760 33.38146 2.510760 0.000000       0.000000 
1 1 1 1   0  2  o 173.0226 4.174709 365.4540       17.57898 365.4540       17.57898 365.4540       17.57898 173.0226 4.174709 173.0226 4.174709 0.000000       0.000000 
1 1 1 1   0  3  o 372.0485 11.06617 1692.783       100.1295 1692.783       100.1295 1692.783       100.1295 372.0485 11.06617 372.0485 11.06617 0.000000       0.000000 
1 1 1 1   0  4  o 449.1591 9.297368 2463.094       101.6661 2463.094       101.6661 2463.094       101.6661 449.1591 9.297368 449.1591 9.297368 0.000000       0.000000 
1 1 1 1   0  5  o 171.4783 4.207469 358.9821       17.55801 358.9821       17.55801 358.9821       17.55801 171.4783 4.207469 171.4783 4.207469 0.000000       0.000000 
1 1 1 1   0  6  o 294.9749 6.388077 1062.030       45.87027 1062.030       45.87027 1062.030       45.87027 294.9749 6.388077 294.9749 6.388077 0.000000       0.000000 
1 1 1 1   0  7  o 287.0750 6.255523 1005.911       43.71488 1005.911       43.71488 1005.911       43.71488 287.0750 6.255523 287.0750 6.255523 0.000000       0.000000 
1 1 1 1   0  8  o 867.5992 17.56801 9209.601       371.0871 9209.601       371.0871 9209.601       371.0871 867.5992 17.56801 867.5992 17.56801 0.000000       0.000000 
1 1 1 1   0  9  o 321.7208 6.917551 1263.542       54.17690 1263.542       54.17690 1263.542       54.17690 321.7208 6.917551 321.7208 6.917551 0.000000       0.000000 
1 1 1 1   0  10 o 508.4294 14.88445 3166.777       184.0586 3166.777       184.0586 3166.777       184.0586 508.4294 14.88445 508.4294 14.88445 0.000000       0.000000 
1 1 1 1   0  11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 1   0  12 o 654.0325 13.37331 5235.302       212.9435 5235.302       212.9435 5235.302       212.9435 654.0325 13.37331 654.0325 13.37331 0.000000       0.000000 
1 1 1 1   0  13 o 470.8135 9.793639 2708.904       112.2548 2708.904       112.2548 2708.904       112.2548 470.8135 9.793639 470.8135 9.793639 0.000000       0.000000 
1 1 1 1   0  14 o 138.1177 3.965302 233.0660       13.32144 233.0660       13.32144 233.0660       13.32144 138.1177 3.965302 138.1177 3.965302 0.000000       0.000000 
1 1 1 1   0  15 o 712.3244 14.52857 6205.806       251.9584 6205.806       251.9584 6205.806       251.9584 712.3244 14.52857 712.3244 14.52857 0.000000       0.000000 
1 1 1 1   0  16 o 174.2338 6.476124 371.5701       27.41055 371.5701       27.41055 371.5701       27.41055 174.2338 6.476124 174.2338 6.476124 0.000000       0.000000 
1 1 1 1   0  17 o 837.1986 16.99783 8572.074       346.4607 8572.074       346.4607 8572.074       346.4607 837.1986 16.99783 837.1986 16.99783 0.000000       0.000000 
1 1 1 1   0  18 o 63.88056 4.032255 50.32017       6.218980 50.32017       6.218980 50.32017       6.218980 63.88056 4.032255 63.88056 4.032255 0.000000       0.000000 
1 1 1 1   0  19 o 124.9076 4.047830 190.7280       12.29170 190.7280       12.29170 190.7280       12.29170 124.9076 4.047830 124.9076 4.047830 0.000000       0.000000 
1 1 1 1   0  20 o 288.6272 6.477188 1017.010       45.50569 1017.010       45.50569 1017.010       45.50569 288.6272 6.477188 288.6272 6.477188 0.000000       0.000000 
1 1 1 1   0  21 o 992.3164 20.13606 12070.60       486.4712 12070.60       486.4712 12070.60       486.4712 992.3164 20.13606 992.3164 20.13606 0.000000       0.000000 
1 1 1 1   0  22 o 271.7378 6.217065 901.6233       41.12046 901.6233       41.12046 901.6233       41.12046 271.7378 6.217065 271.7378 6.217065 0.000000       0.000000 
1 1 1 1   0  23 o 493.3912 14.62138 2985.187       175.4492 2985.187       175.4492 2985.187       175.4492 493.3912 14.62138 493.3912 14.62138 0.000000       0.000000 
1 1 1 1   0  24 o 156.5712 4.544581 299.5950       17.30663 299.5950       17.30663 299.5950       17.30663 156.5712 4.544581 156.5712 4.544581 0.000000       0.000000 
1 1 1 1   0  25 o 267.5189 6.199052 874.4382       40.36351 874.4382       40.36351 874.4382       40.36351 267.5189 6.199052 267.5189 6.199052 0.000000       0.000000 
1 1 1 1   0  26 o 62.02502 5.027987 47.83851       7.481135 47.83851       7.481135 47.83851       7.481135 62.02502 5.027987 62.02502 5.027987 0.000000       0.000000 
1 1 1 1   0  27 o 84.79451 6.458708 89.30621       13.16342 89.30621       13.16342 89.30621       13.16342 84.79451 6.458708 84.79451 6.458708 0.000000       0.000000 
1 1 1 1   0  28 o 56.55626 4.943808 39.91718       6.688681 39.91718       6.688681 39.91718       6.688681 56.55626 4.943808 56.55626 4.943808 0.000000       0.000000 
1 1 1 1   0  29 o 63.64879 4.671438 50.23127       7.153996 50.23127       7.153996 50.23127       7.153996 63.64879 4.671438 63.64879 4.671438 0.000000       0.000000 
1 1 1 1   0  30 o 35.53516 7.503131 17.34525       5.717300 17.34525       5.717300 17.34525       5.717300 35.53516 7.503131 35.53516 7.503131 0.000000       0.000000 
1 1 1 1   0  31 o 285.4293 6.586246 998.4526       45.75622 998.4526       45.75622 998.4526       45.75622 285.4293 6.586246 285.4293 6.586246 0.000000       0.000000 
1 1 1 1   0  32 o 67.13165 4.682821 55.84127       7.573612 55.84127       7.573612 55.84127       7.573612 67.13165 4.682821 67.13165 4.682821 0.000000       0.000000 
1 1 1 1   0  33 o 15.27976 8.916810 3.441576       5.511653 3.441576       5.511653 3.441576       5.511653 15.27976 8.916810 15.27976 8.916810 0.000000       0.000000 
1 1 1 1   0  34 o 17.00616 9.929528 4.294818       6.840630 4.294818       6.840630 4.294818       6.840630 17.00616 9.929528 17.00616 9.929528 0.000000       0.000000 
1 1 1 1   0  35 o 21.56060 10.13196 8.414280       5.980046 8.414280       5.980046 8.414280       5.980046 21.56060 10.13196 21.56060 10.13196 0.000000       0.000000 
1 1 1 1   0  36 o 12.14087 7.874403 -0.2369374     5.536858 -0.2369374     5.536858 -0.2369374     5.536858 12.14087 7.874403 12.14087 7.874403 0.000000       0.000000 
1 1 1 1   0  37 o 108.5320 4.626445 144.9985       12.18535 144.9985       12.18535 144.9985       12.18535 108.5320 4.626445 108.5320 4.626445 0.000000       0.000000 
1 1 1 1   0  38 o 20.50876 11.61951 7.148057       8.957169 7.148057       8.957169 7.148057       8.957169 20.50876 11.61951 20.50876 11.61951 0.000000       0.000000 
1 1 1 1   0  39 o 73.31409 4.993346 66.95753       8.824491 66.95753       8.824491 66.95753       8.824491 73.31409 4.993346 73.31409 4.993346 0.000000       0.000000 
1 1 1 1   0  40 o 91.22547 4.689835 103.2079       10.36257 103.2079       10.36257 103.2079       10.36257 91.22547 4.689835 91.22547 4.689835 0.000000       0.000000 
1 1 1 1   0  41 o 45.70029 6.445204 27.49788       6.767394 27.49788       6.767394 27.49788       6.767394 45.70029 6.445204 45.70029 6.445204 0.000000       0.000000 
1 1 1 1   0  42 o 74.74715 4.993142 70.33277       9.000490 70.33277       9.000490 70.33277       9.000490 74.74715 4.993142 74.74715 4.993142 0.000000       0.000000 
1 1 1 1   0  43 o 17.41041 9.636585 5.856165       5.985311 5.856165       5.985311 5.856165       5.985311 17.41041 9.636585 17.41041 9.636585 0.000000       0.000000 
1 1 1 1   0  44 o 21.74771 10.84517 9.924756       6.987586 9.924756       6.987586 9.924756       6.987586 21.74771 10.84517 21.74771 10.84517 0.000000       0.000000 
1 1 1 1   0  45 o 31.91365 9.097442 16.56786       6.129765 16.56786       6.129765 16.56786       6.129765 31.91365 9.097442 31.91365 9.097442 0.000000       0.000000 
1 1 1 1   0  46 o 11.26184 7.399965 0.4481542      5.124757 0.4481542      5.124757 0.4481542      5.124757 11.26184 7.399965 11.26184 7.399965 0.000000       0.000000 
1 1 1 1   0  47 o 12.59027 8.039630 2.346405       5.488707 2.346405       5.488707 2.346405       5.488707 12.59027 8.039630 12.59027 8.039630 0.000000       0.000000 
1 1 1 1   0  48 o 10.09014 6.912182 -1.261960      5.416873 -1.261960      5.416873 -1.261960      5.416873 10.09014 6.912182 10.09014 6.912182 0.000000       0.000000 
1 1 1 1   0  49 o 16.11919 9.154771 7.233310       5.578503 7.233310       5.578503 7.233310       5.578503 16.11919 9.154771 16.11919 9.154771 0.000000       0.000000 
1 1 1 1   0  50 o 9.305901 6.446353 -1.187910      5.034585 -1.187910      5.034585 -1.187910      5.034585 9.305901 6.446353 9.305901 6.446353 0.000000       0.000000 
1 1 1 1   0  51 f 8.176016 5.812562 -3.483532      4.978570 -3.483532      4.978570 -3.483532      4.978570 8.176016 5.812562 8.176016 5.812562 0.000000       0.000000 
1 1 1 1   1  0  o 400.6361 6.791887 1957.237       66.30965 1945.668       80.87824 1980.960       115.8146 399.3733 8.310297 402.5682 11.81839 -3.194855      14.44768 
1 1 1 1   1  1  o 139.2199 3.611816 236.3720       12.24323 236.3720       12.24323 0.000000       0.000000 139.2199 3.611816 ?        ?        0.000000       3.611816 
1 1 1 1   1  2  o 630.9183 10.46514 4859.076       160.8993 4812.567       195.7888 4955.826       282.3905 627.6046 12.80164 635.7170 18.24734 -8.112427      22.29008 
1 1 1 1   1  3  o 159.9395 3.249094 311.7419       12.66351 315.3145       22.13753 310.0041       15.43904 160.7247 5.660945 159.4861 3.972476 1.238647       6.915697 
1 1 1 1   1  4  o 238.2640 4.347746 691.9297       25.24403 715.6006       44.69445 680.8409       30.59072 242.1077 7.584815 236.3285 5.311750 5.779236       9.259810 
1 1 1 1   1  5  o 308.7196 4.677207 1161.705       35.18737 1135.493       49.05968 1189.474       50.49634 305.1608 6.597205 312.3290 6.634551 -7.168243      9.356301 
1 1 1 1   1  6  o 449.7158 6.576990 2466.052       72.07779 2459.502       101.7306 2472.656       102.1374 448.9531 9.298535 450.1511 9.310874 -1.198029      13.15884 
1 1 1 1   1  7  o 192.5471 3.239554 451.8130       15.20052 446.6524       21.35651 457.1114       21.63984 191.4270 4.578160 193.6552 4.585521 -2.228165      6.479703 
1 1 1 1   1  8  o 378.3134 5.623178 1744.904       51.84055 1804.211       74.88902 1690.337       71.83361 384.5707 7.991086 372.2407 7.918952 12.33002       11.25021 
1 1 1 1   1  9  o 411.8128 6.079998 2068.028       61.01540 2045.979       85.68768 2090.706       86.90276 409.4473 8.587848 413.8964 8.616002 -4.449158      12.16498 
1 1 1 1   1  10 o 245.9583 4.516654 737.4984       27.07163 730.3973       46.46283 741.1481       33.30983 244.5176 7.807580 246.5328 5.544490 -2.015198      9.575994 
1 1 1 1   1  11 o 417.5947 7.132422 2128.339       72.58186 2125.685       88.81399 2133.677       125.9435 417.1602 8.736598 417.2335 12.40059 -0.7327271E-01 15.16914 
1 1 1 1   1  12 o 420.4041 6.219831 2156.492       63.72085 2173.682       90.56937 2139.642       89.66718 421.7794 8.811705 418.4663 8.792996 3.313110       12.44841 
1 1 1 1   1  13 o 254.7715 4.064422 791.3311       25.23397 784.1904       35.48088 798.6395       35.89518 253.5466 5.742495 255.8710 5.756770 -2.324478      8.131214 
1 1 1 1   1  14 o 292.0465 4.542645 1039.870       32.32935 1071.234       46.51656 1010.564       44.96415 296.3255 6.441730 287.8137 6.410897 8.511841       9.088205 
1 1 1 1   1  15 f 789.8854 16.07681 7648.784       309.4569 7648.784       309.4569 0.000000       0.000000 789.8854 16.07681 ?        ?        0.000000       16.07681 
1 1 1 1   1  16 o 79.24384 3.033894 76.63911       5.847888 61.83916       9.806683 84.80595       7.284824 70.98887 5.717176 83.33974 3.595453 -12.35088      6.753768 
1 1 1 1   1  17 o 367.9580 5.552695 1650.573       49.78954 1644.773       70.22652 1656.434       70.60106 367.2131 7.847781 368.5118 7.861830 -1.298706      11.10838 
1 1 1 1   1  18 o 193.9092 3.434488 458.2388       16.22918 471.1109       23.30598 446.1212       22.61276 196.5936 4.864768 191.2470 4.855950 5.346542       6.873588 
1 1 1 1   1  19 o 242.9649 4.003616 719.4888       23.70457 728.6921       33.76575 710.5450       33.28604 244.4770 5.667641 241.4139 5.658011 3.063126       8.008449 
1 1 1 1   1  20 o 604.1770 8.769136 4454.846       129.1092 4506.778       184.0135 4404.493       181.1950 607.1954 12.43613 600.2731 12.38686 6.922363       17.55254 
1 1 1 1   1  21 o 452.9088 6.714119 2502.049       74.10302 2567.491       106.6103 2440.876       103.0742 458.5419 9.540781 447.1006 9.460378 11.44125       13.43597 
1 1 1 1   1  22 o 388.5246 6.762810 1841.665       64.02975 1823.761       109.8947 1850.866       78.78395 385.9548 11.69784 389.3650 8.303185 -3.410187      14.34512 
1 1 1 1   1  23 o 300.5564 5.478944 1101.858       40.12905 1112.641       49.48314 1081.142       68.58545 301.9412 6.725100 297.2494 9.480487 4.691803       11.62354 
1 1 1 1   1  24 o 635.4061 9.237740 4939.235       143.0386 4879.405       200.6149 5001.102       204.0019 630.2803 13.06151 638.0689 13.11990 -7.788574      18.51309 
1 1 1 1   1  25 f 315.5844 4.954882 1215.352       38.10526 1199.019       53.41608 1232.277       54.37465 313.2183 6.998240 317.5285 7.027124 -4.310242      9.917451 
1 1 1 1   1  26 o 192.5003 3.550560 451.9708       16.65576 453.2559       23.57307 450.6897       23.53656 192.6104 5.026570 192.0633 5.033116 0.5470581      7.113274 
1 1 1 1   1  27 o 166.9067 3.844715 339.9525       15.63775 348.9091       19.28360 322.7495       26.72495 168.9638 4.687901 162.2287 6.775012 6.735046       8.238762 
1 1 1 1   1  28 o 125.6968 3.589317 192.9805       10.98315 201.2710       19.83963 189.3170       13.18846 128.0396 6.378564 124.4249 4.356336 3.614662       7.724231 
1 1 1 1   1  29 o 271.1520 4.447774 898.4427       29.38946 907.5412       41.74486 889.5011       41.38345 272.1268 6.294999 269.4064 6.303512 2.720337       8.908494 
1 1 1 1   1  30 o 27.43501 5.903697 9.576384       3.829905 13.14331       5.537983 6.306589       5.302306 32.07567 7.255385 23.39211 7.868742 8.683559       10.70316 
1 1 1 1   1  31 o 76.11088 3.162732 70.84260       5.853260 66.74093       8.147136 75.21828       8.414876 73.72154 4.557249 78.29630 4.428375 -4.574760      6.354449 
1 1 1 1   1  32 o 127.4763 3.132339 198.4389       9.730477 200.5126       13.78147 196.3776       13.74057 127.9239 4.427544 126.5910 4.461133 1.332878       6.285288 
1 1 1 1   1  33 o 90.07044 3.556175 99.32273       7.790175 101.3952       12.89438 98.13146       9.775984 90.63821 5.869412 89.39911 4.501852 1.239098       7.397071 
1 1 1 1   1  34 o 55.54354 4.228239 38.00172       5.680066 35.92347       6.892432 42.40070       10.02763 53.81939 5.325028 58.12072 7.236250 -4.301331      8.984388 
1 1 1 1   1  35 o 145.8431 3.313112 260.1189       11.77493 263.5621       16.68601 256.7035       16.61871 146.4652 4.681015 144.5338 4.724718 1.931442       6.650929 
1 1 1 1   1  36 o 83.40835 3.305486 85.25938       6.705328 84.58221       9.403588 85.95984       9.563979 82.83656 4.677390 83.50191 4.719299 -0.6653519     6.644528 
1 1 1 1   1  37 o 60.22934 3.735553 44.64903       5.455772 40.03297       7.510682 49.80570       7.938319 56.67316 5.507713 63.34231 5.188209 -6.669144      7.566532 
1 1 1 1   1  38 o 18.92841 7.440425 2.740996       5.024084 3.908210       5.917432 -0.2731623     9.509136 21.12358 8.138789 22.20249 9.596595 -1.078911      12.58311 
1 1 1 1   1  39 o 63.82667 3.753314 50.29648       5.812087 41.53787       8.170490 59.26859       8.269466 57.40155 5.926111 68.98404 4.952129 -11.58249      7.722847 
1 1 1 1   1  40 o 19.06108 6.934737 3.912276       4.169613 3.157330       5.957176 4.637336       5.838074 20.23473 8.054982 21.50836 8.133067 -1.273630      11.44681 
1 1 1 1   1  41 o 43.42394 4.639365 23.82673       4.833378 22.58034       6.701952 25.17760       6.977213 41.40269 6.884226 43.82594 6.749335 -2.423244      9.640856 
1 1 1 1   1  42 o 36.47486 5.323824 17.25857       4.592653 18.13018       6.389634 16.32700       6.605740 36.42963 7.449119 34.24533 8.051944 2.184299       10.96919 
1 1 1 1   1  43 o 41.84388 5.275534 22.91344       5.260087 24.57965       8.060711 21.67769       6.941828 41.43484 8.272963 39.36662 7.510139 2.068230       11.17337 
1 1 1 1   1  44 f 25.71229 6.840192 9.472935       4.360400 7.489482       5.435915 13.05221       7.302292 22.93952 7.960916 28.81607 9.209475 -5.876558      12.17336 
1 1 1 1   1  45 o 14.91355 6.230453 1.582786       3.779881 5.288299       5.192256 -2.595119      5.513295 19.85255 7.630357 14.22187 6.607656 5.630679       10.09373 
1 1 1 1   1  46 o 25.54791 6.515920 10.01272       4.068842 12.29948       5.859961 7.883900       5.653989 26.69488 8.210382 21.81099 8.052311 4.883896       11.50000 
1 1 1 1   1  47 o 27.97698 7.162098 13.10587       4.903176 12.20412       5.866426 15.19563       8.930620 25.46400 8.265209 25.39519 9.938536 0.6881142E-01  12.92626 
1 1 1 1   1  48 o 17.63422 7.154883 5.204583       4.796582 2.680815       9.017529 6.200402       5.664389 17.28056 8.161928 18.52565 7.673831 -1.245087      11.20289 
1 1 1 1   1  49 o 16.12347 6.519595 4.468169       3.967121 4.409617       5.554699 4.529129       5.667720 16.23084 7.166528 16.32832 7.222955 -0.9748459E-01 10.17498 
1 1 1 1   1  50 o 14.99067 6.239546 3.990879       3.770439 1.812144       5.319820 6.190022       5.344677 13.85273 6.454524 16.63886 7.193223 -2.786134      9.664540 
1 1 1 1   1  51 o 12.31789 5.681565 1.159448       3.967401 0.8432940      5.181921 1.607282       6.167371 12.82585 6.095643 13.54441 6.495049 -0.7185545     8.907441 
1 1 1 1   2  0  o 547.9274 7.915336 3661.928       105.6887 3690.098       150.1825 3634.289       148.7604 549.7399 11.21053 545.5690 11.18926 4.170837       15.83905 
1 1 1 1   2  1  o 426.5304 7.214603 2218.639       74.98917 2122.407       89.05686 2453.130       139.0182 417.0910 8.761944 447.9088 12.74935 -30.81781      15.46989 
1 1 1 1   2  2  o 646.9028 9.291336 5106.412       146.4716 4942.892       202.6510 5285.275       211.9456 636.0079 13.07525 657.6447 13.22504 -21.63684      18.59742 
1 1 1 1   2  3  o 348.9499 5.197287 1484.329       44.19527 1430.376       61.05796 1543.705       64.05264 342.4726 7.316113 355.7780 7.387915 -13.30539      10.39744 
1 1 1 1   2  4  o 28.47376 2.494166 9.955427       1.713181 7.782637       3.256885 10.78661       2.014385 24.77939 5.533563 29.61721 2.825206 -4.837816      6.213060 
1 1 1 1   2  5  o 366.9966 5.455239 1641.911       48.78788 1741.914       71.57830 1555.140       66.67529 377.9094 7.772444 357.0798 7.662376 20.82956       10.91434 
1 1 1 1   2  6  o 437.1681 6.405649 2330.271       68.24137 2314.042       96.04571 2346.818       96.97677 435.4916 9.050282 438.5634 9.074011 -3.071747      12.81582 
1 1 1 1   2  7  o 462.8972 6.762134 2612.916       76.27891 2688.593       109.8871 2542.540       105.9689 469.3601 9.607367 456.4397 9.527060 12.92041       13.53020 
1 1 1 1   2  8  o 143.3324 2.713544 250.3558       9.478015 256.7111       13.54124 244.2518       13.27072 145.0793 3.833520 141.5117 3.851859 3.567627       5.434399 
1 1 1 1   2  9  o 717.9388 11.90219 6300.372       208.2334 6268.253       359.1483 6316.637       255.5763 713.5272 20.67690 718.2877 14.60112 -4.760498      25.31258 
1 1 1 1   2  10 o 444.6385 6.533589 2411.697       70.79375 2465.188       101.5569 2361.135       98.73758 449.2787 9.275934 439.7014 9.214855 9.577240       13.07503 
1 1 1 1   2  11 o 180.5545 3.656515 397.3896       16.08836 403.3727       19.79059 385.7310       27.62604 181.8886 4.464956 177.6903 6.390378 4.198349       7.795689 
1 1 1 1   2  12 o 315.6285 4.829226 1214.863       37.14409 1207.860       52.35417 1221.961       52.70697 314.5840 6.829338 316.4144 6.835585 -1.830475      9.662560 
1 1 1 1   2  13 o 147.3209 2.853469 264.5186       10.24409 268.0778       14.56452 261.0340       14.41136 148.2331 4.035704 146.2707 4.046961 1.962387       5.715313 
1 1 1 1   2  14 o 212.2377 5.032948 549.2500       26.03041 549.2500       26.03041 0.000000       0.000000 212.2377 5.032948 ?        ?        0.000000       5.032948 
1 1 1 1   2  15 f 689.4273 9.931062 5804.566       166.8477 5934.173       239.4185 5682.190       232.6439 696.2774 14.11040 681.3558 14.01140 14.92163       19.88524 
1 1 1 1   2  16 o 731.1475 12.15072 6531.827       216.4926 6445.330       371.8820 6576.169       266.2629 723.9490 21.10206 733.1071 14.90415 -9.158020      25.83468 
1 1 1 1   2  17 o 394.1583 5.902524 1894.119       56.69497 1975.643       82.40849 1820.858       78.12083 402.4278 8.403261 386.3477 8.297598 16.08008       11.80953 
1 1 1 1   2  18 o 225.5777 3.780882 620.1644       20.78382 622.8056       29.43368 617.5378       29.35203 226.0294 5.343718 225.0713 5.351577 0.9580994      7.562717 
1 1 1 1   2  19 o 149.6170 3.466398 272.8141       12.63850 278.2923       21.47930 269.9131       15.63073 150.9669 5.849582 148.7475 4.316711 2.219391       7.269911 
1 1 1 1   2  20 o 92.33891 2.847790 104.0070       6.400433 103.8364       8.957633 104.1849       9.148544 92.21292 3.995742 92.36375 4.074595 -0.1508331     5.706862 
1 1 1 1   2  21 o 284.3705 4.529253 985.8055       31.38682 958.8040       43.68449 1014.618       45.12594 280.3798 6.393585 288.4240 6.420352 -8.044189      9.060842 
1 1 1 1   2  22 o 468.4754 7.994826 2679.077       91.27081 2711.792       158.8821 2662.963       111.5050 470.2491 13.87990 466.8469 9.801307 3.402283       16.99168 
1 1 1 1   2  23 o 456.2507 7.839917 2542.071       87.16680 2546.218       107.0594 2533.917       150.1330 456.3630 9.626720 454.3034 13.57630 2.059631       16.64301 
1 1 1 1   2  24 o 539.3530 7.930099 3555.259       104.2288 3396.998       142.5756 3736.922       152.7538 526.4427 11.11368 552.0828 11.35407 -25.64001      15.88801 
1 1 1 1   2  25 o 609.0118 8.888000 4541.823       131.9064 4507.112       185.4566 4577.360       187.6504 605.1691 12.57562 609.8422 12.62687 -4.673096      17.82089 
1 1 1 1   2  26 o 163.1498 3.777382 324.7045       15.01805 329.4705       18.43610 315.3041       25.89217 164.2313 4.611128 160.4391 6.636832 3.792175       8.081463 
1 1 1 1   2  27 o 130.5094 3.077090 207.7407       9.786287 215.7741       13.95304 199.9626       13.72947 132.8755 4.314833 127.9002 4.411610 4.975281       6.170907 
1 1 1 1   2  28 o 63.33556 4.001394 49.17073       6.144258 55.23894       11.45473 46.71953       7.280211 66.73930 7.154694 61.63657 4.886931 5.102730       8.664395 
1 1 1 1   2  29 f 80.23457 3.085052 78.66436       6.020744 80.07558       8.364906 77.14738       8.672668 80.84789 4.260810 79.32599 4.504951 1.521896       6.200732 
1 1 1 1   2  30 o 329.2778 5.177012 1327.080       41.54107 1342.294       59.09377 1312.218       58.40812 330.4072 7.339326 326.6855 7.336810 3.721710       10.37760 
1 1 1 1   2  31 o 49.95167 3.779269 30.66079       4.566251 28.64034       6.280377 32.92663       6.650843 48.03772 5.461837 51.56341 5.371629 -3.525684      7.660683 
1 1 1 1   2  32 o 166.2347 3.394470 337.5882       13.75086 326.9969       19.11184 348.9556       19.79969 163.3221 4.807224 168.7184 4.820647 -5.396317      6.807940 
1 1 1 1   2  33 o 107.2551 3.513050 140.7620       9.169632 139.3106       14.88790 141.6490       11.63932 106.3190 5.767872 107.4550 4.454588 -1.136009      7.287778 
1 1 1 1   2  34 o 85.44749 3.221672 89.35966       6.696351 93.78470       9.462843 84.92107       9.477313 87.36562 4.459479 83.08403 4.700092 4.281586       6.479029 
1 1 1 1   2  35 o 51.92392 4.690377 33.35698       5.870944 28.51415       7.123969 43.60836       10.36486 47.66512 6.286267 58.85121 7.389740 -11.18609      9.701825 
1 1 1 1   2  36 f 60.96395 3.721980 45.69776       5.503115 39.72910       7.633860 52.15530       7.940344 56.48438 5.620502 64.90881 5.059902 -8.424431      7.562582 
1 1 1 1   2  37 o 33.48497 6.878142 14.44377       5.424572 21.03643       6.596441 0.6725769      9.533778 40.57816 6.918793 22.88839 9.744925 17.68977       11.95129 
1 1 1 1   2  38 o 142.1297 3.342252 247.6963       11.57604 243.4789       16.15383 252.1483       16.59716 140.3962 4.728290 142.8577 4.774246 -2.461426      6.719387 
1 1 1 1   2  39 o 36.42250 6.473724 17.09744       5.535384 25.65861       10.75961 14.01601       6.455149 43.48315 10.31141 32.53940 8.157126 10.94375       13.14777 
1 1 1 1   2  40 o 94.75013 3.271537 110.6000       7.542507 107.5109       10.55625 113.8218       10.78073 92.88535 4.678720 95.59551 4.641672 -2.710167      6.590564 
1 1 1 1   2  41 o 30.99967 6.046290 12.60875       4.403438 6.228346       5.982469 20.15266       6.505112 23.01091 8.315792 38.95782 7.114169 -15.94691      10.94366 
1 1 1 1   2  42 f 41.87634 4.795320 22.42941       4.805378 16.03749       6.439156 30.46378       7.219203 33.97478 7.923618 48.12073 6.308060 -14.14595      10.12795 
1 1 1 1   2  43 o 34.34821 5.735319 15.73857       4.631470 10.37808       6.790759 20.40067       6.332954 26.82359 8.902717 38.45017 7.017325 -11.62658      11.33584 
1 1 1 1   2  44 o 16.81222 6.480010 3.065780       3.752128 3.640858       5.106567 2.391014       5.531490 18.66818 7.449040 17.95314 7.521250 0.7150478      10.58572 
1 1 1 1   2  45 o 36.33881 5.051804 17.92496       4.352755 21.80952       6.075343 13.82779       6.239383 38.77018 6.670931 29.27722 8.342080 9.492956       10.68137 
1 1 1 1   2  46 f 43.32774 4.518746 25.48742       4.701076 40.30776       6.952672 13.00506       6.380739 53.42547 5.415026 26.96454 8.607800 26.46093       10.16940 
1 1 1 1   2  47 o 21.68810 7.440212 8.223025       4.743032 4.132052       5.728098 17.14539       8.459351 17.62209 7.529645 27.39230 9.889959 -9.770203      12.43008 
1 1 1 1   2  48 o 9.548965 4.749476 -7.875301      4.326421 -2.884693      8.416055 -9.667857      5.043921 15.10244 7.326589 10.00972 5.002086 5.092717       8.871289 
1 1 1 1   2  49 o 9.434156 4.627415 -4.675207      3.631136 -4.148129      5.061507 -5.234140      5.212212 11.46393 5.588631 11.23662 5.518107 0.2273197      7.853808 
1 1 1 1   2  50 o 8.011228 4.018684 -7.173923      3.403885 -8.585025      4.687530 -5.599799      4.950900 9.356331 4.696567 10.49762 5.196822 -1.141288      7.004620 
1 1 1 1   2  51 o 12.56736 5.685784 1.732439       3.730725 3.281659       5.372914 0.2901200      5.184227 14.10983 6.544388 12.56593 6.006732 1.543905       8.883121 
1 1 1 1   3  0  o 306.1759 5.351811 1142.766       39.93079 1147.355       48.99301 1133.686       68.91530 306.7532 6.554038 304.6682 9.293096 2.084961       11.37177 
1 1 1 1   3  1  o 357.8192 5.323788 1560.776       46.42163 1470.447       63.11194 1667.253       68.52139 347.2309 7.458596 369.7314 7.605079 -22.50052      10.65213 
1 1 1 1   3  2  o 310.9221 4.197693 1178.252       31.80521 1165.176       49.97811 1187.151       41.23193 309.1233 6.634559 312.0631 5.421946 -2.939850      8.568248 
1 1 1 1   3  3  o 492.7531 8.271295 2961.871       99.32050 3035.913       175.1473 2926.777       120.5828 498.0782 14.44538 489.6860 10.10489 8.392151       17.62889 
1 1 1 1   3  4  o 334.8391 5.805827 1366.866       47.37359 1361.667       82.14705 1369.457       57.98756 333.8562 10.10874 335.1088 7.100892 -1.252625      12.35351 
1 1 1 1   3  5  o 311.0715 4.709926 1179.479       35.70347 1193.125       50.82288 1166.182       50.16816 312.8068 6.667253 309.2551 6.656950 3.551727       9.421637 
1 1 1 1   3  6  o 630.8770 9.074519 4856.285       139.5097 4966.799       200.3692 4752.300       194.3610 637.5599 12.89656 623.6557 12.78875 13.90424       18.16242 
1 1 1 1   3  7  o 353.2603 5.282346 1521.310       45.47343 1593.636       66.20364 1456.709       62.56851 361.4654 7.515865 345.5921 7.429438 15.87335       10.56810 
1 1 1 1   3  8  o 554.9389 9.270471 3758.883       125.3670 3820.949       219.1343 3728.685       152.8524 558.2822 16.12411 552.4632 11.35358 5.818970       19.72031 
1 1 1 1   3  9  o 461.6761 6.758141 2599.881       76.03276 2642.323       108.6792 2559.194       106.4098 465.1731 9.587288 457.8024 9.538225 7.370667       13.52382 
1 1 1 1   3  10 o 694.4049 9.992173 5892.237       169.0865 6234.748       248.2287 5595.741       230.9535 713.2355 14.28180 675.7681 14.02461 37.46747       20.01648 
1 1 1 1   3  11 o 345.7840 5.214744 1458.208       43.94141 1482.252       62.76136 1435.088       61.54166 348.4600 7.391003 342.8735 7.365448 5.586456       10.43440 
1 1 1 1   3  12 o 263.5219 4.817503 846.8394       30.93675 846.6130       37.80106 847.2986       53.83722 263.4325 5.888417 263.2365 8.403440 0.1959229      10.26115 
1 1 1 1   3  13 o 196.7691 3.905281 471.9964       18.72602 463.0494       22.61040 491.5359       33.41382 194.8714 4.761283 200.5798 6.846045 -5.708435      8.338954 
1 1 1 1   3  14 o 158.9121 3.428321 307.7940       13.27623 305.2053       16.25093 312.9890       23.02077 158.1731 4.219858 160.0878 5.911148 -1.914764      7.262841 
1 1 1 1   3  15 o 599.9265 8.687686 4392.611       127.0101 4361.500       178.6989 4424.373       180.5542 597.3047 12.27693 601.5881 12.31607 -4.283386      17.38990 
1 1 1 1   3  16 o 856.1215 12.25788 8955.261       255.7329 8906.373       360.2787 9004.905       363.0593 852.6033 17.34026 857.2962 17.37843 -4.692871      24.54983 
1 1 1 1   3  17 o 666.4687 11.11439 5423.492       180.5100 5386.658       311.7650 5442.067       221.3945 662.5172 19.33120 667.2580 13.61561 -4.740845      23.64488 
1 1 1 1   3  18 o 220.5427 3.724183 592.7858       20.01520 593.9313       28.30545 591.6403       28.30608 220.7288 5.262291 220.3025 5.272592 0.4263306      7.449290 
1 1 1 1   3  19 o 933.4216 13.35555 10652.42       303.7915 10603.94       428.2831 10701.51       430.9819 929.7028 18.90387 933.9594 18.93629 -4.256653      26.75704 
1 1 1 1   3  20 o 283.2853 5.172238 978.3700       35.70579 957.8788       60.42006 989.3666       44.26147 280.0079 8.865891 284.8304 6.376808 -4.822479      10.92097 
1 1 1 1   3  21 o 334.9471 5.940391 1368.164       48.48723 1338.048       82.22964 1384.216       60.03464 330.8015 10.21281 336.8304 7.313993 -6.028931      12.56169 
1 1 1 1   3  22 o 193.1518 4.086586 454.7993       19.23515 450.5282       33.60567 456.8804       23.45778 192.0083 7.194908 193.5060 4.978714 -1.497696      8.749532 
1 1 1 1   3  23 o 356.1436 5.453585 1547.194       47.33073 1556.997       67.13190 1537.504       66.74134 357.0692 7.715081 354.8266 7.718673 2.242554       10.91331 
1 1 1 1   3  24 o 391.8076 6.846038 1874.868       65.36544 1874.229       79.94394 1876.158       113.5352 391.5123 8.379228 390.8314 11.93477 0.6809082      14.58253 
1 1 1 1   3  25 o 257.9211 4.251934 811.5110       26.72449 771.0015       36.64996 857.5060       39.05262 251.2551 5.985806 264.9690 6.048100 -13.71397      8.509371 
1 1 1 1   3  26 o 292.2510 5.388993 1043.238       38.37954 1060.821       47.40310 1009.779       65.39100 294.5225 6.604685 286.6663 9.373235 7.856201       11.46645 
1 1 1 1   3  27 o 39.51858 4.483428 19.31325       4.241441 18.80445       5.931352 19.84568       6.067575 38.67417 6.525549 39.76218 6.485266 -1.088017      9.200080 
1 1 1 1   3  28 o 222.4439 3.882236 604.0843       21.04450 589.8848       29.27878 619.2603       30.26873 219.6023 5.471169 224.9959 5.520566 -5.393616      7.772408 
1 1 1 1   3  29 o 98.66549 3.599376 119.0010       8.639730 127.1486       15.78262 115.5146       10.32401 101.6445 6.404313 97.13156 4.372877 4.512917       7.754823 
1 1 1 1   3  30 o 26.30980 6.047272 8.824732       3.795832 9.857846       5.315010 7.749269       5.422850 27.86176 7.613202 25.22138 7.921125 2.640381       10.98659 
1 1 1 1   3  31 o 209.3216 3.779088 535.3917       19.27690 538.1581       27.19446 532.5978       27.32934 209.5003 5.331048 208.4010 5.385890 1.099319       7.578119 
1 1 1 1   3  32 o 147.1932 3.697586 264.9803       13.25251 255.0486       21.55492 271.0163       16.80376 143.9261 6.159939 148.7013 4.642888 -4.775192      7.713706 
1 1 1 1   3  33 o 191.2584 3.646019 447.2497       16.99322 447.7115       23.88297 446.7760       24.18394 190.9651 5.136802 190.7454 5.207672 0.2196960      7.314819 
1 1 1 1   3  34 o 51.29718 3.968291 32.40185       4.922043 37.95833       6.909874 26.67843       7.012910 55.35834 5.182376 46.08604 6.418335 9.272297       8.249366 
1 1 1 1   3  35 o 158.9128 3.902256 309.2939       15.11161 306.2321       18.40703 315.6239       26.46646 157.8469 4.790872 159.5474 6.822979 -1.700424      8.336995 
1 1 1 1   3  36 o 72.80560 3.478924 65.04250       6.154424 65.01094       8.476067 65.07769       8.950652 72.55445 4.821309 72.53520 5.096150 0.1924896E-01  7.015395 
1 1 1 1   3  37 o 14.78439 6.554420 -1.498249      4.692340 -2.418332      5.590106 0.6963054      8.633354 15.69312 7.041988 21.87633 9.292178 -6.183210      11.65908 
1 1 1 1   3  38 o 70.51258 3.527555 61.16498       6.042201 60.37991       8.284214 62.05731       8.831991 69.74800 4.905257 70.64503 5.165991 -0.8970261     7.123834 
1 1 1 1   3  39 o 67.96629 4.257071 57.23699       7.015425 66.96962       13.12836 53.34700       8.299828 72.31189 7.561803 65.31956 5.258630 6.992325       9.210540 
1 1 1 1   3  40 o 57.62656 3.896801 41.22151       5.440083 41.53134       7.528213 40.88291       7.870046 57.34624 5.452578 56.77544 5.768267 0.5707970      7.937475 
1 1 1 1   3  41 o 41.68198 4.703721 22.01110       4.694426 27.30459       6.636930 16.71125       6.640912 45.93670 6.077850 35.04635 7.958124 10.89035       10.01359 
1 1 1 1   3  42 o 18.34628 7.002270 3.437716       4.352245 -1.953305      6.448964 7.946768       5.897894 16.70445 7.523982 24.48604 8.298833 -7.781590      11.20183 
1 1 1 1   3  43 o 17.29720 6.619406 3.143593       3.896065 1.192410       5.356506 5.335408       5.677205 17.12921 7.299051 21.16485 8.016361 -4.035639      10.84150 
1 1 1 1   3  44 o 35.47884 5.206383 16.83991       4.367491 11.91597       5.799603 23.29054       6.638093 28.10877 8.053588 40.51936 6.974254 -12.41059      10.65366 
1 1 1 1   3  45 o 26.62504 6.768693 10.56099       4.400592 8.848304       5.441863 13.79716       7.480404 23.74985 7.971480 28.23236 9.342921 -4.482515      12.28148 
1 1 1 1   3  46 o 21.42182 7.318804 7.400620       4.588399 6.180799       5.546531 10.04529       8.166943 20.00894 7.831839 23.21740 9.366364 -3.208454      12.20928 
1 1 1 1   3  47 o 15.51756 6.339896 2.953039       3.797392 2.054571       5.268433 3.924537       5.478364 15.81517 6.981363 17.32506 7.382030 -1.509890      10.16040 
1 1 1 1   3  48 o 10.59707 5.035097 -2.433967      3.531144 -2.676881      4.985605 -2.189451      5.002018 12.38657 5.912639 12.63313 5.999690 -0.2465620     8.423513 
1 1 1 1   3  49 f 12.69971 5.673251 1.056375       3.584577 6.417358       5.365307 -3.265823      4.817533 17.67740 7.406683 11.53171 5.582170 6.145687       9.274674 
1 1 1 1   3  50 o 11.36197 5.273983 -0.1291581     3.499747 -3.690163      4.800774 3.909662       5.112722 10.97933 5.371819 14.98825 6.729430 -4.008917      8.610556 
1 1 1 1   3  51 o 10.10975 4.928992 -2.943372      3.940130 -7.335052      5.776193 0.8783773      5.388370 10.50808 5.266032 12.91682 6.160508 -2.408738      8.104502 
1 1 1 1   4  0  o 284.3008 4.361122 985.1476       30.21429 955.2338       41.98261 1017.289       43.51764 279.9068 6.154884 288.8548 6.182294 -8.947968      8.723723 
1 1 1 1   4  1  o 398.1995 6.786928 1933.499       65.85823 1873.124       78.91476 2072.036       119.5393 391.8599 8.264020 411.7142 11.92716 -19.85431      14.51038 
1 1 1 1   4  2  f 463.4961 6.760611 2619.586       76.36039 2650.751       108.8102 2589.343       107.1878 466.0643 9.580492 460.6365 9.548848 5.427765       13.52651 
1 1 1 1   4  3  o 643.7042 10.69143 5058.433       167.7097 5153.848       294.5000 5012.638       204.0238 648.2067 18.66328 640.4788 13.07194 7.727905       22.78582 
1 1 1 1   4  4  o 302.6554 5.334396 1116.637       39.34322 1061.586       46.51019 1255.125       73.76857 295.0672 6.468313 320.5714 9.453339 -25.50418      11.45446 
1 1 1 1   4  5  o 893.9185 12.75802 9763.371       277.9184 9759.692       392.9184 9767.054       393.1535 892.5156 18.06552 892.8510 18.06954 -0.3354492     25.55135 
1 1 1 1   4  6  o 354.4596 5.295037 1531.635       45.73744 1633.384       67.33677 1444.485       62.31925 365.9500 7.550827 344.1447 7.430963 21.80527       10.59406 
1 1 1 1   4  7  f 642.1534 10.67085 5035.494       166.9836 5315.592       299.3920 4909.019       201.1817 658.0140 18.68999 633.6953 13.02783 24.31879       22.78245 
1 1 1 1   4  8  o 51.24893 2.086925 32.05801       2.600868 31.15754       3.628674 33.00935       3.729775 50.47662 2.963028 51.96030 2.957824 -1.483688      4.186677 
1 1 1 1   4  9  o 114.2987 2.466418 159.2051       6.869798 157.8847       9.602261 160.5896       9.832556 113.7622 3.467741 114.7313 3.520974 -0.9690781     4.941911 
1 1 1 1   4  10 o 433.4948 6.383133 2292.627       67.43012 2268.186       94.65570 2317.809       96.08147 430.9023 9.014297 435.5858 9.051695 -4.683441      12.77461 
1 1 1 1   4  11 o 112.6024 2.492401 154.5241       6.839141 149.4000       9.512629 160.0066       9.839673 110.6511 3.532364 114.5155 3.530198 -3.864433      4.993986 
1 1 1 1   4  12 o 516.4932 8.706173 3259.056       109.5792 3279.586       134.6353 3218.771       188.6010 517.7719 10.67050 511.6969 15.14164 6.074921       18.52374 
1 1 1 1   4  13 o 161.8052 3.429600 319.1178       13.52297 314.7511       16.56168 327.8528       23.42392 160.6232 4.234861 163.8415 5.876294 -3.218292      7.243265 
1 1 1 1   4  14 o 241.5449 3.910004 711.1668       23.01501 720.8528       32.74867 701.7145       32.35125 243.1368 5.527221 239.8873 5.534110 3.249527       7.821544 
1 1 1 1   4  15 o 397.3556 5.925816 1925.220       57.38041 1992.360       82.90501 1863.485       79.49845 404.0755 8.419420 390.7931 8.347871 13.28241       11.85637 
1 1 1 1   4  16 o 327.4596 5.015768 1307.121       40.02499 1311.835       56.68489 1302.434       56.52322 327.9762 7.092329 326.7986 7.097584 1.177582       10.03378 
1 1 1 1   4  17 o 209.1944 4.169820 533.3779       21.25707 544.3569       37.88768 528.3343       25.67966 211.1414 7.374894 208.1884 5.061704 2.953079       8.944825 
1 1 1 1   4  18 o 314.7844 4.872012 1207.860       37.37297 1202.285       52.70998 1213.496       52.99792 313.9905 6.888747 315.4508 6.894314 -1.460266      9.746097 
1 1 1 1   4  19 f 162.4191 3.136118 321.4876       12.41268 318.9545       17.50650 324.0486       17.60226 161.7011 4.446955 162.9887 4.435868 -1.287598      6.281109 
1 1 1 1   4  20 o 415.2902 7.142325 2103.757       72.28154 2133.130       125.6149 2089.217       88.37919 417.5329 12.35927 413.7354 8.765793 3.797455       15.15225 
1 1 1 1   4  21 o 269.7825 6.152746 887.6765       40.45003 0.000000       0.000000 887.6765       40.45003 ?        ?        269.7825 6.152746 0.000000       6.152746 
1 1 1 1   4  22 o 175.8438 3.334353 376.8858       14.28810 360.8800       19.82780 394.1754       20.60761 171.9741 4.735754 179.7395 4.708930 -7.765411      6.678428 
1 1 1 1   4  23 o 572.6700 8.361578 4007.010       116.6887 4002.050       164.8870 4011.986       165.1588 571.5201 11.83910 572.2278 11.84395 -0.7077637     16.74645 
1 1 1 1   4  24 o 289.8377 5.356757 1025.114       37.83493 1059.752       47.12482 962.2906       63.46447 294.5822 6.564582 280.2373 9.306179 14.34488       11.38853 
1 1 1 1   4  25 o 142.1165 3.559570 246.4579       12.31789 245.4019       15.10050 248.5580       21.29514 141.7574 4.376529 142.5119 6.146326 -0.7544250     7.545285 
1 1 1 1   4  26 o 284.6013 4.577252 988.7358       31.74518 987.7154       44.73248 989.7711       45.05822 284.1951 6.459074 284.4842 6.499498 -0.2890625     9.163139 
1 1 1 1   4  27 o 167.5217 3.323208 342.3578       13.56640 334.1939       18.83486 351.1599       19.55709 165.3472 4.679144 169.4885 4.739740 -4.141357      6.660294 
1 1 1 1   4  28 o 198.1135 3.620883 479.0607       17.48094 478.9037       24.56067 479.2218       24.88611 197.8471 5.098428 197.9023 5.164656 -0.5516052E-01 7.257248 
1 1 1 1   4  29 o 298.5721 5.576936 1091.330       40.57710 1056.596       69.66280 1109.166       49.91978 292.1927 9.797384 300.6532 6.813508 -8.460480      11.93368 
1 1 1 1   4  30 o 97.74250 3.018695 116.7021       7.181545 122.3340       10.03735 110.7952       10.27946 99.96676 4.129175 95.09024 4.448396 4.876518       6.069457 
1 1 1 1   4  31 o 71.50977 3.221307 62.56409       5.599086 65.91690       7.802399 59.00439       8.039531 73.27911 4.389419 69.26411 4.792615 4.014999       6.498935 
1 1 1 1   4  32 o 21.85806 6.941967 5.785038       4.154380 4.124266       6.235395 7.110725       5.570954 21.91423 8.377112 24.49183 8.060951 -2.577602      11.62562 
1 1 1 1   4  33 o 78.30032 3.258935 75.04076       6.204758 83.01214       8.628487 66.50461       8.928928 82.22576 4.321333 73.46712 5.017470 8.758636       6.621852 
1 1 1 1   4  34 o 238.9713 4.154360 699.4341       24.19279 709.1915       34.33199 689.8101       34.09676 240.0154 5.869807 236.6958 5.911349 3.319626       8.330587 
1 1 1 1   4  35 f 93.60062 3.688535 107.4147       8.396874 105.5005       10.09417 111.7151       15.12966 92.62395 4.485430 94.82629 6.588303 -2.202339      7.970245 
1 1 1 1   4  36 o 66.63348 4.167672 54.68858       6.733517 53.73235       8.002040 57.00800       12.46265 65.88560 5.021789 67.17463 7.755464 -1.289024      9.239349 
1 1 1 1   4  37 o 91.29451 3.333837 102.2217       7.404490 108.3294       10.39852 95.93944       10.54610 93.72147 4.566733 88.09605 4.932158 5.625412       6.721699 
1 1 1 1   4  38 o 70.90089 3.509873 61.84204       6.045428 61.12031       8.273619 62.66876       8.855016 70.17616 4.868222 70.98621 5.154038 -0.8100433     7.089689 
1 1 1 1   4  39 o 81.64128 3.410276 82.05460       6.769835 86.17958       9.534546 77.86065       9.613932 83.28703 4.716996 79.05162 5.016492 4.235405       6.885873 
1 1 1 1   4  40 o 107.7598 3.931409 143.7988       10.30653 156.9296       19.19513 138.4797       12.21698 110.5620 7.162966 105.3458 4.771325 5.216133       8.606604 
1 1 1 1   4  41 o 62.07988 3.684746 47.94538       5.549277 45.17208       7.645326 51.03334       8.067398 59.59001 5.320772 63.38783 5.270288 -3.797817      7.489096 
1 1 1 1   4  42 o 60.06731 4.179650 45.49230       6.079903 43.48229       9.086654 47.12162       8.181037 57.30020 6.629622 60.33216 5.629444 -3.031963      8.697270 
1 1 1 1   4  43 o 40.98512 4.754503 21.77576       4.660615 23.08489       6.270525 20.15991       6.966483 41.23302 6.451915 37.57525 7.861066 3.657776       10.16974 
1 1 1 1   4  44 o 8.964847 4.425039 -7.028115      3.496925 -9.025098      4.516614 -4.039605      5.525268 10.10736 4.996367 13.75374 6.462916 -3.646373      8.169024 
1 1 1 1   4  45 o 32.69812 6.051459 15.26184       4.644360 17.22179       5.693232 11.36281       8.029968 33.85175 7.127185 25.59777 9.568358 8.253979       11.93106 
1 1 1 1   4  46 o 39.95200 5.536524 22.88918       5.245595 22.49272       6.299162 23.78606       9.474449 37.89505 7.081574 33.72765 10.45140 4.167397       12.62460 
1 1 1 1   4  47 o 18.99027 6.717576 5.866763       3.882427 8.416240       5.449256 3.238457       5.532859 21.41213 7.905157 16.78532 7.287405 4.626810       10.75164 
1 1 1 1   4  48 o 13.95652 5.977824 1.977813       3.626220 5.827486       5.156500 -1.788635      5.100458 18.07260 7.386289 12.88863 6.102686 5.183965       9.581234 
1 1 1 1   4  49 o 10.59980 5.148558 -3.675891      4.189815 5.142735       8.177132 -6.815297      4.878926 16.76056 7.871582 10.30919 5.113259 6.451373       9.386544 
1 1 1 1   4  50 o 17.23051 6.399857 5.931170       3.581249 5.174925       5.025827 6.711241       5.104389 15.83998 6.910283 17.03449 7.185946 -1.194512      9.969445 
1 1 1 1   4  51 o 8.375528 4.168113 -5.396767      3.350634 -4.285718      4.806137 -6.447410      4.673663 10.49606 5.182120 9.701249 4.842865 0.7948151      7.092793 
1 1 1 1   5  0  o 347.4542 5.202111 1471.630       44.04668 1441.279       61.47017 1503.659       63.14649 343.7752 7.337596 351.1341 7.379724 -7.358917      10.40676 
1 1 1 1   5  1  o 615.3914 8.872608 4620.443       133.0573 4620.112       187.6591 4620.777       188.6881 614.9661 12.52225 615.0016 12.59019 -0.3552246E-01 17.75724 
1 1 1 1   5  2  o 510.6998 6.628664 3180.231       82.49503 3185.033       130.5946 3177.043       106.4146 510.8010 10.49149 510.3179 8.557057 0.4830933      13.53863 
1 1 1 1   5  3  o 1141.872 13.26529 15934.13       369.1222 16055.23       524.6854 15815.46       519.3901 1144.491 18.81267 1135.930 18.76316 8.560669       26.57015 
1 1 1 1   5  4  o 396.7330 5.863974 1918.913       56.69261 1971.558       81.60219 1869.795       78.82103 402.0194 8.329494 391.5105 8.261570 10.50894       11.73175 
1 1 1 1   5  5  f 415.1484 6.113605 2101.353       61.84960 2165.120       89.21062 2042.334       85.82468 421.2588 8.690233 409.1446 8.607941 12.11420       12.23179 
1 1 1 1   5  6  o 404.1509 6.875953 1991.974       67.71931 1967.223       115.9697 2004.781       83.41901 401.1002 11.87775 405.3553 8.444872 -4.255127      14.57384 
1 1 1 1   5  7  o 186.4231 3.180484 423.5438       14.44871 431.7883       20.65398 415.6421       20.22005 188.2086 4.503273 184.6564 4.493470 3.552246       6.361661 
1 1 1 1   5  8  o 314.5532 4.783238 1206.244       36.66504 1216.197       52.10907 1196.485       51.59909 315.7603 6.772043 313.1915 6.760767 2.568787       9.569145 
1 1 1 1   5  9  o 158.0901 2.881777 304.5926       11.10200 309.1925       15.80039 300.1072       15.60267 159.2082 4.075900 156.8497 4.085536 2.358521       5.771010 
1 1 1 1   5  10 o 124.8519 2.580636 189.9738       7.851594 187.4651       11.03034 192.5505       11.17881 123.9569 3.655585 125.6284 3.655389 -1.671509      5.169639 
1 1 1 1   5  11 o 380.7326 6.576172 1768.970       61.01397 1741.121       73.76493 1829.296       108.5668 377.5814 8.016842 386.3770 11.54348 -8.795624      14.05424 
1 1 1 1   5  12 o 206.0467 4.888447 517.7136       24.54554 517.7136       24.54554 0.000000       0.000000 206.0467 4.888447 ?        ?        0.000000       4.888447 
1 1 1 1   5  13 o 378.7820 5.667180 1749.806       52.31093 1753.330       74.02719 1746.291       73.93056 378.9865 8.015515 378.2245 8.021179 0.7619934      11.33966 
1 1 1 1   5  14 o 267.1505 4.227350 869.9610       27.52075 896.6766       39.55633 844.8973       38.31384 271.1644 5.986146 263.2191 5.973132 7.945221       8.456491 
1 1 1 1   5  15 o 469.4146 6.897726 2687.321       78.90392 2690.746       111.6736 2683.906       111.5006 469.4969 9.760715 468.9001 9.758002 0.5968628      13.80182 
1 1 1 1   5  16 o 484.2743 7.104055 2860.013       83.83664 2898.159       119.6268 2823.195       117.5269 487.2783 10.07431 480.9389 10.02793 6.339417       14.21447 
1 1 1 1   5  17 f 951.5974 15.73366 11080.21       364.8540 11525.16       650.0159 10875.55       440.8513 965.8945 27.64427 941.7942 19.20879 24.10028       33.66279 
1 1 1 1   5  18 f 40.67743 3.436982 20.30926       3.375108 25.41517       4.712467 14.93173       4.836183 45.46044 4.305110 34.50359 5.967661 10.95685       7.358461 
1 1 1 1   5  19 o 199.6314 3.507193 485.7039       17.06179 474.7778       23.85827 497.1404       24.40918 197.2862 4.966514 201.9429 4.960077 -4.656723      7.019161 
1 1 1 1   5  20 o 592.4845 12.19668 4291.689       176.0982 0.000000       0.000000 4291.689       176.0982 ?        ?        592.4845 12.19668 0.000000       12.19668 
1 1 1 1   5  21 o 548.3581 8.007614 3670.109       107.0049 3683.248       151.6702 3657.088       150.9876 548.8665 11.33959 546.9156 11.32882 1.950867       16.02899 
1 1 1 1   5  22 o 580.0682 9.751528 4112.595       137.8440 4285.681       244.5448 4031.990       166.8821 590.0357 17.02544 573.9122 11.93241 16.12354       20.79058 
1 1 1 1   5  23 o 269.5467 4.364825 885.9811       28.67061 861.8773       39.83895 911.8765       41.29285 265.7491 6.151768 273.3454 6.199075 -7.596313      8.733429 
1 1 1 1   5  24 o 93.65501 3.448484 107.0887       7.856934 109.8665       9.520786 101.1581       13.91144 94.82275 4.130161 90.79639 6.326931 4.026360       7.555679 
1 1 1 1   5  25 o 229.8711 4.508987 644.7787       25.25803 645.5279       30.94210 643.2825       43.72709 229.9205 5.522505 229.1326 7.842749 0.7878723      9.592016 
1 1 1 1   5  26 o 110.2556 2.963892 148.3452       7.956188 151.7944       11.13922 144.7529       11.36776 111.4531 4.108377 108.8188 4.295255 2.634369       5.943734 
1 1 1 1   5  27 o 395.9739 6.010056 1918.426       57.99375 1911.830       81.70199 1925.124       82.33273 394.4751 8.499179 395.8303 8.535469 -1.355194      12.04534 
1 1 1 1   5  28 o 95.60333 3.000917 111.6121       6.982726 119.1438       9.817748 103.9019       9.933399 98.68873 4.091203 92.11433 4.438277 6.574394       6.036244 
1 1 1 1   5  29 o 139.8262 3.755136 238.9174       12.78372 241.5310       23.04023 237.7549       15.36588 140.1348 6.766909 139.3932 4.529567 0.7415161      8.142974 
1 1 1 1   5  30 o 171.9761 3.415442 361.1225       14.31367 342.6366       19.56145 382.4278       21.00022 167.2769 4.803737 176.7168 4.881194 -9.439926      6.848499 
1 1 1 1   5  31 o 83.19837 3.490910 84.70073       7.061932 83.43258       10.83024 85.63875       9.314444 82.32315 5.428887 83.52953 4.593630 -1.206375      7.111557 
1 1 1 1   5  32 o 195.4156 3.668889 466.7762       17.47149 470.0066       24.57088 463.4726       24.84829 195.7206 5.156159 194.3292 5.251950 1.391434       7.359957 
1 1 1 1   5  33 o 140.4080 3.235712 240.8902       11.07128 242.8850       15.44506 238.7818       15.87823 140.7300 4.509494 139.5007 4.677397 1.229279       6.497198 
1 1 1 1   5  34 o 94.96749 3.206870 110.3597       7.410867 112.7534       10.24661 107.7343       10.73128 95.81435 4.400220 93.59647 4.720199 2.217880       6.453078 
1 1 1 1   5  35 o 187.1397 3.642144 428.7086       16.60960 438.5191       23.48351 418.8879       23.49555 188.7775 5.109475 184.4563 5.232329 4.321121       7.313275 
1 1 1 1   5  36 o 189.4630 5.158761 442.5435       23.79587 442.5435       23.79587 0.000000       0.000000 189.4630 5.158761 ?        ?        0.000000       5.158761 
1 1 1 1   5  37 o 25.33981 6.828860 8.271293       4.311468 9.419909       5.921198 6.975058       6.290191 27.21629 8.230147 24.62957 8.562718 2.586721       11.87668 
1 1 1 1   5  38 o 42.23566 4.754273 22.29765       4.808374 23.64336       6.560599 20.73581       7.067833 43.07497 6.448060 39.97809 7.531050 3.096874       9.914343 
1 1 1 1   5  39 o 58.39876 3.886930 42.21530       5.500061 47.25497       7.532835 36.46081       8.049350 61.47439 5.073508 53.56329 6.286262 7.911102       8.078216 
1 1 1 1   5  40 o 66.01961 4.531995 54.44854       7.246962 80.05288       14.28765 45.57957       8.408929 78.51623 7.560707 59.88449 5.836190 18.63174       9.551199 
1 1 1 1   5  41 o 25.78762 7.095928 8.934870       4.598842 12.00132       6.799385 6.349245       6.243592 29.51065 8.795707 23.22752 8.480545 6.283134       12.21819 
1 1 1 1   5  42 o 116.8650 3.315941 169.8262       9.433827 166.1815       12.81201 174.1425       13.94246 114.5449 4.599273 116.9591 4.902678 -2.414200      6.722318 
1 1 1 1   5  43 o 31.44156 5.752828 13.31260       4.245416 13.61606       5.580131 12.89553       6.541723 30.87545 7.493236 29.48810 8.585224 1.387352       11.39538 
1 1 1 1   5  44 o 21.82344 6.708057 6.795055       3.912389 9.728734       5.326313 3.357422       5.765675 25.44272 7.828037 18.82888 7.765263 6.613838       11.02622 
1 1 1 1   5  45 o 21.16117 7.246653 6.728690       4.498954 7.048973       5.232802 5.820953       8.809420 21.54154 7.778331 21.54293 9.273589 -0.1394272E-02 12.10380 
1 1 1 1   5  46 o 24.77664 6.588881 9.621482       4.046806 9.533679       5.427308 9.731421       6.073083 23.42850 7.960643 23.29184 8.383612 0.1366577      11.56100 
1 1 1 1   5  47 o 11.04639 5.181734 -1.975503      3.525263 2.326846       4.893703 -6.616428      5.082613 15.65650 6.824731 11.18002 5.481897 4.476475       8.753751 
1 1 1 1   5  48 o 12.88692 5.868010 0.2115647      4.052785 -0.3462700     5.128777 1.139008       6.613093 13.59203 6.334560 15.38059 7.176397 -1.788567      9.572217 
1 1 1 1   5  49 o 10.18519 4.973304 -4.171045      4.054899 12.49272       8.552012 -9.003754      4.605503 19.98793 8.855614 9.322791 4.676309 10.66514       10.01448 
1 1 1 1   5  50 o 11.81950 5.500140 0.1209979      3.843496 7.525452       6.017561 -4.981113      4.995155 17.15845 7.521600 10.68416 5.276485 6.474289       9.187805 
1 1 1 1   6  0  o 748.2483 12.39492 6839.386       226.0090 6444.894       375.2393 7063.971       283.1252 724.2288 21.28472 759.9242 15.28876 -35.69543      26.20659 
1 1 1 1   6  1  o 196.8917 3.302072 472.4335       15.84346 453.0599       21.87412 493.8131       22.97873 192.7950 4.655849 201.2789 4.684808 -8.483887      6.604874 
1 1 1 1   6  2  f 690.5386 9.921704 5819.708       166.9592 6242.929       247.7576 5467.634       225.9749 714.5824 14.22783 668.7980 13.86529 45.78442       19.86649 
1 1 1 1   6  3  o 351.2857 4.292472 1504.058       36.74549 1477.062       51.32572 1532.444       52.63079 348.0645 6.051168 354.5283 6.091903 -6.463806      8.586496 
1 1 1 1   6  4  o 400.4041 5.911187 1954.685       57.67788 1878.618       112.1085 1982.067       67.26278 391.9972 11.74924 403.1555 6.846461 -11.15836      13.59848 
1 1 1 1   6  5  o 520.8260 8.727213 3309.996       110.7655 3399.919       195.0171 3267.173       134.5803 526.8528 15.20554 517.2580 10.67673 9.594788       18.57959 
1 1 1 1   6  6  o 258.3882 4.061852 813.7708       25.57601 771.2573       35.08800 861.9644       37.35857 251.5051 5.725001 265.8825 5.765864 -14.37733      8.125320 
1 1 1 1   6  7  o 595.3840 8.603209 4326.767       124.8228 4625.605       184.6827 4075.452       169.3627 615.0341 12.32228 577.3491 12.03769 37.68506       17.22627 
1 1 1 1   6  8  o 391.4599 5.811641 1868.897       55.43986 1935.743       80.21810 1807.774       76.70729 398.2094 8.266560 384.8295 8.179604 13.37994       11.62936 
1 1 1 1   6  9  o 368.7002 5.510821 1658.007       49.51374 1651.254       69.80085 1664.847       70.24729 367.7656 7.788495 369.2745 7.806282 -1.508881      11.02718 
1 1 1 1   6  10 o 214.9570 4.135761 563.3433       21.66422 545.0474       25.87564 606.2331       39.61788 211.4070 5.022680 222.7269 7.309221 -11.31982      8.868598 
1 1 1 1   6  11 o 254.7853 4.645378 791.5545       28.84241 776.3443       35.12279 823.0515       50.54237 252.2769 5.713146 259.4909 8.002334 -7.213989      9.832466 
1 1 1 1   6  12 o 440.5575 7.519611 2369.054       80.72984 2417.216       100.0063 2278.961       136.7810 444.8157 9.225946 431.1472 13.03356 13.66852       15.96846 
1 1 1 1   6  13 o 296.1982 4.587417 1069.565       33.11211 1039.947       45.98092 1101.469       47.72282 291.9902 6.462093 300.5002 6.516963 -8.510040      9.177661 
1 1 1 1   6  14 o 714.4437 10.27359 6233.190       178.8654 6195.813       251.9326 6271.180       253.9879 711.5064 14.53013 715.8141 14.56051 -4.307678      20.57020 
1 1 1 1   6  15 o 249.1020 4.021223 756.2882       24.41021 768.6852       34.83610 744.3295       34.21478 251.0985 5.693106 247.0888 5.682305 4.009750       8.043633 
1 1 1 1   6  16 o 156.1789 3.009685 297.2469       11.45459 298.9413       16.18269 295.5457       16.21583 156.5541 4.245720 155.6605 4.278948 0.8936157      6.027896 
1 1 1 1   6  17 o 692.0740 11.53230 5849.443       194.4932 5677.986       330.9153 5939.930       240.3978 679.9969 19.99151 696.9994 14.15344 -17.00244      24.49449 
1 1 1 1   6  18 o 171.9789 3.204401 360.4463       13.42945 376.0969       19.31190 345.7910       18.68770 175.5981 4.516787 168.3681 4.558897 7.230011       6.417546 
1 1 1 1   6  19 f 451.5740 9.458054 2489.290       104.0799 0.000000       0.000000 2489.290       104.0799 ?        ?        451.5740 9.458054 0.000000       9.458054 
1 1 1 1   6  20 o 451.0510 6.685998 2481.531       73.48996 2344.500       100.1017 2641.735       108.2352 438.1954 9.374269 465.1256 9.549096 -26.93027      13.38141 
1 1 1 1   6  21 o 382.3477 5.775403 1782.922       53.81172 1802.527       76.58282 1763.802       75.62869 384.2622 8.178385 380.1134 8.164645 4.148834       11.55627 
1 1 1 1   6  22 o 384.1777 5.812446 1800.467       54.41607 1799.273       76.96864 1801.661       76.94328 383.8220 8.229014 384.0776 8.220829 -0.2555847     11.63180 
1 1 1 1   6  23 o 145.0714 3.472045 256.5720       12.27449 244.3869       19.77816 264.2050       15.65382 141.4003 5.751841 147.1251 4.370985 -5.724792      7.224208 
1 1 1 1   6  24 o 114.3340 3.344154 159.5211       9.307451 156.2239       11.39907 166.1160       16.12150 113.0987 4.142956 116.5109 5.695354 -3.412231      7.042808 
1 1 1 1   6  25 o 121.6943 3.426480 180.7512       10.15131 179.8985       12.18629 182.6841       18.34826 121.3604 4.126582 122.1122 6.186096 -0.7517776     7.436160 
1 1 1 1   6  26 o 275.2491 4.461504 924.9229       29.92563 954.6286       42.99698 897.0140       41.67637 279.3609 6.315914 270.7997 6.315468 8.561218       8.931736 
1 1 1 1   6  27 o 188.8016 3.509522 434.9723       16.14692 432.5093       22.58520 437.5474       23.09368 188.0664 4.932325 189.1479 5.014629 -1.081497      7.033800 
1 1 1 1   6  28 o 211.0824 3.754602 543.9640       19.31310 552.0889       27.29464 535.8173       27.33108 212.4488 5.272141 209.2123 5.365274 3.236481       7.522077 
1 1 1 1   6  29 o 430.7332 7.565372 2281.295       79.40990 2255.248       137.3298 2294.380       97.33217 424.0687 13.30546 430.9890 9.267318 -6.920349      16.21476 
1 1 1 1   6  30 o 309.3740 4.937688 1171.494       37.22575 1136.577       51.54624 1209.556       53.81752 304.0528 6.956838 313.6281 7.041621 -9.575287      9.898587 
1 1 1 1   6  31 o 128.8896 3.516772 203.0952       11.03550 197.8287       17.38700 206.6479       14.28063 126.8716 5.637810 129.8719 4.519167 -3.000305      7.225494 
1 1 1 1   6  32 o 39.91298 4.517421 19.75191       4.316655 21.29218       5.746587 17.75739       6.539290 41.22538 5.887183 37.28456 7.457913 3.940823       9.501547 
1 1 1 1   6  33 o 83.87534 3.179934 86.08094       6.487857 85.43556       8.850931 86.83040       9.537971 83.40394 4.370027 84.03591 4.675960 -0.6319733     6.400135 
1 1 1 1   6  34 o 63.35558 3.586569 49.25893       5.514712 47.72173       7.461671 51.10935       8.186604 62.15045 4.968028 64.27773 5.272762 -2.127281      7.244537 
1 1 1 1   6  35 o 98.92616 3.637206 119.9720       8.753367 118.4038       10.47893 123.5925       15.92250 98.13964 4.392769 99.72725 6.588727 -1.587608      7.918823 
1 1 1 1   6  36 o 64.95673 4.182747 52.00344       6.585780 48.96207       7.725070 60.09410       12.59969 62.84640 5.087587 68.99250 7.621007 -6.146103      9.163149 
1 1 1 1   6  37 o 136.2114 3.309417 227.3108       10.98503 228.5336       15.25086 225.9923       15.83601 136.1539 4.603128 135.3216 4.809873 0.8322296      6.657602 
1 1 1 1   6  38 o 65.53249 3.649472 52.92188       5.805024 45.47274       7.720452 62.61124       8.805164 60.34053 5.304392 70.92585 5.129093 -10.58532      7.378630 
1 1 1 1   6  39 o 78.55347 3.437544 76.03911       6.564429 82.94440       9.103391 68.55895       9.474750 81.69693 4.591052 74.01042 5.288225 7.686508       7.003077 
1 1 1 1   6  40 o 23.36007 7.722457 6.877485       5.110988 -6.779179      10.01440 11.68753       5.943295 19.22575 8.923227 29.46878 8.049918 -10.24302      12.01770 
1 1 1 1   6  41 o 58.42901 4.203513 42.82809       5.945178 33.01974       8.569906 51.92769       8.254466 49.84327 7.269528 63.81538 5.357371 -13.97211      9.030363 
1 1 1 1   6  42 o 26.51397 6.460267 9.570567       4.135170 8.762202       5.278340 10.85506       6.653644 25.18868 7.800187 27.67389 8.784913 -2.485216      11.74809 
1 1 1 1   6  43 o 46.41951 4.343496 27.69528       4.856275 25.25877       6.269799 31.34896       7.677755 43.24534 6.120297 47.73520 6.791628 -4.489861      9.142443 
1 1 1 1   6  44 o 33.44199 5.651222 15.35482       4.441511 13.21678       5.822120 18.33132       6.869513 29.41549 7.939128 34.51200 8.275232 -5.096510      11.46775 
1 1 1 1   6  45 o 11.93553 5.559682 -2.327648      3.942666 -3.671795      4.569423 1.588788       7.799801 12.18188 5.770470 18.46750 8.300003 -6.285620      10.10883 
1 1 1 1   6  46 o 18.20017 6.838813 4.947027       4.113271 8.198217       4.930313 -2.497419      7.460525 21.99122 7.584110 15.55658 7.370311 6.434638       10.57545 
1 1 1 1   6  47 o 26.88783 6.927054 12.14362       4.566744 12.87820       5.586558 10.66410       7.928424 26.22383 8.007389 22.08061 9.106087 4.143213       12.12597 
1 1 1 1   6  48 o 16.81300 6.379707 4.705508       3.599612 5.143220       5.303047 4.331522       4.901834 17.27154 7.307104 16.54369 7.013375 0.7278519      10.12824 
1 1 1 1   6  49 o 13.32518 5.844311 1.929668       3.637294 2.879017       5.187922 1.011864       5.100999 14.80923 6.701995 13.66413 6.350999 1.145091       9.233197 
1 1 1 1   6  50 o 11.18236 5.226427 -0.3473361     3.531902 4.685488       5.077497 -5.065367      4.916139 15.35813 6.812948 10.54922 5.214400 4.808912       8.579408 
1 1 1 1   7  0  o 738.1575 12.23457 6656.611       220.0765 7178.617       401.6164 6432.597       263.0942 764.1262 21.58966 725.1702 14.88796 38.95599       26.22527 
1 1 1 1   7  1  o 696.7506 10.01320 5925.690       170.0146 5867.949       239.0581 5984.784       241.8401 692.7277 14.16135 699.5858 14.18572 -6.858093      20.04441 
1 1 1 1   7  2  o 1271.416 20.98097 19854.98       650.0540 19374.63       1106.041 20108.46       803.4714 1245.409 36.48309 1276.880 25.82165 -31.47156      44.69646 
1 1 1 1   7  3  o 1342.053 19.15897 22098.79       626.5820 22312.78       1258.672 22028.29       722.4638 1333.784 38.76608 1338.348 22.15190 -4.563965      44.64880 
1 1 1 1   7  4  o 391.6339 4.742018 1869.662       45.25636 1884.056       64.44498 1855.657       63.56834 393.0486 6.728323 390.0773 6.687351 2.971283       9.486358 
1 1 1 1   7  5  o 829.7336 10.61202 8409.085       214.5718 8322.889       336.9349 8467.892       278.3031 823.9570 16.78052 831.9438 13.72739 -7.986816      21.68010 
1 1 1 1   7  6  o 316.1055 4.817104 1218.189       37.10685 1282.611       54.22994 1161.471       50.88377 324.2622 6.862884 308.5745 6.766798 15.68777       9.637880 
1 1 1 1   7  7  o 135.9936 3.138528 225.4039       10.40113 200.2398       17.84561 238.3500       12.80002 128.0090 5.735341 139.7857 3.761029 -11.77669      6.858533 
1 1 1 1   7  8  o 209.0915 3.472729 532.9045       17.69471 548.0857       25.43827 518.6733       24.62951 212.0068 4.923815 206.2406 4.900558 5.766220       6.946899 
1 1 1 1   7  9  o 449.7599 6.609959 2468.478       72.44620 2453.609       102.0974 2483.557       102.8151 448.0618 9.350627 450.7867 9.359440 -2.724884      13.23002 
1 1 1 1   7  10 o 286.5808 5.112020 1001.607       35.70061 1005.258       44.09453 994.6595       60.82609 287.0343 6.303979 285.1993 8.762353 1.834991       10.79440 
1 1 1 1   7  11 o 44.92273 2.937846 24.70081       3.198466 25.06628       3.658504 23.51555       6.588439 45.22532 3.343238 43.43728 6.417147 1.788033       7.235815 
1 1 1 1   7  12 o 337.6432 5.936167 1390.419       48.84276 1409.352       60.08212 1353.526       83.87086 339.8524 7.254690 332.6423 10.35922 7.210083       12.64690 
1 1 1 1   7  13 o 380.4695 5.691532 1765.087       52.76976 1708.152       73.03713 1827.267       76.32696 374.1477 8.010591 386.9673 8.094082 -12.81961      11.38788 
1 1 1 1   7  14 o 337.0247 5.127626 1384.676       42.11280 1412.215       60.24771 1358.366       58.88854 340.2733 7.265684 333.7240 7.241146 6.549347       10.25789 
1 1 1 1   7  15 o 655.6003 9.456550 5245.075       151.0803 5139.871       210.7285 5356.342       216.7171 648.5003 13.33451 662.0005 13.43379 -13.50024      18.92818 
1 1 1 1   7  16 o 178.3748 3.222393 387.7479       14.00710 387.3549       19.78925 388.1425       19.82887 178.2104 4.560550 178.3914 4.565042 -0.1810455     6.452768 
1 1 1 1   7  17 o 355.5475 6.261208 1541.365       54.24902 1555.104       95.44513 1534.809       65.93487 356.7004 10.99342 354.7305 7.627470 1.969910       13.38034 
1 1 1 1   7  18 o 140.8421 4.150945 241.9881       14.23119 0.000000       0.000000 241.9881       14.23119 ?        ?        140.8421 4.150945 0.000000       4.150945 
1 1 1 1   7  19 o 476.0365 7.010789 2764.088       81.32859 2768.065       115.0959 2760.121       114.9363 476.1234 9.919828 475.4397 9.920317 0.6837769      14.02910 
1 1 1 1   7  20 o 148.4696 3.038027 268.6472       10.99171 257.2202       15.22075 281.1013       15.89010 145.1968 4.306486 151.7934 4.300068 -6.596619      6.085754 
1 1 1 1   7  21 o 277.4884 4.446259 938.7632       30.06600 940.9103       42.55770 936.6237       42.48188 277.7223 6.288272 277.0888 6.291420 0.6335144      8.895185 
1 1 1 1   7  22 o 332.9241 5.147102 1351.878       41.75843 1319.661       58.15750 1386.164       59.99609 328.7683 7.259048 336.9460 7.306790 -8.177643      10.29966 
1 1 1 1   7  23 o 236.3625 4.557143 681.4202       26.24867 674.4136       32.08846 695.5903       45.63364 235.0817 5.601364 238.4339 7.864583 -3.352142      9.655411 
1 1 1 1   7  24 o 117.3019 3.249195 167.8980       9.278940 142.1488       14.13073 187.4173       12.30309 107.7751 5.397523 123.8890 4.080735 -16.11393      6.766510 
1 1 1 1   7  25 o 151.1555 3.634953 278.6945       13.38933 286.6027       16.33699 262.5148       23.36800 153.1849 4.380930 146.3756 6.567868 6.809280       7.894900 
1 1 1 1   7  26 o 67.37591 3.095849 55.48340       5.069419 60.01144       7.016684 50.53897       7.332202 69.99647 4.131959 64.15646 4.722944 5.840004       6.275291 
1 1 1 1   7  27 o 210.5285 3.733266 540.9913       19.15297 537.3321       26.87020 544.7708       27.30787 209.5682 5.265667 211.0066 5.314978 -1.438400      7.481727 
1 1 1 1   7  28 f 172.1156 3.356455 361.5392       14.07788 361.1780       19.69295 361.9167       20.13258 171.8304 4.707433 171.9915 4.808202 -0.1611023     6.728948 
1 1 1 1   7  29 o 311.9498 4.952435 1190.503       37.64780 1184.705       52.94158 1196.435       53.54765 310.5667 6.995294 312.0840 7.040976 -1.517334      9.925194 
1 1 1 1   7  30 o 245.5276 5.937365 739.4992       35.52468 0.000000       0.000000 739.4992       35.52468 ?        ?        245.5276 5.937365 0.000000       5.937365 
1 1 1 1   7  31 o 265.4038 4.406260 861.9335       28.49794 837.8639       39.50312 888.0541       41.15176 261.1248 6.207935 268.8049 6.282250 -7.680054      8.832051 
1 1 1 1   7  32 o 59.62188 3.515020 43.59609       5.084383 46.47091       6.932671 40.25013       7.479199 61.41605 4.667093 57.01005 5.449791 4.406002       7.175095 
1 1 1 1   7  33 o 70.61154 3.350410 61.08090       5.748694 60.90920       7.798693 61.28522       8.507198 70.34856 4.573951 70.50063 4.983858 -0.1520691     6.764605 
1 1 1 1   7  34 o 131.6924 3.675112 212.3966       11.78264 213.7387       14.30925 209.5703       20.76528 131.9503 4.456499 130.0866 6.571711 1.863770       7.940262 
1 1 1 1   7  35 f 115.4328 3.211842 163.1052       9.026035 159.8082       12.35973 166.8727       13.21237 114.0163 4.457009 116.4641 4.664790 -2.447830      6.451759 
1 1 1 1   7  36 o 108.1241 3.693278 143.4600       9.717010 139.0057       11.52171 154.4327       18.08352 106.2580 4.459495 111.3051 6.698015 -5.047020      8.046769 
1 1 1 1   7  37 f 16.33489 6.582616 1.574849       4.028969 2.536244       5.286494 0.2426510      6.223021 19.08450 7.590987 18.45035 7.864829 0.6341476      10.93063 
1 1 1 1   7  38 o 112.2504 3.212424 154.6871       8.778291 158.6429       12.14004 150.3524       12.70819 113.3057 4.405150 110.1775 4.744317 3.128151       6.474094 
1 1 1 1   7  39 o 67.06736 3.600000 55.55946       5.862129 56.12192       7.938268 54.88484       8.693749 67.02579 4.893853 66.08585 5.446678 0.9399338      7.322301 
1 1 1 1   7  40 o 37.56028 7.988770 19.00574       7.087048 0.000000       0.000000 19.00574       7.087048 ?        ?        37.56028 7.988770 0.000000       7.988770 
1 1 1 1   7  41 o 47.87210 4.258534 28.87523       4.916171 24.47392       6.572689 34.46459       7.406849 43.13049 6.451376 51.53969 6.009984 -8.409203      8.817038 
1 1 1 1   7  42 o 15.65460 6.312428 1.830274       3.707552 -0.3050835     4.620743 5.689742       6.212127 15.05724 6.596046 22.06642 8.379126 -7.009185      10.66384 
1 1 1 1   7  43 o 25.69851 6.400038 9.223583       3.992726 8.732608       5.222039 9.914542       6.194930 24.62666 7.778319 25.94596 8.498316 -1.319302      11.52057 
1 1 1 1   7  44 o 19.66063 7.103668 5.251282       4.365280 8.824798       5.093307 -4.637577      8.472764 24.16440 7.687924 16.78556 7.923108 7.378841       11.03992 
1 1 1 1   7  45 o 13.26779 5.810429 0.3223153      3.583228 -0.2051317E-01 4.697733 0.7992541      5.540912 14.50127 6.485182 15.99817 7.105844 -1.496898      9.620322 
1 1 1 1   7  46 o 13.94499 6.101962 0.9465964      3.944613 2.042584       4.747486 -1.497076      7.088958 15.63896 6.770199 15.58546 7.322671 0.5349541E-01  9.972818 
1 1 1 1   7  47 o 22.91153 6.622722 8.787994       3.905536 14.65268       5.431116 2.507703       5.620262 28.55735 7.650645 16.09293 7.151744 12.46442       10.47281 
1 1 1 1   7  48 o 12.73262 5.682109 0.8150300      3.586066 0.8950999      5.077655 0.7353494      5.065293 14.10484 6.477255 14.00163 6.444284 0.1032124      9.136937 
1 1 1 1   7  49 o 10.67579 5.122828 -2.319708      3.850907 -3.292404      5.926087 -1.608753      5.066411 12.32250 6.015919 12.27170 5.885294 0.5080223E-01  8.415936 
1 1 1 1   7  50 f 13.12623 6.042098 1.668513       4.454623 6.547071       9.391402 0.2522472      5.060076 15.88343 7.713376 12.70211 6.033014 3.181317       9.792519 
1 1 1 1   8  0  o 97.06264 3.359774 114.9551       7.934927 124.7759       11.42815 105.8133       11.02601 101.0669 4.652621 93.03960 4.880177 8.027313       6.742627 
1 1 1 1   8  1  f 442.7000 7.521723 2390.696       81.14523 2407.948       140.6970 2382.097       99.32952 443.5958 13.02964 441.7751 9.226585 1.820709       15.96563 
1 1 1 1   8  2  o 513.6764 7.478931 3218.801       93.61927 3125.851       129.7763 3319.659       135.1846 505.9149 10.52645 521.3497 10.64049 -15.43481      14.96750 
1 1 1 1   8  3  o 645.9313 9.303480 5093.368       146.4428 5018.416       289.4720 5119.149       169.7701 639.0773 18.60715 647.3561 10.76172 -8.278809      21.49513 
1 1 1 1   8  4  o 543.5620 6.435559 3603.532       85.24551 3567.532       119.7255 3640.549       121.4027 540.5776 9.088508 546.0776 9.123002 -5.500000      12.87751 
1 1 1 1   8  5  o 190.7015 2.919669 443.2106       13.56825 467.6261       22.19421 428.6400       17.14534 195.8506 4.650276 187.5272 3.751853 8.323395       5.975070 
1 1 1 1   8  6  o 512.5471 6.674904 3205.057       83.37099 3118.219       129.4525 3266.602       108.9813 505.0720 10.51771 517.2181 8.646539 -12.14612      13.61561 
1 1 1 1   8  7  o 133.8867 3.160804 218.4859       10.31267 210.5005       12.25286 237.8837       19.09697 131.3514 3.832050 139.5412 5.627530 -8.189804      6.808355 
1 1 1 1   8  8  o 121.2746 2.573333 179.2447       7.605049 174.8065       10.70367 183.7693       10.80740 119.6932 3.674023 122.7287 3.617541 -3.035538      5.156069 
1 1 1 1   8  9  o 426.8994 7.267439 2224.620       75.60371 2228.404       92.99876 2217.246       129.8301 427.0616 8.936152 425.2376 12.54245 1.824005       15.40026 
1 1 1 1   8  10 o 705.0647 10.15025 6077.470       174.3981 6378.372       254.9156 5812.716       239.1143 721.0483 14.50761 688.4152 14.25342 32.63312       20.33791 
1 1 1 1   8  11 o 263.5861 4.849718 847.1180       31.15123 845.4849       37.86244 850.5397       54.80444 263.2893 5.901186 263.7943 8.536630 -0.5050049     10.37777 
1 1 1 1   8  12 o 607.3362 8.787080 4502.600       130.0499 4703.181       189.2845 4323.254       178.9840 620.1288 12.52556 594.5846 12.35277 25.54419       17.59206 
1 1 1 1   8  13 o 247.0323 3.977498 743.7904       23.94417 757.9052       34.22488 730.2585       33.51076 249.3257 5.632987 244.7364 5.618878 4.589279       7.956276 
1 1 1 1   8  14 o 515.7443 7.528040 3244.185       94.61337 3271.192       134.5267 3217.751       133.0918 517.6284 10.66484 513.3853 10.63829 4.243103       15.06360 
1 1 1 1   8  15 o 131.1316 2.760177 209.5443       8.820238 207.9805       12.39898 211.1464       12.54979 130.5748 3.901015 131.5651 3.918718 -0.9902344     5.529400 
1 1 1 1   8  16 o 139.0980 2.865040 235.7813       9.711529 234.9548       13.64161 236.6305       13.82865 138.7856 4.037822 139.2785 4.078756 -0.4928589     5.739360 
1 1 1 1   8  17 o 250.8253 5.750447 767.0373       35.14869 0.000000       0.000000 767.0373       35.14869 ?        ?        250.8253 5.750447 0.000000       5.750447 
1 1 1 1   8  18 o 143.7402 3.508682 251.8096       12.29018 232.5755       21.95851 260.5834       14.83076 137.9431 6.551032 146.1559 4.168259 -8.212875      7.764689 
1 1 1 1   8  19 o 179.7884 3.304391 393.9483       14.47735 362.0065       19.62465 432.0881       21.44427 172.2602 4.679327 188.2665 4.674144 -16.00632      6.613904 
1 1 1 1   8  20 o 314.0894 4.894202 1202.805       37.46029 1197.304       52.81432 1208.374       53.14089 313.2686 6.918291 314.7128 6.929124 -1.444214      9.791604 
1 1 1 1   8  21 o 307.5836 4.816613 1153.632       36.10281 1130.076       50.40047 1178.457       51.74006 304.3109 6.796431 310.7543 6.832406 -6.443329      9.637076 
1 1 1 1   8  22 o 159.0627 3.606795 308.4489       13.98060 305.6874       17.23355 313.7644       23.91037 158.2625 4.472974 160.2266 6.135056 -1.964157      7.592524 
1 1 1 1   8  23 o 118.8255 2.898947 172.1185       8.394326 165.8497       11.53761 179.1691       12.23588 116.5444 4.068694 121.1342 4.151207 -4.589859      5.812641 
1 1 1 1   8  24 o 197.5032 3.555521 475.7110       17.11250 476.8922       24.12495 474.5149       24.27723 197.5976 5.014177 197.0999 5.058662 0.4977112      7.122643 
1 1 1 1   8  25 o 63.20411 4.117382 48.95415       6.307135 56.39604       7.803276 34.93133       10.71157 67.79884 4.753119 52.69362 8.641031 15.10522       9.862026 
1 1 1 1   8  26 o 255.5433 4.230461 797.2648       26.34439 781.8546       36.70898 813.6302       37.82948 252.8134 5.958487 257.8892 6.019511 -5.075714      8.469833 
1 1 1 1   8  27 o 96.08524 2.909491 112.7201       6.804701 118.5936       9.515426 106.5725       9.734930 98.47464 3.973383 93.31176 4.292649 5.162880       5.849326 
1 1 1 1   8  28 o 258.9608 4.293394 819.3646       27.09386 825.7978       38.40000 812.9869       38.23354 259.6171 6.069624 257.5905 6.090860 2.026611       8.598774 
1 1 1 1   8  29 o 383.6011 6.756386 1807.074       63.15831 1802.806       107.7669 1809.307       77.94775 380.0614 11.64953 383.0486 8.350520 -2.987213      14.33327 
1 1 1 1   8  30 o 208.1333 4.437428 529.8924       22.50655 530.0349       40.38292 529.8281       27.10679 207.0995 8.016847 207.8679 5.355704 -0.7683563     9.641234 
1 1 1 1   8  31 o 89.13992 3.076413 97.13960       6.672700 91.52498       8.949584 104.1677       10.01294 86.38749 4.264423 92.14597 4.472479 -5.758476      6.179674 
1 1 1 1   8  32 o 242.7851 4.171973 721.4253       24.68310 753.5707       35.53061 691.4410       34.31545 247.5880 5.888939 237.0699 5.944561 10.51804       8.367641 
1 1 1 1   8  33 f 242.4835 4.187385 720.0927       24.74350 719.6411       34.74834 720.5572       35.24207 241.8026 5.897080 241.9229 5.977896 -0.1202850     8.397071 
1 1 1 1   8  34 o 26.14030 7.093295 8.744740       4.632702 8.712068       5.486643 8.825890       8.646711 26.32424 7.914068 28.21872 10.02088 -1.894487      12.76912 
1 1 1 1   8  35 o 62.77847 3.643513 48.42739       5.550051 53.56347       7.435425 41.96534       8.340174 65.86513 4.662625 57.99055 5.987770 7.874577       7.589035 
1 1 1 1   8  36 o 41.53837 5.342266 21.62899       5.282619 25.34603       6.159392 11.28933       10.27288 44.92510 5.758410 31.11407 10.93397 13.81103       12.35763 
1 1 1 1   8  37 o 54.31983 3.882861 36.43236       5.105905 32.59313       6.707871 41.72104       7.872931 51.01875 5.481198 57.74171 5.668097 -6.722965      7.884850 
1 1 1 1   8  38 o 18.34414 6.713325 3.483923       3.916012 -2.447315      5.088844 12.09626       6.132068 14.74940 6.659844 30.29575 8.135127 -15.54634      10.51351 
1 1 1 1   8  39 o 38.57267 4.862591 18.78303       4.469350 18.43822       5.937070 19.23397       6.789599 37.64583 6.718197 38.17834 7.565306 -0.5325165     10.11771 
1 1 1 1   8  40 o 24.24697 6.968314 7.778210       4.335523 9.613847       6.197724 6.019149       6.067074 26.89139 8.471267 22.89357 8.359621 3.997818       11.90150 
1 1 1 1   8  41 o 14.88760 6.677206 -1.601683      5.019102 4.206536       9.047511 -4.183775      6.032448 23.40546 9.697086 14.94549 6.932827 8.459970       11.92047 
1 1 1 1   8  42 o 33.24422 5.359350 14.56110       4.194146 12.83221       5.482607 17.00034       6.512235 30.19000 7.488690 34.61512 7.895541 -4.425114      10.88210 
1 1 1 1   8  43 o 24.27605 6.539220 8.309604       3.954575 17.65771       5.251715 -3.932381      6.009872 35.82381 6.242580 14.59331 6.819653 21.23050       9.245402 
1 1 1 1   8  44 o 15.03403 6.281107 1.567627       3.841884 4.333141       4.864954 -3.014829      6.262389 18.79827 7.341599 15.01688 6.998979 3.781391       10.14321 
1 1 1 1   8  45 o 18.43450 6.551920 4.908225       3.697090 4.813676       4.911445 5.031847       5.616062 18.72269 7.357457 19.22249 7.762679 -0.4998035     10.69539 
1 1 1 1   8  46 o 13.08251 5.889994 -0.8354779E-01 3.947102 -4.308876      4.672551 10.44384       7.375376 11.66082 5.607774 22.89800 9.010625 -11.23718      10.61313 
1 1 1 1   8  47 o 9.463533 4.600280 -4.214535      3.362725 0.6585333      4.495324 -10.40602      5.067071 13.89077 6.266958 9.911366 4.961933 3.979408       7.993468 
1 1 1 1   8  48 o 17.53019 6.576408 5.483402       3.800386 13.06552       5.502947 -1.430212      5.254755 24.87514 7.999215 12.93599 6.145214 11.93915       10.08717 
1 1 1 1   8  49 o 16.38903 6.480440 5.123086       3.831428 0.5824291      5.434737 9.609744       5.402324 13.47597 6.356250 19.87984 7.744344 -6.403871      10.01882 
1 1 1 1   8  50 o 11.31009 5.428133 -1.399551      4.327783 -10.91240      8.231376 2.234712       5.087745 11.61730 5.879388 13.66388 6.348105 -2.046583      8.652493 
1 1 1 1   9  0  o 157.0826 2.926552 300.7129       11.20264 310.4128       16.02666 291.4454       15.66537 159.5264 4.126094 154.5709 4.162675 4.955536       5.861102 
1 1 1 1   9  1  o 243.2914 3.911735 721.4767       23.19168 759.4234       33.70871 687.3707       31.95732 249.5603 5.542817 237.4271 5.523367 12.13329       7.824986 
1 1 1 1   9  2  o 425.0683 7.251927 2204.458       75.11872 2122.287       89.75547 2396.598       137.2494 416.9366 8.833947 442.4104 12.74389 -25.47382      15.50630 
1 1 1 1   9  3  o 454.1473 5.972486 2515.438       66.09795 2591.094       106.3766 2467.859       84.35955 460.5931 9.477471 449.6899 7.698126 10.90317       12.20998 
1 1 1 1   9  4  o 753.4904 9.670255 6936.410       177.5627 6995.734       282.4024 6897.623       228.3467 755.1607 15.34592 750.7066 12.48212 4.454102       19.78132 
1 1 1 1   9  5  o 202.7180 3.431623 500.9044       16.95227 514.9693       24.27673 487.5195       23.68258 205.5057 4.847639 199.9532 4.860316 5.552505       6.864566 
1 1 1 1   9  6  o 572.9064 8.323313 4008.506       116.2026 3859.900       159.9079 4174.791       169.1523 561.5543 11.68536 583.9648 11.88653 -22.41052      16.66845 
1 1 1 1   9  7  o 162.5525 2.944590 322.0526       11.66419 306.1565       16.43055 338.2033       16.56155 158.4063 4.260279 166.5550 4.080441 -8.148758      5.899150 
1 1 1 1   9  8  o 263.7719 4.789392 848.4090       30.78541 871.7767       38.59158 807.5157       51.05177 267.3240 5.924048 257.0154 8.161434 10.30865       10.08481 
1 1 1 1   9  9  o 335.8323 5.863455 1375.720       47.98574 1333.252       80.96448 1398.715       59.57700 330.1008 10.07676 338.5310 7.221778 -8.430206      12.39738 
1 1 1 1   9  10 o 61.98861 2.959386 46.93818       4.457522 46.96884       5.170737 46.84945       8.795529 61.98161 3.436823 61.69456 5.922988 0.2870407      6.847886 
1 1 1 1   9  11 o 306.0367 5.485010 1142.004       40.90600 1147.274       50.01426 1131.355       71.09399 306.6878 6.692082 304.2289 9.601529 2.458923       11.70356 
1 1 1 1   9  12 o 840.7310 12.04182 8637.716       246.7091 8727.494       351.3743 8550.422       346.4761 843.8327 17.08746 835.2473 17.02245 8.585449       24.11940 
1 1 1 1   9  13 o 437.3419 7.447132 2332.796       79.36815 2493.292       101.7783 2083.747       126.7840 452.0161 9.239851 412.7663 12.61928 39.24985       15.64037 
1 1 1 1   9  14 o 631.7357 9.124471 4869.422       140.4686 4834.931       197.7590 4904.544       199.5585 629.0605 12.90053 633.5696 12.92527 -4.509155      18.26161 
1 1 1 1   9  15 o 280.5014 4.422062 959.0016       30.22707 984.8215       43.42345 934.7290       42.10222 284.2051 6.269839 276.8837 6.239811 7.321411       8.845684 
1 1 1 1   9  16 o 243.8545 4.542642 724.8171       26.99451 727.4263       45.88932 723.4365       33.38107 244.0859 7.724671 243.5982 5.623285 0.4876862      9.554678 
1 1 1 1   9  17 o 152.0328 3.589978 281.7023       13.30042 288.1765       24.86880 279.1085       15.74081 153.5786 6.660733 151.2630 4.274586 2.315628       7.914382 
1 1 1 1   9  18 o 310.5110 4.832373 1175.386       36.56567 1124.007       50.36143 1232.671       53.17670 303.5727 6.807681 317.9055 6.864156 -14.33282      9.667531 
1 1 1 1   9  19 o 360.9832 5.486228 1588.940       48.26107 1570.365       67.73923 1608.087       68.77548 358.7326 7.748781 363.0137 7.774536 -4.281158      10.97666 
1 1 1 1   9  20 o 219.0398 3.748300 584.8353       20.00753 572.1524       27.90312 598.2564       28.70369 216.6069 5.286209 221.4920 5.317942 -4.885056      7.498301 
1 1 1 1   9  21 f 418.6559 6.262666 2138.713       63.89289 2130.454       90.05772 2147.084       90.66170 417.5442 8.850798 419.1672 8.875656 -1.623016      12.53451 
1 1 1 1   9  22 o 139.2420 3.390735 236.3668       11.50536 233.6583       14.22057 241.4998       19.57629 138.3567 4.222692 140.5579 5.727294 -2.201248      7.115688 
1 1 1 1   9  23 o 214.1234 3.715000 559.1177       19.38470 549.9911       27.11840 568.6536       27.71969 212.2793 5.242282 215.8489 5.269900 -3.569595      7.433261 
1 1 1 1   9  24 o 279.7715 4.495807 955.2075       30.65117 968.4446       43.61035 942.2850       43.08896 281.4817 6.357749 277.6525 6.368371 3.829132       8.998729 
1 1 1 1   9  25 o 189.8400 4.060375 439.8329       18.78408 437.4668       22.63552 445.0662       33.66405 189.1940 4.913768 190.4895 7.265342 -1.295471      8.770992 
1 1 1 1   9  26 o 27.73231 5.272960 9.712831       3.433295 5.583152       4.616453 14.82392       5.135787 21.98628 7.341508 34.25229 6.387843 -12.26601      9.731509 
1 1 1 1   9  27 o 179.3419 3.416743 392.5292       14.93242 397.0599       21.12597 388.0056       21.10932 180.1668 4.816099 178.0916 4.868579 2.075180       6.848202 
1 1 1 1   9  28 f 104.1755 2.931956 132.5152       7.435791 129.4235       10.26860 135.9236       10.78175 102.8459 4.105457 105.3901 4.206558 -2.544121      5.877917 
1 1 1 1   9  29 o 24.43451 6.033993 7.612042       3.571259 5.424950       4.756738 10.43741       5.406467 21.86727 7.452272 28.61828 7.618142 -6.751013      10.65704 
1 1 1 1   9  30 o 119.2105 3.702692 173.8106       10.74339 181.1902       20.38425 170.9723       12.64170 121.1538 6.933277 118.1404 4.398755 3.013428       8.210930 
1 1 1 1   9  31 o 49.43619 3.672713 30.03568       4.392932 25.23206       5.748106 36.78097       6.811467 45.04696 5.340035 54.52844 5.188490 -9.481483      7.445562 
1 1 1 1   9  32 o 188.8810 3.596552 436.1982       16.55429 420.3264       22.71926 454.1628       24.17071 185.0373 5.043174 192.3120 5.162260 -7.274719      7.216823 
1 1 1 1   9  33 o 48.65805 4.399147 29.24825       5.159970 29.41844       6.164608 28.84994       9.430543 48.65430 5.284096 47.48185 8.460554 1.172451       9.975101 
1 1 1 1   9  34 o 67.79881 3.524232 56.39806       5.802690 67.43256       7.872948 43.27487       8.585800 74.02045 4.384290 58.92337 6.065959 15.09708       7.484509 
1 1 1 1   9  35 o 39.02480 4.913576 19.02431       4.569416 17.61259       5.873251 21.18920       7.273146 37.13396 6.738490 40.60334 7.630704 -3.469379      10.18012 
1 1 1 1   9  36 o 118.1174 3.213878 170.9462       9.242204 180.5873       12.78173 160.3820       13.37966 121.1305 4.337121 114.0061 4.826859 7.124367       6.489158 
1 1 1 1   9  37 o 26.25953 6.494411 8.941115       4.132452 10.63134       5.252364 6.194794       6.695111 28.55569 7.465376 24.05612 8.782030 4.499567       11.52631 
1 1 1 1   9  38 o 39.93696 4.600880 19.98351       4.395936 24.14953       5.916054 14.84776       6.568611 43.66028 5.696136 33.46716 8.134625 10.19312       9.930665 
1 1 1 1   9  39 o 33.44718 5.788440 14.43014       4.547256 14.28027       6.587193 14.56656       6.285027 32.57274 8.281633 32.98237 7.919785 -0.4096298     11.45899 
1 1 1 1   9  40 o 38.17905 4.896824 18.56882       4.451150 16.15990       5.763186 22.13013       7.007402 34.80336 7.037424 40.74620 7.326550 -5.942841      10.15892 
1 1 1 1   9  41 o 17.89742 7.281960 2.300441       4.984746 12.16520       9.499143 -1.448319      5.855783 29.50422 10.50056 16.19433 7.241567 13.30989       12.75547 
1 1 1 1   9  42 o 83.09238 3.310114 86.31017       6.689141 83.85333       9.005312 89.33430       9.991041 80.96856 4.582715 83.25759 4.946670 -2.289032      6.743205 
1 1 1 1   9  43 o 18.34054 6.902790 4.031153       4.194309 3.388844       4.939420 5.691486       7.941483 18.27389 7.314539 22.27602 9.142381 -4.002136      11.70836 
1 1 1 1   9  44 o 29.23472 5.895342 12.10865       4.054817 12.08884       5.383708 12.13463       6.163905 27.88667 7.679212 27.35163 8.422102 0.5350494      11.39746 
1 1 1 1   9  45 o 11.98601 5.484446 -1.179569      3.596473 -2.143226      4.684345 0.2040776      5.613066 12.99661 6.056003 15.47810 6.991147 -2.481489      9.249395 
1 1 1 1   9  46 o 27.29666 6.196248 11.56964       4.027072 10.27754       5.361150 13.24269       6.100496 23.79505 7.910682 26.47344 8.412773 -2.678392      11.54788 
1 1 1 1   9  47 o 11.56191 5.312303 -0.7358198     3.421677 0.8529596      4.737784 -2.467983      4.946955 14.16435 6.407938 12.50966 5.948360 1.654696       8.743263 
1 1 1 1   9  48 o 10.17918 4.941333 -3.759227      3.844254 -5.425198      6.233981 -2.736973      4.883274 12.22002 6.007770 11.90537 5.727291 0.3146477      8.300311 
1 1 1 1   9  49 o 21.01008 6.885931 9.049626       4.066928 15.44912       5.853106 3.075958       5.655017 25.15384 8.261734 14.76376 6.800143 10.39008       10.70038 
1 1 1 1   9  50 o 16.95866 6.981303 6.828393       4.649118 5.866625       9.340828 7.145105       5.360217 15.46150 7.549364 16.77695 7.227993 -1.315446      10.45164 
1 1 1 1   10 0  o 99.01491 2.882870 119.5873       6.948629 121.7987       11.95965 118.4604       8.537457 99.82270 4.931734 98.51814 3.561982 1.304565       6.083561 
1 1 1 1   10 1  o 251.3483 4.665882 770.2849       28.57891 714.8187       47.40485 801.9545       35.82035 241.8347 8.055164 256.4191 5.732492 -14.58432      9.886715 
1 1 1 1   10 2  o 444.9036 6.563244 2415.103       71.15747 2336.637       98.46879 2500.863       102.9440 437.3213 9.239785 452.4153 9.337440 -15.09406      13.13626 
1 1 1 1   10 3  o 297.8532 4.121652 1081.563       29.91642 1098.725       47.75864 1070.479       38.37924 300.0814 6.530957 296.2686 5.315874 3.812805       8.420921 
1 1 1 1   10 4  o 303.9595 4.188807 1126.403       31.02716 1141.289       49.47241 1116.752       39.83512 305.8249 6.638259 302.5952 5.402166 3.229614       8.558615 
1 1 1 1   10 5  o 408.8790 6.080890 2039.660       60.58959 1984.565       68.57738 2235.695       129.3570 403.2361 6.978873 427.0193 12.44428 -23.78320      14.26761 
1 1 1 1   10 6  o 283.2537 4.407483 978.2456       30.42302 942.1309       42.33347 1016.819       43.75084 277.8820 6.251545 288.6886 6.219001 -10.80664      8.818038 
1 1 1 1   10 7  o 180.6385 2.852771 397.6907       12.55779 411.1996       20.37968 389.4219       15.94446 183.6421 4.553959 178.7350 3.660700 4.907135       5.842882 
1 1 1 1   10 8  o 218.7528 3.642699 583.2975       19.41838 609.4020       28.21346 559.8009       26.76707 223.5477 5.179049 214.2588 5.126560 9.288910       7.287261 
1 1 1 1   10 9  o 284.9841 5.179142 990.2968       35.96786 1044.730       45.23643 896.7350       59.30714 292.6581 6.342957 270.8393 8.998343 21.81873       11.00924 
1 1 1 1   10 10 o 287.0503 5.218256 1004.616       36.50225 961.6982       43.32593 1109.595       67.76101 280.8095 6.331403 301.3293 9.238805 -20.51974      11.20010 
1 1 1 1   10 11 o 472.6252 6.942808 2724.341       79.96283 2758.200       114.1776 2691.748       112.0223 475.3190 9.857334 469.5645 9.789783 5.754486       13.89269 
1 1 1 1   10 12 o 474.9565 6.975727 2750.996       80.73825 2729.261       113.7081 2773.095       114.6601 472.8717 9.867607 476.6536 9.871279 -3.781891      13.95750 
1 1 1 1   10 13 o 649.7452 9.390138 5151.438       148.6795 4961.375       204.6543 5363.871       216.3631 637.1941 13.17993 662.5042 13.40166 -25.31006      18.79667 
1 1 1 1   10 14 o 456.6749 6.737978 2543.010       74.98473 2635.111       108.7989 2459.680       103.4891 464.6900 9.607826 448.9660 9.458997 15.72403       13.48269 
1 1 1 1   10 15 o 440.7522 7.499700 2369.310       80.55165 2326.357       137.0206 2391.994       99.57578 436.1296 12.90661 442.7453 9.229192 -6.615631      15.86691 
1 1 1 1   10 16 o 333.6757 5.116602 1357.284       41.60469 1416.507       60.50452 1304.164       57.30187 340.7909 7.285573 327.0020 7.190885 13.78897       10.23662 
1 1 1 1   10 17 o 824.6264 13.69249 8317.874       275.1540 8806.349       496.9867 8101.965       330.4149 844.6953 24.16881 813.0901 16.67573 31.60510       29.36344 
1 1 1 1   10 18 o 276.6664 4.415597 933.0789       29.77021 946.4301       42.52169 920.2427       41.69341 278.5740 6.263741 274.6944 6.228473 3.879608       8.833364 
1 1 1 1   10 19 o 202.3346 3.557465 498.9965       17.54070 497.6369       24.76742 500.3647       24.84534 202.0236 5.030864 202.5765 5.032918 -0.5528717     7.116169 
1 1 1 1   10 20 o 82.88707 2.780490 83.82623       5.608273 79.34523       7.656662 89.01324       8.237774 80.58170 3.910801 85.35738 3.971226 -4.775688      5.573599 
1 1 1 1   10 21 o 291.6879 5.292591 1037.908       37.62035 1057.360       46.88430 1002.740       63.03939 294.3168 6.536966 286.2357 9.048948 8.081116       11.16313 
1 1 1 1   10 22 o 36.91816 3.936345 16.80922       3.486794 15.33439       4.618334 18.76430       5.317368 35.01142 5.601779 38.78243 5.804552 -3.771011      8.066769 
1 1 1 1   10 23 o 404.6476 6.094065 2000.202       60.09249 2007.220       85.12811 1993.232       84.83985 404.8361 8.628943 403.4229 8.629851 1.413269       12.20381 
1 1 1 1   10 24 o 246.3781 4.101790 740.7065       24.62701 736.9179       34.64687 744.5754       35.01169 245.5690 5.789677 246.8378 5.820569 -1.268707      8.209713 
1 1 1 1   10 25 o 59.35424 3.584358 43.14033       5.160247 43.71353       5.934035 41.36235       10.45105 59.70275 4.103639 57.59103 7.634679 2.111729       8.667651 
1 1 1 1   10 26 o 211.6685 3.726067 546.8736       19.21953 530.8249       26.67738 564.1929       27.71326 208.2911 5.259977 214.8007 5.294389 -6.509537      7.463103 
1 1 1 1   10 27 o 39.23734 4.043949 19.00126       3.811390 22.61512       5.468491 15.58739       5.315023 42.65982 5.379710 35.11819 6.448200 7.541630       8.397652 
1 1 1 1   10 28 o 223.8463 4.421269 612.4957       24.11754 586.1662       39.22889 628.4943       30.57920 218.2337 7.387110 226.5438 5.539083 -8.310043      9.233138 
1 1 1 1   10 29 o 208.3750 3.748416 530.4655       19.03397 525.4720       26.67425 535.6459       27.16877 207.0516 5.290946 209.0367 5.337855 -1.985046      7.515771 
1 1 1 1   10 30 o 56.57574 4.376491 39.39348       5.986939 41.19308       11.93190 38.78796       6.921258 57.01823 8.876139 56.03199 5.125603 0.9862480      10.24976 
1 1 1 1   10 31 o 143.6273 3.186472 251.9774       11.15278 248.0300       15.47385 256.2449       16.08895 142.2577 4.469157 144.5770 4.572342 -2.319275      6.393722 
1 1 1 1   10 32 o 46.06133 4.344291 26.21343       4.818716 27.49209       5.818498 23.42163       8.597567 47.05181 5.159061 42.68763 8.563050 4.364178       9.997087 
1 1 1 1   10 33 o 175.3498 3.499471 376.0812       14.95353 365.9893       20.59657 387.3300       21.74511 172.5957 4.901950 177.5212 5.031688 -4.925491      7.024742 
1 1 1 1   10 34 o 100.9531 3.188721 124.7583       7.834789 130.5163       10.72699 118.1745       11.47047 103.0689 4.280161 97.95564 4.820048 5.113274       6.446134 
1 1 1 1   10 35 o 94.39253 3.215072 109.1624       7.384653 106.1379       9.873216 113.0028       11.12553 92.85640 4.375563 95.72477 4.784530 -2.868370      6.483617 
1 1 1 1   10 36 o 19.25160 6.722972 4.146828       3.879938 6.832184       4.918846 -0.2755130     6.312309 23.56674 7.561265 18.21995 7.846630 5.346786       10.89690 
1 1 1 1   10 37 o 43.65942 5.088787 23.90061       5.312743 20.54524       5.958692 36.90833       11.73224 40.12463 6.301458 52.91714 9.444581 -12.79251      11.35379 
1 1 1 1   10 38 o 25.53574 6.732219 8.523804       4.248102 6.541817       5.827278 10.77182       6.206041 23.58882 8.239034 28.61764 8.370625 -5.028818      11.74517 
1 1 1 1   10 39 o 79.98155 3.349205 78.98810       6.513365 82.60632       8.917434 74.85029       9.536250 81.36183 4.515333 77.18520 5.098552 4.176628       6.810540 
1 1 1 1   10 40 o 27.00347 6.336193 9.713494       4.097274 6.889508       5.181865 14.42412       6.692592 23.20948 7.778587 32.28809 8.420012 -9.078608      11.46312 
1 1 1 1   10 41 o 14.52603 6.496370 -1.296136      4.714172 -5.964424      8.523956 0.7608991      5.658264 17.30114 8.096998 17.38558 7.457277 -0.8444405E-01 11.00783 
1 1 1 1   10 42 o 12.88858 5.808005 -1.313316      3.848027 -1.602369      4.431416 -0.4271910     7.758917 13.68089 6.192464 18.69149 8.348520 -5.010592      10.39444 
1 1 1 1   10 43 o 14.92727 6.148157 1.616952       3.608080 1.151790       4.627613 2.338151       5.762123 15.81216 6.762337 18.00945 7.617941 -2.197298      10.18637 
1 1 1 1   10 44 o 28.27356 6.164192 11.58294       4.127047 11.63947       5.443183 11.50650       6.329664 27.05098 7.818254 26.28165 8.589145 0.7693272      11.61458 
1 1 1 1   10 45 o 17.53646 6.671418 4.330801       3.942548 4.709624       5.179193 3.808805       6.079637 18.42346 7.449392 18.10890 7.747938 0.3145542      10.74821 
1 1 1 1   10 46 f 14.28274 6.060421 1.855528       3.665898 4.630756       5.026410 -1.298183      5.358206 17.72466 7.273806 13.84138 6.458718 3.883278       9.727450 
1 1 1 1   10 47 o 14.50350 6.286731 2.159674       4.104298 2.553207       5.127891 1.458175       6.846391 15.46297 6.853741 15.76808 7.338661 -0.3051033     10.04140 
1 1 1 1   10 48 o 13.29125 5.854437 1.672190       3.685873 5.090612       5.398076 -1.313720      5.045038 16.62089 7.207160 12.61059 5.999394 4.010302       9.377414 
1 1 1 1   10 49 o 10.75510 5.253307 -3.632961      4.535100 -2.999882      9.064222 -3.844359      5.237834 13.82078 6.874260 11.36761 5.572040 2.453171       8.848903 
1 1 1 1   11 0  o 505.9486 7.406059 3124.926       91.31239 3374.913       135.8018 2918.636       123.3630 525.2754 10.60919 488.5222 10.36250 36.75317       14.83025 
1 1 1 1   11 1  o 206.4184 3.509202 519.3838       17.65195 479.8942       23.85692 567.1573       26.24018 198.3746 4.935056 215.6556 4.993096 -17.28101      7.020383 
1 1 1 1   11 2  o 231.6430 3.811373 654.1288       21.51477 661.0168       30.57576 647.3736       30.27936 232.8008 5.389602 230.3856 5.393308 2.415161       7.624669 
1 1 1 1   11 3  o 408.7060 7.038441 2038.758       70.10090 2154.318       126.0622 1987.028       84.34433 419.2111 12.35350 403.3211 8.581612 15.88998       15.04171 
1 1 1 1   11 4  o 691.7845 20.21449 5916.422       340.4110 5916.422       340.4110 0.000000       0.000000 691.7845 20.21449 ?        ?        0.000000       20.21449 
1 1 1 1   11 5  o 314.8869 6.867658 1210.026       52.69864 1120.984       71.62319 1315.131       77.81558 302.6877 9.722692 327.8744 9.750025 -25.18671      13.76930 
1 1 1 1   11 6  o 155.2389 3.404597 293.7397       12.87960 293.5416       15.99556 294.1050       21.71918 155.1136 4.235651 155.1775 5.753490 -0.6391907E-01 7.144465 
1 1 1 1   11 7  o 135.9742 2.819461 225.3297       9.342407 214.1347       13.00453 237.2693       13.43007 132.4764 4.032980 139.4588 3.955807 -6.982437      5.649189 
1 1 1 1   11 8  f 87.71969 2.509250 93.84784       5.358344 105.3580       7.889795 83.99371       7.300189 92.90903 3.490959 82.93455 3.620848 9.974487       5.029646 
1 1 1 1   11 9  o 228.1810 3.783512 634.6039       21.03831 622.4246       29.50538 647.2003       30.00625 225.9448 5.358741 230.3982 5.344370 -4.453384      7.568249 
1 1 1 1   11 10 o 482.1352 7.076509 2835.083       83.14268 2832.046       117.6890 2838.110       117.4743 481.6412 10.02712 482.1593 9.998066 -0.5181580     14.15996 
1 1 1 1   11 11 o 395.4567 5.915556 1906.641       57.00732 1818.337       78.39359 2005.744       83.04871 386.0747 8.332457 405.4781 8.404839 -19.40335      11.83517 
1 1 1 1   11 12 o 595.9802 8.636466 4333.141       125.4308 4327.783       177.3869 4338.499       177.3849 595.2449 12.22896 595.9832 12.21368 -0.7383423     17.28356 
1 1 1 1   11 13 o 312.2475 5.610856 1188.582       42.69373 1079.209       70.87477 1250.873       53.48701 297.2157 9.798915 320.2842 6.852936 -23.06857      11.95749 
1 1 1 1   11 14 o 147.2466 3.286908 264.2273       11.79421 247.2077       19.22938 274.4910       14.93286 142.2926 5.556261 150.0159 4.088600 -7.723373      6.898455 
1 1 1 1   11 15 o 221.2872 3.719613 596.8019       20.05812 617.8406       29.06633 577.6741       27.71483 225.1242 5.298243 217.6850 5.224535 7.439163       7.440910 
1 1 1 1   11 16 o 150.1909 2.998061 274.8986       10.97287 250.0113       15.02790 303.3195       16.05937 143.1523 4.312803 157.6949 4.182715 -14.54263      6.007943 
1 1 1 1   11 17 o 190.6170 4.018341 442.8814       18.66571 414.1230       32.88973 456.5447       22.67025 184.0998 7.345881 193.5198 4.807230 -9.420013      8.779033 
1 1 1 1   11 18 o 394.4852 5.932099 1897.862       57.02630 1965.689       82.48343 1835.756       78.92871 401.2851 8.434855 387.8027 8.351953 13.48236       11.87021 
1 1 1 1   11 19 o 373.7140 5.661381 1703.394       51.55822 1753.965       74.36060 1656.574       71.54929 379.0292 8.050709 368.3632 7.970637 10.66599       11.32894 
1 1 1 1   11 20 o 99.67336 3.088753 121.2104       7.493313 120.8873       9.514700 121.7382       12.15955 99.49929 3.931831 99.78237 5.016757 -0.2830811     6.373943 
1 1 1 1   11 21 o 310.2718 4.852190 1174.338       36.68733 1144.113       51.05201 1206.615       52.75746 306.0779 6.844547 314.3226 6.887668 -8.244629      9.710191 
1 1 1 1   11 22 o 199.1751 3.552187 483.7453       17.24117 474.3718       24.10696 493.5603       24.66813 197.0950 5.023252 201.0429 5.039110 -3.947922      7.115173 
1 1 1 1   11 23 o 198.6003 3.565958 481.0572       17.25807 474.9711       24.18583 487.3706       24.63353 197.1788 5.037562 199.7348 5.065091 -2.555954      7.143681 
1 1 1 1   11 24 o 191.4071 3.486269 446.9268       16.26129 436.0089       22.60747 458.6309       23.40726 188.8808 4.915834 193.7165 4.962558 -4.835693      6.985157 
1 1 1 1   11 25 o 74.37522 3.386995 67.63047       6.122623 66.66283       7.153882 70.27982       11.83733 73.79076 3.993234 75.48553 6.498269 -1.694771      7.627150 
1 1 1 1   11 26 o 145.5938 3.109214 258.6193       11.03137 260.3244       15.50611 256.8718       15.69708 145.9155 4.365701 144.9340 4.449663 0.9814758      6.233686 
1 1 1 1   11 27 o 248.6369 4.735842 755.8299       28.69451 762.6680       48.40319 752.1245       35.63062 248.8501 7.992151 247.7928 5.900633 1.057220       9.934381 
1 1 1 1   11 28 o 334.6450 6.003722 1373.141       48.95995 1416.609       84.76835 1351.382       59.97504 337.6866 10.31319 331.4311 7.425765 6.255493       12.70842 
1 1 1 1   11 29 o 203.3156 3.696839 505.0453       18.31629 508.8601       25.82916 501.1865       25.97776 203.7444 5.206484 202.1847 5.277019 1.559662       7.413124 
1 1 1 1   11 30 o 22.13605 7.179739 5.851055       4.427196 1.934371       9.367829 6.977398       5.023601 23.75056 9.856066 23.99051 7.635426 -0.2399540     12.46763 
1 1 1 1   11 31 o 55.83319 3.444380 38.24207       4.663589 40.69929       6.260175 35.17785       6.990759 57.47214 4.505852 53.25562 5.464110 4.216522       7.082315 
1 1 1 1   11 32 o 183.0064 4.021542 409.9791       17.93474 411.1330       22.02737 407.7097       30.89103 182.9811 4.944454 181.5175 6.996675 1.463608       8.567443 
1 1 1 1   11 33 o 228.3398 4.018878 638.6636       22.36261 619.9745       30.82126 659.4391       32.49618 224.3301 5.642498 231.3785 5.763327 -7.048355      8.065589 
1 1 1 1   11 34 o 74.80825 3.275043 68.59597       5.955919 66.36837       7.930817 71.47729       9.019746 73.39417 4.455235 76.09255 4.890140 -2.698387      6.615330 
1 1 1 1   11 35 o 69.13838 3.430998 58.68756       5.762578 60.18097       7.647305 56.72538       8.765739 69.82286 4.518697 67.59882 5.365225 2.224037       7.014575 
1 1 1 1   11 36 o 17.24798 6.534648 2.705497       3.773085 2.449941       4.731404 3.151894       6.253274 18.26064 7.207388 20.82367 8.264642 -2.563038      10.96589 
1 1 1 1   11 37 o 56.12255 4.410342 39.10528       5.983356 40.90836       6.841760 33.24187       12.33776 57.27380 4.950582 49.62860 10.52817 7.645199       11.63403 
1 1 1 1   11 38 o 101.4620 3.636839 127.0135       8.977600 128.0790       14.08017 126.2836       11.65373 100.9562 5.746940 100.7243 4.761300 0.2318497      7.463062 
1 1 1 1   11 39 f 50.70250 4.255439 32.17541       5.209401 35.57639       7.099520 28.20833       7.667647 52.84119 5.598475 46.41549 6.996134 6.425697       8.960402 
1 1 1 1   11 40 o 62.08540 3.641962 48.04309       5.485920 46.53815       7.331150 49.95814       8.269933 60.49905 5.017741 62.44432 5.490516 -1.945263      7.437976 
1 1 1 1   11 41 o 58.17284 4.809011 43.35244       6.756445 40.13658       12.29366 44.74415       8.087329 51.98198 10.06870 58.50763 5.746317 -6.525642      11.59305 
1 1 1 1   11 42 o 35.02655 5.766962 16.54505       4.751278 20.49832       5.707670 7.623237       8.574470 38.75198 6.257162 24.37092 9.676050 14.38106       11.52293 
1 1 1 1   11 43 o 35.44187 5.266116 17.01252       4.410204 13.38770       5.721681 22.31835       6.922404 29.62430 7.814487 38.75238 7.602004 -9.128073      10.90214 
1 1 1 1   11 44 o 34.57649 5.741062 16.97948       4.667791 20.42173       6.151100 12.30590       7.167323 36.62504 7.148566 26.33023 9.141041 10.29481       11.60434 
1 1 1 1   11 45 o 10.39200 4.998065 -3.989227      3.713781 -4.955227      4.853335 -2.624516      5.768618 11.70798 5.651697 13.88925 6.550394 -2.181270      8.651551 
1 1 1 1   11 46 o 11.69079 5.354513 -0.7778529     3.439065 5.188682       4.839755 -6.863303      4.887746 18.04528 7.234459 10.80552 5.313800 7.239767       8.976295 
1 1 1 1   11 47 o 22.03521 7.645933 9.718163       5.014181 15.88471       6.851912 2.608441       7.357274 26.15384 8.943456 16.31916 7.599315 9.834671       11.73606 
1 1 1 1   11 48 o 10.96053 5.313031 -3.296471      4.403040 2.731847       8.600049 -5.437955      5.125785 15.75388 7.584249 10.96185 5.400584 4.792029       9.310593 
1 1 1 1   11 49 o 19.36211 6.825356 7.975024       4.005272 8.263013       5.625928 7.679039       5.703490 17.95327 7.557182 17.45260 7.486540 0.5006638      10.63763 
1 1 1 1   12 0  o 180.2085 3.239799 395.8270       14.22753 406.5914       20.27229 385.3786       19.97259 182.6118 4.555518 177.7230 4.615537 4.888840       6.485054 
1 1 1 1   12 1  o 816.1404 16.65108 8188.684       331.1642 7946.254       458.7805 8452.420       478.5165 800.0884 23.55614 825.0229 23.82594 -24.93451      33.50473 
1 1 1 1   12 2  o 89.88637 2.908790 98.57440       6.363120 99.36579       7.834960 97.04105       10.90590 90.21700 3.570845 89.06480 5.045444 1.152199       6.181216 
1 1 1 1   12 3  o 425.3077 7.281362 2207.582       75.46610 2167.667       91.39391 2293.115       133.7874 421.2763 8.902543 432.5691 12.70558 -11.29279      15.51409 
1 1 1 1   12 4  o 180.7512 3.245477 398.2012       14.29538 410.7928       20.43075 386.1238       20.00929 183.5589 4.567438 177.9010 4.619392 5.657944       6.496173 
1 1 1 1   12 5  o 675.2529 8.711505 5567.312       143.3494 5148.955       214.8754 5902.832       192.4299 648.4160 13.59868 694.7943 11.36528 -46.37830      17.72269 
1 1 1 1   12 6  o 312.0066 3.924112 1186.591       29.83605 1131.888       40.96696 1248.381       43.53954 304.6724 5.517783 319.9639 5.584016 -15.29150      7.850297 
1 1 1 1   12 7  o 278.9812 3.934230 948.6547       26.74674 974.2681       43.13454 932.6544       34.09221 282.6463 6.262470 276.5869 5.058102 6.059479       8.050027 
1 1 1 1   12 8  o 243.0597 3.535835 720.0155       20.94310 712.9217       33.12786 724.7381       27.02987 241.8126 5.621839 243.8353 4.548951 -2.022659      7.231738 
1 1 1 1   12 9  o 272.9244 3.863960 907.8409       25.69870 951.3316       42.03453 881.8827       32.47475 279.3259 6.175313 268.9705 4.954559 10.35535       7.917206 
1 1 1 1   12 10 o 572.0011 7.432896 3990.294       103.6075 4303.036       173.0226 3815.466       129.3651 593.5539 11.96208 559.1655 9.493811 34.38843       15.27167 
1 1 1 1   12 11 f 459.5887 6.777339 2575.535       75.90399 2597.232       108.0651 2554.406       106.6380 461.3472 9.612169 457.5312 9.564348 3.816010       13.55989 
1 1 1 1   12 12 o 373.0578 6.516570 1696.916       59.24222 1737.415       105.3722 1678.198       71.63609 377.0343 11.48194 370.9329 7.925021 6.101349       13.95138 
1 1 1 1   12 13 o 345.1801 6.039257 1452.677       50.80020 1517.868       89.81303 1422.009       61.60103 352.4655 10.46811 341.4636 7.402995 11.00192       12.82129 
1 1 1 1   12 14 o 190.8987 3.393006 444.1235       15.78424 442.0116       22.46623 446.1821       22.18108 190.3617 4.846942 191.3211 4.757553 -0.9593658     6.791697 
1 1 1 1   12 15 o 222.7510 3.747904 604.7374       20.34437 606.2302       29.05096 603.3008       28.49953 222.9935 5.346041 222.4561 5.257233 0.5373383      7.497910 
1 1 1 1   12 16 o 285.0468 5.246212 990.6068       36.44165 1060.720       67.31721 961.5427       43.34153 294.6169 9.388305 280.7951 6.334007 13.82175       11.32519 
1 1 1 1   12 17 o 178.8151 3.317768 389.7036       14.45727 389.7678       20.67057 389.6421       20.22796 178.7410 4.749821 178.7169 4.648568 0.2406311E-01  6.646050 
1 1 1 1   12 18 o 604.1716 8.774980 4457.669       129.1941 4520.127       184.5828 4397.687       180.8892 607.6921 12.46440 599.4227 12.38350 8.269409       17.57021 
1 1 1 1   12 19 o 149.8160 3.425134 273.5931       12.50466 275.7756       15.85173 269.9973       20.34653 150.3312 4.331562 148.6692 5.626232 1.662003       7.100487 
1 1 1 1   12 20 o 413.5422 6.199049 2087.373       62.47137 2160.581       90.41210 2020.489       86.41885 420.3571 8.826167 406.5172 8.723555 13.83990       12.40974 
1 1 1 1   12 21 o 142.0385 3.028444 245.9496       10.48242 230.6514       14.42699 263.0578       15.25654 137.4457 4.312670 146.7957 4.269415 -9.349976      6.068528 
1 1 1 1   12 22 o 106.0039 2.820239 137.0890       7.278767 132.5666       10.12429 141.9274       10.47197 104.1715 3.995634 107.7920 3.993532 -3.620529      5.649194 
1 1 1 1   12 23 o 114.7012 2.859008 160.4197       7.991335 161.9497       11.23535 158.8531       11.36874 115.1369 4.010508 114.0228 4.098185 1.114090       5.734046 
1 1 1 1   12 24 o 176.9051 3.356353 381.7821       14.46918 380.7356       20.38757 382.8442       20.53829 176.4920 4.744588 176.9778 4.766562 -0.4857941     6.725416 
1 1 1 1   12 25 o 112.5803 3.458599 154.8092       9.477275 158.9225       11.30362 145.0748       17.38910 114.0139 4.074953 108.6206 6.600605 5.393356       7.757140 
1 1 1 1   12 26 o 195.8000 4.044198 468.2169       19.29662 477.4825       32.18757 463.0185       24.10960 197.2133 6.707308 194.5115 5.090754 2.701843       8.420437 
1 1 1 1   12 27 o 250.4758 4.193660 766.6082       25.59735 762.4827       36.03948 770.8080       36.36293 249.4472 5.928760 250.8003 5.949696 -1.353119      8.399349 
1 1 1 1   12 28 o 152.1899 3.208058 282.7544       11.89773 276.6825       16.50923 289.3158       17.16158 150.3395 4.511377 153.7245 4.586316 -3.385025      6.433259 
1 1 1 1   12 29 o 62.97733 3.427827 48.58775       5.240817 44.01980       7.440608 53.08523       7.382997 59.71926 5.163463 65.69495 4.641620 -5.975689      6.943053 
1 1 1 1   12 30 o 52.01711 4.513614 33.37387       5.664884 47.35346       12.39423 29.68234       6.369069 61.25466 8.534615 48.88977 5.437816 12.36489       10.11976 
1 1 1 1   12 31 o 197.3119 4.161225 476.5753       20.00831 476.6318       24.63113 476.4655       34.30695 197.0196 5.134628 196.2636 7.185216 0.7560272      8.831293 
1 1 1 1   12 32 o 56.64246 3.451079 39.37616       4.740969 39.49200       6.251855 39.21940       7.272865 56.57248 4.573868 56.24179 5.371712 0.3306961      7.055180 
1 1 1 1   12 33 o 76.00188 3.194625 70.75308       5.903516 63.18991       7.729626 81.34080       9.145506 71.63404 4.449926 81.27402 4.636878 -9.639977      6.426701 
1 1 1 1   12 34 o 77.40539 3.247420 73.44400       6.111952 73.21671       8.108060 73.74314       9.301538 77.10583 4.332555 77.25549 4.967028 -0.1496506     6.591085 
1 1 1 1   12 35 o 174.2653 3.510931 372.1600       14.90971 351.8433       20.24014 396.2650       22.04653 168.9049 4.922648 179.2011 5.053559 -10.29623      7.054851 
1 1 1 1   12 36 o 29.45876 5.795145 11.13566       4.011935 14.10491       5.108913 6.359054       6.479861 33.06550 6.571985 24.05084 8.659445 9.014656       10.87092 
1 1 1 1   12 37 o 88.51527 4.345340 96.99731       9.344342 87.52055       11.00456 121.4908       17.69164 83.69749 5.424628 97.62988 7.493451 -13.93240      9.250859 
1 1 1 1   12 38 o 35.00034 4.906390 15.53815       4.069983 16.66702       5.271884 13.87273       6.403349 35.86410 6.259714 32.14822 8.160682 3.715885       10.28498 
1 1 1 1   12 39 o 60.89385 3.558523 46.03815       5.257541 45.27571       6.838133 47.14049       8.222334 59.96651 4.717386 60.79681 5.613156 -0.8303032     7.332206 
1 1 1 1   12 40 o 39.88452 4.505569 20.24969       4.302581 21.47767       5.543441 18.38904       6.823651 40.56089 5.770996 36.46250 7.907657 4.098389       9.789557 
1 1 1 1   12 41 o 16.62548 7.344256 -0.4197865     5.840225 -9.835551      8.994525 6.443493       7.679204 16.24613 7.804489 23.47764 9.207696 -7.231506      12.07028 
1 1 1 1   12 42 o 16.84183 6.676251 2.761299       4.075968 2.361128       4.520904 4.499374       9.421863 16.91791 6.915440 22.48265 9.632846 -5.564741      11.85812 
1 1 1 1   12 43 o 46.99571 4.157883 28.81332       4.712673 33.32727       6.172366 22.50376       7.297486 49.70164 5.171728 38.18729 8.093561 11.51436       9.604816 
1 1 1 1   12 44 o 12.80681 5.701122 -0.1626159     3.587082 2.077456       4.278509 -5.462507      6.581045 15.62864 6.585171 13.90192 6.677688 1.726719       9.378486 
1 1 1 1   12 45 o 14.97279 6.175047 2.406970       3.646080 4.020279       4.675102 -0.9775443E-01 5.825220 17.26731 7.042193 15.13033 6.944314 2.136980       9.890196 
1 1 1 1   12 46 o 25.13868 6.964350 10.87134       4.413139 11.17644       6.543003 10.61670       5.977507 22.98297 8.627579 22.90060 8.307276 0.8236885E-01  11.97689 
1 1 1 1   12 47 o 14.74157 6.811008 1.346175       5.736562 -6.109921      8.790665 6.876473       7.570773 14.00419 6.931317 18.20255 8.179384 -4.198359      10.72126 
1 1 1 1   12 48 o 11.82931 5.459843 0.2046033E-01  3.672563 6.146993       5.227221 -5.951803      5.160989 17.03886 7.233639 10.76040 5.323129 6.278466       8.981160 
1 1 1 1   12 49 o 15.97276 6.395443 5.130380       3.777302 4.489127       5.247499 5.819952       5.441611 15.16706 6.812994 16.03690 7.086498 -0.8698416     9.830328 
1 1 1 1   13 0  o 175.7980 4.556151 377.0192       19.50213 400.5468       28.34440 355.8683       26.87462 181.0979 6.432919 170.6831 6.472969 10.41486       9.125885 
1 1 1 1   13 1  o 229.6479 4.407779 642.9113       24.66711 643.6071       30.10892 641.4909       43.01766 229.7437 5.377934 229.1451 7.714714 0.5985718      9.404201 
1 1 1 1   13 2  o 60.11256 2.692661 44.12517       3.934407 38.20918       5.238880 51.77808       5.958511 55.85449 3.872953 65.06735 3.774039 -9.212864      5.407692 
1 1 1 1   13 3  o 244.4025 3.566254 728.0338       21.23998 699.9709       32.79525 748.3098       27.87638 239.5910 5.616998 247.7566 4.617161 -8.165558      7.271096 
1 1 1 1   13 4  o 558.6818 7.267201 3807.697       98.93906 3813.282       156.5275 3803.981       127.6802 558.5820 11.49920 558.1827 9.386662 0.3992310      14.84389 
1 1 1 1   13 5  o 496.8096 6.513346 3010.094       78.85518 3148.836       128.3450 2925.962       99.94385 507.7768 10.37218 489.6724 8.375569 18.10434       13.33163 
1 1 1 1   13 6  o 339.6232 4.629737 1405.998       38.31684 1359.081       59.31874 1439.590       50.19360 333.8040 7.292296 343.6072 5.994459 -9.803192      9.439869 
1 1 1 1   13 7  o 463.2331 6.106594 2616.385       68.93419 2712.538       111.9117 2557.598       87.50547 471.4199 9.741626 457.8979 7.842064 13.52191       12.50589 
1 1 1 1   13 8  o 202.6345 3.134932 500.3864       15.48024 513.7388       25.05684 492.1441       19.68666 205.2937 5.008579 200.9479 4.020245 4.345779       6.422479 
1 1 1 1   13 9  o 863.9219 11.05674 9112.141       232.7757 9146.130       369.2248 9089.720       299.8780 864.2302 17.53175 862.2870 14.27107 1.943115       22.60588 
1 1 1 1   13 10 f 179.3717 3.210333 392.0901       14.03266 406.2799       20.80066 380.2378       19.01032 182.5116 4.680682 176.5714 4.421552 5.940231       6.438859 
1 1 1 1   13 11 o 699.1569 10.07247 5965.924       171.6117 6302.021       357.7950 5865.502       195.5763 716.4218 20.51525 693.0624 11.57998 23.35944       23.55783 
1 1 1 1   13 12 o 329.8533 5.823290 1326.481       46.80856 1324.398       80.57301 1327.542       57.50846 329.2516 10.05391 329.9363 7.152627 -0.6846924     12.33860 
1 1 1 1   13 13 f 254.8228 4.144228 791.4430       25.73464 773.3528       36.16445 810.0005       36.62854 251.8532 5.892483 257.7532 5.831488 -5.900009      8.290212 
1 1 1 1   13 14 o 187.5787 3.389061 428.8169       15.49170 417.0308       21.87991 440.6649       21.93734 184.8969 4.860228 190.1317 4.734708 -5.234879      6.785225 
1 1 1 1   13 15 o 335.7962 5.988989 1374.982       49.00783 1392.928       87.07826 1366.662       59.28905 337.5345 10.59971 334.7170 7.268765 2.817566       12.85258 
1 1 1 1   13 16 o 314.5873 5.691638 1206.799       43.63295 1126.570       73.99155 1249.572       54.02651 303.5330 10.01695 320.0525 6.927070 -16.51953      12.17881 
1 1 1 1   13 17 o 492.7852 7.254131 2963.270       87.11224 3096.104       126.9919 2845.213       119.7201 503.3192 10.35372 482.5195 10.18160 20.79971       14.52117 
1 1 1 1   13 18 o 184.2006 3.829227 413.6243       17.18851 417.4423       21.72696 407.2376       28.10104 184.9587 4.824573 182.5847 6.325259 2.374023       7.955213 
1 1 1 1   13 19 o 528.0018 7.746505 3405.568       99.67296 3607.937       146.5771 3231.502       135.9408 542.7369 11.08257 513.6974 10.85941 29.03955       15.51613 
1 1 1 1   13 20 o 371.5668 5.653089 1685.095       51.18690 1702.351       72.98605 1668.392       71.80679 373.1400 8.026606 369.4073 7.976711 3.732666       11.31611 
1 1 1 1   13 21 f 297.3607 4.708103 1078.980       34.11659 1085.517       48.49357 1072.574       48.00640 298.0381 6.676920 296.2595 6.649527 1.778625       9.423241 
1 1 1 1   13 22 o 99.76412 2.811290 121.4455       6.827833 122.7455       9.659810 120.1475       9.652224 100.2262 3.962853 99.15534 4.002845 1.070885       5.632670 
1 1 1 1   13 23 o 27.06540 4.858377 9.218321       3.086615 7.182173       4.100220 11.88130       4.689066 23.91076 6.745527 30.58806 6.491801 -6.677303      9.361923 
1 1 1 1   13 24 o 207.4579 3.677655 525.2489       18.59247 539.7256       26.65667 511.5347       25.94521 210.1278 5.205785 204.5003 5.210519 5.627502       7.365440 
1 1 1 1   13 25 o 87.86632 3.904117 94.44914       8.338646 101.9971       10.59490 82.16345       13.51706 91.22816 4.782459 81.57496 6.863288 9.653206       8.365204 
1 1 1 1   13 26 o 173.0559 3.366840 365.5346       14.19858 345.3355       19.52402 388.2094       20.68597 167.9931 4.773999 178.1249 4.769866 -10.13176      6.748533 
1 1 1 1   13 27 o 52.99229 3.296620 34.41288       4.236054 30.33531       5.612871 39.80872       6.456750 49.58129 4.701668 56.85777 4.702024 -7.276478      6.649415 
1 1 1 1   13 28 o 88.11571 2.925566 94.86817       6.273310 93.16334       8.658892 96.75163       9.101228 87.20377 4.086018 88.85560 4.215209 -1.651825      5.870565 
1 1 1 1   13 29 o 159.5670 3.283319 310.9825       12.76709 316.8163       18.06457 305.1606       18.04624 160.8033 4.614727 157.7992 4.698181 3.004150       6.585485 
1 1 1 1   13 30 o 123.5740 4.623110 187.3184       13.89731 169.2815       22.01964 199.2595       17.91642 116.7374 7.784901 127.2175 5.794422 -10.48008      9.704638 
1 1 1 1   13 31 o 133.0395 3.136791 216.2577       10.16957 214.1269       14.07572 218.5846       14.70905 132.1381 4.377301 133.4778 4.528652 -1.339706      6.298369 
1 1 1 1   13 32 o 76.61880 3.125922 71.87005       5.824205 77.71326       8.007817 65.30762       8.486338 79.53804 4.145767 72.78687 4.811429 6.751167       6.351160 
1 1 1 1   13 33 o 29.34666 5.496776 10.94490       3.786577 6.014376       4.728791 19.75608       6.321503 22.48184 7.427943 39.39230 6.832854 -16.91046      10.09268 
1 1 1 1   13 34 o 146.8936 3.278726 264.1187       11.73665 259.9481       16.10785 268.8386       17.13608 145.3523 4.553189 147.7512 4.765548 -2.398911      6.591053 
1 1 1 1   13 35 o 137.7401 3.227986 232.4054       10.83498 223.6199       14.73520 242.7474       15.98722 134.7026 4.495239 140.2841 4.683146 -5.581421      6.491457 
1 1 1 1   13 36 o 88.10211 3.469908 95.43614       7.435158 92.03371       11.11146 98.19477       10.00514 85.98904 5.328822 89.05909 4.625940 -3.070045      7.056605 
1 1 1 1   13 37 o 104.1569 3.639310 133.7448       9.223064 128.0098       10.68199 150.5441       18.28223 101.6531 4.322031 108.8873 6.925839 -7.234276      8.163774 
1 1 1 1   13 38 f 19.76111 6.723699 4.693468       3.871888 2.997941       4.459752 9.883176       7.802429 18.25933 7.057511 27.82322 9.542790 -9.563894      11.86901 
1 1 1 1   13 39 o 22.61120 6.310818 6.767665       3.609116 9.564478       4.518562 1.839084       5.998318 26.67524 6.899719 18.89251 7.867287 7.782732       10.46424 
1 1 1 1   13 40 o 13.32425 5.847614 -0.4906853     3.646620 1.431594       4.216795 -6.192043      7.262120 16.01802 6.626777 15.64438 7.369364 0.3736448      9.910686 
1 1 1 1   13 41 o 19.11864 7.935594 2.772779       6.074644 1.217457       8.120452 4.749106       9.153757 20.00226 8.753680 22.95720 9.650178 -2.954939      13.02892 
1 1 1 1   13 42 o 15.49811 6.279630 2.031152       3.689053 3.437466       4.511033 -0.8082883     6.409897 17.86825 7.042168 16.61562 7.491034 1.252632       10.28143 
1 1 1 1   13 43 f 22.73200 6.553023 7.651426       3.828598 8.182750       4.758866 6.676514       6.446241 23.08182 7.440270 21.49837 8.434771 1.583448       11.24735 
1 1 1 1   13 44 o 25.99511 6.167035 10.17632       3.847371 15.37731       4.914109 1.939139       6.184310 31.76461 6.565536 16.99278 7.529512 14.77182       9.989986 
1 1 1 1   13 45 o 14.11064 5.974325 1.737212       3.549417 8.586658       4.797560 -6.545560      5.275706 22.17388 7.484920 11.53454 5.640872 10.63934       9.372484 
1 1 1 1   13 46 o 16.29396 6.393464 4.043561       3.703974 4.859152       5.497452 3.365519       5.012494 17.47106 7.417737 16.14064 6.971936 1.330412       10.17992 
1 1 1 1   13 47 o 13.89439 6.211195 1.716152       4.304405 0.3119677      5.125649 5.075569       7.928093 13.61388 6.340688 17.03238 7.916930 -3.418490      10.14308 
1 1 1 1   13 48 o 10.36245 4.957633 -2.054919      3.547618 4.003561       5.211985 -7.284948      4.842541 15.29265 6.835593 9.955506 4.963463 5.337141       8.447561 
1 1 1 1   13 49 o 13.80769 6.161845 2.879322       4.217113 3.420786       5.244055 1.888240       7.094751 14.40421 6.602783 14.14159 6.828126 0.2626238      9.498424 
1 1 1 1   14 0  o 392.3870 8.336498 1878.652       79.71395 1828.710       110.5745 1932.693       115.0221 386.6916 11.74785 397.5259 11.88688 -10.83435      16.71256 
1 1 1 1   14 1  o 87.78846 2.668258 94.00343       5.701603 91.90907       7.904653 96.27477       8.231867 86.75821 3.747672 88.79535 3.813163 -2.037140      5.346519 
1 1 1 1   14 2  o 191.0005 3.398988 444.6039       15.82050 417.2836       21.58614 476.3089       23.25397 184.9564 4.793311 197.6707 4.827462 -12.71426      6.802957 
1 1 1 1   14 3  o 494.0971 6.495222 2976.990       78.20642 2804.318       118.5341 3110.099       104.0728 479.2783 10.14891 504.8824 8.458844 -25.60413      13.21183 
1 1 1 1   14 4  o 118.9687 2.475663 172.4725       7.177287 162.7411       11.00436 179.6768       9.468369 115.4877 3.915809 121.3811 3.203817 -5.893433      5.059446 
1 1 1 1   14 5  o 574.1888 7.466843 4021.011       104.4787 4325.637       173.4227 3847.458       130.9001 595.0917 11.95876 561.4866 9.566754 33.60510       15.31452 
1 1 1 1   14 6  o 195.5572 3.457421 466.0580       16.47640 512.7191       35.34025 453.0988       18.62439 204.9260 7.087461 192.8132 3.963776 12.11275       8.120568 
1 1 1 1   14 7  o 426.2123 6.348814 2214.829       65.94087 2297.557       135.6139 2189.213       75.46230 433.4746 12.85241 423.6957 7.308695 9.778900       14.78517 
1 1 1 1   14 8  o 401.7992 5.376998 1967.994       52.64838 2001.032       84.39116 1946.942       67.36535 405.0155 8.550454 399.5842 6.918185 5.431366       10.99871 
1 1 1 1   14 9  o 943.7125 12.06051 10876.73       277.3586 11129.59       445.8658 10717.12       354.2420 952.9178 19.20050 936.0456 15.52984 16.87225       24.69484 
1 1 1 1   14 10 o 1059.832 15.12750 13738.17       390.6971 13450.35       769.7061 13838.06       453.4568 1042.302 30.33596 1062.995 17.50525 -20.69385      35.02434 
1 1 1 1   14 11 o 433.9527 6.425530 2296.170       67.94969 2526.627       144.5531 2230.804       76.98543 454.5103 13.06467 427.6818 7.386720 26.82846       15.00831 
1 1 1 1   14 12 f 399.0281 5.346461 1941.082       51.98834 1976.265       83.59474 1918.891       66.38878 402.4635 8.523469 396.6722 6.867944 5.791229       10.94615 
1 1 1 1   14 13 o 90.19460 2.768295 99.22984       6.077354 89.35375       8.899791 107.8588       8.318933 85.51258 4.284492 94.00321 3.638394 -8.490631      5.620924 
1 1 1 1   14 14 o 210.5676 4.245996 540.4566       21.78749 507.0388       37.93429 556.9069       26.61519 203.7201 7.654822 213.7293 5.110101 -10.00916      9.203773 
1 1 1 1   14 15 o 289.1410 5.311712 1019.359       37.42660 1058.388       67.75429 1002.220       44.89821 294.2516 9.461211 286.6539 6.427396 7.597687       11.43792 
1 1 1 1   14 16 o 422.2870 6.307586 2175.247       64.90930 2163.240       91.68386 2187.313       91.90777 420.8820 8.939155 423.2203 8.911476 -2.338287      12.62232 
1 1 1 1   14 17 o 131.7228 3.287202 211.4879       10.55172 204.2917       13.47531 222.8939       16.96500 129.3754 4.280055 135.0939 5.162761 -5.718521      6.706189 
1 1 1 1   14 18 o 296.9329 4.686398 1075.269       33.91045 1060.135       47.81127 1090.589       48.10331 294.6998 6.657550 298.9070 6.603934 -4.207275      9.377362 
1 1 1 1   14 19 o 202.0620 3.576074 497.8077       17.60870 502.2503       25.24552 493.5986       24.57302 202.8279 5.111717 201.1420 5.013252 1.685837       7.159773 
1 1 1 1   14 20 o 420.3764 6.301773 2158.609       64.55609 2162.857       91.55592 2154.408       91.03847 420.2564 8.939969 419.4426 8.906690 0.8138123      12.61952 
1 1 1 1   14 21 o 94.25885 2.809773 108.4181       6.446802 116.6438       9.437075 101.2204       8.827711 97.70226 3.971943 91.00115 3.990454 6.701111       5.630280 
1 1 1 1   14 22 o 88.75053 2.782325 96.13763       6.010049 90.71867       8.477463 101.6133       8.521697 86.12501 4.050597 91.17657 3.843990 -5.051567      5.584227 
1 1 1 1   14 23 f 122.3892 2.910104 182.6870       8.679358 189.9750       12.52855 175.9616       12.03524 124.6782 4.129272 119.9872 4.122203 4.691063       5.834677 
1 1 1 1   14 24 o 99.15527 3.921881 120.2199       9.457773 108.6736       11.50340 144.3068       16.61475 94.15330 5.031936 108.3668 6.319020 -14.21350      8.077771 
1 1 1 1   14 25 o 96.28618 3.511502 113.3139       8.225550 123.0813       9.776210 89.63971       15.22018 100.3101 4.007420 85.11995 7.411388 15.19012       8.425443 
1 1 1 1   14 26 o 238.1879 4.051859 693.1281       23.51853 678.4029       32.91792 708.4819       33.61343 235.3262 5.740187 240.4876 5.735668 -5.161377      8.114655 
1 1 1 1   14 27 o 110.8041 2.948735 149.9437       7.955027 145.3679       10.98230 154.9947       11.53852 108.9749 4.143071 112.5214 4.215483 -3.546532      5.910612 
1 1 1 1   14 28 o 100.0452 2.933530 122.2811       7.144199 123.9190       9.966769 120.5501       10.24586 100.5896 4.074413 99.18827 4.248730 1.401299       5.886641 
1 1 1 1   14 29 o 51.53201 3.813705 32.64347       4.755231 34.49444       5.926313 29.29751       7.967930 52.87177 4.646874 48.27931 6.974397 4.592457       8.380671 
1 1 1 1   14 30 o 72.28832 3.955485 64.12450       6.941381 58.48297       13.49106 66.15568       8.095093 68.18858 8.288979 73.34485 4.551572 -5.156265      9.456425 
1 1 1 1   14 31 o 80.65426 3.078151 79.59855       6.038867 76.44051       8.290529 83.16798       8.813981 78.87038 4.330137 82.26469 4.412806 -3.394310      6.182470 
1 1 1 1   14 32 o 104.4773 3.069337 133.5393       7.806058 124.8113       10.50060 144.3209       11.67076 100.8069 4.284290 108.3841 4.428052 -7.577217      6.161395 
1 1 1 1   14 33 o 86.14299 3.105536 90.87840       6.508506 91.42407       8.928033 90.25951       9.508171 86.20860 4.263029 85.59465 4.575041 0.6139526      6.253352 
1 1 1 1   14 34 o 84.64522 3.128147 87.80614       6.441367 82.04058       8.555175 95.35255       9.787653 81.59940 4.317719 87.92782 4.583723 -6.328415      6.297080 
1 1 1 1   14 35 o 57.73804 3.534064 41.05222       4.948652 39.43220       6.535279 43.22957       7.576496 56.32895 4.806868 58.86738 5.339526 -2.538429      7.184463 
1 1 1 1   14 36 o 30.59816 5.291173 11.94203       3.802624 9.317766       4.849249 16.13259       6.127836 26.72074 7.259861 35.11848 7.394496 -8.397747      10.36263 
1 1 1 1   14 37 o 30.33605 6.245660 11.99185       4.463230 15.03169       5.084550 1.784069       9.317360 34.01725 6.367603 22.85724 9.678665 11.16001       11.58546 
1 1 1 1   14 38 f 24.34538 6.139848 7.821157       3.641434 8.846627       4.541430 5.974772       6.093857 25.77546 7.035050 22.88577 8.374691 2.889685       10.93743 
1 1 1 1   14 39 o 42.49828 4.583895 22.94263       4.672242 23.26134       5.504971 22.12170       8.835155 42.44968 5.447001 39.40950 9.342862 3.040180       10.81475 
1 1 1 1   14 40 o 32.64431 6.569677 14.49223       5.045086 14.49223       5.045086 0.000000       0.000000 32.64431 6.569677 ?        ?        0.000000       6.569677 
1 1 1 1   14 41 o 41.97844 5.519420 23.46622       5.509539 14.05142       9.160485 28.80209       6.896292 29.70104 10.33286 45.99083 6.320274 -16.28979      12.11255 
1 1 1 1   14 42 o 44.59500 4.370525 26.01524       4.688662 29.88897       5.943066 19.62988       7.630252 47.12531 5.264974 35.02306 8.917867 12.10225       10.35608 
1 1 1 1   14 43 o 12.94865 5.690845 0.1272320      3.464878 1.004867       4.272300 -1.559348      5.922542 14.81013 6.416894 15.05405 6.942942 -0.2439184     9.454151 
1 1 1 1   14 44 o 20.57306 6.568568 6.647412       3.715471 7.368058       4.677672 5.415557       6.115732 21.13615 7.381776 19.22834 7.970097 1.907812       10.86338 
1 1 1 1   14 45 o 10.06128 4.892955 -4.751377      3.815309 -5.064048      5.615595 -4.483304      5.199697 12.39577 6.006718 12.13213 5.854818 0.2636366      8.388061 
1 1 1 1   14 46 o 12.95494 5.771995 0.8115327      3.684914 0.5823990      5.047241 1.073074       5.392374 14.06649 6.458974 14.61522 6.698015 -0.5487261     9.304932 
1 1 1 1   14 47 o 35.57947 5.979049 21.07980       5.000353 23.52084       6.252143 16.74672       8.329893 34.80771 7.585628 23.00314 9.393037 11.80457       12.07356 
1 1 1 1   14 48 o 11.41388 5.364073 -0.6234038     3.808199 2.247636       5.491097 -3.283947      5.285971 14.17303 6.588156 11.61523 5.673028 2.557800       8.694081 
1 1 1 1   15 0  o 268.6504 4.995026 879.7507       32.70102 988.4149       60.42126 834.7355       38.88890 284.5056 8.725221 261.6606 6.098898 22.84509       10.64547 
1 1 1 1   15 1  o 707.3198 11.77984 6109.801       203.0446 6146.012       249.6203 6038.991       349.0625 709.0061 14.44754 701.3134 20.44650 7.692688       25.03579 
1 1 1 1   15 2  o 230.2055 4.463391 645.9199       25.03899 642.7311       30.43195 652.6030       44.05551 229.6185 5.438596 231.1832 7.831327 -1.564667      9.534569 
1 1 1 1   15 3  o 477.0227 9.945414 2777.001       115.6107 2754.872       162.0248 2799.955       165.0126 474.5397 14.02651 478.3904 14.17025 -3.850677      19.93838 
1 1 1 1   15 4  o 488.0797 6.420027 2904.501       76.35960 2806.671       117.9690 2975.046       100.1769 479.5587 10.09462 493.8614 8.323891 -14.30270      13.08390 
1 1 1 1   15 5  o 341.4268 5.216700 1420.976       43.40399 1422.750       86.11469 1420.372       50.25419 341.2685 10.36690 341.3294 6.041746 -0.6088257E-01 11.99897 
1 1 1 1   15 6  o 366.6746 4.965214 1638.840       44.36647 1581.540       68.60043 1680.040       58.16931 360.1039 7.817411 371.2061 6.430471 -11.10217      10.12239 
1 1 1 1   15 7  o 433.6869 5.760908 2292.918       60.88402 2352.177       97.94174 2255.596       77.72689 439.0782 9.153557 430.0680 7.416483 9.010162       11.78099 
1 1 1 1   15 8  o 608.2609 8.826929 4513.786       130.8385 4392.929       257.7714 4555.729       151.8541 598.6536 17.68885 610.9496 10.19964 -12.29596      20.41882 
1 1 1 1   15 9  o 516.6499 7.556627 3255.529       95.13940 3211.514       188.4488 3270.584       110.2166 512.1780 15.11513 517.7585 8.735418 -5.580505      17.45779 
1 1 1 1   15 10 o 450.3865 6.681304 2473.573       73.33018 2511.537       104.9573 2437.370       102.4955 453.6445 9.494259 446.9024 9.411442 6.742065       13.36848 
1 1 1 1   15 11 o 193.7033 3.488539 457.2785       16.46708 472.2055       23.94375 443.8818       22.68327 196.7520 4.997913 190.7611 4.883566 5.990921       6.987729 
1 1 1 1   15 12 o 113.3606 3.312327 156.7464       9.140402 166.2487       17.58484 153.2287       10.69935 116.5981 6.211273 112.0554 3.924275 4.542694       7.347098 
1 1 1 1   15 13 o 215.4672 3.709916 565.8511       19.47966 593.4962       41.69854 558.1339       22.03143 220.4160 7.775393 213.9830 4.225006 6.433029       8.849148 
1 1 1 1   15 14 o 227.4814 4.471767 630.8344       24.78913 692.5342       46.74218 606.6901       29.23981 238.0763 8.068350 223.0607 5.379171 15.01552       9.697100 
1 1 1 1   15 15 o 390.2995 6.777067 1858.545       64.45786 1861.137       79.70773 1853.646       109.5752 390.4362 8.377498 389.1260 11.56827 1.310120       14.28311 
1 1 1 1   15 16 f 126.3517 3.250502 194.7199       10.00016 208.7787       13.42226 177.1796       14.99237 130.7930 4.216702 120.4261 5.120423 10.36691       6.633197 
1 1 1 1   15 17 o 222.0279 3.806303 601.0076       20.59430 654.5650       30.82424 557.8238       27.67852 231.6366 5.460710 213.8423 5.311450 17.79430       7.617798 
1 1 1 1   15 18 o 274.6573 4.430841 920.0684       29.65606 939.3516       42.67327 902.0558       41.24329 277.3787 6.313159 271.8239 6.226293 5.554810       8.866945 
1 1 1 1   15 19 o 179.4678 3.357010 392.7183       14.68167 401.8385       21.31973 384.4922       20.24775 181.4086 4.826960 177.4582 4.686244 3.950424       6.727587 
1 1 1 1   15 20 o 173.8150 3.893823 368.5312       16.49300 376.6347       30.78702 365.2696       19.53221 175.3260 7.221306 172.9411 4.638840 2.384918       8.582896 
1 1 1 1   15 21 o 88.04255 2.790528 94.60953       5.979520 89.31389       8.489208 99.82388       8.423808 85.45383 4.088473 90.37212 3.833767 -4.918289      5.604764 
1 1 1 1   15 22 o 156.4821 3.162010 298.6798       12.05769 296.9140       17.18896 300.3904       16.91855 155.8647 4.530298 156.7855 4.432587 -0.9207764     6.338093 
1 1 1 1   15 23 o 45.67274 3.541477 25.60863       3.910869 24.89464       6.135021 26.09737       5.075899 44.74531 5.759880 45.99340 4.590013 -1.248089      7.365082 
1 1 1 1   15 24 o 209.9391 4.398989 538.4686       22.50517 535.7039       27.14030 544.5539       40.26488 209.2015 5.328039 210.3589 7.868568 -1.157394      9.502756 
1 1 1 1   15 25 o 137.4238 3.071031 230.4453       10.28448 232.5242       14.62505 228.4116       14.46516 137.8714 4.358458 136.6467 4.349524 1.224792       6.157476 
1 1 1 1   15 26 o 223.4605 3.892691 610.0663       21.19760 619.3937       30.27715 601.0988       29.68743 224.8556 5.525545 221.5156 5.499614 3.340027       7.795986 
1 1 1 1   15 27 o 181.9845 3.474631 404.5003       15.40917 396.9258       21.57792 412.3828       22.01228 179.9886 4.924213 183.4614 4.928080 -3.472778      6.966624 
1 1 1 1   15 28 o 172.7761 3.846013 364.9325       16.19312 354.2184       19.90720 385.8860       27.83937 169.9954 4.810318 177.0189 6.464481 -7.023468      8.057834 
1 1 1 1   15 29 o 136.8308 3.132449 228.6896       10.44490 225.4667       14.51095 232.1546       15.04621 135.6311 4.396173 137.6122 4.492796 -1.981079      6.285821 
1 1 1 1   15 30 o 38.11985 5.878133 18.28144       5.285110 12.28401       11.21373 19.99408       5.992398 32.74752 11.42985 39.79853 6.395310 -7.051014      13.09739 
1 1 1 1   15 31 o 154.9831 3.311132 293.6873       12.50539 287.5755       17.42961 300.1715       17.95255 153.0275 4.679429 156.3359 4.717681 -3.308456      6.644815 
1 1 1 1   15 32 o 38.62820 4.427320 18.54502       4.092334 19.18374       5.584938 17.80448       6.013684 38.97313 6.078828 37.34663 6.860480 1.626499       9.166151 
1 1 1 1   15 33 o 116.3410 3.128624 165.7150       8.861919 165.5767       12.24706 165.8669       12.83919 116.0359 4.338795 116.0852 4.547425 -0.4936981E-01 6.285238 
1 1 1 1   15 34 o 21.89348 6.468406 6.061230       3.690187 6.518372       4.850383 5.432983       5.686112 23.12439 7.516171 22.48282 8.109567 0.6415691      11.05703 
1 1 1 1   15 35 o 18.57398 6.646876 3.726963       3.811417 9.750334       5.387375 -2.308864      5.392943 27.39952 7.732998 15.37845 6.907453 12.02107       10.36881 
1 1 1 1   15 36 o 126.4680 3.202298 196.5527       9.861181 195.6167       13.51416 197.6185       14.42166 125.6842 4.419250 126.1949 4.697819 -0.5106812     6.449750 
1 1 1 1   15 37 f 39.92651 5.141206 20.23923       4.886239 19.98407       5.485938 21.21862       10.74791 39.42932 5.889733 38.79632 10.91304 0.6330032      12.40094 
1 1 1 1   15 38 o 29.42464 5.630972 11.30916       3.890631 10.63196       4.903631 12.45983       6.391949 28.09664 7.146334 30.12189 8.395349 -2.025251      11.02506 
1 1 1 1   15 39 o 55.75991 4.947664 39.73610       6.653208 39.73610       6.653208 0.000000       0.000000 55.75991 4.947664 ?        ?        0.000000       4.947664 
1 1 1 1   15 40 o 34.63105 5.425318 15.86447       4.428306 14.71731       5.174391 19.00440       8.560637 32.67502 6.722812 35.28682 9.670109 -2.611801      11.77740 
1 1 1 1   15 41 o 19.66009 6.651262 5.216928       3.788438 5.808286       4.803617 4.243887       6.161818 20.80383 7.460028 20.05561 8.119596 0.7482166      11.02633 
1 1 1 1   15 42 o 21.71860 6.567180 6.884559       3.770190 9.023726       4.667035 2.866147       6.396553 24.40171 7.290524 18.60461 7.953357 5.797096       10.78924 
1 1 1 1   15 43 o 30.03765 5.707289 13.00158       4.024956 13.96243       5.198111 11.56295       6.360500 29.76027 7.238145 25.63712 8.618202 4.123152       11.25452 
1 1 1 1   15 44 o 24.57885 6.788490 9.775009       4.200196 15.72373       6.338510 5.118033       5.608251 29.35088 8.422611 18.62496 7.667526 10.72592       11.38997 
1 1 1 1   15 45 o 18.41403 6.631317 5.595379       3.800248 8.560596       5.320995 2.508147       5.429369 21.25566 7.817780 15.95156 7.062225 5.304105       10.53531 
1 1 1 1   15 46 o 21.10650 6.765920 8.131782       3.939106 9.627236       5.550044 6.613812       5.591664 21.14902 7.944549 18.31893 7.609477 2.830090       11.00091 
1 1 1 1   15 47 o 13.71531 6.223132 1.730447       4.508327 -2.429030      5.387710 11.44516       8.233789 12.25581 5.925570 19.32892 8.618917 -7.073111      10.45936 
1 1 1 1   15 48 o 13.13307 5.956993 1.787771       4.126833 3.643101       5.237009 -1.251780      6.703125 14.74062 6.695794 13.13716 6.410264 1.603461       9.269582 
1 1 1 1   16 0  o 572.9365 8.355281 4003.969       116.6551 3848.257       160.5866 4177.948       169.7444 561.3889 11.73841 584.9244 11.90857 -23.53552      16.72138 
1 1 1 1   16 1  o 204.5215 4.144224 509.8008       20.65468 560.3139       37.09932 487.1107       24.86458 214.2410 7.115907 199.8392 5.109998 14.40179       8.760606 
1 1 1 1   16 2  f 279.7936 6.315770 954.4474       43.06259 1016.367       62.62831 898.9215       59.30675 288.5002 8.918880 271.2986 8.982966 17.20166       12.65860 
1 1 1 1   16 3  o 151.2829 3.076855 278.9011       11.34313 267.1040       15.63306 292.0173       16.48396 147.9744 4.340012 154.7258 4.376223 -6.751358      6.163362 
1 1 1 1   16 4  o 389.3212 5.868505 1847.819       55.67646 1959.958       81.68208 1750.504       76.09165 400.8479 8.362018 378.8303 8.242448 22.01764       11.74144 
1 1 1 1   16 5  o 436.6934 6.491871 2325.171       69.08481 2362.186       98.65585 2289.556       96.77272 440.0045 9.200886 433.1895 9.167247 6.814972       12.98825 
1 1 1 1   16 6  o 96.04720 3.403565 112.5650       7.953674 122.3213       14.61071 108.4562       9.481714 99.98444 6.024518 94.24202 4.138725 5.742424       7.309163 
1 1 1 1   16 7  o 610.8903 10.23017 4555.223       152.2938 4403.965       256.7417 4637.338       189.1683 599.3599 17.59718 616.0872 12.59999 -16.72736      21.64302 
1 1 1 1   16 8  o 459.3975 9.625727 2575.727       107.7602 0.000000       0.000000 2575.727       107.7602 ?        ?        459.3975 9.625727 0.000000       9.625727 
1 1 1 1   16 9  o 449.5836 7.723063 2465.539       84.61282 2421.491       145.7459 2487.932       103.9183 444.8427 13.46027 451.4958 9.445004 -6.653076      16.44345 
1 1 1 1   16 10 o 366.7495 7.925943 1640.909       70.83641 1669.204       102.1253 1614.674       98.33765 369.4836 11.35581 363.4191 11.11698 6.064484       15.89156 
1 1 1 1   16 11 o 238.1797 3.981495 691.4524       23.10931 707.1334       48.35514 686.8107       26.30812 240.5901 8.259875 237.3667 4.548141 3.223358       9.429270 
1 1 1 1   16 12 o 433.4023 6.463330 2290.930       68.26273 2306.374       138.3688 2285.963       78.47761 434.0091 13.09786 432.8636 7.439754 1.145477       15.06333 
1 1 1 1   16 13 o 118.8972 2.856308 172.2825       8.275852 180.8130       18.88058 170.2538       9.207504 121.5860 6.394777 118.1485 3.200942 3.437424       7.151167 
1 1 1 1   16 14 o 495.3257 7.283762 2994.129       87.91900 2988.627       125.1988 2999.482       123.4913 494.4686 10.39023 495.3900 10.22946 -0.9214478     14.58077 
1 1 1 1   16 15 o 124.4908 3.413499 189.0525       10.34577 188.4550       19.37807 189.2907       12.23550 124.1107 6.429070 124.5406 4.036909 -0.4298325     7.591414 
1 1 1 1   16 16 o 249.3904 4.130552 758.3615       25.10290 758.1262       35.85864 758.5875       35.15357 249.2587 5.903471 249.3417 5.785467 -0.8302307E-01 8.265749 
1 1 1 1   16 17 o 258.9525 4.242910 817.7959       26.77442 772.3573       36.92978 868.1461       38.87452 251.5385 6.024712 266.6842 5.981795 -15.14578      8.489936 
1 1 1 1   16 18 o 192.7122 3.963646 452.9426       18.61402 442.2461       31.56774 458.6440       23.04695 190.1219 6.824649 193.8117 4.883638 -3.689804      8.392005 
1 1 1 1   16 19 f 216.0567 3.764763 569.3720       19.82172 552.4859       27.82549 586.7692       28.24348 212.6459 5.374002 219.2212 5.286881 -6.575317      7.538635 
1 1 1 1   16 20 o 172.3427 3.296759 362.2535       13.84574 381.8530       20.40516 345.5295       18.84897 176.7890 4.740681 168.1775 4.603542 8.611511       6.608075 
1 1 1 1   16 21 o 203.9552 3.642208 507.5543       18.10238 536.1577       26.58420 482.8243       24.71873 209.4708 5.207915 198.7253 5.108545 10.74553       7.295177 
1 1 1 1   16 22 o 50.66542 3.401783 31.46157       4.175708 31.38893       6.694957 31.50781       5.342129 50.36123 5.547020 50.60586 4.374810 -0.2446251     7.064588 
1 1 1 1   16 23 o 218.8956 3.844957 584.9859       20.50995 615.8214       30.07528 558.1784       28.04223 224.3571 5.500900 213.5486 5.392962 10.80852       7.703502 
1 1 1 1   16 24 o 108.7939 3.518466 144.6348       9.315848 146.9912       11.00534 138.6783       17.49740 109.6183 4.127249 106.1031 6.803052 3.515213       7.957117 
1 1 1 1   16 25 f 124.6023 2.994546 189.4624       9.092704 193.9681       13.07101 185.2377       12.65703 125.9044 4.266384 123.0398 4.227615 2.864601       6.006227 
1 1 1 1   16 26 f 79.60901 2.968084 77.45688       5.747956 77.42571       8.128791 77.48804       8.128883 79.46999 4.212509 79.50226 4.210822 -0.3227234E-01 5.956194 
1 1 1 1   16 27 o 126.7863 3.391697 196.4848       10.46972 200.9965       13.34041 189.2495       16.89391 128.1153 4.278996 124.0869 5.601302 4.028397       7.048716 
1 1 1 1   16 28 o 87.14249 3.010628 92.83684       6.383670 91.18159       8.819388 94.65841       9.251877 86.22292 4.210121 87.83804 4.335660 -1.615120      6.043432 
1 1 1 1   16 29 o 93.19775 3.006924 106.1977       6.820170 102.1921       9.560653 110.3481       9.731983 91.25398 4.311511 94.84695 4.221155 -3.592972      6.033844 
1 1 1 1   16 30 o 132.1234 3.801944 213.7953       12.22841 219.4723       23.16867 211.6032       14.39705 133.0036 7.174838 131.3076 4.506002 1.696014       8.472446 
1 1 1 1   16 31 o 28.60185 5.645202 10.41914       3.794931 9.803527       5.130405 11.16294       5.639303 27.63769 7.449713 29.43864 7.754483 -1.800951      10.75315 
1 1 1 1   16 32 o 72.71941 3.242950 64.82688       5.732351 62.99803       7.865027 66.89924       8.372264 71.47493 4.538996 73.63407 4.690200 -2.159142      6.526903 
1 1 1 1   16 33 o 42.24641 4.244829 22.13930       4.310887 19.46800       5.755538 25.55293       6.506289 39.16908 6.238944 45.03166 6.084504 -5.862579      8.714679 
1 1 1 1   16 34 o 46.82530 4.314804 27.21269       4.868212 23.23544       6.861763 31.24354       6.907850 42.62794 6.836507 49.86012 5.793025 -7.232185      8.960857 
1 1 1 1   16 35 o 58.55912 3.528970 42.28916       5.012549 42.57613       6.782951 41.94389       7.440176 58.46280 4.803378 57.87731 5.335204 0.5854874      7.178916 
1 1 1 1   16 36 o 17.16574 6.301262 3.049434       3.454142 0.8608441      4.345608 6.804862       5.692434 16.00123 6.682327 23.73014 8.150570 -7.728918      10.53970 
1 1 1 1   16 37 o 59.97682 4.072076 44.85127       5.916332 46.96694       6.924326 39.12982       11.38695 61.16096 4.681452 53.69827 9.021409 7.462688       10.16375 
1 1 1 1   16 38 o 91.50626 4.418363 105.1817       9.823426 105.1817       9.823426 0.000000       0.000000 91.50626 4.418363 ?        ?        0.000000       4.418363 
1 1 1 1   16 39 o 38.40037 4.616108 18.93267       4.233130 16.66968       5.464750 22.32778       6.693532 35.08168 6.635245 40.49699 7.037905 -5.415314      9.672568 
1 1 1 1   16 40 o 70.99297 3.400017 63.31864       5.865004 57.26763       7.567112 72.42266       9.281810 66.60691 4.692049 74.52499 5.142396 -7.918083      6.961290 
1 1 1 1   16 41 o 17.04205 6.732444 3.050470       4.131729 -0.6099112E-01 4.788043 12.12372       8.176308 15.03647 6.645741 27.22786 9.736345 -12.19139      11.78823 
1 1 1 1   16 42 o 16.61071 6.435690 3.299760       3.715110 0.5530662      4.698297 7.882720       6.068877 15.04291 6.618476 22.43639 8.331621 -7.393482      10.64050 
1 1 1 1   16 43 o 18.19740 6.557544 4.888134       3.716876 7.579780       5.048398 1.702027       5.492559 21.42723 7.651878 16.22625 7.146959 5.200979       10.47045 
1 1 1 1   16 44 o 15.72478 6.276708 3.212301       3.626948 7.720101       5.023480 -1.696310      5.242055 20.96605 7.614101 13.55671 6.346250 7.409337       9.912085 
1 1 1 1   16 45 o 11.17304 5.225765 -1.534303      3.541338 0.5171868      4.821545 -3.937382      5.218378 13.97484 6.377627 12.13318 5.857797 1.841663       8.659556 
1 1 1 1   16 46 o 18.55834 6.737551 6.464519       3.933006 10.60995       5.430961 1.893004       5.703243 21.89640 7.921831 14.82717 6.829252 7.069222       10.45916 
1 1 1 1   16 47 o 26.51923 8.435072 17.02146       6.131701 17.02146       6.131701 0.000000       0.000000 26.51923 8.435072 ?        ?        0.000000       8.435072 
1 1 1 1   17 0  o 139.0025 3.025654 235.4597       10.24892 261.1558       14.95119 212.6818       14.07664 146.3207 4.197425 132.0247 4.381368 14.29599       6.067517 
1 1 1 1   17 1  o 155.0004 3.137265 292.7806       11.85005 294.4089       16.68591 291.1236       16.83206 155.3560 4.411901 154.4835 4.475866 0.8725128      6.284763 
1 1 1 1   17 2  o 241.2853 4.023602 709.5524       23.65821 775.8323       35.02269 653.9237       32.08546 252.2690 5.697043 231.6029 5.684969 20.66609       8.048303 
1 1 1 1   17 3  o 234.5972 3.947491 670.7581       22.56733 664.6636       31.60948 677.0939       32.22960 233.4990 5.555155 235.6711 5.611935 -2.172028      7.896427 
1 1 1 1   17 4  o 493.7472 6.505695 2972.564       78.27705 3075.613       126.8433 2909.181       99.47874 501.9517 10.36978 488.3394 8.359348 13.61234       13.31957 
1 1 1 1   17 5  o 280.0961 4.466597 956.2529       30.48736 976.6615       60.94012 949.4396       35.21044 282.7857 8.854116 279.0796 5.177347 3.706085       10.25672 
1 1 1 1   17 6  o 634.3890 9.184916 4911.160       141.9930 4809.924       279.1870 4946.483       164.9152 626.1258 18.31743 636.5004 10.63227 -10.37463      21.17955 
1 1 1 1   17 7  o 307.0769 4.303459 1149.351       32.20334 1129.047       50.31654 1163.438       41.91164 304.2733 6.785953 308.9165 5.567465 -4.643219      8.777575 
1 1 1 1   17 8  o 378.8294 6.660347 1750.148       61.48607 1779.051       108.1452 1736.343       74.74165 381.4240 11.64856 377.2513 8.130100 4.172791       14.20519 
1 1 1 1   17 9  f 641.2460 9.297956 5019.327       145.2942 5240.821       300.2813 4951.619       166.0229 653.1220 18.88662 636.7186 10.70002 16.40344       21.70702 
1 1 1 1   17 10 o 146.4917 3.059353 261.5318       10.92141 254.8901       16.14860 267.1303       14.82639 144.5276 4.590912 147.9815 4.115417 -3.453873      6.165479 
1 1 1 1   17 11 o 251.5869 4.160017 771.5577       25.50464 801.3840       53.35112 762.7222       29.03761 256.0838 8.561235 250.1255 4.763946 5.958252       9.797445 
1 1 1 1   17 12 o 252.4037 3.722668 776.5400       22.89740 780.0910       36.76645 774.2900       29.26571 252.9044 5.965670 252.0070 4.765520 0.8973083      7.635404 
1 1 1 1   17 13 o 215.4651 5.311250 566.1693       27.88751 562.5764       40.66772 569.3585       38.31513 214.5299 7.791982 215.8636 7.294225 -1.333679      10.67336 
1 1 1 1   17 14 o 292.0275 4.148371 1039.752       29.52143 962.2214       45.09865 1097.882       39.05064 280.7930 6.590846 300.0172 5.341288 -19.22412      8.483431 
1 1 1 1   17 15 o 502.7178 6.620202 3085.249       81.10201 3237.572       132.9274 2994.922       102.3618 514.2042 10.60822 494.9983 8.485908 19.20584       13.58474 
1 1 1 1   17 16 o 198.6941 3.583499 481.3590       17.35115 474.0489       24.77340 488.3981       24.30965 197.0407 5.163783 200.0784 4.985886 -3.037735      7.178002 
1 1 1 1   17 17 f 135.0101 3.020051 222.2215       9.936114 214.2226       14.37098 229.5472       13.75296 132.4387 4.459181 137.1221 4.120460 -4.683365      6.071449 
1 1 1 1   17 18 o 157.5046 3.185832 302.4965       12.22791 282.7044       17.21953 322.6295       17.36717 152.1291 4.650322 162.5476 4.388436 -10.41849      6.394049 
1 1 1 1   17 19 o 117.4808 3.245628 168.4520       9.282935 164.1947       12.11239 174.5121       14.45122 115.9110 4.295571 119.4426 4.975782 -3.531563      6.573457 
1 1 1 1   17 20 o 162.9281 3.218240 323.7916       12.77763 315.7331       18.24302 331.5521       17.90240 160.7257 4.662669 164.7271 4.463862 -4.001389      6.454963 
1 1 1 1   17 21 o 85.41817 3.451024 89.17133       7.168681 98.28680       11.06767 82.58311       9.409153 89.53283 5.093698 82.08363 4.723849 7.449203       6.946978 
1 1 1 1   17 22 o 99.81764 2.858272 121.6308       6.945435 125.4425       10.24105 118.3845       9.451097 101.2653 4.158844 98.38985 3.949839 2.875488       5.735610 
1 1 1 1   17 23 f 149.3213 3.777096 272.4151       13.73305 275.9504       16.50094 264.4478       24.77159 150.2007 4.513292 146.6428 6.951768 3.557907       8.288359 
1 1 1 1   17 24 o 113.5850 2.931176 157.5260       8.106549 154.9863       11.56529 159.9790       11.36609 112.5386 4.224650 114.3552 4.085238 -1.816658      5.876805 
1 1 1 1   17 25 o 38.10403 3.959400 17.93162       3.622973 11.56256       5.131156 24.26359       5.116193 30.06966 7.114286 44.27162 4.819992 -14.20195      8.593334 
1 1 1 1   17 26 o 72.35164 3.039057 64.01666       5.346322 61.71489       7.486733 66.41189       7.637192 70.89816 4.354331 73.56561 4.278594 -2.667458      6.104635 
1 1 1 1   17 27 o 238.4762 4.660770 696.4073       27.08562 694.5870       33.69711 699.7303       45.52939 237.8353 5.814068 237.8284 7.866653 0.6912231E-02  9.782005 
1 1 1 1   17 28 o 103.2144 2.976446 130.2060       7.478604 136.1752       10.71429 124.5346       10.44359 105.3995 4.179753 100.7744 4.262315 4.625175       5.969729 
1 1 1 1   17 29 o 65.13116 4.095244 52.13537       6.466969 60.37910       13.50969 49.68484       7.365708 69.29373 8.156520 63.47248 4.797560 5.821247       9.462843 
1 1 1 1   17 30 o 167.9981 4.052286 345.7060       16.58978 343.3361       30.62023 346.6907       19.73768 166.1683 7.581757 167.9846 4.826597 -1.816223      8.987718 
1 1 1 1   17 31 o 80.49490 3.179601 79.36734       6.224751 80.17139       8.722917 78.53302       8.885592 80.69883 4.452923 79.84258 4.586133 0.8562469      6.392272 
1 1 1 1   17 32 o 104.2051 3.111100 132.9660       7.891374 137.7062       11.15964 128.2251       11.16053 105.8029 4.337490 102.0523 4.498777 3.750587       6.249225 
1 1 1 1   17 33 o 42.61335 4.553778 22.60556       4.655617 14.50305       6.688713 30.21999       6.484126 33.28548 8.280184 49.12918 5.510846 -15.84370      9.946400 
1 1 1 1   17 34 o 22.80466 6.461693 6.674809       3.754026 5.316555       4.991846 8.442942       5.695452 21.67541 7.621496 25.84790 8.117764 -4.172491      11.13487 
1 1 1 1   17 35 o 34.08027 4.936380 14.70055       3.980425 13.13398       5.211518 16.89391       6.166583 31.66688 6.944989 35.90889 7.296168 -4.242008      10.07308 
1 1 1 1   17 36 o 44.75846 4.144279 25.03282       4.468903 19.87880       5.910245 31.91330       6.828763 39.13876 6.419056 50.07350 5.697472 -10.93475      8.582859 
1 1 1 1   17 37 o 18.03931 7.128828 2.693206       4.634005 2.693206       4.634005 0.000000       0.000000 18.03931 7.128828 ?        ?        0.000000       7.128828 
1 1 1 1   17 38 o 77.82867 3.280767 75.27159       6.208345 74.53195       8.497124 76.11860       9.092984 76.75167 4.563660 77.38587 4.846122 -0.6342010     6.656717 
1 1 1 1   17 39 o 9.982943 4.783255 -4.283893      3.329674 -5.493869      4.103236 -1.950831      5.697721 10.90976 5.248754 15.45142 7.004979 -4.541659      8.753237 
1 1 1 1   17 40 o 41.78623 4.357210 22.62100       4.371772 22.13917       5.658637 23.33443       6.885627 40.35949 5.930183 40.47554 7.247089 -0.1160507     9.364154 
1 1 1 1   17 41 o 26.23640 7.775282 10.63071       5.325304 16.32001       9.323056 7.875571       6.487842 29.99750 10.42484 22.92263 8.594018 7.074875       13.51053 
1 1 1 1   17 42 o 27.64188 6.811882 11.70480       4.558448 13.86608       5.490812 6.911605       8.176998 29.40378 7.606089 21.56051 9.095175 7.843275       11.85642 
1 1 1 1   17 43 o 33.54193 5.679811 16.48939       4.477053 20.74583       7.466150 14.09955       5.594464 33.41817 8.977852 28.68556 7.799470 4.732609       11.89258 
1 1 1 1   17 44 o 11.67054 5.355381 -0.8530883     3.462240 -1.321726      4.877323 -0.3770666     4.915595 13.21040 6.163555 13.79107 6.347726 -0.5806704     8.847770 
1 1 1 1   17 45 o 13.87256 6.075344 1.708661       3.917509 10.79652       5.547893 -7.328929      5.532528 22.67695 8.029378 11.17001 5.523150 11.50694       9.745568 
1 1 1 1   17 46 o 27.24728 6.524713 13.26087       4.274997 15.32342       6.010246 11.14883       6.081910 25.67140 8.368313 21.18613 8.227184 4.485270       11.73521 
1 1 1 1   17 47 o 27.95265 7.412328 16.20186       5.130725 13.46053       6.092501 22.88727       9.514338 22.31009 8.335476 23.63155 9.879603 -1.321457      12.92620 
1 1 1 1   18 0  o 377.4533 5.739663 1736.970       52.79414 1890.493       78.63526 1610.980       71.23627 393.6584 8.197128 363.4016 8.044114 30.25677       11.48480 
1 1 1 1   18 1  o 422.5285 6.330511 2176.886       65.18247 2178.656       92.02541 2175.103       92.33928 422.5468 8.937104 422.1996 8.974962 0.3472595      12.66577 
1 1 1 1   18 2  o 212.8413 4.291901 552.1605       22.26084 479.8618       35.32446 599.7859       28.67013 198.2188 7.325586 221.8106 5.304093 -23.59187      9.044204 
1 1 1 1   18 3  o 339.2697 6.046921 1403.441       49.99373 1422.684       86.55984 1393.808       61.24083 341.1994 10.42273 338.0443 7.434152 3.155151       12.80234 
1 1 1 1   18 4  o 404.9825 7.042367 2000.279       69.50099 0.000000       0.000000 2000.279       69.50099 ?        ?        404.9825 7.042367 0.000000       7.042367 
1 1 1 1   18 5  o 379.7931 5.774051 1758.675       53.43967 1944.676       114.5588 1706.943       60.41585 398.7831 11.80141 374.1265 6.626685 24.65652       13.53463 
1 1 1 1   18 6  o 731.4444 9.427148 6530.732       168.0342 6649.802       269.0375 6454.576       215.1624 737.0579 14.97874 726.7291 12.14948 10.32874       19.28659 
1 1 1 1   18 7  o 676.1005 8.740540 5578.867       144.0077 5519.634       226.0151 5619.348       186.8453 671.6732 13.80840 678.1724 11.30592 -6.499268      17.84645 
1 1 1 1   18 8  o 585.7199 7.625626 4185.691       108.8433 4252.817       173.9209 4142.476       139.5486 589.7996 12.10072 582.4306 9.832072 7.369019       15.59157 
1 1 1 1   18 9  o 158.9743 3.202594 308.0139       12.40694 329.2589       26.50479 302.0524       14.04017 164.1628 6.639116 157.4222 3.659910 6.740646       7.581082 
1 1 1 1   18 10 f 327.3264 5.928012 1306.715       47.28531 1469.780       88.75601 1242.090       55.87504 346.6379 10.51934 319.0584 7.186403 27.57953       12.73974 
1 1 1 1   18 11 o 145.0838 3.081594 256.5479       10.89508 245.6551       16.12249 265.7031       14.78073 141.8672 4.669886 147.5760 4.114035 -5.708786      6.223594 
1 1 1 1   18 12 o 223.4178 4.430371 608.6050       24.12092 593.5795       29.82783 636.9996       41.00381 220.5302 5.554734 228.3145 7.379474 -7.784332      9.236434 
1 1 1 1   18 13 o 345.1355 4.759768 1452.714       40.03239 1501.614       65.18362 1423.101       50.72586 350.6463 7.628394 341.5003 6.095400 9.146027       9.764543 
1 1 1 1   18 14 o 265.1801 5.066200 857.8559       32.73854 852.0743       57.35255 860.6503       39.87311 263.7987 8.934518 265.5346 6.162016 -1.735901      10.85339 
1 1 1 1   18 15 o 157.4554 2.856219 302.2159       10.95936 280.6198       17.53871 316.0500       14.03730 151.5906 4.753642 160.9982 3.577886 -9.407623      5.949654 
1 1 1 1   18 16 o 126.7455 2.623754 195.8236       8.103854 186.7508       13.37438 201.0870       10.18683 123.6432 4.446054 128.3807 3.258774 -4.737488      5.512442 
1 1 1 1   18 17 o 162.0306 3.235480 320.1461       12.77533 336.1041       18.94258 306.8315       17.30266 165.8807 4.690763 158.5040 4.484078 7.376724       6.489238 
1 1 1 1   18 18 o 134.3608 3.494128 220.3545       11.43086 267.8759       23.73676 206.0066       13.04284 147.8372 6.605411 129.8632 4.126687 17.97395       7.788517 
1 1 1 1   18 19 o 201.2751 3.628497 494.2902       17.79725 512.9750       26.12267 478.1047       24.31288 204.8255 5.237861 197.7615 5.049100 7.064026       7.275204 
1 1 1 1   18 20 o 179.3098 3.847425 392.4389       16.81165 408.0300       29.35683 384.8308       20.50729 182.4083 6.615281 177.4195 4.747461 4.988800       8.142502 
1 1 1 1   18 21 o 136.9207 3.035737 228.7000       10.12907 220.1917       14.53093 236.7419       14.12694 134.1840 4.449976 139.1711 4.170163 -4.987137      6.098569 
1 1 1 1   18 22 o 100.8544 3.606099 124.3253       8.848489 124.4381       10.42763 124.0351       16.72376 100.8385 4.253040 100.3225 6.882373 0.5159607      8.090452 
1 1 1 1   18 23 o 93.86481 3.584482 107.7310       8.184017 104.7248       9.570182 115.9125       15.78806 92.47649 4.258141 96.95412 6.723964 -4.477638      7.958860 
1 1 1 1   18 24 o 76.01723 2.930012 70.62254       5.417558 70.40732       7.982346 70.80633       7.376621 75.76445 4.341613 76.01781 3.996078 -0.2533569     5.900699 
1 1 1 1   18 25 o 40.58062 4.048490 20.32950       3.950205 19.45246       5.502360 21.26228       5.674480 39.39041 5.914742 41.23771 5.807344 -1.847298      8.289114 
1 1 1 1   18 26 o 74.66982 3.293212 68.23123       5.977661 64.63926       7.857400 73.16658       9.210238 72.53896 4.466659 77.12820 4.926035 -4.589233      6.649576 
1 1 1 1   18 27 o 64.97726 3.144589 51.68930       4.964437 47.60497       7.023654 55.76693       7.017898 62.16585 4.670488 67.36347 4.297512 -5.197624      6.346816 
1 1 1 1   18 28 o 116.1853 3.055772 165.0123       8.644325 155.4796       12.12249 174.8741       12.32999 112.5747 4.427546 119.4322 4.243224 -6.857529      6.132545 
1 1 1 1   18 29 o 154.4609 3.941995 292.2775       14.82571 290.0708       27.44025 293.1872       17.61865 152.8442 7.389099 154.5296 4.684103 -1.685379      8.748692 
1 1 1 1   18 30 o 9.470668 4.586372 -5.383768      3.260597 -4.493937      4.404565 -6.462633      4.849899 12.35226 5.793578 12.20070 5.826033 0.1515627      8.216337 
1 1 1 1   18 31 o 101.0038 3.066752 124.8857       7.539616 115.2453       10.35609 135.7585       10.99811 96.78082 4.402599 105.0794 4.304123 -8.298553      6.156976 
1 1 1 1   18 32 f 79.87896 3.543771 78.35780       6.881003 78.92008       10.85273 77.97981       8.898176 79.69663 5.624203 79.47016 4.614588 0.2264709      7.275032 
1 1 1 1   18 33 o 54.59945 3.672366 36.76362       4.857770 32.85892       6.607135 41.35783       7.166792 51.24463 5.370576 57.60506 5.159976 -6.360432      7.447713 
1 1 1 1   18 34 o 61.80659 3.496395 47.09307       5.244652 42.28943       7.164346 52.63979       7.698550 58.16888 5.105919 65.00572 4.895811 -6.836845      7.073852 
1 1 1 1   18 35 o 42.77241 4.283313 22.87264       4.404566 27.92435       6.126242 17.46720       6.337101 46.95990 5.454799 36.39268 7.398036 10.56722       9.191614 
1 1 1 1   18 36 o 84.60517 3.850176 88.88638       7.917242 88.03066       9.152502 91.43027       15.78051 83.91270 4.492229 83.40641 7.856544 0.5062943      9.050160 
1 1 1 1   18 37 o 16.68032 6.687739 2.081928       4.136222 2.342502       4.740773 1.251237       8.464540 17.72876 7.141817 21.08823 9.084173 -3.359467      11.55542 
1 1 1 1   18 38 o 16.42342 6.426075 2.462890       3.732972 3.228512       4.828095 1.324915       5.886202 18.50822 7.288192 18.03794 7.667629 0.4702740      10.57877 
1 1 1 1   18 39 o 29.52574 5.783160 11.81289       4.012112 9.025234       5.183225 15.97985       6.337090 25.09851 7.722182 33.15128 7.947514 -8.052767      11.08129 
1 1 1 1   18 40 o 13.27188 5.794971 0.3821624E-01  3.541053 -0.8920121     4.580325 1.420176       5.582763 14.16378 6.363513 17.10343 7.372646 -2.939648      9.739108 
1 1 1 1   18 41 o 11.96713 5.696728 -4.182453      4.562819 -4.293962      7.821033 -4.124917      5.617972 15.93276 7.547872 13.51253 6.400077 2.420234       9.896028 
1 1 1 1   18 42 o 39.33385 5.430957 22.00016       5.066927 17.69672       7.847154 25.07739       6.635673 30.27698 9.531325 40.22376 7.025159 -9.946787      11.84057 
1 1 1 1   18 43 o 14.42441 6.223588 1.560234       3.985361 2.479516       5.154993 0.1944831      6.283326 16.16245 7.025417 15.59595 7.177831 0.5664988      10.04379 
1 1 1 1   18 44 o 16.38300 6.323630 4.095708       3.576903 5.003479       5.111149 3.224397       5.007455 17.60209 7.290196 16.09452 6.960253 1.507568       10.07929 
1 1 1 1   18 45 o 12.69942 5.697441 0.7632697      3.657142 1.623427       5.134401 -0.1225385     5.210396 14.48321 6.598711 13.54800 6.337266 0.9352055      9.148985 
1 1 1 1   18 46 o 21.34943 7.459460 9.962015       4.776944 12.30705       6.060633 6.115585       7.761974 21.93185 8.288113 16.79809 7.816669 5.133762       11.39268 
1 1 1 1   18 47 o 16.92036 7.019594 6.408923       4.749819 7.585361       5.851728 4.136924       8.132119 17.31367 7.505746 15.36939 7.392990 1.944280       10.53530 
1 1 1 1   19 0  o 443.3548 9.358474 2399.376       101.1096 2241.034       136.4665 2592.086       150.5499 427.9050 13.10251 460.1780 13.43953 -32.27304      18.76957 
1 1 1 1   19 1  o 462.3538 9.707161 2609.812       109.3712 2486.291       149.5803 2751.719       160.3266 450.6452 13.63652 474.0685 13.89303 -23.42334      19.46718 
1 1 1 1   19 2  o 784.2466 13.05746 7521.046       249.5441 7253.605       297.7665 8152.062       457.3852 769.5136 15.87901 813.0513 23.10834 -43.53766      28.03816 
1 1 1 1   19 3  o 408.1942 6.165538 2031.875       61.33014 1919.653       83.19279 2165.469       90.76947 396.6070 8.607740 421.2168 8.842968 -24.60974      12.34064 
1 1 1 1   19 4  o 924.6793 13.27115 10459.10       299.0444 10030.91       581.1411 10613.32       348.7637 899.9118 26.52894 930.8474 15.37506 -30.93555      30.66230 
1 1 1 1   19 5  o 355.4413 4.880149 1540.219       42.27047 1633.679       69.27641 1484.783       53.35365 365.9113 7.769148 348.9231 6.274776 16.98822       9.986615 
1 1 1 1   19 6  o 271.3933 3.939212 897.7781       26.05221 944.4389       42.33545 869.3384       33.05138 278.2770 6.242963 267.0266 5.079241 11.25034       8.048184 
1 1 1 1   19 7  o 373.4178 5.708134 1700.446       51.94279 1846.146       77.29173 1580.449       70.14378 388.9160 8.155322 359.8547 7.998820 29.06128       11.42324 
1 1 1 1   19 8  o 471.2346 6.241220 2708.653       71.67088 2652.465       111.7462 2747.918       93.41512 465.9447 9.841523 474.4634 8.079385 -8.518707      12.73311 
1 1 1 1   19 9  o 375.3820 5.725429 1718.660       52.37423 1783.310       108.1137 1698.836       59.86813 381.6012 11.63974 373.1504 6.583785 8.450836       13.37272 
1 1 1 1   19 10 o 243.1188 4.672213 720.7222       27.68071 766.4705       51.21002 701.8382       32.90141 250.3669 8.405396 239.8721 5.628578 10.49475       10.11591 
1 1 1 1   19 11 o 335.5065 4.662252 1372.698       38.11823 1380.621       60.98634 1367.619       48.83187 336.2534 7.442687 334.7935 5.985360 1.459930       9.550818 
1 1 1 1   19 12 o 183.0294 3.091359 408.3509       13.78816 422.6192       22.93127 400.2711       17.25598 186.0642 5.062127 181.1865 3.908208 4.877716       6.395249 
1 1 1 1   19 13 o 73.25545 3.496506 65.57618       6.223788 48.35511       11.85936 72.12190       7.311559 62.39180 7.982677 76.80601 3.919377 -14.41421      8.892956 
1 1 1 1   19 14 o 120.9293 2.648368 178.2586       7.804516 194.1457       13.60413 170.4649       9.528459 126.0781 4.434779 118.1960 3.311402 7.882050       5.534677 
1 1 1 1   19 15 o 207.7302 3.294385 526.1743       16.67670 532.6242       27.20302 522.2906       21.10847 208.8038 5.350578 206.9147 4.186292 1.889084       6.793653 
1 1 1 1   19 16 f 232.9336 3.537211 661.7689       20.07840 664.4962       32.42222 660.0724       25.57202 233.2257 5.704665 232.5616 4.512226 0.6641541      7.273471 
1 1 1 1   19 17 o 317.9183 4.455114 1233.780       34.51520 1225.555       55.00034 1239.124       44.33095 316.4015 7.133306 318.4171 5.713137 -2.015594      9.139146 
1 1 1 1   19 18 o 169.0777 3.313843 348.7259       13.65382 370.0237       20.31734 331.1859       18.43802 173.9879 4.796520 164.6182 4.600727 9.369736       6.646299 
1 1 1 1   19 19 f 316.7955 5.724051 1227.569       44.18945 1243.489       76.93121 1219.730       53.98350 317.4524 9.956925 315.4747 7.021994 1.977722       12.18396 
1 1 1 1   19 20 o 205.8938 3.696470 517.4439       18.54669 526.3175       26.90186 509.4057       25.60420 207.3861 5.327536 204.0533 5.153224 3.332764       7.412042 
1 1 1 1   19 21 o 159.1310 3.916954 309.2197       15.18936 302.5435       18.07767 325.2504       28.01256 157.2556 4.722725 162.6494 7.084466 -5.393768      8.514329 
1 1 1 1   19 22 o 116.9547 3.638421 167.1767       10.35709 162.7697       12.25703 178.1793       19.36705 115.3225 4.369395 120.3271 6.630495 -5.004593      7.940722 
1 1 1 1   19 23 o 129.2697 3.048177 203.9462       9.602255 216.6657       14.35688 193.6511       12.91634 133.0446 4.434391 125.7999 4.219276 7.244675       6.120957 
1 1 1 1   19 24 o 68.29925 3.306443 57.09317       5.486822 57.12597       7.651205 57.05843       7.872608 68.17247 4.633113 68.11374 4.773156 0.5873108E-01  6.651974 
1 1 1 1   19 25 o 77.93011 3.250272 74.29562       6.158951 73.60271       8.278760 75.15444       9.216680 77.43494 4.405424 78.18748 4.861327 -0.7525406     6.560508 
1 1 1 1   19 26 o 19.65403 6.110688 4.721007       3.235772 6.137160       4.963077 3.674014       4.267445 22.88250 7.611444 19.17872 7.009781 3.703787       10.34752 
1 1 1 1   19 27 o 101.2889 3.034684 125.4233       7.482061 125.5352       10.79687 125.3200       10.37802 101.1505 4.390657 101.0899 4.222090 0.6053162E-01  6.091299 
1 1 1 1   19 28 o 50.41710 3.674620 31.25877       4.483678 26.07215       6.412116 36.22114       6.271964 45.65545 5.901220 54.12885 4.804736 -8.473408      7.609855 
1 1 1 1   19 29 o 22.32596 7.262020 5.986839       4.527455 -1.209718      9.497532 8.103091       5.150295 21.89943 9.527354 25.42150 7.673195 -3.522064      12.23309 
1 1 1 1   19 30 o 35.83836 4.739524 16.05114       4.037854 12.74533       5.598885 19.63407       5.828831 31.39849 7.433316 39.37864 6.285318 -7.980158      9.734445 
1 1 1 1   19 31 o 76.32763 3.560879 71.53526       6.605054 79.81531       10.70537 66.44592       8.392967 80.21852 5.509809 73.33940 4.721232 6.879120       7.255896 
1 1 1 1   19 32 o 125.4585 3.177673 192.9336       9.707241 192.2319       13.79784 193.6214       13.65943 124.8420 4.542962 125.3137 4.480197 -0.4717407     6.380491 
1 1 1 1   19 33 o 68.22858 3.367332 57.27438       5.581419 50.93513       7.611889 64.64623       8.208464 63.97377 4.920412 72.17888 4.692194 -8.205112      6.799054 
1 1 1 1   19 34 o 53.89789 3.656375 35.93992       4.773973 36.89091       6.662941 34.93668       6.843516 54.22822 5.101964 52.66627 5.409048 1.561951       7.435578 
1 1 1 1   19 35 o 17.92153 6.998375 2.731896       4.420289 6.218532       5.022378 -9.250751      9.310703 22.51384 7.657798 17.46678 8.262952 5.047062       11.26580 
1 1 1 1   19 36 o 22.91594 7.851808 6.585504       5.281902 6.585504       5.281902 0.000000       0.000000 22.91594 7.851808 ?        ?        0.000000       7.851808 
1 1 1 1   19 37 o 77.38144 3.393608 74.54357       6.383769 74.56275       8.688753 74.52107       9.410390 76.66880 4.672722 76.37194 5.085327 0.2968597      6.906148 
1 1 1 1   19 38 f 25.47858 6.278900 8.909307       3.872963 9.041586       5.201003 8.744655       5.802650 25.30296 7.726121 24.94609 8.227639 0.3568707      11.28658 
1 1 1 1   19 39 o 25.79070 6.438941 9.382257       4.034112 9.311352       5.501803 9.464705       5.932729 25.12724 7.989813 25.25021 8.318954 -0.1229725     11.53439 
1 1 1 1   19 40 o 20.54771 6.698195 6.061665       3.850626 5.320789       5.144003 7.005942       5.807354 19.98145 7.615930 21.94151 8.149697 -1.960058      11.15437 
1 1 1 1   19 41 o 16.97439 7.481791 1.656490       6.029269 0.000000       0.000000 1.656490       6.029269 ?        ?        16.97439 7.481791 0.000000       7.481791 
1 1 1 1   19 42 o 16.63266 6.471658 3.714385       3.769061 1.301627       5.368527 6.059551       5.292793 15.72093 6.987893 19.60526 7.657372 -3.884332      10.36658 
1 1 1 1   19 43 o 28.85203 5.910301 12.78453       4.015618 12.77821       5.653321 12.79098       5.704912 26.13061 8.069201 26.07368 8.114970 0.5693054E-01  11.44398 
1 1 1 1   19 44 o 13.05632 5.767097 1.032574       3.600471 2.949990       5.051187 -0.9478285     5.133481 15.64363 6.873347 13.30702 6.245593 2.336617       9.287106 
1 1 1 1   19 45 o 16.32894 6.707424 4.733277       4.279346 6.332004       5.510848 2.304977       6.791763 17.57353 7.442523 15.33948 7.194542 2.234051       10.35145 
1 1 1 1   19 46 o 10.05144 4.877011 -3.172221      3.733162 1.983836       5.432783 -7.784783      5.138479 14.13361 6.564114 10.13745 5.063292 3.996161       8.290025 
1 1 1 1   20 0  o 355.1754 5.469391 1538.216       47.33888 1477.289       65.09975 1606.586       68.96160 347.9439 7.677750 362.8426 7.799252 -14.89868      10.94423 
1 1 1 1   20 1  o 265.8171 4.371820 861.3533       28.31922 854.3984       39.69989 868.5588       40.40836 264.6790 6.155079 266.8609 6.213697 -2.181885      8.746143 
1 1 1 1   20 2  f 339.6918 7.434247 1407.963       61.54010 1407.963       61.54010 0.000000       0.000000 339.6918 7.434247 ?        ?        0.000000       7.434247 
1 1 1 1   20 3  o 265.4130 4.372140 858.7545       28.27824 870.9651       57.23614 854.8114       32.52518 266.9435 8.810698 264.7811 5.040767 2.162415       10.15075 
1 1 1 1   20 4  o 367.4865 6.507032 1647.372       58.27207 0.000000       0.000000 1647.372       58.27207 ?        ?        367.4865 6.507032 0.000000       6.507032 
1 1 1 1   20 5  o 665.8118 9.663754 5415.953       156.7955 5739.454       326.5162 5318.995       178.7545 682.2711 19.65915 659.5383 11.12195 22.73279       22.58716 
1 1 1 1   20 6  o 244.3599 3.668038 727.8548       21.84237 763.9399       35.30239 705.4725       27.80308 250.2673 5.788472 240.5402 4.743176 9.727142       7.483590 
1 1 1 1   20 7  o 361.4897 4.956376 1593.494       43.66126 1590.068       68.88040 1595.794       56.45081 360.8820 7.832390 361.6524 6.405349 -0.7703552     10.11804 
1 1 1 1   20 8  o 299.7004 4.730152 1095.299       34.54605 1158.097       50.65536 1040.696       47.23480 308.0430 6.748045 292.0199 6.637638 16.02310       9.465429 
1 1 1 1   20 9  o 367.9108 6.552574 1652.114       58.74765 1554.353       98.13720 1706.712       73.34039 356.0737 11.32427 373.7765 8.051839 -17.70282      13.89501 
1 1 1 1   20 10 o 332.4051 5.181109 1347.930       41.96880 1428.749       88.06782 1324.182       47.73809 341.4064 10.59829 329.4007 5.947089 12.00565       12.15284 
1 1 1 1   20 11 o 281.7627 4.556473 968.3474       31.28588 938.2953       62.30006 978.4818       36.17857 276.7485 9.250771 283.1849 5.242581 -6.436432      10.63303 
1 1 1 1   20 12 o 180.1578 3.088096 395.6852       13.55751 360.4930       21.23610 419.8970       17.61425 171.8049 5.077851 185.5578 3.895372 -13.75291      6.399883 
1 1 1 1   20 13 o 403.6998 5.465307 1989.611       53.76617 1930.185       83.91477 2030.997       70.02886 397.0398 8.672979 407.6139 7.050046 -10.57416      11.17693 
1 1 1 1   20 14 o 160.3194 2.901568 313.3655       11.33587 336.8877       19.17777 300.7335       14.05386 166.0730 4.743600 157.0252 3.672739 9.047852       5.999229 
1 1 1 1   20 15 o 29.21283 4.408587 10.64846       3.040800 12.99686       5.879436 9.790899       3.552879 31.94480 7.653153 27.83678 5.432595 4.108021       9.385300 
1 1 1 1   20 16 o 146.3355 2.771604 261.1137       9.883642 249.9050       16.08566 267.9119       12.52735 142.9910 4.622373 148.1969 3.468839 -5.205856      5.779202 
1 1 1 1   20 17 f 240.2417 3.622047 704.2444       21.20502 740.9297       35.16408 683.2806       26.58209 246.1351 5.862591 236.5341 4.611682 9.600983       7.459061 
1 1 1 1   20 18 o 203.9105 3.584437 507.4066       17.81134 468.3734       34.43126 521.6683       20.81243 195.3140 7.246649 206.7039 4.131787 -11.38991      8.341798 
1 1 1 1   20 19 o 255.9392 4.242291 800.0219       26.45900 868.9362       57.80138 781.7534       29.76007 265.5157 8.946075 252.9123 4.828673 12.60335       10.16604 
1 1 1 1   20 20 o 79.22294 3.824984 76.81039       7.362606 86.96214       8.909451 54.94715       13.07488 84.25589 4.354018 66.33356 8.267463 17.92233       9.343897 
1 1 1 1   20 21 o 285.3684 5.440346 996.9312       37.83280 971.1071       45.36059 1055.952       68.57551 281.3313 6.616442 292.0728 9.648021 -10.74149      11.69879 
1 1 1 1   20 22 o 36.53099 4.031050 16.50330       3.528921 20.06468       6.102152 14.71373       4.325619 39.93106 6.493917 34.26075 5.356293 5.670307       8.417888 
1 1 1 1   20 23 o 191.0369 4.051608 446.1002       18.86170 439.3604       23.79396 457.4969       30.94114 189.3306 5.161969 192.8443 6.593751 -3.513763      8.373976 
1 1 1 1   20 24 o 261.2271 4.976868 835.8763       31.68184 844.0432       54.63941 831.7399       38.88611 260.9991 8.602498 260.2241 6.132123 0.7750244      10.56437 
1 1 1 1   20 25 o 149.3208 3.234855 272.3464       11.77094 280.8675       17.26422 264.9442       16.09090 151.3621 4.686161 147.0408 4.495904 4.321335       6.494093 
1 1 1 1   20 26 o 95.97177 3.038766 112.6070       7.097889 112.9720       10.46699 112.2962       9.657653 95.93604 4.489625 95.69907 4.151088 0.2369614      6.114594 
1 1 1 1   20 27 o 91.04098 3.035612 101.3712       6.725298 99.84779       9.743616 102.7574       9.294302 90.15892 4.448550 91.50913 4.178920 -1.350212      6.103521 
1 1 1 1   20 28 o 39.54263 5.007135 19.50540       4.716921 30.19283       10.54951 16.83491       5.273409 48.35010 9.291147 36.46592 6.153027 11.88418       11.14384 
1 1 1 1   20 29 o 18.19335 6.335590 3.671950       3.444350 1.652143       5.071410 5.401357       4.692696 18.04216 7.343448 21.67536 7.401611 -3.633196      10.42641 
1 1 1 1   20 30 o 72.47195 3.566921 64.49012       6.280052 70.20653       10.53683 61.34076       7.820957 75.16509 5.797281 70.49898 4.577149 4.666115       7.386391 
1 1 1 1   20 31 f 117.4822 3.155690 169.1354       9.026281 187.9394       13.38010 153.4308       12.22777 123.5013 4.453107 111.5571 4.507222 11.94424       6.336025 
1 1 1 1   20 32 o 100.7111 3.137328 124.4403       7.690303 125.2343       10.88173 123.6481       10.86974 100.6845 4.446020 100.0362 4.470174 0.6483307      6.304725 
1 1 1 1   20 33 o 19.56035 6.509313 4.597489       3.629750 -1.406905      5.177346 10.40156       5.090247 15.57311 6.895438 28.13463 7.346303 -12.56152      10.07548 
1 1 1 1   20 34 o 61.51179 4.243255 47.11197       6.321559 44.44855       7.265745 55.40850       12.82357 59.46993 5.061618 64.89864 8.298019 -5.428715      9.719934 
1 1 1 1   20 35 o 23.40113 6.632929 7.229493       3.954955 8.283830       5.116684 5.664645       6.233541 25.03178 7.667071 22.64148 8.436933 2.390299       11.40025 
1 1 1 1   20 36 o 48.90898 4.863130 30.48447       5.719453 31.88706       6.578069 26.13911       11.57829 49.72476 5.521605 41.63125 11.17828 8.093513       12.46764 
1 1 1 1   20 37 f 27.02268 6.139285 9.896488       3.950527 8.917944       5.453445 10.97704       5.730636 25.29917 7.943141 27.81615 8.016769 -2.516983      11.28548 
1 1 1 1   20 38 o 15.61770 6.244897 2.091474       3.596625 3.077413       4.858462 0.8960575      5.349749 18.08320 7.248849 16.75324 7.219382 1.329962       10.23061 
1 1 1 1   20 39 o 39.50379 4.681262 20.60333       4.418996 20.25472       6.117262 20.98378       6.390497 37.53990 6.942603 38.04840 7.154829 -0.5084953     9.969519 
1 1 1 1   20 40 o 19.34451 7.088190 5.277982       4.367632 2.377736       6.986740 7.138399       5.595802 18.45455 8.096797 21.66250 8.008394 -3.207954      11.38826 
1 1 1 1   20 41 o 9.600286 4.739980 -7.262079      4.021923 -11.57416      7.005147 -5.141725      4.912222 12.35528 6.127901 11.81976 5.700739 0.5355139      8.369563 
1 1 1 1   20 42 o 12.40954 5.561711 -0.9295421E-01 3.475255 0.9352331      5.074149 -1.001382      4.769493 15.01439 6.725450 13.47103 6.219165 1.543358       9.160223 
1 1 1 1   20 43 o 10.74548 5.048774 -1.876620      3.370238 4.442110       5.097649 -6.783216      4.492056 17.15757 7.206202 10.19841 5.030413 6.959162       8.788310 
1 1 1 1   20 44 o 12.87961 5.881848 0.3424893      4.110196 1.021212       5.287346 -0.6940157     6.533970 14.26870 6.573291 14.27061 6.799945 -0.1914978E-02 9.457664 
1 1 1 1   20 45 o 14.40547 6.142999 3.007442       3.799098 1.635321       5.476540 4.280247       5.274621 14.23995 6.605588 15.79496 6.978373 -1.555004      9.608927 
1 1 1 1   20 46 o 13.27271 5.939581 1.979120       3.947352 6.427582       5.802520 -1.853005      5.385568 16.68155 7.346738 12.21892 5.911766 4.462621       9.429928 
1 1 1 1   21 0  o 401.4109 7.029847 1966.411       68.76559 1917.316       116.8119 1992.448       85.06789 395.5647 12.13241 403.8958 8.642915 -8.331116      14.89615 
1 1 1 1   21 1  o 109.7573 3.523982 146.9924       9.413260 157.2287       16.26596 141.8380       11.54245 113.3784 5.907637 107.7693 4.404361 5.609169       7.368757 
1 1 1 1   21 2  o 343.3523 7.539212 1439.144       63.08150 1479.824       90.89907 1401.353       87.61308 347.6705 10.74179 338.3333 10.63967 9.337189       15.11915 
1 1 1 1   21 3  o 286.1732 4.599066 998.5712       32.07265 1010.746       45.61858 986.6707       45.10099 287.8083 6.504328 284.3596 6.508519 3.448669       9.201472 
1 1 1 1   21 4  o 390.8882 6.834243 1864.828       65.09971 2016.359       118.1963 1798.843       77.99615 405.5840 11.97188 383.7532 8.340364 21.83081       14.59067 
1 1 1 1   21 5  o 276.8820 4.510206 934.8259       30.43176 994.3697       44.35058 881.8488       41.83365 285.4539 6.375691 268.8178 6.386039 16.63611       9.023909 
1 1 1 1   21 6  o 280.5779 4.517326 960.0042       30.88666 934.0049       42.99167 987.7387       44.40318 276.6385 6.377281 284.4828 6.405042 -7.844299      9.038488 
1 1 1 1   21 7  o 289.4664 4.616930 1021.904       32.56774 1085.629       47.81442 966.7532       44.48146 298.2112 6.579591 281.4185 6.486200 16.79269       9.239145 
1 1 1 1   21 8  o 188.5140 3.470458 433.2564       15.94287 442.2363       30.98913 430.0242       18.59204 190.1906 6.696724 187.7894 4.062748 2.401260       7.832754 
1 1 1 1   21 9  o 294.7061 4.205322 1059.228       30.20122 1133.120       49.68382 1015.923       38.03498 304.5945 6.693554 288.5309 5.409470 16.06360       8.606162 
1 1 1 1   21 10 o 92.18915 2.999914 103.7176       6.730481 119.5481       15.14118 99.81934       7.513615 98.73694 6.326080 90.41645 3.416231 8.320488       7.189570 
1 1 1 1   21 11 o 71.38702 3.100074 62.24895       5.380106 71.94222       12.30268 59.95685       5.982482 76.44194 6.671150 70.03202 3.516743 6.409920       7.541334 
1 1 1 1   21 12 o 239.0604 4.068773 697.1802       23.70321 626.9714       45.99390 722.5704       27.65911 226.1131 8.361555 243.3285 4.664544 -17.21538      9.574632 
1 1 1 1   21 13 o 398.8940 5.418575 1943.428       52.67188 2005.983       85.51665 1905.192       66.85906 404.5021 8.675487 394.6435 6.952152 9.858612       11.11740 
1 1 1 1   21 14 o 243.4305 4.084421 723.1440       24.22934 658.6832       46.56297 747.0790       28.37329 231.6330 8.262288 247.3639 4.706924 -15.73093      9.508971 
1 1 1 1   21 15 o 32.91229 3.973385 13.41124       3.122384 28.85794       6.489491 8.758131       3.561758 48.26520 5.622641 26.26054 5.727426 22.00466       8.026052 
1 1 1 1   21 16 o 55.63829 3.044434 37.87061       4.112049 53.26210       10.03641 34.76572       4.507766 65.66423 6.351300 53.26556 3.492050 12.39867       7.247994 
1 1 1 1   21 17 o 90.37970 2.792134 99.71866       6.142172 104.6382       13.27004 98.37734       6.929100 92.28343 5.932242 89.74411 3.173356 2.539322       6.727681 
1 1 1 1   21 18 o 171.7085 2.995823 359.6737       12.53557 385.0511       21.14332 345.9179       15.56659 177.4191 4.894989 168.3322 3.794811 9.086960       6.193667 
1 1 1 1   21 19 o 257.7268 4.324751 811.5281       27.16169 817.3892       38.74419 805.8636       38.08906 258.2971 6.155325 256.4835 6.094031 1.813599       8.661711 
1 1 1 1   21 20 o 232.3666 4.050070 659.6312       22.93360 650.3076       32.44622 668.9396       32.41982 230.3312 5.785210 233.6997 5.692675 -3.368515      8.116354 
1 1 1 1   21 21 o 353.9045 4.902112 1532.545       42.27712 1621.571       70.04488 1481.528       53.02480 362.8077 7.922529 347.5016 6.261611 15.30612       10.09823 
1 1 1 1   21 22 o 129.9643 3.453782 206.4265       10.92874 204.3743       14.42370 209.1927       16.74619 129.1671 4.589650 130.5723 5.273795 -1.405212      6.991266 
1 1 1 1   21 23 o 250.8057 4.256969 769.4026       26.01801 783.2748       37.58421 756.6374       36.05354 252.5435 6.107073 248.2589 5.959462 4.284653       8.532967 
1 1 1 1   21 24 o 87.25955 3.027117 93.08529       6.427175 97.99494       9.912970 89.52461       8.441993 89.34775 4.568019 85.45657 4.065468 3.891182       6.115131 
1 1 1 1   21 25 o 99.80025 3.047502 121.7592       7.402913 117.0129       11.06267 125.6081       9.962195 97.61644 4.664003 101.2411 4.046113 -3.624611      6.174460 
1 1 1 1   21 26 o 36.58739 4.417065 16.63477       3.858626 15.89901       5.925536 17.17647       5.084377 35.25505 7.142210 36.92990 5.843945 -1.674858      9.228373 
1 1 1 1   21 27 o 80.96177 3.662961 80.36857       7.208121 95.69418       14.72176 75.53603       8.266820 87.69106 6.945890 78.38352 4.344903 9.307541       8.192898 
1 1 1 1   21 28 o 98.17066 3.617938 118.1417       8.640430 112.1214       16.60491 120.3771       10.11818 94.76998 7.244934 98.99217 4.203930 -4.222191      8.376282 
1 1 1 1   21 29 o 49.12853 4.158273 29.82180       4.931607 32.36998       8.505620 28.53135       6.052874 50.56774 7.097450 47.84041 5.279665 2.727333       8.845827 
1 1 1 1   21 30 o 94.19191 3.120255 108.7277       7.152205 113.5818       10.46922 104.4795       9.794001 95.98191 4.488417 92.07392 4.377569 3.907990       6.269689 
1 1 1 1   21 31 o 27.25841 5.853983 9.571262       3.772429 8.340481       5.250220 10.88490       5.424065 25.59154 7.752156 28.89002 7.602721 -3.298485      10.85805 
1 1 1 1   21 32 o 70.60469 3.301101 61.33886       5.664016 62.50545       8.054344 60.19754       7.966633 70.92662 4.686249 69.58788 4.725955 1.338737       6.655493 
1 1 1 1   21 33 o 21.94576 6.569159 6.184690       3.786433 6.196060       5.286520 6.172711       5.425847 22.75605 7.853066 22.82358 7.951593 -0.6752777E-01 11.17580 
1 1 1 1   21 34 o 50.21251 4.168269 31.52527       5.054450 31.67955       6.660382 31.31578       7.761424 49.84349 5.579066 49.10417 6.657475 0.7393188      8.686078 
1 1 1 1   21 35 f 17.06335 6.371283 3.019896       3.558401 1.180748       5.063019 4.815132       5.002210 17.11561 7.184695 20.62633 7.581051 -3.510723      10.44472 
1 1 1 1   21 36 o 21.06302 7.223288 5.663011       4.470388 2.108634       5.107097 17.31130       9.245352 17.80040 7.321330 33.95125 10.28772 -16.15085      12.62692 
1 1 1 1   21 37 o 15.47244 6.315434 1.693967       3.763747 4.756695       5.348691 -1.310038      5.297167 20.30245 7.759223 15.22314 6.841099 5.079310       10.34438 
1 1 1 1   21 38 o 12.33298 5.579041 -1.265126      3.590620 -5.950204      4.881070 4.260026       5.300646 11.90617 5.727244 19.38833 7.635992 -7.482165      9.545140 
1 1 1 1   21 39 o 29.55640 5.720496 12.24416       3.971282 7.293509       5.379733 18.17237       5.886961 22.09414 7.897982 34.98157 7.147542 -12.88742      10.65202 
1 1 1 1   21 40 o 14.23299 6.006999 1.427531       3.569649 2.535680       4.949938 0.2267594      5.152653 16.65740 7.054027 15.12913 6.777030 1.528273       9.781995 
1 1 1 1   21 41 o 23.62530 7.200796 9.226204       4.520475 14.93844       8.965534 7.278993       5.234555 26.10520 10.02841 20.85527 7.739024 5.249926       12.66734 
1 1 1 1   21 42 o 15.51683 6.221538 3.151102       3.579820 5.911992       5.315489 0.8594782      4.842731 18.84780 7.572896 14.54799 6.539106 4.299807       10.00543 
1 1 1 1   21 43 o 13.59838 5.987524 1.374514       3.852063 0.9343078      4.930726 2.064000       6.170854 14.20936 6.471063 15.66966 7.175249 -1.460305      9.662238 
1 1 1 1   21 44 o 13.00540 5.740943 1.414790       3.562473 -0.6147531     5.246110 3.151579       4.853017 13.15246 6.216138 15.14882 6.693252 -1.996357      9.134549 
1 1 1 1   21 45 o 15.03828 6.316699 3.835264       3.917434 7.065288       5.726194 0.9935014      5.371025 17.47188 7.498234 13.65061 6.400998 3.821267       9.858818 
1 1 1 1   22 0  o 114.0181 3.529868 158.6369       9.795908 139.7008       15.57640 171.0264       12.59939 106.8251 6.007738 118.3455 4.376332 -11.52035      7.432712 
1 1 1 1   22 1  o 231.2776 3.991021 652.1952       22.49333 602.4022       30.16276 714.5779       33.76129 222.1300 5.576623 241.9964 5.724980 -19.86641      7.992129 
1 1 1 1   22 2  o 288.6176 4.660596 1015.956       32.77935 1006.443       45.95801 1025.806       46.76658 287.1254 6.568308 289.8698 6.620588 -2.744446      9.326032 
1 1 1 1   22 3  o 519.1093 10.86847 3301.357       137.4875 3265.829       193.2324 3337.784       195.6638 514.6682 15.42435 520.3021 15.44899 -5.633911      21.83076 
1 1 1 1   22 4  o 180.9116 4.040020 399.0991       17.81091 345.6247       28.98109 431.5545       22.57797 168.0699 7.091950 188.0232 4.931880 -19.95322      8.638241 
1 1 1 1   22 5  o 215.0954 3.861285 564.1530       20.23947 536.4918       39.21330 574.1978       23.63028 209.3804 7.698417 216.9740 4.469152 -7.593628      8.901626 
1 1 1 1   22 6  o 205.7332 3.725425 516.1063       18.67739 568.3300       39.66051 501.2236       21.17211 215.5088 7.563643 202.7207 4.285780 12.78810       8.693481 
1 1 1 1   22 7  o 425.7794 6.419688 2214.156       66.60928 2187.390       132.5964 2223.189       77.03462 421.4805 12.92503 426.4785 7.412295 -4.997986      14.89962 
1 1 1 1   22 8  o 53.20077 3.074279 34.62127       3.968657 31.07357       5.804474 37.73564       5.438448 50.23627 4.799716 55.47533 4.050817 -5.239056      6.280637 
1 1 1 1   22 9  o 277.1732 4.033414 937.1061       27.24332 953.2146       43.34970 926.5910       35.02405 279.3148 6.368777 275.5113 5.216640 3.803528       8.232536 
1 1 1 1   22 10 o 297.8421 5.490048 1083.319       39.84726 1047.793       69.07761 1101.036       48.78150 292.0595 9.719305 300.1071 6.670260 -8.047638      11.78801 
1 1 1 1   22 11 o 202.4212 3.681640 499.8094       18.16074 498.1423       37.39145 500.3242       20.77579 201.5706 7.625931 202.4906 4.210335 -0.9199524     8.711013 
1 1 1 1   22 12 o 306.4997 4.888260 1147.126       36.51072 1113.444       72.76270 1158.461       42.20911 300.7834 9.940675 307.9016 5.625460 -7.118286      11.42203 
1 1 1 1   22 13 o 465.4023 6.227623 2649.387       70.62964 2773.901       115.6652 2575.353       89.18903 474.7679 9.997361 458.2830 7.986226 16.48489       12.79559 
1 1 1 1   22 14 o 220.2250 3.460706 591.7067       18.57237 600.7094       30.29870 586.2880       23.50631 221.5877 5.615552 219.1260 4.402045 2.461685       7.135294 
1 1 1 1   22 15 o 326.5980 5.112113 1303.680       40.68648 1421.310       86.39063 1270.153       46.12169 339.1995 10.46394 322.2125 5.873903 16.98700       11.99986 
1 1 1 1   22 16 o 78.37300 3.187558 75.06048       6.075101 71.78796       8.848398 77.97872       8.355733 76.50058 4.770131 79.78959 4.313402 -3.289009      6.431142 
1 1 1 1   22 17 o 146.2492 3.256359 260.9885       11.60545 251.3020       16.45112 270.5848       16.37431 143.3189 4.716802 148.7456 4.522593 -5.426697      6.534682 
1 1 1 1   22 18 o 216.2814 3.887108 571.2471       20.48716 636.2581       30.91453 520.3376       27.35700 227.9875 5.564364 206.1237 5.451122 21.86385       7.789536 
1 1 1 1   22 19 o 112.3982 2.631960 154.1053       7.208999 169.3602       12.75670 146.9478       8.738050 117.6220 4.458622 109.6745 3.273097 7.947487       5.531046 
1 1 1 1   22 20 o 198.0858 3.239767 478.9850       15.63879 470.5770       25.29759 484.1858       19.89602 195.9630 5.302348 199.0466 4.101807 -3.083588      6.703709 
1 1 1 1   22 21 o 107.8563 2.816112 142.0569       7.395367 148.9387       11.84770 137.6639       9.465919 110.2635 4.418209 106.0917 3.666896 4.171829       5.741663 
1 1 1 1   22 22 o 144.9512 2.812599 256.4372       9.934951 267.4337       16.90322 250.6335       12.27994 147.7300 4.701298 143.2335 3.518159 4.496506       5.871938 
1 1 1 1   22 23 o 98.09589 2.981716 117.5995       7.119487 116.0586       10.71446 118.8177       9.526811 97.25994 4.533111 98.48914 3.977566 -1.229195      6.030766 
1 1 1 1   22 24 o 29.10836 5.048186 10.68434       3.451131 1.840566       5.958375 15.14909       4.233579 19.50954 7.952608 34.77588 5.151220 -15.26633      9.475181 
1 1 1 1   22 25 o 56.77277 3.480481 39.55216       4.792069 41.57059       7.695809 38.27392       6.124268 57.90771 5.520297 55.70247 4.551380 2.205242       7.154631 
1 1 1 1   22 26 o 26.54293 5.961906 9.017484       3.761820 1.645222       6.281509 13.14009       4.697315 19.74308 8.119902 32.11532 6.226873 -12.37224      10.23263 
1 1 1 1   22 27 o 56.99153 4.055578 40.00426       5.595672 35.40075       11.53230 41.42185       6.399489 52.36580 9.381742 57.91509 4.571420 -5.549294      10.43623 
1 1 1 1   22 28 o 65.26525 3.740224 52.35596       5.923704 53.89604       10.75217 51.68480       7.098076 65.57133 6.828867 64.71275 4.529663 0.8585892      8.194589 
1 1 1 1   22 29 o 104.8019 3.109838 134.5498       7.933455 133.5468       11.62874 135.4230       10.85081 104.0801 4.596225 104.8975 4.253661 -0.8173370     6.262500 
1 1 1 1   22 30 o 116.2048 3.145285 165.5544       8.898580 158.4089       12.72409 172.3947       12.44939 113.2629 4.619716 118.2598 4.327208 -4.996948      6.329811 
1 1 1 1   22 31 f 20.93440 6.508505 5.484226       3.670835 2.219682       5.355024 8.378058       5.041813 18.79797 7.584081 25.50808 7.567021 -6.710114      10.71345 
1 1 1 1   22 32 o 41.53296 4.265534 21.55270       4.255910 26.03772       6.365069 17.92631       5.723458 45.21672 5.918477 37.19849 6.553200 8.018230       8.830220 
1 1 1 1   22 33 o 92.13067 3.485011 104.9007       7.810176 112.7102       10.35486 94.59510       11.89516 95.07005 4.482174 86.47605 5.676045 8.594002       7.232384 
1 1 1 1   22 34 o 62.91339 3.487268 49.15367       5.325520 51.27670       7.662331 47.16978       7.407002 63.65018 4.979589 61.01213 5.026386 2.638046       7.075370 
1 1 1 1   22 35 o 31.68668 5.442861 13.15366       4.051431 13.53212       5.748115 12.78005       5.711240 31.25511 7.617445 30.33210 7.711043 0.9230061      10.83908 
1 1 1 1   22 36 o 17.43208 6.921465 2.750826       4.387617 2.046708       5.190102 4.514441       8.214008 17.68439 7.337246 22.36795 9.250867 -4.683554      11.80736 
1 1 1 1   22 37 o 35.77960 5.145063 16.99167       4.357198 23.57596       6.300777 10.95711       6.032023 41.34782 6.464813 27.06630 8.331027 14.28152       10.54513 
1 1 1 1   22 38 o 17.52258 6.642919 3.711015       3.900631 6.938439       5.525913 0.5058923      5.506788 21.94464 7.983405 16.24822 7.156440 5.696417       10.72145 
1 1 1 1   22 39 o 29.59044 6.383338 12.89280       4.467570 17.38089       7.360445 10.27484       5.621532 31.63775 9.075394 25.05683 8.087424 6.580921       12.15604 
1 1 1 1   22 40 o 13.01473 5.720582 0.3594115      3.502159 0.1350285      5.100911 0.5595022      4.816885 14.82272 6.682636 14.80415 6.597366 0.1857090E-01  9.390574 
1 1 1 1   22 41 o 20.90130 7.261628 7.414761       4.523474 -1.804812      8.805819 10.71972       5.272269 16.48126 7.864643 24.44473 7.826708 -7.963470      11.09549 
1 1 1 1   22 42 o 14.26028 6.025770 2.165507       3.599052 2.690486       5.413177 1.749578       4.818263 15.92118 7.050087 14.88074 6.616927 1.040448       9.668891 
1 1 1 1   22 43 o 18.33522 6.581563 6.060048       3.739970 3.807864       5.464221 8.045017       5.129834 16.07817 7.103129 19.72756 7.583827 -3.649391      10.39081 
1 1 1 1   22 44 o 17.38046 6.633379 5.768749       3.905656 6.813361       5.886015 4.946994       5.220534 17.61176 7.580795 16.31843 7.081760 1.293331       10.37400 
1 1 1 1   23 0  o 104.8230 3.445396 134.1171       8.789034 129.0929       10.57314 145.3521       15.81093 102.7917 4.229987 108.9462 5.978292 -6.154518      7.323440 
1 1 1 1   23 1  o 303.0609 5.588900 1121.126       41.27550 1207.754       52.63521 982.7833       66.51620 314.4059 6.869888 283.0759 9.656610 31.32993       11.85097 
1 1 1 1   23 2  o 525.6050 8.967939 3382.120       114.8652 3467.405       142.9479 3226.700       192.9717 531.5432 11.03579 510.7506 15.52219 20.79251       19.04539 
1 1 1 1   23 3  o 216.1982 3.437768 569.9316       18.11193 571.3552       28.31780 568.9461       23.56141 216.3560 5.370993 215.9571 4.477108 0.3988190      6.992286 
1 1 1 1   23 4  o 341.2189 6.130270 1422.010       50.97401 1360.048       60.59553 1571.989       94.27460 333.5128 7.455762 357.7050 10.82764 -24.19220      13.14634 
1 1 1 1   23 5  o 258.1650 4.313797 813.0836       27.13896 821.5157       38.17831 804.4705       38.58549 259.3470 6.040869 256.6290 6.169959 2.717987       8.634841 
1 1 1 1   23 6  o 500.5971 8.571731 3069.122       104.5666 3021.315       126.6636 3171.427       185.2915 496.0551 10.47818 505.9694 15.04450 -9.914337      18.33383 
1 1 1 1   23 7  o 380.9957 6.719761 1774.646       62.38929 1775.027       76.42825 1773.885       108.0126 380.7142 8.237942 379.4451 11.69521 1.269135       14.30530 
1 1 1 1   23 8  o 294.5996 5.526524 1060.073       39.67530 1004.911       66.78947 1090.153       49.32047 285.9697 9.597711 298.5656 6.778777 -12.59586      11.75023 
1 1 1 1   23 9  o 32.70462 7.171811 13.59937       5.558014 10.23384       8.585401 16.02748       7.292378 29.81069 10.01263 35.45337 8.542213 -5.642673      13.16139 
1 1 1 1   23 10 o 144.0743 3.778341 253.4285       13.25406 237.0822       22.91026 261.6516       16.24933 139.0293 6.782664 146.3279 4.562506 -7.298569      8.174411 
1 1 1 1   23 11 o 289.9631 5.463466 1027.536       38.60532 1019.574       67.22678 1031.453       47.15577 287.7822 9.599543 290.3025 6.665734 -2.520355      11.68688 
1 1 1 1   23 12 o 174.3082 4.027524 370.8546       17.10771 394.8216       31.21383 360.5638       20.45337 179.3735 7.155252 171.7320 4.892383 7.641449       8.667933 
1 1 1 1   23 13 o 227.0919 5.641362 630.6786       31.21920 0.000000       0.000000 630.6786       31.21920 ?        ?        227.0919 5.641362 0.000000       5.641362 
1 1 1 1   23 14 o 177.1548 4.048580 383.1656       17.47800 368.4375       30.13732 390.6295       21.45447 173.2023 7.155685 178.7177 4.930935 -5.515427      8.690107 
1 1 1 1   23 15 o 89.85769 3.177238 98.63563       6.946357 92.47844       10.06607 104.2334       9.597905 86.85969 4.773962 92.28148 4.279668 -5.421791      6.411418 
1 1 1 1   23 16 o 225.3212 4.002793 620.0084       21.97866 604.9810       30.94322 635.3094       31.22372 222.2388 5.718346 227.8327 5.623835 -5.593857      8.020411 
1 1 1 1   23 17 o 17.00953 5.603963 3.378132       2.692201 -1.432622      5.615966 4.813558       3.067667 16.52216 7.253767 19.73010 5.914489 -3.207943      9.359397 
1 1 1 1   23 18 o 56.27764 2.918077 38.74879       3.988255 48.42247       7.805583 35.33101       4.639604 62.69235 5.154714 53.67374 3.567425 9.018612       6.268779 
1 1 1 1   23 19 o 151.0766 2.879323 278.5203       10.60044 273.8287       17.48376 281.2474       13.32996 149.5215 4.804622 151.7495 3.604669 -2.228073      6.006499 
1 1 1 1   23 20 o 62.85843 2.987644 48.33610       4.563348 41.07345       7.654573 52.34048       5.683824 57.62851 5.517962 65.36134 3.582178 -7.732830      6.578747 
1 1 1 1   23 21 o 255.3659 3.831736 797.0712       23.84485 830.6168       39.42036 777.7150       29.94413 260.0176 6.221309 252.0014 4.876099 8.016129       7.904494 
1 1 1 1   23 22 o 67.22926 2.707093 55.25428       4.425972 52.96120       8.070677 56.24051       5.292863 65.53643 5.093449 67.78200 3.213503 -2.245567      6.022443 
1 1 1 1   23 23 o 179.2919 3.101467 392.6327       13.55077 389.7837       22.26009 394.3100       17.08013 178.1912 5.131653 179.5467 3.903711 -1.355545      6.447700 
1 1 1 1   23 24 o 32.75383 4.927595 13.44770       3.811349 4.111608       6.390986 18.60075       4.748075 22.03743 8.466660 38.59040 5.179637 -16.55297      9.925369 
1 1 1 1   23 25 o 78.98381 3.187330 76.37496       6.122211 74.72926       9.502498 77.54285       8.005036 77.84931 5.035973 79.45634 4.148639 -1.607033      6.524740 
1 1 1 1   23 26 o 66.61497 3.695189 54.49299       5.975024 56.13157       12.11270 53.96605       6.868893 66.80298 7.574122 66.20306 4.280622 0.5999222      8.700060 
1 1 1 1   23 27 o 63.82006 3.757952 50.07056       5.818595 54.15275       11.55065 48.68241       6.735640 65.59457 7.352461 62.81730 4.428491 2.777279       8.583136 
1 1 1 1   23 28 o 137.0477 3.263115 229.9683       10.89783 255.6767       16.71194 210.9483       14.37454 144.0317 4.767950 130.8921 4.513304 13.13960       6.565307 
1 1 1 1   23 29 o 102.6640 3.172264 129.2418       7.926878 121.5480       11.59333 135.9966       10.86289 99.14771 4.812697 105.0528 4.252066 -5.905083      6.422002 
1 1 1 1   23 30 o 16.49249 6.359644 2.301301       3.615201 5.789565       5.537041 -0.2906688     4.772962 22.64194 8.021089 15.78135 6.809961 6.860594       10.52205 
1 1 1 1   23 31 o 49.11864 3.849650 29.92314       4.571116 31.13220       7.065600 29.05282       5.994676 49.51324 5.976644 48.04719 5.202817 1.466049       7.923987 
1 1 1 1   23 32 o 41.91895 4.521498 22.09000       4.545815 21.53459       6.272136 22.70457       6.597722 40.72115 6.542134 41.77211 6.708493 -1.050964      9.370347 
1 1 1 1   23 33 o 35.93129 4.651302 16.40388       3.977240 16.08354       5.912733 16.66861       5.374979 34.64816 7.236619 35.60049 6.432293 -0.9523277     9.682099 
1 1 1 1   23 34 o 54.52224 3.686518 37.16675       4.869284 38.91906       7.223298 35.70722       6.592295 54.98459 5.463046 52.78399 5.192187 2.200603       7.536821 
1 1 1 1   23 35 o 25.99390 7.482826 9.445168       4.995448 8.231982       5.790306 12.97648       9.878841 24.51066 8.222683 29.68661 10.69159 -5.175955      13.48787 
1 1 1 1   23 36 o 52.73449 3.833723 35.31979       4.893002 36.26943       7.132020 34.47535       6.725371 52.20255 5.698860 51.03358 5.494302 1.168968       7.916082 
1 1 1 1   23 37 o 29.82660 5.991475 12.39847       4.203518 12.57184       6.118648 12.24350       5.784741 28.52420 8.302500 28.33394 8.018756 0.1902599      11.54261 
1 1 1 1   23 38 o 35.19044 5.672420 17.32761       4.699053 17.95597       7.913761 16.98541       5.840049 32.05968 9.472628 33.38930 7.374621 -1.329624      12.00482 
1 1 1 1   23 39 o 30.94785 5.585896 13.73421       4.057713 14.89340       5.956134 12.73023       5.543054 29.84543 8.019057 27.65923 7.856781 2.186201       11.22650 
1 1 1 1   23 40 o 19.45114 7.500686 6.034436       5.028928 0.000000       0.000000 6.034436       5.028928 ?        ?        19.45114 7.500686 0.000000       7.500686 
1 1 1 1   23 41 o 17.93384 6.882178 5.181619       4.219424 -9.154680      8.383057 10.04586       4.883052 13.70753 6.781641 23.52197 7.532378 -9.814443      10.13545 
1 1 1 1   23 42 o 12.04165 5.433804 0.1387196      3.381496 3.752037       5.134655 -2.628600      4.493532 16.22677 7.032715 11.74885 5.609619 4.477919       8.995938 
1 1 1 1   23 43 o 15.82636 6.296924 4.211727       3.638766 4.796698       5.626067 3.791057       4.770988 16.48467 7.248032 15.60208 6.770441 0.8825960      9.918308 
1 1 1 1   23 44 o 12.20891 5.545843 0.7076477      3.592756 -2.448013      5.330561 3.334396       4.863366 12.11386 5.865865 14.85430 6.623809 -2.740441      8.847780 
1 1 1 1   24 0  o 108.6638 3.036387 144.0842       8.032525 136.8834       10.97034 152.4064       11.79371 105.8338 4.262349 111.6769 4.341895 -5.843086      6.084379 
1 1 1 1   24 1  o 176.4516 4.016448 379.8311       17.27046 412.9060       30.58772 364.3523       20.92501 183.6331 6.847332 172.6909 4.977525 10.94218       8.465324 
1 1 1 1   24 2  o 168.4908 4.841166 346.8181       19.85691 336.3220       27.30428 358.6013       28.93002 165.7090 6.775878 171.0954 6.953127 -5.386368      9.708682 
1 1 1 1   24 3  o 182.3090 3.144127 405.2870       13.96832 430.8060       22.33330 388.8900       17.90201 187.7939 4.884320 178.5332 4.114781 9.260696       6.386549 
1 1 1 1   24 4  o 148.2003 3.216273 267.8382       11.61550 270.0385       16.16930 265.4920       16.69701 148.6824 4.467746 147.4084 4.653985 1.274033       6.451382 
1 1 1 1   24 5  o 359.9001 4.978166 1581.567       43.66037 1546.521       67.83080 1606.357       57.04950 355.3372 7.833397 362.4484 6.459064 -7.111237      10.15291 
1 1 1 1   24 6  o 260.1533 3.879129 825.7497       24.59233 829.4101       38.68257 823.2667       31.85958 260.4727 6.094205 259.6425 5.035333 0.8301697      7.905309 
1 1 1 1   24 7  o 218.4635 3.834951 582.3229       20.41620 640.3539       30.31969 534.1830       27.61517 228.9312 5.434802 209.0245 5.426027 19.90674       7.679768 
1 1 1 1   24 8  o 86.31365 2.725290 90.93191       5.725109 108.6995       9.013488 78.91598       7.412379 94.29817 3.931036 80.33172 3.797218 13.96645       5.465520 
1 1 1 1   24 9  o 46.15329 3.538203 26.14043       3.949091 30.61369       5.361497 20.83547       5.838684 49.87566 4.458206 40.83802 6.049682 9.037636       7.514935 
1 1 1 1   24 10 o 165.9860 5.055958 336.9539       20.42699 367.7770       30.17662 310.8855       27.75174 173.0999 7.169332 159.1239 7.175258 13.97607       10.14316 
1 1 1 1   24 11 o 246.6977 4.196035 743.0602       25.22553 817.4153       54.42395 722.7156       28.46815 257.7438 8.677314 243.2200 4.803124 14.52379       9.917953 
1 1 1 1   24 12 o 181.4567 3.994298 401.9762       17.66240 0.000000       0.000000 401.9762       17.66240 ?        ?        181.4567 3.994298 0.000000       3.994298 
1 1 1 1   24 13 o 180.1009 3.497401 395.8470       15.34961 376.2265       31.27115 402.0749       17.61810 174.9560 7.351021 181.4693 3.984004 -6.513275      8.361208 
1 1 1 1   24 14 o 136.1110 3.140698 226.0406       10.41731 233.7559       22.59491 223.9579       11.73945 137.9130 6.743539 135.4095 3.560734 2.503464       7.625886 
1 1 1 1   24 15 o 139.9548 2.854487 238.9531       9.735360 222.4504       15.83775 248.9756       12.34252 134.7968 4.829257 142.8123 3.546516 -8.015594      5.991618 
1 1 1 1   24 16 o 165.3117 3.322659 333.5692       13.38522 339.2871       20.34438 329.2048       17.77403 166.4581 5.021114 164.0513 4.450117 2.406769       6.709331 
1 1 1 1   24 17 o 55.74298 3.064060 38.03586       4.146197 44.00384       7.933232 35.79311       4.863256 59.68856 5.516488 54.00832 3.717818 5.680244       6.652353 
1 1 1 1   24 18 o 188.2361 3.523532 432.7333       16.16282 432.2809       24.00288 433.1087       21.86217 187.8000 5.249986 188.0758 4.773923 -0.2758026     7.095963 
1 1 1 1   24 19 o 72.20527 2.771537 63.71675       4.867640 64.50318       8.769237 63.36653       5.851963 72.40654 5.000618 71.95657 3.346463 0.4499741      6.017059 
1 1 1 1   24 20 o 66.79121 2.810250 54.54530       4.563824 53.90464       8.486147 54.80598       5.413311 66.10081 5.312980 66.90401 3.330754 -0.8031921     6.270700 
1 1 1 1   24 21 o 115.0174 2.696918 161.4653       7.559051 166.6225       13.13597 158.9122       9.242710 116.5540 4.634102 114.0048 3.330472 2.549149       5.706746 
1 1 1 1   24 22 o 119.6960 3.106406 175.1148       9.053294 178.4871       13.75951 172.5402       12.02221 120.6044 4.690643 118.6645 4.163907 1.939949       6.272181 
1 1 1 1   24 23 o 82.73529 3.102233 83.74624       6.243547 86.68353       9.926347 81.82348       8.031159 83.92778 4.874393 81.66076 4.048414 2.267021       6.336352 
1 1 1 1   24 24 o 112.8173 2.709195 155.4355       7.448211 170.2381       13.54104 149.0142       8.918586 117.6991 4.730736 110.3497 3.320342 7.349335       5.779666 
1 1 1 1   24 25 o 153.5907 3.260903 288.5016       12.20503 289.1446       26.83570 288.3340       13.70443 152.4927 7.242202 153.4714 3.664353 -0.9786987     8.116463 
1 1 1 1   24 26 o 62.24408 3.143601 47.50718       4.752841 44.92201       11.58006 48.03088       5.212073 59.42914 8.215556 62.54926 3.432576 -3.120121      8.903816 
1 1 1 1   24 27 o 59.73785 3.552126 43.88304       5.147646 50.50267       8.456088 39.98568       6.488397 63.71603 5.499875 56.80690 4.729935 6.909138       7.254027 
1 1 1 1   24 28 o 30.81501 5.508050 12.09512       3.984329 12.91953       6.619654 11.62679       4.989291 31.42727 8.458243 29.92808 6.971239 1.499191       10.96084 
1 1 1 1   24 29 f 20.83989 6.892516 5.235681       4.071308 4.458579       6.354506 5.776800       5.302601 22.04206 8.449061 22.45057 7.858118 -0.4085140     11.53849 
1 1 1 1   24 30 o 62.14657 3.459949 47.64352       5.219215 49.76448       8.208935 46.20440       6.761899 62.97601 5.401145 60.91434 4.589004 2.061672       7.087406 
1 1 1 1   24 31 o 65.14867 3.736798 52.58835       5.907662 55.39476       8.243790 49.62567       8.470201 66.38979 5.135428 62.63210 5.608902 3.757690       7.604762 
1 1 1 1   24 32 o 20.64530 6.315948 5.493633       3.473547 6.384010       5.456185 4.886843       4.504237 22.86409 7.973277 20.42980 7.234727 2.434294       10.76636 
1 1 1 1   24 33 o 19.40463 6.465805 4.721437       3.581158 9.073469       5.702026 1.886597       4.602008 25.87585 8.121870 17.08937 6.980367 8.786482       10.70936 
1 1 1 1   24 34 o 35.30576 4.997753 16.17880       4.179815 20.37620       6.116680 12.50170       5.725039 38.83372 6.705897 29.79154 7.796784 9.042173       10.28391 
1 1 1 1   24 35 o 23.81811 7.456542 7.971800       4.809247 5.782038       5.754518 13.04376       8.757870 21.56530 8.091963 29.15004 10.10538 -7.584740      12.94598 
1 1 1 1   24 36 o 50.95699 4.049107 33.39178       4.986728 31.38689       7.288890 35.15596       6.837345 47.56075 6.455419 51.13208 5.577620 -3.571331      8.531253 
1 1 1 1   24 37 o 59.83954 4.148317 46.68071       6.011731 60.11322       10.89665 40.80315       7.207967 64.16592 7.086639 54.62076 5.489615 9.545166       8.964170 
1 1 1 1   24 38 o 28.53496 5.886708 11.82097       3.957512 15.61766       5.850855 8.618943       5.373146 31.12338 7.745328 22.96429 7.917481 8.159098       11.07595 
1 1 1 1   24 39 o 13.14466 5.771306 0.4712323      3.555567 4.018796       5.329872 -2.373496      4.772787 17.83474 7.420515 12.88283 6.038740 4.951908       9.567154 
1 1 1 1   24 40 o 16.17598 6.539223 3.464397       3.989948 6.110527       8.266724 2.660766       4.555710 19.55382 8.682614 15.77106 6.726191 3.782757       10.98314 
1 1 1 1   24 41 o 15.40301 6.666224 2.749141       4.600245 1.721670       7.241417 3.444361       5.956620 16.20823 7.544824 16.56359 7.361673 -0.3553619     10.54128 
1 1 1 1   24 42 o 17.20893 6.458844 5.211644       3.666615 4.442342       5.892189 5.697807       4.684024 16.53132 7.335974 17.48946 7.079790 -0.9581337     10.19509 
1 1 1 1   24 43 o 13.10058 5.725864 1.789932       3.464572 -2.128156      5.241063 4.830886       4.617291 12.29275 5.918674 16.19428 6.833151 -3.901526      9.040059 
1 1 1 1   25 0  o 154.5756 3.789198 291.5269       14.27330 287.2665       17.16146 301.0869       25.70767 153.3242 4.598311 156.7154 6.747359 -3.391144      8.165251 
1 1 1 1   25 1  o 103.4864 3.487769 130.7877       8.783063 127.7906       10.46147 137.9457       16.16726 102.2386 4.207955 106.0187 6.285961 -3.780113      7.564403 
1 1 1 1   25 2  o 152.7094 3.742999 284.5281       13.92906 266.7442       16.46894 329.2182       26.10706 147.7399 4.579906 163.9078 6.549337 -16.16791      7.991830 
1 1 1 1   25 3  o 20.79135 6.044635 5.386503       3.244931 5.999032       4.640608 4.800471       4.539126 22.55628 7.353274 20.93445 7.274120 1.621836       10.34328 
1 1 1 1   25 4  o 102.8022 2.749116 128.9587       6.880844 118.4122       10.12559 138.0077       9.379186 98.40232 4.232485 106.2943 3.626230 -7.892014      5.573462 
1 1 1 1   25 5  o 169.7121 3.056687 351.2787       12.64154 382.2308       20.39219 331.9592       16.11075 176.8485 4.736063 164.9218 4.008682 11.92668       6.204823 
1 1 1 1   25 6  o 50.58644 3.807540 31.40410       4.659242 25.50194       5.946382 40.79008       7.498719 45.34842 5.492713 57.51775 5.413602 -12.16933      7.712132 
1 1 1 1   25 7  o 157.8856 2.957269 304.0266       11.37809 311.2924       17.86343 299.0665       14.75937 159.5858 4.598197 156.5384 3.869107 3.047440       6.009443 
1 1 1 1   25 8  o 117.9060 3.461054 169.7644       9.933678 167.6096       12.01191 174.4266       17.66858 117.0912 4.216588 119.2391 6.100887 -2.147827      7.416228 
1 1 1 1   25 9  o 142.5355 2.851852 247.7841       9.905722 242.6980       15.05932 251.6631       13.15134 140.9035 4.391145 143.5463 3.762848 -2.642715      5.782835 
1 1 1 1   25 10 o 148.0348 3.736413 267.6490       13.46814 0.000000       0.000000 267.6490       13.46814 ?        ?        148.0348 3.736413 0.000000       3.736413 
1 1 1 1   25 11 o 17.67791 6.404280 3.151978       3.551037 -7.611921      8.091421 5.719667       3.951949 17.04607 7.948376 21.68432 6.754934 -4.638248      10.43100 
1 1 1 1   25 12 o 62.12870 3.315110 47.23706       5.000935 29.39087       10.38554 52.62415       5.706026 48.05111 9.204314 65.56272 3.585061 -17.51162      9.877857 
1 1 1 1   25 13 o 137.8715 3.172373 231.9564       10.65847 261.4635       23.85859 224.5993       11.91335 145.8444 6.731189 135.5899 3.608751 10.25449       7.637538 
1 1 1 1   25 14 o 81.67806 3.090712 81.52518       6.140670 84.17874       13.93333 80.88554       6.840863 82.51043 6.995502 81.32629 3.459690 1.184135       7.804261 
1 1 1 1   25 15 o 208.4393 3.783288 530.6522       19.21698 531.1094       40.04892 530.5155       21.90326 207.5374 7.933390 208.3373 4.314252 -0.7999420     9.030584 
1 1 1 1   25 16 o 165.7682 3.044826 335.3812       12.29985 349.7278       20.73535 327.5926       15.27802 168.9555 5.041840 163.7522 3.828636 5.203308       6.330766 
1 1 1 1   25 17 o 83.61811 3.017946 85.45442       6.139528 87.11659       10.32470 84.54515       7.636339 84.19901 5.055207 83.09902 3.780876 1.099983       6.312697 
1 1 1 1   25 18 o 90.45452 2.743549 99.94048       6.040554 113.2186       11.14279 94.41434       7.188473 96.05141 4.775490 87.86005 3.363659 8.191360       5.841190 
1 1 1 1   25 19 o 228.3710 3.591713 637.2952       19.98843 649.0928       32.91406 630.4020       25.15916 229.8458 5.881197 226.9351 4.549445 2.910706       7.435451 
1 1 1 1   25 20 o 105.0804 3.099508 134.9667       7.928222 144.8181       12.49144 128.3211       10.25955 108.6275 4.730196 102.3324 4.122579 6.295036       6.274584 
1 1 1 1   25 21 o 40.61665 4.164126 20.40054       4.063291 19.51898       7.290732 20.79773       4.893786 39.02542 7.936911 40.88063 5.017467 -1.855213      9.389863 
1 1 1 1   25 22 o 78.51857 3.150057 75.45201       6.015121 75.58798       9.704767 75.36720       7.665006 78.30849 5.113549 78.36491 4.027299 -0.5641937E-01 6.509034 
1 1 1 1   25 23 o 76.77093 3.017491 72.12946       5.634198 44.32004       13.28637 78.22676       6.221270 58.76427 9.609906 79.93340 3.200321 -21.16913      10.12879 
1 1 1 1   25 24 o 135.2761 3.128111 223.7370       10.31191 219.0731       23.01231 224.9088       11.53482 132.7237 7.141310 135.5277 3.495499 -2.804047      7.950901 
1 1 1 1   25 25 o 77.06807 2.960261 72.72317       5.549225 71.70608       13.33548 72.93616       6.102694 75.59264 7.331182 77.14209 3.253646 -1.549454      8.020751 
1 1 1 1   25 26 o 26.59845 4.894899 8.982206       3.055876 11.56650       6.463025 8.238099       3.468029 29.91211 8.479397 25.32055 5.751871 4.591558       10.24618 
1 1 1 1   25 27 o 51.15382 3.205028 32.18111       3.975192 39.23742       7.845517 29.74384       4.610884 55.95507 5.839533 49.06055 3.888480 6.894516       7.015727 
1 1 1 1   25 28 o 61.78490 3.733783 47.09229       5.595460 46.79935       8.479679 47.31822       7.446887 61.07719 5.765460 61.63528 5.000957 -0.5580978     7.632175 
1 1 1 1   25 29 o 119.1749 3.199525 174.5502       9.283535 174.4260       13.88753 174.6505       12.48240 118.4902 4.819633 118.7914 4.319173 -0.3012085     6.471794 
1 1 1 1   25 30 o 56.50099 3.955895 39.66737       5.412330 29.53732       7.652423 49.80678       7.655958 47.78772 6.759732 62.98624 5.029655 -15.19852      8.425639 
1 1 1 1   25 31 o 46.49987 3.945948 27.01092       4.429172 26.48184       7.092072 27.34923       5.671116 45.04881 6.660865 46.41811 5.097313 -1.369301      8.387474 
1 1 1 1   25 32 o 25.46906 5.801794 8.598482       3.520198 6.453329       5.627195 9.977694       4.512096 22.85076 8.086972 27.18428 6.822725 -4.333521      10.58058 
1 1 1 1   25 33 o 21.48260 6.467268 6.170304       3.662123 3.556252       5.802725 7.900641       4.721066 19.83945 7.932471 24.06467 7.363535 -4.225227      10.82339 
1 1 1 1   25 34 o 28.94346 6.957254 11.72604       4.846195 11.71625       5.842298 11.74765       8.677092 28.44760 8.061144 28.14081 10.03372 0.3067894      12.87080 
1 1 1 1   25 35 o 12.80052 5.673609 -0.5371881     3.513946 -0.1294585     5.621232 -0.7987185     4.502009 16.20699 7.180082 14.21412 6.353282 1.992870       9.587376 
1 1 1 1   25 36 o 19.80514 6.982169 5.458134       4.191501 8.313626       7.735176 4.271145       4.987157 23.56693 9.241645 18.85131 7.412151 4.715620       11.84686 
1 1 1 1   25 37 o 12.59525 5.633735 -0.4426512     3.546771 -3.511012      5.028522 2.595075       5.003357 12.91418 6.098195 16.89680 7.120437 -3.982622      9.374892 
1 1 1 1   25 38 o 25.85921 6.258672 10.12998       3.901064 8.390959       5.925245 11.46054       5.182861 22.18783 8.233733 26.23911 7.642395 -4.051285      11.23390 
1 1 1 1   25 39 o 13.49691 5.849233 1.044970       3.551479 4.740587       5.543307 -1.528156      4.625472 18.19056 7.568023 12.99411 6.042344 5.196457       9.684260 
1 1 1 1   25 40 o 30.19396 7.529960 16.21217       5.521449 9.398016       9.124671 20.14861       6.935271 20.60591 9.137417 31.88987 8.689455 -11.28397      12.60948 
1 1 1 1   25 41 o 13.89391 5.926751 2.150056       3.538344 6.951600       5.603977 -1.033200      4.562907 18.66158 7.671705 12.56814 5.895457 6.093439       9.675302 
1 1 1 1   25 42 o 13.24053 5.933550 1.335931       3.954394 2.791077       7.617348 0.7991022      4.626671 15.80031 7.474387 13.40185 6.164855 2.398466       9.688751 
1 1 1 1   26 0  o 95.31139 3.594142 111.0026       8.332922 102.0337       13.36075 116.7124       10.66035 91.12655 6.050853 97.65930 4.491446 -6.532753      7.535643 
1 1 1 1   26 1  o 158.0260 3.322086 304.6476       12.79309 296.7502       17.58200 313.5331       18.64947 155.8051 4.635898 160.1373 4.784374 -4.332230      6.661965 
1 1 1 1   26 2  o 106.0862 3.542476 137.4733       9.145180 146.1838       11.12731 119.3437       16.05325 109.3462 4.183619 98.49180 6.728888 10.85442       7.923421 
1 1 1 1   26 3  o 138.2584 3.218255 233.1856       10.84297 240.1690       15.05206 225.6528       15.63298 140.1718 4.412050 135.8324 4.730047 4.339401       6.468348 
1 1 1 1   26 4  o 180.5412 3.531380 397.7277       15.53664 381.7902       21.13216 416.4775       22.92093 176.7002 4.912383 184.5333 5.101975 -7.833099      7.082489 
1 1 1 1   26 5  o 70.82233 2.903422 61.27835       5.000283 53.54019       7.283405 68.17707       6.877018 66.05165 4.552812 74.64305 3.793157 -8.591400      5.925887 
1 1 1 1   26 6  o 43.14480 3.767858 22.89249       3.921788 24.83836       5.822964 21.27706       5.305564 44.74208 5.453135 41.36987 5.390834 3.372211       7.667971 
1 1 1 1   26 7  o 128.0925 2.775079 200.1122       8.662341 201.8952       13.42258 198.8396       11.33990 128.5043 4.292319 127.5876 3.650996 0.9167480      5.635049 
1 1 1 1   26 8  o 50.55373 3.638602 31.35372       4.452550 28.91563       7.456830 32.70467       5.550707 48.15178 6.522408 51.55072 4.462430 -3.398941      7.902853 
1 1 1 1   26 9  o 78.33750 3.399367 75.03116       6.473943 74.47514       9.998509 75.43255       8.495172 77.85403 5.301723 78.45003 4.462081 -0.5959930     6.929534 
1 1 1 1   26 10 f 187.1957 4.234509 428.0697       19.31679 478.8500       35.35592 406.4617       23.06330 197.3412 7.364967 182.2180 5.199223 15.12325       9.015246 
1 1 1 1   26 11 o 125.3054 3.152877 191.7215       9.619839 203.0309       20.32297 188.4558       10.92077 128.5132 6.510595 124.1914 3.612328 4.321747       7.445587 
1 1 1 1   26 12 o 148.9942 3.281704 270.9498       11.91530 290.1996       25.49261 265.5689       13.47816 153.6113 6.827183 147.4209 3.754820 6.190338       7.791605 
1 1 1 1   26 13 o 150.2745 3.290288 275.6542       12.04912 242.4550       24.08289 286.7394       13.91608 140.3032 7.066518 153.2270 3.726881 -12.92386      7.989075 
1 1 1 1   26 14 o 106.0534 3.056680 137.3849       7.891458 119.5374       16.38637 142.7741       9.004417 98.39950 6.876956 108.0814 3.423077 -9.681862      7.681795 
1 1 1 1   26 15 o 123.6256 3.527276 186.8087       10.61549 168.5206       19.73097 194.2588       12.59344 116.8675 6.959692 125.9986 4.106987 -9.131096      8.081130 
1 1 1 1   26 16 o 91.31882 3.387027 101.9819       7.524226 133.0393       16.42640 93.73526       8.464431 103.8486 6.523875 87.48045 3.980983 16.36813       7.642590 
1 1 1 1   26 17 o 152.4560 3.364422 283.8940       12.49945 285.8840       18.60705 282.2576       16.87360 152.6824 5.007722 151.7923 4.566843 0.8901367      6.777414 
1 1 1 1   26 18 o 83.99375 3.230880 86.29420       6.600750 89.88685       10.52464 83.96481       8.474654 85.48904 5.074802 82.73722 4.217157 2.751823       6.598336 
1 1 1 1   26 19 o 58.95841 3.541244 42.63662       5.064439 44.29645       8.555345 41.74121       6.283690 59.74691 5.955289 58.21937 4.463086 1.527542       7.442083 
1 1 1 1   26 20 o 145.6400 3.323161 259.2104       11.79420 266.5649       17.86100 253.5241       15.70521 147.3382 4.981720 143.7902 4.487562 3.547974       6.704904 
1 1 1 1   26 21 o 27.28961 5.247934 9.450200       3.363249 4.844953       9.497097 10.11057       3.596310 25.78661 10.20078 28.21998 5.426596 -2.433369      11.55438 
1 1 1 1   26 22 o 73.94774 3.034806 66.93901       5.457179 67.81374       12.94345 66.74991       6.018234 73.62270 7.310920 73.80496 3.354939 -0.1822662     8.043952 
1 1 1 1   26 23 o 112.1348 3.054174 153.8309       8.338071 150.3960       19.68099 154.5823       9.204990 109.8022 7.398476 112.3600 3.365622 -2.557777      8.128030 
1 1 1 1   26 24 o 102.4491 2.982727 128.4502       7.438666 126.7658       16.97688 128.8504       8.275347 100.7998 6.953955 102.5557 3.315594 -1.755898      7.703938 
1 1 1 1   26 25 o 104.7608 2.753277 134.2846       7.022764 144.7972       12.78417 129.7411       8.404421 108.3160 4.855671 102.8667 3.357212 5.449234       5.903255 
1 1 1 1   26 26 o 50.59617 3.193833 31.48625       3.917817 28.52010       7.593568 32.56224       4.573548 47.35693 6.772631 51.37992 3.677091 -4.022991      7.706460 
1 1 1 1   26 27 o 78.45020 3.351969 75.66515       6.393343 75.08996       9.683234 76.10967       8.512574 77.68316 5.144113 78.40855 4.473707 -0.7253876     6.817327 
1 1 1 1   26 28 o 94.92817 3.151742 110.7692       7.280803 109.7044       11.27858 111.5299       9.533285 93.87130 4.947912 94.95709 4.129702 -1.085793      6.444864 
1 1 1 1   26 29 o 21.82440 5.797001 6.201804       3.134842 11.79859       6.347292 4.396179       3.605229 29.67844 8.399733 19.16962 6.488424 10.50882       10.61391 
1 1 1 1   26 30 o 43.94168 4.080935 24.17775       4.319971 18.85258       7.002297 27.45003       5.489070 37.37936 7.933046 46.57656 4.909883 -9.197201      9.329532 
1 1 1 1   26 31 o 13.85479 5.819655 0.5953645      3.325251 2.629310       5.880188 -0.3608679     4.031840 19.34724 7.895048 14.20948 6.194310 5.137766       10.03500 
1 1 1 1   26 32 o 22.36023 6.227948 6.724177       3.518856 7.573746       5.754879 6.216871       4.447052 23.92388 8.195864 21.78552 7.203487 2.138363       10.91157 
1 1 1 1   26 33 o 21.23784 7.575664 5.785432       4.946940 6.161197       5.913891 4.909799       9.027680 22.16140 8.225481 23.12635 9.642634 -0.9649525     12.67434 
1 1 1 1   26 34 o 13.71750 6.253312 -1.836934      4.619109 -3.830095      5.609815 2.359534       8.139905 14.07356 6.580685 20.35184 8.837433 -6.278279      11.01842 
1 1 1 1   26 35 o 19.41662 6.979135 5.093077       4.207048 7.619275       8.474312 4.266835       4.846457 23.37855 9.501115 18.82993 7.335176 4.548620       12.00317 
1 1 1 1   26 36 o 36.57856 4.826718 18.14128       4.197542 15.22421       6.086538 20.78698       5.796518 30.76095 8.033648 37.70168 6.546504 -6.940733      10.36321 
1 1 1 1   26 37 o 32.58027 5.517610 15.15529       4.224492 20.82780       6.425954 10.83766       5.606251 36.14634 7.539564 25.22498 8.070209 10.92136       11.04415 
1 1 1 1   26 38 o 20.94464 6.664671 7.020116       3.827578 4.785132       5.986395 8.565590       4.978048 18.53404 7.798232 22.30609 7.623174 -3.772043      10.90528 
1 1 1 1   26 39 o 20.88969 7.527585 7.894001       4.897838 6.885825       8.727531 8.357483       5.917519 19.64385 8.808116 20.90498 8.116006 -1.261133      11.97716 
1 1 1 1   26 40 o 16.52769 6.580041 4.374692       3.975727 6.571752       7.662619 3.565367       4.650696 18.48617 8.273829 15.93454 6.795932 2.551634       10.70705 
1 1 1 1   26 41 o 18.95213 6.494077 6.538736       3.613164 8.438842       5.798640 5.332773       4.619599 19.45707 7.876894 17.05418 6.983081 2.402891       10.52658 
1 1 1 1   26 42 o 11.77417 5.366059 0.2764498      3.398589 -3.631332      5.563231 2.603177       4.292740 11.97993 5.844333 14.25523 6.296891 -2.275303      8.591104 
1 1 1 1   27 0  o 174.5303 3.487122 371.7195       14.83113 371.6418       20.61211 371.8031       21.35645 174.3193 4.856960 174.3332 5.032311 -0.1390076E-01 6.993870 
1 1 1 1   27 1  o 137.8829 3.730769 232.2255       12.52408 233.9687       20.91437 231.2509       15.63792 138.0938 6.230959 137.4956 4.673969 0.5981445      7.789148 
1 1 1 1   27 2  o 71.50072 3.283347 62.50830       5.705615 58.88216       7.662095 67.02185       8.548379 69.27515 4.564154 73.90562 4.771971 -4.630470      6.603272 
1 1 1 1   27 3  o 151.0959 2.971484 278.4910       10.94113 286.9644       17.04747 272.5559       14.26728 153.1895 4.571735 149.3623 3.923198 3.827194       6.024305 
1 1 1 1   27 4  o 121.8674 2.804655 181.1489       8.329200 175.5107       12.61982 185.5007       11.08701 119.7917 4.330178 123.2200 3.696481 -3.428329      5.693366 
1 1 1 1   27 5  o 258.4990 4.349320 816.2897       27.39784 819.1567       53.62102 815.2767       31.87246 257.8669 8.544832 258.2200 5.065118 -0.3530884     9.933256 
1 1 1 1   27 6  o 56.57411 4.183384 39.30588       5.726618 45.38131       8.467979 34.18571       7.773800 60.61224 5.803833 52.46849 6.199529 8.143757       8.492270 
1 1 1 1   27 7  o 247.8575 4.236304 750.4908       25.58735 745.6668       35.74612 755.5597       36.64250 246.7477 5.944832 248.3555 6.054457 -1.607742      8.485133 
1 1 1 1   27 8  o 81.00147 3.085382 80.17536       6.079156 75.12049       7.997940 87.09141       9.355174 78.30290 4.206893 84.28904 4.571653 -5.986137      6.212726 
1 1 1 1   27 9  o 161.4117 3.802248 318.1687       14.95586 323.0815       18.39203 308.5789       25.69624 162.4965 4.649394 158.4522 6.669721 4.044281       8.130317 
1 1 1 1   27 10 o 15.31788 5.952130 1.781630       3.184887 3.478862       3.831637 -2.012136      5.728607 18.44843 6.656700 16.31155 7.236208 2.136883       9.832312 
1 1 1 1   27 11 o 175.3261 4.924389 376.3955       21.01865 389.5786       31.24588 365.4996       28.40631 177.8721 7.223594 172.3880 6.775141 5.484161       9.903678 
1 1 1 1   27 12 o 57.81185 4.348841 41.08996       6.081784 44.01966       11.09849 39.83267       7.270606 59.27526 7.878310 56.78794 5.315635 2.487324       9.503881 
1 1 1 1   27 13 o 75.51365 3.811821 69.84660       6.991772 52.85979       11.90643 78.78733       8.637977 65.07311 7.654572 80.14175 4.440359 -15.06863      8.849252 
1 1 1 1   27 14 o 188.1248 5.067320 433.7379       23.20944 475.1263       36.01432 404.3387       30.35318 196.2182 7.545883 181.1842 6.887146 15.03400       10.21632 
1 1 1 1   27 15 o 123.5335 3.667956 186.6353       11.02970 193.4000       20.34794 183.8206       13.12523 125.2189 6.692600 122.4968 4.404062 2.722130       8.011658 
1 1 1 1   27 16 o 93.29118 3.651950 106.5241       8.286322 73.91199       14.36832 122.7758       10.14299 76.99036 7.764271 100.1002 4.167216 -23.10983      8.811900 
1 1 1 1   27 17 o 111.4515 3.603114 151.9742       9.773020 169.3950       19.17998 145.8650       11.35810 117.0861 6.750749 109.0928 4.280724 7.993294       7.993573 
1 1 1 1   27 18 o 205.1306 3.785506 514.5972       18.92303 505.7267       39.35661 517.2645       21.58130 201.9152 8.014496 205.5500 4.308480 -3.634781      9.099184 
1 1 1 1   27 19 o 139.2093 3.203143 236.7995       10.86628 218.7282       22.86828 242.0696       12.34951 132.8766 7.087992 140.6508 3.606036 -7.774200      7.952555 
1 1 1 1   27 20 o 125.8290 3.123490 193.4885       9.577608 203.5374       21.47436 190.9933       10.70086 128.1435 6.902293 124.9164 3.518811 3.227066       7.747495 
1 1 1 1   27 21 o 15.45097 6.002858 1.852073       3.238994 0.2747101      8.959325 2.089227       3.473961 22.12583 9.434368 16.12172 6.229514 6.004107       11.30549 
1 1 1 1   27 22 o 152.8447 3.277479 285.7643       12.20749 318.7120       27.82123 277.9084       13.58512 160.0934 7.149303 150.6482 3.700524 9.445175       8.050243 
1 1 1 1   27 23 o 58.70197 3.102926 42.27187       4.422980 53.81239       9.082935 38.68473       5.063937 65.76933 5.724140 56.06216 3.727834 9.707165       6.830997 
1 1 1 1   27 24 o 81.31609 2.802294 80.96413       5.544683 85.41257       10.40184 79.19844       6.553341 83.04400 5.165609 80.33792 3.354771 2.706078       6.159383 
1 1 1 1   27 25 o 70.41772 2.879501 60.79668       4.930809 67.57440       9.380363 58.20889       5.796183 73.72933 5.255330 68.80298 3.468179 4.926353       6.296567 
1 1 1 1   27 26 o 28.39757 4.805157 10.23757       3.206773 10.73317       6.496767 10.07793       3.687252 28.74736 8.604786 27.99889 5.599898 0.7484722      10.26651 
1 1 1 1   27 27 o 16.30760 6.395142 2.078165       3.704110 7.061833       6.261748 -0.6044807     4.594123 24.43274 8.540184 15.18005 6.614861 9.252694       10.80237 
1 1 1 1   27 28 o 22.29330 5.492293 6.472153       2.964012 4.613008       5.932296 7.090679       3.421725 21.53567 8.185735 23.28652 5.994448 -1.750851      10.14592 
1 1 1 1   27 29 f 43.00894 3.541186 23.01809       3.678599 22.45795       7.155917 23.21927       4.288652 41.10386 7.416927 43.03535 4.140435 -1.931496      8.494352 
1 1 1 1   27 30 o 32.81262 4.217875 13.65955       3.294731 13.44446       6.577489 13.73159       3.806741 31.08208 8.459455 32.67021 4.935233 -1.588131      9.793819 
1 1 1 1   27 31 o 43.47738 3.472170 23.66692       3.648204 32.66238       7.270004 20.63927       4.217701 49.84258 6.113334 40.26529 4.368324 9.577286       7.513661 
1 1 1 1   27 32 o 43.44719 3.807306 23.89331       3.990327 9.497038       8.908872 27.50631       4.463048 26.43092 10.03485 46.56339 3.971104 -20.13247      10.79202 
1 1 1 1   27 33 o 31.76243 6.612883 14.12765       4.951869 10.55001       5.887455 22.77832       9.154902 26.64401 8.235784 37.82512 9.839911 -11.18110      12.83168 
1 1 1 1   27 34 o 20.28879 7.019501 5.733128       4.224863 4.438849       8.293500 6.186710       4.909668 21.25127 9.069711 21.03022 7.541842 0.2210522      11.79572 
1 1 1 1   27 35 o 20.00326 6.579764 5.822641       3.711947 9.667343       5.845701 3.225049       4.804970 24.45371 8.262177 17.44427 7.129853 7.009441       10.91322 
1 1 1 1   27 36 o 20.44623 6.615329 6.352221       3.759868 5.641884       5.906569 6.836138       4.875159 19.83551 7.978292 20.89132 7.512432 -1.055807      10.95855 
1 1 1 1   27 37 o 44.53262 4.343737 26.94162       4.654022 22.22099       6.902854 30.87585       6.301710 36.21785 8.031724 46.01810 5.744189 -9.800255      9.874426 
1 1 1 1   27 38 o 13.11298 5.946990 -0.1260945     4.111115 2.846242       5.491458 -3.916124      6.200975 16.44547 7.197788 13.48221 6.477614 2.963261       9.683370 
1 1 1 1   27 39 f 15.92417 6.552388 3.635334       4.092905 -9.555870      7.990692 8.327066       4.765503 13.02187 6.473137 20.98416 7.440575 -7.962294      9.862234 
1 1 1 1   27 40 o 27.79136 6.099277 12.81804       4.017097 10.72005       6.308705 14.24879       5.209795 21.34749 8.353551 27.02898 7.596108 -5.681494      11.29082 
1 1 1 1   27 41 o 15.27501 6.288949 3.803509       3.773299 4.142902       6.017561 3.583597       4.843893 15.95530 7.219594 15.32468 6.732098 0.6306219      9.871357 
1 1 1 1   28 0  o 139.9974 3.222135 239.1719       10.99259 234.6460       15.14087 244.2167       15.98520 138.4945 4.492178 141.2737 4.649568 -2.779175      6.465148 
1 1 1 1   28 1  o 204.2517 3.775318 509.3921       18.79123 506.2748       26.18851 512.7003       26.97874 203.3520 5.289262 204.6157 5.415374 -1.263672      7.569846 
1 1 1 1   28 2  o 426.7000 6.498340 2232.432       67.57113 2107.977       129.3280 2279.163       79.24816 410.6547 12.93963 430.6711 7.551050 -20.01645      14.98174 
1 1 1 1   28 3  f 309.8506 4.991724 1174.201       37.69112 1232.790       76.40095 1155.355       43.33108 315.5844 9.946945 307.1554 5.789022 8.428986       11.50889 
1 1 1 1   28 4  o 257.5992 4.358598 810.8858       27.36071 811.9899       53.59367 810.4966       31.81978 256.5645 8.584059 257.4048 5.072762 -0.8402100     9.970906 
1 1 1 1   28 5  o 77.29332 2.933564 72.99557       5.515498 71.22984       8.169207 74.47469       7.476876 76.21592 4.417363 77.98695 3.947086 -1.771027      5.923900 
1 1 1 1   28 6  o 196.5285 3.303676 471.4292       15.82192 439.7670       23.76577 496.6331       21.20388 189.5085 5.150982 201.5892 4.316304 -12.08070      6.720349 
1 1 1 1   28 7  f 236.6011 3.674984 683.6172       21.18890 713.4133       33.90627 664.5246       27.14145 241.3079 5.765970 233.0936 4.778224 8.214264       7.488513 
1 1 1 1   28 8  o 152.1932 2.951998 282.6478       10.94831 309.5690       17.54766 265.4883       14.00955 159.0513 4.531990 147.3673 3.904540 11.68401       5.982004 
1 1 1 1   28 9  o 182.6779 3.204079 407.3516       14.26347 395.1442       21.63865 416.7311       18.96746 179.6263 4.948095 184.6462 4.215340 -5.019928      6.500210 
1 1 1 1   28 10 o 78.65910 3.290597 75.67049       6.293605 78.20495       13.13463 74.91517       7.170345 79.48469 6.847766 78.21879 3.772902 1.265900       7.818356 
1 1 1 1   28 11 o 88.52063 3.203885 95.78967       6.899864 94.31671       14.04004 96.25869       7.922589 87.36456 6.644563 88.69183 3.673572 -1.327278      7.592453 
1 1 1 1   28 12 o 20.03004 6.916791 4.468604       4.101353 9.587963       7.564209 2.336885       4.881132 28.43421 9.394531 18.51357 7.316382 9.920639       11.90742 
1 1 1 1   28 13 o 246.7191 4.892006 745.4443       29.41209 0.000000       0.000000 745.4443       29.41209 ?        ?        246.7191 4.892006 0.000000       4.892006 
1 1 1 1   28 14 o 181.2698 3.584118 401.5152       15.83229 415.5379       33.29222 397.4171       17.99767 183.3877 7.465264 180.2632 4.097067 3.124512       8.515640 
1 1 1 1   28 15 o 124.6214 3.165087 189.7981       9.604237 213.0093       21.31334 183.8839       10.75845 131.3676 6.679670 122.6084 3.604667 8.759140       7.590232 
1 1 1 1   28 16 o 59.10392 3.479883 42.84007       4.989891 43.68654       11.36063 42.63773       5.554343 58.86141 8.137651 58.91615 3.890451 -0.5473709E-01 9.019811 
1 1 1 1   28 17 o 85.61477 3.123363 89.66399       6.505470 74.99532       14.32369 93.47614       7.302034 77.47659 7.687916 87.38254 3.435820 -9.905952      8.420743 
1 1 1 1   28 18 o 116.8480 3.121881 166.9517       8.881458 177.6855       20.14108 164.3607       9.895493 119.7297 6.932763 115.8830 3.508182 3.846680       7.769848 
1 1 1 1   28 19 o 80.55783 2.927551 79.39257       5.737538 72.02200       10.39293 82.62366       6.881163 76.29565 5.629526 82.11977 3.446231 -5.824112      6.600611 
1 1 1 1   28 20 o 115.2509 2.836942 162.2925       7.967661 176.3341       14.42084 156.1226       9.559211 119.6943 4.954741 112.9074 3.478417 6.786865       6.053829 
1 1 1 1   28 21 o 62.28658 3.407335 47.62193       5.152146 38.71885       13.37005 49.17454       5.583344 54.41935 10.46188 63.26475 3.636893 -8.845406      11.07600 
1 1 1 1   28 22 o 64.20130 3.070520 50.54292       4.789953 48.95903       9.089478 51.15189       5.636040 62.61692 6.031305 64.51169 3.599357 -1.894772      7.023675 
1 1 1 1   28 23 o 116.5909 2.815330 166.2829       7.998893 164.4086       13.95059 167.2008       9.763149 115.3482 4.974709 116.7504 3.435325 -1.402206      6.045593 
1 1 1 1   28 24 o 16.99541 5.880677 3.261917       2.965238 7.468643       6.721902 2.245516       3.304096 25.35544 8.849386 15.98926 6.101484 9.366180       10.74894 
1 1 1 1   28 25 o 46.39978 3.335732 26.56569       3.746583 40.68573       8.157909 22.79148       4.217685 56.80155 5.983398 42.81622 4.092036 13.98533       7.248849 
1 1 1 1   28 26 f 43.20310 3.693553 23.16086       3.851353 36.43888       7.534671 18.46464       4.480970 53.63799 5.859626 38.25213 4.920937 15.38585       7.651852 
1 1 1 1   28 27 o 13.20225 5.408675 0.8406115      2.773172 -6.422914      5.752300 3.039957       3.165297 13.62420 6.459766 16.77044 6.050389 -3.146246      8.850751 
1 1 1 1   28 28 o 47.69471 3.331080 28.21744       3.847271 31.02168       7.638965 27.26441       4.453299 48.83215 6.587214 46.71061 3.949254 2.121540       7.680365 
1 1 1 1   28 29 o 11.60853 5.072213 -0.4030852     2.716933 -1.609254      6.067939 -0.1006339     3.038539 16.48971 7.372764 12.59172 5.433559 3.897982       9.158669 
1 1 1 1   28 30 o 24.93653 5.232511 8.212162       3.078098 7.749579       6.290110 8.357815       3.529587 24.32272 8.555122 24.96109 5.897017 -0.6383743     10.39062 
1 1 1 1   28 31 o 20.12842 5.941888 5.441271       3.114974 3.210899       7.312657 5.935685       3.442960 20.70822 8.659706 20.95680 6.262012 -0.2485809     10.68659 
1 1 1 1   28 32 o 57.86287 3.726371 42.48121       5.226452 46.27840       7.968515 39.61444       6.923753 58.96789 5.612926 54.81957 5.246821 4.148319       7.683363 
1 1 1 1   28 33 o 21.34581 5.950947 6.410557       3.211182 3.102210       8.529296 6.956940       3.466222 20.63665 9.002541 22.14062 6.186513 -1.503967      10.92331 
1 1 1 1   28 34 o 14.78062 5.781296 2.314787       3.020575 -3.097146      5.756801 4.370748       3.548236 14.21626 6.653558 17.94952 6.414443 -3.733254      9.242019 
1 1 1 1   28 35 o 15.92009 6.329211 2.891669       3.673364 -3.800758      5.596172 7.958281       4.869205 13.44701 6.374509 22.31614 7.540587 -8.869123      9.873946 
1 1 1 1   28 36 o 35.01786 5.195183 17.37686       4.299081 12.94421       6.431638 20.95688       5.780062 26.51881 8.657509 36.94385 6.665477 -10.42504      10.92616 
1 1 1 1   28 37 o 16.77120 6.656466 3.975251       4.056571 1.408134       5.281703 7.667701       6.334442 15.40162 6.882952 20.54448 8.262649 -5.142864      10.75390 
1 1 1 1   28 38 o 22.48690 7.312689 9.248371       4.590996 3.726037       7.860437 12.10756       5.655971 17.51192 8.048167 24.68285 8.122148 -7.170931      11.43426 
1 1 1 1   28 39 o 14.02783 6.185354 1.799685       4.124444 -2.347611      7.854650 3.378529       4.846340 14.57267 7.071551 15.68087 6.814009 -1.108201      9.820262 
1 1 1 1   28 40 o 13.71465 5.888977 2.237813       3.535647 4.603200       5.797998 0.8374882      4.461094 16.35968 7.267482 13.31931 6.099669 3.040366       9.488007 
1 1 1 1   29 0  o 40.91212 5.144557 20.80343       5.015903 17.68434       7.732143 23.06971       6.590876 37.13039 8.698695 42.88548 6.510973 -5.755089      10.86555 
1 1 1 1   29 1  o 243.5085 4.876280 725.3980       28.93603 727.2283       49.31536 724.4371       35.73387 242.7405 8.349314 243.0893 6.032234 -0.3487244     10.30043 
1 1 1 1   29 2  o 332.5563 4.729116 1352.656       38.32492 1349.346       60.06993 1354.929       49.77055 331.2226 7.442194 332.4019 6.144306 -1.179260      9.650842 
1 1 1 1   29 3  f 59.55986 3.313005 43.43769       4.789578 43.43525       6.955858 43.43990       6.604745 59.39078 4.848279 59.42562 4.596562 -0.3484344E-01 6.680882 
1 1 1 1   29 4  o 360.8824 6.560312 1598.796       57.69342 0.000000       0.000000 1598.796       57.69342 ?        ?        360.8824 6.560312 0.000000       6.560312 
1 1 1 1   29 5  o 270.7318 4.534055 896.3464       29.91315 879.4870       41.39053 914.7800       43.27987 267.7050 6.344659 272.9734 6.506233 -5.268311      9.087671 
1 1 1 1   29 6  o 108.5628 3.276304 144.0167       8.657735 120.7339       16.03874 153.5907       10.28488 98.91827 6.693022 112.0654 3.771471 -13.14717      7.682482 
1 1 1 1   29 7  o 374.7208 5.198830 1719.570       47.47332 1686.425       73.79281 1742.974       62.00906 369.7113 8.190590 376.6078 6.756623 -6.896545      10.61780 
1 1 1 1   29 8  o 203.0352 3.379300 503.3924       16.71992 522.8549       26.42469 490.3980       21.59178 206.5350 5.254519 200.2400 4.424879 6.294983       6.869463 
1 1 1 1   29 9  o 130.8068 2.838888 208.8186       9.049295 192.0845       13.42483 222.7541       12.25086 125.2372 4.405716 134.9710 3.728262 -9.733795      5.771505 
1 1 1 1   29 10 o 54.59338 3.423248 36.54555       4.531301 26.16001       5.759164 53.42234       7.341588 45.91187 5.241309 65.91209 4.599628 -20.00021      6.973371 
1 1 1 1   29 11 o 52.95788 4.416169 34.55130       5.647351 20.09752       9.666459 42.04088       6.958341 39.43709 10.03518 58.38074 4.937273 -18.94365      11.18398 
1 1 1 1   29 12 o 152.2539 3.386412 283.1827       12.56447 253.2650       24.66857 293.6626       14.60017 143.1925 7.091546 154.9849 3.865738 -11.79240      8.076754 
1 1 1 1   29 13 o 74.56290 3.721245 68.13123       6.740195 59.43338       12.28459 71.87737       8.062062 69.00974 7.421399 76.51303 4.341708 -7.503296      8.598116 
1 1 1 1   29 14 o 33.53559 5.551131 14.16763       4.377956 6.467891       9.850931 16.06270       4.887104 27.35274 10.51084 35.70877 5.816166 -8.356028      12.01272 
1 1 1 1   29 15 o 84.08237 3.216666 86.50639       6.578778 97.82405       14.88271 83.75784       7.334246 88.77216 6.934687 82.68345 3.648982 6.088715       7.836132 
1 1 1 1   29 16 o 82.66232 3.196119 83.62551       6.426101 85.44697       14.16161 83.15321       7.211269 82.85779 7.081452 82.37934 3.600872 0.4784470      7.944385 
1 1 1 1   29 17 o 62.55252 3.427891 47.99252       5.205287 51.38234       12.11351 47.22484       5.764647 63.84772 7.957793 61.99701 3.834390 1.850708       8.833404 
1 1 1 1   29 18 o 59.48769 3.467368 43.43631       5.004682 54.37447       12.06194 41.16166       5.500496 65.74134 7.673211 57.84275 3.925522 7.898586       8.619042 
1 1 1 1   29 19 o 119.0608 3.535856 173.6580       10.24750 0.000000       0.000000 173.6580       10.24750 ?        ?        119.0608 3.535856 0.000000       3.535856 
1 1 1 1   29 20 o 75.33770 3.282116 69.59334       6.011172 67.71596       15.79257 69.91142       6.500488 72.81192 9.098536 75.47072 3.544429 -2.658798      9.764544 
1 1 1 1   29 21 o 38.51991 4.061923 18.41410       3.755540 19.78640       7.497535 17.95445       4.339140 39.02335 8.147667 37.89192 4.807210 1.131435       9.460114 
1 1 1 1   29 22 o 70.04152 2.988368 60.16475       5.088930 65.33060       9.742367 58.22635       5.967803 72.43108 5.562109 68.80582 3.571431 3.625259       6.610005 
1 1 1 1   29 23 f 33.32263 5.798726 14.18316       4.537841 11.66628       7.267549 15.79146       5.809503 30.00603 9.127171 34.88165 7.076728 -4.875612      11.54926 
1 1 1 1   29 24 o 65.29916 2.958561 52.38955       4.695638 60.51341       9.151544 49.48650       5.470667 69.52951 5.444577 63.34172 3.558477 6.187790       6.504320 
1 1 1 1   29 25 o 21.31267 5.768539 5.885437       3.068524 7.308704       6.332233 5.448648       3.507916 24.67686 8.590557 20.72234 6.348564 3.954523       10.68185 
1 1 1 1   29 26 o 41.86599 3.630804 21.80197       3.667663 16.80613       7.190734 23.55868       4.264019 35.20560 8.482444 43.41970 4.077641 -8.214096      9.411642 
1 1 1 1   29 27 o 34.38888 4.015111 14.88470       3.301499 17.57320       6.601448 13.98798       3.812541 36.06184 7.743357 33.07427 4.876432 2.987576       9.150911 
1 1 1 1   29 28 o 14.15357 5.660325 1.426701       2.955261 -3.849133      5.797181 3.279130       3.435121 14.78843 6.837690 17.24827 6.291484 -2.459842      9.291759 
1 1 1 1   29 29 o 14.02128 5.537466 1.584620       2.794426 -7.184208      5.733801 4.316194       3.200209 13.02372 6.249889 18.45663 6.111076 -5.432908      8.741073 
1 1 1 1   29 30 o 16.04063 6.024767 2.750173       3.191583 10.13887       7.346372 1.031178       3.543450 26.61319 9.253635 14.48472 6.040450 12.12847       11.05065 
1 1 1 1   29 31 o 30.58595 5.946612 12.80978       4.272619 13.91451       6.806496 12.09140       5.488737 30.19863 8.747092 28.73979 7.687383 1.458843       11.64506 
1 1 1 1   29 32 o 31.34198 4.502082 12.97173       3.339991 14.54165       6.441469 12.39444       3.906107 30.55260 8.394444 30.05706 5.536828 0.4955387      10.05600 
1 1 1 1   29 33 o 10.84849 4.927055 -1.089106      2.834282 -3.329335      5.618525 -0.3244433     3.282549 13.93590 6.538610 12.34719 5.477567 1.588711       8.529781 
1 1 1 1   29 34 o 22.30821 5.765750 7.257289       3.156990 9.950832       5.879188 6.165935       3.742297 24.31250 8.285016 20.26520 6.603113 4.047295       10.59446 
1 1 1 1   29 35 o 25.85798 6.267660 10.18208       3.907820 13.47595       6.250021 8.067858       5.007295 27.41975 8.487291 22.00561 7.640402 5.414146       11.41971 
1 1 1 1   29 36 o 26.64237 6.707406 11.46955       4.351197 12.79321       5.947996 9.945703       6.381939 26.14248 8.306881 22.71465 8.522014 3.427828       11.90080 
1 1 1 1   29 37 o 37.56861 4.964643 20.50017       4.434018 16.08230       6.534066 24.27110       6.036718 28.07795 8.675794 38.63221 6.652314 -10.55427      10.93264 
1 1 1 1   29 38 o 12.29853 5.668040 -0.4151668     3.937132 -4.376092      7.720710 0.9768221      4.576956 13.97011 6.830256 13.86318 6.282310 0.1069345      9.280077 
1 1 1 1   29 39 o 20.85905 6.694511 8.082882       3.855572 15.76271       6.409870 3.728966       4.826291 25.89976 8.650840 15.66816 6.804266 10.23159       11.00614 
1 1 1 1   30 0  o 76.05460 3.357102 70.76673       6.206614 65.32962       8.305676 77.64242       9.340047 72.92096 4.698990 79.50315 4.843893 -6.582191      6.748615 
1 1 1 1   30 1  o 124.4321 3.221198 189.1568       9.759340 199.4879       13.66268 178.3938       13.94524 127.6431 4.398979 120.6474 4.752504 6.995773       6.475903 
1 1 1 1   30 2  o 161.2356 3.444223 317.4847       13.53282 313.9471       18.58192 321.4802       19.74785 160.0971 4.768208 161.9643 5.009414 -1.867188      6.915926 
1 1 1 1   30 3  o 92.18875 2.890493 103.8235       6.485581 108.2885       9.745609 100.2742       8.689045 94.01033 4.265108 90.49422 3.949683 3.516113       5.813015 
1 1 1 1   30 4  o 40.01220 4.088960 19.77370       3.930961 16.27681       5.606889 23.15414       5.512742 35.83035 6.666764 43.14458 5.358428 -7.314224      8.553274 
1 1 1 1   30 5  o 101.9834 3.186203 127.1090       7.908717 100.1112       13.39953 141.5420       9.797232 90.09720 6.139668 107.5636 3.743385 -17.46638      7.190860 
1 1 1 1   30 6  o 208.5038 3.456398 531.0125       17.56199 524.1440       27.02722 536.0319       23.10440 206.7230 5.369628 209.3020 4.529865 -2.578995      7.025140 
1 1 1 1   30 7  o 205.4398 3.878886 515.8906       19.41903 593.6804       41.87934 494.5840       21.91771 219.1733 7.853780 201.0472 4.473639 18.12607       9.038546 
1 1 1 1   30 8  o 203.3914 3.770903 505.6070       18.69021 484.9795       25.63824 529.0024       27.30425 198.8322 5.296052 207.6388 5.400756 -8.806580      7.564148 
1 1 1 1   30 9  o 54.62260 3.593529 36.61543       4.756752 35.19337       6.279588 38.52995       7.286225 53.38213 4.881203 55.79154 5.427704 -2.409409      7.299734 
1 1 1 1   30 10 o 67.76507 3.036533 56.18487       5.001674 57.71261       7.312614 54.84186       6.856287 68.52812 4.402212 66.81700 4.232566 1.711121       6.106888 
1 1 1 1   30 11 o 223.8668 4.037416 613.0800       22.02568 636.3920       45.45537 605.9270       25.17912 226.5150 8.248555 222.4137 4.645610 4.101318       9.466804 
1 1 1 1   30 12 o 248.2755 4.306399 754.6416       26.05459 797.4392       54.56407 742.0012       29.65368 253.1386 8.858951 246.0009 4.946588 7.137634       10.14641 
1 1 1 1   30 13 o 150.3495 4.004171 276.8260       14.65763 301.1262       26.37848 265.9714       17.62995 156.0328 6.954894 147.1797 4.922418 8.853104       8.520608 
1 1 1 1   30 14 o 150.0446 3.390056 275.2294       12.39548 249.4632       24.74349 283.8622       14.32224 141.8547 7.181186 152.2556 3.863246 -10.40096      8.154391 
1 1 1 1   30 15 o 134.3813 3.730377 221.1493       12.20415 184.5258       21.19160 239.3231       14.92819 121.8944 7.165786 139.6635 4.391656 -17.76908      8.404471 
1 1 1 1   30 16 o 137.3738 3.300322 230.7657       11.04832 235.1273       23.46967 229.5240       12.52265 137.6305 7.020911 136.8804 3.757769 0.7500916      7.963292 
1 1 1 1   30 17 o 47.93245 3.996193 28.34563       4.625370 13.44473       9.602943 32.84689       5.277950 32.85211 10.56725 51.58566 4.235837 -18.73355      11.38460 
1 1 1 1   30 18 o 164.2299 3.926767 330.6608       15.71533 0.000000       0.000000 330.6608       15.71533 ?        ?        164.2299 3.926767 0.000000       3.926767 
1 1 1 1   30 19 o 160.5701 3.447843 315.8059       13.49112 282.2838       27.34278 326.5930       15.51063 150.1755 7.495181 163.1695 3.900806 -12.99400      8.449498 
1 1 1 1   30 20 o 10.67611 5.023914 -3.596414      3.359809 1.724055       8.470412 -4.589791      3.660047 22.32092 9.326052 10.75000 5.113019 11.57093       10.63570 
1 1 1 1   30 21 o 15.76456 6.108416 2.017365       3.347099 -1.353760      8.006681 2.731244       3.684490 19.77361 8.671826 17.14913 6.466353 2.624477       10.81732 
1 1 1 1   30 22 o 14.06670 6.154747 -0.7537037     4.012473 7.123012       6.648326 -5.266632      5.032329 24.87398 8.791335 13.03966 6.139975 11.83432       10.72319 
1 1 1 1   30 23 o 85.89017 3.310920 90.79072       6.916943 87.05858       10.79948 93.38667       9.006816 83.44043 5.339182 86.82681 4.269877 -3.386383      6.836573 
1 1 1 1   30 24 o 105.2568 3.078192 136.2871       7.887062 137.0191       12.65691 135.8224       10.08436 104.7438 4.972850 104.7530 3.957560 -0.9223938E-02 6.355433 
1 1 1 1   30 25 o 92.82462 2.815249 105.9882       6.360832 106.5529       11.30232 105.7264       7.695177 92.11319 5.054489 92.50251 3.419615 -0.3893204     6.102591 
1 1 1 1   30 26 o 38.25410 3.790572 18.33258       3.487194 16.42713       6.936629 18.97701       4.034011 34.55217 8.335151 38.76440 4.345084 -4.212231      9.399707 
1 1 1 1   30 27 o 38.57183 3.810711 18.70720       3.535141 20.71454       7.134710 18.05404       4.069851 38.87476 7.802804 37.64939 4.526617 1.225372       9.020754 
1 1 1 1   30 28 o 12.94491 5.310169 0.9156168      2.677495 2.634650       5.646290 0.4169155      3.041174 18.84472 7.718652 13.05147 5.528167 5.793249       9.494115 
1 1 1 1   30 29 o 22.12378 6.507755 6.710176       3.742073 16.11719       5.852922 0.2062669      4.866693 33.86057 7.307784 15.70348 6.826023 18.15709       9.999914 
1 1 1 1   30 30 o 18.17166 6.902168 3.800401       4.215893 19.69121       9.827667 0.2165686      4.667145 34.29455 10.64731 15.26097 6.658385 19.03357       12.55783 
1 1 1 1   30 31 o 48.93123 3.379324 30.41496       4.004758 31.99811       7.348728 29.74618       4.776312 47.74341 6.483693 47.91127 4.131211 -0.1678543     7.687989 
1 1 1 1   30 32 o 13.25122 5.467031 1.253679       2.859303 -0.5062482     5.309579 1.972528       3.393372 15.12445 6.818373 14.80756 6.014323 0.3168840      9.091880 
1 1 1 1   30 33 o 16.21603 5.791818 3.515196       2.892442 4.302885       5.220742 3.166335       3.474415 18.47928 7.476601 16.12468 6.230119 2.354593       9.732109 
1 1 1 1   30 34 o 10.59144 5.008333 -2.763810      3.413760 5.439723       5.535224 -7.799485      4.336742 19.26749 7.732565 9.914770 4.900192 9.352724       9.154477 
1 1 1 1   30 35 o 13.96196 6.027216 1.326152       3.741663 -0.1735585     5.150662 3.001907       5.444584 14.37488 6.572167 16.74994 7.250692 -2.375063      9.786006 
1 1 1 1   30 36 o 38.59803 4.007111 20.41286       3.714274 16.60020       6.652041 22.14002       4.477215 28.60609 8.738241 39.34651 4.766518 -10.74042      9.953721 
1 1 1 1   30 37 o 14.00955 5.853192 2.305643       3.336329 17.56964       8.670815 -0.3469681     3.614619 25.17628 9.810214 11.99011 5.490808 13.18617       11.24230 
1 1 1 1   30 38 o 12.92113 5.506180 1.703016       3.048500 1.028941       5.537673 1.996123       3.651624 14.35317 6.652650 13.70741 5.935816 0.6457596      8.915810 
1 1 1 1   31 0  o 97.42480 3.403087 116.0784       8.066986 126.6926       15.13961 111.8700       9.533008 101.3750 6.157450 95.55937 4.103304 5.815582       7.399412 
1 1 1 1   31 1  o 89.71062 3.815253 98.54449       8.321671 100.6283       13.89586 97.37929       10.39100 90.26705 6.357803 89.04914 4.806220 1.217911       7.970032 
1 1 1 1   31 2  o 89.49599 2.994757 97.89071       6.522127 111.2339       10.02841 88.10979       8.586019 95.25548 4.331556 84.77604 4.168853 10.47944       6.011798 
1 1 1 1   31 3  o 171.9585 3.181410 361.0915       13.33151 329.9877       19.69482 387.3959       18.11172 164.0579 4.931875 177.9692 4.176176 -13.91129      6.462495 
1 1 1 1   31 4  o 53.07717 3.559472 34.57597       4.577322 29.99804       6.443989 39.23818       6.503037 49.15776 5.471950 56.40641 4.775830 -7.248642      7.262974 
1 1 1 1   31 5  o 144.3453 3.319648 254.5078       11.67699 236.7561       15.61240 277.0459       17.59172 138.9824 4.616117 150.3187 4.808596 -11.33633      6.665668 
1 1 1 1   31 6  o 133.8495 3.250696 218.8328       10.60301 236.1182       14.97319 201.4466       15.01675 138.8187 4.431871 128.1444 4.817415 10.67429       6.545912 
1 1 1 1   31 7  o 167.1439 3.486803 341.3932       14.20214 324.4071       26.07048 348.5613       16.93570 162.1904 6.609955 168.7925 4.117313 -6.602036      7.787411 
1 1 1 1   31 8  o 124.5302 2.894986 189.3464       8.785316 199.8351       13.63332 181.8979       11.48876 127.6871 4.387977 121.8958 3.872571 5.791237       5.852448 
1 1 1 1   31 9  o 214.1049 3.496544 560.3087       18.24323 562.3500       28.42403 558.8788       23.78977 213.9444 5.456361 213.5937 4.570522 0.3507385      7.117692 
1 1 1 1   31 10 o 89.35093 2.878224 97.59325       6.258825 111.0842       9.610097 87.65589       8.247875 95.17201 4.153646 84.54041 4.014990 10.63161       5.776930 
1 1 1 1   31 11 o 219.1260 4.016057 587.7296       21.44520 589.2288       43.39291 587.2451       24.66829 217.6971 8.194188 218.8731 4.624988 -1.176010      9.409316 
1 1 1 1   31 12 o 136.2839 3.346675 227.0668       11.11461 218.5592       22.14913 229.9301       12.84957 132.8244 6.866243 137.0126 3.852329 -4.188126      7.873102 
1 1 1 1   31 13 o 94.21930 3.338639 108.6792       7.653471 96.46663       15.24500 112.7944       8.849485 87.99126 7.171854 95.92342 3.793276 -7.932159      8.113225 
1 1 1 1   31 14 o 65.61567 3.647810 52.85256       5.809827 54.31177       12.17289 52.42211       6.611441 65.68128 7.754637 65.27125 4.178545 0.4100342      8.808782 
1 1 1 1   31 15 o 81.46796 3.327471 81.32725       6.592077 95.17675       14.70037 77.84128       7.375186 87.35385 6.963339 79.62903 3.811785 7.724823       7.938375 
1 1 1 1   31 16 o 173.6644 4.838348 371.1886       20.45599 0.000000       0.000000 371.1886       20.45599 ?        ?        173.6644 4.838348 0.000000       4.838348 
1 1 1 1   31 17 o 17.45996 6.835386 2.313194       4.225586 0.000000       0.000000 2.313194       4.225586 ?        ?        17.45996 6.835386 0.000000       6.835386 
1 1 1 1   31 18 o 115.6369 3.191993 163.8616       8.986257 177.5058       19.95517 160.3908       10.06451 119.1364 6.903015 114.3122 3.617520 4.824211       7.793463 
1 1 1 1   31 19 o 78.25430 3.273163 75.18365       6.228049 74.38975       13.58136 75.39506       7.008386 76.68067 7.358306 78.28563 3.684001 -1.604958      8.229006 
1 1 1 1   31 20 o 67.18638 3.399138 55.53952       5.547186 58.39869       12.85147 54.88485       6.149556 67.48406 7.968243 66.70775 3.798658 0.7763138      8.827383 
1 1 1 1   31 21 o 83.70695 3.209535 86.14230       6.534832 85.08764       14.27552 86.42190       7.350161 81.72735 7.242752 83.74426 3.610165 -2.016907      8.092635 
1 1 1 1   31 22 o 23.12067 6.932661 6.880070       4.214361 19.84189       8.538871 2.705880       4.845667 38.26788 9.258099 18.51895 7.298671 19.74893       11.78910 
1 1 1 1   31 23 f 92.40439 2.889429 105.0005       6.498402 120.0502       11.88186 98.57762       7.762196 97.93652 4.995055 89.31324 3.573636 8.623276       6.141779 
1 1 1 1   31 24 o 65.48843 3.032794 52.92972       4.826837 58.93710       9.038245 50.53276       5.709156 68.15643 5.488147 63.79035 3.688389 4.366074       6.612410 
1 1 1 1   31 25 o 56.13405 3.114645 39.02732       4.243899 39.16253       7.858440 38.97165       5.042434 55.07885 5.949130 55.90067 3.722795 -0.8218155     7.017931 
1 1 1 1   31 26 o 80.27006 2.865242 79.67410       5.595692 92.63557       10.43727 74.44579       6.628884 85.28120 5.044777 77.29585 3.528541 7.985344       6.156328 
1 1 1 1   31 27 o 30.00623 4.630562 11.66257       3.277124 10.75404       6.442976 11.97964       3.806262 27.48133 8.634534 30.12536 5.382319 -2.644028      10.17470 
1 1 1 1   31 28 f 29.18404 5.725962 11.49262       3.926694 14.19903       5.883935 9.319382       5.272595 31.41971 7.736918 25.53566 7.775547 5.884047       10.96900 
1 1 1 1   31 29 o 15.13351 6.410287 1.052790       4.089414 -1.521430      8.773726 1.767246       4.622200 18.81334 8.592392 16.47240 6.886322 2.340939       11.01139 
1 1 1 1   31 30 o 34.34774 4.130122 15.39115       3.387706 19.92058       6.398355 13.62680       3.993373 36.73475 7.403569 31.59422 5.379333 5.140530       9.151505 
1 1 1 1   31 31 o 27.70989 5.070128 10.56443       3.297529 9.573932       5.883575 11.01805       3.981661 24.38647 8.288479 27.65596 6.074471 -3.269493      10.27609 
1 1 1 1   31 32 o 28.47916 4.899933 11.19286       3.277966 12.22821       6.058947 10.76441       3.897633 26.86020 8.363486 27.10860 6.053287 -0.2483959     10.32425 
1 1 1 1   31 33 o 17.24119 6.416152 4.164090       3.602787 2.691346       5.738377 5.122354       4.628797 17.14680 7.433052 18.70713 7.200735 -1.560337      10.34895 
1 1 1 1   31 34 o 13.19869 5.866013 0.3616098      3.781879 0.5762564      5.319503 0.1422373      5.377743 15.01549 6.791763 14.80420 6.748167 0.2112875      9.574226 
1 1 1 1   31 35 o 15.42183 5.902800 3.358144       3.098537 1.183003       5.924353 4.177195       3.635406 15.48699 7.068387 16.64102 6.387623 -1.154021      9.527004 
1 1 1 1   31 36 o 13.55716 5.725656 1.913340       3.246689 7.296923       7.657399 0.7334138      3.584867 18.98605 8.397251 12.81164 5.701558 6.174407       10.14995 
1 1 1 1   31 37 o 17.02852 6.316489 4.981405       3.486422 15.75735       9.389729 3.258213       3.754847 22.34930 9.596784 15.03540 6.239726 7.313909       11.44694 
1 1 1 1   32 0  o 249.9353 3.902139 764.0024       23.76657 785.1631       37.34195 749.5942       30.81318 252.7027 6.063885 247.2345 5.114362 5.468262       7.932679 
1 1 1 1   32 1  o 58.10727 3.792154 41.46082       5.340394 47.92968       7.269514 33.87674       7.871239 62.35644 4.821388 52.09970 6.329404 10.25674       7.956579 
1 1 1 1   32 2  o 152.5065 3.419576 284.2188       12.70857 286.7303       17.54838 281.4489       18.42922 152.9063 4.715142 151.4290 5.001013 1.477325       6.873333 
1 1 1 1   32 3  o 44.10559 5.352363 24.21662       5.635153 24.74743       8.222188 23.74644       7.738414 44.07159 7.948192 43.21741 7.626498 0.8541756      11.01532 
1 1 1 1   32 4  o 63.77498 4.342935 50.02554       6.709200 55.36178       11.11483 46.96665       8.415244 66.64590 6.945533 61.57653 5.671780 5.069363       8.967134 
1 1 1 1   32 5  o 97.86470 3.350096 117.1777       7.977717 102.2295       14.98057 123.0951       9.425399 90.79641 6.820396 100.2409 3.865746 -9.444527      7.839757 
1 1 1 1   32 6  o 111.9139 2.909679 153.0594       7.928601 140.7195       11.64461 163.7246       10.82560 107.0852 4.472153 115.6239 3.847454 -8.538788      5.899411 
1 1 1 1   32 7  o 23.47641 6.148986 7.033859       3.558982 6.687265       4.710591 7.494843       5.432594 23.39858 7.387233 24.83377 7.944150 -1.435186      10.84808 
1 1 1 1   32 8  o 151.3274 3.363948 279.9440       12.40518 268.9139       22.78041 284.5936       14.79051 147.5645 6.349816 152.4266 3.985281 -4.862137      7.496841 
1 1 1 1   32 9  o 118.0333 2.918294 170.1870       8.394013 171.5865       12.52797 169.0469       11.30748 118.2537 4.354840 117.4460 3.956508 0.8077240      5.883757 
1 1 1 1   32 10 o 41.28598 3.990494 21.06358       3.964830 29.16520       5.680530 13.36765       5.536478 48.50705 4.871482 32.24227 7.225770 16.26478       8.714534 
1 1 1 1   32 11 o 29.84071 6.319525 11.39705       4.452224 18.48371       9.266109 9.269900       5.076634 37.66663 9.948687 26.93272 7.472670 10.73392       12.44255 
1 1 1 1   32 12 o 37.79179 5.168433 17.88083       4.635261 25.61143       9.702524 15.59468       5.276320 44.41077 9.265357 34.99484 6.423810 9.415932       11.27440 
1 1 1 1   32 13 o 52.86622 4.135306 34.47956       5.285118 50.98399       11.21941 29.77264       5.991543 63.63600 7.371032 48.93401 5.099211 14.70199       8.962927 
1 1 1 1   32 14 o 154.2719 3.950924 292.0301       14.84103 0.000000       0.000000 292.0301       14.84103 ?        ?        154.2719 3.950924 0.000000       3.950924 
1 1 1 1   32 15 o 115.1758 3.745272 162.8120       10.49792 0.000000       0.000000 162.8120       10.49792 ?        ?        115.1758 3.745272 0.000000       3.745272 
1 1 1 1   32 16 o 179.2726 3.632931 394.1338       15.87111 432.8552       34.15722 383.4720       17.92342 185.7466 7.561965 176.6527 4.163557 9.093811       8.632410 
1 1 1 1   32 17 o 57.37010 3.783337 40.58939       5.259758 30.63880       10.58882 43.84880       6.060281 48.28090 9.337605 59.55754 4.202595 -11.27664      10.23976 
1 1 1 1   32 18 o 36.42139 4.878747 16.67864       4.221322 27.38941       9.964083 14.33573       4.660200 45.47798 9.304732 33.47147 5.930449 12.00651       11.03396 
1 1 1 1   32 19 o 29.11243 7.183875 11.11214       5.064864 9.226789       9.119544 11.95307       6.090558 28.33579 10.26343 30.10472 8.117907 -1.768934      13.08581 
1 1 1 1   32 20 o 99.50018 3.203105 121.7652       7.756485 112.3268       16.05963 124.6367       8.858166 93.87919 7.071879 100.5379 3.621496 -6.658714      7.945231 
1 1 1 1   32 21 o 18.30026 6.514457 3.737142       3.656265 6.730461       8.100293 2.971243       4.097414 25.26817 9.574345 17.83366 6.797191 7.434513       11.74180 
1 1 1 1   32 22 o 54.68598 3.602156 37.10730       4.773637 39.54816       10.36924 36.45087       5.377355 54.62635 8.028847 54.05054 4.113452 0.5758133      9.021246 
1 1 1 1   32 23 o 39.04859 4.168991 19.19274       3.905798 10.27312       8.418836 21.63912       4.409002 28.12413 9.897015 41.40279 4.439160 -13.27866      10.84698 
1 1 1 1   32 24 o 12.23420 5.278543 -0.1010083     2.866853 -2.764038      5.831462 0.7477500      3.292164 15.44171 7.034245 13.94678 5.819697 1.494935       9.129594 
1 1 1 1   32 25 o 83.75820 2.894037 86.84853       5.898132 82.36703       10.21443 89.09023       7.224214 80.12750 5.260232 84.51870 3.515206 -4.391197      6.326667 
1 1 1 1   32 26 o 38.06766 5.554433 19.10760       5.000919 22.07915       8.900768 17.73682       6.045325 38.38706 9.553169 35.78315 7.182607 2.603905       11.95211 
1 1 1 1   32 27 o 18.43209 6.511162 4.267706       3.646486 7.137821       5.389897 1.845262       4.951739 22.80466 7.926406 17.07247 7.131677 5.732191       10.66249 
1 1 1 1   32 28 o 16.42163 6.057471 3.179571       3.198436 -9.824480      8.557623 5.291083       3.448344 15.35633 7.435081 19.65821 6.333188 -4.301877      9.766765 
1 1 1 1   32 29 o 36.85629 3.940167 17.62317       3.484014 15.73164       6.277783 18.46506       4.188187 31.88084 8.073454 37.26296 4.717828 -5.382118      9.350859 
1 1 1 1   32 30 o 14.42026 5.681422 2.130784       2.935301 -1.612565      5.510394 3.613771       3.468336 14.66132 6.738246 16.85420 6.290743 -2.192878      9.218319 
1 1 1 1   32 31 o 37.19305 4.032668 18.30072       3.596611 23.20226       6.742623 16.35145       4.252046 38.64862 7.428930 34.22765 5.266384 4.420967       9.106251 
1 1 1 1   32 32 o 33.22098 5.843828 16.14114       4.558271 19.19801       6.277391 12.73144       6.629772 34.22638 7.711800 26.27461 8.798362 7.951767       11.69970 
1 1 1 1   32 33 o 16.80246 6.460785 4.019709       3.723615 7.010976       5.679765 1.764956       4.931194 20.22779 7.923033 15.47892 6.796410 4.748878       10.43866 
1 1 1 1   32 34 o 27.88811 5.320043 11.58660       3.483626 20.37721       6.813715 8.475590       4.053452 32.70654 8.479308 22.28593 6.823777 10.42061       10.88405 
1 1 1 1   32 35 o 12.28787 5.423038 0.6660284      3.177228 9.724583       8.632728 -0.7532669     3.417079 20.28150 8.945477 11.47763 5.286363 8.803878       10.39073 
1 1 1 1   32 36 o 9.313445 4.500363 -3.251426      3.096570 0.8633863      8.287450 -3.919117      3.338363 15.77465 7.555100 9.395823 4.571055 6.378823       8.830293 
1 1 1 1   33 0  o 30.33603 6.491890 11.77385       4.654187 17.78288       5.455608 -4.291449      8.920423 37.51919 6.182093 19.61008 8.839432 17.90911       10.78674 
1 1 1 1   33 1  f 211.7019 3.964704 548.5786       20.45368 515.4752       27.32229 590.7812       30.84959 204.7190 5.481684 219.0578 5.784085 -14.33888      7.968971 
1 1 1 1   33 2  o 44.43283 4.136267 24.38193       4.427227 29.51577       6.338916 19.49283       6.185974 48.71405 5.432118 39.20968 6.715505 9.504372       8.637471 
1 1 1 1   33 3  o 149.3446 3.098439 272.5337       11.27635 283.2601       17.18967 264.4309       14.94022 151.9160 4.648784 146.8788 4.178337 5.037216       6.250575 
1 1 1 1   33 4  o 41.30677 4.720655 21.19577       4.666588 22.50269       6.266266 19.56843       6.992384 42.28432 6.270997 39.09483 7.613451 3.189491       9.863571 
1 1 1 1   33 5  o 104.5472 3.223696 133.7277       8.203203 141.5238       11.30001 125.0416       11.92758 107.3799 4.327233 100.8226 4.869045 6.557243       6.514027 
1 1 1 1   33 6  o 111.2561 3.214976 151.4339       8.707266 154.4453       12.08960 148.1882       12.55124 112.1537 4.432190 109.8017 4.701623 2.351959       6.461391 
1 1 1 1   33 7  o 103.6690 3.917508 131.7883       9.879001 148.5312       17.35617 123.7644       12.01526 109.4642 6.536241 100.2702 4.932420 9.193993       8.188480 
1 1 1 1   33 8  f 190.2619 3.783906 443.2263       17.54399 474.4422       36.29634 433.7101       20.04054 195.2518 7.643134 188.0550 4.373089 7.196747       8.805760 
1 1 1 1   33 9  o 98.66385 3.415864 119.2506       8.200477 90.50961       15.04677 131.3943       9.780674 85.07008 7.329629 103.4916 3.885074 -18.42153      8.295617 
1 1 1 1   33 10 o 52.00013 4.220884 33.38433       5.302697 46.79227       10.62043 28.93187       6.120142 60.94746 7.295497 48.19054 5.298838 12.75693       9.016761 
1 1 1 1   33 11 o 78.19273 3.508256 75.01647       6.667858 75.37099       13.60348 74.90437       7.649842 77.50159 7.288385 78.04700 4.035876 -0.5454102     8.331198 
1 1 1 1   33 12 o 19.99240 7.092300 4.348784       4.330271 1.774555       9.188396 5.083763       4.909683 23.21641 9.707680 21.43921 7.556835 1.777199       12.30223 
1 1 1 1   33 13 o 42.07301 5.426103 22.21039       5.433833 0.000000       0.000000 22.21039       5.433833 ?        ?        42.07301 5.426103 0.000000       5.426103 
1 1 1 1   33 14 o 52.32934 3.945510 33.81775       4.994289 35.70150       10.18397 33.22126       5.730722 52.67096 8.201224 51.74024 4.592782 0.9307251      9.399667 
1 1 1 1   33 15 o 79.17157 3.368546 77.00158       6.484166 76.44228       13.44888 77.17097       7.401194 77.77809 7.176538 79.16067 3.848216 -1.382576      8.143186 
1 1 1 1   33 16 o 31.05105 5.629609 12.33097       4.102996 29.09379       9.806269 8.773669       4.517423 47.03657 8.880681 25.98982 6.983980 21.04675       11.29790 
1 1 1 1   33 17 o 60.22007 3.694277 44.78011       5.395250 43.10125       11.19022 45.28857       6.158298 57.61630 8.201292 60.44427 4.207158 -2.827969      9.217449 
1 1 1 1   33 18 o 49.85938 5.095501 31.22655       6.104170 22.83978       9.933855 36.31440       7.737265 40.89991 10.04193 53.49894 6.040296 -12.59903      11.71860 
1 1 1 1   33 19 o 22.43943 7.471138 6.209785       4.781550 10.11488       8.078741 4.104193       5.932189 28.32047 9.710389 21.08083 8.141876 7.239645       12.67209 
1 1 1 1   33 20 o 21.18469 6.484851 5.756550       3.661108 7.785256       8.450047 5.287716       4.062180 26.25818 9.815400 20.71261 6.885962 5.545563       11.98993 
1 1 1 1   33 21 o 43.16392 4.237163 23.40434       4.399520 19.72657       9.198488 24.49520       5.009682 37.36464 9.932541 44.00321 4.746883 -6.638569      11.00855 
1 1 1 1   33 22 o 47.39513 3.877392 28.12295       4.439154 35.64785       10.15091 26.34354       4.936189 51.10460 8.445718 45.65113 4.495412 5.453476       9.567595 
1 1 1 1   33 23 o 32.41840 6.319411 14.03190       4.812891 11.04192       7.996973 15.72995       6.026530 28.25720 9.661917 33.83513 7.505591 -5.577930      12.23464 
1 1 1 1   33 24 o 34.58480 6.308775 16.06296       5.121147 25.41613       9.000443 11.58524       6.227488 41.90567 9.076717 28.52237 8.396623 13.38330       12.36487 
1 1 1 1   33 25 o 13.97549 6.100365 -0.1531918     3.921572 5.251450       6.604599 -3.096203      4.873702 21.70185 8.530784 13.50473 6.253021 8.197126       10.57708 
1 1 1 1   33 26 o 13.54473 5.485945 1.323424       2.814173 4.501482       5.626246 0.2630155      3.249933 20.06245 7.877462 13.11384 5.638721 6.948611       9.687599 
1 1 1 1   33 27 f 17.96912 6.152607 4.264699       3.243032 10.49460       8.638814 3.242712       3.498938 25.95929 9.875511 16.72168 6.302247 9.237610       11.71512 
1 1 1 1   33 28 o 32.29200 4.393375 13.80465       3.367661 12.22489       5.867129 14.58084       4.112602 27.83443 8.138109 32.60072 5.363031 -4.766283      9.746328 
1 1 1 1   33 29 o 15.38259 5.780140 2.852787       2.938357 5.438402       5.632425 1.885971       3.444177 19.96859 7.869248 14.71481 6.027892 5.253782       9.912645 
1 1 1 1   33 30 o 19.63808 6.231685 5.709788       3.348343 15.41250       6.131052 1.585923       3.997061 30.47293 8.112937 14.90284 6.326081 15.57009       10.28781 
1 1 1 1   33 31 o 39.48881 5.130502 21.92369       4.820472 19.66538       6.635046 24.44817       7.015178 34.09025 8.106095 38.73846 7.702507 -4.648205      11.18201 
1 1 1 1   33 32 o 58.38578 3.832390 45.52493       5.422569 36.39647       8.202086 52.61275       7.227398 47.09490 7.389842 61.14371 4.891346 -14.04881      8.861999 
1 1 1 1   33 33 o 12.42859 5.405640 0.8060091      3.055775 2.676477       5.730647 0.6285644E-01  3.612165 16.25898 7.223810 12.51918 5.635619 3.739796       9.162076 
1 1 1 1   33 34 o 33.19844 5.018067 16.29791       3.933100 28.22984       9.678575 13.93774       4.304549 32.82165 10.61334 29.30610 6.220110 3.515549       12.30174 
1 1 1 1   33 35 o 23.88659 6.062702 9.502739       3.534493 14.58302       8.998512 8.575964       3.843388 22.21819 9.463760 21.91284 6.631629 0.3053493      11.55601 
1 1 1 1   34 0  o 143.0107 3.097908 250.0320       10.79626 258.9549       16.47760 243.3200       14.29119 145.1604 4.664163 140.8271 4.168929 4.333298       6.255748 
1 1 1 1   34 1  o 124.6722 3.017969 189.9902       9.168972 203.6269       14.04656 179.8658       12.10316 128.7453 4.484005 121.0723 4.108161 7.673042       6.081388 
1 1 1 1   34 2  o 71.68011 3.235398 62.96297       5.636915 72.03997       8.309031 55.22331       7.672559 76.49292 4.477090 66.89298 4.737425 9.599937       6.518246 
1 1 1 1   34 3  o 46.86180 3.913989 27.08923       4.428879 26.79137       6.458727 27.35359       6.084752 46.25110 5.861923 46.82912 5.432700 -0.5780220     7.992269 
1 1 1 1   34 4  f 163.3336 3.543926 326.5594       14.10575 328.8859       19.34903 323.9203       20.60748 163.5125 4.861324 162.1542 5.221886 1.358353       7.134463 
1 1 1 1   34 5  o 42.46439 4.174517 22.32486       4.264055 24.93965       5.986210 19.63162       6.075346 44.63588 5.628284 39.31565 6.573038 5.320229       8.653462 
1 1 1 1   34 6  o 112.8600 2.944145 155.8285       8.090295 158.9229       12.25028 153.4349       10.77414 113.6869 4.430286 111.8061 3.960662 1.880798       5.942582 
1 1 1 1   34 7  o 175.3221 3.244262 376.1236       13.86082 352.9516       20.68548 395.0060       18.67296 169.2624 5.020525 179.3895 4.271496 -10.12704      6.591764 
1 1 1 1   34 8  o 56.10578 3.700990 38.74263       5.031868 46.15892       6.987378 30.75336       7.252284 61.08206 4.731087 49.48333 6.146301 11.59872       7.756301 
1 1 1 1   34 9  o 102.9015 3.205099 129.7356       8.027298 122.6277       10.70234 138.8773       12.13719 99.79149 4.411884 106.1347 4.704410 -6.343170      6.449511 
1 1 1 1   34 10 o 19.56539 6.412561 4.582080       3.526981 3.148262       4.413252 7.116628       5.867620 18.62814 7.065053 24.50249 8.277656 -5.874346      10.88276 
1 1 1 1   34 11 o 53.84412 5.730218 36.30171       7.403389 0.000000       0.000000 36.30171       7.403389 ?        ?        53.84412 5.730218 0.000000       5.730218 
1 1 1 1   34 12 o 86.12803 3.991415 91.37510       8.354586 94.51473       14.66800 89.86742       10.16451 86.63982 7.007056 85.17429 4.918047 1.465530       8.560726 
1 1 1 1   34 13 o 56.57446 4.548020 39.73092       6.217376 43.00087       10.84347 38.12937       7.588707 57.85392 7.897239 55.11554 5.733839 2.738384       9.759267 
1 1 1 1   34 14 o 88.16381 3.994421 95.91005       8.559546 107.4579       15.48110 90.82548       10.27254 92.19852 6.941332 85.50195 4.951391 6.696571       8.526334 
1 1 1 1   34 15 f 53.42196 4.839682 35.65508       6.232182 38.12795       10.72037 34.39275       7.659437 53.98660 8.423600 52.06597 6.155709 1.920628       10.43311 
1 1 1 1   34 16 o 27.00582 7.155670 9.592136       4.783929 0.4047542      7.620357 15.56823       6.145939 20.17518 8.654015 34.32801 7.552385 -14.15284      11.48610 
1 1 1 1   34 17 o 35.53089 7.068816 16.59291       5.905114 15.43134       8.993721 17.47312       7.829071 33.65239 10.13591 35.88212 8.976732 -2.229729      13.53951 
1 1 1 1   34 18 o 51.37412 8.626819 35.38163       10.41776 35.38163       10.41776 0.000000       0.000000 51.37412 8.626819 ?        ?        0.000000       8.626819 
1 1 1 1   34 19 o 14.76815 6.477634 -0.6892012     4.469015 0.3524825      7.610543 -1.237437      5.521175 19.84733 8.581963 16.05046 7.113048 3.796877       11.14655 
1 1 1 1   34 20 o 19.53662 7.590470 3.599019       5.178982 1.179563       7.133994 6.294858       7.530449 19.72234 8.414353 24.03544 9.201556 -4.313107      12.46876 
1 1 1 1   34 21 o 16.07393 6.614385 1.474241       4.171032 0.6819665      6.906054 1.929204       5.233357 18.98159 8.191238 17.91617 7.394402 1.065420       11.03511 
1 1 1 1   34 22 o 16.02890 6.592026 1.558045       4.139745 5.425531       7.386905 -0.2127538     4.998420 22.77766 9.000827 15.75050 6.880936 7.027160       11.32970 
1 1 1 1   34 23 o 50.07722 3.782337 31.64231       4.581564 38.58663       10.59058 30.04346       5.081693 51.89857 8.680216 48.52528 4.343264 3.373287       9.706188 
1 1 1 1   34 24 o 22.62718 6.216249 7.062678       3.532513 6.879049       8.564995 7.100317       3.877679 23.95591 9.617178 22.61937 6.616758 1.336538       11.67354 
1 1 1 1   34 25 o 48.93034 4.186058 30.82743       4.943464 0.000000       0.000000 30.82743       4.943464 ?        ?        48.93034 4.186058 0.000000       4.186058 
1 1 1 1   34 26 o 64.90263 3.362065 53.40240       5.299337 63.00802       12.13758 51.14008       5.890424 65.38988 7.768690 63.13234 3.847026 2.257538       8.669034 
1 1 1 1   34 27 o 24.38216 5.404088 8.314290       3.126517 2.065414       5.706778 10.99431       3.737306 17.37868 7.472277 27.96198 5.678780 -10.58330      9.385279 
1 1 1 1   34 28 o 15.25336 5.825399 2.730690       3.013428 0.8638187      5.472549 3.543060       3.610021 16.08448 7.107111 16.79355 6.385039 -0.7090645     9.554044 
1 1 1 1   34 29 o 48.01468 3.955294 30.41124       4.586948 35.21243       7.268666 27.23393       5.913028 49.11565 6.211624 43.73031 5.682993 5.385334       8.419066 
1 1 1 1   34 30 o 22.73307 6.907038 8.324154       4.163576 6.549824       5.624050 10.47593       6.193412 20.16312 7.888082 23.96402 8.483789 -3.800903      11.58432 
1 1 1 1   34 31 o 59.04853 3.749441 46.45224       5.367385 52.40404       8.347034 42.25628       7.008478 59.27003 5.855534 53.92113 5.406563 5.348907       7.969831 
1 1 1 1   34 32 o 24.12022 5.780802 9.067095       3.353518 7.611106       5.968232 9.738891       4.054016 20.03844 8.033660 24.07071 6.677443 -4.032276      10.44643 
1 1 1 1   34 33 o 21.00762 6.376700 7.480697       3.549901 13.36894       8.287004 6.157370       3.928605 22.79795 9.345926 18.79394 6.745589 4.004017       11.52603 
1 1 1 1   34 34 f 12.83845 5.596539 1.268730       3.291093 13.08137       8.546692 -0.7877972     3.566086 21.68875 9.230161 11.54231 5.345919 10.14643       10.66652 
1 1 1 1   35 0  o 34.81678 5.568556 15.32711       4.565492 16.88550       5.815889 12.82476       7.369740 36.29956 6.825214 31.50023 9.095140 4.799334       11.37124 
1 1 1 1   35 1  o 121.7518 3.064927 181.4742       9.086286 199.0671       13.68312 167.5970       12.15251 127.2003 4.421014 116.7371 4.279141 10.46315       6.152757 
1 1 1 1   35 2  o 134.8958 3.400824 222.9965       11.17050 224.6359       15.12019 221.0264       16.57475 135.0712 4.600370 133.8237 5.091794 1.247528       6.862199 
1 1 1 1   35 3  o 102.1521 3.003288 127.7727       7.468075 136.9749       11.33604 120.7164       9.926640 105.4723 4.420290 99.07278 4.120604 6.399536       6.043040 
1 1 1 1   35 4  o 41.48790 4.166447 21.34820       4.155378 27.55522       6.194740 16.27053       5.602913 46.91529 5.524184 35.62468 6.699822 11.29061       8.683560 
1 1 1 1   35 5  o 67.07970 3.174772 55.21221       5.174943 54.09936       7.557619 56.19456       7.100685 66.11861 4.721642 67.47202 4.341618 -1.353409      6.414324 
1 1 1 1   35 6  o 106.1776 2.915202 138.0463       7.535749 129.7799       11.10604 145.0994       10.25865 102.6070 4.452264 108.6528 3.880710 -6.045715      5.906147 
1 1 1 1   35 7  o 74.67464 3.111452 68.40297       5.649627 71.84100       8.276194 65.40284       7.731182 76.26327 4.472908 72.77476 4.379691 3.488510       6.260080 
1 1 1 1   35 8  o 23.11459 7.031345 6.736419       4.313047 4.830742       5.860027 8.989001       6.371113 21.98278 8.182442 26.82678 8.605206 -4.844007      11.87442 
1 1 1 1   35 9  o 81.39216 3.384275 81.39448       6.697856 88.43720       11.82072 78.06412       8.128671 84.18657 5.797286 79.52520 4.209478 4.661369       7.164372 
1 1 1 1   35 10 o 70.08288 3.152190 60.33599       5.369668 58.49693       7.857038 61.94775       7.355465 68.65617 4.724976 70.77342 4.284925 -2.117256      6.378557 
1 1 1 1   35 11 o 146.5507 3.510434 263.8734       12.53675 250.4605       24.23487 268.7742       14.64910 140.8367 7.084116 147.6386 4.075592 -6.801926      8.172830 
1 1 1 1   35 12 o 111.5705 3.376113 153.0853       9.168593 184.8188       20.69895 145.3393       10.22657 120.7699 7.064052 108.5501 3.872219 12.21980       8.055737 
1 1 1 1   35 13 o 41.18758 4.649198 21.28030       4.584927 14.93952       8.353185 24.01429       5.485027 33.33397 9.700309 43.61658 5.267017 -10.28261      11.03800 
1 1 1 1   35 14 o 14.26548 6.097490 0.7008158E-01  3.758630 -0.1498234     7.145324 0.1542084      4.419484 19.19128 8.306905 15.48521 6.615151 3.706070       10.61908 
1 1 1 1   35 15 o 18.86035 7.188348 3.381331       4.582507 -2.225017      8.086637 6.033239       5.561696 19.08618 8.524033 22.70577 8.039382 -3.619591      11.71712 
1 1 1 1   35 16 o 31.15894 6.469752 12.77825       4.751668 17.03230       8.741869 10.99433       5.660960 34.99353 9.841600 28.60621 7.873327 6.387323       12.60343 
1 1 1 1   35 17 o 25.82440 6.678661 8.883549       4.234083 5.401800       8.070260 10.20594       4.973571 23.85068 9.413213 27.55640 7.293593 -3.705725      11.90819 
1 1 1 1   35 18 o 101.7193 3.312618 128.1080       8.200329 124.5226       16.57308 129.2703       9.436426 97.63387 7.012435 101.9217 3.805995 -4.287880      7.978712 
1 1 1 1   35 19 o 22.12159 6.609219 6.494816       3.835532 9.820566       7.839055 5.448032       4.397921 27.15326 9.550576 20.88066 7.164380 6.272600       11.93909 
1 1 1 1   35 20 o 49.28724 4.508153 30.89363       5.354739 0.000000       0.000000 30.89363       5.354739 ?        ?        49.28724 4.508153 0.000000       4.508153 
1 1 1 1   35 21 o 41.48259 4.434314 22.02486       4.413137 29.65067       9.918104 20.14233       4.927843 44.92841 9.362914 39.26255 5.284467 5.665859       10.75127 
1 1 1 1   35 22 o 60.94549 4.054361 47.19257       5.987199 77.89420       13.06024 39.02362       6.736798 75.25564 7.209637 54.73901 5.109359 20.51663       8.836538 
1 1 1 1   35 23 o 17.99346 6.427926 4.044260       3.562855 7.008687       7.812730 3.265888       4.003372 23.44849 9.259523 17.37906 6.694769 6.069435       11.42623 
1 1 1 1   35 24 o 49.23301 4.947310 32.04760       5.855187 0.000000       0.000000 32.04760       5.855187 ?        ?        49.23301 4.947310 0.000000       4.947310 
1 1 1 1   35 25 o 43.71719 3.992718 24.80050       4.206698 30.40111       9.862123 23.55485       4.651043 42.73991 9.692780 42.18616 4.598586 0.5537491      10.72833 
1 1 1 1   35 26 o 22.54262 6.416197 7.481854       3.693021 24.92233       8.863399 3.818037       4.062450 38.06805 9.566995 17.53857 6.747172 20.52948       11.70691 
1 1 1 1   35 27 o 22.64668 6.869200 7.856142       4.120460 3.097685       7.637986 9.809447       4.893627 19.11599 8.423551 24.84706 7.475089 -5.731071      11.26202 
1 1 1 1   35 28 o 12.46176 5.757667 -1.655934      4.099401 -5.264282      6.577632 0.6357607      5.241961 13.89867 6.676081 15.40081 6.871536 -1.502135      9.580609 
1 1 1 1   35 29 f 16.44635 6.224608 3.726084       3.421494 7.247344       5.593716 1.621096       4.324901 20.73082 7.931984 14.96004 6.469073 5.770776       10.23549 
1 1 1 1   35 30 o 28.07807 5.281969 11.56130       3.481482 17.58407       6.171158 8.749543       4.216555 31.35149 8.039722 22.80372 6.955344 8.547771       10.63080 
1 1 1 1   35 31 o 23.74875 6.427407 9.304184       3.809684 17.51505       8.908479 7.466483       4.214505 26.05988 10.00016 20.63089 7.014954 5.428989       12.21527 
1 1 1 1   35 32 o 25.61461 6.181305 10.73448       3.813840 10.83999       9.107135 10.71204       4.199848 20.79150 9.178455 24.86797 6.756203 -4.076469      11.39694 
1 1 1 1   35 33 o 9.682246 4.615316 -2.388541      3.015827 -2.239317      5.846188 -2.442651      3.520401 13.23700 6.341264 10.47570 4.991565 2.761295       8.070151 
1 1 1 1   36 0  o 67.95583 3.120489 56.69804       5.153766 65.50203       7.942033 50.29388       6.773656 72.76585 4.500896 63.75171 4.386831 9.014141       6.285089 
1 1 1 1   36 1  f 106.8562 2.790793 139.8419       7.260918 127.7657       11.13021 148.7889       9.580210 101.7141 4.501561 110.0442 3.577250 -8.330078      5.749850 
1 1 1 1   36 2  o 91.79141 3.012000 103.3134       6.728289 95.15980       9.682253 110.9278       9.356578 87.73469 4.544138 94.87760 4.056211 -7.142914      6.091145 
1 1 1 1   36 3  o 51.87848 3.706491 33.22453       4.654956 27.25393       6.406887 39.90036       6.774707 46.50110 5.778165 56.60524 4.961430 -10.10414      7.615968 
1 1 1 1   36 4  o 55.94263 3.859294 38.65670       5.228983 47.02837       7.130918 28.91945       7.690549 61.51713 4.794622 47.60579 6.824098 13.91134       8.340067 
1 1 1 1   36 5  o 30.25844 5.772908 11.74918       4.101470 12.30882       4.998950 10.59651       7.174228 30.75681 6.845837 28.80836 9.119309 1.948448       11.40295 
1 1 1 1   36 6  o 13.91615 6.254254 -1.957348      4.428331 -4.823165      6.065616 1.313541       6.480127 15.01772 6.961324 19.51278 8.155264 -4.495055      10.72233 
1 1 1 1   36 7  o 58.83718 3.703313 42.74672       5.282867 37.27789       8.864010 45.75939       6.578984 54.03545 6.887912 60.70147 4.479127 -6.666016      8.216198 
1 1 1 1   36 8  o 134.5255 3.001302 221.9640       9.838987 207.4278       14.46506 234.4799       13.42224 129.3977 4.594598 137.8590 3.999570 -8.461288      6.091542 
1 1 1 1   36 9  o 34.72698 4.475821 15.15677       3.699714 13.48931       4.986508 17.19876       5.518167 32.19273 6.578691 36.49520 6.440073 -4.302475      9.206178 
1 1 1 1   36 10 o 123.9864 2.948174 188.6645       8.907651 178.7211       13.02596 197.3988       12.20839 120.0409 4.460675 126.3956 3.968522 -6.354706      5.970493 
1 1 1 1   36 11 o 41.35364 4.957087 21.57477       4.896037 17.55654       8.732416 23.41705       5.912826 35.84314 9.743843 42.84510 5.812945 -7.001961      11.34605 
1 1 1 1   36 12 o 38.32758 5.125589 18.65268       4.667407 13.78933       8.457834 20.78225       5.596766 31.93283 9.871325 40.25014 5.879510 -8.317307      11.48963 
1 1 1 1   36 13 o 21.31438 6.836563 5.739351       4.021364 13.18126       7.427617 2.653411       4.783007 31.12408 9.172073 18.28615 7.237441 12.83793       11.68364 
1 1 1 1   36 14 o 71.97015 4.990376 65.23971       8.698088 0.000000       0.000000 65.23971       8.698088 ?        ?        71.97015 4.990376 0.000000       4.990376 
1 1 1 1   36 15 o 44.34629 5.321453 25.14713       5.636009 23.36559       9.567865 26.09377       6.974463 40.64727 9.778875 44.63898 6.611095 -3.991707      11.80394 
1 1 1 1   36 16 o 41.04229 4.738811 21.43754       4.652612 22.61108       9.017975 21.01186       5.431278 39.92515 9.421743 40.25779 5.695094 -0.3326454     11.00924 
1 1 1 1   36 17 o 71.93291 4.034300 64.88338       7.043495 41.19357       11.09006 80.89989       9.118791 54.53700 8.631623 79.95064 4.701106 -25.41364      9.828800 
1 1 1 1   36 18 o 12.89214 5.754676 -1.087610      3.680560 -9.917399      6.570319 2.950288       4.443130 13.26743 6.444990 17.85819 7.003841 -4.590764      9.517966 
1 1 1 1   36 19 f 60.99819 3.724038 46.78225       5.509252 62.19697       11.41048 42.09644       6.291128 67.86626 6.999744 57.42524 4.532341 10.44101       8.338977 
1 1 1 1   36 20 o 51.35941 3.935916 33.46956       4.888550 37.76257       10.29460 32.21964       5.554802 51.11567 8.567436 50.02197 4.608700 1.093697       9.728364 
1 1 1 1   36 21 o 28.79344 5.675319 11.25510       3.840530 13.79142       8.118004 10.52376       4.359210 29.64069 9.729470 27.36891 6.610924 2.271776       11.76295 
1 1 1 1   36 22 o 27.63506 6.675256 10.91005       4.444441 0.000000       0.000000 10.91005       4.444441 ?        ?        27.63506 6.675256 0.000000       6.675256 
1 1 1 1   36 23 o 26.52311 7.789222 10.75014       5.364578 25.44792       8.943410 2.489699       6.704691 39.48589 9.425520 18.79475 8.090427 20.69114       12.42157 
1 1 1 1   36 24 o 15.16372 6.401696 1.485115       4.056093 -1.950685      7.193541 3.086622       4.911263 16.47061 7.615940 17.52938 7.191432 -1.058773      10.47470 
1 1 1 1   36 25 o 31.46892 6.353223 14.44108       4.703989 23.36177       9.073942 11.16261       5.500876 35.89914 10.00174 26.33845 7.925670 9.560690       12.76131 
1 1 1 1   36 26 o 13.34415 5.973267 -0.2753187     3.995335 4.417201       7.932477 -1.870356      4.624781 19.88317 8.677706 13.16832 6.095153 6.714849       10.60441 
1 1 1 1   36 27 o 12.97602 5.701935 0.3607824      3.477089 6.996336       6.993979 -1.817724      4.007423 20.85833 8.572179 12.15800 5.643511 8.700327       10.26311 
1 1 1 1   36 28 o 12.06367 5.394789 -0.1492179     3.250401 -1.523170      6.778915 0.2609693      3.703953 15.27567 7.171950 13.05586 5.803740 2.219810       9.226065 
1 1 1 1   36 29 o 16.28788 6.237065 3.837902       3.460428 0.4942726      6.663017 5.072848       4.049356 15.79274 7.312040 17.91097 6.773328 -2.118231      9.967141 
1 1 1 1   36 30 o 17.29220 6.418974 4.773778       3.601686 5.471775       8.507627 4.621365       3.975514 18.59807 8.481437 17.12031 6.650704 1.477760       10.77806 
1 1 1 1   36 31 o 56.46022 4.494484 45.40282       6.132840 54.08183       12.69922 42.76303       7.003687 46.16298 11.36582 52.94625 5.508641 -6.783276      12.63040 
1 1 1 1   37 0  o 69.02723 3.030453 58.57704       5.085157 69.63551       8.241931 51.77991       6.461659 74.87524 4.538358 64.64090 4.123546 10.23434       6.131910 
1 1 1 1   37 1  o 57.86145 3.176426 41.23268       4.461645 40.33331       6.730994 41.93753       5.958779 56.80610 4.910542 58.11677 4.236555 -1.310677      6.485509 
1 1 1 1   37 2  o 36.83995 4.447566 17.02409       3.912090 15.24801       5.415812 18.96198       5.657136 34.22864 6.732870 38.41413 6.258501 -4.185490      9.192409 
1 1 1 1   37 3  o 28.19485 6.355229 10.37166       4.261751 5.833918       6.911904 13.15490       5.413182 23.69513 8.873165 31.62271 7.188034 -7.927574      11.41932 
1 1 1 1   37 4  o 77.75274 3.474759 74.53413       6.567165 83.24422       12.12362 70.91710       7.812636 81.18375 6.174426 75.61639 4.256992 5.567352       7.499701 
1 1 1 1   37 5  o 37.99177 4.580532 18.14198       4.155263 17.28183       5.808958 19.04329       5.946308 36.43056 6.793127 38.34784 6.601225 -1.917286      9.472209 
1 1 1 1   37 6  f 57.41791 3.651429 40.79802       5.082654 33.13545       6.570662 52.21366       8.019961 51.25541 5.338733 64.52650 5.142853 -13.27110      7.412895 
1 1 1 1   37 7  o 100.6788 2.954853 124.6042       7.241690 118.4248       10.55250 130.1049       9.956092 97.60336 4.448339 102.5079 3.993254 -4.904564      5.977775 
1 1 1 1   37 8  o 51.85591 3.923137 33.43718       4.920782 32.85081       6.244808 34.39760       7.992158 51.05004 5.087464 51.73064 6.481763 -0.6805954     8.239876 
1 1 1 1   37 9  o 93.55876 3.720680 108.3538       8.465954 100.2647       9.622810 136.0590       17.80876 89.70510 4.415555 102.7577 7.156586 -13.05261      8.409153 
1 1 1 1   37 10 o 31.19493 5.316634 12.53739       3.896843 11.96570       4.728102 13.74824       6.881031 30.07281 6.630415 31.73693 8.658549 -1.664122      10.90563 
1 1 1 1   37 11 o 18.22960 7.208645 2.710412       4.741136 7.355473       7.086617 -1.053347      6.379024 24.87525 9.042068 17.40725 7.683191 7.468006       11.86551 
1 1 1 1   37 12 o 29.03600 9.882579 11.29013       8.364720 11.29013       8.364720 0.000000       0.000000 29.03600 9.882579 ?        ?        0.000000       9.882579 
1 1 1 1   37 13 o 88.01573 3.994518 96.70449       8.545300 90.55196       14.09482 100.2803       10.74533 83.12086 7.024151 89.05260 4.971235 -5.931740      8.605340 
1 1 1 1   37 14 o 28.34614 7.062469 10.92906       4.860491 14.62684       8.124389 8.867823       6.065738 31.96276 9.635053 25.68868 8.408952 6.274076       12.78846 
1 1 1 1   37 15 o 32.23846 8.211558 14.61189       6.467958 0.000000       0.000000 14.61189       6.467958 ?        ?        32.23846 8.211558 0.000000       8.211558 
1 1 1 1   37 16 o 66.44210 4.225202 55.80982       6.805674 58.57538       11.54930 54.33866       8.423541 65.78333 7.328804 64.83819 5.379620 0.9451447      9.091297 
1 1 1 1   37 17 o 22.55169 7.280588 6.902349       4.555654 5.090250       7.296303 8.060166       5.832192 22.17413 8.885117 24.25085 8.252056 -2.076715      12.12608 
1 1 1 1   37 18 o 41.93141 5.274037 23.10422       5.270195 13.74697       8.222786 29.62787       6.865783 29.95291 9.789739 46.97811 6.144467 -17.02520      11.55826 
1 1 1 1   37 19 o 46.55519 4.934421 28.36225       5.512965 30.70319       9.627221 27.22006       6.724730 45.07526 9.078773 44.62489 6.363985 0.4503708      11.08713 
1 1 1 1   37 20 o 39.14529 5.670273 20.76119       5.251704 12.32799       10.15384 23.84104       6.136196 27.63709 10.65787 41.56178 6.252032 -13.92468      12.35630 
1 1 1 1   37 21 o 18.42647 7.493149 3.480735       5.274682 0.000000       0.000000 3.480735       5.274682 ?        ?        18.42647 7.493149 0.000000       7.493149 
1 1 1 1   37 22 o 16.53301 6.703828 2.672579       4.207796 -4.667334      7.137918 6.581730       5.209156 15.26094 7.224020 21.31283 7.751562 -6.051888      10.59590 
1 1 1 1   37 23 o 14.62772 6.038627 1.716514       3.491321 13.38293       8.239368 -0.8366489     3.854468 27.30914 9.772851 12.86818 5.804572 14.44096       11.36669 
1 1 1 1   37 24 o 20.25603 6.828512 6.135491       3.992997 10.80155       8.329923 4.743450       4.549798 24.56963 9.603433 18.64670 7.148865 5.922934       11.97214 
1 1 1 1   37 25 o 9.658345 4.653955 -3.966757      3.255741 3.023712       7.727982 -5.475208      3.589869 18.75422 8.357137 9.570054 4.674348 9.184163       9.575556 
1 1 1 1   37 26 o 22.19498 6.839425 7.912272       4.064013 8.533167       8.794580 7.743686       4.582652 21.77637 9.317920 21.64681 7.315337 0.1295547      11.84643 
1 1 1 1   37 27 o 14.84560 6.080722 2.473120       3.504271 4.144487       7.767243 2.045978       3.926605 18.51607 8.305381 14.78817 6.273441 3.727903       10.40843 
1 1 1 1   37 28 o 28.34158 6.054278 12.53801       4.054377 16.31832       8.846437 11.53285       4.561659 25.65166 9.933065 26.02439 7.028889 -0.3727264     12.16845 
1 1 1 1   37 29 o 55.51155 4.592736 43.74303       6.157302 65.03544       12.83904 37.38320       7.016867 55.91557 9.778323 48.98008 6.004220 6.935493       11.47459 
1 1 1 1   37 30 f 28.45746 6.011839 12.99434       4.038236 11.82016       8.832031 13.30469       4.540657 21.32730 9.233462 27.84308 6.760663 -6.515783      11.44392 
1 1 1 1   38 0  o 59.27667 3.709981 43.58591       5.332225 52.10728       10.42642 40.56782       6.205065 63.55940 6.839112 56.93733 4.508904 6.622066       8.191683 
1 1 1 1   38 1  o 122.0497 3.128675 183.4724       9.297691 223.1171       20.27411 172.9140       10.46280 132.4738 6.298267 118.2611 3.634842 14.21272       7.271881 
1 1 1 1   38 2  o 124.6719 2.989959 191.1744       9.083849 188.0954       13.62566 193.6377       12.18735 122.8247 4.560267 124.9465 4.007846 -2.121780      6.071150 
1 1 1 1   38 3  o 71.38846 3.117974 62.86293       5.411129 71.40733       8.002154 55.66428       7.344993 75.66440 4.358337 66.70615 4.545609 8.958244       6.297432 
1 1 1 1   38 4  o 36.12246 4.435197 16.47097       3.822305 14.55638       5.448548 18.32630       5.363564 33.12966 6.969982 37.60793 6.058227 -4.478275      9.234866 
1 1 1 1   38 5  o 19.31660 6.206580 4.675773       3.313354 6.021194       4.561505 3.173032       4.820823 21.94223 7.296974 18.82633 7.320839 3.115898       10.33637 
1 1 1 1   38 6  o 12.85675 5.479033 0.1419796      3.018793 2.469600       3.954512 -3.108855      4.673413 16.97520 6.622114 13.45725 6.192369 3.517949       9.066302 
1 1 1 1   38 7  o 51.29884 3.447005 32.67638       4.284078 34.48573       6.100041 30.91537       6.017993 52.24029 4.846993 49.35411 5.076000 2.886177       7.018484 
1 1 1 1   38 8  o 36.99234 4.255344 17.27673       3.766241 15.52865       5.319163 19.03418       5.333403 34.23118 6.615956 38.27262 5.908487 -4.041439      8.870236 
1 1 1 1   38 9  o 67.78532 3.121532 56.86050       5.142474 49.54153       7.023140 65.32006       7.550582 62.68004 4.630666 72.17039 4.312914 -9.490353      6.328057 
1 1 1 1   38 10 o 90.49408 3.275637 101.4983       7.211654 92.82010       9.228339 115.1114       11.55816 85.93662 4.421522 95.33068 4.992708 -9.394058      6.669106 
1 1 1 1   38 11 o 40.29281 4.847162 20.77864       4.663921 18.68644       8.266870 21.75547       5.648728 36.07552 9.333305 40.81627 5.845823 -4.740749      11.01291 
1 1 1 1   38 12 o 39.53387 5.761555 20.46766       5.387525 19.69643       8.339358 21.02012       7.058135 36.90540 9.282700 39.08452 7.684556 -2.179123      12.05076 
1 1 1 1   38 13 o 26.01382 6.735771 9.267604       4.303306 13.60423       7.809001 7.376328       5.157000 30.51997 9.493516 23.45028 7.757332 7.069685       12.25981 
1 1 1 1   38 14 o 78.96589 3.502650 78.03448       6.723420 92.69569       13.51963 73.21715       7.749678 83.24374 6.721766 76.04900 4.197998 7.194740       7.924981 
1 1 1 1   38 15 o 47.86024 4.310235 29.27765       4.973233 32.92490       9.641879 27.95560       5.805023 47.74817 8.602833 46.25188 5.242730 1.496284       10.07447 
1 1 1 1   38 16 o 34.92846 5.394528 16.21994       4.443899 15.66182       8.107969 16.45959       5.313004 31.73888 9.637656 34.54277 6.551355 -2.803886      11.65353 
1 1 1 1   38 17 o 25.24057 7.464887 9.236117       4.912689 0.000000       0.000000 9.236117       4.912689 ?        ?        25.24057 7.464887 0.000000       7.464887 
1 1 1 1   38 18 o 48.06562 4.321025 29.95594       5.007282 26.42422       9.697294 31.23993       5.847085 40.22861 9.948221 48.60213 5.008459 -8.373520      11.13785 
1 1 1 1   38 19 o 14.77000 6.424941 0.4800897      4.318150 0.000000       0.000000 0.4800897      4.318150 ?        ?        14.77000 6.424941 0.000000       6.424941 
1 1 1 1   38 20 o 11.41653 5.289339 -2.108982      3.495144 11.30260       7.744313 -5.539508      3.916727 26.03044 9.453752 10.31062 5.001060 15.71981       10.69505 
1 1 1 1   38 21 o 20.94205 6.593849 6.431263       3.755474 6.107305       7.726357 6.531476       4.297247 21.50207 8.939372 21.01808 7.083887 0.4839878      11.40587 
1 1 1 1   38 22 f 17.71850 6.319389 4.328154       3.442153 3.973150       7.223091 4.432463       3.915327 19.49335 8.394325 18.05196 6.694196 1.441393       10.73671 
1 1 1 1   38 23 o 10.60324 4.988440 -2.541827      3.309050 -13.00357      6.845626 0.6479606      3.780002 11.90920 5.931707 13.76315 5.998771 -1.853952      8.436255 
1 1 1 1   38 24 o 17.72972 6.899647 4.372815       4.284615 -6.321999      8.220360 8.362025       5.020508 14.99982 7.268329 22.34874 7.655127 -7.348915      10.55602 
1 1 1 1   38 25 o 10.16284 4.871034 -3.507223      3.459213 -3.452178      7.716916 -3.521065      3.869793 15.28644 7.312971 10.85381 5.188680 4.432632       8.966713 
1 1 1 1   38 26 o 15.96253 6.453290 3.350010       3.886013 -0.5407469     7.221645 4.935786       4.610415 15.76885 7.403166 17.89107 7.097816 -2.122215      10.25602 
1 1 1 1   38 27 f 16.53183 6.396350 4.086867       3.666066 -1.298631      7.821435 5.603189       4.150202 15.61257 7.439498 18.38067 6.877172 -2.768104      10.13122 
1 1 1 1   38 28 o 21.04339 6.693970 7.670108       3.861559 15.13180       9.055730 6.011764       4.269158 23.69151 9.747228 18.58919 6.970939 5.102322       11.98342 
1 1 1 1   39 0  o 21.64548 6.338890 6.166252       3.557123 2.763400       4.783453 10.37582       5.320333 18.23970 7.231818 27.61030 7.645842 -9.370598      10.52417 
1 1 1 1   39 1  o 123.4640 2.996420 188.0786       9.015279 192.0142       13.48075 184.8944       12.12570 123.7266 4.478491 121.6941 4.094682 2.032570       6.068221 
1 1 1 1   39 2  o 59.74934 3.185748 44.24610       4.621764 39.51532       6.828611 48.24514       6.278331 55.72630 5.084418 62.02890 4.177867 -6.302608      6.580720 
1 1 1 1   39 3  o 29.06426 5.421493 11.03394       3.698641 14.37093       5.124502 7.405343       5.343718 32.80637 6.638181 23.83898 7.896915 8.967386       10.31633 
1 1 1 1   39 4  o 25.29040 5.773757 8.475821       3.479837 9.488241       4.810596 7.364596       5.039871 26.43886 7.250443 23.65950 7.659382 2.779358       10.54680 
1 1 1 1   39 5  f 37.69934 4.301691 18.01604       3.881289 15.69177       5.374382 20.54968       5.611218 34.24495 6.680121 39.61996 5.999293 -5.375008      8.978616 
1 1 1 1   39 6  o 27.08150 5.500691 9.662831       3.506139 10.50926       4.886631 8.764760       5.033488 27.74322 7.174865 25.39034 7.567856 2.352875       10.42838 
1 1 1 1   39 7  o 71.78206 3.416605 64.13455       5.959343 61.23237       7.680584 68.52460       9.446387 69.56831 4.555569 73.11584 5.338525 -3.547531      7.018053 
1 1 1 1   39 8  o 26.26254 5.830735 9.212168       3.634322 13.89673       4.716326 2.364110       5.702336 32.23836 6.228819 18.75183 7.726878 13.48653       9.924859 
1 1 1 1   39 9  o 12.32771 5.444241 -0.6567010     3.207195 -1.030100      4.015166 0.1485143E-02  5.330785 13.53200 6.027352 16.36558 7.128569 -2.833577      9.335174 
1 1 1 1   39 10 o 31.90343 4.751130 13.19696       3.581264 15.78476       4.925091 10.29350       5.216837 34.33281 6.110667 27.08808 7.597156 7.244734       9.749720 
1 1 1 1   39 11 o 31.67570 5.796832 13.42137       4.309746 19.63837       7.752880 10.64108       5.184618 36.63747 8.795274 27.45140 7.526591 9.186071       11.57611 
1 1 1 1   39 12 o 19.76111 6.782885 5.045997       3.942128 2.674578       6.593594 6.365223       4.917878 19.59705 8.210909 21.88449 7.573276 -2.287447      11.17021 
1 1 1 1   39 13 o 52.08679 4.149625 34.65033       5.223598 38.28936       9.916305 33.25275       6.145347 51.65260 8.147868 50.46061 5.066019 1.191990       9.594389 
1 1 1 1   39 14 o 36.89963 5.262822 18.09848       4.598402 7.709458       8.247641 22.78463       5.539248 24.18530 9.525092 41.21064 5.665545 -17.02534      11.08268 
1 1 1 1   39 15 o 16.52201 6.503841 2.737857       3.843665 -3.218379      6.974935 5.335452       4.606169 16.08571 7.459332 20.14305 7.294422 -4.057333      10.43313 
1 1 1 1   39 16 o 28.92147 6.047809 11.70404       4.125081 11.24480       7.433769 11.90838       4.958568 26.58165 9.304181 28.48957 7.153438 -1.907925      11.73625 
1 1 1 1   39 17 f 23.92795 7.433529 8.572280       4.789436 0.000000       0.000000 8.572280       4.789436 ?        ?        23.92795 7.433529 0.000000       7.433529 
1 1 1 1   39 18 o 42.69019 4.812182 24.35303       4.919052 15.70656       9.972956 27.13288       5.654773 29.05196 10.69982 44.68217 5.296190 -15.63021      11.93884 
1 1 1 1   39 19 o 14.13251 5.995472 1.099672       3.586526 -0.8361274     7.256732 1.725360       4.125627 16.98069 7.777607 15.41203 6.478564 1.568666       10.12240 
1 1 1 1   39 20 o 15.18658 6.250332 2.067087       3.725376 -1.027794      7.435730 3.104285       4.304596 16.85541 7.775793 16.81238 6.793722 0.4303169E-01  10.32558 
1 1 1 1   39 21 o 15.83402 6.265578 2.899361       3.583995 4.697340       7.480159 2.363609       4.083198 19.78714 8.531796 15.71445 6.512879 4.072688       10.73355 
1 1 1 1   39 22 o 16.45904 6.395811 3.499881       3.677511 -0.4513927     7.169251 4.910802       4.284072 16.42488 7.597707 18.38586 6.963702 -1.960987      10.30623 
1 1 1 1   39 23 o 20.50414 7.106460 6.841682       4.331004 5.616517       7.791472 7.389512       5.210087 19.72097 8.603697 20.91338 7.728177 -1.192406      11.56496 
1 1 1 1   39 24 o 17.67772 6.573922 4.778534       3.780862 7.719140       8.222713 3.990140       4.257638 20.57996 8.909588 16.90388 6.782503 3.676086       11.19746 
1 1 1 1   39 25 o 12.36669 5.626711 -0.4083576     3.717149 4.347052       7.673140 -1.866560      4.249013 18.21505 8.205499 12.14898 5.695716 6.066072       9.988564 
1 1 1 1   39 26 o 21.94164 6.836345 8.326763       4.047580 7.129031       8.620994 8.665438       4.584254 19.44399 8.733491 21.84260 7.316251 -2.398611      11.39304 
1 1 1 1   40 0  o 16.85122 6.296186 3.042538       3.476151 -8.121226      5.876329 9.052026       4.311412 12.85891 6.210130 25.69566 6.785894 -12.83675      9.198590 
1 1 1 1   40 1  o 20.68064 6.730411 5.601647       3.888586 1.864668       6.859925 7.370956       4.720204 19.53254 8.289267 23.33192 7.398374 -3.799381      11.11071 
1 1 1 1   40 2  o 52.19152 3.416755 34.06689       4.321707 34.94849       6.503537 33.36975       5.783298 52.00648 5.201351 51.07491 4.699202 0.9315643      7.009747 
1 1 1 1   40 3  o 22.45654 5.808073 6.785931       3.202022 6.132572       4.528961 7.438934       4.527725 21.62832 7.272288 23.36415 7.222467 -1.735826      10.24940 
1 1 1 1   40 4  o 20.66767 6.586968 5.659308       3.737642 5.765754       4.573979 5.445385       6.484231 21.15546 7.304505 22.00385 8.508549 -0.8483906     11.21388 
1 1 1 1   40 5  o 67.18416 3.516765 56.53958       5.737617 50.24783       7.208715 67.41500       9.477531 62.61761 4.759827 72.05299 5.437815 -9.435375      7.226740 
1 1 1 1   40 6  o 24.39175 5.900142 8.066605       3.468440 9.605926       4.785857 6.363685       5.033757 26.19132 7.251148 22.02137 7.659712 4.169952       10.54753 
1 1 1 1   40 7  o 56.23289 3.573206 39.76617       4.871161 43.27891       6.638478 35.66852       7.169896 58.00566 4.737597 51.97994 5.756698 6.025715       7.455495 
1 1 1 1   40 8  o 69.27049 3.097721 59.88532       5.215869 53.03254       7.393149 66.67618       7.359669 64.14838 4.763411 72.40065 4.189270 -8.252266      6.343506 
1 1 1 1   40 9  o 43.76654 4.232228 24.56455       4.457599 20.44584       5.548102 32.06503       7.487008 38.91010 6.047536 48.54373 6.491635 -9.633633      8.872092 
1 1 1 1   40 10 o 14.18770 5.778591 1.422105       3.142888 2.308982       4.331420 0.4359636      4.567392 16.72694 6.794565 15.34032 6.640731 1.386622       9.500812 
1 1 1 1   40 11 o 32.36923 5.640151 14.19517       4.287352 13.89373       7.589635 14.33645       5.195768 29.71447 9.376218 31.77792 6.907065 -2.063444      11.64564 
1 1 1 1   40 12 o 43.02253 4.661312 24.24375       4.808998 17.42821       8.033471 28.05004       6.003495 32.88622 9.496041 45.71046 5.499917 -12.82424      10.97378 
1 1 1 1   40 13 o 31.92541 5.810858 14.06361       4.354280 22.88657       8.078059 10.45026       5.169576 38.26701 8.840438 26.41423 7.614678 11.85279       11.66776 
1 1 1 1   40 14 o 14.90003 6.276923 1.292530       3.886101 6.254395       6.908554 -1.004172      4.700208 21.79414 8.674822 14.20083 6.407390 7.593307       10.78458 
1 1 1 1   40 15 o 24.01455 7.314642 8.665385       4.665560 0.000000       0.000000 8.665385       4.665560 ?        ?        24.01455 7.314642 0.000000       7.314642 
1 1 1 1   40 16 o 45.21597 4.544554 27.10287       4.939646 38.36193       9.618896 23.07014       5.756705 49.78821 8.214181 40.51313 6.013163 9.275082       10.17993 
1 1 1 1   40 17 o 16.86547 6.491373 3.458851       3.761537 12.04741       6.923432 -0.1380670     4.480500 26.55844 8.991514 14.28012 6.363401 12.27831       11.01545 
1 1 1 1   40 18 o 13.92300 5.964877 0.9576366      3.612100 4.206886       7.339909 -0.8074068E-01 4.149318 19.67792 8.467740 13.78354 6.134054 5.894382       10.45606 
1 1 1 1   40 19 o 18.49794 6.619351 4.954230       3.779869 12.75509       8.177297 2.834557       4.262584 25.81351 9.654371 16.32258 6.698391 9.490934       11.75055 
1 1 1 1   40 20 o 22.83136 7.392001 8.551686       4.694071 0.000000       0.000000 8.551686       4.694071 ?        ?        22.83136 7.392001 0.000000       7.392001 
1 1 1 1   40 21 o 14.70658 6.446727 1.191051       4.420468 12.81582       8.242162 -3.502926      5.237445 24.77799 9.589702 12.85105 6.113488 11.92694       11.37265 
1 1 1 1   40 22 o 16.23261 6.447298 3.524334       3.808222 9.166549       7.923882 1.829690       4.342627 21.64613 9.030341 14.98725 6.481579 6.658883       11.11566 
1 1 1 1   40 23 o 12.00065 5.501635 -0.8232949     3.642193 -0.6849378     7.402228 -0.8674919     4.183675 15.79946 7.441706 12.70823 5.851781 3.091229       9.466908 
1 1 1 1   40 24 o 15.47244 6.328714 3.106202       3.789377 3.052923       7.645208 3.123554       4.363027 17.36623 7.964949 15.82181 6.657271 1.544416       10.38074 
1 1 1 1   40 25 o 15.79765 6.353740 3.537628       3.745784 -1.364590      7.594627 5.113492       4.305956 15.26811 7.290707 17.64755 6.902648 -2.379441      10.03997 
1 1 1 1   41 0  o 15.22159 6.050498 2.011396       3.356426 5.263683       4.484438 -2.131126      5.061114 20.21696 7.212696 14.29810 6.528589 5.918861       9.728589 
1 1 1 1   41 1  f 17.00787 6.344489 3.284038       3.526859 2.774190       4.317573 4.306475       6.114167 17.22975 6.857898 20.33507 8.138533 -3.105322      10.64267 
1 1 1 1   41 2  o 17.89433 6.524422 3.856266       3.693639 4.172535       4.550723 3.245625       6.323309 18.95809 7.177898 19.60767 8.113658 -0.6495762     10.83299 
1 1 1 1   41 3  o 12.47133 5.546444 -0.7251197     3.386761 -2.239168      5.952575 -0.4040467E-03 4.118308 15.46711 7.069162 14.32806 6.252938 1.139048       9.437812 
1 1 1 1   41 4  f 21.59545 6.914903 6.459363       4.115340 12.24147       7.440444 3.910813       4.939720 28.22500 9.317019 18.94213 7.397793 9.282879       11.89681 
1 1 1 1   41 5  o 49.56821 4.189642 31.56021       5.013419 27.77578       8.292629 33.74018       6.293859 43.60987 8.101327 50.59697 5.177461 -6.987103      9.614448 
1 1 1 1   41 6  o 32.28334 4.710037 13.71692       3.596322 9.815523       4.999151 17.90160       5.177470 25.93968 7.491227 36.13362 6.096632 -10.19394      9.658541 
1 1 1 1   41 7  o 13.33958 5.596529 0.8395964      3.069450 -1.465195      4.071171 3.875372       4.672382 13.03837 5.915087 18.54413 7.208329 -5.505757      9.324606 
1 1 1 1   41 8  o 48.95002 3.632847 30.52521       4.302583 29.28609       6.039115 31.80252       6.131479 46.74788 5.400386 48.86580 5.230274 -2.117920      7.517974 
1 1 1 1   41 9  o 42.08105 3.888555 22.78650       3.942512 20.41846       5.432478 25.42153       5.730563 38.47878 5.988235 43.33257 5.554399 -4.853786      8.167638 
1 1 1 1   41 10 o 71.06863 3.175614 63.73375       5.485844 61.35285       7.957945 65.88970       7.572695 68.22453 4.817547 71.16650 4.387890 -2.941963      6.516314 
1 1 1 1   41 11 o 37.14177 5.058884 18.54602       4.459920 10.75712       7.759427 22.38870       5.450147 25.79094 9.448137 40.37745 5.697168 -14.58651      11.03291 
1 1 1 1   41 12 o 26.99300 6.539766 10.59444       4.256000 19.21144       8.136243 7.348420       4.993684 33.74637 9.495890 22.24837 7.634214 11.49800       12.18414 
1 1 1 1   41 13 f 31.45096 6.909400 14.63337       5.150531 0.000000       0.000000 14.63337       5.150531 ?        ?        31.45096 6.909400 0.000000       6.909400 
1 1 1 1   41 14 o 15.49470 6.298482 2.268295       3.725115 4.209762       6.983155 1.496089       4.404062 19.75328 8.372339 15.51000 6.614025 4.243284       10.66965 
1 1 1 1   41 15 o 47.69403 4.280793 30.10802       4.922490 20.82812       8.460708 34.85665       6.052285 34.01339 9.721567 50.66602 4.965622 -16.65263      10.91633 
1 1 1 1   41 16 o 10.43813 4.968232 -3.362963      3.468180 -4.040579      6.556028 -3.099645      4.086857 14.50058 6.881406 11.66324 5.504499 2.837340       8.812109 
1 1 1 1   41 17 o 15.04278 6.200490 2.164661       3.673490 1.620353       6.789851 2.389922       4.367974 17.36828 7.779834 15.93326 6.679882 1.435019       10.25410 
1 1 1 1   41 18 o 18.52582 6.674839 5.126813       3.850851 1.680967       7.198514 6.508249       4.557850 17.47486 7.902797 20.25168 7.266125 -2.776827      10.73549 
1 1 1 1   41 19 o 15.27739 6.564656 1.946252       4.399387 -5.697080      7.421259 6.087676       5.462747 14.30650 6.926082 19.55357 7.736039 -5.247067      10.38349 
1 1 1 1   41 20 o 16.11957 6.520558 3.326087       3.970037 1.743895       7.887044 3.863015       4.594547 17.41069 8.023452 16.99513 6.962108 0.4155598      10.62293 
1 1 1 1   41 21 o 30.83142 6.365340 14.93926       4.623927 26.47686       9.832206 11.66290       5.239487 33.39677 10.68774 25.44646 7.751639 7.950308       13.20287 
1 1 1 1   41 22 o 12.53040 5.681797 -0.2006534     3.750667 -7.876961      7.336775 2.515252       4.364016 13.16182 6.479945 15.33149 6.562081 -2.169662      9.222288 
1 1 1 1   42 0  o 36.69635 4.101897 17.47480       3.605450 14.67732       5.136380 20.19203       5.062183 31.96666 6.802701 38.56414 5.545938 -6.597479      8.776911 
1 1 1 1   42 1  o 14.76250 5.918434 1.920332       3.239138 -4.661985      4.611634 8.329686       4.550641 12.00772 5.719167 23.83269 7.216768 -11.82497      9.208182 
1 1 1 1   42 2  o 38.76297 4.008440 19.43718       3.731853 14.64129       5.455376 23.65527       5.116209 31.58741 7.242085 42.08962 5.091487 -10.50221      8.852742 
1 1 1 1   42 3  o 16.81278 6.120250 3.500402       3.248333 6.818651       4.528419 -0.1676128E-01 4.662173 21.77951 7.271145 14.88970 6.570346 6.889819       9.799949 
1 1 1 1   42 4  o 43.36752 3.854396 24.21513       4.031009 18.61402       5.522186 30.60400       5.897743 36.26897 6.486094 47.84187 5.139209 -11.57290      8.275318 
1 1 1 1   42 5  o 20.07803 6.396179 5.672599       3.524578 5.544872       4.693844 5.837718       5.336848 20.18247 7.355512 20.76116 7.792236 -0.5786915     10.71553 
1 1 1 1   42 6  o 51.08014 4.134220 33.86658       5.102199 32.94755       6.530375 35.30666       8.174603 49.21756 5.540966 49.55989 6.960171 -0.3423271     8.896420 
1 1 1 1   42 7  o 41.47194 4.006245 22.32994       3.998469 20.13534       5.512605 24.76634       5.808358 37.83302 6.193395 42.37167 5.775433 -4.538643      8.468398 
1 1 1 1   42 8  o 30.57013 5.895285 13.14259       4.232584 8.536802       7.534554 15.26619       5.116126 23.61722 9.161048 32.40138 6.700844 -8.784163      11.35016 
1 1 1 1   42 9  f 20.83845 6.715151 6.322171       3.876670 15.96763       7.625493 2.960418       4.501834 30.54107 9.360860 17.05816 6.927737 13.48290       11.64557 
1 1 1 1   42 10 o 18.59113 6.596913 4.774323       3.746685 3.419407       6.794240 5.366397       4.491309 19.13799 8.189494 19.58953 7.186229 -0.4515362     10.89540 
1 1 1 1   42 11 o 21.28950 7.623672 6.818661       5.014816 0.000000       0.000000 6.818661       5.014816 ?        ?        21.28950 7.623672 0.000000       7.623672 
1 1 1 1   42 12 o 15.16278 6.229107 2.095158       3.691312 2.252491       6.766475 2.028497       4.404426 18.07140 7.947112 15.85300 6.680630 2.218399       10.38207 
1 1 1 1   42 13 o 12.60304 5.726573 -0.9694404     3.834248 -2.773686      7.272325 -0.2747996     4.512379 15.76641 7.410539 14.06133 6.316921 1.705083       9.737535 
1 1 1 1   42 14 o 23.34256 6.501644 8.340203       3.834906 1.726622       6.866256 11.33853       4.623184 17.51707 7.836675 26.89489 6.990564 -9.377815      10.50150 
1 1 1 1   42 15 o 13.93930 6.028620 1.001534       3.757186 -2.752524      6.865430 2.606552       4.489078 15.12748 7.137919 16.14413 6.770303 -1.016648      9.838033 
1 1 1 1   42 16 o 19.91409 6.839504 6.260639       4.008386 6.906051       7.879189 6.035277       4.655903 20.67885 8.833250 19.56151 7.291086 1.117348       11.45366 
1 1 1 1   42 17 o 15.66058 6.657503 2.402416       4.437990 7.258269       8.051110 0.2829587      5.319065 20.64698 8.876413 14.90656 6.762032 5.740416       11.15866 
1 1 1 1   42 18 o 12.69997 5.886064 -1.348474      4.334058 -0.3780741     6.944220 -1.967673      5.547062 15.80326 7.367043 13.79309 6.479598 2.010163       9.811142 
1 1 1 1   42 19 o 23.33181 6.805764 9.069254       4.107494 6.044461       7.514135 10.35826       4.905229 19.31427 8.437278 24.16328 7.525436 -4.849012      11.30574 
1 1 1 1   42 20 o 15.99205 6.464993 3.475775       3.899962 -0.2369398     7.903410 4.670787       4.483888 16.16512 7.636899 17.44705 6.973983 -1.281937      10.34208 
1 1 1 1   43 0  o 15.24628 6.164952 2.165819       3.547299 5.725845       4.801099 -2.113920      5.264083 20.17145 7.424841 14.15206 6.533612 6.019389       9.890215 
1 1 1 1   43 1  o 8.855510 4.285471 -4.053740      2.834189 -6.384723      4.059352 -1.836766      3.958835 10.17808 4.971174 12.37901 5.697346 -2.200929      7.561238 
1 1 1 1   43 2  o 49.81425 3.831459 32.13638       4.615371 33.79812       6.713861 30.64746       6.355142 49.42203 5.677626 47.06747 5.653794 2.354565       8.012542 
1 1 1 1   43 3  o 31.27218 4.932199 13.28698       3.634257 14.69123       5.510033 12.20569       4.835087 31.03318 7.392087 28.50273 7.010478 2.530457       10.18773 
1 1 1 1   43 4  o 23.38279 6.166913 7.955778       3.563775 5.587687       4.587498 11.55999       5.659553 19.87071 7.267071 26.89200 8.026942 -7.021284      10.82784 
1 1 1 1   43 5  o 31.89358 5.076420 13.93855       3.813341 11.23859       5.596363 16.27867       5.210091 26.46176 8.001047 33.27089 6.658638 -6.809122      10.40933 
1 1 1 1   43 6  o 20.87225 6.380638 6.412848       3.545914 12.50144       5.223325 1.208432       4.829195 28.29975 7.467043 15.68938 6.809947 12.61038       10.10604 
1 1 1 1   43 7  o 14.30002 5.921609 1.625089       3.371478 2.342842       4.635631 0.8190787      4.912376 16.38575 6.876315 15.43583 6.780269 0.9499187      9.656902 
1 1 1 1   43 8  o 11.18713 5.295130 -3.239413      3.833350 -1.801312      6.031958 -4.213703      4.964866 15.02247 6.956020 12.47009 5.937915 2.552382       9.145766 
1 1 1 1   43 9  o 13.06201 5.822370 -0.1973029     3.753970 -2.099763      5.328526 1.677406       5.289519 13.97644 6.494432 16.32697 7.106484 -2.350532      9.627033 
1 1 1 1   43 10 o 10.97811 5.029417 -1.262824      3.036810 -2.335474      3.814471 0.5938294      5.018463 11.61961 5.431015 15.20009 6.756312 -3.580478      8.668546 
1 1 1 1   43 11 o 13.44278 5.967732 0.1384869      3.903050 1.388843       7.091695 -0.4048268     4.674751 17.40791 7.860934 14.04941 6.359645 3.358504       10.11135 
1 1 1 1   43 12 o 21.90449 6.998684 7.685750       4.217400 5.219089       8.010609 8.631632       4.960542 19.88187 8.697796 22.72441 7.610583 -2.842548      11.55736 
1 1 1 1   43 13 o 14.15804 6.105179 1.260686       3.830894 -2.175918      7.666467 2.404357       4.422637 15.89003 7.511328 15.76629 6.671782 0.1237392      10.04653 
1 1 1 1   43 14 f 28.10280 6.405766 12.25314       4.288997 20.61590       8.867330 9.699157       4.900356 30.84610 10.17076 23.79582 7.537347 7.050274       12.65922 
1 1 1 1   43 15 o 13.07484 5.991221 -0.7648544     4.312322 -10.36620      7.273011 4.440535       5.355188 12.70225 6.290095 17.89098 7.440538 -5.188730      9.743044 
1 1 1 1   43 16 o 25.96614 7.374570 11.59287       4.883946 19.80048       8.807093 7.947954       5.869051 29.37686 10.13617 20.92790 8.094234 8.448954       12.97145 
1 1 1 1   43 17 o 16.10243 6.477670 3.499177       3.894199 7.605095       8.133571 2.278053       4.435637 20.25502 8.814282 15.29555 6.582296 4.959463       11.00083 
1 1 1 1   44 0  o 18.20654 6.315951 4.760063       3.421406 0.6968848      4.712424 9.289536       4.975483 14.98413 6.609105 23.95316 7.595854 -8.969027      10.06863 
1 1 1 1   44 1  o 26.35143 5.633082 10.00082       3.507662 5.540901       5.065674 14.10892       4.861773 19.55253 7.531126 30.49249 6.723909 -10.93996      10.09598 
1 1 1 1   44 2  o 12.94518 5.712162 0.1087934      3.523621 0.1224003      4.697833 0.9129318E-01  5.327694 14.53353 6.493441 15.22861 6.850722 -0.6950788     9.439130 
1 1 1 1   44 3  o 12.03987 5.390946 -0.4427651     3.256784 2.418310       4.066185 -5.562600      5.439394 15.74063 6.509250 12.45872 6.006393 3.281915       8.857036 
1 1 1 1   44 4  o 45.20679 4.144034 27.19353       4.514497 29.88050       6.389093 24.51434       6.379844 45.55429 5.893348 40.32935 6.728528 5.224941       8.944531 
1 1 1 1   44 5  o 13.78754 5.872027 1.177535       3.463579 4.218847       4.851439 -1.984032      4.946423 17.99873 7.233731 13.45025 6.252419 4.548474       9.561359 
1 1 1 1   44 6  o 12.92601 5.732864 0.6259016E-01  3.593361 -4.976857      5.936398 2.976818       4.514330 13.23598 6.353734 16.53956 6.850855 -3.303581      9.343669 
1 1 1 1   44 7  o 13.75839 5.955326 0.9357427      3.672488 -4.412561      5.927596 4.267661       4.678619 13.41243 6.414521 17.83011 7.124916 -4.417678      9.586996 
1 1 1 1   44 8  o 17.42102 6.342352 4.369431       3.488506 1.966299       5.060243 6.546009       4.815813 16.01416 6.960761 20.22676 7.437741 -4.212603      10.18686 
1 1 1 1   44 9  o 13.16385 5.713953 0.7565692      3.400108 -0.4073856     5.087058 1.696415       4.571165 14.36376 6.553490 15.30814 6.635089 -0.9443760     9.325912 
1 1 1 1   44 10 o 26.64109 6.723754 11.27048       4.364693 9.476819       8.132557 11.99615       5.172804 22.28173 9.209067 26.55517 7.605147 -4.273434      11.94342 
1 1 1 1   44 11 o 18.34027 6.656703 5.159989       3.838857 9.115636       7.994226 3.974455       4.376477 21.88511 9.095345 17.11600 6.873441 4.769106       11.40042 
1 1 1 1   44 12 o 15.27007 6.361665 2.504604       3.924670 -3.367380      7.321915 4.871850       4.648941 14.91278 7.131271 18.04483 7.137384 -3.132052      10.08946 
1 1 1 1   44 13 o 19.78390 7.758193 6.665156       5.451236 3.221568       8.044153 9.589491       7.412902 18.09173 8.249237 21.95179 8.899075 -3.860060      12.13439 
1 1 1 1   44 14 o 15.15568 6.764314 1.337910       5.083880 -2.935611      7.303560 5.354935       7.080989 14.88742 7.120006 18.83304 8.209421 -3.945623      10.86688 
1 1 1 1   45 0  o 14.36479 5.828050 2.156980       3.182348 1.945299       4.624922 2.347324       4.385646 15.55763 6.708405 15.69067 6.641990 -0.1330442     9.440271 
1 1 1 1   45 1  o 18.17473 6.503196 4.950652       3.648302 3.616051       5.185609 6.258687       5.133738 17.35131 7.276589 19.81556 7.594587 -2.464241      10.51791 
1 1 1 1   45 2  o 14.13279 5.829587 1.900454       3.250257 4.309501       5.067906 0.2172251      4.236211 17.88507 7.317619 13.78330 6.161647 4.101775       9.566266 
1 1 1 1   45 3  o 12.99225 5.765704 0.2090403      3.640077 -4.065979      6.409622 2.244196       4.422442 13.95854 6.674216 15.60006 6.639304 -1.641512      9.414113 
1 1 1 1   45 4  o 13.42366 5.859732 0.7636359      3.618617 -9.232979      6.677399 4.920066       4.305674 12.48223 6.152390 18.18935 6.959208 -5.707128      9.288836 
1 1 1 1   45 5  o 37.50678 4.596247 19.44862       4.113267 22.85287       6.342010 16.97689       5.404008 37.79002 7.148516 32.58374 7.013640 5.206280       10.01461 
1 1 1 1   45 6  o 16.04712 6.450147 3.236350       3.857807 5.775499       5.133719 -0.5758599E-01 5.847167 19.14935 7.523012 15.20315 6.970175 3.946206       10.25568 
1 1 1 1   45 7  o 16.64625 6.658873 3.706988       4.090962 4.455261       5.372584 2.674470       6.311053 17.93498 7.455206 17.11331 7.593353 0.8216648      10.64139 
1 1 1 1   45 8  o 29.84881 7.603941 15.22973       5.545636 31.87539       9.943627 7.714906       6.681188 38.96492 10.31273 20.75308 8.435456 18.21184       13.32326 
1 1 1 1   45 9  o 17.05811 6.565157 4.240160       3.847386 3.454658       4.911701 5.487399       6.189179 16.75443 7.057369 18.88226 7.936045 -2.127825      10.62014 
1 1 1 1   45 10 o 14.36198 6.152638 1.711033       3.842729 7.766533       7.614523 -0.3581597     4.451109 20.57940 8.733404 13.43313 6.129385 7.146274       10.66966 
1 1 1 2   0  0  o 202.5922 6.607977 501.8711       32.54457 501.8711       32.54457 501.8711       32.54457 202.5922 6.607977 202.5922 6.607977 0.000000       0.000000 
1 1 1 2   0  1  o 420.3832 8.723770 2157.418       89.28189 2157.418       89.28189 2157.418       89.28189 420.3832 8.723770 420.3832 8.723770 0.000000       0.000000 
1 1 1 2   0  2  f 46.36539 3.803878 26.72170       4.229098 26.72170       4.229098 26.72170       4.229098 46.36539 3.803878 46.36539 3.803878 0.000000       0.000000 
1 1 1 2   0  3  o 709.0071 14.39341 6143.287       248.4542 6143.287       248.4542 6143.287       248.4542 709.0071 14.39341 709.0071 14.39341 0.000000       0.000000 
1 1 1 2   0  4  o 91.77742 3.088225 102.9873       6.889121 102.9873       6.889121 102.9873       6.889121 91.77742 3.088225 91.77742 3.088225 0.000000       0.000000 
1 1 1 2   0  5  o 18.25369 4.614577 4.760398       1.774928 4.760398       1.774928 4.760398       1.774928 18.25369 4.614577 18.25369 4.614577 0.000000       0.000000 
1 1 1 2   0  6  o 272.2958 5.983301 904.9998       39.65923 904.9998       39.65923 904.9998       39.65923 272.2958 5.983301 272.2958 5.983301 0.000000       0.000000 
1 1 1 2   0  7  o 633.4653 12.92402 4903.052       199.3189 4903.052       199.3189 4903.052       199.3189 633.4653 12.92402 633.4653 12.92402 0.000000       0.000000 
1 1 1 2   0  8  o 233.4923 5.318947 665.5103       30.22910 665.5103       30.22910 665.5103       30.22910 233.4923 5.318947 233.4923 5.318947 0.000000       0.000000 
1 1 1 2   0  9  o 103.4730 3.413901 130.8991       8.586983 130.8991       8.586983 130.8991       8.586983 103.4730 3.413901 103.4730 3.413901 0.000000       0.000000 
1 1 1 2   0  10 o 313.6443 6.789804 1201.133       51.84072 1201.133       51.84072 1201.133       51.84072 313.6443 6.789804 313.6443 6.789804 0.000000       0.000000 
1 1 1 2   0  11 o 115.8294 5.099166 164.4942       14.32944 164.4942       14.32944 164.4942       14.32944 115.8294 5.099166 115.8294 5.099166 0.000000       0.000000 
1 1 1 2   0  12 o 77.95702 3.401974 74.48595       6.434747 74.48595       6.434747 74.48595       6.434747 77.95702 3.401974 77.95702 3.401974 0.000000       0.000000 
1 1 1 2   0  13 o 289.3152 6.390385 1022.038       45.00449 1022.038       45.00449 1022.038       45.00449 289.3152 6.390385 289.3152 6.390385 0.000000       0.000000 
1 1 1 2   0  14 o 335.8652 10.25622 1380.207       83.76644 1380.207       83.76644 1380.207       83.76644 335.8652 10.25622 335.8652 10.25622 0.000000       0.000000 
1 1 1 2   0  15 o 109.3602 3.765841 146.2614       10.00892 146.2614       10.00892 146.2614       10.00892 109.3602 3.765841 109.3602 3.765841 0.000000       0.000000 
1 1 1 2   0  16 o 81.64925 5.383153 82.30412       10.60252 82.30412       10.60252 82.30412       10.60252 81.64925 5.383153 81.64925 5.383153 0.000000       0.000000 
1 1 1 2   0  17 o 608.7393 12.50004 4526.882       185.2530 4526.882       185.2530 4526.882       185.2530 608.7393 12.50004 608.7393 12.50004 0.000000       0.000000 
1 1 1 2   0  18 f 76.24946 3.934981 71.41438       7.266955 71.41438       7.266955 71.41438       7.266955 76.24946 3.934981 76.24946 3.934981 0.000000       0.000000 
1 1 1 2   0  19 o 160.7419 4.480136 315.6171       17.51834 315.6171       17.51834 315.6171       17.51834 160.7419 4.480136 160.7419 4.480136 0.000000       0.000000 
1 1 1 2   0  20 o 784.5369 15.98524 7530.099       305.3244 7530.099       305.3244 7530.099       305.3244 784.5369 15.98524 784.5369 15.98524 0.000000       0.000000 
1 1 1 2   0  21 o 151.8629 4.470418 281.8046       16.51136 281.8046       16.51136 281.8046       16.51136 151.8629 4.470418 151.8629 4.470418 0.000000       0.000000 
1 1 1 2   0  22 o 224.8906 5.464115 617.6198       29.90527 617.6198       29.90527 617.6198       29.90527 224.8906 5.464115 224.8906 5.464115 0.000000       0.000000 
1 1 1 2   0  23 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 2   0  24 o 177.4151 4.809165 384.6037       20.75747 384.6037       20.75747 384.6037       20.75747 177.4151 4.809165 177.4151 4.809165 0.000000       0.000000 
1 1 1 2   0  25 f 141.0053 4.462895 243.1542       15.30034 243.1542       15.30034 243.1542       15.30034 141.0053 4.462895 141.0053 4.462895 0.000000       0.000000 
1 1 1 2   0  26 o 37.09040 7.426652 18.67441       5.955181 18.67441       5.955181 18.67441       5.955181 37.09040 7.426652 37.09040 7.426652 0.000000       0.000000 
1 1 1 2   0  27 o 49.12706 5.582034 30.57715       6.460166 30.57715       6.460166 30.57715       6.460166 49.12706 5.582034 49.12706 5.582034 0.000000       0.000000 
1 1 1 2   0  28 o 35.49297 11.51167 19.61511       8.803192 19.61511       8.803192 19.61511       8.803192 35.49297 11.51167 35.49297 11.51167 0.000000       0.000000 
1 1 1 2   0  29 o 57.90916 5.160839 41.90724       7.143615 41.90724       7.143615 41.90724       7.143615 57.90916 5.160839 57.90916 5.160839 0.000000       0.000000 
1 1 1 2   0  30 o 191.0542 5.093152 446.7425       23.67452 446.7425       23.67452 446.7425       23.67452 191.0542 5.093152 191.0542 5.093152 0.000000       0.000000 
1 1 1 2   0  31 o 101.3755 4.397727 126.1759       10.81756 126.1759       10.81756 126.1759       10.81756 101.3755 4.397727 101.3755 4.397727 0.000000       0.000000 
1 1 1 2   0  32 o 69.65677 4.861744 60.14309       8.158638 60.14309       8.158638 60.14309       8.158638 69.65677 4.861744 69.65677 4.861744 0.000000       0.000000 
1 1 1 2   0  33 o 88.13044 4.593971 95.67568       9.804648 95.67568       9.804648 95.67568       9.804648 88.13044 4.593971 88.13044 4.593971 0.000000       0.000000 
1 1 1 2   0  34 f 132.9168 6.249385 217.9786       20.13969 217.9786       20.13969 217.9786       20.13969 132.9168 6.249385 132.9168 6.249385 0.000000       0.000000 
1 1 1 2   0  35 o 10.02488 6.892965 -3.888971      5.501992 -3.888971      5.501992 -3.888971      5.501992 10.02488 6.892965 10.02488 6.892965 0.000000       0.000000 
1 1 1 2   0  36 o 149.8498 4.796646 275.7683       17.47511 275.7683       17.47511 275.7683       17.47511 149.8498 4.796646 149.8498 4.796646 0.000000       0.000000 
1 1 1 2   0  37 o 33.97040 9.573475 17.25662       6.860703 17.25662       6.860703 17.25662       6.860703 33.97040 9.573475 33.97040 9.573475 0.000000       0.000000 
1 1 1 2   0  38 o 70.64291 5.305804 62.34258       9.012603 62.34258       9.012603 62.34258       9.012603 70.64291 5.305804 70.64291 5.305804 0.000000       0.000000 
1 1 1 2   0  39 o 49.00436 6.490191 31.20148       7.371839 31.20148       7.371839 31.20148       7.371839 49.00436 6.490191 49.00436 6.490191 0.000000       0.000000 
1 1 1 2   0  40 o 8.914631 6.340085 -7.950910      5.943798 -7.950910      5.943798 -7.950910      5.943798 8.914631 6.340085 8.914631 6.340085 0.000000       0.000000 
1 1 1 2   0  41 o 17.21085 9.580737 5.394710       5.955631 5.394710       5.955631 5.394710       5.955631 17.21085 9.580737 17.21085 9.580737 0.000000       0.000000 
1 1 1 2   0  42 o 50.85685 6.025124 33.80049       7.191624 33.80049       7.191624 33.80049       7.191624 50.85685 6.025124 50.85685 6.025124 0.000000       0.000000 
1 1 1 2   0  43 o 10.27429 6.917565 -1.575274      4.964296 -1.575274      4.964296 -1.575274      4.964296 10.27429 6.917565 10.27429 6.917565 0.000000       0.000000 
1 1 1 2   0  44 o 10.78760 7.426644 -3.395693      6.433817 -3.395693      6.433817 -3.395693      6.433817 10.78760 7.426644 10.78760 7.426644 0.000000       0.000000 
1 1 1 2   0  45 o 22.03144 10.08977 10.17639       5.907938 10.17639       5.907938 10.17639       5.907938 22.03144 10.08977 22.03144 10.08977 0.000000       0.000000 
1 1 1 2   0  46 o 10.64914 7.194174 -0.8749452     5.456603 -0.8749452     5.456603 -0.8749452     5.456603 10.64914 7.194174 10.64914 7.194174 0.000000       0.000000 
1 1 1 2   0  47 o 19.22834 9.805155 9.019422       5.779785 9.019422       5.779785 9.019422       5.779785 19.22834 9.805155 19.22834 9.805155 0.000000       0.000000 
1 1 1 2   0  48 o 11.19534 7.860700 -2.967874      8.218024 -2.967874      8.218024 -2.967874      8.218024 11.19534 7.860700 11.19534 7.860700 0.000000       0.000000 
1 1 1 2   0  49 o 12.88685 8.173424 4.049095       5.560036 4.049095       5.560036 4.049095       5.560036 12.88685 8.173424 12.88685 8.173424 0.000000       0.000000 
1 1 1 2   0  50 o 13.05567 8.449111 4.900447       6.327122 4.900447       6.327122 4.900447       6.327122 13.05567 8.449111 13.05567 8.449111 0.000000       0.000000 
1 1 1 2   1  0  o 792.2396 11.32190 7663.966       218.5808 7445.741       302.9891 7900.793       315.6385 780.0561 15.93915 803.5005 16.12010 -23.44440      22.66967 
1 1 1 2   1  1  o 266.5240 3.670986 865.7192       23.84268 906.7827       38.70282 840.6035       30.26831 272.7249 5.823470 262.6097 4.729784 10.11511       7.502244 
1 1 1 2   1  2  f 164.9452 3.297672 331.5621       13.25510 322.4739       16.04506 351.0954       23.52288 162.6613 4.047819 169.6079 5.699354 -6.946579      6.990527 
1 1 1 2   1  3  o 357.6737 6.147209 1559.758       53.57980 1629.164       95.52705 1527.902       64.71826 365.1483 10.74716 353.9470 7.503304 11.20126       13.10729 
1 1 1 2   1  4  o 261.3166 4.695183 832.3427       29.89892 857.7249       52.81267 820.3703       36.27124 265.0442 8.186623 259.4065 5.737802 5.637726       9.997158 
1 1 1 2   1  5  o 654.7623 9.406070 5231.499       150.0818 5275.505       213.4648 5188.483       211.0511 657.0126 13.33265 651.5772 13.29186 5.435425       18.82639 
1 1 1 2   1  6  o 177.9448 3.067756 385.8752       13.30278 382.7502       18.73223 389.0547       18.89475 177.2086 4.337792 178.6620 4.339832 -1.453461      6.136007 
1 1 1 2   1  7  o 748.9289 10.72935 6848.965       195.8168 6888.028       278.0156 6810.508       275.8507 750.2459 15.20650 746.0192 15.17358 4.226746       21.48197 
1 1 1 2   1  8  o 337.6345 5.088997 1389.753       41.87118 1390.048       59.22400 1389.459       59.20559 337.5777 7.199260 337.5063 7.198545 0.7141113E-01  10.18079 
1 1 1 2   1  9  o 414.9946 6.128458 2100.380       61.97689 2085.750       87.24516 2115.283       88.05762 413.3539 8.661304 416.2683 8.680756 -2.914398      12.26270 
1 1 1 2   1  10 o 358.4598 6.208558 1567.464       54.23346 1593.068       94.67871 1554.961       66.16384 360.7894 10.78077 356.9222 7.606959 3.867249       13.19435 
1 1 1 2   1  11 o 158.2265 3.393242 305.1684       13.08369 306.0251       16.03115 303.4597       22.64193 158.3779 4.157283 157.6081 5.905647 0.7697754      7.222165 
1 1 1 2   1  12 o 340.1954 5.156940 1411.478       42.75203 1392.434       59.93787 1431.199       60.99703 337.7340 7.282665 342.4005 7.310350 -4.666473      10.31884 
1 1 1 2   1  13 o 339.7187 5.957793 1407.784       49.32204 1420.462       60.75451 1383.276       84.46991 341.1478 7.308022 336.2121 10.32208 4.935760       12.64724 
1 1 1 2   1  14 o 433.0158 6.407207 2287.060       67.60963 2289.184       95.67171 2284.941       95.55733 432.9851 9.067227 432.5839 9.064786 0.4011841      12.82127 
1 1 1 2   1  15 o 314.2562 6.837093 1204.479       52.35901 1241.637       75.21925 1169.551       72.92757 318.7626 9.694615 309.3630 9.685514 9.399597       13.70382 
1 1 1 2   1  16 o 344.9291 6.072584 1450.618       51.04338 1477.928       89.73490 1437.555       62.06190 347.7650 10.60100 343.3166 7.418126 4.448364       12.93869 
1 1 1 2   1  17 o 327.3460 5.820272 1306.391       46.42869 1233.399       77.92753 1346.560       57.80912 317.7258 10.07748 332.2916 7.139057 -14.56586      12.34997 
1 1 1 2   1  18 o 576.0760 8.375356 4048.701       117.5761 4131.961       168.5938 3969.864       164.0546 581.5950 11.89556 570.0834 11.80902 11.51160       16.76178 
1 1 1 2   1  19 o 727.6695 10.47805 6465.782       185.8022 6340.040       259.2658 6598.547       266.4077 719.7838 14.78111 734.2883 14.88827 -14.50446      20.97955 
1 1 1 2   1  20 o 667.6288 9.649963 5442.234       156.9990 5416.370       221.3508 5468.418       222.7157 665.3505 13.65194 668.5359 13.67068 -3.185425      19.32001 
1 1 1 2   1  21 o 40.64113 4.251339 20.35453       4.148224 18.89299       5.764898 21.92381       5.973617 38.86229 6.303073 41.97443 6.011460 -3.112137      8.710131 
1 1 1 2   1  22 o 263.2067 6.089257 845.1083       39.05687 0.000000       0.000000 845.1083       39.05687 ?        ?        263.2067 6.089257 0.000000       6.089257 
1 1 1 2   1  23 f 286.6613 5.292715 1002.407       36.97292 1000.899       63.49280 1003.180       45.47927 285.9781 9.122450 286.6874 6.509816 -0.7093506     11.20700 
1 1 1 2   1  24 o 315.9682 7.023104 1219.717       54.07650 1219.717       54.07650 0.000000       0.000000 315.9682 7.023104 ?        ?        0.000000       7.023104 
1 1 1 2   1  25 o 281.3755 4.542774 966.0817       31.14896 979.4343       44.39278 953.1322       43.71753 283.1052 6.434702 279.2794 6.423632 3.825775       9.092218 
1 1 1 2   1  26 o 71.05202 3.217639 61.69592       5.556757 60.30543       7.740542 63.17448       7.981898 70.13860 4.553359 71.79140 4.586432 -1.652802      6.462850 
1 1 1 2   1  27 o 99.66054 3.472549 121.3327       8.420611 124.9531       10.29015 113.9942       14.65050 101.0798 4.186611 96.30576 6.276778 4.773987       7.544909 
1 1 1 2   1  28 o 282.8943 5.326677 978.8987       36.72118 1036.408       66.14050 953.2725       44.15105 289.7648 9.379038 278.9041 6.496060 10.86072       11.40899 
1 1 1 2   1  29 o 141.9762 3.163106 245.9904       10.94374 243.0064       15.33725 249.0856       15.62019 140.9321 4.471480 142.6823 4.498035 -1.750198      6.342433 
1 1 1 2   1  30 o 70.45098 3.300955 60.72742       5.651367 58.24741       7.898439 63.32884       8.089464 68.83999 4.737185 71.80451 4.648059 -2.964523      6.636669 
1 1 1 2   1  31 o 137.9576 3.200847 232.3955       10.76085 223.6828       14.97189 241.7060       15.47697 135.1233 4.553349 140.4718 4.527185 -5.348465      6.420933 
1 1 1 2   1  32 o 96.42798 3.128397 113.6804       7.341517 102.7600       10.06784 126.0813       10.72858 91.49949 4.529324 101.4011 4.351866 -9.901657      6.281203 
1 1 1 2   1  33 o 98.48949 3.155626 118.6349       7.563986 115.1696       10.52790 122.3322       10.87471 96.85534 4.472560 99.82632 4.481726 -2.970985      6.331640 
1 1 1 2   1  34 o 59.36013 4.198631 43.38072       6.034305 49.99286       9.835283 39.38923       7.641587 63.32882 6.463610 56.30521 5.645350 7.023602       8.581855 
1 1 1 2   1  35 o 67.83587 3.982238 56.57822       6.554029 57.30685       8.088620 55.18537       11.18347 68.11564 4.905806 66.36578 7.021419 1.749863       8.565469 
1 1 1 2   1  36 o 50.86389 4.256821 31.98181       5.227971 28.19359       7.218125 36.16185       7.582242 47.28020 6.431407 53.77882 5.881411 -6.498623      8.715158 
1 1 1 2   1  37 f 49.40580 4.392139 30.25453       5.232927 22.63844       7.285811 38.36969       7.520730 41.96994 7.393664 55.40781 5.648900 -13.43787      9.304641 
1 1 1 2   1  38 o 74.34530 4.100887 68.24696       7.400855 66.82931       8.845445 71.55551       13.51301 73.33778 4.978958 75.00768 7.492992 -1.669891      8.996386 
1 1 1 2   1  39 o 23.51452 7.916625 6.734939       5.366986 10.70910       9.329385 4.769145       6.561441 29.59522 10.41817 22.41376 8.587044 7.181461       13.50095 
1 1 1 2   1  40 o 112.3338 3.305783 155.6353       9.039577 149.9159       12.55295 161.7959       13.02806 109.5674 4.712431 113.8365 4.706521 -4.269096      6.660207 
1 1 1 2   1  41 o 21.78117 6.952206 6.136313       4.162395 2.558599       5.663291 10.33950       6.138403 19.08382 7.762856 27.55074 8.389813 -8.466911      11.43026 
1 1 1 2   1  42 o 36.16703 5.365259 17.08747       4.585539 14.68268       6.446111 19.55108       6.524461 32.17260 8.199229 37.70939 7.364299 -5.536793      11.02090 
1 1 1 2   1  43 o 14.94129 6.287611 1.031536       3.892762 6.089286       5.423308 -4.343652      5.590909 21.65779 7.904404 13.88874 6.518398 7.769048       10.24544 
1 1 1 2   1  44 o 23.98303 6.494345 8.269510       3.888188 6.544181       5.331871 10.22908       5.682298 21.57911 7.843227 25.83864 8.107469 -4.259531      11.28039 
1 1 1 2   1  45 o 27.31477 6.329479 10.99906       4.130540 13.35421       5.797364 8.570853       5.886590 28.69451 7.994543 23.04808 8.259031 5.646435       11.49453 
1 1 1 2   1  46 o 35.12353 5.174488 17.55556       4.296403 18.08766       6.297363 17.09221       5.876508 32.47174 8.008962 31.99257 7.642644 0.4791660      11.07039 
1 1 1 2   1  47 o 16.17497 6.343444 3.751850       3.644617 5.007197       5.403182 2.703838       4.936861 17.94177 7.468725 15.87835 6.888747 2.063423       10.16055 
1 1 1 2   1  48 o 18.06240 7.184044 6.038034       4.734630 1.830876       8.776096 7.765238       5.623137 16.39974 7.832787 19.40530 7.791708 -3.005560      11.04823 
1 1 1 2   1  49 o 16.65083 6.534116 5.238954       3.869053 4.075584       5.464779 6.408209       5.478583 15.58933 6.981516 17.24411 7.365865 -1.654780      10.14877 
1 1 1 2   1  50 o 13.57215 5.879457 2.776025       3.585338 1.023147       4.975727 4.669013       5.170762 13.03891 6.128925 15.25115 6.813372 -2.212242      9.164374 
1 1 1 2   2  0  o 298.2705 3.694579 1084.243       26.85415 1100.472       38.31842 1068.578       37.64552 300.4599 5.233412 296.0744 5.217668 4.385529       7.390038 
1 1 1 2   2  1  o 243.1018 5.383955 720.4341       31.89523 720.4341       31.89523 0.000000       0.000000 243.1018 5.383955 ?        ?        0.000000       5.383955 
1 1 1 2   2  2  o 565.8500 9.444255 3907.160       130.2282 3907.160       130.2282 0.000000       0.000000 565.8500 9.444255 ?        ?        0.000000       9.444255 
1 1 1 2   2  3  o 342.2288 5.115233 1427.681       42.65973 1425.693       60.26014 1429.678       60.40004 341.9150 7.232291 342.3922 7.238978 -0.4772339     10.23273 
1 1 1 2   2  4  o 311.8494 5.460526 1185.537       41.49688 1321.712       77.18385 1130.172       49.21493 328.9565 9.638742 304.4440 6.633663 24.51254       11.70089 
1 1 1 2   2  5  o 534.7341 8.949760 3488.774       116.6233 3624.398       207.4165 3426.076       141.0272 544.0441 15.66121 529.7309 10.92475 14.31323       19.09512 
1 1 1 2   2  6  o 892.6870 12.74589 9737.312       277.2716 9588.099       388.1022 9892.869       396.2679 884.5721 18.00432 898.4942 18.09829 -13.92206      25.52849 
1 1 1 2   2  7  o 93.35055 2.274576 106.1899       5.174322 105.1792       7.293519 107.2140       7.341915 92.84448 3.228541 93.73972 3.218803 -0.8952408     4.558965 
1 1 1 2   2  8  o 655.4148 9.431507 5244.221       150.6376 5418.002       217.8407 5084.975       208.5316 665.5231 13.43197 644.7750 13.27173 20.74811       18.88271 
1 1 1 2   2  9  o 393.4233 6.736922 1888.144       64.58887 1873.380       111.0190 1895.698       79.41143 391.2539 11.65701 394.0926 8.268917 -2.838684      14.29199 
1 1 1 2   2  10 o 509.5522 7.432460 3169.170       92.29058 3056.271       127.5566 3293.201       133.6970 499.9626 10.46958 518.9625 10.57182 -18.99985      14.87869 
1 1 1 2   2  11 o 226.2008 3.701650 623.7437       20.40449 643.4605       29.32578 605.2407       28.40868 229.6921 5.239230 222.7664 5.233177 6.925720       7.405111 
1 1 1 2   2  12 o 126.5191 3.082324 195.1031       9.503217 193.3733       11.53178 198.7642       16.77651 125.8905 3.763179 127.5419 5.410036 -1.651382      6.590145 
1 1 1 2   2  13 o 343.2953 5.205603 1437.170       43.54868 1458.184       62.14222 1416.891       61.04666 345.6489 7.377606 340.7217 7.352346 4.927155       10.41566 
1 1 1 2   2  14 o 429.8575 6.365918 2253.721       66.68401 2255.800       94.31619 2251.643       94.29467 429.8356 9.004254 429.4387 9.010521 0.3969421      12.73837 
1 1 1 2   2  15 o 560.4138 9.406420 3833.623       128.4604 3830.759       157.2755 3839.364       222.6577 559.9507 11.52591 559.5782 16.34581 0.3724976      20.00080 
1 1 1 2   2  16 o 242.6449 4.552017 717.6429       26.91604 716.2141       46.14107 718.3799       33.13860 242.1899 7.828280 242.7465 5.602026 -0.5565643     9.626248 
1 1 1 2   2  17 o 608.4929 10.18960 4519.528       151.0946 4581.901       264.5320 4489.327       184.0760 611.3093 17.77635 606.1882 12.46102 5.121033       21.70889 
1 1 1 2   2  18 o 334.0690 5.127011 1360.460       41.73847 1354.229       58.87519 1366.756       59.18021 333.2235 7.250376 334.7610 7.254468 -1.537445      10.25647 
1 1 1 2   2  19 o 463.2490 6.842665 2617.236       77.24597 2591.922       108.5752 2643.182       109.9219 460.7878 9.669267 465.3197 9.693855 -4.531921      13.69181 
1 1 1 2   2  20 o 329.6530 5.091880 1324.873       40.90452 1276.759       56.48928 1377.911       59.30915 323.5190 7.165230 336.0861 7.241608 -12.56711      10.18732 
1 1 1 2   2  21 o 174.7392 3.873177 372.1856       16.49278 351.6303       28.06446 383.0298       20.38417 169.6392 6.802615 177.1865 4.725135 -7.547226      8.282661 
1 1 1 2   2  22 o 601.4951 10.10580 4422.885       148.1285 4357.632       253.5288 4456.705       182.5229 594.8306 17.50938 603.2838 12.41537 -8.453125      21.46439 
1 1 1 2   2  23 o 301.9220 4.775737 1111.761       35.13753 1088.200       48.99557 1136.711       50.41894 298.5645 6.734147 305.1428 6.780386 -6.578308      9.556274 
1 1 1 2   2  24 o 252.9586 4.848362 780.6788       29.88688 766.6505       36.15833 810.9311       53.09875 250.5951 5.921063 257.3297 8.479137 -6.734573      10.34189 
1 1 1 2   2  25 o 138.1311 3.608308 232.8587       12.13554 238.2251       14.95193 222.4991       20.77430 139.6604 4.398752 134.7895 6.342402 4.870911       7.718490 
1 1 1 2   2  26 o 258.9024 4.288357 818.1269       27.05597 824.7238       38.36011 811.5965       38.16647 259.7230 6.060847 257.6451 6.078887 2.077911       8.584098 
1 1 1 2   2  27 o 82.37554 3.501943 82.94732       7.013769 87.01328       8.592967 74.83179       12.14004 84.31644 4.195280 77.91708 6.451466 6.399361       7.695570 
1 1 1 2   2  28 o 59.48257 3.387162 43.31827       4.889483 44.66398       6.772899 41.85359       7.065954 60.27765 4.646707 58.29372 5.023023 1.983921       6.842707 
1 1 1 2   2  29 o 253.3069 4.937353 784.8218       30.47735 777.8139       52.96505 788.2908       37.26497 251.0267 8.671336 253.6270 6.029331 -2.600327      10.56148 
1 1 1 2   2  30 o 99.55920 3.073025 121.0963       7.446689 116.3247       10.30801 126.3047       10.76957 97.44358 4.351936 101.5443 4.362354 -4.100685      6.161938 
1 1 1 2   2  31 o 239.9888 4.120484 704.2693       24.09769 701.6107       33.95017 706.9686       34.20987 239.1099 5.826508 240.0146 5.848948 -0.9047089     8.255809 
1 1 1 2   2  32 o 61.23535 3.509554 45.97380       5.215158 42.25842       7.144609 50.21116       7.629990 58.49641 5.061784 63.81834 4.944716 -5.321922      7.076149 
1 1 1 2   2  33 o 79.17104 3.702720 76.82770       7.123912 72.17171       11.32588 79.87563       9.163648 76.32719 6.140937 80.58837 4.686381 -4.261185      7.724848 
1 1 1 2   2  34 o 93.58665 3.200861 107.1826       7.289154 102.4838       10.02337 112.4566       10.61926 91.31125 4.518608 95.65195 4.569005 -4.340706      6.426012 
1 1 1 2   2  35 o 134.6575 3.753541 222.2294       12.30507 221.4204       15.09106 223.8342       21.25541 134.2110 4.621082 134.3633 6.510998 -0.1522675     7.984202 
1 1 1 2   2  36 o 44.17819 4.519992 24.23166       4.797591 27.76752       6.647551 20.38788       6.930958 47.03118 5.931838 39.84088 7.411551 7.190300       9.493039 
1 1 1 2   2  37 o 56.41474 4.026472 39.28545       5.499064 38.85880       7.559920 39.76485       8.013597 55.76202 5.640926 56.34311 5.925043 -0.5810928     8.180842 
1 1 1 2   2  38 o 73.84416 3.596614 67.13258       6.452647 75.31823       9.058117 58.69905       9.194249 77.92448 4.793302 68.54045 5.552189 9.384026       7.335022 
1 1 1 2   2  39 o 40.87925 6.201346 21.41075       5.984021 25.99039       11.31352 19.63186       7.051077 43.42927 10.74860 38.61007 7.763498 4.819199       13.25912 
1 1 1 2   2  40 o 13.04401 5.926151 -2.190211      4.104464 -6.359589      5.678158 2.372349       5.939858 13.51288 6.410198 19.44262 7.934613 -5.929743      10.20043 
1 1 1 2   2  41 o 64.58353 3.683589 51.94530       5.773303 51.00596       7.920543 53.01008       8.432885 63.33508 5.176987 64.44745 5.419672 -1.112373      7.494935 
1 1 1 2   2  42 o 25.46199 6.607630 8.855001       4.134932 10.69825       5.726847 6.847546       5.976492 27.57350 8.034145 23.16365 8.319273 4.409847       11.56537 
1 1 1 2   2  43 o 41.02542 5.184759 22.15984       5.067879 8.285040       7.423390 34.27104       6.935577 24.57352 9.196945 50.75853 5.705788 -26.18501      10.82312 
1 1 1 2   2  44 o 17.83624 6.626212 3.962362       3.839430 3.638915       5.201152 4.349667       5.691463 18.52826 7.474661 19.53858 7.841083 -1.010319      10.83296 
1 1 1 2   2  45 o 24.39944 7.025885 9.180123       4.403371 9.560131       5.503886 8.504331       7.339729 24.24006 8.013803 22.87937 8.993213 1.360695       12.04570 
1 1 1 2   2  46 o 17.75359 6.604060 4.656696       3.816138 3.451232       5.380312 5.877082       5.413509 17.25206 7.332040 19.37316 7.689464 -2.121107      10.62481 
1 1 1 2   2  47 o 18.28894 7.096787 5.508882       4.522831 10.62425       5.444089 -5.887182      8.125769 23.59662 7.973311 14.36404 7.019485 9.232580       10.62294 
1 1 1 2   2  48 f 17.09608 6.439721 4.984257       3.652102 5.056400       5.253701 4.916796       5.080362 17.11601 7.258567 16.98635 7.167503 0.1296654      10.20098 
1 1 1 2   2  49 o 20.91757 7.303727 9.392074       4.579123 15.03306       9.195464 7.531944       5.280412 20.44561 9.113154 18.22576 7.464670 2.219851       11.78010 
1 1 1 2   2  50 o 16.32797 6.402603 5.452519       3.712498 5.704737       5.239150 5.198151       5.261450 15.94279 7.002580 15.58391 6.922945 0.3588886      9.846994 
1 1 1 2   3  0  o 157.1172 2.508907 300.8148       9.606039 311.3749       12.55557 285.9074       14.91776 159.8457 3.223291 153.1098 4.001630 6.735825       5.138350 
1 1 1 2   3  1  o 480.0193 8.060836 2810.592       94.29199 2755.744       114.0154 2929.284       167.7239 475.1849 9.846112 489.3020 14.08101 -14.11716      17.18199 
1 1 1 2   3  2  o 333.4004 5.791996 1355.139       47.05767 1444.913       59.89444 1210.339       76.06667 344.2162 7.140344 314.7568 9.929485 29.45938       12.23026 
1 1 1 2   3  3  o 406.4035 5.983137 2013.647       59.25465 2009.857       83.65474 2017.464       83.94347 405.8984 8.457404 406.6651 8.470595 -0.7666321     11.96991 
1 1 1 2   3  4  f 521.8333 7.562194 3321.162       96.16470 3285.784       135.0519 3357.549       136.9631 518.7966 10.68237 524.4283 10.71720 -5.631653      15.13180 
1 1 1 2   3  5  f 635.8096 10.57129 4934.969       163.7914 4875.675       281.5427 4965.304       201.3769 630.5158 18.34315 637.4564 12.96352 -6.940613      22.46162 
1 1 1 2   3  6  o 585.9082 8.454163 4188.226       120.7081 4198.452       170.9751 4178.064       170.4401 586.2407 11.96798 584.8166 11.95958 1.424133       16.91934 
1 1 1 2   3  7  o 669.7629 9.624209 5475.891       157.0805 5460.053       221.6839 5491.861       222.6097 668.1733 13.61473 670.1137 13.63200 -1.940369      19.26635 
1 1 1 2   3  8  o 389.4615 6.663015 1850.032       63.23704 1838.707       108.6103 1855.840       77.78056 387.7061 11.50836 389.9711 8.184696 -2.265015      14.12202 
1 1 1 2   3  9  o 170.0357 3.027094 352.3671       12.54302 358.4238       17.86566 346.4798       17.61405 171.4694 4.275592 168.5333 4.292308 2.936066       6.058431 
1 1 1 2   3  10 o 400.4018 5.947531 1955.735       58.03218 1896.517       80.34133 2020.338       83.91506 394.0663 8.366303 406.7155 8.466680 -12.64914      11.90293 
1 1 1 2   3  11 o 266.6412 4.206863 866.8432       27.33517 829.9959       37.54632 908.4011       39.87414 260.8309 5.907072 272.8673 5.996582 -12.03638      8.417393 
1 1 1 2   3  12 o 462.0895 7.848407 2607.283       88.37791 2586.476       107.5419 2650.568       155.1097 459.9989 9.593675 464.6925 13.71237 -4.693604      16.73522 
1 1 1 2   3  13 o 202.8409 3.453314 501.5018       17.06977 502.1003       24.10532 500.8999       24.17543 202.9258 4.874606 202.6825 4.894652 0.2432861      6.907923 
1 1 1 2   3  14 o 181.2871 3.712517 400.5753       16.40104 409.3343       20.35538 384.3652       27.69153 183.2429 4.558437 177.4070 6.415874 5.835938       7.870375 
1 1 1 2   3  15 f 121.9540 2.689646 181.2424       7.993318 174.0911       11.08823 188.9795       11.53343 119.4543 3.814004 124.4627 3.807096 -5.008408      5.388934 
1 1 1 2   3  16 o 436.4205 6.460586 2322.381       68.70892 2278.406       95.93005 2368.703       98.45743 432.1131 9.110058 440.5883 9.170215 -8.475189      12.92618 
1 1 1 2   3  17 o 391.5130 8.304980 1869.885       79.23569 0.000000       0.000000 1869.885       79.23569 ?        ?        391.5130 8.304980 0.000000       8.304980 
1 1 1 2   3  18 o 559.1682 8.142177 3814.352       110.9479 3743.774       154.9196 3888.667       158.9666 553.6370 11.48273 564.2394 11.56129 -10.60242      16.29468 
1 1 1 2   3  19 o 350.3979 5.346121 1496.864       45.64954 1469.895       63.83080 1525.097       65.31107 347.1268 7.545812 353.5831 7.579825 -6.456238      10.69547 
1 1 1 2   3  20 o 347.5172 6.163765 1472.783       52.19855 1447.522       90.00494 1485.585       64.07478 344.0506 10.74833 348.9488 7.535104 -4.898224      13.12648 
1 1 1 2   3  21 o 207.9160 4.171789 526.9714       21.13714 486.2009       34.62750 551.1849       26.68555 199.4934 7.134382 212.6127 5.150518 -13.11928      8.799274 
1 1 1 2   3  22 o 118.2682 2.950754 170.4781       8.504270 176.1146       12.16277 165.0867       11.89539 120.1182 4.161444 116.2898 4.204522 3.828445       5.915709 
1 1 1 2   3  23 o 342.2862 5.281751 1429.258       44.05583 1399.400       61.42738 1460.883       63.21998 338.4898 7.446981 345.8396 7.501421 -7.349762      10.57019 
1 1 1 2   3  24 o 201.5326 4.183353 495.3738       20.54499 492.6488       24.95682 501.1035       36.18859 200.8639 5.102737 202.3506 7.351119 -1.486710      8.948567 
1 1 1 2   3  25 o 195.2260 3.578177 464.8300       17.02298 441.2077       23.28927 491.9285       24.94408 190.0461 5.033190 200.6728 5.104999 -10.62665      7.168962 
1 1 1 2   3  26 o 83.19255 3.460098 84.57060       6.999385 89.02705       8.575715 75.67796       12.11410 85.30914 4.137478 78.39951 6.396306 6.909637       7.617838 
1 1 1 2   3  27 o 245.5145 4.130824 735.9357       24.71439 739.2756       34.92144 732.5845       34.98149 245.8245 5.829494 244.7033 5.866277 1.121216       8.270200 
1 1 1 2   3  28 o 170.3227 3.373831 354.0327       14.00335 353.8240       19.63737 354.2487       19.97438 170.0748 4.742762 170.1658 4.821731 -0.9097290E-01 6.763348 
1 1 1 2   3  29 o 105.7801 3.627183 136.7836       9.336123 148.0949       17.06619 131.9529       11.15297 109.7033 6.411774 103.8102 4.418846 5.893074       7.786979 
1 1 1 2   3  30 o 86.70638 3.072144 91.87785       6.480999 96.44563       9.165970 87.31097       9.165062 88.71918 4.251976 84.37695 4.473321 4.342232       6.171702 
1 1 1 2   3  31 o 95.34479 3.064657 111.0996       7.111324 114.0516       9.970274 108.0428       10.14589 96.47131 4.251486 93.86471 4.448248 2.606606       6.153214 
1 1 1 2   3  32 o 175.3337 3.484872 375.6855       14.88978 369.3207       20.77908 382.4029       21.34706 173.5190 4.919057 176.5565 4.966495 -3.037506      6.990221 
1 1 1 2   3  33 o 33.22156 6.272424 14.02948       4.891897 17.63476       7.599580 11.47866       6.392359 36.94582 8.602184 29.97477 8.410685 6.971046       12.03068 
1 1 1 2   3  34 o 43.08934 4.598034 23.02662       4.753606 16.51458       6.502784 30.50022       6.966361 35.82479 7.679420 49.42297 5.900599 -13.59818      9.684552 
1 1 1 2   3  35 o 31.20969 6.253114 12.45177       4.589920 7.951616       6.435487 17.11100       6.548235 25.88367 8.668501 36.44080 7.619485 -10.55712      11.54121 
1 1 1 2   3  36 o 49.74599 4.303753 30.61485       5.165982 39.25549       7.272004 21.81168       7.340075 56.16348 5.378955 41.19210 7.591885 14.97138       9.304294 
1 1 1 2   3  37 o 19.65620 7.429679 3.590715       4.870783 1.567520       5.814744 8.349382       8.917733 18.93379 7.802342 27.75100 10.13475 -8.817213      12.79022 
1 1 1 2   3  38 o 63.77120 3.788662 50.17373       5.861174 49.12151       7.907403 51.45676       8.731662 62.74877 5.218400 64.10732 5.646905 -1.358547      7.688904 
1 1 1 2   3  39 o 106.4838 3.261881 139.4797       8.454253 144.0059       11.96013 134.9596       11.95212 107.7126 4.566883 104.2037 4.719046 3.508911       6.567025 
1 1 1 2   3  40 o 31.90272 7.141725 13.54426       5.413599 0.5074273      9.548478 19.72001       6.571930 22.14077 9.593121 38.61362 7.250382 -16.47285      12.02481 
1 1 1 2   3  41 o 56.40960 3.962302 39.82043       5.412097 41.82458       7.429728 37.55478       7.899583 57.19142 5.394702 53.80145 6.134723 3.389965       8.169311 
1 1 1 2   3  42 o 21.86940 6.894984 6.400145       4.105034 1.316086       5.418627 13.24840       6.288887 17.46394 7.387299 30.47539 8.262365 -13.01145      11.08327 
1 1 1 2   3  43 o 47.02013 4.790763 28.75772       5.412801 30.83580       8.198355 27.15189       7.206851 46.76021 7.444041 44.24268 6.910324 2.517532       10.15708 
1 1 1 2   3  44 o 15.79390 6.288803 2.439815       3.632086 2.877185       4.961191 1.934638       5.331913 17.58944 7.223279 17.14843 7.293897 0.4410076      10.26532 
1 1 1 2   3  45 o 26.24194 6.939562 10.57933       4.504984 10.81268       5.565074 10.13572       7.673205 25.65205 8.019694 24.14718 9.277199 1.504868       12.26303 
1 1 1 2   3  46 o 29.95234 5.834582 13.36924       4.105525 10.13785       5.557867 17.25011       6.090847 23.77829 8.056083 31.68541 7.912588 -7.907114      11.29201 
1 1 1 2   3  47 o 16.67971 6.504027 4.178974       3.813406 4.468404       5.382318 3.887241       5.403687 17.41912 7.365143 16.96887 7.283219 0.4502487      10.35812 
1 1 1 2   3  48 o 12.55102 5.632928 0.6017013      3.578398 0.9034045E-01  5.055059 1.115318       5.066199 13.62296 6.328610 14.22484 6.509038 -0.6018896     9.078485 
1 1 1 2   3  49 o 18.47812 7.044118 7.210340       4.401035 0.9785773      8.514174 9.482536       5.141146 14.96651 7.285426 20.18296 7.632126 -5.216449      10.55115 
1 1 1 2   3  50 o 12.13650 5.507554 1.128608       3.532672 1.124322       5.029547 1.132781       4.963024 13.07756 6.151745 13.04780 6.129327 0.2976513E-01  8.684045 
1 1 1 2   4  0  o 441.4634 5.781810 2375.960       62.20060 2252.455       94.93787 2468.847       82.33256 429.6605 9.067301 449.9233 7.509257 -20.26288      11.77306 
1 1 1 2   4  1  o 189.6497 3.682843 438.3383       17.02046 435.4502       20.69618 444.3732       29.91743 189.0134 4.493260 190.7974 6.443759 -1.784012      7.855662 
1 1 1 2   4  2  o 368.8652 5.479969 1658.674       49.25858 1621.410       68.63026 1698.268       70.74204 364.6072 7.724213 373.1459 7.779699 -8.538727      10.96299 
1 1 1 2   4  3  o 544.0341 7.036101 3609.286       93.28124 3686.672       149.6471 3560.109       119.2931 549.4862 11.17572 540.1665 9.062577 9.319702       14.38843 
1 1 1 2   4  4  o 1103.321 15.72720 14894.47       422.8529 14252.07       579.6457 15625.22       618.2256 1077.085 22.08394 1127.604 22.49854 -50.51917      31.52593 
1 1 1 2   4  5  o 440.1439 7.458733 2362.786       80.00107 2552.444       146.3006 2281.882       95.55267 456.8047 13.15625 432.4409 9.067342 24.36380       15.97822 
1 1 1 2   4  6  o 624.4282 8.992727 4758.248       136.8390 4659.938       190.7238 4862.542       196.4421 617.4702 12.67514 630.7343 12.78062 -13.26410      18.00010 
1 1 1 2   4  7  o 904.6241 14.94801 10019.02       329.5244 9622.866       553.8350 10236.11       409.9911 882.0359 25.79436 913.2393 18.42272 -31.20337      31.69772 
1 1 1 2   4  8  o 656.0436 9.443750 5255.783       150.9779 5286.770       214.3159 5225.256       212.7229 657.2395 13.38119 653.4094 13.35958 3.830139       18.90858 
1 1 1 2   4  9  o 285.7917 4.423786 995.7712       30.80916 1000.170       43.63018 991.3965       43.51154 286.3387 6.252746 285.0795 6.263287 1.259216       8.850175 
1 1 1 2   4  10 o 168.7696 3.027435 347.1615       12.45103 335.5157       17.29535 359.6904       17.93912 165.8333 4.283364 171.7609 4.285888 -5.927521      6.059377 
1 1 1 2   4  11 o 141.2612 2.766296 243.2041       9.522649 249.0354       13.55585 237.5232       13.37999 142.8724 3.897159 139.5266 3.939106 3.345856       5.541155 
1 1 1 2   4  12 o 113.9919 2.559954 158.3609       7.111187 156.1202       9.933699 160.7162       10.18446 113.1130 3.608431 114.7658 3.646204 -1.652824      5.129871 
1 1 1 2   4  13 o 188.8760 4.642837 434.9310       21.36960 434.9310       21.36960 0.000000       0.000000 188.8760 4.642837 ?        ?        0.000000       4.642837 
1 1 1 2   4  14 o 613.7660 8.876884 4598.129       132.7698 4592.232       187.5481 4604.053       187.9825 612.8293 12.55848 613.6153 12.57144 -0.7859497     17.76954 
1 1 1 2   4  15 o 132.7871 2.787426 214.8729       9.019769 209.0569       12.55386 221.0789       12.96798 130.9090 3.939728 134.6230 3.957206 -3.714035      5.583989 
1 1 1 2   4  16 o 440.5677 6.518572 2366.724       69.98441 2411.378       100.1913 2324.178       97.79787 444.5406 9.248738 436.4326 9.195516 8.108002       13.04211 
1 1 1 2   4  17 o 569.5029 8.281188 3956.540       114.9277 3881.736       160.5822 4035.092       164.5552 563.7604 11.68872 574.7819 11.74823 -11.02148      16.57248 
1 1 1 2   4  18 o 444.4819 7.625142 2409.841       82.59203 2339.406       141.0583 2446.585       101.8824 437.2576 13.25339 447.7357 9.337732 -10.47815      16.21251 
1 1 1 2   4  19 o 450.1242 7.720243 2471.782       84.68362 2366.726       143.2980 2528.161       104.9754 439.7057 13.38901 455.0865 9.465801 -15.38089      16.39716 
1 1 1 2   4  20 o 422.6301 7.263134 2179.065       74.80327 2075.468       124.8745 2237.044       93.41904 411.7756 12.45882 428.0766 8.955253 -16.30103      15.34336 
1 1 1 2   4  21 o 146.5166 3.483346 261.6547       12.43712 248.4716       20.44157 269.4030       15.67151 142.6112 5.894701 148.5933 4.332510 -5.982132      7.315609 
1 1 1 2   4  22 f 639.8732 9.281967 5003.810       144.7338 5036.573       205.5960 4971.622       203.7851 640.9918 13.16213 636.8544 13.13095 4.137390       18.59203 
1 1 1 2   4  23 o 120.6640 2.974462 177.4748       8.746255 168.3930       12.11340 187.3660       12.64165 117.4353 4.239790 123.8854 4.193474 -6.450081      5.963309 
1 1 1 2   4  24 o 234.5504 3.977907 670.9512       22.73667 651.2451       31.55680 692.2245       32.78751 230.9721 5.606571 238.1247 5.650253 -7.152527      7.959836 
1 1 1 2   4  25 o 58.76805 4.756323 42.42926       6.753434 42.42926       6.753434 0.000000       0.000000 58.76805 4.756323 ?        ?        0.000000       4.756323 
1 1 1 2   4  26 o 175.7743 3.400665 376.8897       14.56650 379.3041       20.52058 374.4374       20.68064 176.1732 4.784272 175.0309 4.853250 1.142303       6.814932 
1 1 1 2   4  27 o 266.1886 5.042724 866.0269       32.71077 859.8176       39.86660 878.8195       57.22279 265.0283 6.172782 267.1621 8.801391 -2.133820      10.75024 
1 1 1 2   4  28 o 96.47028 3.029375 113.6549       7.112858 117.0650       9.892832 110.0054       10.23404 97.81053 4.159986 94.78088 4.443251 3.029648       6.086703 
1 1 1 2   4  29 o 136.6135 3.156557 227.7700       10.50856 216.8277       14.46264 240.0079       15.29495 133.1098 4.464952 140.0488 4.487389 -6.939011      6.330281 
1 1 1 2   4  30 o 145.8884 3.806651 260.2149       13.52162 252.5568       23.89291 263.8233       16.40065 143.1722 6.868198 146.7837 4.590726 -3.611526      8.261168 
1 1 1 2   4  31 o 200.8061 3.702391 492.7733       18.11738 488.6228       25.37175 497.0917       25.87948 199.6000 5.220677 201.3085 5.279981 -1.708481      7.425205 
1 1 1 2   4  32 o 85.77791 3.535672 90.08078       7.374822 83.92611       11.54977 94.31750       9.582660 82.45441 5.784792 87.64787 4.501589 -5.193466      7.329947 
1 1 1 2   4  33 o 137.3177 3.242974 230.4359       10.85191 228.8769       15.05077 232.1240       15.66128 136.5865 4.528094 137.5210 4.680101 -0.9345245     6.512064 
1 1 1 2   4  34 o 86.72269 3.244895 92.07269       6.845464 90.44219       9.425924 93.89240       9.957859 85.75813 4.526402 87.35284 4.695174 -1.594704      6.521731 
1 1 1 2   4  35 o 161.9093 3.447045 320.8220       13.60050 332.0705       19.23537 309.5767       19.23264 164.3132 4.809054 158.5909 4.982688 5.722275       6.924896 
1 1 1 2   4  36 o 122.7537 4.539449 185.5020       13.55579 185.5020       13.55579 0.000000       0.000000 122.7537 4.539449 ?        ?        0.000000       4.539449 
1 1 1 2   4  37 f 41.91117 4.807985 21.93295       4.821727 21.02718       6.588079 22.97782       7.075933 40.51380 6.921358 42.34182 7.109414 -1.828014      9.922145 
1 1 1 2   4  38 o 39.26405 5.066979 19.39587       4.735279 16.77215       6.502666 22.35792       6.909201 35.78723 7.685866 41.64667 7.059771 -5.859436      10.43613 
1 1 1 2   4  39 o 59.51459 3.750553 43.83039       5.411787 47.65751       7.449984 39.55469       7.874493 61.71159 4.996661 55.89896 5.868116 5.812634       7.707231 
1 1 1 2   4  40 o 14.38870 6.501630 -2.187085      4.860108 -6.897374      9.103191 -0.3091960     5.747842 18.06958 8.427308 17.06882 7.418910 1.000755       11.22763 
1 1 1 2   4  41 o 40.62498 4.697520 21.00333       4.564903 25.13326       6.327670 16.52125       6.591932 43.90133 6.077480 34.64837 7.972905 9.252953       10.02512 
1 1 1 2   4  42 o 58.23537 4.197605 42.95397       5.916988 33.09333       8.457649 52.40681       8.280919 49.25499 7.264130 63.59379 5.394373 -14.33880      9.048030 
1 1 1 2   4  43 o 31.36400 5.717702 13.31715       4.209113 11.82397       5.617951 15.22791       6.355152 28.40200 7.853605 32.10740 8.118793 -3.705404      11.29575 
1 1 1 2   4  44 o 21.72667 6.712736 6.828450       3.911787 4.203972       5.197400 10.25774       5.941094 18.98020 7.534120 25.62212 8.317726 -6.641922      11.22263 
1 1 1 2   4  45 o 19.86231 6.673662 5.872404       3.814079 3.964268       5.225626 8.047804       5.579602 18.18424 7.434214 22.34926 8.036862 -4.165012      10.94800 
1 1 1 2   4  46 o 14.94983 6.666717 0.9389028      4.927173 0.9389028      4.927173 0.000000       0.000000 14.94983 6.666717 ?        ?        0.000000       6.666717 
1 1 1 2   4  47 o 15.43884 6.528394 2.828658       4.229413 -0.4455799     5.206540 9.180997       7.252053 13.93571 6.456213 20.95284 8.681418 -7.017134      10.81895 
1 1 1 2   4  48 o 26.36856 6.271974 11.75214       3.971193 12.90184       5.671052 10.64593       5.562745 24.50426 8.135794 22.12270 8.015469 2.381561       11.42098 
1 1 1 2   4  49 o 14.42153 6.131288 3.213355       3.764700 0.9894634      5.525513 5.140151       5.143202 13.74169 6.459078 16.17195 7.023570 -2.430259      9.542024 
1 1 1 2   4  50 o 13.95650 5.994584 3.251894       3.665612 -3.622687      5.024863 11.07170       5.359190 11.03998 5.420834 20.36732 7.771032 -9.327340      9.474935 
1 1 1 2   5  0  o 413.5430 6.092834 2085.058       61.40110 2074.830       86.64628 2095.375       87.02351 412.3988 8.621770 414.4358 8.616744 -2.037018      12.18947 
1 1 1 2   5  1  o 272.3340 4.219429 903.9402       28.00217 981.1722       41.57102 839.7903       37.88697 283.6858 6.013356 262.4547 5.923787 21.23111       8.441072 
1 1 1 2   5  2  o 638.1404 10.61252 4971.202       165.0330 4783.620       196.6462 5418.029       303.5011 625.7026 12.89678 664.6077 18.75830 -38.90515      22.76402 
1 1 1 2   5  3  o 351.4360 5.253839 1505.571       44.99447 1432.337       61.63810 1589.110       65.83235 342.7043 7.380632 360.9677 7.484021 -18.26334      10.51115 
1 1 1 2   5  4  o 294.8642 5.221653 1059.891       37.52029 1094.250       66.72117 1044.000       45.37447 299.3152 9.158196 292.6110 6.363336 6.704224       11.15189 
1 1 1 2   5  5  o 511.8836 10.52077 3199.371       131.2366 0.000000       0.000000 3199.371       131.2366 ?        ?        511.8836 10.52077 0.000000       10.52077 
1 1 1 2   5  6  o 452.5917 7.646729 2498.908       84.33705 2389.053       141.0148 2560.084       105.2316 441.8160 13.11197 457.9526 9.429522 -16.13657      16.15053 
1 1 1 2   5  7  o 457.1043 6.690701 2548.578       74.52860 2591.969       106.5715 2507.044       104.2651 460.7316 9.491982 453.1259 9.442429 7.605682       13.38870 
1 1 1 2   5  8  o 234.2070 5.318681 668.8776       30.35568 668.8776       30.35568 0.000000       0.000000 234.2070 5.318681 ?        ?        0.000000       5.318681 
1 1 1 2   5  9  o 285.5641 4.418759 994.2461       30.74964 967.5852       42.73589 1022.866       44.27822 281.6196 6.227213 289.5499 6.275244 -7.930267      8.840637 
1 1 1 2   5  10 o 295.3724 4.555447 1063.822       32.78967 1091.866       47.05341 1037.347       45.71857 299.1281 6.455022 291.5658 6.434577 7.562317       9.114334 
1 1 1 2   5  11 o 324.1623 4.936098 1281.444       38.99261 1290.086       55.34467 1272.926       54.94527 325.1153 6.985577 322.9461 6.981748 2.169220       9.876390 
1 1 1 2   5  12 o 160.0715 3.387312 312.3113       13.21312 312.9483       16.32906 311.1033       22.48797 160.1650 4.187262 159.6026 5.791552 0.5624390      7.146694 
1 1 1 2   5  13 o 321.9940 5.701100 1264.329       44.73449 1266.603       54.64363 1259.707       77.89663 322.2183 6.959103 320.9788 9.970875 1.239471       12.15925 
1 1 1 2   5  14 o 386.7007 5.783198 1823.298       54.49782 1779.728       75.79601 1869.930       78.41375 381.9221 8.143957 391.4759 8.219608 -9.553802      11.57091 
1 1 1 2   5  15 o 415.9224 6.181564 2109.245       62.65371 2134.130       89.22259 2085.035       88.00149 418.2254 8.754438 413.3881 8.735665 4.837341       12.36738 
1 1 1 2   5  16 o 806.0156 11.55706 7933.757       227.0005 8162.846       327.3128 7721.458       315.0903 816.6207 16.44775 794.2725 16.27906 22.34814       23.14166 
1 1 1 2   5  17 o 701.1161 10.10072 6000.251       172.5751 5946.574       242.6206 6055.220       245.5215 697.3461 14.27720 703.6805 14.31785 -6.334351      20.21978 
1 1 1 2   5  18 o 505.1352 8.569456 3113.405       105.4865 3202.903       187.0709 3071.681       127.7304 511.3767 15.02798 501.5663 10.45032 9.810425       18.30435 
1 1 1 2   5  19 o 384.9091 5.798577 1806.489       54.38958 1796.573       76.66881 1816.535       77.17061 383.7131 8.199285 385.8385 8.207489 -2.125336      11.60134 
1 1 1 2   5  20 o 362.8802 6.348259 1606.069       56.13763 1609.018       96.50327 1604.560       69.01678 362.6965 10.93097 362.6172 7.810343 0.7922363E-01  13.43456 
1 1 1 2   5  21 o 797.2488 11.47056 7774.573       222.8510 7884.294       318.3007 7669.079       312.1082 801.2768 16.30118 790.3008 16.20603 10.97601       22.98616 
1 1 1 2   5  22 o 206.5935 3.646203 520.2991       18.35666 507.1288       25.58987 534.2604       26.34716 203.8469 5.155568 209.2950 5.165814 -5.448151      7.298323 
1 1 1 2   5  23 o 87.10197 2.948596 92.58535       6.249608 90.13858       8.720144 95.16934       8.961351 85.87281 4.179635 88.24215 4.179239 -2.369339      5.910616 
1 1 1 2   5  24 f 403.3875 6.083285 1987.319       59.79939 1953.922       83.56302 2022.374       85.61243 399.5213 8.582979 406.4458 8.643667 -6.924530      12.18115 
1 1 1 2   5  25 f 179.9140 4.788763 395.4141       20.97675 395.4141       20.97675 0.000000       0.000000 179.9140 4.788763 ?        ?        0.000000       4.788763 
1 1 1 2   5  26 o 293.5253 4.695101 1052.177       33.58355 1030.375       46.80757 1075.306       48.21218 290.1417 6.620181 296.3890 6.675112 -6.247375      9.401272 
1 1 1 2   5  27 o 110.9063 2.983395 150.1476       8.055797 157.2922       11.32170 142.8211       11.46488 113.4249 4.102826 108.0493 4.363205 5.375626       5.989219 
1 1 1 2   5  28 o 185.1704 4.035376 418.7734       18.20924 410.6673       22.03913 436.2100       32.32353 183.1954 4.941292 188.3994 7.052948 -5.203964      8.611645 
1 1 1 2   5  29 o 189.3481 3.572982 437.7720       16.48648 422.3879       22.70449 454.9309       23.97843 185.7329 5.020945 192.7435 5.109615 -7.010544      7.163662 
1 1 1 2   5  30 o 135.5968 3.778608 224.8218       12.47365 215.4866       21.97840 229.2574       15.14997 132.2155 6.844769 136.8210 4.550170 -4.605499      8.219180 
1 1 1 2   5  31 o 132.4133 3.580640 214.3975       11.54329 194.4262       17.98178 228.3963       15.05480 125.7028 5.886528 136.5266 4.531309 -10.82375      7.428591 
1 1 1 2   5  32 o 146.7376 3.274417 263.0672       11.70877 259.1826       16.23002 267.2833       16.90820 145.3897 4.586623 147.6222 4.706142 -2.232483      6.571521 
1 1 1 2   5  33 o 57.87142 3.720095 41.13655       5.218527 41.61767       7.053956 40.55488       7.756141 58.01817 5.039149 57.16121 5.641589 0.8569527      7.564426 
1 1 1 2   5  34 o 232.9166 4.097995 664.6425       23.25991 710.9420       33.83726 623.1661       32.02636 240.2438 5.779721 224.8215 5.850633 15.42235       8.224054 
1 1 1 2   5  35 o 205.4665 3.824767 517.2463       19.15058 508.0466       26.56979 527.1927       27.62718 203.0155 5.375328 206.7577 5.488112 -3.742157      7.682026 
1 1 1 2   5  36 o 139.6278 4.629993 240.0720       15.73212 240.0720       15.73212 0.000000       0.000000 139.6278 4.629993 ?        ?        0.000000       4.629993 
1 1 1 2   5  37 o 31.04460 6.133031 12.37817       4.475150 12.59069       5.928981 12.09678       6.822253 31.04543 7.837223 30.48915 8.734576 0.5562859      11.73520 
1 1 1 2   5  38 o 107.9353 3.239408 143.0728       8.510860 146.1319       11.90645 139.8766       12.17023 108.6880 4.505129 106.2573 4.711782 2.430649       6.518978 
1 1 1 2   5  39 o 55.25604 3.960490 37.89204       5.297548 31.08850       7.026299 46.85406       8.064217 49.43729 5.951834 60.99530 5.483853 -11.55802      8.093020 
1 1 1 2   5  40 o 45.38457 4.543154 25.93120       4.957129 24.71796       6.899712 27.22558       7.126673 43.49023 6.727282 45.74474 6.582324 -2.254513      9.411870 
1 1 1 2   5  41 f 53.03018 4.061989 35.31219       5.209301 31.94198       7.148251 39.12915       7.607288 49.54053 6.046228 55.04721 5.755964 -5.506683      8.347934 
1 1 1 2   5  42 o 31.77134 5.836049 13.48067       4.352002 9.053041       5.681284 19.76833       6.770262 25.44876 8.122142 37.59813 7.649905 -12.14937      11.15752 
1 1 1 2   5  43 o 14.80057 6.164009 1.266166       3.682796 2.801935       4.868505 -0.7881699     5.630776 17.75726 7.207034 15.86620 7.097509 1.891060       10.11514 
1 1 1 2   5  44 o 30.86727 5.818247 13.31583       4.216018 16.51426       5.709989 9.482068       6.251429 33.35788 7.233074 24.58660 8.536955 8.771278       11.18915 
1 1 1 2   5  45 o 26.42115 6.571120 10.59422       4.213207 11.04851       5.793802 10.08438       6.137818 25.55653 8.206892 24.27024 8.457114 1.286291       11.78456 
1 1 1 2   5  46 o 19.46883 7.193887 6.157750       4.514454 8.665141       5.459343 0.7353574      8.028324 22.01911 7.945697 17.10415 7.955895 4.914967       11.24413 
1 1 1 2   5  47 o 16.38444 6.403491 4.030810       3.703281 6.367797       5.086152 1.393950       5.402624 18.95155 7.474991 15.12797 6.843439 3.823580       10.13450 
1 1 1 2   5  48 o 14.50920 6.069355 2.846098       3.593868 -1.311134      5.028617 7.186398       5.138145 12.78007 6.053723 18.81017 7.483117 -6.030101      9.625207 
1 1 1 2   5  49 o 21.10936 6.680202 8.784028       3.849986 15.96859       5.636121 2.498865       5.271550 26.47172 8.034766 14.36858 6.598884 12.10315       10.39725 
1 1 1 2   5  50 o 15.00974 6.741075 4.562759       5.134655 0.000000       0.000000 4.562759       5.134655 ?        ?        15.00974 6.741075 0.000000       6.741075 
1 1 1 2   6  0  o 331.2714 5.767200 1337.885       46.55701 1327.851       56.83960 1358.344       81.15810 329.9801 7.068499 333.4571 9.998771 -3.477051      12.24496 
1 1 1 2   6  1  o 389.5886 5.778091 1850.409       54.85632 1732.463       74.24001 1992.244       81.41220 376.8644 8.083823 404.1227 8.266852 -27.25830      11.56240 
1 1 1 2   6  2  o 866.8344 12.38764 9180.244       261.6741 9568.802       380.8270 8832.709       360.1632 883.7500 17.68325 849.1509 17.40517 34.59912       24.81204 
1 1 1 2   6  3  o 248.3227 4.483235 751.6222       27.12964 829.8870       49.77234 718.5405       32.35931 260.7144 7.842978 242.7745 5.469656 17.93993       9.561874 
1 1 1 2   6  4  o 418.1986 6.146425 2132.508       62.63849 2111.570       124.2466 2139.644       72.53032 415.5036 12.28431 418.8459 7.106066 -3.342285      14.19156 
1 1 1 2   6  5  o 271.3965 4.901448 897.9139       32.41639 890.8802       39.36259 912.7378       57.14470 270.2980 5.975919 273.3499 8.589350 -3.051819      10.46368 
1 1 1 2   6  6  o 115.3646 2.435803 162.1856       6.847797 156.1570       9.579795 168.4844       9.792193 113.1386 3.478769 117.5257 3.422739 -4.387146      4.880264 
1 1 1 2   6  7  o 228.9881 4.304398 639.2178       24.01936 644.5884       29.36152 628.3525       41.76269 229.9203 5.240407 226.7896 7.567245 3.130737       9.204622 
1 1 1 2   6  8  o 511.4745 7.445775 3193.195       92.80471 3168.494       130.5838 3218.404       131.9177 509.0415 10.52689 513.0307 10.55173 -3.989227      14.90485 
1 1 1 2   6  9  o 289.8677 4.479283 1024.493       31.64058 1037.159       45.05162 1012.165       44.44758 291.5519 6.341009 288.0181 6.332749 3.533875       8.961702 
1 1 1 2   6  10 o 234.9305 3.798655 672.8309       21.74730 656.0006       30.29862 690.7156       31.23333 231.9152 5.361146 237.9713 5.385890 -6.056168      7.599322 
1 1 1 2   6  11 o 301.0295 5.328487 1105.162       39.08851 1101.425       47.97287 1112.544       67.42469 300.4489 6.552226 301.6198 9.183944 -1.170868      11.28169 
1 1 1 2   6  12 o 62.88955 2.297405 48.26205       3.514971 42.17875       4.753797 55.59927       5.220797 58.73246 3.335147 67.46638 3.184497 -8.733921      4.611314 
1 1 1 2   6  13 o 734.7764 12.21171 6600.738       218.6592 6772.422       272.2965 6289.023       366.9065 743.6226 15.02635 714.5148 21.09521 29.10779       25.89979 
1 1 1 2   6  14 o 617.2246 8.926386 4648.957       134.2626 4534.960       186.6279 4771.250       193.2997 609.1535 12.57227 624.8030 12.69557 -15.64948      17.86727 
1 1 1 2   6  15 f 218.2895 3.660261 580.7272       19.47067 575.2795       27.34119 586.3328       27.73440 217.2383 5.164697 219.3149 5.189369 -2.076584      7.321451 
1 1 1 2   6  16 o 297.1191 4.638768 1076.036       33.58685 1046.446       46.63384 1107.927       48.41413 292.9526 6.532325 301.4336 6.590895 -8.481049      9.279611 
1 1 1 2   6  17 o 146.3256 2.972574 260.9254       10.59959 263.1736       14.97339 258.6673       15.00684 146.8834 4.187499 145.6176 4.233510 1.265839       5.954641 
1 1 1 2   6  18 o 575.5819 9.686202 4044.191       135.8616 4031.634       235.7004 4050.440       166.2615 573.3530 16.88790 575.7595 11.84989 -2.406494      20.63059 
1 1 1 2   6  19 o 188.8349 3.872460 434.6263       17.81991 404.2556       28.84431 453.3731       22.66188 181.9458 6.516043 192.7863 4.827536 -10.84048      8.109495 
1 1 1 2   6  20 o 157.5357 3.139909 302.4651       12.05403 288.1678       16.66094 318.1688       17.46113 153.6830 4.453444 161.4918 4.441178 -7.808838      6.289454 
1 1 1 2   6  21 o 163.5908 3.226512 326.1864       12.86259 328.4248       18.18844 323.9469       18.19245 164.0616 4.553789 162.9367 4.586364 1.124832       6.463105 
1 1 1 2   6  22 o 181.9182 3.400362 403.4218       15.07432 411.0434       21.39733 395.9118       21.24014 183.5246 4.788509 180.1092 4.843727 3.415405       6.811131 
1 1 1 2   6  23 o 249.2451 4.129163 757.6150       25.07984 751.0146       35.20089 764.4198       35.74179 248.0471 5.823491 250.2482 5.860968 -2.201096      8.262202 
1 1 1 2   6  24 o 211.8322 4.262486 547.4249       22.00347 544.1418       26.90479 554.0558       38.23605 211.1305 5.229287 212.7227 7.387248 -1.592194      9.050794 
1 1 1 2   6  25 o 115.7028 3.423500 163.4232       9.642115 167.5953       11.67852 154.4896       17.08945 117.1244 4.098019 112.2373 6.273160 4.887108       7.493083 
1 1 1 2   6  26 o 118.5258 2.961933 171.3357       8.555085 164.5029       11.71996 179.1292       12.51674 116.0110 4.152330 121.0562 4.249544 -5.045151      5.941420 
1 1 1 2   6  27 o 93.66587 2.947078 107.1248       6.718438 105.4250       9.258776 109.0151       9.763953 92.82618 4.103189 94.38194 4.256176 -1.555763      5.911953 
1 1 1 2   6  28 o 334.6472 5.234563 1370.118       42.68779 1387.723       60.64150 1352.825       60.10144 336.1042 7.403889 331.8408 7.432229 4.263428       10.49074 
1 1 1 2   6  29 o 69.83221 3.616107 59.70974       6.132695 56.95449       7.323040 66.17945       11.22154 68.11150 4.436131 73.17562 6.355869 -5.064117      7.750892 
1 1 1 2   6  30 o 91.55083 3.781498 102.5881       8.418338 98.53794       15.31248 104.3425       10.07803 89.20887 7.102301 92.24609 4.496783 -3.037216      8.406173 
1 1 1 2   6  31 o 46.59652 4.326087 26.79379       4.856201 30.37882       7.275023 23.91255       6.521940 49.34251 6.185876 43.66512 6.312186 5.677391       8.837915 
1 1 1 2   6  32 o 143.4366 3.235608 251.3626       11.30972 260.7490       15.95758 241.8891       16.03139 145.8389 4.495484 140.4218 4.691490 5.417068       6.497650 
1 1 1 2   6  33 o 67.07718 3.472965 55.16238       5.657568 52.75655       7.620912 58.11618       8.444316 65.40528 4.815188 68.61841 5.086118 -3.213127      7.003901 
1 1 1 2   6  34 o 103.9725 3.179631 132.2869       8.046749 132.1201       11.19273 132.4653       11.57662 103.6954 4.439628 103.8016 4.587922 -0.1062241     6.384303 
1 1 1 2   6  35 o 215.8146 4.530395 572.0489       23.82610 561.9117       28.72176 594.4185       42.66587 213.4111 5.527435 217.9993 8.045166 -4.588226      9.761006 
1 1 1 2   6  36 o 99.46285 3.275673 121.2579       7.928750 115.3197       10.66914 128.5827       11.84939 96.72895 4.538891 102.0901 4.776190 -5.361183      6.588894 
1 1 1 2   6  37 f 105.5622 3.291012 136.7280       8.455573 142.9393       11.51213 129.4518       12.46001 107.6438 4.397909 102.2400 5.016369 5.403770       6.671249 
1 1 1 2   6  38 o 85.34713 3.342555 89.57722       6.938459 92.45405       9.533954 86.33783       10.11690 86.37482 4.545494 83.31151 5.006273 3.063316       6.761973 
1 1 1 2   6  39 o 16.35589 6.558702 1.789573       3.978805 2.122891       5.360733 1.380734       5.937060 18.59580 7.556980 18.71513 7.812804 -0.1193314     10.86958 
1 1 1 2   6  40 o 90.29459 3.300646 100.7737       7.250457 89.36233       9.731569 115.0111       10.87002 84.37641 4.752088 95.79978 4.670252 -11.42337      6.662852 
1 1 1 2   6  41 o 25.22947 8.456473 8.478344       6.124379 0.000000       0.000000 8.478344       6.124379 ?        ?        25.22947 8.456473 0.000000       8.456473 
1 1 1 2   6  42 f 41.24675 4.617709 21.89473       4.561863 19.61203       6.051186 24.90015       6.943339 37.87950 6.805544 42.71726 6.905540 -4.837761      9.695458 
1 1 1 2   6  43 o 24.01305 6.638952 8.168388       4.014918 5.141449       5.234393 12.49427       6.257516 20.33753 7.698664 28.73242 8.405564 -8.394892      11.39837 
1 1 1 2   6  44 o 29.73367 5.762218 12.39591       4.024384 9.366377       5.227207 16.80507       6.306087 24.61287 7.783219 32.90704 7.952968 -8.294174      11.12781 
1 1 1 2   6  45 o 21.73842 7.733175 7.633352       5.151442 7.633352       5.151442 0.000000       0.000000 21.73842 7.733175 ?        ?        0.000000       7.733175 
1 1 1 2   6  46 o 18.52130 6.974199 5.400571       4.282681 8.228322       5.268590 -0.1071887     7.352944 21.52695 7.800517 16.22436 7.569129 5.302588       10.86921 
1 1 1 2   6  47 o 14.90915 6.155062 2.791206       3.627460 0.1165664      4.933715 5.938296       5.351752 13.89820 6.383255 18.42915 7.527565 -4.530952      9.869660 
1 1 1 2   6  48 o 8.299823 4.134041 -6.451495      3.325785 -6.138128      4.645122 -6.781087      4.763867 10.33780 5.102222 10.27518 5.088667 0.6262779E-01  7.206053 
1 1 1 2   6  49 o 13.84038 5.906842 2.800160       3.517707 5.207393       4.958138 0.3603150      4.991609 16.08500 6.940899 12.99785 6.118676 3.087148       9.252798 
1 1 1 2   6  50 o 12.04969 5.782554 -0.6318263     4.908795 0.000000       0.000000 -0.6318263     4.908795 ?        ?        12.04969 5.782554 0.000000       5.782554 
1 1 1 2   7  0  o 458.7793 9.509892 2568.917       106.3201 0.000000       0.000000 2568.917       106.3201 ?        ?        458.7793 9.509892 0.000000       9.509892 
1 1 1 2   7  1  o 266.2166 4.802726 863.9077       31.15725 822.7274       52.20856 886.6870       38.82999 259.5514 8.264872 269.6732 5.908721 -10.12173      10.15978 
1 1 1 2   7  2  o 184.2027 3.649067 413.5343       16.38000 416.9229       28.05335 411.7815       20.17653 184.8044 6.238200 183.7993 4.504706 1.005142       7.694642 
1 1 1 2   7  3  o 524.4777 6.815204 3354.875       87.10478 3338.177       137.0915 3366.180       112.8005 522.7973 10.76072 525.1916 8.813676 -2.394287      13.90949 
1 1 1 2   7  4  o 705.9551 9.064776 6083.454       155.9445 5838.456       239.7223 6263.194       205.3286 690.6724 14.24296 715.8621 11.77020 -25.18970      18.47700 
1 1 1 2   7  5  o 382.6394 5.086236 1785.087       47.42663 1815.257       75.93371 1765.789       60.72853 385.6744 8.079373 380.4867 6.549636 5.187683       10.40067 
1 1 1 2   7  6  o 329.4604 5.784130 1323.764       46.43840 1290.392       55.78564 1399.083       83.80727 325.2093 7.039201 338.2268 10.17963 -13.01749      12.37640 
1 1 1 2   7  7  f 395.9973 5.877424 1912.800       56.71727 1909.503       80.14427 1916.108       80.27657 395.4374 8.316846 396.1208 8.316203 -0.6834106     11.76134 
1 1 1 2   7  8  o 152.8546 2.842737 284.7632       10.58891 276.1030       14.81492 293.8082       15.14036 150.4367 4.044860 155.1903 4.006810 -4.753632      5.693454 
1 1 1 2   7  9  o 208.4366 3.972851 529.6586       20.17959 536.3403       25.14472 517.5681       33.82425 209.7160 4.920160 205.8254 6.752761 3.890625       8.355103 
1 1 1 2   7  10 o 240.9971 4.442147 708.1376       26.08800 706.9371       32.17323 710.4423       44.57662 240.7509 5.483915 241.1163 7.596030 -0.3653870     9.368724 
1 1 1 2   7  11 o 214.5150 4.070760 560.9629       21.27988 520.3525       34.60158 585.6658       26.98681 206.3957 6.889190 219.1584 5.053095 -12.76263      8.543694 
1 1 1 2   7  12 o 453.4570 6.668995 2508.132       73.69408 2502.284       104.0486 2514.018       104.3906 452.6822 9.432061 453.7414 9.440978 -1.059235      13.34525 
1 1 1 2   7  13 o 713.1217 11.85843 6214.018       206.0758 6177.902       251.1427 6288.452       360.5424 710.5445 14.50418 715.0020 20.71434 -4.457458      25.28745 
1 1 1 2   7  14 f 312.1102 4.807395 1187.407       36.56402 1160.586       50.96238 1215.861       52.49014 308.5029 6.778824 315.7622 6.821525 -7.259369      9.616946 
1 1 1 2   7  15 o 206.1824 3.527328 518.0842       17.72285 517.8263       24.96984 518.3461       25.15903 206.1098 4.971426 206.2126 5.006596 -0.1028290     7.055571 
1 1 1 2   7  16 o 80.88168 2.552373 79.79722       5.024426 71.86547       6.757790 89.60171       7.513336 76.70492 3.625570 85.66860 3.607015 -8.963684      5.114226 
1 1 1 2   7  17 o 217.6483 3.688010 577.3350       19.56066 567.2611       27.34215 587.8959       27.99532 215.7138 5.201380 219.6016 5.231351 -3.887726      7.377085 
1 1 1 2   7  18 o 261.7846 5.980742 835.6359       38.15358 0.000000       0.000000 835.6359       38.15358 ?        ?        261.7846 5.980742 0.000000       5.980742 
1 1 1 2   7  19 o 321.9438 5.796552 1263.891       45.47638 1325.807       82.10049 1236.485       54.62130 329.3012 10.24342 318.3745 7.040245 10.92676       12.42951 
1 1 1 2   7  20 o 437.7090 6.508359 2337.151       69.42136 2389.150       99.53018 2287.888       96.87682 442.2886 9.234490 432.8197 9.184948 9.468933       13.02456 
1 1 1 2   7  21 f 259.8637 4.235977 823.3083       26.82473 797.3395       37.17715 851.5110       38.74308 255.6558 5.967388 264.1951 6.017738 -8.539261      8.474838 
1 1 1 2   7  22 o 77.09803 3.260371 72.58879       6.111741 61.58469       9.090366 81.66625       8.256320 70.85297 5.303342 81.73230 4.158979 -10.87933      6.739625 
1 1 1 2   7  23 o 133.9834 3.422609 219.0190       11.16577 212.5867       13.63621 232.1073       19.45147 131.9523 4.246256 137.7654 5.806993 -5.813004      7.193877 
1 1 1 2   7  24 o 90.85931 2.898869 100.7518       6.410295 108.2072       9.030510 93.17962       9.100955 94.10172 3.946789 87.28568 4.291821 6.816032       5.830683 
1 1 1 2   7  25 o 237.9505 4.017888 690.9286       23.29810 704.0286       33.16113 678.1594       32.73989 240.0168 5.669590 235.5616 5.703436 4.455139       8.041980 
1 1 1 2   7  26 o 256.5234 4.921700 804.0306       30.76651 811.5420       37.65236 788.9390       53.37081 257.5445 5.999345 253.2213 8.661783 4.323212       10.53654 
1 1 1 2   7  27 o 220.9119 3.853333 595.8265       20.74397 570.8679       28.50960 623.9059       30.23958 215.9555 5.421686 225.8226 5.495058 -9.867081      7.719478 
1 1 1 2   7  28 o 181.5498 3.464720 402.3497       15.32851 414.0443       21.73264 390.7725       21.62336 183.9421 4.852602 178.6752 4.971014 5.266922       6.946850 
1 1 1 2   7  29 o 127.3772 3.085727 198.0281       9.578231 202.1196       13.35860 193.6991       13.74081 128.5163 4.271402 125.7789 4.490202 2.737427       6.197321 
1 1 1 2   7  30 o 244.2111 8.407997 738.0187       49.96268 0.000000       0.000000 738.0187       49.96268 ?        ?        244.2111 8.407997 0.000000       8.407997 
1 1 1 2   7  31 o 158.9300 3.339508 308.5679       12.93375 322.7842       18.37103 294.5964       18.21218 162.2860 4.650122 154.9966 4.827624 7.289459       6.702954 
1 1 1 2   7  32 o 56.94442 3.655466 39.81189       5.045801 47.07732       6.927793 31.60309       7.363833 61.81230 4.632925 50.31763 6.131968 11.49467       7.685378 
1 1 1 2   7  33 o 64.72509 3.461092 51.37355       5.439260 53.19964       7.370203 49.18930       8.060634 65.70528 4.632720 63.05613 5.294579 2.649155       7.035244 
1 1 1 2   7  34 o 70.20451 3.444104 60.44204       5.874215 60.46563       7.908293 60.41299       8.773739 70.03185 4.660465 69.90394 5.187442 0.1279144      6.973485 
1 1 1 2   7  35 o 92.39008 3.708356 104.7491       8.332198 101.6000       9.868191 112.5697       15.55114 90.84158 4.471501 95.01810 6.760296 -4.176514      8.105302 
1 1 1 2   7  36 o 90.94671 3.227565 101.4003       7.141822 105.9468       9.815125 96.28468       10.41135 92.73619 4.355375 88.27699 4.858489 4.459206       6.524891 
1 1 1 2   7  37 o 43.19355 5.173159 23.39850       5.336982 22.47962       6.172627 26.11973       10.62245 42.06415 6.208089 44.21013 10.08377 -2.145981      11.84157 
1 1 1 2   7  38 o 29.38270 6.279822 11.20903       4.360116 6.482080       5.748988 17.60936       6.689628 23.51434 8.185405 36.59418 7.743513 -13.07984      11.26778 
1 1 1 2   7  39 o 52.36181 4.030804 34.11284       5.103749 36.88073       6.844408 30.64618       7.659807 54.07597 5.260323 48.76102 6.616856 5.314949       8.453033 
1 1 1 2   7  40 o 71.25246 3.951157 63.26311       6.833708 53.25113       9.963935 72.15530       9.390209 64.16352 6.460302 75.54830 5.130966 -11.38478      8.249990 
1 1 1 2   7  41 o 24.32709 7.871132 7.945739       5.322832 10.09025       9.913273 7.077007       6.309510 27.96649 10.59289 23.73296 8.544878 4.233530       13.60971 
1 1 1 2   7  42 o 55.19321 3.853591 38.51802       5.150513 34.84312       6.770817 43.56493       7.934708 51.54300 5.474195 57.48844 5.740559 -5.945442      7.932265 
1 1 1 2   7  43 o 14.21557 6.009138 0.9015871      3.581421 -0.3588392     4.633425 2.772318       5.644807 14.70787 6.517201 18.36647 7.638755 -3.658607      10.04114 
1 1 1 2   7  44 o 31.89921 6.368749 14.68152       4.777268 17.56303       5.617165 7.148792       9.082042 34.49398 6.923353 22.75510 9.591455 11.73888       11.82915 
1 1 1 2   7  45 o 15.77919 6.321980 2.863610       3.693459 1.875240       4.830528 4.254705       5.730772 15.86642 6.848812 18.42510 7.682588 -2.558674      10.29215 
1 1 1 2   7  46 f 11.95815 5.458728 -0.7326411     3.535278 0.1237958E-01  4.776073 -1.635550      5.257857 14.03372 6.382389 13.60257 6.363854 0.4311562      9.012965 
1 1 1 2   7  47 o 27.06900 6.734635 12.45626       4.424346 11.38102       5.307827 14.90417       8.008707 24.12319 7.864154 24.37694 9.447884 -0.2537441     12.29258 
1 1 1 2   7  48 o 9.486679 4.605372 -3.556360      3.340254 -0.6924544     4.941247 -5.966373      4.532804 12.87763 6.069981 10.21465 5.041201 2.662980       7.890397 
1 1 1 2   7  49 o 11.72823 5.464163 -0.1119630     3.811235 2.819399       5.783715 -2.361772      5.066931 14.56748 6.768072 11.77439 5.705645 2.793090       8.852185 
1 1 1 2   7  50 o 11.84520 5.611639 -0.1037416     4.323758 -14.16456      8.488433 4.822649       5.024428 11.15468 5.678218 15.07063 6.725616 -3.915949      8.802050 
1 1 1 2   8  0  o 228.0302 3.711551 633.7532       20.62452 595.9065       28.14383 677.6549       30.31162 221.0843 5.223833 235.7602 5.275973 -14.67595      7.424575 
1 1 1 2   8  1  o 88.17318 2.323445 94.80521       4.987999 99.70313       7.128653 90.10696       6.981831 90.39037 3.241552 85.92012 3.340926 4.470245       4.655045 
1 1 1 2   8  2  o 383.1373 5.709228 1789.944       53.30500 1808.761       75.89596 1771.627       74.88354 385.0011 8.089480 381.0302 8.064749 3.970856       11.42278 
1 1 1 2   8  3  o 234.4862 3.788509 670.1814       21.64820 720.3126       31.85498 627.1601       29.50970 243.0551 5.378196 226.7961 5.339407 16.25897       7.578539 
1 1 1 2   8  4  o 180.9820 2.809138 399.1783       12.38923 402.5795       19.69892 396.9525       15.93548 181.7229 4.448326 180.4642 3.623580 1.258682       5.737415 
1 1 1 2   8  5  o 258.8697 5.798783 817.3248       36.58088 817.3248       36.58088 0.000000       0.000000 258.8697 5.798783 ?        ?        0.000000       5.798783 
1 1 1 2   8  6  o 306.5098 4.196761 1145.366       31.34691 1157.403       50.04358 1137.594       40.21371 307.9813 6.667882 305.4105 5.403239 2.570831       8.582287 
1 1 1 2   8  7  o 262.2704 4.136628 838.6118       26.43819 846.1830       37.71270 831.2948       37.07397 263.3725 5.875991 261.0478 5.827911 2.324707       8.275979 
1 1 1 2   8  8  o 474.1666 8.011577 2745.643       92.57314 2777.796       114.5625 2685.148       157.1425 476.6591 9.862763 467.6820 13.80328 8.977020       16.96481 
1 1 1 2   8  9  o 444.8822 7.545623 2416.175       81.80431 2428.565       100.8250 2392.305       139.9414 445.8026 9.280887 441.6563 13.01667 4.146301       15.98651 
1 1 1 2   8  10 o 165.1297 3.007822 332.3335       12.10357 320.3441       16.85634 345.0944       17.39020 162.0452 4.272382 168.1941 4.246247 -6.148865      6.023609 
1 1 1 2   8  11 o 677.4812 9.759891 5605.885       161.1307 5787.193       232.7665 5439.061       223.2761 687.5034 13.89343 666.5382 13.74615 20.96515       19.54441 
1 1 1 2   8  12 o 432.0811 6.387136 2276.731       67.25237 2356.648       97.35303 2203.780       93.01372 439.4044 9.091781 424.9231 8.982570 14.48135       12.78073 
1 1 1 2   8  13 o 79.81450 4.114150 77.84943       7.974986 74.63713       11.21561 81.13461       11.34212 78.01533 5.944139 81.37416 5.756839 -3.358833      8.274900 
1 1 1 2   8  14 o 423.3282 7.280694 2185.491       75.10798 2295.686       135.2028 2136.306       90.32801 433.2745 12.81930 418.4476 8.858195 14.82690       15.58211 
1 1 1 2   8  15 o 263.4721 4.201263 846.0674       26.97433 854.6235       38.34671 837.6869       37.95129 264.7614 5.943431 262.1249 5.941310 2.636536       8.403782 
1 1 1 2   8  16 o 399.9940 5.978411 1950.707       58.27407 1991.461       83.48799 1911.988       81.37653 404.0195 8.479800 395.8785 8.435312 8.140991       11.96083 
1 1 1 2   8  17 o 436.6059 7.449023 2325.192       79.25470 2206.592       131.6000 2392.688       99.27740 424.6922 12.73022 442.7707 9.201010 -18.07843      15.70723 
1 1 1 2   8  18 o 281.3760 5.211342 965.2451       35.73327 1106.408       68.31329 912.0726       41.92648 300.9093 9.327349 273.4791 6.291122 27.43021       11.25067 
1 1 1 2   8  19 o 626.6761 10.51314 4798.443       160.5505 4800.752       279.1611 4797.301       196.2550 624.7897 18.35507 626.1697 12.86153 -1.380066      22.41266 
1 1 1 2   8  20 o 111.3887 3.439615 151.3756       9.325379 162.6776       17.97955 147.2163       10.90717 115.2981 6.424529 109.8164 4.082872 5.481766       7.612123 
1 1 1 2   8  21 o 374.7813 5.684064 1713.516       51.91261 1685.067       72.55624 1743.354       74.30608 371.4346 8.015973 377.7978 8.071028 -6.363129      11.37529 
1 1 1 2   8  22 o 99.11765 3.203673 119.8886       7.727952 114.3628       9.439350 131.1210       13.45798 96.76026 4.011919 103.5269 5.352636 -6.766663      6.689260 
1 1 1 2   8  23 o 225.5768 4.405629 620.7584       24.21800 571.6860       38.77470 652.1461       31.01060 216.1164 7.373288 231.1305 5.505754 -15.01416      9.202104 
1 1 1 2   8  24 o 207.7280 3.675501 526.3369       18.60578 535.2052       26.37290 517.5493       26.25259 209.3606 5.169242 205.8062 5.238787 3.554352       7.359753 
1 1 1 2   8  25 o 181.5781 3.411827 402.2002       15.09685 404.5865       21.23781 399.7627       21.46435 181.9494 4.794039 180.8515 4.874788 1.097885       6.837132 
1 1 1 2   8  26 o 34.01118 5.017951 14.43934       4.034181 13.30459       4.534263 18.74927       8.836713 32.47125 5.949400 38.27118 9.515495 -5.799923      11.22230 
1 1 1 2   8  27 o 220.9624 3.849688 596.1453       20.72908 583.8457       28.81123 609.3450       29.84689 218.4482 5.412243 223.1545 5.488547 -4.706299      7.708211 
1 1 1 2   8  28 o 334.2102 5.226298 1366.927       42.56474 1361.438       59.89161 1372.530       60.50434 332.8154 7.384592 334.1503 7.430339 -1.334900      10.47579 
1 1 1 2   8  29 o 29.95945 5.803708 11.37529       4.084095 16.04106       5.688666 6.412348       5.867026 35.54782 6.814833 23.94372 8.272548 11.60411       10.71807 
1 1 1 2   8  30 f 254.7314 4.286829 793.7010       26.61060 797.0294       37.46339 790.3117       37.80508 254.7810 6.033981 253.6787 6.115474 1.102356       8.591155 
1 1 1 2   8  31 o 171.1244 5.007101 359.2695       20.85774 367.7440       31.24688 352.4588       28.01211 172.4182 7.454436 168.9993 6.815798 3.418884       10.10068 
1 1 1 2   8  32 o 21.56449 6.693356 5.711172       3.884093 7.281804       5.111791 3.565720       5.974411 24.39503 7.694547 21.06023 8.160807 3.334801       11.21627 
1 1 1 2   8  33 o 56.09608 3.763248 38.68036       5.114600 39.60878       6.785970 37.45933       7.782220 56.58663 4.971584 54.84331 5.916477 1.743320       7.727959 
1 1 1 2   8  34 o 94.25518 3.639064 108.9186       8.342848 103.7739       9.900891 121.5165       15.49323 91.86006 4.436057 98.92902 6.461982 -7.068954      7.838100 
1 1 1 2   8  35 o 114.6613 3.215662 161.0140       8.976239 160.5822       12.30140 161.5058       13.12747 114.2469 4.426870 114.5016 4.714799 -0.2547455     6.467342 
1 1 1 2   8  36 o 58.46808 3.785820 42.11621       5.365050 47.32188       7.191298 35.58189       8.056929 61.79020 4.813817 53.16568 6.343750 8.624527       7.963417 
1 1 1 2   8  37 f 86.41577 3.750802 91.93752       7.879847 90.72793       9.269536 95.08896       14.96210 85.66311 4.455777 86.73736 7.141866 -1.074249      8.417850 
1 1 1 2   8  38 o 34.34045 5.407279 15.02242       4.375552 14.24136       5.683693 16.15881       6.855725 32.92346 7.277935 34.86892 8.205798 -1.945454      10.96829 
1 1 1 2   8  39 o 53.32756 3.932965 35.37499       5.075062 41.21073       6.944516 28.68578       7.435007 57.22373 5.031174 47.07087 6.668214 10.15285       8.353310 
1 1 1 2   8  40 o 31.50525 6.472843 13.17600       4.803176 15.71908       7.005098 10.91954       6.598550 33.69098 8.526385 28.29104 8.714453 5.399939       12.19184 
1 1 1 2   8  41 o 58.41625 4.837207 43.56907       6.824280 37.89384       11.89883 46.35085       8.330543 50.93784 9.942764 59.68182 5.800995 -8.743977      11.51130 
1 1 1 2   8  42 o 8.324475 4.161697 -9.090333      3.508148 -1.642569      4.505391 -20.56016      5.591109 13.78362 6.240954 9.116626 4.637642 4.666989       7.775425 
1 1 1 2   8  43 o 34.06685 5.348319 15.67450       4.293927 17.03047       5.691064 13.88237       6.542665 34.38852 7.028710 29.86944 8.552670 4.519077       11.07027 
1 1 1 2   8  44 o 20.93739 7.221992 6.519262       4.470811 8.178304       5.155511 1.488087       8.977962 22.91303 7.759028 19.38783 8.790997 3.525204       11.72536 
1 1 1 2   8  45 o 20.28479 6.793095 6.446938       3.952114 13.37262       5.308873 -2.162232      5.919045 28.44449 7.538600 14.38251 6.736303 14.06198       10.10981 
1 1 1 2   8  46 o 21.92579 6.664398 7.941972       3.875665 5.586994       5.177744 10.94272       5.844697 18.61098 7.475383 23.88055 8.256504 -5.269567      11.13783 
1 1 1 2   8  47 o 13.68601 6.047626 1.325978       3.963020 4.909310       4.940040 -5.143917      6.637973 17.24291 7.156561 13.02771 6.361684 4.215198       9.575353 
1 1 1 2   8  48 o 18.22195 6.547800 6.222670       3.702789 4.648836       5.175142 7.873466       5.300166 16.23506 7.048204 18.92819 7.576769 -2.693134      10.34817 
1 1 1 2   8  49 o 19.97753 7.107293 8.825412       4.351401 16.53291       7.338428 4.645915       5.403914 22.59829 8.958160 15.47044 6.934318 7.127843       11.32843 
1 1 1 2   8  50 o 14.30455 6.080045 3.804757       3.700456 6.679218       5.182949 0.8159703      5.285014 16.30317 7.065770 12.84052 6.117695 3.462655       9.346192 
1 1 1 2   9  0  o 456.6139 6.709575 2543.417       74.65867 2431.521       102.4299 2670.238       109.0471 446.2009 9.420202 467.5738 9.570350 -21.37286      13.42877 
1 1 1 2   9  1  o 242.6299 3.904558 717.5836       23.08619 706.8038       32.31537 728.8200       32.99278 240.7518 5.508121 244.4716 5.538020 -3.719742      7.810830 
1 1 1 2   9  2  o 296.5224 5.283916 1072.163       38.18120 1108.093       67.04533 1054.918       46.44898 301.0769 9.148695 294.0700 6.481707 7.006927       11.21210 
1 1 1 2   9  3  o 282.7151 4.407736 974.4436       30.36691 1037.216       44.56206 920.0211       41.49264 291.5921 6.271239 274.6287 6.199963 16.96344       8.818615 
1 1 1 2   9  4  o 166.4399 3.517626 337.6716       14.26735 321.2562       16.85463 379.1697       26.79831 162.2727 4.265936 176.1846 6.251613 -13.91193      7.568413 
1 1 1 2   9  5  o 409.4605 5.424413 2044.839       54.12537 2015.945       84.89320 2064.629       70.25688 406.2568 8.575040 411.3011 7.009595 -5.044220      11.07546 
1 1 1 2   9  6  o 235.4707 3.784934 675.9267       21.71857 669.8992       30.89014 681.8192       30.54222 234.3567 5.408867 236.4374 5.300884 -2.080658      7.573323 
1 1 1 2   9  7  o 180.2801 4.349007 396.2642       19.10619 420.1283       28.01946 375.5247       26.12082 185.4632 6.208385 175.3366 6.122731 10.12660       8.719625 
1 1 1 2   9  8  o 197.5531 3.381241 475.7036       16.27781 511.7855       23.97931 444.8673       22.16786 204.8692 4.803125 191.0076 4.762522 13.86157       6.763995 
1 1 1 2   9  9  o 50.73398 2.436668 31.43982       3.003723 33.38314       4.502320 29.88110       4.032259 52.21239 3.559854 49.39869 3.369808 2.813694       4.901853 
1 1 1 2   9  10 o 111.2060 2.526757 150.7067       6.847435 139.8211       9.493685 162.5098       9.885676 107.0432 3.644798 115.4163 3.518929 -8.373108      5.066302 
1 1 1 2   9  11 o 359.2301 5.414068 1573.347       47.39500 1569.326       66.97482 1577.379       67.07862 358.6579 7.662934 359.5774 7.655185 -0.9194641     10.83155 
1 1 1 2   9  12 o 623.7740 10.43083 4750.503       158.5559 4867.932       197.1095 4535.208       266.8926 631.1115 12.81638 607.9918 18.03362 23.11963       22.12400 
1 1 1 2   9  13 o 870.1186 17.69948 9274.084       375.2971 9582.392       542.8856 8991.882       519.3939 881.6816 25.29353 854.1831 24.97908 27.49847       35.54880 
1 1 1 2   9  14 f 369.0564 5.556771 1660.411       49.97483 1645.353       70.29304 1675.801       71.06342 367.2846 7.853685 370.6667 7.867311 -3.382141      11.11643 
1 1 1 2   9  15 o 291.9528 4.563199 1038.937       32.46521 1016.497       45.34788 1062.531       46.49925 288.7305 6.445078 295.1954 6.463984 -6.464874      9.128096 
1 1 1 2   9  16 o 488.1711 8.248929 2907.417       98.13088 2870.636       167.5167 2926.632       121.0809 484.2571 14.21072 489.6205 10.14798 -5.363403      17.46214 
1 1 1 2   9  17 o 434.6605 6.450641 2303.994       68.32650 2376.178       98.57648 2237.248       94.79118 441.2228 9.168097 428.1366 9.085513 13.08621       12.90738 
1 1 1 2   9  18 o 407.5811 7.079662 2026.486       70.31737 1984.713       121.2316 2047.665       86.32150 402.6864 12.36881 409.5872 8.648416 -6.900757      15.09247 
1 1 1 2   9  19 o 472.1155 8.083518 2720.691       93.00039 2805.915       165.5277 2681.379       112.4219 478.3519 14.21573 468.4897 9.847240 9.862152       17.29321 
1 1 1 2   9  20 o 288.0490 4.571088 1011.674       32.08647 1015.152       45.39372 1008.201       45.36054 288.4439 6.458003 287.4536 6.475517 0.9903564      9.145388 
1 1 1 2   9  21 o 119.0939 2.876133 172.8770       8.347082 163.6315       11.42257 183.4717       12.22762 115.7748 4.054943 122.5985 4.098563 -6.823784      5.765482 
1 1 1 2   9  22 o 187.8293 3.917275 430.2268       17.93014 425.8799       22.06332 438.6812       30.76930 186.7734 4.851628 189.3977 6.677083 -2.624298      8.253589 
1 1 1 2   9  23 o 280.0522 4.499509 956.9631       30.70721 922.5989       42.37568 994.9609       44.55969 274.7891 6.328213 285.3519 6.408041 -10.56281      9.006068 
1 1 1 2   9  24 f 117.6143 3.243169 168.8327       9.286477 156.6693       14.19157 177.9413       12.28080 113.1445 5.160666 120.6820 4.182202 -7.537476      6.642537 
1 1 1 2   9  25 o 157.0890 3.822345 301.1544       14.63227 303.0456       26.84487 300.3550       17.45278 157.1296 7.028581 156.7604 4.573587 0.3692780      8.385622 
1 1 1 2   9  26 o 260.9174 4.994288 832.1694       31.75504 814.1857       38.11444 872.9827       57.41830 257.8858 6.064933 266.1770 8.864411 -8.291168      10.74063 
1 1 1 2   9  27 o 46.49466 3.514166 26.53746       3.952157 25.71334       5.161178 27.70574       6.145079 45.62404 4.709764 47.27568 5.432626 -1.651638      7.189944 
1 1 1 2   9  28 f 69.17644 3.051497 58.51145       5.131417 56.25030       6.856716 61.39009       7.736518 67.71877 4.175303 70.71846 4.512826 -2.999687      6.148069 
1 1 1 2   9  29 o 43.03316 4.148929 22.84706       4.296988 18.57340       5.846380 27.86799       6.336936 38.37298 6.482789 47.35736 5.599221 -8.984383      8.566086 
1 1 1 2   9  30 o 92.35132 3.021756 104.2399       6.791308 103.2158       9.221084 105.4539       10.03978 91.77255 4.133799 92.72114 4.456385 -0.9485855     6.078459 
1 1 1 2   9  31 o 69.68760 4.110551 59.62659       6.949577 60.15211       13.56969 59.43975       8.091232 69.22236 8.203573 69.48056 4.808421 -0.2582016     9.508918 
1 1 1 2   9  32 o 141.4473 3.680775 244.8810       12.67654 245.3548       15.48165 243.9172       22.08212 141.4274 4.497800 140.5114 6.466351 0.9160614      7.876795 
1 1 1 2   9  33 o 107.5662 3.555505 141.7067       9.307135 134.0465       11.11672 159.6605       17.01900 104.4760 4.376096 113.6152 6.170132 -9.139175      7.564440 
1 1 1 2   9  34 o 168.6410 3.477572 348.0845       14.29142 323.6239       19.21520 378.3668       21.37991 162.1884 4.867217 175.3323 5.009026 -13.14384      6.984278 
1 1 1 2   9  35 o 137.4547 3.280996 231.2880       10.99009 235.2895       15.24804 226.9619       15.85436 138.2746 4.531297 135.7206 4.801217 2.554001       6.601843 
1 1 1 2   9  36 o 44.98652 4.344920 25.12568       4.704011 26.20365       6.193364 23.65601       7.231613 45.65673 5.689669 42.96192 7.159222 2.694809       9.144768 
1 1 1 2   9  37 o 29.68297 6.670632 11.45702       4.707287 10.62662       5.329152 14.40520       10.04132 28.50385 7.552358 33.34384 10.81267 -4.839991      13.18909 
1 1 1 2   9  38 o 12.04661 5.519608 -2.424786      3.659131 1.504652       4.690052 -8.537259      5.849529 17.14676 7.030272 12.94445 6.237589 4.202313       9.398523 
1 1 1 2   9  39 o 15.16775 6.495114 0.1378315      4.279153 5.158541       6.026239 -4.968416      6.077357 22.06891 8.280832 14.79957 6.896729 7.269340       10.77669 
1 1 1 2   9  40 o 46.61804 4.310280 27.39146       4.841183 26.90360       6.269445 28.11199       7.619163 45.61203 5.769296 46.03605 7.012827 -0.4240189     9.080997 
1 1 1 2   9  41 o 35.13959 5.171503 16.09213       4.296114 16.94215       5.652388 14.92940       6.610820 35.28535 6.820365 32.32853 8.337279 2.956818       10.77161 
1 1 1 2   9  42 o 33.77966 6.703745 15.86576       5.323547 18.03925       9.807944 14.95799       6.338495 33.20930 10.67919 31.89720 8.131279 1.312099       13.42247 
1 1 1 2   9  43 o 13.22207 5.930454 -0.8236706     3.959703 0.5937529      4.494658 -5.737577      8.368743 15.11946 6.566152 16.34375 7.761496 -1.224288      10.16638 
1 1 1 2   9  44 o 15.71004 6.267084 2.651285       3.613681 2.902158       4.637133 2.263323       5.766566 16.89201 6.964959 17.32247 7.480191 -0.4304619     10.22076 
1 1 1 2   9  45 o 19.14328 6.601384 5.678562       3.735356 8.980855       4.897422 1.085543       5.775756 22.98866 7.557560 15.91520 7.148486 7.073465       10.40277 
1 1 1 2   9  46 o 10.26231 4.854544 -2.356595      3.213056 -1.133483      4.341831 -3.837293      4.777199 12.69323 5.885849 11.84805 5.690672 0.8451796      8.186999 
1 1 1 2   9  47 o 8.667339 4.327997 -7.655760      3.744634 -9.019196      4.612471 -5.019671      6.413517 9.536416 4.768250 12.76210 6.236551 -3.225683      7.850527 
1 1 1 2   9  48 o 15.12194 6.764012 3.337350       5.112915 0.000000       0.000000 3.337350       5.112915 ?        ?        15.12194 6.764012 0.000000       6.764012 
1 1 1 2   9  49 o 10.80212 5.127254 -1.219846      3.643071 -3.476228      5.030682 1.268283       5.282714 11.21863 5.491014 13.42027 6.310369 -2.201640      8.364926 
1 1 1 2   10 0  o 430.0957 6.361403 2256.859       66.67363 2246.897       93.84947 2267.011       94.73832 428.8672 8.979930 430.7769 9.024792 -1.909698      12.73130 
1 1 1 2   10 1  o 413.1917 6.132148 2082.773       61.74479 2132.201       88.54972 2035.999       86.14075 417.8068 8.697123 408.2771 8.658000 9.529724       12.27196 
1 1 1 2   10 2  o 273.7372 4.961112 913.7527       33.09399 895.9570       40.17848 951.2988       58.36035 271.0028 6.083921 278.9453 8.595702 -7.942474      10.53092 
1 1 1 2   10 3  o 433.4474 6.412621 2292.380       67.73421 2188.800       92.79816 2410.488       99.09263 423.2551 8.997069 444.1508 9.155347 -20.89569      12.83618 
1 1 1 2   10 4  o 254.2633 4.036060 788.1723       25.00791 756.6866       34.71919 822.1208       36.05148 249.0613 5.720412 259.6079 5.698612 -10.54662      8.074484 
1 1 1 2   10 5  o 217.3977 3.574734 576.1114       18.93803 598.4400       27.56409 556.1474       26.06369 221.5200 5.106162 213.5527 5.008352 7.967346       7.152375 
1 1 1 2   10 6  o 301.5026 4.160444 1108.256       30.56798 1084.222       47.84794 1124.830       39.73347 298.0850 6.586990 303.6901 5.368956 -5.605072      8.497890 
1 1 1 2   10 7  o 266.7991 3.764247 867.6926       24.47364 925.3106       40.48153 834.5026       30.72427 275.4201 6.031499 261.6100 4.819380 13.81012       7.720453 
1 1 1 2   10 8  o 495.6302 6.478274 2996.637       78.24440 3033.730       125.0451 2972.769       100.3081 498.2397 10.29893 493.4610 8.341560 4.778778       13.25329 
1 1 1 2   10 9  o 389.2731 5.815556 1847.875       55.16730 1825.647       77.48922 1870.720       78.55846 386.7658 8.221614 391.5101 8.234057 -4.744263      11.63592 
1 1 1 2   10 10 o 383.2273 5.737200 1790.686       53.57874 1845.153       77.34982 1740.448       74.28656 388.8743 8.162327 377.6854 8.071309 11.18887       11.47909 
1 1 1 2   10 11 o 412.2609 7.052816 2072.764       70.85505 1874.751       114.2641 2196.474       90.31600 391.5527 11.98935 424.2810 8.735243 -32.72830      14.83405 
1 1 1 2   10 12 o 413.2668 8.795640 2083.708       88.57967 2248.343       131.6596 1947.557       119.7297 428.8021 12.61339 399.0965 12.32562 29.70560       17.63572 
1 1 1 2   10 13 o 627.3834 9.075065 4802.459       138.7455 5231.037       207.8747 4458.148       186.3214 654.3058 13.03722 604.0866 12.65690 50.21918       18.17048 
1 1 1 2   10 14 o 345.5528 5.254483 1455.593       44.24666 1515.418       64.23495 1401.579       61.03600 352.4970 7.477903 339.0025 7.388343 13.49454       10.51221 
1 1 1 2   10 15 o 330.1796 5.808671 1329.153       46.73724 1401.587       82.65606 1295.109       56.66578 338.7025 10.02532 325.8724 7.135709 12.83005       12.30551 
1 1 1 2   10 16 o 814.2700 11.68357 8100.797       231.8356 8238.761       331.6646 7968.979       324.1932 820.0382 16.59697 806.5273 16.49486 13.51086       23.39957 
1 1 1 2   10 17 o 611.2477 8.863312 4560.355       132.0229 4510.229       185.3814 4611.942       188.0648 607.3514 12.52536 614.1546 12.56590 -6.803223      17.74222 
1 1 1 2   10 18 o 279.9382 5.203094 955.5010       35.49441 1021.245       65.32670 927.9626       42.27968 289.0421 9.286615 275.8307 6.290035 13.21146       11.21632 
1 1 1 2   10 19 o 384.6110 6.744915 1804.882       63.21706 1767.358       109.2392 1823.776       77.51572 379.8691 11.81509 386.4886 8.230326 -6.619446      14.39912 
1 1 1 2   10 20 o 226.0006 3.831171 622.6808       21.09975 600.8258       29.19320 646.5845       30.53083 221.9386 5.397749 230.2328 5.441708 -8.294250      7.664717 
1 1 1 2   10 21 o 128.7567 3.284718 202.2341       10.29791 201.4954       12.85565 203.5570       17.20308 128.4785 4.111376 129.0431 5.483102 -0.5645905     6.853307 
1 1 1 2   10 22 o 167.8845 3.247247 343.6442       13.28502 333.4335       18.38730 354.7957       19.21576 165.2561 4.570268 170.4671 4.630024 -5.211014      6.505726 
1 1 1 2   10 23 o 147.8455 3.072776 266.5262       11.07070 257.8264       15.28770 276.1187       16.05299 145.2966 4.322489 150.3619 4.385776 -5.065308      6.157835 
1 1 1 2   10 24 o 92.85758 2.824320 105.2395       6.383550 104.7313       8.771366 105.8118       9.307911 92.56171 3.897380 93.02151 4.116324 -0.4598083     5.668659 
1 1 1 2   10 25 o 206.3753 4.186989 520.0184       21.05696 575.4910       37.02302 493.4940       25.60092 216.5872 7.023889 200.8591 5.234778 15.72813       8.760018 
1 1 1 2   10 26 o 69.19532 3.509694 58.58688       5.898768 62.20045       6.825381 47.92258       11.72532 71.26427 3.945640 61.95413 7.949325 9.310143       8.874674 
1 1 1 2   10 27 o 91.43605 2.892442 102.1021       6.436823 90.16425       8.559934 117.6367       9.764658 85.81383 4.105238 98.04620 4.095885 -12.23238      5.799074 
1 1 1 2   10 28 o 223.8889 4.434068 612.8956       24.19195 592.6043       39.49078 625.0847       30.60742 219.3501 7.398501 225.8791 5.560510 -6.528976      9.255112 
1 1 1 2   10 29 o 75.08495 3.041445 68.93373       5.553532 66.11243       7.541288 72.27664       8.208871 73.40745 4.233656 76.74289 4.407985 -3.335442      6.111806 
1 1 1 2   10 30 o 178.6834 3.478884 390.1081       15.14818 396.2101       21.38642 383.9645       21.45927 179.7671 4.886467 176.9436 4.981689 2.823517       6.978164 
1 1 1 2   10 31 o 197.0263 4.354676 475.3322       20.90817 497.7873       38.52176 465.9547       24.89406 200.3497 7.905600 194.7870 5.249231 5.562668       9.489622 
1 1 1 2   10 32 o 103.5906 3.490351 131.3673       8.798422 122.7685       10.45294 152.2659       16.29585 100.0161 4.298804 111.0342 6.045408 -11.01815      7.417997 
1 1 1 2   10 33 o 31.53460 5.989669 12.65639       4.434584 18.61612       5.345843 -0.4938110     7.940887 38.43692 5.895129 20.39495 8.792223 18.04196       10.58564 
1 1 1 2   10 34 o 152.1732 3.353239 283.3909       12.43480 283.9801       17.22333 282.7494       17.97144 151.9538 4.656744 151.5571 4.872313 0.3966370      6.739785 
1 1 1 2   10 35 o 140.5933 3.287729 242.0216       11.26411 242.8211       15.53225 241.1347       16.35964 140.4433 4.544325 139.8691 4.806864 0.5742188      6.614895 
1 1 1 2   10 36 o 22.86268 6.702323 6.651944       3.974919 7.903686       5.031794 4.574249       6.482704 24.96756 7.594577 22.34513 8.541675 2.622431       11.42969 
1 1 1 2   10 37 o 19.15267 6.769184 4.085707       3.941620 7.465381       4.992520 -1.506845      6.422253 24.29554 7.596004 17.45231 7.705866 6.843227       10.82034 
1 1 1 2   10 38 o 91.08025 3.274465 102.1682       7.255934 104.7337       9.905388 99.19762       10.65887 91.81024 4.440522 89.14610 4.925658 2.664146       6.631768 
1 1 1 2   10 39 o 32.91366 5.632657 14.03085       4.355465 19.01745       5.755811 7.349998       6.662242 38.14655 6.419497 24.64035 8.791258 13.50619       10.88559 
1 1 1 2   10 40 o 16.88388 6.479656 2.732885       3.740450 1.823338       4.761168 4.199331       6.045522 17.23466 7.076722 20.84836 8.171775 -3.613705      10.81008 
1 1 1 2   10 41 o 53.30096 3.911582 35.87014       5.045317 39.65174       6.691236 30.88698       7.681046 55.45358 5.005373 47.81324 6.782389 7.640331       8.429386 
1 1 1 2   10 42 o 16.98729 7.058451 2.029602       4.813222 -2.979172      8.631969 4.289638       5.798315 18.11430 8.364180 19.96199 7.946709 -1.847694      11.53732 
1 1 1 2   10 43 o 22.48921 6.543527 7.342641       3.801299 11.59067       4.884489 0.8182834      6.053329 27.87681 7.154736 16.99809 7.494292 10.87871       10.36121 
1 1 1 2   10 44 o 27.26391 6.269094 11.03792       4.078049 15.35154       5.332958 4.963590       6.328436 31.51799 7.112864 19.55335 8.106403 11.96465       10.78455 
1 1 1 2   10 45 o 20.38998 6.782839 6.700062       3.941290 10.12751       5.272430 2.359072       5.933621 23.94166 7.839969 16.72809 7.395560 7.213573       10.77773 
1 1 1 2   10 46 o 14.28840 5.965446 2.215893       3.461867 1.056608       4.828396 3.442269       4.966148 14.52547 6.529166 16.39366 7.008032 -1.868188      9.578232 
1 1 1 2   10 47 o 11.80504 5.742829 -4.315661      5.267380 -4.366235      8.677853 -4.286158      6.628065 14.40750 7.084200 13.07210 6.377591 1.335400       9.532028 
1 1 1 2   10 48 o 12.30076 5.586432 0.7355608      3.643259 0.7639753      5.138021 0.7068273      5.166792 13.45875 6.294731 13.44676 6.296634 0.1199341E-01  8.903440 
1 1 1 2   10 49 o 9.805716 4.749202 -2.689091      3.498932 -4.888190      4.996406 -0.5727989     4.901434 10.64385 5.260373 12.21384 5.839020 -1.569988      7.859114 
1 1 1 2   11 0  o 695.1163 11.59443 5914.465       196.4007 6542.584       364.7499 5657.995       233.0736 727.2319 20.60270 679.1389 14.08310 48.09302       24.95606 
1 1 1 2   11 1  o 352.3568 7.577209 1515.728       65.06210 1464.094       89.87751 1572.576       94.30550 345.8073 10.67829 358.3801 10.81070 -12.57285      15.19530 
1 1 1 2   11 2  o 95.88545 3.559987 112.2265       8.303908 117.2334       12.35942 108.1065       11.21134 97.90717 5.198850 94.02778 4.909899 3.879387       7.150884 
1 1 1 2   11 3  o 188.0190 3.783659 430.9407       17.33603 440.8290       21.57257 412.9120       29.12887 190.1404 4.655767 183.8428 6.512193 6.297607       8.005300 
1 1 1 2   11 4  o 295.9767 4.576117 1068.116       33.00583 1064.732       46.78647 1071.468       46.56888 295.4047 6.499304 296.3409 6.448640 -0.9361877     9.155649 
1 1 1 2   11 5  o 301.3620 4.167568 1107.171       30.60604 1134.240       49.14751 1090.024       39.11666 304.9001 6.614666 298.9666 5.369118 5.933441       8.519462 
1 1 1 2   11 6  o 332.7749 5.079230 1350.297       41.18932 1225.289       78.42867 1397.908       48.40165 316.4812 10.18255 338.5490 5.866817 -22.06781      11.75176 
1 1 1 2   11 7  o 643.6009 8.306323 5055.997       130.2751 5021.123       205.1262 5079.573       168.6558 640.5281 13.14156 644.7184 10.73483 -4.190308      16.96871 
1 1 1 2   11 8  o 139.6988 3.198644 237.8442       10.88917 219.2222       17.86045 248.8613       13.73773 133.9765 5.482087 142.8344 3.950603 -8.857895      6.757258 
1 1 1 2   11 9  o 138.3731 3.333128 233.3489       11.23931 223.0161       20.15229 238.0140       13.54085 135.0999 6.137179 139.6861 3.981990 -4.586182      7.315820 
1 1 1 2   11 10 o 307.9540 4.771474 1155.994       35.80755 1128.563       49.89435 1185.127       51.41912 304.2168 6.730264 311.7459 6.768427 -7.529114      9.545054 
1 1 1 2   11 11 o 651.3509 13.37305 5184.828       212.2666 5191.459       300.6293 5178.236       299.7532 650.5107 18.98478 649.6884 18.95340 0.8223267      26.82635 
1 1 1 2   11 12 o 496.2380 8.427220 3003.947       101.9085 3073.327       126.5107 2875.727       171.9826 501.7878 10.34597 484.7535 14.57542 17.03430       17.87406 
1 1 1 2   11 13 o 167.7914 3.695468 343.1198       15.11038 338.0169       18.10052 354.8524       27.44607 166.4704 4.465916 170.4644 6.619676 -3.994019      7.985269 
1 1 1 2   11 14 o 372.6778 6.448804 1693.550       58.56645 1705.001       100.9508 1687.741       71.90382 373.4976 11.10372 371.9668 7.932531 1.530792       13.64616 
1 1 1 2   11 15 o 504.0127 7.389261 3098.501       90.75668 3170.190       130.3643 3031.080       126.4250 509.5335 10.49905 498.2376 10.41263 11.29590       14.78691 
1 1 1 2   11 16 o 382.6999 5.771383 1785.800       53.82380 1815.842       77.11955 1757.270       75.15515 385.7650 8.203622 379.4975 8.126692 6.267487       11.54740 
1 1 1 2   11 17 o 225.1782 3.800015 618.0330       20.85200 614.7659       29.49876 621.2959       29.47961 224.5422 5.391005 225.7325 5.359095 -1.190308      7.601502 
1 1 1 2   11 18 o 330.4130 5.930482 1331.542       47.75109 1311.708       83.46076 1341.194       58.22187 327.4307 10.47336 331.5295 7.206558 -4.098785      12.71321 
1 1 1 2   11 19 o 316.8341 4.930687 1224.150       38.06935 1253.622       54.62011 1196.307       53.08892 320.4894 6.993633 313.0800 6.958451 7.409424       9.865644 
1 1 1 2   11 20 o 254.3250 4.765493 788.8876       29.53473 757.5568       35.62469 857.7603       52.81878 249.1598 5.867283 264.8120 8.194786 -15.65218      10.07867 
1 1 1 2   11 21 o 186.1646 3.411183 422.5534       15.47527 411.7276       21.49256 434.2084       22.30046 183.6431 4.806743 188.5896 4.856480 -4.946503      6.833021 
1 1 1 2   11 22 o 304.8222 4.800479 1133.960       35.65884 1141.945       50.54734 1126.048       50.31193 305.6485 6.786407 303.5113 6.802366 2.137238       9.608721 
1 1 1 2   11 23 o 198.3263 3.563303 479.7869       17.22143 477.9011       24.22509 481.7136       24.48656 197.7637 5.030781 198.5477 5.065026 -0.7839203     7.138855 
1 1 1 2   11 24 o 167.2928 3.272856 341.3976       13.34260 355.4814       19.05149 327.8400       18.69220 170.5528 4.588055 163.7718 4.688484 6.781021       6.559888 
1 1 1 2   11 25 o 125.7513 2.947317 192.8898       9.031824 182.7280       12.32515 204.6752       13.27334 122.2588 4.142895 129.3935 4.215138 -7.134682      5.910243 
1 1 1 2   11 26 o 164.1785 4.526399 329.6415       18.09217 340.9955       24.28828 315.4888       27.11720 166.7559 5.986664 160.2071 6.962498 6.548752       9.182404 
1 1 1 2   11 27 o 219.0792 4.351197 586.6041       23.22983 578.7058       38.24100 591.2230       29.24378 216.8916 7.245366 219.7459 5.461056 -2.854233      9.072952 
1 1 1 2   11 28 o 118.3782 2.991897 171.1411       8.623949 163.8355       11.78354 179.5676       12.65528 115.6929 4.186488 121.1130 4.294700 -5.420097      5.997594 
1 1 1 2   11 29 o 89.88008 2.953751 98.72028       6.460753 100.8568       8.898905 96.33884       9.395041 90.73461 4.034735 88.63380 4.363149 2.100815       5.942739 
1 1 1 2   11 30 o 26.92529 5.569709 9.224094       3.533856 10.54404       4.638046 7.397314       5.456327 28.69346 6.747215 24.75758 7.965620 3.935886       10.43916 
1 1 1 2   11 31 o 89.61809 3.901416 98.44808       8.499868 100.2494       16.68179 97.81644       9.878364 89.66820 7.709035 89.23212 4.557942 0.4360809      8.955672 
1 1 1 2   11 32 o 123.4524 3.592279 186.5850       10.79552 187.8023       13.34521 184.2800       18.36327 123.7011 4.434236 122.1161 6.190992 1.585037       7.615171 
1 1 1 2   11 33 o 28.04625 6.036210 10.07100       4.003181 8.618510       5.084838 12.43891       6.492363 26.05839 7.564005 31.04517 8.385674 -4.986780      11.29308 
1 1 1 2   11 34 o 121.1062 3.588394 179.8118       10.57848 170.3908       12.68808 201.2906       19.15815 117.6970 4.431702 127.3833 6.190234 -9.686256      7.613079 
1 1 1 2   11 35 o 129.4646 3.215223 205.2336       10.14374 200.9650       13.78825 210.2692       14.97609 127.7532 4.435684 130.5927 4.713640 -2.839485      6.472534 
1 1 1 2   11 36 o 50.35987 3.897701 31.36025       4.746112 31.84830       6.204363 30.67180       7.368899 50.49043 5.112974 49.23051 6.285478 1.259914       8.102452 
1 1 1 2   11 37 o 103.1184 3.217425 130.6855       8.075122 134.7650       10.95754 125.8365       11.94631 104.3603 4.317981 100.6213 4.886615 3.738998       6.521040 
1 1 1 2   11 38 o 74.55936 4.365013 69.20585       7.896235 65.99687       9.579886 76.00584       13.94543 72.36603 5.472943 76.57284 7.572495 -4.206810      9.343222 
1 1 1 2   11 39 o 56.42924 3.829337 39.69500       5.234600 37.78066       6.732634 42.62097       8.323591 54.56201 5.123541 57.55632 6.023566 -2.994308      7.907845 
1 1 1 2   11 40 o 50.63726 3.996356 32.26424       4.891455 30.42686       6.335618 34.97562       7.696362 48.51364 5.453395 51.60880 6.246610 -3.095154      8.292144 
1 1 1 2   11 41 o 19.27144 7.007017 4.497640       4.256089 3.735277       4.860361 7.004474       8.813540 18.91204 7.351744 24.44744 9.775726 -5.535398      12.23164 
1 1 1 2   11 42 o 47.22056 6.823996 31.22550       7.624990 42.71787       11.47546 22.14039       10.20306 52.67063 9.279451 35.95940 10.78804 16.71124       14.22990 
1 1 1 2   11 43 o 45.24002 4.246441 26.85086       4.626759 30.69774       6.110531 21.68193       7.083124 47.41286 5.383892 37.41333 8.010548 9.999523       9.651692 
1 1 1 2   11 44 o 13.65550 5.874165 0.9444265      3.529899 -2.119328      4.439531 6.210481       5.820400 12.68676 5.906254 20.23373 7.991496 -7.546962      9.937195 
1 1 1 2   11 45 o 10.12536 4.834456 -3.113981      3.337432 -1.847549      4.441272 -4.756811      5.058397 12.55618 5.865979 11.95969 5.772373 0.5964880      8.229824 
1 1 1 2   11 46 o 25.72706 6.266242 10.76251       3.891594 13.02327       5.391394 8.303332       5.623000 26.23196 7.835553 20.60814 7.935419 5.623827       11.15198 
1 1 1 2   11 47 o 11.06277 5.252834 -1.991391      3.830371 4.050516       5.984902 -6.183190      4.985059 16.26025 7.292233 10.74921 5.301561 5.511039       9.015720 
1 1 1 2   11 48 o 11.50347 5.367902 -0.4175106     3.701455 -0.6921474     5.068488 -0.1036564     5.418301 12.59459 5.997866 13.11055 6.231573 -0.5159588     8.649098 
1 1 1 2   11 49 o 11.62771 5.445006 0.1001527E-01  3.864175 -7.496366      5.636393 6.666996       5.307923 10.45350 5.233332 16.50870 7.152661 -6.055196      8.862749 
1 1 1 2   12 0  o 317.4368 6.906379 1229.579       53.42490 1229.579       53.42490 0.000000       0.000000 317.4368 6.906379 ?        ?        0.000000       6.906379 
1 1 1 2   12 1  o 413.3511 6.160604 2084.223       62.05524 2034.274       86.16146 2138.058       89.44961 408.1387 8.663018 418.4081 8.772881 -10.26947      12.32929 
1 1 1 2   12 2  o 273.3824 4.987757 911.3124       33.22858 860.7939       39.32183 1037.491       62.14427 265.6496 6.074193 291.3402 8.763116 -25.69064      10.66246 
1 1 1 2   12 3  o 231.7382 4.435950 654.7062       25.05073 631.8796       42.75871 666.6357       30.91117 227.4016 7.727273 233.8073 5.425270 -6.405685      9.441626 
1 1 1 2   12 4  o 149.3254 3.435814 271.7763       12.50257 312.3390       23.48898 255.7413       14.76847 159.9146 6.038384 144.7815 4.190283 15.13315       7.349868 
1 1 1 2   12 5  o 380.9961 6.628491 1770.604       61.54195 1647.903       102.1763 1840.460       77.09502 366.9854 11.43921 388.3310 8.146822 -21.34561      14.04372 
1 1 1 2   12 6  o 791.4501 11.36257 7654.674       219.1474 7564.880       435.3561 7685.148       253.6229 782.9954 22.84093 792.6349 13.13043 -9.639526      26.34609 
1 1 1 2   12 7  o 464.5148 6.848385 2631.620       77.52179 2730.173       112.2872 2541.865       107.1574 472.8999 9.743720 456.3096 9.636656 16.59027       13.70420 
1 1 1 2   12 8  o 298.9765 4.665709 1089.574       33.99310 1061.554       47.33855 1119.404       48.84379 295.0479 6.583947 302.9794 6.615461 -7.931580      9.333418 
1 1 1 2   12 9  o 702.3802 10.11589 6021.567       173.1460 6013.697       244.7377 6029.454       244.9933 701.3067 14.32045 702.2255 14.31665 -0.9188232     20.24949 
1 1 1 2   12 10 o 199.1902 3.479588 483.5352       16.89009 465.7662       23.51987 502.4559       24.27018 195.4139 4.943017 203.0301 4.905424 -7.616211      6.963950 
1 1 1 2   12 11 o 308.1308 5.492706 1157.417       41.24369 1137.817       50.44980 1196.913       71.61593 305.4714 6.777238 313.0554 9.398195 -7.583954      11.58693 
1 1 1 2   12 12 o 130.1628 3.131631 206.4674       9.933301 178.9268       15.86555 224.2232       12.73910 121.0315 5.392779 135.5836 3.859561 -14.55207      6.631612 
1 1 1 2   12 13 o 305.3948 5.439813 1136.996       40.48385 1125.372       69.02037 1143.093       49.98540 303.5304 9.342355 306.1707 6.699516 -2.640320      11.49622 
1 1 1 2   12 14 o 411.7536 6.145102 2067.269       61.65987 1974.495       84.74383 2171.638       89.88342 402.2651 8.644893 421.8625 8.743242 -19.59741      12.29546 
1 1 1 2   12 15 o 700.7126 10.10359 5995.382       172.5249 5941.599       242.7530 6050.274       245.2400 696.8154 14.29588 703.1556 14.31211 -6.340271      20.22890 
1 1 1 2   12 16 o 166.1450 3.734151 336.4524       15.11872 308.7924       26.74157 349.4471       18.32925 158.9553 6.920184 169.2530 4.447834 -10.29771      8.226310 
1 1 1 2   12 17 o 593.0004 8.619939 4293.339       124.5648 4333.589       177.3357 4254.139       175.0097 595.1649 12.22708 589.6933 12.17867 5.471558       17.25751 
1 1 1 2   12 18 o 249.1997 4.812325 757.2320       29.22393 765.7197       52.35608 753.3908       35.22134 250.2390 8.598481 248.5237 5.815700 1.715302       10.38057 
1 1 1 2   12 19 o 282.1989 5.153097 971.3687       35.43723 959.0855       43.51822 995.5447       61.05305 280.3294 6.370396 285.2619 8.793188 -4.932526      10.85827 
1 1 1 2   12 20 o 203.0681 3.586551 502.7779       17.74822 482.2789       24.58014 525.1069       25.65382 198.7548 5.079099 207.4598 5.074368 -8.705032      7.179586 
1 1 1 2   12 21 o 528.4886 7.763591 3416.273       99.98490 3496.919       143.6126 3340.414       139.2866 533.6398 11.04354 521.5927 10.95827 12.04712       15.55774 
1 1 1 2   12 22 f 17.87405 5.722491 3.805399       2.818483 0.5746123      3.723768 8.138777       4.312625 14.91853 6.204450 25.37176 6.826434 -10.45323      9.224717 
1 1 1 2   12 23 o 225.9576 3.870955 623.0193       21.31479 615.1936       29.89069 631.1158       30.40319 224.3693 5.466840 227.2515 5.490051 -2.882141      7.747709 
1 1 1 2   12 24 o 62.10289 2.936075 47.14516       4.430815 41.10838       5.841759 55.32196       6.798806 57.87638 4.169917 67.18467 4.173264 -9.308292      5.899520 
1 1 1 2   12 25 o 218.4779 3.805577 582.7371       20.26115 585.4814       28.60141 579.9726       28.70607 218.7803 5.364670 217.7415 5.409991 1.038864       7.618903 
1 1 1 2   12 26 o 181.2500 4.777922 401.9470       21.08503 402.0326       27.98318 401.8346       32.07045 180.9811 6.354805 180.7264 7.296947 0.2546692      9.676207 
1 1 1 2   12 27 o 160.0547 3.640520 312.8571       14.19934 306.7590       22.76907 316.7380       18.16411 158.0789 5.921117 160.8628 4.638487 -2.783905      7.521648 
1 1 1 2   12 28 o 55.10722 3.265337 37.20913       4.365372 35.24739       5.745326 39.88854       6.714491 53.49800 4.447155 56.87499 4.892062 -3.376984      6.611313 
1 1 1 2   12 29 o 121.3914 3.019119 179.9163       8.931088 193.2484       12.69202 166.8398       12.56980 125.6267 4.151543 116.6767 4.428916 8.949982       6.070469 
1 1 1 2   12 30 o 127.1243 3.078975 197.3798       9.538296 196.7809       13.20330 198.0336       13.79449 126.7186 4.281839 127.0907 4.460972 -0.3721237     6.183398 
1 1 1 2   12 31 o 109.7698 4.600016 147.9554       12.27764 153.9050       19.50613 144.0518       15.80009 111.3386 7.228413 108.0110 6.026717 3.327599       9.411231 
1 1 1 2   12 32 o 24.50723 6.148620 7.694707       3.665478 3.468148       4.623229 14.84805       6.014594 19.32172 7.252450 33.96282 7.470632 -14.64110      10.41193 
1 1 1 2   12 33 o 80.90511 3.177061 80.17668       6.251619 73.78771       8.236990 88.85722       9.601229 77.42169 4.383771 84.93037 4.656857 -7.508675      6.395605 
1 1 1 2   12 34 o 57.57669 3.563773 40.76685       4.975754 34.80873       6.334293 50.36728       8.040606 52.94254 4.967762 63.71301 5.224597 -10.77047      7.209373 
1 1 1 2   12 35 o 50.61799 4.234506 31.72341       5.175466 26.81911       6.013692 45.72952       10.16275 46.25817 5.438565 60.10432 7.073856 -13.84615      8.922860 
1 1 1 2   12 36 o 134.7824 3.244422 222.8357       10.65630 232.8728       14.84694 212.1710       15.30402 137.3145 4.442797 130.9124 4.805364 6.402115       6.544461 
1 1 1 2   12 37 f 22.30626 6.819623 6.338906       4.050497 6.616241       5.312009 5.953660       6.260735 23.32201 7.876006 23.27079 8.492826 0.5121994E-01  11.58273 
1 1 1 2   12 38 o 75.89489 3.816751 71.44781       7.036333 67.58632       8.065002 83.75496       14.39810 73.54750 4.521735 80.27955 7.444572 -6.732048      8.710209 
1 1 1 2   12 39 o 44.56310 4.175138 24.98073       4.481212 26.97319       5.833628 22.11255       6.999189 45.89119 5.314554 40.61199 7.342437 5.279205       9.063987 
1 1 1 2   12 40 o 32.08789 6.023414 13.73786       4.537055 11.66426       5.088306 21.78251       10.02222 29.03917 7.220867 37.85459 10.49820 -8.815424      12.74179 
1 1 1 2   12 41 o 78.11172 4.363979 77.98684       8.273798 77.98684       8.273798 0.000000       0.000000 78.11172 4.363979 ?        ?        0.000000       4.363979 
1 1 1 2   12 42 o 43.24044 5.827643 25.55118       5.984532 24.87998       10.20341 25.90316       7.388925 37.94506 10.61854 42.16466 7.464231 -4.219601      12.97953 
1 1 1 2   12 43 o 34.10514 5.236446 16.02916       4.213164 19.58846       5.437964 10.68429       6.663815 36.88931 6.273622 25.23870 8.810905 11.65062       10.81621 
1 1 1 2   12 44 o 12.06111 5.443832 -0.5692033     3.396249 -3.285716      4.284813 4.021727       5.570272 11.72859 5.565129 18.01142 7.546747 -6.282833      9.376782 
1 1 1 2   12 45 o 26.21082 6.157867 10.73811       3.866004 13.76262       5.352469 7.439220       5.589972 28.02050 7.633186 20.42020 7.899021 7.600294       10.98454 
1 1 1 2   12 46 o 12.69822 5.693070 0.4701508      3.644807 3.758388       5.754405 -1.732882      4.710093 16.60651 7.314857 12.52821 5.911692 4.078301       9.405064 
1 1 1 2   12 47 o 29.24675 5.841942 14.07495       4.017817 14.84483       5.587441 13.25063       5.781636 26.36500 7.999499 24.07034 8.215710 2.294653       11.46690 
1 1 1 2   12 48 o 13.03685 5.959520 1.359785       4.233042 1.978599       5.265072 0.2285933      7.118560 13.95752 6.475342 13.98407 6.773180 -0.2654743E-01 9.370486 
1 1 1 2   12 49 o 11.73982 5.455572 0.4068624      3.761304 -0.9134701     5.283353 1.763735       5.355963 12.19676 5.889888 13.42652 6.325897 -1.229759      8.643364 
1 1 1 2   13 0  o 313.2604 4.848557 1196.373       37.01299 1187.291       52.03804 1205.672       52.65599 311.9803 6.844751 314.3845 6.873067 -2.404236      9.699983 
1 1 1 2   13 1  o 87.92544 2.556737 94.29102       5.472368 91.93941       7.569795 96.86544       7.920291 86.77813 3.587363 89.07304 3.656648 -2.294914      5.122523 
1 1 1 2   13 2  o 347.1655 5.285699 1469.476       44.71725 1490.518       63.68598 1449.014       62.80277 349.5282 7.476968 344.6274 7.478127 4.900787       10.57485 
1 1 1 2   13 3  o 424.0241 8.917015 2194.610       92.13956 2090.280       125.5465 2316.406       135.6492 413.2853 12.48005 435.0355 12.80942 -21.75015      17.88387 
1 1 1 2   13 4  o 489.2556 6.419071 2919.132       76.53219 3023.985       123.8789 2854.409       97.32752 497.6351 10.21528 483.6644 8.257630 13.97073       13.13546 
1 1 1 2   13 5  o 864.0515 12.38057 9124.110       260.6852 8822.263       360.0039 9456.859       377.9818 848.3945 17.41299 878.3034 17.65998 -29.90894      24.80095 
1 1 1 2   13 6  o 224.5832 3.760658 614.7142       20.58151 603.6378       28.68732 626.4628       29.54492 222.5224 5.290298 226.6891 5.348304 -4.166718      7.522739 
1 1 1 2   13 7  o 801.4448 13.29884 7849.964       259.7308 8321.915       468.9927 7641.184       311.9343 822.2514 23.42979 790.1376 16.20035 32.11383       28.48520 
1 1 1 2   13 8  o 482.1979 8.209713 2836.201       96.46935 2629.865       159.7036 2954.742       121.0490 463.6079 14.15262 492.0324 10.09558 -28.42450      17.38440 
1 1 1 2   13 9  o 538.0227 7.018761 3529.802       92.02316 3506.786       145.1190 3545.282       119.0109 535.9470 11.11134 539.0593 9.059707 -3.112305      14.33667 
1 1 1 2   13 10 o 198.3994 4.077385 479.7378       19.71325 444.0984       33.90836 497.9334       24.22845 190.6911 7.310472 202.1144 4.919174 -11.42336      8.811429 
1 1 1 2   13 11 o 297.9539 4.621278 1082.084       33.55423 1161.935       69.72977 1058.023       38.27732 308.4435 9.287560 294.6049 5.331696 13.83850       10.70914 
1 1 1 2   13 12 o 587.3026 8.529985 4208.199       122.0805 4322.124       175.9521 4102.448       169.5232 594.8020 12.13908 579.5060 12.00425 15.29596       17.07218 
1 1 1 2   13 13 o 214.6861 3.660417 561.7281       19.15008 561.4096       27.29749 562.0369       26.87213 214.5966 5.219918 214.7183 5.135668 -0.1216431     7.322747 
1 1 1 2   13 14 o 228.8604 3.846768 638.3832       21.45372 607.2446       29.76469 672.0519       30.95032 223.1737 5.472961 234.7824 5.409579 -11.60875      7.695249 
1 1 1 2   13 15 o 265.5439 4.278511 859.5360       27.68631 900.0345       40.34914 823.5027       38.05978 271.6679 6.094804 259.8643 6.010127 11.80368       8.559689 
1 1 1 2   13 16 o 44.30561 3.181669 24.04765       3.412310 21.71048       5.175848 25.84447       4.538242 41.87820 5.182215 45.86211 4.104000 -3.983910      6.610459 
1 1 1 2   13 17 o 113.9754 3.885287 158.5398       10.77543 174.3587       18.40107 150.2844       13.29301 119.3804 6.348020 110.9073 4.930764 8.473091       8.038021 
1 1 1 2   13 18 o 275.7982 6.250909 928.2032       42.01174 995.3677       64.19148 877.8779       55.56496 285.1989 9.248434 267.9101 8.521746 17.28876       12.57592 
1 1 1 2   13 19 o 324.2806 5.031237 1282.858       39.75867 1300.879       56.84398 1265.598       55.63017 326.3476 7.147726 321.8979 7.091794 4.449707       10.06894 
1 1 1 2   13 20 o 271.0471 4.988182 896.4858       32.94755 945.3288       57.82610 873.0077       40.09171 277.8017 8.552053 267.3703 6.153260 10.43140       10.53566 
1 1 1 2   13 21 o 89.32049 3.424745 97.43658       7.440635 88.30054       14.61829 100.6311       8.644167 84.67079 7.151597 90.74299 3.918309 -6.072197      8.154659 
1 1 1 2   13 22 o 128.7027 2.935406 201.9874       9.206443 193.7981       12.78220 210.8154       13.27132 125.9474 4.170420 131.3681 4.150817 -5.420723      5.884019 
1 1 1 2   13 23 o 86.31233 2.819854 90.94831       5.923144 85.36026       8.152122 97.19720       8.620686 83.52954 4.016698 89.14882 3.978189 -5.619278      5.653305 
1 1 1 2   13 24 o 168.5251 3.288340 346.5257       13.50447 357.6107       19.29843 335.8890       18.90407 171.0207 4.634872 165.7351 4.685338 5.285614       6.590480 
1 1 1 2   13 25 o 58.21967 3.272423 41.49318       4.624062 35.71064       6.664349 46.86153       6.421247 53.79208 5.146662 61.78676 4.291362 -7.994678      6.701038 
1 1 1 2   13 26 o 104.5100 3.452682 133.4851       8.781199 139.5570       10.38560 118.2595       16.44576 106.8091 3.997183 97.89581 6.938689 8.913338       8.007676 
1 1 1 2   13 27 f 22.72866 5.682899 6.580126       3.138994 5.788829       4.081164 7.726284       4.911753 21.83919 6.873489 24.93263 7.486233 -3.093433      10.16310 
1 1 1 2   13 28 o 32.62493 4.835677 13.31131       3.728313 16.34291       5.148791 9.969422       5.405859 36.00031 6.085652 27.99352 7.689609 8.006784       9.806388 
1 1 1 2   13 29 o 162.0328 3.311005 320.7302       13.07371 300.3305       17.72884 345.0468       19.35618 156.5294 4.652976 167.7691 4.739222 -11.23972      6.641566 
1 1 1 2   13 30 o 163.6343 3.788490 327.5035       15.10694 316.0468       18.34561 351.6371       26.62629 160.5152 4.695121 168.8154 6.484414 -8.300186      8.005734 
1 1 1 2   13 31 o 157.4907 4.003479 303.8525       15.35240 323.8990       28.82857 295.9167       18.13838 161.5911 7.340153 155.2357 4.800573 6.355362       8.770596 
1 1 1 2   13 32 o 27.23967 5.621468 9.467734       3.607735 7.804710       4.561528 12.24573       5.895582 24.81290 7.152792 30.79674 7.837376 -5.983831      10.61070 
1 1 1 2   13 33 o 81.18536 3.103825 80.73370       6.129294 74.24205       8.081220 89.52599       9.404827 77.65878 4.286851 85.24926 4.543552 -7.590477      6.246676 
1 1 1 2   13 34 o 19.65379 6.579171 4.536979       3.707162 3.945522       4.639427 5.581598       6.165688 19.81858 7.298104 23.09948 8.428451 -3.280901      11.14904 
1 1 1 2   13 35 o 59.18553 3.554198 43.13609       5.102555 42.11927       6.684703 44.55567       7.898413 58.23952 4.751332 59.72831 5.487839 -1.488796      7.258893 
1 1 1 2   13 36 o 117.0239 4.108472 169.0309       11.69814 166.0112       15.34482 173.2213       18.07599 115.4016 5.472087 117.4372 6.339769 -2.035622      8.374748 
1 1 1 2   13 37 o 13.43439 5.779275 -0.1262822     3.417030 -1.361931      4.274314 2.061813       5.687899 14.00244 6.228961 18.96286 7.754719 -4.960418      9.946639 
1 1 1 2   13 38 o 114.8320 3.687256 163.4081       10.30478 167.2480       12.31362 154.4337       18.82441 115.7828 4.372067 109.1751 7.114321 6.607613       8.350361 
1 1 1 2   13 39 o 55.42711 4.257449 38.68224       5.706502 35.99009       6.474972 48.04731       12.07659 53.09815 5.065369 59.08560 8.643019 -5.987453      10.01797 
1 1 1 2   13 40 o 56.68574 3.841099 40.48662       5.274641 46.32436       6.849016 31.97742       8.268946 60.16595 4.708824 48.37016 7.237236 11.79580       8.634270 
1 1 1 2   13 41 o 43.10613 4.401829 24.01046       4.559064 27.47474       5.935902 19.02734       7.119191 45.46718 5.466925 35.81701 8.316528 9.650173       9.952482 
1 1 1 2   13 42 o 54.27168 5.223772 39.57590       6.823415 41.98929       11.79864 38.36310       8.363991 50.33163 9.972242 51.85461 6.781295 -1.522984      12.05950 
1 1 1 2   13 43 o 13.22102 5.729692 0.5487024      3.407831 0.7141102      4.138577 0.2003607      6.005867 14.37064 6.269972 16.09511 7.254204 -1.724465      9.588327 
1 1 1 2   13 44 o 14.39981 5.968734 1.994852       3.429974 0.6664196      4.332532 4.225565       5.614279 14.20206 6.297087 18.00464 7.562299 -3.802578      9.840816 
1 1 1 2   13 45 o 26.31615 6.205126 10.98736       3.914115 15.13580       5.289932 5.968426       5.818538 29.60630 7.362919 18.83497 7.787476 10.77133       10.71715 
1 1 1 2   13 46 o 10.64608 5.051365 -2.200736      3.529781 3.125215       4.986007 -7.551786      4.997742 15.63752 6.850979 10.46181 5.186550 5.175705       8.592800 
1 1 1 2   13 47 o 10.16238 4.861526 -2.281242      3.409940 -1.736494      4.912184 -2.787899      4.737333 12.17891 5.828560 11.54579 5.575950 0.6331196      8.066184 
1 1 1 2   13 48 o 12.36363 5.737626 0.5619868      4.138523 1.996601       4.999336 -2.561733      7.377018 13.72887 6.348480 13.11870 6.466212 0.6101665      9.061738 
1 1 1 2   14 0  o 341.4481 5.223727 1421.283       43.46516 1356.815       59.63446 1494.343       63.48402 333.5304 7.337124 350.0208 7.442769 -16.49042      10.45123 
1 1 1 2   14 1  o 182.9346 3.320912 407.8382       14.80435 426.6792       21.28785 390.1917       20.60202 187.0936 4.669139 178.8517 4.731101 8.241867       6.647118 
1 1 1 2   14 2  o 735.3897 10.58193 6602.879       189.6351 6724.359       271.2902 6486.806       265.1830 741.3528 15.01665 728.1545 14.94466 13.19830       21.18591 
1 1 1 2   14 3  o 265.5396 4.263059 859.4196       27.58587 874.4930       39.41923 844.9530       38.61775 267.8145 6.040015 263.2528 6.019740 4.561646       8.527546 
1 1 1 2   14 4  o 513.5323 6.721710 3215.716       84.11697 3140.251       130.8713 3268.839       109.8018 507.1802 10.58878 517.6210 8.704856 -10.44080      13.70755 
1 1 1 2   14 5  o 538.8546 7.027948 3540.819       92.28609 3583.233       147.1236 3513.304       118.4974 541.7378 11.14441 536.6119 9.061759 5.125854       14.36361 
1 1 1 2   14 6  o 153.3543 2.689803 286.5819       10.05200 303.1185       16.33639 276.5063       12.75178 157.6455 4.256335 150.6285 3.473981 7.017029       5.494082 
1 1 1 2   14 7  o 409.7146 5.466644 2046.326       54.58060 1956.604       83.79150 2112.452       71.93522 400.4928 8.585569 416.2145 7.092318 -15.72171      11.13611 
1 1 1 2   14 8  o 856.8451 10.97083 8962.858       229.0752 9127.212       367.0264 8857.979       293.1923 863.3981 17.44416 851.2776 14.13335 12.12048       22.45107 
1 1 1 2   14 9  o 67.33883 3.129643 55.37883       5.121616 64.73727       9.391120 51.41704       6.110279 72.67838 5.339718 64.83640 3.885104 7.841972       6.603531 
1 1 1 2   14 10 o 211.9302 3.596158 547.3792       18.57239 636.6758       40.26498 523.2465       20.93210 228.3720 7.244331 207.1982 4.145632 21.17375       8.346652 
1 1 1 2   14 11 o 318.0968 4.397581 1233.324       34.08860 1226.791       54.04832 1237.640       43.92737 317.1678 6.992895 318.6161 5.657589 -1.448273      8.994937 
1 1 1 2   14 12 o 252.0345 3.659517 774.1754       22.47604 779.7831       36.09136 770.6228       28.72640 252.8941 5.856368 251.4345 4.688353 1.459641       7.501846 
1 1 1 2   14 13 o 221.7544 3.770158 599.3506       20.37361 573.0892       28.37055 627.3151       29.27605 216.8083 5.369770 226.8356 5.296208 -10.02733      7.542165 
1 1 1 2   14 14 o 506.9388 7.451932 3135.324       92.05779 3004.710       126.4471 3282.632       134.2849 495.9539 10.46240 518.3619 10.63060 -22.40802      14.91548 
1 1 1 2   14 15 o 338.7659 5.210933 1399.326       43.01810 1411.821       61.39602 1387.277       60.29256 340.1496 7.406860 337.1845 7.337702 2.965149       10.42609 
1 1 1 2   14 16 o 152.9223 3.473754 285.0433       12.94511 284.1916       16.50619 286.4042       20.86458 152.6109 4.443119 153.1389 5.600414 -0.5279846     7.148842 
1 1 1 2   14 17 o 473.5695 8.115362 2739.361       93.65430 2676.033       161.0388 2771.726       115.1250 466.6705 14.17712 476.0674 9.923509 -9.396820      17.30510 
1 1 1 2   14 18 o 265.1073 4.293544 857.0827       27.73791 853.5406       39.29401 860.6009       39.16098 264.4434 6.097581 265.5382 6.051880 -1.094849      8.591027 
1 1 1 2   14 19 o 416.0001 6.243021 2113.328       63.28844 2234.526       92.95061 2008.578       86.41325 427.2629 8.927318 405.1214 8.753044 22.14154       12.50251 
1 1 1 2   14 20 o 105.0071 2.790294 134.5204       7.133781 127.8869       10.14924 140.9979       10.02921 102.3085 4.079033 107.4490 3.836418 -5.140472      5.599698 
1 1 1 2   14 21 o 297.2170 4.718914 1078.426       34.17841 1105.705       49.20604 1052.995       47.50973 300.6560 6.716028 293.4143 6.644544 7.241669       9.447486 
1 1 1 2   14 22 o 101.3327 2.800092 125.3115       6.907824 116.3363       9.592393 134.9799       9.956028 97.54691 4.044085 105.0974 3.894124 -7.550461      5.614163 
1 1 1 2   14 23 o 169.0061 3.289419 348.4838       13.54745 352.4546       19.23203 344.5727       19.08677 169.7913 4.652467 167.8784 4.670071 1.912811       6.592042 
1 1 1 2   14 24 o 93.29655 3.123179 106.3170       7.090649 109.5599       11.05998 104.0539       9.239232 94.55317 4.815871 92.21261 4.122006 2.340561       6.339050 
1 1 1 2   14 25 o 280.8096 4.547270 963.8501       31.11708 971.7394       44.19293 956.0928       43.82181 281.5074 6.442091 279.2324 6.440037 2.275024       9.109041 
1 1 1 2   14 26 o 110.3045 3.477078 148.7114       9.334714 152.8557       11.05892 138.4415       17.40893 111.7691 4.067050 105.9544 6.777981 5.814690       7.904551 
1 1 1 2   14 27 o 166.5705 3.325922 338.8055       13.50038 320.6726       18.52174 359.3592       19.71934 161.8082 4.702255 171.2935 4.728582 -9.485352      6.668634 
1 1 1 2   14 28 o 235.6409 4.054499 679.0469       23.28220 652.6820       32.12934 708.1991       33.78502 230.6044 5.717396 240.1951 5.771967 -9.590775      8.124297 
1 1 1 2   14 29 o 168.2797 4.473978 347.0119       18.33058 346.5292       25.30300 347.5450       26.59169 167.7247 6.201365 167.8772 6.512422 -0.1525116     8.992695 
1 1 1 2   14 30 o 226.6321 3.983960 628.6110       22.00253 625.6570       30.88022 631.6572       31.35782 225.6047 5.616892 226.5912 5.683418 -0.9864502     7.990665 
1 1 1 2   14 31 o 88.48544 3.881272 96.03886       8.348802 87.67101       15.72267 99.32484       9.852613 83.67812 7.800276 89.88545 4.512500 -6.207336      9.011490 
1 1 1 2   14 32 o 73.79878 3.198370 66.73066       5.738278 59.41455       7.455678 77.36222       8.987637 69.44434 4.428771 79.23257 4.675635 -9.788231      6.440154 
1 1 1 2   14 33 o 57.05437 3.523982 40.01987       4.875667 40.08509       6.414022 39.93060       7.504041 56.91106 4.665778 56.62910 5.507230 0.2819633      7.217968 
1 1 1 2   14 34 o 64.86914 3.404417 51.71037       5.362832 47.40346       7.051367 57.61954       8.259488 61.85583 4.713453 68.16206 5.007444 -6.306225      6.876855 
1 1 1 2   14 35 o 48.41299 3.970297 29.02189       4.642930 30.88338       6.069631 26.39636       7.208439 49.70631 5.082349 45.47619 6.705593 4.230118       8.413991 
1 1 1 2   14 36 o 37.51206 4.508193 17.65214       4.038578 17.92037       5.161833 17.22881       6.484696 37.44793 5.847429 36.18890 7.595706 1.259033       9.585780 
1 1 1 2   14 37 o 47.15792 4.370153 27.83952       4.964997 26.95042       5.803205 30.26779       9.590462 46.11979 5.257271 47.51770 8.598708 -1.397911      10.07853 
1 1 1 2   14 38 o 59.57393 3.966016 44.31386       5.724883 42.97780       6.473899 49.10625       12.26108 58.42955 4.583372 60.21518 8.599771 -1.785637      9.744915 
1 1 1 2   14 39 o 34.31272 4.979153 15.22155       4.041917 13.67622       5.036284 18.01829       6.775235 31.78960 6.712093 35.98361 7.939721 -4.194006      10.39670 
1 1 1 2   14 40 o 30.21888 6.136535 12.41292       4.364502 12.14359       5.004726 13.26820       8.918614 29.43820 7.066277 29.55960 10.20010 -0.1214085     12.40864 
1 1 1 2   14 41 o 45.58350 4.193819 26.81820       4.606399 24.47972       5.788333 30.85697       7.606972 42.54025 5.729150 46.88160 6.861583 -4.341351      8.938931 
1 1 1 2   14 42 o 24.03900 8.012347 9.014462       5.499103 7.314949       9.774961 9.801383       6.651474 23.14829 9.861893 24.65804 8.785605 -1.509752      13.20772 
1 1 1 2   14 43 o 25.38261 6.561286 9.867417       4.087877 16.86066       5.267707 -0.7198514     6.481482 33.30112 6.723142 15.84831 7.292581 17.45281       9.918790 
1 1 1 2   14 44 o 21.81511 6.532066 7.628546       3.743356 10.07899       5.007866 4.525585       5.635315 24.02753 7.620665 18.07509 7.583188 5.952433       10.75078 
1 1 1 2   14 45 o 13.26718 5.928812 0.6136562      3.918397 5.570612       5.913099 -3.267261      5.232085 18.28065 7.724114 12.53887 6.004723 5.741788       9.783590 
1 1 1 2   14 46 o 21.67253 6.701340 8.548920       3.897609 20.18519       5.668674 -1.884648      5.367733 33.43377 7.172559 12.85336 6.135342 20.58041       9.438645 
1 1 1 2   14 47 o 10.44333 4.992391 -2.083402      3.582306 0.4285286      4.976112 -4.785726      5.161252 13.17100 6.171319 11.12896 5.470399 2.042041       8.246845 
1 1 1 2   14 48 o 28.59620 7.627762 17.86946       5.413249 23.27494       6.759529 8.203963       9.038819 30.36360 8.692968 16.48404 7.893598 13.87956       11.74209 
1 1 1 2   15 0  o 94.23936 3.882634 108.4207       8.897415 121.9576       12.48829 94.46586       12.67958 99.89272 5.147547 87.82430 5.959838 12.06842       7.875082 
1 1 1 2   15 1  o 99.10334 2.710455 119.7729       6.539712 123.6716       9.248121 115.8734       9.248979 100.6647 3.776688 97.42890 3.903461 3.235771       5.431426 
1 1 1 2   15 2  o 511.7580 7.503668 3193.921       93.57813 3036.677       127.8009 3375.669       137.3986 498.7867 10.51437 525.8723 10.72176 -27.08566      15.01692 
1 1 1 2   15 3  o 64.39818 2.823128 50.63387       4.419607 50.89814       6.164577 50.35437       6.339634 64.50402 3.940558 64.14821 4.076583 0.3558121      5.669791 
1 1 1 2   15 4  o 377.1958 5.090919 1734.267       46.79497 1693.882       72.89902 1762.571       61.02822 372.6658 8.027235 380.2093 6.586761 -7.543427      10.38373 
1 1 1 2   15 5  o 340.0826 4.662235 1409.689       38.63799 1371.256       60.15755 1436.677       50.41031 335.3289 7.361783 343.2830 6.026025 -7.954102      9.513613 
1 1 1 2   15 6  o 417.3192 5.567589 2123.033       56.62023 2145.049       90.33678 2108.789       72.66403 419.3203 8.840619 415.8494 7.170465 3.470886       11.38298 
1 1 1 2   15 7  o 433.1741 5.755136 2287.525       60.75110 2213.714       94.11328 2340.252       79.54302 425.9577 9.066682 438.0579 7.451343 -12.10019      11.73572 
1 1 1 2   15 8  o 253.5699 4.750215 783.7311       29.35263 0.000000       0.000000 783.7311       29.35263 ?        ?        253.5699 4.750215 0.000000       4.750215 
1 1 1 2   15 9  o 582.4304 7.572406 4137.470       107.4766 4205.123       172.0674 4094.189       137.6266 586.7190 12.03462 579.1827 9.751030 7.536255       15.48917 
1 1 1 2   15 10 o 287.8884 4.070970 1010.157       28.55999 1053.688       46.69508 984.1404       36.09953 293.9546 6.518605 284.1286 5.213753 9.825989       8.347180 
1 1 1 2   15 11 f 494.1167 6.495813 2977.352       78.21664 2942.350       123.0450 3001.086       101.3226 490.8929 10.28587 495.9435 8.383743 -5.050629      13.26975 
1 1 1 2   15 12 o 305.6369 4.270116 1138.647       31.80399 1092.895       49.46353 1170.893       41.52585 299.3438 6.780766 309.8942 5.498814 -10.55042      8.730163 
1 1 1 2   15 13 o 212.1051 3.262609 548.3008       16.86367 529.0101       26.61621 561.2383       21.79693 208.2322 5.249388 214.5755 4.168493 -6.343307      6.703164 
1 1 1 2   15 14 o 382.0066 5.780253 1779.675       53.80887 1762.233       75.86576 1797.331       76.33083 379.9568 8.193615 383.7244 8.162900 -3.767639      11.56582 
1 1 1 2   15 15 o 591.2078 9.923199 4271.993       142.9644 4327.243       177.2247 4169.053       241.9099 594.5415 12.23224 582.0378 17.07403 12.50366       21.00357 
1 1 1 2   15 16 o 188.4173 4.012753 432.8241       18.42465 424.7012       33.25119 436.4231       22.13313 186.3649 7.335949 189.1131 4.806591 -2.748245      8.770374 
1 1 1 2   15 17 o 110.3338 3.314448 148.5370       8.901502 155.4596       17.54544 146.1376       10.32961 112.6664 6.417018 109.4094 3.880445 3.257011       7.499065 
1 1 1 2   15 18 o 407.6240 6.126180 2028.825       60.85351 2084.350       87.75948 1977.403       84.45529 412.7157 8.725834 402.0087 8.620955 10.70703       12.26626 
1 1 1 2   15 19 o 271.0308 4.380228 896.2190       28.93021 878.6227       40.68662 914.2133       41.14420 268.1774 6.225774 273.5613 6.171885 -5.383911      8.766552 
1 1 1 2   15 20 o 246.7706 4.104594 743.0225       24.68311 761.9358       35.61055 725.5330       34.24391 249.7110 5.852007 243.6829 5.766632 6.028152       8.215840 
1 1 1 2   15 21 o 216.3293 3.753774 571.0177       19.78880 562.7070       27.93952 579.3834       28.03189 214.5941 5.342752 217.7577 5.282540 -3.163620      7.513337 
1 1 1 2   15 22 o 189.0602 3.493777 436.1397       16.09650 458.9059       23.42469 415.7728       22.15602 193.7280 4.965965 184.3969 4.935063 9.331070       7.001118 
1 1 1 2   15 23 o 34.67120 4.213464 14.89601       3.486958 16.31861       5.229587 13.75725       4.678854 36.00486 6.182996 33.01294 6.038377 2.991913       8.642421 
1 1 1 2   15 24 o 130.6805 3.012017 208.3573       9.591892 205.6116       13.50905 211.1490       13.62162 129.6581 4.281394 131.3968 4.259731 -1.738678      6.039506 
1 1 1 2   15 25 o 201.9979 3.659602 498.2768       18.01427 493.0265       25.28794 503.6862       25.66838 200.6410 5.176312 202.7954 5.198312 -2.154434      7.335984 
1 1 1 2   15 26 o 213.5958 4.444527 557.9656       23.13419 583.1015       28.47823 509.1928       39.66937 218.1707 5.356493 203.0412 8.033283 15.12947       9.655343 
1 1 1 2   15 27 o 80.13135 2.966930 78.49004       5.783561 80.25574       8.064894 76.62057       8.298488 80.91100 4.103699 79.02534 4.325695 1.885666       5.962548 
1 1 1 2   15 28 o 58.15961 3.546497 41.48973       5.002507 36.87536       6.208730 50.02873       8.445977 54.67035 4.706066 63.61694 5.502080 -8.946590      7.240162 
1 1 1 2   15 29 o 155.9986 3.299039 297.3750       12.54135 279.2445       17.10120 318.4727       18.44750 150.8815 4.656662 161.1299 4.703164 -10.24841      6.618478 
1 1 1 2   15 30 o 78.20708 3.419079 74.92405       6.500408 73.87331       9.774542 75.75728       8.704202 77.38211 5.213895 78.47791 4.571193 -1.095802      6.934011 
1 1 1 2   15 31 o 31.20313 7.054284 12.52880       5.237594 5.249340       10.25925 15.09489       6.091191 26.71164 10.59091 34.22923 7.509328 -7.517582      12.98296 
1 1 1 2   15 32 o 162.5680 3.391378 323.4771       13.43530 319.3494       18.64995 327.9304       19.37134 161.1078 4.755548 163.2195 4.875720 -2.111633      6.810865 
1 1 1 2   15 33 o 93.35980 3.127772 106.7874       7.105874 107.0932       9.690822 106.4319       10.45058 93.27181 4.274944 92.90077 4.630801 0.3710403      6.302338 
1 1 1 2   15 34 o 20.20008 6.442980 5.001083       3.575463 0.4387017      4.537209 12.47644       5.807765 16.04576 6.772225 30.90304 7.731836 -14.85728      10.27834 
1 1 1 2   15 35 o 102.8120 3.505778 130.0179       8.770580 126.5774       13.21431 132.7268       11.72565 100.7921 5.399705 103.5072 4.660640 -2.715157      7.132909 
1 1 1 2   15 36 o 31.12422 5.241329 12.38934       3.834256 10.72408       4.895528 15.03183       6.166882 28.51128 7.078794 33.65436 7.688345 -5.143085      10.45084 
1 1 1 2   15 37 o 30.46416 6.095680 12.15658       4.367196 12.23253       4.822242 11.81018       10.29862 30.38330 6.693945 30.34399 10.91791 0.3931618E-01  12.80662 
1 1 1 2   15 38 o 66.77103 4.594690 56.24255       7.430615 56.24255       7.430615 0.000000       0.000000 66.77103 4.594690 ?        ?        0.000000       4.594690 
1 1 1 2   15 39 o 21.98632 6.719273 6.501101       3.932647 5.337736       4.556690 9.897338       7.785572 20.65661 7.280185 26.80226 9.509700 -6.145643      11.97646 
1 1 1 2   15 40 o 40.29108 4.293525 20.89151       4.150730 19.01975       5.339637 23.74955       6.598128 37.47883 6.052586 41.47982 6.760109 -4.000988      9.073747 
1 1 1 2   15 41 o 25.27187 6.280104 9.092325       3.850618 7.215160       4.717533 12.83946       6.665206 22.30117 7.420845 28.45403 8.757230 -6.152857      11.47859 
1 1 1 2   15 42 o 39.60637 4.749724 21.16073       4.492928 19.36083       5.705489 24.09885       7.289606 36.22416 6.710422 39.23441 7.897944 -3.010250      10.36375 
1 1 1 2   15 43 o 8.700507 4.324373 -7.459374      3.561018 -8.577529      4.669908 -5.905868      5.504449 10.15667 5.031441 12.26236 5.943235 -2.105697      7.787005 
1 1 1 2   15 44 o 22.22883 6.731690 8.166537       3.959334 15.91422       6.567113 3.742047       4.962726 28.68962 8.665650 16.94156 7.112503 11.74807       11.21076 
1 1 1 2   15 45 o 11.87252 5.426355 -0.4003631     3.507567 2.720953       4.859646 -3.794793      5.067797 15.47726 6.772623 11.98917 5.784401 3.488092       8.906610 
1 1 1 2   15 46 o 18.31765 6.677400 6.294379       3.868594 11.37802       5.431766 1.061083       5.511136 22.63494 7.950931 14.21218 6.604248 8.422760       10.33602 
1 1 1 2   15 47 o 28.73199 6.244608 14.68857       4.247158 16.12765       6.053265 13.29322       5.960584 25.47853 8.403443 22.60580 8.280938 2.872728       11.79796 
1 1 1 2   15 48 o 13.00998 6.189666 0.6456971      5.371290 0.6456971      5.371290 0.000000       0.000000 13.00998 6.189666 ?        ?        0.000000       6.189666 
1 1 1 2   16 0  o 893.8366 12.80348 9759.559       278.8831 9706.946       392.7538 9813.063       396.0676 890.2917 18.10306 895.1312 18.15710 -4.839478      25.63984 
1 1 1 2   16 1  o 406.7547 8.618594 2018.249       85.42896 2018.249       85.42896 0.000000       0.000000 406.7547 8.618594 ?        ?        0.000000       8.618594 
1 1 1 2   16 2  o 557.9628 9.407872 3798.580       127.9183 3983.852       161.5012 3486.669       209.5491 571.2009 11.60248 533.6038 16.13355 37.59717       19.87232 
1 1 1 2   16 3  o 646.5161 13.24690 5107.118       208.7036 4946.652       288.0628 5284.411       302.7905 635.1456 18.63148 656.4185 18.94873 -21.27295      26.57417 
1 1 1 2   16 4  o 887.9873 12.72627 9632.879       275.3873 10394.02       581.3719 9412.691       312.6934 918.2437 26.00744 877.4125 14.62442 40.83124       29.83724 
1 1 1 2   16 5  o 464.0550 7.920040 2626.606       89.56387 0.000000       0.000000 2626.606       89.56387 ?        ?        464.0550 7.920040 0.000000       7.920040 
1 1 1 2   16 6  o 837.4235 12.00414 8565.680       244.9696 8094.998       470.5305 8740.695       286.9216 810.8314 23.83927 845.5776 13.92431 -34.74622      27.60792 
1 1 1 2   16 7  o 364.6430 5.550169 1620.983       49.31853 1565.081       68.04681 1682.843       71.58121 358.2053 7.795424 371.4314 7.908322 -13.22610      11.10451 
1 1 1 2   16 8  o 577.8392 8.415316 4073.702       118.4987 4071.078       237.7721 4074.569       136.6824 576.2554 16.95048 577.7756 9.707720 -1.520142      19.53352 
1 1 1 2   16 9  o 267.8356 4.337709 874.3837       28.31163 883.0341       58.09386 871.6893       32.42245 268.8543 8.879190 267.4072 4.975500 1.447083       10.17819 
1 1 1 2   16 10 o 797.0687 10.23992 7757.911       198.8970 7942.791       319.9048 7641.410       253.9460 805.1649 16.30421 790.4952 13.18275 14.66962       20.96694 
1 1 1 2   16 11 o 169.5884 2.900214 350.4942       11.98567 355.2019       19.58993 347.6776       15.15273 170.6318 4.715778 168.8958 3.681594 1.736023       5.982700 
1 1 1 2   16 12 o 256.4646 4.207644 801.7754       26.29677 782.0467       36.92839 822.0715       37.45570 253.2324 5.984186 259.6342 5.919978 -6.401794      8.417638 
1 1 1 2   16 13 f 142.6508 4.030354 248.2557       13.99646 254.1216       21.02143 243.5844       18.75914 144.2198 5.994446 141.2264 5.461101 2.993347       8.109069 
1 1 1 2   16 14 o 158.4340 4.388334 306.2720       16.92644 294.2217       25.71595 315.4834       22.48356 155.1274 6.819308 160.7218 5.749824 -5.594376      8.919833 
1 1 1 2   16 15 o 343.5726 6.133257 1440.379       51.35063 1486.342       92.03770 1419.605       61.87659 348.3030 10.85683 340.9681 7.446918 7.334900       13.16539 
1 1 1 2   16 16 o 189.2452 4.026615 436.7028       18.56954 405.5898       32.60838 451.6352       22.59037 182.0694 7.364673 192.3615 4.822938 -10.29213      8.803359 
1 1 1 2   16 17 o 286.3659 4.582751 1000.379       31.98039 1030.972       46.43580 972.7763       44.10812 290.5310 6.558799 282.2271 6.413332 8.303894       9.173258 
1 1 1 2   16 18 o 57.88116 3.059118 40.96053       4.299568 36.54396       6.578065 44.25475       5.681089 54.49014 5.009899 60.10962 3.899435 -5.619476      6.348597 
1 1 1 2   16 19 o 153.7567 3.738216 288.3836       14.00666 275.4337       16.47108 322.2086       26.61998 150.1587 4.506374 162.1759 6.750500 -12.01715      8.116444 
1 1 1 2   16 20 o 185.5511 3.430832 419.9836       15.51312 415.2062       22.08704 424.6349       21.79362 184.3155 4.921849 186.4117 4.801554 -2.096191      6.876010 
1 1 1 2   16 21 o 204.4467 3.640199 510.0584       18.13599 533.8716       26.49208 489.0551       24.88009 209.0011 5.201532 199.9826 5.109513 9.018539       7.291300 
1 1 1 2   16 22 o 151.5050 4.088642 280.4836       15.08151 273.7500       21.36358 287.1730       21.29355 149.4445 5.877677 153.0941 5.717645 -3.649612      8.199912 
1 1 1 2   16 23 o 255.9098 4.245711 800.0114       26.47728 803.2957       37.68149 796.8083       37.21199 256.0987 6.037881 255.0736 5.986613 1.025070       8.502679 
1 1 1 2   16 24 o 53.94332 3.160023 35.63322       4.135785 34.15619       5.808992 37.15154       5.889606 52.66168 4.571832 54.95507 4.435525 -2.293392      6.369893 
1 1 1 2   16 25 o 119.7436 3.553942 175.2602       10.35900 174.8669       12.16151 176.2999       19.77326 119.5367 4.181379 119.5973 6.812726 -0.6063080E-01 7.993570 
1 1 1 2   16 26 o 183.2699 4.111478 410.6563       18.36222 418.2766       22.14989 393.9123       32.83354 184.7605 4.923951 178.6134 7.560506 6.147079       9.022557 
1 1 1 2   16 27 o 81.21664 3.251124 80.69128       6.421495 78.98968       8.144551 83.48698       10.43957 80.24960 4.179143 82.35847 5.228612 -2.108871      6.693551 
1 1 1 2   16 28 o 73.00692 3.356556 65.26556       5.955666 66.05885       7.620755 64.02086       9.545903 73.33733 4.282831 72.00870 5.481143 1.328629       6.955974 
1 1 1 2   16 29 o 112.5132 3.027267 154.7558       8.292690 154.1123       11.61095 155.4259       11.84791 112.0983 4.258172 112.5638 4.327297 -0.4654770     6.071040 
1 1 1 2   16 30 o 47.50279 3.864810 27.80510       4.435249 24.92464       5.933963 31.45124       6.676219 44.67320 5.571594 50.26545 5.542250 -5.592251      7.858702 
1 1 1 2   16 31 o 115.5270 4.551429 164.1004       12.78841 0.000000       0.000000 164.1004       12.78841 ?        ?        115.5270 4.551429 0.000000       4.551429 
1 1 1 2   16 32 o 38.66594 4.456724 18.60467       4.122596 18.95454       5.449147 18.13635       6.304371 38.72417 5.965734 37.59307 7.142805 1.131104       9.306431 
1 1 1 2   16 33 o 62.34956 3.428869 47.78778       5.189734 38.54948       6.857369 60.17287       7.939824 55.65852 5.112879 69.73546 4.699642 -14.07694      6.944650 
1 1 1 2   16 34 o 81.05820 3.546564 80.82165       6.988573 72.95958       10.18016 87.82923       9.611045 76.49344 5.497952 84.20993 4.702182 -7.716492      7.234499 
1 1 1 2   16 35 f 31.57513 5.268046 12.71648       3.910779 12.35748       5.018849 13.27139       6.239747 30.72706 6.874816 31.63147 8.069910 -0.9044132     10.60125 
1 1 1 2   16 36 o 74.17852 3.791533 68.16842       6.831028 62.71449       7.687845 88.62630       14.88950 70.91161 4.471654 82.75278 7.463615 -11.84116      8.700646 
1 1 1 2   16 37 o 14.86709 6.080239 1.219684       3.497046 -2.969587      4.381196 8.574738       5.805190 12.99300 5.984867 25.51321 8.217024 -12.52022      10.16554 
1 1 1 2   16 38 o 29.28399 7.107507 11.73001       5.020146 11.73001       5.020146 0.000000       0.000000 29.28399 7.107507 ?        ?        0.000000       7.107507 
1 1 1 2   16 39 o 46.91264 4.404148 28.15313       4.975984 26.96716       5.820054 31.37560       9.593660 45.39634 5.364536 46.55693 8.777818 -1.160583      10.28729 
1 1 1 2   16 40 o 30.44500 5.701735 12.62294       4.074764 13.64783       5.214746 11.01604       6.529654 30.86548 7.083420 26.94431 8.717875 3.921164       11.23282 
1 1 1 2   16 41 o 25.14314 6.363657 9.144532       3.901867 8.965577       5.008978 9.420704       6.222524 24.26685 7.611656 24.50193 8.516643 -0.2350788     11.42237 
1 1 1 2   16 42 o 18.32096 6.654834 4.762701       3.837703 5.974464       5.456850 3.576807       5.398289 20.12476 7.799042 17.90696 7.460675 2.217794       10.79290 
1 1 1 2   16 43 o 20.25073 7.278064 6.706882       4.574999 10.20417       8.894105 5.448592       5.334908 22.60539 9.507912 18.93478 7.593997 3.670609       12.16837 
1 1 1 2   16 44 o 19.16875 6.627001 6.082074       3.765311 10.60340       5.272909 1.377727       5.378570 23.79436 7.842877 15.25673 6.871635 8.537633       10.42737 
1 1 1 2   16 45 f 16.74282 6.544068 4.659004       3.867912 8.761324       5.422414 0.4092849      5.518970 20.55524 7.822977 14.24324 6.615353 6.312004       10.24509 
1 1 1 2   16 46 o 14.49949 6.146799 3.087158       3.765347 0.5301433      5.311345 5.670649       5.338771 13.60069 6.373664 16.86546 7.239094 -3.264769      9.645106 
1 1 1 2   16 47 o 17.08811 6.996244 6.443951       4.636428 9.950540       5.827988 0.3986082      7.652207 19.28111 7.862997 14.13639 6.887036 5.144713       10.45265 
1 1 1 2   17 0  o 590.4896 8.597528 4253.694       123.7149 4037.329       168.8328 4504.586       181.8050 574.9342 12.05043 607.2644 12.28547 -32.33020      17.20889 
1 1 1 2   17 1  o 274.4967 4.418152 918.3810       29.55384 919.0726       41.67324 917.6813       41.91873 274.5556 6.228606 274.3465 6.270073 0.2091064      8.837949 
1 1 1 2   17 2  o 348.7550 5.350496 1482.718       45.47269 1566.047       66.41055 1409.164       62.39348 358.3322 7.605278 339.9135 7.532424 18.41873       10.70410 
1 1 1 2   17 3  o 351.9413 6.217048 1510.208       53.32005 1542.420       92.90231 1494.385       65.11182 355.2780 10.74289 350.0334 7.633333 5.244537       13.17868 
1 1 1 2   17 4  o 561.3143 11.60989 3848.149       158.8073 0.000000       0.000000 3848.149       158.8073 ?        ?        561.3143 11.60989 0.000000       11.60989 
1 1 1 2   17 5  o 708.9340 10.22879 6135.418       176.7120 6237.620       252.8322 6037.812       247.0839 714.1239 14.52856 702.6112 14.43090 11.51270       20.47755 
1 1 1 2   17 6  o 579.0421 8.432385 4090.800       118.9862 3996.697       165.5322 4191.401       171.1523 571.9669 11.87615 585.7181 11.99107 -13.75128      16.87687 
1 1 1 2   17 7  o 67.37914 3.720133 55.50033       6.084588 42.12244       10.59565 62.08250       7.432215 58.26673 7.646631 71.23830 4.301270 -12.97157      8.773363 
1 1 1 2   17 8  o 170.7269 3.241667 355.2261       13.48673 341.2050       18.56791 370.8842       19.62193 167.2437 4.560185 174.3683 4.621908 -7.124588      6.492867 
1 1 1 2   17 9  o 486.8065 8.311538 2891.912       98.59929 2878.846       171.0290 2898.417       120.6709 484.7342 14.49500 487.1686 10.16453 -2.434448      17.70374 
1 1 1 2   17 10 o 834.7332 11.99893 8519.413       244.0768 8680.604       349.7740 8366.427       340.7559 841.1033 17.06484 825.7863 16.93322 15.31696       24.04044 
1 1 1 2   17 11 o 72.56467 4.126731 64.39518       7.267305 57.70198       8.693183 79.92809       13.24305 68.59194 5.240471 80.65809 6.800886 -12.06615      8.585720 
1 1 1 2   17 12 o 307.9169 5.548344 1156.311       41.63254 1236.379       77.08681 1123.339       49.46727 317.9181 9.962425 303.4315 6.689925 14.48660       12.00021 
1 1 1 2   17 13 o 208.7880 3.668030 531.3979       18.66270 506.9047       38.10711 539.1261       21.40545 203.6137 7.693871 210.2862 4.177126 -6.672455      8.754658 
1 1 1 2   17 14 o 371.9652 6.501233 1688.738       58.92968 1723.454       105.7008 1673.080       70.98528 374.8890 11.58406 370.0878 7.870955 4.801239       14.00509 
1 1 1 2   17 15 o 274.5757 3.949286 919.3090       26.42511 869.0081       40.95515 955.1855       34.58802 266.8013 6.299188 279.8129 5.072497 -13.01166      8.087645 
1 1 1 2   17 16 o 253.9913 4.171522 786.8312       25.81960 816.9775       54.85942 778.2534       29.26331 258.2266 8.730500 252.5650 4.754602 5.661545       9.941221 
1 1 1 2   17 17 o 111.9228 2.887934 152.8204       7.870078 158.2597       11.89733 148.5884       10.49420 113.8147 4.297303 110.3035 3.910313 3.511200       5.810109 
1 1 1 2   17 18 o 186.8161 3.461315 425.6584       15.75765 474.0654       23.91321 388.5078       20.94916 196.9861 4.985578 178.3300 4.825088 18.65604       6.938117 
1 1 1 2   17 19 o 201.2969 3.608456 494.3432       17.70087 495.1224       25.43766 493.6116       24.64670 201.2534 5.191113 200.9651 5.036679 0.2882690      7.232965 
1 1 1 2   17 20 o 246.7344 4.118618 743.1730       24.76380 794.0623       36.68174 700.5573       33.56770 254.7868 5.907951 239.3396 5.755338 15.44717       8.247897 
1 1 1 2   17 21 o 259.0568 4.865827 820.1470       30.71764 852.0859       53.68735 804.6027       37.45398 263.1529 8.382665 256.3924 5.994550 6.760468       10.30552 
1 1 1 2   17 22 o 263.1510 4.328903 845.9594       27.75997 894.2727       40.72496 804.0281       37.93989 270.1946 6.185117 256.2226 6.076347 13.97198       8.670506 
1 1 1 2   17 23 o 134.5310 3.021213 220.8342       9.904664 217.6596       14.13476 223.8969       13.88325 133.3884 4.354283 135.3049 4.215720 -1.916458      6.060699 
1 1 1 2   17 24 o 37.48212 3.863976 17.34354       3.478832 20.00954       5.073518 14.97780       4.779277 40.07888 5.326406 34.48065 5.899835 5.598236       7.948500 
1 1 1 2   17 25 o 171.2218 3.982250 358.3166       16.61589 368.4195       20.06687 336.2828       29.63474 173.4412 4.752266 165.0940 7.384724 8.347183       8.781695 
1 1 1 2   17 26 o 94.02061 3.203119 108.0746       7.328204 98.84029       9.184766 124.2505       12.15621 89.79569 4.209075 100.5902 4.974576 -10.79446      6.516343 
1 1 1 2   17 27 o 15.44265 5.951363 1.920389       3.164604 5.398559       4.218507 -2.556220      4.785838 21.36368 7.013706 14.28761 6.454252 7.076069       9.531497 
1 1 1 2   17 28 o 67.38213 3.218668 55.60215       5.269865 56.52942       7.394402 54.64505       7.512429 67.78112 4.502222 66.61385 4.657193 1.167267       6.477611 
1 1 1 2   17 29 o 86.81776 3.076732 92.21663       6.499011 92.99210       9.145933 91.42570       9.236717 87.00883 4.327065 86.25782 4.408858 0.7510147      6.177501 
1 1 1 2   17 30 o 55.85081 3.523941 38.31958       4.771714 35.07129       6.491430 42.13805       7.038119 53.18061 5.070292 58.34888 4.997892 -5.168266      7.119466 
1 1 1 2   17 31 o 69.31689 4.071775 59.12779       6.847659 63.67677       14.13297 57.73228       7.827846 70.87395 8.342576 68.37344 4.727162 2.500511       9.588777 
1 1 1 2   17 32 o 137.2523 3.608167 231.0602       12.05773 219.0606       19.02516 239.1159       15.58824 132.9076 5.888736 139.3407 4.597035 -6.433167      7.470605 
1 1 1 2   17 33 o 30.88001 5.885905 12.21657       4.267573 11.12521       6.094723 13.26636       5.977504 29.24398 8.215012 31.85191 7.771053 -2.607935      11.30821 
1 1 1 2   17 34 o 18.72796 6.610743 3.904836       3.758326 9.217486       4.853455 -4.052029      5.939725 26.58943 7.279025 15.21317 6.993319 11.37626       10.09409 
1 1 1 2   17 35 o 56.19731 4.251462 39.29762       5.779048 37.11229       6.600094 46.47839       11.96404 54.37424 5.038347 59.43632 8.502097 -5.062080      9.882843 
1 1 1 2   17 36 o 31.82459 5.309227 13.04025       3.972498 14.06197       5.298970 11.72922       6.002498 32.56081 6.893279 29.45394 8.107635 3.106876       10.64195 
1 1 1 2   17 37 o 69.65363 3.742938 60.48071       6.329865 64.43983       7.777137 52.71106       10.89486 71.55750 4.482450 63.11409 7.213067 8.443417       8.492390 
1 1 1 2   17 38 o 22.93114 7.050840 7.114338       4.322019 5.633182       4.804534 13.39718       9.895301 21.17910 7.474576 30.26714 10.72278 -9.088036      13.07085 
1 1 1 2   17 39 o 71.50575 3.409726 64.20720       5.924387 67.81908       7.987715 59.79088       8.832537 72.67793 4.532640 67.49626 5.415346 5.181671       7.061926 
1 1 1 2   17 40 o 24.81611 6.481716 8.809833       3.961835 7.972785       5.084434 10.10358       6.321091 23.30143 7.702342 25.62687 8.591228 -2.325443      11.53843 
1 1 1 2   17 41 o 19.64934 7.330631 5.398650       4.708694 5.796909       8.856446 5.241712       5.559572 21.65147 9.309039 19.82918 7.816995 1.822294       12.15581 
1 1 1 2   17 42 o 18.12989 6.489573 4.808274       3.633388 3.867678       4.786623 6.087055       5.581177 17.53312 7.135018 19.93365 7.840117 -2.400530      10.60075 
1 1 1 2   17 43 o 21.90598 7.481701 8.327234       4.794843 0.000000       0.000000 8.327234       4.794843 ?        ?        21.90598 7.481701 0.000000       7.481701 
1 1 1 2   17 44 o 23.36293 6.469077 9.130144       3.808855 10.99328       5.485713 7.395908       5.292546 23.59805 8.003540 19.82982 7.681829 3.768225       11.09356 
1 1 1 2   17 45 o 17.00257 6.481263 5.053233       3.725683 4.816777       5.253519 5.292480       5.284440 16.71653 7.178212 17.09388 7.265679 -0.3773537     10.21356 
1 1 1 2   17 46 o 28.47062 7.112874 15.71947       4.920321 16.59324       6.260071 14.30725       7.958521 25.89770 8.545968 21.03868 8.928411 4.859018       12.35921 
1 1 1 2   17 47 o 12.45513 5.678493 1.166006       3.810329 3.485646       5.326497 -1.265094      5.452967 14.60689 6.680196 12.36376 5.973759 2.243125       8.961630 
1 1 1 2   18 0  o 676.7043 11.31384 5592.887       186.5714 5150.794       305.2245 5856.604       235.7396 647.6451 19.36128 692.0424 13.97860 -44.39728      23.88013 
1 1 1 2   18 1  o 369.5201 7.967149 1665.703       71.74259 1782.078       105.3451 1565.044       97.97412 381.8116 11.33470 357.7945 11.25076 24.01706       15.97044 
1 1 1 2   18 2  o 522.4657 8.858730 3330.936       112.7886 3430.113       198.5235 3283.665       137.0568 529.1710 15.41143 518.5533 10.84603 10.61761       18.84538 
1 1 1 2   18 3  o 543.4462 9.203114 3604.361       121.8786 3534.698       208.4728 3640.535       150.2257 537.0594 15.94675 545.9414 11.29177 -8.881958      19.53978 
1 1 1 2   18 4  o 534.8125 7.013247 3488.450       91.40223 3328.686       140.0324 3607.043       120.6475 522.0503 11.00728 543.6455 9.106812 -21.59521      14.28615 
1 1 1 2   18 5  o 694.8632 8.974802 5892.829       151.9709 5950.488       241.7312 5855.147       195.4191 697.3828 14.22412 692.2568 11.58413 5.126038       18.34442 
1 1 1 2   18 6  o 797.8462 10.25751 7773.697       199.4331 8077.919       323.5945 7587.371       253.2461 811.8936 16.35558 787.6439 13.19401 24.24969       21.01397 
1 1 1 2   18 7  o 235.5045 3.538663 675.9716       20.30835 681.7435       32.08445 672.1132       26.23207 236.4580 5.568067 234.8087 4.584398 1.649307       7.212494 
1 1 1 2   18 8  o 281.3486 4.025498 964.8661       27.59945 1033.795       45.42621 924.5338       34.74826 291.1370 6.402846 275.3699 5.178219 15.76703       8.234706 
1 1 1 2   18 9  o 671.3334 9.730791 5505.136       159.1925 6203.172       346.8163 5318.808       179.1839 709.4714 20.08008 659.6176 11.14733 49.85382       22.96677 
1 1 1 2   18 10 o 211.4473 4.225757 545.0513       21.77423 564.4755       40.19970 536.9864       25.90311 214.9157 7.688095 209.8532 5.065241 5.062515       9.206708 
1 1 1 2   18 11 o 196.8440 4.029445 472.3704       19.32874 507.6084       36.74277 458.8877       22.72766 203.7904 7.410985 193.9925 4.807659 9.797897       8.833816 
1 1 1 2   18 12 o 147.0253 2.793378 263.4626       10.00824 278.9501       17.22672 255.5717       12.29630 151.1722 4.681859 144.7949 3.484858 6.377304       5.836441 
1 1 1 2   18 13 o 175.8262 2.991931 376.8304       12.81951 373.6170       20.85606 378.7817       16.25216 174.9484 4.896816 176.2599 3.783743 -1.311539      6.188337 
1 1 1 2   18 14 o 328.6658 4.564857 1317.606       36.56097 1335.445       58.86267 1306.401       46.65098 330.6038 7.306276 327.1514 5.851617 3.452332       9.360721 
1 1 1 2   18 15 o 314.3556 4.407412 1205.482       33.76300 1244.194       54.98413 1182.050       42.77765 319.0673 7.071621 311.1684 5.641379 7.898926       9.046159 
1 1 1 2   18 16 o 183.7953 3.040120 411.8705       13.61637 408.2774       22.15482 414.0516       17.26129 182.8235 4.977421 184.2451 3.844514 -1.421539      6.289277 
1 1 1 2   18 17 o 242.5327 3.614142 717.5021       21.36051 724.9063       34.55942 712.9250       27.17225 243.5678 5.822514 241.6744 4.613801 1.893402       7.428918 
1 1 1 2   18 18 o 80.80129 2.827253 79.70995       5.558394 74.19016       8.383243 84.04018       7.425180 77.83076 4.438424 82.91357 3.684097 -5.082809      5.768204 
1 1 1 2   18 19 o 69.92092 2.883628 59.72546       4.902859 56.63055       7.655512 61.87756       6.383830 67.93449 4.652404 71.11306 3.696487 -3.178574      5.942128 
1 1 1 2   18 20 o 104.5491 3.183071 133.4742       8.100216 131.3893       14.03441 134.5157       9.919136 103.4923 5.585501 104.9005 3.886977 -1.408157      6.804882 
1 1 1 2   18 21 o 107.7369 2.872806 141.6888       7.535625 139.7393       11.09643 143.3573       10.26593 106.8734 4.269259 108.2867 3.896688 -1.413307      5.780203 
1 1 1 2   18 22 o 122.6909 2.969050 183.6596       8.876993 189.0021       13.04457 179.0514       12.11485 124.2960 4.313159 120.9979 4.114684 3.298088       5.961037 
1 1 1 2   18 23 f 102.1774 2.888277 127.4920       7.184455 125.0969       10.37566 129.6982       9.957913 101.0839 4.221383 102.9566 3.976448 -1.872711      5.799329 
1 1 1 2   18 24 o 106.2993 3.609639 138.1770       9.336835 141.5036       10.97154 129.4416       17.77913 107.5052 4.196012 102.3277 7.175342 5.177505       8.312163 
1 1 1 2   18 25 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 2   18 26 o 23.86611 5.738965 7.272631       3.296585 8.731606       4.829791 6.000070       4.510699 26.22225 7.293701 22.38848 7.245982 3.833773       10.28116 
1 1 1 2   18 27 o 34.97954 4.456876 15.22409       3.712939 19.04551       5.141797 11.06025       5.367232 38.99550 5.568817 29.35752 7.481619 9.637974       9.326647 
1 1 1 2   18 28 o 93.21790 3.040261 106.2735       6.897075 101.3371       9.578206 111.5896       9.939709 90.84752 4.339026 95.35044 4.288722 -4.502922      6.100843 
1 1 1 2   18 29 o 52.98194 3.642122 34.51148       4.673780 33.17922       6.350174 36.08623       6.903944 51.71788 5.105096 53.91645 5.324015 -2.198574      7.376120 
1 1 1 2   18 30 o 64.38528 3.354931 50.86120       5.245725 53.34525       7.397426 48.34854       7.439907 65.73919 4.647601 62.51810 4.923136 3.221088       6.770337 
1 1 1 2   18 31 o 79.60910 3.954217 77.92532       7.647120 84.40376       15.30720 75.77071       8.827643 81.83906 7.768395 78.36330 4.643522 3.475761       9.050428 
1 1 1 2   18 32 f 27.87560 6.252754 10.02764       4.142617 6.525146       6.033303 13.15180       5.698143 23.93274 8.381701 31.78388 7.481849 -7.851143      11.23526 
1 1 1 2   18 33 o 79.48054 3.582613 77.74371       6.921159 80.55888       10.77492 75.76628       9.030507 80.36411 5.535756 78.16318 4.763663 2.200935       7.303224 
1 1 1 2   18 34 o 87.13676 3.807033 93.74096       8.064449 96.53641       9.414731 86.03802       15.62823 88.23927 4.392150 81.69721 7.950386 6.542053       9.082930 
1 1 1 2   18 35 o 59.61433 3.563023 44.00910       5.152515 51.12418       7.161942 36.37547       7.418332 63.92828 4.628634 53.45963 5.786485 10.46865       7.409970 
1 1 1 2   18 36 o 51.02096 4.176869 32.63041       5.147790 37.42414       6.402979 23.86856       8.656508 54.39434 4.882387 41.59867 8.813759 12.79567       10.07572 
1 1 1 2   18 37 o 68.74010 3.453549 58.86461       5.766582 58.82216       7.765209 58.91680       8.610495 68.08096 4.709514 67.81046 5.251592 0.2705078      7.053988 
1 1 1 2   18 38 o 12.48559 5.748801 -2.453046      4.036583 -5.158329      4.453460 10.00135       9.555481 11.71591 5.591312 27.05849 10.36361 -15.34258      11.77570 
1 1 1 2   18 39 o 15.45031 6.296417 1.844282       3.733943 2.102103       4.788590 1.444359       5.963997 16.98493 7.047441 17.74571 7.634560 -0.7607803     10.39004 
1 1 1 2   18 40 o 43.89356 5.531397 26.32475       5.785488 42.69089       11.18873 20.35190       6.759253 51.59639 9.237917 36.62370 7.811976 14.97269       12.09819 
1 1 1 2   18 41 o 26.81788 6.282018 10.67012       4.033020 14.32214       5.344474 5.840025       6.146325 30.24617 7.328822 20.26141 8.142429 9.984768       10.95494 
1 1 1 2   18 42 o 18.34349 6.898290 5.042299       4.186978 -1.076025      6.582650 9.199549       5.426096 15.44660 7.191356 22.93339 7.954000 -7.486791      10.72295 
1 1 1 2   18 43 o 39.98808 5.912795 24.30519       5.588327 40.38882       12.03240 19.88171       6.310183 40.11973 11.63268 33.55306 7.856616 6.566666       14.03730 
1 1 1 2   18 44 o 15.67714 6.283681 3.664677       3.650401 6.966949       5.295391 0.6743984      5.039037 19.03133 7.588309 14.12277 6.473272 4.908557       9.974251 
1 1 1 2   18 45 o 22.14844 6.824248 9.341100       4.046146 7.841115       5.707060 10.85701       5.737288 18.68706 7.718091 21.44858 8.073092 -2.761522      11.16887 
1 1 1 2   18 46 o 12.62321 5.754915 1.024635       3.913127 12.84447       6.031116 -7.568745      5.142496 21.97371 8.275832 10.18057 5.081806 11.79314       9.711547 
1 1 1 2   19 0  o 469.6873 6.971944 2690.766       79.79925 2603.227       110.2554 2787.070       115.6436 461.7496 9.798450 477.7627 9.932839 -16.01303      13.95245 
1 1 1 2   19 1  o 186.2221 4.072310 422.6925       18.48027 448.0482       23.08792 377.4807       30.82995 191.6461 4.947799 175.7665 7.213140 15.87958       8.747005 
1 1 1 2   19 2  f 480.6184 7.116472 2817.677       83.34916 2687.526       114.0480 2966.883       122.1117 469.1349 9.975945 492.8936 10.16642 -23.75876      14.24344 
1 1 1 2   19 3  o 284.6386 5.297513 987.7997       36.74531 1005.586       45.24244 953.3285       62.98503 287.1452 6.465593 279.2931 9.267079 7.852112       11.29967 
1 1 1 2   19 4  o 71.59649 3.579467 62.63293       6.225391 57.04609       7.532964 74.66852       11.05647 68.25608 4.554923 78.03242 5.857148 -9.776337      7.419805 
1 1 1 2   19 5  o 623.5778 8.100035 4745.515       123.0874 4611.917       190.9539 4840.485       160.9982 614.0091 12.76197 629.4443 10.49609 -15.43524      16.52379 
1 1 1 2   19 6  o 178.4683 3.023254 388.1780       13.14837 399.2811       20.90012 380.9053       16.91500 180.9094 4.744894 176.7743 3.926601 4.135147       6.158913 
1 1 1 2   19 7  o 393.3833 5.315898 1887.021       50.95991 1893.541       80.67875 1882.693       65.73250 393.8319 8.406441 392.8295 6.866571 1.002411       10.85440 
1 1 1 2   19 8  o 693.2560 10.01453 5873.559       169.1844 6121.895       246.3006 5651.709       232.7958 706.6559 14.30281 679.0444 14.06827 27.61145       20.06207 
1 1 1 2   19 9  o 166.8256 3.746976 339.2614       15.23280 353.6305       28.51867 333.5255       18.01846 170.0882 6.894774 165.3324 4.476343 4.755798       8.220435 
1 1 1 2   19 10 o 264.0253 4.954000 850.1514       31.87408 828.8944       56.12624 860.2704       38.72454 260.2913 8.861433 265.5359 5.984487 -5.244598      10.69295 
1 1 1 2   19 11 o 350.3443 7.533069 1499.160       64.31364 0.000000       0.000000 1499.160       64.31364 ?        ?        350.3443 7.533069 0.000000       7.533069 
1 1 1 2   19 12 o 48.59727 3.233948 28.91802       3.808053 20.89342       7.236299 31.99141       4.478302 40.70399 7.573970 51.09626 3.620004 -10.39228      8.394608 
1 1 1 2   19 13 o 322.3258 4.511736 1267.342       35.43846 1245.412       56.03531 1281.960       45.74966 319.2420 7.202870 324.0590 5.793322 -4.816986      9.243588 
1 1 1 2   19 14 o 185.7634 3.394919 420.7769       15.36830 437.0353       23.13931 407.9446       20.55721 189.1677 5.024026 182.7926 4.618674 6.375046       6.824440 
1 1 1 2   19 15 o 288.0359 4.125944 1012.176       28.96050 1031.845       47.02846 1000.161       36.75675 290.5250 6.642647 286.2055 5.270150 4.319427       8.479342 
1 1 1 2   19 16 o 194.7746 3.156176 462.6465       14.98061 444.7157       23.86914 474.2995       19.24232 190.7569 5.139445 197.1599 4.005002 -6.402969      6.515668 
1 1 1 2   19 17 o 155.0938 2.813899 293.3185       10.63503 308.3970       17.95715 285.1724       13.19880 158.8542 4.643751 152.8894 3.542589 5.964798       5.840750 
1 1 1 2   19 18 o 254.0633 4.151663 788.0165       25.70396 800.6090       51.88151 783.9202       29.59089 255.1964 8.353868 253.3200 4.793496 1.876373       9.631445 
1 1 1 2   19 19 o 117.1318 3.266522 167.5216       9.314768 199.0023       17.28726 154.6427       11.05717 127.4298 5.580502 112.4710 4.040859 14.95885       6.889887 
1 1 1 2   19 20 o 108.7287 2.912432 144.3143       7.709833 149.3340       11.62451 140.3720       10.30166 110.4818 4.326013 107.1470 3.952170 3.334793       5.859525 
1 1 1 2   19 21 o 148.9550 3.160082 270.7519       11.47069 258.3853       16.41196 282.5620       16.03848 145.3135 4.640616 152.0068 4.334188 -6.693329      6.349843 
1 1 1 2   19 22 o 94.08919 2.848550 108.1131       6.523779 120.7260       10.07770 99.01492       8.559207 99.30653 4.173656 89.94497 3.914368 9.361557       5.722035 
1 1 1 2   19 23 f 8.767264 4.210993 -3.864202      2.615991 -7.089081      4.672840 -2.392142      3.157091 11.61788 5.592439 11.08244 5.095949 0.5354404      7.565981 
1 1 1 2   19 24 o 45.44356 5.545219 25.69073       6.013802 25.69073       6.013802 0.000000       0.000000 45.44356 5.545219 ?        ?        0.000000       5.545219 
1 1 1 2   19 25 o 111.4293 2.993365 151.7075       8.120852 143.5083       11.53155 159.7746       11.43825 108.2009 4.382483 114.2171 4.116265 -6.016136      6.012471 
1 1 1 2   19 26 o 154.9883 3.268462 293.4822       12.34465 283.3015       17.32623 303.9785       17.59275 151.9890 4.683545 157.4628 4.589690 -5.473831      6.557503 
1 1 1 2   19 27 o 54.71017 3.439894 36.73406       4.562948 38.76908       6.653296 34.92691       6.269736 56.00686 4.924936 53.14175 4.896490 2.865105       6.944826 
1 1 1 2   19 28 o 63.35031 3.344651 49.20676       5.145104 48.09260       7.292108 50.31129       7.260546 62.41392 4.832020 63.86793 4.697860 -1.454006      6.739310 
1 1 1 2   19 29 o 82.26849 3.106970 82.86915       6.217639 82.47081       8.738767 83.27755       8.848399 81.87095 4.396224 82.26539 4.430130 -0.3944397     6.241220 
1 1 1 2   19 30 o 88.12702 3.861516 95.38310       8.272703 82.77129       15.06944 100.8235       9.897465 81.10328 7.717608 90.48341 4.502831 -9.380127      8.935153 
1 1 1 2   19 31 o 40.48061 4.788115 20.45940       4.631996 16.46333       6.940704 23.66837       6.219705 35.50970 8.188190 43.29339 6.061236 -7.783691      10.18749 
1 1 1 2   19 32 o 74.87168 3.254262 68.85136       5.923357 73.41629       8.296255 64.10453       8.459925 77.06004 4.436663 71.88473 4.857938 5.175316       6.579023 
1 1 1 2   19 33 o 108.1536 3.754784 144.1391       9.881039 140.0648       11.58457 155.0175       18.92936 106.3601 4.479592 110.6254 7.058566 -4.265289      8.360030 
1 1 1 2   19 34 o 86.31067 3.492093 91.92636       7.329744 101.4347       11.93324 86.16574       9.288415 89.86317 5.475282 83.17206 4.600694 6.691109       7.151580 
1 1 1 2   19 35 o 43.09655 4.211695 23.30446       4.366798 21.41817       5.918048 25.55900       6.469962 40.63470 6.170177 44.47134 6.133295 -3.836639      8.699907 
1 1 1 2   19 36 o 15.85815 6.289014 1.991804       3.618312 -1.022468      4.863519 5.728287       5.414907 15.06576 6.676359 21.90742 7.912242 -6.841656      10.35265 
1 1 1 2   19 37 o 43.81676 4.257459 24.41186       4.488732 23.58455       6.108610 25.38290       6.617994 42.15571 6.125469 43.58872 6.422682 -1.433010      8.875371 
1 1 1 2   19 38 f 29.68790 6.742394 12.32553       4.766266 12.72559       5.501278 11.12128       9.544683 29.73162 7.573138 27.46482 10.39609 2.266798       12.86200 
1 1 1 2   19 39 o 21.24261 7.481889 6.314374       4.812105 12.10144       8.869040 3.899980       5.728638 27.19979 10.07727 19.25458 7.816676 7.945211       12.75350 
1 1 1 2   19 40 o 25.40668 6.579801 9.588346       4.105803 11.33800       5.549520 7.472422       6.102798 26.62983 7.948492 22.12617 8.326680 4.503662       11.51139 
1 1 1 2   19 41 o 43.54049 5.117314 26.46860       5.326109 30.98191       8.286735 23.29184       6.952281 43.30018 8.152449 37.84062 7.798775 5.459564       11.28199 
1 1 1 2   19 42 o 15.83697 6.401633 3.120615       3.823446 5.751447       5.587519 0.8040085      5.243227 19.08690 7.730308 15.09964 6.794155 3.987258       10.29166 
1 1 1 2   19 43 o 19.88144 7.149068 7.020665       4.414919 13.94909       9.173899 4.932406       5.036501 23.16937 9.694862 17.59428 7.257023 5.575092       12.11011 
1 1 1 2   19 44 o 16.02824 6.292946 4.169351       3.590251 0.6067847      5.164971 7.500103       4.994103 13.95993 6.454432 19.30929 7.467005 -5.349360      9.869946 
1 1 1 2   19 45 o 11.45467 5.432818 -1.419719      4.074936 -3.977296      5.270551 2.381102       6.425105 11.58059 5.657973 14.96997 7.013677 -3.389382      9.011344 
1 1 1 2   19 46 o 10.87507 5.175870 -1.409548      3.762890 1.790985       5.276720 -4.721153      5.367501 13.76263 6.417803 11.15182 5.500328 2.610809       8.452325 
1 1 1 2   20 0  o 564.7219 11.74836 3899.697       161.6768 3696.265       219.6386 4140.292       238.8601 548.6136 16.44738 580.5326 16.90221 -31.91901      23.58392 
1 1 1 2   20 1  o 631.8388 9.187626 4875.092       141.4639 4777.772       197.1124 4978.458       203.1443 624.8181 12.94566 637.7784 13.07069 -12.96033      18.39655 
1 1 1 2   20 2  o 439.2903 6.572386 2354.041       70.35757 2419.458       101.0824 2292.564       97.99084 445.0911 9.319455 433.2663 9.280994 11.82483       13.15253 
1 1 1 2   20 3  o 291.3920 4.665672 1035.198       33.13049 1032.991       46.59595 1037.456       47.11555 290.9947 6.570934 291.6198 6.629965 -0.6250916     9.334538 
1 1 1 2   20 4  o 440.5211 6.589964 2367.482       70.74339 2305.199       98.26000 2434.508       101.9336 434.4191 9.281792 446.4265 9.369825 -12.00739      13.18883 
1 1 1 2   20 5  o 448.7054 5.982591 2455.865       65.41640 2405.758       101.9482 2490.935       85.29014 443.7440 9.427815 451.7303 7.747891 -7.986267      12.20301 
1 1 1 2   20 6  o 240.9756 4.030413 707.9191       23.66784 688.9136       32.98626 728.0851       33.97856 237.6557 5.695722 244.3183 5.707065 -6.662582      8.062992 
1 1 1 2   20 7  o 586.2388 8.544175 4198.429       122.0621 4127.055       170.7375 4273.042       174.5701 580.4832 12.06989 590.6458 12.12848 -10.16266      17.11088 
1 1 1 2   20 8  o 392.9959 5.929261 1884.437       56.78384 1806.264       78.29987 1971.162       82.47136 384.4966 8.356655 401.6550 8.425853 -17.15842      11.86713 
1 1 1 2   20 9  o 241.0712 4.770566 708.8085       28.02537 839.9183       54.35632 661.3362       32.70790 261.9985 8.524986 232.8051 5.765329 29.19342       10.29147 
1 1 1 2   20 10 o 82.60816 2.973320 83.29173       5.975741 76.85062       12.88491 85.05679       6.745000 79.04388 6.753892 83.46233 3.322953 -4.418457      7.527090 
1 1 1 2   20 11 o 73.29401 3.000989 65.59709       5.348716 57.90737       11.95978 67.51965       5.980085 68.45652 7.280782 74.34509 3.309090 -5.888573      7.997491 
1 1 1 2   20 12 o 54.95265 3.264432 36.94862       4.351820 39.26768       10.06353 36.41520       4.826425 56.17317 7.542052 54.52400 3.653554 1.649170       8.380394 
1 1 1 2   20 13 o 242.4488 3.655066 716.8981       21.59491 725.3226       35.06093 711.7486       27.41150 243.6837 5.904197 241.5052 4.657686 2.178513       7.520211 
1 1 1 2   20 14 o 200.2050 3.241291 488.7945       15.81354 508.3384       26.16826 477.5519       19.84742 203.9579 5.269412 197.8374 4.116797 6.120453       6.686906 
1 1 1 2   20 15 f 91.03071 2.557629 101.1082       5.668014 102.3043       9.867470 100.5193       6.924330 91.44073 4.441514 90.73310 3.136385 0.7076263      5.437275 
1 1 1 2   20 16 o 166.0779 2.931061 336.3707       11.86241 331.5289       19.38079 339.2712       15.00045 164.6813 4.834612 166.7487 3.691524 -2.067429      6.082830 
1 1 1 2   20 17 o 156.1448 3.109805 297.4037       11.83306 307.9772       24.43046 294.1628       13.52549 158.4927 6.338157 155.2639 3.574757 3.228836       7.276752 
1 1 1 2   20 18 o 216.5296 3.386697 572.0958       17.87022 556.5541       28.52032 582.1413       22.92940 213.2473 5.492831 218.3248 4.309764 -5.077408      6.981781 
1 1 1 2   20 19 o 207.8515 3.301941 527.1863       16.72471 531.4730       27.34242 524.6237       21.14086 208.3663 5.389372 207.2514 4.185902 1.114883       6.824009 
1 1 1 2   20 20 f 170.3757 2.955717 354.1579       12.27176 362.4926       20.34168 349.3888       15.38723 172.1079 4.854943 169.1581 3.732773 2.949753       6.124056 
1 1 1 2   20 21 o 209.6364 4.263026 537.1155       21.77814 529.2840       27.40020 550.5497       35.88721 207.8386 5.414540 211.5903 6.969487 -3.751770      8.825587 
1 1 1 2   20 22 o 243.2151 4.134012 723.0327       24.50182 746.7014       35.80814 702.1945       33.59889 246.7462 5.955183 239.3297 5.760925 7.416534       8.285678 
1 1 1 2   20 23 o 127.5841 4.483420 199.3941       13.91768 199.3941       13.91768 0.000000       0.000000 127.5841 4.483420 ?        ?        0.000000       4.483420 
1 1 1 2   20 24 o 126.6585 3.073159 195.8835       9.485393 198.0117       13.83184 193.9942       13.03255 127.1164 4.472184 125.8526 4.255556 1.263741       6.173345 
1 1 1 2   20 25 o 117.3160 3.062998 168.2005       8.749207 178.2790       12.90463 159.6265       11.90253 120.5925 4.398630 114.1187 4.287649 6.473732       6.142628 
1 1 1 2   20 26 o 36.90004 4.423391 16.91390       3.898395 9.564254       5.869484 22.71529       5.214738 27.55649 8.161976 42.72812 5.109375 -15.17163      9.629307 
1 1 1 2   20 27 o 13.11955 5.664783 -0.3608152     3.306604 -2.985493      4.955964 1.744950       4.439102 14.29933 6.502516 17.22733 6.920958 -2.928002      9.496440 
1 1 1 2   20 28 o 57.92960 3.452665 41.20192       4.851949 38.55622       6.879472 43.82043       6.844049 55.77205 5.118810 59.55195 4.755561 -3.779903      6.986958 
1 1 1 2   20 29 o 56.08387 3.541555 38.66497       4.815536 42.98499       6.929340 34.62980       6.696996 58.92661 4.868937 52.76891 5.278720 6.157692       7.181325 
1 1 1 2   20 30 o 74.27039 4.586988 68.11034       8.261429 0.000000       0.000000 68.11034       8.261429 ?        ?        74.27039 4.586988 0.000000       4.586988 
1 1 1 2   20 31 o 58.73988 3.526216 42.47638       5.024281 38.23721       6.856554 47.39216       7.383484 55.39309 5.137979 61.76372 4.946924 -6.370632      7.132383 
1 1 1 2   20 32 o 58.42096 4.271333 42.30957       6.038884 46.40071       7.153686 32.16507       11.26479 61.04843 4.848402 49.10221 9.758150 11.94622       10.89626 
1 1 1 2   20 33 o 114.4172 3.147292 160.9547       8.767016 163.5783       12.43153 158.3589       12.36560 114.8343 4.450818 112.9621 4.501082 1.872276       6.330049 
1 1 1 2   20 34 o 42.48002 4.208291 22.61083       4.299192 29.19261       6.091874 16.08022       6.068148 47.96500 5.300130 34.73960 7.395035 13.22540       9.098237 
1 1 1 2   20 35 o 20.05528 7.095917 4.754143       4.332268 2.578493       5.994061 7.133705       6.268666 19.49192 7.964653 24.03641 8.532668 -4.544483      11.67228 
1 1 1 2   20 36 o 26.61032 6.208771 9.537441       3.952205 10.46308       5.280922 8.358917       5.958795 27.46844 7.621628 24.91700 8.341224 2.551435       11.29890 
1 1 1 2   20 37 o 14.95961 6.143856 1.421180       3.589618 0.2117045      4.851547 2.884221       5.335928 15.70165 6.820400 18.54434 7.538214 -2.842690      10.16575 
1 1 1 2   20 38 o 21.25730 8.505703 5.234271       6.676744 15.70804       9.681538 -4.264774      9.220043 30.57984 10.62360 18.02761 8.431833 12.55223       13.56306 
1 1 1 2   20 39 o 17.42969 6.538421 3.778672       3.756522 12.45228       5.231522 -5.453726      5.397411 28.66379 7.429226 12.75196 6.104649 15.91183       9.615620 
1 1 1 2   20 40 o 20.60942 7.150914 6.479428       4.385914 10.63699       6.884350 3.639178       5.690125 24.63138 8.917983 18.17351 7.621933 6.457878       11.73134 
1 1 1 2   20 41 o 12.84418 5.691443 0.1923986      3.533754 -1.903147      5.069160 2.173474       4.928764 13.47454 6.285735 15.99345 6.910923 -2.518918      9.341912 
1 1 1 2   20 42 o 13.55647 5.904566 1.124222       3.656790 0.4927131      5.484561 1.629635       4.906544 14.90574 6.802284 15.15866 6.712269 -0.2529202     9.556444 
1 1 1 2   20 43 o 17.69863 6.869378 5.390244       4.238398 12.45114       8.772055 3.239831       4.840972 21.71101 9.298324 15.79788 6.837768 5.913127       11.54183 
1 1 1 2   20 44 o 12.16706 5.676940 -0.5511204     4.138102 0.6877004      5.334225 -2.423432      6.557770 13.86938 6.462606 13.37589 6.483896 0.4934826      9.154572 
1 1 1 2   20 45 o 17.74345 6.642044 6.299090       3.872251 2.827167       5.567194 9.552925       5.389508 14.68981 6.759202 19.81268 7.730296 -5.122865      10.26861 
1 1 1 2   21 0  o 207.5666 3.744742 525.2031       18.94155 500.8573       25.73072 554.0037       27.98595 202.5865 5.216350 213.0594 5.394519 -10.47290      7.504075 
1 1 1 2   21 1  o 232.6997 3.996786 660.1396       22.66433 691.1411       32.57275 631.0435       31.55583 238.0376 5.615298 227.3782 5.699505 10.65936       8.000996 
1 1 1 2   21 2  o 360.3433 5.553296 1583.837       48.76445 1586.537       68.99432 1581.141       68.93241 360.4547 7.854646 359.8406 7.860990 0.6140747      11.11263 
1 1 1 2   21 3  o 532.4828 9.039026 3465.057       117.2906 3433.414       142.7837 3530.716       205.6753 529.6542 11.06242 535.6525 15.77379 -5.998291      19.26628 
1 1 1 2   21 4  o 290.3760 5.385201 1028.515       38.10648 946.2943       63.30035 1075.248       47.72257 278.0605 9.355123 296.8170 6.597796 -18.75650      11.44767 
1 1 1 2   21 5  o 517.0242 10.75835 3272.435       135.5478 3421.103       197.1769 3139.227       186.6437 527.1362 15.36600 504.9965 15.18387 22.13977       21.60240 
1 1 1 2   21 6  o 552.5200 7.247770 3728.204       97.58621 3762.184       155.3231 3706.043       125.4341 554.0674 11.50369 550.4559 9.350975 3.611572       14.82483 
1 1 1 2   21 7  o 187.1508 4.075471 427.1024       18.58685 424.9499       22.24907 432.0747       33.81612 186.5820 4.897583 187.9228 7.398742 -1.340790      8.872864 
1 1 1 2   21 8  o 460.6065 6.844165 2591.301       76.82218 2464.501       105.2888 2735.652       112.3395 448.6646 9.629959 472.6732 9.752940 -24.00867      13.70606 
1 1 1 2   21 9  o 206.4155 3.286066 519.4660       16.52931 526.6465       26.07736 514.6436       21.37086 207.7444 5.151080 205.4118 4.269339 2.332596       6.690358 
1 1 1 2   21 10 o 190.0409 3.538267 440.3950       16.38603 470.9855       35.02085 431.8209       18.54075 196.1397 7.339930 188.1592 4.043578 7.980499       8.380042 
1 1 1 2   21 11 o 320.1403 5.782307 1251.711       45.11049 1314.934       82.29716 1224.557       53.93504 327.1269 10.33660 316.4774 6.993462 10.64957       12.48014 
1 1 1 2   21 12 o 139.1014 3.097673 235.9380       10.50034 220.6037       21.77843 240.5823       11.98543 134.1554 6.682694 140.4491 3.501859 -6.293625      7.544628 
1 1 1 2   21 13 o 87.57350 2.882944 93.61387       6.144021 108.2761       14.65959 90.48956       6.767033 93.87659 6.447233 86.07769 3.231793 7.798897       7.211886 
1 1 1 2   21 14 o 176.8473 3.051166 381.4186       13.14923 380.7122       21.57530 381.8361       16.58542 176.4742 5.022056 176.8961 3.847441 -0.4219666     6.326440 
1 1 1 2   21 15 o 334.0391 4.666227 1362.792       37.98388 1385.546       61.26459 1348.583       48.41152 336.1932 7.477983 332.0404 5.983038 4.152832       9.576899 
1 1 1 2   21 16 o 108.2367 2.820829 142.9751       7.433908 141.5494       15.69695 143.3873       8.440470 107.3851 6.022531 108.3676 3.199683 -0.9825363     6.819739 
1 1 1 2   21 17 o 96.33640 2.557317 113.2548       5.998282 112.7404       10.43152 113.5089       7.331585 95.96488 4.472965 96.40791 3.124807 -0.4430237     5.456357 
1 1 1 2   21 18 o 147.1764 2.785345 264.2119       9.989717 261.6152       16.50400 265.7134       12.54982 146.2385 4.637040 147.5485 3.490333 -1.309998      5.803840 
1 1 1 2   21 19 o 156.1700 2.851793 297.5396       10.85305 296.3495       17.94994 298.2254       13.62579 155.6147 4.738956 156.2938 3.577536 -0.6791077     5.937716 
1 1 1 2   21 20 o 276.3047 4.019393 932.7595       27.06356 925.6921       43.32999 937.2801       34.65459 274.6591 6.473789 276.7339 5.138807 -2.074799      8.265427 
1 1 1 2   21 21 f 261.3305 3.871139 834.4318       24.65273 872.4802       40.67051 812.3317       30.99628 266.6266 6.259504 257.6231 4.937291 9.003571       7.972342 
1 1 1 2   21 22 o 258.0433 6.205439 817.6850       39.02125 817.6850       39.02125 0.000000       0.000000 258.0433 6.205439 ?        ?        0.000000       6.205439 
1 1 1 2   21 23 o 126.3886 3.807725 195.4401       11.71424 188.3033       13.92533 212.7149       21.66511 123.9363 4.618822 131.2836 6.795080 -7.347298      8.216242 
1 1 1 2   21 24 o 154.1656 3.271644 290.3499       12.29107 294.1203       17.97359 287.0379       16.84559 154.8632 4.768353 153.0356 4.522039 1.827637       6.571607 
1 1 1 2   21 25 o 158.6066 3.326020 307.4232       12.85530 295.5805       18.28476 318.9986       18.07730 155.1910 4.840812 161.2819 4.604225 -6.090897      6.680745 
1 1 1 2   21 26 o 44.83173 3.843768 24.77555       4.158832 26.48429       6.418224 23.53886       5.460192 46.02861 5.854321 43.46473 5.262087 2.563873       7.871634 
1 1 1 2   21 27 o 112.7793 3.127818 155.6065       8.587906 167.7090       12.72293 145.4774       11.63952 116.8420 4.476682 108.8264 4.398050 8.015633       6.275630 
1 1 1 2   21 28 o 69.46180 3.310201 59.16754       5.587081 56.17155       8.118967 61.86250       7.700298 67.40104 4.978220 70.84427 4.483324 -3.443230      6.699467 
1 1 1 2   21 29 o 53.06575 5.130480 35.01913       6.551857 0.000000       0.000000 35.01913       6.551857 ?        ?        53.06575 5.130480 0.000000       5.130480 
1 1 1 2   21 30 o 29.60513 6.538342 11.32747       4.590923 8.632078       8.371461 12.48673       5.490122 27.61230 9.854319 30.97458 7.379105 -3.362280      12.31092 
1 1 1 2   21 31 o 63.37578 3.449062 49.44968       5.306651 45.50582       7.397408 53.63102       7.616879 60.42069 5.070833 65.70207 4.790226 -5.281384      6.975645 
1 1 1 2   21 32 o 56.69881 3.612355 39.72660       4.965192 41.50525       7.079285 38.00454       6.965775 57.56805 5.098963 55.02018 5.259238 2.547863       7.325231 
1 1 1 2   21 33 o 37.31324 4.433079 17.52411       3.952227 12.98178       5.566456 22.14176       5.612413 31.20669 7.427503 41.61704 5.682295 -10.41035      9.351806 
1 1 1 2   21 34 o 57.22458 3.940172 40.85471       5.461033 44.44606       7.213043 36.03130       8.359242 59.26816 5.041960 52.58748 6.673063 6.680676       8.363680 
1 1 1 2   21 35 o 18.68039 6.609575 4.136747       3.758780 2.306074       5.242371 6.073582       5.392231 18.24690 7.451337 22.20332 7.910440 -3.956413      10.86727 
1 1 1 2   21 36 o 22.33714 6.946233 6.765593       4.180934 6.419255       6.512095 7.008463       5.453277 22.88439 8.603654 22.99197 7.973919 -0.1075802     11.73057 
1 1 1 2   21 37 o 12.94678 6.195881 -6.183430      5.550028 -1.866018      7.435575 -11.61486      8.339884 17.45497 7.948129 14.73148 7.179817 2.723492       10.71086 
1 1 1 2   21 38 o 13.32397 5.826461 0.2843754E-01  3.591365 -4.015513      4.594307 6.381669       5.758568 12.28407 5.809148 21.53632 8.091913 -9.252247      9.961187 
1 1 1 2   21 39 o 15.82270 6.529696 2.270935       4.080366 5.516010       6.249763 -0.1399600     5.386918 20.28462 8.189886 15.36604 6.902597 4.918578       10.71075 
1 1 1 2   21 40 o 17.35469 6.417624 4.233433       3.593959 5.255271       4.944130 3.088503       5.233451 18.97222 7.403533 17.13437 7.254492 1.837851       10.36532 
1 1 1 2   21 41 o 13.34735 5.808479 0.9102653      3.532318 4.533396       5.058990 -2.536394      4.934248 17.83494 7.305760 12.83192 6.053700 5.003024       9.487962 
1 1 1 2   21 42 o 13.01993 5.867489 0.2971791      3.927808 7.028230       8.180417 -1.719550      4.477728 19.33406 8.607985 12.39443 5.822262 6.939622       10.39212 
1 1 1 2   21 43 o 11.76302 5.471904 -0.8488284     3.798818 -0.4396201     5.015463 -1.399498      5.818140 13.27244 6.211363 13.48380 6.422681 -0.2113600     8.934868 
1 1 1 2   21 44 o 10.90960 5.122146 -1.119817      3.457938 2.819215       5.257603 -4.122695      4.590521 14.85129 6.731348 10.84534 5.294766 4.005945       8.564204 
1 1 1 2   21 45 o 16.07750 6.415492 4.997057       3.787926 11.37282       5.900640 0.5278051      4.940269 20.59256 8.072742 12.99302 6.107258 7.599543       10.12264 
1 1 1 2   22 0  o 126.2897 3.607853 194.6049       11.09194 175.8086       18.01134 206.0885       14.07824 119.8568 6.187566 129.9191 4.453299 -10.06221      7.623507 
1 1 1 2   22 1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 2   22 2  o 159.6518 4.635697 311.1433       18.01627 290.8960       24.86481 333.5219       26.14074 154.2110 6.632086 165.1541 6.507941 -10.94305      9.291818 
1 1 1 2   22 3  o 232.7042 4.578560 660.4818       25.96386 650.0891       31.46723 682.6481       45.95577 230.8077 5.594640 236.1945 7.995780 -5.386734      9.758713 
1 1 1 2   22 4  o 124.8253 2.730007 189.9227       8.304288 203.1085       13.06986 180.9957       10.75403 128.9861 4.163525 121.7847 3.627663 7.201424       5.522217 
1 1 1 2   22 5  o 114.4293 3.063187 159.7389       8.534066 187.4834       17.93605 151.6197       9.702757 123.7833 5.963593 111.4556 3.577007 12.32771       6.954093 
1 1 1 2   22 6  o 273.1273 3.983852 909.7705       26.51578 862.8160       40.50367 944.9860       35.07699 265.8086 6.253011 278.2763 5.172613 -12.46774      8.115175 
1 1 1 2   22 7  o 289.9561 4.166847 1025.500       29.44258 1065.112       47.42913 1000.664       37.55467 295.2660 6.591673 286.3212 5.382380 8.944794       8.510004 
1 1 1 2   22 8  o 367.2984 5.612332 1647.235       50.23408 1629.575       70.70152 1665.240       71.38687 364.9393 7.950090 368.9130 7.940691 -3.973694      11.23648 
1 1 1 2   22 9  o 345.2016 4.780414 1454.372       40.21373 1549.633       66.01839 1398.176       50.70635 355.8727 7.612622 338.2820 6.151022 17.59061       9.787087 
1 1 1 2   22 10 o 310.5406 4.932612 1177.310       37.32772 1236.876       77.90452 1159.559       42.52734 317.1590 10.09259 308.0949 5.664318 9.064087       11.57346 
1 1 1 2   22 11 o 259.7720 4.313944 823.5770       27.30882 814.9596       55.51004 826.3286       31.36721 257.5818 8.856594 260.1382 4.948068 -2.556427      10.14508 
1 1 1 2   22 12 o 150.2169 3.189223 275.2149       11.67454 248.2928       23.75277 283.7902       13.40551 142.2621 6.871875 152.5183 3.606828 -10.25618      7.760920 
1 1 1 2   22 13 o 173.2741 3.386681 366.2684       14.30026 359.6091       30.00115 368.2263       16.26713 171.1770 7.208244 173.7063 3.842901 -2.529297      8.168640 
1 1 1 2   22 14 o 186.2391 3.474540 423.2018       15.76901 482.8222       34.47704 407.4304       17.73247 198.3581 7.144202 182.6963 3.982937 15.66185       8.179451 
1 1 1 2   22 15 o 96.27551 2.639967 113.1189       6.187857 120.7605       10.95620 109.5397       7.498246 99.32564 4.538493 94.69897 3.254049 4.626671       5.584510 
1 1 1 2   22 16 o 99.67527 2.620184 121.2480       6.358849 114.5714       10.81530 124.7754       7.861128 96.72546 4.601601 101.0769 3.195529 -4.351479      5.602333 
1 1 1 2   22 17 o 240.5173 3.652357 706.2006       21.40699 695.4583       34.24216 713.0926       27.42752 238.3161 5.896194 241.5435 4.659670 -3.227402      7.515160 
1 1 1 2   22 18 o 187.8673 3.149402 430.7129       14.41834 434.7017       23.70581 428.3710       18.16441 188.4161 5.167863 187.2684 3.980345 1.147736       6.523032 
1 1 1 2   22 19 o 132.5036 2.720545 214.1970       8.784556 231.5520       15.12539 205.3634       10.79105 137.5402 4.518882 129.6502 3.418485 7.889984       5.666245 
1 1 1 2   22 20 o 35.72811 5.001344 15.92591       4.235328 8.922383       5.865818 23.55375       6.121690 26.85185 8.206237 43.42904 5.939845 -16.57719      10.13035 
1 1 1 2   22 21 o 132.4021 4.374716 214.6644       14.09562 228.2601       22.46427 205.8354       18.10282 136.0650 6.796523 129.4113 5.754738 6.653763       8.905602 
1 1 1 2   22 22 o 50.53716 3.628888 31.36978       4.439353 33.32883       6.952234 30.02104       5.768539 51.82590 5.593288 49.27158 4.867872 2.554321       7.414921 
1 1 1 2   22 23 o 223.4098 3.489635 609.9594       18.99846 603.9120       30.63905 613.7370       24.21592 221.6881 5.676154 223.8955 4.438330 -2.207367      7.205379 
1 1 1 2   22 24 o 26.97638 5.552642 9.263083       3.528484 9.307977       6.103332 9.240545       4.324393 27.34225 8.373530 26.85742 6.644255 0.4848309      10.68935 
1 1 1 2   22 25 o 89.92571 3.036600 98.91119       6.644833 111.6193       10.33439 89.95431       8.676068 95.32978 4.460938 85.60294 4.171650 9.726837       6.107588 
1 1 1 2   22 26 f 92.55189 3.129086 104.8280       7.047157 118.0385       10.77628 94.95731       9.315018 97.99080 4.525031 87.89622 4.362513 10.09457       6.285493 
1 1 1 2   22 27 o 139.1674 3.245520 236.9134       11.00672 234.2140       15.91986 239.3853       15.23446 137.9862 4.741472 139.5723 4.484934 -1.586105      6.526575 
1 1 1 2   22 28 o 63.55541 3.789707 49.69036       5.842755 56.59301       10.69820 46.75636       6.974828 67.22119 6.616501 61.48518 4.690480 5.736008       8.110407 
1 1 1 2   22 29 o 42.86787 4.893497 22.94467       5.020501 22.79813       10.01815 22.99382       5.801593 41.42823 10.03137 42.72994 5.714735 -1.301712      11.54498 
1 1 1 2   22 30 o 49.60509 3.935925 30.44781       4.718857 36.32840       7.093896 25.78045       6.319907 53.85233 5.481946 45.17221 5.880674 8.680119       8.039532 
1 1 1 2   22 31 o 49.19128 3.784206 29.96890       4.501431 30.98482       6.869014 29.20423       5.959414 49.49666 5.805036 48.22472 5.150700 1.271942       7.760680 
1 1 1 2   22 32 o 28.67503 5.536419 10.62978       3.728634 7.655150       5.465295 13.21987       5.099825 24.55489 7.978192 31.69979 6.805285 -7.144896      10.48635 
1 1 1 2   22 33 o 24.84088 6.508995 8.177192       3.986870 5.203212       5.152046 12.61651       6.294608 21.33644 7.716212 30.44361 8.271327 -9.107164      11.31171 
1 1 1 2   22 34 o 38.83030 4.526000 19.16314       4.202538 16.61804       6.055436 21.52805       5.837145 35.00401 7.334065 40.54969 6.095568 -5.545681      9.536480 
1 1 1 2   22 35 o 16.19928 6.255633 2.511378       3.501579 6.908108       5.217007 -1.093071      4.723631 22.88881 7.804413 14.65865 6.532817 8.230162       10.17775 
1 1 1 2   22 36 f 25.17281 7.039489 8.925679       4.485986 8.250609       8.660569 9.173216       5.244352 25.10987 9.798660 25.34062 7.762222 -0.2307510     12.50063 
1 1 1 2   22 37 o 22.31831 8.037709 7.007486       5.583196 9.610812       7.109482 2.818537       9.018332 25.18843 9.070220 21.02196 9.211784 4.166475       12.92772 
1 1 1 2   22 38 o 20.45410 6.604242 6.057835       3.748479 6.507257       5.247198 5.589442       5.356800 21.15805 7.766484 20.22368 7.756104 0.9343662      10.97613 
1 1 1 2   22 39 o 29.01731 5.825980 12.21778       3.976404 7.988792       5.257013 17.87286       6.079112 22.18093 7.819456 33.42221 7.632087 -11.24128      10.92669 
1 1 1 2   22 40 o 18.53420 6.520788 5.235903       3.654483 7.674767       5.221274 2.893710       5.116750 21.27577 7.757189 16.67654 7.120812 4.599230       10.52995 
1 1 1 2   22 41 o 14.54642 5.996099 2.378818       3.435453 3.242644       4.925486 1.560460       4.794106 16.37800 6.989701 14.98642 6.635510 1.391579       9.637734 
1 1 1 2   22 42 o 18.15638 7.378119 5.970729       5.109744 2.789020       8.324073 7.894570       6.472769 16.87102 7.929286 19.50680 8.151544 -2.635788      11.37195 
1 1 1 2   22 43 o 14.22264 5.948702 2.781028       3.451723 3.387278       5.024624 2.239259       4.749900 15.38651 6.803850 14.46307 6.490534 0.9234476      9.403159 
1 1 1 2   22 44 o 10.53149 5.097007 -2.977915      4.011600 0.9824050      5.261697 -8.475699      6.199470 13.59587 6.362490 11.03142 5.517591 2.564449       8.421703 
1 1 1 2   23 0  o 60.79738 3.406069 45.21022       5.026140 52.92039       6.846575 36.19850       7.401935 65.72705 4.298158 54.15630 5.693740 11.57075       7.133921 
1 1 1 2   23 1  o 349.9760 6.279944 1495.975       53.55871 1406.772       88.61486 1547.315       67.22722 338.4306 10.75853 355.7069 7.755623 -17.27631      13.26256 
1 1 1 2   23 2  o 253.2717 4.246670 782.4669       26.21026 784.7469       36.81533 780.1234       37.32370 253.5029 5.959498 252.7455 6.059894 0.7573547      8.499290 
1 1 1 2   23 3  o 199.5670 5.169302 486.4251       25.11834 463.4033       34.74534 511.6291       36.35468 194.5461 7.342062 204.4365 7.309122 -9.890442      10.35998 
1 1 1 2   23 4  o 119.3942 3.641037 174.0042       10.58125 184.2708       18.06248 168.6400       13.05608 122.6785 6.060650 117.4757 4.569384 5.202827       7.590175 
1 1 1 2   23 5  f 287.9033 4.668344 1011.494       32.75259 1111.539       69.59895 983.0362       37.11966 300.9372 9.502445 283.7546 5.368153 17.18262       10.91391 
1 1 1 2   23 6  o 212.1794 4.437833 549.3494       22.94618 571.1178       40.57299 539.1125       27.82326 215.8858 7.724623 210.0460 5.440305 5.839844       9.448107 
1 1 1 2   23 7  o 307.2856 4.368935 1152.257       32.71553 1127.021       50.84375 1170.088       42.73822 303.5628 6.873105 309.4940 5.666672 -5.931274      8.907904 
1 1 1 2   23 8  o 150.2823 2.854889 275.3745       10.45522 292.9256       16.71341 264.0908       13.40108 154.8584 4.433446 147.0870 3.741815 7.771378       5.801433 
1 1 1 2   23 9  o 138.5517 2.765141 234.0639       9.336097 241.9628       14.67945 228.6986       12.09824 140.7362 4.285229 136.8719 3.630407 3.864304       5.616319 
1 1 1 2   23 10 o 460.6568 6.900000 2597.741       77.45735 2792.563       163.6195 2541.470       87.93497 473.8591 14.18532 455.3004 7.925515 18.55865       16.24922 
1 1 1 2   23 11 o 171.4031 3.394396 358.4040       14.17808 323.4246       28.13605 370.3092       16.41446 162.3335 7.129836 174.1951 3.866826 -11.86163      8.110912 
1 1 1 2   23 12 o 150.6235 3.665993 276.8541       13.45614 0.000000       0.000000 276.8541       13.45614 ?        ?        150.6235 3.665993 0.000000       3.665993 
1 1 1 2   23 13 o 74.65325 3.377371 68.13694       6.128262 0.000000       0.000000 68.13694       6.128262 ?        ?        74.65325 3.377371 0.000000       3.377371 
1 1 1 2   23 14 o 38.08323 4.051397 17.90757       3.702245 12.63928       9.083957 18.95696       4.054238 32.27707 10.26685 39.16147 4.319992 -6.884399      11.13870 
1 1 1 2   23 15 o 132.3615 2.774492 213.6918       8.949139 208.2297       14.91771 216.7627       11.18538 130.4464 4.700503 133.2265 3.448173 -2.780090      5.829634 
1 1 1 2   23 16 o 61.60202 2.830584 46.39043       4.237843 42.96601       7.857968 47.79492       5.032407 58.99282 5.530555 62.49188 3.316454 -3.499062      6.448713 
1 1 1 2   23 17 o 27.03704 4.582779 9.182694       2.911697 13.59328       6.086229 7.873614       3.315763 32.59667 7.771899 24.86925 5.605734 7.727421       9.582623 
1 1 1 2   23 18 o 151.3766 3.332517 279.7474       12.29326 261.5028       17.13640 299.0919       17.64537 146.1242 4.818986 156.3131 4.637454 -10.18889      6.687945 
1 1 1 2   23 19 o 282.7560 5.345108 979.4711       36.83023 1004.649       46.32285 936.2029       60.72498 285.9435 6.647814 274.8969 9.077316 11.04666       11.25127 
1 1 1 2   23 20 o 103.4318 3.130813 130.7345       7.882193 129.7192       11.47703 131.6408       10.84409 102.8556 4.590514 103.6555 4.302389 -0.7999496     6.291531 
1 1 1 2   23 21 o 117.2988 2.655004 167.9122       7.589179 184.7854       13.40247 159.9485       9.207576 122.7900 4.486589 114.3860 3.306681 8.404030       5.573475 
1 1 1 2   23 22 o 149.6726 3.191058 273.6351       11.63893 282.3955       26.11026 271.4628       13.00218 151.1461 7.108808 149.0293 3.580208 2.116714       7.959462 
1 1 1 2   23 23 o 30.16394 4.069198 11.33371       2.914892 8.424240       6.084294 12.20043       3.320797 26.30228 8.406441 31.24649 4.489973 -4.944212      9.530377 
1 1 1 2   23 24 o 131.1821 2.764082 210.1508       8.836123 199.7882       14.67883 216.0397       11.06558 127.5453 4.730906 132.8848 3.419981 -5.339546      5.837614 
1 1 1 2   23 25 o 13.46312 5.426122 0.9991658      2.738062 0.2581031      5.570912 1.235198       3.144011 17.61791 7.473079 14.52214 5.827854 3.095773       9.476855 
1 1 1 2   23 26 o 135.4476 3.223388 224.3954       10.63947 222.5488       15.61046 225.9973       14.53952 134.5009 4.770267 135.6355 4.404707 -1.134567      6.492834 
1 1 1 2   23 27 o 93.58182 3.525252 107.4123       8.024918 111.6808       14.75714 105.6201       9.562405 94.71262 6.431946 92.65925 4.246178 2.053368       7.707137 
1 1 1 2   23 28 o 68.68057 3.927980 58.09856       6.546729 43.28212       12.44512 63.76737       7.697915 57.79984 9.139105 71.86439 4.416992 -14.06455      10.15052 
1 1 1 2   23 29 o 48.26547 4.604894 28.98901       5.350597 23.10205       10.11298 31.27757       6.305424 41.53470 10.09218 49.99942 5.253415 -8.464718      11.37763 
1 1 1 2   23 30 o 32.73854 5.124016 13.60549       3.953985 15.91880       6.096300 11.92576       5.194819 34.85504 7.406016 30.15347 7.174263 4.701574       10.31112 
1 1 1 2   23 31 o 30.84642 5.334773 12.20336       3.865055 7.194205       5.905073 15.95777       5.112269 24.27424 8.302514 35.11819 6.200361 -10.84395      10.36225 
1 1 1 2   23 32 o 78.92542 3.549119 77.12158       6.808650 88.89299       9.438183 64.34829       9.831634 84.29612 4.612141 71.17345 5.716583 13.12267       7.345146 
1 1 1 2   23 33 o 44.91195 4.184964 25.38445       4.527539 27.28260       6.719345 23.80603       6.127341 45.75628 6.184336 42.75660 6.049522 2.999676       8.651169 
1 1 1 2   23 34 o 42.13351 4.328677 22.55799       4.381314 28.36242       6.727168 18.28223       5.773761 46.42606 6.093051 36.85953 6.673588 9.566536       9.036706 
1 1 1 2   23 35 o 28.55084 5.795859 10.99313       3.894588 6.297736       5.680215 15.15870       5.350150 22.16955 8.089724 33.09023 6.860248 -10.92068      10.60691 
1 1 1 2   23 36 o 55.63919 3.785842 39.42203       5.102520 45.20015       7.384245 34.14191       7.058855 58.47765 5.237185 50.27584 5.871993 8.201817       7.868190 
1 1 1 2   23 37 o 28.46396 6.752872 11.84019       4.612980 11.56065       5.513155 12.49277       8.423577 27.35785 7.856524 27.10800 9.857513 0.2498493      12.60538 
1 1 1 2   23 38 o 26.66916 6.842930 10.85538       4.468863 7.909009       7.311779 12.61228       5.646165 22.31822 8.910815 27.81141 7.939267 -5.493195      11.93460 
1 1 1 2   23 39 o 15.41120 6.166049 2.737400       3.508536 4.143396       4.962800 1.332515       4.960838 17.82214 7.260462 15.48637 6.807678 2.335767       9.952827 
1 1 1 2   23 40 o 17.69580 6.504134 4.789030       3.682026 4.131161       5.397618 5.361603       5.035559 17.53756 7.393344 18.51982 7.394657 -0.9822636     10.45670 
1 1 1 2   23 41 o 13.63971 5.853008 1.647086       3.488362 -1.612649      5.305902 4.128745       4.629553 13.31438 6.280165 16.67973 6.925862 -3.365343      9.349226 
1 1 1 2   23 42 o 9.776936 4.774191 -4.434085      3.738026 5.584157       7.565510 -7.669638      4.299487 17.44776 7.972572 9.427740 4.696580 8.020023       9.253095 
1 1 1 2   23 43 f 10.26703 4.897030 -2.091923      3.405883 0.8674815      5.279677 -4.201250      4.457355 13.75272 6.415312 10.66481 5.208966 3.087902       8.263749 
1 1 1 2   24 0  o 290.6395 4.704762 1031.024       33.32180 999.5751       45.92240 1065.995       48.42544 285.9341 6.590563 295.2598 6.730280 -9.325684      9.419777 
1 1 1 2   24 1  o 84.08626 3.111709 86.33404       6.365176 84.12367       8.485488 89.17809       9.625301 82.92661 4.212812 85.35257 4.645170 -2.425964      6.270996 
1 1 1 2   24 2  o 183.1161 3.512609 408.9707       15.67445 432.2541       22.40086 386.6346       21.94037 188.1053 4.890983 177.8779 5.066738 10.22737       7.042268 
1 1 1 2   24 3  o 216.4611 3.849123 571.6095       20.30382 600.4844       29.15068 544.4025       28.29626 221.7298 5.394963 211.0400 5.506801 10.68977       7.709117 
1 1 1 2   24 4  o 89.30472 3.410022 97.41338       7.407455 95.18655       8.895439 102.4503       13.37842 88.22404 4.149185 91.35583 6.043388 -3.131798      7.330639 
1 1 1 2   24 5  o 206.1619 3.731411 518.5172       18.74639 525.4818       26.40611 511.4403       26.61795 207.3522 5.230058 204.5473 5.344622 2.804825       7.477867 
1 1 1 2   24 6  o 257.3926 6.155609 810.0932       38.61030 0.000000       0.000000 810.0932       38.61030 ?        ?        257.3926 6.155609 0.000000       6.155609 
1 1 1 2   24 7  o 206.3431 3.741685 519.4971       18.81452 501.8440       25.85347 539.3721       27.43216 202.6058 5.240776 210.0331 5.364038 -7.427231      7.499242 
1 1 1 2   24 8  o 331.8677 6.070095 1347.057       49.09039 1260.766       81.87977 1395.481       61.33669 319.6813 10.52485 337.4538 7.458815 -17.77255      12.89986 
1 1 1 2   24 9  o 288.7520 4.695860 1018.349       33.04276 907.9565       62.77468 1060.657       38.86216 271.4874 9.503180 294.5732 5.413743 -23.08578      10.93705 
1 1 1 2   24 10 o 58.48328 3.913927 41.93341       5.545916 0.000000       0.000000 41.93341       5.545916 ?        ?        58.48328 3.913927 0.000000       3.913927 
1 1 1 2   24 11 o 262.6128 5.026219 842.8602       32.16573 0.000000       0.000000 842.8602       32.16573 ?        ?        262.6128 5.026219 0.000000       5.026219 
1 1 1 2   24 12 o 121.2914 3.063262 179.5812       9.046959 160.8689       18.55965 185.4132       10.36130 114.3861 6.687426 123.2162 3.454133 -8.830139      7.526798 
1 1 1 2   24 13 o 88.10598 2.979011 94.80486       6.386877 98.57612       14.34652 93.87267       7.132685 89.44059 6.629403 87.64444 3.345729 1.796150       7.425826 
1 1 1 2   24 14 o 138.2624 3.154294 233.2617       10.62778 214.6306       22.06042 238.8927       12.12795 132.0926 6.876971 139.8485 3.561617 -7.755829      7.744536 
1 1 1 2   24 15 o 224.0969 4.647082 613.9681       25.37770 604.8527       44.47131 618.3699       30.90352 221.4746 8.254306 224.6478 5.649558 -3.173203      10.00255 
1 1 1 2   24 16 o 83.22932 3.664146 84.75619       7.413436 69.44483       12.84936 92.39594       9.076420 74.84588 7.131024 86.84058 4.302393 -11.99470      8.328391 
1 1 1 2   24 17 o 188.3765 3.671054 433.4344       16.85208 413.6992       23.48427 454.3848       24.19658 183.7293 5.250592 192.5775 5.160643 -8.848251      7.362130 
1 1 1 2   24 18 o 225.7603 4.612318 623.5931       25.37482 650.8585       32.38533 580.2381       40.83779 230.3019 5.775071 216.8248 7.741314 13.47714       9.658126 
1 1 1 2   24 19 o 71.28104 2.784880 62.10434       4.828143 49.22768       8.578818 68.07365       5.841006 63.10545 5.637913 74.59520 3.220811 -11.48975      6.493049 
1 1 1 2   24 20 o 168.4634 3.027338 346.5181       12.42804 357.9179       20.94464 340.3231       15.43998 170.8238 5.036896 166.8508 3.797366 3.973038       6.307956 
1 1 1 2   24 21 o 93.12046 2.648091 105.9243       6.003063 110.2924       10.85101 103.9977       7.206290 94.76704 4.713481 92.21391 3.211758 2.553131       5.703708 
1 1 1 2   24 22 o 72.78482 2.737486 64.76993       4.846789 59.52030       8.624912 67.19285       5.859486 69.46113 5.131617 74.08423 3.253555 -4.623100      6.076110 
1 1 1 2   24 23 o 156.1372 2.941293 297.8046       11.19131 303.9241       18.86830 294.4834       13.90037 157.2945 4.928551 155.1525 3.676473 2.141983       6.148745 
1 1 1 2   24 24 o 53.31917 3.011160 34.85336       3.896590 40.96502       7.793461 32.81634       4.499340 57.41358 5.643156 51.66295 3.596279 5.750629       6.691669 
1 1 1 2   24 25 o 155.2611 3.374519 294.9503       12.76764 303.6195       19.03246 287.8568       17.21619 157.0643 4.978866 153.0352 4.621764 4.029114       6.793365 
1 1 1 2   24 26 o 120.6898 3.551897 178.5695       10.43504 172.4797       18.74951 181.3023       12.56002 117.7476 6.560277 121.4511 4.250332 -3.703476      7.816813 
1 1 1 2   24 27 o 79.95530 5.377188 79.33936       10.41612 80.35999       14.02225 78.08285       15.55847 79.87215 7.284281 78.35625 8.272860 1.515907       11.02275 
1 1 1 2   24 28 o 27.98644 6.532537 10.15710       4.373675 -4.199866      9.143070 14.41721       4.980476 19.70302 8.908847 33.49329 6.334040 -13.79027      10.93104 
1 1 1 2   24 29 o 68.18559 3.302405 57.21527       5.470986 63.41348       8.792232 53.29894       6.988847 71.32066 5.092307 65.55084 4.400628 5.769814       6.730313 
1 1 1 2   24 30 o 76.59690 3.267484 72.28230       6.085019 80.94166       9.373117 65.97407       8.000093 80.56383 4.795985 72.79929 4.532012 7.764542       6.598531 
1 1 1 2   24 31 o 71.08443 3.629292 62.60267       6.266033 64.15891       8.735127 60.95299       8.993539 71.41913 5.051613 69.46985 5.353763 1.949280       7.360813 
1 1 1 2   24 32 o 44.23571 4.149794 24.59430       4.421144 28.72148       6.784726 21.54846       5.828528 47.07309 6.054624 40.67928 6.064675 6.393814       8.569641 
1 1 1 2   24 33 o 32.18790 5.250298 13.50038       3.976422 13.62958       5.999030 13.39914       5.310695 31.27131 7.877374 31.30581 7.122331 -0.3450394E-01 10.61982 
1 1 1 2   24 34 o 14.39201 6.045776 0.8468111      3.589104 4.337651       5.522918 -1.705141      4.722152 20.14474 7.835175 14.16185 6.402993 5.982889       10.11871 
1 1 1 2   24 35 o 33.81087 5.041776 15.12999       4.027295 18.90084       6.108381 12.23050       5.356341 36.55454 7.113292 29.02326 7.514771 7.531282       10.34750 
1 1 1 2   24 36 o 30.21691 6.878128 13.26477       4.950623 11.68228       5.831602 17.34784       9.367222 27.49460 8.133541 31.37648 10.45728 -3.881880      13.24799 
1 1 1 2   24 37 o 27.11108 7.107124 11.24367       4.751836 8.517189       5.594510 18.30487       9.003269 23.16602 8.074024 31.14731 10.24740 -7.981289      13.04603 
1 1 1 2   24 38 o 14.68654 6.089577 1.948904       3.571896 5.211368       5.377168 -0.6275553     4.778508 19.14076 7.641774 14.03340 6.382936 5.107354       9.956836 
1 1 1 2   24 39 o 15.14565 6.385982 2.220985       4.027959 1.357949       7.313209 2.596799       4.825919 17.04701 7.807919 16.12345 6.900829 0.9235668      10.42041 
1 1 1 2   24 40 o 14.31240 5.911575 2.308627       3.348334 0.7291670      5.283352 3.368822       4.328605 14.73032 6.704488 16.04134 6.681850 -1.311012      9.465584 
1 1 1 2   24 41 o 12.85509 5.692688 0.9456705      3.529836 -0.3541624     5.235838 2.028679       4.779235 13.63881 6.370897 14.74134 6.570317 -1.102533      9.151906 
1 1 1 2   24 42 o 30.29020 6.631689 16.22454       4.759090 16.77984       9.331541 16.02933       5.532705 22.20125 9.550568 27.97644 7.815627 -5.775192      12.34088 
1 1 1 2   24 43 o 9.092482 4.471967 -4.576335      3.465405 -1.673267      5.339818 -6.688656      4.554889 12.43087 5.982374 9.827564 4.885585 2.603302       7.723842 
1 1 1 2   25 0  o 102.6187 3.043247 128.5379       7.601857 123.8343       10.29687 134.1729       11.27024 100.6390 4.207869 104.7444 4.425333 -4.105453      6.106532 
1 1 1 2   25 1  o 124.4806 3.091114 188.9802       9.376761 185.5845       12.82883 192.8751       13.73944 123.2305 4.278504 125.6114 4.495778 -2.380852      6.206256 
1 1 1 2   25 2  o 118.4751 3.059397 171.2982       8.825421 177.6185       12.39035 164.7895       12.57373 120.5567 4.224037 116.0960 4.452631 4.460724       6.137460 
1 1 1 2   25 3  o 83.50980 3.094065 85.17182       6.285667 91.93690       8.560291 77.25669       9.259361 86.69724 4.063095 79.39043 4.808592 7.306808       6.295339 
1 1 1 2   25 4  o 175.4171 3.087099 375.3014       13.19650 397.3860       21.09503 361.1018       16.91500 180.3142 4.805088 172.0064 4.035445 8.307800       6.274846 
1 1 1 2   25 5  o 10.94724 5.029724 -2.308555      3.067001 0.5882362      4.430548 -4.973911      4.249878 16.16931 6.749531 11.83356 5.593419 4.335751       8.765985 
1 1 1 2   25 6  o 61.11163 3.027485 45.66188       4.494566 55.26572       6.876227 38.49798       5.938853 67.15005 4.223506 55.98020 4.388491 11.16985       6.090719 
1 1 1 2   25 7  o 103.6381 2.702624 131.0694       6.819784 126.6087       10.31446 134.5341       9.090360 101.7507 4.168635 104.9424 3.559778 -3.191757      5.481746 
1 1 1 2   25 8  o 175.7849 3.415073 377.0226       14.62910 362.2450       27.29240 382.9800       17.32877 171.8699 6.528238 177.1217 4.014761 -5.251831      7.663955 
1 1 1 2   25 9  o 194.0253 4.139720 459.6635       19.57336 452.8755       32.16217 463.6566       24.66743 192.1094 6.881175 194.6782 5.204275 -2.568802      8.627574 
1 1 1 2   25 10 o 88.06352 3.723997 94.83019       7.973702 95.63209       14.21840 94.46230       9.630654 88.09193 6.672995 87.81870 4.515369 0.2732391      8.057135 
1 1 1 2   25 11 o 20.73483 6.966565 4.934154       4.156223 12.52008       8.096413 2.219842       4.843041 31.75643 9.628256 18.37454 7.279452 13.38190       12.07037 
1 1 1 2   25 12 o 83.33180 3.765905 84.95780       7.627681 68.96307       13.04178 93.27366       9.403766 74.60178 7.265792 87.25690 4.437047 -12.65512      8.513468 
1 1 1 2   25 13 o 71.13972 3.868591 61.98811       6.681344 53.55067       11.47792 66.31234       8.216981 65.63034 7.300043 73.50851 4.610321 -7.878166      8.633985 
1 1 1 2   25 14 o 111.7573 3.646633 152.6741       9.917953 173.5099       18.63103 144.4348       11.71596 118.7533 6.462416 108.6108 4.435917 10.14243       7.838378 
1 1 1 2   25 15 f 37.07087 4.377964 17.03234       3.878739 29.98436       9.346745 14.33784       4.263150 48.68482 8.167223 33.81131 5.352058 14.87351       9.764633 
1 1 1 2   25 16 o 268.0775 5.084393 879.9060       33.21510 947.1597       62.35863 853.2678       39.24567 276.4340 9.270087 263.7057 6.107115 12.72833       11.10096 
1 1 1 2   25 17 o 170.5489 3.084668 355.0896       12.82016 332.9415       20.66428 368.9487       16.34632 164.7826 5.152369 173.7509 3.860619 -8.968353      6.438267 
1 1 1 2   25 18 o 109.0790 2.739989 145.3008       7.277498 150.7428       12.95015 142.7890       8.798145 110.8482 4.805552 108.0715 3.344775 2.776657       5.854985 
1 1 1 2   25 19 o 187.8890 3.214358 431.1754       14.71742 432.0803       24.30596 430.6516       18.49293 187.6199 5.321531 187.6433 4.044237 -0.2340698E-01 6.683902 
1 1 1 2   25 20 o 141.7101 2.870195 245.1898       9.911703 229.9944       16.30253 254.1005       12.48407 136.8943 4.894779 144.1831 3.553085 -7.288849      6.048411 
1 1 1 2   25 21 o 66.91548 2.836791 54.77591       4.615340 52.94568       8.680877 55.49713       5.449345 65.42460 5.495605 67.30483 3.332843 -1.880234      6.427248 
1 1 1 2   25 22 o 91.45750 2.714216 102.2321       6.042532 90.47527       10.62824 107.8473       7.345128 85.68544 5.113260 93.88026 3.215366 -8.194824      6.040199 
1 1 1 2   25 23 o 66.78944 2.831198 54.59661       4.597566 64.45027       8.881887 50.99000       5.373485 72.24262 5.077505 64.47225 3.432536 7.770370       6.128896 
1 1 1 2   25 24 f 57.75452 3.841252 41.04102       5.375508 24.59041       10.91468 46.30907       6.176537 43.23019 10.47243 61.31600 4.158263 -18.08581      11.26778 
1 1 1 2   25 25 o 161.6027 3.434829 319.7957       13.52663 298.1375       19.45581 340.0598       18.81917 155.4724 5.142306 166.2364 4.650131 -10.76402      6.933039 
1 1 1 2   25 26 o 119.7669 3.765168 176.1639       10.97533 146.5338       19.20851 190.5263       13.37334 108.0126 7.341281 124.3750 4.419384 -16.36239      8.568860 
1 1 1 2   25 27 o 76.50105 3.644597 72.01653       6.774890 74.78280       13.57281 71.09861       7.818552 76.83604 7.337868 75.87792 4.245316 0.9581223      8.477441 
1 1 1 2   25 28 o 77.27744 2.801205 73.25740       5.266409 66.69028       9.374245 76.28592       6.365964 73.08660 5.299348 78.75320 3.324589 -5.666595      6.255876 
1 1 1 2   25 29 o 74.23958 3.549785 68.03517       6.403442 64.94592       9.021584 71.17179       9.090479 72.00718 5.175804 75.47365 4.970262 -3.466469      7.175824 
1 1 1 2   25 30 o 49.33810 3.768626 30.27407       4.496789 27.00137       6.886612 32.70670       5.937303 45.72749 6.351271 50.96850 4.838199 -5.241009      7.984160 
1 1 1 2   25 31 o 24.44101 6.252555 7.934088       3.738694 7.985061       5.940458 7.900656       4.811006 24.84611 8.328535 24.40781 7.426448 0.4383011      11.15870 
1 1 1 2   25 32 o 13.95827 5.881161 0.5875511      3.412410 -2.678751      5.458588 2.682931       4.372034 14.87489 6.787419 17.56033 6.929111 -2.685445      9.699569 
1 1 1 2   25 33 o 18.10802 6.432784 3.954773       3.563472 -1.491652      5.554134 7.765254       4.645693 15.58585 7.004502 23.75743 7.311029 -8.171583      10.12493 
1 1 1 2   25 34 o 15.13782 6.073480 1.886037       3.413760 2.405512       5.216545 1.496937       4.514721 17.83202 7.373292 16.20347 6.792031 1.628553       10.02483 
1 1 1 2   25 35 o 9.946418 4.786385 -4.456822      3.416745 -3.765747      5.193829 -4.984064      4.536597 13.37833 6.280055 11.73873 5.613412 1.639593       8.423152 
1 1 1 2   25 36 o 17.65460 7.060267 3.540194       4.597724 3.936576       5.459721 2.573683       8.525442 18.64639 7.608113 19.76575 8.794678 -1.119352      11.62883 
1 1 1 2   25 37 o 13.57998 5.868789 0.7833911      3.555269 -3.715539      5.117100 4.981776       4.943225 12.83414 6.087359 18.89133 7.393859 -6.057193      9.577322 
1 1 1 2   25 38 o 19.13631 6.564417 5.653980       3.692122 -1.204368      5.445500 11.48927       5.022957 14.28054 6.611341 26.16210 7.494696 -11.88156      9.994014 
1 1 1 2   25 39 o 11.62720 5.325182 -0.8354617     3.401052 1.873570       5.175458 -2.894561      4.512117 15.54564 6.888174 11.98467 5.693622 3.560973       8.936681 
1 1 1 2   25 40 o 9.924910 4.834182 -4.519227      3.764355 3.870040       7.384367 -7.464802      4.375587 17.21926 7.871341 9.739470 4.832697 7.479788       9.236502 
1 1 1 2   25 41 o 8.776330 4.333518 -5.362064      3.364107 -7.017799      5.605037 -4.429773      4.205897 11.17492 5.531648 10.41525 5.081142 0.7596741      7.511134 
1 1 1 2   25 42 o 12.31602 5.721471 -0.3603644E-01 4.131678 -1.522945      8.332414 0.4487506      4.757779 14.35163 7.033298 13.12641 6.112057 1.225222       9.317967 
1 1 1 2   26 0  o 79.09914 3.541018 76.49448       6.808219 76.92739       8.044191 75.40136       12.78242 79.27032 4.179002 78.17473 6.776689 1.095589       7.961631 
1 1 1 2   26 1  o 144.1717 4.555634 254.1086       15.98525 267.4698       22.52783 240.5591       22.68611 147.6997 6.273269 140.0003 6.668762 7.699326       9.155670 
1 1 1 2   26 2  o 76.16399 3.159822 70.88379       5.851998 70.52625       7.918984 71.31396       8.686049 75.87884 4.300253 76.26414 4.696535 -0.3853073     6.367858 
1 1 1 2   26 3  o 48.72421 3.506708 29.11720       4.135861 25.55907       5.858214 32.65302       5.839811 45.40709 5.399907 51.48838 4.706275 -6.081295      7.162962 
1 1 1 2   26 4  o 331.8850 4.680259 1345.582       37.85241 1409.237       61.26974 1306.290       48.13773 338.9800 7.417130 326.7199 6.046081 12.26013       9.569164 
1 1 1 2   26 5  o 411.6103 5.602371 2072.220       56.19455 1994.186       86.28883 2129.689       74.04995 402.6648 8.793764 416.7284 7.291815 -14.06357      11.42370 
1 1 1 2   26 6  o 186.0780 3.562714 422.5575       16.15519 481.4825       33.20850 404.2887       18.49070 198.0812 6.890197 181.9578 4.170101 16.12347       8.053853 
1 1 1 2   26 7  o 75.14376 4.069440 69.14837       7.424038 68.46977       9.946325 70.00204       11.15581 74.61620 5.508925 75.36972 6.126701 -0.7535248     8.239219 
1 1 1 2   26 8  o 171.1368 3.055667 357.3056       12.74341 353.5261       19.71737 360.0168       16.69995 170.0103 4.763938 171.7086 3.991049 -1.698364      6.214787 
1 1 1 2   26 9  o 98.10574 2.932424 117.5195       7.002763 100.8554       11.89890 126.3496       8.661626 90.63284 5.412124 101.6837 3.500741 -11.05090      6.445641 
1 1 1 2   26 10 o 182.2138 3.557114 405.3106       15.79484 403.2215       32.21900 405.9715       18.12185 181.0489 7.317719 182.3082 4.079060 -1.259277      8.377812 
1 1 1 2   26 11 o 195.6451 3.681105 467.3734       17.55025 416.7310       34.10730 485.6108       20.46784 183.9486 7.625310 199.3603 4.213057 -15.41167      8.711785 
1 1 1 2   26 12 o 39.50713 4.283829 19.29679       4.058316 12.96538       8.314614 21.27689       4.649815 32.24549 9.753044 41.45240 4.685109 -9.206905      10.81999 
1 1 1 2   26 13 o 32.83092 4.886656 13.47306       3.790605 25.66647       9.769091 11.31183       4.112842 44.76269 9.261380 29.87062 5.859593 14.89207       10.95938 
1 1 1 2   26 14 o 45.08607 4.216912 25.06439       4.579362 19.01257       9.011834 27.17104       5.316997 38.43209 9.640199 46.89249 4.716947 -8.460407      10.73234 
1 1 1 2   26 15 o 88.23254 3.404141 95.21289       7.305617 107.7548       15.13023 91.39986       8.342568 93.39602 6.692203 86.38545 3.973634 7.010567       7.783017 
1 1 1 2   26 16 o 46.13338 3.754322 26.17917       4.184230 36.41039       10.60997 24.29490       4.553260 53.65856 8.388554 44.36687 4.263846 9.291695       9.410006 
1 1 1 2   26 17 o 194.6905 3.648712 463.2245       17.31094 506.2033       37.96980 451.9469       19.44996 202.3378 7.714741 192.2215 4.152223 10.11632       8.761174 
1 1 1 2   26 18 f 142.1958 2.923725 246.8701       10.13117 271.2082       17.83741 235.2798       12.30934 148.6804 4.929954 138.6918 3.645227 9.988617       6.131241 
1 1 1 2   26 19 o 65.06824 2.975328 51.81295       4.705320 45.81544       8.669669 54.31723       5.602206 60.76363 5.930334 66.57494 3.465050 -5.811317      6.868437 
1 1 1 2   26 20 o 135.5020 2.852676 224.2280       9.419642 256.9795       16.99208 209.6979       11.31787 144.6749 4.826425 130.9086 3.551092 13.76636       5.992047 
1 1 1 2   26 21 o 177.4236 3.153888 384.7349       13.63621 386.0192       22.70506 384.0103       17.05455 177.1591 5.265083 177.1019 3.951673 0.5720520E-01  6.583071 
1 1 1 2   26 22 o 69.91118 3.262156 59.89728       5.542277 56.80500       8.911364 61.84787       7.077629 67.72573 5.445370 70.92424 4.112669 -3.198509      6.823936 
1 1 1 2   26 23 o 171.1086 3.972401 358.8550       16.56384 390.9472       31.38340 346.4636       19.50120 177.2260 7.282199 167.8431 4.772688 9.382919       8.706835 
1 1 1 2   26 24 o 147.0870 2.931757 264.5894       10.50844 254.5244       17.47806 270.2875       13.15081 143.6694 4.999832 148.5143 3.633692 -4.844971      6.180780 
1 1 1 2   26 25 o 47.76635 4.661697 28.35925       5.357303 35.36287       10.81669 26.08282       6.166802 52.23683 8.810420 45.56858 5.676104 6.668247       10.48054 
1 1 1 2   26 26 o 85.20496 3.596381 89.28569       7.450561 74.05805       14.83638 94.42094       8.615735 76.11781 8.123873 87.51751 4.050801 -11.39970      9.077791 
1 1 1 2   26 27 o 86.72244 2.954432 92.30553       6.234577 88.44767       10.39977 94.46983       7.789511 84.28951 5.086747 87.56629 3.658431 -3.276787      6.265709 
1 1 1 2   26 28 f 111.7804 3.006754 153.5423       8.182861 142.3696       12.77392 161.3178       10.65641 106.8763 4.917818 114.2780 3.832012 -7.401703      6.234521 
1 1 1 2   26 29 o 19.13727 5.713662 4.685380       2.867275 10.89684       6.150043 2.960279       3.241073 28.51385 8.330683 16.72902 6.109788 11.78483       10.33101 
1 1 1 2   26 30 o 57.30145 3.055474 40.60220       4.251158 49.83926       8.104049 37.09540       4.993337 62.59441 5.364563 54.54997 3.779673 8.044441       6.562352 
1 1 1 2   26 31 o 41.92458 4.149122 22.20232       4.183442 24.85318       6.568041 20.39277       5.426600 43.38792 6.404273 39.50465 5.810368 3.883270       8.647259 
1 1 1 2   26 32 o 43.49472 4.082880 24.00262       4.276922 28.96704       6.821161 20.78654       5.490181 46.72691 6.138719 39.63139 5.861294 7.095516       8.487558 
1 1 1 2   26 33 f 13.98691 5.928387 0.6742018      3.501413 2.121069       5.753310 -0.1769429     4.412708 18.20668 7.651765 14.67387 6.436477 3.532809       9.998887 
1 1 1 2   26 34 o 15.23235 6.158200 1.949902       3.538812 4.037578       5.865599 0.7551161      4.437371 19.56330 7.921391 15.27347 6.578298 4.289830       10.29672 
1 1 1 2   26 35 o 22.91707 7.502233 7.964296       4.828114 6.939094       5.805215 10.26444       8.695438 21.75653 8.134976 24.94748 9.793877 -3.190952      12.73177 
1 1 1 2   26 36 o 16.17893 6.732523 2.493972       4.388255 7.341486       5.361478 -7.343816      7.637896 21.56399 7.860897 14.43336 6.996742 7.130629       10.52369 
1 1 1 2   26 37 o 20.26304 6.632405 6.385259       3.773513 4.433319       5.675004 7.932294       5.052229 18.40300 7.656981 21.82010 7.667849 -3.417097      10.83629 
1 1 1 2   26 38 o 13.62274 5.894758 1.172574       3.595897 -3.246887      5.439828 4.602430       4.792239 13.05190 6.215096 17.73116 7.167057 -4.679264      9.486524 
1 1 1 2   26 39 o 29.28238 5.777481 13.29821       3.976209 16.15480       6.282675 11.38950       5.135588 28.42094 8.450987 24.55252 7.708106 3.868418       11.43827 
1 1 1 2   26 40 o 19.78128 6.578524 7.033345       3.707480 11.74590       6.122270 4.304417       4.658868 22.65381 8.376331 16.33552 6.876688 6.318293       10.83752 
1 1 1 2   26 41 o 12.69908 5.924844 -0.1563169     4.506405 0.000000       0.000000 -0.1563169     4.506405 ?        ?        12.69908 5.924844 0.000000       5.924844 
1 1 1 2   27 0  o 283.0764 4.651105 979.0955       32.08455 922.9888       43.52945 1045.836       47.47575 274.4799 6.507834 292.1360 6.668846 -17.65607      9.318015 
1 1 1 2   27 1  o 134.0370 3.193931 219.1953       10.43245 214.3291       14.27599 224.7720       15.28284 132.3862 4.431389 135.5538 4.633353 -3.167557      6.411331 
1 1 1 2   27 2  o 325.3819 5.963252 1296.048       47.28382 1271.726       56.95500 1349.989       84.81840 321.9530 7.259442 330.2877 10.55162 -8.334656      12.80766 
1 1 1 2   27 3  o 182.6671 4.122184 407.4866       18.34948 421.5155       31.02986 399.9427       22.75437 185.2840 6.884332 180.7778 5.170470 4.506195       8.609749 
1 1 1 2   27 4  o 200.2953 4.304626 490.0594       21.01079 471.5009       34.46303 501.0379       26.50663 195.8844 7.232090 202.3118 5.381247 -6.427414      9.014485 
1 1 1 2   27 5  f 140.0582 3.219550 239.3625       10.98853 215.6722       19.81115 249.8895       13.20619 132.5511 6.150009 143.0146 3.792667 -10.46353      7.225436 
1 1 1 2   27 6  o 124.9765 3.081647 190.5730       9.385282 191.7358       13.03555 189.3216       13.52347 125.2047 4.278695 124.3915 4.468559 0.8131714      6.186699 
1 1 1 2   27 7  o 198.7009 3.308939 481.8556       16.02229 479.3502       24.89346 483.6276       20.93506 197.8843 5.166655 198.9514 4.318085 -1.067139      6.733511 
1 1 1 2   27 8  o 146.4654 3.185575 261.7940       11.36997 254.5663       15.74024 269.6804       16.44182 144.2493 4.483208 148.4648 4.549912 -4.215515      6.387555 
1 1 1 2   27 9  o 167.0862 3.035561 340.6675       12.35992 343.4787       19.18634 338.6732       16.15984 167.5351 4.704140 166.5075 3.982605 1.027634       6.163609 
1 1 1 2   27 10 f 138.0528 3.240810 232.6308       10.90272 257.2925       23.32420 225.7355       12.33307 144.6288 6.635511 135.9018 3.727521 8.727036       7.610809 
1 1 1 2   27 11 o 92.19343 3.128591 103.8616       7.018675 109.4814       14.76790 102.2218       7.977197 94.22547 6.470814 91.42034 3.587694 2.805130       7.398850 
1 1 1 2   27 12 o 80.47268 3.200537 79.17931       6.263834 84.30628       13.21462 77.69354       7.113786 82.58701 6.621525 79.66866 3.674076 2.918350       7.572544 
1 1 1 2   27 13 o 152.0930 3.757328 282.6343       13.92593 316.9772       26.92997 270.0984       16.27023 160.3987 6.905857 148.5254 4.500473 11.87328       8.242883 
1 1 1 2   27 14 o 84.20035 3.138019 86.68002       6.427544 102.9289       14.63857 82.79912       7.154063 91.26198 6.627383 82.24830 3.577914 9.013680       7.531512 
1 1 1 2   27 15 o 156.0912 3.331444 297.5926       12.67206 302.3394       26.90592 296.2395       14.36504 156.5100 7.072834 155.6807 3.786483 0.8292999      8.022619 
1 1 1 2   27 16 o 116.4596 3.096107 165.7408       8.778934 137.7520       18.00219 174.4736       10.05566 105.4933 7.043025 119.4477 3.458234 -13.95439      7.846246 
1 1 1 2   27 17 o 73.82844 3.179488 66.70261       5.706866 49.34806       12.48507 71.28629       6.416406 62.56487 8.400998 76.29783 3.459993 -13.73296      9.085610 
1 1 1 2   27 18 o 128.4060 3.130027 201.4263       9.794210 207.9112       21.69284 199.7659       10.97669 129.6287 6.891960 127.7821 3.528426 1.846581       7.742667 
1 1 1 2   27 19 o 168.4795 3.497753 347.0967       14.36059 376.2746       22.06503 325.6554       18.91484 174.9716 5.180594 162.8750 4.770682 12.09659       7.042582 
1 1 1 2   27 20 o 72.11380 3.306335 63.71933       5.794878 71.03992       9.669724 59.61689       7.238719 75.84130 5.264735 69.61349 4.287903 6.227814       6.789959 
1 1 1 2   27 21 o 113.4425 3.209380 157.4928       8.863314 150.0628       13.54385 163.0582       11.72187 110.3743 5.048815 115.2569 4.180363 -4.882568      6.554843 
1 1 1 2   27 22 o 75.51275 3.127584 69.86079       5.742808 46.73433       13.23576 75.22421       6.374043 60.29262 9.307748 78.33212 3.346888 -18.03949      9.891200 
1 1 1 2   27 23 o 116.5196 3.069904 166.2382       8.709264 165.4889       19.56426 166.4233       9.726130 115.0831 7.009394 116.5141 3.429242 -1.431076      7.803288 
1 1 1 2   27 24 o 103.6018 3.022439 131.5039       7.622487 134.9575       17.58842 130.7052       8.458051 103.7280 6.999143 103.2180 3.367132 0.5099640      7.766954 
1 1 1 2   27 25 o 38.69872 3.948308 18.60432       3.671325 18.65760       9.505157 18.59498       3.980205 37.34345 10.17170 38.61998 4.302145 -1.276535      11.04409 
1 1 1 2   27 26 f 46.10560 3.442241 26.26324       3.839595 37.74141       7.795306 22.58657       4.411892 54.66599 5.947434 42.56157 4.313227 12.10442       7.346830 
1 1 1 2   27 27 o 111.3461 3.032039 152.3965       8.219424 151.0819       13.16087 153.2371       10.52427 110.0827 4.918441 111.3414 3.884771 -1.258675      6.267576 
1 1 1 2   27 28 o 65.29136 2.920262 52.51410       4.634610 66.54287       9.082541 47.57527       5.389017 72.71216 5.159340 61.96591 3.584081 10.74625       6.282072 
1 1 1 2   27 29 o 49.82977 3.214627 30.78278       3.882685 32.79367       7.296141 29.98834       4.585959 50.37797 6.065006 48.99061 3.872809 1.387360       7.196036 
1 1 1 2   27 30 o 60.02089 3.281859 44.77401       4.781925 32.45245       10.38224 48.09173       5.387390 47.91541 9.226324 62.09874 3.575190 -14.18333      9.894798 
1 1 1 2   27 31 o 32.30606 4.296623 13.38129       3.298785 9.818524       6.141355 14.82608       3.910870 26.41784 8.446022 33.79756 4.890432 -7.379717      9.759693 
1 1 1 2   27 32 o 47.99713 3.280242 28.92769       3.813633 33.02692       7.294561 27.38585       4.473720 49.53976 6.176167 46.36282 3.998745 3.176941       7.357649 
1 1 1 2   27 33 o 11.56159 5.387771 -2.690657      3.708826 2.406091       7.678907 -4.241363      4.235625 19.85287 8.602333 11.62947 5.522437 8.223395       10.22240 
1 1 1 2   27 34 o 12.21484 5.476361 -0.7378506     3.372618 4.501743       5.439399 -4.010220      4.298661 19.30347 7.692789 11.71617 5.563541 7.587299       9.493787 
1 1 1 2   27 35 o 27.18825 7.342716 11.62513       4.978303 12.48813       5.946965 9.604130       9.100698 27.35827 8.242598 23.65658 9.756061 3.701691       12.77189 
1 1 1 2   27 36 o 11.41739 5.278679 -1.619211      3.454159 -3.929537      5.359314 0.2243856E-01  4.517652 12.95801 6.169980 14.11669 6.332892 -1.158675      8.841616 
1 1 1 2   27 37 f 16.69627 6.473266 3.896036       3.760561 5.548267       5.423307 2.365919       5.219044 18.90142 7.629982 16.17966 7.050436 2.721760       10.38871 
1 1 1 2   27 38 o 14.12874 5.969440 2.008318       3.531352 8.294835       5.470980 -2.481394      4.623484 20.87122 7.877433 12.21939 5.793009 8.651827       9.778185 
1 1 1 2   27 39 o 20.02167 6.617290 7.126238       3.752856 4.029726       5.764588 9.403989       4.944075 16.55241 7.304930 21.72366 7.588925 -5.171247      10.53346 
1 1 1 2   27 40 o 12.29628 5.473412 0.8371515      3.305575 0.9766838      5.055375 0.7329377      4.368964 13.90156 6.412535 13.23230 6.050976 0.6692591      8.816741 
1 1 1 2   28 0  o 105.5162 3.238983 135.9985       8.318586 148.7051       15.79867 131.1244       9.784822 110.0296 5.913895 103.5488 3.884566 6.480797       7.075592 
1 1 1 2   28 1  o 89.63249 3.601159 98.23821       7.849803 98.65686       12.79075 97.98526       9.942349 89.55836 5.893513 89.41916 4.577941 0.1392059      7.462643 
1 1 1 2   28 2  o 127.1012 3.665912 197.4018       11.34263 197.4766       18.61862 197.3577       14.30328 126.8146 6.042172 126.9789 4.630156 -0.1643372     7.612239 
1 1 1 2   28 3  o 282.1680 4.672259 973.3732       32.12705 911.6159       61.54345 996.5065       37.66661 271.5674 9.313465 285.3368 5.417047 -13.76941      10.77428 
1 1 1 2   28 4  o 111.8479 2.819989 152.7134       7.680063 154.4410       11.60464 151.3670       10.24456 112.3463 4.246385 111.2697 3.783664 1.076569       5.687521 
1 1 1 2   28 5  o 145.5985 2.930033 258.6527       10.39598 256.5095       15.88931 260.2568       13.74664 144.7886 4.508832 145.9239 3.869167 -1.135284      5.941381 
1 1 1 2   28 6  o 123.0115 3.153033 184.7971       9.443920 186.9665       12.94222 182.3265       13.81156 123.6102 4.303099 122.0207 4.653395 1.589500       6.338040 
1 1 1 2   28 7  o 130.8639 3.169404 209.0211       10.10726 216.3629       14.01402 201.0623       14.59108 132.9738 4.330522 128.1342 4.680762 4.839584       6.376751 
1 1 1 2   28 8  o 85.35546 3.164734 89.04866       6.571311 98.65597       8.954362 77.83566       9.673747 89.75652 4.104722 79.59406 5.012904 10.16245       6.479039 
1 1 1 2   28 9  o 112.7397 3.468853 155.3540       9.518793 153.1429       11.47208 160.2405       17.05396 111.8498 4.216472 114.1216 6.155048 -2.271751      7.460781 
1 1 1 2   28 10 o 144.8566 3.255237 256.1882       11.49098 242.0199       15.35812 274.2064       17.31950 140.5957 4.488348 149.6185 4.756264 -9.022827      6.539673 
1 1 1 2   28 11 o 156.0104 4.710100 298.1357       17.88636 304.9975       26.56332 292.4441       24.19280 157.3124 6.946332 154.1550 6.454376 3.157333       9.482115 
1 1 1 2   28 12 o 129.4670 3.791942 205.0207       11.95057 198.9477       20.84435 207.9943       14.58582 127.0008 6.759476 130.2856 4.601301 -3.284775      8.176949 
1 1 1 2   28 13 o 148.5217 3.848436 269.8261       13.91696 245.4854       23.74322 282.5655       17.17705 141.0355 6.929579 151.8551 4.647231 -10.81967      8.343610 
1 1 1 2   28 14 o 118.2356 3.710774 171.0424       10.67851 184.4335       20.28857 165.9113       12.55882 122.1881 6.841069 116.3427 4.437832 5.845474       8.154421 
1 1 1 2   28 15 o 96.76444 3.686297 114.6320       8.676555 108.0838       16.12183 117.3020       10.29460 93.33933 7.142081 97.79899 4.330293 -4.459656      8.352290 
1 1 1 2   28 16 o 71.85719 3.859682 63.33907       6.733816 74.85070       13.40766 59.45584       7.787187 77.53927 7.177131 69.50918 4.623579 8.030090       8.537487 
1 1 1 2   28 17 o 72.98476 3.760782 65.33399       6.666218 80.48950       13.64524 60.58290       7.639991 80.42264 7.033230 70.17253 4.491336 10.25011       8.344964 
1 1 1 2   28 18 o 101.5720 3.632623 126.3753       8.976983 136.9013       17.42762 122.5739       10.47331 105.0303 6.846380 99.92190 4.311320 5.108391       8.090760 
1 1 1 2   28 19 o 56.01851 4.089097 38.64962       5.543621 37.56005       11.50537 38.97906       6.326417 54.11937 9.042747 56.16817 4.664055 -2.048794      10.17471 
1 1 1 2   28 20 o 109.8954 3.122756 147.7912       8.354356 150.9593       19.58510 147.0865       9.236884 110.0029 7.348242 109.5783 3.463462 0.4245224      8.123560 
1 1 1 2   28 21 o 87.89161 3.056844 94.60030       6.537250 79.89374       14.52889 98.33350       7.320100 79.70454 7.571002 89.56467 3.359811 -9.860130      8.283019 
1 1 1 2   28 22 o 49.71186 4.739039 30.69290       5.671602 19.52156       10.27173 35.59258       6.802598 38.40842 10.61903 53.44860 5.292193 -15.04018      11.86470 
1 1 1 2   28 23 o 77.64642 3.047411 73.93806       5.754987 71.00433       13.29929 74.61398       6.383619 74.91929 7.380207 77.94531 3.368740 -3.026024      8.112698 
1 1 1 2   28 24 o 64.62031 2.934122 51.25928       4.608384 63.72334       9.175062 47.05396       5.329403 71.50095 5.303522 61.79820 3.553874 9.702751       6.384149 
1 1 1 2   28 25 o 43.02502 3.431457 22.89493       3.567997 24.96004       7.237351 22.23185       4.101002 43.98147 6.985972 42.27411 4.029572 1.707363       8.064816 
1 1 1 2   28 26 o 23.09734 5.437580 6.931875       3.009492 13.70220       6.246339 4.885154       3.434393 32.01007 8.023928 19.79876 6.314555 12.21131       10.21063 
1 1 1 2   28 27 o 63.62653 2.957473 49.89842       4.573044 43.34416       8.358822 52.69816       5.463140 58.25923 5.972122 65.25849 3.447567 -6.999264      6.895792 
1 1 1 2   28 28 o 75.79581 2.863128 70.85809       5.278865 70.57565       9.590775 70.98085       6.322796 74.55576 5.313645 75.65977 3.438306 -1.104012      6.329042 
1 1 1 2   28 29 o 64.94809 3.204748 52.36717       5.056536 50.17494       11.65029 52.87600       5.612760 60.70253 8.075970 65.12747 3.549942 -4.424946      8.821755 
1 1 1 2   28 30 o 44.14631 3.544210 24.47868       3.780841 27.57798       7.150944 23.27612       4.454353 45.26596 6.683454 42.72577 4.338259 2.540195       7.968001 
1 1 1 2   28 31 o 22.65804 5.507677 6.957682       3.011025 13.30342       6.019035 4.839610       3.477413 30.19990 8.037676 19.18921 6.370826 11.01069       10.25630 
1 1 1 2   28 32 o 56.26149 4.222112 40.79193       5.746420 35.97868       10.80278 42.69133       6.786182 47.83927 9.600558 57.00649 4.933518 -9.167225      10.79399 
1 1 1 2   28 33 o 8.698838 4.214736 -4.087347      2.762547 1.243068       5.290167 -6.085949      3.239306 16.46439 7.137049 8.774348 4.317095 7.690043       8.341150 
1 1 1 2   28 34 o 19.70823 6.380639 5.690195       3.497486 7.372200       5.595103 4.611432       4.480817 21.76148 8.014423 18.51710 7.095653 3.244377       10.70417 
1 1 1 2   28 35 o 17.74409 5.832466 4.554558       2.916860 18.47045       5.684195 -0.4197024     3.398426 34.54594 6.992303 12.24883 5.493994 22.29711       8.892484 
1 1 1 2   28 36 o 27.07420 6.168755 11.23144       3.978868 11.50977       5.775755 10.98006       5.489120 25.17181 8.203305 24.82190 7.989818 0.3499107      11.45126 
1 1 1 2   28 37 o 11.93490 5.507696 -1.028075      3.735070 -2.114545      5.539932 -0.1226405     5.057365 13.49656 6.381485 14.06274 6.460269 -0.5661812     9.080663 
1 1 1 2   28 38 o 27.02024 6.126208 11.89661       3.940507 15.25499       6.385869 9.831499       5.007566 26.58814 8.622853 22.36230 7.645656 4.225840       11.52431 
1 1 1 2   28 39 o 15.02780 6.091712 3.398613       3.473294 3.484243       5.498879 3.341772       4.480141 15.79359 7.042937 15.33052 6.606461 0.4630642      9.656515 
1 1 1 2   28 40 o 14.75781 6.279292 3.264850       3.954135 -3.027720      7.837321 5.413548       4.579745 13.79912 6.774482 16.80285 6.924309 -3.003739      9.687087 
1 1 1 2   29 0  o 185.5734 3.613221 420.5387       16.33979 415.7757       22.62446 425.7318       23.62382 184.2569 5.043440 186.4209 5.205287 -2.163986      7.247848 
1 1 1 2   29 1  o 104.8057 3.613876 134.2956       9.216037 128.9713       15.10643 137.4521       11.63135 102.3810 6.082305 105.9311 4.516149 -3.550049      7.575621 
1 1 1 2   29 2  o 115.9667 3.222821 164.2811       9.098804 165.1511       12.49133 163.2977       13.28017 116.1427 4.421549 115.4480 4.730444 0.6946640      6.475121 
1 1 1 2   29 3  o 341.6293 4.827478 1427.874       40.18940 1382.215       61.79120 1461.350       52.90960 335.1298 7.566195 345.1201 6.291122 -9.990326      9.839996 
1 1 1 2   29 4  o 134.7010 2.912635 221.4145       9.560771 211.6852       14.26570 229.3477       12.88189 131.4999 4.458203 136.9602 3.863522 -5.460251      5.899354 
1 1 1 2   29 5  f 162.3620 3.417887 321.8852       13.52316 324.8427       18.66235 318.6154       19.62308 162.8837 4.706610 161.2633 4.999431 1.620407       6.866330 
1 1 1 2   29 6  o 37.51429 4.157705 17.41167       3.737164 15.50844       5.224550 19.40584       5.347904 35.01443 6.357086 39.38220 5.741304 -4.367767      8.565928 
1 1 1 2   29 7  o 198.7548 3.330933 482.3543       16.13317 471.4624       24.75887 490.3916       21.26834 196.1339 5.184694 200.2522 4.358332 -4.118271      6.773190 
1 1 1 2   29 8  o 317.7249 5.061354 1236.285       39.18809 1232.533       55.24658 1240.085       55.59573 316.4373 7.164430 317.3947 7.187959 -0.9574280     10.14869 
1 1 1 2   29 9  o 73.12485 3.137734 65.40492       5.578347 68.42595       7.590930 61.85801       8.225127 74.68794 4.187463 70.92519 4.786934 3.762749       6.359999 
1 1 1 2   29 10 o 144.7789 3.278238 255.9853       11.56596 284.3279       16.45182 228.2886       16.26329 152.3746 4.435350 136.4429 4.899219 15.93169       6.608682 
1 1 1 2   29 11 o 113.8436 3.614738 158.5326       10.01545 150.9468       17.78701 162.0544       12.11931 110.5703 6.631757 115.0053 4.332126 -4.434975      7.921333 
1 1 1 2   29 12 o 93.13181 3.224023 106.0635       7.305952 87.25166       14.88876 112.0298       8.384855 83.78459 7.367137 95.67648 3.602723 -11.89188      8.200873 
1 1 1 2   29 13 o 146.3000 3.323570 261.5037       11.84909 245.9492       23.80370 266.6276       13.66203 141.0729 6.945477 147.6161 3.801078 -6.543243      7.917565 
1 1 1 2   29 14 o 90.36090 3.210023 99.87956       7.057230 105.1458       15.08496 98.40400       7.984942 92.10674 6.767992 89.63670 3.663243 2.470039       7.695783 
1 1 1 2   29 15 o 94.47375 3.179709 109.1798       7.309966 89.74464       15.07702 115.1525       8.358047 84.87743 7.362062 96.98093 3.542524 -12.10349      8.170033 
1 1 1 2   29 16 o 52.89278 3.710219 34.39557       4.751915 23.85024       10.51922 37.09923       5.326355 42.74681 10.23408 54.90255 4.008710 -12.15575      10.99119 
1 1 1 2   29 17 o 175.6881 3.547892 377.6254       15.18969 425.7256       33.92213 365.5622       16.98798 185.0797 7.536987 172.7560 4.035269 12.32364       8.549244 
1 1 1 2   29 18 o 36.36563 4.834836 16.52284       4.178529 8.208710       9.496852 18.51879       4.653138 28.27391 10.43639 38.48786 5.085519 -10.21395      11.60951 
1 1 1 2   29 19 o 157.0397 3.842369 302.2221       14.70430 0.000000       0.000000 302.2221       14.70430 ?        ?        157.0397 3.842369 0.000000       3.842369 
1 1 1 2   29 20 o 107.7500 3.113206 142.1808       8.165934 148.4797       18.11974 140.5755       9.147527 109.0709 6.851834 107.0660 3.510780 2.004868       7.698910 
1 1 1 2   29 21 o 88.30306 3.885292 95.89874       8.340095 93.47152       15.43455 96.89970       9.911706 86.12426 7.426621 88.59748 4.606650 -2.473221      8.739332 
1 1 1 2   29 22 o 64.89285 3.455180 51.80277       5.444215 50.67659       9.171033 52.41559       6.765212 63.57900 5.989856 65.11073 4.287622 -1.531734      7.366280 
1 1 1 2   29 23 o 12.04801 5.214619 -0.3125421     2.815353 -6.165417      6.473441 1.052737       3.126521 15.00723 7.033979 14.19102 5.769635 0.8162079      9.097557 
1 1 1 2   29 24 o 13.18613 5.456091 0.6547694      2.859156 -7.857568      6.151506 3.000412       3.229148 13.71403 6.552162 16.84964 6.106716 -3.135612      8.956718 
1 1 1 2   29 25 o 38.97058 3.641950 18.89351       3.418596 18.78526       7.060287 18.92667       3.907160 37.52778 7.966893 38.87700 4.190230 -1.349216      9.001634 
1 1 1 2   29 26 o 22.49104 5.486596 6.616534       2.979921 -2.843588      6.304327 9.338266       3.381529 16.25708 7.369516 26.81325 5.362682 -10.55617      9.114172 
1 1 1 2   29 27 o 44.61214 3.389923 24.76641       3.657762 28.13480       7.119550 23.55848       4.263464 46.37136 6.476823 43.29895 4.089062 3.072411       7.659613 
1 1 1 2   29 28 o 13.71742 5.669270 0.9082635      3.082009 4.803863       7.964982 0.2222797      3.342370 22.87873 9.242665 13.45968 5.751423 9.419054       10.88603 
1 1 1 2   29 29 f 14.29841 5.582783 1.797789       2.812611 10.53422       5.940156 -0.7268783     3.193250 27.23996 8.244594 12.21072 5.410543 15.02925       9.861405 
1 1 1 2   29 30 o 38.03320 3.747062 18.38722       3.427825 22.68937       6.554267 16.76746       4.021673 40.48368 6.890265 35.87751 4.713821 4.606171       8.348405 
1 1 1 2   29 31 o 16.85137 6.019787 3.523568       3.124756 9.200866       8.980002 2.741450       3.333050 25.23539 9.938892 15.96889 6.119619 9.266501       11.67182 
1 1 1 2   29 32 f 16.59636 5.711444 3.619368       2.795623 4.068057       5.206087 3.437558       3.313968 18.78897 7.513216 16.67221 6.163054 2.116756       9.717594 
1 1 1 2   29 33 o 17.91744 6.365745 4.446826       3.489667 8.642463       5.580417 1.752485       4.471920 23.19338 8.065059 15.70677 6.680232 7.486610       10.47238 
1 1 1 2   29 34 o 13.52355 5.809861 0.9183199      3.444560 -1.373282      5.328372 2.563541       4.514785 14.28141 6.586195 16.23343 6.797487 -1.952021      9.464872 
1 1 1 2   29 35 o 34.15148 4.283531 15.89205       3.486689 19.76228       6.242987 14.13760       4.203329 34.51550 7.625888 30.90583 5.793872 3.609661       9.577219 
1 1 1 2   29 36 o 19.49287 5.803732 5.919513       2.961575 5.722633       5.547439 5.997994       3.502457 18.68079 7.651065 19.25339 6.393775 -0.5726013     9.970916 
1 1 1 2   29 37 o 18.03710 6.525219 5.500100       3.684751 4.496181       5.374461 6.390556       5.061645 17.05102 7.289776 18.69439 7.430410 -1.643370      10.40922 
1 1 1 2   29 38 o 15.77533 6.309865 3.947436       3.672998 -4.200571      5.396329 10.98057       5.013572 11.96093 5.817309 23.27644 7.646369 -11.31551      9.607708 
1 1 1 2   29 39 o 11.41785 5.276273 -0.4284113     3.444750 -0.1122497     5.778597 -0.6026977     4.290418 13.71351 6.493987 12.25505 5.738353 1.458457       8.666058 
1 1 1 2   30 0  o 88.52494 2.964451 95.75504       6.386059 97.06300       9.419872 94.64266       8.687073 88.98389 4.357326 87.89926 4.066592 1.084633       5.960156 
1 1 1 2   30 1  o 160.8778 3.435168 316.0801       13.46728 339.1967       19.24009 293.8752       18.85692 166.4160 4.749200 154.8450 5.003895 11.57098       6.898831 
1 1 1 2   30 2  o 36.74825 4.754043 16.79904       4.157650 9.978710       5.363259 27.07011       6.581642 28.00818 7.645423 46.60711 5.928914 -18.59893      9.674943 
1 1 1 2   30 3  o 126.0632 2.936615 193.9673       9.021346 191.7902       13.64624 195.6574       12.02350 125.1318 4.482408 126.4680 3.906025 -1.336281      5.945504 
1 1 1 2   30 4  o 205.0758 3.424778 513.6465       17.11524 528.7247       26.91366 503.4084       22.17730 207.6493 5.323098 202.8498 4.486401 4.799484       6.961549 
1 1 1 2   30 5  o 246.7150 3.813976 743.8742       22.93029 727.2112       35.38452 755.9378       30.10752 243.4096 5.965399 248.4472 4.972844 -5.037628      7.766284 
1 1 1 2   30 6  o 229.3639 4.044042 643.2115       22.60356 652.9921       31.95548 633.4178       31.97705 230.7141 5.683751 227.1312 5.782009 3.582916       8.107815 
1 1 1 2   30 7  o 58.21009 3.539434 41.54953       4.997016 40.41157       6.655243 43.02012       7.565672 57.24787 4.815139 59.00496 5.318695 -1.757084      7.174543 
1 1 1 2   30 8  o 184.4308 3.598872 415.6470       16.17469 415.5102       30.74429 415.6993       19.01964 183.5745 6.884719 184.3406 4.233946 -0.7660522     8.082429 
1 1 1 2   30 9  o 233.3271 4.063430 665.8743       23.10437 636.6246       31.70904 698.9790       33.73391 227.6499 5.720363 238.5857 5.802113 -10.93575      8.147826 
1 1 1 2   30 10 o 160.8862 3.026465 316.0866       11.86563 321.8444       18.46663 312.0379       15.48535 162.0290 4.681817 159.7239 3.978460 2.305038       6.143904 
1 1 1 2   30 11 o 164.5373 3.493516 330.8803       14.00759 333.7535       28.71651 329.9832       16.04605 164.2849 7.190367 164.2342 4.009300 0.5067444E-01  8.232610 
1 1 1 2   30 12 o 195.0211 4.275328 465.6760       20.31829 446.7474       35.63426 474.7946       24.73277 189.8285 7.719285 196.6355 5.165960 -6.807037      9.288407 
1 1 1 2   30 13 f 151.2498 3.380978 279.6401       12.46159 247.6963       24.53991 290.7397       14.46550 141.3881 7.145526 154.1484 3.850864 -12.76028      8.117124 
1 1 1 2   30 14 o 108.5526 3.211061 144.1527       8.484906 127.0033       16.85735 149.9716       9.819460 101.1455 6.880178 110.6604 3.646302 -9.514893      7.786679 
1 1 1 2   30 15 o 35.54482 5.011341 15.81628       4.220447 19.81561       9.139256 14.73223       4.758181 38.99491 9.666315 34.10199 5.941475 4.892914       11.34631 
1 1 1 2   30 16 o 121.8683 3.210056 181.7302       9.524920 179.4489       20.16833 182.3851       10.80593 120.1810 6.915699 122.0146 3.638307 -1.833679      7.814356 
1 1 1 2   30 17 f 98.83877 3.554948 119.7582       8.548477 0.000000       0.000000 119.7582       8.548477 ?        ?        98.83877 3.554948 0.000000       3.554948 
1 1 1 2   30 18 o 17.13827 6.495666 2.631851       3.729084 3.287056       9.204031 2.503175       4.078859 24.24285 9.883287 17.47189 6.750412 6.770958       11.96860 
1 1 1 2   30 19 f 19.14431 6.516661 4.227962       3.637164 3.866862       8.833743 4.301674       3.991167 24.21801 9.751386 19.58040 6.819900 4.637615       11.89960 
1 1 1 2   30 20 o 61.38244 3.425483 46.33886       5.103591 45.16760       11.72282 46.61276       5.669028 59.27317 8.346774 61.49841 3.801338 -2.225239      9.171631 
1 1 1 2   30 21 o 66.96511 3.679075 55.25840       5.980692 52.61932       11.86529 56.15727       6.924704 64.12289 7.750334 67.38670 4.238344 -3.263809      8.833529 
1 1 1 2   30 22 o 77.96745 3.108666 74.70081       5.894569 60.87526       13.17380 78.16170       6.591187 68.70868 8.018551 79.68991 3.401923 -10.98123      8.710352 
1 1 1 2   30 23 o 63.03945 3.257198 48.98598       4.986748 46.99147       8.648439 49.97938       6.103568 60.94481 5.896824 63.50256 3.963946 -2.557755      7.105308 
1 1 1 2   30 24 o 71.94836 2.888726 63.70094       5.054515 51.63386       8.960004 69.33352       6.121544 63.78202 5.829027 74.93835 3.360680 -11.15634      6.728426 
1 1 1 2   30 25 o 53.76134 3.102871 35.73557       4.047817 41.94349       7.911298 33.53411       4.711180 57.30136 5.742931 51.89869 3.750391 5.402676       6.859058 
1 1 1 2   30 26 o 18.40091 5.745502 4.323132       2.857291 12.41128       6.159310 2.105263       3.225339 29.97873 8.197218 15.45265 5.993884 14.52608       10.15485 
1 1 1 2   30 27 o 36.37084 3.924780 16.71925       3.423584 18.20400       6.971488 16.24738       3.930128 36.07379 8.126172 35.59823 4.640841 0.4755592      9.357996 
1 1 1 2   30 28 o 27.54757 4.815527 9.927311       3.115056 14.46572       6.032763 8.277341       3.637496 31.93940 7.815733 24.68106 6.086624 7.258339       9.906194 
1 1 1 2   30 29 o 25.74116 5.108663 8.851670       3.091465 13.00151       5.954284 7.320152       3.617218 29.78888 8.023908 22.99328 6.279696 6.795597       10.18910 
1 1 1 2   30 30 o 26.83906 5.494812 9.847395       3.472726 3.442101       9.116832 10.93451       3.755879 21.48341 9.340538 28.23243 5.656458 -6.749025      10.91976 
1 1 1 2   30 31 o 10.26609 4.713286 -1.472477      2.686407 0.4661712      4.974275 -2.270737      3.191923 15.52354 6.820692 10.73072 4.999796 4.792824       8.456939 
1 1 1 2   30 32 o 21.17956 6.433253 6.653242       3.612309 6.930869       5.489810 6.441254       4.797123 21.34593 7.924648 20.74031 7.452821 0.6056232      10.87863 
1 1 1 2   30 33 o 13.74217 5.855524 1.127140       3.447050 1.236737       5.611889 1.060736       4.368227 16.20847 7.177760 14.81330 6.452687 1.395164       9.651809 
1 1 1 2   30 34 o 12.64024 5.480949 0.6374878      3.121784 -1.668260      5.369383 1.814907       3.836932 13.93415 6.489799 14.66062 6.209581 -0.7264662     8.982004 
1 1 1 2   30 35 o 32.27653 4.399913 14.50409       3.370713 25.06079       6.626239 10.81871       3.915115 38.83057 7.269680 26.18631 6.226818 12.64426       9.571913 
1 1 1 2   30 36 o 14.78524 5.795016 3.022784       3.040149 9.644077       5.661726 0.3401769      3.603760 21.78733 8.055269 12.59501 5.652750 9.192312       9.840779 
1 1 1 2   30 37 o 21.82516 6.522197 8.393955       3.734855 2.203145       5.609363 13.32416       5.005785 15.23717 6.924646 26.48161 7.447176 -11.24444      10.16913 
1 1 1 2   30 38 o 8.152300 4.019919 -4.638651      2.861072 -5.730625      5.171618 -4.157043      3.434531 11.04254 5.437309 9.358467 4.571239 1.684076       7.103559 
1 1 1 2   31 0  o 35.32822 4.841835 15.56539       4.058835 16.91462       5.792539 14.26398       5.688980 36.51162 6.759187 33.39981 7.201775 3.111805       9.876850 
1 1 1 2   31 1  o 134.9954 3.309340 222.5787       10.88670 248.7189       15.74321 198.6230       15.07103 142.4811 4.539986 127.2554 4.868919 15.22569       6.657165 
1 1 1 2   31 2  o 119.6213 2.941139 174.6828       8.573538 185.3252       13.30609 167.1280       11.21096 122.9816 4.447233 116.8516 3.942708 6.129974       5.943301 
1 1 1 2   31 3  o 59.14223 3.735191 42.92065       5.355777 48.66689       7.104671 35.35698       8.151133 62.87551 4.670234 53.25117 6.410102 9.624340       7.930984 
1 1 1 2   31 4  o 133.4368 3.781984 217.8309       12.28551 204.8323       19.47692 226.4202       15.83250 128.9430 6.216812 135.8797 4.788927 -6.936707      7.847457 
1 1 1 2   31 5  o 200.4321 3.839169 491.1739       18.75170 486.0467       25.54655 497.1634       27.61147 199.0123 5.272287 201.1741 5.637802 -2.161865      7.718926 
1 1 1 2   31 6  o 79.83385 2.996398 77.93285       5.819038 77.85461       8.396471 78.00516       8.071851 79.63889 4.342924 79.73926 4.168459 -0.1003723     6.019721 
1 1 1 2   31 7  o 74.37119 2.992291 67.65014       5.411991 77.40066       8.141892 59.93166       7.243976 79.41727 4.222190 69.84740 4.276391 9.569870       6.009526 
1 1 1 2   31 8  o 15.26606 6.052656 1.534814       3.350645 0.2475666      4.602655 2.986137       4.887191 16.09794 6.808889 19.16165 7.392859 -3.063704      10.05064 
1 1 1 2   31 9  o 77.48986 2.931539 73.43549       5.525770 88.19787       8.465702 62.47723       7.293826 84.79088 4.109347 71.31592 4.215748 13.47496       5.887213 
1 1 1 2   31 10 o 190.1339 3.641897 442.1107       16.87421 425.3080       23.22149 460.9100       24.56239 186.0804 5.125865 193.6927 5.208536 -7.612274      7.307759 
1 1 1 2   31 11 o 53.96739 3.991990 35.84609       5.212805 42.06836       10.45622 33.78814       6.013373 57.79619 7.608643 52.27094 4.773492 5.525249       8.982075 
1 1 1 2   31 12 o 79.25266 3.383955 76.93986       6.520393 72.35787       13.33624 78.37924       7.474713 76.11092 7.278931 79.92994 3.848816 -3.819023      8.233846 
1 1 1 2   31 13 o 101.7924 3.668886 126.9673       9.086039 140.4074       17.18975 121.7563       10.70346 106.3814 6.664309 99.55079 4.423124 6.830612       7.998565 
1 1 1 2   31 14 o 62.62039 3.652385 48.16229       5.549313 31.46926       11.12625 53.68990       6.402505 49.25282 9.615213 66.07845 3.994728 -16.82563      10.41202 
1 1 1 2   31 15 o 85.80335 3.771872 90.36706       7.867465 0.000000       0.000000 90.36706       7.867465 ?        ?        85.80335 3.771872 0.000000       3.771872 
1 1 1 2   31 16 o 81.92645 3.791110 82.44898       7.548272 0.000000       0.000000 82.44898       7.548272 ?        ?        81.92645 3.791110 0.000000       3.791110 
1 1 1 2   31 17 o 73.03920 3.315855 65.46529       5.886450 78.97911       13.36340 62.21192       6.556838 79.33059 6.983805 71.11792 3.797139 8.212669       7.949327 
1 1 1 2   31 18 o 12.76931 5.658253 -1.124105      3.492639 -2.296076      7.529678 -0.8028217     3.942414 18.63527 8.279960 13.93233 6.098246 4.702942       10.28330 
1 1 1 2   31 19 o 18.14180 6.318862 3.702839       3.426272 2.566431       8.006199 3.957628       3.790958 22.29836 9.168570 18.87032 6.641232 3.428038       11.32116 
1 1 1 2   31 20 o 95.69653 3.118747 112.4377       7.263268 139.0004       17.16165 106.6416       8.016641 105.0013 6.742634 93.09209 3.540264 11.90924       7.615549 
1 1 1 2   31 21 o 54.27640 3.812252 36.48199       5.010231 43.38925       11.34186 34.80731       5.584672 57.61706 8.318447 52.87461 4.373333 4.742447       9.398011 
1 1 1 2   31 22 o 31.23602 5.118526 12.46826       3.761332 15.06334       8.372885 11.81216       4.210051 33.28365 9.719177 30.16498 5.938766 3.118673       11.38997 
1 1 1 2   31 23 o 20.74532 6.116370 5.560737       3.302306 13.64640       9.035735 4.314244       3.547730 31.70162 10.25512 18.96052 6.436305 12.74110       12.10758 
1 1 1 2   31 24 o 18.60995 5.850645 4.390209       2.957695 13.58771       6.421551 1.913647       3.332188 31.46733 8.268166 15.41106 6.058965 16.05627       10.25054 
1 1 1 2   31 25 o 33.53986 4.454573 14.33972       3.550918 14.86092       8.777871 14.23774       3.882802 32.17562 10.07393 33.25460 4.941318 -1.078976      11.22055 
1 1 1 2   31 26 o 34.44081 4.094750 15.07861       3.369464 20.44606       6.633548 13.21224       3.911656 38.65765 7.309360 31.79716 5.229862 6.860495       8.987669 
1 1 1 2   31 27 o 36.50721 3.875193 16.93267       3.394932 28.07650       6.538364 12.81929       3.972386 45.96955 5.978105 31.08629 5.441960 14.88326       8.084100 
1 1 1 2   31 28 o 31.36973 4.345835 12.77653       3.233033 19.00832       6.404975 10.64584       3.745168 36.49233 7.454636 27.99639 5.683844 8.495937       9.374310 
1 1 1 2   31 29 f 7.734537 3.852496 -6.946481      2.888343 5.430986       7.763580 -8.934890      3.111709 21.85192 9.011265 7.531287 3.786695 14.32063       9.774556 
1 1 1 2   31 30 o 20.59018 5.747002 5.996844       2.992967 6.924851       5.636269 5.632395       3.532108 21.78708 8.040356 19.89541 6.409651 1.891663       10.28256 
1 1 1 2   31 31 o 18.02145 6.457313 4.492070       3.598326 10.58704       5.574665 0.1389573      4.711216 25.48753 8.034871 14.71018 6.541934 10.77735       10.36128 
1 1 1 2   31 32 o 10.75085 5.026976 -2.191604      3.273453 -1.685620      5.108883 -2.544012      4.263640 13.85490 6.410590 12.19982 5.715043 1.655087       8.588212 
1 1 1 2   31 33 o 14.76009 5.841761 2.544275       3.116097 3.524642       5.427396 2.062195       3.805895 17.40214 7.378645 14.87855 6.236341 2.523583       9.661075 
1 1 1 2   31 34 f 28.75127 5.070132 11.98219       3.422545 14.43867       6.157588 10.88400       4.117105 27.50944 8.407978 25.98881 6.514195 1.520624       10.63620 
1 1 1 2   31 35 o 29.88225 4.914022 13.06765       3.454104 14.97003       6.553317 12.33584       4.064525 26.49593 8.743861 27.67593 6.182701 -1.179993      10.70892 
1 1 1 2   31 36 o 13.16593 5.733023 1.423480       3.445561 -3.415386      5.288524 4.992338       4.541793 12.24466 5.908004 17.08763 6.951482 -4.842974      9.122917 
1 1 1 2   31 37 o 11.96361 5.246603 0.9178055      2.930678 -1.546251      5.447249 1.921591       3.476742 12.96061 6.184904 13.44960 5.807998 -0.4889917     8.484449 
1 1 1 2   32 0  o 53.09772 4.901105 34.84822       6.270177 34.67164       9.608798 34.97917       8.274734 52.40997 7.757453 52.90369 6.558856 -0.4937210     10.15858 
1 1 1 2   32 1  o 85.04167 4.160712 88.71381       8.596374 110.2035       14.11481 76.04298       10.83833 94.45449 6.165908 78.47510 5.706531 15.97939       8.401364 
1 1 1 2   32 2  o 117.8235 4.872543 170.4611       13.96001 0.000000       0.000000 170.4611       13.96001 ?        ?        117.8235 4.872543 0.000000       4.872543 
1 1 1 2   32 3  o 121.9347 2.978880 181.5764       8.851491 191.8998       13.45377 173.6974       11.75359 125.1037 4.419984 119.0749 4.056474 6.028763       5.999270 
1 1 1 2   32 4  o 135.9672 2.992154 225.7879       9.914122 245.3501       15.50988 212.2727       12.89173 141.4531 4.505198 131.6490 4.023162 9.804092       6.040086 
1 1 1 2   32 5  o 192.7471 3.749325 454.3936       17.61072 480.6363       34.56541 445.1934       20.46623 197.1037 7.208468 190.6484 4.405232 6.455322       8.447964 
1 1 1 2   32 6  o 114.1535 2.899004 159.2506       8.057913 151.0967       11.93268 166.0856       10.92509 110.9695 4.421491 116.4470 3.855312 -5.477577      5.866260 
1 1 1 2   32 7  o 131.6105 2.928734 211.5756       9.393048 186.5141       13.62664 234.2644       12.96556 123.2732 4.543890 138.3099 3.850568 -15.03672      5.955989 
1 1 1 2   32 8  o 91.30186 3.423397 102.0667       7.603318 145.1082       16.63554 90.70123       8.548436 108.3059 6.330621 85.96832 4.092237 22.33760       7.538114 
1 1 1 2   32 9  o 145.3550 2.994482 258.1486       10.60689 248.7527       15.89486 265.6916       14.24174 142.3477 4.588150 147.2560 3.972380 -4.908218      6.068849 
1 1 1 2   32 10 o 115.7972 2.887025 163.8208       8.146756 169.2719       12.31245 159.5759       10.86529 117.4371 4.309633 114.0929 3.913723 3.344177       5.821526 
1 1 1 2   32 11 o 47.32283 4.471979 27.71206       5.095944 20.44164       9.936300 30.30688       5.936068 39.52674 10.23554 49.41765 4.997872 -9.890915      11.39057 
1 1 1 2   32 12 o 110.6247 3.313410 149.8489       8.922236 166.6302       18.74044 144.9302       10.14590 115.8125 6.668505 108.7009 3.836212 7.111588       7.693210 
1 1 1 2   32 13 o 22.95917 7.571920 6.304182       4.914619 0.000000       0.000000 6.304182       4.914619 ?        ?        22.95917 7.571920 0.000000       7.571920 
1 1 1 2   32 14 o 110.1813 3.802873 149.0133       10.19540 0.000000       0.000000 149.0133       10.19540 ?        ?        110.1813 3.802873 0.000000       3.802873 
1 1 1 2   32 15 o 63.45385 4.054674 49.63626       6.236942 62.96733       12.45346 45.17309       7.205744 70.64518 7.340790 60.34691 4.943187 10.29827       8.849989 
1 1 1 2   32 16 o 77.45526 3.402463 73.68061       6.406480 88.13412       14.29373 70.04723       7.166627 83.68412 7.075408 75.42072 3.912690 8.263397       8.085205 
1 1 1 2   32 17 o 60.50065 4.412941 45.34048       6.461412 40.25726       11.14086 47.91698       7.931665 55.76941 8.463029 61.98533 5.301828 -6.215919      9.986603 
1 1 1 2   32 18 o 57.79475 4.187198 41.38114       5.857238 51.91530       11.60908 37.78383       6.784011 63.65074 7.636721 54.98326 5.122059 8.667480       9.195379 
1 1 1 2   32 19 o 91.24453 3.167720 102.3449       7.032836 96.68424       14.71668 104.0203       8.006197 87.21179 6.982961 91.87660 3.582767 -4.664810      7.848437 
1 1 1 2   32 20 o 22.34308 6.562682 6.439528       3.807859 11.37759       8.175913 5.071682       4.303050 29.62270 9.766132 20.67506 7.086913 8.947641       12.06655 
1 1 1 2   32 21 o 28.80680 5.417971 10.72215       3.663799 5.846779       8.360061 11.88112       4.076083 24.66614 9.626684 30.27116 5.735473 -5.605015      11.20574 
1 1 1 2   32 22 o 34.72013 4.506164 15.27300       3.722777 25.95490       9.176613 13.16868       4.072995 43.49268 8.956674 31.92313 5.429912 11.56956       10.47406 
1 1 1 2   32 23 o 42.10839 3.924721 22.24388       3.980919 19.35634       8.804746 22.98584       4.463162 36.85036 9.681145 42.67248 4.352881 -5.822121      10.61471 
1 1 1 2   32 24 o 24.87343 5.540273 8.197111       3.272050 16.17540       7.922680 6.556430       3.592769 33.50973 9.349324 22.16298 6.335169 11.34675       11.29355 
1 1 1 2   32 25 o 21.03250 5.738821 5.922687       3.022586 4.406555       7.559132 6.211232       3.297690 22.01196 8.963115 21.49811 6.044072 0.5138435      10.81056 
1 1 1 2   32 26 o 22.22854 5.394230 6.656729       2.891966 -0.5675642     5.369161 9.609177       3.432415 15.83434 7.016004 26.77504 5.446206 -10.94069      8.881749 
1 1 1 2   32 27 o 21.70723 5.852160 6.491178       3.165631 14.71003       9.165979 5.378075       3.373192 30.12787 10.34276 19.87540 6.248040 10.25247       12.08348 
1 1 1 2   32 28 o 15.91093 5.739287 3.093918       2.848005 5.434259       5.697745 2.314438       3.288259 20.62623 7.975858 15.30102 6.017925 5.325209       9.991484 
1 1 1 2   32 29 f 13.80675 5.608018 1.573219       2.950491 -2.377310      5.498564 3.170656       3.496500 14.32873 6.637079 16.40327 6.272412 -2.074535      9.132030 
1 1 1 2   32 30 o 22.76392 6.370247 7.714460       3.672218 6.715337       5.467297 8.535698       4.956758 21.07857 7.891971 23.23709 7.601195 -2.158516      10.95725 
1 1 1 2   32 31 o 13.38387 5.805936 0.6783182      3.506101 1.313434       5.459016 0.2323927      4.574243 16.09944 7.106696 14.40536 6.423742 1.694074       9.579645 
1 1 1 2   32 32 o 25.28994 5.840538 9.583296       3.526827 10.25495       6.039195 9.235682       4.344662 23.71113 8.379052 23.79181 7.015833 -0.8067894E-01 10.92842 
1 1 1 2   32 33 o 41.50044 3.779315 23.12163       3.780212 36.74931       7.194774 17.92507       4.442873 48.93479 6.170316 34.92834 5.393243 14.00645       8.195113 
1 1 1 2   32 34 o 13.07943 5.521020 1.573935       3.016207 -3.492978      5.678756 3.565068       3.559849 12.85511 6.182129 15.72466 6.237383 -2.869555      8.782008 
1 1 1 2   32 35 o 17.28985 6.392392 5.044700       3.565445 -2.152747      5.642917 9.827570       4.600009 13.14878 6.280283 22.73243 7.313881 -9.583648      9.640270 
1 1 1 2   32 36 o 13.90373 5.675131 2.601340       3.039248 1.613939       5.588092 3.016109       3.621758 14.68341 6.761922 14.65979 6.109627 0.2361774E-01  9.113240 
1 1 1 2   33 0  o 97.76207 2.990116 116.8666       7.115143 105.8625       10.29033 126.9467       9.848847 92.81719 4.563502 101.7588 3.979382 -8.941559      6.054835 
1 1 1 2   33 1  o 74.86845 3.250146 68.63850       5.915644 68.06297       8.579833 69.16003       8.167367 74.34182 4.761001 74.98459 4.490222 -0.6427689     6.544405 
1 1 1 2   33 2  o 146.5721 3.366134 262.6488       12.02316 254.7883       16.36982 271.8559       17.71656 144.0639 4.669029 148.7614 4.893784 -4.697464      6.763797 
1 1 1 2   33 3  o 85.27039 3.488231 89.06624       7.233054 76.42286       12.65679 95.19788       8.814149 78.39585 6.688962 88.07140 4.118259 -9.675545      7.855080 
1 1 1 2   33 4  o 105.6741 3.373649 136.6772       8.676561 140.6404       16.81172 135.2383       10.12993 106.5554 6.505417 105.0259 3.965105 1.529510       7.618564 
1 1 1 2   33 5  o 182.3273 3.729872 406.8246       16.57226 367.7845       31.20013 422.1678       19.55956 172.0848 7.457790 185.5944 4.324721 -13.50966      8.621012 
1 1 1 2   33 6  o 62.99433 3.372116 48.66696       5.157681 49.50546       7.517826 47.92136       7.089160 63.30888 4.911332 62.31715 4.702926 0.9917297      6.799904 
1 1 1 2   33 7  o 161.3521 3.477565 318.5133       13.67370 327.7143       25.91914 314.9651       16.09575 162.6982 6.550742 160.2661 4.124718 2.432098       7.741157 
1 1 1 2   33 8  o 96.19701 2.947644 113.2078       6.901763 109.0202       10.09871 116.8779       9.454262 94.16343 4.413241 97.58495 3.984032 -3.421524      5.945520 
1 1 1 2   33 9  o 125.1793 2.892735 191.5298       8.824237 184.5990       13.13537 197.2305       11.91274 122.5628 4.405087 126.8157 3.859296 -4.252983      5.856531 
1 1 1 2   33 10 o 98.96124 2.889232 119.8237       6.960146 135.4690       10.80420 108.7246       9.100008 104.9859 4.231713 94.08453 3.978035 10.90138       5.807939 
1 1 1 2   33 11 o 35.42201 6.605492 16.04662       5.492136 0.000000       0.000000 16.04662       5.492136 ?        ?        35.42201 6.605492 0.000000       6.605492 
1 1 1 2   33 12 f 56.10268 4.617740 38.97676       6.257355 0.000000       0.000000 38.97676       6.257355 ?        ?        56.10268 4.617740 0.000000       4.617740 
1 1 1 2   33 13 o 62.70980 3.685208 48.40123       5.606799 56.29760       11.22822 45.77824       6.471365 66.82885 6.998288 60.85059 4.393690 5.978264       8.263204 
1 1 1 2   33 14 o 148.9819 3.462251 272.2076       12.56980 274.1498       25.73738 271.5993       14.40454 147.7866 7.167874 148.6083 3.981178 -0.8217468     8.199280 
1 1 1 2   33 15 o 161.5702 3.531515 320.4690       13.90460 334.6613       29.06451 316.2567       15.83415 162.9529 7.338047 160.2636 4.057638 2.689362       8.385187 
1 1 1 2   33 16 o 62.02262 4.086043 47.59879       6.141341 58.79242       12.35387 43.92453       7.077868 67.77323 7.611523 59.35863 4.937754 8.414597       9.072855 
1 1 1 2   33 17 o 52.30062 4.536507 34.09724       5.724692 36.01675       10.24791 33.22654       6.902015 52.46220 8.291072 51.31989 5.610208 1.142311       10.01081 
1 1 1 2   33 18 o 45.89927 4.394993 26.32543       4.855887 28.10671       9.391418 25.67543       5.673085 45.90678 8.713582 45.08250 5.262749 0.8242760      10.17954 
1 1 1 2   33 19 o 56.76219 3.634033 39.92355       5.000310 34.06922       10.41521 41.67712       5.700208 50.41915 8.796653 57.88018 4.067225 -7.461037      9.691410 
1 1 1 2   33 20 o 15.49372 6.032134 2.015534       3.276046 4.513076       7.300437 1.385780       3.665879 22.57602 8.939523 15.36038 6.246600 7.215640       10.90574 
1 1 1 2   33 21 o 78.35945 3.187974 75.93775       6.074835 98.50751       13.81467 70.52722       6.763900 87.28073 6.542721 75.31931 3.696437 11.96143       7.514709 
1 1 1 2   33 22 o 47.91341 3.773039 28.74482       4.369868 26.76295       9.501465 29.27649       4.921228 43.49036 9.249990 48.19173 4.233470 -4.701370      10.17274 
1 1 1 2   33 23 o 52.56458 3.532255 34.55780       4.498346 47.77920       10.62935 31.67324       4.964864 59.37994 7.513599 50.08678 4.103640 9.293159       8.561193 
1 1 1 2   33 24 o 14.07940 5.717890 1.324946       3.066686 -0.4255488     7.392368 1.688821       3.370384 18.51256 8.215968 14.97723 6.025843 3.535328       10.18886 
1 1 1 2   33 25 f 15.36231 5.811594 2.483684       2.981693 12.02153       7.477822 0.6805594      3.251344 28.22403 9.341352 13.58229 5.732678 14.64174       10.96013 
1 1 1 2   33 26 o 14.04387 5.785703 1.279041       3.196222 0.000000       0.000000 1.279041       3.196222 ?        ?        14.04387 5.785703 0.000000       5.785703 
1 1 1 2   33 27 o 23.35046 5.608204 7.607885       3.151029 11.63966       5.975995 6.055290       3.708441 27.31870 8.269640 20.65242 6.558780 6.666271       10.55484 
1 1 1 2   33 28 o 11.29690 5.239542 -2.074293      3.443569 4.260696       5.350632 -6.553512      4.499179 18.86874 7.592113 10.84288 5.282126 8.025860       9.248839 
1 1 1 2   33 29 o 16.04268 6.463528 2.746607       3.883640 4.842527       5.510477 0.6781195      5.474295 19.21624 7.714135 15.90306 7.063334 3.313179       10.45938 
1 1 1 2   33 30 o 34.24209 4.337177 15.83019       3.538061 24.01276       6.933049 12.94888       4.114092 38.78074 7.608105 29.75953 5.881585 9.021214       9.616460 
1 1 1 2   33 31 o 36.09114 4.550476 17.97359       3.913372 32.81696       7.008682 11.24960       4.717189 46.54140 6.344635 26.11084 7.187355 20.43056       9.587099 
1 1 1 2   33 32 o 38.54188 4.681708 20.92998       4.307099 15.63578       6.596365 24.86465       5.686684 28.17994 8.718721 40.48400 5.940857 -12.30407      10.55035 
1 1 1 2   33 33 o 19.61766 6.124123 6.306996       3.246464 15.82995       6.511538 3.156792       3.745133 27.58066 8.682367 15.36083 6.288357 12.21983       10.72040 
1 1 1 2   33 34 o 20.75905 6.571505 7.568840       3.725442 10.54642       6.108645 5.805551       4.700836 21.87873 8.308765 17.97153 7.154936 3.907204       10.96488 
1 1 1 2   33 35 o 7.190346 3.611243 -6.905761      2.789978 -0.6723086     5.450472 -9.118942      3.247717 13.45645 6.352633 7.368507 3.724948 6.087938       7.364183 
1 1 1 2   34 0  o 91.14037 3.014345 101.6497       6.685624 103.4811       9.968023 100.1521       9.013648 91.72261 4.473095 90.29881 4.106964 1.423805       6.072540 
1 1 1 2   34 1  o 42.50840 4.170255 22.36307       4.264363 27.17549       6.352551 18.41574       5.753318 46.61858 5.710955 38.09655 6.425577 8.522038       8.596688 
1 1 1 2   34 2  o 134.4727 3.036143 221.0704       9.949300 227.7055       15.27533 216.1816       13.11200 136.1020 4.612303 132.7421 4.058211 3.359940       6.143486 
1 1 1 2   34 3  o 111.3026 2.998075 151.5563       8.124344 156.8959       12.19991 147.3015       10.89040 112.9780 4.439900 109.5376 4.087018 3.440331       6.034603 
1 1 1 2   34 4  o 63.98700 3.576194 50.28341       5.554150 42.96669       7.263583 60.58461       8.618602 58.87678 5.113219 69.99222 5.087758 -11.11544      7.213202 
1 1 1 2   34 5  o 10.45842 4.977138 -4.431703      3.477950 -0.2901235     4.597106 -9.975104      5.318506 15.58209 6.703264 11.61301 5.675926 3.969082       8.783501 
1 1 1 2   34 6  o 70.59662 3.368021 61.14089       5.777506 65.17616       7.968455 56.66843       8.389013 72.70130 4.520115 67.65132 5.126768 5.049980       6.834851 
1 1 1 2   34 7  o 151.1338 3.485299 279.7363       12.83624 296.7563       25.99324 274.2471       14.76179 154.3613 6.927777 149.4547 4.056909 4.906616       8.028238 
1 1 1 2   34 8  o 43.61906 5.881489 23.93994       6.092562 0.000000       0.000000 23.93994       6.092562 ?        ?        43.61906 5.881489 0.000000       5.881489 
1 1 1 2   34 9  o 57.16495 4.545038 40.44822       6.279365 0.000000       0.000000 40.44822       6.279365 ?        ?        57.16495 4.545038 0.000000       4.545038 
1 1 1 2   34 10 o 90.03529 3.941254 99.72694       8.626405 0.000000       0.000000 99.72694       8.626405 ?        ?        90.03529 3.941254 0.000000       3.941254 
1 1 1 2   34 11 o 65.25864 4.270601 52.61790       6.754143 68.15068       12.27796 45.87784       8.087857 73.53899 6.933111 60.62259 5.535752 12.91640       8.872011 
1 1 1 2   34 12 o 99.90909 3.383598 122.5780       8.226077 118.9593       15.82770 123.9172       9.628658 97.31575 6.715367 100.3137 3.946549 -2.997986      7.789186 
1 1 1 2   34 13 o 56.91753 3.911399 40.04361       5.392199 25.00586       9.997762 46.21232       6.403369 43.23429 9.725589 61.06950 4.330867 -17.83521      10.64629 
1 1 1 2   34 14 o 95.36009 3.935273 112.2130       9.125221 103.5958       15.27487 116.9950       11.37889 90.39854 6.988160 97.06932 4.825538 -6.670784      8.492361 
1 1 1 2   34 15 f 111.0338 3.322353 151.6681       8.979417 153.3496       18.20768 151.1277       10.32194 109.9748 6.827673 110.6604 3.833445 -0.6856842     7.830225 
1 1 1 2   34 16 o 41.70249 5.110820 21.97869       5.085395 25.30860       9.473147 20.63059       6.027525 43.25433 9.266263 39.98433 6.401952 3.270000       11.26271 
1 1 1 2   34 17 o 62.91187 4.032419 49.19446       6.149527 55.01943       11.34967 46.77374       7.316583 65.16926 7.270367 61.02913 4.962446 4.140129       8.802505 
1 1 1 2   34 18 o 52.40486 3.879105 34.20802       4.918687 30.09455       10.08182 35.49297       5.634799 46.90042 9.149834 53.22719 4.382992 -6.326771      10.14545 
1 1 1 2   34 19 o 30.31799 5.571473 11.97224       3.964654 11.25901       8.488001 12.17127       4.483836 29.04124 9.953442 30.34642 6.270748 -1.305180      11.76407 
1 1 1 2   34 20 o 17.53424 6.335851 3.454203       3.472696 5.215250       7.362634 2.950331       3.938289 22.89486 9.004830 17.40548 6.656584 5.489386       11.19808 
1 1 1 2   34 21 o 15.11979 5.981718 1.850454       3.265983 16.64662       7.653084 -1.444231      3.611344 34.02736 9.066435 12.49996 5.630274 21.52740       10.67241 
1 1 1 2   34 22 o 52.41576 3.651328 34.50312       4.634735 28.53877       9.726865 36.25502       5.271651 44.21907 9.320932 53.54536 4.070570 -9.326286      10.17100 
1 1 1 2   34 23 o 18.25914 6.195525 4.253395       3.287223 -1.704734      7.906004 5.498728       3.614471 18.24206 8.262708 20.27119 6.479370 -2.029133      10.50022 
1 1 1 2   34 24 o 20.99290 6.440424 6.073537       3.608578 0.000000       0.000000 6.073537       3.608578 ?        ?        20.99290 6.440424 0.000000       6.440424 
1 1 1 2   34 25 o 24.19972 7.837034 8.675604       5.276093 0.000000       0.000000 8.675604       5.276093 ?        ?        24.19972 7.837034 0.000000       7.837034 
1 1 1 2   34 26 o 16.18336 6.461225 2.645900       3.844200 0.8706524      7.510598 3.276061       4.474773 18.35990 8.206189 17.44534 6.969040 0.9145641      10.76611 
1 1 1 2   34 27 o 11.70526 5.415514 -1.973621      3.644830 -5.160768      6.402584 -0.4455380     4.433306 14.06281 6.709352 14.00228 6.278162 0.6052303E-01  9.188620 
1 1 1 2   34 28 o 22.07186 5.857375 7.120672       3.202324 9.294936       5.897905 6.211726       3.813385 23.64811 8.286740 20.35381 6.667661 3.294302       10.63615 
1 1 1 2   34 29 o 40.04552 4.269148 21.57060       4.101952 27.79367       7.068304 18.41050       5.036895 42.32335 7.104800 35.37926 6.060091 6.944084       9.338248 
1 1 1 2   34 30 o 25.35440 5.617250 9.552013       3.379246 23.79632       6.485193 4.242996       3.959218 38.45578 7.184421 17.23594 6.652961 21.21984       9.791720 
1 1 1 2   34 31 o 12.18261 5.374193 0.3778625      3.116965 4.149561       5.999957 -1.016286      3.647826 17.57916 7.610579 11.85842 5.461816 5.720747       9.367622 
1 1 1 2   34 32 o 24.95368 6.525600 10.41374       4.012444 13.33967       6.557569 8.662693       5.072939 24.80830 8.734352 21.28282 7.662026 3.525478       11.61876 
1 1 1 2   34 33 o 29.18082 5.989204 13.70634       4.116117 17.38116       6.742647 11.52337       5.196810 28.08346 8.834345 24.06090 7.776762 4.022566       11.76961 
1 1 1 2   35 0  o 32.02490 5.277660 12.97221       3.975400 6.960037       5.341172 20.43944       5.952511 24.00871 7.892509 40.14788 6.290627 -16.13917      10.09275 
1 1 1 2   35 1  o 52.89547 3.414048 34.41072       4.377221 34.11583       6.423993 34.66629       5.980433 52.36974 5.098171 52.87670 4.689810 -0.5069618     6.927169 
1 1 1 2   35 2  o 76.38060 3.066579 71.50336       5.696257 65.10905       8.073723 77.84097       8.037844 72.61089 4.586279 79.50735 4.163053 -6.896469      6.193946 
1 1 1 2   35 3  o 51.20985 3.578408 32.29810       4.437495 33.08115       6.381107 31.56479       6.175093 51.54069 5.149398 50.34378 5.103849 1.196911       7.250212 
1 1 1 2   35 4  o 120.0090 2.951576 176.2174       8.631850 174.1864       13.01024 177.8145       11.53672 118.9055 4.498119 120.2924 3.940892 -1.386909      5.980276 
1 1 1 2   35 5  o 32.51642 4.982831 13.33041       3.822708 14.67574       5.448067 12.02573       5.365137 33.73520 6.860993 30.42266 7.325034 3.312542       10.03640 
1 1 1 2   35 6  o 48.72992 3.724831 29.30721       4.389695 24.58628       6.203142 34.04285       6.212800 44.15189 5.913951 52.30627 4.932369 -8.154388      7.700849 
1 1 1 2   35 7  o 50.47740 4.560938 31.64333       5.549847 31.72695       8.177722 31.57194       7.556388 49.95097 6.902476 49.98566 6.346302 -0.3469086E-01 9.376552 
1 1 1 2   35 8  o 77.73531 3.824928 74.42186       7.223407 73.62801       10.96093 75.03131       9.603926 76.75655 5.905342 77.73446 5.098032 -0.9779053     7.801474 
1 1 1 2   35 9  o 70.65276 3.311887 61.36267       5.686308 62.01847       7.616896 60.53703       8.546445 70.78423 4.438094 69.76675 5.061324 1.017479       6.731544 
1 1 1 2   35 10 o 88.92712 3.724492 97.40466       8.053316 83.93063       11.98230 108.5057       10.87610 81.80280 6.053752 93.54424 4.787037 -11.74144      7.717748 
1 1 1 2   35 11 o 21.89060 7.511585 5.647178       4.834550 -2.588619      8.019830 10.34849       6.059291 18.98893 8.484110 28.15721 8.280677 -9.168276      11.85537 
1 1 1 2   35 12 o 75.97678 3.579984 71.19074       6.609596 76.56257       13.41216 69.46770       7.596024 77.42937 7.190306 74.88643 4.179007 2.542946       8.316526 
1 1 1 2   35 13 o 21.92952 7.096053 5.991024       4.326094 0.2581434      8.030207 8.335210       5.134951 20.55178 8.850516 25.35399 7.663690 -4.802206      11.70742 
1 1 1 2   35 14 o 56.03670 4.662514 39.28802       6.309280 34.88992       10.54862 41.73779       7.872716 51.12899 8.782620 57.40664 5.702972 -6.277641      10.47179 
1 1 1 2   35 15 o 24.68474 7.084733 8.018127       4.484432 8.005616       7.695080 8.024561       5.518351 26.00767 9.426771 24.94804 8.009229 1.059624       12.36979 
1 1 1 2   35 16 o 120.0511 3.354524 178.0467       9.804088 181.1617       19.77802 177.0319       11.28866 118.5389 6.876287 119.4301 3.883920 -0.8912048     7.897351 
1 1 1 2   35 17 o 81.10728 3.874315 81.90089       7.635427 61.43601       12.75502 93.33006       9.531988 67.98904 7.842021 86.24974 4.551237 -18.26070      9.067032 
1 1 1 2   35 18 o 43.99175 4.329000 24.44670       4.580767 32.22636       9.840976 22.29482       5.175663 48.28716 8.682326 41.66285 5.211457 6.624310       10.12631 
1 1 1 2   35 19 o 124.2374 4.491233 194.6691       13.57497 189.2925       20.36097 198.9715       18.21380 119.6354 7.014750 123.9117 6.050160 -4.276291      9.263432 
1 1 1 2   35 20 o 12.58187 5.596815 -0.9022235     3.450452 -0.3085837     6.399457 -1.145538      4.096993 17.52741 7.717475 13.57410 6.064440 3.953316       9.815134 
1 1 1 2   35 21 o 46.10008 5.061300 27.62553       5.592513 28.01490       9.386622 27.41125       6.963347 43.58350 9.130778 45.01930 6.538246 -1.435806      11.23031 
1 1 1 2   35 22 o 13.45399 6.025515 -1.037501      4.071154 -3.753547      7.855599 -0.4015128E-01 4.760303 17.06626 7.914802 15.27663 6.693461 1.789633       10.36564 
1 1 1 2   35 23 o 17.49167 7.182901 2.582146       4.905683 0.000000       0.000000 2.582146       4.905683 ?        ?        17.49167 7.182901 0.000000       7.182901 
1 1 1 2   35 24 o 35.63766 5.692657 17.44657       4.777530 26.40913       9.287022 14.22115       5.571256 40.13653 9.620439 30.85439 7.486748 9.282135       12.19033 
1 1 1 2   35 25 o 61.43858 5.744443 52.13850       8.500819 52.76514       11.79401 51.46095       12.26369 57.87474 8.625561 56.20102 9.277954 1.673721       12.66810 
1 1 1 2   35 26 o 17.06465 6.178510 3.872750       3.304456 9.326422       7.307583 2.470935       3.704884 23.72482 9.068900 15.63554 6.308237 8.089280       11.04712 
1 1 1 2   35 27 o 19.35623 6.396578 5.549860       3.506721 8.103914       7.954441 4.933738       3.906860 22.27123 9.146154 18.53175 6.716939 3.739475       11.34766 
1 1 1 2   35 28 o 11.81003 5.375984 -0.8955308     3.398312 2.918574       7.272733 -1.960913      3.843741 18.18706 8.105642 11.79759 5.493436 6.389468       9.791796 
1 1 1 2   35 29 o 19.15558 6.315428 5.739875       3.418974 15.96103       8.221054 3.602365       3.759513 27.02370 9.750623 16.33963 6.432188 10.68407       11.68108 
1 1 1 2   35 30 f 50.24889 4.329408 34.97566       5.249762 28.66135       7.641384 40.62011       7.224696 40.02000 8.113408 51.77690 5.826998 -11.75690      9.989058 
1 1 1 2   35 31 o 42.87331 4.599847 26.21965       4.730753 30.75563       7.463815 23.17375       6.116220 41.72572 7.621162 36.97281 7.045510 4.752911       10.37889 
1 1 1 2   35 32 o 47.26979 4.228241 31.49174       4.819188 33.82438       7.548663 29.88693       6.261195 43.68515 7.351671 43.06438 6.139952 0.6207733      9.578418 
1 1 1 2   36 0  o 67.04700 3.301085 55.25460       5.376935 52.30186       7.757638 57.98466       7.459396 64.87241 4.944445 68.43642 4.497739 -3.564003      6.684100 
1 1 1 2   36 1  o 68.75879 3.416832 58.14419       5.707229 56.86266       7.857235 59.57552       8.303742 67.69150 4.794228 69.25336 4.953063 -1.561867      6.893290 
1 1 1 2   36 2  o 17.38412 6.545453 2.834892       3.772130 4.305730       4.929059 0.7559009      5.860140 20.45990 7.524479 18.28654 7.706046 2.173359       10.77037 
1 1 1 2   36 3  o 29.12991 5.772962 10.90283       3.953125 11.67127       5.573822 10.12508       5.607456 29.85623 7.632532 27.90166 7.894415 1.954573       10.98077 
1 1 1 2   36 4  o 67.17396 3.646915 55.60527       5.947451 67.59560       11.23294 50.93465       7.010761 73.29292 6.351844 64.08671 4.518075 9.206207       7.794801 
1 1 1 2   36 5  o 80.38112 3.391182 79.46325       6.627725 66.19457       11.15332 86.70634       8.240475 72.47794 6.379886 83.80882 4.046801 -11.33088      7.555100 
1 1 1 2   36 6  o 76.86948 3.086154 72.58706       5.769311 83.00026       8.642608 64.21698       7.748499 81.88879 4.346529 71.97578 4.439291 9.913010       6.212860 
1 1 1 2   36 7  o 53.88801 3.493263 35.84269       4.562605 36.59699       6.470992 35.09695       6.434162 54.10683 4.962984 52.95452 5.046972 1.152313       7.078357 
1 1 1 2   36 8  f 50.82568 3.567278 31.93507       4.390253 25.82312       6.041293 38.77501       6.390962 45.17301 5.608410 55.73872 4.750371 -10.56571      7.349850 
1 1 1 2   36 9  o 106.2596 2.911399 138.6331       7.531763 129.9467       10.85488 146.6977       10.45918 102.3882 4.360484 108.9643 3.945432 -6.576103      5.880498 
1 1 1 2   36 10 o 24.24621 5.941564 7.667373       3.482693 5.440568       4.583228 10.71004       5.357447 21.36075 7.314232 28.43697 7.589726 -7.076218      10.54049 
1 1 1 2   36 11 f 102.9810 4.805899 132.3003       12.02731 0.000000       0.000000 132.3003       12.02731 ?        ?        102.9810 4.805899 0.000000       4.805899 
1 1 1 2   36 12 o 46.00416 4.677954 26.61906       5.171458 33.56302       9.944929 24.04540       6.054434 50.13901 8.438735 43.30443 5.889780 6.834583       10.29086 
1 1 1 2   36 13 o 12.36396 5.941586 -7.192964      5.223393 -9.948895      7.065065 -3.870471      7.757361 14.19194 6.842831 17.71377 8.086077 -3.521832      10.59287 
1 1 1 2   36 14 o 39.76213 5.835114 20.44357       5.485862 20.36383       9.144183 20.48841       6.856872 37.97162 9.812098 39.13613 7.461998 -1.164505      12.32715 
1 1 1 2   36 15 o 76.02518 4.170684 72.31182       7.697221 84.45385       13.12725 65.94998       9.502100 80.53362 6.751067 71.92494 5.462147 8.608681       8.684006 
1 1 1 2   36 16 o 32.98554 6.836196 14.64247       5.314391 26.20882       9.052154 8.559169       6.564828 43.24123 8.887738 25.50874 8.753166 17.73248       12.47437 
1 1 1 2   36 17 o 40.57379 5.703601 21.51097       5.483900 26.29936       9.386758 19.02981       6.756918 42.80990 9.266973 37.12616 7.720461 5.683735       12.06161 
1 1 1 2   36 18 o 46.31020 5.125763 27.73685       5.687852 31.39339       9.927464 25.95000       6.939820 46.69303 9.051517 43.91371 6.696597 2.779316       11.25941 
1 1 1 2   36 19 o 19.72880 7.357998 4.567869       4.743193 -0.4652538     7.849893 7.462195       5.952765 18.90689 8.424134 23.56490 8.319644 -4.658014      11.83987 
1 1 1 2   36 20 o 18.36679 7.522379 2.794377       5.362327 11.43349       7.791917 -4.978409      7.390914 27.59561 9.533537 16.00823 7.507239 11.58738       12.13454 
1 1 1 2   36 21 o 33.82386 6.121426 15.74829       4.859889 0.000000       0.000000 15.74829       4.859889 ?        ?        33.82386 6.121426 0.000000       6.121426 
1 1 1 2   36 22 o 12.44156 5.515060 -0.4706672     3.321119 -0.2664377     7.060688 -0.5286892     3.763433 17.55031 7.891606 13.15813 5.849623 4.392176       9.823214 
1 1 1 2   36 23 o 20.45861 6.406641 5.995557       3.550023 12.61800       7.367900 3.993306       4.051296 27.44245 9.275718 17.88702 6.772531 9.555429       11.48504 
1 1 1 2   36 24 o 31.67280 5.238750 13.82262       3.902202 22.02482       8.535671 11.65543       4.387542 35.57196 9.618013 28.14961 6.523757 7.422356       11.62177 
1 1 1 2   36 25 o 58.42131 3.580687 44.13255       5.073205 56.94564       11.41985 40.98209       5.662656 60.13284 7.990742 55.69024 4.203619 4.442600       9.028974 
1 1 1 2   36 26 f 13.32246 5.719186 0.8721414      3.333189 1.635107       7.275068 0.6694303      3.749932 17.73378 7.989160 13.70599 5.974344 4.027796       9.975945 
1 1 1 2   36 27 o 15.19296 6.242008 2.459943       3.707002 1.935688       7.344094 2.639181       4.294190 17.54002 7.952271 15.86755 6.635762 1.672474       10.35722 
1 1 1 2   36 28 o 15.60281 6.167433 3.174893       3.469155 9.358532       7.774589 1.637576       3.876477 21.71803 8.992714 14.34633 6.163345 7.371703       10.90210 
1 1 1 2   36 29 o 31.28236 6.400046 15.64579       4.714262 23.30995       9.356624 13.03825       5.457613 30.55272 10.45094 26.47570 7.877541 4.077026       13.08731 
1 1 1 2   36 30 o 34.37095 5.942480 18.50734       4.797304 17.08610       9.537376 18.98872       5.550596 24.55976 10.04236 33.31179 7.057371 -8.752028      12.27418 
1 1 1 2   36 31 o 11.44240 5.271592 -0.6868520     3.401323 4.659893       8.058487 -1.845860      3.751906 17.49597 8.079698 11.19164 5.279548 6.304329       9.651690 
1 1 1 2   37 0  o 78.61777 3.237743 76.06062       6.189690 80.90847       12.37266 74.44232       7.148531 79.96722 6.402593 77.63354 3.790057 2.333679       7.440278 
1 1 1 2   37 1  o 55.15629 3.722537 37.64272       4.974149 39.58871       9.605743 36.92971       5.814433 55.42394 7.288565 54.45929 4.419204 0.9646530      8.523646 
1 1 1 2   37 2  o 28.08939 6.165657 10.27205       4.104442 6.045599       7.182681 12.32132       5.001473 24.10084 9.041106 30.65351 6.866326 -6.552666      11.35289 
1 1 1 2   37 3  o 54.86316 3.641765 37.23417       4.841318 40.47154       7.072448 34.37957       6.641196 56.79089 5.166913 52.27060 5.286364 4.520287       7.392066 
1 1 1 2   37 4  o 66.75361 3.659198 55.07063       5.929698 49.07415       7.499950 65.06895       9.684425 62.63044 4.954348 71.93838 5.567601 -9.307934      7.452767 
1 1 1 2   37 5  o 116.6418 3.338973 167.5297       9.481044 175.2118       12.99701 158.7922       13.86111 118.7846 4.498135 112.7942 5.055689 5.990402       6.767068 
1 1 1 2   37 6  o 24.90592 6.561108 8.137830       4.036906 6.927460       4.883148 10.75091       7.174925 23.40787 7.536020 28.65242 9.125699 -5.244547      11.83512 
1 1 1 2   37 7  o 31.30149 4.885448 12.48245       3.604870 14.34952       5.010292 10.47859       5.190600 33.15083 6.434111 28.07720 7.460116 5.073637       9.851452 
1 1 1 2   37 8  o 47.67678 3.623486 28.22416       4.178350 22.18603       5.593291 35.84858       6.285203 41.65140 5.656695 53.38492 4.885407 -11.73352      7.474316 
1 1 1 2   37 9  o 52.84460 3.453343 34.61024       4.422731 32.47339       5.980901 37.18869       6.569879 50.74688 4.897148 54.28967 5.022907 -3.542793      7.015102 
1 1 1 2   37 10 o 60.65075 3.492289 45.60604       5.139754 45.67075       6.481221 45.49640       8.436996 60.37800 4.435925 59.65380 5.880189 0.7242050      7.365736 
1 1 1 2   37 11 o 47.87544 8.340919 31.01366       9.377645 31.01366       9.377645 0.000000       0.000000 47.87544 8.340919 ?        ?        0.000000       8.340919 
1 1 1 2   37 12 o 35.98433 5.492912 16.75313       4.664327 22.96596       9.039677 14.49886       5.445173 40.37454 9.369015 32.86199 7.013265 7.512550       11.70318 
1 1 1 2   37 13 o 21.06638 6.921678 5.678512       4.108197 12.10630       7.623285 3.047790       4.876956 29.45845 9.409171 18.58615 7.323108 10.87230       11.92310 
1 1 1 2   37 14 o 58.71643 4.523676 43.64577       6.422859 50.37954       10.85269 40.01585       7.968129 61.27186 7.419371 55.43275 5.993887 5.839108       9.538016 
1 1 1 2   37 15 o 20.52589 6.826996 5.432487       3.992806 16.97565       7.713693 1.207671       4.666635 34.21547 9.095750 16.43775 6.898777 17.77772       11.41603 
1 1 1 2   37 16 o 37.40257 5.002519 18.16969       4.445369 19.00815       8.590216 17.86303       5.195082 35.59846 9.658681 36.58710 6.037156 -0.9886322     11.39023 
1 1 1 2   37 17 o 59.87856 4.354825 45.76153       6.311020 31.11186       10.09949 55.14668       8.083624 45.70310 9.382647 65.20287 5.128746 -19.49977      10.69290 
1 1 1 2   37 18 o 17.95354 6.656314 3.779519       3.870771 5.706591       8.312521 3.245970       4.373920 22.91774 9.373670 17.79463 6.957864 5.123112       11.67380 
1 1 1 2   37 19 o 24.85799 6.303284 8.675123       3.823121 6.108891       8.212456 9.385137       4.319747 22.82225 9.323770 25.64191 6.802154 -2.819662      11.54132 
1 1 1 2   37 20 o 41.26897 5.185100 22.78909       5.099731 0.000000       0.000000 22.78909       5.099731 ?        ?        41.26897 5.185100 0.000000       5.185100 
1 1 1 2   37 21 o 13.23993 5.770465 0.1764942      3.497418 -3.398319      7.664081 1.116732       3.930539 16.42896 7.685220 14.74189 6.266086 1.687070       9.915969 
1 1 1 2   37 22 o 31.11825 5.514235 13.46605       4.028487 25.83078       8.365875 9.733407       4.596498 39.89975 8.837207 25.33106 7.140667 14.56868       11.36157 
1 1 1 2   37 23 o 25.02443 6.272091 9.227872       3.816928 14.25826       7.830610 7.660212       4.371405 28.06146 9.561661 22.36387 7.123113 5.697582       11.92326 
1 1 1 2   37 24 o 31.15592 5.360600 13.68073       3.923204 18.08213       9.139784 12.68660       4.343729 29.94673 10.32615 29.25116 6.281373 0.6955757      12.08656 
1 1 1 2   37 25 o 18.29134 6.810989 4.897253       4.061003 15.55411       8.105062 1.325114       4.692518 27.77488 9.715675 15.23246 6.660565 12.54242       11.77954 
1 1 1 2   37 26 o 17.77417 6.708660 4.696235       3.968009 -1.485109      6.957773 7.675702       4.830567 15.46022 7.260918 21.26821 7.495775 -5.807987      10.43588 
1 1 1 2   37 27 o 11.71962 5.523486 -2.306594      4.089365 -14.28860      7.248742 3.287112       4.952763 11.63464 5.840223 16.48532 7.021432 -4.850686      9.132836 
1 1 1 2   37 28 o 13.45190 6.038204 0.5418362      4.113645 11.89222       8.138406 -3.353233      4.767510 22.53670 9.252824 11.97384 5.733548 10.56286       10.88523 
1 1 1 2   37 29 o 22.94231 6.282082 8.756458       3.614538 7.751045       9.140344 8.942829       3.935314 19.34689 8.810655 22.74309 6.669283 -3.396198      11.05020 
1 1 1 2   38 0  o 114.6347 3.261067 162.0631       9.100608 178.6231       12.91199 145.7158       12.82882 119.7507 4.432301 107.8843 4.892424 11.86636       6.601598 
1 1 1 2   38 1  o 103.6309 2.966679 132.1998       7.484255 141.5675       11.25327 124.7698       10.02207 106.6297 4.339830 100.2036 4.113032 6.426102       5.979228 
1 1 1 2   38 2  o 15.06261 5.916471 1.787412       3.174748 2.564895       4.580365 1.068536       4.404349 17.92704 7.086511 16.20559 6.744340 1.721447       9.782881 
1 1 1 2   38 3  o 43.01516 3.773990 23.07095       3.915976 17.85993       5.859122 27.27798       5.264527 36.84976 6.774275 46.52206 4.708454 -9.672306      8.249869 
1 1 1 2   38 4  o 71.22276 3.117241 62.61346       5.397245 61.55552       7.766732 63.60146       7.505674 70.10195 4.571383 71.35830 4.336751 -1.256348      6.301186 
1 1 1 2   38 5  o 15.02308 5.944268 1.710447       3.225623 -2.597854      4.328457 7.091177       4.837275 13.15587 6.018607 23.43247 7.496291 -10.27660      9.613428 
1 1 1 2   38 6  o 27.33650 5.516152 9.753778       3.547788 11.04263       4.790812 8.188664       5.279350 28.72699 6.925120 24.93386 7.813453 3.793127       10.44066 
1 1 1 2   38 7  o 61.36261 3.255667 46.63676       4.850906 49.29371       6.928468 44.08198       6.793945 62.60561 4.572918 59.11058 4.756639 3.495037       6.598272 
1 1 1 2   38 8  o 66.21085 4.516458 55.14381       7.243611 55.14381       7.243611 0.000000       0.000000 66.21085 4.516458 ?        ?        0.000000       4.516458 
1 1 1 2   38 9  o 68.19362 3.885644 58.08718       6.430456 57.93610       7.251438 58.64337       13.91317 67.86729 4.408431 65.23553 8.990801 2.631752       10.01343 
1 1 1 2   38 10 o 21.75724 6.346207 6.278473       3.571574 5.422470       4.240882 8.366715       6.623828 20.76002 7.037137 25.30638 8.787514 -4.546360      11.25796 
1 1 1 2   38 11 o 38.22669 6.797128 19.61903       6.099773 18.05962       7.577446 22.48990       10.28131 35.63298 8.783359 38.73566 10.59031 -3.102684      13.75871 
1 1 1 2   38 12 o 53.89131 4.742534 37.08052       6.164772 28.78192       9.274461 43.64948       8.251527 45.03867 8.765703 57.77827 5.945242 -12.73960      10.59167 
1 1 1 2   38 13 o 29.82617 7.080581 12.32601       5.068988 5.930474       7.512436 17.67149       6.868084 23.11702 9.094831 35.24552 8.157898 -12.12849      12.21750 
1 1 1 2   38 14 o 47.74837 5.175029 29.67279       5.925389 0.000000       0.000000 29.67279       5.925389 ?        ?        47.74837 5.175029 0.000000       5.175029 
1 1 1 2   38 15 o 37.78858 5.024896 18.70166       4.512677 23.39548       8.854770 17.05483       5.244906 39.28234 9.379839 35.37479 6.316023 3.907555       11.30812 
1 1 1 2   38 16 o 24.00596 6.765250 8.128385       4.126478 8.900495       8.034279 7.851725       4.809278 25.15089 9.534024 23.51429 7.469254 1.636600       12.11146 
1 1 1 2   38 17 o 17.81446 6.568222 3.864154       3.759808 -0.6365253     7.186268 5.560464       4.411811 17.65101 7.947074 20.33864 7.163907 -2.687628      10.69942 
1 1 1 2   38 18 o 17.30889 6.858033 3.147451       4.298975 0.000000       0.000000 3.147451       4.298975 ?        ?        17.30889 6.858033 0.000000       6.858033 
1 1 1 2   38 19 o 56.28822 4.499415 41.61248       6.120422 40.59830       10.70995 42.10432       7.458267 50.60347 9.015635 55.56897 5.583270 -4.965504      10.60446 
1 1 1 2   38 20 o 14.41220 6.261031 0.5960501      4.089384 -1.476634      6.423180 2.008839       5.303007 15.89944 7.295352 16.96484 7.246733 -1.065400      10.28286 
1 1 1 2   38 21 o 13.67523 6.120970 -0.3923277     4.194448 2.230710       7.438911 -1.614989      5.078790 18.67934 8.268363 14.08227 6.470967 4.597062       10.49949 
1 1 1 2   38 22 o 24.32533 6.987063 9.186625       4.360004 2.482964       7.240093 13.00096       5.461316 18.42496 8.156376 28.39621 7.699944 -9.971249      11.21676 
1 1 1 2   38 23 o 13.20844 6.126411 -1.809456      4.708830 6.103299       7.314760 -7.409057      6.153394 20.42075 8.607678 12.61063 6.150808 7.810121       10.57944 
1 1 1 2   38 24 o 20.23879 7.506081 6.675196       4.922919 3.560969       7.646999 8.879357       6.433356 18.55909 8.288828 22.19408 8.502833 -3.634991      11.87446 
1 1 1 2   38 25 o 16.27038 6.347503 3.653296       3.633493 10.61685       7.392475 1.435138       4.172253 22.82050 9.008442 14.47495 6.305776 8.345553       10.99613 
1 1 1 2   38 26 o 13.94286 5.948669 1.697325       3.565667 9.095156       8.627875 0.1735669      3.915702 20.92311 9.091872 13.04237 5.869685 7.880738       10.82198 
1 1 1 2   38 27 o 13.59163 5.880403 1.457939       3.577315 -0.6101915     8.332085 1.925322       3.960967 16.00398 7.640552 14.36828 6.201969 1.635705       9.840857 
1 1 1 2   38 28 o 11.57953 5.317688 -0.6380800     3.422615 -5.044250      7.683210 0.4527481      3.822876 13.93318 6.812508 12.89355 5.801458 1.039632       8.948026 
1 1 1 2   39 0  o 126.6919 2.798734 197.7719       8.640656 173.3263       13.23067 215.9523       11.40996 117.3890 4.634173 131.8938 3.553197 -14.50478      5.839587 
1 1 1 2   39 1  o 17.75518 6.157512 3.747859       3.251791 -0.5229928     4.641145 7.866066       4.557450 15.09976 6.612741 24.24422 7.194936 -9.144459      9.772177 
1 1 1 2   39 2  o 32.42453 4.629641 13.45027       3.554368 21.91181       5.402667 6.993176       4.719569 41.17952 5.522947 23.09244 7.406262 18.08708       9.238813 
1 1 1 2   39 3  o 14.94121 5.816222 1.927784       3.045387 2.412325       4.361672 1.466870       4.254001 17.31901 6.893028 16.21564 6.677014 1.103374       9.596684 
1 1 1 2   39 4  o 21.07698 6.167036 5.861637       3.368133 2.098680       4.520948 10.55541       5.049238 17.18785 6.956267 27.79616 7.345037 -10.60831      10.11628 
1 1 1 2   39 5  f 59.92857 3.586011 44.80223       5.213036 46.14549       6.765655 42.83948       8.178308 60.35971 4.635138 57.46181 5.925339 2.897896       7.522908 
1 1 1 2   39 6  o 47.84223 4.462144 29.02817       5.142255 30.13290       6.058969 26.18331       9.723055 48.41122 5.218231 42.58274 9.599991 5.828480       10.92656 
1 1 1 2   39 7  o 50.79852 3.525685 32.26427       4.337379 35.08894       6.098517 29.37294       6.170071 52.41788 4.828513 47.64449 5.409910 4.773396       7.251322 
1 1 1 2   39 8  o 31.75091 5.425254 13.24709       4.047052 12.35895       4.821022 15.36644       7.447340 30.10513 6.739688 32.54535 9.058695 -2.440210      11.29085 
1 1 1 2   39 9  o 24.14157 5.723375 7.829673       3.315527 7.852205       4.391598 7.799806       5.056017 23.92968 7.052876 23.90286 7.665659 0.2681351E-01  10.41659 
1 1 1 2   39 10 o 48.71854 3.619097 29.85736       4.265968 23.01543       5.737697 38.31457       6.379134 41.71218 5.801470 54.57353 4.847080 -12.86135      7.559844 
1 1 1 2   39 11 o 25.37614 6.797053 8.953367       4.287327 22.64426       7.861909 3.158673       5.114786 39.58836 8.409235 18.58486 7.441813 21.00350       11.22924 
1 1 1 2   39 12 o 19.28350 6.763449 4.735892       3.929444 3.570728       6.681557 5.351957       4.858446 20.27576 8.360369 20.58809 7.486355 -0.3123283     11.22236 
1 1 1 2   39 13 o 37.44279 4.992892 18.44357       4.442269 20.78995       7.859529 17.34213       5.384906 37.12914 8.818314 35.44214 6.473249 1.686996       10.93918 
1 1 1 2   39 14 o 23.59109 6.731640 7.904666       4.059990 17.79307       7.760187 4.177943       4.764011 33.69041 9.196515 18.98416 7.305728 14.70625       11.74519 
1 1 1 2   39 15 f 10.61196 5.065127 -4.113535      3.657212 -1.074602      6.433370 -5.564513      4.445375 16.48984 7.462831 11.32924 5.453785 5.160601       9.243246 
1 1 1 2   39 16 o 16.85170 7.036804 2.202241       4.818176 0.000000       0.000000 2.202241       4.818176 ?        ?        16.85170 7.036804 0.000000       7.036804 
1 1 1 2   39 17 o 27.52150 6.286115 10.87384       4.123182 11.56408       7.586827 10.58453       4.911876 26.39080 9.385123 26.45883 7.353891 -0.6802750E-01 11.92310 
1 1 1 2   39 18 o 22.62131 6.658061 7.560024       3.915945 16.76645       7.931641 4.592640       4.503024 31.04629 9.552675 18.75619 7.131189 12.29011       11.92088 
1 1 1 2   39 19 o 10.59149 5.024860 -3.280546      3.490791 -0.9474280     6.747921 -4.133065      4.079000 16.33924 7.489843 11.18419 5.341278 5.155045       9.199293 
1 1 1 2   39 20 o 12.84758 5.746246 -0.3756549     3.689243 14.75581       7.872448 -4.633843      4.176205 28.16759 9.587363 11.04041 5.307394 17.12718       10.95837 
1 1 1 2   39 21 o 31.08319 5.604682 13.88955       4.089192 19.96535       9.020703 12.31811       4.587629 31.30811 10.25500 28.24000 6.756923 3.068111       12.28092 
1 1 1 2   39 22 o 15.39649 6.464977 2.274921       4.101357 5.956741       7.162210 0.4785373      5.002825 19.96431 8.471112 14.86251 6.666130 5.101794       10.77947 
1 1 1 2   39 23 o 10.10881 4.870323 -3.924067      3.562502 -3.294415      7.294019 -4.121325      4.082573 14.92942 7.133354 10.87128 5.231589 4.058136       8.846144 
1 1 1 2   39 24 o 14.57180 6.219544 1.951044       3.900623 5.221455       7.389598 0.6878499      4.592558 18.77237 8.278255 14.22942 6.384187 4.542951       10.45406 
1 1 1 2   39 25 o 11.87395 5.469266 -0.9161195     3.658485 -3.993839      7.144996 0.1775262      4.259178 14.16066 6.841000 13.38659 6.063925 0.7740669      9.141688 
1 1 1 2   39 26 o 21.83073 7.038460 8.507874       4.258597 17.69613       9.822075 6.380733       4.725904 24.81824 10.17453 18.91560 7.277201 5.902645       12.50915 
1 1 1 2   40 0  o 16.87493 6.023580 3.329520       3.128092 8.957905       4.570013 -1.632030      4.290761 25.47070 7.098632 13.55081 6.117302 11.91989       9.370804 
1 1 1 2   40 1  o 90.25108 2.786333 100.8375       6.120698 107.6939       9.858373 96.53676       7.807818 92.19789 4.400516 87.80426 3.657040 4.393631       5.721756 
1 1 1 2   40 2  o 26.90476 5.859256 9.729013       3.732489 17.84584       5.028007 -0.2344719     5.570683 36.70676 5.814543 16.47568 7.229185 20.23108       9.277393 
1 1 1 2   40 3  o 21.16190 6.104841 6.025979       3.321676 1.588642       4.159226 13.83995       5.519343 16.01740 6.599502 31.50243 7.328225 -15.48503      9.861862 
1 1 1 2   40 4  o 11.87139 5.274892 -0.7832513     3.056300 -1.629585      3.945177 0.4870365      4.833333 12.90760 5.842611 15.96022 6.869716 -3.052615      9.018265 
1 1 1 2   40 5  o 29.77830 5.079855 11.65957       3.554124 11.50805       4.917615 11.82526       5.142504 28.72157 7.073488 29.02899 7.282673 -0.3074188     10.15242 
1 1 1 2   40 6  o 49.02016 3.573278 30.24999       4.239209 28.02794       5.956004 32.53142       6.035071 46.25155 5.384955 50.09151 5.011248 -3.839958      7.355973 
1 1 1 2   40 7  o 56.00452 3.360225 39.34412       4.564841 49.55827       6.781816 30.88306       6.172445 62.19094 4.505443 48.55894 5.302229 13.63199       6.957920 
1 1 1 2   40 8  o 20.54050 6.495198 5.712991       3.640319 5.540599       4.524083 6.029610       6.131119 20.61695 7.255110 21.99521 8.330714 -1.378265      11.04706 
1 1 1 2   40 9  o 52.22214 3.482511 34.40780       4.406506 34.25785       6.270973 34.55406       6.193234 51.12909 5.101048 51.41670 5.006163 -0.2876091     7.147192 
1 1 1 2   40 10 f 27.06888 5.467229 9.935615       3.482074 11.84914       4.835101 7.873905       5.018829 28.82166 6.962811 23.47122 7.646755 5.350435       10.34184 
1 1 1 2   40 11 o 30.47170 5.840996 12.74806       4.179503 7.966438       6.942751 15.46582       5.234196 23.74067 8.892383 33.07506 6.723416 -9.334396      11.14804 
1 1 1 2   40 12 f 26.89384 6.380428 10.26506       4.118141 10.12477       7.258677 10.33165       5.000879 25.60474 9.171667 26.40430 7.449872 -0.7995567     11.81609 
1 1 1 2   40 13 o 26.02757 6.594844 9.782994       4.187224 2.629453       6.998040 13.77228       5.225926 19.19431 8.264004 30.62568 7.135269 -11.43137      10.91814 
1 1 1 2   40 14 o 21.43745 7.437379 6.646758       4.744288 0.000000       0.000000 6.646758       4.744288 ?        ?        21.43745 7.437379 0.000000       7.437379 
1 1 1 2   40 15 o 20.45407 6.761152 6.024009       3.917765 10.29616       6.955561 4.038820       4.741437 25.17516 8.982630 18.37486 7.226506 6.800299       11.52866 
1 1 1 2   40 16 o 20.11293 6.671404 5.868618       3.813507 18.26859       8.026726 2.253722       4.333870 32.32936 9.536794 16.14252 6.701768 16.18685       11.65608 
1 1 1 2   40 17 o 19.36537 7.838848 4.783120       5.741995 0.000000       0.000000 4.783120       5.741995 ?        ?        19.36537 7.838848 0.000000       7.838848 
1 1 1 2   40 18 o 29.95499 5.842247 12.95524       4.111442 19.02896       8.426302 11.05741       4.710186 31.68272 9.862627 26.57669 7.126918 5.106028       12.16817 
1 1 1 2   40 19 o 24.90419 6.467529 9.494162       3.959540 14.29034       8.296902 8.079690       4.505735 26.78899 9.776817 22.43003 7.240527 4.358957       12.16599 
1 1 1 2   40 20 o 25.58535 7.055553 10.58121       4.541104 12.39111       8.664662 9.895819       5.332063 24.52570 9.730248 23.92815 7.886736 0.5975475      12.52511 
1 1 1 2   40 21 o 11.42492 5.302531 -1.594229      3.536013 -4.837078      6.819342 -0.4016829     4.135391 13.95745 6.728017 13.10989 5.953072 0.8475561      8.983611 
1 1 1 2   40 22 o 17.36678 6.423610 4.583503       3.601041 7.967521       7.380044 3.526037       4.125492 20.66273 8.674016 16.31899 6.630258 4.343742       10.91782 
1 1 1 2   40 23 o 10.82742 5.103898 -2.203601      3.494483 -2.902417      7.354448 -1.999822      3.971438 14.79166 7.093014 11.67601 5.484295 3.115647       8.965954 
1 1 1 2   40 24 o 15.87464 6.453117 3.501116       3.910408 -3.125521      8.147972 5.484159       4.457270 15.07446 7.288048 18.10727 7.039902 -3.032814      10.13291 
1 1 1 2   41 0  o 15.46057 6.172747 2.058344       3.508649 -0.3256913E-01 4.547268 5.134755       5.515753 14.95669 6.547920 20.65309 7.882836 -5.696399      10.24765 
1 1 1 2   41 1  o 16.81914 6.258208 3.230252       3.427361 3.422680       5.495947 3.107793       4.384325 18.99262 7.675864 17.62424 6.943619 1.368380       10.35049 
1 1 1 2   41 2  o 54.99931 3.663198 38.30669       4.881700 35.69302       9.235874 39.31997       5.750640 49.90929 7.852978 55.33632 4.298199 -5.427025      8.952306 
1 1 1 2   41 3  o 26.84810 5.620101 9.809772       3.558839 9.942102       4.993231 9.673143       5.073650 26.21095 7.460789 25.82730 7.572401 0.3836441      10.63036 
1 1 1 2   41 4  o 49.28314 3.370147 30.64283       4.023108 31.23874       6.180288 30.20463       5.299743 48.57269 5.307605 48.25422 4.561084 0.3184700      6.998154 
1 1 1 2   41 5  o 14.81130 5.959227 1.805330       3.296363 3.457187       4.294330 -0.5641045     5.143178 17.82142 6.915242 15.32241 6.823446 2.499011       9.714936 
1 1 1 2   41 6  o 20.35427 6.092703 5.732761       3.257111 9.274912       4.625235 2.248177       4.587497 25.29016 7.174579 16.83817 6.933623 8.451988       9.977460 
1 1 1 2   41 7  o 23.13772 5.848173 7.458978       3.298495 8.129881       4.634410 6.770198       4.695747 23.65075 7.306375 21.87265 7.404991 1.778105       10.40274 
1 1 1 2   41 8  o 15.67363 6.067938 2.587257       3.300745 3.767035       4.629016 1.366925       4.707901 18.28131 7.155038 16.09037 6.849181 2.190945       9.904840 
1 1 1 2   41 9  o 47.31982 3.702697 28.67061       4.235723 22.45276       5.946121 35.07639       6.035310 40.07946 6.295292 51.49483 4.867255 -11.41538      7.957442 
1 1 1 2   41 10 o 25.41079 5.756519 9.041962       3.481719 8.485651       4.799510 9.659925       5.058479 23.84096 7.446803 25.28157 7.598638 -1.440613      10.63927 
1 1 1 2   41 11 o 28.84378 6.064849 11.78126       4.127466 14.25151       7.785584 10.81559       4.867818 28.99049 9.528826 26.83391 7.266658 2.156582       11.98344 
1 1 1 2   41 12 o 15.12180 6.540983 0.8843871      4.424233 0.000000       0.000000 0.8843871      4.424233 ?        ?        15.12180 6.540983 0.000000       6.540983 
1 1 1 2   41 13 o 19.11445 6.693362 5.137288       3.847428 4.494820       6.845530 5.433939       4.651633 19.94177 8.361553 19.72550 7.299901 0.2162762      11.09974 
1 1 1 2   41 14 o 30.00883 5.868975 12.84976       4.138054 13.95202       7.829514 12.42252       4.874488 27.86670 9.559286 28.57618 7.045210 -0.7094860     11.87497 
1 1 1 2   41 15 o 12.33100 5.633481 -1.259935      3.775142 -1.471441      6.822644 -1.166604      4.532172 15.99514 7.403427 13.52599 6.176795 2.469144       9.641760 
1 1 1 2   41 16 o 46.74745 4.459230 29.40791       5.018410 36.86171       11.01778 27.45670       5.637113 44.07331 10.42316 44.29613 5.329129 -0.2228241     11.70649 
1 1 1 2   41 17 o 16.66401 6.463552 3.617995       3.750514 3.516494       8.069120 3.645965       4.235876 19.05651 8.512513 16.98936 6.782607 2.067158       10.88424 
1 1 1 2   41 18 o 21.13401 7.593327 7.450299       4.979527 14.04133       8.656328 4.190605       6.087593 25.65990 9.854831 18.26647 7.782367 7.393429       12.55719 
1 1 1 2   41 19 o 12.62396 5.856436 -1.490624      4.306090 0.000000       0.000000 -1.490624      4.306090 ?        ?        12.62396 5.856436 0.000000       5.856436 
1 1 1 2   41 20 f 11.96152 5.510718 -1.106304      3.716816 -0.2624661     8.005787 -1.338163      4.196493 16.48473 7.756621 12.48514 5.788368 3.999591       9.678346 
1 1 1 2   41 21 o 16.16412 6.467677 3.616882       3.860423 -3.770884      7.563287 6.219666       4.489243 14.68224 7.079425 19.18672 7.157823 -4.504487      10.06741 
1 1 1 2   41 22 o 14.62673 6.214321 2.225023       3.862862 11.35807       8.224354 -0.3600499     4.375526 22.16608 9.219822 13.13374 6.024446 9.032340       11.01359 
1 1 1 2   42 0  o 18.22897 6.160816 4.461170       3.250311 0.3755396      4.677558 8.275805       4.519768 15.21696 6.651948 23.74689 7.192554 -8.529935      9.797002 
1 1 1 2   42 1  o 53.13149 3.549475 35.96159       4.569348 38.82062       6.600232 33.33007       6.332168 54.02380 5.072817 49.84883 5.293516 4.174969       7.331766 
1 1 1 2   42 2  o 26.94678 5.737943 10.09670       3.652303 12.47241       5.387188 8.075947       4.968458 28.82645 7.572452 23.35903 7.608153 5.467428       10.73434 
1 1 1 2   42 3  o 41.09875 4.313009 22.05782       4.255337 22.20840       5.744121 21.87467       6.335101 39.98897 6.086232 39.01572 6.916315 0.9732513      9.212906 
1 1 1 2   42 4  o 36.17339 4.817308 17.42854       4.141018 10.69821       7.588508 20.28262       4.941648 25.83772 9.361816 38.66661 5.390805 -12.82889      10.80298 
1 1 1 2   42 5  o 50.86820 4.129257 33.58121       5.074658 40.85146       9.670037 30.81805       5.961511 52.36750 7.816534 47.88883 5.191345 4.478664       9.383404 
1 1 1 2   42 6  o 32.76099 5.323463 14.65149       4.104218 5.832490       6.868534 19.54903       5.118503 21.31513 8.592916 37.59935 5.770339 -16.28423      10.35060 
1 1 1 2   42 7  o 37.91068 4.467454 18.99810       4.048065 22.36147       6.068464 16.30159       5.433653 39.55352 6.523088 33.35501 6.912226 6.198509       9.504186 
1 1 1 2   42 8  o 12.88887 5.589299 0.2905753      3.247069 -3.508603      4.612072 4.024486       4.572284 12.46376 5.871640 18.21776 7.116630 -5.754004      9.226190 
1 1 1 2   42 9  o 16.38964 6.502412 2.914384       3.869503 -2.460215      6.975541 5.303396       4.650653 15.95521 7.419596 19.59342 7.290087 -3.638207      10.40172 
1 1 1 2   42 10 o 23.66492 6.522209 8.313842       3.881766 3.725291       6.133219 11.38019       5.013733 18.84291 7.908579 27.10674 7.389120 -8.263830      10.82334 
1 1 1 2   42 11 o 24.16143 6.573047 8.760835       3.972092 6.920875       7.083207 9.604870       4.797401 21.62079 8.722612 24.74779 7.391107 -3.126993      11.43295 
1 1 1 2   42 12 o 25.00428 6.489944 9.413211       3.988502 5.519825       7.094130 11.21272       4.822949 20.36306 8.523332 26.74285 7.229300 -6.379791      11.17631 
1 1 1 2   42 13 o 14.06872 6.131139 0.7479994      3.947538 5.737595       7.148612 -1.441021      4.734935 20.33428 8.536581 13.54079 6.231606 6.793486       10.56911 
1 1 1 2   42 14 o 28.24516 6.375969 12.06495       4.284230 12.43991       8.146340 11.92159       5.037064 25.23390 9.592177 27.08414 7.415827 -1.850231      12.12454 
1 1 1 2   42 15 o 18.42653 6.800668 5.063708       4.032347 -0.8642238     7.637423 7.354798       4.748062 16.49387 7.701237 21.17989 7.434189 -4.686020      10.70403 
1 1 1 2   42 16 o 16.06088 6.823506 2.613550       4.657176 23.35849       8.866860 -5.289627      5.472864 33.54602 10.05521 12.36520 5.976939 21.18082       11.69748 
1 1 1 2   42 17 o 20.45010 7.041018 6.909579       4.248881 2.934162       7.616202 8.705870       5.119592 17.90884 8.111011 22.22426 7.725069 -4.315420      11.20112 
1 1 1 2   42 18 o 17.03820 6.584216 4.258986       3.881078 8.811264       8.150826 2.924246       4.413526 21.20437 9.018581 15.92765 6.698384 5.276717       11.23402 
1 1 1 2   42 19 o 22.18207 6.924241 8.377036       4.150249 0.1467984      8.019498 11.38763       4.850286 16.44895 7.747053 25.46248 7.386451 -9.013525      10.70404 
1 1 1 2   42 20 o 17.93826 7.023639 5.208658       4.462076 0.000000       0.000000 5.208658       4.462076 ?        ?        17.93826 7.023639 0.000000       7.023639 
1 1 1 2   43 0  o 10.64081 4.862963 -1.307731      2.816204 -2.532259      4.165310 -0.2766288     3.822203 12.27154 5.715631 13.28644 5.901553 -1.014897      8.215641 
1 1 1 2   43 1  o 50.30576 3.459554 32.42980       4.215232 36.32953       6.595501 29.73705       5.480608 51.59583 5.321891 47.07468 4.846735 4.521152       7.198150 
1 1 1 2   43 2  o 28.25511 5.530369 11.17513       3.671535 21.34321       5.825921 4.476236       4.728755 38.49957 6.436795 18.70835 7.257371 19.79122       9.700607 
1 1 1 2   43 3  o 21.79154 6.251915 6.932203       3.492754 8.829749       5.333338 5.507237       4.621735 23.71179 7.890337 19.77656 7.283909 3.935234       10.73838 
1 1 1 2   43 4  o 46.61019 3.904713 28.30338       4.394403 28.69038       6.225672 27.91913       6.203633 45.27825 5.773507 44.58551 5.850786 0.6927452      8.219797 
1 1 1 2   43 5  o 21.91266 6.330417 7.086848       3.569323 6.748602       5.243233 7.378973       4.872682 21.18708 7.765784 21.91921 7.540447 -0.7321358     10.82431 
1 1 1 2   43 6  o 23.88671 6.097573 8.362405       3.560975 5.850223       4.725272 11.66433       5.417326 20.03002 7.367137 26.94223 7.803506 -6.912205      10.73170 
1 1 1 2   43 7  o 13.33788 5.836302 0.3330821      3.608615 1.498226       6.022714 -0.3194760     4.507255 16.95713 7.475810 14.07867 6.319941 2.878458       9.789248 
1 1 1 2   43 8  o 16.12236 6.387323 2.997129       3.728775 13.63544       7.780672 -0.1745695     4.248414 27.07330 9.515552 13.79198 6.167665 13.28132       11.33957 
1 1 1 2   43 9  o 18.49693 6.718788 4.922429       3.911827 1.917826       7.055029 6.256233       4.700578 17.83686 7.964224 20.24111 7.363199 -2.404251      10.84645 
1 1 1 2   43 10 o 13.87221 6.028738 0.8023163      3.794562 8.914185       7.285110 -2.217799      4.445160 22.65455 8.942831 12.63561 5.891650 10.01894       10.70914 
1 1 1 2   43 11 o 23.22058 6.710437 8.465378       4.010123 8.953228       7.824505 8.291588       4.670090 22.40884 9.121193 22.50846 7.379015 -0.9961700E-01 11.73226 
1 1 1 2   43 12 o 22.41367 6.947494 8.100992       4.186247 12.28126       8.257037 6.654752       4.856711 24.58118 9.574714 20.29920 7.468428 4.281973       12.14300 
1 1 1 2   43 13 o 13.98509 6.028606 1.240352       3.733002 9.889176       7.803936 -1.325840      4.250888 22.62666 9.145910 12.71641 5.870973 9.910253       10.86812 
1 1 1 2   43 14 o 17.77631 7.106333 4.549811       4.656183 11.29278       8.200248 1.341408       5.656476 23.32012 9.393339 15.83764 7.097045 7.482477       11.77297 
1 1 1 2   43 15 o 21.88112 6.988410 8.001959       4.205354 11.90681       8.256149 6.633920       4.886802 23.48802 9.437746 19.86515 7.456341 3.622869       12.02780 
1 1 1 2   43 16 o 19.25738 6.866730 6.100245       4.064028 2.766957       7.872861 7.311131       4.745125 17.66373 8.094418 20.50792 7.406758 -2.844193      10.97177 
1 1 1 2   43 17 o 10.61825 5.066033 -3.039073      3.650595 -3.629643      7.131720 -2.829388      4.249543 14.38788 6.921495 11.63284 5.526188 2.755036       8.856966 
1 1 1 2   44 0  o 37.61261 4.778750 19.34383       4.281353 24.32317       6.040515 14.31729       6.069081 40.72501 6.288962 29.16719 8.199226 11.55782       10.33336 
1 1 1 2   44 1  o 25.75510 6.108601 9.837967       3.775541 9.889161       5.103443 9.776073       5.611485 24.57355 7.679475 24.12009 8.094751 0.4534569      11.15793 
1 1 1 2   44 2  o 12.04805 5.349515 -0.1919583     3.137672 2.340380       4.654879 -2.300647      4.247699 16.19611 6.848764 12.32738 5.751704 3.868723       8.943583 
1 1 1 2   44 3  o 17.44198 6.153685 4.306108       3.256280 0.1040489      5.079451 7.237910       4.242804 14.90768 6.699212 21.49147 7.032637 -6.583784      9.712745 
1 1 1 2   44 4  o 20.90776 6.669858 6.738730       3.831572 -0.2502498     6.860483 9.906984       4.619105 16.38963 7.527405 24.85591 7.207617 -8.466286      10.42169 
1 1 1 2   44 5  o 16.58839 6.332176 3.630943       3.559417 1.974169       5.983184 4.538478       4.428253 16.90129 7.451213 18.06983 7.019295 -1.168533      10.23675 
1 1 1 2   44 6  o 14.57427 5.810045 2.330764       3.103735 5.673764       4.467994 -0.7867886     4.314707 19.30164 7.152279 13.27482 6.048517 6.026816       9.366944 
1 1 1 2   44 7  o 28.66508 6.292579 12.46796       4.274832 7.888919       7.527746 14.64749       5.193490 21.48444 8.867881 30.25351 7.157093 -8.769075      11.39576 
1 1 1 2   44 8  o 15.43279 6.263673 2.684963       3.677438 2.841347       5.013312 2.502801       5.410766 16.62105 7.071209 16.64513 7.216659 -0.2408791E-01 10.10357 
1 1 1 2   44 9  f 16.24890 6.313787 3.494894       3.583631 2.358495       4.932041 4.765867       5.215902 16.10573 6.936002 18.32597 7.451652 -2.220240      10.18014 
1 1 1 2   44 10 o 18.39077 7.061589 5.126396       4.444032 7.848809       8.050744 3.933319       5.329583 21.07814 8.963901 17.56700 7.372612 3.511143       11.60633 
1 1 1 2   44 11 o 26.05405 6.668607 10.86932       4.251304 11.90591       8.257178 10.49542       4.959099 23.70676 9.467988 24.63657 7.548471 -0.9298115     12.10877 
1 1 1 2   44 12 o 20.74760 7.441562 7.393442       4.780162 12.30560       8.065027 4.733331       5.934983 23.86421 9.412763 18.23557 7.723291 5.628647       12.17577 
1 1 1 2   44 13 o 11.27471 5.327542 -2.516984      3.849643 8.682639       7.591322 -6.394156      4.466561 21.13699 8.829932 10.44447 5.124853 10.69252       10.20940 
1 1 1 2   45 0  o 15.46165 6.260554 2.747177       3.663801 0.1367329E-01  6.834821 3.849357       4.340037 16.19479 7.465269 17.08315 6.850091 -0.8883686     10.13183 
1 1 1 2   45 1  o 19.26312 6.419020 5.725962       3.529511 5.650744       6.976898 5.751832       4.091709 19.60596 8.341504 19.20683 6.885347 0.3991318      10.81613 
1 1 1 2   45 2  o 11.50942 5.226289 -0.7584280     3.187245 -7.362859      4.727248 4.746119       4.315703 10.60428 5.217004 18.01371 6.947918 -7.409427      8.688538 
1 1 1 2   45 3  o 56.34639 4.162212 42.75484       5.674788 41.96011       7.461411 43.84531       8.740159 53.50102 5.816496 52.90552 6.946945 0.5955048      9.060446 
1 1 1 2   45 4  o 28.69218 6.717011 13.01852       4.613140 6.743839       5.919117 22.72646       7.362495 20.18707 8.031436 35.69275 8.572573 -15.50568      11.74704 
1 1 1 2   45 5  o 18.14727 6.557815 5.014824       3.720358 5.138580       4.948482 4.853933       5.642285 18.48983 7.347602 18.43741 7.649980 0.5242538E-01  10.60705 
1 1 1 2   45 6  o 27.04015 6.393335 11.43127       4.146050 14.48229       6.062910 8.751227       5.682374 28.22114 8.278744 22.04458 8.083738 6.176556       11.57084 
1 1 1 2   45 7  o 30.89282 5.396354 13.93215       3.914738 11.99317       5.974813 15.39069       5.181998 25.30942 8.348863 30.70462 7.071568 -5.395197      10.94123 
1 1 1 2   45 8  o 17.46902 6.481986 4.596417       3.672057 2.814417       5.234148 6.323558       5.152950 16.44465 7.113865 19.51530 7.574376 -3.070650      10.39126 
1 1 1 2   45 9  o 12.94952 5.783037 0.2152146      3.721577 -3.452071      4.769161 5.925589       5.951163 12.12203 5.785399 19.13771 7.890558 -7.015675      9.784261 
1 1 1 3   0  0  o 225.3263 5.076892 619.7036       27.84504 619.7036       27.84504 619.7036       27.84504 225.3263 5.076892 225.3263 5.076892 0.000000       0.000000 
1 1 1 3   0  1  o 330.2684 4.953748 1330.217       39.84895 1330.217       39.84895 1330.217       39.84895 330.2684 4.953748 330.2684 4.953748 0.000000       0.000000 
1 1 1 3   0  2  o 45.13330 2.767889 25.10043       3.017749 25.10043       3.017749 25.10043       3.017749 45.13330 2.767889 45.13330 2.767889 0.000000       0.000000 
1 1 1 3   0  3  o 104.4184 3.237031 133.2440       8.218893 133.2440       8.218893 133.2440       8.218893 104.4184 3.237031 104.4184 3.237031 0.000000       0.000000 
1 1 1 3   0  4  o 137.6672 3.701760 231.4501       12.39837 231.4501       12.39837 231.4501       12.39837 137.6672 3.701760 137.6672 3.701760 0.000000       0.000000 
1 1 1 3   0  5  o 176.8358 4.326447 381.7655       18.61873 381.7655       18.61873 381.7655       18.61873 176.8358 4.326447 176.8358 4.326447 0.000000       0.000000 
1 1 1 3   0  6  o 214.0600 4.969234 559.3461       25.89001 559.3461       25.89001 559.3461       25.89001 214.0600 4.969234 214.0600 4.969234 0.000000       0.000000 
1 1 1 3   0  7  o 321.9049 6.917379 1264.983       54.20663 1264.983       54.20663 1264.983       54.20663 321.9049 6.917379 321.9049 6.917379 0.000000       0.000000 
1 1 1 3   0  8  o 547.9681 11.26822 3669.063       150.3254 3669.063       150.3254 3669.063       150.3254 547.9681 11.26822 547.9681 11.26822 0.000000       0.000000 
1 1 1 3   0  9  o 376.5525 7.965098 1731.625       73.01531 1731.625       73.01531 1731.625       73.01531 376.5525 7.965098 376.5525 7.965098 0.000000       0.000000 
1 1 1 3   0  10 o 16.67105 6.754907 4.715540       2.684393 4.715540       2.684393 4.715540       2.684393 16.67105 6.754907 16.67105 6.754907 0.000000       0.000000 
1 1 1 3   0  11 o 313.7809 9.652477 1205.055       73.64943 1205.055       73.64943 1205.055       73.64943 313.7809 9.652477 313.7809 9.652477 0.000000       0.000000 
1 1 1 3   0  12 o 199.4412 4.846084 485.7021       23.52135 485.7021       23.52135 485.7021       23.52135 199.4412 4.846084 199.4412 4.846084 0.000000       0.000000 
1 1 1 3   0  13 o 350.1363 7.515320 1496.972       64.05733 1496.972       64.05733 1496.972       64.05733 350.1363 7.515320 350.1363 7.515320 0.000000       0.000000 
1 1 1 3   0  14 o 450.7911 9.426326 2481.704       103.4487 2481.704       103.4487 2481.704       103.4487 450.7911 9.426326 450.7911 9.426326 0.000000       0.000000 
1 1 1 3   0  15 o 196.9593 4.874526 473.6432       23.36380 473.6432       23.36380 473.6432       23.36380 196.9593 4.874526 196.9593 4.874526 0.000000       0.000000 
1 1 1 3   0  16 o 525.1834 15.43462 3376.218       197.1483 3376.218       197.1483 3376.218       197.1483 525.1834 15.43462 525.1834 15.43462 0.000000       0.000000 
1 1 1 3   0  17 o 29.99028 6.818480 12.51660       4.343622 12.51660       4.343622 12.51660       4.343622 29.99028 6.818480 29.99028 6.818480 0.000000       0.000000 
1 1 1 3   0  18 o 501.1473 10.42439 3067.265       127.1826 3067.265       127.1826 3067.265       127.1826 501.1473 10.42439 501.1473 10.42439 0.000000       0.000000 
1 1 1 3   0  19 o 660.8410 13.54269 5338.196       217.8844 5338.196       217.8844 5338.196       217.8844 660.8410 13.54269 660.8410 13.54269 0.000000       0.000000 
1 1 1 3   0  20 o 402.8111 8.582550 1981.485       84.16058 1981.485       84.16058 1981.485       84.16058 402.8111 8.582550 402.8111 8.582550 0.000000       0.000000 
1 1 1 3   0  21 o 129.9709 6.134095 207.3097       19.32924 207.3097       19.32924 207.3097       19.32924 129.9709 6.134095 129.9709 6.134095 0.000000       0.000000 
1 1 1 3   0  22 o 172.3139 4.748061 362.7548       19.90337 362.7548       19.90337 362.7548       19.90337 172.3139 4.748061 172.3139 4.748061 0.000000       0.000000 
1 1 1 3   0  23 o 452.1457 13.53752 2508.646       148.8577 2508.646       148.8577 2508.646       148.8577 452.1457 13.53752 452.1457 13.53752 0.000000       0.000000 
1 1 1 3   0  24 o 93.60546 4.429557 107.5414       10.05234 107.5414       10.05234 107.5414       10.05234 93.60546 4.429557 93.60546 4.429557 0.000000       0.000000 
1 1 1 3   0  25 o 181.7142 4.893612 403.5989       21.63425 403.5989       21.63425 403.5989       21.63425 181.7142 4.893612 181.7142 4.893612 0.000000       0.000000 
1 1 1 3   0  26 f 146.3865 4.504901 262.1180       16.03576 262.1180       16.03576 262.1180       16.03576 146.3865 4.504901 146.3865 4.504901 0.000000       0.000000 
1 1 1 3   0  27 f 167.1070 4.759052 341.5647       19.34433 341.5647       19.34433 341.5647       19.34433 167.1070 4.759052 167.1070 4.759052 0.000000       0.000000 
1 1 1 3   0  28 o 30.46931 11.65239 15.46729       8.160788 15.46729       8.160788 15.46729       8.160788 30.46931 11.65239 30.46931 11.65239 0.000000       0.000000 
1 1 1 3   0  29 o 134.5412 4.477161 221.6580       14.64205 221.6580       14.64205 221.6580       14.64205 134.5412 4.477161 134.5412 4.477161 0.000000       0.000000 
1 1 1 3   0  30 f 20.10580 9.622932 7.291964       5.417806 7.291964       5.417806 7.291964       5.417806 20.10580 9.622932 20.10580 9.622932 0.000000       0.000000 
1 1 1 3   0  31 o 42.85874 6.298604 23.87363       6.162701 23.87363       6.162701 23.87363       6.162701 42.85874 6.298604 42.85874 6.298604 0.000000       0.000000 
1 1 1 3   0  32 o 85.93806 4.522660 90.96688       9.411171 90.96688       9.411171 90.96688       9.411171 85.93806 4.522660 85.93806 4.522660 0.000000       0.000000 
1 1 1 3   0  33 o 112.6510 4.555683 155.8499       12.45960 155.8499       12.45960 155.8499       12.45960 112.6510 4.555683 112.6510 4.555683 0.000000       0.000000 
1 1 1 3   0  34 o 122.4044 4.554463 183.9464       13.54259 183.9464       13.54259 183.9464       13.54259 122.4044 4.554463 122.4044 4.554463 0.000000       0.000000 
1 1 1 3   0  35 o 33.18224 11.77591 17.96569       8.666224 17.96569       8.666224 17.96569       8.666224 33.18224 11.77591 33.18224 11.77591 0.000000       0.000000 
1 1 1 3   0  36 f 61.08524 5.483810 46.85569       8.004495 46.85569       8.004495 46.85569       8.004495 61.08524 5.483810 61.08524 5.483810 0.000000       0.000000 
1 1 1 3   0  37 o 130.0644 4.745778 208.2302       14.99637 208.2302       14.99637 208.2302       14.99637 130.0644 4.745778 130.0644 4.745778 0.000000       0.000000 
1 1 1 3   0  38 o 44.74546 7.076672 26.51750       7.139596 26.51750       7.139596 26.51750       7.139596 44.74546 7.076672 44.74546 7.076672 0.000000       0.000000 
1 1 1 3   0  39 o 67.53066 8.371240 59.69093       13.20690 59.69093       13.20690 59.69093       13.20690 67.53066 8.371240 67.53066 8.371240 0.000000       0.000000 
1 1 1 3   0  40 o 11.73330 7.772346 -1.114986      5.836131 -1.114986      5.836131 -1.114986      5.836131 11.73330 7.772346 11.73330 7.772346 0.000000       0.000000 
1 1 1 3   0  41 o 17.80190 9.607527 6.015532       5.794608 6.015532       5.794608 6.015532       5.794608 17.80190 9.607527 17.80190 9.607527 0.000000       0.000000 
1 1 1 3   0  42 o 29.04566 9.567399 13.93014       6.011374 13.93014       6.011374 13.93014       6.011374 29.04566 9.567399 29.04566 9.567399 0.000000       0.000000 
1 1 1 3   0  43 o 8.777590 6.208128 -5.989535      5.430240 -5.989535      5.430240 -5.989535      5.430240 8.777590 6.208128 8.777590 6.208128 0.000000       0.000000 
1 1 1 3   0  44 o 22.05520 11.24604 10.94393       7.603053 10.94393       7.603053 10.94393       7.603053 22.05520 11.24604 22.05520 11.24604 0.000000       0.000000 
1 1 1 3   0  45 o 18.09003 9.423469 7.316003       5.413402 7.316003       5.413402 7.316003       5.413402 18.09003 9.423469 18.09003 9.423469 0.000000       0.000000 
1 1 1 3   0  46 o 14.37420 8.619078 4.473958       5.406607 4.473958       5.406607 4.473958       5.406607 14.37420 8.619078 14.37420 8.619078 0.000000       0.000000 
1 1 1 3   0  47 o 9.538596 6.616487 -2.348212      5.349899 -2.348212      5.349899 -2.348212      5.349899 9.538596 6.616487 9.538596 6.616487 0.000000       0.000000 
1 1 1 3   0  48 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 3   0  49 o 15.09331 8.873976 6.873523       5.527608 6.873523       5.527608 6.873523       5.527608 15.09331 8.873976 15.09331 8.873976 0.000000       0.000000 
1 1 1 3   0  50 o 18.48304 9.731224 10.75358       5.818959 10.75358       5.818959 10.75358       5.818959 18.48304 9.731224 18.48304 9.731224 0.000000       0.000000 
1 1 1 3   1  0  o 452.4747 5.900335 2496.021       65.05895 2483.640       102.5414 2504.362       84.16955 451.1540 9.326918 453.1418 7.622278 -1.987823      12.04535 
1 1 1 3   1  1  o 673.4308 8.639499 5532.688       141.7809 5420.222       180.5147 5713.785       229.0644 666.2775 11.11787 683.7079 13.74836 -17.43042      17.68119 
1 1 1 3   1  2  o 804.1304 13.27662 7902.165       260.1656 7626.094       439.5729 8051.014       322.7698 787.3265 22.93523 811.0533 16.33080 -23.72681      28.15528 
1 1 1 3   1  3  o 702.2943 11.63156 6023.311       199.0642 6051.575       346.0026 6009.326       243.3773 702.0326 20.24603 701.0791 14.24548 0.9534912      24.75551 
1 1 1 3   1  4  o 405.2428 5.971721 2002.161       58.97268 1987.965       83.05994 2016.592       83.74420 403.6818 8.443379 406.5774 8.452310 -2.895569      11.94706 
1 1 1 3   1  5  o 289.3781 4.440293 1020.679       31.31218 1010.943       44.02617 1030.645       44.54257 287.9444 6.274313 290.7363 6.286948 -2.791962      8.882158 
1 1 1 3   1  6  o 859.5657 12.28251 9028.765       257.2779 9094.243       365.6878 8964.588       362.0315 861.4116 17.42062 855.2634 17.37042 6.148254       24.60101 
1 1 1 3   1  7  o 314.8780 4.789928 1208.668       36.75423 1256.401       53.20029 1165.081       50.83688 320.9543 6.801970 309.0725 6.749668 11.88181       9.582526 
1 1 1 3   1  8  o 622.0021 8.971505 4723.622       135.9857 4666.438       190.7044 4782.776       193.9627 617.6004 12.67118 625.2397 12.73021 -7.639343      17.96154 
1 1 1 3   1  9  o 322.4991 4.904765 1268.186       38.54631 1279.252       54.78827 1257.340       54.24128 323.7835 6.943794 320.9992 6.934097 2.784302       9.813154 
1 1 1 3   1  10 o 396.0085 6.799317 1913.878       65.61542 1816.788       109.6062 1968.107       81.91554 385.0523 11.69454 401.4128 8.374116 -16.36057      14.38360 
1 1 1 3   1  11 o 334.9285 5.087746 1368.078       41.52538 1348.777       58.18800 1388.109       59.27869 332.4053 7.183390 337.2145 7.213670 -4.809235      10.18028 
1 1 1 3   1  12 o 168.7288 3.559359 347.0269       14.63515 339.0446       17.70230 364.2647       26.01394 166.7028 4.361379 172.6862 6.191787 -5.983337      7.573628 
1 1 1 3   1  13 f 516.6172 8.707273 3258.616       109.6193 3238.100       188.7444 3269.058       134.6577 513.7187 15.09328 517.1769 10.68454 -3.458191      18.49234 
1 1 1 3   1  14 o 89.74526 2.534240 98.22819       5.536819 94.23061       7.712568 102.4794       7.953475 87.85471 3.610140 91.62751 3.568833 -3.772797      5.076385 
1 1 1 3   1  15 o 626.7767 10.46845 4796.336       159.8937 4849.183       197.2800 4695.159       272.9720 629.8976 12.85219 618.6232 18.12694 11.27441       22.22082 
1 1 1 3   1  16 o 207.5046 3.573099 524.7551       18.06795 508.2340       25.03969 542.7007       26.09698 204.1901 5.032203 210.9995 5.075430 -6.809387      7.147242 
1 1 1 3   1  17 o 524.9772 8.869426 3362.721       113.4676 3395.390       198.0727 3346.764       138.4335 526.5532 15.45313 523.5494 10.85044 3.003723       18.88204 
1 1 1 3   1  18 o 490.9492 7.216448 2939.778       86.33685 2970.917       122.9453 2909.481       121.2694 493.2935 10.22752 488.1696 10.19399 5.123901       14.44021 
1 1 1 3   1  19 o 435.0779 6.472660 2308.501       68.62557 2320.422       97.38604 2296.743       96.71981 436.0032 9.165812 433.7743 9.149883 2.228912       12.95116 
1 1 1 3   1  20 o 262.0471 4.939911 837.1938       31.54530 859.2358       55.75311 826.8148       38.25805 265.1705 8.639486 260.3794 6.029482 4.791077       10.53543 
1 1 1 3   1  21 o 295.1526 4.684296 1062.137       33.69202 1057.584       47.56356 1066.722       47.73231 294.4238 6.629264 295.6934 6.624219 -1.269592      9.371628 
1 1 1 3   1  22 o 393.7191 6.875379 1892.077       65.96585 1912.888       81.32749 1852.052       112.7836 395.7040 8.433948 388.6718 11.92177 7.032166       14.60343 
1 1 1 3   1  23 o 34.10000 5.966643 14.60676       4.777662 12.71681       8.157833 15.59340       5.894261 32.10192 9.649939 35.09940 7.134629 -2.997471      12.00101 
1 1 1 3   1  24 o 164.3035 3.799254 329.2302       15.21182 322.8615       18.36706 343.1400       27.14386 162.6039 4.639989 167.4469 6.665413 -4.843018      8.121406 
1 1 1 3   1  25 o 263.4955 4.337682 847.2767       27.85269 833.4541       38.98176 861.6933       39.81061 261.1365 6.125729 265.5200 6.152696 -4.383453      8.682178 
1 1 1 3   1  26 o 236.1480 4.032072 680.6385       23.20324 666.6289       32.41080 695.3682       33.23332 233.5067 5.695795 238.4838 5.718457 -4.977051      8.071111 
1 1 1 3   1  27 o 167.4839 3.354388 342.2768       13.69060 332.7210       19.07829 352.4217       19.65757 164.9423 4.751428 169.7585 4.756533 -4.816177      6.723145 
1 1 1 3   1  28 f 101.9740 3.529317 127.0875       8.757114 115.7340       10.33233 156.0420       16.50034 97.22514 4.372160 112.7046 6.029746 -15.47942      7.448061 
1 1 1 3   1  29 o 111.0698 3.606190 150.8020       9.747761 140.8181       17.13637 155.5778       11.85207 106.9104 6.609848 112.7379 4.322085 -5.827507      7.897500 
1 1 1 3   1  30 o 106.6539 3.074101 138.9724       7.981375 131.3790       11.12060 147.0391       11.46188 103.5463 4.417296 109.5697 4.301039 -6.023483      6.165342 
1 1 1 3   1  31 o 70.95265 3.363947 61.63483       5.799830 64.68333       8.428109 58.89260       7.993533 72.51524 4.796362 69.18226 4.770625 3.332985       6.764906 
1 1 1 3   1  32 o 63.38715 3.532607 49.26532       5.435147 49.61423       7.658609 48.91130       7.714614 63.41441 4.996269 62.94886 5.072004 0.4655533      7.119546 
1 1 1 3   1  33 o 80.21135 3.295200 78.77541       6.427292 82.57925       9.109326 75.00441       9.069928 81.94651 4.579847 78.05077 4.791693 3.895744       6.628373 
1 1 1 3   1  34 o 78.38538 3.862566 75.41980       7.355421 72.12623       11.88308 77.46547       9.365135 76.14282 6.465259 79.27365 4.871375 -3.130829      8.095052 
1 1 1 3   1  35 f 73.22434 3.967860 65.92161       7.053789 62.30184       8.662251 73.04640       12.15280 70.98183 5.040599 76.51472 6.581603 -5.532898      8.290063 
1 1 1 3   1  36 o 16.72883 6.709658 1.724509       4.164977 2.838130       5.709780 0.4581320      6.088806 19.94325 7.903050 18.46135 7.820997 1.481903       11.11873 
1 1 1 3   1  37 o 44.25485 4.925251 24.47175       5.221711 24.40789       7.127623 24.54573       7.671573 43.68320 6.926511 43.64701 7.481746 0.3619385E-01  10.19574 
1 1 1 3   1  38 o 47.39589 5.260953 28.21846       5.974090 23.31831       6.977308 41.67834       11.56389 42.53468 6.972847 56.47407 8.680097 -13.93938      11.13394 
1 1 1 3   1  39 o 82.58447 4.140533 84.59067       8.306216 93.89882       15.15960 80.59739       9.929345 85.45229 7.351326 80.23983 5.104485 5.212456       8.949736 
1 1 1 3   1  40 o 20.99002 7.138140 5.406911       4.363842 -0.5523196     6.263527 11.02801       6.083233 17.57030 7.688693 28.52889 8.271043 -10.95859      11.29275 
1 1 1 3   1  41 o 30.19607 6.072196 12.12075       4.313160 14.54554       6.112927 9.716783       6.086617 32.41510 7.827793 26.62630 8.395957 5.788807       11.47896 
1 1 1 3   1  42 o 42.88332 4.552956 23.62267       4.685305 24.70798       6.475338 22.43010       6.787739 42.85257 6.396370 40.32343 7.170452 2.529144       9.608794 
1 1 1 3   1  43 o 10.08602 4.866049 -4.933029      3.585745 -4.980937      5.046202 -4.884166      5.096187 12.64336 6.010734 12.76781 6.061413 -0.1244555     8.536372 
1 1 1 3   1  44 f 27.52628 6.796258 11.21288       4.531166 9.159281       7.341115 12.47675       5.759114 24.03094 9.112553 28.12970 8.014420 -4.098761      12.13547 
1 1 1 3   1  45 o 27.65599 6.906814 11.92980       4.640607 11.91644       5.796484 11.95366       7.744509 26.36931 8.175457 25.12625 9.395806 1.243061       12.45469 
1 1 1 3   1  46 o 16.17347 6.428668 3.519821       3.788993 3.622260       5.197845 3.403665       5.534915 17.01258 7.217507 17.01757 7.338348 -0.4985809E-02 10.29290 
1 1 1 3   1  47 o 16.37487 6.505841 4.090399       3.878859 7.529593       5.543176 0.7906273      5.429656 19.75886 7.800443 14.65675 6.718570 5.102115       10.29495 
1 1 1 3   1  48 o 14.36466 6.412558 2.199562       4.571299 5.172855       5.529729 -4.218307      8.124196 16.80352 7.290391 13.85105 6.819180 2.952477       9.982535 
1 1 1 3   1  49 o 12.28164 5.849656 -0.7007729     4.824583 0.000000       0.000000 -0.7007729     4.824583 ?        ?        12.28164 5.849656 0.000000       5.849656 
1 1 1 3   1  50 o 11.44740 5.311455 0.3619037      3.544091 0.3468774      4.934496 0.3779140      5.093489 12.43269 5.920002 12.53607 5.981867 -0.1033812     8.416006 
1 1 1 3   2  0  o 258.3626 3.594652 813.5037       22.63198 804.8547       28.99043 827.0001       36.21450 256.9672 4.629573 260.4542 5.705782 -3.486969      7.347713 
1 1 1 3   2  1  o 430.9394 5.652534 2263.974       59.36022 2262.010       76.60176 2266.927       93.91554 430.6754 7.298819 431.0468 8.940812 -0.3713989     11.54170 
1 1 1 3   2  2  o 357.3188 4.752134 1556.263       41.37906 1605.521       54.43924 1488.865       63.67865 362.8829 6.156155 349.3979 7.478895 13.48495       9.686697 
1 1 1 3   2  3  o 337.4937 5.057669 1388.434       41.59607 1401.437       59.15780 1375.718       58.49917 338.9970 7.161106 335.8725 7.147253 3.124481       10.11754 
1 1 1 3   2  4  o 255.0306 4.619678 792.7709       28.71046 855.7421       52.28008 765.5792       34.35444 264.7423 8.113153 250.5968 5.625630 14.14543       9.872738 
1 1 1 3   2  5  o 823.1396 13.60144 8283.411       272.8315 8278.443       472.6160 8285.894       334.1284 819.7788 23.68269 822.5723 16.66876 -2.793457      28.96062 
1 1 1 3   2  6  o 343.9373 5.163413 1442.095       43.27651 1447.118       61.31669 1437.110       61.08840 344.4446 7.305050 343.2516 7.303147 1.193024       10.32956 
1 1 1 3   2  7  o 180.8558 3.125025 398.6261       13.77279 384.5603       19.12733 413.7718       19.84799 177.6169 4.419101 184.2393 4.420771 -6.622452      6.250733 
1 1 1 3   2  8  f 454.3060 6.662309 2517.725       73.75803 2546.236       105.0495 2490.004       103.5851 456.6034 9.441013 451.5364 9.413877 5.066956       13.33243 
1 1 1 3   2  9  o 510.7307 10.53532 3189.519       131.1221 3181.188       184.7402 3197.976       186.1370 508.9499 14.91142 510.2723 14.98530 -1.322418      21.14023 
1 1 1 3   2  10 o 522.0063 7.603973 3326.933       96.72804 3327.406       136.7740 3326.459       136.8142 521.5102 10.76229 521.4351 10.76700 0.7513428E-01  15.22351 
1 1 1 3   2  11 f 378.6729 5.664011 1749.149       52.26662 1751.512       73.95780 1746.792       73.87460 378.7138 8.013767 378.2029 8.015566 0.5108643      11.33445 
1 1 1 3   2  12 o 255.5651 4.720542 796.3721       29.39879 779.7141       35.48629 832.8223       52.49263 252.8344 5.759546 261.0281 8.262706 -8.193726      10.07198 
1 1 1 3   2  13 o 255.5441 4.093017 796.0286       25.48857 786.7865       35.78460 805.5462       36.31380 254.0009 5.781292 257.0105 5.798088 -3.009613      8.187866 
1 1 1 3   2  14 o 235.4583 4.441238 675.7974       25.48321 669.3936       43.47093 679.1501       31.45465 234.1204 7.629639 236.0161 5.468991 -1.895706      9.387292 
1 1 1 3   2  15 o 413.2896 7.098881 2083.107       71.49580 2102.112       88.10052 2046.448       122.3578 415.0750 8.709953 409.0817 12.28792 5.993286       15.06174 
1 1 1 3   2  16 o 358.9187 5.440169 1570.429       47.58220 1647.090       69.33250 1502.175       65.42056 367.4792 7.742265 350.9455 7.649596 16.53375       10.88389 
1 1 1 3   2  17 o 54.85841 3.576698 36.83258       4.755399 29.42427       8.481646 40.22907       5.742959 48.56612 7.400069 57.30216 4.140641 -8.736038      8.479736 
1 1 1 3   2  18 o 474.0363 6.988307 2740.571       80.72716 2758.305       114.6919 2723.158       113.6461 475.3409 9.901286 472.3052 9.874063 3.035645       13.98330 
1 1 1 3   2  19 o 25.34819 6.061553 8.151296       3.693621 7.602428       5.440228 8.620673       5.030890 25.16237 7.938064 26.27319 7.492279 -1.110825      10.91545 
1 1 1 3   2  20 o 237.9580 3.982438 690.2058       23.09327 687.3762       32.57168 693.0659       32.74665 237.4228 5.629652 238.4032 5.636620 -0.9803772     7.966459 
1 1 1 3   2  21 o 109.1957 2.950480 145.4276       7.843972 145.2041       11.08022 145.6522       11.10593 109.0574 4.176962 109.2256 4.180196 -0.1682281     5.909403 
1 1 1 3   2  22 o 316.5097 5.707368 1222.122       44.02092 1189.720       74.65842 1239.390       54.50340 311.7546 9.839520 318.6376 7.019245 -6.882996      12.08660 
1 1 1 3   2  23 o 592.6897 10.00032 4301.508       144.4367 4335.527       177.8235 4235.545       247.6145 594.2809 12.27895 584.9522 17.39010 9.328735       21.28822 
1 1 1 3   2  24 o 219.7299 4.425685 589.0300       23.69768 611.3076       29.47672 548.3180       39.84794 223.7766 5.405407 211.5836 7.741420 12.19301       9.441822 
1 1 1 3   2  25 o 58.11367 3.475816 41.33781       4.899844 38.07146       6.600033 45.34866       7.313631 55.62593 4.919585 60.74083 4.984835 -5.114906      7.003634 
1 1 1 3   2  26 o 79.48166 3.105116 77.16962       6.002670 75.12503       8.245287 79.47526       8.755813 78.32384 4.336851 80.55341 4.478051 -2.229576      6.233876 
1 1 1 3   2  27 o 142.0096 3.652326 246.3062       12.62882 243.9736       15.27045 251.3539       22.46372 141.2545 4.441744 143.0995 6.458450 -1.844940      7.838410 
1 1 1 3   2  28 o 35.98058 4.831807 16.10988       4.129574 10.61343       5.611513 22.60301       6.099107 28.89909 7.791822 42.53559 6.054852 -13.63650      9.867812 
1 1 1 3   2  29 o 97.95888 3.606194 117.3386       8.593835 123.6634       15.57275 114.5690       10.30507 100.1919 6.411830 96.71152 4.383966 3.480347       7.767285 
1 1 1 3   2  30 o 110.2162 3.084327 148.4076       8.275887 146.7563       11.55665 150.1459       11.85687 109.4574 4.341231 110.7078 4.403753 -1.250381      6.183796 
1 1 1 3   2  31 o 70.18021 3.330215 60.29860       5.679137 59.17928       7.967409 61.45468       8.097189 69.35366 4.742784 70.68245 4.728151 -1.328789      6.696970 
1 1 1 3   2  32 o 39.39828 4.647105 19.27835       4.375908 18.05427       5.989273 20.67999       6.408961 37.71670 6.764885 40.43601 6.741242 -2.719311      9.550289 
1 1 1 3   2  33 o 30.89675 6.529150 12.21201       4.761780 15.65294       7.207072 9.546195       6.343611 34.79063 8.560229 27.68863 8.547193 7.102009       12.09678 
1 1 1 3   2  34 o 190.8704 3.688603 445.9430       17.15681 444.9299       24.15873 446.9738       24.36945 190.1478 5.218641 190.5722 5.252480 -0.4243622     7.404239 
1 1 1 3   2  35 o 42.29333 4.787755 22.26377       4.847782 26.98134       6.722722 17.15326       6.997106 46.33892 6.101480 36.37046 8.102291 9.968452       10.14274 
1 1 1 3   2  36 o 91.51403 3.817222 102.9035       8.494084 112.1064       10.65243 86.83628       14.07537 95.34889 4.598107 83.20878 7.006551 12.14011       8.380594 
1 1 1 3   2  37 o 82.81956 3.432940 84.27199       6.913416 81.02718       9.494157 87.93455       10.08683 80.87548 4.839432 84.23633 4.935441 -3.360847      6.912213 
1 1 1 3   2  38 o 127.0549 3.846354 198.9185       11.89533 183.1993       13.99535 239.8270       22.57752 121.5761 4.732929 137.9601 6.735991 -16.38399      8.232509 
1 1 1 3   2  39 o 32.47180 5.838378 13.61349       4.450094 14.63802       6.063691 12.41755       6.551324 33.17106 7.656568 30.44701 8.504307 2.724045       11.44318 
1 1 1 3   2  40 o 100.3383 3.990766 125.2459       9.738497 148.1598       18.71186 116.7337       11.40479 106.7039 7.239012 96.37816 4.871732 10.32579       8.725656 
1 1 1 3   2  41 o 14.65670 6.259463 0.3506843      3.955008 -0.5296748     5.523305 1.277077       5.665872 16.35990 7.187741 17.89355 7.560752 -1.533649      10.43209 
1 1 1 3   2  42 o 22.77390 6.841160 7.115231       4.101061 3.863669       5.624412 10.80649       5.992639 19.76154 7.839681 27.41712 8.277229 -7.655586      11.40058 
1 1 1 3   2  43 f 16.60294 6.571565 2.694667       3.943554 4.839473       5.462019 0.3591987      5.699623 20.13480 7.802789 16.63941 7.306346 3.495388       10.68954 
1 1 1 3   2  44 f 27.88861 6.221406 11.20048       4.120593 10.37025       5.652058 12.14236       6.020141 25.58834 8.093548 27.49541 8.295186 -1.907074      11.58946 
1 1 1 3   2  45 o 12.97881 5.931400 -1.056957      4.189510 -5.077409      5.123735 7.053565       7.277356 12.17698 5.860161 21.15530 8.724309 -8.978325      10.50976 
1 1 1 3   2  46 o 10.30547 4.958362 -3.793406      3.663213 -6.472689      4.920145 -0.4608757     5.487262 11.07221 5.421657 14.46703 6.676044 -3.394815      8.600228 
1 1 1 3   2  47 o 14.68130 6.513316 1.776863       4.641790 0.2501680      5.311376 6.712645       9.550121 14.23716 6.569327 18.96163 8.770389 -4.724475      10.95791 
1 1 1 3   2  48 o 10.81820 5.110207 -1.616181      3.536737 -0.1502823     5.132386 -2.941734      4.880517 13.30731 6.245476 11.76913 5.677810 1.538183       8.440586 
1 1 1 3   2  49 o 14.10142 6.277409 2.859761       4.348871 4.659322       8.630580 2.247346       5.034771 15.69841 7.567660 13.95617 6.423900 1.742242       9.926528 
1 1 1 3   2  50 o 24.81408 6.475478 12.17985       3.956510 11.62119       5.720885 12.69203       5.477732 19.85636 7.897129 21.36234 7.918692 -1.505976      11.18349 
1 1 1 3   3  0  o 221.4725 3.194195 597.7507       17.23921 606.3685       22.38159 585.1807       27.03115 223.0507 4.117668 219.1032 5.062672 3.947495       6.525782 
1 1 1 3   3  1  o 925.8102 11.80662 10468.04       266.3690 10586.10       424.4138 10391.31       342.1465 929.3691 18.73981 921.6960 15.23310 7.673096       24.15011 
1 1 1 3   3  2  o 850.5757 14.05120 8844.491       291.2477 8574.868       348.9728 9463.346       528.6971 836.8412 17.11246 876.4345 24.77921 -39.59332      30.11388 
1 1 1 3   3  3  o 678.6217 8.724857 5618.486       144.2853 5618.514       186.3289 5618.445       228.0299 678.3322 11.27202 677.9658 13.80218 0.3663330      17.82018 
1 1 1 3   3  4  o 1620.379 23.17250 32294.01       915.0095 31337.55       1267.885 33333.61       1321.838 1588.808 32.74706 1638.290 33.10941 -49.48145      46.56827 
1 1 1 3   3  5  o 489.4791 8.238799 2923.015       98.27299 2975.719       172.5803 2897.725       119.5481 493.0194 14.37989 487.2030 10.06923 5.816376       17.55479 
1 1 1 3   3  6  o 394.4383 5.840826 1897.020       56.14220 1881.221       79.01310 1913.130       79.78667 392.6535 8.257594 395.9688 8.268624 -3.315308      11.68580 
1 1 1 3   3  7  o 589.0940 9.829051 4238.066       141.1017 4476.135       253.1297 4130.745       169.9560 603.7488 17.22244 581.2622 11.99854 22.48663       20.98993 
1 1 1 3   3  8  o 328.5144 7.037371 1316.780       56.33793 1359.272       80.69679 1276.377       78.68888 333.3972 9.943603 323.0542 10.00751 10.34302       14.10764 
1 1 1 3   3  9  o 307.3952 4.709216 1152.181       35.27620 1147.610       49.73170 1156.810       50.04593 306.6721 6.654615 307.8977 6.670005 -1.225647      9.421936 
1 1 1 3   3  10 o 363.3016 5.452604 1609.933       48.27334 1632.559       68.86279 1588.071       67.68995 365.6474 7.728337 360.6335 7.702328 5.013855       10.91114 
1 1 1 3   3  11 o 631.4992 9.123398 4873.151       140.3995 4949.412       200.5972 4799.918       196.5737 635.4883 12.95333 625.8353 12.88930 9.652954       18.27355 
1 1 1 3   3  12 o 224.9732 3.707176 616.9501       20.32404 612.9687       28.62928 620.9952       28.85715 224.1991 5.240110 225.6620 5.247579 -1.462860      7.415918 
1 1 1 3   3  13 o 556.8091 9.353474 3785.882       126.9157 3796.964       155.6425 3763.889       219.2534 557.3189 11.46009 553.7345 16.26595 3.584412       19.89761 
1 1 1 3   3  14 o 143.7428 3.295076 251.8109       11.54217 259.2869       14.37188 238.2288       19.37148 145.7966 4.049029 139.6654 5.703644 6.131165       6.994726 
1 1 1 3   3  15 o 274.2301 4.994812 916.7037       33.37877 879.3354       55.88147 937.4314       41.61902 268.3316 8.556880 277.2811 6.159359 -8.949432      10.54314 
1 1 1 3   3  16 o 301.8565 4.702643 1110.636       34.59224 1130.852       49.41353 1091.207       48.44255 304.5333 6.658478 299.1480 6.645150 5.385315       9.407090 
1 1 1 3   3  17 o 167.7819 3.173055 343.0637       12.97355 333.2881       18.07230 353.4580       18.63539 165.2982 4.490675 170.2298 4.496216 -4.931641      6.354693 
1 1 1 3   3  18 o 399.9965 6.941522 1951.330       67.66234 1984.265       119.0527 1935.615       82.23483 402.7834 12.14305 398.2901 8.472667 4.493256       14.80675 
1 1 1 3   3  19 o 218.4447 3.738061 581.5980       19.89867 581.3724       28.14921 581.8232       28.13275 218.3688 5.289804 218.4535 5.284659 -0.8476257E-01 7.477275 
1 1 1 3   3  20 o 155.6196 3.140262 295.1511       11.90875 287.6613       16.67193 302.9535       17.01639 153.5481 4.460320 157.5811 4.435675 -4.032990      6.290443 
1 1 1 3   3  21 o 420.0085 7.250021 2152.903       74.20506 2137.934       127.4366 2160.582       91.27525 417.6903 12.53416 420.5842 8.905617 -2.893829      15.37580 
1 1 1 3   3  22 f 224.2681 3.861690 613.1896       21.10479 611.8249       29.76279 614.5698       29.93129 223.9534 5.453557 224.4543 5.472193 -0.5009308     7.725683 
1 1 1 3   3  23 o 224.4803 3.864682 614.4648       21.14112 624.3738       30.08279 604.7955       29.71670 226.1965 5.457529 222.6206 5.477710 3.575897       7.732395 
1 1 1 3   3  24 o 345.3613 6.161170 1456.997       51.85288 1456.216       63.48185 1458.563       89.88183 345.0488 7.549756 344.4978 10.71959 0.5509949      13.11139 
1 1 1 3   3  25 o 61.67494 3.811698 46.58175       5.700802 48.32362       6.951447 43.00418       9.962315 62.75378 4.577157 58.86266 7.087648 3.891125       8.437128 
1 1 1 3   3  26 o 84.69849 3.457574 87.66856       7.121465 87.43279       8.614200 88.17758       12.65757 84.52527 4.195189 84.67159 6.176954 -0.1463165     7.466886 
1 1 1 3   3  27 o 23.39955 6.273130 6.935654       3.649886 7.461161       5.010967 6.341781       5.326950 24.66854 7.593298 23.47791 7.886930 1.190634       10.94814 
1 1 1 3   3  28 o 190.6691 3.577904 443.8186       16.62436 454.0796       23.59205 433.6985       23.42959 192.6143 5.030521 188.2250 5.112741 4.389282       7.172605 
1 1 1 3   3  29 o 40.37948 4.303942 20.15433       4.169896 22.52236       5.664052 17.35203       6.161558 42.51782 5.602862 36.96937 7.097290 5.548454       9.042322 
1 1 1 3   3  30 o 123.8111 3.685619 187.4532       11.10765 180.4379       19.72070 190.7130       13.44284 120.9620 6.716542 124.7848 4.427739 -3.822762      8.044676 
1 1 1 3   3  31 o 116.2146 3.116964 165.0493       8.819345 169.0224       12.40009 160.9821       12.54607 117.4443 4.340147 114.5881 4.501715 2.856178       6.253185 
1 1 1 3   3  32 o 120.7675 3.170974 178.2993       9.324018 182.3745       13.10567 174.1225       13.26813 121.9518 4.417262 119.1286 4.578962 2.823151       6.362318 
1 1 1 3   3  33 o 184.2379 4.102484 415.6693       18.41882 412.6567       30.70252 417.3631       23.02164 182.6039 6.912141 184.2825 5.131436 -1.678635      8.608678 
1 1 1 3   3  34 o 41.05760 4.652670 20.95041       4.573171 20.78440       6.287514 21.13687       6.663754 40.50294 6.597095 40.77232 6.956227 -0.2693710     9.587009 
1 1 1 3   3  35 o 77.25104 3.406657 73.18977       6.397340 67.66549       8.638740 79.89819       9.519691 74.02784 4.814841 80.45322 4.878533 -6.425377      6.854399 
1 1 1 3   3  36 o 33.92324 6.666848 14.78224       5.314682 18.57172       6.563994 7.569576       9.055779 37.95916 7.361752 27.26087 10.16692 10.69829       12.55236 
1 1 1 3   3  37 o 23.77971 7.712599 6.954472       5.108754 11.53314       6.248140 -2.280575      8.873615 29.73318 8.305294 20.34287 9.016328 9.390312       12.25855 
1 1 1 3   3  38 o 82.39809 3.412228 83.55531       6.836763 77.28985       9.314235 90.87421       10.06685 78.83409 4.872191 85.51197 4.850823 -6.677879      6.875226 
1 1 1 3   3  39 o 27.37138 6.702696 9.870886       4.434473 13.30155       6.265498 6.427503       6.277100 31.50208 8.112725 23.66788 8.522717 7.834202       11.76661 
1 1 1 3   3  40 o 82.65350 4.107784 85.18745       8.247873 86.35953       15.18514 84.69696       9.823189 80.88308 7.800821 81.99990 4.938793 -1.116821      9.232794 
1 1 1 3   3  41 f 98.09443 3.368655 119.5758       8.040667 106.1029       10.80217 136.3157       12.04085 91.43102 4.865730 103.7370 4.775890 -12.30597      6.817951 
1 1 1 3   3  42 o 30.92388 5.846594 12.85446       4.244509 13.40103       5.711941 12.18050       6.342785 30.68121 7.662921 28.91539 8.463625 1.765820       11.41724 
1 1 1 3   3  43 f 37.48399 5.564405 18.95793       4.928746 9.794100       7.349371 26.44807       6.644418 25.51150 9.217313 43.71766 6.428644 -18.20616      11.23772 
1 1 1 3   3  44 o 13.06153 5.825107 -0.4494087     3.762445 -0.1323144     5.074306 -0.8366202     5.607335 15.12606 6.754056 15.31921 6.946690 -0.1931419     9.688848 
1 1 1 3   3  45 o 26.19871 6.386212 10.44131       4.039582 4.609703       5.522449 17.15263       5.924365 18.62375 7.631452 32.51781 7.611578 -13.89407      10.77846 
1 1 1 3   3  46 o 16.30947 6.624823 3.520307       4.117593 4.269996       5.155994 2.200365       6.841469 17.48518 7.288634 16.91970 7.672737 0.5654755      10.58277 
1 1 1 3   3  47 o 14.54158 6.388404 1.905603       4.362423 -2.197357      5.061760 13.75300       8.601304 12.70654 6.034802 22.90310 9.468776 -10.19655      11.22838 
1 1 1 3   3  48 o 12.91224 5.777109 1.133827       3.732341 0.4025513      5.187717 1.918522       5.373857 13.60752 6.351425 14.56355 6.678865 -0.9560280     9.216716 
1 1 1 3   3  49 o 12.19864 5.543016 0.9308872      3.592770 3.487323       5.080802 -1.625833      5.081085 14.70401 6.645525 12.04048 5.804867 2.663535       8.823803 
1 1 1 3   3  50 o 9.198265 4.521757 -3.870769      3.528823 -4.712833      4.907090 -2.968909      5.078333 10.43844 5.168645 11.16461 5.475418 -0.7261677     7.529614 
1 1 1 3   4  0  o 914.9291 10.65309 10218.94       237.5195 10107.95       333.6047 10333.05       338.2502 909.0861 15.05882 919.1429 15.10146 -10.05682      21.32656 
1 1 1 3   4  1  o 202.0597 3.350855 497.5622       16.49952 497.2744       23.18730 497.8575       23.48321 201.9827 4.710858 202.1001 4.768203 -0.1174469     6.702831 
1 1 1 3   4  2  o 551.2343 9.219890 3707.656       123.8506 3807.116       154.3497 3527.851       207.5302 558.3741 11.34343 536.7162 15.88469 21.65796       19.51914 
1 1 1 3   4  3  o 1057.681 21.41503 13740.22       551.9625 13790.19       782.5688 13690.74       778.6318 1054.882 30.47460 1051.094 30.43071 3.788208       43.06657 
1 1 1 3   4  4  o 286.4369 4.404781 1000.047       30.74606 972.0428       42.71796 1030.148       44.28748 282.3477 6.208551 290.6625 6.252531 -8.314850      8.811370 
1 1 1 3   4  5  o 205.9271 3.392873 516.8127       17.02618 539.4091       24.60400 496.0483       23.58559 210.3564 4.799696 201.7245 4.797908 8.631912       6.786530 
1 1 1 3   4  6  o 134.2853 3.711660 219.9522       12.13434 0.000000       0.000000 219.9522       12.13434 ?        ?        134.2853 3.711660 0.000000       3.711660 
1 1 1 3   4  7  o 216.4165 4.114669 570.9208       21.70009 567.8858       26.34272 577.3282       38.27595 215.8179 5.008837 217.4089 7.234654 -1.590988      8.799356 
1 1 1 3   4  8  o 388.4728 5.774807 1840.637       54.66813 1878.761       78.30109 1804.380       76.36024 392.2740 8.191101 384.4342 8.150968 7.839752       11.55562 
1 1 1 3   4  9  o 116.5157 2.522618 165.4512       7.162622 165.3930       10.09655 165.5101       10.16273 116.4281 3.562792 116.4684 3.584953 -0.4023743E-01 5.054244 
1 1 1 3   4  10 o 107.8882 2.471509 141.8564       6.497890 140.8887       9.121845 142.8533       9.258486 107.4515 3.488270 108.1975 3.516119 -0.7460556     4.952890 
1 1 1 3   4  11 o 338.0162 5.126420 1393.358       42.22677 1423.300       60.48001 1364.880       58.98346 341.4774 7.267980 334.3983 7.238191 7.079102       10.25743 
1 1 1 3   4  12 o 472.0735 6.926363 2719.081       79.68031 2775.925       114.1937 2665.146       111.2345 476.6505 9.831189 467.0504 9.773264 9.600067       13.86250 
1 1 1 3   4  13 o 515.9507 10.66076 3252.162       134.0394 3252.162       134.0394 0.000000       0.000000 515.9507 10.66076 ?        ?        0.000000       10.66076 
1 1 1 3   4  14 o 827.6133 11.86054 8368.487       239.2038 8541.235       342.9610 8204.849       333.7958 834.9517 16.85572 818.3762 16.73755 16.57556       23.75417 
1 1 1 3   4  15 o 573.0072 8.322148 4005.433       116.2068 4121.560       167.5153 3897.709       161.3411 580.8970 11.83367 564.9150 11.71995 15.98193       16.65512 
1 1 1 3   4  16 o 740.7983 12.29406 6703.981       221.9379 6832.937       388.7323 6641.620       270.3260 745.6264 21.41625 736.8680 15.05435 8.758362       26.17803 
1 1 1 3   4  17 o 119.4202 2.790646 173.7895       8.121172 166.3963       11.25607 181.8166       11.72865 116.7769 3.961163 122.0745 3.947828 -5.297623      5.592509 
1 1 1 3   4  18 o 148.1194 3.555599 267.3873       12.83397 237.8177       21.91622 282.8192       15.83256 139.4993 6.464577 152.2653 4.271136 -12.76607      7.748119 
1 1 1 3   4  19 o 425.4990 6.342383 2207.994       65.76382 2245.503       94.03766 2172.090       92.00388 428.9007 8.997232 421.8354 8.950082 7.065369       12.69071 
1 1 1 3   4  20 o 462.4669 6.844458 2609.187       77.13578 2606.601       109.0420 2611.776       109.1310 461.9514 9.686377 462.4099 9.684674 -0.4585571     13.69740 
1 1 1 3   4  21 o 157.4160 3.615574 302.0551       13.86955 259.8383       21.89153 330.3637       17.92637 145.8128 6.174882 164.5483 4.474722 -18.73552      7.625766 
1 1 1 3   4  22 o 202.3390 3.615240 499.1130       17.82595 495.9413       25.05832 502.3627       25.36387 201.5768 5.105344 202.8764 5.134486 -1.299652      7.240683 
1 1 1 3   4  23 o 182.1312 3.426190 404.4372       15.20659 410.0820       21.56713 398.8566       21.44414 183.2767 4.833126 180.7461 4.873038 2.530624       6.863353 
1 1 1 3   4  24 o 64.37981 3.215523 50.66396       5.028756 44.95989       6.910811 57.08323       7.331269 60.51440 4.723745 68.25648 4.431526 -7.742073      6.477051 
1 1 1 3   4  25 o 44.84755 5.345857 24.91505       5.727527 24.91505       5.727527 0.000000       0.000000 44.84755 5.345857 ?        ?        0.000000       5.345857 
1 1 1 3   4  26 o 133.0596 3.514757 216.1740       11.38668 224.4491       14.07979 200.5301       19.35892 135.5180 4.268795 127.8592 6.231940 7.658806       7.553786 
1 1 1 3   4  27 o 51.14521 3.571763 32.08193       4.423698 35.58139       6.177148 28.39778       6.338062 53.74828 4.765486 47.86359 5.535869 5.884686       7.304499 
1 1 1 3   4  28 o 110.3867 3.014928 148.7882       8.102571 150.5694       11.28268 146.8913       11.64337 110.9371 4.180970 109.5510 4.370173 1.386162       6.048051 
1 1 1 3   4  29 o 55.63203 3.496334 37.93967       4.715982 33.68268       6.355761 43.15457       7.034594 52.21852 5.057930 59.18442 4.921986 -6.965904      7.057521 
1 1 1 3   4  30 o 36.51631 5.837031 16.76012       5.019328 25.44515       9.698613 13.58299       5.865997 44.51754 9.242833 32.55944 7.541493 11.95810       11.92913 
1 1 1 3   4  31 o 106.8737 3.106510 139.6025       8.081993 139.6101       11.27121 139.5945       11.59499 106.7193 4.343100 106.6944 4.469467 0.2494049E-01  6.232066 
1 1 1 3   4  32 o 65.51974 3.956818 52.71296       6.288188 63.49459       10.32967 46.36520       7.926002 71.60669 5.974041 61.22309 5.366769 10.38360       8.030652 
1 1 1 3   4  33 o 167.2492 3.461640 342.0651       14.10854 339.7763       19.64786 344.5016       20.27173 166.3293 4.852605 167.4496 4.973386 -1.120255      6.948550 
1 1 1 3   4  34 o 38.62304 5.057928 18.64101       4.646248 26.11106       6.482449 10.74943       6.662838 45.63770 5.971937 29.12633 8.713099 16.51137       10.56324 
1 1 1 3   4  35 o 59.13761 3.777464 43.03053       5.415314 44.59677       7.403100 41.22793       7.942100 59.97063 5.114454 57.51085 5.743695 2.459778       7.690753 
1 1 1 3   4  36 o 66.87883 4.115688 55.13776       6.675111 55.01598       8.006701 55.41529       12.08752 66.62927 4.966931 66.12966 7.641142 0.4996109      9.113586 
1 1 1 3   4  37 o 25.67324 7.544328 8.459805       5.031225 9.301309       5.971183 6.400091       9.341915 27.00194 8.284838 26.40177 10.21181 0.6001740      13.14989 
1 1 1 3   4  38 o 70.68325 3.547278 61.58839       6.090565 67.38274       8.493082 55.45376       8.738897 73.60831 4.760336 66.53571 5.437083 7.072601       7.226526 
1 1 1 3   4  39 o 15.88017 6.457370 1.449183       3.916997 -0.3350684     5.310302 3.578506       5.801123 16.47511 7.146114 20.42130 8.004741 -3.946182      10.73046 
1 1 1 3   4  40 o 89.34987 3.348852 98.80304       7.278749 98.39375       10.03771 99.25691       10.57035 88.52187 4.669674 88.77512 4.905163 -0.2532425     6.772480 
1 1 1 3   4  41 o 20.44640 7.575097 4.783291       5.011460 4.688253       9.265685 4.822588       5.958143 23.73953 9.822355 21.24843 8.171985 2.491108       12.77732 
1 1 1 3   4  42 o 37.92514 5.524058 19.04093       4.955391 20.55943       7.463132 17.84359       6.627089 37.65233 8.352452 35.30554 7.900390 2.346794       11.49694 
1 1 1 3   4  43 o 25.75533 6.313223 9.363097       3.931156 8.204635       5.232574 10.86428       5.956500 23.69889 7.812887 26.75110 8.286486 -3.052210      11.38890 
1 1 1 3   4  44 o 25.15918 6.549355 9.352283       4.053918 7.248588       5.351488 12.18514       6.210055 21.91270 7.871981 27.28282 8.462647 -5.370119      11.55788 
1 1 1 3   4  45 o 22.42716 7.428713 8.245831       4.728875 6.400153       5.680551 12.41218       8.534741 20.22564 7.923170 24.89586 9.723732 -4.670221      12.54303 
1 1 1 3   4  46 o 11.39959 5.554345 -5.730044      4.981231 -5.730044      4.981231 0.000000       0.000000 11.39959 5.554345 ?        ?        0.000000       5.554345 
1 1 1 3   4  47 o 10.59177 5.028963 -2.368455      3.510043 -6.532037      4.876506 2.107760       5.056275 10.71679 5.277490 15.13259 6.750506 -4.415794      8.568619 
1 1 1 3   4  48 o 19.35934 6.678082 7.132304       3.822771 9.152744       5.427480 5.143222       5.385197 20.08854 7.779934 16.63481 7.205927 3.453733       10.60437 
1 1 1 3   4  49 o 12.32984 5.565587 1.182934       3.550725 1.688398       5.026572 0.6795107      5.016410 13.56990 6.306280 13.02803 6.133185 0.5418701      8.796882 
1 1 1 3   4  50 o 25.19590 7.580031 14.98914       5.031994 18.48918       9.940243 13.78317       5.834860 18.88001 8.805598 21.61223 8.139986 -2.732212      11.99158 
1 1 1 3   5  0  o 510.6390 6.644281 3179.522       82.67955 3482.046       139.1229 3014.335       102.8033 534.0602 10.68987 497.0789 8.486835 36.98126       13.64916 
1 1 1 3   5  1  o 893.5578 14.75708 9765.529       321.3359 10310.59       408.1066 8876.337       521.2558 917.2365 18.25813 848.4632 25.23857 68.77325       31.15036 
1 1 1 3   5  2  o 386.4404 6.622448 1821.015       62.36447 1785.641       75.32112 1898.138       111.2150 382.5950 8.078698 394.0491 11.59443 -11.45410      14.13139 
1 1 1 3   5  3  o 780.1904 15.83528 7451.648       301.0666 7500.674       427.6949 7403.494       423.8755 780.5696 22.50817 775.5118 22.45284 5.057739       31.79226 
1 1 1 3   5  4  f 184.3620 4.428324 414.3043       19.89513 0.000000       0.000000 414.3043       19.89513 ?        ?        184.3620 4.428324 0.000000       4.428324 
1 1 1 3   5  5  f 232.0049 4.267020 656.1060       24.12447 605.8845       39.45652 686.0891       30.48687 222.7452 7.278768 237.2218 5.273783 -14.47653      8.988506 
1 1 1 3   5  6  o 262.3889 5.903630 839.5989       37.74859 825.9099       52.86486 853.8398       53.91991 259.9953 8.354677 264.3571 8.380522 -4.361847      11.83359 
1 1 1 3   5  7  o 204.8844 3.401305 511.6439       16.98207 485.1177       23.30999 541.6476       24.79092 199.4700 4.795439 210.7709 4.826651 -11.30084      6.803881 
1 1 1 3   5  8  o 266.6271 4.854135 866.8715       31.53931 958.4926       58.64064 829.5809       37.41111 279.9977 8.604466 260.7812 5.886921 19.21643       10.42558 
1 1 1 3   5  9  o 231.2053 3.743780 651.6580       21.09328 636.0845       29.36434 668.2610       30.31939 228.3693 5.276506 234.0724 5.315378 -5.703079      7.489643 
1 1 1 3   5  10 o 210.3051 3.505907 539.1271       17.96744 553.1012       25.71286 525.7930       25.11721 212.9678 4.954505 207.6435 4.963830 5.324295       7.013326 
1 1 1 3   5  11 o 330.3399 5.034322 1330.672       40.52642 1316.117       56.69821 1345.876       57.94824 328.4013 7.084813 332.0878 7.160631 -3.686462      10.07319 
1 1 1 3   5  12 o 574.6531 9.615729 4033.320       134.6555 4123.493       167.5054 3868.598       226.3950 580.6816 11.83735 561.2299 16.57165 19.45172       20.36523 
1 1 1 3   5  13 o 575.4781 8.346266 4041.215       117.0461 4039.303       165.4577 4043.129       165.5989 574.9125 11.80998 575.1840 11.81448 -0.2715454     16.70501 
1 1 1 3   5  14 o 353.6368 6.193862 1524.848       53.37712 1535.766       65.47137 1503.205       92.17648 354.8391 7.571535 350.7019 10.79850 4.137115       13.18847 
1 1 1 3   5  15 o 563.0560 9.470051 3868.734       129.9391 3873.813       225.9422 3866.224       158.8336 562.3179 16.50630 562.6615 11.58401 -0.3436279     20.16549 
1 1 1 3   5  16 o 593.6259 8.611048 4299.232       124.5676 4297.426       176.1151 4301.041       176.2152 593.1190 12.18481 593.3681 12.18662 -0.2491455     17.23320 
1 1 1 3   5  17 o 343.2055 6.025531 1436.183       50.39479 1415.185       85.63295 1447.309       62.33130 340.3063 10.33805 344.4715 7.425347 -4.165192      12.72836 
1 1 1 3   5  18 f 484.3542 7.128511 2861.471       84.13911 2804.103       117.3893 2922.080       120.6594 479.2251 10.05201 489.1953 10.12145 -9.970245      14.26488 
1 1 1 3   5  19 o 471.7901 8.066808 2716.228       92.74416 2564.621       155.4424 2800.030       115.5684 457.5300 13.95796 478.8276 9.904304 -21.29764      17.11491 
1 1 1 3   5  20 o 430.8676 7.395176 2265.418       77.64767 2338.409       136.4316 2230.448       94.43364 436.9076 12.82802 427.3671 9.067542 9.540527       15.70919 
1 1 1 3   5  21 o 136.1220 3.019853 225.8381       10.01729 219.2230       14.00832 232.7608       14.33034 134.0237 4.294664 138.1057 4.263136 -4.081970      6.051320 
1 1 1 3   5  22 o 325.8618 5.069171 1295.275       40.25377 1275.238       56.32822 1316.187       57.54617 323.1515 7.152926 328.2948 7.193104 -5.143311      10.14422 
1 1 1 3   5  23 o 204.1993 3.642831 508.4469       18.12715 497.7177       25.25321 519.8516       26.03601 201.8923 5.137050 206.3316 5.182228 -4.439285      7.296901 
1 1 1 3   5  24 o 41.77357 4.123135 21.49537       4.142584 18.11182       5.731526 25.19629       5.994301 37.97979 6.421376 45.08203 5.574985 -7.102245      8.503794 
1 1 1 3   5  25 o 132.3374 3.493990 213.7828       11.25797 217.2583       13.81655 206.9167       19.41977 133.3503 4.257222 129.9394 6.150373 3.410904       7.480042 
1 1 1 3   5  26 o 214.0386 5.318956 560.0488       27.74307 560.0488       27.74307 0.000000       0.000000 214.0386 5.318956 ?        ?        0.000000       5.318956 
1 1 1 3   5  27 o 106.6336 2.979697 138.8238       7.735287 139.6587       10.70427 137.9112       11.19063 106.8571 4.118425 106.1637 4.334678 0.6934738      5.979202 
1 1 1 3   5  28 o 24.33829 6.158782 7.541344       3.655164 8.621661       4.962314 6.260018       5.404287 26.16022 7.434772 23.42309 7.943921 2.737131       10.88034 
1 1 1 3   5  29 o 40.27869 4.419855 20.07368       4.267120 16.57932       5.691406 24.55953       6.448493 36.17593 6.702775 44.33350 6.132922 -8.157566      9.085149 
1 1 1 3   5  30 o 74.10513 3.956214 67.31959       7.118482 73.08264       13.26636 64.98938       8.435735 76.71107 7.180154 72.70384 4.787994 4.007225       8.630151 
1 1 1 3   5  31 o 119.0749 3.144812 173.2897       9.117392 174.6315       12.79289 171.9046       12.99742 119.3608 4.405720 118.4066 4.512745 0.9541855      6.306761 
1 1 1 3   5  32 o 229.0966 4.604411 643.1976       25.70566 641.3029       43.06230 644.2465       32.04056 227.4238 7.781536 228.8459 5.749962 -1.422028      9.675451 
1 1 1 3   5  33 o 175.7213 3.537681 377.6830       15.14884 393.4024       21.53373 362.2809       21.31531 178.9472 4.942817 171.6717 5.100807 7.275497       7.102794 
1 1 1 3   5  34 o 91.54511 3.265573 102.6258       7.273348 108.0305       10.01312 96.58877       10.58262 93.74015 4.395607 88.52260 4.925140 5.217552       6.601391 
1 1 1 3   5  35 o 89.29615 3.264572 97.71671       7.091914 96.47253       9.645274 99.18094       10.46359 88.49972 4.487000 89.66582 4.806264 -1.166107      6.575207 
1 1 1 3   5  36 o 95.76772 3.713663 112.6622       8.650352 111.8616       10.32143 114.5518       15.85702 95.25629 4.458787 95.65112 6.848236 -0.3948288     8.171849 
1 1 1 3   5  37 o 81.65408 3.869296 82.15020       7.677303 88.78803       9.318959 68.12826       13.54435 84.72475 4.530048 73.11327 7.718317 11.61148       8.949512 
1 1 1 3   5  38 o 79.14984 3.350225 77.11867       6.447284 78.99003       8.890841 75.04320       9.363156 79.75150 4.594199 77.59924 4.977658 2.152252       6.773754 
1 1 1 3   5  39 o 85.17195 3.366839 89.52143       6.974267 88.04088       9.507370 91.24635       10.26201 83.97798 4.664104 85.36724 4.954217 -1.389259      6.804273 
1 1 1 3   5  40 o 27.84685 6.395171 10.32033       4.248119 4.913232       5.523740 18.14848       6.646308 21.23204 7.936027 36.60630 7.695238 -15.37425      11.05429 
1 1 1 3   5  41 o 76.18047 4.238930 73.15883       7.838269 56.26581       13.57664 81.60467       9.599752 63.14527 9.084059 79.99183 4.948917 -16.84656      10.34466 
1 1 1 3   5  42 o 37.72905 5.625295 18.94089       5.014152 27.07962       7.794672 13.19555       6.549040 43.89165 7.560328 29.87845 8.557340 14.01320       11.41870 
1 1 1 3   5  43 o 15.20244 6.208253 1.820977       3.639247 -0.1599152     4.747195 4.644471       5.667612 14.95814 6.613938 19.93238 7.881698 -4.974237      10.28909 
1 1 1 3   5  44 o 21.42594 7.064146 6.879509       4.277682 4.771523       5.136654 11.64948       7.726884 19.15681 7.525397 25.87198 9.436097 -6.715174      12.06945 
1 1 1 3   5  45 o 15.06670 6.269005 2.181827       3.804214 -1.789582      5.206097 6.731947       5.572517 13.76367 6.403642 20.43397 7.891421 -6.670302      10.16273 
1 1 1 3   5  46 o 24.97322 7.259775 10.79220       4.680897 10.81363       5.459583 10.73273       9.094488 24.05413 7.982547 21.98925 9.443480 2.064880       12.36529 
1 1 1 3   5  47 o 11.73263 5.386718 -0.5388517     3.509202 -3.566779      4.845229 2.801790       5.089282 11.77769 5.675753 15.57409 6.868847 -3.796400      8.910400 
1 1 1 3   5  48 o 11.15109 5.220506 -0.9832063     3.548362 -3.518698      4.851577 1.933049       5.203130 11.41416 5.543216 14.37201 6.583894 -2.957856      8.606677 
1 1 1 3   5  49 o 16.70932 6.559347 5.760812       3.900147 9.491074       5.581810 2.202336       5.451769 18.96533 7.709720 13.97355 6.518556 4.991787       10.09611 
1 1 1 3   5  50 o 10.01647 4.922031 -3.700795      4.167951 -10.38595      8.437604 -1.543042      4.793629 11.57692 5.869240 11.44447 5.546684 0.1324501      8.075499 
1 1 1 3   6  0  o 496.9410 8.359689 3012.875       101.2351 2697.978       162.6679 3211.935       129.3333 469.4622 14.23532 512.9174 10.34730 -43.45526      17.59861 
1 1 1 3   6  1  o 439.1092 7.440032 2351.841       79.61289 2138.196       129.2684 2482.396       101.0514 418.0781 12.70291 451.0074 9.194380 -32.92938      15.68121 
1 1 1 3   6  2  o 404.8208 6.900657 1998.658       68.07526 1889.848       113.2422 2060.230       85.18585 393.1135 11.83448 410.9092 8.507177 -17.79565      14.57487 
1 1 1 3   6  3  o 464.7878 7.860614 2635.564       89.03224 2695.512       110.5154 2524.716       150.2787 469.8911 9.651385 454.1277 13.59479 15.76337       16.67236 
1 1 1 3   6  4  o 326.8289 6.994338 1302.939       55.70614 1237.184       76.97632 1375.240       80.71754 318.1428 9.941048 335.4462 9.885141 -17.30341      14.01929 
1 1 1 3   6  5  o 373.4122 7.938587 1701.626       72.23834 1837.973       107.2400 1588.364       97.74045 387.6007 11.36594 360.3264 11.14460 27.27435       15.91813 
1 1 1 3   6  6  o 805.7546 13.36764 7950.513       262.4785 8846.358       490.1368 7590.296       310.8014 845.0197 23.82583 786.3593 16.21906 58.66040       28.82236 
1 1 1 3   6  7  o 293.1349 4.511768 1047.684       32.22926 1098.781       46.92028 1002.038       44.34665 300.0961 6.415997 286.5847 6.349972 13.51144       9.027023 
1 1 1 3   6  8  o 181.9486 3.152778 403.5101       13.97907 402.2154       19.72130 404.8174       19.81782 181.6250 4.455781 182.2113 4.463181 -0.5863342     6.306661 
1 1 1 3   6  9  o 365.2261 5.471039 1626.993       48.69313 1584.661       67.66309 1672.464       70.12800 360.2575 7.707306 370.0966 7.775713 -9.839111      10.94825 
1 1 1 3   6  10 o 418.0651 7.129375 2133.115       72.63257 2095.871       88.16803 2211.769       128.1258 414.2272 8.734467 424.8143 12.38984 -10.58707      15.15912 
1 1 1 3   6  11 o 176.5385 3.576554 379.8765       15.38652 367.6173       18.70411 405.5380       27.06129 173.5936 4.425084 182.2390 6.102164 -8.645401      7.537756 
1 1 1 3   6  12 o 399.8545 5.954445 1949.712       58.02023 1970.235       82.56524 1929.690       81.55016 401.7859 8.432695 397.6317 8.416040 4.154266       11.91386 
1 1 1 3   6  13 o 253.2433 4.060039 781.6683       25.05557 789.8561       35.57297 773.6073       35.29649 254.5252 5.735262 251.8931 5.750150 2.632065       8.121420 
1 1 1 3   6  14 o 235.0310 5.585603 673.4308       31.99125 674.9587       45.43636 671.9287       45.05103 235.0984 7.942219 234.5728 7.892415 0.5256042      11.19683 
1 1 1 3   6  15 o 450.1186 6.646370 2470.504       72.90337 2441.769       102.2921 2500.167       103.9292 447.3267 9.383855 452.6415 9.422090 -5.314850      13.29784 
1 1 1 3   6  16 f 370.2631 5.588392 1671.351       50.42354 1682.260       71.55118 1660.589       71.07057 371.3664 7.906387 368.9667 7.904356 2.399689       11.17988 
1 1 1 3   6  17 o 272.9442 4.354200 908.0574       28.96133 867.9041       39.84122 953.0490       42.17320 266.7934 6.128037 279.5720 6.190231 -12.77853      8.710443 
1 1 1 3   6  18 o 611.5345 10.22633 4566.896       152.3971 4629.093       265.3683 4536.289       186.1554 614.0515 17.75269 609.1384 12.54075 4.913086       21.73542 
1 1 1 3   6  19 o 159.6741 4.488335 311.0516       17.44716 0.000000       0.000000 311.0516       17.44716 ?        ?        159.6741 4.488335 0.000000       4.488335 
1 1 1 3   6  20 o 430.6209 6.417428 2262.139       67.34296 2255.213       94.98695 2269.138       95.48969 429.7032 9.071085 431.0255 9.091120 -1.322296      12.84263 
1 1 1 3   6  21 o 102.8395 2.891235 129.0032       7.238494 125.9522       10.09093 132.2372       10.38914 101.5588 4.085683 104.0648 4.104802 -2.505997      5.791564 
1 1 1 3   6  22 o 261.9828 4.276784 837.0040       27.30400 809.1036       37.77290 867.5346       39.51323 257.4701 6.020290 266.6002 6.081994 -9.130066      8.557718 
1 1 1 3   6  23 o 146.9237 3.115014 263.1777       11.15290 264.0829       15.68190 262.2513       15.86487 147.0683 4.380541 146.5523 4.447445 0.5160065      6.242508 
1 1 1 3   6  24 o 247.1862 4.738209 745.7953       28.54134 745.1746       34.95960 747.0360       49.42449 246.9740 5.808704 246.8192 8.228766 0.1547394      10.07242 
1 1 1 3   6  25 o 184.1417 3.451912 413.6449       15.48988 410.2368       21.64228 417.2243       22.17960 183.2114 4.851731 184.7570 4.930658 -1.545624      6.917419 
1 1 1 3   6  26 o 129.5386 3.523110 204.9190       11.11112 212.0759       13.52395 190.0542       19.49043 131.7195 4.218695 124.4118 6.450741 7.307663       7.707752 
1 1 1 3   6  27 o 248.9296 4.815945 757.5125       29.21420 756.1395       35.75623 760.2693       50.66777 248.4983 5.904623 248.4177 8.381765 0.8061218E-01  10.25273 
1 1 1 3   6  28 o 31.51947 5.117748 12.46471       3.796209 12.44361       5.110002 12.49070       5.671019 31.23522 6.897870 31.25660 7.534199 -0.2138138E-01 10.21493 
1 1 1 3   6  29 o 144.4274 3.205956 254.6498       11.28349 247.9423       15.57053 262.0677       16.37433 142.3101 4.495485 146.2956 4.598709 -3.985489      6.430980 
1 1 1 3   6  30 o 108.5704 3.060740 144.0261       8.089849 154.2652       11.37019 133.5287       11.51269 112.2360 4.164408 104.3581 4.537893 7.877907       6.159121 
1 1 1 3   6  31 f 67.59750 4.970792 56.30939       8.131009 0.000000       0.000000 56.30939       8.131009 ?        ?        67.59750 4.970792 0.000000       4.970792 
1 1 1 3   6  32 o 85.81193 3.194513 90.10142       6.668523 92.98112       9.154163 86.84539       9.733950 87.02302 4.330269 84.02533 4.773456 2.997688       6.444929 
1 1 1 3   6  33 o 253.8021 4.321164 789.4758       26.72588 793.4970       37.63218 785.3838       37.96220 253.7202 6.086509 252.3784 6.172528 1.341766       8.668661 
1 1 1 3   6  34 o 142.5244 3.305960 248.4880       11.48214 239.7483       15.63484 258.7203       16.91729 139.6634 4.600103 145.0365 4.793077 -5.373077      6.643383 
1 1 1 3   6  35 o 14.05291 6.303546 -1.979801      4.474448 -3.400497      5.211158 2.006377       8.728951 14.45742 6.610186 22.86889 9.504155 -8.411475      11.57685 
1 1 1 3   6  36 o 21.67107 6.995869 5.722288       4.206349 7.176610       5.491168 3.657056       6.543633 24.32129 8.002930 21.62568 8.494191 2.695616       11.67040 
1 1 1 3   6  37 o 62.79410 4.170106 48.77148       6.345042 48.16019       7.517719 50.28534       11.83059 62.19506 5.002298 62.58726 7.934918 -0.3922005     9.380080 
1 1 1 3   6  38 o 71.22749 3.451623 62.54205       5.973272 64.53496       8.197566 60.28612       8.721745 72.00455 4.697497 69.42040 5.193247 2.584145       7.002592 
1 1 1 3   6  39 o 73.50288 3.449770 66.78798       6.161937 60.14766       8.204011 75.38241       9.333416 69.23875 4.893822 77.51619 4.967106 -8.277443      6.972922 
1 1 1 3   6  40 o 52.01341 4.120746 33.93176       5.180435 32.18997       6.885621 36.20366       7.863952 49.98389 5.758069 52.80674 6.230884 -2.822853      8.484059 
1 1 1 3   6  41 o 21.04563 8.217257 4.595966       6.093453 0.000000       0.000000 4.595966       6.093453 ?        ?        21.04563 8.217257 0.000000       8.217257 
1 1 1 3   6  42 o 43.99988 4.376751 24.90346       4.630719 21.91314       6.183113 28.72319       6.988192 39.97650 6.575379 45.98267 6.410430 -6.006168      9.183094 
1 1 1 3   6  43 o 23.08702 6.497156 7.639500       3.808683 7.028690       5.037857 8.454333       5.818718 22.10803 7.664355 23.79469 8.237576 -1.686653      11.25167 
1 1 1 3   6  44 o 11.95078 5.444909 -1.209921      3.495847 -2.349538      4.566175 0.4040760      5.434061 12.91875 6.006008 15.75214 7.014347 -2.833388      9.234348 
1 1 1 3   6  45 o 24.53143 7.377000 10.04003       4.766781 7.022739       5.615812 17.81750       9.016191 20.59132 7.929979 28.51551 10.22099 -7.924194      12.93651 
1 1 1 3   6  46 o 16.13389 6.368156 3.662563       3.693795 3.537010       5.043155 3.807871       5.425395 16.65550 7.089268 17.04715 7.306969 -0.3916473     10.18084 
1 1 1 3   6  47 o 13.48573 6.040463 1.029605       4.092716 -0.8044513     5.074635 4.442451       6.922401 13.26564 6.220924 17.12459 7.746553 -3.858956      9.935239 
1 1 1 3   6  48 o 16.15726 6.402669 4.692179       3.747545 5.346066       5.257723 4.016919       5.342964 16.59201 7.153518 15.64152 6.960797 0.9504976      9.981258 
1 1 1 3   6  49 o 12.07522 5.482775 0.9818012      3.506896 1.395627       4.926681 0.5567626      4.992982 13.26709 6.191549 12.86585 6.075746 0.4012432      8.674674 
1 1 1 3   7  0  o 579.5246 7.496754 4096.967       105.8720 3951.083       163.2768 4202.801       139.0706 568.6204 11.78327 586.7256 9.726672 -18.10529      15.27919 
1 1 1 3   7  1  o 663.9897 9.554812 5382.474       154.6036 5538.524       222.8920 5237.781       214.6272 672.8704 13.59336 654.3724 13.45934 18.49805       19.12938 
1 1 1 3   7  2  o 82.37247 2.236148 82.74445       4.484529 81.08071       6.293125 84.46099       6.392200 81.50375 3.174563 83.18857 3.158933 -1.684822      4.478472 
1 1 1 3   7  3  o 205.8781 3.424550 516.5933       17.18106 523.2281       24.43270 510.1030       24.16487 207.1670 4.839661 204.5519 4.847801 2.615051       6.850072 
1 1 1 3   7  4  o 230.3132 3.720039 646.5477       20.87865 654.3277       29.70492 638.9515       29.35198 231.6529 5.262044 228.9149 5.261715 2.738022       7.441421 
1 1 1 3   7  5  o 253.0930 4.011678 780.8540       24.74242 895.7089       54.89792 751.5765       27.71714 270.7309 8.331037 248.2852 4.581011 22.44571       9.507463 
1 1 1 3   7  6  o 112.2428 2.166380 153.5288       5.925559 145.8702       9.378390 158.6178       7.644837 109.3369 3.524464 114.0825 2.749875 -4.745598      4.470309 
1 1 1 3   7  7  o 293.8609 4.532656 1052.930       32.45867 1040.387       45.59062 1065.823       46.22290 292.0016 6.406991 295.5489 6.417884 -3.547211      9.068559 
1 1 1 3   7  8  o 517.8318 7.547046 3273.781       95.23615 3488.973       140.5636 3091.172       129.4859 534.0226 10.80133 502.7012 10.57003 31.32144       15.11272 
1 1 1 3   7  9  o 143.7033 3.148822 251.6999       11.02683 255.6828       13.86428 244.8431       18.19124 144.7690 3.933582 141.5917 5.281414 3.177292       6.585317 
1 1 1 3   7  10 o 386.7182 5.766062 1823.990       54.33881 1795.503       76.04748 1853.708       77.67161 383.4995 8.137368 389.6618 8.179718 -6.162354      11.53796 
1 1 1 3   7  11 o 273.5132 4.296802 911.9292       28.63912 910.0198       40.41224 913.8556       40.59201 273.1644 6.070895 273.7389 6.085103 -0.5744934     8.595593 
1 1 1 3   7  12 o 265.6192 4.206837 859.9725       27.23023 873.9191       38.83055 846.4780       38.19600 267.7152 5.952022 263.4786 5.948896 4.236572       8.415219 
1 1 1 3   7  13 o 414.6131 7.136631 2096.480       72.10616 2061.125       124.3932 2114.372       88.48941 410.5306 12.44850 416.2842 8.722988 -5.753540      15.20052 
1 1 1 3   7  14 o 515.7441 8.712613 3245.101       109.5012 3216.844       133.0521 3304.414       192.7671 513.3335 10.63619 519.5341 15.24237 -6.200562      18.58652 
1 1 1 3   7  15 o 354.4111 5.370098 1531.212       46.37946 1522.394       65.29498 1540.191       65.88998 353.3024 7.583979 355.3604 7.608767 -2.057953      10.74291 
1 1 1 3   7  16 o 399.6245 5.975508 1947.128       58.19196 1944.348       82.18717 1949.922       82.40498 399.2087 8.448273 399.7799 8.458559 -0.5711670     11.95494 
1 1 1 3   7  17 o 451.9044 6.683601 2490.520       73.60261 2450.606       102.9572 2532.239       105.2607 448.0692 9.429213 455.4662 9.483612 -7.396973      13.37344 
1 1 1 3   7  18 o 581.1620 9.746493 4124.098       138.0326 4442.025       250.2494 3985.075       165.4825 601.5787 17.08775 570.9844 11.89301 30.59424       20.81910 
1 1 1 3   7  19 o 187.8540 4.861169 430.5320       22.23474 0.000000       0.000000 430.5320       22.23474 ?        ?        187.8540 4.861169 0.000000       4.861169 
1 1 1 3   7  20 o 248.9692 4.103515 755.6616       24.89647 768.2374       35.45670 743.4313       34.96626 250.9662 5.797584 246.8805 5.812010 4.085678       8.209229 
1 1 1 3   7  21 o 356.8210 5.458210 1553.181       47.46099 1592.523       68.12156 1516.070       66.16132 361.0955 7.741522 352.3252 7.705919 8.770355       10.92302 
1 1 1 3   7  22 o 389.4442 5.892141 1851.308       55.91837 1853.788       79.05456 1848.825       79.10650 389.3550 8.331920 388.8307 8.348635 0.5242615      11.79494 
1 1 1 3   7  23 o 123.9918 3.359746 187.6015       10.14227 180.7699       12.31525 202.0021       17.88008 121.6626 4.159961 128.4915 5.724676 -6.828835      7.076524 
1 1 1 3   7  24 o 334.1438 5.191121 1363.525       42.26984 1275.607       57.19201 1469.365       62.75118 322.8386 7.269654 346.4561 7.432546 -23.61743      10.39666 
1 1 1 3   7  25 o 229.7052 3.933405 643.9650       22.01789 644.6191       30.96283 643.2959       31.31617 229.6372 5.533020 229.3921 5.602144 0.2451630      7.873901 
1 1 1 3   7  26 o 134.2680 3.559121 220.1694       11.63505 221.6157       13.98032 216.9104       20.98645 134.6407 4.266315 132.9105 6.499235 1.730225       7.774413 
1 1 1 3   7  27 o 169.3763 3.358642 350.1301       13.86285 341.2386       19.14777 359.9247       20.09668 167.0129 4.709404 171.5131 4.813054 -4.500168      6.733793 
1 1 1 3   7  28 o 215.0531 4.387275 565.3134       22.99199 558.1090       27.93994 580.4260       40.46640 213.4405 5.375987 217.0668 7.662079 -3.626297      9.359952 
1 1 1 3   7  29 o 167.4213 3.368685 342.2802       13.74381 336.1024       18.99554 349.0671       19.91006 165.6640 4.710082 168.8067 4.845031 -3.142685      6.757158 
1 1 1 3   7  30 o 67.47811 3.619692 55.79920       5.930322 60.24263       8.888404 52.23424       7.961439 69.90759 5.256000 65.09750 5.058371 4.810097       7.294701 
1 1 1 3   7  31 o 76.11019 3.897520 71.03530       7.204746 83.51237       14.46475 66.91845       8.308772 81.92402 7.322542 73.76461 4.645839 8.159409       8.671992 
1 1 1 3   7  32 o 230.1278 4.039331 648.2849       22.65242 651.6498       31.89535 644.8601       32.17722 230.2003 5.685720 228.8949 5.773285 1.305328       8.102977 
1 1 1 3   7  33 o 155.1170 3.372647 294.2533       12.74871 285.9318       17.41592 303.8600       18.71264 152.5765 4.689632 157.2371 4.889586 -4.660645      6.775005 
1 1 1 3   7  34 o 58.26126 3.814361 41.75911       5.385708 40.01316       7.212767 43.95923       8.096726 56.77394 5.273639 59.45085 5.656850 -2.676914      7.733771 
1 1 1 3   7  35 o 142.4061 3.801340 248.8377       13.17993 257.5221       16.16109 231.5912       22.77471 144.6405 4.590872 136.2930 6.879388 8.347427       8.270555 
1 1 1 3   7  36 o 39.59641 4.806505 19.60745       4.543036 20.58100       6.130335 18.42143       6.766284 40.18419 6.480680 37.68024 7.630826 2.503956       10.01143 
1 1 1 3   7  37 o 108.7946 3.260424 145.3445       8.634306 138.8858       11.54578 153.5398       13.00567 105.9826 4.480574 111.3223 4.805501 -5.339745      6.570265 
1 1 1 3   7  38 o 50.45193 4.139999 31.65852       5.045224 32.60722       6.701345 30.41719       7.665505 50.82183 5.498435 48.68321 6.633789 2.138615       8.616261 
1 1 1 3   7  39 o 70.79494 3.519267 62.04929       6.052389 59.68667       8.032154 65.15308       9.206206 68.95914 4.809891 71.84301 5.295698 -2.883873      7.153983 
1 1 1 3   7  40 o 56.84633 3.840019 40.38455       5.288298 42.22676       7.119732 38.11740       7.898281 57.58257 5.127408 54.21511 6.083076 3.367466       7.955761 
1 1 1 3   7  41 o 88.31610 3.356787 97.24998       7.211215 82.94038       9.547324 116.2570       11.00337 80.52544 4.888358 95.50924 4.742470 -14.98380      6.810805 
1 1 1 3   7  42 o 21.55696 7.784441 6.128059       5.241137 -0.4250813     9.526814 8.972264       6.276295 20.19935 9.117268 24.94586 8.558693 -4.746502      12.50503 
1 1 1 3   7  43 o 23.35110 6.574194 7.891797       3.898699 5.276984       5.033566 11.81258       6.163710 20.01889 7.555917 27.40411 8.419022 -7.385221      11.31246 
1 1 1 3   7  44 o 12.31377 5.545966 -0.6989881     3.503201 -4.174644      4.579100 4.206251       5.439911 11.92150 5.683929 18.59139 7.591030 -6.669895      9.483185 
1 1 1 3   7  45 f 16.75757 6.471725 3.883048       3.747881 5.103506       4.842945 2.060747       5.917772 18.47246 7.291584 16.57500 7.353807 1.897463       10.35595 
1 1 1 3   7  46 o 14.61378 6.056732 2.439878       3.531296 5.674284       4.828930 -1.277974      5.177258 18.44403 7.280819 13.50885 6.318344 4.935181       9.640114 
1 1 1 3   7  47 o 21.11992 7.050324 8.393471       4.257559 14.51578       5.379122 -1.874520      6.966211 27.24570 7.739868 14.19048 6.830152 13.05522       10.32262 
1 1 1 3   7  48 o 13.94509 6.270587 2.164282       4.458113 12.21595       9.036819 -1.068873      5.125189 19.18984 8.747431 12.58148 6.002680 6.608365       10.60894 
1 1 1 3   7  49 o 15.50713 6.342465 4.738206       3.805534 4.841776       5.199115 4.618680       5.585288 15.36696 6.850770 15.21334 6.912227 0.1536255      9.732005 
1 1 1 3   8  0  o 385.2856 5.138940 1809.909       48.24945 1776.076       75.16607 1833.619       62.92440 381.4830 8.085569 387.7146 6.659948 -6.231628      10.47527 
1 1 1 3   8  1  o 305.8683 5.408134 1140.773       40.31049 1137.013       69.29275 1142.697       49.55962 304.9969 9.333999 306.0679 6.644681 -1.071014      11.45754 
1 1 1 3   8  2  o 517.2769 8.706298 3266.874       109.7470 3204.934       132.5222 3402.080       195.7949 512.0968 10.61941 526.5488 15.27516 -14.45203      18.60383 
1 1 1 3   8  3  f 250.1612 5.630723 763.2048       34.32576 785.7375       48.65619 740.8788       48.43250 253.5947 7.882965 246.2245 8.082737 7.370224       11.29034 
1 1 1 3   8  4  o 410.3480 5.427362 2053.599       54.27218 2098.509       87.03402 2025.026       69.42271 414.5171 8.616096 407.3580 6.993413 7.159119       11.09707 
1 1 1 3   8  5  o 175.4521 3.094249 375.1989       13.22970 383.1669       27.61259 372.8249       15.07228 177.0972 6.408792 174.8876 3.536583 2.209549       7.319838 
1 1 1 3   8  6  o 75.21866 2.161122 69.00594       3.957222 68.19662       5.969897 69.64024       5.285169 74.72693 3.286375 75.53526 2.876520 -0.8083344     4.367451 
1 1 1 3   8  7  o 328.1962 5.730283 1313.915       45.82956 1326.195       56.74463 1290.878       77.72095 329.6289 7.064207 324.8004 9.830725 4.828461       12.10563 
1 1 1 3   8  8  o 207.3998 3.960639 524.3828       20.01749 531.3401       25.01236 511.9881       33.38505 208.7418 4.917102 204.7259 6.700830 4.015869       8.311379 
1 1 1 3   8  9  o 421.5165 6.239933 2167.391       64.09595 2314.576       94.53931 2042.184       87.19605 435.3323 8.911594 408.9319 8.750034 26.40045       12.48918 
1 1 1 3   8  10 o 631.0941 9.114124 4863.034       140.1668 4831.685       197.2156 4895.033       199.2517 628.3994 12.87862 632.4955 12.92732 -4.096130      18.24759 
1 1 1 3   8  11 o 652.7759 9.412776 5201.863       149.7332 5099.062       208.8847 5310.515       214.7463 645.6882 13.27540 658.9218 13.37383 -13.23364      18.84398 
1 1 1 3   8  12 o 434.1637 7.435853 2299.109       78.67204 2372.940       139.9738 2265.016       95.11744 440.4172 13.05648 430.8254 9.059886 9.591797       15.89192 
1 1 1 3   8  13 o 486.1230 7.126288 2881.868       84.42007 2790.012       116.8700 2982.089       122.0761 478.1103 10.03088 494.2852 10.13484 -16.17493      14.25950 
1 1 1 3   8  14 o 745.0225 12.37779 6780.519       224.7235 6934.456       279.1423 6497.002       378.8284 752.9380 15.21354 727.1154 21.40307 25.82263       26.25915 
1 1 1 3   8  15 o 651.0953 9.410203 5173.364       149.3068 5255.840       213.7644 5094.799       208.6326 655.7430 13.37721 645.6364 13.26044 10.10663       18.83585 
1 1 1 3   8  16 o 522.4094 7.635779 3328.991       97.20763 3304.915       136.8256 3353.529       138.1284 520.2274 10.79289 524.0370 10.81645 -3.809631      15.28013 
1 1 1 3   8  17 o 677.4764 11.27692 5607.366       186.1747 5571.810       319.9289 5625.572       228.9290 673.2520 19.52084 678.1132 13.85359 -4.861267      23.93711 
1 1 1 3   8  18 o 563.6338 8.210654 3877.060       112.7745 3899.599       160.0691 3854.845       158.9117 564.8109 11.62970 561.5632 11.61237 3.247681       16.43463 
1 1 1 3   8  19 o 400.8392 6.986212 1960.396       68.24142 1871.500       115.7358 2007.773       84.49143 390.9136 12.16409 405.5153 8.550064 -14.60165      14.86838 
1 1 1 3   8  20 o 331.1652 7.253111 1338.703       58.53358 0.000000       0.000000 1338.703       58.53358 ?        ?        331.1652 7.253111 0.000000       7.253111 
1 1 1 3   8  21 o 472.4721 6.995477 2725.827       80.54333 2695.160       112.9891 2757.510       114.8445 469.3025 9.879789 474.6898 9.928053 -5.387360      14.00630 
1 1 1 3   8  22 f 191.8288 3.981944 448.7743       18.61423 434.0627       22.54306 480.2983       32.99915 188.5502 4.910432 198.1592 6.843917 -9.609024      8.423274 
1 1 1 3   8  23 o 174.6889 3.343309 372.1258       14.23239 371.4911       19.85380 372.7968       20.41314 174.4098 4.675506 174.7055 4.799310 -0.2957001     6.700278 
1 1 1 3   8  24 o 290.9889 4.644087 1033.766       32.93161 1008.824       45.72089 1060.655       47.47319 287.1783 6.533215 294.4484 6.616116 -7.270111      9.298165 
1 1 1 3   8  25 o 83.19707 2.916218 84.52268       5.903261 91.44484       8.149027 76.87879       8.563317 86.47137 3.877067 79.21935 4.453763 7.252014       5.904883 
1 1 1 3   8  26 o 53.26669 3.328538 34.75721       4.299019 34.63414       5.654189 34.92583       6.618526 53.06421 4.412415 53.19599 5.170756 -0.1317825     6.797509 
1 1 1 3   8  27 o 308.9970 5.691792 1169.099       42.85873 1126.613       51.01856 1270.978       79.00355 302.9783 6.910041 320.3256 10.13364 -17.34735      12.26537 
1 1 1 3   8  28 o 145.3243 3.175703 257.7781       11.24642 251.0611       15.42323 265.4049       16.43457 143.2326 4.424034 147.2477 4.585678 -4.015076      6.371854 
1 1 1 3   8  29 o 189.1886 4.859209 438.4632       22.38396 434.2599       30.50643 443.3653       32.94550 187.8326 6.675372 189.6565 7.141160 -1.823898      9.775313 
1 1 1 3   8  30 o 100.7940 3.060549 124.1664       7.508731 123.3868       10.34416 125.0346       10.91688 100.3359 4.240163 100.9754 4.447474 -0.6394653     6.144836 
1 1 1 3   8  31 o 122.5752 3.788523 183.9221       11.30282 157.2598       19.73901 196.9292       13.78687 112.6241 7.230331 126.7254 4.471434 -14.10136      8.501259 
1 1 1 3   8  32 o 87.30655 3.173287 93.27238       6.740145 100.1520       9.317987 85.72227       9.761478 90.32484 4.245175 83.45592 4.820302 6.868919       6.423147 
1 1 1 3   8  33 o 134.0118 3.229826 219.5890       10.54771 219.1925       14.54740 220.0285       15.31566 133.6033 4.474510 133.8034 4.704447 -0.2001648     6.492538 
1 1 1 3   8  34 o 33.64724 6.105227 14.40934       4.821656 14.61549       5.728765 13.90856       8.928789 33.68066 7.198182 33.02470 10.13061 0.6559563      12.42751 
1 1 1 3   8  35 o 64.04434 3.599078 50.42558       5.594448 43.57570       7.254743 60.47489       8.787165 59.24886 5.073436 69.83772 5.200576 -10.58885      7.265380 
1 1 1 3   8  36 o 18.63079 6.792228 3.587891       4.002934 4.779975       5.042525 1.556608       6.582333 21.13810 7.635209 19.90309 8.260816 1.235014       11.24889 
1 1 1 3   8  37 o 46.67472 4.269223 27.09064       4.802149 27.64067       6.352162 26.35702       7.336149 46.79335 5.687232 45.32753 6.855482 1.465820       8.907426 
1 1 1 3   8  38 o 38.14879 5.639071 18.58575       5.084564 17.93372       5.817779 20.69451       10.46250 37.13679 6.673913 38.62718 10.73156 -1.490395      12.63754 
1 1 1 3   8  39 o 96.93285 3.285852 116.0646       7.750447 110.1802       10.34021 123.6092       11.70844 93.86469 4.533955 99.24718 4.855849 -5.382492      6.643494 
1 1 1 3   8  40 o 11.82263 5.560546 -3.968832      4.106450 -9.878967      5.431325 3.918103       6.274241 11.59916 5.683153 20.81046 8.272307 -9.211305      10.03640 
1 1 1 3   8  41 o 24.33662 6.729167 8.147219       4.124516 12.11805       5.396127 2.567575       6.396536 29.34451 7.514201 19.47399 8.118002 9.870523       11.06188 
1 1 1 3   8  42 o 12.10019 5.812842 -6.048003      4.989734 -9.645369      8.748808 -4.313729      6.074569 15.73941 7.595363 14.51325 6.806087 1.226158       10.19864 
1 1 1 3   8  43 o 38.23312 4.794519 19.51115       4.369087 13.95835       5.489259 29.10968       7.217055 30.40685 7.464218 45.00409 6.791943 -14.59724      10.09183 
1 1 1 3   8  44 o 16.17096 6.566747 2.824176       4.044409 4.819220       4.607110 -3.879192      8.444984 18.64579 7.182091 16.33834 7.769761 2.307451       10.58072 
1 1 1 3   8  45 o 14.90712 6.174571 2.336039       3.666962 4.454661       4.838534 -0.5228544     5.620642 17.73507 7.189650 14.69095 6.771235 3.044125       9.876268 
1 1 1 3   8  46 o 30.08427 5.679553 13.84318       4.011206 10.69127       5.440035 17.59856       5.938027 23.47351 7.970050 31.07809 7.841946 -7.604586      11.18114 
1 1 1 3   8  47 o 18.94879 7.270906 7.050079       4.709203 17.47957       9.110208 3.247165       5.501169 23.69451 9.765366 15.72147 7.025291 7.973043       12.02984 
1 1 1 3   8  48 o 8.269699 4.127084 -6.427250      3.383944 -5.126276      4.751025 -7.766818      4.820979 10.54475 5.195923 9.813765 4.902043 0.7309866      7.143363 
1 1 1 3   8  49 o 13.15049 5.881743 2.228318       3.865309 0.6223931      5.728305 3.570772       5.237369 13.14344 6.291235 14.45260 6.615072 -1.309154      9.129010 
1 1 1 3   9  0  o 398.2771 5.303625 1934.428       51.47475 1906.820       80.63906 1953.414       66.87129 395.1698 8.373859 400.1105 6.858413 -4.940765      10.82402 
1 1 1 3   9  1  o 266.8472 4.870928 868.2768       31.67455 898.1080       39.41502 813.8869       53.22131 271.3417 5.960863 258.0193 8.475924 13.32239       10.36210 
1 1 1 3   9  2  o 156.4170 2.910012 298.1901       11.09213 307.1538       15.86253 289.6132       15.51647 158.6761 4.105725 154.0742 4.136377 4.601929       5.828087 
1 1 1 3   9  3  o 161.8657 3.406934 319.3622       13.43862 330.0431       23.07913 313.8831       16.52998 164.3902 5.770075 160.3987 4.232677 3.991470       7.156068 
1 1 1 3   9  4  o 369.7801 4.948908 1667.476       44.59530 1729.918       72.22852 1629.008       56.69130 376.3970 7.874562 365.3890 6.366853 11.00803       10.12648 
1 1 1 3   9  5  o 458.0010 6.709808 2559.875       74.88806 2501.144       104.5482 2621.763       107.3217 452.3636 9.484026 463.1391 9.509113 -10.77548      13.43019 
1 1 1 3   9  6  o 353.1194 5.296477 1520.767       45.57689 1503.536       64.39931 1538.058       64.51175 350.9426 7.530245 354.9551 7.458118 -4.012573      10.59850 
1 1 1 3   9  7  o 290.3717 4.020067 1027.872       28.44616 1019.389       44.87638 1033.569       36.77909 289.0583 6.370832 291.1255 5.184235 -2.067169      8.213634 
1 1 1 3   9  8  o 195.5372 3.353832 466.0227       15.98111 448.4106       22.22337 484.8839       22.99794 191.7751 4.755341 199.4226 4.732366 -7.647568      6.708842 
1 1 1 3   9  9  o 413.6112 6.134845 2086.410       61.83467 2053.003       86.56178 2121.221       88.36082 410.0948 8.661753 416.8493 8.698503 -6.754456      12.27558 
1 1 1 3   9  10 o 380.5773 5.693720 1766.015       52.80501 1774.726       74.95734 1757.433       74.40088 381.3812 8.065269 379.5198 8.044657 1.861359       11.39145 
1 1 1 3   9  11 o 394.8275 6.826610 1901.082       65.68234 1873.213       113.6467 1915.060       80.48610 391.3914 11.92934 396.1913 8.336425 -4.799957      14.55353 
1 1 1 3   9  12 o 377.1511 5.657619 1734.102       51.99782 1705.575       72.77290 1763.858       74.32366 373.9344 7.986162 380.2681 8.020494 -6.333679      11.31844 
1 1 1 3   9  13 o 576.6982 8.366065 4057.037       117.5726 4036.742       165.7168 4077.606       166.8342 574.9200 11.82832 577.8204 11.84830 -2.900452      16.74191 
1 1 1 3   9  14 o 281.7209 5.156394 967.4824       35.39984 962.7590       42.91277 977.5427       62.62779 281.0017 6.266737 282.8997 9.096270 -1.897980      11.04600 
1 1 1 3   9  15 o 463.6161 6.830309 2621.181       77.16759 2601.764       108.5758 2641.001       109.6958 461.6978 9.650258 465.1639 9.677156 -3.466125      13.66656 
1 1 1 3   9  16 o 491.1221 8.304809 2942.997       99.39286 3086.623       176.4531 2876.248       120.2918 502.0526 14.43761 485.3519 10.17052 16.70071       17.66024 
1 1 1 3   9  17 f 321.9542 4.974533 1263.677       39.02856 1283.490       55.64699 1244.496       54.75329 324.3777 7.039706 319.4125 7.034321 4.965240       9.951841 
1 1 1 3   9  18 o 424.4497 6.326179 2197.406       65.43405 2259.085       94.16419 2139.812       90.99273 430.1382 8.983420 418.6354 8.919380 11.50278       12.65927 
1 1 1 3   9  19 o 176.3657 3.306449 379.1242       14.21059 380.9292       20.02724 377.2940       20.16711 176.6945 4.655222 175.8459 4.710496 0.8485870      6.622678 
1 1 1 3   9  20 o 68.08050 3.752427 56.67652       6.201376 60.83870       12.54566 55.33072       7.133850 70.19550 7.447633 67.22050 4.378812 2.974991       8.639516 
1 1 1 3   9  21 o 173.8580 4.425160 368.8923       18.73297 349.1515       25.28937 392.8938       27.88530 169.0087 6.150601 179.2744 6.393177 -10.26570      8.871449 
1 1 1 3   9  22 o 361.5790 5.536285 1596.093       48.78180 1571.210       68.05511 1622.388       69.96009 358.4078 7.791967 364.1816 7.883085 -5.773773      11.08412 
1 1 1 3   9  23 o 105.6038 2.850655 136.0705       7.329309 131.5385       10.03117 141.2609       10.73500 103.7603 3.974551 107.5226 4.104541 -3.762299      5.713520 
1 1 1 3   9  24 o 211.1158 3.715465 543.8142       19.11481 533.7445       26.55906 554.6353       27.53203 209.0114 5.214427 213.0526 5.302923 -4.041153      7.437153 
1 1 1 3   9  25 o 289.4455 4.638381 1023.465       32.71668 983.1928       44.97872 1068.712       47.67572 283.3347 6.514351 295.3747 6.623507 -12.03992      9.290189 
1 1 1 3   9  26 o 66.07957 3.064027 53.38764       4.920531 53.99951       6.489776 52.56027       7.546537 66.37494 4.031271 65.40280 4.767695 0.9721375      6.243562 
1 1 1 3   9  27 o 157.9474 3.768434 304.6557       14.50472 310.1044       17.52944 292.8248       25.83022 159.2111 4.522711 154.2944 6.887120 4.916687       8.239377 
1 1 1 3   9  28 o 108.1691 3.000357 142.9098       7.901192 137.9161       10.70800 148.8782       11.70661 106.1432 4.147791 110.2601 4.365520 -4.116898      6.021788 
1 1 1 3   9  29 o 79.04831 3.400090 76.45950       6.534350 71.43503       9.541968 80.89647       8.966763 76.18493 5.170273 81.18137 4.550774 -4.996445      6.887762 
1 1 1 3   9  30 o 90.16036 3.432009 99.46575       7.526732 96.81847       9.107121 105.1707       13.36932 88.85436 4.218014 92.32748 5.974202 -3.473114      7.313189 
1 1 1 3   9  31 o 49.02682 3.869788 29.58583       4.585888 32.04931       6.241970 26.69668       6.759786 50.85835 5.105414 46.17822 6.160579 4.680122       8.001124 
1 1 1 3   9  32 o 38.40724 6.085376 18.60548       5.505926 18.31579       10.21402 18.72414       6.537008 37.60909 10.65917 38.28792 7.272017 -0.6788368     12.90349 
1 1 1 3   9  33 f 103.8850 3.538064 132.2181       8.943768 132.3667       10.82666 131.8988       15.87062 103.8107 4.288970 103.1390 6.345153 0.6716309      7.658736 
1 1 1 3   9  34 o 123.9229 3.208313 188.0249       9.680529 184.9541       13.24790 191.5432       14.18029 122.6347 4.440326 124.7412 4.673125 -2.106499      6.446285 
1 1 1 3   9  35 o 33.79367 5.399185 14.44189       4.296741 12.05636       5.503181 18.16695       6.876837 30.46727 7.470444 37.42831 7.793286 -6.961037      10.79550 
1 1 1 3   9  36 o 80.28420 3.308342 79.16809       6.458702 78.60124       8.602087 79.90059       9.778566 79.74034 4.444382 80.23974 5.026162 -0.4993973     6.709309 
1 1 1 3   9  37 o 78.05119 3.397662 74.99059       6.446947 72.88058       8.526391 77.80720       9.851139 76.62280 4.587375 78.99390 5.145491 -2.371101      6.893481 
1 1 1 3   9  38 o 63.17395 4.137643 49.61437       6.334761 52.26696       7.374196 42.14424       12.37496 64.65974 4.712335 55.93947 9.411796 8.720272       10.52559 
1 1 1 3   9  39 o 40.92995 5.249834 21.42083       5.115862 18.86416       7.169456 24.07307       7.302213 37.22079 8.132228 42.56395 7.302907 -5.343159      10.93003 
1 1 1 3   9  40 o 26.34062 6.366269 9.348567       4.040704 10.87130       5.186697 6.997442       6.444917 28.09622 7.453691 23.74436 8.624142 4.351854       11.39883 
1 1 1 3   9  41 f 19.82941 6.635037 5.129299       3.770439 5.644194       4.837267 4.332184       6.018677 21.03385 7.492479 20.50455 8.117655 0.5292969      11.04688 
1 1 1 3   9  42 o 15.97282 6.897946 0.7851819      4.904568 -1.740232      8.351130 2.114857       6.059708 18.27820 8.361209 18.28570 7.776635 -0.7505417E-02 11.41866 
1 1 1 3   9  43 o 14.71007 6.308978 0.9835984      4.049057 0.8512559      4.532322 1.506794       9.011625 15.21509 6.600739 19.67423 8.874965 -4.459134      11.06050 
1 1 1 3   9  44 o 12.20763 5.527048 -0.7641924     3.532967 -5.085449      4.450256 6.601348       5.810082 11.19915 5.407511 20.60206 8.029696 -9.402913      9.680765 
1 1 1 3   9  45 o 11.65614 5.348978 -1.010784      3.454411 -1.742579      4.503690 0.3498886E-01  5.383843 12.68373 5.919463 14.69903 6.719959 -2.015301      8.955328 
1 1 1 3   9  46 o 18.29539 7.263880 5.788218       4.832247 5.955357       9.579130 5.731167       5.596522 18.80472 8.727587 18.24123 7.597905 0.5634861      11.57147 
1 1 1 3   9  47 o 12.94934 5.735995 1.237592       3.586154 -2.798426      4.998923 5.517113       5.147514 12.01228 5.782797 17.17825 7.229707 -5.165967      9.257937 
1 1 1 3   9  48 o 13.04209 6.023110 1.040067       4.478828 1.417166       6.137846 0.6105855      6.550292 14.11008 6.685031 13.95217 6.691393 0.1579094      9.458562 
1 1 1 3   9  49 o 10.71247 5.077669 -0.9364001     3.548977 1.781250       5.032921 -3.624215      5.005218 13.30367 6.224740 10.97033 5.391356 2.333346       8.234932 
1 1 1 3   10 0  o 296.3994 4.607567 1071.214       33.28014 1053.950       46.42976 1089.456       47.72751 293.8969 6.482841 298.8016 6.554653 -4.904755      9.219041 
1 1 1 3   10 1  o 104.2602 2.504011 132.4761       6.361959 123.7200       8.743447 142.3277       9.274342 100.6813 3.569320 107.9983 3.528691 -7.316986      5.019134 
1 1 1 3   10 2  o 346.4783 6.050233 1464.563       51.08392 1377.589       60.16669 1689.177       96.68967 335.9319 7.349686 371.4494 10.69293 -35.51752      12.97523 
1 1 1 3   10 3  o 192.6904 3.817293 452.6292       17.92469 455.1351       22.12383 447.8416       30.58009 193.1983 4.699167 191.4635 6.563862 1.734818       8.072575 
1 1 1 3   10 4  o 407.7010 6.037110 2027.784       59.98007 2019.406       84.86879 2036.144       84.78055 406.6059 8.565214 408.2928 8.520958 -1.686859      12.08179 
1 1 1 3   10 5  o 212.0996 3.162407 548.3105       16.34533 604.2123       27.28317 517.0129       20.41445 222.5943 5.029732 205.9356 4.067900 16.65871       6.468849 
1 1 1 3   10 6  o 469.0900 6.892569 2684.960       78.79041 2464.806       149.7306 2769.266       92.65624 448.2951 13.72215 476.2816 7.983158 -27.98654      15.87539 
1 1 1 3   10 7  o 280.3613 3.914609 958.1275       26.74500 950.2960       42.24095 963.3678       34.55309 279.1250 6.210103 281.0883 5.044383 -1.963318      8.000698 
1 1 1 3   10 8  o 195.5555 2.995444 466.0572       14.27471 448.8902       22.40464 477.7878       18.52042 191.8880 4.791308 197.9876 3.838634 -6.099594      6.139360 
1 1 1 3   10 9  o 471.9850 6.933144 2717.052       79.74335 2907.562       117.9618 2556.721       108.2157 487.9958 9.919489 457.6278 9.703798 30.36801       13.87660 
1 1 1 3   10 10 o 575.5802 8.350935 4041.834       117.1324 4259.406       171.6738 3852.327       160.2193 590.4725 11.93076 561.5751 11.70768 28.89740       16.71564 
1 1 1 3   10 11 o 295.5647 4.598938 1064.798       33.12426 1065.184       46.92288 1064.415       46.76707 295.5648 6.514722 295.4586 6.495422 0.1061707      9.199572 
1 1 1 3   10 12 o 732.4300 10.52808 6548.339       187.9106 6809.681       273.0209 6313.108       259.0228 746.1993 15.01430 718.5162 14.79331 27.68311       21.07774 
1 1 1 3   10 13 o 287.1704 4.500566 1005.157       31.49510 963.4641       43.45874 1051.278       45.70791 281.1040 6.344159 293.6338 6.387769 -12.52979      9.002885 
1 1 1 3   10 14 o 273.5977 6.121526 912.6907       40.81392 882.6664       55.14462 949.0601       60.69261 268.8474 8.427485 278.7462 8.946507 -9.898895      12.29075 
1 1 1 3   10 15 o 332.3421 5.843407 1346.686       47.32467 1341.411       80.65096 1349.456       58.44400 331.3275 10.00031 332.6258 7.210211 -1.298218      12.32855 
1 1 1 3   10 16 o 406.6242 6.078376 2016.217       60.23056 1962.536       83.65221 2074.003       86.79230 401.0183 8.560066 412.2434 8.639556 -11.22510      12.16210 
1 1 1 3   10 17 o 37.07538 3.443849 16.89782       3.075902 14.60153       4.055703 20.00699       4.719282 34.24651 5.007771 40.21095 4.918361 -5.964447      7.019120 
1 1 1 3   10 18 o 424.4857 6.329653 2198.013       65.47553 2223.472       93.27667 2173.282       91.93076 426.6906 8.970650 421.8503 8.942654 4.840271       12.66663 
1 1 1 3   10 19 o 517.5368 7.593657 3270.101       95.76974 3339.477       137.2849 3204.335       133.6653 522.4652 10.78274 511.7970 10.71729 10.66821       15.20289 
1 1 1 3   10 20 f 235.7144 5.639141 677.9375       32.39181 653.3096       46.62023 700.9227       45.03857 231.0572 8.293232 239.4054 7.730085 -8.348206      11.33719 
1 1 1 3   10 21 o 251.6324 4.736636 772.4859       29.04508 756.1592       35.36743 806.3076       50.90401 248.8776 5.831517 256.6351 8.149870 -7.757507      10.02133 
1 1 1 3   10 22 o 287.0739 4.587162 1005.642       32.09031 998.5103       45.13885 1012.930       45.63023 285.8413 6.480214 287.8948 6.504033 -2.053467      9.181265 
1 1 1 3   10 23 o 74.93737 2.975601 68.58498       5.423067 72.28837       7.537454 64.61049       7.808474 76.86333 4.038272 72.62134 4.433434 4.241989       5.996914 
1 1 1 3   10 24 o 78.93192 2.872625 76.08125       5.516234 77.65097       7.477272 74.20670       8.171084 79.67244 3.862736 77.84106 4.324593 1.831375       5.798520 
1 1 1 3   10 25 o 137.5370 3.056454 230.7652       10.24410 237.4261       14.36205 223.8667       14.61597 139.3667 4.233749 135.3028 4.438873 4.063904       6.134185 
1 1 1 3   10 26 o 88.27851 2.855207 95.16729       6.134189 88.88464       8.137833 103.4344       9.334970 85.22389 3.928994 91.92411 4.178153 -6.700218      5.735325 
1 1 1 3   10 27 o 66.27405 3.557050 53.78345       5.723681 54.73978       6.578364 50.80374       11.61187 66.81284 4.059534 63.82561 7.615796 2.987225       8.630189 
1 1 1 3   10 28 o 112.6348 3.328453 155.0429       9.125875 148.9668       13.94930 159.5894       12.06637 110.1626 5.210926 114.1567 4.345431 -3.994072      6.785022 
1 1 1 3   10 29 o 214.3783 3.824545 561.7714       19.98006 537.8003       27.36238 589.1518       29.24347 209.3627 5.367557 219.1728 5.475276 -9.810089      7.667419 
1 1 1 3   10 30 o 51.32446 3.653788 32.36378       4.539986 25.18695       5.829095 43.43029       7.238366 44.98358 5.427088 59.30398 5.056845 -14.32040      7.417881 
1 1 1 3   10 31 o 203.0345 4.282575 504.8595       21.18902 501.6414       25.89438 511.3811       36.86258 202.0562 5.263411 203.1589 7.458504 -1.102676      9.128678 
1 1 1 3   10 32 o 76.09081 4.975114 71.39217       9.174510 61.30134       14.07719 78.84299       12.09636 69.67227 8.464710 79.70967 6.278054 -10.03740      10.53875 
1 1 1 3   10 33 o 58.12563 3.627023 41.52175       5.111924 43.17693       6.723382 39.25389       7.869969 59.10790 4.706577 56.12098 5.839866 2.986919       7.500394 
1 1 1 3   10 34 o 144.7403 3.299317 256.4438       11.63723 249.5535       15.78046 264.6579       17.22996 142.4153 4.552870 146.5772 4.830313 -4.161896      6.637813 
1 1 1 3   10 35 o 62.56771 3.564862 48.15450       5.412877 45.26905       7.159525 52.00437       8.269904 60.39889 4.906507 64.67158 5.293766 -4.272686      7.217878 
1 1 1 3   10 36 o 68.41169 3.453712 57.58864       5.739121 60.71492       7.586185 53.40496       8.775850 70.02180 4.469170 65.35948 5.562717 4.662315       7.135636 
1 1 1 3   10 37 o 38.55157 4.728578 18.68537       4.349389 20.59163       5.577091 15.72633       6.948511 40.18411 5.868392 34.34517 8.377968 5.838943       10.22880 
1 1 1 3   10 38 o 52.63192 4.370263 34.63517       5.554703 28.81162       6.372998 53.04467       11.33108 47.57090 5.604977 63.84678 7.420875 -16.27588      9.299740 
1 1 1 3   10 39 o 73.24202 3.484461 66.57346       6.201329 66.67165       8.167453 66.43980       9.529190 72.79469 4.628130 72.22898 5.454181 0.5657120      7.153158 
1 1 1 3   10 40 o 18.29939 6.987174 3.451361       4.334620 5.580372       4.943987 -3.623501      9.012545 21.25657 7.574371 18.87461 8.653476 2.381964       11.50016 
1 1 1 3   10 41 o 49.49049 4.041400 31.17458       4.831645 35.34157       6.319733 25.31246       7.495751 52.11716 5.038786 42.42401 7.526078 9.693150       9.057108 
1 1 1 3   10 42 o 27.32631 6.165814 10.49226       4.007976 8.678494       5.064356 13.53240       6.556616 24.23812 7.660548 29.47919 8.598522 -5.241070      11.51601 
1 1 1 3   10 43 o 19.91558 7.588936 5.505286       5.106797 4.941196       9.031785 5.770380       6.191561 21.24434 9.265849 20.58441 8.206069 0.6599331      12.37722 
1 1 1 3   10 44 o 11.49764 5.295183 -1.407498      3.427579 -0.1437295     4.428231 -3.296222      5.413532 13.85184 6.237307 13.28221 6.288495 0.5696325      8.857153 
1 1 1 3   10 45 o 15.42795 6.153620 3.064856       3.483492 3.172322       4.674282 2.930612       5.224280 16.28058 6.872674 16.41644 7.104408 -0.1358509     9.884647 
1 1 1 3   10 46 o 15.99949 6.338624 3.859070       3.672120 12.47358       5.288685 -4.160007      5.102635 25.41001 7.797114 11.88240 5.750257 13.52761       9.688161 
1 1 1 3   10 47 o 15.19758 6.176414 3.669990       3.581244 5.386308       5.277240 2.204841       4.875832 16.88877 7.222053 14.48042 6.530456 2.408344       9.736781 
1 1 1 3   10 48 o 11.52917 5.467142 -0.9628707     4.122887 -3.366112      5.138915 3.378220       6.906725 11.43963 5.588621 15.05284 7.119725 -3.613216      9.051142 
1 1 1 3   10 49 o 14.92943 6.217546 4.405429       3.746934 1.207394       5.100321 8.155198       5.522786 12.97624 6.131741 17.28236 7.389208 -4.306124      9.602013 
1 1 1 3   11 0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 3   11 1  o 563.1277 11.58254 3880.879       158.9450 4132.620       234.3613 3666.465       216.2892 579.5314 16.61197 545.9488 16.27542 33.58264       23.25611 
1 1 1 3   11 2  o 237.2880 3.871845 686.3816       22.38875 664.5377       30.98895 710.2334       32.38190 233.4268 5.447784 241.3165 5.506545 -7.889694      7.745992 
1 1 1 3   11 3  o 606.0144 8.778709 4485.378       129.6432 4404.419       181.1039 4570.468       185.6676 599.8181 12.39002 611.0016 12.46975 -11.18353      17.57860 
1 1 1 3   11 4  f 235.9982 3.432316 678.8488       19.73931 687.0861       31.42215 673.4790       25.37010 237.3641 5.432311 235.0360 4.429470 2.328140       7.009294 
1 1 1 3   11 5  o 353.6967 4.773629 1525.236       41.14488 1657.126       68.58902 1451.095       51.42510 368.4943 7.638142 344.9246 6.118076 23.56970       9.786321 
1 1 1 3   11 6  o 318.0759 4.883924 1233.452       37.85609 1213.254       75.79642 1240.164       43.69627 315.0215 9.885768 318.9099 5.622641 -3.888397      11.37288 
1 1 1 3   11 7  o 534.6667 6.964153 3486.874       90.73765 3663.448       148.5944 3381.884       114.5810 547.5823 11.13568 526.3745 8.932677 21.20789       14.27572 
1 1 1 3   11 8  o 260.4505 4.154611 826.8066       26.36888 911.6175       57.12442 803.8420       29.72528 273.1962 8.591147 256.7946 4.750112 16.40161       9.816893 
1 1 1 3   11 9  o 138.7860 2.819521 234.7249       9.535800 250.2105       21.35030 230.8660       10.65791 143.1219 6.135808 137.6378 3.177591 5.484055       6.909792 
1 1 1 3   11 10 o 899.4061 12.86378 9883.653       281.9426 9961.973       400.9799 9807.069       396.5117 901.7043 18.24829 894.6831 18.18657 7.021240       25.76337 
1 1 1 3   11 11 o 129.0967 2.749717 203.0909       8.650464 202.4528       12.41020 203.6938       12.06434 128.8245 3.957853 129.2238 3.835355 -0.3992920     5.511311 
1 1 1 3   11 12 o 260.0273 4.165012 824.0818       26.39194 857.8528       38.34175 793.6733       36.38293 265.2622 5.931443 255.1487 5.851515 10.11356       8.332001 
1 1 1 3   11 13 o 628.7104 12.87399 4830.379       197.2422 4705.064       272.5579 4968.165       285.7982 619.3619 18.07770 636.3711 18.44895 -17.00916      25.82957 
1 1 1 3   11 14 o 364.1747 6.407570 1617.211       56.86424 1552.826       67.55883 1773.670       105.3147 356.7858 7.770311 380.8962 11.35878 -24.11041      13.76225 
1 1 1 3   11 15 o 283.4906 4.488720 979.6392       31.00968 947.9453       43.11905 1013.591       44.62851 278.8085 6.346394 288.3005 6.352298 -9.491943      8.979332 
1 1 1 3   11 16 o 381.8052 5.757130 1777.574       53.56535 1742.915       74.88198 1813.893       76.65483 377.9187 8.130980 385.5349 8.159052 -7.616272      11.51881 
1 1 1 3   11 17 o 510.4533 7.487607 3179.638       93.13977 3201.344       132.3074 3158.314       131.1394 511.8015 10.60832 508.3536 10.58599 3.447968       14.98664 
1 1 1 3   11 18 o 127.1386 2.854888 197.0043       8.845097 192.1245       12.24292 202.3324       12.79290 125.4741 4.009154 128.7641 4.082136 -3.290001      5.721638 
1 1 1 3   11 19 o 309.8436 5.554654 1171.202       41.94069 1170.857       51.68233 1171.868       71.77453 309.6977 6.848066 309.4127 9.530468 0.2850342      11.73567 
1 1 1 3   11 20 o 102.9608 4.048588 129.4745       10.13828 110.6931       15.77107 142.7019       13.23534 94.95359 6.862040 108.0335 5.041270 -13.07989      8.514810 
1 1 1 3   11 21 o 380.7025 5.772369 1769.735       53.55202 1747.795       75.06747 1792.473       76.41859 377.9332 8.150807 382.7246 8.193633 -4.791412      11.55730 
1 1 1 3   11 22 o 390.6097 5.914051 1864.279       56.29427 1819.443       78.27511 1912.314       81.02006 385.3518 8.335472 395.0429 8.416125 -9.691162      11.84530 
1 1 1 3   11 23 o 110.2220 2.837398 148.2442       7.614882 146.7382       10.55912 149.8763       10.99206 109.5840 3.960586 110.7415 4.080147 -1.157463      5.686285 
1 1 1 3   11 24 o 224.9058 3.884324 617.4323       21.28885 617.8834       29.94437 616.9713       30.27227 224.7898 5.466413 224.6144 5.530587 0.1754150      7.776186 
1 1 1 3   11 25 o 33.91199 4.100998 14.24828       3.320302 13.89788       4.194128 14.83657       5.434489 33.29435 5.350576 34.19949 6.760546 -0.9051399     8.621696 
1 1 1 3   11 26 o 130.9364 3.002170 209.1860       9.579257 213.0801       13.38039 205.0915       13.72023 131.9994 4.164900 129.4766 4.354643 2.522827       6.025720 
1 1 1 3   11 27 f 133.5543 4.168542 218.2121       13.55021 213.2275       17.29376 226.1382       21.80760 131.8385 5.394231 135.5486 6.622062 -3.710098      8.541044 
1 1 1 3   11 28 o 213.3197 3.802034 556.0737       19.76438 579.7910       28.31348 533.5332       27.60219 217.5138 5.341588 208.5659 5.435436 8.947845       7.620795 
1 1 1 3   11 29 o 147.3153 3.240751 265.0609       11.63401 258.4643       16.11555 272.2403       16.81253 145.2296 4.559238 149.0392 4.634731 -3.809662      6.501338 
1 1 1 3   11 30 o 157.1195 3.306246 301.6419       12.65906 292.0746       17.34182 312.5554       18.52160 154.3337 4.616217 159.6244 4.766832 -5.290710      6.635672 
1 1 1 3   11 31 o 28.82243 5.474424 10.54170       3.704516 9.606787       4.815192 11.89758       5.798813 27.37568 7.143559 30.40792 7.791122 -3.032240      10.57034 
1 1 1 3   11 32 o 89.69848 4.774608 99.04733       10.39900 94.59119       16.06394 102.2618       13.64353 86.95127 7.659451 90.83185 6.201047 -3.880577      9.854957 
1 1 1 3   11 33 o 103.5769 3.132057 131.3268       7.896410 130.9100       10.61922 131.8422       11.80985 103.2151 4.230920 103.4818 4.695449 -0.2667160     6.320437 
1 1 1 3   11 34 o 80.68420 3.234047 79.81454       6.345855 70.95215       8.253314 92.63041       9.924915 75.84257 4.485627 86.63944 4.718646 -10.79688      6.510489 
1 1 1 3   11 35 o 36.69194 4.913406 16.90035       4.282960 14.25776       5.516824 20.90935       6.795030 33.17271 7.042498 40.31133 7.180459 -7.138618      10.05762 
1 1 1 3   11 36 o 80.21185 3.284437 79.08505       6.406427 80.14282       8.552309 77.73259       9.670500 80.47647 4.377402 79.05409 5.046168 1.422379       6.680230 
1 1 1 3   11 37 o 46.58945 4.116070 27.02726       4.625096 25.43407       5.976482 29.40607       7.302832 44.77625 5.599305 47.91597 6.415292 -3.139721      8.515174 
1 1 1 3   11 38 o 79.57097 3.764110 78.53954       7.278135 77.34946       10.49164 79.64351       10.10492 78.16208 5.544207 79.47237 5.247077 -1.310295      7.633482 
1 1 1 3   11 39 o 50.81957 4.549481 32.65027       5.574619 30.99835       6.432384 37.63469       11.17341 49.11795 5.466485 51.98000 9.155205 -2.862045      10.66303 
1 1 1 3   11 40 o 18.01025 6.595659 3.711349       3.780935 7.987599       4.796932 -3.303041      6.143658 24.12887 7.429752 15.41976 7.097055 8.709112       10.27470 
1 1 1 3   11 41 o 42.34781 4.429333 23.15414       4.503411 26.19004       5.938652 19.04587       6.908346 44.33962 5.622396 36.13491 8.051437 8.204712       9.820233 
1 1 1 3   11 42 o 14.66585 6.257578 0.9410729      3.946106 4.035262       4.435000 -10.81787      8.645784 18.33353 7.050601 14.96771 7.298346 3.365818       10.14775 
1 1 1 3   11 43 o 23.50921 7.655581 8.777632       5.030722 14.86992       9.087188 6.085337       6.040887 27.75897 10.21533 20.59224 8.138840 7.166725       13.06115 
1 1 1 3   11 44 o 15.99831 6.278477 3.282172       3.572436 3.176503       4.616836 3.439847       5.639658 16.58591 6.904067 17.44185 7.462422 -0.8559437     10.16631 
1 1 1 3   11 45 o 18.22536 6.435452 5.313674       3.561887 5.040527       4.966553 5.602952       5.111093 17.95012 7.281469 18.50050 7.428459 -0.5503731     10.40201 
1 1 1 3   11 46 o 20.52095 6.652701 7.480699       3.801347 6.316980       5.272723 8.740196       5.485416 18.34060 7.479199 20.56373 7.858092 -2.223131      10.84841 
1 1 1 3   11 47 o 26.54246 6.752193 13.01455       4.377121 14.09508       6.721539 12.21892       5.767724 22.92004 8.712947 22.56902 8.163941 0.3510208      11.94007 
1 1 1 3   11 48 o 10.60627 5.122466 -2.442339      3.999296 -2.170053      4.837732 -3.030119      7.107833 11.56950 5.598876 12.83690 6.331081 -1.267400      8.451627 
1 1 1 3   12 0  o 550.0311 9.266699 3695.051       124.2077 3380.131       202.5535 3884.830       157.2407 524.6268 15.86179 563.6246 11.44825 -38.99786      19.56167 
1 1 1 3   12 1  o 478.0178 8.127260 2789.178       94.67260 3099.459       176.0762 2662.997       112.2845 502.7391 14.38695 466.8808 9.869105 35.85834       17.44659 
1 1 1 3   12 2  o 259.7376 5.887883 822.7555       37.26749 767.1547       51.02518 886.3282       54.56065 250.5527 8.368724 269.3356 8.322831 -18.78296      11.80276 
1 1 1 3   12 3  o 230.0995 4.366752 645.4216       24.48557 626.1989       41.08132 656.0129       30.49396 226.4220 7.455594 231.9508 5.394881 -5.528778      9.202751 
1 1 1 3   12 4  o 571.7449 7.422609 3988.130       103.4177 3931.790       161.9886 4026.893       134.3640 567.1479 11.72066 574.2682 9.601345 -7.120361      15.15123 
1 1 1 3   12 5  o 571.0313 7.411506 3977.775       103.1341 3772.476       157.3905 4132.262       136.5310 555.6204 11.62423 581.7775 9.630264 -26.15710      15.09519 
1 1 1 3   12 6  o 637.6920 8.232086 4961.464       127.9255 4872.509       199.8460 5023.218       166.5100 631.3201 12.99002 641.3587 10.65377 -10.03857      16.80010 
1 1 1 3   12 7  o 174.8360 3.630968 372.5394       15.46997 0.000000       0.000000 372.5394       15.46997 ?        ?        174.8360 3.630968 0.000000       3.630968 
1 1 1 3   12 8  o 41.64847 3.048886 21.25164       3.072959 18.10242       4.769766 23.48633       4.017947 38.17620 5.267275 43.73332 3.808057 -5.557121      6.499652 
1 1 1 3   12 9  o 404.6240 6.011656 1996.020       59.27641 2053.176       85.93189 1944.134       81.87422 410.2504 8.595464 399.2177 8.415915 11.03268       12.02953 
1 1 1 3   12 10 o 510.0852 6.666202 3172.524       82.86236 3298.863       134.8110 3095.811       105.0493 519.8522 10.64166 503.7626 8.557185 16.08960       13.65541 
1 1 1 3   12 11 f 681.1678 9.819996 5662.579       163.0052 5491.410       225.8282 5848.763       235.5258 670.2637 13.82600 691.7052 13.97273 -21.44147      19.65694 
1 1 1 3   12 12 o 616.5276 12.63954 4644.447       189.8978 4615.977       266.2067 4673.946       270.9688 613.5287 17.82414 617.3262 18.03159 -3.797546      25.35426 
1 1 1 3   12 13 o 192.2651 4.015350 450.5469       18.81309 467.7179       23.12485 416.9379       32.35252 195.8810 4.844517 184.7528 7.199679 11.12825       8.677830 
1 1 1 3   12 14 o 82.96189 2.595926 83.95535       5.241701 93.71803       7.864015 76.15045       7.031432 87.61185 3.691644 78.95988 3.664266 8.651962       5.201450 
1 1 1 3   12 15 o 313.1547 4.863726 1195.526       37.11625 1183.666       52.32280 1207.540       52.65943 311.5124 6.892544 314.6394 6.867947 -3.126984      9.730152 
1 1 1 3   12 16 o 461.3795 6.826745 2596.879       76.75524 2699.556       111.4332 2504.187       105.8764 470.1176 9.726849 452.8017 9.595223 17.31583       13.66308 
1 1 1 3   12 17 o 427.8666 6.374384 2233.396       66.46343 2264.761       94.87398 2203.169       93.13708 430.5884 9.041670 424.6980 8.999249 5.890411       12.75689 
1 1 1 3   12 18 o 157.3142 3.493217 301.6766       13.39151 289.0017       16.42594 326.7987       23.12523 153.8913 4.384529 163.5641 5.811023 -9.672836      7.279566 
1 1 1 3   12 19 o 288.9271 5.352670 1018.527       37.68729 1024.724       66.66418 1015.617       45.68907 289.2337 9.470948 288.4210 6.500538 0.8127136      11.48720 
1 1 1 3   12 20 f 415.9298 7.241300 2114.448       73.39605 2191.770       131.4386 2079.412       88.47503 421.8893 12.79944 412.1627 8.808784 9.726593       15.53770 
1 1 1 3   12 21 o 201.9561 3.589166 497.4305       17.66391 508.5953       25.17425 486.6028       24.79123 204.1144 5.061121 199.5847 5.101416 4.529663       7.186056 
1 1 1 3   12 22 o 119.9517 2.895302 175.4494       8.463234 176.4620       11.80881 174.3800       12.13552 120.1864 4.037678 119.4636 4.174982 0.7227707      5.808040 
1 1 1 3   12 23 o 221.9974 3.827409 601.4577       20.70565 601.9910       29.14675 600.9144       29.41958 221.9194 5.389627 221.7135 5.445129 0.2058868      7.661430 
1 1 1 3   12 24 o 17.02551 5.671967 3.344698       2.755813 1.170643       3.424469 7.340083       4.642344 15.00311 6.060627 24.33134 7.271619 -9.328223      9.466132 
1 1 1 3   12 25 o 267.2191 4.386624 872.4744       28.56498 877.7346       40.44003 867.2365       40.35406 267.6516 6.200197 266.0404 6.224487 1.611237       8.785596 
1 1 1 3   12 26 o 73.96923 3.172868 66.89899       5.705954 62.90867       8.282360 70.50383       7.872133 71.56282 4.776659 75.83496 4.277113 -4.272141      6.411721 
1 1 1 3   12 27 o 75.29694 3.479868 69.38567       6.367958 68.83285       7.294937 71.15567       13.05315 74.94181 4.009080 75.72688 7.158378 -0.7850647     8.204578 
1 1 1 3   12 28 o 160.5985 3.285831 314.9854       12.85946 309.2710       17.76856 321.2703       18.63435 158.8950 4.593694 161.9254 4.727466 -3.030396      6.591734 
1 1 1 3   12 29 f 32.33331 4.694539 13.06842       3.590933 13.59979       4.536264 12.17658       5.876831 32.78471 5.894627 30.79928 7.817825 1.985437       9.791068 
1 1 1 3   12 30 o 61.99343 3.315734 47.09988       4.990897 42.03816       6.469799 54.53873       7.843217 58.39518 4.583208 66.51477 4.872635 -8.119591      6.689422 
1 1 1 3   12 31 o 110.2896 3.434560 148.8826       9.219599 145.1130       11.11943 157.1747       16.49196 108.7602 4.203341 112.8019 6.021383 -4.041649      7.343373 
1 1 1 3   12 32 o 53.87260 5.006434 35.96989       6.497318 33.37468       12.11353 37.01805       7.698391 50.60344 10.17632 54.48509 5.891715 -3.881649      11.75881 
1 1 1 3   12 33 o 42.60796 4.626746 22.56828       4.726963 22.70215       5.488686 22.18388       9.300770 42.58207 5.411449 41.14501 9.472266 1.437057       10.90906 
1 1 1 3   12 34 o 94.56359 3.160143 109.5887       7.272040 106.2302       9.650647 114.0010       11.06157 92.87875 4.275338 96.10888 4.737591 -3.230125      6.381480 
1 1 1 3   12 35 o 195.2507 3.738713 468.2685       17.78897 470.9267       24.73258 465.4194       25.60489 195.0019 5.209352 193.7229 5.429182 1.279022       7.524185 
1 1 1 3   12 36 f 28.17243 5.809498 10.25013       3.855873 14.23178       4.841739 3.346287       6.375513 33.21913 6.209286 21.00107 8.341807 12.21805       10.39909 
1 1 1 3   12 37 o 73.87683 3.639227 67.47636       6.531528 64.86500       9.280096 70.03973       9.194451 71.83366 5.339560 74.76627 5.076534 -2.932610      7.367639 
1 1 1 3   12 38 o 52.32833 4.370690 34.36411       5.522578 37.75002       6.362791 24.02322       11.11959 54.69336 4.823311 40.74607 10.96075 13.94729       11.97508 
1 1 1 3   12 39 o 77.64839 3.771048 75.30377       7.114264 77.48888       8.324876 69.38672       13.69916 78.44224 4.372337 71.57895 7.989754 6.863289       9.107882 
1 1 1 3   12 40 f 69.00942 3.450898 59.62417       5.784908 65.04457       7.686148 52.54169       8.785892 71.47121 4.434927 63.27659 5.760892 8.194618       7.270245 
1 1 1 3   12 41 o 24.21077 6.707983 8.307090       4.093978 7.523910       4.723976 10.66999       8.205398 23.00518 7.412710 26.54522 9.717246 -3.540041      12.22183 
1 1 1 3   12 42 o 11.44164 5.292974 -2.045419      3.480352 -3.525701      4.317175 0.7024779      5.882037 12.01469 5.666438 16.70910 7.376316 -4.694419      9.301535 
1 1 1 3   12 43 o 32.19952 7.180504 16.11049       5.490694 32.26704       11.37454 11.20199       6.269520 39.53323 11.26311 25.41402 8.556419 14.11921       14.14461 
1 1 1 3   12 44 o 21.82675 6.538258 7.609674       3.749870 3.853496       5.018297 12.35869       5.642678 17.29122 7.197850 26.25326 8.053456 -8.962046      10.80126 
1 1 1 3   12 45 f 13.21524 5.787820 1.007759       3.555948 2.903396       4.863296 -1.169960      5.212596 15.89454 6.866517 13.55635 6.340334 2.338193       9.346063 
1 1 1 3   12 46 o 15.99434 6.547743 4.061348       4.060501 1.142955       6.366846 6.062154       5.271750 15.02126 7.019518 17.88271 7.404896 -2.861452      10.20324 
1 1 1 3   12 47 o 14.77047 6.211657 3.506953       3.795354 3.266917       5.352467 3.749695       5.382542 14.99461 6.794514 15.30532 6.885507 -0.3107014     9.673450 
1 1 1 3   12 48 o 17.06761 6.677923 6.272096       4.031204 13.17900       5.729884 -0.4971994     5.672517 22.08623 8.114398 12.75314 6.144668 9.333088       10.17843 
1 1 1 3   13 0  o 656.5110 10.96009 5265.209       175.3445 5034.810       208.0744 5829.689       325.6881 641.5923 13.30833 688.6339 19.42726 -47.04156      23.54846 
1 1 1 3   13 1  o 656.1280 10.94233 5258.768       174.9582 5180.345       212.1397 5425.555       309.3729 650.8102 13.37616 664.4570 19.12632 -13.64673      23.33962 
1 1 1 3   13 2  o 777.3600 11.16467 7381.757       211.4970 7190.667       293.5753 7587.945       304.9528 766.2724 15.72173 787.1108 15.89866 -20.83844      22.35934 
1 1 1 3   13 3  o 145.4953 3.433548 257.9908       12.17385 248.1950       21.01900 262.9356       14.93363 142.5427 6.064916 146.8154 4.178299 -4.272720      7.364875 
1 1 1 3   13 4  o 379.7028 8.081067 1758.825       74.77366 1755.000       106.2725 1762.576       105.2271 378.8776 11.52368 379.7106 11.38490 -0.8330383     16.19911 
1 1 1 3   13 5  o 368.0298 5.558599 1651.237       49.85221 1733.577       103.6474 1626.455       56.86140 376.6032 11.30655 365.2257 6.388812 11.37753       12.98672 
1 1 1 3   13 6  o 312.0723 4.836449 1187.098       36.78052 1326.885       79.76625 1149.351       41.45002 329.5779 9.943104 307.0519 5.539580 22.52600       11.38210 
1 1 1 3   13 7  o 327.0439 5.032318 1303.757       40.10609 1452.655       87.42901 1264.074       45.13519 344.8254 10.41642 322.0080 5.751915 22.81741       11.89901 
1 1 1 3   13 8  o 792.0288 11.37142 7659.241       219.4783 7397.651       429.2177 7751.856       255.3928 775.6660 22.73189 796.5244 13.15750 -20.85846      26.26516 
1 1 1 3   13 9  o 545.8680 7.110087 3633.596       94.57985 3497.302       145.9599 3732.245       124.1771 535.2093 11.19113 553.0746 9.213435 -17.86536      14.49582 
1 1 1 3   13 10 o 416.0721 7.148415 2111.138       72.47938 2094.302       124.0266 2119.869       89.31796 413.8788 12.31087 416.8397 8.792929 -2.960938      15.12855 
1 1 1 3   13 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 3   13 12 o 417.0444 7.217873 2121.294       73.35465 2066.287       88.01289 2246.428       132.7471 411.5043 8.776793 428.5347 12.72577 -17.03043      15.45889 
1 1 1 3   13 13 o 206.8343 3.583531 521.3934       18.06216 555.2960       26.65517 492.6094       24.56070 213.4234 5.125110 201.0186 5.013817 12.40485       7.169735 
1 1 1 3   13 14 f 486.8823 8.253623 2892.852       97.92751 2807.228       165.3419 2939.118       121.5377 478.6920 14.18961 490.5640 10.16668 -11.87201      17.45584 
1 1 1 3   13 15 o 407.3705 6.100163 2023.957       60.55738 1965.824       84.08376 2086.606       87.28825 401.2880 8.598444 413.4259 8.664070 -12.13797      12.20653 
1 1 1 3   13 16 o 192.8828 3.461385 453.4704       16.26970 491.1478       24.05195 421.6873       22.09063 200.6993 4.917772 185.9037 4.880448 14.79556       6.928438 
1 1 1 3   13 17 o 242.7888 4.578140 718.7746       27.08656 707.4269       33.36012 740.7294       46.40216 240.8152 5.684700 246.1743 7.744617 -5.359085      9.607024 
1 1 1 3   13 18 o 421.0513 6.292859 2163.956       64.56825 2218.184       92.85503 2113.186       89.84589 425.9081 8.946506 415.7185 8.868756 10.18958       12.59741 
1 1 1 3   13 19 o 191.7537 4.069387 448.4323       19.01555 440.4915       34.19332 451.9877       22.87990 189.7013 7.410903 192.4114 4.883581 -2.710098      8.875295 
1 1 1 3   13 20 o 23.44661 5.341510 6.979905       2.983605 10.31245       4.141727 3.384904       4.301729 28.51099 6.142648 18.94973 7.018666 9.561264       9.327046 
1 1 1 3   13 21 o 317.8890 4.968177 1233.864       38.48652 1196.619       53.41152 1274.087       55.50515 312.7303 7.008561 322.6848 7.058600 -9.954529      9.947048 
1 1 1 3   13 22 o 192.6614 3.516320 452.8461       16.50894 449.7297       23.17294 456.0580       23.52537 191.8123 4.961733 193.1530 5.002242 -1.340652      7.045652 
1 1 1 3   13 23 o 207.5144 3.678147 525.5512       18.60002 522.8544       26.17334 528.3027       26.43745 206.7475 5.199090 207.8186 5.224484 -1.071121      7.370603 
1 1 1 3   13 24 o 72.40927 2.888849 64.05915       5.087244 65.36161       6.978357 62.58187       7.431945 73.05872 3.934141 71.44936 4.288162 1.609352       5.819432 
1 1 1 3   13 25 o 192.1767 4.000103 451.1071       18.73303 445.0486       30.61685 454.7324       23.68358 190.3638 6.609972 192.7415 5.046726 -2.377762      8.316319 
1 1 1 3   13 26 o 176.9930 3.413271 382.4836       14.72187 369.3991       20.28272 397.0521       21.40209 173.6999 4.796301 180.0734 4.881702 -6.373581      6.843648 
1 1 1 3   13 27 o 190.0334 4.152004 441.5260       19.22754 435.5509       22.90642 455.7770       35.37586 188.5348 4.990129 192.1690 7.568989 -3.634216      9.065924 
1 1 1 3   13 28 o 138.2505 3.126100 233.3974       10.53187 222.3516       14.35177 246.2870       15.50344 134.7271 4.377150 141.7805 4.492873 -7.053421      6.272587 
1 1 1 3   13 29 o 95.11514 3.001679 110.5923       6.948738 108.1771       9.430059 113.4617       10.27869 93.93231 4.129772 96.16431 4.397836 -2.231995      6.032908 
1 1 1 3   13 30 o 153.3473 3.697872 287.6384       13.81861 281.4026       16.82244 300.5757       24.23055 151.4551 4.563150 156.0332 6.385999 -4.578140      7.848779 
1 1 1 3   13 31 o 135.3783 3.202710 224.0476       10.56581 210.3500       14.21374 240.9640       15.79580 130.8971 4.462495 140.0687 4.634071 -9.171555      6.433387 
1 1 1 3   13 32 o 149.4821 4.026768 274.0909       14.65502 289.8311       27.20320 267.6548       17.39504 152.5495 7.339203 147.4945 4.846226 5.055038       8.794874 
1 1 1 3   13 33 o 75.67630 3.253045 70.22363       5.985090 70.57888       7.966398 69.76328       9.068728 75.68251 4.337636 75.10870 4.982904 0.5738068      6.606393 
1 1 1 3   13 34 o 129.0330 3.617860 204.3862       11.36475 202.7140       13.84293 207.8433       19.90468 128.2641 4.435483 129.1321 6.344782 -0.8680267     7.741432 
1 1 1 3   13 35 o 42.08609 4.373900 22.06656       4.420486 22.85914       5.650510 20.81632       7.096835 42.55835 5.582865 40.02772 7.552417 2.530632       9.391879 
1 1 1 3   13 36 f 76.66692 3.651684 72.53487       6.802790 74.80614       9.745518 70.37645       9.500363 77.36520 5.199389 75.01880 5.229521 2.346397       7.374383 
1 1 1 3   13 37 o 43.54123 4.764914 23.90336       4.973364 22.84060       5.682590 27.38158       10.28036 42.26304 5.659734 44.54933 9.741652 -2.286293      11.26643 
1 1 1 3   13 38 o 16.28989 6.253488 2.463224       3.484574 5.067952       4.369083 -2.089669      5.776340 20.48747 7.135502 15.82570 7.125132 4.661772       10.08379 
1 1 1 3   13 39 o 86.37090 3.668348 93.22509       7.703425 90.53017       8.938005 101.0091       15.19041 84.68639 4.345558 86.86974 7.241518 -2.183342      8.445321 
1 1 1 3   13 40 o 42.66453 4.743093 23.57810       4.848084 23.86647       5.641031 22.76318       9.482813 42.45699 5.587723 38.23475 10.04805 4.222244       11.49722 
1 1 1 3   13 41 o 23.86383 6.377769 8.076709       3.779894 11.17155       4.871101 3.392623       5.992667 27.67266 7.166928 19.12550 7.904945 8.547165       10.67019 
1 1 1 3   13 42 o 11.76940 5.390686 -1.512225      3.486051 -5.372565      4.265996 6.246897       6.048030 10.95509 5.290827 21.03668 8.194357 -10.08159      9.753991 
1 1 1 3   13 43 o 20.92048 7.641376 7.026777       5.069861 9.276351       9.851429 6.216346       5.912988 22.73179 9.796238 20.15793 8.024842 2.573858       12.66351 
1 1 1 3   13 44 o 14.29528 6.028378 1.875388       3.590376 1.156417       4.974658 2.657084       5.187122 15.02729 6.700174 16.28045 7.062207 -1.253162      9.734839 
1 1 1 3   13 45 o 31.32531 5.233394 14.63645       3.854148 17.09114       5.556072 12.35972       5.350893 31.01636 7.445493 25.39571 7.851803 5.620657       10.82064 
1 1 1 3   13 46 o 21.24675 6.921018 8.585909       4.111461 17.07950       5.910940 0.6249570      5.722600 28.65808 8.104133 14.20592 6.643857 14.45216       10.47940 
1 1 1 3   13 47 o 12.64308 5.704173 1.211399       3.724437 1.900625       5.243684 0.5096976      5.290932 14.00996 6.486631 13.30898 6.275684 0.7009830      9.025552 
1 1 1 3   13 48 o 10.98269 5.184482 -0.6911191     3.629219 -1.812660      4.995241 0.5627496      5.281714 11.68382 5.662556 12.89165 6.134637 -1.207827      8.348551 
1 1 1 3   14 0  o 293.3050 4.608768 1048.589       32.94128 1008.658       45.41903 1092.906       47.84784 287.6142 6.480244 299.3823 6.558433 -11.76810      9.219903 
1 1 1 3   14 1  o 545.4409 7.955338 3628.887       105.7408 3689.516       151.1441 3570.765       147.9860 549.6765 11.28361 540.7639 11.22992 8.912659       15.91951 
1 1 1 3   14 2  o 673.5579 9.719846 5536.631       159.5403 5371.659       220.9252 5716.425       230.6360 662.9323 13.67540 683.8497 13.83982 -20.91748      19.45654 
1 1 1 3   14 3  o 399.2571 5.982192 1943.422       58.20350 2018.157       84.15503 1874.892       80.58530 406.7401 8.490376 392.0405 8.435072 14.69965       11.96816 
1 1 1 3   14 4  o 178.4016 3.813014 387.8874       16.57690 396.2903       29.34762 383.9503       20.08843 180.1554 6.696470 177.4229 4.650235 2.732513       8.152754 
1 1 1 3   14 5  o 104.9039 3.239028 134.2379       8.270312 124.6229       14.49085 138.8828       10.07174 100.9327 5.917458 106.6799 3.880701 -5.747177      7.076450 
1 1 1 3   14 6  o 1136.597 16.22374 15806.10       449.3594 16244.05       647.9698 15400.35       623.7048 1149.777 23.12624 1119.628 22.85964 30.14966       32.51747 
1 1 1 3   14 7  o 659.8152 9.528022 5312.265       153.2009 5358.373       217.8212 5267.128       215.5146 662.1902 13.49837 656.5318 13.47054 5.658386       19.06991 
1 1 1 3   14 8  o 437.5085 9.195084 2335.516       98.03434 0.000000       0.000000 2335.516       98.03434 ?        ?        437.5085 9.195084 0.000000       9.195084 
1 1 1 3   14 9  o 234.8472 4.487795 672.2440       25.68352 635.7695       42.59943 693.0742       32.19249 228.1831 7.671889 238.4364 5.540461 -10.25336      9.463328 
1 1 1 3   14 10 o 578.2821 8.417116 4079.832       118.6149 3935.139       163.6619 4239.930       172.1536 567.5802 11.83271 589.1308 11.99135 -21.55060      16.84653 
1 1 1 3   14 11 o 469.9055 6.196219 2692.459       70.95343 2629.297       110.7097 2736.487       92.43208 464.1039 9.788913 473.6143 8.008696 -9.510406      12.64761 
1 1 1 3   14 12 o 301.2682 4.206127 1106.298       30.87960 1129.141       49.91566 1092.136       39.30312 304.2753 6.731845 299.2984 5.388732 4.976898       8.623002 
1 1 1 3   14 13 o 209.7397 3.222178 536.1309       16.46897 561.6301       27.10169 521.2023       20.73688 214.6290 5.181695 206.7834 4.115205 7.845581       6.617014 
1 1 1 3   14 14 o 294.1129 4.640517 1054.570       33.25956 1089.026       48.13826 1023.099       46.00639 298.7936 6.611240 289.6128 6.518750 9.180878       9.284535 
1 1 1 3   14 15 o 122.8032 2.872760 183.7945       8.596965 173.1087       12.03223 194.9388       12.28768 119.0917 4.152348 126.3940 3.994412 -7.302307      5.761712 
1 1 1 3   14 16 o 345.0465 6.071455 1452.550       51.05126 1465.649       63.46023 1428.526       85.94405 346.4778 7.516058 341.6018 10.33616 4.875977       12.77996 
1 1 1 3   14 17 o 286.4329 4.549615 1000.564       31.75657 1018.328       45.54382 983.7554       44.30304 288.8307 6.470681 283.8907 6.403924 4.939941       9.103842 
1 1 1 3   14 18 o 125.3443 2.880577 191.5180       8.798731 177.2682       12.23482 206.7822       12.66278 120.4893 4.173196 130.1553 3.997110 -9.666000      5.778621 
1 1 1 3   14 19 f 211.2216 4.321454 544.2745       22.24356 554.0275       40.49245 540.0595       26.61960 212.6650 7.826787 210.3446 5.193190 2.320404       9.392965 
1 1 1 3   14 20 f 162.2137 3.192014 320.8763       12.61793 337.8016       18.35263 305.7039       17.37628 166.3060 4.532725 158.2034 4.511790 8.102661       6.395455 
1 1 1 3   14 21 o 215.3945 3.745087 566.0719       19.65769 565.5858       27.81263 566.5571       27.78773 215.1535 5.304661 215.3392 5.295342 -0.1856995     7.495337 
1 1 1 3   14 22 o 174.7184 3.329693 372.4256       14.17683 385.7988       20.38734 359.9045       19.72708 177.6517 4.713450 171.5809 4.722491 6.070801       6.672221 
1 1 1 3   14 23 o 26.07321 4.785708 8.568832       2.928702 10.19087       4.005549 6.705637       4.292994 28.32421 5.990615 23.28573 7.000432 5.038477       9.213768 
1 1 1 3   14 24 o 60.12967 3.291302 44.25560       4.804336 34.66697       6.805224 53.78322       6.783542 52.96333 5.345759 66.21790 4.225881 -13.25457      6.814339 
1 1 1 3   14 25 o 205.2327 3.688658 514.3774       18.44808 519.7160       26.12350 509.0665       26.05567 205.9990 5.208092 203.8679 5.249024 2.131058       7.394354 
1 1 1 3   14 26 o 173.8834 3.383586 369.1997       14.33743 365.3042       20.02975 373.2931       20.53196 172.7157 4.763460 174.5831 4.830695 -1.867386      6.784259 
1 1 1 3   14 27 o 153.8805 3.829900 289.4240       14.36175 295.6214       17.20487 275.1812       26.08234 155.3538 4.549477 149.2908 7.190450 6.062958       8.508838 
1 1 1 3   14 28 o 182.1590 3.502610 405.4904       15.54814 402.6937       21.73642 408.4206       22.24934 181.2046 4.927037 182.4698 5.008423 -1.265198      7.025667 
1 1 1 3   14 29 o 95.41812 3.301868 111.3913       7.666053 111.2977       9.406573 111.5766       13.22859 95.27805 4.060687 95.10677 5.734402 0.1712799      7.026560 
1 1 1 3   14 30 o 45.88006 3.821132 25.93586       4.233456 25.16204       5.574085 26.99064       6.507802 44.97359 5.180584 46.46875 5.878256 -1.495163      7.835327 
1 1 1 3   14 31 o 130.6843 3.151538 208.7983       10.03650 205.6267       13.65343 212.5268       14.80374 129.4214 4.335239 131.5094 4.626534 -2.087982      6.340277 
1 1 1 3   14 32 o 18.83189 7.384742 2.672128       4.938992 5.983104       10.08053 1.626245       5.665615 26.97828 10.55874 18.84206 7.726316 8.136219       13.08369 
1 1 1 3   14 33 o 149.9385 3.348055 275.3298       12.23325 260.4206       16.52597 293.4028       18.19507 145.3995 4.670159 154.2777 4.845664 -8.878220      6.729847 
1 1 1 3   14 34 o 63.81339 3.446459 50.08901       5.339572 51.27856       7.017867 48.45371       8.228359 64.35706 4.503209 62.31300 5.474326 2.044064       7.088521 
1 1 1 3   14 35 o 50.14509 4.220201 31.22559       5.109192 31.50258       6.930179 30.89579       7.562083 49.95911 5.800051 49.26989 6.453275 0.6892166      8.676713 
1 1 1 3   14 36 o 22.08035 6.894845 6.185886       4.114714 6.032470       4.547120 6.879391       9.667746 22.09435 7.283165 26.60032 10.36062 -4.505970      12.66440 
1 1 1 3   14 37 o 57.02476 3.541695 40.34406       4.897357 40.76054       6.366745 39.74054       7.664130 56.96393 4.626287 55.80706 5.716252 1.156868       7.353779 
1 1 1 3   14 38 o 50.05520 3.837503 31.37251       4.645253 29.49969       5.951941 34.29098       7.429964 48.00857 5.168836 51.36298 6.052140 -3.354412      7.958974 
1 1 1 3   14 39 o 68.17882 3.899407 58.50027       6.451625 62.62616       7.529081 47.09970       12.51546 70.23392 4.421488 57.12105 9.311610 13.11287       10.30804 
1 1 1 3   14 40 o 12.39004 5.602019 -1.361953      3.614833 -1.072409      4.100336 -2.372029      7.658419 13.46340 6.037070 17.46546 7.996012 -4.002061      10.01910 
1 1 1 3   14 41 o 16.61431 6.418126 3.079750       3.686784 1.266058       4.480926 6.880422       6.486586 15.65392 6.673323 22.21957 8.531513 -6.565659      10.83143 
1 1 1 3   14 42 o 25.66165 7.837529 10.62550       5.351656 19.81418       9.770857 6.687628       6.396421 31.50798 10.68154 21.23462 8.380473 10.27336       13.57673 
1 1 1 3   14 43 o 29.36364 7.699777 14.50900       5.576361 15.46825       10.22005 14.10237       6.654158 25.85731 10.46112 27.45740 8.792948 -1.600084      13.66569 
1 1 1 3   14 44 o 9.304008 4.547970 -4.938578      3.417908 -7.187654      4.591602 -2.143690      5.118519 10.31249 5.086525 13.10476 6.177305 -2.792267      8.001990 
1 1 1 3   14 45 o 28.27995 6.564532 13.49739       4.436686 20.98685       6.951985 8.350969       5.762834 31.83678 8.710134 20.15437 7.954454 11.68241       11.79575 
1 1 1 3   14 46 o 19.33558 6.743150 7.199329       3.902513 7.527575       5.394914 6.839050       5.652034 18.54853 7.564847 17.86678 7.550581 0.6817513      10.68823 
1 1 1 3   14 47 o 8.982789 4.426373 -4.612508      3.448627 -3.121077      4.928527 -6.043268      4.827241 11.34756 5.528080 10.24118 5.080669 1.106380       7.508186 
1 1 1 3   15 0  o 102.3880 2.731244 127.8389       6.808595 130.7660       9.576400 124.8467       9.682083 103.5150 3.802786 101.1358 3.936023 2.379135       5.472975 
1 1 1 3   15 1  o 359.7345 6.306344 1577.750       55.28354 1568.767       67.53162 1596.002       96.25934 358.6534 7.726736 361.4206 10.94194 -2.767151      13.39509 
1 1 1 3   15 2  o 312.8094 4.868037 1192.685       37.10818 1293.703       55.09175 1108.791       50.20571 325.7252 6.940634 301.5533 6.832079 24.17194       9.739081 
1 1 1 3   15 3  o 557.2826 8.122997 3787.956       110.3133 3680.774       152.9070 3904.292       159.3026 549.0646 11.42794 565.4767 11.56038 -16.41211      16.25546 
1 1 1 3   15 4  o 235.7336 4.565125 677.3159       26.22468 648.8065       44.80212 692.1752       32.34482 230.5032 7.988079 238.2863 5.570185 -7.783051      9.738396 
1 1 1 3   15 5  f 484.3745 7.114911 2861.013       83.98211 2694.201       114.3255 3056.536       123.7736 469.8575 9.984839 500.4428 10.14933 -30.58530      14.23748 
1 1 1 3   15 6  o 746.2538 10.72385 6798.254       195.0174 6587.224       380.8125 6873.271       227.0493 732.2326 21.36440 750.1188 12.42093 -17.88623      24.71269 
1 1 1 3   15 7  o 531.3306 7.748544 3443.323       100.3277 3477.982       201.0166 3431.826       115.7792 532.9635 15.49386 530.3520 8.958399 2.611511       17.89728 
1 1 1 3   15 8  f 152.4485 3.061874 283.2204       11.37487 297.5356       24.82885 279.4177       12.79679 156.0707 6.542798 151.4180 3.468066 4.652664       7.405112 
1 1 1 3   15 9  o 712.2141 10.26680 6192.727       178.1894 6308.012       362.0030 6155.862       204.7062 716.3480 20.75918 709.8618 11.83372 6.486267       23.89520 
1 1 1 3   15 10 o 641.5638 8.302579 5022.025       129.8043 4982.904       204.7021 5048.334       167.8705 638.4019 13.15806 642.9503 10.71423 -4.548401      16.96848 
1 1 1 3   15 11 o 54.34404 2.639349 36.07426       3.484850 35.40133       6.384439 36.35984       4.159065 53.66191 4.937572 54.53085 3.143123 -0.8689384     5.853105 
1 1 1 3   15 12 o 464.5765 6.139304 2632.124       69.50443 2601.629       109.4878 2652.709       89.95417 461.5673 9.734077 466.2523 7.917064 -4.685089      12.54720 
1 1 1 3   15 13 o 336.3226 4.622537 1378.996       37.88546 1352.874       59.62965 1396.679       49.05996 332.9786 7.348688 338.4094 5.949063 -5.430817      9.454870 
1 1 1 3   15 14 o 300.6779 4.676448 1102.294       34.26524 1118.481       49.68673 1087.615       47.31683 302.7696 6.734293 298.5767 6.503149 4.192963       9.361712 
1 1 1 3   15 15 o 250.1782 5.628945 763.4840       34.31726 720.3463       47.53330 810.4474       49.59628 242.7312 8.047055 257.4940 7.913371 -14.76283      11.28612 
1 1 1 3   15 16 o 119.2664 3.385435 173.5437       9.829447 193.3249       19.48623 166.7925       11.38389 125.6896 6.382880 116.8906 4.002359 8.798950       7.533926 
1 1 1 3   15 17 o 227.9202 3.862446 633.4566       21.45266 655.7503       31.14083 613.3207       29.59542 231.8006 5.512893 224.1822 5.417354 7.618378       7.729147 
1 1 1 3   15 18 o 178.3166 3.936050 387.8140       17.10363 369.6190       30.69556 396.0067       20.59743 173.7242 7.266734 180.0911 4.697381 -6.366928      8.652792 
1 1 1 3   15 19 o 297.7158 5.500382 1082.515       39.90532 1019.242       68.51917 1114.991       49.08978 287.9906 9.777502 301.9814 6.670753 -13.99072      11.83632 
1 1 1 3   15 20 o 357.0528 5.485695 1557.767       47.73096 1556.696       67.66436 1558.827       67.34036 356.4173 7.790495 356.6723 7.747650 -0.2549744     10.98717 
1 1 1 3   15 21 f 24.76341 4.898997 7.753985       2.851601 6.751113       3.990790 8.800195       4.076108 23.22980 6.688503 26.29442 6.418375 -3.064619      9.269931 
1 1 1 3   15 22 o 172.6209 3.325707 363.5813       13.98986 346.2365       19.43159 382.2466       20.15770 168.2650 4.743642 176.8134 4.682440 -8.548340      6.665387 
1 1 1 3   15 23 o 251.1647 4.769810 771.1141       29.19415 765.1021       48.88216 774.4474       36.39867 249.3176 8.056231 251.4850 5.939328 -2.167450      10.00892 
1 1 1 3   15 24 o 204.3432 3.658476 509.8544       18.21782 511.8385       25.73665 507.8620       25.79122 204.4605 5.169576 203.6582 5.201029 0.8023071      7.333158 
1 1 1 3   15 25 o 58.15297 3.057990 41.38791       4.318323 39.76191       5.898704 43.26577       6.339113 56.87164 4.287808 59.32278 4.416705 -2.451145      6.155695 
1 1 1 3   15 26 o 83.73558 2.937833 85.68672       5.985493 81.13920       8.222481 90.81272       8.729812 81.35680 4.161193 86.08031 4.174086 -4.723511      5.893939 
1 1 1 3   15 27 o 134.9162 3.696690 222.6394       12.14238 215.0776       14.15141 243.7449       23.64196 132.4990 4.388850 140.5095 6.925995 -8.010513      8.199476 
1 1 1 3   15 28 o 163.5513 3.777422 327.1063       15.05517 310.5710       18.25851 362.2264       26.60958 159.1351 4.713485 171.4185 6.381210 -12.28336      7.933270 
1 1 1 3   15 29 o 80.62144 3.042895 79.51663       5.967515 72.11427       7.956591 89.03448       9.022174 76.61610 4.278578 85.14303 4.362913 -8.526932      6.110748 
1 1 1 3   15 30 o 101.5947 3.049623 126.2490       7.541566 122.9524       10.16372 130.2876       11.24951 100.0886 4.176256 102.9779 4.493661 -2.889252      6.134664 
1 1 1 3   15 31 o 62.34156 3.382324 47.69150       5.119169 43.98008       6.744720 52.73476       7.862298 59.66158 4.676439 65.30701 4.977808 -5.645428      6.829909 
1 1 1 3   15 32 o 129.9852 3.897573 207.3759       12.33199 200.0784       22.34911 210.5704       14.78685 126.5380 7.278461 130.7841 4.647029 -4.246117      8.635443 
1 1 1 3   15 33 o 47.30959 4.043556 27.69142       4.617096 19.75614       5.904786 40.17662       7.406632 39.39656 6.367597 56.75655 5.420896 -17.35999      8.362559 
1 1 1 3   15 34 o 41.65348 4.324993 21.60397       4.326254 20.78099       5.545013 22.88430       6.916224 40.50322 5.781848 42.20663 6.967269 -1.703419      9.053872 
1 1 1 3   15 35 o 19.75127 7.270872 4.057006       4.604224 -0.5213011     5.117198 23.51925       10.55058 16.11329 7.001876 41.45446 10.44900 -25.34117      12.57807 
1 1 1 3   15 36 o 26.28547 5.937732 9.038126       3.713336 13.29151       4.751866 2.366884       5.951141 31.88662 6.338636 19.48669 7.946090 12.39993       10.16458 
1 1 1 3   15 37 o 41.75607 4.301431 21.96304       4.314370 16.98734       5.408170 30.67209       7.154986 35.93700 6.410676 48.66157 6.172413 -12.72456      8.899182 
1 1 1 3   15 38 o 53.19720 3.677080 35.42405       4.737481 38.71616       6.314606 31.18509       7.165367 55.15025 4.744612 48.73719 6.171258 6.413063       7.784328 
1 1 1 3   15 39 o 69.65179 4.516267 61.98986       7.624304 61.98986       7.624304 0.000000       0.000000 69.65179 4.516267 ?        ?        0.000000       4.516267 
1 1 1 3   15 40 o 30.72337 5.544878 12.79890       3.998702 16.20577       5.206394 7.898751       6.244013 34.05606 6.510682 23.56149 8.498172 10.49456       10.70551 
1 1 1 3   15 41 o 19.61403 7.496895 5.069219       4.993479 12.28793       9.428102 2.254748       5.886982 26.57858 10.26454 17.76964 7.613952 8.808939       12.78018 
1 1 1 3   15 42 f 24.45344 6.428660 9.054266       3.880724 9.506329       5.017698 8.381350       6.121892 24.15481 7.624009 22.46451 8.362973 1.690300       11.31657 
1 1 1 3   15 43 o 23.48722 6.517817 8.768497       3.861780 9.667326       5.181572 7.645402       5.792042 23.44839 7.776487 20.94877 8.057133 2.499620       11.19782 
1 1 1 3   15 44 o 17.00634 6.741111 4.411305       4.155342 0.4941135      6.227791 7.554535       5.578722 15.30604 7.080561 20.12888 7.861602 -4.822843      10.58013 
1 1 1 3   15 45 o 12.75255 5.676587 0.8727942      3.555662 0.8994232      5.017076 0.8459221      5.039932 14.06961 6.452715 14.05474 6.453843 0.1487064E-01  9.126314 
1 1 1 3   15 46 o 22.27104 6.870079 9.723135       4.099231 14.84412       5.861215 4.819956       5.735216 25.06125 8.269206 16.12233 7.190906 8.938923       10.95851 
1 1 1 3   15 47 o 14.96259 6.234130 4.104969       3.769384 6.292296       5.412808 2.045486       5.252244 16.47964 7.180655 13.80032 6.424492 2.679325       9.635139 
1 1 1 3   16 0  o 712.8692 11.88731 6205.823       206.5045 5876.674       243.1089 7058.684       391.3309 693.3459 14.38847 758.1384 21.20246 -64.79248      25.62367 
1 1 1 3   16 1  o 809.0916 13.42553 7999.275       264.7068 8161.819       328.4901 7698.256       447.0280 816.6707 16.50590 791.1340 23.21232 25.53668       28.48256 
1 1 1 3   16 2  o 626.1417 9.089823 4783.328       138.6961 4668.296       192.4992 4907.507       200.0079 618.1652 12.77875 633.7828 12.95002 -15.61761      18.19339 
1 1 1 3   16 3  o 163.0504 3.653477 323.9998       14.51658 361.3385       25.89850 306.8945       17.52909 172.0434 6.187404 158.6137 4.539726 13.42969       7.674183 
1 1 1 3   16 4  o 358.9608 6.301621 1571.046       55.12333 1559.153       94.31173 1577.217       67.93540 357.2031 10.84721 359.6037 7.752394 -2.400635      13.33272 
1 1 1 3   16 5  o 360.2762 5.465856 1582.344       47.98770 1457.000       90.40774 1631.511       56.62251 345.2906 10.75759 365.7976 6.352024 -20.50708      12.49295 
1 1 1 3   16 6  o 575.1821 7.486880 4035.070       104.9403 3750.405       157.9177 4260.186       140.4324 554.1237 11.69467 590.8032 9.754123 -36.67957      15.22853 
1 1 1 3   16 7  o 395.3260 5.309105 1905.219       51.14614 1855.267       79.44620 1940.575       66.83955 389.9579 8.360250 398.9064 6.875849 -8.948517      10.82456 
1 1 1 3   16 8  o 240.9719 4.019594 707.7434       23.60395 628.6261       45.31645 737.2000       27.65105 226.8425 8.211311 245.9231 4.613986 -19.08064      9.418838 
1 1 1 3   16 9  f 496.6554 7.314125 3008.842       88.52249 2822.584       170.8365 3077.209       103.5015 480.0194 14.62152 502.1721 8.457813 -22.15274      16.89152 
1 1 1 3   16 10 o 353.2113 6.201993 1521.424       53.38287 1596.023       97.13749 1489.145       63.89681 361.2610 11.04690 349.3743 7.505025 11.88675       13.35512 
1 1 1 3   16 11 o 426.6422 5.691562 2219.631       59.17406 2290.010       95.97557 2176.470       75.15951 433.0848 9.093931 422.3648 7.302307 10.71994       11.66290 
1 1 1 3   16 12 o 298.7514 4.207184 1088.022       30.62934 1024.359       47.12792 1134.577       40.30158 289.7724 6.673985 305.0271 5.421851 -15.25470      8.598752 
1 1 1 3   16 13 o 276.8546 4.393192 934.4911       29.63931 913.0869       42.13950 955.4479       41.69664 273.5762 6.320842 279.8617 6.113945 -6.285492      8.793939 
1 1 1 3   16 14 o 158.5240 2.784631 306.2823       10.75719 287.6036       17.08972 318.5394       13.84384 153.5086 4.573522 161.6510 3.514326 -8.142471      5.767807 
1 1 1 3   16 15 o 350.7693 4.802120 1500.711       41.04787 1560.044       66.95787 1464.987       51.95594 357.3483 7.689069 346.4545 6.153935 10.89383       9.848488 
1 1 1 3   16 16 o 375.0885 5.701122 1717.251       52.11109 1659.059       72.31139 1780.124       75.16376 368.3577 8.055655 381.5563 8.083767 -13.19861      11.41231 
1 1 1 3   16 17 o 169.3309 3.806849 349.6907       15.70862 347.9054       28.99648 350.4323       18.68862 168.5583 7.074990 169.4171 4.530789 -0.8588409     8.401401 
1 1 1 3   16 18 o 342.1007 7.665805 1432.446       63.90690 1406.259       89.47549 1459.717       91.30840 338.0175 10.87663 344.3833 10.89380 -6.365784      15.39402 
1 1 1 3   16 19 o 177.5862 3.354592 384.6597       14.51727 397.6894       21.12822 373.0067       19.98083 180.4061 4.810203 174.7256 4.696940 5.680466       6.723042 
1 1 1 3   16 20 o 350.0185 5.401361 1497.472       46.07128 1551.267       66.82457 1448.737       63.60394 355.6691 7.709991 343.7475 7.592912 11.92163       10.82110 
1 1 1 3   16 21 o 103.5418 2.857263 130.8592       7.202558 122.1910       10.23391 139.3667       10.13867 99.94469 4.211339 106.7777 3.902971 -6.833054      5.741826 
1 1 1 3   16 22 o 64.41859 3.145540 50.75125       4.922974 51.69277       7.868493 50.14563       6.310707 64.83074 5.019591 63.95135 4.070541 0.8793907      6.462631 
1 1 1 3   16 23 o 162.7298 3.250826 323.1764       12.89130 325.9891       18.36323 320.4432       18.10170 163.2377 4.620933 161.8459 4.594320 1.391846       6.516195 
1 1 1 3   16 24 o 43.20185 3.505547 22.93849       3.658894 23.67542       5.018914 22.10256       5.345422 43.73563 4.787219 42.15878 5.321368 1.576843       7.157822 
1 1 1 3   16 25 o 116.2510 2.946899 165.0462       8.341567 158.5967       11.51426 172.1698       12.10112 113.8237 4.158127 118.5959 4.193762 -4.772209      5.905731 
1 1 1 3   16 26 o 232.0955 4.014171 658.6530       22.70380 664.4330       32.23503 652.9632       31.98251 232.7040 5.684445 230.6854 5.689269 2.018661       8.042431 
1 1 1 3   16 27 o 150.5228 4.510762 277.6684       16.52715 277.6684       16.52715 0.000000       0.000000 150.5228 4.510762 ?        ?        0.000000       4.510762 
1 1 1 3   16 28 o 274.3252 4.528353 922.0201       30.27206 899.0688       42.05899 946.6900       43.60520 270.1521 6.388727 277.1826 6.455595 -7.030426      9.082430 
1 1 1 3   16 29 o 114.1589 3.082115 159.3623       8.566374 149.9675       11.65557 170.3983       12.63270 110.5444 4.335144 117.8310 4.407240 -7.286552      6.182009 
1 1 1 3   16 30 o 79.75185 3.113283 77.87314       6.038937 78.43650       8.291387 77.23665       8.813170 79.87051 4.275532 79.20165 4.585884 0.6688614      6.269809 
1 1 1 3   16 31 o 33.78966 4.863406 14.32123       3.889418 11.92301       4.970745 18.10792       6.246069 30.41350 6.869623 37.59612 7.077162 -7.182623      9.862958 
1 1 1 3   16 32 o 83.65833 4.062168 86.11443       8.256634 107.1250       16.03279 78.53105       9.632101 92.42884 7.174261 79.68116 4.985527 12.74768       8.736446 
1 1 1 3   16 33 o 80.13767 3.248566 78.83587       6.330871 71.53979       8.354895 88.67381       9.701709 76.06187 4.528015 84.65829 4.721353 -8.596413      6.541719 
1 1 1 3   16 34 o 18.66015 7.240005 2.931582       4.706812 8.532473       5.362066 -15.87544      9.825704 25.78952 7.838896 16.21929 7.879532 9.570234       11.11464 
1 1 1 3   16 35 o 110.5568 3.149960 150.3331       8.477812 148.4193       11.58312 152.5411       12.44174 109.3864 4.354065 110.7747 4.619112 -1.388336      6.347762 
1 1 1 3   16 36 o 50.89899 3.709768 32.21983       4.569829 31.92954       5.982654 32.62645       7.080635 50.27631 4.947096 50.47373 5.865799 -0.1974182     7.673419 
1 1 1 3   16 37 o 33.11032 5.132143 14.15491       4.007010 12.49467       5.079561 16.89014       6.519853 30.40979 6.999665 35.11058 7.820690 -4.700790      10.49564 
1 1 1 3   16 38 o 23.88080 6.682502 7.777532       4.041143 9.838084       4.809819 2.831486       7.451883 26.64842 7.226120 20.79262 8.721537 5.855803       11.32617 
1 1 1 3   16 39 o 16.28124 6.543265 2.242222       3.969360 4.566036       4.456603 -6.675998      8.730563 19.37829 7.149915 16.86730 7.985893 2.510992       10.71894 
1 1 1 3   16 40 o 29.53988 7.648087 13.07628       5.548295 17.34524       9.935362 11.14167       6.688355 31.28670 10.76709 26.63149 8.835217 4.655207       13.92807 
1 1 1 3   16 41 o 28.91203 5.900308 11.94424       4.016206 16.91697       5.325195 5.384604       6.116143 33.88326 6.686855 20.16666 8.116114 13.71660       10.51596 
1 1 1 3   16 42 f 15.01134 6.174245 2.261093       3.632181 1.139481       4.752213 3.836799       5.632644 15.15455 6.662363 17.93871 7.556977 -2.784155      10.07447 
1 1 1 3   16 43 o 10.48061 4.979094 -2.806404      3.450717 0.3873810      5.057483 -5.588256      4.720071 14.57479 6.604421 11.13920 5.422835 3.435596       8.545497 
1 1 1 3   16 44 o 15.23259 6.643274 2.470180       4.641896 1.825548       9.765716 2.658336       5.276022 17.26343 8.250032 15.74889 6.967661 1.514537       10.79867 
1 1 1 3   16 45 o 12.12096 5.563576 -0.6227932E-01 3.740116 -2.900798      5.228607 2.912024       5.352204 12.20083 5.883763 15.30298 6.876798 -3.102151      9.050360 
1 1 1 3   16 46 o 12.50711 5.707105 0.8357373      3.859475 4.099919       5.369065 -2.654369      5.551762 15.41561 6.910663 12.18072 5.918775 3.234892       9.098855 
1 1 1 3   16 47 o 17.98570 7.165728 7.760549       4.718350 13.26549       6.233880 0.3769839      7.219634 21.15824 8.296655 13.72243 6.686289 7.435816       10.65556 
1 1 1 3   17 0  o 613.0106 10.28504 4587.070       153.6420 4329.121       255.4168 4733.331       192.3296 594.2122 17.65850 622.4117 12.68038 -28.19946      21.73971 
1 1 1 3   17 1  o 558.0222 11.54995 3802.922       157.0608 0.000000       0.000000 3802.922       157.0608 ?        ?        558.0222 11.54995 0.000000       11.54995 
1 1 1 3   17 2  o 347.0816 7.541206 1469.283       63.78353 1456.483       88.93678 1482.839       91.52600 345.2374 10.58378 348.3296 10.79550 -3.092163      15.11817 
1 1 1 3   17 3  o 234.8919 4.579329 672.5220       26.21236 662.8118       31.60371 693.9260       46.92139 233.1691 5.562001 238.3683 8.089393 -5.199265      9.817032 
1 1 1 3   17 4  o 576.1119 8.397823 4049.359       117.8989 3976.052       164.5272 4126.736       169.0325 570.5068 11.83425 581.2040 11.93453 -10.69720      16.80722 
1 1 1 3   17 5  o 283.3496 4.038353 978.5577       27.88451 1027.735       45.35197 948.6674       35.35742 290.3136 6.410512 278.9600 5.201188 11.35355       8.255120 
1 1 1 3   17 6  o 404.1261 6.054460 1991.387       59.62500 2034.819       119.9244 1977.125       68.72070 407.8907 12.07831 402.6269 7.004040 5.263824       13.96217 
1 1 1 3   17 7  o 80.60142 2.806497 79.26638       5.504022 75.09756       7.481676 84.18403       8.125896 78.39632 3.928741 83.00947 4.029087 -4.613152      5.627481 
1 1 1 3   17 8  o 603.2243 7.833345 4439.749       115.1495 4441.557       182.0918 4438.543       148.6441 602.7270 12.39749 602.8669 10.11790 -0.1398926     16.00217 
1 1 1 3   17 9  o 190.9085 3.485431 444.2056       16.21504 422.4760       32.92726 451.1623       18.63068 185.9470 7.280654 192.3892 3.973855 -6.442139      8.294543 
1 1 1 3   17 10 o 306.8148 4.821302 1147.693       36.04763 1374.596       82.32308 1093.866       40.09599 335.2789 10.08727 299.5062 5.493625 35.77267       11.48620 
1 1 1 3   17 11 o 381.1862 5.747077 1772.169       53.38514 1827.933       77.72433 1722.366       73.45260 386.9373 8.242907 375.6177 8.024631 11.31958       11.50392 
1 1 1 3   17 12 o 460.3871 6.807649 2586.624       76.37592 2564.724       108.0870 2608.463       107.9369 458.0672 9.682961 461.9709 9.587804 -3.903748      13.62665 
1 1 1 3   17 13 o 160.6179 3.107438 314.4561       12.16277 285.4088       23.74105 324.7930       14.16250 152.7924 6.390309 163.2267 3.560515 -10.43423      7.315279 
1 1 1 3   17 14 o 443.9159 6.621645 2406.040       71.63128 2542.885       105.3007 2288.172       97.72668 455.8732 9.478746 432.4783 9.272840 23.39496       13.26017 
1 1 1 3   17 15 o 554.2414 8.124591 3756.605       109.7328 3916.341       159.8226 3614.150       150.9302 564.8263 11.61147 542.6658 11.41321 22.16046       16.28151 
1 1 1 3   17 16 o 515.1511 7.591327 3245.762       95.29901 3050.239       184.9475 3316.441       111.1976 496.3058 15.31026 520.4019 8.768400 -24.09604      17.64338 
1 1 1 3   17 17 o 330.9599 5.975852 1338.333       48.19603 1254.181       81.86226 1382.976       59.62505 319.2839 10.53576 336.2092 7.277515 -16.92523      12.80486 
1 1 1 3   17 18 o 107.0677 2.840162 139.8784       7.403786 148.4432       11.16334 133.1527       9.892530 110.2102 4.164073 104.3920 3.895530 5.818161       5.702163 
1 1 1 3   17 19 o 244.2354 4.088508 728.1169       24.33378 749.7174       35.28502 708.5269       33.60291 247.6002 5.847945 240.7202 5.728333 6.880020       8.186101 
1 1 1 3   17 20 o 241.2080 4.617451 710.7424       27.14126 706.1415       46.19859 713.1673       33.53960 239.6982 7.919988 241.4559 5.700119 -1.757675      9.757949 
1 1 1 3   17 21 o 201.4840 4.097953 495.7545       20.12073 509.3979       34.59793 488.7819       24.73340 203.6849 6.980679 199.8772 5.082024 3.807617       8.634630 
1 1 1 3   17 22 o 136.6511 3.029199 227.8378       10.08735 238.3425       14.69590 218.4790       13.87113 139.6006 4.325111 133.6582 4.264187 5.942337       6.073704 
1 1 1 3   17 23 o 136.6972 3.035256 228.0330       10.11093 232.8223       14.61082 223.6317       14.00635 137.9447 4.351882 135.2042 4.256376 2.740524       6.087332 
1 1 1 3   17 24 o 70.31075 2.941608 60.43777       5.029006 56.28603       7.144924 64.51407       7.079703 67.70844 4.353376 72.54517 4.020428 -4.836739      5.925852 
1 1 1 3   17 25 o 84.69770 2.895222 87.66295       5.966927 78.89847       8.180239 97.62882       8.722895 80.21268 4.199545 89.27230 4.019976 -9.059616      5.813465 
1 1 1 3   17 26 o 185.6568 3.981850 421.5318       18.01491 415.6522       22.21500 432.8247       30.78749 184.1060 4.956071 187.3633 6.754059 -3.257233      8.377347 
1 1 1 3   17 27 o 65.82168 3.843189 53.16967       6.137667 55.53294       6.963974 44.94625       12.99053 67.21774 4.273580 59.41708 9.274654 7.800667       10.21189 
1 1 1 3   17 28 o 258.1711 4.346451 816.5272       27.34504 826.3289       38.88580 806.9385       38.46114 259.0119 6.160772 255.9525 6.166329 3.059464       8.716578 
1 1 1 3   17 29 o 29.60351 5.275915 11.09064       3.666488 11.75950       4.905332 10.24391       5.519172 30.25516 6.817181 28.27439 7.770983 1.980774       10.33741 
1 1 1 3   17 30 o 93.05089 3.087668 105.9907       6.991741 101.3512       9.539246 111.3763       10.27762 90.78519 4.324274 95.15485 4.444542 -4.369652      6.201073 
1 1 1 3   17 31 o 96.96306 3.122981 115.1496       7.369618 115.9434       10.10754 114.2485       10.76824 97.07772 4.283120 96.29256 4.602297 0.7851639      6.286991 
1 1 1 3   17 32 o 72.78011 4.177731 65.32584       7.378376 58.12877       13.69070 68.27190       8.759291 67.35109 8.532729 74.25124 4.867777 -6.900154      9.823580 
1 1 1 3   17 33 o 42.49027 5.921119 22.87648       5.964665 17.88856       6.915109 37.37278       11.78875 36.95272 7.917463 53.26459 9.427144 -16.31187      12.31086 
1 1 1 3   17 34 o 114.3567 3.178459 160.7168       8.848976 163.9307       12.36579 157.3436       12.66838 115.0387 4.419265 112.6121 4.626216 2.426666       6.397795 
1 1 1 3   17 35 o 20.60848 6.446746 5.382555       3.595584 4.804937       4.714094 6.186000       5.559756 20.61405 7.390400 22.85420 8.042755 -2.240154      10.92263 
1 1 1 3   17 36 f 60.29537 3.483401 45.12870       5.096485 42.44388       6.680953 48.86568       7.882102 58.00217 4.768781 62.03660 5.263483 -4.034424      7.102501 
1 1 1 3   17 37 o 54.98595 4.145018 38.08972       5.513211 42.98917       6.822976 28.87289       9.358176 58.08310 4.865113 45.30831 8.792946 12.77478       10.04914 
1 1 1 3   17 38 o 50.41129 3.821765 32.10658       4.659937 33.98682       6.206889 29.67776       7.054470 51.22083 5.037810 47.05989 6.310344 4.160934       8.074651 
1 1 1 3   17 39 o 15.17068 7.107659 -4.325041      6.598248 1.184121       9.263263 -9.999162      9.400923 20.57900 9.161275 16.27938 7.860234 4.299622       12.07113 
1 1 1 3   17 40 o 17.13286 6.482764 3.550987       3.710619 3.956853       4.776253 2.933085       5.893262 18.38737 7.246393 18.35424 7.730803 0.3313446E-01  10.59601 
1 1 1 3   17 41 o 23.55383 6.510199 8.396926       3.861292 4.607347       4.967924 14.17963       6.136844 18.63153 7.375423 29.08030 8.269051 -10.44877      11.08035 
1 1 1 3   17 42 o 12.72988 5.654957 0.1277440      3.510413 0.6160415      4.853623 -0.4078563     5.083282 14.72982 6.589325 14.30989 6.537361 0.4199305      9.282042 
1 1 1 3   17 43 o 15.90698 6.338107 3.473356       3.691703 1.692308       5.139413 5.371950       5.306300 15.32340 6.822598 18.29387 7.486648 -2.970475      10.12906 
1 1 1 3   17 44 o 18.31272 7.093192 6.095867       4.512070 14.43180       8.882805 3.197103       5.238168 22.63479 9.509956 15.84870 6.980123 6.786092       11.79667 
1 1 1 3   17 45 o 10.08581 4.860456 -2.883986      3.553360 0.4364206      5.097383 -6.022779      4.956019 13.45906 6.286658 10.62794 5.250027 2.831122       8.190534 
1 1 1 3   17 46 o 20.07286 7.335185 9.202653       4.672509 17.01974       6.183367 -1.202698      7.133965 25.86405 8.491440 13.50689 6.595544 12.35716       10.75201 
1 1 1 3   18 0  o 192.2712 5.025379 450.9646       23.52592 476.2827       33.96509 427.6161       32.61720 197.4889 7.068951 187.1076 7.166759 10.38133       10.06640 
1 1 1 3   18 1  o 455.3131 7.824212 2528.975       86.81342 2665.780       155.6386 2467.188       104.5966 466.6929 13.69999 449.5856 9.547048 17.10724       16.69838 
1 1 1 3   18 2  o 187.2084 3.956858 427.1611       18.05144 439.5955       22.41875 404.2367       30.44029 189.8369 4.850097 181.9289 6.878503 7.908020       8.416487 
1 1 1 3   18 3  o 192.2897 4.011583 450.6718       18.79784 454.8961       23.17891 442.5550       32.12966 193.1098 4.929555 190.3622 6.937715 2.747696       8.510723 
1 1 1 3   18 4  o 613.4484 8.929831 4592.936       133.4926 4469.324       184.9383 4727.400       192.8867 604.6432 12.55138 621.8262 12.72908 -17.18298      17.87643 
1 1 1 3   18 5  o 126.2018 3.514038 194.2634       10.79655 220.3165       19.82843 183.2840       12.87201 134.2771 6.075429 122.5467 4.317055 11.73038       7.453040 
1 1 1 3   18 6  o 247.0109 4.100506 743.7164       24.68253 743.9755       34.67475 743.4503       35.14269 247.0072 5.760599 246.9173 5.840465 0.8987427E-01  8.203385 
1 1 1 3   18 7  o 496.4510 7.317567 3006.990       88.52769 3070.101       126.7200 2946.825       123.7278 501.3000 10.37316 491.1368 10.33781 10.16321       14.64489 
1 1 1 3   18 8  o 112.1322 2.866292 153.3363       7.825836 159.8303       10.88273 146.3821       11.26181 114.4421 3.907992 109.5002 4.228381 4.941879       5.757743 
1 1 1 3   18 9  o 272.5599 6.217257 906.1933       41.29494 888.1044       59.13087 923.4146       57.69533 269.5084 9.016077 274.8598 8.624443 -5.351410      12.47680 
1 1 1 3   18 10 o 298.4737 6.661369 1087.046       48.45132 1070.963       69.39722 1102.341       67.67622 295.8679 9.638025 300.2218 9.261418 -4.353943      13.36658 
1 1 1 3   18 11 o 297.1516 5.474236 1077.082       39.64036 1164.855       73.08266 1040.495       47.18431 308.4969 9.733549 291.9846 6.631344 16.51236       11.77781 
1 1 1 3   18 12 o 535.2321 9.068811 3502.955       118.2847 3732.327       213.5292 3401.409       142.0753 550.2177 15.94208 526.9608 11.06380 23.25690       19.40509 
1 1 1 3   18 13 o 454.7729 6.772446 2525.808       75.05441 2649.329       109.7963 2417.460       102.8316 465.1986 9.685304 444.4164 9.495121 20.78229       13.56328 
1 1 1 3   18 14 o 257.5808 4.242747 809.2674       26.63156 728.6903       51.98641 837.9370       31.00952 243.8457 8.762847 262.0608 4.855757 -18.21506      10.01828 
1 1 1 3   18 15 f 301.6488 4.772648 1110.417       35.08303 1102.599       71.79639 1112.870       40.21061 299.6679 9.845011 301.9085 5.465490 -2.240631      11.26037 
1 1 1 3   18 16 o 139.1396 2.989320 236.0584       10.13583 254.6496       23.23204 231.6877       11.26444 144.1617 6.630798 137.8327 3.353677 6.329010       7.430655 
1 1 1 3   18 17 o 69.59849 2.449689 59.12713       4.148290 59.64926       7.475054 58.89477       4.986627 69.76505 4.419554 69.43303 2.953916 0.3320160      5.315833 
1 1 1 3   18 18 o 56.72623 2.993276 39.35463       4.123129 36.98791       6.439462 40.99912       5.367732 54.81256 4.871656 57.83581 3.830111 -3.023247      6.196998 
1 1 1 3   18 19 o 304.1192 5.525962 1131.076       40.95320 1136.719       70.72263 1128.229       50.23211 303.6187 9.570542 303.4516 6.792910 0.1670532      11.73622 
1 1 1 3   18 20 o 17.50246 5.519663 3.691592       2.630558 5.369462       4.850904 2.992640       3.130885 21.90913 7.524064 16.91470 6.027524 4.994434       9.640674 
1 1 1 3   18 21 o 37.53279 3.761194 17.37140       3.393809 21.31515       5.558681 15.02766       4.285200 41.34936 5.665347 34.66574 5.235678 6.683624       7.714174 
1 1 1 3   18 22 o 285.2128 4.609535 994.6285       32.03776 1035.411       46.65179 958.2274       44.07445 290.4730 6.590622 279.4723 6.471606 11.00073       9.236773 
1 1 1 3   18 23 o 129.6715 3.008899 205.2179       9.507982 214.5563       13.91872 197.0479       13.01896 132.4031 4.319632 126.8936 4.216031 5.509483       6.036070 
1 1 1 3   18 24 o 125.3484 3.000693 191.7975       9.165931 197.4579       13.21327 186.5473       12.72564 126.9934 4.275757 123.4364 4.236865 3.556953       6.019396 
1 1 1 3   18 25 o 58.98875 3.470015 42.65913       4.966086 35.70605       6.401403 53.16889       7.870152 53.76273 4.941274 65.69276 4.952675 -11.93003      6.996083 
1 1 1 3   18 26 o 62.06336 3.966975 47.30819       5.968309 48.47207       6.758369 43.18497       12.72054 62.76213 4.447650 58.23600 9.274262 4.526127       10.28560 
1 1 1 3   18 27 o 154.4400 3.305797 291.5007       12.44149 312.4570       17.90830 271.9497       17.29743 159.6025 4.609288 148.8520 4.774774 10.75043       6.636566 
1 1 1 3   18 28 o 109.2517 3.092227 145.9815       8.224293 132.5538       11.17307 161.8603       12.15007 103.8937 4.423257 114.8383 4.349525 -10.94460      6.203513 
1 1 1 3   18 29 o 105.8502 3.068334 137.0872       7.906277 131.4379       10.90756 143.3412       11.47645 103.4288 4.337252 108.0119 4.369153 -4.583038      6.156399 
1 1 1 3   18 30 o 26.39459 5.883972 8.938746       3.687973 8.585525       4.814206 9.440472       5.737639 25.91045 7.309147 27.25290 8.069207 -1.342453      10.88741 
1 1 1 3   18 31 o 59.00082 3.588646 42.82950       5.135302 49.95535       7.243292 35.62790       7.281688 63.52718 4.712421 53.37849 5.685345 10.14869       7.384447 
1 1 1 3   18 32 o 23.54857 9.921807 1.667217       9.711995 0.000000       0.000000 1.667217       9.711995 ?        ?        23.54857 9.921807 0.000000       9.921807 
1 1 1 3   18 33 o 56.29993 3.627501 39.13626       4.950330 35.83123       6.648783 43.24743       7.415445 53.49292 5.164610 58.79326 5.230290 -5.300346      7.350451 
1 1 1 3   18 34 o 30.01797 5.464571 11.59488       3.850142 10.23967       5.088945 13.40900       5.887849 27.82116 7.384227 31.74395 7.692757 -3.922792      10.66327 
1 1 1 3   18 35 o 29.73641 5.539939 11.47685       3.866814 14.44355       5.154809 7.659324       5.847447 33.08539 6.624765 24.56842 8.263343 8.516966       10.59105 
1 1 1 3   18 36 o 14.52120 6.170405 0.4223531      3.809432 -0.1366819     4.553535 1.726018       6.953639 15.25452 6.617015 19.82559 8.376514 -4.571067      10.67478 
1 1 1 3   18 37 o 19.97587 6.578192 5.167679       3.709782 10.91463       4.868263 -2.791297      5.729068 28.08924 7.107540 15.11670 6.918883 12.97254       9.919076 
1 1 1 3   18 38 o 33.07728 6.549378 15.11338       5.092327 18.75456       9.148821 13.47890       6.129619 34.32069 10.19628 30.31357 8.130676 4.007116       13.04117 
1 1 1 3   18 39 o 53.24029 4.522544 37.00578       5.812109 34.73794       6.552942 45.36877       12.58380 50.89887 5.363681 52.67728 10.17117 -1.778412      11.49877 
1 1 1 3   18 40 o 12.37703 5.577920 -0.8241674     3.549976 -0.7843542     4.639748 -0.8803852     5.513374 14.05887 6.352568 15.10907 6.865924 -1.050196      9.353931 
1 1 1 3   18 41 o 16.35317 6.298672 3.458968       3.543304 1.081806       4.614262 6.875163       5.531515 15.01039 6.583025 20.72087 7.897628 -5.710479      10.28148 
1 1 1 3   18 42 o 18.32163 6.715429 5.220630       3.920797 8.106406       6.347438 3.440262       4.985653 21.12614 8.345001 16.83566 7.101962 4.290480       10.95796 
1 1 1 3   18 43 o 16.10105 6.360458 3.810588       3.687635 2.070079       5.207093 5.561849       5.223151 15.40616 6.862914 18.15259 7.428169 -2.746428      10.11322 
1 1 1 3   18 44 o 13.00235 5.960722 0.3098390      4.275072 -5.462291      8.189758 2.471760       5.012136 13.77112 6.792597 14.98373 6.699976 -1.212605      9.540915 
1 1 1 3   18 45 o 14.06312 6.045508 2.751629       3.734130 5.470269       5.639120 0.6286403      4.983212 16.50895 7.257648 13.32170 6.220312 3.187248       9.558543 
1 1 1 3   18 46 o 22.82803 7.010589 10.94491       4.274424 9.403950       6.024995 12.50645       6.065099 18.47378 7.800836 21.04871 8.203955 -2.574932      11.32068 
1 1 1 3   19 0  o 211.0057 3.727331 542.6647       19.16586 566.7376       27.55776 520.1124       26.67313 215.6018 5.245119 206.4733 5.305594 9.128540       7.460603 
1 1 1 3   19 1  o 131.8666 3.037599 211.9181       9.761159 220.7172       13.84005 203.2091       13.76896 134.4967 4.227947 129.0394 4.385044 5.457321       6.091318 
1 1 1 3   19 2  o 412.3768 6.209106 2073.896       62.39639 1952.874       84.59988 2218.260       92.39860 399.9915 8.679263 426.2856 8.894645 -26.29407      12.42756 
1 1 1 3   19 3  o 670.7007 11.21275 5497.704       183.2639 5522.672       225.1549 5448.689       315.4603 671.7086 13.75512 665.3979 19.47578 6.310669       23.84343 
1 1 1 3   19 4  o 121.9498 2.992923 181.2451       8.894321 175.9742       12.06686 187.5153       13.16121 120.0804 4.129837 123.9489 4.364105 -3.868553      6.008408 
1 1 1 3   19 5  o 234.1868 3.546003 668.4594       20.23661 667.9849       31.83903 668.7811       26.21234 234.0463 5.582412 234.2168 4.592526 -0.1705322     7.228736 
1 1 1 3   19 6  o 277.5909 3.998209 939.3166       27.04623 1007.542       44.48698 899.3138       34.06459 287.3967 6.352066 271.5754 5.147266 15.82129       8.175762 
1 1 1 3   19 7  o 541.2084 7.914259 3575.730       104.3785 3580.583       147.9735 3570.923       147.2560 541.0540 11.22296 540.3309 11.18348 0.7230835      15.84377 
1 1 1 3   19 8  o 578.7524 8.431376 4090.969       118.9125 4246.334       172.5479 3950.436       164.1048 588.9164 12.02320 568.0654 11.85460 20.85107       16.88457 
1 1 1 3   19 9  o 362.2275 6.381529 1601.146       56.33033 1681.649       102.1351 1565.954       67.52967 370.4450 11.32728 358.0963 7.738534 12.34872       13.71832 
1 1 1 3   19 10 o 547.4016 9.256457 3664.315       123.4772 3738.905       218.5498 3629.342       149.6510 550.6205 16.30575 544.3049 11.28239 6.315613       19.82851 
1 1 1 3   19 11 o 276.4235 4.472576 931.9151       30.12789 914.2589       60.88467 937.6404       34.67014 273.2194 9.157450 277.2289 5.131934 -4.009491      10.49741 
1 1 1 3   19 12 o 144.3790 3.084296 254.1220       10.85166 264.1234       23.77820 251.4910       12.19576 146.9021 6.659566 143.6193 3.484656 3.282791       7.516159 
1 1 1 3   19 13 o 210.3168 3.693258 539.4219       18.92865 603.9685       42.12627 523.0933       21.18803 222.0786 7.796225 207.0830 4.198654 14.99561       8.854932 
1 1 1 3   19 14 o 203.6199 3.625145 505.6643       17.98795 520.2888       38.44110 501.5644       20.35382 206.0604 7.668732 202.7645 4.119248 3.295883       8.705036 
1 1 1 3   19 15 o 220.6907 3.412169 594.0201       18.35062 592.2277       29.66307 595.1313       23.35640 220.1123 5.534524 220.8300 4.340219 -0.7177734     7.033382 
1 1 1 3   19 16 o 67.59914 2.539876 55.79188       4.176540 49.29816       7.468955 58.74617       5.037792 63.34917 4.875673 69.34216 2.988322 -5.992981      5.718589 
1 1 1 3   19 17 o 289.4589 4.132753 1022.799       29.15160 1041.720       47.18998 1011.122       37.07088 291.6946 6.638735 287.6309 5.288849 4.063690       8.487917 
1 1 1 3   19 18 o 133.4639 2.876546 217.2552       9.355594 252.2423       20.15595 207.6475       10.56233 143.4766 5.776637 130.4152 3.326212 13.06140       6.665824 
1 1 1 3   19 19 o 207.1032 3.274511 523.3560       16.52606 554.0714       27.54515 506.0819       20.65685 212.8475 5.310562 203.5674 4.164087 9.280106       6.748459 
1 1 1 3   19 20 o 112.0791 2.906497 153.3486       7.931655 160.3284       11.89415 147.7592       10.64382 114.4793 4.271029 109.9238 3.980039 4.555481       5.838013 
1 1 1 3   19 21 o 109.0228 2.912033 145.1272       7.729665 155.2826       11.65192 137.1456       10.32989 112.6453 4.252346 105.8792 4.010836 6.766113       5.845448 
1 1 1 3   19 22 o 54.74479 3.159398 36.70357       4.196957 35.47864       6.523246 37.56876       5.482327 53.60340 5.053483 55.29384 4.097790 -1.690437      6.506118 
1 1 1 3   19 23 o 127.1876 3.018791 197.4647       9.356511 178.7674       13.10363 216.9138       13.36443 120.8049 4.458787 133.1357 4.124242 -12.33075      6.073727 
1 1 1 3   19 24 o 69.68298 3.340677 59.44535       5.656275 59.72875       7.748810 59.12212       8.275502 69.70403 4.587350 69.29961 4.932600 0.4044189      6.736046 
1 1 1 3   19 25 o 37.55407 4.183850 17.46824       3.763914 14.96812       5.524160 19.63466       5.142288 34.26159 6.855928 39.63278 5.470047 -5.371185      8.770700 
1 1 1 3   19 26 o 76.67503 3.814164 72.08916       7.104343 77.39156       8.256514 56.96792       13.94295 79.38775 4.283696 67.16675 8.724481 12.22100       9.719394 
1 1 1 3   19 27 o 30.09235 5.256414 11.44166       3.714417 11.07820       5.114376 11.84737       5.403498 29.35110 7.204696 30.34029 7.380092 -0.9891853     10.31375 
1 1 1 3   19 28 o 83.81447 3.123234 85.99567       6.367945 92.52792       9.140684 79.83569       8.876398 86.76014 4.337122 80.53919 4.541049 6.220947       6.279471 
1 1 1 3   19 29 o 46.63205 3.945884 26.84248       4.441943 31.83885       6.208201 21.60176       6.358197 50.61471 5.102892 41.28577 6.537197 9.328938       8.293036 
1 1 1 3   19 30 o 49.26209 3.815427 29.93427       4.544602 29.29731       6.176859 30.68601       6.710305 48.45265 5.318684 49.52503 5.661703 -1.072380      7.768094 
1 1 1 3   19 31 o 47.87617 5.360927 28.69384       6.147267 26.37321       7.492204 33.47429       10.75330 45.44984 6.988017 50.64728 9.044539 -5.197437      11.42961 
1 1 1 3   19 32 o 90.08996 3.792783 99.98953       8.308027 106.5520       16.25601 97.66942       9.665706 91.65755 7.339238 88.84444 4.478889 2.813110       8.597957 
1 1 1 3   19 33 f 34.47546 4.831474 15.02574       3.947791 9.576653       5.266807 22.01299       5.964010 27.01070 7.653776 41.48655 6.079584 -14.47585      9.774540 
1 1 1 3   19 34 o 52.19526 3.610891 33.80120       4.564534 28.83833       6.205173 39.65327       6.738167 47.63713 5.442875 56.12096 4.978581 -8.483837      7.376392 
1 1 1 3   19 35 o 13.72999 5.939635 -0.1691122     3.648977 -1.256531      4.334320 2.477247       6.761559 14.06699 6.264189 20.28033 8.390882 -6.213344      10.47124 
1 1 1 3   19 36 o 34.27243 4.946500 15.17554       4.011816 12.59677       5.295831 18.64839       6.145682 30.26039 7.272234 37.08313 7.058535 -6.822746      10.13451 
1 1 1 3   19 37 o 16.83893 6.872198 2.103841       4.455829 5.634398       7.708888 0.3324825      5.460386 22.80146 9.134106 16.63126 7.229848 6.170197       11.64915 
1 1 1 3   19 38 o 28.87041 5.881731 11.45800       3.997378 13.42435       5.129804 8.418061       6.378265 30.63018 7.022690 24.14908 8.603385 6.481094       11.10569 
1 1 1 3   19 39 o 46.04004 5.763580 29.21883       6.325131 29.21883       6.325131 0.000000       0.000000 46.04004 5.763580 ?        ?        0.000000       5.763580 
1 1 1 3   19 40 o 33.12485 5.339783 15.37047       4.163837 14.68927       5.567389 16.23518       6.272594 30.41625 7.547279 31.40289 8.132773 -0.9866447     11.09520 
1 1 1 3   19 41 o 18.11620 6.791147 4.871036       4.051023 4.291608       6.476915 5.243353       5.191890 18.49590 7.956683 18.79505 7.507222 -0.2991447     10.93925 
1 1 1 3   19 42 o 19.30454 6.566274 6.086089       3.692664 7.291753       5.343940 4.984344       5.108447 20.19447 7.746310 17.97588 7.349869 2.218596       10.67829 
1 1 1 3   19 43 o 20.10230 6.552598 7.040770       3.685074 11.93426       5.639526 3.394440       4.868118 24.03101 8.115177 15.91481 6.872578 8.116196       10.63430 
1 1 1 3   19 44 o 20.32063 7.225250 8.443029       4.496447 18.18216       9.585752 5.695579       5.091329 22.68085 9.716985 17.12628 7.197929 5.554569       12.09256 
1 1 1 3   19 45 o 13.81862 6.156295 2.387177       4.191041 4.916470       5.410657 -1.406600      6.626532 15.89572 7.043139 13.29683 6.462315 2.598887       9.558625 
1 1 1 3   20 0  f 105.2606 3.036382 135.1484       7.780444 133.0132       10.73883 137.5077       11.28813 104.3709 4.230994 106.1148 4.374637 -1.743874      6.085948 
1 1 1 3   20 1  o 536.8075 9.105481 3519.381       119.1126 3364.076       141.3764 3899.317       221.1259 524.5363 11.06026 563.4020 16.12248 -38.86572      19.55157 
1 1 1 3   20 2  o 701.6357 10.16498 6016.406       173.8018 5735.059       237.6730 6339.778       254.8062 684.0399 14.25812 719.1149 14.54037 -35.07507      20.36459 
1 1 1 3   20 3  o 359.5150 5.527989 1576.310       48.43064 1691.794       71.33365 1477.558       65.96367 372.2756 7.863099 347.9139 7.780311 24.36176       11.06172 
1 1 1 3   20 4  o 178.0366 3.875003 386.3952       16.81192 368.2338       20.11113 428.5332       30.63373 173.7163 4.755198 187.2834 6.723102 -13.56708      8.234805 
1 1 1 3   20 5  o 139.7581 3.027294 238.0647       10.31021 242.1301       14.69500 234.1231       14.46930 140.8594 4.286012 138.5082 4.292006 2.351135       6.065576 
1 1 1 3   20 6  o 512.3019 7.532530 3204.486       94.03790 3054.821       128.8878 3374.844       137.5098 499.6914 10.58459 525.1808 10.74457 -25.48947      15.08241 
1 1 1 3   20 7  o 224.9265 3.453339 616.7287       18.92849 602.7490       29.37873 626.6505       24.75027 222.2850 5.423587 226.6917 4.480311 -4.406662      7.034805 
1 1 1 3   20 8  o 270.0728 3.920039 889.3278       25.79926 901.1074       40.96222 881.5825       33.21513 271.7185 6.186260 268.8329 5.070109 2.885529       7.998489 
1 1 1 3   20 9  o 21.56993 6.161682 5.812243       3.399756 0.9201281      7.960523 6.903596       3.759897 21.58900 9.032105 23.41279 6.405636 -1.823790      11.07299 
1 1 1 3   20 10 o 269.5525 4.396997 886.2399       28.88256 846.4351       57.47898 899.6854       33.40632 262.8377 8.987205 271.5439 5.048385 -8.706207      10.30806 
1 1 1 3   20 11 o 255.2787 4.227577 794.8999       26.29918 778.2104       53.44707 800.2318       30.20945 251.9865 8.716959 256.0897 4.840774 -4.103180      9.970881 
1 1 1 3   20 12 o 237.8289 4.023420 689.9584       23.31826 711.2082       49.02678 683.7460       26.50858 240.8720 8.365088 236.7153 4.595407 4.156662       9.544238 
1 1 1 3   20 13 o 179.9151 3.405784 394.7663       14.93210 349.0463       29.95475 409.8839       17.22478 168.7422 7.301887 183.3040 3.856078 -14.56181      8.257535 
1 1 1 3   20 14 o 256.8657 3.795906 804.9721       23.76061 864.1199       39.81934 772.2665       29.60983 265.8565 6.146256 251.4925 4.831420 14.36400       7.817870 
1 1 1 3   20 15 o 143.4898 2.746429 251.0614       9.603414 252.6253       16.02482 250.1850       11.99622 143.7659 4.579895 143.2082 3.437481 0.5577240      5.726405 
1 1 1 3   20 16 o 151.6713 3.071200 280.5910       11.35136 257.5141       22.40802 288.5573       13.16564 144.9105 6.361023 153.7842 3.513130 -8.873657      7.266684 
1 1 1 3   20 17 o 160.6623 3.154089 314.8955       12.34878 315.8070       25.05933 314.6032       14.19151 160.4596 6.421637 160.5561 3.627152 -0.9649658E-01 7.375205 
1 1 1 3   20 18 o 76.81442 2.491784 72.02909       4.658157 61.37885       8.008670 77.47423       5.726444 70.71896 4.673366 79.63868 2.955828 -8.919716      5.529672 
1 1 1 3   20 19 o 129.0946 2.643840 203.2667       8.317242 211.3557       14.13432 198.9822       10.28676 131.4442 4.418911 127.6471 3.309771 3.797050       5.520992 
1 1 1 3   20 20 o 82.59248 2.479969 83.27463       4.985750 72.52937       8.451371 89.01038       6.174674 76.89253 4.530391 85.35762 2.973030 -8.465088      5.418796 
1 1 1 3   20 21 o 176.0461 3.418612 378.4143       14.66603 377.6219       21.22145 379.1388       20.29157 175.5892 4.964520 175.9828 4.735920 -0.3935547     6.861152 
1 1 1 3   20 22 o 178.5609 3.895715 389.6595       16.95156 390.0349       21.67977 389.0689       27.19233 178.4064 4.991546 177.8903 6.282614 0.5160828      8.024137 
1 1 1 3   20 23 o 67.80264 3.321606 56.28257       5.471508 63.21979       7.773452 49.47089       7.702793 71.73861 4.468759 63.34896 5.030971 8.389652       6.729076 
1 1 1 3   20 24 o 161.9541 3.306816 320.4270       13.05083 327.0241       18.95127 314.4763       17.99885 163.3140 4.766986 160.1789 4.615902 3.135056       6.635564 
1 1 1 3   20 25 o 52.85015 4.479372 34.45380       5.714698 35.87456       6.660999 30.49186       11.12329 53.83492 5.139689 48.61104 9.729724 5.223881       11.00381 
1 1 1 3   20 26 o 35.60482 5.902745 16.00621       4.942239 17.18881       5.750431 12.66361       9.667712 36.77521 6.661880 32.28118 10.61871 4.494034       12.53546 
1 1 1 3   20 27 o 112.7485 3.093208 155.4949       8.490740 166.8246       12.38758 145.4558       11.66079 116.5653 4.368680 108.8258 4.406146 7.739502       6.204796 
1 1 1 3   20 28 o 52.14632 3.667367 33.46159       4.630585 32.28384       6.528241 34.65416       6.569223 50.93262 5.338991 52.82146 5.169609 -1.888844      7.431667 
1 1 1 3   20 29 o 33.49573 5.191010 14.14034       4.100181 17.97544       5.693613 10.00892       5.909472 37.57672 6.449956 27.97761 8.163901 9.599108       10.40438 
1 1 1 3   20 30 f 40.67767 6.371504 21.03708       6.108691 23.45930       7.306416 15.41161       11.13466 42.76134 7.271677 34.79537 11.39319 7.965973       13.51600 
1 1 1 3   20 31 o 87.91824 3.154877 94.87233       6.748276 98.59113       9.640126 91.29897       9.449729 89.31046 4.443347 85.91179 4.529682 3.398666       6.345184 
1 1 1 3   20 32 o 59.54938 4.256726 44.01340       6.136423 42.26937       11.81019 44.65836       7.181996 56.69589 8.836008 59.78864 4.974378 -3.092754      10.13999 
1 1 1 3   20 33 o 27.61549 5.735989 9.914609       3.733775 11.38165       5.289628 8.457813       5.271133 29.25043 7.412790 25.46833 7.778313 3.782101       10.74484 
1 1 1 3   20 34 o 37.35868 4.987410 17.79596       4.427163 18.97107       5.561294 15.76281       7.315103 38.16119 6.192287 33.79280 8.798196 4.368385       10.75884 
1 1 1 3   20 35 o 32.73837 5.109805 13.86902       3.943494 11.23150       5.132547 17.66970       6.161201 28.65747 7.323164 36.10806 7.254094 -7.450594      10.30779 
1 1 1 3   20 36 o 50.28732 4.725564 32.42462       5.723064 49.47062       11.11024 26.26791       6.677082 59.87376 7.799913 44.33871 6.361689 15.53505       10.06527 
1 1 1 3   20 37 o 30.20940 5.693015 12.33539       4.037339 9.431629       5.293303 16.37428       6.242775 25.55899 7.792427 33.63937 7.771728 -8.080376      11.00553 
1 1 1 3   20 38 o 33.06864 5.239162 14.77317       4.081401 11.06223       5.258376 20.39655       6.473052 27.12442 7.634450 37.33012 7.377298 -10.20569      10.61647 
1 1 1 3   20 39 o 37.39153 5.557637 19.48260       4.910297 24.54732       5.791378 6.531591       9.260962 41.75805 5.851611 22.16180 9.523728 19.59625       11.17778 
1 1 1 3   20 40 o 19.95387 7.538174 6.173003       5.012536 9.742054       6.824750 1.992715       7.386071 23.28189 8.795803 17.86220 8.048192 5.419693       11.92223 
1 1 1 3   20 41 o 24.66750 6.497550 9.687776       3.959367 19.65459       6.058609 2.258178       5.230912 34.37344 7.448469 16.07920 7.031517 18.29424       10.24314 
1 1 1 3   20 42 f 19.82367 6.651162 6.690712       3.788508 11.94187       5.402578 1.610263       5.314037 24.94558 7.915711 15.19010 6.836939 9.755477       10.45955 
1 1 1 3   20 43 o 19.02683 6.588683 6.522813       3.722525 11.24935       5.346124 2.074488       5.186399 23.11830 7.899995 14.86010 6.715323 8.258200       10.36849 
1 1 1 3   20 44 o 10.84436 5.342986 -5.397417      5.019291 -6.079612      7.941762 -4.943681      6.476853 12.99700 6.459523 12.30853 6.065341 0.6884794      8.860801 
1 1 1 3   20 45 o 11.85161 5.463964 0.3508211      3.663253 1.525757       5.305243 -0.7198545     5.064390 13.65557 6.389889 12.42470 5.938589 1.230873       8.723389 
1 1 1 3   21 0  o 523.6304 7.719889 3348.183       98.50811 3422.152       141.2677 3278.174       137.4344 528.7937 10.96277 517.5641 10.89671 11.22961       15.45706 
1 1 1 3   21 1  o 419.6633 7.284214 2150.165       74.49374 2152.386       91.33460 2145.752       128.7489 419.6703 8.930813 418.2087 12.64776 1.461548       15.48307 
1 1 1 3   21 2  o 491.5631 8.403551 2952.210       100.6649 2800.383       118.8378 3337.907       189.4094 478.4497 10.19253 520.9531 14.93534 -42.50339      18.08182 
1 1 1 3   21 3  o 222.4532 5.424368 603.6667       29.40519 603.6667       29.40519 0.000000       0.000000 222.4532 5.424368 ?        ?        0.000000       5.424368 
1 1 1 3   21 4  o 410.4433 5.536929 2055.308       55.38067 2016.722       86.22561 2082.403       72.25389 406.1831 8.711206 412.9570 7.179932 -6.773865      11.28878 
1 1 1 3   21 5  o 364.2173 5.589361 1618.603       49.60881 1576.981       68.81601 1663.637       71.58054 359.2563 7.860477 368.9818 7.960749 -9.725464      11.18752 
1 1 1 3   21 6  o 117.4396 2.651079 168.1060       7.587057 165.2025       11.68538 170.2220       9.975734 116.3197 4.128982 118.1112 3.469674 -1.791550      5.393249 
1 1 1 3   21 7  o 333.0073 5.197443 1353.096       42.17738 1328.868       58.58203 1379.171       60.77398 329.7870 7.289451 335.9535 7.423392 -6.166504      10.40398 
1 1 1 3   21 8  o 326.4645 4.554866 1300.149       36.23662 1344.875       58.34386 1272.061       46.23541 331.7354 7.217175 322.7916 5.877822 8.943817       9.307868 
1 1 1 3   21 9  o 208.3218 3.295439 529.1416       16.72954 565.9410       27.24481 506.8680       21.19620 215.3350 5.191980 203.8430 4.267034 11.49200       6.720434 
1 1 1 3   21 10 o 359.1425 5.530313 1574.941       48.40082 1565.080       97.60609 1578.156       55.73616 356.6578 11.24429 359.3851 6.364157 -2.727356      12.92039 
1 1 1 3   21 11 o 251.1224 4.197746 769.4357       25.68844 687.6012       49.56032 799.4983       30.03854 236.7206 8.605680 255.9257 4.816469 -19.20509      9.861852 
1 1 1 3   21 12 o 547.0022 8.058772 3666.322       107.4222 3538.670       211.2573 3710.838       124.7546 532.5620 16.29734 549.7958 9.311489 -17.23376      18.76985 
1 1 1 3   21 13 o 367.1079 5.644575 1647.134       50.49648 1590.651       100.2914 1666.316       58.44523 358.8575 11.48325 369.0550 6.498631 -10.19754      13.19460 
1 1 1 3   21 14 o 248.8855 4.156357 756.1440       25.20859 721.0311       50.83330 767.5953       29.02960 242.1529 8.628141 250.6923 4.751863 -8.539444      9.850128 
1 1 1 3   21 15 o 189.4725 3.477064 438.0352       16.05443 520.3831       36.37489 418.1131       17.89134 205.9046 7.260722 185.0744 3.966982 20.83018       8.273756 
1 1 1 3   21 16 o 49.50524 2.948124 29.99953       3.540475 26.31579       6.717188 31.41658       4.166159 45.96189 6.151591 50.62809 3.396472 -4.666195      7.026955 
1 1 1 3   21 17 o 164.1548 2.921035 328.7140       11.68494 363.5790       20.08396 310.8732       14.36681 172.4068 4.784968 159.5824 3.694360 12.82439       6.045181 
1 1 1 3   21 18 o 111.1247 2.563690 150.6096       6.942444 149.4277       11.78350 151.2381       8.592010 110.4976 4.384788 111.2825 3.171576 -0.7848663     5.411586 
1 1 1 3   21 19 o 93.00883 2.528368 105.5920       5.725289 103.8746       9.957078 106.4402       6.997800 92.07540 4.450824 93.34168 3.080670 -1.266281      5.412981 
1 1 1 3   21 20 o 153.5062 2.840369 287.5318       10.62519 313.1510       18.39207 274.6986       13.01715 159.9260 4.724455 149.9794 3.561625 9.946671       5.916557 
1 1 1 3   21 21 o 59.25261 2.878396 42.94860       4.143744 46.27954       7.415717 41.43642       4.996574 61.27686 5.009851 58.13690 3.543661 3.139957       6.136460 
1 1 1 3   21 22 o 79.03249 2.538720 76.29016       4.883069 81.14651       8.802114 74.13110       5.869004 81.31245 4.459227 77.85827 3.099505 3.454178       5.430620 
1 1 1 3   21 23 o 157.9710 3.295641 304.8461       12.68684 297.3575       18.24880 311.8513       17.64998 155.7184 4.814826 159.5270 4.544822 -3.808655      6.621024 
1 1 1 3   21 24 o 105.4652 3.759273 136.1944       9.646149 138.8726       11.51039 129.8759       17.67953 106.3946 4.449322 102.3310 7.134378 4.063667       8.408081 
1 1 1 3   21 25 o 55.48045 4.509456 37.96812       6.044252 35.98931       6.966504 43.99288       12.15574 53.86336 5.379316 58.85003 8.741298 -4.986668      10.26388 
1 1 1 3   21 26 o 84.52311 3.090971 87.43042       6.355863 86.34794       9.398024 88.34285       8.628319 83.77097 4.621608 84.80938 4.187853 -1.038414      6.236776 
1 1 1 3   21 27 o 72.09669 3.273596 63.71190       5.736433 66.09798       8.463161 61.68397       7.802174 73.19724 4.770618 70.74077 4.550079 2.456467       6.592573 
1 1 1 3   21 28 o 94.40921 3.092025 109.1425       7.104069 111.0172       10.26666 107.4202       9.840240 94.96729 4.448646 93.43720 4.333454 1.530090       6.210416 
1 1 1 3   21 29 o 43.58517 4.787608 23.67586       5.001411 32.34169       8.494143 19.07711       6.187769 50.44685 7.106206 38.59724 6.828518 11.84961       9.855294 
1 1 1 3   21 30 o 78.81729 3.229401 76.27449       6.189545 79.29301       8.822531 73.34885       8.685749 80.06960 4.540176 76.97142 4.652368 3.098183       6.500595 
1 1 1 3   21 31 o 83.26827 3.812862 85.52827       7.716362 78.51856       14.64872 88.22025       9.077925 78.27245 7.782888 84.39236 4.429663 -6.119911      8.955181 
1 1 1 3   21 32 o 54.43372 4.308288 36.91859       5.668329 36.29910       10.77633 37.15555       6.664814 52.24528 8.775008 54.37494 5.088951 -2.129654      10.14388 
1 1 1 3   21 33 o 76.61204 3.594106 72.71132       6.691319 77.45617       8.713276 65.89071       10.44677 78.68689 4.563631 71.85944 6.021017 6.827446       7.555089 
1 1 1 3   21 34 o 50.97963 3.822826 32.49691       4.714577 31.06044       6.673419 33.92821       6.661434 49.08782 5.683669 51.46444 5.391517 -2.376617      7.834063 
1 1 1 3   21 35 o 32.60888 6.551847 14.36550       5.025510 17.77388       8.956797 12.79949       6.071222 34.51173 10.04514 30.11364 8.098369 4.398094       12.90304 
1 1 1 3   21 36 o 15.43853 6.251894 1.799041       3.654139 -1.606637      4.878452 6.152160       5.515444 14.41228 6.512936 21.87802 7.973334 -7.465739      10.29526 
1 1 1 3   21 37 o 16.85608 6.365263 3.250491       3.573183 2.672989       4.709827 4.033652       5.484713 17.35150 7.071394 19.32268 7.716674 -1.971178      10.46669 
1 1 1 3   21 38 o 26.50228 5.877159 9.956373       3.696134 9.335656       4.978982 10.71834       5.516492 24.67667 7.564121 26.15414 7.951228 -1.477476      10.97442 
1 1 1 3   21 39 o 14.87297 6.512753 0.8728201      4.500833 3.566128       5.414635 -5.148700      8.096164 17.88373 7.463094 15.57297 7.460882 2.310756       10.55285 
1 1 1 3   21 40 o 18.32802 6.462337 5.078293       3.590706 6.697694       5.154075 3.551066       5.005246 20.24518 7.644832 17.16677 7.170516 3.078409       10.48140 
1 1 1 3   21 41 o 12.28544 5.571712 -0.3439154     3.608684 -4.931259      4.656180 6.556430       5.710637 11.24272 5.453066 19.43969 7.835793 -8.196969      9.546496 
1 1 1 3   21 42 o 12.41482 5.573630 0.3691682      3.506631 5.668705       5.070926 -4.487473      4.854408 17.89457 7.320453 11.40846 5.541462 6.486111       9.181332 
1 1 1 3   21 43 o 19.97056 6.906364 7.754889       4.089587 11.32537       5.394607 2.930215       6.270911 22.55614 7.923653 15.50488 7.148478 7.051269       10.67169 
1 1 1 3   21 44 o 11.67012 5.548741 -1.258061      4.302967 -1.312109      8.061091 -1.236524      5.088569 14.05938 6.895784 12.38408 5.928235 1.675308       9.093724 
1 1 1 3   22 0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 3   22 1  o 66.47977 3.228700 54.00494       5.214981 56.70635       7.016482 50.67082       7.794991 68.05698 4.251927 64.25208 5.018206 3.804909       6.577331 
1 1 1 3   22 2  o 385.0814 5.875813 1810.014       55.13871 1810.040       77.60059 1809.987       78.36079 384.7486 8.276598 384.7296 8.358091 0.1898193E-01  11.76264 
1 1 1 3   22 3  o 350.7320 5.426832 1501.197       46.38289 1503.217       65.41781 1499.155       65.77427 350.6962 7.654711 350.2145 7.707007 0.4816895      10.86244 
1 1 1 3   22 4  o 300.3354 4.285534 1100.181       31.36516 1066.023       48.42466 1124.868       41.16776 295.4150 6.726637 303.5797 5.564786 -8.164703      8.730091 
1 1 1 3   22 5  o 255.9273 3.804223 798.7485       23.72568 845.4035       38.42304 769.9968       30.16300 263.1293 5.992201 251.2063 4.927289 11.92307       7.757876 
1 1 1 3   22 6  o 206.9205 3.313208 522.0505       16.70661 532.3813       26.49952 515.2357       21.52275 208.8520 5.206707 205.5171 4.297477 3.334885       6.751156 
1 1 1 3   22 7  o 224.2908 4.512715 613.7995       24.66525 608.1019       29.63958 626.6312       44.48061 223.1770 5.449874 226.1374 8.084658 -2.960358      9.750016 
1 1 1 3   22 8  f 232.2271 3.554055 657.7104       20.11283 645.2844       31.22558 666.5212       26.29370 229.8675 5.574384 233.7030 4.616910 -3.835495      7.238067 
1 1 1 3   22 9  o 402.9618 5.457111 1983.219       53.58742 2120.646       88.31946 1903.151       67.41435 415.9217 8.713823 394.4371 7.013559 21.48456       11.18574 
1 1 1 3   22 10 o 364.0599 6.460574 1620.840       57.31654 0.000000       0.000000 1620.840       57.31654 ?        ?        364.0599 6.460574 0.000000       6.460574 
1 1 1 3   22 11 o 140.7240 3.726838 241.7818       12.76917 226.0677       22.13347 249.6212       15.63310 135.7559 6.711246 142.9238 4.494120 -7.167938      8.077001 
1 1 1 3   22 12 f 238.5212 4.058478 694.3926       23.58991 723.2333       49.84133 686.0668       26.77929 242.5895 8.443921 237.0250 4.636272 5.564545       9.633007 
1 1 1 3   22 13 o 21.31622 6.170443 5.672800       3.388073 0.000000       0.000000 5.672800       3.388073 ?        ?        21.31622 6.170443 0.000000       6.170443 
1 1 1 3   22 14 o 233.1323 4.564837 663.9030       25.93367 0.000000       0.000000 663.9030       25.93367 ?        ?        233.1323 4.564837 0.000000       4.564837 
1 1 1 3   22 15 o 139.7982 2.770619 238.3647       9.438752 266.3620       16.41404 224.5330       11.53707 147.5840 4.569447 135.5969 3.494392 11.98711       5.752445 
1 1 1 3   22 16 o 189.5512 3.159967 438.3941       14.59638 446.1036       24.09220 433.9232       18.34696 190.9165 5.183210 188.5038 3.993999 2.412750       6.543523 
1 1 1 3   22 17 o 178.0640 3.070543 386.8892       13.32378 371.1824       21.39243 396.8434       17.03025 174.1260 5.046833 180.2628 3.876847 -6.136856      6.363997 
1 1 1 3   22 18 o 116.8999 2.643488 166.7025       7.530569 169.4957       12.91480 165.2635       9.269497 117.6583 4.512683 116.3123 3.273607 1.345985       5.575016 
1 1 1 3   22 19 o 93.70416 2.567606 107.1934       5.857520 125.0427       10.83528 99.82307       6.962615 101.0303 4.411644 90.37593 3.166321 10.65437       5.430304 
1 1 1 3   22 20 o 89.68904 2.740810 98.25067       5.983350 86.50928       9.410112 106.2194       7.752274 83.95856 4.617095 93.19777 3.419198 -9.239204      5.745301 
1 1 1 3   22 21 o 173.6763 3.014704 368.2482       12.75914 377.1491       21.29308 363.2619       15.93720 175.3943 4.986869 172.3977 3.793539 2.996613       6.265764 
1 1 1 3   22 22 o 157.2403 2.893948 301.8522       11.08896 328.2760       19.06993 288.3531       13.63026 163.6284 4.787641 153.5955 3.641579 10.03294       6.015198 
1 1 1 3   22 23 o 80.80905 3.105392 79.88020       6.103846 92.08189       9.304002 70.66055       8.087545 86.60371 4.423215 75.83894 4.394939 10.76477       6.235409 
1 1 1 3   22 24 o 149.9743 3.947423 275.4602       14.41414 284.3778       17.51285 256.7324       25.37910 152.2168 4.726992 143.9058 7.260513 8.311035       8.663689 
1 1 1 3   22 25 o 57.50747 3.441931 40.58962       4.801431 39.26815       7.358294 41.56948       6.336249 56.25264 5.435448 58.05058 4.514556 -1.797932      7.065784 
1 1 1 3   22 26 o 48.12914 3.822662 28.54825       4.446621 36.79081       7.113944 23.26298       5.696567 54.39890 5.439277 43.11399 5.550636 11.28491       7.771441 
1 1 1 3   22 27 o 21.15432 6.925440 5.358452       4.114237 10.79284       7.976687 3.388723       4.802315 29.60522 9.639885 19.41120 7.368075 10.19403       12.13326 
1 1 1 3   22 28 o 54.28374 4.125568 36.39641       5.416578 42.44303       9.862973 33.78518       6.481470 57.92206 7.138446 52.08225 5.175178 5.839809       8.817022 
1 1 1 3   22 29 o 92.15521 3.158126 104.1741       7.081794 114.0651       10.50914 95.94634       9.584884 96.11113 4.499506 88.13618 4.477357 7.974953       6.347620 
1 1 1 3   22 30 o 12.33525 5.569065 -1.785604      3.557090 5.737625       5.372472 -7.657736      4.746461 22.43475 7.905208 11.41697 5.530023 11.01778       9.647458 
1 1 1 3   22 31 o 26.98191 6.775141 9.561432       4.447861 9.481987       9.279529 9.585128       5.067976 28.44506 10.34586 26.98824 7.457980 1.456816       12.75375 
1 1 1 3   22 32 o 42.87514 4.414349 23.08743       4.546366 23.14759       6.074057 23.01078       6.855745 42.39367 6.051023 41.91896 6.954962 0.4747086      9.218806 
1 1 1 3   22 33 o 48.02110 3.925718 28.85374       4.553904 32.89221       6.646569 25.28062       6.251918 50.69803 5.466143 44.17598 5.959382 6.522053       8.086591 
1 1 1 3   22 34 o 34.29052 6.196547 15.63631       4.987449 11.19653       9.011110 17.59702       5.988311 28.55091 10.21994 36.00505 7.077474 -7.454134      12.43132 
1 1 1 3   22 35 o 14.19971 6.027849 0.5921201      3.629321 -2.785462      5.223756 3.743896       5.046121 14.27305 6.560111 19.12871 7.475191 -4.855659      9.945528 
1 1 1 3   22 36 o 8.735130 4.316721 -7.010432      3.362319 -5.199279      4.821806 -8.724628      4.690969 12.20726 5.823632 10.55724 5.194465 1.650023       7.803663 
1 1 1 3   22 37 o 38.45932 4.690896 19.60719       4.305507 23.83006       6.159612 15.57279       6.020580 41.16881 6.343152 32.02366 7.790443 9.145153       10.04622 
1 1 1 3   22 38 o 19.70683 6.874939 5.672561       4.056736 0.4725185      6.134709 9.713523       5.407953 16.47766 7.386861 24.51715 7.933917 -8.039497      10.84033 
1 1 1 3   22 39 o 21.42436 7.062491 7.337740       4.275737 3.443410       4.885345 20.08621       8.839096 17.16349 7.119621 31.24278 10.14578 -14.07929      12.39459 
1 1 1 3   22 40 o 17.72429 6.392599 4.796011       3.533161 1.883824       5.074912 7.535224       4.921888 15.64274 6.880642 20.87729 7.543011 -5.234546      10.20981 
1 1 1 3   22 41 o 17.98349 6.402095 5.311248       3.531277 9.305294       5.318935 2.163220       4.722125 21.86538 7.848858 15.12178 6.644822 6.743599       10.28388 
1 1 1 3   22 42 o 12.24558 5.630158 -0.1776147     3.852211 0.4562225      5.104563 -1.016147      5.871238 13.80536 6.394727 13.66090 6.491338 0.1444530      9.112080 
1 1 1 3   22 43 o 13.45797 5.882422 2.031402       3.657103 4.666864       5.478697 -0.8663141E-01 4.911513 16.10135 7.112988 12.97851 6.096988 3.122835       9.368450 
1 1 1 3   22 44 o 11.40635 5.451402 -1.517135      4.265656 4.888733       8.572291 -3.625356      4.917744 15.84185 7.612563 11.15759 5.454309 4.684265       9.364861 
1 1 1 3   23 0  o 42.40645 4.659162 22.20553       4.735560 15.45436       5.571628 39.77426       8.987992 34.97108 6.782687 56.67084 6.633677 -21.69976      9.487387 
1 1 1 3   23 1  o 358.0136 6.410322 1565.924       55.92623 1467.958       92.64916 1622.083       70.14794 345.5594 11.01635 364.1228 7.905530 -18.56335      13.55941 
1 1 1 3   23 2  o 237.5034 5.738418 688.8176       33.21223 691.2876       47.11118 686.3771       46.82847 237.5247 8.151228 236.6819 8.131194 0.8428497      11.51342 
1 1 1 3   23 3  o 216.0904 3.825256 569.5313       20.14337 586.9005       28.66573 552.5887       28.31162 219.2532 5.365139 212.6697 5.467431 6.583496       7.660125 
1 1 1 3   23 4  o 262.0078 3.882600 837.3531       24.78980 819.8992       38.49439 849.7205       32.40334 259.0556 6.097733 263.8370 5.039854 -4.781433      7.910908 
1 1 1 3   23 5  o 174.4827 3.053996 371.2101       12.98545 382.0907       20.52728 363.9511       16.76659 176.8671 4.766993 172.7251 3.983393 4.141953       6.212217 
1 1 1 3   23 6  o 306.5676 4.860634 1147.329       36.31243 1142.881       71.31936 1148.885       42.19058 304.9803 9.608191 306.6734 5.645512 -1.693024      11.14402 
1 1 1 3   23 7  o 95.69634 2.626343 111.7329       6.118882 117.0495       9.417657 107.8490       8.049361 97.86692 3.957011 93.96572 3.521478 3.901199       5.297050 
1 1 1 3   23 8  o 204.7624 3.290915 511.3747       16.42113 474.7396       24.81826 539.9019       21.90043 197.0800 5.172114 210.3245 4.272939 -13.24448      6.708858 
1 1 1 3   23 9  o 45.55690 3.175904 25.43571       3.503720 35.01938       5.195784 17.44327       4.744876 53.41776 4.020955 37.40783 5.357863 16.00993       6.698864 
1 1 1 3   23 10 o 193.6411 4.112924 457.6920       19.40816 399.1151       32.86264 489.0660       24.05047 180.3014 7.495759 200.0901 4.932441 -19.78874      8.973036 
1 1 1 3   23 11 o 66.46706 3.556929 54.05930       5.740283 0.000000       0.000000 54.05930       5.740283 ?        ?        66.46706 3.556929 0.000000       3.556929 
1 1 1 3   23 12 o 177.7812 3.919751 385.8083       16.98168 0.000000       0.000000 385.8083       16.98168 ?        ?        177.7812 3.919751 0.000000       3.919751 
1 1 1 3   23 13 o 113.9200 2.972906 158.4113       8.246050 159.6037       17.97234 158.0933       9.280556 113.9644 6.498347 113.7779 3.350837 0.1865158      7.311404 
1 1 1 3   23 14 o 109.5404 2.933501 146.4772       7.823584 130.9744       16.47903 150.9883       8.889272 103.1701 6.588969 111.1895 3.284298 -8.019394      7.362142 
1 1 1 3   23 15 o 54.84169 3.287294 36.83516       4.373080 39.31734       11.18360 36.38713       4.751387 55.90226 8.474900 54.47790 3.599185 1.424362       9.207500 
1 1 1 3   23 16 f 73.12370 2.692773 65.31440       4.790177 59.53422       8.485779 68.01769       5.803203 69.58022 5.038741 74.58601 3.200264 -5.005791      5.969137 
1 1 1 3   23 17 o 142.4730 2.815821 247.6628       9.776284 254.0061       16.54202 244.2579       12.11926 144.0332 4.719287 141.4367 3.516235 2.596512       5.885200 
1 1 1 3   23 18 o 122.8479 2.937356 184.1794       8.793470 185.2631       13.78293 183.4354       11.41952 122.9791 4.607260 122.4710 3.831004 0.5080872      5.991948 
1 1 1 3   23 19 o 143.6760 3.065959 251.9976       10.73462 246.8153       16.28490 255.9797       14.27498 141.9308 4.714934 144.6483 4.053727 -2.717484      6.217983 
1 1 1 3   23 20 o 189.1802 3.176683 437.0315       14.64488 430.5732       23.87775 440.9258       18.54183 187.3526 5.235083 189.8980 4.006786 -2.545334      6.592452 
1 1 1 3   23 21 o 123.5315 2.696793 186.2565       8.118230 194.5178       14.01908 182.0884       9.957749 125.9556 4.574967 122.0385 3.351503 3.917107       5.671234 
1 1 1 3   23 22 o 111.1998 3.141977 151.1681       8.505651 145.7671       12.34412 156.0505       11.73649 108.9752 4.659075 112.8243 4.276477 -3.849129      6.324179 
1 1 1 3   23 23 o 34.66556 4.703843 14.99808       3.871200 13.83712       6.085867 15.78706       5.017047 32.77887 7.743032 35.33239 6.044013 -2.553520      9.822659 
1 1 1 3   23 24 o 127.2247 2.728847 197.6827       8.460319 190.9305       14.13948 201.4483       10.55907 124.6675 4.662406 128.3064 3.380025 -3.638885      5.758698 
1 1 1 3   23 25 o 115.5301 2.696201 163.0492       7.590727 169.7737       13.14314 159.6836       9.298257 117.5114 4.598562 114.2038 3.344669 3.307655       5.686263 
1 1 1 3   23 26 o 25.68181 6.658613 8.480053       4.201545 -1.134869      7.995585 12.14784       4.938323 20.02643 8.726658 30.71670 6.779185 -10.69027      11.05043 
1 1 1 3   23 27 o 38.78270 4.453592 18.73105       4.132762 25.64300       6.957594 14.96277       5.137247 44.99203 6.536941 34.19354 6.400429 10.79849       9.148611 
1 1 1 3   23 28 o 44.76559 4.051750 24.83117       4.372197 30.07874       6.939700 21.37725       5.630114 48.87749 5.948703 41.13594 5.775267 7.741550       8.291005 
1 1 1 3   23 29 o 51.34169 3.826593 32.60151       4.753177 36.34890       7.542904 30.13338       6.121507 53.71994 5.856649 49.03556 5.202113 4.684376       7.833410 
1 1 1 3   23 30 o 52.48820 4.320869 34.29493       5.477840 42.31274       11.33645 31.85261       6.256765 56.80307 8.446372 50.33872 5.174072 6.464344       9.905162 
1 1 1 3   23 31 o 72.87010 4.357921 66.17163       7.703289 72.60075       13.27581 62.90827       9.458405 74.84512 7.374525 70.56062 5.545245 4.284508       9.226774 
1 1 1 3   23 32 o 43.20480 4.230652 23.46369       4.397227 27.30537       6.481885 20.18839       5.985027 46.00659 5.918514 39.23903 6.485464 6.767559       8.780093 
1 1 1 3   23 33 o 35.51512 5.622748 16.47606       4.704423 16.11077       8.438103 16.64082       5.666870 33.33715 9.763137 35.15784 6.860699 -1.820690      11.93265 
1 1 1 3   23 34 o 13.07195 5.750757 -0.5131370     3.546331 3.049803       5.181469 -3.652980      4.864101 18.65461 7.483182 13.24328 6.170997 5.411325       9.699445 
1 1 1 3   23 35 o 60.10451 3.674658 45.67838       5.356479 43.46839       7.639733 47.81524       7.512285 57.33205 5.537019 60.46612 5.147163 -3.134064      7.559885 
1 1 1 3   23 36 o 12.94961 5.762110 -0.5794745     3.660045 0.6186066      5.154097 -1.798221      5.198359 16.02774 6.994946 14.46896 6.610376 1.558777       9.624258 
1 1 1 3   23 37 o 44.38087 4.858982 26.52080       5.169262 33.01158       8.774710 23.07088       6.397179 46.02195 8.120807 39.58800 6.880766 6.433952       10.64389 
1 1 1 3   23 38 o 34.31007 5.922613 17.11399       4.772968 14.42482       5.473844 25.64432       9.749138 29.90258 7.520253 35.73680 10.50195 -5.834225      12.91685 
1 1 1 3   23 39 o 19.04684 6.997843 5.687042       4.261518 5.476155       5.091059 6.180681       7.789110 18.90164 7.471332 20.02581 8.670587 -1.124174      11.44552 
1 1 1 3   23 40 o 26.83148 5.963501 11.21089       3.798151 14.10075       5.804085 9.046522       5.022980 27.34220 8.120876 22.16891 7.654624 5.173288       11.15983 
1 1 1 3   23 41 o 16.90402 6.711439 4.730579       4.125170 1.859727       5.290157 9.184456       6.589193 15.00096 6.780267 20.38636 8.342821 -5.385407      10.75057 
1 1 1 3   23 42 o 15.71897 6.275915 4.128666       3.626914 7.944555       5.303963 0.7772350      4.970702 19.10228 7.601734 13.66187 6.321986 5.440406       9.887055 
1 1 1 3   23 43 o 12.21601 5.614909 0.4375562      3.827469 -5.567540      5.531789 5.952624       5.301284 11.19919 5.534868 16.75553 7.203095 -5.556342      9.084016 
1 1 1 3   24 0  o 207.7832 3.386463 526.5530       17.14719 512.9497       26.29811 536.6136       22.61589 204.8751 5.271814 209.6879 4.425926 -4.812805      6.883374 
1 1 1 3   24 1  o 198.6930 3.670174 481.5757       17.77073 485.7462       24.92173 477.2618       25.34689 199.3777 5.133659 197.6125 5.268193 1.765198       7.355835 
1 1 1 3   24 2  o 231.1056 4.010432 651.6700       22.58591 637.6342       31.21793 667.0866       32.71742 228.4525 5.607537 233.6533 5.746072 -5.200806      8.028811 
1 1 1 3   24 3  o 350.7373 5.456175 1502.838       46.63439 1453.419       64.28986 1557.717       67.74791 344.4835 7.658399 356.5962 7.796202 -12.11267      10.92849 
1 1 1 3   24 4  o 95.34232 3.117446 110.9752       7.233299 110.2009       14.21051 111.2459       8.403384 94.73638 6.189296 95.42628 3.620249 -0.6898956     7.170327 
1 1 1 3   24 5  o 211.6745 3.812940 546.6934       19.66820 561.0889       40.07480 542.1256       22.57393 213.8522 7.702495 210.7404 4.395651 3.111816       8.868493 
1 1 1 3   24 6  o 115.0597 3.649219 161.6819       10.21903 155.0146       17.33626 165.2320       12.65049 112.3907 6.355689 116.2502 4.473927 -3.859520      7.772439 
1 1 1 3   24 7  o 62.55634 2.899501 47.82526       4.408062 53.92535       6.740445 43.26684       5.826770 66.33420 4.191226 59.40239 4.049417 6.931812       5.827877 
1 1 1 3   24 8  o 145.5516 3.220842 258.4226       11.42411 298.2020       24.82241 247.7324       12.86792 155.9426 6.546517 142.4349 3.710444 13.50771       7.524910 
1 1 1 3   24 9  o 214.4372 4.371992 561.5069       22.84629 611.1262       39.80563 537.1323       27.89899 223.1530 7.329854 209.5318 5.468571 13.62126       9.145055 
1 1 1 3   24 10 o 43.86799 4.775197 23.78755       5.022467 0.000000       0.000000 23.78755       5.022467 ?        ?        43.86799 4.775197 0.000000       4.775197 
1 1 1 3   24 11 o 109.3191 3.017332 145.8905       8.030444 154.0816       17.31974 143.6474       9.063563 111.9878 6.372807 108.4441 3.434037 3.543770       7.239149 
1 1 1 3   24 12 o 82.81911 3.006990 83.78399       6.058668 90.88430       13.39202 81.95676       6.793670 85.89043 6.445323 81.87988 3.412275 4.010544       7.292861 
1 1 1 3   24 13 o 28.91324 5.116504 10.52586       3.473121 24.68644       8.402179 7.607673       3.814236 44.12669 8.112514 24.46428 6.344970 19.66241       10.29910 
1 1 1 3   24 14 o 173.0467 3.419657 365.5253       14.42055 340.8539       29.41035 373.3340       16.54604 166.4223 7.269450 174.8396 3.883453 -8.417343      8.241730 
1 1 1 3   24 15 o 154.6734 3.242221 292.0055       12.22065 318.1305       27.29496 285.4556       13.66702 160.7901 6.982706 152.8917 3.668206 7.898392       7.887579 
1 1 1 3   24 16 o 172.0056 3.401354 361.2283       14.25708 353.1476       29.90454 363.6053       16.21897 169.3030 7.265213 172.5200 3.857871 -3.217010      8.225965 
1 1 1 3   24 17 o 105.4692 2.877459 135.8520       7.388651 148.8260       12.14821 128.2350       9.308220 110.2105 4.532953 102.3847 3.737015 7.825821       5.874772 
1 1 1 3   24 18 o 156.0469 2.926366 297.2230       11.12807 290.1046       18.41347 301.3188       13.96729 153.8425 4.917922 157.0415 3.649737 -3.199066      6.124258 
1 1 1 3   24 19 o 97.48865 2.661061 116.0702       6.315949 116.8201       11.17235 115.7180       7.656886 97.56314 4.713128 97.28679 3.234196 0.2763519      5.716082 
1 1 1 3   24 20 o 136.9755 2.805277 229.0410       9.363856 225.5894       15.65952 230.9621       11.68260 135.6195 4.745588 137.4336 3.491100 -1.814041      5.891382 
1 1 1 3   24 21 o 151.2824 3.390354 279.6898       12.49884 275.8014       17.98321 283.3233       17.38406 149.8996 4.929714 151.9826 4.699410 -2.082977      6.810767 
1 1 1 3   24 22 o 84.11643 3.232230 86.59542       6.613180 81.04500       9.669020 91.47411       9.065065 81.13220 4.913531 86.30906 4.323781 -5.176857      6.545065 
1 1 1 3   24 23 o 54.71507 2.972733 36.68614       3.948796 43.10305       7.613005 34.32430       4.618680 58.97400 5.355707 52.84557 3.608165 6.128426       6.457744 
1 1 1 3   24 24 o 163.9463 3.007340 328.5482       12.01490 329.5760       20.01119 327.9688       15.02439 163.6602 5.023521 163.6529 3.767360 0.7324219E-02  6.279233 
1 1 1 3   24 25 o 102.3658 3.580003 128.4777       8.916726 132.9389       16.19190 126.5359       10.68243 103.4151 6.457292 101.4419 4.331289 1.973152       7.775390 
1 1 1 3   24 26 o 125.6987 3.171873 193.5320       9.708129 175.4511       14.00003 210.2793       13.47382 119.2637 4.827062 130.7626 4.233930 -11.49892      6.420802 
1 1 1 3   24 27 o 46.29945 3.927228 26.52023       4.389197 30.92267       7.151250 23.85945       5.559551 49.54666 6.048067 43.60714 5.343260 5.939522       8.070288 
1 1 1 3   24 28 o 51.01014 3.832591 32.18043       4.729308 37.68883       7.674397 28.80778       6.005054 54.72498 5.845092 47.93427 5.225349 6.790707       7.840241 
1 1 1 3   24 29 o 55.90500 3.599040 38.62489       4.877082 34.67444       7.392763 41.66907       6.489624 52.32753 5.900246 57.81143 4.645562 -5.483894      7.509604 
1 1 1 3   24 30 o 34.07993 5.988137 15.03488       4.791694 13.85351       8.631300 15.56118       5.760992 31.99085 9.985498 34.32116 7.121655 -2.330305      12.26492 
1 1 1 3   24 31 o 20.17438 6.479965 5.145425       3.611891 3.640280       5.570342 6.237334       4.744451 20.07414 7.851190 22.27855 7.442659 -2.204407      10.81824 
1 1 1 3   24 32 o 86.75114 3.305409 93.36230       6.974954 88.35583       10.22677 97.71660       9.537422 83.40073 5.055649 88.11838 4.455950 -4.717651      6.739071 
1 1 1 3   24 33 o 12.81513 5.737298 -1.167593      3.687355 1.797491       5.479295 -3.621920      4.985084 17.93255 7.497262 13.48841 6.272416 4.444138       9.775077 
1 1 1 3   24 34 o 19.97081 6.537109 5.313214       3.665832 4.107535       5.315774 6.406552       5.062064 19.59245 7.667669 21.91692 7.677346 -2.324467      10.85057 
1 1 1 3   24 35 o 16.80927 6.425345 3.156085       3.668216 7.834406       5.617480 -0.3217955     4.843439 23.26525 8.091692 15.00620 6.655597 8.259048       10.47723 
1 1 1 3   24 36 o 32.43478 6.072595 14.90736       4.623421 8.798696       7.830997 18.17603       5.728360 23.78255 9.306826 35.18340 6.927903 -11.40085      11.60228 
1 1 1 3   24 37 o 47.58369 4.072852 29.92120       4.677355 31.23476       6.795300 28.73852       6.447920 46.43874 6.156212 44.60153 6.091460 1.837208       8.660533 
1 1 1 3   24 38 o 30.85371 6.904394 14.99351       5.061346 20.28063       6.185860 4.284671       8.803621 35.46400 7.397485 19.53812 8.796428 15.92588       11.49347 
1 1 1 3   24 39 o 9.329929 4.549149 -4.691602      3.358101 -1.233881      5.166667 -7.220671      4.418713 13.69188 6.373311 10.07789 4.974389 3.613984       8.084778 
1 1 1 3   24 40 o 12.22753 5.631701 -0.6267609     3.877984 1.551019       5.245048 -3.252779      5.759587 14.96533 6.758945 12.97992 6.237979 1.985407       9.197594 
1 1 1 3   24 41 o 36.58101 4.994403 20.21950       4.336061 26.80877       6.525396 15.00962       5.802325 38.47520 7.224936 26.52233 8.172166 11.95288       10.90798 
1 1 1 3   24 42 o 13.50733 5.884447 2.124739       3.633588 9.368005       5.612743 -3.101104      4.767451 19.80625 7.839783 11.42907 5.537395 8.377172       9.598174 
1 1 1 3   25 0  o 225.5925 4.000538 621.0982       21.99273 625.5713       43.17687 619.5311       25.55656 225.7462 7.860637 225.2430 4.656023 0.5032349      9.136091 
1 1 1 3   25 1  o 185.3267 3.554048 419.0287       16.05083 451.6953       23.17652 388.9206       22.25039 192.2350 4.951554 178.3473 5.124904 13.88768       7.126186 
1 1 1 3   25 2  o 151.3695 3.253576 279.4861       12.00150 275.5509       16.50440 283.9018       17.48323 150.1563 4.515582 152.3963 4.713391 -2.240021      6.527368 
1 1 1 3   25 3  o 174.2832 3.932852 370.7040       16.70318 366.5933       20.32441 379.2574       29.31747 173.1765 4.820760 175.8584 6.854248 -2.681854      8.379764 
1 1 1 3   25 4  f 190.1618 3.587433 441.2233       16.62429 418.2149       22.56250 468.5494       24.58855 184.9475 5.010752 195.7490 5.159126 -10.80147      7.191955 
1 1 1 3   25 5  o 235.6618 4.691701 678.3429       26.94360 625.6642       43.52198 711.0789       34.30873 225.6785 7.926055 241.1191 5.838979 -15.44061      9.844594 
1 1 1 3   25 6  o 210.2241 3.792048 539.3701       19.42640 537.2090       27.07948 541.6616       27.88437 209.5707 5.306682 210.4170 5.442628 -0.8462677     7.601518 
1 1 1 3   25 7  o 60.21910 4.804171 44.58519       6.991581 0.000000       0.000000 44.58519       6.991581 ?        ?        60.21910 4.804171 0.000000       4.804171 
1 1 1 3   25 8  o 268.5445 5.142144 881.5670       33.65089 0.000000       0.000000 881.5670       33.65089 ?        ?        268.5445 5.142144 0.000000       5.142144 
1 1 1 3   25 9  o 55.12526 3.636407 37.24959       4.857655 32.88434       10.69356 38.38457       5.452713 50.96651 8.935570 55.92505 4.027999 -4.958534      9.801489 
1 1 1 3   25 10 o 163.1727 3.350556 324.9091       13.32295 349.7198       28.60449 318.0357       15.05573 168.7203 6.972162 161.4000 3.827913 7.320328       7.953865 
1 1 1 3   25 11 o 110.9199 3.041938 150.2207       8.214589 165.1866       17.95630 146.2596       9.237955 115.9227 6.381030 109.4121 3.469154 6.510582       7.263096 
1 1 1 3   25 12 f 176.8434 3.465249 381.7534       14.93343 410.6338       32.07532 373.7609       16.87375 182.7120 7.218105 174.9334 3.958246 7.778610       8.232178 
1 1 1 3   25 13 f 78.34818 3.026919 75.01620       5.768302 79.15240       12.70506 73.94223       6.474012 80.05492 6.570340 77.75189 3.425260 2.303024       7.409573 
1 1 1 3   25 14 o 115.8631 3.388237 164.0313       9.556266 0.000000       0.000000 164.0313       9.556266 ?        ?        115.8631 3.388237 0.000000       3.388237 
1 1 1 3   25 15 o 132.7757 3.488303 215.4359       11.27697 207.0575       21.47679 218.6252       13.25059 129.6272 6.822902 133.6848 4.072149 -4.057617      7.945715 
1 1 1 3   25 16 o 88.15025 2.979901 94.95310       6.391999 109.6586       14.86749 91.61857       7.079711 94.25361 6.513020 86.55215 3.363015 7.701462       7.330027 
1 1 1 3   25 17 o 60.82817 3.222160 45.30828       4.759222 22.63900       10.73137 50.85852       5.309967 41.81592 10.53706 64.43967 3.393406 -22.62375      11.06999 
1 1 1 3   25 18 o 68.67480 3.496750 57.77287       5.832654 64.40286       8.868579 52.71928       7.742796 72.31736 5.064415 65.42022 4.892222 6.897141       7.041459 
1 1 1 3   25 19 o 183.5008 3.642521 411.6143       16.28831 407.8157       23.27040 415.2631       22.80690 182.2618 5.244740 183.9592 5.092449 -1.697342      7.310290 
1 1 1 3   25 20 o 153.5802 3.943561 288.7693       14.74689 290.0390       26.73447 288.2141       17.67989 153.0760 7.186915 153.2703 4.739228 -0.1943054     8.608834 
1 1 1 3   25 21 o 73.16239 2.772220 65.45901       4.933616 59.93893       8.947573 67.87045       5.913858 69.65551 5.311300 74.44762 3.267708 -4.792114      6.236010 
1 1 1 3   25 22 o 31.97370 4.105124 12.72594       3.124856 14.45042       6.763108 12.25786       3.523519 33.42157 8.333066 31.25304 4.777967 2.168522       9.605673 
1 1 1 3   25 23 o 11.99745 5.146338 -0.1545810     2.694967 -4.853279      6.358110 0.8744634      2.975475 15.59487 7.192851 13.76630 5.616698 1.828568       9.126029 
1 1 1 3   25 24 o 213.9245 4.532026 562.1538       23.62594 574.6691       41.64416 556.2137       28.68998 214.3377 7.986928 212.2928 5.550493 2.044891       9.726202 
1 1 1 3   25 25 o 102.4921 3.111732 128.6857       7.762924 118.8693       11.70611 136.3914       10.37151 98.10437 4.912155 105.3249 4.048409 -7.220490      6.365444 
1 1 1 3   25 26 o 37.08397 3.892544 17.07400       3.465306 23.33729       7.213590 15.19500       3.951059 42.63580 7.198970 34.78582 4.787819 7.849972       8.645715 
1 1 1 3   25 27 o 34.37992 4.672730 14.85956       3.813585 14.08587       6.279097 15.31175       4.800360 32.71333 7.954534 34.61141 5.902969 -1.898075      9.905537 
1 1 1 3   25 28 o 52.18055 3.089200 33.53840       3.910596 38.65116       7.451539 31.59501       4.594090 55.38483 5.597770 50.50784 3.759504 4.876995       6.743063 
1 1 1 3   25 29 o 17.57817 5.937079 3.671663       3.018510 4.646481       7.289107 3.469891       3.316221 22.82643 8.965240 17.56469 6.208890 5.261740       10.90531 
1 1 1 3   25 30 o 49.66079 4.238422 30.89707       5.080272 41.92715       10.23817 27.29405       5.851479 56.32919 7.656541 46.30028 5.280442 10.02892       9.300844 
1 1 1 3   25 31 o 46.19094 4.123713 26.84833       4.592981 25.38489       7.221929 27.84225       5.951708 43.63777 7.030134 46.55891 5.342360 -2.921139      8.829700 
1 1 1 3   25 32 o 40.67474 4.527492 21.14722       4.411677 31.37442       6.962870 14.28781       5.702342 48.86953 5.970576 32.08906 7.437649 16.78048       9.537631 
1 1 1 3   25 33 o 11.96900 5.431196 -1.534380      3.434730 -1.340744      5.087668 -1.696544      4.655884 14.91221 6.702658 14.01148 6.344209 0.9007311      9.229009 
1 1 1 3   25 34 o 35.19475 4.968943 16.41103       4.143223 14.14342       6.417904 18.03141       5.425206 30.51547 8.377020 36.01704 6.416481 -5.501568      10.55205 
1 1 1 3   25 35 o 26.06519 6.775307 9.981249       4.342677 11.61944       8.247364 9.352804       5.108178 26.36610 9.726792 24.75984 7.674435 1.606262       12.38981 
1 1 1 3   25 36 o 35.48036 5.047935 17.30484       4.241543 28.92310       6.505239 8.712875       5.594212 44.90691 6.102216 23.19989 8.074558 21.70702       10.12104 
1 1 1 3   25 37 o 9.925201 4.750387 -3.452334      3.264450 -8.511827      4.793020 0.9253350      4.458382 10.39041 5.138238 14.70123 6.458420 -4.310813      8.253040 
1 1 1 3   25 38 o 10.72316 5.198793 -4.901742      4.220087 -8.435374      5.045627 3.325361       7.698886 10.62920 5.259142 18.13398 8.189516 -7.504782      9.732767 
1 1 1 3   25 39 o 12.72846 5.704397 0.3141713      3.655422 2.074494       5.119165 -1.517196      5.221447 15.39607 6.834704 13.35245 6.276973 2.043619       9.279739 
1 1 1 3   25 40 o 19.20526 6.597455 6.597122       3.729751 13.37507       5.887733 2.054059       4.820292 24.87068 8.290664 14.69890 6.571709 10.17178       10.57934 
1 1 1 3   25 41 o 13.41185 5.812699 1.971346       3.507656 0.1477159      5.385032 3.315306       4.622886 13.57660 6.379899 15.12425 6.612157 -1.547647      9.188238 
1 1 1 3   25 42 o 14.32300 6.102877 3.115413       3.744278 -1.510789      5.480361 7.165285       5.127639 12.59187 6.060044 17.84585 7.337609 -5.253984      9.516546 
1 1 1 3   26 0  o 95.34717 2.800631 110.9663       6.500232 113.8150       9.746192 108.6839       8.723955 96.46303 4.155832 94.28940 3.804584 2.173630       5.634341 
1 1 1 3   26 1  o 237.9688 4.106624 691.3594       23.81447 729.2762       34.34807 656.2606       33.04710 244.1722 5.772580 231.5394 5.861673 12.63280       8.226900 
1 1 1 3   26 2  o 102.2291 3.055328 127.5915       7.602925 121.1963       10.19054 135.6204       11.41821 99.54055 4.210591 105.2837 4.460522 -5.743172      6.133949 
1 1 1 3   26 3  o 202.9491 3.737223 502.7037       18.48299 482.4830       25.24850 526.0515       27.13067 198.5985 5.221561 207.3534 5.373774 -8.754944      7.492806 
1 1 1 3   26 4  o 208.2471 4.324524 529.6194       21.94590 541.3666       37.77147 523.6328       26.96419 209.9528 7.394088 206.8718 5.353219 3.081009       9.128498 
1 1 1 3   26 5  o 43.11037 4.126444 22.89986       4.282196 22.80593       7.413981 22.94688       5.245660 42.51052 7.426969 43.02814 5.101958 -0.5176239     9.010541 
1 1 1 3   26 6  o 113.4890 2.766696 157.0892       7.651586 158.2027       11.73814 156.2666       10.08988 113.7355 4.242570 113.0899 3.666069 0.6456680      5.607090 
1 1 1 3   26 7  o 334.0073 4.697028 1363.374       38.23095 1335.758       59.40870 1382.893       49.94732 329.8824 7.390176 336.0462 6.099260 -6.163788      9.582049 
1 1 1 3   26 8  o 213.4014 3.834350 556.0399       19.94000 584.0362       28.56744 529.4413       27.84526 218.4899 5.365423 207.9342 5.500103 10.55574       7.683677 
1 1 1 3   26 9  o 109.0257 3.021581 145.1396       8.020113 165.6418       11.45483 125.4247       11.23274 116.3841 4.045008 101.1995 4.566584 15.18460       6.100473 
1 1 1 3   26 10 o 111.2091 2.999450 151.0113       8.121222 149.8244       11.07726 152.3906       11.94167 110.6673 4.114661 111.5805 4.400412 -0.9132080     6.024455 
1 1 1 3   26 11 o 111.7492 3.653228 152.6515       9.935125 131.5636       16.76718 164.0613       12.33341 103.3225 6.695360 115.7748 4.379423 -12.45227      8.000449 
1 1 1 3   26 12 o 210.0764 4.486597 539.6027       22.96838 642.1072       44.06881 501.3734       26.91276 228.1857 7.937221 202.2553 5.465381 25.93040       9.636901 
1 1 1 3   26 13 o 246.5835 5.994437 745.7305       36.02039 760.8096       52.39654 732.2183       49.59952 248.0306 8.682235 243.4458 8.373094 4.584778       12.06192 
1 1 1 3   26 14 o 152.6395 4.680977 285.3557       17.39106 286.6462       25.73488 284.2711       23.59372 152.5147 6.942480 152.0125 6.383348 0.5021973      9.431074 
1 1 1 3   26 15 o 174.1533 4.110157 370.8335       17.44320 399.6820       31.98544 358.6221       20.81007 179.9836 7.307810 171.0481 4.997871 8.935486       8.853406 
1 1 1 3   26 16 o 120.0061 3.745844 176.1865       10.94100 191.8367       20.15774 169.6504       13.02684 124.6966 6.657762 117.6427 4.552590 7.053909       8.065474 
1 1 1 3   26 17 o 75.11297 3.933829 69.18072       7.175466 82.96744       13.58207 63.84297       8.451119 81.78664 6.878390 72.02792 4.842937 9.758720       8.412271 
1 1 1 3   26 18 o 68.85307 4.053215 58.20020       6.770702 68.00526       13.02815 54.57209       7.924973 73.86210 7.334914 66.54320 4.922019 7.318901       8.833302 
1 1 1 3   26 19 o 119.6118 2.791532 174.6935       8.136782 176.3427       14.17489 173.8830       9.937011 119.8196 4.864741 119.2216 3.423851 0.5980530      5.948820 
1 1 1 3   26 20 o 46.25459 3.422108 26.30118       3.829992 29.99680       7.792274 25.12399       4.397887 48.84963 6.724055 45.12082 4.042524 3.728809       7.845694 
1 1 1 3   26 21 o 101.6978 2.756880 126.4271       6.825976 128.2382       12.33004 125.6268       8.196623 102.0539 4.972883 101.3005 3.324879 0.7533569      5.982006 
1 1 1 3   26 22 o 118.5428 3.074752 171.9198       8.874720 227.0403       21.44409 160.5279       9.748761 135.3192 6.522179 114.4760 3.498719 20.84322       7.401341 
1 1 1 3   26 23 o 215.8561 3.874806 571.2148       20.38217 582.6200       42.58224 567.8251       23.21422 215.6366 8.117945 215.0126 4.430512 0.6239166      9.248268 
1 1 1 3   26 24 o 119.8747 3.176667 176.0457       9.271549 161.7273       13.76622 187.9325       12.54289 114.4467 4.947689 123.6182 4.169667 -9.171425      6.470375 
1 1 1 3   26 25 o 47.27354 3.773203 27.61233       4.310697 27.25664       7.337123 27.79983       5.327040 46.28948 6.698938 47.25879 4.687290 -0.9693146     8.175969 
1 1 1 3   26 26 o 45.01573 3.866550 25.10925       4.200494 22.27493       7.130597 26.61549       5.198153 41.48544 7.320861 46.18163 4.683655 -4.696190      8.690893 
1 1 1 3   26 27 o 62.06888 2.910306 47.35704       4.389729 54.57851       8.598313 44.81126       5.105180 65.96809 5.395739 60.25646 3.491689 5.711632       6.426966 
1 1 1 3   26 28 o 23.89484 5.643106 7.446546       3.233100 17.24778       7.900449 5.474963       3.543391 35.56619 9.084139 20.73907 6.385541 14.82712       11.10390 
1 1 1 3   26 29 o 70.15634 3.092506 60.76027       5.274062 46.27113       11.76634 64.40324       5.899947 58.74994 8.462347 72.14743 3.365032 -13.39750      9.106853 
1 1 1 3   26 30 o 56.07477 3.116932 38.97267       4.242469 38.77467       8.087886 39.04782       4.983038 54.61189 6.186133 55.94532 3.675415 -1.333431      7.195619 
1 1 1 3   26 31 o 45.12407 3.471739 25.48980       3.788280 21.81136       7.237272 26.87800       4.446013 39.69463 7.760049 46.14879 3.992669 -6.454163      8.726956 
1 1 1 3   26 32 o 29.83309 5.626163 11.91401       3.940266 18.18213       6.308114 7.903693       5.045691 35.97725 7.440829 23.84879 7.658762 12.12846       10.67813 
1 1 1 3   26 33 o 25.59761 6.108955 9.116883       3.757525 6.537386       5.958035 10.82041       4.841829 22.14766 8.249268 27.38888 7.171275 -5.241217      10.93058 
1 1 1 3   26 34 o 41.60455 5.254737 23.35232       5.208938 23.02490       10.10476 23.47081       6.078864 35.82801 10.73302 40.88847 6.303063 -5.060455      12.44694 
1 1 1 3   26 35 o 33.87366 5.235379 15.85087       4.182412 16.88166       6.534882 15.13570       5.443271 32.20809 8.280505 31.43482 7.253239 0.7732639      11.00801 
1 1 1 3   26 36 o 13.54188 5.782965 1.051659       3.375374 6.749526       5.119503 -3.329817      4.489334 20.67739 7.657119 12.08602 5.723472 8.591370       9.559791 
1 1 1 3   26 37 o 13.72134 6.164412 0.1198149      4.297568 -1.234024      5.086610 3.496699       8.033466 13.78758 6.385438 18.55104 8.372861 -4.763467      10.52989 
1 1 1 3   26 38 o 13.26028 6.236098 -1.782329      5.162584 -1.782329      5.162584 0.000000       0.000000 13.26028 6.236098 ?        ?        0.000000       6.236098 
1 1 1 3   26 39 o 14.87670 6.112761 2.977536       3.555592 -3.877574      5.427678 8.130752       4.705935 12.28112 5.940158 20.58753 7.383630 -8.306413      9.476469 
1 1 1 3   26 40 o 12.26567 5.543015 0.4746257      3.533884 -3.063272      5.393736 3.135569       4.677727 12.27271 5.932560 15.15478 6.637743 -2.882071      8.902522 
1 1 1 3   26 41 f 14.50556 6.082679 3.223527       3.623098 3.142089       5.684442 3.279247       4.701919 15.09551 6.902653 14.88736 6.582498 0.2081442      9.538128 
1 1 1 3   27 0  o 104.3570 3.675234 133.0972       9.331773 127.7993       14.65991 136.7062       12.09978 102.0059 5.923007 105.6623 4.711014 -3.656494      7.568069 
1 1 1 3   27 1  o 261.3029 6.207622 836.2744       39.52806 872.1700       56.44563 801.7312       55.37207 266.0450 8.718184 254.9952 8.924683 11.04977       12.47624 
1 1 1 3   27 2  o 195.5878 4.294393 467.2878       20.46820 435.9329       32.91996 487.0478       26.13370 188.3518 7.185396 199.4656 5.381382 -11.11380      8.977148 
1 1 1 3   27 3  o 173.2834 4.003948 366.6820       16.90758 352.5979       27.76387 374.9839       21.31600 169.4462 6.737189 175.0540 5.001992 -5.607895      8.391045 
1 1 1 3   27 4  o 181.9471 3.171571 403.9428       14.06228 404.6628       21.81428 403.4309       18.39434 181.8590 4.926860 181.7387 4.153372 0.1203613      6.443946 
1 1 1 3   27 5  o 62.07073 3.057602 47.12172       4.610683 42.69551       6.485369 51.64513       6.556190 58.93231 4.551146 64.88945 4.168158 -5.957138      6.171423 
1 1 1 3   27 6  o 144.4986 3.180282 254.7971       11.19864 240.5087       15.28940 271.3343       16.44861 140.2127 4.480481 148.9285 4.537560 -8.715714      6.376846 
1 1 1 3   27 7  o 159.8515 2.979184 311.7736       11.60513 293.2139       17.42999 326.5532       15.55403 154.8017 4.625650 163.5157 3.903438 -8.714035      6.052559 
1 1 1 3   27 8  o 97.73697 2.701487 116.6175       6.428078 115.4791       9.678345 117.5161       8.598509 97.13600 4.097901 98.03940 3.605177 -0.9033966     5.458031 
1 1 1 3   27 9  o 196.9385 3.634804 473.6254       17.44407 446.3564       32.30044 484.8535       20.72656 190.4943 6.969843 199.1750 4.270280 -8.680634      8.173984 
1 1 1 3   27 10 o 127.5551 3.093712 198.5791       9.616426 208.4124       13.43373 188.2444       13.77194 130.5118 4.229456 123.9855 4.565941 6.526283       6.223835 
1 1 1 3   27 11 f 161.0622 4.727058 317.6512       18.53321 315.0677       27.37391 319.8378       25.18281 159.9236 7.041320 161.2799 6.420316 -1.356323      9.528937 
1 1 1 3   27 12 o 182.6102 4.057336 407.6086       18.05519 402.9291       32.36247 409.7234       21.75574 180.7544 7.362521 182.8878 4.885873 -2.133423      8.836202 
1 1 1 3   27 13 o 24.62419 6.183672 7.735643       3.704926 8.535605       8.446593 7.545068       4.122686 27.99298 9.907781 24.39790 6.720519 3.595076       11.97203 
1 1 1 3   27 14 o 100.0588 3.080405 122.3540       7.502078 94.19271       14.84131 132.0193       8.694688 87.18058 7.045784 103.9020 3.438688 -16.72141      7.840131 
1 1 1 3   27 15 o 124.7528 3.114558 190.0519       9.468536 164.3103       19.21113 198.3114       10.88207 115.3060 6.868112 127.3487 3.509903 -12.04276      7.713001 
1 1 1 3   27 16 o 34.20947 4.705033 14.60073       3.818556 22.36457       9.455353 13.08771       4.174086 41.58457 9.534458 32.21247 5.515670 9.372101       11.01492 
1 1 1 3   27 17 o 97.32538 3.076239 115.8156       7.286795 108.0014       16.23847 117.7858       8.153841 93.24859 7.201830 98.11117 3.415628 -4.862579      7.970751 
1 1 1 3   27 18 o 100.9652 3.039791 124.6461       7.470618 126.5964       16.79337 124.1650       8.341443 101.0340 6.861493 100.7251 3.403232 0.3089218      7.659117 
1 1 1 3   27 19 o 83.31200 3.668492 85.08732       7.429595 64.38660       14.04227 93.13496       8.755461 71.51002 8.206678 87.10039 4.136812 -15.59037      9.190364 
1 1 1 3   27 20 o 83.59728 3.063257 85.53598       6.229837 80.63577       14.45421 86.65395       6.904018 80.26531 7.475718 84.10222 3.375527 -3.836906      8.202471 
1 1 1 3   27 21 o 63.81276 3.226510 49.93398       5.001094 55.34192       12.97079 48.98964       5.420181 66.09673 8.230688 63.16435 3.535431 2.932373       8.957873 
1 1 1 3   27 22 o 24.50978 5.469512 7.699273       3.183851 10.96195       7.001348 6.848661       3.574870 29.38159 8.962700 23.12434 6.212294 6.257248       10.90516 
1 1 1 3   27 23 o 90.02073 2.755368 99.19567       6.037354 102.6826       10.99135 97.68908       7.224852 91.12491 4.968485 89.23960 3.328103 1.885307       5.980144 
1 1 1 3   27 24 o 47.97712 3.765894 28.44050       4.367630 21.89820       7.678475 31.56973       5.310411 41.02571 7.967654 50.44881 4.362399 -9.423096      9.083724 
1 1 1 3   27 25 o 83.37429 3.194337 85.39990       6.478058 82.09008       10.20673 87.63255       8.382897 81.19485 5.185584 84.23735 4.095973 -3.042496      6.608122 
1 1 1 3   27 26 o 63.37567 3.073785 49.42641       4.732985 45.69019       8.047798 51.40195       5.851995 60.25537 5.542882 64.48175 3.740236 -4.226383      6.686771 
1 1 1 3   27 27 o 94.97010 2.993700 110.9697       6.919719 122.2064       16.19340 108.4595       7.653695 97.71971 6.843430 93.77271 3.354741 3.947006       7.621471 
1 1 1 3   27 28 o 15.36142 5.737549 2.345964       2.886160 7.968272       7.814730 1.457961       3.105732 25.87753 9.481441 14.51743 5.803717 11.36010       11.11669 
1 1 1 3   27 29 f 87.09370 2.793214 93.57399       5.920591 96.40538       10.91389 92.39328       7.047757 87.12631 5.163526 86.30643 3.357383 0.8198853      6.159060 
1 1 1 3   27 30 o 66.50639 2.928205 54.82415       4.734074 59.95104       8.955519 52.83590       5.576992 68.17599 5.435400 65.03621 3.532171 3.139786       6.482269 
1 1 1 3   27 31 o 53.55369 3.100792 35.79573       4.029368 40.55700       7.629667 33.95413       4.745063 55.49740 5.723527 51.85447 3.781069 3.642933       6.859683 
1 1 1 3   27 32 o 18.13037 5.727843 4.387397       2.831567 9.580757       5.451372 2.468513       3.313645 25.56466 7.928736 15.66582 6.075710 9.898837       9.988949 
1 1 1 3   27 33 o 43.66594 3.832819 24.53692       4.037134 25.03716       9.729243 24.43287       4.437167 38.30719 10.22964 43.30712 4.259525 -4.999931      11.08103 
1 1 1 3   27 34 o 20.79724 6.639104 6.373246       3.795812 3.956549       5.792957 8.191520       5.024800 18.80206 7.771768 22.96098 7.659160 -4.158913      10.91160 
1 1 1 3   27 35 o 23.44111 6.600632 8.439613       3.929780 9.502263       5.652807 7.445693       5.466947 23.73761 8.123119 21.51503 7.922374 2.222578       11.34677 
1 1 1 3   27 36 o 21.02021 6.469905 6.927878       3.638014 4.632059       5.404220 8.830488       4.919704 18.30649 7.530578 22.80232 7.577919 -4.495831      10.68337 
1 1 1 3   27 37 o 15.96378 7.083787 2.155379       5.493399 2.155379       5.493399 0.000000       0.000000 15.96378 7.083787 ?        ?        0.000000       7.083787 
1 1 1 3   27 38 o 20.12264 6.535574 6.954885       3.667713 13.43142       6.029967 3.151773       4.620757 25.42122 8.387378 15.72250 6.741366 9.698724       10.76077 
1 1 1 3   27 39 o 12.22872 5.529610 0.3449140      3.522989 -0.7649831     5.658872 1.047335       4.501810 13.58515 6.431180 13.67024 6.208973 -0.8508492E-01 8.939319 
1 1 1 3   27 40 o 8.955597 4.409065 -4.831977      3.396482 -9.487316      5.261769 -1.506652      4.447062 9.984702 5.006921 11.87078 5.643216 -1.886083      7.544212 
1 1 1 3   28 0  o 74.62212 3.181653 68.07708       5.772430 66.03052       7.816604 70.53199       8.560982 73.37673 4.391524 75.81582 4.656156 -2.439087      6.400412 
1 1 1 3   28 1  o 31.06021 5.162494 12.11570       3.770399 7.723847       5.005658 17.87494       5.732179 24.99223 7.569204 37.65648 6.480299 -12.66425      9.964293 
1 1 1 3   28 2  o 176.4278 3.508824 379.9924       15.08567 356.0536       20.30938 409.4576       22.53205 170.5564 4.891492 182.8817 5.060719 -12.32529      7.038293 
1 1 1 3   28 3  o 186.0677 3.624821 422.7206       16.43591 386.7802       21.63838 471.7356       25.26957 177.7457 5.000591 196.2587 5.288454 -18.51299      7.278300 
1 1 1 3   28 4  o 129.8011 3.659350 205.8968       11.56338 197.9780       13.55278 227.0878       22.17055 127.1966 4.378898 135.8598 6.717354 -8.663177      8.018578 
1 1 1 3   28 5  o 154.5971 3.329861 291.7519       12.54479 269.9693       16.65162 320.3410       19.07663 148.5177 4.606464 161.7558 4.845020 -13.23808      6.685337 
1 1 1 3   28 6  o 111.3409 2.783014 151.2487       7.551028 156.0523       11.49662 147.6042       10.01381 112.9240 4.185043 109.8689 3.745625 3.055115       5.616430 
1 1 1 3   28 7  o 81.70598 3.047894 81.58803       6.057980 76.07909       8.076825 88.67287       9.159505 78.78268 4.222439 85.04653 4.434886 -6.263855      6.123496 
1 1 1 3   28 8  o 52.55104 3.320765 33.85028       4.230863 42.76277       6.304018 26.54570       5.707102 58.97330 4.418706 46.28318 5.147025 12.69013       6.783571 
1 1 1 3   28 9  o 167.1308 3.353116 341.0725       13.65656 365.3828       19.77137 318.8916       18.88564 172.7436 4.701134 161.3526 4.808442 11.39098       6.724713 
1 1 1 3   28 10 o 56.83505 3.341565 39.58075       4.607674 33.55223       6.040307 47.97094       7.125900 52.13843 4.808189 62.43296 4.718638 -10.29453      6.736782 
1 1 1 3   28 11 o 60.88620 3.531585 45.43738       5.217432 52.04720       11.25637 43.62875       5.888138 64.60917 7.275722 59.59800 4.078835 5.011173       8.341044 
1 1 1 3   28 12 o 152.2576 3.340052 283.1501       12.39277 302.1987       26.30214 277.7147       14.05007 156.5272 6.912542 150.6836 3.829381 5.843552       7.902366 
1 1 1 3   28 13 o 43.03889 4.299553 22.88778       4.449129 28.49008       9.864805 21.45723       4.984914 47.19376 8.904025 41.54808 5.025463 5.645676       10.22433 
1 1 1 3   28 14 o 94.51128 3.144789 109.2157       7.232794 101.2824       14.90629 111.6586       8.271784 90.41960 6.815216 95.51728 3.559932 -5.097679      7.688971 
1 1 1 3   28 15 o 81.70132 3.148834 81.66053       6.257504 94.31917       13.93086 78.46087       7.003834 87.25304 6.600769 80.03223 3.600379 7.220802       7.518835 
1 1 1 3   28 16 o 114.8973 3.115948 161.4013       8.716359 179.8349       19.25915 156.6529       9.774745 120.5958 6.578347 113.1357 3.549830 7.460075       7.475021 
1 1 1 3   28 17 o 108.6610 3.110719 144.3986       8.228552 135.6270       17.59359 146.8545       9.309513 104.5312 6.946138 109.5294 3.492331 -4.998276      7.774652 
1 1 1 3   28 18 o 47.47425 3.772774 27.76009       4.328833 36.68340       10.71520 26.01969       4.732189 53.63819 8.479169 45.87874 4.282130 7.759445       9.499103 
1 1 1 3   28 19 o 30.50400 5.638222 11.81839       4.036822 0.000000       0.000000 11.81839       4.036822 ?        ?        30.50400 5.638222 0.000000       5.638222 
1 1 1 3   28 20 o 62.65924 5.136498 48.64934       7.774329 0.000000       0.000000 48.64934       7.774329 ?        ?        62.65924 5.136498 0.000000       5.136498 
1 1 1 3   28 21 o 65.54030 3.758942 52.83863       5.978397 47.64717       12.10895 54.51197       6.874704 61.07866 8.354137 66.48403 4.265776 -5.405369      9.380217 
1 1 1 3   28 22 o 119.1624 3.190375 174.0338       9.256061 168.4764       14.17788 178.1620       12.21946 116.7474 4.994967 120.3192 4.173874 -3.571716      6.509295 
1 1 1 3   28 23 o 38.64878 4.304066 18.61885       3.984996 15.28555       7.339334 20.01236       4.745422 34.01849 8.790586 39.93980 4.983806 -5.921314      10.10508 
1 1 1 3   28 24 o 25.97060 4.876523 8.614430       2.972924 10.98315       6.481748 7.983366       3.345585 28.99467 8.574351 24.84464 5.653543 4.150036       10.27045 
1 1 1 3   28 25 o 40.63876 3.986151 20.57911       3.896845 30.73175       9.776699 18.66151       4.248949 48.11841 8.655898 38.53102 4.616995 9.587391       9.810261 
1 1 1 3   28 26 o 75.80701 2.997446 70.76288       5.526369 68.68525       12.85279 71.23410       6.121087 72.81624 7.343457 75.97101 3.314292 -3.154770      8.056729 
1 1 1 3   28 27 o 50.85483 3.375868 32.08266       4.159951 21.17169       9.716226 34.53165       4.603192 38.60732 10.18289 52.70331 3.605864 -14.09599      10.80248 
1 1 1 3   28 28 o 52.55993 3.147270 34.27187       4.012648 25.41017       7.439686 37.90739       4.765179 43.53853 7.268089 55.15056 3.564723 -11.61203      8.095206 
1 1 1 3   28 29 o 16.45357 5.717667 3.231450       2.804490 4.480145       6.180720 2.907705       3.147116 21.03706 8.257599 16.32409 6.010904 4.712973       10.21366 
1 1 1 3   28 30 o 43.75256 3.432607 24.06333       3.630569 21.78423       6.902788 24.93490       4.268691 39.49450 7.445180 44.30515 3.996630 -4.810646      8.450075 
1 1 1 3   28 31 o 70.54247 2.863790 62.07906       4.912744 60.84188       8.836139 62.63260       5.910469 67.87436 5.386346 70.48774 3.451395 -2.613380      6.397253 
1 1 1 3   28 32 o 23.64548 5.669172 7.796032       3.224297 10.80580       8.692072 7.315803       3.472010 26.00746 9.903033 22.71121 6.131399 3.296249       11.64749 
1 1 1 3   28 33 o 20.90876 5.771467 6.257848       3.036949 6.977533       5.989524 6.008791       3.523467 21.66797 8.227675 20.33569 6.384715 1.332285       10.41438 
1 1 1 3   28 34 o 26.94825 4.994815 10.12193       3.159337 9.616362       5.639454 10.35318       3.814041 23.96377 8.115026 26.51782 6.037921 -2.554058      10.11485 
1 1 1 3   28 35 o 21.40522 5.741000 6.843135       3.056107 9.074673       5.481989 5.836874       3.681216 22.87553 7.991120 19.45294 6.556500 3.422586       10.33662 
1 1 1 3   28 36 o 20.65916 6.512079 6.927116       3.661935 14.51243       5.801455 1.903326       4.721348 28.26900 8.040436 15.29091 6.683672 12.97809       10.45562 
1 1 1 3   28 37 o 14.00251 6.252085 1.088563       4.347556 -1.781293      5.113592 8.572966       8.257995 13.04584 6.157091 20.08479 8.807625 -7.038946      10.74635 
1 1 1 3   28 38 o 10.66494 5.012665 -1.588897      3.327211 -0.5535862     5.331031 -2.249504      4.258408 13.51998 6.351572 11.56348 5.504248 1.956506       8.404714 
1 1 1 3   28 39 o 14.81371 6.112014 3.333028       3.574035 5.181086       5.779445 2.188648       4.547928 16.70750 7.346080 14.27164 6.381825 2.435867       9.731011 
1 1 1 3   29 0  o 206.1893 3.443620 519.0873       17.30284 520.8760       26.74211 517.7993       22.69321 206.1788 5.326959 205.7782 4.525436 0.4006042      6.989712 
1 1 1 3   29 1  o 126.8325 3.185414 196.4792       9.837589 179.0489       13.03959 219.5074       14.98789 120.9325 4.432209 133.8933 4.600355 -12.96078      6.388094 
1 1 1 3   29 2  o 245.3143 4.228691 735.5887       25.27929 705.2761       34.45749 770.9195       37.20051 239.8470 5.895401 250.7090 6.088957 -10.86201      8.475326 
1 1 1 3   29 3  o 84.72030 2.939356 87.69602       6.059229 103.8054       9.343104 76.00265       7.960163 92.06209 4.175479 78.74651 4.162940 13.31557       5.896159 
1 1 1 3   29 4  o 168.7972 3.103440 347.7824       12.76570 354.9447       19.80953 342.6955       16.69439 170.2533 4.779391 167.4486 4.091221 2.804672       6.291317 
1 1 1 3   29 5  o 227.0085 4.021351 629.8123       22.24591 585.9485       41.39832 647.6207       26.37799 217.9113 7.808534 230.0668 4.704915 -12.15547      9.116437 
1 1 1 3   29 6  o 166.8166 3.452803 339.8473       14.03612 362.1000       19.84334 317.5644       19.85682 171.9523 4.740074 160.9630 5.068613 10.98932       6.939678 
1 1 1 3   29 7  f 220.3414 4.507241 593.9598       24.20154 582.1961       29.18754 619.8432       43.29502 217.8647 5.502019 224.0045 7.943889 -6.139786      9.663207 
1 1 1 3   29 8  o 125.4439 3.576279 192.3973       10.92129 194.4989       13.20668 187.8515       19.42345 126.0308 4.306450 123.4679 6.478257 2.562874       7.779031 
1 1 1 3   29 9  o 132.3070 3.184994 213.7531       10.26899 214.4422       14.02364 212.9564       15.07879 132.3251 4.354864 131.8096 4.701965 0.5154114      6.408847 
1 1 1 3   29 10 o 162.9677 3.924115 324.7054       15.58401 323.3916       18.47558 327.9453       29.01289 162.4562 4.671720 162.9326 7.325869 -0.4763489     8.688689 
1 1 1 3   29 11 o 409.0610 6.291597 2057.467       62.71696 2031.606       124.9550 2066.176       72.51219 400.6287 12.81547 409.3051 7.269889 -8.676422      14.73389 
1 1 1 3   29 12 o 138.7080 3.297754 235.0513       11.14695 226.3053       22.65703 237.8443       12.80371 135.3305 6.892929 139.4223 3.771957 -4.091721      7.857489 
1 1 1 3   29 13 o 54.65309 3.800076 36.70413       5.029556 30.91174       10.53457 38.41428       5.724070 49.09962 9.140737 55.86204 4.236450 -6.762424      10.07475 
1 1 1 3   29 14 o 113.9909 3.194957 158.8923       8.866305 150.0689       18.09843 161.6786       10.17032 110.0845 6.779386 114.9264 3.636015 -4.841858      7.692898 
1 1 1 3   29 15 o 138.8104 3.257946 235.5110       11.02051 226.0125       22.70175 238.4395       12.60545 135.0729 6.919982 139.5574 3.709838 -4.484497      7.851691 
1 1 1 3   29 16 f 120.5423 3.186397 177.7407       9.351781 160.5957       18.93855 183.2693       10.75439 113.7581 6.863621 122.3363 3.611355 -8.578186      7.755719 
1 1 1 3   29 17 o 100.8061 3.690942 124.5558       9.051615 104.6015       16.26381 133.5101       10.89487 91.53648 7.352886 104.2632 4.297211 -12.72672      8.516511 
1 1 1 3   29 18 o 57.09735 4.907850 40.36886       6.762591 0.000000       0.000000 40.36886       6.762591 ?        ?        57.09735 4.907850 0.000000       4.907850 
1 1 1 3   29 19 o 53.47725 6.560378 35.97750       8.370478 51.48759       11.92832 20.93022       11.74901 63.74025 7.844727 39.82631 11.47907 23.91393       13.90355 
1 1 1 3   29 20 o 89.51520 3.593170 98.38689       7.822170 91.22237       15.25843 100.9410       9.110375 85.12038 7.430380 90.55901 4.139219 -5.438622      8.505509 
1 1 1 3   29 21 o 106.7219 3.568499 139.8866       9.267531 131.0625       17.43702 143.3605       10.94073 102.1231 7.049941 107.8848 4.169346 -5.761696      8.190550 
1 1 1 3   29 22 o 95.33100 3.027954 111.4828       7.025357 109.1851       15.84858 112.0447       7.837448 92.97611 7.047407 95.49391 3.373227 -2.517799      7.813105 
1 1 1 3   29 23 o 24.55406 5.439357 7.789651       3.168892 1.568339       8.160715 8.894297       3.438734 21.64127 9.105239 26.24786 5.549871 -4.606594      10.66332 
1 1 1 3   29 24 o 20.77951 5.878232 5.570796       3.109277 9.465518       8.461719 4.962840       3.343156 27.93922 9.913951 19.87564 6.216158 8.063576       11.70158 
1 1 1 3   29 25 o 12.14674 5.175337 0.8910342E-01  2.692388 -7.009799      7.749786 1.063528       2.871232 16.32218 7.664888 13.65162 5.536889 2.670567       9.455562 
1 1 1 3   29 26 o 45.23819 3.502941 25.46632       3.831595 33.15852       9.649028 24.02630       4.174866 49.56079 8.281292 43.80744 3.953228 5.753353       9.176481 
1 1 1 3   29 27 o 15.89786 5.691982 2.837396       2.795337 5.068953       5.739943 2.143601       3.200510 21.43871 8.073751 15.44211 5.975965 5.996610       10.04478 
1 1 1 3   29 28 f 10.66700 4.833441 -1.325814      2.708465 -3.990638      5.939979 -0.6263413     3.043239 14.80139 6.870627 12.02526 5.307285 2.776133       8.681750 
1 1 1 3   29 29 o 35.68772 3.730189 16.15636       3.196183 14.89433       5.914369 16.67697       3.798640 32.37781 7.623038 35.98371 4.425052 -3.605904      8.814295 
1 1 1 3   29 30 o 43.25134 3.500977 23.69389       3.658472 28.01397       7.226972 22.20536       4.242191 44.86101 6.825684 41.48985 4.256043 3.371155       8.043871 
1 1 1 3   29 31 o 19.67806 5.908193 5.393810       3.059339 6.619475       8.165360 5.193654       3.299699 22.69731 9.287713 19.35744 6.191181 3.339878       11.16209 
1 1 1 3   29 32 o 29.59460 4.745395 11.84801       3.306704 9.135644       5.905934 13.08655       3.990888 23.93279 8.298370 30.60010 5.556524 -6.667313      9.986887 
1 1 1 3   29 33 o 11.52166 5.063659 -0.4121441E-01 2.743197 4.495002       5.285819 -1.713320      3.209204 18.65104 7.531315 10.99411 5.084772 7.656935       9.087112 
1 1 1 3   29 34 o 20.18513 5.688308 6.050181       2.917326 7.091182       5.148736 5.557938       3.540504 20.83560 7.685538 19.12090 6.429906 1.714705       10.02054 
1 1 1 3   29 35 f 11.32711 5.101353 -0.3992431     2.963641 1.043816       5.197291 -1.094556      3.607657 15.14119 6.792527 11.82585 5.441312 3.315343       8.703235 
1 1 1 3   29 36 o 25.04599 5.888403 9.865005       3.533029 12.58260       5.707407 8.176697       4.498548 25.33060 8.146537 21.29805 7.247401 4.032557       10.90371 
1 1 1 3   29 37 o 23.17374 5.674069 8.597739       3.178141 17.72630       6.298178 5.479213       3.681192 29.28950 8.392858 17.79063 6.509225 11.49887       10.62121 
1 1 1 3   29 38 o 18.47772 5.849320 5.810722       2.951610 9.160645       5.395730 4.380242       3.525932 20.36639 7.790893 16.09392 6.260176 4.272472       9.994390 
1 1 1 3   30 0  o 205.3860 3.894052 515.5308       19.48986 564.0314       39.22116 499.6274       22.45905 213.8211 7.539003 202.0805 4.560694 11.74060       8.811157 
1 1 1 3   30 1  o 85.21482 3.004987 88.74744       6.230364 80.69010       8.663639 97.37753       8.966284 81.10337 4.400021 89.15022 4.138477 -8.046844      6.040462 
1 1 1 3   30 2  o 174.4218 3.537901 371.6237       15.03774 394.6548       21.43185 349.2896       21.10505 179.4710 4.904975 168.7869 5.137091 10.68405       7.102710 
1 1 1 3   30 3  o 184.4214 3.263380 415.3119       14.66611 405.8699       22.27910 422.5326       19.48301 181.9727 5.028888 185.8686 4.301439 -3.895920      6.617560 
1 1 1 3   30 4  o 133.1480 3.212621 216.4749       10.42390 224.3004       14.50600 208.1194       14.98911 135.3350 4.404332 130.3059 4.728208 5.029160       6.461740 
1 1 1 3   30 5  o 35.23454 4.749386 15.46946       3.974201 16.21810       5.064193 14.26925       6.412139 35.87299 6.005109 33.33934 7.995613 2.533649       9.999557 
1 1 1 3   30 6  o 210.5824 3.455657 541.7216       17.73327 571.3943       28.25303 522.4330       22.77910 215.8777 5.370581 206.6085 4.524309 9.269180       7.022287 
1 1 1 3   30 7  o 102.1480 2.802751 127.4533       6.970110 118.7115       10.17850 135.1724       9.564569 98.41657 4.254086 105.0974 3.740506 -6.680840      5.664683 
1 1 1 3   30 8  o 177.9729 3.159676 386.8264       13.70353 382.1181       21.06561 390.2805       18.04302 176.5336 4.901525 178.6172 4.145240 -2.083664      6.419343 
1 1 1 3   30 9  o 176.3822 3.481880 380.1769       14.96596 387.7462       21.12269 372.5466       21.20769 177.8136 4.879315 174.2629 4.999210 3.550674       6.985686 
1 1 1 3   30 10 o 194.7398 3.304639 463.3460       15.68248 445.9379       23.82854 476.6479       20.82953 190.6104 5.134646 197.3215 4.331805 -6.711105      6.717822 
1 1 1 3   30 11 o 30.22624 5.949342 11.61926       4.226074 3.507181       7.332176 15.65477       5.171494 22.57084 8.952083 35.14956 6.267427 -12.57873      10.92797 
1 1 1 3   30 12 o 90.54736 3.840266 100.4889       8.454460 96.48946       14.91726 102.3815       10.26170 88.11919 7.004356 91.27713 4.628509 -3.157936      8.395481 
1 1 1 3   30 13 o 78.88949 3.888688 76.35682       7.452773 82.02703       13.32511 73.77561       8.990474 81.21707 6.794888 77.40227 4.789893 3.814804       8.313458 
1 1 1 3   30 14 o 159.1740 3.995672 310.4656       15.48655 316.5948       27.99554 307.7631       18.58990 159.7270 7.211005 158.2742 4.825456 1.452820       8.676613 
1 1 1 3   30 15 o 107.6129 3.705820 141.9232       9.703673 135.3104       17.34887 144.9339       11.70601 104.3392 6.861268 108.6154 4.431948 -4.276161      8.168180 
1 1 1 3   30 16 o 110.0741 4.424239 148.9347       11.84334 0.000000       0.000000 148.9347       11.84334 ?        ?        110.0741 4.424239 0.000000       4.424239 
1 1 1 3   30 17 o 36.63861 4.844218 16.79181       4.219254 17.48596       9.257412 16.60981       4.740217 36.54078 10.07273 36.29578 5.534075 0.2449989      11.49286 
1 1 1 3   30 18 o 32.19933 5.201426 13.10075       3.942296 18.31355       9.535158 12.02595       4.329683 37.27626 10.20181 30.65664 6.010487 6.619612       11.84073 
1 1 1 3   30 19 o 51.76652 3.726522 33.05063       4.669526 33.39077       11.24059 32.97969       5.133426 50.47210 9.487260 51.64287 4.113026 -1.170769      10.34046 
1 1 1 3   30 20 o 37.66848 4.412312 17.71636       3.973569 26.47549       10.19976 16.14915       4.314431 44.63615 9.658076 35.79393 5.089541 8.842220       10.91704 
1 1 1 3   30 21 o 19.53905 5.993891 4.782280       3.125622 1.451228       7.606374 5.459022       3.428454 20.98151 8.806813 20.77703 6.258134 0.2044811      10.80390 
1 1 1 3   30 22 o 38.32725 4.369348 18.39641       4.008142 11.34008       8.945876 20.16869       4.483321 29.96582 10.21972 40.07710 4.678483 -10.11127      11.23970 
1 1 1 3   30 23 o 54.20005 3.342530 36.30361       4.393322 34.07326       10.17052 36.81525       4.871242 50.60827 8.551135 54.49915 3.689620 -3.890873      9.313174 
1 1 1 3   30 24 f 36.30417 3.811374 16.48772       3.321676 15.09573       6.780752 16.92723       3.810152 33.30660 8.366445 36.64895 4.351048 -3.342346      9.430219 
1 1 1 3   30 25 o 37.15331 3.753725 17.29813       3.352006 7.803914       6.506330 20.72865       3.910983 24.88024 8.704758 40.63097 4.001846 -15.75074      9.580584 
1 1 1 3   30 26 o 33.93455 3.959461 14.55920       3.212815 13.98276       6.420040 14.75180       3.710916 31.62492 8.246635 33.95088 4.603845 -2.325958      9.444701 
1 1 1 3   30 27 o 12.93045 5.311218 0.8989672      2.683069 -3.107238      5.559330 2.115476       3.063468 14.68388 6.755728 15.11014 5.846860 -0.4262552     8.934520 
1 1 1 3   30 28 o 17.19073 5.714086 3.767743       2.797228 0.3934438      5.404642 5.002316       3.269139 16.55913 7.195724 19.40408 6.157552 -2.844954      9.470686 
1 1 1 3   30 29 o 14.38181 5.644592 1.907945       2.887713 8.941220       8.569246 1.006933       3.067109 25.16320 9.767323 13.55670 5.633880 11.60650       11.27569 
1 1 1 3   30 30 o 14.32394 5.478861 2.169967       2.668250 2.751236       5.215184 1.963858       3.105487 17.73879 7.356956 14.60838 5.815622 3.130410       9.377967 
1 1 1 3   30 31 o 12.68284 5.271536 1.010269       2.685863 5.900918       5.387979 -0.6068806     3.098259 20.44933 7.794402 11.76734 5.264305 8.681983       9.405616 
1 1 1 3   30 32 o 16.21313 5.829972 3.504206       2.936001 5.574265       5.361974 2.617792       3.508745 19.73006 7.706923 15.48429 6.175953 4.245770       9.876187 
1 1 1 3   30 33 o 12.09585 5.205715 0.5681421      2.774744 2.596938       5.030610 -0.3189693     3.326523 16.53198 7.059895 12.16255 5.446932 4.369430       8.916904 
1 1 1 3   30 34 o 14.15184 5.732518 2.195899       3.073246 8.459140       5.479924 -0.6778491     3.711926 21.69622 7.941277 12.29402 5.604903 9.402205       9.720021 
1 1 1 3   30 35 o 9.752496 4.639511 -2.540767      3.016584 -1.609104      5.113818 -3.037966      3.735780 13.22899 6.216742 10.69456 5.108588 2.534435       8.046462 
1 1 1 3   30 36 o 17.12660 6.004658 4.799965       3.097020 12.76261       5.855788 1.707739       3.649154 24.53845 8.269304 13.66730 5.926073 10.87115       10.17348 
1 1 1 3   30 37 o 12.35427 5.319546 1.312611       2.900149 0.9937846      5.314380 1.447828       3.460924 14.17062 6.550177 13.04155 5.710903 1.129068       8.690180 
1 1 1 3   31 0  o 192.8521 3.759687 454.5968       17.66901 478.7346       24.93840 430.2670       25.03740 197.5586 5.184562 187.2068 5.494164 10.35175       7.554172 
1 1 1 3   31 1  o 50.04600 4.130909 30.84046       4.993094 31.30043       6.403029 30.12676       7.975852 50.25070 5.309034 49.00499 6.867050 1.245712       8.679990 
1 1 1 3   31 2  o 121.0045 4.550604 179.4984       13.39467 182.7613       18.86083 176.1780       19.02611 121.7462 6.379512 119.4867 6.559386 2.259407       9.150066 
1 1 1 3   31 3  o 96.81820 2.925990 114.5447       6.895524 115.2005       10.24534 114.0016       9.323240 96.92686 4.348638 96.47065 3.974354 0.4562149      5.891192 
1 1 1 3   31 4  o 185.2552 3.270332 419.2209       14.76381 392.5090       22.00333 441.0952       19.91141 178.8736 5.052907 189.8519 4.303790 -10.97826      6.637355 
1 1 1 3   31 5  o 144.5680 2.981818 255.2004       10.50484 264.9195       16.18418 248.1246       13.80909 147.0222 4.522602 142.3751 3.984025 4.647095       6.027138 
1 1 1 3   31 6  o 56.52844 3.429435 39.19070       4.701948 42.85360       6.668044 35.56813       6.631224 58.96292 4.679040 53.61333 5.138390 5.349594       6.949566 
1 1 1 3   31 7  o 86.34048 2.943648 91.13815       6.184447 98.61135       9.337399 85.29767       8.254608 89.65021 4.286457 83.39358 4.074217 6.256630       5.913794 
1 1 1 3   31 8  o 92.95973 2.853133 105.6193       6.455628 108.3679       9.651481 103.3940       8.684210 93.99083 4.224582 91.85178 3.888574 2.139053       5.741786 
1 1 1 3   31 9  f 134.4128 2.899656 220.6501       9.497807 235.2980       14.83670 210.4796       12.36300 138.5230 4.400789 131.1018 3.873964 7.421234       5.862981 
1 1 1 3   31 10 o 224.4344 3.981116 616.6038       21.77361 640.4199       31.25750 594.1539       30.34771 228.2020 5.620808 219.7149 5.672751 8.487122       7.985837 
1 1 1 3   31 11 f 94.24232 3.680596 108.8315       8.436542 111.5061       15.55324 107.7165       10.04229 94.76468 6.779801 93.64197 4.413162 1.122711       8.089605 
1 1 1 3   31 12 f 44.99948 4.516829 25.07956       4.886196 25.11637       9.460650 25.06617       5.706160 44.05080 9.113927 44.84634 5.325167 -0.7955399     10.55562 
1 1 1 3   31 13 o 36.28643 5.190147 16.50969       4.458879 15.06841       9.146414 16.95900       5.106817 34.27775 10.19776 36.63950 5.921461 -2.361752      11.79228 
1 1 1 3   31 14 o 17.01613 6.846758 1.696383       4.351655 0.000000       0.000000 1.696383       4.351655 ?        ?        17.01613 6.846758 0.000000       6.846758 
1 1 1 3   31 15 o 82.22260 3.705118 83.00426       7.404781 0.000000       0.000000 83.00426       7.404781 ?        ?        82.22260 3.705118 0.000000       3.705118 
1 1 1 3   31 16 o 125.7127 3.889138 194.0572       11.89997 195.1329       20.91805 193.5425       14.46951 125.0370 6.891747 125.3094 4.747011 -0.2723389     8.368410 
1 1 1 3   31 17 o 16.52060 6.638022 1.660537       4.084217 4.254801       7.380869 0.5156004      4.903329 23.01934 9.027330 16.71906 7.047404 6.300278       11.45245 
1 1 1 3   31 18 o 35.05966 4.845837 15.45123       4.029534 9.673205       9.417618 16.74609       4.458241 29.09716 10.44405 36.45332 5.163000 -7.356161      11.65053 
1 1 1 3   31 19 o 43.99982 4.036267 24.03144       4.279625 31.32697       10.27434 22.49993       4.707439 48.78493 8.972906 42.43787 4.626767 6.347057       10.09554 
1 1 1 3   31 20 o 98.39207 3.094847 118.9246       7.411309 117.2525       16.05992 119.3770       8.354052 96.16598 6.898920 98.47168 3.486869 -2.305702      7.730029 
1 1 1 3   31 21 o 42.04910 4.159137 22.07267       4.206062 29.05476       9.734255 20.46986       4.663914 46.60162 8.896074 40.30407 4.845675 6.297558       10.13019 
1 1 1 3   31 22 o 71.66311 3.154785 63.32450       5.495863 74.61270       13.38696 61.03632       6.027202 75.91935 7.326834 70.24828 3.532154 5.671066       8.133794 
1 1 1 3   31 23 o 16.66773 5.854238 3.175947       2.944681 17.01089       7.921762 0.9577931      3.171969 34.99276 9.177958 14.03733 5.771340 20.95543       10.84174 
1 1 1 3   31 24 o 33.32201 4.337981 14.10258       3.438990 23.80300       8.801765 12.35493       3.735957 41.25051 9.008881 30.90154 5.141792 10.34897       10.37294 
1 1 1 3   31 25 o 15.38150 5.644266 2.544537       2.771008 9.487191       6.269506 0.8590455      3.089113 26.30851 8.544827 13.66752 5.664726 12.64100       10.25198 
1 1 1 3   31 26 f 15.44055 5.640026 2.639772       2.761990 6.760449       5.836973 1.450931       3.135200 22.91709 8.222707 14.36075 5.799768 8.556343       10.06232 
1 1 1 3   31 27 f 42.75571 3.455535 23.04905       3.569706 19.06148       6.698860 24.63043       4.218567 36.48754 7.772107 43.97090 3.980039 -7.483360      8.731916 
1 1 1 3   31 28 o 32.57460 4.646810 13.94730       3.584232 11.30268       8.781297 14.47597       3.926173 26.99394 10.02239 32.99130 5.043450 -5.997358      11.21984 
1 1 1 3   31 29 f 22.58664 5.619338 7.136114       3.080332 12.13470       6.227067 5.516715       3.544352 27.72412 8.451700 19.82612 6.423603 7.897991       10.61574 
1 1 1 3   31 30 o 13.36122 5.550214 1.213446       2.974842 -1.143440      5.293263 2.301544       3.596567 14.68009 6.692886 15.38671 6.212669 -0.7066250     9.131921 
1 1 1 3   31 31 o 33.12938 4.113075 14.59806       3.249311 13.37049       5.891389 15.13472       3.895349 28.35624 8.114699 33.12727 4.979197 -4.771030      9.520543 
1 1 1 3   31 32 o 35.65131 4.030929 16.99587       3.440651 21.55228       6.296801 15.05643       4.108161 36.88715 7.263627 32.46700 5.380706 4.420155       9.039484 
1 1 1 3   31 33 o 14.57145 5.856746 2.454360       3.180488 9.844159       5.791633 -0.7363997     3.805676 23.05110 8.199678 12.39579 5.660464 10.65531       9.963713 
1 1 1 3   31 34 o 24.03293 6.406183 9.450342       3.819856 15.13990       6.259088 6.073547       4.821965 27.66930 8.480837 18.82028 7.320801 8.849022       11.20351 
1 1 1 3   31 35 o 13.83854 5.921472 1.943648       3.551791 3.855395       5.849018 0.8268971      4.470395 16.60963 7.342943 13.75209 6.222661 2.857535       9.624985 
1 1 1 3   31 36 o 10.98817 4.961017 -0.5052410E-01 2.822953 2.651368       5.359894 -1.087720      3.320875 15.25192 6.865430 10.93547 5.096733 4.316452       8.550487 
1 1 1 3   32 0  f 64.32328 3.362943 50.69738       5.253065 50.17229       7.606263 51.17621       7.263495 63.78229 4.931962 64.46278 4.655172 -0.6804924     6.781952 
1 1 1 3   32 1  o 59.17077 3.383599 42.92577       4.858563 40.37046       6.886580 45.45815       6.855615 57.16216 4.993872 60.73222 4.668030 -3.570065      6.835880 
1 1 1 3   32 2  o 68.31643 3.438772 57.18683       5.706449 52.60322       7.514145 63.43228       8.771163 65.34203 4.751478 71.73788 5.049587 -6.395859      6.933604 
1 1 1 3   32 3  o 98.81281 3.352332 119.4633       8.060594 105.7275       14.35905 125.7835       9.740053 92.42792 6.414895 101.3153 3.952614 -8.887337      7.534855 
1 1 1 3   32 4  o 37.33464 4.441938 17.31232       3.962152 21.48289       5.717624 13.45933       5.495626 41.40341 5.827935 32.39200 7.153470 9.011410       9.226970 
1 1 1 3   32 5  o 56.45313 3.426897 39.10211       4.692181 39.81018       6.703273 38.42187       6.570220 56.76225 4.893827 55.75787 4.884747 1.004375       6.914499 
1 1 1 3   32 6  o 96.93004 2.912087 114.8635       6.870780 119.1694       10.29417 111.4042       9.226732 98.53957 4.297244 95.31825 3.981006 3.221313       5.857877 
1 1 1 3   32 7  o 83.38593 3.009908 85.06037       6.106172 85.45553       9.093095 84.73584       8.240573 83.37660 4.491981 83.08759 4.082412 0.2890167      6.069924 
1 1 1 3   32 8  o 264.2914 4.008193 855.3116       25.81473 863.2153       40.48806 849.8978       33.50922 264.5599 6.280104 262.9979 5.228487 1.562012       8.171706 
1 1 1 3   32 9  o 206.7917 3.443379 523.0317       17.35217 510.4724       26.51307 532.4421       22.95010 203.6797 5.346281 208.3572 4.520016 -4.677460      7.000947 
1 1 1 3   32 10 o 73.65662 2.948636 66.40450       5.281902 64.63663       7.678471 67.99239       7.277152 72.47115 4.368116 74.38921 4.029392 -1.918060      5.942764 
1 1 1 3   32 11 o 65.25282 3.652127 52.29444       5.784220 48.89604       11.33794 53.49014       6.725238 62.25356 7.633219 65.91227 4.209015 -3.658714      8.716756 
1 1 1 3   32 12 o 107.8692 4.519187 143.1591       11.85307 0.000000       0.000000 143.1591       11.85307 ?        ?        107.8692 4.519187 0.000000       4.519187 
1 1 1 3   32 13 o 106.2311 3.774922 138.5031       9.756741 0.000000       0.000000 138.5031       9.756741 ?        ?        106.2311 3.774922 0.000000       3.774922 
1 1 1 3   32 14 o 40.76842 4.918055 20.76299       4.787399 23.03828       10.20246 20.12054       5.421308 41.71216 10.13762 39.94783 5.733039 1.764328       11.64641 
1 1 1 3   32 15 o 20.30795 6.943006 4.765123       4.129441 2.858649       8.578955 5.340047       4.711118 23.20232 9.510122 21.53547 7.414153 1.666849       12.05869 
1 1 1 3   32 16 o 97.71028 3.673416 117.3825       8.731170 113.4890       15.77341 119.1024       10.48380 95.02093 6.858073 98.23660 4.390441 -3.215668      8.143043 
1 1 1 3   32 17 o 89.44564 3.222566 98.25487       7.012723 101.2839       15.08549 97.41985       7.920568 89.54624 6.967958 88.96262 3.661355 0.5836258      7.871338 
1 1 1 3   32 18 o 32.64305 4.991120 13.50577       3.844388 11.91824       8.832447 13.87683       4.270090 30.56098 10.15354 32.96756 5.509408 -2.406578      11.55197 
1 1 1 3   32 19 o 30.09290 5.782144 11.69700       4.086181 9.125271       8.379972 12.49921       4.680298 27.64787 9.860169 30.96765 6.413183 -3.319784      11.76231 
1 1 1 3   32 20 o 59.22123 3.457633 43.36674       4.968201 64.41095       11.79025 38.82334       5.478325 70.80042 6.921952 55.86731 4.051493 14.93311       8.020475 
1 1 1 3   32 21 o 86.80942 3.091126 92.91654       6.528688 88.35826       13.94800 94.19542       7.387987 82.67972 6.988099 87.26807 3.481023 -4.588356      7.807115 
1 1 1 3   32 22 o 25.97787 5.450065 8.834545       3.339914 7.755547       7.542368 9.097734       3.725044 25.39225 9.312933 26.23564 5.962257 -0.8433895     11.05799 
1 1 1 3   32 23 o 27.64544 5.320529 10.00500       3.454299 10.36166       8.770227 9.939514       3.758073 27.98511 10.07447 27.39602 5.809538 0.5890846      11.62951 
1 1 1 3   32 24 o 15.67666 5.758031 2.669121       2.884930 4.032085       7.066045 2.396476       3.160333 21.41532 8.685903 15.64083 5.967573 5.774495       10.53835 
1 1 1 3   32 25 o 18.76913 5.923382 4.623593       3.028934 2.204017       7.596704 5.080954       3.302823 20.31399 8.675318 19.59881 6.185420 0.7151775      10.65460 
1 1 1 3   32 26 o 40.73795 3.837106 21.13915       3.764382 25.58148       9.696770 20.35086       4.084744 40.39801 9.922977 39.75550 4.283840 0.6425095      10.80818 
1 1 1 3   32 27 o 18.25924 5.868726 4.487646       2.962283 -0.2889918     8.272685 5.190194       3.172659 18.83860 8.500182 19.44739 6.051496 -0.6087894     10.43426 
1 1 1 3   32 28 o 42.28813 3.556631 22.91219       3.631228 22.89594       6.913665 22.91838       4.267196 39.23030 7.505231 41.87091 4.240498 -2.640610      8.620343 
1 1 1 3   32 29 o 13.11917 5.424763 1.214786       2.823841 5.196896       5.339695 -0.3312865     3.327168 19.64415 7.685781 12.38468 5.503280 7.259464       9.452901 
1 1 1 3   32 30 o 28.93515 4.731636 11.47676       3.221156 12.52203       6.202116 11.09067       3.769404 27.01494 8.469281 27.71329 5.769302 -0.6983490     10.24761 
1 1 1 3   32 31 o 29.33147 5.088595 12.15424       3.505395 20.94093       6.394776 8.379807       4.191202 36.00133 7.531442 22.90189 6.923975 13.09945       10.23054 
1 1 1 3   32 32 o 35.67477 4.083306 17.27766       3.485960 30.74569       6.759939 12.39875       4.068667 44.71078 6.385499 28.48348 6.048753 16.22729       8.795568 
1 1 1 3   32 33 o 20.86596 6.779967 7.421070       3.946905 11.81830       6.197125 4.420133       5.119519 24.06103 8.489226 17.29756 7.240431 6.763466       11.15754 
1 1 1 3   32 34 o 19.94849 6.577568 6.926123       3.708658 6.059873       5.832792 7.513991       4.805018 18.24713 7.688663 19.88835 7.408094 -1.641214      10.67686 
1 1 1 3   32 35 o 13.50423 5.585953 2.225008       2.995587 -0.5031552     5.530180 3.357911       3.563694 13.65117 6.430576 15.08816 6.150310 -1.436987      8.898237 
1 1 1 3   33 0  o 86.14640 3.060891 90.79202       6.415498 88.11140       9.302905 93.22298       8.859123 84.65842 4.525781 87.14145 4.184086 -2.483025      6.163544 
1 1 1 3   33 1  f 108.8747 3.376050 145.0679       8.946370 160.3796       17.35115 139.5232       10.44130 113.8836 6.276441 106.6726 4.023878 7.211021       7.455555 
1 1 1 3   33 2  o 116.1511 3.102228 164.9829       8.772923 166.7369       18.18888 164.4512       10.01483 116.0686 6.456091 115.8983 3.550117 0.1702805      7.367798 
1 1 1 3   33 3  o 96.25603 2.984950 113.3133       6.993198 115.2715       10.34651 111.6663       9.488816 96.87615 4.394130 95.39716 4.091204 1.478989       6.003859 
1 1 1 3   33 4  o 149.4607 3.437977 273.2088       12.52178 277.6698       23.64164 271.4694       14.76248 149.8214 6.490814 148.8163 4.074566 1.005127       7.663730 
1 1 1 3   33 5  o 97.85730 2.975668 117.1243       7.087758 104.3363       10.16386 129.2300       9.888999 92.11672 4.541770 102.6476 3.960801 -10.53091      6.026245 
1 1 1 3   33 6  o 131.4974 2.952780 211.3164       9.462028 201.3941       14.11337 219.4175       12.75253 128.0373 4.530470 133.7872 3.915734 -5.749878      5.988166 
1 1 1 3   33 7  o 120.0725 2.923699 176.2074       8.554852 163.1160       12.61150 187.3656       11.64321 115.1990 4.501096 123.6143 3.869930 -8.415337      5.936010 
1 1 1 3   33 8  o 60.01174 3.234610 44.18047       4.712879 41.78550       6.773726 46.42764       6.561378 58.11184 4.826825 61.34775 4.418547 -3.235912      6.543837 
1 1 1 3   33 9  o 52.60839 3.447347 34.02449       4.395181 38.64172       6.258195 29.53051       6.174107 55.89001 4.636622 48.68415 5.289054 7.205864       7.033659 
1 1 1 3   33 10 o 122.2991 3.214612 183.1617       9.572187 173.8882       16.83212 187.5944       11.63714 118.4740 5.848225 123.6332 3.867316 -5.159195      7.011267 
1 1 1 3   33 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 3   33 12 o 108.2234 3.351425 143.6268       8.828012 159.7321       18.10654 138.6045       10.11123 113.1194 6.597072 106.1885 3.914119 6.930862       7.670833 
1 1 1 3   33 13 o 143.7668 4.863652 255.3035       17.01498 264.4915       24.81640 247.1525       23.37397 145.2700 7.031019 140.5186 6.846551 4.751389       9.813791 
1 1 1 3   33 14 o 215.0098 4.004185 568.6071       20.98014 585.5035       43.12022 563.3666       24.01428 214.7965 8.253276 213.6901 4.611574 1.106461       9.454268 
1 1 1 3   33 15 o 112.1441 3.282680 154.4490       8.961349 143.9703       18.08564 157.8588       10.31688 106.7955 6.987743 113.2431 3.743670 -6.447632      7.927397 
1 1 1 3   33 16 o 104.8727 3.221422 135.1656       8.223012 116.6063       16.19674 141.6106       9.544588 95.88046 6.979848 107.2140 3.658528 -11.33353      7.880553 
1 1 1 3   33 17 o 45.92850 4.390230 26.34217       4.853935 35.03531       9.653989 23.40104       5.615326 51.79079 7.898836 42.96503 5.488338 8.825760       9.618392 
1 1 1 3   33 18 o 55.74770 3.722208 38.52651       5.027690 38.05445       10.31577 38.67358       5.757839 53.74286 8.130528 55.70380 4.274343 -1.960941      9.185614 
1 1 1 3   33 19 o 24.29743 6.167666 7.769626       3.657652 3.023494       7.693192 9.155790       4.157613 21.85014 8.986263 26.31235 6.518074 -4.462215      11.10127 
1 1 1 3   33 20 o 41.96134 4.059424 22.08748       4.099194 27.09480       8.637122 20.63168       4.657113 44.74847 8.223487 40.29917 4.838924 4.449299       9.541537 
1 1 1 3   33 21 o 38.43264 4.213440 18.66001       3.881532 23.26930       8.615190 17.48606       4.347819 40.79253 8.916066 36.94137 4.954531 3.851158       10.20018 
1 1 1 3   33 22 o 65.10927 3.807506 53.08037       6.014785 49.65971       11.25509 54.44779       7.116168 60.45675 7.822770 65.61131 4.477565 -5.154560      9.013563 
1 1 1 3   33 23 o 13.15538 5.553494 0.5073357      3.052162 -1.641101      7.346197 0.9555726      3.355483 17.86012 8.038654 14.16864 5.890872 3.691476       9.966059 
1 1 1 3   33 24 o 29.42830 4.879213 11.37535       3.376561 21.29697       8.741516 9.635415       3.660678 37.37338 9.560612 26.66167 5.799677 10.71171       11.18220 
1 1 1 3   33 25 o 15.63215 5.978480 2.558318       3.176807 0.000000       0.000000 2.558318       3.176807 ?        ?        15.63215 5.978480 0.000000       5.978480 
1 1 1 3   33 26 o 21.89451 5.660566 6.668222       3.042222 3.756701       8.085463 7.148384       3.283512 20.83565 8.925299 22.57967 5.902383 -1.744019      10.70042 
1 1 1 3   33 27 o 27.34472 5.185278 10.26894       3.328866 11.00253       8.284062 10.12768       3.635283 25.65190 9.690784 26.82947 5.734127 -1.177570      11.26017 
1 1 1 3   33 28 o 33.28562 4.234119 14.71181       3.356815 15.81368       6.204190 14.25573       3.991522 31.33680 8.074368 32.05197 5.295045 -0.7151699     9.655720 
1 1 1 3   33 29 o 17.93620 5.767199 4.620427       2.860478 12.77971       5.545279 1.662141       3.339009 27.87778 7.837654 14.19025 5.886100 13.68753       9.801785 
1 1 1 3   33 30 o 10.91255 5.004824 -1.195313      3.018217 -7.779924      5.400871 1.794920       3.639580 11.45799 5.624853 14.50524 6.090415 -3.047249      8.290484 
1 1 1 3   33 31 o 17.99616 6.006128 4.953506       3.089840 6.924620       5.644120 4.109970       3.692260 20.07631 7.887840 16.86141 6.446100 3.214901       10.18677 
1 1 1 3   33 32 o 15.76855 6.311473 3.446532       3.677443 2.986208       5.846343 3.747906       4.730484 16.50152 7.315886 16.54468 6.944871 -0.4315758E-01 10.08729 
1 1 1 3   33 33 o 16.14061 6.412821 3.993485       3.768764 6.411866       5.856513 2.284134       4.923709 18.54996 7.752899 15.15772 6.717304 3.392245       10.25815 
1 1 1 3   33 34 o 8.076007 3.967720 -4.262749      2.704172 -3.506544      5.456875 -4.508901      3.113334 12.30669 5.953394 8.737748 4.285618 3.568940       7.335490 
1 1 1 3   34 0  o 25.49774 6.294141 8.352316       3.886945 13.45500       5.442527 3.040226       5.553080 32.32098 7.104136 19.99290 7.833245 12.32808       10.57490 
1 1 1 3   34 1  f 94.59251 2.986919 109.4953       6.876566 114.3900       10.14079 105.3285       9.356375 96.46069 4.325050 92.58524 4.157566 3.875450       5.999284 
1 1 1 3   34 2  o 84.87244 3.076921 88.19833       6.353306 94.90462       9.432093 82.62843       8.595878 87.82135 4.421516 81.94867 4.319651 5.872681       6.181358 
1 1 1 3   34 3  o 203.8266 3.920973 509.2184       19.47559 491.1648       26.35799 530.9265       28.90289 199.5709 5.424777 207.3569 5.725357 -7.785919      7.887199 
1 1 1 3   34 4  o 25.34315 7.269271 8.181269       4.722467 8.062323       8.242447 8.239396       5.761960 27.17529 9.768684 25.81334 8.172754 1.361948       12.73660 
1 1 1 3   34 5  f 90.92940 3.409650 101.3626       7.541891 85.55534       13.62303 108.3484       9.056351 82.74798 6.816239 93.91513 3.966070 -11.16715      7.886117 
1 1 1 3   34 6  o 68.40108 3.815447 57.53551       6.334611 65.98531       12.32937 54.50504       7.383679 72.50214 7.068006 66.43168 4.589219 6.070465       8.427196 
1 1 1 3   34 7  o 89.79057 3.285200 98.83778       7.176223 89.85559       12.53888 103.2130       8.751151 84.96722 6.096312 91.64038 3.927812 -6.673157      7.252084 
1 1 1 3   34 8  o 89.72046 3.320820 98.72369       7.248079 123.7941       13.56627 88.70866       8.574436 99.91412 5.594164 84.88177 4.157943 15.03235       6.970163 
1 1 1 3   34 9  o 31.07490 5.154588 12.22673       3.766660 9.240463       5.089441 15.84341       5.600945 26.77462 7.501872 35.09436 6.794761 -8.319733      10.12160 
1 1 1 3   34 10 f 18.86282 6.124448 4.293216       3.220929 4.849751       4.123649 3.422382       5.158256 20.40365 6.938909 19.79819 7.606395 0.6054573      10.29591 
1 1 1 3   34 11 o 79.05256 3.609717 76.87708       6.935497 85.54162       13.42579 73.72330       8.099956 82.45367 6.740581 77.25085 4.319930 5.202812       8.006074 
1 1 1 3   34 12 o 86.08699 4.070272 91.44353       8.514623 93.58884       14.43144 90.29797       10.54574 86.08440 6.938104 85.24187 5.100095 0.8425293      8.610938 
1 1 1 3   34 13 o 118.9906 3.848166 174.4870       11.14374 153.1761       18.59371 186.4326       13.92093 110.0633 6.968233 122.6779 4.665066 -12.61459      8.385649 
1 1 1 3   34 14 o 69.15868 3.521468 58.98684       5.915271 61.51117       11.61281 58.10239       6.873868 69.45012 6.955129 68.48031 4.138386 0.9698105      8.093211 
1 1 1 3   34 15 o 55.32251 4.236007 38.07920       5.667333 42.01311       10.02762 36.23288       6.869720 56.98498 7.395328 53.63491 5.326300 3.350075       9.113745 
1 1 1 3   34 16 o 70.85843 3.811611 62.20135       6.557447 67.00631       12.04214 60.17599       7.818270 72.22788 6.926464 69.41399 4.648775 2.813896       8.341883 
1 1 1 3   34 17 o 43.67778 4.339872 23.93892       4.558233 20.85625       9.249679 24.92767       5.238486 38.68594 9.801539 44.39882 4.924418 -5.712883      10.96905 
1 1 1 3   34 18 o 64.56389 3.482198 51.69891       5.458449 55.06596       11.45103 50.70890       6.209287 64.73107 7.391655 63.75645 4.016933 0.9746246      8.412628 
1 1 1 3   34 19 o 28.62208 5.837110 10.79500       3.933176 12.28525       8.055639 10.32854       4.506888 29.78761 9.686637 27.72274 6.737976 2.064869       11.79963 
1 1 1 3   34 20 o 13.59282 5.764833 0.3983039      3.314252 1.365105       7.343656 0.1510203      3.713996 19.89384 8.513586 14.06358 6.037189 5.830264       10.43690 
1 1 1 3   34 21 o 23.68829 5.928795 7.551078       3.414028 10.51142       7.259693 6.710478       3.868492 27.36959 9.207299 22.31616 6.630345 5.053432       11.34618 
1 1 1 3   34 22 o 34.74819 4.487183 15.56971       3.711018 14.22086       8.072084 15.93121       4.178810 30.71135 9.666813 34.90427 5.060304 -4.192921      10.91119 
1 1 1 3   34 23 o 10.57831 4.931467 -2.486037      3.112025 -13.58599      7.783007 -0.3736650     3.395252 13.54879 6.671165 12.81006 5.631538 0.7387266      8.730330 
1 1 1 3   34 24 o 32.18848 5.374731 13.96014       4.067374 0.000000       0.000000 13.96014       4.067374 ?        ?        32.18848 5.374731 0.000000       5.374731 
1 1 1 3   34 25 o 13.45132 5.505854 1.301494       2.870541 -0.6410264     7.121953 1.678272       3.136602 17.30760 7.840588 14.29235 5.790624 3.015259       9.747109 
1 1 1 3   34 26 o 24.65737 5.673892 8.611542       3.338423 18.07990       8.753996 7.000154       3.611344 31.57563 10.08258 21.88709 6.380692 9.688536       11.93196 
1 1 1 3   34 27 o 24.25274 5.865217 8.520358       3.428084 6.383294       8.143842 8.980576       3.779221 21.50046 9.073644 24.64600 6.276446 -3.145536      11.03290 
1 1 1 3   34 28 o 21.03220 6.225218 6.654080       3.415394 2.833308       8.139321 7.470607       3.762685 18.94082 8.498463 22.08503 6.533348 -3.144207      10.71954 
1 1 1 3   34 29 o 16.92442 6.255318 4.060838       3.413703 0.9759281      6.888819 5.064948       3.930196 16.74653 7.635108 18.35159 6.723951 -1.605066      10.17381 
1 1 1 3   34 30 o 34.97953 5.343702 17.83861       4.410753 29.48937       7.178118 10.77100       5.590744 42.52098 7.183014 24.09862 8.079688 18.42236       10.81097 
1 1 1 3   34 31 o 20.65292 6.856775 7.370733       4.028141 16.04370       6.424992 1.753925       5.170511 28.28038 8.577605 15.23314 6.808713 13.04724       10.95143 
1 1 1 3   34 32 o 29.38312 5.157017 12.94398       3.557980 32.52712       7.096791 6.369097       4.112111 43.96714 6.846491 18.94105 6.887392 25.02608       9.711365 
1 1 1 3   34 33 o 12.12646 5.290084 0.9488086      2.945194 3.455212       5.825968 0.8838420E-01  3.413492 16.06973 7.201701 11.95905 5.421796 4.110684       9.014453 
1 1 1 3   35 0  o 146.9573 3.101707 264.3281       11.10780 261.7521       16.64501 266.3963       14.91466 145.7453 4.692666 147.2096 4.161762 -1.464294      6.272271 
1 1 1 3   35 1  o 52.15065 3.689265 33.51463       4.658256 37.95460       6.650348 29.23793       6.526922 55.27042 4.991329 48.30854 5.650973 6.961876       7.539686 
1 1 1 3   35 2  o 53.50790 3.435823 35.22507       4.456394 34.37131       6.618906 35.93300       6.027162 52.51624 5.241930 53.83437 4.639496 -1.318130      7.000197 
1 1 1 3   35 3  o 77.32961 3.122954 73.32856       5.872907 65.88042       8.390303 80.48315       8.223304 72.97998 4.743482 80.81953 4.189662 -7.839554      6.328815 
1 1 1 3   35 4  o 96.83543 3.782752 115.2559       8.909266 127.3719       14.59612 108.0613       11.24759 101.1740 5.946366 93.46705 4.955871 7.706940       7.740796 
1 1 1 3   35 5  o 55.76040 4.375563 38.49324       5.898010 41.57766       9.191702 36.33440       7.689878 57.38102 6.699330 53.79602 5.966067 3.585007       8.970784 
1 1 1 3   35 6  o 69.56313 3.945685 59.65224       6.661211 53.10035       10.05266 64.78098       8.894123 64.98390 6.432331 72.23183 5.085374 -7.247925      8.199751 
1 1 1 3   35 7  o 56.90889 4.850637 40.27563       6.662843 0.000000       0.000000 40.27563       6.662843 ?        ?        56.90889 4.850637 0.000000       4.850637 
1 1 1 3   35 8  o 68.10502 3.650511 57.13721       6.036414 62.80061       11.85860 55.15652       7.012993 70.42368 7.002697 66.76137 4.334068 3.662315       8.235406 
1 1 1 3   35 9  o 33.54736 5.856679 14.40224       4.613807 22.71079       8.494147 10.92496       5.495116 41.45773 8.686233 28.87443 7.677611 12.58330       11.59294 
1 1 1 3   35 10 f 88.07716 3.937754 95.75315       8.430406 114.8874       15.02191 86.95607       10.18564 95.47372 6.495298 83.58549 5.023779 11.88823       8.211410 
1 1 1 3   35 11 o 104.5388 3.403500 134.4862       8.658850 109.5637       15.56113 145.6638       10.42121 92.89240 6.924047 108.6186 3.943660 -15.72617      7.968368 
1 1 1 3   35 12 o 24.14844 6.974226 7.574582       4.332851 10.16214       7.627426 6.341768       5.264794 28.28130 9.436555 22.94933 7.839738 5.331976       12.26825 
1 1 1 3   35 13 o 112.0285 3.820140 155.1346       10.41378 162.1255       18.18962 151.7259       12.70133 112.9238 6.639304 110.3689 4.733442 2.554840       8.153884 
1 1 1 3   35 14 o 58.27350 4.312735 42.37423       6.080945 51.94247       11.22373 38.39854       7.234814 63.18283 7.431518 55.06309 5.463750 8.119740       9.223883 
1 1 1 3   35 15 o 70.10838 3.525726 60.87969       6.004246 68.93502       11.93312 58.14901       6.947796 73.07232 6.778667 68.28286 4.195671 4.789459       7.972075 
1 1 1 3   35 16 o 56.54080 4.291752 40.07410       5.869167 42.92632       10.59341 38.81079       7.050134 56.75709 7.870672 55.23449 5.302895 1.522602       9.490425 
1 1 1 3   35 17 o 54.00713 3.890023 36.48257       5.085339 44.77827       10.56073 33.97835       5.802347 57.85830 7.679644 51.82676 4.643392 6.031544       8.974298 
1 1 1 3   35 18 o 87.77622 3.278831 95.63415       7.001126 108.8400       14.61973 91.70451       7.975045 91.14192 6.627703 85.66519 3.829942 5.476730       7.654731 
1 1 1 3   35 19 o 17.43552 6.404470 3.397225       3.569151 -0.7977301     6.941779 4.904692       4.161319 17.93489 7.960505 19.90336 6.961663 -1.968468      10.57518 
1 1 1 3   35 20 o 42.34809 4.187612 22.85017       4.265002 32.96553       9.637952 20.38697       4.756024 48.02890 8.548021 39.59344 5.043626 8.435463       9.925061 
1 1 1 3   35 21 o 45.97452 4.053590 26.95443       4.494969 46.96566       9.941975 21.81287       5.039446 58.32563 7.143799 40.74413 5.193413 17.58150       8.832067 
1 1 1 3   35 22 o 27.58633 6.189334 10.57792       4.058185 0.000000       0.000000 10.57792       4.058185 ?        ?        27.58633 6.189334 0.000000       6.189334 
1 1 1 3   35 23 o 34.46900 4.671640 15.70358       3.823132 35.84570       9.379016 11.68987       4.186757 49.01334 8.137744 28.85831 6.142171 20.15503       10.19555 
1 1 1 3   35 24 o 11.71442 5.230555 -0.6203702     3.043073 5.339282       7.074415 -1.973450      3.370868 20.93500 8.614375 11.28113 5.215316 9.653867       10.07010 
1 1 1 3   35 25 o 19.05450 6.164790 5.180184       3.265193 15.05535       7.725146 3.032249       3.602839 29.18520 9.485496 16.23732 6.324651 12.94788       11.40069 
1 1 1 3   35 26 o 11.61895 5.230919 -0.7062063     3.112935 -1.190041      6.765582 -0.5762678     3.506109 16.06968 7.414678 12.40141 5.569958 3.668270       9.273720 
1 1 1 3   35 27 o 13.42465 5.797268 0.8164365      3.463961 8.298509       7.476033 -1.228982      3.908871 22.08709 8.943080 12.44169 5.702209 9.645406       10.60631 
1 1 1 3   35 28 o 18.59909 6.977335 5.298952       4.277865 -0.7175257     8.175612 7.567208       5.019902 16.75190 7.868567 21.15098 7.620929 -4.399076      10.95413 
1 1 1 3   35 29 o 10.73059 5.153423 -3.720004      3.915485 -6.063642      7.193956 -2.733502      4.667363 13.71382 6.680378 12.29823 5.827466 1.415588       8.864920 
1 1 1 3   35 30 o 22.96758 7.550503 9.795947       4.888288 14.84804       9.496943 7.975014       5.701579 23.57246 9.863844 20.35948 7.948843 3.212986       12.66805 
1 1 1 3   35 31 o 31.29330 5.334785 14.84797       3.922449 29.81158       10.78644 12.56765       4.210728 31.45510 11.19003 27.50919 6.401823 3.945910       12.89186 
1 1 1 3   35 32 o 19.13875 6.210890 6.296010       3.312729 8.500200       6.428561 5.499062       3.865489 19.63649 8.158124 17.67421 6.632066 1.962280       10.51377 
1 1 1 3   36 0  o 62.32604 3.823064 47.93356       5.778598 54.85331       7.639249 38.67831       8.834851 66.47166 4.747298 55.20909 6.704006 11.26257       8.214653 
1 1 1 3   36 1  o 92.07536 3.177654 104.0733       7.119258 93.08546       13.66058 108.1703       8.341614 86.02070 6.566362 93.75976 3.657898 -7.739059      7.516471 
1 1 1 3   36 2  o 45.11595 4.242296 25.29882       4.609359 30.97051       8.548916 22.97423       5.473037 49.08488 7.374856 42.71313 5.377010 6.371742       9.126925 
1 1 1 3   36 3  o 110.1013 3.347067 148.9236       8.969913 144.3440       16.20081 150.9481       10.77162 107.3208 6.221317 110.6541 4.001228 -3.333252      7.396933 
1 1 1 3   36 4  o 67.01568 3.251530 55.24050       5.294223 46.53655       7.479260 63.98132       7.495088 61.07150 5.071265 71.89178 4.297822 -10.82028      6.647481 
1 1 1 3   36 5  o 85.13050 3.034106 88.98773       6.284301 98.04444       9.314295 81.42015       8.514190 89.02216 4.306316 81.10104 4.323677 7.921120       6.102339 
1 1 1 3   36 6  o 79.18327 3.050519 77.03221       5.875302 83.34170       8.576523 71.45301       8.064920 82.03722 4.305136 75.92315 4.377589 6.114075       6.139827 
1 1 1 3   36 7  o 57.07100 3.614595 40.24325       5.001200 42.89884       6.726734 36.96105       7.478354 58.64419 4.747547 54.10387 5.760544 4.540321       7.464788 
1 1 1 3   36 8  o 70.34069 3.393966 60.99426       5.800517 56.23220       7.612370 67.58725       8.957027 67.17859 4.679251 73.55727 5.027135 -6.378685      6.867858 
1 1 1 3   36 9  o 21.00924 6.729696 5.509688       3.897577 4.188773       4.919131 7.737592       6.388502 20.16891 7.498836 25.16376 8.634813 -4.994852      11.43646 
1 1 1 3   36 10 o 119.8865 3.719890 177.5614       10.85452 180.3291       12.93965 170.9886       19.94032 120.4819 4.414682 115.5615 7.115312 4.920433       8.373593 
1 1 1 3   36 11 o 49.27263 5.220511 30.71052       6.173127 26.08967       9.349236 34.28225       8.219677 43.81515 9.055714 51.50440 6.708240 -7.689255      11.26971 
1 1 1 3   36 12 o 122.7954 3.856680 186.9440       11.52638 187.5245       19.66937 186.6404       14.22472 120.9121 6.701727 122.1285 4.788872 -1.216385      8.236896 
1 1 1 3   36 13 o 52.52284 4.117709 34.50457       5.228249 13.17033       9.121431 44.94318       6.380369 31.04825 10.31839 59.87828 4.403405 -28.83003      11.21870 
1 1 1 3   36 14 o 18.47071 6.609835 3.896316       3.769042 -4.120026      6.513198 7.932226       4.621436 15.77622 7.277769 24.40362 7.246023 -8.627399      10.26990 
1 1 1 3   36 15 o 42.47712 4.523963 22.88572       4.610882 22.01736       9.058125 23.18942       5.356837 39.22686 9.563644 42.46193 5.291435 -3.235073      10.92989 
1 1 1 3   36 16 o 42.92519 4.442859 23.40755       4.580305 20.33280       8.599395 24.62532       5.411849 37.50159 9.422766 43.72827 5.179066 -6.226681      10.75227 
1 1 1 3   36 17 o 28.21143 5.953148 10.66629       3.963846 19.00157       7.840647 7.804532       4.594183 36.25305 8.933649 23.91874 7.252975 12.33431       11.50720 
1 1 1 3   36 18 o 16.79380 6.346469 2.990325       3.553632 3.766132       6.786686 2.697268       4.171160 20.72899 8.473091 17.14730 6.767461 3.581692       10.84398 
1 1 1 3   36 19 o 51.10074 3.843277 33.10082       4.750844 35.90917       9.922586 32.26555       5.411422 49.82503 8.475445 50.10489 4.479145 -0.2798576     9.586235 
1 1 1 3   36 20 o 21.03284 7.151154 6.020963       4.379740 0.000000       0.000000 6.020963       4.379740 ?        ?        21.03284 7.151154 0.000000       7.151154 
1 1 1 3   36 21 o 13.50571 5.960550 -0.2957504     3.838331 0.000000       0.000000 -0.2957504     3.838331 ?        ?        13.50571 5.960550 0.000000       5.960550 
1 1 1 3   36 22 o 15.50441 6.136048 2.405139       3.437806 7.944924       7.512232 0.9376538      3.866423 23.30399 9.116644 14.51025 6.192717 8.793731       11.02102 
1 1 1 3   36 23 o 12.60085 5.500006 0.1157844      3.187281 7.992159       7.153461 -1.835150      3.560200 22.89876 8.914045 11.68609 5.387262 11.21267       10.41551 
1 1 1 3   36 24 o 61.75087 4.184003 50.15957       6.258915 49.10575       11.16766 50.64216       7.557357 55.20079 8.580564 60.93367 5.137326 -5.732880      10.00091 
1 1 1 3   36 25 o 23.46078 7.242942 8.738123       4.555170 26.39273       8.813663 2.303578       5.320915 38.39499 9.477881 16.78211 7.215497 21.61287       11.91191 
1 1 1 3   36 26 f 14.60877 6.520232 0.4673427      4.723629 -1.072234      7.191261 1.635719       6.264634 16.09452 7.500858 16.78342 7.498596 -0.6889019     10.60622 
1 1 1 3   36 27 o 14.61754 6.240566 1.784689       3.928716 6.093833       7.065975 -0.1435408     4.726678 19.66811 8.382153 13.98983 6.357284 5.678283       10.52024 
1 1 1 3   36 28 o 17.80411 6.302009 4.988750       3.417380 3.749148       8.034197 5.262567       3.775999 18.04737 8.234814 18.12871 6.598740 -0.8133698E-01 10.55251 
1 1 1 3   36 29 o 12.34023 5.458441 0.5220769      3.236292 -6.769254      7.577753 2.148667       3.579119 13.52434 6.643960 14.24431 6.013535 -0.7199774     8.961295 
1 1 1 3   36 30 o 10.76464 5.027199 -1.410084      3.257164 3.701079       8.133306 -2.386378      3.554657 17.22136 8.009512 10.62825 5.050465 6.593113       9.468869 
1 1 1 3   37 0  o 117.0976 3.281585 168.6900       9.354901 175.8419       13.07750 161.1949       13.38761 119.0491 4.515965 113.8250 4.837493 5.224106       6.617800 
1 1 1 3   37 1  o 89.39403 3.047707 98.23718       6.629523 110.6866       9.994727 88.45674       8.858832 94.46986 4.353220 84.44276 4.319398 10.02710       6.132514 
1 1 1 3   37 2  o 102.4677 3.091624 129.0859       7.711041 142.8641       11.36966 117.3502       10.49312 107.3364 4.355796 97.23076 4.440305 10.10564       6.220069 
1 1 1 3   37 3  o 80.45219 3.212176 79.69524       6.284914 71.63804       8.772980 88.19011       9.008103 75.78873 4.774401 84.25961 4.402374 -8.470871      6.494290 
1 1 1 3   37 4  o 87.94447 2.994288 95.10402       6.407731 99.45516       9.499054 91.47085       8.680030 89.48051 4.369492 85.88251 4.159814 3.598000       6.032952 
1 1 1 3   37 5  o 59.97620 3.355932 44.42493       4.885316 37.75763       6.541519 52.83299       7.346012 54.83506 4.948549 65.03264 4.666386 -10.19758      6.801713 
1 1 1 3   37 6  o 30.83237 5.189229 12.18545       3.760612 13.39019       5.038558 10.67030       5.650509 31.91526 6.692596 28.29302 7.896316 3.622248       10.35097 
1 1 1 3   37 7  o 96.68733 3.202751 115.2372       7.535796 110.6014       9.874353 121.7031       11.66172 94.27972 4.309275 98.62839 4.867074 -4.348663      6.500635 
1 1 1 3   37 8  o 52.54163 3.500162 34.23332       4.455991 34.72383       6.135123 33.68567       6.482677 52.50453 4.849803 51.57106 5.230635 0.9334679      7.133031 
1 1 1 3   37 9  o 31.01813 5.637581 12.49419       4.104405 18.11677       5.169727 2.907226       6.750575 37.42045 5.861504 20.71422 8.456806 16.70623       10.28955 
1 1 1 3   37 10 o 29.26040 5.920738 11.23746       4.076625 15.21870       6.277558 8.334126       5.360806 33.47589 7.834736 25.12376 7.873578 8.352137       11.10749 
1 1 1 3   37 11 o 94.94565 3.926320 112.3200       9.064810 86.15855       13.89924 131.6835       11.95784 81.10625 7.104005 102.2586 4.812121 -21.15238      8.580407 
1 1 1 3   37 12 o 27.98104 6.932103 10.58947       4.702240 9.347474       6.838213 11.70354       6.476468 26.48143 8.936106 29.05150 8.565589 -2.570078      12.37834 
1 1 1 3   37 13 o 22.00025 7.362084 6.237995       4.642004 4.415275       7.047472 7.634800       6.169379 21.86659 8.742312 24.30640 8.478243 -2.439812      12.17820 
1 1 1 3   37 14 o 22.92130 7.291201 7.025683       4.581366 14.21389       7.881690 3.357684       5.630199 31.28160 9.502922 19.53856 7.813155 11.74305       12.30248 
1 1 1 3   37 15 o 24.74139 7.190615 8.449501       4.592645 6.072797       7.343695 9.976122       5.885626 23.14738 9.025822 26.60865 8.236147 -3.461266      12.21882 
1 1 1 3   37 16 o 27.39443 7.319591 10.57383       4.979436 10.17439       7.507295 10.88760       6.653694 26.70141 9.349793 27.40375 8.794335 -0.7023449     12.83585 
1 1 1 3   37 17 o 19.03356 7.085551 4.293986       4.394471 3.371107       7.203351 4.841063       5.546083 20.54045 8.592513 20.47042 7.881331 0.7002831E-01  11.65962 
1 1 1 3   37 18 o 12.90502 5.933984 -2.265996      4.280777 3.302622       7.014978 -5.570048      5.403512 20.11016 8.450321 12.95785 6.177034 7.152315       10.46727 
1 1 1 3   37 19 o 18.09412 8.084661 0.1378646      7.283255 0.000000       0.000000 0.1378646      7.283255 ?        ?        18.09412 8.084661 0.000000       8.084661 
1 1 1 3   37 20 f 25.64796 7.182386 9.786650       4.666491 19.40351       8.109614 5.026036       5.705781 34.23760 9.423627 20.10136 7.920709 14.13624       12.31026 
1 1 1 3   37 21 o 27.25933 6.909124 11.06344       4.594799 15.51432       7.629323 8.530232       5.755702 30.10991 9.386444 23.45567 8.188564 6.654238       12.45624 
1 1 1 3   37 22 o 29.55205 6.908149 13.11586       4.885240 28.36149       9.401515 7.476852       5.717772 40.49559 9.662194 22.06755 8.106105 18.42804       12.61217 
1 1 1 3   37 23 o 37.63348 5.647731 20.03320       5.019764 26.93307       9.104733 17.01987       6.016856 38.79494 9.666233 32.73300 7.676764 6.061939       12.34377 
1 1 1 3   37 24 o 19.12221 7.413727 5.342994       4.932589 8.146536       7.328246 3.020727       6.669643 21.95971 8.867627 18.08644 7.923792 3.873270       11.89207 
1 1 1 3   37 25 o 28.86744 5.722126 12.29919       3.883043 24.12419       8.456055 9.139393       4.371165 35.27430 9.588089 23.63523 7.054247 11.63907       11.90352 
1 1 1 3   37 26 o 20.50649 6.355084 6.716157       3.502963 -0.9652040     8.059772 8.505065       3.889534 16.27394 7.695436 22.86974 6.608688 -6.595795      10.14369 
1 1 1 3   37 27 o 25.04966 6.467130 10.24195       3.974753 14.45336       9.656192 9.382817       4.361380 23.64861 9.924310 23.24932 7.070289 0.3992863      12.18527 
1 1 1 3   37 28 o 35.83875 4.873558 18.66050       4.146150 17.69685       9.729801 18.87431       4.583091 24.93208 10.16264 35.30165 5.507242 -10.36957      11.55893 
1 1 1 3   37 29 o 9.887171 4.728889 -2.738307      3.222799 -10.07888      7.214304 -0.9081864     3.602212 12.15814 6.061080 11.59951 5.372591 0.5586329      8.099471 
1 1 1 3   38 0  o 128.4805 3.010029 203.1764       9.424191 208.7792       14.25455 198.8257       12.56113 129.3464 4.529329 126.5039 4.079970 2.842468       6.095981 
1 1 1 3   38 1  o 60.37728 3.179159 45.04534       4.661103 43.32295       7.040395 46.38940       6.219295 58.62012 4.975454 60.95702 4.212703 -2.336891      6.519356 
1 1 1 3   38 2  o 65.21045 3.030157 52.46926       4.802080 53.47244       7.261234 51.68946       6.401971 65.30987 4.591685 64.38981 4.101321 0.9200592      6.156655 
1 1 1 3   38 3  o 83.53761 2.859930 85.94444       5.813433 105.0445       9.543844 74.67692       7.330279 91.77454 4.279198 77.50703 3.893465 14.26751       5.785379 
1 1 1 3   38 4  o 19.22938 6.362486 4.569034       3.469115 10.21624       4.779853 -1.716692      5.042845 27.61839 7.072065 14.97402 6.706224 12.64437       9.746156 
1 1 1 3   38 5  o 36.16614 4.941900 16.69777       4.241634 12.30361       5.039497 27.37388       7.855172 30.31475 6.967905 45.42208 7.347375 -15.10732      10.12599 
1 1 1 3   38 6  o 30.70139 6.032701 12.39879       4.352378 13.19453       4.700829 7.620401       11.51939 31.59232 6.326796 27.64027 11.13332 3.952049       12.80544 
1 1 1 3   38 7  o 17.32875 6.602212 2.928966       3.864777 4.430490       4.155232 -6.698823      10.52186 19.49063 6.944060 19.54454 9.096758 -0.5390739E-01 11.44425 
1 1 1 3   38 8  o 70.86834 3.138284 62.19353       5.406324 60.59619       7.651906 63.78569       7.639503 69.33930 4.553699 71.21334 4.424027 -1.874039      6.348874 
1 1 1 3   38 9  o 25.75925 5.602878 8.773903       3.416727 5.581587       4.415111 13.54002       5.394749 21.06882 7.179687 31.54239 7.180159 -10.47357      10.15394 
1 1 1 3   38 10 o 84.61655 3.222575 88.86880       6.632848 81.70840       8.554803 99.66086       10.50251 80.50919 4.376882 88.57998 4.884339 -8.070786      6.558495 
1 1 1 3   38 11 o 23.42959 7.397097 7.401012       4.723167 11.78435       8.149607 5.184062       5.795787 28.79530 9.755248 21.40643 8.101516 7.388876       12.68067 
1 1 1 3   38 12 o 38.53765 4.963286 19.22912       4.553014 23.79907       8.072259 17.09696       5.513773 40.94558 8.372803 35.52422 6.612525 5.421360       10.66908 
1 1 1 3   38 13 o 20.95560 6.917787 5.820409       4.101826 19.61977       7.753620 0.4576386      4.833588 36.60372 8.801137 15.91077 6.859356 20.69295       11.15844 
1 1 1 3   38 14 o 35.53596 5.245312 16.64551       4.405919 15.65985       8.157660 17.05145       5.235148 31.93057 9.661139 35.41582 6.296650 -3.485247      11.53193 
1 1 1 3   38 15 f 11.20092 5.238719 -2.919490      3.558676 -6.613583      6.825371 -1.540347      4.170394 14.57750 6.947225 13.24504 6.000038 1.332460       9.179564 
1 1 1 3   38 16 o 14.50352 6.126094 0.9572623      3.717451 2.277470       7.485477 0.5250596      4.282940 19.71764 8.518485 14.93655 6.448195 4.781095       10.68381 
1 1 1 3   38 17 o 40.14449 5.981441 22.15529       5.673130 0.000000       0.000000 22.15529       5.673130 ?        ?        40.14449 5.981441 0.000000       5.981441 
1 1 1 3   38 18 o 28.27036 6.331624 11.42625       4.253352 22.75438       8.521402 7.667538       4.908528 37.21672 9.395970 22.73968 7.569651 14.47704       12.06581 
1 1 1 3   38 19 o 55.01457 4.540995 39.96436       6.033697 43.50854       10.41101 38.17190       7.403882 53.00612 8.334736 52.41783 5.898479 0.5882912      10.21077 
1 1 1 3   38 20 o 13.49835 6.005598 -0.2515783     3.974751 7.476753       7.023999 -3.892149      4.820880 22.28599 8.786131 12.51995 5.929582 9.766031       10.59981 
1 1 1 3   38 21 o 17.10630 6.504758 3.765835       3.746953 7.948955       8.114532 2.632190       4.224272 22.47058 9.233927 16.23087 6.665305 6.239706       11.38823 
1 1 1 3   38 22 o 14.44495 6.043297 1.685696       3.563802 4.048977       7.763083 1.054656       4.011484 19.41851 8.526793 14.38546 6.225439 5.033057       10.55757 
1 1 1 3   38 23 f 27.66338 6.629836 11.91387       4.411003 21.96519       8.488171 8.195292       5.162870 33.35920 9.798201 22.03533 7.750719 11.32388       12.49313 
1 1 1 3   38 24 o 17.41663 6.401509 4.507723       3.566745 4.205263       6.921920 4.617062       4.161798 18.38523 8.062978 17.68476 6.822412 0.7004662      10.56205 
1 1 1 3   38 25 o 28.92856 5.804607 12.73244       3.949578 24.20950       8.982035 9.981383       4.397532 32.77294 10.17958 24.23334 7.034251 8.539602       12.37354 
1 1 1 3   38 26 o 9.625545 4.658998 -3.886755      3.353801 -16.45333      7.007957 -0.1536410     3.819606 10.85582 5.485971 12.60841 5.723741 -1.752584      7.928246 
1 1 1 3   38 27 o 16.97643 6.462770 4.633780       3.701372 13.45140       8.826231 2.752180       4.077210 22.65124 9.495845 15.09279 6.397215 7.558446       11.44969 
1 1 1 3   39 0  o 73.61326 3.197444 67.15949       5.722134 76.03777       8.359140 59.33075       7.849520 77.74512 4.430513 68.49267 4.731955 9.252449       6.482349 
1 1 1 3   39 1  o 69.83791 2.931173 60.30245       4.977395 51.71159       7.495617 67.07848       6.656973 63.85269 4.853530 73.33637 3.737279 -9.483681      6.125685 
1 1 1 3   39 2  o 18.48671 6.148248 4.258142       3.238350 4.645150       4.580501 3.871399       4.578935 20.02994 7.271147 19.13211 7.209823 0.8978310      10.23968 
1 1 1 3   39 3  o 20.30487 6.127893 5.401571       3.284920 7.979124       4.179287 1.235200       5.313459 24.32942 6.791286 17.43194 7.341403 6.897476       10.00089 
1 1 1 3   39 4  o 17.41823 6.239077 3.484955       3.358911 1.248157       3.937317 9.464828       6.437735 15.48957 6.405334 26.37473 8.664616 -10.88516      10.77515 
1 1 1 3   39 5  o 16.05559 5.998730 2.681327       3.155408 3.827878       4.264536 1.294182       4.690682 18.71388 6.977378 16.59987 6.938201 2.114010       9.839840 
1 1 1 3   39 6  o 69.41262 3.159382 59.85422       5.330114 62.04763       7.546330 57.67057       7.529536 70.02660 4.445126 67.40723 4.611578 2.619370       6.405138 
1 1 1 3   39 7  o 65.47866 3.215404 53.36007       5.114948 49.33949       6.978252 58.02822       7.519264 62.25840 4.632726 67.56561 4.594142 -5.307213      6.524438 
1 1 1 3   39 8  o 28.35922 6.108882 10.85409       4.096959 11.52517       4.969120 9.429526       7.239908 28.83125 7.116338 26.17249 9.180493 2.658758       11.61567 
1 1 1 3   39 9  o 47.19596 4.077504 28.26341       4.643647 25.91322       5.640986 33.20413       8.178964 44.57837 5.296109 49.41896 6.986141 -4.840595      8.766695 
1 1 1 3   39 10 o 50.40108 3.933358 32.18179       4.792797 30.68169       5.830403 35.30793       8.416734 48.64899 4.988585 50.84986 6.975999 -2.200871      8.576161 
1 1 1 3   39 11 o 51.28437 5.166605 34.35270       6.369020 38.28545       9.611396 31.27383       8.504197 52.07128 7.815490 47.10945 7.671531 4.961826       10.95145 
1 1 1 3   39 12 o 20.93135 7.264967 5.849613       4.527107 7.856613       6.516663 3.977572       6.293746 23.83723 8.669939 20.16239 8.190228 3.674839       11.92676 
1 1 1 3   39 13 o 26.85113 7.493373 10.52304       5.088732 0.000000       0.000000 10.52304       5.088732 ?        ?        26.85113 7.493373 0.000000       7.493373 
1 1 1 3   39 14 o 12.44169 5.556738 -0.7632238     3.436810 -1.832750      6.278156 -0.3055699     4.106814 15.91501 7.268563 13.93632 6.157384 1.978683       9.526037 
1 1 1 3   39 15 o 16.16871 6.637314 2.177189       4.186873 0.000000       0.000000 2.177189       4.186873 ?        ?        16.16871 6.637314 0.000000       6.637314 
1 1 1 3   39 16 o 11.77239 5.411272 -1.791377      3.555485 -2.835434      6.011908 -1.229779      4.409230 14.84082 6.896849 13.57795 6.158249 1.262877       9.246110 
1 1 1 3   39 17 o 18.69720 6.497393 4.827373       3.621554 10.49661       7.004556 2.758959       4.230944 25.30110 9.015662 16.61756 6.728011 8.683537       11.24937 
1 1 1 3   39 18 o 37.57888 5.765471 19.82998       5.111473 27.32888       8.763359 15.96325       6.292803 40.50921 9.100074 31.55696 8.132204 8.952253       12.20427 
1 1 1 3   39 19 o 12.40594 5.555563 -0.5014223     3.459909 0.5302030      7.235035 -0.8072956     3.939584 17.42326 7.896814 12.93174 5.847466 4.491529       9.826115 
1 1 1 3   39 20 o 16.01082 6.307889 3.052430       3.618217 10.26898       6.973563 0.3940767      4.232493 24.00947 8.928143 14.12736 6.245921 9.882106       10.89602 
1 1 1 3   39 21 o 11.27375 5.342805 -3.091697      3.926076 8.022449       8.112946 -6.490398      4.486389 21.66184 9.094049 10.61550 5.193625 11.04634       10.47261 
1 1 1 3   39 22 o 15.73381 6.354657 2.991029       3.764051 4.239431       7.813104 2.613708       4.295378 18.85984 8.403696 15.75935 6.616660 3.100492       10.69590 
1 1 1 3   39 23 o 12.86305 5.674535 0.5214216      3.475343 0.4943421      7.118222 0.5298967      3.982225 16.23563 7.531169 13.50009 6.008510 2.735542       9.634350 
1 1 1 3   39 24 o 13.28738 6.034191 -0.1853939E-01 4.249999 0.2034615      7.192262 -0.1376468     5.268143 15.91825 7.445857 14.26540 6.567997 1.652854       9.928714 
1 1 1 3   39 25 o 21.44534 7.463130 8.528261       4.779006 5.836415       8.555720 9.749012       5.761625 18.73476 8.528916 22.02949 8.129373 -3.294724      11.78258 
1 1 1 3   40 0  o 51.29131 3.723996 33.10854       4.622967 31.81355       6.208088 34.72058       6.926471 49.52556 5.222433 51.52818 5.606371 -2.002617      7.661932 
1 1 1 3   40 1  o 31.81441 4.871563 13.17692       3.656791 8.865851       4.623739 20.37678       5.975341 25.26989 7.174962 38.83738 6.546109 -13.56750      9.712446 
1 1 1 3   40 2  o 23.18708 5.960878 7.286300       3.386597 9.567111       4.729495 4.886219       4.851580 26.19279 7.191506 20.23665 7.461185 5.956148       10.36277 
1 1 1 3   40 3  o 29.71536 4.838975 11.53278       3.383589 11.96360       4.754538 11.09070       4.816295 29.43997 6.768892 28.22033 7.029806 1.219645       9.758897 
1 1 1 3   40 4  o 47.68795 3.857994 28.76786       4.445139 32.92904       6.024078 23.79383       6.586220 50.45458 4.963723 41.84407 6.683784 8.610512       8.325354 
1 1 1 3   40 5  f 48.54619 3.507020 29.64775       4.120900 24.69979       5.594997 35.51456       6.092388 43.35336 5.413570 52.45150 4.820296 -9.098141      7.248586 
1 1 1 3   40 6  o 21.66078 6.130474 6.410217       3.381021 5.536053       4.424857 7.636626       5.241073 20.61514 7.180843 23.47395 7.822064 -2.858805      10.61834 
1 1 1 3   40 7  o 68.41071 3.106133 58.48503       5.164707 63.17485       7.478136 54.20797       7.141488 70.24497 4.390552 64.94176 4.541236 5.303207       6.316627 
1 1 1 3   40 8  f 50.90981 3.626965 32.80412       4.470202 38.67972       6.393840 27.18599       6.252182 54.51787 4.863698 45.01520 5.836780 9.502670       7.597601 
1 1 1 3   40 9  o 54.60943 3.468282 37.67110       4.591645 35.19714       6.290165 40.49311       6.718070 51.77051 5.050026 55.58287 5.013679 -3.812359      7.116160 
1 1 1 3   40 10 o 81.57269 2.997989 83.30556       5.949378 87.16525       8.769483 80.01436       8.097962 82.19832 4.393959 78.90998 4.226640 3.288338       6.096832 
1 1 1 3   40 11 o 32.44830 5.622080 14.37511       4.284561 16.51229       7.786390 13.44697       5.131264 31.94669 9.384714 30.45889 7.052312 1.487806       11.73916 
1 1 1 3   40 12 o 21.86323 7.375963 6.887331       4.658902 0.000000       0.000000 6.887331       4.658902 ?        ?        21.86323 7.375963 0.000000       7.375963 
1 1 1 3   40 13 o 18.36655 6.949569 4.218169       4.264241 0.000000       0.000000 4.218169       4.264241 ?        ?        18.36655 6.949569 0.000000       6.949569 
1 1 1 3   40 14 o 31.57960 6.899806 14.66117       5.161017 16.05239       8.182859 13.74218       6.650642 30.38521 9.752837 29.04400 8.708997 1.341209       13.07534 
1 1 1 3   40 15 o 30.78795 7.158976 14.28166       5.269176 7.789122       8.190271 18.86652       6.882631 22.90238 9.328259 34.40166 8.305044 -11.49928      12.48960 
1 1 1 3   40 16 o 30.73470 6.896115 14.19007       5.037687 16.55149       8.381202 12.85434       6.303439 29.97116 9.888293 27.75546 8.511502 2.215696       13.04699 
1 1 1 3   40 17 o 16.06586 6.704580 2.349153       4.370030 -0.4446878     7.213073 3.969329       5.492886 16.84785 7.730672 18.37842 7.579397 -1.530563      10.82638 
1 1 1 3   40 18 o 15.73970 6.614577 2.228454       4.298919 1.426219       7.074179 2.698173       5.413076 17.49449 7.880008 17.08114 7.309603 0.4133511      10.74825 
1 1 1 3   40 19 o 34.39899 7.584748 19.26188       6.186751 24.83050       8.991239 14.25456       8.526058 35.53398 9.976514 26.23935 9.848893 9.294626       14.01897 
1 1 1 3   40 20 o 15.29204 6.514359 2.117419       4.264582 4.067051       7.941434 1.327367       5.055340 18.83019 8.425757 15.38148 6.811992 3.448710       10.83497 
1 1 1 3   40 21 o 20.18294 7.242393 6.862668       4.528286 6.895641       7.941732 6.846783       5.512125 20.09286 8.727051 19.97279 7.810491 0.1200695      11.71175 
1 1 1 3   40 22 o 25.54944 7.485148 11.54212       4.959051 36.34157       9.737156 2.856953       5.762358 42.61244 9.607143 16.57360 7.309350 26.03884       12.07161 
1 1 1 3   40 23 o 15.53719 6.612104 2.825302       4.385767 11.07377       8.626719 -0.4971802E-01 5.093068 21.79692 9.274632 14.05652 6.466777 7.740397       11.30655 
1 1 1 3   40 24 o 11.24092 5.269511 -1.707834      3.635479 11.75734       8.521973 -4.703514      4.019591 21.93101 9.269962 10.28633 5.006888 11.64467       10.53571 
1 1 1 3   41 0  o 49.27334 4.165931 31.14291       4.955362 30.10580       8.715517 31.63832       6.023757 45.44159 8.170890 49.05947 5.113557 -3.617882      9.639083 
1 1 1 3   41 1  o 20.11989 6.086561 5.537813       3.238018 5.148944       4.513247 5.950290       4.648233 19.99793 7.223392 21.03550 7.357687 -1.037577      10.31082 
1 1 1 3   41 2  o 46.17461 3.857155 27.20030       4.300553 31.95372       6.133266 22.60285       6.031805 49.21210 5.192456 40.59474 6.301574 8.617367       8.165257 
1 1 1 3   41 3  o 36.40023 4.073642 17.07063       3.551559 16.14872       5.211703 17.86994       4.852807 34.03249 6.521507 36.38844 5.656243 -2.355946      8.632679 
1 1 1 3   41 4  o 25.58337 5.534364 8.947405       3.349870 14.57401       5.284552 5.167683       4.331265 31.94971 6.982861 19.84106 7.087350 12.10865       9.949416 
1 1 1 3   41 5  o 15.90489 6.003712 2.817905       3.178081 2.094586       4.523608 3.522893       4.465918 16.60667 6.866335 17.98306 7.030916 -1.376389      9.827530 
1 1 1 3   41 6  o 16.10274 6.067475 2.939033       3.242661 1.494246       4.389554 4.674568       4.810998 15.85211 6.674180 19.43562 7.375340 -3.583516      9.946875 
1 1 1 3   41 7  o 26.54909 5.611879 9.727042       3.516965 13.47987       5.090948 6.300968       4.864271 30.48411 7.000929 21.24912 7.518931 9.234987       10.27362 
1 1 1 3   41 8  o 23.27435 6.130435 7.684104       3.524651 7.865266       5.025120 7.508669       4.945063 23.09416 7.658158 22.65514 7.598850 0.4390202      10.78841 
1 1 1 3   41 9  o 11.82001 5.385914 -1.420916      3.421690 -2.105674      4.410776 -0.3860465     5.422375 13.04526 6.007529 15.56573 6.963879 -2.520466      9.197065 
1 1 1 3   41 10 o 35.34825 6.779263 18.07087       5.627254 0.000000       0.000000 18.07087       5.627254 ?        ?        35.34825 6.779263 0.000000       6.779263 
1 1 1 3   41 11 f 18.24293 7.116752 4.023294       4.567387 0.000000       0.000000 4.023294       4.567387 ?        ?        18.24293 7.116752 0.000000       7.116752 
1 1 1 3   41 12 o 20.96731 6.685631 6.443263       3.850085 3.923302       6.853204 7.605365       4.653921 19.56244 8.292874 22.41279 7.367234 -2.850349      11.09270 
1 1 1 3   41 13 o 17.59612 6.656767 3.990530       3.912044 7.641532       7.587083 2.668344       4.565783 22.44450 9.037193 16.69712 6.900480 5.747374       11.37047 
1 1 1 3   41 14 o 29.98859 5.957797 12.97358       4.200397 14.52484       8.294150 12.43849       4.871258 27.82406 9.820704 28.44522 7.060545 -0.6211662     12.09535 
1 1 1 3   41 15 o 17.18439 6.559010 3.884986       3.818745 13.23297       7.841330 0.9786022      4.372272 26.50603 9.528035 14.80094 6.451359 11.70510       11.50667 
1 1 1 3   41 16 o 17.82191 7.037076 4.254607       4.512089 0.000000       0.000000 4.254607       4.512089 ?        ?        17.82191 7.037076 0.000000       7.037076 
1 1 1 3   41 17 o 12.28538 5.704911 -1.781420      4.101357 3.014448       7.120947 -4.162052      5.017071 18.10469 8.047697 12.32951 5.897889 5.775174       9.977501 
1 1 1 3   41 18 o 29.16803 6.180428 12.99985       4.256283 20.60065       9.154911 10.90392       4.807438 30.30760 10.33838 25.44170 7.345809 4.865902       12.68239 
1 1 1 3   41 19 o 19.89612 7.019408 6.542647       4.236925 17.85905       9.399807 3.657238       4.746445 27.15668 10.30827 16.83982 7.004259 10.31686       12.46275 
1 1 1 3   41 20 o 17.57860 7.083647 4.641001       4.665522 5.425603       8.214351 4.267362       5.668591 19.05156 8.543677 17.58616 7.501678 1.465403       11.36968 
1 1 1 3   41 21 o 15.06873 6.234759 2.738769       3.733233 -1.748819      6.941920 4.564690       4.428065 14.84658 7.055804 17.25985 6.919805 -2.413274      9.882715 
1 1 1 3   42 0  o 19.93901 6.362514 5.567327       3.486409 0.3397208      4.742537 11.71458       5.142805 15.24778 6.680886 28.00191 7.419035 -12.75413      9.983804 
1 1 1 3   42 1  o 25.92058 6.796478 9.793757       4.344917 3.228744       6.849943 14.21320       5.620215 19.47735 8.275223 30.80260 7.547526 -11.32525      11.20020 
1 1 1 3   42 2  o 51.30305 3.929415 33.92076       4.875165 36.97191       9.623137 32.86730       5.654488 49.35382 8.295244 49.91724 4.703890 -0.5634232     9.536123 
1 1 1 3   42 3  o 25.43800 6.397789 9.308291       3.961602 11.25035       7.429392 8.536698       4.682921 26.33531 9.294709 23.94059 7.335277 2.394724       11.84052 
1 1 1 3   42 4  o 22.11886 6.036497 6.959337       3.343880 11.36621       4.930171 3.205021       4.550531 27.58595 7.242955 17.48857 7.013698 10.09738       10.08228 
1 1 1 3   42 5  o 39.51365 4.039943 20.31218       3.835389 22.79487       5.830739 18.41866       5.092103 40.33769 6.123849 36.32381 5.959135 4.013885       8.544754 
1 1 1 3   42 6  o 43.41993 4.136715 24.60681       4.324213 26.58550       6.294951 22.83886       5.950312 43.55125 6.098293 40.17213 6.284039 3.379116       8.756616 
1 1 1 3   42 7  o 14.93682 6.195990 1.692473       3.700024 -1.442237      6.260343 3.375290       4.586886 15.75870 7.220161 17.55223 7.040825 -1.793537      10.08484 
1 1 1 3   42 8  o 19.88119 7.393181 5.516207       4.781896 0.000000       0.000000 5.516207       4.781896 ?        ?        19.88119 7.393181 0.000000       7.393181 
1 1 1 3   42 9  o 25.98356 5.867158 9.672759       3.626836 10.20853       5.146310 9.144082       5.112102 25.46922 7.666406 24.12934 7.704927 1.339888       10.86921 
1 1 1 3   42 10 o 30.39973 5.181252 12.80068       3.700806 11.05969       5.123312 14.70029       5.351608 26.44172 7.567408 30.94539 7.227993 -4.503677      10.46468 
1 1 1 3   42 11 o 28.40891 5.966630 11.71352       3.999018 17.81050       7.328471 9.128193       4.772143 31.93558 9.021212 23.99381 7.414460 7.941771       11.67718 
1 1 1 3   42 12 o 13.40236 5.863275 0.4405625      3.640346 -7.034275      6.942042 3.275649       4.275329 13.74904 6.666284 16.79801 6.776762 -3.048970      9.505990 
1 1 1 3   42 13 o 22.64597 6.739994 7.998565       3.994764 5.292115       7.464210 9.084931       4.729030 19.96774 8.564961 23.63625 7.393281 -3.668512      11.31456 
1 1 1 3   42 14 o 12.14509 5.574502 -1.225405      3.754474 7.804045       7.911388 -3.850058      4.265382 21.48535 8.997535 11.41518 5.454423 10.07017       10.52171 
1 1 1 3   42 15 o 14.52693 6.410647 0.9328428      4.438908 3.550711       7.652975 -0.3944028     5.449191 18.50999 8.277704 14.70447 6.736787 3.805519       10.67261 
1 1 1 3   42 16 o 33.62696 5.729669 16.74217       4.527018 26.29494       9.693707 14.07765       5.119588 34.47162 10.55209 29.17210 7.236710 5.299520       12.79518 
1 1 1 3   42 17 o 13.20825 5.884721 0.3584146      3.830026 5.738699       8.512420 -1.007236      4.288645 19.51970 8.729629 12.82989 5.913911 6.689802       10.54423 
1 1 1 3   42 18 o 25.63577 6.697248 10.79942       4.229094 25.66075       9.493054 7.119678       4.723739 33.08511 10.49213 20.22109 7.377473 12.86402       12.82622 
1 1 1 3   42 19 o 21.96587 6.872317 8.249366       4.085819 18.78763       8.881966 5.420781       4.601603 27.50921 10.10339 18.20454 7.131217 9.304674       12.36660 
1 1 1 3   43 0  o 16.57945 6.131435 3.481712       3.280682 -2.146515      4.913194 8.010206       4.407122 13.60332 6.291523 22.97958 7.129331 -9.376257      9.508450 
1 1 1 3   43 1  f 23.05546 6.344055 7.811070       3.675925 3.541555       5.130222 12.31584       5.269669 18.01486 7.365628 28.14154 7.534664 -10.12669      10.53678 
1 1 1 3   43 2  o 25.58271 5.892541 9.398701       3.597779 9.351201       5.320026 9.438733       4.883953 24.28825 7.869906 24.61785 7.480949 -0.3296051     10.85818 
1 1 1 3   43 3  o 12.16438 5.292819 0.1778440      2.931980 -1.361845      4.129356 1.743290       4.163751 12.89725 5.892050 15.41632 6.496015 -2.519069      8.770089 
1 1 1 3   43 4  o 20.95900 7.226420 6.606207       4.476129 0.000000       0.000000 6.606207       4.476129 ?        ?        20.95900 7.226420 0.000000       7.226420 
1 1 1 3   43 5  o 28.48386 6.911505 12.33200       4.748034 0.000000       0.000000 12.33200       4.748034 ?        ?        28.48386 6.911505 0.000000       6.911505 
1 1 1 3   43 6  o 13.52853 5.990227 0.5117364E-01  3.907377 0.6191446E-01  7.191618 0.4667491E-01  4.654280 17.11240 7.801606 14.51904 6.476718 2.593367       10.13967 
1 1 1 3   43 7  o 10.40547 4.860291 -2.113334      3.046586 1.133529       4.478856 -4.909312      4.156253 15.08589 6.553062 10.86444 5.240925 4.221450       8.391062 
1 1 1 3   43 8  o 9.636925 4.610257 -3.364707      3.066918 -2.613283      4.667603 -3.935595      4.068426 12.77894 5.984181 11.15975 5.330905 1.619186       8.014298 
1 1 1 3   43 9  o 23.44830 5.970804 8.173723       3.420364 8.713559       4.903694 7.662237       4.773197 23.08625 7.560909 21.82405 7.464514 1.262199       10.62480 
1 1 1 3   43 10 o 9.952413 4.702657 -2.539750      2.999323 -3.919629      4.113807 -0.9738901     4.382276 11.16678 5.341405 13.25302 6.060351 -2.086238      8.078271 
1 1 1 3   43 11 o 31.09633 6.013447 14.39178       4.392058 16.36667       8.370336 13.64145       5.159378 28.04008 9.868381 28.93264 7.314781 -0.8925610     12.28377 
1 1 1 3   43 12 o 24.11069 6.875854 9.391680       4.237039 11.22591       8.491214 8.783550       4.889226 23.48072 9.522360 22.72015 7.554522 0.7605705      12.15509 
1 1 1 3   43 13 o 26.46228 7.381226 11.80285       4.938861 18.92787       8.606277 8.304232       6.030736 29.47468 10.02438 21.53026 8.236469 7.944426       12.97411 
1 1 1 3   43 14 o 15.57998 6.429317 2.810953       3.955701 15.15157       7.746393 -1.542178      4.600784 26.66697 9.483308 12.94106 6.020562 13.72591       11.23300 
1 1 1 3   43 15 o 21.71176 6.887141 7.895810       4.090082 9.667379       7.754288 7.212952       4.814242 21.79713 8.998970 20.40739 7.447446 1.389736       11.68101 
1 1 1 3   43 16 o 20.65236 6.767799 7.140414       3.928639 8.446356       7.675021 6.676753       4.573179 20.74448 8.784200 19.73101 7.249216 1.013472       11.38917 
1 1 1 3   44 0  o 21.41169 6.105955 6.862558       3.341361 7.718374       5.117002 6.226370       4.411824 21.84013 7.713277 20.14310 7.157469 1.697031       10.52255 
1 1 1 3   44 1  o 21.03699 6.444022 6.738393       3.614367 8.522816       6.767688 6.026342       4.275106 22.39863 8.683994 19.87756 7.047429 2.521072       11.18383 
1 1 1 3   44 2  o 9.868903 4.735551 -3.693776      3.290330 -5.811403      5.683705 -2.626370      4.035261 12.62989 6.101483 11.77444 5.529789 0.8554497      8.234481 
1 1 1 3   44 3  o 19.96728 6.375082 6.043115       3.499814 4.246373       4.781030 8.117451       5.137101 17.94873 7.192251 22.18589 7.736630 -4.237164      10.56333 
1 1 1 3   44 4  o 19.78445 6.291837 5.928200       3.411724 8.078175       4.720518 3.576946       4.936540 22.24514 7.423706 17.36114 7.175070 4.884005       10.32439 
1 1 1 3   44 5  o 14.04063 6.107319 0.9382582      3.901302 7.410966       7.005715 -1.971249      4.696986 21.17903 8.626971 13.04788 6.074614 8.131150       10.55109 
1 1 1 3   44 6  o 11.80879 5.382057 -0.9330270     3.419321 -3.913576      4.719617 2.359778       4.960685 12.04435 5.750239 16.24193 6.974864 -4.197577      9.039579 
1 1 1 3   44 7  o 29.56330 5.322237 12.55692       3.693289 14.88347       5.771961 10.94396       4.805932 29.56543 7.871967 25.73769 7.317350 3.827744       10.74763 
1 1 1 3   44 8  o 14.43245 6.218246 1.426070       3.967597 9.187787       7.167256 -2.003382      4.764161 22.26410 8.844254 13.01522 6.078804 9.248881       10.73185 
1 1 1 3   44 9  o 16.80692 6.531201 3.898750       3.834949 5.712779       7.835503 3.327330       4.397670 19.72680 8.616684 16.51105 6.792716 3.215752       10.97216 
1 1 1 3   44 10 o 18.33616 7.345690 5.027700       4.985933 11.64138       8.027625 0.8740956      6.361770 23.63340 9.369097 16.09947 7.338992 7.533934       11.90129 
1 1 1 3   44 11 o 19.13637 7.239197 5.946457       4.626460 6.268675       7.487149 5.747434       5.884277 19.70103 8.515392 19.05161 7.849667 0.6494217      11.58142 
1 1 1 3   44 12 o 21.57859 7.021379 7.864942       4.232177 10.00350       8.297928 7.113055       4.920233 21.94955 9.204844 20.28828 7.507789 1.661268       11.87839 
1 1 1 3   44 13 o 16.74748 6.456242 4.107761       3.725145 6.748522       7.513829 3.247164       4.289403 19.74206 8.531831 16.08426 6.671540 3.657799       10.83059 
1 1 1 3   45 0  o 11.75996 5.289856 -0.4213921     3.175750 3.620655       4.607678 -4.079040      4.383111 16.97183 6.964482 11.41731 5.475150 5.554519       8.858966 
1 1 1 3   45 1  f 27.60104 6.505069 11.87788       4.303265 15.14909       5.417644 6.285916       7.083347 30.29392 7.402609 20.01322 8.454959 10.28070       11.23766 
1 1 1 3   45 2  o 41.26417 4.713678 23.63886       4.654970 24.58975       6.517146 22.64848       6.651142 39.35932 7.053855 36.99725 7.630650 2.362072       10.39152 
1 1 1 3   45 3  o 16.64010 6.499023 3.769409       3.812496 -3.912103      6.785313 7.313308       4.608792 14.32619 6.854607 20.94705 7.326429 -6.620857      10.03306 
1 1 1 3   45 4  o 50.30377 3.772915 33.62358       4.591323 49.69848       7.479468 23.90352       5.816091 59.00050 5.257105 39.73805 6.209066 19.26244       8.135702 
1 1 1 3   45 5  o 37.98052 4.278914 19.70988       3.891483 23.21000       6.147249 17.36921       5.027008 38.32990 6.831786 33.55958 6.380041 4.770317       9.347631 
1 1 1 3   45 6  o 19.59381 6.386913 6.066040       3.501067 4.018333       5.143362 7.834036       4.779185 17.41578 7.271223 21.35256 7.461165 -3.936779      10.41824 
1 1 1 3   45 7  o 22.07549 6.769203 8.003970       3.987032 10.42587       5.581603 5.480711       5.697204 23.80003 8.073176 18.79098 7.731171 5.009056       11.17798 
1 1 1 3   45 8  o 12.30383 5.594918 -0.5395589     3.668716 2.698554       4.431122 -7.597160      6.541785 15.76481 6.674992 12.65442 6.207780 3.110397       9.115484 
1 1 1 4   0  0  o 299.1324 6.434688 1092.157       46.85686 1092.157       46.85686 1092.157       46.85686 299.1324 6.434688 299.1324 6.434688 0.000000       0.000000 
1 1 1 4   0  1  o 198.8289 3.794136 482.2711       18.36841 482.2711       18.36841 482.2711       18.36841 198.8289 3.794136 198.8289 3.794136 0.000000       0.000000 
1 1 1 4   0  2  f 462.6452 7.814131 2611.556       88.04109 2611.556       88.04109 2611.556       88.04109 462.6452 7.814131 462.6452 7.814131 0.000000       0.000000 
1 1 1 4   0  3  o 49.26492 2.407900 29.78500       2.874944 29.78500       2.874944 29.78500       2.874944 49.26492 2.407900 49.26492 2.407900 0.000000       0.000000 
1 1 1 4   0  4  f 194.1866 4.613597 460.3273       21.80424 460.3273       21.80424 460.3273       21.80424 194.1866 4.613597 194.1866 4.613597 0.000000       0.000000 
1 1 1 4   0  5  o 348.1441 7.396682 1479.646       62.68872 1479.646       62.68872 1479.646       62.68872 348.1441 7.396682 348.1441 7.396682 0.000000       0.000000 
1 1 1 4   0  6  o 265.3039 5.883703 859.2283       37.99688 859.2283       37.99688 859.2283       37.99688 265.3039 5.883703 265.3039 5.883703 0.000000       0.000000 
1 1 1 4   0  7  o 205.3887 4.856339 515.0209       24.27576 515.0209       24.27576 515.0209       24.27576 205.3887 4.856339 205.3887 4.856339 0.000000       0.000000 
1 1 1 4   0  8  o 296.6845 6.476634 1074.764       46.77490 1074.764       46.77490 1074.764       46.77490 296.6845 6.476634 296.6845 6.476634 0.000000       0.000000 
1 1 1 4   0  9  o 416.1292 12.37286 2121.179       125.2172 2121.179       125.2172 2121.179       125.2172 416.1292 12.37286 416.1292 12.37286 0.000000       0.000000 
1 1 1 4   0  10 o 158.2374 4.186244 305.8213       16.11692 305.8213       16.11692 305.8213       16.11692 158.2374 4.186244 158.2374 4.186244 0.000000       0.000000 
1 1 1 4   0  11 o 68.66023 4.939007 58.34892       8.163603 58.34892       8.163603 58.34892       8.163603 68.66023 4.939007 68.66023 4.939007 0.000000       0.000000 
1 1 1 4   0  12 o 41.12193 4.275433 21.26876       4.168801 21.26876       4.168801 21.26876       4.168801 41.12193 4.275433 41.12193 4.275433 0.000000       0.000000 
1 1 1 4   0  13 o 239.0610 5.531359 697.6937       32.18484 697.6937       32.18484 697.6937       32.18484 239.0610 5.531359 239.0610 5.531359 0.000000       0.000000 
1 1 1 4   0  14 o 56.39378 3.921959 39.31453       5.328854 39.31453       5.328854 39.31453       5.328854 56.39378 3.921959 56.39378 3.921959 0.000000       0.000000 
1 1 1 4   0  15 o 577.2922 11.87909 4070.709       166.9551 4070.709       166.9551 4070.709       166.9551 577.2922 11.87909 577.2922 11.87909 0.000000       0.000000 
1 1 1 4   0  16 o 492.4923 14.55395 2968.507       174.3238 2968.507       174.3238 2968.507       174.3238 492.4923 14.55395 492.4923 14.55395 0.000000       0.000000 
1 1 1 4   0  17 o 44.05635 4.989707 24.55092       5.180014 24.55092       5.180014 24.55092       5.180014 44.05635 4.989707 44.05635 4.989707 0.000000       0.000000 
1 1 1 4   0  18 o 950.7143 19.29127 11069.42       446.5224 11069.42       446.5224 11069.42       446.5224 950.7143 19.29127 950.7143 19.29127 0.000000       0.000000 
1 1 1 4   0  19 o 256.8760 5.950350 805.6256       37.20280 805.6256       37.20280 805.6256       37.20280 256.8760 5.950350 256.8760 5.950350 0.000000       0.000000 
1 1 1 4   0  20 o 338.9955 7.414576 1403.300       61.18531 1403.300       61.18531 1403.300       61.18531 338.9955 7.414576 338.9955 7.414576 0.000000       0.000000 
1 1 1 4   0  21 o 292.7491 6.619028 1046.625       47.16549 1046.625       47.16549 1046.625       47.16549 292.7491 6.619028 292.7491 6.619028 0.000000       0.000000 
1 1 1 4   0  22 o 99.70007 4.262321 121.8267       10.31250 121.8267       10.31250 121.8267       10.31250 99.70007 4.262321 99.70007 4.262321 0.000000       0.000000 
1 1 1 4   0  23 o 353.1164 7.716708 1524.140       66.33116 1524.140       66.33116 1524.140       66.33116 353.1164 7.716708 353.1164 7.716708 0.000000       0.000000 
1 1 1 4   0  24 o 12.77242 8.523585 -2.433760      7.240742 -2.433760      7.240742 -2.433760      7.240742 12.77242 8.523585 12.77242 8.523585 0.000000       0.000000 
1 1 1 4   0  25 o 152.5072 4.594261 284.4526       17.03917 284.4526       17.03917 284.4526       17.03917 152.5072 4.594261 152.5072 4.594261 0.000000       0.000000 
1 1 1 4   0  26 o 51.99571 5.618836 34.13875       6.909302 34.13875       6.909302 34.13875       6.909302 51.99571 5.618836 51.99571 5.618836 0.000000       0.000000 
1 1 1 4   0  27 o 16.82466 9.111922 4.904457       5.229753 4.904457       5.229753 4.904457       5.229753 16.82466 9.111922 16.82466 9.111922 0.000000       0.000000 
1 1 1 4   0  28 o 72.65201 7.024225 66.34296       12.15149 66.34296       12.15149 66.34296       12.15149 72.65201 7.024225 72.65201 7.024225 0.000000       0.000000 
1 1 1 4   0  29 o 13.56701 8.282895 1.952695       5.184092 1.952695       5.184092 1.952695       5.184092 13.56701 8.282895 13.56701 8.282895 0.000000       0.000000 
1 1 1 4   0  30 o 93.28018 4.425634 106.9541       10.00826 106.9541       10.00826 106.9541       10.00826 93.28018 4.425634 93.28018 4.425634 0.000000       0.000000 
1 1 1 4   0  31 o 15.71861 9.101764 3.752943       5.671801 3.752943       5.671801 3.752943       5.671801 15.71861 9.101764 15.71861 9.101764 0.000000       0.000000 
1 1 1 4   0  32 o 12.70494 8.080066 0.5978532      5.477228 0.5978532      5.477228 0.5978532      5.477228 12.70494 8.080066 12.70494 8.080066 0.000000       0.000000 
1 1 1 4   0  33 o 104.6729 4.593754 134.7108       11.66609 134.7108       11.66609 134.7108       11.66609 104.6729 4.593754 104.6729 4.593754 0.000000       0.000000 
1 1 1 4   0  34 o 70.37315 5.012465 61.52694       8.493841 61.52694       8.493841 61.52694       8.493841 70.37315 5.012465 70.37315 5.012465 0.000000       0.000000 
1 1 1 4   0  35 o 74.11575 7.124915 69.47214       12.57773 69.47214       12.57773 69.47214       12.57773 74.11575 7.124915 74.11575 7.124915 0.000000       0.000000 
1 1 1 4   0  36 o 21.19023 10.27754 8.244422       6.205233 8.244422       6.205233 8.244422       6.205233 21.19023 10.27754 21.19023 10.27754 0.000000       0.000000 
1 1 1 4   0  37 o 45.74802 7.411686 27.80054       7.612426 27.80054       7.612426 27.80054       7.612426 45.74802 7.411686 45.74802 7.411686 0.000000       0.000000 
1 1 1 4   0  38 o 28.10424 10.62189 13.39209       6.817604 13.39209       6.817604 13.39209       6.817604 28.10424 10.62189 28.10424 10.62189 0.000000       0.000000 
1 1 1 4   0  39 o 47.53611 11.26464 33.14596       11.32862 33.14596       11.32862 33.14596       11.32862 47.53611 11.26464 47.53611 11.26464 0.000000       0.000000 
1 1 1 4   0  40 o 47.21814 6.516649 29.40359       7.092094 29.40359       7.092094 29.40359       7.092094 47.21814 6.516649 47.21814 6.516649 0.000000       0.000000 
1 1 1 4   0  41 o 55.84539 5.834938 40.38203       7.724014 40.38203       7.724014 40.38203       7.724014 55.84539 5.834938 55.84539 5.834938 0.000000       0.000000 
1 1 1 4   0  42 o 10.64858 7.138940 -1.345195      5.183667 -1.345195      5.183667 -1.345195      5.183667 10.64858 7.138940 10.64858 7.138940 0.000000       0.000000 
1 1 1 4   0  43 o 26.45290 9.819082 12.62617       5.877421 12.62617       5.877421 12.62617       5.877421 26.45290 9.819082 26.45290 9.819082 0.000000       0.000000 
1 1 1 4   0  44 o 11.00890 7.292160 -0.1475133     5.136334 -0.1475133     5.136334 -0.1475133     5.136334 11.00890 7.292160 11.00890 7.292160 0.000000       0.000000 
1 1 1 4   0  45 o 51.37736 8.024422 39.64264       9.316090 39.64264       9.316090 39.64264       9.316090 51.37736 8.024422 51.37736 8.024422 0.000000       0.000000 
1 1 1 4   0  46 o 19.60474 9.952866 9.454157       5.939955 9.454157       5.939955 9.454157       5.939955 19.60474 9.952866 19.60474 9.952866 0.000000       0.000000 
1 1 1 4   0  47 o 12.48938 7.937872 3.042902       5.276165 3.042902       5.276165 3.042902       5.276165 12.48938 7.937872 12.48938 7.937872 0.000000       0.000000 
1 1 1 4   0  48 o 9.760373 6.703643 -0.6913317     5.170547 -0.6913317     5.170547 -0.6913317     5.170547 9.760373 6.703643 9.760373 6.703643 0.000000       0.000000 
1 1 1 4   0  49 o 7.159756 5.193042 -7.028756      4.945137 -7.028756      4.945137 -7.028756      4.945137 7.159756 5.193042 7.159756 5.193042 0.000000       0.000000 
1 1 1 4   1  0  o 476.8903 6.204954 2772.825       72.10960 2729.767       112.7357 2802.639       93.80970 472.9473 9.781666 479.3432 8.030915 -6.395966      12.65609 
1 1 1 4   1  1  o 631.8274 6.861163 4867.942       105.6409 4847.040       139.3115 4896.226       162.0516 630.2838 9.070154 633.3254 10.50002 -3.041626      13.87509 
1 1 1 4   1  2  o 302.7050 3.474419 1116.698       25.62937 1105.314       38.87730 1125.448       34.08457 301.1169 5.298158 303.8649 4.603003 -2.748047      7.018412 
1 1 1 4   1  3  o 339.0023 4.544977 1400.791       37.54659 1423.792       48.96416 1367.963       58.49609 341.7314 5.879730 334.9138 7.167336 6.817627       9.270487 
1 1 1 4   1  4  o 703.7307 10.09801 6046.024       173.1722 6276.215       251.1757 5837.476       239.0770 716.2802 14.38993 690.8264 14.20145 25.45374       20.21760 
1 1 1 4   1  5  o 111.2018 2.757281 150.6950       7.471861 149.9735       9.169049 152.1211       12.89138 110.8787 3.397449 111.6082 4.750744 -0.7295837     5.840568 
1 1 1 4   1  6  o 848.7568 12.14154 8808.183       251.1268 8924.601       358.3548 8695.843       352.0237 852.8401 17.24287 841.8676 17.15900 10.97247       24.32587 
1 1 1 4   1  7  o 331.7001 5.016536 1341.521       40.54952 1361.723       57.89075 1322.062       56.81572 334.0719 7.111039 329.1728 7.082859 4.899170       10.03662 
1 1 1 4   1  8  o 347.7389 6.050487 1475.146       51.27193 1481.777       62.95533 1462.083       88.35737 348.4146 7.414811 345.6201 10.50296 2.794464       12.85658 
1 1 1 4   1  9  o 320.1442 5.631790 1250.220       43.93678 1241.444       75.62428 1254.692       53.98220 318.5127 9.754624 320.6252 6.909028 -2.112427      11.95355 
1 1 1 4   1  10 o 502.2705 8.471632 3081.584       103.6909 3151.818       182.0993 3047.885       126.1375 506.4556 14.77049 499.2043 10.36883 7.251312       18.04661 
1 1 1 4   1  11 o 178.0855 3.175454 386.5466       13.78068 374.6014       19.14632 399.3863       19.85038 175.2271 4.487511 180.9899 4.500683 -5.762817      6.355620 
1 1 1 4   1  12 f 418.4173 7.169837 2136.073       73.10633 2170.036       90.43363 2072.015       124.1960 421.5853 8.802548 411.3546 12.40371 10.23074       15.20976 
1 1 1 4   1  13 o 181.0578 3.239962 399.5210       14.29531 402.4953       20.26272 396.5737       20.17082 181.6522 4.581077 180.3096 4.594333 1.342606       6.488001 
1 1 1 4   1  14 o 1083.699 15.47355 14372.71       408.6342 14471.87       580.6068 14275.37       575.2230 1085.014 21.95891 1077.646 21.90402 7.367554       31.01580 
1 1 1 4   1  15 o 648.1613 10.81546 5129.058       170.8300 5177.561       210.5910 5035.724       292.1277 650.8905 13.27687 640.6949 18.73061 10.19562       22.95890 
1 1 1 4   1  16 o 599.7007 10.04669 4389.773       146.8228 4343.599       178.5036 4486.351       258.1565 596.2781 12.28463 604.9222 17.53097 -8.644104      21.40670 
1 1 1 4   1  17 o 774.2151 12.85950 7326.351       242.6172 7258.395       417.6026 7360.975       298.0847 767.8851 22.34050 775.4316 15.77467 -7.546448      27.34845 
1 1 1 4   1  18 o 43.62902 3.769668 23.37294       3.968603 21.22314       5.622907 25.50682       5.602056 41.32711 5.737853 45.45085 5.148456 -4.123741      7.709057 
1 1 1 4   1  19 o 184.4644 3.420227 414.7173       15.37459 410.8533       21.69695 418.6143       21.78925 183.5129 4.855990 185.2404 4.831047 -1.727539      6.849792 
1 1 1 4   1  20 o 396.8094 5.983660 1920.476       57.86087 1980.199       83.44292 1865.164       80.30267 402.7249 8.502466 390.8588 8.430900 11.86606       11.97381 
1 1 1 4   1  21 o 470.5032 6.972415 2701.891       79.94328 2694.189       112.8661 2709.645       113.2486 469.4337 9.866274 470.7774 9.871456 -1.343719      13.95668 
1 1 1 4   1  22 o 326.8778 5.095647 1303.431       40.59018 1254.782       56.02554 1357.178       58.88770 320.5347 7.172573 333.3484 7.249202 -12.81372      10.19788 
1 1 1 4   1  23 o 52.83742 4.401053 34.29099       5.615343 31.79687       9.640577 35.57167       6.908195 50.35452 8.133611 53.72194 5.347827 -3.367420      9.734212 
1 1 1 4   1  24 o 242.3440 4.719928 716.8195       27.87428 732.3616       34.52165 687.7051       47.24895 244.8525 5.785634 236.8258 8.199410 8.026703       10.03513 
1 1 1 4   1  25 o 197.2872 3.616912 474.8540       17.38894 487.8736       24.89560 462.4514       24.29860 199.7805 5.117893 194.5007 5.131019 5.279831       7.247081 
1 1 1 4   1  26 o 142.1210 3.169868 246.4053       10.97831 245.4755       15.41108 247.3633       15.64287 141.6978 4.468659 142.2367 4.518767 -0.5389099     6.355169 
1 1 1 4   1  27 o 46.70296 4.007510 26.83154       4.516898 24.11937       6.170935 29.96167       6.629394 43.99591 5.904700 49.16028 5.635562 -5.164368      8.162416 
1 1 1 4   1  28 o 54.87700 4.281656 37.02393       5.680537 40.86198       6.900486 28.95472       10.00553 57.58442 4.965902 47.69349 8.937150 9.890930       10.22413 
1 1 1 4   1  29 o 152.3229 3.851363 283.6748       14.28458 304.9879       26.00847 274.4686       17.09351 157.3867 6.797291 149.7051 4.691317 7.681549       8.259032 
1 1 1 4   1  30 o 58.80006 3.620401 42.40437       5.162494 37.67564       7.112901 47.66821       7.504573 55.18240 5.356758 62.18428 4.994290 -7.001881      7.323782 
1 1 1 4   1  31 o 41.49166 4.741446 21.36231       4.708135 18.15322       6.626178 24.63441       6.690911 37.70039 7.476563 44.30294 6.381298 -6.602554      9.829545 
1 1 1 4   1  32 o 30.04895 5.979801 11.49612       4.224708 5.944481       5.631555 18.64199       6.389185 23.15735 8.098716 38.25291 7.115834 -15.09557      10.78074 
1 1 1 4   1  33 o 56.68210 3.886389 39.51673       5.335711 29.06739       7.237002 51.96174       7.897908 48.14251 6.321275 64.85231 5.036938 -16.70980      8.082651 
1 1 1 4   1  34 o 18.02500 7.098960 2.344507       4.581235 1.947976       7.357337 2.595612       5.854764 21.29939 8.776752 19.96134 7.972406 1.338055       11.85709 
1 1 1 4   1  35 o 156.1527 3.947523 299.3025       15.00935 302.0189       18.55687 294.1632       25.52425 156.5606 4.869837 153.6832 6.832467 2.877441       8.390347 
1 1 1 4   1  36 o 61.97131 3.862986 47.32568       5.804767 58.81973       8.446982 37.04062       7.990394 68.85409 5.069813 54.29325 6.147326 14.56084       7.968225 
1 1 1 4   1  37 o 151.4664 3.444033 281.6376       12.71217 275.6963       17.85312 287.7477       18.10496 149.2066 4.916811 152.4546 4.879560 -3.247955      6.927131 
1 1 1 4   1  38 o 23.92597 7.180192 7.369995       4.519257 11.86555       6.686126 3.588553       6.132137 29.92453 8.669909 20.88935 8.217386 9.035181       11.94541 
1 1 1 4   1  39 o 16.45688 6.970109 0.6068075      4.834022 2.137249       5.880896 -2.581429      8.488099 19.16755 7.867085 19.32027 8.672884 -0.1527195     11.70940 
1 1 1 4   1  40 o 56.59291 4.818397 40.56300       6.581955 22.27190       10.89000 51.09057       8.261748 38.83213 11.00639 63.25634 5.411525 -24.42421      12.26479 
1 1 1 4   1  41 o 45.17673 4.479612 26.03200       4.866760 26.55121       6.664504 25.43877       7.123695 44.70087 6.291971 43.33984 6.982182 1.361034       9.398923 
1 1 1 4   1  42 o 22.52750 6.858501 7.069030       4.102453 9.442708       5.781785 4.662290       5.821912 25.51886 8.198723 20.43847 8.016809 5.080389       11.46683 
1 1 1 4   1  43 o 24.09130 6.687728 8.419067       4.064988 8.019149       5.704619 8.831608       5.793942 23.23550 8.149246 24.14266 8.224778 -0.9071598     11.57831 
1 1 1 4   1  44 o 25.64137 7.064387 10.15218       4.554879 5.118215       6.761897 14.33372       6.162843 20.05362 8.352098 29.45476 8.255999 -9.401142      11.74389 
1 1 1 4   1  45 o 27.58421 6.888919 12.20604       4.616576 15.14918       6.011061 7.973506       7.208515 29.33442 8.128450 21.23453 8.712087 8.099886       11.91521 
1 1 1 4   1  46 o 15.85386 6.428085 3.401990       3.868515 1.318688       5.489841 5.456797       5.452167 15.27144 6.904352 18.28744 7.547495 -3.016000      10.22911 
1 1 1 4   1  47 o 33.18183 6.109284 17.96085       4.758025 13.89003       7.759182 20.41408       6.023439 22.85622 9.161187 33.01161 7.639094 -10.15539      11.92825 
1 1 1 4   1  48 o 15.28774 6.636683 3.904804       4.588099 7.896172       5.432343 -6.027095      8.569242 18.44276 7.564418 13.26699 6.612573 5.175771       10.04722 
1 1 1 4   1  49 o 14.97778 6.472921 4.334874       4.324976 -2.292902      8.568376 6.600852       5.010054 13.44263 6.685750 16.66179 7.077993 -3.219158      9.736386 
1 1 1 4   2  0  o 176.9279 2.470073 381.4549       10.64982 394.9585       15.31888 368.8235       14.81595 180.0232 3.491907 173.9650 3.494873 6.058182       4.940400 
1 1 1 4   2  1  o 734.1580 8.580217 6575.483       153.5055 6837.968       222.9832 6339.025       211.6398 748.1862 12.23000 720.3988 12.05558 27.78735       17.17294 
1 1 1 4   2  2  o 137.4627 2.601045 230.2646       8.713018 240.1945       17.30814 226.8941       10.08393 140.2804 5.071453 136.4500 3.032636 3.830475       5.909020 
1 1 1 4   2  3  o 285.7336 4.383639 995.1366       30.52335 920.9103       41.15579 1085.876       45.50406 274.8237 6.145266 298.4215 6.257256 -23.59781      8.770265 
1 1 1 4   2  4  o 552.5178 11.33843 3729.052       152.6635 3931.495       223.7110 3552.609       208.8518 566.3386 16.22643 538.3923 15.93608 27.94629       22.74326 
1 1 1 4   2  5  o 141.5418 2.686378 244.1424       9.265905 236.0431       12.91675 252.7289       13.29957 139.1109 3.813871 143.9481 3.794674 -4.837204      5.380071 
1 1 1 4   2  6  o 205.5904 3.412014 515.1526       17.09424 524.1105       24.38990 506.5039       23.96550 207.3406 4.827138 203.8282 4.824874 3.512314       6.825004 
1 1 1 4   2  7  o 263.6419 4.786405 847.4586       30.75105 832.5135       37.19956 879.7112       54.64762 261.2651 5.842791 268.3022 8.368398 -7.037109      10.20629 
1 1 1 4   2  8  o 515.3519 8.664728 3244.135       108.8166 3266.903       189.1324 3232.868       133.0422 515.6422 15.06771 514.1345 10.61883 1.507690       18.43354 
1 1 1 4   2  9  o 310.8939 5.489600 1178.968       41.59000 1177.858       71.67749 1179.531       51.06533 310.2694 9.491148 310.8825 6.740526 -0.6131287     11.64116 
1 1 1 4   2  10 o 598.9854 8.670808 4383.020       126.5645 4400.462       179.4486 4365.756       178.5333 599.3884 12.28558 597.0236 12.27133 2.364807       17.36436 
1 1 1 4   2  11 o 71.75618 2.724671 62.84196       4.755759 64.62638       7.889798 61.82362       5.960251 72.66852 4.477104 71.13529 3.448571 1.533226       5.651292 
1 1 1 4   2  12 o 310.5236 5.529425 1175.807       41.84182 1194.401       51.66317 1140.359       71.33269 312.9077 6.775305 305.4163 9.596208 7.491394       11.74700 
1 1 1 4   2  13 o 555.3723 9.329803 3765.060       126.2678 3779.530       154.9832 3736.494       217.7576 556.1824 11.43487 552.0074 16.20551 4.174988       19.83368 
1 1 1 4   2  14 o 506.3336 8.553921 3127.914       105.5451 3136.386       129.5403 3111.183       182.0406 506.8500 10.48792 504.0927 14.83523 2.757324       18.16812 
1 1 1 4   2  15 o 239.6386 4.535332 699.9578       26.48512 702.8272       32.53835 694.3240       45.59229 240.1081 5.560997 238.4596 7.856583 1.648438       9.625517 
1 1 1 4   2  16 o 768.6168 12.76666 7218.891       239.1240 6865.253       400.4140 7414.925       298.1231 747.1309 22.01661 778.4091 15.71635 -31.27820      27.05059 
1 1 1 4   2  17 o 631.1699 9.141376 4861.737       140.6028 4689.073       194.1355 5052.224       203.9090 619.3772 12.86215 642.8899 13.01558 -23.51270      18.29865 
1 1 1 4   2  18 f 484.0940 8.244760 2859.505       97.26214 2832.981       167.7955 2872.926       119.3594 480.9339 14.33322 485.0543 10.09788 -4.120361      17.53306 
1 1 1 4   2  19 o 147.6230 3.087993 265.5914       11.10878 262.8115       15.65530 268.4106       15.76566 146.7659 4.382144 148.3232 4.366567 -1.557236      6.186282 
1 1 1 4   2  20 o 538.7141 7.887834 3542.390       103.5505 3552.299       146.7396 3532.562       146.1472 538.9847 11.17210 537.4877 11.15799 1.497009       15.78976 
1 1 1 4   2  21 o 252.9874 4.187872 780.3232       25.81834 790.9302       36.71656 769.9486       36.31209 254.6219 5.917390 251.2212 5.931423 3.400711       8.378382 
1 1 1 4   2  22 o 283.5092 5.244061 980.6022       36.23022 990.4312       62.75132 975.6874       44.37321 284.4245 9.065145 282.7064 6.440938 1.718079       11.12037 
1 1 1 4   2  23 o 355.5450 5.469161 1543.059       47.38615 1521.031       66.37030 1565.964       67.67708 352.6808 7.722463 357.8458 7.760855 -5.164978      10.94839 
1 1 1 4   2  24 o 208.2590 3.713869 529.0293       18.84805 531.7717       26.71549 526.3114       26.59526 208.6199 5.259176 207.5450 5.262672 1.074905       7.440071 
1 1 1 4   2  25 o 259.3403 4.960202 821.4999       31.34769 805.7473       37.96104 855.2716       55.58262 256.6862 6.068753 263.8207 8.657301 -7.134521      10.57254 
1 1 1 4   2  26 o 116.5933 3.073137 165.9416       8.723940 166.3516       12.21171 165.5142       12.46729 116.6341 4.303879 116.3297 4.405862 0.3044128      6.159139 
1 1 1 4   2  27 o 46.76086 4.514078 26.96644       5.079973 24.18420       6.021293 33.83725       9.462290 44.08163 5.741571 51.92861 7.711254 -7.846981      9.614004 
1 1 1 4   2  28 o 43.48343 4.180505 23.31548       4.375326 25.46234       6.045742 20.95453       6.340034 45.25880 5.601062 40.81833 6.598876 4.440475       8.655464 
1 1 1 4   2  29 o 112.5259 3.111070 154.6814       8.522785 146.9292       11.82629 163.0579       12.29334 109.5187 4.440439 115.3906 4.379783 -5.871941      6.236987 
1 1 1 4   2  30 o 46.87522 4.856103 27.19281       5.466864 18.97468       9.772125 30.93644       6.595526 38.36217 10.25568 49.92761 5.512592 -11.56544      11.64335 
1 1 1 4   2  31 o 104.8749 3.161931 134.4677       8.071679 137.0347       11.33853 131.8302       11.49319 105.7045 4.411467 103.6507 4.561390 2.053780       6.345654 
1 1 1 4   2  32 o 114.3008 3.197697 159.7708       8.898068 160.9800       12.44269 158.5052       12.72975 114.5342 4.466592 113.6234 4.606995 0.9108810      6.416763 
1 1 1 4   2  33 o 23.92822 6.904908 7.239039       4.248785 2.372420       5.971722 12.22806       6.046352 19.94368 8.022043 30.79726 7.989222 -10.85358      11.32170 
1 1 1 4   2  34 o 197.6502 4.327928 479.2944       20.84555 480.2022       35.30528 478.8085       25.82825 196.4161 7.389272 197.1085 5.382204 -0.6924286     9.141633 
1 1 1 4   2  35 o 144.5251 3.387861 255.7810       11.93177 253.5841       16.75185 258.0432       16.99902 143.4653 4.798341 144.7130 4.827124 -1.247635      6.806262 
1 1 1 4   2  36 o 25.02304 7.474315 7.957685       4.905773 12.18377       5.939637 -1.113077      8.701867 30.56874 7.912583 20.82954 9.089805 9.739197       12.05129 
1 1 1 4   2  37 o 92.80425 3.358943 105.8329       7.583849 108.2522       10.62066 103.3159       10.83286 93.49343 4.676437 91.26311 4.888767 2.230324       6.765287 
1 1 1 4   2  38 o 77.45280 3.990967 74.23285       7.507310 76.82352       9.154176 68.91167       13.11951 78.52784 4.806679 73.23431 7.455178 5.293526       8.870392 
1 1 1 4   2  39 o 122.3705 3.385745 184.8536       10.08671 193.0714       14.27827 176.6669       14.25128 124.3067 4.722102 118.7651 4.934875 5.541573       6.830171 
1 1 1 4   2  40 o 26.06818 7.543921 9.196872       5.064883 12.66654       9.525568 7.829280       5.980330 30.34357 10.53789 24.59303 8.356386 5.750536       13.44903 
1 1 1 4   2  41 f 43.85334 4.653940 24.63968       4.897628 33.68743       6.957057 15.75021       6.895933 50.75177 5.724996 33.12553 8.500869 17.62623       10.24892 
1 1 1 4   2  42 o 17.25811 6.587029 3.239475       3.851397 5.119992       5.178254 0.9112854      5.761744 20.43707 7.674532 17.25981 7.465145 3.177269       10.70639 
1 1 1 4   2  43 o 21.82424 6.846790 6.877006       4.052699 13.07969       5.840970 1.118925       5.627739 29.17033 7.985168 16.84987 7.332170 12.32046       10.84083 
1 1 1 4   2  44 o 17.25915 6.814414 3.615665       4.230815 4.497021       6.976121 3.102896       5.321074 19.67187 8.354217 17.57820 7.371332 2.093668       11.14134 
1 1 1 4   2  45 o 16.46732 6.515103 3.578997       3.874553 2.064067       5.359598 5.237436       5.607710 16.16321 7.091524 18.79870 7.695151 -2.635496      10.46447 
1 1 1 4   2  46 o 19.45210 7.011573 6.495833       4.249731 8.060498       5.471441 4.116488       6.747140 20.70386 7.863274 17.62824 7.834901 3.075617       11.10030 
1 1 1 4   2  47 o 13.75012 5.923858 1.974247       3.600340 3.165821       5.247725 0.9145931      4.948719 15.65354 6.936035 14.01581 6.420790 1.637733       9.451725 
1 1 1 4   2  48 o 9.392567 4.631035 -5.077490      3.793848 -9.451560      6.887133 -3.171966      4.545722 11.41596 5.725152 11.09230 5.381954 0.3236599      7.857657 
1 1 1 4   2  49 o 14.22567 5.996545 3.524966       3.550201 2.798704       5.245677 4.138769       4.822465 14.03686 6.495155 14.80726 6.599814 -0.7703991     9.259837 
1 1 1 4   3  0  o 248.3293 3.188552 751.5155       19.29556 745.8124       27.19501 757.2973       27.38205 247.3635 4.511465 249.2608 4.507915 -1.897385      6.377665 
1 1 1 4   3  1  o 877.0873 11.20228 9394.026       239.4338 9364.174       308.2094 9439.465       380.2465 875.0507 14.45362 877.7358 17.77728 -2.685120      22.91154 
1 1 1 4   3  2  f 523.8210 7.598799 3346.803       96.99826 3396.734       138.3634 3298.550       136.0191 527.4340 10.76507 519.7579 10.73898 7.676147       15.20567 
1 1 1 4   3  3  o 1352.235 19.28895 22439.29       635.6190 22311.97       731.0837 22833.56       1286.488 1346.797 22.27557 1348.637 39.18638 -1.839722      45.07520 
1 1 1 4   3  4  o 464.7780 6.068582 2634.075       68.73357 2568.493       87.23655 2741.436       111.6158 458.8416 7.801887 473.8780 9.665476 -15.03641      12.42139 
1 1 1 4   3  5  o 444.0781 7.529012 2405.956       81.47671 2479.654       144.3370 2371.490       98.70697 450.0371 13.17531 440.7460 9.190166 9.291138       16.06388 
1 1 1 4   3  6  o 565.6379 11.59793 3911.998       159.8656 4008.696       229.3472 3820.613       222.9565 571.3380 16.48993 557.7809 16.42077 13.55701       23.27143 
1 1 1 4   3  7  o 72.47018 2.947047 64.11452       5.193684 62.19203       7.211033 66.18680       7.486676 71.30338 4.168207 73.56365 4.193654 -2.260269      5.912755 
1 1 1 4   3  8  o 126.2529 2.599966 194.2624       7.999173 192.9178       11.24333 195.6406       11.38304 125.7472 3.673044 126.6314 3.692708 -0.8841400     5.208392 
1 1 1 4   3  9  o 153.7391 2.886503 288.0739       10.81415 293.1796       15.39624 283.1021       15.19282 155.0189 4.079165 152.3287 4.096520 2.690262       5.781096 
1 1 1 4   3  10 o 168.9984 3.061352 348.1052       12.60759 346.2987       17.76494 349.9384       17.89542 168.4768 4.330595 169.3600 4.339632 -0.8831940     6.130780 
1 1 1 4   3  11 o 136.8295 2.762918 228.1732       9.212636 231.1393       13.07363 225.2476       12.98410 137.6452 3.901551 135.8771 3.925408 1.768112       5.534522 
1 1 1 4   3  12 o 523.2479 8.804464 3342.299       112.2656 3387.167       195.7141 3320.295       137.0561 525.5248 15.29873 521.2748 10.78935 4.250000       18.72061 
1 1 1 4   3  13 o 668.2593 13.64844 5461.753       222.2615 5461.753       222.2615 0.000000       0.000000 668.2593 13.64844 ?        ?        0.000000       13.64844 
1 1 1 4   3  14 o 417.0275 7.153802 2120.946       72.70055 2144.585       89.74126 2075.812       124.0044 419.2485 8.783843 412.0112 12.36471 7.237244       15.16713 
1 1 1 4   3  15 o 848.2180 14.05185 8795.940       290.4539 8904.068       507.5050 8743.271       354.1981 850.1580 24.52215 844.9675 17.20165 5.190491       29.95384 
1 1 1 4   3  16 o 364.8507 5.525291 1622.828       49.12544 1619.450       69.36006 1626.227       69.58822 364.3721 7.811388 365.1332 7.820748 -0.7610474     11.05359 
1 1 1 4   3  17 o 248.8113 4.072880 754.5462       24.69493 764.5749       35.14709 744.7682       34.70491 250.4191 5.759515 247.1541 5.762183 3.264954       8.147071 
1 1 1 4   3  18 o 194.2505 4.050792 459.9216       19.17513 447.6590       33.30838 466.0000       23.45088 191.4388 7.152398 195.4514 4.927547 -4.012573      8.685477 
1 1 1 4   3  19 o 265.8633 4.307008 861.6316       27.90423 844.0635       39.00294 880.0528       39.93877 263.0789 6.083804 268.6283 6.101082 -5.549347      8.616024 
1 1 1 4   3  20 o 303.2268 4.778811 1121.071       35.31210 1136.361       50.28663 1106.197       49.59819 305.1848 6.761662 301.1073 6.759406 4.077576       9.560839 
1 1 1 4   3  21 o 347.2742 6.156710 1471.481       52.10234 1476.868       89.88393 1468.755       63.94050 347.2706 10.63384 346.8295 7.565260 0.4410400      13.05035 
1 1 1 4   3  22 o 400.7020 6.053320 1959.799       59.10868 2007.365       84.85424 1914.962       82.38503 405.1747 8.593996 395.7476 8.542675 9.427032       12.11751 
1 1 1 4   3  23 o 108.0027 2.992967 142.3153       7.869623 137.4455       11.00392 147.4136       11.25913 106.0634 4.266115 109.8517 4.213740 -3.788269      5.996278 
1 1 1 4   3  24 o 329.1606 5.142123 1322.939       41.24644 1369.469       59.49325 1279.874       57.23482 334.5411 7.297634 323.4194 7.262032 11.12173       10.29527 
1 1 1 4   3  25 o 181.7302 3.993819 403.0580       17.68690 391.2248       21.28686 429.4417       31.78543 178.9041 4.887224 187.1430 6.982014 -8.238876      8.522528 
1 1 1 4   3  26 o 75.01400 3.624414 68.83483       6.605858 71.36215       8.147853 63.98715       11.28445 76.31200 4.400069 71.98976 6.502435 4.322243       7.851259 
1 1 1 4   3  27 o 72.45200 3.210957 64.18050       5.655105 63.54865       7.841195 64.86537       8.163597 71.97469 4.493015 72.70416 4.631806 -0.7294769     6.452969 
1 1 1 4   3  28 o 92.30126 3.094543 104.0861       6.950655 98.20924       9.583508 110.6081       10.09592 89.52798 4.406217 95.02821 4.371416 -5.500229      6.206772 
1 1 1 4   3  29 o 91.42868 3.119422 102.1610       6.939947 101.9940       9.629319 102.3414       10.01093 91.22460 4.344073 91.35937 4.510558 -0.1347656     6.262277 
1 1 1 4   3  30 o 129.8646 3.764721 206.2987       11.90148 215.8126       21.59690 202.1494       14.26256 132.2675 6.722470 128.4321 4.564348 3.835373       8.125569 
1 1 1 4   3  31 o 66.41598 3.453660 54.05182       5.570494 56.39343       7.752719 51.55267       8.009278 67.67953 4.730462 64.63444 5.127003 3.045097       6.975918 
1 1 1 4   3  32 o 62.11267 3.589754 47.33624       5.410369 44.58250       7.265148 50.76484       8.106668 60.07043 5.008574 64.08813 5.236339 -4.017696      7.246037 
1 1 1 4   3  33 o 56.73726 4.311873 39.68130       5.917061 45.49248       9.439873 35.92048       7.594080 60.35518 6.521685 53.68352 5.902193 6.671658       8.795922 
1 1 1 4   3  34 o 184.0548 3.658878 414.8336       16.41085 406.2798       22.75603 424.1032       23.68897 181.6337 5.146384 185.5403 5.244544 -3.906662      7.347823 
1 1 1 4   3  35 o 71.63824 3.552275 63.03092       6.182026 66.88706       8.532063 58.76899       8.969762 73.56998 4.784978 68.80698 5.392542 4.763008       7.209405 
1 1 1 4   3  36 o 128.5760 3.797290 203.1207       11.88485 213.3736       14.65648 183.4339       20.30931 131.5371 4.579395 121.0127 6.915766 10.52442       8.294497 
1 1 1 4   3  37 o 74.12238 3.578846 67.65356       6.445301 68.06078       8.760558 67.17304       9.516337 74.01302 4.884525 73.38310 5.358477 0.6299133      7.250645 
1 1 1 4   3  38 o 90.22144 3.370220 100.2538       7.396734 89.99433       9.899680 113.2195       11.12903 85.00295 4.798642 95.36940 4.804111 -10.36645      6.790173 
1 1 1 4   3  39 f 13.98427 6.196394 -1.105433      4.188209 -1.264086      5.722685 -0.9224409     6.145987 16.37789 7.250753 17.21739 7.572679 -0.8394985     10.48422 
1 1 1 4   3  40 o 34.45591 5.582422 15.44873       4.527052 18.56889       6.401968 12.32809       6.402468 37.08041 7.344730 29.81238 8.435658 7.268036       11.18505 
1 1 1 4   3  41 f 16.77984 7.023182 1.435480       4.816343 -7.269456      8.591042 5.425492       5.816344 16.78706 7.940146 21.55325 8.125035 -4.766191      11.36055 
1 1 1 4   3  42 o 15.10427 6.299508 1.290111       3.854527 0.5353835      5.212337 2.200938       5.726054 16.29142 7.073074 18.17762 7.636220 -1.886204      10.40866 
1 1 1 4   3  43 o 14.92300 6.325190 1.188196       3.985857 1.853875       5.924191 0.6376364      5.387640 17.64971 7.601317 16.21181 7.111533 1.437899       10.40932 
1 1 1 4   3  44 o 12.55427 5.833825 -2.182352      4.300302 -0.1484304E-01 5.207115 -6.831549      7.626157 15.12061 6.789866 14.63642 7.070043 0.4841948      9.802438 
1 1 1 4   3  45 o 22.60505 6.839626 8.321982       4.088573 6.554292       5.600720 10.33878       5.982358 19.93482 7.849790 23.64748 8.341046 -3.712660      11.45392 
1 1 1 4   3  46 o 21.45460 7.284521 8.262454       4.544453 8.861967       5.797400 7.306954       7.318956 21.28805 8.092009 19.66491 8.458815 1.623144       11.70607 
1 1 1 4   3  47 o 12.43107 5.792711 -0.6795671     4.286568 -0.4170112E-01 5.017519 -2.402972      8.247416 13.48978 6.279715 14.69701 7.157859 -1.207225      9.522067 
1 1 1 4   3  48 o 9.488018 4.615499 -3.446296      3.401541 -4.034151      5.140870 -2.988514      4.536608 11.34668 5.553086 11.13624 5.396975 0.2104406      7.743649 
1 1 1 4   3  49 o 10.50002 5.115579 -2.979091      4.222678 -5.972210      8.492865 -1.996171      4.866887 12.61281 6.329894 11.51010 5.580950 1.102717       8.438872 
1 1 1 4   4  0  f 216.7515 3.146007 572.5435       16.61720 561.4406       25.94760 580.2631       21.63614 214.6108 4.961460 218.1946 4.069111 -3.583801      6.416677 
1 1 1 4   4  1  o 97.30749 2.302195 115.3829       5.459142 127.6644       7.726895 103.1427       7.713907 102.3042 3.102972 91.93116 3.449424 10.37301       4.639716 
1 1 1 4   4  2  o 294.5275 4.498487 1057.373       32.28706 1120.113       47.27481 1002.525       44.20156 303.0789 6.400856 286.7321 6.325943 16.34680       8.999362 
1 1 1 4   4  3  o 234.3637 4.294518 669.5007       24.52679 670.1211       29.78284 668.1934       43.23534 234.4512 5.212877 233.9178 7.594787 0.5334320      9.211671 
1 1 1 4   4  4  o 38.91602 2.263925 18.51737       2.137703 19.24197       2.365003 15.28203       4.997375 39.66063 2.459107 34.89454 6.098800 4.766098       6.575908 
1 1 1 4   4  5  o 102.7988 3.312484 128.9290       8.287254 0.000000       0.000000 128.9290       8.287254 ?        ?        102.7988 3.312484 0.000000       3.312484 
1 1 1 4   4  6  o 286.1244 5.118886 998.2462       35.69164 1058.818       64.53280 971.5520       42.84044 294.3121 9.008403 282.2227 6.229108 12.08948       10.95231 
1 1 1 4   4  7  o 323.4290 4.913230 1275.581       38.72417 1272.969       54.67783 1278.209       54.85110 322.9699 6.947253 323.6334 6.954980 -0.6635132     9.830365 
1 1 1 4   4  8  o 306.7609 4.700416 1147.476       35.13762 1144.435       49.57095 1150.548       49.81415 306.2354 6.642564 307.0511 6.657419 -0.8157349     9.404514 
1 1 1 4   4  9  o 128.4890 2.647999 201.2077       8.291246 205.7692       11.77636 196.7241       11.67547 129.8684 3.724952 126.9771 3.777427 2.891251       5.305113 
1 1 1 4   4  10 o 314.8387 4.823380 1208.672       37.00631 1203.704       52.20082 1213.691       52.46986 314.0733 6.820405 315.3731 6.827303 -1.299805      9.650389 
1 1 1 4   4  11 o 142.0060 2.810257 245.7617       9.724979 242.6556       13.65540 248.9585       13.85312 141.0343 3.977202 142.8553 3.983266 -1.821091      5.628902 
1 1 1 4   4  12 o 615.2309 10.27072 4623.046       153.9838 4663.330       189.8119 4545.501       263.3519 617.5281 12.61336 608.3350 17.78378 9.193115       21.80274 
1 1 1 4   4  13 o 542.1630 9.107471 3587.238       120.3272 3625.271       148.5062 3514.547       205.3069 544.8083 11.18574 535.5632 15.74812 9.245056       19.31642 
1 1 1 4   4  14 o 337.5375 7.350523 1389.496       60.46115 1413.200       86.50816 1366.860       84.53592 340.0822 10.45088 334.4607 10.38452 5.621521       14.73293 
1 1 1 4   4  15 o 78.05827 2.626046 74.33377       4.988140 77.35923       6.983902 71.18318       7.126861 79.59003 3.610237 76.32753 3.843981 3.262497       5.273519 
1 1 1 4   4  16 o 825.4901 11.83620 8323.894       238.1005 8303.740       336.1308 8344.190       337.3222 823.4495 16.75079 825.4480 16.76946 -1.998535      23.70240 
1 1 1 4   4  17 o 115.2282 2.802580 161.8047       7.869606 161.7942       11.04504 161.8156       11.21553 115.1483 3.941980 115.1533 4.002840 -0.4989624E-02 5.618001 
1 1 1 4   4  18 o 506.7219 7.436090 3132.378       91.82277 3174.879       130.9771 3091.302       128.7652 509.8347 10.54216 503.0839 10.50321 6.750793       14.88135 
1 1 1 4   4  19 o 426.2426 7.367785 2216.775       76.52968 2160.872       130.7298 2245.921       94.39462 420.0573 12.78603 428.8864 9.031687 -8.829102      15.65420 
1 1 1 4   4  20 o 457.7529 6.795772 2556.703       75.80642 2509.185       105.9233 2606.595       108.5375 453.1627 9.591822 461.8681 9.643298 -8.705444      13.60133 
1 1 1 4   4  21 o 168.1151 3.751008 344.5522       15.36706 323.4083       25.18612 357.0914       19.39567 162.6684 6.365922 171.0585 4.657236 -8.390167      7.887637 
1 1 1 4   4  22 o 123.6533 3.009618 186.3869       9.068868 185.3391       12.68750 187.4816       12.96773 123.2052 4.232100 123.9120 4.301040 -0.7067108     6.034038 
1 1 1 4   4  23 o 47.28449 3.929983 27.45743       4.487512 31.71110       6.217576 22.83231       6.483364 50.71817 5.099769 42.76097 6.419880 7.957203       8.198933 
1 1 1 4   4  24 o 242.4467 4.088487 717.2052       24.15544 736.3243       34.50033 698.8203       33.83138 245.4879 5.767094 239.1500 5.805148 6.337936       8.182856 
1 1 1 4   4  25 o 30.56274 5.210809 11.73119       3.741839 12.24621       5.020696 11.08772       5.612072 31.02702 6.826046 29.53447 7.714580 1.492550       10.30095 
1 1 1 4   4  26 o 56.35407 4.701114 39.07170       6.397223 39.07170       6.397223 0.000000       0.000000 56.35407 4.701114 ?        ?        0.000000       4.701114 
1 1 1 4   4  27 o 29.64140 5.458249 11.08996       3.797417 11.20828       5.276955 10.96287       5.468904 29.63257 7.344843 29.32704 7.593269 0.3055305      10.56430 
1 1 1 4   4  28 o 38.68975 4.375489 18.52864       4.053019 14.18213       5.349343 24.38659       6.210174 33.39249 6.804980 44.22356 5.910384 -10.83107      9.013345 
1 1 1 4   4  29 o 96.93536 3.086857 114.8196       7.282505 117.6545       10.16341 111.8282       10.44020 97.99957 4.265999 95.50824 4.498358 2.491325       6.199514 
1 1 1 4   4  30 o 111.4189 3.121229 151.7078       8.466281 153.1937       11.85287 150.1601       12.09713 111.8076 4.358618 110.6732 4.494778 1.134430       6.261037 
1 1 1 4   4  31 o 170.1572 4.059070 354.2652       16.83112 351.8733       29.68688 355.3983       20.43234 168.6648 7.239628 170.1896 4.931821 -1.524719      8.759856 
1 1 1 4   4  32 o 120.1788 3.601464 176.7974       10.53544 165.9719       16.63428 184.0487       13.61414 115.9815 5.904877 122.4495 4.570464 -6.467957      7.467041 
1 1 1 4   4  33 o 55.28511 3.895911 37.60938       5.215108 36.85610       7.085529 38.49984       7.703750 54.47767 5.408597 55.62063 5.767290 -1.142960      7.906614 
1 1 1 4   4  34 o 133.0804 3.292216 216.6831       10.67673 213.8028       14.76398 219.8407       15.45830 131.8562 4.601857 133.6664 4.753300 -1.810226      6.615962 
1 1 1 4   4  35 o 109.9251 3.281438 148.0703       8.780326 151.9841       12.18472 143.8427       12.66363 111.0917 4.510262 107.9875 4.824436 3.104233       6.604366 
1 1 1 4   4  36 o 23.58657 7.113368 7.036047       4.427523 12.05994       5.903140 0.5756320      6.694112 30.39609 7.898502 19.33037 8.195341 11.06572       11.38200 
1 1 1 4   4  37 o 133.4691 4.634504 220.4118       15.05084 220.4118       15.05084 0.000000       0.000000 133.4691 4.634504 ?        ?        0.000000       4.634504 
1 1 1 4   4  38 o 50.06743 4.282601 31.23700       5.175024 32.27216       7.087380 30.05479       7.574010 50.41535 5.879021 48.38023 6.595829 2.035114       8.835602 
1 1 1 4   4  39 o 102.8749 3.334920 130.7142       8.349429 124.5915       11.28178 138.1288       12.41517 99.79947 4.651681 104.9640 4.866985 -5.164558      6.732435 
1 1 1 4   4  40 o 43.53129 4.604240 24.05619       4.810289 24.16134       6.543445 23.93254       7.095604 42.82447 6.471869 42.28781 7.139473 0.5366592      9.636243 
1 1 1 4   4  41 o 25.28809 7.836360 8.912134       5.326362 15.38377       9.887028 6.265944       6.322215 31.74801 10.74499 22.66302 8.486314 9.084984       13.69205 
1 1 1 4   4  42 o 15.83873 6.371906 2.123708       3.768274 2.715626       5.169189 1.452403       5.504930 18.00503 7.381238 17.31367 7.389228 0.6913643      10.44430 
1 1 1 4   4  43 o 16.95388 6.755020 3.017387       4.193213 0.6187111E-01  4.904692 11.04569       8.083637 15.17797 6.716392 25.93662 9.618607 -10.75864      11.73147 
1 1 1 4   4  44 o 29.97153 6.078778 13.12045       4.287728 12.52508       5.889199 13.79204       6.254829 27.32458 8.195724 28.47520 8.423489 -1.150620      11.75266 
1 1 1 4   4  45 o 20.54527 6.838459 6.867002       4.006068 3.817977       5.279341 11.00581       6.150873 17.36474 7.315713 24.14664 8.462502 -6.781900      11.18631 
1 1 1 4   4  46 o 17.13588 6.678348 4.605534       4.018847 11.38777       5.412938 -3.725336      5.999180 24.32947 7.942317 13.16229 6.336054 11.16718       10.16002 
1 1 1 4   4  47 o 21.00673 6.744215 8.110065       3.912798 8.848943       5.550005 7.379894       5.517205 20.22502 7.857735 18.87628 7.668131 1.348745       10.97926 
1 1 1 4   4  48 f 13.20713 5.815166 1.968507       3.633355 -0.3655955     5.219479 4.162909       5.060872 12.86920 6.116660 15.40722 6.819935 -2.538022      9.161061 
1 1 1 4   4  49 o 11.91111 5.448662 0.8877184      3.546442 -1.033425      5.021730 2.799244       5.009145 11.99522 5.779984 13.90069 6.401683 -1.905472      8.624950 
1 1 1 4   5  0  o 372.0838 5.535956 1687.907       50.19604 1629.976       69.44406 1751.292       72.63955 365.5349 7.795970 378.8896 7.867274 -13.35474      11.07570 
1 1 1 4   5  1  o 120.9158 2.802924 178.1728       8.259059 165.0791       13.64738 185.7393       10.37450 116.2700 4.827154 123.4033 3.453278 -7.133354      5.935195 
1 1 1 4   5  2  o 374.0907 7.870740 1707.372       71.75111 1666.474       99.36384 1751.934       103.7190 369.1841 11.05704 378.5166 11.25693 -9.332520      15.77900 
1 1 1 4   5  3  o 330.6364 5.785466 1333.016       46.61494 1370.063       57.95036 1265.099       78.46368 335.1357 7.095768 321.7056 10.02083 13.43005       12.27872 
1 1 1 4   5  4  o 601.7758 12.33601 4428.987       180.9029 4359.594       253.0360 4501.538       258.7298 595.6783 17.45030 605.2746 17.55971 -9.596252      24.75593 
1 1 1 4   5  5  o 255.1493 5.773327 793.9509       35.89687 772.7032       49.99441 816.5627       51.57412 251.4644 8.169313 258.5074 8.197324 -7.042969      11.57298 
1 1 1 4   5  6  o 435.6325 6.413943 2315.347       68.08971 2314.722       96.39560 2315.970       96.19151 435.2865 9.087532 435.4066 9.065791 -0.1200867     12.83635 
1 1 1 4   5  7  o 152.4596 3.329693 283.3221       12.37072 263.3393       21.28434 293.5160       15.20208 146.8029 5.962027 155.1124 4.025200 -8.309540      7.193608 
1 1 1 4   5  8  o 471.7226 6.908080 2715.896       79.41090 2684.511       111.4064 2748.312       113.2236 468.5960 9.756079 474.1246 9.799602 -5.528595      13.82799 
1 1 1 4   5  9  o 149.1565 2.836668 271.1502       10.31067 270.4281       14.49975 271.8888       14.66462 148.8840 4.000095 149.2841 4.034778 -0.4001617     5.681566 
1 1 1 4   5  10 o 521.0714 7.591228 3314.013       96.39298 3302.051       135.9292 3326.115       136.7148 519.6802 10.73348 521.5664 10.75647 -1.886230      15.19569 
1 1 1 4   5  11 o 578.1944 9.671206 4082.991       136.2670 4112.674       167.8453 4025.598       233.3931 579.9453 11.87644 572.5305 16.74636 7.414795       20.53023 
1 1 1 4   5  12 o 280.7039 4.404691 960.4623       30.13006 951.3027       42.30773 969.8887       42.91953 279.3057 6.215897 282.0199 6.245097 -2.714172      8.811277 
1 1 1 4   5  13 o 329.6273 5.846755 1324.715       46.96498 1331.409       82.20461 1321.471       57.22351 330.0900 10.23181 329.1735 7.133679 0.9164734      12.47314 
1 1 1 4   5  14 o 807.7957 13.39084 7974.864       263.6000 8253.694       330.2427 7485.304       437.5892 821.1527 16.50339 779.9690 23.04782 41.18372       28.34720 
1 1 1 4   5  15 o 1029.819 14.71543 12970.21       369.2921 13473.89       536.3727 12516.27       509.2019 1047.603 21.01038 1009.803 20.69270 37.79950       29.48938 
1 1 1 4   5  16 o 303.0634 4.728534 1119.573       34.92175 1155.162       50.27809 1086.401       48.54132 307.7784 6.703546 298.4786 6.673633 9.299713       9.459117 
1 1 1 4   5  17 o 458.0496 6.771350 2558.800       75.58295 2536.764       106.2203 2581.402       107.5735 455.8616 9.561769 459.8516 9.599562 -3.989929      13.54913 
1 1 1 4   5  18 o 308.9861 4.823943 1163.898       36.32262 1157.751       51.12130 1170.165       51.61820 308.0879 6.809124 309.7338 6.838773 -1.645905      9.650543 
1 1 1 4   5  19 o 434.9139 7.501170 2308.149       79.50023 2221.292       134.9845 2354.279       98.37148 425.8139 13.02383 439.0732 9.193824 -13.25925      15.94197 
1 1 1 4   5  20 o 186.8027 3.922707 425.3904       17.85686 397.3684       29.03693 442.4336       22.64519 180.3418 6.618435 190.4196 4.884125 -10.07779      8.225471 
1 1 1 4   5  21 o 234.5599 3.962396 670.8013       22.64894 653.3275       31.46017 689.6021       32.63288 231.4115 5.578790 237.7461 5.632562 -6.334595      7.927714 
1 1 1 4   5  22 o 281.0068 4.517749 963.1972       30.93678 950.7827       43.28941 976.1559       44.22812 279.0396 6.366191 282.7333 6.419267 -3.693665      9.040761 
1 1 1 4   5  23 o 177.5464 3.401126 384.3930       14.71535 398.5048       20.98150 370.7316       20.64391 180.6439 4.770430 174.2226 4.867176 6.421280       6.815160 
1 1 1 4   5  24 o 77.79087 3.073097 73.90922       5.814141 74.59418       7.949875 73.12154       8.525105 78.07139 4.194009 77.26438 4.547882 0.8070068      6.186513 
1 1 1 4   5  25 o 286.1249 5.308823 1000.605       37.01604 995.7448       45.15301 1010.565       64.63847 285.2097 6.496602 286.4933 9.270704 -1.283508      11.32041 
1 1 1 4   5  26 o 159.8733 3.771059 312.0116       14.69181 315.3887       17.84886 304.9159       25.87214 160.6021 4.565244 157.5784 6.753172 3.023697       8.151490 
1 1 1 4   5  27 o 120.2854 3.040531 176.6494       8.905336 178.0808       12.39613 175.1228       12.80176 120.6591 4.222403 119.6317 4.398730 1.027428       6.097337 
1 1 1 4   5  28 o 18.15724 6.459641 3.475102       3.594484 9.218151       4.877626 -3.350629      5.317554 26.93308 7.265633 14.76193 6.721700 12.17115       9.898013 
1 1 1 4   5  29 o 38.87737 4.667672 18.75845       4.333823 21.88503       5.941829 15.20447       6.334945 41.81478 6.003053 34.45321 7.735289 7.361572       9.791391 
1 1 1 4   5  30 o 105.0098 3.088519 134.7681       7.894850 139.8629       11.04796 129.4515       11.28585 106.8344 4.252100 102.7361 4.518963 4.098259       6.204948 
1 1 1 4   5  31 o 110.2747 3.749314 148.8796       10.06078 152.7754       18.39117 147.2158       12.01855 111.1039 6.825672 109.5388 4.512100 1.565079       8.182227 
1 1 1 4   5  32 o 50.06953 4.480015 30.96749       5.408545 43.33558       8.600748 22.87734       6.956059 59.01768 6.066522 42.50090 6.956746 16.51677       9.230330 
1 1 1 4   5  33 o 118.8159 3.196549 172.7246       9.246927 169.3011       12.75922 176.5120       13.42005 117.4001 4.468000 119.8481 4.603572 -2.448044      6.415287 
1 1 1 4   5  34 o 36.49744 5.368460 16.75005       4.632190 16.43186       6.239072 17.14089       6.914716 35.71289 7.411975 36.37650 8.016864 -0.6636047     10.91822 
1 1 1 4   5  35 o 41.47671 4.850952 21.46427       4.810561 25.45744       6.623258 17.00574       6.998566 44.91275 6.218159 36.13721 8.143038 8.775539       10.24571 
1 1 1 4   5  36 o 58.25380 4.362963 42.00940       6.148588 43.29090       7.387188 39.11966       11.09296 58.94992 5.195439 54.98917 8.556368 3.960758       10.01020 
1 1 1 4   5  37 o 54.23492 4.524529 36.58384       5.925397 36.07582       6.989086 37.88227       11.17357 53.61813 5.423492 53.74510 8.838291 -0.1269684     10.36965 
1 1 1 4   5  38 f 26.42920 6.624127 9.175443       4.257445 11.66077       5.820860 6.316406       6.243171 29.60044 7.916082 23.56786 8.497974 6.032587       11.61378 
1 1 1 4   5  39 o 52.67771 4.065355 34.66242       5.178340 34.81111       7.038361 34.48695       7.645859 52.21970 5.619300 51.72865 6.188015 0.4910507      8.358712 
1 1 1 4   5  40 o 38.14957 4.964402 18.67852       4.505861 15.16506       5.943346 23.42753       6.909799 33.28860 7.506260 41.83574 7.026539 -8.547142      10.28184 
1 1 1 4   5  41 o 17.84290 6.716978 3.473796       3.972022 4.441034       5.252232 2.181551       6.070848 20.06189 7.683557 18.82324 7.882155 1.238647       11.00752 
1 1 1 4   5  42 o 24.79988 8.361184 8.988613       5.986627 0.000000       0.000000 8.988613       5.986627 ?        ?        24.79988 8.361184 0.000000       8.361184 
1 1 1 4   5  43 o 31.44910 5.590174 13.69984       4.127213 14.12210       5.454602 13.13431       6.312435 30.60914 7.395926 28.63311 8.460126 1.976030       11.23715 
1 1 1 4   5  44 o 14.00213 6.015511 1.032418       3.692787 5.383416       4.984346 -4.261860      5.498158 19.33482 7.464304 13.09509 6.239220 6.239736       9.728499 
1 1 1 4   5  45 o 18.18876 6.752743 5.110926       3.986242 5.985011       5.300749 3.973186       6.047583 19.24029 7.617820 17.78561 7.670120 1.454679       10.81027 
1 1 1 4   5  46 o 15.93744 6.723881 3.324803       4.469836 2.065950       5.195638 6.910031       8.768185 15.38942 6.855416 19.25934 8.714702 -3.869920      11.08796 
1 1 1 4   5  47 o 14.75351 6.337924 2.865144       4.098762 1.259914       4.954775 6.344865       7.295035 14.09840 6.445847 17.74090 7.995554 -3.642497      10.27024 
1 1 1 4   5  48 o 13.07975 5.808977 1.821464       3.701990 -1.283985      5.047081 5.437906       5.446516 12.27092 5.882045 16.21988 7.131526 -3.948951      9.244302 
1 1 1 4   5  49 o 12.31755 5.546658 1.516687       3.502259 1.755358       4.876060 1.262346       5.033579 13.20863 6.162739 13.01951 6.133650 0.1891146      8.694884 
1 1 1 4   6  0  o 160.8223 2.389966 315.1758       9.366427 321.0648       13.37630 309.5106       13.11969 162.3076 3.381902 159.3604 3.378369 2.947220       4.780234 
1 1 1 4   6  1  o 680.3270 8.746615 5649.292       145.0086 5762.393       232.5586 5577.346       185.4817 686.1965 13.90746 675.5958 11.26622 10.60071       17.89819 
1 1 1 4   6  2  o 441.2944 9.212080 2377.615       99.06545 2272.104       135.9066 2497.232       144.7065 430.7730 12.96135 451.5945 13.16337 -20.82147      18.47352 
1 1 1 4   6  3  o 206.8057 3.425553 521.2686       17.26351 524.8156       24.53841 517.7924       24.29204 207.4767 4.853343 206.0842 4.837080 1.392532       6.852174 
1 1 1 4   6  4  o 47.89216 2.927848 28.05811       3.400703 0.000000       0.000000 28.05811       3.400703 ?        ?        47.89216 2.927848 0.000000       2.927848 
1 1 1 4   6  5  o 151.2301 3.289382 278.7612       12.12240 289.4200       21.98280 274.1036       14.53162 153.9246 5.871323 149.8965 3.981724 4.028061       7.094121 
1 1 1 4   6  6  o 148.2121 2.783718 267.7240       10.05414 256.9749       13.91537 279.4643       14.54278 145.1339 3.938141 151.3556 3.946239 -6.221680      5.575102 
1 1 1 4   6  7  f 329.8913 5.798951 1327.595       46.61829 1342.804       81.94981 1320.319       56.68349 331.2125 10.16528 328.8905 7.072438 2.322021       12.38355 
1 1 1 4   6  8  o 134.1103 3.164450 219.2198       10.34181 202.9219       18.13817 227.0702       12.58850 128.8472 5.791537 136.4277 3.790150 -7.580521      6.921499 
1 1 1 4   6  9  o 742.5358 12.32794 6749.940       223.0715 6713.734       272.4856 6823.516       388.4324 739.6611 15.11732 742.7057 21.48420 -3.044678      26.26983 
1 1 1 4   6  10 f 294.2220 5.235990 1055.549       37.54137 1025.262       45.34889 1121.506       66.92192 289.9163 6.418862 302.9153 9.076141 -12.99899      11.11657 
1 1 1 4   6  11 o 634.2004 9.156358 4910.035       141.5094 4931.159       200.5884 4889.105       199.6639 634.9581 12.96357 632.2456 12.95918 2.712524       18.33015 
1 1 1 4   6  12 o 665.3513 11.09528 5406.802       179.8976 5677.258       322.7448 5284.898       216.6801 679.8318 19.50162 657.4288 13.52491 22.40302       23.73260 
1 1 1 4   6  13 o 487.8909 7.149268 2902.932       85.00029 2886.327       119.6947 2919.826       120.7291 486.2787 10.10075 489.0900 10.12948 -2.811310      14.30494 
1 1 1 4   6  14 o 379.7283 5.705596 1757.887       52.79710 1804.164       75.82935 1714.343       73.55534 384.5873 8.091076 374.8937 8.051373 9.693634       11.41447 
1 1 1 4   6  15 o 571.5963 9.604282 3987.401       133.7798 4065.804       165.7686 3840.965       226.5479 576.9514 11.79035 559.8538 16.62381 17.09760       20.38047 
1 1 1 4   6  16 o 828.6097 13.72665 8395.866       277.1729 8802.625       494.7265 8209.781       334.6204 844.9856 24.05037 818.6525 16.77323 26.33307       29.32169 
1 1 1 4   6  17 o 247.9754 4.058817 749.5043       24.52699 774.2998       35.24526 726.2214       34.15329 252.0002 5.739365 244.0510 5.742697 7.949173       8.119044 
1 1 1 4   6  18 o 504.8524 7.408969 3109.605       91.15035 3126.089       129.2952 3093.317       128.5204 505.8557 10.48865 503.1982 10.48086 2.657562       14.82769 
1 1 1 4   6  19 o 251.1664 4.726589 769.1346       28.92981 801.5046       50.18297 753.0221       35.40517 256.1186 8.050426 248.4803 5.847075 7.638275       9.949757 
1 1 1 4   6  20 o 40.28740 5.048389 20.10312       4.847784 22.86525       9.533777 19.13990       5.629948 42.42393 9.462750 39.14540 6.100621 3.278538       11.25883 
1 1 1 4   6  21 o 224.5423 3.842815 614.7334       21.02732 601.8989       29.27680 628.4081       30.21985 222.1147 5.408916 226.9502 5.464188 -4.835556      7.688544 
1 1 1 4   6  22 o 311.0208 4.889775 1180.275       37.06077 1156.035       51.55719 1206.191       53.31046 307.6035 6.877996 314.1949 6.962692 -6.591400      9.787027 
1 1 1 4   6  23 o 563.0234 8.262374 3881.789       113.3620 3776.975       157.3757 3994.824       163.4318 554.0025 11.65708 569.6996 11.77212 -15.69708      16.56715 
1 1 1 4   6  24 o 326.7079 5.879699 1304.745       46.81131 1297.313       57.17146 1319.862       81.53917 325.5128 7.207341 327.3725 10.23344 -1.859680      12.51675 
1 1 1 4   6  25 o 199.3446 3.630607 484.9259       17.63680 496.4191       25.02784 473.5886       24.85745 201.4801 5.101578 196.7772 5.188298 4.702927       7.276299 
1 1 1 4   6  26 f 95.19939 2.972325 110.6668       6.887063 113.7648       9.555060 107.3171       9.935640 96.43322 4.075218 93.62707 4.366730 2.806152       5.972916 
1 1 1 4   6  27 f 58.18201 3.957538 41.53586       5.577724 39.83911       6.520293 46.16504       10.76987 56.88627 4.746751 60.85768 7.414935 -3.971409      8.804142 
1 1 1 4   6  28 o 246.5624 4.173050 743.0258       25.07360 734.2928       35.02280 752.2081       35.91279 244.7389 5.872349 247.6863 5.949918 -2.947464      8.359785 
1 1 1 4   6  29 o 52.39142 3.685510 33.70205       4.675350 33.92773       6.334466 33.43198       6.929401 52.39692 5.022404 51.92600 5.562734 0.4709206      7.494568 
1 1 1 4   6  30 o 65.23679 3.372255 52.13067       5.342844 53.45418       7.231585 50.53989       7.928220 65.92393 4.528986 64.00673 5.125736 1.917198       6.839948 
1 1 1 4   6  31 o 73.42220 4.824187 66.36887       8.583709 0.000000       0.000000 66.36887       8.583709 ?        ?        73.42220 4.824187 0.000000       4.824187 
1 1 1 4   6  32 o 107.8420 3.166829 142.2530       8.313385 146.2507       11.61987 138.0609       11.89890 109.1579 4.377150 106.0085 4.617136 3.149361       6.362184 
1 1 1 4   6  33 o 22.10323 6.881142 6.019986       4.101696 7.574767       5.452238 3.992743       6.225770 24.89493 7.957952 21.69671 8.351137 3.198212       11.53562 
1 1 1 4   6  34 o 176.2201 3.568902 380.3006       15.32591 365.6230       21.01069 396.9904       22.40462 172.2919 5.009574 179.4906 5.127493 -7.198685      7.168474 
1 1 1 4   6  35 o 62.49533 3.750493 48.06903       5.685507 51.27938       7.523864 43.79558       8.680690 64.34893 4.833359 59.14285 6.110949 5.206078       7.791345 
1 1 1 4   6  36 o 101.3905 3.247254 126.1405       8.012889 123.9268       10.85804 128.7879       11.87384 100.1856 4.458609 102.0332 4.788804 -1.847534      6.543076 
1 1 1 4   6  37 o 77.45210 3.396729 73.83228       6.395475 76.22709       8.703978 71.02216       9.428549 78.38403 4.576647 75.46802 5.157797 2.916008       6.895547 
1 1 1 4   6  38 o 101.9022 3.747472 128.3340       9.290042 128.8099       11.05727 127.1916       17.13033 101.7897 4.468558 99.65496 7.100437 2.134789       8.389530 
1 1 1 4   6  39 o 45.08929 4.502111 25.62047       4.880752 26.02272       6.353383 25.04125       7.623863 44.90746 5.952065 43.36725 7.484408 1.540207       9.562607 
1 1 1 4   6  40 o 28.83334 6.374771 11.16334       4.359986 10.07868       5.573609 12.87366       6.998846 27.03357 7.939631 30.16568 8.907011 -3.132111      11.93200 
1 1 1 4   6  41 o 22.05513 7.133738 6.576963       4.372441 8.143488       6.252502 5.077671       6.116860 24.41744 8.533943 21.28772 8.255171 3.129721       11.87333 
1 1 1 4   6  42 o 27.50991 7.512398 11.08972       5.177053 9.653849       9.063530 11.78506       6.307221 25.72735 10.02850 27.83856 8.509708 -2.111210      13.15241 
1 1 1 4   6  43 o 21.98400 6.592087 7.078684       3.810407 9.109032       4.921240 4.039421       6.021067 24.37585 7.528857 19.21245 7.930596 5.163403       10.93517 
1 1 1 4   6  44 o 50.51006 4.137188 33.93611       5.047779 31.89326       6.723595 36.57478       7.641438 46.86800 6.026227 49.62949 6.472340 -2.761490      8.843450 
1 1 1 4   6  45 f 15.25696 6.517787 2.230726       4.290513 5.217047       5.211596 -4.050380      7.558238 18.42109 7.463887 14.78509 7.115866 3.635998       10.31238 
1 1 1 4   6  46 o 12.37526 5.593644 0.3765808E-01  3.600824 -4.622866      4.814209 5.955788       5.425000 11.40154 5.533542 18.39489 7.553639 -6.993348      9.363629 
1 1 1 4   6  47 o 13.67281 6.201708 1.247475       4.472633 -6.287705      8.469687 4.161333       5.266895 13.57971 6.735694 16.08989 7.045446 -2.510179      9.747199 
1 1 1 4   6  48 o 25.08770 6.477231 11.77514       3.987062 13.92340       5.565678 9.510563       5.714377 23.92717 8.061857 19.17671 7.798849 4.750452       11.21675 
1 1 1 4   6  49 o 9.977060 4.797582 -1.931102      3.418035 4.634037       4.734844 -9.075460      4.939299 14.95821 6.610046 9.329134 4.701006 5.629081       8.111238 
1 1 1 4   7  0  o 310.8459 4.748856 1178.002       35.97247 1148.004       70.27438 1188.653       41.87454 306.4605 9.421120 312.2172 5.503729 -5.756714      10.91094 
1 1 1 4   7  1  o 328.5896 5.763213 1316.721       46.14817 1314.891       79.04651 1317.667       56.84042 327.9331 9.902827 328.6334 7.097568 -0.7002258     12.18366 
1 1 1 4   7  2  o 283.8789 5.060412 982.6119       35.00703 940.4932       41.88350 1080.234       63.76448 277.6792 6.189614 297.3019 8.810986 -19.62277      10.76777 
1 1 1 4   7  3  o 335.1527 5.862398 1370.066       47.87999 1380.824       58.72160 1348.724       82.70341 336.3802 7.163600 332.0243 10.23378 4.355835       12.49190 
1 1 1 4   7  4  o 207.6924 3.945733 525.8561       19.97029 512.0610       33.48783 533.4696       24.87802 204.7419 6.720989 209.1625 4.880855 -4.420578      8.306290 
1 1 1 4   7  5  o 356.5906 5.352440 1550.847       46.51123 1642.968       97.24664 1523.523       52.96159 366.3070 10.90629 353.3803 6.150105 12.92667       12.52082 
1 1 1 4   7  6  o 454.5409 6.682426 2521.354       74.01900 2662.299       108.6799 2399.410       101.0892 466.6902 9.556177 443.0783 9.362421 23.61191       13.37817 
1 1 1 4   7  7  o 265.8197 4.855601 861.6488       31.45331 813.4667       53.37397 887.2836       38.93151 257.9272 8.503355 269.6919 5.923756 -11.76477      10.36330 
1 1 1 4   7  8  f 231.1883 4.290549 651.6139       24.17212 666.9861       30.24984 624.4587       40.20501 233.8633 5.307928 226.0774 7.307315 7.785873       9.031664 
1 1 1 4   7  9  o 431.3204 6.367027 2269.336       66.92259 2193.295       92.44632 2353.061       97.00376 423.7978 8.951481 438.9489 9.068564 -15.15109      12.74236 
1 1 1 4   7  10 o 372.8586 5.585101 1695.182       50.74710 1694.780       71.68003 1695.587       71.85477 372.6765 7.892781 372.7641 7.910163 -0.8758545E-01 11.17438 
1 1 1 4   7  11 o 627.9355 10.49401 4815.049       160.5804 4759.721       276.6956 4843.147       197.1843 622.6579 18.25516 629.4155 12.85579 -6.757629      22.32761 
1 1 1 4   7  12 o 386.1335 5.774926 1817.768       54.34005 1754.839       75.03314 1887.178       78.80219 379.2813 8.118122 393.3169 8.221660 -14.03561      11.55420 
1 1 1 4   7  13 o 418.5232 6.211826 2135.625       63.35413 2163.597       90.29445 2108.501       88.91403 421.1187 8.798738 415.7236 8.776665 5.395142       12.42770 
1 1 1 4   7  14 o 849.3016 12.16405 8810.968       251.7540 8927.860       359.1792 8698.081       352.9699 853.8290 17.26252 842.7884 17.18633 11.04059       24.35907 
1 1 1 4   7  15 f 276.1087 5.078496 929.3294       34.17051 950.3665       42.12997 888.8834       58.41670 279.1845 6.192467 269.7568 8.898633 9.427734       10.84123 
1 1 1 4   7  16 o 492.2376 7.229061 2955.332       86.71471 2974.445       123.1092 2936.511       122.1625 493.5698 10.23542 490.4137 10.22208 3.156067       14.46564 
1 1 1 4   7  17 o 310.4002 5.538365 1174.745       41.89284 1188.424       71.89240 1167.712       51.54925 311.8566 9.470993 309.4149 6.836676 2.441620       11.68075 
1 1 1 4   7  18 o 256.7316 4.775340 803.5563       29.87581 789.7120       50.02143 811.2333       37.24943 254.2453 8.083870 257.9147 5.926624 -3.669388      10.02366 
1 1 1 4   7  19 o 181.0320 3.351834 399.4513       14.78679 386.1051       20.45705 414.0534       21.39804 177.8898 4.723243 184.2175 4.770594 -6.327728      6.713240 
1 1 1 4   7  20 o 413.8533 7.197360 2090.952       72.58647 2133.985       128.2698 2070.680       88.03894 417.0591 12.63548 411.6474 8.776338 5.411743       15.38439 
1 1 1 4   7  21 o 100.0696 2.877888 122.1643       7.010694 121.8942       9.673211 122.4630       10.17505 99.90279 3.981324 100.1240 4.179441 -0.2212219     5.772233 
1 1 1 4   7  22 f 242.9841 4.060473 720.1257       24.04311 696.6491       33.20561 745.9981       34.85877 238.8710 5.704425 247.1795 5.787133 -8.308472      8.125970 
1 1 1 4   7  23 o 225.3572 4.430427 619.7588       24.33061 610.4544       29.60750 639.1106       42.69903 223.5717 5.434364 228.3660 7.683682 -4.794296      9.411232 
1 1 1 4   7  24 o 225.6714 3.881763 621.4606       21.34723 612.6770       29.77629 630.7493       30.62049 223.9063 5.457179 227.1754 5.531141 -3.269089      7.770092 
1 1 1 4   7  25 o 74.91419 2.996493 68.56457       5.459293 66.37286       7.407232 71.17084       8.077447 73.61332 4.145933 76.21476 4.367381 -2.601440      6.021858 
1 1 1 4   7  26 o 121.0435 3.020774 178.7507       8.910369 169.5234       12.04527 189.9025       13.24189 117.7324 4.205159 124.5989 4.367893 -6.866463      6.063155 
1 1 1 4   7  27 o 171.5224 3.909976 359.3425       16.34298 354.7036       19.57031 370.0326       29.70842 170.2519 4.721599 173.4414 7.043607 -3.189484      8.479734 
1 1 1 4   7  28 o 122.0775 3.047191 181.8958       9.065076 176.8808       12.37792 187.6972       13.31301 120.2135 4.231907 123.8140 4.419441 -3.600502      6.118864 
1 1 1 4   7  29 o 124.4560 3.087323 189.1075       9.363412 195.3465       13.09325 182.5770       13.39566 126.3072 4.259958 122.0674 4.511033 4.239807       6.204567 
1 1 1 4   7  30 o 81.56022 3.492447 81.43696       6.925286 74.90687       10.31043 86.80466       9.347838 77.94147 5.462998 84.07062 4.580092 -6.129150      7.128927 
1 1 1 4   7  31 o 154.1775 3.317310 290.5053       12.46359 290.4578       17.31939 290.5562       17.94987 153.8790 4.623916 153.8668 4.793030 0.1220703E-01  6.659860 
1 1 1 4   7  32 o 72.00644 4.212525 63.73455       7.359512 79.58184       14.19339 57.90709       8.606938 79.82675 7.379794 68.46194 5.197818 11.36481       9.026553 
1 1 1 4   7  33 o 64.57091 3.533580 51.17626       5.538976 47.04973       7.318332 56.71016       8.474911 61.68891 4.908657 67.71130 5.175370 -6.022396      7.132977 
1 1 1 4   7  34 o 162.7684 3.445247 324.4026       13.66553 325.3601       18.98624 323.3734       19.68463 162.5653 4.797892 161.9988 4.992268 0.5665131      6.924053 
1 1 1 4   7  35 o 45.53911 4.950066 25.85572       5.404999 27.44698       6.307036 21.45551       10.48800 46.78108 5.646556 40.16612 10.57273 6.614964       11.98609 
1 1 1 4   7  36 o 96.83734 3.262693 115.1130       7.688374 117.1926       10.49204 112.7014       11.29872 97.40594 4.431775 95.38078 4.877269 2.025162       6.590022 
1 1 1 4   7  37 o 36.04953 5.192248 16.46288       4.429959 16.54590       5.913684 16.35671       6.687200 35.62120 7.062194 35.16154 7.986927 0.4596558      10.66141 
1 1 1 4   7  38 o 51.97783 4.623336 33.85044       5.795073 37.93221       6.778675 22.76684       11.17021 54.87693 5.128352 40.18063 11.06001 14.69630       12.19114 
1 1 1 4   7  39 o 81.80969 3.389108 82.89526       6.741940 76.63145       8.892972 91.36103       10.33857 78.06977 4.696133 85.08914 5.008122 -7.019371      6.865490 
1 1 1 4   7  40 o 15.33697 6.330425 1.278466       3.836079 2.858625       4.934685 -1.134750      6.098278 18.35778 7.323461 16.71314 7.437191 1.644640       10.43767 
1 1 1 4   7  41 o 28.91402 6.837105 11.65050       4.741195 6.206614       6.653596 17.26613       6.757741 22.57526 8.647583 34.54544 8.158539 -11.97018      11.88875 
1 1 1 4   7  42 o 46.72797 5.335021 29.14956       5.966313 23.17694       10.15768 32.29549       7.372019 36.79556 10.69376 48.31165 6.420598 -11.51609      12.47319 
1 1 1 4   7  43 o 35.63956 5.190272 17.36772       4.375411 15.63508       5.710006 19.83206       6.809792 31.98458 7.462935 35.57728 8.044025 -3.592705      10.97277 
1 1 1 4   7  44 o 36.37816 4.931919 18.38138       4.259621 17.02530       5.611891 20.22462       6.542693 32.79503 7.218107 35.08675 7.848788 -2.291714      10.66323 
1 1 1 4   7  45 o 17.17136 6.800686 4.302423       4.225723 3.571297       4.895185 6.440530       8.371205 16.75902 7.051600 19.75157 8.755646 -2.992550      11.24217 
1 1 1 4   7  46 o 16.35674 6.766338 3.981909       4.395772 -1.925085      8.103610 6.444700       5.232497 15.20874 7.331953 18.73778 7.518774 -3.529039      10.50188 
1 1 1 4   7  47 o 11.59898 5.349346 -0.3330632     3.515521 -1.861435      4.840078 1.373649       5.114673 12.18831 5.820121 14.10500 6.485940 -1.916690      8.714426 
1 1 1 4   7  48 f 21.19458 7.014606 9.541315       4.216606 8.617688       5.139309 11.44360       7.375538 18.79506 7.481719 19.01536 8.331611 -0.2202969     11.19785 
1 1 1 4   7  49 o 17.56121 6.558810 6.796625       3.771424 3.811632       5.068676 10.49893       5.644938 14.34052 6.542410 18.97121 7.737808 -4.630688      10.13296 
1 1 1 4   8  0  o 331.7297 5.048849 1341.889       40.81434 1408.981       59.46480 1282.130       56.12065 339.7849 7.181576 324.1343 7.104960 15.65063       10.10225 
1 1 1 4   8  1  o 177.5499 2.808187 384.1988       12.15018 403.8476       19.55283 371.8389       15.50774 182.0001 4.408612 174.6557 3.643590 7.344376       5.719407 
1 1 1 4   8  2  o 395.6791 5.880366 1909.765       56.70006 1969.607       81.80226 1854.430       78.66190 401.6006 8.358625 389.6894 8.283422 11.91122       11.76782 
1 1 1 4   8  3  o 140.4832 3.197249 240.5488       10.94553 265.0217       20.33988 230.5730       12.98617 147.2931 5.677327 137.4735 3.880257 9.819534       6.876659 
1 1 1 4   8  4  o 372.2780 4.971018 1690.108       45.09712 1608.969       69.14403 1750.176       59.49254 363.0022 7.816447 378.7248 6.446183 -15.72263      10.13164 
1 1 1 4   8  5  o 349.8346 7.449005 1494.043       63.50341 1592.033       94.49429 1413.340       85.75517 360.5908 10.76568 339.7941 10.36852 20.79666       14.94678 
1 1 1 4   8  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 4   8  7  o 556.9683 9.326554 3790.015       126.5866 3650.917       215.0348 3863.781       156.5956 544.9329 16.21111 561.9810 11.43462 -17.04816      19.83811 
1 1 1 4   8  8  f 586.8540 8.496032 4204.754       121.5017 4178.550       171.0552 4231.438       172.6141 584.4359 12.01056 588.1163 12.04417 -3.680359      17.00928 
1 1 1 4   8  9  o 713.5698 10.26310 6219.815       178.4642 6110.140       249.3738 6334.956       255.5110 706.3655 14.48723 719.2203 14.57846 -12.85480      20.55264 
1 1 1 4   8  10 o 613.2719 8.862094 4590.029       132.4419 4609.742       187.7874 4570.519       186.8187 614.0884 12.54872 611.4720 12.53741 2.616455       17.73857 
1 1 1 4   8  11 o 510.8869 7.455594 3183.425       92.82034 3241.789       132.8361 3127.738       129.7537 515.2853 10.57870 506.1456 10.51982 9.139679       14.91896 
1 1 1 4   8  12 o 254.2059 4.074311 787.5882       25.23922 784.0194       35.54243 791.2184       35.84682 253.5941 5.751378 254.7551 5.774196 -1.161041      8.149828 
1 1 1 4   8  13 o 1153.315 16.45293 16280.45       462.4101 16448.25       658.5521 16117.25       649.4365 1156.593 23.36542 1144.935 23.27661 11.65723       32.98096 
1 1 1 4   8  14 o 84.60801 2.515693 87.30937       5.181108 76.74698       6.959875 100.4385       7.759568 79.27347 3.612270 90.71394 3.516827 -11.44047      5.041484 
1 1 1 4   8  15 o 412.9956 7.127566 2080.248       71.73362 2096.987       87.99831 2047.092       123.8450 414.5555 8.710751 409.1015 12.43701 5.453918       15.18408 
1 1 1 4   8  16 o 114.2144 3.055937 159.0900       8.497888 165.2503       13.59308 155.1378       10.88783 116.3306 4.805336 112.7498 3.968872 3.580803       6.232431 
1 1 1 4   8  17 o 107.9207 3.043062 142.0546       7.994993 141.3217       12.48640 142.5638       10.40841 107.5619 4.775587 108.0764 3.958693 -0.5145111     6.203022 
1 1 1 4   8  18 o 105.5387 3.069825 135.8654       7.886784 126.2619       12.02111 143.1231       10.45032 101.6474 4.867162 108.2848 3.966984 -6.637413      6.279031 
1 1 1 4   8  19 o 275.3123 5.068408 924.3275       34.00425 864.3065       54.98449 961.5002       43.27136 265.8847 8.497061 280.7273 6.325282 -14.84259      10.59289 
1 1 1 4   8  20 o 222.6098 4.475542 604.3077       24.27873 655.5734       44.90472 583.1309       28.86088 231.5137 7.971271 218.6320 5.417011 12.88167       9.637695 
1 1 1 4   8  21 o 315.2641 4.939459 1212.624       37.94810 1249.982       54.60875 1177.737       52.77182 319.8710 7.005696 310.4933 6.974509 9.377625       9.885523 
1 1 1 4   8  22 o 236.1970 4.545796 680.7198       26.16499 670.4403       31.86054 702.0137       45.85600 234.3231 5.579584 239.3980 7.871009 -5.074860      9.648033 
1 1 1 4   8  23 o 156.1794 3.178263 297.4626       12.09622 287.7053       16.57639 308.5766       17.69128 153.4694 4.436987 158.9309 4.572635 -5.461472      6.371487 
1 1 1 4   8  24 o 155.0560 3.181234 293.2616       12.02044 290.3864       16.62778 296.4091       17.39725 154.1521 4.430977 155.7273 4.589376 -1.575226      6.379336 
1 1 1 4   8  25 o 94.38115 2.918238 108.7585       6.703782 109.3770       9.130695 108.0352       9.874037 94.56758 3.970937 93.95171 4.324344 0.6158752      5.870971 
1 1 1 4   8  26 o 19.88307 6.099111 4.842485       3.236374 4.921407       4.136036 4.717855       5.197546 20.69528 6.949594 21.46891 7.752087 -0.7736359     10.41113 
1 1 1 4   8  27 o 222.4134 4.514518 604.7729       24.46856 605.2277       29.56014 603.7833       43.60901 222.3247 5.456105 221.2628 8.101501 1.061905       9.767467 
1 1 1 4   8  28 o 166.7075 3.355585 339.3557       13.63200 341.1956       18.96703 337.3897       19.60596 166.9262 4.667294 165.9586 4.853098 0.9676208      6.733216 
1 1 1 4   8  29 o 236.5712 4.658675 685.1554       26.85718 662.8885       43.84552 698.5273       33.97756 231.5923 7.780041 238.5449 5.845020 -6.952560      9.731049 
1 1 1 4   8  30 o 84.32563 3.118070 86.96869       6.396360 78.51247       8.481590 98.12048       9.740062 79.96518 4.369115 89.40392 4.484956 -9.438744      6.261309 
1 1 1 4   8  31 o 177.1007 3.504623 383.4839       15.12508 359.8283       20.47526 411.8962       22.43964 171.1978 4.912976 183.1414 5.032746 -11.94366      7.033197 
1 1 1 4   8  32 o 106.0399 3.817152 137.8156       9.847722 150.3279       18.21401 132.6472       11.70625 110.0641 6.824416 103.8845 4.635817 6.179596       8.250057 
1 1 1 4   8  33 o 51.91070 3.863910 33.19279       4.852819 34.16230       6.475171 31.95044       7.329871 52.45517 5.131103 50.51894 6.075767 1.936226       7.952557 
1 1 1 4   8  34 o 107.8125 3.601886 142.5730       9.449849 143.6904       11.40157 140.1208       16.88935 108.0736 4.338027 106.0666 6.566483 2.006981       7.870017 
1 1 1 4   8  35 o 115.8459 3.231514 164.5052       9.113777 153.4668       12.16992 178.6008       13.75231 111.5771 4.485002 120.3139 4.699587 -8.736870      6.496257 
1 1 1 4   8  36 o 38.35310 4.906671 18.47338       4.480992 17.46554       5.828821 19.92969       7.006678 36.80769 6.746954 39.12857 7.622361 -2.320877      10.17948 
1 1 1 4   8  37 o 38.58579 4.813560 18.74210       4.427995 20.39659       5.816079 16.46076       6.829566 39.88901 6.183297 35.19514 8.127106 4.693874       10.21191 
1 1 1 4   8  38 o 18.64249 7.043545 3.421901       4.376589 3.659628       4.965477 2.594199       9.265288 19.55247 7.475235 23.14274 9.717279 -3.590263      12.25988 
1 1 1 4   8  39 o 52.36225 4.009845 34.32803       5.077679 33.41678       6.576168 35.67342       7.990550 51.12834 5.357533 52.34111 6.397472 -1.212765      8.344508 
1 1 1 4   8  40 o 24.22133 7.186331 8.007990       4.547015 11.75317       6.318415 3.984878       6.548664 28.79544 8.452519 20.91703 8.405124 7.878407       11.92020 
1 1 1 4   8  41 o 19.18649 6.676889 4.712122       3.825099 4.014554       4.947112 5.749091       6.031718 19.18177 7.427966 21.68606 8.251408 -2.504292      11.10227 
1 1 1 4   8  42 o 19.26928 6.613428 5.028945       3.747591 2.192883       4.700724 9.975430       6.208049 16.80365 6.978242 25.50603 8.513441 -8.702381      11.00793 
1 1 1 4   8  43 o 22.09943 7.595510 7.505976       4.943757 5.366876       8.955578 8.443559       5.929020 21.35469 9.271300 23.04929 8.285180 -1.694605      12.43387 
1 1 1 4   8  44 o 15.55900 6.460650 2.485851       4.028630 3.402318       4.660009 -0.2255258     8.015364 16.91106 6.978394 17.04406 7.935206 -0.1329994     10.56719 
1 1 1 4   8  45 o 11.02802 5.344593 -4.771363      4.449314 -6.788036      8.152783 -3.915962      5.309738 14.25797 6.981071 12.51037 6.006360 1.747602       9.209327 
1 1 1 4   8  46 o 10.79851 5.060962 -1.574915      3.350163 1.874056       4.654361 -5.282936      4.825989 14.63912 6.506806 11.06669 5.408441 3.572433       8.461073 
1 1 1 4   8  47 o 19.58595 6.728352 7.390511       3.879225 10.31793       5.490795 4.473190       5.481322 21.11016 7.907860 16.09760 7.112861 5.012558       10.63612 
1 1 1 4   8  48 o 10.54462 5.052676 -1.882820      3.716545 -3.017360      4.505265 0.5337961      6.575282 10.90227 5.305352 13.70744 6.607258 -2.805174      8.473642 
1 1 1 4   8  49 o 9.662981 4.738135 -3.545678      3.797541 -2.857265      5.695833 -4.096576      5.095278 11.63519 5.724650 10.78575 5.327109 0.8494396      7.819828 
1 1 1 4   9  0  o 302.7876 4.669063 1117.899       34.45116 1151.099       69.62708 1107.136       39.64417 306.7726 9.324595 301.2889 5.399581 5.483673       10.77514 
1 1 1 4   9  1  o 390.3006 5.821921 1858.276       55.37346 1784.148       76.41573 1940.238       80.35227 382.2176 8.204197 398.5788 8.272711 -16.36124      11.65103 
1 1 1 4   9  2  o 198.0894 4.678735 478.4731       22.58529 495.0308       32.49016 462.9904       31.41768 201.3020 6.632249 194.6712 6.632404 6.630798       9.379526 
1 1 1 4   9  3  o 298.0651 5.291459 1083.537       38.43462 1039.159       45.98575 1186.373       70.00293 291.8287 6.466350 311.4489 9.233643 -19.62027      11.27270 
1 1 1 4   9  4  o 362.6591 6.272233 1604.638       55.43154 1636.819       68.95525 1545.855       93.19429 366.1525 7.728037 355.3359 10.77497 10.81662       13.25981 
1 1 1 4   9  5  o 392.8726 5.823774 1882.711       55.75609 1787.964       76.48580 1990.156       81.45016 382.6541 8.202352 403.7027 8.279311 -21.04858      11.65442 
1 1 1 4   9  6  o 327.5187 4.982010 1307.976       39.76278 1390.848       83.57879 1283.731       45.20658 337.1866 10.18328 324.4310 5.717988 12.75565       11.67881 
1 1 1 4   9  7  o 201.4412 3.035947 494.5496       14.90317 501.8722       23.94810 489.9214       19.03901 202.8884 4.843707 200.4804 3.897053 2.407974       6.216794 
1 1 1 4   9  8  o 837.8213 12.00371 8581.786       245.0772 8626.138       492.7985 8567.213       282.4874 835.3203 24.23481 836.6403 13.85556 -1.319946      27.91599 
1 1 1 4   9  9  o 148.7957 2.860040 269.8111       10.37048 282.7346       15.02702 258.0588       14.32994 152.2508 4.053813 145.4507 4.046829 6.800186       5.728021 
1 1 1 4   9  10 o 679.3226 9.783132 5632.676       161.9534 5499.797       225.3876 5774.523       232.8690 670.6859 13.79033 687.2130 13.90542 -16.52710      19.58402 
1 1 1 4   9  11 o 380.7044 5.704007 1766.934       52.91808 1763.137       74.77439 1770.744       74.90069 380.1906 8.070780 381.0099 8.067024 -0.8193970     11.41115 
1 1 1 4   9  12 o 660.2551 9.518563 5319.628       153.1508 5353.686       217.5198 5286.147       215.6680 661.8658 13.48630 657.6820 13.45655 4.183777       19.05148 
1 1 1 4   9  13 o 367.4276 5.536607 1645.804       49.57373 1675.352       70.87685 1617.504       69.36335 370.6131 7.847793 364.1600 7.816309 6.453125       11.07622 
1 1 1 4   9  14 o 349.9527 5.315640 1492.966       45.33160 1444.591       62.76915 1545.702       65.53754 344.1488 7.484518 355.9857 7.554773 -11.83688      10.63450 
1 1 1 4   9  15 o 229.6906 5.382178 643.1971       30.12572 665.2493       41.71708 619.1641       43.55044 233.4217 7.343061 225.1418 7.950281 8.279846       10.82255 
1 1 1 4   9  16 o 221.6392 3.748658 598.7346       20.24689 585.8942       28.21840 612.3591       29.06734 219.2161 5.282310 224.1114 5.322372 -4.895294      7.498696 
1 1 1 4   9  17 o 246.8359 4.056437 742.6840       24.39996 771.3285       35.19446 716.1738       33.85786 251.4983 5.742528 242.3400 5.733215 9.158279       8.114578 
1 1 1 4   9  18 o 684.6229 9.890576 5727.667       165.0096 5675.497       231.7943 5781.270       234.9553 680.5088 13.97761 686.8034 14.03837 -6.294617      19.81034 
1 1 1 4   9  19 o 64.90887 3.186771 51.47792       5.025293 49.53068       7.210452 53.31711       7.007566 63.55993 4.688246 65.98159 4.383060 -2.421665      6.418011 
1 1 1 4   9  20 o 311.7565 4.879294 1185.561       37.06881 1157.465       51.49719 1215.773       53.40105 307.8716 6.864010 315.5225 6.945178 -7.650940      9.764739 
1 1 1 4   9  21 o 319.4961 7.086667 1247.512       55.17517 1244.644       79.31741 1250.201       76.80230 318.4483 10.23429 319.2368 9.884366 -0.7884521     14.22819 
1 1 1 4   9  22 o 101.0618 2.829196 124.6184       6.960793 125.7365       9.590719 123.3739       10.11857 101.4526 3.886476 100.4756 4.141469 0.9769669      5.679477 
1 1 1 4   9  23 o 66.38170 2.985259 53.84488       4.816747 53.56449       6.369979 54.21927       7.360752 66.13538 3.970752 66.48555 4.570983 -0.3501740     6.054813 
1 1 1 4   9  24 o 316.8124 4.978080 1226.456       38.43264 1185.069       52.99816 1272.359       55.81509 310.9893 6.993252 322.2092 7.108494 -11.21991      9.971773 
1 1 1 4   9  25 o 176.2352 3.388626 379.0204       14.55299 363.9960       19.88409 396.3529       21.35681 172.5157 4.734257 180.0060 4.873188 -7.490219      6.794200 
1 1 1 4   9  26 o 220.3992 3.852745 593.2103       20.69267 587.9572       28.82728 598.7941       29.72088 219.1830 5.397101 221.1723 5.514358 -1.989212      7.716012 
1 1 1 4   9  27 o 304.7468 4.864104 1136.248       36.12252 1089.602       49.56302 1189.099       52.75630 297.8321 6.828891 311.0850 6.959198 -13.25290      9.750086 
1 1 1 4   9  28 o 162.5014 3.885867 322.7234       15.38796 335.3479       18.72466 296.4603       27.00717 165.4776 4.648029 155.0286 7.168171 10.44908       8.543234 
1 1 1 4   9  29 o 121.0246 3.439617 179.0894       10.13396 166.3135       15.33015 189.0055       13.50576 116.3189 5.423220 124.1856 4.470136 -7.866699      7.028046 
1 1 1 4   9  30 o 112.7376 3.073051 155.3520       8.434691 147.9302       11.37213 164.4274       12.57532 109.8488 4.256309 115.7860 4.465207 -5.937248      6.168811 
1 1 1 4   9  31 o 58.82767 3.529342 42.47014       5.036280 36.29369       6.600195 51.07858       7.792007 54.14512 5.060835 64.32109 5.010689 -10.17597      7.121731 
1 1 1 4   9  32 o 80.00838 3.327969 78.41644       6.474430 80.37769       8.923376 76.23624       9.408312 80.81873 4.549230 78.63309 4.934754 2.185646       6.711728 
1 1 1 4   9  33 o 33.08088 6.021429 13.92237       4.675371 9.956297       5.528093 23.88647       8.762218 27.86551 7.822410 42.94478 8.671787 -15.07927      11.67861 
1 1 1 4   9  34 o 62.54134 3.563944 48.08063       5.409195 42.97517       7.021518 55.53399       8.483786 58.86998 4.939936 66.90504 5.245400 -8.035065      7.205358 
1 1 1 4   9  35 o 30.61283 5.956009 12.01475       4.283222 9.169661       5.485375 16.45947       6.856160 26.74033 7.882690 35.46507 8.109971 -8.724739      11.30966 
1 1 1 4   9  36 o 139.3850 3.310507 238.4391       11.24467 233.1780       15.27183 244.6686       16.61806 137.3188 4.570147 140.5309 4.859889 -3.212067      6.671189 
1 1 1 4   9  37 o 22.44893 6.732632 6.466514       3.974367 7.003649       5.021732 5.566049       6.501975 23.61544 7.645624 23.05965 8.611935 0.5557861      11.51612 
1 1 1 4   9  38 o 69.76656 3.469589 60.24744       5.880260 49.34504       7.490052 77.76219       9.493486 62.60626 4.949674 78.65966 4.978186 -16.05340      7.020086 
1 1 1 4   9  39 o 28.83788 7.381407 11.33187       5.208579 11.41571       6.204515 11.13175       9.585386 28.75650 8.357793 29.01719 10.52061 -0.2606869     13.43637 
1 1 1 4   9  40 o 75.79488 3.436966 71.74462       6.331690 70.93694       8.378113 72.82028       9.668624 74.63374 4.629330 75.11002 5.316755 -0.4762878     7.049722 
1 1 1 4   9  41 o 14.68696 6.128520 1.161950       3.650800 0.5118130      4.657972 2.197427       5.878475 15.54813 6.718445 18.34750 7.724140 -2.799369      10.23718 
1 1 1 4   9  42 o 44.45394 4.367690 25.83871       4.670468 29.57557       6.195437 20.91945       7.108352 46.64511 5.559725 37.04876 8.099753 9.596355       9.824284 
1 1 1 4   9  43 o 14.44045 6.711488 -2.228652      5.695403 -4.261153      8.549011 -0.6066892     7.636967 16.45095 7.821646 17.19299 7.913019 -0.7420330     11.12628 
1 1 1 4   9  44 o 15.62679 6.300590 2.906570       3.693258 4.578961       4.877196 0.6584251      5.654750 18.00410 7.246967 15.51785 7.012329 2.486244       10.08421 
1 1 1 4   9  45 o 26.54134 6.103401 11.09353       3.865091 12.26102       5.312852 9.780942       5.633346 25.82115 7.793244 22.52134 8.078332 3.299812       11.22471 
1 1 1 4   9  46 o 12.60651 5.632084 0.6727704      3.533521 1.404851       4.897149 -0.1223204     5.103547 14.35933 6.503633 13.61397 6.336108 0.7453642      9.079841 
1 1 1 4   9  47 o 12.56285 5.645944 1.033324       3.608604 3.420175       4.956487 -1.658954      5.264064 15.09405 6.711510 12.48598 5.990935 2.608072       8.996426 
1 1 1 4   9  48 o 16.61645 6.643046 5.838521       4.069103 18.01433       6.349858 -2.645321      5.300432 25.88278 8.609412 11.71281 5.711956 14.16997       10.33191 
1 1 1 4   10 0  o 408.5647 6.069435 2036.383       60.42897 1989.377       84.16232 2086.403       86.81853 403.5779 8.557643 413.2950 8.620175 -9.717102      12.14663 
1 1 1 4   10 1  o 211.1711 4.066178 543.6413       20.92459 538.4724       25.60970 554.0217       36.29230 210.1353 5.001144 212.9486 7.003171 -2.813309      8.605571 
1 1 1 4   10 2  o 436.1872 6.442347 2321.348       68.47832 2244.493       94.62615 2405.852       99.22324 428.6223 9.059417 443.7467 9.175763 -15.12433      12.89448 
1 1 1 4   10 3  o 97.83142 2.474118 116.7141       5.893676 114.4100       8.219051 119.1529       8.455824 96.81995 3.489246 98.80769 3.517406 -1.987740      4.954491 
1 1 1 4   10 4  o 435.0400 6.432261 2308.856       68.19130 2378.498       98.33492 2244.343       94.64501 441.2763 9.144523 428.6607 9.060411 12.61560       12.87297 
1 1 1 4   10 5  o 219.5927 3.637524 587.7604       19.46524 583.9631       27.34337 591.6619       27.71644 218.8428 5.127240 220.2795 5.163299 -1.436737      7.276554 
1 1 1 4   10 6  o 218.9656 3.635390 584.3865       19.39827 600.6643       40.37291 579.5008       22.11872 221.7511 7.481879 218.0372 4.162873 3.713852       8.562011 
1 1 1 4   10 7  o 926.9213 13.25842 10509.46       299.4819 10621.68       604.2452 10472.91       344.8132 925.9574 26.80671 924.7128 15.30174 1.244629       30.86654 
1 1 1 4   10 8  o 406.6782 5.397583 2016.309       53.49169 2038.404       85.43206 2002.061       68.60392 408.7215 8.577433 405.1624 6.948381 3.559052       11.03868 
1 1 1 4   10 9  o 379.1121 5.067566 1752.025       46.81696 1797.894       75.54549 1723.425       59.65282 383.9074 8.075063 375.9490 6.511273 7.958435       10.37320 
1 1 1 4   10 10 o 356.7319 5.387425 1551.318       46.83380 1582.685       67.11536 1521.547       65.38454 360.2318 7.645462 353.2078 7.596416 7.024078       10.77769 
1 1 1 4   10 11 o 349.8382 5.305243 1491.906       45.22813 1524.408       64.88403 1461.187       63.07866 353.5456 7.531063 346.1390 7.478178 7.406616       10.61320 
1 1 1 4   10 12 o 381.8663 5.726958 1777.743       53.29315 1774.324       75.29560 1781.176       75.44040 381.3932 8.101409 382.1289 8.101361 -0.7357178     11.45709 
1 1 1 4   10 13 o 537.2287 7.831042 3520.478       102.5215 3559.016       146.0312 3483.022       143.9654 539.8622 11.10009 534.0715 11.06172 5.790710       15.67079 
1 1 1 4   10 14 o 129.9280 3.106383 205.7279       9.835443 189.1908       15.43078 217.0436       12.76434 124.4727 5.097975 133.3881 3.931149 -8.915382      6.437646 
1 1 1 4   10 15 o 228.3549 4.454352 635.6383       24.78741 645.7792       30.20212 614.7126       43.38511 230.1469 5.385129 224.3212 7.949161 5.825714       9.601499 
1 1 1 4   10 16 o 269.6634 4.323423 886.4308       28.41095 877.8080       39.86698 895.3292       40.49877 268.2890 6.097816 270.9519 6.133573 -2.662872      8.648935 
1 1 1 4   10 17 o 274.1963 4.384895 916.5620       29.29927 966.0807       42.64453 872.2866       40.32366 281.4296 6.218097 267.4206 6.187696 14.00897       8.772247 
1 1 1 4   10 18 o 361.5592 5.501612 1594.435       48.47363 1656.712       70.14323 1537.504       67.06448 368.3622 7.814020 354.8677 7.755146 13.49454       11.00914 
1 1 1 4   10 19 o 343.8120 5.279253 1441.976       44.23129 1481.409       63.49675 1404.804       61.64914 348.2755 7.481565 339.1534 7.459242 9.122040       10.56476 
1 1 1 4   10 20 o 182.7662 4.514677 407.4490       20.10753 409.0602       27.94655 405.7198       28.95283 182.9269 6.278543 182.1528 6.533156 0.7740784      9.061028 
1 1 1 4   10 21 o 296.1850 5.480903 1071.052       39.55954 1045.841       68.64753 1083.586       48.40515 291.9006 9.663910 297.7684 6.670784 -5.867798      11.74268 
1 1 1 4   10 22 o 289.7538 4.616943 1024.810       32.60016 1033.047       46.18951 1016.634       46.01814 290.6569 6.521187 288.3343 6.549326 2.322601       9.242270 
1 1 1 4   10 23 o 76.65811 2.867086 71.76275       5.346492 68.51277       7.080938 76.07274       8.154337 74.82641 3.896717 78.82648 4.260865 -4.000069      5.774025 
1 1 1 4   10 24 o 175.6603 3.345327 376.4914       14.32018 363.0356       19.63665 391.7760       20.92861 172.3156 4.680683 178.9954 4.802363 -6.679810      6.706078 
1 1 1 4   10 25 f 93.02386 2.883183 105.6625       6.527968 105.7987       8.841463 105.4993       9.679191 93.00089 3.909947 92.83197 4.290237 0.1689148      5.804638 
1 1 1 4   10 26 o 148.2651 3.156133 268.2719       11.40330 260.5617       15.59552 277.1299       16.71613 145.9453 4.390033 150.4942 4.563331 -4.548950      6.332170 
1 1 1 4   10 27 o 80.32387 2.924716 78.84103       5.715297 73.80411       7.569588 85.51997       8.716523 77.60997 4.016043 83.52672 4.296787 -5.916748      5.881410 
1 1 1 4   10 28 o 71.56267 4.071639 62.81506       7.071249 61.24392       8.339005 66.83631       13.34097 70.55618 4.880082 73.24888 7.583518 -2.692696      9.018034 
1 1 1 4   10 29 f 43.82185 3.932920 23.67097       4.155308 24.69329       5.374550 22.15175       6.551749 44.60684 5.032017 41.92464 6.633330 2.682201       8.325999 
1 1 1 4   10 30 o 118.3869 3.099081 171.3276       8.933034 163.8894       12.03722 180.4459       13.32752 115.6150 4.279826 121.2796 4.517364 -5.664627      6.222820 
1 1 1 4   10 31 o 94.60644 3.089609 109.4851       7.113404 109.0789       9.565667 109.9877       10.63955 94.27818 4.173937 94.59343 4.629642 -0.3152542     6.233405 
1 1 1 4   10 32 f 18.98452 6.743954 3.868780       3.916531 3.797300       4.511252 4.087536       7.891969 19.55953 7.197636 23.56411 9.305993 -4.004580      11.76467 
1 1 1 4   10 33 o 75.08040 4.264494 69.40392       7.770352 78.21122       14.29117 65.70745       9.258480 78.89316 7.524517 72.85028 5.250437 6.042877       9.175262 
1 1 1 4   10 34 o 17.07258 6.569002 2.448610       3.851183 1.234194       4.872941 4.469236       6.285655 17.32333 7.141031 22.11799 8.421511 -4.794668      11.04157 
1 1 1 4   10 35 o 92.66306 3.239903 105.3741       7.304761 100.3381       9.673155 112.0570       11.14308 90.14130 4.417053 95.15297 4.821302 -5.011673      6.538754 
1 1 1 4   10 36 o 78.41674 3.343368 75.65110       6.374280 76.61108       8.377083 74.33086       9.824011 78.64259 4.388589 77.18653 5.254219 1.456055       6.845913 
1 1 1 4   10 37 o 86.53557 3.267011 92.25775       6.877028 93.13705       9.161469 91.12275       10.40864 86.57922 4.356252 85.36306 5.025900 1.216164       6.651060 
1 1 1 4   10 38 f 37.08252 5.509227 17.69797       4.827409 18.76560       5.553496 14.39710       9.764921 37.94375 6.221497 32.27694 10.67441 5.666813       12.35516 
1 1 1 4   10 39 o 36.98119 5.687254 17.85001       4.961374 14.32627       5.543334 32.03830       11.12331 32.44015 7.200152 47.06959 10.00596 -14.62944      12.32727 
1 1 1 4   10 40 o 32.83965 5.572788 14.29788       4.300460 17.85913       5.479401 8.585619       6.939618 36.34379 6.421599 25.13343 8.971823 11.21036       11.03316 
1 1 1 4   10 41 o 13.43768 5.844857 0.3882844E-01  3.572938 1.720703       4.592400 -2.540455      5.687121 16.42877 6.865795 14.87937 6.841016 1.549404       9.692195 
1 1 1 4   10 42 o 17.10497 6.604960 3.410633       3.903387 0.7003248      4.954031 7.848144       6.338975 15.67635 6.849390 22.89119 8.512242 -7.214840      10.92577 
1 1 1 4   10 43 o 13.36689 6.347497 -3.975587      5.595862 -1.964778      8.493152 -5.518113      7.438744 17.09721 8.027338 14.81687 7.112567 2.280344       10.72505 
1 1 1 4   10 44 o 33.42116 5.480420 16.29906       4.308889 22.75543       5.865925 8.732570       6.350227 38.36486 6.506565 21.79585 8.422306 16.56902       10.64287 
1 1 1 4   10 45 o 20.36621 6.571761 6.983983       3.712068 6.332617       5.106689 7.713765       5.405345 18.97415 7.488156 20.27292 7.787044 -1.298773      10.80326 
1 1 1 4   10 46 o 10.72017 5.083410 -2.038515      3.564093 -4.265514      4.838443 0.6034011      5.269933 11.32613 5.508531 14.02771 6.497639 -2.701583      8.518405 
1 1 1 4   10 47 o 13.86164 5.993199 2.614610       3.710903 7.661226       5.369002 -2.001406      5.134843 18.16966 7.493386 12.12578 5.843357 6.043882       9.502402 
1 1 1 4   10 48 o 12.40081 5.739629 0.9131690      4.100283 -4.149525      6.360412 4.513279       5.363549 11.91898 5.898641 15.08276 6.821236 -3.163777      9.017940 
1 1 1 4   11 0  o 312.5332 4.829705 1190.947       36.78348 1108.218       70.42136 1221.987       43.13558 301.0290 9.612072 316.5433 5.591991 -15.51428      11.12035 
1 1 1 4   11 1  o 539.9069 7.864152 3558.036       103.4682 3396.542       141.7448 3742.237       151.3825 527.0617 11.03594 553.1997 11.22943 -26.13800      15.74459 
1 1 1 4   11 2  o 123.8390 2.675913 186.8990       8.075429 180.5826       11.16296 193.8336       11.69647 121.6582 3.769869 126.0451 3.812345 -4.386902      5.361519 
1 1 1 4   11 3  o 194.6965 3.367851 462.0090       15.97891 438.2970       21.90331 488.9853       23.36238 189.5476 4.745664 200.2698 4.787023 -10.72221      6.740691 
1 1 1 4   11 4  o 557.1586 8.102305 3788.380       110.0078 3853.592       157.4872 3726.243       153.7299 561.4802 11.50999 552.1375 11.42550 9.342651       16.21795 
1 1 1 4   11 5  o 383.3441 5.126306 1791.587       47.88830 1723.552       73.79628 1841.078       62.94038 375.8331 8.057556 388.5251 6.647741 -12.69205      10.44589 
1 1 1 4   11 6  o 699.9046 10.07821 5981.061       171.8930 6258.156       355.4301 5896.466       196.3867 713.3589 20.46724 694.7051 11.60047 18.65381       23.52613 
1 1 1 4   11 7  o 169.0925 3.104177 348.4436       12.79107 347.9858       26.98067 348.5763       14.52738 168.8013 6.571603 169.1203 3.524970 -0.3190460     7.457304 
1 1 1 4   11 8  o 271.1506 3.820198 896.0569       25.24251 906.0768       40.39785 889.6391       32.33125 272.6103 6.081069 270.1558 4.911024 2.454468       7.816493 
1 1 1 4   11 9  o 427.4177 5.652187 2227.094       58.87150 2269.261       94.42166 2200.277       75.29993 431.2727 8.984286 424.7635 7.274635 6.509125       11.56018 
1 1 1 4   11 10 o 275.4055 4.344368 924.4533       29.15650 930.3013       60.09481 922.6530       33.34393 275.9934 8.946980 275.1241 4.973384 0.8692932      10.23636 
1 1 1 4   11 11 o 279.9388 5.044846 955.2508       34.41494 997.3143       60.42531 935.0550       41.86935 285.7846 8.686572 276.9335 6.204185 8.851135       10.67466 
1 1 1 4   11 12 o 446.4926 7.589264 2431.519       82.57529 2413.985       141.4687 2440.580       101.6975 444.2430 13.08209 447.2071 9.331803 -2.964142      16.06934 
1 1 1 4   11 13 o 337.5939 5.914465 1389.584       48.65709 1331.151       81.08859 1422.461       60.82413 330.0559 10.09362 341.5042 7.308762 -11.44827      12.46191 
1 1 1 4   11 14 o 274.3423 4.363724 917.4089       29.17333 895.5854       40.70606 940.4560       41.83161 271.0063 6.163729 277.7117 6.181221 -6.705383      8.729206 
1 1 1 4   11 15 o 265.4864 6.016564 859.5179       38.92485 852.5082       53.07344 867.6774       57.26084 264.1757 8.254326 266.4693 8.830285 -2.293610      12.08751 
1 1 1 4   11 16 o 277.3544 5.053197 937.9305       34.15368 915.3735       41.58713 984.6649       59.85992 273.9507 6.229460 283.8625 8.663646 -9.911774      10.67075 
1 1 1 4   11 17 o 201.7466 3.549068 496.1241       17.44844 512.3339       25.01275 480.7592       24.35214 204.9757 5.007524 198.4943 5.038534 6.481400       7.103670 
1 1 1 4   11 18 o 85.47884 2.730402 89.14376       5.680203 84.71291       7.768554 94.23390       8.326478 83.26987 3.838718 87.83061 3.899992 -4.560738      5.472266 
1 1 1 4   11 19 o 472.6524 8.051282 2730.632       92.73486 2749.738       114.4118 2694.039       158.3347 473.9188 9.906737 467.8127 13.90434 6.106018       17.07261 
1 1 1 4   11 20 o 204.0278 3.597906 507.6077       17.88855 491.2487       24.77510 525.4253       25.85596 200.5710 5.072941 207.4940 5.113510 -6.922989      7.202966 
1 1 1 4   11 21 o 93.90849 4.053730 107.7862       9.254901 0.000000       0.000000 107.7862       9.254901 ?        ?        93.90849 4.053730 0.000000       4.053730 
1 1 1 4   11 22 o 171.2945 3.298714 357.8816       13.76969 350.9525       19.10786 365.3673       19.86051 169.4809 4.630869 172.9200 4.717535 -3.439163      6.610604 
1 1 1 4   11 23 o 128.0296 2.954390 199.9214       9.217527 194.5555       12.62233 206.0523       13.49221 126.1746 4.110661 129.8379 4.270087 -3.663345      5.927155 
1 1 1 4   11 24 o 78.82021 2.859129 75.87862       5.482610 72.99583       7.302994 79.60171       8.299391 77.22607 3.893176 80.62099 4.239267 -3.394920      5.755711 
1 1 1 4   11 25 o 207.2862 3.692313 524.6002       18.65112 544.5156       26.58541 505.2983       26.17278 210.9785 5.170933 203.1521 5.291298 7.826431       7.398404 
1 1 1 4   11 26 o 84.54007 2.894454 87.30792       5.954213 84.37171       8.067967 90.82001       8.823756 83.00579 4.000369 86.10315 4.218151 -3.097359      5.813412 
1 1 1 4   11 27 o 157.4906 3.645922 302.9935       13.99259 273.3127       21.31005 325.4894       18.55235 149.1592 5.874194 163.0315 4.674551 -13.87225      7.507169 
1 1 1 4   11 28 o 183.1175 4.072925 410.0661       18.17492 406.5985       21.66492 418.3043       33.39318 182.1315 4.885720 184.0126 7.462354 -1.881180      8.919472 
1 1 1 4   11 29 o 162.4467 3.347419 322.4289       13.25125 302.5513       17.91145 346.4635       19.69555 157.0824 4.684383 168.0761 4.813642 -10.99367      6.716739 
1 1 1 4   11 30 o 45.02670 3.967080 25.00118       4.308417 20.90178       5.471460 31.69120       6.989666 40.86071 5.645610 50.44199 5.791198 -9.581280      8.087700 
1 1 1 4   11 31 o 35.55742 4.794610 15.79027       4.048735 19.35992       5.160142 10.07306       6.530419 39.29680 5.542223 28.34602 8.657834 10.95078       10.27980 
1 1 1 4   11 32 o 50.39478 4.213513 31.35569       5.127152 31.16485       6.020657 31.85936       9.780861 50.10666 4.997314 49.88870 8.339369 0.2179604      9.722048 
1 1 1 4   11 33 o 65.53252 4.377002 52.97845       6.949805 78.53279       14.33602 45.12795       7.945935 79.00810 7.537195 60.24000 5.472487 18.76810       9.314366 
1 1 1 4   11 34 o 39.57381 4.651397 19.54148       4.400123 21.91018       5.703190 16.05803       6.916199 41.68991 5.768083 35.04944 8.237620 6.640465       10.05630 
1 1 1 4   11 35 o 61.36212 3.580689 46.38933       5.331040 44.16006       6.949487 49.57698       8.310115 59.59452 4.826584 62.99372 5.467540 -3.399197      7.293141 
1 1 1 4   11 36 o 129.1399 3.265549 204.9886       10.26843 194.2886       13.63529 219.0072       15.60713 125.2428 4.474804 132.8035 4.830606 -7.560699      6.584726 
1 1 1 4   11 37 o 111.9512 3.716921 154.9711       10.12618 146.9950       11.71266 178.5766       20.14975 108.6949 4.431203 118.0089 7.038770 -9.313934      8.317442 
1 1 1 4   11 38 o 37.51242 5.446919 18.13165       4.833798 18.81884       6.655248 17.36438       7.032377 37.36562 7.568708 35.56791 8.270508 1.797710       11.21101 
1 1 1 4   11 39 o 19.08373 6.978110 4.176125       4.229664 4.600503       4.801707 2.706583       8.935327 20.06224 7.418137 22.19411 9.441190 -2.131870      12.00687 
1 1 1 4   11 40 o 14.43975 6.081750 0.8391934      3.646976 0.2006302      4.526111 2.021223       6.157968 15.21420 6.598306 18.67530 7.886217 -3.461099      10.28251 
1 1 1 4   11 41 o 23.86923 6.628195 8.118633       3.992241 10.32233       5.104019 4.645638       6.407499 26.45599 7.547231 20.52413 8.290449 5.931852       11.21126 
1 1 1 4   11 42 o 58.94688 4.353583 45.66688       6.209665 53.87247       7.599825 29.18512       10.77087 63.37140 4.960745 39.74367 10.82872 23.62773       11.91093 
1 1 1 4   11 43 o 12.07718 5.486227 -0.8798786     3.516369 -1.258244      4.663176 -0.3811307     5.353856 13.49182 6.199976 14.85395 6.756202 -1.362130      9.169840 
1 1 1 4   11 44 f 22.39511 7.515066 8.780914       4.836569 6.749756       9.066820 9.588766       5.718063 20.16413 9.014227 22.72467 8.140326 -2.560541      12.14583 
1 1 1 4   11 45 o 38.15654 4.873939 21.14454       4.428624 25.51413       6.204205 16.60524       6.323539 39.35222 6.710123 28.78546 8.457666 10.56676       10.79620 
1 1 1 4   11 46 o 20.56400 6.555847 7.717095       3.702190 7.692318       5.276027 7.741129       5.196260 19.08023 7.585364 19.17415 7.557729 -0.9392548E-01 10.70780 
1 1 1 4   11 47 o 15.54600 6.510525 4.464114       4.142498 3.891467       6.292986 4.902001       5.502935 15.33370 7.101810 15.85181 7.058699 -0.5181036     10.01304 
1 1 1 4   11 48 o 12.41427 5.613392 1.501971       3.630326 1.097000       4.941919 1.976673       5.350502 12.92132 6.084352 13.54287 6.362588 -0.6215467     8.803514 
1 1 1 4   12 0  o 201.2074 3.498590 493.4208       17.15431 511.0064       34.91676 487.8258       19.69506 204.5539 7.015089 200.0539 4.039934 4.500015       8.095218 
1 1 1 4   12 1  o 187.8313 4.714998 430.3623       21.56463 0.000000       0.000000 430.3623       21.56463 ?        ?        187.8313 4.714998 0.000000       4.714998 
1 1 1 4   12 2  o 260.2850 4.163929 825.7886       26.41123 825.6013       37.28925 825.9771       37.41330 260.2065 5.880704 260.2651 5.898940 -0.5856323E-01 8.329476 
1 1 1 4   12 3  o 246.3513 3.996144 739.7067       23.99010 793.0068       35.20250 693.4871       32.78103 255.0299 5.664301 238.4915 5.640448 16.53831       7.993682 
1 1 1 4   12 4  o 745.0513 10.71328 6778.754       194.5113 6439.753       265.4213 7172.023       285.8773 725.4017 15.01485 765.4644 15.32564 -40.06274      21.45510 
1 1 1 4   12 5  o 555.8464 8.090564 3769.091       109.5897 3958.913       227.1686 3711.516       125.1106 568.3770 16.41841 551.4775 9.309583 16.89941       18.87412 
1 1 1 4   12 6  o 487.1936 6.381144 2894.099       75.75934 2793.228       117.0613 2966.796       99.37733 478.3808 10.04162 493.1573 8.269243 -14.77655      13.00825 
1 1 1 4   12 7  o 379.6182 5.700889 1756.842       52.73824 1780.444       107.5976 1749.378       60.50449 381.6660 11.58206 378.7784 6.554904 2.887604       13.30830 
1 1 1 4   12 8  o 200.9434 3.462803 492.0815       16.95655 485.7637       35.12114 494.0017       19.36277 199.4538 7.237873 201.3293 3.946613 -1.875488      8.243940 
1 1 1 4   12 9  f 162.8452 2.722675 323.1531       10.80456 316.5446       17.35104 327.3387       13.80848 161.0950 4.424037 163.8904 3.457453 -2.795410      5.614810 
1 1 1 4   12 10 o 873.6702 11.18308 9319.906       238.0921 9929.641       393.9357 8968.988       298.8532 900.3101 17.95548 856.4912 14.31854 43.81891       22.96563 
1 1 1 4   12 11 o 443.5211 6.531697 2398.627       70.59540 2606.009       148.6053 2338.186       80.22595 461.5692 13.22542 437.8437 7.518993 23.72556       15.21338 
1 1 1 4   12 12 o 275.4924 4.377465 925.0883       29.38789 956.1083       42.55454 896.8057       40.63348 280.0208 6.236192 271.2005 6.148335 8.820374       8.757403 
1 1 1 4   12 13 o 278.7064 4.425846 946.8354       30.05934 941.8262       42.54894 951.8264       42.47181 277.9116 6.282696 279.3847 6.238240 -1.473114      8.853694 
1 1 1 4   12 14 f 151.4151 3.601448 279.4297       13.28870 282.9704       15.90517 271.2442       24.18339 152.3017 4.289733 148.9782 6.678267 3.323456       7.937322 
1 1 1 4   12 15 o 488.1443 8.325176 2908.566       99.03250 2820.314       118.4393 3113.647       180.5491 480.4772 10.11549 503.8936 14.71926 -23.41644      17.86001 
1 1 1 4   12 16 o 66.27142 3.460463 53.67797       5.569154 64.75192       11.59790 50.35934       6.349028 72.54989 6.633358 64.14333 4.083005 8.406555       7.789248 
1 1 1 4   12 17 o 388.6791 5.864971 1843.033       55.55116 1818.467       77.76287 1868.635       79.38465 385.8411 8.270423 391.1202 8.328948 -5.279144      11.73760 
1 1 1 4   12 18 o 557.6733 9.394446 3804.575       127.6695 3804.487       156.7246 3804.749       220.1166 557.0989 11.54433 555.2344 16.28583 1.864563       19.96246 
1 1 1 4   12 19 o 404.3794 6.082437 1996.630       59.93806 1959.947       83.79806 2035.057       85.76665 400.2291 8.591900 407.8182 8.630098 -7.589142      12.17782 
1 1 1 4   12 20 o 72.21904 2.796728 63.67921       4.912656 61.56386       6.777435 66.02112       7.131141 70.93468 3.936198 73.46065 3.998606 -2.525970      5.610927 
1 1 1 4   12 21 o 131.8026 3.585838 212.0596       11.50660 204.7054       21.48413 215.0178       13.62565 129.1750 6.849492 132.6724 4.219812 -3.497375      8.045021 
1 1 1 4   12 22 o 296.5160 5.384262 1074.558       38.90545 1059.785       65.25403 1082.705       48.46071 293.4926 9.134887 297.3920 6.686893 -3.899384      11.32081 
1 1 1 4   12 23 o 111.8075 2.867158 152.5720       7.805492 152.2234       10.78705 152.9552       11.30868 111.5938 3.973015 111.8452 4.156374 -0.2513504     5.749808 
1 1 1 4   12 24 o 382.2991 5.839645 1789.312       54.40337 1832.156       77.93331 1748.590       75.97985 385.9184 8.286889 377.0221 8.269810 8.896301       11.70736 
1 1 1 4   12 25 o 65.11499 3.004348 51.84478       4.754395 54.91699       6.418685 48.11022       7.076857 66.93703 3.952583 62.55653 4.676116 4.380501       6.122825 
1 1 1 4   12 26 o 185.6188 3.931424 420.9834       17.78312 403.6152       28.33484 432.2703       22.84188 181.2155 6.426543 187.8643 4.993865 -6.648804      8.138743 
1 1 1 4   12 27 o 91.37702 2.940895 102.0215       6.540134 102.2095       8.869190 101.7976       9.682531 91.35406 3.993656 91.12302 4.373149 0.2310486      5.922307 
1 1 1 4   12 28 o 136.1790 3.665910 226.8211       12.15439 232.9777       14.44954 211.9259       22.47544 137.9173 4.304585 130.9455 7.069599 6.971756       8.276998 
1 1 1 4   12 29 f 55.77272 3.393148 38.15386       4.589876 41.25579       5.999311 33.77534       7.127686 57.89474 4.282644 52.12651 5.704200 5.768227       7.132947 
1 1 1 4   12 30 o 163.0635 3.371905 325.0570       13.39887 320.7318       18.38593 329.9555       19.56688 161.6630 4.671914 163.9136 4.904099 -2.250580      6.773254 
1 1 1 4   12 31 o 125.2052 3.516193 191.9408       10.71769 187.0877       12.84485 203.0633       19.44549 123.4670 4.275606 128.1225 6.246955 -4.655464      7.570023 
1 1 1 4   12 32 o 46.95651 3.922282 27.20856       4.447224 24.01749       5.595464 32.68164       7.327972 43.84506 5.347457 51.10419 5.998301 -7.259125      8.035851 
1 1 1 4   12 33 o 64.71446 4.578969 51.75104       7.174500 53.23462       13.08293 51.11301       8.579629 64.56780 8.522740 64.10378 5.546752 0.4640198      10.16875 
1 1 1 4   12 34 o 112.5742 3.163736 155.3624       8.670504 159.4420       11.76530 150.5130       12.82731 113.7655 4.251294 110.3694 4.780596 3.396111       6.397468 
1 1 1 4   12 35 f 63.81945 3.524741 50.18003       5.460424 52.05018       7.108155 47.48751       8.528977 64.77160 4.531950 61.51168 5.756759 3.259914       7.326585 
1 1 1 4   12 36 o 89.92846 3.766712 99.87730       8.236316 103.1859       9.692202 91.27847       15.62498 91.19687 4.373955 84.18623 7.701493 7.010635       8.856889 
1 1 1 4   12 37 o 76.29166 3.796368 72.21143       7.035824 84.51207       10.93636 63.52518       9.190203 81.75594 5.521698 70.91177 5.357915 10.84417       7.693920 
1 1 1 4   12 38 o 33.73988 5.249127 14.70970       4.175560 17.81352       5.357368 9.906265       6.664680 36.82567 6.189183 27.09404 8.810747 9.731636       10.76732 
1 1 1 4   12 39 o 31.20709 5.543421 12.86261       4.061236 18.24086       5.387779 5.785596       6.180364 36.97857 6.198055 22.20182 8.374137 14.77674       10.41835 
1 1 1 4   12 40 o 12.83012 5.795671 -1.394970      3.858639 -0.7765479     4.343261 -3.711489      8.406041 14.10761 6.277176 17.71167 8.204843 -3.604057      10.33065 
1 1 1 4   12 41 o 31.51429 6.358662 14.02734       4.714655 16.31031       5.486165 7.579391       9.219990 33.63465 6.924243 23.81482 9.820403 9.819832       12.01605 
1 1 1 4   12 42 o 15.77479 6.765979 1.539723       4.657357 -0.9124618     8.598143 2.557971       5.540574 17.95577 8.310984 17.43542 7.426266 0.5203590      11.14549 
1 1 1 4   12 43 o 14.13333 6.080361 1.248775       3.782831 2.973903       5.117536 -0.8293035     5.616701 16.84430 7.154439 14.72852 6.781432 2.115778       9.857678 
1 1 1 4   12 44 o 19.30280 7.278327 6.258161       4.667863 8.915571       9.080326 5.303678       5.441971 21.03235 9.229077 18.39411 7.560688 2.638247       11.93063 
1 1 1 4   12 45 o 15.02843 6.215333 2.998197       3.707758 -0.9603838     5.283132 6.840361       5.204867 13.48076 6.329935 19.02161 7.543069 -5.540848      9.847130 
1 1 1 4   12 46 o 15.79847 6.425508 4.225923       3.879409 8.837011       6.132362 1.149319       5.009124 19.30075 7.988764 13.86903 6.392358 5.431721       10.23145 
1 1 1 4   12 47 f 13.81220 5.999943 2.762082       3.754876 3.169456       5.283784 2.346459       5.337009 14.58860 6.664821 14.13341 6.543897 0.4551926      9.340365 
1 1 1 4   12 48 o 12.07253 5.563280 0.9447243      3.791480 -0.1840121     5.253405 2.171829       5.477539 12.42662 5.968304 13.60078 6.404694 -1.174160      8.754471 
1 1 1 4   13 0  o 324.9139 4.476439 1286.779       35.44354 1310.281       56.59931 1271.617       45.46098 327.7762 7.085943 322.9542 5.776460 4.822021       9.142105 
1 1 1 4   13 1  o 489.8206 8.322327 2927.035       99.33857 3248.188       184.6324 2796.191       117.8501 515.0939 14.72418 478.6044 10.10456 36.48950       17.85787 
1 1 1 4   13 2  o 534.4025 9.020749 3484.740       117.4755 3458.758       202.4826 3497.924       144.2317 531.4082 15.65297 535.2181 11.05844 -3.809937      19.16519 
1 1 1 4   13 3  o 354.2897 6.195583 1530.416       53.49052 1540.672       92.37912 1525.242       65.60804 355.0840 10.68812 353.6310 7.613259 1.453003       13.12241 
1 1 1 4   13 4  f 309.5001 5.565592 1167.751       41.97669 1208.413       74.74412 1149.018       50.73293 314.5242 9.763671 306.9694 6.782015 7.554810       11.88802 
1 1 1 4   13 5  o 1441.224 18.36476 25446.74       644.9899 24839.25       1002.532 25875.77       842.5042 1418.176 29.00895 1450.633 23.83299 -32.45667      37.54372 
1 1 1 4   13 6  o 428.2956 5.674421 2236.220       59.22448 2202.077       92.78638 2259.693       76.93515 424.8517 8.962120 430.4641 7.334184 -5.612305      11.58058 
1 1 1 4   13 7  o 445.1631 6.594258 2416.271       71.53543 2200.755       135.4793 2499.586       84.23528 424.2104 13.12134 452.7194 7.635348 -28.50894      15.18117 
1 1 1 4   13 8  o 160.7516 3.064279 314.9077       12.00383 339.6148       26.62069 308.6019       13.44871 166.7641 6.563410 159.1306 3.468093 7.633545       7.423343 
1 1 1 4   13 9  o 145.9003 3.299914 259.4172       11.73262 0.000000       0.000000 259.4172       11.73262 ?        ?        145.9003 3.299914 0.000000       3.299914 
1 1 1 4   13 10 o 402.4759 5.981594 1974.985       58.66686 1924.103       115.0022 1992.885       68.20988 396.7041 11.90955 404.2517 6.924037 -7.547577      13.77606 
1 1 1 4   13 11 o 781.6318 10.02968 7458.374       191.0404 7556.171       305.0490 7395.268       245.0452 785.5924 15.93442 777.8248 12.92791 7.767578       20.51917 
1 1 1 4   13 12 o 177.1139 3.247330 382.3010       14.01571 425.9103       31.98915 371.9406       15.59195 186.7357 7.042359 174.6924 3.662607 12.04332       7.937853 
1 1 1 4   13 13 o 220.0526 3.735214 590.1966       20.02987 624.0511       29.36148 560.7275       27.39381 226.2390 5.325672 214.4557 5.241780 11.78326       7.472553 
1 1 1 4   13 14 o 453.5449 7.796112 2510.272       86.16570 2555.623       106.3817 2423.769       146.9212 457.4468 9.543119 444.7583 13.57166 12.68848       16.59099 
1 1 1 4   13 15 o 470.2888 8.059371 2700.022       92.36381 2728.326       113.4917 2644.504       158.9484 472.5233 9.856096 464.3118 14.06408 8.211517       17.17385 
1 1 1 4   13 16 o 310.8554 5.556042 1178.678       42.08817 1202.950       52.72273 1136.035       69.88261 313.9478 6.891350 304.7257 9.422063 9.222107       11.67330 
1 1 1 4   13 17 f 613.9345 10.30023 4613.700       154.1009 4628.240       189.7088 4585.497       264.2169 614.1761 12.67530 609.0237 17.82205 5.152405       21.86982 
1 1 1 4   13 18 o 482.8271 7.134793 2848.267       83.94775 2937.256       121.0705 2765.868       116.5014 489.6262 10.14700 475.1487 10.06156 14.47748       14.28974 
1 1 1 4   13 19 o 141.3638 2.998242 243.6360       10.32859 236.9704       14.37084 250.7581       14.85485 139.3111 4.238045 143.3088 4.258350 -3.997696      6.007876 
1 1 1 4   13 20 o 297.7291 4.714279 1082.009       34.20367 1127.591       49.56385 1040.565       47.26086 303.6574 6.697999 291.7120 6.648311 11.94547       9.437331 
1 1 1 4   13 21 o 171.4149 3.907949 358.5576       16.32427 346.9959       29.46098 363.6800       19.60987 168.1729 7.205479 172.5168 4.668817 -4.343872      8.585847 
1 1 1 4   13 22 o 84.71687 2.755111 87.61706       5.680246 94.24919       7.995836 80.85990       8.070851 87.79858 3.745756 81.28217 4.087749 6.516411       5.544401 
1 1 1 4   13 23 o 46.65842 3.826982 26.75512       4.313130 22.75000       5.462239 33.38807       7.029366 42.79938 5.353979 51.93494 5.644888 -9.135563      7.780093 
1 1 1 4   13 24 o 223.3976 3.874279 609.4472       21.09140 627.0009       30.12721 592.5745       29.53704 226.3419 5.462078 219.9629 5.514726 6.379013       7.761862 
1 1 1 4   13 25 o 272.0279 5.073069 905.5698       33.62949 915.5683       56.83182 900.1825       41.71714 272.3005 8.575291 270.8933 6.319463 1.407135       10.65229 
1 1 1 4   13 26 o 48.57724 3.410918 28.95757       4.012094 28.67891       5.237756 29.35320       6.241136 48.21302 4.510403 48.66018 5.351479 -0.4471512     6.998719 
1 1 1 4   13 27 o 154.1043 3.245004 290.0217       12.18614 277.7867       16.65517 304.1180       17.87726 150.5858 4.543873 157.5455 4.661619 -6.959702      6.509798 
1 1 1 4   13 28 o 88.53269 3.487061 95.93261       7.508428 94.36150       8.602571 100.9573       15.38435 87.73674 4.034360 90.21501 7.053887 -2.478271      8.126093 
1 1 1 4   13 29 o 21.84783 5.956226 6.061877       3.257545 4.729138       3.961072 8.846659       5.725795 20.22076 6.801097 26.62983 8.101643 -6.409063      10.57788 
1 1 1 4   13 30 o 82.06691 3.399478 82.49232       6.783831 76.66409       8.039021 96.90837       12.64322 79.00021 4.190785 88.52215 5.894555 -9.521942      7.232458 
1 1 1 4   13 31 o 64.67868 3.422821 51.32267       5.375669 54.31799       7.162854 47.45996       8.134120 66.39120 4.453057 61.85674 5.451931 4.534462       7.039409 
1 1 1 4   13 32 o 77.34386 3.237921 73.32780       6.089288 67.51320       7.796638 82.42183       9.750462 74.02795 4.340959 81.69880 4.920291 -7.670845      6.561493 
1 1 1 4   13 33 o 132.7585 3.999205 216.5586       12.92340 218.9946       23.49527 215.5020       15.47459 132.2181 7.320688 132.1872 4.811927 0.3092957E-01  8.760543 
1 1 1 4   13 34 o 112.5731 3.181904 155.4377       8.720113 158.7309       11.76117 151.4172       12.99516 113.4644 4.261153 110.6296 4.831954 2.834747       6.442454 
1 1 1 4   13 35 o 14.96059 6.316226 0.4006266      3.948800 0.5499473      4.312220 -0.3749214     9.827551 15.71511 6.615736 22.32634 9.702497 -6.611226      11.74336 
1 1 1 4   13 36 f 35.04466 5.426580 15.69880       4.484629 17.13382       6.014802 13.90241       6.729684 36.11644 7.087296 32.14571 8.472716 3.970734       11.04612 
1 1 1 4   13 37 o 57.04387 3.624174 40.43270       5.011904 46.69149       6.634730 32.11462       7.648737 61.00861 4.494229 49.74609 6.462068 11.26252       7.871240 
1 1 1 4   13 38 o 35.31656 4.813920 16.00557       4.035245 15.59437       4.963986 16.80667       6.928681 34.32727 6.160467 34.68739 8.306624 -0.3601227     10.34173 
1 1 1 4   13 39 o 33.61216 5.025260 14.74588       3.989988 13.23046       5.013056 17.36517       6.590632 30.99150 6.822889 34.99817 7.913851 -4.006664      10.44896 
1 1 1 4   13 40 o 15.93605 6.686046 1.451681       4.381069 1.451681       4.381069 0.000000       0.000000 15.93605 6.686046 ?        ?        0.000000       6.686046 
1 1 1 4   13 41 o 50.59013 5.357819 34.63729       6.504987 33.66607       11.90457 35.05072       7.767090 42.92711 11.24717 49.70391 6.573568 -6.776794      13.02730 
1 1 1 4   13 42 o 18.55690 6.444930 4.958277       3.563056 7.160099       4.688555 1.948434       5.481758 21.44809 7.395871 16.73055 7.258716 4.717539       10.36281 
1 1 1 4   13 43 o 23.69332 6.430208 8.825815       3.806728 13.29891       5.086389 3.129905       5.739671 28.33649 7.315838 17.18948 7.442768 11.14701       10.43630 
1 1 1 4   13 44 o 14.06051 6.287259 0.8642703      4.413850 -5.042712      9.071995 2.696203       5.052133 15.25681 7.447356 15.92648 6.938494 -0.6696644     10.17869 
1 1 1 4   13 45 o 13.98186 6.000634 2.109628       3.667465 4.041255       5.208504 0.2101860      5.164930 16.36103 7.087029 13.84085 6.418538 2.520180       9.561569 
1 1 1 4   13 46 o 15.03242 6.272137 3.671620       3.823431 7.355519       5.448537 0.9757020E-01  5.366688 18.10593 7.515406 13.36761 6.308547 4.738320       9.812191 
1 1 1 4   13 47 o 13.37129 5.901169 2.361588       3.762147 -0.1432725E-01 5.097082 5.205043       5.576086 12.69406 6.036587 15.72022 7.045277 -3.026156      9.277732 
1 1 1 4   14 0  o 273.1792 3.906344 909.5096       26.00484 907.2900       40.91132 911.0144       33.68563 272.7964 6.154160 273.3826 5.056357 -0.5861816     7.964950 
1 1 1 4   14 1  o 309.1641 4.807547 1165.048       36.22002 1102.032       49.42287 1238.160       53.23497 300.6332 6.746133 318.6567 6.855480 -18.02350      9.618104 
1 1 1 4   14 2  o 94.40958 2.713059 108.7044       6.235350 110.9356       8.810500 106.4653       8.825754 95.33199 3.800117 93.38430 3.886801 1.947685       5.435817 
1 1 1 4   14 3  o 369.7755 5.599461 1666.843       50.45688 1757.150       73.79845 1587.572       69.14250 379.5647 7.978575 360.7898 7.864203 18.77493       11.20283 
1 1 1 4   14 4  o 589.7836 9.903678 4244.818       142.3394 4079.117       240.5083 4334.144       176.5856 577.0265 17.12296 595.7242 12.16393 -18.69775      21.00374 
1 1 1 4   14 5  o 207.7105 3.595475 525.7892       18.19914 489.1436       36.05136 538.3215       21.08262 200.1387 7.404640 210.1646 4.116506 -10.02597      8.471972 
1 1 1 4   14 6  o 859.0120 14.20860 9020.181       297.4312 10259.37       563.6243 8541.900       350.1566 912.5460 25.37000 835.2974 17.20224 77.24860       30.65215 
1 1 1 4   14 7  f 129.9735 3.202658 205.8684       10.14382 0.000000       0.000000 205.8684       10.14382 ?        ?        129.9735 3.202658 0.000000       3.202658 
1 1 1 4   14 8  o 251.3340 4.681657 769.9701       28.67391 0.000000       0.000000 769.9701       28.67391 ?        ?        251.3340 4.681657 0.000000       4.681657 
1 1 1 4   14 9  o 305.0691 4.762007 1134.443       35.40171 1236.184       76.39986 1106.624       39.94945 318.0859 9.868193 301.2863 5.441206 16.79959       11.26889 
1 1 1 4   14 10 o 431.8918 6.422290 2274.597       67.59290 2145.880       131.7476 2320.582       78.74658 418.7843 12.92517 436.1779 7.408529 -17.39352      14.89787 
1 1 1 4   14 11 o 434.2334 5.760499 2299.080       60.95641 2308.407       96.98505 2292.989       78.37042 434.8835 9.151572 433.5588 7.417679 1.324677       11.78020 
1 1 1 4   14 12 o 533.6397 6.970688 3473.659       90.64835 3274.558       138.0304 3624.651       120.2029 517.6981 10.94113 544.9058 9.052267 -27.20770      14.20041 
1 1 1 4   14 13 o 174.9653 3.873277 373.1452       16.51455 369.9510       29.78537 374.5631       19.84406 173.9957 7.039242 175.2208 4.651499 -1.225174      8.437262 
1 1 1 4   14 14 o 220.2768 4.422720 591.5544       23.74075 555.0049       27.64733 694.1697       46.32527 213.3359 5.318060 238.3299 7.987619 -24.99400      9.596032 
1 1 1 4   14 15 o 337.5459 5.949922 1389.983       48.94183 1422.564       61.38549 1333.138       81.08308 341.3654 7.379215 330.0360 10.09354 11.32941       12.50329 
1 1 1 4   14 16 o 475.2198 7.024939 2757.452       81.35292 2801.019       116.3819 2715.823       113.7636 478.4476 9.981936 471.1297 9.908932 7.317871       14.06506 
1 1 1 4   14 17 o 278.6381 4.461172 946.9776       30.29183 952.4943       43.03953 941.5625       42.64149 279.3017 6.323504 277.6964 6.301241 1.605377       8.927056 
1 1 1 4   14 18 o 88.93927 2.745232 96.51936       5.942763 99.21221       8.484207 93.92558       8.326680 90.10998 3.872730 87.66949 3.907328 2.440483       5.501386 
1 1 1 4   14 19 o 160.7334 3.163785 315.0318       12.39222 305.2447       17.30343 325.3374       17.75582 158.0909 4.496042 163.2176 4.468343 -5.126617      6.338808 
1 1 1 4   14 20 o 147.1979 3.667751 264.3374       13.15641 266.0934       24.68414 263.6406       15.54909 147.2911 6.896247 146.9021 4.348295 0.3889618      8.152662 
1 1 1 4   14 21 o 50.84870 3.936099 31.74627       4.839380 22.86258       10.47196 34.15868       5.457044 42.23869 10.27376 52.72121 4.284422 -10.48252      11.13133 
1 1 1 4   14 22 o 81.47032 2.775757 81.04634       5.502780 80.16242       7.684112 81.97683       7.883949 80.93905 3.907368 81.84695 3.964596 -0.9078979     5.566466 
1 1 1 4   14 23 o 53.87841 3.099571 35.53512       4.052431 31.14828       5.479881 40.82961       6.020149 50.28677 4.519964 57.65093 4.316476 -7.364162      6.249963 
1 1 1 4   14 24 o 270.3759 5.041326 894.3404       33.21612 887.5615       55.64536 898.0929       41.40129 268.2119 8.524453 270.6413 6.277456 -2.429382      10.58644 
1 1 1 4   14 25 o 202.4338 3.662408 500.5331       18.06699 494.6238       25.20690 506.7760       25.90872 200.9305 5.152237 203.3681 5.232243 -2.437592      7.343153 
1 1 1 4   14 26 o 108.6224 2.954152 144.1247       7.812405 146.9599       10.83122 141.0501       11.27921 109.5643 4.063735 107.3020 4.322394 2.262291       5.932709 
1 1 1 4   14 27 o 34.24496 4.299840 14.57212       3.509367 17.80395       4.482224 9.452680       5.641326 37.79669 4.987988 27.38242 7.972633 10.41427       9.404408 
1 1 1 4   14 28 o 52.08111 3.983173 33.37652       5.016926 31.87682       5.544189 40.15516       11.78710 50.81663 4.524350 56.18927 8.904883 -5.372639      9.988328 
1 1 1 4   14 29 o 104.8174 3.421277 134.4598       8.727209 135.7256       10.52182 131.6691       15.62344 105.2074 4.111928 103.1934 6.242010 2.014030       7.474666 
1 1 1 4   14 30 o 40.25933 4.157435 20.06763       4.020159 21.59822       5.123415 17.61546       6.484948 41.61172 5.163222 37.05723 7.439948 4.554493       9.056030 
1 1 1 4   14 31 o 33.97147 4.901764 14.47188       3.940678 16.30742       4.952329 11.30360       6.506398 35.90724 5.861718 29.69599 8.537119 6.211254       10.35578 
1 1 1 4   14 32 o 20.27909 6.388801 5.043680       3.525054 1.142474       4.239213 13.78616       6.346045 16.26206 6.677485 32.55685 8.045722 -16.29479      10.45574 
1 1 1 4   14 33 o 61.02408 4.707008 46.15823       6.945686 30.21441       12.82066 52.78178       8.263412 47.38348 11.26857 65.15073 5.249199 -17.76725      12.43120 
1 1 1 4   14 34 o 25.14728 9.243821 6.777506       7.437511 6.733140       10.72082 6.818669       10.32671 27.65922 10.86990 27.41719 10.69956 0.2420349      15.25239 
1 1 1 4   14 35 o 30.37274 5.700372 11.87928       4.064213 13.60298       5.555345 9.894366       5.961450 32.14915 7.262873 27.52358 8.243635 4.625574       10.98667 
1 1 1 4   14 36 o 28.39059 5.577711 10.45951       3.721213 11.31774       4.747145 9.091600       5.993193 29.23886 6.792553 26.36956 8.333398 2.869301       10.75101 
1 1 1 4   14 37 o 31.49183 5.162888 12.80299       3.824935 11.38719       4.778362 15.32821       6.381558 29.13230 6.847243 33.47752 7.942747 -4.345222      10.48675 
1 1 1 4   14 38 o 30.83694 5.286644 12.44533       3.829806 13.51710       4.906017 10.77326       6.127810 31.63004 6.579516 27.71955 8.370391 3.910498       10.64676 
1 1 1 4   14 39 o 24.45416 6.135806 8.201990       3.650002 9.564949       4.580526 5.831091       6.041303 26.09429 7.041535 21.85179 8.271045 4.242506       10.86248 
1 1 1 4   14 40 o 22.91376 8.485692 7.357314       6.287545 3.946753       9.329453 10.19552       8.510704 21.91003 9.487828 25.88027 9.812145 -3.970232      13.64907 
1 1 1 4   14 41 o 43.56576 4.307841 24.99043       4.513616 24.37364       5.868833 25.88347       7.061906 41.68824 5.945246 41.77607 7.196476 -0.8782578E-01 9.334624 
1 1 1 4   14 42 o 15.12585 6.145215 2.371602       3.543769 2.824569       4.642884 1.739410       5.485024 16.54950 6.908889 16.39027 7.183072 0.1592293      9.966407 
1 1 1 4   14 43 o 14.73223 6.113179 2.261646       3.603480 3.294106       4.916426 1.063152       5.297009 16.66646 7.042654 15.29049 6.858608 1.375973       9.830538 
1 1 1 4   14 44 o 21.97115 7.549770 9.034982       4.884315 23.61209       11.09870 5.533741       5.439355 27.52011 10.98156 18.14386 7.518147 9.376242       13.30854 
1 1 1 4   14 45 f 14.94277 6.299448 3.135013       3.918546 4.660032       6.229353 2.136426       5.040784 16.74527 7.479784 14.73414 6.642878 2.011132       10.00375 
1 1 1 4   14 46 o 14.09850 6.037722 2.891860       3.698227 4.571076       5.177005 1.141969       5.284828 15.75675 6.939454 13.69084 6.396982 2.065919       9.438082 
1 1 1 4   14 47 o 12.43424 5.643657 1.340098       3.711416 -1.796151      5.146498 4.738555       5.357319 11.85174 5.744816 15.24791 6.863688 -3.396162      8.950593 
1 1 1 4   15 0  o 411.0783 5.506289 2059.963       55.15942 1970.878       84.65136 2125.699       72.71626 401.9531 8.642163 417.5186 7.146931 -15.56555      11.21453 
1 1 1 4   15 1  o 248.1707 5.820387 750.8202       35.19966 753.7947       49.69996 747.8265       49.86009 248.4612 8.219768 247.4707 8.279518 0.9905090      11.66683 
1 1 1 4   15 2  o 345.6945 5.288258 1456.740       44.54934 1480.116       63.59742 1434.219       62.42355 348.3800 7.491178 342.9370 7.469612 5.443024       10.57889 
1 1 1 4   15 3  o 331.1678 5.102931 1336.850       41.18166 1396.344       59.79328 1283.161       56.80117 338.3850 7.251122 324.3835 7.185591 14.00150       10.20840 
1 1 1 4   15 4  o 277.3792 5.081244 937.8560       34.34631 948.8317       59.19813 932.2866       42.16964 278.7476 8.725615 276.5244 6.257926 2.223206       10.73769 
1 1 1 4   15 5  o 786.6266 13.04569 7560.936       250.0759 7226.720       419.1374 7745.676       311.6188 766.5942 22.46070 795.5952 16.07295 -29.00098      27.61924 
1 1 1 4   15 6  o 288.8033 4.570733 1016.640       32.16800 1071.128       46.80329 967.8569       44.28587 296.3875 6.480082 281.7385 6.450344 14.64896       9.143216 
1 1 1 4   15 7  o 265.8051 4.989024 861.2469       32.31581 835.5865       55.72167 874.2517       39.66825 261.5476 8.754872 267.7753 6.079060 -6.227753      10.65846 
1 1 1 4   15 8  o 288.2849 5.313888 1013.170       37.33106 958.4593       63.38113 1042.233       46.19392 280.0850 9.299005 292.3520 6.483995 -12.26700      11.33639 
1 1 1 4   15 9  o 315.7733 5.715971 1215.743       43.98469 1289.513       79.82664 1183.582       52.70761 324.8311 10.09675 311.5201 6.943065 13.31104       12.25360 
1 1 1 4   15 10 o 359.3047 6.360038 1574.390       55.68763 1522.840       95.31373 1601.107       68.61721 352.8847 11.09754 362.2622 7.772737 -9.377533      13.54883 
1 1 1 4   15 11 o 970.8753 13.91498 11537.90       329.2170 11923.99       476.1656 11184.33       455.6762 984.6569 19.84436 953.7339 19.60618 30.92297       27.89626 
1 1 1 4   15 12 o 399.6231 6.019768 1947.710       58.62279 1868.438       80.71680 2036.202       85.28171 391.2227 8.466497 408.3994 8.569089 -17.17673      12.04620 
1 1 1 4   15 13 f 467.1835 6.880326 2663.203       78.33081 2611.029       110.1146 2716.650       111.4505 462.2473 9.775398 471.5146 9.699529 -9.267242      13.77096 
1 1 1 4   15 14 o 142.5594 2.852065 247.6986       9.908120 272.8492       15.52669 230.4213       12.86895 149.5345 4.265260 137.4276 3.846451 12.10683       5.743486 
1 1 1 4   15 15 o 310.7640 4.859909 1177.898       36.80399 1230.055       53.61131 1131.408       50.61523 317.4035 6.931202 304.4198 6.822950 12.98373       9.725956 
1 1 1 4   15 16 o 86.03106 2.736294 90.30766       5.729299 91.96210       8.576823 88.97454       7.698982 86.74380 4.068776 85.34243 3.710833 1.401367       5.506834 
1 1 1 4   15 17 o 282.6636 4.519148 974.7675       31.12882 1004.062       44.99691 947.8788       43.10933 286.6909 6.440694 278.5644 6.350523 8.126495       9.044982 
1 1 1 4   15 18 o 56.41481 2.943430 38.90934       4.032536 45.50522       6.187571 34.03946       5.316717 60.92825 4.192968 52.65583 4.177657 8.272419       5.918936 
1 1 1 4   15 19 o 217.2171 3.756629 575.6398       19.88513 604.4702       28.98463 550.0037       27.33175 222.4441 5.347007 212.1921 5.285695 10.25204       7.518580 
1 1 1 4   15 20 o 130.3201 3.519681 207.3582       11.16743 196.8378       20.80557 211.6158       13.23562 126.6128 6.767788 131.6015 4.132244 -4.988670      7.929590 
1 1 1 4   15 21 o 353.5512 6.350673 1530.601       54.71523 1530.661       96.45119 1530.573       66.44050 351.5227 11.27405 353.1312 7.720771 -1.608490      13.66435 
1 1 1 4   15 22 o 190.5999 3.951400 443.5903       18.35311 454.4664       30.82979 437.6202       22.84145 192.4465 6.583616 189.1322 4.960177 3.314316       8.243019 
1 1 1 4   15 23 o 91.34637 2.862014 101.8960       6.363015 103.2617       9.117852 100.5995       8.884027 91.85188 4.083716 90.66302 4.031168 1.188850       5.738210 
1 1 1 4   15 24 o 92.35941 2.826145 104.1782       6.353315 101.1786       8.804043 107.4377       9.177476 90.91367 3.983570 93.68376 4.029391 -2.770096      5.666111 
1 1 1 4   15 25 o 12.72300 5.415509 -0.1645959E-01 2.942986 0.9605416      3.950478 -1.234866      4.411621 15.68006 6.443107 14.55938 6.409276 1.120681       9.088038 
1 1 1 4   15 26 o 40.50715 3.822296 20.23311       3.728436 21.14433       4.881926 18.95772       5.775640 41.25560 4.954972 38.78766 6.328413 2.467934       8.037447 
1 1 1 4   15 27 o 109.7835 2.980335 147.2783       7.965925 141.7778       10.80913 153.8170       11.78508 107.5678 4.131239 112.0187 4.325362 -4.450951      5.981296 
1 1 1 4   15 28 f 57.59874 4.339093 40.85794       6.045648 40.85794       6.045648 0.000000       0.000000 57.59874 4.339093 ?        ?        0.000000       4.339093 
1 1 1 4   15 29 o 20.09180 6.312792 4.925238       3.443907 2.366183       4.159717 10.50177       6.140535 17.47742 6.799221 28.73451 8.303728 -11.25710      10.73225 
1 1 1 4   15 30 o 68.49205 3.233495 57.49416       5.381714 50.54988       6.925708 68.07832       8.550243 64.03567 4.466187 74.30875 4.746560 -10.27308      6.517412 
1 1 1 4   15 31 o 58.20273 3.548297 41.63708       5.008768 39.16139       6.447521 45.40522       7.954421 56.24227 4.748613 60.44509 5.458997 -4.202816      7.235328 
1 1 1 4   15 32 o 23.55366 6.397700 7.114718       3.766458 7.566478       4.665951 6.269781       6.381143 24.44598 7.286310 23.98063 8.598284 0.4653435      11.27035 
1 1 1 4   15 33 o 21.45095 7.484111 5.232954       4.807568 5.232954       4.807568 0.000000       0.000000 21.45095 7.484111 ?        ?        0.000000       7.484111 
1 1 1 4   15 34 o 98.07381 4.747703 119.3179       11.31307 0.000000       0.000000 119.3179       11.31307 ?        ?        98.07381 4.747703 0.000000       4.747703 
1 1 1 4   15 35 o 27.14962 5.904250 9.596002       3.794772 11.29320       4.850510 6.918259       6.092638 29.27058 6.911520 24.09142 8.423850 5.179155       10.89635 
1 1 1 4   15 36 o 26.67167 5.806063 9.328237       3.666385 9.489062       4.638006 9.060302       5.986419 26.66457 7.036550 26.22105 8.333881 0.4435177      10.90718 
1 1 1 4   15 37 o 61.13492 3.475117 46.50826       5.155877 53.28483       6.910593 38.00026       7.743268 65.05969 4.384405 54.13848 5.968156 10.92122       7.405531 
1 1 1 4   15 38 o 37.28160 4.693154 17.90332       4.169518 21.29690       5.484821 13.25730       6.417623 40.19285 5.764662 30.39939 8.389346 9.793463       10.17902 
1 1 1 4   15 39 o 21.04122 8.076480 5.328610       5.811832 13.41829       9.008243 -0.4396441     7.606706 29.23139 10.24144 18.42312 8.244746 10.80827       13.14773 
1 1 1 4   15 40 o 16.56168 6.567341 2.807001       3.945280 3.292840       4.373024 0.6816598      9.146396 17.49192 6.921189 19.76193 8.925344 -2.270014      11.29445 
1 1 1 4   15 41 o 17.96733 6.332203 4.482709       3.447244 2.148732       4.394537 8.216424       5.558217 15.99467 6.702529 22.74793 8.038485 -6.753267      10.46619 
1 1 1 4   15 42 o 21.80988 6.500062 7.441178       3.713419 7.821856       4.895453 6.925321       5.698738 21.66506 7.552638 20.55613 7.968978 1.108932       10.97939 
1 1 1 4   15 43 o 25.54249 6.287475 10.33938       3.886857 16.70995       5.512248 4.039509       5.481573 31.45348 7.328126 17.37370 7.392840 14.07978       10.40940 
1 1 1 4   15 44 o 16.35306 6.598810 4.130738       4.054794 5.511438       6.852872 3.386957       5.029741 17.94946 7.941088 16.02658 6.953150 1.922874       10.55496 
1 1 1 4   15 45 o 16.02579 6.419744 4.398584       3.807939 4.098063       5.230209 4.737580       5.554927 15.92449 6.995505 16.42454 7.212469 -0.5000439     10.04773 
1 1 1 4   15 46 o 12.92567 5.710979 1.804831       3.533105 3.436881       5.208460 0.4137559      4.808590 14.82547 6.711713 12.88431 6.046414 1.941155       9.033616 
1 1 1 4   15 47 o 22.53865 6.634222 10.34471       3.887832 12.86053       5.818306 8.315242       5.225753 21.25300 8.099936 17.84656 7.379596 3.406439       10.95753 
1 1 1 4   16 0  o 878.6851 17.85913 9456.910       382.4104 0.000000       0.000000 9456.910       382.4104 ?        ?        878.6851 17.85913 0.000000       17.85913 
1 1 1 4   16 1  o 327.3932 5.837932 1306.747       46.57627 1307.414       80.21527 1306.408       57.20778 327.1391 10.07410 327.3034 7.172465 -0.1643372     12.36656 
1 1 1 4   16 2  o 458.6001 7.838186 2565.224       87.59631 2648.387       154.2515 2525.640       106.4209 465.2900 13.61875 454.9300 9.599450 10.36005       16.66192 
1 1 1 4   16 3  o 680.7756 9.830610 5656.367       163.0874 5712.462       232.1229 5601.682       229.1861 683.5691 13.93476 676.9152 13.89370 6.653870       19.67771 
1 1 1 4   16 4  o 191.2287 3.449214 445.6601       16.07346 457.8807       22.86712 433.7255       22.59788 193.8130 4.841638 188.5661 4.921976 5.246933       6.904151 
1 1 1 4   16 5  o 715.0009 9.212163 6238.692       160.5108 6159.853       251.5997 6292.803       208.4370 709.6466 14.54896 717.7200 11.91746 -8.073364      18.80686 
1 1 1 4   16 6  o 222.1724 4.323904 601.6461       23.41005 634.1918       29.68821 548.1422       38.06535 228.0811 5.341443 211.8632 7.384186 16.21788       9.113572 
1 1 1 4   16 7  o 275.3240 3.927613 923.9061       26.35172 967.7741       42.85400 897.2326       33.41621 281.7185 6.242233 271.2932 5.054546 10.42529       8.032055 
1 1 1 4   16 8  o 103.8288 3.362828 131.5228       8.497389 120.8209       15.05727 136.5238       10.29308 99.34185 6.251519 105.7590 4.001069 -6.417107      7.422266 
1 1 1 4   16 9  o 140.5553 3.557306 240.9376       12.17462 245.5625       22.09571 238.9214       14.58897 141.7525 6.413089 139.9362 4.283216 1.816330       7.711916 
1 1 1 4   16 10 o 162.3723 3.164953 321.3207       12.52320 361.9066       28.16763 311.3218       13.98097 172.1151 6.728724 159.8202 3.589794 12.29491       7.626425 
1 1 1 4   16 11 o 124.1836 2.864913 187.9464       8.669854 180.2231       18.89940 190.0049       9.757063 121.3810 6.412161 124.8169 3.210482 -3.435905      7.170984 
1 1 1 4   16 12 o 274.7099 4.360602 920.0626       29.19153 931.7759       42.41275 909.5192       40.23907 276.3622 6.297695 273.0551 6.047301 3.307159       8.731026 
1 1 1 4   16 13 o 301.7583 4.233242 1110.234       31.12923 1178.474       51.49971 1070.947       39.07568 310.7298 6.801202 296.3085 5.411609 14.42136       8.691483 
1 1 1 4   16 14 o 478.7743 6.319754 2797.924       73.73388 2889.885       119.5327 2741.440       93.68031 485.9131 10.09466 473.6453 8.116317 12.26785       12.95287 
1 1 1 4   16 15 o 405.3392 5.436901 2005.041       53.70394 2131.697       88.83272 1932.087       67.41930 417.4299 8.732796 397.6985 6.956555 19.73141       11.16492 
1 1 1 4   16 16 o 85.41498 2.763695 89.03008       5.744975 90.52490       8.666152 87.85812       7.673377 86.04877 4.145001 84.79723 3.722445 1.251549       5.571143 
1 1 1 4   16 17 o 331.5257 5.143238 1341.844       41.55181 1374.178       59.88446 1311.823       57.70252 335.1537 7.332196 327.4796 7.230603 7.674133       10.29770 
1 1 1 4   16 18 o 206.7949 3.649438 521.6794       18.39086 536.4582       26.68685 508.3131       25.37957 209.5726 5.225488 203.9482 5.110584 5.624313       7.309158 
1 1 1 4   16 19 f 126.4159 2.920602 194.8941       8.997262 200.2363       13.09033 190.1106       12.38689 128.0070 4.202133 124.7355 4.080573 3.271530       5.857388 
1 1 1 4   16 20 o 143.9408 3.643264 253.0129       12.76914 251.4120       24.08837 253.6385       15.05904 143.0680 6.929830 144.0564 4.294513 -0.9884338     8.152631 
1 1 1 4   16 21 o 96.37723 3.075976 113.4343       7.215011 118.5453       11.75707 110.3468       9.138022 98.35587 4.920897 94.98365 3.956574 3.372223       6.314246 
1 1 1 4   16 22 o 232.3778 3.971678 659.4941       22.49080 657.5356       31.84090 661.4443       31.77279 231.7580 5.637862 232.4514 5.609021 -0.6933746     7.952774 
1 1 1 4   16 23 o 149.4817 3.125485 272.7043       11.38522 270.2581       16.04202 275.1869       16.16091 148.6214 4.434326 149.9728 4.426830 -1.351349      6.265786 
1 1 1 4   16 24 o 224.5116 3.896672 615.9139       21.31910 626.4825       30.44877 605.7504       29.85939 226.1050 5.526160 222.3357 5.511065 3.769257       7.804504 
1 1 1 4   16 25 o 117.6187 3.308684 169.0830       9.474059 168.9710       11.90107 169.2767       15.65424 117.4742 4.163846 117.3704 5.488347 0.1037674      6.889090 
1 1 1 4   16 26 o 136.2941 3.481186 227.1287       11.55274 235.4046       18.69999 222.0203       14.69178 138.3881 5.556361 134.5969 4.485494 3.791138       7.140924 
1 1 1 4   16 27 o 167.2167 3.790697 341.9735       15.44667 341.0243       19.17567 343.7277       26.06818 166.7466 4.723843 166.9437 6.419697 -0.1971741     7.970396 
1 1 1 4   16 28 o 37.64354 5.170223 17.71692       4.617650 24.53056       5.218121 -6.882284      9.914822 44.45221 4.898190 19.70967 9.051116 24.74254       10.29150 
1 1 1 4   16 29 o 191.1834 3.645484 447.2951       16.98406 469.6530       24.18670 425.5464       23.85492 195.4394 5.082730 185.9664 5.269208 9.472977       7.321114 
1 1 1 4   16 30 f 47.60030 3.825044 27.93580       4.399604 24.18040       5.640189 33.77203       7.031233 43.99363 5.372303 52.04348 5.633798 -8.049847      7.784685 
1 1 1 4   16 31 o 94.88220 3.108368 110.2649       7.177394 107.1358       9.538381 114.3495       10.89761 93.32301 4.205008 96.31761 4.656701 -2.994598      6.274309 
1 1 1 4   16 32 o 162.5975 3.992413 324.7978       15.81923 330.8890       18.92861 310.6894       28.80737 163.7708 4.747936 157.2147 7.541241 6.556137       8.911408 
1 1 1 4   16 33 o 99.28677 3.526073 121.2016       8.517824 124.4435       13.00347 118.7651       11.27305 100.0266 5.354178 97.92884 4.737892 2.097794       7.149464 
1 1 1 4   16 34 o 40.17273 7.081811 20.97299       6.679607 25.08864       11.00546 18.57272       8.404654 42.72221 10.61742 37.09545 9.312512 5.626755       14.12276 
1 1 1 4   16 35 o 45.46658 4.048031 25.80075       4.438253 22.31815       5.738134 30.98672       7.002195 41.73157 5.798944 49.22639 5.958252 -7.494820      8.314356 
1 1 1 4   16 36 o 38.14551 4.444287 18.41169       4.053959 20.63918       5.270957 15.18587       6.343100 40.02372 5.553702 33.35524 7.922100 6.668488       9.674879 
1 1 1 4   16 37 o 29.06797 5.668965 11.17722       3.871354 12.00309       4.951011 9.877742       6.210428 29.64803 6.970781 26.72537 8.487692 2.922653       10.98329 
1 1 1 4   16 38 o 15.68096 7.015074 -1.119464      5.501638 0.2073520      8.902549 -1.939269      6.997847 20.27825 9.006969 17.13220 7.765451 3.146048       11.89234 
1 1 1 4   16 39 o 17.63069 6.424493 3.812007       3.580601 4.442348       4.552844 2.790038       5.797143 19.10767 7.191715 18.56873 7.733488 0.5389423      10.56066 
1 1 1 4   16 40 o 27.20372 6.698028 10.86594       4.410227 9.942597       4.940422 14.48846       9.785579 25.52868 7.468869 28.20189 10.55841 -2.673216      12.93306 
1 1 1 4   16 41 o 14.48656 6.069412 1.639567       3.602496 2.033500       4.506017 0.9417372      5.997313 15.82688 6.717488 16.43151 7.339427 -0.6046267     9.949464 
1 1 1 4   16 42 o 26.56036 6.295293 10.92457       4.012023 11.41331       5.492485 10.36548       5.874474 25.32919 7.974149 23.77007 8.274266 1.559113       11.49132 
1 1 1 4   16 43 o 13.75845 6.053615 1.129013       3.930957 3.866132       6.159119 -0.7522495     5.106183 17.26930 7.588639 13.71317 6.367102 3.556122       9.905929 
1 1 1 4   16 44 o 15.78935 6.295353 3.880160       3.644420 2.708370       5.319000 4.917037       5.003439 15.44049 6.903278 17.00773 7.141036 -1.567243      9.932252 
1 1 1 4   16 45 o 15.43136 6.663335 3.957685       4.575565 19.64526       10.22755 0.3221589E-01  5.116104 22.13568 9.751088 13.17000 6.198098 8.965683       11.55423 
1 1 1 4   16 46 o 16.15403 6.366195 5.134527       3.686385 8.802753       5.625631 2.374072       4.880154 18.40166 7.637224 13.89522 6.369504 4.506444       9.944736 
1 1 1 4   17 0  o 409.7433 7.119075 2047.530       71.08394 2153.677       89.64749 1867.773       116.6618 420.1305 8.756243 390.7988 12.26528 29.33173       15.07013 
1 1 1 4   17 1  o 504.6289 10.53513 3109.115       129.5532 3107.739       182.9564 3110.498       183.4764 503.7832 14.91923 504.0009 14.95524 -0.2177124     21.12446 
1 1 1 4   17 2  o 643.3955 10.75738 5054.771       168.6632 5118.155       208.4096 4934.463       287.1288 647.0607 13.21711 634.0635 18.60277 12.99725       22.82006 
1 1 1 4   17 3  o 409.4251 6.148271 2043.943       61.34280 2007.922       85.53215 2082.095       88.02521 405.6579 8.652336 413.0760 8.744620 -7.418182      12.30168 
1 1 1 4   17 4  o 670.4714 9.696997 5487.448       158.4359 5691.058       229.5613 5302.244       218.9403 682.1488 13.80967 658.4637 13.64451 23.68512       19.41339 
1 1 1 4   17 5  o 506.1698 7.425532 3125.290       91.59251 3359.560       136.0500 2931.094       123.8681 524.4852 10.64459 489.9278 10.37508 34.55740       14.86437 
1 1 1 4   17 6  o 147.7621 2.734585 266.0741       9.846698 277.9941       15.65010 258.2634       12.66845 150.9583 4.258515 145.5689 3.571239 5.389465       5.557760 
1 1 1 4   17 7  o 361.8429 4.923551 1596.203       43.41447 1525.751       66.67945 1648.047       57.19968 353.6225 7.737773 367.6023 6.385269 -13.97980      10.03219 
1 1 1 4   17 8  o 435.3458 5.791932 2311.189       61.44604 2424.926       100.1933 2242.624       77.79264 445.6449 9.226003 428.7234 7.446036 16.92148       11.85591 
1 1 1 4   17 9  o 131.2565 3.568559 210.1442       11.40372 188.1143       19.58887 221.4376       14.02535 124.0126 6.504719 134.7091 4.277911 -10.69651      7.785364 
1 1 1 4   17 10 f 162.9679 4.559465 324.0573       18.08944 308.8862       26.25232 337.7727       24.96114 158.9643 6.792572 166.2884 6.170497 -7.324127      9.176823 
1 1 1 4   17 11 f 464.3976 6.884930 2632.044       77.91581 2861.415       166.1152 2567.348       88.22256 482.7468 14.13585 458.5372 7.895308 24.20959       16.19130 
1 1 1 4   17 12 o 143.6066 2.698504 251.3513       9.443514 256.3038       15.66358 248.5232       11.83666 144.9107 4.440862 142.7842 3.401832 2.126480       5.594079 
1 1 1 4   17 13 o 269.8412 3.893738 887.8348       25.60419 859.9388       40.26400 906.7739       33.17616 265.4211 6.225085 272.6416 4.993418 -7.220459      7.980345 
1 1 1 4   17 14 o 462.8240 6.136431 2615.403       69.20985 2799.046       114.8379 2510.655       86.73051 478.0149 9.858431 453.1616 7.853851 24.85324       12.60443 
1 1 1 4   17 15 o 317.7239 4.424199 1231.562       34.25474 1227.035       54.55148 1234.508       44.01416 316.8288 7.065547 317.9734 5.680225 -1.144592      9.065701 
1 1 1 4   17 16 f 264.6960 3.837835 854.6502       24.75539 898.4757       40.89961 829.3116       31.09901 271.1544 6.189655 260.6509 4.896111 10.50348       7.892004 
1 1 1 4   17 17 o 99.41873 2.792060 120.6116       6.757698 133.1541       10.29773 111.1249       8.955821 104.3823 4.056074 95.35794 3.861997 9.024338       5.600603 
1 1 1 4   17 18 o 139.3808 3.010302 236.9315       10.22466 247.8318       15.11604 227.7378       13.88232 142.4106 4.360855 136.5265 4.177536 5.884109       6.038945 
1 1 1 4   17 19 o 92.82220 3.283972 105.2460       7.416560 107.0575       15.43285 104.7020       8.457157 93.23122 6.840416 92.54555 3.757828 0.6856689      7.804650 
1 1 1 4   17 20 o 251.7570 5.902897 775.8067       36.21454 0.000000       0.000000 775.8067       36.21454 ?        ?        251.7570 5.902897 0.000000       5.902897 
1 1 1 4   17 21 o 213.3227 4.415607 556.0421       22.95428 559.6618       41.69550 554.4680       27.49605 213.1733 8.040806 212.8882 5.300083 0.2850952      9.630444 
1 1 1 4   17 22 o 106.7555 2.881539 139.1516       7.489515 148.3668       10.97827 131.1288       10.24342 110.1222 4.098087 103.5213 4.068416 6.600899       5.774628 
1 1 1 4   17 23 o 116.2795 2.946401 165.1109       8.342211 160.5127       11.77326 169.7474       11.82223 114.5129 4.226219 117.7777 4.125451 -3.264854      5.905951 
1 1 1 4   17 24 f 135.5635 3.062690 224.3469       10.11770 209.6914       13.91159 240.8035       14.74165 130.8599 4.368610 140.2499 4.318423 -9.389954      6.142762 
1 1 1 4   17 25 o 48.22383 3.668046 28.58408       4.278213 28.19928       5.515219 29.16544       6.779094 47.74639 4.805372 48.39202 5.868371 -0.6456299     7.584812 
1 1 1 4   17 26 o 130.9246 3.434881 209.6190       10.94948 207.6508       13.68608 213.1190       18.25098 130.1703 4.320493 131.5959 5.704804 -1.425583      7.156218 
1 1 1 4   17 27 o 124.7386 3.424504 190.3462       10.39976 161.7359       15.55700 213.4617       13.98348 114.5838 5.588282 131.9420 4.355035 -17.35821      7.084859 
1 1 1 4   17 28 o 180.4383 4.164266 398.8503       18.31063 388.9331       21.51503 424.9048       34.87307 177.9108 4.967396 184.8587 7.758553 -6.947937      9.212501 
1 1 1 4   17 29 o 108.8236 3.094159 144.9017       8.197108 149.5162       11.33821 139.8488       11.86463 110.3463 4.224284 106.6419 4.576169 3.704483       6.227832 
1 1 1 4   17 30 o 84.02418 3.137182 86.48646       6.412344 83.23056       8.576888 90.61274       9.655475 82.23134 4.295012 85.73977 4.638476 -3.508430      6.321597 
1 1 1 4   17 31 o 158.8569 3.980748 309.9921       15.39802 329.5905       18.73045 269.1347       27.04417 163.5435 4.704686 146.4368 7.604628 17.10672       8.942284 
1 1 1 4   17 32 o 18.40611 6.679453 3.541795       3.864919 5.623030       5.438310 1.417907       5.493754 22.42941 7.948923 18.32981 7.571699 4.099602       10.97798 
1 1 1 4   17 33 o 53.95240 3.762551 35.99217       4.915855 27.39173       6.450525 47.90681       7.592337 46.52415 5.816306 61.94401 5.074107 -15.41986      7.718548 
1 1 1 4   17 34 o 40.07796 5.806818 20.54011       5.506240 9.540981       9.888862 25.48266       6.628926 28.73927 10.64213 44.55844 6.278742 -15.81917      12.35627 
1 1 1 4   17 35 o 53.54140 4.016961 35.77245       5.202901 31.61118       6.194473 45.74000       9.587061 49.92436 5.166176 59.39910 6.742369 -9.474735      8.494052 
1 1 1 4   17 36 o 24.44432 6.097455 7.970347       3.619874 10.28817       4.660120 4.444195       5.747876 27.56693 6.942128 20.84406 8.023888 6.722872       10.61018 
1 1 1 4   17 37 o 25.07652 8.028268 8.686802       5.547410 8.866229       7.873880 8.509962       7.816875 25.86478 9.510527 25.52683 9.460065 0.3379555      13.41428 
1 1 1 4   17 38 o 13.10791 5.787205 -0.5007018     3.621623 -3.705781      4.545086 5.073447       5.993935 12.55448 5.887419 20.95285 8.158785 -8.398370      10.06119 
1 1 1 4   17 39 o 16.43440 6.342910 2.967944       3.598518 0.6360781      4.631610 6.519391       5.715877 15.36574 6.669330 21.70584 8.080823 -6.340095      10.47758 
1 1 1 4   17 40 f 15.66712 6.473695 2.162646       4.017539 2.124070       4.570139 2.293849       8.428411 16.20409 6.815509 19.40163 8.680940 -3.197540      11.03675 
1 1 1 4   17 41 o 29.57914 5.792396 12.82257       4.025759 13.95745       5.389082 11.38963       6.055591 29.15645 7.531831 25.27368 8.407577 3.882778       11.28786 
1 1 1 4   17 42 o 14.19457 6.025383 1.745167       3.626062 4.141309       4.972412 -0.9763056     5.299230 17.36706 7.191503 14.02159 6.502042 3.345467       9.695064 
1 1 1 4   17 43 f 14.06324 5.954384 2.062555       3.525888 -0.1943566     4.897800 4.490411       5.079900 13.65364 6.303042 17.09658 7.187913 -3.442935      9.560043 
1 1 1 4   17 44 o 17.05759 6.473329 5.129962       3.706317 12.35367       5.440891 -1.124122      5.062580 23.99808 7.969028 12.86179 6.087011 11.13629       10.02782 
1 1 1 4   17 45 o 12.21852 5.691907 -0.1338229E-01 4.133589 -1.752690      9.010420 0.4502411      4.651998 14.34012 7.082886 12.91337 6.023155 1.426752       9.297616 
1 1 1 4   17 46 o 13.29057 6.075643 1.945909       4.399946 1.318010       5.494698 3.068105       7.345700 13.44945 6.358063 14.70189 7.060132 -1.252443      9.501076 
1 1 1 4   18 0  o 74.71041 2.816126 68.11706       5.117893 60.81096       7.400825 74.81306       7.085084 70.49978 4.328677 78.25862 3.725854 -7.758842      5.711343 
1 1 1 4   18 1  o 211.9348 4.260121 547.4899       22.00191 544.8076       26.93422 552.8693       38.14388 211.3947 5.228466 212.7658 7.367884 -1.371140      9.034521 
1 1 1 4   18 2  o 196.5722 4.116231 470.9860       19.71778 446.1956       23.24664 534.5566       37.22600 191.2476 4.992289 209.2093 7.313036 -17.96170      8.854572 
1 1 1 4   18 3  f 92.78970 3.387931 105.0737       7.647873 104.5445       8.970306 106.4821       14.63421 92.52704 3.987707 93.21575 6.482739 -0.6887131     7.611026 
1 1 1 4   18 4  f 511.1666 8.701101 3189.234       108.3859 3086.059       129.5711 3429.663       197.7951 502.6215 10.57867 528.8930 15.36286 -26.27151      18.65276 
1 1 1 4   18 5  o 94.65903 2.559116 109.2737       5.897791 106.5034       8.925233 111.4211       7.857831 93.39292 3.930442 95.55416 3.379881 -2.161240      5.183818 
1 1 1 4   18 6  o 186.0092 3.067473 421.6768       13.90437 408.3697       21.54575 431.1741       18.20196 182.9541 4.836872 188.0769 3.971427 -5.122833      6.258399 
1 1 1 4   18 7  o 78.52299 2.736440 75.23438       5.228229 77.38344       7.473774 73.17486       7.316401 79.58304 3.865309 77.38186 3.892414 2.201180       5.485572 
1 1 1 4   18 8  f 269.1913 4.304408 883.4284       28.23648 871.6032       39.84987 895.3522       40.01546 267.3073 6.117586 270.9273 6.060925 -3.620087      8.611602 
1 1 1 4   18 9  o 99.51067 3.478209 120.8515       8.421573 147.8124       16.39920 111.1947       9.814572 109.9007 6.147812 95.40741 4.231898 14.49330       7.463549 
1 1 1 4   18 10 o 717.7040 10.37925 6302.059       181.5295 6509.504       372.2662 6237.343       207.9261 724.4833 21.10826 713.5303 11.95805 10.95294       24.26013 
1 1 1 4   18 11 o 183.4044 3.407835 410.0600       15.23086 496.1189       36.03747 391.3449       16.80558 201.4128 7.354634 179.1576 3.849302 22.25513       8.301070 
1 1 1 4   18 12 o 127.1598 2.923067 197.1035       9.057843 169.3201       19.03154 205.2400       10.29911 117.5624 6.670446 129.7101 3.260875 -12.14767      7.424834 
1 1 1 4   18 13 o 325.3611 4.526806 1291.394       35.89166 1338.905       58.48849 1262.697       45.45691 330.9811 7.251554 321.6018 5.800231 9.379333       9.285889 
1 1 1 4   18 14 o 403.5991 5.434597 1988.734       53.45073 2029.447       86.15739 1963.260       68.15108 407.0768 8.685205 400.7458 6.978590 6.331055       11.14152 
1 1 1 4   18 15 o 161.1544 2.837834 316.6409       11.14462 324.3528       18.52910 312.2698       13.94998 162.9498 4.671032 160.0081 3.577629 2.941666       5.883704 
1 1 1 4   18 16 o 39.88151 3.466041 19.54719       3.335117 19.54377       5.860703 19.54883       4.055875 39.49339 6.301223 39.79718 4.247707 -0.3037872     7.599238 
1 1 1 4   18 17 o 27.13538 4.352713 9.214669       2.780991 9.705136       5.273263 9.025702       3.273170 27.70451 7.588521 26.72301 5.213552 0.9814987      9.206888 
1 1 1 4   18 18 o 54.53243 3.030892 36.38498       4.011895 0.000000       0.000000 36.38498       4.011895 ?        ?        54.53243 3.030892 0.000000       3.030892 
1 1 1 4   18 19 o 338.9251 7.444799 1409.742       61.48835 0.000000       0.000000 1409.742       61.48835 ?        ?        338.9251 7.444799 0.000000       7.444799 
1 1 1 4   18 20 o 72.73708 2.857335 64.63869       5.054839 71.23600       7.869872 60.00554       6.595122 76.24589 4.252450 69.99426 3.881759 6.251633       5.757724 
1 1 1 4   18 21 o 216.0769 3.799697 570.1956       20.00752 585.7925       28.93773 555.9116       27.69312 218.7502 5.428501 213.0487 5.338253 5.701508       7.613512 
1 1 1 4   18 22 o 76.02389 2.902436 70.62962       5.367233 67.55067       7.862057 73.31699       7.345112 74.20503 4.367078 77.36790 3.908505 -3.162872      5.860698 
1 1 1 4   18 23 o 313.5061 4.979825 1203.439       38.04487 1227.587       54.67287 1180.768       52.97448 315.8388 7.103465 309.7943 7.017091 6.044525       9.984927 
1 1 1 4   18 24 o 55.33263 3.531849 37.55810       4.737469 40.85591       6.319113 33.32569       7.158757 57.60013 4.538551 51.79669 5.769331 5.803440       7.340547 
1 1 1 4   18 25 o 15.50453 5.926492 2.020781       3.120697 1.780600       4.316138 2.283882       4.517403 17.10216 6.840208 17.92668 7.052659 -0.8245125     9.824889 
1 1 1 4   18 26 o 76.69695 3.011638 71.95862       5.617873 68.42319       7.933228 75.51488       7.956569 74.61858 4.382105 78.43176 4.177991 -3.813171      6.054623 
1 1 1 4   18 27 f 57.64398 3.372223 40.76225       4.716343 36.14398       6.336322 46.49962       7.062435 54.06012 4.861642 61.38800 4.758131 -7.327881      6.802601 
1 1 1 4   18 28 o 184.1898 5.096834 417.3156       22.85517 465.6557       31.56411 364.0363       33.13745 193.9178 6.689452 170.8421 7.981608 23.07574       10.41417 
1 1 1 4   18 29 o 116.7662 3.117388 166.8719       8.862484 157.7635       12.07631 177.5030       13.04676 113.2840 4.382782 120.1526 4.463637 -6.868591      6.255624 
1 1 1 4   18 30 f 30.76402 6.176814 12.12749       4.469639 14.63978       4.980580 1.733032       10.13085 33.85615 6.267566 24.18097 10.15762 9.675180       11.93564 
1 1 1 4   18 31 o 56.99369 3.983699 40.10346       5.498019 40.33227       8.253145 39.92091       7.371998 56.67430 6.070268 56.55200 5.415437 0.1223030      8.134809 
1 1 1 4   18 32 o 71.93288 3.319603 63.62949       5.803329 60.35706       7.886107 67.49492       8.570884 69.74112 4.667073 73.72987 4.796337 -3.988747      6.692266 
1 1 1 4   18 33 o 40.71731 4.411952 20.74767       4.307833 25.42494       5.916003 15.46851       6.285131 44.81173 5.535050 34.18506 7.726976 10.62666       9.504890 
1 1 1 4   18 34 o 71.16341 4.103612 62.99041       7.086201 54.21753       12.14705 67.51620       8.724615 64.23705 7.927810 73.36674 4.908133 -9.129692      9.324159 
1 1 1 4   18 35 f 42.71825 4.194920 22.95504       4.310643 24.02093       5.584891 21.38429       6.779693 43.27207 5.414467 40.03769 7.214027 3.234379       9.019902 
1 1 1 4   18 36 o 47.12276 5.977646 29.08780       6.710072 22.82027       10.05816 34.11432       9.007489 39.05077 10.38886 50.06267 7.623717 -11.01190      12.88601 
1 1 1 4   18 37 o 35.86366 4.948381 16.77709       4.209548 10.64806       5.383368 26.42226       6.753257 27.32340 7.736521 44.23170 6.455526 -16.90830      10.07609 
1 1 1 4   18 38 o 34.55892 5.148900 15.91251       4.204040 20.86410       5.655701 9.798198       6.284748 38.99436 6.155814 25.59052 8.566319 13.40384       10.54874 
1 1 1 4   18 39 f 14.09117 5.943980 1.094895       3.492136 3.604601       4.447859 -2.938337      5.638534 17.74506 6.992971 14.27251 6.648420 3.472548       9.648996 
1 1 1 4   18 40 o 41.18095 5.087880 23.40894       4.997390 26.82009       5.829121 13.94838       9.707571 43.56863 5.621116 26.34220 10.34615 17.22643       11.77454 
1 1 1 4   18 41 o 19.27437 6.590208 5.791218       3.720459 3.534901       4.964885 8.680812       5.618593 17.08825 7.139913 22.19465 8.053610 -5.106409      10.76285 
1 1 1 4   18 42 o 16.51611 6.320887 4.030609       3.552729 3.434433       4.928928 4.675278       5.125469 16.50029 7.015336 17.63783 7.302278 -1.137541      10.12611 
1 1 1 4   18 43 o 13.12920 5.753436 1.250148       3.518315 2.728157       5.342786 0.1184737      4.675091 15.58049 6.945450 13.43609 6.186569 2.144407       9.301231 
1 1 1 4   18 44 o 14.39407 6.079469 2.956926       3.660692 -0.8586994     5.425512 6.145594       4.959781 13.07751 6.221520 17.44208 7.198614 -4.364570      9.514586 
1 1 1 4   18 45 o 13.41378 6.382600 0.4128149      5.715070 4.859973       9.134254 -2.448045      7.326221 15.89178 7.691247 13.25708 6.516673 2.634702       10.08079 
1 1 1 4   19 0  o 659.8506 8.564011 5314.750       137.7079 5402.275       220.5755 5258.847       176.2831 664.3435 13.62475 655.9813 11.02765 8.362244       17.52834 
1 1 1 4   19 1  o 190.2353 4.061595 441.1315       18.82885 458.0595       23.15603 408.0978       32.34736 193.7705 4.907836 182.7460 7.278205 11.02451       8.778333 
1 1 1 4   19 2  o 97.70505 4.358323 116.6041       10.35090 114.0650       13.84684 119.8200       15.58330 96.53100 5.914769 98.89922 6.501986 -2.368217      8.789784 
1 1 1 4   19 3  o 351.1215 5.405031 1503.349       46.24786 1527.747       65.73558 1479.436       65.07806 353.8227 7.623926 348.1801 7.669985 5.642609       10.81448 
1 1 1 4   19 4  o 215.6710 3.777401 566.9743       19.85277 571.0981       27.88546 562.7358       28.27061 216.4125 5.287611 214.7505 5.406425 1.661926       7.562293 
1 1 1 4   19 5  o 333.1775 7.292587 1354.706       59.20977 1354.706       59.20977 0.000000       0.000000 333.1775 7.292587 ?        ?        0.000000       7.292587 
1 1 1 4   19 6  f 176.2461 4.700585 379.0186       20.17064 379.0186       20.17064 0.000000       0.000000 176.2461 4.700585 ?        ?        0.000000       4.700585 
1 1 1 4   19 7  o 341.2331 5.271254 1420.143       43.83300 1315.682       58.89058 1549.900       65.63482 328.2913 7.361228 356.2979 7.559357 -28.00662      10.55138 
1 1 1 4   19 8  o 111.9552 2.863486 152.8681       7.805823 144.9328       10.47482 162.7778       11.70564 108.9591 3.951547 115.4691 4.166834 -6.510010      5.742580 
1 1 1 4   19 9  o 315.0154 4.947884 1210.416       37.98283 1168.608       75.50488 1224.580       43.94857 308.8509 10.04542 316.7983 5.692798 -7.947418      11.54636 
1 1 1 4   19 10 o 272.1439 4.416873 903.2785       29.29204 956.7463       61.97916 887.9012       33.23840 279.4983 9.111947 269.7772 5.055902 9.721130       10.42064 
1 1 1 4   19 11 o 91.05389 2.856862 101.1644       6.331202 76.45924       13.23318 108.4980       7.209920 78.80492 6.962429 94.28609 3.142345 -15.48118      7.638701 
1 1 1 4   19 12 o 161.3126 3.746415 317.3437       14.72720 334.2705       27.63752 310.6314       17.40398 165.2426 6.878467 159.5042 4.481995 5.738464       8.209846 
1 1 1 4   19 13 o 443.1176 7.677546 2402.711       82.90439 2542.170       150.4204 2341.865       99.35746 453.5242 13.62583 437.0266 9.329460 16.49756       16.51369 
1 1 1 4   19 14 o 83.06178 2.874955 84.22246       5.810495 94.68044       9.318350 77.56931       7.432390 87.97347 4.360201 79.64741 3.840631 8.326065       5.810491 
1 1 1 4   19 15 o 95.60104 2.834713 111.5438       6.596715 109.5377       10.02130 113.0779       8.763111 94.62975 4.357400 96.19827 3.745291 -1.568512      5.745793 
1 1 1 4   19 16 o 200.1947 3.586231 489.0047       17.49552 434.4655       35.15713 506.9567       20.17043 188.0795 7.686913 203.7964 4.061462 -15.71692      8.693913 
1 1 1 4   19 17 o 52.17089 3.123416 33.32081       3.952765 0.000000       0.000000 33.32081       3.952765 ?        ?        52.17089 3.123416 0.000000       3.123416 
1 1 1 4   19 18 o 196.7434 3.561513 472.4155       17.07540 468.5428       36.49060 473.5012       19.32129 195.1991 7.686292 196.9241 4.026253 -1.725021      8.676970 
1 1 1 4   19 19 o 174.0736 2.959788 369.6706       12.55538 354.9969       20.07985 379.0903       16.08825 170.3374 4.842340 176.2112 3.746617 -5.873764      6.122531 
1 1 1 4   19 20 o 63.84141 2.948759 49.83463       4.575128 52.20693       7.115032 48.16224       5.973945 65.19876 4.505894 62.67187 3.931387 2.526894       5.979873 
1 1 1 4   19 21 o 232.9513 4.004279 663.0714       22.73137 668.8252       32.64836 657.6580       31.66807 233.6146 5.734892 231.6851 5.609026 1.929565       8.021855 
1 1 1 4   19 22 o 44.94140 3.772297 24.84956       4.093226 35.20446       6.230181 16.98528       5.429468 53.41503 4.838749 36.68922 6.299555 16.72581       7.943418 
1 1 1 4   19 23 o 45.32189 3.781974 25.27751       4.138943 26.04854       5.855570 24.50766       5.851130 45.79152 5.348032 44.36715 5.531631 1.424366       7.694180 
1 1 1 4   19 24 o 65.73219 3.113330 52.88389       4.972827 52.50255       7.375097 53.20181       6.733846 65.31100 4.664595 65.80625 4.221400 -0.4952469     6.291157 
1 1 1 4   19 25 o 97.69363 2.983990 116.6679       7.095618 116.9315       10.27470 116.4275       9.810804 97.62940 4.329463 97.44660 4.140883 0.1828003      5.990923 
1 1 1 4   19 26 o 131.5724 3.117325 211.5225       9.995002 211.7611       14.22834 211.2901       14.04361 131.3812 4.450534 131.2456 4.397153 0.1356812      6.256374 
1 1 1 4   19 27 o 142.3746 3.229511 247.8241       11.20483 260.0341       16.12502 236.4240       15.58103 145.5271 4.552549 138.7419 4.614846 6.785248       6.482478 
1 1 1 4   19 28 o 125.6821 3.777575 193.6633       11.55658 196.1897       13.58880 187.0604       21.96829 126.3563 4.419950 122.4500 7.396585 3.906334       8.616578 
1 1 1 4   19 29 o 43.15811 5.746778 23.39608       5.893904 22.20555       7.025178 26.22580       10.83080 41.68836 7.173933 44.60223 10.18868 -2.913876      12.46092 
1 1 1 4   19 30 o 47.78710 4.297179 28.30244       4.950763 30.40906       7.331998 26.53708       6.711897 49.10127 6.270540 45.84667 6.163606 3.254604       8.792594 
1 1 1 4   19 31 o 63.40179 3.383446 49.45404       5.208603 53.36862       7.280220 45.34919       7.455046 65.61438 4.581915 60.32618 5.119477 5.288200       6.870443 
1 1 1 4   19 32 o 50.88384 3.711194 32.03550       4.570179 35.10401       6.224166 28.44574       6.732096 52.99586 4.874065 47.35007 5.966560 5.645798       7.704307 
1 1 1 4   19 33 o 72.34962 4.066453 64.97486       7.140631 66.99718       13.16537 64.13199       8.499401 71.85327 7.635611 71.58063 4.902147 0.2726440      9.073786 
1 1 1 4   19 34 f 32.46991 6.181897 13.82681       4.712852 6.589142       7.943470 17.75844       5.854603 24.74006 9.455673 36.66596 6.802777 -11.92590      11.64850 
1 1 1 4   19 35 o 26.18489 8.070931 9.342412       5.658883 -0.1335599     8.425504 17.12990       7.638054 20.18663 8.872978 34.75711 8.960654 -14.57049      12.61044 
1 1 1 4   19 36 o 19.84145 6.567826 5.101932       3.696533 5.691648       4.906963 4.328151       5.620827 21.24777 7.548592 20.30620 7.902531 0.9415684      10.92846 
1 1 1 4   19 37 o 37.64969 5.401961 18.83331       4.814422 15.61566       5.717552 26.67420       8.925327 33.14360 7.278663 42.19262 8.957858 -9.049019      11.54219 
1 1 1 4   19 38 o 39.61589 4.802405 20.79601       4.541670 24.96745       6.199680 15.96463       6.672091 42.40556 6.181162 32.03857 8.432537 10.36699       10.45536 
1 1 1 4   19 39 o 27.19707 5.854493 10.58867       3.765179 12.36865       5.134827 8.518596       5.537476 28.25593 7.378612 23.18894 8.035614 5.066986       10.90940 
1 1 1 4   19 40 o 17.79111 6.825362 4.432656       4.149199 0.6331917      4.747746 16.71587       8.536548 14.79392 6.573908 28.51250 9.971132 -13.71858      11.94319 
1 1 1 4   19 41 f 35.57985 7.136596 20.60295       5.972253 25.65729       7.814399 13.50457       9.260671 37.40829 8.731913 24.19509 9.894708 13.21320       13.19665 
1 1 1 4   19 42 o 11.28325 5.216575 -1.057508      3.373154 3.447123       4.749863 -5.640740      4.791124 16.16079 6.879415 11.00543 5.380721 5.155361       8.733757 
1 1 1 4   19 43 o 17.34096 6.455477 5.274044       3.647681 1.930946       5.196192 8.522121       5.121813 14.72152 6.680221 20.21724 7.623828 -5.495722      10.13647 
1 1 1 4   19 44 o 10.68020 5.035975 -1.299392      3.406607 2.745549       4.895905 -5.095731      4.743069 14.55163 6.554885 10.60756 5.220008 3.944073       8.379439 
1 1 1 4   19 45 o 16.37141 6.746696 5.653260       4.347968 5.026206       7.801155 5.935821       5.236762 15.62821 7.442141 16.30735 7.084729 -0.6791477     10.27516 
1 1 1 4   20 0  o 176.4910 3.438285 379.6745       14.78770 364.2819       19.99423 398.2617       21.97123 172.7822 4.753159 180.6537 4.995611 -7.871460      6.895553 
1 1 1 4   20 1  o 147.6580 3.590174 265.7651       12.91839 260.7901       15.63632 276.4628       22.92899 146.1886 4.394185 150.4072 6.269510 -4.218613      7.656083 
1 1 1 4   20 2  o 215.9964 4.326753 568.8092       22.77429 558.9102       27.66321 589.6308       40.12028 214.0756 5.302728 219.6510 7.506428 -5.575348      9.190505 
1 1 1 4   20 3  o 174.3937 3.817342 370.7534       16.22288 386.1862       20.20862 342.7820       27.20643 177.9033 4.665429 167.4672 6.680023 10.43610       8.147941 
1 1 1 4   20 4  o 254.8009 4.221598 791.5701       26.21283 782.3035       36.48292 801.4586       37.68750 253.2263 5.912140 256.3009 6.034080 -3.074677      8.447694 
1 1 1 4   20 5  o 117.6138 2.630679 168.5930       7.539841 157.6507       11.35935 177.2106       10.08069 113.6368 4.108789 120.5219 3.435830 -6.885048      5.356031 
1 1 1 4   20 6  o 395.5689 5.959718 1909.417       57.44920 1997.055       83.80606 1831.727       78.90605 404.2312 8.507648 387.1573 8.363474 17.07388       11.93012 
1 1 1 4   20 7  o 460.7327 6.123166 2590.928       68.74818 2583.705       108.3202 2595.800       88.96229 459.4965 9.673669 460.8976 7.920734 -1.401123      12.50272 
1 1 1 4   20 8  o 319.7870 4.468221 1247.292       34.82023 1356.013       57.82389 1185.439       43.61457 333.1731 7.121988 311.6541 5.742785 21.51895       9.148896 
1 1 1 4   20 9  o 97.92753 3.468321 117.0718       8.263688 107.5278       15.12807 121.1308       9.865642 93.58821 6.677109 99.57715 4.074251 -5.988937      7.821976 
1 1 1 4   20 10 o 311.4146 6.935974 1185.195       52.63597 0.000000       0.000000 1185.195       52.63597 ?        ?        311.4146 6.935974 0.000000       6.935974 
1 1 1 4   20 11 o 226.4346 4.541354 625.6346       25.05903 623.6641       44.61218 626.5430       30.28884 225.5740 8.129036 226.5236 5.486977 -0.9496155     9.807555 
1 1 1 4   20 12 o 227.7765 4.559419 633.2005       25.30781 582.3773       43.14692 659.8565       31.24755 217.9019 8.139857 232.4325 5.516746 -14.53062      9.833197 
1 1 1 4   20 13 o 210.1196 4.213484 538.8040       21.57467 0.000000       0.000000 538.8040       21.57467 ?        ?        210.1196 4.213484 0.000000       4.213484 
1 1 1 4   20 14 o 318.5463 5.003343 1239.489       38.83908 1249.477       79.94163 1236.403       44.43597 318.3687 10.31764 318.0245 5.733740 0.3442078      11.80379 
1 1 1 4   20 15 o 441.0985 7.616328 2386.007       81.86859 0.000000       0.000000 2386.007       81.86859 ?        ?        441.0985 7.616328 0.000000       7.616328 
1 1 1 4   20 16 o 256.5864 4.842127 804.4746       30.27651 0.000000       0.000000 804.4746       30.27651 ?        ?        256.5864 4.842127 0.000000       4.842127 
1 1 1 4   20 17 o 156.4624 3.104141 298.6603       11.83552 299.7974       17.96592 297.7885       15.73164 156.5599 4.714417 156.1023 4.139156 0.4575653      6.273623 
1 1 1 4   20 18 o 142.7521 2.716052 248.5598       9.448366 288.2407       16.74841 230.0363       11.44310 153.5205 4.481631 137.2874 3.420399 16.23308       5.637743 
1 1 1 4   20 19 o 152.6611 2.796973 284.3181       10.40526 273.2526       16.94919 291.0110       13.18161 149.4238 4.660414 154.3928 3.503524 -4.968994      5.830450 
1 1 1 4   20 20 o 84.66869 2.476686 87.51631       5.104615 85.41278       8.852524 88.56414       6.247947 83.47305 4.367148 85.13509 3.016334 -1.662041      5.307565 
1 1 1 4   20 21 o 110.8407 2.538792 149.8807       6.857446 152.8364       11.66332 148.3191       8.477521 111.7176 4.292132 110.1790 3.160698 1.538597       5.330329 
1 1 1 4   20 22 o 96.94542 3.228414 114.8940       7.616342 122.3174       10.49785 106.6441       11.06694 99.90372 4.322264 93.19228 4.890281 6.711441       6.526624 
1 1 1 4   20 23 o 128.0450 3.059844 200.2064       9.547686 200.7953       13.89513 199.6796       13.14132 127.9999 4.461504 127.6809 4.229380 0.3189850      6.147574 
1 1 1 4   20 24 o 122.7709 3.056085 184.0927       9.143172 172.5342       13.02890 195.3083       12.83409 118.6019 4.516212 126.2563 4.177094 -7.654373      6.151771 
1 1 1 4   20 25 o 161.6666 3.928501 319.8416       15.47687 316.3017       28.49347 321.3231       18.43316 159.7485 7.338956 161.8274 4.679160 -2.078949      8.703724 
1 1 1 4   20 26 o 150.9722 3.274249 278.6566       12.04605 281.5204       17.32405 275.9759       16.76127 151.4035 4.701149 149.9306 4.592962 1.472900       6.572374 
1 1 1 4   20 27 o 56.45406 4.397140 39.33423       6.001574 37.17570       6.908307 45.97606       12.11814 54.72331 5.244508 60.10227 8.511749 -5.378956      9.997737 
1 1 1 4   20 28 o 14.19969 6.289954 -1.380992      4.312455 -0.6285565     4.756145 -4.858744      10.22515 15.57661 6.759640 20.87480 9.431636 -5.298192      11.60381 
1 1 1 4   20 29 o 37.84753 4.837575 17.92459       4.359849 18.72339       6.911521 17.39665       5.618809 38.01970 7.723637 36.90699 6.483893 1.112705       10.08442 
1 1 1 4   20 30 o 38.13974 4.877032 18.24237       4.429251 23.52454       7.046123 14.79154       5.695158 42.84185 6.989890 33.75571 7.146401 9.086140       9.996480 
1 1 1 4   20 31 o 66.45683 3.365928 54.37266       5.433304 49.41908       7.470440 59.93569       7.916666 62.97928 4.906256 69.45059 4.705461 -6.471313      6.797993 
1 1 1 4   20 32 o 47.81715 3.878842 28.40246       4.481051 26.51834       6.097007 30.61572       6.608134 45.72270 5.588017 49.16262 5.616446 -3.439922      7.922777 
1 1 1 4   20 33 o 29.45170 6.629697 11.48234       4.643078 20.96193       9.212928 8.254877       5.375683 38.76579 9.760218 25.13265 7.885662 13.63313       12.54773 
1 1 1 4   20 34 o 36.50944 6.729047 17.71939       5.766280 30.53702       10.00321 11.34073       7.056683 46.83566 9.092422 28.72075 9.038130 18.11490       12.82029 
1 1 1 4   20 35 o 12.76940 5.687231 -0.9909186     3.574081 -1.201069      4.732427 -0.7119195     5.452806 14.62885 6.527941 16.05723 7.094709 -1.428378      9.641002 
1 1 1 4   20 36 o 38.79152 4.630054 19.46698       4.290512 17.90784       5.640765 21.60732       6.609017 36.11926 6.653690 39.43996 7.139211 -3.320702      9.759094 
1 1 1 4   20 37 f 42.76029 4.372789 23.73736       4.492452 21.90943       5.813353 26.44739       7.078384 39.90076 6.178261 43.28474 6.945467 -3.383987      9.295721 
1 1 1 4   20 38 o 16.29028 6.471618 2.785764       3.837810 4.483757       4.713441 -0.5542751     6.610679 18.82665 7.261143 16.65647 7.548927 2.170177       10.47428 
1 1 1 4   20 39 o 14.97654 6.104552 2.191601       3.510685 1.716925       4.750606 2.762736       5.210986 15.81313 6.808583 17.07244 7.234063 -1.259309      9.934207 
1 1 1 4   20 40 o 45.15205 6.005003 30.22747       6.443678 44.19817       8.869846 14.61434       9.376741 52.99416 7.042515 25.54153 10.12573 27.45263       12.33400 
1 1 1 4   20 41 o 22.01756 6.637020 8.053533       3.855058 7.513061       5.392786 8.618359       5.512950 20.35865 7.788560 21.45265 7.945596 -1.093994      11.12628 
1 1 1 4   20 42 o 9.890430 4.762478 -3.254601      3.395367 0.5070074      5.033604 -6.395077      4.599282 14.00887 6.439026 10.36049 5.106499 3.648376       8.218114 
1 1 1 4   20 43 o 17.09404 6.523720 5.354864       3.777463 4.083079       5.403148 6.570786       5.283152 15.89117 7.039832 17.80451 7.396251 -1.913341      10.21096 
1 1 1 4   20 44 o 12.81933 5.888838 0.9598141      4.201704 2.225402       5.261631 -1.267710      6.980485 14.18208 6.541973 13.52278 6.585797 0.6592989      9.282787 
1 1 1 4   21 0  o 71.68402 3.156040 62.75821       5.499650 58.34824       7.204203 68.91792       8.514282 69.04048 4.303391 75.02823 4.680103 -5.987747      6.357873 
1 1 1 4   21 1  o 94.65587 2.981902 109.3189       6.869655 106.9503       9.397698 112.0370       10.06713 93.56397 4.131894 95.75555 4.325421 -2.191582      5.981790 
1 1 1 4   21 2  o 452.9375 6.761343 2504.689       74.62895 2397.347       102.3197 2626.701       109.0877 442.6965 9.484557 463.3550 9.661079 -20.65851      13.53858 
1 1 1 4   21 3  o 353.3709 5.453740 1523.558       46.96360 1481.220       64.92435 1570.025       68.01662 348.1972 7.651495 358.4661 7.786294 -10.26892      10.91658 
1 1 1 4   21 4  o 324.6067 5.087556 1285.473       40.24416 1274.628       56.29472 1296.808       57.55383 323.0381 7.151181 325.8256 7.248580 -2.787445      10.18240 
1 1 1 4   21 5  o 82.34688 2.649375 82.73807       5.309592 96.16658       8.224708 73.14277       6.952418 88.72533 3.812866 77.36347 3.698482 11.36186       5.311940 
1 1 1 4   21 6  o 316.2906 4.438666 1220.250       34.21172 1206.427       53.59640 1229.756       44.44407 314.2412 6.999007 317.4040 5.745996 -3.162781      9.055527 
1 1 1 4   21 7  o 214.6163 3.355810 561.5943       17.55077 603.6303       28.66596 536.3886       22.19753 222.3930 5.289433 209.6974 4.343857 12.69563       6.844502 
1 1 1 4   21 8  o 98.73171 2.560440 118.9038       6.155178 126.7142       9.535708 113.3252       8.058930 101.8573 3.848632 96.34255 3.438112 5.514793       5.160676 
1 1 1 4   21 9  o 186.0819 3.073276 422.1888       13.93612 425.1776       21.95904 420.1733       18.03312 186.5845 4.833562 185.5945 3.987216 0.9900818      6.265877 
1 1 1 4   21 10 o 74.06377 3.041680 66.99857       5.478104 55.57882       11.70549 70.20113       6.198833 67.00833 7.285590 75.79638 3.364410 -8.788048      8.024903 
1 1 1 4   21 11 o 467.5729 6.978281 2675.201       79.51221 2377.043       148.8147 2794.327       94.06470 437.7452 13.96834 477.5228 8.083445 -39.77762      16.13866 
1 1 1 4   21 12 o 309.1592 4.894454 1167.286       36.87419 1183.796       76.23157 1162.243       42.13102 310.0098 10.10424 308.3792 5.606357 1.630554       11.55539 
1 1 1 4   21 13 o 276.8329 4.499913 935.7834       30.35693 922.5511       61.97729 939.9600       34.81976 273.7541 9.303951 277.3575 5.151690 -3.603424      10.63501 
1 1 1 4   21 14 o 398.6388 6.967389 1947.136       67.68396 0.000000       0.000000 1947.136       67.68396 ?        ?        398.6388 6.967389 0.000000       6.967389 
1 1 1 4   21 15 f 201.9300 3.634206 497.6479       17.88325 490.4432       37.51305 499.7668       20.34373 199.7412 7.721424 202.3114 4.126427 -2.570175      8.754872 
1 1 1 4   21 16 o 39.70766 3.164745 19.35873       3.036987 11.30983       6.045953 22.07504       3.512254 29.84800 8.104973 42.39317 3.429047 -12.54517      8.800508 
1 1 1 4   21 17 o 45.81129 3.386907 25.75336       3.754307 16.94499       6.308575 30.58358       4.671610 36.50809 7.345646 49.89656 3.872312 -13.38847      8.303813 
1 1 1 4   21 18 o 235.6465 3.584317 678.0009       20.58276 673.0553       33.18196 681.0938       26.24130 234.3902 5.809336 236.0316 4.562251 -1.641403      7.386645 
1 1 1 4   21 19 o 50.27421 2.808397 30.93471       3.426969 27.71874       6.667587 32.08926       3.995041 47.18718 5.928970 51.17148 3.220066 -3.984306      6.746963 
1 1 1 4   21 20 o 59.40161 2.896151 43.16523       4.179695 41.82521       7.185936 43.85038       5.138298 58.22038 5.116917 59.81397 3.541019 -1.593597      6.222672 
1 1 1 4   21 21 o 143.3344 3.007854 250.8049       10.50614 237.6291       15.66257 261.5827       14.16578 139.2624 4.621628 146.2236 3.979154 -6.961182      6.098616 
1 1 1 4   21 22 o 189.9590 3.147740 440.6773       14.57118 466.5656       24.46975 426.4540       18.13753 195.0177 5.153474 186.7394 3.985713 8.278336       6.514921 
1 1 1 4   21 23 o 103.5375 2.601418 130.9236       6.558428 121.0203       10.90423 136.5367       8.209272 99.30354 4.517864 105.6734 3.191545 -6.369843      5.531461 
1 1 1 4   21 24 o 80.19422 3.086012 78.68223       6.019570 83.72715       9.186198 74.88575       7.968903 82.52953 4.585653 78.09372 4.202903 4.435806       6.220338 
1 1 1 4   21 25 o 146.2169 3.235911 261.3409       11.53002 255.5916       16.56370 266.7457       16.05981 144.2620 4.717954 147.4373 4.475070 -3.175308      6.502718 
1 1 1 4   21 26 o 66.85921 3.302937 54.80635       5.364771 52.27073       7.899783 56.97662       7.308529 65.02202 5.024567 68.00718 4.434186 -2.985161      6.701364 
1 1 1 4   21 27 o 92.89000 3.802614 105.9057       8.589505 109.9241       10.24150 96.37545       15.77213 94.51096 4.459354 87.68943 7.451358 6.821526       8.683811 
1 1 1 4   21 28 o 33.70102 5.525695 14.38235       4.380883 21.20697       7.588439 10.97075       5.365278 40.47770 7.976868 29.09062 7.515358 11.38708       10.95952 
1 1 1 4   21 29 o 51.12262 3.828972 32.27302       4.735488 39.40407       7.141418 26.67678       6.326392 56.20910 5.275302 46.03899 5.764931 10.17011       7.814297 
1 1 1 4   21 30 f 16.31363 6.268331 2.289150       3.503338 6.606717       5.066619 -1.666223      4.849449 23.26696 7.688751 14.87425 6.624685 8.392711       10.14906 
1 1 1 4   21 31 o 13.59184 5.968547 -0.8034716     3.804056 -4.253605      6.052094 1.449826       4.890994 15.23295 7.022943 17.38950 7.159838 -2.156549      10.02921 
1 1 1 4   21 32 o 66.73035 3.384291 55.03629       5.485383 62.06861       8.004054 48.80830       7.532416 70.42891 4.690347 62.30325 5.003237 8.125660       6.857968 
1 1 1 4   21 33 o 39.86001 6.239161 20.74039       5.861748 36.90300       10.34887 13.10558       7.112731 52.20396 8.421430 30.78004 8.949400 21.42392       12.28870 
1 1 1 4   21 34 o 62.49808 3.582270 48.75735       5.432979 52.69322       7.730457 44.91589       7.637177 64.28325 4.973474 59.11058 5.360111 5.172668       7.312061 
1 1 1 4   21 35 o 49.93716 4.029339 31.60689       4.861759 33.54634       6.747303 29.51263       7.011431 50.59956 5.563708 46.98890 6.280267 3.610664       8.390268 
1 1 1 4   21 36 o 44.31437 4.223930 25.26414       4.506280 28.18437       6.216166 22.02976       6.541996 45.89230 5.679454 39.58769 7.039289 6.304615       9.044765 
1 1 1 4   21 37 o 27.15227 5.934548 10.35485       3.816835 8.947083       4.998919 12.32286       5.910520 24.40859 7.596197 28.18774 8.147022 -3.779152      11.13895 
1 1 1 4   21 38 o 39.55136 4.519226 20.94575       4.277644 24.38132       5.986526 17.36171       6.114510 41.23771 6.144552 33.25380 7.697669 7.983917       9.849346 
1 1 1 4   21 39 o 20.04044 6.810894 6.247278       3.972820 14.35085       6.116095 0.3323166      5.225309 28.66492 8.288260 15.07554 6.782990 13.58938       10.71001 
1 1 1 4   21 40 o 21.04072 7.038755 7.407529       4.243265 3.861120       4.998648 16.55414       8.027647 17.15880 7.166383 27.57611 9.667482 -10.41731      12.03400 
1 1 1 4   21 41 o 20.45215 6.621555 7.155206       3.766578 14.05994       5.354386 0.3912239      5.299530 27.60395 7.680192 14.38947 6.611382 13.21449       10.13389 
1 1 1 4   21 42 f 17.37630 6.501067 5.315125       3.708582 5.269130       5.285096 5.359740       5.205269 17.12951 7.272906 17.20310 7.256815 -0.7359123E-01 10.27407 
1 1 1 4   21 43 o 20.57400 7.226188 8.916923       4.486580 7.775700       5.551402 11.06613       7.618270 18.39265 7.605793 19.51461 8.510705 -1.121958      11.41403 
1 1 1 4   21 44 o 10.61572 5.037796 -1.360305      3.513683 0.9615089      5.128416 -3.414458      4.823762 13.27576 6.234588 11.10597 5.423222 2.169795       8.263258 
1 1 1 4   22 0  o 406.2689 7.116796 2016.679       70.45864 2106.945       125.1116 1974.754       85.26556 413.9111 12.41783 401.7473 8.709328 12.16382       15.16756 
1 1 1 4   22 1  o 109.0479 3.487531 145.1369       9.255770 155.4902       11.15449 122.2498       16.58468 112.8413 4.063078 99.80157 6.860946 13.03974       7.973781 
1 1 1 4   22 2  f 330.9355 5.178229 1336.477       41.76003 1327.775       58.64711 1345.427       59.47683 329.6060 7.301555 331.7821 7.356290 -2.176056      10.36473 
1 1 1 4   22 3  o 121.1814 3.018697 179.0252       8.914393 179.3236       12.30176 178.6953       12.93584 121.1809 4.172008 120.9534 4.396060 0.2275162      6.060609 
1 1 1 4   22 4  o 198.5225 3.635669 480.6006       17.58856 501.1539       25.13932 460.8925       24.61687 202.5787 5.096459 194.2561 5.204916 8.322617       7.284575 
1 1 1 4   22 5  o 71.83537 2.799077 63.00356       4.890546 72.05404       7.543958 56.44281       6.423031 76.75214 4.047722 67.91602 3.897257 8.836121       5.618956 
1 1 1 4   22 6  o 303.5210 4.794666 1124.316       35.46363 1058.341       48.43019 1200.593       52.07413 294.2463 6.754125 313.3882 6.818726 -19.14197      9.597563 
1 1 1 4   22 7  o 162.1463 2.906648 320.5528       11.48512 302.2677       17.42180 334.6075       15.27411 157.3150 4.549284 165.6258 3.784355 -8.310760      5.917544 
1 1 1 4   22 8  o 168.7466 2.959215 347.2080       12.16880 349.7646       19.11073 345.4646       15.78174 169.2145 4.638883 168.2804 3.848443 0.9340820      6.027416 
1 1 1 4   22 9  o 169.9935 2.956728 352.3791       12.24841 370.4742       19.62222 340.8275       15.67785 174.1438 4.627954 167.1386 3.849229 7.005234       6.019512 
1 1 1 4   22 10 o 124.7082 3.011926 189.6611       9.153255 186.1925       19.62948 190.6249       10.34703 123.1874 6.562607 124.9635 3.400954 -1.776062      7.391502 
1 1 1 4   22 11 o 180.7105 3.452301 398.3961       15.20296 368.9317       30.90148 407.8053       17.46251 173.3684 7.330856 182.7990 3.920096 -9.430664      8.313158 
1 1 1 4   22 12 o 136.1395 3.465529 226.2779       11.48780 0.000000       0.000000 226.2779       11.48780 ?        ?        136.1395 3.465529 0.000000       3.465529 
1 1 1 4   22 13 o 341.0573 5.316963 1422.128       44.19031 1246.881       83.15903 1491.086       52.16509 317.5120 10.76320 349.0324 6.133073 -31.52042      12.38794 
1 1 1 4   22 14 o 11.25485 4.951199 -0.7474001     2.628554 -0.3907988     7.647370 -0.7951744     2.799097 20.23846 8.675024 11.61370 5.109168 8.624769       10.06775 
1 1 1 4   22 15 o 103.9185 2.877060 131.8321       7.278801 119.8113       16.12146 134.9099       8.157601 98.62548 6.748450 105.1029 3.188705 -6.477394      7.463874 
1 1 1 4   22 16 o 102.7408 2.845769 128.8712       7.118037 126.8856       16.56346 129.3210       7.883081 101.4810 6.735892 102.8973 3.147508 -1.416252      7.434988 
1 1 1 4   22 17 o 100.9101 2.584155 124.2902       6.349387 129.2073       11.25611 121.9955       7.689536 102.7072 4.508279 99.92986 3.161663 2.777336       5.506423 
1 1 1 4   22 18 o 84.89610 2.572977 88.00167       5.316897 79.44933       9.343388 92.09740       6.465886 80.44512 4.787818 86.81403 3.061133 -6.368912      5.682758 
1 1 1 4   22 19 o 140.1476 3.013026 239.7426       10.29022 236.9593       15.77714 241.8032       13.57500 139.0835 4.661554 140.6022 3.965935 -1.518738      6.120353 
1 1 1 4   22 20 o 119.7883 2.643582 175.0972       7.716910 172.9182       13.11637 176.2507       9.543401 118.7837 4.539632 120.0916 3.264055 -1.307861      5.591271 
1 1 1 4   22 21 o 139.8250 2.771794 238.6429       9.444567 228.1697       15.58229 244.7246       11.87426 136.4167 4.694348 141.5273 3.442946 -5.110565      5.821579 
1 1 1 4   22 22 o 144.9244 2.816429 256.4225       9.946642 263.8071       16.84081 252.4664       12.32631 146.6579 4.718313 143.7217 3.519448 2.936264       5.886340 
1 1 1 4   22 23 o 119.2788 2.672653 173.6956       7.768587 175.9404       13.22288 172.5123       9.600137 119.7406 4.539791 118.7624 3.320388 0.9782104      5.624472 
1 1 1 4   22 24 o 97.61246 2.607338 116.4200       6.196546 122.2869       10.81146 113.5500       7.561805 99.78046 4.457596 96.32937 3.225847 3.451088       5.502386 
1 1 1 4   22 25 o 29.77454 5.324640 11.22839       3.721585 13.28348       5.874364 9.850546       4.810001 32.07089 7.628183 27.67318 7.098662 4.397707       10.42018 
1 1 1 4   22 26 o 113.6413 3.806201 158.4074       10.52569 158.3006       12.56728 158.6582       19.26495 113.4403 4.555353 112.8307 7.041655 0.6095886      8.386664 
1 1 1 4   22 27 o 74.03771 4.865394 67.77695       8.729586 59.99363       11.11825 80.28773       14.09601 69.18244 6.677734 79.91447 7.319469 -10.73203      9.907914 
1 1 1 4   22 28 o 84.00928 3.163302 86.56548       6.464390 91.44843       9.715070 82.68578       8.659731 86.02377 4.651681 81.85815 4.356859 4.165619       6.373411 
1 1 1 4   22 29 o 40.60178 4.416334 20.56388       4.299290 32.11925       6.577871 11.94606       5.680571 50.60229 5.418587 30.18270 7.699583 20.41960       9.415130 
1 1 1 4   22 30 o 40.68430 4.318610 20.67892       4.216283 16.97622       5.989073 24.31717       5.936722 36.06868 7.066720 43.78534 5.699039 -7.716656      9.078413 
1 1 1 4   22 31 f 61.33862 3.397474 46.49930       5.058554 36.54468       7.014216 57.28819       7.302223 53.74433 5.430025 67.77767 4.445662 -14.03334      7.017769 
1 1 1 4   22 32 o 57.22099 6.301778 42.24563       8.641959 0.000000       0.000000 42.24563       8.641959 ?        ?        57.22099 6.301778 0.000000       6.301778 
1 1 1 4   22 33 o 41.44559 5.448681 22.20692       5.369923 22.11086       9.869956 22.24731       6.400068 38.81971 10.27453 40.93792 6.642874 -2.118210      12.23494 
1 1 1 4   22 34 o 21.23450 6.683582 6.010940       3.858706 5.210632       5.491989 6.791193       5.422740 21.10766 7.908349 22.79420 7.948809 -1.686543      11.21274 
1 1 1 4   22 35 o 26.45272 6.128559 9.630198       3.873071 10.65808       5.512965 8.628453       5.442415 27.10395 7.878482 24.60040 7.959016 2.503548       11.19895 
1 1 1 4   22 36 o 47.17721 3.963670 28.63024       4.514763 28.86950       6.226838 28.36506       6.555513 46.16672 5.652592 45.41761 6.075299 0.7491150      8.298256 
1 1 1 4   22 37 o 23.91314 6.568809 8.458722       3.944823 9.765198       5.456730 7.028406       5.709495 24.84757 7.963137 21.72542 8.078585 3.122158       11.34350 
1 1 1 4   22 38 o 36.66755 5.469501 19.05066       4.738012 20.25384       7.647241 18.30105       6.036143 33.63867 9.107316 33.89913 7.505274 -0.2604599     11.80137 
1 1 1 4   22 39 o 33.49830 5.021177 15.88509       3.972729 17.44754       5.751374 14.45934       5.494031 32.57408 7.412727 29.24975 7.629480 3.324331       10.63755 
1 1 1 4   22 40 o 9.431509 4.664010 -6.831402      3.948859 -3.554624      4.650403 -15.30123      7.476603 11.80271 5.654565 11.59665 5.835873 0.2060614      8.125978 
1 1 1 4   22 41 f 11.84612 5.390117 -0.1652734     3.411634 -0.6982843     4.868540 0.3489950      4.782176 13.15392 6.144062 13.67755 6.282851 -0.5236244     8.787703 
1 1 1 4   22 42 o 12.24449 5.641505 0.1263819E-01  3.896367 0.2179266      4.899530 -0.3405712     6.426704 13.27074 6.187008 14.03615 6.703609 -0.7654037     9.122360 
1 1 1 4   22 43 o 12.82190 5.728750 1.495237       3.656598 0.7394919      5.224576 2.220874       5.119449 13.39716 6.291969 14.15304 6.501036 -0.7558804     9.047229 
1 1 1 4   23 0  o 117.1274 3.696998 167.4852       10.53901 0.000000       0.000000 167.4852       10.53901 ?        ?        117.1274 3.696998 0.000000       3.696998 
1 1 1 4   23 1  o 458.6595 7.931410 2574.892       88.64961 2424.697       146.8416 2661.024       111.2006 442.9297 13.62055 465.7129 9.798342 -22.78323      16.77876 
1 1 1 4   23 2  o 228.0184 3.962604 634.2386       22.01844 643.6562       31.09591 624.7688       31.18182 229.5755 5.558296 226.1018 5.663740 3.473679       7.935528 
1 1 1 4   23 3  o 253.1952 4.236269 782.1992       26.13817 775.2494       36.48923 789.5237       37.45977 251.8994 5.944310 254.1958 6.047288 -2.296417      8.479652 
1 1 1 4   23 4  o 202.7695 3.678198 501.5145       18.17497 483.2752       24.93493 522.1888       26.54736 198.8783 5.149324 206.7214 5.274177 -7.843124      7.371057 
1 1 1 4   23 5  o 197.1272 3.588368 473.9921       17.23771 508.1306       25.24077 444.1536       23.59769 203.9916 5.077551 190.6500 5.083752 13.34158       7.185128 
1 1 1 4   23 6  o 106.9143 2.969201 139.4931       7.728418 142.7505       10.58264 135.7705       11.31316 108.0869 4.024801 105.3765 4.415373 2.710358       5.974491 
1 1 1 4   23 7  o 253.8343 4.243102 786.4035       26.24641 773.9731       36.48394 799.7373       37.78637 251.6137 5.950198 255.7510 6.062919 -4.137299      8.494930 
1 1 1 4   23 8  o 262.0779 3.865776 838.1424       24.68898 830.7980       38.65019 843.2049       32.08907 260.6389 6.085221 262.7343 5.011921 -2.095428      7.883481 
1 1 1 4   23 9  o 161.4285 2.912281 317.8037       11.45644 307.7838       17.66972 325.0707       15.04794 158.6929 4.573930 163.2131 3.783433 -4.520218      5.935925 
1 1 1 4   23 10 o 74.36392 3.451900 67.61530       6.238356 0.000000       0.000000 67.61530       6.238356 ?        ?        74.36392 3.451900 0.000000       3.451900 
1 1 1 4   23 11 o 220.5164 3.880152 593.5633       20.85094 663.8578       45.93010 575.3157       23.40130 232.3668 8.123737 217.0419 4.424460 15.32483       9.250458 
1 1 1 4   23 12 o 168.5224 3.346118 346.5262       13.74153 355.4265       29.13037 343.9788       15.58446 170.1180 7.042058 167.8667 3.809703 2.251328       8.006523 
1 1 1 4   23 13 o 101.0958 2.907352 124.7739       7.155095 121.7755       15.74886 125.5538       8.031886 99.47559 6.532912 101.3864 3.255105 -1.910774      7.298948 
1 1 1 4   23 14 o 72.21584 2.930908 63.72714       5.147159 82.94131       12.85406 60.05791       5.617163 82.00402 6.485103 70.07466 3.298683 11.92936       7.275842 
1 1 1 4   23 15 o 25.16273 5.065687 8.022109       2.998615 3.522236       8.227576 8.711387       3.220095 23.67733 9.452750 26.22469 5.222330 -2.547359      10.79941 
1 1 1 4   23 16 o 139.4555 3.089131 237.3444       10.49804 243.7547       23.27872 235.7078       11.76200 140.7282 6.808197 138.9007 3.477622 1.827530       7.644959 
1 1 1 4   23 17 o 42.01944 3.655525 21.72792       3.705925 27.34603       9.864046 20.80459       3.998878 46.25518 9.075314 41.06245 4.048917 5.192730       9.937557 
1 1 1 4   23 18 o 41.87831 3.391618 21.55700       3.431649 19.48094       6.502783 22.35832       4.039999 39.20986 7.065469 42.59162 3.936972 -3.381760      8.088301 
1 1 1 4   23 19 o 172.1799 3.024337 361.9277       12.68962 383.0173       21.53899 350.7163       15.70447 176.7550 5.005588 169.3955 3.804391 7.359467       6.287233 
1 1 1 4   23 20 o 95.21916 2.590893 110.7270       6.006288 123.9114       11.01415 105.1468       7.165485 100.5071 4.508429 92.73265 3.175544 7.774414       5.514527 
1 1 1 4   23 21 o 89.34983 2.596939 97.52061       5.648466 99.63943       10.20450 96.58465       6.782245 90.06432 4.665366 88.86784 3.136710 1.196472       5.621796 
1 1 1 4   23 22 o 46.52317 3.131454 26.56235       3.529508 33.29368       7.102001 24.35453       4.067352 51.73134 5.729605 44.46056 3.790159 7.270779       6.869766 
1 1 1 4   23 23 o 142.9184 2.821517 249.4816       9.826685 252.5784       16.49829 247.7790       12.23339 143.4122 4.727274 142.3327 3.527004 1.079453       5.898041 
1 1 1 4   23 24 f 143.0176 3.295776 250.1526       11.48638 232.1147       16.10198 268.8420       16.39025 137.3924 4.816735 147.9460 4.551591 -10.55356      6.627059 
1 1 1 4   23 25 o 52.32218 4.838737 33.93253       6.099688 35.34228       7.218784 30.41338       11.40540 53.24703 5.649404 48.22332 10.03260 5.023708       11.51385 
1 1 1 4   23 26 o 64.27919 3.725323 50.81818       5.810394 40.11940       10.15105 56.03154       7.086028 56.20098 7.607052 67.39840 4.337394 -11.19742      8.756724 
1 1 1 4   23 27 o 46.71104 3.822239 26.96032       4.312831 28.33744       6.786568 26.02740       5.585811 47.43090 6.005997 45.63897 5.110065 1.791927       7.885732 
1 1 1 4   23 28 o 24.70415 6.269744 7.904715       3.780220 12.43635       6.097498 5.075578       4.817829 30.77803 8.042234 21.24279 7.485965 9.535240       10.98714 
1 1 1 4   23 29 o 54.65379 3.736490 36.94296       4.946523 39.92906       7.479494 34.62160       6.594641 56.35414 5.517014 52.52753 5.220948 3.826607       7.595771 
1 1 1 4   23 30 o 105.9084 3.162092 138.0737       8.151813 148.7581       12.06271 129.0927       11.05934 109.3505 4.536618 101.8871 4.465084 7.463371       6.365365 
1 1 1 4   23 31 o 23.26805 7.472638 6.963446       4.803387 5.765088       8.615811 7.503894       5.786019 24.62830 9.724293 24.35350 8.219906 0.2747974      12.73298 
1 1 1 4   23 32 o 63.93599 4.159318 51.26867       6.445251 45.62486       11.88521 53.61984       7.671181 57.62101 8.738050 65.05051 4.874673 -7.429508      10.00580 
1 1 1 4   23 33 o 21.80943 7.687232 6.014771       5.080571 0.000000       0.000000 6.014771       5.080571 ?        ?        21.80943 7.687232 0.000000       7.687232 
1 1 1 4   23 34 o 29.53045 5.816211 11.77312       4.036501 18.52555       5.788492 5.381566       5.631686 36.70298 6.719386 21.14320 7.989576 15.55978       10.43952 
1 1 1 4   23 35 o 26.25263 6.101826 9.621929       3.829220 12.38881       5.473000 6.968657       5.359456 28.95389 7.645206 22.30826 7.892497 6.645630       10.98821 
1 1 1 4   23 36 o 19.43314 6.481687 5.307453       3.598608 9.535913       5.220870 1.480196       4.967016 24.88518 7.765880 16.28236 6.985551 8.602814       10.44542 
1 1 1 4   23 37 o 30.38484 6.325053 13.62789       4.530858 11.94164       7.336830 14.66742       5.760552 25.75866 9.221599 30.16318 7.784634 -4.404526      12.06807 
1 1 1 4   23 38 o 12.40293 5.537879 -0.1585642     3.411010 6.560735       5.053160 -5.783179      4.623250 20.22349 7.584004 11.08358 5.389217 9.139903       9.303804 
1 1 1 4   23 39 f 37.01069 4.724095 19.29135       4.163717 21.12130       6.182968 17.77286       5.632256 35.56152 7.376864 32.65707 7.264841 2.904442       10.35355 
1 1 1 4   23 40 o 30.84295 7.081809 16.43470       5.210192 21.83132       6.258069 4.244213       9.405681 35.01309 7.556445 18.00290 8.450987 17.01019       11.33662 
1 1 1 4   23 41 o 10.92093 5.184507 -2.014651      3.727908 -0.1785828     4.893857 -4.552953      5.754115 13.21846 6.169526 12.12137 5.919949 1.097088       8.550371 
1 1 1 4   23 42 o 13.69117 5.886214 2.397066       3.540630 2.304867       5.183978 2.477679       4.847368 14.45886 6.604035 14.41792 6.505988 0.4093361E-01  9.270446 
1 1 1 4   24 0  o 149.0643 3.290291 271.0041       11.95210 256.2710       15.83832 290.4918       18.21553 144.8256 4.493175 154.1668 4.854635 -9.341156      6.614840 
1 1 1 4   24 1  o 141.2478 3.714231 243.5647       12.77349 254.0331       21.90838 238.1733       15.72234 144.0004 6.258189 139.5992 4.628058 4.401169       7.783563 
1 1 1 4   24 2  o 106.9829 3.554332 139.7726       9.253478 115.0666       14.81310 155.5833       11.85008 96.79601 6.314362 112.8200 4.318189 -16.02397      7.649700 
1 1 1 4   24 3  o 56.25813 4.091483 38.82833       5.570876 43.47425       9.645813 36.50304       6.824044 59.21745 6.807964 54.41727 5.209524 4.800175       8.572486 
1 1 1 4   24 4  o 151.7102 3.232274 280.7260       11.94975 297.8856       17.06396 264.2122       16.73971 156.1394 4.489337 147.0237 4.678188 9.115692       6.483795 
1 1 1 4   24 5  o 188.5074 3.523200 433.5244       16.18460 450.4575       23.24283 417.5861       22.54985 191.9692 4.972641 184.8227 5.011333 7.146484       7.059789 
1 1 1 4   24 6  o 120.8116 2.694746 177.9750       7.933461 180.7834       12.26960 175.9572       10.39999 121.6268 4.145724 120.0379 3.559250 1.588905       5.463999 
1 1 1 4   24 7  o 129.0415 3.382134 203.2882       10.62630 194.1636       17.21149 208.9087       13.50824 125.8906 5.624542 130.7419 4.245453 -4.851303      7.046939 
1 1 1 4   24 8  o 153.4308 3.182877 287.1700       11.90059 303.4641       22.96503 281.1880       13.91464 157.3763 5.999120 151.7892 3.761795 5.587128       7.080998 
1 1 1 4   24 9  o 379.7222 5.197117 1762.590       48.09109 1799.684       76.92262 1738.789       61.61778 382.7542 8.247038 376.7412 6.711611 6.012970       10.63294 
1 1 1 4   24 10 o 241.4431 4.145022 711.8403       24.38809 635.2919       46.87253 740.2562       28.55817 227.1510 8.482643 246.1294 4.761357 -18.97835      9.727577 
1 1 1 4   24 11 o 56.07092 3.370207 38.50335       4.583752 50.07587       10.45553 35.74993       5.099983 63.54629 6.860419 53.97185 3.904007 9.574436       7.893454 
1 1 1 4   24 12 f 66.80724 3.101728 54.57359       5.035892 61.73811       11.71018 52.94796       5.578032 70.61398 6.892787 65.77097 3.492775 4.843010       7.727224 
1 1 1 4   24 13 o 115.0559 2.975502 161.6237       8.335674 149.0530       17.51799 165.3030       9.477371 110.0470 6.562155 116.3280 3.346719 -6.280960      7.366302 
1 1 1 4   24 14 o 74.15111 2.993971 67.20229       5.398926 61.88794       11.99413 68.55268       6.046082 70.63705 7.062464 74.86719 3.322228 -4.230141      7.804844 
1 1 1 4   24 15 o 100.2443 2.944988 122.7325       7.186349 126.7654       17.14520 121.8730       7.915191 101.3315 6.985987 99.86587 3.256788 1.465668       7.707832 
1 1 1 4   24 16 f 162.2300 3.706510 321.5106       14.65319 327.7740       28.13605 319.1795       17.16474 163.0905 7.096418 161.5015 4.365389 1.588959       8.331613 
1 1 1 4   24 17 o 41.25658 3.595910 20.95027       3.579162 24.51170       9.287317 20.32907       3.878768 43.71777 9.017080 40.58952 3.972219 3.128250       9.853236 
1 1 1 4   24 18 o 24.93124 5.102732 7.892400       2.995635 10.31265       8.377031 7.537521       3.207749 29.57958 9.889782 24.31222 5.538378 5.267359       11.33496 
1 1 1 4   24 19 o 84.12079 2.618388 86.44389       5.360981 101.3287       10.19110 80.74900       6.303652 90.84904 4.618401 81.24789 3.189987 9.601151       5.612988 
1 1 1 4   24 20 o 157.6189 2.932877 303.3701       11.26519 308.2240       19.00003 300.7387       13.98927 158.4850 4.925581 156.8384 3.660213 1.646637       6.136653 
1 1 1 4   24 21 o 65.87763 2.771736 53.08541       4.439709 60.69568       8.572016 50.29556       5.190076 70.15242 5.047981 64.06285 3.336032 6.089569       6.050721 
1 1 1 4   24 22 o 11.71139 5.032087 -0.1913644     2.584763 5.766279       6.023837 -1.535806      2.861587 23.28303 8.353376 11.05590 4.992918 12.22713       9.731811 
1 1 1 4   24 23 o 153.6121 3.398309 288.6610       12.72109 284.2086       18.24750 292.8710       17.74375 152.0107 4.932517 154.3722 4.722274 -2.361542      6.828586 
1 1 1 4   24 24 o 20.67026 8.244131 2.849747       6.252012 -4.091484      7.895329 14.51999       10.23746 18.26283 8.266109 34.00114 10.90827 -15.73832      13.68645 
1 1 1 4   24 25 o 57.86285 4.057452 41.28749       5.684965 38.46656       10.55042 42.44164       6.748457 54.85305 8.139315 58.53816 4.772110 -3.685104      9.435120 
1 1 1 4   24 26 o 37.65464 3.658764 17.55450       3.315016 18.15106       6.601713 17.35336       3.833348 37.44199 7.497076 37.32475 4.292552 0.1172447      8.638989 
1 1 1 4   24 27 o 26.37309 4.932026 8.867425       3.053233 5.460890       6.036053 10.03874       3.539440 22.74491 8.332987 28.00831 5.381255 -5.263405      9.919505 
1 1 1 4   24 28 o 86.02158 2.704978 90.73585       5.663268 91.20934       9.878175 90.50402       6.912006 85.68547 4.749367 85.77605 3.312984 -0.9057617E-01 5.790713 
1 1 1 4   24 29 o 45.91178 4.436044 26.37499       4.901392 31.17686       7.159077 22.13835       6.724541 49.42488 6.071356 41.23697 6.937808 8.187916       9.219248 
1 1 1 4   24 30 o 60.40205 3.882124 45.38485       5.683968 42.80439       7.787538 48.32675       8.315055 58.02414 5.576076 61.67422 5.593310 -3.650089      7.897958 
1 1 1 4   24 31 o 42.27503 4.379460 22.58084       4.446434 15.71028       6.605725 28.27274       6.012472 33.76217 8.127171 46.96869 5.348173 -13.20652      9.729022 
1 1 1 4   24 32 o 12.84691 5.781093 -1.440066      3.797235 -4.226219      7.084650 -0.3170626     4.497866 16.31869 7.550048 14.92915 6.524601 1.389540       9.978660 
1 1 1 4   24 33 o 48.19589 3.972094 29.46119       4.623775 28.41512       6.711928 30.40600       6.378794 46.12560 6.122353 48.10213 5.542982 -1.976532      8.258804 
1 1 1 4   24 34 o 39.72937 4.962717 20.78973       4.700214 15.98010       8.024185 23.30192       5.799242 31.70505 9.579393 41.48067 5.903515 -9.775614      11.25239 
1 1 1 4   24 35 o 32.67819 5.038008 14.38884       3.883152 17.71154       5.724586 11.55692       5.284935 34.91095 6.973130 27.61021 7.610544 7.300743       10.32206 
1 1 1 4   24 36 f 26.16420 6.578189 10.23156       4.189188 2.507669       6.611647 15.41219       5.414804 18.19799 7.932642 31.78265 7.163272 -13.58466      10.68828 
1 1 1 4   24 37 o 37.61488 4.690110 19.41442       4.205970 18.95016       5.884866 19.89921       6.013501 34.69735 7.196174 35.60035 7.179721 -0.9029922     10.16530 
1 1 1 4   24 38 o 18.64879 6.441255 5.411577       3.556870 3.081390       5.146194 7.542864       4.921663 16.68119 7.132516 20.99440 7.548343 -4.313208      10.38510 
1 1 1 4   24 39 f 14.77208 6.086117 2.631148       3.537071 7.019186       5.356546 -0.7614550     4.709949 19.62108 7.691655 13.24858 6.138828 6.372499       9.841076 
1 1 1 4   24 40 o 23.57484 8.076898 11.76222       5.589049 11.76222       5.589049 0.000000       0.000000 23.57484 8.076898 ?        ?        0.000000       8.076898 
1 1 1 4   24 41 o 13.08836 5.791798 1.488629       3.647380 6.644250       5.357958 -2.963833      4.979193 17.82064 7.429361 11.80396 5.704519 6.016681       9.366800 
1 1 1 4   24 42 o 18.18717 6.651582 6.638257       3.843370 8.814066       5.782135 4.916005       5.144299 18.76580 7.761374 15.95275 6.974712 2.813047       10.43482 
1 1 1 4   25 0  o 50.55237 3.795313 31.36056       4.641334 30.14279       6.002193 33.17169       7.319868 49.41499 5.055605 51.74852 5.910426 -2.333530      7.777678 
1 1 1 4   25 1  o 277.5903 4.093842 940.5862       27.69310 985.8611       44.45049 911.8655       35.40348 283.8181 6.426882 273.1500 5.318739 10.66812       8.342290 
1 1 1 4   25 2  o 90.39489 3.008285 99.77071       6.617495 104.7648       9.175525 94.35728       9.552985 92.55312 4.078227 87.79049 4.480165 4.762627       6.058367 
1 1 1 4   25 3  o 191.3575 3.597389 446.8101       16.77525 451.5214       23.51299 441.9259       23.94036 192.1671 5.025341 190.0931 5.172878 2.074051       7.211984 
1 1 1 4   25 4  o 216.9704 5.551019 575.9809       29.32597 0.000000       0.000000 575.9809       29.32597 ?        ?        216.9704 5.551019 0.000000       5.551019 
1 1 1 4   25 5  o 189.0633 4.154007 436.4102       19.13861 0.000000       0.000000 436.4102       19.13861 ?        ?        189.0633 4.154007 0.000000       4.154007 
1 1 1 4   25 6  o 45.48108 4.653883 25.53183       5.085365 0.000000       0.000000 25.53183       5.085365 ?        ?        45.48108 4.653883 0.000000       4.653883 
1 1 1 4   25 7  o 158.7028 2.930199 307.2145       11.33229 290.1003       17.18515 320.3823       15.07411 154.0317 4.583427 162.0075 3.818216 -7.975784      5.965449 
1 1 1 4   25 8  o 258.2347 3.851161 814.0906       24.23496 820.3653       38.31447 809.9059       31.28957 258.8573 6.073881 257.4021 4.988287 1.455170       7.859710 
1 1 1 4   25 9  o 222.5334 3.489504 604.3957       18.92322 605.8065       29.67574 603.4289       24.56564 222.5224 5.472575 222.2276 4.536218 0.2947845      7.108189 
1 1 1 4   25 10 o 36.93098 4.481650 16.90942       3.950896 18.42358       8.418015 16.48166       4.474308 37.90683 9.205829 36.34444 5.199868 1.562389       10.57289 
1 1 1 4   25 11 o 98.63593 3.038297 118.8233       7.294294 90.75037       14.53991 128.2648       8.432156 85.69720 7.023980 102.4553 3.381922 -16.75811      7.795748 
1 1 1 4   25 12 o 116.2918 3.040284 165.1396       8.608485 179.7587       19.11033 161.4179       9.642170 120.8752 6.511802 114.9371 3.446428 5.938065       7.367593 
1 1 1 4   25 13 o 41.73329 3.940503 21.46596       3.960023 33.23721       9.676113 19.09771       4.340137 51.35916 7.990994 39.24942 4.626466 12.10973       9.233644 
1 1 1 4   25 14 o 147.4458 3.592835 265.5227       12.90940 260.4524       24.05015 267.5748       15.30041 145.4312 6.805029 147.8842 4.250069 -2.452988      8.023186 
1 1 1 4   25 15 o 92.08988 2.969183 103.6166       6.654522 101.1446       14.55389 104.2700       7.482482 90.48155 6.646983 92.34733 3.330405 -1.865776      7.434648 
1 1 1 4   25 16 f 70.70870 3.070993 61.15360       5.278991 66.78663       12.33136 59.88962       5.841312 73.34072 6.983896 69.93846 3.437884 3.402260       7.784205 
1 1 1 4   25 17 o 118.9301 3.016464 172.8050       8.735251 173.8595       19.44852 172.5385       9.776906 118.6587 6.753797 118.7975 3.380646 -0.1388245     7.552651 
1 1 1 4   25 18 o 95.96800 2.962759 112.5610       6.920515 100.3943       15.37797 115.6508       7.749611 89.96396 7.071259 97.24484 3.274894 -7.280884      7.792794 
1 1 1 4   25 19 o 74.02196 2.963111 67.02091       5.334161 64.80923       12.65286 67.49895       5.882450 72.07880 7.304253 74.25593 3.258741 -2.177132      7.998219 
1 1 1 4   25 20 o 78.06694 2.722033 74.50349       5.170488 69.70424       9.415833 76.57542       6.186727 75.17735 5.171175 79.09514 3.216488 -3.917793      6.089898 
1 1 1 4   25 21 o 108.4854 2.693144 143.7257       7.119784 141.3196       12.44813 144.8955       8.679656 107.2089 4.776711 108.8179 3.276885 -1.608994      5.792663 
1 1 1 4   25 22 o 64.47204 3.608175 51.03250       5.646234 45.61303       8.473593 55.36026       7.572186 60.56165 5.812903 66.99372 4.667408 -6.432076      7.454833 
1 1 1 4   25 23 o 19.84964 7.091493 4.210374       4.336497 7.805889       9.135583 3.164581       4.926956 27.62794 10.22910 19.33302 7.432300 8.294916       12.64412 
1 1 1 4   25 24 o 29.55694 5.862849 11.17292       4.073685 3.179312       6.518039 16.29665       5.218420 21.22348 8.433114 35.77740 6.210556 -14.55392      10.47322 
1 1 1 4   25 25 o 52.85764 3.058872 34.31899       3.923250 29.31377       7.425454 36.25732       4.620885 48.12469 6.497525 54.26659 3.513151 -6.141895      7.386478 
1 1 1 4   25 26 o 15.19527 5.693381 2.172981       2.846472 -4.035060      5.846728 4.101529       3.258748 15.10272 6.941011 18.57155 6.167317 -3.468826      9.285119 
1 1 1 4   25 27 o 49.64371 3.151067 30.36613       3.792370 33.23678       7.079582 29.21090       4.491080 51.30954 5.761471 48.55740 3.826311 2.752132       6.916300 
1 1 1 4   25 28 o 39.91687 3.806748 19.83969       3.658151 13.77675       6.322472 22.89083       4.485144 32.08489 8.089512 42.76596 4.364834 -10.68107      9.191952 
1 1 1 4   25 29 o 43.18311 4.022653 23.31613       4.184449 28.01410       6.714798 20.33342       5.350358 46.67607 6.045260 39.79201 5.678495 6.884060       8.294003 
1 1 1 4   25 30 o 90.81205 2.783977 101.6441       6.153638 97.79225       10.52584 103.6442       7.584855 88.00906 4.927551 91.44206 3.409781 -3.433006      5.992276 
1 1 1 4   25 31 o 21.82583 6.985540 6.271203       4.200201 16.57406       8.759254 3.194847       4.786373 33.57701 9.977202 18.53867 7.269753 15.03834       12.34479 
1 1 1 4   25 32 o 14.63739 6.269111 0.4330703      3.987828 7.272210       7.685246 -2.086871      4.665007 24.19878 9.287682 13.82188 6.294479 10.37690       11.21969 
1 1 1 4   25 33 o 71.40528 3.361869 64.11420       5.833458 71.79652       8.809584 58.11545       7.784671 74.31010 4.892083 66.90240 4.806920 7.407700       6.858495 
1 1 1 4   25 34 o 31.06663 5.286337 13.09605       3.858867 11.48760       5.682285 14.47275       5.257015 27.39932 8.008327 31.54197 7.020105 -4.142649      10.64966 
1 1 1 4   25 35 o 15.88284 6.502136 2.360032       4.004162 11.06614       7.146339 -1.623993      4.834290 25.53619 9.105692 13.78801 6.327462 11.74818       11.08830 
1 1 1 4   25 36 o 21.07321 6.506893 6.776599       3.676216 5.974113       5.305408 7.517761       5.098664 19.93877 7.700024 21.60230 7.692544 -1.663534      10.88419 
1 1 1 4   25 37 o 19.77169 6.500707 6.116394       3.623438 11.73764       5.684225 2.268702       4.702785 25.63973 8.117394 15.83096 6.794640 9.808768       10.58580 
1 1 1 4   25 38 o 14.15840 5.900372 2.078590       3.377669 7.170288       5.238716 -1.543959      4.418762 20.03800 7.673850 12.55548 5.860855 7.482523       9.655962 
1 1 1 4   25 39 o 14.52077 6.230302 2.315783       3.951665 6.971355       5.372828 -3.170320      5.832415 19.09225 7.633226 13.00211 6.255992 6.090138       9.869326 
1 1 1 4   25 40 o 15.22928 6.587299 3.311467       4.486868 6.890963       5.420321 -4.480831      7.997365 18.26377 7.530345 13.76361 6.774107 4.500161       10.12890 
1 1 1 4   25 41 o 12.08224 5.454554 0.6976959      3.411793 2.062533       5.163502 -0.3599382     4.545394 14.25118 6.539773 12.46464 5.858650 1.786533       8.780228 
1 1 1 4   26 0  o 165.6830 3.058326 334.8534       12.34804 335.6819       19.09666 334.2581       16.18729 165.6897 4.734468 165.4679 4.014433 0.2218475      6.207323 
1 1 1 4   26 1  o 116.2454 3.695729 165.0894       10.45586 141.8363       15.68269 183.6967       14.02881 107.4893 6.011081 122.5300 4.707069 -15.04070      7.634762 
1 1 1 4   26 2  o 247.1132 4.874113 746.2337       29.35131 765.7872       50.58435 736.3088       36.03855 249.4915 8.331706 245.2735 6.029490 4.218018       10.28456 
1 1 1 4   26 3  o 90.18211 3.540540 99.40272       7.765711 97.41570       12.25082 100.7375       10.04074 89.05615 5.674531 90.69464 4.557661 -1.638489      7.278226 
1 1 1 4   26 4  o 79.17673 3.085553 76.59339       5.942025 68.08721       7.927737 87.49820       8.976169 74.53285 4.384173 84.52505 4.372686 -9.992203      6.192040 
1 1 1 4   26 5  o 225.4711 4.570200 621.1495       25.11089 659.3757       43.57132 602.1388       30.72698 231.5812 7.731620 221.7524 5.690815 9.828857       9.600173 
1 1 1 4   26 6  o 122.8028 3.054993 183.9855       9.142282 181.8076       12.54919 186.4486       13.34583 121.9290 4.229908 123.4541 4.443377 -1.525093      6.134796 
1 1 1 4   26 7  o 80.61919 3.222754 79.43705       6.318668 89.20865       13.26427 76.56872       7.186460 85.07178 6.446234 79.10503 3.738569 5.966751       7.451901 
1 1 1 4   26 8  o 26.15979 6.092181 8.719954       3.811010 -1.601873      8.102362 11.65225       4.318543 20.08359 8.767562 30.31104 6.058535 -10.22745      10.65720 
1 1 1 4   26 9  o 149.4664 3.276887 272.6616       11.93551 307.2052       25.81263 263.2676       13.46095 158.0879 6.715649 146.7814 3.766409 11.30649       7.699726 
1 1 1 4   26 10 o 91.70810 3.105606 102.7548       6.930478 118.0666       15.22141 98.75035       7.784147 97.90240 6.415417 89.86224 3.561712 8.040169       7.337803 
1 1 1 4   26 11 o 184.3116 3.557104 414.8263       15.97664 457.5535       34.51713 403.1766       18.02356 192.7409 7.362476 181.6433 4.071788 11.09764       8.413412 
1 1 1 4   26 12 o 109.1777 3.404285 145.6840       9.046170 157.4624       17.54845 141.4214       10.55696 113.0819 6.394149 107.4993 4.037101 5.582634       7.561966 
1 1 1 4   26 13 o 149.1281 3.681898 271.6833       13.38034 230.3593       23.36716 291.8430       16.32096 136.6692 7.039880 154.4228 4.341397 -17.75360      8.270890 
1 1 1 4   26 14 o 179.4973 3.494668 393.5566       15.28621 419.7244       32.87592 386.3389       17.26616 184.4477 7.328818 177.7770 3.985511 6.670670       8.342414 
1 1 1 4   26 15 o 138.7849 3.169332 235.2034       10.71880 232.3705       22.74010 236.0126       12.15365 137.2374 6.820981 138.9341 3.592747 -1.696625      7.709320 
1 1 1 4   26 16 o 18.42782 6.113430 3.960515       3.202250 3.460331       7.711363 4.064743       3.520113 22.98571 9.159771 18.88885 6.411214 4.096863       11.18057 
1 1 1 4   26 17 o 80.84710 3.024814 79.93193       5.948845 69.13675       13.25018 82.65723       6.657539 74.47309 7.398810 82.18425 3.331117 -7.711159      8.114107 
1 1 1 4   26 18 f 218.5561 3.904169 584.3988       20.79350 614.2661       44.72292 576.1618       23.48641 222.3497 8.268271 216.8795 4.443877 5.470154       9.386818 
1 1 1 4   26 19 o 28.05569 4.968794 9.942105       3.272780 3.005625       8.854667 11.03965       3.522198 23.83469 9.702510 29.58286 5.068044 -5.748171      10.94640 
1 1 1 4   26 20 o 79.40005 2.987557 77.14519       5.770293 91.56787       14.47734 74.42125       6.291643 85.74409 6.989221 77.94413 3.320018 7.799965       7.737682 
1 1 1 4   26 21 o 18.49039 6.814363 3.368791       4.046112 -6.608412      6.591897 9.399972       5.125157 15.11634 7.089250 27.09540 7.504683 -11.97906      10.32365 
1 1 1 4   26 22 o 83.46605 3.788381 85.53522       7.685391 98.62940       14.82971 80.72709       8.986308 88.89047 6.900067 80.93849 4.574690 7.951981       8.278811 
1 1 1 4   26 23 o 73.17411 3.467256 65.74225       6.165132 65.37936       9.173849 66.04112       8.325399 72.62308 5.218503 73.10921 4.697875 -0.4861374     7.021596 
1 1 1 4   26 24 o 28.12033 4.565533 9.981196       3.021380 17.02986       6.485439 8.027321       3.414559 36.20878 7.592978 24.96863 5.733051 11.24015       9.514262 
1 1 1 4   26 25 o 60.24834 2.903385 44.55956       4.250163 58.13846       8.421915 39.91964       4.923039 68.35063 5.092897 56.90637 3.568022 11.44426       6.218391 
1 1 1 4   26 26 o 54.63685 3.016390 36.72693       4.000559 42.19092       7.471701 34.53095       4.736739 58.00410 5.346078 52.84249 3.701825 5.161602       6.502620 
1 1 1 4   26 27 o 41.04203 3.754201 20.95332       3.713222 25.64872       6.864923 19.01145       4.414783 44.61860 6.505006 38.82962 4.765430 5.788986       8.063772 
1 1 1 4   26 28 o 15.46503 6.025890 1.989986       3.271390 0.5734877      5.768709 2.661467       3.971799 17.75319 7.570120 17.25088 6.662245 0.5023117      10.08426 
1 1 1 4   26 29 o 59.35403 3.461853 43.76380       4.985466 43.42256       7.822045 43.99726       6.469880 58.24606 5.578953 59.11552 4.525568 -0.8694611     7.183696 
1 1 1 4   26 30 o 25.42855 4.872421 8.434898       2.909402 11.35344       5.800932 7.454029       3.362948 28.54930 8.012680 23.61850 5.868810 4.930801       9.932068 
1 1 1 4   26 31 o 72.44516 3.097906 65.33031       5.456446 74.36767       12.66318 63.26981       6.046566 74.11902 7.097562 71.08337 3.501412 3.035645       7.914245 
1 1 1 4   26 32 o 25.22092 4.885032 8.457993       2.893896 2.311470       5.164887 11.27061       3.493826 17.69048 7.327758 29.10570 5.112367 -11.41522      8.934895 
1 1 1 4   26 33 o 47.05066 3.907936 28.44430       4.440326 34.43890       6.782546 23.94796       5.874106 50.48777 5.607236 41.78402 5.935741 8.703751       8.165422 
1 1 1 4   26 34 o 22.82856 6.866942 7.780019       4.129956 4.347285       7.613291 9.211375       4.916162 20.31466 8.680440 24.42903 7.521402 -4.114370      11.48571 
1 1 1 4   26 35 o 18.36661 6.531190 4.846623       3.674171 9.313448       5.611059 1.493725       4.861335 23.63719 8.092946 15.74169 6.832613 7.895495       10.59152 
1 1 1 4   26 36 o 24.08734 6.776833 9.224811       4.144222 12.41156       7.527503 7.838818       4.964293 25.10616 9.287128 21.66742 7.601872 3.438740       12.00163 
1 1 1 4   26 37 o 19.03406 6.449924 5.786271       3.562631 -0.2706082E-01 5.245978 10.76233       4.853519 14.46281 6.620032 24.84293 7.437677 -10.38012      9.957102 
1 1 1 4   26 38 o 15.93171 6.413946 3.686488       3.821136 1.393036       5.417181 5.957590       5.390719 15.02617 6.819384 18.38575 7.537577 -3.359586      10.16460 
1 1 1 4   26 39 o 14.15434 6.322922 1.767886       4.452292 1.342173       5.360791 2.714461       7.993695 14.48177 6.652206 16.28500 7.689566 -1.803228      10.16766 
1 1 1 4   26 40 o 16.76289 6.945419 5.360000       4.641718 9.192324       5.570772 -3.342566      8.394753 19.85029 7.825004 14.01437 6.905799 5.835918       10.43651 
1 1 1 4   27 0  o 211.4682 4.433782 546.3794       22.84838 539.5513       27.42796 561.8611       41.30045 209.9408 5.365579 213.6497 7.946464 -3.708893      9.588312 
1 1 1 4   27 1  o 131.2364 3.159374 210.1499       10.10395 198.1532       13.72746 224.3329       14.92596 127.2718 4.432874 135.4166 4.529454 -8.144798      6.337691 
1 1 1 4   27 2  o 32.84269 4.920190 13.47753       3.816746 18.12695       5.091925 7.515398       5.766114 38.07504 5.659777 25.16342 8.196174 12.91162       9.960439 
1 1 1 4   27 3  o 198.9930 5.181744 484.7009       25.10615 484.7009       25.10615 0.000000       0.000000 198.9930 5.181744 ?        ?        0.000000       5.181744 
1 1 1 4   27 4  o 75.73746 2.871009 70.07822       5.289253 67.50274       7.809259 72.26107       7.189395 74.20182 4.337677 76.82936 3.852271 -2.627541      5.801330 
1 1 1 4   27 5  o 148.3539 2.930365 268.5195       10.59392 309.2039       17.32528 244.2235       13.38857 158.9948 4.476038 141.3592 3.890337 17.63560       5.930399 
1 1 1 4   27 6  o 143.5107 2.882772 251.2716       10.08163 264.8738       15.92452 242.1732       13.02402 147.1447 4.446150 140.7697 3.800121 6.375000       5.848860 
1 1 1 4   27 7  o 90.59290 3.044193 100.2625       6.710967 104.5965       9.143478 95.20123       9.880833 92.43855 4.069000 88.12022 4.617425 4.318321       6.154459 
1 1 1 4   27 8  o 95.42060 3.018535 111.2241       7.010157 105.1517       9.385105 118.8878       10.54340 92.66745 4.166660 98.51869 4.402755 -5.851242      6.061791 
1 1 1 4   27 9  o 17.91225 6.051998 3.658223       3.136498 6.322756       3.885417 -1.326267      5.314195 22.51646 6.633346 16.08757 7.059787 6.428894       9.687201 
1 1 1 4   27 10 o 41.96395 4.101838 21.72675       4.141102 22.79682       4.890097 19.01393       7.786123 42.90552 4.756836 38.50895 8.522683 4.396568       9.760308 
1 1 1 4   27 11 o 83.13062 3.917366 84.63995       7.913487 77.34576       13.39128 88.55405       9.809544 78.99216 7.030047 84.93311 4.758563 -5.940948      8.489139 
1 1 1 4   27 12 o 142.7286 3.293086 248.7661       11.45382 222.6430       22.51041 257.8922       13.30492 134.3519 6.898586 145.2257 3.762692 -10.87376      7.858011 
1 1 1 4   27 13 o 156.1077 3.330448 297.6423       12.66960 293.6903       26.27674 298.8393       14.46165 154.2831 7.007324 156.3655 3.795254 -2.082367      7.969099 
1 1 1 4   27 14 o 77.70372 3.157718 73.85629       5.966856 73.07202       12.95257 74.06757       6.722675 76.70461 7.006737 77.77431 3.556483 -1.069702      7.857667 
1 1 1 4   27 15 o 111.3600 3.076897 151.5598       8.341843 157.4682       18.27501 150.0047       9.375565 112.8874 6.672948 110.7401 3.478528 2.147346       7.525184 
1 1 1 4   27 16 o 128.5731 3.813295 202.3591       11.93456 189.3696       20.60590 208.9160       14.64008 123.7290 6.861007 130.5028 4.610737 -6.773788      8.266336 
1 1 1 4   27 17 o 141.5258 3.902019 245.2737       13.44456 258.2882       24.14922 239.4281       16.18472 144.4843 6.878523 139.6568 4.762585 4.827515       8.366379 
1 1 1 4   27 18 o 76.54847 3.922974 71.91759       7.293520 69.29859       13.14160 73.08339       8.767791 74.46366 7.337379 77.04901 4.691922 -2.585350      8.709263 
1 1 1 4   27 19 o 71.96886 4.041641 63.64993       7.059760 55.16597       12.68529 67.45670       8.497272 66.12550 8.037023 73.98148 4.738156 -7.855988      9.329730 
1 1 1 4   27 20 o 24.48780 9.950774 3.404944       9.294168 0.000000       0.000000 3.404944       9.294168 ?        ?        24.48780 9.950774 0.000000       9.950774 
1 1 1 4   27 21 o 50.49274 3.551185 31.37780       4.341701 25.25505       10.68258 32.58929       4.751868 43.77172 10.20397 51.42352 3.819250 -7.651802      10.89531 
1 1 1 4   27 22 o 13.42762 5.356749 1.138263       2.640191 -4.842227      6.133213 2.498573       2.925086 15.19288 7.027644 15.81911 5.800014 -0.6262236     9.111967 
1 1 1 4   27 23 o 27.53789 4.682487 9.600021       3.029889 11.40093       6.915993 9.172275       3.370563 29.72025 8.873845 26.77318 5.353354 2.947071       10.36357 
1 1 1 4   27 24 o 93.23206 2.774167 106.5215       6.295794 105.3225       11.17510 107.0790       7.620182 92.11482 4.997066 93.35228 3.355144 -1.237457      6.018942 
1 1 1 4   27 25 o 27.96220 4.690011 9.935337       3.082763 11.13174       6.128997 9.530153       3.566782 29.06669 8.263291 27.17754 5.572783 1.889153       9.966840 
1 1 1 4   27 26 f 24.82993 5.727055 8.033746       3.394652 8.871860       8.325898 7.866641       3.717698 27.28616 9.816822 24.51110 6.216012 2.775057       11.61933 
1 1 1 4   27 27 o 38.87469 4.264173 18.99487       3.973373 24.14878       6.658006 16.14398       4.951836 43.08957 6.546351 35.27870 5.972845 7.810863       8.861692 
1 1 1 4   27 28 o 61.81194 3.340716 47.39323       5.013387 52.56284       8.042669 44.10799       6.411439 64.33100 5.173913 59.20721 4.476874 5.123787       6.841913 
1 1 1 4   27 29 o 13.16632 5.332194 1.085610       2.658365 4.793676       5.712481 0.6061417E-01  3.003392 21.04472 8.024638 12.64871 5.429397 8.396005       9.688817 
1 1 1 4   27 30 o 41.04769 3.794827 21.29760       3.752960 31.18234       9.127855 19.28666       4.117048 46.96906 8.277122 38.79069 4.434960 8.178368       9.390401 
1 1 1 4   27 31 o 24.82315 5.264649 8.288811       3.085801 -1.688689      6.702340 10.97270       3.476143 16.75246 7.595871 28.70234 5.159517 -11.94988      9.182476 
1 1 1 4   27 32 o 28.27440 4.600154 10.58898       3.060724 9.072422       5.738636 11.19190       3.618337 24.63000 8.184334 28.69239 5.372343 -4.062387      9.790066 
1 1 1 4   27 33 o 18.28745 6.054898 4.638721       3.141647 -2.867089      7.501006 6.235482       3.459718 16.37335 7.640730 20.78913 6.292002 -4.415777      9.897982 
1 1 1 4   27 34 o 22.60724 5.585977 7.372830       3.059314 4.521278       5.624692 8.570832       3.645751 18.88973 7.716584 24.02062 6.189715 -5.130888      9.892332 
1 1 1 4   27 35 o 16.59905 6.206193 3.754489       3.378654 4.560513       4.996399 3.075383       4.586191 18.25308 7.339250 16.62067 6.896653 1.632408       10.07117 
1 1 1 4   27 36 o 21.69968 6.393084 7.504064       3.608966 8.215128       5.696537 7.027311       4.664479 21.37038 8.044216 20.40340 7.346878 0.9669819      10.89431 
1 1 1 4   27 37 o 17.91079 7.018186 5.302168       4.457975 8.965723       7.799337 3.524466       5.432953 20.55403 8.784375 16.59154 7.212131 3.962488       11.36574 
1 1 1 4   27 38 o 11.90709 5.428413 -0.1227439     3.481652 2.143897       5.657893 -1.504152      4.416969 15.25027 6.939943 12.16317 5.734965 3.087098       9.002924 
1 1 1 4   27 39 o 12.04509 5.704491 -1.387296      4.461118 0.6372960      5.420974 -5.635155      7.852241 13.90485 6.491010 13.28366 6.570392 0.6211901      9.235976 
1 1 1 4   28 0  o 193.2391 3.690381 455.9749       17.37810 438.3498       23.44208 477.4780       25.89299 189.2149 5.088609 197.4283 5.386948 -8.213364      7.410340 
1 1 1 4   28 1  o 144.5226 3.320430 254.9473       11.69408 246.1814       15.52720 266.4359       17.77580 141.8405 4.497862 147.5004 4.952404 -5.659958      6.690072 
1 1 1 4   28 2  o 148.0380 3.789824 267.8288       13.66064 268.2563       16.29048 266.8160       25.07458 148.0625 4.520244 147.2249 7.009152 0.8376007      8.340313 
1 1 1 4   28 3  o 122.9784 3.135001 184.6957       9.387464 191.8925       13.03028 176.9296       13.53591 125.2313 4.276043 120.1995 4.629793 5.031799       6.302343 
1 1 1 4   28 4  o 133.5107 3.172747 217.5610       10.32257 203.0256       13.82752 235.8588       15.51428 128.7962 4.412114 138.8069 4.592857 -10.01065      6.368758 
1 1 1 4   28 5  o 215.1712 3.474359 565.3094       18.21775 615.1404       29.62895 535.0189       23.10040 224.1166 5.425080 209.1734 4.531865 14.94325       7.068896 
1 1 1 4   28 6  o 165.4474 3.048715 334.0783       12.29172 329.1039       18.85079 337.7576       16.21230 163.9532 4.723091 166.2561 4.001574 -2.302887      6.190330 
1 1 1 4   28 7  o 94.57555 2.991248 109.2734       6.885269 102.2470       9.329023 117.6800       10.20421 91.36084 4.201499 98.01736 4.282423 -6.656517      5.999312 
1 1 1 4   28 8  o 93.32936 2.976147 106.4186       6.760102 111.1210       9.455512 101.5020       9.668503 95.25964 4.082709 91.00097 4.372702 4.258667       5.982394 
1 1 1 4   28 9  o 171.5169 3.068372 359.1155       12.82481 401.7469       20.96153 333.6096       16.21357 181.1132 4.753487 165.2020 4.027423 15.91125       6.230231 
1 1 1 4   28 10 o 46.91799 3.367833 27.02236       3.824964 21.51609       5.272542 33.13951       5.557319 41.56648 5.327570 51.85813 4.440255 -10.29165      6.935335 
1 1 1 4   28 11 o 74.40157 3.263661 67.73362       5.902899 84.94290       12.89699 63.17318       6.639119 82.87952 6.436060 71.79187 3.808515 11.08765       7.478479 
1 1 1 4   28 12 o 166.5616 3.476711 338.9622       14.11171 321.6448       28.00123 344.8580       16.33824 161.3875 7.137511 167.9303 3.992454 -6.542892      8.178248 
1 1 1 4   28 13 o 112.4973 3.757178 154.8961       10.28561 158.9821       18.22712 152.9870       12.45883 113.4441 6.622047 111.6782 4.587739 1.765930       8.055983 
1 1 1 4   28 14 o 97.31142 3.793959 115.9803       8.979655 130.7497       16.48353 109.7475       10.70806 102.8097 6.614400 94.53011 4.662800 8.279610       8.092712 
1 1 1 4   28 15 o 154.8812 3.993452 293.7530       15.05986 309.1099       27.14352 286.9233       18.10149 158.0481 7.065452 152.8836 4.864861 5.164520       8.578315 
1 1 1 4   28 16 o 134.3840 3.871752 221.1960       12.66597 221.2447       22.24089 221.1727       15.40875 133.6588 6.851252 134.2070 4.718808 -0.5482483     8.319062 
1 1 1 4   28 17 o 43.52151 4.160399 23.41527       4.358757 22.58064       9.696815 23.62661       4.879505 41.61976 9.735144 43.64000 4.660380 -2.020237      10.79315 
1 1 1 4   28 18 o 80.84103 4.799527 80.53827       9.412549 0.000000       0.000000 80.53827       9.412549 ?        ?        80.84103 4.799527 0.000000       4.799527 
1 1 1 4   28 19 o 85.41742 4.109312 89.67762       8.528562 0.000000       0.000000 89.67762       8.528562 ?        ?        85.41742 4.109312 0.000000       4.109312 
1 1 1 4   28 20 o 127.1655 3.126162 197.8735       9.687617 201.9566       21.47487 196.8303       10.85488 127.2349 6.952512 126.7103 3.518826 0.5245895      7.792276 
1 1 1 4   28 21 o 35.22277 4.147627 15.44915       3.491908 22.51427       9.206123 14.26188       3.773923 41.34174 9.356924 33.71207 4.723207 7.629669       10.48145 
1 1 1 4   28 22 o 80.27007 3.054693 79.03674       5.964363 90.50158       14.39358 76.66003       6.553486 84.73324 7.034104 78.98636 3.412795 5.746880       7.818298 
1 1 1 4   28 23 o 67.01366 2.895232 55.12500       4.716904 53.81681       8.887634 55.63797       5.565385 65.54798 5.618177 67.23017 3.408113 -1.682190      6.571084 
1 1 1 4   28 24 o 13.43173 5.510693 0.8203571      2.884080 -0.3386719     6.060384 1.159695       3.279211 17.65339 7.645748 14.55662 5.912329 3.096768       9.665045 
1 1 1 4   28 25 o 59.92881 3.267269 44.33272       4.753471 61.54345       11.87950 41.05174       5.186810 69.08567 7.159930 57.55094 3.718282 11.53473       8.067851 
1 1 1 4   28 26 o 25.57728 5.570809 8.549089       3.373693 5.305233       6.047922 10.01446       4.064898 22.19581 8.302465 27.56478 6.201896 -5.368969      10.36313 
1 1 1 4   28 27 o 40.11720 4.064306 20.24919       3.918554 17.99244       6.407110 21.59775       4.952852 36.49092 7.457226 41.10474 5.050598 -4.613819      9.006596 
1 1 1 4   28 28 o 25.94965 4.850457 8.774878       2.954512 9.002679       5.969807 8.700981       3.400115 25.70481 8.337283 25.60226 5.605518 0.1025562      10.04650 
1 1 1 4   28 29 o 16.40982 5.738494 3.230497       2.827398 10.07187       7.396800 2.059843       3.059754 26.73279 9.285914 14.99548 5.832017 11.73731       10.96543 
1 1 1 4   28 30 o 22.38872 5.542961 6.819380       3.007958 11.60265       7.835980 5.992748       3.257519 27.70123 9.560889 20.92448 6.048399 6.776752       11.31343 
1 1 1 4   28 31 o 11.66107 5.134959 -0.3440304     2.833756 -12.16175      7.731046 1.490148       3.045735 13.68454 6.720284 14.01767 5.696291 -0.3331270     8.809650 
1 1 1 4   28 32 o 13.07980 5.355127 1.253013       2.716379 -0.5108987     4.850026 2.059219       3.278902 14.63106 6.562834 14.83795 5.952602 -0.2068825     8.860264 
1 1 1 4   28 33 o 19.16402 5.881175 5.317776       3.008797 8.448065       5.504706 3.984153       3.593010 22.86542 8.006243 17.27627 6.411582 5.589148       10.25711 
1 1 1 4   28 34 o 24.41802 5.354383 8.584025       3.098127 7.774240       5.574357 8.945963       3.726719 21.65052 7.994990 24.27329 6.259742 -2.622774      10.15403 
1 1 1 4   28 35 o 34.37491 4.123049 16.04203       3.384956 8.105686       5.879190 19.97739       4.139989 21.33344 8.139398 37.97739 4.564802 -16.64395      9.332052 
1 1 1 4   28 36 o 11.64729 5.072818 0.5344780      2.698899 3.110274       5.270320 -0.3811005     3.142166 16.31719 7.098006 11.50137 5.209335 4.815824       8.804480 
1 1 1 4   28 37 o 14.89933 5.499164 3.308583       2.636680 2.737294       5.194654 3.506845       3.060188 15.51282 6.885812 15.27981 5.861698 0.2330074      9.042892 
1 1 1 4   28 38 o 14.85637 6.305981 3.094487       3.971301 11.39222       7.368652 -0.3023404     4.714602 20.76696 8.689137 12.95258 6.048744 7.814376       10.58718 
1 1 1 4   28 39 o 16.17883 6.902780 4.810413       4.801367 7.599064       5.979392 -0.2515628     8.056011 18.11961 7.716117 14.64318 7.118633 3.476427       10.49826 
1 1 1 4   29 0  f 211.2787 3.916317 545.4140       20.16368 549.2207       27.81285 541.1966       29.27478 211.6831 5.396068 210.0523 5.724469 1.630737       7.866835 
1 1 1 4   29 1  o 142.3505 2.985457 247.3045       10.35633 260.9783       15.95724 237.3536       13.61270 146.0147 4.489951 139.3083 4.014065 6.706406       6.022655 
1 1 1 4   29 2  o 232.4091 4.079148 660.1581       23.10248 646.6074       31.86367 675.1765       33.54480 229.6774 5.693003 234.6532 5.866277 -4.975815      8.174563 
1 1 1 4   29 3  o 150.9834 3.858520 278.7132       14.18502 288.3672       17.17021 257.9598       25.17473 153.4682 4.596326 144.6358 7.164846 8.832367       8.512417 
1 1 1 4   29 4  o 128.3205 4.448701 201.6311       13.89019 201.0385       18.51171 202.3947       21.01245 127.8807 5.956624 128.1514 6.752311 -0.2706528     9.004169 
1 1 1 4   29 5  o 92.13921 3.585728 103.8591       8.035780 98.13705       9.339681 120.1679       15.76775 89.48135 4.295698 98.67357 6.595282 -9.192215      7.870881 
1 1 1 4   29 6  o 72.95846 3.239087 65.12190       5.744476 70.71272       7.880566 58.78293       8.391297 75.92149 4.276772 69.10326 5.017215 6.818230       6.592665 
1 1 1 4   29 7  o 46.58915 3.499865 26.66270       3.944443 28.50299       5.481709 24.68676       5.680152 48.02317 4.746125 44.56807 5.335909 3.455097       7.141262 
1 1 1 4   29 8  o 59.14599 3.116826 42.83114       4.476497 49.44462       6.780753 37.72205       5.959842 63.41801 4.415195 55.34598 4.456531 8.072037       6.273325 
1 1 1 4   29 9  o 255.6063 3.871359 798.7276       24.11411 788.8862       37.43945 805.7046       31.52353 253.4142 6.062648 256.4222 5.044790 -3.007950      7.887053 
1 1 1 4   29 10 o 196.3378 3.296533 470.8768       15.77239 465.4078       24.32863 474.8419       20.71553 194.7804 5.129967 196.9861 4.315432 -2.205765      6.703694 
1 1 1 4   29 11 f 82.32967 3.296988 82.93983       6.601318 65.53918       12.95194 89.04632       7.672692 72.48727 7.437623 85.26551 3.701469 -12.77824      8.307774 
1 1 1 4   29 12 o 129.2529 3.251190 204.2390       10.23231 208.1679       21.26914 203.0559       11.67176 129.7808 6.748356 128.8109 3.722231 0.9698792      7.706835 
1 1 1 4   29 13 o 199.9872 3.765937 489.2120       18.35318 514.2441       38.54030 481.8705       20.87170 203.6125 7.781702 198.3600 4.317852 5.252518       8.899367 
1 1 1 4   29 14 o 203.3578 3.809327 506.0298       18.87754 491.1392       38.11832 510.8685       21.72932 198.8152 7.883334 204.1917 4.366888 -5.376465      9.012029 
1 1 1 4   29 15 o 96.13004 3.143414 113.0674       7.353810 114.8368       15.61897 112.5635       8.335514 96.17725 6.706150 95.85683 3.574660 0.3204193      7.599384 
1 1 1 4   29 16 o 94.79951 3.131517 109.9815       7.224380 118.0325       16.17845 107.9763       8.074081 97.42447 6.858300 93.87385 3.535813 3.550621       7.716104 
1 1 1 4   29 17 o 100.5136 3.518545 123.8099       8.605060 0.000000       0.000000 123.8099       8.605060 ?        ?        100.5136 3.518545 0.000000       3.518545 
1 1 1 4   29 18 o 62.53200 3.357541 48.00243       5.097584 43.34502       11.47466 49.14760       5.689876 58.28278 8.314549 63.22416 3.709332 -4.941387      9.104443 
1 1 1 4   29 19 o 16.75172 6.154360 2.796309       3.296056 7.413667       8.497240 1.978512       3.576051 26.71337 9.869823 16.10454 6.292986 10.60884       11.70534 
1 1 1 4   29 20 o 60.15062 3.336809 44.47585       4.871944 47.08857       11.97458 43.95757       5.333320 60.57009 8.333351 59.74095 3.681323 0.8291397      9.110262 
1 1 1 4   29 21 o 74.27903 3.128420 67.74252       5.650073 86.85033       13.77029 63.87446       6.195618 82.98911 6.870553 72.04565 3.539748 10.94346       7.728798 
1 1 1 4   29 22 o 50.22362 3.481452 31.14256       4.234558 23.44711       10.66080 32.58415       4.614173 41.49709 10.52751 51.33271 3.713727 -9.835617      11.16334 
1 1 1 4   29 23 o 12.46247 5.342267 -0.6229964E-01 2.900508 -1.192713      7.049469 0.1680693      3.182364 18.43003 8.107969 13.27924 5.641088 5.150784       9.877299 
1 1 1 4   29 24 o 111.2148 3.172947 152.3432       8.590482 152.5677       13.35411 152.1848       11.22018 110.4375 4.974835 110.7281 4.165631 -0.2906265     6.488564 
1 1 1 4   29 25 o 49.66900 3.628826 30.68506       4.361949 26.57552       7.239989 33.02674       5.465185 45.05632 6.805928 51.29428 4.415118 -6.237965      8.112577 
1 1 1 4   29 26 o 39.61774 3.564635 19.62194       3.404685 23.18938       6.720359 18.39014       3.948982 41.80924 6.831772 38.11471 4.328192 3.694527       8.087420 
1 1 1 4   29 27 o 17.77140 5.744860 4.008282       2.835874 -4.018264      5.457294 6.977523       3.319218 14.09082 6.556008 22.82568 5.918408 -8.734856      8.832259 
1 1 1 4   29 28 o 64.08612 3.133152 51.18130       4.878242 62.62381       11.50639 48.67392       5.386268 68.00279 7.045414 62.28985 3.563282 5.712940       7.895242 
1 1 1 4   29 29 o 52.26366 3.280623 34.31952       4.157152 37.05345       9.672555 33.70009       4.604071 50.73394 8.095506 51.58452 3.686884 -0.8505745     8.895523 
1 1 1 4   29 30 o 36.42226 4.062955 17.16126       3.544822 15.50528       8.831740 17.47927       3.870253 30.39183 10.15452 36.56482 4.433993 -6.172987      11.08037 
1 1 1 4   29 31 o 33.48552 4.081659 14.68711       3.261919 12.67865       6.045313 15.51203       3.874309 28.20960 8.264357 33.98365 4.812800 -5.774057      9.563610 
1 1 1 4   29 32 o 23.66989 5.395896 7.957734       3.043003 15.34653       5.844402 5.209661       3.564245 31.01814 7.753654 18.97518 6.451135 12.04296       10.08644 
1 1 1 4   29 33 o 18.99484 5.830790 5.315164       2.957221 8.635026       5.491889 3.959489       3.509454 22.66963 7.992187 17.00468 6.331654 5.664946       10.19632 
1 1 1 4   29 34 o 20.54558 5.768830 6.391572       3.006210 5.764314       5.651138 6.639136       3.550225 19.24035 7.780787 20.53927 6.403059 -1.298922      10.07670 
1 1 1 4   29 35 o 12.92689 5.420582 1.460517       2.877192 5.967821       5.306571 -0.4162316     3.424196 18.79621 7.561537 11.92964 5.417097 6.866569       9.301708 
1 1 1 4   29 36 o 15.70238 5.795293 3.780471       2.928239 -1.223087      5.608828 5.655262       3.433280 13.63360 6.438682 18.30203 6.328035 -4.668437      9.027771 
1 1 1 4   29 37 o 17.29396 5.844259 4.998013       2.924873 9.033906       5.559000 3.453033       3.439445 20.35782 7.876507 15.11055 6.084538 5.247268       9.952937 
1 1 1 4   29 38 o 15.66186 6.239692 4.164446       3.577527 2.493691       5.362160 5.504763       4.802717 14.78737 6.739680 16.90011 7.038817 -2.112744      9.745165 
1 1 1 4   30 0  o 201.6078 3.434133 496.4429       16.87177 510.6570       26.17974 486.3459       22.06500 204.0740 5.268717 199.3671 4.541659 4.706970       6.956008 
1 1 1 4   30 1  o 130.9252 3.305581 209.4629       10.53804 235.9750       14.76240 181.9158       15.04778 138.8234 4.369172 121.7600 5.082619 17.06342       6.702438 
1 1 1 4   30 2  o 159.5954 3.440103 311.1136       13.37913 289.1714       17.63819 340.8454       20.53160 153.6266 4.717005 166.7330 5.059036 -13.10648      6.916934 
1 1 1 4   30 3  o 181.4715 4.970749 403.6519       21.96125 403.6519       21.96125 0.000000       0.000000 181.4715 4.970749 ?        ?        0.000000       4.970749 
1 1 1 4   30 4  o 90.98097 2.855485 101.1335       6.323077 110.1653       9.554972 94.09669       8.433945 94.82156 4.145117 87.64233 3.959165 7.179237       5.732101 
1 1 1 4   30 5  o 36.09449 4.285081 16.15936       3.695621 24.13198       5.312348 8.682628       5.144489 44.09948 5.033321 26.25327 7.604609 17.84621       9.119452 
1 1 1 4   30 6  o 34.36022 5.117851 14.78133       4.154722 11.12682       5.149030 21.60054       7.033603 29.46775 7.226496 41.27423 7.257815 -11.80648      10.24198 
1 1 1 4   30 7  o 228.5830 4.639698 639.8569       25.84459 633.1294       31.28469 654.3157       45.86369 227.1018 5.652950 229.7872 8.203600 -2.685425      9.962675 
1 1 1 4   30 8  o 169.5436 3.483602 351.2775       14.39283 346.8622       19.65348 356.3842       21.13638 168.1851 4.800213 170.4112 5.095473 -2.226151      7.000421 
1 1 1 4   30 9  o 93.17358 3.130667 106.1584       7.098205 97.97924       9.228032 118.0099       11.10817 89.36977 4.249406 98.03526 4.663058 -8.665489      6.308848 
1 1 1 4   30 10 o 95.83377 2.797068 112.2313       6.525184 117.6169       9.774594 107.9018       8.763920 97.94569 4.104317 93.84303 3.840421 4.102669       5.620876 
1 1 1 4   30 11 o 147.0970 3.851996 264.9190       13.79596 0.000000       0.000000 264.9190       13.79596 ?        ?        147.0970 3.851996 0.000000       3.851996 
1 1 1 4   30 12 o 132.5811 3.271801 214.8633       10.57072 227.4807       22.37294 211.2372       11.99389 135.5384 6.795356 131.3387 3.751252 4.199661       7.762007 
1 1 1 4   30 13 o 48.92977 4.079343 29.52451       4.819853 20.11321       9.225891 33.05735       5.652565 39.29221 9.695594 51.72569 4.530068 -12.43347      10.70168 
1 1 1 4   30 14 f 74.31439 3.365751 67.68310       6.079422 68.08043       12.63180 67.56332       6.935489 73.80117 7.111659 74.18223 3.849724 -0.3810577     8.086783 
1 1 1 4   30 15 o 59.77263 5.308653 44.31551       7.652205 0.000000       0.000000 44.31551       7.652205 ?        ?        59.77263 5.308653 0.000000       5.308653 
1 1 1 4   30 16 o 53.96392 4.302605 35.97016       5.611283 38.56908       10.67602 34.97816       6.595814 54.96014 8.223615 53.04985 5.167510 1.910294       9.712415 
1 1 1 4   30 17 o 89.73522 3.172896 98.67787       6.927411 90.11165       14.48243 101.2193       7.888381 84.77852 7.074450 90.81612 3.571383 -6.037598      7.924810 
1 1 1 4   30 18 o 102.1738 3.127423 127.9413       7.777690 143.7002       17.65804 124.1481       8.663330 107.1639 6.796749 100.5640 3.540663 6.599976       7.663686 
1 1 1 4   30 19 o 65.07447 3.327375 52.05646       5.259014 49.35685       12.08929 52.68657       5.840600 61.99244 8.203675 65.40431 3.679338 -3.411873      8.990985 
1 1 1 4   30 20 o 26.44882 5.674107 9.022413       3.547529 -3.583274      8.334749 11.81133       3.920369 18.92047 8.535031 30.39337 5.495346 -11.47290      10.15114 
1 1 1 4   30 21 o 51.34231 4.397514 32.82438       5.449044 24.66939       9.245320 37.16504       6.745092 42.93124 9.118976 54.44826 5.144558 -11.51701      10.47006 
1 1 1 4   30 22 o 51.66839 4.313500 33.29214       5.381629 34.99134       10.25730 32.64673       6.321588 51.39460 8.485808 50.90977 5.167018 0.4848289      9.935141 
1 1 1 4   30 23 o 37.67171 4.526529 17.90079       4.072296 11.65358       8.235188 19.92288       4.685226 29.67150 9.802309 39.64192 4.958104 -9.970417      10.98490 
1 1 1 4   30 24 o 43.84360 3.640445 23.96877       3.854472 14.96078       8.607038 26.22852       4.310913 32.66642 9.931996 45.80208 3.899357 -13.13567      10.67003 
1 1 1 4   30 25 o 48.24548 3.382407 28.98114       3.951466 35.58111       9.936580 27.74136       4.306638 51.02649 8.274214 47.06979 3.786492 3.956699       9.099458 
1 1 1 4   30 26 o 44.56084 3.532170 24.88244       3.804224 17.84933       8.795359 26.50099       4.219315 34.67073 9.912776 45.89513 3.806805 -11.22440      10.61861 
1 1 1 4   30 27 o 32.59477 4.460554 13.71324       3.450167 21.74819       8.635111 12.18686       3.763636 38.15562 9.359119 30.36448 5.277812 7.791136       10.74469 
1 1 1 4   30 28 o 26.86796 5.134593 9.654943       3.239318 6.200322       8.013681 10.32966       3.541553 23.01603 9.280567 27.67122 5.446062 -4.655190      10.76051 
1 1 1 4   30 29 o 20.15563 5.807318 5.637599       3.007552 10.46817       7.715181 4.771999       3.265919 25.92452 9.432917 18.75634 6.171914 7.168180       11.27264 
1 1 1 4   30 30 o 16.33689 5.683061 3.491041       2.771008 4.802058       5.461221 3.036493       3.215699 19.55885 7.735957 16.00286 6.039483 3.555992       9.814295 
1 1 1 4   30 31 o 25.57931 5.548685 9.322574       3.359019 13.51175       5.789650 7.197001       4.124072 28.82274 7.973781 21.73433 6.918221 7.088408       10.55665 
1 1 1 4   30 32 f 17.19376 5.885257 4.207110       2.967260 2.027160       5.351485 5.174838       3.565558 16.47677 7.160089 18.69810 6.449525 -2.221338      9.636558 
1 1 1 4   30 33 o 18.63441 6.012166 5.267529       3.106871 3.092432       5.342941 6.378731       3.818892 16.92938 7.253754 20.04987 6.676876 -3.120495      9.858885 
1 1 1 4   30 34 o 23.24188 5.474906 8.170317       3.049475 11.58964       5.811804 6.871289       3.582203 24.46809 8.238165 20.49332 6.438204 3.974775       10.45552 
1 1 1 4   30 35 o 28.63067 4.935871 12.09447       3.319418 15.31598       6.138370 10.76308       3.946175 27.34101 8.402076 25.43097 6.379325 1.910040       10.54944 
1 1 1 4   30 36 o 10.15978 4.689911 -0.8654705     2.711143 -0.6436340     5.454137 -0.9382724     3.124500 13.54304 6.381661 10.77676 4.995739 2.766283       8.104506 
1 1 1 4   30 37 o 9.400112 4.466671 -1.960730      2.779776 2.233879       5.309752 -3.544425      3.262603 14.69984 6.702436 9.347256 4.540887 5.352589       8.095820 
1 1 1 4   31 0  o 140.4796 3.469320 241.1278       11.87664 235.1680       21.65080 243.6931       14.20456 138.1136 6.450640 141.0821 4.136079 -2.968491      7.662761 
1 1 1 4   31 1  o 62.90334 3.284632 48.46435       5.017522 50.24659       7.116333 46.70249       7.075538 63.89577 4.601146 61.56792 4.752712 2.327843       6.615045 
1 1 1 4   31 2  o 130.5763 2.988192 208.1873       9.508436 225.6342       14.59108 195.3096       12.53567 135.6968 4.418360 126.2932 4.078507 9.403549       6.012997 
1 1 1 4   31 3  o 147.1432 3.010255 264.3825       10.79393 237.8635       15.68014 288.2675       14.88103 139.2868 4.626013 153.4699 3.982363 -14.18306      6.104032 
1 1 1 4   31 4  o 117.9016 2.887386 169.7208       8.295847 176.1555       12.61112 164.8123       11.01450 119.8868 4.323723 116.0215 3.901293 3.865334       5.823630 
1 1 1 4   31 5  o 66.03556 3.180305 53.39095       5.102749 56.81462       7.481735 50.41331       6.977388 67.95888 4.543834 64.00408 4.502240 3.954796       6.396607 
1 1 1 4   31 6  o 254.7567 3.902429 793.9243       24.22683 778.0567       37.34192 805.4582       31.83666 251.4835 6.093279 256.2424 5.098477 -4.758850      7.944968 
1 1 1 4   31 7  o 70.92745 3.055827 61.56404       5.269376 65.86941       7.833569 58.00603       7.121295 73.20277 4.411807 68.69727 4.275048 4.505493       6.143295 
1 1 1 4   31 8  o 118.5896 3.120711 171.9448       9.010700 156.7449       11.93556 192.0888       13.74028 113.0388 4.340972 125.1198 4.513834 -12.08096      6.262486 
1 1 1 4   31 9  o 75.30520 2.945440 69.37910       5.394770 72.78426       7.879073 66.37385       7.401971 76.97264 4.216622 73.50424 4.149214 3.468399       5.915731 
1 1 1 4   31 10 f 144.8395 2.968003 256.3054       10.47581 265.4646       16.18902 249.7074       13.74037 147.0737 4.522365 142.7597 3.953441 4.314087       6.006786 
1 1 1 4   31 11 o 137.1670 3.864355 230.5336       12.90416 242.6923       23.10015 225.0184       15.55796 139.9348 6.794426 135.3280 4.724933 4.606812       8.275821 
1 1 1 4   31 12 o 89.92713 3.907012 99.23463       8.541498 104.6522       15.29159 96.77778       10.29774 91.68516 6.894627 88.64807 4.784635 3.037086       8.392176 
1 1 1 4   31 13 o 104.8278 4.589766 135.2054       11.69632 0.000000       0.000000 135.2054       11.69632 ?        ?        104.8278 4.589766 0.000000       4.589766 
1 1 1 4   31 14 o 122.3281 4.931021 184.4325       14.66926 179.7469       20.23064 189.6274       21.30170 120.0917 6.942500 123.2874 7.120510 -3.195717      9.944846 
1 1 1 4   31 15 o 183.3615 4.220771 412.9224       18.85975 405.1729       33.30239 416.5813       22.88286 179.8892 7.614082 183.7637 5.114900 -3.874496      9.172592 
1 1 1 4   31 16 o 68.48705 3.977549 57.78780       6.609785 46.12685       11.42071 63.66097       8.105174 60.10943 7.994824 71.75122 4.660724 -11.64179      9.254165 
1 1 1 4   31 17 o 137.3681 3.793641 231.9362       12.68710 278.2150       24.95199 215.7999       14.73385 149.0033 6.890501 132.2363 4.579154 16.76698       8.273310 
1 1 1 4   31 18 o 11.18418 5.224135 -3.318683      3.520115 3.522175       7.976182 -4.973365      3.922808 22.92846 9.254008 11.07261 5.274063 11.85584       10.65140 
1 1 1 4   31 19 o 76.61714 3.691563 72.39869       6.872148 90.13470       13.70206 66.43790       7.943452 84.38901 6.718330 73.17821 4.475832 11.21080       8.072734 
1 1 1 4   31 20 o 22.38310 6.881625 6.385152       4.117188 9.678638       7.888201 5.151983       4.826824 27.90917 9.594313 21.20945 7.491304 6.699720       12.17253 
1 1 1 4   31 21 o 14.72568 5.745270 1.748478       2.976894 1.348814       7.533941 1.822422       3.240599 20.58561 8.709366 15.24080 5.980199 5.344809       10.56484 
1 1 1 4   31 22 o 20.53836 5.801528 5.488317       3.030926 15.02669       8.243538 3.997331       3.259217 32.92954 9.651616 18.23369 6.169222 14.69585       11.45482 
1 1 1 4   31 23 o 30.71118 4.385269 12.00866       3.188841 -0.2183166     7.076327 15.12432       3.572097 18.74381 8.187940 34.54354 4.338947 -15.79973      9.266543 
1 1 1 4   31 24 o 12.73373 5.275011 0.7031245      2.676796 5.454169       7.412293 -0.9403952E-02 2.870511 23.01670 9.040465 12.31954 5.298300 10.69715       10.47864 
1 1 1 4   31 25 o 27.06264 4.929701 9.585435       3.131333 11.26382       7.357260 9.214148       3.460395 28.10322 9.264258 26.29668 5.573281 1.806536       10.81147 
1 1 1 4   31 26 o 18.72351 5.803936 4.641478       2.921514 8.226829       6.993171 3.883429       3.215563 24.62535 8.977607 17.66594 6.123300 6.959414       10.86702 
1 1 1 4   31 27 o 60.54253 3.784940 46.55132       5.556196 35.33651       10.45963 50.95988       6.557964 48.19239 9.242554 62.98977 4.298062 -14.79737      10.19304 
1 1 1 4   31 28 o 17.72322 5.742520 4.229531       2.832577 2.324438       5.510653 4.913636       3.302222 17.72592 7.471423 18.94967 6.204534 -1.223747      9.711766 
1 1 1 4   31 29 f 12.85732 5.291525 1.148129       2.669985 3.402030       5.149195 0.3192755      3.122560 18.00815 7.372959 12.69768 5.493787 5.310472       9.194684 
1 1 1 4   31 30 o 30.06362 4.487726 12.19501       3.187264 14.38552       5.929207 11.30479       3.779828 29.73260 8.006230 28.11637 5.711758 1.616224       9.834831 
1 1 1 4   31 31 o 25.80715 4.939215 9.331698       2.993122 12.84302       5.850519 8.086846       3.483517 27.38899 8.157858 23.21989 6.084245 4.169096       10.17687 
1 1 1 4   31 32 o 18.85983 6.017189 5.409914       3.118329 11.31250       5.524841 2.650449       3.777558 25.24659 8.003997 15.39977 6.311187 9.846824       10.19289 
1 1 1 4   31 33 o 10.81450 4.895045 -0.5252414     2.769058 0.7791741      5.358407 -1.000505      3.234409 14.94428 6.782250 11.22755 5.160954 3.716730       8.522579 
1 1 1 4   31 34 f 14.48734 5.684155 2.853747       2.927522 3.468828       5.366737 2.593189       3.492984 16.32306 7.130530 14.54060 6.024859 1.782454       9.335063 
1 1 1 4   31 35 o 10.05813 4.693223 -1.299177      2.828902 -4.051219      5.496500 -0.3075106     3.299448 12.17074 5.908211 11.51955 5.264224 0.6511889      7.913218 
1 1 1 4   31 36 o 13.57937 5.658033 2.348724       3.105087 -3.804577      5.660155 4.997768       3.713804 12.20794 5.942052 16.78372 6.452607 -4.575783      8.771780 
1 1 1 4   32 0  o 141.0750 3.446409 243.2750       11.84821 201.4564       20.72890 263.5666       14.43942 127.6466 6.687258 146.6975 4.043012 -19.05090      7.814434 
1 1 1 4   32 1  o 38.42831 4.518714 18.33838       4.150799 18.09399       5.752034 18.60392       5.995785 37.80661 6.476185 38.31048 6.664195 -0.5038757     9.292603 
1 1 1 4   32 2  o 66.86992 3.286477 54.77761       5.339062 60.54926       7.676570 49.36993       7.430585 70.15334 4.514338 63.26538 4.856852 6.887959       6.630857 
1 1 1 4   32 3  o 69.94193 3.166532 59.89521       5.383065 48.19175       7.459699 72.61135       7.775741 62.48418 4.939232 76.89725 4.165037 -14.41306      6.460925 
1 1 1 4   32 4  o 44.16301 4.094341 24.08085       4.356180 22.73552       6.195767 25.39605       6.125963 42.54026 6.155365 45.09536 5.701741 -2.555103      8.390373 
1 1 1 4   32 5  o 134.4267 2.953516 220.7461       9.675224 238.7759       15.08783 208.1539       12.60906 139.5134 4.443537 130.3412 3.974408 9.172211       5.961623 
1 1 1 4   32 6  o 82.44067 3.065408 83.16071       6.147645 95.32126       9.283875 73.66442       8.204079 88.09300 4.337999 77.41027 4.366764 10.68273       6.155230 
1 1 1 4   32 7  o 286.8659 4.251667 1008.349       29.72174 991.1292       45.92939 1020.754       38.98498 283.2553 6.653904 288.0543 5.553756 -4.799042      8.667101 
1 1 1 4   32 8  o 94.36147 2.889488 108.8878       6.636508 102.5348       9.673887 114.5359       9.121345 91.35007 4.358233 96.64066 3.881031 -5.290588      5.835803 
1 1 1 4   32 9  o 78.89608 3.203184 76.23520       6.145674 73.44672       8.074223 80.07562       9.475599 77.27587 4.304676 80.60014 4.846697 -3.324265      6.482338 
1 1 1 4   32 10 f 43.39910 4.152575 23.30192       4.338216 21.05463       6.409647 25.20164       5.893171 40.72837 6.690128 44.90567 5.500011 -4.177303      8.660712 
1 1 1 4   32 11 o 170.8517 5.025148 359.5167       20.89932 0.000000       0.000000 359.5167       20.89932 ?        ?        170.8517 5.025148 0.000000       5.025148 
1 1 1 4   32 12 o 99.30666 3.821780 121.0800       9.231424 124.3340       16.22670 119.5229       11.22492 99.85664 6.707233 98.47591 4.691024 1.380722       8.184906 
1 1 1 4   32 13 o 79.58835 3.385777 77.72517       6.551648 67.72317       12.68688 81.36253       7.650751 73.36009 7.188934 81.34624 3.870598 -7.986145      8.164699 
1 1 1 4   32 14 o 25.83620 6.474867 8.625100       4.068031 7.593888       7.782950 9.012726       4.771739 26.29066 9.487109 26.42038 7.211291 -0.1297264     11.91671 
1 1 1 4   32 15 o 107.1995 3.212087 140.9565       8.381582 186.6228       19.15873 130.1478       9.320868 122.1772 6.457815 102.8851 3.723786 19.29208       7.454526 
1 1 1 4   32 16 o 114.3028 3.209543 160.3495       8.931120 147.7251       18.23061 164.3362       10.24469 108.2714 6.946218 115.5967 3.641325 -7.325287      7.842780 
1 1 1 4   32 17 o 44.54710 3.957303 24.63669       4.251247 37.51842       9.791888 21.64454       4.719226 53.89492 7.672004 41.55650 4.745047 12.33842       9.020816 
1 1 1 4   32 18 o 52.64753 3.923477 34.38110       4.997483 45.27076       10.39239 31.10544       5.699770 59.26182 7.353926 49.85346 4.748955 9.408360       8.754017 
1 1 1 4   32 19 o 27.87078 5.332629 10.01807       3.489910 15.53354       8.074272 8.750952       3.870086 33.76786 9.444573 25.83831 6.221305 7.929550       11.30949 
1 1 1 4   32 20 o 86.94053 3.077812 93.15442       6.510507 111.2579       14.69921 88.73627       7.261625 93.24762 6.509626 84.70092 3.525821 8.546700       7.403151 
1 1 1 4   32 21 o 29.08059 4.859484 10.86946       3.322307 14.71383       8.022799 10.07375       3.649973 32.46432 9.523228 27.76066 5.588998 4.703661       11.04214 
1 1 1 4   32 22 o 24.93815 5.364755 8.172117       3.163435 14.93053       7.656549 6.780921       3.473801 32.47958 9.236564 22.58859 6.147690 9.890989       11.09541 
1 1 1 4   32 23 f 85.73229 3.010822 91.06575       6.280453 97.82835       14.11432 89.39619       7.012992 86.04012 6.786583 84.74751 3.402704 1.292610       7.591845 
1 1 1 4   32 24 o 38.27638 3.810902 18.53917       3.507455 12.06541       7.789660 20.18545       3.928196 28.77098 9.534569 39.83973 4.104825 -11.06875      10.38064 
1 1 1 4   32 25 o 46.60574 3.518493 27.39546       3.966547 27.59334       9.506995 27.35376       4.364581 42.72719 9.387624 46.39393 3.896486 -3.666740      10.16416 
1 1 1 4   32 26 o 38.95724 4.228878 19.62005       3.950341 0.000000       0.000000 19.62005       3.950341 ?        ?        38.95724 4.228878 0.000000       4.228878 
1 1 1 4   32 27 o 34.65117 4.313604 15.74071       3.563811 33.19457       9.671246 12.99828       3.833582 46.00919 8.948107 30.91788 5.277407 15.09131       10.38844 
1 1 1 4   32 28 o 36.32455 4.220767 17.39875       3.666689 31.67119       9.966518 15.16456       3.943249 43.07267 9.726104 33.39149 4.999580 9.681183       10.93585 
1 1 1 4   32 29 o 32.18123 4.263214 13.83259       3.261141 13.49032       6.006896 13.97563       3.883246 28.51653 8.204375 31.70172 5.207258 -3.185183      9.717371 
1 1 1 4   32 30 o 11.78809 5.107877 0.3486068      2.707418 3.334883       5.342155 -0.6835141     3.140630 17.45973 7.357608 11.59109 5.233021 5.868639       9.028782 
1 1 1 4   32 31 o 20.30951 6.000635 6.330799       3.175719 7.533146       5.567115 5.750822       3.866521 20.92558 7.935381 19.13801 6.709332 1.787565       10.39160 
1 1 1 4   32 32 o 24.91779 5.390055 9.281628       3.177624 13.86923       6.006238 7.498461       3.744601 26.91998 8.317996 21.32251 6.564187 5.597471       10.59611 
1 1 1 4   32 33 o 12.16495 5.287394 0.8402998      2.919423 3.873478       5.662626 -0.2578034     3.407144 16.74923 7.320415 11.87214 5.395937 4.877089       9.094208 
1 1 1 4   32 34 o 10.21503 4.733324 -1.040251      2.800382 3.247879       5.395152 -2.621596      3.276295 15.85559 7.028799 9.992996 4.776371 5.862596       8.498102 
1 1 1 4   32 35 o 13.56158 5.578205 2.379504       2.964931 -2.998839      5.314630 4.809793       3.572545 12.23410 5.907765 16.64940 6.346659 -4.415304      8.670742 
1 1 1 4   33 0  o 43.61753 4.779497 23.61996       4.997090 11.73257       8.013867 31.18250       6.391945 30.68093 9.628373 50.09322 5.317347 -19.41229      10.99908 
1 1 1 4   33 1  o 67.53922 3.241678 55.89205       5.319762 70.96465       8.084667 44.38288       7.064640 75.96098 4.386178 59.93444 4.879189 16.02654       6.560873 
1 1 1 4   33 2  o 42.16911 4.329507 22.02202       4.385946 24.24686       6.069965 19.59141       6.344467 44.00532 5.801560 39.25235 6.883609 4.752968       9.002343 
1 1 1 4   33 3  o 166.6174 3.534367 339.6461       14.35054 376.4482       20.62900 305.1365       19.97619 175.0336 4.841031 157.4644 5.213068 17.56926       7.114187 
1 1 1 4   33 4  o 101.9453 2.972605 127.1178       7.376943 141.2005       11.58161 117.5039       9.569226 107.2015 4.442981 97.85315 4.021540 9.348366       5.992733 
1 1 1 4   33 5  o 38.34392 5.618473 18.48352       5.094180 26.50319       9.269372 15.01323       6.097550 45.32613 8.708389 34.11907 7.535176 11.20706       11.51585 
1 1 1 4   33 6  o 139.2034 3.428513 237.1248       11.63032 227.1482       22.09192 240.9499       13.67942 135.2602 6.723428 140.1547 4.009317 -4.894501      7.828097 
1 1 1 4   33 7  o 67.77272 3.176724 56.30355       5.231911 65.97679       7.722245 48.09576       7.113290 73.19399 4.349050 62.38886 4.713592 10.80513       6.413437 
1 1 1 4   33 8  o 68.53650 3.518918 57.66799       5.857479 64.67120       10.16577 54.18733       7.166764 72.13554 5.832729 66.27576 4.463468 5.859787       7.344609 
1 1 1 4   33 9  o 112.4253 3.236027 154.8194       8.856462 173.8859       16.33728 146.8844       10.53948 118.5204 5.673009 109.3596 3.961358 9.160759       6.919204 
1 1 1 4   33 10 o 151.1105 3.045582 279.4002       11.21505 288.1587       17.20436 272.9282       14.78916 152.9748 4.620412 149.0480 4.075576 3.926788       6.161050 
1 1 1 4   33 11 o 130.3264 4.731097 209.4971       15.00061 210.4768       21.38996 208.5489       21.04245 129.8039 6.785735 129.2445 6.704014 0.5593719      9.538868 
1 1 1 4   33 12 o 93.43506 4.543160 107.7918       10.31336 99.84222       14.53942 115.8426       14.63161 89.20874 6.737926 96.30711 6.268506 -7.098366      9.202924 
1 1 1 4   33 13 o 69.53894 3.537340 59.50337       5.974643 52.38449       11.62193 62.06059       6.965563 64.09289 7.588033 70.91519 4.047512 -6.822304      8.600035 
1 1 1 4   33 14 o 45.03664 4.312984 25.23277       4.675702 15.42403       9.408180 28.45010       5.388240 34.14197 10.38462 47.76071 4.689980 -13.61874      11.39457 
1 1 1 4   33 15 o 84.10896 3.272502 87.00230       6.694664 90.21069       13.72456 86.00056       7.668902 84.41341 6.727544 83.49390 3.778936 0.9195023      7.716230 
1 1 1 4   33 16 o 44.29033 4.574452 24.55747       4.866278 38.86758       9.614656 19.62919       5.642345 54.83710 7.382217 39.11392 6.120085 15.72318       9.589190 
1 1 1 4   33 17 o 14.48037 5.972834 0.9134957      3.411858 6.260476       6.726028 -0.9390474     3.959028 23.83676 8.785680 13.74388 6.060105 10.09287       10.67301 
1 1 1 4   33 18 o 26.46025 5.751365 9.145385       3.602439 14.08713       7.600047 7.713332       4.091246 32.10673 9.225697 24.20647 6.705345 7.900257       11.40505 
1 1 1 4   33 19 o 45.26854 3.898066 25.60659       4.258293 32.46605       9.071850 23.66812       4.822596 49.35777 7.801251 43.28130 4.644994 6.076466       9.079399 
1 1 1 4   33 20 o 44.46829 3.848247 24.76238       4.129127 18.89826       8.449331 26.60225       4.732763 36.51143 9.430477 45.96085 4.274621 -9.449421      10.35405 
1 1 1 4   33 21 o 37.59979 4.177076 17.90957       3.762798 35.20750       9.508364 14.69759       4.097281 50.79860 7.940804 33.67718 5.156449 17.12142       9.468122 
1 1 1 4   33 22 o 64.08723 3.191031 51.11935       4.967872 58.90069       10.98618 49.11926       5.569862 66.36730 6.893210 62.60739 3.666807 3.759914       7.807805 
1 1 1 4   33 23 o 38.22365 3.960509 18.59147       3.635697 26.67934       9.084754 17.04911       3.967244 42.58810 9.033925 36.32915 4.583019 6.258953       10.12995 
1 1 1 4   33 24 o 11.06760 5.010015 -1.240416      2.901368 0.000000       0.000000 -1.240416      2.901368 ?        ?        11.06760 5.010015 0.000000       5.010015 
1 1 1 4   33 25 o 29.89670 5.159572 12.01985       3.623204 0.000000       0.000000 12.01985       3.623204 ?        ?        29.89670 5.159572 0.000000       5.159572 
1 1 1 4   33 26 o 13.84500 5.551266 1.667682       2.850062 7.931244       7.447195 0.5928971      3.084912 23.24572 9.081978 12.97440 5.534234 10.27132       10.63532 
1 1 1 4   33 27 o 44.69846 3.727915 25.88648       4.023703 27.44495       9.894878 25.57771       4.404294 38.94242 10.27835 44.12487 4.144492 -5.182442      11.08248 
1 1 1 4   33 28 o 25.46745 5.639222 9.318399       3.407346 10.30528       9.340564 9.166915       3.659525 24.03926 9.895757 24.95771 6.075104 -0.9184513     11.61176 
1 1 1 4   33 29 o 16.41027 6.223819 3.563182       3.424831 2.657507       7.746553 3.783215       3.818262 18.43847 8.280542 16.90385 6.531140 1.534628       10.54624 
1 1 1 4   33 30 o 26.74447 5.164945 10.32049       3.244289 6.765976       6.013254 11.77999       3.853208 20.11795 8.064464 28.03542 5.830268 -7.917473      9.951262 
1 1 1 4   33 31 o 26.37791 5.101113 10.18518       3.160393 10.48446       5.927114 10.06628       3.735764 23.15051 8.288389 25.25819 6.131770 -2.107677      10.30999 
1 1 1 4   33 32 o 13.40703 5.492777 2.024690       2.860222 4.720450       5.739117 1.133870       3.299129 17.39390 7.486292 12.91965 5.618020 4.474243       9.359846 
1 1 1 4   33 33 o 12.88978 5.435092 1.665689       2.917954 5.073650       5.700953 0.4559649      3.396591 17.25331 7.443853 12.27799 5.500911 4.975320       9.255861 
1 1 1 4   33 34 o 11.98427 5.265991 0.8635215      2.965537 -6.099039      5.473383 3.756785       3.528299 11.32176 5.578442 15.43546 6.180801 -4.113693      8.325943 
1 1 1 4   34 0  o 36.34252 4.953578 16.53715       4.272948 15.55554       5.976494 17.56361       6.111491 34.74989 7.290584 37.02986 7.029694 -2.279972      10.12765 
1 1 1 4   34 1  o 49.06960 4.679004 29.85204       5.527368 26.64434       9.485889 31.50105       6.801308 45.33381 8.904413 50.22600 5.655003 -4.892185      10.54835 
1 1 1 4   34 2  o 114.3955 3.098288 160.1798       8.629129 182.0760       18.43385 154.0353       9.765121 121.1382 6.265809 112.0924 3.579500 9.045799       7.216175 
1 1 1 4   34 3  o 102.2750 3.641548 128.3051       9.061459 0.000000       0.000000 128.3051       9.061459 ?        ?        102.2750 3.641548 0.000000       3.641548 
1 1 1 4   34 4  o 152.5682 3.456655 285.0508       12.85157 278.4455       17.33480 293.1120       19.15024 150.3868 4.736033 154.1724 5.104235 -3.785568      6.962989 
1 1 1 4   34 5  o 31.85219 6.024760 12.95420       4.505183 20.35021       7.749261 9.178152       5.537074 39.58171 8.299567 26.84241 7.921577 12.73930       11.47319 
1 1 1 4   34 6  f 47.21766 4.357902 27.62745       4.957843 26.81319       8.263301 28.08544       6.197207 45.72398 7.688627 47.38734 5.466665 -1.663353      9.433950 
1 1 1 4   34 7  o 141.6840 3.046354 245.6896       10.51810 263.7130       16.25395 232.7048       13.79610 146.3149 4.564212 137.5754 4.119733 8.739502       6.148514 
1 1 1 4   34 8  o 135.9713 2.980468 226.2905       9.875696 227.7793       14.83284 225.1050       13.23588 135.9594 4.483047 135.3069 4.018631 0.6524506      6.020557 
1 1 1 4   34 9  o 78.72540 3.264962 76.08303       6.250079 86.60568       8.490880 63.63883       9.233655 83.81046 4.170469 71.52676 5.335923 12.28370       6.772362 
1 1 1 4   34 10 o 54.50192 3.355145 36.56765       4.434544 36.31407       6.269043 36.82160       6.273744 54.02147 4.812430 54.40793 4.780372 -0.3864555     6.783173 
1 1 1 4   34 11 o 12.84634 5.891701 -2.852005      4.182632 0.2017225      7.580590 -4.188557      5.015111 20.14304 8.635651 13.59011 6.309996 6.552932       10.69535 
1 1 1 4   34 12 o 47.89501 4.797577 28.67143       5.524188 31.58426       10.06595 27.41604       6.608242 48.98167 8.754394 46.50554 5.968452 2.476131       10.59537 
1 1 1 4   34 13 o 94.79400 3.289699 110.5365       7.587774 103.8200       14.85100 112.9091       8.826849 90.47977 6.784890 95.65823 3.794107 -5.178452      7.773672 
1 1 1 4   34 14 o 86.63257 3.716878 92.69302       7.828600 106.3853       14.38721 86.93371       9.330902 91.59892 6.487380 83.59417 4.598197 8.004745       7.951699 
1 1 1 4   34 15 o 55.57581 3.723425 38.29196       5.013622 37.50209       9.685322 38.58109       5.859831 53.57315 7.634521 55.61083 4.358847 -2.037682      8.791215 
1 1 1 4   34 16 o 48.32872 3.971545 29.12346       4.636127 30.51039       9.159398 28.64574       5.375600 47.83855 8.148739 47.71732 4.683160 0.1212273      9.398614 
1 1 1 4   34 17 o 30.01953 5.495679 11.70120       3.872219 27.26777       8.458459 7.573865       4.355413 45.05931 7.996018 23.94443 7.014774 21.11489       10.63689 
1 1 1 4   34 18 o 40.00827 4.363609 20.22943       4.185457 13.25807       8.307863 22.60067       4.845269 30.81789 9.820284 42.16000 4.801550 -11.34210      10.93128 
1 1 1 4   34 19 o 38.01062 4.429255 18.36736       4.025936 19.12366       8.410775 18.14258       4.585358 36.48780 9.401021 37.50648 5.152906 -1.018688      10.72062 
1 1 1 4   34 20 o 16.45153 6.021643 2.993807       3.150829 0.9473220      6.333868 3.666772       3.632128 18.35734 7.882282 17.86395 6.476243 0.4933929      10.20157 
1 1 1 4   34 21 o 67.28929 3.212107 56.47635       5.251897 73.28367       11.88358 52.39680       5.854685 73.98490 6.662548 64.54335 3.738336 9.441551       7.639679 
1 1 1 4   34 22 o 12.44520 5.305272 0.3167039      2.831882 -2.447897      5.775089 1.191913       3.249364 15.17929 6.947188 14.14085 5.830434 1.038446       9.069586 
1 1 1 4   34 23 o 11.37107 5.150534 -1.264421      3.072019 0.000000       0.000000 -1.264421      3.072019 ?        ?        11.37107 5.150534 0.000000       5.150534 
1 1 1 4   34 24 o 32.18415 4.639177 13.71983       3.533540 23.55780       9.154000 11.99727       3.830419 37.67661 9.858283 29.58652 5.515573 8.090088       11.29634 
1 1 1 4   34 25 o 13.41673 5.524321 1.284818       2.911855 -8.586679      7.693734 2.935218       3.145867 14.44586 7.007378 15.80279 5.971417 -1.356922      9.206583 
1 1 1 4   34 26 o 35.19018 4.410042 16.52415       3.698994 16.61606       8.955720 16.50524       4.061630 29.58357 10.22072 34.81186 4.925205 -5.228285      11.34551 
1 1 1 4   34 27 o 11.31279 5.101826 -0.7356766     2.975740 -5.671263      7.374809 0.2241765      3.252249 14.70412 7.064554 12.64025 5.535593 2.063873       8.975005 
1 1 1 4   34 28 o 28.49522 5.669559 11.84555       3.798379 13.17524       8.848049 11.54514       4.205624 25.25277 9.889632 27.49478 6.397577 -2.242008      11.77853 
1 1 1 4   34 29 o 20.61901 6.253888 6.683467       3.415389 0.8825378      7.998338 7.977083       3.777058 17.14143 7.962265 22.30607 6.531798 -5.164635      10.29864 
1 1 1 4   34 30 o 11.08693 5.053629 -0.6767736     3.015835 -0.2149986     7.465051 -0.7668403     3.296853 15.89643 7.482999 11.47000 5.249348 4.426434       9.140620 
1 1 1 4   34 31 o 12.43441 5.433914 0.8508440      3.119291 5.801645       8.702914 0.1210961      3.341284 18.51345 8.493698 12.08277 5.431277 6.430673       10.08175 
1 1 1 4   34 32 o 10.16636 4.736080 -1.259911      2.862245 4.533679       6.105279 -2.891975      3.240412 16.94843 7.496956 9.790679 4.698402 7.157746       8.847562 
1 1 1 4   35 0  o 62.73159 3.404265 48.36537       5.184601 41.86497       7.170837 55.48540       7.504828 58.02119 5.124239 66.97045 4.626998 -8.949261      6.904125 
1 1 1 4   35 1  o 83.94749 3.201794 86.43417       6.537931 92.98149       9.459288 80.44571       9.046577 86.80369 4.487048 80.69285 4.619894 6.110840       6.440265 
1 1 1 4   35 2  o 128.6411 3.488626 203.0445       10.92621 209.7288       20.37370 200.3460       12.94522 129.6575 6.468596 127.5934 4.168969 2.064087       7.695651 
1 1 1 4   35 3  o 117.1778 3.759831 168.7212       10.72228 171.0145       17.58370 167.3637       13.52855 117.1394 6.181750 116.4038 4.779392 0.7355652      7.813874 
1 1 1 4   35 4  o 24.65101 7.977073 7.491461       5.466963 0.000000       0.000000 7.491461       5.466963 ?        ?        24.65101 7.977073 0.000000       7.977073 
1 1 1 4   35 5  o 157.7530 3.586572 305.4415       13.78775 303.2762       26.74943 306.2249       16.08979 155.4180 7.081411 157.6922 4.190724 -2.274246      8.228520 
1 1 1 4   35 6  o 142.5973 3.493180 249.5609       12.13860 277.1619       24.63042 240.7066       13.95039 148.6327 6.818357 139.7965 4.099429 8.836243       7.955835 
1 1 1 4   35 7  o 44.86421 3.912229 24.94379       4.234470 27.49356       5.904429 22.24354       6.076154 46.81471 5.266857 41.81916 6.145518 4.995552       8.093650 
1 1 1 4   35 8  o 81.08772 3.262202 80.81908       6.433015 86.78560       8.688287 73.57870       9.570942 83.77643 4.269834 76.86383 5.139241 6.912598       6.681562 
1 1 1 4   35 9  o 51.39929 3.877856 32.71952       4.821362 39.03126       6.262345 23.53315       7.555005 55.98175 4.631859 42.50915 7.570759 13.47260       8.875276 
1 1 1 4   35 10 o 17.57430 6.076170 3.540634       3.165406 3.643186       4.159169 3.399465       4.879816 18.77768 6.910865 19.31766 7.404228 -0.5399857     10.12831 
1 1 1 4   35 11 o 54.75253 4.148706 37.26072       5.494254 33.33401       9.958531 38.97898       6.587567 50.25493 8.429913 55.79695 4.894347 -5.542023      9.747721 
1 1 1 4   35 12 o 106.6126 3.740880 140.4332       9.703869 137.7516       16.60541 141.8238       11.95823 104.0989 6.579527 106.7603 4.607279 -2.661392      8.032260 
1 1 1 4   35 13 o 34.60498 5.941656 15.49106       4.830089 15.31508       7.707985 15.60484       6.197877 33.47429 9.176908 34.18558 7.633101 -0.7112885     11.93649 
1 1 1 4   35 14 o 24.61177 6.374598 8.000329       3.853433 7.144491       6.559665 8.451293       4.761646 24.41841 8.722068 25.25944 7.316015 -0.8410339     11.38414 
1 1 1 4   35 15 o 43.11997 4.463710 23.44831       4.622660 36.25347       9.584831 19.56699       5.276936 52.16544 7.777210 38.91528 5.736337 13.25016       9.663878 
1 1 1 4   35 16 o 10.63614 5.006607 -3.386004      3.341142 -5.751725      6.566819 -2.559684      3.881034 15.04280 7.061429 12.28315 5.648804 2.759648       9.042830 
1 1 1 4   35 17 o 59.34295 3.605168 43.94299       5.188920 48.99734       10.40466 42.26976       5.986515 60.66916 7.176357 57.92420 4.271133 2.744957       8.351209 
1 1 1 4   35 18 o 25.31585 6.000743 8.611751       3.645166 8.365380       7.162639 8.697861       4.234540 25.29406 9.104601 25.25619 6.750688 0.3787231E-01  11.33426 
1 1 1 4   35 19 o 41.19064 4.142299 21.58718       4.101525 31.90586       8.984654 18.87072       4.609897 47.73539 8.006943 38.07560 5.096154 9.659786       9.491149 
1 1 1 4   35 20 o 42.02179 4.089722 22.54033       4.135059 27.83933       9.108342 21.16466       4.640873 43.45609 8.900739 40.36098 4.813217 3.095112       10.11880 
1 1 1 4   35 21 o 26.08110 6.411192 9.517453       4.045505 0.000000       0.000000 9.517453       4.045505 ?        ?        26.08110 6.411192 0.000000       6.411192 
1 1 1 4   35 22 o 21.06225 6.198395 6.217028       3.394087 9.996696       8.051167 5.400144       3.742934 25.57645 9.576781 19.83585 6.610254 5.740601       11.63659 
1 1 1 4   35 23 o 11.96412 5.283607 -0.3230483     3.020638 -0.4691980     6.804587 -0.2871802     3.370983 17.00989 7.688885 12.62775 5.578924 4.382136       9.499649 
1 1 1 4   35 24 o 28.16137 5.141181 10.91673       3.398232 21.86951       8.097838 8.575636       3.743834 36.08184 9.186830 24.23321 6.286695 11.84863       11.13195 
1 1 1 4   35 25 o 30.71499 4.944692 12.94962       3.575439 11.49242       8.246529 13.28696       3.967771 25.28136 9.641237 30.72749 5.500872 -5.446127      11.10014 
1 1 1 4   35 26 o 39.72934 5.062087 21.88924       4.789763 7.219307       8.927534 27.81878       5.675813 21.69319 9.336880 44.54678 5.334429 -22.85359      10.75330 
1 1 1 4   35 27 o 18.18814 6.487751 4.948860       3.628127 10.06681       7.674167 3.475650       4.117327 22.98918 9.145363 16.59700 6.666205 6.392181       11.31707 
1 1 1 4   35 28 o 10.19184 4.814456 -2.379143      3.139583 0.5945246      7.636377 -2.984035      3.444132 16.69539 7.763561 10.37729 4.942574 6.318104       9.203364 
1 1 1 4   35 29 o 10.03353 4.736912 -2.149301      3.031102 -1.281448      7.124279 -2.341119      3.349370 15.15181 7.185499 10.47172 4.954451 4.680096       8.728000 
1 1 1 4   35 30 o 13.04713 5.591992 1.417326       3.177072 2.910262       8.207580 1.154200       3.445691 17.10626 7.985969 13.08849 5.715623 4.017775       9.820593 
1 1 1 4   35 31 o 16.43174 6.098425 4.384527       3.250665 13.63140       9.476242 3.151317       3.460645 21.60844 9.456432 14.93877 6.071417 6.669676       11.23771 
1 1 1 4   36 0  o 34.19547 6.095973 15.00628       4.893499 20.72137       7.613738 10.98379       6.387535 39.71698 8.140297 29.01196 8.493855 10.70502       11.76478 
1 1 1 4   36 1  o 74.83918 3.374933 68.90565       6.139194 79.43662       8.571496 57.81287       8.797166 80.10252 4.408104 68.02987 5.349494 12.07265       6.931700 
1 1 1 4   36 2  o 58.68894 3.398782 42.44070       4.840093 39.51174       6.852095 45.35744       6.837777 56.23755 5.053735 60.38430 4.683397 -4.146751      6.890170 
1 1 1 4   36 3  o 91.52846 2.840993 102.7559       6.329017 110.0365       10.06350 97.99206       8.140425 94.29034 4.391781 89.15803 3.755122 5.132317       5.778294 
1 1 1 4   36 4  o 48.36158 4.050887 29.03366       4.730223 30.32145       6.348951 27.42699       7.091579 49.08880 5.396306 46.34112 6.454650 2.747681       8.413241 
1 1 1 4   36 5  o 23.83370 6.606428 7.371007       3.969987 10.45674       5.124727 2.740133       6.278026 28.20149 7.374762 20.34352 8.210264 7.857975       11.03610 
1 1 1 4   36 6  o 131.8456 3.872644 214.5174       12.42906 220.1285       20.20096 211.0993       15.76661 132.2062 6.288263 130.2556 4.976285 1.950623       8.019081 
1 1 1 4   36 7  o 53.72034 4.199208 35.89003       5.453558 36.33837       9.720479 35.68409       6.588093 52.80780 7.787009 53.30023 5.135690 -0.4924278     9.328066 
1 1 1 4   36 8  o 17.85031 6.807094 2.953362       4.110729 -2.796198      6.771359 6.309003       5.173046 17.07735 7.699263 22.82026 7.771647 -5.742918      10.93971 
1 1 1 4   36 9  o 70.91940 4.220902 62.53219       7.261684 67.06566       11.84493 59.80228       9.191606 72.33582 6.799324 68.86059 5.523823 3.475235       8.760333 
1 1 1 4   36 10 o 36.64804 6.020167 17.36500       5.189927 18.84546       7.574710 16.05502       7.125226 37.29816 8.520912 34.38932 8.541076 2.908836       12.06466 
1 1 1 4   36 11 o 117.7657 3.426458 171.3455       9.822867 166.3666       18.17898 173.3986       11.67380 113.9604 6.573954 118.1414 4.060879 -4.181068      7.727069 
1 1 1 4   36 12 o 43.73931 4.419123 24.08994       4.645717 15.08331       7.693279 29.25929       5.828382 32.95382 9.219840 48.01908 5.056601 -15.06526      10.51545 
1 1 1 4   36 13 o 29.62709 5.890537 11.53785       4.103054 17.94063       7.621570 8.924942       4.868806 35.91120 8.783131 25.76700 7.377932 10.14420       11.47071 
1 1 1 4   36 14 o 36.88972 5.053109 17.48680       4.423296 22.68056       8.564595 15.59751       5.165534 40.17426 8.974887 34.27908 6.419582 5.895180       11.03447 
1 1 1 4   36 15 f 31.62381 6.117542 13.29947       4.543919 11.86267       7.632795 14.08819       5.655212 29.03028 9.428144 32.03497 7.394072 -3.004688      11.98174 
1 1 1 4   36 16 o 19.96277 6.685283 5.095899       3.827662 7.284756       7.308952 4.268736       4.493057 24.31077 9.120153 19.36881 7.173207 4.941956       11.60311 
1 1 1 4   36 17 o 36.57982 5.017839 17.41556       4.355197 14.61366       8.196239 18.51792       5.141043 31.21120 9.728810 37.33670 5.841758 -6.125500      11.34795 
1 1 1 4   36 18 o 16.03429 6.178115 2.575870       3.409852 -1.856962      6.443439 4.300177       4.018688 16.43620 7.450582 18.80316 6.812803 -2.366957      10.09581 
1 1 1 4   36 19 o 33.83750 5.666640 15.42837       4.507545 0.000000       0.000000 15.42837       4.507545 ?        ?        33.83750 5.666640 0.000000       5.666640 
1 1 1 4   36 20 o 19.16080 6.841257 4.795551       4.035240 0.000000       0.000000 4.795551       4.035240 ?        ?        19.16080 6.841257 0.000000       6.841257 
1 1 1 4   36 21 o 19.86934 6.262733 5.539960       3.386923 1.531482       6.883392 6.820451       3.890461 18.34509 8.043080 21.76258 6.689211 -3.417492      10.46120 
1 1 1 4   36 22 o 13.60157 5.748266 0.9612011      3.275975 1.506535       7.202398 0.8189509      3.678512 18.34449 8.127209 14.05216 6.019821 4.292327       10.11384 
1 1 1 4   36 23 o 21.14072 6.126353 6.515595       3.338152 8.133777       7.223043 6.076107       3.764267 22.77953 8.931183 20.34402 6.622028 2.435505       11.11833 
1 1 1 4   36 24 o 24.01305 5.793282 8.389268       3.350738 12.96921       7.475182 7.237642       3.748411 26.62800 9.329356 21.87153 6.533540 4.756468       11.38965 
1 1 1 4   36 25 o 19.96086 6.696996 6.123457       3.840904 19.56249       7.970658 2.058990       4.383408 32.10840 9.511646 15.58583 6.620728 16.52257       11.58902 
1 1 1 4   36 26 o 21.50302 6.373910 7.259412       3.578375 14.78839       7.851870 5.285766       4.020125 26.66155 9.540370 18.54877 6.799752 8.112782       11.71560 
1 1 1 4   36 27 o 16.84005 6.154328 4.240324       3.289293 -4.555168      7.790316 6.148549       3.628606 14.70693 7.114220 19.49900 6.508755 -4.792072      9.642407 
1 1 1 4   36 28 o 10.37595 4.885673 -2.017557      3.186165 -2.858836      8.329512 -1.873365      3.448420 15.32716 7.400054 10.90218 5.117534 4.424977       8.997219 
1 1 1 4   36 29 o 12.61591 5.539781 0.8681388      3.276859 5.330927       7.974460 -0.3851678E-01 3.594341 18.09495 8.236268 12.26060 5.560520 5.834349       9.937580 
1 1 1 4   36 30 o 9.906539 4.714837 -2.342634      3.122167 13.09454       9.088401 -4.408224      3.324494 21.54392 9.346718 9.186270 4.489340 12.35765       10.36896 
1 1 1 4   37 0  o 76.93406 3.449486 73.01757       6.450646 67.25908       8.236075 82.15550       10.37504 73.46925 4.623668 80.95971 5.287714 -7.490456      7.024117 
1 1 1 4   37 1  o 88.92231 2.861314 97.14891       6.192223 107.3018       9.692767 90.14792       8.048837 92.98591 4.289097 85.35724 3.879659 7.628670       5.783434 
1 1 1 4   37 2  o 29.71229 5.072036 11.29470       3.540724 12.15821       5.213780 10.55559       4.823626 30.31171 7.171193 28.26369 7.032010 2.048016       10.04366 
1 1 1 4   37 3  o 110.4719 2.796108 149.8872       7.521300 168.3254       12.30994 138.9037       9.500967 116.4291 4.346315 106.0352 3.682487 10.39389       5.696592 
1 1 1 4   37 4  o 64.99035 3.165420 52.08506       4.998137 59.01344       7.603644 46.81368       6.632356 68.75858 4.563769 61.23684 4.475360 7.521744       6.391935 
1 1 1 4   37 5  f 62.36086 3.308420 48.04060       5.009704 50.04331       7.264974 46.22495       6.917383 63.19989 4.751974 60.74276 4.709941 2.457134       6.690650 
1 1 1 4   37 6  o 19.15712 6.772480 4.206344       3.945662 4.618866       4.784630 3.329520       6.975589 20.42359 7.428864 21.36831 8.643438 -0.9447193     11.39724 
1 1 1 4   37 7  o 17.50151 6.908324 2.458446       4.347216 6.815211       5.411313 -5.470601      7.300137 23.39606 7.948914 16.33784 7.595060 7.058220       10.99410 
1 1 1 4   37 8  o 23.76561 6.701772 7.462865       4.048075 8.864703       4.562102 2.272513       8.778382 25.78370 7.056643 22.31082 9.418324 3.472883       11.76865 
1 1 1 4   37 9  o 38.62040 4.510295 18.87380       4.164979 24.09057       5.348007 10.83271       6.639705 43.46759 5.148685 28.26813 8.747539 15.19946       10.15029 
1 1 1 4   37 10 o 95.88834 2.965542 113.4870       6.921235 115.7921       9.992783 111.3615       9.595510 96.19888 4.273322 94.38936 4.182043 1.809525       5.979194 
1 1 1 4   37 11 o 44.18116 4.974689 24.93017       5.262997 29.41951       8.374294 21.99942       6.766225 46.71466 7.618625 40.52790 7.110207 6.186756       10.42106 
1 1 1 4   37 12 o 24.44667 6.543475 8.055587       3.975126 9.289122       7.394846 7.554281       4.714168 26.45181 9.278228 23.74405 7.374643 2.707766       11.85204 
1 1 1 4   37 13 o 30.83867 5.858612 12.62529       4.241842 17.41303       7.736061 10.56700       5.072347 34.73833 9.049512 27.64817 7.387641 7.090157       11.68208 
1 1 1 4   37 14 o 15.95108 6.374607 2.044163       3.745443 0.6946874      6.475128 2.722717       4.591534 18.26028 7.905826 17.72303 7.066230 0.5372467      10.60348 
1 1 1 4   37 15 o 49.91502 4.101199 31.64849       4.944633 38.04956       9.899232 29.52052       5.707657 51.97433 8.078096 47.74165 4.979057 4.232681       9.489291 
1 1 1 4   37 16 o 41.13900 5.113060 22.17445       5.015612 13.97486       8.133620 27.20554       6.371167 30.14771 9.727806 45.10026 5.941374 -14.95255      11.39869 
1 1 1 4   37 17 o 32.78540 6.309560 14.84174       4.858037 0.000000       0.000000 14.84174       4.858037 ?        ?        32.78540 6.309560 0.000000       6.309560 
1 1 1 4   37 18 o 24.44116 7.402909 8.729949       4.787990 0.000000       0.000000 8.729949       4.787990 ?        ?        24.44116 7.402909 0.000000       7.402909 
1 1 1 4   37 19 o 44.11003 4.217085 25.31784       4.477878 44.07775       9.870073 20.45579       5.024755 54.81171 7.593118 38.79526 5.466310 16.01645       9.356067 
1 1 1 4   37 20 o 19.16625 6.352281 5.154758       3.457583 5.840466       6.420218 4.874637       4.103488 20.99566 8.360767 18.97383 6.882940 2.021824       10.82946 
1 1 1 4   37 21 o 24.63025 6.289794 8.877915       3.788016 13.96800       8.145252 7.473233       4.278889 27.92062 9.741573 22.27375 7.041694 5.646866       12.02014 
1 1 1 4   37 22 o 14.47935 5.923438 1.866745       3.320236 10.20290       7.191385 -0.3916203     3.743060 24.32581 9.062490 12.94491 5.789019 11.38090       10.75367 
1 1 1 4   37 23 o 15.21504 6.113084 2.488953       3.463580 1.547003       6.269526 2.902713       4.155225 16.97230 7.547396 16.27613 6.638673 0.6961651      10.05163 
1 1 1 4   37 24 o 29.26554 5.375018 12.32869       3.692080 14.62678       7.639787 11.62843       4.217249 27.09042 9.435586 27.50504 6.410866 -0.4146175     11.40743 
1 1 1 4   37 25 o 19.26616 6.313220 5.816371       3.418625 -5.112878      6.480591 10.03035       4.024070 13.48894 6.516169 25.10381 6.520344 -11.61487      9.218207 
1 1 1 4   37 26 o 23.89803 6.134313 9.057980       3.590270 8.342721       7.477998 9.272240       4.092840 20.63160 8.700234 23.52788 6.773218 -2.896284      11.02590 
1 1 1 4   37 27 o 38.16039 4.643757 20.76494       4.229553 48.25069       11.38988 16.36853       4.555274 47.23619 10.19419 32.35797 5.997735 14.87822       11.82769 
1 1 1 4   37 28 o 16.85991 6.838150 4.558264       4.379410 13.95969       8.428436 1.081315       5.125654 23.01946 9.429746 14.50211 6.601803 8.517354       11.51103 
1 1 1 4   38 0  o 30.78840 5.314548 12.24157       3.843326 10.02317       5.316658 14.66962       5.562221 27.31242 7.672859 33.16109 7.097405 -5.848677      10.45208 
1 1 1 4   38 1  o 35.31954 4.131676 15.70868       3.489008 19.88244       5.141310 12.14568       4.750262 39.34331 5.513638 30.25052 6.627525 9.092787       8.621154 
1 1 1 4   38 2  o 32.33652 5.008818 13.40966       3.819447 9.104823       4.916441 19.96276       6.065905 26.08240 7.396199 38.98522 6.621596 -12.90282      9.927199 
1 1 1 4   38 3  o 61.34653 4.634424 47.34361       6.876983 47.34361       6.876983 0.000000       0.000000 61.34653 4.634424 ?        ?        0.000000       4.634424 
1 1 1 4   38 4  o 49.19143 3.770410 30.19727       4.485296 43.42465       6.302834 16.62583       6.384283 58.79420 4.431740 35.02077 7.691697 23.77343       8.877078 
1 1 1 4   38 5  o 56.03528 4.551165 39.57029       6.161244 50.76369       9.272549 30.72151       8.244417 62.70218 6.147406 48.09990 7.259430 14.60227       9.512619 
1 1 1 4   38 6  o 32.97595 4.717139 13.91548       3.682776 12.65611       4.747799 15.81783       5.835252 30.79619 6.529305 34.23385 7.222180 -3.437662      9.736103 
1 1 1 4   38 7  o 27.75737 5.285285 10.06698       3.444519 6.998724       4.554197 14.16838       5.265406 23.03245 7.262508 32.44498 6.873630 -9.412529      9.999540 
1 1 1 4   38 8  o 24.21304 5.985885 7.829163       3.511672 2.319800       4.585421 15.64359       5.461062 17.46950 7.028576 34.09836 6.810664 -16.62886      9.787033 
1 1 1 4   38 9  o 48.42278 4.172174 29.60467       4.875247 25.43492       7.689075 32.40796       6.304527 43.17927 7.583981 50.19442 5.230858 -7.015144      9.212961 
1 1 1 4   38 10 o 18.89684 6.043690 4.611663       3.144373 4.900246       3.990429 4.138994       5.106966 19.79095 6.823126 19.76773 7.575135 0.2322388E-01  10.19498 
1 1 1 4   38 11 o 14.51929 6.190919 0.4837508      3.857925 0.6944878      5.778036 0.3142286      5.182308 17.41166 7.502955 16.34850 7.075409 1.063168       10.31289 
1 1 1 4   38 12 o 53.30831 5.384311 37.06783       6.898803 50.25216       10.01191 25.14857       9.519467 60.96018 6.858470 40.86543 9.704471 20.09475       11.88341 
1 1 1 4   38 13 o 13.64621 6.042284 -0.6470869     3.975507 -3.932375      6.119842 1.751439       5.229085 14.91106 6.939308 17.40240 7.303104 -2.491337      10.07419 
1 1 1 4   38 14 o 40.74036 5.310694 21.95355       5.147067 13.21828       7.976222 28.18655       6.737632 29.22543 9.646617 45.60300 6.225216 -16.37757      11.48088 
1 1 1 4   38 15 o 27.35066 8.117321 11.17620       5.800735 0.000000       0.000000 11.17620       5.800735 ?        ?        27.35066 8.117321 0.000000       8.117321 
1 1 1 4   38 16 o 31.02657 6.682413 13.72105       4.903041 0.000000       0.000000 13.72105       4.903041 ?        ?        31.02657 6.682413 0.000000       6.682413 
1 1 1 4   38 17 o 13.85413 5.961595 0.5651193      3.638072 7.672158       7.002880 -2.062064      4.257724 23.02606 8.858521 12.82663 5.905227 10.19944       10.64637 
1 1 1 4   38 18 o 30.59297 5.494732 12.94691       3.945869 23.04066       8.242650 9.946064       4.494304 37.50769 9.109770 25.82622 6.977419 11.68146       11.47485 
1 1 1 4   38 19 o 48.64928 4.712980 31.62817       5.517473 26.68686       8.923209 34.68678       7.020401 39.81432 9.356369 49.77091 5.903111 -9.956585      11.06293 
1 1 1 4   38 20 o 28.66033 5.911542 11.82581       3.991619 16.27448       7.987888 10.34522       4.608232 29.82560 9.641671 25.88401 7.095511 3.941591       11.97114 
1 1 1 4   38 21 o 13.82722 5.845645 1.255947       3.389827 3.480599       6.519393 0.4316305      3.968469 18.48862 7.968423 13.84573 6.087560 4.642884       10.02767 
1 1 1 4   38 22 o 15.43951 6.326869 2.522573       3.795897 -4.390403      7.048277 5.346777       4.505038 14.61432 6.990766 18.91541 7.146271 -4.301093      9.997000 
1 1 1 4   38 23 o 13.51113 6.015512 0.3265969      3.995064 0.7988341      6.661471 0.6134088E-01  4.992552 16.36522 7.479118 14.46767 6.558271 1.897555       9.947268 
1 1 1 4   38 24 o 24.32368 7.310989 10.23896       4.682688 19.61098       8.405334 6.021054       5.638807 29.62142 9.906524 19.10076 7.754809 10.52066       12.58079 
1 1 1 4   38 25 o 61.07881 6.021687 57.38674       8.846367 50.28451       12.01735 65.78790       13.07016 47.91879 10.57497 57.00053 9.760301 -9.081745      14.39075 
1 1 1 4   38 26 o 22.03959 7.618473 9.245559       4.976187 18.34416       8.801745 4.971021       6.032899 26.43386 9.988366 17.70749 7.648732 8.726377       12.58056 
1 1 1 4   38 27 o 13.41276 6.106849 0.3899354      4.388046 3.635432       8.110995 -0.9530139     5.217511 17.23787 8.010842 13.42617 6.299923 3.811709       10.19130 
1 1 1 4   39 0  o 57.01903 3.778679 40.67842       5.220822 39.24108       6.463618 43.37636       8.855453 55.54525 4.822970 57.51825 6.427599 -1.972996      8.035862 
1 1 1 4   39 1  o 21.29920 6.307695 6.005195       3.505716 5.649761       4.160411 6.875550       6.510366 20.99847 6.968343 23.69530 8.658500 -2.696829      11.11429 
1 1 1 4   39 2  o 10.52911 4.830174 -1.814702      2.813623 -1.508147      3.823143 -2.176918      4.155763 12.86896 5.795053 13.00723 5.930244 -0.1382732     8.291589 
1 1 1 4   39 3  o 55.58923 3.455967 38.54907       4.658466 33.62374       6.166224 45.09807       7.110314 51.24913 5.000933 59.43932 4.953836 -8.190189      7.039164 
1 1 1 4   39 4  o 76.35047 2.821739 72.11070       5.241034 73.74735       8.120115 70.94203       6.861676 76.41473 4.378963 75.29677 3.751350 1.117966       5.766103 
1 1 1 4   39 5  o 18.11502 6.350637 3.958168       3.464143 6.812319       4.398581 -0.7035393     5.621428 22.56351 7.140288 16.29226 7.200835 6.271244       10.14080 
1 1 1 4   39 6  o 21.12671 6.545657 5.944508       3.716468 5.106685       4.359465 8.173002       7.109890 20.25373 7.122333 24.97150 9.059818 -4.717772      11.52423 
1 1 1 4   39 7  o 20.51144 6.465897 5.580694       3.610130 4.762796       4.370650 7.336954       6.404584 19.78427 7.113259 23.76965 8.602230 -3.985380      11.16229 
1 1 1 4   39 8  o 34.83075 4.541145 15.64765       3.762773 16.50678       5.073165 14.59708       5.609964 35.02295 6.169443 32.31190 7.297639 2.711048       9.556022 
1 1 1 4   39 9  o 25.00476 5.771269 8.470725       3.445348 7.709780       4.434269 9.629910       5.472954 23.57094 7.120991 26.00311 7.922709 -2.432177      10.65260 
1 1 1 4   39 10 o 20.53733 6.688488 5.667565       3.839939 4.733742       5.881922 6.361168       5.069240 20.63060 8.068088 21.86444 7.680961 -1.233839      11.13962 
1 1 1 4   39 11 o 66.84962 4.322666 57.28738       7.004097 75.57958       11.67085 46.99071       8.756240 74.60838 6.483478 59.02358 6.179208 15.58479       8.956455 
1 1 1 4   39 12 o 21.20828 6.717861 6.250350       3.892699 1.154611       6.596386 8.973145       4.821808 18.19872 7.928365 24.89034 7.404140 -6.691620      10.84805 
1 1 1 4   39 13 o 37.36863 6.278045 19.37768       5.514476 0.000000       0.000000 19.37768       5.514476 ?        ?        37.36863 6.278045 0.000000       6.278045 
1 1 1 4   39 14 o 15.83553 6.706549 1.450382       4.474916 0.000000       0.000000 1.450382       4.474916 ?        ?        15.83553 6.706549 0.000000       6.706549 
1 1 1 4   39 15 o 11.61096 5.335958 -1.764297      3.454715 0.9494734      6.143450 -3.019349      4.177886 17.19831 7.567455 12.08983 5.661509 5.108472       9.450876 
1 1 1 4   39 16 o 17.47997 6.430005 3.929221       3.599761 3.313259       6.630079 4.186702       4.286609 19.10320 8.129705 18.22679 6.951064 0.8764038      10.69623 
1 1 1 4   39 17 o 32.26449 6.222077 14.98256       4.714806 11.44653       7.390352 17.40951       6.122623 25.85413 9.255244 33.54572 7.658674 -7.691586      12.01311 
1 1 1 4   39 18 o 15.74619 6.643857 1.939376       4.364777 3.103390       7.463260 1.334286       5.380959 19.09235 8.372734 16.29433 7.128480 2.798018       10.99627 
1 1 1 4   39 19 o 28.87489 7.957517 13.79378       5.778475 14.32689       8.702905 13.37346       7.727730 26.94200 9.982316 26.67120 9.473197 0.2708015      13.76183 
1 1 1 4   39 20 o 10.46287 5.158597 -7.898948      4.706255 -10.17479      6.744540 -5.739257      6.570184 12.42561 6.135530 13.64135 6.582697 -1.215744      8.998702 
1 1 1 4   39 21 o 15.61900 6.588454 2.409014       4.290458 5.093906       7.586985 1.146737       5.202153 19.38078 8.471952 15.43615 6.868990 3.944630       10.90674 
1 1 1 4   39 22 o 14.09322 6.230223 0.9149297      4.210261 4.842090       7.582139 -0.8358141     5.062485 18.81411 8.336810 13.85274 6.399633 4.961372       10.50989 
1 1 1 4   39 23 o 11.40042 5.379154 -2.328827      3.898499 -0.7400776     6.466296 -3.236081      4.886437 15.03200 7.040609 12.27660 5.858322 2.755400       9.159154 
1 1 1 4   39 24 o 20.18637 6.710156 6.946169       3.857433 6.433868       8.070103 7.097879       4.391607 19.09892 8.523493 20.04033 7.138952 -0.9414139     11.11821 
1 1 1 4   39 25 o 16.67603 6.407096 4.382828       3.659975 3.023658       8.050382 4.736952       4.109199 17.13500 7.969086 17.12526 6.729769 0.9746552E-02  10.43054 
1 1 1 4   40 0  o 18.03647 5.961972 4.165883       3.046330 8.972882       4.464880 -0.2082985E-01 4.166865 25.40190 6.992612 14.52600 6.315174 10.87590       9.422211 
1 1 1 4   40 1  o 25.02587 5.737296 8.456705       3.424036 15.13395       5.119655 3.052892       4.605663 33.28898 6.544482 17.98679 7.107331 15.30219       9.661490 
1 1 1 4   40 2  o 21.81315 5.754709 6.439944       3.102670 5.284751       4.383517 7.599702       4.392172 20.34693 7.143001 23.44158 7.088226 -3.094656      10.06307 
1 1 1 4   40 3  o 14.25236 5.744592 1.497342       3.069118 3.070236       4.336375 -0.8138887E-01 4.344413 17.67850 6.923391 14.71708 6.422511 2.961425       9.443622 
1 1 1 4   40 4  o 41.73209 3.794246 22.08938       3.816476 23.02811       5.473626 21.20123       5.324105 41.74281 5.515784 39.97202 5.620867 1.770794       7.875152 
1 1 1 4   40 5  o 19.01524 5.999109 4.811759       3.107108 6.038560       4.390332 3.580722       4.397907 21.21076 7.160207 18.23164 7.018550 2.979124       10.02640 
1 1 1 4   40 6  o 17.41007 6.165793 3.735658       3.271609 -1.346568      4.557432 9.139301       4.699337 14.02607 6.320654 25.33088 7.246902 -11.30481      9.616041 
1 1 1 4   40 7  o 58.24785 3.286446 42.64451       4.645979 39.00829       6.620574 46.17258       6.521363 54.59486 5.032928 59.82831 4.506083 -5.233452      6.755379 
1 1 1 4   40 8  o 55.80057 3.382724 39.27690       4.578219 43.63962       6.526325 35.04985       6.424046 57.96512 4.659475 51.53655 5.185551 6.428574       6.971416 
1 1 1 4   40 9  o 70.66103 4.193160 64.18330       7.187870 67.50186       11.40067 61.99385       9.260245 69.62000 6.806723 68.04049 5.635448 1.579514       8.836841 
1 1 1 4   40 10 o 76.06525 3.419469 73.22023       6.322215 65.43784       8.048643 85.75800       10.21589 70.74924 4.694924 80.36196 5.245292 -9.612724      7.039560 
1 1 1 4   40 11 o 33.96235 7.980727 17.50357       6.492473 0.000000       0.000000 17.50357       6.492473 ?        ?        33.96235 7.980727 0.000000       7.980727 
1 1 1 4   40 12 o 23.97403 7.651926 8.670457       5.042452 0.000000       0.000000 8.670457       5.042452 ?        ?        23.97403 7.651926 0.000000       7.651926 
1 1 1 4   40 13 o 32.02661 5.522166 14.16837       4.154181 22.26523       7.964002 11.14183       4.869067 37.09150 8.920579 27.20795 7.223617 9.883551       11.47856 
1 1 1 4   40 14 o 10.89802 5.141385 -3.055529      3.559212 -8.652312      6.414412 -0.5657738     4.278248 12.85637 6.272692 13.74975 6.165973 -0.8933878     8.795788 
1 1 1 4   40 15 o 30.77745 5.988649 13.56745       4.329867 31.61185       9.000777 8.134462       4.938878 44.14875 8.675684 22.86572 7.592478 21.28303       11.52880 
1 1 1 4   40 16 o 29.59155 6.038278 12.70982       4.206689 23.69989       9.126502 9.744999       4.740273 35.70070 10.06116 24.87577 7.326403 10.82492       12.44600 
1 1 1 4   40 17 o 16.15386 6.395271 3.090865       3.735596 0.7909350      7.525025 3.843004       4.303282 17.52619 7.986452 17.37493 6.868647 0.1512604      10.53384 
1 1 1 4   40 18 o 22.84817 7.082222 8.400930       4.350175 19.67115       8.687957 4.629877       5.025541 31.07554 10.05610 18.34648 7.366230 12.72905       12.46541 
1 1 1 4   40 19 o 15.00633 6.208164 2.314489       3.700818 14.45964       7.948040 -1.047607      4.181803 26.38905 9.578259 12.80861 5.880581 13.58044       11.23941 
1 1 1 4   40 20 o 23.99498 7.177649 9.733258       4.521557 16.89524       9.265667 7.494653       5.180229 26.63941 10.20470 20.76059 7.699719 5.878822       12.78365 
1 1 1 4   40 21 o 17.80133 6.741982 4.950010       4.015496 6.171519       7.741220 4.500356       4.696781 19.39189 8.514952 17.45758 7.081213 1.934313       11.07465 
1 1 1 4   40 22 o 15.93180 6.362787 3.545264       3.729134 6.547432       7.801800 2.656252       4.245522 19.28644 8.505434 15.33971 6.515954 3.946730       10.71448 
1 1 1 4   40 23 o 19.07279 6.805027 6.251204       3.991911 5.750206       8.424065 6.396281       4.533198 18.64150 8.477327 19.04578 7.174501 -0.4042778     11.10579 
1 1 1 4   41 0  o 48.37881 3.990627 29.97437       4.662904 39.66394       6.605403 20.34943       6.583338 54.97744 4.984473 37.59796 7.448777 17.37947       8.962659 
1 1 1 4   41 1  o 12.32211 5.408227 -0.2711874     3.119745 -2.686852      4.543158 1.884327       4.291558 13.04891 6.040319 16.17376 6.687675 -3.124843      9.011684 
1 1 1 4   41 2  o 31.52005 4.877203 13.17619       3.625359 9.522514       5.284593 16.42443       4.982772 25.40533 7.793804 34.49967 6.152477 -9.094341      9.929570 
1 1 1 4   41 3  o 20.65792 6.590010 5.933072       3.740398 6.624833       4.966579 5.026567       5.685442 21.79148 7.606612 20.40087 7.945430 1.390608       10.99956 
1 1 1 4   41 4  o 21.34270 6.030664 6.365541       3.274534 6.251665       4.897216 6.457624       4.403767 21.28139 7.543017 21.42730 7.170683 -0.1459007     10.40749 
1 1 1 4   41 5  o 14.88113 5.841558 2.149932       3.093210 -0.8600145E-01 4.482621 4.182369       4.273769 14.63627 6.451200 18.49065 6.966010 -3.854386      9.494382 
1 1 1 4   41 6  f 14.31657 5.677817 1.873595       2.949276 5.321302       4.331687 -1.105846      4.026793 19.85645 7.088270 13.15037 5.932291 6.706078       9.243141 
1 1 1 4   41 7  o 14.85807 6.154914 1.550573       3.644192 4.364606       6.451433 0.2319553      4.416222 20.06445 8.238047 14.72632 6.449821 5.338131       10.46258 
1 1 1 4   41 8  o 27.76925 6.425379 11.06887       4.261786 9.441868       7.708733 11.78506       5.114473 24.65658 9.340652 28.03475 7.384903 -3.378168      11.90733 
1 1 1 4   41 9  o 8.930333 4.379886 -5.787316      3.250716 -9.653511      5.967811 -4.156235      3.876243 12.02672 5.905797 10.92411 5.214252 1.102605       7.878253 
1 1 1 4   41 10 o 31.10177 4.969683 13.11024       3.639881 16.72952       5.642402 10.53057       4.763600 33.57177 7.118032 26.40766 7.204041 7.164118       10.12742 
1 1 1 4   41 11 o 25.38417 6.584372 9.524038       4.107152 16.78024       7.700564 6.639222       4.855420 31.17801 9.376347 21.19621 7.510958 9.981798       12.01376 
1 1 1 4   41 12 o 11.05587 5.303380 -4.549968      4.119158 -0.4244556     6.566239 -7.227014      5.289390 16.46863 7.487320 11.76483 5.730358 4.703796       9.428518 
1 1 1 4   41 13 o 19.29414 7.842303 4.771640       5.774501 0.000000       0.000000 4.771640       5.774501 ?        ?        19.29414 7.842303 0.000000       7.842303 
1 1 1 4   41 14 o 27.72566 7.319567 12.17941       5.017279 18.31103       8.313802 8.667124       6.292267 31.01741 9.816685 22.77866 8.478814 8.238743       12.97141 
1 1 1 4   41 15 o 25.69353 7.467473 10.78104       4.953070 10.20568       8.210733 11.11019       6.210301 23.50302 9.422772 25.06362 8.515552 -1.560608      12.70052 
1 1 1 4   41 16 o 24.00016 8.371265 10.29964       6.014657 5.654059       8.209349 15.68316       8.837345 20.14230 8.808535 27.13332 10.05803 -6.991024      13.36990 
1 1 1 4   41 17 o 25.92827 7.255148 11.18433       4.763519 -1.472319      7.392473 20.17106       6.229181 15.85002 7.456604 34.92672 7.539937 -19.07670      10.60432 
1 1 1 4   41 18 o 41.82805 5.818486 26.04376       5.770464 37.61889       10.23912 20.65622       6.985458 43.54678 9.876698 33.64866 8.513738 9.898121       13.03967 
1 1 1 4   41 19 o 28.60491 7.296607 13.91960       5.101755 13.01380       9.113347 14.33304       6.156928 23.52401 9.737980 27.40828 8.413301 -3.884262      12.86903 
1 1 1 4   41 20 o 13.47883 6.138521 -0.1998212E-01 4.437316 5.185407       7.864314 -2.451164      5.374560 18.61164 8.351982 13.15685 6.239896 5.454794       10.42554 
1 1 1 4   41 21 o 23.53184 7.621189 10.31135       4.989427 11.35626       9.156839 9.870111       5.950345 21.69688 9.397576 22.11244 8.242415 -0.4155560     12.50007 
1 1 1 4   42 0  o 34.41711 4.969809 15.89759       4.047635 20.64285       7.807087 14.15319       4.733500 35.88038 8.957186 31.53797 6.378462 4.342413       10.99618 
1 1 1 4   42 1  o 13.04577 5.563724 0.5969029      3.116929 -4.387808      4.482479 5.263566       4.337121 11.87658 5.651565 19.66636 7.084010 -7.789773      9.062196 
1 1 1 4   42 2  f 20.35312 6.012044 5.856164       3.188128 1.440097       4.669702 9.711670       4.363269 15.97156 6.810703 25.69709 6.845315 -9.725526      9.656294 
1 1 1 4   42 3  o 60.01905 3.214264 45.64226       4.684032 49.62240       7.467699 43.06070       6.014215 60.89275 5.078719 57.40653 4.331085 3.486221       6.674705 
1 1 1 4   42 4  o 12.43601 5.434303 0.1524835E-01  3.119351 -1.674035      4.424879 1.684147       4.398101 13.27955 6.078982 15.81634 6.671084 -2.536793      9.025374 
1 1 1 4   42 5  o 21.90519 6.552362 7.003636       3.768110 2.662390       6.439205 9.264428       4.646814 18.50230 7.946088 24.74966 7.244249 -6.247356      10.75265 
1 1 1 4   42 6  o 26.11490 6.269415 9.886639       3.939189 16.75451       7.766117 7.507591       4.570822 31.20238 9.423352 22.34659 7.298621 8.855787       11.91929 
1 1 1 4   42 7  o 13.54799 5.694097 1.079378       3.186208 -0.6740339     4.432167 2.954657       4.583604 13.87149 6.243641 17.05769 6.966788 -3.186193      9.355168 
1 1 1 4   42 8  o 13.98146 5.740782 1.569436       3.133121 4.104110       4.460857 -0.8982803     4.401544 18.07373 7.038253 13.63047 6.170408 4.443264       9.360072 
1 1 1 4   42 9  o 24.04046 6.098616 8.471700       3.577789 4.980187       4.968703 12.23141       5.156008 19.15566 7.436914 27.91979 7.442953 -8.764132      10.52166 
1 1 1 4   42 10 o 34.33747 4.749763 16.05697       3.868127 18.79908       5.382277 13.12772       5.562909 35.75822 6.412234 28.48329 7.791037 7.274923       10.09044 
1 1 1 4   42 11 o 18.65048 6.754419 5.029728       3.949522 1.190929       7.237944 6.657394       4.713028 17.57237 7.937791 20.72500 7.394208 -3.152624      10.84817 
1 1 1 4   42 12 o 8.996523 4.445777 -6.766291      3.565525 -5.836093      6.917974 -7.102767      4.160717 14.04552 6.771982 9.909514 4.878947 4.136010       8.346488 
1 1 1 4   42 13 o 23.50353 7.304974 9.064571       4.624632 20.57520       8.390375 4.041626       5.542568 32.26409 9.805483 18.02919 7.539242 14.23490       12.36882 
1 1 1 4   42 14 o 17.89130 6.968388 4.617938       4.373320 9.595494       8.047847 2.532127       5.209655 22.43301 9.204731 16.45640 7.108027 5.976610       11.62975 
1 1 1 4   42 15 o 20.25698 7.331508 6.807310       4.652272 0.000000       0.000000 6.807310       4.652272 ?        ?        20.25698 7.331508 0.000000       7.331508 
1 1 1 4   42 16 o 19.13128 6.806765 5.894125       3.991262 13.48133       8.006691 3.385343       4.604089 24.85175 9.494490 16.52011 6.887015 8.331636       11.72929 
1 1 1 4   42 17 o 46.39755 5.488461 31.71211       6.085561 49.08404       11.16443 24.36878       7.258705 50.32215 9.451153 36.72475 8.306011 13.59740       12.58229 
1 1 1 4   42 18 o 32.10992 6.065637 16.00316       4.572362 32.76942       10.17512 11.76089       5.118236 37.71694 10.62138 25.47177 7.640563 12.24517       13.08403 
1 1 1 4   43 0  o 20.99246 6.316756 6.474997       3.494247 7.176894       5.029069 5.819887       4.858564 21.67240 7.647366 20.09673 7.456211 1.575668       10.68070 
1 1 1 4   43 1  o 17.33418 6.485952 3.911447       3.691545 16.51356       8.130599 0.6389971      4.143214 30.10568 9.727014 14.40171 6.278677 15.70398       11.57742 
1 1 1 4   43 2  o 39.69621 5.322717 21.79272       5.019308 0.000000       0.000000 21.79272       5.019308 ?        ?        39.69621 5.322717 0.000000       5.322717 
1 1 1 4   43 3  o 14.64742 6.340487 0.9462631      4.163336 0.000000       0.000000 0.9462631      4.163336 ?        ?        14.64742 6.340487 0.000000       6.340487 
1 1 1 4   43 4  o 24.97753 7.444535 9.882516       4.870851 8.588374       7.264001 10.93979       6.565662 22.88824 8.961596 25.23927 8.749687 -2.351032      12.52467 
1 1 1 4   43 5  o 11.72805 5.332790 -1.050711      3.332411 -4.616766      4.664622 2.666379       4.762380 11.82096 5.663279 16.69437 6.985310 -4.873416      8.992623 
1 1 1 4   43 6  o 28.09977 5.240023 11.10504       3.456200 12.20873       5.101652 10.16879       4.698776 27.67951 7.414737 25.33867 7.245615 2.340836       10.36712 
1 1 1 4   43 7  o 12.02195 5.283190 0.6117741E-01  2.985769 2.085924       4.363229 -1.721925      4.094593 15.69951 6.634363 12.44847 5.752505 3.251046       8.781008 
1 1 1 4   43 8  o 23.88774 5.774765 8.393711       3.324133 7.503893       4.622375 9.346783       4.783849 21.64433 7.346735 23.94986 7.427374 -2.305527      10.44703 
1 1 1 4   43 9  o 13.56394 5.670469 1.432415       3.134125 2.871501       4.332659 -0.1471433     4.539196 16.25105 6.719627 13.99839 6.308105 2.252656       9.216593 
1 1 1 4   43 10 o 11.90976 5.247095 0.1039811      2.962330 -0.2340201E-02 4.032036 0.2286834      4.366680 13.39579 5.998193 13.98673 6.253971 -0.5909462     8.665476 
1 1 1 4   43 11 f 11.07708 5.309951 -3.929228      4.113797 -3.360576      7.155277 -4.210003      5.027854 14.94300 7.119096 12.26565 5.877211 2.677350       9.231637 
1 1 1 4   43 12 o 25.57699 7.203280 10.89499       4.679718 16.63076       8.535589 8.429908       5.595685 27.50127 9.933741 21.80269 8.017363 5.698586       12.76547 
1 1 1 4   43 13 o 63.43699 4.640845 55.82343       7.124599 64.37930       12.43009 51.63734       8.694537 59.80281 8.791560 58.32249 6.213040 1.480324       10.76538 
1 1 1 4   43 14 o 12.00823 5.508338 -0.9015315     3.658320 -1.844688      7.129832 -0.5644916     4.262144 15.21267 7.206709 13.05260 5.971726 2.160069       9.359389 
1 1 1 4   43 15 o 21.79099 6.935976 8.060782       4.145302 18.08612       8.587968 5.015500       4.733199 27.69955 9.969544 17.94309 7.167597 9.756458       12.27869 
1 1 1 4   44 0  o 10.52819 4.934077 -2.228541      3.183758 -3.119447      4.573687 -1.391012      4.434563 12.29978 5.810420 13.08815 6.025987 -0.7883797     8.370992 
1 1 1 4   44 1  o 15.92849 6.148489 3.200559       3.381630 5.502623       5.209239 1.523881       4.445702 19.31804 7.581487 15.19259 6.564192 4.125443       10.02834 
1 1 1 4   44 2  o 13.51026 5.994568 0.2188792      3.933124 -5.372354      6.176305 4.032979       5.101184 13.34105 6.423834 17.85663 7.327808 -4.515578      9.744866 
1 1 1 4   44 3  o 24.20521 6.092350 8.842477       3.590417 6.853511       4.973999 11.00626       5.187992 20.64117 7.564086 25.58427 7.696576 -4.943104      10.79132 
1 1 1 4   44 4  o 26.67087 5.294517 10.21176       3.319688 8.168236       4.855459 12.00548       4.549006 22.17920 7.529671 27.64232 6.800556 -5.463120      10.14611 
1 1 1 4   44 5  o 29.03106 5.799877 12.42896       3.959502 16.18853       7.983278 11.20242       4.559867 28.26792 9.653937 26.44129 6.976739 1.826637       11.91106 
1 1 1 4   44 6  o 16.26666 6.414100 3.399369       3.743900 15.89523       7.934244 -0.1798729     4.246372 27.89120 9.620905 13.51753 6.095449 14.37367       11.38931 
1 1 1 4   44 7  o 12.89246 5.579470 0.7622625      3.222352 -3.389652      4.609747 4.729754       4.506205 12.07608 5.742153 18.03752 7.059525 -5.961432      9.099957 
1 1 1 4   44 8  o 12.76044 5.707209 -0.2142977E-01 3.639185 -2.572455      4.730184 3.678608       5.696704 12.62182 5.946178 17.55000 7.504170 -4.928180      9.574425 
1 1 1 4   44 9  o 14.66621 6.192489 1.978738       3.796144 1.888371       4.856082 2.120738       6.087297 15.54428 6.786721 16.62533 7.412251 -1.081055      10.04993 
1 1 1 4   44 10 o 18.71289 6.955570 5.569655       4.231649 16.43645       8.491817 1.979702       4.880836 26.97372 9.883564 15.55863 6.798265 11.41509       11.99588 
1 1 1 4   44 11 o 18.46302 6.824484 5.423221       4.063315 11.24755       7.792159 3.247947       4.762026 23.02641 9.197103 16.43172 6.936697 6.594687       11.51974 
1 1 1 4   44 12 o 17.34928 6.651440 4.558763       3.938661 2.701596       7.816042 5.190880       4.559954 17.59942 8.065027 18.15428 7.102594 -0.5548515     10.74670 
1 1 1 4   45 0  o 12.69140 5.661440 0.3582422E-01  3.556284 -4.397299      7.418885 1.358373       4.052187 14.72946 7.079030 14.41615 6.247787 0.3133078      9.441796 
1 1 1 4   45 1  o 14.38095 5.986973 1.975420       3.472378 -0.7569218     5.482439 3.805723       4.487120 14.47110 6.676202 17.00856 6.913149 -2.537457      9.610583 
1 1 1 4   45 2  o 31.69402 5.041896 14.30314       3.763797 23.21254       6.176559 9.040735       4.746948 38.35883 6.859435 23.00671 7.432251 15.35213       10.11386 
1 1 1 4   45 3  o 41.64184 4.057717 23.40436       4.065466 26.31512       6.591656 21.61737       5.164781 40.81908 6.870420 38.30178 5.707479 2.517300       8.931852 
1 1 1 4   45 4  o 20.94773 6.369438 6.954065       3.539753 7.487312       5.095360 6.456665       4.921120 20.85421 7.653566 19.75779 7.467995 1.096422       10.69336 
1 1 1 4   45 5  o 13.85363 6.071010 0.9730189      3.917603 -1.859283      4.784577 6.734661       6.824123 12.99546 6.076847 19.98869 8.362598 -6.993232      10.33737 
1 1 1 4   45 6  o 14.43745 6.191823 1.692406       3.899806 1.674499       5.093564 1.717774       6.062412 15.50125 6.852674 16.25855 7.311472 -0.7572927     10.02082 
1 1 1 5   0  0  o 8.277202 4.695642 1.086048       1.465356 1.086048       1.465356 1.086048       1.465356 8.277202 4.695642 8.277202 4.695642 0.000000       0.000000 
1 1 1 5   0  1  o 498.3707 8.372738 3030.943       101.6201 3030.943       101.6201 3030.943       101.6201 498.3707 8.372738 498.3707 8.372738 0.000000       0.000000 
1 1 1 5   0  2  o 17.28888 3.585032 4.078056       1.332639 4.078056       1.332639 4.078056       1.332639 17.28888 3.585032 17.28888 3.585032 0.000000       0.000000 
1 1 1 5   0  3  o 303.0733 5.344881 1120.583       39.44729 1120.583       39.44729 1120.583       39.44729 303.0733 5.344881 303.0733 5.344881 0.000000       0.000000 
1 1 1 5   0  4  o 385.3759 8.105536 1813.419       76.04464 1813.419       76.04464 1813.419       76.04464 385.3759 8.105536 385.3759 8.105536 0.000000       0.000000 
1 1 1 5   0  5  o 188.1961 4.550685 432.4250       20.84249 432.4250       20.84249 432.4250       20.84249 188.1961 4.550685 188.1961 4.550685 0.000000       0.000000 
1 1 1 5   0  6  o 45.16994 3.500207 25.30992       3.798185 25.30992       3.798185 25.30992       3.798185 45.16994 3.500207 45.16994 3.500207 0.000000       0.000000 
1 1 1 5   0  7  o 207.9071 4.918025 527.7794       24.88554 527.7794       24.88554 527.7794       24.88554 207.9071 4.918025 207.9071 4.918025 0.000000       0.000000 
1 1 1 5   0  8  o 112.4282 3.567563 154.5121       9.751936 154.5121       9.751936 154.5121       9.751936 112.4282 3.567563 112.4282 3.567563 0.000000       0.000000 
1 1 1 5   0  9  o 9.834162 5.998183 1.012840       2.712878 1.012840       2.712878 1.012840       2.712878 9.834162 5.998183 9.834162 5.998183 0.000000       0.000000 
1 1 1 5   0  10 o 65.29564 4.850234 52.82131       7.617485 52.82131       7.617485 52.82131       7.617485 65.29564 4.850234 65.29564 4.850234 0.000000       0.000000 
1 1 1 5   0  11 o 424.2731 12.62432 2203.427       130.2621 2203.427       130.2621 2203.427       130.2621 424.2731 12.62432 424.2731 12.62432 0.000000       0.000000 
1 1 1 5   0  12 o 340.0730 7.332591 1411.872       60.70295 1411.872       60.70295 1411.872       60.70295 340.0730 7.332591 340.0730 7.332591 0.000000       0.000000 
1 1 1 5   0  13 o 21.58855 8.015007 7.621418       3.915713 7.621418       3.915713 7.621418       3.915713 21.58855 8.015007 21.58855 8.015007 0.000000       0.000000 
1 1 1 5   0  14 f 728.8777 14.85447 6493.292       263.5972 6493.292       263.5972 6493.292       263.5972 728.8777 14.85447 728.8777 14.85447 0.000000       0.000000 
1 1 1 5   0  15 o 274.7817 6.201488 921.7004       41.47822 921.7004       41.47822 921.7004       41.47822 274.7817 6.201488 274.7817 6.201488 0.000000       0.000000 
1 1 1 5   0  16 o 176.4458 6.633500 381.1027       28.43102 381.1027       28.43102 381.1027       28.43102 176.4458 6.633500 176.4458 6.633500 0.000000       0.000000 
1 1 1 5   0  17 f 241.4477 5.666930 711.7272       33.30170 711.7272       33.30170 711.7272       33.30170 241.4477 5.666930 241.4477 5.666930 0.000000       0.000000 
1 1 1 5   0  18 o 159.3432 4.507322 310.1820       17.47035 310.1820       17.47035 310.1820       17.47035 159.3432 4.507322 159.3432 4.507322 0.000000       0.000000 
1 1 1 5   0  19 o 385.9568 8.276615 1819.245       77.76363 1819.245       77.76363 1819.245       77.76363 385.9568 8.276615 385.9568 8.276615 0.000000       0.000000 
1 1 1 5   0  20 o 355.2003 7.715501 1541.000       66.71306 1541.000       66.71306 1541.000       66.71306 355.2003 7.715501 355.2003 7.715501 0.000000       0.000000 
1 1 1 5   0  21 o 383.6068 8.254046 1798.131       77.07886 1798.131       77.07886 1798.131       77.07886 383.6068 8.254046 383.6068 8.254046 0.000000       0.000000 
1 1 1 5   0  22 o 490.9103 10.29191 2949.061       122.9995 2949.061       122.9995 2949.061       122.9995 490.9103 10.29191 490.9103 10.29191 0.000000       0.000000 
1 1 1 5   0  23 o 89.74099 4.287318 98.86217       9.326921 98.86217       9.326921 98.86217       9.326921 89.74099 4.287318 89.74099 4.287318 0.000000       0.000000 
1 1 1 5   0  24 o 104.4761 6.049022 134.5520       15.28147 134.5520       15.28147 134.5520       15.28147 104.4761 6.049022 104.4761 6.049022 0.000000       0.000000 
1 1 1 5   0  25 f 64.34388 4.756329 51.33168       7.362102 51.33168       7.362102 51.33168       7.362102 64.34388 4.756329 64.34388 4.756329 0.000000       0.000000 
1 1 1 5   0  26 o 62.47611 4.932751 48.51952       7.399184 48.51952       7.399184 48.51952       7.399184 62.47611 4.932751 62.47611 4.932751 0.000000       0.000000 
1 1 1 5   0  27 o 19.43687 9.596828 6.819393       5.447236 6.819393       5.447236 6.819393       5.447236 19.43687 9.596828 19.43687 9.596828 0.000000       0.000000 
1 1 1 5   0  28 o 37.11365 7.883988 18.95513       6.268930 18.95513       6.268930 18.95513       6.268930 37.11365 7.883988 37.11365 7.883988 0.000000       0.000000 
1 1 1 5   0  29 o 223.0833 8.059371 612.8053       43.68322 612.8053       43.68322 612.8053       43.68322 223.0833 8.059371 223.0833 8.059371 0.000000       0.000000 
1 1 1 5   0  30 o 33.48885 8.989696 16.39286       6.339038 16.39286       6.339038 16.39286       6.339038 33.48885 8.989696 33.48885 8.989696 0.000000       0.000000 
1 1 1 5   0  31 o 56.62755 5.601977 40.36349       7.544242 40.36349       7.544242 40.36349       7.544242 56.62755 5.601977 56.62755 5.601977 0.000000       0.000000 
1 1 1 5   0  32 f 159.0385 4.869193 310.1636       18.83095 310.1636       18.83095 310.1636       18.83095 159.0385 4.869193 159.0385 4.869193 0.000000       0.000000 
1 1 1 5   0  33 o 9.839013 6.871687 -5.870235      6.041924 -5.870235      6.041924 -5.870235      6.041924 9.839013 6.871687 9.839013 6.871687 0.000000       0.000000 
1 1 1 5   0  34 o 75.19017 5.043505 70.16193       9.144342 70.16193       9.144342 70.16193       9.144342 75.19017 5.043505 75.19017 5.043505 0.000000       0.000000 
1 1 1 5   0  35 o 68.38092 7.221726 59.52442       11.69736 59.52442       11.69736 59.52442       11.69736 68.38092 7.221726 68.38092 7.221726 0.000000       0.000000 
1 1 1 5   0  36 o 94.20914 4.760979 109.6808       10.86611 109.6808       10.86611 109.6808       10.86611 94.20914 4.760979 94.20914 4.760979 0.000000       0.000000 
1 1 1 5   0  37 o 13.76118 8.539728 1.764409       5.725399 1.764409       5.725399 1.764409       5.725399 13.76118 8.539728 13.76118 8.539728 0.000000       0.000000 
1 1 1 5   0  38 o 19.47315 9.969308 7.111885       5.989180 7.111885       5.989180 7.111885       5.989180 19.47315 9.969308 19.47315 9.969308 0.000000       0.000000 
1 1 1 5   0  39 o 16.99021 9.690573 5.025270       6.287472 5.025270       6.287472 5.025270       6.287472 16.99021 9.690573 16.99021 9.690573 0.000000       0.000000 
1 1 1 5   0  40 o 87.58028 5.022062 96.33428       10.63697 96.33428       10.63697 96.33428       10.63697 87.58028 5.022062 87.58028 5.022062 0.000000       0.000000 
1 1 1 5   0  41 o 17.02980 9.371346 5.612002       5.623755 5.612002       5.623755 5.612002       5.623755 17.02980 9.371346 17.02980 9.371346 0.000000       0.000000 
1 1 1 5   0  42 o 14.19457 8.534208 3.293297       5.328843 3.293297       5.328843 3.293297       5.328843 14.19457 8.534208 14.19457 8.534208 0.000000       0.000000 
1 1 1 5   0  43 o 14.35810 8.610290 3.721030       5.396655 3.721030       5.396655 3.721030       5.396655 14.35810 8.610290 14.35810 8.610290 0.000000       0.000000 
1 1 1 5   0  44 o 25.67934 10.15754 13.09373       6.118050 13.09373       6.118050 13.09373       6.118050 25.67934 10.15754 25.67934 10.15754 0.000000       0.000000 
1 1 1 5   0  45 o 17.90408 10.26290 8.377681       7.102484 8.377681       7.102484 8.377681       7.102484 17.90408 10.26290 17.90408 10.26290 0.000000       0.000000 
1 1 1 5   0  46 o 15.91424 9.147182 6.526035       5.664723 6.526035       5.664723 6.526035       5.664723 15.91424 9.147182 15.91424 9.147182 0.000000       0.000000 
1 1 1 5   0  47 o 9.577715 6.488007 -0.2534614     4.497909 -0.2534614     4.497909 -0.2534614     4.497909 9.577715 6.488007 9.577715 6.488007 0.000000       0.000000 
1 1 1 5   0  48 o 8.466963 5.931756 -2.212583      4.602903 -2.212583      4.602903 -2.212583      4.602903 8.466963 5.931756 8.466963 5.931756 0.000000       0.000000 
1 1 1 5   0  49 o 11.83716 8.248824 2.373017       8.573206 2.373017       8.573206 2.373017       8.573206 11.83716 8.248824 11.83716 8.248824 0.000000       0.000000 
1 1 1 5   1  0  o 503.1846 6.531178 3087.578       80.08571 3127.481       127.6747 3061.693       102.8313 506.1114 10.35196 500.9344 8.423801 5.176971       13.34630 
1 1 1 5   1  1  o 701.7968 7.602233 6007.970       130.0135 6041.750       172.6741 5963.752       197.5629 703.4618 10.07281 698.6761 11.60362 4.785645       15.36572 
1 1 1 5   1  2  o 227.8096 3.271986 632.4811       18.16434 646.1588       23.77060 613.2853       28.16015 230.2422 4.236615 224.2888 5.152183 5.953415       6.670374 
1 1 1 5   1  3  o 517.4044 6.132848 3264.625       77.32652 3291.925       109.9391 3237.896       108.7825 519.3427 8.686844 515.0652 8.666839 4.277466       12.27092 
1 1 1 5   1  4  o 374.9241 4.986696 1713.799       45.56091 1701.917       58.53321 1732.064       72.57270 373.5461 6.430163 376.7417 7.904848 -3.195587      10.18988 
1 1 1 5   1  5  o 327.3333 5.724276 1306.718       45.66115 1346.999       56.94555 1234.183       76.41516 332.2633 7.033011 317.6802 9.882841 14.58310       12.12987 
1 1 1 5   1  6  o 384.3004 5.716535 1801.386       53.53525 1831.430       76.53395 1772.601       74.91263 387.2850 8.109375 381.0181 8.068138 6.266876       11.43927 
1 1 1 5   1  7  o 298.1804 4.587258 1084.124       33.33253 1082.887       47.11611 1085.364       47.16256 297.9021 6.490226 298.2426 6.489206 -0.3405151     9.177845 
1 1 1 5   1  8  o 391.0097 6.725775 1865.836       64.08642 1815.955       108.7772 1892.354       79.31275 384.9691 11.60840 393.6183 8.268594 -8.649139      14.25218 
1 1 1 5   1  9  o 317.8127 5.606260 1231.988       43.41908 1196.532       73.65483 1250.870       53.75160 312.7322 9.676435 320.1530 6.889657 -7.420807      11.87858 
1 1 1 5   1  10 o 378.4434 5.663225 1746.706       52.22769 1743.039       73.75013 1750.396       73.97259 377.8668 8.009177 378.6627 8.016452 -0.7958679     11.33183 
1 1 1 5   1  11 f 265.2036 4.862463 857.4659       31.42475 857.5396       38.47583 857.3183       54.46176 265.1766 5.954108 264.8919 8.447779 0.2846985      10.33520 
1 1 1 5   1  12 f 621.6522 10.38405 4719.081       157.3078 4688.417       191.7883 4782.121       274.9874 619.2901 12.70843 624.1363 18.09906 -4.846191      22.11516 
1 1 1 5   1  13 o 606.9456 8.785847 4494.718       129.9480 4501.421       183.9634 4488.043       183.5856 606.9797 12.43716 606.0781 12.43008 0.9016724      17.58379 
1 1 1 5   1  14 o 37.65778 3.479782 17.42989       3.157221 16.78492       4.400801 18.11390       4.532061 36.76499 5.044932 38.22653 4.983679 -1.461540      7.091431 
1 1 1 5   1  15 o 437.0141 9.180174 2330.434       97.76479 2397.655       140.9472 2268.106       135.7214 442.7454 13.07804 430.6242 12.94814 12.12119       18.40351 
1 1 1 5   1  16 o 245.7645 4.036026 736.1699       24.17180 719.6389       33.67655 753.7363       34.71530 242.9525 5.688138 248.6405 5.729450 -5.687988      8.073506 
1 1 1 5   1  17 o 100.2574 4.031833 122.7122       9.830339 139.5814       14.62288 108.8021       13.27855 106.8476 5.635997 94.28494 5.807439 12.56264       8.092640 
1 1 1 5   1  18 o 440.9292 6.556752 2371.292       70.45206 2354.997       99.15697 2387.906       100.1185 439.1894 9.264786 442.2450 9.289993 -3.055634      13.12022 
1 1 1 5   1  19 o 451.9603 6.713931 2492.012       73.94575 2483.353       104.3347 2500.750       104.8171 450.8925 9.495542 452.4678 9.506234 -1.575378      13.43629 
1 1 1 5   1  20 o 571.7912 8.349425 3993.109       116.3403 4052.353       166.1227 3936.084       162.9822 575.3266 11.84891 567.0253 11.79510 8.301331       16.71889 
1 1 1 5   1  21 o 157.0006 3.221108 300.4734       12.32374 305.1077       17.62868 296.0440       17.23480 158.1039 4.580357 155.7379 4.546121 2.366013       6.453440 
1 1 1 5   1  22 o 110.8901 3.023154 150.0172       8.161761 148.6471       11.56518 151.3766       11.51990 110.3099 4.310609 111.3232 4.254288 -1.013367      6.056428 
1 1 1 5   1  23 o 139.1971 3.589426 236.4635       12.16547 227.6035       20.74201 241.1095       15.02022 136.3363 6.259849 140.5033 4.392256 -4.167007      7.647066 
1 1 1 5   1  24 o 103.4501 3.429605 130.6835       8.633968 133.5554       10.72657 125.3992       14.55020 104.5237 4.219917 101.1099 5.931312 3.413788       7.279296 
1 1 1 5   1  25 o 154.0544 3.277176 289.5311       12.30297 278.1135       16.85340 302.5569       18.00132 150.8267 4.590702 157.3085 4.701146 -6.481812      6.570793 
1 1 1 5   1  26 o 103.7866 3.052369 131.5277       7.711559 137.0228       11.03195 126.2770       10.78386 105.8263 4.286695 101.5767 4.366762 4.249527       6.119180 
1 1 1 5   1  27 o 14.35959 6.081183 0.1189518      3.678990 -2.777231      4.989624 3.569214       5.446041 14.54131 6.577495 20.51456 7.832156 -5.973247      10.22771 
1 1 1 5   1  28 o 161.7209 3.904694 319.5439       15.38825 315.3301       18.62395 328.6106       27.31866 160.4733 4.767766 163.3884 6.876606 -2.915176      8.367753 
1 1 1 5   1  29 o 44.03680 5.213787 24.08806       5.486653 23.79239       9.877010 24.22002       6.598356 42.95166 9.670155 43.96127 6.342475 -1.009613      11.56455 
1 1 1 5   1  30 o 102.1346 3.162371 127.5251       7.861367 123.8400       11.07773 131.2639       11.15801 100.4692 4.536320 103.4579 4.436059 -2.988708      6.344826 
1 1 1 5   1  31 o 125.8067 3.232672 193.5178       9.902424 203.5526       14.26790 184.1922       13.75449 128.8124 4.552496 122.5139 4.615303 6.298508       6.482765 
1 1 1 5   1  32 o 74.52863 3.490658 68.07856       6.322055 84.28810       9.072489 52.77757       8.814563 82.79385 4.513755 65.26974 5.595768 17.52411       7.189340 
1 1 1 5   1  33 o 166.1433 3.486621 337.7710       14.11639 347.4988       20.12864 328.3558       19.80253 168.0952 4.919155 163.3768 4.979681 4.718353       6.999665 
1 1 1 5   1  34 o 123.3057 3.328353 186.2313       9.991973 191.4827       14.22266 181.1136       14.04067 124.7141 4.688166 121.2661 4.760545 3.447998       6.681443 
1 1 1 5   1  35 o 55.73206 4.059055 38.34007       5.474931 43.45547       7.785069 33.33449       7.701058 59.05762 5.471626 51.46711 6.269436 7.590504       8.321329 
1 1 1 5   1  36 o 105.2905 3.803330 136.4043       9.742608 136.3002       11.83372 136.6233       17.16401 105.0031 4.636126 104.2776 6.791423 0.7254562      8.222961 
1 1 1 5   1  37 o 154.5345 3.458901 293.5457       13.02565 299.3470       18.56887 287.9255       18.27672 155.2906 4.913048 152.2858 4.931462 3.004715       6.961132 
1 1 1 5   1  38 o 86.29044 3.439966 91.89584       7.219077 98.12733       10.23917 85.73649       10.17972 88.66516 4.756286 82.72489 5.074089 5.940269       6.954756 
1 1 1 5   1  39 o 27.87030 7.455652 10.49058       5.162457 8.616783       6.088405 15.28419       9.738091 25.64229 8.426372 32.94207 10.64538 -7.299780      13.57674 
1 1 1 5   1  40 o 23.62581 7.724841 7.427682       5.119598 -1.388066      8.754894 12.00883       6.311148 19.74285 8.839521 29.21995 8.410463 -9.477102      12.20135 
1 1 1 5   1  41 o 47.72820 4.442697 29.20595       5.107892 36.35429       7.439591 22.83126       7.025482 52.32410 5.939570 40.42771 7.403932 11.89639       9.491928 
1 1 1 5   1  42 o 21.82853 6.790728 6.738451       3.995402 0.4401297      5.390543 14.41649       5.951756 16.27711 7.127540 31.09457 7.853715 -14.81746      10.60578 
1 1 1 5   1  43 o 19.55390 6.867166 5.422457       4.051763 7.418307       5.757744 3.464539       5.702767 22.13833 8.134007 18.42518 7.671717 3.713154       11.18111 
1 1 1 5   1  44 o 17.80965 6.770304 4.459873       4.058419 1.726331       5.778368 7.121028       5.701348 16.54530 7.307206 20.95026 8.009917 -4.404957      10.84223 
1 1 1 5   1  45 o 11.09525 5.299033 -3.296829      4.015656 -4.696277      6.588018 -2.469495      5.065438 13.60250 6.570766 12.91607 6.105540 0.6864271      8.969537 
1 1 1 5   1  46 o 11.69789 5.405994 -0.8477279     3.616979 1.825017       5.218178 -3.319395      5.018052 15.05225 6.774934 12.12308 5.825256 2.929176       8.934951 
1 1 1 5   1  47 o 9.783750 4.736269 -3.299080      3.469196 -6.742891      4.895418 0.1751925      4.917020 10.36608 5.138054 13.24749 6.183416 -2.881406      8.039542 
1 1 1 5   1  48 f 13.66247 6.199673 2.271364       4.475536 6.140132       5.316383 -7.140552      8.292185 16.47084 7.147197 12.51785 6.278363 3.952994       9.513163 
1 1 1 5   1  49 o 11.40119 5.421939 -0.4487151     4.112590 4.854418       8.124721 -2.275562      4.768626 14.80149 7.184803 11.12890 5.425132 3.672586       9.002969 
1 1 1 5   2  0  o 429.9239 5.639418 2253.528       59.08293 2319.852       95.16150 2211.924       75.36919 435.9957 8.956596 425.8486 7.262774 10.14706       11.53120 
1 1 1 5   2  1  o 234.7458 3.054845 671.5603       17.47524 660.7001       24.47976 682.8458       24.95452 232.8178 4.314742 236.6873 4.326515 -3.869461      6.110297 
1 1 1 5   2  2  f 380.6783 4.607262 1766.532       42.74026 1715.308       59.23331 1822.168       61.73179 375.0344 6.481251 386.5359 6.553645 -11.50156      9.217205 
1 1 1 5   2  3  o 361.8043 4.076091 1595.589       35.93798 1604.819       55.02867 1588.725       47.45596 362.7560 6.224986 360.9728 5.394859 1.783112       8.237411 
1 1 1 5   2  4  o 197.2672 3.300128 474.2821       15.86433 481.3658       18.39412 453.7114       31.34547 198.7259 3.798293 192.7431 6.683709 5.982742       7.687587 
1 1 1 5   2  5  o 281.7374 4.360002 967.6837       29.93418 939.0383       41.56108 998.5616       43.15028 277.4610 6.146796 286.1176 6.188751 -8.656555      8.722599 
1 1 1 5   2  6  o 166.4194 2.978277 337.5517       12.07828 335.1226       17.03779 340.0059       17.12509 165.7415 4.221818 166.9460 4.212771 -1.204407      5.964159 
1 1 1 5   2  7  o 329.6257 5.761854 1325.416       46.28278 1358.408       81.14076 1309.505       56.34853 333.1653 10.00543 327.5461 7.059501 5.619202       12.24521 
1 1 1 5   2  8  o 308.7821 5.461400 1162.955       41.09531 1130.033       69.55188 1180.614       50.93773 303.9253 9.402180 311.0342 6.720403 -7.108917      11.55702 
1 1 1 5   2  9  o 494.5764 8.345608 2987.182       100.5837 2909.442       170.8779 3028.399       124.4226 486.7916 14.42068 497.6877 10.25903 -10.89609      17.69757 
1 1 1 5   2  10 o 526.2479 7.668493 3380.010       98.34142 3411.844       139.9322 3348.943       138.2348 528.2720 10.86986 523.3849 10.83828 4.887146       15.34999 
1 1 1 5   2  11 o 734.9196 10.56281 6598.405       189.1714 6662.492       269.3201 6535.994       265.7728 737.4902 14.98568 730.4697 14.93043 7.020447       21.15392 
1 1 1 5   2  12 o 308.9653 5.516609 1163.830       41.53535 1171.219       51.00321 1149.280       71.56955 309.8976 6.753722 306.6907 9.587943 3.206909       11.72781 
1 1 1 5   2  13 o 573.9772 9.626832 4020.729       134.6524 4031.529       165.1594 3999.319       232.5376 574.5124 11.79690 571.2664 16.72192 3.246033       20.46434 
1 1 1 5   2  14 o 109.9870 3.840793 147.6137       10.27854 148.0302       14.88022 147.2336       14.21471 110.0536 5.566494 109.7704 5.329869 0.2831650      7.706709 
1 1 1 5   2  15 o 428.4938 6.366948 2238.748       66.48320 2189.979       92.58887 2290.656       95.52264 423.6523 8.968363 433.2754 9.047034 -9.623138      12.73893 
1 1 1 5   2  16 o 299.6233 4.692636 1094.308       34.26325 1104.071       48.64777 1084.698       48.26559 300.8938 6.634582 298.2420 6.640989 2.651825       9.387247 
1 1 1 5   2  17 o 461.2516 6.820379 2594.823       76.66241 2574.025       107.7821 2616.120       109.0633 459.1754 9.632344 462.9114 9.668174 -3.735992      13.64755 
1 1 1 5   2  18 o 316.7879 7.003527 1224.202       54.06566 1253.730       78.05495 1196.969       74.95973 320.2342 10.01454 312.9121 9.842606 7.322113       14.04165 
1 1 1 5   2  19 o 443.5106 6.600244 2399.650       71.33457 2404.123       100.9623 2395.192       100.8025 443.6508 9.338605 442.8257 9.341193 0.8251038      13.20861 
1 1 1 5   2  20 o 460.7257 6.839389 2590.572       76.78844 2581.859       108.3438 2599.366       108.8485 459.5777 9.674066 461.1313 9.686383 -1.553589      13.68991 
1 1 1 5   2  21 o 267.7010 4.368371 873.9294       28.49743 893.2355       40.80719 855.5516       39.81405 270.5256 6.190022 264.7590 6.170915 5.766541       8.740513 
1 1 1 5   2  22 o 239.7034 4.657079 700.9767       27.20345 674.8803       45.90918 715.0975       33.77069 234.7702 8.036393 242.0275 5.725838 -7.257324      9.867565 
1 1 1 5   2  23 o 63.19357 3.363614 48.83635       5.161166 54.04964       7.457732 44.04445       7.149974 66.38860 4.638937 59.86595 4.945110 6.522652       6.780402 
1 1 1 5   2  24 o 274.9828 4.484701 923.0963       30.05213 895.0599       41.67924 953.4555       43.37151 270.5200 6.322434 279.1964 6.374684 -8.676453      8.978294 
1 1 1 5   2  25 o 113.7191 3.454492 157.9358       9.562027 156.0847       11.61287 161.8332       16.85048 112.9850 4.225214 114.8443 6.042229 -1.859360      7.372989 
1 1 1 5   2  26 o 123.7996 3.069731 186.9867       9.260949 190.5379       13.15449 183.4969       13.04018 124.8145 4.331432 122.4790 4.376068 2.335495       6.157214 
1 1 1 5   2  27 o 109.3068 3.577156 146.0287       9.515594 146.6912       11.60032 144.6662       16.63705 109.4736 4.357055 108.4411 6.323163 1.032433       7.678953 
1 1 1 5   2  28 o 230.2819 4.025387 648.0444       22.58934 644.0206       31.73705 652.1761       32.15944 229.2316 5.681407 230.6690 5.721146 -1.437408      8.062872 
1 1 1 5   2  29 o 38.76763 4.817883 18.68004       4.453655 26.23261       6.325729 11.25650       6.271461 45.88499 5.785586 29.75648 8.324055 16.12851       10.13720 
1 1 1 5   2  30 o 89.32413 3.805920 97.72929       8.265480 76.90746       14.26275 108.2580       10.14217 78.56889 7.541830 93.93470 4.443258 -15.36581      8.753385 
1 1 1 5   2  31 o 99.40499 3.191959 120.8557       7.722150 119.9766       10.67343 121.8213       11.18614 98.86764 4.441442 99.59639 4.621536 -0.7287521     6.409758 
1 1 1 5   2  32 o 34.33232 5.632221 14.86975       4.548896 19.19145       6.303592 10.17366       6.570954 38.84502 6.912505 28.48183 8.681785 10.36319       11.09757 
1 1 1 5   2  33 o 160.3520 3.461334 314.6227       13.52552 326.1344       19.31730 303.5515       18.94409 162.8513 4.873129 157.0823 4.955119 5.769073       6.949863 
1 1 1 5   2  34 o 110.4900 3.753706 149.7843       10.09226 154.7414       16.68017 146.9217       12.67568 111.6614 6.153802 109.1945 4.775136 2.466980       7.789172 
1 1 1 5   2  35 o 143.0417 3.384539 250.6802       11.79773 252.4310       16.54556 248.8694       16.82700 143.0837 4.751801 142.0278 4.869002 1.055878       6.803440 
1 1 1 5   2  36 o 52.17461 4.822963 33.90131       6.062720 32.63771       7.271864 36.78194       10.97955 50.89054 5.977545 53.12811 8.787481 -2.237572      10.62784 
1 1 1 5   2  37 o 34.47543 5.842019 15.22736       4.732974 9.395438       6.541052 21.63627       6.856991 27.16153 8.719869 40.83672 7.150853 -13.67519      11.27700 
1 1 1 5   2  38 o 40.58258 6.024603 21.16983       5.777490 25.19967       7.004547 12.59350       10.21849 44.08212 6.733788 31.24411 10.91048 12.83801       12.82117 
1 1 1 5   2  39 o 55.87549 4.191320 39.10728       5.665413 39.14529       7.867269 39.06634       8.165244 55.15832 5.946851 54.97674 6.202897 0.1815796      8.593077 
1 1 1 5   2  40 o 21.16119 7.107981 5.748825       4.326692 -0.4806099     5.916248 12.91125       6.343838 16.89282 7.429863 30.25929 8.337195 -13.36647      11.16744 
1 1 1 5   2  41 o 24.32881 7.569447 8.308393       4.964118 -0.7487340E-01 8.589326 12.51290       6.082889 19.78321 8.813444 29.33206 8.195270 -9.548847      12.03492 
1 1 1 5   2  42 o 20.04028 6.674008 5.513325       3.815603 9.231242       5.293604 1.492909       5.504744 24.95061 7.824756 17.17171 7.360282 7.778908       10.74247 
1 1 1 5   2  43 o 22.42241 7.303723 7.622019       4.578750 9.201230       5.559877 4.293666       8.071604 24.11091 8.056936 20.47110 8.844856 3.639803       11.96435 
1 1 1 5   2  44 o 15.09359 6.421733 1.814002       4.135081 -2.456181      6.265303 5.109646       5.504135 14.65643 6.885530 18.98564 7.678509 -4.329212      10.31359 
1 1 1 5   2  45 o 20.58939 6.773651 7.054186       3.933871 0.5805960      5.619411 13.27566       5.508901 15.10314 6.889695 27.07331 7.877315 -11.97017      10.46518 
1 1 1 5   2  46 o 11.46192 5.491774 -3.075822      4.388602 -2.296965      6.458497 -3.743933      5.981729 13.90131 6.660990 12.93297 6.250712 0.9683418      9.134560 
1 1 1 5   2  47 o 14.91958 6.161840 3.450558       3.637420 7.519832       5.533811 0.3549327      4.826586 18.48302 7.613541 13.26054 6.168293 5.222488       9.798666 
1 1 1 5   2  48 o 12.58218 6.130755 -1.893787      6.070145 -5.367780      9.150872 0.8360078      8.111722 13.23707 6.632853 14.31703 7.000127 -1.079961      9.643471 
1 1 1 5   2  49 o 20.28631 6.612537 8.869635       3.752802 16.73381       5.502083 2.028411       5.131774 25.73309 7.962952 13.25614 6.228916 12.47696       10.10980 
1 1 1 5   3  0  o 873.3771 12.47517 9324.296       265.5122 9479.272       379.7079 9176.019       371.4114 879.1593 17.72336 865.0151 17.61958 14.14417       24.99134 
1 1 1 5   3  1  o 252.2033 3.954081 775.2724       24.30147 779.9192       34.42056 770.6541       34.31462 252.9156 5.584782 251.4083 5.600972 1.507248       7.909530 
1 1 1 5   3  2  f 210.3648 3.437422 539.3481       17.62146 582.5467       25.97174 502.4984       23.98739 218.5972 4.875513 203.0242 4.848407 15.57297       6.875876 
1 1 1 5   3  3  o 602.8300 12.31551 4444.434       180.9187 4467.202       256.2093 4421.789       255.5076 602.9943 17.45431 599.9070 17.49637 3.087341       24.71388 
1 1 1 5   3  4  o 666.3039 11.07074 5427.418       179.7568 5292.772       305.6218 5498.633       222.2679 655.5540 19.15162 670.0929 13.61149 -14.53894      23.49590 
1 1 1 5   3  5  o 225.6278 3.627649 620.5370       19.94592 616.1176       27.91268 625.1485       28.51246 224.7785 5.095778 226.4173 5.167601 -1.638794      7.257483 
1 1 1 5   3  6  o 561.7260 9.402717 3856.031       128.7105 3723.664       217.3038 3927.564       159.7474 550.1623 16.22614 566.4817 11.57209 -16.31940      19.92990 
1 1 1 5   3  7  o 249.8272 3.975787 760.9049       24.20466 741.7102       33.71659 781.3163       34.76877 246.5871 5.610960 253.0838 5.637529 -6.496719      7.953906 
1 1 1 5   3  8  o 91.06512 2.393851 101.1337       5.307725 98.73212       7.457504 103.5991       7.555980 89.93483 3.408917 92.12970 3.371227 -2.194870      4.794359 
1 1 1 5   3  9  o 217.6390 3.613444 577.3747       19.16435 557.9309       26.51099 598.6561       27.73542 213.8999 5.086036 221.5672 5.136806 -7.667328      7.228730 
1 1 1 5   3  10 o 244.4598 4.531175 728.5562       26.99321 751.2188       47.12428 717.4892       32.93104 247.9747 7.808055 242.5615 5.571185 5.413193       9.591863 
1 1 1 5   3  11 o 546.8243 7.952159 3648.580       105.9666 3641.389       149.6464 3655.812       150.0733 545.8940 11.24921 546.9727 11.25905 -1.078674      15.91574 
1 1 1 5   3  12 o 464.2514 6.829037 2628.471       77.25895 2671.213       110.3735 2587.409       108.1808 467.7986 9.682106 460.4054 9.642147 7.393188       13.66434 
1 1 1 5   3  13 o 299.4134 9.436493 1095.087       68.76625 1095.087       68.76625 0.000000       0.000000 299.4134 9.436493 ?        ?        0.000000       9.436493 
1 1 1 5   3  14 o 436.2514 6.464229 2320.534       68.72104 2245.565       95.03961 2402.681       99.48518 428.9979 9.091036 443.7446 9.200030 -14.74667      12.93397 
1 1 1 5   3  15 o 425.7477 6.329505 2210.141       65.66866 2217.115       93.00756 2203.209       92.73206 426.2670 8.953657 424.9279 8.955267 1.339081       12.66352 
1 1 1 5   3  16 o 334.3591 5.137038 1362.869       41.85641 1397.813       60.06929 1329.890       58.35571 338.5313 7.281446 330.2052 7.252093 8.326050       10.27678 
1 1 1 5   3  17 o 221.7798 3.775753 599.4912       20.40618 609.1073       29.04974 590.1240       28.67138 223.5175 5.333282 220.0065 5.347820 3.510986       7.552687 
1 1 1 5   3  18 o 39.05779 4.282435 18.81902       4.009247 20.50842       5.662943 17.12126       5.676947 40.58718 5.898052 36.91786 6.550045 3.669323       8.814199 
1 1 1 5   3  19 o 118.9640 4.231040 172.7470       12.24635 151.5570       17.28671 194.0959       17.35138 111.2789 6.401773 126.0279 5.664253 -14.74897      8.547893 
1 1 1 5   3  20 o 153.0696 3.168174 285.5879       11.81773 300.2347       17.03594 272.0020       16.40735 156.8547 4.461429 149.2885 4.515183 7.566147       6.347537 
1 1 1 5   3  21 o 489.2105 8.347219 2925.481       99.51160 2899.061       170.8001 2939.058       122.4390 485.2279 14.46076 489.9431 10.25505 -4.715210      17.72794 
1 1 1 5   3  22 o 293.3003 4.687201 1049.555       33.50134 1047.530       47.27611 1051.599       47.48066 292.8242 6.625195 293.3905 6.641016 -0.5663147     9.380634 
1 1 1 5   3  23 o 305.6295 4.843923 1140.192       36.07685 1100.502       49.88072 1183.729       52.24190 299.9977 6.823051 311.1240 6.890478 -11.12625      9.697046 
1 1 1 5   3  24 o 147.2975 3.178131 264.6211       11.40783 262.7388       15.93610 266.5995       16.33762 146.6348 4.464934 147.7017 4.544480 -1.066818      6.370866 
1 1 1 5   3  25 f 249.9016 4.197769 762.5377       25.56370 739.1072       35.40928 788.0440       36.94463 245.7775 5.912060 253.7725 5.974075 -7.994965      8.404881 
1 1 1 5   3  26 o 185.9261 4.986274 422.9709       22.57150 422.9709       22.57150 0.000000       0.000000 185.9261 4.986274 ?        ?        0.000000       4.986274 
1 1 1 5   3  27 o 85.53172 3.597319 89.47881       7.481204 91.08225       9.098376 86.13171       13.14530 86.22136 4.344246 83.54703 6.507892 2.674332       7.824649 
1 1 1 5   3  28 o 183.9739 3.546365 413.3577       15.89921 409.3778       22.24597 417.5133       22.73166 182.8099 4.998311 184.6071 5.057737 -1.797150      7.110824 
1 1 1 5   3  29 o 102.3564 3.131150 128.0379       7.800887 124.5359       10.88992 131.7291       11.18004 100.7914 4.444615 103.6681 4.435752 -2.876656      6.279371 
1 1 1 5   3  30 o 101.5167 3.192438 126.0016       7.887801 146.7690       11.62654 108.2917       10.73661 109.4141 4.369333 93.90735 4.706716 15.50677       6.422168 
1 1 1 5   3  31 o 129.8557 3.794978 206.4485       11.99610 203.3641       21.07458 207.9270       14.59053 128.2138 6.769081 130.1731 4.606794 -1.959366      8.187980 
1 1 1 5   3  32 o 134.5023 3.264415 221.1583       10.69969 222.1876       14.90297 220.0633       15.37118 134.5296 4.552447 133.8465 4.720024 0.6831055      6.557698 
1 1 1 5   3  33 o 26.66635 7.370859 9.102407       4.949578 9.759278       7.416853 8.574988       6.645946 28.34912 9.299505 26.69182 8.805305 1.657301       12.80680 
1 1 1 5   3  34 o 34.28288 5.826364 14.91016       4.693541 16.11958       6.349720 13.45346       6.968715 35.30146 7.605841 32.17619 8.686440 3.125271       11.54569 
1 1 1 5   3  35 o 166.6121 3.538023 340.3008       14.36492 355.5129       20.51040 325.6546       20.12521 169.7273 4.964244 162.3836 5.092129 7.343781       7.111505 
1 1 1 5   3  36 o 41.96766 5.049767 22.08866       5.060783 25.14295       6.771700 18.22462       7.616633 44.44843 6.439126 37.16086 8.583777 7.287571       10.73050 
1 1 1 5   3  37 f 145.3260 3.965625 260.5980       14.03088 258.9592       17.01394 264.0817       24.80644 144.4255 4.841046 144.3426 7.073893 0.8291626E-01  8.571795 
1 1 1 5   3  38 o 125.7237 3.901954 195.6769       11.94014 216.6953       14.87454 157.5943       20.02196 131.8860 4.635371 110.4953 7.479866 21.39066       8.799719 
1 1 1 5   3  39 o 115.3835 3.359769 164.7641       9.436838 175.4133       13.32732 154.0559       13.36417 118.2388 4.634348 110.5537 4.973314 7.685051       6.797870 
1 1 1 5   3  40 o 46.23979 4.413984 27.15707       4.913450 30.58494       6.691744 23.14710       7.237653 48.42097 5.785483 41.13574 7.496187 7.285229       9.469141 
1 1 1 5   3  41 o 41.90006 5.730671 23.34592       5.698184 32.25481       10.52889 19.65576       6.776316 46.16044 9.670188 37.15942 7.735105 9.001019       12.38323 
1 1 1 5   3  42 o 20.98236 7.247945 6.110839       4.503611 3.410043       5.366766 12.54054       8.280606 18.59854 7.560070 27.82464 9.813405 -9.226103      12.38780 
1 1 1 5   3  43 o 14.45472 6.339684 0.4108934      4.279973 -2.232929      6.098931 2.976206       6.007692 15.05499 6.979229 18.21242 7.744243 -3.157422      10.42511 
1 1 1 5   3  44 o 24.36199 6.684669 9.315613       4.087797 9.214970       5.598941 9.430502       5.982098 23.08880 8.075196 23.14943 8.322057 -0.6062889E-01 11.59592 
1 1 1 5   3  45 o 18.14404 6.606397 5.234229       3.785185 5.489759       5.227785 4.952648       5.487797 18.48997 7.481383 18.06931 7.524813 0.4206619      10.61103 
1 1 1 5   3  46 o 9.935420 4.792025 -3.443968      3.471496 -1.067348      4.870853 -5.897411      4.948952 13.01259 6.099852 11.00502 5.398801 2.007566       8.145873 
1 1 1 5   3  47 o 11.72921 5.587489 -1.752190      4.405655 -3.729689      5.179218 3.424529       8.379797 11.67434 5.682707 16.09661 7.678584 -4.422270      9.552687 
1 1 1 5   3  48 o 11.65811 5.366187 0.3633433      3.513440 5.546191       5.019652 -4.614494      4.919374 16.04040 6.952720 10.71794 5.282397 5.322453       8.731783 
1 1 1 5   3  49 o 12.56380 5.624158 1.994930       3.542309 -0.4497336     4.986161 4.486069       5.033335 12.00864 5.779609 14.63425 6.614164 -2.625616      8.783566 
1 1 1 5   4  0  o 269.7132 4.185733 886.7098       27.51122 875.1273       38.70688 898.5347       39.10975 267.8929 5.929130 271.4525 5.912280 -3.559692      8.373150 
1 1 1 5   4  1  o 564.6890 7.306355 3890.142       100.5417 3794.633       156.0609 3957.912       131.4583 557.2029 11.49330 569.3449 9.474938 -12.14203      14.89532 
1 1 1 5   4  2  o 127.7435 2.962460 198.8739       9.222046 188.4179       14.68678 205.6799       11.84923 124.2223 4.861051 129.8484 3.748627 -5.626160      6.138568 
1 1 1 5   4  3  o 536.9002 9.000707 3519.920       117.7623 3507.030       143.7220 3546.255       205.4266 535.6289 11.01091 537.4953 15.70043 -1.866394      19.17664 
1 1 1 5   4  4  o 50.37197 2.086346 30.97306       2.555467 30.83383       2.807779 31.64502       6.168084 50.24846 2.299092 50.69172 5.060742 -0.4432602     5.558501 
1 1 1 5   4  5  o 400.4657 5.300173 1955.851       51.72392 1971.975       67.15107 1932.329       81.10662 401.9888 6.854928 397.7778 8.367191 4.211029       10.81665 
1 1 1 5   4  6  o 276.6736 4.992459 933.5042       33.66033 984.0286       60.64684 911.0112       40.46512 283.6711 8.783762 273.2633 6.076640 10.40787       10.68082 
1 1 1 5   4  7  o 76.06710 2.272582 70.57735       4.207898 66.85772       5.819636 74.65247       6.091395 73.99103 3.235429 78.19474 3.203492 -4.203712      4.553061 
1 1 1 5   4  8  o 274.3649 4.292864 917.7648       28.70198 931.0367       40.89902 904.8856       40.28930 276.2561 6.075261 272.3490 6.070548 3.907135       8.588385 
1 1 1 5   4  9  o 119.2582 2.590210 173.3284       7.527648 186.4633       10.89592 161.3344       10.41196 123.6297 3.620540 114.9857 3.720702 8.643990       5.191525 
1 1 1 5   4  10 o 293.0935 4.551156 1047.238       32.50603 1027.361       45.42772 1068.095       46.53315 290.2233 6.423216 295.9195 6.452868 -5.696167      9.104791 
1 1 1 5   4  11 o 539.2214 9.055355 3548.923       118.9895 3574.894       206.4505 3536.004       145.6069 540.0240 15.70465 538.0032 11.10609 2.020813       19.23490 
1 1 1 5   4  12 o 952.0901 15.73057 11095.26       364.9712 11175.68       449.3882 10939.43       625.5432 954.4337 19.32146 940.7093 27.31656 13.72443       33.45912 
1 1 1 5   4  13 o 404.7859 6.035051 1997.680       59.53090 1957.306       83.02680 2040.397       85.40224 400.5523 8.505953 408.9622 8.569391 -8.409943      12.07417 
1 1 1 5   4  14 o 130.5406 3.304137 207.8050       10.50245 213.4941       12.81749 196.1814       18.32104 132.2924 3.980395 126.7120 5.949916 5.580414       7.158565 
1 1 1 5   4  15 o 450.1969 6.656968 2471.490       73.03232 2463.822       103.0208 2479.237       103.5478 449.3186 9.408801 450.7206 9.427522 -1.401978      13.31930 
1 1 1 5   4  16 o 349.7388 5.332490 1491.206       45.44749 1506.763       64.62114 1475.980       63.92937 351.4594 7.545071 347.8510 7.541732 3.608459       10.66798 
1 1 1 5   4  17 f 643.8394 9.320625 5060.438       146.2375 5197.232       210.5453 4932.935       203.2687 651.8500 13.25445 635.0814 13.13424 16.76862       18.65981 
1 1 1 5   4  18 o 413.8658 6.195361 2089.040       62.48305 2134.649       89.50687 2045.688       87.26454 418.1543 8.783826 409.3516 8.747929 8.802734       12.39685 
1 1 1 5   4  19 o 244.4056 4.725973 728.3152       28.14741 726.3342       49.08216 729.2859       34.35868 243.7648 8.274590 244.5284 5.765953 -0.7635345     10.08539 
1 1 1 5   4  20 o 282.4730 6.332257 973.6714       43.58847 948.5681       60.46285 1000.836       62.89592 278.4605 8.921744 286.0227 9.035058 -7.562195      12.69763 
1 1 1 5   4  21 o 533.8705 9.050505 3486.627       117.7456 3596.152       207.3984 3434.536       143.0311 539.7861 15.78390 529.3413 11.08814 10.44476       19.28933 
1 1 1 5   4  22 o 111.9019 2.979212 152.7670       8.116864 149.1218       11.21762 156.7729       11.75951 110.4897 4.173729 113.2864 4.267291 -2.796707      5.969069 
1 1 1 5   4  23 o 245.2209 4.118160 733.6831       24.60916 734.1148       34.71106 733.2468       34.89488 245.1289 5.810817 244.9800 5.845141 0.1488647      8.242043 
1 1 1 5   4  24 o 281.3481 4.554697 966.5085       31.22766 972.9661       44.21565 960.0818       44.10970 281.9921 6.434324 280.1137 6.461950 1.878387       9.119063 
1 1 1 5   4  25 o 82.98151 3.090460 84.11609       6.238514 85.53432       8.687360 82.60597       8.964342 83.58219 4.279431 82.11409 4.497029 1.468102       6.207802 
1 1 1 5   4  26 o 134.1963 4.369469 220.2564       14.27006 220.2564       14.27006 0.000000       0.000000 134.1963 4.369469 ?        ?        0.000000       4.369469 
1 1 1 5   4  27 o 107.7641 3.062818 141.8289       8.035087 136.4315       11.06727 147.8451       11.68449 105.5702 4.310998 109.8974 4.371735 -4.327187      6.139770 
1 1 1 5   4  28 o 161.8611 3.341722 319.8929       13.18102 324.9250       18.61169 314.8291       18.66999 162.8962 4.693444 160.3279 4.783931 2.568329       6.701822 
1 1 1 5   4  29 o 146.6555 3.271019 262.6624       11.69008 258.4940       16.28868 267.0897       16.78711 145.2516 4.607642 147.6379 4.671851 -2.386292      6.561749 
1 1 1 5   4  30 o 94.08047 3.142098 108.2273       7.193588 108.0442       10.01506 108.4225       10.33923 93.84356 4.391562 93.98789 4.527508 -0.1443329     6.307468 
1 1 1 5   4  31 o 42.63472 5.604342 22.71500       5.681840 51.87566       11.26055 12.75484       6.581037 64.37727 7.306893 31.49725 8.414337 32.88001       11.14414 
1 1 1 5   4  32 f 101.6391 3.260272 126.4214       8.064704 124.8457       11.32847 128.0405       11.48354 100.7811 4.625038 102.0644 4.629109 -1.283211      6.543671 
1 1 1 5   4  33 o 37.09447 5.307368 17.26840       4.661043 14.49749       6.415593 20.36593       6.783177 33.45827 7.980785 39.92282 7.238782 -6.464554      10.77464 
1 1 1 5   4  34 o 53.95399 4.152870 35.93746       5.418208 36.56223       7.523750 35.26439       7.809227 54.09519 5.797757 53.03141 6.157126 1.063778       8.457197 
1 1 1 5   4  35 o 98.85909 3.270464 119.8417       7.867992 120.5000       10.78485 119.0927       11.50398 98.85426 4.488664 98.18423 4.822822 0.6700287      6.588453 
1 1 1 5   4  36 o 35.42455 5.744638 15.97424       4.789392 17.89568       6.320428 13.38309       7.339742 37.14029 7.243628 31.88738 9.035182 5.252909       11.58036 
1 1 1 5   4  37 o 47.89370 6.005945 29.14084       6.855921 29.14084       6.855921 0.000000       0.000000 47.89370 6.005945 ?        ?        0.000000       6.005945 
1 1 1 5   4  38 o 78.83318 3.529849 76.83286       6.763917 77.16014       9.330341 76.47035       9.819654 78.47873 4.903259 77.99505 5.196093 0.4836807      7.144321 
1 1 1 5   4  39 o 46.04918 4.549321 26.79616       5.038476 27.81010       6.868847 25.61515       7.413210 46.21251 6.260259 43.89141 7.178860 2.321098       9.525065 
1 1 1 5   4  40 o 16.45092 6.630556 2.033536       4.088664 2.339996       5.509051 1.657730       6.100578 18.48650 7.603804 18.60973 7.853480 -0.1232262     10.93138 
1 1 1 5   4  41 o 31.94988 6.404706 14.02302       4.812809 15.24972       5.853325 11.46277       8.456165 32.71438 7.502371 27.74125 9.903637 4.973125       12.42448 
1 1 1 5   4  42 o 13.53243 6.211874 -2.068496      4.663638 -0.2498180     8.631181 -2.818393      5.542338 19.04229 8.628435 14.37748 6.660977 4.664813       10.90039 
1 1 1 5   4  43 o 34.14509 6.169248 16.75701       4.944421 25.18103       7.352604 9.802593       6.680545 40.34902 7.759514 24.32684 8.788089 16.02218       11.72351 
1 1 1 5   4  44 o 11.83104 5.472981 -1.583030      3.720764 2.329224       5.058939 -6.193005      5.491554 16.28167 7.018330 12.12649 5.891084 4.155180       9.163069 
1 1 1 5   4  45 o 11.80727 5.433894 -0.9839117     3.600447 -8.397284      4.802386 8.531343       5.440757 10.20831 5.064915 21.42850 7.901141 -11.22020      9.385169 
1 1 1 5   4  46 o 13.03206 5.753724 1.038516       3.579846 7.548247       5.143964 -5.075354      4.985107 19.65115 7.583823 11.32408 5.526123 8.327065       9.383625 
1 1 1 5   4  47 o 15.12780 6.800839 3.190324       5.240564 3.190324       5.240564 0.000000       0.000000 15.12780 6.800839 ?        ?        0.000000       6.800839 
1 1 1 5   4  48 o 12.53236 5.642790 1.456952       3.623625 -2.066674      4.950127 5.525107       5.318880 11.65845 5.647092 15.91091 7.019546 -4.252460      9.009089 
1 1 1 5   4  49 o 19.50105 6.747924 8.588346       3.904333 11.22767       5.539545 5.983023       5.503751 19.50436 7.766431 15.47667 6.962600 4.027684       10.43050 
1 1 1 5   5  0  o 468.4080 5.590253 2675.426       63.81046 2643.892       89.53011 2707.983       90.97037 465.4594 7.893166 471.0643 7.924715 -5.604980      11.18495 
1 1 1 5   5  1  o 423.4842 6.246981 2187.356       64.46789 2202.300       91.29706 2172.493       91.04619 424.7151 8.821104 421.8278 8.857079 2.887390       12.50039 
1 1 1 5   5  2  o 580.9410 8.408506 4120.167       119.0384 4278.167       172.4059 3976.221       164.5595 591.3872 11.96311 570.1580 11.84381 21.22919       16.83425 
1 1 1 5   5  3  o 495.2619 8.349150 2994.906       100.7658 3051.592       124.7919 2888.697       170.8163 499.6629 10.24881 485.1777 14.46364 14.48520       17.72667 
1 1 1 5   5  4  o 217.0230 3.549618 574.1105       18.77256 581.3176       21.67479 552.4738       37.55502 218.3668 4.073165 212.6327 7.258367 5.734116       8.323134 
1 1 1 5   5  5  o 432.8920 6.398245 2286.500       67.49577 2329.787       78.83278 2167.625       130.6380 436.8672 7.404935 420.4261 12.76578 16.44116       14.75799 
1 1 1 5   5  6  o 487.8786 7.130717 2905.385       84.77760 2901.743       119.7288 2909.048       120.0592 487.1390 10.08578 487.7492 10.10096 -0.6102295     14.27419 
1 1 1 5   5  7  o 443.3912 7.552339 2400.065       81.60272 2501.464       145.7237 2353.743       98.49400 451.5597 13.25713 438.8844 9.209233 12.67523       16.14192 
1 1 1 5   5  8  o 331.0766 5.024251 1336.610       40.53554 1362.129       57.96579 1312.188       56.70677 334.0898 7.119878 327.9097 7.096505 6.180054       10.05251 
1 1 1 5   5  9  o 164.0559 3.003709 328.0173       12.00842 325.8754       16.88644 330.2086       17.08016 163.4444 4.243258 164.5272 4.263675 -1.082870      6.015327 
1 1 1 5   5  10 o 654.0551 10.89006 5226.673       173.5724 5230.176       212.8770 5219.726       299.8067 653.8221 13.36082 651.5605 18.90209 2.261597       23.14736 
1 1 1 5   5  11 o 1143.630 18.87558 16047.99       526.0438 16022.47       643.6770 16099.29       912.8174 1140.711 23.15561 1136.888 32.98295 3.823120       40.29959 
1 1 1 5   5  12 o 578.9367 9.685500 4090.553       136.6436 4099.437       236.2164 4086.086       167.5159 578.3764 16.77732 578.3804 11.88520 -0.4028320E-02 20.56055 
1 1 1 5   5  13 o 444.1028 6.564786 2404.844       71.04610 2377.688       99.69324 2432.869       101.2741 441.4299 9.267612 446.5201 9.307249 -5.090210      13.13444 
1 1 1 5   5  14 o 80.51320 2.621113 79.07726       5.135819 75.67306       7.105569 82.80112       7.431693 78.71058 3.714984 82.34224 3.713196 -3.631660      5.252516 
1 1 1 5   5  15 o 673.5269 11.23276 5540.261       184.3645 5544.407       225.7151 5531.950       319.5681 673.3865 13.75498 671.1539 19.56000 2.232666       23.91220 
1 1 1 5   5  16 o 87.45033 2.748085 93.28767       5.849091 103.5551       8.343431 83.36513       8.202106 92.10152 3.725107 82.60092 4.087479 9.500603       5.530272 
1 1 1 5   5  17 o 330.2664 5.089610 1329.813       40.96236 1335.074       57.99409 1324.575       57.86517 330.8218 7.193720 329.5178 7.206132 1.303986       10.18224 
1 1 1 5   5  18 o 538.0372 7.869415 3532.975       103.1789 3699.699       150.3749 3384.653       141.8334 550.1227 11.21708 526.2031 11.06086 23.91968       15.75327 
1 1 1 5   5  19 o 402.8820 6.981579 1980.761       68.54372 2095.530       122.1093 1927.961       82.82312 413.5715 12.12918 397.3226 8.554058 16.24887       14.84214 
1 1 1 5   5  20 o 372.4937 8.040504 1694.979       72.98579 0.000000       0.000000 1694.979       72.98579 ?        ?        372.4937 8.040504 0.000000       8.040504 
1 1 1 5   5  21 o 256.8048 4.855174 804.5311       30.38393 790.9254       36.92049 833.0819       53.48294 254.5459 5.952031 260.8674 8.424210 -6.321472      10.31475 
1 1 1 5   5  22 o 231.8672 3.952009 655.7442       22.33024 647.1243       31.19970 664.7973       31.97399 230.2214 5.561201 233.3385 5.623079 -3.117157      7.908602 
1 1 1 5   5  23 o 123.8770 3.011782 187.1193       9.091809 187.1197       12.63328 187.1189       13.09465 123.7621 4.194890 123.7497 4.349000 0.1235962E-01  6.042425 
1 1 1 5   5  24 o 86.31825 2.982546 90.97791       6.264305 84.26398       8.519527 98.88007       9.242727 82.97536 4.227307 89.90085 4.230779 -6.925491      5.980770 
1 1 1 5   5  25 o 194.7267 4.124968 463.0153       19.57412 444.5927       23.44862 505.3602       35.55022 190.6445 5.051726 202.8631 7.202659 -12.21861      8.797626 
1 1 1 5   5  26 o 262.4637 4.348973 841.6734       27.81583 824.7580       38.70902 859.7338       39.99767 259.4620 6.122128 264.8888 6.196337 -5.426819      8.710628 
1 1 1 5   5  27 o 56.15221 4.012245 38.71590       5.454049 40.46132       6.427567 34.22724       10.30756 57.33810 4.639699 52.05925 8.411675 5.278851       9.606409 
1 1 1 5   5  28 o 105.9036 3.077715 137.0204       7.934401 129.8798       10.80903 145.3637       11.68384 102.9701 4.317219 108.9330 4.410510 -5.962967      6.171789 
1 1 1 5   5  29 o 99.06201 3.079962 119.9337       7.426098 117.5507       10.10192 122.7355       10.95393 97.93796 4.242757 100.0422 4.504701 -2.104240      6.188159 
1 1 1 5   5  30 o 78.92429 3.202437 76.21658       6.146452 74.85920       8.454290 77.73843       8.951824 78.06262 4.462841 79.52874 4.639179 -1.466118      6.437308 
1 1 1 5   5  31 o 144.0346 3.265459 253.5453       11.46165 249.5243       15.92178 257.8703       16.51282 142.6058 4.587584 144.9528 4.680887 -2.347061      6.554130 
1 1 1 5   5  32 o 40.52001 6.947455 20.85969       6.613319 0.000000       0.000000 20.85969       6.613319 ?        ?        40.52001 6.947455 0.000000       6.947455 
1 1 1 5   5  33 o 16.25406 6.629858 1.265661       4.144339 1.398097       5.570268 1.101454       6.202544 18.52978 7.636279 19.16700 7.992295 -0.6372185     11.05394 
1 1 1 5   5  34 o 37.22612 5.257192 17.41239       4.636516 17.56544       6.292159 17.23055       6.858423 36.94462 7.247975 36.43652 7.948339 0.5080948      10.75682 
1 1 1 5   5  35 o 48.77965 4.462721 29.52368       5.246157 31.02901       6.992671 27.58547       7.934661 49.69770 5.888187 46.45557 7.245289 3.242130       9.336218 
1 1 1 5   5  36 o 120.2499 3.742302 177.9230       10.95294 176.1828       13.13306 181.8987       19.85061 119.3925 4.522083 120.2527 6.801696 -0.8601379     8.167760 
1 1 1 5   5  37 o 52.25003 4.192207 33.94300       5.293083 35.08318       7.081570 32.49965       7.967624 52.72359 5.597151 50.36619 6.654267 2.357403       8.695251 
1 1 1 5   5  38 o 49.14947 4.840321 30.43311       5.722196 33.06837       6.818614 24.15764       10.52223 50.98678 5.578809 41.44014 10.42915 9.546642       11.82753 
1 1 1 5   5  39 o 66.94384 3.660266 55.78516       5.948450 57.95020       8.131503 53.29282       8.724526 67.64125 4.967788 64.51957 5.604541 3.121681       7.489312 
1 1 1 5   5  40 o 50.45258 4.257371 32.26609       5.185526 30.78908       6.797101 34.32276       8.020756 48.44718 5.877362 50.70010 6.652196 -2.252914      8.876660 
1 1 1 5   5  41 o 20.97868 6.848226 5.970167       4.024358 5.359290       5.230280 6.856645       6.300605 20.76892 7.730350 22.85142 8.488540 -2.082500      11.48101 
1 1 1 5   5  42 o 14.42345 6.707574 -3.068991      5.701925 0.000000       0.000000 -3.068991      5.701925 ?        ?        14.42345 6.707574 0.000000       6.707574 
1 1 1 5   5  43 o 26.98306 6.297160 10.70370       4.064787 10.62344       5.371982 10.81120       6.217138 25.69637 7.853225 25.42057 8.520270 0.2758026      11.58741 
1 1 1 5   5  44 o 30.46450 6.081325 13.94112       4.356468 12.81068       5.640164 15.61298       6.859118 27.09822 7.994434 28.82424 8.885940 -1.726023      11.95286 
1 1 1 5   5  45 o 13.73403 5.908751 1.474504       3.572515 -3.501149      4.685146 8.386290       5.521959 11.87533 5.685688 21.14917 7.928654 -9.273841      9.756568 
1 1 1 5   5  46 f 12.02746 5.872700 -5.055066      5.653001 -3.164016      7.856373 -7.085262      8.140285 14.42357 7.015970 13.52911 6.691439 0.8944578      9.695318 
1 1 1 5   5  47 o 12.57109 5.703052 0.8142158      3.784441 5.894769       5.129951 -5.252247      5.605644 17.02221 7.193521 11.48715 5.657133 5.535056       9.151497 
1 1 1 5   5  48 o 13.53697 5.855824 2.732231       3.546351 0.6053401      4.769886 5.361078       5.302958 12.72186 5.986420 15.73909 6.973267 -3.017225      9.190413 
1 1 1 5   5  49 o 11.69650 5.357765 0.9863621      3.444613 -2.635514      4.666894 5.320891       5.105427 10.85765 5.308904 15.11557 6.760262 -4.257915      8.595675 
1 1 1 5   6  0  o 264.5980 3.394527 853.3392       21.88779 867.6370       31.23207 839.5396       30.68324 266.7615 4.804425 262.4068 4.798329 4.354736       6.790174 
1 1 1 5   6  1  o 76.70470 2.009461 71.74639       3.752870 69.03420       5.755110 73.75291       4.950112 75.19435 3.147703 77.74933 2.616384 -2.554977      4.093104 
1 1 1 5   6  2  o 187.4595 3.245993 428.3180       14.82829 425.8496       20.57909 430.9834       21.38485 186.8893 4.518620 188.0083 4.667594 -1.119080      6.496488 
1 1 1 5   6  3  o 206.4131 3.418252 519.3344       17.19403 532.9261       24.65344 506.4621       23.99209 209.0566 4.839246 203.8001 4.830895 5.256500       6.837825 
1 1 1 5   6  4  o 306.3648 6.711039 1145.385       50.10311 1222.250       73.65910 1079.199       68.35123 316.0829 9.573929 297.0078 9.455753 19.07516       13.45628 
1 1 1 5   6  5  o 235.6147 5.472039 677.1177       31.41866 662.9470       43.87860 692.0276       45.00832 232.8867 7.742408 237.9424 7.772633 -5.055634      10.97081 
1 1 1 5   6  6  o 182.9867 4.656946 408.5506       20.74932 447.2479       30.66230 375.8600       28.18226 191.3354 6.585991 175.3808 6.605942 15.95468       9.328116 
1 1 1 5   6  7  o 252.5057 4.014100 777.2675       24.69991 800.0294       35.46621 755.8297       34.41921 256.1105 5.682655 248.9357 5.673849 7.174881       8.030263 
1 1 1 5   6  8  o 219.3197 5.113479 586.5242       27.32940 563.4966       38.81691 609.1591       38.48446 214.7544 7.428434 223.3234 7.080506 -8.569000      10.26232 
1 1 1 5   6  9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 5   6  10 o 900.7814 12.88458 9920.822       282.8302 10007.88       402.3879 9835.817       397.6194 903.1454 18.28316 895.3682 18.22342 7.777161       25.81408 
1 1 1 5   6  11 o 236.2868 3.848438 680.4602       22.15950 677.7100       31.17596 683.2685       31.50314 235.7772 5.426027 236.7413 5.460641 -0.9641113     7.698076 
1 1 1 5   6  12 o 288.5374 4.510210 1014.753       31.71283 1035.551       45.31012 994.7809       44.40112 291.4291 6.380081 285.6347 6.378917 5.794434       9.021974 
1 1 1 5   6  13 o 425.4453 7.270751 2207.392       75.38051 2305.955       133.2384 2160.992       91.41769 434.2720 12.60350 420.8560 8.913753 13.41599       15.43707 
1 1 1 5   6  14 o 396.4777 5.931684 1916.519       57.31033 1926.072       81.22157 1907.047       80.87764 397.3415 8.388250 395.3738 8.394300 1.967682       11.86706 
1 1 1 5   6  15 o 243.9155 4.642173 725.2101       27.59286 756.3473       34.29068 668.0141       46.47493 249.0721 5.649564 233.8564 8.167715 15.21565       9.931221 
1 1 1 5   6  16 o 197.3967 3.487601 474.8943       16.77655 470.9982       23.53877 478.9165       23.91701 196.4989 4.919594 198.2051 4.951719 -1.706207      6.980109 
1 1 1 5   6  17 o 917.8884 13.15198 10307.97       294.1826 10516.71       421.7481 10110.16       410.5519 925.1942 18.70614 907.1896 18.57094 18.00464       26.35905 
1 1 1 5   6  18 o 175.8280 3.746709 376.8361       16.05367 358.7482       26.10505 387.8369       20.35833 171.3823 6.261133 178.2947 4.689697 -6.912415      7.822727 
1 1 1 5   6  19 o 168.4245 3.701372 345.7947       15.19162 347.9588       25.18343 344.5567       19.04760 168.7713 6.133425 168.0357 4.656092 0.7356262      7.700526 
1 1 1 5   6  20 o 251.3313 4.845509 770.4406       29.67713 824.7550       53.98016 746.9120       35.52827 259.6234 8.543705 247.4038 5.892934 12.21956       10.37890 
1 1 1 5   6  21 o 232.5647 3.940192 659.5837       22.33044 635.3842       30.77455 686.4935       32.45222 228.1625 5.534920 237.1556 5.615326 -8.993118      7.884620 
1 1 1 5   6  22 o 268.2145 5.019257 878.1028       32.80634 843.7861       39.30844 956.8694       59.55314 262.8053 6.137840 279.3421 8.759296 -16.53680      10.69572 
1 1 1 5   6  23 o 266.1098 4.358775 864.3026       28.26580 840.7852       39.10415 890.0350       40.90436 262.2484 6.118909 269.8046 6.221343 -7.556244      8.726176 
1 1 1 5   6  24 o 352.3965 6.268629 1519.711       53.83197 1499.256       65.35320 1562.878       94.93940 349.6393 7.670267 355.6148 10.96857 -5.975464      13.38441 
1 1 1 5   6  25 o 132.2276 3.067009 213.2990       9.882648 215.6876       13.76566 210.7583       14.19666 132.8219 4.258461 131.2738 4.444251 1.548111       6.155148 
1 1 1 5   6  26 o 107.1275 3.946627 140.3482       10.28538 139.6082       13.89269 141.2457       15.30044 106.6788 5.361254 107.2314 5.877736 -0.5525284     7.955553 
1 1 1 5   6  27 o 84.97926 3.536427 88.32967       7.307412 83.77165       8.588107 100.2856       13.90916 82.67849 4.277083 90.19019 6.369538 -7.511703      7.672318 
1 1 1 5   6  28 o 142.7480 3.193399 248.7836       11.10860 245.9478       15.35169 251.9005       16.09447 141.7286 4.450422 143.4096 4.611344 -1.680969      6.408646 
1 1 1 5   6  29 o 30.59230 5.508023 11.82667       3.955247 13.58442       5.277951 9.575079       5.973537 32.61848 6.857939 27.64518 8.245361 4.973303       10.72461 
1 1 1 5   6  30 o 38.57574 4.722278 18.50243       4.346707 18.61930       5.795528 18.35217       6.571723 38.38715 6.422100 37.92009 7.377324 0.4670601      9.781015 
1 1 1 5   6  31 o 91.42964 3.544735 102.3783       7.882851 96.77147       12.26703 106.3222       10.28827 88.52026 5.717282 93.02419 4.552303 -4.503929      7.308268 
1 1 1 5   6  32 o 81.63332 4.081318 81.84286       8.093276 69.67489       14.10442 87.81599       9.882051 74.46951 7.892124 84.43806 4.822615 -9.968552      9.248959 
1 1 1 5   6  33 o 88.70615 3.253751 96.39134       7.021624 97.06612       9.573590 95.60579       10.32960 88.81372 4.437481 88.06083 4.832060 0.7528915      6.560491 
1 1 1 5   6  34 o 12.27686 5.657532 -2.989634      3.921272 -3.168873      5.209963 -2.755423      5.955558 14.58960 6.647148 16.08448 7.238819 -1.494884      9.827770 
1 1 1 5   6  35 f 114.4294 3.275362 160.5852       9.124013 162.0500       12.44647 158.8837       13.41443 114.6333 4.464065 113.3786 4.866510 1.254692       6.603848 
1 1 1 5   6  36 o 55.07923 4.546480 37.71107       6.048082 38.67584       7.137583 35.25451       11.38948 55.58015 5.335261 51.63291 9.398049 3.947243       10.80687 
1 1 1 5   6  37 o 76.49834 3.443008 72.15623       6.401941 71.58248       8.490935 72.91206       9.745618 75.83744 4.616340 76.29860 5.273966 -0.4611588     7.008945 
1 1 1 5   6  38 o 37.08734 5.708337 17.72110       4.993862 15.38323       5.729064 25.11670       10.18967 34.01766 7.139011 42.35531 10.02841 -8.337646      12.30993 
1 1 1 5   6  39 o 35.18449 5.521139 16.07598       4.578198 21.62477       5.968088 8.141706       7.136577 40.60851 6.229424 25.39913 9.094647 15.20938       11.02354 
1 1 1 5   6  40 o 28.89683 6.386935 11.34518       4.377760 9.840117       5.686798 13.53452       6.858770 26.46493 8.078497 30.57457 8.757564 -4.109638      11.91457 
1 1 1 5   6  41 o 43.09077 5.091060 24.39863       5.242884 24.99053       7.650281 23.87445       7.199361 41.70420 7.814759 40.99875 7.481467 0.7054520      10.81863 
1 1 1 5   6  42 o 22.84826 6.659601 7.566271       3.934297 3.205153       4.993694 14.70333       6.388262 17.91535 7.288777 30.66002 8.333678 -12.74467      11.07143 
1 1 1 5   6  43 o 15.74364 6.348694 2.593354       3.750511 0.8933810      4.832386 5.168560       5.947666 15.35915 6.736376 19.68937 7.975101 -4.330225      10.43940 
1 1 1 5   6  44 o 13.67782 5.946189 0.9688527      3.693857 0.9530261      4.724714 0.9937363      5.924303 14.80622 6.569851 15.91670 7.186450 -1.110486      9.736940 
1 1 1 5   6  45 o 14.79275 6.869835 -0.1639136     5.949284 -6.691360      7.849377 8.647808       9.119981 13.90418 6.816572 20.46371 9.101245 -6.559530      11.37094 
1 1 1 5   6  46 f 21.67443 6.525968 8.292878       3.728706 7.229687       5.108623 9.505020       5.454751 19.07685 7.501554 21.16152 7.890969 -2.084671      10.88764 
1 1 1 5   6  47 o 14.54340 6.036907 3.321761       3.515830 5.153744       4.871086 1.329467       5.079743 16.32609 6.958765 13.76318 6.376572 2.562915       9.438490 
1 1 1 5   6  48 o 16.83360 6.714948 6.190528       4.148409 4.343111       5.076136 9.905565       7.198339 14.99679 6.721468 17.71772 7.967413 -2.720929      10.42391 
1 1 1 5   7  0  o 194.0831 2.711193 459.0759       12.82284 448.8127       17.95013 469.7713       18.32411 191.8784 3.838886 196.3077 3.830448 -4.429260      5.423041 
1 1 1 5   7  1  o 77.72524 2.233394 73.68170       4.225840 77.06160       6.065205 70.49308       5.891080 79.45248 3.138754 75.98294 3.188667 3.469543       4.474301 
1 1 1 5   7  2  o 438.6888 5.777672 2347.508       61.76545 2404.571       99.07412 2311.230       78.99589 443.6111 9.164773 435.1240 7.449983 8.487091       11.81081 
1 1 1 5   7  3  o 366.4463 7.762699 1639.600       69.32011 1648.780       97.54693 1630.235       98.52729 366.9340 10.92127 364.8335 11.09509 2.100494       15.56840 
1 1 1 5   7  4  o 227.1241 5.225583 629.1287       28.92238 601.7819       39.04812 662.3661       43.04876 221.9209 7.230126 232.8018 7.598368 -10.88094      10.48856 
1 1 1 5   7  5  o 303.4518 6.689065 1123.668       49.46422 1192.244       72.46014 1063.825       67.68925 312.1883 9.535771 294.8928 9.431444 17.29547       13.41205 
1 1 1 5   7  6  o 104.5390 5.278510 133.6119       13.40349 133.6119       13.40349 0.000000       0.000000 104.5390 5.278510 ?        ?        0.000000       5.278510 
1 1 1 5   7  7  o 628.3826 10.53759 4826.596       161.3621 4914.369       200.3739 4664.646       272.1752 633.5488 12.97851 615.5596 18.16426 17.98920       22.32447 
1 1 1 5   7  8  o 621.2795 10.39841 4715.728       157.4310 4202.849       252.7061 5041.030       201.2573 584.7569 17.75447 641.8932 12.86627 -57.13629      21.92629 
1 1 1 5   7  9  o 603.2777 10.09830 4444.201       148.4574 4614.242       264.3551 4365.871       179.4220 613.0662 17.71331 597.6177 12.32015 15.44843       21.57655 
1 1 1 5   7  10 o 450.1220 6.627466 2470.739       72.69656 2393.435       100.5410 2555.432       105.2366 442.8452 9.316549 457.5768 9.437711 -14.73154      13.26154 
1 1 1 5   7  11 o 441.1434 6.509583 2372.913       69.97920 2355.131       98.41806 2391.095       99.52225 439.3285 9.192832 442.6678 9.225845 -3.339325      13.02399 
1 1 1 5   7  12 o 350.9876 5.312714 1501.735       45.44062 1477.707       63.53843 1526.890       65.01238 348.0878 7.490513 353.8310 7.539875 -5.743134      10.62815 
1 1 1 5   7  13 o 330.3340 5.055632 1330.155       40.69723 1364.504       58.36481 1297.649       56.77717 334.4986 7.160127 326.2019 7.142515 8.296722       10.11350 
1 1 1 5   7  14 o 556.0431 9.324203 3773.214       126.3445 3775.335       217.8193 3772.139       155.1026 555.0952 16.11955 555.7400 11.45279 -0.6447754     19.77389 
1 1 1 5   7  15 o 308.5473 4.795520 1160.509       36.05733 1168.965       51.12040 1152.137       50.86608 309.5988 6.775774 307.3616 6.791139 2.237183       9.593263 
1 1 1 5   7  16 o 352.1967 6.211563 1512.677       53.31167 1544.866       65.86446 1451.524       90.78386 355.8494 7.595368 344.5370 10.82620 11.31232       13.22483 
1 1 1 5   7  17 o 301.9268 5.422009 1111.559       39.89313 1165.915       69.89381 1085.295       48.58430 308.8595 9.296863 298.2809 6.683968 10.57852       11.45020 
1 1 1 5   7  18 o 294.4820 4.646275 1057.312       33.34262 1077.969       47.57113 1037.366       46.74687 297.2493 6.567295 291.5968 6.578604 5.652527       9.295558 
1 1 1 5   7  19 o 297.6595 4.693763 1080.434       34.04686 1102.857       48.59502 1058.815       47.71607 300.6107 6.633628 294.5461 6.647760 6.064667       9.391365 
1 1 1 5   7  20 o 143.8702 3.061334 252.3135       10.73291 241.6909       14.67942 264.5148       15.73250 140.7141 4.285897 147.2080 4.390518 -6.493881      6.135598 
1 1 1 5   7  21 o 127.7034 3.591279 199.0181       11.16494 174.2572       19.25605 211.5580       13.70354 119.2457 6.652942 131.6264 4.277903 -12.38066      7.909620 
1 1 1 5   7  22 o 66.88107 3.098881 54.65876       5.036885 51.15680       6.784862 58.95826       7.517864 64.60512 4.334694 69.36533 4.471317 -4.760216      6.227540 
1 1 1 5   7  23 o 190.6615 4.010682 443.6119       18.63448 433.1881       22.57992 465.8712       32.99647 188.2703 4.925810 194.9621 6.956292 -6.691788      8.523708 
1 1 1 5   7  24 o 184.2072 3.463504 414.0285       15.54743 410.2446       21.58630 418.1073       22.41168 183.1775 4.840057 184.9075 4.978279 -1.729980      6.943300 
1 1 1 5   7  25 o 104.9680 2.948196 134.5171       7.533885 146.8351       10.58900 121.8895       10.72128 109.5873 3.971709 99.78800 4.419885 9.799332       5.942209 
1 1 1 5   7  26 o 160.4830 3.282282 314.3330       12.83634 311.2708       17.82027 317.6354       18.50577 159.5070 4.589338 161.1121 4.718576 -1.605148      6.582324 
1 1 1 5   7  27 o 144.8445 3.166873 256.0857       11.17812 257.6495       15.55669 254.4165       16.07243 145.0992 4.404728 144.1595 4.580932 0.9396820      6.355042 
1 1 1 5   7  28 o 102.1776 3.462140 127.6653       8.608128 126.8267       10.21689 129.7171       15.98138 101.7643 4.128474 102.5525 6.427190 -0.7881927     7.638918 
1 1 1 5   7  29 o 68.25095 3.295057 57.03222       5.464151 58.04631       7.316859 55.75357       8.216018 68.72935 4.391616 67.25977 5.049544 1.469582       6.692100 
1 1 1 5   7  30 o 44.24405 4.633164 24.24369       4.921393 19.54759       7.128179 28.52110       6.803004 39.08562 7.757665 47.79838 5.970354 -8.712753      9.789101 
1 1 1 5   7  31 o 68.76822 3.441317 57.96747       5.748655 63.07612       7.896220 52.20615       8.385473 71.58758 4.549867 64.96778 5.343751 6.619797       7.018331 
1 1 1 5   7  32 o 91.38023 3.925298 102.4623       8.720614 112.3677       16.24330 98.45104       10.33662 94.98053 7.068519 89.42181 4.760658 5.558716       8.522196 
1 1 1 5   7  33 o 43.28178 4.572210 23.26200       4.749642 23.97561       6.264249 22.29696       7.284664 43.64950 6.051756 41.73943 7.434482 1.910069       9.586203 
1 1 1 5   7  34 o 72.86411 3.447554 65.18415       6.104181 64.84248       8.294560 65.58781       9.015689 72.43197 4.725026 72.76043 5.117362 -0.3284607     6.965147 
1 1 1 5   7  35 o 38.64584 5.575360 18.87105       5.098980 17.94721       5.948183 21.43141       9.902309 37.36657 6.781983 40.05560 10.13753 -2.689034      12.19692 
1 1 1 5   7  36 o 51.14065 4.145290 32.44724       5.121784 38.84092       6.794985 24.03547       7.793929 55.75464 5.056084 42.95866 7.729255 12.79599       9.236091 
1 1 1 5   7  37 o 72.23336 3.450221 64.38699       6.055687 63.78843       7.968937 65.20502       9.316062 71.54881 4.594768 72.06434 5.342890 -0.5155258     7.046869 
1 1 1 5   7  38 o 43.24054 4.579380 23.58245       4.752155 22.40899       6.082707 25.42064       7.613072 41.56761 6.193723 43.80090 7.395542 -2.233288      9.646566 
1 1 1 5   7  39 o 43.96091 5.109406 24.77501       5.371738 25.60120       6.119157 21.99920       11.21624 44.39293 5.794599 38.20273 11.27451 6.190197       12.67644 
1 1 1 5   7  40 o 38.80974 4.841639 19.48039       4.479669 20.90342       5.784019 17.34731       7.081524 39.52646 6.209389 34.67812 8.456913 4.848343       10.49170 
1 1 1 5   7  41 o 31.43481 6.425897 13.74139       4.756121 18.57064       6.931733 9.445333       6.537874 35.41212 8.195018 25.34630 8.733771 10.06581       11.97652 
1 1 1 5   7  42 o 30.76054 5.802616 13.20884       4.190197 20.71741       5.692606 4.329992       6.190294 38.26997 6.324775 19.69964 8.076860 18.57033       10.25858 
1 1 1 5   7  43 o 26.84356 7.705719 11.71603       5.304561 8.957843       9.554345 12.94507       6.377838 23.05890 9.784098 27.33869 8.590922 -4.279793      13.02046 
1 1 1 5   7  44 o 18.05350 7.223415 4.790687       4.815130 -10.29310      8.667498 11.52393       5.790961 14.01471 6.926697 25.04695 8.217279 -11.03224      10.74722 
1 1 1 5   7  45 o 26.19831 7.044513 11.85511       4.594279 13.71216       5.463356 7.370700       8.489848 27.15622 7.827893 19.61991 8.750079 7.536310       11.74052 
1 1 1 5   7  46 o 16.42344 6.418828 4.521617       3.721086 3.961977       5.024278 5.201544       5.537964 16.08455 6.963929 17.11163 7.359235 -1.027082      10.13186 
1 1 1 5   7  47 o 21.93354 6.832486 9.563596       4.043225 11.12204       5.481464 7.703795       5.988026 21.32903 7.918574 17.83254 7.660615 3.496485       11.01766 
1 1 1 5   7  48 o 12.82542 5.861897 1.628072       4.093273 0.8512552      4.924062 3.365436       7.363929 12.83490 6.052771 14.65714 7.046464 -1.822235      9.289171 
1 1 1 5   8  0  o 499.2537 6.521101 3041.481       79.33746 3054.212       125.7554 3033.064       102.2555 499.7460 10.32621 498.3188 8.420608 1.427185       13.32431 
1 1 1 5   8  1  o 166.8042 3.456971 339.1550       14.05203 359.4750       24.59725 329.3102       17.12092 171.5608 5.892200 164.2919 4.280009 7.268875       7.282616 
1 1 1 5   8  2  o 191.1802 3.271961 445.5021       15.24359 455.4277       21.78142 435.9741       21.34071 193.2632 4.624884 189.0903 4.631306 4.172882       6.545116 
1 1 1 5   8  3  o 628.4755 10.48524 4830.347       160.5842 4842.346       197.3673 4806.845       276.2114 628.6685 12.88301 624.4000 18.17209 4.268555       22.27548 
1 1 1 5   8  4  o 666.7643 13.63181 5449.628       221.4941 5449.628       221.4941 0.000000       0.000000 666.7643 13.63181 ?        ?        0.000000       13.63181 
1 1 1 5   8  5  o 256.0465 5.734443 799.6068       35.78048 806.2889       51.90034 793.5543       49.39505 256.8406 8.303123 254.8341 7.963852 2.006500       11.50499 
1 1 1 5   8  6  o 448.6237 7.660409 2456.291       83.74721 2342.528       140.9199 2518.408       104.1307 437.2058 13.24193 454.0724 9.410603 -16.86664      16.24525 
1 1 1 5   8  7  o 307.6534 5.488900 1154.119       41.15125 1165.270       72.38976 1148.795       50.01942 308.7495 9.633107 306.8879 6.688408 1.861633       11.72738 
1 1 1 5   8  8  o 442.5908 6.525295 2388.960       70.37827 2372.418       99.01310 2405.853       100.0549 440.8548 9.216393 443.9477 9.248480 -3.092865      13.05666 
1 1 1 5   8  9  o 131.0512 3.826834 209.4976       12.20819 0.000000       0.000000 209.4976       12.20819 ?        ?        131.0512 3.826834 0.000000       3.826834 
1 1 1 5   8  10 o 229.3981 3.763895 641.3451       21.04086 636.0750       29.53639 646.7750       29.98112 228.4261 5.306103 230.3386 5.341276 -1.912521      7.528875 
1 1 1 5   8  11 o 794.3856 11.39046 7705.391       220.5000 7484.025       305.4904 7946.149       318.5902 782.0756 16.02923 805.8183 16.22405 -23.74274      22.80693 
1 1 1 5   8  12 o 521.6002 7.612200 3318.194       96.75737 3248.454       134.8237 3392.259       138.9404 515.8441 10.72535 527.1298 10.81620 -11.28571      15.23231 
1 1 1 5   8  13 o 691.3675 9.960109 5834.222       167.8066 5708.467       233.8631 5967.685       240.9232 683.2864 14.04504 698.6096 14.15168 -15.32318      19.93823 
1 1 1 5   8  14 o 646.3712 9.339371 5099.077       147.1078 4950.908       203.7871 5260.300       212.5747 636.3934 13.14059 655.9509 13.29855 -19.55743      18.69563 
1 1 1 5   8  15 o 265.8158 4.868530 861.3559       31.53660 859.0912       53.22447 862.5812       39.14890 265.2161 8.245238 265.9694 6.040207 -0.7532349     10.22096 
1 1 1 5   8  16 o 364.5213 7.793837 1621.329       69.23254 1653.149       97.54381 1589.026       98.27954 367.6708 10.89894 360.4258 11.20312 7.245026       15.62999 
1 1 1 5   8  17 o 140.7992 2.954268 241.6071       10.13646 236.0013       14.03321 247.7227       14.65739 139.0785 4.145203 142.4898 4.225879 -3.411270      5.919523 
1 1 1 5   8  18 o 47.43531 3.271155 27.55621       3.758127 24.83531       4.965403 31.20506       5.750115 44.89686 4.603522 50.36625 4.740655 -5.469391      6.608043 
1 1 1 5   8  19 o 203.0156 3.579207 502.4506       17.70730 502.2907       24.83217 502.6161       25.25706 202.9317 5.021444 202.9295 5.111487 0.2212524E-02  7.165347 
1 1 1 5   8  20 f 280.3187 4.491021 958.4518       30.67844 975.9875       43.66545 941.3582       43.11157 282.7231 6.337831 277.6589 6.371565 5.064117       8.986932 
1 1 1 5   8  21 o 306.1075 5.631049 1144.106       42.00484 1247.720       77.34991 1100.769       50.02360 318.8029 9.968632 300.1045 6.840160 18.69833       12.08972 
1 1 1 5   8  22 o 289.9030 5.312009 1026.432       37.52732 987.7049       44.94851 1115.539       68.18090 284.2174 6.489758 301.3575 9.295316 -17.14011      11.33666 
1 1 1 5   8  23 o 43.01655 3.667431 22.74111       3.807816 20.98216       4.981663 25.21302       5.905587 41.13338 5.077526 45.08992 5.487482 -3.956543      7.476211 
1 1 1 5   8  24 o 67.16499 3.394257 55.18409       5.537498 53.91836       6.687605 57.94450       9.876178 66.32153 4.158835 68.55357 5.971368 -2.232040      7.276891 
1 1 1 5   8  25 o 116.7040 2.968187 166.2651       8.434520 164.2136       11.53344 168.6237       12.36651 115.8822 4.090606 117.4046 4.329824 -1.522408      5.956546 
1 1 1 5   8  26 o 58.94209 3.238945 42.52962       4.634390 41.15387       6.105428 44.39990       7.118660 57.86572 4.361821 60.05132 4.907269 -2.185600      6.565575 
1 1 1 5   8  27 o 90.31190 2.993359 99.65369       6.578689 101.3696       8.898376 97.58521       9.769922 90.98678 4.023200 89.21191 4.508608 1.774872       6.042655 
1 1 1 5   8  28 o 116.9044 3.531241 167.1087       10.04839 163.8882       11.82277 175.4879       19.07021 115.6866 4.200701 119.2908 6.585684 -3.604210      7.811346 
1 1 1 5   8  29 o 54.74835 3.909288 36.83991       5.181285 34.02788       7.372262 39.58458       7.283433 52.30796 5.885604 56.55730 5.348113 -4.249340      7.952525 
1 1 1 5   8  30 o 170.5249 3.444447 355.4535       14.31342 358.5359       19.95253 352.1854       20.54493 170.9389 4.794575 169.3696 4.983168 1.569305       6.915195 
1 1 1 5   8  31 o 166.1799 3.420492 337.6891       13.85170 344.3580       19.35142 330.6821       19.83610 167.4705 4.746537 164.0488 4.967615 3.421692       6.870722 
1 1 1 5   8  32 o 27.48872 6.252765 9.696715       4.093722 9.869539       5.311735 9.443897       6.424495 27.74273 7.623028 27.55411 8.617070 0.1886215      11.50498 
1 1 1 5   8  33 o 60.63986 4.700763 45.47313       6.892238 54.44413       12.96398 41.93844       8.137550 65.44711 8.316042 57.98442 5.838389 7.462696       10.16087 
1 1 1 5   8  34 o 46.94947 4.707502 27.40224       5.313305 25.43122       6.278073 32.37804       9.974984 44.95923 5.870291 50.08356 8.474967 -5.124332      10.30948 
1 1 1 5   8  35 f 79.95579 3.330434 78.53212       6.474926 75.64122       8.555979 82.40678       9.905366 78.20263 4.508762 81.49608 5.011914 -3.293449      6.741529 
1 1 1 5   8  36 o 35.16674 5.419706 15.72317       4.495549 14.85993       5.683698 17.16565       7.347178 33.71410 7.140555 35.92309 8.522208 -2.208996      11.11825 
1 1 1 5   8  37 o 56.20589 3.785031 39.17866       5.154038 48.25294       6.902144 27.74121       7.748950 62.15917 4.588976 46.17179 7.115245 15.98738       8.466723 
1 1 1 5   8  38 o 66.51115 3.636272 54.94339       5.871265 49.82534       7.529107 62.88501       9.378757 62.81475 4.958842 70.32814 5.516551 -7.513386      7.417712 
1 1 1 5   8  39 o 83.46849 3.848906 87.11524       7.807741 87.32655       9.191324 86.56754       14.79750 83.14826 4.553546 80.26849 7.657663 2.879768       8.909242 
1 1 1 5   8  40 o 12.48313 5.740630 -2.377212      4.007905 -6.644114      5.340886 3.122861       6.063749 12.54046 6.021627 19.51817 7.997199 -6.977712      10.01075 
1 1 1 5   8  41 o 50.27219 4.063106 32.42366       4.935245 38.12993       6.617066 25.27013       7.408835 53.78169 5.110205 41.90288 7.532423 11.87881       9.102285 
1 1 1 5   8  42 o 44.74981 4.415966 26.40076       4.752932 28.89267       6.317163 23.14986       7.215350 45.62775 5.813244 38.87717 7.886015 6.750580       9.797093 
1 1 1 5   8  43 o 11.25535 5.442046 -5.318081      4.545299 -5.482902      8.798168 -5.258077      5.308592 15.96548 7.682292 12.38171 5.960279 3.583772       9.723299 
1 1 1 5   8  44 o 18.27574 6.899322 5.200509       4.197224 0.5752722      4.790215 20.48934       8.709138 14.46844 6.503436 30.36362 10.08224 -15.89517      11.99776 
1 1 1 5   8  45 o 13.74927 5.875726 1.750091       3.489004 1.964117       4.789637 1.508124       5.092688 15.00588 6.638842 14.91148 6.703845 0.9439373E-01  9.434816 
1 1 1 5   8  46 o 12.29253 5.540075 0.5148338      3.502399 1.295584       4.736073 -0.4274816     5.203080 13.94276 6.346699 13.32081 6.263298 0.6219463      8.916809 
1 1 1 5   8  47 o 11.36715 5.287969 -0.3162796     3.548282 2.298966       4.768947 -3.559478      5.310715 13.98936 6.368213 11.58945 5.665981 2.399914       8.523936 
1 1 1 5   8  48 o 14.87601 6.199036 4.295932       3.727921 6.839108       5.153733 1.504972       5.398965 16.58012 7.114509 13.29850 6.291398 3.281625       9.497258 
1 1 1 5   9  0  o 405.9707 6.024559 2010.540       59.60134 2005.951       84.17015 2015.155       84.40839 405.2656 8.522799 406.1938 8.527392 -0.9281311     12.05631 
1 1 1 5   9  1  o 516.5881 6.738942 3256.396       84.83446 3196.908       132.3553 3297.878       110.5228 511.2872 10.62283 519.6080 8.728509 -8.320770      13.74887 
1 1 1 5   9  2  o 284.7052 4.432278 988.2466       30.75095 960.1745       42.70300 1018.483       44.31881 280.5470 6.246212 288.9371 6.294318 -8.390137      8.867558 
1 1 1 5   9  3  f 606.8647 8.778665 4497.754       129.8244 4523.404       184.1693 4472.419       183.0350 607.8862 12.43251 604.4521 12.42614 3.434082       17.57772 
1 1 1 5   9  4  o 373.6142 5.590849 1702.315       50.90228 1678.074       71.21282 1727.639       72.78636 370.7815 7.881412 376.2127 7.939268 -5.431183      11.18699 
1 1 1 5   9  5  o 151.5616 2.852745 279.9471       10.53630 272.4124       14.66376 287.9890       15.14925 149.4381 4.030369 153.6534 4.049409 -4.215286      5.713282 
1 1 1 5   9  6  o 324.4740 5.734355 1283.808       45.34200 1355.793       81.99078 1252.095       54.42090 333.0241 10.11479 320.3824 6.970452 12.64166       12.28398 
1 1 1 5   9  7  o 318.6750 7.020919 1238.649       54.52278 1339.430       80.82053 1154.475       73.86215 331.0580 10.02958 307.3446 9.874708 23.71335       14.07488 
1 1 1 5   9  8  o 262.6206 4.843342 840.7267       30.99632 818.5261       53.79581 851.7599       37.92435 258.8699 8.539367 264.3105 5.887998 -5.440643      10.37253 
1 1 1 5   9  9  o 175.4155 4.445978 375.2903       18.98983 0.000000       0.000000 375.2903       18.98983 ?        ?        175.4155 4.445978 0.000000       4.445978 
1 1 1 5   9  10 o 260.0810 4.138258 824.4137       26.22783 814.7688       36.81807 834.3508       37.37162 258.5192 5.844295 261.6069 5.862146 -3.087738      8.277714 
1 1 1 5   9  11 o 142.5114 2.860820 247.4937       9.935193 254.9363       14.20168 240.3598       13.90401 144.5724 4.034997 140.3739 4.068893 4.198578       5.730366 
1 1 1 5   9  12 o 253.4759 4.086840 783.0770       25.24413 797.6703       36.00143 768.9616       35.40716 255.7901 5.775637 251.1446 5.785370 4.645447       8.174870 
1 1 1 5   9  13 o 450.9629 6.663227 2479.957       73.22535 2647.087       108.0521 2338.011       99.57867 465.7119 9.520938 437.6940 9.335974 28.01794       13.33449 
1 1 1 5   9  14 o 337.7945 5.924003 1391.290       48.76451 1440.792       84.98695 1366.994       59.54126 343.3661 10.16805 334.7708 7.298513 8.595276       12.51629 
1 1 1 5   9  15 o 385.7113 6.660192 1814.510       62.60157 1772.874       105.4360 1837.180       77.79908 380.7321 11.37682 388.0126 8.227967 -7.280518      14.04035 
1 1 1 5   9  16 o 334.0242 5.966030 1360.675       48.56232 1383.149       59.76469 1317.001       83.31453 336.6967 7.283996 328.1505 10.43190 8.546143       12.72326 
1 1 1 5   9  17 o 455.9078 6.751678 2536.005       75.01098 2491.205       104.6640 2583.317       107.5583 451.5613 9.511400 459.8223 9.598821 -8.261017      13.51311 
1 1 1 5   9  18 f 297.8285 4.683385 1081.648       33.99086 1044.292       46.90944 1122.945       49.32193 292.5265 6.580500 303.3360 6.672369 -10.80945      9.371419 
1 1 1 5   9  19 o 382.6884 5.790010 1787.182       53.99590 1740.862       74.93951 1837.194       77.86814 377.4106 8.148182 387.6985 8.241943 -10.28790      11.58976 
1 1 1 5   9  20 o 101.2955 2.800053 125.1750       6.905195 131.7066       9.615539 118.2198       9.922538 103.8546 3.805808 98.36449 4.148820 5.490120       5.629999 
1 1 1 5   9  21 o 121.2383 3.248253 179.3627       9.588139 174.2525       11.69657 189.8311       16.74092 119.4493 4.024011 124.5577 5.529124 -5.108368      6.838412 
1 1 1 5   9  22 o 216.5670 4.435178 572.4965       23.40665 575.4836       41.57447 571.1104       28.32181 216.5685 7.890817 216.2134 5.375295 0.3550720      9.547711 
1 1 1 5   9  23 o 182.2664 3.411412 405.3066       15.15224 386.4526       20.65389 427.2805       22.29737 177.8028 4.771115 186.9495 4.898550 -9.146759      6.838079 
1 1 1 5   9  24 o 129.1636 2.995351 203.5151       9.428095 197.8265       12.84158 210.1669       13.88630 127.2100 4.148034 131.1002 4.352606 -3.890282      6.012600 
1 1 1 5   9  25 o 198.0406 4.107920 479.0714       19.82496 474.1612       24.18197 489.1364       34.62179 196.8344 5.045600 199.4845 7.133523 -2.650116      8.737576 
1 1 1 5   9  26 o 100.3286 2.938799 122.9299       7.177321 119.3408       9.682192 127.3079       10.69352 98.75053 4.031925 101.9674 4.313259 -3.216850      5.904288 
1 1 1 5   9  27 o 145.5228 3.156734 258.5271       11.19451 237.0432       14.88758 286.4778       16.98103 139.1506 4.395903 152.9602 4.560734 -13.80959      6.334371 
1 1 1 5   9  28 o 95.20947 3.360500 110.8624       7.784641 104.2740       11.36726 116.6814       10.68288 92.10889 5.084002 97.53714 4.506690 -5.428246      6.793918 
1 1 1 5   9  29 o 110.6156 3.602377 149.7258       9.697546 153.9554       11.52267 139.4556       17.95534 112.0794 4.226396 106.1190 6.982065 5.960350       8.161596 
1 1 1 5   9  30 o 143.1588 3.230553 250.4473       11.27019 253.5021       15.61013 247.1212       16.28840 143.7705 4.460940 141.8931 4.717209 1.877396       6.492461 
1 1 1 5   9  31 o 87.15405 3.147939 92.96082       6.674765 85.78785       8.809500 102.6288       10.22751 83.54990 4.341719 91.35639 4.608930 -7.806488      6.331884 
1 1 1 5   9  32 o 72.22978 3.310878 63.95441       5.812179 61.44466       7.665806 67.34800       8.914008 70.61678 4.477712 73.84946 4.982406 -3.232674      6.698826 
1 1 1 5   9  33 o 126.1820 4.803050 196.1852       14.74202 195.9735       21.59889 196.3698       20.17099 125.2913 7.103252 125.6187 6.612552 -0.3274307     9.704742 
1 1 1 5   9  34 o 17.87457 6.659543 3.081883       3.883470 4.336156       4.948084 1.070001       6.266750 20.57346 7.543526 19.15122 8.013130 1.422241       11.00523 
1 1 1 5   9  35 o 113.2396 3.214462 157.3610       8.861416 156.1211       11.87924 158.9166       13.30557 112.4636 4.342675 113.2952 4.830406 -0.8316040     6.495510 
1 1 1 5   9  36 o 53.43194 3.853759 35.36256       4.984184 35.53164       6.582848 35.13541       7.629890 53.22726 5.138913 52.63935 6.058362 0.5879097      7.944317 
1 1 1 5   9  37 o 27.19758 6.943977 9.800820       4.617615 12.13671       5.279349 2.195750       9.525888 30.19760 7.263307 23.17933 9.799353 7.018269       12.19766 
1 1 1 5   9  38 o 56.06547 3.810925 39.20813       5.175744 39.59007       6.805949 38.68430       7.970422 55.85600 5.054808 54.73220 6.078267 1.123795       7.905467 
1 1 1 5   9  39 o 82.22296 4.484183 85.50557       8.950878 79.69465       11.11687 96.21635       15.09283 78.36400 5.863953 84.66743 7.389019 -6.303436      9.433109 
1 1 1 5   9  40 o 26.58742 6.301736 9.730576       4.020225 16.06268       5.267257 0.8942199      6.222245 34.21099 6.556612 17.89917 7.749695 16.31183       10.15120 
1 1 1 5   9  41 o 22.83921 6.661798 7.439163       3.935628 8.108920       5.146306 6.495670       6.108101 23.56082 7.747295 21.97693 8.317046 1.583883       11.36635 
1 1 1 5   9  42 o 11.34188 5.272348 -2.206939      3.517300 -0.2585991     4.575724 -5.020869      5.499004 14.36594 6.414222 12.99293 6.204153 1.373007       8.923775 
1 1 1 5   9  43 o 17.30081 6.806759 3.950852       4.208061 2.677574       4.950329 7.267563       7.989623 16.59009 7.041133 21.28385 8.985039 -4.693756      11.41527 
1 1 1 5   9  44 o 11.83631 5.582589 -2.420207      4.191303 -5.112982      8.202538 -1.468695      4.875906 14.88090 7.222369 13.24232 6.173197 1.638584       9.501103 
1 1 1 5   9  45 o 13.13483 5.756468 1.121810       3.522796 9.681954       5.064533 -6.902131      4.903348 22.32905 7.687225 10.65252 5.254642 11.67653       9.311535 
1 1 1 5   9  46 o 11.35908 5.290944 -0.8109791     3.570126 -1.255812      4.913923 -0.3136697     5.195693 12.56375 5.960907 13.26913 6.245176 -0.7053814     8.633345 
1 1 1 5   9  47 o 19.35262 6.679549 7.659288       3.824650 5.315975       5.135100 10.57872       5.731688 16.03322 6.989955 20.04154 7.925729 -4.008316      10.56772 
1 1 1 5   9  48 f 12.52507 5.707737 1.581318       3.844002 5.225845       5.694672 -1.469325      5.210073 15.21592 6.939044 11.85502 5.754311 3.360898       9.014567 
1 1 1 5   10 0  o 206.1411 3.486345 517.9485       17.51342 515.5201       24.64646 520.4252       24.89078 205.6218 4.918688 206.5970 4.944000 -0.9751740     6.973997 
1 1 1 5   10 1  o 497.8607 7.289842 3024.617       88.44271 2970.975       173.7350 3043.381       102.7535 492.1315 14.50254 499.2751 8.445406 -7.143677      16.78238 
1 1 1 5   10 2  o 377.5825 5.658598 1738.614       52.06631 1621.167       70.30939 1881.230       77.47713 364.4562 7.916475 392.5866 8.098450 -28.13043      11.32499 
1 1 1 5   10 3  o 400.5332 5.959848 1956.466       58.17144 1981.050       82.96140 1932.688       81.58944 402.8595 8.450576 397.9149 8.414099 4.944580       11.92515 
1 1 1 5   10 4  o 57.71211 2.393992 40.65788       3.359555 40.40278       4.667176 40.93219       4.839780 57.47929 3.346486 57.84944 3.448786 -0.3701515     4.805527 
1 1 1 5   10 5  o 308.3302 4.743487 1158.906       35.64100 1241.248       75.43153 1135.240       40.43985 318.7018 9.723904 305.1425 5.438396 13.55933       11.14139 
1 1 1 5   10 6  o 447.1731 6.589936 2438.523       71.81132 2306.329       139.5608 2486.128       83.74896 434.1280 13.20733 451.4525 7.612569 -17.32455      15.24417 
1 1 1 5   10 7  f 400.5067 5.961044 1955.707       58.17927 1982.297       118.5489 1947.271       66.77342 402.6383 12.09593 399.6006 6.857114 3.037720       13.90437 
1 1 1 5   10 8  o 527.4509 7.690525 3393.144       98.84943 3932.608       220.0631 3256.783       110.6394 566.6828 15.95157 516.6654 8.787478 50.01740       18.21187 
1 1 1 5   10 9  o 398.5204 5.307471 1935.999       51.54356 2131.459       87.12131 1830.739       63.93318 418.0024 8.552823 387.4799 6.770815 30.52252       10.90847 
1 1 1 5   10 10 o 600.3611 8.690192 4397.113       127.1388 4368.173       179.0519 4426.543       180.5604 598.0137 12.28660 601.9933 12.30821 -3.979614      17.39116 
1 1 1 5   10 11 o 256.0147 4.102771 798.8412       25.59636 783.5360       35.87214 814.7167       36.53439 253.5139 5.806567 258.5091 5.799490 -4.995255      8.206723 
1 1 1 5   10 12 o 166.1715 3.497923 336.5236       14.16455 334.5612       23.35713 337.6651       17.81405 165.5528 5.798528 166.3843 4.397390 -0.8314819     7.277360 
1 1 1 5   10 13 o 523.7923 8.813988 3348.000       112.5039 3244.742       189.6509 3404.067       139.7489 514.6699 15.13778 527.9517 10.86221 -13.28180      18.63169 
1 1 1 5   10 14 o 274.0784 4.367559 915.6583       29.17089 906.8583       41.03811 924.6458       41.47307 272.7025 6.175357 275.3638 6.180494 -2.661285      8.736907 
1 1 1 5   10 15 o 65.24577 3.182518 52.00540       5.044837 55.04221       5.728764 41.51619       10.64690 67.10976 3.515249 57.81674 7.751871 9.293018       8.511666 
1 1 1 5   10 16 o 369.7594 6.498837 1667.850       58.55864 1759.428       73.69299 1510.956       96.45722 379.6626 7.965118 351.3425 11.28057 28.32010       13.80922 
1 1 1 5   10 17 o 177.3287 3.873460 383.3387       16.73841 378.4604       19.91728 395.0682       30.88428 176.1163 4.644870 179.7783 7.063343 -3.661942      8.453734 
1 1 1 5   10 18 o 213.4333 3.687794 555.3627       19.18073 568.1761       27.26563 542.8091       26.98780 215.8218 5.184227 210.9460 5.250010 4.875870       7.378266 
1 1 1 5   10 19 o 62.71885 2.879740 48.05133       4.389620 47.73558       5.800146 48.47462       6.715731 62.45070 3.829650 62.88834 4.410104 -0.4376411     5.840825 
1 1 1 5   10 20 o 114.2502 3.149843 159.2693       8.761272 152.6551       10.63858 173.2098       15.44485 111.8072 3.910632 118.9988 5.339649 -7.191574      6.618526 
1 1 1 5   10 21 o 240.7587 4.020500 707.2017       23.58838 698.5386       32.94715 716.3119       33.78670 239.1253 5.654006 242.1402 5.725886 -3.014908      8.046959 
1 1 1 5   10 22 o 192.5045 4.145984 452.3154       19.44933 470.9844       35.50480 444.3114       23.24770 195.9199 7.450140 190.6526 5.008151 5.267303       8.976979 
1 1 1 5   10 23 o 131.6124 2.969346 211.2809       9.523434 202.9328       12.94910 221.1160       14.05512 128.8566 4.129124 134.4950 4.293874 -5.638412      5.957098 
1 1 1 5   10 24 o 140.6768 3.062338 241.4427       10.49813 235.7395       14.34092 248.0276       15.40983 138.8585 4.243053 142.4114 4.445793 -3.552963      6.145614 
1 1 1 5   10 25 o 82.59352 2.923223 83.33289       5.874334 84.82200       7.836751 81.42310       8.874894 83.24899 3.873587 81.49708 4.486044 1.751907       5.926995 
1 1 1 5   10 26 o 115.1450 3.301061 161.9920       9.253079 158.9290       11.22953 168.4701       16.33098 113.9707 4.049701 117.1052 5.740179 -3.134453      7.024936 
1 1 1 5   10 27 o 96.61895 3.278951 114.1223       7.709098 109.8261       11.38506 117.7600       10.47619 94.57742 4.957131 98.02064 4.397001 -3.443222      6.626218 
1 1 1 5   10 28 o 86.04591 3.073045 90.52262       6.433352 84.30036       8.543150 98.67287       9.777543 82.90018 4.243004 89.67232 4.488676 -6.772133      6.176674 
1 1 1 5   10 29 o 182.0976 4.099294 405.7875       18.19070 398.1736       21.57761 424.4929       33.82067 180.1437 4.919885 185.1596 7.511077 -5.015915      8.978951 
1 1 1 5   10 30 o 49.74918 3.791604 30.45618       4.562062 35.67646       6.027267 23.45375       6.980689 53.74537 4.647590 43.06357 6.883698 10.68180       8.305744 
1 1 1 5   10 31 o 111.8191 3.110631 152.9542       8.467953 141.3012       11.15059 168.8310       13.01553 107.2807 4.273760 117.2213 4.565099 -9.940567      6.253412 
1 1 1 5   10 32 o 16.27812 6.575912 1.468225       4.031692 2.278043       4.661788 -0.9348143     8.030443 18.06243 7.146327 20.20272 8.775206 -2.140291      11.31699 
1 1 1 5   10 33 o 49.16768 4.081592 29.87226       4.846358 33.63837       6.285881 24.35248       7.609938 52.01947 5.020981 43.61290 7.426140 8.406574       8.964252 
1 1 1 5   10 34 o 44.58737 5.858020 25.06287       6.211191 20.72554       11.19766 26.99043       7.464839 39.36535 11.16188 46.02610 6.865128 -6.660759      13.10410 
1 1 1 5   10 35 o 76.89252 3.361206 72.70876       6.282967 68.57896       8.215944 78.52574       9.750822 74.38503 4.554311 79.46167 5.061872 -5.076645      6.809134 
1 1 1 5   10 36 o 91.09273 3.730469 102.4447       8.263487 105.0757       9.717674 95.57405       15.70387 92.04391 4.344689 86.25656 7.546938 5.787346       8.708192 
1 1 1 5   10 37 o 19.99613 6.556839 4.962646       3.687289 6.422871       4.733880 2.710040       5.879628 22.57998 7.430657 19.63761 7.938293 2.942369       10.87341 
1 1 1 5   10 38 o 41.85204 4.440153 22.16344       4.459453 21.54564       5.757741 23.08964       7.049887 40.65993 5.990273 41.54144 7.226367 -0.8815117     9.386360 
1 1 1 5   10 39 o 19.27913 6.767454 4.570043       3.934636 3.476898       5.076886 6.214140       6.226190 19.02520 7.479135 22.64300 8.433038 -3.617798      11.27180 
1 1 1 5   10 40 o 38.14939 5.472836 19.34601       4.942363 20.41925       5.725715 16.20894       9.789103 38.72353 6.282751 31.64237 10.69172 7.081152       12.40104 
1 1 1 5   10 41 o 19.73150 6.681565 5.371296       3.823080 6.858968       5.014381 3.305989       5.908213 21.88745 7.642927 18.84962 7.825220 3.037830       10.93839 
1 1 1 5   10 42 o 15.84114 6.382287 2.587260       3.786598 -0.5584537     4.870052 7.396284       6.021469 14.45373 6.521755 21.91108 8.265499 -7.457355      10.52862 
1 1 1 5   10 43 o 25.76152 7.001807 10.69769       4.509668 12.75466       5.392157 5.910349       8.226118 27.41623 7.735984 20.19313 8.824437 7.223091       11.73525 
1 1 1 5   10 44 o 19.96593 7.223064 6.848516       4.515043 7.452739       8.872532 6.637370       5.244937 20.14555 8.967292 19.56125 7.627714 0.5842991      11.77261 
1 1 1 5   10 45 o 18.61687 6.511021 5.992381       3.639959 8.959514       5.166491 3.068072       5.129072 21.15711 7.716011 15.76262 6.925865 5.394485       10.36843 
1 1 1 5   10 46 o 9.264812 4.518008 -3.840705      3.315445 -4.061660      4.473872 -3.571540      4.937890 10.77533 5.253219 11.48613 5.581428 -0.7108021     7.664766 
1 1 1 5   10 47 o 11.57768 5.366962 0.7680937E-01  3.605965 -3.013255      5.127585 3.100335       5.072078 11.49872 5.609856 14.40081 6.560153 -2.902095      8.631691 
1 1 1 5   10 48 o 16.13699 6.638896 5.913940       4.200816 5.187151       6.318421 6.489707       5.623771 15.05170 7.020201 15.91703 7.108572 -0.8653297     9.990746 
1 1 1 5   11 0  o 603.0211 12.36725 4446.477       181.7364 4446.477       181.7364 0.000000       0.000000 603.0211 12.36725 ?        ?        0.000000       12.36725 
1 1 1 5   11 1  f 449.7198 6.648303 2466.754       72.85996 2453.800       145.2319 2471.111       84.22599 447.6646 13.32776 450.0414 7.679936 -2.376770      15.38215 
1 1 1 5   11 2  o 394.5958 5.892818 1898.623       56.66457 1995.078       82.66306 1813.124       77.82703 404.3383 8.389392 385.4666 8.285286 18.87170       11.79101 
1 1 1 5   11 3  o 242.5833 3.939037 717.2436       23.28558 730.0392       33.17204 704.8136       32.69472 244.6988 5.562938 240.4335 5.580157 4.265289       7.879367 
1 1 1 5   11 4  o 356.3719 5.388204 1548.304       46.79329 1518.148       65.27292 1580.188       67.11702 352.7870 7.592493 359.9200 7.652274 -7.133087      10.77976 
1 1 1 5   11 5  o 972.0723 12.41311 11545.55       294.0459 11517.81       464.1533 11564.15       380.0347 968.8704 19.65892 971.9473 16.04518 -3.076843      25.37559 
1 1 1 5   11 6  o 561.9654 8.169594 3852.276       111.8784 3444.826       208.6675 4016.656       132.5387 530.2982 16.16613 573.7173 9.480002 -43.41919      18.74071 
1 1 1 5   11 7  o 699.1460 11.61127 5968.962       197.8261 5662.365       332.0225 6137.711       246.3229 679.1760 20.08290 708.5628 14.26561 -29.38684      24.63393 
1 1 1 5   11 8  o 551.1163 8.013846 3704.590       107.6268 3803.413       220.3512 3673.627       123.3401 557.2941 16.24271 548.7167 9.224019 8.577393       18.67909 
1 1 1 5   11 9  o 164.3865 3.048485 329.3094       12.21199 293.7915       24.83871 340.6316       14.02400 155.0861 6.587343 167.1851 3.442216 -12.09900      7.432492 
1 1 1 5   11 10 o 325.1458 4.441661 1288.569       35.19327 1332.894       57.17646 1261.532       44.65465 330.6050 7.096950 321.6819 5.696445 8.923126       9.100339 
1 1 1 5   11 11 o 276.8410 5.012110 934.2501       33.81326 931.4232       57.50903 935.7437       41.80221 276.1705 8.555528 277.0292 6.192094 -0.8587646     10.56121 
1 1 1 5   11 12 o 165.2459 4.109009 332.8200       16.54642 335.3825       23.58624 330.3367       23.21843 165.7502 5.848570 164.4996 5.801126 1.250565       8.237648 
1 1 1 5   11 13 o 264.9961 4.247682 855.9523       27.43011 852.6556       38.71655 859.2748       38.86797 264.4353 6.008155 265.4597 6.008378 -1.024414      8.496971 
1 1 1 5   11 14 o 102.7799 2.652134 128.8199       6.637075 131.7746       9.370573 125.8454       9.401988 103.9124 3.706457 101.5400 3.806412 2.372330       5.312871 
1 1 1 5   11 15 o 252.7132 4.110201 778.4999       25.31204 790.3660       36.07405 766.9921       35.52551 254.5742 5.814928 250.7817 5.813107 3.792526       8.222262 
1 1 1 5   11 16 o 303.4161 5.527164 1122.799       40.86740 1080.681       48.42653 1227.013       76.17521 297.6050 6.677393 316.6971 9.882467 -19.09201      11.92689 
1 1 1 5   11 17 o 120.7578 3.359135 177.8940       9.875445 177.0509       11.54044 180.1998       19.08554 120.4439 3.937183 121.3412 6.477938 -0.8973236     7.580574 
1 1 1 5   11 18 o 169.7451 3.644415 351.3011       15.07514 347.4433       18.65240 358.5677       25.59931 168.7197 4.540751 171.2811 6.143086 -2.561325      7.639105 
1 1 1 5   11 19 o 101.4589 3.063751 125.6108       7.566271 129.3001       9.531799 119.3260       12.44067 102.8989 3.807831 98.74564 5.188191 4.153282       6.435596 
1 1 1 5   11 20 o 136.1646 2.967615 226.0576       9.847093 224.6045       13.64835 227.6351       14.22108 135.6218 4.134491 136.5239 4.279810 -0.9020844     5.950697 
1 1 1 5   11 21 o 232.4024 3.931883 659.0292       22.26780 689.9122       32.09247 630.3563       30.92293 237.6190 5.542249 227.1262 5.586982 10.49272       7.869618 
1 1 1 5   11 22 o 48.11260 4.444918 28.50602       5.152560 31.03044       10.75412 27.75384       5.870211 49.44868 9.264853 47.37787 5.168126 2.070805       10.60882 
1 1 1 5   11 23 o 79.62321 2.883708 77.43164       5.586108 77.19350       7.351705 77.75694       8.592532 79.43018 3.809202 79.66089 4.443904 -0.2307129     5.853060 
1 1 1 5   11 24 f 83.38102 2.868101 84.91233       5.819031 81.28757       7.677696 89.80508       8.920040 81.49821 3.876982 85.63061 4.288308 -4.132393      5.781054 
1 1 1 5   11 25 f 119.0865 2.926401 173.0379       8.492442 164.1517       11.45021 183.9029       12.66113 115.8426 4.062392 122.6007 4.244230 -6.758141      5.875076 
1 1 1 5   11 26 o 169.6065 3.789441 351.4500       15.66223 330.6033       24.36807 366.1238       20.44443 164.0354 6.106695 172.8939 4.857242 -8.858490      7.802853 
1 1 1 5   11 27 o 90.24374 3.714170 99.68765       8.150530 103.1201       10.70430 94.95215       12.57309 91.64625 4.809838 87.75673 5.913828 3.889519       7.622854 
1 1 1 5   11 28 o 138.9136 3.170434 235.6914       10.73247 229.3215       14.59254 243.1970       15.84011 136.8043 4.382840 140.8428 4.621424 -4.038483      6.369211 
1 1 1 5   11 29 o 86.69688 3.547857 92.04749       7.479752 87.76720       8.506221 106.6411       15.70657 84.57548 4.139783 92.68449 7.005937 -8.109016      8.137626 
1 1 1 5   11 30 o 126.1740 3.118246 194.5471       9.587745 190.9947       12.99985 198.7842       14.19739 124.7824 4.281469 127.2423 4.586188 -2.459930      6.274081 
1 1 1 5   11 31 o 149.1189 3.725643 272.2412       13.53849 264.3150       16.24653 290.2527       24.49084 146.6909 4.550374 153.0639 6.581288 -6.373001      8.001203 
1 1 1 5   11 32 f 82.55863 3.208582 83.51843       6.442940 74.14144       8.229289 98.36990       10.35655 77.58659 4.370174 89.31689 4.775594 -11.73029      6.473385 
1 1 1 5   11 33 o 13.22878 5.806130 -0.8483742     3.595642 2.405631       4.371101 -7.658128      6.323353 17.75416 6.951636 14.18353 6.738802 3.570632       9.681772 
1 1 1 5   11 34 o 83.54427 4.219146 86.11869       8.561880 95.82693       15.64158 81.96545       10.23066 87.02898 7.446813 81.23698 5.195122 5.792007       9.079885 
1 1 1 5   11 35 o 117.2632 3.723129 169.3493       10.62564 170.2329       12.49455 167.0402       20.19694 117.3306 4.377593 114.7668 7.258785 2.563805       8.476631 
1 1 1 5   11 36 o 30.69405 5.611053 12.14465       4.042349 17.66490       5.318070 4.590677       6.221032 37.01727 6.108265 21.83368 8.362199 15.18360       10.35554 
1 1 1 5   11 37 o 27.69240 6.031683 10.09179       3.954882 10.03090       5.031902 10.19018       6.396636 27.34026 7.381437 27.58680 8.593966 -0.2465420     11.32881 
1 1 1 5   11 38 o 38.39610 5.221590 19.01634       4.759208 18.86940       6.502729 19.18584       6.984094 37.26344 7.421901 37.33234 7.922447 -0.6890106E-01 10.85586 
1 1 1 5   11 39 o 25.97708 6.236513 9.191020       3.897862 10.43656       5.083725 7.414288       6.071760 27.27488 7.442805 23.67918 8.398407 3.595692       11.22179 
1 1 1 5   11 40 o 28.83048 6.659420 11.69712       4.584434 16.57212       5.305303 -2.674490      9.109099 34.53793 6.542899 18.71764 8.624634 15.82028       10.82561 
1 1 1 5   11 41 o 12.28403 5.840530 -4.466824      4.767004 2.953171       9.314824 -7.099712      5.548672 20.83768 9.236588 12.33402 5.975376 8.503664       11.00089 
1 1 1 5   11 42 o 18.98982 6.877035 5.202950       4.094164 4.837791       4.840796 6.120463       7.673308 18.82485 7.331545 20.96730 8.825843 -2.142452      11.47375 
1 1 1 5   11 43 o 21.51420 6.745971 7.465451       3.934744 8.000504       5.315085 6.816652       5.852840 21.48641 7.827693 20.21400 8.004273 1.272408       11.19559 
1 1 1 5   11 44 o 18.64629 7.392454 5.884531       4.997953 21.05020       10.59032 1.538909       5.668974 27.04304 10.74813 15.52924 7.018958 11.51380       12.83698 
1 1 1 5   11 45 o 15.42575 6.278607 3.548564       3.707340 10.06521       5.416763 -2.194042      5.084898 21.83905 7.910030 12.53178 5.978988 9.307271       9.915486 
1 1 1 5   11 46 o 14.37241 6.129766 3.039320       3.783698 10.09182       5.501312 -3.291610      5.212291 20.51566 7.862058 11.75625 5.717644 8.759409       9.721287 
1 1 1 5   11 47 o 16.38576 6.677653 5.692897       4.199809 9.400224       6.740526 3.340379       5.369450 17.84957 7.887294 14.50230 6.660142 3.347273       10.32312 
1 1 1 5   12 0  o 456.4175 7.806053 2541.141       86.82203 2852.491       162.2301 2416.172       102.7797 482.7878 13.80337 444.9321 9.479325 37.85568       16.74487 
1 1 1 5   12 1  o 467.3729 6.157023 2663.404       70.12460 2727.483       112.4041 2622.572       89.72676 472.7119 9.757749 463.6689 7.941050 9.042969       12.58070 
1 1 1 5   12 2  o 582.5626 11.96289 4145.767       169.8301 4069.551       237.7814 4225.133       242.6446 576.1943 16.95295 587.1094 16.97742 -10.91510      23.99240 
1 1 1 5   12 3  o 203.3407 3.491464 503.9021       17.30087 488.8157       24.00914 520.1971       24.95236 200.2528 4.919963 206.5802 4.956633 -6.327362      6.983857 
1 1 1 5   12 4  o 210.6514 3.566289 540.7870       18.30699 517.3759       25.22399 566.8449       26.61170 206.0199 5.024220 215.6437 5.064071 -9.623795      7.133555 
1 1 1 5   12 5  o 344.5246 5.204759 1446.895       43.69754 1414.474       61.26690 1480.463       62.34243 340.5673 7.382217 348.4226 7.342455 -7.855316      10.41195 
1 1 1 5   12 6  o 132.3987 2.759966 213.6122       8.904790 213.7041       12.46494 213.5164       12.72565 132.3630 3.868598 132.3017 3.951533 0.6134033E-01  5.529979 
1 1 1 5   12 7  o 683.5251 9.850853 5701.483       164.0833 6255.913       351.1713 5546.634       185.5879 713.9387 20.20500 674.0146 11.29911 39.92413       23.14977 
1 1 1 5   12 8  o 776.9488 11.15709 7370.099       211.2417 7948.215       446.1681 7203.064       239.8248 803.9448 22.79686 767.8449 12.81695 36.09985       26.15283 
1 1 1 5   12 9  o 554.3338 9.294950 3749.624       125.5610 0.000000       0.000000 3749.624       125.5610 ?        ?        554.3338 9.294950 0.000000       9.294950 
1 1 1 5   12 10 o 252.7852 4.030520 778.8190       24.82840 820.8229       50.67173 765.5483       28.48174 259.2758 8.029555 250.6098 4.663719 8.665985       9.285689 
1 1 1 5   12 11 o 621.9883 8.048022 4719.687       121.9853 4869.604       197.0893 4626.594       155.3076 631.1848 12.81358 615.5718 10.35328 15.61298       16.47356 
1 1 1 5   12 12 o 222.6194 4.253991 604.0818       23.07787 579.2984       38.25747 618.2588       28.93519 217.8087 7.217807 225.1938 5.272711 -7.385101      8.938581 
1 1 1 5   12 13 o 283.2166 4.486427 977.7894       30.96388 959.7413       43.29784 996.6813       44.29837 280.5258 6.333698 285.8725 6.358860 -5.346649      8.975011 
1 1 1 5   12 14 o 449.3113 6.655878 2462.656       72.87671 2414.335       101.7962 2513.461       104.3788 444.6260 9.395081 453.6566 9.441673 -9.030609      13.31964 
1 1 1 5   12 15 o 761.0358 10.95980 7082.719       203.2562 7170.289       289.9394 6998.097       285.0191 764.3121 15.56684 755.1064 15.48923 9.205627       21.96002 
1 1 1 5   12 16 f 384.0342 6.747426 1799.992       63.14575 1938.993       80.46865 1577.205       101.8736 398.4178 8.288041 358.7017 11.66999 39.71609       14.31364 
1 1 1 5   12 17 o 360.8484 7.782238 1590.917       68.43297 1590.917       68.43297 0.000000       0.000000 360.8484 7.782238 ?        ?        0.000000       7.782238 
1 1 1 5   12 18 o 83.34089 2.747188 84.75745       5.571712 90.03065       7.783046 79.21425       7.979818 85.84475 3.729385 80.48946 4.081670 5.355293       5.528864 
1 1 1 5   12 19 o 223.4483 3.816980 608.9712       20.78419 604.8479       29.17310 613.2214       29.61852 222.5803 5.378483 224.1119 5.423283 -1.531677      7.638068 
1 1 1 5   12 20 o 62.44530 3.790188 47.74464       5.740460 54.38395       12.83647 46.08495       6.417978 66.13402 8.136274 61.30002 4.324115 4.834000       9.213953 
1 1 1 5   12 21 o 286.5048 4.585788 1002.328       32.01710 1044.458       46.28381 963.6673       44.33695 292.1454 6.501207 280.6223 6.483470 11.52310       9.181561 
1 1 1 5   12 22 o 82.05501 3.530675 82.31327       7.043386 86.88911       14.29466 80.84615       8.094142 83.90304 7.056672 81.27133 4.100177 2.631706       8.161377 
1 1 1 5   12 23 o 195.0255 3.550007 464.2370       16.87161 464.2720       23.69385 464.2011       24.02983 194.8047 4.995265 194.7784 5.066906 0.2630615E-01  7.115210 
1 1 1 5   12 24 o 131.9596 3.000464 212.4663       9.648631 215.7301       13.40944 208.9625       13.89390 132.8214 4.148005 130.6935 4.368627 2.127914       6.024189 
1 1 1 5   12 25 o 99.31271 3.179435 120.5116       7.684771 116.4274       11.35334 123.9650       10.43985 97.43842 4.796163 100.6159 4.267553 -3.177467      6.419906 
1 1 1 5   12 26 o 43.58122 3.653157 23.36500       3.844081 26.10812       4.896960 18.96059       6.205091 45.99080 4.423885 38.71326 6.826773 7.277542       8.134838 
1 1 1 5   12 27 o 54.67091 3.305298 36.63981       4.382981 38.04964       5.646397 34.50240       6.952336 55.61596 4.197134 52.75688 5.487844 2.859085       6.908862 
1 1 1 5   12 28 o 20.07035 6.246454 4.925381       3.380211 7.984865       3.899942 -4.313452      6.777080 24.99757 6.381213 16.58347 7.565441 8.414101       9.897262 
1 1 1 5   12 29 o 68.15721 3.660166 56.97848       6.056933 56.01768       6.807431 60.62938       13.26989 67.51332 4.157858 69.48498 7.981589 -1.971657      8.999641 
1 1 1 5   12 30 o 25.13199 6.300794 8.095763       3.851173 8.095663       4.471123 8.096051       7.580706 25.20919 7.019798 26.83276 9.395425 -1.623568      11.72824 
1 1 1 5   12 31 o 125.6526 3.180326 193.2108       9.730389 185.4662       12.92411 203.3455       14.78445 122.8809 4.322720 128.5754 4.726624 -5.694450      6.405223 
1 1 1 5   12 32 o 48.33090 4.104104 28.86665       4.788028 29.50575       6.287645 27.98452       7.387022 48.62252 5.397402 47.05313 6.625587 1.569389       8.545780 
1 1 1 5   12 33 o 53.96577 3.724260 35.89708       4.867690 40.18778       6.285067 29.46567       7.694829 56.95744 4.566403 48.20044 6.734653 8.757004       8.136805 
1 1 1 5   12 34 o 38.80564 8.476433 19.83035       7.790881 13.99308       10.63051 26.60363       11.45114 33.22476 11.14135 44.37021 10.71300 -11.14545      15.45633 
1 1 1 5   12 35 o 28.40828 5.866148 10.44221       3.926443 12.57117       4.903718 6.638753       6.554387 31.03636 6.681540 24.22171 8.710601 6.814653       10.97805 
1 1 1 5   12 36 o 26.73783 6.055172 9.363570       3.853423 6.728963       4.776231 14.27609       6.521984 23.05445 7.455770 32.54177 8.222491 -9.487316      11.09945 
1 1 1 5   12 37 o 26.65127 6.481283 9.467098       4.168205 6.426007       5.570506 13.33597       6.283075 22.91631 8.051670 31.18220 8.171441 -8.265890      11.47178 
1 1 1 5   12 38 o 27.90385 5.918377 10.38256       3.899515 9.645804       4.929020 11.61518       6.375477 26.48734 7.368549 28.73264 8.505541 -2.245300      11.25343 
1 1 1 5   12 39 o 32.79622 5.239736 14.18659       4.046775 14.42703       5.129467 13.79028       6.585618 32.33530 6.728939 30.67016 8.511662 1.665148       10.85021 
1 1 1 5   12 40 o 25.53099 8.824726 9.816386       6.676675 26.57770       10.09864 -3.199743      8.899179 40.20077 10.27181 18.12704 8.412742 22.07373       13.27721 
1 1 1 5   12 41 o 13.93386 6.071983 0.3784955      3.871210 3.839469       4.534870 -8.918717      7.432623 17.99210 7.069950 14.03278 6.825484 3.959318       9.827076 
1 1 1 5   12 42 o 40.05374 4.483773 21.70032       4.301442 19.87117       5.574374 24.39247       6.762716 36.43498 6.517576 39.56099 7.283130 -3.126003      9.773576 
1 1 1 5   12 43 o 18.23265 6.536057 5.154708       3.687087 8.034585       4.859560 1.247722       5.660190 21.53312 7.523685 15.70754 7.064134 5.825581       10.32026 
1 1 1 5   12 44 o 16.88163 6.430054 4.467995       3.665200 5.676352       5.033960 3.104712       5.346937 18.24940 7.356594 16.20798 7.097927 2.041418       10.22253 
1 1 1 5   12 45 o 13.66217 6.207534 1.062992       4.504704 -6.494030      9.063689 3.542048       5.191261 13.98280 6.941177 15.75375 6.943141 -1.770957      9.817697 
1 1 1 5   12 46 o 13.52522 6.008850 2.106199       3.964492 0.5927507      6.182477 3.163133       5.166574 13.86552 6.609043 14.76872 6.685482 -0.9032021     9.400804 
1 1 1 5   12 47 o 20.34913 6.900319 9.069303       4.077608 2.965280       5.625817 15.82503       5.918527 14.20140 6.623836 24.25692 8.311529 -10.05552      10.62811 
1 1 1 5   13 0  o 423.8756 5.640780 2190.314       58.26580 2172.108       91.52780 2202.719       75.55199 421.9487 8.901379 425.0008 7.294913 -3.052094      11.50871 
1 1 1 5   13 1  o 476.8409 8.118023 2773.401       94.33219 0.000000       0.000000 2773.401       94.33219 ?        ?        476.8409 8.118023 0.000000       8.118023 
1 1 1 5   13 2  o 848.5570 14.06640 8800.992       290.8708 8949.749       360.4843 8523.426       492.4146 855.0112 17.30129 832.1374 24.30891 22.87378       29.83719 
1 1 1 5   13 3  o 722.6926 10.40526 6374.543       183.2495 6832.394       271.4479 5991.167       248.3919 747.5317 14.90119 700.0563 14.56024 47.47546       20.83377 
1 1 1 5   13 4  o 952.1679 13.61018 11078.76       315.8011 10665.71       434.7812 11540.03       459.4604 932.9359 19.12418 970.3318 19.43085 -37.39594      27.26338 
1 1 1 5   13 5  o 354.1873 4.797967 1529.079       41.41202 1422.901       62.59722 1611.717       55.22417 341.5785 7.520183 363.5869 6.232823 -22.00842      9.767355 
1 1 1 5   13 6  f 669.2421 8.625368 5463.758       140.6685 5308.577       218.1675 5574.176       184.0310 659.0878 13.58347 675.6970 11.17642 -16.60919      17.59043 
1 1 1 5   13 7  o 336.1458 5.905675 1377.567       48.37638 0.000000       0.000000 1377.567       48.37638 ?        ?        336.1458 5.905675 0.000000       5.905675 
1 1 1 5   13 8  o 260.9995 4.791330 830.3448       30.47417 0.000000       0.000000 830.3448       30.47417 ?        ?        260.9995 4.791330 0.000000       4.791330 
1 1 1 5   13 9  o 418.4060 6.224809 2134.567       63.46876 2245.501       132.7791 2101.713       72.25840 428.4706 12.73076 415.1271 7.142844 13.34357       14.59769 
1 1 1 5   13 10 f 361.1774 5.474022 1590.380       48.17960 1629.936       99.53008 1578.275       55.06058 365.1314 11.19909 359.7669 6.280344 5.364532       12.83987 
1 1 1 5   13 11 o 358.9243 4.856379 1570.460       42.47676 1582.202       67.85094 1562.893       54.47146 360.1266 7.731515 358.0005 6.243804 2.126068       9.937878 
1 1 1 5   13 12 o 210.4486 3.209972 539.7613       16.46203 531.1462       26.25844 545.3398       21.13005 208.7228 5.162534 211.5174 4.099383 -2.794556      6.592170 
1 1 1 5   13 13 o 128.9937 2.832264 202.7842       8.903043 224.6922       13.22880 184.6457       12.03702 135.7099 4.004500 123.0109 4.020901 12.69899       5.674827 
1 1 1 5   13 14 o 527.9355 7.732024 3402.094       99.47413 3567.761       145.3265 3256.050       136.4482 540.1345 11.04096 516.0319 10.85064 24.10260       15.48028 
1 1 1 5   13 15 o 471.5257 6.986269 2713.775       80.27619 2759.570       114.6177 2669.682       112.4682 475.0706 9.900510 467.2733 9.876944 7.797333       13.98478 
1 1 1 5   13 16 o 107.4755 3.825326 141.0104       10.00278 141.0104       10.00278 0.000000       0.000000 107.4755 3.825326 ?        ?        0.000000       3.825326 
1 1 1 5   13 17 o 357.9770 5.466178 1563.917       47.68425 1643.895       69.50469 1492.801       65.54112 366.7149 7.777669 349.4677 7.696099 17.24713       10.94176 
1 1 1 5   13 18 o 172.4658 3.260679 362.6728       13.70400 354.1758       19.08655 371.7140       19.68821 170.3127 4.603016 174.4791 4.634593 -4.166367      6.532014 
1 1 1 5   13 19 o 336.8249 5.206586 1385.328       42.73595 1419.993       61.27813 1352.502       59.63103 340.6419 7.381953 332.4524 7.360491 8.189545       10.42449 
1 1 1 5   13 20 o 163.9486 3.209851 327.8346       12.82415 332.0646       18.15026 323.6178       18.12196 164.8604 4.522105 162.7434 4.574008 2.117050       6.432028 
1 1 1 5   13 21 o 181.4494 3.402982 401.6913       15.04705 411.0375       21.54272 392.7881       21.02617 183.3627 4.825374 179.2440 4.818072 4.118668       6.818948 
1 1 1 5   13 22 f 135.3512 3.627504 223.7624       11.95403 247.8031       23.52496 215.3941       13.87950 142.0187 6.817378 132.7287 4.296803 9.290039       8.058484 
1 1 1 5   13 23 o 137.4016 3.011985 230.3377       10.08512 230.3720       14.06964 230.3015       14.46353 137.2611 4.211272 137.2263 4.330570 0.3485107E-01  6.040583 
1 1 1 5   13 24 o 164.8821 3.677993 331.9856       14.77816 355.3896       24.64861 318.8515       18.46498 170.1868 5.952503 161.4066 4.699528 8.780258       7.584053 
1 1 1 5   13 25 o 124.6699 3.017065 189.7009       9.166055 185.6334       12.54992 194.3514       13.41922 123.1586 4.187667 125.9952 4.377209 -2.836639      6.057765 
1 1 1 5   13 26 o 55.64104 3.244104 37.93357       4.379639 37.17659       5.614100 39.11051       7.000286 54.97361 4.223071 56.26518 5.163028 -1.291573      6.670172 
1 1 1 5   13 27 o 63.28745 3.135808 49.03522       4.821126 43.99248       6.174795 56.90967       7.716122 59.80921 4.264589 68.00718 4.684569 -8.197971      6.334975 
1 1 1 5   13 28 o 114.0883 3.035537 159.0953       8.431924 159.6318       11.39361 158.4457       12.53736 114.1324 4.103209 113.6347 4.536623 0.4977417      6.116966 
1 1 1 5   13 29 o 72.87171 4.098107 65.22729       7.248111 65.22729       7.248111 0.000000       0.000000 72.87171 4.098107 ?        ?        0.000000       4.098107 
1 1 1 5   13 30 f 121.9229 3.565738 182.0530       10.58288 199.6530       12.99508 147.3952       18.23574 127.5641 4.186036 108.9070 6.906768 18.65712       8.076283 
1 1 1 5   13 31 o 26.30036 6.025342 8.881782       3.778642 5.818125       4.550504 15.68589       6.781490 22.08935 7.286070 34.75955 8.148561 -12.67020      10.93096 
1 1 1 5   13 32 o 51.07655 3.731409 32.15229       4.612367 29.35217       5.787669 37.02577       7.635465 48.57063 4.959354 54.41085 5.850363 -5.840221      7.669546 
1 1 1 5   13 33 o 52.83270 4.273237 34.56572       5.454774 33.44268       6.105628 39.00684       12.14168 51.83192 4.891752 54.58783 9.470613 -2.755901      10.65935 
1 1 1 5   13 34 o 66.35233 4.530334 54.62016       7.281308 75.68829       14.22757 47.14405       8.475310 76.97499 7.687531 61.28173 5.742177 15.69326       9.595350 
1 1 1 5   13 35 o 41.86289 4.298875 21.90409       4.323266 21.78951       5.433897 22.10170       7.136356 41.42086 5.520741 41.09995 7.397216 0.3209190      9.230243 
1 1 1 5   13 36 o 50.64017 4.150005 32.04322       5.076410 31.18733       6.913198 33.04476       7.478314 49.35451 5.862387 50.68789 6.182035 -1.333378      8.519691 
1 1 1 5   13 37 o 13.39417 5.767700 -0.2690456E-01 3.409831 3.504436       4.199757 -6.857491      5.840949 18.37518 6.909108 13.44460 6.412719 4.930584       9.426492 
1 1 1 5   13 38 o 24.74506 6.273122 8.305675       3.787270 5.841544       4.611894 13.40867       6.636817 21.32985 7.335957 30.57542 8.566689 -9.245569      11.27849 
1 1 1 5   13 39 o 54.30041 4.864980 38.26739       6.369401 48.64174       11.96954 34.16927       7.522973 57.62526 8.802507 50.29908 6.273530 7.326172       10.80932 
1 1 1 5   13 40 o 49.16652 4.451392 31.54314       5.275639 34.53572       6.148620 23.19168       10.27156 51.02288 5.009632 36.25930 10.81156 14.76359       11.91580 
1 1 1 5   13 41 o 33.69491 5.705015 15.97788       4.517445 13.02909       5.074296 27.24446       9.918599 29.20511 7.180943 38.58120 10.34030 -9.376091      12.58919 
1 1 1 5   13 42 o 17.80927 6.401690 4.629416       3.539725 5.299939       4.493636 3.533070       5.745988 18.82613 7.131639 17.72651 7.556861 1.099623       10.39069 
1 1 1 5   13 43 o 12.24189 5.513123 -0.1894726     3.460993 2.675931       4.753379 -3.422583      5.049168 15.91461 6.830825 12.45940 5.948177 3.455208       9.057648 
1 1 1 5   13 44 o 20.43362 6.540896 7.187706       3.682415 5.418524       5.047369 9.201043       5.384398 17.79609 7.294456 21.44508 7.868106 -3.648983      10.72922 
1 1 1 5   13 45 o 11.25176 5.402096 -2.636603      4.295146 -5.481723      8.539330 -1.673031      4.969533 13.74200 6.806886 12.42042 5.921664 1.321579       9.022183 
1 1 1 5   13 46 o 13.30663 5.839292 2.192446       3.635418 7.798845       5.069594 -3.742557      5.216049 18.20620 7.367049 11.40772 5.585184 6.798475       9.244874 
1 1 1 5   13 47 o 12.61337 5.678979 1.756185       3.669725 3.131960       4.997859 0.1467465      5.405644 14.04634 6.441413 12.69670 6.086476 1.349636       8.862110 
1 1 1 5   14 0  o 520.6101 8.810130 3306.368       111.7715 0.000000       0.000000 3306.368       111.7715 ?        ?        520.6101 8.810130 0.000000       8.810130 
1 1 1 5   14 1  o 404.5296 7.014899 1995.435       69.15249 0.000000       0.000000 1995.435       69.15249 ?        ?        404.5296 7.014899 0.000000       7.014899 
1 1 1 5   14 2  o 517.0306 8.753380 3261.043       110.2880 3539.006       202.1740 3143.283       131.5922 537.7194 15.44485 507.4650 10.64113 30.25433       18.75572 
1 1 1 5   14 3  o 327.2616 5.843198 1305.660       46.59955 1416.748       85.40122 1258.561       55.60737 340.5513 10.30256 321.2635 7.102886 19.28778       12.51374 
1 1 1 5   14 4  o 319.0694 5.673928 1241.085       44.11691 1267.633       76.45213 1227.831       54.01805 322.1543 9.749664 317.3188 6.985653 4.835510       11.99397 
1 1 1 5   14 5  o 265.2434 4.213265 857.4768       27.23325 854.9203       53.54744 858.3687       31.62929 264.6054 8.314635 265.3678 4.891084 -0.7623596     9.646546 
1 1 1 5   14 6  o 634.0170 9.153333 4904.901       141.4218 4630.261       271.1575 5007.521       165.7503 614.4642 18.12860 640.4564 10.62010 -25.99225      21.01030 
1 1 1 5   14 7  o 531.9896 7.743475 3452.052       100.3865 3529.509       144.5069 3379.809       139.5582 537.6290 11.02985 526.1189 10.88517 11.51013       15.49660 
1 1 1 5   14 8  o 556.3212 8.106956 3775.672       109.9055 3515.682       211.0074 3872.466       128.7491 535.5981 16.18531 563.2893 9.379431 -27.69122      18.70663 
1 1 1 5   14 9  o 191.6478 3.403903 447.6247       15.89707 489.3723       35.22419 436.9465       17.81451 200.1742 7.232882 189.3418 3.860924 10.83232       8.198860 
1 1 1 5   14 10 o 480.2223 7.070816 2812.924       82.74618 2713.899       163.1489 2847.219       96.01118 470.7086 14.23953 483.0549 8.156226 -12.34625      16.41000 
1 1 1 5   14 11 o 472.9452 6.228396 2727.885       71.78324 2764.069       114.8826 2704.710       91.94106 475.7375 9.909477 470.7904 8.013935 4.947174       12.74445 
1 1 1 5   14 12 o 365.0400 4.939596 1624.677       43.94080 1536.696       67.40639 1689.693       57.94470 354.8481 7.795116 372.1917 6.388677 -17.34366      10.07864 
1 1 1 5   14 13 o 291.5207 4.100518 1036.015       29.13025 1016.306       45.87757 1049.329       37.70670 288.6219 6.522813 293.3389 5.274883 -4.716949      8.388771 
1 1 1 5   14 14 o 154.3987 3.440753 290.5878       12.94593 297.4860       16.66887 280.1018       20.55143 156.1385 4.385210 151.4328 5.578646 4.705688       7.095869 
1 1 1 5   14 15 o 370.8764 6.560194 1679.080       59.29006 1763.419       74.33585 1531.616       98.29409 379.9010 8.029560 353.3675 11.42974 26.53348       13.96828 
1 1 1 5   14 16 o 227.8531 5.729778 634.0714       31.78953 676.0724       46.37828 596.8510       43.65919 235.0109 8.110392 220.7933 8.128222 14.21762       11.48244 
1 1 1 5   14 17 o 338.6078 5.222377 1399.429       43.09246 1367.311       60.10271 1433.405       61.81733 334.4125 7.375228 342.3942 7.408797 -7.981689      10.45391 
1 1 1 5   14 18 o 278.0707 4.465751 943.5819       30.26117 996.1545       44.16283 897.0499       41.54826 285.4900 6.347898 270.9239 6.293169 14.56613       8.938668 
1 1 1 5   14 19 o 92.57970 2.724328 104.5950       6.139580 108.4263       8.700972 100.7958       8.664497 94.19400 3.798394 90.80411 3.924900 3.389893       5.461926 
1 1 1 5   14 20 o 11.72247 4.935740 0.1630181      2.400847 0.4841698      3.141355 -0.2880342     3.722849 13.69834 5.697945 14.07120 6.042485 -0.3728628     8.305311 
1 1 1 5   14 21 o 161.8165 3.200601 319.4544       12.62091 319.9384       17.82522 318.9678       17.87219 161.7727 4.526062 161.5247 4.545010 0.2480164      6.414230 
1 1 1 5   14 22 o 73.48222 4.056954 66.14228       7.236521 0.000000       0.000000 66.14228       7.236521 ?        ?        73.48222 4.056954 0.000000       4.056954 
1 1 1 5   14 23 f 180.6799 3.832707 398.6753       16.87531 374.2492       26.74327 414.8359       21.75287 174.6079 6.295439 184.1156 4.852535 -9.507706      7.948563 
1 1 1 5   14 24 o 37.45616 3.832195 17.31676       3.448646 18.83696       4.536336 15.23505       5.308409 38.93507 4.888594 34.67536 6.521442 4.259708       8.150311 
1 1 1 5   14 25 o 152.3236 3.217555 283.2913       11.94343 273.5537       16.29816 294.5856       17.55265 149.4726 4.479517 155.0884 4.649626 -5.615799      6.456399 
1 1 1 5   14 26 o 83.39972 2.950656 85.02003       5.987347 85.89297       8.033262 83.92909       8.980471 83.72246 3.948565 82.69082 4.473275 1.031639       5.966687 
1 1 1 5   14 27 f 25.87335 5.474104 8.524870       3.343580 8.059547       4.193693 9.336740       5.539401 25.14293 6.716989 27.19034 7.895532 -2.047401      10.36616 
1 1 1 5   14 28 o 21.58575 6.310813 5.845470       3.528250 3.349954       4.062474 13.50624       7.117815 18.51761 6.827477 32.40694 8.791728 -13.88932      11.13144 
1 1 1 5   14 29 o 126.6965 3.479514 196.4781       10.73268 197.9241       13.15156 193.5951       18.57045 127.0197 4.254842 125.1727 6.106455 1.846962       7.442612 
1 1 1 5   14 30 o 150.5891 4.536291 278.6025       16.62781 278.6025       16.62781 0.000000       0.000000 150.5891 4.536291 ?        ?        0.000000       4.536291 
1 1 1 5   14 31 o 17.32559 6.336244 3.023570       3.487547 2.275730       4.286087 4.488877       5.999581 17.51423 6.875958 21.87746 8.250979 -4.363228      10.74046 
1 1 1 5   14 32 o 42.09891 4.838462 22.11679       4.873662 22.16013       5.359399 21.90968       11.71569 42.03081 5.353892 40.52080 11.39224 1.510010       12.58759 
1 1 1 5   14 33 o 91.13508 3.126105 101.9026       6.932372 99.40530       9.152237 105.2638       10.61795 89.76182 4.195685 92.21832 4.740753 -2.456505      6.330759 
1 1 1 5   14 34 o 37.11750 4.743854 17.32661       4.192935 13.16936       5.260199 24.57088       6.943787 31.72943 6.991929 43.72598 6.732278 -11.99655      9.706217 
1 1 1 5   14 35 o 77.81496 4.972214 75.78754       9.379311 0.000000       0.000000 75.78754       9.379311 ?        ?        77.81496 4.972214 0.000000       4.972214 
1 1 1 5   14 36 o 15.62381 6.043221 2.143249       3.271724 1.450910       3.958460 3.635813       5.812104 15.85528 6.474823 20.31072 7.996936 -4.455441      10.28953 
1 1 1 5   14 37 o 16.65498 6.314027 2.776030       3.523959 5.249957       4.297438 -2.302240      6.157069 20.54873 7.080887 16.14143 7.303409 4.407299       10.17245 
1 1 1 5   14 38 o 32.31581 7.294249 14.58016       5.607544 21.41833       10.27732 11.68145       6.691334 36.91029 10.76502 28.38397 8.781160 8.526327       13.89225 
1 1 1 5   14 39 o 39.68979 5.060979 20.78064       4.783767 18.22754       5.444160 29.43068       10.02088 36.35218 6.378094 43.37352 9.721832 -7.021336      11.62730 
1 1 1 5   14 40 o 31.03728 5.363700 13.19405       3.910124 11.46598       5.031206 15.82979       6.213593 27.60885 7.348804 32.04070 7.986542 -4.431850      10.85310 
1 1 1 5   14 41 o 24.77869 6.834304 9.435738       4.260349 7.799420       4.755049 16.09508       9.592608 22.24956 7.451276 28.17163 10.47221 -5.922071      12.85257 
1 1 1 5   14 42 o 16.15088 6.220118 3.493584       3.455224 0.9846509      4.525043 7.002017       5.350999 14.64037 6.466108 20.47422 7.776202 -5.833851      10.11335 
1 1 1 5   14 43 o 19.88454 6.583131 6.557238       3.713739 4.296467       5.085214 9.141047       5.436398 17.26508 7.220728 21.97790 7.929225 -4.712822      10.72434 
1 1 1 5   14 44 o 18.93439 6.547969 6.306543       3.676151 8.825274       5.240279 3.865894       5.158414 20.79481 7.738171 16.26450 7.049017 4.530306       10.46747 
1 1 1 5   14 45 f 13.56643 6.338831 0.6277122      5.189115 0.000000       0.000000 0.6277122      5.189115 ?        ?        13.56643 6.338831 0.000000       6.338831 
1 1 1 5   14 46 o 14.99849 6.239905 4.076558       3.768355 7.603163       5.287238 0.4355696      5.372297 17.67140 7.374652 13.11866 6.226663 4.552742       9.651778 
1 1 1 5   15 0  o 464.2058 7.917274 2628.236       89.56171 2634.554       154.9397 2625.066       109.7561 464.0960 13.71499 463.8081 9.710782 0.2878418      16.80477 
1 1 1 5   15 1  o 438.9667 9.181847 2351.059       98.21950 2370.069       139.6362 2332.442       138.1819 440.2418 13.03014 436.7340 12.99815 3.507782       18.40479 
1 1 1 5   15 2  o 358.3759 6.285743 1565.910       54.89484 1466.086       90.63343 1623.748       68.98864 346.3820 10.75036 364.8721 7.758911 -18.49014      13.25786 
1 1 1 5   15 3  o 306.4693 5.514698 1144.993       41.18555 1104.536       68.86504 1167.522       51.38879 300.7123 9.409060 309.4279 6.815110 -8.715515      11.61792 
1 1 1 5   15 4  o 166.1479 3.713918 336.4340       15.03707 329.1047       26.40064 339.9535       18.29459 164.1528 6.613329 166.9448 4.501011 -2.792023      7.999701 
1 1 1 5   15 5  o 651.7360 9.422835 5183.707       149.6544 5263.837       303.3878 5157.939       172.0418 654.8823 19.03091 649.9442 10.86230 4.938110       21.91267 
1 1 1 5   15 6  o 117.1366 2.812907 167.2074       8.029417 171.1194       17.55822 166.1730       9.028805 118.3091 6.110837 116.7281 3.177040 1.580948       6.887373 
1 1 1 5   15 7  o 166.7846 3.071091 338.9987       12.48201 338.8769       17.99429 339.1116       17.32897 166.6790 4.434080 166.7435 4.268203 -0.6440735E-01 6.154561 
1 1 1 5   15 8  o 229.0908 3.846070 639.6689       21.47143 643.7513       44.66947 638.4423       24.48561 229.5646 7.997120 228.8604 4.390402 0.7041931      9.123023 
1 1 1 5   15 9  o 371.3833 5.623891 1681.741       50.89737 1678.302       103.1154 1682.848       58.52350 370.4167 11.43714 371.4632 6.465147 -1.046539      13.13797 
1 1 1 5   15 10 o 542.8495 7.929814 3596.138       104.9007 3582.738       210.7998 3600.549       120.9386 540.3185 16.02745 543.0447 9.138888 -2.726196      18.44989 
1 1 1 5   15 11 o 261.9902 4.242223 836.7390       27.08412 761.7145       53.03843 863.2037       31.50092 249.6186 8.732669 266.0808 4.858181 -16.46214      9.993069 
1 1 1 5   15 12 o 197.7499 3.419738 476.6478       16.47954 480.3077       24.28214 473.5226       22.43812 198.4020 5.026371 197.0693 4.672308 1.332764       6.862570 
1 1 1 5   15 13 o 338.5799 5.153622 1398.142       42.52162 1404.282       61.14929 1392.394       59.16890 339.1473 7.398895 337.7276 7.189370 1.419739       10.31653 
1 1 1 5   15 14 o 161.0550 2.786922 316.1567       10.93793 297.8826       17.33256 328.2503       14.10014 156.2204 4.557782 164.0896 3.526193 -7.869263      5.762587 
1 1 1 5   15 15 o 152.1571 3.104931 282.2352       11.51278 279.8587       16.27782 284.6138       16.28525 151.4117 4.416367 152.6959 4.381069 -1.284210      6.220777 
1 1 1 5   15 16 o 190.8913 3.462136 444.3298       16.10521 429.3561       22.57115 459.8603       22.98695 187.5091 4.943953 194.0669 4.864477 -6.557816      6.935835 
1 1 1 5   15 17 o 78.21869 2.765491 74.68238       5.263020 75.30629       7.691237 74.13298       7.217406 78.46494 4.035954 77.86577 3.815248 0.5991669      5.553832 
1 1 1 5   15 18 o 135.9153 2.960104 225.2606       9.804185 225.9272       13.93698 224.6076       13.79454 135.9966 4.210443 135.6010 4.179526 0.3955841      5.932645 
1 1 1 5   15 19 o 130.4515 2.925748 207.5378       9.300838 208.5699       13.17709 206.5132       13.12978 130.6507 4.144015 130.0037 4.149753 0.6469269      5.864581 
1 1 1 5   15 20 o 132.0851 3.317863 212.9933       10.67099 206.2623       13.35756 224.8665       17.74061 129.9000 4.225323 135.5062 5.383173 -5.606186      6.843384 
1 1 1 5   15 21 o 52.69207 2.997289 33.97981       3.832791 32.01521       5.250752 36.22051       5.607598 51.02060 4.262085 54.28869 4.273111 -3.268089      6.035301 
1 1 1 5   15 22 o 86.52950 3.993105 91.64095       8.397278 0.000000       0.000000 91.64095       8.397278 ?        ?        86.52950 3.993105 0.000000       3.993105 
1 1 1 5   15 23 o 92.88319 3.085974 105.4045       6.975286 87.51653       10.22934 120.9505       9.536183 84.42591 4.994369 99.42349 3.943774 -14.99758      6.363731 
1 1 1 5   15 24 o 78.04940 2.843749 74.43674       5.399709 72.04366       7.360722 77.22511       7.945439 76.67944 3.952514 79.37726 4.121695 -2.697815      5.710581 
1 1 1 5   15 25 o 75.23520 2.943739 69.20103       5.386634 73.58556       7.380419 64.20309       7.879779 77.48743 3.921279 72.29588 4.494879 5.191559       5.964928 
1 1 1 5   15 26 o 172.6271 3.409193 364.1046       14.34157 344.1993       19.52316 387.4365       21.13692 167.5503 4.786455 177.7481 4.884414 -10.19774      6.838687 
1 1 1 5   15 27 o 101.6797 3.293794 126.4673       8.150672 123.9349       10.06184 131.3005       13.90069 100.5447 4.115295 103.2409 5.545557 -2.696205      6.905712 
1 1 1 5   15 28 o 171.6820 3.439578 360.3875       14.39017 363.3534       19.97294 357.1860       20.75089 172.0465 4.768470 170.5164 4.999237 1.530151       6.908739 
1 1 1 5   15 29 o 112.0352 3.083098 153.5413       8.409396 156.6186       11.50786 150.0150       12.31888 112.9668 4.187552 110.4766 4.585746 2.490112       6.210045 
1 1 1 5   15 30 o 68.36101 3.827724 57.44119       6.351076 57.65575       7.218526 56.70593       13.36257 68.40196 4.353146 66.83338 8.389001 1.568581       9.451201 
1 1 1 5   15 31 o 77.77343 4.310809 74.52883       8.138114 74.52883       8.138114 0.000000       0.000000 77.77343 4.310809 ?        ?        0.000000       4.310809 
1 1 1 5   15 32 o 81.73123 3.197626 81.96179       6.356426 79.92140       8.351145 84.77186       9.800488 80.48586 4.273163 82.74477 4.882085 -2.258911      6.488041 
1 1 1 5   15 33 o 68.74554 3.314989 58.12848       5.537081 59.74569       7.305778 55.94569       8.487696 69.46823 4.337269 66.96812 5.242747 2.500114       6.804286 
1 1 1 5   15 34 o 31.86308 5.520107 13.01657       4.130985 11.00098       5.500412 15.62440       6.256546 28.84058 7.687106 34.36477 7.666140 -5.524187      10.85639 
1 1 1 5   15 35 o 43.22101 5.795305 23.94852       5.950217 38.09276       11.79264 19.11761       6.891846 52.81413 9.512538 37.82350 7.738252 14.99063       12.26250 
1 1 1 5   15 36 o 22.71922 6.282866 6.839728       3.595265 8.311913       4.402624 3.892715       6.229047 24.90839 6.976760 20.86660 8.259154 4.041796       10.81151 
1 1 1 5   15 37 o 17.54121 7.161726 2.163769       4.841592 -5.603703      7.838987 6.954184       6.156114 16.63562 7.778807 23.42805 8.439691 -6.792429      11.47773 
1 1 1 5   15 38 o 10.48892 4.944708 -3.206076      3.281021 -7.056046      3.945629 5.423163       5.907094 9.906889 4.851897 21.34637 8.155183 -11.43948      9.489357 
1 1 1 5   15 39 o 46.66994 3.987365 27.99165       4.491413 26.21934       5.694142 30.91010       7.306933 44.23457 5.393790 47.12505 6.538719 -2.890476      8.476310 
1 1 1 5   15 40 o 33.83306 4.901363 15.48304       3.923488 17.36940       5.036648 12.57167       6.257168 34.94363 6.138658 27.76635 8.473588 7.177280       10.46350 
1 1 1 5   15 41 o 26.08243 6.628936 10.47570       4.221554 11.74815       4.822039 6.299870       8.735376 27.16543 7.177656 20.99899 9.136335 6.166437       11.61858 
1 1 1 5   15 42 o 18.06173 6.420100 5.016201       3.549906 4.803102       4.692303 5.301404       5.428408 17.97610 7.151161 18.63298 7.592428 -0.6568737     10.42996 
1 1 1 5   15 43 o 9.986022 4.795582 -3.256861      3.389555 -2.362399      4.718388 -4.210681      4.872433 12.35264 5.855004 11.69607 5.650089 0.6565752      8.136620 
1 1 1 5   15 44 o 13.75833 6.033094 1.818550       3.874350 -1.313040      6.042115 4.005271       5.048975 13.64149 6.510940 16.09381 6.974445 -2.452323      9.541239 
1 1 1 5   15 45 o 12.53742 5.844481 0.1368852      4.370121 14.97252       9.690328 -3.650726      4.896301 19.92376 9.072776 11.25905 5.490496 8.664710       10.60475 
1 1 1 5   15 46 o 14.08748 6.013367 3.305890       3.646884 7.427863       5.551808 0.1773250      4.836760 17.11748 7.365169 12.53311 5.936852 4.584369       9.460017 
1 1 1 5   16 0  o 712.1186 10.27378 6190.332       178.2866 6287.460       254.7133 6097.040       249.6340 717.0126 14.57769 706.0840 14.50812 10.92859       20.56684 
1 1 1 5   16 1  o 759.0602 9.770415 7032.253       180.7280 7524.483       299.1229 6749.258       226.8064 784.1370 15.65387 743.2258 12.52271 40.91113       20.04649 
1 1 1 5   16 2  o 346.3965 5.312767 1462.767       44.84669 1484.035       63.92871 1442.159       62.92871 348.8163 7.520782 343.8602 7.509843 4.956177       10.62826 
1 1 1 5   16 3  o 179.2944 3.340152 391.7686       14.59382 405.2962       20.75787 378.5471       20.52172 182.2856 4.676847 176.1590 4.784928 6.126678       6.690921 
1 1 1 5   16 4  o 692.9654 10.00084 5862.161       168.8824 5909.195       240.0730 5816.085       237.6174 695.0721 14.17351 689.5804 14.14025 5.491638       20.02087 
1 1 1 5   16 5  o 580.1575 9.741540 4108.801       137.7240 4134.841       238.5021 4095.773       168.6919 580.6620 16.87305 578.9616 11.95662 1.700378       20.67995 
1 1 1 5   16 6  o 414.9497 8.877280 2101.414       89.76592 1954.057       120.9221 2282.302       133.9754 399.6297 12.43198 431.8779 12.74393 -32.24823      17.80342 
1 1 1 5   16 7  o 386.2646 6.772787 1819.778       63.75121 1744.864       108.0538 1859.780       78.95798 377.6624 11.75518 390.3872 8.299738 -12.72476      14.38992 
1 1 1 5   16 8  o 568.0458 8.284485 3938.099       114.6793 4156.604       239.0255 3872.762       130.7051 581.8497 16.87549 563.1652 9.524025 18.68451       19.37754 
1 1 1 5   16 9  o 217.4021 3.736870 576.0923       19.79738 635.9912       43.34553 560.3034       22.25417 228.1516 7.807734 214.3905 4.259609 13.76115       8.894098 
1 1 1 5   16 10 o 376.8884 6.555399 1732.905       60.20713 1826.831       110.2223 1692.962       71.87770 386.2617 11.72343 372.4125 7.920157 13.84921       14.14807 
1 1 1 5   16 11 o 371.6832 6.473642 1685.602       58.63511 1668.838       103.1845 1693.597       71.25836 369.1047 11.48570 372.4420 7.851290 -3.337372      13.91273 
1 1 1 5   16 12 o 504.2973 7.420588 3105.292       91.19290 2902.666       176.0157 3179.637       106.6181 485.7875 14.88613 510.1165 8.576801 -24.32898      17.18017 
1 1 1 5   16 13 o 179.0373 3.372984 390.7679       14.71614 417.8405       21.55647 367.1379       20.13927 185.0251 4.784929 173.4293 4.769773 11.59579       6.756203 
1 1 1 5   16 14 o 148.7773 3.115315 269.8405       11.29470 264.8165       15.91674 274.9363       16.03011 147.2794 4.439891 150.0729 4.387979 -2.793579      6.242355 
1 1 1 5   16 15 o 168.1426 2.853329 344.6566       11.69138 330.9853       18.67466 353.4690       14.99321 164.6373 4.659350 170.2519 3.613819 -5.614624      5.896544 
1 1 1 5   16 16 o 92.17047 2.359170 103.6229       5.294561 103.6625       9.013941 103.6020       6.542027 92.09373 4.026237 92.13505 2.917421 -0.4131317E-01 4.972115 
1 1 1 5   16 17 o 164.0871 3.204517 328.3618       12.81365 316.5067       18.07690 340.3338       18.16591 160.9530 4.613570 166.9198 4.469966 -5.966797      6.423832 
1 1 1 5   16 18 o 194.0722 3.513430 459.5049       16.61616 469.3134       23.93005 450.3728       23.09006 195.9385 5.015855 191.9507 4.940381 3.987793       7.040324 
1 1 1 5   16 19 o 97.41936 2.783185 115.8374       6.600518 120.2266       9.529078 111.7893       9.151455 99.16373 3.951229 95.61650 3.935960 3.547226       5.577096 
1 1 1 5   16 20 o 174.3672 3.360931 371.0075       14.28106 395.5805       21.11000 350.2711       19.39211 179.8435 4.821136 169.2384 4.706651 10.60512       6.737649 
1 1 1 5   16 21 o 100.1228 3.103077 122.4326       7.562005 119.8893       12.03182 124.0933       9.722183 98.88795 5.009206 100.7251 3.968630 -1.837196      6.390788 
1 1 1 5   16 22 o 151.6462 3.769311 280.8535       13.92931 242.5007       24.57600 299.0053       16.90727 140.2987 7.212430 156.3370 4.442384 -16.03831      8.470768 
1 1 1 5   16 23 o 170.2851 3.327639 354.0321       13.80858 358.1962       19.58539 349.9163       19.47167 171.0466 4.703207 169.0518 4.731236 1.994812       6.671188 
1 1 1 5   16 24 o 34.75175 4.284344 14.99170       3.551520 16.25237       5.072495 13.77942       4.974164 35.91516 6.007749 32.93527 6.428403 2.979893       8.798717 
1 1 1 5   16 25 o 173.3233 3.388919 366.9930       14.31377 368.3391       20.17793 365.6295       20.30816 173.3515 4.781098 172.7016 4.830196 0.6498871      6.796300 
1 1 1 5   16 26 o 50.98827 3.627608 31.94242       4.477968 32.50053       5.615417 30.96764       7.421278 51.31523 4.537253 49.78810 6.254362 1.527126       7.726818 
1 1 1 5   16 27 o 35.48213 4.383682 15.65366       3.709875 18.64804       4.865584 11.49533       5.733782 38.61513 5.311144 29.91106 7.790314 8.704071       9.428534 
1 1 1 5   16 28 o 43.33619 3.920405 23.17935       4.095429 25.45292       5.348741 19.95765       6.367070 45.27001 4.927915 39.63895 6.838456 5.631062       8.429047 
1 1 1 5   16 29 o 17.70117 6.276591 3.366825       3.391134 2.490513       4.178339 5.058024       5.804593 17.62117 6.825695 22.29747 8.171233 -4.676300      10.64703 
1 1 1 5   16 30 o 51.96350 4.333394 33.38141       5.437443 32.13295       6.028622 38.82683       12.59058 50.86768 4.924938 54.62756 9.818890 -3.759876      10.98479 
1 1 1 5   16 31 f 102.2237 3.125043 128.0502       7.775589 127.8689       10.55560 128.2652       11.49735 101.9039 4.260051 101.9629 4.639371 -0.5896759E-01 6.298555 
1 1 1 5   16 32 o 54.97699 3.934288 37.34849       5.236038 37.80962       6.379261 36.39643       9.166267 55.13225 4.795867 53.39785 7.229775 1.734406       8.675828 
1 1 1 5   16 33 o 92.96418 3.482633 106.3842       7.875732 106.4962       11.75482 106.2930       10.60903 92.42329 5.240609 92.53236 4.720450 -0.1090698     7.053129 
1 1 1 5   16 34 o 11.52002 5.231657 -1.778169      3.194831 -0.8938933     3.999478 -3.337323      5.310727 13.85362 6.100420 14.49489 6.644453 -0.6412735     9.020193 
1 1 1 5   16 35 o 33.11021 6.799932 14.54830       5.302806 32.75407       10.69956 8.620353       6.105389 48.73195 9.349795 25.71387 8.437489 23.01808       12.59404 
1 1 1 5   16 36 o 22.55198 7.770718 6.450917       5.175524 14.03885       9.728730 3.455866       6.112188 31.35043 10.65812 20.23941 8.124559 11.11102       13.40164 
1 1 1 5   16 37 o 73.82732 3.419353 68.11308       6.135020 70.90029       8.192838 64.55500       9.256702 74.63355 4.525956 70.55007 5.425869 4.083481       7.065715 
1 1 1 5   16 38 o 21.03948 6.823540 6.062212       3.998856 8.247833       4.695564 0.2924902      7.629178 24.06200 7.339919 18.81986 8.349755 5.242140       11.11723 
1 1 1 5   16 39 o 29.49729 5.754345 12.08267       3.987736 11.80311       5.159338 12.49749       6.284766 28.06483 7.428738 28.15900 8.471154 -0.9417152E-01 11.26706 
1 1 1 5   16 40 o 16.91920 6.338624 3.697059       3.528029 5.917300       4.536194 0.2979105      5.612762 20.06440 7.242489 15.83413 7.084437 4.230276       10.13128 
1 1 1 5   16 41 o 20.12173 6.893791 6.400822       4.071598 8.908505       4.666051 -1.602867      8.336009 23.15701 7.357359 16.65855 7.861867 6.498457       10.76753 
1 1 1 5   16 42 o 13.53259 5.822608 1.302542       3.469699 2.733957       4.762722 -0.3163415     5.065008 15.93622 6.838774 14.07116 6.464509 1.865063       9.410564 
1 1 1 5   16 43 f 17.36722 6.731577 5.049273       4.065841 3.897948       6.278677 5.880728       5.335668 16.84610 7.518131 18.13988 7.474481 -1.293776      10.60142 
1 1 1 5   16 44 o 18.98249 6.678229 6.800083       3.833057 2.359398       5.416490 11.25480       5.425043 14.86543 6.774671 22.45304 7.940928 -7.587614      10.43813 
1 1 1 5   16 45 o 18.08227 6.644659 6.632342       3.842491 10.61791       5.637012 3.173093       5.251638 20.37860 7.918618 14.70062 6.688386 5.677979       10.36528 
1 1 1 5   16 46 o 14.24758 6.387819 3.429210       4.588887 11.23717       9.797210 1.234834       5.193849 17.02976 8.171618 13.16307 6.210227 3.866693       10.26364 
1 1 1 5   17 0  o 322.8764 7.085299 1271.467       55.74816 1271.467       55.74816 0.000000       0.000000 322.8764 7.085299 ?        ?        0.000000       7.085299 
1 1 1 5   17 1  o 505.3849 7.436999 3115.502       91.59170 3034.551       127.0489 3203.100       132.1628 498.5083 10.45833 512.1517 10.58948 -13.64334      14.88334 
1 1 1 5   17 2  f 561.7341 8.207335 3850.013       112.3490 3677.272       154.0138 4046.481       164.2507 548.6237 11.51991 575.4806 11.71225 -26.85693      16.42818 
1 1 1 5   17 3  o 390.4030 5.890899 1858.439       56.04421 1846.661       78.74799 1870.527       79.77903 389.0241 8.306667 391.5262 8.361646 -2.502106      11.78634 
1 1 1 5   17 4  o 880.4851 12.63072 9478.927       271.0106 9684.228       388.7271 9284.770       378.0303 888.3975 17.95566 869.9237 17.83238 18.47375       25.30612 
1 1 1 5   17 5  o 163.7224 3.137708 326.6784       12.51863 305.2018       17.32871 350.1218       18.10480 158.1664 4.500470 169.4202 4.388928 -11.25380      6.286249 
1 1 1 5   17 6  o 378.7109 5.118994 1748.633       47.24203 1751.738       74.74133 1746.567       60.96468 378.8659 8.095417 378.4066 6.611248 0.4592590      10.45200 
1 1 1 5   17 7  o 370.3597 6.468214 1673.127       58.37732 1699.271       72.36666 1624.413       98.78097 373.1373 7.958548 364.3684 11.13799 8.768829       13.68916 
1 1 1 5   17 8  o 501.9097 8.509725 3075.789       104.0824 3026.280       126.2758 3180.696       183.8161 497.5980 10.41371 509.1140 14.83186 -11.51596      18.12262 
1 1 1 5   17 9  o 261.9039 6.041884 836.7482       38.56120 833.4034       55.69081 839.8289       53.44596 261.0665 8.766228 262.1123 8.378178 -1.045807      12.12603 
1 1 1 5   17 10 o 122.7814 3.482888 183.9124       10.41044 178.3833       18.76709 186.3699       12.51197 120.7384 6.401329 123.5672 4.161085 -2.828766      7.634896 
1 1 1 5   17 11 o 291.9919 5.405479 1040.105       38.46281 1088.556       69.37464 1018.603       46.21623 298.1774 9.559861 288.8742 6.565225 9.303162       11.59712 
1 1 1 5   17 12 o 151.9798 3.701016 281.6225       13.70702 264.4788       24.02151 289.8995       16.69108 147.0162 6.722798 154.1102 4.449098 -7.093994      8.061667 
1 1 1 5   17 13 o 121.0868 3.464753 178.9156       10.21312 160.3706       18.26229 187.3552       12.31978 114.3982 6.578629 123.8768 4.086692 -9.478607      7.744637 
1 1 1 5   17 14 o 212.4544 3.620185 550.4427       18.74272 556.9857       27.68841 544.9091       25.46357 213.6068 5.319207 211.3050 4.945081 2.301758       7.262768 
1 1 1 5   17 15 o 85.03407 2.384244 88.21104       4.935724 99.39206       8.920446 83.27769       5.925389 90.16871 4.070200 82.59237 2.948752 7.576340       5.026099 
1 1 1 5   17 16 o 145.5796 2.683009 258.3982       9.518285 273.4579       16.06046 250.2449       11.81724 149.6145 4.409836 143.2369 3.385517 6.377609       5.559530 
1 1 1 5   17 17 o 146.4965 2.683999 261.6894       9.581772 274.3356       16.07291 254.7172       11.93429 149.8351 4.406737 144.4996 3.389173 5.335403       5.559300 
1 1 1 5   17 18 o 180.7867 3.378042 398.7691       14.88222 419.0535       21.83051 381.1574       20.34155 185.1341 4.843000 176.5728 4.731685 8.561371       6.770782 
1 1 1 5   17 19 o 98.58481 3.106181 118.6861       7.452990 119.2123       12.53344 118.3982       9.270052 98.60098 5.234943 98.40391 3.873315 0.1970749      6.512081 
1 1 1 5   17 20 f 161.8546 3.241462 319.6758       12.78504 316.6388       18.22741 322.6171       17.93763 160.8890 4.653922 162.4178 4.536502 -1.528763      6.499141 
1 1 1 5   17 21 o 146.8546 3.695685 263.5119       13.21519 259.5213       24.52797 265.1440       15.68669 145.2217 6.951152 147.2261 4.377164 -2.004456      8.214504 
1 1 1 5   17 22 o 89.54868 3.479329 98.06486       7.578156 101.8762       15.28015 96.82162       8.727052 90.78788 6.959654 88.92184 4.037921 1.866043       8.046216 
1 1 1 5   17 23 o 46.11829 3.405897 26.11526       3.800717 22.59163       5.342698 29.72548       5.407947 42.62637 5.254436 49.08078 4.574191 -6.454403      6.966514 
1 1 1 5   17 24 o 148.8400 3.161280 270.5216       11.46618 266.7242       16.12425 274.4063       16.30857 147.5594 4.489334 149.6735 4.476343 -2.114090      6.339697 
1 1 1 5   17 25 o 93.99886 3.656824 108.1736       8.360522 117.2131       11.83915 99.18149       11.80804 97.65829 4.991352 89.73875 5.424937 7.919540       7.371807 
1 1 1 5   17 26 o 79.83986 2.959038 77.95926       5.747173 77.40151       7.833649 78.60939       8.457630 79.42255 4.060956 79.99972 4.354765 -0.5771713     5.954439 
1 1 1 5   17 27 o 88.91655 3.000408 96.70399       6.491970 94.60052       8.805455 99.20897       9.609166 87.79189 4.127421 89.86518 4.401302 -2.073288      6.033827 
1 1 1 5   17 28 f 138.0912 3.221627 233.1752       10.84120 248.7621       15.40134 217.8667       15.26315 142.3360 4.445705 133.1311 4.712093 9.204849       6.478281 
1 1 1 5   17 29 o 109.4490 3.634515 146.8775       9.680358 144.7963       11.08996 153.5387       19.84045 108.5560 4.200106 110.8391 7.387694 -2.283058      8.498172 
1 1 1 5   17 30 o 52.60191 4.206052 34.19311       5.346649 35.09394       5.999115 30.71444       11.78888 53.20840 4.674147 48.22718 10.34140 4.981228       11.34866 
1 1 1 5   17 31 o 20.43923 6.334483 5.193577       3.480250 7.215615       4.423238 1.907443       5.638821 23.83055 7.092177 18.96632 7.734443 4.864227       10.49384 
1 1 1 5   17 32 o 26.12698 6.384261 8.872029       4.029657 10.88225       5.615097 6.737313       5.786354 28.81894 7.804652 23.87581 8.216908 4.943127       11.33270 
1 1 1 5   17 33 o 19.68440 6.542840 4.684838       3.667478 4.973919       4.333251 3.954878       6.885783 20.59499 7.109748 21.97736 8.688410 -1.382362      11.22662 
1 1 1 5   17 34 o 43.43828 4.053334 23.58830       4.241099 17.07722       5.366928 34.41518       6.920712 36.20906 6.311694 52.02807 5.543836 -15.81901      8.400691 
1 1 1 5   17 35 o 19.32268 7.464824 3.584068       4.987575 3.679903       9.232342 3.544572       5.926876 23.43878 9.760407 20.25699 8.044019 3.181795       12.64800 
1 1 1 5   17 36 o 45.76041 4.247204 26.53662       4.682139 25.70430       6.256751 27.59597       7.058619 44.23397 5.955570 45.52540 6.550887 -1.291428      8.853414 
1 1 1 5   17 37 o 50.82504 4.459373 33.12747       5.467251 33.72919       6.562202 31.76199       9.885489 50.71857 5.391953 46.40660 9.066686 4.311966       10.54884 
1 1 1 5   17 38 o 31.55548 5.434246 13.46847       4.028019 8.906545       5.065502 21.31394       6.642898 24.63285 7.643504 38.45273 7.357105 -13.81988      10.60897 
1 1 1 5   17 39 o 18.60163 6.562354 4.736061       3.703092 5.717279       4.820825 3.323793       5.783587 20.20651 7.439677 18.46290 7.709608 1.743605       10.71386 
1 1 1 5   17 40 o 16.29875 6.337757 3.288838       3.612932 5.845488       4.720117 -0.3283132     5.614362 19.74528 7.344763 15.24438 6.927848 4.500895       10.09657 
1 1 1 5   17 41 o 15.13726 6.434954 2.096147       4.146152 6.298267       4.832021 -9.634704      8.073453 19.67712 7.408307 13.70191 6.755750 5.975210       10.02612 
1 1 1 5   17 42 o 12.72610 5.801909 -0.2950180     3.977486 6.312151       5.910908 -5.762413      5.376959 19.00612 7.852762 11.77167 5.743378 7.234444       9.728939 
1 1 1 5   17 43 o 12.82343 5.698605 0.9166624      3.568111 0.4539153      5.213223 1.324478       4.894029 13.99128 6.474404 14.27422 6.479556 -0.2829399     9.159834 
1 1 1 5   17 44 o 11.10530 5.213450 -1.035714      3.580595 1.260957       5.302809 -2.960323      4.854313 13.93925 6.477692 11.57798 5.604296 2.361270       8.565549 
1 1 1 5   17 45 o 16.73321 6.498715 5.669381       3.795158 9.087258       5.636508 2.834785       5.133074 18.65870 7.684673 14.27501 6.539445 4.383682       10.09052 
1 1 1 5   18 0  o 81.57095 2.991476 81.19874       5.936369 84.76340       8.355107 77.56465       8.436065 83.28831 4.129412 79.64981 4.362956 3.638504       6.007281 
1 1 1 5   18 1  o 459.7330 6.846713 2578.048       76.70504 2758.073       112.9293 2423.855       104.5135 475.2475 9.751035 445.5357 9.626173 29.71179       13.70204 
1 1 1 5   18 2  o 186.5190 4.017900 424.0527       18.26242 430.2989       22.12942 410.7155       32.33662 187.8091 4.839262 183.3398 7.252025 4.469315       8.718390 
1 1 1 5   18 3  o 438.9542 7.552963 2351.030       80.79280 2544.932       146.4820 2266.252       96.85774 455.8477 13.20037 430.8175 9.225818 25.03015       16.10482 
1 1 1 5   18 4  o 206.2526 3.643391 518.5070       18.31224 485.2997       24.76873 558.5414       27.19594 199.4407 5.100471 214.0285 5.214305 -14.58772      7.294093 
1 1 1 5   18 5  o 511.7280 7.503803 3195.644       93.57433 3280.708       134.8612 3116.669       129.9439 518.0821 10.68200 504.9817 10.55952 13.10043       15.02027 
1 1 1 5   18 6  o 298.1099 4.673536 1083.529       33.95144 1174.353       50.60563 1009.186       45.78468 310.2469 6.693532 287.6122 6.532459 22.63461       9.352881 
1 1 1 5   18 7  o 346.9202 5.291451 1467.774       44.73428 1577.222       66.45161 1377.069       60.49477 359.4500 7.586317 335.8849 7.390795 23.56503       10.59132 
1 1 1 5   18 8  f 387.2292 5.227386 1828.820       49.32747 1863.005       78.73095 1806.729       63.28938 390.5418 8.272596 384.7567 6.750074 5.785095       10.67705 
1 1 1 5   18 9  o 281.3887 4.515478 965.5607       30.96325 1019.935       65.26750 949.7692       35.17325 288.6689 9.290239 279.0421 5.172573 9.626740       10.63316 
1 1 1 5   18 10 o 326.5825 5.075624 1301.100       40.39414 1388.239       85.57546 1276.118       45.82002 336.5323 10.44751 323.3717 5.814564 13.16061       11.95657 
1 1 1 5   18 11 o 457.5819 6.804656 2557.441       75.87717 2354.228       145.2444 2633.718       88.98521 437.2085 13.64920 464.1648 7.867006 -26.95633      15.75406 
1 1 1 5   18 12 o 84.10374 2.759651 86.31834       5.648292 71.35187       12.86737 89.89053       6.286320 76.09119 7.018394 85.81603 3.010685 -9.724838      7.636889 
1 1 1 5   18 13 o 391.5823 5.923301 1872.874       56.52271 1849.508       113.9882 1880.493       65.08833 387.4629 12.08719 392.2247 6.809765 -4.761749      13.87347 
1 1 1 5   18 14 o 101.5670 2.464699 125.7544       6.100319 128.5452       10.60172 124.3731       7.458822 102.5506 4.251527 100.9494 3.035458 1.601280       5.223934 
1 1 1 5   18 15 o 43.62660 2.756837 23.29921       2.915895 22.83917       5.865025 23.45026       3.360662 42.84823 5.762936 43.73513 3.174868 -0.8868942     6.579606 
1 1 1 5   18 16 o 29.92941 3.395220 11.06769       2.432594 10.58769       5.301033 11.19573       2.737888 28.85807 7.477832 30.04844 3.825642 -1.190367      8.399613 
1 1 1 5   18 17 o 161.2041 2.824293 316.9323       11.09487 343.9315       18.84789 302.6160       13.72471 167.7358 4.615450 157.4765 3.576443 10.25923       5.838949 
1 1 1 5   18 18 o 148.4498 2.963803 268.8182       10.72174 270.7726       21.47901 268.1696       12.37358 148.6170 5.942734 148.2424 3.425207 0.3745422      6.859164 
1 1 1 5   18 19 o 97.99460 2.813003 117.2341       6.710560 119.2541       9.926787 115.5342       9.106513 98.72565 4.135284 97.19795 3.852298 1.527702       5.651617 
1 1 1 5   18 20 o 181.5652 3.428832 402.4147       15.17102 396.8164       21.56387 407.9015       21.34789 180.0556 4.919162 182.5743 4.802380 -2.518723      6.874664 
1 1 1 5   18 21 o 31.36282 5.122163 12.34846       3.779755 31.26365       9.476534 8.770083       4.121806 49.75260 8.094213 26.21851 6.487082 23.53408       10.37297 
1 1 1 5   18 22 o 89.45972 2.868177 97.76794       6.244648 96.11734       8.974781 99.31702       8.694424 88.57118 4.169810 90.05937 3.971413 -1.488190      5.758423 
1 1 1 5   18 23 o 52.79207 3.364211 34.17760       4.305489 44.25515       6.478991 26.20793       5.761695 59.97498 4.465072 45.95106 5.238865 14.02392       6.883500 
1 1 1 5   18 24 o 60.57903 3.391483 44.97593       4.986670 42.48108       6.528146 48.47113       7.726872 58.72245 4.598594 62.67551 5.103184 -3.953053      6.869465 
1 1 1 5   18 25 o 117.8736 2.990137 169.7992       8.582085 169.5772       12.08132 170.0254       12.19325 117.6225 4.221752 117.7725 4.255537 -0.1499252     5.994396 
1 1 1 5   18 26 o 54.74047 3.673210 36.81700       4.871574 40.12867       7.505644 34.40634       6.403718 56.88391 5.482385 52.70890 5.047122 4.175007       7.451845 
1 1 1 5   18 27 o 195.5892 3.659603 468.1637       17.44275 463.8784       24.42590 472.6230       24.91698 194.2046 5.165839 196.0081 5.221223 -1.803497      7.344866 
1 1 1 5   18 28 o 60.98263 4.028000 45.78382       5.952408 48.60095       6.778342 36.29107       12.44276 62.76744 4.460587 52.79428 10.03827 9.973167       10.98471 
1 1 1 5   18 29 o 17.74606 6.290637 3.400967       3.406111 7.504322       4.406273 -2.691629      5.369119 24.29801 7.037766 15.16672 6.845223 9.131297       9.817700 
1 1 1 5   18 30 o 60.75257 4.096541 45.55488       6.029364 45.29936       6.703086 46.63776       13.79906 60.48429 4.581826 59.75537 9.816848 0.7289124      10.83345 
1 1 1 5   18 31 o 69.21757 4.106156 59.17753       6.894964 67.66323       9.568650 50.01287       9.944087 73.69078 5.365211 62.92589 6.582094 10.76489       8.491729 
1 1 1 5   18 32 o 47.46205 3.966782 27.96041       4.546052 37.77877       6.152269 16.15208       6.746987 55.05301 4.628658 34.90468 8.090308 20.14833       9.320813 
1 1 1 5   18 33 o 34.25302 4.759676 14.86680       3.865749 11.46140       4.858670 20.74149       6.381537 29.44767 6.893156 39.89023 6.809018 -10.44256      9.689083 
1 1 1 5   18 34 o 31.99529 7.683932 13.86106       5.915562 9.622722       9.089204 16.97565       7.791628 27.90791 10.22539 34.95303 9.070253 -7.045122      13.66851 
1 1 1 5   18 35 o 45.03998 5.087646 26.01045       5.486445 35.47606       9.805796 21.69684       6.619560 50.88860 8.184766 40.20857 7.010515 10.68003       10.77672 
1 1 1 5   18 36 o 63.76495 3.943142 51.28510       6.097203 49.69929       7.406967 54.61823       10.73842 62.18034 4.928510 63.53933 7.053973 -1.358986      8.605158 
1 1 1 5   18 37 o 55.17641 3.770027 38.62692       5.038681 42.24601       6.875096 34.42728       7.406030 56.87215 5.011927 50.46556 6.148983 6.406590       7.932805 
1 1 1 5   18 38 o 27.98654 6.148283 11.07341       4.078312 15.52607       5.344754 4.867542       6.309855 32.72205 6.919306 20.36878 8.227273 12.35327       10.75011 
1 1 1 5   18 39 o 16.29776 6.348261 3.121094       3.629821 7.712170       4.961703 -2.165166      5.324120 22.26729 7.610631 14.05870 6.518572 8.208591       10.02065 
1 1 1 5   18 40 f 12.35548 5.547894 -0.3523008     3.475894 -0.9112421     4.683525 0.3330388      5.186121 13.63671 6.246845 15.00062 6.752686 -1.363905      9.199013 
1 1 1 5   18 41 o 22.09177 6.839402 8.113831       4.058409 12.21440       6.116130 4.887907       5.424778 25.18075 8.450902 18.13411 7.510537 7.046640       11.30601 
1 1 1 5   18 42 o 22.91043 7.328983 9.697664       4.623796 9.743543       5.550209 9.593597       8.359100 21.97101 7.999751 20.47833 8.923213 1.492682       11.98415 
1 1 1 5   18 43 o 12.19758 5.516614 0.3952372      3.508494 3.642745       5.178135 -2.361004      4.770423 15.74336 6.936625 11.97393 5.734048 3.769436       8.999783 
1 1 1 5   18 44 o 13.36963 5.861048 2.103801       3.654292 7.819613       5.526679 -2.336375      4.871082 18.18956 7.561226 11.74045 5.666044 6.449113       9.448608 
1 1 1 5   18 45 o 10.84303 5.230741 -2.135743      4.140807 -3.549370      5.205207 0.3007947      6.833722 11.29486 5.540135 13.60902 6.602073 -2.314160      8.618611 
1 1 1 5   19 0  o 130.2031 3.081263 206.6161       9.776563 212.9674       18.58023 204.1844       11.49680 132.0183 5.789462 129.3763 3.650231 2.641998       6.844125 
1 1 1 5   19 1  o 424.7895 6.374474 2201.194       65.98637 2404.226       98.57648 2036.357       88.82163 443.6788 9.117348 408.3470 8.925925 35.33179       12.75924 
1 1 1 5   19 2  o 218.0162 4.340520 579.4630       23.06039 599.3625       28.85194 544.2654       38.37153 221.6964 5.340480 211.0442 7.472837 10.65219       9.184989 
1 1 1 5   19 3  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 5   19 4  o 605.3137 12.48410 4487.230       184.1509 4487.230       184.1509 0.000000       0.000000 605.3137 12.48410 ?        ?        0.000000       12.48410 
1 1 1 5   19 5  o 195.1363 3.504237 464.1625       16.66356 443.6120       31.43332 472.1953       19.65227 190.5347 6.780677 196.8020 4.097766 -6.267288      7.922706 
1 1 1 5   19 6  o 133.0887 2.657247 215.8765       8.618052 215.8159       13.34089 215.9200       11.28981 132.9810 4.121772 133.0435 3.485226 -0.6253052E-01 5.397759 
1 1 1 5   19 7  o 585.0614 7.637487 4180.938       108.8900 4141.742       170.5847 4207.893       141.4598 581.2556 12.04306 586.4565 9.898312 -5.200928      15.58883 
1 1 1 5   19 8  o 98.77560 2.491714 118.9892       5.992902 102.2685       8.841162 133.2024       8.151297 91.49535 3.974766 104.4828 3.205235 -12.98741      5.106103 
1 1 1 5   19 9  o 277.3026 4.476153 937.9240       30.24788 963.4131       62.78821 930.2208       34.51727 280.4250 9.200547 276.1164 5.129892 4.308594       10.53403 
1 1 1 5   19 10 o 172.2585 3.311287 361.7807       13.89996 396.8072       30.60723 352.6797       15.60162 180.0713 6.988253 170.0621 3.764664 10.00926       7.937781 
1 1 1 5   19 11 o 343.3242 5.307028 1438.866       44.40091 1455.039       91.05679 1433.821       50.85682 344.0630 10.87387 342.6211 6.091145 1.441833       12.46367 
1 1 1 5   19 12 o 196.4225 3.541578 470.5401       16.95213 469.6405       35.64161 470.8032       19.27152 195.7753 7.484518 196.4505 4.025563 -0.6752014     8.498422 
1 1 1 5   19 13 o 317.1600 4.973648 1228.229       38.44054 1436.805       87.05520 1177.711       42.84362 341.6456 10.46877 310.4720 5.662753 31.17358       11.90218 
1 1 1 5   19 14 o 163.2687 3.199780 325.1186       12.73090 293.9673       26.51569 334.4509       14.51313 154.7976 7.047636 165.5738 3.596941 -10.77625      7.912468 
1 1 1 5   19 15 o 265.7058 3.864417 861.6063       25.02195 922.7391       41.82976 827.5424       31.22444 274.6130 6.250692 260.2698 4.923055 14.34320       7.956609 
1 1 1 5   19 16 o 176.0960 3.257357 378.3155       13.97819 381.2062       28.36739 377.3885       16.06379 176.2979 6.614654 175.8441 3.748730 0.4537964      7.603067 
1 1 1 5   19 17 o 124.1700 2.951663 188.0745       8.931399 194.9137       13.40686 182.6175       11.97576 126.2482 4.364350 122.2301 4.026073 4.018021       5.937745 
1 1 1 5   19 18 o 86.38715 2.813996 91.12768       5.916010 104.2999       9.240842 81.97943       7.701071 92.31871 4.117941 81.84776 3.872054 10.47095       5.652454 
1 1 1 5   19 19 o 206.7536 3.276097 521.7270       16.50615 495.3949       25.99024 539.5274       21.36891 201.1248 5.307479 210.1410 4.172876 -9.016235      6.751462 
1 1 1 5   19 20 o 127.5250 2.923806 198.4455       9.086150 206.7011       20.89565 196.5205       10.09000 129.5859 6.639140 126.8398 3.267092 2.746155       7.399464 
1 1 1 5   19 21 o 41.56534 4.197950 21.33449       4.193902 27.80967       9.778872 19.87505       4.642536 46.67192 8.923112 40.00786 4.861487 6.664063       10.16150 
1 1 1 5   19 22 o 145.3302 3.520989 258.0185       12.46972 256.1201       15.98753 260.9673       19.92530 144.5990 4.542752 145.7586 5.620166 -1.159561      7.226539 
1 1 1 5   19 23 o 48.46334 3.869458 28.89777       4.531898 23.17586       6.294504 35.05608       6.530130 42.99545 6.185401 53.23996 5.095348 -10.24451      8.013847 
1 1 1 5   19 24 o 93.23735 2.961818 106.2665       6.720987 108.7785       9.727480 103.9719       9.296950 94.17393 4.249658 92.07922 4.153963 2.094719       5.942642 
1 1 1 5   19 25 f 113.5520 3.019611 157.6205       8.348269 154.8211       11.81616 160.4106       11.79634 112.3459 4.324088 114.3734 4.239730 -2.027519      6.055827 
1 1 1 5   19 26 f 44.59998 3.874403 24.53234       4.169168 20.63491       5.804828 28.68489       5.991804 40.48659 6.070492 48.04250 5.200779 -7.555904      7.993684 
1 1 1 5   19 27 o 121.0391 3.481410 179.4321       10.25806 188.7562       16.74473 173.8306       12.97862 123.6555 5.571154 118.9304 4.486202 4.725143       7.152885 
1 1 1 5   19 28 f 78.74637 3.388277 76.04621       6.486765 76.02137       8.222033 76.08717       10.55688 78.57732 4.310349 78.34162 5.566018 0.2357025      7.039862 
1 1 1 5   19 29 o 116.1573 3.761350 165.6823       10.63294 180.9901       12.71261 130.0353       19.39946 121.2654 4.308761 101.5199 7.903795 19.74551       9.001966 
1 1 1 5   19 30 o 30.57052 7.233307 12.17736       5.303974 14.51848       6.027465 4.143789       11.16547 33.34645 7.588616 26.44889 10.84610 6.897552       13.23726 
1 1 1 5   19 31 o 60.92056 3.510062 45.75686       5.188862 53.87032       7.066560 36.26400       7.643694 65.90013 4.425999 53.59104 5.953293 12.30909       7.418299 
1 1 1 5   19 32 o 52.85659 3.701107 34.61242       4.737111 35.31924       6.245432 33.65491       7.269051 53.07715 4.883270 51.46992 5.902110 1.607231       7.660367 
1 1 1 5   19 33 o 20.86870 7.437844 5.035896       4.767625 10.13032       8.904655 2.988651       5.644876 28.41327 10.16069 19.60227 7.828467 8.810993       12.82671 
1 1 1 5   19 34 o 26.58169 5.917067 9.358404       3.734267 10.32685       4.783055 7.846604       5.976064 27.63135 7.073933 24.61467 8.353535 3.016680       10.94633 
1 1 1 5   19 35 o 33.30946 7.475727 15.36939       5.918811 15.44149       8.921856 15.31272       7.910102 32.23810 10.16500 32.34768 9.447016 -0.1095734     13.87708 
1 1 1 5   19 36 o 48.28050 4.008547 29.64822       4.673731 31.36214       6.151628 27.30812       7.188041 48.96096 5.237148 44.62420 6.826735 4.336761       8.604187 
1 1 1 5   19 37 f 31.92106 5.267148 13.71212       3.954441 14.19609       5.186422 13.04008       6.111634 31.45526 6.951418 29.28334 8.226519 2.171915       10.77023 
1 1 1 5   19 38 o 33.00083 5.429163 15.02057       4.214403 15.51095       5.551303 14.35345       6.474850 32.12799 7.261810 29.76653 8.503426 2.361458       11.18222 
1 1 1 5   19 39 o 17.25684 6.310988 4.104541       3.459778 2.138548       4.486040 6.990442       5.435166 15.87062 6.717845 21.05357 7.871572 -5.182953      10.34848 
1 1 1 5   19 40 o 17.42627 6.394820 4.467060       3.557014 8.581521       4.906521 -0.9075580E-01 5.164112 22.37870 7.569397 14.55298 6.625569 7.825722       10.05952 
1 1 1 5   19 41 o 10.59754 5.007725 -2.313200      3.401827 -2.546155      4.724758 -2.062445      4.901954 12.36684 5.860919 12.82338 6.044835 -0.4565401     8.419644 
1 1 1 5   19 42 o 14.43282 6.338118 2.066715       4.290153 5.444494       5.170720 -5.395765      7.685585 17.54522 7.305186 13.65075 6.703046 3.894464       9.914463 
1 1 1 5   19 43 o 11.44666 5.319621 -0.5662369     3.576916 7.540806       5.297180 -7.360786      4.849465 18.52329 7.517745 10.08847 5.019559 8.434823       9.039495 
1 1 1 5   19 44 o 13.81919 6.177840 2.466637       4.258779 -1.741416      5.408265 9.335015       6.909465 12.30231 5.945327 18.15183 8.004698 -5.849522      9.971064 
1 1 1 5   20 0  o 321.0947 5.033189 1257.396       39.38333 1148.371       52.44815 1398.343       59.63414 306.7254 7.016885 338.4477 7.230483 -31.72235      10.07554 
1 1 1 5   20 1  o 204.7243 3.306131 510.8836       16.49399 483.6419       24.90395 532.1704       22.01443 199.0680 5.137998 208.9157 4.324144 -9.847763      6.715449 
1 1 1 5   20 2  o 361.4844 5.544343 1594.046       48.84000 1499.982       66.24928 1706.031       72.28514 350.4576 7.757281 373.7337 7.936895 -23.27609      11.09819 
1 1 1 5   20 3  o 324.3766 5.069415 1283.387       40.07222 1242.105       55.31061 1328.994       58.13627 318.9558 7.116097 329.9121 7.231241 -10.95633      10.14543 
1 1 1 5   20 4  o 202.9199 3.631374 501.9979       17.95692 494.3710       24.88833 510.2789       25.93375 201.2541 5.078810 204.4593 5.209262 -3.205215      7.275350 
1 1 1 5   20 5  o 260.1542 4.962627 825.5853       31.46145 844.6350       38.58632 787.8043       54.34083 263.0681 6.019065 253.6715 8.803945 9.396667       10.66483 
1 1 1 5   20 6  o 351.5609 6.273211 1508.897       53.74358 1455.284       63.87159 1638.894       99.45819 345.1012 7.594954 365.4454 11.18132 -20.34421      13.51685 
1 1 1 5   20 7  o 159.0218 3.730460 308.3520       14.45623 301.9398       17.01598 324.9861       27.40626 157.2723 4.444312 162.9595 6.917080 -5.687241      8.221795 
1 1 1 5   20 8  f 183.1354 3.032186 408.8730       13.53207 392.8079       20.88361 420.5002       17.76652 179.3651 4.782107 185.6867 3.926319 -6.321609      6.187449 
1 1 1 5   20 9  o 155.5836 3.191392 295.1377       12.09986 292.5376       25.32173 295.9071       13.77419 154.5726 6.738598 155.7710 3.628633 -1.198456      7.653475 
1 1 1 5   20 10 f 332.8275 5.186738 1352.384       42.06779 1206.579       79.98544 1408.139       49.46127 313.2512 10.49290 339.5092 5.978297 -26.25803      12.07646 
1 1 1 5   20 11 o 237.6827 4.014754 689.2488       23.25372 714.1633       49.17661 682.0735       26.39060 241.2630 8.377050 236.3951 4.581152 4.867950       9.547875 
1 1 1 5   20 12 f 89.63934 3.501986 98.16388       7.635065 96.06642       14.32604 98.99598       9.023335 88.36114 6.703181 89.97314 4.126444 -1.612000      7.871479 
1 1 1 5   20 13 o 261.5406 4.293377 835.0251       27.36366 826.7087       56.26747 837.6012       31.31627 259.2807 8.918633 261.8684 4.907393 -2.587769      10.17961 
1 1 1 5   20 14 o 169.4268 4.727957 350.9067       19.50144 0.000000       0.000000 350.9067       19.50144 ?        ?        169.4268 4.727957 0.000000       4.727957 
1 1 1 5   20 15 o 157.0712 4.403528 301.5525       16.83855 0.000000       0.000000 301.5525       16.83855 ?        ?        157.0712 4.403528 0.000000       4.403528 
1 1 1 5   20 16 o 47.70321 3.255383 27.89424       3.761624 25.26686       6.655363 29.12754       4.559806 45.00179 6.236238 48.69217 3.874766 -3.690380      7.341967 
1 1 1 5   20 17 o 158.1061 3.229975 305.0352       12.44468 300.0551       18.00796 309.5877       17.21752 156.6070 4.724046 159.1143 4.444787 -2.507294      6.486350 
1 1 1 5   20 18 o 86.72987 2.511861 91.82049       5.303256 94.10622       9.488327 90.78202       6.395484 87.63338 4.457723 86.20004 3.049401 1.433342       5.400939 
1 1 1 5   20 19 o 86.68710 2.731189 91.77116       5.762356 92.47169       14.06377 91.62983       6.316941 86.52324 6.722826 86.60004 2.997838 -0.7679749E-01 7.360939 
1 1 1 5   20 20 o 128.0190 2.958294 200.0223       9.228941 208.9847       21.39766 197.9741       10.22931 130.2270 6.765827 127.2935 3.300431 2.933563       7.527898 
1 1 1 5   20 21 o 77.98904 2.644476 74.30249       5.018577 77.70901       8.384842 72.40093       6.264602 79.58746 4.339708 76.92238 3.350019 2.665085       5.482307 
1 1 1 5   20 22 o 54.90816 2.742191 36.88942       3.657583 41.99731       6.909012 34.90049       4.311272 58.34676 4.904538 53.34861 3.332891 4.998150       5.929811 
1 1 1 5   20 23 o 224.6104 3.946229 617.1160       21.59973 598.7438       30.31007 636.0732       30.78881 220.7223 5.639758 227.5993 5.551187 -6.876953      7.913441 
1 1 1 5   20 24 o 162.9505 3.341086 324.5258       13.26721 323.0625       18.98977 325.9212       18.54352 162.2472 4.808237 162.9963 4.673333 -0.7491455     6.705161 
1 1 1 5   20 25 o 123.7722 3.099685 187.3276       9.341892 191.7874       13.50928 183.2406       12.93245 125.0047 4.441818 122.2024 4.349688 2.802315       6.216875 
1 1 1 5   20 26 o 82.73727 3.082896 83.79885       6.204916 92.29320       9.217540 76.75997       8.390770 86.63541 4.380210 78.99000 4.376171 7.645409       6.191697 
1 1 1 5   20 27 o 55.16580 3.490066 37.40469       4.667751 38.64600       6.786851 36.29049       6.429990 55.81948 5.043741 54.09931 4.931491 1.720169       7.054001 
1 1 1 5   20 28 o 34.13512 5.126998 14.67369       4.133153 16.38824       6.847850 13.69114       5.183868 35.47543 8.099811 32.61105 6.745800 2.864376       10.54100 
1 1 1 5   20 29 o 80.33071 4.539777 79.74725       8.850772 83.40856       10.93530 72.79333       15.07051 81.89119 5.511812 75.48487 8.331232 6.406319       9.989470 
1 1 1 5   20 30 o 114.0695 3.155011 159.6976       8.761719 158.2286       12.13693 161.2964       12.66160 113.1540 4.409963 114.1923 4.559211 -1.038292      6.343041 
1 1 1 5   20 31 o 78.05610 3.249219 75.00082       6.166960 79.63629       8.591054 70.07294       8.857862 80.09483 4.418674 74.96449 4.875279 5.130341       6.579743 
1 1 1 5   20 32 o 15.86997 6.667813 0.7446694      4.366852 -3.335769      7.993473 2.480517       5.213603 18.34565 8.309094 18.66820 7.500233 -0.3225441     11.19350 
1 1 1 5   20 33 o 27.10741 5.718154 9.649767       3.658268 14.42385       4.900268 3.639139       5.498379 33.08479 6.308099 19.94866 7.800837 13.13614       10.03221 
1 1 1 5   20 34 o 13.99408 6.017625 0.1119845      3.701864 -0.7234295     4.419909 2.075075       6.775364 14.51290 6.400999 19.74948 8.302117 -5.236580      10.48322 
1 1 1 5   20 35 o 42.48668 5.436165 23.67287       5.499581 16.71843       9.456833 27.22673       6.760282 32.82750 10.47921 45.06796 6.329680 -12.24046      12.24250 
1 1 1 5   20 36 o 29.03979 5.627359 11.44672       3.838473 14.70000       5.024154 6.885221       5.949168 32.45019 6.578903 22.56426 8.271819 9.885935       10.56906 
1 1 1 5   20 37 o 13.62070 5.831476 0.6279660      3.448118 0.6148654      4.506352 0.6464700      5.355633 15.12171 6.570844 16.18967 7.096426 -1.067963      9.671363 
1 1 1 5   20 38 o 16.35780 6.209371 3.326385       3.410756 7.757959       4.402600 -3.326013      5.394104 22.44264 7.148515 13.52492 6.364862 8.917721       9.571454 
1 1 1 5   20 39 o 11.99816 5.416896 -0.5826845     3.365392 -0.2791327E-01 4.578330 -1.234797      4.963769 14.09038 6.343650 13.78732 6.357808 0.3030548      8.981293 
1 1 1 5   20 40 o 14.15145 5.925100 1.915444       3.429778 0.9287593      4.687519 3.052305       5.031618 14.56909 6.499376 16.45071 7.043753 -1.881615      9.584171 
1 1 1 5   20 41 o 15.64472 6.200477 3.537949       3.515076 6.268221       4.913591 0.6760817      5.030612 18.71774 7.357991 14.28399 6.517069 4.433757       9.829151 
1 1 1 5   20 42 o 22.98936 7.253465 10.30622       4.542199 11.43446       5.451412 7.744396       8.214499 22.93997 7.971622 18.38906 8.365919 4.550909       11.55575 
1 1 1 5   20 43 o 13.74948 5.907036 2.517589       3.560882 7.952759       5.271350 -2.044279      4.829328 18.59959 7.517255 11.87758 5.709199 6.722004       9.439496 
1 1 1 5   20 44 o 13.79428 6.032272 2.807512       3.849772 2.438106       5.682661 3.120865       5.233797 14.18209 6.628767 14.42685 6.606862 -0.2447567     9.359015 
1 1 1 5   21 0  o 166.1955 3.001528 336.6922       12.15620 339.9644       18.81025 334.3454       15.92956 166.8873 4.629724 165.5891 3.947625 1.298157       6.084249 
1 1 1 5   21 1  o 47.01441 3.503350 27.09756       3.984900 22.53062       5.596244 31.79493       5.675592 42.61616 5.518152 50.84629 4.631306 -8.230133      7.204096 
1 1 1 5   21 2  o 123.6508 3.494600 186.5587       10.51949 198.0712       12.80560 162.6675       18.44736 127.3772 4.130921 115.2292 6.597123 12.14806       7.783736 
1 1 1 5   21 3  o 203.9555 3.663563 507.2072       18.20854 495.4831       25.09012 520.2529       26.46651 201.4519 5.115013 206.4167 5.265873 -4.964859      7.341170 
1 1 1 5   21 4  o 105.8892 2.909186 136.7860       7.499761 134.5849       10.24822 139.3241       11.00466 104.9744 4.013559 106.7953 4.236931 -1.820847      5.836115 
1 1 1 5   21 5  o 211.1561 3.326506 543.6248       17.11702 566.8960       27.47109 528.8560       21.88462 215.5240 5.230512 208.2215 4.312978 7.302475       6.779383 
1 1 1 5   21 6  o 392.6179 5.318307 1881.606       50.88380 1865.928       79.89784 1892.304       65.99896 390.4545 8.397083 393.4935 6.882773 -3.038971      10.85742 
1 1 1 5   21 7  o 44.28251 3.535045 24.06553       3.783076 19.62574       4.844831 31.00174       6.055623 39.77249 5.117171 50.14857 5.022763 -10.37608      7.170327 
1 1 1 5   21 8  o 270.4210 4.400163 892.3179       28.99648 873.1560       40.26458 912.9618       41.79251 267.3123 6.181134 273.3256 6.274542 -6.013336      8.807740 
1 1 1 5   21 9  o 197.6343 4.159577 476.5973       20.03307 476.0323       24.01969 477.8883       36.30996 197.3917 4.997488 197.4345 7.560841 -0.4273987E-01 9.063178 
1 1 1 5   21 10 f 76.79871 3.487096 72.09148       6.509077 96.70403       13.33815 64.39780       7.457344 88.71832 6.208635 72.51745 4.238409 16.20087       7.517397 
1 1 1 5   21 11 o 224.7549 4.534885 616.7518       24.83771 594.3498       43.45200 627.6238       30.27056 219.9948 8.119081 226.6208 5.481313 -6.625977      9.796135 
1 1 1 5   21 12 o 102.8258 4.000390 129.2447       10.00486 0.000000       0.000000 129.2447       10.00486 ?        ?        102.8258 4.000390 0.000000       4.000390 
1 1 1 5   21 13 o 118.5430 4.035870 171.7442       11.64167 0.000000       0.000000 171.7442       11.64167 ?        ?        118.5430 4.035870 0.000000       4.035870 
1 1 1 5   21 14 o 210.6661 4.346051 542.0257       22.31133 525.8887       39.53638 549.5660       27.02592 206.8085 7.859293 212.0143 5.230932 -5.205826      9.440928 
1 1 1 5   21 15 o 51.65231 3.640152 32.72642       4.552554 37.35049       10.27872 31.59794       5.077768 54.57595 7.963133 50.69769 4.146249 3.878265       8.977909 
1 1 1 5   21 16 o 124.2126 2.956662 188.2317       8.949594 163.8504       19.28098 194.9272       10.10400 115.3620 6.889913 126.3411 3.284590 -10.97911      7.632786 
1 1 1 5   21 17 o 87.64874 2.740758 93.80917       5.846802 72.39510       13.51118 98.74317       6.485496 76.40745 7.346851 89.91013 2.964097 -13.50269      7.922253 
1 1 1 5   21 18 o 52.20164 2.959886 33.35998       3.749835 29.94418       10.47285 33.86229       4.016097 48.44493 9.207656 52.57827 3.148881 -4.133339      9.731207 
1 1 1 5   21 19 o 122.6127 2.944745 183.4848       8.798715 187.1226       20.26256 182.6394       9.767673 123.2020 6.775095 122.2616 3.281389 0.9404144      7.527910 
1 1 1 5   21 20 o 22.91826 4.695580 6.663033       2.534207 17.83968       5.788224 4.012546       2.818722 37.56429 6.561837 18.19134 5.710491 19.37295       8.698701 
1 1 1 5   21 21 o 146.4932 2.795064 261.9467       9.978043 250.4484       16.30050 268.8370       12.61835 142.9367 4.686067 148.3337 3.490816 -5.396957      5.843374 
1 1 1 5   21 22 o 133.9557 2.712800 219.0406       8.855542 203.5216       14.41520 228.4473       11.22294 128.8216 4.599316 136.7341 3.368169 -7.912445      5.700725 
1 1 1 5   21 23 o 107.7208 2.602157 141.6455       6.830763 150.8068       11.88571 137.1273       8.346878 110.8737 4.407848 105.8865 3.238606 4.987228       5.469707 
1 1 1 5   21 24 o 211.0027 3.831814 544.8824       19.70283 571.7576       28.89404 521.5248       26.93682 215.5701 5.504769 205.9242 5.372469 9.645950       7.691938 
1 1 1 5   21 25 o 72.86226 3.180914 65.03101       5.634338 75.12582       8.687373 57.70179       7.402323 78.11190 4.584040 68.44260 4.462520 9.669304       6.397460 
1 1 1 5   21 26 o 51.04737 3.685714 32.07925       4.554041 32.18641       6.897055 31.99642       6.063867 50.78145 5.670073 50.77035 4.964587 0.1110077E-01  7.536368 
1 1 1 5   21 27 o 19.44919 6.336361 4.536979       3.446102 -0.9479238     5.369825 8.377717       4.493483 16.34164 7.135738 25.54247 7.008506 -9.200823      10.00190 
1 1 1 5   21 28 o 154.7424 3.742652 293.8853       14.11318 320.5531       24.63879 280.8627       17.21764 160.4265 6.314753 150.8947 4.688032 9.531769       7.864715 
1 1 1 5   21 29 o 93.37064 4.716063 107.9588       10.69590 103.1273       12.90022 118.5856       19.13189 90.85645 5.857678 96.33655 8.228189 -5.480103      10.10027 
1 1 1 5   21 30 o 50.63055 3.802894 31.75235       4.657764 26.25114       6.447526 37.75701       6.736092 45.44449 5.965993 54.90141 5.092931 -9.456913      7.844171 
1 1 1 5   21 31 o 24.23512 7.147461 7.663112       4.508979 7.297032       8.410260 7.810780       5.341529 25.92574 9.770914 24.67517 7.875568 1.250568       12.54971 
1 1 1 5   21 32 o 14.12666 5.943511 0.5364107      3.477153 1.076587       4.892522 -0.1491085E-01 4.942736 16.88660 7.073915 16.05627 6.929314 0.8303375      9.902306 
1 1 1 5   21 33 o 61.97929 3.877210 48.06043       5.826679 53.83843       7.458652 39.01280       9.333375 65.20876 4.725800 54.06990 7.267333 11.13887       8.668755 
1 1 1 5   21 34 o 61.27061 3.583660 47.03589       5.327397 55.17094       7.437192 38.46268       7.634850 65.75826 4.671535 54.13220 5.882198 11.62605       7.511557 
1 1 1 5   21 35 o 32.07566 6.504752 14.21300       4.910269 7.025044       8.268056 18.12954       6.103122 23.92084 9.500219 35.86969 7.232110 -11.94885      11.93975 
1 1 1 5   21 36 o 22.65729 6.503576 7.319138       3.778690 16.69458       5.087049 -4.221579      5.643991 34.57177 6.268998 13.81211 6.503301 20.75966       9.032899 
1 1 1 5   21 37 o 15.49845 6.114934 2.544791       3.404670 2.400686       4.466411 2.744673       5.260262 16.42980 6.810706 17.46777 7.327322 -1.037977      10.00377 
1 1 1 5   21 38 o 16.12711 6.223477 3.266878       3.463942 3.483391       4.625088 2.990284       5.227561 17.17149 7.003929 17.15940 7.257059 0.1208687E-01  10.08563 
1 1 1 5   21 39 o 13.63426 5.771463 1.421183       3.311352 -0.4808239E-01 4.615690 2.979333       4.753256 13.97681 6.323792 16.42135 6.931209 -2.444538      9.382537 
1 1 1 5   21 40 o 15.40502 6.185423 3.136059       3.543616 1.209061       4.826750 5.389044       5.219071 14.69148 6.571696 18.23095 7.438570 -3.539465      9.925700 
1 1 1 5   21 41 o 27.53507 6.087422 12.38750       3.975963 18.73521       5.997355 7.409991       5.310764 31.29401 7.872477 19.31804 7.632434 11.97597       10.96494 
1 1 1 5   21 42 o 20.11209 7.224588 8.361332       4.507374 11.82439       5.351831 -0.8925179E-01 8.360190 23.00256 7.902886 14.95599 7.266356 8.046567       10.73571 
1 1 1 5   21 43 o 14.82039 6.128646 3.751094       3.604535 3.128541       5.144140 4.351609       5.052268 14.63921 6.644376 15.43978 6.825198 -0.8005705     9.525286 
1 1 1 5   22 0  o 39.86725 3.945871 19.57394       3.783267 19.85897       5.344731 19.28771       5.355981 39.93914 5.649002 39.33298 5.758420 0.6061592      8.066637 
1 1 1 5   22 1  o 442.0092 5.942816 2385.846       64.01175 2627.091       107.4169 2252.998       79.71130 463.0069 9.520267 429.2175 7.620903 33.78940       12.19482 
1 1 1 5   22 2  o 40.13968 3.996243 19.84609       3.857090 21.17169       5.268949 18.31550       5.661704 41.30191 5.361414 38.22314 6.297454 3.078770       8.270592 
1 1 1 5   22 3  o 209.7746 3.736760 536.6921       19.10223 564.1113       27.45957 510.9808       26.59065 214.9675 5.241854 204.5174 5.339915 10.45006       7.482762 
1 1 1 5   22 4  o 214.4585 3.777614 560.9666       19.74226 542.8126       27.19304 581.1996       28.70807 210.7895 5.298063 218.1754 5.399605 -7.385986      7.564734 
1 1 1 5   22 5  o 267.0466 3.914867 869.9338       25.47652 835.9016       39.18948 894.8432       33.52789 261.5477 6.148688 270.7349 5.081897 -9.187195      7.976969 
1 1 1 5   22 6  o 201.9818 3.253176 497.5117       16.01238 498.7953       25.10974 496.6320       20.78752 202.0517 5.103775 201.7436 4.228311 0.3080902      6.627755 
1 1 1 5   22 7  o 280.3674 4.046089 959.1313       27.64388 965.0858       43.76027 955.1773       35.66018 280.9383 6.391944 279.6555 5.232679 1.282837       8.260622 
1 1 1 5   22 8  o 238.6732 3.599995 694.9240       20.93831 747.2206       34.38131 664.0933       26.39832 247.2657 5.705877 233.2253 4.644774 14.04044       7.357374 
1 1 1 5   22 9  o 45.87644 3.000599 25.77656       3.336135 38.30152       5.093482 16.36638       4.414949 55.90130 3.760897 36.24413 5.142870 19.65717       6.371300 
1 1 1 5   22 10 o 243.0967 5.802133 722.6526       34.37184 0.000000       0.000000 722.6526       34.37184 ?        ?        243.0967 5.802133 0.000000       5.802133 
1 1 1 5   22 11 o 70.54953 3.339965 60.85786       5.725814 0.000000       0.000000 60.85786       5.725814 ?        ?        70.54953 3.339965 0.000000       3.339965 
1 1 1 5   22 12 o 121.6912 2.958121 180.6287       8.772256 190.1752       19.58920 178.2341       9.810958 124.4484 6.481727 120.8187 3.335470 3.629715       7.289592 
1 1 1 5   22 13 o 139.6303 3.063333 237.8453       10.42341 251.1270       23.15819 234.4711       11.67261 142.9988 6.663955 138.6133 3.455630 4.385529       7.506642 
1 1 1 5   22 14 o 169.7800 3.950517 351.9819       16.34468 378.3710       30.14049 340.9889       19.45342 175.4737 7.063022 166.9553 4.786392 8.518417       8.532047 
1 1 1 5   22 15 o 210.9259 3.740364 543.2341       19.22560 599.9304       42.40060 528.5607       21.57046 220.7161 7.895910 207.9928 4.255738 12.72324       8.969767 
1 1 1 5   22 16 o 141.2697 3.070574 243.5440       10.57072 275.9880       24.68752 236.2604       11.69725 149.7865 6.781043 139.1129 3.450485 10.67355       7.608442 
1 1 1 5   22 17 o 62.61221 2.899430 47.93988       4.411913 48.48906       12.14595 47.85640       4.735361 62.19476 8.214507 62.53994 3.116954 -0.3451805     8.785985 
1 1 1 5   22 18 o 79.75867 2.728088 77.71272       5.294593 78.95452       9.064350 77.06962       6.523059 80.19643 4.658208 79.37223 3.380198 0.8241959      5.755401 
1 1 1 5   22 19 o 71.89352 2.577964 63.14622       4.509196 78.82183       8.940847 57.79893       5.221955 80.12241 4.598505 68.73308 3.125859 11.38933       5.560328 
1 1 1 5   22 20 o 120.4995 2.651313 177.2044       7.785424 200.1073       13.88406 166.7000       9.402821 127.7847 4.465495 116.7748 3.307583 11.00990       5.557045 
1 1 1 5   22 21 o 109.9491 2.606835 147.5445       6.984599 159.6131       12.31190 141.8172       8.481520 114.0902 4.436795 107.6968 3.235397 6.393379       5.491169 
1 1 1 5   22 22 o 30.98907 3.993405 11.94320       2.945669 14.57786       6.222813 11.18234       3.344061 33.66166 7.746901 29.84037 4.758380 3.821293       9.091571 
1 1 1 5   22 23 f 124.9410 3.166612 190.8949       9.633538 180.4462       13.78620 200.8657       13.46716 121.2098 4.676126 127.9657 4.324847 -6.755920      6.369493 
1 1 1 5   22 24 o 42.93377 3.966100 22.76743       4.102647 28.42038       6.831384 19.57837       5.130998 47.64383 6.017915 39.52341 5.474143 8.120419       8.135203 
1 1 1 5   22 25 o 139.0111 2.775213 236.1364       9.401168 246.3019       15.85919 230.6290       11.67329 141.5405 4.604075 137.2206 3.493745 4.319870       5.779599 
1 1 1 5   22 26 o 119.2861 3.468265 174.4117       10.07110 205.9133       18.42460 160.9891       12.02683 128.9206 5.880098 114.4106 4.321457 14.51007       7.297297 
1 1 1 5   22 27 o 46.79752 4.291121 27.15141       4.839192 39.87427       9.211160 22.30113       5.687287 56.15224 6.874718 42.07673 5.692481 14.07551       8.925586 
1 1 1 5   22 28 o 82.81470 3.950417 84.53362       7.949365 92.54124       9.633013 67.43980       14.07441 86.48748 4.586999 72.58754 8.094247 13.89994       9.303622 
1 1 1 5   22 29 o 54.58841 4.535685 37.09846       5.979185 35.58578       6.929444 41.50715       11.82985 53.21430 5.419132 56.16777 8.942360 -2.953465      10.45623 
1 1 1 5   22 30 o 44.71238 5.665107 25.43616       6.034304 0.000000       0.000000 25.43616       6.034304 ?        ?        44.71238 5.665107 0.000000       5.665107 
1 1 1 5   22 31 f 41.91497 4.406629 22.10533       4.433785 22.54708       6.294341 21.67026       6.246571 41.63538 6.408972 40.76381 6.506910 0.8715744      9.133170 
1 1 1 5   22 32 o 51.60729 4.170863 33.46141       5.200678 30.57561       6.592848 38.21531       8.461846 48.70381 5.660188 54.03623 6.560273 -5.332420      8.664578 
1 1 1 5   22 33 o 20.86578 6.634821 5.727658       3.793933 7.808703       5.220906 3.399100       5.522665 24.04203 7.796728 19.44292 7.750427 4.599113       10.99355 
1 1 1 5   22 34 o 48.19476 3.970038 29.49925       4.621316 21.65481       6.059836 40.40259       7.144299 39.93271 6.446762 55.58856 5.339567 -15.65585      8.370885 
1 1 1 5   22 35 o 58.58710 4.371046 44.35397       6.195586 46.19767       11.20181 43.54140       7.436583 55.70575 8.522398 57.20646 5.398316 -1.500706      10.08826 
1 1 1 5   22 36 o 16.53211 6.265389 3.243967       3.469198 2.929958       4.597719 3.659095       5.286436 17.19584 6.994652 18.45329 7.502444 -1.257460      10.25728 
1 1 1 5   22 37 o 23.10472 6.438604 8.034077       3.759886 5.269516       5.030159 11.53423       5.659947 19.35541 7.491454 26.38358 8.060521 -7.028179      11.00427 
1 1 1 5   22 38 o 22.82541 6.724791 8.267519       3.993174 19.15250       6.732400 2.359859       4.959797 33.20320 8.334368 16.21504 6.968941 16.98816       10.86406 
1 1 1 5   22 39 o 14.25007 5.925200 2.069698       3.395090 3.451806       4.890801 0.7842416      4.716694 16.65027 7.029458 14.45803 6.479629 2.192241       9.560275 
1 1 1 5   22 40 o 16.72868 6.321692 4.446051       3.525886 6.818089       5.038172 2.169148       4.936105 19.18944 7.477817 15.16586 6.723081 4.023575       10.05572 
1 1 1 5   22 41 o 13.82510 5.919421 2.231984       3.553387 0.4153041      4.975255 4.123563       5.076780 13.58411 6.299511 16.08117 6.981153 -2.497069      9.403209 
1 1 1 5   22 42 o 14.68111 6.649508 2.799016       5.119617 2.799016       5.119617 0.000000       0.000000 14.68111 6.649508 ?        ?        0.000000       6.649508 
1 1 1 5   23 0  o 71.80334 2.846376 62.95895       4.970633 60.56914       7.295146 65.02985       6.790975 70.32458 4.277098 72.91217 3.835536 -2.587593      5.744989 
1 1 1 5   23 1  o 52.98661 3.264806 34.36814       4.195131 31.86620       5.937185 36.86273       5.928446 50.86225 4.848750 54.77676 4.480394 -3.914513      6.601841 
1 1 1 5   23 2  o 422.9221 6.386771 2186.787       65.82303 2135.487       91.55660 2241.667       94.69854 417.2317 9.004846 427.4509 9.091194 -10.21924      12.79598 
1 1 1 5   23 3  o 194.1514 4.164844 459.9793       19.70495 459.0997       23.74927 461.9229       35.30100 193.8341 5.032125 194.0964 7.477329 -0.2623138     9.012920 
1 1 1 5   23 4  o 256.0617 4.888844 800.6227       30.50611 797.2784       37.29428 807.3851       53.03185 255.3888 5.992448 256.4477 8.497712 -1.058929      10.39810 
1 1 1 5   23 5  o 121.7144 2.703171 180.6295       8.017732 180.8889       12.28413 180.4369       10.58272 121.6747 4.149004 121.5658 3.576204 0.1089478      5.477542 
1 1 1 5   23 6  o 302.4818 4.824956 1117.385       35.56549 1111.076       49.88156 1123.910       50.72340 301.2868 6.793972 303.0066 6.869421 -1.719757      9.661626 
1 1 1 5   23 7  o 127.4930 2.684388 198.2001       8.340032 213.8920       13.34898 188.1534       10.68126 132.3107 4.145272 124.1355 3.534540 8.175240       5.447592 
1 1 1 5   23 8  o 110.8452 3.313165 150.0193       8.939402 159.2823       14.34952 144.1443       11.42793 114.0521 5.176445 108.5698 4.328064 5.482292       6.747424 
1 1 1 5   23 9  o 120.7602 2.853816 177.8529       8.398192 162.0660       14.89222 185.2146       10.16950 115.0202 5.327585 123.1638 3.391516 -8.143616      6.315501 
1 1 1 5   23 10 o 178.6854 3.443979 389.5891       14.99636 376.7109       30.60437 393.6583       17.20321 175.1428 7.185854 179.5772 3.931172 -4.434464      8.190886 
1 1 1 5   23 11 o 121.7873 3.006409 180.9311       8.922495 187.5549       19.53907 179.1859       10.02925 123.5644 6.511936 121.1314 3.400992 2.432976       7.346568 
1 1 1 5   23 12 o 255.9534 4.265048 800.2009       26.60240 868.3035       57.40278 781.5739       30.02083 265.3883 8.888497 252.8619 4.871954 12.52638       10.13614 
1 1 1 5   23 13 o 91.10897 2.902468 101.3686       6.435913 79.13004       13.44009 107.9853       7.331103 80.00776 6.962681 94.01594 3.204550 -14.00818      7.664729 
1 1 1 5   23 14 o 314.5273 4.996675 1210.130       38.29795 1413.994       85.99380 1159.691       42.77413 337.5979 10.46541 307.7194 5.704141 29.87851       11.91897 
1 1 1 5   23 15 o 83.76656 2.855596 85.71339       5.820603 107.5162       14.42895 81.47586       6.361143 93.40237 6.377553 81.63986 3.203618 11.76251       7.136971 
1 1 1 5   23 16 o 147.0289 3.500490 263.9898       12.54202 273.5443       24.88850 260.7377       14.52051 149.0355 6.871371 146.0046 4.085134 3.030853       7.994001 
1 1 1 5   23 17 o 132.5449 3.359100 214.6710       10.84107 224.3059       22.24847 211.6711       12.41462 134.9032 6.789537 131.5525 3.876790 3.350693       7.818396 
1 1 1 5   23 18 o 138.8386 3.076128 235.3426       10.40760 200.8241       21.74278 245.6024       11.85383 127.5272 7.023545 141.7979 3.430461 -14.27074      7.816537 
1 1 1 5   23 19 o 119.2464 2.676221 173.5460       7.776843 167.5921       13.29889 176.6400       9.586881 116.8926 4.678108 120.2110 3.275685 -3.318329      5.710937 
1 1 1 5   23 20 o 91.13960 2.599263 101.4618       5.766995 118.4774       10.98705 94.99108       6.775375 98.24342 4.602036 88.12958 3.159942 10.11385       5.582469 
1 1 1 5   23 21 o 100.2627 2.624694 122.7992       6.407382 117.0019       11.08139 125.7109       7.853268 97.59271 4.673095 101.3848 3.182584 -3.792053      5.653906 
1 1 1 5   23 22 o 142.8945 3.292151 249.6016       11.46387 253.6602       16.70726 245.9907       15.75899 143.7166 4.777122 141.5714 4.573905 2.145157       6.613736 
1 1 1 5   23 23 o 159.1558 3.340350 309.7942       12.95539 312.9489       19.03627 307.0724       17.68197 159.5480 4.901962 158.1274 4.593545 1.420578       6.717878 
1 1 1 5   23 24 o 15.82137 5.611669 2.676146       2.710870 -3.907823      5.766720 4.543818       3.071393 15.13218 6.931821 19.21369 5.950127 -4.081513      9.135324 
1 1 1 5   23 25 o 65.47855 2.948004 52.53746       4.691891 49.49779       10.65003 53.26950       5.226411 62.69838 7.094940 65.89207 3.265045 -3.193695      7.810166 
1 1 1 5   23 26 o 70.43728 2.707422 60.76102       4.638582 60.78816       8.399485 60.74911       5.563976 70.03824 4.953270 70.35100 3.254296 -0.3127594     5.926662 
1 1 1 5   23 27 o 42.78121 3.358619 22.58325       3.473411 25.98976       6.630489 21.29486       4.077693 45.29501 6.167041 41.40641 4.094762 3.888603       7.402667 
1 1 1 5   23 28 o 87.07779 3.923735 93.58684       8.304741 98.64800       10.02495 82.51637       14.82655 89.18516 4.628520 80.30699 7.669227 8.878166       8.957691 
1 1 1 5   23 29 o 39.90984 5.252396 20.19361       4.984392 15.36858       10.08430 21.75347       5.733753 33.76827 10.82565 41.25708 5.868304 -7.488811      12.31389 
1 1 1 5   23 30 o 42.33347 4.556466 22.57109       4.626618 26.91537       6.374366 17.73456       6.725822 45.82379 5.840920 36.34204 7.826081 9.481747       9.765444 
1 1 1 5   23 31 o 37.29459 5.344133 17.91696       4.718277 33.76333       8.775439 11.47315       5.595969 50.39921 7.362367 28.99507 7.764990 21.40414       10.70044 
1 1 1 5   23 32 o 20.26861 6.622468 5.297580       3.762986 8.689761       5.323032 1.908880       5.320300 25.22355 7.836792 17.93894 7.434522 7.284607       10.80220 
1 1 1 5   23 33 o 19.66548 6.642598 5.000340       3.778531 6.276481       5.159698 3.524476       5.548792 21.95458 7.746127 19.38223 7.754498 2.572348       10.96060 
1 1 1 5   23 34 o 43.00397 5.042236 24.34318       5.183823 29.01929       9.280926 22.22287       6.249533 43.77346 9.001281 40.02517 6.639925 3.748291       11.18533 
1 1 1 5   23 35 o 35.95495 6.019742 17.99461       5.088107 30.78089       9.856742 13.34977       5.940825 43.50774 9.558447 29.41840 8.053159 14.08934       12.49869 
1 1 1 5   23 36 o 31.24806 5.533920 13.70776       4.059766 16.31244       5.644536 10.91633       5.843379 32.64544 7.280752 25.78462 8.238044 6.860815       10.99430 
1 1 1 5   23 37 o 19.04424 6.519428 5.457457       3.641219 5.882632       5.416761 5.106946       4.918190 19.72577 7.734151 18.82701 7.373219 0.8987598      10.68557 
1 1 1 5   23 38 o 31.58220 6.155295 15.21334       4.566954 23.24735       6.261695 6.082550       6.675438 38.13967 6.994886 19.56543 8.233651 18.57424       10.80377 
1 1 1 5   23 39 o 12.36610 5.539456 0.1835662      3.442792 7.316972       5.197934 -5.391575      4.595262 19.95038 7.643013 10.88190 5.309315 9.068478       9.306152 
1 1 1 5   23 40 o 13.69388 5.823902 2.039908       3.398671 1.950389       5.045339 2.114274       4.598562 14.79204 6.659459 14.62480 6.485870 0.1672382      9.295961 
1 1 1 5   23 41 o 10.06921 4.894239 -3.694267      3.803797 -5.461916      4.858225 -0.8940314     6.114724 10.71406 5.274483 13.55328 6.490772 -2.839213      8.363629 
1 1 1 5   23 42 f 17.68915 7.004492 6.731234       4.482043 6.377458       5.418142 7.498092       7.977076 16.92678 7.279454 17.01509 7.919870 -0.8830833E-01 10.75708 
1 1 1 5   24 0  o 136.2176 3.236920 226.3167       10.74487 257.0724       21.63935 216.2523       12.37871 144.8572 6.144060 133.0729 3.821199 11.78427       7.235401 
1 1 1 5   24 1  o 175.5690 3.519932 376.0407       15.05976 368.7762       29.08646 378.7014       17.60291 173.4283 6.896070 176.1505 4.100763 -2.722183      8.023218 
1 1 1 5   24 2  o 161.4572 3.320487 317.9835       13.06458 334.4683       18.79564 302.5739       18.17232 165.4343 4.666914 157.3342 4.745124 8.100067       6.655546 
1 1 1 5   24 3  o 174.9448 3.427375 373.3675       14.61163 408.6125       21.25297 341.7758       20.12138 182.8495 4.773768 167.1976 4.943890 15.65186       6.872475 
1 1 1 5   24 4  o 386.4176 5.916053 1826.148       55.70895 1941.144       81.57977 1725.667       76.25793 397.6422 8.418871 374.9472 8.346008 22.69498       11.85467 
1 1 1 5   24 5  o 282.8490 4.585020 977.0571       31.60327 1021.430       63.65408 962.5412       36.40738 288.0912 9.078259 280.6272 5.323823 7.464081       10.52416 
1 1 1 5   24 6  o 409.4380 6.198495 2051.528       61.84585 2011.444       120.8120 2065.763       71.99462 402.6582 12.32677 410.5453 7.196193 -7.887146      14.27356 
1 1 1 5   24 7  o 18.60492 5.768780 4.210156       2.886001 6.463810       4.087657 1.970203       4.075213 22.84665 6.822308 16.98408 6.693458 5.862577       9.557524 
1 1 1 5   24 8  o 127.9309 2.701565 199.5942       8.422230 207.5947       13.20710 194.1107       10.93397 130.3231 4.163969 126.0694 3.562607 4.253716       5.480037 
1 1 1 5   24 9  o 180.9851 3.068551 399.5948       13.53357 372.6152       20.48357 420.4962       18.02921 174.5471 4.820287 185.5807 3.986647 -11.03352      6.255280 
1 1 1 5   24 10 o 140.1362 3.746275 239.9084       12.78193 227.8449       22.15401 245.9279       15.64928 136.1692 6.696864 141.7989 4.534655 -5.629669      8.087711 
1 1 1 5   24 11 o 262.1166 4.364758 839.4579       27.87988 821.7302       56.20474 845.2435       32.10862 258.0423 8.951673 262.9026 5.011765 -4.860291      10.25915 
1 1 1 5   24 12 o 138.5026 3.113058 234.0856       10.50706 204.5793       21.48772 243.3575       12.04531 128.9281 6.863959 141.1909 3.500862 -12.26285      7.705191 
1 1 1 5   24 13 o 151.1113 3.202725 278.6982       11.79377 298.0508       25.77217 273.5721       13.26410 155.6620 6.810590 149.6786 3.636487 5.983414       7.720633 
1 1 1 5   24 14 o 278.6332 5.198563 950.4733       35.29818 1032.652       66.52663 918.2728       41.64337 288.6966 9.469033 273.5847 6.246231 15.11197       11.34363 
1 1 1 5   24 15 o 138.3280 3.448935 233.6694       11.62602 241.6104       22.78410 230.8738       13.51840 140.0689 6.694422 137.3816 4.042343 2.687302       7.820219 
1 1 1 5   24 16 o 145.8669 3.140913 259.7697       11.16474 247.8841       23.76157 263.1371       12.64786 141.7876 6.897727 146.7701 3.536253 -4.982483      7.751369 
1 1 1 5   24 17 o 236.5488 4.071788 684.2507       23.47156 816.8302       54.50504 654.0675       26.00646 256.6541 8.727394 231.1537 4.616833 25.50034       9.873324 
1 1 1 5   24 18 o 91.76876 2.861907 102.9081       6.392273 113.2213       15.19822 100.6916       7.045774 95.69729 6.556756 90.74210 3.191247 4.955185       7.292127 
1 1 1 5   24 19 o 115.9050 2.973516 164.1575       8.391695 158.6863       19.21302 165.4473       9.328536 113.2164 6.998067 116.3218 3.294230 -3.105392      7.734656 
1 1 1 5   24 20 o 189.4709 3.193763 438.6440       14.74624 448.7148       24.63025 433.0172       18.41049 191.0939 5.294250 188.0983 4.016467 2.995590       6.645381 
1 1 1 5   24 21 o 131.8106 3.269311 212.3792       10.50129 207.1192       15.15218 217.2408       14.56723 129.8400 4.797091 133.0442 4.499562 -3.204224      6.577092 
1 1 1 5   24 22 f 120.4425 2.735529 177.2007       8.028918 166.2397       13.63941 183.0128       9.932061 116.2503 4.825148 122.2815 3.336173 -6.031174      5.866183 
1 1 1 5   24 23 o 93.58144 2.682384 107.0783       6.110805 92.73290       10.47681 114.4750       7.523039 86.70122 4.979647 96.69251 3.197142 -9.991295      5.917651 
1 1 1 5   24 24 o 183.3426 3.466621 411.6706       15.48837 429.7757       32.51615 406.3572       17.61509 185.6404 7.201367 182.0108 3.971473 3.629623       8.223885 
1 1 1 5   24 25 o 175.5932 3.086006 377.4533       13.20506 366.4634       21.44860 384.1616       16.75745 172.2404 5.115750 176.9034 3.887189 -4.662964      6.425039 
1 1 1 5   24 26 o 32.80527 4.004578 13.42545       3.135096 15.80169       6.365322 12.66439       3.602330 34.77426 7.713492 31.68181 4.817472 3.092449       9.094284 
1 1 1 5   24 27 o 15.22188 6.013988 1.673300       3.297241 6.493286       5.759616 -0.6764165     4.021410 23.55496 8.193365 14.13699 6.174065 9.417968       10.25916 
1 1 1 5   24 28 o 63.72486 3.408772 50.11484       5.274239 50.31806       8.140312 49.96781       6.924191 63.28303 5.328027 63.32996 4.516306 -0.4693222E-01 6.984619 
1 1 1 5   24 29 o 101.2105 2.951151 126.0755       7.270918 118.6912       11.34291 131.2260       9.473104 97.40181 4.793554 102.9293 3.783177 -5.527504      6.106603 
1 1 1 5   24 30 o 29.59452 5.508082 11.41306       3.826206 3.819946       5.712730 17.59030       5.152654 20.32659 7.950616 36.74245 5.958683 -16.41586      9.935703 
1 1 1 5   24 31 o 44.01345 4.215138 24.49450       4.465806 23.30829       6.616633 25.48697       6.052243 41.79909 6.723831 44.23904 5.749944 -2.439945      8.847133 
1 1 1 5   24 32 o 49.01152 4.630388 30.79249       5.464779 45.27023       10.09878 24.79761       6.498437 57.50840 7.375717 42.98979 6.397740 14.51861       9.763824 
1 1 1 5   24 33 o 44.35167 4.289248 25.29995       4.578041 27.50608       6.636423 23.29693       6.323556 45.03250 6.212809 41.19227 6.516063 3.840229       9.003226 
1 1 1 5   24 34 o 18.28143 7.005600 3.964254       4.367913 5.564711       8.428390 3.376588       5.107258 22.19586 9.290408 18.28144 7.395494 3.914427       11.87455 
1 1 1 5   24 35 o 27.34955 5.955570 10.70562       3.856524 15.76477       5.779024 6.643734       5.178203 32.01088 7.534409 21.20151 7.725886 10.80938       10.79151 
1 1 1 5   24 36 o 24.40792 6.372431 9.025668       3.830422 5.050900       5.341252 13.23430       5.496137 19.06900 7.615180 28.40471 7.733750 -9.335711      10.85366 
1 1 1 5   24 37 o 26.10785 5.948729 10.26881       3.700016 16.10568       5.679656 5.965384       4.876842 31.10756 7.566085 19.43712 7.413815 11.67044       10.59294 
1 1 1 5   24 38 o 12.64075 5.615452 0.3618536      3.461675 1.284358       5.308011 -0.3208722     4.566366 15.22042 6.843304 13.48709 6.174522 1.733327       9.217133 
1 1 1 5   24 39 f 24.17237 6.917603 10.36874       4.281322 7.936899       5.703592 13.50756       6.479826 19.86757 7.890505 24.63981 8.681800 -4.772243      11.73174 
1 1 1 5   24 40 o 12.39909 5.664822 0.2544546      3.817774 -1.280077      5.000438 2.399095       5.911495 12.67387 6.013153 15.18171 6.978060 -2.507840      9.211478 
1 1 1 5   24 41 o 18.82761 6.626343 6.951600       3.773993 8.323035       5.526950 5.753538       5.165800 18.74984 7.653112 16.75519 7.154642 1.994654       10.47659 
1 1 1 5   25 0  o 308.7248 4.437040 1163.887       33.38113 1095.394       50.33495 1217.661       44.59976 299.0328 6.907401 315.5288 5.800392 -16.49606      9.019797 
1 1 1 5   25 1  o 204.2101 3.800016 508.9480       18.91031 480.4015       35.15050 520.5753       22.43332 197.8317 7.303746 206.4658 4.458710 -8.634125      8.557149 
1 1 1 5   25 2  o 151.9872 4.667166 282.4337       17.26559 0.000000       0.000000 282.4337       17.26559 ?        ?        151.9872 4.667166 0.000000       4.667166 
1 1 1 5   25 3  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 5   25 4  o 171.9376 3.420834 360.7125       14.33306 335.5646       19.38324 391.0538       21.29080 165.6528 4.806744 178.8249 4.890303 -13.17210      6.857102 
1 1 1 5   25 5  o 93.31487 3.455411 106.4005       7.843970 109.1794       9.185500 98.91637       15.07433 94.48231 3.998519 89.56692 6.961055 4.915390       8.027730 
1 1 1 5   25 6  f 56.34671 3.052756 38.84452       4.176109 44.42722       6.278529 34.41496       5.592622 60.15910 4.311312 52.90159 4.377359 7.257504       6.143996 
1 1 1 5   25 7  f 204.5930 3.315221 510.7715       16.52873 496.4531       25.45164 521.2145       21.73595 201.4242 5.189551 206.5682 4.317965 -5.143951      6.751019 
1 1 1 5   25 8  o 176.4898 3.053641 380.0273       13.13329 365.1107       20.05682 391.2238       17.37671 172.7635 4.768586 178.9885 3.983882 -6.225006      6.213753 
1 1 1 5   25 9  o 76.89151 2.951838 72.23721       5.520770 66.71234       7.292872 79.65305       8.449240 73.79249 4.071334 80.62751 4.316024 -6.835022      5.933280 
1 1 1 5   25 10 o 78.96252 3.086412 76.19945       5.927530 96.68491       13.24635 71.07033       6.628183 88.60564 6.173388 76.21375 3.578819 12.39190       7.135731 
1 1 1 5   25 11 o 224.5099 3.944526 615.7205       21.58074 552.0345       41.79028 638.8801       25.20102 211.5615 8.121004 228.6015 4.523795 -17.04004      9.295989 
1 1 1 5   25 12 o 79.62496 3.332450 77.53556       6.451904 76.72983       12.68750 77.81660       7.493086 78.77499 6.671934 79.71869 3.868683 -0.9437027     7.712420 
1 1 1 5   25 13 o 164.4941 3.758982 330.5525       15.06804 303.2927       26.79220 343.1636       18.22314 156.9039 7.024917 167.4534 4.469736 -10.54948      8.326343 
1 1 1 5   25 14 o 54.68112 3.580834 36.67905       4.745276 32.70904       10.30079 37.74851       5.346363 50.76631 8.635348 55.43223 3.984436 -4.665920      9.510257 
1 1 1 5   25 15 o 49.34853 3.387863 29.88288       4.049424 47.84514       10.44401 26.70481       4.393075 61.95691 7.042188 46.57941 3.906191 15.37749       8.052996 
1 1 1 5   25 16 o 75.02250 2.964881 68.82066       5.409771 67.10941       12.53969 69.21199       5.996499 73.47124 7.091828 75.20634 3.279840 -1.735107      7.813538 
1 1 1 5   25 17 o 99.82510 2.929989 121.7728       7.119864 117.7993       16.29043 122.7110       7.915944 97.53571 6.898327 100.1761 3.246956 -2.640434      7.624280 
1 1 1 5   25 18 o 111.2819 2.956679 151.3354       8.010874 163.3608       18.58518 148.5913       8.877938 114.9452 6.663549 110.2264 3.308890 4.718811       7.439868 
1 1 1 5   25 19 o 61.31874 3.074949 46.04953       4.580144 42.65136       11.61298 46.67549       4.984164 58.01389 8.463592 61.70835 3.326755 -3.694466      9.093937 
1 1 1 5   25 20 f 81.85415 3.470032 82.08625       6.905958 83.67831       14.43760 81.61391       7.863949 81.88818 7.311829 81.54913 3.969096 0.3390579      8.319650 
1 1 1 5   25 21 o 29.46872 4.318217 10.87009       3.009013 11.22646       6.974098 10.78858       3.335438 29.75871 8.917101 29.25992 4.847391 0.4987869      10.14948 
1 1 1 5   25 22 f 98.86018 2.906409 119.5635       6.994271 144.0927       16.74065 114.3763       7.698378 107.7371 6.405241 96.63737 3.273750 11.09975       7.193368 
1 1 1 5   25 23 o 78.62342 2.696558 75.64509       5.158869 87.36378       9.909378 71.28810       6.042261 84.11243 4.855115 76.24622 3.259480 7.866203       5.847764 
1 1 1 5   25 24 o 95.28481 2.657678 111.0999       6.165066 114.4864       10.92504 109.5176       7.467689 96.30212 4.669251 94.50368 3.247485 1.798439       5.687536 
1 1 1 5   25 25 o 59.88354 2.868497 44.00349       4.173816 44.71473       7.835843 43.72176       4.931658 59.83101 5.433512 59.60467 3.409511 0.2263451      6.414657 
1 1 1 5   25 26 o 104.2872 3.674577 133.9334       9.323850 123.7499       16.82167 138.4495       11.20207 98.85464 7.028750 105.8083 4.353826 -6.953659      8.267958 
1 1 1 5   25 27 o 48.44573 3.848217 29.13532       4.505785 32.18902       7.155553 27.12895       5.800100 50.32196 5.950076 46.37395 5.223197 3.948009       7.917398 
1 1 1 5   25 28 o 60.87409 3.101303 45.72242       4.585422 55.62213       8.157351 41.14928       5.544279 66.49358 5.072519 57.50559 3.980961 8.987995       6.448139 
1 1 1 5   25 29 o 111.4191 2.742444 152.7296       7.446181 147.8420       12.50549 155.4142       9.268279 108.4947 4.741393 112.0570 3.398021 -3.562325      5.833297 
1 1 1 5   25 30 o 17.46297 5.787825 3.787097       2.870408 10.37237       5.988028 1.822465       3.270675 27.39238 8.274972 15.11918 5.984579 12.27320       10.21226 
1 1 1 5   25 31 o 28.72883 5.727514 11.02656       3.869017 12.16685       5.938498 10.18557       5.099963 29.23303 8.071134 26.97365 7.492009 2.259380       11.01242 
1 1 1 5   25 32 o 60.52373 3.547432 46.16166       5.209158 51.32021       7.802988 42.01430       6.996540 62.70689 5.151727 56.73106 5.115788 5.975838       7.260273 
1 1 1 5   25 33 o 24.07910 6.936360 8.378628       4.291078 1.957004       7.722071 11.24743       5.161332 19.54908 8.546246 27.56967 7.489545 -8.020594      11.36361 
1 1 1 5   25 34 o 14.85323 6.492970 0.5224019      4.456676 0.000000       0.000000 0.5224019      4.456676 ?        ?        14.85323 6.492970 0.000000       6.492970 
1 1 1 5   25 35 o 27.88500 5.693667 11.18145       3.738002 7.555467       5.316006 14.72760       5.257151 21.78245 7.843243 30.81670 7.140489 -9.034250      10.60674 
1 1 1 5   25 36 o 9.936838 4.733513 -3.041317      3.161402 -2.736735      4.617138 -3.310151      4.337726 12.48731 5.880305 11.78412 5.593771 0.7031889      8.115927 
1 1 1 5   25 37 o 12.84671 5.638206 0.6165554      3.390348 1.355019       4.861994 -0.8238038E-01 4.730079 15.03141 6.667472 13.92627 6.340548 1.105139       9.200964 
1 1 1 5   25 38 o 12.80606 5.659069 0.7606289      3.470544 -1.526169      5.466474 2.304763       4.491961 13.50016 6.369832 15.02823 6.544915 -1.528069      9.132944 
1 1 1 5   25 39 o 29.67688 6.318096 14.83202       4.428947 14.29408       5.970880 15.49004       6.603786 25.49993 8.342689 25.63104 8.779601 -0.1311073     12.11123 
1 1 1 5   25 40 f 10.16854 4.911228 -3.058301      3.677051 -4.961250      4.999458 -0.8158848     5.427096 11.02053 5.410442 13.06773 6.218447 -2.047200      8.242692 
1 1 1 5   26 0  f 165.2999 3.918103 333.5824       15.78281 314.0698       25.79967 345.2516       19.95160 159.9653 6.632779 168.0056 4.878407 -8.040283      8.233626 
1 1 1 5   26 1  o 150.6122 3.263414 276.7742       11.97757 266.3342       16.32755 288.9383       17.62436 147.5795 4.545452 153.7001 4.711032 -6.120621      6.546369 
1 1 1 5   26 2  o 16.99104 6.009914 3.064163       3.107476 3.491990       4.295665 2.594504       4.500777 19.04195 7.020714 18.28502 7.083805 0.7569256      9.973500 
1 1 1 5   26 3  o 154.1669 3.272775 290.0117       12.29542 272.8105       16.60299 310.9019       18.29686 149.3538 4.567142 159.4302 4.714625 -10.07642      6.564029 
1 1 1 5   26 4  f 173.2658 4.032909 366.6156       17.02815 387.0778       30.19809 357.0763       20.61879 177.4996 6.995153 170.8272 4.958265 6.672363       8.574180 
1 1 1 5   26 5  o 83.41440 3.186242 85.02560       6.464824 111.2929       13.88427 77.75428       7.305021 95.13802 6.019566 79.71405 3.771236 15.42397       7.103337 
1 1 1 5   26 6  o 251.0919 4.275675 770.2740       26.16216 832.1954       55.00000 752.1660       29.74254 259.7500 8.701308 248.0143 4.921134 11.73564       9.996516 
1 1 1 5   26 7  o 63.04199 2.844372 48.58303       4.358452 43.03966       6.286940 53.71236       6.047589 59.18481 4.390325 66.21666 3.763315 -7.031845      5.782516 
1 1 1 5   26 8  o 117.2158 2.696874 167.6031       7.703410 179.2996       12.03800 159.4917       10.02477 121.0777 4.085794 114.2356 3.605628 6.842133       5.449245 
1 1 1 5   26 9  o 188.6918 3.516542 434.7188       16.16981 453.6486       31.38915 427.8808       18.86559 192.1185 6.714946 187.1278 4.137100 4.990662       7.887084 
1 1 1 5   26 10 o 227.9933 4.580611 635.6982       25.44964 695.3550       47.81430 612.1168       30.06168 237.3247 8.280273 223.5391 5.518532 13.78557       9.950735 
1 1 1 5   26 11 o 115.4001 3.455043 162.7643       9.705239 137.0348       16.98310 175.2416       11.82662 105.4181 6.644780 119.6765 4.061115 -14.25839      7.787539 
1 1 1 5   26 12 o 80.67564 3.087533 79.56628       6.058818 78.59094       12.91449 79.84155       6.860703 79.68858 6.712717 80.77795 3.493556 -1.089371      7.567398 
1 1 1 5   26 13 o 93.47516 3.026909 106.7750       6.885868 107.7094       15.34567 106.5394       7.705124 93.33846 6.793168 93.33688 3.393232 0.1579285E-02  7.593494 
1 1 1 5   26 14 o 141.6956 3.558764 245.4666       12.27857 256.4196       23.64388 241.4220       14.36789 144.1984 6.747269 140.4285 4.203304 3.769928       7.949428 
1 1 1 5   26 15 o 113.4443 3.033071 157.2555       8.377441 151.1279       17.96413 158.9585       9.470271 110.5998 6.696618 114.0145 3.412364 -3.414665      7.515911 
1 1 1 5   26 16 o 198.4333 4.390823 482.0584       21.23228 461.9652       36.49100 492.3427       26.10645 193.1315 7.769338 200.2377 5.354957 -7.106201      9.436004 
1 1 1 5   26 17 o 168.2985 3.372654 346.1682       13.83210 330.1634       28.80951 350.9629       15.76845 163.3103 7.257251 169.3873 3.820076 -6.076965      8.201260 
1 1 1 5   26 18 o 158.7227 3.994052 308.5773       15.43632 308.1308       27.56938 308.7812       18.63041 157.6865 7.193523 158.5844 4.826492 -0.8979034     8.662667 
1 1 1 5   26 19 o 169.4186 3.981209 351.4994       16.43661 356.4258       30.52663 349.4880       19.50546 169.3978 7.412896 168.6879 4.749727 0.7098541      8.804029 
1 1 1 5   26 20 o 109.7554 2.972356 147.3366       7.942602 150.8040       18.30604 146.5325       8.815598 110.1486 6.853882 109.4053 3.310374 0.7432632      7.611457 
1 1 1 5   26 21 o 98.51460 3.322246 118.8873       7.964283 0.000000       0.000000 118.8873       7.964283 ?        ?        98.51460 3.322246 0.000000       3.322246 
1 1 1 5   26 22 o 97.53713 2.687563 116.3761       6.381908 122.6884       11.49749 113.5652       7.672371 99.73877 4.744056 96.25860 3.275572 3.480171       5.765018 
1 1 1 5   26 23 o 24.93382 4.928647 7.929198       2.888504 15.20343       6.566032 6.183630       3.216458 34.11324 8.032302 21.95822 5.889850 12.15501       9.960332 
1 1 1 5   26 24 o 8.236625 3.988328 -4.045416      2.463995 -11.57344      5.618711 -2.252980      2.741688 11.54424 5.681052 10.14354 4.694348 1.400702       7.369617 
1 1 1 5   26 25 o 129.6485 3.792974 207.0735       11.97061 218.9725       21.92305 202.0189       14.28872 131.7132 6.853810 127.7270 4.598159 3.986290       8.253349 
1 1 1 5   26 26 o 50.77574 4.257171 32.11960       5.219157 39.33653       7.391307 24.94278       7.370740 55.84163 5.503027 43.79197 7.153605 12.04966       9.025373 
1 1 1 5   26 27 o 62.75277 3.047668 48.56088       4.646608 42.64273       7.730082 51.90909       5.814304 57.99282 5.536968 64.70412 3.702942 -6.711300      6.661066 
1 1 1 5   26 28 o 44.59958 3.350386 24.71724       3.614726 29.25304       7.156962 23.16399       4.188162 47.43334 6.351144 42.97466 4.046855 4.458679       7.530874 
1 1 1 5   26 29 o 16.58297 5.727055 3.271310       2.811803 5.969452       5.368277 2.251227       3.300808 22.09055 7.890372 15.70315 6.071071 6.387394       9.955695 
1 1 1 5   26 30 o 18.81209 5.788636 4.640221       2.912447 7.528243       5.879075 3.700953       3.352768 23.80220 8.277986 17.60980 6.241296 6.192404       10.36720 
1 1 1 5   26 31 o 20.08855 6.712450 5.348319       3.859120 3.144821       5.526754 7.444909       5.391016 18.88049 7.672946 23.23150 7.933230 -4.351013      11.03677 
1 1 1 5   26 32 o 34.75139 3.912091 15.55116       3.255479 18.15373       6.058246 14.49454       3.860171 35.48121 7.251787 33.02034 4.949534 2.460873       8.779881 
1 1 1 5   26 33 o 17.02095 6.292162 3.632531       3.454317 0.000000       0.000000 3.632531       3.454317 ?        ?        17.02095 6.292162 0.000000       6.292162 
1 1 1 5   26 34 o 12.64262 5.842906 -1.869817      4.226103 0.000000       0.000000 -1.869817      4.226103 ?        ?        12.64262 5.842906 0.000000       5.842906 
1 1 1 5   26 35 o 16.60827 6.138698 3.775098       3.287657 5.845604       5.029274 2.230077       4.344443 19.59030 7.514729 15.68057 6.622895 3.909730       10.01668 
1 1 1 5   26 36 o 25.14775 6.168249 9.808185       3.750870 7.501641       5.588078 11.69953       5.060185 20.73516 7.929389 26.05209 7.540767 -5.316931      10.94250 
1 1 1 5   26 37 o 16.13184 6.197101 3.852468       3.423644 9.186029       5.396348 0.2594093      4.429182 21.83727 7.897079 13.58274 6.165071 8.254528       10.01858 
1 1 1 5   26 38 o 12.60960 5.613940 0.7523423      3.479177 -3.775360      5.239111 4.324274       4.653399 12.04211 5.827331 16.46560 6.898306 -4.423484      9.030194 
1 1 1 5   26 39 o 30.13611 5.813935 14.87526       4.114959 14.40089       6.244094 15.23945       5.471083 24.50187 8.530504 27.15701 7.835048 -2.655136      11.58264 
1 1 1 5   26 40 o 9.651505 4.673889 -3.085668      3.385952 -6.894075      5.347667 -0.5372261     4.374517 10.66640 5.301108 12.17313 5.729680 -1.506722      7.805830 
1 1 1 5   27 0  o 133.1853 3.248889 216.4691       10.54453 223.9853       14.46662 207.9498       15.40171 135.3200 4.392836 130.3234 4.858155 4.996597       6.549708 
1 1 1 5   27 1  o 181.4752 3.201246 401.8879       14.15704 386.5337       21.33957 413.9579       18.92021 177.7207 4.932098 184.0767 4.217849 -6.356003      6.489672 
1 1 1 5   27 2  o 95.42071 3.442896 111.2838       7.992637 113.6610       9.795347 106.5481       13.82559 96.36595 4.181141 93.04961 6.131403 3.316338       7.421323 
1 1 1 5   27 3  o 150.4618 3.266717 276.2945       11.97771 279.5710       16.65008 272.7803       17.24360 151.1704 4.524833 149.2913 4.745801 1.879120       6.557190 
1 1 1 5   27 4  o 85.28371 3.059345 88.86551       6.347848 79.51744       8.377481 101.4690       9.727441 80.55553 4.282977 91.01273 4.398942 -10.45719      6.139592 
1 1 1 5   27 5  o 99.13169 3.659545 120.1602       8.825303 142.7461       15.94829 110.1913       10.59542 107.7439 6.099053 94.82501 4.598924 12.91887       7.638622 
1 1 1 5   27 6  o 95.93088 3.043049 112.4177       7.104831 113.4642       9.683022 111.1971       10.45706 96.27298 4.136995 95.26126 4.517480 1.011719       6.125549 
1 1 1 5   27 7  o 231.3324 4.067853 653.9217       22.93178 656.7933       46.22095 652.9841       26.41162 230.6760 8.235647 231.0574 4.690716 -0.3813629     9.477800 
1 1 1 5   27 8  o 54.29383 4.165340 36.23959       5.468997 24.73118       9.248384 42.42800       6.781842 43.96860 8.936504 58.69675 4.782718 -14.72816      10.13585 
1 1 1 5   27 9  o 136.7599 3.649268 228.6220       12.15101 209.2081       21.25934 238.0413       14.80820 130.3136 6.717257 139.4557 4.362792 -9.142136      8.009713 
1 1 1 5   27 10 o 131.7566 3.748595 212.2731       12.02362 195.8508       20.36224 221.0644       14.89827 126.0656 6.651698 134.3466 4.557244 -8.281029      8.063099 
1 1 1 5   27 11 o 85.24509 3.118671 88.83720       6.467588 100.4799       14.21136 85.79592       7.263359 90.18760 6.510064 83.72759 3.568040 6.460007       7.423735 
1 1 1 5   27 12 o 37.68878 4.548384 17.63403       4.093018 14.45116       9.197467 18.42002       4.570535 33.90405 10.25843 38.46056 4.994419 -4.556503      11.40963 
1 1 1 5   27 13 o 154.2390 3.298053 290.5858       12.39618 303.3252       26.39730 286.9817       14.04063 156.7734 6.926672 153.2224 3.760349 3.550934       7.881562 
1 1 1 5   27 14 o 267.4827 4.486617 876.0080       29.24494 852.6004       58.55326 883.7880       33.75698 261.7110 9.195353 268.4579 5.160018 -6.746948      10.54421 
1 1 1 5   27 15 f 97.48389 3.071214 116.1883       7.286801 130.0927       16.55121 112.8453       8.115640 102.5313 6.660299 96.02354 3.473964 6.507805       7.511858 
1 1 1 5   27 16 o 245.4188 4.220675 737.5296       25.24212 700.8587       50.54713 749.7127       29.13502 237.1518 8.761556 247.2460 4.835595 -10.09424      10.00739 
1 1 1 5   27 17 o 240.9176 4.908235 712.3784       28.81576 754.2358       52.17134 694.0035       34.56677 245.8306 8.722655 237.2993 5.982362 8.531372       10.57702 
1 1 1 5   27 18 o 41.30394 4.362285 21.14585       4.324525 30.06146       10.14303 19.16514       4.780825 48.32039 8.943230 39.16478 5.132629 9.155617       10.31141 
1 1 1 5   27 19 o 55.61854 3.562529 38.01649       4.803132 0.000000       0.000000 38.01649       4.803132 ?        ?        55.61854 3.562529 0.000000       3.562529 
1 1 1 5   27 20 o 29.96062 4.458378 11.26001       3.156068 21.53445       9.660183 10.03228       3.339313 40.47060 9.882170 28.13325 5.056679 12.33735       11.10078 
1 1 1 5   27 21 o 93.54566 2.951819 107.1567       6.720561 121.8820       16.46595 104.2133       7.361647 98.71838 6.887883 92.19633 3.281848 6.522049       7.629775 
1 1 1 5   27 22 o 68.24355 3.005494 57.12435       4.985940 69.72132       12.66986 54.81606       5.423551 74.36041 7.077107 66.79483 3.342620 7.565582       7.826784 
1 1 1 5   27 23 o 102.0179 3.287451 127.7879       8.162145 137.9362       12.39720 120.0230       10.84411 105.5338 4.833373 98.52732 4.528600 7.006516       6.623422 
1 1 1 5   27 24 o 24.13902 6.909154 7.535524       4.270544 11.29327       8.294293 6.180004       4.981597 29.78060 9.837383 22.63992 7.627114 7.140678       12.44777 
1 1 1 5   27 25 o 60.86588 3.940095 45.94545       5.812685 51.31617       8.009008 39.96783       8.449418 63.94202 5.184351 55.97758 6.303535 7.964443       8.161620 
1 1 1 5   27 26 o 80.37726 2.733304 79.43363       5.345949 77.64064       9.337356 80.30797       6.520394 78.68736 4.893705 80.64532 3.324996 -1.957962      5.916413 
1 1 1 5   27 27 o 62.86948 2.869862 48.77177       4.385206 47.25367       7.809309 49.47093       5.299647 60.96615 5.309294 63.14191 3.457432 -2.175762      6.335805 
1 1 1 5   27 28 o 14.26413 5.542398 1.763375       2.761393 2.857043       5.646245 1.419545       3.165841 19.21505 7.774944 14.47417 5.834263 4.740884       9.720513 
1 1 1 5   27 29 o 30.66492 4.336663 12.08078       3.150329 14.53480       5.983798 11.13974       3.705443 32.15707 7.731528 29.01385 5.440635 3.143225       9.453942 
1 1 1 5   27 30 o 15.41617 6.129522 2.042070       3.445583 2.190603       5.668782 1.955045       4.339104 18.22933 7.623886 16.48237 6.760472 1.746962       10.18958 
1 1 1 5   27 31 f 49.79650 3.269158 31.28037       3.945139 30.51764       7.244432 31.60192       4.703807 46.93945 6.508172 49.68934 3.916271 -2.749889      7.595623 
1 1 1 5   27 32 o 19.01057 6.042872 5.043791       3.147375 4.790231       7.245151 5.102772       3.494309 20.68872 8.633233 19.14800 6.387077 1.540712       10.73906 
1 1 1 5   27 33 o 21.23751 6.018702 6.593463       3.256653 11.77870       8.496185 5.700412       3.525964 25.48052 9.769011 19.73607 6.407888 5.744453       11.68309 
1 1 1 5   27 34 o 15.47245 5.587538 3.178072       2.700340 1.424315       5.035136 3.886132       3.199349 15.73293 6.888928 16.77306 6.078542 -1.040121      9.187274 
1 1 1 5   27 35 o 11.17033 5.015954 -0.4076973     2.841644 -3.261132      6.340357 0.3095379      3.178781 14.14042 6.726748 12.36938 5.443030 1.771040       8.653076 
1 1 1 5   27 36 o 27.38429 6.200592 11.87585       4.041273 13.38894       5.766817 10.41573       5.664989 26.52262 8.142578 23.17902 8.121531 3.343603       11.50047 
1 1 1 5   27 37 f 15.51150 6.231986 3.526325       3.599496 6.907206       5.569044 1.100573       4.717251 18.91685 7.696854 14.13985 6.395718 4.777005       10.00734 
1 1 1 5   27 38 o 15.90527 6.268542 4.183018       3.574351 3.971424       5.654123 4.323867       4.613066 16.09475 7.161671 16.14931 6.822910 -0.5455589E-01 9.891493 
1 1 1 5   27 39 o 10.67571 5.039756 -1.414030      3.430012 1.713243       5.349141 -3.597768      4.469936 14.20577 6.568238 10.89804 5.299022 3.307732       8.439276 
1 1 1 5   28 0  o 14.90241 6.150595 0.7653615      3.620861 0.6123800E-01  4.215156 2.747691       7.072567 15.29221 6.494069 21.73845 8.734982 -6.446249      10.88452 
1 1 1 5   28 1  o 69.22981 3.097371 58.60875       5.212203 53.10927       7.371927 64.10596       7.370410 65.74035 4.631280 72.30573 4.201044 -6.565376      6.252801 
1 1 1 5   28 2  o 109.6962 3.161024 146.9919       8.441167 134.6333       10.89227 165.5744       13.35628 104.8666 4.271251 116.2541 4.724404 -11.38752      6.368954 
1 1 1 5   28 3  o 212.0672 3.840538 549.3785       19.84731 517.7888       26.80567 587.7106       29.52807 205.5617 5.355727 218.9682 5.538174 -13.40651      7.704231 
1 1 1 5   28 4  o 79.51221 2.846936 77.24257       5.507393 75.90284       7.979801 78.46119       7.610571 78.69471 4.176073 80.04175 3.913661 -1.347038      5.723314 
1 1 1 5   28 5  o 275.0721 4.528974 925.4076       30.35865 902.5604       42.11699 950.1169       43.79965 271.1564 6.373843 278.1800 6.461132 -7.023590      9.075908 
1 1 1 5   28 6  o 163.1729 3.831957 325.3157       15.23719 344.9235       19.07343 290.7296       25.33181 167.8421 4.667814 153.6574 6.781845 14.18474       8.232977 
1 1 1 5   28 7  o 160.0775 3.346753 312.9066       13.05539 312.0541       18.01470 313.8495       18.94677 159.6331 4.635839 160.0518 4.863430 -0.4187469     6.718925 
1 1 1 5   28 8  o 78.29884 3.068262 74.95636       5.843086 76.22232       7.911886 73.43748       8.666290 78.84931 4.132038 77.33116 4.619840 1.518150       6.198117 
1 1 1 5   28 9  o 132.4013 3.127296 214.0356       10.09015 216.9462       13.76230 210.6523       14.83754 133.1159 4.247969 131.1059 4.651490 2.009949       6.299334 
1 1 1 5   28 10 o 103.5875 3.027898 131.1183       7.635164 132.6559       10.30795 129.2493       11.36474 104.0740 4.072237 102.6604 4.554101 1.413536       6.109251 
1 1 1 5   28 11 o 140.1273 3.245870 239.8286       11.08384 248.4270       23.15159 237.2718       12.62466 141.9034 6.714062 139.2762 3.723030 2.627243       7.677212 
1 1 1 5   28 12 o 27.22867 5.968637 9.462260       3.850903 14.42153       8.673273 8.244581       4.297746 33.69668 9.906383 25.43217 6.802298 8.264511       12.01697 
1 1 1 5   28 13 o 181.6230 3.581569 403.2543       15.85186 361.2904       30.95451 418.1713       18.45548 170.8244 7.453918 184.8580 4.096859 -14.03357      8.505595 
1 1 1 5   28 14 f 100.7362 3.067363 124.0791       7.521088 127.7783       16.27530 123.0747       8.480970 101.5903 6.610058 100.2774 3.475870 1.312943       7.468235 
1 1 1 5   28 15 o 131.0298 3.177897 209.8185       10.14720 165.3795       19.96399 225.2980       11.78270 115.4267 7.132331 135.6785 3.566765 -20.25178      7.974456 
1 1 1 5   28 16 o 167.6324 3.445462 343.6954       14.07478 366.4850       30.38085 337.4675       15.88193 171.8322 7.271802 166.0127 3.925779 5.819504       8.263827 
1 1 1 5   28 17 o 165.9387 3.869759 337.2364       15.64832 0.000000       0.000000 337.2364       15.64832 ?        ?        165.9387 3.869759 0.000000       3.869759 
1 1 1 5   28 18 o 29.02834 5.467301 10.71376       3.725657 0.000000       0.000000 10.71376       3.725657 ?        ?        29.02834 5.467301 0.000000       5.467301 
1 1 1 5   28 19 o 119.3184 3.054324 174.2768       8.873631 155.6487       18.52415 179.8244       10.10896 111.7103 6.837454 121.1312 3.428083 -9.420937      7.648695 
1 1 1 5   28 20 o 54.39771 3.264567 36.36942       4.307640 52.62132       10.95457 33.39677       4.685063 64.58150 7.076406 52.05001 3.718161 12.53149       7.993762 
1 1 1 5   28 21 o 147.0852 3.984543 266.1171       14.26867 299.4368       26.69445 252.7895       16.88286 154.4572 7.111214 143.0254 4.850936 11.43175       8.608191 
1 1 1 5   28 22 o 26.16317 7.057609 8.901953       4.602448 16.52582       8.609406 5.851428       5.445940 35.18584 9.719469 22.64157 7.960654 12.54428       12.56344 
1 1 1 5   28 23 o 13.43592 6.012174 -1.588009      4.043626 -11.61971      7.582572 2.398612       4.780042 14.49835 7.014627 18.16555 7.220581 -3.667201      10.06687 
1 1 1 5   28 24 o 22.30364 5.538744 6.471582       2.996645 7.065722       5.812236 6.256468       3.497305 24.06006 8.236777 21.96921 6.240836 2.090853       10.33405 
1 1 1 5   28 25 o 48.54364 3.159945 29.14425       3.717759 37.79369       7.227738 26.03246       4.335244 54.54548 5.513207 45.67774 3.932950 8.867737       6.772263 
1 1 1 5   28 26 o 73.29993 2.787235 66.23438       4.969599 55.94796       8.383594 71.80700       6.170602 66.38527 5.224370 76.13749 3.333858 -9.752220      6.197472 
1 1 1 5   28 27 f 42.11688 3.417959 22.15379       3.477873 28.66980       6.487380 19.52578       4.119943 46.96538 5.790829 39.20974 4.386931 7.755638       7.264906 
1 1 1 5   28 28 o 48.46126 3.264239 29.33447       3.832408 27.50416       7.006712 30.11577       4.577884 45.31221 6.534025 48.86300 3.876319 -3.550793      7.597323 
1 1 1 5   28 29 o 12.56038 5.442541 -0.2600584E-01 3.073845 -4.340465      4.879860 2.811911       3.957711 12.80704 6.035307 16.92983 6.618888 -4.122799      8.957378 
1 1 1 5   28 30 o 24.34897 6.182642 8.309716       3.674644 6.142479       5.925528 9.663985       4.684102 21.65909 8.192924 25.81651 7.183603 -4.157425      10.89625 
1 1 1 5   28 31 o 15.00959 5.815812 2.382971       3.034088 -2.196231      7.176444 3.379639       3.348032 16.49455 7.619889 16.64418 6.186845 -0.1496277     9.815282 
1 1 1 5   28 32 o 13.06049 5.508642 0.9494133      2.998837 -13.58498      7.591090 3.637132       3.264357 12.76309 6.338538 16.70248 6.126616 -3.939387      8.815469 
1 1 1 5   28 33 o 9.325568 4.426222 -2.640342      2.714411 -9.682891      7.564081 -1.599369      2.908111 13.53683 6.647659 10.45817 4.838118 3.078665       8.221847 
1 1 1 5   28 34 f 23.84375 5.255529 8.256849       2.971306 7.921599       5.509431 8.394354       3.528425 21.43219 7.942130 23.38063 6.121867 -1.948448      10.02770 
1 1 1 5   28 35 o 13.79749 5.467616 2.262072       2.732907 1.810956       4.895804 2.466270       3.293862 15.26165 6.733783 14.53418 5.917233 0.7274694      8.964233 
1 1 1 5   28 36 o 16.94607 5.727607 4.538632       2.809279 8.296496       5.671698 3.316968       3.233839 20.33960 7.931753 15.21127 5.972356 5.128332       9.928833 
1 1 1 5   28 37 o 11.57498 5.108055 0.5941865      2.818392 -1.004597      5.044338 1.319798       3.398298 12.96683 6.118419 12.91591 5.657360 0.5092239E-01  8.333113 
1 1 1 5   28 38 o 9.200248 4.390032 -2.129512      2.743092 5.586487       5.416760 -4.790746      3.181157 16.88328 7.269833 8.624885 4.250251 8.258391       8.421110 
1 1 1 5   29 0  o 93.90337 2.871302 107.7086       6.562746 100.5533       9.510640 114.2126       9.067460 90.58169 4.321031 96.60481 3.859453 -6.023125      5.793676 
1 1 1 5   29 1  o 125.7355 3.759909 193.3222       11.50756 188.8760       13.20529 207.3555       23.46039 124.2015 4.369806 129.5558 7.462492 -5.354279      8.647774 
1 1 1 5   29 2  o 82.78618 3.775776 83.91082       7.597229 82.36820       8.591186 89.44429       16.27131 81.95913 4.316718 84.79778 7.967466 -2.838646      9.061708 
1 1 1 5   29 3  o 200.2960 4.292855 490.6039       20.95341 499.2873       25.78362 473.7161       35.95710 201.8128 5.247200 195.9365 7.544760 5.876297       9.190022 
1 1 1 5   29 4  o 125.6615 2.861275 192.7201       8.761890 197.1006       13.28872 189.3510       11.65396 126.8775 4.304195 124.4164 3.848420 2.461098       5.773771 
1 1 1 5   29 5  o 63.69253 3.037742 49.63533       4.701343 51.68566       6.819555 47.77833       6.490079 64.86073 4.339542 62.35482 4.297423 2.505909       6.107329 
1 1 1 5   29 6  o 39.86847 3.818634 19.60331       3.664703 17.68538       5.243117 21.43528       5.124271 37.51091 5.932928 41.50975 5.178067 -3.998837      7.874770 
1 1 1 5   29 7  o 112.7971 2.786234 155.2880       7.658638 144.7473       11.27690 164.3120       10.43404 108.6953 4.265666 115.8949 3.699208 -7.199554      5.646242 
1 1 1 5   29 8  o 86.19638 2.768444 90.77794       5.807607 91.47235       8.693449 90.21825       7.804646 86.37939 4.142030 85.83250 3.740324 0.5468903      5.580899 
1 1 1 5   29 9  o 17.41882 5.916411 3.446991       2.997785 1.959034       3.899063 5.598195       4.688197 16.65674 6.552472 21.99696 7.399046 -5.340219      9.883358 
1 1 1 5   29 10 o 73.77425 2.840074 66.54594       5.096342 63.94874       7.300515 69.01462       7.117598 72.17179 4.168713 75.01831 3.906872 -2.846519      5.713302 
1 1 1 5   29 11 o 33.11175 6.412533 13.94998       4.987290 12.45835       8.618476 14.70095       6.115182 31.70786 9.989727 33.82969 7.603398 -2.121830      12.55414 
1 1 1 5   29 12 o 270.4933 6.467362 901.8160       42.63043 891.0011       60.56243 912.4374       60.01831 267.0761 9.319618 270.4131 9.120991 -3.336914      13.04024 
1 1 1 5   29 13 o 164.9254 4.084370 333.0601       16.41530 293.6659       27.18233 355.6738       20.59473 153.8837 7.269211 170.1601 4.971968 -16.27635      8.806923 
1 1 1 5   29 14 o 94.62282 3.783755 109.7598       8.707196 115.3422       15.61837 107.2424       10.48834 96.39301 6.690484 93.38949 4.623008 3.003525       8.132329 
1 1 1 5   29 15 o 85.12836 7.181226 90.43377       14.75854 0.000000       0.000000 90.43377       14.75854 ?        ?        85.12836 7.181226 0.000000       7.181226 
1 1 1 5   29 16 o 56.90609 5.519697 40.25997       7.558361 0.000000       0.000000 40.25997       7.558361 ?        ?        56.90609 5.519697 0.000000       5.519697 
1 1 1 5   29 17 o 78.13287 3.914221 75.03652       7.428993 55.79400       12.07342 86.76120       9.424318 66.48580 7.587543 83.89022 4.627948 -17.40442      8.887559 
1 1 1 5   29 18 o 20.88116 7.216457 4.962303       4.464774 -2.596193      7.043270 10.03999       5.772844 17.82053 7.957216 27.95535 8.042960 -10.13482      11.31400 
1 1 1 5   29 19 o 51.35449 4.653038 32.75040       5.759928 28.91086       10.23843 34.52829       6.967006 46.94287 9.279135 52.54461 5.523539 -5.601738      10.79870 
1 1 1 5   29 20 o 47.36615 4.724243 27.96233       5.380360 27.71413       9.643478 28.07451       6.483222 45.91740 8.939953 47.21086 5.753964 -1.293461      10.63160 
1 1 1 5   29 21 o 106.6580 4.888528 141.1821       12.67218 129.8914       16.99087 155.3354       19.02318 101.3703 6.919596 110.7996 7.082536 -9.429321      9.901673 
1 1 1 5   29 22 o 58.98378 3.468212 42.95333       4.963107 47.91438       11.35403 41.78149       5.518232 60.76357 7.851123 58.06450 3.922925 2.699066       8.776644 
1 1 1 5   29 23 o 40.31631 3.666744 20.22110       3.563075 22.14565       8.873621 19.85116       3.890485 40.29393 9.235046 39.84964 4.063079 0.4442863      10.08934 
1 1 1 5   29 24 o 48.18056 3.433530 28.80636       4.004915 35.85592       9.635020 27.33398       4.403333 51.98286 7.850417 46.80444 3.895927 5.178417       8.763977 
1 1 1 5   29 25 o 73.33233 3.480780 66.76414       6.202499 74.04293       12.03377 64.13087       7.238004 75.46838 6.610019 71.58080 4.167431 3.887589       7.814079 
1 1 1 5   29 26 o 57.69357 3.000453 41.26863       4.203928 42.76917       7.590557 40.60472       5.049004 57.61087 5.472339 56.98972 3.654840 0.6211472      6.580604 
1 1 1 5   29 27 o 56.61555 3.046058 39.88673       4.187048 35.09574       7.300244 42.23537       5.111323 51.63522 5.907934 58.01068 3.633928 -6.375465      6.936073 
1 1 1 5   29 28 o 29.48455 5.169874 11.54155       3.579225 7.090780       5.796379 14.28450       4.550385 22.93782 8.198282 32.47024 5.970732 -9.532421      10.14206 
1 1 1 5   29 29 o 51.77533 4.040957 34.39602       5.058154 25.96465       9.890647 37.38211       5.886105 39.85346 10.15612 53.63601 4.546131 -13.78254      11.12718 
1 1 1 5   29 30 o 21.83957 5.560452 6.680268       2.966646 13.50356       6.013125 4.485131       3.410626 29.41040 8.122303 18.22972 6.306925 11.18069       10.28344 
1 1 1 5   29 31 o 28.27327 5.239901 11.12053       3.477321 10.18857       8.881598 11.28925       3.778999 24.35467 9.787755 28.18290 5.698548 -3.828226      11.32579 
1 1 1 5   29 32 o 17.46126 6.037462 4.328344       3.125224 11.43017       8.469636 3.208992       3.362507 24.58760 9.661879 16.01154 6.143910 8.576056       11.44987 
1 1 1 5   29 33 o 20.43801 5.801422 6.288883       3.023317 13.93833       5.791791 3.423853       3.544561 28.29703 8.028842 16.16329 6.279624 12.13374       10.19294 
1 1 1 5   29 34 o 17.78672 5.827354 4.853307       2.912737 10.10767       5.719464 3.013380       3.384509 23.07359 8.154189 15.28129 6.075260 7.792304       10.16856 
1 1 1 5   29 35 o 13.09805 5.349362 1.886521       2.702248 -4.603063      5.154925 4.345532       3.173176 11.82131 5.734635 16.63782 6.050150 -4.816516      8.336087 
1 1 1 5   29 36 o 23.08845 5.578055 8.520296       3.103021 4.467028       5.582260 10.33277       3.732877 16.67270 7.278000 24.78674 6.197061 -8.114035      9.558914 
1 1 1 5   29 37 f 14.64635 5.701433 3.325673       2.926362 2.274719       5.405011 3.761494       3.480638 14.77642 6.746898 15.27564 6.131338 -0.4992218     9.116684 
1 1 1 5   30 0  o 146.8409 3.020270 263.2349       10.80759 246.1553       15.76428 278.3818       14.84555 141.7475 4.569729 150.8372 4.042438 -9.089722      6.101125 
1 1 1 5   30 1  o 48.10452 3.743150 28.44957       4.353411 22.16391       5.852149 36.23795       6.514241 42.10033 5.863036 54.16511 4.991336 -12.06478      7.699911 
1 1 1 5   30 2  o 204.4020 3.448336 510.3846       17.17635 498.3179       25.95949 519.7809       22.90778 201.5519 5.289915 206.0759 4.561626 -4.523956      6.985101 
1 1 1 5   30 3  o 40.09461 4.277033 19.88696       4.114478 16.35956       5.548902 24.19497       6.132229 35.92279 6.581161 44.01680 5.862586 -8.094006      8.813716 
1 1 1 5   30 4  o 81.02576 3.673131 80.40054       7.233772 79.00652       8.289404 84.85207       14.81295 80.24907 4.254039 82.61352 7.437450 -2.364449      8.568110 
1 1 1 5   30 5  o 41.77554 4.518408 21.61094       4.526730 19.62423       5.657336 25.14661       7.547105 39.51852 6.068222 44.62000 7.184805 -5.101486      9.404507 
1 1 1 5   30 6  o 139.5391 2.924901 237.7325       9.945876 238.5578       15.07428 237.0963       13.23560 139.5253 4.439157 139.1864 3.906074 0.3389130      5.912996 
1 1 1 5   30 7  o 84.62634 2.882277 87.54073       5.935306 92.51321       8.758307 83.31773       8.071299 86.85330 4.150076 82.42943 4.030358 4.423874       5.785060 
1 1 1 5   30 8  o 63.78370 3.089052 49.80864       4.787159 49.88410       6.865428 49.73723       6.678570 63.66883 4.452986 63.59087 4.335689 0.7795715E-01  6.215085 
1 1 1 5   30 9  o 118.9267 2.811641 172.7005       8.148458 201.8767       13.09716 154.2750       10.40812 128.3456 4.193179 112.2395 3.810839 16.10606       5.666149 
1 1 1 5   30 10 o 78.78883 2.856256 75.91230       5.474930 85.27689       8.188103 68.34012       7.362912 83.36805 4.042443 74.60690 4.065167 8.761147       5.732968 
1 1 1 5   30 11 o 33.72306 5.483289 14.33240       4.351477 14.99622       8.719577 14.11224       5.021466 34.18878 9.899581 33.27981 6.424430 0.9089737      11.80148 
1 1 1 5   30 12 o 61.98575 3.612170 47.16740       5.432632 45.00731       10.67367 47.92263       6.311280 59.80570 7.487404 62.40437 4.174177 -2.598671      8.572338 
1 1 1 5   30 13 o 105.4528 4.694624 136.7691       12.03386 0.000000       0.000000 136.7691       12.03386 ?        ?        105.4528 4.694624 0.000000       4.694624 
1 1 1 5   30 14 o 149.4003 4.671563 274.4143       16.98696 0.000000       0.000000 274.4143       16.98696 ?        ?        149.4003 4.671563 0.000000       4.671563 
1 1 1 5   30 15 o 86.75168 3.163399 92.19249       6.676366 122.0072       15.41032 85.30329       7.407660 99.04253 6.419481 83.36687 3.655176 15.67565       7.387154 
1 1 1 5   30 16 o 70.96136 3.279024 61.77963       5.654927 69.87628       12.66152 59.76214       6.320315 74.59477 7.048925 69.71903 3.733690 4.875740       7.976703 
1 1 1 5   30 17 o 137.3917 3.249325 231.2126       10.87902 251.4629       23.75841 225.8401       12.23733 141.8298 6.894722 135.6297 3.705979 6.200150       7.827610 
1 1 1 5   30 18 o 15.66338 6.070288 1.986456       3.305887 11.91069       8.485463 0.2105690      3.589506 30.67926 9.939054 14.17131 6.004346 16.50795       11.61193 
1 1 1 5   30 19 f 63.19522 3.377367 49.15693       5.182249 63.79091       12.41099 46.06670       5.703225 70.80840 7.296957 61.07692 3.851451 9.731476       8.251016 
1 1 1 5   30 20 o 124.9789 3.499004 192.2292       10.64608 198.4401       20.51203 189.9393       12.45499 125.3157 6.741693 123.9906 4.127852 1.325050       7.905035 
1 1 1 5   30 21 o 98.92026 3.323035 120.5251       7.999066 131.9796       16.17500 116.8169       9.203226 101.9740 6.543602 97.18978 3.893708 4.784180       7.614439 
1 1 1 5   30 22 o 39.44838 3.762761 19.40350       3.573425 21.26002       8.540001 19.00946       3.934418 39.44197 9.074058 38.92984 4.214388 0.5121269      10.00498 
1 1 1 5   30 23 o 28.09752 4.748298 10.13232       3.135462 20.28567       7.976696 8.276834       3.409945 38.39949 8.723530 25.10060 5.704663 13.29889       10.42320 
1 1 1 5   30 24 o 11.39679 5.001781 -0.5073841     2.668065 1.369138       6.635023 -0.8693449     2.914046 19.22610 8.155448 11.59378 5.151155 7.632315       9.646022 
1 1 1 5   30 25 o 66.03047 3.157347 54.15981       5.065738 60.53100       11.49900 52.62558       5.642802 67.31103 7.118027 64.90910 3.581291 2.401932       7.968184 
1 1 1 5   30 26 o 15.09785 6.033188 1.805831       3.354734 9.288862       6.797250 -0.6038906     3.857251 25.82805 8.905100 13.54239 5.976047 12.28565       10.72445 
1 1 1 5   30 27 o 37.45503 4.201838 18.03784       3.769131 23.16187       6.182180 15.00640       4.755100 41.23148 6.356910 33.18584 6.104800 8.045639       8.813563 
1 1 1 5   30 28 o 28.28091 4.858211 10.66179       3.227554 21.87975       8.378242 8.706906       3.497488 37.24520 9.268233 25.05217 5.837572 12.19303       10.95342 
1 1 1 5   30 29 o 17.60158 5.693722 4.225114       2.785330 6.097584       5.198140 3.470972       3.298885 20.86790 7.717881 16.71476 6.154242 4.153145       9.871189 
1 1 1 5   30 30 o 13.89245 5.671669 1.631707       3.036287 13.22915       8.247502 -0.1865440     3.265640 26.90398 9.758197 12.38378 5.480156 14.52021       11.19172 
1 1 1 5   30 31 o 37.56318 4.041865 18.72945       3.641667 18.42404       9.273136 18.78514       3.959789 29.94339 10.39742 37.31151 4.442170 -7.368126      11.30660 
1 1 1 5   30 32 o 10.80034 4.862127 -0.5586839     2.689072 -4.704859      4.871057 1.258804       3.225040 11.86788 5.712028 13.42768 5.690406 -1.559794      8.062753 
1 1 1 5   30 33 o 14.78683 5.745847 2.822358       2.967983 -0.2747952     5.024220 4.482502       3.678411 14.08281 6.458227 17.23758 6.469304 -3.154773      9.141149 
1 1 1 5   30 34 o 11.41287 5.043671 0.2738151      2.757113 0.7690461      5.379786 0.9740891E-01  3.210835 14.67811 6.713055 11.92564 5.345304 2.752471       8.581223 
1 1 1 5   30 35 o 11.52777 5.012220 0.7402775      2.625389 0.5681182      5.290103 0.7965361      3.024082 14.13718 6.534888 12.11039 5.319683 2.026790       8.426374 
1 1 1 5   30 36 o 13.24769 5.435587 2.230823       2.806264 0.5654678      5.257891 2.894185       3.318437 13.80899 6.428331 14.31493 5.896112 -0.5059423     8.722820 
1 1 1 5   31 0  o 286.6334 4.801867 1006.677       33.54077 1141.215       70.86362 967.8349       38.07584 302.5076 9.625074 280.7806 5.564758 21.72696       11.11794 
1 1 1 5   31 1  o 244.6528 4.949744 733.6957       29.50999 737.1319       35.46479 725.9619       53.20596 244.9015 5.942510 241.5084 9.056533 3.393036       10.83209 
1 1 1 5   31 2  o 96.55542 3.186906 114.0061       7.488359 116.9188       10.16320 110.5468       11.07583 97.64205 4.281686 94.85821 4.807104 2.783844       6.437475 
1 1 1 5   31 3  o 93.30293 2.976868 106.4177       6.759816 94.05840       9.590612 118.6195       9.529329 87.52000 4.512024 98.38966 3.982679 -10.86965      6.018313 
1 1 1 5   31 4  o 26.71532 5.707820 9.100031       3.603092 10.90898       4.995207 7.138080       5.202176 29.15819 7.097793 24.27518 7.774721 4.883003       10.52734 
1 1 1 5   31 5  o 99.28858 2.899426 120.4899       7.007805 112.5903       10.11714 127.7756       9.716091 95.78806 4.345529 102.1216 3.911486 -6.333488      5.846652 
1 1 1 5   31 6  o 34.88171 4.685674 15.17795       3.882313 14.21734       5.266474 16.32129       5.745601 33.37296 6.708630 35.79071 6.836852 -2.417747      9.578530 
1 1 1 5   31 7  o 122.4353 3.225305 183.3273       9.614686 178.8311       12.79253 189.1644       14.57577 120.7395 4.354948 124.0882 4.829420 -3.348732      6.502989 
1 1 1 5   31 8  o 76.57436 3.288940 71.80796       6.122964 75.15659       8.069398 67.26334       9.400600 78.21284 4.249732 73.81097 5.260839 4.401878       6.762887 
1 1 1 5   31 9  o 135.4806 3.248288 224.3833       10.72427 220.7726       14.43230 228.8351       16.02528 134.1268 4.421586 136.4639 4.826542 -2.337158      6.545681 
1 1 1 5   31 10 o 124.5264 2.863639 189.4510       8.689920 189.7480       13.04907 189.2143       11.64863 124.3390 4.313146 124.2550 3.851676 0.8409119E-01  5.782615 
1 1 1 5   31 11 o 170.0244 5.101068 355.7576       21.11140 0.000000       0.000000 355.7576       21.11140 ?        ?        170.0244 5.101068 0.000000       5.101068 
1 1 1 5   31 12 o 82.97023 3.885155 84.54292       7.833557 0.000000       0.000000 84.54292       7.833557 ?        ?        82.97023 3.885155 0.000000       3.885155 
1 1 1 5   31 13 o 90.46672 3.261426 100.2865       7.178294 85.12980       14.10998 105.5790       8.337925 82.45027 7.091432 92.75270 3.696289 -10.30243      7.996934 
1 1 1 5   31 14 o 154.9177 3.406338 293.9491       12.85953 294.9422       26.34877 293.6385       14.73338 153.7209 7.052612 154.6593 3.912364 -0.9383545     8.065105 
1 1 1 5   31 15 o 72.67742 3.390487 64.86452       5.988240 51.91739       11.66656 69.49567       6.977513 63.94223 7.638075 75.15472 3.822407 -11.21250      8.541135 
1 1 1 5   31 16 o 158.7382 3.417699 309.0203       13.22061 310.6000       27.71191 308.5548       15.04284 157.2204 7.252588 158.4655 3.895465 -1.245041      8.232538 
1 1 1 5   31 17 o 51.59420 3.741267 32.88726       4.671918 45.92566       10.51992 29.68396       5.214333 59.98166 7.350564 48.86483 4.426893 11.11682       8.580686 
1 1 1 5   31 18 o 118.5925 3.181073 172.7401       9.184902 179.8942       19.36651 170.6640       10.43287 119.4260 6.681149 117.7320 3.640790 1.694084       7.608752 
1 1 1 5   31 19 o 25.11213 6.254056 8.237275       3.812636 4.390600       7.343095 9.657010       4.461079 22.78818 8.983682 27.12011 6.771276 -4.331932      11.24974 
1 1 1 5   31 20 o 69.13739 3.196682 58.93594       5.371201 77.84926       12.38238 54.55231       5.961246 78.08630 6.568006 66.37689 3.700038 11.70941       7.538500 
1 1 1 5   31 21 o 82.20419 3.038308 83.29939       6.075946 106.5716       14.27180 78.14764       6.714868 91.21298 6.462602 79.47592 3.475498 11.73706       7.337868 
1 1 1 5   31 22 o 12.34559 5.205116 0.3358420      2.675816 -0.7024608     6.086797 0.5845693      2.979123 17.16951 7.544400 13.23293 5.530018 3.936584       9.354094 
1 1 1 5   31 23 f 21.95902 5.675623 6.394557       3.059019 10.52768       7.541878 5.580706       3.346669 27.78053 9.384608 20.61600 6.177029 7.164528       11.23506 
1 1 1 5   31 24 f 28.87680 5.633967 11.06298       3.822200 9.444013       8.354485 11.49155       4.298431 26.65762 9.797421 29.20967 6.228998 -2.552048      11.60990 
1 1 1 5   31 25 o 33.56499 4.950081 14.71277       3.927490 1.144499       7.644788 19.57806       4.577806 19.65111 8.548481 38.79930 4.954587 -19.14820      9.880509 
1 1 1 5   31 26 o 19.87396 6.498590 5.313141       3.623192 14.50068       7.760479 2.752293       4.097141 30.52347 9.459000 16.93591 6.699903 13.58756       11.59144 
1 1 1 5   31 27 o 16.45982 5.907511 3.341684       3.013016 0.000000       0.000000 3.341684       3.013016 ?        ?        16.45982 5.907511 0.000000       5.907511 
1 1 1 5   31 28 o 20.83591 5.700952 6.130100       2.978045 11.94264       7.784145 5.133468       3.223260 26.63797 9.502826 19.12563 6.119261 7.512346       11.30261 
1 1 1 5   31 29 o 22.05828 5.751742 7.017953       3.123172 18.84275       8.725375 5.280306       3.344783 31.74769 10.05785 19.13359 6.243122 12.61410       11.83794 
1 1 1 5   31 30 o 22.85519 5.784503 7.661739       3.224002 6.290022       8.514579 7.891320       3.483367 21.09761 9.099773 22.98972 6.112701 -1.892107      10.96225 
1 1 1 5   31 31 o 17.57227 5.996915 4.541798       3.080446 9.559562       5.434350 2.166193       3.739208 23.41561 7.965664 14.94133 6.215894 8.474273       10.10392 
1 1 1 5   31 32 o 11.96020 5.146419 0.7142462      2.710967 -6.907349      4.966912 3.948132       3.235384 10.97078 5.387386 16.44945 6.087942 -5.478666      8.129389 
1 1 1 5   31 33 o 9.663548 4.531688 -1.695795      2.692780 -2.332952      5.183066 -1.460235      3.151479 12.87512 6.112502 10.65600 4.965997 2.219123       7.875519 
1 1 1 5   31 34 o 18.29541 5.957798 5.554978       3.046809 6.860980       5.648005 5.018934       3.618459 18.71813 7.699091 17.23722 6.427081 1.480913       10.02913 
1 1 1 5   31 35 o 14.54895 5.663359 3.182008       2.887345 7.954144       5.884284 1.668614       3.313700 19.02911 7.845971 13.09489 5.662535 5.934213       9.675927 
1 1 1 5   32 0  o 88.61591 3.004498 96.03725       6.478750 107.6755       9.630374 86.41528       8.756513 93.67348 4.229725 83.88676 4.297854 9.786728       6.030102 
1 1 1 5   32 1  o 89.36906 3.039560 97.68537       6.610002 104.2834       9.798209 92.17467       8.954562 92.15810 4.375414 86.64893 4.253774 5.509163       6.102364 
1 1 1 5   32 2  o 65.02463 3.252959 51.80502       5.138203 56.29032       7.369370 47.56166       7.167853 67.62387 4.497481 62.09257 4.773726 5.531300       6.558643 
1 1 1 5   32 3  o 70.25940 3.239165 60.46090       5.530996 65.75180       8.113052 55.86652       7.560198 73.09296 4.577821 67.34294 4.635131 5.750015       6.514667 
1 1 1 5   32 4  o 73.74180 3.277767 66.60246       5.875453 72.14994       7.963653 59.97572       8.703893 76.62134 4.282109 69.69275 5.161588 6.928589       6.706597 
1 1 1 5   32 5  o 134.9305 2.962881 222.4372       9.742281 232.9297       15.02148 214.8196       12.79914 137.7645 4.480407 132.3983 3.971492 5.366180       5.987219 
1 1 1 5   32 6  o 49.48427 3.572932 30.11228       4.279507 31.92533       6.058260 28.30654       6.046033 50.75126 4.961838 47.70124 5.290045 3.050018       7.252890 
1 1 1 5   32 7  o 160.9970 3.421036 317.0614       13.42182 331.1186       18.87059 302.6693       19.09403 164.1708 4.721770 156.8747 5.001080 7.296112       6.877929 
1 1 1 5   32 8  o 23.03171 6.224180 6.771574       3.575723 13.16761       4.928863 -0.3347113     5.195325 32.07032 6.528975 16.55498 7.123982 15.51535       9.663262 
1 1 1 5   32 9  o 36.82073 4.754507 16.92909       4.166644 19.19840       6.425105 15.28211       5.473644 38.75897 7.062685 34.55084 6.743157 4.208126       9.764819 
1 1 1 5   32 10 o 131.8624 4.504758 213.8337       14.45407 234.7384       19.37735 187.6127       21.70188 137.7577 5.785090 122.5762 7.298370 15.18154       9.313081 
1 1 1 5   32 11 o 71.74541 4.064611 63.36346       7.077326 50.79816       11.56692 70.88244       8.947689 63.35106 7.647048 75.73286 4.874191 -12.38181      9.068357 
1 1 1 5   32 12 o 76.20846 3.982007 71.47831       7.369399 82.36127       13.12677 66.46973       8.905153 81.11069 6.700888 73.26432 5.018144 7.846375       8.371598 
1 1 1 5   32 13 o 25.67888 7.179651 8.487294       4.666875 5.506328       7.829028 10.13037       5.812443 24.48455 9.380020 28.02818 8.072533 -3.543629      12.37540 
1 1 1 5   32 14 o 76.70121 3.839137 72.45708       7.153014 77.10057       12.98452 70.43389       8.570800 78.22659 6.881455 75.42223 4.686372 2.804359       8.325653 
1 1 1 5   32 15 o 151.9609 3.920133 284.2855       14.50460 272.0034       25.37303 290.2475       17.67788 146.9244 7.107759 153.1842 4.741363 -6.259811      8.544048 
1 1 1 5   32 16 o 71.85213 3.803996 63.73169       6.636905 76.02151       12.58144 58.99317       7.812300 77.47327 6.730847 68.88980 4.681398 8.583466       8.198768 
1 1 1 5   32 17 o 74.92139 4.275318 69.63118       7.773271 56.52023       11.70577 79.97319       10.39646 66.29930 7.369662 79.91099 5.369966 -13.61169      9.118578 
1 1 1 5   32 18 o 20.31593 6.809007 5.004192       3.970562 6.005328       7.768195 4.650144       4.619602 24.41513 9.345987 20.38565 7.315061 4.029478       11.86834 
1 1 1 5   32 19 o 17.47473 6.489876 3.126923       3.682520 4.330071       7.022731 2.670635       4.324798 22.23228 8.779014 17.72692 6.922373 4.505358       11.17991 
1 1 1 5   32 20 o 23.24833 6.304012 7.142196       3.660643 -0.5025041     6.623231 10.50458       4.392516 18.06473 7.905685 28.10575 6.537105 -10.04102      10.25834 
1 1 1 5   32 21 o 26.92232 5.897754 9.594893       3.762072 16.20817       7.673239 7.502147       4.316469 33.89452 9.099614 23.71894 6.992689 10.17558       11.47609 
1 1 1 5   32 22 o 17.03192 6.200277 3.241933       3.333885 12.47704       7.532706 0.9922425      3.717846 29.61656 9.340415 14.86950 6.193038 14.74707       11.20701 
1 1 1 5   32 23 o 22.67892 6.061798 6.953244       3.414394 1.980080       7.290906 8.350320       3.864338 20.00140 8.519042 24.75276 6.369573 -4.751366      10.63699 
1 1 1 5   32 24 o 60.61824 3.660819 46.32162       5.382559 39.12016       10.12649 49.15741       6.354568 52.36320 8.205227 62.11354 4.223324 -9.750332      9.228337 
1 1 1 5   32 25 o 10.79330 4.900290 -1.281871      2.800588 0.000000       0.000000 -1.281871      2.800588 ?        ?        10.79330 4.900290 0.000000       4.900290 
1 1 1 5   32 26 o 12.18074 5.208299 0.3604548      2.744125 -7.971408      7.482433 1.655238       2.949649 14.62180 7.048078 14.03802 5.640946 0.5837746      9.027495 
1 1 1 5   32 27 o 9.179807 4.346402 -2.599681      2.586678 -8.894472      6.920678 -1.577525      2.788795 13.43731 6.547151 10.38080 4.779202 3.056516       8.105921 
1 1 1 5   32 28 o 34.09701 4.248757 15.46605       3.453940 31.67516       9.850886 13.19406       3.688070 42.49231 9.724144 30.93024 5.068446 11.56207       10.96577 
1 1 1 5   32 29 o 25.17820 5.439466 9.099246       3.239820 20.59150       9.224280 7.482056       3.460274 31.83701 10.36636 22.32455 6.159945 9.512457       12.05845 
1 1 1 5   32 30 o 22.86416 5.702232 7.792408       3.166249 12.05062       5.496071 5.677167       3.873637 26.34873 7.920738 19.15421 6.715466 7.194513       10.38439 
1 1 1 5   32 31 o 15.44610 5.661169 3.356954       2.786315 3.989350       5.262271 3.110584       3.284522 17.28253 7.293704 15.36494 6.023067 1.917594       9.459146 
1 1 1 5   32 32 o 19.08431 5.814318 5.798532       2.947682 14.35172       5.821681 2.849807       3.418232 27.17780 8.147896 14.86837 6.037311 12.30943       10.14087 
1 1 1 5   32 33 o 10.16123 4.708536 -1.084204      2.771441 2.916200       5.369590 -2.536890      3.235751 15.71986 6.987934 10.00452 4.772191 5.715342       8.461975 
1 1 1 5   32 34 o 9.662237 4.549425 -1.615748      2.762188 -0.7723140     5.482921 -1.902612      3.197600 13.41006 6.342971 10.20907 4.833364 3.200992       7.974628 
1 1 1 5   33 0  o 90.12462 2.987160 99.37302       6.551451 104.7297       9.671798 94.83122       8.905830 92.32385 4.310800 87.86677 4.171146 4.457085       5.998455 
1 1 1 5   33 1  o 36.89472 4.602067 16.95843       4.047928 8.966592       5.296847 28.17884       6.276225 26.57890 7.721540 47.53466 5.520738 -20.95576      9.492140 
1 1 1 5   33 2  o 59.80555 3.464123 43.90733       5.026993 39.50893       7.067379 48.41151       7.151857 56.44659 5.196157 62.61683 4.721755 -6.170242      7.021041 
1 1 1 5   33 3  o 36.73991 4.429738 16.79668       3.886053 19.37208       5.598435 14.40201       5.398438 39.17682 6.059489 33.51477 6.841655 5.662048       9.139236 
1 1 1 5   33 4  o 124.4783 2.935548 189.3959       8.904691 166.2466       12.83425 210.8838       12.36512 116.2812 4.537947 131.1400 3.873496 -14.85877      5.966317 
1 1 1 5   33 5  o 75.00219 3.069220 68.90171       5.597829 61.45428       7.847584 76.61673       7.987317 70.59070 4.586807 78.92848 4.167473 -8.337784      6.197309 
1 1 1 5   33 6  o 63.11298 3.738134 48.97069       5.723477 62.14897       10.01208 42.57362       6.975660 70.70580 5.863445 58.62840 4.928060 12.07739       7.659358 
1 1 1 5   33 7  o 126.3878 3.303045 195.6482       10.16444 182.3187       17.80509 202.0923       12.37998 121.2622 6.044408 128.3080 3.964159 -7.045799      7.228377 
1 1 1 5   33 8  o 135.6724 3.735085 225.8220       12.33715 245.0836       15.32014 190.2868       20.80876 141.1411 4.459832 123.4846 6.943045 17.65650       8.252028 
1 1 1 5   33 9  o 18.70443 6.202677 4.136057       3.296517 5.040771       4.236109 2.746948       5.249037 20.78445 7.033265 19.27167 7.596059 1.512789       10.35215 
1 1 1 5   33 10 o 30.39105 4.899314 11.66719       3.505068 11.34519       4.637009 12.09641       5.353712 29.63147 6.591820 30.50930 7.298947 -0.8778286     9.834974 
1 1 1 5   33 11 o 67.14683 3.623630 55.48768       5.907362 44.91273       10.89020 59.89670       7.031823 59.30745 7.718030 69.66324 4.161136 -10.35579      8.768297 
1 1 1 5   33 12 o 43.08594 4.424340 23.11527       4.579440 38.16618       9.493439 18.55103       5.227896 54.66481 7.309586 38.23364 5.792270 16.43117       9.326330 
1 1 1 5   33 13 o 53.81564 3.894218 35.82205       5.072443 56.84074       10.87541 29.97835       5.734382 66.98890 6.754155 48.98994 4.867664 17.99896       8.325428 
1 1 1 5   33 14 o 91.09396 3.761233 102.3376       8.331451 106.6411       14.72849 100.3126       10.10323 91.85401 6.624469 89.91008 4.626781 1.943932       8.080266 
1 1 1 5   33 15 o 46.01766 4.487693 26.46711       4.968631 23.59955       8.595809 27.90596       6.088889 42.04930 8.676586 47.00278 5.414752 -4.953487      10.22755 
1 1 1 5   33 16 o 43.08846 4.139562 23.18145       4.293203 37.76142       9.396622 19.33500       4.826404 53.92134 7.341640 39.03159 5.203779 14.88975       8.998833 
1 1 1 5   33 17 o 32.04963 4.991879 13.12195       3.771796 22.73478       8.145051 10.49785       4.255582 41.06158 8.422746 28.24276 6.339174 12.81882       10.54172 
1 1 1 5   33 18 o 37.89130 4.296039 18.09440       3.896913 17.52965       8.186740 18.25985       4.431112 35.45852 9.344631 37.87638 4.916651 -2.417866      10.55915 
1 1 1 5   33 19 o 18.41840 6.185062 4.160683       3.276073 5.858891       6.712862 3.629767       3.753404 23.05486 8.720402 18.09044 6.579836 4.964420       10.92427 
1 1 1 5   33 20 o 41.03831 4.029273 21.23583       3.977618 20.30279       8.793847 21.47582       4.459930 37.48131 9.589696 41.09307 4.528735 -3.611759      10.60527 
1 1 1 5   33 21 o 56.52241 3.327428 39.84859       4.562890 40.51252       9.746382 39.66223       5.163729 54.53162 7.535491 56.19646 3.792886 -1.664841      8.436208 
1 1 1 5   33 22 o 17.29782 5.952927 3.703812       3.037024 8.602121       7.279972 2.671713       3.341700 25.19178 9.163492 16.13150 6.140832 9.060274       11.03084 
1 1 1 5   33 23 o 32.40176 4.397367 13.61698       3.382614 10.03901       7.973007 14.40236       3.735461 26.27315 9.584774 33.17372 4.756682 -6.900564      10.70018 
1 1 1 5   33 24 o 28.08417 5.240718 10.64017       3.454758 0.000000       0.000000 10.64017       3.454758 ?        ?        28.08417 5.240718 0.000000       5.240718 
1 1 1 5   33 25 o 30.98389 4.578004 12.74467       3.352641 27.98934       8.517049 9.949341       3.647088 42.56195 8.509297 26.67775 5.777524 15.88420       10.28533 
1 1 1 5   33 26 o 21.66076 5.865030 6.734784       3.171303 18.31393       8.553552 4.889425       3.414669 31.89236 9.938218 18.66599 6.314637 13.22637       11.77467 
1 1 1 5   33 27 o 25.03122 5.670311 8.993708       3.378330 2.951751       8.805449 10.03658       3.658288 19.73274 8.847710 26.35925 5.848184 -6.626505      10.60581 
1 1 1 5   33 28 o 12.44830 5.326505 0.6982236      2.873821 4.075220       7.189626 0.5606608E-01  3.135175 19.08865 8.297093 12.23767 5.394527 6.850981       9.896600 
1 1 1 5   33 29 o 27.28793 5.855001 11.13357       3.776821 16.14677       9.714301 10.24084       4.099329 26.38823 10.35408 25.50340 6.559165 0.8848305      12.25682 
1 1 1 5   33 30 o 11.10608 5.012264 -0.4427927     2.878253 0.4411949      7.817101 -0.5814310     3.095739 16.58556 7.759477 11.35669 5.154483 5.228867       9.315481 
1 1 1 5   33 31 o 17.45317 6.049581 4.862308       3.138607 9.784890       7.882663 3.934868       3.421520 20.95217 8.888482 16.15891 6.198318 4.793259       10.83625 
1 1 1 5   33 32 o 13.74747 5.597191 2.339480       2.947346 5.968493       5.770133 1.058383       3.428329 18.06518 7.631474 12.87909 5.660494 5.186098       9.501609 
1 1 1 5   33 33 o 15.99015 5.836685 4.154928       2.957195 5.229175       5.956841 3.803594       3.406621 17.11232 7.492941 15.52196 6.119011 1.590356       9.674009 
1 1 1 5   34 0  o 36.91621 6.825118 17.43778       5.913824 0.000000       0.000000 17.43778       5.913824 ?        ?        36.91621 6.825118 0.000000       6.825118 
1 1 1 5   34 1  o 81.00666 3.594003 80.54908       7.077059 67.20102       12.18715 87.34023       8.692905 73.22117 6.911933 84.23830 4.248382 -11.01713      8.113173 
1 1 1 5   34 2  o 58.29120 4.141441 41.91377       5.844576 62.70544       10.78624 33.27189       6.953920 70.86338 6.312143 51.61226 5.619565 19.25112       8.451193 
1 1 1 5   34 3  o 159.0900 3.279284 309.8593       12.71329 349.7110       27.07273 298.5849       14.39979 167.6551 6.639555 156.0450 3.786780 11.61006       7.643519 
1 1 1 5   34 4  o 100.8222 3.306725 124.6109       8.113386 143.9845       15.13552 116.7993       9.610891 107.7316 5.786487 97.45722 4.055680 10.27433       7.066256 
1 1 1 5   34 5  o 70.73037 3.126083 61.35975       5.374874 59.82106       7.501877 62.98272       7.704617 69.60152 4.446231 71.42368 4.448713 -1.822151      6.289675 
1 1 1 5   34 6  o 108.8652 2.919663 145.1272       7.738656 149.7221       11.53993 141.3723       10.43197 110.2574 4.303225 107.2126 3.999875 3.044800       5.875095 
1 1 1 5   34 7  o 66.85014 3.390250 54.92178       5.504906 53.90779       7.188282 56.35984       8.560498 66.01442 4.495198 67.32287 5.259673 -1.308449      6.918885 
1 1 1 5   34 8  o 10.12964 4.832582 -4.352584      3.320701 -4.555082      3.911460 -3.829943      6.283903 11.28665 5.344180 15.93073 7.274276 -4.644087      9.026370 
1 1 1 5   34 9  o 78.10336 3.018982 74.84688       5.735189 73.65617       8.072018 76.06074       8.150110 77.20132 4.307715 78.46239 4.278707 -1.261070      6.071552 
1 1 1 5   34 10 o 52.93818 3.329327 34.52817       4.273233 30.68662       5.747872 39.27516       6.389445 49.58482 4.817532 56.17751 4.710627 -6.592693      6.737850 
1 1 1 5   34 11 o 49.27028 4.349452 30.20464       5.168656 38.16001       9.596426 26.95381       6.134464 54.45176 7.425304 46.21175 5.558877 8.240013       9.275573 
1 1 1 5   34 12 o 54.40008 4.249309 36.78453       5.588520 30.85984       9.242484 40.19900       7.016460 48.53189 8.100249 56.63297 5.140009 -8.101078      9.593422 
1 1 1 5   34 13 o 73.68173 3.772025 67.13501       6.750295 56.21693       11.40040 73.02937       8.376545 66.12086 7.191001 76.62041 4.506153 -10.49955      8.486219 
1 1 1 5   34 14 o 48.78857 3.934752 29.61459       4.638472 36.92033       9.574574 27.37410       5.302231 53.14767 7.609502 46.67915 4.726276 6.468521       8.957802 
1 1 1 5   34 15 o 10.44636 4.936363 -3.642497      3.305799 -0.7398140     6.228519 -4.780847      3.900523 17.46808 7.654960 11.05525 5.263898 6.412829       9.290157 
1 1 1 5   34 16 o 29.46824 5.477791 11.28125       3.788896 3.851768       6.955063 14.41659       4.518192 21.64718 8.674552 33.30569 5.776145 -11.65851      10.42169 
1 1 1 5   34 17 o 35.99747 4.553043 16.46949       3.904823 13.72005       8.393349 17.22895       4.411278 31.28574 9.858612 36.65378 5.074640 -5.368040      11.08802 
1 1 1 5   34 18 o 36.35447 4.527149 16.84678       3.924030 17.39619       8.320114 16.68961       4.450045 34.75681 9.536675 35.92233 5.237567 -1.165524      10.88027 
1 1 1 5   34 19 o 27.93327 5.420867 10.29646       3.556880 23.23620       8.073948 7.180465       3.962064 40.61801 8.433228 23.05703 6.672187 17.56098       10.75348 
1 1 1 5   34 20 o 36.44527 4.245026 16.98016       3.699648 19.25020       7.942676 16.35117       4.180898 36.19483 9.034031 35.45284 4.976098 0.7419853      10.31384 
1 1 1 5   34 21 o 37.48812 4.268040 18.05889       3.829692 32.51997       9.061334 14.91401       4.225648 47.72837 8.078673 33.53592 5.350340 14.19245       9.689742 
1 1 1 5   34 22 o 16.03729 6.102528 2.768778       3.299318 0.000000       0.000000 2.768778       3.299318 ?        ?        16.03729 6.102528 0.000000       6.102528 
1 1 1 5   34 23 o 12.10074 5.243603 0.7745679E-01  2.853495 -11.71612      6.818792 2.581228       3.141825 12.64836 6.230992 15.49104 5.940222 -2.842681      8.608804 
1 1 1 5   34 24 o 24.77689 5.528097 8.578348       3.252940 6.759336       8.434724 8.896168       3.525684 22.53617 9.352239 25.05008 5.877492 -2.513908      11.04578 
1 1 1 5   34 25 o 33.47708 5.282552 15.47454       4.166762 10.50291       8.267750 17.16723       4.824223 24.77480 9.600183 34.81241 5.896947 -10.03761      11.26665 
1 1 1 5   34 26 o 19.52145 6.044409 5.574358       3.169653 5.680123       7.948490 5.554359       3.456362 20.77570 8.873244 19.43547 6.346711 1.340233       10.90941 
1 1 1 5   34 27 o 14.98114 5.911952 2.572738       3.182933 -2.394033      6.611755 4.071020       3.631420 15.07281 7.078685 17.17733 6.431758 -2.104526      9.564272 
1 1 1 5   34 28 o 13.77738 5.666674 1.827164       3.059514 3.865554       8.038938 1.481901       3.308494 18.72984 8.421395 13.68833 5.780416 5.041509       10.21436 
1 1 1 5   34 29 o 26.17262 5.571767 10.32006       3.444562 20.45526       9.200518 8.667863       3.714726 28.94553 10.33069 23.17552 6.377591 5.770012       12.14071 
1 1 1 5   34 30 o 11.74011 5.219934 0.2377755      2.997841 16.14718       8.220355 -2.202667      3.219570 25.42925 9.642817 10.27787 4.861175 15.15138       10.79884 
1 1 1 5   34 31 f 10.53714 4.852432 -0.8429399     2.877532 2.768061       8.515964 -1.308368      3.057358 16.86934 7.956753 10.49382 4.890707 6.375513       9.339643 
1 1 1 5   34 32 o 10.52553 4.876571 -0.9355941     2.971010 3.045032       8.825100 -1.444411      3.155184 16.64747 7.924120 10.46282 4.906142 6.184649       9.319973 
1 1 1 5   35 0  o 62.56358 4.236890 48.37046       6.421486 40.81598       9.945867 53.77073       8.409061 56.61252 7.385207 65.72960 5.294656 -9.117077      9.087060 
1 1 1 5   35 1  o 54.16293 3.843735 36.21175       5.040351 33.05510       6.563110 40.75045       7.869754 51.42667 5.313460 57.04450 5.739151 -5.617828      7.821171 
1 1 1 5   35 2  o 66.49654 5.260974 55.04045       8.455718 0.000000       0.000000 55.04045       8.455718 ?        ?        66.49654 5.260974 0.000000       5.260974 
1 1 1 5   35 3  o 88.26034 3.246410 95.62124       6.970509 107.7940       14.44516 91.92641       7.958396 92.74703 6.431084 86.42021 3.788179 6.326820       7.463856 
1 1 1 5   35 4  o 137.7803 2.860834 232.4406       9.605413 267.3321       16.20476 213.5406       11.92649 147.1535 4.524306 131.7872 3.717384 15.36632       5.855620 
1 1 1 5   35 5  o 35.94781 4.822912 16.24697       4.118415 22.74357       5.291438 6.264051       6.559327 42.54139 5.212998 23.97505 8.701446 18.56634       10.14350 
1 1 1 5   35 6  o 19.57827 6.207270 4.730855       3.322787 8.720706       4.608819 0.4122021      4.794966 25.90197 7.094166 16.39354 6.942527 9.508423       9.926020 
1 1 1 5   35 7  o 27.25679 5.681347 9.585220       3.651147 10.80081       5.064473 8.269675       5.268577 28.70153 7.242147 25.41348 7.779292 3.288044       10.62855 
1 1 1 5   35 8  o 13.51928 5.637002 0.5502026      3.085247 4.348355       4.016477 -4.916573      4.818643 19.54437 6.839196 12.81128 6.024892 6.733088       9.114491 
1 1 1 5   35 9  o 30.60474 4.884927 11.90240       3.520790 20.17067       4.812988 2.384883       5.163800 39.98189 5.052487 18.63551 7.472165 21.34638       9.020026 
1 1 1 5   35 10 o 28.08693 5.320051 10.15007       3.508027 10.92693       4.185097 8.314652       6.432801 28.97092 6.120074 25.81469 8.666953 3.156229       10.60997 
1 1 1 5   35 11 o 52.46674 4.693419 34.48921       5.937493 33.43571       9.171567 35.24928       7.790277 50.52272 7.691809 52.52049 6.206555 -1.997776      9.883585 
1 1 1 5   35 12 o 19.99962 6.713748 4.865830       3.860098 -0.8871644     6.359246 8.222244       4.857317 17.57591 7.717559 25.02374 7.428268 -7.447828      10.71167 
1 1 1 5   35 13 o 14.36131 6.233173 -0.3156694     4.045373 0.5558782      6.349275 -0.9112420     5.248630 18.48649 7.913881 15.88391 6.991679 2.602577       10.55998 
1 1 1 5   35 14 o 16.04546 6.285998 2.140406       3.575710 2.668142       6.017699 1.852385       4.445641 19.65333 7.999256 16.95431 6.884805 2.699018       10.55408 
1 1 1 5   35 15 f 24.01973 6.400558 7.697031       3.813935 10.35447       7.378046 6.727968       4.455388 27.72997 9.281544 22.68533 7.187171 5.044641       11.73893 
1 1 1 5   35 16 f 14.39581 5.934692 1.063172       3.365958 0.4900054      6.255931 1.296703       3.993224 18.06610 7.796165 15.63362 6.456406 2.432480       10.12252 
1 1 1 5   35 17 f 20.89917 6.334885 5.791817       3.505190 16.07351       7.101974 2.480703       4.030267 33.54868 8.636031 16.86734 6.653668 16.68134       10.90194 
1 1 1 5   35 18 o 49.67297 3.590703 30.99566       4.317124 41.36079       9.195584 28.06519       4.889464 55.29445 6.979554 46.93745 4.323240 8.357002       8.210030 
1 1 1 5   35 19 o 19.06009 6.128098 4.793646       3.229729 6.836828       6.333608 4.075645       3.754569 22.98400 8.515796 18.32372 6.592290 4.660275       10.76927 
1 1 1 5   35 20 o 61.00510 3.822922 47.24851       5.654691 0.000000       0.000000 47.24851       5.654691 ?        ?        61.00510 3.822922 0.000000       3.822922 
1 1 1 5   35 21 o 14.53012 5.841547 1.765332       3.164820 -1.321344      6.143177 2.880540       3.692542 16.04845 7.274855 16.50157 6.409837 -0.4531174     9.695850 
1 1 1 5   35 22 o 15.72454 5.964351 2.811518       3.145414 6.639366       7.095580 1.875352       3.509030 22.15419 8.800137 14.99711 6.106795 7.157074       10.71146 
1 1 1 5   35 23 o 17.37137 6.065173 4.054393       3.157739 9.749554       7.830275 2.948313       3.450780 24.44294 9.376554 16.06257 6.208148 8.380369       11.24548 
1 1 1 5   35 24 o 19.06732 6.113956 5.231792       3.216373 7.044136       7.575816 4.833288       3.552430 21.87163 8.947562 18.49929 6.434706 3.372345       11.02108 
1 1 1 5   35 25 o 24.23826 5.688414 8.534233       3.301834 13.69024       7.754959 7.392589       3.649117 26.95049 9.497540 22.09788 6.405830 4.852608       11.45591 
1 1 1 5   35 26 o 11.70659 5.277686 -0.5643628     3.181408 10.92807       8.397360 -2.490355      3.437670 23.63112 9.510140 10.78440 5.077022 12.84671       10.78049 
1 1 1 5   35 27 f 33.99951 4.734669 16.20984       3.816547 11.55819       8.841284 17.27515       4.231064 23.18903 9.594692 34.70615 5.159442 -11.51712      10.89394 
1 1 1 5   35 28 o 10.83017 5.024983 -1.378355      3.171902 -1.740813      7.409091 -1.297017      3.509802 15.26776 7.265470 11.43113 5.297602 3.836627       8.991754 
1 1 1 5   35 29 o 18.81894 6.380749 5.912302       3.486660 28.67940       9.109799 2.004797       3.774024 35.26342 10.09040 14.22823 6.096406 21.03519       11.78908 
1 1 1 5   35 30 o 12.33043 5.366039 0.9886974      3.014808 -3.124572      8.267669 1.619519       3.237745 14.73038 7.172438 13.19884 5.650821 1.531546       9.131026 
1 1 1 5   36 0  o 20.09438 6.424753 4.985934       3.553591 3.224657       4.708517 7.316803       5.416630 18.95629 7.271242 24.28219 7.946159 -5.325903      10.77091 
1 1 1 5   36 1  o 96.59480 3.021222 114.5631       7.102940 109.4128       10.24302 119.3336       9.858177 93.96361 4.486303 98.26543 4.125981 -4.301819      6.095132 
1 1 1 5   36 2  o 50.74339 3.625440 31.84048       4.453542 31.20351       6.345822 32.45871       6.251750 49.81606 5.309069 50.87449 5.111937 -1.058426      7.370082 
1 1 1 5   36 3  o 51.03748 4.206427 32.38161       5.185248 40.35020       9.575023 29.07499       6.167953 56.04038 7.175807 48.04010 5.359873 8.000275       8.956586 
1 1 1 5   36 4  o 43.03297 4.709293 23.22291       4.857933 21.91616       9.073814 23.74796       5.751676 40.27051 9.415634 43.27993 5.583411 -3.009415      10.94663 
1 1 1 5   36 5  o 122.5920 3.957309 185.6981       11.80671 176.0924       19.14945 191.5889       14.99624 117.8621 6.694769 124.0279 4.971731 -6.165794      8.338947 
1 1 1 5   36 6  o 49.12785 4.465669 30.15226       5.287903 24.62546       8.974256 33.09166       6.544717 42.82477 8.890634 51.23026 5.319735 -8.405487      10.36064 
1 1 1 5   36 7  o 52.79244 3.869574 34.60617       4.943603 34.42967       6.140466 34.93131       8.334375 52.37483 4.866761 52.08899 6.722444 0.2858429      8.299193 
1 1 1 5   36 8  o 32.75873 5.075152 13.69732       3.920526 12.80702       4.707508 15.71268       7.082671 31.27599 6.392570 34.06296 8.547443 -2.786964      10.67351 
1 1 1 5   36 9  o 19.00890 6.073631 4.516121       3.176196 6.191002       4.170354 2.202674       4.901293 22.02029 6.950556 17.99274 7.256927 4.027552       10.04854 
1 1 1 5   36 10 o 36.39009 4.208773 16.66897       3.663568 12.80199       4.784709 22.14861       5.695681 31.13869 6.515107 41.48859 5.791108 -10.34990      8.716854 
1 1 1 5   36 11 o 61.04037 4.311340 46.66359       6.371802 53.76295       10.32156 42.29211       8.099354 64.37508 6.676301 57.43516 5.869194 6.939915       8.889343 
1 1 1 5   36 12 o 60.35805 4.207170 45.66598       6.149416 55.45366       10.36616 40.35130       7.638644 65.26885 6.608380 56.08212 5.666943 9.186729       8.705454 
1 1 1 5   36 13 o 37.06163 4.895878 17.60180       4.313674 20.24484       7.939220 16.49469       5.138296 37.99562 8.754558 35.35773 6.188799 2.637890       10.72117 
1 1 1 5   36 14 o 33.10615 5.331448 14.28069       4.155158 20.85843       7.340111 11.17879       5.040563 38.79989 8.028024 28.54684 7.237089 10.25305       10.80854 
1 1 1 5   36 15 o 12.72584 5.630695 -0.7409533     3.446279 -3.960637      5.989031 0.8529200      4.213828 14.89230 6.908042 15.45544 6.524925 -0.5631409     9.502404 
1 1 1 5   36 16 o 24.28760 6.325237 8.060841       3.780118 15.40479       7.651023 5.689257       4.347843 32.21184 9.256798 20.91225 7.124812 11.29959       11.68124 
1 1 1 5   36 17 o 13.69697 5.852584 0.4091665      3.460728 -3.997237      6.734563 1.990279       4.034119 15.70393 7.298515 16.14970 6.558286 -0.4457712     9.812208 
1 1 1 5   36 18 o 23.12819 6.858283 7.518149       4.142260 0.000000       0.000000 7.518149       4.142260 ?        ?        23.12819 6.858283 0.000000       6.858283 
1 1 1 5   36 19 o 24.73673 6.789836 8.771185       4.216602 0.000000       0.000000 8.771185       4.216602 ?        ?        24.73673 6.789836 0.000000       6.789836 
1 1 1 5   36 20 o 15.09023 5.948837 2.235644       3.219785 -1.519938      6.073092 3.704005       3.797410 15.70466 7.163451 17.48144 6.570513 -1.776779      9.720426 
1 1 1 5   36 21 o 28.87370 5.470559 11.56102       3.708334 14.97887       7.981451 10.62009       4.187791 29.38357 9.647412 27.02912 6.448363 2.354456       11.60405 
1 1 1 5   36 22 o 30.85922 4.973803 13.00701       3.613204 20.99075       7.849958 10.86089       4.069968 35.29740 9.075924 27.31125 6.250695 7.986151       11.02014 
1 1 1 5   36 23 f 13.36098 5.635189 1.085230       3.138026 1.880675       6.305432 0.8233590      3.617879 17.41435 7.664395 13.77903 5.937309 3.635315       9.695081 
1 1 1 5   36 24 o 34.81269 5.045000 16.88292       4.155328 24.49277       8.826517 14.71610       4.709911 36.03329 9.796480 31.32339 6.387097 4.709896       11.69470 
1 1 1 5   36 25 o 12.20017 5.386344 0.1449302      3.137161 4.450425       7.284703 -0.8353732     3.476007 18.92012 8.285271 11.92937 5.432939 6.990756       9.907701 
1 1 1 5   36 26 o 15.91373 6.124682 3.485795       3.348426 0.4074611E-01  7.510861 4.340326       3.740727 16.33615 7.630740 17.12729 6.502489 -0.7911472     10.02549 
1 1 1 5   36 27 o 12.49080 5.483914 0.6462219      3.209863 9.502349       8.158364 -0.9757763     3.491454 21.06030 8.992067 11.59135 5.340492 9.468945       10.45840 
1 1 1 5   36 28 o 12.68014 5.507879 1.039379       3.163883 -1.896584      7.752666 1.626068       3.465613 15.08612 7.246834 13.57096 5.828868 1.515153       9.300124 
1 1 1 5   36 29 o 10.57519 4.904699 -1.084781      3.017244 5.292556       8.132693 -2.102678      3.249127 17.80017 8.182737 10.28016 4.868536 7.520012       9.521545 
1 1 1 5   37 0  o 99.07571 2.986340 120.7400       7.201890 123.6728       10.59004 118.2165       9.823158 99.74174 4.367559 97.61166 4.139046 2.130081       6.017248 
1 1 1 5   37 1  o 55.51768 3.453955 38.13593       4.649729 32.41267       6.421572 44.44368       6.741508 50.63696 5.281555 59.58636 4.680276 -8.949398      7.056898 
1 1 1 5   37 2  o 52.90751 3.569413 34.69403       4.575103 35.22254       6.460194 34.16224       6.480198 52.86117 5.077385 52.01713 5.180999 0.8440437      7.254143 
1 1 1 5   37 3  o 70.51013 3.206015 61.34366       5.494339 78.96189       8.356739 47.92901       7.291976 79.62482 4.322989 61.78252 4.883000 17.84230       6.521651 
1 1 1 5   37 4  o 57.07208 3.894500 40.51060       5.383955 38.69025       6.651757 43.96868       9.168034 55.41320 4.978943 58.42741 6.551800 -3.014206      8.228971 
1 1 1 5   37 5  o 36.65502 5.061135 17.12794       4.400307 19.86885       5.560966 12.53763       7.196536 39.19824 6.013317 30.35302 9.049462 8.845226       10.86521 
1 1 1 5   37 6  o 17.98250 6.312471 3.734017       3.423377 3.329165       4.103807 4.660398       6.207739 18.16867 6.830097 21.68662 8.341168 -3.517956      10.78078 
1 1 1 5   37 7  o 74.47565 3.620135 68.83215       6.550467 79.25753       12.51492 64.89828       7.687625 78.32300 6.618864 71.99815 4.402671 6.324852       7.949395 
1 1 1 5   37 8  o 45.77951 4.635702 26.50356       5.100372 41.03230       9.146494 19.94705       6.144371 55.98590 6.846373 38.85115 6.733789 17.13475       9.602955 
1 1 1 5   37 9  o 59.52268 3.990823 44.32510       5.755250 68.89825       10.88450 34.78859       6.780668 73.03464 6.173424 52.11718 5.417924 20.91745       8.213712 
1 1 1 5   37 10 o 15.44811 5.858382 2.322706       3.034290 2.917225       3.863887 1.366219       4.900956 17.26239 6.595490 17.01657 7.100671 0.2458153      9.691234 
1 1 1 5   37 11 o 21.46839 6.687866 6.072135       3.873832 7.359427       6.194378 5.245306       4.964405 23.99653 8.485463 20.96322 7.575323 3.033310       11.37491 
1 1 1 5   37 12 o 63.50464 4.196206 50.88839       6.457396 45.03799       9.973021 55.11166       8.473416 57.82196 7.235767 65.40102 5.363733 -7.579056      9.006995 
1 1 1 5   37 13 o 54.52362 4.599871 37.96985       6.054807 37.19878       9.477785 38.50153       7.870152 51.90610 7.728258 54.00256 6.086318 -2.096462      9.837136 
1 1 1 5   37 14 o 12.99573 5.735425 -0.5753902     3.553787 -2.758881      5.988700 0.6114411      4.415210 15.39756 7.057342 15.42379 6.600999 -0.2623272E-01 9.663295 
1 1 1 5   37 15 o 27.46820 5.933506 10.28377       3.855459 12.13041       6.671993 9.358015       4.724030 28.56535 8.756223 25.69514 7.237566 2.870211       11.36018 
1 1 1 5   37 16 o 11.31985 5.317695 -3.255146      3.735919 0.000000       0.000000 -3.255146      3.735919 ?        ?        11.31985 5.317695 0.000000       5.317695 
1 1 1 5   37 17 o 28.30542 6.412863 11.30371       4.320595 0.000000       0.000000 11.30371       4.320595 ?        ?        28.30542 6.412863 0.000000       6.412863 
1 1 1 5   37 18 o 13.41686 5.734978 0.5974874      3.325220 6.582861       6.585201 -1.450961      3.852440 22.00733 8.556706 12.58298 5.726315 9.424353       10.29601 
1 1 1 5   37 19 o 14.19003 5.821056 1.553941       3.217564 4.064559       6.245658 0.6469000      3.754060 19.45507 8.058311 14.03499 6.047813 5.420087       10.07534 
1 1 1 5   37 20 o 19.67748 6.411745 5.564297       3.528516 7.350844       7.037294 4.964313       4.078199 22.25233 8.787743 18.95398 6.863674 3.298344       11.15054 
1 1 1 5   37 21 o 40.05974 4.379622 21.39651       4.205859 29.94720       8.551157 18.66790       4.830536 42.97675 8.466289 36.42389 5.623011 6.552864       10.16348 
1 1 1 5   37 22 o 15.71655 6.200340 2.864111       3.500112 -0.9217187     6.661522 4.307824       4.113706 15.97829 7.367105 17.81768 6.805926 -1.839389      10.02970 
1 1 1 5   37 23 o 50.05215 5.129930 35.11658       6.168624 32.65321       9.654035 36.81628       8.019189 41.84129 9.663149 48.79855 6.938870 -6.957253      11.89640 
1 1 1 5   37 24 o 13.77039 5.805033 1.559220       3.327425 -2.650230      7.479045 2.598040       3.715383 15.38131 7.313864 15.24079 6.253982 0.1405220      9.623144 
1 1 1 5   37 25 o 22.54509 6.239274 8.127120       3.544109 11.19092       8.366683 7.457150       3.912466 22.49606 9.323136 21.14510 6.739271 1.350964       11.50385 
1 1 1 5   37 26 o 24.10231 6.252786 9.418873       3.703536 16.36407       9.503700 8.175316       4.021455 24.67357 10.04889 21.80181 6.817524 2.871759       12.14326 
1 1 1 5   37 27 o 17.15862 6.344042 4.793941       3.511754 12.13994       8.321431 3.202168       3.873587 21.99275 9.220079 15.38230 6.356396 6.610454       11.19882 
1 1 1 5   38 0  o 75.61095 3.855390 71.17421       7.080324 65.71413       7.871737 94.30556       16.20211 72.37260 4.485387 84.27698 7.984300 -11.90438      9.157934 
1 1 1 5   38 1  o 53.32811 4.412661 35.76123       5.683179 37.05029       6.263636 29.75737       13.51782 54.13649 4.797504 44.43454 12.14127 9.701954       13.05475 
1 1 1 5   38 2  o 31.66212 5.756245 13.10144       4.277801 13.74771       5.066644 11.49703       7.983054 32.11585 6.691322 29.08193 9.652695 3.033918       11.74514 
1 1 1 5   38 3  o 50.17720 3.449131 31.32157       4.191818 33.30486       6.147263 29.59786       5.730869 51.18954 4.991252 48.25073 4.943771 2.938808       7.025203 
1 1 1 5   38 4  f 53.45791 3.287366 35.48597       4.261775 29.57525       5.989564 41.54705       6.065269 48.10139 5.191933 57.46301 4.364006 -9.361618      6.782382 
1 1 1 5   38 5  o 16.54659 5.971422 3.049190       3.083495 1.848235       4.150811 4.528037       4.606078 16.45491 6.663328 19.93714 7.283284 -3.482229      9.871483 
1 1 1 5   38 6  o 80.63705 3.465821 80.85313       6.794567 75.61525       11.24413 83.86584       8.527593 76.39558 6.090167 81.69022 4.298843 -5.294640      7.454541 
1 1 1 5   38 7  o 51.94601 3.751074 33.80018       4.716383 34.27890       6.017384 33.03763       7.594544 51.86417 4.816088 50.11349 6.362056 1.750687       7.979377 
1 1 1 5   38 8  o 18.81096 6.425488 4.389449       3.536622 4.131945       4.452005 4.829888       5.822464 19.21192 7.135643 21.11177 8.088843 -1.899843      10.78642 
1 1 1 5   38 9  o 20.08731 6.518134 5.254056       3.648634 7.969137       4.597828 0.6364073      5.996140 24.13446 7.242245 17.68854 7.632898 6.445925       10.52194 
1 1 1 5   38 10 o 15.02357 5.955185 1.868715       3.242917 -2.159038      4.237265 7.563587       5.038441 13.07366 5.971078 23.55897 7.660717 -10.48531      9.712896 
1 1 1 5   38 11 o 45.44279 5.115520 26.86697       5.566585 27.62499       8.446770 26.28500       7.401133 44.07660 8.164656 43.65154 7.209080 0.4250641      10.89185 
1 1 1 5   38 12 o 22.48386 6.693252 6.979756       3.939200 7.597781       6.791061 6.666368       4.835889 23.86730 8.822535 22.17703 7.514628 1.690271       11.58908 
1 1 1 5   38 13 o 30.56396 5.788164 12.67511       4.153288 9.876886       7.296737 14.01619       5.051430 25.95827 9.206703 31.63517 6.757821 -5.676901      11.42066 
1 1 1 5   38 14 o 23.62173 7.324499 8.018644       4.652447 0.000000       0.000000 8.018644       4.652447 ?        ?        23.62173 7.324499 0.000000       7.324499 
1 1 1 5   38 15 o 12.65508 5.949118 -3.693860      4.690162 0.000000       0.000000 -3.693860      4.690162 ?        ?        12.65508 5.949118 0.000000       5.949118 
1 1 1 5   38 16 o 15.42378 6.075425 2.394740       3.355869 -4.496458      5.612723 6.228959       4.186632 13.55165 6.412225 20.90276 6.991609 -7.351110      9.486792 
1 1 1 5   38 17 o 10.92800 5.050596 -1.882494      3.157946 -1.410375      5.444285 -2.121885      3.876766 14.85410 6.778160 12.09269 5.591383 2.761413       8.786752 
1 1 1 5   38 18 o 39.55002 4.457147 20.76477       4.221035 30.26724       8.634655 17.78087       4.838589 43.77797 8.399229 35.62130 5.771389 8.156677       10.19098 
1 1 1 5   38 19 o 13.03529 5.672153 0.3634841      3.367800 3.731142       6.970888 -0.6618854     3.846487 19.23003 8.263264 12.92501 5.817161 6.305017       10.10549 
1 1 1 5   38 20 o 64.33270 4.152910 54.75166       6.475807 58.25953       11.14661 52.96446       7.956245 61.01200 7.665877 61.71468 5.342919 -0.7026749     9.344113 
1 1 1 5   38 21 o 17.86917 6.538042 4.604055       3.713874 4.013168       6.982523 4.837161       4.385677 18.80928 8.176180 18.34709 7.022567 0.4621925      10.77805 
1 1 1 5   38 22 o 13.84446 5.788146 1.647041       3.265898 7.770207       6.984052 -0.6664772E-01 3.694753 21.10175 8.606803 12.82872 5.743241 8.273029       10.34707 
1 1 1 5   38 23 o 13.78909 5.811916 1.664035       3.334400 -1.741429      6.781810 2.749713       3.829198 15.00627 7.084849 15.36187 6.331124 -0.3555927     9.501485 
1 1 1 5   38 24 o 34.68444 4.990077 17.38240       4.096489 25.30220       9.146756 15.39526       4.581678 33.06679 10.27276 31.30415 6.225232 1.762642       12.01179 
1 1 1 5   38 25 o 12.17572 5.469631 0.9762253E-01  3.382724 2.714716       7.980768 -0.4755262     3.734812 17.14089 7.959103 12.21281 5.588489 4.928079       9.725149 
1 1 1 5   38 26 o 26.78858 6.032675 11.54633       3.843151 27.53292       9.840898 8.669412       4.174657 31.80027 10.71998 21.97342 6.956492 9.826851       12.77931 
1 1 1 5   39 0  o 101.2556 3.269031 127.3649       8.055727 125.9249       10.57377 129.3570       12.43663 99.94575 4.351825 100.6908 5.084932 -0.7450180     6.692900 
1 1 1 5   39 1  o 35.01745 4.173076 15.59311       3.491054 17.94155       5.148101 13.59377       4.750075 36.87124 5.930680 31.82246 6.348021 5.048782       8.687366 
1 1 1 5   39 2  f 73.37495 2.886744 66.68063       5.151621 68.87183       7.867186 65.03574       6.816284 73.79470 4.394705 71.98376 3.900338 1.810944       5.875889 
1 1 1 5   39 3  o 21.04297 6.108054 5.915908       3.315760 2.184855       4.109391 12.87694       5.613047 16.62014 6.665190 30.36963 7.602673 -13.74949      10.11066 
1 1 1 5   39 4  o 8.860993 4.322104 -5.293218      3.039229 -3.352180      3.895069 -8.314322      4.859382 11.70493 5.476489 11.12955 5.436567 0.5753822      7.716748 
1 1 1 5   39 5  o 28.63477 5.147835 10.78626       3.460106 15.80033       4.888898 5.753981       4.897770 34.37327 6.057774 21.31393 7.544504 13.05934       9.675545 
1 1 1 5   39 6  o 42.45256 3.738692 22.75627       3.828285 26.51266       5.679085 19.62760       5.182899 45.11107 5.264929 38.52888 5.691219 6.582191       7.753028 
1 1 1 5   39 7  o 41.01824 4.163808 21.46585       4.104408 25.71516       5.635258 16.66473       5.989989 44.33372 5.322359 34.49926 7.350054 9.834465       9.074734 
1 1 1 5   39 8  o 25.67879 6.762246 9.199112       4.289218 5.901971       7.315552 10.92630       5.294787 22.66756 8.957273 27.64281 7.616893 -4.975254      11.75797 
1 1 1 5   39 9  o 68.07665 3.533972 58.35158       5.842624 54.89951       7.436637 63.91869       9.443906 65.21728 4.711018 69.59249 5.616361 -4.375214      7.330566 
1 1 1 5   39 10 o 16.83808 6.195918 3.317408       3.342883 6.164135       4.389884 -0.6118124     5.157429 21.24771 7.159830 15.37203 6.839993 5.875678       9.901953 
1 1 1 5   39 11 o 11.62143 5.470199 -3.492016      3.987892 -4.872846      6.462896 -2.643028      5.067667 14.72733 6.941886 13.89782 6.414212 0.8295031      9.451555 
1 1 1 5   39 12 o 18.87309 8.563426 -0.5705367     8.536808 0.000000       0.000000 -0.5705367     8.536808 ?        ?        18.87309 8.563426 0.000000       8.563426 
1 1 1 5   39 13 o 14.37367 6.285026 0.2064379      4.178251 -7.924108      6.424957 6.164775       5.500130 13.29694 6.439026 21.21505 7.921183 -7.918114      10.20814 
1 1 1 5   39 14 o 23.88736 6.413947 8.250553       3.811927 16.01810       7.484596 5.530068       4.429448 31.09173 9.218737 19.99668 7.164428 11.09505       11.67536 
1 1 1 5   39 15 o 16.15981 6.339562 2.845954       3.641164 8.782073       6.676196 0.3326145      4.344135 23.70495 8.750265 14.57112 6.388987 9.133831       10.83450 
1 1 1 5   39 16 o 31.35197 6.035173 14.03753       4.443636 15.90967       7.899729 13.17098       5.374538 29.97872 9.578567 29.15956 7.516039 0.8191566      12.17538 
1 1 1 5   39 17 o 21.49948 6.566024 6.912911       3.756137 9.819579       7.355735 5.887643       4.368647 24.04523 9.120778 20.00849 7.121043 4.036743       11.57142 
1 1 1 5   39 18 o 9.151951 4.480753 -5.494178      3.357070 -8.460047      7.039351 -4.621062      3.819378 13.40575 6.547347 10.40690 5.021162 2.998847       8.251050 
1 1 1 5   39 19 o 36.68618 6.955092 20.81968       5.990380 11.92287       8.597151 29.21541       8.351541 24.56944 9.709786 41.42197 8.556999 -16.85253      12.94226 
1 1 1 5   39 20 o 15.61683 6.170864 3.014207       3.471932 3.219288       7.093043 2.949589       3.981518 18.10297 8.040284 15.92302 6.497000 2.179946       10.33717 
1 1 1 5   39 21 o 10.95705 5.082325 -1.511541      3.241003 2.058069       6.454879 -2.714811      3.747652 16.74069 7.534982 11.04675 5.230733 5.693942       9.172596 
1 1 1 5   39 22 o 11.91573 5.447444 -0.7178737     3.537738 11.64632       7.836045 -3.883173      3.964801 23.04904 9.217309 10.70507 5.152615 12.34397       10.55975 
1 1 1 5   39 23 o 14.42798 6.082653 2.191383       3.653690 -12.04961      7.900576 6.065661       4.120824 12.58623 6.285133 18.92784 6.892883 -6.341611      9.328168 
1 1 1 5   39 24 o 24.09649 6.410968 9.663385       3.830102 12.04370       8.959155 9.131065       4.236782 21.83174 9.374350 22.70558 6.980873 -0.8738384     11.68807 
1 1 1 5   40 0  o 30.99606 5.041151 12.64793       3.677058 9.146220       5.050508 16.59774       5.363925 25.40072 7.582971 34.79338 6.566987 -9.392666      10.03129 
1 1 1 5   40 1  o 39.18016 4.071496 19.60945       3.830752 17.11767       5.771281 21.57188       5.121706 35.07117 6.998218 40.48486 5.320030 -5.413689      8.790777 
1 1 1 5   40 2  o 12.99086 5.465049 0.6249857      2.939346 -2.792122      4.224137 3.832757       4.092704 12.55814 5.817063 18.26138 6.830012 -5.703242      8.971471 
1 1 1 5   40 3  o 31.21559 4.545546 12.68919       3.356264 7.261881       4.602538 18.85281       4.904819 22.84520 7.312531 37.65448 5.508196 -14.80928      9.154963 
1 1 1 5   40 4  o 13.53653 5.606966 1.005972       3.023843 -0.5794775     4.270542 2.600089       4.282200 14.12402 6.257728 17.00467 6.809180 -2.880652      9.247923 
1 1 1 5   40 5  o 34.25401 4.796866 15.39599       3.894488 14.21339       5.019828 17.18397       6.172391 31.87949 6.675949 34.56011 7.541390 -2.680622      10.07178 
1 1 1 5   40 6  o 14.10500 5.905419 1.002853       3.406828 4.784653       4.460802 -4.290436      5.277478 19.51010 7.161006 13.36617 6.291871 6.143929       9.532453 
1 1 1 5   40 7  o 10.88113 5.076291 -2.560553      3.307037 -0.1509619     4.070048 -7.242279      5.673236 14.04914 6.171386 12.62821 6.099492 1.420925       8.676970 
1 1 1 5   40 8  o 11.33212 5.131831 -1.205024      3.047856 -0.8786835     4.279852 -1.540825      4.341446 13.77286 6.172440 13.40530 6.092075 0.3675547      8.672507 
1 1 1 5   40 9  o 15.43916 6.196695 2.152675       3.555069 3.197244       5.478487 1.392873       4.672427 18.43921 7.583341 16.05890 6.829113 2.380316       10.20509 
1 1 1 5   40 10 o 14.32644 6.061615 1.022318       3.649820 -0.1578048     5.998635 1.716004       4.599075 16.41942 7.336699 16.19177 6.825204 0.2276440      10.02051 
1 1 1 5   40 11 o 34.45067 5.368190 16.18910       4.359916 33.88280       9.088537 10.90016       4.968997 47.15049 8.207928 26.91508 7.363939 20.23541       11.02713 
1 1 1 5   40 12 o 11.61801 5.338664 -1.716975      3.457019 5.169503       6.004677 -5.131187      4.228014 20.22692 8.075382 11.04670 5.318031 9.180213       9.669191 
1 1 1 5   40 13 o 18.64844 6.629088 4.791232       3.784839 8.998803       6.961522 3.025637       4.509558 23.74616 8.902333 17.08516 6.935527 6.660995       11.28508 
1 1 1 5   40 14 o 30.85822 6.889657 14.28277       5.049671 20.38107       8.303951 10.70444       6.360933 33.92942 9.609176 25.33198 8.618035 8.597437       12.90763 
1 1 1 5   40 15 o 16.79301 6.754682 3.190213       4.233852 11.15782       7.187620 -1.043298      5.239280 25.17174 9.112477 14.52784 6.636923 10.64390       11.27324 
1 1 1 5   40 16 o 12.03302 5.597267 -2.086300      3.974225 6.446871       7.255933 -5.743340      4.750101 20.85720 8.666415 11.40144 5.524790 9.455763       10.27765 
1 1 1 5   40 17 o 15.84187 6.898318 1.721366       4.988715 7.277356       7.829798 -2.075432      6.472596 21.22455 8.923648 15.04352 7.045370 6.181033       11.36964 
1 1 1 5   40 18 o 15.09844 6.543230 1.628775       4.444132 10.43872       8.207980 -2.025085      5.285982 23.02402 9.352990 13.64717 6.383461 9.376855       11.32374 
1 1 1 5   40 19 f 12.51038 5.762272 -1.094980      4.060633 -9.518787      7.282231 2.706055       4.891716 12.91399 6.376446 16.16905 6.934584 -3.255064      9.420589 
1 1 1 5   40 20 f 18.58701 7.065268 5.590554       4.419540 12.90014       8.427019 2.817305       5.190654 23.80211 9.544912 16.28434 7.064247 7.517773       11.87472 
1 1 1 5   40 21 o 20.52667 7.203840 7.401221       4.458271 -0.7294836     7.785329 11.36849       5.438244 15.86098 7.518785 24.50356 7.958193 -8.642578      10.94829 
1 1 1 5   40 22 o 13.71353 6.067318 1.097244       4.000842 -4.774575      6.751750 4.274749       4.966760 13.45108 6.534010 16.98810 7.122637 -3.537020      9.665673 
1 1 1 5   41 0  f 41.74980 3.966242 22.41797       3.986836 26.44723       6.132061 19.46760       5.247251 44.09716 5.850585 37.72240 5.901448 6.374756       8.310020 
1 1 1 5   41 1  o 42.25753 3.900311 22.93583       3.971128 20.36324       5.823644 25.17167       5.429133 38.14761 6.497219 43.43055 5.235261 -5.282936      8.343968 
1 1 1 5   41 2  o 12.21402 5.339332 -0.1266612     3.013781 2.043966       4.371230 -2.093342      4.160810 16.32950 6.750523 12.72493 5.850835 3.604572       8.933187 
1 1 1 5   41 3  o 20.82344 5.999718 6.065133       3.210140 4.232397       4.637821 7.750753       4.447785 18.79446 7.214597 23.10558 7.161109 -4.311113      10.16523 
1 1 1 5   41 4  o 22.56974 5.972083 7.168379       3.335133 5.854317       4.835451 8.360734       4.606084 20.68867 7.476264 23.85714 7.268105 -3.168465      10.42688 
1 1 1 5   41 5  o 20.93303 6.516324 6.217218       3.678383 6.542175       6.512949 6.065016       4.457341 21.96869 8.518528 20.78913 7.209145 1.179550       11.15962 
1 1 1 5   41 6  f 27.54735 5.965981 10.66836       3.888822 14.07933       7.432838 9.382750       4.563203 29.23255 9.285706 25.17663 7.120859 4.055918       11.70175 
1 1 1 5   41 7  o 28.02055 6.348628 11.25137       4.234301 31.26664       8.816195 5.249972       4.827550 45.14495 8.320225 19.83833 7.418272 25.30662       11.14706 
1 1 1 5   41 8  o 14.02151 5.757565 1.479311       3.151706 3.129050       4.567696 -0.1990077E-01 4.354326 17.36348 7.004731 14.34584 6.339182 3.017644       9.447300 
1 1 1 5   41 9  o 11.10621 5.169206 -2.267451      3.397459 -1.540924      4.122476 -3.805598      5.998340 12.85653 5.878635 14.25619 6.709899 -1.399667      8.920824 
1 1 1 5   41 10 o 8.587931 4.299929 -9.613311      3.810866 -14.57554      5.442444 -4.840006      5.337835 9.886291 4.975670 12.84338 6.127165 -2.957089      7.892999 
1 1 1 5   41 11 o 23.58730 7.554930 8.702234       4.912140 9.054496       8.051301 8.493366       6.199687 23.56091 9.369151 23.05748 8.445559 0.5034294      12.61382 
1 1 1 5   41 12 o 17.83286 6.528332 4.361354       3.703625 4.586577       6.558173 4.255889       4.487759 19.50273 8.181256 18.09473 7.055733 1.407995       10.80353 
1 1 1 5   41 13 o 13.07368 5.840122 -0.2405005     3.798223 10.11456       7.641191 -3.638654      4.377299 23.84602 9.232258 11.81666 5.612108 12.02936       10.80418 
1 1 1 5   41 14 o 26.32557 7.373163 11.23087       4.917322 19.94703       8.913278 7.417398       5.895699 31.36890 10.18838 21.32953 8.147665 10.03937       13.04560 
1 1 1 5   41 15 o 15.07204 6.372805 1.963203       4.029714 0.3575786E-01  7.423266 2.768503       4.798248 16.76725 7.747265 16.45898 6.956362 0.3082714      10.41206 
1 1 1 5   41 16 o 20.04366 6.818624 6.425157       3.981963 9.136101       8.316798 5.618886       4.535617 21.95461 9.211677 18.97282 7.169920 2.981791       11.67316 
1 1 1 5   41 17 o 15.88989 6.395070 3.206106       3.797372 11.37467       8.138844 0.9330583      4.293327 23.22406 9.356886 14.23387 6.291938 8.990191       11.27563 
1 1 1 5   41 18 f 14.95160 6.137152 2.581991       3.579234 0.2833439      6.915872 3.422915       4.183012 15.96108 7.410529 16.22506 6.644403 -0.2639790     9.953092 
1 1 1 5   41 19 o 22.02234 7.368278 8.660953       4.649841 20.28809       9.543522 5.041624       5.324592 27.96773 10.43582 17.97304 7.442072 9.994696       12.81760 
1 1 1 5   41 20 o 15.28373 6.195647 3.072351       3.592952 2.289147       7.215010 3.330624       4.143228 16.73929 7.699510 15.85337 6.564619 0.8859196      10.11814 
1 1 1 5   42 0  o 17.46798 6.085870 4.055103       3.178380 -0.4808978     4.613197 8.153960       4.385275 14.37422 6.427594 23.41710 7.083051 -9.042885      9.564705 
1 1 1 5   42 1  o 19.74440 6.164106 5.519835       3.288934 7.615346       4.938072 3.849124       4.409235 22.55891 7.593697 17.97844 6.998468 4.580471       10.32680 
1 1 1 5   42 2  o 27.54854 5.990191 10.77883       3.906517 8.633517       7.122018 11.70205       4.672071 23.63686 8.972660 28.12893 6.874891 -4.492069      11.30366 
1 1 1 5   42 3  o 14.76666 6.473771 0.3949217      4.458720 0.000000       0.000000 0.3949217      4.458720 ?        ?        14.76666 6.473771 0.000000       6.473771 
1 1 1 5   42 4  o 31.36708 5.926605 13.90801       4.364219 10.03957       7.519596 15.87292       5.359169 24.73780 9.256774 32.76210 6.929346 -8.024307      11.56303 
1 1 1 5   42 5  o 32.92467 4.753056 14.60664       3.703288 19.03245       5.423325 10.74012       5.069083 36.40605 6.343456 26.31672 7.525847 10.08933       9.842652 
1 1 1 5   42 6  o 18.84048 6.568811 4.992341       3.703197 8.006742       4.575045 -0.7353026     6.306419 22.88136 7.287047 16.07345 7.319341 6.807919       10.32830 
1 1 1 5   42 7  o 13.56642 5.661231 1.246555       3.115520 4.906998       4.456532 -2.252485      4.357172 18.91086 7.115757 12.66602 5.881145 6.244834       9.231569 
1 1 1 5   42 8  o 28.01007 5.361132 11.02697       3.526124 12.34477       5.165031 9.876661       4.825636 27.99924 7.442783 25.02298 7.397917 2.976263       10.49401 
1 1 1 5   42 9  o 11.30340 5.117575 -0.8824803     3.028738 1.579333       4.555641 -2.832536      4.054577 15.54221 6.679359 11.76499 5.530898 3.777215       8.672062 
1 1 1 5   42 10 f 10.61041 4.884865 -1.430603      2.913369 -2.054228      4.168804 -0.8352791     4.073113 12.35647 5.742602 13.01039 5.907963 -0.6539183     8.239023 
1 1 1 5   42 11 o 31.43774 6.110968 14.61782       4.512957 23.58649       8.896128 11.50994       5.236829 34.90463 9.966090 26.33783 7.685195 8.566803       12.58512 
1 1 1 5   42 12 o 10.65776 5.292919 -9.885227      5.292724 0.000000       0.000000 -9.885227      5.292724 ?        ?        10.65776 5.292919 0.000000       5.292919 
1 1 1 5   42 13 o 12.84365 5.968890 -1.699548      4.503461 -0.2412263     7.555292 -2.503228      5.608752 16.57385 7.712179 13.76767 6.482561 2.806179       10.07479 
1 1 1 5   42 14 o 25.52299 7.622381 11.26617       5.102391 13.70209       8.732373 10.00337       6.287354 24.89731 9.802380 23.06747 8.495697 1.829842       12.97164 
1 1 1 5   42 15 f 18.54519 7.241183 5.403828       4.731943 7.419498       7.835992 4.246902       5.936591 20.45535 8.774925 17.87812 7.652883 2.577238       11.64328 
1 1 1 5   42 16 o 11.35042 5.443421 -3.720592      4.334010 7.395458       7.745435 -8.787551      5.229309 20.17040 8.689278 10.69185 5.301422 9.478550       10.17883 
1 1 1 5   42 17 o 16.80370 6.586136 4.194595       3.926870 13.61578       8.348829 1.518278       4.449811 24.02919 9.545458 14.61727 6.435776 9.411922       11.51238 
1 1 1 5   43 0  o 16.81054 6.860209 3.010381       4.439974 0.000000       0.000000 3.010381       4.439974 ?        ?        16.81054 6.860209 0.000000       6.860209 
1 1 1 5   43 1  o 11.16209 5.226944 -2.481722      3.560805 -2.856800      5.771577 -2.251217      4.524540 14.20263 6.651992 12.86619 5.980550 1.336440       8.945165 
1 1 1 5   43 2  o 8.704009 4.244180 -4.612363      2.924028 -7.336614      3.967843 -1.374568      4.325693 9.563131 4.719080 13.09809 6.001362 -3.534955      7.634531 
1 1 1 5   43 3  o 21.57415 6.105117 6.892645       3.353344 6.364454       4.883280 7.363975       4.612946 20.49112 7.497094 21.71919 7.339478 -1.228069      10.49163 
1 1 1 5   43 4  o 12.56667 5.398623 0.6015382      2.974032 -0.9359508     4.494235 1.799331       3.966804 13.57267 6.179904 15.07795 6.346241 -1.505285      8.858103 
1 1 1 5   43 5  o 29.00444 5.027866 11.72477       3.425002 15.33607       5.019412 8.578354       4.685207 31.82166 6.685712 23.13597 7.374946 8.685696       9.954324 
1 1 1 5   43 6  o 18.20380 6.116067 4.828591       3.203362 5.649471       4.477890 3.968171       4.584467 19.42377 7.166922 17.62470 7.049484 1.799063       10.05286 
1 1 1 5   43 7  o 16.83645 6.051966 3.958898       3.163532 6.383165       4.484112 1.556569       4.463778 20.20948 7.212168 15.23775 6.580591 4.971725       9.763173 
1 1 1 5   43 8  o 16.63104 6.086039 3.843555       3.218315 9.426544       4.841707 -0.5758553     4.307718 23.80474 7.485842 13.38454 6.077020 10.42020       9.641992 
1 1 1 5   43 9  o 14.48015 5.994135 2.001840       3.452931 6.954180       4.542838 -4.773592      5.313620 20.69157 7.271045 12.43401 5.979735 8.257563       9.414103 
1 1 1 5   43 10 o 17.87565 6.342140 4.781152       3.462771 3.525095       4.466669 6.673168       5.482032 16.78469 6.868912 20.15437 7.815232 -3.369678      10.40480 
1 1 1 5   43 11 o 24.03160 6.641068 9.255106       4.018493 9.409420       7.842540 9.200167       4.679474 22.07731 9.075677 23.26971 7.364872 -1.192398      11.68800 
1 1 1 5   43 12 o 16.05230 6.486218 3.286088       3.923493 14.24833       8.219276 0.5100925E-01  4.465051 25.43985 9.643256 13.77953 6.228564 11.66032       11.47987 
1 1 1 5   43 13 o 13.02910 5.838972 0.1665334      3.829645 -2.988736      7.533556 1.266026       4.447110 15.08386 7.218621 14.56062 6.421413 0.5232420      9.661420 
1 1 1 5   43 14 o 14.24252 6.175920 1.535551       3.963916 -3.876559      8.191430 3.190418       4.529581 15.16696 7.326580 16.14392 6.787402 -0.9769659     9.987371 
1 1 1 5   44 0  o 15.17111 6.070827 2.602140       3.401490 -1.973609      4.935712 6.741110       4.694235 13.35643 6.221220 20.53617 7.373325 -7.179749      9.647254 
1 1 1 5   44 1  o 21.45507 6.489839 7.149735       3.681443 6.268121       5.159981 8.063764       5.253984 19.97261 7.624065 21.91683 7.808377 -1.944225      10.91316 
1 1 1 5   44 2  o 18.85931 6.257705 5.366911       3.355140 11.98755       5.271652 0.8591614      4.349876 26.67343 7.689515 14.47080 6.367493 12.20263       9.983666 
1 1 1 5   44 3  o 22.18836 6.628005 7.759992       3.857627 -2.311166      7.012342 12.13049       4.619437 15.34280 7.231677 27.65771 6.881751 -12.31491      9.982767 
1 1 1 5   44 4  o 19.42665 6.685677 5.865274       3.830705 5.530956       7.309971 5.991840       4.497744 19.67959 8.459224 19.52580 7.186573 0.1537895      11.09979 
1 1 1 5   44 5  o 24.70169 5.977371 9.234752       3.558798 5.757261       5.101916 12.53024       4.966612 19.25941 7.519260 27.58978 7.281959 -8.330376      10.46739 
1 1 1 5   44 6  o 21.67806 6.619983 7.493245       3.818235 6.034598       5.215275 9.178285       5.605409 19.48608 7.603899 22.70930 8.067937 -3.223213      11.08652 
1 1 1 5   44 7  o 12.48262 5.713050 -0.8874659     3.905642 -0.8982111     4.573698 -0.8585309     7.505377 13.35904 6.139416 16.15082 7.571240 -2.791780      9.747621 
1 1 1 5   44 8  f 14.03245 5.811901 1.916960       3.248555 -2.080911      4.718808 5.518619       4.478877 12.80893 6.004227 18.71996 7.113307 -5.911035      9.308592 
1 1 1 5   44 9  o 17.94046 6.233042 4.950825       3.332767 6.139637       4.981103 3.987276       4.484417 19.31730 7.460720 17.03016 6.915074 2.287146       10.17254 
1 1 1 5   44 10 o 13.58584 5.995756 0.7784388      3.883561 -2.428415      7.114522 2.139541       4.635019 14.97433 7.124059 15.41793 6.681979 -0.4435968     9.767346 
1 1 1 5   45 0  o 19.66827 6.281919 6.046756       3.398029 4.581245       4.970433 7.332734       4.656037 17.91581 7.278144 20.87587 7.358978 -2.960060      10.35017 
1 1 1 5   45 1  o 19.58380 6.266993 5.995205       3.380656 6.764113       5.046453 5.369203       4.553411 20.10290 7.570405 18.59332 7.145756 1.509579       10.41023 
1 1 1 5   45 2  o 11.69675 5.411458 -1.413913      3.639068 -2.676761      4.694374 0.4877299      5.760583 12.46795 5.888875 15.36936 6.997442 -2.901417      9.145658 
1 1 1 5   45 3  o 17.27446 6.617722 4.368037       3.896836 8.212037       5.079585 -1.130059      6.074948 21.64876 7.681304 14.76132 6.884384 6.887439       10.31490 
1 1 1 5   45 4  o 47.07595 4.218253 30.19121       4.787898 37.37934       7.028254 23.96659       6.540270 50.07763 5.870594 38.24766 7.282972 11.82997       9.354440 
1 1 1 6   0  0  o 167.6356 4.163915 343.1127       16.98628 343.1127       16.98628 343.1127       16.98628 167.6356 4.163915 167.6356 4.163915 0.000000       0.000000 
1 1 1 6   0  1  o 106.2777 2.719585 137.9064       7.032952 137.9064       7.032952 137.9064       7.032952 106.2777 2.719585 106.2777 2.719585 0.000000       0.000000 
1 1 1 6   0  2  o 175.8631 3.533517 377.3623       15.12942 377.3623       15.12942 377.3623       15.12942 175.8631 3.533517 175.8631 3.533517 0.000000       0.000000 
1 1 1 6   0  3  o 194.8136 3.789122 463.0577       17.97311 463.0577       17.97311 463.0577       17.97311 194.8136 3.789122 194.8136 3.789122 0.000000       0.000000 
1 1 1 6   0  4  o 108.1812 3.437096 143.0558       9.040337 143.0558       9.040337 143.0558       9.040337 108.1812 3.437096 108.1812 3.437096 0.000000       0.000000 
1 1 1 6   0  5  o 231.6132 5.302298 654.9775       29.89161 654.9775       29.89161 654.9775       29.89161 231.6132 5.302298 231.6132 5.302298 0.000000       0.000000 
1 1 1 6   0  6  o 236.1363 5.389872 680.8112       30.97891 680.8112       30.97891 680.8112       30.97891 236.1363 5.389872 236.1363 5.389872 0.000000       0.000000 
1 1 1 6   0  7  f 464.4912 9.658276 2636.293       109.2168 2636.293       109.2168 2636.293       109.2168 464.4912 9.658276 464.4912 9.658276 0.000000       0.000000 
1 1 1 6   0  8  o 34.36174 4.443794 15.09634       3.549906 15.09634       3.549906 15.09634       3.549906 34.36174 4.443794 34.36174 4.443794 0.000000       0.000000 
1 1 1 6   0  9  o 448.8428 13.28258 2466.639       144.9943 2466.639       144.9943 2466.639       144.9943 448.8428 13.28258 448.8428 13.28258 0.000000       0.000000 
1 1 1 6   0  10 o 27.57055 8.465286 11.54223       4.972016 11.54223       4.972016 11.54223       4.972016 27.57055 8.465286 27.57055 8.465286 0.000000       0.000000 
1 1 1 6   0  11 o 572.1848 11.77189 3999.388       163.9848 3999.388       163.9848 3999.388       163.9848 572.1848 11.77189 572.1848 11.77189 0.000000       0.000000 
1 1 1 6   0  12 o 761.2967 15.48929 7085.050       287.0885 7085.050       287.0885 7085.050       287.0885 761.2967 15.48929 761.2967 15.48929 0.000000       0.000000 
1 1 1 6   0  13 o 346.7412 7.479945 1467.664       63.13694 1467.664       63.13694 1467.664       63.13694 346.7412 7.479945 346.7412 7.479945 0.000000       0.000000 
1 1 1 6   0  14 o 603.6353 12.40052 4451.344       182.2372 4451.344       182.2372 4451.344       182.2372 603.6353 12.40052 603.6353 12.40052 0.000000       0.000000 
1 1 1 6   0  15 o 197.3453 4.945067 475.5294       23.74753 475.5294       23.74753 475.5294       23.74753 197.3453 4.945067 197.3453 4.945067 0.000000       0.000000 
1 1 1 6   0  16 o 158.1562 6.320727 306.3598       24.27210 306.3598       24.27210 306.3598       24.27210 158.1562 6.320727 158.1562 6.320727 0.000000       0.000000 
1 1 1 6   0  17 o 415.3115 8.806845 2106.394       89.04087 2106.394       89.04087 2106.394       89.04087 415.3115 8.806845 415.3115 8.806845 0.000000       0.000000 
1 1 1 6   0  18 o 55.97079 4.965700 39.07690       6.644687 39.07690       6.644687 39.07690       6.644687 55.97079 4.965700 55.97079 4.965700 0.000000       0.000000 
1 1 1 6   0  19 o 442.3589 9.341532 2391.006       100.5985 2391.006       100.5985 2391.006       100.5985 442.3589 9.341532 442.3589 9.341532 0.000000       0.000000 
1 1 1 6   0  20 o 176.3101 4.786827 379.7825       20.53226 379.7825       20.53226 379.7825       20.53226 176.3101 4.786827 176.3101 4.786827 0.000000       0.000000 
1 1 1 6   0  21 o 54.13222 5.223117 36.71727       6.733097 36.71727       6.733097 36.71727       6.733097 54.13222 5.223117 54.13222 5.223117 0.000000       0.000000 
1 1 1 6   0  22 o 23.42019 9.828851 9.458301       5.634229 9.458301       5.634229 9.458301       5.634229 23.42019 9.828851 23.42019 9.828851 0.000000       0.000000 
1 1 1 6   0  23 o 349.3411 7.666403 1493.109       65.19360 1493.109       65.19360 1493.109       65.19360 349.3411 7.666403 349.3411 7.666403 0.000000       0.000000 
1 1 1 6   0  24 o 102.0015 5.867731 128.2683       14.47386 128.2683       14.47386 128.2683       14.47386 102.0015 5.867731 102.0015 5.867731 0.000000       0.000000 
1 1 1 6   0  25 f 63.16126 4.780570 49.51089       7.258809 49.51089       7.258809 49.51089       7.258809 63.16126 4.780570 63.16126 4.780570 0.000000       0.000000 
1 1 1 6   0  26 o 42.70536 6.390475 23.72465       6.211878 23.72465       6.211878 23.72465       6.211878 42.70536 6.390475 42.70536 6.390475 0.000000       0.000000 
1 1 1 6   0  27 o 191.5197 5.139341 448.9186       23.94691 448.9186       23.94691 448.9186       23.94691 191.5197 5.139341 191.5197 5.139341 0.000000       0.000000 
1 1 1 6   0  28 o 108.9805 4.538478 145.7624       12.00536 145.7624       12.00536 145.7624       12.00536 108.9805 4.538478 108.9805 4.538478 0.000000       0.000000 
1 1 1 6   0  29 o 73.19691 7.189365 67.52330       12.51991 67.52330       12.51991 67.52330       12.51991 73.19691 7.189365 73.19691 7.189365 0.000000       0.000000 
1 1 1 6   0  30 o 43.00726 6.790395 24.27328       6.586586 24.27328       6.586586 24.27328       6.586586 43.00726 6.790395 43.00726 6.790395 0.000000       0.000000 
1 1 1 6   0  31 o 16.73639 9.503910 4.537436       6.010910 4.537436       6.010910 4.537436       6.010910 16.73639 9.503910 16.73639 9.503910 0.000000       0.000000 
1 1 1 6   0  32 o 99.74039 4.645025 122.4383       11.23406 122.4383       11.23406 122.4383       11.23406 99.74039 4.645025 99.74039 4.645025 0.000000       0.000000 
1 1 1 6   0  33 o 35.42643 8.971288 18.11751       6.696577 18.11751       6.696577 18.11751       6.696577 35.42643 8.971288 35.42643 8.971288 0.000000       0.000000 
1 1 1 6   0  34 o 43.91329 7.574486 25.74765       7.382953 25.74765       7.382953 25.74765       7.382953 43.91329 7.574486 43.91329 7.574486 0.000000       0.000000 
1 1 1 6   0  35 o 67.22872 7.918466 58.21412       12.50103 58.21412       12.50103 58.21412       12.50103 67.22872 7.918466 67.22872 7.918466 0.000000       0.000000 
1 1 1 6   0  36 o 109.2580 4.721907 147.3690       12.51852 147.3690       12.51852 147.3690       12.51852 109.2580 4.721907 109.2580 4.721907 0.000000       0.000000 
1 1 1 6   0  37 o 37.98344 8.526239 20.44568       6.889075 20.44568       6.889075 20.44568       6.889075 37.98344 8.526239 37.98344 8.526239 0.000000       0.000000 
1 1 1 6   0  38 o 11.01420 7.470170 -2.772229      5.999299 -2.772229      5.999299 -2.772229      5.999299 11.01420 7.470170 11.01420 7.470170 0.000000       0.000000 
1 1 1 6   0  39 o 85.62057 5.076689 92.00464       10.50636 92.00464       10.50636 92.00464       10.50636 85.62057 5.076689 85.62057 5.076689 0.000000       0.000000 
1 1 1 6   0  40 o 12.89384 8.630077 -1.621983      7.519917 -1.621983      7.519917 -1.621983      7.519917 12.89384 8.630077 12.89384 8.630077 0.000000       0.000000 
1 1 1 6   0  41 o 53.41468 5.944613 37.61195       7.492808 37.61195       7.492808 37.61195       7.492808 53.41468 5.944613 53.41468 5.944613 0.000000       0.000000 
1 1 1 6   0  42 o 28.30310 10.18801 14.47477       6.433035 14.47477       6.433035 14.47477       6.433035 28.30310 10.18801 28.30310 10.18801 0.000000       0.000000 
1 1 1 6   0  43 o 11.11048 7.372896 -0.1093824     5.290147 -0.1093824     5.290147 -0.1093824     5.290147 11.11048 7.372896 11.11048 7.372896 0.000000       0.000000 
1 1 1 6   0  44 o 12.31022 7.957133 1.800216       5.589232 1.800216       5.589232 1.800216       5.589232 12.31022 7.957133 12.31022 7.957133 0.000000       0.000000 
1 1 1 6   0  45 o 37.88038 11.09919 27.56446       8.899298 27.56446       8.899298 27.56446       8.899298 37.88038 11.09919 37.88038 11.09919 0.000000       0.000000 
1 1 1 6   0  46 o 14.35231 8.449439 5.254782       5.022796 5.254782       5.022796 5.254782       5.022796 14.35231 8.449439 14.35231 8.449439 0.000000       0.000000 
1 1 1 6   0  47 o 12.54896 7.878564 3.897663       5.021644 3.897663       5.021644 3.897663       5.021644 12.54896 7.878564 12.54896 7.878564 0.000000       0.000000 
1 1 1 6   0  48 f 6.675850 4.882971 -9.074319      4.954835 -9.074319      4.954835 -9.074319      4.954835 6.675850 4.882971 6.675850 4.882971 0.000000       0.000000 
1 1 1 6   1  0  o 420.0937 6.174207 2152.412       63.20675 2199.218       90.65184 2108.130       88.17527 424.4250 8.764750 415.5479 8.707422 8.877106       12.35476 
1 1 1 6   1  1  o 94.41724 2.264123 108.6348       5.209397 105.6081       7.293051 111.7878       7.443658 93.03033 3.221845 95.71774 3.195709 -2.687401      4.537933 
1 1 1 6   1  2  o 301.4830 3.480311 1107.858       25.56919 1127.229       34.16306 1083.186       38.55450 304.0670 4.610534 298.0377 5.308450 6.029327       7.031121 
1 1 1 6   1  3  o 107.1272 2.381691 139.8568       6.217576 128.2859       8.420503 153.7284       9.219704 102.5352 3.374590 112.2534 3.374230 -9.718201      4.772136 
1 1 1 6   1  4  o 313.1645 3.890699 1195.554       29.69178 1200.232       42.06404 1190.909       41.91737 313.6977 5.502544 312.4769 5.504780 1.220795       7.783354 
1 1 1 6   1  5  o 559.3420 8.112362 3820.849       110.5760 3790.331       155.1693 3852.337       157.6156 556.4717 11.44265 560.9854 11.52953 -4.513672      16.24390 
1 1 1 6   1  6  o 277.7657 4.326082 940.6826       29.28259 942.4756       41.47960 938.9014       41.34440 277.9403 6.124165 277.4133 6.115801 0.5270386      8.654964 
1 1 1 6   1  7  o 142.7130 3.193462 248.2440       11.10609 247.7812       19.14649 248.4786       13.63422 142.4253 5.527021 142.7143 3.924090 -0.2890167     6.778381 
1 1 1 6   1  8  o 19.17744 4.776009 4.661435       2.223487 7.320602       3.898083 3.378980       2.707069 24.09490 6.493178 17.05804 5.619390 7.036854       8.587136 
1 1 1 6   1  9  o 383.5663 5.733989 1794.107       53.59613 1895.607       78.58061 1705.819       73.28855 394.0970 8.182314 373.8590 8.044374 20.23804       11.47441 
1 1 1 6   1  10 o 160.6653 3.010365 314.5827       11.78629 315.0820       16.68944 314.0858       16.64732 160.7205 4.264994 160.4662 4.260977 0.2543030      6.028773 
1 1 1 6   1  11 o 160.4725 3.499712 313.8387       13.68576 314.7189       16.75718 312.0755       23.71686 160.6311 4.284727 159.8677 6.098983 0.7633667      7.453621 
1 1 1 6   1  12 o 555.2087 9.328951 3761.532       126.2191 3769.148       219.0637 3757.748       154.4294 554.7027 16.22337 554.7234 11.42398 -0.2069092E-01 19.84200 
1 1 1 6   1  13 o 156.6732 3.034387 299.1320       11.58515 307.3775       16.58095 291.2673       16.19368 158.7476 4.290070 154.5278 4.304533 4.219788       6.077311 
1 1 1 6   1  14 o 520.0702 7.602973 3298.932       96.35661 3287.997       135.9775 3309.962       136.5620 518.9427 10.75255 520.6722 10.76290 -1.729492      15.21373 
1 1 1 6   1  15 o 91.51950 3.887533 102.2683       8.650346 107.8785       12.51127 97.13026       11.97333 93.90726 5.491173 89.08593 5.542764 4.821327       7.802258 
1 1 1 6   1  16 o 355.4081 5.418530 1540.032       46.92939 1577.097       67.29844 1504.949       65.47545 359.5470 7.680920 351.2283 7.649849 8.318695       10.84051 
1 1 1 6   1  17 f 621.9754 10.42846 4725.893       158.0627 4728.086       273.8397 4724.796       193.5627 620.2296 18.13737 621.4976 12.78045 -1.268005      22.18793 
1 1 1 6   1  18 o 425.9711 6.365333 2213.407       66.07503 2178.583       92.44343 2249.781       94.47820 422.3687 8.981487 429.2093 9.032885 -6.840576      12.73814 
1 1 1 6   1  19 o 234.0697 3.965253 667.9302       22.61789 648.1151       31.42141 689.2379       32.58328 230.5099 5.593711 237.7089 5.624880 -7.199020      7.932773 
1 1 1 6   1  20 o 164.8912 3.279216 331.4410       13.17661 341.0096       18.84379 322.2860       18.43210 167.1513 4.630641 162.4923 4.659666 4.658997       6.569272 
1 1 1 6   1  21 o 99.03572 2.994800 119.6762       7.219325 123.9986       10.31332 115.5234       10.10908 100.7415 4.210291 97.22714 4.277125 3.514397       6.001696 
1 1 1 6   1  22 f 223.6404 3.872618 610.0678       21.10528 595.8051       29.42377 625.1825       30.28981 220.8918 5.466162 226.2697 5.493311 -5.377823      7.749541 
1 1 1 6   1  23 o 103.6093 3.438906 131.0847       8.670681 124.8940       14.59620 134.4606       10.77856 100.9047 5.962557 104.8789 4.225973 -3.974220      7.308279 
1 1 1 6   1  24 o 77.70551 3.161673 73.77659       5.974437 74.52472       8.400772 73.01099       8.498332 77.99467 4.438278 77.18627 4.538141 0.8083954      6.347679 
1 1 1 6   1  25 o 37.90608 5.268285 17.90607       4.735123 14.54268       5.742569 25.05023       8.369386 33.79782 7.193385 44.48741 8.014803 -10.68959      10.76949 
1 1 1 6   1  26 f 114.1060 3.073644 158.9884       8.538911 152.4674       12.01198 165.6500       12.14074 111.6083 4.425309 116.3560 4.289080 -4.747704      6.162756 
1 1 1 6   1  27 o 100.7851 3.139245 124.0990       7.700653 127.7674       10.95601 120.5171       10.82589 102.1329 4.412418 99.17772 4.490984 2.955177       6.295901 
1 1 1 6   1  28 o 127.2544 3.678054 198.0163       11.39387 192.9614       13.73485 209.1717       20.40380 125.5071 4.498030 130.3204 6.444836 -4.813263      7.859273 
1 1 1 6   1  29 o 155.9348 3.367923 297.0532       12.79798 307.0980       18.28104 287.3986       17.92244 158.2749 4.745079 153.0968 4.809880 5.178101       6.756532 
1 1 1 6   1  30 o 114.0661 3.726672 159.2791       10.34501 167.6387       18.52713 155.4921       12.47000 116.4627 6.554525 112.5698 4.555188 3.892937       7.981950 
1 1 1 6   1  31 o 144.0751 3.335242 253.7597       11.70988 251.0196       16.49605 256.5428       16.62524 142.9771 4.741092 144.5467 4.726153 -1.569580      6.694362 
1 1 1 6   1  32 o 84.34403 3.404940 87.16032       6.984034 84.39433       9.768209 90.05296       9.989335 82.75358 4.865332 85.50188 4.813736 -2.748299      6.844232 
1 1 1 6   1  33 o 87.82943 3.378343 94.55048       7.217210 93.53977       10.01972 95.64032       10.40451 87.10926 4.737978 88.05662 4.867618 -0.9473572     6.792800 
1 1 1 6   1  34 o 33.10022 6.169987 13.99964       4.793763 8.736761       6.831965 19.10361       6.728038 26.86431 8.930103 38.49833 7.440766 -11.63402      11.62376 
1 1 1 6   1  35 o 31.96118 7.078889 13.26866       5.368016 6.608151       8.897061 17.08110       6.731235 26.24244 10.01271 36.17019 7.861651 -9.927753      12.73028 
1 1 1 6   1  36 o 80.53117 4.022864 80.09360       7.869700 77.31845       9.460553 86.32760       14.17938 78.84898 4.948571 82.46597 7.125638 -3.616982      8.675429 
1 1 1 6   1  37 o 36.08307 5.565208 16.64564       4.736352 14.03232       6.524013 19.55798       6.887158 32.36573 8.248718 38.49464 7.611630 -6.128910      11.22400 
1 1 1 6   1  38 o 15.47650 6.587588 0.3838797      4.354812 4.001211       6.136240 -3.286744      6.181275 21.00597 8.233064 15.80310 7.215475 5.202867       10.94744 
1 1 1 6   1  39 o 14.23480 6.433137 -1.959883      4.760521 0.2977721      5.647373 -7.502982      8.848995 17.15965 7.406147 17.24567 8.127079 -0.8601189E-01 10.99547 
1 1 1 6   1  40 o 15.53601 6.746091 0.1167483      4.742981 0.4996338      8.501771 -0.5626517E-01 5.714983 20.18991 8.892318 16.74840 7.336274 3.441517       11.52798 
1 1 1 6   1  41 o 25.55999 6.742495 9.268118       4.259504 8.438803       6.193932 10.01221       5.867047 24.22383 8.491883 25.99927 8.248827 -1.775440      11.83872 
1 1 1 6   1  42 o 17.74459 6.702326 3.911450       3.962149 5.747232       5.389156 1.751794       5.845241 20.53997 7.803246 17.40470 7.523415 3.135277       10.83939 
1 1 1 6   1  43 o 12.08668 5.544339 -1.378481      3.706329 -0.6302727     5.040810 -2.258986      5.468334 14.45005 6.565914 14.03532 6.541069 0.4147310      9.268053 
1 1 1 6   1  44 o 49.10311 4.481457 33.23283       5.303421 37.59389       7.536622 28.95512       7.464242 49.45847 6.403311 41.64896 7.635671 7.809513       9.965233 
1 1 1 6   1  45 o 21.47054 7.166494 8.281265       4.399044 4.654123       7.024150 10.62197       5.642672 17.82414 7.953454 23.07517 8.103960 -5.251034      11.35480 
1 1 1 6   1  46 o 13.08784 5.844846 1.109297       3.801617 -1.975476      4.653369 7.299910       6.592083 12.06621 5.746452 18.41052 7.973877 -6.344306      9.828755 
1 1 1 6   1  47 o 16.74270 6.822823 5.748609       4.384172 6.817609       8.546683 5.366867       5.107330 16.67297 7.896094 16.22210 7.022369 0.4508762      10.56702 
1 1 1 6   1  48 o 10.71997 5.040944 -0.5772207     3.371942 -1.044729      4.682061 -0.7345702E-01 4.860218 11.69500 5.621446 12.26670 5.850544 -0.5717077     8.113540 
1 1 1 6   2  0  o 81.89205 3.118027 81.85235       6.211031 83.34695       9.313520 80.65527       8.335141 82.55251 4.648422 81.23139 4.225211 1.321114       6.281738 
1 1 1 6   2  1  o 299.6698 4.576240 1094.832       33.41858 1052.360       46.07156 1141.993       48.54761 293.7153 6.436803 305.9640 6.511207 -12.24866      9.155777 
1 1 1 6   2  2  o 375.8365 5.594190 1722.718       51.23566 1655.986       57.54338 1978.021       112.5534 368.4311 6.409188 401.9496 11.50265 -33.51849      13.16771 
1 1 1 6   2  3  o 267.6040 4.162365 873.0396       27.14370 883.3322       38.46401 862.8290       38.31042 269.1028 5.865435 265.9591 5.911067 3.143738       8.327307 
1 1 1 6   2  4  o 476.2987 6.952447 2768.668       80.69623 2781.725       114.2914 2755.689       113.9527 477.0333 9.831703 474.7930 9.848824 2.240295       13.91624 
1 1 1 6   2  5  o 108.3426 2.781984 143.1556       7.338890 125.7787       11.99589 153.5497       9.277696 101.4430 4.866792 112.1850 3.397583 -10.74194      5.935422 
1 1 1 6   2  6  f 252.0872 4.609398 774.8594       28.31595 777.8748       48.97871 773.3456       34.70320 252.2696 7.977238 251.7947 5.655706 0.4748993      9.778719 
1 1 1 6   2  7  o 267.4422 4.204956 871.9924       27.40486 870.0387       38.69452 873.9586       38.81842 267.0667 5.945571 267.6674 5.951224 -0.6007080     8.412306 
1 1 1 6   2  8  o 697.3503 10.03685 5942.554       170.5629 6086.060       245.1919 5808.001       237.4204 704.6717 14.27852 688.4216 14.15231 16.25006       20.10383 
1 1 1 6   2  9  f 537.1513 7.817860 3520.886       102.3342 3624.511       147.6097 3424.990       141.9981 544.5800 11.12288 529.3956 11.00693 15.18445       15.64835 
1 1 1 6   2  10 o 264.7761 4.199664 854.5233       27.09751 868.7836       38.67653 840.7745       37.97639 266.9267 5.945923 262.5891 5.934730 4.337677       8.400893 
1 1 1 6   2  11 o 465.7094 7.921040 2645.667       89.89455 2904.417       165.8627 2538.048       106.9676 487.1615 13.98587 456.0144 9.625820 31.14709       16.97825 
1 1 1 6   2  12 o 259.4954 4.810053 820.7971       30.41695 812.2052       36.95512 838.8432       53.55775 258.1088 5.875377 262.0934 8.396358 -3.984619      10.24787 
1 1 1 6   2  13 o 84.39446 3.075477 86.91193       6.314452 87.08973       7.640993 86.52898       11.21381 84.45174 3.721972 84.06973 5.503924 0.3820114      6.644265 
1 1 1 6   2  14 o 465.7148 7.923223 2645.637       89.92034 2633.611       109.8366 2670.080       156.5850 464.5257 9.702892 467.1348 13.77039 -2.609070      16.84547 
1 1 1 6   2  15 o 220.5134 3.738716 592.6434       20.09063 581.5591       28.08660 604.2575       28.74990 218.4122 5.276988 222.6333 5.299198 -4.221054      7.478509 
1 1 1 6   2  16 o 207.8496 3.621681 526.5334       18.34406 537.9254       26.08344 515.3845       25.80365 210.0572 5.095550 205.5432 5.155667 4.514008       7.248830 
1 1 1 6   2  17 o 412.0273 6.171568 2070.427       61.96659 2077.225       87.71744 2063.654       87.55079 412.5128 8.725945 411.1619 8.737981 1.350830       12.34886 
1 1 1 6   2  18 o 504.0839 8.575715 3102.583       105.3439 3156.429       184.7538 3076.644       128.2310 507.1366 14.96606 501.7116 10.48825 5.425018       18.27530 
1 1 1 6   2  19 o 209.1022 3.682835 533.0032       18.76623 534.1326       26.49237 531.8658       26.58681 209.2745 5.194795 208.7633 5.230196 0.5111847      7.371624 
1 1 1 6   2  20 o 280.4670 4.512979 959.3272       30.84474 992.7171       44.49200 928.4297       42.79933 285.1743 6.402292 275.7886 6.368315 9.385651       9.030215 
1 1 1 6   2  21 o 448.7973 6.696273 2460.569       73.23514 2466.084       103.6901 2455.079       103.4505 448.7148 9.482677 447.7126 9.481942 1.002136       13.41001 
1 1 1 6   2  22 o 80.44349 3.541245 79.07281       6.924962 56.90549       11.19302 92.81982       8.814438 67.88017 6.860633 87.12583 4.163612 -19.24567      8.025208 
1 1 1 6   2  23 o 155.7058 3.240460 295.6934       12.29554 288.0384       17.18075 303.7303       17.60401 153.5326 4.597218 157.6639 4.586751 -4.131287      6.494051 
1 1 1 6   2  24 o 235.7685 4.034939 678.5650       23.18243 656.0781       32.14606 702.9327       33.46342 231.6140 5.695435 239.7368 5.727953 -8.122787      8.077588 
1 1 1 6   2  25 o 99.44340 3.479618 120.8370       8.419259 117.0167       10.15401 129.2416       15.06082 97.78521 4.271471 102.5601 6.052982 -4.774918      7.408377 
1 1 1 6   2  26 o 59.07940 3.552010 42.76421       5.090212 44.28249       7.209215 41.25481       7.188127 59.96694 4.978173 57.84333 5.153389 2.123604       7.165168 
1 1 1 6   2  27 o 134.5142 3.693580 221.1644       12.09597 217.0830       14.68740 229.7682       21.32469 133.1597 4.532834 136.6771 6.420464 -3.517426      7.859322 
1 1 1 6   2  28 o 133.6787 3.197563 218.1909       10.41640 216.9854       14.60592 219.4387       14.85936 133.0964 4.509769 133.8393 4.562636 -0.7428741     6.415268 
1 1 1 6   2  29 o 73.25240 3.300636 65.67881       5.876768 69.17063       8.286242 62.14494       8.335990 75.02830 4.553505 71.06048 4.842795 3.967819       6.647336 
1 1 1 6   2  30 o 93.92493 3.803852 108.0755       8.688429 124.3768       16.02018 101.2826       10.34143 100.2505 6.594209 90.79027 4.690076 9.460281       8.091996 
1 1 1 6   2  31 o 73.01369 3.463568 65.33406       6.145033 64.55242       8.447549 66.21252       8.955452 72.37858 4.816849 73.26780 5.046604 -0.8892212     6.976407 
1 1 1 6   2  32 o 197.1910 3.757249 476.0724       18.05482 467.7046       25.20017 484.8979       25.88016 194.9135 5.310438 198.4486 5.356487 -3.535141      7.542725 
1 1 1 6   2  33 o 26.75602 6.950559 9.217491       4.572134 9.451121       6.286475 8.955132       6.661784 27.46224 8.513942 27.07441 8.809155 0.3878269      12.25106 
1 1 1 6   2  34 o 88.38064 3.893262 96.02378       8.364496 106.6368       14.33799 90.54836       10.29858 92.46947 6.402412 85.58141 4.959364 6.888054       8.098529 
1 1 1 6   2  35 o 56.47670 4.076024 39.42503       5.571993 54.10455       7.994191 25.55538       7.770543 65.99053 5.008553 44.57187 7.414458 21.41866       8.947614 
1 1 1 6   2  36 o 65.59058 3.753689 53.10173       5.974734 59.64424       8.558481 46.88202       8.344674 69.15848 5.114453 61.10439 5.668664 8.054089       7.634880 
1 1 1 6   2  37 o 118.8115 3.826448 174.4359       11.06429 171.9153       13.41414 179.8005       19.56929 117.5363 4.692762 118.8712 6.783736 -1.334946      8.248702 
1 1 1 6   2  38 o 78.34198 3.564992 76.06692       6.788121 80.99109       9.396347 70.69179       9.817180 80.28725 4.824862 74.68777 5.430987 5.599472       7.264635 
1 1 1 6   2  39 o 51.99398 4.432341 34.17233       5.562444 33.79661       7.621054 34.60067       8.137261 50.80467 6.289893 51.19205 6.682235 -0.3873787     9.176874 
1 1 1 6   2  40 o 77.06789 3.513602 74.37654       6.581398 71.68191       9.182667 77.22286       9.437573 74.56889 5.083702 77.45415 5.027271 -2.885254      7.149649 
1 1 1 6   2  41 o 20.16440 7.963739 4.572546       5.779789 18.03886       9.004798 -4.862246      7.537301 33.19956 10.17165 16.08716 7.555959 17.11240       12.67103 
1 1 1 6   2  42 o 34.44029 5.490909 16.31709       4.453743 19.86737       6.031072 12.05886       6.605083 36.86630 6.968446 27.21066 8.764976 9.655642       11.19750 
1 1 1 6   2  43 o 36.78138 5.174561 18.84575       4.510020 23.49320       6.245649 13.78194       6.519418 39.54486 6.721455 28.03084 8.666891 11.51402       10.96781 
1 1 1 6   2  44 f 23.04740 7.146569 8.964569       4.429126 -1.156725      6.440421 18.04664       6.100827 15.05714 7.044000 32.31646 7.830128 -17.25933      10.53228 
1 1 1 6   2  45 o 20.39676 6.566604 7.068773       3.707639 7.797141       5.039020 6.208966       5.474837 20.38954 7.587973 18.70041 7.622978 1.689133       10.75580 
1 1 1 6   2  46 o 13.61953 5.987679 1.746930       3.838681 -1.201459      4.944205 6.221418       6.090821 12.72136 6.019027 17.70356 7.666206 -4.982207      9.746764 
1 1 1 6   2  47 o 11.31614 5.280316 -0.4479129     3.581180 0.8673697      5.044070 -1.784780      5.085289 13.29714 6.224902 12.07672 5.818548 1.220420       8.520851 
1 1 1 6   2  48 o 12.26425 5.788353 0.3977977      4.519953 2.271990       5.215284 -5.258649      9.060305 13.58829 6.350929 12.85033 6.461138 0.7379570      9.059834 
1 1 1 6   3  0  o 234.1959 3.346890 668.5027       19.10103 663.6081       30.00261 671.8388       24.76933 233.2816 5.277675 234.7542 4.329768 -1.472672      6.826474 
1 1 1 6   3  1  o 307.2664 4.199560 1150.975       31.44524 1171.370       40.96307 1121.713       49.06640 309.9221 5.423803 303.2150 6.640450 6.707092       8.573984 
1 1 1 6   3  2  f 126.3134 2.938957 194.4574       9.046462 191.0737       10.82983 202.2695       16.45554 125.1513 3.554598 128.6796 5.258748 -3.528366      6.347408 
1 1 1 6   3  3  o 434.3136 5.210574 2300.390       55.14740 2331.777       78.57827 2269.926       77.41515 437.0701 7.377602 431.2355 7.366740 5.834595       10.42583 
1 1 1 6   3  4  o 371.3499 4.958138 1681.668       44.86813 1679.429       57.70770 1685.092       71.34673 370.9993 6.382996 371.4877 7.881221 -0.4883728     10.14181 
1 1 1 6   3  5  o 494.0963 7.202665 2979.941       86.72431 2971.705       100.0939 3004.744       173.6920 493.2644 8.327063 494.6108 14.42595 -1.346436      16.65677 
1 1 1 6   3  6  o 370.2217 4.943233 1671.427       44.59736 1642.997       56.90536 1716.688       71.80088 366.9605 6.363525 374.9656 7.857822 -8.005127      10.11137 
1 1 1 6   3  7  o 110.3928 2.844819 148.6223       7.646616 156.3136       13.12800 144.6730       9.407111 113.1247 4.772896 108.8869 3.549974 4.237724       5.948349 
1 1 1 6   3  8  o 224.8643 3.691092 616.3239       20.22607 636.2590       29.07730 597.6359       28.15305 228.4293 5.223556 221.3877 5.218382 7.041611       7.383566 
1 1 1 6   3  9  o 222.8877 3.683401 605.5034       20.00650 605.3602       28.26638 605.6472       28.32064 222.8260 5.205568 222.8786 5.214332 -0.5256653E-01 7.367984 
1 1 1 6   3  10 o 398.8665 6.877778 1940.320       66.85161 1873.482       113.4998 1975.825       82.72367 391.3857 11.91406 402.4031 8.435918 -11.01743      14.59827 
1 1 1 6   3  11 o 246.8296 3.993619 742.5463       24.02149 784.7132       35.06001 705.2376       32.97849 253.7047 5.670841 240.5153 5.626678 13.18941       7.988614 
1 1 1 6   3  12 o 287.4176 5.184582 1006.996       36.31309 1008.629       44.61200 1003.789       62.51191 287.6178 6.365020 286.6925 8.958672 0.9252930      10.98960 
1 1 1 6   3  13 o 331.9713 7.185112 1343.962       58.12597 1343.962       58.12597 0.000000       0.000000 331.9713 7.185112 ?        ?        0.000000       7.185112 
1 1 1 6   3  14 o 276.9951 5.089725 935.3038       34.35599 931.1754       41.80718 943.8906       60.29318 276.3516 6.208015 277.9876 8.911856 -1.635986      10.86097 
1 1 1 6   3  15 o 337.6961 5.176916 1390.230       42.60231 1376.311       59.78502 1404.590       60.72349 335.9138 7.303456 339.3453 7.343089 -3.431519      10.35671 
1 1 1 6   3  16 f 65.52885 2.975473 52.43830       4.739036 47.63953       6.480402 57.95462       6.948024 62.36924 4.289915 68.82842 4.161898 -6.459179      5.977020 
1 1 1 6   3  17 o 419.2229 7.226507 2144.174       73.82604 2168.720       91.12286 2097.283       125.9445 421.4770 8.871914 413.8925 12.50125 7.584473       15.32945 
1 1 1 6   3  18 o 269.4054 4.359552 884.8318       28.62096 898.3433       40.74350 871.6693       40.21400 271.3791 6.160924 267.3192 6.173209 4.059906       8.721554 
1 1 1 6   3  19 o 400.8988 6.994104 1961.745       68.32867 1960.034       118.5583 1962.597       83.61138 399.8246 12.18241 400.8097 8.560342 -0.9850464     14.88928 
1 1 1 6   3  20 o 323.7241 5.051927 1278.413       39.85366 1240.910       55.22976 1319.156       57.56598 318.7552 7.110167 328.6427 7.187962 -9.887543      10.11045 
1 1 1 6   3  21 o 229.4801 4.518511 642.4317       25.26832 640.0659       43.14729 643.6666       31.17318 228.6556 7.754689 229.6276 5.570844 -0.9719696     9.548272 
1 1 1 6   3  22 o 141.4193 3.132807 243.8633       10.79638 247.4350       15.32369 240.3426       15.21368 142.3302 4.423417 140.2709 4.456379 2.059280       6.279007 
1 1 1 6   3  23 o 106.3456 3.006432 138.0282       7.783430 135.9599       10.81586 140.2498       11.20956 105.4598 4.217105 107.1061 4.303514 -1.646278      6.025298 
1 1 1 6   3  24 o 81.50839 3.082124 81.15475       6.110904 77.92964       8.423757 84.73737       8.878403 79.76744 4.350016 83.18420 4.395436 -3.416763      6.184052 
1 1 1 6   3  25 o 118.5825 3.070775 171.6727       8.866235 168.4599       12.25094 175.2063       12.84784 117.3565 4.290994 119.6733 4.413074 -2.316795      6.155311 
1 1 1 6   3  26 o 163.6174 4.732590 327.5997       18.84984 327.5997       18.84984 0.000000       0.000000 163.6174 4.732590 ?        ?        0.000000       4.732590 
1 1 1 6   3  27 o 224.4436 4.557074 616.0845       24.92467 605.0024       30.15683 639.9733       44.27636 222.1419 5.575224 227.7411 7.990386 -5.599182      9.743173 
1 1 1 6   3  28 f 51.90988 3.793421 33.10427       4.765502 34.64492       6.632368 31.45996       6.851865 52.92375 5.210072 50.33211 5.685760 2.591637       7.711855 
1 1 1 6   3  29 o 66.70975 3.427067 54.51530       5.552517 50.71661       7.473430 59.19585       8.295670 64.16432 4.814699 69.32946 4.942598 -5.165138      6.900044 
1 1 1 6   3  30 o 37.55638 4.967798 17.59363       4.435174 13.06456       6.040093 22.89285       6.533488 31.86323 7.834607 42.63848 6.492600 -10.77525      10.17521 
1 1 1 6   3  31 o 153.3822 3.980389 288.2185       14.86516 298.3484       26.58347 283.6099       17.93055 155.1645 7.048859 151.9505 4.848546 3.214005       8.555396 
1 1 1 6   3  32 o 36.89261 5.438232 17.10059       4.742681 9.572101       6.341464 26.65632       7.144430 27.67067 8.546456 45.99167 6.560316 -18.32100      10.77403 
1 1 1 6   3  33 o 34.24432 6.539231 14.99641       5.258008 12.60641       7.736473 17.04803       7.167925 31.38485 9.388933 36.21664 8.299835 -4.831787      12.53153 
1 1 1 6   3  34 o 141.7963 3.395059 246.3027       11.73136 268.3690       16.85210 225.5546       16.34100 147.5805 4.691818 135.1918 4.968570 12.38867       6.833728 
1 1 1 6   3  35 o 74.49843 3.583690 68.27440       6.486912 72.26074       9.089981 64.13741       9.260142 76.33363 4.912732 71.78317 5.331765 4.550453       7.250010 
1 1 1 6   3  36 o 84.01769 3.444849 86.87601       7.038094 94.65758       9.920147 78.98934       9.986923 87.34509 4.677680 79.60365 5.176359 7.741440       6.976774 
1 1 1 6   3  37 o 99.62925 3.830582 122.7428       9.282776 125.2961       11.24889 117.2925       16.43506 100.3324 4.613132 95.70229 7.097662 4.630150       8.465093 
1 1 1 6   3  38 o 58.56705 4.545279 43.08083       6.436346 42.81196       7.566436 43.78469       12.24241 58.02527 5.413509 56.59981 9.190972 1.425457       10.66677 
1 1 1 6   3  39 o 87.21130 3.415215 94.53708       7.244135 89.14371       9.762943 101.1441       10.80575 83.88349 4.796031 89.22819 4.989419 -5.344696      6.920709 
1 1 1 6   3  40 o 80.63036 3.940234 82.00153       7.718621 80.31243       9.358465 85.59504       13.65011 79.08295 4.879846 79.41814 7.128870 -0.3351898     8.639079 
1 1 1 6   3  41 o 40.81676 4.751569 21.82153       4.637935 23.78149       6.314953 19.52627       6.833788 41.48475 6.456625 36.44866 7.920624 5.036091       10.21882 
1 1 1 6   3  42 o 12.35246 5.597786 -1.137387      3.634041 -0.9480742     4.694399 -1.420489      5.740658 14.13031 6.386880 15.19949 6.945079 -1.069181      9.435378 
1 1 1 6   3  43 o 13.13934 5.823514 0.5879876E-01  3.701660 1.825461       5.052230 -1.988721      5.439017 16.12401 6.982140 14.09746 6.554324 2.026549       9.576505 
1 1 1 6   3  44 o 29.14088 6.090745 13.02576       4.185721 17.47801       5.905990 8.532528       5.933111 31.92576 7.684396 21.55659 8.188029 10.36916       11.22915 
1 1 1 6   3  45 o 14.18451 6.214520 1.619438       4.102812 -4.664821      6.345195 6.134608       5.378423 13.06749 6.344566 18.59326 7.564431 -5.525767      9.872899 
1 1 1 6   3  46 f 13.91967 5.963783 2.299557       3.611145 3.026154       5.175490 1.610226       5.041024 15.31042 6.829744 14.32561 6.531351 0.9848156      9.450076 
1 1 1 6   3  47 o 12.86725 6.079588 0.1306614      5.011423 0.1306614      5.011423 0.000000       0.000000 12.86725 6.079588 ?        ?        0.000000       6.079588 
1 1 1 6   3  48 o 8.080501 4.029984 -5.638093      3.203604 -2.978323      4.555075 -8.241411      4.506477 10.75234 5.254736 9.055445 4.553563 1.696898       6.953215 
1 1 1 6   4  0  o 230.6345 3.032740 648.3055       17.04494 679.1653       24.74961 620.4630       23.50862 236.0253 4.303022 225.5955 4.276226 10.42987       6.066474 
1 1 1 6   4  1  o 40.61135 3.122947 20.22061       3.066920 23.59877       3.773080 13.64211       5.265251 43.85597 3.561074 32.83182 6.804671 11.02415       7.680156 
1 1 1 6   4  2  o 178.4598 2.769480 388.1472       12.04411 411.9200       19.43927 373.3356       15.34406 183.8100 4.339851 175.0066 3.597906 8.803391       5.637308 
1 1 1 6   4  3  o 94.60209 2.090852 109.0617       4.820145 102.2992       7.298332 114.2934       6.419374 91.55376 3.276515 96.80123 2.724004 -5.247467      4.260956 
1 1 1 6   4  4  o 403.3003 5.971266 1984.265       58.68554 2053.093       69.10680 1806.273       111.1321 410.1490 6.914217 383.9031 11.89339 26.24591       13.75715 
1 1 1 6   4  5  o 291.2531 4.006107 1034.150       28.43343 1022.922       36.42513 1051.662       45.49117 289.6158 5.161105 293.5876 6.358480 -3.971771      8.189462 
1 1 1 6   4  6  o 248.5285 3.528803 752.8915       21.37173 756.3238       27.57334 747.7266       33.82378 249.0615 4.543041 247.5990 5.605794 1.462524       7.215549 
1 1 1 6   4  7  o 44.19878 2.425238 23.87847       2.602155 24.18871       3.669384 23.56461       3.690714 44.41705 3.416287 43.83125 3.483984 0.5858040      4.879464 
1 1 1 6   4  8  o 257.3917 4.694111 807.6784       29.44313 754.4304       48.49955 838.7565       37.05214 248.5002 8.019436 262.2583 5.797595 -13.75812      9.895628 
1 1 1 6   4  9  o 267.0146 4.901557 869.1697       31.89372 969.0688       59.51045 828.9135       37.77716 281.6511 8.680896 260.7256 5.945791 20.92551       10.52190 
1 1 1 6   4  10 o 584.7662 8.476540 4172.202       120.7917 4292.988       173.9743 4059.781       167.8411 592.7574 12.04403 576.4450 11.94825 16.31238       16.96524 
1 1 1 6   4  11 o 438.7658 7.475753 2347.958       79.93258 2370.133       98.65490 2305.585       136.3757 440.7246 9.185763 434.1848 12.90353 6.539856       15.83917 
1 1 1 6   4  12 o 323.2919 4.964801 1274.013       39.11404 1314.188       56.28534 1236.493       54.39434 328.2816 7.035785 318.4308 7.009749 9.850800       9.931709 
1 1 1 6   4  13 o 319.0629 4.916395 1240.905       38.22602 1289.026       55.27053 1196.781       52.92522 325.1222 6.976070 313.2747 6.932681 11.84747       9.835020 
1 1 1 6   4  14 o 252.3500 4.749019 776.2339       29.20407 808.7813       36.40113 717.4434       48.92281 257.5600 5.799631 242.3614 8.295691 15.19859       10.12197 
1 1 1 6   4  15 o 517.3306 7.574750 3264.696       95.49323 3172.080       132.3973 3365.118       137.8642 509.6522 10.66029 524.9175 10.77766 -15.26535      15.15915 
1 1 1 6   4  16 o 200.4216 3.540892 489.5724       17.29392 480.9818       24.13595 498.6361       24.79182 198.5654 4.991938 202.2396 5.030443 -3.674179      7.086945 
1 1 1 6   4  17 o 216.0905 3.732398 569.1579       19.65439 573.2228       27.82248 565.1087       27.76862 216.8223 5.265696 215.2815 5.293118 1.540848       7.466234 
1 1 1 6   4  18 o 283.1790 5.206818 977.8841       35.93102 963.6472       43.71264 1007.542       63.09075 281.0517 6.382412 287.0620 9.030138 -6.010376      11.05796 
1 1 1 6   4  19 o 375.7271 5.711965 1722.221       52.29910 1741.856       74.33683 1702.976       73.59296 377.6295 8.077967 373.3900 8.087932 4.239410       11.43102 
1 1 1 6   4  20 o 326.4908 7.218502 1302.122       57.43201 0.000000       0.000000 1302.122       57.43201 ?        ?        326.4908 7.218502 0.000000       7.218502 
1 1 1 6   4  21 o 377.3857 5.750626 1738.894       52.88551 1690.067       73.29258 1791.931       76.38612 371.6743 8.092102 382.6921 8.190846 -11.01782      11.51400 
1 1 1 6   4  22 o 216.5977 3.794702 572.2778       20.02938 554.2986       27.71661 591.9294       28.97705 212.9827 5.344448 220.1570 5.401141 -7.174347      7.598385 
1 1 1 6   4  23 o 159.0531 3.263588 308.5679       12.64951 313.3218       17.81001 303.7286       17.96927 160.1276 4.568841 157.6436 4.682735 2.483963       6.542348 
1 1 1 6   4  24 o 90.17899 3.021477 99.30733       6.630511 98.73870       9.184193 99.92635       9.582397 89.82642 4.207355 90.35145 4.365055 -0.5250320     6.062634 
1 1 1 6   4  25 o 285.4736 4.627496 995.9671       32.19201 991.8599       45.22522 1000.186       45.83364 284.4626 6.524082 285.6382 6.584641 -1.175568      9.269365 
1 1 1 6   4  26 o 269.1625 5.117603 886.4288       33.56736 867.6104       40.53002 927.5288       59.89698 266.0179 6.252157 274.0083 8.982402 -7.990356      10.94409 
1 1 1 6   4  27 o 31.74727 6.236629 12.79146       4.652743 11.66801       5.561636 15.41114       8.492767 30.20244 7.571714 34.75491 9.673607 -4.552477      12.28452 
1 1 1 6   4  28 o 56.79910 3.610568 39.57385       4.971633 32.94626       6.724280 47.56529       7.383811 51.56047 5.433297 62.13173 4.916811 -10.57126      7.327738 
1 1 1 6   4  29 o 105.1696 3.123806 135.2007       7.997031 132.1921       11.03340 138.5305       11.60744 103.8321 4.370325 106.2779 4.491981 -2.445801      6.267187 
1 1 1 6   4  30 o 97.48599 3.184206 116.2363       7.554337 114.0222       10.54438 118.5711       10.82816 96.36887 4.502468 98.27126 4.533816 -1.902397      6.389656 
1 1 1 6   4  31 o 71.62839 4.112035 63.04121       7.147418 77.93459       13.29546 56.98761       8.476434 79.09754 6.968889 67.92175 5.159763 11.17579       8.671134 
1 1 1 6   4  32 o 143.5456 3.349432 252.0530       11.71648 251.4972       16.51977 252.6156       16.61990 143.0283 4.746222 143.3414 4.764581 -0.3130798     6.725165 
1 1 1 6   4  33 o 95.80834 3.695541 112.6330       8.611967 116.0936       13.84100 110.4469       11.00075 96.75348 5.898388 94.64835 4.785027 2.105133       7.595226 
1 1 1 6   4  34 o 40.70584 4.917524 20.70616       4.779230 22.36829       6.383479 18.58613       7.209324 41.97907 6.445756 37.80114 8.071774 4.177925       10.32963 
1 1 1 6   4  35 o 40.53659 4.986913 20.60366       4.822531 22.40639       6.471123 18.35185       7.232373 41.89777 6.552522 37.41445 8.162536 4.483315       10.46721 
1 1 1 6   4  36 o 23.03855 7.129513 6.722131       4.410544 8.908391       5.914182 3.982674       6.620275 26.39530 8.269676 21.81500 8.551185 4.580303       11.89581 
1 1 1 6   4  37 o 51.23694 4.926560 32.99662       6.075519 37.88136       7.302241 22.00964       10.95152 54.71289 5.553710 39.61753 10.96919 15.09535       12.29500 
1 1 1 6   4  38 o 59.73254 4.452390 44.77874       6.434357 40.93365       7.607095 54.44600       12.06195 56.62436 5.585550 64.02718 7.897888 -7.402813      9.673417 
1 1 1 6   4  39 o 17.93649 7.062407 2.863527       4.533218 2.106738       5.504728 4.458288       7.990912 18.36446 7.581977 22.65252 9.218682 -4.288055      11.93610 
1 1 1 6   4  40 o 56.79942 3.982875 40.84715       5.477915 44.29954       7.427775 36.73028       8.111136 58.35192 5.280674 52.25140 6.510995 6.100525       8.383231 
1 1 1 6   4  41 o 25.87071 6.533385 9.480552       4.119215 7.218106       5.358942 12.74761       6.439745 22.62478 7.901104 28.86777 8.549007 -6.242985      11.64100 
1 1 1 6   4  42 o 19.25731 7.441517 4.807901       4.957430 1.449992       8.399047 6.603162       6.141286 19.20793 8.624476 21.50058 8.289393 -2.292646      11.96226 
1 1 1 6   4  43 o 25.73288 7.126077 10.53732       4.621519 17.67950       7.255667 5.661510       5.994946 31.29296 9.021183 19.77588 8.007970 11.51708       12.06272 
1 1 1 6   4  44 o 18.73778 6.615387 5.589549       3.763738 5.757920       5.197949 5.403980       5.456952 18.89846 7.523821 18.61100 7.601438 0.2874603      10.69531 
1 1 1 6   4  45 o 18.05484 6.578510 5.470246       3.754227 7.314579       5.366494 3.702522       5.253855 19.62696 7.697356 16.49595 7.131643 3.131010       10.49331 
1 1 1 6   4  46 o 13.86740 5.933555 2.318263       3.566012 5.169688       5.029121 -0.5650926     5.057201 16.82920 7.117726 13.07180 6.155116 3.757393       9.409966 
1 1 1 6   4  47 o 15.88625 6.886325 5.073955       4.924847 5.073955       4.924847 0.000000       0.000000 15.88625 6.886325 ?        ?        0.000000       6.886325 
1 1 1 6   4  48 o 29.24779 6.072159 15.71415       4.186083 23.08533       6.009212 8.764934       5.834676 32.00732 7.780996 17.42744 7.524873 14.57987       10.82440 
1 1 1 6   5  0  o 214.6879 2.882987 561.7447       15.08295 575.9089       21.63365 548.3474       21.03978 217.3480 4.084492 212.0837 4.070969 5.264236       5.766789 
1 1 1 6   5  1  o 333.8057 4.511759 1358.589       36.70081 1369.765       47.76031 1342.473       57.35175 335.0987 5.848687 331.6544 7.096182 3.444214       9.195811 
1 1 1 6   5  2  o 608.4198 7.857320 4519.919       116.4968 4550.917       184.8277 4499.487       150.0565 609.5328 12.44325 606.6147 10.15093 2.918091       16.05852 
1 1 1 6   5  3  o 147.7495 3.235970 266.0817       11.65110 281.7179       14.35650 235.9146       19.94110 151.9674 3.879872 138.9390 5.903095 13.02840       7.063989 
1 1 1 6   5  4  o 453.2526 7.692428 2508.152       84.96496 2506.214       103.7828 2512.091       147.9583 452.8541 9.404399 452.4890 13.43310 0.3651733      16.39790 
1 1 1 6   5  5  o 465.2056 6.814573 2640.911       77.25376 2616.730       88.51386 2718.227       158.2741 462.9568 7.845754 470.6611 13.81452 -7.704254      15.88700 
1 1 1 6   5  6  o 450.5422 6.618132 2476.553       72.66194 2493.321       103.1986 2460.067       102.3260 451.7667 9.373969 448.7460 9.357270 3.020691       13.24499 
1 1 1 6   5  7  o 96.08361 2.846619 112.6107       6.657876 113.6564       12.41652 112.1887       7.887696 96.39956 5.305994 95.88166 3.381106 0.5178986      6.291697 
1 1 1 6   5  8  o 416.3978 7.138584 2115.139       72.43635 2079.719       124.6872 2133.182       88.99437 412.2149 12.42677 418.0466 8.735780 -5.831757      15.19008 
1 1 1 6   5  9  o 465.5830 7.883533 2644.511       89.44460 2710.153       111.5977 2526.598       149.5714 471.1724 9.719398 454.3329 13.52452 16.83948       16.65471 
1 1 1 6   5  10 o 1057.650 17.45547 13704.47       449.8934 13735.50       552.1394 13643.16       776.0580 1057.388 21.42784 1049.078 30.38842 8.309814       37.18344 
1 1 1 6   5  11 f 575.8253 9.634734 4046.355       135.1968 4084.990       166.7949 3972.352       230.8455 578.3387 11.83490 569.4151 16.65418 8.923584       20.43102 
1 1 1 6   5  12 o 422.2287 6.268462 2173.634       64.49779 2228.086       92.58146 2122.285       89.90472 427.3429 8.890198 417.0761 8.845677 10.26685       12.54120 
1 1 1 6   5  13 o 283.9580 4.473128 982.8020       30.95292 986.2640       43.81983 979.3544       43.72838 284.4081 6.322555 283.4098 6.331584 0.9982910      8.947830 
1 1 1 6   5  14 o 310.0345 4.810849 1171.697       36.34694 1112.612       49.72091 1239.511       53.26675 302.0523 6.754930 318.8084 6.856308 -16.75610      9.624866 
1 1 1 6   5  15 o 302.4060 5.474633 1114.952       40.34424 1138.909       49.78216 1069.108       68.86383 305.5913 6.684927 295.7821 9.566539 9.809204       11.67077 
1 1 1 6   5  16 o 692.1494 9.987160 5850.705       168.4527 5873.861       238.7734 5827.759       237.6864 692.7149 14.14475 689.9931 14.13590 2.721802       19.99744 
1 1 1 6   5  17 o 192.6832 3.473456 452.5168       16.30955 449.6100       22.87461 455.5225       23.26060 191.9706 4.893698 193.2269 4.943949 -1.256363      6.956357 
1 1 1 6   5  18 o 164.9432 3.229113 331.6048       12.97937 334.4727       18.28755 328.6939       18.42443 165.5658 4.536891 164.1244 4.611215 1.441422       6.468901 
1 1 1 6   5  19 o 146.3772 4.194117 261.4672       14.94521 249.8388       20.37358 275.0144       21.99033 142.9759 5.859895 150.0055 6.028010 -7.029602      8.406858 
1 1 1 6   5  20 o 171.8460 3.907269 360.1059       16.36247 348.7108       28.41939 365.7563       20.01218 168.8211 6.922679 173.0913 4.748906 -4.270203      8.394975 
1 1 1 6   5  21 o 322.8399 5.046906 1272.068       39.70531 1225.020       54.68815 1324.514       57.73960 316.5550 7.089375 329.1421 7.198703 -12.58713      10.10349 
1 1 1 6   5  22 o 501.9745 7.427885 3084.303       90.86213 2994.540       125.8385 3182.078       131.3346 493.5081 10.46364 508.6688 10.59517 -15.16064      14.89112 
1 1 1 6   5  23 f 223.6321 3.888430 610.3190       21.19066 646.4827       30.61912 577.0752       29.35696 229.9865 5.463289 217.2092 5.550764 12.77730       7.788357 
1 1 1 6   5  24 o 278.0862 4.524188 944.6545       30.65887 941.2062       43.08203 948.1927       43.63974 277.2298 6.377055 278.2438 6.436067 -1.013977      9.060341 
1 1 1 6   5  25 o 173.0987 3.883572 365.8756       16.38178 353.0208       19.67374 394.9401       29.58250 169.8728 4.757237 179.3202 6.781922 -9.447372      8.284068 
1 1 1 6   5  26 o 110.5601 3.028524 149.2708       8.151853 145.1148       11.26186 153.8450       11.81494 108.8898 4.252286 112.1129 4.332696 -3.223091      6.070765 
1 1 1 6   5  27 o 152.2939 3.749907 283.3482       13.91679 283.9582       16.82142 282.0249       24.77521 152.2976 4.537514 151.3477 6.734328 0.9498749      8.120358 
1 1 1 6   5  28 o 165.4983 3.381924 334.5443       13.63935 342.5912       19.29518 326.5076       19.28272 167.2143 4.739993 163.2167 4.853448 3.997604       6.784061 
1 1 1 6   5  29 o 71.05422 3.337355 61.81760       5.762529 64.82661       8.032582 58.62687       8.271566 72.61623 4.562320 68.98531 4.953310 3.630928       6.734245 
1 1 1 6   5  30 o 130.5071 3.189808 208.1120       10.14460 219.0068       14.37878 197.3141       14.31470 133.6348 4.421449 126.7943 4.640659 6.840591       6.409753 
1 1 1 6   5  31 o 116.9025 3.183394 167.1636       9.060369 168.7449       12.63505 165.4898       12.99931 117.2424 4.430351 116.0696 4.604986 1.172791       6.390141 
1 1 1 6   5  32 o 32.10583 8.268933 13.34543       6.508713 0.000000       0.000000 13.34543       6.508713 ?        ?        32.10583 8.268933 0.000000       8.268933 
1 1 1 6   5  33 o 101.6089 3.259312 126.4861       8.059938 124.0294       11.05406 129.2749       11.77722 100.3611 4.531500 102.4174 4.731600 -2.056320      6.551529 
1 1 1 6   5  34 o 58.31910 3.865544 41.92058       5.462602 41.37039       7.373414 42.58994       8.132874 57.64230 5.308771 58.37551 5.793482 -0.7332077     7.857956 
1 1 1 6   5  35 o 40.38165 4.965692 20.45142       4.783751 24.73316       6.452209 15.22467       7.128763 44.15808 6.163723 33.96010 8.605047 10.19798       10.58482 
1 1 1 6   5  36 o 30.22376 7.129989 11.99306       5.165827 6.934599       5.963030 27.20828       10.34182 24.14028 8.339980 44.93095 9.727701 -20.79066      12.81341 
1 1 1 6   5  37 o 49.35823 4.358368 30.45480       5.188467 31.52272       6.754507 28.91772       8.103545 49.79990 5.666483 47.04052 7.306095 2.759384       9.245975 
1 1 1 6   5  38 o 19.16756 7.332189 3.609286       4.779019 4.251688       5.651861 1.997792       8.951626 20.69870 7.959531 22.20411 9.447775 -1.505402      12.35373 
1 1 1 6   5  39 o 58.48576 3.939340 42.95906       5.581730 55.21294       7.638430 28.91787       8.176532 65.88350 4.790364 46.10380 7.537985 19.77970       8.931338 
1 1 1 6   5  40 o 20.19454 6.837702 5.338601       4.003840 6.685612       5.294053 3.538573       6.119870 22.41253 7.851273 19.85171 8.071756 2.560822       11.26036 
1 1 1 6   5  41 o 11.23508 5.267863 -2.995140      3.636407 -2.997971      4.581172 -2.990319      5.978820 12.89666 6.002540 14.94244 6.921179 -2.045788      9.161507 
1 1 1 6   5  42 o 31.44898 6.423099 14.33473       4.755928 16.80065       7.023929 12.24705       6.462844 31.90293 8.765882 27.23457 8.659525 4.668365       12.32185 
1 1 1 6   5  43 o 22.13078 7.002218 7.781874       4.230270 10.00522       5.736638 5.131840       6.262962 24.04840 8.184159 19.34035 8.045166 4.708054       11.47629 
1 1 1 6   5  44 o 17.87823 7.077397 4.887115       4.574652 -7.452223      8.020064 10.83795       5.569562 14.04080 6.884934 24.10988 8.064084 -10.06908      10.60338 
1 1 1 6   5  45 o 15.29666 6.238067 3.217245       3.668083 3.033835       5.078469 3.417289       5.303769 15.84976 6.929805 16.23590 7.090595 -0.3861437     9.914572 
1 1 1 6   5  46 f 11.68218 5.499462 -1.185672      4.032860 -2.791803      4.775718 2.806375       7.529150 11.70902 5.640704 15.83257 7.471945 -4.123546      9.362024 
1 1 1 6   5  47 o 12.15833 5.505103 0.9707978      3.505684 4.049125       4.901370 -2.253454      5.016197 15.06346 6.687353 11.73409 5.683947 3.329372       8.776556 
1 1 1 6   5  48 o 11.23636 5.344636 -0.6459287     4.000242 -1.145865      4.850822 0.4166866      7.072064 11.68609 5.643370 13.34238 6.526257 -1.656290      8.627842 
1 1 1 6   6  0  o 394.3416 4.783133 1896.238       45.96434 1866.508       64.40424 1927.100       65.61959 391.0850 6.757830 397.3804 6.776274 -6.295441      9.570066 
1 1 1 6   6  1  o 295.2813 4.067760 1062.976       29.27031 1130.780       47.91788 1022.618       36.96905 304.4223 6.459293 289.5675 5.239048 14.85477       8.316855 
1 1 1 6   6  2  o 482.4948 6.307528 2840.374       74.16311 2700.319       113.3621 2945.169       98.05923 469.9871 9.897963 491.0881 8.193945 -21.10095      12.84953 
1 1 1 6   6  3  o 561.8717 8.161382 3855.173       111.7473 3755.863       154.9279 3962.868       161.3358 553.9879 11.47608 569.0150 11.63512 -15.02710      16.34247 
1 1 1 6   6  4  o 287.1883 3.961104 1005.446       27.72165 1006.661       35.70393 1003.601       43.98851 287.3142 5.099444 286.8145 6.293643 0.4997864      8.100264 
1 1 1 6   6  5  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 6   6  6  o 356.6857 10.85788 1556.561       94.26723 1556.561       94.26723 0.000000       0.000000 356.6857 10.85788 ?        ?        0.000000       10.85788 
1 1 1 6   6  7  o 585.6516 12.02875 4193.621       171.6706 4012.121       236.0653 4397.343       250.0998 571.6150 16.96576 598.3954 17.16873 -26.78046      24.13716 
1 1 1 6   6  8  f 268.5320 5.977476 879.2725       39.11559 855.9948       55.53193 902.1945       55.10612 264.7069 8.620271 271.7867 8.330066 -7.079834      11.98745 
1 1 1 6   6  9  o 215.1980 4.183381 564.4482       21.93824 550.7008       38.18499 571.2219       26.80340 212.3597 7.390043 216.4686 5.081114 -4.108917      8.968303 
1 1 1 6   6  10 o 457.1514 6.724247 2548.363       74.91000 2628.755       108.0601 2473.988       103.9376 464.1238 9.554221 450.2599 9.472692 13.86389       13.45418 
1 1 1 6   6  11 o 1243.629 17.74216 18942.45       537.6917 19350.48       772.3165 18558.64       749.0392 1253.621 25.28093 1227.828 25.03405 25.79309       35.57850 
1 1 1 6   6  12 o 642.5405 10.70950 5040.196       167.6895 4955.181       203.1819 5221.809       296.9688 636.7940 13.09333 652.4614 18.69683 -15.66742      22.82557 
1 1 1 6   6  13 o 106.1846 2.642233 137.3990       6.837050 129.0506       9.377412 146.8732       9.989705 102.8334 3.748348 109.7139 3.741890 -6.880455      5.296401 
1 1 1 6   6  14 o 382.9908 5.759024 1788.395       53.74936 1799.817       76.21530 1777.093       75.81245 384.0881 8.142828 381.6551 8.151423 2.432983       11.52178 
1 1 1 6   6  15 o 285.9970 4.514896 997.0537       31.46627 969.8848       43.67073 1026.389       45.37844 282.0131 6.354554 290.1092 6.418774 -8.096039      9.032221 
1 1 1 6   6  16 o 182.2782 3.882764 404.9812       17.24693 392.7606       20.50025 434.5821       31.90548 179.4306 4.692449 188.6184 6.953270 -9.187820      8.388507 
1 1 1 6   6  17 o 183.1018 3.368498 408.6312       15.03021 398.6064       20.80698 419.5704       21.73524 180.7520 4.727842 185.4430 4.813769 -4.691055      6.747211 
1 1 1 6   6  18 o 123.6930 3.291806 186.6234       9.913554 189.7136       16.07384 184.7264       12.59410 124.6073 5.305610 123.0199 4.207220 1.587318       6.771277 
1 1 1 6   6  19 o 363.8876 5.551757 1615.565       49.23045 1612.348       69.36483 1618.831       69.88281 363.2832 7.835341 364.0074 7.878146 -0.7242126     11.11115 
1 1 1 6   6  20 o 192.2253 3.990915 450.6237       18.69473 449.3857       22.93485 453.0751       32.27191 191.8547 4.909581 192.4554 6.892239 -0.6006775     8.462088 
1 1 1 6   6  21 o 510.4122 8.732828 3191.373       108.6206 3319.385       193.6363 3132.597       131.2083 517.4348 15.37364 505.0282 10.66128 12.40665       18.70860 
1 1 1 6   6  22 o 195.4082 3.563048 465.7789       16.96683 442.3391       23.15357 492.9638       24.93475 190.2594 4.998181 200.8475 5.098632 -10.58809      7.139878 
1 1 1 6   6  23 o 385.9796 5.881907 1822.114       55.32464 1801.232       77.45385 1843.865       79.05235 383.0472 8.297640 387.5281 8.370962 -4.480896      11.78660 
1 1 1 6   6  24 o 125.5229 3.426251 192.4128       10.47060 189.6028       12.70909 198.3501       18.47375 124.5319 4.193899 127.1562 5.978597 -2.624283      7.302905 
1 1 1 6   6  25 o 123.3587 3.030759 185.6664       9.110812 177.8538       12.43989 194.7055       13.38077 120.5834 4.240032 126.1601 4.358890 -5.576630      6.080936 
1 1 1 6   6  26 o 112.2439 3.000769 153.8486       8.200522 147.9084       11.16465 160.8079       12.08447 109.9389 4.174912 114.6206 4.334231 -4.681618      6.017927 
1 1 1 6   6  27 o 104.2378 3.030696 132.7371       7.690284 136.9291       10.61093 128.0989       11.16134 105.7560 4.125214 102.2378 4.490863 3.518196       6.097970 
1 1 1 6   6  28 o 165.7602 3.915863 335.9160       15.81772 341.5348       19.13779 323.8028       28.09983 166.9501 4.708721 161.9607 7.137165 4.989456       8.550508 
1 1 1 6   6  29 o 131.4846 3.184074 211.1810       10.20221 203.8979       13.91689 219.6420       15.00013 128.9693 4.434722 133.8301 4.606308 -4.860794      6.394125 
1 1 1 6   6  30 o 111.1555 3.138138 151.0842       8.491886 161.5317       11.96389 140.4764       12.05531 114.7633 4.285453 106.9504 4.636528 7.812889       6.313675 
1 1 1 6   6  31 o 101.0138 3.616655 125.0020       8.888379 141.8986       14.58600 115.0213       11.21024 107.2413 5.600747 96.69543 4.772178 10.54586       7.358128 
1 1 1 6   6  32 o 91.10540 3.305933 101.6709       7.327462 104.2986       9.946294 98.55201       10.83597 92.08183 4.445661 89.39140 4.994201 2.690430       6.686250 
1 1 1 6   6  33 o 53.71268 5.023762 35.83427       6.499409 31.48589       11.29579 37.98635       7.946615 49.04591 9.794090 55.09566 6.016396 -6.049747      11.49440 
1 1 1 6   6  34 o 28.99537 6.497046 10.85784       4.476703 9.425675       5.885686 12.82366       6.895607 27.19851 8.201245 31.36565 8.711573 -4.167143      11.96461 
1 1 1 6   6  35 o 154.1428 3.448872 291.6447       12.95497 298.6646       17.90092 283.9246       18.77232 155.4153 4.732077 151.3510 5.097022 4.064316       6.955011 
1 1 1 6   6  36 o 41.79802 5.584855 22.16141       5.546350 28.95476       6.539879 4.758271       10.46746 47.82354 5.725311 25.91344 10.54901 21.91010       12.00253 
1 1 1 6   6  37 o 124.6350 3.351915 191.5811       10.17126 209.4766       14.13738 172.3783       14.64468 129.7213 4.478925 117.2663 5.137189 12.45493       6.815533 
1 1 1 6   6  38 o 27.06487 6.803274 9.832243       4.481417 7.602832       5.866156 12.95699       6.944897 24.35341 8.276216 30.56947 8.829911 -6.216057      12.10219 
1 1 1 6   6  39 o 73.30228 3.947149 67.47047       7.024775 66.68811       8.351007 69.36375       12.99101 72.39145 4.760275 71.60593 7.558815 0.7855148      8.932856 
1 1 1 6   6  40 o 76.02875 3.444691 72.54381       6.365531 82.79927       8.766733 61.10734       9.257764 80.42931 4.490713 68.13077 5.626156 12.29854       7.198620 
1 1 1 6   6  41 o 12.00639 5.520830 -1.971564      3.705555 -1.809007      4.881330 -2.192646      5.692614 14.03653 6.410078 14.94276 6.860658 -0.9062328     9.389235 
1 1 1 6   6  42 o 30.30808 6.150388 13.23001       4.387092 9.050565       5.790348 18.86245       6.721924 23.80056 8.218531 34.43880 8.139247 -10.63824      11.56683 
1 1 1 6   6  43 o 19.61337 7.482076 5.935601       4.967499 -0.7452465     8.561312 9.326322       6.099168 17.26180 8.090215 22.99229 8.383856 -5.730490      11.65078 
1 1 1 6   6  44 o 22.53987 6.678644 8.405516       3.929334 8.011192       5.269904 8.899199       5.896591 21.03191 7.772336 21.66707 8.178041 -0.6351585     11.28227 
1 1 1 6   6  45 o 16.69358 6.396958 4.483698       3.641856 4.751598       4.986272 4.177384       5.331797 17.12110 7.154576 16.73249 7.208823 0.3886051      10.15653 
1 1 1 6   6  46 o 10.99422 5.159558 -1.171188      3.501842 -1.904486      4.849723 -0.3723581     5.061785 12.12993 5.801408 13.05551 6.150671 -0.9255800     8.455004 
1 1 1 6   6  47 o 14.74430 6.294323 3.826886       3.996289 3.634959       5.950827 3.984542       5.393411 14.88537 6.898294 15.00313 6.807140 -0.1177654     9.691420 
1 1 1 6   6  48 o 14.01407 6.151855 3.564942       4.038170 0.2622986      4.912402 10.44756       7.091529 12.31605 5.876237 17.40576 7.860320 -5.089712      9.814010 
1 1 1 6   7  0  f 377.5652 5.629649 1738.785       51.79757 1673.546       71.54710 1810.639       75.08665 370.2231 7.930351 385.0814 8.001550 -14.85825      11.26567 
1 1 1 6   7  1  o 37.64226 2.397834 17.33793       2.188101 16.85248       3.104376 17.81721       3.084602 37.01965 3.482058 38.08526 3.357936 -1.065617      4.837402 
1 1 1 6   7  2  o 347.7808 5.229953 1475.033       44.32405 1440.258       61.77621 1511.930       63.63234 343.5061 7.379904 351.9460 7.419348 -8.439880      10.46469 
1 1 1 6   7  3  o 234.6859 4.400204 671.4890       25.16494 669.2198       30.51233 676.3155       44.50014 234.2558 5.345014 235.2515 7.773015 -0.9957275     9.433394 
1 1 1 6   7  4  o 325.9842 7.014039 1296.641       55.71868 1296.641       55.71868 0.000000       0.000000 325.9842 7.014039 ?        ?        0.000000       7.014039 
1 1 1 6   7  5  o 164.5671 6.247871 330.8006       25.01047 330.8006       25.01047 0.000000       0.000000 164.5671 6.247871 ?        ?        0.000000       6.247871 
1 1 1 6   7  6  o 86.52019 3.761267 91.41267       7.911318 95.19409       11.30429 87.78258       11.07579 88.20264 5.283491 84.67844 5.395488 3.524200       7.551594 
1 1 1 6   7  7  o 355.6497 7.670003 1543.088       66.47434 1594.597       95.82185 1495.300       92.29514 361.1451 10.90044 349.7158 10.84308 11.42929       15.37504 
1 1 1 6   7  8  o 698.6418 10.08935 5958.677       171.7726 5781.518       238.0976 6150.962       248.0545 687.5286 14.21111 709.1280 14.35444 -21.59937      20.19915 
1 1 1 6   7  9  o 106.5740 3.982479 138.6220       10.32467 164.6051       15.41970 117.5059       13.90073 116.0718 5.466823 98.00068 5.847247 18.07113       8.004777 
1 1 1 6   7  10 o 739.1732 10.61868 6669.620       191.2726 6534.595       266.5678 6812.917       274.6123 730.9876 14.96448 746.3679 15.09840 -15.38031      21.25788 
1 1 1 6   7  11 o 340.0391 5.165749 1409.469       42.80537 1399.018       60.15791 1420.187       60.92118 338.7020 7.288513 341.2534 7.325803 -2.551392      10.33392 
1 1 1 6   7  12 o 679.2012 11.29729 5633.296       186.9859 5836.495       330.4995 5537.632       226.7692 689.5189 19.68944 673.0399 13.82634 16.47900       24.05913 
1 1 1 6   7  13 o 432.2147 6.408445 2277.913       67.49760 2370.296       97.87766 2194.140       93.20567 440.7198 9.113494 424.0336 9.019987 16.68622       12.82248 
1 1 1 6   7  14 o 181.1400 3.280932 399.8800       14.48263 375.0036       19.75763 428.7682       21.29132 175.3353 4.628172 187.5480 4.658586 -12.21278      6.566765 
1 1 1 6   7  15 o 121.5197 2.802474 179.9602       8.298976 180.4832       11.59291 179.4106       11.88561 121.6229 3.916585 121.2557 4.027971 0.3671722      5.618202 
1 1 1 6   7  16 o 252.8017 4.789098 779.1548       29.50325 767.2585       35.50177 805.7108       53.04253 250.8293 5.808121 256.7712 8.488661 -5.941864      10.28551 
1 1 1 6   7  17 o 385.2545 6.690393 1810.901       62.81096 1786.248       106.4055 1824.086       77.81480 381.9519 11.44483 386.5159 8.261497 -4.563995      14.11511 
1 1 1 6   7  18 o 136.9333 2.990635 228.5443       9.979494 241.9374       14.21681 215.5349       14.01169 140.8056 4.147819 132.8838 4.332748 7.921799       5.998092 
1 1 1 6   7  19 o 235.0384 3.946754 673.6084       22.60555 661.5653       31.45968 686.4643       32.50402 232.8435 5.544395 237.1797 5.623718 -4.336243      7.897248 
1 1 1 6   7  20 o 158.5354 3.178691 306.4254       12.28035 314.0297       17.36573 298.8188       17.36834 160.3820 4.447548 156.4384 4.560819 3.943604       6.370381 
1 1 1 6   7  21 f 62.33815 4.730997 47.70138       7.133254 50.66330       11.51050 45.85460       9.088971 63.90865 7.535635 60.94490 6.206360 2.963745       9.762413 
1 1 1 6   7  22 o 123.0610 3.598885 184.9061       10.78097 190.2611       19.66371 182.6046       12.89122 124.5427 6.501560 122.2346 4.334629 2.308105       7.814044 
1 1 1 6   7  23 o 174.4175 3.830786 371.2979       16.28224 370.5143       19.96219 372.8553       28.14366 174.0948 4.709613 174.3636 6.635625 -0.2687988     8.137074 
1 1 1 6   7  24 o 73.69731 3.051059 66.37343       5.467618 61.27019       7.291449 72.92942       8.264380 70.69947 4.251803 77.13924 4.414854 -6.439766      6.129336 
1 1 1 6   7  25 o 170.3110 3.349666 354.0248       13.90210 353.1823       19.33888 354.9257       19.99879 169.9072 4.675159 170.3040 4.823703 -0.3968201     6.717531 
1 1 1 6   7  26 o 90.34963 2.999365 99.72718       6.594615 94.80154       8.900577 105.7222       9.819358 87.97728 4.163374 92.89595 4.349684 -4.918671      6.021082 
1 1 1 6   7  27 o 124.2508 3.063440 188.4594       9.275661 180.7259       12.59037 197.6396       13.71753 121.4951 4.259079 127.0342 4.437995 -5.539055      6.151062 
1 1 1 6   7  28 o 197.8119 4.236294 478.7189       20.42089 469.7939       24.44239 499.3477       37.16024 195.7080 5.129482 200.9863 7.600798 -5.278351      9.169717 
1 1 1 6   7  29 o 142.3271 3.226414 247.4799       11.19035 240.4333       15.29959 255.5862       16.40977 140.0410 4.489003 144.3545 4.670979 -4.313492      6.478364 
1 1 1 6   7  30 o 82.06835 3.593266 82.52833       7.168812 80.66546       10.86287 83.96559       9.541616 80.82005 5.549232 82.60777 4.760010 -1.787712      7.311065 
1 1 1 6   7  31 o 166.1543 3.442100 337.6894       13.93706 326.6020       18.96140 350.7186       20.55484 163.0429 4.777504 168.8942 4.999673 -5.851303      6.915293 
1 1 1 6   7  32 o 80.23389 3.317336 78.89712       6.472106 84.25916       8.845123 72.71781       9.495308 82.74035 4.402676 76.70996 5.108615 6.030388       6.743998 
1 1 1 6   7  33 f 28.12139 7.935575 10.17787       5.673758 30.60718       10.92620 2.635155       6.639049 48.37462 9.607468 20.91112 8.441718 27.46350       12.78929 
1 1 1 6   7  34 o 104.6005 3.244175 134.1783       8.259407 133.1420       11.09408 135.4670       12.37112 103.9175 4.390829 104.6840 4.862739 -0.7665100     6.551764 
1 1 1 6   7  35 o 21.93006 7.470583 5.678629       4.780065 8.131848       5.527212 -1.600070      9.520612 25.38005 8.000549 21.40156 9.418610 3.978495       12.35795 
1 1 1 6   7  36 o 84.35834 3.366408 87.65399       6.906497 77.87672       8.970457 101.8860       10.82276 79.10662 4.674183 90.41541 4.930675 -11.30878      6.794081 
1 1 1 6   7  37 o 59.40788 3.883014 43.88138       5.590650 45.81786       7.317296 41.16571       8.665281 60.31068 5.024346 56.57357 6.397521 3.737114       8.134638 
1 1 1 6   7  38 o 35.57003 5.329653 16.34146       4.477671 15.54477       5.735412 17.58497       7.165440 33.96353 7.155912 35.62817 8.392216 -1.664642      11.02889 
1 1 1 6   7  39 o 73.42538 3.917370 67.76352       6.983966 72.49436       8.315915 56.44037       12.86543 75.56204 4.537067 63.51548 8.527298 12.04656       9.659182 
1 1 1 6   7  40 o 30.26620 5.899652 12.44669       4.194901 17.28128       5.607345 6.301919       6.321651 35.27517 6.769185 22.31758 8.457713 12.95759       10.83304 
1 1 1 6   7  41 o 22.56130 7.105431 7.391211       4.360559 6.113193       6.141480 8.690491       6.192358 21.45413 8.284736 24.03598 8.485469 -2.581856      11.85917 
1 1 1 6   7  42 o 23.77806 6.700833 8.523200       4.048330 4.218547       5.358108 14.24941       6.179823 18.66624 7.566307 29.46283 8.270626 -10.79659      11.20947 
1 1 1 6   7  43 o 20.51751 6.995636 6.742730       4.191743 12.80823       5.577936 -1.126852      6.353546 27.21683 7.928657 15.24755 7.087306 11.96928       10.63454 
1 1 1 6   7  44 o 27.82315 6.221384 12.21168       4.112246 11.33632       5.684577 13.17268       5.956110 24.31870 8.147126 26.11796 8.314105 -1.799252      11.64045 
1 1 1 6   7  45 o 17.05469 6.762288 4.874357       4.182662 4.101554       4.799956 7.312615       8.525944 16.40880 6.947434 18.80767 8.543297 -2.398869      11.01157 
1 1 1 6   7  46 o 18.87718 6.533931 6.750191       3.660738 7.095598       4.998257 6.350520       5.376548 18.22633 7.336379 17.42154 7.363436 0.8047924      10.39436 
1 1 1 6   7  47 o 7.646386 3.846444 -7.357131      3.231222 -8.883965      4.331185 -5.440725      4.852375 8.793043 4.427173 10.36631 5.134141 -1.573265      6.779326 
1 1 1 6   7  48 f 16.23832 6.425560 5.808051       3.769355 7.985934       5.224044 3.442815       5.444108 17.10345 7.244982 14.04288 6.538546 3.060574       9.759218 
1 1 1 6   8  0  o 165.5314 2.715828 333.9369       10.95516 308.2223       16.74837 353.1662       14.48319 158.9440 4.328093 170.2181 3.491582 -11.27405      5.560894 
1 1 1 6   8  1  o 398.3992 5.298030 1935.557       51.43621 1843.346       78.71371 2004.276       67.95090 388.5561 8.313052 405.2936 6.880014 -16.73746      10.79080 
1 1 1 6   8  2  o 509.7938 6.653156 3170.650       82.65295 3178.755       131.0457 3165.296       106.5099 509.9544 10.54522 509.1478 8.584401 0.8066101      13.59756 
1 1 1 6   8  3  o 552.1639 8.017299 3721.363       107.8778 3757.693       153.5758 3685.977       151.5686 554.3631 11.36821 549.0543 11.32812 5.308777       16.04876 
1 1 1 6   8  4  o 415.5492 8.774362 2108.085       88.85340 2154.231       127.2811 2064.219       124.0948 419.4789 12.46521 410.6217 12.41581 8.857239       17.59357 
1 1 1 6   8  5  o 331.9591 7.229368 1344.296       58.48185 1488.253       87.95002 1230.195       78.30016 348.9098 10.35542 317.2144 10.14220 31.69534       14.49479 
1 1 1 6   8  6  o 361.1450 7.773968 1591.148       68.41644 1733.983       102.0109 1474.374       92.23665 376.5974 11.12781 347.2604 10.91319 29.33704       15.58608 
1 1 1 6   8  7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 6   8  8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 6   8  9  f 333.4480 5.079524 1355.333       41.27501 1319.131       57.37379 1394.168       59.42351 328.8959 7.158450 338.1188 7.211953 -9.222900      10.16148 
1 1 1 6   8  10 o 392.3386 6.801031 1876.968       65.02373 1687.964       106.1035 1990.644       82.28640 371.5996 11.73175 403.9666 8.358850 -32.36700      14.40501 
1 1 1 6   8  11 o 504.8470 7.379613 3108.327       90.78822 3128.541       128.9225 3088.440       127.8718 506.2513 10.45025 502.9979 10.43212 3.253326       14.76607 
1 1 1 6   8  12 o 431.7935 7.357881 2273.956       77.42210 2131.183       127.3524 2357.659       97.51067 417.4451 12.53325 439.5550 9.103383 -22.10986      15.49045 
1 1 1 6   8  13 f 315.5690 5.586832 1214.113       42.96314 1239.901       74.07078 1201.039       52.74163 318.5741 9.551929 313.8152 6.896733 4.758881       11.78152 
1 1 1 6   8  14 o 133.9227 2.863363 218.5701       9.344730 208.2604       12.83116 230.2145       13.63647 130.6526 4.034896 137.3710 4.078042 -6.718414      5.736794 
1 1 1 6   8  15 o 195.4637 3.919331 465.6920       18.66870 476.2675       31.28096 459.8413       23.26652 197.4996 6.508357 194.1490 4.921648 3.350616       8.159738 
1 1 1 6   8  16 o 73.15674 3.005682 65.33652       5.346967 63.65237       7.799551 66.82986       7.344459 72.12016 4.459709 73.92944 4.092647 -1.809280      6.052996 
1 1 1 6   8  17 o 255.3120 4.830540 794.8552       30.05406 784.1097       36.12562 819.0101       54.16337 253.5343 5.847126 258.8014 8.600162 -5.267044      10.39960 
1 1 1 6   8  18 o 273.5175 4.391505 912.2761       29.27080 930.6664       41.68417 894.3871       41.11208 276.1506 6.194254 270.7120 6.231977 5.438599       8.786713 
1 1 1 6   8  19 o 385.7884 5.836406 1816.725       54.86946 1860.557       78.56339 1774.985       76.66570 390.0606 8.265173 380.9863 8.257633 9.074310       11.68339 
1 1 1 6   8  20 o 152.9413 3.121711 285.1918       11.63466 277.1528       16.01542 294.1756       16.93047 150.6608 4.366772 155.2140 4.480814 -4.553192      6.256708 
1 1 1 6   8  21 o 118.8288 3.261525 172.3288       9.435555 167.2622       11.50338 182.7467       16.49526 117.0159 4.040137 122.1865 5.554398 -5.170593      6.868336 
1 1 1 6   8  22 o 87.48005 4.246864 93.63584       9.026385 92.26965       13.99435 94.60913       11.81184 86.56921 6.685423 87.80583 5.548619 -1.236618      8.688041 
1 1 1 6   8  23 o 84.16813 2.916681 86.51114       5.973322 83.93343       8.053700 89.66294       8.905483 82.82028 4.002305 85.58111 4.283773 -2.760826      5.862521 
1 1 1 6   8  24 o 111.6913 2.934296 152.2887       7.979637 151.4092       10.87515 153.3145       11.74478 111.2759 4.017087 111.9446 4.313391 -0.6686630     5.894262 
1 1 1 6   8  25 o 282.6083 4.582162 976.3743       31.55669 969.6697       44.11621 983.3990       45.15782 281.1832 6.438323 283.1360 6.544882 -1.952820      9.180821 
1 1 1 6   8  26 o 164.3424 3.308631 329.7378       13.25055 320.1061       18.17060 340.6769       19.36455 161.7074 4.615809 166.8006 4.768919 -5.093124      6.636889 
1 1 1 6   8  27 o 248.2277 4.200413 753.5016       25.40846 756.6448       35.62772 750.2483       36.24624 248.3109 5.887841 247.2204 6.016482 1.090576       8.418118 
1 1 1 6   8  28 f 219.8763 3.892901 591.1576       20.85873 578.7813       28.81650 604.7795       30.23175 217.1268 5.450486 221.9080 5.595008 -4.781235      7.811012 
1 1 1 6   8  29 o 63.73846 4.485484 50.00589       6.922532 60.62485       8.814034 32.90988       11.18359 70.09959 5.196641 50.62005 9.412495 19.47955       10.75175 
1 1 1 6   8  30 o 221.8162 3.958165 602.3056       21.39554 595.3952       29.62112 609.8439       30.93752 219.9863 5.529860 222.5708 5.708733 -2.584488      7.947891 
1 1 1 6   8  31 o 47.70899 4.047225 28.08466       4.661007 21.37707       5.931914 38.90888       7.535461 41.20141 6.091463 55.94139 5.602979 -14.73998      8.276430 
1 1 1 6   8  32 o 97.84382 3.194697 117.2380       7.607056 124.6097       10.36547 108.6333       11.19880 100.6871 4.233987 93.85392 4.913581 6.833145       6.486134 
1 1 1 6   8  33 o 52.03674 4.078025 33.44217       5.129974 32.38533       6.836749 34.80388       7.760490 50.89820 5.604687 52.65153 6.165025 -1.753334      8.331869 
1 1 1 6   8  34 o 101.4306 4.913745 127.3185       12.10944 137.9315       17.81428 118.2019       16.51060 104.7601 7.018576 96.93792 7.037208 7.822189       9.938949 
1 1 1 6   8  35 o 63.74338 3.693372 50.13165       5.712554 52.34126       7.485191 47.04949       8.840433 64.87344 4.768091 61.11779 6.013467 3.755657       7.674405 
1 1 1 6   8  36 o 109.6564 3.273162 148.0136       8.736780 148.4565       11.77758 147.4716       13.02821 109.3621 4.428456 108.7605 4.928418 0.6016006      6.625747 
1 1 1 6   8  37 o 56.74033 3.803176 40.05144       5.228283 40.48991       6.800028 39.41748       8.176671 56.64252 4.976978 55.38098 6.162981 1.261539       7.921657 
1 1 1 6   8  38 o 62.17615 3.613362 48.17738       5.451251 48.03139       7.134821 48.38210       8.449255 61.56656 4.793310 61.30013 5.722263 0.2664375      7.464591 
1 1 1 6   8  39 o 46.18000 4.249023 27.11989       4.728098 32.50884       6.292103 20.13034       7.165864 50.07608 5.233371 37.74833 8.036632 12.32775       9.590392 
1 1 1 6   8  40 o 47.41241 5.491619 29.85221       6.227762 28.26174       7.809543 32.63040       10.32149 44.66962 7.435525 46.11883 9.500273 -1.449207      12.06409 
1 1 1 6   8  41 o 42.31466 4.629598 23.65616       4.696046 26.65912       6.154699 19.47205       7.264963 43.94066 5.896532 35.18933 8.556018 8.751328       10.39108 
1 1 1 6   8  42 o 12.42439 5.614944 -0.8083276     3.626576 0.9065682      4.676145 -3.396542      5.744724 15.17913 6.642811 13.89286 6.547409 1.286267       9.327138 
1 1 1 6   8  43 o 23.18947 6.554775 8.543759       3.867741 5.095726       5.090729 13.25169       5.948526 18.52153 7.421622 27.06942 8.262169 -8.547884      11.10603 
1 1 1 6   8  44 o 15.96958 7.179815 2.060907       5.842146 10.57104       9.100622 -3.904437      7.619400 21.52104 9.344781 14.58259 7.049622 6.938451       11.70564 
1 1 1 6   8  45 o 11.81480 5.398941 -0.2208205     3.470051 7.156967       4.859296 -7.898110      4.956947 19.14804 7.375912 10.27497 5.106102 8.873063       8.970861 
1 1 1 6   8  46 o 11.46010 5.305598 -0.2968561     3.506963 -0.2113741     4.799850 -0.3947470     5.136431 12.75824 6.004055 12.92612 6.121537 -0.1678734     8.574491 
1 1 1 6   8  47 o 10.05386 4.823123 -1.967841      3.408473 -2.363337      4.623663 -1.497094      5.044388 11.20870 5.435962 11.92217 5.756759 -0.7134666     7.917699 
1 1 1 6   9  0  o 715.9656 9.209730 6259.837       160.6850 6215.126       252.5397 6290.252       208.2864 712.2134 14.55068 717.1619 11.91812 -4.948547      18.80861 
1 1 1 6   9  1  o 254.2366 3.633742 787.8228       22.51273 805.1645       35.90231 776.5857       28.90047 256.9550 5.733625 252.3883 4.698936 4.566681       7.413127 
1 1 1 6   9  2  o 195.9136 3.018641 467.7691       14.41160 493.1998       23.22130 451.8377       18.37953 201.1360 4.737623 192.5339 3.917339 8.602142       6.147407 
1 1 1 6   9  3  o 602.8494 10.08381 4438.485       148.1390 4370.502       254.3239 4473.396       182.2478 596.5667 17.51308 604.8616 12.36432 -8.294922      21.43792 
1 1 1 6   9  4  o 425.4482 7.282942 2207.944       75.50743 2231.929       92.84131 2161.083       129.7711 427.6335 8.909091 420.2395 12.68653 7.394043       15.50225 
1 1 1 6   9  5  o 731.7941 10.55242 6539.252       188.1815 6657.316       269.7842 6427.378       262.6181 737.5517 15.01025 724.7322 14.87000 12.81952       21.12876 
1 1 1 6   9  6  o 203.6527 5.075005 505.5790       25.18621 568.4095       37.73055 455.0801       33.82586 215.7669 7.185856 193.0349 7.203431 22.73201       10.17477 
1 1 1 6   9  7  o 231.8493 5.532275 655.3025       31.25689 682.2749       45.09566 630.3629       43.36306 236.3818 7.839455 227.2006 7.843793 9.181168       11.08973 
1 1 1 6   9  8  o 162.2428 4.562041 321.0899       18.01895 309.7263       24.97166 333.4335       26.02632 159.2519 6.448010 165.2423 6.475854 -5.990433      9.138573 
1 1 1 6   9  9  o 555.2991 8.102415 3761.165       109.6421 3939.034       160.3532 3604.995       150.2538 567.9621 11.58570 543.3705 11.34732 24.59155       16.21697 
1 1 1 6   9  10 o 481.8754 8.188985 2832.448       96.16144 2725.447       163.2387 2889.313       119.0012 471.9435 14.20993 486.5518 10.03659 -14.60825      17.39699 
1 1 1 6   9  11 o 604.6119 8.764091 4460.129       129.1278 4271.563       176.9303 4675.036       188.8837 591.3079 12.27870 618.5701 12.53053 -27.26215      17.54368 
1 1 1 6   9  12 o 352.3355 5.342233 1513.400       45.86858 1461.385       63.38379 1570.589       66.46156 346.1362 7.514413 358.8316 7.600527 -12.69543      10.68805 
1 1 1 6   9  13 o 264.9424 4.237232 855.5972       27.35708 817.3635       37.57634 898.7192       39.90621 258.9084 5.955691 271.4854 6.031953 -12.57700      8.476716 
1 1 1 6   9  14 o 268.2996 4.899817 877.5757       32.03583 883.6815       54.27015 874.3102       39.68850 268.9667 8.289819 267.7602 6.082506 1.206573       10.28192 
1 1 1 6   9  15 o 267.6530 4.287597 873.2905       27.96547 873.5701       39.39766 873.0065       39.70239 267.6326 6.040812 267.5442 6.089549 0.8840942E-01  8.577530 
1 1 1 6   9  16 o 361.0454 5.483492 1589.754       48.24531 1585.587       67.95459 1593.990       68.50710 360.4074 7.737292 361.3575 7.779694 -0.9500427     10.97221 
1 1 1 6   9  17 o 294.0288 5.386277 1054.528       38.59355 1012.111       45.66303 1160.594       72.20774 287.9828 6.506719 307.9448 9.634062 -19.96198      11.62551 
1 1 1 6   9  18 o 251.9020 4.130974 773.7816       25.35830 816.4186       36.72511 734.9295       35.05711 258.6463 5.826674 245.3965 5.862349 13.24977       8.265426 
1 1 1 6   9  19 o 195.5557 3.504622 466.2966       16.70120 469.3302       23.43823 463.1676       23.80415 196.0611 4.909522 194.7597 5.019719 1.301346       7.021466 
1 1 1 6   9  20 o 205.7721 4.123682 516.5598       20.67796 519.4106       25.52723 511.1197       35.26369 206.2727 5.078389 204.3147 7.093349 1.957977       8.723853 
1 1 1 6   9  21 o 152.8255 3.525478 284.8983       13.12956 280.9757       16.05512 292.8181       22.81295 151.6631 4.348567 154.6460 6.065261 -2.982971      7.463071 
1 1 1 6   9  22 o 269.0965 5.124077 884.8737       33.60159 903.7961       60.01624 876.2341       40.55336 270.9660 9.101956 267.5964 6.218854 3.369568       11.02360 
1 1 1 6   9  23 f 103.7995 3.180508 131.5740       8.035539 132.9629       9.873075 128.8489       13.82989 104.2886 3.891723 102.4806 5.558651 1.807961       6.785582 
1 1 1 6   9  24 o 165.4782 3.279690 334.1715       13.22542 326.9679       18.14975 342.3268       19.31140 163.5023 4.559686 167.2757 4.742239 -3.773315      6.578721 
1 1 1 6   9  25 o 130.1213 3.026730 206.6138       9.597500 208.5370       13.21318 204.4659       13.96373 130.5725 4.157895 129.2554 4.439785 1.317108       6.082745 
1 1 1 6   9  26 o 128.5429 3.049845 201.6827       9.553487 209.2242       13.24297 193.4991       13.79529 130.7593 4.161307 125.6965 4.511039 5.062859       6.137259 
1 1 1 6   9  27 o 101.7405 2.986988 126.4730       7.397635 121.6510       9.925849 132.4982       11.09522 99.65768 4.095881 103.9736 4.388890 -4.315918      6.003216 
1 1 1 6   9  28 o 40.24325 4.696032 20.10349       4.518869 18.50731       6.187596 21.92785       6.615095 38.18537 6.903536 41.68042 6.742944 -3.495045      9.650187 
1 1 1 6   9  29 o 123.5772 3.616780 186.9002       10.88000 188.3828       12.85383 183.1537       20.43257 123.9606 4.261465 121.6161 6.922984 2.344521       8.129439 
1 1 1 6   9  30 o 109.0529 3.121987 145.4568       8.288146 149.1774       11.23857 141.0205       12.27189 110.2735 4.189813 107.1146 4.712933 3.158875       6.306051 
1 1 1 6   9  31 o 36.96373 4.943485 17.08093       4.341385 15.82314       5.553293 19.05788       6.962148 35.19536 6.719862 38.50231 7.689608 -3.306950      10.21208 
1 1 1 6   9  32 o 98.12220 3.226829 117.9409       7.705276 125.9205       10.42277 108.3239       11.44225 101.1984 4.235794 93.67003 5.031197 7.528366       6.576845 
1 1 1 6   9  33 o 34.31353 5.885782 14.97278       4.744488 19.76152       5.500556 1.056435       9.376885 39.53882 5.888175 22.92889 9.709293 16.60993       11.35522 
1 1 1 6   9  34 o 74.24242 4.383499 68.14166       7.895360 101.5293       15.09033 55.55698       9.264615 89.77876 6.951578 66.64825 5.760802 23.13050       9.028359 
1 1 1 6   9  35 o 72.42729 3.969172 64.83414       6.978707 68.41290       8.070750 54.22886       13.89340 74.26304 4.480536 64.27832 9.125868 9.984718       10.16645 
1 1 1 6   9  36 o 55.64555 3.816999 38.41300       5.144584 37.31886       6.731637 39.94939       7.976936 54.45368 5.133488 56.06692 5.928061 -1.613243      7.841850 
1 1 1 6   9  37 o 50.02593 4.059793 31.30284       4.906703 28.23313       6.247156 36.24595       7.927455 46.95854 5.567436 52.96257 6.263321 -6.004028      8.380068 
1 1 1 6   9  38 o 72.16013 3.445791 64.79682       6.041791 62.36883       7.890590 68.23766       9.393289 70.20178 4.638374 73.02574 5.314822 -2.823959      7.054208 
1 1 1 6   9  39 o 20.54591 7.042302 5.464715       4.249034 4.580428       5.836617 6.461802       6.197708 20.63577 8.046532 22.69547 8.421139 -2.059706      11.64741 
1 1 1 6   9  40 o 25.40212 6.802958 9.191130       4.295190 7.823414       4.957405 13.30924       8.602119 23.37737 7.598658 28.85812 10.01453 -5.480747      12.57101 
1 1 1 6   9  41 o 9.713915 4.721567 -5.304500      3.540237 1.042555       4.749638 -13.23899      5.310480 15.67951 6.779739 10.06036 5.042750 5.619147       8.449508 
1 1 1 6   9  42 o 60.06047 3.658293 46.94696       5.328913 50.40082       7.221167 42.81692       7.896471 60.70861 4.923353 54.47205 6.050679 6.236561       7.800649 
1 1 1 6   9  43 o 13.34315 5.978811 0.1566435      4.013628 3.881481       4.671836 -10.33941      7.842362 17.09608 7.013840 13.25964 6.559916 3.836431       9.603460 
1 1 1 6   9  44 o 13.41629 6.126579 -0.3649656E-02 4.458497 0.6133206      9.235755 -0.1911163     5.090991 16.89923 8.061392 13.93396 6.430201 2.965267       10.31181 
1 1 1 6   9  45 o 13.70093 5.934262 1.939636       3.651264 1.743734       4.860224 2.193447       5.532112 14.40667 6.506485 15.07281 6.860425 -0.6661463     9.455146 
1 1 1 6   9  46 f 12.26049 5.556300 0.8201523      3.580745 1.179725       4.918030 0.4145004      5.223655 13.48689 6.257446 13.26928 6.250413 0.2176085      8.844394 
1 1 1 6   9  47 o 7.936228 3.980403 -6.807655      3.332606 -5.885212      4.539246 -7.886236      4.908405 9.814391 4.878727 9.652944 4.839894 0.1614475      6.872158 
1 1 1 6   10 0  o 519.9324 6.788091 3297.134       86.00638 3422.395       139.4252 3220.191       109.2741 529.3085 10.80927 513.6613 8.729802 15.64722       13.89424 
1 1 1 6   10 1  o 343.3202 4.661077 1436.827       38.99614 1376.274       59.86583 1481.457       51.39585 335.8951 7.313734 348.5566 6.050881 -12.66150      9.492306 
1 1 1 6   10 2  o 275.5429 4.363864 925.4479       29.30195 924.5309       58.74345 925.7517       33.80825 275.1058 8.773628 275.5705 5.034472 -0.4646912     10.11546 
1 1 1 6   10 3  o 580.0311 8.405870 4104.852       118.8147 4028.105       165.8891 4185.692       170.2546 574.1987 11.85549 585.3120 11.93645 -11.11328      16.82354 
1 1 1 6   10 4  o 327.7589 4.995981 1309.520       39.90354 1333.015       56.99881 1286.936       55.88202 330.6108 7.074774 324.8471 7.059226 5.763763       9.994252 
1 1 1 6   10 5  o 648.7761 9.366186 5136.270       148.0791 5477.854       218.5969 4846.599       201.3015 669.4766 13.39900 629.7620 13.11700 39.71460       18.75070 
1 1 1 6   10 6  o 459.6672 7.829867 2577.094       87.70695 2689.832       156.9179 2525.872       105.7715 468.9234 13.74687 454.9652 9.540134 13.95819       16.73292 
1 1 1 6   10 7  o 216.3356 4.209132 570.4065       22.18996 610.8462       40.96368 553.6118       26.39861 223.6774 7.525921 213.1131 5.083172 10.56424       9.081747 
1 1 1 6   10 8  o 467.8723 7.981084 2669.967       90.99662 2496.018       151.3539 2768.436       113.8760 451.7100 13.76591 476.2970 9.811110 -24.58701      16.90438 
1 1 1 6   10 9  o 147.7236 3.417937 265.9441       12.30411 242.9200       21.68661 276.8737       14.94177 141.0095 6.327248 150.6675 4.073289 -9.657944      7.525008 
1 1 1 6   10 10 o 600.7215 8.711410 4402.783       127.5257 5071.153       282.6266 4231.917       142.8996 643.0594 18.05327 588.8302 9.958751 54.22925       20.61789 
1 1 1 6   10 11 o 405.5804 6.046491 2005.653       59.76080 2036.324       85.34663 1976.150       83.70631 408.5291 8.572890 402.4502 8.535126 6.078949       12.09722 
1 1 1 6   10 12 o 473.5131 8.015533 2735.466       92.49123 2643.145       155.4622 2786.048       115.0721 464.6715 13.74423 477.7103 9.884832 -13.03879      16.92967 
1 1 1 6   10 13 o 216.3547 3.684511 570.5177       19.42595 584.1434       27.85649 557.6183       27.10385 218.8898 5.222335 213.8629 5.200671 5.026932       7.370195 
1 1 1 6   10 14 o 313.2000 4.858411 1195.930       37.08105 1192.415       52.23609 1199.500       52.64740 312.6481 6.856125 313.5737 6.889713 -0.9256287     9.719804 
1 1 1 6   10 15 o 492.6176 8.335888 2962.745       100.0686 2998.817       173.2576 2944.688       122.5820 494.4243 14.39525 490.8636 10.24778 3.560608       17.67031 
1 1 1 6   10 16 o 127.2840 2.824600 197.4573       8.761264 185.2109       11.87090 212.1089       12.98444 123.1938 3.959342 131.8407 4.046241 -8.646904      5.661135 
1 1 1 6   10 17 o 200.4751 3.539888 489.9596       17.29363 474.6209       23.83761 507.0027       25.12707 197.1987 4.964414 203.8751 5.057567 -6.676392      7.086917 
1 1 1 6   10 18 o 56.02197 3.359367 38.40090       4.565122 35.90270       4.990958 51.19500       11.29471 54.12804 3.808078 64.31408 7.337770 -10.18604      8.267063 
1 1 1 6   10 19 o 148.0698 3.401827 267.3452       12.27481 270.4128       15.23536 261.6702       20.72213 148.8276 4.205028 146.2663 5.825373 2.561325       7.184513 
1 1 1 6   10 20 o 225.6338 3.841164 621.0673       21.12045 636.8182       30.00840 605.6062       29.73117 228.3433 5.392852 222.6686 5.479198 5.674667       7.687943 
1 1 1 6   10 21 o 350.6394 5.394230 1502.434       46.09208 1505.214       64.98158 1499.619       65.38843 350.4585 7.608825 349.7900 7.671097 0.6684875      10.80463 
1 1 1 6   10 22 o 114.4185 2.845277 159.6680       7.933357 156.3069       10.79145 163.6207       11.70281 113.0912 3.921683 115.6886 4.157863 -2.597412      5.715542 
1 1 1 6   10 23 o 142.9477 3.717462 249.6156       12.93871 245.5288       23.41188 251.4127       15.52503 141.3448 6.817149 143.3828 4.448619 -2.037964      8.140254 
1 1 1 6   10 24 o 111.9694 3.241982 153.1320       8.836666 150.3443       10.78105 158.8389       15.42532 110.8739 3.996747 113.7699 5.580821 -2.895966      6.864368 
1 1 1 6   10 25 f 154.7963 3.218268 292.4914       12.14001 288.0288       16.66320 297.5397       17.72289 153.4190 4.461745 155.9017 4.670221 -2.482666      6.458958 
1 1 1 6   10 26 o 87.89474 2.987544 94.40605       6.389716 98.29068       8.629891 89.69224       9.506409 89.58943 3.962674 85.49847 4.579409 4.090958       6.055887 
1 1 1 6   10 27 o 35.23264 4.759758 15.47337       3.982207 13.46148       5.326901 18.02209       5.995599 32.45757 6.944681 37.70860 6.773578 -5.251030      9.701029 
1 1 1 6   10 28 o 163.5675 3.357490 326.9166       13.38283 330.5904       18.56323 322.9408       19.31128 164.2065 4.643693 162.2392 4.890073 1.967361       6.743641 
1 1 1 6   10 29 o 74.22288 3.199204 67.44422       5.772910 63.13652       7.475064 73.81051       9.087315 71.66879 4.299822 77.42537 4.840547 -5.756584      6.474516 
1 1 1 6   10 30 o 54.20034 4.213430 36.21148       5.521428 37.15343       6.249825 32.86231       11.78484 54.82497 4.723950 50.32315 9.962589 4.501823       11.02583 
1 1 1 6   10 31 o 114.6861 3.131960 160.9598       8.744926 150.9171       11.54677 174.4681       13.39169 110.8367 4.283109 119.1050 4.622686 -8.268341      6.301924 
1 1 1 6   10 32 o 23.45425 6.976184 6.940506       4.280705 5.102443       4.849726 13.42344       9.107991 21.41032 7.513490 32.54504 10.27163 -11.13472      12.72631 
1 1 1 6   10 33 o 32.97294 5.409378 13.77721       4.195925 16.52665       5.265516 8.993934       6.945141 35.99294 6.228662 27.14993 9.003091 8.843008       10.94769 
1 1 1 6   10 34 o 56.70906 6.265090 40.58453       8.513791 31.58932       11.74469 50.54609       12.35946 48.56898 10.24587 62.61085 8.305178 -14.04187      13.18916 
1 1 1 6   10 35 o 87.32021 3.263271 93.80330       6.931693 86.48235       9.104844 103.8969       10.69083 83.47845 4.492259 91.39810 4.816974 -7.919655      6.586625 
1 1 1 6   10 36 o 36.38358 4.972302 16.81246       4.293355 18.11940       5.490247 14.75518       6.888299 37.38712 6.246269 32.99913 8.510573 4.387993       10.55679 
1 1 1 6   10 37 o 29.82261 5.834055 11.66839       4.087941 9.663218       5.181139 14.97531       6.653682 26.74857 7.595245 32.97729 8.289900 -6.228720      11.24323 
1 1 1 6   10 38 o 18.30214 6.889985 3.573688       4.179312 3.685326       5.740172 3.447746       6.096818 19.96153 7.919651 20.09544 8.097715 -0.1339054     11.32669 
1 1 1 6   10 39 o 70.89481 3.447742 63.04349       5.938560 67.46492       7.899508 57.29726       9.005553 72.63592 4.484722 66.01124 5.652661 6.624680       7.215630 
1 1 1 6   10 40 o 12.60086 5.673094 -1.081665      3.661658 1.627613       4.831365 -4.738203      5.612781 16.53208 6.983446 13.57193 6.418971 2.960146       9.485341 
1 1 1 6   10 41 o 30.30981 5.741187 12.91474       4.085336 9.601385       5.269239 17.90800       6.468528 24.77153 7.811996 33.84956 7.973934 -9.078024      11.16293 
1 1 1 6   10 42 f 9.885945 4.751619 -3.837843      3.344131 0.4910612      4.354323 -10.06281      5.221560 14.29217 6.326191 10.56031 5.246671 3.731860       8.218774 
1 1 1 6   10 43 o 12.96840 5.744924 0.4307081      3.598071 -0.9722644     4.877274 2.106005       5.329648 13.55814 6.269872 15.95430 7.033159 -2.396161      9.422134 
1 1 1 6   10 44 o 20.49886 6.562676 7.184806       3.706885 10.84634       5.114754 3.133738       5.379949 23.80526 7.716834 16.15374 7.095618 7.651514       10.48319 
1 1 1 6   10 45 o 16.70835 6.897260 4.979323       4.554511 14.45591       9.416475 2.085336       5.203681 21.17661 9.341401 14.68746 6.672750 6.489151       11.47987 
1 1 1 6   10 46 o 15.25915 6.208559 4.166752       3.623526 3.502278       4.904690 4.965257       5.376646 14.81666 6.626342 15.86410 7.025461 -1.047443      9.657407 
1 1 1 6   10 47 o 13.72273 5.964503 3.082714       3.715073 0.2316188      5.011671 6.560386       5.535044 12.50626 5.958145 16.19777 7.152798 -3.691509      9.309243 
1 1 1 6   11 0  o 246.6062 3.579783 741.1655       21.51279 713.7417       33.18542 761.0438       28.25356 241.9594 5.628190 249.8715 4.640025 -7.912170      7.294269 
1 1 1 6   11 1  o 269.9289 4.303955 888.0719       28.31087 910.2267       57.64349 881.0289       32.50080 273.0001 8.675672 268.8419 4.960907 4.158203       9.993892 
1 1 1 6   11 2  f 305.9597 4.240801 1140.957       31.61900 1144.730       49.90807 1138.428       40.86695 306.3944 6.684267 305.5883 5.487816 0.8061829      8.648442 
1 1 1 6   11 3  o 390.0992 5.831382 1855.248       55.43482 1764.581       75.83466 1959.293       81.23722 380.3434 8.181930 400.7714 8.318064 -20.42792      11.66765 
1 1 1 6   11 4  o 689.1861 9.932102 5796.618       166.8068 6072.608       242.9450 5550.469       229.4352 704.8226 14.14465 673.8670 13.97171 30.95563       19.88165 
1 1 1 6   11 5  o 479.8560 6.285108 2807.371       73.49533 2740.806       114.3790 2854.183       95.91740 473.9129 9.904022 483.7377 8.136757 -9.824799      12.81782 
1 1 1 6   11 6  o 147.8701 4.390581 266.7360       15.80364 243.8104       21.38131 294.3426       23.46288 141.2763 6.225823 155.2544 6.214119 -13.97806      8.796371 
1 1 1 6   11 7  o 532.9565 8.994240 3465.395       116.8133 3538.289       205.8907 3430.793       141.8545 537.5882 15.73325 530.1205 10.98076 7.467651       19.18625 
1 1 1 6   11 8  o 296.6501 5.364322 1072.761       38.77890 1167.570       71.86633 1033.817       46.05991 309.1743 9.550079 291.1834 6.491130 17.99091       11.54724 
1 1 1 6   11 9  o 149.8315 2.917843 273.5754       10.65372 249.7100       22.37647 280.5711       12.11497 142.9614 6.439512 151.7322 3.276488 -8.770813      7.225142 
1 1 1 6   11 10 o 543.0194 9.118720 3598.374       120.6661 0.000000       0.000000 3598.374       120.6661 ?        ?        543.0194 9.118720 0.000000       9.118720 
1 1 1 6   11 11 o 740.2684 10.63109 6692.084       191.7798 6825.409       387.9742 6648.974       220.6179 744.7585 21.39941 737.6043 12.27386 7.154175       24.66947 
1 1 1 6   11 12 o 538.1372 7.854620 3533.252       103.0040 3596.148       147.4578 3473.316       143.9452 542.5364 11.15328 533.2000 11.07824 9.336365       15.72015 
1 1 1 6   11 13 o 223.8675 3.767864 610.8552       20.55523 624.7458       29.41431 597.5975       28.73652 226.3594 5.332416 221.3867 5.326556 4.972672       7.537032 
1 1 1 6   11 14 o 432.2473 6.429895 2279.132       67.72863 2312.641       96.68282 2246.842       94.90735 435.1612 9.117234 428.9300 9.079823 6.231201       12.86729 
1 1 1 6   11 15 o 103.2923 2.686278 130.1183       6.755949 121.2257       9.127460 140.8937       10.04736 99.65154 3.765406 107.4386 3.843756 -7.787033      5.380776 
1 1 1 6   11 16 o 244.1658 4.586035 727.0110       27.28716 706.4290       44.94241 739.0286       34.34157 240.3805 7.682085 246.1177 5.725865 -5.737228      9.581229 
1 1 1 6   11 17 o 131.6272 2.891962 211.1921       9.276288 202.5242       12.65793 221.2479       13.63365 128.8092 4.037537 134.6304 4.160585 -5.821182      5.797600 
1 1 1 6   11 18 o 231.1024 5.455684 651.9345       30.72485 651.9345       30.72485 0.000000       0.000000 231.1024 5.455684 ?        ?        0.000000       5.455684 
1 1 1 6   11 19 o 98.32648 2.735357 117.9576       6.547846 116.4580       8.920096 119.7097       9.642097 97.64104 3.755879 98.97985 4.005777 -1.338806      5.491163 
1 1 1 6   11 20 o 277.2205 5.222067 938.7407       35.27800 925.5709       61.66402 945.1484       43.01231 274.3876 9.235291 277.9987 6.349126 -3.611053      11.20723 
1 1 1 6   11 21 o 406.6966 6.134155 2023.701       60.79409 1951.960       83.78134 2103.484       88.35230 398.6185 8.624894 413.7467 8.762887 -15.12823      12.29541 
1 1 1 6   11 22 o 88.90620 2.790251 96.50022       6.037725 99.83938       8.191574 92.52843       8.933906 90.36401 3.727944 86.94195 4.229421 3.422058       5.637869 
1 1 1 6   11 23 o 190.8438 4.171830 444.8832       19.40174 450.7834       34.97477 442.2604       23.31865 191.4273 7.512055 190.1059 5.037959 1.321442       9.044998 
1 1 1 6   11 24 o 106.0272 2.863727 137.2556       7.392425 139.0284       10.11424 135.2224       10.83151 106.6175 3.899426 105.1100 4.237409 1.507568       5.758573 
1 1 1 6   11 25 o 159.2921 3.660235 309.9355       14.20821 292.0500       16.97194 351.8348       25.97671 154.4630 4.513743 169.1903 6.311529 -14.72725      7.759464 
1 1 1 6   11 26 o 87.31896 3.259671 93.23586       6.923973 91.68516       10.03148 94.64683       9.568847 86.40956 4.782605 87.83858 4.485164 -1.429024      6.556676 
1 1 1 6   11 27 o 130.9000 3.103303 209.2515       9.899196 198.1778       13.20142 223.4769       14.96255 127.1910 4.265235 135.0247 4.553843 -7.833786      6.239368 
1 1 1 6   11 28 o 160.2845 3.327195 313.9513       12.99589 307.8333       17.71540 321.0804       19.12314 158.4399 4.593133 161.7553 4.856875 -3.315353      6.684767 
1 1 1 6   11 29 o 56.48782 3.464096 39.16222       4.745556 38.64980       6.109327 39.94174       7.535241 55.97341 4.517284 56.73875 5.519484 -0.7653351     7.132360 
1 1 1 6   11 30 o 123.2560 3.614711 186.0786       10.84547 188.8710       12.72729 178.6741       20.72474 124.0619 4.215925 119.8740 7.126772 4.187965       8.280394 
1 1 1 6   11 31 o 60.40269 3.791338 44.87611       5.552503 40.14420       6.381813 59.61617       11.26356 56.97827 4.636229 69.01914 6.784433 -12.04087      8.217247 
1 1 1 6   11 32 o 61.13748 3.520197 45.94473       5.222405 45.95884       6.702252 45.92291       8.332205 60.97033 4.543597 60.69673 5.699947 0.2735939      7.289285 
1 1 1 6   11 33 o 91.17503 3.674118 102.1927       8.146568 106.7612       9.530540 89.79958       15.69723 93.06546 4.213284 84.16972 7.739573 8.895737       8.812079 
1 1 1 6   11 34 o 54.71922 3.752686 36.99213       4.973716 28.92963       6.237799 51.06532       8.241240 47.97069 5.431495 63.92472 5.339105 -15.95403      7.616244 
1 1 1 6   11 35 o 74.01374 4.226611 67.96675       7.591568 76.17843       14.17220 64.66235       8.990171 76.85455 7.669435 71.86720 5.167857 4.987343       9.248079 
1 1 1 6   11 36 o 17.11416 6.493391 2.808192       3.728838 5.690238       4.633545 -2.488566      6.281566 21.58129 7.355131 16.43763 7.412788 5.143661       10.44258 
1 1 1 6   11 37 o 32.07847 5.484861 13.39336       4.133656 13.95984       5.297285 12.51132       6.610020 32.21595 6.951790 30.02017 8.596820 2.195776       11.05589 
1 1 1 6   11 38 o 72.62796 3.864356 66.26147       6.814765 57.80894       9.744589 74.35250       9.533932 66.36134 6.093741 76.05869 5.174651 -9.697350      7.994416 
1 1 1 6   11 39 f 53.97235 4.918150 37.87452       6.397600 63.66437       12.78014 29.25085       7.390217 66.91685 7.995278 46.11551 6.778286 20.80134       10.48187 
1 1 1 6   11 40 o 15.27603 6.206995 1.952034       3.615906 3.467015       4.729669 -0.1790125     5.609492 18.02130 7.176158 16.00250 7.126200 2.018799       10.11336 
1 1 1 6   11 41 o 10.75230 5.126328 -3.767483      3.724161 -2.695475      4.306084 -6.949190      7.418459 12.33635 5.767444 14.51084 7.000403 -2.174496      9.070230 
1 1 1 6   11 42 o 13.55192 6.003341 0.3551326      3.928919 -1.853833      4.623910 6.091619       7.451401 12.97984 6.037612 20.18123 8.604497 -7.201395      10.51143 
1 1 1 6   11 43 o 14.33702 6.044941 1.989701       3.609138 1.360744       4.937785 2.711155       5.288419 15.01755 6.686863 16.24329 7.087329 -1.225739      9.743940 
1 1 1 6   11 44 o 15.66962 6.281830 3.610610       3.648955 2.204391       4.991738 5.224357       5.347404 15.13852 6.733068 17.57303 7.380653 -2.434511      9.990408 
1 1 1 6   11 45 o 21.69286 7.653886 10.19218       5.037560 24.32379       10.60568 6.075030       5.724545 24.95570 10.43185 17.32251 7.466371 7.633188       12.82849 
1 1 1 6   11 46 o 11.03973 5.190364 -0.7654642     3.571952 -1.263563      5.056471 -0.2693183     5.046549 12.18304 5.852368 12.62445 6.004369 -0.4414158     8.384668 
1 1 1 6   11 47 o 18.32323 6.910118 7.872117       4.207911 5.711473       6.363177 9.551291       5.609579 15.38374 7.130655 18.26409 7.607040 -2.880351      10.42657 
1 1 1 6   12 0  o 266.2852 4.270071 864.2247       27.70883 828.9558       54.19861 876.7051       32.24077 260.5411 8.547990 268.1879 4.933216 -7.646790      9.869385 
1 1 1 6   12 1  o 763.9930 9.811965 7122.756       182.6760 6875.258       281.6653 7302.440       239.9949 749.7628 15.41606 773.1655 12.73777 -23.40265      19.99764 
1 1 1 6   12 2  f 753.2775 9.683328 6923.967       177.7525 7412.550       294.1275 6642.856       223.1031 778.5074 15.50375 737.4788 12.41424 41.02863       19.86151 
1 1 1 6   12 3  o 431.9149 6.404962 2274.466       67.41412 2195.707       92.97649 2361.769       97.88902 424.2397 8.993440 439.9815 9.129846 -15.74188      12.81546 
1 1 1 6   12 4  o 381.9390 6.588298 1778.644       61.32017 1781.688       75.42439 1772.709       105.3139 382.1994 8.098148 380.8780 11.35923 1.321411       13.95035 
1 1 1 6   12 5  o 232.9104 3.827300 661.1259       21.72288 697.1227       31.56388 628.7337       29.94185 239.1393 5.416306 227.1067 5.410191 12.03261       7.655490 
1 1 1 6   12 6  o 290.1024 4.033064 1025.707       28.51166 994.2520       44.39118 1047.795       37.19874 285.5629 6.379090 293.1835 5.206580 -7.620605      8.234152 
1 1 1 6   12 7  o 484.0249 8.183408 2857.790       96.52460 0.000000       0.000000 2857.790       96.52460 ?        ?        484.0249 8.183408 0.000000       8.183408 
1 1 1 6   12 8  o 333.8940 5.853739 1359.208       47.62972 0.000000       0.000000 1359.208       47.62972 ?        ?        333.8940 5.853739 0.000000       5.853739 
1 1 1 6   12 9  o 492.4156 8.320807 2958.228       99.84662 0.000000       0.000000 2958.228       99.84662 ?        ?        492.4156 8.320807 0.000000       8.320807 
1 1 1 6   12 10 o 514.3763 7.525926 3227.444       94.33591 3065.515       183.8707 3285.295       109.9031 500.2280 15.10101 518.8681 8.691942 -18.64011      17.42384 
1 1 1 6   12 11 o 242.4155 3.900605 716.2592       23.04244 735.6230       46.13736 709.8242       26.59704 245.4310 7.723750 241.3103 4.522944 4.120712       8.950605 
1 1 1 6   12 12 f 394.0049 5.269366 1892.780       50.59367 1854.898       79.25348 1918.836       65.72970 389.8459 8.342366 396.6194 6.800668 -6.773499      10.76309 
1 1 1 6   12 13 o 564.5784 8.226272 3890.958       113.1784 3946.846       161.6382 3837.202       158.5240 568.0874 11.67596 560.1522 11.61323 7.935242       16.46801 
1 1 1 6   12 14 o 298.3531 4.690640 1085.354       34.10349 1083.825       48.18017 1086.889       48.27921 298.0386 6.633759 298.4594 6.638024 -0.4207153     9.384568 
1 1 1 6   12 15 o 412.2074 6.174513 2073.346       62.02326 2172.943       90.40324 1984.776       85.25156 421.6753 8.797712 403.0201 8.680398 18.65521       12.35917 
1 1 1 6   12 16 o 271.9898 4.997900 902.4464       33.12656 870.4218       40.09450 971.3267       58.80183 267.0388 6.161328 281.7288 8.574906 -14.68994      10.55893 
1 1 1 6   12 17 o 323.6823 6.937972 1280.109       54.72523 1270.370       76.71192 1290.200       78.09289 321.8614 9.791816 324.3447 9.891825 -2.483307      13.91862 
1 1 1 6   12 18 o 138.1140 3.489746 232.7710       11.73599 239.3399       13.97164 217.0285       21.62890 140.0114 4.099357 133.0860 6.690536 6.925354       7.846528 
1 1 1 6   12 19 o 211.0846 3.677024 543.5265       18.91425 546.5424       26.61404 540.4487       26.88561 211.5509 5.162498 210.3606 5.244685 1.190308       7.359219 
1 1 1 6   12 20 o 111.2028 2.836016 150.8965       7.679027 155.7008       10.75725 145.9045       10.96530 112.8859 3.916371 109.2555 4.125936 3.630432       5.688700 
1 1 1 6   12 21 o 98.15469 2.767951 117.5905       6.614115 108.7804       8.846006 128.7601       9.960382 94.32436 3.856596 102.6234 3.990453 -8.299019      5.549509 
1 1 1 6   12 22 o 131.9595 2.954079 212.4236       9.499456 205.1095       12.93262 220.9940       13.99920 129.5320 4.102243 134.4401 4.278500 -4.908127      5.927391 
1 1 1 6   12 23 o 57.48771 3.993613 40.55849       5.559922 36.08548       10.97472 42.10290       6.448721 53.44503 8.727482 58.51516 4.558338 -5.070137      9.846187 
1 1 1 6   12 24 o 63.19722 2.947497 48.84193       4.526781 43.52573       5.801418 57.11695       7.237992 59.55050 4.021303 68.21491 4.377244 -8.664410      5.944000 
1 1 1 6   12 25 o 37.22450 4.487675 17.19259       3.988824 18.38387       4.834455 14.65224       7.059715 38.37993 5.311197 33.79078 8.563889 4.589153       10.07715 
1 1 1 6   12 26 o 58.01623 3.475770 41.26686       4.891486 44.50705       5.886223 34.03553       8.793467 60.19655 4.035949 52.09863 7.111703 8.097919       8.177115 
1 1 1 6   12 27 o 66.18591 3.110105 53.61956       5.002191 55.33273       6.500708 51.13270       7.832248 67.13979 3.991250 64.38728 5.031651 2.752510       6.422429 
1 1 1 6   12 28 o 29.64504 5.074806 11.08193       3.534379 8.095915       4.357701 16.82254       6.042129 25.20981 6.895604 36.30342 7.084185 -11.09361      9.886103 
1 1 1 6   12 29 o 81.05977 3.127791 80.42177       6.166852 85.03876       8.269531 74.63740       9.256114 83.22736 4.089882 77.82516 4.905551 5.402206       6.386827 
1 1 1 6   12 30 o 31.36932 6.335972 12.58349       4.676484 12.58349       4.676484 0.000000       0.000000 31.36932 6.335972 ?        ?        0.000000       6.335972 
1 1 1 6   12 31 o 98.76904 3.090775 119.4481       7.430010 114.7289       9.699736 126.1489       11.55812 96.60968 4.129583 101.1837 4.700335 -4.574036      6.256724 
1 1 1 6   12 32 o 167.2202 3.990582 343.2881       16.26152 325.8364       18.84566 394.1565       32.17483 162.5885 4.761608 177.3833 7.459988 -14.79480      8.850103 
1 1 1 6   12 33 o 84.62801 3.215990 87.91486       6.620244 84.32623       8.606074 93.11651       10.36121 82.64143 4.288043 86.67431 4.925786 -4.032883      6.530748 
1 1 1 6   12 34 o 89.91718 3.188401 99.36013       6.975316 102.1623       9.315085 95.78318       10.52442 90.88964 4.217177 87.75798 4.941209 3.131660       6.496163 
1 1 1 6   12 35 o 53.56299 4.895656 36.00785       6.319584 17.93635       10.96122 45.00564       7.734457 36.03169 11.25373 59.76293 5.367951 -23.73124      12.46841 
1 1 1 6   12 36 o 14.84867 6.074474 1.195449       3.491679 -1.625433      4.263430 6.941750       6.085004 13.70054 6.148696 23.85235 8.412389 -10.15181      10.41992 
1 1 1 6   12 37 o 53.59458 4.239924 36.19215       5.492433 29.69974       7.539955 43.53192       8.016915 47.34776 6.723638 58.04589 5.742791 -10.69813      8.842339 
1 1 1 6   12 38 o 83.27442 4.215660 87.78728       8.527038 84.20815       15.03777 89.48350       10.35225 77.85424 8.041804 83.34106 5.122037 -5.486824      9.534458 
1 1 1 6   12 39 o 17.50047 6.530781 3.564461       3.737734 6.949358       4.787345 -1.720425      5.981907 22.31815 7.476571 15.75911 7.157542 6.559039       10.35034 
1 1 1 6   12 40 o 30.88130 5.649723 13.20824       4.095035 11.98182       5.297700 15.02886       6.454707 28.08929 7.569663 30.87096 8.370995 -2.781664      11.28598 
1 1 1 6   12 41 o 10.59144 5.127366 -5.203820      4.066283 -5.203820      4.066283 0.000000       0.000000 10.59144 5.127366 ?        ?        0.000000       5.127366 
1 1 1 6   12 42 o 10.49543 4.930707 -2.209521      3.212803 0.2975166      4.145990 -5.977891      5.083053 13.68187 6.107413 11.58886 5.638523 2.093011       8.312246 
1 1 1 6   12 43 o 19.97201 6.605689 6.646725       3.739501 8.163012       5.171487 4.985059       5.413730 21.02593 7.711527 17.91261 7.467834 3.113317       10.73481 
1 1 1 6   12 44 o 18.61424 6.598544 6.134432       3.747725 7.575228       5.142986 4.503087       5.472517 19.50326 7.567783 16.78474 7.267507 2.718519       10.49228 
1 1 1 6   12 45 o 18.41512 6.658006 6.597342       3.835520 8.129497       5.406298 5.044673       5.442370 18.83209 7.612279 16.33147 7.156257 2.500620       10.44791 
1 1 1 6   12 46 f 12.00423 5.587034 0.2671015      3.968497 1.087792       6.413709 -0.2420244     5.051637 13.81840 6.625658 12.55255 5.980662 1.265852       8.925674 
1 1 1 6   13 0  o 189.2957 3.917669 436.7067       18.07193 473.7434       32.82975 420.6045       21.64686 196.9928 6.849241 185.7006 4.787490 11.29219       8.356565 
1 1 1 6   13 1  o 377.5356 5.688931 1737.556       52.33891 1751.391       104.3987 1732.912       60.48977 378.5867 11.32876 376.9986 6.584245 1.588104       13.10317 
1 1 1 6   13 2  o 179.6476 2.947662 393.2849       12.90432 385.5888       19.93007 398.8403       16.93296 177.8043 4.603582 180.9034 3.841051 -3.099075      5.995552 
1 1 1 6   13 3  o 463.3246 7.869106 2618.189       88.84783 2621.338       109.1936 2612.021       152.8372 463.4879 9.667687 462.1339 13.58617 1.354004       16.67477 
1 1 1 6   13 4  o 109.0987 2.977307 145.1546       7.908118 143.4383       12.82708 146.2069       10.04408 108.3700 4.869603 109.4646 3.770937 -1.094604      6.158977 
1 1 1 6   13 5  o 637.7652 13.09139 4970.063       203.4616 0.000000       0.000000 4970.063       203.4616 ?        ?        637.7652 13.09139 0.000000       13.09139 
1 1 1 6   13 6  o 351.9071 5.304061 1509.638       45.48546 1529.954       90.79164 1502.831       52.55673 353.8578 10.54060 351.0836 6.143016 2.774170       12.20004 
1 1 1 6   13 7  o 610.3922 8.847733 4546.083       131.6064 4127.122       247.9451 4710.420       155.2870 580.1233 17.55898 621.1758 10.25852 -41.05255      20.33605 
1 1 1 6   13 8  o 236.5918 4.558395 682.3036       26.28136 743.2322       48.84376 657.4753       31.17968 246.6892 8.136120 232.2261 5.509658 14.46315       9.826127 
1 1 1 6   13 9  o 293.1010 4.602877 1047.194       32.87628 937.2878       63.43374 1087.558       38.44224 276.9457 9.412852 298.6761 5.281680 -21.73041      10.79342 
1 1 1 6   13 10 o 464.7239 6.862820 2634.185       77.72016 2312.889       144.5927 2764.730       92.16666 434.5812 13.67036 476.0162 7.945405 -41.43500      15.81164 
1 1 1 6   13 11 o 376.9668 5.681551 1732.820       52.19226 1697.600       104.7416 1744.453       60.19817 372.4810 11.55326 378.1823 6.531996 -5.701355      13.27196 
1 1 1 6   13 12 o 311.5072 4.849777 1183.100       36.81510 1177.421       75.79539 1184.853       42.11694 310.2706 10.03779 311.7072 5.544647 -1.436615      11.46736 
1 1 1 6   13 13 o 251.4605 3.640375 770.7749       22.30755 775.9175       35.70063 767.4810       28.57216 252.2163 5.808536 250.8885 4.673326 1.327759       7.455137 
1 1 1 6   13 14 o 176.5788 3.283038 380.0663       14.12702 378.0588       19.87327 382.1169       20.08567 176.0154 4.637255 176.9568 4.661881 -0.9414063     6.575506 
1 1 1 6   13 15 o 497.6412 8.438623 3027.253       102.3350 3131.842       128.6460 2847.026       168.8742 505.7304 10.43857 480.8944 14.42676 24.83600       17.80717 
1 1 1 6   13 16 o 229.9987 3.877344 645.0887       21.73181 649.4553       30.87450 640.8009       30.59425 230.6790 5.492319 229.1378 5.479071 1.541183       7.757950 
1 1 1 6   13 17 o 140.5230 2.954726 240.7438       10.11814 242.1479       14.25839 239.3194       14.36059 140.8307 4.159234 140.0013 4.214041 0.8294067      5.920927 
1 1 1 6   13 18 o 486.4233 10.22023 2907.321       121.1466 3085.235       175.9935 2747.101       167.0133 498.7754 14.49494 470.5775 14.58170 28.19791       20.56038 
1 1 1 6   13 19 o 126.7557 2.900718 195.9283       8.960025 184.8659       12.19621 208.9000       13.20682 123.0092 4.074279 130.7630 4.149804 -7.753731      5.815550 
1 1 1 6   13 20 o 86.21067 2.752831 90.72884       5.775898 84.19563       7.786057 98.72375       8.613125 82.96691 3.861621 89.84769 3.943455 -6.880775      5.519325 
1 1 1 6   13 21 o 154.7756 3.136328 292.2577       11.82933 286.7619       16.39478 298.2258       17.08494 153.1565 4.397280 156.1789 4.493728 -3.022430      6.287262 
1 1 1 6   13 22 o 148.0859 3.084320 267.5659       11.13036 272.6043       15.64102 262.3970       15.84232 149.3150 4.303071 146.4735 4.443511 2.841568       6.185565 
1 1 1 6   13 23 o 136.7528 3.681346 228.5317       12.25699 236.0989       23.17382 225.5925       14.44251 138.5013 6.887670 135.7888 4.370274 2.712555       8.157162 
1 1 1 6   13 24 o 115.5386 4.269539 163.4201       12.00043 0.000000       0.000000 163.4201       12.00043 ?        ?        115.5386 4.269539 0.000000       4.269539 
1 1 1 6   13 25 o 83.54964 2.884768 85.30170       5.864616 80.80192       7.780286 91.22249       8.924617 81.20893 3.943264 86.26045 4.258793 -5.051521      5.804020 
1 1 1 6   13 26 o 131.1171 3.072706 209.9312       9.817849 214.7904       13.64282 204.7117       14.13958 132.4290 4.232948 129.2384 4.496462 3.190659       6.175437 
1 1 1 6   13 27 o 118.8750 3.357310 172.8244       9.715895 167.7977       11.78028 183.5172       17.18155 117.0187 4.137599 122.0588 5.792931 -5.040085      7.118832 
1 1 1 6   13 28 o 136.4241 3.149690 227.4251       10.47117 222.5882       14.14541 233.2886       15.57446 134.7283 4.314006 137.8629 4.642472 -3.134659      6.337444 
1 1 1 6   13 29 f 134.7516 3.530571 222.3027       11.58353 221.0583       14.01727 224.9826       20.57027 134.2215 4.291050 134.8740 6.275785 -0.6524353     7.602538 
1 1 1 6   13 30 o 125.3193 3.156478 192.1959       9.631876 194.8916       12.95867 188.8683       14.39776 125.9781 4.227124 123.8795 4.778312 2.098557       6.379721 
1 1 1 6   13 31 o 129.0995 3.669438 204.4238       11.53239 200.1816       13.45586 216.1624       22.38312 127.5854 4.334165 131.6256 7.003420 -4.040245      8.236072 
1 1 1 6   13 32 o 29.94144 5.557502 11.43829       3.905723 11.41732       4.794508 11.47965       6.734134 29.68954 6.776592 29.79320 8.720891 -0.1036625     11.04428 
1 1 1 6   13 33 o 26.55820 5.917583 9.116318       3.731785 11.45788       4.626967 4.758324       6.312287 29.70989 6.565875 22.28865 8.450367 7.421240       10.70137 
1 1 1 6   13 34 o 63.02932 3.435037 49.00008       5.256123 52.57224       6.818121 43.76743       8.252012 65.06680 4.324551 58.87988 5.827536 6.186920       7.256853 
1 1 1 6   13 35 o 20.45681 7.586422 4.433268       5.028710 13.90040       9.699777 0.9534439      5.880730 32.12484 10.63930 18.23226 7.703268 13.89258       13.13526 
1 1 1 6   13 36 o 53.19541 4.102654 35.44551       5.277265 39.66715       7.334198 30.91327       7.599215 55.72173 5.471707 48.62451 6.582104 7.097214       8.559420 
1 1 1 6   13 37 o 106.0389 4.081833 141.1751       10.52798 123.6936       17.73470 150.6882       13.08257 95.75563 7.664109 108.8119 4.946728 -13.05626      9.121880 
1 1 1 6   13 38 o 19.42246 6.566159 4.892852       3.692088 7.157210       4.526598 0.3924115      6.381561 22.79786 7.246973 17.76444 7.767522 5.033417       10.62323 
1 1 1 6   13 39 o 18.38840 6.439466 4.396644       3.561109 4.738173       4.525756 3.841444       5.770348 19.38697 7.195665 19.38160 7.853545 0.5367279E-02  10.65156 
1 1 1 6   13 40 o 39.92370 5.118915 21.61545       4.865734 25.09934       5.700093 12.25915       9.341183 42.62754 5.624358 26.39841 10.21116 16.22913       11.65767 
1 1 1 6   13 41 o 15.78747 6.177389 2.995512       3.449701 5.597142       4.365723 -1.329129      5.628705 19.35403 7.087456 14.65038 6.760971 4.703652       9.795037 
1 1 1 6   13 42 o 12.22846 5.482945 -0.1471362     3.381538 2.255029       4.499530 -3.264643      5.125892 15.50469 6.650244 12.71383 6.048161 2.790855       8.989216 
1 1 1 6   13 43 o 21.72546 6.598828 7.999412       3.800692 11.04007       5.146256 4.350912       5.637213 24.18654 7.731418 17.26158 7.424320 6.924961       10.71893 
1 1 1 6   13 44 o 34.12407 5.232790 17.87234       4.212811 20.84838       5.980418 14.94088       5.935464 33.34209 7.538010 26.28402 8.291451 7.058065       11.20579 
1 1 1 6   13 45 o 12.05400 5.615114 -0.1165370     4.022372 -5.990199      6.193505 4.168073       5.289781 11.66630 5.781946 15.49389 6.908612 -3.827590      9.008874 
1 1 1 6   13 46 o 15.62822 6.786933 5.198313       4.801756 1.490855       10.09259 6.283065       5.459211 14.63885 7.276586 16.25559 7.143782 -1.616745      10.19717 
1 1 1 6   14 0  o 256.9661 4.809507 804.8556       30.11705 788.3309       50.91952 813.7468       37.35071 254.0910 8.234415 258.3567 5.932572 -4.265625      10.14894 
1 1 1 6   14 1  o 580.5039 11.94348 4115.425       168.9555 0.000000       0.000000 4115.425       168.9555 ?        ?        580.5039 11.94348 0.000000       11.94348 
1 1 1 6   14 2  f 300.0531 6.640081 1097.783       48.55205 0.000000       0.000000 1097.783       48.55205 ?        ?        300.0531 6.640081 0.000000       6.640081 
1 1 1 6   14 3  o 414.2855 8.673588 2093.895       87.56582 2130.945       125.2168 2058.434       122.5014 417.4859 12.32140 410.3217 12.26502 7.164215       17.38527 
1 1 1 6   14 4  o 353.5035 5.379336 1523.390       46.34026 1588.153       67.21111 1464.707       63.97839 360.8474 7.643309 346.5426 7.576011 14.30475       10.76179 
1 1 1 6   14 5  o 863.3872 14.28635 9116.029       300.5821 9076.559       367.2988 9196.061       523.0170 860.7271 17.51128 863.6255 24.87752 -2.898376      30.42262 
1 1 1 6   14 6  o 587.5370 8.511145 4211.784       121.8595 4381.145       249.3586 4158.648       139.6740 597.7554 17.13615 583.6880 9.819709 14.06732       19.75030 
1 1 1 6   14 7  o 496.3636 7.290544 3005.107       88.18525 2930.097       174.6320 3030.782       102.1688 489.1347 14.66730 498.3933 8.412211 -9.258606      16.90843 
1 1 1 6   14 8  o 337.3611 5.179606 1387.525       42.58217 1456.167       89.23360 1367.284       48.45515 345.1315 10.62246 334.8618 5.937974 10.26971       12.16948 
1 1 1 6   14 9  o 122.2817 2.765706 182.2236       8.241447 182.9702       18.48558 182.0384       9.207117 122.3311 6.221405 122.1777 3.094891 0.1533966      6.948685 
1 1 1 6   14 10 o 215.1507 3.668526 564.2057       19.23404 565.2735       40.50035 563.8948       21.85601 215.0910 7.739431 215.0808 4.169971 0.1013184E-01  8.791328 
1 1 1 6   14 11 o 326.9570 5.039673 1303.455       40.15403 1275.344       81.07592 1312.591       46.22088 322.8832 10.31735 328.0641 5.781539 -5.180908      11.82683 
1 1 1 6   14 12 o 317.0203 4.913595 1225.511       37.95968 1400.825       84.50307 1181.191       42.48778 338.3433 10.26080 311.1989 5.602604 27.14441       11.69073 
1 1 1 6   14 13 o 640.2958 9.261809 5011.642       144.5149 4854.511       200.7576 5180.630       208.1951 629.1588 13.09410 649.9318 13.14518 -20.77307      18.55401 
1 1 1 6   14 14 o 170.7701 2.836237 355.4582       11.80295 329.3003       18.36605 373.8622       15.40533 164.2538 4.592940 175.1152 3.610032 -10.86145      5.841869 
1 1 1 6   14 15 o 300.6941 4.732880 1103.031       34.68060 1112.879       49.31771 1093.398       48.77827 301.8474 6.704700 299.1955 6.690142 2.651947       9.471590 
1 1 1 6   14 16 o 497.9247 7.341984 3031.524       89.08675 3066.859       126.9888 2997.281       125.0099 499.9273 10.42371 494.2387 10.37938 5.688599       14.71004 
1 1 1 6   14 17 o 454.7273 6.772758 2528.505       75.05035 2573.914       107.4462 2485.244       104.8749 457.9572 9.627869 450.0216 9.563176 7.935577       13.57020 
1 1 1 6   14 18 o 138.2108 4.758958 233.5190       16.00448 226.5421       22.51528 240.6446       22.75414 135.8903 6.820930 140.0847 6.684802 -4.194397      9.550479 
1 1 1 6   14 19 o 299.8668 5.431840 1099.173       39.69277 1082.410       66.53837 1108.435       49.45625 296.5340 9.219119 300.8644 6.745502 -4.330383      11.42339 
1 1 1 6   14 20 o 136.5088 2.989244 227.3065       9.943933 225.2726       13.89342 229.4427       14.23863 135.7581 4.204663 137.0033 4.270036 -1.245239      5.992695 
1 1 1 6   14 21 o 145.2704 3.075151 257.4721       10.88628 264.8973       15.41184 250.0782       15.37927 147.1956 4.301198 143.0019 4.418544 4.193741       6.166347 
1 1 1 6   14 22 o 63.10252 2.918585 48.68493       4.475868 49.38436       6.144151 47.89405       6.533436 63.46097 3.993249 62.45790 4.319179 1.003071       5.882291 
1 1 1 6   14 23 o 128.5097 3.316113 201.7459       10.37620 196.9399       16.28979 205.0272       13.46014 126.7148 5.286975 129.4411 4.273038 -2.726341      6.797864 
1 1 1 6   14 24 o 120.2839 3.639305 176.9057       10.65521 188.3736       20.91780 172.8874       12.38202 123.5595 6.975434 118.8284 4.282983 4.731102       8.185391 
1 1 1 6   14 25 o 20.76100 5.713071 5.452607       2.980959 5.333358       3.681745 5.679558       5.079160 20.90367 6.521188 22.42819 7.699162 -1.524517      10.08975 
1 1 1 6   14 26 o 146.4949 3.183852 262.1385       11.36610 255.3577       15.54581 269.9264       16.66016 144.3542 4.424466 148.3822 4.613061 -4.027954      6.391888 
1 1 1 6   14 27 o 140.3339 3.162533 240.6156       10.81518 244.8357       14.96106 235.9966       15.65229 141.3208 4.349481 138.6857 4.637900 2.635056       6.358310 
1 1 1 6   14 28 o 47.13283 3.891192 27.37611       4.429547 28.28928       5.206293 24.98223       8.429533 47.82549 4.520832 44.17514 8.129987 3.650341       9.302398 
1 1 1 6   14 29 o 161.4013 3.358045 318.6624       13.20777 314.2061       17.99680 323.8644       19.44429 159.9224 4.622808 162.2746 4.922751 -2.352188      6.753061 
1 1 1 6   14 30 o 49.31583 4.175855 30.05128       4.971300 27.21545       5.365064 47.27064       13.22034 46.81044 4.769796 60.62962 9.239529 -13.81918      10.39807 
1 1 1 6   14 31 o 67.41954 3.816045 55.93187       6.243937 60.11843       7.085380 41.37922       13.21009 69.83764 4.182460 56.25230 10.00332 13.58533       10.84248 
1 1 1 6   14 32 o 53.09600 3.557163 34.74785       4.576030 30.04992       5.756065 42.81650       7.543501 49.10065 4.874946 58.57629 5.343406 -9.475643      7.233055 
1 1 1 6   14 33 o 36.50430 4.596943 16.72249       3.998824 19.50933       5.008152 11.82059       6.642079 39.28053 5.372602 29.98437 8.627430 9.296167       10.16353 
1 1 1 6   14 34 f 87.49332 3.156685 94.21389       6.719390 94.45664       8.719592 93.85898       10.54338 87.30448 4.110024 86.67438 5.013142 0.6301041      6.482584 
1 1 1 6   14 35 o 9.001678 4.397773 -5.828052      3.183082 -5.432531      3.885959 -6.634592      5.549146 10.68042 5.130533 13.14974 6.266052 -2.469322      8.098505 
1 1 1 6   14 36 o 71.43739 4.345563 64.13486       7.529194 81.57872       14.14601 57.23996       8.893575 78.35591 7.499857 66.85847 5.507426 11.49744       9.304816 
1 1 1 6   14 37 o 19.97956 6.617079 5.164585       3.752040 4.507030       4.721860 6.290983       6.180068 19.77991 7.348321 22.66306 8.409140 -2.883152      11.16743 
1 1 1 6   14 38 o 65.73207 3.493309 54.40211       5.575555 54.15548       7.292813 54.74906       8.649751 64.78603 4.650248 64.37959 5.568077 0.4064484      7.254536 
1 1 1 6   14 39 o 37.12926 5.185027 18.53265       4.563647 20.62727       5.374914 13.12210       8.638530 38.70754 5.883184 27.99814 10.00823 10.70940       11.60933 
1 1 1 6   14 40 o 11.18559 5.192683 -2.041883      3.394110 2.779000       4.313735 -9.876806      5.499301 16.55279 6.759341 11.16556 5.518311 5.387226       8.725849 
1 1 1 6   14 41 o 18.81339 6.340819 5.344963       3.443007 2.253865       4.387635 10.29866       5.554424 15.67478 6.639752 24.30950 8.051040 -8.634717      10.43578 
1 1 1 6   14 42 o 17.44731 6.749699 4.591914       4.081913 7.319468       4.826782 -2.256758      7.648466 20.52065 7.461907 15.42291 7.351264 5.097733       10.47479 
1 1 1 6   14 43 o 13.53692 5.847766 1.573442       3.526969 4.094325       4.882514 -1.177444      5.100390 16.60592 7.017761 13.24649 6.219793 3.359439       9.377356 
1 1 1 6   14 44 o 15.75527 6.299740 4.119154       3.659976 4.493120       5.256231 3.767184       5.099312 16.27310 7.083549 15.70941 6.904004 0.5636930      9.891508 
1 1 1 6   14 45 o 14.20891 6.034125 3.151975       3.639318 2.889297       5.176136 3.408776       5.117903 14.48569 6.609694 14.79448 6.679641 -0.3087902     9.397108 
1 1 1 6   14 46 o 12.28984 5.830369 0.1192203      4.698782 4.165365       9.658279 -1.135390      5.378157 15.02005 7.402501 12.18495 5.898303 2.835093       9.465040 
1 1 1 6   15 0  o 641.4016 9.294362 5020.119       145.2733 5330.607       302.7595 4927.251       165.5798 659.1428 18.86815 635.2878 10.69549 23.85498       21.68872 
1 1 1 6   15 1  o 472.9396 6.983495 2727.649       80.48494 2931.963       167.9891 2666.777       91.69399 489.4893 14.09790 467.5671 8.047497 21.92221       16.23308 
1 1 1 6   15 2  o 368.8934 5.601260 1659.020       50.35269 1563.988       95.97297 1695.115       59.14696 357.7152 11.02285 372.8480 6.509752 -15.13281      12.80157 
1 1 1 6   15 3  o 233.5664 4.530366 664.9525       25.78575 738.3616       47.92890 635.0494       30.59008 245.8931 8.009304 228.2338 5.500023 17.65927       9.715925 
1 1 1 6   15 4  o 315.6856 5.633160 1215.001       43.33541 1155.141       71.83456 1249.251       54.33639 307.4861 9.598516 320.0533 6.966786 -12.56714      11.86034 
1 1 1 6   15 5  o 91.62990 2.709358 102.4053       6.043138 101.2591       8.468580 103.5946       8.626173 91.06872 3.824486 92.11347 3.851396 -1.044754      5.427701 
1 1 1 6   15 6  o 589.2408 7.648618 4235.650       109.8277 4304.960       175.6823 4191.185       140.7136 593.4933 12.14720 585.9047 9.855373 7.588684       15.64234 
1 1 1 6   15 7  o 322.4515 4.941184 1267.564       38.82680 1397.213       81.47513 1229.471       44.16410 338.1211 9.898844 317.5406 5.707344 20.58051       11.42632 
1 1 1 6   15 8  o 127.4858 3.160118 198.0767       9.817503 214.0048       19.80592 192.8883       11.30395 132.3253 6.158986 125.7454 3.692945 6.579918       7.181292 
1 1 1 6   15 9  o 390.0951 5.869982 1855.837       55.80118 1928.302       115.8925 1833.968       63.66718 396.8894 11.99634 387.7341 6.738226 9.155304       13.75921 
1 1 1 6   15 10 o 262.6326 5.799989 841.2631       37.12033 0.000000       0.000000 841.2631       37.12033 ?        ?        262.6326 5.799989 0.000000       5.799989 
1 1 1 6   15 11 o 632.5303 10.57355 4893.201       162.9815 5059.719       291.0343 4817.120       196.7218 640.4147 18.66855 627.0291 12.87445 13.38568       22.67744 
1 1 1 6   15 12 o 124.5859 3.105482 189.1944       9.428314 168.8781       18.54669 196.2743       10.94855 117.4524 6.505311 126.8388 3.545640 -9.386391      7.408822 
1 1 1 6   15 13 f 419.6837 5.601300 2149.234       57.28582 2229.173       93.34777 2100.941       72.55470 426.9307 8.972439 414.7478 7.178692 12.18286       11.49079 
1 1 1 6   15 14 o 454.0020 6.697527 2517.641       74.09832 2541.606       106.2542 2494.952       103.3863 455.5726 9.570893 451.4126 9.398387 4.160065       13.41386 
1 1 1 6   15 15 o 470.1994 6.214328 2700.610       71.20530 2732.112       113.7529 2680.314       91.30625 472.0267 9.889168 468.0419 8.005339 3.984833       12.72325 
1 1 1 6   15 16 o 180.1905 3.351709 395.9555       14.71751 397.7932       20.95203 394.1656       20.67807 180.4654 4.768443 179.6439 4.727583 0.8215179      6.714767 
1 1 1 6   15 17 o 83.74291 3.372831 85.67555       6.868934 84.06641       7.902989 90.64597       13.88962 82.91224 3.922562 85.81863 6.694528 -2.906395      7.759072 
1 1 1 6   15 18 f 249.4333 4.847230 759.9819       29.46350 799.0004       36.57351 687.8412       49.73042 255.6069 5.871620 236.5016 8.643371 19.10535       10.44910 
1 1 1 6   15 19 o 120.3100 2.856135 176.5384       8.373683 163.7763       11.49821 190.9507       12.21899 115.7485 4.082810 125.0000 4.016549 -9.251511      5.727303 
1 1 1 6   15 20 o 180.3604 3.817692 397.1371       16.77946 417.3608       28.38516 386.2741       20.80341 184.4742 6.323568 177.7101 4.808234 6.764084       7.943967 
1 1 1 6   15 21 o 96.94579 3.064813 114.7901       7.231412 110.8957       11.07009 117.6888       9.550808 95.11910 4.791241 98.08142 4.004344 -2.962318      6.244258 
1 1 1 6   15 22 o 57.37357 3.013146 40.27942       4.198007 40.65075       5.695567 39.83775       6.211712 57.53572 4.088862 56.90530 4.516448 0.6304245      6.092381 
1 1 1 6   15 23 o 61.59058 3.064027 46.41617       4.584343 52.72472       6.403742 39.78432       6.565776 65.55893 4.027796 56.82059 4.786270 8.738338       6.255519 
1 1 1 6   15 24 o 69.22412 3.812064 58.74257       6.405808 49.25715       12.71800 61.96698       7.415073 62.54548 8.569314 71.04693 4.303036 -8.501446      9.589018 
1 1 1 6   15 25 o 156.3044 3.245661 298.4154       12.36261 304.5733       17.42710 292.1773       17.54020 157.6584 4.540719 154.3894 4.667454 3.269028       6.511778 
1 1 1 6   15 26 o 117.4947 3.029940 168.7216       8.668136 172.0101       11.94711 165.0663       12.59579 118.4783 4.144358 116.0063 4.463945 2.472023       6.091183 
1 1 1 6   15 27 o 80.03239 3.311871 78.42441       6.445194 74.75729       7.716003 86.88919       11.72298 78.03733 4.071539 83.84954 5.772440 -5.812210      7.063887 
1 1 1 6   15 28 o 98.43716 3.056403 118.5397       7.322837 122.2311       9.892179 114.0643       10.89198 99.80580 4.075817 96.30384 4.654951 3.501961       6.187152 
1 1 1 6   15 29 o 118.2834 3.675467 171.5018       10.58145 178.4921       12.28325 151.3872       20.83636 120.5653 4.187110 109.9460 7.828103 10.61930       8.877561 
1 1 1 6   15 30 o 48.73934 3.707917 29.28027       4.370934 30.22811       5.540798 27.71857       7.112205 49.36551 4.661063 46.87892 6.392068 2.486595       7.911007 
1 1 1 6   15 31 o 74.16994 3.783874 67.69422       6.816528 66.78472       7.624873 71.31438       15.21224 73.56962 4.271393 74.69864 8.508376 -1.129021      9.520361 
1 1 1 6   15 32 o 25.39069 5.851750 8.332461       3.546414 4.357411       4.366709 16.03446       6.078335 19.94772 7.117306 35.08336 7.345566 -15.13564      10.22807 
1 1 1 6   15 33 o 27.24911 5.712263 9.603868       3.671657 8.100030       4.462505 12.75538       6.460077 24.94934 7.036779 30.98602 8.362692 -6.036676      10.92936 
1 1 1 6   15 34 o 13.70584 5.798846 0.3208729      3.340059 -2.533081      4.035389 6.529209       5.951818 12.68892 5.807356 23.49612 8.316813 -10.80720      10.14371 
1 1 1 6   15 35 o 23.43166 7.775537 7.030660       5.180109 -0.9016284     9.175488 10.74171       6.275935 20.78778 9.193175 28.12218 8.466345 -7.334404      12.49774 
1 1 1 6   15 36 o 29.09988 7.650440 11.72661       5.495853 10.93244       9.509124 12.12494       6.734552 28.50552 10.45655 29.31193 8.757798 -0.8064022     13.63959 
1 1 1 6   15 37 o 16.83694 6.372004 3.011095       3.585308 3.280748       4.458016 2.517292       6.032756 18.06940 7.036169 18.99269 7.897852 -0.9232883     10.57751 
1 1 1 6   15 38 o 19.25918 6.642730 4.895930       3.782364 3.486447       4.290376 9.812827       8.013293 17.86118 6.917163 25.74701 9.571303 -7.885826      11.80919 
1 1 1 6   15 39 o 24.64045 6.212521 8.726713       3.728891 10.33992       4.700709 5.988562       6.124168 26.28080 7.150922 21.07782 8.235590 5.202982       10.90691 
1 1 1 6   15 40 o 11.75634 5.321246 -0.8594447     3.272042 1.731585       4.296842 -4.435788      5.048156 15.38727 6.546390 12.44575 5.943287 2.941522       8.841826 
1 1 1 6   15 41 f 19.60850 6.334316 5.979496       3.448060 9.227961       4.625156 1.915350       5.173351 23.43467 7.308827 15.91105 6.974447 7.523624       10.10257 
1 1 1 6   15 42 o 15.39124 6.448448 2.798711       4.066503 4.336586       4.791688 -1.160140      7.687985 17.18778 7.082804 15.65064 7.434298 1.537140       10.26815 
1 1 1 6   15 43 o 12.39003 5.541905 0.5316119      3.432024 2.212668       4.838995 -1.169914      4.868368 14.89291 6.626216 12.85916 6.050056 2.033751       8.972732 
1 1 1 6   15 44 o 22.36059 6.866178 9.689261       4.100298 17.49521       6.808976 5.248027       5.135948 26.06102 8.915294 16.54962 7.101834 9.511400       11.39818 
1 1 1 6   15 45 o 15.20553 6.235532 4.252790       3.690492 -0.8960526     5.201235 9.473159       5.237238 12.42783 5.960940 19.46343 7.612679 -7.035602      9.668799 
1 1 1 6   16 0  o 610.0416 8.877316 4541.269       131.9706 4201.017       250.2213 4672.389       155.3313 585.2054 17.56595 618.6246 10.30376 -33.41913      20.36492 
1 1 1 6   16 1  o 547.1558 7.999508 3652.302       106.6622 3533.030       147.6726 3782.396       154.2270 537.8199 11.26748 556.4634 11.37333 -18.64349      16.00965 
1 1 1 6   16 2  o 301.5754 4.258021 1108.548       31.29246 1114.742       49.28753 1104.365       40.50293 302.3368 6.689751 300.9688 5.522413 1.367950       8.674665 
1 1 1 6   16 3  o 211.3983 4.191689 544.7108       21.59369 531.9024       36.04389 551.8816       26.96923 208.7076 7.097243 212.7645 5.201556 -4.056931      8.799264 
1 1 1 6   16 4  o 185.0929 3.966207 417.5724       17.88962 393.2592       30.48266 430.3461       22.09481 179.4246 6.984982 187.8253 4.831266 -8.400665      8.493004 
1 1 1 6   16 5  o 899.5386 14.93087 9908.871       327.2963 10375.08       584.6443 9696.068       394.9927 915.3300 26.23774 888.7335 18.23818 26.59650       31.95387 
1 1 1 6   16 6  o 239.5512 3.976883 699.4675       23.21546 661.9015       31.62785 743.3516       34.18419 232.9872 5.570594 246.9028 5.681502 -13.91562      7.956820 
1 1 1 6   16 7  o 212.7593 3.259883 551.6993       16.90155 540.1621       26.37859 559.7344       22.01393 210.4799 5.142863 214.2832 4.215734 -3.803375      6.649921 
1 1 1 6   16 8  o 333.6912 5.900851 1358.073       47.98390 1398.083       86.77251 1340.449       57.59050 338.0433 10.54643 331.4439 7.130250 6.599396       12.73058 
1 1 1 6   16 9  o 449.9077 7.685355 2470.941       84.26039 2324.212       142.0955 2550.517       104.6434 435.3142 13.41096 456.8841 9.398746 -21.56985      16.37651 
1 1 1 6   16 10 o 179.9636 3.327852 394.7743       14.59435 427.4201       31.96373 386.1759       16.40411 186.9968 7.026846 177.9827 3.782151 9.014130       7.980052 
1 1 1 6   16 11 o 436.3867 6.499422 2324.413       69.11659 2381.025       142.0165 2306.843       79.11876 440.2537 13.25239 434.6115 7.470370 5.642181       15.21290 
1 1 1 6   16 12 o 209.6868 3.626507 536.0765       18.53087 508.4904       38.03538 544.6624       21.21961 203.8507 7.670341 211.3397 4.120218 -7.488937      8.706913 
1 1 1 6   16 13 o 310.6144 4.851357 1177.141       36.72155 1204.689       76.56869 1168.912       41.84826 313.3855 10.03915 309.4633 5.549223 3.922241       11.47076 
1 1 1 6   16 14 o 108.6072 2.416045 143.7776       6.394398 154.1871       11.08083 138.5805       7.829598 112.3577 4.053643 106.5720 3.017851 5.785713       5.053657 
1 1 1 6   16 15 o 65.57200 2.378199 52.48125       3.793874 49.63073       6.734672 53.80638       4.591795 63.62574 4.370116 66.37109 2.845624 -2.745350      5.214930 
1 1 1 6   16 16 o 56.65880 2.472499 39.21102       3.405593 32.22573       5.844315 42.80247       4.190603 51.15737 4.741987 59.17494 2.915019 -8.017570      5.566307 
1 1 1 6   16 17 o 15.95515 5.309762 2.935576       2.415215 6.609891       4.065626 0.9317281      3.002421 23.05552 6.783649 13.94263 5.659383 9.112889       8.834394 
1 1 1 6   16 18 f 200.2998 3.583460 489.5892       17.49118 503.3419       25.15782 476.7210       24.33522 202.8722 5.092815 197.4355 5.062117 5.436661       7.180654 
1 1 1 6   16 19 o 356.7615 5.494875 1556.998       47.77184 1609.508       69.06628 1508.833       66.14737 361.9886 7.829518 350.5151 7.744078 11.47348       11.01236 
1 1 1 6   16 20 o 115.3701 3.196181 162.5435       8.977228 175.6363       14.90074 155.0835       11.24765 119.7254 5.119047 112.6060 4.105741 7.119347       6.562145 
1 1 1 6   16 21 o 82.10127 3.092230 82.37479       6.175625 80.51996       9.442993 83.76098       8.163384 80.99911 4.805624 82.70199 4.063026 -1.702881      6.293028 
1 1 1 6   16 22 o 56.35958 3.051682 38.88136       4.175612 35.99827       5.597621 42.49842       6.269796 54.09718 4.281002 58.79141 4.408365 -4.694233      6.144970 
1 1 1 6   16 23 o 121.0154 3.594091 179.0629       10.58728 198.5054       20.72641 172.1987       12.31518 126.8833 6.727262 118.5855 4.268569 8.297791       7.967229 
1 1 1 6   16 24 o 148.1470 3.807667 268.4675       13.73497 252.6741       24.82196 275.4371       16.48943 143.0125 7.145021 149.9401 4.518013 -6.927597      8.453625 
1 1 1 6   16 25 o 32.15619 4.477878 12.90212       3.413860 10.02597       4.415471 17.17656       5.382832 27.98109 6.585771 36.87946 6.209888 -8.898365      9.051800 
1 1 1 6   16 26 o 235.3721 4.619010 679.0137       26.49353 696.9529       33.20876 647.6064       43.94067 238.0862 5.723772 228.4423 7.905131 9.643967       9.759747 
1 1 1 6   16 27 o 22.64825 6.081220 6.537605       3.426699 6.229230       4.376860 7.025965       5.507997 22.57092 7.120066 24.29152 8.016210 -1.720600      10.72170 
1 1 1 6   16 28 o 44.34585 4.644529 24.40135       4.944791 27.10095       5.512873 13.29045       11.18416 46.71169 4.916662 33.39049 11.42596 13.32119       12.43890 
1 1 1 6   16 29 o 75.40054 3.190871 69.68005       5.849744 68.68317       7.757426 70.99419       8.906714 74.68320 4.280371 75.82233 4.845776 -1.139130      6.465533 
1 1 1 6   16 30 o 73.68716 3.217870 66.60460       5.764319 60.11364       7.499787 75.97396       9.010514 69.78265 4.433191 78.41454 4.737480 -8.631882      6.488213 
1 1 1 6   16 31 o 33.74768 5.577581 14.47400       4.426876 12.88531       4.774504 24.20740       11.81793 31.61247 6.417203 42.31659 11.26260 -10.70411      12.96251 
1 1 1 6   16 32 o 11.67433 5.264504 -1.563118      3.167897 -3.297707      3.893535 1.834120       5.448899 11.97013 5.558511 18.56450 7.590724 -6.594372      9.408301 
1 1 1 6   16 33 o 26.67510 6.191463 9.300772       3.947016 11.93280       5.117154 5.434766       6.201757 30.06754 7.098447 22.65350 8.420420 7.414045       11.01324 
1 1 1 6   16 34 o 37.33675 6.105777 18.09919       5.363539 23.40378       10.02670 15.97287       6.348141 40.77537 10.13471 34.44534 7.750678 6.330025       12.75874 
1 1 1 6   16 35 o 74.63783 3.283702 69.06589       5.957918 70.15088       7.882652 67.62015       9.099228 74.74371 4.346497 72.94358 5.152103 1.800133       6.740638 
1 1 1 6   16 36 o 48.67289 5.410679 30.76000       6.309305 40.28157       11.56904 26.72930       7.527198 52.90257 9.314002 44.30775 7.219724 8.594814       11.78453 
1 1 1 6   16 37 o 33.98465 5.542063 15.42018       4.431738 17.05764       5.172683 10.90097       8.593325 35.39882 6.223473 27.20812 9.946780 8.190702       11.73329 
1 1 1 6   16 38 o 52.67933 3.796381 35.50975       4.840871 33.90545       6.165573 38.08825       7.816536 50.54148 5.074572 52.55283 6.224239 -2.011349      8.030718 
1 1 1 6   16 39 o 15.74030 6.199445 2.685297       3.493950 1.618919       4.539367 4.235398       5.472930 15.78238 6.722024 18.88953 7.650537 -3.107151      10.18412 
1 1 1 6   16 40 o 25.10911 6.055096 9.431639       3.661663 6.014318       4.675492 14.85239       5.888630 19.77421 7.318477 29.71750 7.968556 -9.943289      10.81933 
1 1 1 6   16 41 o 15.18441 6.029756 2.874919       3.330293 3.687155       4.538393 1.927282       4.902099 16.79334 6.903816 15.54973 6.803289 1.243612       9.692648 
1 1 1 6   16 42 o 9.514634 4.679531 -5.765931      3.794147 -2.805710      4.509937 -12.93520      7.018526 11.86233 5.651558 11.50914 5.772960 0.3531885      8.078810 
1 1 1 6   16 43 o 13.59915 5.973869 1.700463       3.813915 4.390780       6.215940 0.7613577E-01  4.829941 16.59437 7.437669 13.33631 6.192243 3.258061       9.677954 
1 1 1 6   16 44 o 11.96994 5.510966 0.2005433      3.708516 0.1159345      5.201965 0.2879861      5.288370 13.15176 6.207987 13.29306 6.270008 -0.1412954     8.823383 
1 1 1 6   16 45 o 14.23902 6.071671 3.444806       3.711015 -0.5008139     5.312401 7.205201       5.186208 12.53814 6.016596 17.16973 7.243169 -4.631594      9.416099 
1 1 1 6   17 0  o 434.3250 5.806767 2300.156       61.45897 2321.177       97.25978 2286.182       79.29722 436.0656 9.152617 432.8954 7.516902 3.170197       11.84374 
1 1 1 6   17 1  o 534.1655 7.005271 3480.447       91.18784 3631.939       147.9267 3387.598       115.8085 545.2101 11.13388 526.8018 9.021048 18.40826       14.32978 
1 1 1 6   17 2  o 214.2659 3.777764 559.5709       19.72531 537.5215       38.61782 567.3542       22.94415 209.7621 7.567229 215.7390 4.364225 -5.976944      8.735526 
1 1 1 6   17 3  o 434.5051 6.483405 2302.675       68.64898 2386.864       99.36078 2225.782       94.95747 442.1495 9.221673 426.9782 9.126143 15.17126       12.97404 
1 1 1 6   17 4  o 476.6520 7.044642 2771.727       81.82697 2978.821       121.1145 2597.814       110.9889 493.8178 10.06453 461.1785 9.875851 32.63928       14.10061 
1 1 1 6   17 5  o 300.1563 4.756381 1098.407       34.79046 1173.439       50.76073 1031.937       47.77701 310.1458 6.716235 290.8441 6.740975 19.30173       9.515700 
1 1 1 6   17 6  o 539.3904 11.18120 3557.740       146.9697 3633.098       211.8131 3487.773       204.0947 543.8217 16.00047 532.8969 15.73361 10.92480       22.44017 
1 1 1 6   17 7  o 213.9819 5.235830 558.3865       27.30227 553.2722       39.57650 563.0308       37.71333 212.7594 7.645734 214.6659 7.219617 -1.906479      10.51571 
1 1 1 6   17 8  o 342.0415 5.269496 1426.879       43.92219 1394.130       87.91706 1437.771       50.70301 337.4122 10.70597 343.2906 6.060882 -5.878326      12.30253 
1 1 1 6   17 9  o 176.2253 3.293107 378.5555       14.14198 391.4674       30.29558 374.9581       15.99115 178.9373 6.960998 175.3750 3.741760 3.562378       7.902927 
1 1 1 6   17 10 o 161.9644 3.177176 319.7749       12.53998 311.9600       26.36096 322.0606       14.25636 159.6993 6.789130 162.5317 3.599438 -2.832367      7.684285 
1 1 1 6   17 11 o 198.2825 3.527932 479.3543       17.04672 492.8434       36.28241 475.5332       19.31082 200.6931 7.431531 197.4718 4.012911 3.221268       8.445775 
1 1 1 6   17 12 o 260.8525 4.244761 829.9726       26.98263 761.8280       53.29466 853.4610       31.28920 249.3218 8.785504 264.4739 4.854846 -15.15218      10.03766 
1 1 1 6   17 13 o 99.34699 2.641017 120.4012       6.388174 124.6547       15.28620 119.5012       7.031632 100.8186 6.252666 98.96165 2.918959 1.856987       6.900445 
1 1 1 6   17 14 o 212.4062 3.681150 550.3153       19.05403 622.1356       43.70972 533.4655       21.17150 225.2520 7.975524 209.0981 4.154948 16.15390       8.992918 
1 1 1 6   17 15 o 104.5962 2.859630 133.5030       7.282061 126.7133       10.30536 140.2744       10.29144 101.8119 4.162411 107.1468 3.948245 -5.334854      5.737099 
1 1 1 6   17 16 f 39.11030 3.539921 18.81440       3.337316 20.35663       5.268962 17.78117       4.312716 40.44438 5.487443 37.85745 4.781246 2.586926       7.278211 
1 1 1 6   17 17 o 276.3640 5.127932 933.5139       34.53503 1022.353       61.97927 893.5120       41.58961 288.2039 8.835351 270.1608 6.317226 18.04303       10.86144 
1 1 1 6   17 18 o 71.78724 2.921784 62.96505       5.100620 0.000000       0.000000 62.96505       5.100620 ?        ?        71.78724 2.921784 0.000000       2.921784 
1 1 1 6   17 19 o 197.2534 4.038700 475.1906       19.41342 480.4899       32.89116 472.3575       24.04933 197.8059 6.833710 196.4753 5.027081 1.330643       8.483581 
1 1 1 6   17 20 o 93.74395 2.839481 107.3115       6.479140 109.9423       9.317221 104.8482       9.015979 94.78147 4.043204 92.55929 4.006699 2.222183       5.692200 
1 1 1 6   17 21 o 168.6400 3.309760 347.1935       13.60170 348.8459       19.30807 345.5655       19.16416 168.8100 4.698152 168.0160 4.685191 0.7940521      6.635032 
1 1 1 6   17 22 o 114.1146 3.247936 159.1247       9.022828 158.3902       14.48159 159.5907       11.53552 113.5887 5.245892 114.1778 4.152822 -0.5891190     6.690688 
1 1 1 6   17 23 o 29.11256 6.157060 10.80030       4.231407 -3.424311      8.990616 14.84771       4.795765 20.19731 9.006221 34.29383 5.954489 -14.09652      10.79666 
1 1 1 6   17 24 o 213.4183 5.400830 559.2261       28.06591 584.4533       42.98019 540.4725       37.05751 217.1407 8.136919 209.1563 7.281689 7.984390       10.91936 
1 1 1 6   17 25 o 169.3973 3.792297 350.9836       15.65471 341.2040       19.27079 369.9608       26.84440 166.7734 4.746557 173.1995 6.371061 -6.426117      7.944823 
1 1 1 6   17 26 o 103.4336 2.985038 130.8088       7.516112 136.5448       10.50437 124.7913       10.75898 105.5201 4.092826 100.8198 4.389662 4.700294       6.001696 
1 1 1 6   17 27 o 38.42860 5.031087 18.44667       4.598390 16.96358       5.078264 25.20008       10.83664 36.65733 5.883858 43.86449 10.31265 -7.207161      11.87310 
1 1 1 6   17 28 o 61.56936 3.259919 46.50627       4.873679 45.52504       6.393704 47.86712       7.529613 60.75235 4.347439 62.18177 5.011466 -1.429417      6.634382 
1 1 1 6   17 29 o 91.46516 3.102828 102.4778       6.905900 110.3474       9.519143 93.73380       10.03402 94.72467 4.133763 87.15768 4.742117 7.566994       6.290920 
1 1 1 6   17 30 o 34.14339 4.783442 14.64307       3.870961 16.16755       5.005459 12.37468       6.105792 35.63861 5.974779 30.78708 8.049223 4.851540       10.02437 
1 1 1 6   17 31 o 31.06472 6.241809 12.45154       4.560991 15.60692       5.049515 -1.529447      10.62901 34.89144 6.164107 22.68199 9.967999 12.20945       11.71995 
1 1 1 6   17 32 o 22.99453 6.573959 6.833782       3.868402 4.594208       5.203865 9.599964       5.783406 20.94191 7.726252 27.13763 8.117629 -6.195721      11.20673 
1 1 1 6   17 33 o 41.79383 5.724025 22.34990       5.676739 22.73061       10.42277 22.18933       6.768781 40.25751 10.51233 41.17884 6.995284 -0.9213257     12.62708 
1 1 1 6   17 34 o 31.43416 5.260896 12.76560       3.887642 10.21996       4.925192 16.97331       6.332091 27.54565 7.242622 35.46782 7.557542 -7.922169      10.46767 
1 1 1 6   17 35 o 22.73160 6.403450 6.927896       3.697716 5.861479       4.681443 8.696862       6.029425 21.51602 7.391389 25.39108 8.387410 -3.875063      11.17950 
1 1 1 6   17 36 o 37.96939 7.569518 20.19777       6.757995 32.70904       10.54858 11.48773       8.801431 46.93546 9.548038 28.13986 10.09706 18.79560       13.89661 
1 1 1 6   17 37 o 14.39466 5.977997 1.215561       3.449854 2.526544       4.293593 -1.172559      5.794960 16.85921 6.794842 15.82392 7.129392 1.035295       9.848762 
1 1 1 6   17 38 o 33.69901 5.100549 15.35047       4.057759 18.18684       5.159362 10.75093       6.570101 36.01963 6.095055 25.94221 8.759167 10.07743       10.67111 
1 1 1 6   17 39 o 52.90269 3.821052 36.52925       4.892835 37.79895       6.515623 34.88741       7.409214 52.42082 5.167670 48.98311 6.356907 3.437714       8.192380 
1 1 1 6   17 40 o 11.85871 5.380512 -0.7126920     3.369705 -2.308423      4.559119 1.208634       5.002669 12.59252 5.902457 15.32929 6.783257 -2.736762      8.991751 
1 1 1 6   17 41 o 8.686076 4.268464 -5.155405      3.135631 -8.813670      4.346309 -1.184566      4.528185 9.426881 4.700285 12.92982 6.000822 -3.502942      7.622502 
1 1 1 6   17 42 o 11.69184 5.438899 -1.095006      3.753422 2.121669       5.760867 -3.467702      4.947723 15.50244 7.034286 11.94498 5.751085 3.557459       9.086042 
1 1 1 6   17 43 o 8.008731 4.015097 -7.473221      3.373919 -9.298018      4.571127 -5.289395      5.000633 9.244392 4.640031 10.96960 5.390577 -1.725204      7.112539 
1 1 1 6   17 44 f 32.15675 5.654647 17.29607       4.269435 18.41349       6.174457 16.27233       5.910008 27.68753 8.410963 25.92332 8.285147 1.764204       11.80627 
1 1 1 6   17 45 o 19.65058 6.777157 8.352065       3.936968 13.77665       5.881411 3.947989       5.299390 22.16915 8.207585 14.69995 6.699945 7.469197       10.59499 
1 1 1 6   18 0  o 167.6280 3.337024 342.4729       13.63144 360.4315       19.08259 323.7603       19.47907 171.8847 4.559822 162.8823 4.913093 9.002365       6.703018 
1 1 1 6   18 1  o 619.5994 10.41752 4691.319       157.2938 4715.121       193.1405 4644.439       271.0548 620.7153 12.76864 614.4255 18.12285 6.289795       22.16926 
1 1 1 6   18 2  o 498.7513 8.483041 3037.005       103.1031 3020.518       177.0762 3045.462       126.8169 496.1963 14.66044 499.1900 10.42498 -2.993744      17.98913 
1 1 1 6   18 3  o 573.9290 9.660261 4024.444       135.1086 4079.858       167.1164 3919.876       229.5670 577.4653 11.87564 564.6569 16.70191 12.80835       20.49353 
1 1 1 6   18 4  o 340.5421 6.027756 1414.608       50.02218 1414.699       61.36449 1414.426       86.35995 340.4564 7.396384 339.9806 10.43606 0.4758301      12.79132 
1 1 1 6   18 5  o 227.5177 4.521482 631.1503       25.06872 654.0397       30.88101 586.9165       42.92903 231.5699 5.472343 219.0910 8.054347 12.47893       9.737507 
1 1 1 6   18 6  f 312.4579 4.856364 1190.590       36.97761 1205.885       73.29672 1185.368       42.82709 313.9229 9.592580 311.7254 5.637807 2.197418       11.12665 
1 1 1 6   18 7  f 108.6817 2.826452 144.0627       7.479375 146.3566       10.18820 141.3813       11.01498 109.4993 3.823994 107.5987 4.209001 1.900574       5.686706 
1 1 1 6   18 8  o 193.7262 3.485345 457.5303       16.45395 459.5909       23.02212 455.3789       23.52484 194.0505 4.872345 193.1498 5.002209 0.9006653      6.982968 
1 1 1 6   18 9  o 156.7802 3.752337 299.7071       14.33604 280.4571       24.93013 309.2176       17.52317 151.3900 6.774745 159.1588 4.522585 -7.768738      8.145609 
1 1 1 6   18 10 f 207.8142 4.316463 526.7640       21.85946 521.4810       38.43836 529.2893       26.57514 206.3951 7.655660 208.1938 5.242242 -1.798737      9.278482 
1 1 1 6   18 11 o 305.1473 5.616788 1136.857       41.76704 1112.384       72.24960 1149.141       51.18695 301.0525 9.861510 306.6402 6.850056 -5.587677      12.00719 
1 1 1 6   18 12 o 137.2935 3.579870 230.0423       11.96693 214.0397       21.29036 237.4332       14.46886 132.1616 6.631801 139.4365 4.263163 -7.274918      7.883866 
1 1 1 6   18 13 o 285.2331 5.346820 993.6853       37.16479 973.6758       64.73474 1003.523       45.39050 281.4757 9.450977 286.4772 6.501879 -5.001465      11.47150 
1 1 1 6   18 14 o 136.9305 3.584268 228.8950       11.94987 224.4326       21.88156 230.7915       14.26493 135.2704 6.658494 137.4427 4.264202 -2.172256      7.906893 
1 1 1 6   18 15 o 72.37520 3.440345 64.04927       6.050381 69.08212       12.46152 62.49691       6.920869 74.79124 6.915586 71.44667 3.990910 3.344566       7.984529 
1 1 1 6   18 16 o 101.9920 2.420301 126.8356       6.015501 140.3852       10.69582 120.5668       7.275163 107.1536 4.103692 99.37546 3.007652 7.778152       5.087854 
1 1 1 6   18 17 o 212.9274 3.631921 553.3663       18.84534 531.2248       36.75763 561.2616       21.94961 207.9667 7.264152 214.3789 4.201542 -6.412201      8.391714 
1 1 1 6   18 18 o 116.3851 3.478875 165.4751       9.855633 154.2254       18.33543 170.0462       11.68765 111.9441 6.752703 117.9267 4.073159 -5.982567      7.886040 
1 1 1 6   18 19 o 48.81237 2.682815 29.15163       3.178949 28.79457       5.828898 29.30280       3.792632 48.25871 5.030252 48.89655 3.200517 -0.6378403     5.962109 
1 1 1 6   18 20 f 39.77881 3.679610 19.48969       3.526474 14.27860       5.188649 23.96332       4.807506 33.53596 6.584154 44.03694 4.545108 -10.50097      8.000568 
1 1 1 6   18 21 o 141.2300 3.085059 243.4756       10.61761 247.8074       15.26280 239.4135       14.77997 142.2780 4.407418 139.8550 4.341961 2.423050       6.186919 
1 1 1 6   18 22 o 58.07055 3.177751 41.29889       4.479747 46.71912       6.536502 36.49815       6.151637 61.64280 4.379908 54.40553 4.685535 7.237278       6.413878 
1 1 1 6   18 23 o 94.77695 5.083874 110.4225       11.69880 0.000000       0.000000 110.4225       11.69880 ?        ?        94.77695 5.083874 0.000000       5.083874 
1 1 1 6   18 24 o 100.3014 2.969839 122.9674       7.250993 126.6185       10.28094 119.3537       10.22817 101.6284 4.160071 98.64929 4.264763 2.979111       5.957717 
1 1 1 6   18 25 o 70.19823 3.065590 60.31734       5.231521 65.90487       7.415621 54.78115       7.381472 73.24671 4.171794 66.70015 4.568892 6.546562       6.186973 
1 1 1 6   18 26 o 132.6123 3.109270 214.9416       10.04797 209.1474       13.95813 221.1737       14.47598 130.5389 4.394105 134.2354 4.431395 -3.696442      6.240627 
1 1 1 6   18 27 o 35.24041 4.482456 15.48265       3.762412 20.10618       5.200541 10.40507       5.449922 40.04524 5.472195 28.43836 7.683647 11.60688       9.433098 
1 1 1 6   18 28 o 165.5165 3.393044 335.3912       13.68569 335.0454       19.08713 335.7571       19.63342 164.9893 4.752274 165.1177 4.884767 -0.1284637     6.815061 
1 1 1 6   18 29 o 78.01434 3.126507 74.63082       5.931840 79.36246       8.091160 69.13246       8.722104 80.26269 4.150868 74.75157 4.813707 5.511116       6.356216 
1 1 1 6   18 30 o 87.38307 3.120803 93.68628       6.634862 95.26205       9.005223 91.81516       9.812951 87.86624 4.218000 86.12981 4.693037 1.736427       6.310001 
1 1 1 6   18 31 o 60.54472 4.760327 45.65886       6.966977 50.74430       8.102634 31.23542       13.64570 63.69582 5.267148 47.41901 11.84446 16.27681       12.96280 
1 1 1 6   18 32 o 66.09914 4.246370 54.31894       6.803719 66.18369       13.58309 50.34508       7.860960 71.31569 7.950949 63.33117 5.137649 7.984516       9.466415 
1 1 1 6   18 33 o 19.74493 6.527508 4.823952       3.651639 5.748305       4.708514 3.428948       5.784327 21.67300 7.413740 20.13495 7.962239 1.538042       10.87937 
1 1 1 6   18 34 o 47.35076 3.926648 28.11851       4.490197 30.32727       5.952329 25.20184       6.840002 48.73273 5.087047 43.68459 6.633533 5.048141       8.359534 
1 1 1 6   18 35 o 38.28633 5.081395 19.00586       4.623976 22.43233       5.647436 12.03677       8.054088 41.30562 5.767597 28.90882 9.697746 12.39680       11.28324 
1 1 1 6   18 36 o 42.10414 5.856699 23.72836       5.846711 39.03071       10.95248 17.62974       6.914317 51.29602 9.094750 34.66715 8.295583 16.62887       12.30980 
1 1 1 6   18 37 o 20.75717 6.681769 6.047775       3.838912 6.793211       4.928044 4.897245       6.122349 21.87953 7.580614 20.43723 8.155864 1.442301       11.13480 
1 1 1 6   18 38 o 49.47649 3.958059 31.86680       4.732416 38.17617       6.483412 24.67173       6.923542 53.12836 5.069109 40.61842 7.261243 12.50995       8.855593 
1 1 1 6   18 39 o 9.325877 4.512540 -4.156387      3.140042 -3.318893      4.126904 -5.307835      4.839000 11.52845 5.467675 11.67335 5.637039 -0.1448994     7.853131 
1 1 1 6   18 40 o 18.76110 6.453263 5.491240       3.568852 9.913005       4.993531 0.8744417      5.102469 23.84516 7.615141 15.03497 6.738707 8.810191       10.16861 
1 1 1 6   18 41 o 8.902282 4.405364 -6.341495      3.545264 -7.852149      5.454930 -5.236773      4.664800 11.14326 5.505207 11.03957 5.378061 0.1036873      7.696157 
1 1 1 6   18 42 o 12.77400 5.653692 1.010924       3.477010 6.853849       5.091166 -4.096575      4.759992 18.67185 7.442009 11.32542 5.497923 7.346433       9.252603 
1 1 1 6   18 43 o 14.52309 6.405196 2.893604       4.425223 -0.2939202     5.276627 10.45033       8.124499 13.10725 6.206489 18.89247 8.482627 -5.785219      10.51073 
1 1 1 6   18 44 o 16.39725 6.533728 5.457859       3.923267 4.320620       5.771861 6.434539       5.348921 15.23858 6.963317 16.67988 7.203471 -1.441295      10.01887 
1 1 1 6   19 0  o 173.6581 3.338787 367.5847       14.12927 373.7419       19.90959 361.3374       20.05481 175.0130 4.672448 172.0758 4.787237 2.937210       6.689499 
1 1 1 6   19 1  o 448.1653 6.697039 2451.044       73.14037 2517.912       104.7532 2387.437       102.1674 453.8885 9.470702 441.9699 9.486012 11.91861       13.40443 
1 1 1 6   19 2  o 688.8193 11.55621 5808.781       193.9799 5139.449       307.7690 6249.912       249.8551 644.7617 19.61077 713.5712 14.36861 -68.80945      24.31130 
1 1 1 6   19 3  o 179.3584 3.846183 392.1855       16.81078 419.5599       21.32153 347.2099       27.32972 185.4263 4.722420 168.5358 6.667526 16.89044       8.170505 
1 1 1 6   19 4  o 148.3868 3.503331 268.4171       12.66813 278.3734       15.78497 250.4004       21.23412 151.0342 4.293120 143.1192 6.102365 7.915024       7.461215 
1 1 1 6   19 5  o 394.1268 5.960052 1895.592       57.24296 1981.221       83.01762 1817.978       79.03656 402.6170 8.461398 385.6808 8.409378 16.93613       11.92950 
1 1 1 6   19 6  f 385.1321 5.209964 1809.591       48.89680 1814.711       77.30973 1806.178       63.12709 385.3082 8.233601 384.6038 6.735442 0.7044067      10.63759 
1 1 1 6   19 7  o 189.3161 3.457995 436.9670       15.95321 431.4760       22.08294 442.9608       23.07202 188.0064 4.823998 190.4827 4.974690 -2.476227      6.929538 
1 1 1 6   19 8  o 41.74422 2.955555 21.34922       2.987131 13.32914       4.156419 29.91668       4.295917 32.61486 5.419725 49.40285 3.592911 -16.78799      6.502494 
1 1 1 6   19 9  o 237.2000 3.987289 686.2315       23.04775 768.9955       50.68716 664.6592       25.87769 250.5414 8.313505 233.4067 4.549631 17.13470       9.476999 
1 1 1 6   19 10 o 279.2210 5.254848 951.8026       35.75563 939.0851       62.33717 958.0381       43.64986 276.6322 9.260210 280.0031 6.397111 -3.370880      11.25498 
1 1 1 6   19 11 o 72.32850 3.568393 63.96117       6.270114 63.32164       12.13862 64.19391       7.322662 71.60677 7.047544 72.41523 4.167167 -0.8084564     8.187378 
1 1 1 6   19 12 o 220.5657 4.484639 593.8306       24.10469 618.7079       43.82078 583.0374       28.86390 224.5549 8.020836 218.4615 5.421805 6.093353       9.681415 
1 1 1 6   19 13 o 273.7371 5.204386 915.4775       34.71676 854.8591       58.90894 947.7338       42.97198 263.6120 9.184252 278.3368 6.335468 -14.72473      11.15745 
1 1 1 6   19 14 o 351.9066 5.420286 1513.800       46.48209 1699.649       102.2864 1465.432       52.18122 370.6995 11.33628 346.0693 6.187497 24.63013       12.91497 
1 1 1 6   19 15 o 131.7245 3.259637 211.6883       10.46337 0.000000       0.000000 211.6883       10.46337 ?        ?        131.7245 3.259637 0.000000       3.259637 
1 1 1 6   19 16 o 287.3993 4.121017 1008.652       28.86198 955.8980       44.88336 1045.845       37.68724 279.3000 6.594447 292.4406 5.288354 -13.14063      8.453012 
1 1 1 6   19 17 o 241.2677 3.609825 710.5746       21.22371 735.6486       34.79056 695.7122       26.78515 245.1239 5.824245 238.5923 4.606823 6.531601       7.425945 
1 1 1 6   19 18 o 226.0000 3.455714 623.5044       19.03191 632.0890       30.92752 618.2722       24.14489 227.2066 5.585835 224.9178 4.405198 2.288849       7.113882 
1 1 1 6   19 19 o 70.87392 2.468369 61.34264       4.256662 68.44427       7.683791 58.19818       5.112920 74.71367 4.237636 68.98908 3.048783 5.724586       5.220406 
1 1 1 6   19 20 o 29.51812 4.645108 10.91579       3.231055 8.244983       5.148475 12.65118       4.150062 25.70648 7.651798 31.67019 5.581185 -5.963715      9.470990 
1 1 1 6   19 21 o 164.2546 3.304528 329.4830       13.22705 349.8311       19.37318 311.7155       18.10309 168.9874 4.709058 159.5173 4.662031 9.470154       6.626444 
1 1 1 6   19 22 o 141.7769 3.521259 245.6142       12.16577 242.9262       15.48580 249.9478       19.66265 140.7981 4.519222 142.5897 5.670019 -1.791580      7.250688 
1 1 1 6   19 23 o 169.7535 3.994732 352.5317       16.52504 316.0015       28.94499 370.1958       20.12767 159.7540 7.455644 173.7439 4.758357 -13.98990      8.844692 
1 1 1 6   19 24 o 35.96671 4.464797 16.08797       3.829272 18.26826       5.634389 14.21650       5.220122 38.02422 6.301140 33.38218 6.650635 4.642044       9.161622 
1 1 1 6   19 25 o 92.17815 2.999395 103.9267       6.728514 115.2920       9.873990 94.07398       9.193521 96.92129 4.190490 87.50983 4.324503 9.411453       6.021755 
1 1 1 6   19 26 o 96.48488 3.003615 113.8983       7.053593 115.2374       10.04021 112.5934       9.911609 96.84942 4.264574 95.73075 4.259370 1.118668       6.027340 
1 1 1 6   19 27 o 101.9202 3.045170 127.1480       7.554758 137.3239       10.88588 117.6933       10.49303 105.7026 4.234690 97.80594 4.413877 7.896660       6.116773 
1 1 1 6   19 28 o 121.0870 3.115279 179.5679       9.184804 172.0579       12.66652 187.8953       13.33803 118.2234 4.404306 123.5422 4.437581 -5.318825      6.252203 
1 1 1 6   19 29 o 30.44502 5.240281 11.77472       3.747605 9.401099       5.126492 14.49909       5.492217 26.95718 7.520444 33.46728 6.961352 -6.510103      10.24780 
1 1 1 6   19 30 o 37.56676 4.936962 17.75916       4.410316 25.01581       6.549717 11.73950       5.965408 44.34003 6.233522 29.88231 8.023686 14.45773       10.16053 
1 1 1 6   19 31 o 51.97837 6.621366 34.60065       8.196867 36.27679       10.93752 32.45313       12.38034 52.27760 8.904385 48.53228 10.75138 3.745319       13.95995 
1 1 1 6   19 32 o 11.06574 5.132325 -2.688013      3.304064 -2.242662      4.149449 -3.459597      5.461742 13.09140 5.951938 14.63031 6.718271 -1.538909      8.975563 
1 1 1 6   19 33 o 60.48960 3.466413 45.43897       5.088325 46.42064       6.734331 44.13290       7.767766 60.71878 4.585183 58.78970 5.485301 1.929077       7.149295 
1 1 1 6   19 34 o 52.98973 3.998162 35.33568       5.124748 34.78986       6.141811 36.58668       9.298210 52.17259 4.887693 51.91446 7.572703 0.2581291      9.013067 
1 1 1 6   19 35 o 16.87716 6.440366 2.967501       3.681336 8.282896       4.891284 -3.977409      5.590985 24.35669 7.502922 14.16722 6.606364 10.18947       9.996894 
1 1 1 6   19 36 o 21.93294 7.698265 6.629237       5.091345 16.22709       9.216186 2.413560       6.107984 31.33094 10.37049 18.60727 7.855645 12.72367       13.00992 
1 1 1 6   19 37 o 14.97617 6.625025 0.3135857E-01  4.768543 -9.267612      8.866184 3.816009       5.656297 15.56097 7.542182 18.91970 7.734647 -3.358730      10.80321 
1 1 1 6   19 38 o 35.60610 4.947200 17.38316       4.176798 22.00342       5.642877 11.78430       6.211793 39.03004 6.135078 26.30883 8.502267 12.72122       10.48464 
1 1 1 6   19 39 o 23.19608 6.424707 8.387621       3.756194 8.425082       5.101931 8.343283       5.550493 22.25813 7.713123 21.98533 8.000705 0.2727985      11.11321 
1 1 1 6   19 40 o 11.40847 5.311761 -1.603642      3.592413 -2.511475      5.507763 -0.9314703     4.739282 13.38304 6.338230 13.35478 6.177488 0.2825928E-01  8.850679 
1 1 1 6   19 41 o 13.39757 5.814689 1.451534       3.520162 2.802809       4.974369 0.9602214E-01  4.982161 15.58605 6.835295 13.80829 6.368229 1.777762       9.342140 
1 1 1 6   19 42 o 13.06827 5.763135 1.440709       3.581876 -2.407807      4.975049 5.582530       5.161149 12.10859 5.813598 17.13168 7.226305 -5.023091      9.274557 
1 1 1 6   19 43 o 13.91363 6.277549 2.236238       4.511114 12.47172       5.643204 -15.88318      7.508335 22.47289 8.082386 10.68207 5.428060 11.79082       9.735954 
1 1 1 6   19 44 f 12.33253 5.739718 0.6022289      4.188039 -0.2160410     5.262699 2.015357       6.915935 12.64123 6.045251 14.24780 6.844256 -1.606563      9.131752 
1 1 1 6   20 0  o 215.8339 3.806825 567.9649       20.02251 526.6837       37.39207 584.5599       23.70787 207.5275 7.405674 218.9391 4.443582 -11.41158      8.636518 
1 1 1 6   20 1  o 116.9789 2.714004 166.7883       7.736670 172.1212       11.80018 162.7674       10.24625 118.7394 4.084178 115.4874 3.645341 3.251945       5.474398 
1 1 1 6   20 2  o 318.5300 4.481248 1237.414       34.78448 1232.921       54.43972 1240.514       45.21899 317.7332 7.031001 318.8259 5.820109 -1.092682      9.127357 
1 1 1 6   20 3  o 347.9871 6.215952 1478.278       52.71169 1455.548       63.53998 1528.450       94.40054 345.1454 7.554554 352.9654 10.98843 -7.820007      13.33480 
1 1 1 6   20 4  o 299.9513 5.529658 1097.986       40.41896 1131.325       49.96027 1034.824       68.76568 304.3545 6.736107 290.5542 9.725702 13.80026       11.83066 
1 1 1 6   20 5  o 132.7595 3.374727 215.0264       10.90908 210.8168       13.34578 223.5029       18.93789 131.4080 4.172892 135.1908 5.761628 -3.782867      7.114027 
1 1 1 6   20 6  o 271.2535 4.402887 897.5536       29.10375 864.5429       40.04595 934.5073       42.37017 266.0695 6.176286 276.6148 6.285627 -10.54535      8.812243 
1 1 1 6   20 7  o 328.3758 4.562829 1315.634       36.51248 1294.043       57.07407 1330.593       47.50564 325.3431 7.198818 330.0867 5.905830 -4.743622      9.311380 
1 1 1 6   20 8  o 290.7155 4.132295 1031.028       29.27491 1033.885       46.33555 1029.131       37.76777 290.8526 6.537404 290.3300 5.338182 0.5225830      8.440014 
1 1 1 6   20 9  o 269.5623 4.400589 886.7196       28.90720 831.9139       57.02332 905.6750       33.53568 260.3158 9.002643 272.3622 5.052707 -12.04642      10.32363 
1 1 1 6   20 10 o 96.07858 2.833159 112.6521       6.626116 124.9336       15.33898 109.8345       7.346973 100.8946 6.269658 94.84866 3.183148 6.045921       7.031433 
1 1 1 6   20 11 o 283.6350 4.576133 982.1942       31.62966 912.2946       62.09348 1006.687       36.75572 272.3286 9.370528 287.0580 5.254352 -14.72937      10.74314 
1 1 1 6   20 12 o 18.44460 5.507915 4.201828       2.664298 5.800777       8.108521 4.008304       2.820926 25.43983 9.592668 18.21469 5.711997 7.225132       11.16451 
1 1 1 6   20 13 o 182.9060 3.841883 408.3146       17.12412 0.000000       0.000000 408.3146       17.12412 ?        ?        182.9060 3.841883 0.000000       3.841883 
1 1 1 6   20 14 o 83.69218 2.999382 85.54860       6.107310 0.000000       0.000000 85.54860       6.107310 ?        ?        83.69218 2.999382 0.000000       2.999382 
1 1 1 6   20 15 o 171.3727 3.293723 358.3572       13.75513 374.3165       30.17737 354.1720       15.45386 174.5452 7.109635 170.3349 3.723037 4.210327       8.025455 
1 1 1 6   20 16 o 202.8838 3.637298 502.4922       17.98301 540.0959       40.49604 493.2554       20.07049 209.4395 7.948895 200.9588 4.098403 8.480682       8.943256 
1 1 1 6   20 17 o 125.4949 2.605766 192.1003       7.968885 207.8723       13.89674 184.3730       9.727041 130.3435 4.381323 122.8652 3.251604 7.478271       5.456090 
1 1 1 6   20 18 o 115.8055 2.573147 163.5928       7.261558 156.6238       12.16286 167.4526       9.051819 113.0996 4.421564 117.0857 3.175391 -3.986061      5.443651 
1 1 1 6   20 19 o 89.63502 2.503202 98.08833       5.462409 104.2052       9.489549 95.05721       6.680091 92.22504 4.233705 88.19008 3.113209 4.034966       5.255124 
1 1 1 6   20 20 o 65.85046 3.296068 53.08631       5.272398 50.84122       7.416381 55.38039       7.496866 64.26982 4.769304 67.11335 4.611932 -2.843529      6.634469 
1 1 1 6   20 21 o 172.4302 3.251062 363.1411       13.66075 370.6307       20.59188 357.2538       18.25668 173.8744 4.864646 170.8027 4.389863 3.071686       6.552533 
1 1 1 6   20 22 f 49.87647 3.215362 30.51423       3.887243 31.58017       10.81864 30.35621       4.165416 49.62077 9.288204 49.72044 3.459430 -0.9967041E-01 9.911528 
1 1 1 6   20 23 o 19.20265 5.781743 4.571424       2.926750 15.51522       9.852463 3.512243       3.065111 34.99488 10.62351 17.58211 5.982324 17.41276       12.19209 
1 1 1 6   20 24 o 23.96831 5.900284 7.352092       3.422749 11.15379       5.394603 4.790469       4.428209 29.44689 7.498678 20.70989 7.185337 8.736996       10.38553 
1 1 1 6   20 25 o 77.18430 3.092806 72.94065       5.805470 72.13176       8.636616 73.60741       7.841241 76.52068 4.653575 77.38411 4.173562 -0.8634262     6.250950 
1 1 1 6   20 26 o 48.37116 3.705168 28.82473       4.334230 28.96008       6.464669 28.71422       5.841628 48.14712 5.615132 48.05010 5.064991 0.9701920E-01  7.562000 
1 1 1 6   20 27 o 82.79066 3.106381 83.98739       6.256065 76.71021       8.773767 91.51413       8.922944 78.85160 4.585826 86.21764 4.260131 -7.366035      6.259275 
1 1 1 6   20 28 o 125.6322 3.516399 193.7092       10.75494 194.1522       17.77013 193.4531       13.51031 124.9842 5.850680 125.2839 4.432194 -0.2996902     7.339946 
1 1 1 6   20 29 o 102.5689 3.104361 129.0790       7.750399 114.8626       10.56790 145.6249       11.40087 96.37502 4.512275 108.6056 4.316339 -12.23059      6.244310 
1 1 1 6   20 30 o 95.51640 3.802670 112.5854       8.833521 120.1548       16.37063 109.4761       10.49206 97.27200 6.952072 93.91228 4.598591 3.359726       8.335366 
1 1 1 6   20 31 o 84.77984 3.868736 89.04381       7.971713 95.11086       9.182720 70.48468       16.06059 87.44933 4.322418 72.60041 9.290545 14.84892       10.24683 
1 1 1 6   20 32 o 42.45130 4.244615 22.65146       4.332201 22.83742       5.829676 22.42212       6.474201 42.06947 5.844039 41.35216 6.650123 0.7173080      8.853074 
1 1 1 6   20 33 o 13.91035 5.945099 0.2374888      3.572458 0.5007243      4.347749 -0.3096246     6.268028 15.43577 6.576644 17.54520 7.684230 -2.109433      10.11433 
1 1 1 6   20 34 o 16.27162 6.253073 2.609084       3.486646 1.154556       4.449058 4.924299       5.613099 16.01615 6.729821 20.87868 7.956166 -4.862535      10.42070 
1 1 1 6   20 35 o 55.93098 3.722503 39.60592       5.044810 42.96251       6.743899 35.34106       7.601769 57.52144 4.856438 51.14317 6.227701 6.378273       7.897420 
1 1 1 6   20 36 o 18.00625 7.016022 3.680007       4.434752 -0.5271852E-01 7.297836 5.865438       5.584054 17.90062 8.038218 21.00094 7.951225 -3.100327      11.30641 
1 1 1 6   20 37 o 14.35003 6.373534 -0.1942827E-01 4.457237 8.116587       8.072898 -3.587222      5.345933 22.96916 9.295755 13.41711 6.321002 9.552050       11.24127 
1 1 1 6   20 38 o 14.95730 5.966884 2.473763       3.275822 0.8259439      4.273489 4.821542       5.101014 14.44857 6.335994 18.64219 7.442882 -4.193618      9.774524 
1 1 1 6   20 39 o 22.67371 6.831213 8.403988       4.084725 9.848069       6.084859 7.219434       5.511023 22.98379 8.375041 20.51980 7.867645 2.463989       11.49092 
1 1 1 6   20 40 o 17.26266 6.499104 4.702857       3.718703 0.9186040      5.309009 8.347920       5.210457 14.82560 6.737253 21.06941 7.738362 -6.243804      10.26025 
1 1 1 6   20 41 o 8.351526 4.152860 -6.327706      3.299484 -4.903650      4.852254 -7.552497      4.499984 11.14061 5.439940 9.783123 4.862246 1.357491       7.296190 
1 1 1 6   20 42 o 11.22732 5.221519 -0.6313819     3.456040 -2.150667      4.992749 0.7663068      4.788785 12.07923 5.805833 13.37141 6.193738 -1.292179      8.489410 
1 1 1 6   20 43 o 21.49257 8.024331 11.96172       5.644141 11.96172       5.644141 0.000000       0.000000 21.49257 8.024331 ?        ?        0.000000       8.024331 
1 1 1 6   21 0  o 110.5040 3.048265 148.9775       8.200719 122.6881       14.41802 161.5498       9.970625 100.0706 5.939105 115.0500 3.560595 -14.97948      6.924652 
1 1 1 6   21 1  o 192.5693 4.246574 452.3084       19.92791 468.2616       34.18182 444.0943       24.52744 195.6150 7.182820 190.6853 5.283453 4.929749       8.916714 
1 1 1 6   21 2  o 272.7306 3.995792 907.1731       26.55663 874.2281       40.57650 931.8593       35.12424 267.5500 6.223485 276.3234 5.216189 -8.773407      8.120368 
1 1 1 6   21 3  o 145.8293 3.124694 259.2754       11.10422 248.0127       15.14670 272.3619       16.32715 142.5186 4.366394 149.3483 4.491256 -6.829666      6.263926 
1 1 1 6   21 4  o 314.9528 4.956260 1210.602       38.03957 1164.404       52.27076 1262.617       55.46323 308.6432 6.949699 321.3765 7.081985 -12.73328      9.922339 
1 1 1 6   21 5  o 299.7820 6.711267 1098.483       49.02824 1098.483       49.02824 0.000000       0.000000 299.7820 6.711267 ?        ?        0.000000       6.711267 
1 1 1 6   21 6  o 289.4510 4.637583 1022.498       32.71168 1015.733       45.85118 1029.511       46.68262 288.2621 6.527199 290.2000 6.601182 -1.937897      9.283316 
1 1 1 6   21 7  o 285.5005 4.580053 994.8635       31.86496 972.3996       44.29747 1018.952       45.87146 282.0223 6.445541 288.6827 6.520572 -6.660400      9.168580 
1 1 1 6   21 8  o 201.3020 3.206064 494.1929       15.72738 474.5663       24.25265 508.4361       20.66045 197.0670 5.054379 204.1194 4.153549 -7.052368      6.542073 
1 1 1 6   21 9  o 45.33154 3.653536 25.23253       4.001829 18.54452       8.836884 26.95794       4.488448 38.10788 9.538989 46.83456 3.970097 -8.726681      10.33218 
1 1 1 6   21 10 o 204.0639 3.657653 508.0878       18.18884 485.7230       37.06594 515.1814       20.87504 198.9129 7.661056 205.4410 4.169693 -6.528107      8.722277 
1 1 1 6   21 11 o 246.4738 4.717490 742.0301       28.33464 0.000000       0.000000 742.0301       28.33464 ?        ?        246.4738 4.717490 0.000000       4.717490 
1 1 1 6   21 12 o 143.1277 3.462363 249.9615       12.07626 0.000000       0.000000 249.9615       12.07626 ?        ?        143.1277 3.462363 0.000000       3.462363 
1 1 1 6   21 13 o 143.6516 3.069540 251.7368       10.74533 298.1504       25.31646 241.5381       11.86731 155.8456 6.681628 140.6887 3.461443 15.15692       7.525008 
1 1 1 6   21 14 o 215.7544 3.772624 568.2881       19.83533 650.3311       44.86629 548.3572       22.11379 229.8841 8.021232 211.8779 4.282935 18.00621       9.093057 
1 1 1 6   21 15 o 210.4687 3.714384 540.8411       19.05068 522.5839       39.44260 546.3961       21.75675 206.0063 7.871341 211.4838 4.221636 -5.477509      8.931978 
1 1 1 6   21 16 o 223.5645 3.860658 610.4641       21.03296 655.7930       45.94588 598.4467       23.65734 230.6050 8.189013 221.2754 4.387293 9.329681       9.290225 
1 1 1 6   21 17 o 261.8651 4.314790 838.2578       27.53426 817.0275       56.50801 844.8677       31.53059 256.9626 9.038175 262.7662 4.924096 -5.803558      10.29249 
1 1 1 6   21 18 o 56.42934 3.183648 38.99707       4.360147 46.89215       7.515490 34.99159       5.353117 61.68308 5.043831 53.34153 4.150829 8.341549       6.532198 
1 1 1 6   21 19 o 193.9854 4.062812 460.0820       19.20578 457.9280       24.45583 463.5482       31.02293 193.2515 5.197781 194.0707 6.569211 -0.8192139     8.376841 
1 1 1 6   21 20 o 103.6010 2.549128 130.9707       6.435643 144.8558       11.37294 124.4301       7.805584 108.7229 4.301039 100.8902 3.178797 7.832726       5.348241 
1 1 1 6   21 21 o 40.60676 3.506027 20.30080       3.435416 22.84414       10.06189 19.96519       3.655056 41.96919 9.984041 40.23408 3.771877 1.735111       10.67278 
1 1 1 6   21 22 o 110.6684 3.599936 149.9056       9.695633 153.0930       18.81319 148.7529       11.31383 111.1557 6.980602 110.1481 4.222810 1.007584       8.158488 
1 1 1 6   21 23 o 126.8943 3.108939 196.7623       9.613698 200.4892       14.08011 193.5075       13.15830 127.8058 4.527997 125.6022 4.305354 2.203598       6.248106 
1 1 1 6   21 24 o 166.8811 2.979717 340.3381       12.11764 341.7677       19.99127 339.5078       15.23556 166.7324 4.925618 166.5323 3.754254 0.2000885      6.193233 
1 1 1 6   21 25 o 99.85342 3.028399 122.0186       7.360542 135.7341       11.18028 111.5263       9.778704 105.0781 4.375781 95.26068 4.222914 9.817436       6.081156 
1 1 1 6   21 26 o 68.84472 3.261151 58.13921       5.455585 56.86459       8.093019 59.20087       7.386077 67.79120 4.932680 69.28374 4.397372 -1.492538      6.608193 
1 1 1 6   21 27 o 114.2014 3.479454 160.0282       9.671898 163.6451       16.43258 158.1111       11.96368 114.7419 5.896668 113.2944 4.341349 1.447525       7.322432 
1 1 1 6   21 28 o 127.6035 3.168697 199.5938       9.853247 207.7417       14.32943 192.2859       13.57069 129.6960 4.540846 124.7985 4.469494 4.897530       6.371473 
1 1 1 6   21 29 o 41.60095 4.993437 21.76292       4.961141 10.84161       9.526789 25.82669       5.811306 29.88173 10.52708 45.26423 5.373152 -15.38250      11.81906 
1 1 1 6   21 30 o 38.36008 4.468277 18.49059       4.098809 18.90638       5.792533 18.07362       5.800659 38.19991 6.452140 37.27176 6.629452 0.9281464      9.250932 
1 1 1 6   21 31 o 54.63975 4.409722 37.41695       5.821755 35.75765       6.569202 43.48915       12.56678 53.14479 5.136364 56.34505 9.489161 -3.200256      10.79011 
1 1 1 6   21 32 o 48.05416 4.201505 29.05854       4.870641 27.48844       6.008201 32.06837       8.318635 46.24054 5.435633 49.10955 7.161770 -2.869011      8.990943 
1 1 1 6   21 33 o 23.09056 6.356364 7.207281       3.689333 6.091474       4.726497 8.947248       5.902218 21.72741 7.428002 25.50896 8.291175 -3.781553      11.13188 
1 1 1 6   21 34 o 58.65941 3.989173 43.65556       5.668458 45.02031       7.007888 41.07290       9.640401 58.97475 4.921051 54.31939 7.481382 4.655361       8.954765 
1 1 1 6   21 35 o 22.75527 6.345231 7.299439       3.650378 1.035699       4.784452 16.02497       5.646915 15.99387 6.858768 33.35891 7.160642 -17.36504      9.915518 
1 1 1 6   21 36 o 19.37577 6.950017 5.171380       4.169602 3.281069       7.047628 6.189366       5.171868 19.40817 8.323688 20.88422 7.702904 -1.476042      11.34101 
1 1 1 6   21 37 o 14.55043 6.354660 0.7994234      4.260158 0.2247016      7.972103 1.029145       5.040162 17.69863 8.123344 15.60606 6.861036 2.092564       10.63309 
1 1 1 6   21 38 o 20.72704 6.723302 6.812024       3.882141 8.818515       6.054329 5.410985       5.059093 22.28547 8.312701 18.94529 7.460443 3.340178       11.16957 
1 1 1 6   21 39 o 13.53869 5.728000 1.561384       3.258826 -0.1719004     4.359732 3.756055       4.905797 13.38230 6.090701 16.85569 7.073713 -3.473388      9.334562 
1 1 1 6   21 40 o 9.731183 4.663808 -2.893994      3.169886 -2.894642      4.381071 -2.893282      4.592166 11.54599 5.519916 11.81108 5.647922 -0.2650881     7.897372 
1 1 1 6   21 41 o 13.82667 5.826093 2.427830       3.349156 4.707641       5.030508 0.6127977      4.488536 16.43115 7.039340 13.24621 6.085517 3.184941       9.305151 
1 1 1 6   21 42 o 19.77061 6.961512 8.087290       4.165793 7.398177       5.203798 9.316896       6.951175 18.05794 7.404750 18.53760 8.106154 -0.4796619     10.97907 
1 1 1 6   22 0  o 400.3256 6.083007 1957.927       59.34277 1838.200       80.33155 2101.748       88.04446 387.3970 8.509299 414.1833 8.723151 -26.78622      12.18612 
1 1 1 6   22 1  o 126.3295 2.764031 194.5638       8.509103 204.3978       13.07499 187.3387       11.20716 129.3703 4.152731 123.8778 3.716700 5.492477       5.573064 
1 1 1 6   22 2  o 98.32068 2.725510 117.9441       6.523935 125.6420       9.830007 111.8843       8.721598 101.4066 3.985640 95.70098 3.747000 5.705635       5.470405 
1 1 1 6   22 3  o 301.0955 4.804256 1106.659       35.25060 1036.546       47.69444 1191.067       52.33135 291.1453 6.722363 312.0658 6.881445 -20.92053      9.620003 
1 1 1 6   22 4  o 152.4980 3.165899 283.5948       11.76515 266.9397       15.94100 303.5207       17.43622 147.8270 4.430125 157.6295 4.543936 -9.802460      6.346129 
1 1 1 6   22 5  f 150.9797 3.573945 278.0556       13.14929 269.0850       15.94992 297.0879       23.23233 148.4151 4.414966 155.7719 6.132210 -7.356720      7.556184 
1 1 1 6   22 6  o 215.1122 3.368451 564.4105       17.65759 577.1870       28.02316 555.9976       22.73973 217.3651 5.290433 213.4259 4.372222 3.939209       6.863308 
1 1 1 6   22 7  o 233.6512 3.545744 666.0112       20.18884 628.2733       30.80173 694.4346       26.73159 226.7280 5.574860 238.4838 4.599703 -11.75586      7.227470 
1 1 1 6   22 8  o 285.1230 5.256965 993.4059       36.52611 924.7910       59.27902 1035.401       46.37581 274.2264 8.882372 290.8567 6.542992 -16.63028      11.03210 
1 1 1 6   22 9  f 88.99979 3.857683 96.85268       8.346781 87.57768       9.907437 119.5347       15.49334 84.53389 4.829535 98.60783 6.483564 -14.07394      8.084616 
1 1 1 6   22 10 o 247.8683 4.844120 750.6600       29.25985 783.8162       53.02971 736.1477       35.08371 252.3857 8.634922 245.3030 5.869034 7.082718       10.44066 
1 1 1 6   22 11 o 149.6374 4.826934 273.8987       17.57839 298.1511       25.37229 251.5121       24.37678 155.8530 6.696112 143.0679 7.013315 12.78508       9.696624 
1 1 1 6   22 12 o 146.5202 3.674356 262.2090       13.10908 270.7395       24.23574 258.6811       15.58586 148.4725 6.715837 145.4541 4.402188 3.018311       8.030051 
1 1 1 6   22 13 o 338.0298 6.120950 1399.660       50.42082 1551.454       94.60996 1339.446       59.58802 353.6486 10.99149 330.2740 7.403695 23.37466       13.25245 
1 1 1 6   22 14 o 226.9326 4.561576 629.4955       25.22597 649.5982       46.13917 620.9243       30.12759 229.5475 8.261711 225.2208 5.489336 4.326675       9.919106 
1 1 1 6   22 15 o 93.22058 3.300262 106.2077       7.485325 99.26665       14.66046 108.6552       8.705579 89.67244 6.758667 94.24374 3.798392 -4.571304      7.752893 
1 1 1 6   22 16 o 118.5438 3.403865 171.7194       9.822849 183.7069       19.29806 167.5275       11.41180 122.1579 6.506169 117.0212 4.007699 5.136696       7.641458 
1 1 1 6   22 17 o 221.9333 5.368508 603.4974       29.03435 669.4608       46.25604 560.6119       37.29691 232.7601 8.167656 213.3161 7.185109 19.44394       10.87825 
1 1 1 6   22 18 o 70.78583 3.345844 61.33120       5.755157 59.92868       12.24745 61.72865       6.519827 69.36266 7.357855 70.97047 3.783508 -1.607803      8.273630 
1 1 1 6   22 19 o 74.36976 2.598179 67.57641       4.701473 63.80102       8.583238 69.19467       5.619459 71.99787 4.921699 75.21529 3.072326 -3.217422      5.801922 
1 1 1 6   22 20 o 69.37251 2.882502 58.85957       4.862347 63.29397       12.73403 58.10268       5.260976 71.21508 7.447657 68.89981 3.141641 2.315269       8.083162 
1 1 1 6   22 21 o 69.36186 3.789992 59.02020       6.381779 51.87524       12.52137 61.52752       7.417488 64.18267 8.192153 70.75344 4.322658 -6.570770      9.262653 
1 1 1 6   22 22 o 61.62135 2.831852 46.47396       4.241068 33.22703       7.660565 52.32855       5.092742 51.56532 6.221931 65.35630 3.207426 -13.79099      7.000000 
1 1 1 6   22 23 o 42.86625 3.240423 22.59393       3.359889 30.10503       6.890776 20.25122       3.848356 49.08890 5.877013 40.47418 3.952057 8.614716       7.082234 
1 1 1 6   22 24 o 190.3009 3.186052 442.9168       14.77508 484.2981       25.33542 421.5899       18.18821 198.2883 5.247796 185.4555 4.024519 12.83275       6.613328 
1 1 1 6   22 25 f 41.57837 3.324800 21.29440       3.340705 18.69470       6.337985 22.29453       3.931129 38.19964 7.068858 42.47512 3.839341 -4.275478      8.044209 
1 1 1 6   22 26 o 57.17509 3.057493 40.12738       4.244496 45.46971       9.744808 38.87655       4.715283 60.05723 6.776628 56.21574 3.458769 3.841492       7.608270 
1 1 1 6   22 27 o 100.3973 3.105425 123.6208       7.588511 124.1050       11.22951 123.2139       10.29485 100.2022 4.611195 99.95205 4.236217 0.2501450      6.261681 
1 1 1 6   22 28 o 21.47598 6.853622 5.724747       4.045321 0.9605029      8.617410 7.071406       4.581510 21.79129 9.270840 23.59722 7.260103 -1.805927      11.77529 
1 1 1 6   22 29 o 61.12326 3.465225 46.14402       5.140335 48.91483       7.650670 43.86392       6.940210 62.46839 5.069301 59.20502 4.852917 3.263371       7.017736 
1 1 1 6   22 30 o 75.55877 3.279500 70.50867       6.024112 69.96764       8.680897 71.01125       8.366559 74.70264 4.793921 75.35275 4.577891 -0.6501083     6.628633 
1 1 1 6   22 31 o 17.11132 7.128251 1.354941       4.927007 1.354941       4.927007 0.000000       0.000000 17.11132 7.128251 ?        ?        0.000000       7.128251 
1 1 1 6   22 32 o 27.24737 5.867544 9.900833       3.780700 10.74248       5.045192 8.822878       5.709691 27.91987 7.325189 25.42768 8.145274 2.492191       10.95463 
1 1 1 6   22 33 o 53.06929 3.764955 35.53072       4.837380 41.51883       6.732500 29.14008       6.955108 56.72412 4.919066 46.64162 6.278506 10.08250       7.976017 
1 1 1 6   22 34 o 25.07284 6.209522 8.765059       3.773978 4.847698       4.944710 14.23124       5.840984 19.89010 7.492958 31.17583 7.727434 -11.28573      10.76372 
1 1 1 6   22 35 o 17.09085 6.583865 3.356968       3.871883 3.430890       4.850152 3.227087       6.428940 18.00255 7.233638 19.10894 8.062999 -1.106382      10.83224 
1 1 1 6   22 36 o 21.59571 7.124284 7.092463       4.350607 3.240616       7.159428 9.347573       5.478073 19.04063 8.277902 24.07279 7.996284 -5.032160      11.50931 
1 1 1 6   22 37 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 6   22 38 o 13.40421 5.767571 1.145564       3.404641 4.566016       5.052497 -1.699445      4.607933 17.85287 7.305701 12.86558 5.998768 4.987284       9.452962 
1 1 1 6   22 39 o 15.76555 6.168376 3.586697       3.439440 4.405868       4.972290 2.835133       4.762684 17.11420 7.147590 15.71078 6.791144 1.403428       9.859395 
1 1 1 6   22 40 o 23.43533 6.314883 9.410666       3.687143 8.728395       5.183845 10.10927       5.245518 20.53355 7.685333 21.99917 7.805745 -1.465620      10.95418 
1 1 1 6   22 41 o 14.24582 6.137347 2.758961       3.864434 4.283516       5.033645 0.5705673      6.030785 15.82325 6.909081 14.05820 6.650369 1.765059       9.589725 
1 1 1 6   22 42 o 14.72849 6.116740 3.703812       3.611935 -0.8355743     5.072423 8.372998       5.144433 12.44117 5.945599 18.67481 7.468250 -6.233646      9.545937 
1 1 1 6   23 0  o 142.8911 2.873248 248.9659       10.00493 252.6920       15.37623 246.2301       13.17555 143.8181 4.392480 142.0128 3.810640 1.805298       5.815055 
1 1 1 6   23 1  o 32.17593 4.586633 12.89225       3.494648 12.18972       4.887214 13.62729       4.999041 30.97690 6.671540 32.81204 6.481979 -1.835138      9.301908 
1 1 1 6   23 2  o 105.3895 2.728445 135.5175       7.001371 133.1823       10.39650 137.4556       9.470963 104.3867 4.094956 106.0826 3.669173 -1.695946      5.498317 
1 1 1 6   23 3  f 171.7525 3.831827 359.9411       16.03781 357.2147       19.61786 365.4348       27.84762 170.9738 4.713031 172.6877 6.629766 -1.713837      8.134276 
1 1 1 6   23 4  o 271.3967 4.446035 899.2438       29.40448 921.0486       41.93032 878.1443       41.24656 274.3983 6.270622 267.9232 6.317443 6.475159       8.901168 
1 1 1 6   23 5  o 199.7172 3.606220 486.6617       17.55108 474.9634       33.52210 491.0794       20.60023 196.8101 7.000679 200.5718 4.214696 -3.761703      8.171485 
1 1 1 6   23 6  o 155.6853 3.680912 295.7613       13.96495 314.0515       23.46385 285.7286       17.37796 160.1174 6.024205 152.8826 4.669969 7.234802       7.622313 
1 1 1 6   23 7  o 245.2692 4.091958 734.3743       24.45740 740.7239       47.78638 732.1207       28.46861 245.5437 7.996848 244.8089 4.772027 0.7348328      9.312455 
1 1 1 6   23 8  o 134.8459 2.702343 221.7467       8.880026 209.3427       13.49026 231.2309       11.79607 130.8697 4.235623 137.6131 3.520450 -6.743423      5.507638 
1 1 1 6   23 9  o 396.1562 5.375892 1919.105       51.89830 1894.694       81.22139 1935.949       67.46796 392.5788 8.489996 397.4073 6.966675 -4.828522      10.98247 
1 1 1 6   23 10 o 151.6167 3.200507 280.4682       11.82502 266.5786       24.44858 284.7097       13.51043 147.3087 6.829247 152.7295 3.630031 -5.420822      7.734063 
1 1 1 6   23 11 o 185.7240 3.490750 420.9991       15.79875 466.0472       34.82815 409.3279       17.72760 194.7041 7.353605 183.0855 3.973379 11.61865       8.358423 
1 1 1 6   23 12 o 248.1259 4.178526 752.1216       25.26570 640.5993       47.80309 795.3521       29.76250 227.8652 8.624352 255.0526 4.788546 -27.18742      9.864565 
1 1 1 6   23 13 o 329.3438 5.191553 1327.331       41.66610 1294.720       83.24897 1338.230       48.12791 322.9167 10.59352 330.4618 5.976399 -7.545166      12.16306 
1 1 1 6   23 14 o 72.98795 2.935061 65.10978       5.209761 57.33062       12.34231 66.79632       5.746821 67.85035 7.594784 73.90771 3.198388 -6.057358      8.240779 
1 1 1 6   23 15 o 36.37196 4.046959 16.36583       3.526331 22.34426       9.074503 15.30246       3.827114 41.70892 9.177623 35.07613 4.587190 6.632797       10.26017 
1 1 1 6   23 16 o 35.72768 3.938381 15.78835       3.372107 13.18639       9.402304 16.17244       3.612429 32.80878 10.44626 36.13132 4.179783 -3.322548      11.25144 
1 1 1 6   23 17 o 35.47816 3.674002 15.54392       3.130494 4.095604       8.631106 17.27808       3.359236 24.47749 9.711303 37.41722 3.733917 -12.93973      10.40440 
1 1 1 6   23 18 o 96.77895 2.817596 114.4271       6.637938 117.6554       15.51203 113.7035       7.344349 97.56814 6.562325 96.44209 3.129146 1.126045       7.270190 
1 1 1 6   23 19 o 43.93928 3.342289 23.72456       3.551914 44.28247       10.89413 21.27929       3.757223 59.37392 7.711410 41.55050 3.751042 17.82343       8.575323 
1 1 1 6   23 20 o 144.5499 3.846699 255.7916       13.53804 244.0154       24.36110 261.0534       16.28407 140.3721 7.145142 145.8864 4.586191 -5.514221      8.490359 
1 1 1 6   23 21 o 10.67625 4.756320 -0.9922826     2.501606 4.498267       6.000262 -2.147432      2.752209 21.97334 8.259159 10.28780 4.740492 11.68554       9.522919 
1 1 1 6   23 22 o 109.4683 2.645617 146.3497       7.057511 159.4166       12.63487 140.4239       8.508618 113.9011 4.561270 107.1153 3.263461 6.785851       5.608508 
1 1 1 6   23 23 o 70.10219 2.928234 60.17142       4.991328 67.87923       13.04682 58.84988       5.402301 73.55771 7.377981 69.29274 3.208005 4.264969       8.045240 
1 1 1 6   23 24 o 89.30872 2.844283 97.60854       6.182279 110.7310       14.07749 94.47298       6.881366 94.39931 6.153096 87.80673 3.221421 6.592583       6.945368 
1 1 1 6   23 25 o 141.7602 3.093137 246.0004       10.68537 264.2724       22.86407 240.8944       12.08648 145.6654 6.457164 140.1362 3.542108 5.529205       7.364882 
1 1 1 6   23 26 o 24.24525 5.123891 7.535999       2.932440 5.191676       6.041483 8.258546       3.354038 22.50350 8.320860 25.33079 5.584121 -2.827290      10.02093 
1 1 1 6   23 27 o 46.76702 3.443616 27.00873       3.897035 34.03257       10.24118 25.81947       4.214057 50.99459 8.543085 45.64870 3.823316 5.345890       9.359596 
1 1 1 6   23 28 o 13.32324 5.376576 1.038352       2.692041 -1.530477      5.960163 1.696727       3.017361 16.67579 7.390284 14.75549 5.776238 1.920297       9.379831 
1 1 1 6   23 29 o 53.29168 3.749988 35.28128       4.838869 33.58813       7.208650 36.66988       6.528221 51.28322 5.874111 53.93253 5.024979 -2.649311      7.730174 
1 1 1 6   23 30 o 67.99995 4.936543 58.40255       8.124564 58.40255       8.124564 0.000000       0.000000 67.99995 4.936543 ?        ?        0.000000       4.936543 
1 1 1 6   23 31 o 68.63793 4.318268 59.36564       7.186265 56.43260       8.017644 71.34875       16.20589 66.55400 4.979622 70.98758 9.615136 -4.433578      10.82809 
1 1 1 6   23 32 o 14.84867 6.096344 1.347114       3.532866 3.033915       4.796191 -0.6537042     5.223580 18.21829 7.235611 15.66858 6.932498 2.549712       10.02066 
1 1 1 6   23 33 o 18.34541 6.385126 4.288904       3.498175 1.866310       4.595122 7.628182       5.394896 16.64023 6.903943 23.33385 7.936714 -6.693619      10.51931 
1 1 1 6   23 34 o 19.72894 6.546607 5.374368       3.672075 8.601637       5.037232 1.714279       5.364389 24.07989 7.643663 17.10141 7.296340 6.978474       10.56703 
1 1 1 6   23 35 o 46.42028 4.105546 28.22100       4.596412 25.14266       6.286981 31.75573       6.736936 41.87218 6.361263 47.54622 5.943971 -5.674034      8.706117 
1 1 1 6   23 36 o 29.92945 9.175787 16.43884       7.326344 0.000000       0.000000 16.43884       7.326344 ?        ?        29.92945 9.175787 0.000000       9.175787 
1 1 1 6   23 37 o 19.39496 6.974382 5.947289       4.201842 11.74210       8.693159 4.180749       4.799764 23.72662 9.630219 17.58003 7.148263 6.146595       11.99328 
1 1 1 6   23 38 o 15.38354 6.092128 3.154847       3.390789 10.38944       5.141228 -2.414663      4.510953 23.76995 7.739116 12.19450 5.763619 11.57545       9.649519 
1 1 1 6   23 39 o 19.60905 6.451240 6.639531       3.568290 5.170338       5.062427 8.090178       5.030374 17.43192 7.240669 20.31663 7.577426 -2.884708      10.48068 
1 1 1 6   23 40 o 13.53423 5.956131 1.794890       3.807106 2.845531       5.036180 0.3938432      5.815679 15.02236 6.716725 14.05235 6.611775 0.9700098      9.424965 
1 1 1 6   23 41 o 10.21241 4.866222 -1.888132      3.346223 -6.278026      4.770289 2.364563       4.695154 10.20881 5.062172 14.12834 6.386559 -3.919536      8.149462 
1 1 1 6   24 0  o 188.8593 3.213833 435.0698       14.79101 427.6584       22.78589 440.4669       19.44452 187.0316 5.003862 189.9534 4.200626 -2.921829      6.533291 
1 1 1 6   24 1  o 65.43841 3.329517 52.37305       5.292006 43.06065       9.252414 56.90063       6.451448 58.95452 6.550704 68.17023 3.899799 -9.215710      7.623658 
1 1 1 6   24 2  o 109.0843 3.442824 145.3199       9.140480 136.7278       14.67558 150.7655       11.68333 105.5886 5.724921 111.0391 4.325999 -5.450462      7.175583 
1 1 1 6   24 3  o 195.6533 4.164752 467.3286       19.85695 483.0233       33.95275 459.1698       24.48005 198.4339 7.032508 193.7655 5.189084 4.668335       8.739723 
1 1 1 6   24 4  o 125.3008 3.475483 191.7114       10.60194 175.3322       16.71116 202.7448       13.71557 119.5943 5.750885 128.7793 4.376865 -9.185051      7.227006 
1 1 1 6   24 5  o 172.0588 3.393456 361.2028       14.22837 355.4590       19.67943 367.4940       20.59575 170.5096 4.740772 173.3568 4.880148 -2.847168      6.803731 
1 1 1 6   24 6  o 153.1575 2.863214 286.1010       10.68632 274.1715       16.30056 295.0926       14.15172 149.7560 4.471662 155.4909 3.734807 -5.734848      5.826194 
1 1 1 6   24 7  o 185.3803 3.494508 419.3811       15.78650 427.1639       22.14402 411.3378       22.51148 186.8935 4.866264 183.3714 5.042536 3.522171       7.007689 
1 1 1 6   24 8  o 264.3353 3.899071 853.0930       25.11611 862.1860       39.74338 847.0468       32.40774 265.3419 6.146430 263.2161 5.052430 2.125793       7.956484 
1 1 1 6   24 9  o 52.94348 2.884831 34.29444       3.707874 39.04733       5.377939 29.98808       5.119084 56.41191 3.936798 49.36052 4.298584 7.051384       5.828911 
1 1 1 6   24 10 o 230.8879 3.992538 651.0974       22.46396 606.9741       44.40372 666.2745       26.04243 221.9224 8.224967 233.4758 4.577238 -11.55341      9.412821 
1 1 1 6   24 11 o 260.6107 4.336741 830.0098       27.54177 899.4584       59.11337 810.7542       31.12663 269.8268 9.002706 257.4519 4.961351 12.37497       10.27929 
1 1 1 6   24 12 o 91.85539 2.928658 103.0571       6.547176 93.15499       13.97111 105.8436       7.411350 86.86845 6.650398 93.06217 3.273141 -6.193726      7.412237 
1 1 1 6   24 13 o 17.26467 5.975017 3.291708       3.061202 4.857502       7.480655 2.976764       3.354971 23.93889 9.169458 17.16799 6.224205 6.770895       11.08240 
1 1 1 6   24 14 o 120.0204 3.286434 176.0085       9.603003 181.4789       19.28168 174.2040       11.07414 121.3754 6.543146 119.3452 3.812647 2.030167       7.572914 
1 1 1 6   24 15 o 110.6120 3.217524 149.5178       8.663597 131.3736       16.80688 156.0837       10.11037 103.1488 6.722954 112.9662 3.677574 -9.817459      7.663072 
1 1 1 6   24 16 o 82.43385 2.837744 83.04157       5.692024 110.2581       14.61603 78.17596       6.179910 94.49510 6.384709 79.94885 3.178339 14.54625       7.132065 
1 1 1 6   24 17 o 48.81124 3.219419 29.22625       3.808042 14.29058       9.357099 32.19097       4.168891 33.76826 10.37297 51.22306 3.358310 -17.45480      10.90306 
1 1 1 6   24 18 o 202.5018 3.689222 501.3616       18.20538 507.5083       38.77235 499.6232       20.61979 202.3662 7.877316 202.0508 4.187815 0.3153839      8.921317 
1 1 1 6   24 19 o 123.8893 3.530580 187.8064       10.64811 235.5613       23.13648 174.9731       11.99383 137.9746 6.903091 119.4848 4.125353 18.48982       8.041841 
1 1 1 6   24 20 o 58.06575 3.039379 41.30794       4.285745 23.10993       10.26399 45.15074       4.716590 42.09010 10.12988 60.69629 3.200126 -18.60619      10.62333 
1 1 1 6   24 21 o 167.5660 3.002581 343.1588       12.26074 372.6674       21.26055 328.4550       15.00771 174.0802 5.016981 163.7960 3.759888 10.28419       6.269518 
1 1 1 6   24 22 o 95.95293 2.624110 112.5505       6.130112 123.4319       11.27100 107.9796       7.305051 100.1490 4.630809 93.90776 3.196828 6.241241       5.627087 
1 1 1 6   24 23 o 50.31187 3.239956 31.10465       3.951216 31.02491       10.12956 31.11896       4.291134 48.99121 8.808494 50.28475 3.524180 -1.293537      9.487329 
1 1 1 6   24 24 o 31.58115 4.161394 12.46046       3.124744 5.350551       6.394723 14.69062       3.581438 23.05447 8.554014 34.29227 4.386003 -11.23780      9.612917 
1 1 1 6   24 25 o 51.78901 3.027135 32.96063       3.803715 33.80759       7.267717 32.64111       4.463905 51.86287 5.852600 51.44872 3.582832 0.4141464      6.862186 
1 1 1 6   24 26 o 94.78017 2.693754 110.0861       6.215425 115.8974       11.11564 107.4426       7.496958 96.68207 4.732318 93.50142 3.295417 3.180649       5.766681 
1 1 1 6   24 27 o 31.32976 4.258779 12.35165       3.167355 9.591556       6.425919 13.23742       3.640285 27.25701 8.630919 32.33136 4.762892 -5.074345      9.857885 
1 1 1 6   24 28 o 84.36224 2.925320 87.58167       6.004820 84.69925       9.893059 89.26305       7.555871 82.20292 4.961739 84.93366 3.659221 -2.730743      6.165124 
1 1 1 6   24 29 o 44.19283 3.431627 24.28796       3.666684 26.36377       7.086094 23.52893       4.284937 44.86374 6.685332 43.30298 4.109802 1.560757       7.847556 
1 1 1 6   24 30 o 59.97395 3.527975 44.83182       5.133360 36.72379       7.738709 51.20277       6.859826 53.08055 6.093041 63.69719 4.447270 -10.61664      7.543431 
1 1 1 6   24 31 o 22.67105 6.552459 6.977484       3.823308 2.680314       5.459366 11.11357       5.356063 18.64320 7.607467 28.13189 7.624166 -9.488686      10.77040 
1 1 1 6   24 32 o 20.29220 6.587451 5.530199       3.726423 4.663948       5.304529 6.374229       5.236053 20.11879 7.717587 21.92552 7.796767 -1.806730      10.97045 
1 1 1 6   24 33 o 34.54153 4.900877 15.83786       4.009588 12.17423       5.507997 19.96789       5.848100 28.56298 7.727539 37.69282 6.607540 -9.129845      10.16732 
1 1 1 6   24 34 o 35.19512 5.015723 16.76548       4.180231 18.98461       6.059915 14.75086       5.773928 35.72091 7.210375 30.95828 7.688456 4.762623       10.54049 
1 1 1 6   24 35 o 18.58882 6.985399 4.853155       4.291674 11.33357       6.960110 0.8777768      5.451347 25.25484 8.988304 15.91927 7.060728 9.335576       11.42994 
1 1 1 6   24 36 o 14.48518 6.210215 1.466138       3.920577 9.368743       7.851341 -1.158963      4.525136 22.51398 9.146895 13.26195 6.099163 9.252032       10.99388 
1 1 1 6   24 37 o 17.41035 7.009203 4.404083       4.563282 5.011649       8.599854 4.165974       5.383719 19.09762 8.637140 17.50600 7.382134 1.591621       11.36205 
1 1 1 6   24 38 o 19.26148 6.491420 6.288962       3.608500 20.23050       5.718099 -2.937625      4.651754 34.44513 7.049881 11.92714 5.698244 22.51800       9.064812 
1 1 1 6   24 39 o 22.01967 6.894565 9.048577       4.111488 6.250168       5.239425 13.53366       6.633048 17.92130 7.397817 23.52925 8.715336 -5.607950      11.43174 
1 1 1 6   24 40 o 12.58590 5.669234 0.9507630      3.661959 11.00915       5.459501 -7.275675      4.937359 21.71971 7.930157 10.19190 5.070000 11.52782       9.412349 
1 1 1 6   25 0  o 162.2476 3.916192 321.3377       15.48383 308.6087       26.23518 328.1415       19.18067 158.5640 6.805428 163.8097 4.810151 -5.245667      8.333751 
1 1 1 6   25 1  o 224.1815 4.577973 613.9181       25.00974 575.4125       41.58058 635.7448       31.30559 216.3536 7.899873 227.9828 5.634867 -11.62917      9.703593 
1 1 1 6   25 2  o 66.97813 2.942262 54.82397       4.790596 61.20828       7.023840 49.27077       6.550726 70.68549 4.095167 63.37674 4.266397 7.308758       5.913759 
1 1 1 6   25 3  o 163.3124 3.330996 325.4257       13.25652 336.0633       18.69825 314.6752       18.79724 165.7879 4.632743 160.3987 4.814474 5.389130       6.681427 
1 1 1 6   25 4  o 247.2699 4.192577 746.6862       25.26321 733.7947       35.05735 760.6129       36.43775 244.8577 5.875289 249.2684 5.998578 -4.410690      8.396544 
1 1 1 6   25 5  o 234.2377 3.604722 669.6961       20.57618 686.0421       32.66190 658.9403       26.49469 236.7767 5.660651 232.2100 4.682112 4.566650       7.346097 
1 1 1 6   25 6  o 155.1864 3.256744 293.8721       12.31611 289.5893       16.97418 298.6336       17.89770 153.8785 4.531563 156.2424 4.706062 -2.363846      6.533153 
1 1 1 6   25 7  o 248.6718 3.740778 755.0023       22.66859 748.8929       35.39261 759.2516       29.51765 247.2934 5.873055 249.1952 4.860781 -1.901779      7.623645 
1 1 1 6   25 8  o 94.51801 2.602219 109.0465       5.987990 117.6469       9.266880 102.8813       7.845976 98.07306 3.885151 91.73586 3.516225 6.337204       5.240061 
1 1 1 6   25 9  o 98.87913 2.598886 119.3390       6.256785 120.2950       9.499449 118.6064       8.315197 99.16171 3.938975 98.50694 3.469351 0.6547699      5.248992 
1 1 1 6   25 10 o 126.0669 3.095158 193.9574       9.508674 184.0365       19.26588 197.1522       10.93306 122.2994 6.487612 127.0210 3.535516 -4.721573      7.388436 
1 1 1 6   25 11 o 132.9494 3.484722 215.9799       11.28018 208.1916       20.75735 219.2437       13.43753 130.0549 6.570800 133.8752 4.123834 -3.820297      7.757668 
1 1 1 6   25 12 o 63.12000 3.433290 48.79484       5.261088 61.57972       11.14517 45.12912       5.967853 70.50958 6.561696 60.63047 4.062605 9.879108       7.717552 
1 1 1 6   25 13 o 96.22416 2.938642 113.1159       6.882682 125.9918       15.66393 110.0352       7.661956 101.0799 6.391896 94.86864 3.319330 6.211266       7.202380 
1 1 1 6   25 14 o 66.81836 3.009605 54.61429       4.887932 55.44171       11.15409 54.41763       5.437874 66.76308 6.957835 66.66560 3.358088 0.9748077E-01  7.725815 
1 1 1 6   25 15 o 198.7427 4.149597 483.1450       20.09709 438.0667       35.40890 504.5674       24.40970 188.1895 7.737636 202.9377 4.935870 -14.74820      9.177898 
1 1 1 6   25 16 f 13.06617 5.398454 0.5748277      2.793427 12.25428       8.994513 -0.6719561     2.938746 31.69531 10.22989 12.03643 5.266822 19.65888       11.50609 
1 1 1 6   25 17 o 177.8434 4.148661 387.0984       17.97967 431.6365       33.69415 369.3678       21.25940 186.7429 7.418901 173.4687 5.034467 13.27420       8.965821 
1 1 1 6   25 18 o 71.22095 3.420713 62.14982       5.919554 77.73354       13.21556 58.23842       6.620891 79.04969 6.930440 68.87121 3.961677 10.17848       7.982850 
1 1 1 6   25 19 o 132.5980 3.064939 214.8518       9.903638 216.2765       22.00913 214.4901       11.08981 132.1023 6.860363 132.3924 3.440276 -0.2901001     7.674638 
1 1 1 6   25 20 o 113.1507 2.952291 156.5685       8.133574 192.0647       21.12704 150.3921       8.812839 124.3275 7.001543 110.8495 3.266028 13.47807       7.725836 
1 1 1 6   25 21 o 88.46649 3.197643 95.84754       6.882241 0.000000       0.000000 95.84754       6.882241 ?        ?        88.46649 3.197643 0.000000       3.197643 
1 1 1 6   25 22 o 46.28423 3.374856 26.36647       3.780330 40.72363       10.76322 24.34614       4.037561 56.51814 8.041430 44.40911 3.766367 12.10902       8.879760 
1 1 1 6   25 23 o 92.05297 2.680664 103.6997       6.006942 100.8602       10.70956 105.0030       7.255753 90.32686 4.883561 92.54082 3.222376 -2.213959      5.850887 
1 1 1 6   25 24 o 56.11703 3.005049 38.67801       4.094450 29.69631       7.925743 41.94760       4.781973 48.25577 6.939209 58.38831 3.375205 -10.13254      7.716516 
1 1 1 6   25 25 o 54.15199 3.031483 36.06578       3.984450 24.25045       7.341553 40.99913       4.743901 43.32981 7.205863 57.68328 3.389753 -14.35347      7.963346 
1 1 1 6   25 26 o 27.73207 4.544236 9.766562       2.964726 11.39269       6.009769 9.243540       3.408322 29.31098 8.129716 26.76453 5.411942 2.546448       9.766340 
1 1 1 6   25 27 o 47.49443 3.403388 27.94578       3.912928 32.13340       7.173190 26.17183       4.668725 50.13131 5.990154 45.74545 4.236185 4.385860       7.336703 
1 1 1 6   25 28 o 87.78716 2.755660 94.87666       5.887820 93.86867       10.36733 95.35654       7.153370 86.34029 4.948115 87.79418 3.349703 -1.453888      5.975312 
1 1 1 6   25 29 o 37.89703 4.570292 18.29527       4.135589 13.60799       6.498095 21.48636       5.361608 31.20615 8.372118 40.71881 5.547481 -9.512669      10.04325 
1 1 1 6   25 30 o 33.78901 4.906251 14.80253       3.921821 19.19813       6.675471 12.48572       4.846384 37.17359 7.625064 30.21830 6.751645 6.955284       10.18461 
1 1 1 6   25 31 o 22.21931 5.792193 6.720781       3.167812 8.167879       7.536345 6.410233       3.491212 24.68001 9.260464 21.64695 6.262905 3.033064       11.17945 
1 1 1 6   25 32 f 23.60655 5.328665 7.600803       2.992479 6.086793       5.382237 8.278236       3.600243 21.34655 7.860684 24.33165 6.087500 -2.985100      9.942233 
1 1 1 6   25 33 o 16.35072 6.229269 3.112918       3.440374 1.130119       4.861921 5.101440       4.868934 15.90747 6.868799 19.64307 7.427471 -3.735603      10.11671 
1 1 1 6   25 34 o 53.66262 4.342331 38.24366       5.629998 48.93207       10.04475 33.34788       6.798199 56.52991 7.474624 48.50008 5.871342 8.029823       9.504875 
1 1 1 6   25 35 o 35.26627 4.760262 17.16163       3.986603 21.09440       5.878567 13.81285       5.424575 37.13623 6.744201 28.97748 7.592201 8.158751       10.15509 
1 1 1 6   25 36 o 18.49828 6.762022 5.345161       3.971319 4.227446       7.515800 5.778110       4.677654 18.57094 8.260615 19.01489 7.258871 -0.4439545     10.99677 
1 1 1 6   25 37 o 15.85787 6.190921 3.625111       3.458405 7.322136       5.311798 0.9047452      4.556474 19.91408 7.700855 14.14928 6.352778 5.764803       9.983033 
1 1 1 6   25 38 o 18.72018 6.800010 6.350450       4.007003 6.488203       5.357003 6.175488       6.037315 18.37067 7.520695 18.03564 7.718860 0.3350220      10.77690 
1 1 1 6   25 39 o 11.17144 5.220364 -0.9634665     3.521053 -0.1195884E-01 5.206250 -1.765563      4.780047 13.38526 6.284656 12.15541 5.798748 1.229850       8.551162 
1 1 1 6   25 40 o 10.95935 5.147072 -0.9578102     3.496279 -3.586693      5.093674 1.384155       4.807682 11.45783 5.590208 13.55764 6.253740 -2.099806      8.388068 
1 1 1 6   26 0  o 197.6506 4.197528 477.1547       20.21752 464.5402       24.36868 505.0130       36.21386 194.8358 5.136961 202.7019 7.343436 -7.866058      8.961830 
1 1 1 6   26 1  o 164.3142 3.069741 329.4045       12.29173 369.0110       19.75049 304.3663       15.70350 173.6995 4.670219 157.8131 4.086793 15.88640       6.205871 
1 1 1 6   26 2  o 159.6227 4.025475 311.3669       15.64592 330.7440       26.74127 301.2810       19.29280 164.0974 6.701297 156.8811 5.053072 7.216324       8.392909 
1 1 1 6   26 3  o 102.3865 3.218379 128.0477       8.020034 124.8545       15.19579 129.2806       9.442207 100.7560 6.219250 102.8310 3.774427 -2.074921      7.274983 
1 1 1 6   26 4  o 96.40900 2.999993 113.5121       7.039552 111.1357       9.585288 116.2946       10.37205 95.29382 4.137525 97.45927 4.378404 -2.165459      6.024080 
1 1 1 6   26 5  o 55.65971 3.065441 37.91606       4.141806 39.93698       6.065012 36.14997       5.669743 56.99841 4.400545 54.22042 4.326932 2.777988       6.171478 
1 1 1 6   26 6  o 44.55965 3.420459 24.37969       3.685776 22.98872       5.180211 25.80586       5.245349 43.06118 5.031288 45.69172 4.781586 -2.630543      6.940995 
1 1 1 6   26 7  o 98.11073 2.652363 117.5056       6.335589 121.7393       9.685922 114.3396       8.375915 99.74660 3.992871 96.70525 3.560312 3.041344       5.349658 
1 1 1 6   26 8  o 104.0479 2.895735 132.2012       7.335094 139.9960       10.42737 124.5658       10.32024 106.9675 4.007331 100.8696 4.207735 6.097984       5.810657 
1 1 1 6   26 9  o 265.0529 4.347287 858.9031       28.07934 900.0685       40.83964 821.9962       38.66954 270.8603 6.187290 258.8629 6.130037 11.99738       8.709760 
1 1 1 6   26 10 o 171.6557 3.433189 359.8209       14.36124 386.1904       30.24440 352.1445       16.31825 177.0751 7.022850 169.7545 3.944721 7.320679       8.054890 
1 1 1 6   26 11 o 194.7426 4.142080 463.6613       19.65692 423.8999       33.94159 483.7278       24.11217 185.3359 7.530815 198.7001 4.983622 -13.36417      9.030484 
1 1 1 6   26 12 o 166.3176 3.364065 337.8406       13.63448 356.6981       28.97355 332.4768       15.45237 170.0863 7.005302 164.9323 3.844620 5.154007       7.990955 
1 1 1 6   26 13 o 72.18188 3.113519 63.73758       5.463781 72.54356       12.83997 61.79046       6.037696 76.44403 6.969174 71.03104 3.498851 5.412987       7.798163 
1 1 1 6   26 14 o 120.7598 3.053537 178.1863       8.978695 200.5737       20.35479 172.7778       10.00464 127.4941 6.573690 118.8644 3.457606 8.629776       7.427546 
1 1 1 6   26 15 o 210.2776 4.295851 541.2433       22.01295 575.0024       41.83348 528.3163       25.88668 215.3844 7.984102 207.5513 5.118171 7.833069       9.483752 
1 1 1 6   26 16 o 99.39269 3.697409 120.9765       8.939851 106.2340       15.30278 128.6147       11.01494 92.55328 6.833067 102.3774 4.425568 -9.824120      8.141035 
1 1 1 6   26 17 o 61.96624 3.133586 47.03912       4.716511 70.93065       12.39050 42.99065       5.100492 75.49494 6.808027 59.18523 3.552765 16.30971       7.679282 
1 1 1 6   26 18 o 132.2517 3.092171 213.7667       9.965538 192.3531       21.14479 219.8813       11.29914 124.4829 6.998585 134.0336 3.462257 -9.550789      7.808163 
1 1 1 6   26 19 o 145.0697 3.167530 257.3217       11.19782 273.2626       25.12416 253.3700       12.50898 148.3507 6.969177 143.8842 3.567573 4.466553       7.829240 
1 1 1 6   26 20 o 106.4620 3.277926 138.7998       8.493998 0.000000       0.000000 138.7998       8.493998 ?        ?        106.4620 3.277926 0.000000       3.277926 
1 1 1 6   26 21 o 174.1112 3.443006 371.3024       14.60833 402.4751       32.91915 363.6584       16.30133 179.3566 7.548614 172.1872 3.884955 7.169388       8.489667 
1 1 1 6   26 22 o 76.69572 2.963550 72.09524       5.528425 79.27008       13.29445 70.59510       6.078962 79.41990 6.938795 75.83929 3.297145 3.580612       7.682320 
1 1 1 6   26 23 o 128.6649 3.068723 202.8284       9.621742 205.7984       21.53683 202.0878       10.75469 127.9924 6.930824 128.2930 3.443116 -0.3006821     7.738952 
1 1 1 6   26 24 o 48.62747 3.153456 29.13095       3.716688 35.76574       7.701467 27.11659       4.243552 53.18816 6.049214 46.79997 3.752315 6.388191       7.118486 
1 1 1 6   26 25 o 95.69366 2.677764 112.3402       6.238275 127.7988       11.40162 105.7352       7.452766 101.3994 4.626374 92.66997 3.305511 8.729439       5.685925 
1 1 1 6   26 26 o 73.91960 2.934561 67.26666       5.275638 71.62776       9.041403 65.01533       6.496172 75.58670 4.935558 72.45382 3.691423 3.132881       6.163305 
1 1 1 6   26 27 o 35.95399 3.897152 16.22347       3.359992 12.53216       6.187456 17.76721       4.001365 30.29790 8.187493 37.47982 4.468947 -7.181921      9.327729 
1 1 1 6   26 28 o 58.18692 3.028779 41.93986       4.279878 41.75567       7.649041 42.02381       5.163888 56.96562 5.581645 58.02412 3.670828 -1.058498      6.680550 
1 1 1 6   26 29 o 48.87648 3.864129 30.09081       4.565014 40.80566       7.563644 23.95127       5.725395 56.00804 5.617474 42.78647 5.627433 13.22157       7.951354 
1 1 1 6   26 30 f 33.04652 4.301949 14.06986       3.382236 17.29866       6.474063 12.85781       3.966581 34.77783 7.828423 31.08323 5.434414 3.694603       9.529799 
1 1 1 6   26 31 o 17.26921 5.747926 3.892569       2.830249 3.734323       5.620558 3.946325       3.275886 19.23411 7.766351 17.61353 6.175602 1.620577       9.922413 
1 1 1 6   26 32 o 11.84216 5.162274 -0.2366276E-01 2.800202 -1.783596      4.839476 0.8621143      3.433306 13.87641 6.354157 13.81444 5.863496 0.6197548E-01  8.646150 
1 1 1 6   26 33 o 17.34991 6.722026 3.744644       4.053021 -1.818978      7.531456 6.012706       4.808699 16.62127 7.722606 20.26737 7.435659 -3.646097      10.72043 
1 1 1 6   26 34 o 20.88747 5.576338 6.379225       2.891538 3.933969       4.928023 7.663088       3.570836 17.75365 7.234072 22.46854 6.279556 -4.714888      9.579386 
1 1 1 6   26 35 o 20.70009 6.331749 6.712180       3.491119 7.069728       5.157087 6.409718       4.743214 20.52104 7.668553 19.84674 7.366472 0.6743031      10.63351 
1 1 1 6   26 36 o 21.55919 7.022630 8.033887       4.233086 11.98290       9.146371 6.957440       4.775301 22.46129 9.553341 19.89048 7.389713 2.570814       12.07784 
1 1 1 6   26 37 o 13.22389 5.846908 1.082334       3.709643 -0.4187385     5.170446 2.674750       5.325440 13.63502 6.356481 15.61137 6.948256 -1.976350      9.417171 
1 1 1 6   26 38 o 37.76524 4.871023 21.42554       4.378496 21.31101       6.555583 21.51778       5.883114 31.93451 8.336129 34.12009 7.296486 -2.185585      11.07835 
1 1 1 6   26 39 o 11.53707 5.336070 -0.2506191     3.534689 -2.276660      5.190450 1.501569       4.826932 12.15050 5.860181 13.76413 6.318772 -1.613630      8.617923 
1 1 1 6   27 0  o 47.11382 3.860289 27.28951       4.393217 25.21302       5.688936 30.35733       6.914830 45.08781 5.277422 49.44339 5.852344 -4.355579      7.880425 
1 1 1 6   27 1  o 265.0108 4.445062 858.4048       28.70632 872.9818       40.41035 843.5556       40.78599 266.8539 6.214167 262.2743 6.381447 4.579620       8.907229 
1 1 1 6   27 2  o 120.3139 3.187830 176.7883       9.338223 150.2137       15.97511 190.5821       11.50936 110.5595 5.951349 124.8640 3.786868 -14.30446      7.054001 
1 1 1 6   27 3  o 170.9449 3.121955 356.6310       13.00526 348.7082       19.59420 362.8698       17.38735 168.7876 4.768549 172.3283 4.140385 -3.540634      6.315208 
1 1 1 6   27 4  o 148.0683 3.831237 267.9755       13.81250 263.9866       23.56146 270.0642       17.04946 146.5059 6.616577 148.5248 4.716570 -2.018921      8.125584 
1 1 1 6   27 5  o 185.6252 4.117598 421.0721       18.62588 421.5477       32.64933 420.8426       22.67827 185.0213 7.255365 185.3744 5.024869 -0.3531647     8.825510 
1 1 1 6   27 6  o 98.50546 3.520900 118.6425       8.438224 110.1753       14.41348 123.0579       10.40836 94.55172 6.291305 100.2430 4.270596 -5.691284      7.603848 
1 1 1 6   27 7  f 124.5403 3.036126 189.3080       9.214372 209.2871       13.29176 170.8227       12.78517 130.7817 4.175961 118.1050 4.450203 12.67675       6.102701 
1 1 1 6   27 8  o 198.2976 3.275651 480.1067       15.82891 451.1761       23.91897 502.6488       21.11353 191.8776 5.120005 202.7527 4.273247 -10.87512      6.668964 
1 1 1 6   27 9  o 111.9633 2.681538 152.9627       7.316368 152.2917       11.08310 153.4810       9.740291 111.5370 4.084510 112.0336 3.572260 -0.4965591     5.426257 
1 1 1 6   27 10 o 100.1705 3.087001 122.6213       7.526515 109.3449       14.99649 127.0915       8.701834 94.07977 6.582736 101.9385 3.508200 -7.858696      7.459214 
1 1 1 6   27 11 o 13.98185 5.855305 0.3883300      3.350507 0.1313781      7.278362 0.4574225      3.774184 20.02032 8.518876 14.85220 6.216776 5.168120       10.54607 
1 1 1 6   27 12 o 44.00242 3.951566 23.86550       4.192153 23.85548       8.895119 23.86836       4.753115 43.11788 8.764671 43.92974 4.503700 -0.8118629     9.854074 
1 1 1 6   27 13 o 88.01866 3.061587 94.72803       6.556858 111.3850       15.08406 90.84737       7.280695 94.88977 6.563677 86.15064 3.475125 8.739128       7.426867 
1 1 1 6   27 14 o 167.4735 3.400007 342.7784       13.87593 353.7678       29.63412 339.6923       15.70385 169.0990 7.207960 166.6440 3.867055 2.455017       8.179780 
1 1 1 6   27 15 o 161.1969 3.799842 317.8982       14.92652 307.8272       27.21221 322.2324       17.85179 157.6742 7.100402 162.0928 4.523836 -4.418625      8.419074 
1 1 1 6   27 16 o 187.7727 3.584033 431.2997       16.39987 454.5823       35.39431 424.9345       18.50632 191.3199 7.606832 186.2745 4.076906 5.045364       8.630472 
1 1 1 6   27 17 o 22.54320 5.746904 6.498819       3.166124 3.366720       8.412759 7.015645       3.417375 23.57709 9.508119 23.41290 5.971624 0.1641827      11.22785 
1 1 1 6   27 18 o 139.6307 3.552562 238.7899       12.07830 0.000000       0.000000 238.7899       12.07830 ?        ?        139.6307 3.552562 0.000000       3.552562 
1 1 1 6   27 19 o 76.43938 2.996327 71.56198       5.570580 69.16469       13.15525 72.08575       6.149087 74.18562 7.374384 76.67736 3.298560 -2.491737      8.078493 
1 1 1 6   27 20 o 83.38145 2.919585 85.14660       5.923194 82.98745       13.77377 85.63648       6.560824 81.33202 7.018112 83.57404 3.227513 -2.242020      7.724684 
1 1 1 6   27 21 o 120.5642 3.011231 177.9522       8.847054 162.0408       19.06280 182.3202       9.987839 113.7114 6.911980 121.9177 3.364993 -8.206245      7.687565 
1 1 1 6   27 22 o 137.4857 3.135032 231.6991       10.50354 250.9909       24.19741 227.2202       11.65925 141.2318 7.053044 135.9998 3.520966 5.232025       7.883060 
1 1 1 6   27 23 o 33.63393 4.125403 14.15310       3.310547 16.87077       8.722826 13.69577       3.578270 35.41886 9.783069 32.97923 4.575513 2.439632       10.80017 
1 1 1 6   27 24 o 21.12028 5.794694 5.772957       3.071930 6.870309       7.860170 5.575129       3.337363 25.28777 9.463771 20.85506 6.148756 4.432709       11.28584 
1 1 1 6   27 25 o 14.90141 5.571020 2.167761       2.722356 -0.3573010     5.844789 2.867333       3.076445 17.20721 7.480114 16.40125 5.958230 0.8059540      9.563087 
1 1 1 6   27 26 o 23.71197 5.416579 7.368259       3.061107 5.718109       6.008264 7.946755       3.557438 22.49087 8.301208 24.52106 6.002604 -2.030193      10.24409 
1 1 1 6   27 27 o 55.22368 3.067566 37.80549       4.111928 43.59543       7.591574 35.40160       4.891611 58.30777 5.404301 53.19021 3.798854 5.117558       6.605888 
1 1 1 6   27 28 o 44.53042 4.153698 25.13395       4.455426 31.28325       6.874329 20.67980       5.850595 48.82365 5.897147 39.37386 6.310642 9.449791       8.637160 
1 1 1 6   27 29 o 15.60734 5.753048 2.702850       2.884172 8.401094       5.722829 0.7627755      3.339254 24.49565 8.173921 13.85904 5.827305 10.63661       10.03845 
1 1 1 6   27 30 o 51.37571 3.188695 33.19443       3.972473 42.65346       7.710440 29.77635       4.634969 56.45314 5.681939 48.23153 3.978840 8.221611       6.936541 
1 1 1 6   27 31 o 29.96772 4.815435 12.03311       3.397519 19.54143       8.450895 10.58559       3.710596 34.09617 9.706389 27.58185 5.708818 6.514320       11.26075 
1 1 1 6   27 32 f 43.62705 3.790525 24.74122       3.989914 18.21067       8.836876 26.41342       4.471657 31.24358 10.14439 44.82053 4.140867 -13.57695      10.95698 
1 1 1 6   27 33 o 19.58096 6.403182 5.739660       3.517561 7.757581       5.728175 4.518049       4.456877 21.79937 8.094507 18.16807 7.046241 3.631300       10.73176 
1 1 1 6   27 34 o 18.29385 5.719009 4.979358       2.830103 2.847601       5.216687 5.868443       3.368972 16.71907 7.165669 19.53305 6.256709 -2.813982      9.512793 
1 1 1 6   27 35 o 9.007996 4.294099 -2.534683      2.611221 -3.108324      7.284030 -2.450092      2.797132 14.75345 7.070524 9.444525 4.485708 5.308922       8.373403 
1 1 1 6   27 36 o 16.12383 6.085490 3.998570       3.264986 6.189042       9.169154 3.680498       3.494003 18.70026 8.629667 15.77370 6.203487 2.926558       10.62800 
1 1 1 6   27 37 o 8.665083 4.150127 -2.390972      2.500965 -5.228737      4.706709 -1.274516      2.952228 10.78416 5.285210 10.24236 4.784210 0.5418034      7.128963 
1 1 1 6   27 38 o 23.21545 6.390192 9.706409       3.728888 10.62629       5.671824 9.006129       4.948715 21.14424 8.011645 20.28720 7.525407 0.8570309      10.99173 
1 1 1 6   28 0  o 72.08434 2.963030 63.51754       5.193812 61.62767       7.524306 65.23756       7.178228 70.86459 4.378520 72.95425 4.053605 -2.089661      5.966837 
1 1 1 6   28 1  o 54.55275 3.882526 36.54159       5.127662 36.32646       6.127103 37.04445       9.367586 54.29686 4.676188 54.41891 7.243583 -0.1220551     8.621846 
1 1 1 6   28 2  o 243.5550 4.214164 725.1110       25.01178 758.9841       35.63372 692.2151       35.11596 248.7997 5.877266 237.4780 6.072978 11.32170       8.451232 
1 1 1 6   28 3  o 91.17528 3.121218 101.5898       6.924627 99.08449       9.041713 105.1438       10.76900 89.94099 4.136389 92.57512 4.789876 -2.634132      6.328714 
1 1 1 6   28 4  o 166.3761 3.876758 338.2395       15.71795 338.3153       19.20965 338.0860       27.34087 166.2099 4.747572 165.7183 6.784613 0.4916687      8.280725 
1 1 1 6   28 5  o 59.61755 3.430402 43.54871       4.962696 46.44288       6.628815 39.85799       7.485667 61.46006 4.456220 56.76941 5.479029 4.690659       7.062411 
1 1 1 6   28 6  o 314.7495 5.040103 1213.262       38.65812 1268.615       55.68149 1161.752       53.71328 321.0375 7.117360 307.1934 7.175195 13.84418       10.10645 
1 1 1 6   28 7  o 94.80270 3.193477 109.8644       7.367161 123.0775       15.20656 105.8120       8.421474 99.90364 6.277908 92.98093 3.724240 6.922707       7.299459 
1 1 1 6   28 8  o 203.9932 3.793219 508.6083       18.85644 437.3332       35.21946 537.2495       22.32589 188.1031 7.699623 209.5518 4.372012 -21.44862      8.854303 
1 1 1 6   28 9  o 175.0106 3.514712 374.2271       14.98960 428.4973       32.32328 359.3584       16.91884 186.3396 7.131428 171.4211 4.050142 14.91852       8.201276 
1 1 1 6   28 10 o 131.1269 2.778180 209.8813       8.877451 206.1515       13.47625 212.7406       11.79942 129.7282 4.268646 131.8773 3.675176 -2.149048      5.632784 
1 1 1 6   28 11 o 134.7181 3.207729 221.6991       10.53076 225.7856       21.92690 220.4739       12.00602 135.2236 6.674719 134.2424 3.673514 0.9811249      7.618831 
1 1 1 6   28 12 o 89.65678 3.119627 98.30989       6.805494 104.7616       14.41078 96.45802       7.720667 92.00359 6.468793 88.75491 3.576984 3.248688       7.391894 
1 1 1 6   28 13 o 172.3635 4.130396 363.7172       17.34895 345.2989       29.81021 373.1506       21.33409 166.9337 7.345979 174.3145 5.027575 -7.380753      8.901680 
1 1 1 6   28 14 o 99.93388 3.569349 122.3040       8.678402 89.43831       14.99022 138.8729       10.64349 84.69137 7.335538 106.4105 4.112270 -21.71916      8.409571 
1 1 1 6   28 15 o 44.06390 4.520022 24.05840       4.784825 24.82238       9.855281 23.82277       5.473176 43.69993 9.524086 43.71978 5.241555 -0.1984406E-01 10.87116 
1 1 1 6   28 16 o 53.24683 3.882026 34.90744       5.002584 0.000000       0.000000 34.90744       5.002584 ?        ?        53.24683 3.882026 0.000000       3.882026 
1 1 1 6   28 17 o 27.00404 5.718721 9.328886       3.645949 0.000000       0.000000 9.328886       3.645949 ?        ?        27.00404 5.718721 0.000000       5.718721 
1 1 1 6   28 18 o 25.63921 5.286629 8.397137       3.193306 -4.055827      7.961072 10.78491       3.486037 18.33783 8.300215 29.17995 5.087287 -10.84212      9.735196 
1 1 1 6   28 19 o 56.14935 3.297790 38.74788       4.492495 48.96697       11.65438 36.96439       4.868765 62.01382 7.890380 54.78063 3.668310 7.233196       8.701413 
1 1 1 6   28 20 o 36.34166 3.907437 16.41056       3.406154 12.29180       9.105875 17.08062       3.672783 31.28070 10.30631 37.04155 4.139525 -5.760845      11.10656 
1 1 1 6   28 21 o 31.72892 4.302773 12.63055       3.241245 19.33148       8.992487 11.63000       3.474813 37.98692 9.685913 30.30040 4.871000 7.686516       10.84175 
1 1 1 6   28 22 o 34.34232 4.003816 14.73455       3.287954 21.74102       8.750942 13.58286       3.547905 40.26282 9.129978 32.83208 4.557125 7.430744       10.20411 
1 1 1 6   28 23 o 47.08989 3.589175 27.48706       4.087653 39.76701       10.29148 25.18694       4.454056 55.13520 7.883893 44.94288 4.112384 10.19232       8.891989 
1 1 1 6   28 24 o 48.57715 3.387201 29.24184       3.984553 31.15099       9.789207 28.86272       4.362272 48.08323 8.673497 48.17017 3.745612 -0.8694839E-01 9.447707 
1 1 1 6   28 25 o 61.88050 3.185850 47.39141       4.787963 51.17366       11.08048 46.52306       5.309212 62.25611 7.451496 61.18640 3.576321 1.069717       8.265281 
1 1 1 6   28 26 o 99.10801 3.277081 121.8109       7.903772 140.8071       12.03695 107.4126       10.47945 105.6111 4.688723 92.22353 4.678230 13.38760       6.623440 
1 1 1 6   28 27 o 63.64988 3.493626 50.64584       5.398107 52.88207       8.112886 48.86929       7.231126 64.04981 5.243684 61.80888 4.839417 2.240929       7.135558 
1 1 1 6   28 28 o 12.47108 5.487957 -0.4587837     3.231711 -8.179085      4.818973 5.851048       4.356586 11.04333 5.398627 21.01315 7.132389 -9.969823      8.945174 
1 1 1 6   28 29 o 56.61130 3.004754 40.14186       4.130379 46.98790       7.770442 37.44577       4.876327 59.51138 5.417405 54.28704 3.708311 5.224339       6.565048 
1 1 1 6   28 30 o 44.13062 3.769739 25.03099       4.015250 32.15262       9.975297 23.65403       4.386279 44.62203 9.467176 42.57270 4.286221 2.049328       10.39226 
1 1 1 6   28 31 o 12.53746 5.237144 0.9235318      2.670227 2.391366       5.423914 0.4539751      3.067739 17.25501 7.348489 12.68705 5.467038 4.567964       9.159082 
1 1 1 6   28 32 o 16.59603 6.268899 3.591727       3.466396 -0.1332563     5.539511 5.989067       4.444001 15.30357 6.925575 19.91223 7.170998 -4.608662      9.969293 
1 1 1 6   28 33 o 10.36891 4.784628 -1.383829      2.817888 -11.10458      6.888169 0.5699704      3.088118 12.26087 6.080287 12.55238 5.447034 -0.2915049     8.163337 
1 1 1 6   28 34 o 17.82571 5.707670 4.834460       2.803842 3.898824       5.705352 5.132381       3.219436 17.40984 7.478300 18.16724 6.131501 -0.7574043     9.670588 
1 1 1 6   28 35 o 21.13678 6.043281 7.251402       3.268947 8.913867       8.101186 6.928066       3.572724 20.31137 8.818151 20.29149 6.436867 0.1987839E-01  10.91756 
1 1 1 6   28 36 o 19.79657 6.118890 6.678910       3.249897 21.47030       9.126745 4.531075       3.477859 26.91109 10.17056 16.52812 6.271053 10.38297       11.94849 
1 1 1 6   28 37 o 21.45744 5.874313 7.824403       3.160894 7.546337       5.765171 7.943918       3.779624 18.49031 7.707370 20.61660 6.629361 -2.126291      10.16622 
1 1 1 6   29 0  o 71.90634 3.851920 63.36631       6.725007 56.83615       7.423654 93.24324       15.87902 68.01323 4.504453 86.66054 7.595830 -18.64731      8.831010 
1 1 1 6   29 1  o 66.68933 3.536499 54.47839       5.726781 53.00247       7.297913 56.84378       9.238879 65.65672 4.590158 67.85590 5.638103 -2.199181      7.270334 
1 1 1 6   29 2  o 51.69848 3.470197 32.79195       4.346556 28.99979       5.842350 37.49282       6.504789 48.40482 5.026014 55.12313 4.893219 -6.718304      7.014585 
1 1 1 6   29 3  o 93.29996 2.894981 106.3514       6.574118 102.1793       9.406881 110.3345       9.191281 91.30702 4.239283 94.91999 3.982430 -3.612968      5.816466 
1 1 1 6   29 4  o 67.89741 3.132319 56.40721       5.168727 63.60548       7.598534 50.20815       7.051454 71.97630 4.352498 63.89112 4.558954 8.085175       6.303039 
1 1 1 6   29 5  o 144.0025 3.355321 253.2857       11.77444 248.6298       22.91834 254.9553       13.72414 142.0160 6.640703 144.3615 3.904781 -2.345490      7.703651 
1 1 1 6   29 6  o 58.49787 3.211236 41.91638       4.560152 42.80824       6.385226 40.98797       6.514782 58.97406 4.476466 57.67231 4.675562 1.301750       6.472992 
1 1 1 6   29 7  o 22.27283 5.857859 6.312968       3.221301 6.527575       4.031754 5.934126       5.356744 22.85717 6.763207 22.95114 7.905702 -0.9397316E-01 10.40390 
1 1 1 6   29 8  o 31.79674 5.114470 12.70403       3.828583 15.17863       4.940352 8.983396       6.057802 34.64730 6.072545 26.96145 8.357488 7.685854       10.33070 
1 1 1 6   29 9  o 69.05161 3.212080 58.37374       5.390196 59.78222       7.107501 56.46704       8.269568 69.76562 4.200058 67.67321 5.050958 2.092407       6.569069 
1 1 1 6   29 10 o 38.30247 4.817946 18.26407       4.397756 27.85710       8.579504 14.84525       5.121803 46.84192 7.789537 34.18421 6.383072 12.65771       10.07078 
1 1 1 6   29 11 o 63.90744 3.475915 50.07930       5.392856 49.32069       10.96782 50.32119       6.193233 62.74648 7.309620 63.99805 3.990999 -1.251564      8.328182 
1 1 1 6   29 12 o 114.7200 3.760656 161.2141       10.49909 140.0341       17.58073 172.9550       13.08954 106.2468 6.826359 118.6872 4.534024 -12.44044      8.194910 
1 1 1 6   29 13 f 173.4532 4.875794 369.6584       20.58888 341.5839       29.68200 395.6928       28.58324 165.8458 7.362688 178.8610 6.568982 -13.01517      9.867152 
1 1 1 6   29 14 f 19.66850 6.647569 4.466349       3.784200 0.000000       0.000000 4.466349       3.784200 ?        ?        19.66850 6.647569 0.000000       6.647569 
1 1 1 6   29 15 o 56.12467 3.773454 38.75732       5.130949 0.000000       0.000000 38.75732       5.130949 ?        ?        56.12467 3.773454 0.000000       3.773454 
1 1 1 6   29 16 o 116.9540 3.066992 167.4296       8.733509 185.5502       19.48366 162.8732       9.770017 122.1411 6.570129 115.2739 3.481980 6.867188       7.435778 
1 1 1 6   29 17 o 84.09132 3.061249 86.64716       6.262684 68.41909       13.32067 91.81959       7.095822 73.62257 7.530677 86.51698 3.372079 -12.89440      8.251183 
1 1 1 6   29 18 o 38.35283 4.061427 18.27317       3.738264 34.42393       9.880201 15.57482       4.038490 51.71884 8.105462 35.22307 4.832195 16.49577       9.436558 
1 1 1 6   29 19 o 51.75201 3.315382 32.97929       4.159171 37.29911       10.19217 32.11621       4.555757 53.78648 8.020863 51.00324 3.690403 2.783241       8.829117 
1 1 1 6   29 20 o 60.28944 3.159241 44.71348       4.625322 56.02252       11.35399 42.46327       5.064621 66.30804 7.138962 58.67277 3.558947 7.635277       7.976897 
1 1 1 6   29 21 f 76.78255 3.220161 72.56764       6.011892 77.80392       12.85434 71.10159       6.801625 78.17460 6.815654 75.88181 3.689286 2.292786       7.750095 
1 1 1 6   29 22 o 93.40430 3.432891 107.6438       7.800519 89.70664       14.33815 115.1847       9.296740 83.54324 7.110304 96.42599 3.964860 -12.88275      8.141040 
1 1 1 6   29 23 o 26.36944 5.360134 9.038567       3.326864 12.27611       7.696208 8.294577       3.689372 30.09855 9.434188 25.08981 6.095243 5.008739       11.23191 
1 1 1 6   29 24 o 22.83950 5.714835 6.886610       3.172673 14.06208       8.253638 5.642528       3.436724 31.64676 9.745945 20.81137 6.265056 10.83539       11.58596 
1 1 1 6   29 25 o 69.32990 3.956210 60.22994       6.656247 66.47224       11.92986 57.40827       8.020778 70.83871 7.002304 67.16926 4.934597 3.669456       8.566360 
1 1 1 6   29 26 o 31.17298 6.118190 13.05558       4.481667 14.50637       7.933109 12.37552       5.431418 31.33725 9.536728 29.73998 7.497570 1.597269       12.13106 
1 1 1 6   29 27 o 17.83337 5.662331 4.164759       2.764108 7.074113       5.548888 3.204567       3.187768 22.88964 8.036526 16.62938 6.061501 6.260260       10.06616 
1 1 1 6   29 28 o 15.01549 5.510985 2.576205       2.641882 4.026716       5.413476 2.122751       3.026791 19.34612 7.685979 14.83987 5.792241 4.506248       9.624154 
1 1 1 6   29 29 o 28.58265 4.974822 11.02941       3.339302 16.25049       8.209295 9.994236       3.655382 30.96009 9.749104 26.74342 5.777943 4.216667       11.33268 
1 1 1 6   29 30 o 43.49454 3.516449 24.36144       3.695382 23.13510       6.781349 24.87942       4.407241 39.08146 7.391164 43.45872 4.214379 -4.377270      8.508248 
1 1 1 6   29 31 o 37.82449 4.564453 19.36332       4.122281 16.78294       6.337850 21.25538       5.427106 31.83028 8.139733 38.34554 6.004802 -6.515253      10.11498 
1 1 1 6   29 32 o 29.15742 5.433122 12.26160       3.718424 10.47911       5.934705 13.41360       4.771024 24.22984 8.322207 29.23367 6.822255 -5.003836      10.76115 
1 1 1 6   29 33 o 25.07091 5.419758 9.324907       3.214549 12.70348       6.158862 8.059903       3.768596 25.73101 8.475952 22.32624 6.520798 3.404766       10.69404 
1 1 1 6   29 34 o 16.79265 5.942573 4.383197       3.038526 6.144698       8.096170 4.094407       3.278153 18.89032 8.475847 16.38439 6.115749 2.505938       10.45191 
1 1 1 6   29 35 o 11.34355 5.073701 0.1684467      2.876425 -0.5652666     8.431731 0.2650814      3.059990 15.52581 7.483330 11.68788 5.230009 3.837932       9.129798 
1 1 1 6   29 36 o 7.902172 3.886871 -4.176797      2.619767 -6.055141      5.061305 -3.489389      3.061840 10.84049 5.345703 9.067098 4.403440 1.773394       6.925809 
1 1 1 6   30 0  o 50.32198 3.617517 31.10389       4.406530 38.16124       6.376326 24.65210       6.096629 55.62360 4.749484 44.45211 5.763654 11.17149       7.468421 
1 1 1 6   30 1  o 98.15399 2.953367 117.7265       7.056141 140.1391       10.83725 101.2329       9.296732 106.9536 4.165999 90.87077 4.209705 16.08279       5.922598 
1 1 1 6   30 2  o 108.1460 3.305904 142.9971       8.702150 161.5954       11.74678 120.3756       12.95516 114.8518 4.204153 98.91857 5.394806 15.93322       6.839505 
1 1 1 6   30 3  o 168.0230 3.540920 345.0056       14.49843 323.5968       19.00381 374.8203       22.42637 162.4550 4.805618 174.7415 5.272589 -12.28653      7.134014 
1 1 1 6   30 4  f 63.21867 3.172778 48.93645       4.872262 49.33561       6.994372 48.56016       6.790968 63.31173 4.564078 62.82329 4.464928 0.4884377      6.384857 
1 1 1 6   30 5  o 62.57979 4.171842 48.13304       6.325731 62.32756       9.965438 38.55397       8.186491 70.99325 5.811080 55.66431 6.136831 15.32894       8.451589 
1 1 1 6   30 6  o 25.46576 5.786432 8.283590       3.509026 7.384323       4.856733 9.265702       5.075517 24.41001 7.468468 26.97659 7.466903 -2.566576      10.56090 
1 1 1 6   30 7  o 22.51634 5.957231 6.457849       3.318821 6.877658       4.468019 5.941120       4.957022 23.53600 7.155947 22.61886 7.608223 0.9171429      10.44474 
1 1 1 6   30 8  o 42.07811 3.692354 21.82012       3.747796 22.49587       5.341556 21.16490       5.259759 42.48612 5.272297 41.17322 5.370062 1.312901       7.525602 
1 1 1 6   30 9  o 50.70838 3.387438 31.57515       4.161878 34.39298       5.746005 28.46541       6.036288 52.78191 4.510482 47.85809 5.262552 4.923824       6.931010 
1 1 1 6   30 10 o 68.24682 3.234952 57.06022       5.364737 61.69382       7.104434 50.91265       8.183183 70.85223 4.132656 64.15479 5.281000 6.697441       6.705804 
1 1 1 6   30 11 o 75.07226 5.098389 69.55774       9.271802 75.20357       12.48910 62.62528       13.83920 77.73479 6.656972 70.48338 8.210848 7.251404       10.57040 
1 1 1 6   30 12 f 70.91601 4.900641 62.07146       8.416939 0.000000       0.000000 62.07146       8.416939 ?        ?        70.91601 4.900641 0.000000       4.900641 
1 1 1 6   30 13 o 138.6304 3.940426 235.7321       13.29832 251.9661       23.97047 228.5140       15.98361 142.3516 6.930831 136.2645 4.821043 6.087158       8.442682 
1 1 1 6   30 14 o 18.05968 6.468142 3.455025       3.609978 -0.2939842     8.205408 4.354836       4.019923 20.78910 8.949567 19.70457 6.845544 1.084524       11.26749 
1 1 1 6   30 15 o 47.89232 3.747704 28.29423       4.339075 32.90564       9.889034 27.19474       4.828725 50.57943 8.311579 46.85892 4.275729 3.720509       9.346882 
1 1 1 6   30 16 o 91.44584 3.071231 102.4915       6.834329 101.1202       14.75169 102.8663       7.711896 89.81750 6.790057 91.54035 3.463351 -1.722855      7.622313 
1 1 1 6   30 17 o 81.52306 3.059236 81.52488       6.066782 97.09583       14.03026 77.94394       6.728320 87.95087 6.594214 79.63181 3.475611 8.319054       7.454095 
1 1 1 6   30 18 o 109.7970 3.546922 148.2480       9.477808 120.8962       16.88635 160.8273       11.45171 97.75929 7.137474 114.1833 4.122352 -16.42400      8.242410 
1 1 1 6   30 19 o 73.86298 3.384789 67.19091       6.076292 58.38687       12.22937 70.07681       7.001703 67.40176 7.576609 75.32532 3.826944 -7.923553      8.488256 
1 1 1 6   30 20 o 92.61401 3.309474 105.6531       7.457152 104.2107       14.90120 106.1350       8.613305 90.41914 6.812887 92.65836 3.822811 -2.239227      7.812126 
1 1 1 6   30 21 o 43.26380 5.014046 23.67808       5.188502 23.56238       8.608137 23.74410       6.502415 41.71724 8.747478 42.83639 6.427208 -1.119156      10.85483 
1 1 1 6   30 22 o 85.26370 3.765918 90.26701       7.805458 87.35220       13.29465 91.80025       9.642258 82.24229 6.691310 85.57451 4.641161 -3.332222      8.143342 
1 1 1 6   30 23 o 58.47272 4.120661 42.86781       5.833996 44.16491       9.939327 42.18604       7.205887 57.74096 7.221229 57.53159 5.195724 0.2093697      8.896161 
1 1 1 6   30 24 o 43.15937 5.042552 23.95220       5.203657 34.06141       9.587271 19.73032       6.195692 49.66172 8.208564 38.26380 6.898271 11.39793       10.72225 
1 1 1 6   30 25 o 29.47181 4.911054 11.34888       3.403045 21.60855       8.284839 9.266530       3.732451 38.47213 8.998224 26.18338 5.981122 12.28874       10.80471 
1 1 1 6   30 26 o 11.91292 5.140904 0.2857172E-01  2.720312 -0.5082200     6.594612 0.1386421      2.986219 17.35707 7.728201 12.55053 5.400912 4.806538       9.428411 
1 1 1 6   30 27 o 13.75035 5.612344 1.327440       2.972253 0.000000       0.000000 1.327440       2.972253 ?        ?        13.75035 5.612344 0.000000       5.612344 
1 1 1 6   30 28 o 11.19672 5.020600 -0.7781681     2.835692 -2.752146      8.311664 -0.5181358     3.016689 17.39755 8.093284 11.78745 5.238922 5.610100       9.640930 
1 1 1 6   30 29 o 30.10765 4.299794 12.07402       3.065214 16.06227       5.897428 10.59783       3.587917 32.12275 7.644862 27.42022 5.560006 4.702526       9.452914 
1 1 1 6   30 30 o 12.84097 5.599657 0.3640556      3.297298 5.057566       5.392696 -2.438332      4.166977 19.20510 7.657673 12.15470 5.679575 7.050406       9.534020 
1 1 1 6   30 31 o 11.52297 5.255184 -0.9799758     3.266747 -6.222127      5.173838 2.495358       4.212658 11.70842 5.694868 15.74697 6.577963 -4.038547      8.700640 
1 1 1 6   30 32 o 13.53432 5.537421 1.841183       2.901978 6.604422       5.132986 -0.3965353     3.518208 19.79449 7.592131 12.20933 5.522863 7.585158       9.388422 
1 1 1 6   30 33 o 12.22841 5.153708 1.184010       2.621589 9.041389       5.395310 -1.244489      2.999483 21.68812 7.888733 10.58188 4.901703 11.10625       9.287561 
1 1 1 6   30 34 o 13.87202 5.657896 2.411133       3.018033 1.025283       8.198590 2.628366       3.245965 16.06311 7.643620 14.27968 5.851008 1.783439       9.625965 
1 1 1 6   30 35 o 15.03427 6.050184 3.438654       3.398510 0.000000       0.000000 3.438654       3.398510 ?        ?        15.03427 6.050184 0.000000       6.050184 
1 1 1 6   31 0  o 16.07940 6.187799 2.106959       3.417546 2.372358       4.601821 1.780570       5.103259 18.13196 7.122840 18.26256 7.390886 -0.1306000     10.26451 
1 1 1 6   31 1  o 142.7751 3.027228 248.9740       10.53255 250.6395       15.73961 247.6233       14.17371 142.9703 4.523338 142.1877 4.094849 0.7825623      6.101506 
1 1 1 6   31 2  o 57.13628 3.471369 40.05044       4.810551 43.53367       6.790263 36.54065       6.816103 59.41202 4.729033 54.32209 5.212912 5.089928       7.038338 
1 1 1 6   31 3  o 15.55854 6.372862 1.036088       3.849169 7.731123       4.891610 -9.850349      6.237610 24.87357 7.471406 13.23701 6.394070 11.63656       9.833922 
1 1 1 6   31 4  o 97.03371 3.037784 115.1331       7.174314 116.9349       10.17817 113.3539       10.11416 97.61934 4.289030 96.10357 4.329832 1.515770       6.094524 
1 1 1 6   31 5  o 80.71526 3.342971 79.77327       6.561200 84.06797       8.575937 73.71098       10.18905 82.73757 4.267888 77.26102 5.446649 5.476547       6.919599 
1 1 1 6   31 6  o 28.03595 5.518713 9.993714       3.636122 17.60260       5.048790 1.794124       5.241106 37.41112 5.719331 18.45214 7.481884 18.95897       9.417501 
1 1 1 6   31 7  o 87.44401 2.876704 93.50581       6.121670 110.1543       9.348717 81.00876       8.099694 94.75606 4.058035 81.22572 4.105343 13.53034       5.772477 
1 1 1 6   31 8  o 68.83019 3.073229 58.01448       5.141780 69.66238       7.679711 48.55090       6.922280 75.28430 4.202732 62.75306 4.557729 12.53125       6.199666 
1 1 1 6   31 9  o 172.0036 4.011135 362.4449       16.81284 347.6911       26.64129 372.2099       21.67395 167.5948 6.535699 173.9360 5.119002 -6.341248      8.301780 
1 1 1 6   31 10 o 152.2756 3.803013 284.0252       14.11218 262.7449       21.83708 299.2863       18.49257 145.7133 6.163697 155.9766 4.871184 -10.26326      7.856182 
1 1 1 6   31 11 o 96.57613 3.260777 114.2472       7.663086 100.8643       14.86845 119.0880       8.942233 89.91640 6.836891 98.52351 3.731261 -8.607109      7.788799 
1 1 1 6   31 12 o 117.2079 3.224563 168.2484       9.201337 150.3562       18.16959 174.4196       10.67081 109.8091 6.823730 119.2486 3.676437 -9.439445      7.751095 
1 1 1 6   31 13 o 73.30230 3.343496 65.94201       5.956752 71.33897       12.70870 64.42251       6.743367 75.36858 6.999487 72.36857 3.837479 3.000015       7.982422 
1 1 1 6   31 14 o 68.91466 4.176783 58.58924       6.981452 70.66965       12.47046 53.07461       8.425588 74.95859 6.904449 65.31815 5.339910 9.640434       8.728461 
1 1 1 6   31 15 o 68.04153 4.098455 57.14819       6.764137 67.27195       11.90911 52.32689       8.218455 73.07243 6.764678 64.82562 5.247259 8.246811       8.561227 
1 1 1 6   31 16 o 52.14854 5.974310 34.30081       7.455268 25.37867       9.568705 48.08386       11.89300 43.71609 9.269950 61.04616 8.201941 -17.33007      12.37755 
1 1 1 6   31 17 o 20.87958 7.744674 4.471741       5.241149 9.956733       7.256274 -1.511090      7.578426 28.05016 9.198109 19.01072 8.383358 9.039442       12.44532 
1 1 1 6   31 18 o 27.92846 7.627118 10.29819       5.336204 25.06292       8.280591 -0.1880737     6.978448 43.56983 8.096981 18.97739 8.211829 24.59244       11.53236 
1 1 1 6   31 19 o 95.56859 4.812824 114.0393       11.17252 119.6602       15.34463 107.6972       16.29920 96.92947 6.534462 91.39266 7.381190 5.536812       9.858051 
1 1 1 6   31 20 o 66.83594 4.111742 55.65589       6.664454 52.86621       10.77300 57.38536       8.482342 63.79754 7.046702 67.43037 5.202269 -3.632832      8.758973 
1 1 1 6   31 21 o 44.62751 5.165322 25.41280       5.513819 30.32873       9.423224 22.85342       6.799303 47.15562 8.513515 41.54652 6.961804 5.609108       10.99757 
1 1 1 6   31 22 o 24.25591 5.559450 7.783419       3.215689 0.4731564      7.097115 9.671902       3.607214 19.09389 8.271761 27.06580 5.651789 -7.971912      10.01822 
1 1 1 6   31 23 o 80.15382 3.013637 79.67458       5.875936 81.37196       12.88128 79.22857       6.602937 78.26668 6.821866 79.73606 3.406026 -1.469383      7.624884 
1 1 1 6   31 24 o 32.40651 4.330245 13.51123       3.334135 15.53008       7.536418 13.01995       3.717746 32.31059 9.155551 31.53141 5.005439 0.7791824      10.43449 
1 1 1 6   31 25 o 9.926950 4.580134 -1.753236      2.581044 -9.915391      6.125161 0.8978333E-02  2.846062 12.42061 6.075018 12.12523 5.245514 0.2953825      8.026285 
1 1 1 6   31 26 o 25.44446 5.827579 8.979409       3.535520 0.000000       0.000000 8.979409       3.535520 ?        ?        25.44446 5.827579 0.000000       5.827579 
1 1 1 6   31 27 o 11.17452 4.940702 -0.3779171     2.648740 1.684618       7.757708 -0.6500897     2.818091 19.04667 8.436683 11.26223 5.030735 7.784448       9.822724 
1 1 1 6   31 28 o 14.71138 5.661978 2.424022       2.861621 -0.8670024     6.657030 3.169992       3.169390 16.29912 7.459371 16.01785 6.006392 0.2812710      9.577002 
1 1 1 6   31 29 o 35.52615 5.182513 17.56978       4.354588 17.30572       9.129460 17.64754       4.954514 29.27450 10.30588 34.85412 6.052725 -5.579622      11.95185 
1 1 1 6   31 30 o 13.43092 5.724272 1.133910       3.295639 0.6563655      5.455616 1.408304       4.135459 15.47377 6.949098 14.68797 6.338516 0.7858000      9.405677 
1 1 1 6   31 31 o 14.33798 5.776079 2.336521       3.101087 9.645879       5.629973 -0.8470226     3.715541 22.87965 8.089733 12.17085 5.571082 10.70880       9.822460 
1 1 1 6   31 32 o 16.11996 6.038400 3.871891       3.201520 -1.013139      8.229728 4.743001       3.475267 15.92061 7.598742 17.32357 6.326718 -1.402959      9.887782 
1 1 1 6   31 33 o 14.94174 5.861314 3.210197       3.112339 -12.51096      8.107427 5.927458       3.370595 12.37489 6.206854 18.70326 6.273579 -6.328371      8.825125 
1 1 1 6   31 34 o 13.76004 5.638046 2.463293       3.013943 -1.411974      7.991450 3.105913       3.254258 14.78060 7.163125 14.64165 5.910416 0.1389551      9.286732 
1 1 1 6   32 0  o 112.7606 2.938800 155.4305       8.068506 165.6339       12.09393 147.2463       10.83137 116.1969 4.278376 109.5857 4.062992 6.611191       5.900204 
1 1 1 6   32 1  o 32.59607 4.893663 13.32300       3.767263 11.24688       4.987993 16.07987       5.747877 29.57967 7.024917 35.48883 6.894818 -5.909159      9.843169 
1 1 1 6   32 2  o 89.83817 2.981283 98.71687       6.517758 103.5360       9.567860 94.54423       8.903014 91.82268 4.287752 87.75405 4.175238 4.068626       5.984766 
1 1 1 6   32 3  o 86.16865 3.025919 90.84239       6.344073 92.78789       9.208483 89.08476       8.752615 86.89729 4.362516 85.16281 4.230713 1.734482       6.077045 
1 1 1 6   32 4  o 120.3160 2.991289 176.8935       8.770372 183.9556       12.92011 170.8584       11.94371 122.4238 4.337618 118.0146 4.159558 4.409195       6.009730 
1 1 1 6   32 5  o 15.54277 6.167042 1.602788       3.480976 2.607048       4.587101 0.2392291      5.345054 18.32304 7.136637 17.25290 7.319210 1.070141       10.22264 
1 1 1 6   32 6  o 120.8920 3.257087 178.8741       9.586659 181.6126       17.34996 177.6706       11.50194 121.2036 5.891829 120.3624 3.926682 0.8411713      7.080429 
1 1 1 6   32 7  o 114.1993 4.386409 160.2761       12.18430 154.7827       15.59021 168.8973       19.53045 111.8813 5.737349 116.5071 6.910012 -4.625854      8.981394 
1 1 1 6   32 8  o 95.11349 3.280372 110.8247       7.591907 120.6402       10.27331 99.01487       11.26875 99.06025 4.265737 89.52744 5.187374 9.532814       6.716052 
1 1 1 6   32 9  o 174.2216 3.549079 371.7839       15.06794 384.4122       21.02950 358.4606       21.60054 176.6755 4.889160 170.4817 5.205468 6.193802       7.141483 
1 1 1 6   32 10 o 84.84637 2.847393 88.13097       5.878967 83.51479       8.424417 92.51306       8.208035 82.35883 4.211511 86.75702 3.892295 -4.398186      5.734700 
1 1 1 6   32 11 o 108.8831 3.787454 145.6291       10.03419 0.000000       0.000000 145.6291       10.03419 ?        ?        108.8831 3.787454 0.000000       3.787454 
1 1 1 6   32 12 o 35.81766 5.244264 16.17835       4.441794 16.85916       8.858895 15.94973       5.133720 35.71059 9.857305 35.33879 6.186624 0.3717957      11.63790 
1 1 1 6   32 13 o 115.8582 3.216551 164.6677       9.072624 147.4356       17.81568 170.7013       10.54198 108.3586 6.780869 117.8421 3.675504 -9.483452      7.712945 
1 1 1 6   32 14 o 15.51776 6.191304 1.594793       3.527342 -4.339559      7.435706 3.318019       4.006882 17.32789 7.912498 18.25820 6.771763 -0.9303112     10.41462 
1 1 1 6   32 15 o 29.12920 6.150645 11.00204       4.228808 24.70812       8.180149 6.003195       4.940141 43.41009 8.028397 22.39260 7.595126 21.01749       11.05175 
1 1 1 6   32 16 o 81.14878 4.192674 81.61633       8.262931 77.06229       12.88670 84.79587       10.76778 77.74736 6.872436 82.26585 5.401066 -4.518494      8.740818 
1 1 1 6   32 17 o 64.87119 3.756191 52.12147       5.912542 38.57612       10.63645 58.17858       7.112700 54.02103 8.348641 68.38389 4.289810 -14.36286      9.386281 
1 1 1 6   32 18 o 37.65425 4.264410 17.82359       3.844191 37.48621       9.110505 13.56449       4.240142 53.62000 7.150434 32.41578 5.568264 21.20422       9.062796 
1 1 1 6   32 19 o 69.47994 3.175351 59.67678       5.362134 62.20708       11.49806 58.97355       6.061650 69.14219 6.916856 68.92003 3.621899 0.2221603      7.807755 
1 1 1 6   32 20 o 56.48883 3.367161 39.64519       4.614102 35.75293       10.27920 40.62735       5.163538 51.06792 8.562724 57.06149 3.733881 -5.993576      9.341419 
1 1 1 6   32 21 o 16.62840 5.856009 3.232551       2.947857 1.501595       6.322064 3.713447       3.332279 18.82255 7.971502 17.70154 6.226791 1.121006       10.11522 
1 1 1 6   32 22 o 31.47513 4.504793 12.76616       3.356835 9.205975       8.021006 13.52212       3.696082 26.20761 9.605211 32.27690 4.848831 -6.069292      10.75970 
1 1 1 6   32 23 o 19.18976 5.738431 4.923235       2.890430 8.720928       6.746853 4.069535       3.198851 25.01435 8.854819 17.92557 6.111219 7.088787       10.75894 
1 1 1 6   32 24 o 15.72999 5.897831 2.728651       3.055690 0.000000       0.000000 2.728651       3.055690 ?        ?        15.72999 5.897831 0.000000       5.897831 
1 1 1 6   32 25 o 24.98887 5.280438 8.531976       3.114688 9.669914       8.248547 8.342741       3.363714 25.21621 9.636062 24.49021 5.737350 0.7260036      11.21476 
1 1 1 6   32 26 o 16.38686 5.793702 3.470603       2.887655 12.98755       7.639721 1.884301       3.119045 27.62770 9.443714 14.43502 5.800596 13.19268       11.08290 
1 1 1 6   32 27 o 26.05153 6.086963 9.880685       3.794301 7.700540       8.237332 10.46783       4.274806 22.50778 9.281973 26.43287 6.644697 -3.925098      11.41521 
1 1 1 6   32 28 o 13.38529 5.822165 0.5758007      3.545372 -0.5459342     8.280891 0.8275676      3.923117 17.49531 8.118073 14.11705 6.132624 3.378261       10.17409 
1 1 1 6   32 29 o 18.11949 6.351425 4.876378       3.464933 7.776533       7.940660 4.194306       3.850887 21.40011 8.991366 17.31573 6.591991 4.084375       11.14895 
1 1 1 6   32 30 o 19.35195 6.129036 5.855752       3.240306 12.21581       8.579680 4.797655       3.499480 23.53315 9.561459 17.71049 6.365317 5.822659       11.48646 
1 1 1 6   32 31 o 12.36703 5.395281 0.7488673      3.063798 -10.81736      8.014525 2.728429       3.315633 12.94337 6.442141 14.72770 5.958448 -1.784338      8.775208 
1 1 1 6   32 32 o 13.14105 5.549950 1.701879       3.050510 16.61950       8.895822 -0.2860549     3.247411 24.34998 9.792208 11.56127 5.259837 12.78871       11.11545 
1 1 1 6   32 33 o 11.73108 5.253073 0.3568942      3.092949 14.79462       8.941748 -1.605302      3.296433 22.15991 9.436231 10.57571 4.976558 11.58420       10.66811 
1 1 1 6   33 0  o 104.5223 2.983437 133.6575       7.591319 133.1198       11.09465 134.1309       10.40956 104.0668 4.384699 104.5201 4.094845 -0.4533768     5.999445 
1 1 1 6   33 1  o 114.0660 2.969438 159.1605       8.247017 164.5773       12.37887 154.8376       11.05857 115.7218 4.397650 112.3147 4.047035 3.407120       5.976438 
1 1 1 6   33 2  o 118.4739 3.429704 171.9289       9.891404 179.5056       18.34633 168.8239       11.74458 120.3214 6.278780 117.2619 4.116409 3.059555       7.507856 
1 1 1 6   33 3  o 47.18540 4.503689 27.58487       5.115846 36.64266       8.872066 23.07303       6.261672 53.92536 6.910018 42.77726 6.186194 11.14809       9.274554 
1 1 1 6   33 4  o 24.19412 6.809006 7.465995       4.182983 14.90869       6.582055 2.423521       5.417740 33.87917 8.085268 19.21892 7.671360 14.66025       11.14546 
1 1 1 6   33 5  o 90.78088 2.963917 100.8897       6.548079 94.00504       9.185220 108.0044       9.337419 87.38951 4.326599 93.73270 4.097795 -6.343193      5.959143 
1 1 1 6   33 6  o 49.72210 3.919667 30.51032       4.710973 31.84169       6.161283 28.63645       7.309565 50.59266 5.065492 47.63573 6.463426 2.956928       8.211886 
1 1 1 6   33 7  o 92.90837 3.242043 105.8139       7.328981 104.5493       9.547371 107.6282       11.43587 92.14847 4.263224 93.30508 5.048337 -1.156609      6.607630 
1 1 1 6   33 8  o 86.33209 2.939809 91.30460       6.175804 87.52818       8.879086 94.84375       8.595622 84.25751 4.338991 87.78632 4.028782 -3.528801      5.920973 
1 1 1 6   33 9  o 73.78328 2.974074 66.74843       5.336481 71.37311       7.593087 62.23453       7.501592 76.08884 4.110329 70.98329 4.357722 5.105553       5.990371 
1 1 1 6   33 10 o 68.09500 3.340971 56.99291       5.527086 49.32580       6.889622 70.83719       9.257944 63.10472 4.509931 75.53545 5.058695 -12.43073      6.777158 
1 1 1 6   33 11 o 42.39571 5.465238 22.65207       5.515126 17.69154       8.756526 25.91368       7.100418 36.40474 9.697212 45.05423 6.668234 -8.649483      11.76866 
1 1 1 6   33 12 o 73.36787 3.979501 66.49075       7.088297 53.81932       11.41258 74.44875       9.044250 64.89906 7.345179 77.40771 4.818492 -12.50866      8.784618 
1 1 1 6   33 13 o 92.52755 4.376297 106.0697       9.839691 121.0384       14.93130 94.57903       13.08217 98.01475 6.284408 86.61797 6.239587 11.39678       8.855858 
1 1 1 6   33 14 o 115.5071 3.651475 164.5627       10.26520 165.4690       18.13857 164.1356       12.45094 114.3109 6.538748 115.0189 4.450583 -0.7080002     7.909672 
1 1 1 6   33 15 o 54.16367 3.635649 36.34792       4.770934 35.11987       9.400602 36.77396       5.537014 51.80083 7.679220 54.32821 4.215246 -2.527378      8.760064 
1 1 1 6   33 16 o 31.99640 5.013888 13.08955       3.781094 26.65441       8.404363 9.647164       4.233765 44.71297 8.007276 27.01822 6.508106 17.69476       10.31852 
1 1 1 6   33 17 o 47.49535 3.780079 28.13213       4.339030 29.12580       9.139132 27.84296       4.930115 46.38738 8.393712 47.07647 4.346567 -0.6890907     9.452356 
1 1 1 6   33 18 f 21.36913 6.246716 5.999099       3.457128 11.92825       7.706950 4.505516       3.868131 29.42030 9.467068 19.35785 6.715619 10.06245       11.60711 
1 1 1 6   33 19 o 15.07486 6.063040 1.605149       3.410866 7.301208       7.541928 0.1405554      3.824315 24.68591 9.263638 14.25116 6.122088 10.43476       11.10383 
1 1 1 6   33 20 o 52.22293 3.867664 34.31293       4.887117 27.75356       9.061180 37.00377       5.803600 44.21478 8.719685 53.97115 4.452215 -9.756371      9.790563 
1 1 1 6   33 21 o 27.05767 5.091400 9.672421       3.233926 15.07155       7.224222 8.319339       3.616523 31.94983 8.932688 24.72326 6.052336 7.226570       10.78998 
1 1 1 6   33 22 o 11.24232 4.943349 -0.4013416     2.617377 -7.146788      5.771802 1.344898       2.936689 12.91664 6.217044 13.80421 5.599329 -0.8875704     8.366847 
1 1 1 6   33 23 o 30.91052 4.852247 12.66509       3.534734 0.000000       0.000000 12.66509       3.534734 ?        ?        30.91052 4.852247 0.000000       4.852247 
1 1 1 6   33 24 o 55.13058 3.850144 39.05029       5.140050 37.91384       10.77923 39.38475       5.847704 48.65721 9.431417 54.93534 4.405038 -6.278133      10.40942 
1 1 1 6   33 25 f 34.84930 5.116843 16.55352       4.216094 12.04488       8.658729 17.95467       4.826959 26.23180 9.908030 35.87043 5.713545 -9.638628      11.43738 
1 1 1 6   33 26 o 41.22998 4.632673 22.87215       4.574146 23.18238       10.14619 22.79301       5.124446 34.08348 10.85158 40.58338 5.308735 -6.499905      12.08054 
1 1 1 6   33 27 o 9.525984 4.531736 -2.880927      2.878009 -10.71286      7.053230 -1.316448      3.152381 12.71594 6.278048 11.14490 5.112671 1.571044       8.096498 
1 1 1 6   33 28 o 17.18965 6.149123 4.275882       3.261625 12.76318       8.216550 2.688332       3.553600 24.92394 9.593723 15.32394 6.179666 9.600005       11.41174 
1 1 1 6   33 29 o 12.72931 5.441937 1.043590       2.994926 7.848124       7.669552 -0.1806992     3.253216 20.63193 8.760667 11.96270 5.369730 8.669223       10.27537 
1 1 1 6   33 30 o 8.598214 4.193669 -4.073252      2.860034 -1.624915      7.711230 -4.463767      3.079690 15.33679 7.329780 8.837070 4.319158 6.499719       8.507690 
1 1 1 6   33 31 f 24.20347 5.861297 9.400061       3.419908 9.541527       8.968519 9.375990       3.699431 20.03766 8.960919 23.66951 6.302160 -3.631853      10.95515 
1 1 1 6   33 32 o 12.89097 5.530829 1.553771       3.113970 7.847572       7.807384 0.3631425      3.395762 18.72565 8.368415 12.12921 5.461776 6.596438       9.993066 
1 1 1 6   34 0  o 51.47009 4.619118 32.84944       5.732075 29.47205       9.114559 35.05918       7.372515 47.86209 8.103486 52.92833 5.811464 -5.066238      9.971941 
1 1 1 6   34 1  o 88.00064 3.796653 95.16833       8.122691 95.81120       13.44142 94.79852       10.19472 87.63876 6.336588 87.60835 4.793489 0.3041840E-01  7.945432 
1 1 1 6   34 2  o 92.23211 3.178457 104.2740       7.133210 101.1154       9.545424 108.2687       10.73475 90.58885 4.336580 93.65085 4.718957 -3.061996      6.408938 
1 1 1 6   34 3  o 26.84494 5.616374 9.239823       3.555902 12.84994       4.955337 5.407390       5.105639 31.56512 6.652263 21.95562 7.708842 9.609509       10.18228 
1 1 1 6   34 4  o 72.75127 3.563530 65.06160       6.298451 48.34477       9.879062 76.51021       8.175514 61.96165 6.646448 78.76102 4.275620 -16.79937      7.902924 
1 1 1 6   34 5  o 42.36147 3.880459 22.22133       3.961355 25.66920       5.756351 19.11955       5.459810 45.25983 5.320641 38.82211 5.961410 6.437721       7.990470 
1 1 1 6   34 6  o 13.11779 5.616875 -0.8317769E-01 3.199746 3.551480       4.367480 -4.294456      4.701172 18.99997 7.065548 12.97875 6.054067 6.021223       9.304498 
1 1 1 6   34 7  o 56.51875 3.662916 39.39424       5.017763 38.95266       6.508298 40.04139       7.878906 55.95535 4.819910 56.48004 5.807109 -0.5246887     7.546791 
1 1 1 6   34 8  o 45.48047 3.763671 25.60096       4.133998 27.79909       5.690507 23.14438       6.015755 47.12943 5.032546 42.72315 5.938497 4.406277       7.784103 
1 1 1 6   34 9  o 43.42728 3.655026 23.35124       3.832158 17.71375       5.140863 30.40129       5.748960 37.27171 5.852689 49.32468 4.845341 -12.05297      7.598112 
1 1 1 6   34 10 o 53.93092 3.230571 35.84243       4.226276 34.71138       5.830952 37.09423       6.134294 52.77020 4.579645 54.54274 4.659802 -1.772541      6.533521 
1 1 1 6   34 11 o 39.58665 5.111297 19.80219       4.815815 29.79462       8.038784 14.20852       6.014547 48.02482 7.081151 32.75349 7.671027 15.27133       10.43970 
1 1 1 6   34 12 o 41.51318 4.451601 21.60065       4.433125 28.28185       8.450484 19.06379       5.207179 46.42396 7.742209 38.61935 5.704482 7.804611       9.616803 
1 1 1 6   34 13 o 44.37942 4.166605 24.61238       4.453386 36.31462       8.722182 20.48595       5.179384 52.96844 6.922793 40.08798 5.442272 12.88046       8.805872 
1 1 1 6   34 14 o 15.10806 6.317449 0.7767676      3.891449 0.9661891E-01  6.226225 1.212782       4.985093 18.01945 7.776842 17.18135 7.164778 0.8381004      10.57418 
1 1 1 6   34 15 o 60.40680 3.941296 45.50000       5.770094 46.84262       10.11921 44.85314       7.023871 59.83200 7.077124 59.61569 4.877414 0.2163124      8.595048 
1 1 1 6   34 16 o 42.97707 4.631197 23.41761       4.773795 20.17974       7.740380 25.40520       6.064522 38.17949 8.534274 44.33747 5.748088 -6.157986      10.28953 
1 1 1 6   34 17 o 14.80797 6.170328 0.9419709      3.693164 4.937163       7.030011 -0.5809426     4.340350 22.31017 8.791668 14.51901 6.375557 7.791158       10.86007 
1 1 1 6   34 18 o 13.66635 5.949831 -0.2322885     3.709649 1.273583       6.452165 -0.9758775     4.533964 18.73399 7.997695 14.47255 6.428042 4.261446       10.26074 
1 1 1 6   34 19 o 52.02358 4.092300 34.29880       5.146306 43.72171       9.530165 30.42000       6.114443 56.78154 7.037988 48.36614 5.273049 8.415401       8.794221 
1 1 1 6   34 20 o 48.38597 4.198048 29.90755       4.901040 29.69561       9.151670 29.99277       5.803392 45.10708 8.640154 47.97847 5.038732 -2.871384      10.00205 
1 1 1 6   34 21 o 25.19914 7.036405 9.076160       4.485615 0.000000       0.000000 9.076160       4.485615 ?        ?        25.19914 7.036405 0.000000       7.036405 
1 1 1 6   34 22 o 36.49611 4.890903 17.68397       4.240425 20.09045       8.737544 16.94255       4.849849 34.82108 9.855206 35.09985 5.877679 -0.2787704     11.47485 
1 1 1 6   34 23 o 44.13556 4.203994 25.44093       4.466994 34.29294       9.181885 22.69617       5.112849 47.24270 8.277068 40.92584 5.247164 6.316856       9.800132 
1 1 1 6   34 24 o 25.74511 5.281139 9.238896       3.202048 25.40712       8.159055 6.295302       3.481350 39.53046 8.705600 20.77398 6.316687 18.75648       10.75584 
1 1 1 6   34 25 o 15.62363 5.827433 3.057088       2.975253 1.425340       7.001074 3.416734       3.286820 17.69691 7.915466 16.34524 6.119234 1.351675       10.00498 
1 1 1 6   34 26 o 15.79741 6.054832 3.141517       3.263185 10.66044       7.661317 1.475154       3.606702 23.97871 9.254942 14.24649 6.026648 9.732220       11.04420 
1 1 1 6   34 27 o 18.99580 6.081478 5.500978       3.183210 5.073865       7.253489 5.602857       3.542572 19.23409 8.347294 19.04157 6.431849 0.1925240      10.53784 
1 1 1 6   34 28 o 14.12589 5.725364 2.238316       3.067638 -1.962966      7.697719 3.031499       3.344703 15.56173 7.405439 15.29807 6.053020 0.2636595      9.564496 
1 1 1 6   34 29 o 27.00983 5.506921 11.10396       3.501614 21.70443       9.142384 9.281577       3.790673 29.04503 10.30511 23.69504 6.410703 5.349991       12.13641 
1 1 1 6   34 30 o 9.792975 4.614978 -1.847238      2.853423 -0.1833502     7.258629 -2.151362      3.103259 15.25951 7.241331 10.04028 4.755836 5.219227       8.663421 
1 1 1 6   34 31 o 14.81358 5.832998 3.239721       3.092426 18.67386       9.825603 1.542789       3.257994 23.88881 10.01713 13.03407 5.625409 10.85473       11.48861 
1 1 1 6   35 0  o 71.40166 3.690089 62.79173       6.398901 70.92458       11.22169 58.87308       7.789405 75.19809 6.178156 68.90848 4.666212 6.289612       7.742296 
1 1 1 6   35 1  o 26.43813 6.947803 9.084978       4.533910 6.754999       7.286781 10.55685       5.791543 25.02917 9.157986 28.46449 8.012336 -3.435326      12.16825 
1 1 1 6   35 2  o 157.7636 3.177923 305.1990       12.21761 318.4989       18.80865 295.4908       16.06950 160.4370 4.816248 154.7851 4.264333 5.651932       6.432790 
1 1 1 6   35 3  o 77.75546 2.909173 74.17561       5.502626 68.56993       8.265327 78.63796       7.374428 74.37344 4.582689 79.87253 3.799635 -5.499092      5.953004 
1 1 1 6   35 4  o 28.13291 5.871030 10.21794       3.894692 7.414155       4.934787 14.84901       6.342164 24.21045 7.549313 33.57016 7.887289 -9.359711      10.91794 
1 1 1 6   35 5  o 28.05317 5.257710 10.07812       3.462274 12.55089       4.913081 7.638667       4.879877 31.04371 6.691799 24.46212 7.486591 6.581596       10.04138 
1 1 1 6   35 6  o 26.45049 5.810243 9.064312       3.642505 12.02605       5.034958 5.812145       5.276055 30.29796 6.965278 22.39817 7.838521 7.899794       10.48606 
1 1 1 6   35 7  o 28.30412 5.390433 10.29736       3.582258 9.986981       4.865632 10.66473       5.293530 27.56433 7.174990 28.44166 7.522972 -0.8773365     10.39594 
1 1 1 6   35 8  o 71.58258 3.346159 63.15860       5.820852 75.99559       7.766028 46.70134       8.793185 78.32298 4.082966 60.71595 6.022303 17.60704       7.275901 
1 1 1 6   35 9  o 23.96030 5.823702 7.486932       3.366711 10.27853       3.985294 0.5293207      6.291646 28.08913 6.004224 18.53198 7.904109 9.557154       9.926009 
1 1 1 6   35 10 o 60.00108 3.171751 44.42006       4.621138 42.23595       6.298970 46.96569       6.800342 58.14166 4.480291 61.29250 4.586141 -3.150841      6.411373 
1 1 1 6   35 11 o 35.22316 5.237304 15.86815       4.358855 19.18502       7.762798 14.34083       5.267671 37.52785 8.663778 32.96026 6.784566 4.567585       11.00415 
1 1 1 6   35 12 o 28.98301 5.684154 10.95698       3.871115 12.80521       6.546156 9.963073       4.800430 30.62102 8.481601 27.28289 7.139105 3.338137       11.08622 
1 1 1 6   35 13 o 25.73540 6.018898 8.762489       3.707015 11.19260       6.505718 7.594132       4.510972 28.64022 8.619415 23.94964 7.170451 4.690586       11.21203 
1 1 1 6   35 14 o 26.84153 6.480373 9.654197       4.190320 14.86892       7.018117 6.765296       5.223616 32.60353 8.679954 23.02213 7.809984 9.581400       11.67636 
1 1 1 6   35 15 o 35.25275 4.882527 15.98397       4.081967 23.25301       7.632326 13.07173       4.830946 41.14057 7.900019 31.18393 6.565135 9.956638       10.27187 
1 1 1 6   35 16 o 14.29618 5.886292 1.113491       3.305838 5.663195       5.727134 -1.159866      4.048364 21.84131 8.096824 13.50581 6.031523 8.335501       10.09643 
1 1 1 6   35 17 o 12.63540 5.429639 0.1065686      3.009859 2.079194       5.658579 -0.6717547     3.554389 18.30309 7.633059 12.94408 5.723217 5.359006       9.540378 
1 1 1 6   35 18 o 48.18811 3.662890 29.32641       4.269078 30.39479       8.818412 28.99937       4.878905 46.11615 8.144693 47.63174 4.247820 -1.515587      9.185859 
1 1 1 6   35 19 o 54.16434 4.130616 37.53830       5.410985 0.000000       0.000000 37.53830       5.410985 ?        ?        54.16434 4.130616 0.000000       4.130616 
1 1 1 6   35 20 o 17.71654 6.211332 4.038573       3.313868 10.41037       8.012798 2.723859       3.639728 26.01378 9.589109 16.26149 6.350376 9.752295       11.50123 
1 1 1 6   35 21 o 15.54036 5.968648 2.645818       3.175424 15.62750       7.402783 -0.2813855     3.515249 30.86593 9.172323 12.90059 5.698366 17.96534       10.79828 
1 1 1 6   35 22 o 13.01654 5.530861 0.7346287      3.060515 1.222939       7.200876 0.6269722      3.381097 18.14211 8.076816 13.41375 5.759285 4.728362       9.919895 
1 1 1 6   35 23 o 33.72826 4.433386 15.21312       3.555751 19.94518       8.601028 14.23766       3.905080 33.05663 9.902129 32.12802 5.162662 0.9286118      11.16715 
1 1 1 6   35 24 o 32.21654 4.696301 14.17133       3.578570 33.80133       9.661242 11.04983       3.852605 44.13176 9.278426 27.52940 5.918861 16.60235       11.00555 
1 1 1 6   35 25 o 13.88134 5.804270 1.557587       3.284718 -8.182963      7.450182 3.907860       3.659606 13.73788 6.715176 16.93364 6.430983 -3.195756      9.297910 
1 1 1 6   35 26 o 11.86705 5.317657 -0.2380126     3.175456 6.130074       7.673095 -1.554040      3.488177 19.84647 8.599322 11.38105 5.276771 8.465425       10.08923 
1 1 1 6   35 27 o 12.32434 5.397389 0.5708477      3.092064 4.825312       7.455911 -0.3128485     3.398051 18.47120 8.221252 12.00578 5.429555 6.465424       9.852363 
1 1 1 6   35 28 o 14.20010 5.793619 2.424276       3.165830 -2.071250      8.177769 3.216775       3.433555 15.38776 7.404864 15.29606 6.106576 0.9170628E-01  9.598036 
1 1 1 6   35 29 o 30.70012 5.037425 14.03876       3.638048 33.59237       10.33906 11.27561       3.886607 35.55897 10.90009 26.20227 6.186635 9.356699       12.53341 
1 1 1 6   35 30 o 14.69312 5.782164 3.144388       3.037187 3.770185       8.322637 3.048244       3.262164 16.93744 7.950429 14.66932 5.919012 2.268111       9.911812 
1 1 1 6   36 0  o 21.78554 6.284453 6.107227       3.520086 6.970750       4.812928 5.114036       5.161653 23.50384 7.472810 21.47380 7.728992 2.030037       10.75082 
1 1 1 6   36 1  o 91.33489 3.026535 102.5132       6.726952 100.1217       9.583898 104.8356       9.444329 89.84206 4.390800 91.99760 4.223952 -2.155533      6.092692 
1 1 1 6   36 2  o 20.00007 7.031791 4.566718       4.249187 7.568309       7.116374 2.903625       5.297136 25.46096 9.085737 19.28049 7.621057 6.180473       11.85880 
1 1 1 6   36 3  o 71.51022 3.458858 63.09045       6.009621 60.51118       11.38788 64.08601       7.074987 68.78329 6.886481 71.90808 4.053911 -3.124786      7.991109 
1 1 1 6   36 4  o 95.26838 2.820482 111.4695       6.540782 114.6869       10.10208 109.1472       8.582670 96.12513 4.323652 93.98285 3.755025 2.142281       5.726620 
1 1 1 6   36 5  o 21.33809 6.243065 5.870437       3.451780 9.915247       4.391361 -0.6692985     5.583804 27.43972 6.639799 16.65351 7.274129 10.78621       9.848852 
1 1 1 6   36 6  o 30.26050 6.353104 11.99718       4.535424 8.701668       4.961867 28.73494       11.18233 25.70635 7.474943 45.46286 10.32913 -19.75651      12.75013 
1 1 1 6   36 7  o 44.39258 3.697473 24.51797       3.963637 22.40950       5.223324 27.38031       6.085884 41.99552 5.216044 46.38247 5.490712 -4.386948      7.573310 
1 1 1 6   36 8  o 34.61834 4.497586 15.16551       3.704607 15.97258       4.968925 14.15547       5.558765 35.05671 6.034041 32.57651 7.194623 2.480198       9.390008 
1 1 1 6   36 9  o 10.55009 4.891076 -2.412951      2.995903 -3.774693      3.768324 -0.7369427E-01 4.939010 11.32849 5.327691 16.00546 6.917113 -4.676970      8.731022 
1 1 1 6   36 10 o 39.67487 4.885672 20.04107       4.623982 20.53992       7.888374 19.77993       5.707330 38.60275 8.605334 38.90949 6.229297 -0.3067360     10.62337 
1 1 1 6   36 11 o 56.32455 3.990298 39.71119       5.441497 45.53154       9.874855 37.17315       6.520863 58.77306 7.034260 54.07546 5.005235 4.697601       8.633261 
1 1 1 6   36 12 o 15.75409 6.354849 1.733504       3.759049 8.143022       6.578087 -1.374490      4.580649 25.06359 8.753758 14.33470 6.407760 10.72889       10.84839 
1 1 1 6   36 13 o 38.36311 4.579855 18.80288       4.197086 25.89976       7.523048 15.59577       5.057278 43.71957 7.319788 34.19624 6.300889 9.523327       9.658182 
1 1 1 6   36 14 o 10.21235 4.850071 -3.717134      3.268935 -7.223828      5.984124 -2.225627      3.902691 13.37479 6.409500 12.44863 5.702517 0.9261627      8.579067 
1 1 1 6   36 15 o 29.70489 5.313276 11.67368       3.704948 12.21222       6.964587 11.46113       4.375422 28.89884 8.961717 28.97324 6.370840 -0.7439423E-01 10.99545 
1 1 1 6   36 16 o 11.76466 5.299203 -1.190359      3.199336 7.183534       5.625812 -5.193022      3.889520 23.03619 8.091720 10.62265 5.110522 12.41355       9.570442 
1 1 1 6   36 17 o 46.66589 4.482183 28.15195       5.034520 0.000000       0.000000 28.15195       5.034520 ?        ?        46.66589 4.482183 0.000000       4.482183 
1 1 1 6   36 18 o 38.48220 4.273282 19.21868       3.939866 25.22421       8.068990 17.33869       4.514616 40.99678 8.360388 35.94998 5.313163 5.046799       9.905847 
1 1 1 6   36 19 o 22.70512 6.200776 7.341697       3.526943 9.305766       7.256612 6.734231       4.035676 24.60831 9.115652 21.63967 6.838309 2.968637       11.39551 
1 1 1 6   36 20 o 17.97153 6.122004 4.404394       3.210049 12.63853       6.940135 2.163358       3.620623 27.60040 8.992080 15.36791 6.223206 12.23249       10.93553 
1 1 1 6   36 21 o 12.74502 5.497683 0.4366499      3.108444 -2.515460      6.657640 1.259590       3.515104 15.53418 7.232156 14.18127 5.971714 1.352906       9.378990 
1 1 1 6   36 22 o 33.82480 4.525618 15.42388       3.636828 17.12592       7.773322 14.94691       4.114978 30.74197 9.456464 32.69668 5.349300 -1.954716      10.86461 
1 1 1 6   36 23 o 29.16030 5.659992 12.27135       3.876936 14.30084       7.991507 11.64669       4.433618 27.14023 9.634149 27.54102 6.676269 -0.4007835     11.72132 
1 1 1 6   36 24 o 11.30379 5.146446 -0.8864938     3.116038 6.459836       7.641476 -2.351716      3.412666 20.36325 8.698723 10.79848 5.075805 9.564768       10.07132 
1 1 1 6   36 25 o 46.33511 4.378979 29.49905       4.885808 31.27121       9.970387 28.93902       5.604890 38.18966 10.42402 44.85872 5.224937 -6.669067      11.66019 
1 1 1 6   36 26 o 13.09976 5.567557 1.382385       3.102538 1.061724       7.116635 1.457629       3.447387 16.23594 7.530972 13.56268 5.819216 2.673261       9.517290 
1 1 1 6   36 27 o 23.15424 5.961891 8.590816       3.384079 16.99131       8.634571 7.066307       3.678353 25.58557 9.838280 20.38551 6.538482 5.200058       11.81285 
1 1 1 6   36 28 o 28.46011 5.557996 12.58303       3.716367 16.22172       9.532248 11.93080       4.035718 23.37221 9.837509 26.84243 6.281633 -3.470219      11.67200 
1 1 1 6   37 0  o 55.82124 3.819979 38.73452       5.165009 35.74165       6.414610 44.25232       8.709807 53.23232 5.003586 58.78880 6.171544 -5.556488      7.945050 
1 1 1 6   37 1  o 63.26916 4.089940 49.86398       6.272086 54.78070       7.106170 32.53033       13.34268 66.20413 4.430177 47.44133 11.63203 18.76280       12.44711 
1 1 1 6   37 2  o 14.70543 6.390062 -0.3607112     4.261946 3.838904       5.761716 -5.434987      6.333360 20.51924 7.996552 14.95468 6.992532 5.564560       10.62263 
1 1 1 6   37 3  o 65.91498 3.278514 53.72328       5.249670 56.04697       7.367668 51.32694       7.481959 66.88466 4.547343 63.87566 4.842749 3.009003       6.643083 
1 1 1 6   37 4  o 14.92651 5.813881 1.860040       3.044336 1.211395       4.025171 2.727015       4.653550 15.72597 6.487144 18.14116 7.151677 -2.415194      9.655542 
1 1 1 6   37 5  o 51.44590 3.868525 33.02535       4.814367 42.51791       9.539235 29.78113       5.576702 56.99773 7.015694 48.53752 4.776627 8.460209       8.487410 
1 1 1 6   37 6  o 36.28011 4.916575 16.81726       4.235015 19.53578       7.754272 15.66169       5.055614 37.58586 8.646211 34.52076 6.239352 3.065094       10.66239 
1 1 1 6   37 7  o 65.34491 3.137772 52.85880       4.981937 48.48927       6.862698 57.72707       7.243783 62.03109 4.572061 67.78517 4.409180 -5.754086      6.351740 
1 1 1 6   37 8  o 16.93732 6.014331 3.291941       3.114645 2.033172       3.931846 5.412552       5.103334 16.34872 6.532049 21.34636 7.684941 -4.997641      10.08593 
1 1 1 6   37 9  o 44.13635 3.792973 24.44397       4.040024 21.04285       5.395947 28.78276       6.094540 40.21281 5.663035 47.26156 5.387830 -7.048752      7.816565 
1 1 1 6   37 10 o 77.07767 3.303351 73.86723       6.190290 65.13760       7.749385 89.25913       10.29001 71.78379 4.451920 83.63308 5.072809 -11.84929      6.749295 
1 1 1 6   37 11 o 46.71542 4.743024 27.95214       5.324709 32.54985       8.564731 25.05545       6.798189 48.84657 7.428988 43.20866 6.670889 5.637909       9.984520 
1 1 1 6   37 12 o 19.18181 6.610845 4.635067       3.745880 10.56254       6.760867 2.009500       4.499656 27.18974 8.876314 16.86570 6.897231 10.32404       11.24103 
1 1 1 6   37 13 o 44.08737 4.141651 24.78013       4.397518 22.68997       7.829828 25.74324       5.314965 39.64025 8.368615 44.51352 4.985269 -4.873268      9.740976 
1 1 1 6   37 14 o 14.08810 5.927769 0.8376172      3.459204 -2.875402      6.061392 2.631015       4.212569 15.32069 7.050702 16.98794 6.769931 -1.667251      9.774680 
1 1 1 6   37 15 o 64.84192 5.008612 54.99635       7.852938 0.000000       0.000000 54.99635       7.852938 ?        ?        64.84192 5.008612 0.000000       5.008612 
1 1 1 6   37 16 o 80.09404 3.798802 81.74880       7.393387 83.77101       12.75135 80.72468       9.074421 77.43631 6.827181 78.61994 4.758700 -1.183632      8.321997 
1 1 1 6   37 17 o 11.96536 5.335203 -0.6350453     3.154599 0.8914951      5.752019 -1.291707      3.772568 16.83299 7.367006 12.55513 5.695132 4.277869       9.311676 
1 1 1 6   37 18 o 18.42057 6.337357 4.644167       3.441857 7.248539       6.268969 3.520366       4.118029 22.24998 8.424612 17.38098 6.764117 4.868998       10.80404 
1 1 1 6   37 19 o 47.14152 4.609095 29.59477       5.227299 38.68979       9.190466 25.24548       6.355427 50.43405 7.723386 41.91946 6.426054 8.514591       10.04713 
1 1 1 6   37 20 o 16.82651 6.114774 3.754052       3.240598 -1.763353      5.644775 6.466386       3.957772 14.65051 6.764446 20.78491 6.791742 -6.134405      9.585691 
1 1 1 6   37 21 o 32.44260 5.574269 14.98424       4.248202 23.22224       8.531730 12.26841       4.898658 35.62649 9.608517 27.94948 7.160768 7.677008       11.98333 
1 1 1 6   37 22 o 17.34506 6.193871 4.321914       3.307791 -0.4085664     6.862527 5.753572       3.775297 16.15726 7.459555 19.38268 6.638284 -3.225418      9.985579 
1 1 1 6   37 23 f 12.93297 5.588441 0.8421404      3.222879 -9.969739      6.679315 4.123315       3.679561 12.23402 6.052775 16.99495 6.449837 -4.760936      8.845139 
1 1 1 6   37 24 o 24.15315 6.111276 9.165161       3.599267 19.94853       8.826177 7.014234       3.941924 29.18069 10.14311 20.53445 6.781730 8.646231       12.20141 
1 1 1 6   37 25 o 15.40446 5.971795 3.325678       3.200229 -6.791077      7.642415 5.476831       3.524079 13.67136 6.707277 18.34059 6.407087 -4.669231      9.275685 
1 1 1 6   37 26 f 18.91211 6.301702 5.973626       3.401684 14.67145       8.975875 4.514872       3.675888 23.36385 9.667276 16.83417 6.432752 6.529678       11.61191 
1 1 1 6   37 27 o 14.60405 5.861642 2.917940       3.181095 -0.7007205     8.196531 3.559653       3.451648 15.50015 7.447195 15.48507 6.142015 0.1508141E-01  9.653241 
1 1 1 6   38 0  o 27.56672 5.327027 9.925790       3.449029 11.41374       4.713040 8.210135       5.060839 29.13454 6.767966 24.77761 7.631730 4.356932       10.20042 
1 1 1 6   38 1  o 53.08414 3.593349 35.13116       4.620970 38.06812       6.570572 32.25689       6.500076 54.71260 4.982713 50.14392 5.404678 4.568687       7.351052 
1 1 1 6   38 2  o 20.38358 6.129516 5.431094       3.290956 4.954737       4.435189 6.014674       4.909030 20.31953 7.180604 21.92835 7.567492 -1.608816      10.43207 
1 1 1 6   38 3  o 22.47343 6.039237 6.722074       3.377855 8.190071       4.915154 5.408252       4.649893 24.66364 7.506827 21.00568 7.358151 3.657959       10.51165 
1 1 1 6   38 4  o 18.78121 6.205091 4.434429       3.299972 3.688074       4.403650 5.390363       4.983727 18.72793 7.067628 21.17779 7.598059 -2.449865      10.37699 
1 1 1 6   38 5  o 57.11303 3.363241 40.62166       4.660179 34.85753       6.330276 47.44162       6.885677 52.18663 5.040334 61.15114 4.655674 -8.964516      6.861506 
1 1 1 6   38 6  o 23.29616 5.838708 7.265377       3.307762 5.709817       4.477716 9.133911       4.907538 21.16854 7.230048 25.77642 7.415602 -4.607878      10.35687 
1 1 1 6   38 7  o 84.26360 4.128929 89.43852       8.452578 91.56756       13.24932 87.97729       10.97642 83.20970 6.587786 82.54893 5.487645 0.6607742      8.573982 
1 1 1 6   38 8  o 61.17882 3.968930 47.20039       5.885188 61.91019       11.15225 41.52293       6.928455 67.97616 6.824630 56.76752 5.061444 11.20864       8.496694 
1 1 1 6   38 9  o 46.47685 5.286598 28.15774       5.881258 37.57338       9.385248 22.06955       7.546834 52.08766 7.619268 39.38605 8.132478 12.70161       11.14408 
1 1 1 6   38 10 o 46.80126 3.655796 27.64281       4.136360 25.60729       5.623340 30.04258       6.105791 44.19475 5.328833 47.91444 5.318750 -3.719685      7.528981 
1 1 1 6   38 11 o 57.73603 4.330917 42.68043       6.049036 37.95707       9.374185 46.05049       7.918201 51.91899 7.637196 59.07901 5.565502 -7.160011      9.449951 
1 1 1 6   38 12 f 14.77350 6.682295 -1.494080      5.149380 0.000000       0.000000 -1.494080      5.149380 ?        ?        14.77350 6.682295 0.000000       6.682295 
1 1 1 6   38 13 o 27.91666 7.173916 11.29491       4.906512 0.000000       0.000000 11.29491       4.906512 ?        ?        27.91666 7.173916 0.000000       7.173916 
1 1 1 6   38 14 o 15.81147 6.211854 2.519231       3.500264 -2.842376      5.810837 5.572576       4.385097 14.72362 6.821017 20.21719 7.140346 -5.493571      9.874756 
1 1 1 6   38 15 o 12.06791 5.416580 -0.8351718     3.309593 6.832928       5.980835 -4.219621      3.973397 21.95407 8.247083 11.08839 5.288932 10.86569       9.797305 
1 1 1 6   38 16 o 38.59149 4.583525 19.77237       4.226398 29.97781       8.284739 16.18209       4.913904 44.36345 7.955597 33.76276 6.200891 10.60070       10.08675 
1 1 1 6   38 17 o 13.64162 5.809814 0.8756245      3.390511 10.62345       6.721962 -2.450564      3.926592 25.31691 8.848510 11.90903 5.547672 13.40789       10.44379 
1 1 1 6   38 18 o 51.97434 4.469030 35.98408       5.605381 39.09064       9.611601 34.38295       6.900320 49.59977 8.241151 49.35711 5.850638 0.2426567      10.10676 
1 1 1 6   38 19 o 15.70246 6.381033 2.567967       3.822061 1.016324       6.781703 3.290218       4.626864 17.16970 7.726133 17.09988 6.993645 0.6982040E-01  10.42133 
1 1 1 6   38 20 o 14.10073 6.028433 1.277951       3.675477 -0.9235653     6.727250 2.214757       4.388353 15.85023 7.341640 15.71461 6.647702 0.1356258      9.904121 
1 1 1 6   38 21 o 13.62747 5.748596 1.432895       3.266526 3.149384       6.641371 0.8851511      3.751683 17.77865 7.843676 13.70258 5.974252 4.076069       9.859763 
1 1 1 6   38 22 o 21.47846 6.201632 7.286017       3.426432 9.125010       7.789548 6.844822       3.815376 21.54993 8.968925 20.49131 6.666609 1.058626       11.17521 
1 1 1 6   38 23 o 16.56515 6.214569 4.096364       3.393747 8.644364       8.016246 3.103209       3.746014 20.73963 8.885649 15.52954 6.314835 5.210090       10.90100 
1 1 1 6   38 24 o 19.91349 6.436345 6.622229       3.559729 6.065260       9.210787 6.720026       3.859621 18.97882 8.718567 19.83147 6.713434 -0.8526497     11.00380 
1 1 1 6   38 25 o 21.49185 6.249563 7.709614       3.468366 15.23317       8.906197 6.364630       3.765646 23.66087 9.693002 19.18648 6.627570 4.474386       11.74219 
1 1 1 6   39 0  o 19.17100 6.139879 4.775378       3.244414 3.377407       4.224976 6.784522       5.065013 18.04689 6.896405 22.67303 7.690516 -4.626139      10.32978 
1 1 1 6   39 1  o 58.16468 3.697522 42.47379       5.213772 36.33885       6.435755 54.18876       8.893340 53.11606 5.032082 64.46245 5.720720 -11.34639      7.618956 
1 1 1 6   39 2  o 50.50618 3.663878 32.06414       4.478768 33.70242       6.171571 30.24137       6.509825 51.11858 5.018915 48.03879 5.669972 3.079792       7.572192 
1 1 1 6   39 3  o 22.10950 5.918620 6.605600       3.251939 10.39466       4.842143 3.492477       4.389042 27.29902 7.182986 18.28476 7.018559 9.014265       10.04268 
1 1 1 6   39 4  o 12.41845 5.355871 0.2197089E-01  2.949136 -1.691512      4.040092 1.976460       4.314872 13.02345 5.902012 16.57265 6.762967 -3.549200      8.976160 
1 1 1 6   39 5  o 36.05550 4.825334 16.89453       4.133357 16.82176       7.296987 16.92891       5.015612 33.77538 8.784128 35.51262 6.009846 -1.737240      10.64327 
1 1 1 6   39 6  o 37.22837 4.107077 17.72917       3.664146 18.67203       5.301275 16.86672       5.070214 37.24687 6.047815 35.33174 6.109776 1.915134       8.596827 
1 1 1 6   39 7  o 19.43125 6.089048 5.058695       3.206229 1.759340       4.139944 10.00343       5.068173 16.01182 6.589347 26.42858 7.514526 -10.41677      9.994378 
1 1 1 6   39 8  o 45.11303 3.907794 25.94762       4.253727 29.65837       5.588817 20.83806       6.558140 47.68388 4.878313 38.38163 7.277912 9.302250       8.761618 
1 1 1 6   39 9  o 19.66958 5.999380 5.279168       3.137140 4.548555       4.151000 6.252273       4.790592 19.02029 6.919339 21.41780 7.470995 -2.397509      10.18298 
1 1 1 6   39 10 o 46.37139 5.266363 28.61321       5.845814 0.000000       0.000000 28.61321       5.845814 ?        ?        46.37139 5.266363 0.000000       5.266363 
1 1 1 6   39 11 o 36.71157 5.234490 18.10473       4.550406 15.71752       8.068939 19.21798       5.510201 30.85845 9.658127 37.09442 6.322180 -6.235970      11.54337 
1 1 1 6   39 12 o 18.53665 6.516133 4.585754       3.648720 8.979159       6.109545 2.150026       4.549071 24.25811 8.438554 16.52032 6.863024 7.737793       10.87705 
1 1 1 6   39 13 o 13.27420 5.821958 0.1141758E-01  3.609530 -2.484606      6.259524 1.254871       4.418062 15.31158 7.088537 15.49079 6.615716 -0.1792059     9.696136 
1 1 1 6   39 14 o 17.71444 6.495362 4.086600       3.668584 8.817474       6.729449 2.086079       4.376030 23.70660 8.778914 16.10974 6.714978 7.596867       11.05261 
1 1 1 6   39 15 o 41.33451 5.404360 23.55999       5.313434 23.29576       8.395448 23.73655       6.862793 37.00307 9.317545 39.62826 7.377992 -2.625187      11.88492 
1 1 1 6   39 16 o 25.29103 6.076361 9.352530       3.698079 9.986301       7.100904 9.116665       4.331902 24.21162 9.008142 24.37411 6.952864 -0.1624908     11.37932 
1 1 1 6   39 17 o 11.53909 5.381876 -2.215264      3.713383 -2.804440      6.715483 -1.955773      4.456726 15.14975 7.120848 12.86016 5.963242 2.289588       9.287989 
1 1 1 6   39 18 o 29.40191 6.325233 13.03259       4.397426 11.79578       8.461269 13.49027       5.147153 24.50633 9.648845 28.96778 7.296422 -4.461454      12.09702 
1 1 1 6   39 19 o 23.29595 6.208266 8.358586       3.588006 4.478391       6.911291 9.790220       4.198057 18.80432 8.154468 24.77367 6.764785 -5.969345      10.59517 
1 1 1 6   39 20 o 23.07347 6.309853 8.411671       3.649277 23.60012       8.625557 5.100307       4.027483 33.62486 9.877434 18.16467 6.779081 15.46019       11.97997 
1 1 1 6   39 21 f 13.83134 5.812448 1.781653       3.319374 5.621222       7.505919 0.8481848      3.700943 19.01414 8.365591 13.37704 5.880232 5.637099       10.22547 
1 1 1 6   39 22 o 14.90464 6.087141 2.746298       3.498995 -0.7634586     7.389332 3.760712       3.972595 15.54539 7.356136 16.26406 6.542597 -0.7186728     9.844710 
1 1 1 6   39 23 o 14.37523 6.009377 2.356978       3.519731 7.013909       8.401885 1.365753       3.876260 19.20455 8.624206 13.76654 6.035698 5.438012       10.52647 
1 1 1 6   40 0  o 12.07879 5.365731 -0.6925924     3.160519 4.379999       4.365202 -6.281484      4.581970 19.06559 7.068653 11.35464 5.483666 7.710945       8.946309 
1 1 1 6   40 1  f 36.07491 4.229589 16.77822       3.647731 12.68910       5.272794 20.53154       5.051650 29.75593 7.322245 39.30773 5.417675 -9.551805      9.108594 
1 1 1 6   40 2  o 24.59519 5.981897 8.347145       3.550341 11.48121       5.264726 5.733090       4.808160 28.14644 7.528967 20.87939 7.466311 7.267046       10.60336 
1 1 1 6   40 3  o 22.53753 6.351588 7.083979       3.637230 5.141643       4.831682 9.624187       5.525492 20.16927 7.444192 25.63433 7.987615 -5.465059      10.91870 
1 1 1 6   40 4  o 24.55072 6.680758 8.543946       4.102686 15.06247       6.558549 4.353368       5.258602 31.60513 8.380306 19.56913 7.635674 12.03600       11.33724 
1 1 1 6   40 5  o 22.45991 5.828590 6.992492       3.217380 4.830188       4.548076 9.158579       4.552052 19.53926 7.220497 25.17859 7.108970 -5.639334      10.13277 
1 1 1 6   40 6  o 23.78792 6.521255 8.051853       3.892389 3.795957       6.963090 9.986213       4.694345 20.21487 8.451564 26.18081 7.155298 -5.965940      11.07372 
1 1 1 6   40 7  o 25.72363 5.976739 9.267893       3.674906 11.86644       6.499899 8.046998       4.455342 27.55670 8.674574 23.50939 7.145366 4.047312       11.23853 
1 1 1 6   40 8  o 20.39570 6.633579 5.847363       3.777810 -4.598669      6.074262 12.43678       4.824376 14.17562 6.696424 29.26464 6.881337 -15.08902      9.601817 
1 1 1 6   40 9  o 22.20762 5.927583 6.974527       3.267687 13.81265       4.674831 0.4413967      4.569388 31.15798 6.372015 15.06565 6.580429 16.09233       9.159946 
1 1 1 6   40 10 o 10.66407 4.913763 -1.707866      2.956848 0.4230044      3.710381 -5.416099      4.894671 13.79296 5.978089 12.03084 5.773695 1.762124       8.311024 
1 1 1 6   40 11 o 59.97991 5.353146 48.86933       7.742250 48.05038       10.28293 49.94125       11.76440 56.63001 7.646540 55.97112 8.924704 0.6588936      11.75244 
1 1 1 6   40 12 o 10.24909 4.885419 -3.555944      3.378803 -3.412854      6.235147 -3.615431      4.020253 14.65898 6.881106 11.39218 5.401153 3.266791       8.747689 
1 1 1 6   40 13 o 16.33600 6.348193 3.143684       3.623042 3.212756       6.956172 3.117971       4.244150 18.93081 8.195186 16.82429 6.764415 2.106518       10.62631 
1 1 1 6   40 14 o 41.59431 4.675042 23.40789       4.656713 34.29785       9.686550 20.13461       5.310650 44.82055 9.177761 37.37356 6.036731 7.446991       10.98515 
1 1 1 6   40 15 o 17.41942 6.885477 3.886878       4.323961 12.99770       7.934268 0.3786522E-01  5.157066 26.06618 9.553174 14.95995 6.734117 11.10623       11.68809 
1 1 1 6   40 16 o 16.56362 6.351209 3.633410       3.591497 2.476733       7.032299 4.041564       4.177372 17.86017 7.964556 17.35233 6.795386 0.5078487      10.46955 
1 1 1 6   40 17 o 25.07914 6.559639 9.903308       4.053915 21.82763       8.981240 6.852213       4.543047 32.03032 10.21095 20.48403 7.264678 11.54629       12.53152 
1 1 1 6   40 18 o 15.30501 6.193501 2.803659       3.583362 3.703431       7.353853 2.523498       4.103489 18.18458 8.124506 15.42385 6.470935 2.760725       10.38656 
1 1 1 6   40 19 o 17.80668 6.363788 4.932106       3.492470 -0.1481509     7.028237 6.597905       4.024527 15.82810 7.389502 19.93548 6.853031 -4.107380      10.07813 
1 1 1 6   40 20 o 10.55364 4.997366 -2.441799      3.421115 0.9814528E-01  7.833726 -3.040383      3.802932 16.23506 7.649545 10.83457 5.169631 5.400491       9.232585 
1 1 1 6   40 21 o 12.37800 5.543376 0.2205740      3.445292 2.205865       7.894287 -0.2465345     3.829214 16.93816 7.882241 12.51688 5.701199 4.421276       9.727969 
1 1 1 6   41 0  o 12.03842 5.419466 -1.000896      3.340858 -0.8907697E-01 4.692712 -1.937996      4.757323 14.90605 6.584073 13.74478 6.296170 1.161273       9.109982 
1 1 1 6   41 1  o 23.22192 5.989301 7.596068       3.411395 9.629010       4.804141 5.528399       4.844999 25.49270 7.338022 20.31158 7.461709 5.181118       10.46536 
1 1 1 6   41 2  o 16.29029 6.241548 2.965194       3.466727 2.132626       5.632260 3.473003       4.398691 17.66273 7.503977 17.72849 6.964005 -0.6575584E-01 10.23753 
1 1 1 6   41 3  o 16.76207 6.417809 3.211693       3.663576 8.717753       7.201914 1.289474       4.255286 24.07578 9.048662 15.40035 6.531835 8.675425       11.15989 
1 1 1 6   41 4  o 41.50402 4.465122 22.62568       4.445107 35.83329       9.038589 18.41224       5.105136 49.06993 7.821063 36.40816 5.960068 12.66177       9.833180 
1 1 1 6   41 5  o 12.01922 5.357817 -0.5966194     3.179241 0.3005094      4.452717 -1.529605      4.540830 14.77441 6.473502 13.59130 6.197445 1.183104       8.961839 
1 1 1 6   41 6  o 10.07998 4.793666 -3.369220      3.214850 -3.870579      3.968263 -2.411752      5.483885 11.23322 5.337444 14.35954 6.643244 -3.126317      8.521795 
1 1 1 6   41 7  o 13.11695 5.595381 0.6677425      3.153798 -0.5545840E-01 4.204216 1.598430       4.769332 14.07040 6.222677 16.12075 6.878907 -2.050356      9.275832 
1 1 1 6   41 8  o 21.74119 6.316729 6.887616       3.544665 15.01124       6.234984 3.008138       4.308707 30.66642 8.189106 16.89776 6.808055 13.76867       10.64946 
1 1 1 6   41 9  o 16.45394 6.035663 3.461307       3.168197 2.946101       4.475481 3.978834       4.485551 16.91278 6.892989 17.97623 7.041033 -1.063452      9.853397 
1 1 1 6   41 10 o 19.91581 6.159548 5.777538       3.292636 4.604000       4.574821 7.038784       4.742697 18.59731 7.158586 21.46496 7.436706 -2.867651      10.32230 
1 1 1 6   41 11 o 23.96739 6.609580 8.719084       3.985103 13.03659       7.489360 7.013850       4.706739 26.75199 9.340639 21.28713 7.406583 5.464861       11.92078 
1 1 1 6   41 12 o 28.93506 6.653492 12.73782       4.593408 29.03620       8.946811 6.903910       5.352738 40.68030 9.236671 20.96594 7.817071 19.71437       12.10052 
1 1 1 6   41 13 o 20.04951 7.585559 6.226919       5.080120 11.44386       7.454978 1.704208       6.941249 24.65188 9.218483 17.44105 7.835001 7.210833       12.09825 
1 1 1 6   41 14 o 14.58668 6.263916 1.489558       4.000786 -0.8086157     7.018801 2.595639       4.869282 16.01792 7.446653 16.33652 6.960159 -0.3186054     10.19296 
1 1 1 6   41 15 o 24.81009 7.283908 10.31201       4.691733 16.56023       8.518397 7.591211       5.621180 27.55494 9.927597 20.98039 7.969714 6.574545       12.73081 
1 1 1 6   41 16 o 14.61941 6.562820 0.6692635      4.860636 -1.369535      7.373137 2.236353       6.464159 15.71287 7.408947 16.86365 7.569467 -1.150781      10.59195 
1 1 1 6   41 17 o 16.83471 6.534895 4.125949       3.836070 11.27371       8.632872 2.367373       4.282044 22.62286 9.430811 15.30164 6.523359 7.321224       11.46710 
1 1 1 6   41 18 o 23.93311 6.837493 9.666463       4.186201 21.12888       9.173617 6.651790       4.704598 29.22193 10.32698 19.57796 7.322731 9.643978       12.65974 
1 1 1 6   41 19 o 13.45153 5.866831 1.194930       3.620669 4.566161       7.640702 0.2187153      4.111607 18.07862 8.162072 13.22177 5.976657 4.856847       10.11632 
1 1 1 6   42 0  o 13.44853 6.071846 -0.9151186     4.228683 0.000000       0.000000 -0.9151186     4.228683 ?        ?        13.44853 6.071846 0.000000       6.071846 
1 1 1 6   42 1  o 14.84977 5.907926 2.172032       3.202848 4.081677       4.519790 0.2458683      4.539295 18.20735 7.086204 14.72540 6.491116 3.481954       9.609832 
1 1 1 6   42 2  o 17.37926 6.206914 4.015001       3.321847 9.686918       4.722573 -1.539446      4.673414 25.16662 7.284987 13.65684 6.250070 11.50978       9.598666 
1 1 1 6   42 3  o 24.18079 5.900738 8.396711       3.445905 9.947464       4.998731 6.992458       4.756761 25.28671 7.542819 21.58488 7.449192 3.701832       10.60116 
1 1 1 6   42 4  o 15.17047 5.935748 2.499608       3.184997 -0.8289730     4.678360 5.375047       4.348266 14.06590 6.365097 19.48858 7.082999 -5.422679      9.522779 
1 1 1 6   42 5  o 16.52093 5.966700 3.584549       3.079340 3.901205       4.442502 3.291709       4.272178 17.78447 6.994787 17.01910 6.805859 0.7653675      9.759444 
1 1 1 6   42 6  o 40.82473 3.735936 21.71311       3.675555 23.09320       5.477904 20.58298       4.957072 40.46686 5.713737 38.40962 5.448750 2.057236       7.895295 
1 1 1 6   42 7  o 26.11502 5.340140 9.639125       3.283673 14.15625       4.897070 5.948946       4.426182 30.62583 6.744363 19.98260 7.161502 10.64323       9.837355 
1 1 1 6   42 8  o 26.80910 5.303976 10.17303       3.342380 10.30365       5.049279 10.07116       4.459203 25.18804 7.596449 25.39896 6.986730 -0.2109261     10.32087 
1 1 1 6   42 9  o 25.38542 6.573409 9.882737       4.098202 10.23967       5.570808 9.461720       6.050304 24.57290 8.059448 23.45592 8.376779 1.116980       11.62433 
1 1 1 6   42 10 o 29.67421 6.264054 13.22850       4.387259 13.93843       4.916354 10.45248       9.721744 29.87331 6.893458 23.33282 9.883543 6.540497       12.05007 
1 1 1 6   42 11 o 13.48955 6.032663 0.6487978E-01  4.064901 14.63680       8.060541 -4.904853      4.707304 26.72494 9.653348 11.56352 5.578002 15.16142       11.14905 
1 1 1 6   42 12 o 34.74451 5.365980 17.37998       4.397105 19.52330       9.263059 16.75654       4.995850 29.46312 10.38028 33.03252 6.437729 -3.569407      12.21452 
1 1 1 6   42 13 o 11.46624 5.327785 -1.651248      3.585459 -1.972817      6.899171 -1.532262      4.196698 15.15425 7.152036 12.45272 5.778570 2.701533       9.194754 
1 1 1 6   42 14 o 11.81919 5.438426 -1.102450      3.604244 8.158257       7.127108 -4.284611      4.177845 20.96689 8.638895 10.91068 5.261055 10.05621       10.11480 
1 1 1 6   42 15 o 11.71341 5.412401 -1.210567      3.623686 2.125097       7.728930 -2.150395      4.102537 17.26052 7.950049 11.83132 5.562528 5.429200       9.702834 
1 1 1 6   42 16 o 15.79208 6.360536 3.346244       3.759556 -1.296039      7.455569 4.929194       4.353600 15.48087 7.344207 17.71183 6.936925 -2.230954      10.10239 
1 1 1 6   43 0  o 20.57225 6.006410 6.240135       3.197973 8.223500       4.740377 4.583511       4.332350 22.74127 7.433091 18.29297 6.985192 4.448298       10.20018 
1 1 1 6   43 1  o 15.59941 6.021423 2.924081       3.243289 3.486867       4.756942 2.435220       4.433523 17.37679 7.097229 16.13625 6.744943 1.240538       9.791063 
1 1 1 6   43 2  o 19.95523 5.926737 5.862309       3.091459 6.036659       4.529582 5.710277       4.229767 19.98290 7.233929 19.55964 7.001872 0.4232693      10.06757 
1 1 1 6   43 3  o 9.261684 4.451201 -3.525279      2.933236 -4.163318      4.377774 -3.005481      3.951364 11.52970 5.513676 11.44779 5.405745 0.8191299E-01  7.721574 
1 1 1 6   43 4  o 25.20176 5.378909 9.106974       3.202774 7.640294       4.589266 10.49955       4.471828 21.84812 7.320280 25.84158 6.950617 -3.993462      10.09443 
1 1 1 6   43 5  o 19.22347 6.022325 5.506303       3.136559 2.874329       4.584112 7.823160       4.300947 16.49238 6.873491 22.14328 7.066877 -5.650896      9.858277 
1 1 1 6   43 6  o 10.72452 4.955435 -1.509627      3.037561 -3.973806      4.577127 0.4297913      4.060623 11.83395 5.653347 13.81517 6.112373 -1.981225      8.325950 
1 1 1 6   43 7  o 18.87548 6.280551 5.397256       3.379132 6.487426       4.606336 4.127011       4.972241 20.15363 7.295067 17.74665 7.253102 2.406977       10.28715 
1 1 1 6   43 8  o 13.09721 5.657365 0.8439702      3.300511 -0.7341084     4.513996 2.656791       4.838094 13.46746 6.155511 16.29926 6.940845 -2.831803      9.277158 
1 1 1 6   43 9  o 22.46954 5.774459 7.614062       3.178822 11.31617       4.955440 5.025437       4.143739 25.87574 7.454031 18.24061 6.861940 7.635132       10.13157 
1 1 1 6   43 10 o 22.55877 7.018641 8.435033       4.267970 18.04861       8.988194 5.636390       4.849574 28.13959 10.18969 18.92634 7.347404 9.213251       12.56241 
1 1 1 6   43 11 o 12.74380 5.928408 -1.543432      4.459894 0.000000       0.000000 -1.543432      4.459894 ?        ?        12.74380 5.928408 0.000000       5.928408 
1 1 1 6   43 12 o 12.56318 5.864370 -1.680861      4.423820 -0.5456327     7.245685 -2.355528      5.585763 15.83141 7.427117 13.57229 6.414454 2.259115       9.813627 
1 1 1 6   43 13 o 22.34104 7.657931 9.049449       5.024410 9.015632       8.028370 9.071222       6.441898 21.12596 8.966562 21.56328 8.440309 -0.4373169     12.31414 
1 1 1 6   44 0  o 35.64526 4.647391 17.52971       3.940856 24.25219       6.342391 13.30213       5.029606 39.57262 6.823281 28.65089 7.210410 10.92173       9.927093 
1 1 1 6   44 1  f 20.53065 6.757138 6.668816       3.914561 12.29331       7.597875 4.636255       4.567433 24.88913 9.306575 18.03799 7.093078 6.851141       11.70146 
1 1 1 6   44 2  o 14.79533 5.866356 2.546459       3.147723 -0.1435657E-01 4.746458 4.556883       4.205565 14.22506 6.426664 17.80098 6.860581 -3.575918      9.400510 
1 1 1 6   44 3  o 10.37111 4.958314 -3.434227      3.535285 -2.539657      4.609890 -4.711588      5.508588 12.52145 5.889949 12.67140 6.092501 -0.1499577     8.474083 
1 1 1 6   44 4  o 10.88758 5.119943 -2.345319      3.479010 -3.641392      4.597889 -0.6094648     5.321085 11.92552 5.688550 14.42873 6.627727 -2.503215      8.734206 
1 1 1 6   44 5  o 34.44141 4.576944 16.43945       3.746426 25.53314       6.179821 11.15528       4.710795 40.84546 6.420222 25.91199 7.201750 14.93346       9.648028 
1 1 1 6   44 6  o 17.42987 6.235851 4.543754       3.354391 1.090286       5.173121 7.049239       4.406268 15.24528 6.812545 20.59677 7.166279 -5.351498      9.887686 
1 1 1 6   44 7  o 13.84487 5.694030 1.917090       3.088841 1.175686       4.622485 2.515216       4.151875 14.74680 6.523202 15.44276 6.495770 -0.6959677     9.205824 
1 1 1 6   44 8  o 17.61871 6.365390 4.739643       3.504984 4.682576       5.531218 4.777931       4.530739 18.03733 7.536275 17.82820 7.047836 0.2091293      10.31831 
1 1 1 7   0  0  o 311.7903 9.539542 1189.618       72.32762 1189.618       72.32762 1189.618       72.32762 311.7903 9.539542 311.7903 9.539542 0.000000       0.000000 
1 1 1 7   0  1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   0  2  o 13.79586 6.373509 3.383770       2.359715 3.383770       2.359715 3.383770       2.359715 13.79586 6.373509 13.79586 6.373509 0.000000       0.000000 
1 1 1 7   0  3  o 174.0047 3.063948 369.3175       12.98299 369.3175       12.98299 369.3175       12.98299 174.0047 3.063948 174.0047 3.063948 0.000000       0.000000 
1 1 1 7   0  4  o 207.4376 4.884310 525.3761       24.65940 525.3761       24.65940 525.3761       24.65940 207.4376 4.884310 207.4376 4.884310 0.000000       0.000000 
1 1 1 7   0  5  o 185.4017 3.708972 419.4157       16.74215 419.4157       16.74215 419.4157       16.74215 185.4017 3.708972 185.4017 3.708972 0.000000       0.000000 
1 1 1 7   0  6  o 431.7822 9.024288 2277.131       94.86051 2277.131       94.86051 2277.131       94.86051 431.7822 9.024288 431.7822 9.024288 0.000000       0.000000 
1 1 1 7   0  7  o 396.2309 8.353463 1917.100       80.57776 1917.100       80.57776 1917.100       80.57776 396.2309 8.353463 396.2309 8.353463 0.000000       0.000000 
1 1 1 7   0  8  o 61.33646 5.139744 46.81050       7.553722 46.81050       7.553722 46.81050       7.553722 61.33646 5.139744 61.33646 5.139744 0.000000       0.000000 
1 1 1 7   0  9  o 132.2692 5.551429 214.3539       17.82183 214.3539       17.82183 214.3539       17.82183 132.2692 5.551429 132.2692 5.551429 0.000000       0.000000 
1 1 1 7   0  10 o 504.7214 10.45617 3110.794       128.4812 3110.794       128.4812 3110.794       128.4812 504.7214 10.45617 504.7214 10.45617 0.000000       0.000000 
1 1 1 7   0  11 o 342.0245 10.47070 1430.636       87.08550 1430.636       87.08550 1430.636       87.08550 342.0245 10.47070 342.0245 10.47070 0.000000       0.000000 
1 1 1 7   0  12 o 116.0194 3.865453 164.5751       10.90115 164.5751       10.90115 164.5751       10.90115 116.0194 3.865453 116.0194 3.865453 0.000000       0.000000 
1 1 1 7   0  13 o 75.24342 3.859851 69.53548       7.034686 69.53548       7.034686 69.53548       7.034686 75.24342 3.859851 75.24342 3.859851 0.000000       0.000000 
1 1 1 7   0  14 o 134.5403 4.133011 221.2128       13.52152 221.2128       13.52152 221.2128       13.52152 134.5403 4.133011 134.5403 4.133011 0.000000       0.000000 
1 1 1 7   0  15 o 248.7435 5.782978 755.3878       35.01136 755.3878       35.01136 755.3878       35.01136 248.7435 5.782978 248.7435 5.782978 0.000000       0.000000 
1 1 1 7   0  16 o 104.3864 5.849075 134.0703       14.77115 134.0703       14.77115 134.0703       14.77115 104.3864 5.849075 104.3864 5.849075 0.000000       0.000000 
1 1 1 7   0  17 o 297.8394 6.668287 1083.186       48.34380 1083.186       48.34380 1083.186       48.34380 297.8394 6.668287 297.8394 6.668287 0.000000       0.000000 
1 1 1 7   0  18 o 466.7227 9.801810 2662.190       111.3702 2662.190       111.3702 2662.190       111.3702 466.7227 9.801810 466.7227 9.801810 0.000000       0.000000 
1 1 1 7   0  19 o 250.8210 5.905099 768.4189       36.04816 768.4189       36.04816 768.4189       36.04816 250.8210 5.905099 250.8210 5.905099 0.000000       0.000000 
1 1 1 7   0  20 o 78.76337 4.408864 76.33878       8.401187 76.33878       8.401187 76.33878       8.401187 78.76337 4.408864 78.76337 4.408864 0.000000       0.000000 
1 1 1 7   0  21 o 55.08479 5.173444 37.97532       6.795613 37.97532       6.795613 37.97532       6.795613 55.08479 5.173444 55.08479 5.173444 0.000000       0.000000 
1 1 1 7   0  22 o 305.8920 6.880515 1144.319       51.23053 1144.319       51.23053 1144.319       51.23053 305.8920 6.880515 305.8920 6.880515 0.000000       0.000000 
1 1 1 7   0  23 o 298.5073 6.769626 1090.207       49.18709 1090.207       49.18709 1090.207       49.18709 298.5073 6.769626 298.5073 6.769626 0.000000       0.000000 
1 1 1 7   0  24 o 191.0723 7.135373 448.2009       33.11857 448.2009       33.11857 448.2009       33.11857 191.0723 7.135373 191.0723 7.135373 0.000000       0.000000 
1 1 1 7   0  25 o 181.5937 4.984615 403.4609       22.02055 403.4609       22.02055 403.4609       22.02055 181.5937 4.984615 181.5937 4.984615 0.000000       0.000000 
1 1 1 7   0  26 o 99.90359 4.416018 122.5247       10.70304 122.5247       10.70304 122.5247       10.70304 99.90359 4.416018 99.90359 4.416018 0.000000       0.000000 
1 1 1 7   0  27 o 117.2417 4.477942 168.5478       12.75128 168.5478       12.75128 168.5478       12.75128 117.2417 4.477942 117.2417 4.477942 0.000000       0.000000 
1 1 1 7   0  28 o 153.4244 4.751451 288.3714       17.72605 288.3714       17.72605 288.3714       17.72605 153.4244 4.751451 153.4244 4.751451 0.000000       0.000000 
1 1 1 7   0  29 o 77.43977 6.999094 75.28745       12.94766 75.28745       12.94766 75.28745       12.94766 77.43977 6.999094 77.43977 6.999094 0.000000       0.000000 
1 1 1 7   0  30 o 28.98924 9.868418 13.37574       6.249516 13.37574       6.249516 13.37574       6.249516 28.98924 9.868418 28.98924 9.868418 0.000000       0.000000 
1 1 1 7   0  31 o 131.7883 4.668242 213.1755       14.94952 213.1755       14.94952 213.1755       14.94952 131.7883 4.668242 131.7883 4.668242 0.000000       0.000000 
1 1 1 7   0  32 o 53.10823 6.057847 35.91168       7.576504 35.91168       7.576504 35.91168       7.576504 53.10823 6.057847 53.10823 6.057847 0.000000       0.000000 
1 1 1 7   0  33 o 129.8357 4.748061 207.2484       14.97700 207.2484       14.97700 207.2484       14.97700 129.8357 4.748061 129.8357 4.748061 0.000000       0.000000 
1 1 1 7   0  34 o 71.82908 5.251438 64.31637       9.076772 64.31637       9.076772 64.31637       9.076772 71.82908 5.251438 71.82908 5.251438 0.000000       0.000000 
1 1 1 7   0  35 o 113.2079 4.778209 158.1519       13.12836 158.1519       13.12836 158.1519       13.12836 113.2079 4.778209 113.2079 4.778209 0.000000       0.000000 
1 1 1 7   0  36 o 15.21779 9.327975 2.650536       6.634127 2.650536       6.634127 2.650536       6.634127 15.21779 9.327975 15.21779 9.327975 0.000000       0.000000 
1 1 1 7   0  37 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   0  38 o 94.53481 4.916045 111.6482       11.25483 111.6482       11.25483 111.6482       11.25483 94.53481 4.916045 94.53481 4.916045 0.000000       0.000000 
1 1 1 7   0  39 o 30.59582 9.836242 15.27479       6.470406 15.27479       6.470406 15.27479       6.470406 30.59582 9.836242 30.59582 9.836242 0.000000       0.000000 
1 1 1 7   0  40 o 29.12337 12.51425 16.88904       9.098738 16.88904       9.098738 16.88904       9.098738 29.12337 12.51425 29.12337 12.51425 0.000000       0.000000 
1 1 1 7   0  41 o 9.890225 6.804953 -2.965003      5.383533 -2.965003      5.383533 -2.965003      5.383533 9.890225 6.804953 9.890225 6.804953 0.000000       0.000000 
1 1 1 7   0  42 o 9.238323 6.438753 -3.742755      5.228765 -3.742755      5.228765 -3.742755      5.228765 9.238323 6.438753 9.238323 6.438753 0.000000       0.000000 
1 1 1 7   0  43 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   0  44 o 11.41503 7.458129 1.232577       5.096977 1.232577       5.096977 1.232577       5.096977 11.41503 7.458129 11.41503 7.458129 0.000000       0.000000 
1 1 1 7   0  45 o 11.81864 7.523201 2.440141       4.761017 2.440141       4.761017 2.440141       4.761017 11.81864 7.523201 11.81864 7.523201 0.000000       0.000000 
1 1 1 7   0  46 o 14.21743 9.431516 5.818163       8.644838 5.818163       8.644838 5.818163       8.644838 14.21743 9.431516 14.21743 9.431516 0.000000       0.000000 
1 1 1 7   0  47 o 11.59722 7.467942 3.071189       4.862282 3.071189       4.862282 3.071189       4.862282 11.59722 7.467942 11.59722 7.467942 0.000000       0.000000 
1 1 1 7   0  48 o 11.65980 7.553234 3.541016       5.073431 3.541016       5.073431 3.541016       5.073431 11.65980 7.553234 11.65980 7.553234 0.000000       0.000000 
1 1 1 7   1  0  o 230.8529 3.316647 649.5883       18.65824 619.4785       28.64037 671.7894       24.59311 225.3775 5.214732 234.7350 4.299316 -9.357513      6.758517 
1 1 1 7   1  1  o 533.1992 6.918911 3469.745       89.90075 3529.303       117.3429 3385.107       139.8848 537.4579 8.959346 526.0150 10.91280 11.44293       14.11946 
1 1 1 7   1  2  o 412.1744 5.446600 2072.071       54.70697 2118.461       71.64837 2007.212       84.71835 416.6208 7.057148 405.3712 8.576074 11.24966       11.10641 
1 1 1 7   1  3  o 348.1377 5.232356 1478.103       44.38992 1532.700       64.06684 1427.692       61.56172 354.3455 7.419426 341.9945 7.386787 12.35101       10.46960 
1 1 1 7   1  4  o 201.8027 3.371252 496.3859       16.57884 459.6328       22.45704 540.4103       24.57834 194.1531 4.746484 210.5221 4.790919 -16.36897      6.744035 
1 1 1 7   1  5  o 146.8324 2.784040 262.7548       9.961699 263.4549       14.07167 262.0514       14.10433 146.9583 3.932836 146.5652 3.952593 0.3931122      5.575858 
1 1 1 7   1  6  o 812.0590 11.63766 8064.485       230.2976 7994.859       323.6723 8135.875       327.7458 807.0679 16.45733 814.1317 16.51986 -7.063843      23.31844 
1 1 1 7   1  7  o 289.4434 5.182244 1021.437       36.55254 1012.051       62.88784 1026.226       44.91938 287.7868 8.978241 290.0743 6.354602 -2.287445      10.99954 
1 1 1 7   1  8  o 206.5324 3.487836 519.8673       17.55417 528.5978       25.04188 511.4324       24.61434 208.2330 4.934933 204.8242 4.931408 3.408859       6.976557 
1 1 1 7   1  9  o 173.0230 3.136422 364.8316       13.22435 360.4811       18.59834 369.2805       18.80752 171.9152 4.443120 174.0023 4.439103 -2.087158      6.280681 
1 1 1 7   1  10 o 361.4089 7.724180 1593.103       68.02795 1598.755       96.36000 1587.488       96.05283 361.7004 10.94490 360.4221 10.94880 1.278290       15.48118 
1 1 1 7   1  11 o 178.3669 3.732124 387.7348       16.22208 381.1895       19.65662 401.7123       28.72515 176.7860 4.566554 181.3944 6.508891 -4.608337      7.951043 
1 1 1 7   1  12 o 681.7138 11.34952 5674.934       188.5453 5693.839       231.4645 5637.651       325.0461 682.4727 13.91755 677.7003 19.70301 4.772461       24.12274 
1 1 1 7   1  13 o 618.0389 8.948000 4660.886       134.7652 4718.991       192.1801 4604.669       189.0325 621.4233 12.69068 613.8576 12.63667 7.565735       17.90918 
1 1 1 7   1  14 o 519.8313 8.782741 3297.564       111.2573 3328.871       137.1331 3237.270       190.3078 522.0919 10.77852 514.0532 15.20864 8.038696       18.64080 
1 1 1 7   1  15 o 229.9039 4.454257 644.2981       24.95500 630.7988       30.19335 673.3986       44.33080 227.4583 5.447202 234.8075 7.758077 -7.349289      9.479439 
1 1 1 7   1  16 o 215.2538 3.715519 564.7515       19.48975 557.1786       27.34179 572.5740       27.78900 213.7690 5.248631 216.7019 5.262283 -2.932816      7.432344 
1 1 1 7   1  17 o 249.3688 4.763300 758.1915       28.94584 768.1084       50.59291 753.3657       35.29286 250.6890 8.293091 248.5329 5.827291 2.156067       10.13571 
1 1 1 7   1  18 o 393.0002 5.935945 1884.260       56.84846 1849.005       79.42831 1921.286       81.39966 389.0625 8.377605 396.5888 8.422598 -7.526306      11.87958 
1 1 1 7   1  19 o 317.7040 4.973406 1231.242       38.50460 1207.632       53.80345 1256.030       55.12817 314.4662 7.021016 320.7024 7.053998 -6.236115      9.952565 
1 1 1 7   1  20 o 156.1256 3.216896 297.1791       12.23904 289.5858       17.05624 305.2390       17.57253 154.0044 4.549781 158.1143 4.565433 -4.109909      6.445438 
1 1 1 7   1  21 o 247.3188 4.139827 746.2256       24.95028 743.9902       35.15587 748.4943       35.41561 246.7929 5.845599 247.5361 5.871108 -0.7431793     8.284983 
1 1 1 7   1  22 o 210.9839 3.753620 543.0923       19.29904 554.2469       27.58121 532.3922       27.01358 212.9997 5.313714 208.6907 5.316143 4.309021       7.516444 
1 1 1 7   1  23 o 117.7592 3.478999 169.3448       9.972611 184.9717       17.43755 161.7493       12.15697 122.8350 5.842163 115.0122 4.345376 7.822868       7.281013 
1 1 1 7   1  24 o 249.7562 4.202445 761.8434       25.57728 739.5773       35.49956 785.8796       36.88360 245.7924 5.926776 253.3602 5.973913 -7.567810      8.415124 
1 1 1 7   1  25 o 129.6235 3.606229 205.2892       11.38023 205.3869       13.92940 205.0931       19.73517 129.5655 4.418173 129.2014 6.286999 0.3641357      7.684180 
1 1 1 7   1  26 o 221.9276 3.923740 601.7126       21.22011 601.2179       29.98135 602.2092       30.03828 221.4704 5.559593 221.6515 5.565598 -0.1811676     7.866699 
1 1 1 7   1  27 o 90.97559 3.177525 101.1715       7.033682 98.30556       9.789106 104.2302       10.11306 89.52969 4.501272 92.19283 4.515152 -2.663139      6.375582 
1 1 1 7   1  28 o 185.0267 4.163961 418.7888       18.77487 410.8665       22.74353 435.7370       33.26542 183.0166 5.104527 187.8353 7.281199 -4.818710      8.892247 
1 1 1 7   1  29 o 171.4227 3.481965 359.1709       14.54550 373.4893       20.92104 345.7737       20.23690 174.4655 4.925753 167.8556 4.952757 6.609833       6.985188 
1 1 1 7   1  30 o 109.0269 3.781789 145.6141       10.03250 149.7746       17.65047 143.6284       12.19381 109.9766 6.616571 108.1342 4.638219 1.842422       8.080352 
1 1 1 7   1  31 f 125.3689 3.261238 192.3113       9.954959 196.7169       14.14347 187.9859       14.01429 126.5389 4.594278 123.6809 4.658104 2.858032       6.542578 
1 1 1 7   1  32 f 111.2658 3.298960 151.6049       8.935011 156.0827       12.79588 147.3440       12.48199 112.6166 4.672788 109.4086 4.692534 3.208046       6.622297 
1 1 1 7   1  33 o 71.01103 3.628520 61.96122       6.258197 64.76979       8.830479 59.12713       8.870512 72.32946 5.041505 69.02963 5.314109 3.299828       7.325062 
1 1 1 7   1  34 f 94.83513 3.363058 110.3805       7.759819 106.9339       10.70063 114.2033       11.26954 93.01035 4.736684 96.10117 4.827636 -3.090813      6.763301 
1 1 1 7   1  35 o 93.61735 3.873708 108.0226       8.818202 105.6913       14.94234 109.2685       10.92315 91.54620 6.745323 93.87407 4.790764 -2.327866      8.273500 
1 1 1 7   1  36 o 17.81668 7.216530 1.951150       4.869991 2.178355       5.766066 1.385761       9.095889 19.19478 7.823626 22.43917 9.534800 -3.244387      12.33376 
1 1 1 7   1  37 o 69.80480 3.656532 60.40730       6.198318 61.45142       8.824615 59.39059       8.708036 69.79161 5.226638 68.59524 5.249309 1.196373       7.407630 
1 1 1 7   1  38 o 19.50713 7.122000 4.295720       4.403382 -0.1210121     5.966969 9.577228       6.525027 17.33794 7.547169 26.67732 8.720827 -9.339378      11.53311 
1 1 1 7   1  39 o 21.77234 7.476533 6.150715       4.789784 8.258742       5.847721 1.853284       8.349356 24.62538 8.263374 20.95059 9.023494 3.674789       12.23547 
1 1 1 7   1  40 o 14.36399 6.170912 0.4465905      3.885973 0.6161526      5.330935 0.2543315      5.676521 16.51957 7.162717 16.68826 7.310696 -0.1686878     10.23478 
1 1 1 7   1  41 o 14.02858 6.260669 -0.5507834     4.353915 4.152164       7.525587 -2.916941      5.337982 20.57673 8.705021 13.97206 6.495051 6.604665       10.86108 
1 1 1 7   1  42 o 45.13700 4.510426 27.26528       4.894826 28.19653       6.978370 26.36337       6.867618 43.62240 6.785094 41.97887 6.956786 1.643532       9.717735 
1 1 1 7   1  43 o 22.03105 6.924848 7.893604       4.143685 12.72840       5.789387 2.815316       5.933377 26.70860 8.150679 17.12253 7.488253 9.586067       11.06831 
1 1 1 7   1  44 o 41.71817 4.602210 24.56005       4.601064 22.98417       6.362445 26.28761       6.661636 36.77031 7.357584 39.70325 7.148072 -2.932938      10.25812 
1 1 1 7   1  45 o 36.00051 7.364734 23.36791       6.243018 0.000000       0.000000 23.36791       6.243018 ?        ?        36.00051 7.364734 0.000000       7.364734 
1 1 1 7   1  46 f 14.98183 6.297943 3.641768       3.899002 3.430018       4.997851 3.971040       6.232316 15.07606 6.719245 15.67834 7.191024 -0.6022730     9.841701 
1 1 1 7   1  47 o 12.11340 5.501348 1.085072       3.533134 8.878688       5.214484 -5.529645      4.803939 18.53277 7.481476 10.23394 5.075569 8.298832       9.040680 
1 1 1 7   1  48 o 12.03458 5.434397 1.531706       3.389097 0.9654790      4.649735 2.173470       4.950175 12.39566 5.856562 13.15284 6.160366 -0.7571859     8.499966 
1 1 1 7   2  0  o 183.1832 2.807279 408.9728       12.53162 430.6272       20.30214 395.6441       15.92809 187.9323 4.433065 180.1571 3.628075 7.775223       5.728437 
1 1 1 7   2  1  o 770.8968 9.903237 7265.138       186.0414 7054.006       287.2407 7417.709       244.1781 757.7681 15.55513 778.0566 12.87832 -20.28845      20.19439 
1 1 1 7   2  2  f 413.7728 4.620252 2087.571       46.58689 2144.642       62.67735 2017.120       69.63876 419.2759 6.134436 406.5393 7.029306 12.73663       9.329654 
1 1 1 7   2  3  o 241.9805 3.155102 713.6907       18.60501 693.0844       25.76682 736.1362       26.89216 238.4233 4.434820 245.7147 4.491160 -7.291382      6.311747 
1 1 1 7   2  4  o 468.1472 5.592457 2673.002       63.80008 2689.111       90.48730 2657.077       89.96882 469.3242 7.911859 466.5203 7.913806 2.803925       11.19043 
1 1 1 7   2  5  o 692.2949 8.124485 5850.970       137.0639 5821.039       193.1013 5881.362       194.5825 689.8568 11.48656 693.4153 11.51527 -3.558472      16.26476 
1 1 1 7   2  6  o 400.7213 5.318213 1958.005       51.93310 1875.947       65.17641 2100.705       85.94888 392.1405 6.820445 414.8268 8.502316 -22.68637      10.89990 
1 1 1 7   2  7  o 493.7547 7.217320 2974.081       86.84070 3041.868       124.5812 2910.013       121.1148 499.0446 10.24417 488.1160 10.18211 10.92865       14.44363 
1 1 1 7   2  8  o 185.5757 3.248789 419.7021       14.69192 439.5085       21.26155 401.6021       20.32511 189.8837 4.594848 181.4523 4.600284 8.431381       6.501941 
1 1 1 7   2  9  o 352.8230 6.162927 1517.814       52.98831 1499.140       91.20393 1527.329       65.10318 350.2413 10.69842 353.8663 7.549652 -3.625000      13.09402 
1 1 1 7   2  10 o 554.5297 8.061374 3750.857       108.9356 3870.125       157.4095 3641.233       150.9124 562.9616 11.47403 546.0742 11.34063 16.88745       16.13268 
1 1 1 7   2  11 o 200.4474 3.460300 489.6579       16.90247 492.6292       23.97496 486.7216       23.83308 201.0347 4.893853 199.8256 4.894325 1.209045       6.921287 
1 1 1 7   2  12 o 320.2401 5.703742 1250.257       44.51144 1287.961       55.40926 1181.655       74.74056 324.9873 6.996484 311.0015 9.874349 13.98575       12.10180 
1 1 1 7   2  13 o 299.4830 5.401614 1093.409       39.42138 1113.189       48.90171 1056.697       66.62035 302.1385 6.641741 294.1113 9.306926 8.027191       11.43379 
1 1 1 7   2  14 o 320.2334 5.710686 1250.322       44.56470 1287.854       55.61603 1182.998       74.48891 324.9499 7.023402 311.1388 9.836654 13.81107       12.08668 
1 1 1 7   2  15 f 321.9809 4.985000 1263.877       39.11392 1286.728       55.84701 1241.876       54.79877 324.7891 7.056062 319.0786 7.047530 5.710449       9.972747 
1 1 1 7   2  16 o 258.3284 4.209335 813.4766       26.49852 824.4805       37.69080 802.7216       37.26201 260.0116 5.948487 256.5573 5.959995 3.454376       8.420573 
1 1 1 7   2  17 o 511.8647 7.521715 3197.771       93.82275 3171.211       131.9619 3224.921       133.4210 509.3075 10.63242 513.5978 10.66019 -4.290344      15.05616 
1 1 1 7   2  18 o 609.9943 10.26921 4551.276       152.6508 5024.647       283.1549 4357.329       181.2444 638.0444 18.22982 596.3105 12.47257 41.73389       22.08827 
1 1 1 7   2  19 o 145.8072 3.124803 259.1568       11.10293 270.3983       15.85359 248.3354       15.55452 148.8392 4.375683 142.6261 4.480854 6.213181       6.262959 
1 1 1 7   2  20 o 290.9135 4.648911 1032.510       32.95726 1057.038       47.18019 1009.136       46.05731 294.1581 6.581771 287.4162 6.575840 6.741852       9.303837 
1 1 1 7   2  21 o 45.86513 3.944007 25.85027       4.365385 21.76747       5.886128 30.84094       6.507741 41.79667 5.946561 49.96302 5.432322 -8.166344      8.054297 
1 1 1 7   2  22 o 188.9383 4.055819 435.6332       18.67388 436.5494       31.85066 435.1533       23.05140 188.7292 6.937176 188.6903 5.017613 0.3895569E-01  8.561592 
1 1 1 7   2  23 o 277.1358 4.514191 938.0210       30.48657 920.8289       42.60987 956.0523       43.63755 274.2642 6.375363 279.4539 6.407877 -5.189636      9.039145 
1 1 1 7   2  24 o 194.1209 3.605919 459.9532       17.05785 440.4811       23.50449 481.6205       24.79403 189.7350 5.088144 198.3963 5.132657 -8.661346      7.227266 
1 1 1 7   2  25 o 228.2843 3.978580 636.5191       22.13300 618.0590       30.68340 656.5436       31.95702 224.6821 5.604010 231.5598 5.663267 -6.877716      7.967278 
1 1 1 7   2  26 o 108.9911 3.575531 145.2190       9.483733 144.9728       11.48474 145.7467       16.81486 108.8137 4.339838 108.8011 6.369826 0.1256561E-01  7.707715 
1 1 1 7   2  27 o 142.8161 3.762978 249.4003       13.08478 243.6660       15.83469 261.7456       23.23386 141.0379 4.613413 145.7933 6.556322 -4.755386      8.016791 
1 1 1 7   2  28 o 20.27679 6.789790 4.763490       3.948279 6.957725       5.505250 2.439553       5.665623 24.26877 8.014448 19.66034 7.845780 4.608431       11.21551 
1 1 1 7   2  29 o 266.1163 4.461988 867.3419       28.93583 869.2863       40.88669 865.3909       40.95628 265.7296 6.314019 265.1227 6.339245 0.6069641      8.947227 
1 1 1 7   2  30 o 130.4254 3.838913 208.3439       12.18804 182.1538       20.58714 222.4766       15.12309 121.2048 6.999896 134.6268 4.616535 -13.42201      8.385162 
1 1 1 7   2  31 o 221.1910 4.660944 600.4573       25.12334 567.0104       42.65274 618.2265       31.08870 213.1765 8.225973 223.9701 5.700718 -10.79361      10.00824 
1 1 1 7   2  32 o 89.89059 3.399930 99.03290       7.434243 112.4265       10.72277 86.63564       10.31623 95.55608 4.618494 83.75778 5.078144 11.79830       6.864257 
1 1 1 7   2  33 o 115.2131 3.310332 162.6670       9.284509 163.7648       12.95112 161.5063       13.31708 115.2907 4.619096 114.4454 4.785574 0.8453674      6.651148 
1 1 1 7   2  34 o 47.14639 5.245894 27.80734       5.925094 29.96409       9.423248 26.39712       7.619837 48.07911 8.345336 45.42997 7.116300 2.649136       10.96751 
1 1 1 7   2  35 o 70.91791 3.631665 61.97540       6.255315 62.57450       8.691772 61.33170       9.009482 70.88867 5.064847 70.10217 5.313475 0.7864990      7.340687 
1 1 1 7   2  36 o 92.25264 3.367104 104.8300       7.556875 112.1216       10.61922 97.34911       10.75617 94.97111 4.602140 88.31146 5.018753 6.659645       6.809374 
1 1 1 7   2  37 f 51.99244 4.860738 34.07753       6.087166 38.02126       7.446150 26.13205       10.56909 54.62197 5.676780 43.11153 10.21735 11.51044       11.68846 
1 1 1 7   2  38 o 54.52696 4.247007 37.38889       5.598788 36.03786       7.508064 39.08122       8.403079 52.75682 5.943302 54.69873 6.426587 -1.941906      8.753506 
1 1 1 7   2  39 o 44.17506 6.780843 26.33769       7.066722 26.33769       7.066722 0.000000       0.000000 44.17506 6.780843 ?        ?        0.000000       6.780843 
1 1 1 7   2  40 o 66.07105 3.705097 55.23223       5.941602 55.83905       8.168287 54.55040       8.658512 65.30828 5.174741 64.17911 5.592002 1.129173       7.618953 
1 1 1 7   2  41 o 26.72786 7.435151 10.72902       5.018640 16.08529       8.830306 8.173355       6.099524 30.41956 10.15349 23.37247 8.403202 7.047094       13.17980 
1 1 1 7   2  42 o 17.08600 6.985739 3.165138       4.614583 14.56771       7.518543 -3.726214      5.844999 28.39429 9.365479 13.88192 6.561036 14.51238       11.43501 
1 1 1 7   2  43 o 48.34839 4.367239 31.85539       5.090048 33.63483       6.943730 29.78863       7.483350 47.35848 6.162741 42.83031 7.439624 4.528172       9.660610 
1 1 1 7   2  44 o 12.44551 5.689985 -0.4989738     3.860543 1.969618       5.899074 -2.348225      5.105722 15.94495 7.187714 12.89068 6.104299 3.054264       9.430042 
1 1 1 7   2  45 o 9.974425 4.775697 -2.718728      3.305929 -0.5254195     4.529529 -5.218976      4.836094 12.82195 5.968054 11.00801 5.387050 1.813944       8.039775 
1 1 1 7   2  46 o 12.34502 5.539616 0.9766711      3.459345 0.5366446E-01  4.590390 2.189868       5.262750 12.72220 5.950105 14.36076 6.594587 -1.638562      8.882135 
1 1 1 7   2  47 o 14.70307 6.300621 3.995806       4.031992 6.860876       5.196502 -0.3383129     6.391369 16.78660 7.172175 13.12676 6.372010 3.659845       9.593884 
1 1 1 7   2  48 o 12.11485 5.711705 0.7177629      4.379547 1.810560       5.051610 -2.589155      8.787630 12.99865 6.130197 12.93059 6.482229 0.6805801E-01  8.921804 
1 1 1 7   3  0  o 377.5733 5.613313 1738.882       51.64837 1742.726       73.22055 1735.076       72.86440 377.7882 7.953321 376.9603 7.932018 0.8279114      11.23264 
1 1 1 7   3  1  o 36.55820 2.032932 16.33715       1.803974 17.71743       2.469537 14.75788       2.641549 38.03375 2.681658 34.65267 3.162971 3.381081       4.146767 
1 1 1 7   3  2  o 115.6782 2.212548 163.0722       6.237067 170.3071       7.981221 151.7231       9.996170 118.2110 2.770609 111.5035 3.683880 6.707512       4.609474 
1 1 1 7   3  3  o 280.9451 3.554956 962.1139       24.33839 984.8895       34.75382 940.1936       34.09500 284.1934 5.018253 277.6690 5.038802 6.524384       7.111426 
1 1 1 7   3  4  o 415.7749 5.497219 2108.242       55.69772 2095.517       71.47342 2127.919       88.87781 414.3935 7.077754 417.4192 8.737453 -3.025665      11.24445 
1 1 1 7   3  5  o 733.6088 9.417455 6573.859       168.3582 6568.718       265.6469 6577.310       217.6508 731.9523 14.89313 733.1857 12.18176 -1.233398      19.24060 
1 1 1 7   3  6  o 469.7660 6.152672 2691.410       70.43385 2765.196       92.46882 2589.435       108.7067 476.0093 7.971569 460.4589 9.687896 15.55038       12.54596 
1 1 1 7   3  7  o 74.51687 2.101735 67.71780       3.812718 68.05020       4.903594 67.20962       6.063106 74.67813 2.698981 74.18451 3.362610 0.4936218      4.311802 
1 1 1 7   3  8  o 532.9865 7.760375 3465.350       100.7941 3399.459       140.7451 3534.721       144.4144 527.5895 10.94715 537.9755 11.01570 -10.38599      15.53015 
1 1 1 7   3  9  o 655.8143 9.453681 5248.661       151.0838 5258.863       213.9315 5238.510       213.3991 655.9359 13.38373 654.6664 13.37631 1.269409       18.92221 
1 1 1 7   3  10 o 825.9894 11.83573 8332.261       238.2351 8720.640       347.6411 7988.369       327.1247 844.0043 16.90248 807.8558 16.61665 36.14844       23.70246 
1 1 1 7   3  11 o 346.9408 6.068906 1467.512       51.30999 1493.171       63.67960 1420.020       86.63531 349.9059 7.468150 340.9182 10.44049 8.987671       12.83655 
1 1 1 7   3  12 o 250.2784 4.662559 763.5123       28.43700 745.3145       34.44828 802.4412       50.38410 247.2544 5.717253 256.3565 8.075233 -9.102127      9.894259 
1 1 1 7   3  13 o 668.5164 11.15400 5457.993       181.7099 5285.817       217.4945 5855.952       330.6598 657.5229 13.57380 690.5073 19.67070 -32.98444      23.89946 
1 1 1 7   3  14 o 263.7343 4.884839 847.9102       31.39446 847.4287       38.51532 848.8633       54.19402 263.6272 5.995250 263.6209 8.446880 0.6225586E-02  10.35822 
1 1 1 7   3  15 o 373.6718 5.653856 1702.550       51.48386 1708.907       72.90597 1696.225       72.71276 374.2340 7.994360 372.8422 8.002937 1.391785       11.31180 
1 1 1 7   3  16 o 394.6722 5.940437 1899.663       57.13352 1867.039       79.80390 1933.967       81.83228 391.0920 8.373539 398.0346 8.436605 -6.942566      11.88665 
1 1 1 7   3  17 o 191.6378 3.482013 447.6415       16.26102 463.2180       23.27085 432.7784       22.73173 194.8463 4.904892 188.3285 4.957449 6.517822       6.973827 
1 1 1 7   3  18 o 591.3034 8.615790 4272.185       124.1485 4268.986       175.3880 4275.398       175.7577 590.2502 12.19348 590.6888 12.21011 -0.4385986     17.25595 
1 1 1 7   3  19 o 204.2593 4.234183 508.8003       21.07597 536.9490       37.91204 496.2101       25.35494 209.5130 7.437375 201.6077 5.165080 7.905228       9.054976 
1 1 1 7   3  20 o 16.66312 6.263361 2.474913       3.450799 0.5086581      4.681104 4.815227       5.106994 16.53509 6.922525 21.53904 7.695669 -5.003950      10.35107 
1 1 1 7   3  21 o 35.60376 5.519259 15.84511       4.633750 3.803683       7.585992 23.01197       5.852454 23.26970 9.143988 43.02913 5.723137 -19.75943      10.78734 
1 1 1 7   3  22 o 242.1645 4.096794 715.7040       24.17635 704.6617       33.76527 727.3207       34.63226 240.0972 5.770947 243.9193 5.826376 -3.822144      8.200640 
1 1 1 7   3  23 o 131.4144 3.103139 210.6614       9.937572 203.6927       13.73354 218.3203       14.39767 129.0769 4.372454 133.6308 4.427409 -4.553818      6.222564 
1 1 1 7   3  24 o 167.8193 3.362679 343.6872       13.75192 334.0560       19.14159 353.9612       19.76994 165.2551 4.758164 170.1090 4.773879 -4.853973      6.740182 
1 1 1 7   3  25 o 96.68316 3.065706 114.1762       7.213867 106.3891       9.860847 123.1425       10.58109 93.20488 4.353525 100.2916 4.339692 -7.086700      6.147040 
1 1 1 7   3  26 f 218.8282 5.497057 586.9620       29.29043 586.9620       29.29043 0.000000       0.000000 218.8282 5.497057 ?        ?        0.000000       5.497057 
1 1 1 7   3  27 o 162.2868 3.380316 321.6499       13.36831 317.9707       18.60737 325.5749       19.21875 161.1056 4.744733 163.0037 4.843658 -1.898117      6.780377 
1 1 1 7   3  28 o 122.0602 3.166775 182.0765       9.411534 184.2425       13.13190 179.7889       13.49538 122.6146 4.402048 121.0926 4.581582 1.521957       6.353653 
1 1 1 7   3  29 o 117.8264 3.191814 169.7328       9.156219 164.9700       12.64491 174.9827       13.27582 115.9685 4.482894 119.4254 4.570152 -3.456932      6.401768 
1 1 1 7   3  30 o 159.1600 3.407180 309.7213       13.21494 306.1959       18.49180 313.4009       18.89212 157.9102 4.811049 159.7467 4.858674 -1.836487      6.837609 
1 1 1 7   3  31 o 78.68639 4.012372 76.04471       7.668330 68.17408       13.37173 79.90154       9.360479 73.73190 7.548542 80.52838 4.791606 -6.796478      8.940916 
1 1 1 7   3  32 o 33.07476 6.072865 13.92968       4.714384 22.48238       6.447107 4.100858       6.911369 42.14702 6.484687 22.50015 8.761049 19.64687       10.89987 
1 1 1 7   3  33 o 18.67134 7.400437 2.448841       5.007515 3.431030       7.991452 1.813888       6.425378 23.05042 9.277094 19.97120 8.212897 3.079222       12.39016 
1 1 1 7   3  34 o 59.38145 3.924722 43.51146       5.647466 48.04453       7.810174 38.54401       8.175814 62.12539 5.206734 55.34914 6.166133 6.776253       8.070395 
1 1 1 7   3  35 o 65.48820 3.733546 52.91472       5.933589 52.21952       8.163660 53.69328       8.639246 64.67171 5.224494 65.51137 5.461198 -0.8396606     7.557778 
1 1 1 7   3  36 o 33.33118 5.974333 14.33866       4.674367 24.09520       6.282846 2.243091       6.995545 43.39032 6.110988 20.69912 8.546680 22.69120       10.50666 
1 1 1 7   3  37 o 35.63802 5.700099 16.40115       4.783564 18.58517       6.406474 13.64924       7.191302 37.38598 7.293914 31.55248 8.944388 5.833502       11.54137 
1 1 1 7   3  38 o 24.64439 8.242236 7.973217       5.818380 7.973217       5.818380 0.000000       0.000000 24.64439 8.242236 ?        ?        0.000000       8.242236 
1 1 1 7   3  39 o 32.14466 5.852686 13.78278       4.415738 9.811124       5.955140 18.63354       6.581295 26.38570 8.302723 36.51566 7.641723 -10.12996      11.28411 
1 1 1 7   3  40 o 32.79642 5.705927 14.53122       4.394728 14.19195       6.073347 14.90412       6.367233 31.05435 7.982145 31.70688 8.184945 -0.6525326     11.43276 
1 1 1 7   3  41 o 35.16816 5.473461 16.90690       4.538245 15.11987       6.090635 19.13749       6.804659 31.37356 7.956141 35.32420 8.080674 -3.950638      11.34008 
1 1 1 7   3  42 o 19.59347 7.528689 5.470546       5.053843 4.650218       8.657525 5.894582       6.224462 20.48443 8.999417 20.37228 8.191577 0.1121502      12.16928 
1 1 1 7   3  43 o 13.78973 6.103842 0.6084264      4.053695 0.6533931      5.927896 0.5689282      5.555762 15.68658 7.124817 15.31390 6.932448 0.3726807      9.940918 
1 1 1 7   3  44 o 9.831623 4.732820 -3.472186      3.347626 -4.704033      4.808085 -2.313197      4.663731 11.46095 5.554758 12.36960 5.850572 -0.9086494     8.067498 
1 1 1 7   3  45 o 10.58878 5.036543 -2.270941      3.552106 -8.437267      4.889203 4.622334       5.169370 10.01372 4.991666 16.70173 7.145106 -6.688008      8.716035 
1 1 1 7   3  46 o 24.13433 6.537109 10.82015       3.938918 6.009489       5.282376 16.84495       5.911509 16.90704 7.227608 27.10864 8.228849 -10.20160      10.95227 
1 1 1 7   3  47 o 14.65264 6.272909 3.966641       3.989478 8.399819       5.108732 -2.962233      6.386853 18.13181 7.373960 12.25962 6.037732 5.872192       9.530451 
1 1 1 7   4  0  o 331.9047 4.482249 1343.140       36.25312 1333.472       56.94117 1349.731       47.01293 330.5447 7.069033 332.6436 5.799654 -2.098816      9.143699 
1 1 1 7   4  1  o 556.2606 7.210591 3776.622       97.74290 3720.559       152.8376 3815.419       127.1414 551.4174 11.37401 558.7883 9.336917 -7.370850      14.71551 
1 1 1 7   4  2  o 138.6338 2.406025 234.2207       8.128404 250.8905       12.99343 223.5025       10.41887 143.4156 3.720988 135.4155 3.157303 8.000076       4.879992 
1 1 1 7   4  3  o 538.1144 6.375459 3532.599       83.60306 3648.516       120.6949 3425.682       115.9150 546.5259 9.062376 529.5851 8.981893 16.94080       12.75935 
1 1 1 7   4  4  o 62.00704 2.077940 46.90609       3.135423 48.03770       4.661699 45.97128       4.236983 62.70665 3.059904 61.35144 2.841692 1.355206       4.175910 
1 1 1 7   4  5  o 343.6821 5.183099 1440.206       43.40928 1445.291       50.09070 1424.868       86.99599 344.2488 5.971021 341.3195 10.47167 2.929352       12.05442 
1 1 1 7   4  6  f 285.0353 4.403897 990.3759       30.58946 1041.319       44.37451 944.2472       42.22552 292.2079 6.231685 278.2551 6.227242 13.95282       8.809792 
1 1 1 7   4  7  o 467.5664 6.856709 2666.333       78.12592 2759.365       113.0161 2581.188       108.1199 475.4172 9.755046 459.8216 9.648953 15.59564       13.72090 
1 1 1 7   4  8  o 298.6773 4.620674 1087.383       33.63130 1110.116       48.13928 1065.709       47.00470 301.7232 6.547188 295.6276 6.524693 6.095551       9.243230 
1 1 1 7   4  9  o 675.1589 11.22464 5566.058       184.6777 5477.662       223.8590 5754.403       326.7637 669.4223 13.72266 684.7129 19.60363 -15.29059      23.92935 
1 1 1 7   4  10 o 529.4493 8.897624 3419.927       114.7981 3391.282       139.9559 3478.827       200.6913 527.0571 10.89676 533.0715 15.46559 -6.014404      18.91887 
1 1 1 7   4  11 o 271.9688 4.311538 901.5267       28.57508 882.7205       39.87837 921.3728       40.96610 269.0760 6.081719 274.9030 6.115176 -5.827026      8.624540 
1 1 1 7   4  12 o 162.8322 3.093126 323.1170       12.27366 337.9292       17.62253 309.1634       17.10422 166.4523 4.348250 159.2026 4.413023 7.249680       6.195325 
1 1 1 7   4  13 o 348.5428 5.305520 1480.983       45.06301 1493.937       63.97689 1468.229       63.48341 349.9705 7.501629 346.9459 7.508659 3.024567       10.61388 
1 1 1 7   4  14 o 348.0275 6.145478 1476.974       52.12011 1475.028       63.55504 1480.972       91.07905 347.7315 7.500149 348.0531 10.75123 -0.3216248     13.10882 
1 1 1 7   4  15 o 113.7425 3.254564 157.8024       9.011662 147.1241       10.72325 183.4754       16.62700 109.7913 4.014713 122.5405 5.582653 -12.74922      6.876331 
1 1 1 7   4  16 o 349.2417 5.344273 1487.273       45.48318 1510.499       64.82574 1464.754       63.83166 351.8234 7.561129 346.4550 7.560547 5.368378       10.69264 
1 1 1 7   4  17 f 276.8828 4.445499 934.7012       29.99525 942.2247       42.47568 927.2172       42.36393 277.9078 6.271964 275.6838 6.305926 2.223969       8.893944 
1 1 1 7   4  18 o 222.6677 3.822639 604.4686       20.74228 598.7838       29.08079 610.3557       29.59398 221.5546 5.386286 223.6831 5.429178 -2.128540      7.647748 
1 1 1 7   4  19 o 340.0013 5.250581 1410.511       43.50348 1395.723       61.03493 1425.782       62.02341 337.9793 7.410581 341.5941 7.450908 -3.614807      10.50870 
1 1 1 7   4  20 o 108.9196 4.243437 144.9363       11.24160 0.000000       0.000000 144.9363       11.24160 ?        ?        108.9196 4.243437 0.000000       4.243437 
1 1 1 7   4  21 o 143.0730 3.121513 249.6101       10.88326 242.6849       15.12269 257.0500       15.67464 140.9508 4.408185 145.0638 4.439293 -4.113022      6.256151 
1 1 1 7   4  22 o 72.14141 3.143376 63.59567       5.512815 58.94215       7.564397 68.86705       8.050923 69.33641 4.501223 74.97650 4.426096 -5.640091      6.312791 
1 1 1 7   4  23 o 202.1189 3.671284 498.5726       18.08261 501.3134       25.45773 495.7817       25.68917 202.4471 5.164482 201.3147 5.240925 1.132385       7.357932 
1 1 1 7   4  24 o 48.32936 3.819497 28.69453       4.461804 33.50658       6.208729 23.55539       6.416277 52.11883 4.947720 43.41426 6.244161 8.704567       7.966774 
1 1 1 7   4  25 o 184.3093 4.056432 414.9818       18.21913 405.2973       22.07941 435.6463       32.25232 181.9583 4.984123 188.2223 7.044020 -6.264053      8.629004 
1 1 1 7   4  26 o 179.6732 4.004276 394.4899       17.53248 388.8338       21.27742 406.4523       30.94345 178.1845 4.904856 181.7039 7.001348 -3.519409      8.548478 
1 1 1 7   4  27 o 110.4515 3.575199 149.1926       9.610269 148.1294       11.57308 151.5542       17.24836 109.9630 4.327281 110.8763 6.411045 -0.9133682     7.734782 
1 1 1 7   4  28 o 132.8881 3.202873 215.6883       10.37199 208.3900       14.20523 224.0223       15.17961 130.3949 4.477095 135.1783 4.614820 -4.783478      6.429692 
1 1 1 7   4  29 o 156.3076 3.360683 298.5865       12.80099 293.0889       17.77983 304.5033       18.44518 154.5647 4.725977 157.5292 4.810552 -2.964447      6.743609 
1 1 1 7   4  30 o 69.30962 3.531013 58.90208       5.944226 64.85851       8.342360 52.75915       8.471948 72.56223 4.743841 65.30553 5.370924 7.256691       7.165951 
1 1 1 7   4  31 o 68.00490 3.602678 56.75640       5.949075 52.75609       8.004602 61.69247       8.891667 65.32281 5.068126 70.64320 5.201551 -5.320389      7.262371 
1 1 1 7   4  32 o 37.24499 6.586976 17.67738       5.759802 21.57043       10.76107 16.11426       6.818779 40.43770 10.74019 35.23329 8.109944 5.204414       13.45819 
1 1 1 7   4  33 o 126.0679 3.774761 195.0936       11.58352 222.7617       19.97220 181.0691       14.21938 133.9204 6.136190 121.1618 4.825569 12.75859       7.806340 
1 1 1 7   4  34 o 27.48196 6.877710 9.808393       4.594608 7.094635       6.180212 13.16162       6.869884 24.61548 8.491111 31.68085 8.654923 -7.065372      12.12463 
1 1 1 7   4  35 o 81.59438 3.422086 81.91884       6.789253 95.03484       9.505139 68.25741       9.700757 87.60212 4.467290 73.90945 5.423810 13.69267       7.026691 
1 1 1 7   4  36 o 58.40581 3.999408 42.34443       5.657947 42.35524       7.619997 42.33114       8.446819 57.95871 5.459413 57.70533 6.098949 0.2533836      8.185497 
1 1 1 7   4  37 f 21.85892 8.098106 5.259296       5.727268 5.259296       5.727268 0.000000       0.000000 21.85892 8.098106 ?        ?        0.000000       8.098106 
1 1 1 7   4  38 f 49.44754 4.925239 31.16869       5.855987 26.21766       6.808917 45.23670       11.47749 44.61440 6.449734 57.45382 8.449886 -12.83942      10.63013 
1 1 1 7   4  39 o 15.67157 6.480359 1.433161       4.029889 6.062282       5.479370 -4.020969      5.947633 21.94888 7.954797 14.72436 6.848548 7.224521       10.49673 
1 1 1 7   4  40 o 46.13691 4.468051 27.54478       4.960654 33.17596       6.845029 21.31578       7.199212 49.76311 5.750239 38.18914 7.992822 11.57397       9.846342 
1 1 1 7   4  41 f 16.86711 6.607020 3.149426       3.949819 6.428558       5.320877 -0.8753831     5.894899 21.27898 7.819158 15.77026 7.139786 5.508713       10.58847 
1 1 1 7   4  42 o 28.77048 7.571211 13.24944       5.379221 10.53626       9.573800 14.50114       6.502721 24.08068 9.975832 29.03739 8.588529 -4.956709      13.16359 
1 1 1 7   4  43 o 27.17856 8.668936 14.05896       6.472756 0.000000       0.000000 14.05896       6.472756 ?        ?        27.17856 8.668936 0.000000       8.668936 
1 1 1 7   4  44 o 13.90026 5.981278 1.661010       3.661933 4.971525       5.396185 -1.164950      4.985654 17.75252 7.432365 13.30598 6.215886 4.446535       9.689030 
1 1 1 7   4  45 o 28.71283 5.807287 13.28363       3.923583 10.17096       5.455465 16.61878       5.647061 21.72032 7.927714 29.09331 7.804376 -7.372995      11.12461 
1 1 1 7   4  46 o 14.78174 6.214545 3.577392       3.797106 3.953427       5.257130 3.167262       5.490293 15.33925 6.860157 14.90020 6.802079 0.4390545      9.660747 
1 1 1 7   4  47 o 13.44439 6.078406 2.420334       4.255107 6.180083       4.983353 -7.697833      8.175101 16.26148 6.987134 12.12397 6.101390 4.137508       9.276153 
1 1 1 7   5  0  o 334.2604 4.521903 1362.263       36.83344 1299.448       56.49111 1408.716       48.58010 326.3060 7.104262 339.8357 5.866152 -13.52969      9.213158 
1 1 1 7   5  1  o 238.7100 3.135509 694.5134       18.23958 718.8770       26.30952 671.9678       25.30889 242.8233 4.446174 234.7679 4.423829 8.055420       6.272059 
1 1 1 7   5  2  o 597.5767 7.723074 4358.822       112.4657 4397.287       178.6487 4333.571       144.7487 599.4017 12.23055 595.4883 9.974826 3.913330       15.78238 
1 1 1 7   5  3  o 191.7561 2.929225 448.1371       13.68794 461.6567       21.73054 439.2449       17.62363 194.5926 4.582559 189.8280 3.809772 4.764587       5.959380 
1 1 1 7   5  4  o 923.8928 10.77675 10432.18       242.6305 10651.40       348.0223 10224.87       338.4410 932.0998 15.32176 913.2882 15.20684 18.81158       21.58713 
1 1 1 7   5  5  o 214.0443 4.115469 558.4558       21.46639 550.5510       25.81847 576.1566       38.63495 212.5040 4.985713 217.1931 7.310004 -4.689087      8.848362 
1 1 1 7   5  6  o 433.6024 7.368481 2293.471       77.85846 2293.471       77.85846 0.000000       0.000000 433.6024 7.368481 ?        ?        0.000000       7.368481 
1 1 1 7   5  7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   5  8  o 449.5660 7.625361 2465.097       83.53914 2415.517       101.1511 2571.472       148.1613 444.9098 9.329592 458.5010 13.27443 -13.59119      16.22503 
1 1 1 7   5  9  o 636.0453 9.180642 4936.139       142.2975 5063.864       204.7227 4816.752       197.9274 643.7645 13.04977 627.8758 12.93588 15.88867       18.37481 
1 1 1 7   5  10 o 173.0406 3.147454 364.8990       13.27222 362.2567       18.64471 367.6133       18.89734 172.3419 4.443150 173.6112 4.470421 -1.269318      6.302876 
1 1 1 7   5  11 o 482.0702 7.073020 2833.963       83.09047 2777.109       115.8797 2894.128       119.2063 477.0111 9.968795 486.9510 10.04564 -9.939911      14.15245 
1 1 1 7   5  12 o 57.36413 2.803926 40.19613       3.907737 42.69308       5.392380 37.43460       5.670881 59.06635 3.765929 55.25703 4.243889 3.809319       5.673871 
1 1 1 7   5  13 o 232.0762 3.849879 656.4370       21.77278 653.7307       30.60508 659.2102       30.98108 231.5644 5.423575 232.5318 5.467366 -0.9673920     7.701120 
1 1 1 7   5  14 o 435.9948 6.472060 2318.234       68.76381 2382.682       98.87034 2257.853       95.70053 441.8134 9.183135 430.0888 9.131037 11.72464       12.95013 
1 1 1 7   5  15 o 546.3625 9.224032 3644.695       122.8111 3634.343       149.8551 3665.867       214.3178 545.3091 11.27698 546.5648 16.10848 -1.255737      19.66351 
1 1 1 7   5  16 o 323.0931 5.763069 1273.112       45.37510 1265.471       55.48031 1288.549       78.85587 322.0462 7.069433 324.5915 9.981073 -2.545258      12.23106 
1 1 1 7   5  17 o 99.17715 2.863692 119.9808       6.913834 124.8568       9.703941 114.9537       9.853040 101.1251 3.945367 97.01270 4.177578 4.112366       5.746136 
1 1 1 7   5  18 o 202.1306 3.597937 498.0916       17.72237 490.2706       24.75593 506.3132       25.38223 200.4191 5.072866 203.6707 5.118107 -3.251602      7.206177 
1 1 1 7   5  19 o 132.9587 3.419568 215.6756       11.07041 219.2439       18.36114 213.6376       13.87622 133.9074 5.639389 132.2781 4.310498 1.629349       7.098105 
1 1 1 7   5  20 o 309.5441 4.873328 1169.367       36.76075 1158.839       51.55699 1180.254       52.42907 307.9028 6.871282 310.7271 6.923997 -2.824310      9.754807 
1 1 1 7   5  21 o 66.79227 3.958463 54.61992       6.414116 59.42456       11.48812 52.44382       7.731374 69.35981 6.887712 65.35831 4.889664 4.001495       8.446857 
1 1 1 7   5  22 o 61.44501 3.308818 46.18813       4.936177 48.44814       6.820122 43.70183       7.153415 62.83236 4.483696 59.60661 4.969920 3.225750       6.693552 
1 1 1 7   5  23 o 134.3306 3.108958 220.1304       10.17714 218.6586       14.12335 221.7201       14.67798 133.7345 4.339439 134.6535 4.479374 -0.9190826     6.236628 
1 1 1 7   5  24 o 93.05370 3.411264 105.8218       7.722350 99.94447       9.359780 118.3525       13.66667 90.35128 4.263063 98.16059 5.738356 -7.809311      7.148597 
1 1 1 7   5  25 o 136.9340 3.583310 229.0992       11.94699 228.4865       14.58344 230.3497       20.83224 136.6573 4.384840 136.9232 6.259985 -0.2659302     7.642921 
1 1 1 7   5  26 f 149.3811 3.238011 272.4243       11.78719 279.4292       16.61181 265.3211       16.72800 151.0834 4.517021 147.1927 4.669510 3.890671       6.496753 
1 1 1 7   5  27 o 192.9176 3.628640 454.7301       17.05894 460.6835       23.99082 448.6417       24.26142 193.8529 5.082899 191.2713 5.209965 2.581604       7.278708 
1 1 1 7   5  28 o 15.74778 6.609923 0.4532881      4.284753 -2.984265      5.008750 9.832908       8.273652 14.41624 6.548369 29.03548 9.829264 -14.61924      11.81082 
1 1 1 7   5  29 o 141.7565 3.271674 245.5587       11.30184 238.9496       15.54190 252.9757       16.46440 139.5686 4.575808 143.5819 4.711928 -4.013260      6.568126 
1 1 1 7   5  30 o 79.21736 3.302419 76.84917       6.361143 68.89674       8.493229 87.00957       9.600159 74.80227 4.682806 84.09171 4.703523 -9.289444      6.637153 
1 1 1 7   5  31 o 63.14959 3.675429 48.98195       5.631624 45.93668       7.576569 52.74155       8.418425 60.90800 5.152909 65.25628 5.340534 -4.348282      7.421171 
1 1 1 7   5  32 o 69.41288 5.276950 59.70137       8.859159 0.000000       0.000000 59.70137       8.859159 ?        ?        69.41288 5.276950 0.000000       5.276950 
1 1 1 7   5  33 o 72.46889 3.645680 64.54953       6.417549 65.28621       8.779306 63.70420       9.404483 72.60927 4.992097 71.61491 5.429291 0.9943542      7.375516 
1 1 1 7   5  34 o 109.0484 3.296207 145.9330       8.749257 150.7683       12.13288 140.6945       12.62863 110.4991 4.515282 106.6207 4.873362 3.878441       6.643601 
1 1 1 7   5  35 o 21.46365 6.968530 5.666537       4.169968 2.553413       5.369901 10.39546       6.618344 19.10372 7.633387 28.33506 8.727425 -9.231342      11.59468 
1 1 1 7   5  36 o 71.19989 4.120496 62.93428       7.118780 66.88050       8.446605 53.25838       13.22627 73.18121 4.762245 63.42131 8.794213 9.759903       10.00086 
1 1 1 7   5  37 o 22.67791 6.888102 6.715796       4.141222 5.556656       5.364970 8.424607       6.513981 21.86719 7.878570 25.64161 8.721132 -3.774418      11.75287 
1 1 1 7   5  38 o 15.83099 6.517658 1.409203       4.052574 -0.5962639E-01 5.384715 3.328029       6.154531 16.51104 7.178561 20.14663 8.129713 -3.635590      10.84546 
1 1 1 7   5  39 o 56.70794 4.385416 40.98245       6.013196 38.58847       7.186749 46.57043       10.97995 54.34357 5.502605 57.70298 8.025374 -3.359402      9.730637 
1 1 1 7   5  40 o 35.59072 5.232852 16.87598       4.403104 22.01527       5.971661 10.75328       6.518007 39.99554 6.338068 26.68091 8.715767 13.31463       10.77663 
1 1 1 7   5  41 o 41.54919 4.637933 22.91646       4.615957 23.86684       6.150887 21.69116       6.984109 41.02299 6.358455 37.71642 7.854312 3.306568       10.10545 
1 1 1 7   5  42 o 18.89577 7.737703 4.632640       5.672487 0.000000       0.000000 4.632640       5.672487 ?        ?        18.89577 7.737703 0.000000       7.737703 
1 1 1 7   5  43 o 17.15130 7.006932 3.985075       4.638132 3.593432       8.602098 4.145603       5.507249 18.62412 8.506721 17.68112 7.461713 0.9430065      11.31554 
1 1 1 7   5  44 o 18.59309 6.554913 5.775488       3.694225 5.332542       5.126944 6.253798       5.327681 17.94747 7.353579 18.78946 7.570333 -0.8419857     10.55391 
1 1 1 7   5  45 o 17.25100 6.472814 5.239140       3.681943 6.949522       5.069963 3.330389       5.355902 18.60106 7.422282 15.66832 6.971185 2.932747       10.18271 
1 1 1 7   5  46 o 19.50965 7.158914 8.305734       4.457720 4.204943       5.151747 20.52422       8.892614 15.41074 6.847955 23.55257 9.671223 -8.141825      11.85019 
1 1 1 7   5  47 o 15.35367 6.252714 4.708219       3.679240 3.838768       5.012191 5.724130       5.417926 14.51504 6.576321 15.71811 7.001264 -1.203073      9.605504 
1 1 1 7   6  0  o 92.21883 2.616363 103.7246       5.873737 120.6327       10.30707 95.59270       7.148000 99.38353 4.265765 88.49809 3.320362 10.88544       5.405696 
1 1 1 7   6  1  o 503.8293 7.334931 3097.716       90.05660 3099.731       127.4444 3095.707       127.2743 503.6040 10.38474 503.2781 10.37760 0.3259277      14.68119 
1 1 1 7   6  2  o 243.2995 3.876914 721.5526       22.98601 717.5818       32.38771 725.5825       32.62786 242.5792 5.478866 243.9274 5.488985 -1.348190      7.755445 
1 1 1 7   6  3  o 287.0115 4.433309 1004.206       31.00726 1022.186       44.27861 986.9048       43.43532 289.4965 6.276457 284.4571 6.265996 5.039398       8.868856 
1 1 1 7   6  4  o 79.19740 3.739175 76.61908       7.196060 83.36172       10.09641 69.65744       10.25907 82.53581 5.043911 75.37297 5.626008 7.162842       7.555991 
1 1 1 7   6  5  o 771.5536 15.68948 7291.593       294.9923 7291.593       294.9923 0.000000       0.000000 771.5536 15.68948 ?        ?        0.000000       15.68948 
1 1 1 7   6  6  o 552.6879 8.025118 3726.562       108.0855 3788.565       125.9846 3553.671       210.3761 557.1497 9.279179 538.4725 16.05025 18.67719       18.53952 
1 1 1 7   6  7  o 1020.447 14.58445 12735.83       362.6742 12846.45       421.3871 12419.77       712.2886 1024.213 16.88321 1001.629 29.21308 22.58386       33.74088 
1 1 1 7   6  8  o 369.6709 6.380430 1666.217       57.47796 1648.979       98.10615 1675.226       70.92531 367.3470 10.97162 370.6042 7.853347 -3.257202      13.49264 
1 1 1 7   6  9  o 580.7870 8.417195 4114.700       119.1298 4137.282       169.0767 4092.437       167.8797 582.0432 11.92045 578.8823 11.90068 3.160889       16.84409 
1 1 1 7   6  10 o 138.7115 2.800237 234.4698       9.465491 220.1315       12.98091 250.7499       13.83204 134.3360 3.969661 143.3823 3.962519 -9.046326      5.608900 
1 1 1 7   6  11 o 245.0393 4.549817 731.8687       27.16851 714.0999       33.02957 769.0421       47.77373 242.0241 5.600261 250.9760 7.820799 -8.951965      9.619139 
1 1 1 7   6  12 o 124.0675 2.742699 187.5785       8.292250 191.7067       11.76234 183.4996       11.69200 125.3576 3.854993 122.6398 3.917226 2.717789       5.495965 
1 1 1 7   6  13 o 201.0194 3.500122 492.4812       17.14578 521.3255       24.82071 466.1545       23.71281 206.7974 4.925305 195.4845 4.981828 11.31290       7.005515 
1 1 1 7   6  14 o 253.6533 4.119009 784.2451       25.46064 797.4755       36.23215 771.3387       35.78557 255.7358 5.813885 251.5093 5.838722 4.226517       8.239656 
1 1 1 7   6  15 o 106.5710 2.786521 138.5054       7.230440 132.9842       9.902414 144.8106       10.58217 104.3783 3.899951 108.9225 3.993530 -4.544189      5.581926 
1 1 1 7   6  16 o 108.2474 3.330518 142.9536       8.775023 151.8141       10.52833 122.7948       15.88043 111.5304 3.879646 100.1123 6.545260 11.41813       7.608685 
1 1 1 7   6  17 o 78.01034 3.657753 74.34879       6.934125 70.16705       9.296155 79.59359       10.41092 75.68183 5.069765 80.60608 5.330034 -4.924248      7.356071 
1 1 1 7   6  18 o 231.0804 4.482238 651.2272       25.24028 623.0084       41.44818 667.8593       31.82078 225.7026 7.546470 233.9533 5.581431 -8.250671      9.386244 
1 1 1 7   6  19 o 86.78938 2.890072 91.92431       6.103868 89.65656       8.352143 94.52391       8.942399 85.64663 4.012922 87.93411 4.185129 -2.287483      5.798176 
1 1 1 7   6  20 o 124.6227 2.955580 189.3542       8.975856 195.2322       12.57177 183.2423       12.81940 126.4401 4.085509 122.4764 4.301837 3.963615       5.932722 
1 1 1 7   6  21 o 190.7343 4.122781 443.9456       19.16263 457.7539       34.52542 437.7981       23.03670 193.2186 7.345910 189.2754 4.998852 3.943222       8.885432 
1 1 1 7   6  22 f 315.3724 4.969245 1215.160       38.19005 1213.917       53.84977 1216.417       54.16941 314.7862 7.019918 315.1018 7.054514 -0.3155823     9.952157 
1 1 1 7   6  23 o 74.82664 3.426318 68.46739       6.231117 68.72865       7.724843 67.98077       10.54242 74.89723 4.249849 74.30063 5.870189 0.5966034      7.247091 
1 1 1 7   6  24 o 174.6157 3.881313 372.3327       16.51574 356.0682       19.81277 409.3722       29.89907 170.5973 4.770497 182.5699 6.731886 -11.97264      8.250813 
1 1 1 7   6  25 o 26.14094 5.916488 8.705797       3.680781 9.595896       4.931748 7.586511       5.530347 27.45636 7.260876 25.08710 8.014260 2.369259       10.81428 
1 1 1 7   6  26 o 15.18398 6.146842 1.178789       3.531081 1.442764       4.660048 0.8228683      5.411100 17.31375 7.042169 17.90435 7.465332 -0.5905991     10.26272 
1 1 1 7   6  27 o 109.1536 3.078505 145.5855       8.180508 138.2665       11.12555 154.2000       12.07006 106.2260 4.306811 112.1723 4.424255 -5.946281      6.174355 
1 1 1 7   6  28 o 191.2608 4.203825 447.6538       19.59326 438.0760       23.41929 469.9964       35.76913 188.9458 5.090920 194.9010 7.545348 -5.955215      9.102182 
1 1 1 7   6  29 o 107.3320 3.138984 140.8712       8.201393 140.2644       11.23163 141.5644       12.00389 106.9296 4.319201 107.3766 4.598151 -0.4469986     6.308605 
1 1 1 7   6  30 o 173.6774 3.511213 368.9442       14.86060 384.4196       21.05849 353.5928       20.97390 176.8983 4.889724 169.5964 5.080616 7.301834       7.051387 
1 1 1 7   6  31 o 52.99371 4.413156 34.68975       5.647464 40.63739       8.580510 30.14417       7.501284 57.02058 6.278931 48.97598 6.441139 8.044605       8.995179 
1 1 1 7   6  32 o 114.8664 3.247466 161.6052       9.081084 175.7823       12.76887 147.0959       12.91761 119.5494 4.390432 109.2273 4.865259 10.32204       6.553369 
1 1 1 7   6  33 o 57.43553 4.895890 40.94518       6.787225 47.37804       12.25023 38.09580       8.152980 60.77708 8.503600 55.08265 6.180340 5.694431       10.51227 
1 1 1 7   6  34 o 99.73154 3.316367 122.1203       8.048718 129.8549       11.06791 113.4389       11.72578 102.5394 4.439858 95.63547 5.049263 6.903908       6.723645 
1 1 1 7   6  35 o 22.13423 7.588409 5.800930       4.933653 10.35028       5.769375 -6.578996      9.517285 28.09457 8.027149 18.97086 8.767823 9.123714       11.88738 
1 1 1 7   6  36 o 83.04025 3.394347 85.08891       6.854323 95.22890       9.408636 73.62077       10.00586 87.47820 4.427979 76.48940 5.402819 10.98879       6.985517 
1 1 1 7   6  37 o 44.16251 4.522419 24.61409       4.798331 25.15767       6.257488 23.83829       7.475560 44.10476 5.975663 42.22047 7.542637 1.884285       9.622885 
1 1 1 7   6  38 o 90.87476 3.322125 102.6042       7.344527 112.3067       10.05942 91.52739       10.74822 94.41137 4.384296 84.61439 5.238309 9.796982       6.830954 
1 1 1 7   6  39 o 50.58533 4.715520 32.94348       5.745905 36.24554       6.743712 24.19555       10.97639 52.70191 5.323851 38.77149 11.07017 13.93042       12.28381 
1 1 1 7   6  40 o 27.39294 6.288150 10.51670       4.108637 11.27196       5.470413 9.539331       6.223060 27.55906 7.797307 25.28029 8.524694 2.278770       11.55285 
1 1 1 7   6  41 o 36.96599 6.961271 20.08354       6.040844 33.36083       12.02276 15.59959       6.986819 41.78272 11.46375 30.71883 8.851492 11.06389       14.48331 
1 1 1 7   6  42 o 18.08823 6.659195 4.669436       3.862257 5.499643       5.172696 3.623449       5.806131 19.40336 7.572457 18.04207 7.640061 1.361292       10.75698 
1 1 1 7   6  43 o 17.74358 6.649814 4.807337       3.883658 9.545165       5.379144 -0.3513184     5.612957 22.90148 7.920712 14.67871 6.765957 8.222766       10.41709 
1 1 1 7   6  44 o 11.70768 5.377540 -0.6968640     3.502327 0.5183913      5.038668 -1.832881      4.871631 14.21723 6.500180 12.74118 6.012192 1.476058       8.854309 
1 1 1 7   6  45 o 12.02314 5.539498 -0.2298785     3.756673 -3.481508      5.512455 2.589793       5.133266 12.24135 5.936470 14.99367 6.736498 -2.752324      8.978980 
1 1 1 7   6  46 o 11.41513 5.315454 -0.3003021     3.598996 5.288711       5.078879 -5.937420      5.100689 16.09953 6.985904 10.58858 5.247693 5.510956       8.737342 
1 1 1 7   6  47 o 14.97759 6.158141 4.399611       3.611562 3.119955       4.906189 5.913220       5.335860 13.97704 6.399322 15.77531 6.991804 -1.798272      9.478219 
1 1 1 7   7  0  o 382.8728 5.107836 1787.361       47.65709 1768.195       61.20140 1816.885       75.95902 380.7275 6.596460 385.8239 8.078936 -5.096344      10.42988 
1 1 1 7   7  1  o 432.8221 5.705924 2284.450       60.18267 2267.521       94.60953 2295.956       77.99793 430.9513 9.008876 433.7910 7.378473 -2.839691      11.64481 
1 1 1 7   7  2  o 789.2419 10.11744 7608.344       194.5883 7792.532       312.5253 7491.733       248.6705 797.2493 16.08626 782.5375 13.04016 14.71173       20.70781 
1 1 1 7   7  3  o 168.1443 3.523635 344.5814       14.43807 391.1613       27.21717 326.3404       17.03206 178.9866 6.249614 163.5667 4.276702 15.41988       7.572836 
1 1 1 7   7  4  o 285.6388 5.156415 994.6726       35.89229 1021.757       44.35648 943.3033       61.08664 289.4627 6.288229 277.8606 9.033597 11.60208       11.00671 
1 1 1 7   7  5  o 636.9425 9.217356 4951.204       143.0681 4908.879       164.2089 5084.563       291.4830 634.0451 10.62773 643.5993 18.60448 -9.554199      21.42604 
1 1 1 7   7  6  o 189.6470 4.836654 438.6921       22.33430 456.1752       32.05452 422.1962       31.13644 193.2925 6.815824 185.9411 6.883475 7.351440       9.686985 
1 1 1 7   7  7  o 288.7248 6.468423 1016.429       45.51124 1024.515       64.54761 1008.435       64.17920 289.6257 9.156997 287.3399 9.177398 2.285736       12.96438 
1 1 1 7   7  8  o 647.2911 13.28316 5119.577       209.5257 5570.226       313.6094 4756.235       281.5970 673.8943 19.11614 622.7869 18.57540 51.10742       26.65469 
1 1 1 7   7  9  o 259.6687 4.727701 821.8699       29.91615 808.7628       50.37287 829.0120       37.18402 257.3762 8.041285 260.7693 5.851454 -3.393158      9.944937 
1 1 1 7   7  10 f 155.3849 3.517403 294.2486       13.31886 275.5168       23.37962 303.2484       16.20559 150.1853 6.402826 157.6796 4.221280 -7.494308      7.669119 
1 1 1 7   7  11 o 622.3210 8.999744 4725.699       136.4837 4549.558       187.9993 4921.985       198.4594 610.1818 12.64331 634.6381 12.83244 -24.45624      18.01458 
1 1 1 7   7  12 o 366.6983 5.535960 1639.387       49.46955 1578.911       68.25373 1706.313       71.80209 359.7670 7.785187 373.9949 7.878350 -14.22794      11.07599 
1 1 1 7   7  13 o 489.6249 7.183742 2924.187       85.71371 2877.602       119.7890 2973.063       122.6983 485.4490 10.12599 493.4271 10.20421 -7.978088      14.37573 
1 1 1 7   7  14 o 479.0444 7.049625 2799.417       82.29584 2748.104       114.7798 2853.701       118.0572 474.3600 9.929359 483.3772 10.02237 -9.017273      14.10815 
1 1 1 7   7  15 o 122.3359 2.815402 182.3927       8.393256 186.3398       11.75585 178.2888       11.98725 123.5785 3.908603 120.8689 4.075591 2.709572       5.646912 
1 1 1 7   7  16 o 299.2487 5.390212 1092.140       39.30738 1048.053       65.07346 1117.466       49.32231 292.7486 9.132813 302.6220 6.688163 -9.873383      11.31989 
1 1 1 7   7  17 o 185.8915 3.963177 421.3057       17.95309 427.1123       21.68799 408.6648       31.99971 187.0818 4.761073 182.8092 7.197162 4.272507       8.629424 
1 1 1 7   7  18 o 236.3615 4.531406 681.4094       26.10032 679.3373       32.05967 685.4820       44.94623 235.9392 5.575999 236.6995 7.802861 -0.7602386     9.590433 
1 1 1 7   7  19 o 202.8858 3.610067 501.9554       17.84856 519.5375       25.37663 484.7425       25.10884 206.3279 5.047076 199.2239 5.176272 7.104034       7.229577 
1 1 1 7   7  20 o 44.93317 3.481078 24.77081       3.781977 25.52543       5.014628 23.77539       5.759435 45.50383 4.584688 43.77775 5.521271 1.726086       7.176614 
1 1 1 7   7  21 o 56.12174 3.223584 38.54163       4.390109 38.33334       5.858553 38.80838       6.629843 55.87206 4.336820 56.16021 4.893190 -0.2881546     6.538449 
1 1 1 7   7  22 o 125.8895 4.332980 193.7505       13.27285 190.2993       19.79634 196.5688       17.88947 124.4931 6.548371 126.6344 5.812587 -2.141258      8.755989 
1 1 1 7   7  23 f 222.6652 3.869156 605.3203       20.99446 576.0099       28.65213 639.3019       30.85094 216.9977 5.418333 228.5888 5.538311 -11.59106      7.747982 
1 1 1 7   7  24 o 157.4019 3.231034 302.3523       12.39332 291.9722       16.91035 314.3972       18.21598 154.4973 4.496327 160.3015 4.668116 -5.804230      6.481378 
1 1 1 7   7  25 o 208.5388 3.743310 531.1641       19.02299 509.2180       25.96956 556.5739       27.94394 203.8849 5.231212 213.1269 5.384696 -9.241989      7.507365 
1 1 1 7   7  26 o 28.87467 5.412654 10.54569       3.668689 8.955942       4.675444 13.09279       5.918088 26.52383 7.095186 31.96359 7.691474 -5.439760      10.46425 
1 1 1 7   7  27 f 105.1027 3.051726 134.9913       7.807922 141.0892       10.84880 128.4386       11.24605 107.3201 4.156102 102.3370 4.520684 4.983147       6.140828 
1 1 1 7   7  28 o 61.74006 3.450478 46.72895       5.170721 43.82872       6.904784 50.43204       7.802184 59.61390 4.793358 63.93456 5.048718 -4.320663      6.961741 
1 1 1 7   7  29 o 151.2071 3.808862 279.9094       14.02354 288.5431       17.01419 261.6176       24.76516 153.3665 4.557502 145.3525 7.012385 8.014008       8.363276 
1 1 1 7   7  30 o 48.81222 4.517981 29.46595       5.313168 33.99279       7.883852 25.69910       7.191669 52.11594 6.337863 45.12348 6.747035 6.992466       9.256943 
1 1 1 7   7  31 o 121.6059 3.219103 180.9994       9.531111 177.7267       12.97054 184.8409       14.05242 120.2576 4.433570 122.5765 4.713221 -2.318901      6.470780 
1 1 1 7   7  32 o 51.11613 4.124145 32.27334       5.093640 40.36213       6.925653 22.74248       7.517703 57.02953 5.035053 42.07837 7.611573 14.95117       9.126216 
1 1 1 7   7  33 o 163.5706 3.495679 328.0100       13.93391 343.4272       19.53084 312.0286       19.88498 166.8483 4.808574 158.8906 5.142369 7.957672       7.040337 
1 1 1 7   7  34 o 57.71796 4.834325 41.45538       6.737183 52.09832       12.05101 36.61671       8.125603 63.72372 7.931638 53.81548 6.316084 9.908241       10.13922 
1 1 1 7   7  35 o 17.33259 6.968694 1.950918       4.504299 0.2294451E-01  5.212092 7.638714       8.952278 16.67513 7.154967 26.81324 10.08616 -10.13811      12.36625 
1 1 1 7   7  36 o 13.70001 6.005721 -0.6879415     3.836698 -0.4892668     4.924683 -0.9947466     6.119814 15.73416 6.852625 17.17678 7.555616 -1.442617      10.20028 
1 1 1 7   7  37 o 30.81216 5.974853 12.47885       4.324322 12.59466       5.608032 12.30900       6.791551 30.43274 7.588345 29.86642 8.762297 0.5663280      11.59141 
1 1 1 7   7  38 o 46.47632 4.158770 27.31548       4.660402 25.52949       6.139674 29.74350       7.158654 44.14960 5.850534 47.42028 6.354667 -3.270679      8.637739 
1 1 1 7   7  39 o 37.83482 4.881897 18.65316       4.396272 23.04285       5.775388 12.60518       6.779058 41.55006 5.867001 29.15326 8.804091 12.39679       10.57987 
1 1 1 7   7  40 o 42.10090 5.304882 23.71319       5.321986 22.97873       6.281442 25.58174       10.01907 40.50499 6.590111 39.10435 10.35278 1.400631       12.27231 
1 1 1 7   7  41 o 24.22218 7.154774 8.925972       4.515301 15.36689       6.963059 4.252143       5.931474 30.30157 8.867382 19.21893 7.895885 11.08264       11.87331 
1 1 1 7   7  42 o 17.59765 6.606895 4.350078       3.837303 2.282577       5.069784 7.123282       5.871614 16.36963 7.040720 20.96003 8.098867 -4.590405      10.73142 
1 1 1 7   7  43 f 16.03071 6.323202 3.498452       3.639642 3.191589       4.945319 3.861102       5.376085 16.46736 7.015045 17.23154 7.326457 -0.7641773     10.14336 
1 1 1 7   7  44 o 21.03217 7.448389 8.371879       4.774259 13.49779       9.347468 6.562732       5.553227 22.30169 9.575732 18.81354 7.674243 3.488150       12.27146 
1 1 1 7   7  45 o 14.38716 6.272914 2.573346       4.136433 3.676423       4.821575 -0.5018013     8.050428 15.54139 6.774407 14.85406 7.196538 0.6873255      9.883459 
1 1 1 7   7  46 f 11.41056 5.384810 -0.7819242     3.909603 -10.35387      5.638481 8.081161       5.425683 9.963120 5.020761 18.09880 7.504908 -8.135677      9.029490 
1 1 1 7   7  47 o 11.84100 5.488925 0.6713785      3.771442 4.561676       5.109300 -3.985966      5.590353 14.82902 6.686565 11.25549 5.562951 3.573530       8.698078 
1 1 1 7   8  0  o 575.3566 6.812872 4037.707       95.52202 3967.891       133.3461 4111.295       136.9011 570.0670 9.598827 580.2666 9.681516 -10.19958      13.63339 
1 1 1 7   8  1  o 465.9705 6.115629 2647.746       69.44415 2630.988       109.1732 2659.134       89.99862 464.2123 9.650797 466.8437 7.910943 -2.631378      12.47882 
1 1 1 7   8  2  o 539.1853 7.847692 3546.792       103.1136 3541.984       206.2799 3548.394       119.0552 537.5540 15.76406 539.1926 9.060841 -1.638611      18.18253 
1 1 1 7   8  3  o 961.5748 12.29115 11299.31       288.0128 11806.60       469.5965 10993.42       364.6494 980.6812 19.64992 947.5634 15.79178 33.11786       25.20912 
1 1 1 7   8  4  o 213.2342 4.143913 554.1876       21.53295 583.5231       26.77724 500.4998       36.22488 218.7890 5.022318 202.4407 7.355217 16.34825       8.906341 
1 1 1 7   8  5  o 465.3208 9.733251 2642.533       110.3688 2571.237       153.1208 2719.630       159.2285 458.4282 13.72195 471.4612 13.87431 -13.03302      19.51381 
1 1 1 7   8  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   8  7  o 421.7446 8.919523 2169.977       91.67001 2257.400       132.9420 2090.728       126.5742 429.6898 12.71009 413.5239 12.57516 16.16592       17.87963 
1 1 1 7   8  8  o 291.7343 6.563590 1037.725       46.66219 998.5696       64.47839 1080.782       67.61381 285.9297 9.266009 297.4735 9.338761 -11.54385      13.15566 
1 1 1 7   8  9  o 743.9327 15.19029 6769.192       275.3821 6508.225       379.0214 7060.994       400.7878 727.7778 21.39442 757.9827 21.72037 -30.20496      30.48763 
1 1 1 7   8  10 o 248.0665 4.563827 750.0681       27.58884 706.1168       45.03675 776.4682       34.90471 240.4854 7.694875 252.3692 5.675597 -11.88376      9.561563 
1 1 1 7   8  11 o 286.1500 5.226105 998.1959       36.44248 1048.656       65.96664 976.0322       43.71941 292.9882 9.250871 282.9211 6.341218 10.06708       11.21560 
1 1 1 7   8  12 o 691.4561 9.967236 5837.260       167.9482 5950.040       240.5606 5730.017       234.5815 697.3915 14.15506 684.3932 14.06540 12.99829       19.95498 
1 1 1 7   8  13 o 593.5826 8.610327 4300.207       124.5480 4383.776       178.3442 4220.649       174.0108 598.8190 12.22158 587.5829 12.15265 11.23615       17.23525 
1 1 1 7   8  14 o 422.5374 7.233421 2178.278       74.48090 2220.998       129.2798 2157.054       91.12331 425.9233 12.46898 420.3308 8.896152 5.592529       15.31721 
1 1 1 7   8  15 o 366.4528 6.377528 1638.185       56.95167 1620.044       96.53995 1647.868       70.53227 363.8380 10.90066 367.4185 7.877543 -3.580475      13.44917 
1 1 1 7   8  16 o 448.9290 6.661518 2459.495       72.87641 2558.740       105.4857 2368.871       100.7996 457.5308 9.460999 440.2379 9.395832 17.29294       13.33387 
1 1 1 7   8  17 o 116.8265 2.821980 166.3573       8.033988 164.8302       11.01318 168.0943       11.74571 116.2054 3.894616 117.3396 4.114065 -1.134201      5.665118 
1 1 1 7   8  18 o 266.9059 5.019436 869.2203       32.64744 900.1876       40.28096 809.9307       55.73628 271.5293 6.087613 257.1039 8.909431 14.42545       10.79060 
1 1 1 7   8  19 o 150.0121 3.112377 274.3770       11.37770 260.8227       15.34159 290.9440       16.96101 146.1517 4.312266 154.3522 4.514085 -8.200455      6.242804 
1 1 1 7   8  20 o 114.8992 2.854344 160.9684       7.992071 163.2366       11.08295 158.5112       11.53562 115.6028 3.939909 113.8987 4.163106 1.704109       5.731870 
1 1 1 7   8  21 o 196.0453 4.032579 469.0864       19.26529 460.0959       23.42507 487.8766       33.86538 194.0108 4.958781 199.4778 6.977415 -5.466965      8.560013 
1 1 1 7   8  22 o 152.1005 3.137397 282.2229       11.62884 288.2483       16.29683 275.9724       16.59864 153.5679 4.359194 150.2396 4.538895 3.328293       6.293182 
1 1 1 7   8  23 o 34.06112 5.814467 14.59587       4.653099 22.94156       9.332520 11.83483       5.367898 42.33001 9.301647 30.44836 7.324186 11.88165       11.83910 
1 1 1 7   8  24 o 132.8520 3.064013 215.3691       9.919612 223.0747       13.87934 207.3233       14.18247 135.0527 4.222439 130.1615 4.477962 4.891235       6.154766 
1 1 1 7   8  25 o 116.4755 3.004446 165.6796       8.520639 170.7242       11.79254 160.1690       12.32510 118.1209 4.103029 114.3659 4.430779 3.754974       6.038763 
1 1 1 7   8  26 o 230.0518 3.995264 646.9495       22.39790 644.3795       31.23272 649.6707       32.13749 229.2379 5.590971 230.1403 5.730376 -0.9024048     8.006008 
1 1 1 7   8  27 o 198.9933 3.680212 483.9971       17.84627 496.1587       25.13457 471.6324       25.34361 201.1169 5.132653 196.0334 5.310096 5.083450       7.385204 
1 1 1 7   8  28 o 126.7737 3.119778 196.3200       9.638048 192.1946       13.08978 201.2049       14.24373 125.2203 4.296011 128.0755 4.571079 -2.855179      6.272996 
1 1 1 7   8  29 o 257.2415 6.087024 815.0584       38.15770 808.6274       51.94381 822.5966       56.23792 254.8744 8.374551 256.6451 9.006038 -1.770691      12.29804 
1 1 1 7   8  30 f 154.4405 3.345440 291.7061       12.59072 298.6709       17.44497 284.1334       18.19034 155.9504 4.595382 152.0179 4.916791 3.932510       6.729960 
1 1 1 7   8  31 o 86.04877 3.241596 90.70872       6.785198 94.25082       9.106534 86.28819       10.17328 87.54114 4.281779 83.60522 5.016416 3.935913       6.595306 
1 1 1 7   8  32 o 196.1069 3.744575 471.5138       17.89499 462.8987       24.52374 481.3254       26.17118 193.6826 5.200596 197.3830 5.446188 -3.700378      7.530416 
1 1 1 7   8  33 o 80.08303 3.422916 78.77180       6.664536 84.69861       8.990869 71.54370       9.928956 82.81723 4.471554 75.85413 5.406859 6.963097       7.016332 
1 1 1 7   8  34 o 82.25655 5.046031 84.11288       10.06611 92.36829       14.67669 76.78030       13.83207 85.39753 7.117205 77.69114 7.395083 7.706390       10.26362 
1 1 1 7   8  35 o 87.09118 3.298268 93.38152       6.987319 109.1074       9.674079 76.23022       10.10299 93.83949 4.241427 78.00705 5.347054 15.83244       6.825005 
1 1 1 7   8  36 o 23.12090 6.769752 6.988784       4.057437 4.824430       5.219666 10.29345       6.449745 21.02726 7.741410 27.81439 8.623905 -6.787130      11.58884 
1 1 1 7   8  37 o 85.14729 3.356444 89.87657       6.950798 91.92841       9.297823 87.27714       10.46523 85.55067 4.475429 82.91678 5.205557 2.633896       6.864932 
1 1 1 7   8  38 o 29.79363 5.977857 11.87866       4.189081 13.61632       5.527690 9.534302       6.420586 31.32771 7.365479 26.21107 8.655074 5.116636       11.36488 
1 1 1 7   8  39 o 29.57228 5.800406 11.84826       4.030619 19.08848       5.444273 3.066581       5.995880 37.50429 6.171406 19.22383 7.922509 18.28045       10.04253 
1 1 1 7   8  40 o 33.99669 6.919905 16.63600       5.537711 18.05141       6.845795 13.95644       9.419212 34.32616 8.280252 28.61493 10.42108 5.711229       13.31020 
1 1 1 7   8  41 o 13.76590 5.962997 0.6075998      3.687459 -0.2092155E-02 4.869668 1.427088       5.645669 14.85281 6.625296 16.69998 7.303928 -1.847165      9.861131 
1 1 1 7   8  42 o 26.61866 6.422636 10.91307       4.117932 15.44082       5.504589 5.158899       6.205476 30.75475 7.428876 19.14277 7.989103 11.61198       10.90935 
1 1 1 7   8  43 o 17.12694 6.451506 4.448166       3.665532 8.864882       5.056846 -0.4418872     5.320921 22.09588 7.677750 14.22240 6.567048 7.873484       10.10317 
1 1 1 7   8  44 o 17.81982 7.007891 5.520386       4.458718 5.162819       5.293787 6.393233       8.270985 17.48908 7.344360 18.51192 8.411167 -1.022840      11.16635 
1 1 1 7   8  45 f 13.01004 5.780951 1.387131       3.671043 2.463583       4.995161 0.1229256      5.413287 14.63435 6.603965 13.55393 6.377785 1.080425       9.180877 
1 1 1 7   8  46 o 10.72601 5.052100 -0.9225513     3.411749 -3.687417      4.623341 2.383281       5.055444 10.77331 5.271145 13.97060 6.432910 -3.197288      8.316689 
1 1 1 7   8  47 o 10.73374 5.077347 -0.6810420     3.514096 -1.180706      4.733846 -0.6771945E-01 5.244685 11.57044 5.584407 12.37727 5.949454 -0.8068352     8.159755 
1 1 1 7   9  0  o 272.3338 3.840565 903.9246       25.48782 890.4539       39.79855 913.2910       33.18623 270.2404 6.043393 273.7148 4.975348 -3.474365      7.827943 
1 1 1 7   9  1  o 266.5526 4.236166 865.9990       27.51642 801.6413       52.90649 889.8628       32.21655 256.1877 8.486222 270.1851 4.893070 -13.99744      9.795821 
1 1 1 7   9  2  o 314.0161 4.313732 1201.864       33.00966 1159.872       50.93185 1232.279       43.34576 308.4056 6.776900 317.9282 5.594760 -9.522552      8.787930 
1 1 1 7   9  3  o 466.0859 6.125551 2648.619       69.57404 2706.254       111.4733 2611.841       89.04694 470.8987 9.714200 462.7394 7.896714 8.159302       12.51894 
1 1 1 7   9  4  o 350.8426 6.140427 1500.725       52.49852 1454.151       62.69927 1609.961       96.02213 345.3048 7.451157 362.9846 10.86767 -17.67981      13.17672 
1 1 1 7   9  5  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   9  6  o 142.4094 4.301490 247.4035       14.91061 255.5746       21.25930 239.4924       20.91842 144.6613 6.043912 140.0220 6.145475 4.639343       8.619497 
1 1 1 7   9  7  o 234.4974 5.589409 670.3460       31.94038 741.6016       47.67811 612.3306       43.02105 246.4553 7.949013 223.9261 7.896242 22.52917       11.20435 
1 1 1 7   9  8  o 267.5804 6.164571 872.9446       40.19696 896.1089       57.75528 851.1822       55.98042 270.8798 8.760939 263.9983 8.713536 6.881500       12.35636 
1 1 1 7   9  9  o 360.0735 7.810704 1581.416       68.53580 1667.615       100.2370 1505.740       93.91961 369.3879 11.14825 351.0003 10.99382 18.38760       15.65719 
1 1 1 7   9  10 o 772.0246 15.76484 7295.418       296.5902 6937.089       405.0248 7709.731       435.5170 750.8426 22.16012 791.4307 22.60483 -40.58813      31.65516 
1 1 1 7   9  11 o 412.0765 7.064510 2071.051       70.94079 2248.061       128.5633 1993.561       85.06306 428.7186 12.31854 404.1953 8.636020 24.52325       15.04418 
1 1 1 7   9  12 o 156.5284 3.375295 298.6066       12.87481 271.2482       20.03521 317.8511       16.80359 149.0526 5.525487 161.4251 4.275408 -12.37244      6.986424 
1 1 1 7   9  13 o 607.8753 10.15852 4513.550       150.4809 4541.196       260.4281 4499.693       184.3759 607.9728 17.59644 606.5580 12.47371 1.414795       21.56915 
1 1 1 7   9  14 o 654.6227 9.464304 5234.368       150.9788 5217.541       212.9224 5251.384       214.1150 652.7623 13.38536 654.8683 13.41705 -2.106018      18.95218 
1 1 1 7   9  15 o 127.5003 2.816776 198.1258       8.751842 180.3912       11.69756 220.6760       13.19043 121.5807 3.953415 134.4821 4.029475 -12.90149      5.645012 
1 1 1 7   9  16 o 164.2123 3.150328 328.6926       12.60658 331.7577       17.67187 325.5166       17.98917 164.8863 4.402006 163.3200 4.524330 1.566315       6.312465 
1 1 1 7   9  17 o 123.3452 2.839044 185.4493       8.533563 181.1798       11.61720 190.4530       12.57635 121.8320 3.918041 124.9015 4.137620 -3.069504      5.698329 
1 1 1 7   9  18 o 363.8439 6.429969 1617.120       57.01120 1566.980       67.91669 1736.737       104.9022 357.9469 7.786133 375.8498 11.46680 -17.90295      13.86043 
1 1 1 7   9  19 o 17.22459 5.610429 3.486688       2.701795 7.118925       3.320398 -3.630563      4.647926 23.67313 5.801679 13.39412 6.167727 10.27901       8.467605 
1 1 1 7   9  20 o 237.5653 4.554886 688.9886       26.36918 674.7749       32.01534 718.9698       46.49743 234.9871 5.590853 242.0850 7.892342 -7.097885      9.671954 
1 1 1 7   9  21 o 169.9950 3.275376 352.5333       13.56855 353.9822       18.93739 351.0048       19.45056 170.1864 4.570382 169.4520 4.714889 0.7343750      6.566473 
1 1 1 7   9  22 o 112.6455 2.887946 154.8773       7.921016 145.7394       10.64702 166.2044       11.85394 109.1800 4.008545 116.5871 4.179069 -7.407059      5.790772 
1 1 1 7   9  23 o 148.9191 3.764435 270.9435       13.65016 267.8680       24.51104 272.3261       16.43449 147.6150 6.832425 149.2095 4.525073 -1.594559      8.195018 
1 1 1 7   9  24 o 58.66048 3.197415 42.12187       4.553398 39.65193       5.819655 46.02065       7.311705 56.80665 4.234453 61.13665 4.950034 -4.330002      6.514094 
1 1 1 7   9  25 o 155.9935 3.227611 297.0783       12.26941 290.2977       16.80791 304.8130       17.95164 153.9983 4.483573 157.7733 4.674267 -3.774979      6.476975 
1 1 1 7   9  26 o 163.1616 3.314048 325.1291       13.17689 315.0542       17.92597 336.9719       19.43527 160.3772 4.591465 165.8233 4.814698 -5.446091      6.653034 
1 1 1 7   9  27 o 101.9577 3.009830 127.0474       7.470032 117.4367       9.856173 140.0191       11.45068 97.88667 4.141245 106.8605 4.406671 -8.973824      6.047203 
1 1 1 7   9  28 o 49.51450 4.128525 30.21559       4.936246 23.02928       6.756962 38.44036       7.228703 42.71921 6.711779 55.69506 5.393504 -12.97585      8.610334 
1 1 1 7   9  29 o 135.9742 3.192996 225.9736       10.58013 217.8330       14.20034 236.1311       15.86236 133.2515 4.379061 138.6698 4.700869 -5.418350      6.424511 
1 1 1 7   9  30 o 86.87404 3.659235 92.54293       7.729346 90.95135       8.921520 97.33295       15.47723 86.02393 4.269161 88.29830 7.256898 -2.274376      8.419519 
1 1 1 7   9  31 o 100.6820 3.182208 124.1362       7.797775 116.7646       10.28053 134.1227       11.96577 97.43108 4.340839 104.3488 4.717824 -6.917709      6.410986 
1 1 1 7   9  32 o 35.84451 5.235905 16.17294       4.438573 15.69218       5.620965 16.96923       7.234099 34.93971 6.846643 36.04846 8.392467 -1.108746      10.83097 
1 1 1 7   9  33 o 88.79615 3.689453 96.97179       7.966089 97.30826       9.283871 96.03247       15.51166 88.80246 4.302913 87.17033 7.371228 1.632133       8.535225 
1 1 1 7   9  34 o 82.51740 3.333875 83.73852       6.690152 83.16196       8.798250 84.52885       10.30110 81.94622 4.422249 82.38182 5.157033 -0.4356003     6.793473 
1 1 1 7   9  35 o 69.71053 4.401369 60.45485       7.438743 66.50516       12.99846 57.50837       9.070983 71.75452 7.546561 67.57174 5.557837 4.182777       9.372307 
1 1 1 7   9  36 o 66.96879 3.517303 55.57875       5.719961 56.20484       7.511189 54.71444       8.825257 66.93698 4.633348 65.62399 5.571206 1.312996       7.246119 
1 1 1 7   9  37 o 15.59156 6.353289 1.512387       3.801204 1.565317       4.714815 1.414090       6.425202 16.94858 7.009038 18.97864 8.036873 -2.030062      10.66386 
1 1 1 7   9  38 o 32.84965 5.461840 14.23112       4.218790 14.31874       5.470152 14.10251       6.627619 32.14759 7.165646 31.26835 8.483905 0.8792381      11.10509 
1 1 1 7   9  39 o 20.45563 7.188440 5.518548       4.440236 10.22838       6.391169 1.124236       6.173378 26.27945 8.633217 17.83814 7.721244 8.441305       11.58232 
1 1 1 7   9  40 o 11.18235 5.230107 -2.682967      3.547180 -3.656078      4.561232 -1.193837      5.642445 12.38910 5.837307 15.32841 6.957808 -2.939314      9.082139 
1 1 1 7   9  41 o 38.11908 5.356255 20.22056       4.838471 17.80660       5.603405 27.29586       9.593100 34.35235 6.932878 38.55327 10.09404 -4.200924      12.24559 
1 1 1 7   9  42 o 14.40341 6.035320 1.868894       3.562811 0.8791605      4.527222 3.479136       5.774552 14.57102 6.450046 17.50224 7.520835 -2.931227      9.907878 
1 1 1 7   9  43 o 13.57783 6.059026 0.6555953      4.077126 2.267845       4.801385 -3.512195      7.719753 15.46360 6.750004 14.83785 7.153911 0.6257563      9.835700 
1 1 1 7   9  44 o 9.169898 4.507349 -5.146276      3.503461 -4.307827      4.871836 -6.044254      5.041820 11.43114 5.552228 10.99543 5.405154 0.4357061      7.748737 
1 1 1 7   9  45 o 14.43618 6.413521 2.673767       4.516384 19.35350       9.648002 -2.007019      5.110957 22.68388 9.733949 12.23133 5.877704 10.45255       11.37089 
1 1 1 7   9  46 o 15.33802 6.185455 4.452038       3.560330 10.36296       4.911354 -2.094365      5.168627 20.67677 7.525760 11.82615 5.738217 8.850621       9.463836 
1 1 1 7   9  47 o 11.71056 5.432015 0.6586940      3.702811 6.006554       4.981596 -5.943759      5.535172 15.73094 6.870932 10.59387 5.285634 5.137079       8.668774 
1 1 1 7   10 0  o 140.9526 2.810884 242.1083       9.654993 254.0138       13.94527 231.1473       13.38067 144.3126 3.969165 137.6578 3.993008 6.654785       5.630132 
1 1 1 7   10 1  o 192.6818 3.340281 452.4466       15.68411 483.3541       22.94224 425.3275       21.49025 199.1360 4.727700 186.7412 4.726225 12.39487       6.684935 
1 1 1 7   10 2  o 632.0712 9.133357 4874.428       140.6801 5063.571       204.3185 4703.930       193.9867 643.7697 13.02390 620.5119 12.82879 23.25781       18.28113 
1 1 1 7   10 3  o 204.2247 3.465161 508.2831       17.24519 493.9192       24.02393 523.5530       24.76992 201.2992 4.897404 207.2498 4.904496 -5.950638      6.930992 
1 1 1 7   10 4  o 624.0428 9.013449 4750.995       137.0697 4688.529       192.0961 4815.790       195.6442 619.5378 12.72374 627.8817 12.78654 -8.343933      18.03855 
1 1 1 7   10 5  o 72.02612 2.898005 63.32069       5.076186 66.95127       5.819333 51.76680       10.38125 74.05042 3.232639 64.81734 6.667355 9.233070       7.409695 
1 1 1 7   10 6  o 198.0671 5.040325 478.5062       24.30827 495.3472       34.90406 462.6453       33.87328 201.4215 7.122266 194.6488 7.153338 6.772659       10.09440 
1 1 1 7   10 7  o 132.0560 4.261920 212.7669       13.69716 217.1276       19.28178 208.3248       19.46087 133.3204 5.949905 130.5736 6.133184 2.746811       8.545017 
1 1 1 7   10 8  o 606.4877 12.50245 4493.855       184.7793 4256.517       251.7235 4771.170       272.0991 589.2302 17.55040 623.7850 17.91869 -34.55481      25.08179 
1 1 1 7   10 9  o 187.6165 4.984599 429.3893       22.76945 414.9077       31.67864 444.8667       32.74978 184.3134 7.066084 190.8619 7.053437 -6.548492      9.984014 
1 1 1 7   10 10 o 551.3175 16.25260 3725.776       218.1154 0.000000       0.000000 3725.776       218.1154 ?        ?        551.3175 16.25260 0.000000       16.25260 
1 1 1 7   10 11 o 595.2114 9.986782 4325.779       144.8548 4258.336       247.7652 4360.804       178.5490 589.0695 17.27855 597.2961 12.26681 -8.226685      21.19016 
1 1 1 7   10 12 o 428.8250 7.404155 2243.493       77.37341 2528.252       146.7079 2133.768       91.06841 454.3914 13.26332 418.0842 8.938567 36.30722       15.99418 
1 1 1 7   10 13 o 594.5238 8.634577 4315.226       125.0969 4175.354       172.9222 4468.802       181.1949 584.2445 12.14563 604.3959 12.30236 -20.15143      17.28769 
1 1 1 7   10 14 o 174.8032 3.217979 372.4291       13.70782 368.8314       19.13447 376.2221       19.64729 173.8712 4.519821 175.6019 4.595266 -1.730728      6.445560 
1 1 1 7   10 15 o 143.5888 2.945450 251.2970       10.30643 247.7205       14.25823 255.2107       14.91493 142.4824 4.110764 144.6158 4.236798 -2.133362      5.903290 
1 1 1 7   10 16 o 155.4282 3.070854 294.4783       11.63122 304.1670       16.44235 284.7738       16.45571 157.8746 4.277755 152.7463 4.425557 5.128265       6.155058 
1 1 1 7   10 17 o 221.3931 3.772701 597.7007       20.35413 629.2875       29.36997 568.5104       28.23381 227.0784 5.307519 215.8304 5.368104 11.24806       7.548927 
1 1 1 7   10 18 o 179.0059 3.743146 390.8057       16.32827 395.3157       20.25993 382.4471       27.58163 179.9309 4.624407 176.8008 6.412385 3.130157       7.905936 
1 1 1 7   10 19 o 187.0733 4.770037 427.5088       21.72777 427.5088       21.72777 0.000000       0.000000 187.0733 4.770037 ?        ?        0.000000       4.770037 
1 1 1 7   10 20 o 71.35989 2.755905 62.18672       4.783408 64.50843       6.367130 59.17850       7.247592 72.62440 3.609007 69.49335 4.300784 3.131050       5.614417 
1 1 1 7   10 21 o 238.1698 4.012557 692.4995       23.28863 663.2610       31.84192 726.1288       34.14920 232.8727 5.611055 243.6361 5.751787 -10.76337      8.035358 
1 1 1 7   10 22 o 77.53596 2.815034 73.42645       5.310084 71.03616       7.028672 76.60487       8.105001 76.18575 3.797824 79.08326 4.220933 -2.897507      5.678006 
1 1 1 7   10 23 o 178.1165 3.386189 387.2361       14.69777 393.3872       20.58408 380.8380       20.99353 179.3169 4.714667 176.4045 4.888307 2.912369       6.791438 
1 1 1 7   10 24 o 115.8676 3.611312 164.1095       10.18433 164.8262       18.61580 163.8033       12.16649 115.6806 6.631451 115.6786 4.323557 0.2029419E-02  7.916394 
1 1 1 7   10 25 o 125.6938 3.010927 192.8454       9.222529 185.3263       12.40155 202.1486       13.79465 123.0522 4.141615 128.4836 4.412369 -5.431450      6.051610 
1 1 1 7   10 26 o 33.44772 4.572040 13.94528       3.629158 15.98833       4.498984 10.13931       6.140564 35.72780 5.330224 28.37941 8.333337 7.348392       9.892208 
1 1 1 7   10 27 o 124.3665 3.462265 189.1667       10.48279 178.4068       15.75781 197.7087       14.04021 120.4521 5.381999 126.9752 4.544853 -6.523087      7.044260 
1 1 1 7   10 28 o 142.4278 3.207476 247.8850       11.13254 242.2672       15.08263 254.6084       16.50029 140.5566 4.408870 144.0316 4.707405 -3.475006      6.449635 
1 1 1 7   10 29 o 59.12314 3.507243 42.90493       5.030413 43.96888       6.472217 41.28155       7.994753 59.71840 4.480085 57.62645 5.770628 2.091949       7.305567 
1 1 1 7   10 30 f 70.27651 3.771486 60.65679       6.435244 63.51414       7.419255 51.97711       12.93094 71.84081 4.257008 63.96837 8.505842 7.872440       9.511649 
1 1 1 7   10 31 o 154.8660 3.359628 293.6130       12.67896 281.0663       16.99873 309.3458       19.03507 151.1344 4.620910 158.4537 4.935668 -7.319290      6.761186 
1 1 1 7   10 32 o 58.95671 4.781454 43.09290       6.810658 43.09290       6.810658 0.000000       0.000000 58.95671 4.781454 ?        ?        0.000000       4.781454 
1 1 1 7   10 33 o 20.24919 6.730312 4.898789       3.880665 3.661896       4.800180 7.232374       6.593308 19.60590 7.383346 25.00944 8.761820 -5.403542      11.45789 
1 1 1 7   10 34 o 66.11694 3.507274 53.89883       5.630695 53.76120       7.302646 54.10061       8.842504 65.75914 4.585832 65.65663 5.579427 0.1025085      7.222178 
1 1 1 7   10 35 o 99.98840 3.998382 123.8672       9.722845 127.3769       17.21662 122.2237       11.78139 99.62646 7.138803 98.91110 4.903104 0.7153549      8.660423 
1 1 1 7   10 36 f 30.87820 5.517926 12.38193       3.999667 7.407155       4.979812 21.42425       6.713765 23.84600 7.603500 40.18462 7.116412 -16.33862      10.41425 
1 1 1 7   10 37 o 48.20876 4.152115 29.31054       4.830403 27.78952       6.179813 31.69925       7.744417 46.30729 5.589258 48.90945 6.671433 -2.602154      8.703322 
1 1 1 7   10 38 o 37.64884 8.135179 20.25089       7.245489 0.000000       0.000000 20.25089       7.245489 ?        ?        37.64884 8.135179 0.000000       8.135179 
1 1 1 7   10 39 o 40.71432 4.617793 21.62335       4.500787 23.50978       5.840103 18.86419       7.062988 41.63539 5.922879 35.51834 8.308836 6.117046       10.20379 
1 1 1 7   10 40 o 19.25718 6.686388 5.148801       3.834916 0.6978065      4.936059 11.92642       6.091026 15.63498 6.834014 27.34018 8.363597 -11.70520      10.80062 
1 1 1 7   10 41 o 35.33453 5.691108 17.82256       4.733991 14.86921       5.432300 27.14565       9.651751 30.69196 7.358558 37.72129 10.23953 -7.029327      12.60938 
1 1 1 7   10 42 o 13.74842 6.043364 0.8134251      3.908958 1.958985       4.596788 -2.178470      7.428800 15.38389 6.660827 15.49931 7.346537 -0.1154165     9.916562 
1 1 1 7   10 43 f 12.39138 5.629196 -0.2266242     3.702507 3.269544       5.019556 -4.398803      5.483408 16.24851 6.997379 12.37195 5.980809 3.876565       9.205074 
1 1 1 7   10 44 f 10.41159 4.974489 -2.556304      3.546283 -2.520579      4.756601 -2.601012      5.321156 11.98406 5.735365 12.52983 6.014948 -0.5457659     8.311078 
1 1 1 7   10 45 o 13.59214 6.240963 1.481871       4.711740 5.605291       9.344242 0.7600608E-01  5.456160 16.49075 7.930448 13.30395 6.303038 3.186803       10.13017 
1 1 1 7   10 46 o 14.92380 6.184755 4.178785       3.681769 0.8586934      5.163620 7.612322       5.251098 13.03177 6.161488 17.39541 7.310453 -4.363634      9.560683 
1 1 1 7   11 0  o 300.1969 4.176522 1098.337       30.55323 1116.297       48.67980 1086.664       39.24596 302.5801 6.601951 298.5704 5.394014 4.009735       8.525323 
1 1 1 7   11 1  o 621.1259 8.983483 4706.558       135.9754 4589.179       188.8049 4833.045       195.9931 612.9600 12.63994 629.0175 12.78621 -16.05750      17.97930 
1 1 1 7   11 2  o 529.9025 6.915265 3423.877       89.29781 3282.506       137.0217 3528.250       117.7338 518.5687 10.84294 537.7822 8.983773 -19.21350      14.08110 
1 1 1 7   11 3  o 472.8734 6.221387 2726.195       71.69159 2752.536       113.8197 2708.871       92.30273 474.9386 9.834306 471.2738 8.037207 3.664795       12.70080 
1 1 1 7   11 4  o 151.4785 2.906631 279.6182       10.72944 274.0594       15.02105 285.4089       15.33113 149.8988 4.116020 152.9734 4.116395 -3.074631      5.821196 
1 1 1 7   11 5  o 292.6390 5.217834 1043.905       37.20990 1048.832       63.71342 1041.354       45.83972 293.0695 8.931644 292.2479 6.436570 0.8216248      11.00926 
1 1 1 7   11 6  o 753.5286 12.54592 6936.504       230.3767 7417.813       417.4702 6725.753       276.2475 776.8054 22.07587 741.5242 15.28752 35.28113       26.85241 
1 1 1 7   11 7  o 393.8936 8.444828 1892.791       81.05985 2063.584       121.0699 1754.025       109.1296 410.8356 12.10615 378.7701 11.83761 32.06549       16.93186 
1 1 1 7   11 8  o 736.1252 21.42017 6663.582       383.8386 0.000000       0.000000 6663.582       383.8386 ?        ?        736.1252 21.42017 0.000000       21.42017 
1 1 1 7   11 9  o 659.7405 19.28882 5346.358       309.7764 0.000000       0.000000 5346.358       309.7764 ?        ?        659.7405 19.28882 0.000000       19.28882 
1 1 1 7   11 10 o 571.3158 11.84293 3988.769       164.8813 4029.231       234.7100 3949.346       231.6745 573.1060 16.82406 567.4028 16.77365 5.703125       23.75720 
1 1 1 7   11 11 o 369.9980 7.934190 1670.467       71.53821 0.000000       0.000000 1670.467       71.53821 ?        ?        369.9980 7.934190 0.000000       7.934190 
1 1 1 7   11 12 o 394.0020 5.904530 1893.199       56.69174 1874.532       114.3249 1899.286       65.28378 391.3181 12.00296 394.5772 6.789489 -3.259094      13.79015 
1 1 1 7   11 13 o 239.8419 4.497972 701.3235       26.28924 749.6675       33.83983 627.7311       41.75163 247.9295 5.600978 226.6587 7.569631 21.27083       9.416490 
1 1 1 7   11 14 o 426.7482 6.359192 2222.133       66.13171 2153.462       91.46815 2297.345       95.72578 419.8099 8.940897 433.5915 9.059664 -13.78156      12.72860 
1 1 1 7   11 15 o 441.0804 6.553892 2374.894       70.44547 2431.218       101.0396 2321.617       98.26806 445.8633 9.299379 435.7052 9.255152 10.15808       13.12007 
1 1 1 7   11 16 o 131.3325 2.862827 210.2512       9.162274 207.1008       12.65356 213.7235       13.28426 130.2572 3.991051 132.3176 4.124911 -2.060364      5.739633 
1 1 1 7   11 17 o 240.2198 4.537548 704.0401       26.56233 700.5317       32.68775 710.8605       45.57627 239.5379 5.599829 240.9495 7.772222 -1.411621      9.579432 
1 1 1 7   11 18 o 175.1879 3.270654 374.2626       13.96287 364.3619       19.19805 385.3814       20.34477 172.7269 4.565011 177.6301 4.704165 -4.903183      6.555036 
1 1 1 7   11 19 o 218.7158 4.380446 583.9232       23.34719 587.9645       28.11539 574.9459       41.90401 219.3835 5.259011 216.4328 7.958597 2.950638       9.539207 
1 1 1 7   11 20 o 46.09625 3.123650 26.03720       3.488119 33.06577       4.566990 16.19688       5.403821 51.92916 3.631861 35.84128 6.422941 16.08788       7.378658 
1 1 1 7   11 21 o 217.0201 3.771940 574.9095       19.94807 577.3335       27.98968 572.4073       28.43731 217.2860 5.286035 216.3411 5.394030 0.9449615      7.552332 
1 1 1 7   11 22 o 194.0899 3.542319 459.8271       16.75431 444.4610       22.91092 477.4901       24.56367 190.5945 4.936987 197.5255 5.107384 -6.930969      7.103465 
1 1 1 7   11 23 o 124.2843 2.941360 188.4709       8.908415 186.2326       12.14116 191.0813       13.11153 123.4020 4.042857 124.9684 4.311896 -1.566368      5.910765 
1 1 1 7   11 24 o 42.46616 4.950618 22.36718       5.027194 27.30937       10.20275 20.78259       5.777170 46.16507 9.389250 40.73872 5.998699 5.426353       11.14192 
1 1 1 7   11 25 o 154.4756 3.873358 291.8370       14.56938 330.3021       27.74833 277.1968       17.11892 163.6825 6.972597 150.4201 4.675869 13.26239       8.395288 
1 1 1 7   11 26 o 71.36087 3.328266 62.34197       5.771867 59.50740       8.026443 65.37746       8.306041 69.54067 4.765197 72.91433 4.699635 -3.373657      6.692807 
1 1 1 7   11 27 o 251.4590 4.253725 774.0916       26.06590 719.3451       34.93942 842.8044       39.14322 241.8676 5.927914 261.7159 6.137484 -19.84828      8.532811 
1 1 1 7   11 28 o 53.00994 3.507755 34.51057       4.505814 34.72224       5.735965 34.16949       7.281366 53.04213 4.479446 52.38925 5.800465 0.6528854      7.328767 
1 1 1 7   11 29 f 22.04041 6.285639 6.143875       3.540803 7.641228       4.334933 3.142329       6.137519 24.52424 6.941877 20.82501 8.212120 3.699226       10.75307 
1 1 1 7   11 30 o 80.28570 3.198125 78.96740       6.244531 77.57279       8.002538 81.13862       9.985147 79.42486 4.149002 81.05257 5.080914 -1.627716      6.559719 
1 1 1 7   11 31 o 38.50774 5.799572 18.72338       5.273539 18.72338       5.273539 0.000000       0.000000 38.50774 5.799572 ?        ?        0.000000       5.799572 
1 1 1 7   11 32 o 12.93100 5.711083 -1.023321      3.529902 0.5742996E-02  4.303289 -3.139891      6.171569 15.28004 6.527560 16.16250 7.312564 -0.8824654     9.802176 
1 1 1 7   11 33 o 152.6413 3.357851 285.9406       12.49021 282.4507       16.95297 290.0841       18.47232 151.1621 4.607592 153.0197 4.960346 -1.857620      6.770150 
1 1 1 7   11 34 o 30.67777 5.495762 12.07614       3.957643 13.28804       4.955766 9.942537       6.575573 31.92732 6.588221 27.72348 8.724630 4.203835       10.93270 
1 1 1 7   11 35 o 31.40212 5.369432 12.69194       3.961338 15.69816       4.953727 7.359838       6.597369 34.78106 6.064985 24.72940 8.755964 10.05166       10.65134 
1 1 1 7   11 36 o 18.14400 7.343345 2.326151       5.038160 1.504406       8.895305 2.714261       6.113224 21.78885 9.348149 19.74058 8.052080 2.048269       12.33790 
1 1 1 7   11 37 o 22.97761 8.544074 6.362533       6.386365 0.000000       0.000000 6.362533       6.386365 ?        ?        22.97761 8.544074 0.000000       8.544074 
1 1 1 7   11 38 o 24.21410 6.529830 8.125829       3.940562 4.216110       4.944602 14.93110       6.523508 19.43389 7.452096 31.94450 8.304320 -12.51061      11.15775 
1 1 1 7   11 39 o 33.79760 5.328169 15.38309       4.243156 16.23345       5.607358 14.24379       6.490506 33.58937 7.074312 30.43118 8.451723 3.158188       11.02168 
1 1 1 7   11 40 o 14.41471 6.037179 1.390797       3.562422 0.9859235      4.575380 2.014117       5.677055 15.32986 6.641346 17.28207 7.442013 -1.952215      9.974520 
1 1 1 7   11 41 o 11.78878 5.390510 -1.148671      3.466496 -0.7772570     4.362744 -1.784722      5.709215 13.39284 6.094449 14.44661 6.716145 -1.053772      9.069118 
1 1 1 7   11 42 o 26.95089 6.815704 11.83724       4.478453 13.37306       5.206884 7.471153       8.779187 27.89313 7.499152 20.49923 9.032093 7.393902       11.73950 
1 1 1 7   11 43 o 25.23489 6.304221 10.43656       3.865266 19.52810       5.431195 1.106035       5.502119 34.31212 6.736053 14.93968 6.816005 19.37244       9.582918 
1 1 1 7   11 44 o 10.81126 5.102041 -1.644823      3.509933 -0.1159257     4.870447 -3.296820      5.062723 13.19805 6.158262 11.87731 5.742937 1.320735       8.420542 
1 1 1 7   11 45 o 11.66899 5.385798 0.7360835E-01  3.573501 3.293246       4.981398 -3.339963      5.129231 14.73659 6.627288 11.52081 5.618461 3.215782       8.688387 
1 1 1 7   11 46 o 12.07961 5.715880 0.2367922E-01  4.460541 -0.9064555E-01 8.978971 0.6113720E-01  5.139591 13.94324 6.919326 12.54216 5.991395 1.401073       9.152808 
1 1 1 7   12 0  o 332.9322 4.564855 1351.003       37.03555 1258.460       55.90598 1423.379       49.44031 321.2527 7.141270 341.6959 5.937523 -20.44324      9.287191 
1 1 1 7   12 1  o 437.0379 5.792928 2328.466       61.69548 2404.693       99.50232 2280.858       78.63608 443.9587 9.197176 432.4730 7.461510 11.48572       11.84323 
1 1 1 7   12 2  o 267.1369 3.824335 869.7080       24.89579 867.3329       39.04531 871.3350       32.31721 266.7270 6.007114 267.3657 4.960118 -0.6387329     7.790263 
1 1 1 7   12 3  o 1057.856 15.10513 13684.97       389.3923 13648.71       549.9324 13721.42       551.4384 1054.522 21.40019 1057.326 21.40187 -2.804443      30.26563 
1 1 1 7   12 4  o 229.5640 4.339070 642.3150       24.27373 631.4875       40.79558 648.2493       30.20176 227.4355 7.370425 230.6030 5.374416 -3.167435      9.121816 
1 1 1 7   12 5  o 496.3257 8.376014 3005.094       101.3072 2914.685       170.8927 3054.082       125.7941 488.0258 14.38530 500.2002 10.32002 -12.17447      17.70423 
1 1 1 7   12 6  o 462.5897 6.781456 2609.470       76.44604 2531.530       148.9630 2637.335       89.06928 454.8880 13.45288 464.9879 7.860500 -10.09991      15.58100 
1 1 1 7   12 7  o 431.9345 9.062914 2276.708       95.39419 0.000000       0.000000 2276.708       95.39419 ?        ?        431.9345 9.062914 0.000000       9.062914 
1 1 1 7   12 8  o 62.56248 4.769642 47.98902       7.216886 45.50171       9.943854 50.75732       10.49051 60.69862 6.841693 64.15337 6.814405 -3.454750      9.656339 
1 1 1 7   12 9  o 355.4331 7.780994 1541.276       67.39522 1607.923       97.65916 1480.674       93.12490 362.6312 11.06420 347.9803 10.99564 14.65088       15.59874 
1 1 1 7   12 10 o 376.6805 6.612974 1730.590       60.70242 1555.858       99.17823 1835.255       76.75921 356.6171 11.42718 387.8036 8.122365 -31.18652      14.01974 
1 1 1 7   12 11 o 579.4323 9.764763 4100.937       137.8798 4235.114       244.9372 4038.696       166.8212 587.0879 17.13881 574.6728 11.91227 12.41510       20.87201 
1 1 1 7   12 12 o 332.0091 5.108381 1344.126       41.33037 1180.379       78.16677 1407.670       48.69385 310.5890 10.34204 339.7239 5.881823 -29.13492      11.89763 
1 1 1 7   12 13 o 242.0984 3.988066 714.5428       23.52829 660.3333       47.12748 732.5402       27.15452 232.3707 8.336062 245.1082 4.546196 -12.73747      9.495148 
1 1 1 7   12 14 o 631.8488 9.177864 4881.475       141.3158 4769.438       197.0082 5000.218       202.8201 623.4727 12.96674 638.3541 13.03807 -14.88135      18.38824 
1 1 1 7   12 15 o 80.26706 2.892175 78.63702       5.647906 82.55838       7.341446 72.95072       8.840516 82.20479 3.674068 77.18965 4.722435 5.015137       5.983324 
1 1 1 7   12 16 o 158.8071 3.475851 307.5148       13.45139 313.8524       16.97711 296.8259       22.04788 160.3431 4.348891 155.8117 5.816931 4.531448       7.262888 
1 1 1 7   12 17 o 52.44067 2.837049 33.62525       3.612028 31.38248       4.728772 36.76668       5.596529 50.57575 3.866111 54.73349 4.228713 -4.157745      5.729645 
1 1 1 7   12 18 o 128.1507 2.859235 200.2457       8.929080 189.1077       12.07892 213.6654       13.25862 124.4294 3.988690 132.2598 4.118738 -7.830360      5.733555 
1 1 1 7   12 19 o 78.60723 3.215127 75.49649       6.145811 78.69612       7.003273 64.77764       12.81814 80.23177 3.591043 72.33876 7.374413 7.893013       8.202290 
1 1 1 7   12 20 o 71.91353 2.709026 63.15811       4.738957 65.84963       6.387330 59.86233       7.068045 73.37023 3.583264 69.89555 4.168609 3.474678       5.497006 
1 1 1 7   12 21 o 205.7405 3.638068 516.6897       18.24008 501.5999       25.08471 533.6194       26.57006 202.4762 5.087954 208.8846 5.219753 -6.408356      7.289245 
1 1 1 7   12 22 o 187.6184 3.471564 429.6879       15.87218 448.0651       22.55734 411.6669       22.33759 191.3625 4.841096 183.3938 5.002896 7.968719       6.961694 
1 1 1 7   12 23 o 58.66697 3.018680 42.11325       4.301145 43.67279       5.523732 39.71133       6.855093 59.67279 3.818609 56.74874 5.008373 2.924057       6.298061 
1 1 1 7   12 24 o 107.4678 4.289921 141.4480       11.21219 0.000000       0.000000 141.4480       11.21219 ?        ?        107.4678 4.289921 0.000000       4.289921 
1 1 1 7   12 25 o 64.99081 3.222485 51.70744       5.087710 44.50243       6.911633 60.22894       7.516594 60.10129 4.757909 70.01917 4.427903 -9.917885      6.499540 
1 1 1 7   12 26 f 117.7176 2.990648 169.3228       8.572171 163.2693       11.47966 176.9526       12.88795 115.4506 4.086790 120.1457 4.409371 -4.695091      6.012022 
1 1 1 7   12 27 o 48.31394 3.622957 28.70213       4.234450 31.37094       5.443869 24.61390       6.737774 50.40774 4.478304 44.24981 6.437002 6.157925       7.841569 
1 1 1 7   12 28 o 130.4381 3.107309 207.9185       9.876997 193.4147       13.04464 227.4057       15.12050 125.5715 4.269106 136.1074 4.565238 -10.53590      6.250333 
1 1 1 7   12 29 o 122.7360 3.107072 184.2823       9.285601 180.7497       12.36832 188.8451       14.05676 121.3554 4.188582 123.9402 4.662428 -2.584755      6.267571 
1 1 1 7   12 30 o 21.17583 6.951473 5.360103       4.144012 5.360103       4.144012 0.000000       0.000000 21.17583 6.951473 ?        ?        0.000000       6.951473 
1 1 1 7   12 31 o 117.2850 3.641104 168.7956       10.39406 169.3108       12.05603 167.3036       20.51486 117.3215 4.223764 115.5367 7.324090 1.784805       8.454731 
1 1 1 7   12 32 o 71.98787 3.268427 63.65245       5.718733 62.86635       7.411577 64.80905       8.990102 71.33662 4.283185 72.21919 5.141928 -0.8825760     6.692167 
1 1 1 7   12 33 o 108.0974 3.144059 143.4722       8.273334 139.2141       10.95971 149.1133       12.61456 106.1461 4.245567 109.6788 4.730813 -3.532715      6.356526 
1 1 1 7   12 34 o 71.35069 3.316954 62.76377       5.751534 58.32954       7.357264 69.73244       9.223217 68.46187 4.433773 74.63571 5.101748 -6.173843      6.759155 
1 1 1 7   12 35 o 58.09209 3.627228 41.89629       5.109230 41.96164       6.572711 41.79650       8.121736 57.77420 4.709282 57.16042 5.916072 0.6137848      7.561564 
1 1 1 7   12 36 o 28.55796 8.712826 11.28234       6.616062 0.000000       0.000000 11.28234       6.616062 ?        ?        28.55796 8.712826 0.000000       8.712826 
1 1 1 7   12 37 o 31.87338 5.663137 13.46848       4.237513 12.25272       5.567937 15.14192       6.532455 29.52073 7.670938 32.57870 8.227584 -3.057970      11.24884 
1 1 1 7   12 38 o 19.18895 6.706647 4.737800       3.861587 0.5472227      4.920673 11.45623       6.230481 15.94411 6.897444 27.78547 8.450733 -11.84136      10.90824 
1 1 1 7   12 39 o 22.75497 6.554245 7.445439       3.831507 5.748251       4.995943 9.869362       5.970516 20.58002 7.574214 25.32312 8.345518 -4.743105      11.27015 
1 1 1 7   12 40 o 14.22523 5.989326 1.328897       3.535028 2.850851       4.716569 -0.6218469     5.339807 16.95495 7.010882 14.98687 6.789196 1.968085       9.759388 
1 1 1 7   12 41 o 18.32610 6.765390 5.000022       3.991074 1.434987       4.662505 14.77345       7.719884 15.22173 6.647902 27.15962 9.483280 -11.93789      11.58133 
1 1 1 7   12 42 o 12.40244 5.679363 -0.7109953     3.866533 1.017610       4.551003 -5.196381      7.330931 14.42505 6.421546 14.08998 6.836014 0.3350744      9.379091 
1 1 1 7   12 43 o 28.27505 6.047645 12.85299       4.040926 13.06224       5.466081 12.60081       6.000728 25.75171 7.931333 24.37085 8.368449 1.380859       11.52983 
1 1 1 7   12 44 o 19.40866 6.704117 7.163568       3.853123 11.38116       5.368749 2.683560       5.533251 22.60613 7.907379 15.06708 6.859104 7.539050       10.46776 
1 1 1 7   12 45 o 14.47804 6.159580 3.467971       3.804081 1.103401       5.274833 6.030558       5.491259 13.45884 6.321321 16.47518 7.204535 -3.016341      9.584593 
1 1 1 7   12 46 o 12.55571 6.021478 0.5359181E-01  5.303479 0.000000       0.000000 0.5359181E-01  5.303479 ?        ?        12.55571 6.021478 0.000000       6.021478 
1 1 1 7   13 0  o 413.8238 8.723149 2089.143       87.96803 0.000000       0.000000 2089.143       87.96803 ?        ?        413.8238 8.723149 0.000000       8.723149 
1 1 1 7   13 1  o 737.9508 12.25559 6651.565       220.3930 6220.250       364.0494 6901.096       276.9011 711.6348 21.01566 751.1849 15.12661 -39.55011      25.89348 
1 1 1 7   13 2  o 750.6228 12.45271 6882.880       227.7833 6902.643       394.7004 6873.012       278.9171 749.4489 21.63437 749.5985 15.26899 -0.1495972     26.47995 
1 1 1 7   13 3  o 623.3099 9.025597 4740.440       137.0932 4290.725       255.2589 4922.746       162.5224 591.5718 17.72668 635.0261 10.50233 -43.45422      20.60423 
1 1 1 7   13 4  o 458.3360 6.762268 2561.677       75.52878 2469.763       104.2158 2663.365       109.6164 449.8612 9.506457 467.1510 9.629021 -17.28979      13.53110 
1 1 1 7   13 5  o 754.7872 10.84993 6956.534       199.5664 6728.773       275.7577 7207.006       289.1795 741.5464 15.25995 767.4022 15.46352 -25.85571      21.72525 
1 1 1 7   13 6  o 354.1062 5.332393 1528.657       46.01419 1627.086       94.80668 1498.326       52.62847 364.8746 10.67398 350.5436 6.160878 14.33105       12.32437 
1 1 1 7   13 7  o 582.5449 8.463091 4140.917       120.1419 3930.891       233.4162 4216.611       140.1294 566.0958 16.93924 587.7015 9.784451 -21.60565      19.56203 
1 1 1 7   13 8  o 583.4905 8.483994 4154.851       120.6341 4479.621       255.3316 4061.523       136.8740 604.1132 17.36205 576.7563 9.738508 27.35687       19.90676 
1 1 1 7   13 9  o 364.7879 5.526840 1622.567       49.13075 1691.344       102.5309 1602.068       55.97563 371.8360 11.32855 362.4348 6.337720 9.401245       12.98086 
1 1 1 7   13 10 o 336.8918 5.160293 1383.858       42.36438 1412.924       87.50851 1374.960       48.41626 339.8672 10.57874 335.7700 5.917159 4.097229       12.12116 
1 1 1 7   13 11 o 69.30586 2.490663 58.61200       4.199662 57.03959       11.14231 58.87237       4.534051 68.03455 6.812153 69.45160 2.684024 -1.417046      7.321845 
1 1 1 7   13 12 o 120.8238 4.567054 178.2555       13.42277 187.9685       18.89544 168.3611       19.07111 123.9626 6.275458 117.2672 6.701554 6.695419       9.181079 
1 1 1 7   13 13 o 469.2118 6.895997 2687.782       78.85006 2786.337       114.9431 2600.179       108.3688 477.2451 9.883373 461.0710 9.644954 16.17407       13.80964 
1 1 1 7   13 14 o 58.80180 2.447007 42.21499       3.498741 36.02030       5.708559 45.94195       4.427860 54.17115 4.361194 61.31941 2.972043 -7.148262      5.277599 
1 1 1 7   13 15 o 117.3076 2.810468 167.7494       8.034167 164.0586       11.33156 171.4800       11.39274 115.9124 4.017734 118.5123 3.950355 -2.599922      5.634490 
1 1 1 7   13 16 o 102.1097 3.010872 127.2316       7.483780 129.2549       9.637540 124.1585       11.87736 102.8703 3.851301 100.7452 4.852195 2.125130       6.194862 
1 1 1 7   13 17 o 365.6751 5.576210 1633.576       49.69019 1666.089       71.02675 1602.410       69.54185 368.8077 7.902887 361.6942 7.889847 7.113525       11.16715 
1 1 1 7   13 18 o 203.2501 3.589246 503.9987       17.77747 500.2726       24.90175 507.8717       25.38758 202.3694 5.049507 203.8302 5.115170 -1.460800      7.187662 
1 1 1 7   13 19 o 94.05138 3.243812 108.0391       7.423461 110.5276       8.557403 100.4714       14.92289 95.09567 3.699768 90.30865 6.831570 4.787018       7.769082 
1 1 1 7   13 20 o 224.9417 3.858470 617.7217       21.15052 596.9682       29.13604 640.8413       30.75205 220.9226 5.411955 228.8803 5.513529 -7.957657      7.725818 
1 1 1 7   13 21 o 126.7556 2.924493 196.0107       9.033451 208.5205       12.78334 183.5325       12.76713 130.6043 4.021320 122.4932 4.283650 8.111046       5.875430 
1 1 1 7   13 22 o 99.68306 2.792943 121.3221       6.777841 116.2112       9.064533 127.8032       10.20758 97.47046 3.823664 102.1938 4.107217 -4.723351      5.611563 
1 1 1 7   13 23 o 309.4036 5.619214 1173.210       42.36790 1158.680       70.69635 1181.354       52.92488 305.7026 9.501438 309.9787 7.006351 -4.276123      11.80535 
1 1 1 7   13 24 o 96.84933 2.907385 114.5895       6.853988 106.5372       9.006321 125.6708       10.56526 93.27241 3.971489 101.2760 4.290645 -8.003609      5.846568 
1 1 1 7   13 25 o 156.5801 3.924128 299.9774       14.96145 284.4373       26.78409 307.0255       18.03799 151.6997 7.266423 158.2714 4.681956 -6.571625      8.644167 
1 1 1 7   13 26 o 32.59513 4.290805 13.22768       3.325529 13.48060       4.086434 12.73173       5.722336 32.73540 5.303939 31.47504 7.556378 1.260361       9.232042 
1 1 1 7   13 27 o 40.17608 3.896123 19.93562       3.766659 20.35584       4.674961 19.15805       6.359258 40.45603 4.837757 38.81462 6.979769 1.641411       8.492413 
1 1 1 7   13 28 o 125.1675 3.075808 191.4776       9.381816 190.6438       12.57795 192.5232       14.08543 124.6716 4.145824 125.1843 4.625210 -0.5127640     6.211315 
1 1 1 7   13 29 o 88.10957 4.031484 95.35590       8.633200 95.35590       8.633200 0.000000       0.000000 88.10957 4.031484 ?        ?        0.000000       4.031484 
1 1 1 7   13 30 o 74.43437 3.129540 67.90752       5.663959 67.37698       7.302118 68.70882       8.974009 73.99297 4.065316 74.54245 4.968590 -0.5494843     6.419788 
1 1 1 7   13 31 o 74.35200 3.145497 67.81360       5.686378 67.52054       7.359113 68.24784       8.958130 74.01855 4.095862 74.21742 4.981938 -0.1988754     6.449480 
1 1 1 7   13 32 o 23.64332 6.519245 7.206158       3.877239 7.327313       4.192022 6.489117       10.19820 23.88542 6.848134 27.11589 10.61795 -3.230471      12.63479 
1 1 1 7   13 33 o 100.6238 3.113059 124.3983       7.624329 123.2247       10.08837 125.9614       11.64277 99.82555 4.156181 100.7023 4.757847 -0.8767548     6.317512 
1 1 1 7   13 34 o 73.65381 3.214401 66.89104       5.755517 63.34394       7.329055 72.59801       9.296381 71.35970 4.233653 76.09367 5.041796 -4.733971      6.583580 
1 1 1 7   13 35 f 57.26785 4.832875 41.40742       6.681649 39.77863       12.26046 42.09555       7.969030 53.41699 9.778960 57.32079 5.784050 -3.903793      11.36148 
1 1 1 7   13 36 o 101.0078 4.123209 127.9885       10.12774 123.4237       17.91829 130.1314       12.27692 95.80524 7.740732 101.1774 4.994754 -5.372200      9.212301 
1 1 1 7   13 37 o 37.03762 4.815585 17.78918       4.243574 16.89395       5.357918 19.29594       6.951023 35.26165 6.473795 36.82815 7.976447 -1.566502      10.27296 
1 1 1 7   13 38 o 24.87332 6.182335 8.630802       3.731095 5.832661       4.572728 14.20447       6.453737 20.82065 7.296582 30.67919 8.391707 -9.858538      11.12029 
1 1 1 7   13 39 o 33.17032 5.099650 14.90883       3.990385 12.87105       5.075578 18.20693       6.457132 29.38764 7.155292 34.50684 7.855711 -5.119194      10.62593 
1 1 1 7   13 40 o 12.11394 5.543500 -1.295686      3.675477 -3.891698      4.395402 4.739985       6.702057 11.73593 5.587959 19.55935 8.241646 -7.823413      9.957410 
1 1 1 7   13 41 o 16.73848 6.270269 3.974214       3.452162 4.892445       4.460297 2.602372       5.451799 18.13868 7.045034 16.60437 7.221094 1.534309       10.08844 
1 1 1 7   13 42 o 20.70463 7.017092 7.427251       4.216744 6.235328       4.988942 10.40863       7.890296 19.01876 7.432574 21.79759 9.045527 -2.778835      11.70746 
1 1 1 7   13 43 o 16.91506 6.394933 4.800890       3.608975 2.521948       4.976525 7.328978       5.241500 15.16086 6.734071 19.20118 7.583675 -4.040322      10.14198 
1 1 1 7   13 44 f 15.76866 6.246779 4.349560       3.566266 5.463374       4.958712 3.156208       5.132712 16.68870 7.063457 14.99008 6.735406 1.698620       9.760027 
1 1 1 7   13 45 o 15.35738 6.467598 4.524419       4.123758 10.39325       6.412870 0.3866255      5.384696 18.90587 8.018607 13.06451 6.210413 5.841360       10.14235 
1 1 1 7   14 0  o 210.1854 3.669941 538.4096       18.79740 525.3241       37.05711 542.9432       21.81189 207.4131 7.343193 211.0602 4.240829 -3.647079      8.479807 
1 1 1 7   14 1  f 470.3946 6.953147 2698.371       79.70395 2766.488       162.1927 2676.684       91.51639 475.4697 14.01350 468.4347 8.017034 7.035004       16.14469 
1 1 1 7   14 2  o 205.9373 4.102584 516.9022       20.58869 553.4514       36.13045 499.3267       25.05457 212.9187 6.972837 202.3256 5.085625 10.59308       8.630414 
1 1 1 7   14 3  o 510.5157 6.701418 3178.242       83.37041 3052.466       128.2447 3270.303       109.7184 500.0063 10.52514 517.7090 8.696759 -17.70276      13.65328 
1 1 1 7   14 4  o 464.1276 6.849644 2627.074       77.47141 2732.354       112.3658 2531.688       106.9565 473.1177 9.746053 455.4226 9.637327 17.69510       13.70634 
1 1 1 7   14 5  o 154.7774 3.048978 291.9461       11.50000 318.9489       16.73984 267.8124       15.82557 161.7069 4.251709 148.1624 4.387973 13.54454       6.109938 
1 1 1 7   14 6  o 222.9979 3.325944 606.0523       18.07390 634.4462       29.40480 588.8112       22.91334 228.1208 5.289533 219.7861 4.278111 8.334671       6.803042 
1 1 1 7   14 7  o 98.69289 3.170876 118.8298       7.616180 108.6812       13.94328 123.1454       9.092448 94.20660 6.106523 100.4477 3.720970 -6.241058      7.150891 
1 1 1 7   14 8  o 245.7287 4.008686 736.0225       24.00458 739.7953       49.84311 734.8831       27.39030 246.0554 8.324572 245.5236 4.577912 0.5318298      9.500303 
1 1 1 7   14 9  o 296.1032 4.638623 1068.926       33.47097 1188.401       73.35648 1037.512       37.61471 311.7581 9.667401 291.6940 5.291687 20.06415       11.02092 
1 1 1 7   14 10 o 517.3667 8.787266 3269.162       110.7869 3311.728       194.4524 3248.704       134.8057 519.2285 15.38502 515.4443 10.73224 3.784241       18.75846 
1 1 1 7   14 11 o 178.3113 3.675117 387.5901       15.96931 371.7909       29.89474 393.8987       18.89037 174.3854 7.049277 179.7403 4.312796 -5.354889      8.263928 
1 1 1 7   14 12 o 125.8291 3.933662 193.2293       12.04704 210.7674       20.01492 183.2659       15.08579 131.2648 6.275223 122.4714 5.065655 8.793335       8.064694 
1 1 1 7   14 13 o 152.2157 3.608699 282.4917       13.38585 251.7664       23.37004 297.4937       16.32998 143.4303 6.704801 156.1252 4.296252 -12.69484      7.963174 
1 1 1 7   14 14 o 41.74400 3.176212 21.36746       3.206765 25.04477       4.861085 18.53419       4.266893 45.08919 4.483438 38.70469 4.614678 6.384499       6.434008 
1 1 1 7   14 15 o 339.9417 4.659703 1410.160       38.60102 1384.153       60.72301 1427.797       50.00493 336.4064 7.407180 341.8916 6.001894 -5.485168      9.533575 
1 1 1 7   14 16 o 203.9355 3.585496 507.2841       17.81879 539.1093       26.06172 479.3475       24.41769 210.1226 5.089725 198.0722 5.062920 12.05035       7.179029 
1 1 1 7   14 17 o 252.2175 4.734316 776.7860       29.09837 814.3142       50.29815 757.9077       35.67419 257.5926 8.022548 248.9872 5.879508 8.605423       9.946350 
1 1 1 7   14 18 o 39.57410 3.322779 19.23994       3.174850 19.05177       4.236146 19.48108       4.795539 39.24116 4.511898 39.60652 5.085843 -0.3653603     6.798751 
1 1 1 7   14 19 o 267.9549 5.091001 877.7093       33.24305 871.7642       40.01395 890.9548       59.72619 266.8450 6.153416 268.8478 9.129621 -2.002838      11.00975 
1 1 1 7   14 20 o 28.70665 4.909140 10.35574       3.310863 9.469891       3.545806 16.38367       9.249504 27.33562 5.513387 35.92710 10.13004 -8.591482      11.53322 
1 1 1 7   14 21 o 238.5757 4.021777 695.2621       23.38193 721.9126       33.58024 670.1807       32.57667 242.8036 5.675347 233.9343 5.714480 8.869354       8.053872 
1 1 1 7   14 22 o 75.66122 3.078290 69.98289       5.663843 76.99535       8.480412 64.33623       7.609882 79.23604 4.409347 72.41705 4.332023 6.818985       6.181324 
1 1 1 7   14 23 o 147.3014 3.138636 264.8839       11.26637 277.2769       15.84498 252.2114       16.02261 150.5166 4.324358 143.5056 4.587609 7.010941       6.304462 
1 1 1 7   14 24 o 118.5176 2.935267 171.4712       8.477475 169.1705       11.54289 174.1655       12.49110 117.5527 4.035431 119.2390 4.305861 -1.686203      5.901283 
1 1 1 7   14 25 o 125.6660 4.427277 193.5713       13.53666 202.1367       21.54029 187.9806       17.40238 127.8717 6.938588 123.5720 5.795138 4.299683       9.040334 
1 1 1 7   14 26 o 131.5463 3.059463 211.3820       9.807533 209.7138       13.41452 213.2977       14.37515 130.8104 4.213701 131.8748 4.479663 -1.064377      6.150013 
1 1 1 7   14 27 o 149.4446 3.221075 272.9801       11.73052 259.9925       15.68633 289.4584       17.66900 145.5774 4.426864 153.5401 4.727938 -7.962708      6.476923 
1 1 1 7   14 28 o 56.70053 4.314444 39.64659       5.916641 39.64659       5.916641 0.000000       0.000000 56.70053 4.314444 ?        ?        0.000000       4.314444 
1 1 1 7   14 29 o 60.99891 3.316385 45.66813       4.911187 45.94533       6.255971 45.22291       7.928364 61.04607 4.231527 60.32897 5.451660 0.7171021      6.901190 
1 1 1 7   14 30 o 95.36676 3.050799 111.3959       7.080886 102.8316       9.157680 124.1286       11.16613 91.42472 4.121009 100.3553 4.577956 -8.930550      6.159578 
1 1 1 7   14 31 o 25.45844 5.664994 8.342958       3.423941 8.651610       4.148715 7.683676       6.063379 25.85080 6.572272 25.20165 8.413697 0.6491489      10.67638 
1 1 1 7   14 32 o 51.82511 4.164078 33.31168       5.214676 33.88723       5.705754 30.39329       12.84829 52.19021 4.531154 47.09719 11.33279 5.093025       12.20506 
1 1 1 7   14 33 o 12.79008 5.517584 -0.2131477     3.131503 0.9661078      3.757976 -2.892469      5.664511 15.15403 6.261325 15.36903 6.974329 -0.2149992     9.372591 
1 1 1 7   14 34 o 21.26023 7.773610 5.020727       5.248899 11.20314       10.39168 2.903127       6.081751 29.95893 10.94041 20.03216 8.082219 9.926764       13.60201 
1 1 1 7   14 35 o 70.34273 3.706415 61.61024       6.331027 69.21265       9.004216 54.17698       8.903481 73.91695 5.028745 65.01565 5.676473 8.901299       7.583576 
1 1 1 7   14 36 o 12.89604 5.625311 -0.3000972     3.329656 -0.1693029     3.983327 -0.6034403     6.066225 14.18291 6.170177 16.95039 7.486518 -2.767473      9.701497 
1 1 1 7   14 37 o 20.29144 7.583944 4.972551       5.044318 1.176396       8.785104 6.839713       6.161209 20.55676 9.047128 22.85377 8.411234 -2.297010      12.35311 
1 1 1 7   14 38 o 28.39205 5.544459 11.02991       3.698444 12.09951       4.639377 9.165033       6.125946 29.10183 6.683049 24.71451 8.456273 4.387312       10.77830 
1 1 1 7   14 39 o 40.89719 4.689544 22.37492       4.589249 24.63141       5.481405 17.08536       8.392364 42.30486 5.442966 30.85861 9.874087 11.44625       11.27491 
1 1 1 7   14 40 o 11.57192 5.235136 -0.7569587     3.162260 0.4999276E-01  4.093011 -1.951925      4.980776 13.62695 6.076550 13.49193 6.272574 0.1350222      8.733250 
1 1 1 7   14 41 o 21.17114 6.310709 7.106761       3.500000 6.318429       4.604844 8.185210       5.385923 19.57738 7.259775 21.44085 7.868780 -1.863478      10.70617 
1 1 1 7   14 42 o 15.63352 6.205194 3.465849       3.525334 0.4089539      4.703797 7.383371       5.324931 13.89478 6.324928 19.85348 7.701366 -5.958699      9.965729 
1 1 1 7   14 43 o 21.65967 7.124517 9.054012       4.352036 10.81829       5.285074 5.337762       7.670446 22.54263 7.848134 17.29439 7.948969 5.248245       11.17047 
1 1 1 7   14 44 o 10.44701 4.976726 -1.827589      3.495287 -4.695165      4.746766 1.568834       5.165962 10.70266 5.257915 13.86344 6.425606 -3.160777      8.302654 
1 1 1 7   14 45 o 16.03633 6.513976 5.338447       3.981023 12.20166       5.586837 -1.741119      5.674212 21.25621 7.973779 12.24842 5.958965 9.007793       9.954417 
1 1 1 7   15 0  o 410.3255 5.503164 2052.645       55.02715 1933.943       83.43266 2144.032       73.20654 398.1188 8.599779 419.2761 7.164958 -21.15726      11.19343 
1 1 1 7   15 1  o 893.4301 12.81425 9756.917       278.9908 9648.565       551.5379 9794.175       323.4203 883.8837 25.63322 894.6496 14.83468 -10.76593      29.61637 
1 1 1 7   15 2  o 235.0520 4.572062 673.4660       26.18860 679.2265       45.95726 670.6959       31.86927 235.8178 8.008885 234.5442 5.575851 1.273590       9.758707 
1 1 1 7   15 3  o 267.4346 4.308681 871.7831       28.08007 831.6252       53.24270 887.2570       33.05020 260.9286 8.384292 269.7789 5.027245 -8.850250      9.775968 
1 1 1 7   15 4  o 535.1586 9.016102 3495.707       117.5811 3445.626       142.8882 3600.746       206.9352 531.0783 11.04083 541.9521 15.68536 -10.87378      19.18151 
1 1 1 7   15 5  f 312.9880 5.570264 1194.455       42.48539 1175.170       51.75603 1234.298       74.39174 310.3950 6.842427 317.7973 9.616973 -7.402344      11.80275 
1 1 1 7   15 6  o 313.8317 4.339975 1200.604       33.19099 1209.443       52.74288 1194.808       42.70783 314.8755 6.873673 313.0255 5.598758 1.849976       8.865296 
1 1 1 7   15 7  o 248.5108 3.612377 752.7423       21.87633 808.6203       36.02877 720.1105       27.53276 257.5018 5.741602 243.0371 4.648802 14.46469       7.387649 
1 1 1 7   15 8  o 407.9073 6.106524 2029.559       60.70042 1869.563       116.5897 2089.054       71.09605 390.6659 12.26186 413.7679 7.051029 -23.10202      14.14462 
1 1 1 7   15 9  o 786.7354 13.07818 7583.822       250.7333 7295.681       424.7954 7737.878       310.6116 767.0107 22.75216 793.5638 16.06200 -26.55310      27.85047 
1 1 1 7   15 10 o 243.1649 4.547841 721.0166       26.94897 663.3058       47.00002 749.2831       32.89316 232.8735 8.295380 247.8438 5.446174 -14.97029      9.923413 
1 1 1 7   15 11 o 311.4470 5.661551 1183.537       42.96905 1128.582       73.27186 1212.342       53.04836 303.5320 9.919281 315.1067 6.908413 -11.57462      12.08794 
1 1 1 7   15 12 o 222.9896 3.770352 606.3037       20.48814 612.5109       43.22359 604.5049       23.26815 223.7101 7.941244 222.6348 4.288770 1.075302       9.025348 
1 1 1 7   15 13 o 59.09817 2.690835 42.66181       3.865061 27.75315       10.19096 45.16657       4.177140 46.79752 9.264235 60.80429 2.826825 -14.00677      9.685917 
1 1 1 7   15 14 f 420.2563 6.291278 2157.888       64.43017 1979.835       123.7773 2224.062       75.45916 400.6653 12.69321 426.4572 7.261068 -25.79190      14.62329 
1 1 1 7   15 15 o 72.78554 2.443981 64.65424       4.328752 67.20320       7.171931 63.19354       5.429187 74.11147 3.985798 71.92150 3.105019 2.189972       5.052497 
1 1 1 7   15 16 f 169.0208 3.213335 348.4295       13.23525 378.1612       29.89487 341.1812       14.76067 175.6229 6.999228 167.2311 3.622036 8.391785       7.880884 
1 1 1 7   15 17 o 79.03956 2.708716 76.26995       5.209569 71.96381       7.330744 80.66341       7.404699 76.68613 3.935958 81.21558 3.751515 -4.529449      5.437429 
1 1 1 7   15 18 o 188.2559 3.896607 432.6288       17.87604 447.8222       30.20930 424.4421       22.17515 191.1071 6.496203 186.3028 4.888623 4.804245       8.130147 
1 1 1 7   15 19 o 17.59765 6.202712 3.311133       3.307776 3.725724       3.586813 0.9532571      8.553808 18.50989 6.464024 22.26655 9.342249 -3.756660      11.36051 
1 1 1 7   15 20 o 48.61478 4.227390 29.09019       4.958398 32.12773       5.731970 20.05971       9.883227 51.05657 4.658231 39.52987 10.19382 11.52670       11.20772 
1 1 1 7   15 21 o 49.41993 3.347878 29.95085       4.008082 24.35801       5.504212 36.26408       5.847961 44.31112 5.195958 54.28268 4.460170 -9.971554      6.847707 
1 1 1 7   15 22 o 135.5144 3.005107 224.1376       9.923878 219.4829       13.70815 229.2635       14.38529 133.9257 4.205500 136.8642 4.318536 -2.938522      6.027933 
1 1 1 7   15 23 o 194.4189 3.591187 461.8064       17.01424 477.1229       24.29191 447.0568       23.83806 197.2909 5.056810 190.9532 5.127446 6.337662       7.201530 
1 1 1 7   15 24 o 140.1885 3.105115 239.9979       10.60782 238.6572       14.67002 241.4672       15.35700 139.5843 4.317983 140.3735 4.495162 -0.7892303     6.233094 
1 1 1 7   15 25 o 119.2157 3.691282 173.9472       10.71083 185.8754       20.58234 169.5173       12.54300 122.5646 6.919281 117.5780 4.385316 4.986565       8.191914 
1 1 1 7   15 26 o 136.7211 3.494128 228.7053       11.63200 226.6486       14.30870 232.7130       19.97396 135.9552 4.324351 137.3703 5.981049 -1.415085      7.380580 
1 1 1 7   15 27 o 180.4687 3.531003 398.4342       15.52873 402.0298       21.42985 394.4586       22.53360 180.8913 4.865863 179.0833 5.168852 1.808029       7.098849 
1 1 1 7   15 28 o 67.70148 3.150410 56.17232       5.183331 60.44390       6.869256 50.52440       7.898769 70.10722 4.037867 63.88712 5.116257 6.220100       6.517704 
1 1 1 7   15 29 o 31.44333 5.026634 12.46836       3.721951 7.648819       4.513324 22.71279       6.580180 24.53425 7.127620 42.31390 6.596463 -17.77965      9.711658 
1 1 1 7   15 30 o 30.39724 5.188985 11.71642       3.705869 13.55311       4.599042 8.315908       6.257806 32.56566 6.016826 26.06090 8.541644 6.504757       10.44806 
1 1 1 7   15 31 o 19.45392 6.241127 4.625021       3.351253 4.570873       4.101080 4.733849       5.814051 19.98162 6.915773 21.80107 8.143274 -1.819454      10.68367 
1 1 1 7   15 32 f 38.23127 4.990803 18.42884       4.538805 15.64776       4.861328 37.32627       12.67212 34.93543 5.921484 52.58327 10.25778 -17.64783      11.84424 
1 1 1 7   15 33 o 18.04388 7.355926 1.922697       5.098441 -10.49216      10.11668 6.149282       5.902854 18.06376 8.565319 23.09164 8.270929 -5.027878      11.90685 
1 1 1 7   15 34 o 20.81256 6.552395 5.545480       3.708494 2.752968       4.599841 10.73145       6.268449 18.08685 7.116401 28.16357 8.457358 -10.07673      11.05306 
1 1 1 7   15 35 o 20.02547 6.280743 5.201167       3.410532 7.422512       4.191874 0.8513770      5.865896 23.51749 6.879639 17.83925 7.620981 5.678236       10.26688 
1 1 1 7   15 36 o 50.47755 3.735565 32.08952       4.562493 31.62978       5.711490 32.90022       7.584426 49.60497 4.784133 49.60671 6.424784 -0.1739502E-02 8.010354 
1 1 1 7   15 37 o 27.62756 7.488768 11.05319       5.166990 10.18459       8.878808 11.49799       6.353686 26.38981 10.01821 27.70212 8.554433 -1.312305      13.17357 
1 1 1 7   15 38 o 20.04319 6.504894 5.652400       3.633742 9.630708       4.291385 -4.426426      6.830513 25.68740 6.763688 15.14628 7.138512 10.54112       9.833912 
1 1 1 7   15 39 o 12.36076 5.403500 0.1443300      3.086676 1.036818       3.905261 -1.341343      5.038607 14.39491 6.185230 14.13337 6.476212 0.2615442      8.955356 
1 1 1 7   15 40 o 20.16193 6.377459 6.293086       3.509295 9.744302       4.618213 1.577290       5.398404 24.30224 7.250259 15.96873 7.057252 8.333517       10.11786 
1 1 1 7   15 41 o 10.43659 4.921117 -2.242113      3.253016 -1.472526      4.226874 -3.360104      5.094599 12.39750 5.768711 12.51550 5.974936 -0.1180048     8.305293 
1 1 1 7   15 42 o 12.37755 5.516860 0.5021901      3.369695 -0.5506107     4.622276 1.696364       4.922849 13.06257 6.062572 14.74019 6.611841 -1.677620      8.970575 
1 1 1 7   15 43 o 13.55859 6.039748 1.639995       4.032648 3.251969       4.960271 -1.502443      6.925636 15.25021 6.751054 13.93142 6.731459 1.318786       9.533587 
1 1 1 7   15 44 o 13.07179 5.780783 1.903289       3.627913 3.510820       5.156452 0.3275440      5.105218 14.86220 6.707990 13.03727 6.152742 1.824930       9.102383 
1 1 1 7   15 45 o 19.23420 6.690724 7.981730       3.840763 7.897485       5.353621 8.071073       5.513213 17.37962 7.346818 17.40093 7.409620 -0.2131271E-01 10.43447 
1 1 1 7   16 0  o 55.71209 2.926410 37.92992       3.959089 36.79325       5.738070 38.96270       5.469569 54.76943 4.334557 56.39675 4.005891 -1.627319      5.902165 
1 1 1 7   16 1  o 594.4968 10.00673 4315.921       144.9698 4002.944       237.5224 4501.727       183.0108 571.0682 17.08714 606.8010 12.37640 -35.73279      21.09847 
1 1 1 7   16 2  o 569.2400 8.294412 3954.433       115.0581 3968.436       162.9986 3940.527       162.4362 569.7951 11.73895 567.7878 11.73980 2.007263       16.60198 
1 1 1 7   16 3  o 276.9153 4.490880 934.7814       30.30502 892.0019       58.89997 950.1837       35.34194 270.1627 8.958899 279.1646 5.195101 -9.001862      10.35620 
1 1 1 7   16 4  o 181.8656 3.933215 403.1593       17.43148 407.6584       31.02794 401.0844       21.07100 182.6679 6.983212 181.3176 4.772951 1.350342       8.458506 
1 1 1 7   16 5  o 77.65577 2.758570 73.58508       5.211987 80.46616       7.191322 65.97119       7.564559 81.16879 3.644962 73.44223 4.244789 7.726555       5.594995 
1 1 1 7   16 6  o 329.6364 5.830863 1325.277       46.83862 1273.523       56.17867 1443.280       84.82930 323.0563 7.136037 343.5061 10.14499 -20.44977      12.40338 
1 1 1 7   16 7  o 395.9507 5.903407 1912.371       56.96131 1984.957       82.96338 1847.641       78.34571 403.1602 8.444475 388.9840 8.265085 14.17621       11.81612 
1 1 1 7   16 8  o 299.6278 4.721763 1094.757       34.47644 1093.574       69.94749 1095.137       39.62393 298.9371 9.614382 299.6414 5.426497 -0.7042542     11.04007 
1 1 1 7   16 9  o 416.7104 6.230909 2119.145       63.27350 2248.518       133.0188 2081.312       71.93260 427.9767 12.76859 412.8708 7.149497 15.10587       14.63394 
1 1 1 7   16 10 o 437.3564 6.516336 2335.276       69.45045 2107.995       131.6059 2422.999       81.76208 414.0931 13.05823 445.3467 7.533862 -31.25360      15.07569 
1 1 1 7   16 11 o 391.0356 5.891093 1866.576       56.13688 1982.856       118.5376 1832.957       63.73747 401.6482 12.12472 387.3853 6.751738 14.26291       13.87785 
1 1 1 7   16 12 o 375.3366 6.623423 1721.166       60.58142 1780.148       108.3206 1694.320       73.07951 380.4510 11.69748 372.1566 8.058122 8.294495       14.20438 
1 1 1 7   16 13 o 258.7484 4.213154 816.7895       26.56568 839.4659       56.15651 810.2516       30.15307 261.6111 8.821238 257.6620 4.802253 3.949005       10.04370 
1 1 1 7   16 14 o 187.0899 3.398894 426.8972       15.49616 458.6435       34.52060 418.8857       17.34158 193.4457 7.336195 185.3015 3.840375 8.144165       8.280594 
1 1 1 7   16 15 o 154.5841 2.719295 291.3692       10.24371 304.1367       17.01982 284.1172       12.82717 157.7804 4.430943 152.6154 3.449027 5.165024       5.615073 
1 1 1 7   16 16 o 113.8563 2.434757 158.0524       6.755366 162.8054       11.39948 155.4798       8.386605 115.4183 4.059298 112.8640 3.052064 2.554352       5.078681 
1 1 1 7   16 17 o 212.8187 3.283561 552.5789       17.02907 563.4919       27.71102 545.9570       21.58588 214.6849 5.296816 211.4528 4.189095 3.232101       6.753131 
1 1 1 7   16 18 o 96.45883 2.377388 113.4533       5.588279 120.7634       9.412822 109.4743       6.944589 99.37914 3.894306 94.68285 3.013649 4.696297       4.924195 
1 1 1 7   16 19 o 92.02235 3.942123 103.6031       8.819665 101.4641       10.89626 107.6670       15.01915 90.95950 4.934262 93.46970 6.637012 -2.510201      8.270240 
1 1 1 7   16 20 o 265.9648 4.365267 864.5960       28.29248 850.0779       39.54818 879.8152       40.49174 263.3141 6.163342 267.8693 6.203079 -4.555267      8.744426 
1 1 1 7   16 21 o 109.6515 3.534527 146.9848       9.432222 115.9497       17.19301 160.3471       11.28149 96.80566 7.342879 114.4745 4.050480 -17.66883      8.385957 
1 1 1 7   16 22 o 62.29722 3.046233 47.48911       4.610512 50.03970       6.412189 44.75903       6.633961 63.84018 4.144092 60.31318 4.547104 3.527004       6.152208 
1 1 1 7   16 23 o 127.5534 2.993233 198.6386       9.303982 197.3159       12.89330 200.0758       13.43931 126.9400 4.173693 127.8029 4.321410 -0.8628922     6.007853 
1 1 1 7   16 24 o 137.2154 3.102703 229.9607       10.37479 234.1259       14.53528 225.6349       14.81299 138.2306 4.320326 135.6685 4.486682 2.562103       6.228606 
1 1 1 7   16 25 o 51.24405 5.301834 32.57869       6.525209 50.22985       12.53105 26.01194       7.643217 63.08753 8.356236 45.35989 7.151213 17.72763       10.99848 
1 1 1 7   16 26 f 22.28890 5.933392 6.333084       3.279563 7.816214       4.108070 3.726876       5.445690 24.74162 6.665047 20.58047 7.838038 4.161150       10.28872 
1 1 1 7   16 27 o 70.19602 3.393265 60.41854       5.787328 59.27697       7.085551 62.70641       10.03088 69.41023 4.208815 71.08608 5.842038 -1.675850      7.200245 
1 1 1 7   16 28 o 100.1415 3.007941 122.7400       7.332076 115.6643       9.848318 131.5390       10.98237 97.00605 4.175856 103.4192 4.367548 -6.413147      6.042620 
1 1 1 7   16 29 o 170.1993 3.453362 354.8800       14.32306 348.2545       19.60140 362.4707       20.98059 168.1169 4.789414 171.4195 5.027950 -3.302582      6.943974 
1 1 1 7   16 30 o 28.55597 5.514467 10.43022       3.698449 12.57797       4.588539 6.447399       6.248543 31.26992 6.240378 23.98453 8.518489 7.285393       10.55969 
1 1 1 7   16 31 o 65.74883 3.308034 53.19151       5.283195 54.58717       6.898134 51.21125       8.216805 66.39051 4.286640 64.01674 5.315014 2.373772       6.828225 
1 1 1 7   16 32 o 17.13173 8.229883 -13.17372      10.00148 0.000000       0.000000 -13.17372      10.00148 ?        ?        17.13173 8.229883 0.000000       8.229883 
1 1 1 7   16 33 o 16.28387 6.181308 2.505946       3.379996 1.531799       4.193490 4.312315       5.710403 16.34071 6.667599 20.94885 8.014567 -4.608143      10.42546 
1 1 1 7   16 34 o 27.93734 5.623611 10.23955       3.695917 10.96987       4.624992 8.949121       6.147838 28.59276 6.747247 25.94996 8.463856 2.642796       10.82415 
1 1 1 7   16 35 f 77.31300 3.239624 74.32464       6.090034 74.15382       7.920802 74.57165       9.524460 76.66872 4.256206 76.28458 5.153760 0.3841476      6.684051 
1 1 1 7   16 36 o 59.49988 3.589502 44.56511       5.180384 48.40840       6.748272 39.05043       8.083532 61.44244 4.539053 53.95805 6.263915 7.484390       7.735609 
1 1 1 7   16 37 o 25.93718 8.248010 10.12480       5.863040 5.990613       8.664561 13.61658       7.962978 22.83414 9.477600 29.07149 9.640262 -6.237345      13.51886 
1 1 1 7   16 38 o 25.64463 5.855430 9.341448       3.578569 12.64808       4.601284 4.279650       5.692963 29.44528 6.578531 19.20177 7.793377 10.24351       10.19872 
1 1 1 7   16 39 o 15.07685 5.958606 2.542174       3.237744 1.066358       4.149767 4.838394       5.176240 14.58290 6.321301 18.83197 7.504557 -4.249076      9.812095 
1 1 1 7   16 40 o 16.39351 6.226814 3.737004       3.431249 2.431977       4.600328 5.373363       5.151320 15.80755 6.750896 18.74378 7.480810 -2.936234      10.07656 
1 1 1 7   16 41 o 21.46983 6.597216 7.731019       3.784545 9.244777       5.174633 5.990122       5.549296 22.17054 7.762528 18.72046 7.658098 3.450075       10.90428 
1 1 1 7   16 42 o 10.63841 5.037801 -2.033198      3.477668 -7.686908      4.832629 4.039287       5.008411 10.18631 5.058589 16.27642 6.999269 -6.090116      8.635919 
1 1 1 7   16 43 o 27.15316 7.669516 15.32047       5.297139 11.36995       7.122937 20.20880       7.923407 20.10990 8.486287 26.03874 9.546061 -5.928846      12.77280 
1 1 1 7   16 44 o 12.28319 5.606302 0.9347410      3.727281 3.193771       5.334722 -1.219763      5.209839 14.53037 6.660243 12.27544 5.907967 2.254930       8.902972 
1 1 1 7   17 0  o 493.0790 6.506000 2965.594       78.17478 2821.541       119.4127 3073.638       103.4163 480.5739 10.19657 501.7925 8.457244 -21.21863      13.24745 
1 1 1 7   17 1  o 351.5137 6.207094 1507.070       53.17000 1455.435       89.40365 1535.327       66.13727 344.9352 10.64884 354.6998 7.651546 -9.764587      13.11274 
1 1 1 7   17 2  o 550.0480 8.046174 3693.001       107.8515 3856.524       156.9503 3546.703       148.4541 561.5795 11.46872 538.5760 11.31121 23.00354       16.10823 
1 1 1 7   17 3  o 501.8595 7.386058 3073.656       90.32979 3016.653       125.9648 3134.000       129.6041 496.7990 10.40477 506.3545 10.50336 -9.555511      14.78444 
1 1 1 7   17 4  f 160.8895 3.582304 315.5243       14.04515 298.3075       16.93540 353.4542       25.13678 156.3586 4.449175 170.1148 6.073358 -13.75624      7.528667 
1 1 1 7   17 5  f 26.57813 6.483044 8.964353       4.160891 4.616953       7.144264 11.19596       5.118607 23.51847 8.972616 29.69581 7.157763 -6.177336      11.47787 
1 1 1 7   17 6  o 255.3288 4.165958 794.8401       25.92094 798.6696       36.57280 790.9748       36.74327 255.8638 5.865613 254.6252 5.921618 1.238602       8.334925 
1 1 1 7   17 7  o 172.2291 2.870183 361.5458       12.04626 358.6397       18.89975 363.5341       15.63327 171.4335 4.527981 172.6827 3.715053 -1.249191      5.856981 
1 1 1 7   17 8  o 89.75777 2.743854 98.28865       5.994582 95.66246       13.40588 98.94501       6.701948 88.30727 6.270427 90.04340 3.058750 -1.736137      6.976690 
1 1 1 7   17 9  o 227.4070 3.843487 630.5802       21.29930 670.0212       45.63487 619.5955       24.08338 233.9808 8.015347 225.3920 4.384728 8.588730       9.136281 
1 1 1 7   17 10 o 266.7879 4.310575 868.1647       28.02448 803.3074       55.43689 890.4286       32.48030 256.0315 8.898770 270.1424 4.933909 -14.11090      10.17505 
1 1 1 7   17 11 o 388.0419 5.863176 1838.810       55.44312 1957.402       117.4766 1804.826       62.88741 398.7278 12.10436 384.3052 6.715082 14.42252       13.84225 
1 1 1 7   17 12 o 187.3743 3.402993 428.1553       15.53843 366.6469       31.16402 448.5057       17.92555 172.9576 7.411152 191.7531 3.836135 -18.79555      8.345125 
1 1 1 7   17 13 o 149.1501 4.793103 271.8646       17.39851 278.0425       24.74798 265.8271       24.46488 150.6166 6.759881 147.2542 6.836383 3.362442       9.614162 
1 1 1 7   17 14 o 171.2658 3.243956 357.7611       13.53885 389.7006       30.68502 350.0403       15.08677 178.2657 7.077610 169.3843 3.654997 8.881393       7.965649 
1 1 1 7   17 15 o 155.5553 3.093043 295.1418       11.72484 295.2424       25.99524 295.1161       13.13701 155.1094 6.894555 155.5278 3.466192 -0.4183502     7.716824 
1 1 1 7   17 16 o 177.8595 2.949827 385.8495       12.78526 383.9232       20.71155 387.0354       16.25121 177.1967 4.800885 178.0752 3.744951 -0.8785400     6.088772 
1 1 1 7   17 17 o 268.8561 4.294521 882.8832       28.13654 888.5812       55.89634 880.9495       32.56277 268.6242 8.549794 268.4494 4.977631 0.1747437      9.893220 
1 1 1 7   17 18 o 71.34721 2.532525 62.15963       4.396200 47.98597       8.517553 67.30652       5.132703 62.35770 5.667002 74.22572 2.842884 -11.86803      6.340103 
1 1 1 7   17 19 o 251.3451 4.188493 771.9244       25.65455 801.7065       37.25047 745.0527       35.38351 255.7742 5.976388 246.5920 5.888245 9.182220       8.389794 
1 1 1 7   17 20 o 161.9000 3.655207 320.1368       14.42098 344.3319       24.70841 307.6369       17.75966 167.4497 6.065162 158.5314 4.601964 8.918320       7.613426 
1 1 1 7   17 21 o 69.65331 2.924553 59.31776       4.953019 53.69776       6.912570 65.24742       7.100461 66.12518 4.313338 72.95267 4.009427 -6.827492      5.889006 
1 1 1 7   17 22 o 180.7701 3.450648 399.1955       15.20069 397.4532       21.39776 400.9706       21.59767 180.0769 4.880620 180.8672 4.904694 -0.7903748     6.919282 
1 1 1 7   17 23 o 81.46069 2.919691 81.12354       5.786530 74.67732       7.837906 88.84639       8.578993 78.01834 4.137354 85.11588 4.148582 -7.097542      5.859047 
1 1 1 7   17 24 o 49.75949 3.709533 30.44530       4.465758 26.75706       5.447000 38.00734       7.799510 46.46355 4.883626 55.29494 5.878205 -8.831387      7.642191 
1 1 1 7   17 25 f 228.6914 4.718192 641.4291       26.29429 648.7268       47.51019 638.2068       31.57012 228.1391 8.560950 227.7797 5.687547 0.3593903      10.27804 
1 1 1 7   17 26 o 83.17448 2.986888 84.64937       6.044209 80.56467       8.168111 89.59291       8.985894 80.97881 4.153050 85.37661 4.333201 -4.397797      6.002038 
1 1 1 7   17 27 o 16.30256 6.014428 2.595746       3.153340 2.665305       4.054216 2.489224       5.017082 17.64234 6.752186 18.76185 7.416608 -1.119509      10.02986 
1 1 1 7   17 28 f 113.5580 3.382850 158.0326       9.350871 169.6108       11.88044 139.1821       15.15908 117.4778 4.156478 105.9349 5.895411 11.54297       7.213334 
1 1 1 7   17 29 o 54.95959 3.498068 37.18177       4.660666 34.61637       6.109540 40.75283       7.208237 52.77961 4.802683 57.20484 5.228579 -4.425228      7.099564 
1 1 1 7   17 30 o 28.34421 5.654796 10.31760       3.768877 11.33878       4.795513 8.667853       6.095235 29.52280 6.805137 26.28145 8.415481 3.241343       10.82267 
1 1 1 7   17 31 f 68.12737 5.216618 58.04130       8.594699 0.000000       0.000000 58.04130       8.594699 ?        ?        68.12737 5.216618 0.000000       5.216618 
1 1 1 7   17 32 o 59.16876 3.547001 43.32706       5.090865 46.03092       6.730905 39.71271       7.782095 60.68512 4.585434 55.91619 5.795055 4.768932       7.389781 
1 1 1 7   17 33 o 22.73826 6.863220 6.767007       4.120377 10.24792       4.573031 -8.250892      9.498664 27.69350 6.821679 17.93456 8.441955 9.758944       10.85366 
1 1 1 7   17 34 o 23.24587 6.174709 7.227293       3.556607 4.970135       4.298275 12.12828       6.333666 20.19587 7.074478 29.46206 8.408184 -9.266188      10.98844 
1 1 1 7   17 35 o 37.44449 4.545158 18.02373       4.062548 16.24015       5.080992 21.18483       6.764272 34.75070 6.228771 39.13616 7.362774 -4.385460      9.644067 
1 1 1 7   17 36 o 61.99010 3.885789 48.82661       5.840467 50.07654       6.984788 45.92150       10.64863 62.24675 4.638025 56.65327 7.930076 5.593479       9.186805 
1 1 1 7   17 37 o 12.16494 5.499367 -1.133067      3.481938 -1.603227      4.617836 -0.5135190     5.300946 13.70419 6.249250 15.36028 6.877718 -1.656084      9.292800 
1 1 1 7   17 38 f 26.43910 7.466811 10.97219       5.021183 33.57432       11.14132 5.211278       5.624808 42.23545 10.78767 19.71342 7.833703 22.52204       13.33195 
1 1 1 7   17 39 o 12.24926 5.398314 0.1404811      3.137776 0.1847436      4.070811 0.7568754E-01  4.925258 13.61894 6.067342 14.55882 6.564854 -0.9398851     8.939236 
1 1 1 7   17 40 o 19.71982 6.357638 6.198858       3.474606 3.417635       4.669502 9.649287       5.201028 16.54747 6.919856 23.11814 7.793297 -6.570671      10.42209 
1 1 1 7   17 41 o 15.64454 6.205292 3.538253       3.523146 9.175032       4.980175 -2.108977      4.984790 21.89013 7.618548 12.70714 6.021562 9.182996       9.710895 
1 1 1 7   17 42 o 20.72940 6.909198 8.167240       4.089099 3.854441       6.336621 11.24479       5.352792 16.21657 7.365858 22.82453 7.900932 -6.607962      10.80188 
1 1 1 7   17 43 o 26.35784 6.551469 12.81879       4.189877 20.33040       6.171862 6.397799       5.706251 30.36082 8.165378 17.00703 7.392037 13.35378       11.01434 
1 1 1 7   17 44 o 21.87278 7.349296 10.98241       4.625435 10.87617       5.604978 11.20922       8.189701 19.99206 7.858718 17.90853 8.224767 2.083529       11.37569 
1 1 1 7   18 0  o 229.6902 4.542010 643.2488       25.42300 683.7722       31.74639 570.7975       42.44869 236.7781 5.501951 216.0639 8.076274 20.71417       9.772290 
1 1 1 7   18 1  o 305.0579 4.313459 1134.589       32.06594 1069.518       48.56509 1184.882       42.69593 296.0498 6.731678 311.6786 5.621385 -15.62875      8.770145 
1 1 1 7   18 2  o 378.2983 5.150537 1745.318       47.48135 1758.689       75.20277 1736.455       61.22869 379.4841 8.132128 377.2198 6.660769 2.264282       10.51177 
1 1 1 7   18 3  o 82.89410 2.674427 83.83369       5.395375 83.69227       7.854161 83.96005       7.424390 82.76299 3.905298 82.90825 3.683942 -0.1452560     5.368685 
1 1 1 7   18 4  o 225.1327 3.845254 617.9242       21.09598 581.8215       28.63445 660.7823       31.19865 218.3963 5.380313 232.7386 5.500869 -14.34230      7.694630 
1 1 1 7   18 5  o 214.2784 3.717302 559.7809       19.41076 535.3295       26.56321 587.7980       28.43410 209.4873 5.203393 219.5080 5.315609 -10.02068      7.438480 
1 1 1 7   18 6  f 87.60584 3.395469 93.70343       7.235122 103.9169       13.40753 89.50733       8.593787 92.07872 6.008024 85.57550 4.133188 6.503220       7.292434 
1 1 1 7   18 7  o 134.2534 2.956931 219.7105       9.673924 237.2736       21.33095 215.1628       10.85436 139.2646 6.301732 132.8059 3.356594 6.458771       7.139927 
1 1 1 7   18 8  o 143.9041 2.988531 252.4475       10.48014 231.8665       14.02077 278.5052       15.77637 137.8171 4.179602 151.0475 4.290398 -13.23047      5.989707 
1 1 1 7   18 9  o 306.0739 4.806283 1143.112       35.84856 1114.672       72.14734 1152.435       41.30878 301.3893 9.836453 307.2488 5.517166 -5.859558      11.27807 
1 1 1 7   18 10 o 296.7325 4.690227 1074.507       33.91525 1198.341       74.37114 1041.993       38.10849 312.4062 9.781019 292.1400 5.352966 20.26614       11.15000 
1 1 1 7   18 11 o 88.95503 2.668354 96.55693       5.777750 92.86110       13.52911 97.38133       6.389740 86.92130 6.432732 89.32041 2.939601 -2.399109      7.072574 
1 1 1 7   18 12 o 106.5221 2.698097 138.4357       6.998158 161.4860       17.37131 133.9700       7.646064 114.7556 6.235296 104.7727 2.997785 9.982933       6.918499 
1 1 1 7   18 13 o 106.5571 2.725698 138.5412       7.071954 140.4592       16.94163 138.1364       7.782420 106.9410 6.532079 106.3852 3.004920 0.5558472      7.190104 
1 1 1 7   18 14 o 72.45474 2.664857 64.10162       4.697171 54.76205       11.56058 65.94834       5.140624 66.45805 7.256064 73.47967 2.876420 -7.021622      7.805399 
1 1 1 7   18 15 o 104.7858 3.001648 134.0430       7.656860 0.000000       0.000000 134.0430       7.656860 ?        ?        104.7858 3.001648 0.000000       3.001648 
1 1 1 7   18 16 o 71.29170 2.907115 62.09951       5.039940 0.000000       0.000000 62.09951       5.039940 ?        ?        71.29170 2.907115 0.000000       2.907115 
1 1 1 7   18 17 o 80.78897 2.387342 79.66080       4.694898 71.14462       8.004126 84.12764       5.796843 76.18848 4.328917 82.99466 2.870513 -6.806183      5.194167 
1 1 1 7   18 18 o 153.3848 3.164088 287.1218       11.82679 290.3786       16.99581 284.0642       16.46789 154.0567 4.532079 152.3838 4.439421 1.672867       6.344147 
1 1 1 7   18 19 o 98.01879 3.395977 117.4423       8.099415 143.9610       17.09886 109.7709       9.196605 108.1008 6.521184 94.69966 3.994103 13.40112       7.647137 
1 1 1 7   18 20 o 261.2399 3.831821 833.9167       24.39388 832.1571       39.08320 835.0398       31.22206 260.3779 6.159563 261.1784 4.905556 -0.8004761     7.874306 
1 1 1 7   18 21 o 90.63489 3.194260 100.4330       7.044048 90.31138       11.05424 107.3528       9.140076 85.67256 5.321085 93.61886 4.015701 -7.946297      6.666318 
1 1 1 7   18 22 o 180.9348 3.905256 400.3142       17.21899 405.4058       21.76849 391.8033       28.14436 181.8269 4.917370 178.3285 6.487225 3.498444       8.140308 
1 1 1 7   18 23 f 81.00695 3.274086 80.30723       6.449896 83.73180       8.316896 75.13971       10.21642 82.61191 4.144497 78.05253 5.404629 4.559380       6.810791 
1 1 1 7   18 24 o 150.7686 3.220108 277.7834       11.83089 297.5263       17.09322 259.6280       16.39163 155.7507 4.508321 145.4580 4.630223 10.29272       6.462502 
1 1 1 7   18 25 f 19.90257 7.073575 4.250237       4.309224 -5.402591      8.847333 7.252409       4.934042 18.96012 8.647530 24.23528 7.547451 -5.275164      11.47797 
1 1 1 7   18 26 o 71.54603 3.073405 62.69796       5.345981 57.57248       7.239023 68.84653       7.928673 68.36663 4.367946 74.78552 4.369613 -6.418892      6.178387 
1 1 1 7   18 27 o 34.73482 4.451687 15.05528       3.681617 15.25565       4.916201 14.79941       5.555379 34.64698 6.042350 33.92619 6.953402 0.7207870      9.211937 
1 1 1 7   18 28 o 130.1600 3.123225 207.3941       9.906426 209.0756       13.84533 205.6302       14.18028 130.3254 4.365675 129.2016 4.510740 1.123840       6.277411 
1 1 1 7   18 29 o 88.53919 3.364543 96.27174       7.246140 96.51276       9.002007 95.82816       12.21233 88.46023 4.187840 87.68004 5.747281 0.7801895      7.111205 
1 1 1 7   18 30 o 87.95396 4.677711 95.95897       9.989882 0.000000       0.000000 95.95897       9.989882 ?        ?        87.95396 4.677711 0.000000       4.677711 
1 1 1 7   18 31 o 25.03740 5.995257 8.181094       3.609474 7.769207       4.629101 8.819908       5.764930 24.46221 7.249173 26.11742 8.162015 -1.655216      10.91646 
1 1 1 7   18 32 o 45.83569 4.067036 26.26406       4.495632 28.33873       5.991116 23.59038       6.801224 47.22408 5.297254 42.46884 6.801170 4.755245       8.620720 
1 1 1 7   18 33 o 50.40565 4.330826 31.99215       5.268168 30.13335       5.830647 40.25574       12.29376 48.65351 4.988307 53.41439 9.806004 -4.760876      11.00186 
1 1 1 7   18 34 o 19.70951 6.440187 5.010030       3.558662 5.335527       4.368416 4.367855       6.135890 20.59403 7.137115 20.89376 8.219665 -0.2997265     10.88583 
1 1 1 7   18 35 o 15.30780 6.264974 1.598039       3.716092 3.516389       4.305735 -4.002615      7.357032 18.11120 6.951709 16.48044 7.648766 1.630760       10.33585 
1 1 1 7   18 36 f 22.02833 6.439487 6.839065       3.673774 5.876369       4.593033 8.548836       6.121024 20.77368 7.310194 24.13675 8.443187 -3.363070      11.16809 
1 1 1 7   18 37 o 27.75539 5.817946 10.87353       3.809043 15.40747       5.077366 5.037046       5.760715 32.56696 6.623518 19.93346 7.925621 12.63349       10.32891 
1 1 1 7   18 38 o 11.77097 5.570937 -3.304624      4.241134 -6.161256      9.120632 -2.516528      4.790572 16.08971 7.762092 13.00981 6.082611 3.079901       9.861451 
1 1 1 7   18 39 o 13.62532 5.775572 1.386573       3.323659 0.6060415      4.523369 2.302461       4.899908 14.34564 6.393108 15.98947 6.899851 -1.643831      9.406369 
1 1 1 7   18 40 o 14.35273 5.974699 2.218738       3.457714 5.995883       4.805728 -1.835284      4.978752 18.83780 7.313813 13.03889 6.129502 5.798909       9.542676 
1 1 1 7   18 41 o 15.08100 6.292906 3.075057       3.849243 7.075969       5.990246 0.2610860      5.023715 18.85097 7.856940 13.81304 6.379088 5.037932       10.12049 
1 1 1 7   18 42 o 31.43670 5.706783 16.14396       4.210875 23.16542       6.345353 10.61845       5.628956 34.05696 7.812096 21.22601 7.994952 12.83095       11.17802 
1 1 1 7   18 43 o 13.99067 6.008541 2.936235       3.681872 7.438600       5.379114 -1.032561      5.050331 17.67400 7.411459 12.33730 5.905864 5.336697       9.476759 
1 1 1 7   19 0  o 357.1769 4.915236 1556.001       42.78228 1574.503       67.98559 1543.870       55.04845 359.0235 7.770659 355.6620 6.351429 3.361481       10.03612 
1 1 1 7   19 1  o 231.2958 3.982430 652.2859       22.44667 661.3387       31.31586 642.7202       32.19100 232.8221 5.519554 229.4359 5.762099 3.386200       7.979177 
1 1 1 7   19 2  o 206.3596 3.301517 519.1205       16.60253 513.1777       25.58616 523.4426       21.82004 205.1046 5.119101 207.1807 4.321855 -2.076141      6.699523 
1 1 1 7   19 3  o 121.9697 2.989063 181.3401       8.884303 164.2940       15.63407 189.4702       10.79705 115.9034 5.551420 124.6122 3.559211 -8.708771      6.594410 
1 1 1 7   19 4  o 331.6064 5.147808 1341.623       41.59885 1409.472       60.42340 1280.489       57.35572 339.6595 7.300042 323.7489 7.269966 15.91055       10.30257 
1 1 1 7   19 5  o 96.15018 2.805462 112.7871       6.566380 103.8490       8.771796 124.1800       9.903354 92.19968 3.913016 100.8288 4.038694 -8.629173      5.623411 
1 1 1 7   19 6  o 494.2319 6.518118 2983.625       78.50352 2984.322       124.0589 2983.159       101.3837 493.3708 10.31854 493.7835 8.425492 -0.4126892     13.32146 
1 1 1 7   19 7  o 252.9333 4.165946 780.3645       25.67768 769.2418       35.76281 792.2000       36.89092 250.9901 5.847079 254.6987 5.943696 -3.708679      8.337617 
1 1 1 7   19 8  o 481.4233 8.272552 2837.497       97.05161 2965.015       121.7375 2615.113       160.7644 491.5258 10.16347 459.7551 14.36682 31.77069       17.59834 
1 1 1 7   19 9  o 455.5424 7.872080 2540.678       87.38853 2564.322       153.0652 2529.245       106.4411 455.1949 13.81484 453.9795 9.621377 1.215454       16.83510 
1 1 1 7   19 10 o 236.2148 3.965926 680.7839       22.82905 664.6567       46.78861 685.8228       26.15345 232.7300 8.263069 237.0387 4.527658 -4.308670      9.422208 
1 1 1 7   19 11 o 189.8659 3.442898 439.7350       15.92969 463.7933       34.74143 433.3305       17.92504 194.4646 7.344329 188.4478 3.903309 6.016815       8.317151 
1 1 1 7   19 12 o 180.1508 3.346930 395.9034       14.69329 392.7309       31.38146 396.7942       16.62863 178.9021 7.212951 180.3239 3.784138 -1.421814      8.145328 
1 1 1 7   19 13 o 82.81770 2.933185 83.75727       5.910339 0.000000       0.000000 83.75727       5.910339 ?        ?        82.81770 2.933185 0.000000       2.933185 
1 1 1 7   19 14 o 251.2663 4.725354 771.3874       28.93375 0.000000       0.000000 771.3874       28.93375 ?        ?        251.2663 4.725354 0.000000       4.725354 
1 1 1 7   19 15 o 123.7964 2.840427 186.9351       8.568954 183.9196       19.43797 187.6624       9.546647 122.3384 6.543878 123.9809 3.162385 -1.642517      7.267944 
1 1 1 7   19 16 o 296.2162 4.713431 1072.562       34.02374 1176.189       74.28468 1045.052       38.27438 308.3579 9.898538 292.2517 5.374215 16.10623       11.26336 
1 1 1 7   19 17 o 68.28475 3.486245 57.07206       5.781999 52.24187       11.51656 58.69989       6.685682 64.78051 7.429580 69.20739 3.981013 -4.426880      8.428946 
1 1 1 7   19 18 o 91.12180 3.434055 101.5221       7.611809 101.1589       14.79833 101.6528       8.876034 90.50903 6.758204 91.12347 4.006968 -0.6144409     7.856788 
1 1 1 7   19 19 o 65.67083 2.527331 52.68974       4.037004 50.97091       7.239857 53.46532       4.863250 64.37900 4.646018 66.11466 3.026538 -1.735664      5.544855 
1 1 1 7   19 20 o 118.2404 2.561112 170.5838       7.379564 157.8161       11.95332 178.4472       9.380679 113.5025 4.329565 120.8474 3.188162 -7.344925      5.376756 
1 1 1 7   19 21 o 102.0286 2.686646 127.1369       6.674067 125.5220       10.42417 128.2588       8.688298 101.2012 4.236248 102.3961 3.486979 -1.194908      5.486785 
1 1 1 7   19 22 o 119.4072 3.329504 174.3487       9.678814 173.6529       16.03200 174.7478       12.14105 118.7922 5.553508 119.4218 4.178364 -0.6295853     6.949833 
1 1 1 7   19 23 o 57.30127 3.320079 40.26214       4.616204 45.29888       6.793319 35.94127       6.292055 60.62004 4.633763 53.92495 4.839552 6.695091       6.700225 
1 1 1 7   19 24 o 106.9518 2.991368 139.8675       7.788739 142.1795       11.07754 137.6071       10.95339 107.6438 4.231214 105.8923 4.253364 1.751572       5.999523 
1 1 1 7   19 25 o 67.74915 3.907872 56.40786       6.424414 60.27383       13.14208 55.19392       7.364306 69.15294 7.942641 66.91281 4.543283 2.240128       9.150244 
1 1 1 7   19 26 o 14.06540 5.782166 0.7967384      3.183370 3.010455       4.401424 -1.631469      4.609726 18.49463 7.045867 14.56200 6.473854 3.932630       9.568439 
1 1 1 7   19 27 o 104.8803 3.010112 134.6893       7.685343 139.9718       10.91964 129.5042       10.81850 106.6708 4.209010 102.5678 4.338120 4.103035       6.044424 
1 1 1 7   19 28 o 65.75905 3.250504 53.11658       5.192712 59.10398       7.251991 46.81676       7.438779 69.16777 4.324097 61.37401 5.017469 7.793758       6.623655 
1 1 1 7   19 29 o 81.09654 4.533630 81.45124       8.923849 0.000000       0.000000 81.45124       8.923849 ?        ?        81.09654 4.533630 0.000000       4.533630 
1 1 1 7   19 30 o 26.26617 6.211380 9.000483       3.912889 6.305767       4.750745 14.68429       6.899613 22.60895 7.444061 33.14246 8.502051 -10.53351      11.30040 
1 1 1 7   19 31 o 87.91549 3.139611 95.24686       6.715517 105.9509       9.384702 84.01384       9.613791 92.33411 4.181680 81.92514 4.837026 10.40897       6.394003 
1 1 1 7   19 32 o 32.05307 5.129764 13.22723       3.871791 17.90404       5.089582 6.802929       5.965137 37.15116 5.812140 23.57793 8.327923 13.57323       10.15555 
1 1 1 7   19 33 o 30.65880 6.201754 12.54511       4.474111 10.51197       4.865142 23.68950       11.39044 27.71480 7.154766 39.36684 11.28886 -11.65204      13.36521 
1 1 1 7   19 34 o 28.05862 6.124458 10.68014       4.069823 13.10865       4.797160 4.443075       7.687832 30.95297 6.563668 21.98764 9.006367 8.965338       11.14434 
1 1 1 7   19 35 f 23.00860 6.222003 7.360320       3.571824 9.247704       4.481163 4.072124       5.914791 25.47657 7.002266 19.88786 7.989229 5.588711       10.62354 
1 1 1 7   19 36 o 8.928540 4.395565 -6.430986      3.374573 -7.592495      4.295247 -4.557852      5.454580 10.18939 5.004925 13.31030 6.304893 -3.120909      8.049904 
1 1 1 7   19 37 o 15.81828 6.187994 2.845830       3.460884 8.060359       4.695416 -3.357047      5.121099 22.77635 7.394539 13.16097 6.196104 9.615380       9.647326 
1 1 1 7   19 38 o 13.33486 6.071848 -0.7183231     4.338943 -9.375113      8.554800 2.279873       5.034559 14.42386 7.080500 16.27521 7.008341 -1.851354      9.962445 
1 1 1 7   19 39 o 16.89598 6.310912 4.196291       3.491875 5.778086       4.856566 2.503407       5.024213 18.92544 7.351130 16.04360 6.954987 2.881834       10.11983 
1 1 1 7   19 40 o 18.41879 6.718083 5.755454       3.916681 9.759435       5.957419 2.707253       5.197972 21.78403 8.220572 15.78414 6.952426 5.999892       10.76634 
1 1 1 7   19 41 o 13.11546 5.749897 1.433266       3.517379 -1.062832      4.850178 4.202353       5.108521 12.74014 6.007808 16.23948 7.026544 -3.499340      9.244786 
1 1 1 7   19 42 o 19.08736 6.524885 7.017043       3.647029 5.705517       5.212909 8.274422       5.104166 16.72563 7.165668 19.05750 7.496964 -2.331861      10.37069 
1 1 1 7   19 43 o 16.13384 6.419166 5.190508       3.781362 6.280937       5.379680 4.125664       5.316191 16.50679 7.175973 15.04488 6.798830 1.461906       9.885277 
1 1 1 7   20 0  o 235.3337 3.594831 675.2656       20.61573 674.2897       32.18176 675.9447       26.84786 235.0464 5.618497 235.3954 4.680321 -0.3490448     7.312518 
1 1 1 7   20 1  o 243.9628 3.686648 725.7348       21.91752 670.5630       32.67551 770.8613       29.55150 234.3830 5.720844 251.3664 4.824322 -16.98340      7.483458 
1 1 1 7   20 2  o 174.0291 3.420328 369.2668       14.50527 341.8578       19.12349 406.3997       22.25870 167.3308 4.694448 182.4311 5.011602 -15.10023      6.866877 
1 1 1 7   20 3  o 104.6992 3.098274 133.7586       7.896255 141.6885       10.47511 123.3225       12.01698 107.7106 3.997777 100.4114 4.926107 7.299156       6.344190 
1 1 1 7   20 4  o 306.6977 4.855079 1147.825       36.28631 1158.483       51.22818 1137.094       51.40546 307.8936 6.827665 305.0264 6.915693 2.867126       9.718222 
1 1 1 7   20 5  o 365.2739 5.590732 1629.155       49.76493 1578.095       68.73689 1685.402       72.14308 359.1347 7.854098 371.1198 7.977090 -11.98502      11.19468 
1 1 1 7   20 6  o 190.7792 3.107155 443.7867       14.44541 441.9845       22.66992 445.0186       18.74339 190.2295 4.894370 190.9980 4.027016 -0.7685242     6.338116 
1 1 1 7   20 7  o 383.3675 5.197153 1794.597       48.55310 1799.316       76.80945 1791.456       62.65989 383.2551 8.224142 382.7574 6.717845 0.4977417      10.61913 
1 1 1 7   20 8  o 38.19772 3.075868 17.90748       2.838942 9.936823       3.896151 26.92947       4.145148 27.99266 5.897991 46.84286 3.660331 -18.85020      6.941492 
1 1 1 7   20 9  o 119.2456 3.490789 173.6032       10.13291 175.8078       18.44949 172.6510       12.12543 119.7279 6.346098 118.8653 4.192631 0.8626480      7.605992 
1 1 1 7   20 10 o 201.7770 4.253788 496.9937       20.91624 502.5574       37.27757 494.4373       25.26874 202.3601 7.572746 201.1044 5.160418 1.255707       9.163863 
1 1 1 7   20 11 o 61.28751 4.406629 46.10002       6.537411 0.000000       0.000000 46.10002       6.537411 ?        ?        61.28751 4.406629 0.000000       4.406629 
1 1 1 7   20 12 o 146.2370 4.416086 261.4060       15.71929 0.000000       0.000000 261.4060       15.71929 ?        ?        146.2370 4.416086 0.000000       4.416086 
1 1 1 7   20 13 f 71.83823 3.578443 63.13800       6.244771 45.43180       11.19465 71.13694       7.524260 60.34326 7.794727 76.22164 4.065588 -15.87838      8.791289 
1 1 1 7   20 14 o 188.7998 4.120145 435.3234       18.95616 407.4767       32.91933 449.1377       23.18612 182.0400 7.436409 191.6078 4.969876 -9.567841      8.944263 
1 1 1 7   20 15 o 113.9534 3.494523 158.6543       9.692548 180.2834       19.03294 151.0810       11.26231 121.0945 6.473309 111.1327 4.165997 9.961807       7.698003 
1 1 1 7   20 16 o 144.3403 3.674128 254.5728       12.91293 274.0368       24.33245 246.9421       15.23529 149.2775 6.706030 142.0707 4.405907 7.206833       8.023892 
1 1 1 7   20 17 o 195.7585 4.223862 468.3912       20.14960 479.6396       36.54416 463.4778       24.15277 197.2591 7.616610 194.5240 5.099556 2.735092       9.166145 
1 1 1 7   20 18 o 144.7696 3.063919 255.8275       10.80913 228.5262       23.04697 263.5263       12.23865 136.1405 6.970088 146.8992 3.418835 -10.75862      7.763411 
1 1 1 7   20 19 o 190.8039 3.431465 444.6837       15.95523 415.4818       22.85671 472.4368       22.28245 184.0895 5.099967 196.4650 4.654165 -12.37549      6.904412 
1 1 1 7   20 20 o 79.26022 2.703876 76.76160       5.214850 69.43613       8.427650 81.30669       6.638340 75.16669 4.623293 81.51568 3.348945 -6.348984      5.708789 
1 1 1 7   20 21 o 144.9108 3.172556 256.5064       11.20330 269.8747       16.35725 244.6939       15.37597 148.3779 4.529119 141.2905 4.471369 7.087463       6.364437 
1 1 1 7   20 22 o 184.5571 3.520886 416.4180       15.83503 408.7303       22.36172 424.1505       22.42665 182.4578 5.034101 185.8921 4.955127 -3.434265      7.063671 
1 1 1 7   20 23 o 101.2942 3.317082 125.5673       8.176939 151.1797       14.45261 113.5087       9.916743 110.7812 5.369567 96.16565 4.242121 14.61559       6.843087 
1 1 1 7   20 24 o 141.2570 3.193865 243.9660       10.99417 252.9568       15.90741 235.7440       15.21210 143.5096 4.554415 138.5464 4.511670 4.963257       6.410762 
1 1 1 7   20 25 o 47.96635 4.545210 28.50175       5.249454 21.07074       10.76429 30.82049       6.012940 40.01339 10.79316 49.80932 5.022331 -9.795929      11.90445 
1 1 1 7   20 26 o 65.82639 3.234929 53.16339       5.173311 55.32658       7.580750 51.27790       7.077485 66.90809 4.678895 64.42928 4.536751 2.478806       6.517220 
1 1 1 7   20 27 f 169.9801 3.437945 354.2010       14.24076 340.7011       19.87662 368.4394       20.41304 166.1132 4.915642 172.7771 4.853063 -6.663834      6.907659 
1 1 1 7   20 28 o 55.83884 5.070633 38.89437       6.824613 0.000000       0.000000 38.89437       6.824613 ?        ?        55.83884 5.070633 0.000000       5.070633 
1 1 1 7   20 29 o 41.68710 4.144501 21.65240       4.154565 21.93262       5.901308 21.37704       5.849915 41.46840 6.015134 40.92023 6.048464 0.5481758      8.530285 
1 1 1 7   20 30 o 23.05929 6.238364 6.945400       3.589719 9.874040       4.963943 3.734866       5.197355 27.29925 7.314472 19.92788 7.640524 7.371363       10.57729 
1 1 1 7   20 31 o 49.21421 4.066063 30.28419       4.832943 30.58116       5.953536 29.71031       8.276046 49.12455 5.044862 47.40088 7.406954 1.723679       8.961785 
1 1 1 7   20 32 o 33.05035 5.150167 14.12661       4.012816 11.87482       5.151230 17.60228       6.399800 29.53180 7.219474 35.93907 7.547981 -6.407272      10.44475 
1 1 1 7   20 33 o 18.54000 7.190997 3.435965       4.642128 3.435965       4.642128 0.000000       0.000000 18.54000 7.190997 ?        ?        0.000000       7.190997 
1 1 1 7   20 34 f 29.63430 5.602794 11.81007       3.897893 14.25006       4.992983 8.002454       6.237244 32.08897 6.605379 24.04141 8.513514 8.047558       10.77548 
1 1 1 7   20 35 o 26.31186 5.987285 9.667969       3.752309 8.155629       4.781229 12.09310       6.054562 23.63415 7.439866 28.10600 8.280593 -4.471853      11.13193 
1 1 1 7   20 36 o 23.69976 6.303473 8.184627       3.703454 10.79451       4.917300 4.763839       5.629621 26.56466 7.348340 19.54930 7.814336 7.015356       10.72669 
1 1 1 7   20 37 o 17.24571 6.333955 4.093414       3.490812 3.030499       4.662766 5.448893       5.265513 16.81604 6.963720 19.44456 7.624957 -2.628519      10.32634 
1 1 1 7   20 38 o 17.20438 6.866093 4.028195       4.339305 3.658358       8.978117 4.140921       4.956693 19.05900 8.699744 17.60272 7.223410 1.456282       11.30766 
1 1 1 7   20 39 o 12.16993 5.534724 -0.4252207     3.591610 -4.723747      5.393247 3.000243       4.814489 12.23003 5.916858 16.06822 6.885253 -3.838197      9.078321 
1 1 1 7   20 40 o 28.68288 5.845691 13.09552       3.947167 16.87445       5.692908 9.597034       5.477592 29.83526 7.758484 21.50250 7.927944 8.332752       11.09263 
1 1 1 7   20 41 o 19.35905 6.591813 7.057621       3.721580 13.85673       5.591635 1.650667       4.986423 25.00812 8.065379 14.13362 6.463631 10.87450       10.33580 
1 1 1 7   20 42 o 14.03290 5.990428 2.939992       3.619499 5.502770       5.285740 0.6773050      4.966638 16.29863 7.098913 13.16823 6.168548 3.130401       9.404550 
1 1 1 7   21 0  o 59.05952 3.162274 42.65022       4.534602 39.79312       6.142724 46.07175       6.722167 56.93556 4.462969 61.28188 4.533433 -4.346325      6.361612 
1 1 1 7   21 1  f 350.8640 4.861051 1502.449       41.56283 1537.598       66.26034 1479.647       53.36741 354.5098 7.669894 347.9977 6.293085 6.512054       9.921200 
1 1 1 7   21 2  o 141.3331 2.820767 243.5252       9.715098 243.3456       14.72671 243.6635       12.92700 141.1631 4.285995 141.2920 3.757766 -0.1288757     5.700049 
1 1 1 7   21 3  o 333.5709 4.675025 1358.004       38.00216 1385.604       60.16338 1339.681       49.01895 336.5370 7.336067 331.1245 6.074864 5.412537       9.524801 
1 1 1 7   21 4  o 313.9844 5.732874 1204.369       43.86485 1180.933       52.67297 1257.400       79.23441 310.7226 6.956309 319.7655 10.18122 -9.042908      12.33076 
1 1 1 7   21 5  o 146.0098 3.096580 259.9691       11.01794 258.1878       15.25683 261.9106       15.92828 145.3898 4.310960 146.4219 4.469258 -1.032059      6.209561 
1 1 1 7   21 6  o 296.8997 4.214266 1075.769       30.49073 1050.378       47.45889 1093.615       39.78881 293.0277 6.646190 299.1909 5.457284 -6.163147      8.599639 
1 1 1 7   21 7  o 179.3962 3.011604 392.4736       13.16580 379.0922       20.34983 402.1070       17.26633 176.1344 4.745439 181.5309 3.903134 -5.396454      6.144399 
1 1 1 7   21 8  o 494.8732 7.310807 3000.277       88.16483 2995.040       124.9420 3005.471       124.4273 493.0719 10.39830 493.9616 10.33681 -0.8897400     14.66200 
1 1 1 7   21 9  o 99.20569 3.215218 120.1774       7.762634 0.000000       0.000000 120.1774       7.762634 ?        ?        99.20569 3.215218 0.000000       3.215218 
1 1 1 7   21 10 o 125.1141 3.318226 191.1072       10.10799 0.000000       0.000000 191.1072       10.10799 ?        ?        125.1141 3.318226 0.000000       3.318226 
1 1 1 7   21 11 o 58.30612 2.970256 41.57437       4.206403 44.07824       10.34239 41.07809       4.604433 59.51883 7.282179 57.93313 3.274802 1.585697       7.984639 
1 1 1 7   21 12 o 126.5837 2.925491 195.4556       9.024280 167.5245       19.12617 203.4544       10.23521 116.7164 6.753338 129.0897 3.256235 -12.37332      7.497376 
1 1 1 7   21 13 o 167.0582 3.261142 340.5568       13.27619 310.7707       27.50355 349.6056       15.15926 158.9842 7.117065 169.2289 3.675931 -10.24466      8.010311 
1 1 1 7   21 14 o 126.9166 2.899687 196.5174       8.968206 206.7853       20.45897 194.0751       9.977934 129.6969 6.493842 126.0630 3.250718 3.633873       7.262035 
1 1 1 7   21 15 o 198.8950 3.581787 483.0296       17.36040 453.3014       35.68090 492.2497       19.87100 191.8083 7.648989 200.7235 4.062426 -8.915161      8.660851 
1 1 1 7   21 16 o 183.1604 3.418274 409.6115       15.25719 370.1699       31.29185 421.9123       17.47513 173.2964 7.427008 185.8373 3.858793 -12.54088      8.369631 
1 1 1 7   21 17 o 132.8487 2.977363 215.4103       9.638849 205.3570       20.93404 218.1151       10.85833 129.0982 6.676902 133.6510 3.333917 -4.552826      7.462977 
1 1 1 7   21 18 o 186.1048 3.901515 423.3606       17.69403 376.3169       31.84507 444.3703       21.28143 174.5542 7.503974 190.5511 4.583037 -15.99686      8.792830 
1 1 1 7   21 19 f 98.60324 2.827910 118.7785       6.788035 107.8076       16.30442 121.0788       7.465835 93.23712 7.232485 99.52972 3.081861 -6.292603      7.861724 
1 1 1 7   21 20 o 91.63327 3.019591 102.6510       6.733547 113.6544       10.13687 93.96167       9.008101 96.26028 4.332467 87.51968 4.236266 8.740601       6.059391 
1 1 1 7   21 21 o 167.8145 2.954389 343.9445       12.08184 360.0940       20.19503 334.9424       15.07774 171.3023 4.842630 165.4867 3.738841 5.815582       6.118006 
1 1 1 7   21 22 o 114.6915 3.050612 160.8340       8.518604 161.8478       12.45823 159.9439       11.67421 114.8267 4.460711 114.1957 4.202259 0.6309662      6.128370 
1 1 1 7   21 23 o 91.53663 2.589605 102.4032       5.770690 103.1963       9.955521 102.0019       7.081753 91.61703 4.472661 91.28564 3.188376 0.3313904      5.492763 
1 1 1 7   21 24 o 121.0460 3.300995 179.3888       9.728046 0.000000       0.000000 179.3888       9.728046 ?        ?        121.0460 3.300995 0.000000       3.300995 
1 1 1 7   21 25 o 71.34937 2.914283 62.35325       5.056418 56.07104       12.59179 63.56105       5.521128 66.52930 7.922168 72.00625 3.154107 -5.476944      8.526965 
1 1 1 7   21 26 o 73.16763 3.521995 65.78342       6.261329 62.19875       10.77168 67.61269       7.694829 70.47509 6.339775 74.03257 4.283497 -3.557480      7.651215 
1 1 1 7   21 27 o 42.36177 5.723107 22.66603       5.757033 0.000000       0.000000 22.66603       5.757033 ?        ?        42.36177 5.723107 0.000000       5.723107 
1 1 1 7   21 28 o 66.47312 3.373054 54.41714       5.446074 54.01614       7.928185 54.77542       7.493968 65.81780 4.979994 66.37393 4.662837 -0.5561295     6.822198 
1 1 1 7   21 29 o 64.80785 3.372291 51.83332       5.307526 47.77751       7.442918 56.02955       7.570663 61.74523 4.989016 67.00713 4.665498 -5.261894      6.830605 
1 1 1 7   21 30 o 16.05391 6.251632 2.176657       3.519426 2.555325       4.951732 1.790092       5.003105 18.37163 7.333729 17.71558 7.262034 0.6560459      10.32089 
1 1 1 7   21 31 o 70.24458 3.312942 61.17561       5.655062 62.70186       7.861186 59.53874       8.141088 70.56200 4.596758 68.59967 4.902260 1.962334       6.720293 
1 1 1 7   21 32 o 34.80029 5.520638 15.86317       4.525629 24.10589       5.718418 2.046810       7.403503 43.01112 5.587764 20.30728 8.614466 22.70384       10.26801 
1 1 1 7   21 33 o 26.52913 6.890396 9.821622       4.493858 15.28152       5.076797 -9.941661      9.658888 33.44955 6.462129 16.89087 8.107267 16.55868       10.36759 
1 1 1 7   21 34 o 12.66368 5.581423 -0.3811421     3.354919 -2.366416      4.406200 2.357536       5.175169 13.02796 6.001315 17.61657 7.319405 -4.588611      9.465171 
1 1 1 7   21 35 o 13.62947 5.825647 0.6923867      3.430971 5.055158       4.511708 -5.290480      5.283412 19.45646 7.191271 12.68609 6.064103 6.770374       9.406792 
1 1 1 7   21 36 o 14.22658 5.942935 1.499072       3.438619 0.4009862      4.536909 2.981343       5.271155 14.64920 6.472089 17.43825 7.326181 -2.789058      9.775524 
1 1 1 7   21 37 o 14.75588 5.976558 2.317194       3.340071 2.373897       4.492984 2.247148       4.993748 15.87251 6.721045 16.18724 6.975255 -0.3147297     9.686414 
1 1 1 7   21 38 o 16.07085 6.931751 2.644874       4.940843 0.000000       0.000000 2.644874       4.940843 ?        ?        16.07085 6.931751 0.000000       6.931751 
1 1 1 7   21 39 o 8.963575 4.399561 -5.012155      3.299685 -1.753354      4.716164 -8.137106      4.618294 12.60334 5.937437 9.907362 4.924286 2.695973       7.713738 
1 1 1 7   21 40 f 19.05500 6.535868 6.570130       3.660052 10.24051       5.306216 3.238930       5.055100 21.85611 7.840202 15.49756 6.839969 6.358554       10.40452 
1 1 1 7   21 41 o 16.99911 6.362617 5.379145       3.553069 11.06464       5.190343 0.3652673      4.874147 22.03590 7.769595 13.13847 6.140368 8.897430       9.903066 
1 1 1 7   21 42 o 13.01424 5.910103 1.579742       4.076896 4.488815       5.271352 -2.750511      6.431340 15.37033 6.872073 12.57646 6.166585 2.793873       9.233210 
1 1 1 7   22 0  o 194.6956 3.229716 462.2788       15.32345 433.9460       23.13762 484.4148       20.45142 188.4478 5.042918 199.2407 4.212203 -10.79286      6.570668 
1 1 1 7   22 1  o 144.6874 2.852474 255.2555       10.05747 257.6175       15.44898 253.5181       13.24977 145.2207 4.370484 144.1066 3.776267 1.114166       5.775926 
1 1 1 7   22 2  o 230.2222 3.569113 646.5397       20.02366 666.9041       31.59433 632.8688       25.88648 233.6313 5.549347 227.6833 4.665580 5.948013       7.250027 
1 1 1 7   22 3  o 168.6513 3.022698 346.8592       12.42283 375.6514       19.72485 327.9305       15.99329 175.3518 4.620042 163.9326 4.003468 11.41925       6.113309 
1 1 1 7   22 4  o 126.8160 2.993834 196.1237       9.252048 186.1730       12.52109 208.0909       13.73123 123.4369 4.168543 130.4953 4.323930 -7.058372      6.006090 
1 1 1 7   22 5  o 240.9912 4.753657 709.2454       27.91677 748.9503       34.84359 638.0659       46.65284 247.5108 5.776870 227.8749 8.415738 19.63597       10.20769 
1 1 1 7   22 6  o 334.6454 6.010597 1369.713       49.01608 1310.640       81.10862 1403.700       61.52104 326.0248 10.22156 338.4245 7.459777 -12.39966      12.65419 
1 1 1 7   22 7  o 299.6530 5.482622 1097.707       40.03529 1102.786       68.09980 1095.024       49.49106 299.2583 9.349678 299.0215 6.791851 0.2367859      11.55620 
1 1 1 7   22 8  o 59.94504 2.647632 43.90455       3.858106 45.88520       5.761172 42.29406       5.195016 61.19081 3.883606 58.75869 3.646058 2.432117       5.326926 
1 1 1 7   22 9  o 34.25376 3.732428 14.48948       3.065222 10.16791       3.731125 23.46127       5.375988 28.34328 5.600661 43.50682 5.171752 -15.16354      7.623282 
1 1 1 7   22 10 o 268.4322 4.400266 880.1511       28.78390 906.5995       59.87707 872.2022       32.82551 271.1939 9.073114 267.1132 5.042896 4.080780       10.38038 
1 1 1 7   22 11 o 127.1784 3.618004 197.5872       11.20152 175.7041       19.55748 208.2702       13.66487 119.5274 6.741765 130.5051 4.302649 -10.97776      7.997761 
1 1 1 7   22 12 o 87.65360 2.824059 93.82201       6.024383 114.0541       14.75425 89.77401       6.599597 96.26305 6.324613 85.71513 3.164974 10.54792       7.072326 
1 1 1 7   22 13 o 158.2375 3.202093 305.5836       12.34752 272.7361       25.23260 315.9258       14.15856 148.8808 6.974224 160.8575 3.611948 -11.97670      7.854042 
1 1 1 7   22 14 o 145.2819 3.086166 257.5902       10.92614 215.5178       22.34458 270.8111       12.52577 132.2765 6.956371 148.9335 3.451248 -16.65700      7.765450 
1 1 1 7   22 15 o 115.6551 2.865995 163.2264       8.077489 162.4498       18.51275 163.4090       8.977069 114.8146 6.645035 115.6554 3.188210 -0.8408661     7.370290 
1 1 1 7   22 16 o 158.9742 3.567259 308.7065       13.81966 331.2559       27.71717 301.2462       15.94267 163.9627 6.952717 156.9145 4.172992 7.048248       8.108892 
1 1 1 7   22 17 o 106.4069 2.824898 138.2883       7.318538 162.3297       18.13508 133.6112       7.998799 114.7284 6.513282 104.5607 3.142775 10.16771       7.231866 
1 1 1 7   22 18 o 123.1878 2.929111 185.2676       8.793056 181.5969       19.78286 186.1713       9.815985 121.2724 6.720363 123.4154 3.266709 -2.143028      7.472260 
1 1 1 7   22 19 o 111.3619 4.829639 152.2610       13.07536 137.5625       17.49138 170.8775       19.68511 105.4284 6.845174 117.5349 6.903212 -12.10652      9.721663 
1 1 1 7   22 20 o 122.5590 2.960033 183.4539       8.840521 200.1362       20.90169 179.8193       9.756138 127.2018 6.767335 121.2589 3.304710 5.942940       7.531131 
1 1 1 7   22 21 o 96.45048 3.017247 113.7660       7.082993 119.6600       10.90622 109.4666       9.314723 98.69315 4.546944 94.46760 4.055681 4.225555       6.092885 
1 1 1 7   22 22 o 149.2087 3.258247 272.2229       11.84716 270.0027       17.29371 274.1863       16.26262 148.2200 4.794209 149.4486 4.470448 -1.228653      6.555101 
1 1 1 7   22 23 o 134.4903 2.753928 221.0071       9.025672 225.4520       15.26752 218.6192       11.19049 135.4119 4.633572 133.6133 3.439732 1.798553       5.770766 
1 1 1 7   22 24 o 10.78055 4.793551 -0.9387015     2.528444 13.07704       9.002198 -2.139065      2.634492 32.20160 10.21792 9.986659 4.614660 22.21494       11.21165 
1 1 1 7   22 25 o 61.04004 2.988174 45.70425       4.431339 35.53862       9.964788 48.21014       4.947459 52.64219 8.020891 62.65709 3.251352 -10.01490      8.654824 
1 1 1 7   22 26 o 107.0964 2.954070 140.5591       7.702237 127.5177       17.46406 143.7084       8.581969 100.5893 7.171594 108.2235 3.257798 -7.634209      7.876865 
1 1 1 7   22 27 o 53.47852 3.705107 35.34314       4.798692 28.74043       7.226510 40.55101       6.417964 47.50429 6.405606 57.08016 4.654350 -9.575871      7.918003 
1 1 1 7   22 28 o 74.90829 3.263506 69.12193       5.943017 64.55577       8.729945 73.06580       8.113286 71.85304 5.017272 76.69733 4.358850 -4.844292      6.646247 
1 1 1 7   22 29 o 15.03449 6.152540 1.189388       3.583488 1.457088       5.304650 0.9646751      4.860112 17.85227 7.413277 16.80267 7.045378 1.049603       10.22712 
1 1 1 7   22 30 o 91.62461 3.517298 104.1104       7.838810 101.7452       10.00777 107.8648       12.60910 90.03350 4.576400 92.01106 5.650774 -1.977562      7.271498 
1 1 1 7   22 31 o 54.31691 3.717956 36.93525       4.891573 35.49146       6.799924 38.48362       7.041877 52.47767 5.394046 54.68562 5.352674 -2.207947      7.599135 
1 1 1 7   22 32 o 16.25059 6.256604 2.607642       3.495121 5.089355       4.901407 0.4018692E-01  4.985359 20.48749 7.508538 15.81646 6.891497 4.671035       10.19171 
1 1 1 7   22 33 o 13.66224 6.132768 -1.107046      4.243773 0.4961388      4.691278 -8.327982      9.956258 15.56214 6.733477 17.46355 8.341415 -1.901408      10.72002 
1 1 1 7   22 34 o 15.88693 6.194552 2.645501       3.458988 1.911884       4.612659 3.588093       5.228516 16.41214 6.871438 18.53679 7.488521 -2.124649      10.16340 
1 1 1 7   22 35 o 22.24261 6.328334 7.278100       3.593268 11.08694       4.871596 2.733362       5.321446 26.82721 7.271440 17.43461 7.344971 9.392601       10.33549 
1 1 1 7   22 36 o 21.84028 6.288443 7.249712       3.527658 6.126139       4.880973 8.478424       5.104238 19.96170 7.460256 22.64750 7.719655 -2.685802      10.73538 
1 1 1 7   22 37 o 9.670135 4.702163 -4.727960      3.520670 -2.464274      5.693944 -6.129080      4.479635 13.81352 6.512590 10.65204 5.206860 3.161479       8.338179 
1 1 1 7   22 38 o 14.80715 6.362282 2.134499       4.131938 18.41730       9.174167 -2.008962      4.627898 26.78331 10.17976 12.50757 5.889014 14.27574       11.76044 
1 1 1 7   22 39 o 10.09400 4.803309 -2.369189      3.237886 -3.772732      4.612715 -1.005870      4.546136 11.35518 5.488355 12.62992 5.911620 -1.274734      8.066553 
1 1 1 7   22 40 o 10.50525 4.957934 -1.553349      3.315399 -2.918638      4.817495 -0.3249106     4.569680 11.65978 5.629011 12.67489 5.930803 -1.015112      8.176807 
1 1 1 7   22 41 o 10.67322 5.103152 -1.938607      3.746423 -0.1065603     4.965004 -4.360897      5.709057 12.78575 6.044166 11.69255 5.748610 1.093201       8.341370 
1 1 1 7   23 0  o 117.4138 2.732979 168.1018       7.819724 187.5903       12.36644 155.1178       10.09393 123.9072 4.101199 112.6938 3.680504 11.21342       5.510530 
1 1 1 7   23 1  o 158.2061 3.319170 305.3124       12.79642 278.9536       23.33836 316.6431       15.30157 150.8621 6.362537 161.0804 3.898139 -10.21832      7.461726 
1 1 1 7   23 2  o 159.1758 3.745268 309.1717       14.52768 288.2309       23.52948 322.0726       18.46824 153.3555 6.309653 162.3296 4.673519 -8.974167      7.851975 
1 1 1 7   23 3  o 133.4270 4.148443 217.5284       13.47216 222.3055       18.93639 212.6323       19.17078 134.7087 5.781995 131.7137 5.988394 2.995056       8.324202 
1 1 1 7   23 4  o 125.2801 3.416363 191.6258       10.42021 187.0092       16.77471 194.5265       13.29679 123.5490 5.586049 126.1479 4.331872 -2.598976      7.068879 
1 1 1 7   23 5  o 159.0099 3.247191 308.4458       12.58253 302.8284       17.31326 314.7341       18.31801 157.4021 4.518369 160.4496 4.689968 -3.047440      6.512408 
1 1 1 7   23 6  o 157.0165 2.861622 300.6901       10.94949 296.6210       16.92956 303.6163       14.35646 155.7786 4.464266 157.7248 3.735177 -1.946243      5.820758 
1 1 1 7   23 7  o 89.64491 2.581748 98.07880       5.634081 94.22959       8.347932 101.2988       7.635264 87.77093 3.912778 91.04792 3.447492 -3.276993      5.214885 
1 1 1 7   23 8  o 65.95306 2.978091 53.16867       4.774053 47.90221       6.184418 60.93494       7.510091 62.50125 4.082799 70.49419 4.393598 -7.992939      5.997745 
1 1 1 7   23 9  o 117.8018 2.894914 169.2811       8.310435 172.7356       11.47691 165.4734       12.04944 118.8722 3.967507 116.3146 4.258243 2.557632       5.820116 
1 1 1 7   23 10 o 118.8836 3.004950 172.5431       8.698550 183.6097       18.80513 169.5307       9.811281 122.2381 6.334579 117.8063 3.421222 4.431793       7.199420 
1 1 1 7   23 11 f 91.41617 2.916101 102.0621       6.487925 124.3318       15.03556 96.96679       7.191941 100.5338 6.166892 89.07137 3.319191 11.46243       7.003398 
1 1 1 7   23 12 o 334.4156 5.235979 1368.785       42.66980 1286.418       83.82597 1397.590       49.57283 321.7390 10.70642 337.6706 6.024407 -15.93164      12.28499 
1 1 1 7   23 13 f 172.1425 3.347733 361.7754       14.04348 346.6903       29.31371 366.2690       15.99898 167.7702 7.186664 173.1600 3.791479 -5.389847      8.125482 
1 1 1 7   23 14 o 67.59610 3.111180 55.89254       5.111127 52.80684       11.28773 56.68837       5.732469 65.12451 7.234494 68.04455 3.468545 -2.920036      8.023011 
1 1 1 7   23 15 o 75.58189 2.833491 69.81554       5.209620 64.71870       12.13503 70.96713       5.768214 72.19901 6.984324 76.17994 3.113729 -3.980927      7.646967 
1 1 1 7   23 16 o 176.6880 3.388857 381.3295       14.59138 400.6580       31.95682 376.2385       16.40082 180.1571 7.294156 175.4433 3.836124 4.713837       8.241393 
1 1 1 7   23 17 o 74.10279 2.863478 67.13506       5.161149 63.42937       12.85465 67.84722       5.635310 71.30499 7.510492 74.47265 3.112025 -3.167664      8.129710 
1 1 1 7   23 18 o 32.27864 4.836586 13.04701       3.687421 16.51328       8.649171 12.27703       4.076451 35.79564 9.683139 31.16184 5.572709 4.633797       11.17221 
1 1 1 7   23 19 o 109.4814 3.449614 146.6647       9.191883 139.3098       17.68461 149.3872       10.75945 106.0275 6.881667 110.4131 4.005473 -4.385612      7.962484 
1 1 1 7   23 20 o 51.91755 3.829090 33.16348       4.810377 38.17963       10.66549 31.88251       5.389703 54.85379 8.232675 50.81985 4.395224 4.033939       9.332466 
1 1 1 7   23 21 o 189.0895 3.548331 437.4865       16.35037 436.9142       35.15082 437.6446       18.47015 187.3589 7.715343 189.0139 4.009964 -1.655014      8.695190 
1 1 1 7   23 22 o 72.34189 2.675086 64.02046       4.707768 66.07449       8.754710 63.18489       5.583814 73.14936 4.940263 71.80593 3.199088 1.343430       5.885606 
1 1 1 7   23 23 o 128.7628 3.063009 202.8060       9.611134 235.7595       24.21919 196.6465       10.47092 137.4228 7.257840 126.6913 3.394639 10.73149       8.012478 
1 1 1 7   23 24 f 147.2029 3.567847 265.6533       12.79849 0.000000       0.000000 265.6533       12.79849 ?        ?        147.2029 3.567847 0.000000       3.567847 
1 1 1 7   23 25 o 175.6684 3.081390 378.0332       13.19096 368.6501       21.54016 383.6635       16.68566 172.5850 5.127333 176.6963 3.875073 -4.111313      6.426954 
1 1 1 7   23 26 o 11.94352 5.169296 -0.3063830     2.766516 -8.125113      8.590524 0.5983402      2.922196 17.20273 8.075722 13.26843 5.505342 3.934301       9.773745 
1 1 1 7   23 27 o 14.15822 5.478551 1.657934       2.689685 6.436819       5.929486 0.4198639      3.018050 23.51154 8.303131 13.22578 5.549173 10.28576       9.986757 
1 1 1 7   23 28 o 64.02506 2.864159 50.46736       4.457408 41.30505       7.830691 54.85905       5.421429 57.01545 5.712882 66.63389 3.349480 -9.618443      6.622389 
1 1 1 7   23 29 o 42.62799 3.662425 22.67384       3.767677 19.70891       6.719453 24.03347       4.550274 38.34538 7.459519 43.69774 4.329973 -5.352367      8.625143 
1 1 1 7   23 30 o 32.02267 5.287640 13.34482       3.982363 17.53741       5.968268 9.980049       5.346686 36.03634 7.048888 26.95119 7.736142 9.085154       10.46588 
1 1 1 7   23 31 o 52.46154 3.762125 34.63482       4.777684 33.77329       6.848452 35.45165       6.668474 50.83018 5.622740 52.27819 5.307940 -1.448002      7.732362 
1 1 1 7   23 32 o 17.05303 6.583782 3.017432       3.877915 0.5249463      5.006346 6.756239       6.131562 16.07075 6.954729 22.69090 8.384008 -6.620146      10.89311 
1 1 1 7   23 33 o 12.23996 5.657422 -2.320715      3.963606 -1.030352      4.497429 -6.808908      8.387724 13.98160 6.291643 16.10748 7.683336 -2.125880      9.930681 
1 1 1 7   23 34 o 19.43161 6.490825 5.356214       3.608539 3.208324       4.892457 7.918737       5.343857 17.62392 7.197821 22.76125 7.893537 -5.137335      10.68253 
1 1 1 7   23 35 o 13.51922 5.776561 0.9676799      3.371330 3.300011       4.657788 -1.598750      4.885953 17.11422 7.010257 13.66774 6.304496 3.446476       9.428169 
1 1 1 7   23 36 o 23.63899 6.979476 9.050344       4.297525 17.39404       7.604829 5.135732       5.209002 29.81469 9.382625 18.73573 7.507378 11.07896       12.01642 
1 1 1 7   23 37 o 19.62488 6.643299 6.294184       3.779398 12.92400       5.834262 1.500444       4.961039 26.20497 8.214128 15.15657 6.728356 11.04840       10.61803 
1 1 1 7   23 38 f 13.10794 5.954368 0.2426616      4.141862 5.650500       8.430190 -1.478100      4.755387 18.33090 8.391104 12.73585 5.988106 5.595045       10.30864 
1 1 1 7   23 39 o 17.85752 6.593827 5.809326       3.791576 7.258502       5.647310 4.619936       5.116148 18.55345 7.671649 16.46941 7.078094 2.084040       10.43808 
1 1 1 7   23 40 o 11.10657 5.234987 -1.189988      3.674713 3.203584       4.971701 -6.480436      5.455598 14.92495 6.673352 10.94122 5.423292 3.983735       8.599170 
1 1 1 7   24 0  o 225.5875 3.957283 621.1760       21.75446 639.1861       30.85696 603.3780       30.67475 228.6382 5.538194 222.0509 5.673463 6.587372       7.928416 
1 1 1 7   24 1  o 137.4587 4.519585 231.0181       15.11875 0.000000       0.000000 231.0181       15.11875 ?        ?        137.4587 4.519585 0.000000       4.519585 
1 1 1 7   24 2  o 81.62590 2.797216 81.35280       5.555817 83.18641       8.189572 79.78941       7.562108 82.44489 4.089015 80.76015 3.853581 1.684738       5.618731 
1 1 1 7   24 3  o 84.28115 2.790351 86.72637       5.723032 88.91685       8.390124 84.82035       7.826427 85.24541 4.050470 83.26997 3.867469 1.975433       5.600324 
1 1 1 7   24 4  o 65.85158 3.112186 53.01845       4.980091 55.95004       6.758930 49.53661       7.365987 67.56718 4.124584 63.49151 4.796262 4.075676       6.325845 
1 1 1 7   24 5  o 135.2772 3.513119 223.4781       11.57140 241.9851       19.44399 213.3293       14.39872 140.5203 5.689960 132.0734 4.480245 8.446945       7.242115 
1 1 1 7   24 6  o 264.6300 3.902107 855.0101       25.16369 849.0281       39.35488 859.1472       32.72813 263.3080 6.133360 265.0841 5.066423 -1.776123      7.955297 
1 1 1 7   24 7  o 106.1627 2.925703 137.5947       7.561781 136.0500       10.25455 139.4357       11.19520 105.4749 3.996851 106.7493 4.312466 -1.274429      5.879811 
1 1 1 7   24 8  o 103.6538 2.969374 131.1892       7.492699 163.3190       16.98569 123.4268       8.348886 115.3043 6.066419 100.5028 3.413857 14.80150       6.961024 
1 1 1 7   24 9  o 162.8879 2.902843 323.7069       11.52255 333.1973       18.21010 317.3700       14.88026 165.0419 4.532035 161.2117 3.787720 3.830200       5.906452 
1 1 1 7   24 10 o 300.9686 4.826075 1107.890       35.39577 1086.070       70.97021 1115.115       40.83730 296.0640 9.850529 301.7631 5.553346 -5.699127      11.30807 
1 1 1 7   24 11 o 200.6145 5.120400 492.9272       25.01193 483.0131       36.80164 501.4379       34.09738 197.9573 7.643219 201.9049 6.940395 -3.947601      10.32414 
1 1 1 7   24 12 o 216.1939 5.339225 572.4839       28.12923 562.0018       41.41557 581.4601       38.32537 213.3771 7.978941 217.2883 7.248068 -3.911133      10.77952 
1 1 1 7   24 13 o 61.09100 3.588810 45.74414       5.319204 51.41436       11.30484 44.13184       6.028198 64.21440 7.356980 59.93974 4.152693 4.274662       8.448077 
1 1 1 7   24 14 o 123.4223 3.498698 186.2271       10.51230 198.0720       20.18839 181.8208       12.31333 126.7693 6.557377 121.8689 4.152226 4.900337       7.761454 
1 1 1 7   24 15 o 135.3513 3.548125 223.9972       11.69292 219.7348       21.75918 225.7278       13.86499 133.4594 6.712024 135.7799 4.195361 -2.320496      7.915322 
1 1 1 7   24 16 o 165.8331 5.219082 337.5749       21.06494 323.8857       28.30471 354.5696       31.53746 161.8938 7.192467 169.2437 7.666677 -7.349915      10.51235 
1 1 1 7   24 17 o 103.1643 3.344257 130.1835       8.396358 131.0894       16.48748 129.8664       9.756233 102.9471 6.606977 102.9671 3.895213 -0.2004242E-01 7.669735 
1 1 1 7   24 18 o 85.09339 3.298951 88.62438       6.827854 74.09172       13.45903 93.66064       7.923098 77.09482 7.249012 87.42801 3.727401 -10.33319      8.151176 
1 1 1 7   24 19 o 111.8253 2.922826 152.8656       7.958049 163.6624       18.48013 150.4076       8.817491 114.9473 6.625436 110.8767 3.266951 4.070572       7.387108 
1 1 1 7   24 20 o 99.84684 2.874695 121.9121       6.987307 156.7151       17.72882 115.5120       7.602680 112.4282 6.498648 97.14378 3.215990 15.28446       7.250864 
1 1 1 7   24 21 o 77.95379 2.894247 74.37315       5.488507 82.17091       13.92323 72.93850       5.972094 81.07060 7.119825 77.16114 3.182917 3.909462       7.798902 
1 1 1 7   24 22 o 105.9701 3.219183 137.5508       8.303503 0.000000       0.000000 137.5508       8.303503 ?        ?        105.9701 3.219183 0.000000       3.219183 
1 1 1 7   24 23 o 109.7120 2.954716 147.3891       7.892420 144.9761       18.11139 147.9547       8.768795 107.6172 6.943170 109.8597 3.279079 -2.242516      7.678539 
1 1 1 7   24 24 o 80.13808 2.672817 78.65340       5.212382 73.04504       9.321155 81.20506       6.287301 76.72523 5.012797 81.34348 3.177912 -4.618240      5.935256 
1 1 1 7   24 25 o 25.20679 5.062781 8.145611       3.001783 7.166910       6.377496 8.424142       3.402217 24.72407 8.620310 25.54358 5.618690 -0.8195076     10.28977 
1 1 1 7   24 26 o 52.20784 3.081371 33.58398       3.902834 28.93964       7.467460 35.32939       4.577836 47.47535 6.635592 53.45997 3.533769 -5.984623      7.517886 
1 1 1 7   24 27 o 72.31019 3.061251 64.42532       5.382089 45.11299       11.96636 69.32274       6.025995 58.16703 8.709668 74.94408 3.307703 -16.77704      9.316610 
1 1 1 7   24 28 o 84.30424 2.999562 87.66618       6.152487 69.45611       9.671469 100.0450       7.974017 74.00481 5.400023 89.80711 3.651210 -15.80230      6.518557 
1 1 1 7   24 29 o 33.40520 4.054020 14.12721       3.232702 12.42819       6.178512 14.76765       3.793362 29.89298 8.224529 33.94951 4.712018 -4.056528      9.478713 
1 1 1 7   24 30 o 35.57399 3.920684 16.04329       3.342538 19.50952       6.470899 14.78183       3.903660 37.65764 7.315103 33.77311 4.884844 3.884529       8.796160 
1 1 1 7   24 31 o 22.14639 5.446165 6.626050       2.918405 6.549319       5.475341 6.656499       3.449204 22.27407 7.967220 22.04196 6.175799 0.2321053      10.08053 
1 1 1 7   24 32 o 22.65154 7.334338 7.332756       4.621069 4.722634       5.359527 14.89522       9.122793 19.91222 7.725739 29.93586 10.31679 -10.02363      12.88888 
1 1 1 7   24 33 o 14.51464 6.376218 0.2096438      4.345252 2.640263       5.149387 -5.801252      8.097793 17.44306 7.278509 15.88966 7.571045 1.553402       10.50226 
1 1 1 7   24 34 o 16.14828 6.348378 3.030303       3.657907 10.04691       5.403975 -2.903224      4.969426 24.81072 7.921755 13.13074 6.157165 11.67998       10.03319 
1 1 1 7   24 35 o 18.39509 6.519376 5.025800       3.658158 13.34552       5.679481 -0.8729666     4.782277 27.99272 7.953337 13.81234 6.321691 14.18037       10.15969 
1 1 1 7   24 36 o 21.28301 6.403039 7.228363       3.590592 13.76228       5.552958 2.533633       4.706987 27.93817 7.838974 15.87775 6.805878 12.06042       10.38121 
1 1 1 7   24 37 o 18.70074 6.548124 5.837811       3.682237 9.873186       5.426668 2.394409       5.012854 22.48880 7.943163 15.53075 6.834656 6.958055       10.47885 
1 1 1 7   24 38 o 30.70526 6.497331 15.97425       4.709765 18.48088       9.484256 15.15380       5.426082 24.23362 9.973239 27.91745 7.717831 -3.683825      12.61073 
1 1 1 7   24 39 o 15.11753 6.697115 3.244373       4.889883 0.4311638      8.278050 4.752078       6.060177 15.08871 7.307204 16.36001 7.337386 -1.271304      10.35531 
1 1 1 7   24 40 o 11.55017 5.279961 0.2590929      3.322798 -0.9735106     4.785328 1.406734       4.617459 12.23051 5.825446 13.39904 6.161793 -1.168531      8.479594 
1 1 1 7   25 0  f 28.42934 6.087482 10.27197       4.090197 16.08075       7.378415 7.695050       4.914412 35.45839 8.623263 24.92908 7.488962 10.52931       11.42126 
1 1 1 7   25 1  f 192.0859 3.658855 450.3660       17.12682 518.9226       35.40557 429.4234       19.56868 205.5712 7.078177 187.5053 4.282644 18.06593       8.272946 
1 1 1 7   25 2  o 258.0041 3.884699 812.7265       24.42418 808.8266       37.90139 815.4962       31.94053 257.0112 6.051554 258.2575 5.075198 -1.246277      7.898034 
1 1 1 7   25 3  f 33.37210 4.445680 13.84535       3.525560 14.80445       4.862822 12.78261       5.118813 34.27237 6.043253 31.68679 6.830509 2.585579       9.120131 
1 1 1 7   25 4  o 58.25049 3.229879 41.53169       4.566867 43.79163       6.107528 38.66564       6.877946 59.72626 4.223515 55.99988 5.095813 3.726383       6.618564 
1 1 1 7   25 5  o 84.91486 2.968117 88.07761       6.132429 85.20872       8.272562 91.57729       9.136832 83.42403 4.081624 86.46529 4.350260 -3.041252      5.965268 
1 1 1 7   25 6  o 197.7925 3.250028 477.4487       15.66510 453.2324       23.78403 496.0027       20.81854 192.4219 5.076619 201.4851 4.240054 -9.063217      6.614387 
1 1 1 7   25 7  f 59.15022 2.858886 42.78487       4.108671 42.37676       5.986188 43.14835       5.649495 58.74218 4.209719 59.30669 3.931226 -0.5645065     5.759884 
1 1 1 7   25 8  o 58.28548 2.838186 41.54613       4.019109 43.92327       5.843184 39.41164       5.536930 59.82532 4.031547 56.65440 4.036957 3.170918       5.705296 
1 1 1 7   25 9  o 117.7884 2.855432 169.2892       8.196161 181.6512       11.84317 157.9263       11.35452 121.8656 3.993349 113.6068 4.108127 8.258858       5.729184 
1 1 1 7   25 10 o 204.3362 4.217586 510.3958       21.00126 495.3483       37.26467 517.3995       25.42315 200.4197 7.643946 205.5842 5.074620 -5.164536      9.175057 
1 1 1 7   25 11 o 183.3088 3.491513 410.3877       15.59671 392.9223       31.55243 416.0351       17.94199 178.5247 7.267869 184.4993 3.990615 -5.974579      8.291377 
1 1 1 7   25 12 o 85.46357 2.941800 89.25739       6.117617 65.05798       12.39895 97.04416       7.033330 72.35976 7.123839 89.09032 3.245044 -16.73056      7.828116 
1 1 1 7   25 13 o 133.2575 3.069848 216.8080       9.968840 186.6197       20.32003 226.3767       11.44017 122.9602 6.808041 136.0863 3.452493 -13.12605      7.633422 
1 1 1 7   25 14 o 175.7568 3.402083 377.3847       14.57113 366.1286       30.39194 380.7443       16.60387 172.1586 7.260551 176.4700 3.861022 -4.311340      8.223327 
1 1 1 7   25 15 o 161.3694 3.962015 318.4988       15.58021 345.6401       28.71291 307.1726       18.54836 167.2690 7.059979 158.2585 4.815130 9.010529       8.545688 
1 1 1 7   25 16 o 285.9118 4.680640 1001.788       32.61171 887.2349       62.12505 1045.361       38.31526 266.4747 9.582576 291.7906 5.388456 -25.31592      10.99369 
1 1 1 7   25 17 o 197.6982 3.635446 478.0238       17.51445 484.1507       37.28361 476.2888       19.83982 197.4984 7.761839 197.2318 4.127858 0.2666626      8.791209 
1 1 1 7   25 18 o 103.2123 2.933271 130.2524       7.370199 125.2437       16.87563 131.4329       8.192845 100.4019 6.940045 103.6387 3.247980 -3.236717      7.662480 
1 1 1 7   25 19 o 140.3965 3.091974 240.9587       10.57860 264.4707       24.20062 235.4050       11.76181 146.0146 6.820179 138.6649 3.483498 7.349701       7.658302 
1 1 1 7   25 20 o 104.0221 3.227934 132.4867       8.172606 0.000000       0.000000 132.4867       8.172606 ?        ?        104.0221 3.227934 0.000000       3.227934 
1 1 1 7   25 21 o 126.5587 3.380012 196.2614       10.41495 0.000000       0.000000 196.2614       10.41495 ?        ?        126.5587 3.380012 0.000000       3.380012 
1 1 1 7   25 22 o 114.8710 2.945557 161.5717       8.238644 157.9345       18.63442 162.4553       9.185113 112.3676 6.837529 115.1178 3.277542 -2.750175      7.582485 
1 1 1 7   25 23 o 63.70854 2.993649 49.81684       4.634665 51.45017       11.32662 49.48838       5.079351 63.58282 7.451313 63.44864 3.296413 0.1341782      8.147908 
1 1 1 7   25 24 o 27.31549 4.641479 9.469776       2.979154 10.49114       6.525116 9.200801       3.348535 28.45229 8.647161 26.77240 5.320037 1.679890       10.15265 
1 1 1 7   25 25 o 69.74641 2.790042 59.74755       4.732508 54.28337       8.661057 62.07339       5.650646 65.73219 5.456143 70.98736 3.275315 -5.255165      6.363739 
1 1 1 7   25 26 o 30.19007 4.825699 11.62669       3.430768 6.342700       6.071568 14.10512       4.158237 23.37578 8.386436 33.17464 5.323614 -9.798866      9.933436 
1 1 1 7   25 27 o 82.68726 2.753061 84.16860       5.539678 81.37773       9.698480 85.52007       6.748975 80.37808 4.975817 83.15037 3.337497 -2.772285      5.991464 
1 1 1 7   25 28 o 48.78922 3.466920 29.67058       4.095107 27.22709       10.21640 30.13832       4.469910 43.50741 9.864245 49.07581 3.766407 -5.568394      10.55884 
1 1 1 7   25 29 o 42.27212 3.442716 22.38804       3.515750 22.76513       6.737650 22.24695       4.121322 40.97764 6.998312 41.90510 4.087746 -0.9274635     8.104692 
1 1 1 7   25 30 o 29.05202 4.682857 11.02531       3.202616 10.85258       6.130546 11.09014       3.755859 27.34307 8.395620 28.77045 5.558257 -1.427374      10.06880 
1 1 1 7   25 31 o 61.61655 2.949452 47.50329       4.415826 47.67046       7.789515 47.42413       5.360371 59.93973 5.390367 61.16807 3.612200 -1.228340      6.488763 
1 1 1 7   25 32 o 30.58169 4.996836 12.62110       3.595377 9.558538       5.579732 14.79552       4.701566 24.92565 8.058344 32.38373 6.183162 -7.458086      10.15718 
1 1 1 7   25 33 o 29.79770 4.810824 12.10678       3.374363 20.32320       8.171942 10.41789       3.704968 33.90347 9.508400 26.95733 5.811228 6.946142       11.14361 
1 1 1 7   25 34 o 11.75550 5.294612 -0.5973315     3.192998 0.1862662      4.571952 -1.343439      4.461244 14.32882 6.403645 13.16276 6.054424 1.166057       8.812646 
1 1 1 7   25 35 o 17.10647 6.281791 4.266070       3.433326 3.949519       5.069201 4.534342       4.666652 17.43187 7.243493 17.80716 7.115779 -0.3752899     10.15394 
1 1 1 7   25 36 o 14.35766 5.963010 2.261638       3.432885 -0.6197281     5.182061 4.515001       4.582673 13.88451 6.435455 17.27971 6.999913 -3.395191      9.508620 
1 1 1 7   25 37 o 18.04969 6.446761 5.568748       3.583590 3.715351       5.256906 7.177728       4.898026 16.27635 7.084495 19.37904 7.420470 -3.102690      10.25931 
1 1 1 7   25 38 o 12.65515 5.942945 -0.6721353     4.659203 -0.3895018     8.150873 -0.8093061     5.678365 14.98585 7.255829 13.43770 6.384861 1.548145       9.665067 
1 1 1 7   25 39 o 17.94045 6.878322 6.559302       4.212039 12.62511       8.546064 4.613064       4.840828 19.64961 8.770115 15.88237 6.855904 3.767237       11.13186 
1 1 1 7   26 0  o 31.34590 4.668369 12.27145       3.457377 10.71375       4.769906 13.99575       5.018498 28.97633 6.861717 33.23447 6.429035 -4.258139      9.402960 
1 1 1 7   26 1  o 180.7747 4.182501 399.2319       18.42509 382.3222       30.07579 409.3910       23.31181 176.3492 7.012522 182.8498 5.237127 -6.500626      8.752312 
1 1 1 7   26 2  o 224.9401 4.025299 618.0408       22.06486 562.4900       41.11886 640.5054       26.14849 213.6951 7.909708 228.8907 4.687943 -15.19557      9.194578 
1 1 1 7   26 3  o 332.5956 5.271014 1353.700       42.72153 1229.413       78.92118 1405.214       50.80952 314.8864 10.29884 338.5978 6.157790 -23.71140      11.99935 
1 1 1 7   26 4  o 88.26426 2.810560 95.14071       6.037538 90.29989       8.691835 99.65413       8.392754 85.86745 4.166245 90.24995 3.824786 -4.382500      5.655669 
1 1 1 7   26 5  o 144.6131 2.867188 255.1630       10.10415 266.6051       15.81444 247.2702       13.13467 147.6177 4.401134 142.2356 3.792821 5.382126       5.809946 
1 1 1 7   26 6  o 224.5151 4.500875 616.3236       24.62513 627.0922       30.35446 595.5930       42.11615 226.2731 5.504951 219.7845 7.876227 6.488602       9.609342 
1 1 1 7   26 7  o 164.2870 3.273966 329.4900       13.10731 350.3115       18.91460 310.2538       18.18027 169.1808 4.592105 159.1911 4.691587 9.989731       6.564939 
1 1 1 7   26 8  o 96.53725 2.631817 113.7829       6.185592 104.6202       9.065557 121.7645       8.461180 92.43552 4.034285 99.79401 3.484635 -7.358482      5.330866 
1 1 1 7   26 9  o 54.97196 2.943328 36.98746       3.928527 31.10803       5.503780 43.09445       5.609275 50.22467 4.546023 59.25613 3.906309 -9.031452      5.993794 
1 1 1 7   26 10 o 101.9393 3.020272 126.9629       7.494536 124.8741       15.68467 127.5809       8.531500 100.6115 6.430894 102.1469 3.432271 -1.535400      7.289505 
1 1 1 7   26 11 o 143.5155 3.182298 251.5050       11.12951 256.6620       23.36887 249.9922       12.65712 144.3017 6.663530 142.9902 3.635338 1.311462       7.590672 
1 1 1 7   26 12 o 137.6033 3.136098 231.2213       10.51610 196.3966       20.88786 243.0452       12.17111 126.1195 6.821737 140.9902 3.545274 -14.87068      7.687982 
1 1 1 7   26 13 o 200.2247 4.219267 490.5446       20.58689 0.000000       0.000000 490.5446       20.58689 ?        ?        200.2247 4.219267 0.000000       4.219267 
1 1 1 7   26 14 o 139.7390 3.656564 238.9012       12.44095 230.0379       22.43834 242.8353       14.94917 136.4436 6.769552 140.7643 4.363282 -4.320755      8.053885 
1 1 1 7   26 15 o 63.71709 3.043367 49.70501       4.711824 39.63307       10.51037 52.23837       5.271193 56.03050 7.918052 65.29489 3.323722 -9.264393      8.587355 
1 1 1 7   26 16 o 42.84145 3.547363 22.59869       3.670276 23.84466       9.511565 22.38071       3.978399 42.89133 9.363400 42.58972 3.875660 0.3016167      10.13381 
1 1 1 7   26 17 o 113.0008 2.941978 156.1292       8.094454 191.1206       19.81973 149.1245       8.867705 124.2046 6.571619 110.3850 3.300296 13.81955       7.353784 
1 1 1 7   26 18 o 158.1039 3.298002 305.7367       12.70660 338.5765       29.85461 298.4717       14.04194 164.9387 7.446881 156.1392 3.690447 8.799484       8.311164 
1 1 1 7   26 19 o 61.15014 3.251475 45.87784       4.827807 0.000000       0.000000 45.87784       4.827807 ?        ?        61.15014 3.251475 0.000000       3.251475 
1 1 1 7   26 20 o 110.2441 3.662688 149.1350       9.826252 141.6879       17.46270 152.5855       11.88667 106.5531 6.760112 111.3439 4.389446 -4.790726      8.060171 
1 1 1 7   26 21 f 21.38508 5.388704 5.872208       2.806649 13.58893       8.913295 5.022869       2.957075 32.52172 10.14671 19.92059 5.764081 12.60112       11.66964 
1 1 1 7   26 22 o 155.9150 3.263403 298.0646       12.39923 295.4340       26.71382 298.7870       13.99847 153.2455 7.173300 155.9702 3.683009 -2.724701      8.063546 
1 1 1 7   26 23 o 92.58443 2.936409 105.1772       6.616695 98.27460       14.94733 106.8594       7.379055 88.05121 7.024339 93.24921 3.252257 -5.198006      7.740705 
1 1 1 7   26 24 o 115.5313 3.012927 163.9879       8.475274 139.6200       17.85596 171.0742       9.629063 104.6689 7.041481 117.8863 3.355264 -13.21738      7.800016 
1 1 1 7   26 25 o 62.00909 3.111473 47.42678       4.686705 44.75288       8.157476 48.74428       5.726078 59.38425 5.707193 62.69160 3.765461 -3.307350      6.837452 
1 1 1 7   26 26 o 43.35256 3.416401 23.36503       3.580124 26.15297       7.017529 22.38410       4.162575 44.73228 6.638741 42.24358 4.094872 2.488708       7.800055 
1 1 1 7   26 27 o 28.34644 4.671368 10.34932       3.114544 8.747467       5.844728 10.98457       3.680667 25.53671 8.246766 28.98009 5.410776 -3.443380      9.863349 
1 1 1 7   26 28 o 43.56592 3.380958 23.74302       3.561332 27.02891       6.608288 22.39807       4.227816 45.22772 6.155408 42.01759 4.184612 3.210136       7.443120 
1 1 1 7   26 29 o 55.60269 3.370289 38.75814       4.545219 25.10413       10.11710 42.21090       5.087550 40.15788 10.29195 57.90991 3.623276 -17.75203      10.91111 
1 1 1 7   26 30 o 50.41939 3.181464 31.95902       3.889024 37.56889       7.209899 29.65705       4.618523 52.99244 5.671233 48.15109 3.971328 4.841347       6.923463 
1 1 1 7   26 31 o 17.36362 5.789808 4.029666       2.871391 8.945131       5.515341 2.201974       3.363115 24.28724 8.021841 15.21289 6.053431 9.074350       10.04958 
1 1 1 7   26 32 o 21.29123 6.342666 6.655515       3.536372 10.32968       6.985206 5.389260       4.100724 24.80608 8.982814 19.43892 6.901183 5.367163       11.32772 
1 1 1 7   26 33 o 32.17811 4.184087 13.87889       3.203312 15.38536       5.847994 13.23312       3.828810 30.64878 7.808880 30.58932 5.330009 0.5946350E-01  9.454502 
1 1 1 7   26 34 o 31.24331 5.082678 13.85521       3.736885 15.98871       5.921237 12.44300       4.817420 30.59522 7.890574 27.68472 7.105450 2.910492       10.61831 
1 1 1 7   26 35 o 21.92602 5.591279 7.336995       2.996331 16.68103       5.923359 4.123797       3.473518 30.52711 7.901695 16.66937 6.280014 13.85774       10.09333 
1 1 1 7   26 36 o 14.15389 6.062160 2.034413       3.729032 4.514549       5.200764 -0.5897891     5.349683 17.05506 7.226843 13.79338 6.442009 3.261679       9.681257 
1 1 1 7   26 37 o 16.11713 6.521142 4.290679       3.971825 5.262819       5.369600 3.116162       5.902105 17.07525 7.292946 15.72977 7.130509 1.345484       10.19957 
1 1 1 7   26 38 o 11.75249 5.472833 -0.4828975     3.816059 -8.443424      8.077535 1.804275       4.329696 12.61134 6.306370 13.73697 6.178091 -1.125630      8.828313 
1 1 1 7   27 0  o 126.1308 2.842484 194.1057       8.736856 194.8552       13.22761 193.5258       11.63635 126.1902 4.307813 125.8181 3.799578 0.3720779      5.744045 
1 1 1 7   27 1  o 179.4702 4.093705 393.5769       17.90380 392.5654       21.28434 396.0245       33.10812 179.0661 4.882206 179.2487 7.596754 -0.1826172     9.030316 
1 1 1 7   27 2  o 134.4549 3.547776 220.9047       11.61420 228.1829       14.26474 206.5920       20.00384 136.5636 4.291726 129.6084 6.352859 6.955215       7.666664 
1 1 1 7   27 3  o 192.6405 4.278890 453.6350       20.08698 453.5867       34.03185 453.6608       24.88393 191.9069 7.290366 192.4057 5.312278 -0.4987640     9.020517 
1 1 1 7   27 4  o 171.0222 4.063873 357.4472       16.93670 317.6327       27.23990 382.5391       21.62479 160.6022 6.976783 176.7127 5.026776 -16.11052      8.599069 
1 1 1 7   27 5  o 214.4514 3.443428 561.5955       17.99517 576.2303       28.39905 551.7772       23.26109 216.8844 5.373280 212.4037 4.493988 4.480698       7.004860 
1 1 1 7   27 6  o 50.48153 3.237588 31.24037       3.961819 34.92363       5.698323 27.79400       5.512037 53.25494 4.430981 47.41146 4.838572 5.843479       6.560897 
1 1 1 7   27 7  o 186.8857 3.193437 426.4260       14.54355 395.8534       21.65838 451.5320       19.62675 179.7380 4.949524 192.1671 4.191151 -12.42905      6.485641 
1 1 1 7   27 8  o 159.1662 2.941710 309.2348       11.41003 319.9132       17.91499 301.9469       14.80000 161.6254 4.553066 157.1771 3.863994 4.448242       5.971671 
1 1 1 7   27 9  o 162.6916 2.964642 323.1193       11.75367 353.5600       18.87030 303.8233       15.02395 169.9015 4.561825 157.6481 3.910742 12.25337       6.008673 
1 1 1 7   27 10 o 26.42898 6.030746 8.919668       3.798061 3.478445       7.555398 10.75964       4.393546 22.83248 9.077155 29.02643 6.385179 -6.193951      11.09798 
1 1 1 7   27 11 o 50.16125 3.637752 30.91437       4.416481 39.53212       9.764088 28.69774       4.952010 56.15127 7.308983 48.24250 4.255859 7.908768       8.457752 
1 1 1 7   27 12 o 75.74619 3.866989 70.35273       7.114269 70.64843       12.78612 70.22013       8.562014 75.35954 7.044104 75.56498 4.672494 -0.2054443     8.452905 
1 1 1 7   27 13 o 57.77794 3.750591 40.99894       5.252240 36.33364       9.783299 42.88802       6.225447 53.66264 7.701737 59.01976 4.359262 -5.357128      8.849854 
1 1 1 7   27 14 o 90.89717 2.947497 101.0294       6.520266 107.8007       14.74118 99.38248       7.270112 93.26883 6.526937 90.10985 3.316456 3.158981       7.321187 
1 1 1 7   27 15 o 129.5538 3.082496 205.1177       9.731701 193.4971       20.69472 208.4171       11.02701 124.9284 6.823611 130.4940 3.470700 -5.565536      7.655549 
1 1 1 7   27 16 o 107.4756 2.988542 141.2743       7.819582 139.8587       17.59974 141.6224       8.728404 106.0935 6.843911 107.5586 3.334097 -1.465080      7.612839 
1 1 1 7   27 17 o 53.55321 3.488502 35.24681       4.527833 0.000000       0.000000 35.24681       4.527833 ?        ?        53.55321 3.488502 0.000000       3.488502 
1 1 1 7   27 18 o 132.0776 3.071631 213.3839       9.886311 189.7269       20.81405 220.2760       11.23450 123.3699 6.951389 134.0835 3.441133 -10.71361      7.756495 
1 1 1 7   27 19 o 81.37246 2.876867 81.08981       5.695732 75.25687       13.04517 82.46368       6.331068 77.42224 6.989489 82.01492 3.173719 -4.592674      7.676291 
1 1 1 7   27 20 o 9.469732 4.354832 -1.720440      2.306389 -10.94492      6.922539 -0.5686430     2.446146 13.84270 6.698603 10.93999 4.795627 2.902708       8.238284 
1 1 1 7   27 21 o 65.08631 2.966748 52.00261       4.693133 51.87724       11.12701 52.02974       5.176065 63.84211 7.282196 65.05048 3.275768 -1.208370      7.985050 
1 1 1 7   27 22 o 53.69213 3.173165 35.50345       4.133315 29.19790       9.936070 36.82295       4.545258 46.91219 9.019000 54.63568 3.431188 -7.723495      9.649633 
1 1 1 7   27 23 o 24.28055 5.515956 7.653986       3.189216 10.28885       7.959217 7.150028       3.480873 28.49461 9.640709 23.41700 6.055294 5.077610       11.38463 
1 1 1 7   27 24 o 29.88708 4.514744 11.34548       3.185742 24.86734       8.612053 9.201836       3.428977 42.96218 8.526883 26.61692 5.469540 16.34526       10.13033 
1 1 1 7   27 25 o 30.33893 4.589336 11.74602       3.287113 10.22679       8.184107 12.03824       3.589354 28.04300 9.766026 30.60407 4.984201 -2.561069      10.96437 
1 1 1 7   27 26 f 71.16601 2.801440 62.53691       4.848872 71.14761       9.226509 59.25128       5.699388 74.80507 5.091748 69.05308 3.397382 5.751991       6.121119 
1 1 1 7   27 27 o 26.11952 5.033872 8.956157       3.087906 6.315850       5.917768 9.944030       3.619772 22.60779 8.255985 27.34658 5.619797 -4.738792      9.987163 
1 1 1 7   27 28 o 56.25620 2.983073 39.42937       4.074882 43.85289       7.515771 37.58767       4.849525 57.94726 5.383946 54.61779 3.664796 3.329472       6.512880 
1 1 1 7   27 29 o 50.97483 3.156418 32.63939       3.901671 35.42636       7.153987 31.45946       4.654898 51.35213 5.819264 49.66621 3.876725 1.685925       6.992341 
1 1 1 7   27 30 o 12.26073 5.294604 0.1940990      2.889261 5.375425       7.258293 -0.7814922     3.149546 21.34055 8.747342 11.83801 5.300940 9.502533       10.22819 
1 1 1 7   27 31 o 47.51922 4.248881 29.71833       4.868308 36.36867       9.389203 27.27304       5.693413 48.08741 8.313010 44.57527 5.347998 3.512142       9.884696 
1 1 1 7   27 32 o 23.79654 5.829953 8.296470       3.353694 6.099944       5.394560 9.680186       4.281653 20.17493 7.771523 24.99692 6.834277 -4.821989      10.34910 
1 1 1 7   27 33 o 23.70817 5.160591 8.079466       2.896677 9.546486       5.453543 7.502924       3.418818 23.42482 7.979529 22.15860 6.126338 1.266220       10.06006 
1 1 1 7   27 34 o 11.03292 4.876748 0.2736748E-01  2.578898 6.595392       5.277060 -2.033433      2.955920 19.67806 7.657348 10.05356 4.725119 9.624495       8.997873 
1 1 1 7   27 35 o 16.36021 6.402178 4.060738       3.705661 7.024600       5.460205 1.529974       5.045517 19.41233 7.716875 14.88811 6.684715 4.524219       10.20958 
1 1 1 7   27 36 o 10.11681 4.681794 -0.9662687     2.726652 1.931276       5.260212 -2.030859      3.188448 14.84596 6.730558 10.16654 4.817124 4.679413       8.276780 
1 1 1 7   27 37 o 18.55419 6.099289 6.091110       3.189816 2.082142       5.434353 8.198379       3.939958 14.65277 6.718507 20.71606 6.776885 -6.063294      9.542772 
1 1 1 7   28 0  o 224.0652 3.606486 613.2294       19.69223 590.9641       29.68810 630.7216       26.31418 219.5215 5.554157 227.0325 4.756262 -7.510956      7.312366 
1 1 1 7   28 1  o 62.73048 3.168330 48.16129       4.827661 44.83154       6.749900 51.64835       6.907516 60.35976 4.624165 64.83915 4.397704 -4.479389      6.381434 
1 1 1 7   28 2  o 49.97459 3.433439 30.64298       4.155923 31.31176       5.776023 29.92512       5.984232 50.36029 4.763173 49.17903 5.065737 1.181255       6.953381 
1 1 1 7   28 3  o 105.9024 2.821773 136.9657       7.275736 144.8848       10.86305 130.5231       9.798059 108.7869 4.105053 103.2710 3.900378 5.515869       5.662545 
1 1 1 7   28 4  o 179.5338 3.199280 393.5518       13.99698 382.0593       21.00639 402.7286       18.77113 176.5820 4.886371 181.4716 4.244687 -4.889511      6.472557 
1 1 1 7   28 5  o 238.5232 4.173191 695.7377       24.25688 624.3109       45.52849 724.0495       28.66394 224.5868 8.333294 243.1765 4.837023 -18.58974      9.635382 
1 1 1 7   28 6  o 265.5807 5.188437 864.3792       33.57911 862.9092       57.81609 865.1274       41.24933 263.6848 9.010857 265.3051 6.380213 -1.620361      11.04095 
1 1 1 7   28 7  o 188.4446 3.607460 433.9371       16.56614 414.0027       22.41621 457.9263       24.59059 183.7524 5.010703 193.2081 5.227653 -9.455765      7.241236 
1 1 1 7   28 8  o 176.3518 3.104600 379.7810       13.34202 393.6117       21.00724 370.4303       17.27308 179.1908 4.815164 174.0277 4.073008 5.163025       6.306758 
1 1 1 7   28 9  o 94.27977 2.676265 108.5791       6.142484 116.4249       9.357609 102.6390       8.142221 97.48733 3.947113 91.56017 3.656576 5.927162       5.380543 
1 1 1 7   28 10 o 110.1647 3.147650 148.3665       8.441499 159.5462       17.62757 145.0398       9.615775 113.6674 6.389583 108.8618 3.629782 4.805611       7.348611 
1 1 1 7   28 11 o 152.0405 3.927087 283.0184       14.53791 287.8741       25.43027 280.6610       17.71883 152.5952 6.856216 151.2231 4.814314 1.372101       8.377668 
1 1 1 7   28 12 o 58.61757 3.391928 42.14366       4.824492 57.47812       10.94704 38.44737       5.374590 67.92905 6.700246 55.90776 3.970752 12.02129       7.788464 
1 1 1 7   28 13 o 30.77446 5.034423 11.92535       3.645091 1.001352       7.637744 15.14730       4.147950 21.01380 8.822949 34.76999 5.042412 -13.75620      10.16220 
1 1 1 7   28 14 o 136.7380 3.194260 228.5813       10.64377 220.2443       23.11750 230.8241       11.99027 133.1482 7.150984 137.3011 3.586665 -4.152893      8.000047 
1 1 1 7   28 15 o 59.79286 3.582198 43.91463       5.195642 0.000000       0.000000 43.91463       5.195642 ?        ?        59.79286 3.582198 0.000000       3.582198 
1 1 1 7   28 16 o 68.55073 3.068732 57.58458       5.113340 67.13217       12.36843 55.61635       5.615717 73.20031 7.019629 67.31783 3.434605 5.882484       7.814839 
1 1 1 7   28 17 o 42.79160 3.649139 22.60191       3.768993 27.76619       9.738933 21.69221       4.087497 46.20559 8.972836 41.85027 4.058862 4.355316       9.848155 
1 1 1 7   28 18 o 60.48928 3.105060 44.91094       4.561722 36.33636       10.64032 46.84186       5.049296 53.07439 8.514680 61.73992 3.368816 -8.665531      9.156893 
1 1 1 7   28 19 o 98.38390 2.928900 118.6136       7.014244 121.5286       16.18365 117.9393       7.783276 98.37935 6.792200 98.03648 3.262450 0.3428650      7.535089 
1 1 1 7   28 20 o 77.52614 2.913928 73.74205       5.495275 75.57294       12.89532 73.33578       6.074442 77.27134 6.921449 77.25019 3.233943 0.2114868E-01  7.639689 
1 1 1 7   28 21 o 40.90120 3.568963 20.73525       3.521656 26.27934       9.073985 19.75208       3.821178 44.50992 8.677636 39.82672 3.990906 4.683205       9.551372 
1 1 1 7   28 22 o 57.15919 3.376950 40.35935       4.682817 34.32149       9.959801 42.07289       5.305858 50.95682 8.306578 58.27100 3.756532 -7.314182      9.116510 
1 1 1 7   28 23 f 49.97646 3.284372 30.91281       3.977774 29.65747       9.168701 31.20387       4.414899 47.07560 8.295335 50.12423 3.639194 -3.048622      9.058494 
1 1 1 7   28 24 o 20.53208 5.502491 5.522238       2.808805 0.1451258E-01  6.328715 6.873239       3.134420 17.99254 7.802825 22.84550 5.659589 -4.852962      9.639245 
1 1 1 7   28 25 o 75.43024 3.502601 70.78568       6.420738 55.08664       11.88596 77.25449       7.629749 63.96912 7.784902 78.56594 3.998252 -14.59682      8.751613 
1 1 1 7   28 26 o 33.78033 4.272455 14.58099       3.438506 11.35417       7.763827 15.36837       3.835149 28.24813 9.521699 34.54062 4.676349 -6.292490      10.60806 
1 1 1 7   28 27 o 80.56595 3.535872 81.46164       6.925085 73.27788       13.10365 84.63312       8.157307 72.83643 7.489165 81.70747 4.110037 -8.871040      8.542833 
1 1 1 7   28 28 o 44.93342 3.329795 25.47597       3.620144 29.10857       6.647644 23.94451       4.316314 46.34478 6.028910 43.14529 4.156676 3.199490       7.322958 
1 1 1 7   28 29 f 11.56799 5.090142 -0.2876160     2.779650 -15.11782      6.420132 3.133683       3.083656 11.21363 5.609652 16.15190 5.949563 -4.938269      8.177133 
1 1 1 7   28 30 o 20.18599 6.196496 5.882174       3.339796 8.585564       5.424078 4.231368       4.238573 23.41595 7.958248 18.14137 6.913569 5.274576       10.54188 
1 1 1 7   28 31 o 12.55849 5.584130 -0.1970226     3.431262 -6.151340      7.013537 1.676593       3.934245 14.16320 6.826179 14.92724 6.303485 -0.7640419     9.291428 
1 1 1 7   28 32 o 30.54497 4.388596 12.73121       3.172966 19.83611       5.985415 9.954140       3.742037 35.38790 7.186309 25.71390 6.069921 9.674000       9.406752 
1 1 1 7   28 33 o 19.21414 5.742052 5.636121       2.894786 10.96517       5.704362 3.787762       3.359507 24.30349 8.161517 16.33481 6.171208 7.968679       10.23202 
1 1 1 7   28 34 o 19.65604 5.812701 6.126824       2.978832 16.66607       5.555225 1.873446       3.529099 30.70600 7.491567 13.96291 5.936322 16.74309       9.558425 
1 1 1 7   28 35 o 31.68887 5.329087 15.37266       3.969347 22.48595       6.507062 11.15712       5.009291 34.34998 7.933567 23.77145 7.630810 10.57853       11.00776 
1 1 1 7   28 36 o 10.16849 4.725732 -1.000015      2.823102 -4.439073      5.609197 0.1666626      3.267054 11.95361 5.839507 11.70316 5.305165 0.2504492      7.889525 
1 1 1 7   28 37 o 16.44731 5.970029 4.756132       3.087778 5.001781       6.001651 4.667701       3.600917 16.31943 7.311857 16.13860 6.312339 0.1808319      9.659652 
1 1 1 7   29 0  o 94.43325 3.131495 109.0008       7.196341 106.1937       9.707387 112.4258       10.72249 93.07803 4.291304 95.73286 4.609742 -2.654823      6.298016 
1 1 1 7   29 1  o 112.1902 2.868202 153.7308       7.835096 159.2452       11.69267 149.2369       10.55540 114.0287 4.215133 110.4201 3.929012 3.608643       5.762333 
1 1 1 7   29 2  o 27.14135 5.603752 9.366318       3.583501 9.463111       4.938631 9.258689       5.207744 27.24402 7.294075 27.02547 7.594433 0.2185497      10.52991 
1 1 1 7   29 3  o 82.54690 2.972243 83.29436       5.969140 80.98933       8.582110 85.45441       8.307845 81.24368 4.350660 83.49176 4.095775 -2.248085      5.975251 
1 1 1 7   29 4  o 160.5473 3.098792 314.7476       12.12360 317.2449       18.38361 312.8256       16.12774 160.8882 4.693913 159.8658 4.143317 1.022385       6.260982 
1 1 1 7   29 5  o 50.10069 3.743214 30.85402       4.537055 28.24321       5.919725 34.57115       7.063455 47.72139 5.173039 52.78704 5.575159 -5.065643      7.605441 
1 1 1 7   29 6  o 37.59889 4.420964 17.54150       3.973365 16.02789       5.144936 19.77841       6.254564 35.61203 6.150855 39.54075 6.732059 -3.928726      9.118861 
1 1 1 7   29 7  o 84.79752 3.354968 87.99862       6.919101 92.63232       13.40079 86.31433       8.079329 86.51745 6.401441 83.90801 3.962456 2.609436       7.528579 
1 1 1 7   29 8  o 110.3307 3.189620 148.8411       8.566734 177.3778       18.06136 140.5576       9.730985 119.8926 6.202991 107.1438 3.732652 12.74884       7.239460 
1 1 1 7   29 9  o 16.47692 6.061760 2.652977       3.199411 1.462863       3.887610 5.150738       5.632013 16.07497 6.470240 22.28986 8.066724 -6.214893      10.34099 
1 1 1 7   29 10 o 12.72563 5.458059 -0.1752414     3.030677 -1.178560      3.603082 2.251677       5.603794 13.00083 5.754624 19.36922 7.777925 -6.368389      9.675320 
1 1 1 7   29 11 o 30.89340 5.514327 12.08325       3.999077 6.515584       7.826386 14.05059       4.652273 25.57325 9.467923 33.28882 5.953529 -7.715572      11.18419 
1 1 1 7   29 12 o 54.67960 4.132789 36.83885       5.466098 0.000000       0.000000 36.83885       5.466098 ?        ?        54.67960 4.132789 0.000000       4.132789 
1 1 1 7   29 13 o 22.48840 6.887791 6.282049       4.129474 0.000000       0.000000 6.282049       4.129474 ?        ?        22.48840 6.887791 0.000000       6.887791 
1 1 1 7   29 14 o 91.65836 3.041368 102.8459       6.783835 104.0243       14.95125 102.5404       7.612544 91.34988 6.764345 91.46523 3.421400 -0.1153564     7.580391 
1 1 1 7   29 15 o 110.5431 3.050627 149.5977       8.209966 177.2094       18.86716 143.1481       9.118538 119.3501 6.511722 108.0572 3.467352 11.29290       7.377334 
1 1 1 7   29 16 o 15.85911 5.968925 2.312308       3.136216 2.249262       7.581936 2.325322       3.444729 21.69663 8.921869 16.33106 6.230450 5.365574       10.88202 
1 1 1 7   29 17 o 78.02969 3.013903 74.65763       5.720157 95.11212       13.90399 70.49030       6.275865 87.10783 6.599165 75.74995 3.408546 11.35789       7.427460 
1 1 1 7   29 18 o 100.7901 2.967975 124.5515       7.281834 130.3685       16.46983 123.1381       8.118439 101.8585 6.671954 100.1352 3.331616 1.723335       7.457522 
1 1 1 7   29 19 o 110.9718 2.982323 151.0986       8.057667 145.5371       17.48760 152.5975       9.078833 107.4024 6.715198 111.4208 3.347497 -4.018478      7.503307 
1 1 1 7   29 20 o 50.62199 3.443409 31.67262       4.222512 36.74044       9.559262 30.44411       4.706568 53.19840 7.588625 49.51863 3.932590 3.679771       8.547075 
1 1 1 7   29 21 f 53.53640 3.217158 35.39613       4.177816 29.30568       9.582069 36.82568       4.642303 46.73280 8.735063 54.54169 3.511417 -7.808895      9.414423 
1 1 1 7   29 22 o 99.57413 2.945133 122.1068       7.138550 137.5370       15.95602 118.2455       7.981925 103.7248 6.342895 97.83172 3.353005 5.893074       7.174605 
1 1 1 7   29 23 o 23.49454 5.358117 7.247134       2.999509 16.80161       7.905102 5.640172       3.241954 34.55727 9.217626 20.75941 6.043741 13.79785       11.02232 
1 1 1 7   29 24 f 46.63437 3.406096 27.12982       3.844093 22.65781       9.197177 28.07643       4.231423 39.57703 9.629248 47.34844 3.696562 -7.771408      10.31441 
1 1 1 7   29 25 f 10.37255 4.706216 -1.302287      2.578032 2.437618       6.567112 -1.983642      2.803051 19.62517 8.206572 10.33515 4.770106 9.290026       9.492193 
1 1 1 7   29 26 f 28.97173 4.863373 11.02940       3.312040 5.494737       7.795831 12.24841       3.658642 22.64024 9.144825 30.45597 5.110442 -7.815731      10.47590 
1 1 1 7   29 27 o 23.46390 5.676818 7.569073       3.210358 7.790658       7.860661 7.524714       3.517047 24.01244 9.345220 23.23689 6.125363 0.7755527      11.17377 
1 1 1 7   29 28 o 33.12380 5.048426 14.75107       3.946405 0.000000       0.000000 14.75107       3.946405 ?        ?        33.12380 5.048426 0.000000       5.048426 
1 1 1 7   29 29 o 60.92362 4.372848 48.91624       6.448934 42.39836       7.484949 67.69400       12.70450 55.36886 5.625380 66.25513 8.032537 -10.88627      9.806455 
1 1 1 7   29 30 o 11.39341 5.131614 -0.7057613     2.999567 6.699511       4.822224 -5.379313      3.830896 20.85156 7.474783 10.09206 4.906788 10.75950       8.941418 
1 1 1 7   29 31 o 39.57954 3.688127 20.62196       3.516293 22.31524       6.453810 19.90710       4.193351 37.47274 7.330154 38.11596 4.608016 -0.6432190     8.658232 
1 1 1 7   29 32 o 24.24882 5.516010 8.755641       3.185737 14.00343       7.622163 7.644877       3.506719 25.75972 9.375444 22.03718 6.245564 3.722534       11.26526 
1 1 1 7   29 33 f 26.00742 5.386848 10.17837       3.301634 19.67447       6.262221 6.522489       3.885545 33.00768 7.892283 19.62994 6.734157 13.37774       10.37482 
1 1 1 7   29 34 f 12.72806 5.732914 0.4607081      3.744032 3.308601       5.423511 -2.132128      5.174951 16.02079 7.077252 12.74083 6.065538 3.279966       9.320850 
1 1 1 7   29 35 o 19.66723 6.674167 7.147414       3.814769 10.58460       6.000116 4.815387       4.942254 21.36082 8.204447 16.64990 7.049596 4.710918       10.81711 
1 1 1 7   29 36 o 11.78510 5.172230 0.9532584      2.853043 -4.256845      5.343368 3.030961       3.374299 11.62204 5.682227 14.33125 5.928341 -2.709209      8.211756 
1 1 1 7   30 0  o 46.78036 3.913495 26.94753       4.420485 25.35501       6.038170 28.78685       6.489190 45.10738 5.614327 48.10092 5.643255 -2.993542      7.960339 
1 1 1 7   30 1  o 113.3873 3.649991 157.3216       10.07224 145.5109       11.61487 193.1365       20.22593 108.9390 4.384124 125.0546 6.661046 -16.11555      7.974339 
1 1 1 7   30 2  o 86.18735 3.009857 90.82278       6.311875 98.83206       9.263072 83.88078       8.623846 89.76293 4.246735 82.67210 4.295343 7.090836       6.040259 
1 1 1 7   30 3  o 127.1889 2.952346 197.5449       9.150663 194.6728       13.42914 200.0343       12.50248 126.0189 4.379629 127.8049 4.019321 -1.786034      5.944417 
1 1 1 7   30 4  o 171.2871 3.185356 358.4301       13.29593 362.7250       20.27674 355.1903       17.61046 171.9454 4.844002 170.3371 4.242535 1.608337       6.439212 
1 1 1 7   30 5  o 50.86132 3.376195 31.75437       4.160886 43.82718       6.539016 23.54018       5.393746 59.64059 4.533146 43.49523 5.191123 16.14536       6.891819 
1 1 1 7   30 6  o 142.4196 2.946785 247.7446       10.22714 262.2280       15.83442 237.3782       13.39616 146.2295 4.448734 139.2174 3.952668 7.012024       5.951035 
1 1 1 7   30 7  o 32.38519 4.991026 13.16576       3.812511 13.86415       4.881576 12.07358       6.104600 33.00766 6.298619 30.63699 8.067060 2.370678       10.23475 
1 1 1 7   30 8  o 35.29675 4.624813 15.53420       3.882401 15.40844       4.893555 15.74780       6.377773 34.89926 5.968366 34.97802 7.692045 -0.7875443E-01 9.735962 
1 1 1 7   30 9  o 56.79363 3.582879 39.61618       4.933428 44.51414       6.503870 32.97925       7.570909 60.08924 4.473696 51.36081 6.172499 8.728428       7.623234 
1 1 1 7   30 10 o 41.14810 5.346013 21.16681       5.234024 0.000000       0.000000 21.16681       5.234024 ?        ?        41.14810 5.346013 0.000000       5.346013 
1 1 1 7   30 11 o 29.56883 6.450592 11.22236       4.516974 0.000000       0.000000 11.22236       4.516974 ?        ?        29.56883 6.450592 0.000000       6.450592 
1 1 1 7   30 12 o 30.48357 5.476022 11.79368       3.918365 11.17848       8.402709 11.96463       4.429456 30.17998 9.898178 30.58049 6.157133 -0.4005127     11.65694 
1 1 1 7   30 13 o 74.57223 3.217285 68.18350       5.832837 84.47932       12.91880 64.01099       6.537068 82.28383 6.495396 72.17146 3.729556 10.11237       7.489977 
1 1 1 7   30 14 o 74.57024 3.184015 68.20023       5.772659 74.42748       12.72385 66.58624       6.477687 77.02558 6.850095 73.60990 3.622293 3.415680       7.748858 
1 1 1 7   30 15 o 28.50705 5.331208 10.36190       3.567397 11.22420       8.469604 10.17593       3.933323 30.06912 9.941134 28.13241 5.924901 1.936707       11.57284 
1 1 1 7   30 16 o 53.06682 3.466865 34.70058       4.458734 40.58530       10.10787 33.27888       4.968223 56.32117 7.555023 51.87437 3.960110 4.446796       8.529997 
1 1 1 7   30 17 o 99.29318 3.024964 120.9782       7.310869 140.2942       16.67046 116.3786       8.134887 105.6252 6.508158 97.28588 3.436753 8.339333       7.359850 
1 1 1 7   30 18 o 113.7572 3.347111 159.1889       9.268568 154.2701       17.80453 161.0174       10.85545 110.4538 6.645488 114.2135 3.906017 -3.759621      7.708404 
1 1 1 7   30 19 f 22.23741 5.420876 6.423736       2.910528 12.61210       7.872637 5.444004       3.132462 30.76640 9.525908 20.56731 5.926919 10.19909       11.21924 
1 1 1 7   30 20 o 66.62922 3.428303 54.89180       5.547755 56.99890       11.27458 54.21864       6.372613 66.37334 7.079775 66.05247 3.977491 0.3208618      8.120569 
1 1 1 7   30 21 f 12.05091 5.044523 0.4131030      2.485260 -2.961952      5.926043 1.133387       2.737640 15.58343 7.095804 13.45760 5.425066 2.125833       8.932064 
1 1 1 7   30 22 o 31.56103 4.209359 12.64669       3.156802 14.94793       8.010868 12.22365       3.434731 32.46535 9.514126 30.86502 4.715995 1.600323       10.61881 
1 1 1 7   30 23 o 19.06753 5.664239 4.761387       2.823451 3.046347       6.482723 5.162872       3.136569 20.16748 8.266690 19.83057 5.988611 0.3369122      10.20792 
1 1 1 7   30 24 o 9.306374 4.389364 -2.683754      2.591127 9.044956       6.864019 -4.632870      2.798157 25.64419 8.942951 8.630457 4.195559 17.01374       9.878213 
1 1 1 7   30 25 o 15.21867 5.666761 2.518531       2.811121 0.3053465      7.182957 2.918816       3.054777 18.50865 8.161833 16.07007 5.921253 2.438576       10.08349 
1 1 1 7   30 26 o 34.68822 4.468129 15.70462       3.689344 0.000000       0.000000 15.70462       3.689344 ?        ?        34.68822 4.468129 0.000000       4.468129 
1 1 1 7   30 27 o 27.53454 5.401447 10.42395       3.494771 0.000000       0.000000 10.42395       3.494771 ?        ?        27.53454 5.401447 0.000000       5.401447 
1 1 1 7   30 28 o 41.48428 5.061703 23.39438       5.011178 46.24343       11.46571 17.99918       5.571482 52.96768 9.217495 34.93921 6.788348 18.02847       11.44744 
1 1 1 7   30 29 o 24.49940 6.653390 9.152454       4.073966 17.14880       8.877384 7.019112       4.585320 29.49201 10.17651 21.27092 7.314825 8.221094       12.53268 
1 1 1 7   30 30 o 22.51856 6.107383 7.681509       3.435427 32.49560       9.965981 4.335251       3.659742 41.23427 10.01818 17.48085 6.473938 23.75342       11.92794 
1 1 1 7   30 31 o 21.22814 5.800431 6.881276       3.085290 5.727020       5.729612 7.352646       3.661469 19.07908 7.790392 21.44770 6.468885 -2.368620      10.12604 
1 1 1 7   30 32 o 36.29256 3.832872 17.87151       3.338685 27.04338       6.540584 14.63948       3.882628 40.69913 6.836870 31.50126 5.241935 9.197870       8.615142 
1 1 1 7   30 33 o 11.42618 5.087674 0.2269685      2.858333 7.825883       7.278650 -1.158559      3.108012 19.31229 8.371593 10.69784 4.967203 8.614449       9.734303 
1 1 1 7   30 34 o 19.42022 6.418700 6.709571       3.530977 2.092178       5.481317 9.984795       4.616437 14.98001 6.822324 22.55551 7.332772 -7.575506      10.01567 
1 1 1 7   30 35 o 10.64639 4.901478 -0.5281836     2.933328 2.636016       5.512877 -1.777809      3.464465 14.99370 6.833728 10.58453 5.016973 4.409166       8.477610 
1 1 1 7   31 0  o 76.69936 3.412790 72.05398       6.362804 73.90614       8.352800 69.49334       9.821220 77.54282 4.438872 75.02365 5.408236 2.519173       6.996614 
1 1 1 7   31 1  o 38.55434 4.363982 18.43801       4.028074 24.64430       5.619299 11.87827       5.777091 44.49231 5.285955 30.38944 7.771315 14.10287       9.398651 
1 1 1 7   31 2  o 86.82659 3.354009 92.29094       7.083298 92.98448       9.021979 91.17646       11.43668 87.02672 4.267163 85.96133 5.488266 1.065392       6.951960 
1 1 1 7   31 3  o 72.83147 3.553498 65.02411       6.287796 63.12034       7.832428 68.47509       10.54536 71.62159 4.510530 74.36629 5.866491 -2.744705      7.400040 
1 1 1 7   31 4  o 32.67872 4.742509 13.36691       3.666466 16.68375       5.371309 10.47307       5.017125 36.28291 6.303562 28.54813 7.210851 7.734776       9.577644 
1 1 1 7   31 5  o 35.05173 4.430466 15.29610       3.699989 19.31359       5.284837 11.43370       5.181832 39.22136 5.695727 29.80881 7.212449 9.412542       9.190251 
1 1 1 7   31 6  o 90.97281 3.161295 101.2851       6.997651 99.24180       9.414402 103.8077       10.46038 89.87886 4.310892 91.85996 4.688394 -1.981102      6.369052 
1 1 1 7   31 7  o 20.16152 7.142315 4.398860       4.390241 3.938372       5.716110 5.061231       6.855538 21.08128 8.029926 23.34563 8.816570 -2.264353      11.92525 
1 1 1 7   31 8  o 87.71862 3.147555 94.20961       6.717329 105.2067       12.01792 89.21288       8.100915 92.29146 5.366723 85.24432 3.910125 7.047134       6.640090 
1 1 1 7   31 9  o 89.96694 3.543549 99.24974       7.753669 91.16872       8.699655 130.4632       17.09779 86.11620 4.157825 102.3238 6.897189 -16.20756      8.053492 
1 1 1 7   31 10 o 77.95279 3.165339 74.46634       6.000449 76.18282       7.868587 72.08100       9.275833 78.69332 4.117526 76.36178 5.012434 2.331543       6.486795 
1 1 1 7   31 11 o 37.70085 5.791279 17.96287       5.150718 10.71751       8.535765 22.11182       6.459247 29.73425 9.983617 41.72762 6.569106 -11.99337      11.95097 
1 1 1 7   31 12 o 11.72959 5.381375 -2.467723      3.493492 -1.291144      6.377806 -2.972064      4.175637 17.63764 7.737223 12.79054 5.873745 4.847103       9.714190 
1 1 1 7   31 13 o 81.95393 3.157164 82.39045       6.293468 84.85966       12.97294 81.63049       7.197090 82.28683 6.522849 81.48564 3.633570 0.8011856      7.466618 
1 1 1 7   31 14 f 97.81464 3.125606 117.3705       7.440744 136.4840       16.08132 112.1638       8.393227 104.4161 6.350039 95.50933 3.612690 8.906746       7.305787 
1 1 1 7   31 15 o 48.81498 3.781157 29.48082       4.462898 44.54887       10.11278 25.83645       4.973401 59.07692 7.171198 45.51972 4.544167 13.55720       8.489731 
1 1 1 7   31 16 o 99.02608 3.407109 120.6776       8.209643 130.7312       15.89322 117.0188       9.587826 101.8031 6.439412 97.31191 4.051999 4.491150       7.608201 
1 1 1 7   31 17 o 37.76939 4.145529 17.84122       3.752905 21.43340       8.436948 16.95514       4.190282 39.89917 8.903461 36.64493 4.808270 3.254242       10.11885 
1 1 1 7   31 18 o 46.52479 3.580482 26.85839       4.028197 39.79682       9.726510 24.17981       4.425567 55.26662 7.408436 43.98291 4.179193 11.28371       8.505915 
1 1 1 7   31 19 o 11.03546 4.943674 -1.107969      2.742477 -4.228823      6.616280 -0.4605221     3.013555 15.95968 7.352586 12.24562 5.346426 3.714064       9.090918 
1 1 1 7   31 20 o 61.19111 3.519567 46.52286       5.226099 46.57110       10.24163 46.50587       6.076800 59.44770 7.217322 60.96535 4.114403 -1.517647      8.307711 
1 1 1 7   31 21 o 44.86285 3.469308 25.12228       3.763402 28.16525       8.743389 24.43032       4.169398 45.24620 8.232990 44.09198 3.921272 1.154221       9.119128 
1 1 1 7   31 22 f 70.42719 3.429375 61.86488       5.867915 57.34781       11.37740 63.50185       6.849136 65.24273 7.279978 71.07788 3.970036 -5.835152      8.292121 
1 1 1 7   31 23 o 30.88712 4.629817 12.38391       3.377549 4.344749       7.093396 14.74096       3.840909 21.41364 8.696275 33.66803 4.818689 -12.25439      9.942080 
1 1 1 7   31 24 o 16.19758 5.782262 3.142501       2.882533 9.573565       6.643738 1.651144       3.199351 25.64765 8.805455 14.56441 5.867025 11.08323       10.58102 
1 1 1 7   31 25 o 13.39591 5.583444 0.9656677      3.025220 0.000000       0.000000 0.9656677      3.025220 ?        ?        13.39591 5.583444 0.000000       5.583444 
1 1 1 7   31 26 o 12.47986 5.556479 -0.5352025     3.408797 -0.7365725     7.019094 -0.4730502     3.899531 17.07683 7.754941 13.34754 5.942885 3.729297       9.770210 
1 1 1 7   31 27 o 19.91324 6.748955 5.768455       3.900641 18.70513       8.714647 2.527367       4.361982 31.86360 10.04618 16.37927 6.754517 15.48433       12.10575 
1 1 1 7   31 28 o 13.50950 5.843959 0.6971703      3.532016 2.024668       7.193974 0.2755434      4.054303 18.08790 8.061528 13.86750 6.122836 4.220399       10.12311 
1 1 1 7   31 29 o 40.16177 4.134305 21.62163       3.988503 29.03448       10.13321 20.26264       4.338730 37.59741 10.60359 38.33458 4.745724 -0.7371712     11.61714 
1 1 1 7   31 30 o 33.38330 5.091415 15.94552       4.011059 29.82804       9.449004 12.89408       4.430004 38.19815 10.02613 28.62990 6.498811 9.568251       11.94813 
1 1 1 7   31 31 o 15.35546 5.912138 3.286470       3.120919 7.074522       8.372854 2.675249       3.363295 19.66875 8.735656 14.75254 5.989216 4.916217       10.59162 
1 1 1 7   31 32 o 17.72725 5.832681 5.075626       2.916799 12.09546       6.232083 3.106602       3.300618 23.53058 8.489651 14.94214 5.979819 8.588443       10.38424 
1 1 1 7   31 33 o 22.98571 6.306516 9.093187       3.638554 10.35262       5.965739 8.347191       4.591398 21.41874 8.192421 20.58999 7.303139 0.8287487      10.97504 
1 1 1 7   31 34 o 13.88924 6.033221 2.226274       3.796398 9.177770       7.897527 0.1371805      4.329432 18.88355 8.429318 12.78193 5.909626 6.101622       10.29452 
1 1 1 7   32 0  o 104.3474 2.925613 133.1443       7.432001 143.2343       11.21198 125.2362       9.925997 108.0184 4.267799 101.0332 4.039710 6.985161       5.876510 
1 1 1 7   32 1  o 91.35581 2.996553 102.1033       6.662024 99.24158       9.475276 104.9010       9.368679 89.86464 4.339629 92.42674 4.170276 -2.562103      6.018602 
1 1 1 7   32 2  o 121.6931 2.955752 180.9820       8.765366 189.8918       13.13396 173.8265       11.77009 124.3642 4.340407 119.0372 4.063480 5.326981       5.945671 
1 1 1 7   32 3  o 98.54418 3.384752 118.9393       8.116125 125.0735       14.38364 116.0740       9.830619 100.5349 5.896947 97.21964 4.159062 3.315216       7.216078 
1 1 1 7   32 4  o 14.37305 6.376316 -1.499717      4.448143 -2.797245      5.864970 0.2572683      6.824823 15.94826 7.180010 19.39375 8.250616 -3.445492      10.93733 
1 1 1 7   32 5  o 65.34977 4.217234 52.59918       6.680098 62.80820       9.986083 44.33094       8.986893 71.11420 5.813068 59.55803 6.286783 11.55618       8.562442 
1 1 1 7   32 6  o 76.17855 3.325693 71.15173       6.158902 73.58380       7.875089 67.32139       9.882935 77.33154 4.194609 73.68346 5.544693 3.648079       6.952580 
1 1 1 7   32 7  o 59.57984 3.340917 43.58778       4.831232 47.07797       6.826889 40.08631       6.837912 61.72614 4.570991 56.85268 4.985985 4.873463       6.764170 
1 1 1 7   32 8  o 68.95102 3.010792 58.26978       5.046722 57.40896       7.259420 59.07494       7.020844 68.21345 4.390442 69.23976 4.180473 -1.026314      6.062370 
1 1 1 7   32 9  o 103.6547 2.847381 131.5148       7.185534 145.0472       10.79782 120.7590       9.626509 108.6021 4.087307 99.10050 3.994364 9.501617       5.714982 
1 1 1 7   32 10 o 75.27042 2.910246 69.43468       5.328084 82.34518       7.806474 58.17566       7.290100 81.79330 3.928008 68.62556 4.382142 13.16773       5.884931 
1 1 1 7   32 11 o 92.42748 3.300009 104.8554       7.420869 111.9595       14.90136 102.5125       8.557498 94.53535 6.508093 91.26579 3.856405 3.269569       7.564862 
1 1 1 7   32 12 o 63.11218 4.267448 49.29151       6.524638 49.70980       11.12999 49.07249       8.053608 62.41629 7.465349 62.70560 5.320641 -0.2893066     9.167369 
1 1 1 7   32 13 o 66.43490 4.118757 54.60336       6.635254 56.44695       11.12602 53.58574       8.266090 66.64406 6.952965 65.51126 5.221000 1.132797       8.694974 
1 1 1 7   32 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   32 15 o 80.98229 3.883061 81.12428       7.640699 86.58031       13.07164 78.29263       9.416968 82.55101 6.551574 79.20073 4.903211 3.350281       8.183190 
1 1 1 7   32 16 o 34.13700 5.893538 15.04968       4.725564 10.08015       7.176804 18.85336       6.278778 27.89046 9.147705 37.90186 7.057591 -10.01140      11.55379 
1 1 1 7   32 17 o 82.09814 3.146373 83.14346       6.283116 88.65443       13.02072 81.47073       7.173573 83.17134 6.475277 81.09933 3.639066 2.072014       7.427786 
1 1 1 7   32 18 o 72.79333 3.575092 65.76794       6.322436 52.91705       11.29009 71.63918       7.631245 63.34871 7.456095 75.74285 4.150310 -12.39414      8.533371 
1 1 1 7   32 19 o 37.87772 3.955376 18.06064       3.597220 32.69704       8.429835 14.80208       3.977546 49.56832 7.188259 33.93317 4.956330 15.63515       8.731339 
1 1 1 7   32 20 o 56.93581 3.201902 40.30541       4.424622 41.91993       9.651629 39.87582       4.978594 55.86926 7.260691 56.46725 3.637393 -0.5979919     8.120853 
1 1 1 7   32 21 o 42.82541 3.541581 23.03975       3.663008 27.92607       8.844504 22.02809       4.024374 44.35049 8.492661 41.69249 4.010409 2.658009       9.391947 
1 1 1 7   32 22 o 11.41967 4.941032 -0.6836648E-01 2.526016 1.069235       5.862172 -0.3277534     2.799223 17.61434 7.573460 11.72863 5.136001 5.885706       9.150727 
1 1 1 7   32 23 o 24.52090 7.723636 8.677683       5.152178 0.000000       0.000000 8.677683       5.152178 ?        ?        24.52090 7.723636 0.000000       7.723636 
1 1 1 7   32 24 o 24.67104 7.026253 8.871352       4.427347 5.986681       8.435563 9.968065       5.201307 22.52041 9.349809 25.81192 7.692851 -3.291506      12.10780 
1 1 1 7   32 25 o 11.82969 5.482742 -2.211169      3.760520 0.9186526      7.656382 -3.206262      4.317135 18.45017 8.263139 12.17845 5.719573 6.271716       10.04953 
1 1 1 7   32 26 o 18.30775 6.786656 4.547533       4.023582 15.78784       8.433595 1.235121       4.578211 29.18632 9.923349 15.42862 6.663719 13.75770       11.95316 
1 1 1 7   32 27 o 10.20873 4.749751 -1.857448      2.864340 0.4939288      7.470569 -2.262695      3.101360 17.42067 7.945730 10.40077 4.872900 7.019896       9.320932 
1 1 1 7   32 28 o 81.42365 3.782433 87.21903       7.484617 108.8462       15.40169 80.53254       8.563826 81.82365 7.819190 76.91118 4.590103 4.912476       9.066905 
1 1 1 7   32 29 o 17.28360 6.364731 4.450330       3.528644 23.35777       8.932147 0.9538790      3.841079 32.84007 10.14306 13.75017 6.018918 19.08990       11.79445 
1 1 1 7   32 30 o 24.77036 5.660638 9.421062       3.342044 20.96931       8.807808 7.478752       3.612177 29.44452 10.13754 21.29415 6.425767 8.150370       12.00251 
1 1 1 7   32 31 o 12.39122 5.452011 0.7591051      3.188422 -7.037156      8.922722 1.900333       3.413819 14.22832 7.031475 13.72197 5.836392 0.5063467      9.138113 
1 1 1 7   32 32 o 16.40891 6.449932 4.459477       3.775411 1.796867       7.565518 5.342427       4.356652 15.87337 7.490828 17.34149 6.893271 -1.468122      10.17987 
1 1 1 7   33 0  o 83.12764 3.899137 84.89854       7.876589 107.3196       13.58885 73.55405       9.666004 92.98093 6.029775 77.11122 5.173851 15.86971       7.945245 
1 1 1 7   33 1  o 57.10629 4.423944 40.28938       6.108461 42.22488       9.610442 38.97741       7.912380 57.90547 6.949312 55.86258 5.901427 2.042885       9.117005 
1 1 1 7   33 2  o 71.60953 3.453949 62.93923       6.009527 68.87527       8.096812 55.65839       8.967188 74.74057 4.465875 66.93301 5.547468 7.807556       7.121688 
1 1 1 7   33 3  o 74.91750 3.505240 68.90040       6.381626 64.70802       8.048188 76.00012       10.47342 72.40295 4.585030 78.27193 5.526464 -5.868980      7.180829 
1 1 1 7   33 4  o 97.91422 2.773870 117.3141       6.611958 120.2005       10.13781 115.1774       8.722437 98.83832 4.218740 96.85645 3.702317 1.981873       5.612924 
1 1 1 7   33 5  o 97.00311 2.776753 115.1627       6.557101 130.9329       10.40012 104.7578       8.447663 103.1623 4.145403 92.33956 3.762037 10.82271       5.597971 
1 1 1 7   33 6  o 27.57613 5.291406 9.699220       3.426538 8.395086       4.353932 11.82130       5.553949 25.51493 6.856466 30.14417 7.571760 -4.629234      10.21483 
1 1 1 7   33 7  o 78.85480 3.259928 76.31727       6.250787 66.29709       7.899789 93.09562       10.22239 73.25154 4.446445 86.74049 4.855472 -13.48895      6.583804 
1 1 1 7   33 8  o 40.85470 4.415010 20.79201       4.325776 20.80154       5.321563 20.77345       7.427048 40.61858 5.518859 39.94951 7.908987 0.6690712      9.644162 
1 1 1 7   33 9  o 60.36333 3.163463 44.78761       4.637176 48.69906       6.559730 40.88038       6.556185 62.72184 4.318067 57.34652 4.733579 5.375324       6.407220 
1 1 1 7   33 10 o 40.17310 3.852657 20.03467       3.725481 18.25605       4.912039 22.44329       5.716171 37.96818 5.466225 42.10388 5.718879 -4.135700      7.911080 
1 1 1 7   33 11 o 112.7230 4.484540 157.3389       12.29416 168.1417       17.87395 147.6389       16.93701 115.6069 6.369159 108.2657 6.448848 7.341148       9.063874 
1 1 1 7   33 12 o 66.33399 4.972369 54.96630       7.979275 0.000000       0.000000 54.96630       7.979275 ?        ?        66.33399 4.972369 0.000000       4.972369 
1 1 1 7   33 13 o 125.0751 3.257987 192.5333       9.921703 202.3315       20.07693 189.3671       11.41269 126.3341 6.543700 123.8251 3.786640 2.509018       7.560334 
1 1 1 7   33 14 o 40.27068 4.341508 20.34579       4.193304 19.44536       8.160854 20.66881       4.887921 37.78153 8.993976 40.38355 5.078952 -2.602020      10.32896 
1 1 1 7   33 15 o 49.04850 3.729164 29.93051       4.423907 35.87971       8.901588 27.97917       5.098063 52.38988 7.159546 47.19444 4.486708 5.195438       8.449240 
1 1 1 7   33 16 o 33.49053 4.946904 14.35981       3.915948 14.32346       7.021210 14.37622       4.717887 32.19575 8.730778 33.13314 6.066670 -0.9373856     10.63160 
1 1 1 7   33 17 o 53.62255 4.570677 36.31712       5.915730 37.41422       9.504247 35.62328       7.558345 52.87409 7.593921 52.43761 6.024199 0.4364815      9.693225 
1 1 1 7   33 18 o 28.05806 6.739686 10.67529       4.550324 8.857767       6.936266 12.04842       6.028963 25.84690 8.991373 29.37966 8.140377 -3.532759      12.12891 
1 1 1 7   33 19 o 24.32647 6.789972 8.082361       4.177833 6.802897       6.326523 9.071795       5.563455 23.30739 8.532413 25.59704 8.020887 -2.289652      11.71054 
1 1 1 7   33 20 o 24.99283 6.940446 8.684875       4.377162 9.225867       6.971132 8.332764       5.624038 25.69587 9.008840 24.48609 8.101027 1.209787       12.11552 
1 1 1 7   33 21 o 20.51413 8.172097 4.476465       6.135996 0.000000       0.000000 4.476465       6.135996 ?        ?        20.51413 8.172097 0.000000       8.172097 
1 1 1 7   33 22 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 7   33 23 o 57.53031 5.548239 44.80322       7.681983 46.08004       10.25294 43.16910       11.59911 55.88157 7.736393 51.86819 9.527718 4.013378       12.27311 
1 1 1 7   33 24 o 21.59063 6.885370 6.893448       4.083453 1.994828       7.276232 9.145579       4.933630 18.63176 8.215450 24.35110 7.541247 -5.719336      11.15186 
1 1 1 7   33 25 o 34.26987 4.308741 15.65036       3.518963 29.03218       8.915895 13.18116       3.829885 41.56753 9.058391 30.76330 5.300045 10.80423       10.49500 
1 1 1 7   33 26 o 17.93859 5.933990 4.638716       3.017633 11.39060       7.832459 3.461805       3.270074 24.75997 9.407083 16.28624 6.102291 8.473736       11.21299 
1 1 1 7   33 27 o 57.93839 4.585728 45.88873       6.421802 55.49763       11.65249 41.69725       7.696009 56.57911 8.732060 53.17862 6.045925 3.400497       10.62083 
1 1 1 7   33 28 o 19.96055 6.095900 6.233916       3.237540 17.33350       8.652709 4.427016       3.491128 27.51822 9.993017 17.20688 6.331779 10.31134       11.83012 
1 1 1 7   33 29 o 14.26001 5.738056 2.484546       3.056585 0.9792030      7.477414 2.786549       3.349186 16.30547 7.615529 14.83140 5.992789 1.474065       9.690707 
1 1 1 7   33 30 f 12.93448 5.774229 0.6800159      3.706714 16.07174       8.969954 -2.489604      4.070522 24.08061 9.779229 11.34402 5.394573 12.73659       11.16847 
1 1 1 7   33 31 o 13.53965 5.931856 1.600981       3.737880 5.039270       8.419807 0.7570297      4.171476 17.47318 8.134301 13.27389 6.008183 4.199290       10.11262 
1 1 1 7   34 0  o 50.55645 3.667792 31.52143       4.488011 33.06158       6.135982 29.74956       6.581418 51.53673 4.946406 48.70123 5.650276 2.835499       7.509498 
1 1 1 7   34 1  o 67.61797 3.255752 56.14981       5.348987 58.31382       7.726162 54.15780       7.412785 68.63725 4.646601 66.13911 4.628464 2.498138       6.558474 
1 1 1 7   34 2  o 59.38451 3.333038 43.36153       4.804001 42.25165       6.527414 44.67315       7.095902 58.37170 4.626657 59.96928 4.898231 -1.597580      6.737849 
1 1 1 7   34 3  o 51.13562 4.103923 32.36221       5.071074 33.33427       6.245023 30.48050       8.688828 51.70796 5.019168 48.72180 7.563271 2.986156       9.077176 
1 1 1 7   34 4  o 89.72640 3.063132 98.74572       6.687824 92.31586       9.232553 105.8444       9.700836 86.44817 4.397022 92.60465 4.310558 -6.156479      6.157493 
1 1 1 7   34 5  o 88.27869 2.774179 95.49703       5.960559 103.5261       9.348262 89.99667       7.737387 91.58844 4.199634 85.50051 3.722472 6.087929       5.611927 
1 1 1 7   34 6  o 78.20984 2.797662 75.00475       5.323442 89.55070       8.311293 64.88611       6.931997 85.19093 4.014788 72.50491 3.938113 12.68603       5.623812 
1 1 1 7   34 7  o 32.63321 4.521669 13.39879       3.499295 13.53694       4.585139 13.20609       5.415325 32.44041 6.021669 31.76570 7.166706 0.6747074      9.360671 
1 1 1 7   34 8  o 72.01030 3.257084 63.80915       5.700776 63.84919       7.396025 63.75055       8.948145 71.78748 4.246766 71.44738 5.174441 0.3400955      6.694017 
1 1 1 7   34 9  o 39.11322 4.787029 19.24799       4.467748 22.02403       4.955350 7.188096       10.32840 41.83063 4.957467 27.41688 10.70015 14.41375       11.79278 
1 1 1 7   34 10 o 73.30101 3.330080 66.22942       5.932871 69.50846       7.487434 60.69712       9.725515 74.87179 4.119606 69.35101 5.808011 5.520782       7.120684 
1 1 1 7   34 11 o 70.49124 3.999645 61.64874       6.842378 67.33856       11.33568 58.38737       8.582191 72.66339 6.469274 68.17245 5.205348 4.490936       8.303442 
1 1 1 7   34 12 o 88.15471 3.696243 96.20159       7.922776 80.47609       12.60323 106.4762       10.18739 79.25768 6.584775 92.38701 4.538867 -13.12933      7.997536 
1 1 1 7   34 13 o 103.0550 3.642713 131.5533       9.133698 132.3749       15.68837 131.1319       11.23389 101.6970 6.362309 102.4451 4.510959 -0.7481079     7.799212 
1 1 1 7   34 14 o 61.97007 4.019588 47.95329       6.037402 39.40858       9.687192 53.38017       7.720126 54.54085 7.485814 65.01897 4.908716 -10.47812      8.951698 
1 1 1 7   34 15 o 25.10453 6.222461 8.410633       3.787434 17.51253       7.203936 4.933764       4.452441 35.49257 8.450989 20.32771 7.193534 15.16486       11.09802 
1 1 1 7   34 16 o 79.57607 3.646707 78.98339       7.052832 73.76235       11.90621 81.80582       8.754004 74.97340 6.583518 80.51927 4.479047 -5.545868      7.962699 
1 1 1 7   34 17 o 32.97562 4.746780 14.03938       3.704671 5.471670       6.509806 18.14325       4.505394 22.17263 8.538158 37.42480 5.070422 -15.25216      9.930223 
1 1 1 7   34 18 o 12.84170 5.466846 0.3335226      2.999829 -4.386748      5.630129 2.204834       3.544932 14.04793 6.576448 15.82021 6.240322 -1.772282      9.065942 
1 1 1 7   34 19 o 43.92232 3.862529 24.51509       4.092150 22.05196       8.707163 25.21337       4.636053 38.01430 9.441929 44.30833 4.349648 -6.294029      10.39565 
1 1 1 7   34 20 o 22.90781 6.379525 7.346204       3.692520 0.000000       0.000000 7.346204       3.692520 ?        ?        22.90781 6.379525 0.000000       6.379525 
1 1 1 7   34 21 f 14.22561 5.547618 1.972870       2.774567 -1.692394      6.050819 2.948725       3.122151 15.65898 7.145562 15.96948 5.966938 -0.3104963     9.309319 
1 1 1 7   34 22 o 30.29533 4.826005 12.35013       3.443444 22.74626       8.295590 10.18596       3.784924 37.25787 9.193875 26.82114 5.946919 10.43673       10.94957 
1 1 1 7   34 23 o 17.89587 5.849798 4.465367       2.935972 0.7112654      6.683489 5.363035       3.268195 17.27662 7.730202 19.35279 6.158474 -2.076166      9.883462 
1 1 1 7   34 24 o 15.18401 5.682105 2.826872       2.833388 7.905314       7.472347 1.974080       3.062058 22.32873 8.976274 14.28551 5.744979 8.043218       10.65731 
1 1 1 7   34 25 o 13.27579 5.593895 1.174279       3.087451 1.839454       7.274375 1.028128       3.409810 17.81116 8.009411 13.56729 5.803574 4.243872       9.891012 
1 1 1 7   34 26 o 18.21685 6.391676 5.009655       3.509543 13.31212       7.901493 2.969207       3.917134 25.43562 9.494761 15.87744 6.457028 9.558179       11.48232 
1 1 1 7   34 27 o 14.06499 5.757172 2.113037       3.138666 -9.407007      8.002972 4.207026       3.412019 13.52495 6.679315 16.85009 6.249020 -3.325132      9.146775 
1 1 1 7   34 28 o 30.65742 5.835585 14.51742       4.200484 15.11692       8.383765 14.31648       4.853625 24.71919 9.642354 29.10020 6.941844 -4.381006      11.88125 
1 1 1 7   34 29 o 18.27966 6.658601 5.747489       3.845821 10.29407       9.089274 4.756027       4.244483 20.50111 9.103731 17.06347 6.797012 3.437639       11.36122 
1 1 1 7   34 30 o 25.64339 6.555734 11.39052       4.111970 6.700889       8.224383 12.95351       4.748008 18.23861 8.325760 26.52816 7.173619 -8.289553      10.98995 
1 1 1 7   35 0  o 138.0505 3.077570 233.7287       10.35338 233.6391       15.49210 233.8010       13.91786 137.3853 4.633997 137.6447 4.154073 -0.2593231     6.223364 
1 1 1 7   35 1  o 75.88789 3.503036 70.92191       6.460707 65.75269       8.224056 79.25451       10.44151 72.76386 4.662572 79.66261 5.410754 -6.898743      7.142537 
1 1 1 7   35 2  o 42.67019 4.100036 22.65234       4.210916 17.05544       5.569701 30.11998       6.433539 36.35386 6.526875 48.90292 5.493458 -12.54906      8.531013 
1 1 1 7   35 3  o 116.7318 2.775990 166.9845       7.896658 154.6136       12.29662 175.6666       10.30152 111.7088 4.526503 119.4626 3.542526 -7.753860      5.747932 
1 1 1 7   35 4  o 38.23106 4.098958 18.23877       3.759240 20.59183       5.410423 16.04251       5.227054 40.24576 5.673904 35.25641 6.315880 4.989353       8.490202 
1 1 1 7   35 5  o 68.35187 3.177688 57.51373       5.278463 64.41729       7.333915 50.09409       7.603108 72.08020 4.193369 63.30413 4.968378 8.776066       6.501471 
1 1 1 7   35 6  o 19.59055 6.080608 4.823486       3.205509 6.329755       4.048596 2.292787       5.247753 22.27276 6.819678 18.63098 7.510914 3.641773       10.14504 
1 1 1 7   35 7  o 18.88739 6.206565 4.349953       3.303128 4.779437       4.349043 3.764468       5.077837 20.32216 7.116323 19.85614 7.567122 0.4660187      10.38766 
1 1 1 7   35 8  o 43.00453 3.732700 23.00388       3.873065 27.48436       5.385087 18.20265       5.574505 46.74451 4.795354 37.47079 6.330140 9.273712       7.941416 
1 1 1 7   35 9  o 125.2016 3.871882 194.1937       11.79902 183.6357       18.95371 200.8741       15.07657 119.9606 6.508018 126.7211 4.891408 -6.760468      8.141264 
1 1 1 7   35 10 o 20.64185 5.782068 5.549433       3.023823 2.864944       3.973824 9.241745       4.660441 17.47441 6.685653 26.33080 7.101548 -8.856390      9.753458 
1 1 1 7   35 11 o 45.32455 4.220850 25.79082       4.608383 37.47364       8.706635 21.24403       5.431612 53.57190 6.823925 40.61979 5.639137 12.95211       8.852447 
1 1 1 7   35 12 o 44.67546 4.299873 25.14606       4.623487 33.54873       8.569255 21.69550       5.491353 50.32218 7.192248 40.97713 5.649396 9.345047       9.145716 
1 1 1 7   35 13 o 36.75586 5.274467 17.45320       4.589159 13.63898       7.002872 20.32415       6.075566 31.14235 8.825853 39.13437 6.605681 -7.992025      11.02410 
1 1 1 7   35 14 o 20.50911 7.026399 5.280745       4.229741 1.273601       6.403907 8.381643       5.633409 18.74792 7.984560 24.92210 8.100151 -6.174171      11.37390 
1 1 1 7   35 15 o 52.09940 4.863749 34.79350       6.103687 36.51372       8.742644 33.15775       8.525292 52.01531 7.080921 49.38739 7.303612 2.627918       10.17262 
1 1 1 7   35 16 o 74.31338 3.719080 69.41510       6.713611 70.70877       11.40625 68.72935       8.304492 72.78088 6.499486 73.30074 4.673437 -0.5198669     8.005269 
1 1 1 7   35 17 o 29.57539 5.959330 11.88181       4.146416 0.000000       0.000000 11.88181       4.146416 ?        ?        29.57539 5.959330 0.000000       5.959330 
1 1 1 7   35 18 o 19.49777 6.712902 5.010322       3.862096 0.000000       0.000000 5.010322       3.862096 ?        ?        19.49777 6.712902 0.000000       6.712902 
1 1 1 7   35 19 o 22.03261 6.165963 6.824769       3.440361 26.20209       8.229253 2.720742       3.787203 41.67984 8.392756 16.39870 6.455714 25.28114       10.58842 
1 1 1 7   35 20 o 13.40243 5.603434 1.014291       3.060859 4.218830       7.643718 0.4022982      3.340373 20.61545 8.749474 13.22166 5.701160 7.393791       10.44301 
1 1 1 7   35 21 o 18.58874 5.947954 4.846243       3.045273 0.4969221      6.341199 6.149992       3.471823 16.92941 7.555380 20.63010 6.314970 -3.700689      9.846960 
1 1 1 7   35 22 o 14.14731 5.649619 1.935389       2.939775 3.007383       7.270921 1.725899       3.214211 19.01200 8.302533 14.24245 5.827490 4.769552       10.14355 
1 1 1 7   35 23 o 55.34756 3.966421 40.28479       5.314280 47.63260       11.30984 38.20281       6.020279 52.92133 9.097663 53.12029 4.699137 -0.1989555     10.23960 
1 1 1 7   35 24 o 20.40525 6.361354 6.376250       3.504117 12.41243       8.350502 5.086177       3.860455 24.92997 9.651435 18.50614 6.681133 6.423828       11.73830 
1 1 1 7   35 25 o 33.61441 5.378412 16.35745       4.257245 18.45615       8.907345 15.73610       4.846654 28.69885 10.17282 31.87160 6.461683 -3.172752      12.05154 
1 1 1 7   35 26 o 10.20529 4.861185 -2.850762      3.333509 -13.04872      7.252923 -0.1196116     3.753439 11.89291 5.951381 12.66183 5.718215 -0.7689142     8.253297 
1 1 1 7   35 27 o 11.60873 5.338399 -0.8206645     3.465663 -2.472671      6.923228 -0.2682759     4.003365 14.42649 6.908322 12.71139 5.804979 1.715100       9.023453 
1 1 1 7   35 28 o 18.80982 6.653268 6.159740       3.808393 3.137890       7.974044 7.052713       4.334723 16.97865 7.908101 19.64194 7.081165 -2.663294      10.61513 
1 1 1 7   35 29 o 9.073149 4.388009 -3.279420      2.959618 -6.046625      7.968790 -2.836638      3.187620 13.60272 6.707787 9.715628 4.661754 3.887089       8.168620 
1 1 1 7   36 0  o 48.01677 4.186165 28.74403       4.849380 23.61728       6.128539 37.32963       7.930874 42.95175 6.020256 54.13079 6.119478 -11.17904      8.584374 
1 1 1 7   36 1  o 19.33900 7.161097 3.882237       4.477599 3.395943       5.837850 4.577072       6.978218 20.31233 8.009383 22.51978 8.793390 -2.207451      11.89428 
1 1 1 7   36 2  o 113.4146 3.861060 159.1266       10.65561 165.7474       12.60817 142.5774       19.93366 115.4478 4.490135 104.8947 7.855309 10.55310       9.048049 
1 1 1 7   36 3  o 37.42930 4.517433 17.64806       4.037163 16.21599       5.211423 19.79726       6.384294 35.32935 6.283484 38.86751 6.997781 -3.538162      9.404845 
1 1 1 7   36 4  o 68.68806 2.978821 58.11737       4.974255 67.05412       7.684052 51.67089       6.526225 73.36420 4.317118 64.41622 4.180058 8.947975       6.009192 
1 1 1 7   36 5  o 65.87189 2.967844 53.47692       4.751825 47.58396       6.885411 58.83606       6.566144 61.62643 4.618462 68.81112 3.932126 -7.184685      6.065625 
1 1 1 7   36 6  o 24.11302 5.701962 7.625775       3.297500 6.370002       4.577011 8.981005       4.754808 22.40822 7.302559 25.97156 7.241660 -3.563341      10.28441 
1 1 1 7   36 7  o 26.41448 5.386454 9.090267       3.349554 8.236518       4.352813 10.32983       5.244915 24.89371 6.924195 27.70349 7.559926 -2.809786      10.25168 
1 1 1 7   36 8  o 53.78385 3.347495 35.88690       4.365657 34.02951       5.964899 38.02961       6.406691 51.89249 4.770298 54.85033 4.842816 -2.957836      6.797691 
1 1 1 7   36 9  o 28.62851 4.915069 10.58166       3.305509 9.626285       4.332129 11.91297       5.113935 26.78977 6.663453 29.68126 7.154647 -2.891489      9.777043 
1 1 1 7   36 10 o 21.68616 5.800794 6.229245       3.125246 6.631972       4.131339 5.690467       4.778482 22.41261 6.893939 21.44962 7.462835 0.9629917      10.15974 
1 1 1 7   36 11 o 49.56721 4.009839 30.90530       4.802164 24.51317       8.512173 33.88948       5.816077 41.80220 8.641806 51.63761 4.672492 -9.835407      9.824101 
1 1 1 7   36 12 o 16.86650 6.200905 3.135219       3.347056 2.092604       5.639435 3.702206       4.158726 18.43446 7.648341 18.41626 6.885501 0.1820183E-01  10.29112 
1 1 1 7   36 13 o 17.13924 6.267661 3.331130       3.412369 0.3237801      6.089538 4.707735       4.119998 17.52937 7.627472 19.55119 6.919675 -2.021820      10.29856 
1 1 1 7   36 14 o 14.48507 5.890813 1.430881       3.260291 2.234956       5.635725 1.026426       3.997025 18.32847 7.628569 15.18010 6.378669 3.148375       9.943968 
1 1 1 7   36 15 o 68.18651 4.865435 60.15388       8.031435 0.000000       0.000000 60.15388       8.031435 ?        ?        68.18651 4.865435 0.000000       4.865435 
1 1 1 7   36 16 o 10.22945 4.907982 -4.475015      3.531991 0.000000       0.000000 -4.475015      3.531991 ?        ?        10.22945 4.907982 0.000000       4.907982 
1 1 1 7   36 17 o 15.40767 5.955307 2.461878       3.175529 4.211226       5.754404 1.695876       3.807827 19.64357 7.883940 15.31247 6.312368 4.331106       10.09963 
1 1 1 7   36 18 f 16.62463 6.402484 3.120270       3.660764 5.340559       5.890872 1.723423       4.672502 20.51818 8.059329 16.26056 6.868158 4.257614       10.58888 
1 1 1 7   36 19 o 28.12221 6.233234 11.36432       4.159402 18.28328       7.583050 8.386799       4.974516 33.15458 9.107418 23.45011 7.610974 9.704477       11.86895 
1 1 1 7   36 20 o 25.55647 6.552302 9.686935       4.099531 8.761766       7.590293 10.06797       4.871118 23.40833 9.162004 25.47611 7.405773 -2.067778      11.78082 
1 1 1 7   36 21 o 19.99840 6.596800 5.935515       3.730242 9.350729       7.190884 4.678131       4.363221 23.50348 8.993247 18.48948 7.022003 5.014000       11.40995 
1 1 1 7   36 22 o 41.37004 5.215661 23.92419       5.141507 22.11434       8.556424 24.94699       6.432284 34.14606 9.781826 40.63782 6.730690 -6.491760      11.87377 
1 1 1 7   36 23 o 22.81217 6.724571 8.284382       3.992000 3.603935       8.305746 9.690392       4.552282 18.93420 8.532582 24.28711 7.186608 -5.352909      11.15582 
1 1 1 7   36 24 o 17.61261 6.516971 4.690101       3.707090 8.308034       8.073282 3.723460       4.173038 21.07929 8.970841 16.64528 6.702236 4.434010       11.19803 
1 1 1 7   36 25 o 16.00029 6.092276 3.704549       3.289532 18.44565       8.814163 1.319063       3.545722 27.41294 10.06530 13.55193 5.858792 13.86101       11.64628 
1 1 1 7   36 26 o 12.00090 5.325101 0.3526306      3.104037 2.169697       7.748285 0.5265255E-02  3.387766 16.77934 7.808561 12.09879 5.451072 4.680542       9.523014 
1 1 1 7   36 27 o 15.91681 5.970063 3.929922       3.131599 12.32229       8.421421 2.583192       3.373519 21.79004 9.212976 14.36112 5.932932 7.428926       10.95804 
1 1 1 7   37 0  o 9.471517 4.568859 -4.749700      3.158119 -4.376481      4.191432 -5.239848      4.803355 11.82408 5.578605 12.50737 5.922196 -0.6832962     8.135922 
1 1 1 7   37 1  o 12.90954 5.558044 -0.8302442E-01 3.165381 -0.1009305     4.017916 -0.5372777E-01 5.139359 14.47220 6.246608 16.31329 7.053092 -1.841089      9.421582 
1 1 1 7   37 2  o 32.32849 4.927403 13.39491       3.759310 13.70005       5.078281 13.02496       5.591653 32.10031 6.708343 31.03604 7.481456 1.064270       10.04858 
1 1 1 7   37 3  o 21.33269 6.471301 5.925823       3.656800 -0.5376799     5.800539 10.18896       4.710849 16.88748 7.394251 27.53057 7.005578 -10.64309      10.18592 
1 1 1 7   37 4  o 58.39479 3.604612 42.43673       5.104424 45.27683       9.772388 41.37114       5.985891 58.71852 6.965014 57.39709 4.311101 1.321430       8.191278 
1 1 1 7   37 5  o 25.10089 5.511765 8.294320       3.278933 9.399033       4.573534 7.125973       4.703414 26.38872 6.998587 23.28458 7.385428 3.104137       10.17471 
1 1 1 7   37 6  o 33.17086 5.356091 14.28871       4.182076 8.109642       7.320104 17.28283       5.095546 25.40709 9.196298 36.30319 5.966960 -10.89610      10.96250 
1 1 1 7   37 7  o 89.61568 3.104595 99.46739       6.769689 112.4494       12.74673 94.36713       7.989586 93.60469 5.613909 86.94520 3.779910 6.659492       6.767842 
1 1 1 7   37 8  o 50.68309 3.755361 32.20915       4.605264 29.92800       5.732371 36.36133       7.733846 48.35321 4.933958 52.68501 6.138690 -4.331795      7.875751 
1 1 1 7   37 9  o 9.960909 4.636926 -2.285135      2.735615 -1.320241      3.397582 -4.063684      4.612784 12.15130 5.468211 12.63534 5.927176 -0.4840460     8.064288 
1 1 1 7   37 10 o 17.58732 5.950461 3.860331       3.032171 1.737544       3.916841 7.035079       4.790020 15.84432 6.451855 22.85794 7.471953 -7.013617      9.872006 
1 1 1 7   37 11 o 17.68339 6.484571 3.607648       3.656536 -0.9856237E-01 6.059387 5.730203       4.585568 17.11934 7.524704 21.03507 7.311113 -3.915733      10.49159 
1 1 1 7   37 12 o 64.94830 4.118808 53.61926       6.485336 50.28719       10.26053 55.83607       8.369100 60.52214 7.091276 65.41496 5.295308 -4.892811      8.850225 
1 1 1 7   37 13 o 17.41816 6.793746 3.114239       4.161577 0.000000       0.000000 3.114239       4.161577 ?        ?        17.41816 6.793746 0.000000       6.793746 
1 1 1 7   37 14 o 20.07891 7.069323 5.355682       4.295739 0.000000       0.000000 5.355682       4.295739 ?        ?        20.07891 7.069323 0.000000       7.069323 
1 1 1 7   37 15 o 27.15247 5.795381 10.21739       3.717862 20.81599       7.379896 6.612628       4.303925 36.96075 8.386591 21.58394 7.084268 15.37681       10.97824 
1 1 1 7   37 16 o 52.35071 4.219047 35.63830       5.336812 35.26567       8.767555 35.85764       6.726505 48.86628 7.610374 51.46590 5.445836 -2.599625      9.358149 
1 1 1 7   37 17 o 27.65095 5.465517 10.61760       3.552197 8.166762       6.640186 11.60016       4.204376 23.14484 8.690768 28.43161 6.239868 -5.286764      10.69885 
1 1 1 7   37 18 o 9.947809 4.689303 -2.618682      2.949932 -3.637801      5.622330 -2.231557      3.465214 13.78195 6.489631 11.22311 5.222563 2.558842       8.330094 
1 1 1 7   37 19 o 11.70624 5.231680 -0.5031863     3.051742 -2.224923      5.789555 0.1592477      3.591146 14.56392 6.768146 13.17806 5.792572 1.385865       8.908517 
1 1 1 7   37 20 o 25.17403 6.334103 9.535451       3.881935 25.85018       8.498004 5.233301       4.363850 38.31291 9.215096 18.98691 7.062242 19.32600       11.61005 
1 1 1 7   37 21 o 14.76768 5.898362 2.423830       3.204889 2.308226       7.003567 2.454450       3.604425 17.70352 7.917759 15.17868 6.186052 2.524842       10.04779 
1 1 1 7   37 22 o 21.79262 6.338379 7.460948       3.567306 18.47312       8.481205 5.093972       3.932041 29.28570 9.951405 18.26763 6.720139 11.01807       12.00794 
1 1 1 7   37 23 o 17.25756 6.185559 4.542898       3.302112 -0.1213957     6.956619 5.899483       3.751706 15.77885 7.361627 19.08348 6.614138 -3.304630      9.896482 
1 1 1 7   37 24 o 24.15770 5.992784 9.223284       3.510834 23.91437       9.090691 6.647982       3.806134 31.54872 10.29228 19.87440 6.666599 11.67432       12.26273 
1 1 1 7   37 25 o 16.56935 6.169578 4.303356       3.332089 9.793251       7.922627 3.123581       3.672711 20.78199 8.866873 15.25052 6.233363 5.531476       10.83865 
1 1 1 7   37 26 o 9.065472 4.355322 -2.844960      2.802412 6.969940       7.750237 -4.321257      3.005792 18.75327 8.362132 8.685902 4.249895 10.06737       9.380132 
1 1 1 7   38 0  o 36.77448 4.294652 17.17181       3.776294 14.57462       4.971407 20.71449       5.806222 33.04419 6.405023 39.63599 6.215503 -6.591805      8.925066 
1 1 1 7   38 1  o 13.75863 5.904162 0.1381765      3.549741 1.170150       5.307493 -0.6970538     4.774834 17.34146 7.322106 15.11594 6.660567 2.225513       9.898303 
1 1 1 7   38 2  o 10.87393 4.993072 -1.953723      3.016297 -4.947479      4.025983 1.876862       4.554033 11.11535 5.307867 16.95538 6.936913 -5.840029      8.734656 
1 1 1 7   38 3  o 39.93323 4.029082 20.16255       3.867258 16.03070       5.264468 25.00580       5.699678 34.57149 6.487064 43.90152 5.444225 -9.330032      8.468860 
1 1 1 7   38 4  o 35.89986 4.111196 16.37266       3.531841 19.92907       5.255634 13.44404       4.769268 38.97618 5.702050 31.58554 6.415415 7.390638       8.583177 
1 1 1 7   38 5  o 26.60234 6.249083 9.588717       3.981781 13.61095       7.069601 7.719958       4.818789 30.66223 8.924270 23.80421 7.465639 6.858017       11.63522 
1 1 1 7   38 6  o 98.08585 3.071497 119.5395       7.332583 113.8397       14.79358 121.3959       8.442651 92.54465 6.603109 98.54654 3.521275 -6.001892      7.483344 
1 1 1 7   38 7  o 15.10853 5.849184 2.148519       3.067054 -0.2911028     4.073142 5.343139       4.660987 14.15519 6.197093 20.62333 7.353782 -6.468141      9.616759 
1 1 1 7   38 8  o 35.90675 4.254705 16.54037       3.650638 13.05314       4.761326 21.51463       5.686591 30.81800 6.542484 40.10614 6.002723 -9.288137      8.879008 
1 1 1 7   38 9  o 35.70709 4.308867 16.42411       3.673615 17.77013       4.930040 14.74369       5.508513 36.44237 5.741241 32.34622 7.176121 4.096146       9.190134 
1 1 1 7   38 10 o 22.46593 6.273972 6.996713       3.565965 0.8241960E-01  5.341543 12.55583       4.789563 16.13263 7.078794 29.91430 6.733194 -13.78168      9.769607 
1 1 1 7   38 11 o 34.30171 5.832346 16.00684       4.700880 0.000000       0.000000 16.00684       4.700880 ?        ?        34.30171 5.832346 0.000000       5.832346 
1 1 1 7   38 12 o 63.84488 4.104784 52.38484       6.352510 38.56322       9.308973 64.43089       8.690495 51.61643 7.630451 69.82410 5.143540 -18.20766      9.202162 
1 1 1 7   38 13 o 22.46554 6.255935 7.180473       3.550967 13.57630       6.267449 4.156752       4.309364 29.54611 8.341404 18.41830 6.982338 11.12781       10.87805 
1 1 1 7   38 14 o 20.38033 6.501200 5.908952       3.640292 9.167944       7.119454 4.755290       4.235888 24.29924 9.023876 18.97360 6.975785 5.325644       11.40578 
1 1 1 7   38 15 o 16.53987 6.217765 3.322442       3.400955 7.796901       6.814301 1.838172       3.924709 22.80048 8.746964 15.37339 6.379588 7.427087       10.82629 
1 1 1 7   38 16 o 19.07753 6.473548 5.169560       3.588874 12.37296       6.977461 2.578299       4.184890 26.94950 9.026149 16.29382 6.656094 10.65568       11.21494 
1 1 1 7   38 17 o 19.90926 6.395321 5.821696       3.518098 -4.571834      6.603638 9.940704       4.157173 14.43298 6.865658 25.71810 6.600544 -11.28512      9.523889 
1 1 1 7   38 18 o 15.15477 6.118406 2.385291       3.487866 1.781439       6.207134 2.663936       4.216490 17.13215 7.569606 16.13340 6.645779 0.9987507      10.07300 
1 1 1 7   38 19 o 15.48212 6.153666 2.799192       3.471648 8.139145       7.251990 1.211612       3.954179 21.81152 8.816504 14.35971 6.197452 7.451811       10.77679 
1 1 1 7   38 20 o 23.89030 6.243478 8.825947       3.674565 18.94792       8.470179 6.479317       4.078329 29.98443 9.942524 20.12663 6.899365 9.857794       12.10186 
1 1 1 7   38 21 o 16.99086 6.306429 4.278164       3.476319 -3.138533      8.037385 5.984909       3.855615 15.46321 7.415039 19.26391 6.703492 -3.800698      9.995979 
1 1 1 7   38 22 o 18.30643 6.251816 5.330466       3.347991 4.049727       7.974979 5.604479       3.688795 18.15654 8.253454 18.59202 6.550475 -0.4354820     10.53699 
1 1 1 7   38 23 o 24.41547 6.144780 9.590006       3.652690 4.964869       8.155756 10.75052       4.085324 18.31862 8.334684 25.45679 6.548352 -7.138168      10.59943 
1 1 1 7   38 24 o 22.65460 6.104249 8.400096       3.445364 7.550727       8.069730 8.589437       3.810082 19.31305 8.576962 22.41028 6.559731 -3.097229      10.79789 
1 1 1 7   39 0  o 78.30455 3.431557 76.71747       6.532184 75.52692       8.357541 78.58654       10.47176 76.99496 4.473574 77.62460 5.572935 -0.6296463     7.146360 
1 1 1 7   39 1  o 42.69287 3.938940 23.12882       4.051812 31.13288       5.907639 16.01936       5.567712 49.01385 5.016755 34.04277 6.946900 14.97109       8.568970 
1 1 1 7   39 2  o 19.38492 6.525266 4.868407       3.646258 4.481451       6.149580 5.078204       4.528075 20.72199 8.204912 20.16193 7.241323 0.5600624      10.94337 
1 1 1 7   39 3  o 39.73824 4.486697 20.34409       4.268932 23.99076       8.242184 19.00721       4.990459 40.54136 8.608997 37.85354 5.576934 2.687817       10.25753 
1 1 1 7   39 4  o 7.744276 3.842293 -6.326701      2.763191 -4.501717      3.692048 -8.650615      4.166274 10.58174 5.061193 9.714096 4.801362 0.8676434      6.976299 
1 1 1 7   39 5  o 58.38604 3.363360 42.83517       4.765152 39.89563       6.615205 46.00543       6.869893 55.37198 4.954804 59.62297 4.767950 -4.250988      6.876295 
1 1 1 7   39 6  o 43.43166 3.755305 23.98858       3.935540 26.02654       5.819245 22.27077       5.342636 44.22813 5.519003 40.88544 5.501808 3.342690       7.792900 
1 1 1 7   39 7  o 30.48700 6.609837 13.05360       4.768854 0.000000       0.000000 13.05360       4.768854 ?        ?        30.48700 6.609837 0.000000       6.609837 
1 1 1 7   39 8  o 19.12207 7.179871 4.486397       4.531953 0.000000       0.000000 4.486397       4.531953 ?        ?        19.12207 7.179871 0.000000       7.179871 
1 1 1 7   39 9  o 40.13565 4.696856 21.19503       4.507038 34.85390       8.784242 16.31446       5.250880 48.97576 7.606869 33.98092 6.578817 14.99484       10.05710 
1 1 1 7   39 10 o 24.28448 6.184087 8.376195       3.668937 6.566952       4.442585 12.25709       6.506587 21.44393 7.202545 27.86470 8.665456 -6.420767      11.26795 
1 1 1 7   39 11 o 18.16117 6.726859 4.203452       3.951538 6.280733       6.378530 2.909685       5.033858 21.55572 8.409913 17.65443 7.265738 3.901291       11.11385 
1 1 1 7   39 12 o 15.97972 6.242198 2.768718       3.517632 6.516122       6.038573 0.8439279      4.327735 21.51204 8.238747 15.00028 6.478792 6.511756       10.48102 
1 1 1 7   39 13 o 18.91484 6.470015 5.012952       3.586071 0.1685577      6.567755 7.070670       4.280456 16.94141 7.615035 21.79960 7.058891 -4.858198      10.38348 
1 1 1 7   39 14 o 26.12300 6.080001 9.896137       3.797629 15.28597       7.238385 7.849061       4.460886 29.73694 9.121243 22.66002 7.193119 7.076920       11.61628 
1 1 1 7   39 15 o 11.91444 5.392333 -0.8995047     3.359170 1.566630       6.060463 -1.993146      4.035849 17.04283 7.506963 12.27513 5.685961 4.767699       9.417253 
1 1 1 7   39 16 o 9.724426 4.710175 -4.584843      3.443272 -3.561503      5.980284 -5.092330      4.211380 13.98343 6.617220 10.83794 5.239769 3.145481       8.440544 
1 1 1 7   39 17 f 18.74192 6.476682 5.265806       3.596280 0.8234015      7.037866 6.835677       4.183733 16.95984 7.726532 20.79974 6.989592 -3.839897      10.41891 
1 1 1 7   39 18 o 11.47084 5.237663 -0.9589655     3.257522 -1.822487      6.259208 -0.6381944     3.814875 14.77146 6.921270 12.57885 5.714211 2.192605       8.975309 
1 1 1 7   39 19 o 23.38563 6.324233 8.652044       3.690064 28.59531       8.427025 3.920901       4.104490 39.09665 9.027449 16.81588 6.688701 22.28076       11.23537 
1 1 1 7   39 20 o 19.27879 6.391593 5.984769       3.500436 8.069221       8.028846 5.495567       3.889567 20.54508 8.848719 18.47585 6.701295 2.069225       11.09987 
1 1 1 7   39 21 o 18.40168 6.428916 5.510044       3.548173 4.745228       8.471970 5.672732       3.907368 18.44566 8.431634 18.51672 6.716542 -0.7106018E-01 10.77981 
1 1 1 7   39 22 o 15.30381 6.103921 3.242445       3.427349 1.137171       7.742343 3.755547       3.822258 16.31533 7.661524 16.05300 6.431409 0.2623272      10.00310 
1 1 1 7   40 0  o 23.00055 5.943739 7.337023       3.355273 5.500339       4.284369 10.25013       5.395702 20.27534 7.065712 26.36774 7.829598 -6.092402      10.54642 
1 1 1 7   40 1  f 18.15318 6.863008 3.862547       4.156621 8.459559       7.039602 1.401934       5.150293 24.29380 8.982108 16.77891 7.153711 7.514894       11.48276 
1 1 1 7   40 2  o 49.03683 3.764472 30.66701       4.464046 37.27779       6.311954 24.05137       6.314274 53.28344 4.916522 41.67680 6.423252 11.60664       8.088903 
1 1 1 7   40 3  o 22.94528 6.120385 7.387027       3.485165 6.860684       5.367769 7.770619       4.582411 22.14666 7.892238 23.20517 7.280581 -1.058508      10.73752 
1 1 1 7   40 4  o 21.74641 6.500661 6.693705       3.709795 11.03870       6.763856 4.824257       4.436663 26.63627 8.886284 19.37060 7.136202 7.265667       11.39699 
1 1 1 7   40 5  o 29.80933 5.989412 12.37388       4.199688 10.69052       6.975233 13.33111       5.259923 26.13894 9.020559 30.14071 7.250128 -4.001766      11.57302 
1 1 1 7   40 6  o 15.24732 5.870412 2.476453       3.076990 3.979284       4.171093 0.6822134      4.557589 18.11333 6.868790 15.29168 6.626602 2.821659       9.544219 
1 1 1 7   40 7  o 18.67588 6.354872 4.744854       3.458764 6.703177       4.550871 2.066623       5.322019 21.56383 7.289918 17.24268 7.308660 4.321156       10.32276 
1 1 1 7   40 8  o 40.72480 4.092222 21.58661       4.006211 22.95371       5.735283 20.28395       5.598469 40.63194 5.970205 37.92275 6.277486 2.709187       8.663151 
1 1 1 7   40 9  o 15.17685 5.718636 2.655912       2.880526 -0.6138299     3.797765 7.084942       4.420035 13.03291 5.829571 21.90089 7.178686 -8.867983      9.247563 
1 1 1 7   40 10 f 31.93796 5.616693 14.22898       4.211919 32.36648       8.594331 8.495715       4.831973 45.88816 7.974844 23.54398 7.487814 22.34418       10.93917 
1 1 1 7   40 11 o 26.60316 5.981472 10.18875       3.783283 9.088691       6.957843 10.65052       4.507925 23.65925 8.893608 26.56197 6.902297 -2.902723      11.25780 
1 1 1 7   40 12 o 26.61406 6.992410 10.85763       4.593008 29.97426       8.744217 3.573704       5.397568 42.70802 8.697692 18.07196 7.488861 24.63605       11.47749 
1 1 1 7   40 13 o 14.95210 6.299164 1.720941       3.913993 -9.138849      6.691077 7.369777       4.825749 12.81920 6.286485 21.63629 7.501250 -8.817090      9.787167 
1 1 1 7   40 14 f 17.19622 6.637031 3.920314       3.940021 7.278997       7.010067 2.369344       4.763646 21.31763 8.649542 16.25611 6.903547 5.061516       11.06678 
1 1 1 7   40 15 o 20.61437 6.578311 6.608850       3.726884 7.556365       7.044706 6.240598       4.391798 21.25284 8.653223 19.93881 7.135057 1.314024       11.21549 
1 1 1 7   40 16 o 12.87108 5.669096 0.4001544      3.455809 7.464996       7.083362 -1.806740      3.958941 20.83089 8.600533 11.98908 5.580090 8.841817       10.25215 
1 1 1 7   40 17 o 14.07541 5.899162 1.822084       3.404996 -2.794347      6.567980 3.518834       3.981875 14.44816 6.865504 16.33295 6.557196 -1.884789      9.493785 
1 1 1 7   40 18 o 11.81312 5.372312 -0.5794503     3.383638 1.001096       7.181021 -1.030511      3.836191 16.45755 7.609693 12.15493 5.599352 4.302615       9.447761 
1 1 1 7   40 19 o 10.66357 4.999948 -1.867017      3.276068 2.739085       6.945241 -3.185166      3.715376 16.98825 7.714447 10.61806 5.078185 6.370185       9.235835 
1 1 1 7   40 20 o 25.60819 6.276831 10.62126       3.886117 18.59853       8.877264 8.730137       4.322270 26.89821 10.05929 22.21045 7.083941 4.687761       12.30331 
1 1 1 7   41 0  f 33.66915 5.820229 15.69730       4.602690 16.42919       8.200203 15.36067       5.561361 31.16099 9.733919 32.26264 7.250729 -1.101650      12.13764 
1 1 1 7   41 1  o 10.85851 5.142353 -3.462323      3.624606 -4.374160      7.168290 -3.149107      4.201262 15.54778 7.323165 12.07254 5.661075 3.475243       9.256161 
1 1 1 7   41 2  o 11.71552 5.292161 -1.044548      3.217282 -1.779549      4.654860 -0.3722816     4.451778 13.60254 6.229885 14.26176 6.349864 -0.6592178     8.895630 
1 1 1 7   41 3  o 58.71960 3.440581 43.93805       4.901670 50.18684       7.245238 38.66404       6.656179 61.44593 4.878662 53.63737 5.155819 7.808559       7.098155 
1 1 1 7   41 4  o 10.30398 4.843471 -2.642609      3.107691 -3.477756      4.064304 -1.467003      4.822096 11.60485 5.480680 13.98874 6.381678 -2.383890      8.412114 
1 1 1 7   41 5  o 15.93654 6.078723 2.950229       3.278578 6.254766       5.700294 1.316664       4.007838 21.05468 8.019045 14.96269 6.342336 6.091985       10.22401 
1 1 1 7   41 6  o 20.67279 5.862020 6.111636       3.088408 9.045185       4.825256 4.075891       4.019623 24.25309 7.448694 17.86165 6.749820 6.391443       10.05202 
1 1 1 7   41 7  o 14.11440 5.640874 1.884091       2.932987 2.953252       4.268707 0.9279688      4.036747 16.74910 6.766347 14.56590 6.273940 2.183197       9.227448 
1 1 1 7   41 8  o 13.35390 5.494711 1.361873       2.878157 2.356323       4.233423 0.5071591      3.924738 16.04515 6.639086 13.99391 6.105719 2.051238       9.019827 
1 1 1 7   41 9  o 11.97641 5.278768 -0.8877594E-01 3.001273 2.469612       4.211496 -2.728812      4.278171 16.05292 6.630132 12.21222 5.722114 3.840693       8.757924 
1 1 1 7   41 10 o 28.71535 5.792600 11.91228       3.913443 13.27606       4.685311 8.765386       7.117182 29.62901 6.652457 22.80569 8.887547 6.823322       11.10152 
1 1 1 7   41 11 o 24.24215 8.034617 9.945020       5.531508 19.29957       8.315775 2.521077       7.408129 31.64551 9.789025 18.30916 8.169043 13.33635       12.74983 
1 1 1 7   41 12 o 13.82600 5.925007 1.148001       3.565843 8.216956       7.039412 -1.291958      4.135710 21.86081 8.738216 12.69338 5.835170 9.167427       10.50741 
1 1 1 7   41 13 o 12.46430 5.572621 -0.1436036     3.466017 1.318944       6.749861 -0.6673405     4.039209 16.82581 7.626591 12.89419 5.866206 3.931616       9.621708 
1 1 1 7   41 14 o 18.64831 6.617959 5.396302       3.770724 14.31255       8.330275 3.098629       4.228754 25.70733 9.716423 16.14719 6.653853 9.560146       11.77636 
1 1 1 7   41 15 o 11.27707 5.234939 -1.547965      3.449039 2.727527       7.163431 -2.838228      3.935203 17.50302 7.902545 11.26960 5.343234 6.233420       9.539412 
1 1 1 7   41 16 o 23.48765 6.439371 8.905793       3.795108 16.65375       8.239317 6.819306       4.275682 27.02814 9.760221 20.09999 7.054728 6.928148       12.04289 
1 1 1 7   41 17 o 17.14992 6.546360 4.519201       3.804218 8.061722       8.324799 3.584176       4.276902 20.30598 8.875404 16.28693 6.699474 4.019049       11.12006 
1 1 1 7   42 0  o 17.73475 6.284049 4.289591       3.398680 8.007123       4.891673 0.8202699      4.725550 22.74895 7.556182 15.30402 6.688083 7.444934       10.09090 
1 1 1 7   42 1  o 31.59306 4.660810 13.47766       3.480664 18.33403       5.310527 9.820288       4.608574 35.56560 6.360852 25.26561 7.159632 10.29999       9.577096 
1 1 1 7   42 2  o 33.73499 4.403013 15.20687       3.533353 28.59649       5.706576 6.882153       4.499624 45.64207 5.224720 21.31787 7.248360 24.32419       8.935122 
1 1 1 7   42 3  o 27.59538 5.123854 10.57398       3.318816 7.943038       4.772409 13.03786       4.618408 22.56474 7.462396 29.61384 6.571477 -7.049095      9.943423 
1 1 1 7   42 4  o 12.86687 5.417792 0.9571109      2.892881 -1.709561      4.007414 3.858930       4.180369 12.40991 5.719023 17.48477 6.812111 -5.074862      8.894497 
1 1 1 7   42 5  o 16.70543 5.981812 3.775965       3.087350 2.513375       4.353783 5.053029       4.378667 16.18051 6.717310 18.88058 7.063986 -2.700069      9.747931 
1 1 1 7   42 6  o 11.56695 5.253430 -0.9665211     3.222355 -5.083157      4.086412 5.802134       5.239890 10.65036 5.152071 19.85792 7.656700 -9.207564      9.228699 
1 1 1 7   42 7  o 34.80728 6.626711 18.26573       5.415628 20.30629       7.305291 15.77605       8.069284 34.23494 8.730571 28.51438 9.706463 5.720564       13.05520 
1 1 1 7   42 8  o 13.93605 5.828074 1.542944       3.312505 0.3373343      4.481022 2.995561       4.918687 14.30973 6.370986 16.85755 7.079284 -2.547819      9.523955 
1 1 1 7   42 9  o 34.78372 4.298192 16.39839       3.565896 15.69305       5.451834 16.92575       4.714102 31.20844 7.299420 33.91466 5.919153 -2.706221      9.397760 
1 1 1 7   42 10 o 28.17348 6.126779 12.00995       4.086287 32.44736       9.214348 7.006630       4.559116 42.13017 9.230713 20.71392 7.283645 21.41625       11.75830 
1 1 1 7   42 11 o 11.30207 5.282175 -2.005702      3.607087 7.193898       6.703036 -5.755644      4.279562 20.56451 8.415021 10.50283 5.124216 10.06168       9.852419 
1 1 1 7   42 12 o 22.65828 7.177581 8.649236       4.443645 9.565636       8.097751 8.254381       5.315454 22.01773 9.152556 21.62148 7.835083 0.3962440      12.04815 
1 1 1 7   42 13 o 13.38113 5.986876 0.3120306      4.008265 -2.954811      7.575183 1.582342       4.723720 15.16372 7.251890 15.08063 6.635667 0.8308887E-01  9.829649 
1 1 1 7   42 14 o 15.28683 6.567378 2.296462       4.401346 0.3448902      8.061089 3.125361       5.253545 16.63068 7.812142 16.51885 7.136463 0.1118221      10.58105 
1 1 1 7   42 15 o 15.59367 6.642195 2.714900       4.432828 8.537198       9.058225 0.8814816      5.083076 20.58125 9.116441 14.73429 6.654259 5.846959       11.28666 
1 1 1 7   43 0  o 19.27597 6.132327 5.524768       3.240688 9.235072       4.707157 2.181571       4.468223 23.88232 7.360979 15.83257 6.703243 8.049745       9.955776 
1 1 1 7   43 1  o 16.38334 6.077209 3.598203       3.227290 4.618614       4.792418 2.751478       4.365544 18.33957 7.248973 16.23912 6.732665 2.100452       9.893250 
1 1 1 7   43 2  o 10.65094 4.903795 -1.382849      2.936568 -0.3620313     4.253446 -2.312571      4.059227 13.51756 6.097535 11.96842 5.596819 1.549146       8.276733 
1 1 1 7   43 3  o 17.93237 6.032881 4.713561       3.116757 1.632478       4.478747 7.606761       4.340044 15.28167 6.595549 21.77641 7.111957 -6.494738      9.699547 
1 1 1 7   43 4  o 9.069185 4.397862 -4.141911      3.024166 -10.46227      3.801752 6.748487       4.990393 8.213731 4.137077 20.48470 7.564607 -12.27097      8.621988 
1 1 1 7   43 5  o 23.11580 6.274797 8.225174       3.624490 5.936162       4.896931 10.99844       5.390091 19.52840 7.433764 25.24056 7.892837 -5.712166      10.84240 
1 1 1 7   43 6  o 29.41787 4.938219 12.19940       3.414800 19.52985       5.320204 7.063566       4.453162 35.95225 6.302103 20.82490 7.206580 15.12735       9.573469 
1 1 1 7   43 7  o 10.38074 4.835462 -1.755362      2.982436 -2.680935      4.327244 -0.9178441     4.116265 12.03253 5.674302 12.79439 5.859244 -0.7618580     8.156497 
1 1 1 7   43 8  o 11.13903 5.144588 -1.384385      3.268377 2.678167       5.744429 -3.329044      3.974377 16.82426 7.362688 11.12353 5.301201 5.700726       9.072591 
1 1 1 7   43 9  o 18.94123 6.464578 5.640643       3.579642 5.908081       4.693388 5.268721       5.534784 19.14561 7.280100 18.63439 7.638361 0.5112152      10.55199 
1 1 1 7   43 10 o 17.86053 7.031798 4.825494       4.493614 3.120917       7.988202 5.614598       5.435104 18.02323 8.218964 18.80693 7.621518 -0.7836971     11.20888 
1 1 1 7   43 11 o 17.05377 6.618510 4.291385       3.934217 2.012579       8.158566 4.981844       4.490857 17.46611 8.088326 17.94456 7.040271 -0.4784489     10.72317 
1 1 1 7   44 0  o 13.55379 6.081770 0.5555492E-01  4.169116 7.857959       7.245437 -3.806566      5.097571 21.18214 8.717163 12.53339 5.981602 8.648749       10.57206 
1 1 1 7   44 1  o 14.64616 6.135433 2.000473       3.680521 2.183049       5.022173 1.788652       5.409462 16.00272 6.945326 16.02473 7.074014 -0.2200699E-01 9.913588 
1 1 1 7   44 2  o 23.19791 6.200207 8.347087       3.572207 13.52137       5.330230 4.128280       4.813000 28.23090 7.586357 17.48982 7.140621 10.74109       10.41831 
1 1 1 7   44 3  o 12.13126 5.363899 0.1550163      3.122193 10.23695       4.706985 -7.765884      4.172134 24.63207 7.312516 9.578103 4.746753 15.05397       8.718059 
1 1 1 7   44 4  o 22.03047 5.980119 7.475749       3.292077 5.505550       4.780137 9.253362       4.540502 18.76144 7.291485 23.41337 7.231785 -4.651930      10.26959 
1 1 1 7   44 5  o 12.84892 5.471136 1.099942       3.005700 3.032771       4.337229 -0.6859891     4.169155 16.07545 6.691675 12.92673 5.911148 3.148726       8.928616 
1 1 1 7   44 6  o 13.78685 5.754690 1.752233       3.220453 2.767127       5.029578 1.047002       4.192629 16.27156 7.005802 14.19226 6.247899 2.079298       9.387093 
1 1 1 8   0  0  o 506.5832 10.44733 3135.777       128.8473 3135.777       128.8473 3135.777       128.8473 506.5832 10.44733 506.5832 10.44733 0.000000       0.000000 
1 1 1 8   0  1  o 290.5959 5.176668 1030.296       36.63238 1030.296       36.63238 1030.296       36.63238 290.5959 5.176668 290.5959 5.176668 0.000000       0.000000 
1 1 1 8   0  2  o 595.8480 9.949433 4335.240       144.3766 4335.240       144.3766 4335.240       144.3766 595.8480 9.949433 595.8480 9.949433 0.000000       0.000000 
1 1 1 8   0  3  o 537.8022 9.029693 3530.661       118.2648 3530.661       118.2648 3530.661       118.2648 537.8022 9.029693 537.8022 9.029693 0.000000       0.000000 
1 1 1 8   0  4  o 56.06915 4.980039 39.21406       6.675269 39.21406       6.675269 39.21406       6.675269 56.06915 4.980039 56.06915 4.980039 0.000000       0.000000 
1 1 1 8   0  5  o 68.67744 3.469293 57.91497       5.772212 57.91497       5.772212 57.91497       5.772212 68.67744 3.469293 68.67744 3.469293 0.000000       0.000000 
1 1 1 8   0  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 8   0  7  o 274.2987 6.122103 918.4215       40.87633 918.4215       40.87633 918.4215       40.87633 274.2987 6.122103 274.2987 6.122103 0.000000       0.000000 
1 1 1 8   0  8  o 246.5056 7.978013 743.0979       47.81069 743.0979       47.81069 743.0979       47.81069 246.5056 7.978013 246.5056 7.978013 0.000000       0.000000 
1 1 1 8   0  9  o 293.2793 6.475567 1049.906       46.22928 1049.906       46.22928 1049.906       46.22928 293.2793 6.475567 293.2793 6.475567 0.000000       0.000000 
1 1 1 8   0  10 o 152.6685 4.232386 284.6878       15.71866 284.6878       15.71866 284.6878       15.71866 152.6685 4.232386 152.6685 4.232386 0.000000       0.000000 
1 1 1 8   0  11 o 175.2662 4.563116 375.1142       19.45943 375.1142       19.45943 375.1142       19.45943 175.2662 4.563116 175.2662 4.563116 0.000000       0.000000 
1 1 1 8   0  12 o 165.3461 4.446673 333.8993       17.88770 333.8993       17.88770 333.8993       17.88770 165.3461 4.446673 165.3461 4.446673 0.000000       0.000000 
1 1 1 8   0  13 o 321.9735 7.051583 1265.591       55.26783 1265.591       55.26783 1265.591       55.26783 321.9735 7.051583 321.9735 7.051583 0.000000       0.000000 
1 1 1 8   0  14 o 377.5863 8.087618 1740.858       74.34008 1740.858       74.34008 1740.858       74.34008 377.5863 8.087618 377.5863 8.087618 0.000000       0.000000 
1 1 1 8   0  15 o 117.5106 5.815144 169.5598       16.55884 169.5598       16.55884 169.5598       16.55884 117.5106 5.815144 117.5106 5.815144 0.000000       0.000000 
1 1 1 8   0  16 o 491.3798 14.56437 2959.532       174.0525 2959.532       174.0525 2959.532       174.0525 491.3798 14.56437 491.3798 14.56437 0.000000       0.000000 
1 1 1 8   0  17 o 593.0712 12.24889 4303.658       176.8566 4303.658       176.8566 4303.658       176.8566 593.0712 12.24889 593.0712 12.24889 0.000000       0.000000 
1 1 1 8   0  18 f 28.48965 9.052438 12.48773       5.530311 12.48773       5.530311 12.48773       5.530311 28.48965 9.052438 28.48965 9.052438 0.000000       0.000000 
1 1 1 8   0  19 o 237.7049 5.709704 690.3501       33.03099 690.3501       33.03099 690.3501       33.03099 237.7049 5.709704 237.7049 5.709704 0.000000       0.000000 
1 1 1 8   0  20 o 340.8521 7.493476 1420.708       62.17437 1420.708       62.17437 1420.708       62.17437 340.8521 7.493476 340.8521 7.493476 0.000000       0.000000 
1 1 1 8   0  21 o 241.5843 5.798741 713.4971       34.09361 713.4971       34.09361 713.4971       34.09361 241.5843 5.798741 241.5843 5.798741 0.000000       0.000000 
1 1 1 8   0  22 o 227.6936 5.594666 633.9868       31.00047 633.9868       31.00047 633.9868       31.00047 227.6936 5.594666 227.6936 5.594666 0.000000       0.000000 
1 1 1 8   0  23 o 252.5062 5.997554 780.0712       36.85773 780.0712       36.85773 780.0712       36.85773 252.5062 5.997554 252.5062 5.997554 0.000000       0.000000 
1 1 1 8   0  24 o 39.55178 9.752587 22.30377       8.137626 22.30377       8.137626 22.30377       8.137626 39.55178 9.752587 39.55178 9.752587 0.000000       0.000000 
1 1 1 8   0  25 o 99.46407 4.350106 121.4291       10.49791 121.4291       10.49791 121.4291       10.49791 99.46407 4.350106 99.46407 4.350106 0.000000       0.000000 
1 1 1 8   0  26 o 72.14413 4.701908 64.35900       8.184650 64.35900       8.184650 64.35900       8.184650 72.14413 4.701908 72.14413 4.701908 0.000000       0.000000 
1 1 1 8   0  27 o 15.84152 9.051344 3.969472       5.499004 3.969472       5.499004 3.969472       5.499004 15.84152 9.051344 15.84152 9.051344 0.000000       0.000000 
1 1 1 8   0  28 o 157.3661 4.817308 303.4773       18.43439 303.4773       18.43439 303.4773       18.43439 157.3661 4.817308 157.3661 4.817308 0.000000       0.000000 
1 1 1 8   0  29 o 72.22700 7.163481 65.86785       12.30292 65.86785       12.30292 65.86785       12.30292 72.22700 7.163481 72.22700 7.163481 0.000000       0.000000 
1 1 1 8   0  30 o 142.5157 4.755989 249.2107       16.47559 249.2107       16.47559 249.2107       16.47559 142.5157 4.755989 142.5157 4.755989 0.000000       0.000000 
1 1 1 8   0  31 o 141.4446 4.791993 245.6558       16.47426 245.6558       16.47426 245.6558       16.47426 141.4446 4.791993 141.4446 4.791993 0.000000       0.000000 
1 1 1 8   0  32 o 180.6644 5.167516 400.9967       22.70837 400.9967       22.70837 400.9967       22.70837 180.6644 5.167516 180.6644 5.167516 0.000000       0.000000 
1 1 1 8   0  33 o 100.8548 4.766134 125.4868       11.65401 125.4868       11.65401 125.4868       11.65401 100.8548 4.766134 100.8548 4.766134 0.000000       0.000000 
1 1 1 8   0  34 o 33.86100 9.514497 17.19575       6.795225 17.19575       6.795225 17.19575       6.795225 33.86100 9.514497 33.86100 9.514497 0.000000       0.000000 
1 1 1 8   0  35 o 73.11900 5.321027 66.89912       9.363363 66.89912       9.363363 66.89912       9.363363 73.11900 5.321027 73.11900 5.321027 0.000000       0.000000 
1 1 1 8   0  36 o 58.07104 8.403242 44.94209       11.16763 44.94209       11.16763 44.94209       11.16763 58.07104 8.403242 58.07104 8.403242 0.000000       0.000000 
1 1 1 8   0  37 o 98.28249 4.898808 120.5054       11.66602 120.5054       11.66602 120.5054       11.66602 98.28249 4.898808 98.28249 4.898808 0.000000       0.000000 
1 1 1 8   0  38 o 26.77165 10.43896 12.75314       6.496738 12.75314       6.496738 12.75314       6.496738 26.77165 10.43896 26.77165 10.43896 0.000000       0.000000 
1 1 1 8   0  39 o 16.01489 9.256528 4.686213       5.849929 4.686213       5.849929 4.686213       5.849929 16.01489 9.256528 16.01489 9.256528 0.000000       0.000000 
1 1 1 8   0  40 f 11.19102 7.848898 -6.585402      8.125282 -6.585402      8.125282 -6.585402      8.125282 11.19102 7.848898 11.19102 7.848898 0.000000       0.000000 
1 1 1 8   0  41 o 72.02388 5.165855 67.63105       8.957526 67.63105       8.957526 67.63105       8.957526 72.02388 5.165855 72.02388 5.165855 0.000000       0.000000 
1 1 1 8   0  42 o 35.83987 8.553183 20.45274       6.481547 20.45274       6.481547 20.45274       6.481547 35.83987 8.553183 35.83987 8.553183 0.000000       0.000000 
1 1 1 8   0  43 o 8.051908 5.705506 -4.569264      4.659575 -4.569264      4.659575 -4.569264      4.659575 8.051908 5.705506 8.051908 5.705506 0.000000       0.000000 
1 1 1 8   0  44 o 16.23683 10.16190 7.551462       8.284615 7.551462       8.284615 7.551462       8.284615 16.23683 10.16190 16.23683 10.16190 0.000000       0.000000 
1 1 1 8   0  45 o 21.44504 9.771059 11.35409       5.538146 11.35409       5.538146 11.35409       5.538146 21.44504 9.771059 21.44504 9.771059 0.000000       0.000000 
1 1 1 8   0  46 o 10.56884 7.184358 0.8034397      5.613572 0.8034397      5.613572 0.8034397      5.613572 10.56884 7.184358 10.56884 7.184358 0.000000       0.000000 
1 1 1 8   0  47 o 11.45133 7.483454 3.131322       5.135656 3.131322       5.135656 3.131322       5.135656 11.45133 7.483454 11.45133 7.483454 0.000000       0.000000 
1 1 1 8   1  0  o 802.0368 13.29423 7877.640       259.8326 0.000000       0.000000 7877.640       259.8326 ?        ?        802.0368 13.29423 0.000000       13.29423 
1 1 1 8   1  1  o 383.8807 5.708370 1797.191       53.40040 1789.283       75.36317 1805.166       75.67694 382.8605 8.077601 384.5563 8.075465 -1.695740      11.42194 
1 1 1 8   1  2  o 137.9732 2.716386 231.9959       9.133186 214.7094       12.55768 251.4084       13.30746 132.6629 3.888595 143.5659 3.807075 -10.90297      5.441966 
1 1 1 8   1  3  o 717.2291 8.407104 6278.768       146.9401 6203.112       206.0458 6357.063       209.6095 712.2825 11.87068 721.0548 11.92907 -8.772339      16.82901 
1 1 1 8   1  4  o 144.9799 2.778847 256.1517       9.817668 258.3826       13.96352 253.9707       13.80637 145.5437 3.940624 144.2953 3.930030 1.248398       5.565398 
1 1 1 8   1  5  o 64.29906 2.342045 50.44750       3.663614 44.46893       5.047662 57.10304       5.325783 60.30646 3.449096 68.37614 3.205185 -8.069683      4.708447 
1 1 1 8   1  6  o 87.53163 2.176576 93.36295       4.642747 82.82786       7.037565 101.4812       6.177802 82.36457 3.514352 91.21293 2.782593 -8.848358      4.482577 
1 1 1 8   1  7  o 508.6528 8.572647 3156.433       106.2607 3185.812       185.2670 3142.031       129.7178 510.1472 14.91877 507.3318 10.49232 2.815430       18.23893 
1 1 1 8   1  8  o 210.7356 4.112210 541.2552       21.11783 551.8907       26.06476 520.9345       36.02835 212.7814 5.026711 206.5595 7.168393 6.221893       8.755209 
1 1 1 8   1  9  o 616.1982 10.29996 4634.404       154.6651 4547.672       186.9655 4822.420       275.2780 610.1479 12.57448 627.2075 18.02914 -17.05957      21.98107 
1 1 1 8   1  10 o 391.9766 6.774947 1873.523       64.71458 1921.366       80.48219 1786.003       108.8531 396.8727 8.321708 382.2443 11.69971 14.62845       14.35737 
1 1 1 8   1  11 o 539.1530 7.858871 3545.714       103.2543 3636.463       148.4794 3460.729       143.6859 545.7062 11.16532 532.3665 11.07560 13.33972       15.72683 
1 1 1 8   1  12 o 293.5261 4.603934 1050.207       32.93153 1024.741       45.86124 1077.316       47.31733 289.8876 6.492023 297.2296 6.532691 -7.341949      9.209908 
1 1 1 8   1  13 o 101.5559 2.759227 125.7783       6.822228 130.2015       9.706836 121.4606       9.590393 103.2843 3.863434 99.74789 3.953280 3.536400       5.527617 
1 1 1 8   1  14 o 486.4748 8.263811 2888.127       97.96632 2876.689       119.6783 2911.355       170.5566 485.3184 10.11935 487.4361 14.37439 -2.117706      17.57909 
1 1 1 8   1  15 o 324.4102 5.026311 1283.182       39.73562 1305.554       56.75894 1261.678       55.64686 327.1149 7.120293 321.5724 7.101104 5.542542       10.05606 
1 1 1 8   1  16 o 637.9968 9.253798 4973.041       143.8715 4939.034       202.5085 5007.698       204.4351 634.9514 13.08780 639.3409 13.12160 -4.389526      18.53286 
1 1 1 8   1  17 o 225.6785 4.459360 621.0475       24.52442 657.1190       43.79290 604.5665       29.60147 231.8276 7.762746 222.6208 5.456468 9.206848       9.488586 
1 1 1 8   1  18 o 228.1372 3.915520 634.6417       21.76815 616.8475       30.17817 653.9422       31.42958 224.8325 5.508049 231.4900 5.571476 -6.657516      7.834535 
1 1 1 8   1  19 o 307.3289 4.856074 1152.526       36.36845 1133.668       50.81744 1172.325       52.07098 304.5835 6.846526 309.7262 6.898930 -5.142639      9.719576 
1 1 1 8   1  20 o 58.17921 3.464257 41.42653       4.889259 39.50806       6.812491 43.46431       7.021141 56.67087 4.983698 59.47146 4.887753 -2.800587      6.980500 
1 1 1 8   1  21 o 294.6991 4.716660 1060.468       33.87267 1051.815       47.70113 1069.268       48.10783 293.1784 6.676679 295.6005 6.678431 -2.422089      9.443489 
1 1 1 8   1  22 o 65.88052 3.232729 53.07504       5.174093 50.53619       7.304563 55.63164       7.330050 64.14788 4.705525 67.34264 4.492326 -3.194763      6.505610 
1 1 1 8   1  23 o 198.4362 4.198021 480.9331       20.30027 450.1950       33.62282 498.5658       25.46565 191.4106 7.221234 201.8496 5.181434 -10.43896      8.887828 
1 1 1 8   1  24 o 16.27315 6.354089 1.948503       3.643594 2.705272       5.257403 1.249092       5.054239 19.41654 7.617558 17.75365 7.290706 1.662891       10.54427 
1 1 1 8   1  25 o 13.19271 5.987223 -2.485187      4.175585 -3.288800      5.119227 -0.8877102     7.217684 14.44664 6.584716 19.29437 8.350195 -4.847727      10.63411 
1 1 1 8   1  26 o 172.5833 3.460928 363.7833       14.55551 381.7885       20.97059 347.0452       20.21917 176.5281 4.879526 168.2872 4.935663 8.240845       6.940500 
1 1 1 8   1  27 o 139.6656 3.257044 238.2498       11.08534 225.5466       15.28746 252.3358       16.09801 135.6464 4.631571 143.4888 4.609799 -7.842361      6.534654 
1 1 1 8   1  28 o 120.4618 3.692546 177.5926       10.82676 176.0571       13.16937 180.7944       19.01704 119.8080 4.518788 120.9957 6.473222 -1.187675      7.894432 
1 1 1 8   1  29 o 117.6332 3.195839 169.2265       9.152683 169.8256       12.94447 168.6275       12.94323 117.6246 4.524396 117.2053 4.540266 0.4192886      6.409694 
1 1 1 8   1  30 o 69.21358 4.142843 58.90424       6.955586 51.88667       11.76523 62.67490       8.624132 64.21263 7.670230 71.25886 4.998081 -7.046227      9.154958 
1 1 1 8   1  31 o 59.40308 3.916200 43.42862       5.637421 53.17463       8.113501 34.33176       7.838637 65.54444 5.120285 52.33844 6.270544 13.20600       8.095494 
1 1 1 8   1  32 o 20.36101 7.160336 4.585859       4.406141 0.2275359E-01  6.179566 9.304801       6.284200 18.27868 7.815739 27.25158 8.522464 -8.972906      11.56366 
1 1 1 8   1  33 o 126.4678 3.370529 196.1671       10.37832 190.2597       14.45439 202.4532       14.91055 124.1334 4.787293 128.0551 4.786583 -3.921722      6.769753 
1 1 1 8   1  34 o 60.76379 3.896222 45.60611       5.738919 56.02062       8.329901 36.19639       7.917880 67.05531 5.136765 53.52371 6.184135 13.53160       8.039271 
1 1 1 8   1  35 f 96.40404 3.922803 114.8350       9.196441 121.1981       15.67905 111.4977       11.35478 97.81205 6.616907 94.60542 4.942371 3.206635       8.258964 
1 1 1 8   1  36 o 109.4291 3.877674 148.4077       10.32412 144.2265       12.53614 157.2210       18.20045 107.3929 4.802329 110.7519 6.776081 -3.358971      8.305277 
1 1 1 8   1  37 o 38.83570 5.229151 19.37257       4.823144 27.35710       6.675020 10.64950       6.976902 45.86394 6.125356 27.98541 9.007729 17.87853       10.89308 
1 1 1 8   1  38 o 21.89350 6.944544 6.378128       4.158578 4.394906       5.651325 8.720254       6.141432 20.49049 7.937887 25.29170 8.468111 -4.801208      11.60685 
1 1 1 8   1  39 o 26.21560 7.366926 9.794835       4.900374 14.15826       5.992255 0.9847944      8.514626 31.25642 7.872535 20.17464 8.891788 11.08178       11.87606 
1 1 1 8   1  40 o 28.32967 6.314866 11.35386       4.248184 14.09542       5.912783 8.428627       6.107633 30.54556 7.888618 23.82572 8.425768 6.719833       11.54226 
1 1 1 8   1  41 o 24.30181 7.559079 9.255023       4.950881 15.75803       9.720819 6.977377       5.752926 28.48795 10.55090 21.53157 8.088410 6.956381       13.29451 
1 1 1 8   1  42 o 12.98145 5.830929 -0.2323221     3.843174 5.073445       5.599305 -4.958232      5.284486 18.87921 7.704132 12.34907 5.945116 6.530143       9.731293 
1 1 1 8   1  43 o 19.79764 6.758635 6.515017       3.912753 8.241236       5.777192 5.052196       5.318198 21.00603 8.055064 18.08424 7.457972 2.921791       10.97750 
1 1 1 8   1  44 o 12.34844 5.563988 0.2494752      3.530368 -1.295310      4.800549 2.068964       5.209927 12.80779 6.020219 15.13886 6.795392 -2.331079      9.078568 
1 1 1 8   1  45 o 16.62202 6.688960 5.100334       4.153903 4.558307       6.143868 5.556734       5.637725 16.22306 7.322178 16.85033 7.335441 -0.6272678     10.36451 
1 1 1 8   1  46 o 19.17274 6.977056 8.121162       4.221016 10.03501       5.067392 3.783701       7.628675 20.13081 7.584970 15.12959 7.246810 5.001218       10.49038 
1 1 1 8   1  47 o 15.87416 6.304884 5.402857       3.641817 7.488838       5.214033 3.415830       5.088861 16.71175 7.163215 13.98040 6.443453 2.731350       9.634819 
1 1 1 8   2  0  o 543.8834 7.893942 3610.589       104.6251 3796.887       216.8474 3554.061       119.4479 555.9981 16.02131 539.4557 9.086289 16.54236       18.41855 
1 1 1 8   2  1  o 485.0652 6.332470 2869.987       74.85303 2877.169       118.5110 2865.220       96.54915 485.2740 10.02156 484.4859 8.177701 0.7881165      12.93470 
1 1 1 8   2  2  o 150.8502 2.144475 277.2993       7.883206 279.7817       10.41490 273.9693       12.06284 151.5173 2.820698 149.9296 3.301612 1.587769       4.342463 
1 1 1 8   2  3  o 298.9773 5.293904 1089.864       38.57006 1060.828       65.26859 1105.445       47.81139 294.6359 9.101304 301.0551 6.517025 -6.419189      11.19399 
1 1 1 8   2  4  o 495.6078 5.905709 2995.121       71.32574 3166.080       104.5218 2846.128       97.57572 509.3552 8.420737 482.9446 8.291027 26.41055       11.81736 
1 1 1 8   2  5  o 418.2992 5.048466 2133.050       51.46151 2168.367       73.54755 2099.174       72.03126 421.6396 7.157985 414.8598 7.124979 6.779816       10.09961 
1 1 1 8   2  6  o 438.6844 5.782157 2346.259       61.81276 2288.433       96.04329 2387.148       80.76213 433.0493 9.101094 442.3987 7.491311 -9.349426      11.78769 
1 1 1 8   2  7  f 223.8740 3.295802 610.7919       17.98047 614.1208       23.29278 605.8834       28.28435 224.4695 4.258218 222.9421 5.206166 1.527420       6.725814 
1 1 1 8   2  8  o 303.1733 4.683963 1120.322       34.60513 1138.758       49.42423 1102.592       48.46786 305.6028 6.636612 300.7116 6.614052 4.891235       9.369648 
1 1 1 8   2  9  o 1038.413 14.82434 13185.41       375.1300 13241.85       532.2180 13129.68       528.8260 1038.767 21.02496 1034.374 20.97969 4.393188       29.70179 
1 1 1 8   2  10 o 320.8471 4.931203 1254.815       38.55556 1254.345       54.51444 1255.286       54.53717 320.7214 6.975053 320.8417 6.975345 -0.1203003     9.864421 
1 1 1 8   2  11 o 512.5082 8.664027 3204.706       108.2073 3133.637       130.4251 3361.657       193.8221 506.6288 10.56416 523.9647 15.19582 -17.33588      18.50714 
1 1 1 8   2  12 o 84.14390 3.784571 86.46650       7.740383 86.46650       7.740383 0.000000       0.000000 84.14390 3.784571 ?        ?        0.000000       3.784571 
1 1 1 8   2  13 o 268.4988 4.954064 878.8495       32.41456 873.1590       39.61982 890.3692       56.37127 267.5934 6.075765 269.9783 8.579154 -2.384857      10.51270 
1 1 1 8   2  14 o 165.1739 3.188021 332.5009       12.83213 349.6360       18.45626 316.4668       17.85348 169.2976 4.477528 161.0578 4.553456 8.239838       6.386095 
1 1 1 8   2  15 o 303.5189 4.761191 1123.168       35.21579 1101.468       49.15912 1146.042       50.47212 300.4811 6.713528 306.4984 6.757519 -6.017212      9.525519 
1 1 1 8   2  16 o 511.4152 7.515047 3192.612       93.65725 3144.295       131.0479 3243.056       133.9008 507.0723 10.60533 514.9627 10.67017 -7.890411      15.04412 
1 1 1 8   2  17 o 162.7778 3.228316 322.9819       12.80582 325.0122       18.06895 320.9331       18.15166 163.1919 4.548016 162.1609 4.598041 1.031006       6.467336 
1 1 1 8   2  18 o 151.9646 3.680821 281.5722       13.63086 296.2879       24.18835 274.7244       16.50035 155.6471 6.390779 150.0114 4.518851 5.635696       7.827009 
1 1 1 8   2  19 o 396.1000 6.001234 1916.062       57.92706 1880.050       80.65375 1954.429       83.25043 391.9214 8.444801 399.5763 8.549696 -7.654877      12.01715 
1 1 1 8   2  20 o 230.6871 3.953355 649.2158       22.22415 637.8148       31.06860 661.1627       31.80368 228.5127 5.579243 232.6545 5.609573 -4.141785      7.911716 
1 1 1 8   2  21 o 390.4998 5.942488 1864.464       56.54903 1854.045       79.64021 1875.058       80.30881 388.7338 8.407056 390.9231 8.430159 -2.189301      11.90572 
1 1 1 8   2  22 o 117.7281 3.467015 169.2613       9.935702 180.2603       17.03895 163.5945       12.23024 121.2561 5.783043 115.6625 4.346901 5.593613       7.234579 
1 1 1 8   2  23 o 122.0525 3.063283 181.8565       9.103880 171.3986       12.52345 193.5763       13.25755 118.3721 4.348881 125.8090 4.330753 -7.436943      6.137442 
1 1 1 8   2  24 o 71.00345 3.242164 61.65499       5.595037 62.10872       7.776656 61.16811       8.055883 71.14302 4.508838 70.57705 4.710937 0.5659714      6.520931 
1 1 1 8   2  25 o 138.5533 3.182761 234.3223       10.74625 222.5203       14.92299 247.0344       15.48772 134.8181 4.548771 142.0682 4.479170 -7.250092      6.383908 
1 1 1 8   2  26 o 212.3206 4.430219 551.4460       22.92204 551.7842       28.04144 550.7648       39.79372 212.1081 5.429554 211.2000 7.744989 0.9081726      9.458590 
1 1 1 8   2  27 o 170.0272 3.971989 353.5151       16.45745 352.8011       20.10235 354.9666       28.65921 169.6337 4.867973 169.6110 6.948556 0.2261353E-01  8.484078 
1 1 1 8   2  28 o 47.67223 4.252855 28.03784       4.888804 25.03603       6.712585 31.42867       7.134297 44.66707 6.345202 50.21914 5.944845 -5.552074      8.694985 
1 1 1 8   2  29 o 85.13410 3.303599 88.72368       6.840721 92.11620       9.746560 85.43001       9.603505 86.55621 4.637731 83.32794 4.749031 3.228271       6.637909 
1 1 1 8   2  30 o 154.5327 3.406393 292.0840       12.82778 276.2264       17.72487 309.5243       18.58835 149.9070 4.858464 158.7071 4.811829 -8.800125      6.838010 
1 1 1 8   2  31 o 133.9828 3.891309 220.1696       12.69172 207.8676       21.53896 226.7128       15.70845 129.2896 6.860924 135.7425 4.756122 -6.452911      8.348232 
1 1 1 8   2  32 o 66.78190 3.715335 54.83862       6.022511 51.81498       8.322147 58.16319       8.726462 64.59401 5.334487 68.47578 5.270073 -3.881775      7.498694 
1 1 1 8   2  33 o 20.73852 7.202784 4.887352       4.450289 7.199008       6.404091 2.728544       6.188750 24.91054 8.641055 20.38815 8.178376 4.522385       11.89763 
1 1 1 8   2  34 o 21.76100 7.679195 5.347368       5.071091 3.285129       8.561768 6.461778       6.293852 23.33823 9.525525 23.95417 8.544930 -0.6159439     12.79654 
1 1 1 8   2  35 o 48.44728 4.518704 29.31582       5.273290 27.73000       7.285340 31.06098       7.642598 46.46398 6.621374 49.25418 6.527972 -2.790203      9.298226 
1 1 1 8   2  36 o 41.78951 4.907460 22.10195       4.902459 17.96131       6.522716 27.47783       7.432229 36.70550 7.544562 45.92049 6.850936 -9.214996      10.19096 
1 1 1 8   2  37 o 27.13435 7.247843 9.969305       4.883238 11.91310       5.854735 5.526034       8.851833 29.45930 7.965788 24.35101 9.776511 5.108297       12.61087 
1 1 1 8   2  38 o 30.38743 6.485773 12.51098       4.656475 19.09677       6.564590 5.841625       6.606105 37.17913 7.504519 22.55913 8.622808 14.62000       11.43113 
1 1 1 8   2  39 o 29.52165 7.209196 12.37727       5.140780 14.86612       6.160143 6.667565       9.330362 31.97718 7.941396 24.20276 9.918762 7.774414       12.70620 
1 1 1 8   2  40 o 21.00975 7.547377 6.105823       4.919205 3.866175       8.029293 7.451614       6.224094 20.83179 8.908257 22.80742 8.443416 -1.975634      12.27389 
1 1 1 8   2  41 o 26.87824 6.639750 10.78570       4.323187 7.477626       5.852140 14.75981       6.414274 22.01748 8.180465 29.88849 8.438708 -7.871014      11.75295 
1 1 1 8   2  42 o 21.58950 6.946934 7.485031       4.149932 0.1719019      5.695998 15.75874       6.058546 15.36783 6.981626 30.27171 8.067305 -14.90388      10.66886 
1 1 1 8   2  43 o 16.27606 6.281729 3.816559       3.529404 2.426004       4.945289 5.260133       5.038684 15.74965 6.863046 18.20147 7.351943 -2.451819      10.05746 
1 1 1 8   2  44 o 17.78092 6.775945 5.470719       4.071404 10.17017       6.877228 2.934917       5.051816 21.09117 8.563691 15.63135 6.870666 5.459821       10.97920 
1 1 1 8   2  45 o 16.27299 6.262613 4.683677       3.500808 5.176427       4.720087 4.081199       5.219241 16.58908 6.948631 15.74938 6.950662 0.8396988      9.828285 
1 1 1 8   2  46 o 14.08343 5.989587 3.236557       3.594815 1.487563       4.942586 5.200819       5.237930 13.35061 6.220866 15.72565 6.950616 -2.375040      9.327929 
1 1 1 8   2  47 o 10.60363 5.088078 -1.387317      3.798319 0.6456603      4.849472 -4.613914      6.109427 12.41761 5.900259 11.34854 5.644448 1.069075       8.165344 
1 1 1 8   3  0  o 329.4086 4.459202 1322.843       35.79548 1388.038       58.25283 1283.292       45.37226 337.2906 7.087233 324.3898 5.739673 12.90079       9.119907 
1 1 1 8   3  1  o 30.69527 2.573678 11.56282       1.907428 15.10439       2.837501 8.643062       2.576386 35.04252 3.364076 26.30762 4.156684 8.734901       5.347432 
1 1 1 8   3  2  o 255.0182 3.295322 792.6165       20.47883 803.5592       29.08906 781.8637       28.83549 256.7390 4.649452 253.2487 4.672442 3.490250       6.591595 
1 1 1 8   3  3  o 285.9904 3.616770 996.8687       25.20625 975.8994       35.02992 1019.384       36.29794 282.9255 5.080786 289.1578 5.151231 -6.232269      7.235301 
1 1 1 8   3  4  f 330.3234 4.090307 1329.953       32.92542 1355.024       46.95018 1305.691       46.18636 333.3643 5.779392 327.2390 5.791786 6.125214       8.182063 
1 1 1 8   3  5  o 401.5010 6.912954 1965.967       67.63732 1979.478       117.4894 1959.269       82.71967 402.3316 11.99676 400.7247 8.470842 1.606873       14.68596 
1 1 1 8   3  6  o 578.3985 6.838640 4079.618       96.39023 4036.823       135.3999 4123.592       137.2517 575.1201 9.661038 581.2654 9.689626 -6.145325      13.68300 
1 1 1 8   3  7  o 916.2358 11.70197 10251.99       261.2777 10207.45       336.2590 10319.84       415.0664 913.5530 15.10442 917.6852 18.56042 -4.132141      23.92974 
1 1 1 8   3  8  f 719.6464 9.243609 6318.873       162.1052 6401.993       211.0528 6199.288       253.1488 724.0298 11.96186 712.0778 14.58856 11.95209       18.86563 
1 1 1 8   3  9  o 624.1039 9.017341 4752.189       137.1423 4689.313       192.1786 4817.436       195.7682 619.5555 12.72884 627.9539 12.79317 -8.398438      18.04684 
1 1 1 8   3  10 o 306.7515 5.462614 1147.095       40.83413 1139.221       49.93232 1162.992       70.95202 305.6578 6.703631 308.5706 9.446825 -2.912811      11.58366 
1 1 1 8   3  11 o 381.8538 6.607676 1778.047       61.48680 1758.323       74.90042 1818.806       107.6729 379.6549 8.095788 385.7306 11.46750 -6.075653      14.03728 
1 1 1 8   3  12 o 421.3293 6.272102 2164.628       64.39777 2204.408       91.94035 2126.315       90.22820 425.0193 8.876902 417.4236 8.870112 7.595642       12.54904 
1 1 1 8   3  13 f 642.2802 10.73962 5038.775       168.0930 5140.562       208.4382 4849.454       284.2696 648.3292 13.19307 628.2899 18.58711 20.03931       22.79337 
1 1 1 8   3  14 o 326.6496 5.046950 1300.880       40.17421 1276.295       56.00596 1326.938       57.65995 323.4507 7.105424 329.8017 7.174396 -6.350922      10.09748 
1 1 1 8   3  15 o 136.8146 2.989422 228.1282       9.966799 231.3968       14.03939 224.8072       14.15164 137.7111 4.188401 135.7298 4.283904 1.981339       5.991205 
1 1 1 8   3  16 o 542.7344 7.940660 3596.615       105.0220 3507.555       145.9604 3692.218       151.2266 535.4194 11.18677 549.3100 11.29730 -13.89063      15.89883 
1 1 1 8   3  17 o 296.9672 4.699427 1075.525       34.00866 1105.664       48.79290 1047.050       47.42720 300.9611 6.652887 292.8757 6.645200 8.085388       9.403169 
1 1 1 8   3  18 o 350.2419 5.381453 1496.932       45.93077 1486.949       64.60139 1507.137       65.31635 348.8089 7.600080 351.1642 7.632653 -2.355316      10.77119 
1 1 1 8   3  19 o 98.91382 3.452718 119.4501       8.309745 101.5870       14.26408 128.6269       10.22380 90.95620 6.477796 102.6076 4.097043 -11.65143      7.664698 
1 1 1 8   3  20 o 175.7978 3.401890 376.9138       14.57370 351.4666       19.80950 406.9365       21.51685 169.6133 4.797488 182.5133 4.842079 -12.89996      6.816276 
1 1 1 8   3  21 o 183.4725 3.979009 410.8089       17.79025 406.6532       29.89101 413.0884       22.13820 182.1475 6.745779 183.8350 4.946213 -1.687515      8.364841 
1 1 1 8   3  22 o 273.7127 4.472863 915.0429       29.83435 917.9961       42.17694 912.0854       42.20736 273.8260 6.320688 272.9378 6.345829 0.8881531      8.956597 
1 1 1 8   3  23 o 86.19124 3.013050 90.74178       6.318838 84.08132       8.682896 98.24034       9.213019 82.85207 4.315436 89.58245 4.232264 -6.730385      6.044423 
1 1 1 8   3  24 o 216.1021 3.843624 570.3284       20.24118 567.9307       28.47838 572.7762       28.77463 215.3329 5.431448 216.2431 5.464865 -0.9102631     7.704893 
1 1 1 8   3  25 o 211.4427 3.812917 546.1585       19.64654 541.1400       27.50436 551.3867       28.07318 210.1326 5.375623 212.1003 5.435911 -1.967636      7.645028 
1 1 1 8   3  26 o 163.1503 4.752317 326.0891       18.87410 326.0891       18.87410 0.000000       0.000000 163.1503 4.752317 ?        ?        0.000000       4.752317 
1 1 1 8   3  27 o 103.9282 3.637226 132.1675       9.197503 132.9829       11.08004 130.3606       16.49422 104.1500 4.375366 102.7092 6.625357 1.440849       7.939722 
1 1 1 8   3  28 o 46.38820 4.254799 26.56074       4.756230 24.97881       6.557988 28.31621       6.908329 44.64297 6.194820 47.60194 6.095084 -2.958965      8.690560 
1 1 1 8   3  29 f 15.28340 6.451708 0.2834925      4.119185 1.375046       5.662213 -0.9436442     6.003578 18.68209 7.699045 17.40887 7.574261 1.273220       10.80022 
1 1 1 8   3  30 o 38.03753 5.146130 18.09878       4.647872 18.74928       6.453462 17.39771       6.699613 38.30649 7.176937 36.76235 7.724341 1.544136       10.54390 
1 1 1 8   3  31 o 32.48096 7.336251 13.62272       5.669204 2.487268       10.03344 18.84514       6.871182 24.61631 10.20644 38.25990 7.637399 -13.64358      12.74760 
1 1 1 8   3  32 o 73.76183 3.597549 66.83292       6.447074 65.53593       9.036588 68.17744       9.200706 72.73747 5.131047 74.19832 5.119905 -1.460846      7.248522 
1 1 1 8   3  33 o 93.76146 3.859250 108.1488       8.799016 100.1110       14.44838 112.8872       11.09344 89.34897 6.684245 95.55611 4.779170 -6.207146      8.217031 
1 1 1 8   3  34 o 97.86466 3.374657 117.7082       8.036027 120.2438       11.13462 114.9516       11.60957 98.53662 4.650169 96.22935 4.967579 2.307266       6.804478 
1 1 1 8   3  35 o 94.64788 3.376902 110.3278       7.776226 127.4177       11.15207 94.15501       10.84870 101.3001 4.529069 86.80527 5.151729 14.49482       6.859503 
1 1 1 8   3  36 o 79.19164 4.030467 77.96483       7.752472 81.70132       9.388711 69.95804       13.74366 80.74266 4.793200 73.01142 7.847643 7.731239       9.195666 
1 1 1 8   3  37 o 54.46950 4.166125 37.24627       5.487992 35.33593       7.288808 39.74689       8.339198 52.32830 5.813914 55.26996 6.304133 -2.941662      8.575762 
1 1 1 8   3  38 o 23.33974 8.149262 7.135734       5.700702 7.135734       5.700702 0.000000       0.000000 23.33974 8.149262 ?        ?        0.000000       8.149262 
1 1 1 8   3  39 o 19.73324 6.721509 5.121582       3.869517 4.609437       5.216517 5.748144       5.769873 19.95738 7.653897 21.47027 8.092783 -1.512890      11.13891 
1 1 1 8   3  40 o 34.95333 5.542827 16.66511       4.563875 21.46939       6.337931 11.49107       6.577311 38.63153 6.989632 26.98387 8.751148 11.64766       11.19989 
1 1 1 8   3  41 o 21.12945 7.348299 6.749755       4.632679 6.938127       7.328395 6.624372       5.978868 21.73315 8.834303 21.14240 8.171652 0.5907440      12.03415 
1 1 1 8   3  42 o 17.30479 7.191842 3.675856       4.998307 6.498214       9.020391 2.425311       6.004390 20.65732 9.126246 16.99240 7.478922 3.664923       11.79926 
1 1 1 8   3  43 o 20.07063 6.719437 6.728509       3.866905 7.228701       5.613835 6.276918       5.334139 20.00534 7.864627 19.13777 7.620878 0.8675652      10.95126 
1 1 1 8   3  44 o 12.65308 5.691114 0.4636382      3.674927 4.419699       5.834016 -2.138664      4.731677 16.91768 7.411304 12.26801 5.828882 4.649671       9.428854 
1 1 1 8   3  45 o 13.35282 5.817276 1.964824       3.551291 2.953861       5.021924 0.9755022      5.022645 14.88090 6.676259 13.66470 6.334307 1.216203       9.203036 
1 1 1 8   3  46 o 12.55534 5.794791 0.9847238      4.136599 4.472163       4.873441 -8.003888      7.823997 15.19610 6.711036 12.01533 6.036277 3.180772       9.026330 
1 1 1 8   3  47 o 22.32294 6.690648 10.61150       3.925877 12.48711       5.614458 8.817045       5.491635 20.55978 7.926084 17.48316 7.417975 3.076614       10.85583 
1 1 1 8   4  0  o 490.6373 7.151751 2936.844       85.50845 3055.702       174.9234 2899.524       98.01776 499.2940 14.39159 487.4070 8.252337 11.88705       16.58973 
1 1 1 8   4  1  o 742.5766 8.696790 6730.922       157.3752 6897.658       226.2314 6574.581       219.0658 751.0255 12.36125 733.2477 12.25992 17.77771       17.40994 
1 1 1 8   4  2  o 706.9317 8.296607 6098.736       142.9269 6428.000       209.5988 5812.555       195.4052 725.1733 11.86071 689.6271 11.62748 35.54614       16.60948 
1 1 1 8   4  3  o 365.6431 4.887817 1629.824       43.55203 1688.672       69.99738 1592.652       55.63180 372.0450 7.720585 361.3881 6.317033 10.65695       9.975588 
1 1 1 8   4  4  o 461.7301 6.788157 2600.009       76.37939 2671.881       155.5525 2577.176       87.67669 467.2255 13.67672 459.6298 7.827803 7.595764       15.75840 
1 1 1 8   4  5  o 324.9074 4.429582 1286.709       35.07183 1284.987       44.97552 1289.382       56.02252 324.6524 5.684883 325.1548 7.070275 -0.5024719     9.072303 
1 1 1 8   4  6  f 457.1368 7.741343 2548.818       86.23798 2548.818       86.23798 0.000000       0.000000 457.1368 7.741343 ?        ?        0.000000       7.741343 
1 1 1 8   4  7  o 1073.065 15.30495 14083.49       400.2159 14200.79       464.9276 13747.89       786.4011 1076.830 17.71748 1053.771 30.65658 23.05933       35.40812 
1 1 1 8   4  8  o 495.1565 7.223682 2989.888       87.16401 2929.176       99.33820 3193.042       181.7153 490.0365 8.318629 510.8345 14.61240 -20.79800      16.81433 
1 1 1 8   4  9  o 199.8123 3.925488 486.5869       19.11402 514.7920       24.29458 440.7644       30.96600 205.5081 4.851145 190.0078 6.698189 15.50035       8.270391 
1 1 1 8   4  10 f 147.5919 2.922883 265.4576       10.51260 265.7145       14.81073 265.1969       14.92404 147.5951 4.121868 147.4498 4.157574 0.1453247      5.854504 
1 1 1 8   4  11 o 190.1323 3.366036 440.5635       15.59591 445.8345       22.06020 435.2964       22.05169 191.2467 4.733467 188.9113 4.794011 2.335480       6.737080 
1 1 1 8   4  12 o 515.1757 7.536511 3237.499       94.61539 3326.199       136.1704 3154.702       131.5614 521.8840 10.70712 508.2611 10.62198 13.62292       15.08207 
1 1 1 8   4  13 o 789.5984 13.10211 7625.288       252.1062 7541.844       306.5972 7799.492       442.9947 784.5312 16.03695 795.1870 22.88470 -10.65576      27.94447 
1 1 1 8   4  14 o 171.8072 3.764319 359.7843       15.76028 352.8843       18.86497 375.7272       28.67575 170.0769 4.555813 175.3764 6.722213 -5.299515      8.120564 
1 1 1 8   4  15 o 490.4826 7.223054 2935.670       86.33376 2910.915       121.2074 2961.164       123.0011 488.0466 10.19135 492.2319 10.25423 -4.185303      14.45728 
1 1 1 8   4  16 o 75.57100 2.970951 69.71400       5.460592 74.21992       7.618631 64.95383       7.830619 77.92143 4.025863 72.85355 4.431681 5.067886       5.987267 
1 1 1 8   4  17 f 137.5881 3.004584 230.7484       10.07399 232.6029       14.11756 228.8245       14.37959 138.0502 4.201383 136.9169 4.315153 1.133286       6.022637 
1 1 1 8   4  18 o 338.2715 5.227211 1396.331       43.08952 1395.551       60.79864 1397.118       61.07788 337.9251 7.383074 338.1107 7.412913 -0.1855774     10.46236 
1 1 1 8   4  19 o 168.9703 3.759000 348.2139       15.47814 363.9713       26.54662 340.0982       19.05160 172.4838 6.326468 166.8793 4.689469 5.604477       7.874980 
1 1 1 8   4  20 o 40.22571 6.022182 20.20998       5.721961 0.000000       0.000000 20.20998       5.721961 ?        ?        40.22571 6.022182 0.000000       6.022182 
1 1 1 8   4  21 o 179.2480 3.441535 391.9676       15.03290 387.5749       20.87334 396.7013       21.66840 178.0714 4.814603 180.1424 4.940662 -2.071014      6.898590 
1 1 1 8   4  22 o 162.1684 3.294525 320.8634       13.01953 311.6954       18.05571 330.7934       18.79108 159.6623 4.645560 164.4792 4.692984 -4.816833      6.603433 
1 1 1 8   4  23 f 236.5152 4.052908 683.1694       23.35942 670.4021       32.63313 696.5860       33.45251 234.0264 5.722130 238.5466 5.754656 -4.520172      8.115346 
1 1 1 8   4  24 o 130.4978 3.105850 207.8152       9.876879 208.0678       13.78696 207.5488       14.15640 130.4101 4.344381 130.2319 4.467276 0.1782074      6.231388 
1 1 1 8   4  25 o 86.97005 3.515764 92.51823       7.435829 86.87728       8.901632 105.5424       13.52599 84.18357 4.353959 92.57162 6.028705 -8.388046      7.436547 
1 1 1 8   4  26 o 197.5973 3.684611 477.0724       17.74225 463.7888       24.50508 491.7079       25.72178 194.4950 5.174847 200.2433 5.275765 -5.748245      7.390043 
1 1 1 8   4  27 o 120.3672 3.664508 177.2501       10.73628 173.0399       12.83768 187.0465       19.58260 118.8144 4.441673 123.1131 6.550830 -4.298714      7.914660 
1 1 1 8   4  28 o 67.70144 3.463405 56.16949       5.694972 57.67291       7.871813 54.51843       8.249252 68.43354 4.749775 66.46623 5.132782 1.967308       6.993270 
1 1 1 8   4  29 o 18.79066 6.855142 3.559997       4.078430 2.596993       5.723558 4.553342       5.813025 19.83817 7.896004 21.83210 8.145009 -1.993927      11.34408 
1 1 1 8   4  30 f 42.79847 4.662959 22.74267       4.784690 26.86199       6.704905 18.46823       6.829977 46.28051 6.092947 37.90802 7.657457 8.372490       9.785737 
1 1 1 8   4  31 o 30.36772 6.407556 11.83291       4.592467 15.99554       6.236243 6.900700       6.788274 35.20816 7.498403 25.00636 8.879037 10.20180       11.62168 
1 1 1 8   4  32 o 149.0796 4.896532 274.0316       17.76451 0.000000       0.000000 274.0316       17.76451 ?        ?        149.0796 4.896532 0.000000       4.896532 
1 1 1 8   4  33 o 73.83273 3.548363 67.03062       6.365608 71.23096       8.893552 62.61831       9.115199 75.82561 4.838322 70.95200 5.310402 4.873604       7.183991 
1 1 1 8   4  34 o 99.08422 3.384418 120.6839       8.159932 117.1836       11.07287 124.8440       12.07147 97.24341 4.686451 100.2804 4.955131 -3.036957      6.820275 
1 1 1 8   4  35 o 92.60276 3.883586 106.0193       8.744355 101.5569       10.33230 117.2832       16.41559 90.32172 4.710555 95.83790 7.078794 -5.516174      8.502861 
1 1 1 8   4  36 o 69.87068 3.650529 60.53632       6.194096 62.28150       8.441797 58.50096       9.116620 70.36515 4.954806 67.91226 5.557262 2.452888       7.445352 
1 1 1 8   4  37 o 53.45152 4.663470 36.16506       6.013665 39.58541       7.137867 27.79885       11.16342 55.62910 5.330528 43.56038 10.61510 12.06873       11.87833 
1 1 1 8   4  38 o 47.74655 4.965212 29.37829       5.692903 32.75084       6.788105 21.38214       10.45226 50.04053 5.666197 37.05528 10.86991 12.98526       12.25809 
1 1 1 8   4  39 o 43.85186 4.595825 24.92295       4.838330 30.18675       6.541309 18.56449       7.189378 47.52879 5.765455 35.34595 8.459599 12.18283       10.23745 
1 1 1 8   4  40 o 13.26192 5.903020 -0.5197101     3.844480 2.430732       5.362397 -3.640052      5.514631 17.59420 7.390360 13.84225 6.489308 3.751953       9.835067 
1 1 1 8   4  41 o 47.37517 5.308482 30.99787       6.023273 28.46795       10.40539 32.27279       7.386653 38.51408 10.70302 46.86566 6.654667 -8.351585      12.60315 
1 1 1 8   4  42 o 12.31591 5.620085 -0.8564312     3.743161 -1.894595      5.049078 0.4104255      5.577544 13.42647 6.266607 15.31218 6.937411 -1.885715      9.348692 
1 1 1 8   4  43 o 11.31376 5.503637 -5.268281      4.836562 0.000000       0.000000 -5.268281      4.836562 ?        ?        11.31376 5.503637 0.000000       5.503637 
1 1 1 8   4  44 o 14.17944 6.021598 2.321778       3.624211 -2.585020      5.147345 7.145815       5.103751 12.46630 5.966190 19.12944 7.505270 -6.663148      9.587728 
1 1 1 8   4  45 o 11.60666 5.362917 -0.2209992     3.557347 7.473697       5.164207 -7.169198      4.907316 18.39695 7.438631 10.17286 5.059539 8.224093       8.996230 
1 1 1 8   4  46 o 13.55260 5.872151 2.733982       3.577863 3.679637       4.857554 1.612561       5.289753 14.59808 6.556388 13.51702 6.342820 1.081059       9.122368 
1 1 1 8   4  47 o 11.55460 5.509727 -0.3420855     4.305655 1.797741       4.921538 -7.322633      8.889071 12.99636 6.104691 12.18827 6.161576 0.8080912      8.673654 
1 1 1 8   5  0  o 485.8696 8.173789 2880.760       96.77858 2819.674       116.9689 3013.333       172.3167 480.5101 9.989225 495.9486 14.27271 -15.43848      17.42111 
1 1 1 8   5  1  o 291.6301 4.484931 1036.723       31.87309 1071.962       45.93431 1004.001       44.26284 296.4790 6.357803 286.9282 6.330384 9.550873       8.971924 
1 1 1 8   5  2  o 173.5595 3.058210 367.1024       12.93456 380.1747       18.49931 354.5994       18.09196 176.6059 4.298474 170.5056 4.357798 6.100281       6.121052 
1 1 1 8   5  3  o 719.2308 10.32635 6316.058       180.9887 6333.588       256.4333 6298.656       255.4827 719.4765 14.62587 717.4925 14.61195 1.984009       20.67426 
1 1 1 8   5  4  o 343.0366 5.153343 1434.492       43.07900 1482.037       61.83540 1389.653       60.04966 348.5909 7.279223 337.5503 7.300220 11.04059       10.30923 
1 1 1 8   5  5  o 707.3782 10.16765 6107.723       175.2703 5988.847       199.5474 6509.047       366.6453 700.2605 11.69366 727.9398 20.68975 -27.67932      23.76568 
1 1 1 8   5  6  o 800.4872 11.46596 7824.369       223.6665 7861.836       258.9208 7714.200       443.9908 802.1131 13.24632 791.9277 23.03106 10.18542       26.56868 
1 1 1 8   5  7  o 711.8810 10.22942 6185.050       177.4575 6180.959       204.6307 6197.459       356.3796 711.4496 11.80295 710.4995 20.60497 0.9501343      23.74604 
1 1 1 8   5  8  o 448.3089 5.897884 2450.214       64.43320 2471.666       83.58224 2418.793       101.1572 450.1828 7.618842 445.2384 9.323265 4.944458       12.04035 
1 1 1 8   5  9  o 356.7293 4.808588 1551.142       41.80156 1580.760       54.51189 1508.865       65.12710 360.0725 6.212482 351.7328 7.598236 8.339722       9.814689 
1 1 1 8   5  10 f 454.8141 6.701892 2522.427       74.27924 2579.180       106.5732 2468.812       103.5840 459.7173 9.513081 449.7784 9.450566 9.938995       13.40940 
1 1 1 8   5  11 o 568.7843 8.263389 3946.966       114.5360 3988.219       163.0823 3906.812       160.8964 571.3763 11.71247 565.5195 11.67516 5.856812       16.53757 
1 1 1 8   5  12 o 153.6746 3.043034 287.8015       11.39581 288.3470       16.08142 287.2512       16.15101 153.7457 4.296466 153.4519 4.323388 0.2937622      6.095187 
1 1 1 8   5  13 o 304.0903 4.760460 1127.291       35.27667 1068.812       47.98768 1196.051       52.03526 296.0248 6.652205 313.1419 6.818997 -17.11710      9.526308 
1 1 1 8   5  14 o 407.6635 7.023287 2027.529       69.77154 2025.792       85.57507 2030.971       120.5029 407.3566 8.620579 407.3096 12.15411 0.4696655E-01  14.90089 
1 1 1 8   5  15 o 128.0711 3.416745 200.0652       10.65398 196.3129       12.54960 209.7483       20.15989 126.8351 4.065516 130.9711 6.335294 -4.135994      7.527574 
1 1 1 8   5  16 o 433.4452 6.465946 2292.703       68.29711 2142.397       92.16469 2475.766       101.7131 418.6878 9.033127 450.0489 9.274301 -31.36105      12.94643 
1 1 1 8   5  17 o 52.95902 3.358693 34.32840       4.312242 36.93066       6.040082 31.62308       6.158505 54.83894 4.561034 50.66397 5.055581 4.174969       6.808959 
1 1 1 8   5  18 o 139.9189 3.459386 238.7049       11.79537 230.2585       19.28439 243.7537       14.90961 137.2148 5.780198 141.2966 4.335233 -4.081833      7.225298 
1 1 1 8   5  19 o 55.79072 3.345459 38.09204       4.527456 37.22078       6.242661 39.05879       6.575910 55.02688 4.700384 56.36499 4.834156 -1.338116      6.742601 
1 1 1 8   5  20 o 122.0827 2.952793 181.7407       8.784626 182.6860       12.37558 180.7806       12.47165 122.2827 4.159077 121.6382 4.213801 0.6444855      5.920645 
1 1 1 8   5  21 o 150.9949 3.730441 278.2180       13.72646 271.8160       24.32117 281.2103       16.62779 148.8464 6.722526 151.6861 4.503330 -2.839722      8.091497 
1 1 1 8   5  22 o 25.25200 5.755509 8.112949       3.462656 7.268610       4.672623 9.141416       5.156999 24.24916 7.306379 26.92375 7.554315 -2.674585      10.50956 
1 1 1 8   5  23 o 48.66881 3.743572 29.08888       4.405807 34.66032       6.202877 23.41615       6.259005 53.02583 4.854103 43.30468 6.099888 9.721157       7.795573 
1 1 1 8   5  24 o 193.4465 4.113479 457.2124       19.39127 466.4729       23.99529 439.7802       32.92199 195.1961 5.048745 189.0669 7.158459 6.129211       8.759758 
1 1 1 8   5  25 o 159.9860 3.313487 312.5082       12.91824 316.9718       18.11165 307.8859       18.43082 160.9027 4.623909 158.5524 4.775633 2.350235       6.647346 
1 1 1 8   5  26 f 211.7306 3.815898 547.9035       19.68868 555.9826       27.80952 539.7842       27.87859 212.9021 5.364430 209.7510 5.458835 3.151077       7.653496 
1 1 1 8   5  27 o 27.31166 6.415911 9.542813       4.197109 7.028030       5.675763 12.57734       6.234756 24.45993 8.139707 31.30309 8.108854 -6.843168      11.48949 
1 1 1 8   5  28 o 139.3875 3.774468 237.8143       12.80901 243.3284       15.50921 225.9827       22.71825 140.8559 4.524205 135.1437 6.921367 5.712128       8.268843 
1 1 1 8   5  29 o 91.74497 3.211320 103.0036       7.168557 116.0673       10.14393 89.97115       10.13182 97.23626 4.291539 85.48579 4.883918 11.75047       6.501535 
1 1 1 8   5  30 o 51.44210 4.068764 32.62671       5.059046 35.08774       6.896352 29.75917       7.444152 53.13074 5.401455 48.67097 6.433804 4.459770       8.400568 
1 1 1 8   5  31 o 88.35845 3.803691 95.85226       8.170921 105.3369       13.03060 89.70634       10.48934 92.17662 5.830947 85.21924 5.073936 6.957382       7.729475 
1 1 1 8   5  32 f 16.18375 6.864019 0.2538031      4.699015 -2.117122      6.930683 2.270931       6.392694 17.93770 7.958362 20.29562 8.250653 -2.357912      11.46337 
1 1 1 8   5  33 o 90.15012 4.058872 100.1414       8.893904 107.0304       16.02230 97.07336       10.69253 92.13120 7.193428 88.50658 4.977628 3.624619       8.747696 
1 1 1 8   5  34 o 21.38486 7.488642 5.233108       4.816041 7.133062       5.663041 0.2681371      9.154541 24.22414 8.131875 21.98082 9.457695 2.243315       12.47299 
1 1 1 8   5  35 o 35.12988 5.446417 15.76525       4.511712 14.34820       6.072667 17.51111       6.740511 32.84218 7.719003 36.30123 7.848644 -3.459049      11.00837 
1 1 1 8   5  36 o 66.54577 4.174135 55.26172       6.734881 59.83053       8.181187 45.65560       11.86285 68.94974 4.901037 58.26947 8.613576 10.68027       9.910290 
1 1 1 8   5  37 o 50.80606 4.206066 32.49910       5.160860 38.20393       7.047155 25.90081       7.578940 54.58279 5.367478 43.88640 7.346084 10.69639       9.098063 
1 1 1 8   5  38 o 18.64962 6.753335 4.119837       3.948108 7.366765       5.223928 -0.2052566     6.029185 23.36126 7.809790 17.07570 7.505712 6.285561       10.83183 
1 1 1 8   5  39 o 33.44587 6.388566 15.46132       5.017120 18.96418       5.944583 6.788588       9.353809 36.79757 6.882217 24.05442 9.902465 12.74315       12.05918 
1 1 1 8   5  40 o 15.03691 6.620150 0.1936320      4.707781 -5.531893      8.686269 2.574953       5.601889 16.64899 7.906716 17.87509 7.533587 -1.226099      10.92113 
1 1 1 8   5  41 f 16.89903 6.618689 3.490404       3.963362 6.513911       5.366812 -0.1366309     5.878098 20.75263 7.808747 15.76667 7.134723 4.985968       10.57737 
1 1 1 8   5  42 o 14.10708 6.216884 0.8410838      4.161228 3.955696       6.636237 -1.177042      5.341879 18.20177 7.940612 14.10233 6.535553 4.099449       10.28430 
1 1 1 8   5  43 o 11.84106 5.575554 -2.084303      4.149528 -2.589172      8.587760 -1.930527      4.739528 15.65370 7.546798 12.67443 5.965106 2.979278       9.619597 
1 1 1 8   5  44 o 10.74595 5.077044 -1.877410      3.494066 -1.455291      5.232518 -2.217106      4.693950 13.00812 6.165709 12.09832 5.764471 0.9097977      8.440681 
1 1 1 8   5  45 o 12.05804 5.535366 0.2670476      3.703815 -2.501736      5.125215 3.293672       5.358544 11.97878 5.788653 15.06922 6.816298 -3.090436      8.942617 
1 1 1 8   5  46 o 18.76994 7.171772 8.343552       4.568721 13.12564       5.361271 -4.339722      8.731211 22.75591 7.905569 13.10863 6.555273 9.647280       10.26984 
1 1 1 8   6  0  o 856.0322 9.991663 8946.925       208.4318 8977.885       295.4609 8916.255       294.0781 856.6323 14.15369 853.6913 14.13597 2.940918       20.00381 
1 1 1 8   6  1  o 521.8796 6.202931 3321.063       78.88663 3279.719       110.6855 3363.743       112.4608 518.4250 8.761300 525.0212 8.789986 -6.596252      12.41065 
1 1 1 8   6  2  o 539.1401 7.841282 3545.790       103.0208 3635.182       209.7574 3517.371       118.2680 544.6994 15.81920 536.8729 9.039817 7.826538       18.21992 
1 1 1 8   6  3  o 366.5395 5.481637 1637.880       48.96290 1645.852       69.35914 1629.960       69.12944 367.3316 7.748352 365.5533 7.760260 1.778320       10.96625 
1 1 1 8   6  4  o 559.4200 6.622708 3815.982       90.28378 3629.793       123.1165 4032.588       132.7930 545.4073 9.263161 574.8532 9.479424 -29.44586      13.25389 
1 1 1 8   6  5  o 612.6222 8.847878 4578.744       132.0894 4541.509       185.0699 4617.408       188.5849 609.7441 12.45524 614.8015 12.58740 -5.057434      17.70807 
1 1 1 8   6  6  o 175.8721 3.560189 376.9532       15.25830 376.9532       15.25830 0.000000       0.000000 175.8721 3.560189 ?        ?        0.000000       3.560189 
1 1 1 8   6  7  o 237.6809 4.478998 688.5471       25.94247 682.6637       31.28490 701.4984       46.41673 236.6456 5.425006 239.6916 7.957711 -3.045975      9.630984 
1 1 1 8   6  8  o 309.1193 4.240397 1164.625       31.94249 1201.925       41.94358 1113.121       49.28664 313.9996 5.481512 302.1407 6.693971 11.85886       8.651949 
1 1 1 8   6  9  o 415.1382 5.506473 2100.956       55.70604 2177.955       73.52836 1997.215       85.34657 422.6024 7.139812 404.6048 8.656034 17.99762       11.22069 
1 1 1 8   6  10 o 488.0433 7.152056 2904.878       85.06001 2874.819       119.4322 2935.820       121.1727 485.2870 10.09919 490.4049 10.13944 -5.117981      14.31090 
1 1 1 8   6  11 o 385.7927 5.783579 1814.678       54.37344 1856.028       78.00891 1775.606       75.82874 390.0336 8.207409 381.4930 8.156638 8.540619       11.57118 
1 1 1 8   6  12 o 460.5273 6.798323 2586.706       76.29450 2576.318       107.4970 2597.249       108.3009 459.3754 9.602683 461.2346 9.635496 -1.859161      13.60347 
1 1 1 8   6  13 o 140.5126 2.911891 240.6164       9.970721 241.5862       13.99161 239.6158       14.21244 140.7224 4.084399 140.1433 4.166223 0.5790863      5.834357 
1 1 1 8   6  14 o 305.4972 4.773267 1137.871       35.53523 1165.951       50.87426 1111.120       49.65666 309.1465 6.753013 301.7899 6.752065 7.356598       9.549532 
1 1 1 8   6  15 o 251.2232 4.705454 769.5544       28.80696 768.4817       35.43620 771.6448       49.46513 251.0013 5.793421 251.2575 8.089288 -0.2562561     9.949890 
1 1 1 8   6  16 o 470.3185 9.850612 2705.686       112.8993 2714.804       158.6570 2696.333       160.6900 470.0172 13.86706 468.3481 14.09543 1.669098       19.77313 
1 1 1 8   6  17 o 263.2484 4.929338 845.4092       31.62207 847.0676       53.46521 844.5169       39.21677 263.0759 8.350347 263.0228 6.118463 0.5316162E-01  10.35200 
1 1 1 8   6  18 o 304.7554 4.799340 1133.262       35.64257 1142.447       50.45330 1124.111       50.35923 305.7715 6.771057 303.3023 6.813454 2.469208       9.605746 
1 1 1 8   6  19 o 53.88470 3.281588 35.53843       4.288660 36.52860       5.960840 34.47585       6.174990 54.52421 4.527029 52.92577 4.841330 1.598446       6.628157 
1 1 1 8   6  20 o 294.9606 4.697408 1062.281       33.76435 1018.974       46.40775 1110.988       49.21590 288.5933 6.598850 301.3222 6.702521 -12.72897      9.405775 
1 1 1 8   6  21 o 173.0727 3.338676 365.4372       14.08118 349.3778       19.35365 383.5002       20.52557 169.0571 4.702355 177.1195 4.759777 -8.062363      6.690861 
1 1 1 8   6  22 o 257.9326 4.989147 813.2751       31.35946 833.2906       55.71474 803.9935       37.94001 260.0478 8.804557 256.2548 6.075603 3.793060       10.69734 
1 1 1 8   6  23 o 134.4075 3.503238 220.6656       11.46460 229.8868       14.28836 203.9988       19.20942 137.1058 4.281767 128.8912 6.133418 8.214569       7.480130 
1 1 1 8   6  24 o 29.67163 5.382017 11.10923       3.748281 5.105244       4.992486 18.86566       5.674508 21.69982 7.622633 38.74735 6.220081 -17.04753      9.838391 
1 1 1 8   6  25 o 126.8533 3.088714 196.4282       9.548069 189.7706       13.05703 204.0799       13.99804 124.5037 4.310043 129.0970 4.456221 -4.593361      6.199546 
1 1 1 8   6  26 o 112.8377 3.065581 155.5678       8.421719 149.3816       11.45219 162.8529       12.42775 110.4255 4.263830 115.2798 4.432137 -4.854218      6.150128 
1 1 1 8   6  27 o 184.0664 3.560095 414.0972       15.96880 410.1452       22.12821 418.3919       23.06765 182.8511 4.970679 184.6407 5.131699 -1.789612      7.144367 
1 1 1 8   6  28 o 128.0446 3.185316 200.3298       9.939170 199.4603       13.71597 201.2913       14.42288 127.5262 4.420262 128.0705 4.628941 -0.5442963     6.400454 
1 1 1 8   6  29 o 78.24261 3.803911 75.10020       7.231135 76.53650       8.485941 71.29208       13.81760 78.89452 4.431660 75.45589 7.618795 3.438629       8.813947 
1 1 1 8   6  30 o 128.7295 3.251636 202.7952       10.19221 204.8573       14.09953 200.5383       14.75041 129.1294 4.487496 127.6963 4.748394 1.433128       6.533366 
1 1 1 8   6  31 o 99.92317 3.687067 122.5052       8.962682 119.5302       13.93557 124.6040       11.70462 98.18587 5.850776 100.5387 4.791147 -2.352814      7.562186 
1 1 1 8   6  32 o 79.79488 3.430092 78.15720       6.654285 83.91126       9.047350 71.37646       9.821395 82.46618 4.519316 75.84209 5.348362 6.624084       7.002085 
1 1 1 8   6  33 o 52.18818 4.247719 33.74961       5.355444 28.78979       6.914239 41.18723       8.466982 47.73705 6.081527 57.19815 6.172113 -9.461102      8.664869 
1 1 1 8   6  34 o 55.16801 4.909897 38.01136       6.531898 30.33786       11.11888 42.05509       8.071514 47.47815 9.929955 57.77797 5.811522 -10.29982      11.50556 
1 1 1 8   6  35 o 29.04307 6.853048 11.12769       4.771433 13.41565       5.693909 5.732117       8.743900 31.77184 7.479106 24.97844 9.816583 6.793402       12.34108 
1 1 1 8   6  36 o 20.35842 7.023561 4.999642       4.228577 9.370608       5.565179 -0.9709105     6.504257 26.46855 7.973426 17.61600 7.767497 8.852551       11.13147 
1 1 1 8   6  37 o 86.66484 3.394602 93.33170       7.155289 114.3765       10.08463 71.99664       10.15393 95.36701 4.350823 74.83566 5.608679 20.53135       7.098376 
1 1 1 8   6  38 o 52.64303 3.948786 35.04518       5.028796 35.52895       6.984716 34.52453       7.246065 52.07993 5.590975 51.11640 5.926810 0.9635277      8.147765 
1 1 1 8   6  39 o 44.33107 4.624629 25.58083       4.922600 30.88547       6.667546 19.22498       7.298357 47.89384 5.832978 35.75069 8.502099 12.14315       10.31064 
1 1 1 8   6  40 o 67.40673 4.135613 58.99625       6.760574 60.63889       7.943095 54.67831       12.87823 67.56508 4.856669 58.14392 9.410326 9.421158       10.58969 
1 1 1 8   6  41 o 22.28635 7.312725 7.846305       4.586126 9.428434       7.139475 6.734859       5.983972 23.37318 8.956625 20.93572 8.152034 2.437464       12.11102 
1 1 1 8   6  42 f 35.85598 5.355209 18.60433       4.536041 19.21663       6.252494 17.92400       6.590724 33.57380 7.792630 31.43188 8.431092 2.141920       11.48078 
1 1 1 8   6  43 o 21.95687 6.919415 8.376156       4.134619 12.79592       6.616930 5.545137       5.295763 24.47409 8.757993 18.23094 7.472141 6.243143       11.51240 
1 1 1 8   6  44 o 23.89135 7.377468 11.08136       4.725648 9.547958       8.971328 11.67022       5.559455 19.35568 8.780913 23.26760 8.052123 -3.911919      11.91391 
1 1 1 8   6  45 o 13.60454 5.936670 2.322431       3.711546 2.351171       5.064379 2.289085       5.455222 14.28291 6.525095 14.40800 6.651558 -0.1250916     9.317730 
1 1 1 8   6  46 o 15.23446 6.221796 4.508129       3.655480 6.393556       4.908275 2.159826       5.477736 16.51769 7.010815 13.76674 6.458264 2.750948       9.532088 
1 1 1 8   7  0  o 293.1770 3.716198 1047.552       26.55002 1061.846       37.87518 1033.743       37.22798 295.1328 5.266246 291.2015 5.246138 3.931244       7.433391 
1 1 1 8   7  1  o 335.9601 4.170700 1375.676       34.14544 1343.215       47.63676 1409.978       48.96867 331.9214 5.889397 340.0696 5.909005 -8.148193      8.342742 
1 1 1 8   7  2  o 220.7660 3.261462 593.9501       17.54610 591.6730       27.47754 595.5178       22.79985 220.3129 5.118018 221.0433 4.232710 -0.7304077     6.641532 
1 1 1 8   7  3  o 269.5417 4.912163 885.5867       32.26524 879.5957       39.07921 898.4162       57.18739 268.6029 5.970339 271.2353 8.663137 -2.632416      10.52116 
1 1 1 8   7  4  o 576.8569 8.357669 4059.108       117.4869 3858.996       225.8956 4133.309       137.5549 561.2998 16.53295 581.9921 9.698905 -20.69232      19.16787 
1 1 1 8   7  5  o 452.9049 5.970763 2500.709       65.89810 2717.644       109.9277 2379.021       82.33160 471.9348 9.558480 441.6687 7.649513 30.26605       12.24253 
1 1 1 8   7  6  o 123.6477 2.613447 186.3051       7.874732 188.1613       8.847521 179.2293       17.27431 124.2604 2.921815 121.1085 5.870641 3.151924       6.557548 
1 1 1 8   7  7  o 237.3561 3.854684 686.6111       22.29591 698.2036       25.71896 651.5489       44.72846 239.3425 4.409582 230.9895 7.958014 8.353043       9.098044 
1 1 1 8   7  8  o 523.7407 7.646637 3345.526       97.59396 3482.485       115.4333 3002.267       182.7457 534.2635 8.866240 495.2055 15.16133 39.05801       17.56349 
1 1 1 8   7  9  o 94.30756 3.037803 108.4977       6.972286 95.25838       13.06162 113.7734       8.245264 88.17886 6.116405 96.55688 3.510012 -8.378014      7.051992 
1 1 1 8   7  10 o 155.9788 3.534391 296.5107       13.43434 283.3517       23.88514 302.6001       16.24807 152.3001 6.450239 157.5073 4.237011 -5.207138      7.717373 
1 1 1 8   7  11 o 305.9153 4.742775 1140.797       35.35655 1110.053       49.13970 1173.798       50.91074 301.6965 6.683841 310.2359 6.734125 -8.539398      9.488002 
1 1 1 8   7  12 o 342.2009 5.218268 1427.697       43.51546 1384.622       60.33240 1474.402       62.82348 336.8970 7.348815 347.6440 7.415683 -10.74698      10.44018 
1 1 1 8   7  13 o 831.5570 11.94017 8456.111       241.9572 8271.982       337.1297 8651.699       347.4626 820.9761 16.85118 839.5601 16.98322 -18.58398      23.92472 
1 1 1 8   7  14 o 803.3361 11.55002 7894.299       226.1080 7840.572       318.1746 7949.114       321.3796 799.0241 16.34066 804.5157 16.39260 -5.491577      23.14594 
1 1 1 8   7  15 o 195.3483 3.955538 465.2288       18.83004 462.5522       31.25918 466.7532       23.59045 194.5778 6.602035 195.5747 4.953784 -0.9969635     8.253899 
1 1 1 8   7  16 o 290.2418 5.270101 1027.674       37.27478 992.5836       44.88486 1105.653       66.90997 285.1563 6.459233 300.5463 9.146376 -15.39008      11.19723 
1 1 1 8   7  17 o 262.5376 4.965019 840.9570       31.76497 870.5623       39.18318 784.1993       54.25353 267.0342 6.021389 253.0060 8.813022 14.02823       10.67363 
1 1 1 8   7  18 o 89.25772 2.803108 97.21975       6.089518 98.61094       8.313330 95.60908       8.945090 89.83797 3.805958 88.43312 4.162499 1.404854       5.640188 
1 1 1 8   7  19 o 138.3863 3.021556 233.5178       10.18966 226.0373       13.95823 242.0527       14.90948 136.0382 4.215582 140.7687 4.351533 -4.730469      6.058629 
1 1 1 8   7  20 o 158.4778 3.184485 306.3284       12.29827 309.7326       17.25397 302.8127       17.53416 159.2166 4.451344 157.4141 4.575792 1.802444       6.383756 
1 1 1 8   7  21 o 263.1298 4.316032 845.4930       27.67520 834.5683       38.63139 857.0109       39.66642 261.1412 6.070561 264.6136 6.151411 -3.472382      8.642428 
1 1 1 8   7  22 o 251.8072 5.983698 776.3544       36.71756 813.2599       54.29498 745.2528       49.84314 256.8901 8.685627 246.0158 8.325926 10.87436       12.03167 
1 1 1 8   7  23 f 163.8600 3.900833 327.9156       15.57637 331.7269       27.84302 326.1794       18.79221 164.2468 6.972241 163.2690 4.728200 0.9777985      8.424253 
1 1 1 8   7  24 o 85.53521 2.999381 89.39364       6.242233 92.39893       8.554924 85.97171       9.128686 86.86459 4.052621 83.73321 4.490200 3.131386       6.048606 
1 1 1 8   7  25 o 58.47192 3.378515 41.89059       4.793537 42.44475       6.377246 41.17083       7.267912 58.73509 4.489556 57.74167 5.221539 0.9934196      6.886261 
1 1 1 8   7  26 o 24.21038 6.288525 7.472284       3.742926 6.345223       4.886140 9.072869       5.822796 23.10046 7.546255 26.98509 8.161739 -3.884626      11.11575 
1 1 1 8   7  27 o 105.1959 3.081108 135.2726       7.889939 134.2468       10.75004 136.4703       11.61637 104.6473 4.224152 105.4640 4.530481 -0.8166885     6.194249 
1 1 1 8   7  28 o 22.17385 6.512602 6.166125       3.750057 3.963537       4.766748 9.743325       6.074734 20.07238 7.396529 27.83100 8.318284 -7.758617      11.13115 
1 1 1 8   7  29 o 99.60954 3.671247 121.5763       8.896252 119.8876       10.43035 126.0842       17.04128 98.80376 4.342615 100.7144 6.986746 -1.910652      8.226356 
1 1 1 8   7  30 o 131.4862 3.685773 211.8617       11.79821 213.8712       18.71697 210.5369       15.19776 131.5405 5.853683 130.8212 4.775235 0.7193298      7.554368 
1 1 1 8   7  31 o 136.1497 3.301787 226.9090       10.95473 229.5371       15.06103 223.9566       15.96295 136.5843 4.531265 134.8111 4.867037 1.773178       6.649843 
1 1 1 8   7  32 o 132.3383 3.771579 215.0608       12.15071 203.3634       14.21752 246.7498       23.40099 128.4586 4.548946 140.5305 6.853926 -12.07191      8.226130 
1 1 1 8   7  33 o 18.82521 6.938108 3.587968       4.194486 4.617200       5.428878 2.063597       6.606916 21.29912 7.885502 20.29078 8.334476 1.008331       11.47365 
1 1 1 8   7  34 o 79.26517 5.101278 78.37096       9.801342 81.42759       14.48630 75.79036       13.31059 79.73183 7.545495 77.08388 7.168086 2.647957       10.40749 
1 1 1 8   7  35 o 34.74009 6.027007 15.61685       4.917425 16.07481       5.860806 14.52774       9.038114 34.89777 7.132727 32.69660 10.21997 2.201168       12.46289 
1 1 1 8   7  36 o 45.57708 4.346482 26.14078       4.769091 30.75852       6.374545 20.27027       7.187409 49.06126 5.422172 38.68977 7.890957 10.37148       9.574296 
1 1 1 8   7  37 o 36.51303 5.195468 17.26779       4.492541 15.61984       5.862501 19.61239       6.992702 33.76578 7.335044 37.65270 7.874633 -3.886925      10.76163 
1 1 1 8   7  38 o 15.15135 6.243229 1.408927       3.722717 2.379058       4.926414 0.1175259      5.683897 17.65441 7.217997 16.76227 7.329953 0.8921356      10.28726 
1 1 1 8   7  39 o 12.14537 5.540073 -1.649812      3.632720 -7.756801      4.623181 8.205921       5.873159 10.76734 5.268821 23.81167 8.274257 -13.04433      9.809373 
1 1 1 8   7  40 o 18.20491 6.950202 4.179207       4.288510 5.343176       4.989755 0.8890389      8.389139 19.85652 7.516601 18.94039 8.551690 0.9161282      11.38555 
1 1 1 8   7  41 o 47.94707 4.706467 31.30761       5.428339 32.84759       8.208189 30.11053       7.236886 45.50652 7.674528 44.53015 6.891400 0.9763641      10.31454 
1 1 1 8   7  42 o 11.98727 5.482913 -0.8500425     3.589897 -0.4241591     4.941624 -1.325969      5.223890 13.98988 6.411627 13.78052 6.412527 0.2093592      9.068047 
1 1 1 8   7  43 o 12.23366 5.544703 -0.1324124     3.566910 -2.328985      5.030516 2.088529       5.058343 12.70251 6.028040 15.29915 6.792701 -2.596635      9.081743 
1 1 1 8   7  44 o 14.10041 6.132362 2.218741       3.932073 -3.023726      5.919397 6.358823       5.260344 12.82294 6.202514 17.96572 7.414008 -5.142774      9.666369 
1 1 1 8   7  45 o 11.63132 5.507895 -0.9930544     4.156631 1.806172       4.943758 -7.744808      7.677970 13.80441 6.358219 12.24345 6.126276 1.560954       8.829394 
1 1 1 8   7  46 o 29.22595 6.116673 15.60175       4.216263 22.18190       5.877077 8.623675       6.052171 31.84107 7.666548 17.41032 7.589437 14.43076       10.78775 
1 1 1 8   8  0  o 670.4788 7.887386 5483.072       128.8707 5609.146       184.8093 5363.746       179.7955 677.7899 11.18903 662.8044 11.13160 14.98547       15.78312 
1 1 1 8   8  1  o 258.6116 3.686356 815.0755       23.23172 814.6236       36.50571 815.3831       30.11743 258.4980 5.795189 258.6410 4.778422 -0.1430359     7.511161 
1 1 1 8   8  2  o 399.6146 5.941802 1946.858       57.86229 2054.417       118.8779 1913.464       66.23822 409.9841 11.91129 396.1353 6.861658 13.84879       13.74631 
1 1 1 8   8  3  o 282.8086 3.954792 974.7609       27.25539 961.3846       42.51250 984.0958       35.51445 280.8108 6.212505 284.1357 5.129124 -3.324951      8.056248 
1 1 1 8   8  4  o 200.0450 3.073742 487.6689       14.98412 472.4205       22.98582 498.9374       19.75968 196.8719 4.791154 202.3326 4.007542 -5.460602      6.246243 
1 1 1 8   8  5  o 196.9284 3.369978 472.6069       16.17229 488.8532       18.72716 424.9520       32.07372 200.2793 3.837071 186.5460 7.068278 13.73326       8.042615 
1 1 1 8   8  6  o 563.8361 11.64431 3881.984       159.9937 3896.573       226.7671 3867.524       225.7667 564.0383 16.51594 561.9321 16.50482 2.106201       23.34921 
1 1 1 8   8  7  o 532.3264 11.04184 3459.713       143.2371 3459.251       202.4618 3460.177       202.6740 531.5226 15.64798 531.5915 15.66238 -0.6884766E-01 22.13977 
1 1 1 8   8  8  o 495.5706 10.36337 2998.004       125.1534 3195.862       184.8617 2830.579       170.0517 510.9430 14.86278 480.8825 14.52794 30.06055       20.78373 
1 1 1 8   8  9  o 617.5590 12.71597 4660.852       191.3656 4857.223       278.1538 4484.375       263.6889 629.1989 18.15999 604.6030 17.91698 24.59589       25.51085 
1 1 1 8   8  10 f 776.4484 10.00822 7360.307       189.3676 7154.041       239.8766 7701.474       308.5013 764.9948 12.86748 793.0226 15.96376 -28.02789      20.50399 
1 1 1 8   8  11 f 336.6456 5.967624 1381.936       48.95652 1400.520       86.48023 1373.172       59.38903 338.4660 10.49763 335.5139 7.263728 2.952057       12.76565 
1 1 1 8   8  12 o 731.8021 10.53723 6542.767       187.9127 6516.259       264.9551 6569.594       266.5494 729.3376 14.90760 732.3088 14.93645 -2.971130      21.10294 
1 1 1 8   8  13 o 321.9234 5.693275 1263.863       44.66330 1315.799       77.97688 1238.505       54.48659 328.0421 9.765263 318.6035 7.017832 9.438568       12.02540 
1 1 1 8   8  14 o 46.40937 3.220744 26.37836       3.619888 31.52373       5.276258 21.80278       4.975555 50.66627 4.314375 41.99372 4.957523 8.672550       6.571976 
1 1 1 8   8  15 o 430.9681 6.416480 2266.741       67.38731 2223.778       93.95134 2312.263       96.70855 426.5236 9.039071 434.9134 9.124856 -8.389740      12.84398 
1 1 1 8   8  16 o 24.99976 4.915867 7.890036       2.888047 7.484321       3.774548 8.462974       4.485469 24.31182 6.315114 25.88863 6.960308 -1.576818      9.398220 
1 1 1 8   8  17 o 158.4674 3.524244 306.2026       13.60949 311.1733       16.96425 297.2263       22.79668 159.6574 4.364326 155.9017 6.011728 3.755707       7.428877 
1 1 1 8   8  18 o 81.55324 3.337900 81.23965       6.619602 83.32371       7.593648 74.64334       13.50970 82.56564 3.784176 77.79211 7.208447 4.773529       8.141356 
1 1 1 8   8  19 f 135.9400 2.981311 225.3450       9.876221 228.3923       13.73634 222.0840       14.20986 136.7442 4.126896 134.8240 4.330623 1.920166       5.982104 
1 1 1 8   8  20 f 102.9152 3.169508 129.3141       7.939435 125.4767       9.658169 137.3115       13.94291 101.3203 3.919061 105.8522 5.423350 -4.531891      6.691171 
1 1 1 8   8  21 o 188.1609 3.936081 432.2240       18.04801 430.3124       22.09575 436.0559       31.28405 187.5896 4.837561 188.5056 6.821489 -0.9160309     8.362698 
1 1 1 8   8  22 f 264.7968 4.341628 856.6185       28.01569 863.9788       39.52158 849.1843       39.71951 265.5868 6.106490 263.2839 6.190753 2.302917       8.695668 
1 1 1 8   8  23 o 32.67765 5.999637 13.49229       4.601616 9.457602       8.891811 14.96810       5.377755 29.19108 10.17865 34.35370 6.664287 -5.162621      12.16625 
1 1 1 8   8  24 o 64.76735 3.129808 51.32132       4.925184 48.95586       6.529035 54.44476       7.502513 63.13970 4.268453 66.55428 4.655238 -3.414574      6.315927 
1 1 1 8   8  25 o 103.2937 2.987886 130.3484       7.513069 131.6796       10.24516 128.7995       11.05067 103.7044 4.061872 102.5142 4.434011 1.190163       6.013258 
1 1 1 8   8  26 o 65.17221 3.244808 52.00587       5.137119 48.08907       6.743076 57.42355       7.930470 62.52373 4.454833 68.30364 4.794981 -5.779911      6.545027 
1 1 1 8   8  27 o 101.9023 3.069791 126.9480       7.614362 129.0930       10.32618 124.3919       11.27262 102.6214 4.137683 100.6592 4.607747 1.962158       6.192879 
1 1 1 8   8  28 o 21.72503 6.535223 5.875786       3.740538 7.933436       4.957187 3.155161       5.700119 25.15524 7.513278 20.33281 7.945103 4.822430       10.93499 
1 1 1 8   8  29 o 62.18994 3.880090 47.53991       5.850985 47.37941       8.534710 47.68223       8.036801 61.76649 5.735751 62.03720 5.368917 -0.2707100     7.856469 
1 1 1 8   8  30 o 150.8647 3.874825 279.0781       14.23365 272.6038       16.72506 296.0839       27.10627 148.9070 4.614673 154.2044 7.233508 -5.297348      8.580142 
1 1 1 8   8  31 o 240.9465 4.217922 712.8960       24.76597 716.4851       34.61246 709.1308       35.45135 240.6607 5.901890 239.2353 6.085891 1.425430       8.477640 
1 1 1 8   8  32 o 70.94337 3.490178 61.86047       6.015342 58.08550       7.862382 67.18938       9.341511 68.48569 4.740305 73.55276 5.246174 -5.067070      7.070561 
1 1 1 8   8  33 o 25.55277 6.606367 8.480109       4.143779 13.03912       5.367866 1.756604       6.518749 31.60946 7.138027 19.91927 8.239923 11.69019       10.90173 
1 1 1 8   8  34 f 44.13611 4.919878 24.47735       5.201706 26.72580       6.215905 19.22351       9.501695 45.92220 5.675146 37.53070 10.14772 8.391495       11.62684 
1 1 1 8   8  35 o 30.59062 7.414584 12.50401       5.468984 5.569464       9.417447 16.03270       6.717854 25.24837 10.10202 34.46941 8.130315 -9.221048      12.96738 
1 1 1 8   8  36 o 27.95873 6.205217 10.37525       4.117356 16.97254       5.420423 1.376377       6.330596 35.86444 6.438621 18.93113 7.995208 16.93331       10.26544 
1 1 1 8   8  37 o 18.17454 6.653731 3.746320       3.847343 4.733562       4.974912 2.277314       6.068551 20.31327 7.543377 19.06598 7.924196 1.247297       10.94054 
1 1 1 8   8  38 o 47.34934 4.168221 28.61976       4.760464 35.42366       6.477217 20.62746       7.020135 52.10368 5.169427 38.00796 7.839766 14.09572       9.390682 
1 1 1 8   8  39 o 15.64411 6.295903 2.160575       3.680357 2.347930       4.804588 1.894539       5.725240 17.10884 7.075397 17.69011 7.542332 -0.5812645     10.34157 
1 1 1 8   8  40 o 24.21980 7.130233 8.915870       4.490608 11.19809       6.341829 6.620871       6.359566 26.08356 8.601341 21.46202 8.390433 4.621538       12.01592 
1 1 1 8   8  41 o 13.02971 5.876988 -0.4559463     3.950373 -2.816480      4.583086 6.366730       7.791664 12.46045 5.864843 20.67558 8.806483 -8.215137      10.58067 
1 1 1 8   8  42 o 12.29406 5.551524 -0.2815121     3.536670 -3.547549      4.687757 4.033647       5.388314 11.95595 5.714259 17.40323 7.364348 -5.447286      9.321286 
1 1 1 8   8  43 o 19.36431 6.615363 6.446915       3.748751 6.626499       5.256203 6.261001       5.348060 18.97116 7.561548 18.61839 7.554710 0.3527660      10.68881 
1 1 1 8   8  44 o 15.91589 6.586105 4.207727       4.166564 3.530160       4.903749 5.966907       7.901457 15.50548 6.793653 17.36463 8.012462 -1.859150      10.50492 
1 1 1 8   8  45 o 13.20260 6.053988 1.432512       4.413504 0.7126828      8.942794 1.664295       5.074563 14.70712 7.223526 13.70233 6.357007 1.004781       9.622415 
1 1 1 8   8  46 o 14.48839 6.066351 3.932755       3.595414 0.2090091      4.842248 8.508344       5.367605 12.36226 5.880208 17.71331 7.414076 -5.351053      9.462842 
1 1 1 8   9  0  o 860.0061 10.05167 9025.893       210.6570 8830.963       294.1405 9231.157       301.8366 850.0060 14.20027 869.0425 14.25262 -19.03650      20.11927 
1 1 1 8   9  1  o 315.9215 4.339110 1216.439       33.40535 1218.028       52.67731 1215.371       43.20348 316.0598 6.839403 315.7519 5.614830 0.3078918      8.848941 
1 1 1 8   9  2  o 493.3028 6.455621 2966.957       77.60464 2874.825       120.0016 3033.186       101.7436 485.3551 10.14591 498.6695 8.372560 -13.31439      13.15444 
1 1 1 8   9  3  o 599.7132 8.678770 4387.319       126.8346 4380.684       179.3482 4393.958       179.3944 598.9093 12.28853 599.8177 12.27308 -0.9084473     17.36768 
1 1 1 8   9  4  o 636.6483 8.229048 4943.838       127.6689 5143.693       207.4121 4821.928       161.9936 648.8611 13.11735 628.5333 10.57629 20.32782       16.85001 
1 1 1 8   9  5  o 417.1452 6.208968 2121.529       63.11647 2073.150       71.59652 2290.236       133.6998 412.3210 7.125582 432.8046 12.69030 -20.48355      14.55396 
1 1 1 8   9  6  o 231.3412 5.556162 652.4307       31.32304 651.5160       44.18286 653.3550       44.41298 230.9865 7.860758 231.3107 7.890680 -0.3242188     11.13797 
1 1 1 8   9  7  o 182.4156 4.844385 405.8945       21.51553 452.3805       31.93932 367.2743       29.11196 192.4871 6.819849 173.4081 6.902949 19.07896       9.703662 
1 1 1 8   9  8  o 449.1004 9.465379 2461.546       103.5899 2391.361       143.6890 2537.501       149.4790 442.0923 13.35281 455.3938 13.48453 -13.30148      18.97709 
1 1 1 8   9  9  o 423.9694 12.78810 2199.151       131.9714 0.000000       0.000000 2199.151       131.9714 ?        ?        423.9694 12.78810 0.000000       12.78810 
1 1 1 8   9  10 o 25.96591 8.377684 7.973865       6.032655 10.17568       8.593264 5.834274       8.470975 29.85398 10.01712 25.91227 9.797181 3.941713       14.01169 
1 1 1 8   9  11 o 31.15713 3.741012 12.00241       2.783679 0.000000       0.000000 12.00241       2.783679 ?        ?        31.15713 3.741012 0.000000       3.741012 
1 1 1 8   9  12 o 402.0305 8.512498 1973.120       83.39732 0.000000       0.000000 1973.120       83.39732 ?        ?        402.0305 8.512498 0.000000       8.512498 
1 1 1 8   9  13 o 457.3941 7.775755 2553.803       86.67009 2458.406       145.0281 2606.799       108.0960 447.7817 13.30552 461.8924 9.603575 -14.11066      16.40931 
1 1 1 8   9  14 o 523.2053 7.664692 3342.547       97.72438 3167.665       133.2128 3546.331       143.7999 508.8112 10.74369 538.3187 10.96183 -29.50745      15.34889 
1 1 1 8   9  15 o 500.2177 7.353165 3056.095       89.63332 3060.289       126.7040 3051.894       126.8174 499.9617 10.39962 499.2700 10.42335 0.6916809      14.72407 
1 1 1 8   9  16 o 478.7539 7.068101 2800.364       82.46148 2751.974       115.0241 2851.532       118.2803 473.9644 9.958804 482.4348 10.06092 -8.470398      14.15627 
1 1 1 8   9  17 o 148.1308 3.029196 267.5232       10.93475 268.4681       15.19072 266.5070       15.75272 148.2907 4.207923 147.7354 4.380413 0.5552979      6.074095 
1 1 1 8   9  18 o 175.4258 3.723193 375.3875       15.91641 363.0310       19.30618 401.6053       28.12200 172.4027 4.599432 181.1409 6.380759 -8.738251      7.865676 
1 1 1 8   9  19 o 304.2180 6.743141 1132.681       49.99002 1132.681       49.99002 0.000000       0.000000 304.2180 6.743141 ?        ?        0.000000       6.743141 
1 1 1 8   9  20 o 325.8427 5.076772 1297.522       40.31176 1236.412       54.99797 1368.467       59.25909 317.6248 7.105525 334.1087 7.278318 -16.48398      10.17165 
1 1 1 8   9  21 o 347.7609 5.370050 1479.171       45.50879 1441.229       62.99858 1520.577       65.81184 342.6393 7.544970 351.8997 7.674480 -9.260406      10.76217 
1 1 1 8   9  22 o 115.8896 2.890987 163.8439       8.164445 166.2253       11.20686 161.1504       11.91850 116.6002 3.949810 114.7710 4.268849 1.829155       5.815846 
1 1 1 8   9  23 o 105.4330 2.870459 135.7297       7.368175 130.7456       9.880323 141.9745       11.05943 103.3815 3.929013 107.7033 4.221919 -4.321800      5.767300 
1 1 1 8   9  24 o 176.7813 4.057770 381.9713       17.48074 382.5120       31.11229 381.7219       21.13158 176.1589 7.263129 176.5276 4.917071 -0.3686829     8.771011 
1 1 1 8   9  25 o 99.30779 2.931866 120.4887       7.087414 116.6203       9.476537 125.3988       10.67668 97.58563 3.993431 101.1524 4.341465 -3.566772      5.898797 
1 1 1 8   9  26 f 49.65334 3.525624 30.28006       4.238250 30.50300       5.459516 29.94193       6.723566 49.70536 4.557977 49.05386 5.732544 0.6515007      7.323743 
1 1 1 8   9  27 f 15.34291 6.198526 1.261083       3.582486 -0.3251071     4.580128 3.760969       5.749898 15.56705 6.693759 20.99086 8.039343 -5.423803      10.46124 
1 1 1 8   9  28 o 82.80315 3.499915 83.99651       7.046280 81.86094       10.26953 85.89625       9.685946 81.47425 5.199558 83.54247 4.777638 -2.068214      7.061248 
1 1 1 8   9  29 o 43.63187 4.179076 23.54381       4.389201 22.26526       5.572349 25.63371       7.124275 42.17448 5.556992 45.05861 6.691116 -2.884129      8.697769 
1 1 1 8   9  30 o 75.00846 3.326568 68.98709       6.065423 75.71274       8.044464 60.12619       9.233559 78.44003 4.224042 69.62506 5.486413 8.814964       6.924107 
1 1 1 8   9  31 o 35.66655 5.819986 16.12545       4.884189 12.00650       5.386470 35.17237       11.58308 30.42792 7.347989 51.95091 9.499387 -21.52299      12.00963 
1 1 1 8   9  32 o 33.25558 5.527617 14.04929       4.322402 18.61073       5.500918 6.687914       6.988172 38.24458 6.107761 24.79659 8.983974 13.44799       10.86354 
1 1 1 8   9  33 o 55.39067 4.241539 38.05122       5.681719 41.33744       6.743896 30.01333       10.54711 57.59558 4.849933 47.50017 9.444399 10.09541       10.61690 
1 1 1 8   9  34 o 46.29885 4.214698 26.72562       4.703173 28.94558       6.123809 23.53309       7.343743 47.88259 5.338889 42.43876 7.368119 5.443829       9.099061 
1 1 1 8   9  35 o 53.50582 5.108353 36.20095       6.579913 37.98074       11.57246 35.35070       7.998673 52.72367 9.349385 52.33514 6.405088 0.3885345      11.33297 
1 1 1 8   9  36 f 68.54290 3.534067 58.42507       5.883076 58.36546       7.705230 58.50840       9.109925 67.99585 4.678670 67.58915 5.580661 0.4067001      7.282426 
1 1 1 8   9  37 o 37.71251 5.013842 18.42906       4.493729 11.47710       5.779391 29.05805       7.146186 28.49747 7.997666 46.67403 6.455595 -18.17656      10.27800 
1 1 1 8   9  38 o 35.45529 5.156497 16.59928       4.324762 17.89168       5.723345 14.87919       6.602767 35.88199 6.794118 31.65595 8.415304 4.226042       10.81561 
1 1 1 8   9  39 o 31.42294 6.158642 13.84373       4.547246 12.67382       6.572571 14.91786       6.297781 28.32586 8.692219 31.14242 8.190638 -2.816561      11.94325 
1 1 1 8   9  40 o 12.37398 5.577271 -0.7886488     3.550480 -2.887356      4.625473 2.221458       5.539507 12.71466 5.955060 17.16911 7.371755 -4.454446      9.476576 
1 1 1 8   9  41 o 20.00349 6.894299 6.292681       4.074005 7.547050       4.737677 2.732632       7.981431 21.41194 7.431993 18.41044 8.324110 3.001507       11.15909 
1 1 1 8   9  42 o 15.48604 6.204224 3.111946       3.556967 1.508245       4.703995 5.253253       5.435563 14.91313 6.589375 18.32146 7.546184 -3.408334      10.01822 
1 1 1 8   9  43 o 13.03750 5.891263 0.4326079      3.990777 -1.712270      4.647550 6.453670       7.786804 12.45031 5.874135 18.55531 8.319963 -6.105000      10.18466 
1 1 1 8   9  44 o 17.41576 6.534543 5.609078       3.752477 10.35655       5.168943 0.3190484      5.456318 21.67927 7.742604 13.70932 6.435862 7.969946       10.06818 
1 1 1 8   9  45 o 9.149669 4.494715 -4.222081      3.467183 -5.169567      4.611750 -2.990305      5.258296 10.25651 5.066148 11.65080 5.683361 -1.394294      7.613569 
1 1 1 8   9  46 o 11.45099 5.510093 -1.157270      4.526572 -7.980185      8.588075 1.467344       5.326520 12.10146 6.110376 13.14459 6.227590 -1.043133      8.724653 
1 1 1 8   10 0  o 499.8503 6.542748 3046.275       79.69595 3076.880       126.8152 3026.298       102.4558 502.1080 10.36426 498.1008 8.440792 4.007202       13.36656 
1 1 1 8   10 1  o 665.0835 8.575707 5395.698       138.9896 5284.974       216.4205 5473.422       181.3254 657.6766 13.50361 669.6006 11.11237 -11.92407      17.48806 
1 1 1 8   10 2  o 599.8325 7.765860 4388.049       113.5156 4337.599       177.9609 4422.657       147.3951 595.9604 12.25381 602.0041 10.04725 -6.043701      15.84624 
1 1 1 8   10 3  o 294.4564 4.100564 1056.728       29.42393 1015.654       45.31149 1086.678       38.69164 288.6208 6.442355 298.5729 5.317782 -9.952148      8.353607 
1 1 1 8   10 4  o 557.1235 7.251218 3785.111       98.44611 3826.812       156.6084 3757.866       126.5833 559.8256 11.47958 554.9577 9.360101 4.867920       14.81190 
1 1 1 8   10 5  o 559.4571 9.434837 3819.329       128.6285 3842.561       158.0421 3773.744       221.3832 560.9465 11.56153 555.0372 16.38560 5.909302       20.05384 
1 1 1 8   10 6  o 522.9689 10.87356 3339.303       138.5746 3342.044       195.9503 3336.561       195.9977 522.4156 15.40879 521.9837 15.42534 0.4318848      21.80303 
1 1 1 8   10 7  o 159.0799 4.600461 308.7227       17.81543 306.0457       24.97294 311.4970       25.42272 158.2917 6.487789 159.6941 6.546647 -1.402328      9.216832 
1 1 1 8   10 8  o 296.0342 9.473016 1070.759       68.25064 0.000000       0.000000 1070.759       68.25064 ?        ?        296.0342 9.473016 0.000000       9.473016 
1 1 1 8   10 9  o 147.2779 6.480783 265.0344       23.20259 0.000000       0.000000 265.0344       23.20259 ?        ?        147.2779 6.480783 0.000000       6.480783 
1 1 1 8   10 10 o 177.4405 6.994619 384.6564       30.18571 0.000000       0.000000 384.6564       30.18571 ?        ?        177.4405 6.994619 0.000000       6.994619 
1 1 1 8   10 11 o 371.6727 8.069043 1685.987       73.08340 1737.465       105.1989 1637.965       101.6058 376.8102 11.46986 365.8597 11.41035 10.95047       16.17881 
1 1 1 8   10 12 f 449.1172 7.725620 2461.979       84.55302 2356.119       142.9451 2518.949       104.8654 438.3871 13.39632 454.0838 9.476769 -15.69672      16.40946 
1 1 1 8   10 13 o 205.9340 4.183092 517.0394       20.99238 527.2383       37.96869 512.5493       25.19317 207.6810 7.514660 205.0099 5.042801 2.671082       9.049859 
1 1 1 8   10 14 o 184.4211 3.314227 414.5966       14.89460 438.3957       21.44529 392.4172       20.70264 189.5988 4.641519 179.3150 4.741920 10.28378       6.635474 
1 1 1 8   10 15 o 188.7946 3.388283 434.5483       15.58853 425.3689       21.61073 444.5054       22.50764 186.6769 4.754407 190.8261 4.844037 -4.149185      6.787421 
1 1 1 8   10 16 o 320.6596 4.979978 1254.745       38.91417 1289.236       55.72355 1221.913       54.36740 324.7903 7.040437 316.1945 7.055832 8.595856       9.967573 
1 1 1 8   10 17 o 255.6544 4.759211 797.7027       29.64998 779.1274       36.03736 836.6233       52.16449 252.5516 5.855538 261.2590 8.203631 -8.707443      10.07903 
1 1 1 8   10 18 o 122.5788 3.157532 183.3637       9.424051 177.5236       11.48445 195.4036       16.48961 120.5586 3.914282 126.3611 5.367241 -5.802521      6.642957 
1 1 1 8   10 19 o 152.8482 4.281301 285.4395       15.93104 285.4395       15.93104 0.000000       0.000000 152.8482 4.281301 ?        ?        0.000000       4.281301 
1 1 1 8   10 20 o 123.9674 2.878927 187.4412       8.697094 189.9773       11.96994 184.6051       12.65798 124.6853 3.944456 122.8806 4.233446 1.804756       5.786259 
1 1 1 8   10 21 o 116.9625 2.838754 166.8719       8.091152 164.6142       10.98155 169.5531       11.96710 116.0472 3.888722 117.7484 4.177209 -1.701248      5.707121 
1 1 1 8   10 22 o 53.01954 3.093665 34.41823       3.979738 31.46645       5.057769 39.21681       6.448721 50.58374 4.139265 56.43911 4.732286 -5.855370      6.287133 
1 1 1 8   10 23 o 129.4389 2.985014 204.4639       9.415588 201.0489       12.79721 208.4944       13.90268 128.1994 4.101595 130.5184 4.377292 -2.319046      5.998647 
1 1 1 8   10 24 o 49.82298 4.464648 30.60535       5.363268 32.56195       10.28137 29.87387       6.286356 50.64717 8.640018 49.09307 5.340611 1.554092       10.15736 
1 1 1 8   10 25 o 86.15062 2.936140 90.71033       6.155115 96.19421       8.360367 84.21996       9.095292 88.62029 3.880702 82.82871 4.523255 5.791573       5.959839 
1 1 1 8   10 26 o 125.8792 3.972550 194.0193       12.17070 179.8297       15.73774 215.1328       19.19712 120.9395 5.353226 132.1590 5.976246 -11.21947      8.023251 
1 1 1 8   10 27 o 114.8269 3.088274 161.1985       8.633781 155.4304       11.50982 168.6201       13.05581 112.5896 4.202397 117.2080 4.579803 -4.618446      6.215685 
1 1 1 8   10 28 o 79.16975 3.149752 76.72778       6.064627 83.87438       8.082531 67.52036       9.174165 82.66219 4.024496 73.96524 5.121449 8.696945       6.513510 
1 1 1 8   10 29 o 14.91205 6.062275 1.103461       3.451380 1.861202       4.183547 -0.5112407     6.107031 16.94017 6.747996 17.83508 7.699681 -0.8949146     10.23819 
1 1 1 8   10 30 o 28.95835 5.728909 10.70797       3.899572 15.67656       4.957355 2.643296       6.315784 35.13659 6.005243 20.54525 8.254809 14.59134       10.20808 
1 1 1 8   10 31 o 62.44243 4.028059 48.07018       6.096613 48.48983       6.935326 46.64314       12.78923 62.60968 4.577205 60.13468 9.003991 2.475006       10.10063 
1 1 1 8   10 32 o 102.0794 3.513053 128.0315       8.725922 141.3825       10.73460 102.0256       14.98182 107.1107 4.120288 90.02403 6.881360 17.08666       8.020592 
1 1 1 8   10 33 o 43.53819 4.301292 23.62463       4.504016 26.36482       5.743559 19.24840       7.258380 45.78139 5.242657 38.20787 8.050085 7.573521       9.606733 
1 1 1 8   10 34 o 26.18384 6.207083 8.980594       3.899861 6.399628       4.740144 14.38740       6.860737 22.65401 7.434567 32.67969 8.526607 -10.02568      11.31264 
1 1 1 8   10 35 o 22.73545 6.562264 6.794245       3.837147 8.088887       4.774696 4.433350       6.447765 24.71746 7.371573 21.67000 8.455163 3.047468       11.21739 
1 1 1 8   10 36 o 13.90576 6.373528 -2.790847      4.884237 7.287262       8.645718 -7.514927      5.919297 25.34367 9.818114 13.25229 6.357106 12.09138       11.69650 
1 1 1 8   10 37 o 16.79497 6.509674 2.743779       3.802161 4.209735       4.911630 0.5516844      6.006132 19.54892 7.444116 17.55057 7.606302 1.998350       10.64287 
1 1 1 8   10 38 o 51.75820 4.524600 34.64742       5.649514 35.19447       8.215945 34.15677       7.781021 50.36314 6.873539 49.86806 6.561999 0.4950829      9.502913 
1 1 1 8   10 39 o 34.36498 5.519929 16.19487       4.466105 20.92198       5.866791 9.680216       6.887286 38.36563 6.507417 24.81793 8.928557 13.54770       11.04833 
1 1 1 8   10 40 f 29.94181 5.871866 12.90890       4.131236 18.54135       5.495235 5.587801       6.265066 35.32512 6.626976 20.13597 8.174471 15.18916       10.52325 
1 1 1 8   10 41 o 12.40658 5.554670 -0.1532323     3.456807 3.343201       4.389295 -5.863789      5.609464 16.54295 6.793941 12.31830 5.977225 4.224653       9.049026 
1 1 1 8   10 42 f 22.89465 7.797745 9.786607       5.207866 9.786607       5.207866 0.000000       0.000000 22.89465 7.797745 ?        ?        0.000000       7.797745 
1 1 1 8   10 43 o 9.561185 4.631696 -3.638028      3.332196 -5.592569      4.638059 -1.552883      4.790512 10.65524 5.227055 12.57897 5.943589 -1.923737      7.915071 
1 1 1 8   10 44 o 10.23291 4.891343 -2.226143      3.437042 -0.4277758     4.735139 -4.228785      4.996836 12.66227 5.960303 11.24940 5.498936 1.412871       8.109470 
1 1 1 8   10 45 o 14.93472 6.111456 4.055966       3.535607 6.623647       4.646879 0.5260610      5.448442 17.11007 7.004553 13.14362 6.247746 3.966443       9.386058 
1 1 1 8   10 46 o 14.01999 6.533562 3.267150       5.454574 0.000000       0.000000 3.267150       5.454574 ?        ?        14.01999 6.533562 0.000000       6.533562 
1 1 1 8   11 0  o 409.9119 5.461180 2048.282       54.55231 2025.910       85.51962 2063.631       70.83561 407.5260 8.611411 411.3802 7.065975 -3.854218      11.13932 
1 1 1 8   11 1  o 214.9100 3.619769 562.8719       18.95717 537.4891       26.14435 591.0126       27.52812 209.9868 5.109164 220.1936 5.130217 -10.20685      7.240351 
1 1 1 8   11 2  f 299.2065 4.665388 1091.191       34.01691 1185.745       70.37071 1062.359       38.85862 311.6015 9.277699 295.2095 5.401582 16.39197       10.73558 
1 1 1 8   11 3  o 329.5275 5.030989 1323.645       40.39997 1336.023       57.55521 1311.623       56.72227 330.9944 7.135557 327.9595 7.097368 3.034973       10.06423 
1 1 1 8   11 4  o 623.7612 10.40546 4749.502       158.1670 4399.104       259.4431 4956.763       199.5350 598.9849 17.79393 636.9153 12.85587 -37.93048      21.95216 
1 1 1 8   11 5  o 994.0509 20.19752 12127.46       489.2633 12504.95       706.9173 11780.39       677.8438 1005.221 28.88828 975.8235 28.53573 29.39722       40.60567 
1 1 1 8   11 6  o 165.6165 6.726778 335.0382       27.09206 0.000000       0.000000 335.0382       27.09206 ?        ?        165.6165 6.726778 0.000000       6.726778 
1 1 1 8   11 7  o 946.2035 27.48285 11080.00       633.0266 0.000000       0.000000 11080.00       633.0266 ?        ?        946.2035 27.48285 0.000000       27.48285 
1 1 1 8   11 8  o 148.1021 4.551641 267.6258       16.40777 284.9456       23.47182 251.0743       22.94532 152.7299 6.320128 143.3317 6.586858 9.398224       9.128566 
1 1 1 8   11 9  o 417.2758 8.902262 2125.424       90.52315 2088.461       126.4133 2164.327       129.6876 413.0677 12.57307 420.4953 12.67059 -7.427612      17.85010 
1 1 1 8   11 10 o 318.1934 7.119101 1235.236       55.20169 1207.135       76.86495 1265.167       79.32722 314.1921 10.05209 321.6540 10.13303 -7.461884      14.27315 
1 1 1 8   11 11 o 154.7100 6.730976 292.5681       25.31582 0.000000       0.000000 292.5681       25.31582 ?        ?        154.7100 6.730976 0.000000       6.730976 
1 1 1 8   11 12 o 273.4870 6.392488 912.5826       42.60325 1024.884       64.25224 824.4705       56.91331 289.4798 9.119605 259.6195 9.009465 29.86026       12.81943 
1 1 1 8   11 13 o 334.1889 5.135839 1362.219       41.82535 1390.204       59.89404 1335.582       58.43298 337.4250 7.284004 330.7330 7.250106 6.692017       10.27720 
1 1 1 8   11 14 o 166.8630 3.759176 339.4862       15.28582 354.7051       28.45522 333.3130       18.12272 170.2889 6.871195 165.2532 4.504457 5.035675       8.216048 
1 1 1 8   11 15 o 197.8377 3.499665 477.2346       16.87219 452.8801       22.82694 506.5624       25.04939 192.5985 4.867510 203.7482 5.045071 -11.14964      7.010377 
1 1 1 8   11 16 o 70.64339 2.769709 60.93214       4.758821 61.20246       5.949571 60.45203       7.928891 70.75928 3.460872 70.23064 4.659209 0.5286484      5.803952 
1 1 1 8   11 17 o 115.9404 2.758067 163.8898       7.792482 167.8620       10.78440 159.5500       11.27225 117.2437 3.779533 114.2814 4.054037 2.962265       5.542570 
1 1 1 8   11 18 o 139.6067 2.959341 237.6830       10.06787 244.8605       14.11436 230.2480       14.36518 141.5836 4.095139 137.2724 4.299594 4.311142       5.937733 
1 1 1 8   11 19 o 106.3246 2.717369 137.9520       7.034974 132.8458       9.486607 144.1911       10.48624 104.2657 3.739704 108.6131 3.968554 -4.347382      5.452963 
1 1 1 8   11 20 f 57.44840 3.765360 40.45941       5.242279 40.45941       5.242279 0.000000       0.000000 57.44840 3.765360 ?        ?        0.000000       3.765360 
1 1 1 8   11 21 o 151.7836 3.103940 281.1030       11.48085 283.2724       15.89619 278.7374       16.59939 152.2111 4.289868 150.9583 4.517393 1.252792       6.229753 
1 1 1 8   11 22 o 106.5398 2.833551 138.5819       7.350101 133.6436       9.784347 144.9782       11.13546 104.5330 3.847546 108.8426 4.206211 -4.309601      5.700510 
1 1 1 8   11 23 o 37.69372 3.554735 17.50548       3.226661 17.79829       3.997533 16.95805       5.465871 37.89850 4.410794 36.65636 6.348763 1.242138       7.730582 
1 1 1 8   11 24 o 102.2887 2.852447 127.8004       7.103254 123.4197       9.464939 133.4494       10.74797 100.4134 3.875307 104.3743 4.234473 -3.960938      5.740101 
1 1 1 8   11 25 o 46.43077 5.691618 26.85194       6.305349 0.000000       0.000000 26.85194       6.305349 ?        ?        46.43077 5.691618 0.000000       5.691618 
1 1 1 8   11 26 o 187.2564 3.530253 428.6385       16.10937 406.9152       21.74459 455.0664       23.98384 182.1103 4.904290 192.5327 5.116386 -10.42238      7.087275 
1 1 1 8   11 27 o 144.6414 3.199797 255.6714       11.27850 263.1377       15.51393 247.3019       16.42549 146.4904 4.350688 141.9219 4.756052 4.568497       6.445814 
1 1 1 8   11 28 o 133.0672 3.157688 216.4560       10.23945 216.4916       13.86931 216.4134       15.18095 132.8268 4.290453 132.7092 4.701629 0.1175537      6.365006 
1 1 1 8   11 29 o 61.08712 3.458397 45.81697       5.127232 48.32184       6.602164 42.01067       8.138518 62.60377 4.354774 58.06774 5.830213 4.536030       7.277048 
1 1 1 8   11 30 o 84.61800 3.214695 87.75883       6.616801 92.79095       8.614263 80.51717       10.33384 86.85996 4.081111 80.63626 5.288087 6.223701       6.679770 
1 1 1 8   11 31 o 74.41203 3.568629 68.06396       6.452275 64.77992       7.597263 76.56304       12.22190 72.44073 4.323331 78.17739 6.473344 -5.736664      7.784303 
1 1 1 8   11 32 o 72.12601 3.767374 64.11927       6.598702 60.73014       7.420518 76.92802       14.42592 70.04953 4.368781 77.67873 7.723076 -7.629196      8.873114 
1 1 1 8   11 33 o 56.08581 3.677951 38.89581       4.999101 43.13390       6.483038 32.67973       7.851475 58.85276 4.555837 50.57632 6.522096 8.276443       7.955714 
1 1 1 8   11 34 f 71.42271 3.362958 63.00277       5.836770 66.92913       7.562452 57.21788       9.179415 73.32916 4.250255 67.23059 5.655265 6.098572       7.074368 
1 1 1 8   11 35 o 27.30051 7.671638 10.08615       5.314196 14.04941       9.328002 8.181712       6.466136 31.73417 10.43006 25.27686 8.686654 6.457304       13.57366 
1 1 1 8   11 36 o 46.66758 5.535705 28.24731       6.172929 38.97335       10.96824 23.27493       7.467919 52.68628 8.856758 41.15715 7.729684 11.52914       11.75543 
1 1 1 8   11 37 o 46.22454 4.764311 27.59240       5.289934 30.87454       7.697061 24.65440       7.282346 47.59138 6.832490 42.09687 7.367017 5.494503       10.04768 
1 1 1 8   11 38 o 32.01041 5.438860 13.82813       4.090983 11.84998       5.211837 17.00317       6.602932 28.46458 7.434051 33.71913 8.130929 -5.254553      11.01713 
1 1 1 8   11 39 o 33.59595 5.183476 15.38482       4.107332 19.29310       5.427450 10.14662       6.283389 36.84779 6.268603 25.16199 8.565258 11.68580       10.61410 
1 1 1 8   11 40 o 14.84119 6.107021 2.054441       3.555616 2.002647       4.508045 2.139701       5.783900 15.76927 6.706999 17.00020 7.414847 -1.230931      9.998190 
1 1 1 8   11 41 o 25.65859 7.022547 10.86356       4.518068 18.64944       5.349338 -8.512603      8.438788 34.53335 6.597080 14.25698 7.005357 20.27637       9.622707 
1 1 1 8   11 42 o 12.59850 5.725849 -0.1650189     3.836046 -0.4119006E-01 4.446486 -0.5254176     7.585732 13.39038 6.116108 15.67619 7.428423 -2.285807      9.622279 
1 1 1 8   11 43 o 13.62749 5.865952 1.939053       3.524433 10.18621       5.093065 -5.639400      4.882221 22.20586 7.705804 10.87294 5.339725 11.33292       9.375077 
1 1 1 8   11 44 o 12.20218 5.527595 0.7442207      3.539443 -0.9329327E-02 4.900622 1.565935       5.117474 12.88356 6.064184 13.87366 6.418112 -0.9900999     8.829864 
1 1 1 8   11 45 o 9.541216 4.647992 -3.204739      3.483603 -6.704591      4.794596 0.7088120      5.070055 9.886782 4.930723 12.92528 6.109421 -3.038499      7.850927 
1 1 1 8   12 0  o 835.6376 16.93931 8548.714       344.9449 8399.209       482.1199 8705.513       493.7393 826.0034 23.97712 840.8909 24.11964 -14.88751      34.00969 
1 1 1 8   12 1  o 634.7836 12.96130 4923.623       200.4981 4536.627       268.0189 5415.394       302.1303 608.2464 18.10228 664.4644 18.67745 -56.21796      26.01038 
1 1 1 8   12 2  f 560.7801 9.407948 3837.543       128.5652 3475.275       207.7754 4062.303       163.6582 532.6464 16.02556 576.7348 11.64462 -44.08838      19.80948 
1 1 1 8   12 3  o 139.8103 2.851318 238.2031       9.714514 236.5725       13.84049 239.7864       13.63853 139.2607 4.082781 140.2076 3.995794 -0.9469299     5.712746 
1 1 1 8   12 4  o 698.1831 8.998228 5948.283       153.0955 5998.357       243.3287 5915.473       196.9666 700.3287 14.25789 695.9100 11.61458 4.418701       18.38983 
1 1 1 8   12 5  o 651.2297 9.413816 5176.208       149.3950 5254.693       213.0820 5100.329       209.5160 655.5885 13.33765 645.8916 13.31133 9.696899       18.84368 
1 1 1 8   12 6  o 340.3999 7.346326 1413.381       60.93906 1358.359       85.37771 1470.523       87.00708 333.3523 10.52324 346.8777 10.30443 -13.52545      14.72820 
1 1 1 8   12 7  o 350.7580 7.683890 1500.984       65.67875 1572.924       95.29887 1435.902       90.64346 358.6675 10.91605 342.6796 10.86830 15.98785       15.40390 
1 1 1 8   12 8  o 687.5757 14.12371 5787.307       236.6494 6070.263       345.4869 5537.199       324.8144 702.1890 20.21127 670.7314 19.89440 31.45764       28.35987 
1 1 1 8   12 9  o 284.8675 6.546929 989.8560       45.44820 984.0274       63.81335 995.8558       64.74366 283.7226 9.241903 285.4166 9.321050 -1.694000      13.12611 
1 1 1 8   12 10 o 278.3489 6.451888 945.1669       43.76354 992.8091       63.55224 902.1998       60.35357 284.9573 9.163894 271.6324 9.130679 13.32492       12.93624 
1 1 1 8   12 11 o 167.0148 4.881627 340.4321       19.84675 384.4859       29.29753 303.0708       26.98051 177.3731 6.790631 157.4263 7.050832 19.94678       9.789122 
1 1 1 8   12 12 o 175.8054 7.096431 377.9464       30.33995 0.000000       0.000000 377.9464       30.33995 ?        ?        175.8054 7.096431 0.000000       7.096431 
1 1 1 8   12 13 o 211.2498 4.271353 544.2142       21.98861 564.0370       40.24207 535.7767       26.25447 214.7193 7.703313 209.5656 5.140995 5.153641       9.261256 
1 1 1 8   12 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 8   12 15 o 46.71684 4.195494 26.83704       4.725497 22.69377       9.646406 28.14526       5.420424 42.19773 9.598153 47.79552 4.715175 -5.597786      10.69380 
1 1 1 8   12 16 o 173.6185 3.240902 367.5865       13.71191 363.3328       19.07855 372.1313       19.72051 172.4822 4.543005 174.5509 4.640293 -2.068649      6.493937 
1 1 1 8   12 17 o 268.4366 4.328112 879.5432       28.31238 838.7356       38.76077 926.2193       41.45431 261.9116 6.072977 275.2149 6.181041 -13.30334      8.665236 
1 1 1 8   12 18 o 237.0597 3.960238 685.9153       22.87784 689.2935       32.19202 682.4683       32.51877 237.4437 5.563544 236.2529 5.648340 1.190796       7.928226 
1 1 1 8   12 19 o 222.2223 3.808950 602.7922       20.62667 607.4116       29.01853 598.0747       29.32491 222.8772 5.342857 221.1430 5.441611 1.734268       7.626091 
1 1 1 8   12 20 o 221.9419 4.454384 601.8357       24.09146 613.6313       29.19567 576.6649       42.64874 223.9705 5.349232 216.4199 8.101029 7.550598       9.707778 
1 1 1 8   12 21 o 147.7877 3.453944 266.6124       12.43912 270.5988       15.43108 259.2152       21.02026 148.7568 4.261194 145.3417 5.947440 3.415054       7.316407 
1 1 1 8   12 22 o 73.62151 2.795440 66.22661       5.006120 61.54830       6.523538 72.92808       7.807709 70.88338 3.790398 77.13602 4.169148 -6.252647      5.634617 
1 1 1 8   12 23 o 229.9970 3.942178 646.4979       22.09503 636.9005       30.56719 656.9995       31.97447 227.9565 5.502594 231.4838 5.668219 -3.527359      7.899826 
1 1 1 8   12 24 o 53.01447 3.403125 34.47201       4.373294 34.07804       5.780916 34.99917       6.687121 52.57120 4.557429 53.18464 5.227070 -0.6134338     6.934870 
1 1 1 8   12 25 o 151.0185 3.876075 279.0873       14.25277 269.5003       25.47882 283.4537       17.19481 147.6511 7.102020 152.0537 4.645945 -4.402603      8.486666 
1 1 1 8   12 26 o 54.91391 3.333497 36.98863       4.439848 32.43232       5.721186 43.88703       7.039688 51.23725 4.632076 59.62538 4.887780 -8.388126      6.733983 
1 1 1 8   12 27 o 45.12490 3.668664 25.07462       3.999454 27.24680       5.011706 21.26546       6.636692 46.94313 4.433564 40.94652 6.895957 5.996609       8.198214 
1 1 1 8   12 28 o 71.28081 3.174169 62.24632       5.499815 57.65486       6.910844 70.17712       9.082677 68.45921 4.162173 75.41056 4.970198 -6.951347      6.482789 
1 1 1 8   12 29 o 68.39668 3.520873 57.43335       5.848674 62.10785       6.987732 46.49732       10.68806 71.04804 4.052782 60.69935 7.376960 10.34869       8.416923 
1 1 1 8   12 30 o 148.4240 3.690075 270.0934       13.34674 254.5517       15.81098 308.6246       24.89523 143.7995 4.517562 157.5092 6.499923 -13.70969      7.915640 
1 1 1 8   12 31 o 125.1959 3.168119 192.1667       9.657809 189.8929       12.98362 194.9832       14.45019 124.1305 4.298700 125.6367 4.728211 -1.506149      6.390211 
1 1 1 8   12 32 o 51.59295 4.182781 33.02552       5.213797 30.95822       5.796396 41.78638       11.93245 49.78860 4.838344 56.45694 8.973061 -6.668339      10.19438 
1 1 1 8   12 33 o 21.71504 6.467739 6.046845       3.677480 5.852872       4.479298 6.447940       6.441142 21.83050 7.229984 23.86888 8.628304 -2.038382      11.25701 
1 1 1 8   12 34 o 48.16103 5.474183 29.54071       6.310806 34.47383       11.06985 27.16548       7.681280 50.16185 9.401249 45.47399 7.168775 4.687862       11.82264 
1 1 1 8   12 35 o 17.01253 6.368671 2.977486       3.560132 3.167075       4.439466 2.635882       5.959170 18.25209 7.044988 19.45878 7.945115 -1.206688      10.61870 
1 1 1 8   12 36 o 27.33315 6.750436 10.23509       4.469357 7.703127       5.992396 13.40926       6.709461 24.09416 8.358646 30.56319 8.631218 -6.469034      12.01519 
1 1 1 8   12 37 o 29.11688 7.416335 12.11971       5.275936 8.757873       8.998448 13.88080       6.512839 25.57383 9.985588 30.61098 8.452755 -5.037151      13.08285 
1 1 1 8   12 38 o 19.79396 6.426647 5.420498       3.546642 3.113347       4.412680 9.630647       5.960917 17.41689 6.932813 25.18345 8.340439 -7.766554      10.84559 
1 1 1 8   12 39 o 16.61434 6.353484 3.343971       3.587605 1.586186       4.670758 5.873216       5.602735 15.88441 6.793526 20.46627 7.910405 -4.581860      10.42720 
1 1 1 8   12 40 o 16.46797 6.296228 3.576659       3.522764 2.917776       4.583438 4.527648       5.506495 16.50144 6.874789 18.48331 7.602218 -1.981871      10.24970 
1 1 1 8   12 41 o 11.07324 5.158920 -1.693487      3.397105 3.013732       4.360383 -8.963073      5.418726 15.99481 6.687682 10.92520 5.413519 5.069602       8.604143 
1 1 1 8   12 42 f 14.11689 5.989803 2.074468       3.580714 2.332712       4.835746 1.761006       5.327716 15.26533 6.715525 15.19669 6.842314 0.6864357E-01  9.587259 
1 1 1 8   12 43 o 13.81283 6.089316 1.886789       3.995446 7.300873       4.984027 -7.849483      6.683659 18.85534 7.411007 11.94177 5.933515 6.913573       9.493662 
1 1 1 8   12 44 o 20.13777 6.645354 8.060700       3.785231 4.289676       5.220253 12.24168       5.496688 15.44943 6.877545 22.34360 7.983799 -6.894164      10.53763 
1 1 1 8   12 45 o 12.65704 5.674131 1.799120       3.619768 -0.5110690     4.961434 4.428277       5.292876 12.18521 5.838559 14.93299 6.762590 -2.747774      8.934282 
1 1 1 8   13 0  o 449.5270 6.666401 2464.123       73.02699 2182.630       135.2928 2579.855       86.74969 422.3843 13.16016 459.8988 7.740510 -37.51453      15.26779 
1 1 1 8   13 1  o 654.3124 8.459870 5223.263       134.8916 5007.866       207.3092 5381.419       177.6401 640.0678 13.29097 663.8487 10.98084 -23.78088      17.24032 
1 1 1 8   13 2  o 588.4550 7.643174 4223.817       109.6032 4273.000       174.4728 4191.756       140.8682 591.3862 12.10655 586.0053 9.864506 5.380859       15.61656 
1 1 1 8   13 3  o 396.9430 5.939826 1921.131       57.45634 1928.726       81.44006 1913.605       81.07227 397.5917 8.405521 396.0304 8.400551 1.561310       11.88369 
1 1 1 8   13 4  o 431.6943 5.747407 2272.202       60.46226 2229.839       94.07503 2302.015       78.92052 427.4428 9.031507 434.4188 7.454958 -6.976013      11.71087 
1 1 1 8   13 5  o 511.0315 8.612132 3187.006       107.2493 3139.037       130.3383 3287.587       188.7348 506.9721 10.54999 518.0002 14.96723 -11.02811      18.31175 
1 1 1 8   13 6  o 248.2860 4.592812 751.4803       27.78863 742.9301       46.59712 756.1995       34.61819 246.6389 7.762516 249.0322 5.704435 -2.393341      9.633132 
1 1 1 8   13 7  o 119.5949 4.350572 174.5843       12.65817 161.8660       16.96880 190.5410       19.00676 115.0475 6.074063 124.8357 6.267940 -9.788162      8.728190 
1 1 1 8   13 8  o 419.9974 8.976098 2153.921       91.86926 2195.792       131.2101 2113.653       128.6725 423.4133 12.73094 415.4121 12.72574 8.001221       18.00059 
1 1 1 8   13 9  o 285.8824 6.586284 997.1086       45.88428 998.8654       64.68580 995.3295       65.09648 285.8006 9.300117 285.2853 9.376321 0.5153198      13.20635 
1 1 1 8   13 10 o 335.9392 7.476814 1377.694       61.20873 1541.539       92.57392 1250.430       81.58765 354.8394 10.71813 319.5836 10.49042 35.25589       14.99757 
1 1 1 8   13 11 o 334.8813 7.461095 1369.448       60.88771 1306.063       83.44320 1441.632       89.04607 326.5207 10.50048 343.0366 10.66513 -16.51593      14.96680 
1 1 1 8   13 12 o 302.5896 9.765453 1121.746       71.91399 1121.746       71.91399 0.000000       0.000000 302.5896 9.765453 ?        ?        0.000000       9.765453 
1 1 1 8   13 13 f 204.1296 6.730196 509.5297       33.43303 0.000000       0.000000 509.5297       33.43303 ?        ?        204.1296 6.730196 0.000000       6.730196 
1 1 1 8   13 14 o 289.9758 4.584035 1025.940       32.39259 983.2280       65.18398 1039.947       37.32793 283.0916 9.462123 291.8867 5.247876 -8.795166      10.81998 
1 1 1 8   13 15 o 75.70194 2.219436 69.91284       4.089938 72.32417       6.804111 68.54868       5.117697 76.91904 3.640286 74.93094 2.807671 1.988106       4.597249 
1 1 1 8   13 16 o 536.9623 7.891722 3533.021       103.2646 3513.786       145.4255 3552.584       146.6589 533.9890 11.17563 536.9109 11.20908 -2.921875      15.82840 
1 1 1 8   13 17 o 107.1844 2.731064 140.1821       7.127639 140.0353       9.950462 140.3369       10.21474 107.0548 3.820303 107.1624 3.918145 -0.1076202     5.472346 
1 1 1 8   13 18 o 287.0362 4.575407 1006.400       32.00387 991.9800       44.74972 1021.497       45.78878 284.6197 6.451925 288.8111 6.505925 -4.191437      9.162663 
1 1 1 8   13 19 f 111.0292 2.774140 150.3577       7.505879 148.9428       10.32944 151.9407       10.92546 110.3868 3.845805 111.4765 4.028421 -1.089676      5.569416 
1 1 1 8   13 20 o 260.0714 4.264523 826.3347       27.02707 859.0398       38.80056 795.5100       37.66868 264.8179 6.012492 254.8255 6.065986 9.992371       8.540857 
1 1 1 8   13 21 o 82.59550 3.279053 83.40134       6.586837 79.20286       7.390835 99.61035       14.52198 80.44101 3.780915 89.84217 6.680808 -9.401161      7.676491 
1 1 1 8   13 22 o 127.4436 3.758839 198.5896       11.66092 202.1795       15.86843 194.3753       17.19319 128.4075 5.081191 125.8113 5.622109 2.596283       7.578035 
1 1 1 8   13 23 o 94.10673 3.115633 108.2427       7.135164 103.6903       10.29249 112.4547       9.900229 91.93248 4.608958 95.79586 4.251534 -3.863380      6.270410 
1 1 1 8   13 24 o 138.6898 3.074951 234.8794       10.39247 242.0309       14.41167 227.1317       15.00034 140.5887 4.211315 136.1354 4.527918 4.453262       6.183625 
1 1 1 8   13 25 f 72.75343 2.920375 64.73848       5.167076 64.81268       6.692948 64.62900       8.129437 72.70103 3.790913 72.48496 4.626466 0.2160645      5.981237 
1 1 1 8   13 26 o 88.07751 3.777866 95.08121       8.089781 87.77963       15.19975 97.96698       9.555621 83.88275 7.515355 89.31343 4.404001 -5.430679      8.710670 
1 1 1 8   13 27 o 33.56421 4.315098 14.03164       3.447858 11.51530       4.215839 19.11414       5.991544 30.05685 5.966339 38.82639 6.566375 -8.769541      8.872118 
1 1 1 8   13 28 o 88.81036 3.261096 96.60679       7.045716 95.14275       8.441370 99.96923       12.79276 88.02722 3.945162 89.82569 5.876504 -1.798470      7.077966 
1 1 1 8   13 29 o 99.34586 3.046306 120.8389       7.366241 118.9366       9.633196 123.5173       11.43083 98.38262 4.026564 100.1115 4.698629 -1.728836      6.187918 
1 1 1 8   13 30 o 81.76690 3.084665 81.96374       6.135391 81.04486       7.964560 83.30487       9.622066 81.12931 4.041265 82.07302 4.832344 -0.9437103     6.299474 
1 1 1 8   13 31 o 57.37497 3.430095 40.53461       4.773946 39.43248       5.979247 42.47263       7.928800 56.39890 4.384936 58.22430 5.659456 -1.825394      7.159407 
1 1 1 8   13 32 o 109.4802 3.100697 147.2057       8.264061 142.8841       10.75409 153.4382       12.91459 107.5379 4.111279 111.1770 4.777979 -3.639191      6.303309 
1 1 1 8   13 33 o 49.62979 5.290497 31.12834       6.299926 25.84917       10.59708 34.01401       7.834773 43.19605 10.22656 51.50234 6.378805 -8.306293      12.05287 
1 1 1 8   13 34 o 57.27050 3.550678 40.73134       4.931025 36.82132       6.239754 47.23445       8.047076 54.02209 4.789376 60.92982 5.478082 -6.907726      7.276503 
1 1 1 8   13 35 o 105.4907 3.570240 138.4821       9.164762 131.2079       13.28430 145.0887       12.66009 101.3299 5.399275 107.0314 4.866619 -5.701454      7.268848 
1 1 1 8   13 36 o 17.93164 6.433079 3.822883       3.572567 5.340988       4.352196 0.6867929      6.255352 20.47204 7.122214 17.93939 7.768692 2.532646       10.53938 
1 1 1 8   13 37 o 15.58785 6.839088 0.2866239E-01  4.984820 3.512226       8.732657 -1.655049      6.071114 21.60367 9.265379 15.92613 7.224429 5.677539       11.74903 
1 1 1 8   13 38 o 23.35043 6.479672 7.877651       3.816770 15.26224       4.983117 -2.603615      5.936695 32.69934 6.482655 14.90418 6.901118 17.79515       9.468381 
1 1 1 8   13 39 o 8.256754 4.097536 -6.751122      3.149713 -3.556094      4.261181 -10.59925      4.676460 11.73942 5.564276 9.694145 4.840092 2.045279       7.374799 
1 1 1 8   13 40 o 16.19679 6.563962 3.179267       4.031556 4.891356       4.776933 -1.059053      7.515933 18.32670 7.239328 16.21718 7.594053 2.109524       10.49178 
1 1 1 8   13 41 o 13.45347 5.816129 1.226312       3.494153 -0.1581080     4.688896 2.955180       5.239836 13.73137 6.275183 16.34720 7.094538 -2.615831      9.471557 
1 1 1 8   13 42 o 16.24666 6.353871 4.156649       3.648109 8.925411       5.166537 -0.5851372     5.151904 21.12149 7.714029 13.51117 6.314013 7.610321       9.968601 
1 1 1 8   13 43 o 14.20482 6.209885 2.482497       4.077057 -2.016550      4.805274 14.04431       7.703197 12.04043 5.762958 21.90349 8.998430 -9.863059      10.68567 
1 1 1 8   13 44 o 12.00002 5.451770 0.7758792      3.473506 0.8940525      4.938375 0.6601712      4.886593 13.15932 6.160047 13.00334 6.100042 0.1559782      8.669296 
1 1 1 8   13 45 o 15.26812 6.416631 4.808007       4.045702 3.751740       6.218593 5.583173       5.327242 14.51893 6.833071 15.56186 6.936357 -1.042921      9.736730 
1 1 1 8   14 0  o 182.4388 3.002121 405.6179       13.34693 398.0718       20.63704 411.0438       17.49946 180.6499 4.691821 183.6436 3.910323 -2.993744      6.107685 
1 1 1 8   14 1  o 253.9357 4.174240 785.9692       25.83076 761.2035       50.88414 794.5669       29.98104 249.6310 8.376515 255.3060 4.818918 -5.675003      9.663746 
1 1 1 8   14 2  o 655.5804 9.476955 5246.439       151.4017 5299.572       215.6699 5194.813       212.5921 658.2734 13.44458 651.7454 13.38545 6.528015       18.97174 
1 1 1 8   14 3  o 426.4214 5.690583 2217.109       59.13327 2121.857       90.43588 2288.248       78.15582 416.9507 8.900613 433.1039 7.405136 -16.15320      11.57830 
1 1 1 8   14 4  o 630.8864 8.176523 4856.974       125.7060 4924.761       200.2819 4812.913       161.4721 634.5500 12.95209 627.7019 10.55621 6.848083       16.70898 
1 1 1 8   14 5  o 678.5995 9.802302 5623.855       162.0980 5300.586       219.9630 6008.068       239.8022 658.0820 13.71619 700.5479 14.04686 -42.46588      19.63283 
1 1 1 8   14 6  o 299.7794 4.167938 1095.480       30.44802 1187.505       50.75177 1043.732       38.05789 312.0074 6.674985 292.5712 5.337982 19.43619       8.546898 
1 1 1 8   14 7  o 216.7164 3.661814 572.4719       19.33856 539.6642       39.04851 583.1335       22.26012 210.1437 7.637919 218.7127 4.176548 -8.569031      8.705249 
1 1 1 8   14 8  f 364.1667 6.420965 1617.964       56.98187 1457.805       93.29364 1713.263       71.96493 345.0519 11.10959 374.6152 7.883142 -29.56335      13.62229 
1 1 1 8   14 9  o 351.3576 10.93985 1512.062       93.55511 1512.062       93.55511 0.000000       0.000000 351.3576 10.93985 ?        ?        0.000000       10.93985 
1 1 1 8   14 10 o 94.88032 6.232879 110.3346       14.33142 110.3346       14.33142 0.000000       0.000000 94.88032 6.232879 ?        ?        0.000000       6.232879 
1 1 1 8   14 11 o 364.2420 8.013731 1621.514       71.13132 1604.671       99.59840 1639.050       101.6219 361.6207 11.31613 365.4528 11.42493 -3.832092      16.08054 
1 1 1 8   14 12 o 289.8365 6.707594 1026.120       47.37573 1122.422       70.41576 946.4770       64.03645 302.5938 9.561347 277.8579 9.471172 24.73596       13.45817 
1 1 1 8   14 13 o 122.5006 3.310843 183.1081       9.874490 223.9513       20.52400 170.8064       11.26382 135.2594 6.243549 118.2760 3.913375 16.98339       7.368610 
1 1 1 8   14 14 o 231.3568 4.403243 653.1445       24.82510 0.000000       0.000000 653.1445       24.82510 ?        ?        231.3568 4.403243 0.000000       4.403243 
1 1 1 8   14 15 o 280.7180 3.984842 961.5247       27.25948 976.3041       43.88369 952.2388       34.78432 282.5565 6.373260 279.2320 5.111900 3.324585       8.170066 
1 1 1 8   14 16 o 115.8113 2.758557 163.5490       7.785186 178.3743       19.25990 160.6535       8.511535 120.5484 6.581227 114.7314 3.047012 5.817062       7.252367 
1 1 1 8   14 17 o 164.2002 3.197531 328.9057       12.79454 331.0248       18.10505 326.7917       18.08339 164.5690 4.518836 163.5099 4.542770 1.059158       6.407546 
1 1 1 8   14 18 f 218.7488 3.767049 584.1102       20.08089 597.2031       28.62544 571.4241       28.17719 220.9860 5.315588 216.1588 5.349197 4.827179       7.541180 
1 1 1 8   14 19 o 186.2425 3.423645 423.3405       15.53831 417.6429       21.72714 429.3052       22.23047 184.7698 4.829566 187.3266 4.873960 -2.556854      6.861501 
1 1 1 8   14 20 o 143.3160 3.041771 250.6300       10.62324 250.2353       14.79063 251.0505       15.26780 143.0409 4.247876 143.2573 4.378585 -0.2163696     6.100529 
1 1 1 8   14 21 o 164.0294 4.548988 329.2897       18.16574 337.3685       23.77384 317.9549       28.15997 165.7831 5.894063 160.6395 7.211946 5.143509       9.314083 
1 1 1 8   14 22 o 216.8411 3.811338 574.5599       20.13980 592.8547       28.68093 556.7640       28.28712 219.9607 5.350718 213.0690 5.452420 6.891617       7.639311 
1 1 1 8   14 23 o 38.77825 3.746143 18.54862       3.496021 16.87738       4.150030 22.63338       6.488058 36.82937 4.733338 42.43231 6.479674 -5.602940      8.024380 
1 1 1 8   14 24 o 56.24829 3.050501 38.75053       4.165703 34.01958       5.260912 46.70246       6.820607 52.56904 4.140110 61.58599 4.577427 -9.016953      6.171981 
1 1 1 8   14 25 o 127.9577 3.017492 199.9927       9.409115 193.9391       12.72958 207.2833       13.96972 125.7989 4.158131 130.0122 4.415686 -4.213280      6.065339 
1 1 1 8   14 26 o 37.61192 5.843920 17.81382       5.182507 16.76930       10.35899 18.16253       5.985404 36.20905 10.87181 37.80263 6.744782 -1.593578      12.79407 
1 1 1 8   14 27 o 72.00633 3.271153 63.53651       5.724953 61.27633       6.817895 68.94022       10.54206 70.61420 3.978158 74.56277 5.848638 -3.948570      7.073351 
1 1 1 8   14 28 o 99.35462 2.955192 120.7984       7.147052 116.4513       9.459991 126.5794       10.90911 97.37411 3.995162 101.4379 4.423830 -4.063828      5.960838 
1 1 1 8   14 29 o 133.3444 3.157539 217.6204       10.26029 219.8036       13.88287 214.9926       15.23116 133.6991 4.266492 132.0856 4.739649 1.613525       6.377086 
1 1 1 8   14 30 o 49.82042 3.595928 30.61018       4.336330 30.14538       5.403944 31.45066       7.266757 49.26052 4.553198 49.95709 6.095125 -0.6965675     7.608033 
1 1 1 8   14 31 o 115.4561 3.108745 163.5727       8.738617 158.5491       11.51881 170.3842       13.41284 113.3463 4.177414 117.3096 4.701448 -3.963318      6.289229 
1 1 1 8   14 32 o 60.26331 4.589716 45.26857       6.689533 35.60277       11.43186 50.30179       8.249378 51.52941 9.452078 63.27777 5.401349 -11.74836      10.88652 
1 1 1 8   14 33 o 40.62154 4.663547 20.82198       4.532828 23.09632       5.017385 10.72398       10.57226 42.73283 4.907083 29.71805 11.00387 13.01479       12.04843 
1 1 1 8   14 34 o 78.67971 3.532450 76.85197       6.755632 65.49158       9.172870 90.31775       9.986747 71.79588 5.279805 84.62108 4.863429 -12.82520      7.178390 
1 1 1 8   14 35 o 27.85343 5.576166 10.27691       3.652721 11.62951       4.399800 7.277005       6.552399 29.38027 6.332101 23.97500 8.697505 5.405272       10.75835 
1 1 1 8   14 36 o 42.02921 4.145337 22.55707       4.190464 18.13944       5.100508 31.73174       7.350447 36.80411 5.885142 48.53487 6.368232 -11.73075      8.671175 
1 1 1 8   14 37 o 10.60740 4.945036 -2.407124      3.129185 -0.5815073     3.794078 -6.290497      5.533577 13.23388 5.878915 12.78399 6.136140 0.4498930      8.497873 
1 1 1 8   14 38 o 22.72571 7.561846 7.809014       4.898518 9.437883       9.167008 7.158007       5.795316 24.41470 9.896624 21.99932 8.146818 2.415380       12.81849 
1 1 1 8   14 39 o 14.95724 6.093696 2.218264       3.496149 1.340179       4.026030 4.911004       7.050270 14.67503 6.292427 19.69941 8.383397 -5.024377      10.48217 
1 1 1 8   14 40 o 24.55416 6.080424 9.277722       3.618968 11.44707       4.691935 6.091593       5.686162 26.28394 7.141110 19.46794 7.828866 6.816000       10.59654 
1 1 1 8   14 41 o 12.91984 5.642745 0.9278066      3.359379 1.014625       4.392376 0.8054491      5.214456 14.10008 6.290706 14.69151 6.676580 -0.5914307     9.173315 
1 1 1 8   14 42 o 10.96227 5.128702 -1.334984      3.415197 0.3403544      4.615514 -3.362127      5.077044 13.40827 6.164011 11.99944 5.789437 1.408827       8.456513 
1 1 1 8   14 43 o 11.40524 5.255188 -0.1748298     3.381824 -1.528180      4.678548 1.306016       4.893965 12.00614 5.730113 13.67830 6.309472 -1.672157      8.523124 
1 1 1 8   14 44 o 13.79245 6.224189 2.550165       4.437461 7.895985       5.796517 -5.018189      6.897008 17.48571 7.524697 12.15465 6.037292 5.331052       9.647278 
1 1 1 8   15 0  o 503.1673 6.617239 3087.844       81.13820 2972.391       124.9201 3172.094       106.7125 493.3181 10.39129 509.8148 8.589475 -16.49680      13.48176 
1 1 1 8   15 1  o 599.6263 7.801246 4387.053       113.9937 4688.520       188.3091 4212.679       143.2160 619.2144 12.47941 587.3248 10.00638 31.88959       15.99573 
1 1 1 8   15 2  o 478.2668 7.075450 2790.375       82.46325 2650.806       159.6349 2841.175       96.30829 465.1222 14.10024 482.5033 8.190819 -17.38113      16.30663 
1 1 1 8   15 3  o 182.6537 3.329129 406.6143       14.81819 404.0969       20.75722 409.2307       21.16079 182.0027 4.683994 183.1531 4.745123 -1.150375      6.667532 
1 1 1 8   15 4  o 138.9897 2.681190 235.4254       9.081265 239.7445       13.96691 232.2622       11.95274 140.1816 4.092968 137.9971 3.557328 2.184494       5.422819 
1 1 1 8   15 5  o 483.7498 7.123209 2855.419       83.97162 2745.609       115.6017 2978.078       122.1786 474.0266 10.00750 493.6658 10.15608 -19.63928      14.25819 
1 1 1 8   15 6  o 505.6371 7.385379 3120.414       91.00135 3080.455       128.0592 3161.177       129.3411 501.9649 10.46890 508.5044 10.43772 -6.539459      14.78323 
1 1 1 8   15 7  o 24.38665 4.421460 7.475928       2.530838 19.05646       8.006968 6.190544       2.667598 38.73598 8.696061 22.09114 5.063737 16.64483       10.06295 
1 1 1 8   15 8  o 147.8715 3.294752 266.5360       11.87253 228.1668       21.80587 282.7027       14.15446 136.5728 6.571271 152.2313 3.818528 -15.65854      7.600182 
1 1 1 8   15 9  o 130.6073 3.314750 208.0793       10.54152 212.7332       19.89361 206.2623       12.43010 131.8775 6.207651 130.0057 3.928027 1.871780       7.346042 
1 1 1 8   15 10 o 210.2119 4.232134 538.9033       21.67968 548.2052       39.15829 534.7917       26.03369 211.6716 7.603810 209.3659 5.102627 2.305695       9.157223 
1 1 1 8   15 11 o 178.6892 3.863902 389.3816       16.82521 396.9610       30.86326 386.1765       20.06976 180.1039 7.045652 177.8587 4.634481 2.245224       8.433246 
1 1 1 8   15 12 o 190.4081 4.006772 442.2195       18.59157 468.6045       34.62193 431.5283       22.03864 195.6342 7.274910 187.9867 4.814809 7.647461       8.723916 
1 1 1 8   15 13 o 65.14232 2.524451 51.80781       3.999847 53.54506       11.28028 51.55797       4.277807 65.77966 7.152079 64.97507 2.707640 0.8045883      7.647454 
1 1 1 8   15 14 o 361.4247 5.520854 1595.948       48.62506 1584.242       99.02045 1599.668       55.81867 358.3608 11.35315 361.6910 6.332943 -3.330200      13.00001 
1 1 1 8   15 15 o 384.1130 8.103814 1809.749       75.85506 0.000000       0.000000 1809.749       75.85506 ?        ?        384.1130 8.103814 0.000000       8.103814 
1 1 1 8   15 16 o 139.2720 2.580075 236.5187       8.756537 258.3927       14.80266 224.7438       10.86059 145.4199 4.181490 135.7289 3.283560 9.690948       5.316636 
1 1 1 8   15 17 o 68.01153 2.293288 56.46162       3.795384 61.09815       6.510761 54.07504       4.671155 70.64677 3.795779 66.52088 2.888461 4.125885       4.769816 
1 1 1 8   15 18 o 44.18048 3.139263 23.93527       3.357809 22.44098       4.738482 25.44246       4.758902 42.60275 4.639049 45.42981 4.351769 -2.827057      6.360713 
1 1 1 8   15 19 o 65.72701 3.016235 52.82139       4.818212 55.14953       7.379431 51.09134       6.361323 67.01839 4.545379 64.54579 4.064944 2.472595       6.097888 
1 1 1 8   15 20 o 90.66520 3.014100 100.4257       6.650132 100.1539       10.21616 100.6256       8.760234 90.37592 4.654407 90.66652 3.974561 -0.2905960     6.120510 
1 1 1 8   15 21 o 113.2730 3.427243 156.8276       9.449476 152.4309       10.85876 170.5449       19.18017 111.6088 3.998972 117.6179 6.719764 -6.009071      7.819655 
1 1 1 8   15 22 f 113.3001 2.885713 156.7878       7.960970 153.0018       10.85799 161.1891       11.70691 111.7995 3.991820 114.7283 4.194374 -2.928795      5.790284 
1 1 1 8   15 23 o 140.2966 3.099453 240.3682       10.59664 235.2908       14.53677 246.1255       15.47944 138.5957 4.309335 141.7224 4.487747 -3.126785      6.221755 
1 1 1 8   15 24 o 165.3539 3.729810 334.3515       15.02925 335.8386       18.66704 331.6111       25.33975 165.4957 4.633194 163.9950 6.352691 1.500641       7.862771 
1 1 1 8   15 25 o 58.25825 3.144109 41.59109       4.447122 44.72743       5.861618 37.33732       6.826418 60.31742 4.010630 54.91085 5.162055 5.406570       6.536969 
1 1 1 8   15 26 o 97.25639 4.404842 116.2044       10.41252 111.3305       16.86056 119.2093       13.23875 94.48910 7.380934 98.27364 5.550638 -3.784538      9.235138 
1 1 1 8   15 27 o 99.74486 3.748137 122.0211       9.094290 105.2559       16.62921 129.1750       10.86266 91.70773 7.506596 102.5148 4.358183 -10.80708      8.680019 
1 1 1 8   15 28 o 84.72606 2.971118 87.89645       6.124919 83.74595       8.131764 93.33856       9.311485 82.52298 4.056079 87.06240 4.403161 -4.539421      5.986619 
1 1 1 8   15 29 o 23.91306 5.768743 7.361000       3.322598 6.474669       4.107441 9.038942       5.651477 22.68244 6.853752 26.65725 8.036055 -3.974812      10.56182 
1 1 1 8   15 30 o 42.50187 3.891486 22.38908       3.985824 20.23883       4.897645 26.60636       6.858978 40.13379 5.124469 45.78931 6.314907 -5.655521      8.132542 
1 1 1 8   15 31 o 58.10333 4.673531 42.05147       6.561546 46.99749       12.34214 40.10275       7.747066 59.94209 8.703530 56.42902 5.712360 3.513073       10.41069 
1 1 1 8   15 32 o 43.71200 3.865048 23.78118       4.074723 23.00243       5.079615 25.18672       6.824263 42.69148 4.975794 44.17723 6.535992 -1.485748      8.214482 
1 1 1 8   15 33 o 77.01016 4.218619 74.00478       7.886650 74.82513       9.289561 71.88727       14.92482 77.08705 4.971641 73.33937 8.508670 3.747681       9.854677 
1 1 1 8   15 34 o 14.96539 5.866306 1.871055       3.115713 2.168850       3.660624 1.088146       5.935433 16.11332 6.345827 18.13181 7.703278 -2.018490      9.980481 
1 1 1 8   15 35 o 27.94242 5.561755 10.39222       3.653934 11.44401       4.341246 7.836773       6.766809 29.04618 6.313800 24.44341 8.842683 4.602764       10.86541 
1 1 1 8   15 36 o 10.62216 4.936925 -2.324368      3.081915 -0.4472669     3.699798 -6.579207      5.570264 13.28113 5.857111 12.82783 6.156991 0.4533062      8.497899 
1 1 1 8   15 37 o 12.34965 5.435774 -0.2577926     3.172238 0.4059898      3.847136 -1.667799      5.607059 14.06461 6.091568 15.06446 6.875906 -0.9998512     9.186146 
1 1 1 8   15 38 o 19.78427 7.686105 5.371852       5.309996 7.917895       8.883517 3.956488       6.623477 22.87023 9.552809 19.27090 8.160254 3.599337       12.56367 
1 1 1 8   15 39 o 17.66435 6.206911 4.542560       3.310397 3.646676       4.224469 5.968024       5.328736 16.93130 6.768760 19.70238 7.686782 -2.771076      10.24220 
1 1 1 8   15 40 o 13.81090 5.798668 1.716988       3.299055 4.808332       4.542815 -1.732623      4.798841 17.84643 7.056537 13.03360 6.091811 4.812835       9.322279 
1 1 1 8   15 41 o 19.87470 6.434424 6.671585       3.556708 7.880708       4.789844 5.185482       5.310195 20.54086 7.438442 17.72340 7.393064 2.817455       10.48751 
1 1 1 8   15 42 o 13.98979 5.948252 2.408069       3.543815 7.309197       4.901673 -2.959273      5.129510 18.95162 7.378470 12.08913 5.829358 6.862492       9.403363 
1 1 1 8   15 43 o 12.95107 5.810755 1.496748       3.804801 -1.732678      5.593290 4.278147       5.190823 12.56516 6.065915 15.51594 6.885451 -2.950775      9.176315 
1 1 1 8   15 44 o 14.03635 6.203668 3.174231       4.172157 4.847591       5.065562 -0.3551427     7.356678 15.32901 6.802216 13.52280 6.623277 1.806206       9.494100 
1 1 1 8   16 0  o 269.1537 4.339807 883.1238       28.46471 888.1667       40.28973 878.0981       40.22073 269.8548 6.126720 268.3198 6.151218 1.535004       8.681831 
1 1 1 8   16 1  o 239.7925 3.989416 700.9137       23.31208 688.6506       32.53537 713.8519       33.41891 237.6352 5.618351 241.9425 5.668185 -4.307236      7.980864 
1 1 1 8   16 2  o 498.8546 10.40015 3041.455       126.4299 0.000000       0.000000 3041.455       126.4299 ?        ?        498.8546 10.40015 0.000000       10.40015 
1 1 1 8   16 3  o 408.9767 7.096608 2041.059       70.72704 2111.446       125.7336 2008.478       85.54444 415.1393 12.44262 405.5509 8.655863 9.588470       15.15727 
1 1 1 8   16 4  f 308.6340 4.826573 1161.492       36.30102 1172.789       51.38194 1150.235       51.29296 310.0178 6.801234 307.0187 6.855780 2.999146       9.657044 
1 1 1 8   16 5  o 59.66063 3.037803 43.49548       4.402017 36.64230       5.446170 56.40990       7.476228 54.66813 4.118377 67.86546 4.546849 -13.19733      6.134727 
1 1 1 8   16 6  o 136.3934 2.887300 226.7415       9.596687 219.7655       13.14994 234.6902       14.03697 134.1985 4.025606 138.6777 4.158356 -4.479172      5.787696 
1 1 1 8   16 7  o 538.5526 7.034102 3541.389       92.31512 3330.977       140.1799 3702.523       122.6715 521.5116 11.03026 550.2697 9.148123 -28.75812      14.33021 
1 1 1 8   16 8  o 87.83698 2.581862 94.11819       5.520457 111.6871       13.78947 90.76497       6.024284 95.47575 5.956443 86.24437 2.870411 9.231384       6.611995 
1 1 1 8   16 9  o 118.5288 2.735115 171.2488       7.900151 167.6564       17.65776 172.1479       8.833578 117.0176 6.214532 118.7944 3.053970 -1.776863      6.924387 
1 1 1 8   16 10 o 189.2215 3.385487 436.5650       15.61089 417.9926       32.37500 442.1913       17.81929 184.7876 7.203334 190.4180 3.840135 -5.630371      8.163006 
1 1 1 8   16 11 o 310.9643 5.547826 1180.720       42.04066 0.000000       0.000000 1180.720       42.04066 ?        ?        310.9643 5.547826 0.000000       5.547826 
1 1 1 8   16 12 o 87.53519 2.555632 93.48992       5.445677 88.16132       13.44646 94.53537       5.955978 84.66618 6.568557 88.01271 2.780461 -3.346535      7.132805 
1 1 1 8   16 13 o 295.3038 4.668815 1064.631       33.59787 1110.227       71.09861 1051.522       38.12299 300.4232 9.724428 293.3923 5.332148 7.030914       11.09037 
1 1 1 8   16 14 o 400.6969 6.043930 1963.625       59.01624 1916.877       118.4348 1979.068       68.06918 393.3842 12.36990 402.0287 6.947960 -8.644531      14.18762 
1 1 1 8   16 15 o 171.5180 3.643595 358.9908       15.22915 0.000000       0.000000 358.9908       15.22915 ?        ?        171.5180 3.643595 0.000000       3.643595 
1 1 1 8   16 16 o 134.0320 3.235058 219.1759       10.56639 0.000000       0.000000 219.1759       10.56639 ?        ?        134.0320 3.235058 0.000000       3.235058 
1 1 1 8   16 17 o 72.65408 2.342338 64.43208       4.141692 60.58053       7.010971 66.49670       5.133108 70.31168 4.109719 73.77837 2.860480 -3.466690      5.007208 
1 1 1 8   16 18 o 24.02688 3.863930 7.226862       2.185672 4.911850       4.720319 7.858662       2.465951 21.21848 7.415020 25.02765 4.191295 -3.809174      8.517598 
1 1 1 8   16 19 o 140.0417 3.040299 239.3294       10.37552 240.8363       14.78483 237.8671       14.56406 140.3038 4.329432 139.4404 4.291160 0.8633728      6.095738 
1 1 1 8   16 20 o 99.93166 2.838349 121.9573       6.905017 127.6008       9.893883 116.5982       9.641353 102.1080 3.983868 97.59070 4.062978 4.517319       5.690254 
1 1 1 8   16 21 o 135.0346 3.636366 222.9389       11.95510 229.8086       14.22753 206.4367       22.05115 137.0131 4.266392 129.3257 7.023328 7.687393       8.217617 
1 1 1 8   16 22 o 57.13655 3.060555 39.97514       4.245830 36.64251       5.601493 44.47546       6.509257 54.56476 4.246051 60.11641 4.475373 -5.551643      6.169110 
1 1 1 8   16 23 o 111.6037 2.950983 152.1988       8.018628 160.3982       11.20312 143.5859       11.48214 114.4334 4.023707 108.2112 4.363207 6.222168       5.935301 
1 1 1 8   16 24 o 46.25293 3.648695 26.32301       4.079282 24.35945       4.918273 30.65143       7.302227 44.34699 4.618658 49.52407 6.185131 -5.177086      7.719316 
1 1 1 8   16 25 o 43.84132 3.790170 23.69596       4.009556 25.06574       4.879166 20.84703       7.036554 44.99434 4.510679 40.41665 7.417633 4.577694       8.681446 
1 1 1 8   16 26 o 161.0784 3.322530 317.3559       13.04195 318.4075       18.11257 316.2235       18.79452 160.9926 4.621553 160.3832 4.814242 0.6093292      6.673506 
1 1 1 8   16 27 o 179.1197 4.173262 393.6292       18.21609 384.0851       32.67981 397.9314       21.94083 175.3547 7.666137 179.7547 5.013734 -4.399918      9.160088 
1 1 1 8   16 28 o 125.1056 3.071307 191.5226       9.363456 201.6891       13.11153 180.9413       13.37630 128.0764 4.206663 121.2126 4.536480 6.863777       6.186733 
1 1 1 8   16 29 o 29.89760 5.023715 11.32965       3.530463 11.03979       4.467783 11.81154       5.760796 29.22228 6.447173 30.08162 7.795616 -0.8593407     10.11621 
1 1 1 8   16 30 o 113.5778 3.874859 158.9262       10.70900 141.1640       18.76686 167.5026       13.04059 105.5331 7.343183 116.3424 4.608752 -10.80927      8.669656 
1 1 1 8   16 31 o 66.11752 3.262702 53.86241       5.240668 55.68485       6.858229 51.30488       8.124476 66.98162 4.223151 63.95864 5.259086 3.022980       6.744849 
1 1 1 8   16 32 o 62.07729 3.712429 47.80510       5.590343 49.92972       7.839334 45.60670       7.974271 62.93613 5.156612 59.98738 5.516740 2.948750       7.551495 
1 1 1 8   16 33 o 75.13267 3.218544 69.85854       5.879182 73.15866       7.654708 65.11159       9.180593 76.51682 4.120410 71.59052 5.299928 4.926300       6.713198 
1 1 1 8   16 34 o 53.77161 4.085802 36.44207       5.313775 32.76633       5.793925 55.90236       13.33139 50.67777 4.746826 63.15043 8.910221 -12.47266      10.09576 
1 1 1 8   16 35 o 28.46472 5.413101 10.80115       3.617635 11.07729       4.371283 10.20091       6.444745 28.37310 6.466590 26.61404 8.664826 1.759064       10.81184 
1 1 1 8   16 36 o 20.17227 6.247323 5.602270       3.385820 7.770193       4.205972 1.610799       5.707040 23.34919 6.907529 17.56208 7.510196 5.787109       10.20377 
1 1 1 8   16 37 o 17.83054 6.440717 4.164267       3.588223 4.353490       4.193800 3.647291       6.931960 18.41771 6.908617 19.63281 8.332284 -1.215109      10.82386 
1 1 1 8   16 38 o 21.30907 7.238979 7.042918       4.487870 0.5822570      8.488952 9.549095       5.287148 18.23544 8.374455 24.14539 7.847229 -5.909950      11.47652 
1 1 1 8   16 39 o 13.45777 5.713449 1.284548       3.261139 -1.350376      4.219057 5.195343       5.140009 12.65794 5.845747 18.67399 7.466008 -6.016046      9.482302 
1 1 1 8   16 40 o 13.32053 5.724187 1.294082       3.345428 0.9767699      4.463808 1.700705       5.053102 14.23774 6.347573 15.26558 6.782842 -1.027838      9.289705 
1 1 1 8   16 41 o 35.07698 4.958208 18.22804       4.120182 25.06849       5.952487 11.93623       5.708784 38.89617 6.509790 23.82576 8.162952 15.07041       10.44084 
1 1 1 8   16 42 o 26.02691 6.789556 12.51272       4.350645 19.63003       6.914521 7.848401       5.597557 28.36314 8.949448 18.69049 7.673688 9.672655       11.78890 
1 1 1 8   16 43 o 15.54261 6.311637 4.484047       3.736309 6.084474       5.265781 2.861355       5.302285 16.62984 7.164320 14.46551 6.634028 2.164327       9.764108 
1 1 1 8   17 0  o 613.4379 7.978641 4594.562       119.2712 4521.635       186.1127 4645.386       155.3694 607.6223 12.56916 616.3889 10.34367 -8.766663      16.27806 
1 1 1 8   17 1  o 372.0730 5.068970 1688.254       45.96041 1630.559       70.76696 1730.342       60.44285 365.4300 7.946763 376.5703 6.586621 -11.14032      10.32156 
1 1 1 8   17 2  o 207.6250 3.284325 525.4496       16.61736 543.9521       26.33136 513.2032       21.42205 211.1915 5.116354 205.1638 4.284736 6.027695       6.673533 
1 1 1 8   17 3  o 325.2090 4.532031 1289.631       35.91629 1312.184       57.01583 1274.795       46.24529 327.8537 7.136402 323.2486 5.870765 4.605042       9.240894 
1 1 1 8   17 4  o 381.9385 6.719254 1780.663       62.53895 0.000000       0.000000 1780.663       62.53895 ?        ?        381.9385 6.719254 0.000000       6.719254 
1 1 1 8   17 5  o 202.2985 3.549922 498.9200       17.50038 467.6330       23.71986 536.2961       25.92552 195.7377 4.976843 209.6789 5.073838 -13.94122      7.107236 
1 1 1 8   17 6  o 85.79883 2.351173 89.78617       4.911255 83.26401       7.453442 94.79095       6.529108 82.55512 3.714415 88.13033 3.044704 -5.575203      4.802823 
1 1 1 8   17 7  o 188.6661 3.003828 433.9106       13.81036 465.7809       22.61475 414.9569       17.44001 195.4024 4.749258 184.4703 3.879577 10.93217       6.132420 
1 1 1 8   17 8  o 384.3715 5.809666 1803.696       54.41747 1667.911       105.0892 1853.446       63.60983 368.3274 11.72307 389.5096 6.701468 -21.18219      13.50333 
1 1 1 8   17 9  o 247.8735 4.631407 749.6751       27.97558 749.0692       50.96874 749.9363       33.46750 247.2256 8.472597 247.8420 5.541307 -0.6163788     10.12378 
1 1 1 8   17 10 o 252.2139 4.115197 776.0386       25.29273 768.0723       52.29788 778.4708       28.89695 250.2508 8.588487 252.5616 4.695140 -2.310776      9.788076 
1 1 1 8   17 11 o 223.9479 3.783991 611.8089       20.65063 627.3303       43.94881 607.4109       23.39402 226.1691 7.986562 223.1028 4.302926 3.066391       9.071954 
1 1 1 8   17 12 o 218.8577 3.730178 584.3782       19.89425 614.6784       43.19120 576.2185       22.41345 223.8109 7.931678 217.2838 4.232970 6.527130       8.990525 
1 1 1 8   17 13 o 160.9621 3.115444 316.0040       12.22024 314.8826       26.88871 316.2959       13.71889 160.2136 6.903270 161.0153 3.496357 -0.8017426     7.738194 
1 1 1 8   17 14 o 220.1449 3.768194 591.4684       20.21519 638.3748       44.61794 579.3526       22.67616 227.9088 8.046262 217.8278 4.271891 10.08098       9.109961 
1 1 1 8   17 15 o 222.1845 3.795403 602.5814       20.54981 584.6561       42.87366 607.9277       23.41471 218.0162 8.083855 223.1102 4.306586 -5.094055      9.159443 
1 1 1 8   17 16 o 139.0731 3.289922 236.0109       11.14974 0.000000       0.000000 236.0109       11.14974 ?        ?        139.0731 3.289922 0.000000       3.289922 
1 1 1 8   17 17 o 290.4958 5.285568 1032.498       37.41689 0.000000       0.000000 1032.498       37.41689 ?        ?        290.4958 5.285568 0.000000       5.285568 
1 1 1 8   17 18 o 144.6848 2.678410 255.3691       9.443570 274.3201       15.89838 245.0371       11.73890 149.7477 4.361336 141.6763 3.400119 8.071396       5.530106 
1 1 1 8   17 19 o 177.7962 2.957125 385.7803       12.81234 373.7210       20.37311 393.6701       16.47892 174.7059 4.789870 179.5166 3.766934 -4.810699      6.093657 
1 1 1 8   17 20 o 75.98586 2.424641 70.50574       4.483944 66.16777       7.552930 72.86676       5.572131 73.43871 4.238413 77.20749 2.967118 -3.768784      5.173774 
1 1 1 8   17 21 o 122.8662 4.893270 185.1971       14.62171 167.6077       20.02398 205.2891       21.40110 116.4330 7.090915 128.9636 6.834173 -12.53059      9.848198 
1 1 1 8   17 22 o 14.61829 5.808226 1.372665       3.091752 3.054653       4.095274 -0.8565671     4.714649 18.21460 6.828117 15.38406 6.702456 2.830542       9.567972 
1 1 1 8   17 23 o 147.1075 3.530342 264.5548       12.65574 261.4308       15.82903 270.0903       21.07080 146.0268 4.453417 148.0991 5.849887 -2.072311      7.352149 
1 1 1 8   17 24 o 240.6262 4.118570 709.0378       24.15046 720.1414       34.24399 698.0502       34.06454 241.9052 5.809021 238.1411 5.869919 3.764114       8.258370 
1 1 1 8   17 25 o 68.35992 3.104875 57.23787       5.158774 64.31855       7.155722 49.57512       7.444035 72.34271 4.075513 63.35690 4.858529 8.985813       6.341538 
1 1 1 8   17 26 o 48.62141 3.744918 29.12671       4.403003 31.57073       5.503282 24.77972       7.339459 50.50992 4.518727 44.16322 7.057177 6.346699       8.379895 
1 1 1 8   17 27 o 45.75098 4.980895 26.06813       5.463657 33.03147       12.09585 24.28322       6.123999 50.13251 10.24733 43.95072 5.864045 6.181797       11.80656 
1 1 1 8   17 28 f 84.37868 3.005759 87.25945       6.170619 79.06852       8.226929 97.79394       9.329919 80.08243 4.230657 89.06560 4.311454 -8.983170      6.040455 
1 1 1 8   17 29 o 81.60714 3.870318 82.06574       7.674879 69.78666       14.05570 87.28202       9.161152 73.90181 7.928609 84.00539 4.491470 -10.10358      9.112417 
1 1 1 8   17 30 o 68.73672 3.199430 58.13469       5.344466 59.72961       7.240187 56.22515       7.922208 69.40527 4.301910 67.16478 4.873410 2.240486       6.500504 
1 1 1 8   17 31 o 37.75864 4.798339 18.01654       4.315549 16.10029       5.930784 20.17290       6.291382 34.92187 7.208183 39.33696 6.809568 -4.415089      9.916054 
1 1 1 8   17 32 o 92.93571 3.099932 106.5749       7.010721 104.2147       9.291775 109.6944       10.68235 91.43143 4.181366 93.53192 4.701817 -2.100487      6.292131 
1 1 1 8   17 33 o 33.28230 4.922153 14.26336       3.871889 14.34495       4.838161 14.11804       6.457182 32.86814 6.269156 31.82266 8.256663 1.045483       10.36701 
1 1 1 8   17 34 o 53.84284 4.198176 36.74368       5.464881 35.67181       6.032523 41.64858       12.90454 52.76931 4.741680 52.61653 10.43297 0.1527824      11.45995 
1 1 1 8   17 35 o 44.93101 3.896691 25.70559       4.224422 29.19617       5.531828 20.82199       6.543184 47.35706 4.862440 38.45060 7.248916 8.906467       8.728694 
1 1 1 8   17 36 o 41.03044 4.539990 22.09060       4.463538 22.26960       5.242770 21.61908       8.509023 40.59539 5.436177 36.45825 9.487518 4.137135       10.93458 
1 1 1 8   17 37 o 19.65827 6.328615 5.576175       3.443784 9.243235       4.723228 1.414144       5.031907 24.45933 7.340482 16.11979 6.974205 8.339540       10.12533 
1 1 1 8   17 38 o 20.80520 6.366883 6.617589       3.529438 7.886082       4.710628 4.994100       5.329166 22.01653 7.416777 18.85993 7.580945 3.156595       10.60563 
1 1 1 8   17 39 o 14.69240 6.413074 1.454861       4.333591 -3.243478      8.784752 2.965942       4.981971 16.03334 7.705031 16.44069 7.023426 -0.4073448     10.42574 
1 1 1 8   17 40 o 10.99018 5.101493 -1.290730      3.274781 2.550967       4.491858 -5.649220      4.784457 15.31981 6.608564 11.01892 5.385100 4.300893       8.524813 
1 1 1 8   17 41 o 26.96580 6.003694 11.96869       3.843785 12.38177       5.634824 11.60919       5.256716 23.94983 8.111684 23.64864 7.832312 0.3011875      11.27584 
1 1 1 8   17 42 o 27.24643 6.215973 13.02100       4.035660 15.27219       5.795259 10.90149       5.623201 25.66035 8.204660 21.14874 7.985363 4.511610       11.44913 
1 1 1 8   17 43 o 14.47862 6.109118 3.613380       3.690532 7.537935       5.388099 0.1450420      5.065251 17.45646 7.374428 12.74554 6.048563 4.710924       9.537678 
1 1 1 8   18 0  o 256.5659 4.953373 802.8719       30.96963 861.1385       55.05066 775.8936       37.45938 265.3121 8.525768 252.1524 6.096231 13.15974       10.48107 
1 1 1 8   18 1  f 111.0385 2.992561 150.3958       8.090151 140.0204       10.54084 165.2686       12.62031 107.0854 4.046604 116.3290 4.460166 -9.243584      6.022299 
1 1 1 8   18 2  o 109.1028 2.610964 145.0812       6.941810 143.5785       10.43521 146.2740       9.297416 108.4428 3.955419 109.4817 3.489312 -1.038895      5.274527 
1 1 1 8   18 3  o 337.9763 4.683205 1393.260       38.57141 1452.159       62.17279 1356.406       49.17985 344.7769 7.399904 333.3596 6.053940 11.41730       9.560793 
1 1 1 8   18 4  o 328.0386 4.576252 1312.556       36.58231 1208.251       54.50873 1398.038       49.34606 314.4982 7.112328 338.4246 5.983488 -23.92639      9.294478 
1 1 1 8   18 5  o 70.89071 3.492277 61.42206       6.014441 67.10135       11.18821 59.11381       7.132711 73.86629 6.274860 69.49088 4.232090 4.375420       7.568650 
1 1 1 8   18 6  o 450.0355 5.973178 2472.965       65.50710 2386.074       101.1872 2535.656       85.94894 441.3689 9.407792 455.3766 7.745220 -14.00766      12.18585 
1 1 1 8   18 7  o 228.5622 3.423048 637.0078       19.06573 625.1035       29.82318 645.2358       24.79406 226.2881 5.408242 229.9751 4.424159 -3.687073      6.987293 
1 1 1 8   18 8  o 419.0674 6.285473 2145.851       64.18860 2265.040       134.3338 2110.585       73.07006 428.4344 12.88126 415.4230 7.217932 13.01132       14.76569 
1 1 1 8   18 9  o 53.55534 2.885160 35.07154       3.751479 25.48190       9.498463 36.84390       4.083466 44.79871 9.013164 54.88364 3.065341 -10.08494      9.520159 
1 1 1 8   18 10 o 113.3797 2.743613 156.7349       7.580441 157.1342       17.34469 156.6407       8.427967 113.1886 6.313235 113.2955 3.055418 -0.1068954     7.013737 
1 1 1 8   18 11 o 228.8937 3.855340 639.2994       21.50467 706.6390       47.68114 622.1041       24.09435 239.9046 8.167811 225.7469 4.379832 14.15775       9.268013 
1 1 1 8   18 12 o 121.5852 2.765807 180.2703       8.194809 182.2455       18.95606 179.8163       9.087903 121.8657 6.405575 121.3815 3.074857 0.4842072      7.105360 
1 1 1 8   18 13 o 196.1437 3.495579 469.4339       16.70820 460.2554       35.40615 472.0634       18.95102 193.5737 7.520096 196.6530 3.954539 -3.079391      8.496483 
1 1 1 8   18 14 o 137.6708 3.266002 231.2455       10.95707 0.000000       0.000000 231.2455       10.95707 ?        ?        137.6708 3.266002 0.000000       3.266002 
1 1 1 8   18 15 o 150.1835 3.406001 275.2567       12.46531 0.000000       0.000000 275.2567       12.46531 ?        ?        150.1835 3.406001 0.000000       3.406001 
1 1 1 8   18 16 o 162.5220 3.175564 322.3168       12.57677 270.3048       25.62483 338.8217       14.43498 148.2189 7.115275 166.5994 3.555549 -18.38054      7.954185 
1 1 1 8   18 17 o 86.08352 2.674609 90.48473       5.603886 85.74587       14.05486 91.38049       6.110610 83.26830 6.990936 86.49258 2.903257 -3.224281      7.569815 
1 1 1 8   18 18 o 155.7774 3.519645 296.3328       13.36101 0.000000       0.000000 296.3328       13.36101 ?        ?        155.7774 3.519645 0.000000       3.519645 
1 1 1 8   18 19 o 34.62379 3.151909 14.75594       2.630283 20.96695       5.218359 12.64053       3.045444 41.02674 5.346598 31.91122 4.004182 9.115517       6.679789 
1 1 1 8   18 20 o 200.5714 3.201160 491.2540       15.64633 479.0534       24.86118 499.2558       20.13364 197.6484 5.166125 202.0572 4.088951 -4.408844      6.588503 
1 1 1 8   18 21 o 167.3404 3.700929 342.3098       15.09204 339.5413       19.10600 346.9034       24.61105 166.4285 4.715678 167.9056 6.024673 -1.477097      7.650771 
1 1 1 8   18 22 o 69.49004 3.279585 59.13175       5.537969 58.70723       7.163853 59.76220       8.730104 69.11926 4.274065 69.60278 5.184262 -0.4835205     6.718944 
1 1 1 8   18 23 o 186.3740 3.549296 424.7601       16.11995 442.4920       23.19643 408.1989       22.41762 189.8182 5.019129 182.3000 5.051093 7.518188       7.120758 
1 1 1 8   18 24 o 117.5861 3.028011 169.0738       8.669381 170.6026       12.16313 167.4951       12.35995 117.9149 4.239827 116.8132 4.349586 1.101639       6.074128 
1 1 1 8   18 25 o 109.6731 3.020581 147.1543       8.065157 148.0627       11.29015 146.2078       11.52519 109.7984 4.227464 109.0833 4.344334 0.7151108      6.061740 
1 1 1 8   18 26 o 44.73828 3.805348 24.70503       4.109345 25.81564       5.558311 23.36620       6.102751 45.51409 5.098970 43.08862 5.972398 2.425472       7.852963 
1 1 1 8   18 27 f 47.18017 4.784823 27.69161       5.425259 8.233351       10.80489 34.25109       6.273405 29.03199 11.04442 52.48364 4.964036 -23.45165      12.10871 
1 1 1 8   18 28 o 76.76898 3.895370 72.61129       7.263548 73.39984       14.50725 72.34748       8.391053 75.88445 7.963563 76.48263 4.522311 -0.5981827     9.158037 
1 1 1 8   18 29 o 37.73601 4.297081 17.79036       3.881217 15.38615       5.225148 20.74963       5.797029 34.52613 6.447373 40.33636 6.086847 -5.810230      8.866698 
1 1 1 8   18 30 o 33.96209 5.141501 14.67389       4.122227 16.38849       5.869767 13.00530       5.790461 35.35805 7.059694 31.29318 7.656905 4.064865       10.41477 
1 1 1 8   18 31 o 49.26249 3.765363 30.19622       4.485963 25.38635       5.916553 36.70038       6.880145 44.58350 5.566722 53.81544 5.315669 -9.231945      7.697060 
1 1 1 8   18 32 o 20.02218 6.293425 5.148469       3.422474 5.958619       4.281933 3.715352       5.695056 21.58940 7.065009 20.16914 7.923641 1.420267       10.61595 
1 1 1 8   18 33 o 73.84545 3.302153 67.85302       5.927303 66.59014       7.708098 69.68027       9.271787 72.58674 4.378016 73.72559 5.193944 -1.138855      6.792944 
1 1 1 8   18 34 o 21.68891 6.849102 6.394416       4.049069 6.470973       4.376058 5.938816       10.67538 21.86095 7.141521 24.71521 10.40719 -2.854261      12.62184 
1 1 1 8   18 35 o 24.53986 6.414849 8.495988       3.878410 12.09578       4.677767 0.5789293      6.937165 29.19351 6.715298 18.13396 8.007746 11.05955       10.45080 
1 1 1 8   18 36 f 16.61311 6.187900 3.376570       3.352442 5.272640       4.365365 0.6506890      5.234157 19.60888 7.101162 15.96508 7.006215 3.643799       9.975648 
1 1 1 8   18 37 o 17.17758 6.250723 4.009324       3.387865 5.744780       4.527311 1.800750       5.107276 19.73011 7.218670 16.27861 7.034554 3.451506       10.07939 
1 1 1 8   18 38 o 15.00084 6.029726 2.559086       3.371369 1.451368       4.563279 3.890370       5.002622 15.08451 6.582590 17.47076 7.221899 -2.386255      9.771709 
1 1 1 8   18 39 o 26.52280 7.273255 12.10919       4.840993 5.850663       9.661096 14.20743       5.593935 19.49818 8.946807 28.04014 7.867938 -8.541962      11.91427 
1 1 1 8   18 40 o 14.27964 5.966383 2.426843       3.466917 -1.898785      4.794932 7.165504       5.018636 12.51327 5.922620 19.40614 7.490442 -6.892877      9.549039 
1 1 1 8   18 41 o 15.70545 6.285218 4.102937       3.646317 2.469019       5.254993 5.620045       5.063670 14.85562 6.731862 17.12352 7.186403 -2.267900      9.846947 
1 1 1 8   18 42 o 15.94710 6.344285 4.732653       3.693324 1.023217       5.303298 8.226022       5.146527 13.58114 6.365890 18.71885 7.475169 -5.137717      9.818487 
1 1 1 8   18 43 o 12.28965 5.586714 1.173391       3.654387 -1.380124      5.180306 3.702947       5.155947 12.06372 5.827245 14.61867 6.641726 -2.554948      8.835684 
1 1 1 8   19 0  o 408.2621 7.162205 2036.371       71.25607 1883.068       116.8697 2127.080       89.89848 391.3872 12.26863 416.9604 8.847518 -25.57321      15.12606 
1 1 1 8   19 1  o 61.68040 2.848991 46.47466       4.270707 52.84992       6.440505 41.47156       5.705461 65.70657 4.041866 58.17442 4.049887 7.532150       5.721736 
1 1 1 8   19 2  o 311.0121 4.393804 1179.875       33.30075 1141.641       51.18896 1207.928       43.84752 305.6898 6.871623 314.5683 5.719973 -8.878571      8.940765 
1 1 1 8   19 3  o 319.4346 5.048056 1245.171       39.29544 1207.235       53.68714 1288.946       57.67076 314.3098 7.009325 324.7341 7.287719 -10.42432      10.11145 
1 1 1 8   19 4  o 306.4567 4.343204 1145.677       32.43512 1085.278       49.10681 1192.419       43.19932 298.0164 6.761847 312.5142 5.672454 -14.49777      8.826058 
1 1 1 8   19 5  o 366.5701 5.606019 1640.760       50.07808 1682.212       71.54025 1600.933       70.12322 370.7797 7.917688 361.7041 7.955588 9.075562       11.22413 
1 1 1 8   19 6  o 207.6029 3.672573 525.6570       18.57976 569.4243       39.75790 513.4280       21.01576 215.5945 7.579240 205.1424 4.203911 10.45213       8.667049 
1 1 1 8   19 7  o 325.8201 5.079312 1296.151       40.32914 1224.925       79.00497 1321.251       46.89982 315.5736 10.28723 328.8490 5.852462 -13.27542      11.83547 
1 1 1 8   19 8  o 204.4121 3.178608 509.5668       15.83360 491.6766       24.58029 522.2551       20.70043 200.5963 5.032352 206.8806 4.106044 -6.284317      6.494934 
1 1 1 8   19 9  o 172.7211 3.271903 363.8626       13.77152 380.4885       29.91063 359.3900       15.51371 176.1696 6.981025 171.6314 3.709221 4.538223       7.905253 
1 1 1 8   19 10 o 161.0392 3.138117 316.3080       12.31507 310.2928       26.28014 318.0005       13.94043 159.0605 6.795652 161.4470 3.543318 -2.386520      7.663941 
1 1 1 8   19 11 f 288.8904 4.600052 1019.284       32.38410 956.0886       64.39286 1040.678       37.46702 278.5670 9.499654 291.7994 5.269005 -13.23239      10.86305 
1 1 1 8   19 12 o 70.14217 2.833978 60.10183       4.834112 0.000000       0.000000 60.10183       4.834112 ?        ?        70.14217 2.833978 0.000000       2.833978 
1 1 1 8   19 13 o 306.4288 5.517476 1148.569       41.20084 0.000000       0.000000 1148.569       41.20084 ?        ?        306.4288 5.517476 0.000000       5.517476 
1 1 1 8   19 14 o 101.1164 2.668627 124.7894       6.570005 124.8036       15.92894 124.7864       7.212043 100.7038 6.526044 101.0978 2.930483 -0.3939819     7.153809 
1 1 1 8   19 15 f 180.4267 3.360577 397.3270       14.77579 383.8354       31.45537 401.1469       16.73731 176.6259 7.323987 181.2500 3.789408 -4.624115      8.246235 
1 1 1 8   19 16 o 47.64220 2.896449 27.79619       3.346856 18.17488       8.709558 29.46308       3.625202 37.62137 9.499693 49.04224 3.048445 -11.42087      9.976832 
1 1 1 8   19 17 o 163.3184 3.212735 325.5951       12.78634 295.0652       26.89354 334.5118       14.53411 154.7497 7.150850 165.5002 3.603743 -10.75056      8.007598 
1 1 1 8   19 18 o 113.7749 2.826241 157.9717       7.835952 157.2543       18.28786 158.1331       8.672386 112.9206 6.675684 113.7700 3.131036 -0.8493805     7.373476 
1 1 1 8   19 19 o 84.53995 2.753682 87.31573       5.665419 109.2042       16.21044 84.27017       6.046730 93.89832 7.137841 83.03048 2.993355 10.86784       7.740087 
1 1 1 8   19 20 o 144.4436 3.488535 254.9404       12.27942 246.9966       15.48388 268.4039       20.15785 141.9748 4.481016 147.7726 5.607937 -5.797745      7.178333 
1 1 1 8   19 21 o 104.7976 2.912809 134.2089       7.431528 134.0181       10.77333 134.3822       10.26465 104.5526 4.237206 104.7256 4.029638 -0.1730042     5.847383 
1 1 1 8   19 22 o 168.1323 2.940942 345.2704       12.04963 328.1263       19.12040 356.5648       15.51918 163.5065 4.803933 170.7346 3.730021 -7.228073      6.082008 
1 1 1 8   19 23 o 131.1537 2.679223 210.0570       8.562993 213.9843       14.10649 207.7655       10.77536 132.0547 4.389678 130.3045 3.396305 1.750214       5.550149 
1 1 1 8   19 24 o 99.75719 2.977498 121.7388       7.230119 121.2499       10.17793 122.2368       10.27260 99.35844 4.213135 99.75851 4.235293 -0.4000626     5.973961 
1 1 1 8   19 25 o 100.3988 3.027436 123.3723       7.398491 139.0285       10.72423 109.1536       10.22006 106.3807 4.144756 94.17650 4.465950 12.20420       6.092923 
1 1 1 8   19 26 o 41.28803 3.942657 21.10426       3.918765 14.69492       5.299512 28.83726       5.821074 33.82687 6.666073 48.11712 5.039053 -14.29025      8.356350 
1 1 1 8   19 27 o 54.87470 4.418815 37.30822       5.859079 45.25212       12.85678 35.22599       6.582319 58.98820 9.247710 53.15269 5.146100 5.835514       10.58312 
1 1 1 8   19 28 o 40.61847 4.457706 20.59636       4.339949 27.05876       6.840979 16.24359       5.614414 46.15865 6.241545 35.44781 6.745864 10.71084       9.190406 
1 1 1 8   19 29 o 23.47791 6.142575 7.170438       3.554140 2.819977       4.928278 11.88514       5.130441 18.76412 7.371165 30.05543 7.115696 -11.29132      10.24535 
1 1 1 8   19 30 o 80.63356 3.147395 80.13468       6.172602 79.56516       8.475043 80.77810       9.008076 79.92631 4.367872 80.43391 4.615128 -0.5076065     6.354346 
1 1 1 8   19 31 o 22.97887 6.197896 6.975294       3.549716 6.617378       4.725429 7.438839       5.377696 22.72883 7.420876 24.02605 7.920477 -1.297220      10.85373 
1 1 1 8   19 32 o 26.84770 5.774544 9.566018       3.665742 5.837904       4.700998 15.34976       5.855312 21.52664 7.406377 33.50607 7.371735 -11.97943      10.44973 
1 1 1 8   19 33 o 61.92158 3.746866 48.21592       5.627419 46.82690       6.791766 51.25787       10.05089 60.52345 4.640320 61.75352 6.790866 -1.230072      8.224867 
1 1 1 8   19 34 o 25.61797 6.604487 9.209648       4.149374 8.928075       4.499199 10.81201       10.73298 25.06688 7.064160 27.31520 10.83188 -2.248323      12.93182 
1 1 1 8   19 35 o 9.831864 4.689033 -3.532103      3.121194 -0.6270353     3.918017 -8.577694      5.163499 13.31964 5.941996 11.27282 5.526976 2.046823       8.115095 
1 1 1 8   19 36 f 39.75507 4.187632 20.84428       3.996061 23.60126       5.589979 17.96296       5.714652 41.03091 5.748128 34.64328 7.010122 6.387634       9.065473 
1 1 1 8   19 37 o 15.88418 6.163140 3.154130       3.410857 5.670854       4.621867 0.1442292      5.054471 19.36250 7.254794 14.81710 6.668565 4.545399       9.854024 
1 1 1 8   19 38 o 15.25187 6.135717 2.799845       3.494034 8.103719       4.841146 -2.966872      5.047961 21.67986 7.513373 12.77461 6.055313 8.905253       9.649746 
1 1 1 8   19 39 o 12.80468 5.901058 -0.6450182     4.266857 2.533211       9.087332 -1.543882      4.832711 17.57207 8.266919 12.93586 6.067726 4.636216       10.25472 
1 1 1 8   19 40 o 11.28991 5.179398 -0.4797864     3.235634 -2.751423      4.550638 1.842956       4.601542 11.66783 5.590914 14.38211 6.426115 -2.714272      8.517821 
1 1 1 8   19 41 o 10.55618 4.988245 -1.501780      3.375612 -2.892612      4.743079 -0.7427759E-01 4.805200 11.49994 5.560035 12.89524 6.049232 -1.395300      8.216276 
1 1 1 8   19 42 o 18.84374 6.644249 7.295712       3.795712 7.491662       5.282396 7.086534       5.457797 17.64890 7.368719 17.22426 7.354480 0.4246387      10.41088 
1 1 1 8   20 0  o 116.5938 3.626724 165.9410       10.29195 154.8290       16.19319 173.4718       13.33084 112.4398 5.930819 119.1478 4.599940 -6.707939      7.505602 
1 1 1 8   20 1  o 131.7075 3.106927 211.5012       9.971892 221.5485       13.57915 199.7410       14.69117 134.7017 4.141710 127.8515 4.723477 6.850220       6.282118 
1 1 1 8   20 2  o 347.5114 6.228539 1475.496       52.74622 1452.195       63.50849 1527.309       94.70346 344.5320 7.564254 352.3568 11.04291 -7.824799      13.38521 
1 1 1 8   20 3  o 300.7541 4.295120 1103.636       31.47914 1175.807       51.18138 1059.722       39.92344 310.1158 6.772546 294.5730 5.561590 15.54282       8.763485 
1 1 1 8   20 4  o 425.6378 5.731719 2213.139       59.45129 2149.020       91.69267 2259.644       78.08968 418.6396 8.987900 429.7028 7.457434 -11.06320      11.67885 
1 1 1 8   20 5  o 43.80394 3.400655 23.54254       3.601628 27.57817       4.769033 18.18547       5.494629 47.35769 4.175122 38.09864 6.125868 9.259048       7.413360 
1 1 1 8   20 6  o 334.2745 5.186182 1364.757       42.24614 1347.383       59.06532 1382.955       60.44884 331.7485 7.306132 336.0826 7.380840 -4.334137      10.38539 
1 1 1 8   20 7  o 317.3935 5.691759 1231.247       44.02310 1245.863       54.49884 1203.802       74.68081 319.0172 7.010307 312.7362 9.811432 6.281006       12.05855 
1 1 1 8   20 8  f 190.3541 3.482773 442.0469       16.15561 460.6773       34.42199 436.7836       18.29591 193.7819 7.302376 189.1825 3.968597 4.599426       8.311105 
1 1 1 8   20 9  o 214.4114 4.264800 561.2585       22.28345 0.000000       0.000000 561.2585       22.28345 ?        ?        214.4114 4.264800 0.000000       4.264800 
1 1 1 8   20 10 o 143.7322 3.389390 252.0542       11.87167 0.000000       0.000000 252.0542       11.87167 ?        ?        143.7322 3.389390 0.000000       3.389390 
1 1 1 8   20 11 o 97.72929 2.711298 116.5687       6.450870 124.3183       15.33001 114.9012       7.111113 100.5720 6.286465 97.00816 3.011755 3.563850       6.970675 
1 1 1 8   20 12 o 260.9008 4.266919 831.3754       27.12850 834.5688       56.53767 830.4203       30.92057 260.2032 8.929626 260.6568 4.867907 -0.4536438     10.17029 
1 1 1 8   20 13 o 200.3438 3.557997 489.9327       17.37071 534.2854       38.79530 478.8111       19.42691 208.4035 7.652017 198.0071 4.026121 10.39644       8.646561 
1 1 1 8   20 14 o 98.43358 2.666883 118.2735       6.391210 134.6869       16.16562 115.2326       6.958107 104.6202 6.370954 97.13950 2.942797 7.480682       7.017771 
1 1 1 8   20 15 o 162.2471 3.198366 321.2932       12.64565 292.3401       26.46965 329.8557       14.39458 154.0966 7.067683 164.3580 3.593952 -10.26137      7.928975 
1 1 1 8   20 16 o 205.1201 3.626646 513.8693       18.12798 580.7130       41.06177 497.6871       20.20346 216.9952 7.777758 201.7968 4.108427 15.19843       8.796175 
1 1 1 8   20 17 o 112.7865 2.824709 155.3357       7.757556 141.9059       17.62285 158.5635       8.639663 107.2276 6.778946 113.9263 3.114904 -6.698685      7.460344 
1 1 1 8   20 18 o 147.5582 3.446266 265.9699       12.39220 240.1244       23.88181 275.4931       14.49657 139.4732 7.049381 150.0631 3.967677 -10.58994      8.089267 
1 1 1 8   20 19 o 108.7865 6.596292 146.1729       17.40465 146.1729       17.40465 0.000000       0.000000 108.7865 6.596292 ?        ?        0.000000       6.596292 
1 1 1 8   20 20 o 45.36994 3.571171 25.31566       3.916535 26.17860       6.247139 24.75684       5.027171 45.81779 5.719349 44.71208 4.683241 1.105705       7.392138 
1 1 1 8   20 21 o 149.2285 3.597643 272.3077       13.08296 315.0266       23.35007 252.7603       15.79510 159.8909 6.003440 143.5548 4.520747 16.33609       7.515214 
1 1 1 8   20 22 o 125.8123 2.641014 193.2757       8.097107 189.6923       13.41705 195.3284       10.15480 124.3224 4.435761 126.3605 3.300621 -2.038094      5.529021 
1 1 1 8   20 23 o 46.76967 2.949030 26.83704       3.343974 25.63522       6.108294 27.35138       3.995956 45.28100 5.658835 47.15162 3.502684 -1.870621      6.655165 
1 1 1 8   20 24 o 63.77991 2.657885 49.78481       4.121955 45.59293       7.170604 51.85360       5.037431 60.70208 4.888797 65.03185 3.188400 -4.329777      5.836628 
1 1 1 8   20 25 o 48.12722 3.658991 28.54872       4.259133 28.49994       6.122748 28.59446       5.928592 47.77730 5.350624 47.89732 5.160651 -0.1200180     7.433807 
1 1 1 8   20 26 o 79.41696 3.717481 77.56359       7.174493 85.35172       14.13602 74.86139       8.326629 82.34079 7.114644 77.87238 4.405801 4.468414       8.368347 
1 1 1 8   20 27 o 60.97008 4.768285 46.19673       7.028282 0.000000       0.000000 46.19673       7.028282 ?        ?        60.97008 4.768285 0.000000       4.768285 
1 1 1 8   20 28 o 42.33672 3.943775 22.27976       4.021994 22.04725       5.827686 22.49124       5.557821 41.61096 5.913446 42.14130 5.546561 -0.5303383     8.107601 
1 1 1 8   20 29 o 85.25442 3.086545 89.47205       6.401891 86.75278       8.913178 92.36974       9.200960 83.51096 4.395261 86.17867 4.395763 -2.667717      6.216193 
1 1 1 8   20 30 o 26.96573 5.967538 9.562363       3.817565 7.297329       5.348027 11.91559       5.451155 23.90315 7.899405 29.74165 7.518472 -5.838501      10.90541 
1 1 1 8   20 31 o 44.60420 4.080684 25.03005       4.386435 20.41493       5.964943 30.46457       6.472850 39.31956 6.448670 48.62785 5.562241 -9.308281      8.516095 
1 1 1 8   20 32 o 30.24677 5.930550 12.21605       4.214993 15.60095       5.359930 6.730458       6.823350 33.90324 6.725093 23.50928 8.813540 10.39397       11.08627 
1 1 1 8   20 33 o 13.77540 5.871264 0.4871434      3.467250 -0.6477749     4.607488 1.969017       5.264866 14.65098 6.495102 17.60785 7.354396 -2.956871      9.811905 
1 1 1 8   20 34 o 36.37244 5.665618 17.96088       4.858245 20.04915       5.476785 10.25066       10.52363 38.17299 6.092198 26.24544 10.61636 11.92754       12.24018 
1 1 1 8   20 35 o 22.65861 6.951127 7.618830       4.203624 10.33329       4.842766 -0.6769602     8.466052 26.08296 7.321308 18.27587 8.381962 7.807089       11.12919 
1 1 1 8   20 36 o 14.40071 5.914047 1.852054       3.325911 1.390854       4.528733 2.392040       4.900308 15.32867 6.624104 16.52112 7.008401 -1.192443      9.643466 
1 1 1 8   20 37 o 10.76970 5.016024 -1.822240      3.207762 -2.098986      4.511324 -1.539239      4.562022 12.64146 5.907865 13.03302 6.039886 -0.3915606     8.448853 
1 1 1 8   20 38 o 22.81056 6.730906 8.656035       3.997843 9.211717       6.249724 8.271168       5.201200 21.77251 8.370588 21.32215 7.747006 0.4503574      11.40539 
1 1 1 8   20 39 o 8.710601 4.285380 -5.057281      3.189751 -7.332298      4.604945 -2.958908      4.422558 10.08788 4.997181 11.56141 5.532343 -1.473532      7.455108 
1 1 1 8   20 40 o 17.59600 6.956638 5.915534       4.414590 0.4445256      9.035913 7.630847       5.059528 15.53908 7.550723 19.03382 7.471209 -3.494740      10.62226 
1 1 1 8   20 41 o 11.12322 5.178933 -0.5523373     3.414958 -3.332293      4.721001 2.498666       4.945799 11.18865 5.441578 14.31756 6.504939 -3.128905      8.480861 
1 1 1 8   21 0  o 310.6212 4.407232 1177.505       33.36054 1224.202       53.70652 1148.167       42.56904 316.3418 6.966815 306.5627 5.698210 9.779114       9.000340 
1 1 1 8   21 1  o 197.9236 3.628459 477.8417       17.50072 500.9980       34.49980 469.8186       20.30747 202.2356 7.011004 196.2145 4.247061 6.021057       8.197055 
1 1 1 8   21 2  o 222.8985 3.493196 606.0145       18.97432 580.1215       28.78545 625.9091       25.23182 217.9214 5.420472 226.4417 4.572525 -8.520279      7.091508 
1 1 1 8   21 3  o 152.1842 3.705951 282.5442       13.74376 276.0276       16.19538 299.3145       25.98063 150.3143 4.426169 156.2541 6.839677 -5.939743      8.146911 
1 1 1 8   21 4  o 293.6364 4.227049 1052.352       30.24707 1110.584       48.84293 1016.128       38.52264 301.2751 6.652768 288.3722 5.481843 12.90292       8.620320 
1 1 1 8   21 5  o 196.6702 3.584531 471.8860       17.17936 482.3198       24.30690 461.4720       24.28368 198.6474 5.025269 194.2907 5.133423 4.356735       7.183687 
1 1 1 8   21 6  o 219.1740 3.756410 586.1703       20.06311 579.2926       38.57362 588.7210       23.49062 217.3216 7.294025 219.5913 4.389785 -2.269699      8.513109 
1 1 1 8   21 7  o 193.3921 3.456689 456.3023       16.29053 441.0655       30.74840 462.2480       19.20777 189.6837 6.662407 194.6005 4.050391 -4.916733      7.797008 
1 1 1 8   21 8  o 95.47657 3.079878 111.3075       7.156453 106.0207       10.83558 115.3978       9.530979 93.03504 4.795540 97.14417 4.034885 -4.109131      6.267176 
1 1 1 8   21 9  o 184.0794 4.051577 413.6952       18.17462 408.8463       32.04717 415.9942       22.06637 182.4631 7.221664 184.4390 4.913930 -1.975983      8.734938 
1 1 1 8   21 10 o 111.1122 3.427068 150.7979       9.268317 150.7126       17.08799 150.8335       11.03203 110.7502 6.358277 111.0682 4.082902 -0.3180161     7.556307 
1 1 1 8   21 11 o 297.9451 4.742578 1084.954       34.43395 1205.313       75.31017 1053.141       38.71814 312.2805 9.908838 293.4080 5.415099 18.87250       11.29196 
1 1 1 8   21 12 o 153.8759 3.119139 288.9150       11.69611 305.6098       26.15562 284.7422       13.07635 157.6877 6.822756 152.7312 3.513362 4.956543       7.674223 
1 1 1 8   21 13 o 49.38872 2.905683 29.86324       3.481681 29.55477       9.878259 29.90699       3.720431 48.24398 8.723372 49.40824 3.105706 -1.164257      9.259731 
1 1 1 8   21 14 o 119.5844 2.828076 174.4801       8.241416 166.6403       18.58702 176.3987       9.194667 116.3363 6.583156 120.1801 3.142245 -3.843781      7.294631 
1 1 1 8   21 15 o 180.3628 3.364370 397.1988       14.78723 400.5441       31.89648 396.2830       16.68904 180.2879 7.275000 180.1026 3.802553 0.1852875      8.208839 
1 1 1 8   21 16 o 135.3290 3.285485 223.6234       10.83494 199.7198       20.92424 232.3810       12.66517 127.2762 6.770673 137.8553 3.773637 -10.57911      7.751280 
1 1 1 8   21 17 o 182.0417 3.816618 405.0423       16.93112 415.8381       32.87428 401.1449       19.75225 183.5339 7.365239 181.0580 4.476748 2.475830       8.619050 
1 1 1 8   21 18 f 26.74578 8.699992 8.590140       6.497926 9.845697       8.886812 7.147693       9.525284 29.42822 10.18064 27.62549 10.40131 1.802734       14.55447 
1 1 1 8   21 19 o 76.98412 3.557829 72.59444       6.656507 76.63109       13.52573 71.30430       7.646606 78.49044 7.149842 76.22510 4.132010 2.265343       8.257951 
1 1 1 8   21 20 o 20.68309 6.417409 5.248435       3.570807 2.315540       8.499604 5.877024       3.934899 22.98272 9.448085 21.83656 6.730067 1.146154       11.60000 
1 1 1 8   21 21 o 15.12636 5.371758 2.427180       2.484710 5.794074       5.599767 1.601783       2.772596 22.94720 8.071959 14.33690 5.558347 8.610295       9.800599 
1 1 1 8   21 22 o 77.50142 2.598353 73.43481       4.900376 81.02312       8.937376 70.17285       5.859725 81.13897 4.538146 75.69333 3.183864 5.445641       5.543623 
1 1 1 8   21 23 o 45.00313 3.105774 24.88315       3.385142 30.07401       6.614008 23.04077       3.940352 49.07888 5.632043 43.20701 3.780396 5.871872       6.783164 
1 1 1 8   21 24 o 100.2584 2.593633 122.9097       6.331410 134.0650       11.05945 117.4711       7.722056 104.3822 4.357395 97.91581 3.240730 6.466408       5.430398 
1 1 1 8   21 25 o 64.44363 3.949024 51.18520       6.171851 53.90403       12.71347 50.34689       7.059514 64.95858 8.214792 63.78807 4.571816 1.170506       9.401293 
1 1 1 8   21 26 o 38.62880 3.706417 18.49373       3.446247 9.661155       7.555330 20.81422       3.872576 28.03953 9.392504 40.96117 3.927709 -12.92164      10.18067 
1 1 1 8   21 27 o 25.63403 6.686171 8.566049       4.219532 16.08603       8.876004 6.370390       4.796137 34.62715 9.976363 22.76985 7.478658 11.85730       12.46829 
1 1 1 8   21 28 o 57.32148 3.484787 40.61444       4.844770 38.62641       6.898410 42.54935       6.805612 55.42254 5.167256 58.29987 4.833721 -2.877327      7.075691 
1 1 1 8   21 29 o 40.78527 4.403116 20.92746       4.306941 21.91834       6.170105 19.98586       6.014734 41.08076 6.369448 39.12827 6.538520 1.952484       9.128095 
1 1 1 8   21 30 o 86.93723 3.165975 93.48643       6.696126 92.17809       9.371167 94.85130       9.571515 85.67541 4.504325 86.89385 4.535883 -1.218445      6.392431 
1 1 1 8   21 31 o 30.55302 5.874323 12.39356       4.214861 12.57597       5.479702 12.12928       6.595660 30.13751 7.493126 29.26577 8.648040 0.8717384      11.44271 
1 1 1 8   21 32 o 22.81467 6.241663 7.114579       3.569977 8.035337       5.025333 6.176487       5.072415 24.04348 7.634931 21.77968 7.680687 2.263794       10.82983 
1 1 1 8   21 33 o 41.73121 4.330525 22.51385       4.339952 29.95956       6.104808 14.90588       6.170967 47.50674 5.367146 31.73355 7.987040 15.77319       9.622841 
1 1 1 8   21 34 o 14.61769 6.077048 1.444442       3.570489 3.831390       4.805820 -1.496339      5.334299 18.35632 7.257999 14.75047 6.722587 3.605844       9.893014 
1 1 1 8   21 35 o 12.16121 5.629145 -1.989353      3.945019 -5.124603      4.485582 8.717594       8.289256 11.36342 5.472309 23.19609 9.407886 -11.83266      10.88368 
1 1 1 8   21 36 o 23.31185 6.204150 8.266217       3.586267 6.304686       5.069132 10.23180       5.074367 20.05515 7.579677 24.71671 7.646969 -4.661560      10.76697 
1 1 1 8   21 37 o 11.47589 5.326229 -1.553563      3.567804 -5.653916      5.551837 1.331110       4.656659 12.23352 5.938500 14.89948 6.570902 -2.665952      8.856779 
1 1 1 8   21 38 o 15.07833 6.101840 2.987855       3.478126 6.409555       5.030991 -0.1448124     4.813818 18.99072 7.451361 13.67501 6.289704 5.315714       9.751060 
1 1 1 8   21 39 o 19.00373 6.539404 6.443313       3.664884 5.914189       5.319234 6.921474       5.056593 17.77655 7.406054 18.75864 7.436110 -0.9820900     10.49502 
1 1 1 8   21 40 o 16.81938 6.908089 5.455244       4.538551 7.203215       10.17858 5.021469       5.070517 17.34257 8.323664 16.38358 7.043903 0.9589920      10.90413 
1 1 1 8   21 41 o 12.85895 5.716224 1.711691       3.593121 4.166827       5.174617 -0.5742404     4.993121 15.24655 6.813294 12.49058 5.949675 2.755971       9.045420 
1 1 1 8   22 0  o 150.5208 2.878988 276.2818       10.56021 289.1103       16.52636 267.4292       13.72858 153.8285 4.413198 147.9958 3.809794 5.832748       5.830167 
1 1 1 8   22 1  o 222.1638 4.563552 602.6388       24.70657 0.000000       0.000000 602.6388       24.70657 ?        ?        222.1638 4.563552 0.000000       4.563552 
1 1 1 8   22 2  o 35.34404 5.190767 15.58592       4.337669 20.10050       6.631501 12.20998       5.734568 39.92916 7.074230 30.95560 7.647262 8.973560       10.41755 
1 1 1 8   22 3  o 274.9431 5.153103 923.6476       34.52611 824.0367       54.94019 988.6625       44.38571 258.8783 8.721253 284.2382 6.408031 -25.35992      10.82234 
1 1 1 8   22 4  o 153.5344 4.469851 288.0903       16.70599 266.5025       21.51515 320.8681       26.51126 147.4832 5.998922 161.7394 6.741113 -14.25620      9.023839 
1 1 1 8   22 5  o 223.8548 4.508169 611.9743       24.59250 588.7769       29.00513 671.2943       46.38271 219.4589 5.423573 233.7077 8.156679 -14.24873      9.795232 
1 1 1 8   22 6  o 169.5316 2.946749 350.5488       12.17391 371.2247       19.55068 337.4550       15.55824 174.2715 4.607664 166.2764 3.839669 7.995041       5.997801 
1 1 1 8   22 7  o 238.1007 3.983401 692.1011       23.11271 713.9448       45.65872 684.5753       26.80005 241.0494 7.783075 236.7201 4.645842 4.329315       9.064221 
1 1 1 8   22 8  o 112.1106 2.510326 153.2675       6.858243 136.7539       10.19834 166.9013       9.266520 105.7614 3.964018 116.9134 3.255661 -11.15205      5.129597 
1 1 1 8   22 9  o 53.22659 3.231622 34.69501       4.171902 23.63377       9.462401 37.36398       4.648049 42.98132 9.304365 55.22274 3.471520 -12.24142      9.930895 
1 1 1 8   22 10 o 310.3046 7.009776 1181.569       53.00641 1118.223       73.56546 1249.966       76.44203 300.5908 10.05713 317.9083 9.879196 -17.31750      14.09767 
1 1 1 8   22 11 o 186.5672 4.096408 425.2056       18.62407 459.1491       34.26688 410.9755       22.18713 193.1972 7.291517 183.2401 4.973318 9.957031       8.826104 
1 1 1 8   22 12 f 71.51952 3.597338 62.61324       6.249500 61.22157       11.76239 63.16062       7.376861 70.26998 6.960290 71.76845 4.236805 -1.498466      8.148384 
1 1 1 8   22 13 o 85.84399 3.469978 90.12538       7.243972 72.92117       12.78915 98.25227       8.789948 76.73723 6.913151 89.58007 4.036976 -12.84284      8.005549 
1 1 1 8   22 14 o 54.79536 4.426351 36.95568       5.860255 32.49389       9.940338 39.33252       7.255150 50.67247 8.339828 56.41692 5.340754 -5.744450      9.903353 
1 1 1 8   22 15 o 103.6504 4.017994 131.5253       10.12962 157.7995       17.09639 117.3117       12.57448 113.1928 6.221902 97.70372 5.301179 15.48907       8.174018 
1 1 1 8   22 16 o 89.10779 3.497363 97.15230       7.579633 92.26107       14.18923 99.10531       8.966061 86.32544 6.799896 89.93048 4.102077 -3.605042      7.941387 
1 1 1 8   22 17 o 124.0139 4.819021 188.6896       14.53577 178.5764       19.80962 200.4865       21.39517 120.2292 6.788881 127.3801 6.918490 -7.150879      9.693009 
1 1 1 8   22 18 o 18.92241 6.573508 3.960550       3.706753 6.093593       7.994879 3.376469       4.183585 25.41815 9.537897 18.71136 6.923216 6.706781       11.78569 
1 1 1 8   22 19 o 144.4404 3.773648 255.3751       13.27131 261.3495       24.47728 252.8875       15.79436 145.3376 6.931105 143.5918 4.519364 1.745804       8.274350 
1 1 1 8   22 20 o 112.8564 2.906417 155.6875       7.986537 140.7242       17.82396 159.4464       8.933544 106.4880 6.905829 114.1709 3.214138 -7.682892      7.617162 
1 1 1 8   22 21 o 192.5221 3.569157 453.5607       16.74489 447.6406       35.82402 455.2157       18.94143 189.5967 7.770137 192.7587 4.032393 -3.161942      8.754154 
1 1 1 8   22 22 o 144.9277 2.808665 256.6761       9.919451 246.8284       16.31024 262.4565       12.49609 141.6621 4.731299 146.4315 3.501898 -4.769394      5.886296 
1 1 1 8   22 23 o 137.7832 2.776053 232.0682       9.320948 218.4699       15.22060 240.2280       11.79038 133.2017 4.696408 140.0595 3.454452 -6.857758      5.830051 
1 1 1 8   22 24 o 129.9269 3.533568 207.1058       11.17752 216.3811       19.60181 202.6366       13.60646 131.9144 6.114358 128.2870 4.358706 3.627335       7.508907 
1 1 1 8   22 25 o 125.7457 3.141538 193.7646       9.626574 198.3523       14.08286 189.7408       13.18911 126.7451 4.567031 124.0289 4.370547 2.716248       6.321349 
1 1 1 8   22 26 o 78.20743 2.652525 74.97684       5.047945 88.34406       9.164481 69.15486       6.048148 84.44851 4.469190 74.97679 3.318461 9.471718       5.566493 
1 1 1 8   22 27 o 61.41188 3.059740 46.43445       4.564603 38.90556       10.60541 48.14626       5.056965 54.43182 8.253953 62.47638 3.333598 -8.044552      8.901720 
1 1 1 8   22 28 o 33.76178 3.848531 14.27996       3.109859 12.98163       6.067201 14.74262       3.621818 31.03144 7.979066 34.15606 4.457593 -3.124624      9.139784 
1 1 1 8   22 29 o 58.22121 3.587711 42.15022       5.065476 41.68442       7.358900 42.56968       6.983188 57.20837 5.340280 57.97393 4.991488 -0.7655563     7.309824 
1 1 1 8   22 30 o 12.83347 5.790685 -1.595637      3.839440 -0.5582446     5.067044 -2.994304      5.883561 15.66304 6.882925 15.33122 7.014991 0.3318186      9.827754 
1 1 1 8   22 31 o 35.88961 4.909671 16.72472       4.181505 17.97646       6.020337 15.55802       5.812235 36.11451 7.093943 33.40627 7.340509 2.708244       10.20819 
1 1 1 8   22 32 o 52.24835 3.675076 34.56573       4.649389 37.89476       6.599005 31.28426       6.551707 53.81309 5.092754 48.47686 5.651956 5.336235       7.607940 
1 1 1 8   22 33 o 14.80598 6.054789 1.689504       3.467505 -3.690532      4.731023 7.934069       5.096988 12.69805 5.971086 23.23530 7.712983 -10.53726      9.754177 
1 1 1 8   22 34 o 13.50708 5.747395 0.8623733      3.312898 3.639666       4.500605 -2.422227      4.894422 17.66635 7.011457 13.42393 6.233103 4.242419       9.381476 
1 1 1 8   22 35 o 11.31246 5.311726 -2.553179      3.719946 -0.9071881     4.189560 -8.685289      8.086483 13.10546 5.967012 14.34581 7.008840 -1.240351      9.204840 
1 1 1 8   22 36 o 12.31766 5.576368 -0.5408369     3.595344 -6.257528      5.931241 2.779901       4.520542 12.57388 6.111628 16.12444 6.780003 -3.550558      9.128003 
1 1 1 8   22 37 o 28.19368 5.702085 12.06663       3.782842 16.87809       5.702034 8.284268       5.055604 31.10963 7.589831 21.34307 7.653219 9.766563       10.77856 
1 1 1 8   22 38 o 10.24669 4.874017 -2.417244      3.327206 -1.863690      5.033486 -2.846807      4.434067 12.76105 6.048223 11.60257 5.548656 1.158487       8.207836 
1 1 1 8   22 39 o 15.95081 6.266582 4.299716       3.562204 7.873643       5.441323 1.619214       4.712375 19.01004 7.653655 14.03337 6.365449 4.976670       9.954766 
1 1 1 8   22 40 o 12.66545 5.810837 0.7550583      4.073587 18.33172       9.539053 -3.165257      4.505028 21.66066 9.483290 11.03241 5.354045 10.62825       10.89030 
1 1 1 8   23 0  o 245.9507 4.157066 738.4769       24.91558 774.6382       36.00004 705.2306       34.51854 251.6605 5.870187 240.1170 5.899205 11.54349       8.322243 
1 1 1 8   23 1  o 156.0402 3.299498 297.0388       12.54644 319.6960       24.59414 289.0681       14.58733 161.5047 6.260860 153.8463 3.894052 7.658310       7.373060 
1 1 1 8   23 2  o 131.4174 3.069281 210.6608       9.829372 210.0466       13.51766 211.3500       14.31855 131.0933 4.236975 131.4763 4.475577 -0.3829803     6.163014 
1 1 1 8   23 3  o 160.3439 3.347929 313.6800       13.08172 303.3743       17.38286 327.1395       19.86539 157.5364 4.532689 163.5401 4.990511 -6.003754      6.741696 
1 1 1 8   23 4  o 188.3196 3.195473 432.6509       14.66449 426.5212       22.33328 437.2969       19.44322 186.7587 4.911482 189.2409 4.216160 -2.482178      6.472918 
1 1 1 8   23 5  o 192.4915 3.566294 452.1938       16.72880 494.8138       24.40873 414.4412       22.97271 201.2059 4.978153 184.0534 5.126908 17.15253       7.146131 
1 1 1 8   23 6  o 169.0349 3.800718 348.8036       15.65590 335.6236       25.15479 357.1371       20.00209 165.4279 6.251120 170.8783 4.808221 -5.450394      7.886412 
1 1 1 8   23 7  o 40.89878 3.258079 20.53976       3.220370 21.52766       4.536204 19.53594       4.572595 41.73109 4.533394 39.68892 4.826917 2.042171       6.621993 
1 1 1 8   23 8  o 87.34402 2.491575 93.11447       5.297845 87.16321       7.878279 98.02725       7.157979 84.40181 3.840457 89.56512 3.285125 -5.163307      5.053826 
1 1 1 8   23 9  o 275.6300 4.422495 928.4512       29.70503 861.0511       55.34804 955.7197       35.20486 264.2030 8.608125 279.4955 5.168824 -15.29251      10.04074 
1 1 1 8   23 10 o 116.1418 3.477017 164.8227       9.829747 154.3803       17.69505 169.4833       11.82155 111.9942 6.511744 117.7062 4.127733 -5.711975      7.709798 
1 1 1 8   23 11 o 104.3939 2.862937 133.0735       7.276341 120.6405       15.76719 136.4378       8.201953 98.92493 6.577890 105.6793 3.188514 -6.754349      7.309942 
1 1 1 8   23 12 o 139.1654 3.387385 236.4704       11.48767 222.4836       21.85351 241.8110       13.50394 134.4178 6.692622 140.6211 3.944602 -6.203262      7.768595 
1 1 1 8   23 13 o 112.1366 3.159503 153.6330       8.625201 144.7455       17.19034 156.6232       9.971165 108.3517 6.540933 113.1757 3.620060 -4.823921      7.475871 
1 1 1 8   23 14 o 141.0136 3.024644 242.7442       10.39373 264.1510       23.53999 237.5603       11.58406 146.4329 6.613844 139.4642 3.408489 6.968704       7.440479 
1 1 1 8   23 15 o 206.5082 4.384325 521.8341       22.06359 489.3417       37.90601 538.4828       27.13363 198.9018 7.835810 209.5003 5.319105 -10.59853      9.470628 
1 1 1 8   23 16 o 45.85013 3.165795 25.79696       3.515483 26.72359       9.745455 25.65834       3.769268 45.62000 9.085545 45.70031 3.409118 -0.8031464E-01 9.704082 
1 1 1 8   23 17 o 146.2650 3.101675 261.3075       11.05536 267.3495       24.75806 259.8027       12.35559 147.0728 6.927399 145.7973 3.477584 1.275482       7.751287 
1 1 1 8   23 18 o 85.33192 2.819858 89.01411       5.855689 81.42545       13.68064 90.71625       6.479210 80.90720 7.007813 86.11633 3.092475 -5.209122      7.659821 
1 1 1 8   23 19 o 201.3777 3.650268 496.1293       17.91316 494.0110       38.22005 496.7256       20.27831 199.3238 7.884125 201.3837 4.132104 -2.059921      8.901332 
1 1 1 8   23 20 o 135.6770 3.044646 225.0032       10.06651 213.6539       22.14159 227.9603       11.30213 131.1687 6.951781 136.5130 3.397429 -5.344284      7.737557 
1 1 1 8   23 21 o 44.24496 3.379514 24.09154       3.616223 25.15960       9.401342 23.90607       3.917636 44.01928 9.066173 44.03197 3.684827 -0.1268768E-01 9.786390 
1 1 1 8   23 22 o 31.93952 4.259589 12.74150       3.232791 12.59348       9.775526 12.75967       3.425529 32.03566 10.68289 31.91206 4.532215 0.1236038      11.60453 
1 1 1 8   23 23 o 45.14405 4.158422 25.24871       4.523354 23.84814       8.942932 25.73021       5.243559 42.69416 8.885074 45.45186 4.806859 -2.757702      10.10200 
1 1 1 8   23 24 o 90.71373 3.065950 100.9205       6.767834 110.1992       10.37078 94.03785       8.931912 94.44415 4.519206 87.30917 4.210470 7.134979       6.176672 
1 1 1 8   23 25 o 62.62465 2.812328 48.14104       4.280928 47.83700       7.791696 48.27250       5.123515 61.87417 5.216105 62.60981 3.370492 -0.7356453     6.210311 
1 1 1 8   23 26 o 65.33668 3.047637 52.53079       4.839027 48.28709       11.81849 53.38552       5.304005 60.81672 8.181858 65.80757 3.318147 -4.990852      8.829094 
1 1 1 8   23 27 o 11.52909 5.068673 -0.6253113     2.750808 9.812808       8.723103 -1.777942      2.898712 28.17869 10.05886 10.83797 4.945669 17.34072       11.20893 
1 1 1 8   23 28 o 72.92635 2.928435 65.60432       5.193643 61.69373       8.537473 67.90172       6.543746 69.87585 5.047815 73.94843 3.642502 -4.072571      6.224810 
1 1 1 8   23 29 o 11.09836 4.881215 -0.5270304     2.553397 0.5959416      5.202927 -0.8833019     2.930581 16.76427 7.169974 11.59686 5.158357 5.167412       8.832733 
1 1 1 8   23 30 o 14.19184 5.527731 1.779985       2.752038 -0.1844308     5.457552 2.449825       3.186887 16.36525 7.168775 15.70537 5.992496 0.6598845      9.343518 
1 1 1 8   23 31 o 23.75971 6.831579 7.890034       4.166090 7.338004       5.346545 8.743272       6.647015 23.08240 7.899974 24.89915 8.791348 -1.816755      11.81937 
1 1 1 8   23 32 f 36.64277 4.798642 17.73191       4.182056 18.27775       5.806781 17.14369       6.028064 35.82768 6.901219 34.27909 7.430987 1.548595       10.14132 
1 1 1 8   23 33 o 32.82714 5.562682 14.92534       4.291200 17.18940       5.549582 11.55865       6.767337 34.23703 6.890431 26.50715 8.889350 7.729879       11.24716 
1 1 1 8   23 34 o 10.62966 5.000035 -2.584561      3.321990 2.654824       4.758440 -7.565967      4.639812 16.65615 6.976771 10.57371 5.195319 6.082447       8.698659 
1 1 1 8   23 35 o 16.19412 7.008253 2.177110       5.083898 9.012082       6.408268 -9.429866      8.350873 22.50250 8.518271 14.18830 6.971045 8.314194       11.00711 
1 1 1 8   23 36 o 25.78088 6.127315 10.34507       3.792507 9.244635       5.463755 11.36822       5.268409 22.44025 7.966047 25.15743 7.793236 -2.717184      11.14417 
1 1 1 8   23 37 o 16.95760 6.305987 4.577837       3.478912 4.611843       5.156029 4.549418       4.713542 17.23042 7.242720 17.07573 7.029504 0.1546936      10.09311 
1 1 1 8   23 38 o 21.39434 6.579934 8.235178       3.763700 12.13083       5.631359 5.090233       5.059758 23.59488 8.106635 16.97141 7.156635 6.623474       10.81365 
1 1 1 8   23 39 o 14.70361 6.273826 3.230838       3.966780 6.607926       5.302209 -1.062209      5.978172 17.62834 7.372955 13.32030 6.389444 4.308031       9.756304 
1 1 1 8   23 40 o 13.20252 6.032326 1.483541       4.330227 12.34012       9.947153 -1.054900      4.809898 18.27343 8.613014 12.15260 5.802761 6.120830       10.38538 
1 1 1 8   24 0  o 72.42045 2.799810 64.06199       4.931818 56.20295       7.117139 71.32169       6.840378 67.69935 4.336855 76.35477 3.687173 -8.655418      5.692412 
1 1 1 8   24 1  o 53.18376 3.122006 34.62503       4.028419 35.36150       5.811174 33.94369       5.589386 53.61710 4.488747 52.53288 4.406708 1.084229       6.290303 
1 1 1 8   24 2  o 66.10587 2.942312 53.41119       4.727975 62.43309       7.080139 46.15011       6.351743 71.38827 4.086932 61.32265 4.277275 10.06562       5.915918 
1 1 1 8   24 3  o 271.5659 4.013851 900.5224       26.56272 894.1939       41.20526 905.0223       34.74599 270.1932 6.258095 272.0367 5.241327 -1.843475      8.163042 
1 1 1 8   24 4  o 90.77805 2.733551 100.6028       6.040169 106.1302       8.919245 95.92051       8.209059 93.14614 3.938295 88.55556 3.812943 4.590584       5.481669 
1 1 1 8   24 5  o 139.8882 3.122129 238.7691       10.64310 237.2804       14.74297 240.3894       15.38049 139.2924 4.348645 140.1836 4.508187 -0.8912659     6.263742 
1 1 1 8   24 6  o 83.04725 2.632896 84.20557       5.321646 88.43948       8.073658 80.95296       7.076441 85.01012 3.907751 81.35450 3.578169 3.655617       5.298472 
1 1 1 8   24 7  o 191.2224 3.166138 446.2321       14.75383 462.7306       23.41578 435.3698       18.99970 194.4453 4.945700 188.7776 4.130097 5.667709       6.443419 
1 1 1 8   24 8  o 41.67874 3.647645 21.37273       3.667484 18.82857       4.663024 25.49894       5.938419 38.91069 5.035686 45.30991 5.490113 -6.399216      7.449797 
1 1 1 8   24 9  o 137.0036 3.402760 229.1570       11.36055 227.5353       13.97784 232.3131       19.49950 136.3816 4.210839 137.5584 5.830238 -1.176788      7.191859 
1 1 1 8   24 10 o 95.43278 3.260855 111.3106       7.572282 95.91064       14.29359 117.3189       8.928073 88.11655 6.706913 97.93018 3.748068 -9.813622      7.683144 
1 1 1 8   24 11 o 100.9732 2.895735 124.5278       7.117905 119.3708       15.34465 125.9417       8.034623 98.38725 6.435354 101.5135 3.252120 -3.126205      7.210414 
1 1 1 8   24 12 o 48.64158 3.272738 29.02038       3.856737 34.09441       9.454011 28.00737       4.224220 52.05184 7.683963 47.74077 3.658839 4.311069       8.510605 
1 1 1 8   24 13 o 172.9950 3.343114 365.5227       14.09356 388.9055       30.81538 359.3379       15.84821 177.5496 7.136702 171.4663 3.792848 6.083328       8.081968 
1 1 1 8   24 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 8   24 15 o 163.7756 3.258131 327.6587       13.00331 335.1109       28.48427 325.6968       14.61508 164.6848 7.114450 163.2276 3.674272 1.457153       8.007226 
1 1 1 8   24 16 o 14.36826 5.165007 2.127748       2.304237 -2.226001      7.656418 2.561358       2.416259 19.02641 8.406755 15.26802 5.307091 3.758386       9.941768 
1 1 1 8   24 17 o 31.02740 3.835118 11.95600       2.838083 17.46121       9.560184 11.42395       2.972065 36.76426 10.27486 30.27048 4.137205 6.493782       11.07652 
1 1 1 8   24 18 o 96.84958 2.824008 114.6690       6.657876 90.05913       14.64651 121.0787       7.474792 85.01623 7.135397 99.49011 3.086802 -14.47388      7.774461 
1 1 1 8   24 19 o 65.46873 2.945535 52.48488       4.687277 55.33964       12.20130 51.99063       5.076845 66.30701 7.693768 65.12891 3.208655 1.178101       8.336039 
1 1 1 8   24 20 o 119.5903 2.933938 174.8250       8.550333 189.6814       19.93497 171.4758       9.465174 123.5774 6.644165 118.3458 3.285186 5.231567       7.411975 
1 1 1 8   24 21 o 72.37720 3.195245 64.23239       5.621734 0.000000       0.000000 64.23239       5.621734 ?        ?        72.37720 3.195245 0.000000       3.195245 
1 1 1 8   24 22 o 20.22375 6.481806 4.983910       3.615347 5.443509       8.893605 4.892926       3.957054 25.41389 9.926057 20.34613 6.797060 5.067755       12.03024 
1 1 1 8   24 23 o 62.42580 3.688012 48.01772       5.585385 45.96088       11.47074 48.65694       6.394668 59.82679 8.073811 62.73694 4.207036 -2.910152      9.104151 
1 1 1 8   24 24 o 40.13461 3.764127 19.98617       3.638490 25.60762       10.85502 19.27465       3.861899 43.45981 10.39058 39.34348 4.087530 4.116329       11.16566 
1 1 1 8   24 25 o 62.34063 2.839873 47.76838       4.302927 48.66755       7.805279 47.37580       5.157423 62.30336 5.187956 61.96032 3.429099 0.3430443      6.218811 
1 1 1 8   24 26 o 14.40709 5.620152 1.674015       2.848312 -1.832207      7.397445 2.284313       3.086263 18.40118 8.189590 15.60161 5.910236 2.799564       10.09952 
1 1 1 8   24 27 o 64.93537 3.328922 52.21138       5.250120 53.37174       11.41426 51.90002       5.912704 63.66137 7.501443 64.59486 3.772650 -0.9334908     8.396698 
1 1 1 8   24 28 o 12.29315 5.131307 0.5222926      2.560594 -2.721595      5.235800 1.542049       2.935609 14.53457 6.637987 14.26051 5.661731 0.2740669      8.724567 
1 1 1 8   24 29 o 22.59504 5.597261 6.831907       3.065876 2.891625       5.779958 8.374582       3.616582 19.20806 7.831537 24.91444 6.023730 -5.706383      9.880198 
1 1 1 8   24 30 o 38.16677 3.618600 18.43593       3.325396 20.27660       6.206474 17.69475       3.938418 38.31770 6.900497 37.03681 4.452880 1.280895       8.212491 
1 1 1 8   24 31 o 33.00198 4.120533 14.10299       3.241821 13.11542       6.023365 14.50572       3.846433 29.53370 8.118608 33.07889 4.921344 -3.545197      9.493757 
1 1 1 8   24 32 o 14.15562 5.531219 1.996980       2.762601 -1.687036      4.960725 3.653136       3.326098 14.08529 6.443578 16.99519 6.192109 -2.909891      8.936549 
1 1 1 8   24 33 o 25.61308 5.975824 9.538564       3.661337 8.330231       5.138242 10.78495       5.218515 22.91315 7.746093 25.94528 7.698924 -3.032125      10.92133 
1 1 1 8   24 34 o 19.70484 6.858316 5.968604       4.035878 8.727024       6.701122 4.398542       5.055633 22.38583 8.651447 18.18109 7.356894 4.204737       11.35656 
1 1 1 8   24 35 o 13.19950 5.979145 -0.2710806     4.140853 2.205530       4.844326 -6.989447      7.978777 15.77578 6.834146 14.30235 6.982055 1.473438       9.770089 
1 1 1 8   24 36 o 22.36087 6.388944 8.234571       3.654799 15.32495       5.775296 3.498235       4.720206 28.70132 7.972922 16.31994 6.898674 12.38138       10.54321 
1 1 1 8   24 37 o 9.003438 4.399854 -4.309212      3.192558 -2.808808      4.653314 -5.643553      4.388253 11.82288 5.662118 10.30930 5.062816 1.513577       7.595505 
1 1 1 8   24 38 o 17.56308 6.736015 5.814935       4.040520 15.04130       5.573066 -4.408722      5.866538 26.61523 7.970348 12.13838 5.938759 14.47685       9.939583 
1 1 1 8   24 39 o 13.91458 5.912749 2.777960       3.498047 1.213694       5.043596 4.227859       4.855723 13.59994 6.319118 15.49025 6.774295 -1.890307      9.264034 
1 1 1 8   25 0  o 120.3681 2.780679 176.7299       8.156396 176.6712       12.27401 176.7762       10.91499 120.1904 4.197083 120.2733 3.728574 -0.8292389E-01 5.614069 
1 1 1 8   25 1  o 170.9911 3.077500 356.7397       12.82353 347.5238       19.40195 363.8884       17.08806 168.5446 4.728505 172.6076 4.062531 -4.063080      6.234014 
1 1 1 8   25 2  o 208.9481 4.496277 533.5621       22.89431 525.9807       38.19539 537.8135       28.60181 206.7502 7.593945 209.5311 5.606598 -2.780914      9.439383 
1 1 1 8   25 3  o 21.38967 5.711156 5.796552       3.032799 5.191298       3.994449 6.620353       4.660143 20.94850 6.821680 23.35720 7.344008 -2.408701      10.02346 
1 1 1 8   25 4  o 226.6828 3.571497 627.3437       19.72899 632.7729       30.56467 623.4660       25.83092 227.3492 5.516839 225.8182 4.694019 1.530945       7.243571 
1 1 1 8   25 5  o 76.33969 2.819089 71.19547       5.235385 66.28878       7.321022 76.33096       7.489768 73.54633 4.101078 78.95654 3.904753 -5.410217      5.662679 
1 1 1 8   25 6  o 83.74780 2.864256 85.67577       5.836892 92.35040       8.162622 78.69154       8.349784 86.86493 3.865792 80.12587 4.291944 6.739059       5.776256 
1 1 1 8   25 7  f 50.10933 3.285327 30.78297       3.989619 37.87836       5.476130 22.75666       5.824297 55.52774 4.075335 42.71848 5.740018 12.80925       7.039614 
1 1 1 8   25 8  o 238.3631 3.997501 694.2964       23.22008 682.2263       32.56619 706.7782       33.11703 235.9377 5.664135 240.1469 5.658983 -4.209213      8.006655 
1 1 1 8   25 9  o 84.39270 2.550462 86.96588       5.239153 84.00792       7.763703 89.43926       7.099351 82.82784 3.857009 85.51377 3.413659 -2.685928      5.150688 
1 1 1 8   25 10 o 127.1191 3.568310 197.5472       11.04281 188.7462       19.31585 201.8203       13.45921 123.7897 6.425133 128.3909 4.307892 -4.601234      7.735649 
1 1 1 8   25 11 o 11.88692 5.386539 -1.945923      3.364407 -5.695743      6.343956 -0.4785820     3.968446 15.20839 7.073465 14.34496 6.199915 0.8634272      9.406001 
1 1 1 8   25 12 o 173.9427 3.960888 369.9436       16.78939 357.3031       29.79593 375.8243       20.32294 170.1151 7.203809 175.1192 4.766733 -5.004089      8.638090 
1 1 1 8   25 13 o 100.3687 3.388061 123.2150       8.274894 126.7752       15.98593 121.9120       9.671439 101.2967 6.510468 99.76261 3.986231 1.534088       7.633887 
1 1 1 8   25 14 o 83.47357 2.886045 85.17861       5.861846 88.73491       13.53296 84.35727       6.503622 84.62318 6.615001 83.03623 3.220146 1.586952       7.357144 
1 1 1 8   25 15 o 167.3403 3.318272 342.2139       13.53158 350.5527       29.27344 339.9479       15.25973 168.3130 7.153382 166.7157 3.756075 1.597260       8.079540 
1 1 1 8   25 16 o 107.8389 2.883514 142.1425       7.570834 145.2670       17.37535 141.4103       8.411281 108.3018 6.615134 107.5197 3.213852 0.7820892      7.354511 
1 1 1 8   25 17 o 87.03517 2.813667 92.63064       5.959812 76.90131       13.81094 96.22995       6.606602 78.44897 7.308450 88.68283 3.061641 -10.23386      7.923831 
1 1 1 8   25 18 o 151.0194 3.186384 278.8750       11.72647 273.2536       25.16615 280.4340       13.25317 148.3410 6.981352 151.3684 3.592927 -3.027328      7.851650 
1 1 1 8   25 19 o 41.39869 3.709392 21.15858       3.702566 0.000000       0.000000 21.15858       3.702566 ?        ?        41.39869 3.709392 0.000000       3.709392 
1 1 1 8   25 20 o 52.61170 4.093157 34.17685       5.206533 0.000000       0.000000 34.17685       5.206533 ?        ?        52.61170 4.093157 0.000000       4.093157 
1 1 1 8   25 21 o 16.01027 5.983510 2.424472       3.139869 17.50975       8.669886 0.1472301      3.368537 36.41175 9.626136 13.70047 5.811226 22.71129       11.24424 
1 1 1 8   25 22 f 89.81924 3.417810 99.11362       7.467243 117.4186       15.49988 93.58107       8.521308 96.72076 6.616001 87.13332 4.024020 9.587440       7.743656 
1 1 1 8   25 23 o 68.26498 3.026819 57.25310       5.022724 62.35324       12.09796 56.19092       5.521034 69.95654 7.199214 67.56193 3.363957 2.394608       7.946375 
1 1 1 8   25 24 o 22.86942 5.501848 6.788260       3.028709 6.698056       8.570326 6.801133       3.237618 25.70414 9.822290 22.87006 5.801315 2.834078       11.40757 
1 1 1 8   25 25 o 21.94994 5.943149 6.285012       3.256404 12.38573       9.141743 5.398409       3.485003 30.65825 10.33215 20.57763 6.332152 10.08062       12.11815 
1 1 1 8   25 26 o 13.30254 5.589836 0.4732338      3.069651 -4.267555      7.551330 1.411710       3.359772 17.19166 7.896333 14.87104 6.004594 2.320613       9.920042 
1 1 1 8   25 27 o 14.14208 5.455419 1.779544       2.660995 8.395477       5.160976 -0.6161217     3.105628 24.97609 7.709332 12.22354 5.379404 12.75255       9.400626 
1 1 1 8   25 28 f 39.78327 3.594195 19.89247       3.446937 19.86637       6.189548 19.90420       4.150027 38.29134 6.886343 39.50624 4.384456 -1.214897      8.163650 
1 1 1 8   25 29 f 17.73974 5.732208 4.079928       2.823583 0.8769304      5.039561 5.545462       3.408885 16.47610 7.051847 20.31015 6.264892 -3.834055      9.432784 
1 1 1 8   25 30 o 46.91861 3.279267 27.75303       3.725763 28.52816       6.950047 27.44045       4.413528 45.51550 6.446186 46.30762 3.948722 -0.7921143     7.559479 
1 1 1 8   25 31 f 11.31409 4.946208 -0.1351562     2.586637 0.2835193      4.985702 -0.2893533     3.025699 15.48495 6.815252 12.02370 5.299884 3.461252       8.633449 
1 1 1 8   25 32 o 27.09664 4.648456 9.962909       2.958982 9.784060       5.322193 10.04292       3.559884 24.75317 7.856835 26.57996 5.669047 -1.826794      9.688547 
1 1 1 8   25 33 o 21.68568 5.904904 6.981662       3.203904 4.189470       6.602556 7.841636       3.664224 18.89496 8.079019 22.69448 6.367815 -3.799517      10.28687 
1 1 1 8   25 34 o 22.10641 5.376812 7.186199       2.868325 2.751594       5.196822 9.128979       3.439713 16.57776 7.129290 24.64801 5.820391 -8.070250      9.203463 
1 1 1 8   25 35 o 9.630499 4.548828 -2.151329      2.801391 -1.734483      4.686463 -2.383089      3.494430 12.77636 5.987246 10.72933 5.071630 2.047028       7.846562 
1 1 1 8   25 36 o 13.09341 5.694250 1.277152       3.390104 -4.414694      4.871001 6.624228       4.721172 11.48539 5.572332 18.97894 7.280734 -7.493551      9.168423 
1 1 1 8   25 37 o 13.62306 5.956098 1.851765       3.751369 2.809251       5.224654 0.8328416      5.389668 15.19797 6.814787 14.11018 6.548007 1.087790       9.450805 
1 1 1 8   25 38 o 10.29209 4.907752 -2.028608      3.416361 -6.174638      4.836395 2.100557       4.826549 10.38391 5.139787 14.15569 6.429288 -3.771777      8.231230 
1 1 1 8   26 0  o 186.4473 3.638359 424.4741       16.53095 390.6751       30.96743 437.9439       19.54937 178.1852 7.146269 189.3100 4.237631 -11.12482      8.308229 
1 1 1 8   26 1  o 79.21167 2.904190 76.65972       5.596474 70.00449       8.027742 82.95258       7.806128 75.55371 4.378914 82.31617 3.902589 -6.762459      5.865586 
1 1 1 8   26 2  o 290.7434 5.471426 1035.128       38.76559 932.0502       62.01017 1101.256       49.66729 274.4561 9.284952 299.4787 6.805632 -25.02261      11.51204 
1 1 1 8   26 3  o 129.2028 3.129230 203.7402       9.852481 195.8660       13.18143 213.7086       14.83101 126.5176 4.281555 132.1167 4.613643 -5.599075      6.294237 
1 1 1 8   26 4  o 68.14509 3.169536 56.80324       5.248981 49.38410       6.648303 69.08154       8.552699 63.41327 4.328186 75.00603 4.702861 -11.59276      6.391407 
1 1 1 8   26 5  o 349.2889 4.899963 1492.998       41.70746 1358.679       61.38272 1608.192       56.84483 332.2056 7.582336 361.9421 6.444894 -29.73645      9.951305 
1 1 1 8   26 6  o 47.07788 3.370025 27.19978       3.840644 36.79633       5.707673 19.25933       5.191874 54.69029 4.317652 39.25751 5.584387 15.43279       7.058860 
1 1 1 8   26 7  o 128.5243 2.740231 201.5623       8.582397 196.8153       13.05513 205.1751       11.38937 126.8045 4.230765 129.5517 3.611138 -2.747231      5.562346 
1 1 1 8   26 8  o 33.13639 3.976808 13.61264       3.147180 14.76610       4.354999 12.35181       4.553181 34.30540 5.386710 31.17756 6.211132 3.127836       8.221606 
1 1 1 8   26 9  o 78.12665 2.596964 74.55929       4.937388 78.10844       7.360147 71.65533       6.657631 79.85478 3.793087 76.49995 3.581208 3.354828       5.216565 
1 1 1 8   26 10 o 112.0652 3.019638 153.4394       8.238834 164.7877       17.61477 150.2617       9.321266 115.6257 6.275046 110.8508 3.454861 4.774925       7.163258 
1 1 1 8   26 11 o 156.4120 4.968253 300.0952       18.91292 274.9529       25.10771 333.0743       28.75571 149.2356 6.922826 164.1966 7.204141 -14.96100      9.991255 
1 1 1 8   26 12 o 64.54317 3.174123 51.00680       4.977095 52.42919       11.12731 50.65105       5.564788 64.80756 7.165290 64.27592 3.566732 0.5316391      8.003934 
1 1 1 8   26 13 o 46.24301 6.154348 26.76247       6.763258 25.93331       8.865427 27.91689       10.46070 45.03198 8.387255 46.50674 9.550120 -1.474762      12.71027 
1 1 1 8   26 14 o 42.58182 4.068418 22.39583       4.170417 24.04103       9.026062 21.94928       4.702462 43.18898 8.873102 42.06054 4.666330 1.128437       10.02530 
1 1 1 8   26 15 o 22.35692 5.805281 6.381474       3.190442 7.681699       7.796860 6.119977       3.496579 26.61056 9.508632 21.99727 6.237298 4.613285       11.37181 
1 1 1 8   26 16 o 182.4738 4.044610 407.9066       17.98512 414.1699       33.04208 405.2697       21.43933 182.5529 7.443104 181.6056 4.848804 0.9473267      8.883169 
1 1 1 8   26 17 o 27.06520 5.343121 9.324909       3.398916 0.000000       0.000000 9.324909       3.398916 ?        ?        27.06520 5.343121 0.000000       5.343121 
1 1 1 8   26 18 f 109.3842 3.987984 146.9193       10.61248 0.000000       0.000000 146.9193       10.61248 ?        ?        109.3842 3.987984 0.000000       3.987984 
1 1 1 8   26 19 o 89.07494 3.332503 97.30119       7.220973 86.53355       14.29383 100.9908       8.367163 83.02669 7.133808 90.66461 3.795473 -7.637924      8.080646 
1 1 1 8   26 20 o 50.34036 3.698804 31.26145       4.505791 45.91906       10.79285 28.16756       4.958576 60.07912 7.537294 47.66042 4.316103 12.41870       8.685595 
1 1 1 8   26 21 o 108.9970 2.959060 145.6309       7.852401 134.9142       17.63321 148.2818       8.769986 103.4652 7.035455 109.9105 3.278001 -6.445320      7.761631 
1 1 1 8   26 22 o 54.42846 3.185129 36.47924       4.206172 23.50098       9.673298 39.50517       4.670847 41.77979 9.689511 56.60745 3.401686 -14.82767      10.26928 
1 1 1 8   26 23 o 64.11581 3.039287 50.59785       4.735161 45.62193       10.97181 51.73679       5.249177 59.23520 7.789432 64.76848 3.337015 -5.533283      8.474133 
1 1 1 8   26 24 o 10.07405 4.652506 -2.059598      2.672583 -8.996827      5.932916 -0.2935191     2.993507 12.84765 6.213285 12.38825 5.369439 0.4594069      8.211930 
1 1 1 8   26 25 o 17.57715 5.807166 3.785693       2.890301 -2.733835      7.485375 4.928028       3.133302 17.87808 8.074439 19.59757 5.999259 -1.719496      10.05921 
1 1 1 8   26 26 o 37.86075 4.009944 18.07314       3.643504 9.412950       8.622668 19.95549       4.020020 27.14755 9.957431 39.73523 4.215862 -12.58768      10.81314 
1 1 1 8   26 27 o 45.83636 3.312663 26.24190       3.675221 33.95624       6.766240 23.01338       4.377231 51.13535 5.517106 42.55803 4.278673 8.577320       6.981797 
1 1 1 8   26 28 o 13.99944 5.458356 1.756006       2.685578 5.362985       4.985047 0.2811118      3.187703 20.77325 7.578803 13.11044 5.609841 7.662807       9.429134 
1 1 1 8   26 29 o 38.04158 3.652509 18.42696       3.344436 24.38509       6.422552 16.21024       3.917489 42.05770 6.473845 35.17648 4.686528 6.881226       7.992135 
1 1 1 8   26 30 o 14.04303 5.488314 1.919914       2.720352 -0.1036813     5.166252 2.696242       3.199899 15.47124 6.867183 15.65945 5.997367 -0.1882029     9.117379 
1 1 1 8   26 31 o 28.04565 4.895409 10.74045       3.224077 13.34027       7.473155 10.14589       3.573768 27.64859 9.341748 26.77732 5.654419 0.8712692      10.91974 
1 1 1 8   26 32 o 52.01017 3.064881 34.57950       3.867306 40.19184       6.963232 32.07615       4.650494 53.56137 5.408890 49.38330 3.895943 4.178062       6.665918 
1 1 1 8   26 33 o 21.65429 5.540516 6.933055       2.935339 4.278366       5.331360 8.087857       3.516292 18.01025 7.451149 22.97428 6.156429 -4.964031      9.665466 
1 1 1 8   26 34 o 10.12582 4.762555 -2.069004      3.012587 4.580160       5.073629 -5.689882      3.744054 17.70211 7.290806 9.571797 4.695721 8.130315       8.672119 
1 1 1 8   26 35 f 18.23302 6.046234 5.400743       3.132329 11.15541       5.357279 2.411595       3.861070 23.85859 7.907055 14.66069 6.220179 9.197897       10.06042 
1 1 1 8   26 36 o 14.42410 5.611320 3.034435       2.833161 6.985190       5.207972 1.373792       3.376499 18.68336 7.499686 12.96464 5.659811 5.718720       9.395678 
1 1 1 8   26 37 o 11.59273 5.044920 0.9636425      2.664686 1.600525       4.779793 0.6764425      3.209754 13.94852 6.359598 11.96072 5.353962 1.987799       8.313206 
1 1 1 8   27 0  o 148.2818 3.283796 268.4292       11.86588 252.8871       15.91666 287.8739       17.80315 143.7250 4.550207 153.3194 4.770813 -9.594391      6.592803 
1 1 1 8   27 1  o 55.42070 3.220216 37.62097       4.330304 37.66904       6.027384 37.56969       6.225363 55.31719 4.510403 55.22340 4.669728 0.9378433E-01  6.492311 
1 1 1 8   27 2  o 102.3172 3.237574 127.9337       8.062271 111.0334       14.36426 135.7063       9.741387 94.91451 6.245024 105.3249 3.801601 -10.41042      7.311121 
1 1 1 8   27 3  o 18.92052 6.144444 4.245038       3.241903 2.466358       4.290366 6.612148       4.949425 17.82256 6.913053 23.50263 7.588816 -5.680071      10.26550 
1 1 1 8   27 4  o 235.7218 3.689237 678.8399       21.19202 648.2175       31.93223 702.9432       28.33014 229.9182 5.699277 239.6368 4.851311 -9.718536      7.484449 
1 1 1 8   27 5  o 139.0813 2.845699 236.0772       9.644811 229.4067       14.50098 241.3691       12.91586 136.8841 4.352720 140.4939 3.775930 -3.609787      5.762275 
1 1 1 8   27 6  o 126.4683 2.782638 195.1960       8.575797 203.8545       13.23885 188.9361       11.25682 129.0400 4.215733 124.2897 3.720777 4.750282       5.622863 
1 1 1 8   27 7  o 141.6996 2.844254 245.0761       9.821395 235.4821       14.80648 252.6140       13.12427 138.6633 4.387339 143.7213 3.750499 -5.058029      5.771914 
1 1 1 8   27 8  o 195.1656 4.058272 465.8149       19.30103 446.7659       31.86892 476.8494       24.25545 190.3578 6.881382 197.2011 5.051514 -6.843216      8.536464 
1 1 1 8   27 9  o 147.9945 3.209106 267.5147       11.57353 265.3631       15.72967 270.0545       17.08967 147.1787 4.390604 148.4110 4.731368 -1.232269      6.454707 
1 1 1 8   27 10 o 86.74489 3.691193 92.15833       7.784897 90.21053       13.53151 93.12200       9.517792 85.34824 6.556225 87.08976 4.499956 -1.741516      7.951962 
1 1 1 8   27 11 o 137.2041 3.145367 229.9663       10.51658 229.1840       21.97911 230.1985       11.97654 136.2069 6.641806 137.1739 3.585886 -0.9669647     7.547990 
1 1 1 8   27 12 o 94.58139 2.963594 109.3716       6.822195 93.15520       14.01890 114.4037       7.809279 86.64964 6.690920 96.69334 3.319118 -10.04369      7.468933 
1 1 1 8   27 13 o 37.73982 4.036188 17.63526       3.654425 17.98868       8.802661 17.56167       4.016942 37.21683 9.632248 37.59175 4.472563 -0.3749237     10.61998 
1 1 1 8   27 14 o 19.44611 5.825173 4.706718       2.976519 23.85192       8.897230 2.293950       3.158512 42.97321 8.792719 15.90976 5.989648 27.06345       10.63898 
1 1 1 8   27 15 o 135.5838 3.484168 225.0735       11.50226 0.000000       0.000000 225.0735       11.50226 ?        ?        135.5838 3.484168 0.000000       3.484168 
1 1 1 8   27 16 f 127.1976 3.386460 198.1393       10.48756 0.000000       0.000000 198.1393       10.48756 ?        ?        127.1976 3.386460 0.000000       3.386460 
1 1 1 8   27 17 o 42.09814 3.478139 21.85152       3.536363 9.147079       8.834471 24.27562       3.859024 28.49256 10.12798 44.36908 3.600019 -15.87652      10.74877 
1 1 1 8   27 18 o 81.83016 2.897956 82.02038       5.769725 91.12025       13.59661 80.02186       6.371880 85.35305 6.587904 80.77192 3.243810 4.581131       7.343214 
1 1 1 8   27 19 o 57.55852 3.010394 40.67711       4.207817 41.99761       10.58789 40.42943       4.585488 57.29409 7.784568 57.33918 3.295575 -0.4509354E-01 8.453420 
1 1 1 8   27 20 o 26.08243 4.685054 8.650625       2.868381 7.758148       8.222434 8.774283       3.060653 26.59311 9.728519 26.21389 4.973117 0.3792152      10.92593 
1 1 1 8   27 21 f 114.7331 2.963496 161.5540       8.278766 157.0885       18.33771 162.6971       9.278104 111.4534 6.783870 115.0355 3.313172 -3.582077      7.549702 
1 1 1 8   27 22 o 39.56072 3.862341 19.49892       3.676125 31.12364       8.722007 16.98779       4.053779 48.81907 7.576962 36.71561 4.633789 12.10345       8.881574 
1 1 1 8   27 23 o 57.19126 3.152118 40.38936       4.376082 35.98935       10.30770 41.35677       4.833277 51.91554 8.436987 57.79969 3.447129 -5.884148      9.114024 
1 1 1 8   27 24 o 22.66135 5.393769 6.734559       2.935411 8.314338       7.113001 6.410286       3.222628 25.74861 9.094017 22.06717 5.884980 3.681435       10.83209 
1 1 1 8   27 25 o 44.67071 3.542793 24.92552       3.825037 34.01148       9.366350 23.10691       4.190391 50.03590 7.947015 42.83364 4.063103 7.202267       8.925461 
1 1 1 8   27 26 o 46.70703 3.532617 27.33806       3.991013 32.78035       9.231949 26.08720       4.425962 48.59170 8.080061 45.42719 4.040226 3.164516       9.033870 
1 1 1 8   27 27 o 21.43286 5.769452 6.220298       3.079604 3.659992       7.155457 6.802365       3.411755 20.86804 8.632730 22.33115 6.098691 -1.463106      10.56968 
1 1 1 8   27 28 o 33.32480 3.908742 14.26109       3.113985 18.40926       5.764882 12.55210       3.700255 36.26532 6.772219 30.68590 5.129211 5.579426       8.495397 
1 1 1 8   27 29 o 21.08973 5.417480 6.157620       2.798781 3.756130       5.156362 7.160627       3.332383 18.62981 7.467841 22.53376 5.972909 -3.903950      9.562651 
1 1 1 8   27 30 o 31.02851 4.627008 12.94055       3.391829 20.14188       7.800059 11.26131       3.766587 34.59832 9.122858 28.27141 5.664741 6.326910       10.73852 
1 1 1 8   27 31 o 15.52537 5.544031 3.177551       2.650111 4.527206       4.838013 2.598988       3.167603 18.44118 7.285178 15.11642 5.918072 3.324758       9.386021 
1 1 1 8   27 32 o 12.79666 5.181912 1.509971       2.510314 4.482018       4.863504 0.4306214      2.930911 18.06709 7.249104 12.19185 5.298448 5.875246       8.979034 
1 1 1 8   27 33 o 8.820198 4.182030 -2.212360      2.410997 3.871932       4.879486 -4.177603      2.773174 17.09690 7.105678 8.451101 4.123579 8.645802       8.215508 
1 1 1 8   27 34 o 17.22391 6.056749 4.689962       3.152580 6.137355       5.359641 3.924257       3.898282 18.69772 7.571633 16.31371 6.508764 2.384005       9.984670 
1 1 1 8   27 35 o 9.189185 4.461775 -3.689767      3.139029 -1.847041      5.132722 -4.790789      3.967485 12.75043 6.061755 10.02520 4.900393 2.725229       7.794789 
1 1 1 8   27 36 o 10.82163 4.891955 -0.3389891E-01 2.755002 -2.062464      5.120045 0.7927874      3.268509 12.38975 5.935119 12.19762 5.435238 0.1921310      8.047823 
1 1 1 8   27 37 o 10.19783 4.746622 -0.8721507     2.865160 0.4071715      5.427946 -1.366289      3.373414 13.52429 6.370821 10.60591 5.004130 2.918377       8.101153 
1 1 1 8   28 0  f 145.9646 2.974450 260.0641       10.58011 245.0496       15.55071 273.0040       14.43642 141.4517 4.517137 149.3952 3.968915 -7.943497      6.013053 
1 1 1 8   28 1  o 322.5246 5.180984 1274.447       40.72031 1361.237       59.07109 1195.861       56.20984 332.4321 7.291819 311.5327 7.404107 20.89948       10.39189 
1 1 1 8   28 2  o 143.8453 3.292230 252.6846       11.54043 231.0620       15.04079 283.6349       17.99487 137.3459 4.499928 152.1216 4.860484 -14.77567      6.623719 
1 1 1 8   28 3  o 73.03328 3.490843 65.30662       6.194811 70.39661       11.48935 63.22040       7.355585 75.43455 6.307828 71.77279 4.224213 3.661758       7.591618 
1 1 1 8   28 4  o 34.84292 5.194639 15.19959       4.276098 9.773865       6.954024 18.49849       5.422410 28.29270 8.980984 38.36707 5.995676 -10.07437      10.79843 
1 1 1 8   28 5  o 260.7780 3.967903 831.5393       25.21553 797.2374       38.06953 858.3504       33.65704 254.7194 6.133090 264.6081 5.219593 -9.888687      8.053505 
1 1 1 8   28 6  o 84.94329 2.765561 88.16515       5.717014 83.07085       8.251666 92.86786       7.928190 82.30401 4.127364 87.08087 3.744824 -4.776863      5.573046 
1 1 1 8   28 7  o 58.63409 3.011739 42.09179       4.288900 36.81163       5.883185 48.08092       6.265712 54.65517 4.455811 62.55355 4.133554 -7.898376      6.077871 
1 1 1 8   28 8  o 43.40618 3.869590 23.22447       4.050232 25.71708       5.162954 19.23590       6.531002 45.57431 4.716917 38.88976 7.154991 6.684547       8.569901 
1 1 1 8   28 9  o 33.75963 4.532212 14.20867       3.634479 15.51521       4.494327 11.73945       6.178493 35.14685 5.421529 30.26465 8.182867 4.882193       9.815921 
1 1 1 8   28 10 o 169.4313 3.999591 351.3589       16.51373 315.5131       27.80981 370.8828       20.52401 159.6105 7.168199 173.8251 4.849963 -14.21455      8.654780 
1 1 1 8   28 11 o 101.4696 3.056851 125.9195       7.550070 130.4632       16.22561 124.6638       8.529769 102.6199 6.522088 100.9073 3.473975 1.712555       7.389596 
1 1 1 8   28 12 o 62.20760 3.258000 47.43903       4.921690 52.29603       10.77705 46.15912       5.532289 64.66374 6.948031 61.30322 3.720791 3.360519       7.881588 
1 1 1 8   28 13 o 70.78424 3.410937 61.43101       5.866327 0.000000       0.000000 61.43101       5.866327 ?        ?        70.78424 3.410937 0.000000       3.410937 
1 1 1 8   28 14 o 93.43594 3.301522 106.9376       7.505528 0.000000       0.000000 106.9376       7.505528 ?        ?        93.43594 3.301522 0.000000       3.301522 
1 1 1 8   28 15 o 76.82320 2.975183 72.28044       5.559304 68.32949       12.67382 73.22176       6.186211 73.79093 7.137023 77.27835 3.292511 -3.487419      7.859881 
1 1 1 8   28 16 o 15.15478 5.574166 2.265177       2.705169 1.409112       8.161549 2.370833       2.867250 21.79622 9.133940 15.55144 5.735497 6.244779       10.78540 
1 1 1 8   28 17 o 30.45831 4.222303 11.61813       3.049767 4.994953       7.397892 12.97418       3.347450 23.64909 9.103187 32.18651 4.381447 -8.537420      10.10273 
1 1 1 8   28 18 o 58.33738 3.028605 41.80074       4.290778 48.53630       10.71474 40.51430       4.682639 61.78281 7.254754 57.37633 3.363808 4.406479       7.996665 
1 1 1 8   28 19 o 65.57130 2.942595 52.80019       4.689996 63.10101       11.66789 50.81517       5.121994 70.53992 6.874814 64.26294 3.281577 6.276978       7.617862 
1 1 1 8   28 20 f 17.10039 6.901051 1.825073       4.435219 3.594191       7.013284 0.6459905      5.725524 21.83640 8.724159 17.90605 7.584848 3.930357       11.56031 
1 1 1 8   28 21 o 78.55506 3.117067 75.99023       5.955160 80.07142       12.47098 74.78473       6.777854 79.26801 6.513453 77.79635 3.584808 1.471657       7.434778 
1 1 1 8   28 22 f 38.21006 3.601515 18.19582       3.313949 23.33024       8.278208 17.21596       3.616370 41.52586 8.467903 37.04158 4.073487 4.484276       9.396738 
1 1 1 8   28 23 o 22.48451 5.463935 6.645457       2.964036 2.683180       7.400447 7.402521       3.234831 21.10614 8.759561 23.69809 5.676269 -2.591948      10.43791 
1 1 1 8   28 24 f 58.25928 3.793797 42.45573       5.356815 54.63470       11.21108 38.85257       6.097956 64.01612 7.317903 55.40401 4.556792 8.612114       8.620676 
1 1 1 8   28 25 o 51.83019 3.287955 33.52576       4.131430 33.57799       9.337139 33.51305       4.606950 49.13897 8.077878 51.66566 3.683267 -2.526691      8.877982 
1 1 1 8   28 26 o 33.06825 4.269841 14.07182       3.360564 23.57996       8.287086 12.20053       3.676416 40.12182 8.725008 30.39723 5.146578 9.724590       10.12981 
1 1 1 8   28 27 o 24.29739 5.450788 8.039401       3.147790 6.266817       7.584621 8.408250       3.459828 22.71297 9.073165 24.69699 5.841001 -1.984026      10.79072 
1 1 1 8   28 28 o 28.67375 4.943013 11.05864       3.329226 17.56644       9.456196 10.13785       3.556963 31.60508 10.50611 27.09658 5.572931 4.508497       11.89268 
1 1 1 8   28 29 f 12.19317 5.345687 -0.3165435E-01 3.040393 0.000000       0.000000 -0.3165435E-01 3.040393 ?        ?        12.19317 5.345687 0.000000       5.345687 
1 1 1 8   28 30 o 11.06628 4.870222 -0.1247057     2.545671 2.197474       5.048147 -0.9166053     2.947944 16.51907 7.063747 11.11987 5.040221 5.399208       8.677578 
1 1 1 8   28 31 o 24.49349 4.965878 8.482369       2.862460 13.61734       5.478178 6.553840       3.357224 28.59163 7.694259 20.75499 6.179193 7.836634       9.868336 
1 1 1 8   28 32 o 20.28205 5.491844 6.168332       2.780531 9.378492       5.532549 5.083484       3.216225 22.72327 8.020788 18.20457 6.128411 4.518703       10.09408 
1 1 1 8   28 33 o 9.430711 4.428230 -1.762903      2.585575 3.172118       5.051904 -3.514371      3.009620 16.21555 7.001770 9.186516 4.438467 7.029030       8.290040 
1 1 1 8   28 34 o 33.67847 4.876451 16.74313       3.885813 22.96319       6.275917 12.87613       4.948425 35.67217 7.459876 26.23604 7.413568 9.436132       10.51716 
1 1 1 8   28 35 f 7.914008 3.889067 -4.103418      2.603039 1.218980       5.068223 -6.010427      3.033740 14.11525 6.478048 7.946824 3.956618 6.168429       7.590779 
1 1 1 8   28 36 o 10.10886 4.713919 -1.005189      2.846665 -1.494700      5.533559 -0.8290196     3.319617 12.82206 6.149607 10.92077 5.091841 1.901299       7.984016 
1 1 1 8   29 0  o 152.1994 3.049828 282.8488       11.31161 285.5351       17.22110 280.8104       15.00164 152.6393 4.635131 151.4709 4.067865 1.168320       6.167007 
1 1 1 8   29 1  o 116.2972 2.892448 165.1144       8.197298 162.7214       12.02220 167.1936       11.20622 115.2392 4.288505 116.8648 3.940589 -1.625580      5.824047 
1 1 1 8   29 2  o 199.0623 3.396570 484.1315       16.47653 498.8335       25.56510 473.6859       21.54892 201.6275 5.207452 196.7027 4.495511 4.924820       6.879475 
1 1 1 8   29 3  o 198.0862 3.386812 479.4162       16.34863 450.0666       24.18721 504.1044       22.18343 191.5034 5.187684 202.9116 4.486273 -11.40826      6.858477 
1 1 1 8   29 4  o 130.6993 2.949132 208.5879       9.392983 216.7956       14.06328 201.9774       12.62085 133.0086 4.344640 128.4281 4.037683 4.580429       5.931170 
1 1 1 8   29 5  o 138.6341 3.052047 234.7379       10.31092 246.1432       22.33870 231.6501       11.62314 141.2212 6.508657 137.6283 3.468375 3.592941       7.375109 
1 1 1 8   29 6  o 182.2645 3.628464 406.1913       16.11614 374.7790       30.85596 417.9753       18.89879 174.0073 7.292884 184.7803 4.197031 -10.77304      8.414346 
1 1 1 8   29 7  o 73.69016 2.894106 66.42043       5.186983 59.07566       7.273633 74.02051       7.398975 69.31729 4.327586 77.67834 3.921413 -8.361046      5.839990 
1 1 1 8   29 8  o 139.6922 2.868967 238.3410       9.766379 241.8949       15.00630 235.7295       12.86348 140.4354 4.390303 138.7458 3.808143 1.689590       5.811774 
1 1 1 8   29 9  o 48.11757 3.316543 28.43855       3.865098 34.53770       5.538606 22.64874       5.396320 52.91481 4.333155 42.61011 5.311997 10.30471       6.855184 
1 1 1 8   29 10 o 67.11224 3.960496 55.34488       6.448406 0.000000       0.000000 55.34488       6.448406 ?        ?        67.11224 3.960496 0.000000       3.960496 
1 1 1 8   29 11 o 98.78735 3.504930 119.5559       8.424189 0.000000       0.000000 119.5559       8.424189 ?        ?        98.78735 3.504930 0.000000       3.504930 
1 1 1 8   29 12 o 44.72332 3.918105 24.69579       4.227092 38.10564       9.722273 21.56992       4.693980 54.88282 7.462477 41.64357 4.707947 13.23925       8.823453 
1 1 1 8   29 13 o 12.12288 5.353432 -0.9320761     3.100613 0.7380576E-01  7.300436 -1.153454      3.424855 19.87183 8.495950 12.62625 5.598539 7.245584       10.17471 
1 1 1 8   29 14 o 75.01994 3.042470 68.97053       5.550565 82.23277       12.89212 65.95281       6.149721 81.11774 6.578278 73.29637 3.452703 7.821373       7.429327 
1 1 1 8   29 15 f 41.16526 3.792644 20.96754       3.761858 26.24117       8.789353 19.78483       4.162370 44.98748 8.323822 39.87828 4.353844 5.109203       9.393720 
1 1 1 8   29 16 o 9.008768 4.272827 -3.052690      2.520792 4.985585       6.836882 -4.317363      2.711851 23.06269 8.782586 8.714089 4.210939 14.34860       9.739909 
1 1 1 8   29 17 o 41.59695 3.539757 21.40137       3.554102 27.88862       8.849897 20.15391       3.880803 46.27100 8.146007 40.27128 4.007622 5.999722       9.078461 
1 1 1 8   29 18 o 56.93063 3.108095 39.88922       4.295620 38.00845       10.13807 40.30076       4.742366 54.11978 7.921656 57.16467 3.419963 -3.044888      8.628370 
1 1 1 8   29 19 o 79.86059 3.152869 78.49306       6.123789 86.78548       13.00204 76.12918       6.941968 82.67422 6.506039 78.51688 3.638024 4.157333       7.454110 
1 1 1 8   29 20 o 46.32464 3.271481 26.55355       3.669359 28.99358       9.016233 26.06919       4.017075 46.67180 8.228030 45.81783 3.627397 0.8539658      8.992135 
1 1 1 8   29 21 o 58.28007 3.456291 42.10552       4.886655 43.11765       9.716847 41.76288       5.653617 57.46350 7.089142 57.86316 4.034760 -0.3996620     8.156913 
1 1 1 8   29 22 o 56.98524 3.127837 40.22110       4.326871 51.06990       10.40941 37.95511       4.757334 62.35918 6.969000 55.22068 3.554170 7.138508       7.822985 
1 1 1 8   29 23 o 35.71099 3.952995 16.11537       3.382515 11.06825       7.420711 17.43905       3.800273 28.19918 9.304490 37.05180 4.287961 -8.852625      10.24501 
1 1 1 8   29 24 o 30.34141 4.591262 11.90453       3.288706 9.255580       7.853153 12.46789       3.621565 26.18655 9.518566 30.91698 4.975698 -4.730434      10.74061 
1 1 1 8   29 25 o 55.16198 3.248500 38.11190       4.347423 28.85134       9.845201 40.35501       4.845421 43.71601 9.512567 56.63030 3.528661 -12.91429      10.14595 
1 1 1 8   29 26 o 22.86009 5.490725 7.147951       3.020272 12.02969       7.458520 6.190439       3.303218 27.84654 9.332193 21.14449 6.084186 6.702051       11.14034 
1 1 1 8   29 27 o 20.10865 6.236485 5.679427       3.372715 0.000000       0.000000 5.679427       3.372715 ?        ?        20.10865 6.236485 0.000000       6.236485 
1 1 1 8   29 28 o 27.49696 4.740194 10.25129       3.061596 8.098659       7.427007 10.69197       3.360395 22.94420 9.038039 27.85813 5.139257 -4.913935      10.39702 
1 1 1 8   29 29 o 46.35037 3.508306 27.80996       3.933235 44.95403       10.34769 24.91464       4.252411 52.71252 8.332108 43.42754 4.065480 9.284981       9.271039 
1 1 1 8   29 30 o 51.81180 4.370225 36.21064       5.466434 43.88656       12.35595 34.34262       6.095411 46.30771 11.09486 49.58590 5.117836 -3.278187      12.21835 
1 1 1 8   29 31 o 26.39217 4.649178 9.788285       2.880922 15.14876       5.485491 7.746588       3.385396 29.93208 7.528572 22.36946 6.060977 7.562618       9.665134 
1 1 1 8   29 32 o 26.33953 5.221363 10.28979       3.232953 11.10808       5.836083 9.927505       3.883223 23.71434 8.247648 24.69596 6.400599 -0.9816284     10.43989 
1 1 1 8   29 33 o 20.80216 6.320117 7.360215       3.486092 10.68719       5.631942 5.293759       4.438607 22.62686 8.081832 17.55045 6.963788 5.076406       10.66819 
1 1 1 8   29 34 o 8.861495 4.328809 -4.065788      3.081562 -8.489006      5.048929 -1.439889      3.890175 10.15754 5.064816 11.48330 5.404431 -1.325758      7.406769 
1 1 1 8   29 35 o 18.05960 5.941624 5.698297       3.026795 12.88927       5.821854 3.034595       3.543320 23.39440 8.230371 14.43857 6.032204 8.955826       10.20424 
1 1 1 8   30 0  o 78.41827 3.458335 75.30704       6.592512 69.11616       8.384247 85.33385       10.67012 74.96776 4.611694 83.21799 5.288945 -8.250229      7.017169 
1 1 1 8   30 1  o 51.31367 3.621431 32.35342       4.499361 31.34616       6.283754 33.41319       6.445441 50.27737 5.203878 51.93241 5.161288 -1.655037      7.329341 
1 1 1 8   30 2  f 152.9794 3.060706 285.8784       11.41014 266.0435       16.67631 303.3375       15.64569 147.2589 4.652944 157.3729 4.083153 -10.11409      6.190479 
1 1 1 8   30 3  o 114.1373 2.905837 159.2094       8.075728 157.0276       11.75492 161.1597       11.11365 113.1546 4.270624 114.6840 3.982699 -1.529305      5.839531 
1 1 1 8   30 4  o 120.7937 2.953791 178.2311       8.694811 179.5453       12.87596 177.1295       11.78851 120.9799 4.374676 120.2239 4.029455 0.7560730      5.947630 
1 1 1 8   30 5  o 102.0546 2.915945 127.3250       7.244401 146.3822       10.94927 112.4871       9.661419 109.2572 4.119814 95.75115 4.150434 13.50610       5.847988 
1 1 1 8   30 6  o 46.76290 3.863260 26.94589       4.363178 27.77911       5.705056 25.77182       6.772198 47.30605 5.025699 45.29840 6.305646 2.007648       8.063425 
1 1 1 8   30 7  o 53.89819 4.626184 35.89353       6.017496 0.000000       0.000000 35.89353       6.017496 ?        ?        53.89819 4.626184 0.000000       4.626184 
1 1 1 8   30 8  o 34.52774 6.168056 15.13872       4.999357 0.000000       0.000000 15.13872       4.999357 ?        ?        34.52774 6.168056 0.000000       6.168056 
1 1 1 8   30 9  o 20.47318 5.866791 5.292016       3.077429 9.920251       4.116741 -0.5702446     4.633171 27.80409 6.230557 15.42662 6.683213 12.37747       9.137023 
1 1 1 8   30 10 o 145.2088 3.310564 258.0087       11.71470 280.5518       24.72666 251.4843       13.30234 150.2672 6.769898 143.2119 3.815046 7.055298       7.770849 
1 1 1 8   30 11 o 52.45412 3.760395 33.89230       4.774833 20.64268       9.033277 39.02960       5.624850 39.66407 9.475807 56.24866 4.132422 -16.58459      10.33769 
1 1 1 8   30 12 o 15.18143 6.060464 1.465529       3.381701 -3.320837      6.428867 3.296518       3.976257 16.49210 7.462391 18.27446 6.751662 -1.782362      10.06341 
1 1 1 8   30 13 o 54.19170 3.482024 36.14462       4.574002 36.87864       9.614288 35.92989       5.200210 53.78086 7.542980 53.94650 3.983789 -0.1656380     8.530365 
1 1 1 8   30 14 o 98.37573 3.013560 118.6231       7.215916 97.58605       14.42749 125.6410       8.333059 88.13847 6.769022 101.1688 3.384805 -13.03033      7.568128 
1 1 1 8   30 15 f 48.68872 3.607252 29.27431       4.249573 40.14904       9.940334 26.84234       4.700795 55.99582 7.470899 46.49919 4.193501 9.496632       8.567368 
1 1 1 8   30 16 o 34.11441 4.509870 14.62286       3.657445 18.78155       7.509533 13.32961       4.187693 37.64944 8.398685 32.30418 5.517584 5.345261       10.04896 
1 1 1 8   30 17 o 62.45314 3.335904 48.08951       5.058543 52.02558       10.51535 46.90435       5.770073 63.79822 6.871870 61.55231 3.866342 2.245907       7.884871 
1 1 1 8   30 18 o 55.87877 3.157726 38.51961       4.282392 43.07041       10.15568 37.53543       4.722807 57.59506 7.407109 55.07135 3.537869 2.523708       8.208641 
1 1 1 8   30 19 o 79.98137 3.295573 78.98830       6.409506 61.08324       11.87090 86.35605       7.614887 68.58973 7.209801 83.47268 3.753144 -14.88295      8.128181 
1 1 1 8   30 20 o 68.95621 2.947558 58.67690       4.941615 61.24808       11.39578 58.08144       5.484051 68.57134 6.914011 68.49716 3.295099 0.7418060E-01  7.659061 
1 1 1 8   30 21 o 18.78475 5.604715 4.574522       2.759676 -0.3053943     6.087202 5.836980       3.096136 17.35815 7.588147 21.03078 5.836005 -3.672630      9.572823 
1 1 1 8   30 22 o 37.45234 5.496901 18.30391       4.867653 30.98825       8.890696 12.87408       5.816944 47.42792 7.975191 30.36839 7.814952 17.05953       11.16589 
1 1 1 8   30 23 o 21.20851 5.495948 6.030003       2.863374 4.985729       6.716538 6.261951       3.165441 21.72731 8.583659 21.55137 5.869774 0.1759338      10.39872 
1 1 1 8   30 24 o 15.42004 5.637222 2.697971       2.760100 -7.573664      6.274790 5.162189       3.073400 13.49343 6.491501 19.57357 5.931631 -6.080140      8.793397 
1 1 1 8   30 25 o 33.60833 4.514932 14.78084       3.604270 0.000000       0.000000 14.78084       3.604270 ?        ?        33.60833 4.514932 0.000000       4.514932 
1 1 1 8   30 26 o 11.20481 5.040088 -0.8847939     2.882856 0.000000       0.000000 -0.8847939     2.882856 ?        ?        11.20481 5.040088 0.000000       5.040088 
1 1 1 8   30 27 o 23.56178 5.486169 7.840488       3.090978 12.23276       7.424310 6.919534       3.399621 26.59457 9.299003 21.80819 6.138721 4.786383       11.14250 
1 1 1 8   30 28 o 18.83002 5.998959 5.144080       3.100362 3.862165       8.112177 5.363353       3.355060 19.72693 8.687379 19.14737 6.253036 0.5795650      10.70378 
1 1 1 8   30 29 o 9.748034 4.552943 -1.858521      2.672821 -0.3729861     6.989746 -2.112944      2.892663 16.32724 7.534588 10.02146 4.698679 6.305780       8.879617 
1 1 1 8   30 30 o 13.31321 5.446839 1.711009       2.807738 1.481447       7.891303 1.744283       3.004337 17.37817 8.014626 13.58280 5.603914 3.795372       9.779472 
1 1 1 8   30 31 o 23.47005 5.930364 8.647041       3.392595 8.833343       7.851273 8.604270       3.761934 20.78430 8.846016 22.88544 6.463002 -2.101133      10.95547 
1 1 1 8   30 32 o 10.01923 4.703289 -1.682096      2.913316 7.177392       8.266835 -2.938405      3.113030 18.95261 8.529184 9.601554 4.606984 9.351056       9.693879 
1 1 1 8   30 33 o 16.52087 6.301221 4.565855       3.522843 13.65165       5.881023 -0.5188541     4.399511 25.03434 8.284106 12.64287 5.883713 12.39147       10.16093 
1 1 1 8   30 34 o 21.81663 6.631238 8.815052       3.837190 8.037924       6.009144 9.350101       4.986126 18.78646 7.852620 20.84329 7.583358 -2.056833      10.91654 
1 1 1 8   31 0  o 73.39375 3.271764 65.97459       5.836925 72.24684       7.877180 58.33731       8.692184 76.68114 4.231880 68.71764 5.229966 7.963501       6.727656 
1 1 1 8   31 1  o 162.2624 4.097877 322.6597       16.19069 323.0976       26.02186 322.3830       20.68141 161.6282 6.620725 161.8953 5.249092 -0.2671814     8.449080 
1 1 1 8   31 2  o 159.5168 3.496919 311.2292       13.59340 314.1573       18.41426 307.7228       20.15084 159.9441 4.729632 158.1570 5.235614 1.787094       7.055571 
1 1 1 8   31 3  o 86.88750 3.421252 92.47308       7.229841 95.04105       12.40059 91.15067       8.898761 87.65203 5.838852 86.13920 4.252430 1.512833       7.223251 
1 1 1 8   31 4  o 64.78955 3.928180 51.59657       6.172871 60.35635       9.904060 46.03218       7.893603 69.73943 5.882520 60.94209 5.370103 8.797340       7.965052 
1 1 1 8   31 5  o 65.72980 4.103040 53.15522       6.539324 57.39721       9.695367 49.61486       8.857347 67.97147 5.912065 63.17998 5.818217 4.791496       8.294827 
1 1 1 8   31 6  o 71.68282 2.967128 62.91854       5.171869 62.90720       7.423231 62.92923       7.209698 71.48685 4.280797 71.52051 4.154550 -0.3365326E-01 5.965359 
1 1 1 8   31 7  o 81.54420 3.178341 81.45962       6.303723 86.24805       8.437428 75.41008       9.483625 83.75436 4.146858 78.13559 5.007039 5.618774       6.501297 
1 1 1 8   31 8  o 53.96527 3.599702 35.82886       4.706811 37.01752       6.173330 34.17844       7.274198 54.67943 4.677863 52.29501 5.805787 2.384422       7.455841 
1 1 1 8   31 9  o 37.22572 4.807395 17.32929       4.259305 14.79850       7.819093 18.39711       5.079001 33.67788 9.246849 38.20274 5.623765 -4.524853      10.82271 
1 1 1 8   31 10 o 70.29714 3.497562 60.70794       5.972733 57.54466       11.50447 61.87515       6.988324 67.57819 7.091439 70.87096 4.063430 -3.292770      8.173125 
1 1 1 8   31 11 f 57.81174 3.691299 41.17279       5.173170 46.87355       10.56554 39.37517       5.932995 60.80216 7.275004 56.40941 4.349617 4.392746       8.476135 
1 1 1 8   31 12 o 33.34200 5.179037 14.06103       4.071517 22.37216       8.474307 11.56675       4.642447 41.26191 8.702235 29.89184 6.554190 11.37007       10.89432 
1 1 1 8   31 13 o 85.38963 3.102040 89.49651       6.444161 88.51465       13.44494 89.78934       7.342509 83.83588 6.635079 85.43650 3.534303 -1.600616      7.517684 
1 1 1 8   31 14 o 21.39748 6.465679 5.804013       3.655429 6.791692       7.262806 5.468934       4.230297 24.94663 9.140471 21.23439 7.025916 3.712244       11.52873 
1 1 1 8   31 15 o 52.27364 3.803636 33.85313       4.812115 25.25317       8.689910 37.65665       5.779090 43.64235 8.476524 55.01266 4.346110 -11.37031      9.525762 
1 1 1 8   31 16 o 53.59796 3.401854 35.50866       4.420315 43.21515       9.619605 33.44588       4.976868 57.93635 6.952194 51.87741 3.966873 6.058933       8.004316 
1 1 1 8   31 17 o 17.28479 5.902692 3.516620       2.984499 6.408610       7.005683 2.875393       3.298816 24.08752 8.950300 16.68871 6.152525 7.398815       10.86101 
1 1 1 8   31 18 o 13.10472 5.333945 0.9434580      2.675698 3.030927       6.533458 0.5227901      2.932937 20.56655 8.348297 13.10010 5.481633 7.466455       9.987110 
1 1 1 8   31 19 o 12.15543 5.100462 0.4056192      2.549990 -4.579460      6.444857 1.330876       2.776569 15.43154 7.160909 13.75219 5.490983 1.679343       9.023829 
1 1 1 8   31 20 o 45.08635 3.402122 25.36222       3.710349 33.39170       9.104919 23.76328       4.063017 49.56773 7.794779 43.48227 3.874981 6.085457       8.704830 
1 1 1 8   31 21 f 62.75493 3.400814 49.15300       5.181327 40.36600       9.794375 52.56767       6.105626 54.35134 7.602547 64.66895 3.892361 -10.31762      8.541030 
1 1 1 8   31 22 o 10.75162 4.808473 -0.8652170     2.582878 -2.185342      6.622415 -0.6283779     2.805018 16.54991 7.522317 11.46762 5.076647 5.082290       9.075109 
1 1 1 8   31 23 o 50.30995 3.786474 32.13902       4.608144 27.67068       9.167428 33.64977       5.330530 42.84661 9.063431 51.18211 4.313942 -8.335506      10.03772 
1 1 1 8   31 24 o 16.78513 5.992968 3.505095       3.096565 0.000000       0.000000 3.505095       3.096565 ?        ?        16.78513 5.992968 0.000000       5.992968 
1 1 1 8   31 25 o 14.51020 5.584028 2.234162       2.783188 -1.480731      6.839629 2.971360       3.046852 16.48985 7.552034 15.82150 5.897943 0.6683474      9.582220 
1 1 1 8   31 26 o 50.77499 3.960949 33.63345       4.862253 33.13128       9.666462 33.80354       5.625751 44.57556 9.203894 50.29691 4.642251 -5.721348      10.30835 
1 1 1 8   31 27 o 22.51046 5.589476 7.318545       3.052044 1.203077       7.622668 8.486106       3.330673 17.95073 8.123754 24.18458 5.738321 -6.233845      9.946040 
1 1 1 8   31 28 o 17.30262 5.958509 4.313834       3.042888 12.15334       8.511101 3.164932       3.258239 24.66599 9.687665 15.76251 6.048016 8.903485       11.42057 
1 1 1 8   31 29 o 51.34106 4.830350 36.91538       5.972370 39.89843       10.56857 35.51580       7.239082 45.10564 9.888247 48.27944 6.303355 -3.173801      11.72645 
1 1 1 8   31 30 o 19.14263 5.840706 5.750437       2.973046 10.37246       8.343085 5.078142       3.181930 21.70237 9.172679 17.94495 6.095414 3.757423       11.01327 
1 1 1 8   31 31 o 14.19023 5.680549 2.619762       2.979397 0.1028387      8.324293 2.989563       3.190774 15.98851 7.634213 14.77266 5.890347 1.215853       9.642479 
1 1 1 8   31 32 o 11.41838 5.338330 -1.210011      3.689293 10.11622       8.005445 -4.264120      4.157048 20.07568 8.740304 10.49452 5.104496 9.581161       10.12170 
1 1 1 8   31 33 o 18.38764 6.920310 6.524300       4.215558 9.109986       10.78623 6.058142       4.579820 18.40203 8.759614 17.70198 7.057418 0.7000561      11.24891 
1 1 1 8   32 0  o 104.1754 3.716259 133.0724       9.419129 136.5299       15.18492 130.9101       12.00855 105.0065 5.958630 103.1086 4.792356 1.897865       7.646696 
1 1 1 8   32 1  o 147.6527 3.937391 267.3720       14.15462 269.1489       23.32536 266.3363       17.80838 147.3178 6.513465 147.0819 4.975708 0.2359009      8.196517 
1 1 1 8   32 2  o 21.90513 6.388855 6.053603       3.619861 7.777342       4.690261 3.514375       5.692619 24.78986 7.284062 20.60869 7.971408 4.181171       10.79819 
1 1 1 8   32 3  o 65.95348 3.980419 53.52388       6.367611 53.73043       7.432941 52.95424       12.34375 65.96343 4.653911 64.65453 8.005379 1.308907       9.259858 
1 1 1 8   32 4  o 18.12477 6.309064 3.655617       3.415380 1.927551       4.751407 5.503066       4.912789 17.82413 7.160428 21.95844 7.570713 -4.134314      10.42053 
1 1 1 8   32 5  o 64.24557 3.040408 50.60270       4.746541 48.47021       6.999646 52.41806       6.458239 62.61959 4.619533 65.23162 4.083228 -2.612034      6.165455 
1 1 1 8   32 6  o 18.31686 6.134508 3.922913       3.222943 9.971802       4.519851 -2.334198      4.596987 27.78085 6.744910 14.02632 6.331911 13.75453       9.251319 
1 1 1 8   32 7  f 47.39600 3.587779 27.69499       4.113068 25.75967       5.595133 29.97050       6.066990 45.41216 5.146573 49.02339 5.155555 -3.611233      7.284707 
1 1 1 8   32 8  o 86.29304 2.892398 91.22317       6.073734 99.25258       9.043594 84.62559       8.197687 89.76481 4.145464 82.88858 4.070906 6.876228       5.810090 
1 1 1 8   32 9  o 87.66583 3.082181 94.25023       6.574284 94.69520       8.714458 93.66246       10.01563 87.65804 4.090835 87.00918 4.741563 0.6488647      6.262376 
1 1 1 8   32 10 o 35.14040 4.316204 15.43490       3.618564 17.80142       4.478235 10.98308       6.142152 37.62436 5.008591 29.03588 8.277977 8.588474       9.675272 
1 1 1 8   32 11 o 86.02170 3.221997 90.90808       6.742190 86.72148       13.05840 92.42978       7.872698 82.97079 6.510569 86.61717 3.738585 -3.646378      7.507631 
1 1 1 8   32 12 o 44.02858 4.536677 24.21967       4.797931 17.92048       8.080505 27.64984       5.962847 36.55958 9.104625 46.86980 5.314332 -10.31021      10.54212 
1 1 1 8   32 13 o 43.52609 4.405967 23.67723       4.609043 31.35233       8.347998 20.31174       5.527962 49.25528 7.164852 39.88486 5.862269 9.370415       9.257500 
1 1 1 8   32 14 o 66.34311 3.249964 54.27062       5.238257 55.34358       10.94615 53.95192       5.965708 65.65041 6.947359 66.02609 3.722830 -0.3756866     7.881958 
1 1 1 8   32 15 f 27.13183 5.251488 9.512608       3.346629 6.370896       6.523537 10.63476       3.898757 23.70871 8.666647 28.57993 5.796465 -4.871225      10.42640 
1 1 1 8   32 16 f 61.64994 3.209942 46.98898       4.805820 40.12542       9.975824 49.06328       5.484151 55.13042 7.629712 62.88569 3.593630 -7.755264      8.433663 
1 1 1 8   32 17 o 61.73025 3.199116 47.18337       4.796008 57.69592       10.93265 44.67815       5.336963 66.48609 6.845462 59.91219 3.673123 6.573902       7.768666 
1 1 1 8   32 18 o 59.22505 3.171192 43.51202       4.560134 42.79572       9.916353 43.70412       5.135336 56.61715 7.361475 59.21412 3.575492 -2.596970      8.183853 
1 1 1 8   32 19 o 23.42050 5.332577 7.270561       2.975034 8.326684       7.009008 7.038470       3.285707 25.22701 9.015297 22.92575 5.859758 2.301266       10.75232 
1 1 1 8   32 20 o 47.07635 3.363048 27.75202       3.832675 23.13728       8.629206 28.88609       4.277770 39.76207 9.102550 47.90201 3.693103 -8.139935      9.823208 
1 1 1 8   32 21 o 17.13535 5.574636 3.788834       2.667854 -0.7388940     5.540469 5.155532       3.043986 15.92243 7.086895 19.58409 5.896363 -3.661656      9.219067 
1 1 1 8   32 22 o 19.48118 5.922870 5.165180       3.060915 0.000000       0.000000 5.165180       3.060915 ?        ?        19.48118 5.922870 0.000000       5.922870 
1 1 1 8   32 23 o 12.43738 5.218045 0.7058302      2.668345 1.632038       6.865744 0.5410393      2.896009 18.51382 8.076749 12.66018 5.379831 5.853636       9.704455 
1 1 1 8   32 24 o 9.888808 4.555205 -1.515394      2.538432 -4.141950      6.338153 -1.013607      2.770316 14.55500 6.864912 10.81804 4.896449 3.736961       8.432214 
1 1 1 8   32 25 o 54.71876 3.845402 38.94235       5.094952 52.01249       10.65626 35.06915       5.800955 58.23237 7.697732 51.12157 4.709389 7.110806       9.024047 
1 1 1 8   32 26 o 12.87564 5.367009 1.140180       2.795546 8.294546       7.529358 -0.3770834E-02 3.010759 22.41013 9.009947 12.02787 5.294825 10.38226       10.45057 
1 1 1 8   32 27 o 57.83370 4.010745 44.46395       5.617503 61.03123       11.94493 39.75932       6.365331 60.29439 8.353781 53.55815 4.932439 6.736240       9.701268 
1 1 1 8   32 28 o 51.94646 5.048615 38.28583       6.310420 46.88283       11.81713 34.85633       7.463706 47.86895 10.42616 47.23741 6.669174 0.6315460      12.37670 
1 1 1 8   32 29 o 20.99610 6.116800 7.076316       3.319803 2.988611       8.427625 7.827119       3.611838 17.71166 8.208500 21.86033 6.383461 -4.148668      10.39846 
1 1 1 8   32 30 o 19.82281 6.001711 6.440735       3.147445 -0.1503522     7.805604 7.720481       3.439458 15.66093 7.453923 21.54249 6.211369 -5.881554      9.702683 
1 1 1 8   32 31 o 15.97242 6.559665 3.979966       4.091825 9.193576       8.901272 2.583068       4.607500 19.38654 8.775602 14.95935 6.568879 4.427188       10.96181 
1 1 1 8   33 0  o 44.05331 4.357814 24.07937       4.617020 25.45983       5.777998 21.64101       7.679175 45.10970 5.360921 40.89333 7.992575 4.216370       9.623966 
1 1 1 8   33 1  o 77.10693 3.071551 72.87770       5.759932 77.34258       8.237422 68.60613       8.057118 79.21825 4.283000 74.56100 4.454680 4.657249       6.179665 
1 1 1 8   33 2  o 28.21942 6.322431 10.26788       4.239733 11.40642       5.302591 8.249990       7.059304 29.63852 7.372182 26.46517 9.076982 3.173357       11.69362 
1 1 1 8   33 3  o 107.6142 3.156100 141.9305       8.267742 152.9274       11.31248 129.3216       12.11327 111.4700 4.171866 102.3036 4.872866 9.166451       6.414772 
1 1 1 8   33 4  o 66.68008 3.012147 54.54119       4.881863 65.10938       7.348867 46.19382       6.531229 72.65474 4.168183 61.10767 4.415727 11.54707       6.072264 
1 1 1 8   33 5  o 13.03866 5.728459 -0.8414130     3.508112 -1.815374      4.293882 1.113771       6.083775 13.79966 6.183646 18.90621 7.901849 -5.106543      10.03378 
1 1 1 8   33 6  o 43.19872 3.816634 23.10373       3.976505 28.61103       5.662752 17.74604       5.585303 47.88060 4.923320 37.23731 6.384758 10.64328       8.062519 
1 1 1 8   33 7  o 57.32666 3.122218 40.40148       4.345238 38.27037       6.332647 42.29758       5.973277 55.46749 4.730102 58.44938 4.222149 -2.981895      6.340379 
1 1 1 8   33 8  o 66.12080 3.060848 53.71679       4.918537 52.37814       6.860791 55.13230       7.054997 65.01283 4.355639 66.70520 4.364079 -1.692368      6.165774 
1 1 1 8   33 9  o 91.49327 3.790219 103.2331       8.432340 131.3818       14.95597 90.11516       10.20983 102.3343 6.023961 85.11002 4.943965 17.22430       7.793004 
1 1 1 8   33 10 o 109.9530 3.050847 148.5000       8.166646 145.5276       10.94251 152.2372       12.26989 108.4771 4.147089 110.7856 4.554580 -2.308441      6.159752 
1 1 1 8   33 11 o 24.18992 7.678708 7.443970       5.083511 8.802226       6.292051 4.890824       8.626589 26.29453 8.561618 24.32629 9.690042 1.968243       12.93051 
1 1 1 8   33 12 o 30.16568 6.672921 11.96844       4.775126 21.37865       7.725363 6.150283       6.074516 40.00640 8.199872 23.22480 8.381335 16.78161       11.72539 
1 1 1 8   33 13 o 72.50353 4.753317 65.83804       8.351996 69.04126       11.68011 62.48652       11.94744 73.34863 6.605281 69.44898 7.162082 3.899643       9.742954 
1 1 1 8   33 14 o 24.93569 6.005969 8.198112       3.605885 7.583221       6.417404 8.481818       4.359088 24.73732 8.645746 25.25562 6.892046 -0.5183029     11.05664 
1 1 1 8   33 15 o 40.36573 4.207422 20.52110       4.078028 31.74642       8.511816 17.17681       4.645953 48.88818 7.373807 36.50812 5.383524 12.38006       9.129916 
1 1 1 8   33 16 o 49.28913 3.604548 30.32981       4.299570 30.27281       8.457180 30.34968       4.992967 47.40422 7.575972 49.09138 4.214405 -1.687160      8.669288 
1 1 1 8   33 17 o 62.24401 3.215142 48.15955       4.860260 52.43818       10.12437 46.87825       5.540411 62.96194 6.701484 61.19829 3.732821 1.763649       7.670974 
1 1 1 8   33 18 o 9.660254 4.531069 -2.546193      2.694391 3.687609       5.690338 -4.347764      3.059055 19.79305 7.874689 9.386199 4.519878 10.40686       9.079649 
1 1 1 8   33 19 o 13.47304 5.385956 1.383436       2.674593 -5.264087      5.717198 3.245844       3.026152 13.71286 6.483465 16.56512 5.923308 -2.852261      8.781851 
1 1 1 8   33 20 o 17.20728 5.908457 3.744437       2.991308 0.000000       0.000000 3.744437       2.991308 ?        ?        17.20728 5.908457 0.000000       5.908457 
1 1 1 8   33 21 f 15.62761 5.566315 2.970016       2.669790 0.8461809      6.173294 3.458632       2.961016 17.45666 7.636175 16.62801 5.867927 0.8286514      9.630355 
1 1 1 8   33 22 o 23.83862 5.239157 7.816210       2.960341 14.45588       7.686157 6.659708       3.207814 29.45251 9.452080 21.71662 5.906505 7.735893       11.14579 
1 1 1 8   33 23 o 16.99513 5.817480 3.889409       2.899315 5.529788       7.369004 3.588968       3.153667 21.00711 8.731611 16.67710 6.036214 4.330004       10.61494 
1 1 1 8   33 24 o 24.19057 5.423145 8.290976       3.117756 17.04819       8.220048 6.819490       3.369530 30.41928 9.776057 21.54902 6.127203 8.870264       11.53750 
1 1 1 8   33 25 o 10.64935 4.814958 -0.7931294     2.670404 2.516959       6.439281 -1.480638      2.934653 17.73731 7.777873 10.61205 4.891771 7.125262       9.188293 
1 1 1 8   33 26 o 69.63904 4.305573 65.38852       7.270945 66.25423       12.61550 64.95790       8.897355 62.16327 8.554472 67.49152 5.456208 -5.328243      10.14639 
1 1 1 8   33 27 o 24.92559 5.652651 9.344172       3.354168 24.13047       9.210728 7.083552       3.601455 32.92116 10.32106 21.02691 6.430896 11.89425       12.16062 
1 1 1 8   33 28 o 20.71700 6.012921 6.863166       3.213403 4.271212       7.279022 7.490582       3.581270 17.87334 8.026759 21.31961 6.390332 -3.446268      10.25988 
1 1 1 8   33 29 o 18.00606 7.048889 5.614770       4.493526 16.44699       9.120129 2.142167       5.163805 24.28685 9.861572 15.25688 6.812850 9.029968       11.98606 
1 1 1 8   33 30 o 15.17693 6.380568 3.186439       4.002576 13.82696       8.221567 -0.1188932     4.582270 22.44576 9.266391 13.11887 6.070446 9.326880       11.07774 
1 1 1 8   34 0  o 49.64159 4.145280 30.53891       4.968858 28.70573       6.259914 33.66096       8.169326 47.81707 5.470512 51.48692 6.667498 -3.669853      8.624501 
1 1 1 8   34 1  o 47.39460 3.955055 27.81792       4.526306 36.54970       6.532487 19.75463       6.277455 54.13414 5.008673 39.19064 6.820636 14.94350       8.462144 
1 1 1 8   34 2  o 96.20081 3.001816 113.5149       7.028572 121.5064       10.29690 106.5429       9.617639 99.20071 4.269464 92.88287 4.260445 6.317841       6.031559 
1 1 1 8   34 3  o 40.11766 4.168349 20.03977       4.015739 19.89822       5.507462 20.20045       5.867885 39.56060 5.892370 39.76333 6.262608 -0.2027321     8.598853 
1 1 1 8   34 4  o 56.83047 3.325964 39.78470       4.585984 41.33830       6.520161 38.26365       6.451505 57.63144 4.682935 55.39587 4.827279 2.235569       6.725511 
1 1 1 8   34 5  o 79.64521 3.064596 77.92874       5.936874 87.66501       8.553990 68.87995       8.246468 84.19064 4.182450 74.49362 4.564602 9.697014       6.191000 
1 1 1 8   34 6  o 45.71457 3.889229 25.93697       4.291560 30.18618       5.789113 20.75293       6.394276 49.09349 4.904535 40.07371 6.789991 9.019787       8.376063 
1 1 1 8   34 7  o 48.37069 4.042871 29.08041       4.721951 32.04802       5.670065 22.36473       8.529617 50.64098 4.646361 40.87539 8.822116 9.765594       9.970878 
1 1 1 8   34 8  o 27.96780 7.203008 10.32700       4.938905 12.06850       7.206127 8.784265       6.782444 30.13538 9.072022 26.47711 8.899462 3.658274       12.70834 
1 1 1 8   34 9  o 35.05502 4.296924 15.44682       3.593987 18.65608       4.872692 11.61792       5.322352 38.27331 5.372098 29.56779 7.403893 8.705519       9.147517 
1 1 1 8   34 10 o 66.76234 2.974181 54.90714       4.826624 55.26120       6.769127 54.54094       6.884080 66.62294 4.190621 66.15071 4.293664 0.4722290      5.999738 
1 1 1 8   34 11 o 53.79611 3.745715 35.98361       4.879782 30.75267       8.834573 38.28019       5.853783 48.12833 7.799370 55.29479 4.380020 -7.166462      8.945097 
1 1 1 8   34 12 o 81.90177 3.719449 83.29676       7.404112 79.49336       12.20045 85.51419       9.315699 78.56029 6.429074 82.55486 4.649384 -3.994568      7.934089 
1 1 1 8   34 13 o 41.94595 4.340921 22.20699       4.373139 21.93442       7.526930 22.34589       5.373039 40.14856 7.974502 41.68768 5.417014 -1.539124      9.640368 
1 1 1 8   34 14 f 36.10454 5.962987 17.11202       5.063417 24.92147       8.000385 11.89360       6.539887 42.66740 7.987975 29.20903 8.606211 13.45837       11.74200 
1 1 1 8   34 15 o 106.7246 4.667578 144.2054       12.10991 141.4568       16.06447 147.8232       18.43024 104.0396 6.366724 105.3546 7.222315 -1.314949      9.627928 
1 1 1 8   34 16 o 15.83038 6.458872 1.684566       3.934680 6.106663       5.668537 -2.427094      5.465947 22.18049 8.083286 14.92779 6.804032 7.252698       10.56572 
1 1 1 8   34 17 o 42.26784 4.838773 23.13442       4.894311 19.68489       7.078266 26.29460       6.774898 37.09917 8.060319 44.11628 6.496111 -7.017105      10.35221 
1 1 1 8   34 18 o 23.52359 6.580375 7.711459       3.919256 0.000000       0.000000 7.711459       3.919256 ?        ?        23.52359 6.580375 0.000000       6.580375 
1 1 1 8   34 19 o 33.83600 4.945645 15.15929       3.957462 0.000000       0.000000 15.15929       3.957462 ?        ?        33.83600 4.945645 0.000000       4.945645 
1 1 1 8   34 20 o 16.76127 5.841748 3.608764       2.928648 11.89986       7.224588 1.978405       3.203678 27.25530 9.185078 14.78261 5.899611 12.47268       10.91655 
1 1 1 8   34 21 o 12.45185 5.215745 0.8041664      2.659454 8.760486       6.148983 -1.026594      2.949599 23.75293 8.448906 11.17821 5.056627 12.57472       9.846496 
1 1 1 8   34 22 o 22.73057 5.528995 7.328214       3.032834 2.579068       7.441215 8.274275       3.321205 18.96830 8.337996 24.06123 5.744005 -5.092930      10.12501 
1 1 1 8   34 23 o 39.43666 4.447315 20.84887       4.199545 22.70000       8.895786 20.31801       4.763795 34.97336 9.959429 38.27569 5.245145 -3.302330      11.25619 
1 1 1 8   34 24 o 19.22563 6.178641 5.507215       3.283472 10.14150       7.878789 4.533165       3.612093 23.53201 9.296688 17.81853 6.458558 5.713476       11.31995 
1 1 1 8   34 25 o 16.47561 6.030533 3.823536       3.160155 15.83912       8.482985 1.887342       3.405263 27.16383 9.890069 14.26755 5.933402 12.89628       11.53337 
1 1 1 8   34 26 o 13.79561 5.663414 1.956104       3.048510 3.381433       7.682772 1.689751       3.321158 17.97948 8.144354 13.79251 5.806125 4.186977       10.00208 
1 1 1 8   34 27 o 13.90432 6.046208 1.485677       3.821212 7.832738       8.468180 -0.1371591     4.281945 19.90220 8.815147 13.15945 6.007290 6.742754       10.66744 
1 1 1 8   34 28 o 16.45111 6.584022 4.193003       4.001500 12.90778       8.567090 1.761256       4.525478 22.31153 9.354549 14.54006 6.441942 7.771472       11.35809 
1 1 1 8   34 29 o 17.31697 6.898494 5.248827       4.372488 -2.594264      8.708282 7.892713       5.056037 14.99088 7.312948 19.83878 7.553171 -4.847903      10.51331 
1 1 1 8   35 0  o 44.14479 3.844082 24.19703       4.094113 19.69305       5.331175 30.67189       6.392045 39.31580 5.733086 49.33143 5.405578 -10.01563      7.879629 
1 1 1 8   35 1  o 87.81159 3.336813 94.93070       7.127365 93.97907       9.173240 96.38029       11.32167 87.06157 4.337404 87.79191 5.316925 -0.7303391     6.861688 
1 1 1 8   35 2  o 47.87679 4.078299 28.51021       4.712921 25.03063       5.725156 35.82504       8.300924 44.49081 5.390373 52.92097 6.578276 -8.430161      8.504695 
1 1 1 8   35 3  o 38.29996 4.553987 18.43174       4.167239 18.16872       5.039456 19.00053       7.410849 37.71947 5.656767 37.73582 8.286304 -0.1634979E-01 10.03304 
1 1 1 8   35 4  o 105.5779 2.760678 136.8375       7.096627 126.1204       10.67017 145.3385       9.503185 100.7955 4.354315 108.5294 3.598212 -7.733871      5.648644 
1 1 1 8   35 5  f 11.08746 5.051181 -1.794388      3.007817 -1.236326      4.039122 -2.489088      4.506555 13.65172 6.065092 13.61635 6.195349 0.3537655E-01  8.669930 
1 1 1 8   35 6  o 31.45618 4.638448 12.56127       3.449038 11.52587       4.536551 13.97956       5.309494 29.61091 6.468338 32.54504 6.908610 -2.934130      9.464052 
1 1 1 8   35 7  o 46.23014 3.413870 26.50364       3.818859 23.52262       5.377921 29.53568       5.423734 43.02248 5.237381 48.47001 4.648787 -5.447533      7.002955 
1 1 1 8   35 8  o 17.68490 6.038288 3.715106       3.123167 1.011835       4.187183 7.105058       4.688932 15.79708 6.575279 23.41843 7.367126 -7.621356      9.874656 
1 1 1 8   35 9  o 23.14970 6.045690 7.071349       3.447029 6.170893       4.113461 9.194819       6.316832 21.88506 6.902340 26.40242 8.577144 -4.517357      11.00953 
1 1 1 8   35 10 f 32.34129 4.957267 13.43541       3.782566 10.94180       4.507485 19.37224       6.955004 28.61643 6.598591 37.77642 7.813137 -9.159994      10.22675 
1 1 1 8   35 11 o 27.96119 5.943105 10.35585       3.924624 5.586492       6.599268 12.96569       4.881717 22.63937 8.626883 31.11050 6.641346 -8.471130      10.88718 
1 1 1 8   35 12 o 16.25003 6.235940 2.519062       3.464192 8.139398       5.535387 -1.099391      4.441486 24.65970 8.030408 14.28246 6.351799 10.37724       10.23879 
1 1 1 8   35 13 o 10.73541 5.039598 -3.157042      3.345188 2.076995       6.002212 -5.515303      4.028922 18.83920 7.859391 10.82445 5.205992 8.014750       9.427215 
1 1 1 8   35 14 o 54.35713 3.709560 37.14204       4.884324 38.35593       8.809159 36.60320       5.869097 53.29166 6.948596 53.55538 4.539829 -0.2637177     8.300183 
1 1 1 8   35 15 o 12.63667 5.494798 -0.1408422     3.155792 0.3202431      5.576840 -0.3580371     3.827563 16.76497 7.297035 13.65578 5.992092 3.109181       9.442027 
1 1 1 8   35 16 o 32.35374 5.768669 14.11822       4.381341 0.000000       0.000000 14.11822       4.381341 ?        ?        32.35374 5.768669 0.000000       5.768669 
1 1 1 8   35 17 f 39.76100 4.209138 20.40755       4.016515 31.88378       8.986934 17.54307       4.489885 46.58971 8.215775 36.29604 5.226688 10.29367       9.737414 
1 1 1 8   35 18 o 26.61111 6.745605 10.21063       4.379524 17.43249       7.087621 5.750133       5.570160 33.47060 8.633164 20.92746 7.937215 12.54314       11.72736 
1 1 1 8   35 19 f 65.75410 5.193385 58.02005       8.254129 54.05499       10.67321 63.92004       13.01955 60.78427 7.354968 64.42677 8.499804 -3.642498      11.24021 
1 1 1 8   35 20 o 48.99879 6.201285 33.97285       7.239053 27.70561       9.434831 42.94332       11.28765 40.20035 9.735501 50.91744 9.444721 -10.71709      13.56402 
1 1 1 8   35 21 o 16.82858 6.594187 3.363182       3.935622 5.519883       6.862195 2.306069       4.804285 20.49086 8.463163 16.54223 6.974529 3.948629       10.96673 
1 1 1 8   35 22 o 32.94032 6.472664 16.16546       5.010346 24.35372       9.437534 12.95184       5.912351 35.40223 10.31316 27.72440 8.186599 7.677835       13.16745 
1 1 1 8   35 23 o 22.40409 7.551437 8.331808       4.883219 12.01392       8.380671 6.439085       6.008606 24.54471 9.621173 20.24889 8.080066 4.295816       12.56401 
1 1 1 8   35 24 o 14.64962 6.322721 1.584844       4.115829 10.23647       8.103585 -1.422850      4.777988 22.62585 9.254798 13.29083 6.166906 9.335024       11.12124 
1 1 1 8   35 25 o 15.46612 6.446872 2.805337       4.033725 3.947096       7.987417 2.414462       4.673458 18.20637 8.269735 15.57642 6.730134 2.629943       10.66223 
1 1 1 8   35 26 o 13.07554 5.887555 0.3279397      3.945170 6.725083       8.186752 -1.606967      4.502448 19.21117 8.578465 12.49865 5.860758 6.712517       10.38935 
1 1 1 8   35 27 o 13.28145 5.869457 1.082417       3.733870 5.877847       7.644175 -0.4202673     4.279083 18.26086 8.211152 12.78531 5.898364 5.475554       10.11008 
1 1 1 8   35 28 o 11.47964 5.145907 0.1715806      2.976557 1.441527       8.641128 0.6077116E-03  3.170599 16.24961 7.764159 11.60559 5.247005 4.644025       9.370872 
1 1 1 8   36 0  o 44.78837 4.668990 25.25170       5.021204 21.54626       8.125762 27.54062       6.386446 39.87050 8.615168 46.41994 5.769884 -6.549442      10.36883 
1 1 1 8   36 1  o 40.74541 4.123260 20.79589       4.037785 19.63712       5.429724 22.22948       6.039389 39.03689 5.890973 41.48096 6.161488 -2.444069      8.524523 
1 1 1 8   36 2  o 54.41623 3.497202 36.71277       4.612963 31.47969       6.283007 42.83238       6.794394 49.82264 5.253947 58.36020 4.820419 -8.537552      7.130246 
1 1 1 8   36 3  o 11.60040 5.206866 -1.275051      3.058486 -2.776239      4.050629 0.7158875      4.664809 12.52451 5.763843 16.26388 6.865669 -3.739378      8.964334 
1 1 1 8   36 4  o 93.98565 3.463265 109.3056       7.918447 95.80301       13.46332 116.4467       9.790943 86.36017 6.443836 96.68296 4.165418 -10.32279      7.672922 
1 1 1 8   36 5  o 30.41635 5.685806 12.06288       4.059484 27.66540       7.914261 6.492213       4.728971 45.66750 7.361856 22.57535 7.426689 23.09215       10.45718 
1 1 1 8   36 6  o 90.48615 2.736796 100.8428       6.027832 97.48795       9.140407 103.4248       8.018610 88.29684 4.260571 91.27792 3.612065 -2.981079      5.585649 
1 1 1 8   36 7  f 32.58561 4.593647 13.55753       3.546616 17.41550       4.829030 9.039598       5.225775 36.64884 5.583222 25.88011 7.710379 10.76873       9.519575 
1 1 1 8   36 8  o 40.98806 3.604504 21.02158       3.563669 24.51824       5.115162 17.72367       4.967653 43.84142 4.869898 36.87494 5.712834 6.966480       7.506823 
1 1 1 8   36 9  o 54.09943 3.291789 36.41307       4.319171 40.47870       6.037872 32.15225       6.181108 56.59697 4.412637 50.08147 5.137444 6.515503       6.772348 
1 1 1 8   36 10 o 12.21824 5.183128 0.2798882      2.680250 2.529783       3.501684 -2.902962      4.164893 16.26767 6.262659 12.52407 5.792461 3.743605       8.530739 
1 1 1 8   36 11 o 26.90538 5.929406 9.732291       3.782664 12.96372       6.405727 8.002171       4.687152 30.09762 8.410213 24.15433 7.326323 5.943289       11.15377 
1 1 1 8   36 12 o 44.74209 4.789805 25.81452       5.141231 25.46546       8.194054 26.04116       6.602585 42.30494 8.244669 44.07586 6.328458 -1.770924      10.39346 
1 1 1 8   36 13 o 37.81723 5.465344 18.91940       4.890752 20.10416       8.065017 18.23032       6.150746 36.65777 9.076663 36.08820 7.245980 0.5695648      11.61422 
1 1 1 8   36 14 o 29.32319 7.380372 12.34553       5.269120 0.000000       0.000000 12.34553       5.269120 ?        ?        29.32319 7.380372 0.000000       7.380372 
1 1 1 8   36 15 o 27.16283 5.695109 10.11074       3.649090 20.17374       7.508773 6.999275       4.175296 36.47404 8.590558 22.25728 6.944704 14.21676       11.04657 
1 1 1 8   36 16 o 23.59745 6.076456 7.848576       3.515211 6.446780       6.829868 8.353721       4.099940 22.12998 8.682263 24.07069 6.729234 -1.940704      10.98473 
1 1 1 8   36 17 o 22.79248 6.039887 7.399627       3.408111 14.15135       7.111144 5.386368       3.883129 29.36431 9.046881 19.66007 6.732446 9.704231       11.27705 
1 1 1 8   36 18 o 19.49896 6.131825 5.401938       3.248601 10.81448       7.055199 3.945609       3.659641 25.57755 9.054832 17.51426 6.476116 8.063292       11.13239 
1 1 1 8   36 19 o 29.14710 5.082745 11.69572       3.478987 16.36394       7.590314 10.45420       3.914366 30.57508 9.333110 26.84666 6.119735 3.728416       11.16056 
1 1 1 8   36 20 o 17.94250 6.108751 4.570529       3.196102 10.73948       7.612900 3.250573       3.521472 24.58111 9.289108 16.27925 6.276861 8.301855       11.21100 
1 1 1 8   36 21 o 49.92641 4.792966 34.15247       5.759827 25.86140       9.267608 39.37055       7.352218 36.57741 10.07650 52.23500 5.877816 -15.65760      11.66553 
1 1 1 8   36 22 o 14.30937 5.766519 2.195639       3.091978 8.449943       7.728901 1.003960       3.373712 21.69976 8.973937 13.35327 5.743430 8.346486       10.65451 
1 1 1 8   36 23 o 17.63690 6.057359 4.726569       3.144031 9.169219       8.371763 3.997097       3.392345 21.57051 9.155823 16.62478 6.218158 4.945728       11.06773 
1 1 1 8   36 24 o 15.65151 6.049665 3.437339       3.276999 7.341159       8.309326 2.718341       3.566029 19.89709 8.776106 14.97580 6.134062 4.921290       10.70732 
1 1 1 8   36 25 o 14.18935 5.755421 2.457887       3.102622 3.513355       8.188223 2.280944       3.352619 17.55524 8.120276 14.18831 5.892798 3.366931       10.03314 
1 1 1 8   36 26 o 12.15981 5.347261 0.7031056      3.063211 1.890581       8.155478 0.5080647      3.305215 16.50163 7.784296 12.29290 5.472437 4.208726       9.515400 
1 1 1 8   37 0  o 57.73069 3.391161 41.39333       4.749790 37.84225       6.514927 45.42244       6.939600 54.60563 4.949648 59.93363 4.791339 -5.328007      6.888828 
1 1 1 8   37 1  o 56.62231 3.999290 40.13628       5.482813 43.33271       9.366100 38.46989       6.762622 57.44399 6.823993 54.97012 5.106782 2.473869       8.523269 
1 1 1 8   37 2  o 46.73301 4.487961 27.62024       5.048281 36.65043       8.575588 22.83129       6.245044 52.72892 6.834524 41.68963 6.347161 11.03928       9.327228 
1 1 1 8   37 3  o 60.50696 3.487154 45.56903       5.119988 62.09630       10.06649 39.80158       5.946610 69.29897 6.020633 56.19143 4.377243 13.10753       7.443674 
1 1 1 8   37 4  o 19.71917 6.042916 5.059804       3.177993 7.594166       4.446254 2.412714       4.544062 23.78606 7.118210 17.51783 7.014414 6.268229       9.993545 
1 1 1 8   37 5  o 35.88291 4.065320 16.30187       3.492272 21.05276       4.961026 11.63509       4.916907 40.41116 5.154915 29.21311 6.998725 11.19805       8.692256 
1 1 1 8   37 6  o 25.07380 5.373405 8.318654       3.184530 9.363831       4.491753 7.262373       4.515553 26.17107 6.933352 23.24048 7.217518 2.930592       10.00819 
1 1 1 8   37 7  o 18.68785 5.840366 4.541319       2.951725 3.589894       3.968925 5.718853       4.415422 18.06695 6.732180 21.09239 7.180083 -3.025442      9.842552 
1 1 1 8   37 8  o 41.44489 4.149288 21.83554       4.134353 11.92464       6.449091 28.75065       5.386933 28.80687 8.561301 47.32990 4.734031 -18.52303      9.782991 
1 1 1 8   37 9  o 16.12534 5.832877 2.983721       2.944191 2.981901       3.782623 2.986520       4.689435 17.02794 6.520837 18.01838 7.155143 -0.9904366     9.680775 
1 1 1 8   37 10 o 13.65104 5.451110 1.447570       2.736650 2.575110       3.617716 -0.6073727E-01 4.184208 16.29464 6.340321 14.47169 6.309415 1.822952       8.944741 
1 1 1 8   37 11 o 28.53923 6.615889 11.36529       4.511313 0.000000       0.000000 11.36529       4.511313 ?        ?        28.53923 6.615889 0.000000       6.615889 
1 1 1 8   37 12 o 24.36335 7.032436 8.470237       4.406604 0.000000       0.000000 8.470237       4.406604 ?        ?        24.36335 7.032436 0.000000       7.032436 
1 1 1 8   37 13 o 39.22739 4.246553 19.94735       3.994749 30.42320       8.097096 16.57725       4.592575 45.95912 7.487228 34.98461 5.573812 10.97451       9.334129 
1 1 1 8   37 14 o 24.10164 5.973763 8.180405       3.490784 26.48261       7.054065 2.244883       4.017142 43.02005 6.966772 16.06157 6.536321 26.95849       9.552979 
1 1 1 8   37 15 o 18.64647 6.678003 4.649696       3.847986 9.007517       5.858072 1.342358       5.103397 24.17444 8.269378 16.37491 7.053728 7.799536       10.86912 
1 1 1 8   37 16 o 56.94010 4.166621 42.31083       5.741447 36.82493       9.501081 45.46648       7.205982 48.70771 8.302027 58.04749 5.147484 -9.339775      9.768328 
1 1 1 8   37 17 o 40.17967 4.935825 21.87944       4.731417 26.21321       8.211450 19.72549       5.789008 40.20192 8.639239 36.62439 6.734394 3.577522       10.95393 
1 1 1 8   37 18 o 35.70917 5.666279 18.03660       4.766281 37.34441       9.156904 10.86151       5.582079 48.59542 8.011380 25.69817 8.031611 22.89725       11.34412 
1 1 1 8   37 19 o 11.35967 5.224273 -1.429158      3.319963 6.668821       6.476381 -4.315744      3.866664 20.79990 8.358417 10.60827 5.101522 10.19163       9.792275 
1 1 1 8   37 20 o 10.46557 4.864736 -1.730069      2.993852 -4.239439      6.739924 -1.113236      3.341617 14.31693 6.845156 11.54424 5.283905 2.772687       8.647301 
1 1 1 8   37 21 o 14.25847 5.817669 2.138934       3.192327 -5.252925      7.250828 3.916277       3.555465 14.23582 6.880770 16.66617 6.336609 -2.430359      9.354015 
1 1 1 8   37 22 o 12.59384 5.479865 0.7494221      3.143093 6.878337       8.388437 -0.2515848     3.390063 19.90151 8.796161 12.07077 5.444382 7.830743       10.34474 
1 1 1 8   37 23 o 10.71200 4.953653 -1.196998      3.044370 2.116229       8.058264 -1.748624      3.288049 17.11305 7.963645 10.74148 5.027650 6.371568       9.417904 
1 1 1 8   37 24 o 8.742691 4.263196 -4.074569      2.951039 -14.14888      8.089375 -2.528044      3.169465 12.18176 6.122312 9.977921 4.749265 2.203835       7.748433 
1 1 1 8   38 0  o 65.53141 3.588240 53.71695       5.708298 52.18748       7.231673 56.24518       9.297698 64.02017 4.667450 65.67066 5.871778 -1.650490      7.500858 
1 1 1 8   38 1  o 15.83137 5.985947 2.552740       3.162334 1.104699       3.992642 4.990266       5.180176 15.34596 6.406679 20.69401 7.695012 -5.348048      10.01293 
1 1 1 8   38 2  o 31.46556 4.997508 12.90749       3.704024 13.32783       5.018518 12.40452       5.489698 31.20343 6.793031 29.75734 7.557348 1.446091       10.16163 
1 1 1 8   38 3  o 15.87165 6.255667 2.204741       3.559875 -0.2575420     6.053478 3.506423       4.401377 17.07987 7.513716 18.33332 7.030643 -1.253443      10.29009 
1 1 1 8   38 4  o 19.68945 6.559648 5.025800       3.685893 12.80324       6.904433 1.925853       4.358998 29.60348 8.872884 16.59233 6.787371 13.01115       11.17123 
1 1 1 8   38 5  o 20.65401 5.752915 5.746770       3.002476 6.236031       4.148562 5.208609       4.350948 21.53027 6.947407 20.24807 7.115774 1.282206       9.944883 
1 1 1 8   38 6  o 42.07307 3.600787 22.35419       3.656338 19.85809       5.022840 25.16780       5.332749 38.76577 5.468728 43.93398 5.074110 -5.168209      7.460132 
1 1 1 8   38 7  o 43.00279 3.901789 23.53179       4.044345 28.94789       5.642075 17.80756       5.800344 47.12593 4.988609 35.78232 6.902065 11.34361       8.516145 
1 1 1 8   38 8  o 21.64050 6.251406 6.467210       3.480880 8.012755       5.651339 5.522426       4.418517 23.79894 8.122617 20.46614 7.172481 3.332808       10.83611 
1 1 1 8   38 9  o 15.25240 6.072154 2.065681       3.385581 0.7204089      5.038821 3.172818       4.571141 16.14062 6.981106 17.80003 7.065648 -1.659409      9.932734 
1 1 1 8   38 10 o 17.20766 5.804866 3.858230       2.885563 7.880477       3.987309 -0.5647015     4.181196 23.51673 6.658074 13.87040 6.166040 9.646333       9.074690 
1 1 1 8   38 11 o 62.73568 3.516545 49.99713       5.354577 51.52800       9.892103 49.36268       6.368198 60.43598 6.836621 61.75439 4.257739 -1.318413      8.054050 
1 1 1 8   38 12 o 24.25975 6.120918 8.373852       3.617892 18.23748       6.976724 4.745790       4.231267 34.18315 8.429212 19.01156 6.974944 15.17159       10.94082 
1 1 1 8   38 13 o 21.77195 6.357288 6.838313       3.582370 4.579539       6.049800 8.057989       4.445565 19.78904 8.033111 23.25853 7.150796 -3.469488      10.75476 
1 1 1 8   38 14 o 12.44731 5.467900 -0.7137994E-01 3.195236 5.604396       6.257387 -2.073326      3.716264 20.61173 8.238684 11.80932 5.465297 8.802408       9.886626 
1 1 1 8   38 15 o 30.06219 5.237845 12.51413       3.697769 12.48957       7.436537 12.52220       4.262012 26.71043 9.308850 29.43330 6.141004 -2.722872      11.15198 
1 1 1 8   38 16 o 21.71346 6.601036 7.107074       3.802089 14.80250       7.009866 3.899557       4.525617 29.04986 8.987835 17.74074 7.034142 11.30912       11.41317 
1 1 1 8   38 17 o 22.34223 6.700677 7.717597       3.936720 18.09836       7.447078 3.691725       4.637684 31.62149 9.146533 17.40981 7.045718 14.21169       11.54561 
1 1 1 8   38 18 o 14.12149 5.854934 1.774737       3.301657 0.8562890      6.951928 2.042233       3.751775 16.86314 7.681215 14.88801 6.212575 1.975131       9.879128 
1 1 1 8   38 19 o 12.17588 5.431697 -0.8596455E-01 3.273862 14.27102       7.958333 -3.010514      3.591864 26.07076 9.565552 10.68050 5.075734 15.39026       10.82880 
1 1 1 8   38 20 o 13.09098 5.888815 0.5089633E-01  3.936090 0.4115670      7.441475 -0.8920933E-01 4.638008 16.43139 7.648580 13.81972 6.286780 2.611664       9.900726 
1 1 1 8   38 21 o 21.50153 7.023105 7.963569       4.232212 3.401207       7.989910 9.742896       4.989707 17.83157 8.164978 23.11299 7.629846 -5.281420      11.17504 
1 1 1 8   38 22 o 12.75798 5.781361 0.6951696E-02  3.875904 2.162840       8.015126 -0.6510606     4.428067 16.97225 7.912910 12.96820 5.988948 4.004050       9.923792 
1 1 1 8   38 23 o 16.93951 6.664114 4.590498       4.033274 -0.6706631     8.133304 6.306199       4.644586 15.69615 7.508624 18.77101 7.216196 -3.074859      10.41407 
1 1 1 8   39 0  o 32.20984 6.899429 14.50235       5.252387 0.000000       0.000000 14.50235       5.252387 ?        ?        32.20984 6.899429 0.000000       6.899429 
1 1 1 8   39 1  o 32.59965 4.664120 13.87159       3.599797 8.167922       4.708562 21.89494       5.584558 24.03666 7.353550 40.40856 5.840494 -16.37190      9.390743 
1 1 1 8   39 2  o 39.23397 4.152886 19.76452       3.910324 18.11264       5.744951 21.19043       5.337562 36.08682 6.781751 39.81374 5.660737 -3.726917      8.833804 
1 1 1 8   39 3  o 41.92356 4.036094 22.50740       4.072502 21.10948       5.738900 23.92545       5.780096 39.35992 6.187195 42.22207 5.768387 -2.862148      8.459058 
1 1 1 8   39 4  o 33.28614 5.065945 14.69335       3.979782 24.28089       7.337612 10.69740       4.737088 41.13189 7.600389 27.33109 7.062164 13.80080       10.37497 
1 1 1 8   39 5  o 15.16326 6.582839 0.3990151      4.514229 0.000000       0.000000 0.3990151      4.514229 ?        ?        15.16326 6.582839 0.000000       6.582839 
1 1 1 8   39 6  o 17.48511 7.111323 2.769124       4.751592 0.000000       0.000000 2.769124       4.751592 ?        ?        17.48511 7.111323 0.000000       7.111323 
1 1 1 8   39 7  o 36.63044 4.231723 17.45374       3.708050 26.41142       5.405330 9.491163       5.096256 44.57971 5.065347 25.26103 7.634582 19.31868       9.162127 
1 1 1 8   39 8  o 31.79083 4.730712 13.43634       3.553426 19.21790       4.954976 7.314484       5.098712 37.55534 5.583837 22.44258 7.713620 15.11275       9.522561 
1 1 1 8   39 9  o 30.05131 4.455766 11.95141       3.164343 11.02563       4.522978 12.83897       4.428628 27.49582 6.790928 30.10053 6.242494 -2.604710      9.224176 
1 1 1 8   39 10 o 22.80806 5.721918 7.335178       3.174536 10.80904       4.536576 4.001938       4.443807 27.08035 6.866000 18.20087 7.042193 8.879482       9.835367 
1 1 1 8   39 11 o 17.26820 6.396059 3.790569       3.572441 6.279862       6.349624 2.637648       4.321253 21.29607 8.366542 16.58588 6.768117 4.710197       10.76134 
1 1 1 8   39 12 o 28.52516 5.703417 11.49275       3.825945 12.71874       7.316656 11.03136       4.488499 27.14865 9.242699 27.16695 6.797235 -0.1830482E-01 11.47301 
1 1 1 8   39 13 o 23.94625 6.182798 8.425168       3.632716 4.612477       6.822063 9.934129       4.291794 19.79101 8.325790 25.63552 6.770638 -5.844515      10.73128 
1 1 1 8   39 14 o 10.65091 5.030871 -2.867466      3.426790 6.063872       6.196825 -6.801774      4.112871 20.43482 8.188290 9.997758 4.908116 10.43706       9.546606 
1 1 1 8   39 15 o 24.33482 6.823310 9.252648       4.208734 21.69613       7.989114 4.472670       4.951545 34.57875 9.285775 18.30713 7.324978 16.27162       11.82713 
1 1 1 8   39 16 o 15.08163 6.062443 2.536244       3.408200 14.23090       7.663172 -0.3473853     3.805261 26.82680 9.442243 12.85418 5.785538 13.97262       11.07377 
1 1 1 8   39 17 o 13.64217 5.779636 1.407582       3.325364 5.451944       7.327998 0.3587742      3.731713 19.43579 8.412580 13.19953 5.848807 6.236265       10.24598 
1 1 1 8   39 18 o 18.96104 6.523195 5.707816       3.646672 9.184915       7.579478 4.660502       4.159770 21.66494 8.915847 17.62798 6.815338 4.036957       11.22235 
1 1 1 8   39 19 o 17.10951 6.380874 4.448449       3.567003 4.485235       8.750301 4.441117       3.906300 18.69373 8.554085 17.16072 6.612464 1.533009       10.81189 
1 1 1 8   39 20 o 14.13913 5.995996 1.952870       3.584840 22.69399       9.082831 -1.874240      3.901581 30.39760 10.29865 11.60274 5.445438 18.79485       11.64968 
1 1 1 8   39 21 o 16.57823 6.269967 4.261213       3.470067 7.453935       8.042093 3.530795       3.846575 19.48698 8.612815 15.82508 6.412232 3.661895       10.73766 
1 1 1 8   40 0  o 44.49747 5.224510 26.42683       5.557431 23.03401       8.290492 29.19552       7.489234 38.35781 9.021569 45.32431 7.006372 -6.966507      11.42270 
1 1 1 8   40 1  o 64.96574 4.580633 55.04128       7.205314 47.49083       10.71233 61.27949       9.737056 56.78914 7.958937 67.00227 6.027883 -10.21313      9.983989 
1 1 1 8   40 2  o 29.77219 6.039294 12.37418       4.231584 10.07866       6.928493 13.73987       5.344105 25.50980 8.978260 30.58189 7.276894 -5.072088      11.55692 
1 1 1 8   40 3  o 37.23280 4.235065 18.07001       3.774360 26.67716       5.436887 10.06322       5.243848 44.72242 5.078541 25.83722 7.729944 18.88520       9.248979 
1 1 1 8   40 4  o 9.573848 4.553925 -3.171966      2.904396 -1.373919      4.210399 -4.804291      4.011676 13.22664 6.006374 10.88106 5.223248 2.345584       7.959827 
1 1 1 8   40 5  o 24.00519 5.610547 8.044458       3.222797 8.766748       4.580677 7.336466       4.535112 24.28837 7.214546 22.36754 7.267620 1.920832       10.24051 
1 1 1 8   40 6  f 33.05777 4.497540 14.47859       3.529261 14.99303       5.219526 14.04528       4.790308 32.03248 6.891183 31.26324 6.499960 0.7692394      9.473008 
1 1 1 8   40 7  o 48.41911 4.441383 30.86908       5.182158 42.90983       9.481734 25.74047       6.188151 53.85069 7.422596 42.82625 6.101848 11.02444       9.608719 
1 1 1 8   40 8  o 37.49064 4.436748 18.63575       3.974976 27.86368       7.859638 15.46423       4.607692 42.67782 7.846305 33.10122 5.929998 9.576607       9.835110 
1 1 1 8   40 9  o 35.07341 4.240303 16.26983       3.550706 20.36477       5.574431 13.47416       4.605956 37.65622 6.296907 30.39738 6.419599 7.258844       8.992346 
1 1 1 8   40 10 o 18.86014 6.392128 5.090814       3.499080 12.66889       6.973660 2.541024       4.045138 27.00599 9.023329 16.03407 6.546281 10.97192       11.14784 
1 1 1 8   40 11 o 24.18064 6.876823 9.006738       4.244024 19.25753       8.011352 5.007722       5.003842 32.58449 9.504775 19.08300 7.447720 13.50149       12.07515 
1 1 1 8   40 12 o 19.82306 6.920078 5.941105       4.110569 -0.7702777     7.250029 9.120613       4.990151 16.55308 7.651146 23.64493 7.618670 -7.091856      10.79741 
1 1 1 8   40 13 o 18.21706 6.388681 4.871620       3.505976 7.963078       6.407549 3.550568       4.188611 21.75037 8.445045 16.87255 6.741753 4.877821       10.80602 
1 1 1 8   40 14 o 13.96005 6.130616 0.7564082      4.014010 -0.6957809     5.840483 2.056376       5.525906 14.99599 6.908425 16.41410 7.201181 -1.418104      9.979145 
1 1 1 8   40 15 o 25.18553 6.082386 9.725101       3.690580 11.23880       7.232808 9.192261       4.291257 23.77728 9.038382 23.65159 6.972081 0.1256866      11.41500 
1 1 1 8   40 16 o 21.00385 6.370566 7.039632       3.544028 8.618521       7.292308 6.551395       4.055130 21.30450 8.754055 19.98383 6.878683 1.320669       11.13327 
1 1 1 8   40 17 f 16.75776 6.404973 4.138924       3.644737 3.000836       7.715083 4.465892       4.135284 17.67595 8.066974 17.27059 6.761748 0.4053555      10.52603 
1 1 1 8   40 18 o 12.98190 5.629977 1.042268       3.294909 -0.8487757     6.925941 1.595454       3.745964 15.23305 7.182103 13.98850 6.034630 1.244553       9.380797 
1 1 1 8   41 0  o 17.98071 6.214903 4.376415       3.311508 4.158193       4.623042 4.606374       4.745728 18.44502 7.170066 18.99995 7.296877 -0.5549221     10.23007 
1 1 1 8   41 1  o 17.66784 6.207348 4.175085       3.310792 8.447189       5.264604 1.380170       4.258230 23.47204 7.840009 15.34907 6.523035 8.122970       10.19881 
1 1 1 8   41 2  o 38.41130 4.392152 19.49837       4.037410 18.36237       5.438410 20.89322       6.026254 35.71768 6.487026 37.89385 6.774616 -2.176170      9.379601 
1 1 1 8   41 3  o 21.51950 6.032553 6.669405       3.290147 15.35055       5.203986 0.8886644      4.246580 32.26353 6.831949 14.85592 6.417104 17.40761       9.373087 
1 1 1 8   41 4  o 36.23340 4.352317 17.40102       3.766122 23.23460       5.729308 12.96241       4.997566 40.60331 5.968308 29.31807 7.076362 11.28524       9.257192 
1 1 1 8   41 5  o 10.56123 4.847013 -1.423019      2.837465 -4.979927      3.998152 2.186430       4.027574 10.64413 5.136047 15.70840 6.485393 -5.064262      8.272804 
1 1 1 8   41 6  o 18.56813 5.947579 4.921578       3.044294 5.636037       4.290492 4.197181       4.320227 19.70363 7.052124 18.01148 6.950366 1.692142       9.901518 
1 1 1 8   41 7  o 15.03847 5.805340 2.604058       3.014856 -1.928431      3.944195 8.974153       4.675876 12.16254 5.629338 23.87742 7.332337 -11.71488      9.244058 
1 1 1 8   41 8  o 19.84527 6.427845 5.864124       3.549195 5.035711       4.461871 7.291374       5.856572 18.84669 7.113808 21.47748 8.140354 -2.630791      10.81072 
1 1 1 8   41 9  f 27.35710 5.328429 10.63402       3.424489 13.67755       4.847625 7.602184       4.838306 29.82342 6.818986 21.77705 7.512891 8.046370       10.14604 
1 1 1 8   41 10 o 23.83039 6.275593 8.638730       3.694036 15.15610       7.231986 6.338026       4.296866 28.41236 9.173225 20.16887 7.072698 8.243492       11.58323 
1 1 1 8   41 11 o 11.40717 5.358965 -2.444822      3.794914 0.5792091      6.844773 -3.786912      4.559915 16.57314 7.576861 11.86556 5.661353 4.707581       9.458316 
1 1 1 8   41 12 o 23.16645 6.586013 8.521201       3.893370 15.89962       8.580196 6.608068       4.369062 27.05827 9.931523 20.19872 7.127861 6.859547       12.22463 
1 1 1 8   41 13 o 19.85686 6.753342 6.338930       3.906048 15.94903       8.311690 3.614954       4.425139 26.99359 9.795324 16.73135 6.840801 10.26225       11.94759 
1 1 1 8   41 14 o 19.89041 6.578879 6.384550       3.709201 12.77139       8.111492 4.695955       4.170808 24.16257 9.467173 17.65735 6.824999 6.505213       11.67082 
1 1 1 8   41 15 o 14.86953 6.118590 2.550169       3.569030 15.46029       8.171233 -0.4934275     3.967491 25.94336 9.661139 12.67640 5.785145 13.26696       11.26079 
1 1 1 8   41 16 o 9.301208 4.516018 -4.094325      3.215115 -0.3791628     6.835045 -5.149921      3.643353 15.40658 7.223273 9.575633 4.683900 5.830947       8.608984 
1 1 1 8   42 0  o 20.03530 6.150392 5.890981       3.290257 2.354609       4.681800 9.342025       4.624973 16.38877 6.896028 24.41566 7.248596 -8.026890      10.00487 
1 1 1 8   42 1  o 14.05652 5.628787 1.933260       2.926292 3.212628       4.205281 0.7321616      4.074616 16.77326 6.737021 14.30133 6.230829 2.471925       9.176638 
1 1 1 8   42 2  o 48.78841 3.458926 30.75394       4.085723 43.28189       6.651936 23.16440       5.177450 56.38320 4.889592 40.75657 5.341355 15.62663       7.241422 
1 1 1 8   42 3  o 10.06013 4.692030 -1.942834      2.822299 -4.845564      4.092687 0.6891602      3.897155 10.77421 5.198215 13.98252 6.092755 -3.208307      8.008939 
1 1 1 8   42 4  o 29.07826 7.354181 13.44771       5.213809 13.75599       6.984416 13.05970       7.835665 27.53176 9.023935 26.24260 9.512413 1.289162       13.11173 
1 1 1 8   42 5  o 24.28062 7.768403 9.817178       5.194731 10.53577       6.871593 8.858808       7.935684 24.18179 8.885813 22.57629 9.187101 1.605499       12.78126 
1 1 1 8   42 6  o 25.23731 6.057134 9.539161       3.677702 14.03202       4.981828 4.158171       5.452031 29.91337 6.964788 18.16139 7.526290 11.75199       10.25443 
1 1 1 8   42 7  o 12.04078 5.251522 0.3243941      2.901010 5.348905       4.389822 -3.571214      3.865339 18.85415 7.069085 10.90974 5.207259 7.944412       8.779949 
1 1 1 8   42 8  o 16.99590 6.004790 4.165197       3.101466 0.6553035      4.527769 7.267866       4.257013 14.46303 6.423741 21.19349 7.049258 -6.730462      9.537111 
1 1 1 8   42 9  o 13.26830 5.624408 1.239106       3.152120 2.089482       4.476789 0.4030275      4.438993 15.48048 6.636517 14.11835 6.309696 1.362137       9.157271 
1 1 1 8   42 10 o 15.36471 6.426429 2.464500       4.028431 6.093474       7.974625 1.221173       4.667788 19.88758 8.689754 14.89561 6.573572 4.991969       10.89604 
1 1 1 8   42 11 o 17.37837 6.394123 4.530876       3.560039 8.674455       8.478282 3.643906       3.922605 21.27695 9.127421 16.42726 6.537285 4.849688       11.22702 
1 1 1 8   42 12 o 21.57411 6.649224 7.645764       3.840924 12.34365       8.066113 6.268162       4.367923 23.68211 9.390530 19.42820 7.093254 4.253906       11.76845 
1 1 1 8   42 13 o 12.63469 5.649866 0.1720409      3.564567 1.305211       6.804850 -0.2564792     4.184626 16.30823 7.492523 13.10382 5.965189 3.204414       9.577127 
1 1 1 8   43 0  o 10.33876 4.880156 -2.569917      3.214601 -3.513804      4.268198 -1.332731      4.886548 11.59721 5.517545 13.65679 6.301389 -2.059583      8.375608 
1 1 1 8   43 1  o 8.805338 4.331858 -5.711322      3.258511 -11.77839      4.507864 0.9278374      4.715612 9.009201 4.533469 14.93022 6.597192 -5.921022      8.004704 
1 1 1 8   43 2  f 15.51044 6.207134 2.818775       3.556255 -1.112915      4.963913 6.964684       5.097350 13.83893 6.373052 20.65689 7.642174 -6.817954      9.950810 
1 1 1 8   43 3  f 10.61831 4.896037 -1.368579      2.942726 -4.221445      4.760295 0.3959503      3.743757 11.93207 5.717722 13.31752 5.881677 -1.385451      8.202833 
1 1 1 8   43 4  o 28.79005 5.028180 11.75775       3.399378 16.21903       5.288441 8.616515       4.437603 31.94302 6.988608 22.86632 7.163235 9.076702       10.00763 
1 1 1 8   43 5  o 24.41096 5.747190 8.915339       3.361797 12.00798       5.083242 6.511096       4.481928 26.66995 7.506135 20.04993 7.203931 6.620018       10.40378 
1 1 1 8   43 6  o 11.98464 5.429805 -0.5745876     3.416756 -3.934098      4.456936 4.214102       5.321166 11.55401 5.535488 17.76774 7.405284 -6.213730      9.245532 
1 1 1 8   43 7  o 12.26610 5.469256 0.5092147E-02  3.315052 1.642661       4.381757 -2.186831      5.069453 14.91036 6.479183 13.18699 6.194712 1.723366       8.964054 
1 1 1 8   43 8  o 13.17309 5.541067 1.402804       3.021134 0.5564582      4.541791 2.074491       4.046100 14.19318 6.359840 14.92309 6.350836 -0.7299099     8.987808 
1 1 1 8   43 9  o 11.44333 5.322481 -1.598491      3.592311 -6.018104      6.369726 0.4628193      4.350110 12.96467 6.308828 13.87523 6.220254 -0.9105558     8.859621 
1 1 1 8   44 0  f 20.37322 6.180641 6.462463       3.335612 9.040100       5.263747 4.732769       4.311901 22.62453 7.834774 17.87863 6.931597 4.745903       10.46091 
1 1 1 8   44 1  o 15.29962 5.959639 3.000502       3.199082 6.639179       5.203737 0.7898048      4.056097 19.96759 7.647862 13.90362 6.132102 6.063970       9.802676 
1 1 1 8   44 2  o 13.59977 5.658559 1.668876       3.099350 4.509346       4.851794 -0.2893271     4.028432 17.76960 7.201008 13.03580 5.901962 4.733802       9.310621 
1 1 1 8   44 3  o 27.24933 5.610253 11.04340       3.601228 19.38768       5.664088 5.381528       4.665689 34.79802 6.923086 18.57501 7.207939 16.22301       9.994173 
1 1 1 9   0  0  o 558.9143 9.355945 3812.647       127.3487 3812.647       127.3487 3812.647       127.3487 558.9143 9.355945 558.9143 9.355945 0.000000       0.000000 
1 1 1 9   0  1  o 596.3469 9.957316 4340.763       144.6120 4340.763       144.6120 4340.763       144.6120 596.3469 9.957316 596.3469 9.957316 0.000000       0.000000 
1 1 1 9   0  2  o 547.2949 9.179822 3655.449       122.3534 3655.449       122.3534 3655.449       122.3534 547.2949 9.179822 547.2949 9.179822 0.000000       0.000000 
1 1 1 9   0  3  o 52.80579 3.095218 34.32744       3.951384 34.32744       3.951384 34.32744       3.951384 52.80579 3.095218 52.80579 3.095218 0.000000       0.000000 
1 1 1 9   0  4  o 7.839192 4.972011 0.2346077      2.057520 0.2346077      2.057520 0.2346077      2.057520 7.839192 4.972011 7.839192 4.972011 0.000000       0.000000 
1 1 1 9   0  5  o 60.21498 3.528755 44.63678       5.136935 44.63678       5.136935 44.63678       5.136935 60.21498 3.528755 60.21498 3.528755 0.000000       0.000000 
1 1 1 9   0  6  o 329.0052 10.04746 1323.630       80.38526 1323.630       80.38526 1323.630       80.38526 329.0052 10.04746 329.0052 10.04746 0.000000       0.000000 
1 1 1 9   0  7  f 279.2782 6.212512 952.0451       42.23329 952.0451       42.23329 952.0451       42.23329 279.2782 6.212512 279.2782 6.212512 0.000000       0.000000 
1 1 1 9   0  8  o 648.6705 10.81525 5136.155       170.8538 5136.155       170.8538 5136.155       170.8538 648.6705 10.81525 648.6705 10.81525 0.000000       0.000000 
1 1 1 9   0  9  o 213.9188 5.134498 558.6683       26.73115 558.6683       26.73115 558.6683       26.73115 213.9188 5.134498 213.9188 5.134498 0.000000       0.000000 
1 1 1 9   0  10 o 355.5795 7.639119 1543.541       66.12465 1543.541       66.12465 1543.541       66.12465 355.5795 7.639119 355.5795 7.639119 0.000000       0.000000 
1 1 1 9   0  11 o 18.48751 8.564955 6.081087       4.263020 6.081087       4.263020 6.081087       4.263020 18.48751 8.564955 18.48751 8.564955 0.000000       0.000000 
1 1 1 9   0  12 o 250.9134 5.799655 768.6220       35.41913 768.6220       35.41913 768.6220       35.41913 250.9134 5.799655 250.9134 5.799655 0.000000       0.000000 
1 1 1 9   0  13 o 601.0042 12.36779 4415.256       180.9632 4415.256       180.9632 4415.256       180.9632 601.0042 12.36779 601.0042 12.36779 0.000000       0.000000 
1 1 1 9   0  14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 9   0  15 o 197.4510 7.082715 477.2871       33.98006 477.2871       33.98006 477.2871       33.98006 197.4510 7.082715 197.4510 7.082715 0.000000       0.000000 
1 1 1 9   0  16 o 141.2163 4.328312 243.7673       14.86326 243.7673       14.86326 243.7673       14.86326 141.2163 4.328312 141.2163 4.328312 0.000000       0.000000 
1 1 1 9   0  17 o 119.4206 4.178362 174.4865       12.12586 174.4865       12.12586 174.4865       12.12586 119.4206 4.178362 119.4206 4.178362 0.000000       0.000000 
1 1 1 9   0  18 o 70.26424 4.434553 60.91083       7.522944 60.91083       7.522944 60.91083       7.522944 70.26424 4.434553 70.26424 4.434553 0.000000       0.000000 
1 1 1 9   0  19 o 351.7442 7.691134 1513.405       65.85435 1513.405       65.85435 1513.405       65.85435 351.7442 7.691134 351.7442 7.691134 0.000000       0.000000 
1 1 1 9   0  20 o 21.50367 9.614386 8.169418       5.357718 8.169418       5.357718 8.169418       5.357718 21.50367 9.614386 21.50367 9.614386 0.000000       0.000000 
1 1 1 9   0  21 o 175.0596 4.840075 374.7869       20.61213 374.7869       20.61213 374.7869       20.61213 175.0596 4.840075 175.0596 4.840075 0.000000       0.000000 
1 1 1 9   0  22 o 33.59959 8.201718 16.02739       5.817227 16.02739       5.817227 16.02739       5.817227 33.59959 8.201718 33.59959 8.201718 0.000000       0.000000 
1 1 1 9   0  23 o 160.6437 4.704017 315.7839       18.37912 315.7839       18.37912 315.7839       18.37912 160.6437 4.704017 160.6437 4.704017 0.000000       0.000000 
1 1 1 9   0  24 o 51.66682 8.133460 35.01456       9.482813 35.01456       9.482813 35.01456       9.482813 51.66682 8.133460 51.66682 8.133460 0.000000       0.000000 
1 1 1 9   0  25 o 14.57597 8.558753 3.027050       5.130524 3.027050       5.130524 3.027050       5.130524 14.57597 8.558753 14.57597 8.558753 0.000000       0.000000 
1 1 1 9   0  26 o 33.02663 8.625755 15.80729       5.998131 15.80729       5.998131 15.80729       5.998131 33.02663 8.625755 33.02663 8.625755 0.000000       0.000000 
1 1 1 9   0  27 o 84.68013 4.662598 88.40388       9.554412 88.40388       9.554412 88.40388       9.554412 84.68013 4.662598 84.68013 4.662598 0.000000       0.000000 
1 1 1 9   0  28 o 153.1377 4.785758 287.5193       17.81996 287.5193       17.81996 287.5193       17.81996 153.1377 4.785758 153.1377 4.785758 0.000000       0.000000 
1 1 1 9   0  29 o 26.33436 12.49601 12.67089       9.115590 12.67089       9.115590 12.67089       9.115590 26.33436 12.49601 26.33436 12.49601 0.000000       0.000000 
1 1 1 9   0  30 o 23.58766 10.34572 9.878774       6.206855 9.878774       6.206855 9.878774       6.206855 23.58766 10.34572 23.58766 10.34572 0.000000       0.000000 
1 1 1 9   0  31 o 202.0168 5.450566 501.5605       26.78860 501.5605       26.78860 501.5605       26.78860 202.0168 5.450566 202.0168 5.450566 0.000000       0.000000 
1 1 1 9   0  32 o 18.60404 10.02149 6.191210       6.293498 6.191210       6.293498 6.191210       6.293498 18.60404 10.02149 18.60404 10.02149 0.000000       0.000000 
1 1 1 9   0  33 o 46.49531 6.944373 28.39516       7.351672 28.39516       7.351672 28.39516       7.351672 46.49531 6.944373 46.49531 6.944373 0.000000       0.000000 
1 1 1 9   0  34 o 41.11297 7.918067 23.15329       7.083873 23.15329       7.083873 23.15329       7.083873 41.11297 7.918067 41.11297 7.918067 0.000000       0.000000 
1 1 1 9   0  35 o 28.20051 10.56737 13.53792       6.775415 13.53792       6.775415 13.53792       6.775415 28.20051 10.56737 28.20051 10.56737 0.000000       0.000000 
1 1 1 9   0  36 o 18.27877 10.89569 5.300008       8.542228 5.300008       8.542228 5.300008       8.542228 18.27877 10.89569 18.27877 10.89569 0.000000       0.000000 
1 1 1 9   0  37 o 14.56743 8.906713 2.813343       6.013947 2.813343       6.013947 2.813343       6.013947 14.56743 8.906713 14.56743 8.906713 0.000000       0.000000 
1 1 1 9   0  38 o 9.616924 6.699329 -4.567426      5.641631 -4.567426      5.641631 -4.567426      5.641631 9.616924 6.699329 9.616924 6.699329 0.000000       0.000000 
1 1 1 9   0  39 o 22.31202 10.56851 10.23100       6.517590 10.23100       6.517590 10.23100       6.517590 22.31202 10.56851 22.31202 10.56851 0.000000       0.000000 
1 1 1 9   0  40 o 18.72487 11.09847 7.842163       8.770644 7.842163       8.770644 7.842163       8.770644 18.72487 11.09847 18.72487 11.09847 0.000000       0.000000 
1 1 1 9   0  41 o 41.82173 7.101324 25.43864       6.611074 25.43864       6.611074 25.43864       6.611074 41.82173 7.101324 41.82173 7.101324 0.000000       0.000000 
1 1 1 9   0  42 o 26.28456 12.77602 18.62668       9.596070 18.62668       9.596070 18.62668       9.596070 26.28456 12.77602 26.28456 12.77602 0.000000       0.000000 
1 1 1 9   0  43 o 10.81846 7.181963 0.6358770      5.027959 0.6358770      5.027959 0.6358770      5.027959 10.81846 7.181963 10.81846 7.181963 0.000000       0.000000 
1 1 1 9   0  44 o 28.66955 9.152607 15.85260       5.632634 15.85260       5.632634 15.85260       5.632634 28.66955 9.152607 28.66955 9.152607 0.000000       0.000000 
1 1 1 9   0  45 o 12.21394 7.753292 3.609524       5.015613 3.609524       5.015613 3.609524       5.015613 12.21394 7.753292 12.21394 7.753292 0.000000       0.000000 
1 1 1 9   0  46 o 7.332079 5.325944 -7.397455      5.307563 -7.397455      5.307563 -7.397455      5.307563 7.332079 5.325944 7.332079 5.325944 0.000000       0.000000 
1 1 1 9   1  0  o 612.1414 7.896390 4571.161       117.7922 4605.203       187.0630 4548.795       151.6291 613.8662 12.50484 610.4000 10.19370 3.466187       16.13327 
1 1 1 9   1  1  o 155.5857 2.362501 294.9782       8.957312 288.2149       12.49870 302.1197       12.84344 153.7838 3.335170 157.4496 3.347370 -3.665771      4.725277 
1 1 1 9   1  2  o 544.8564 6.454443 3619.851       85.69925 3676.026       122.4627 3565.940       119.9698 548.8630 9.155959 540.5864 9.106904 8.276550       12.91384 
1 1 1 9   1  3  o 504.5065 6.007259 3103.164       73.85489 3011.685       102.2830 3202.814       106.7536 496.8666 8.447485 512.3828 8.549718 -15.51611      12.01905 
1 1 1 9   1  4  o 450.2989 5.408461 2471.805       59.34863 2572.152       86.02050 2380.646       81.98792 459.2370 7.686505 441.8144 7.615069 17.42261       10.81996 
1 1 1 9   1  5  o 391.9318 5.846145 1872.672       55.83624 1819.657       77.32234 1930.442       80.71564 386.2425 8.215024 397.8207 8.325958 -11.57816      11.69650 
1 1 1 9   1  6  f 249.3147 3.584863 757.5127       21.77994 762.6918       28.15361 749.7932       34.37160 250.1489 4.618484 248.0031 5.687307 2.145782       7.326381 
1 1 1 9   1  7  o 503.0661 7.351463 3086.257       90.12286 3125.624       104.9209 2975.476       176.0067 506.1902 8.505739 493.1042 14.66348 13.08600       16.95185 
1 1 1 9   1  8  o 364.1041 4.482499 1615.856       39.77240 1607.280       56.00066 1624.585       56.49595 363.0761 6.329354 365.0246 6.351249 -1.948456      8.966554 
1 1 1 9   1  9  o 493.0273 7.222765 2964.477       86.77818 2921.495       121.5142 3009.212       123.9684 489.2168 10.19271 496.5020 10.24599 -7.285187      14.45239 
1 1 1 9   1  10 o 159.2992 3.056795 309.2503       11.86632 313.5198       16.86589 305.0653       16.69839 160.3228 4.320899 158.1441 4.337062 2.178680       6.122114 
1 1 1 9   1  11 f 445.4976 6.591973 2420.373       71.56438 2419.600       101.2000 2421.145       101.2146 445.2287 9.327416 445.3710 9.325780 -0.1422729     13.18980 
1 1 1 9   1  12 o 509.2474 7.463943 3163.814       92.62608 3232.019       132.8534 3099.301       129.2087 514.3783 10.59873 503.7152 10.52618 10.66309       14.93766 
1 1 1 9   1  13 o 277.0821 5.099846 936.0785       34.43512 961.2798       42.93928 890.6636       57.64239 280.7390 6.276477 269.9592 8.773745 10.77979       10.78762 
1 1 1 9   1  14 o 395.8799 5.953784 1911.574       57.43712 1854.044       79.58851 1974.103       82.97392 389.6757 8.381292 402.0857 8.468119 -12.41000      11.91449 
1 1 1 9   1  15 o 250.9026 4.129824 767.5060       25.25066 771.5703       35.73132 763.4515       35.68837 251.4897 5.830325 250.1618 5.854228 1.327896       8.262244 
1 1 1 9   1  16 o 69.77118 3.605668 59.50667       6.109732 75.96687       10.98729 52.13855       7.351083 78.69176 5.769719 65.21788 4.656018 13.47388       7.414052 
1 1 1 9   1  17 o 49.71538 4.196861 30.35887       5.037091 30.72034       9.158151 30.20209       6.031312 49.52706 7.849478 49.49351 5.072343 0.3355026E-01  9.345746 
1 1 1 9   1  18 o 310.7580 4.890085 1178.587       37.03181 1159.413       51.82772 1198.588       52.93148 307.9694 6.905872 313.1245 6.936829 -5.155121      9.788292 
1 1 1 9   1  19 o 43.80145 3.861990 23.58726       4.080086 22.93410       5.723250 24.26226       5.818146 42.96862 5.598848 44.22690 5.518076 -1.258286      7.861060 
1 1 1 9   1  20 o 47.54154 3.811914 27.75686       4.379261 32.87984       6.267045 22.86839       6.121923 51.63570 5.044823 42.82699 6.032853 8.808708       7.864194 
1 1 1 9   1  21 o 218.4856 3.836694 582.6779       20.42754 579.7272       28.77983 585.6737       28.99924 217.7375 5.423990 218.8495 5.437572 -1.111938      7.680290 
1 1 1 9   1  22 o 135.0575 3.585161 222.8032       11.78906 211.9706       19.67157 228.8742       14.72660 131.4095 6.160084 136.7987 4.423395 -5.389191      7.583736 
1 1 1 9   1  23 o 121.5171 3.549271 180.4265       10.49898 211.1430       18.96962 166.8624       12.60573 131.1451 5.951186 116.7617 4.438361 14.38340       7.423993 
1 1 1 9   1  24 o 160.8332 3.328457 315.8010       13.04532 317.2189       18.42970 314.3772       18.46809 160.9680 4.703362 160.2397 4.734698 0.7283173      6.673753 
1 1 1 9   1  25 o 69.63618 3.793649 59.43052       6.413348 60.89741       7.831208 56.44316       11.17564 70.39920 4.589859 67.39664 6.901906 3.002563       8.288734 
1 1 1 9   1  26 o 53.99330 3.838434 35.81868       5.017517 32.41871       6.956975 39.50434       7.243367 51.08538 5.684571 56.51250 5.322358 -5.427116      7.787287 
1 1 1 9   1  27 o 266.1961 4.463419 867.8160       28.95379 882.7796       41.28960 853.3393       40.61249 267.7936 6.327096 263.2892 6.329808 4.504395       8.949783 
1 1 1 9   1  28 o 107.4859 3.699891 141.4941       9.676728 137.3493       11.69439 150.4951       17.23328 105.7590 4.548211 110.2940 6.439811 -4.535019      7.883996 
1 1 1 9   1  29 f 13.38483 5.932860 -1.292754      3.842845 -2.712053      5.406416 0.1565348      5.463236 15.25352 6.878081 17.37458 7.386377 -2.121066      10.09290 
1 1 1 9   1  30 o 46.97098 5.269997 27.49232       5.928296 16.92135       9.649564 33.90111       7.513429 36.08864 10.40342 52.05862 6.034190 -15.96998      12.02674 
1 1 1 9   1  31 o 24.88216 7.253605 7.874143       4.667101 2.227338       6.516256 13.82188       6.687637 20.43097 8.320940 32.57486 8.377727 -12.14389      11.80781 
1 1 1 9   1  32 o 206.3427 3.895118 522.8492       19.58600 544.9849       28.34456 502.6219       27.09524 209.7568 5.550083 201.4489 5.524619 8.307892       7.831017 
1 1 1 9   1  33 o 49.54613 4.519866 30.53886       5.397191 35.15890       7.528869 25.65466       7.741117 52.81612 5.953205 44.59197 7.381830 8.224152       9.483252 
1 1 1 9   1  34 o 66.56450 3.787144 54.77632       6.117795 58.86598       8.725203 50.82131       8.580355 68.56382 5.262313 63.56498 5.596335 4.998840       7.681856 
1 1 1 9   1  35 o 62.90665 4.446237 49.43566       6.772017 50.51746       11.48178 48.85859       8.385930 62.09062 7.757107 62.09233 5.602332 -0.1708984E-02 9.568638 
1 1 1 9   1  36 o 85.52382 3.547071 90.79321       7.376482 99.08486       10.46530 82.60651       10.39886 88.64259 4.863404 80.64500 5.321156 7.997597       7.208842 
1 1 1 9   1  37 o 39.55877 7.228411 21.31975       6.711524 29.99440       10.05744 14.35551       9.011519 45.61129 9.362477 31.25627 10.25045 14.35502       13.88264 
1 1 1 9   1  38 o 40.30568 4.920030 21.16977       4.732439 30.94322       6.800210 11.99095       6.590095 48.18136 5.915724 28.48426 8.696764 19.69710       10.51806 
1 1 1 9   1  39 o 33.95937 5.878932 15.84734       4.689034 21.21906       6.840755 11.08661       6.439968 38.03235 7.646387 26.79235 8.656885 11.24000       11.55028 
1 1 1 9   1  40 o 31.21822 7.266750 14.79543       5.424299 17.99025       6.528203 7.671115       9.748600 33.76724 8.047944 23.13047 9.851254 10.63677       12.72071 
1 1 1 9   1  41 o 15.21825 6.606114 1.457147       4.545363 -11.25414      7.650660 8.391493       5.650760 13.11749 6.487712 22.25104 8.076263 -9.133548      10.35936 
1 1 1 9   1  42 o 11.17402 5.259539 -2.240362      3.686448 -6.562027      5.265403 1.914771       5.162957 11.47293 5.615940 15.62706 6.904158 -4.154136      8.899785 
1 1 1 9   1  43 o 19.80099 7.241934 7.223232       4.555902 8.105638       5.396202 5.033111       8.501354 20.29820 7.784604 18.05217 8.323021 2.246037       11.39617 
1 1 1 9   1  44 o 12.51972 5.532324 1.120007       3.316527 3.531624       4.767737 -1.141013      4.616473 15.40383 6.725065 12.33121 5.828954 3.072627       8.899618 
1 1 1 9   1  45 o 26.28576 6.674585 13.22918       4.282609 10.97809       6.634567 14.83713       5.607265 19.34088 8.177406 24.73886 8.084116 -5.397978      11.49882 
1 1 1 9   1  46 o 14.25719 6.007656 3.772489       3.561304 -0.1836296E-01 4.924881 7.927409       5.155949 12.24396 5.853296 17.28185 7.252139 -5.037887      9.319581 
1 1 1 9   2  0  o 400.5567 5.309448 1955.969       51.82621 1934.440       81.28103 1970.718       67.27592 398.1906 8.376490 401.9930 6.867600 -3.802399      10.83187 
1 1 1 9   2  1  o 759.8425 9.738756 7046.865       180.3280 7081.908       286.0398 7023.751       232.3077 760.7487 15.42941 758.1635 12.57375 2.585144       19.90391 
1 1 1 9   2  2  o 438.4843 5.780398 2344.045       61.76577 2334.480       97.37759 2350.484       79.89425 437.3987 9.135775 439.0009 7.468168 -1.602142      11.79983 
1 1 1 9   2  3  o 186.9837 3.797806 426.1060       17.30504 408.7677       29.86345 434.8713       21.23339 182.9709 6.709000 188.8864 4.612991 -5.915466      8.141891 
1 1 1 9   2  4  o 466.1354 6.118006 2649.061       69.49573 2649.722       109.8193 2648.619       89.75301 465.9834 9.671013 466.0027 7.903591 -0.1931763E-01 12.48981 
1 1 1 9   2  5  o 301.9251 4.672716 1111.100       34.37991 1104.710       48.22460 1117.704       49.02638 301.0053 6.574434 302.7682 6.644825 -1.762878      9.347560 
1 1 1 9   2  6  o 448.2130 5.903892 2449.140       64.48503 2426.162       101.3029 2464.794       83.61324 445.9225 9.322369 449.5602 7.632224 -3.637665      12.04813 
1 1 1 9   2  7  o 336.8278 4.586037 1382.830       37.64277 1368.756       59.14103 1392.415       48.80534 335.0245 7.243962 337.9548 5.926150 -2.930267      9.359179 
1 1 1 9   2  8  o 231.3994 5.387144 652.7426       30.37784 652.7426       30.37784 0.000000       0.000000 231.3994 5.387144 ?        ?        0.000000       5.387144 
1 1 1 9   2  9  o 470.6983 7.998807 2702.626       91.74955 2709.468       112.4284 2688.985       158.7496 471.1600 9.792000 468.7647 13.91241 2.395233       17.01289 
1 1 1 9   2  10 o 527.7856 10.90072 3401.774       140.2003 3401.774       140.2003 0.000000       0.000000 527.7856 10.90072 ?        ?        0.000000       10.90072 
1 1 1 9   2  11 o 588.8784 9.867319 4233.791       141.5992 4336.396       176.3347 4047.506       237.5986 595.6633 12.14789 574.3995 16.99306 21.26385       20.88863 
1 1 1 9   2  12 o 362.1577 5.497803 1599.199       48.52025 1575.579       67.89819 1623.848       69.36119 359.3502 7.753614 364.8100 7.802140 -5.459747      10.99963 
1 1 1 9   2  13 o 105.9322 2.799616 136.8528       7.220741 131.9234       10.01767 142.1835       10.41740 103.9572 3.961607 107.9294 3.967555 -3.972206      5.606766 
1 1 1 9   2  14 o 296.7418 4.673584 1073.621       33.79597 1059.148       47.27833 1088.744       48.32841 294.6389 6.584699 298.7239 6.638906 -4.084991      9.350579 
1 1 1 9   2  15 o 36.84208 4.289092 16.77324       3.778832 16.87075       5.252567 16.66862       5.440538 36.69973 6.086292 36.43369 6.358974 0.2660408      8.802244 
1 1 1 9   2  16 o 468.6380 6.943797 2681.837       79.29952 2606.878       109.9565 2763.080       114.4727 461.5465 9.776180 475.1498 9.886336 -13.60330      13.90372 
1 1 1 9   2  17 o 222.7529 3.833202 605.0823       20.80757 605.4357       29.39339 604.7272       29.45940 222.7257 5.415558 222.5943 5.430925 0.1314087      7.669630 
1 1 1 9   2  18 o 182.6268 3.975248 406.8301       17.69151 409.3298       30.92536 405.6140       21.56964 182.8493 6.953082 182.2395 4.861299 0.6098022      8.483959 
1 1 1 9   2  19 o 326.3397 5.094706 1300.506       40.51587 1270.493       56.42868 1332.443       58.20898 322.1978 7.186893 329.9489 7.239478 -7.751068      10.20105 
1 1 1 9   2  20 o 62.48778 3.254839 47.75831       4.939250 50.67216       6.962323 44.80591       7.008213 64.26673 4.473543 60.37875 4.802618 3.887978       6.563362 
1 1 1 9   2  21 o 146.5273 3.640690 262.0295       12.99985 248.8675       21.51439 269.5985       16.31503 142.4452 6.212853 148.4957 4.513800 -6.050568      7.679449 
1 1 1 9   2  22 o 60.35873 3.890054 44.66732       5.691321 42.75468       9.622983 45.69625       7.058072 58.65239 6.862246 60.95665 4.789933 -2.304264      8.368625 
1 1 1 9   2  23 o 56.25330 3.530534 38.78345       4.815361 43.60521       6.853346 34.08192       6.767366 59.52854 4.764076 52.50027 5.364931 7.028267       7.174881 
1 1 1 9   2  24 o 59.16352 3.480280 42.88907       4.995533 45.75566       6.981605 39.88174       7.150941 60.97607 4.735604 56.83694 5.221224 4.139126       7.048910 
1 1 1 9   2  25 o 74.09008 3.272450 67.15988       5.893814 70.96124       8.238929 63.17567       8.434744 76.03123 4.466422 71.67290 4.857969 4.358330       6.599150 
1 1 1 9   2  26 o 69.91765 3.953443 59.96647       6.708498 53.19991       7.881678 77.75719       12.78002 65.70798 4.958857 79.20658 6.683470 -13.49860      8.322201 
1 1 1 9   2  27 o 188.7121 4.188316 435.8856       19.26084 426.9718       23.33061 454.9630       34.13152 186.4906 5.138628 191.7771 7.316783 -5.286469      8.940962 
1 1 1 9   2  28 o 262.5740 4.438436 844.8898       28.39997 801.1535       38.92010 894.6992       41.53449 254.9656 6.264065 269.4096 6.326444 -14.44398      8.902944 
1 1 1 9   2  29 o 46.53317 4.475719 26.79775       5.012774 21.91779       6.874964 32.33698       7.324650 41.52758 7.045090 50.87077 6.025429 -9.343193      9.270333 
1 1 1 9   2  30 o 108.9106 3.279766 145.2458       8.694690 139.4036       11.97127 151.7681       12.64900 106.4337 4.626616 111.0482 4.684737 -4.614517      6.584249 
1 1 1 9   2  31 o 83.81100 4.010273 86.38581       8.166750 80.96836       13.99483 89.18329       10.05666 80.29746 7.229362 84.97428 4.877060 -4.676819      8.720631 
1 1 1 9   2  32 o 118.3340 3.319187 171.7333       9.561986 158.8344       13.11878 186.3528       13.96636 113.4092 4.757454 122.8850 4.672403 -9.475761      6.668187 
1 1 1 9   2  33 o 21.68317 7.239587 5.645166       4.489182 1.540877       6.143384 10.34785       6.575994 19.26833 7.987510 28.34585 8.693761 -9.077520      11.80601 
1 1 1 9   2  34 o 18.56060 7.312067 2.704710       4.861688 -1.477905      8.073548 5.084239       6.089561 19.60579 8.649032 22.26125 8.330172 -2.655460      12.00823 
1 1 1 9   2  35 o 98.39430 3.420774 119.5554       8.189726 114.4294       11.09001 125.7040       12.14592 95.65809 4.772522 100.1505 4.992439 -4.492393      6.906621 
1 1 1 9   2  36 o 58.67291 4.080270 43.09589       5.797600 43.43690       8.182951 42.75217       8.215233 58.10014 5.859555 57.59580 5.938215 0.5043373      8.342469 
1 1 1 9   2  37 o 23.64248 7.667775 7.516869       5.049573 5.759729       5.996075 11.80239       9.364087 22.11550 8.267942 28.98040 10.41283 -6.864895      13.29608 
1 1 1 9   2  38 o 14.08270 6.321778 -1.216973      4.509926 -4.800040      7.404219 0.8964604      5.686513 16.15146 7.554889 17.24640 7.437605 -1.094940      10.60162 
1 1 1 9   2  39 o 21.69566 7.548566 6.631729       4.888910 9.245790       5.953316 1.217779       8.567580 24.78980 8.337811 19.78145 8.808119 5.008356       12.12856 
1 1 1 9   2  40 o 39.86949 5.111020 21.66247       4.851677 22.09222       6.974907 21.25961       6.753083 37.74394 7.839784 37.13424 7.714945 0.6096992      10.99921 
1 1 1 9   2  41 o 13.80446 6.023254 0.7705258      3.819703 5.283678       5.266985 -4.236504      5.547690 19.05807 7.578110 13.03448 6.226068 6.023582       9.807735 
1 1 1 9   2  42 o 15.34424 6.490772 2.514266       4.183338 3.289895       8.009727 2.223330       4.905572 17.97702 8.210177 15.64577 6.826305 2.331255       10.67733 
1 1 1 9   2  43 o 15.49070 6.207009 3.450779       3.560707 2.858918       5.179801 3.981033       4.902809 15.75090 6.938929 16.49854 7.004966 -0.7476377     9.859933 
1 1 1 9   2  44 o 10.55934 4.955638 -1.304218      3.230975 1.104846       4.316421 -4.374017      4.872531 13.37551 6.076947 11.16687 5.452444 2.208635       8.164461 
1 1 1 9   2  45 o 15.77547 6.302800 4.746606       3.660584 1.919857       4.939980 8.188966       5.451421 13.70170 6.326971 18.11680 7.518436 -4.415092      9.826365 
1 1 1 9   2  46 o 14.50653 6.144176 4.059008       3.756384 1.853321       5.139428 6.588669       5.503944 13.24037 6.225286 16.03636 7.104621 -2.795991      9.446154 
1 1 1 9   3  0  o 449.1594 9.321999 2461.975       102.0341 0.000000       0.000000 2461.975       102.0341 ?        ?        449.1594 9.321999 0.000000       9.321999 
1 1 1 9   3  1  o 243.4030 4.532849 722.1268       26.88644 0.000000       0.000000 722.1268       26.88644 ?        ?        243.4030 4.532849 0.000000       4.532849 
1 1 1 9   3  2  o 205.2561 3.467844 513.4360       17.34570 519.5834       34.75942 511.3975       20.01605 206.3032 6.923829 204.8413 4.009818 1.461868       8.001128 
1 1 1 9   3  3  o 222.3313 3.676622 602.4246       19.91983 657.7900       41.75896 586.1151       22.66469 232.1287 7.391603 219.2932 4.241199 12.83556       8.521947 
1 1 1 9   3  4  f 110.6076 2.080308 149.0754       5.607237 149.8516       7.689560 148.1941       8.194128 110.8553 2.848847 110.2336 3.053313 0.6216888      4.175960 
1 1 1 9   3  5  o 274.5737 3.858443 918.8081       25.81708 912.0348       32.97080 929.5430       41.50750 273.5393 4.946223 276.1231 6.168617 -2.583771      7.906766 
1 1 1 9   3  6  o 269.6514 4.249439 886.2068       27.92353 872.2938       31.85175 932.4074       58.04233 267.5140 4.885969 276.3336 8.629938 -8.819672      9.917082 
1 1 1 9   3  7  o 275.6363 4.309123 925.9980       28.94419 942.6323       33.87988 881.0561       55.68858 278.0865 4.999492 268.6119 8.518324 9.474548       9.877083 
1 1 1 9   3  8  o 629.0520 9.075996 4828.222       139.1288 4849.131       161.2086 4767.186       275.4247 630.2640 10.49614 623.4979 18.14655 6.766052       20.96345 
1 1 1 9   3  9  o 290.5295 5.225620 1028.966       36.99680 995.3228       44.59370 1103.258       66.26736 285.7051 6.405004 300.5506 9.058200 -14.84552      11.09392 
1 1 1 9   3  10 o 329.5943 5.051083 1324.282       40.56956 1348.398       58.03735 1301.238       56.73295 332.4987 7.162777 326.6340 7.127512 5.864777       10.10479 
1 1 1 9   3  11 o 257.3226 4.164539 807.0876       26.11446 790.0082       36.30768 825.3933       37.58846 254.5400 5.853375 260.1757 5.928594 -5.635651      8.331280 
1 1 1 9   3  12 o 517.4536 8.760559 3268.364       110.4687 3317.747       136.3985 3174.219       188.3293 521.1126 10.74093 508.8037 15.20615 12.30887       18.61705 
1 1 1 9   3  13 o 363.7136 5.523900 1613.165       48.96001 1586.962       68.37450 1640.738       70.13902 360.6033 7.780875 366.6567 7.849896 -6.053436      11.05273 
1 1 1 9   3  14 o 423.3612 6.319834 2186.607       65.20079 2081.672       89.21129 2306.928       95.52817 412.8283 8.867766 434.5721 9.020559 -21.74384      12.64942 
1 1 1 9   3  15 o 455.9623 6.763383 2537.564       75.15000 2524.929       105.8493 2550.406       106.7122 454.4333 9.558326 456.7153 9.588099 -2.282013      13.53858 
1 1 1 9   3  16 o 169.9231 3.283815 351.9910       13.59775 351.3644       19.05299 352.6413       19.41230 169.6674 4.612451 169.9706 4.691187 -0.3031616     6.578901 
1 1 1 9   3  17 o 258.7453 4.239129 816.5944       26.72915 793.5155       37.07821 841.5641       38.56719 254.9315 5.968417 262.5308 6.028394 -7.599289      8.483132 
1 1 1 9   3  18 o 201.0963 3.609712 493.1966       17.68938 515.2385       25.44877 472.5909       24.60566 205.4466 5.083137 196.6897 5.137944 8.756897       7.227499 
1 1 1 9   3  19 o 111.9265 3.441690 152.9448       9.376143 151.8573       16.51818 153.4617       11.38867 111.2890 6.114287 112.0631 4.177683 -0.7741241     7.405237 
1 1 1 9   3  20 o 140.6181 3.530205 241.4007       12.08742 246.1542       20.59900 238.9043       14.92764 141.7401 5.977137 139.8141 4.386739 1.926010       7.414151 
1 1 1 9   3  21 o 130.1901 3.054606 206.7610       9.691016 207.2461       13.68732 206.2732       13.72309 130.1958 4.320032 129.8873 4.341700 0.3085175      6.124788 
1 1 1 9   3  22 o 203.2639 3.685783 504.3825       18.25686 506.4550       25.76274 502.2918       25.87584 203.4222 5.201325 202.5760 5.246091 0.8461609      7.387507 
1 1 1 9   3  23 o 158.9344 3.302322 308.3143       12.79009 309.7238       17.97680 306.8694       18.20111 159.0961 4.641744 158.3490 4.722067 0.7471771      6.621458 
1 1 1 9   3  24 f 30.84052 5.337350 11.97883       3.866123 11.87812       5.339642 12.08980       5.605057 30.47266 7.288813 30.73729 7.540855 -0.2646275     10.48767 
1 1 1 9   3  25 o 82.28098 3.156388 82.78017       6.317128 89.62906       8.985694 76.08733       8.882732 85.49492 4.327027 78.71282 4.651635 6.782097       6.353021 
1 1 1 9   3  26 o 62.14301 4.116427 47.44327       6.198607 42.47953       7.532911 57.85263       10.90863 58.61489 5.332039 68.24445 6.643431 -9.629562      8.518557 
1 1 1 9   3  27 o 200.2912 4.339559 491.2078       21.18086 474.3512       25.30271 530.6777       38.71817 196.5215 5.288296 206.9633 7.690267 -10.44174      9.333075 
1 1 1 9   3  28 o 55.97000 3.890670 38.52194       5.273559 35.59560       7.185111 41.93917       7.764408 53.52140 5.591350 58.14959 5.546417 -4.628189      7.875654 
1 1 1 9   3  29 o 62.15988 3.716068 47.46241       5.603286 39.20467       7.665099 56.93959       8.211583 56.14511 5.680403 67.89857 4.997862 -11.75346      7.566082 
1 1 1 9   3  30 o 136.9763 3.334530 229.5870       11.13054 227.0587       15.52481 232.2612       15.96640 135.8574 4.696350 137.3844 4.776334 -1.526962      6.698438 
1 1 1 9   3  31 o 118.5337 3.312402 172.1630       9.558611 165.6332       13.23984 179.2717       13.81428 115.9323 4.696151 120.6145 4.708993 -4.682213      6.650447 
1 1 1 9   3  32 o 111.6639 3.892919 153.3330       10.57693 165.0537       18.75643 147.8681       12.80753 114.8277 6.732507 109.3869 4.816483 5.440880       8.277992 
1 1 1 9   3  33 o 52.92203 4.861090 34.92759       6.199139 44.15634       10.55182 30.06342       7.660558 58.69232 7.552366 48.56861 6.646631 10.12371       10.06061 
1 1 1 9   3  34 o 90.52766 3.934852 101.3122       8.659789 104.1622       10.47917 95.17422       15.37846 91.50992 4.715086 86.18621 7.393524 5.323708       8.769050 
1 1 1 9   3  35 o 34.39640 5.619281 15.24793       4.547618 11.87219       6.217763 19.13081       6.668474 29.65936 8.285229 37.93338 7.479815 -8.274023      11.16211 
1 1 1 9   3  36 o 54.57904 4.178922 37.38208       5.515827 43.93726       7.643782 30.26010       7.967392 58.64378 5.409660 47.79818 7.051747 10.84560       8.887719 
1 1 1 9   3  37 o 50.65946 4.303016 32.54377       5.261924 31.18052       7.364048 33.96590       7.521417 48.47493 6.389373 50.72757 6.214044 -2.252644      8.912824 
1 1 1 9   3  38 o 21.18712 8.120727 5.345147       5.869920 5.345147       5.869920 0.000000       0.000000 21.18712 8.120727 ?        ?        0.000000       8.120727 
1 1 1 9   3  39 o 85.98149 4.036777 94.93102       8.434546 100.2740       14.19050 92.01223       10.48832 84.25935 6.973436 83.26990 5.194579 0.9894485      8.695542 
1 1 1 9   3  40 o 13.81358 6.042716 0.3482716      3.865929 -4.894846      5.368056 5.997660       5.572152 12.82735 6.126391 20.53893 7.901881 -7.711582      9.998620 
1 1 1 9   3  41 o 21.26351 6.939102 7.197738       4.132027 8.316589       5.909649 6.127566       5.779657 22.00372 8.211751 19.90859 7.931130 2.095129       11.41646 
1 1 1 9   3  42 o 15.42912 6.303355 2.937027       3.753446 5.219793       5.774879 1.267298       4.938955 18.38137 7.691711 14.95425 6.671290 3.427122       10.18177 
1 1 1 9   3  43 o 12.48088 5.614092 0.3076878      3.576908 4.263887       5.351046 -2.887928      4.809245 16.82300 7.234523 12.06820 5.773308 4.754799       9.255776 
1 1 1 9   3  44 o 18.70227 6.887353 6.845408       4.131973 9.448935       6.219274 4.788101       5.528513 19.73657 8.094290 16.39910 7.198486 3.337469       10.83216 
1 1 1 9   3  45 o 16.16540 6.356040 5.112366       3.667210 5.825745       4.979139 4.266602       5.421489 16.36537 7.007062 15.21636 6.872065 1.149010       9.814489 
1 1 1 9   3  46 o 11.50220 5.308487 0.5813237      3.470880 3.722002       4.611690 -3.522036      5.271306 14.20062 6.382236 11.11914 5.477814 3.081479       8.410670 
1 1 1 9   4  0  o 121.8204 3.035671 180.8484       9.011785 193.1958       17.12101 176.1165       10.59882 125.7621 5.600596 120.1575 3.623824 5.604607       6.670741 
1 1 1 9   4  1  o 448.9032 7.596694 2457.700       83.10238 2599.727       148.8119 2393.337       100.1782 461.0500 13.25882 442.8813 9.282177 18.16870       16.18503 
1 1 1 9   4  2  o 430.1451 5.673516 2255.600       59.47075 2316.835       78.15961 2171.400       91.65102 435.8675 7.358542 421.8791 8.914833 13.98837       11.55952 
1 1 1 9   4  3  o 881.8600 11.26390 9494.646       242.0608 9466.725       311.7753 9537.018       384.0732 879.9738 14.53904 882.4844 17.85956 -2.510620      23.02928 
1 1 1 9   4  4  o 194.7819 3.328367 462.3577       15.79851 444.5990       21.72822 482.2768       23.01192 190.9887 4.668532 198.9158 4.747310 -7.927017      6.658239 
1 1 1 9   4  5  f 264.1463 4.169232 850.3800       26.83716 860.9644       31.06068 819.2051       53.30640 265.7734 4.795826 259.0121 8.456794 6.761230       9.722001 
1 1 1 9   4  6  o 362.1206 4.878168 1598.368       43.04731 1626.780       55.92456 1557.057       67.43436 365.2794 6.282628 357.3076 7.744669 7.971771       9.972528 
1 1 1 9   4  7  o 228.6122 3.381354 636.9226       18.83762 657.1287       24.43346 607.3104       29.57873 232.1964 4.318107 223.2012 5.438097 8.995178       6.943987 
1 1 1 9   4  8  o 165.2545 3.574149 332.8199       14.39336 329.9975       25.23728 334.1804       17.52250 164.3929 6.311475 165.5262 4.347800 -1.133255      7.664077 
1 1 1 9   4  9  o 757.0458 9.715506 6995.302       179.2354 6907.956       229.3075 7132.470       287.3591 751.8735 12.51519 763.4185 15.44636 -11.54498      19.88014 
1 1 1 9   4  10 o 139.3580 2.801375 236.6668       9.513474 242.7333       11.21773 221.1264       17.95414 141.1289 3.261767 134.5637 5.486714 6.565201       6.383037 
1 1 1 9   4  11 o 585.5220 8.500506 4183.813       121.2898 4161.515       170.8981 4206.442       172.1682 583.5041 12.01869 586.6417 12.04326 -3.137573      17.01438 
1 1 1 9   4  12 o 267.1104 4.287999 869.7234       27.91139 856.2355       38.97861 883.9175       39.98601 264.9731 6.036544 269.2200 6.094873 -4.246887      8.578306 
1 1 1 9   4  13 o 175.2587 3.292072 374.3651       14.05999 383.0605       19.89924 365.6967       19.86844 177.1968 4.612261 173.1264 4.713773 4.070450       6.594893 
1 1 1 9   4  14 o 463.1664 7.928511 2619.220       89.48799 2551.385       107.3868 2773.378       161.8858 456.9046 9.644711 475.3707 13.98985 -18.46613      16.99224 
1 1 1 9   4  15 o 331.8993 5.131675 1343.614       41.50511 1388.239       59.85468 1302.282       57.60416 337.1864 7.284370 326.5851 7.238047 10.60129       10.26895 
1 1 1 9   4  16 o 304.3802 4.790019 1130.140       35.52956 1151.360       50.68945 1109.646       49.81473 307.0504 6.774416 301.4361 6.781511 5.614288       9.585489 
1 1 1 9   4  17 o 69.16925 3.016660 58.43813       5.072592 59.89194       7.061945 56.88850       7.290993 69.95004 4.161672 68.14697 4.414148 1.803078       6.066648 
1 1 1 9   4  18 o 226.0187 3.864419 623.1302       21.28456 616.0859       29.84597 630.4204       30.36250 224.6136 5.452724 227.2088 5.483732 -2.595169      7.733274 
1 1 1 9   4  19 o 278.0578 5.160689 944.3570       34.96865 916.2062       58.75957 959.7941       43.51276 273.0990 8.840871 280.1419 6.373860 -7.042908      10.89895 
1 1 1 9   4  20 o 112.4492 3.481461 154.4230       9.528631 172.8282       17.56824 146.7521       11.34179 118.7013 6.093865 109.5548 4.256390 9.146484       7.433172 
1 1 1 9   4  21 o 90.54437 2.939674 100.1069       6.477698 104.7338       9.164837 95.48811       9.156864 92.52573 4.074670 88.32114 4.267100 4.204590       5.900092 
1 1 1 9   4  22 o 299.5278 4.788716 1096.752       34.95363 1091.828       49.20205 1101.770       49.66500 298.3667 6.767009 299.7124 6.800011 -1.345764      9.593360 
1 1 1 9   4  23 o 84.69551 3.073234 87.65096       6.332446 94.41644       9.031254 81.10802       8.881486 87.79998 4.233497 81.33268 4.498621 6.467300       6.177385 
1 1 1 9   4  24 o 129.4135 3.121594 204.4328       9.844461 204.1333       13.69461 204.7531       14.16146 129.1352 4.358043 129.3114 4.500885 -0.1761475     6.265022 
1 1 1 9   4  25 o 99.82042 3.517962 121.8706       8.544116 118.9560       10.39654 127.9348       14.99644 98.51965 4.341076 101.9021 6.066514 -3.382446      7.459728 
1 1 1 9   4  26 o 45.17281 4.116574 25.16721       4.481839 23.90911       6.111001 26.63158       6.592955 43.73684 5.882645 46.17876 6.000467 -2.441921      8.403042 
1 1 1 9   4  27 o 157.9011 3.887498 305.0140       14.95862 297.3292       17.84525 323.1734       27.43191 155.6838 4.709151 161.6708 6.979312 -5.987015      8.419436 
1 1 1 9   4  28 o 57.69304 3.890884 40.92113       5.438265 40.35341       7.459212 41.56530       7.945541 57.04780 5.431044 57.85364 5.710189 -0.8058395     7.880514 
1 1 1 9   4  29 o 68.64254 3.581421 57.81476       5.970078 62.73059       8.337323 52.64163       8.552729 71.31242 4.826042 65.18538 5.433535 6.127045       7.267323 
1 1 1 9   4  30 o 58.49318 3.878002 42.11400       5.496552 40.49203       7.393305 44.11831       8.218631 57.08204 5.378389 59.52743 5.736568 -2.445389      7.863541 
1 1 1 9   4  31 o 101.9505 3.338835 127.4156       8.283887 135.9942       11.59601 118.4751       11.83811 105.0639 4.539887 97.93943 4.976392 7.124481       6.736101 
1 1 1 9   4  32 o 198.6839 5.503936 489.2880       26.62279 0.000000       0.000000 489.2880       26.62279 ?        ?        198.6839 5.503936 0.000000       5.503936 
1 1 1 9   4  33 o 59.01316 4.591788 43.27774       6.551454 40.09801       7.832854 50.68216       11.95284 56.46790 5.773397 62.73015 8.000984 -6.262249      9.866502 
1 1 1 9   4  34 o 108.3017 3.302025 144.3661       8.704503 134.9650       11.85710 155.3548       12.81916 104.1828 4.682281 111.7732 4.716971 -7.590393      6.646320 
1 1 1 9   4  35 o 32.85599 5.856886 14.01544       4.517410 11.03404       6.192492 17.40684       6.604565 28.63018 8.357899 36.01317 7.755176 -7.382994      11.40163 
1 1 1 9   4  36 o 58.97189 3.924186 43.48710       5.607287 46.72057       7.685413 39.80674       8.199313 60.53108 5.262426 55.37457 6.181491 5.156506       8.118126 
1 1 1 9   4  37 o 29.79933 7.019023 12.23771       5.012487 10.95069       6.094638 14.92804       8.811635 27.80732 8.336742 31.64474 10.11690 -3.837414      13.10927 
1 1 1 9   4  38 o 41.14912 4.674174 21.98172       4.604117 18.45077       6.232111 26.22453       6.831501 36.10704 7.333410 43.73925 6.615736 -7.632206      9.876582 
1 1 1 9   4  39 o 17.62178 7.496842 2.055140       5.634851 -2.020909      7.761324 6.598359       8.194036 17.33384 7.977607 22.74538 9.305301 -5.411535      12.25687 
1 1 1 9   4  40 o 25.60175 6.817521 9.909720       4.328861 9.871463       6.020871 9.950658       6.228262 24.52547 8.383652 24.54060 8.521114 -0.1513290E-01 11.95387 
1 1 1 9   4  41 o 14.28192 6.188480 1.177659       3.974146 3.446969       5.371161 -1.567621      5.907649 17.37579 7.352669 14.62552 6.810299 2.750264       10.02207 
1 1 1 9   4  42 o 22.77351 6.538091 8.500513       3.818582 9.453009       5.394926 7.544219       5.405671 22.50346 7.922361 20.44191 7.803402 2.061550       11.12011 
1 1 1 9   4  43 o 15.57582 6.896034 2.726261       5.177135 0.000000       0.000000 2.726261       5.177135 ?        ?        15.57582 6.896034 0.000000       6.896034 
1 1 1 9   4  44 o 12.38819 5.590782 0.7178850      3.580816 -3.503590      4.977177 5.247470       5.155612 11.56478 5.615936 16.66852 7.133354 -5.103735      9.078738 
1 1 1 9   4  45 o 10.26330 4.993047 -3.164588      3.983022 -3.514792      4.581237 -2.080161      8.061617 10.78712 5.271317 13.52447 6.683628 -2.737350      8.512207 
1 1 1 9   4  46 o 11.17765 5.277136 -0.3143628     3.762141 3.983048       5.276824 -4.756954      5.365218 14.37547 6.602099 10.79735 5.356537 3.578115       8.501777 
1 1 1 9   5  0  o 212.0750 3.567663 548.1180       18.43781 516.0881       36.60754 559.0050       21.34250 205.5876 7.318651 214.1638 4.089434 -8.576279      8.383681 
1 1 1 9   5  1  o 94.57191 2.537340 109.0655       5.842309 106.8180       7.971657 111.6735       8.587179 93.55624 3.502735 95.65376 3.690865 -2.097519      5.088382 
1 1 1 9   5  2  o 469.1511 5.620634 2683.164       64.25903 2781.176       93.07096 2593.882       88.82932 477.5215 7.998070 461.1677 7.904263 16.35382       11.24484 
1 1 1 9   5  3  o 551.7148 6.532804 3711.262       87.83151 3614.452       121.8132 3816.092       126.7594 544.2964 9.183806 559.2635 9.300960 -14.96704      13.07097 
1 1 1 9   5  4  o 720.8813 9.254824 6340.306       162.5803 6379.475       257.4322 6314.318       209.6896 722.3876 14.62367 719.0820 11.96637 3.305603       18.89565 
1 1 1 9   5  5  o 987.2178 12.59969 11904.51       303.1161 11792.20       388.4895 12079.28       484.6158 981.7446 16.23845 992.5564 20.03578 -10.81183      25.78992 
1 1 1 9   5  6  o 419.2048 5.559757 2142.278       56.79605 2195.373       74.16467 2066.979       88.32063 424.2975 7.172829 411.6165 8.805079 12.68094       11.35689 
1 1 1 9   5  7  o 680.5568 9.797975 5652.449       162.4938 5696.192       188.4167 5525.479       321.0081 683.0004 11.32041 670.9518 19.65427 12.04858       22.68132 
1 1 1 9   5  8  o 335.9651 4.564990 1375.801       37.37404 1365.885       47.89162 1391.245       59.77019 334.7116 5.871548 337.7496 7.261957 -3.037994      9.338689 
1 1 1 9   5  9  o 299.1593 4.144683 1090.820       30.21552 1128.966       39.72084 1038.430       46.54934 304.3120 5.356281 291.8159 6.545888 12.49609       8.458037 
1 1 1 9   5  10 o 463.5934 6.100749 2620.660       68.92179 2630.775       89.14761 2605.630       108.6649 464.3695 7.877889 461.9984 9.651901 2.371094       12.45875 
1 1 1 9   5  11 o 225.2525 4.310768 618.4820       23.66248 638.4797       29.76953 584.1682       38.99561 228.8396 5.338323 218.7061 7.327104 10.13348       9.065547 
1 1 1 9   5  12 o 170.4487 3.196170 354.0836       13.27577 356.3403       18.75710 351.8184       18.79249 170.9098 4.507565 169.8195 4.545183 1.090363       6.401314 
1 1 1 9   5  13 o 69.11203 2.862537 58.31239       4.810606 58.51361       6.649493 58.09142       6.968134 69.16975 3.961470 68.90501 4.169332 0.2647400      5.751224 
1 1 1 9   5  14 o 362.8767 5.520403 1606.135       48.81643 1510.932       66.32268 1718.690       72.11406 351.7790 7.736705 375.1704 7.887789 -23.39139      11.04870 
1 1 1 9   5  15 o 88.93914 3.333354 96.56184       7.211760 108.6837       8.682420 69.59049       12.95111 94.34061 3.784323 75.15435 7.157923 19.18626       8.096725 
1 1 1 9   5  16 o 169.4948 3.255113 350.2357       13.44493 353.2530       18.91577 347.1549       19.11377 170.1163 4.567042 168.6345 4.655641 1.481812       6.521723 
1 1 1 9   5  17 o 45.01567 3.948518 24.90494       4.287637 20.30674       6.473588 28.49847       5.722845 40.20831 6.852300 48.07088 4.956295 -7.862568      8.456882 
1 1 1 9   5  18 o 182.6304 3.875324 406.8786       17.24714 375.8732       27.88617 426.0862       21.94857 175.2220 6.542254 186.7687 4.826476 -11.54665      8.129942 
1 1 1 9   5  19 o 117.0258 2.914877 167.0029       8.312618 164.9637       11.56535 169.1822       11.95601 116.1915 4.090973 117.6626 4.176392 -1.471092      5.846221 
1 1 1 9   5  20 o 128.2112 3.001168 200.4954       9.376751 201.1710       13.13067 199.7923       13.39473 128.2951 4.205600 127.8448 4.305613 0.4503250      6.018752 
1 1 1 9   5  21 o 47.27504 4.390686 27.53358       5.000441 31.42326       9.235373 25.92033       5.947691 49.99706 7.837460 45.71512 5.445848 4.281940       9.543743 
1 1 1 9   5  22 o 149.9799 3.181566 274.4849       11.62814 268.0002       16.16525 281.4382       16.73909 148.0217 4.486656 151.6845 4.533590 -3.662827      6.378364 
1 1 1 9   5  23 o 291.8088 4.713332 1041.361       33.51680 996.5436       45.96054 1092.268       48.98357 284.9521 6.618768 298.2846 6.738814 -13.33255      9.445619 
1 1 1 9   5  24 o 127.6939 3.534803 199.2982       10.98888 192.0800       13.29239 214.8820       19.53106 125.2555 4.361475 132.2008 6.078824 -6.945351      7.481615 
1 1 1 9   5  25 o 164.9637 3.379571 332.3864       13.58583 335.6397       18.99554 328.9794       19.43865 165.5122 4.714419 163.8292 4.874409 1.683060       6.781269 
1 1 1 9   5  26 o 115.5897 3.128820 163.2986       8.805138 161.9908       12.12442 164.7583       12.80841 114.9628 4.335571 115.9087 4.543444 -0.9458542     6.280132 
1 1 1 9   5  27 o 85.98140 3.197425 90.45088       6.687808 88.43532       9.229249 92.67943       9.704625 84.84721 4.479548 86.84553 4.602018 -1.998314      6.422221 
1 1 1 9   5  28 o 80.50491 3.779203 79.48177       7.393411 75.55148       8.710108 89.61407       13.98509 78.36424 4.581077 84.90312 6.816591 -6.538879      8.212927 
1 1 1 9   5  29 o 22.77530 6.886769 6.474053       4.146054 7.997685       5.627593 4.665295       6.131586 25.49905 8.077353 22.23972 8.351220 3.259329       11.61837 
1 1 1 9   5  30 o 87.32602 3.360487 93.47308       7.137904 87.43497       9.620939 100.8660       10.64571 84.21007 4.707054 90.43385 4.848396 -6.223778      6.757463 
1 1 1 9   5  31 o 35.57228 6.305581 16.14221       5.265944 17.87560       8.025599 14.83178       6.978124 36.91137 9.003899 33.69278 8.500671 3.218590       12.38271 
1 1 1 9   5  32 o 77.32333 4.093497 73.73411       7.685836 78.84565       9.289372 62.64135       13.68455 79.78973 4.799719 69.98012 8.178582 9.809616       9.482959 
1 1 1 9   5  33 o 41.96127 5.886992 22.35842       5.854391 25.20630       10.27650 20.99007       7.123331 43.25265 9.956208 40.13383 7.560729 3.118824       12.50163 
1 1 1 9   5  34 o 50.66208 4.192766 31.96169       5.129993 30.64167       6.969416 33.52258       7.578623 49.06719 5.950101 51.26388 6.191853 -2.196693      8.587359 
1 1 1 9   5  35 o 18.01707 6.831240 3.172559       4.125236 0.2970075      5.418965 7.135667       6.361708 17.02846 7.300870 24.26906 8.597664 -7.240602      11.27930 
1 1 1 9   5  36 o 31.38938 6.705611 13.22090       4.973481 15.51401       5.953866 7.926274       9.046979 33.75871 7.438339 26.17561 10.06911 7.583099       12.51862 
1 1 1 9   5  37 o 37.49830 5.203492 18.32522       4.626950 19.04330       6.346115 17.51029       6.760520 37.16912 7.266844 35.15635 8.063141 2.012772       10.85455 
1 1 1 9   5  38 o 35.09205 6.422162 16.95719       5.289622 9.694308       8.548716 21.46305       6.733412 26.00973 9.840229 38.91625 7.369918 -12.90652      12.29414 
1 1 1 9   5  39 o 38.33170 5.813781 20.23393       5.260475 18.99369       6.272594 23.17416       9.657924 35.86657 7.421507 36.55631 10.36634 -0.6897469     12.74911 
1 1 1 9   5  40 o 24.75525 6.591332 9.210934       4.046681 4.169065       5.202880 16.93126       6.438220 18.48029 7.468549 32.26649 8.178617 -13.78620      11.07560 
1 1 1 9   5  41 f 17.69981 6.694471 4.547960       3.955961 10.70678       5.440049 -2.363956      5.763061 24.70906 7.954073 14.02494 6.593543 10.68413       10.33161 
1 1 1 9   5  42 o 19.26555 6.928135 6.223364       4.146351 10.62643       7.037629 3.882363       5.131559 22.51147 8.818853 16.97573 7.185252 5.535742       11.37541 
1 1 1 9   5  43 o 17.54166 6.557460 5.257391       3.771596 -0.6735969     5.278733 11.44269       5.390715 13.54157 6.348554 23.68011 7.933759 -10.13855      10.16113 
1 1 1 9   5  44 o 21.65983 7.475659 10.02908       4.790658 13.57718       8.897682 8.580607       5.685034 20.34682 9.022763 19.16746 7.784822 1.179361       11.91695 
1 1 1 9   5  45 o 9.908343 4.765013 -2.222830      3.373729 -0.6273269     4.653142 -3.991150      4.898668 12.06903 5.747378 10.90112 5.352586 1.167917       7.853823 
1 1 1 9   5  46 o 9.010332 4.480295 -5.408574      3.838918 -2.074483      4.568684 -13.41685      7.080633 11.02876 5.361361 10.27445 5.225884 0.7543049      7.486925 
1 1 1 9   6  0  o 449.7483 5.406735 2465.715       59.25715 2435.935       83.08960 2496.539       84.53359 446.9234 7.629173 452.4468 7.667005 -5.523346      10.81606 
1 1 1 9   6  1  o 179.5334 3.599577 392.8109       15.74827 447.7939       28.53069 368.7184       18.88600 191.5532 6.119902 173.8741 4.460953 17.67911       7.573196 
1 1 1 9   6  2  o 433.5267 5.720469 2291.157       60.43430 2373.333       97.56538 2239.999       76.98080 441.0653 9.077300 428.5885 7.370649 12.47681       11.69290 
1 1 1 9   6  3  o 392.2531 5.841390 1875.716       55.83656 2032.091       116.4178 1828.997       63.63321 407.7845 11.72746 387.3035 6.742117 20.48102       13.52736 
1 1 1 9   6  4  o 459.7315 5.515617 2576.441       61.79231 2715.529       90.24416 2453.668       84.78606 471.8633 7.848142 448.5405 7.756873 23.32278       11.03460 
1 1 1 9   6  5  o 48.77168 3.181056 29.11081       3.760094 29.29341       4.226882 28.41834       8.231286 48.89706 3.571967 47.72619 7.309845 1.170872       8.135895 
1 1 1 9   6  6  o 624.8646 8.077370 4762.629       122.9963 4914.166       161.7741 4555.030       189.3486 634.4957 10.46271 610.6064 12.72520 23.88934       16.47419 
1 1 1 9   6  7  f 381.0134 5.701853 1769.832       52.94103 1767.820       60.83751 1776.109       107.4526 380.7621 6.556644 381.1774 11.58131 -0.4153137     13.30851 
1 1 1 9   6  8  o 546.0759 9.162824 3639.008       121.9322 3639.008       121.9322 0.000000       0.000000 546.0759 9.162824 ?        ?        0.000000       9.162824 
1 1 1 9   6  9  o 198.2628 3.426375 479.0589       16.55436 467.4510       23.10279 491.3085       23.73270 195.8236 4.841315 200.7584 4.851068 -4.934799      6.853554 
1 1 1 9   6  10 o 494.0559 6.466593 2976.776       77.85522 2964.085       100.0942 2996.213       123.8772 492.8564 8.333978 495.3308 10.26266 -2.474426      13.22034 
1 1 1 9   6  11 o 531.9397 6.938427 3451.645       89.94138 3463.228       116.2528 3434.373       141.9557 532.6293 8.956578 530.1518 10.98795 2.477478       14.17587 
1 1 1 9   6  12 o 314.1294 5.584779 1203.333       42.75143 1205.594       52.71361 1198.987       73.07587 314.3564 6.881203 313.1618 9.586959 1.194580       11.80088 
1 1 1 9   6  13 o 264.3433 4.255019 851.8979       27.40980 853.3568       38.65934 850.4233       38.86812 264.4959 5.997901 264.0388 6.040733 0.4570923      8.512654 
1 1 1 9   6  14 o 194.1355 3.462188 459.4210       16.37916 459.3307       23.01728 459.5135       23.31282 194.0129 4.872268 194.0478 4.934037 -0.3488159E-01 6.934242 
1 1 1 9   6  15 f 499.7015 8.481840 3052.519       103.2849 3084.026       179.0585 3036.809       126.4398 500.4185 14.69930 497.9973 10.41888 2.421265       18.01728 
1 1 1 9   6  16 o 178.2248 4.702916 387.7795       20.40760 407.0214       28.13545 366.4172       29.64509 182.4545 6.337576 173.0301 7.045377 9.424377       9.476402 
1 1 1 9   6  17 o 347.6812 6.198768 1476.769       52.51975 1498.600       64.51273 1433.864       90.43810 350.0168 7.563457 341.4908 10.88155 8.525970       13.25195 
1 1 1 9   6  18 o 143.3472 3.055093 250.5671       10.67210 254.4968       15.01243 246.5523       15.17412 144.3501 4.272439 142.0677 4.388266 2.282394       6.124591 
1 1 1 9   6  19 o 151.5639 3.130652 280.1745       11.56290 276.5903       16.11058 283.9822       16.60547 150.4548 4.398812 152.4463 4.474745 -1.991501      6.274782 
1 1 1 9   6  20 o 63.58051 3.083607 49.42659       4.763456 53.11438       6.615635 45.45631       6.864336 65.82746 4.145137 60.82331 4.666837 5.004150       6.241917 
1 1 1 9   6  21 o 21.18858 6.068225 5.624056       3.293317 6.267407       4.368632 4.777139       5.012352 22.71346 7.106178 21.35445 7.624665 1.359005       10.42273 
1 1 1 9   6  22 o 332.0124 7.399584 1354.247       59.86841 1287.367       82.96537 1426.910       86.47722 322.1656 10.58209 339.2549 10.47273 -17.08926      14.88820 
1 1 1 9   6  23 o 294.1928 5.435043 1059.901       38.96468 1041.901       47.29515 1097.932       68.74622 291.3152 6.662194 297.7484 9.486758 -6.433197      11.59239 
1 1 1 9   6  24 o 166.6733 3.357685 339.2267       13.63773 324.0944       18.61864 356.7438       20.03216 162.6755 4.701602 170.6571 4.821731 -7.981628      6.734549 
1 1 1 9   6  25 o 75.01621 3.192390 68.84456       5.822548 75.24260       8.002314 61.64672       8.487764 78.31880 4.208344 70.76868 4.952981 7.550125       6.499398 
1 1 1 9   6  26 f 45.39207 4.167451 25.42213       4.558444 24.76814       6.140507 26.22499       6.803595 44.53746 5.795023 45.76021 6.265549 -1.222744      8.534600 
1 1 1 9   6  27 o 135.7820 3.227382 225.2900       10.67895 219.7958       14.65209 231.5155       15.59679 133.8605 4.498090 137.3522 4.666537 -3.491653      6.481464 
1 1 1 9   6  28 o 122.5505 3.190961 183.6926       9.521446 184.1084       13.10001 183.2269       13.86309 122.4805 4.396159 122.1310 4.666570 0.3495331      6.411170 
1 1 1 9   6  29 o 41.54327 5.377593 21.58562       5.316475 21.43244       6.113847 22.06067       10.76660 41.20268 6.287981 40.97858 10.67628 0.2241058      12.39039 
1 1 1 9   6  30 o 73.14696 3.913653 65.78941       6.950736 66.39059       10.73643 65.35564       9.119872 73.01646 6.089357 72.65690 5.184889 0.3595581      7.997708 
1 1 1 9   6  31 o 73.41117 4.073606 66.37949       7.258903 73.98971       8.732618 49.36435       13.05761 77.39455 4.651650 61.93899 8.906733 15.45555       10.04827 
1 1 1 9   6  32 o 67.88683 3.596429 56.72990       5.928446 57.74297       7.963645 55.47056       8.879029 68.21882 4.821460 66.67135 5.514270 1.547470       7.324865 
1 1 1 9   6  33 o 59.46923 3.818190 43.71479       5.504087 44.14524       7.408432 43.18446       8.223058 59.41459 5.168154 58.55304 5.840830 0.8615532      7.799046 
1 1 1 9   6  34 o 102.2693 3.957054 129.4505       9.843128 116.6732       16.47025 136.5497       12.27672 95.42494 7.134397 104.6466 4.827172 -9.221642      8.614013 
1 1 1 9   6  35 o 72.91335 3.921980 66.15220       6.943001 66.26456       8.280692 65.88621       12.74019 72.64748 4.702727 70.87340 7.489773 1.774086       8.843775 
1 1 1 9   6  36 o 28.50334 6.301394 10.87016       4.260437 13.30695       5.647732 7.652308       6.490038 31.13571 7.527331 24.51556 8.684048 6.620150       11.49232 
1 1 1 9   6  37 o 37.17548 5.224136 18.05803       4.602284 12.11525       6.040425 26.28202       7.105819 29.08940 8.180727 44.01221 6.847923 -14.92281      10.66857 
1 1 1 9   6  38 o 39.34884 4.911845 20.32774       4.607624 27.54148       6.436681 12.74636       6.598666 45.13660 6.000406 29.00557 8.669639 16.13103       10.54360 
1 1 1 9   6  39 o 32.32810 5.550153 14.38275       4.214977 13.21671       5.616056 15.88674       6.378166 29.42467 7.732608 31.97956 8.159040 -2.554888      11.24114 
1 1 1 9   6  40 o 49.76343 4.694356 33.42776       5.625486 29.87325       6.580260 43.08018       10.84353 45.60378 6.071891 50.45756 9.155871 -4.853775      10.98626 
1 1 1 9   6  41 o 30.49404 6.686094 14.62158       4.831273 20.07887       7.621692 10.95587       6.246573 32.28654 9.226623 24.18531 8.523899 8.101229       12.56135 
1 1 1 9   6  42 o 13.13229 5.755382 0.9099177      3.521499 -3.014397      5.035495 4.666329       4.926595 12.50507 5.961689 17.50381 7.194152 -4.998739      9.343316 
1 1 1 9   6  43 o 25.06485 6.380085 10.68978       3.906354 13.33597       5.557644 8.105943       5.491784 25.47816 8.021344 19.80249 7.780542 5.675665       11.17492 
1 1 1 9   6  44 o 12.20891 5.740332 -0.5972371     4.369939 18.33282       9.327188 -5.921170      4.946421 22.35029 9.580395 10.58909 5.233434 11.76120       10.91663 
1 1 1 9   6  45 o 13.88662 6.020913 3.030541       3.766562 1.958830       4.940073 4.518635       5.821164 13.56308 6.285406 15.20625 6.965271 -1.643168      9.381968 
1 1 1 9   6  46 o 9.112907 4.483646 -3.869266      3.493911 -0.7901049     4.609696 -8.026432      5.356174 11.59085 5.573047 9.901075 4.976853 1.689774       7.471808 
1 1 1 9   7  0  o 338.2408 4.195576 1394.356       34.58228 1389.047       48.84900 1399.689       48.96467 337.5512 5.938542 338.8421 5.929927 -1.290894      8.392278 
1 1 1 9   7  1  o 518.5943 6.175370 3278.789       78.04173 3281.505       110.3917 3276.075       110.3437 518.6587 8.734109 518.2291 8.737547 0.4295654      12.35433 
1 1 1 9   7  2  o 484.3175 7.105600 2860.240       83.86236 2809.908       116.6278 2914.125       120.6743 479.8574 9.973643 488.6630 10.13372 -8.805634      14.21851 
1 1 1 9   7  3  o 333.8177 5.073167 1358.307       41.26906 1491.805       86.29564 1318.723       46.99090 349.4819 10.14350 328.8955 5.862998 20.58643       11.71603 
1 1 1 9   7  4  o 449.3912 6.617908 2462.396       72.47387 2583.874       148.1316 2424.168       83.09872 459.6735 13.23777 445.8371 7.648601 13.83643       15.28855 
1 1 1 9   7  5  o 227.0716 3.053575 628.3453       16.89692 654.0188       24.07028 603.4026       23.72515 231.6473 4.264007 222.5012 4.375631 9.146133       6.109656 
1 1 1 9   7  6  o 246.0683 3.569998 737.9256       21.40719 737.5041       27.07057 738.6291       34.97422 245.9819 4.516045 246.1407 5.830805 -0.1588287     7.375158 
1 1 1 9   7  7  o 251.5446 4.697647 771.2749       28.79595 784.5499       35.19975 744.4147       50.06993 253.6764 5.694077 246.8800 8.334473 6.796432       10.09386 
1 1 1 9   7  8  o 580.8516 9.750473 4118.399       138.0152 4311.421       173.8166 3789.063       227.0432 594.0280 12.00738 555.9020 16.77921 38.12598       20.63296 
1 1 1 9   7  9  o 115.2598 3.146243 162.0219       8.828764 171.2512       10.49741 139.7141       16.32027 118.4813 3.640086 106.8537 6.295501 11.62759       7.272109 
1 1 1 9   7  10 o 613.4832 7.937274 4592.287       118.6616 4528.751       151.5453 4692.971       190.7717 608.9411 10.21248 619.4969 12.63685 -10.55579      16.24760 
1 1 1 9   7  11 o 399.1389 5.325047 1942.516       51.79449 1910.767       65.95838 1993.584       83.65205 395.7719 6.838943 404.1286 8.494168 -8.356750      10.90514 
1 1 1 9   7  12 o 590.4561 8.575500 4256.964       123.3909 4325.872       176.2914 4190.787       172.7642 594.5798 12.16704 585.2333 12.11403 9.346436       17.16935 
1 1 1 9   7  13 o 193.1270 4.627872 454.7852       21.78013 452.9059       30.66271 456.6989       30.94271 192.5473 6.544381 193.3504 6.576728 -0.8030548     9.278054 
1 1 1 9   7  14 o 607.5382 10.18950 4516.436       150.8560 4446.242       257.3748 4553.172       186.1927 600.0271 17.62097 609.3409 12.53910 -9.313782      21.62701 
1 1 1 9   7  15 o 370.6454 5.620103 1676.531       50.76203 1682.926       71.79926 1670.141       71.77744 371.0589 7.940375 369.6427 7.968375 1.416199       11.24920 
1 1 1 9   7  16 o 183.4719 3.381887 410.4390       15.12045 411.8787       21.20174 408.9488       21.57012 183.6707 4.740878 183.0079 4.840923 0.6628265      6.775725 
1 1 1 9   7  17 o 368.9746 6.516335 1664.028       58.59167 1628.686       70.38641 1743.784       105.7359 364.7632 7.918478 376.2843 11.54475 -11.52109      13.99941 
1 1 1 9   7  18 o 71.83434 3.390672 63.07870       5.918703 65.17571       6.872911 57.06023       11.64349 72.98550 3.878197 67.90771 7.142860 5.077789       8.127783 
1 1 1 9   7  19 o 29.44120 4.714768 10.85024       3.268506 14.38513       4.348370 6.259026       4.955673 33.88366 5.451105 23.11417 7.602552 10.76949       9.354856 
1 1 1 9   7  20 o 145.5683 3.086046 258.4955       10.94725 254.8288       15.18225 262.4666       15.79972 144.3862 4.319793 146.5239 4.430003 -2.137695      6.187531 
1 1 1 9   7  21 o 241.9665 4.658158 715.5323       27.46664 700.4799       33.32510 747.4177       48.50238 239.2253 5.716474 246.4221 8.087906 -7.196793      9.904156 
1 1 1 9   7  22 o 185.9331 3.482244 422.0274       15.77800 431.9699       22.29256 412.0475       22.33442 187.8781 4.873203 183.4704 5.000090 4.407761       6.982049 
1 1 1 9   7  23 o 71.26083 3.769217 62.20259       6.522151 72.81512       12.27884 58.03152       7.697885 76.72572 6.632255 68.72842 4.623094 7.997299       8.084541 
1 1 1 9   7  24 o 150.1900 3.201156 275.4088       11.71613 290.6423       16.64639 260.4549       16.49289 154.0794 4.438049 145.8175 4.647355 8.261917       6.426055 
1 1 1 9   7  25 o 93.64708 3.052835 107.1928       6.957495 110.9399       9.527523 102.9115       10.18402 95.15015 4.118739 91.57359 4.578176 3.576553       6.158223 
1 1 1 9   7  26 o 108.1699 3.085795 143.0255       8.125788 150.8456       11.28518 134.6058       11.70978 110.9435 4.181656 104.7273 4.599528 6.216217       6.216261 
1 1 1 9   7  27 o 149.0875 3.280068 271.6533       11.91681 268.2793       16.38900 275.4383       17.35860 147.8811 4.553249 149.7958 4.761360 -1.914642      6.588067 
1 1 1 9   7  28 o 81.36958 3.210608 81.06395       6.353781 73.20017       8.345535 91.90728       9.799862 77.13801 4.458660 86.42598 4.670421 -9.287971      6.456971 
1 1 1 9   7  29 o 34.28873 5.873938 14.89906       4.731671 24.04721       6.997602 7.192783       6.422511 43.56307 6.814844 25.05983 8.655443 18.50323       11.01630 
1 1 1 9   7  30 o 46.36954 4.929661 26.75606       5.485122 26.21551       6.191941 28.72650       11.82203 45.73816 5.677171 46.58942 10.64620 -0.8512611     12.06532 
1 1 1 9   7  31 o 123.3891 3.242802 186.5955       9.742197 188.5895       13.35029 184.3242       14.24863 123.7343 4.434734 122.2138 4.793580 1.520493       6.530335 
1 1 1 9   7  32 o 20.93372 6.828880 5.325290       4.001989 3.500047       5.185599 8.013495       6.293174 19.87222 7.628653 25.65142 8.571806 -5.779196      11.47485 
1 1 1 9   7  33 o 58.85321 3.837462 42.84565       5.473630 47.57318       7.446373 37.28849       8.073346 61.71844 4.993620 54.21213 6.223874 7.506313       7.979527 
1 1 1 9   7  34 o 72.27242 3.899275 64.75608       6.841975 63.91464       8.187775 66.70346       12.45607 71.51383 4.724762 71.90409 7.205714 -0.3902588     8.616594 
1 1 1 9   7  35 o 35.82403 6.658117 16.95390       5.598587 16.17413       9.223638 17.40878       7.044772 33.81504 10.28168 35.66413 8.267323 -1.849091      13.19324 
1 1 1 9   7  36 o 25.35499 6.750167 8.714238       4.244396 6.506283       5.549934 11.82494       6.587514 22.75430 8.033235 29.01580 8.659841 -6.261501      11.81210 
1 1 1 9   7  37 o 18.69491 6.706651 4.235016       3.882839 9.990559       5.251561 -2.705467      5.766870 26.56833 7.679599 15.12736 6.930473 11.44097       10.34445 
1 1 1 9   7  38 o 19.17249 6.631232 4.839291       3.770289 5.599393       4.886116 3.720658       5.927497 20.66023 7.508368 19.50129 7.938441 1.158939       10.92678 
1 1 1 9   7  39 o 20.40408 6.714857 5.966560       3.865760 5.391171       4.986414 6.833341       6.120154 19.97657 7.524715 21.83119 8.310476 -1.854622      11.21095 
1 1 1 9   7  40 o 10.29623 4.944732 -4.065244      3.604410 -2.015216      4.874570 -6.538255      5.353889 13.41300 6.225425 11.97921 5.818897 1.433784       8.521472 
1 1 1 9   7  41 o 21.43408 7.136955 7.667455       4.363345 7.357379       5.154663 8.451262       8.195418 20.73237 7.682283 21.32372 9.055285 -0.5913582     11.87500 
1 1 1 9   7  42 o 21.73690 7.062064 8.316768       4.282254 16.05363       7.063015 3.819682       5.384845 27.25268 9.080409 16.84709 7.251255 10.40559       11.62044 
1 1 1 9   7  43 o 17.28491 6.468541 5.185910       3.672051 6.520899       5.165006 3.821512       5.221586 18.30538 7.425541 16.08142 7.029028 2.223959       10.22477 
1 1 1 9   7  44 o 10.10280 4.846015 -2.351207      3.438586 -5.976522      4.605187 2.216761       5.169351 10.12850 5.013735 14.28177 6.549978 -4.153270      8.248621 
1 1 1 9   7  45 o 15.52394 7.104593 5.246720       6.038817 0.1591040      9.100006 9.250184       8.072396 14.18351 7.025795 17.01802 7.936537 -2.834517      10.59955 
1 1 1 9   8  0  o 242.8094 3.527589 718.4873       20.87274 739.6899       33.58160 705.1396       26.64473 246.3308 5.594312 240.5284 4.545785 5.802353       7.208362 
1 1 1 9   8  1  o 1278.253 16.27786 19989.48       507.0495 19691.49       793.1086 20195.47       659.4124 1264.859 25.73087 1283.061 21.08985 -18.20239      33.26950 
1 1 1 9   8  2  o 873.0995 12.50284 9310.900       266.0165 9021.547       367.9846 9627.632       385.0004 858.4034 17.59147 886.7142 17.81728 -28.31079      25.03828 
1 1 1 9   8  3  o 390.3576 5.855976 1857.672       55.70549 1860.430       78.45087 1854.868       79.11221 390.5424 8.243156 389.9539 8.325190 0.5885010      11.71573 
1 1 1 9   8  4  o 975.4422 12.45707 11622.96       296.1103 11708.11       470.3677 11567.06       381.1057 977.1256 19.75382 972.2679 16.08508 4.857727       25.47437 
1 1 1 9   8  5  o 452.0884 6.660128 2492.199       73.37397 2507.205       145.9174 2487.121       84.88663 452.7487 13.23977 451.5690 7.713990 1.179626       15.32309 
1 1 1 9   8  6  o 227.6984 3.380470 631.8516       18.75742 654.5687       24.16511 597.4164       29.75181 231.7412 4.279070 221.3691 5.515187 10.37207       6.980525 
1 1 1 9   8  7  o 546.9799 7.983154 3649.836       106.4099 3562.915       120.7086 3952.903       225.3956 540.3236 9.167443 567.9210 16.30314 -27.59735      18.70386 
1 1 1 9   8  8  o 179.4641 4.824796 392.8968       21.08135 442.2453       31.26279 351.7444       28.54878 190.3079 6.751863 169.6842 6.918657 20.62361       9.667236 
1 1 1 9   8  9  o 555.2137 11.50522 3766.916       155.6650 3882.129       224.4429 3660.126       216.0823 562.5687 16.38918 546.2636 16.25040 16.30505       23.07988 
1 1 1 9   8  10 f 298.3060 4.640258 1084.818       33.73185 1099.690       38.92525 1039.973       67.59383 300.3192 5.318782 291.6764 9.522526 8.642792       10.90724 
1 1 1 9   8  11 o 436.8526 7.455193 2328.805       79.36517 2453.864       141.2918 2271.158       95.92888 447.5588 12.96847 431.2491 9.128199 16.30969       15.85892 
1 1 1 9   8  12 o 90.97760 2.784014 100.9688       6.164966 109.6620       9.862140 95.39296       7.898404 94.74519 4.282546 88.38695 3.675053 6.358246       5.643245 
1 1 1 9   8  13 o 447.6013 6.637429 2445.156       72.39813 2321.789       98.90824 2587.544       106.2594 435.8152 9.313095 460.0549 9.478107 -24.23972      13.28790 
1 1 1 9   8  14 o 218.7607 4.217286 583.5747       22.48219 588.6384       27.96722 574.3256       37.79810 219.6603 5.224705 216.7372 7.166349 2.923035       8.868714 
1 1 1 9   8  15 o 250.9698 4.107821 768.1651       25.12286 774.7645       35.40611 761.4732       35.65337 251.9315 5.767128 249.7538 5.858039 2.177643       8.220487 
1 1 1 9   8  16 o 148.1301 3.032636 267.5220       10.94712 275.6404       15.39588 259.2204       15.56870 150.2596 4.208761 145.6989 4.389912 4.560715       6.081529 
1 1 1 9   8  17 o 146.9618 3.016333 263.3503       10.80239 258.1616       14.90640 269.0889       15.67645 145.3955 4.211565 148.4331 4.338575 -3.037628      6.046529 
1 1 1 9   8  18 o 221.7422 4.421222 600.2421       23.89058 587.9008       28.41618 629.9987       44.12407 219.3581 5.315888 226.5449 8.005130 -7.186737      9.609410 
1 1 1 9   8  19 o 112.6235 3.398244 154.8919       9.315848 155.1593       10.83804 154.1355       18.22883 112.6766 3.953250 111.9882 6.710383 0.6884689      7.788288 
1 1 1 9   8  20 o 154.8925 3.544455 292.8026       13.37876 284.1694       16.27694 310.7817       23.48941 152.4635 4.385532 159.2136 6.065281 -6.750092      7.484686 
1 1 1 9   8  21 o 49.36738 3.277893 29.87179       3.921067 28.56091       5.178238 31.63364       6.003228 48.14118 4.464843 50.62763 4.928175 -2.486450      6.649942 
1 1 1 9   8  22 o 94.66826 2.859520 109.4425       6.589243 109.4937       8.942980 109.3816       9.745902 94.60098 3.887558 94.51536 4.242207 0.8562469E-01  5.754079 
1 1 1 9   8  23 o 138.9114 3.082265 235.5289       10.43384 236.6116       14.39808 234.3316       15.14130 139.0557 4.253934 138.3488 4.497064 0.7068481      6.190278 
1 1 1 9   8  24 o 207.1168 4.391782 524.7728       22.16625 532.7531       39.48265 521.0998       26.78595 207.6494 7.816556 206.1273 5.337048 1.522171       9.464809 
1 1 1 9   8  25 o 59.51934 3.284693 43.40336       4.745717 36.92024       6.204288 52.54545       7.367543 54.70741 4.699308 65.34124 4.657535 -10.63383      6.616354 
1 1 1 9   8  26 o 90.62928 3.042274 100.4338       6.709450 110.9397       9.315416 89.10863       9.671805 95.13422 4.027291 85.14775 4.679193 9.986465       6.173647 
1 1 1 9   8  27 o 233.7802 4.079897 669.1553       23.24304 664.6195       32.25425 674.0552       33.52374 232.4543 5.693945 233.9524 5.884827 -1.498108      8.188540 
1 1 1 9   8  28 o 9.928724 4.847091 -7.150328      3.846061 -1.841036      5.356051 -12.80239      5.526245 15.73698 6.988267 11.06559 5.480224 4.671384       8.880807 
1 1 1 9   8  29 o 97.61774 3.223687 116.6916       7.658111 124.3509       10.28792 107.1737       11.46840 100.6002 4.205832 93.19988 5.068611 7.400269       6.586338 
1 1 1 9   8  30 o 80.88876 3.755889 80.38410       7.383288 77.85271       8.505649 88.12214       14.87112 79.47807 4.408889 83.75679 7.360764 -4.278725      8.580160 
1 1 1 9   8  31 o 46.65006 4.251438 26.98099       4.780031 29.01678       6.252288 24.11720       7.415569 48.14252 5.423618 43.35506 7.276431 4.787457       9.075356 
1 1 1 9   8  32 o 115.5858 3.218579 163.9802       9.056945 173.3908       12.50388 153.5934       13.13643 118.5095 4.336993 111.3445 4.853071 7.164948       6.508595 
1 1 1 9   8  33 o 33.74556 5.921230 14.64438       4.691779 14.79248       5.497092 14.24707       9.003784 33.63763 6.936610 32.71616 10.19665 0.9214745      12.33241 
1 1 1 9   8  34 o 86.68562 3.287373 92.70802       6.931774 96.56500       9.183056 87.59966       10.56827 88.09251 4.290623 83.47504 5.221456 4.617470       6.758183 
1 1 1 9   8  35 o 38.20029 6.316292 19.13704       5.674525 12.72084       9.480374 22.71910       7.083579 30.52915 10.51721 41.23780 7.316838 -10.70865      12.81202 
1 1 1 9   8  36 o 46.05817 4.445248 26.95854       4.927370 29.37065       6.559411 23.83463       7.464752 47.43824 5.794252 41.68222 7.630094 5.756023       9.580798 
1 1 1 9   8  37 o 17.06163 6.561098 3.002535       3.840409 1.578516       5.103077 4.862372       5.831922 17.12386 7.202131 20.79361 8.061418 -3.669746      10.81005 
1 1 1 9   8  38 o 20.38758 6.644743 5.741883       3.789505 4.266800       5.001442 7.730109       5.806573 19.19261 7.458556 23.22367 8.215238 -4.031057      11.09595 
1 1 1 9   8  39 o 32.66056 5.490047 14.76735       4.214685 12.30760       5.640497 17.87689       6.341895 27.97291 7.918686 34.02676 7.813392 -6.053858      11.12451 
1 1 1 9   8  40 o 16.45361 6.667689 3.102986       4.159727 1.484202       6.089040 4.519577       5.696085 16.74495 7.442621 18.70422 7.716494 -1.959274      10.72086 
1 1 1 9   8  41 o 14.26777 6.191841 1.386501       3.990931 1.783877       4.803696 0.5010445      7.170651 15.35056 6.724929 16.37782 7.583821 -1.027264      10.13603 
1 1 1 9   8  42 f 15.52724 6.289662 3.311108       3.699658 4.262117       5.114501 2.267304       5.358219 16.98498 7.180474 15.61408 6.958266 1.370898       9.998834 
1 1 1 9   8  43 f 20.65046 6.615060 7.775135       3.765892 12.10588       5.224528 3.091620       5.433147 24.14970 7.796793 15.52307 6.955848 8.626630       10.44863 
1 1 1 9   8  44 o 15.37712 6.482781 4.230026       4.150177 7.913983       4.935571 -4.661978      7.667961 18.59838 7.354817 12.96147 6.425537 5.636909       9.766313 
1 1 1 9   8  45 o 12.85585 5.681277 2.109483       3.498145 5.923467       4.705845 -2.601054      5.229780 16.15289 6.860695 11.55439 5.643203 4.598499       8.883405 
1 1 1 9   9  0  o 396.2274 4.833734 1913.610       46.67274 1946.069       66.83134 1882.708       65.20901 399.4996 6.864798 392.9446 6.809891 6.555023       9.669543 
1 1 1 9   9  1  o 491.7935 6.441849 2948.880       77.20215 3015.186       123.7915 2906.677       98.76105 497.0442 10.22021 488.1557 8.302162 8.888458       13.16733 
1 1 1 9   9  2  o 662.8651 9.550533 5361.642       154.2726 5433.066       310.4338 5338.217       177.7796 665.5110 19.16153 661.2523 11.03262 4.258667       22.11069 
1 1 1 9   9  3  o 394.6700 5.278495 1898.788       50.76687 2053.295       84.28170 1810.808       63.59898 410.2657 8.430086 385.3603 6.772470 24.90533       10.81354 
1 1 1 9   9  4  o 167.5919 2.786672 342.2713       11.38086 360.7876       18.16271 330.3013       14.60327 171.9944 4.336875 164.6275 3.640085 7.366898       5.662041 
1 1 1 9   9  5  o 483.1908 6.348619 2846.813       74.75393 2893.827       119.1590 2816.303       95.99335 486.8987 10.04274 480.4781 8.198445 6.420654       12.96422 
1 1 1 9   9  6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 9   9  7  o 341.8265 7.480231 1425.295       62.30987 1490.861       90.40897 1365.974       85.99551 349.2396 10.63551 334.2848 10.56986 14.95480       14.99453 
1 1 1 9   9  8  o 176.0723 6.841518 378.6877       29.29897 0.000000       0.000000 378.6877       29.29897 ?        ?        176.0723 6.841518 0.000000       6.841518 
1 1 1 9   9  9  o 21.65849 8.831569 2.053488       7.351265 0.000000       0.000000 2.053488       7.351265 ?        ?        21.65849 8.831569 0.000000       8.831569 
1 1 1 9   9  10 o 224.4984 7.872530 615.8487       43.00222 0.000000       0.000000 615.8487       43.00222 ?        ?        224.4984 7.872530 0.000000       7.872530 
1 1 1 9   9  11 o 209.2020 5.334201 534.0618       27.17171 592.8965       40.33897 485.1967       36.76273 220.2744 7.525980 199.2355 7.585757 21.03888       10.68569 
1 1 1 9   9  12 o 398.5226 5.335301 1937.083       51.81411 1930.223       66.66361 1947.552       82.34982 397.6841 6.878829 399.2942 8.463180 -1.610107      10.90613 
1 1 1 9   9  13 o 295.2834 5.396857 1063.700       38.83435 1052.187       67.74559 1069.335       47.39429 293.1514 9.495687 295.9767 6.571014 -2.825378      11.54757 
1 1 1 9   9  14 o 183.3554 3.316810 409.8623       14.82008 421.4732       21.03070 398.4090       20.88755 185.8843 4.642746 180.6599 4.748608 5.224365       6.641112 
1 1 1 9   9  15 o 385.4882 6.689000 1815.595       62.83598 1740.663       75.15647 1989.617       114.5336 377.1944 8.176455 402.2425 11.69689 -25.04816      14.27136 
1 1 1 9   9  16 o 147.3239 3.008430 264.6315       10.80063 276.2996       15.22811 252.8205       15.32112 150.4340 4.157962 143.8792 4.374832 6.554825       6.035545 
1 1 1 9   9  17 o 240.3024 3.993203 704.5898       23.38383 694.0594       32.52374 715.8583       33.64417 238.3373 5.599798 242.0386 5.704127 -3.701279      7.993423 
1 1 1 9   9  18 o 429.1320 7.391592 2256.675       77.29741 2277.380       95.40962 2217.126       131.8610 430.4662 9.095299 422.7635 12.81399 7.702698       15.71378 
1 1 1 9   9  19 f 153.9952 3.645958 289.4132       13.68217 292.2175       16.23121 282.5283       25.43225 154.6304 4.311656 151.6846 6.898352 2.945709       8.134964 
1 1 1 9   9  20 o 203.2947 3.614906 504.4605       17.90850 524.9340       25.51632 484.5854       25.14073 207.2042 5.053397 198.9963 5.188806 8.207901       7.242964 
1 1 1 9   9  21 o 89.13228 2.780733 97.00716       6.032520 94.68899       8.106511 99.88401       9.030660 87.97849 3.790017 90.33271 4.113196 -2.354218      5.593086 
1 1 1 9   9  22 o 233.7263 3.978174 667.4134       22.65831 650.4124       31.26347 686.2242       32.88539 230.4324 5.567465 236.6606 5.702178 -6.228256      7.969411 
1 1 1 9   9  23 o 154.3729 3.185797 290.9352       11.98465 286.8716       16.43912 295.5450       17.50915 153.0914 4.411076 155.3547 4.630091 -2.263245      6.394946 
1 1 1 9   9  24 o 161.2146 3.910370 317.7256       15.36238 320.0939       27.42177 316.6423       18.54598 161.0813 7.002501 160.7463 4.739658 0.3349152      8.455731 
1 1 1 9   9  25 o 141.3042 3.797332 244.3087       13.06399 245.7357       23.70187 243.6861       15.65700 141.0361 6.917407 140.9930 4.562966 0.4306030E-01  8.286808 
1 1 1 9   9  26 f 109.0054 3.006148 145.2416       7.977734 151.3764       10.95279 138.3090       11.64328 111.1423 4.050759 106.1559 4.511140 4.986336       6.062923 
1 1 1 9   9  27 o 26.20734 6.401049 8.805713       4.052243 6.288934       5.350676 12.19068       6.205305 23.31561 7.904450 30.77789 8.147108 -7.462275      11.35146 
1 1 1 9   9  28 o 135.6376 3.217418 224.9599       10.63466 228.1645       14.44804 221.1708       15.71052 136.3318 4.354445 134.1126 4.814935 2.219269       6.491902 
1 1 1 9   9  29 o 129.1362 3.175358 204.0049       9.992559 204.3781       13.59461 203.5662       14.73774 128.9616 4.331985 128.6054 4.710530 0.3562164      6.399624 
1 1 1 9   9  30 o 94.14697 3.171576 108.6135       7.266030 110.1388       9.686384 106.6508       10.98762 94.60319 4.212212 92.93526 4.868602 1.667931       6.437859 
1 1 1 9   9  31 o 79.69666 3.773313 78.16783       7.307418 81.79312       8.412103 67.01994       14.75128 81.41932 4.254519 72.28790 8.538503 9.131424       9.539757 
1 1 1 9   9  32 o 46.62653 4.481747 27.08359       5.029684 32.15814       6.081043 16.09392       8.948946 50.71992 4.984293 34.71682 10.02188 16.00310       11.19291 
1 1 1 9   9  33 o 54.64617 3.772149 36.99458       4.992426 40.26520       6.527993 32.38652       7.748593 56.75180 4.764175 50.29936 6.471332 6.452442       8.035889 
1 1 1 9   9  34 o 20.99329 6.651646 5.599924       3.816102 4.273559       4.794153 7.893566       6.304391 20.01293 7.410044 25.07765 8.578606 -5.064718      11.33584 
1 1 1 9   9  35 o 34.65675 5.226710 15.49689       4.277059 14.26837       5.436600 17.49217       6.928482 32.54340 7.058854 35.63305 8.155687 -3.089653      10.78623 
1 1 1 9   9  36 o 24.38701 7.552421 8.145029       4.948251 9.181808       8.360449 7.586019       6.138982 26.38920 9.782752 24.02513 8.451620 2.364069       12.92796 
1 1 1 9   9  37 o 28.15835 5.998734 10.82793       3.990155 14.54469       5.306207 5.991130       6.053145 32.21495 6.962536 21.91557 8.282761 10.29938       10.82040 
1 1 1 9   9  38 o 22.31312 6.529078 7.097424       3.775112 6.849472       4.881087 7.466533       5.955389 21.92503 7.546774 22.81413 8.289584 -0.8890972     11.21031 
1 1 1 9   9  39 o 24.33896 7.112722 9.044995       4.482713 9.805613       6.579285 8.385966       6.124179 24.42237 8.733786 23.04006 8.401066 1.382313       12.11845 
1 1 1 9   9  40 o 14.84833 6.142022 2.109013       3.621754 3.585040       4.850963 0.2499919      5.444059 17.27958 7.124147 15.25714 6.888802 2.022440       9.910048 
1 1 1 9   9  41 o 13.66265 5.810700 1.504149       3.383361 2.590372       4.489636 0.7652939E-01  5.147042 15.67405 6.680789 14.43038 6.586996 1.243670       9.381975 
1 1 1 9   9  42 f 13.32848 5.916484 0.9437855      3.835485 1.248726       4.604370 0.2524962      6.932544 14.27440 6.399312 15.38491 7.232520 -1.110507      9.657149 
1 1 1 9   9  43 o 12.64824 5.814832 0.2069852      4.107942 1.397127       4.950532 -2.424347      7.361060 14.07665 6.438615 13.94332 6.784367 0.1333303      9.353256 
1 1 1 9   9  44 o 16.01106 6.303254 4.847024       3.610510 1.846200       4.817234 8.693460       5.453893 13.69395 6.296048 18.72549 7.617657 -5.031539      9.882759 
1 1 1 9   9  45 o 10.62708 5.019491 -0.7944704     3.410911 0.9507025      4.490363 -3.175027      5.244469 12.55660 5.876636 11.30564 5.548594 1.250956       8.082187 
1 1 1 9   10 0  o 42.35283 2.674155 21.94568       2.745884 20.55741       3.866739 23.35794       3.900007 40.88189 3.929650 43.62213 3.703770 -2.740242      5.400005 
1 1 1 9   10 1  o 408.0332 6.064712 2029.849       60.30339 2037.688       85.51929 2022.095       85.04642 408.6944 8.586759 407.1285 8.572124 1.565918       12.13317 
1 1 1 9   10 2  o 366.3244 5.520961 1635.928       49.28521 1738.262       72.65747 1548.712       67.07624 377.5052 7.898074 356.3368 7.724527 21.16843       11.04753 
1 1 1 9   10 3  o 164.4088 3.463679 329.4185       13.87710 347.9391       24.07663 320.2052       16.98154 168.8324 5.860879 162.0269 4.304660 6.805573       7.271864 
1 1 1 9   10 4  o 193.5515 3.823563 456.5787       18.03437 417.5692       29.07282 480.9780       22.99272 184.9400 6.460824 198.6414 4.749901 -13.70137      8.018965 
1 1 1 9   10 5  o 352.3296 6.139598 1513.623       52.71390 1552.481       64.90173 1438.298       90.36198 356.7619 7.465203 343.0209 10.82363 13.74103       13.14839 
1 1 1 9   10 6  o 640.4380 18.73183 5037.339       292.0293 0.000000       0.000000 5037.339       292.0293 ?        ?        640.4380 18.73183 0.000000       18.73183 
1 1 1 9   10 7  o 172.6853 6.855823 364.2856       28.79300 0.000000       0.000000 364.2856       28.79300 ?        ?        172.6853 6.855823 0.000000       6.855823 
1 1 1 9   10 8  o 409.5501 8.743467 2047.411       87.26233 2022.413       122.1806 2073.440       124.6722 406.4919 12.34862 411.5782 12.44458 -5.086304      17.53157 
1 1 1 9   10 9  f 223.8452 5.514736 611.0073       30.08213 639.3043       43.44310 584.9409       41.69579 228.7464 7.804894 218.7906 7.833013 9.955841       11.05769 
1 1 1 9   10 10 o 206.6895 5.297395 521.2982       26.65991 560.9554       38.84091 485.9708       36.65923 214.2621 7.450223 199.4008 7.558006 14.86130       10.61269 
1 1 1 9   10 11 o 342.9226 7.558042 1435.628       63.15990 1537.135       92.96333 1348.603       86.07684 354.3216 10.77912 331.8794 10.65696 22.44220       15.15784 
1 1 1 9   10 12 o 174.0553 4.908240 369.7822       20.79770 337.0009       27.94372 410.4915       31.13996 166.0040 6.922831 183.2352 6.986659 -17.23116      9.835599 
1 1 1 9   10 13 o 258.0674 4.874535 812.4023       30.65508 847.4227       55.40966 796.9553       36.79997 263.1055 8.653877 255.5332 5.909680 7.572281       10.47921 
1 1 1 9   10 14 f 347.0790 6.176674 1471.008       52.24192 1531.012       93.75705 1443.989       62.91367 353.1038 10.90905 343.6966 7.511622 9.407196       13.24506 
1 1 1 9   10 15 o 221.9967 3.747243 601.0597       20.27190 596.1058       28.30057 606.2800       29.05179 220.9772 5.255471 222.8473 5.349699 -1.870163      7.499284 
1 1 1 9   10 16 o 28.94983 3.443585 10.36567       2.381814 10.88891       2.824469 9.077639       4.431474 29.60535 4.018649 26.73297 6.790388 2.872379       7.890431 
1 1 1 9   10 17 o 473.2339 9.988312 2755.255       115.1871 2907.401       170.5628 2627.680       156.1838 483.3519 14.49692 459.8464 13.95371 23.50552       20.12130 
1 1 1 9   10 18 o 221.5859 3.773497 599.2252       20.37615 593.0153       28.35988 605.8516       29.29533 220.2644 5.283528 222.6199 5.400057 -2.355484      7.554885 
1 1 1 9   10 19 o 126.4678 2.865782 195.0846       8.832006 181.6555       11.84171 211.9200       13.25875 121.9123 3.991320 131.6724 4.137243 -9.760086      5.748688 
1 1 1 9   10 20 o 182.8759 3.954182 408.3974       17.62176 399.5440       20.77328 431.1177       33.27796 180.7367 4.720572 187.2544 7.306726 -6.517746      8.698968 
1 1 1 9   10 21 o 64.27766 2.823508 50.50197       4.411886 52.41061       5.823769 47.93123       6.758827 65.41348 3.668124 62.46299 4.469846 2.950481       5.782271 
1 1 1 9   10 22 o 142.4290 3.052374 247.5887       10.59430 244.5837       14.50748 251.0223       15.50768 141.3925 4.215167 143.2101 4.449018 -1.817612      6.128736 
1 1 1 9   10 23 o 133.6405 3.010422 218.0072       9.803961 215.5705       13.32596 220.8824       14.47500 132.7225 4.125204 134.3050 4.428784 -1.582489      6.052391 
1 1 1 9   10 24 o 41.46235 3.645896 21.16999       3.646309 21.61724       4.619735 20.43096       5.938410 41.77053 4.615366 40.31111 6.247174 1.459419       7.767161 
1 1 1 9   10 25 o 102.9846 3.651416 129.8206       9.149175 125.0631       16.65296 131.8775       10.94978 100.4984 6.840576 103.7005 4.342610 -3.202095      8.102576 
1 1 1 9   10 26 o 165.9316 3.771266 336.8191       15.24938 310.3177       23.42591 356.3072       20.08850 158.6561 6.070232 170.3770 4.843301 -11.72089      7.765647 
1 1 1 9   10 27 o 84.91623 3.104135 88.24274       6.412627 90.51944       8.320033 84.91114       10.06465 85.88621 3.986132 83.00618 4.998843 2.880028       6.393565 
1 1 1 9   10 28 o 147.4378 3.255847 265.8738       11.69793 256.6820       15.69658 277.3564       17.54387 144.5591 4.461117 150.1793 4.799959 -5.620178      6.552952 
1 1 1 9   10 29 o 77.58937 3.167092 73.77785       5.975651 68.49214       7.695895 81.80324       9.482888 74.57766 4.252241 81.41182 4.801197 -6.834160      6.413505 
1 1 1 9   10 30 o 83.87436 3.169693 86.25011       6.466962 84.34205       8.462284 88.92891       10.02680 82.74414 4.210604 84.81569 4.871706 -2.071548      6.439154 
1 1 1 9   10 31 o 90.49626 3.442329 100.6182       7.577511 98.44759       9.041972 105.7392       13.88808 89.34193 4.164553 91.92128 6.236911 -2.579353      7.499504 
1 1 1 9   10 32 o 36.41936 5.476611 16.85166       4.710159 15.25060       5.176099 24.56275       11.35944 34.35992 6.417735 42.32468 10.93587 -7.964760      12.67993 
1 1 1 9   10 33 o 53.13129 3.810669 35.02494       4.901104 39.42583       6.364011 28.61024       7.683315 56.13504 4.695194 47.00554 6.913926 9.129505       8.357465 
1 1 1 9   10 34 o 19.27054 7.571383 3.212103       5.200397 -0.2110374     8.819045 5.036926       6.439016 20.86605 9.127298 22.22573 8.508670 -1.359678      12.47818 
1 1 1 9   10 35 o 11.38636 5.264362 -2.519800      3.435517 -1.817937      4.251262 -3.840907      5.832577 13.45424 6.079947 14.83358 6.858554 -1.379334      9.165453 
1 1 1 9   10 36 o 27.91384 6.041951 10.51764       3.990490 19.66250       5.305835 -1.391454      6.054865 38.53777 5.831917 16.35920 7.335816 22.17857       9.371524 
1 1 1 9   10 37 o 53.20119 5.006186 36.99819       6.414012 42.79247       11.36969 34.29340       7.768117 53.51561 9.039971 50.06458 6.522110 3.451031       11.14715 
1 1 1 9   10 38 o 20.16265 6.893281 5.683408       4.070502 8.121244       5.561891 2.871666       5.973212 23.30967 8.054504 18.48672 7.784634 4.822945       11.20159 
1 1 1 9   10 39 o 17.94884 6.489167 4.435652       3.643414 5.177335       4.752972 3.378853       5.673519 19.26851 7.326323 18.10262 7.602687 1.165882       10.55821 
1 1 1 9   10 40 o 19.07390 6.504103 5.594179       3.623406 6.588852       4.621065 4.006475       5.838303 20.20920 7.307883 18.01559 7.646394 2.193607       10.57698 
1 1 1 9   10 41 o 29.21975 5.796229 12.99249       3.981457 14.65137       5.265560 10.77789       6.083954 29.16580 7.398394 23.39835 8.394931 5.767445       11.18978 
1 1 1 9   10 42 o 12.29716 5.790888 -1.585712      4.478210 -1.585712      4.478210 0.000000       0.000000 12.29716 5.790888 ?        ?        0.000000       5.790888 
1 1 1 9   10 43 o 13.25534 5.783348 1.803092       3.521080 1.328722       4.775423 2.368233       5.212331 13.80088 6.316713 14.68871 6.675273 -0.8878307     9.190220 
1 1 1 9   10 44 o 15.30002 6.330944 4.344667       3.849716 5.520017       5.566910 3.267434       5.329489 16.05448 7.127144 14.62422 6.685832 1.430260       9.772232 
1 1 1 9   10 45 o 18.17230 6.486113 7.081318       3.626851 8.735987       4.888587 5.055526       5.409103 18.35583 7.300186 15.13434 6.846812 3.221486       10.00857 
1 1 1 9   11 0  o 417.4413 6.209264 2124.657       63.16430 2037.316       122.0956 2156.575       73.80878 408.1881 12.28848 420.5164 7.202596 -12.32828      14.24374 
1 1 1 9   11 1  f 501.3455 7.336452 3065.465       89.63122 2924.359       172.9638 3117.270       104.8006 488.7729 14.53767 505.4806 8.507918 -16.70761      16.84424 
1 1 1 9   11 2  o 125.4329 3.060703 191.7358       9.355536 191.4167       15.82257 191.9074       11.60063 125.2006 5.197327 125.4257 3.799795 -0.2250595     6.438218 
1 1 1 9   11 3  o 520.2014 6.802254 3300.107       86.23040 3304.925       136.4416 3296.903       111.2690 520.2400 10.76235 519.7974 8.784235 0.4425659      13.89212 
1 1 1 9   11 4  o 233.2832 3.459421 663.2471       19.66631 682.9993       31.30586 650.3708       25.27633 236.6906 5.427608 230.9890 4.490417 5.701660       7.044343 
1 1 1 9   11 5  o 833.3424 13.84107 8495.320       281.0795 8274.907       477.3385 8612.313       347.7655 818.8922 23.94585 838.2083 17.02545 -19.31610      29.38145 
1 1 1 9   11 6  o 357.4347 7.788749 1558.778       67.84229 1482.483       92.69411 1646.795       99.56042 348.1795 10.93835 366.9610 11.14640 -18.78152      15.61697 
1 1 1 9   11 7  o 138.2928 4.451554 233.3785       14.98239 255.0752       21.70242 213.6225       20.70907 144.4897 6.177869 132.1873 6.448331 12.30244       8.930120 
1 1 1 9   11 8  o 73.07759 7.044148 65.75653       12.38911 0.000000       0.000000 65.75653       12.38911 ?        ?        73.07759 7.044148 0.000000       7.044148 
1 1 1 9   11 9  o 278.1912 6.423886 944.1073       43.54892 1012.303       63.86889 884.8538       59.53428 287.7425 9.120069 269.0033 9.094910 18.73920       12.87995 
1 1 1 9   11 10 o 302.6857 6.851490 1118.090       50.53742 1177.979       73.44793 1064.242       69.64501 310.2870 9.725604 294.9148 9.703963 15.37219       13.73879 
1 1 1 9   11 11 o 171.7258 4.881049 359.9442       20.40536 375.0992       29.01539 345.1145       28.70222 175.1649 6.810416 167.9882 7.026848 7.176636       9.785620 
1 1 1 9   11 12 o 373.3359 8.144287 1703.534       74.09501 1636.576       101.8722 1778.742       107.9654 365.1958 11.46124 380.6977 11.65145 -15.50189      16.34369 
1 1 1 9   11 13 o 609.4965 12.67940 4566.587       188.3242 4698.179       271.1715 4443.990       261.7400 615.1535 18.10912 598.3520 17.97090 16.80151       25.51262 
1 1 1 9   11 14 o 197.0066 4.895606 473.6388       23.50301 444.4209       34.30727 499.4789       32.26335 190.4997 7.404292 202.0782 6.560394 -11.57849      9.892538 
1 1 1 9   11 15 o 210.4200 5.116642 540.5797       26.23664 555.0249       39.74110 529.4196       34.93097 212.8075 7.675893 207.9511 6.902646 4.856400       10.32307 
1 1 1 9   11 16 o 91.51431 2.599104 102.1888       5.790401 109.9201       8.109459 94.14706       8.270649 94.86205 3.514104 87.75644 3.877018 7.105614       5.232609 
1 1 1 9   11 17 o 105.5996 2.677405 136.0637       6.884339 132.3829       9.343543 140.4349       10.18230 104.0940 3.689239 107.2000 3.904280 -3.105927      5.371582 
1 1 1 9   11 18 o 205.1785 3.594535 513.7492       17.97258 531.3907       25.54072 496.4452       25.29520 208.5154 5.026422 201.4611 5.156654 7.054245       7.201111 
1 1 1 9   11 19 o 253.4219 4.167527 784.3529       25.73704 771.5862       35.76185 798.0697       37.06866 251.0672 5.845127 255.3167 5.957877 -4.249557      8.346365 
1 1 1 9   11 20 o 151.6467 3.078409 280.6001       11.37615 266.6231       15.37599 297.5045       16.90979 147.6630 4.277532 155.9642 4.453711 -8.301224      6.175178 
1 1 1 9   11 21 o 172.8155 3.852547 364.8033       16.22433 348.4973       18.83641 411.6707       31.93457 168.7598 4.584537 182.8797 7.179664 -14.11987      8.518542 
1 1 1 9   11 22 o 38.25574 3.436299 18.01482       3.169396 17.91195       3.922138 18.20841       5.380295 38.03441 4.307387 38.07669 5.996556 -0.4227829E-01 7.383243 
1 1 1 9   11 23 o 80.95007 2.792728 80.07049       5.500866 78.71943       7.269126 81.88098       8.414821 80.17383 3.730835 81.71189 4.240449 -1.538063      5.648056 
1 1 1 9   11 24 o 153.2077 3.579274 286.8654       13.36323 270.6587       20.49832 298.8441       17.62288 148.3718 5.679806 156.1466 4.636492 -7.774765      7.331934 
1 1 1 9   11 25 o 248.1385 4.775542 754.7336       28.87706 713.2090       46.19404 781.3696       36.99700 239.8456 7.914313 252.0351 6.023783 -12.18958      9.945970 
1 1 1 9   11 26 o 150.3032 3.918112 276.6777       14.33873 265.5285       25.13417 282.0570       17.45845 146.3970 7.066113 151.5809 4.732138 -5.183914      8.504298 
1 1 1 9   11 27 o 102.7394 2.990624 129.0988       7.479495 122.2595       9.912091 138.1424       11.39811 99.81409 4.083714 106.0469 4.420303 -6.232841      6.017957 
1 1 1 9   11 28 o 106.3707 3.036653 138.4566       7.863365 147.2064       10.72711 128.2944       11.56055 109.5074 4.026644 102.0901 4.659133 7.417305       6.158034 
1 1 1 9   11 29 o 108.3939 3.079026 143.8601       8.124828 145.9293       10.92100 141.2953       12.15891 108.9621 4.120352 107.0829 4.670725 1.879189       6.228401 
1 1 1 9   11 30 o 64.98212 3.636162 51.96147       5.735055 51.65225       6.809020 52.71640       10.63918 64.65198 4.347086 64.65945 6.856491 -0.7469177E-02 8.118413 
1 1 1 9   11 31 o 147.7801 3.310259 267.9215       11.92104 262.8741       16.03794 274.1532       17.82037 145.8868 4.516686 148.7992 4.921279 -2.912399      6.679779 
1 1 1 9   11 32 o 64.86748 3.884628 52.05305       6.112494 51.81240       6.856250 52.98523       13.49401 64.58500 4.382264 63.47203 8.974183 1.112972       9.987001 
1 1 1 9   11 33 o 25.84618 7.718790 8.785057       5.232308 21.00466       9.654381 3.703233       6.225951 38.85840 10.10281 20.95277 8.268416 17.90563       13.05501 
1 1 1 9   11 34 o 18.10342 6.484416 3.709544       3.628257 5.037036       4.526546 1.323939       6.068065 20.58981 7.256114 18.61031 7.841972 1.979502       10.68399 
1 1 1 9   11 35 o 12.24396 5.500513 -1.300385      3.421423 -0.6699401     4.221805 -2.506773      5.840069 14.22066 6.264650 15.53266 7.061550 -1.311999      9.439879 
1 1 1 9   11 36 o 22.60857 6.507793 7.000337       3.778561 6.784767       4.728508 7.381195       6.285081 22.40240 7.428703 23.61358 8.524867 -1.211178      11.30748 
1 1 1 9   11 37 o 18.95094 7.784915 3.242019       5.765092 0.000000       0.000000 3.242019       5.765092 ?        ?        18.95094 7.784915 0.000000       7.784915 
1 1 1 9   11 38 o 20.50312 6.447172 6.022956       3.591389 4.573484       4.495864 8.578815       5.970033 18.84032 7.134230 23.60501 8.331888 -4.764694      10.96894 
1 1 1 9   11 39 f 14.53659 5.985079 1.877420       3.417583 -1.953565      4.329286 8.212753       5.567315 12.69387 5.883091 22.44913 8.033393 -9.755265      9.957216 
1 1 1 9   11 40 o 33.08175 5.176743 15.66404       4.036584 22.23088       5.396133 7.320461       6.082481 38.67155 5.913647 20.64168 8.164161 18.02987       10.08091 
1 1 1 9   11 41 o 13.23335 5.852090 0.7736631      3.717752 3.969862       4.376803 -7.507343      7.045011 16.65135 6.805153 12.97568 6.380732 3.675670       9.328656 
1 1 1 9   11 42 o 11.70111 5.372758 -0.4343576     3.492166 -1.427294      4.782718 0.6995406      5.110943 12.60796 5.951681 14.06738 6.474080 -1.459426      8.794101 
1 1 1 9   11 43 o 12.45672 5.708940 0.4961842      3.917740 -2.075981      4.733575 6.089711       6.980438 11.82806 5.676777 16.90956 7.700263 -5.081491      9.566601 
1 1 1 9   11 44 o 13.37913 5.798662 2.515909       3.490914 4.813754       4.837286 0.1854204E-01  5.042928 15.50357 6.771168 12.66992 6.019180 2.833646       9.059759 
1 1 1 9   12 0  f 322.6233 4.990241 1268.821       39.23316 1261.937       78.49568 1271.113       45.29691 321.3627 10.03568 322.8896 5.756763 -1.526947      11.56958 
1 1 1 9   12 1  o 861.5521 11.03899 9065.357       231.7645 9385.142       375.3417 8868.297       294.6448 875.0410 17.60201 851.4857 14.19990 23.55524       22.61566 
1 1 1 9   12 2  o 262.2237 3.778825 838.0561       24.14709 796.9939       36.93069 868.7205       31.91420 255.6660 5.927591 266.9521 4.905854 -11.28603      7.694397 
1 1 1 9   12 3  o 352.2140 4.794064 1512.257       41.14779 1442.853       62.94317 1564.053       54.37588 343.9180 7.510306 358.1365 6.230482 -14.21848      9.758258 
1 1 1 9   12 4  o 567.9381 7.399522 3934.821       102.4096 3732.067       155.9197 4088.651       135.8117 552.6366 11.57778 578.6946 9.630562 -26.05804      15.05964 
1 1 1 9   12 5  o 397.7238 5.334966 1928.657       51.70700 1889.793       80.27427 1956.217       67.59821 393.5071 8.371201 400.4651 6.926829 -6.958008      10.86545 
1 1 1 9   12 6  f 129.6103 4.486733 205.0320       14.14981 221.3011       20.28298 189.6078       19.74939 134.5619 6.202164 124.5089 6.531888 10.05297       9.007353 
1 1 1 9   12 7  o 444.8834 9.441660 2417.393       102.3601 2291.678       139.3609 2564.666       150.8373 432.4579 13.23953 457.4539 13.54578 -24.99603      18.94131 
1 1 1 9   12 8  o 211.1416 5.380642 544.0190       27.66241 500.7054       37.13909 597.9904       41.45726 202.4025 7.542922 221.2046 7.702534 -18.80205      10.78076 
1 1 1 9   12 9  o 198.3072 7.468474 480.7551       36.02713 0.000000       0.000000 480.7551       36.02713 ?        ?        198.3072 7.468474 0.000000       7.468474 
1 1 1 9   12 10 o 138.2500 4.600245 233.3349       15.47665 263.7637       22.66363 206.7455       21.18563 146.8775 6.346941 129.9729 6.711595 16.90451       9.237378 
1 1 1 9   12 11 o 125.2561 4.543925 191.5971       13.84668 194.6364       19.30396 188.3760       19.87275 126.1163 6.301108 124.0401 6.598195 2.076218       9.123604 
1 1 1 9   12 12 o 527.2898 15.76994 3436.355       202.4078 3436.355       202.4078 0.000000       0.000000 527.2898 15.76994 ?        ?        0.000000       15.76994 
1 1 1 9   12 13 o 337.0245 10.64380 1395.297       87.30705 1395.297       87.30705 0.000000       0.000000 337.0245 10.64380 ?        ?        0.000000       10.64380 
1 1 1 9   12 14 o 22.70061 8.186829 5.250918       5.794697 4.600612       8.042446 5.952995       8.356448 24.41285 9.466126 25.83773 9.739200 -1.424875      13.58159 
1 1 1 9   12 15 o 141.1264 3.506845 242.9361       12.06038 229.4023       21.93594 248.7995       14.43844 136.7943 6.599874 142.7280 4.155637 -5.933777      7.799209 
1 1 1 9   12 16 f 263.0398 4.986597 845.1814       31.96404 809.8499       55.30618 862.9020       39.16806 256.6351 8.856718 265.6241 6.051017 -8.989044      10.72643 
1 1 1 9   12 17 o 176.0470 3.261984 378.0946       13.99415 397.8475       20.09372 359.4898       19.50103 180.4220 4.573883 171.4867 4.670847 8.935257       6.537371 
1 1 1 9   12 18 o 271.6299 4.403507 901.2628       29.14824 955.6741       42.44487 852.7003       40.09879 279.3576 6.234888 263.8782 6.235794 15.47940       8.818103 
1 1 1 9   12 19 o 229.4965 3.892355 643.1297       21.76830 644.7521       30.54432 641.4551       31.03152 229.5456 5.460412 228.9397 5.562191 0.6059418      7.794489 
1 1 1 9   12 20 o 42.24043 3.090837 21.88921       3.159539 21.31545       3.919217 22.95431       5.339859 41.59285 3.912696 43.00248 5.201219 -1.409630      6.508599 
1 1 1 9   12 21 o 61.79407 3.254992 46.74326       4.884256 45.57096       5.352932 52.57212       11.93613 60.97825 3.618578 64.90362 7.696361 -3.925369      8.504592 
1 1 1 9   12 22 o 182.2596 3.414226 405.6898       15.16417 412.4267       21.17840 398.6021       21.72271 183.5093 4.739829 180.3642 4.946954 3.145187       6.851155 
1 1 1 9   12 23 o 156.5126 3.589121 299.3270       13.68905 298.8877       21.51625 299.6258       17.74323 155.9643 5.670599 156.3691 4.661556 -0.4047852     7.340694 
1 1 1 9   12 24 o 210.4485 3.747221 541.5054       19.21725 533.0637       26.53161 550.8220       27.87255 208.3965 5.228536 211.7884 5.404972 -3.391891      7.520060 
1 1 1 9   12 25 o 74.60001 2.947886 68.07587       5.348472 63.16610       6.816953 75.93771       8.626254 71.74468 3.913924 78.59644 4.522944 -6.851753      5.981289 
1 1 1 9   12 26 o 65.42067 4.073297 52.61349       6.461557 58.93921       12.54524 50.32942       7.538387 68.53719 7.641137 63.85421 4.881550 4.682980       9.067332 
1 1 1 9   12 27 o 143.0883 3.151955 250.3314       10.99057 234.6663       14.67184 270.3612       16.59041 138.2539 4.360281 148.3455 4.594842 -10.09158      6.334400 
1 1 1 9   12 28 f 121.2024 3.045026 179.7691       8.986573 171.1643       11.97047 190.8817       13.60343 118.0396 4.168015 124.5815 4.488169 -6.541840      6.125031 
1 1 1 9   12 29 o 52.77265 3.729354 34.31623       4.765104 33.75443       5.569362 35.85100       9.205261 52.21892 4.418067 53.13969 7.301373 -0.9207726     8.534012 
1 1 1 9   12 30 o 52.80284 3.562098 34.36364       4.556698 33.57577       5.731197 35.71749       7.512871 51.99967 4.569228 53.32874 5.878486 -1.329063      7.445431 
1 1 1 9   12 31 o 41.19116 4.182552 21.12547       4.140229 24.52163       5.148620 14.91041       6.964977 44.25687 4.853432 33.53621 8.509969 10.72065       9.796702 
1 1 1 9   12 32 o 27.97078 7.697240 10.33809       5.411053 19.47299       9.564677 6.038255       6.562125 37.67311 10.17918 23.55909 8.678904 14.11402       13.37681 
1 1 1 9   12 33 o 77.13838 3.691067 73.75491       6.918256 68.90140       7.708383 93.85551       15.68698 74.33577 4.273300 84.76501 7.677451 -10.42924      8.786600 
1 1 1 9   12 34 o 19.44114 6.442867 4.723810       3.556919 5.105749       4.316778 3.916147       6.277369 20.46844 7.094743 20.90604 8.285925 -0.4376011     10.90834 
1 1 1 9   12 35 o 25.50707 6.131610 8.783069       3.764035 10.73021       4.633012 5.002395       6.455791 27.97639 6.851250 21.70393 8.462712 6.272461       10.88839 
1 1 1 9   12 36 o 14.89434 6.261821 1.008774       3.855035 -1.279946      4.978360 4.436581       6.092537 14.76114 6.632881 20.53084 8.154726 -5.769705      10.51164 
1 1 1 9   12 37 o 24.63158 6.287297 8.584208       3.786195 10.02353       4.814294 6.250712       6.129943 26.13183 7.286992 21.72766 8.305929 4.404169       11.04938 
1 1 1 9   12 38 o 16.42774 6.861122 2.262552       4.581935 -2.477264      7.815111 4.745182       5.656012 16.77569 7.818695 19.50423 7.820288 -2.728535      11.05843 
1 1 1 9   12 39 o 13.41108 5.760936 0.9105544      3.386123 0.1578932      4.371028 2.040112       5.354735 14.07011 6.276495 16.47868 7.161579 -2.408576      9.522741 
1 1 1 9   12 40 o 14.44286 6.164886 1.752937       3.832783 2.942690       4.569864 -1.069042      7.038040 16.13186 6.801915 15.58034 7.312695 0.5515175      9.987070 
1 1 1 9   12 41 o 18.82217 6.543064 5.938911       3.672801 5.841498       4.836009 6.071678       5.645750 18.42049 7.281581 18.60797 7.680102 -0.1874790     10.58326 
1 1 1 9   12 42 o 13.33650 5.769700 1.745744       3.443511 8.905828       4.854551 -5.505376      4.885315 20.87325 7.497705 10.89227 5.347643 9.980986       9.209390 
1 1 1 9   12 43 o 23.12096 6.583147 10.11887       3.887022 10.97634       5.364891 9.171358       5.639546 21.39592 7.853217 19.28388 7.781947 2.112038       11.05585 
1 1 1 9   12 44 f 13.59174 5.898831 2.809188       3.622614 5.692642       5.017663 -0.3301629     5.235582 15.97326 6.937299 12.52524 6.000475 3.448015       9.172340 
1 1 1 9   13 0  o 260.6648 4.228447 828.1943       26.85959 800.2316       52.94715 837.8840       31.16775 255.9413 8.500983 262.1690 4.878518 -6.227722      9.801359 
1 1 1 9   13 1  o 503.2062 6.608764 3088.190       81.04055 3103.693       128.1279 3077.852       104.6275 504.1169 10.42981 502.2054 8.549258 1.911530       13.48594 
1 1 1 9   13 2  o 690.2913 8.904908 5816.135       149.7952 5779.980       235.7438 5840.617       193.9924 687.2384 14.07657 691.3347 11.51490 -4.096252      18.18633 
1 1 1 9   13 3  o 562.3398 7.333932 3857.855       100.5013 3722.291       155.1808 3955.795       131.9008 551.8636 11.53905 569.1915 9.509400 -17.32782      14.95254 
1 1 1 9   13 4  o 30.30609 3.510577 11.34430       2.544757 9.782467       3.817486 12.59336       3.413900 27.80491 5.821051 31.82265 4.530072 -4.017738      7.376055 
1 1 1 9   13 5  o 728.9883 10.50994 6493.896       186.7054 6585.230       375.4102 6463.881       215.2081 730.6045 21.10781 726.9484 12.14840 3.656128       24.35411 
1 1 1 9   13 6  o 99.16626 3.144496 119.9756       7.589303 147.5767       15.33850 111.0279       8.733235 109.8521 5.749806 95.36458 3.765359 14.48748       6.873005 
1 1 1 9   13 7  o 599.8929 12.42957 4406.262       181.7047 4270.763       251.3586 4554.573       262.9732 588.9286 17.53391 608.1147 17.76461 -19.18610      24.96035 
1 1 1 9   13 8  o 263.0025 6.203424 843.9620       39.75827 847.0666       56.03147 840.8138       56.42395 263.1629 8.749344 262.1778 8.844099 0.9850769      12.44062 
1 1 1 9   13 9  o 211.8740 7.624403 548.9706       39.30167 548.9706       39.30167 0.000000       0.000000 211.8740 7.624403 ?        ?        0.000000       7.624403 
1 1 1 9   13 10 o 613.3413 18.15610 4658.857       271.0706 4658.857       271.0706 0.000000       0.000000 613.3413 18.15610 ?        ?        0.000000       18.15610 
1 1 1 9   13 11 o 154.3820 6.688560 291.6516       25.10347 291.6516       25.10347 0.000000       0.000000 154.3820 6.688560 ?        ?        0.000000       6.688560 
1 1 1 9   13 12 o 288.9012 6.671628 1019.820       46.96964 1048.338       67.35949 992.8317       65.52856 292.3472 9.467531 284.4949 9.465098 7.852356       13.38739 
1 1 1 9   13 13 o 249.5901 6.042428 761.0670       36.75149 803.1613       53.30610 722.9310       50.73787 255.9150 8.559662 242.7763 8.589634 13.13869       12.12640 
1 1 1 9   13 14 o 188.4437 5.189315 434.0085       23.80752 477.5910       34.91720 396.1453       32.54560 197.4025 7.270988 179.7328 7.446817 17.66969       10.40780 
1 1 1 9   13 15 o 577.0921 12.13853 4117.111       170.7054 3950.269       234.5150 4305.140       248.9598 561.0097 17.17418 585.3896 17.47167 -24.37988      24.49921 
1 1 1 9   13 16 o 175.8951 3.870447 377.6113       16.59018 407.2329       31.65448 366.3934       19.47991 182.1578 7.144872 173.1396 4.621075 9.018188       8.509027 
1 1 1 9   13 17 o 324.1208 5.041453 1284.112       39.81977 1278.398       56.04461 1289.937       56.58661 322.8880 7.122720 324.3313 7.159599 -1.443359      10.09916 
1 1 1 9   13 18 o 127.0266 2.867185 196.8280       8.875370 204.4745       12.50732 189.0720       12.59649 129.3427 3.972845 124.3517 4.162692 4.990967       5.754259 
1 1 1 9   13 19 o 159.6347 3.172918 310.9746       12.34304 320.2639       17.48199 301.7411       17.42951 161.8230 4.437362 157.0536 4.558909 4.769348       6.361905 
1 1 1 9   13 20 o 258.0428 4.252418 813.8307       26.74014 829.6171       37.92776 798.2286       37.70576 260.1399 5.982933 255.1500 6.064234 4.989914       8.518827 
1 1 1 9   13 21 o 71.00713 2.736300 61.61233       4.725940 61.30191       6.246692 62.02781       7.226928 70.74940 3.635381 71.10909 4.189100 -0.3596954     5.546580 
1 1 1 9   13 22 f 96.28281 3.808169 113.4763       8.917511 116.6503       10.73259 106.3993       16.02574 97.53041 4.528092 92.68113 7.150887 4.849281       8.463971 
1 1 1 9   13 23 o 88.15407 2.826256 94.96136       6.063569 89.67255       7.977758 102.1961       9.330667 85.55544 3.836217 91.29810 4.205163 -5.742661      5.692096 
1 1 1 9   13 24 o 141.5704 3.102577 244.8157       10.70363 237.9624       14.42700 253.2069       15.96385 139.3577 4.253218 143.6957 4.564664 -4.338043      6.239072 
1 1 1 9   13 25 o 19.21857 5.457073 4.653384       2.674623 5.685201       3.173676 2.124370       4.968631 21.19268 5.918978 18.38413 7.343721 2.808558       9.432101 
1 1 1 9   13 26 o 124.6095 3.004799 189.7479       9.124366 192.9963       12.40422 185.9178       13.46906 125.4556 4.062714 123.0422 4.499653 2.413376       6.062386 
1 1 1 9   13 27 o 52.43317 4.545815 34.00157       5.751036 25.53870       10.93951 37.23378       6.760657 44.07544 10.36097 54.78166 5.123723 -10.70622      11.55864 
1 1 1 9   13 28 o 60.64011 3.424365 45.16800       5.039736 44.09213       5.986345 47.78609       9.338425 59.80083 4.133316 61.80871 6.287368 -2.007877      7.524313 
1 1 1 9   13 29 o 52.95372 3.448370 34.51270       4.425657 34.23877       5.454362 35.04060       7.571768 52.59752 4.292723 52.83586 5.986089 -0.2383423     7.366189 
1 1 1 9   13 30 o 59.26922 3.312005 43.21653       4.764588 44.69942       5.998801 40.68243       7.841883 60.12537 4.119098 56.95292 5.727962 3.172443       7.055247 
1 1 1 9   13 31 o 91.75029 3.966432 103.9602       8.847416 127.3788       16.49626 94.50377       10.48260 100.3306 6.787029 87.14043 4.956879 13.19013       8.404428 
1 1 1 9   13 32 o 44.18134 3.929729 24.31293       4.186846 24.13109       5.148445 24.66803       7.194526 43.74978 4.913926 43.51643 7.023507 0.2333488      8.571833 
1 1 1 9   13 33 o 62.38282 3.882423 48.46290       5.872810 46.72547       6.529485 55.82067       13.43689 61.05627 4.418354 64.29370 8.807442 -3.237434      9.853572 
1 1 1 9   13 34 o 61.00085 3.624388 46.42264       5.363452 55.41796       6.996955 33.60663       8.351745 66.33543 4.352443 50.25512 7.010139 16.08031       8.251412 
1 1 1 9   13 35 o 13.68240 5.984000 -0.3103359     3.789315 -0.2332571E-01 5.067811 -0.6742731     5.706700 15.91531 6.941187 16.34124 7.237267 -0.4259262     10.02787 
1 1 1 9   13 36 o 38.08142 4.671613 18.90038       4.244559 23.44416       5.501222 12.21622       6.672278 41.96141 5.513120 28.45151 8.762845 13.50990       10.35287 
1 1 1 9   13 37 o 35.18716 4.897273 16.53793       4.085637 15.85778       5.188607 17.64783       6.628105 33.29209 6.628559 33.92783 8.124269 -0.6357460     10.48530 
1 1 1 9   13 38 o 26.56907 7.309731 10.99660       4.880610 10.73904       9.109588 11.10029       5.780205 24.66754 9.912900 25.99215 8.180000 -1.324606      12.85216 
1 1 1 9   13 39 o 14.25417 6.049634 1.543153       3.654229 2.430927       4.213955 -1.148649      7.337709 15.65789 6.562521 16.12451 7.535289 -0.4666157     9.992360 
1 1 1 9   13 40 o 12.87964 5.606924 0.8257363      3.293876 5.940070       4.479248 -5.196436      4.860569 18.99755 7.136967 11.45072 5.558041 7.546834       9.045890 
1 1 1 9   13 41 o 12.95734 5.735804 0.8613861      3.580210 3.770333       4.806394 -2.764474      5.366078 16.29750 6.928295 12.75740 6.101763 3.540097       9.232160 
1 1 1 9   13 42 o 14.93587 6.220392 3.331793       3.750508 7.585503       5.383482 -0.6797228     5.227976 18.81211 7.599064 13.13675 6.207711 5.675360       9.812311 
1 1 1 9   13 43 o 13.67531 5.929364 2.562684       3.652982 5.522992       5.483875 0.2012673      4.897848 16.25139 7.150289 12.85259 6.053584 3.398806       9.368698 
1 1 1 9   13 44 o 16.70017 6.817215 6.357981       4.386103 8.762551       5.437940 1.881298       7.419829 18.02543 7.497242 14.11935 6.856556 3.906077       10.15977 
1 1 1 9   14 0  o 155.7553 2.777476 295.6455       10.54215 302.5690       16.54812 290.9163       13.67665 157.4891 4.315904 154.4945 3.632708 2.994598       5.641240 
1 1 1 9   14 1  o 281.9824 4.512964 969.3177       31.01129 921.3484       60.36108 986.5198       36.14656 274.5636 9.033783 284.4498 5.214652 -9.886200      10.43081 
1 1 1 9   14 2  o 347.6786 4.760703 1473.710       40.33529 1474.793       63.49649 1472.977       52.22629 347.6584 7.494814 347.5244 6.166913 0.1340027      9.705826 
1 1 1 9   14 3  o 264.8167 3.827710 854.8056       24.70133 861.2084       38.89418 850.4774       31.97842 265.7302 6.006308 264.1098 4.968627 1.620422       7.795062 
1 1 1 9   14 4  o 690.1990 8.917318 5817.618       149.9839 5537.536       229.0065 6027.992       198.4736 672.2646 13.97885 702.0139 11.60168 -29.74921      18.16610 
1 1 1 9   14 5  o 61.14771 2.469301 45.64108       3.671945 41.41362       5.228627 49.75498       5.157924 58.16970 3.707844 63.80446 3.328836 -5.634766      4.982896 
1 1 1 9   14 6  o 248.3763 3.958887 752.0718       23.96179 702.8601       33.09846 806.2700       34.73494 240.0455 5.658198 257.1040 5.543979 -17.05852      7.921546 
1 1 1 9   14 7  o 301.0957 9.634887 1109.664       70.60376 1109.664       70.60376 0.000000       0.000000 301.0957 9.634887 ?        ?        0.000000       9.634887 
1 1 1 9   14 8  o 289.9320 9.380490 1029.189       66.18899 1029.189       66.18899 0.000000       0.000000 289.9320 9.380490 ?        ?        0.000000       9.380490 
1 1 1 9   14 9  o 399.0104 8.630236 1946.982       83.91566 2119.449       124.8554 1804.888       113.3294 415.3359 12.34964 383.3009 12.14830 32.03506       17.32324 
1 1 1 9   14 10 o 178.0467 4.996930 387.0972       21.65925 398.6126       30.55808 375.4716       30.70406 180.4951 6.960482 175.1425 7.209375 5.352631       10.02115 
1 1 1 9   14 11 o 192.6678 5.216972 453.4167       24.47169 490.3357       35.73763 420.8221       33.57951 200.1276 7.340387 185.3658 7.448930 14.76181       10.45791 
1 1 1 9   14 12 o 299.6398 6.887976 1097.795       50.29528 1111.960       71.46230 1083.893       70.79887 300.8842 9.759248 297.0502 9.793872 3.834015       13.82617 
1 1 1 9   14 13 o 106.0731 4.595561 137.5965       11.85081 134.5987       16.44273 140.8369       17.09549 104.7187 6.475047 107.1142 6.581123 -2.395531      9.232411 
1 1 1 9   14 14 o 208.7528 5.477538 532.8906       27.84059 556.6013       40.20624 511.0494       38.58865 212.9673 7.760171 204.0521 7.774590 8.915115       10.98474 
1 1 1 9   14 15 o 351.9621 7.857216 1519.646       67.39082 1686.904       101.6012 1388.256       90.05075 369.3289 11.30215 335.1268 11.04169 34.20215       15.80055 
1 1 1 9   14 16 o 232.7444 3.904801 661.2635       22.14697 671.1705       46.91790 658.4232       25.12193 233.5854 8.255439 232.1806 4.440082 1.404785       9.373718 
1 1 1 9   14 17 o 101.6218 2.641654 126.0312       6.536277 138.2347       16.35446 123.7113       7.130520 106.0397 6.358148 100.6642 2.909820 5.375534       6.992360 
1 1 1 9   14 18 f 146.8600 3.658635 263.3098       13.09359 232.5271       23.01998 278.0317       15.91962 137.4960 6.892324 150.7878 4.336922 -13.29182      8.143281 
1 1 1 9   14 19 o 192.3805 3.510484 451.8655       16.45751 461.8582       23.42559 442.1267       23.12617 194.2389 4.953051 190.0336 4.998209 4.205292       7.036676 
1 1 1 9   14 20 o 40.93115 3.371202 20.59346       3.332814 15.68878       4.364434 27.45430       5.161921 35.42347 5.211552 47.16294 4.547650 -11.73948      6.916748 
1 1 1 9   14 21 o 178.3131 3.391566 388.3191       14.73736 408.8827       21.08928 368.6932       20.60278 182.7095 4.740580 173.4646 4.878772 9.244904       6.802611 
1 1 1 9   14 22 o 54.58698 3.523821 36.55780       4.662432 37.45753       5.162018 32.57291       10.86358 55.21995 3.860393 50.49099 9.166749 4.728958       9.946453 
1 1 1 9   14 23 o 35.47551 3.865607 15.57149       3.287822 13.32583       3.893933 21.14820       6.136280 32.58883 5.067890 40.99014 6.348200 -8.401306      8.123001 
1 1 1 9   14 24 o 176.4963 3.402776 380.7621       14.63542 374.4702       20.11307 387.8427       21.33626 174.7121 4.728447 177.7540 4.930404 -3.041870      6.831332 
1 1 1 9   14 25 o 44.41948 3.438898 24.27096       3.693479 26.56860       4.709936 20.60144       5.952211 46.38242 4.212935 40.42374 6.243249 5.958675       7.531732 
1 1 1 9   14 26 o 118.2706 3.309305 171.2141       9.528455 178.5600       11.84078 157.7168       16.05032 120.6510 4.032961 112.9582 5.850759 7.692780       7.106065 
1 1 1 9   14 27 o 76.55759 4.545258 72.24548       8.441580 68.77650       13.95474 74.24752       10.60124 73.84117 7.876555 77.37256 5.661750 -3.531387      9.700286 
1 1 1 9   14 28 o 49.40138 3.335949 30.01945       3.992458 32.25320       5.117220 26.54448       6.382527 51.08786 4.145966 45.97444 5.827662 5.113415       7.151971 
1 1 1 9   14 29 o 82.73852 2.964803 83.91674       5.968114 79.00792       7.811508 90.80002       9.250053 80.07558 4.015939 85.75392 4.441572 -5.678337      5.987932 
1 1 1 9   14 30 o 71.73512 4.197061 63.63997       7.304860 80.16357       13.77365 57.17352       8.616471 79.47276 7.189741 67.68916 5.265031 11.78361       8.911393 
1 1 1 9   14 31 o 63.84293 3.227451 50.21568       5.004924 51.04259       6.430003 48.94457       7.972095 64.14327 4.135658 62.45255 5.287904 1.690720       6.713091 
1 1 1 9   14 32 o 51.51771 3.591944 32.93449       4.481189 31.99735       5.520883 34.74415       7.671923 50.50600 4.533885 52.03749 6.169872 -1.531494      7.656594 
1 1 1 9   14 33 o 62.36042 3.433290 48.27212       5.197285 50.01041       6.524373 45.25363       8.597476 63.16542 4.263588 59.24685 6.039182 3.918571       7.392557 
1 1 1 9   14 34 o 25.40417 6.871677 8.803955       4.355967 11.90276       4.908543 -2.681526      9.449956 29.50879 6.942692 19.79277 8.992172 9.716021       11.36046 
1 1 1 9   14 35 o 33.66503 4.807278 14.76556       3.831927 17.09862       4.666749 9.937041       6.713655 35.93101 5.504887 26.31876 8.854271 9.612251       10.42602 
1 1 1 9   14 36 o 51.22959 3.657194 33.36006       4.535645 35.17092       5.762085 30.41039       7.354022 51.99923 4.594447 46.78643 6.636107 5.212795       8.071360 
1 1 1 9   14 37 o 28.65526 5.474374 11.37454       3.683399 11.90678       4.673884 10.50218       5.983703 28.42675 6.832066 25.72456 8.347235 2.702192       10.78673 
1 1 1 9   14 38 o 10.92576 5.094527 -2.113864      3.324051 -3.528796      3.787253 2.632394       6.936371 10.91022 5.192597 18.23800 8.032363 -7.327783      9.564618 
1 1 1 9   14 39 o 23.76954 7.630678 9.756643       5.009061 15.11742       9.611063 7.757506       5.869199 25.57832 10.21498 21.11079 8.112897 4.467527       13.04473 
1 1 1 9   14 40 o 14.54574 5.956469 2.481770       3.361507 2.433994       4.352655 2.552377       5.291450 15.25837 6.542626 15.98293 7.028243 -0.7245684     9.602196 
1 1 1 9   14 41 o 10.95392 5.118209 -1.340598      3.383217 -4.071667      4.421241 2.518113       5.255318 10.97820 5.322163 15.34643 6.861485 -4.368231      8.683628 
1 1 1 9   14 42 o 20.70968 6.529341 8.033249       3.681198 11.10386       5.126804 4.765297       5.288982 22.39351 7.733277 16.20928 7.079802 6.184231       10.48462 
1 1 1 9   14 43 o 12.49222 5.560325 1.483302       3.410911 4.852586       4.769885 -2.042614      4.879496 15.66417 6.783623 11.70140 5.653036 3.962772       8.830309 
1 1 1 9   15 0  o 297.9415 4.678459 1082.266       33.96799 1040.554       46.82904 1128.581       49.34570 292.0562 6.579801 304.1545 6.657620 -12.09830      9.360432 
1 1 1 9   15 1  o 150.1279 3.561084 274.7189       13.02806 251.8647       22.10364 286.8850       16.12711 143.5513 6.334189 153.3421 4.320084 -9.790741      7.667143 
1 1 1 9   15 2  o 484.8517 7.135537 2868.763       84.30855 2903.345       120.1248 2835.192       118.3555 487.3859 10.11401 481.6359 10.08401 5.750031       14.28218 
1 1 1 9   15 3  o 288.7448 5.232558 1016.761       36.81835 942.8270       60.16847 1061.017       46.55136 277.6743 8.903463 294.8925 6.477877 -17.21817      11.01066 
1 1 1 9   15 4  o 401.3938 6.012778 1965.599       58.81417 1926.704       82.02461 2006.758       84.37685 397.1557 8.475147 405.3145 8.542697 -8.158813      12.03353 
1 1 1 9   15 5  o 378.0933 5.708634 1743.983       52.59776 1638.287       71.38445 1869.523       77.79758 366.2386 7.998405 391.2126 8.160508 -24.97403      11.42665 
1 1 1 9   15 6  o 518.9392 7.604727 3289.216       96.16924 3291.973       135.9325 3286.453       136.0753 518.5283 10.75758 518.0886 10.77803 0.4397583      15.22798 
1 1 1 9   15 7  o 349.9761 6.109581 1494.999       52.10579 1687.424       99.91335 1423.113       61.06777 370.9191 11.06609 341.3263 7.341862 29.59274       13.28011 
1 1 1 9   15 8  o 152.1596 4.673540 282.6884       17.30877 278.4327       23.86314 287.4132       25.14361 150.8609 6.506343 153.2558 6.749027 -2.394821      9.374533 
1 1 1 9   15 9  o 256.8209 6.125250 805.4205       38.33455 807.7818       53.84483 802.9935       54.58931 256.7784 8.617177 255.9915 8.763686 0.7869263      12.29056 
1 1 1 9   15 10 o 48.67728 5.590288 29.30922       6.511050 31.57705       8.933015 26.73893       9.510084 50.26575 7.523748 45.96730 8.810394 4.298458       11.58576 
1 1 1 9   15 11 o 303.2747 6.937645 1124.755       51.27248 1171.965       74.11240 1081.418       71.00769 308.8492 9.859732 296.6722 9.835425 12.17703       13.92659 
1 1 1 9   15 12 o 191.5894 5.249808 448.6491       24.48734 429.6712       33.85820 469.4626       35.45780 187.1939 7.437061 195.6808 7.449402 -8.486893      10.52632 
1 1 1 9   15 13 o 127.7447 4.745871 199.5454       14.74820 185.5046       20.65851 214.1395       21.06154 122.9082 6.925360 132.1313 6.561591 -9.223099      9.540182 
1 1 1 9   15 14 o 165.3168 4.966184 334.1945       19.98404 320.6732       27.65784 348.9648       28.90693 161.6405 7.038404 168.6310 7.049973 -6.990463      9.961989 
1 1 1 9   15 15 o 116.9060 4.600626 167.2073       13.08101 182.0983       18.96863 153.7039       18.06323 121.7817 6.414340 111.8214 6.658950 9.960289       9.245831 
1 1 1 9   15 16 o 127.0991 3.417521 197.2739       10.57536 163.0164       18.97104 212.7189       12.73815 115.1225 6.792491 131.9339 3.966499 -16.81133      7.865815 
1 1 1 9   15 17 o 105.5865 2.668880 136.0644       6.861598 144.6620       16.94302 134.3777       7.504549 108.4509 6.439931 104.9111 2.938293 3.539856       7.078579 
1 1 1 9   15 18 o 157.1499 3.510006 301.5019       13.44182 326.0123       22.73594 288.3309       16.66656 163.0466 5.731141 153.5221 4.459634 9.524445       7.261839 
1 1 1 9   15 19 o 35.80507 3.799296 15.83512       3.264465 19.33443       4.831891 12.89660       4.427830 39.41236 5.154326 31.93575 5.907068 7.476612       7.839677 
1 1 1 9   15 20 o 91.43367 2.755146 102.1070       6.131845 101.6255       8.441921 102.6448       8.921409 91.11842 3.810294 91.55290 4.008474 -0.4344788     5.530480 
1 1 1 9   15 21 o 110.0388 2.860641 147.8958       7.664376 141.9174       10.39753 155.0098       11.34209 107.6678 3.969652 112.5077 4.143980 -4.839920      5.738528 
1 1 1 9   15 22 o 86.23488 3.356713 90.98859       7.040492 93.59791       8.029268 82.30840       14.64458 87.41639 3.778101 81.32258 7.473246 6.093811       8.373975 
1 1 1 9   15 23 o 99.98212 3.422079 122.3181       8.325453 124.8888       9.564533 114.2799       16.91285 100.9659 3.894646 95.91236 7.290749 5.053574       8.265790 
1 1 1 9   15 24 o 170.1030 3.343129 353.7031       13.85802 354.8865       19.27737 352.4375       19.93561 170.0664 4.655883 169.4322 4.833275 0.6341858      6.711021 
1 1 1 9   15 25 o 58.31473 3.291855 41.71214       4.658949 37.91473       5.546128 50.81623       8.587447 55.47727 4.132082 64.02414 5.559120 -8.546871      6.926609 
1 1 1 9   15 26 o 129.1244 3.047142 203.8582       9.588199 191.2989       12.84943 219.6372       14.40263 124.8133 4.230727 133.7003 4.426620 -8.887024      6.123236 
1 1 1 9   15 27 o 119.8586 3.031351 175.8308       8.846937 178.4362       12.10489 172.8435       12.96196 120.5143 4.127887 118.5170 4.496161 1.997253       6.103681 
1 1 1 9   15 28 o 113.6091 3.744296 158.5387       10.35204 145.9738       18.68740 164.1015       12.43421 107.8623 7.149920 115.4032 4.429669 -7.540886      8.410906 
1 1 1 9   15 29 o 42.58387 5.424120 22.82519       5.501157 28.90113       10.59265 20.58122       6.437344 46.66736 9.633823 40.02609 6.845599 6.641266       11.81832 
1 1 1 9   15 30 o 45.85100 3.726622 26.04311       4.128031 21.39937       5.191142 34.03037       6.808131 41.16725 5.297215 52.01480 5.452038 -10.84755      7.601658 
1 1 1 9   15 31 o 30.63217 5.016445 11.98236       3.615138 10.78117       4.367661 14.59566       6.442231 28.67308 6.411869 33.00088 8.077312 -4.327793      10.31286 
1 1 1 9   15 32 o 63.73608 3.285662 50.26001       5.085996 56.23256       6.585229 41.43070       8.006710 67.17035 4.041764 56.89893 5.858110 10.27142       7.117114 
1 1 1 9   15 33 o 21.49069 6.367656 6.096083       3.571944 6.668010       4.296489 4.816123       6.427492 22.49972 7.048424 21.76358 8.455948 0.7361355      11.00833 
1 1 1 9   15 34 o 18.02502 6.381407 3.902932       3.504171 7.440073       3.757624 -19.69537      9.705712 23.39265 6.405145 14.53161 7.208297 8.861045       9.642895 
1 1 1 9   15 35 o 30.70447 4.971663 12.44396       3.592879 15.28361       4.371040 6.528978       6.308545 33.82943 5.490222 22.52031 8.467835 11.30911       10.09192 
1 1 1 9   15 36 o 13.22962 5.561160 0.8384807      3.039920 -1.431262      3.559919 6.950229       5.841636 12.10684 5.507680 22.21252 8.187603 -10.10567      9.867694 
1 1 1 9   15 37 o 10.91613 5.085331 -2.208862      3.299866 -1.229363      3.741598 -5.637923      7.000721 12.39215 5.640976 14.57592 6.970976 -2.183767      8.967448 
1 1 1 9   15 38 o 18.77538 6.337884 5.263382       3.439813 12.93478       4.455961 -6.049994      5.411283 29.18571 6.438276 12.14143 5.886534 17.04428       8.723685 
1 1 1 9   15 39 o 16.32436 6.813668 3.199342       4.514579 4.132909       8.813000 2.867203       5.256673 18.90452 8.625457 16.51817 7.137384 2.386353       11.19557 
1 1 1 9   15 40 o 38.89158 5.227994 22.37513       4.829428 25.14314       5.681803 15.16945       9.167262 40.22015 5.978609 23.92972 9.822034 16.29042       11.49853 
1 1 1 9   15 41 o 13.62526 5.856665 1.987376       3.503792 1.730575       4.740258 2.296654       5.202102 14.31274 6.448336 14.95804 6.745674 -0.6453037     9.331943 
1 1 1 9   15 42 o 12.25741 5.508200 0.9300812      3.433847 4.275705       4.660313 -3.043770      5.079049 15.57374 6.724789 11.68682 5.674717 3.886925       8.799159 
1 1 1 9   15 43 o 10.41100 5.024621 -2.343064      3.831491 -12.37941      5.458840 7.402329       5.379132 9.289917 4.710973 17.26105 7.333373 -7.971130      8.716170 
1 1 1 9   16 0  o 456.6773 6.068507 2544.345       67.53477 2532.393       106.0001 2552.512       87.62048 455.1766 9.556308 457.2128 7.864139 -2.036163      12.37609 
1 1 1 9   16 1  o 127.6493 2.632660 198.5871       8.189349 194.0587       12.49188 202.0001       10.84494 126.0982 4.070541 128.6834 3.461488 -2.585220      5.343333 
1 1 1 9   16 2  f 129.9947 3.447156 206.1373       10.91036 206.6295       19.17358 205.9017       13.26784 129.9933 6.069414 129.8842 4.197382 0.1090546      7.379417 
1 1 1 9   16 3  o 338.8614 4.674095 1400.334       38.59720 1434.246       61.54331 1378.348       49.55383 342.7166 7.369018 336.0911 6.050400 6.625519       9.534661 
1 1 1 9   16 4  o 78.94666 2.519318 76.03873       4.840571 67.45762       6.979349 83.99219       6.719259 74.28218 3.868955 82.93970 3.331250 -8.657524      5.105491 
1 1 1 9   16 5  o 131.5004 3.066640 210.7912       9.827111 221.0173       20.19273 207.6176       11.24913 134.4200 6.181005 130.4491 3.541963 3.970917       7.123926 
1 1 1 9   16 6  f 454.5458 6.740764 2523.342       74.66601 2537.451       105.6912 2509.285       105.4964 455.2855 9.526183 452.7436 9.562015 2.541870       13.49742 
1 1 1 9   16 7  o 464.1510 6.124389 2630.553       69.27206 2519.873       106.5539 2711.575       91.16695 453.5711 9.640239 470.9039 7.944545 -17.33282      12.49200 
1 1 1 9   16 8  o 106.5053 3.210505 138.4279       8.323089 164.4142       16.76194 129.9241       9.588703 115.8815 5.955706 103.1443 3.821465 12.73719       7.076301 
1 1 1 9   16 9  o 479.7693 10.18616 2825.061       119.0910 2663.215       161.6924 3016.957       176.0641 463.9766 14.31784 493.6821 14.65103 -29.70557      20.48544 
1 1 1 9   16 10 o 140.7072 4.632419 241.9048       15.86236 256.4552       22.62120 227.8293       22.24896 144.6999 6.431285 136.3347 6.717482 8.365219       9.299785 
1 1 1 9   16 11 o 304.2458 6.960851 1132.732       51.60871 1116.183       72.18941 1150.031       73.80901 301.2106 9.848073 305.7268 9.920077 -4.516205      13.97829 
1 1 1 9   16 12 o 272.4250 6.442357 908.0120       42.76887 841.4719       57.66178 989.3875       63.76656 261.5747 9.059668 283.6079 9.238862 -22.03314      12.93963 
1 1 1 9   16 13 o 297.1004 6.870368 1081.094       49.74155 1148.597       72.80000 1021.986       68.12304 305.2685 9.798878 287.9607 9.721826 17.30774       13.80333 
1 1 1 9   16 14 o 69.82786 7.229434 60.41101       12.12408 0.000000       0.000000 60.41101       12.12408 ?        ?        69.82786 7.229434 0.000000       7.229434 
1 1 1 9   16 15 o 89.75501 4.760714 98.72179       10.37554 95.84306       14.77597 101.5218       14.57260 88.14740 6.934569 90.78233 6.632954 -2.634933      9.596058 
1 1 1 9   16 16 o 146.5694 3.340340 262.1685       11.93081 0.000000       0.000000 262.1685       11.93081 ?        ?        146.5694 3.340340 0.000000       3.340340 
1 1 1 9   16 17 o 105.0742 2.952764 134.8140       7.553187 0.000000       0.000000 134.8140       7.553187 ?        ?        105.0742 2.952764 0.000000       2.952764 
1 1 1 9   16 18 o 52.96624 2.788568 34.32305       3.586607 32.09145       10.93967 34.59181       3.796442 50.18005 9.288168 53.16154 2.941982 -2.981491      9.742963 
1 1 1 9   16 19 o 100.1644 2.380152 122.3773       5.809704 120.6770       9.534916 123.3812       7.326851 99.29475 3.948401 100.4985 2.995068 -1.203728      4.955835 
1 1 1 9   16 20 o 147.5448 3.109930 265.7865       11.18177 276.9919       15.98613 255.0527       15.64617 150.4127 4.365988 144.3136 4.454356 6.099121       6.237238 
1 1 1 9   16 21 o 110.8189 3.495269 150.2035       9.427293 152.1865       11.01146 144.7603       18.24332 111.4754 4.060281 108.1822 6.956971 3.293144       8.055143 
1 1 1 9   16 22 o 82.26686 2.856647 82.73230       5.718184 78.96026       7.668687 87.45583       8.581560 80.24821 3.933461 84.43128 4.183904 -4.183075      5.742575 
1 1 1 9   16 23 o 93.95573 3.930761 108.2091       8.979985 108.2091       8.979985 0.000000       0.000000 93.95573 3.930761 ?        ?        0.000000       3.930761 
1 1 1 9   16 24 o 57.28336 3.329778 40.25372       4.628110 36.79527       5.647490 47.32577       8.075840 54.63386 4.275912 61.81102 5.416168 -7.177162      6.900601 
1 1 1 9   16 25 o 129.8668 3.043417 206.1665       9.631536 198.1069       13.05767 215.7844       14.26427 127.0430 4.223601 132.5498 4.422245 -5.506828      6.115150 
1 1 1 9   16 26 o 18.75009 5.760332 4.343591       2.885456 1.898176       3.529147 9.274586       5.011419 15.95419 6.246502 26.87787 7.411892 -10.92368      9.693036 
1 1 1 9   16 27 o 94.19101 2.951993 108.6404       6.767440 115.4873       9.335476 101.0575       9.824448 96.92636 3.960721 90.54771 4.466185 6.378647       5.969432 
1 1 1 9   16 28 o 139.5237 3.860489 239.3220       13.11320 246.6529       24.37634 236.3365       15.55581 140.1417 7.161556 138.3847 4.619313 1.757034       8.522086 
1 1 1 9   16 29 o 71.60847 3.074260 62.98832       5.352151 61.51265       7.134558 64.88760       8.094090 70.52374 4.170023 72.31987 4.616875 -1.796127      6.221304 
1 1 1 9   16 30 o 45.52528 3.660655 25.69363       4.026927 25.04425       5.180781 26.68479       6.400560 44.65797 4.837749 45.80562 5.868724 -1.147644      7.605639 
1 1 1 9   16 31 o 51.17533 3.955323 32.62350       4.894376 36.64809       6.841525 28.40460       7.004747 53.81449 5.285060 46.94674 6.280200 6.867752       8.208093 
1 1 1 9   16 32 o 29.64132 5.276453 11.39783       3.671597 12.14617       4.578521 10.04956       6.145607 30.24562 6.411246 27.25735 8.412513 2.988277       10.57707 
1 1 1 9   16 33 o 27.83862 5.546733 10.24528       3.630695 12.38636       4.380444 5.546299       6.489374 30.45530 6.114911 22.31709 8.542319 8.138206       10.50540 
1 1 1 9   16 34 o 33.80523 4.789006 14.86558       3.834852 15.34747       4.673441 13.87235       6.709493 33.84557 5.879520 30.75441 8.612250 3.091158       10.42783 
1 1 1 9   16 35 o 14.01942 5.941584 0.7653653      3.516437 0.5843165      3.821189 1.766513       8.985659 14.32015 6.135058 20.66326 9.119646 -6.343107      10.99122 
1 1 1 9   16 36 o 16.79073 6.275470 3.432020       3.453836 3.647998       3.962560 2.749149       7.045956 17.45676 6.676849 19.15748 8.270499 -1.700716      10.62927 
1 1 1 9   16 37 o 46.06778 3.927664 27.84877       4.367268 35.94962       5.940063 18.31790       6.443055 51.51575 4.786424 33.69676 7.971785 17.81899       9.298344 
1 1 1 9   16 38 f 21.49145 6.329827 7.179969       3.538348 15.47545       4.662838 -4.081890      5.432938 32.02390 6.199099 12.86221 6.148568 19.16169       8.731193 
1 1 1 9   16 39 o 18.70339 6.465245 5.616937       3.583694 4.824858       4.648909 6.776932       5.625935 17.74828 7.098875 19.68308 7.830306 -1.934805      10.56919 
1 1 1 9   16 40 o 19.94759 7.352698 7.511805       4.711001 14.44984       9.740810 5.393497       5.382343 22.38487 9.694093 17.70528 7.418403 4.679594       12.20689 
1 1 1 9   16 41 o 16.39440 6.318035 4.681969       3.566520 7.170634       4.937312 1.966344       5.157536 18.59454 7.355227 14.49583 6.607972 4.098713       9.887602 
1 1 1 9   16 42 o 20.76680 7.001650 9.022030       4.198048 15.05779       6.653578 5.030064       5.411064 23.05652 8.690504 15.95853 7.058536 7.097990       11.19588 
1 1 1 9   16 43 o 12.22209 5.554559 1.179487       3.609534 2.934314       5.003137 -0.7253577     5.212609 14.05586 6.445419 12.31273 5.921721 1.743133       8.752726 
1 1 1 9   17 0  o 465.2889 6.180314 2642.235       70.07601 2891.952       117.4398 2504.164       87.32580 486.1470 9.913147 452.7290 7.915314 33.41806       12.68553 
1 1 1 9   17 1  o 303.2818 4.804962 1121.891       35.51177 1151.321       72.04291 1112.445       40.81477 306.6000 9.654384 301.9501 5.546845 4.649902       11.13439 
1 1 1 9   17 2  o 124.3443 2.636014 188.4518       7.987475 185.5069       12.10384 190.7236       10.63094 123.2758 4.034543 125.0273 3.492661 -1.751450      5.336311 
1 1 1 9   17 3  o 309.0756 4.884122 1165.343       36.78640 1071.751       69.97446 1201.088       43.24440 295.7249 9.723135 313.7162 5.656619 -17.99121      11.24885 
1 1 1 9   17 4  o 275.2167 4.475924 923.8910       30.01881 881.8343       58.53698 938.8976       34.96669 268.2996 8.965710 277.3930 5.172767 -9.093445      10.35092 
1 1 1 9   17 5  o 131.5677 3.028905 211.0252       9.711157 205.9577       12.68069 218.2124       15.10167 129.8907 4.010968 133.6613 4.643476 -3.770615      6.135938 
1 1 1 9   17 6  o 59.59190 2.724156 43.37980       3.945527 47.63752       5.466026 38.74810       5.701026 62.39800 3.610133 56.20605 4.192505 6.191956       5.532645 
1 1 1 9   17 7  o 245.0602 3.575295 732.3737       21.35112 730.7490       33.79184 733.4533       27.54640 244.6258 5.668571 245.1694 4.610653 -0.5436401     7.306902 
1 1 1 9   17 8  o 286.4049 4.533274 1001.025       31.63942 1022.870       65.92113 994.4861       36.06491 288.6255 9.384944 285.3994 5.185560 3.226074       10.72228 
1 1 1 9   17 9  o 172.7372 3.201061 363.8761       13.47460 339.5579       28.19142 371.0766       15.34034 166.4532 6.965456 174.4175 3.609181 -7.964355      7.844983 
1 1 1 9   17 10 o 410.8725 6.176598 2064.248       61.84329 2207.628       130.9963 2023.127       70.15327 422.2892 12.74413 406.5331 7.081348 15.75610       14.57938 
1 1 1 9   17 11 o 239.0409 5.895711 698.7105       34.34349 729.9999       49.56188 669.8085       47.63356 243.7580 8.355941 233.4735 8.385818 10.28456       11.83823 
1 1 1 9   17 12 o 225.0737 5.709748 619.8896       31.29155 637.9001       44.78352 602.7081       43.74076 227.8378 8.078751 221.4465 8.119276 6.391312       11.45377 
1 1 1 9   17 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 9   17 14 o 52.47787 8.027662 34.59496       9.940170 0.000000       0.000000 34.59496       9.940170 ?        ?        52.47787 8.027662 0.000000       8.027662 
1 1 1 9   17 15 o 138.7033 4.144571 235.1894       13.99314 0.000000       0.000000 235.1894       13.99314 ?        ?        138.7033 4.144571 0.000000       4.144571 
1 1 1 9   17 16 o 256.8580 4.209852 806.1076       26.35093 889.2650       58.44545 784.8906       29.52179 268.3371 8.950391 253.3537 4.781666 14.98341       10.14760 
1 1 1 9   17 17 o 133.6274 2.944253 217.8920       9.587532 206.1284       21.98968 220.6531       10.65345 129.3403 7.002800 134.4496 3.251583 -5.109253      7.720880 
1 1 1 9   17 18 o 79.29763 2.665636 76.80537       5.143745 73.19331       13.44584 77.42461       5.567224 76.79374 7.271608 79.60119 2.874728 -2.807449      7.819229 
1 1 1 9   17 19 o 11.58173 4.541164 0.9505830      1.867504 4.414862       4.081314 0.3317003E-01  2.100274 19.93774 6.899161 10.81310 4.587670 9.124642       8.285236 
1 1 1 9   17 20 f 89.62780 3.497379 98.29653       7.624075 97.46397       8.744857 100.9344       15.56572 89.18424 4.034172 90.22876 7.137362 -1.044518      8.198566 
1 1 1 9   17 21 o 155.8190 2.793997 296.4037       10.60919 309.8987       17.59348 288.6925       13.29928 159.0111 4.545002 153.6878 3.551015 5.323334       5.767734 
1 1 1 9   17 22 o 119.2730 3.288017 173.9731       9.547675 173.1443       12.10320 175.3386       15.53531 118.8535 4.185338 119.3818 5.353676 -0.5282135     6.795506 
1 1 1 9   17 23 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 9   17 24 o 123.8105 3.027751 187.3532       9.135107 193.0847       12.82402 181.4486       13.01611 125.4424 4.201040 121.5576 4.401293 3.884766       6.084416 
1 1 1 9   17 25 o 31.60222 4.454309 12.49634       3.335278 9.762792       4.365279 16.33016       5.169686 27.53800 6.592556 35.87080 6.134371 -8.332804      9.005126 
1 1 1 9   17 26 o 61.48986 3.135302 46.38367       4.682556 41.16166       6.187340 53.38377       7.163697 57.71217 4.433422 65.75503 4.497748 -8.042862      6.315455 
1 1 1 9   17 27 o 84.23242 3.813220 87.27294       7.806917 80.27691       14.84353 89.94823       9.179025 79.60397 7.749843 85.37762 4.426925 -5.773651      8.925117 
1 1 1 9   17 28 o 37.51613 4.075358 17.52158       3.666012 17.73221       4.806340 17.22858       5.668806 37.44468 5.425161 36.59681 6.599142 0.8478661      8.542894 
1 1 1 9   17 29 o 86.01072 3.757640 91.27420       7.856960 95.36514       15.03103 89.73620       9.216301 86.51952 7.194194 85.06528 4.461585 1.454239       8.465351 
1 1 1 9   17 30 o 16.13299 6.192895 2.317466       3.417238 9.400549       4.670594 -5.842077      5.012957 26.66682 7.072512 12.64641 6.006069 14.02041       9.278647 
1 1 1 9   17 31 o 13.92768 5.759342 0.8442115      3.183105 3.668482       4.019755 -3.904317      5.212259 18.47882 6.795215 13.91965 6.452587 4.559168       9.370743 
1 1 1 9   17 32 o 99.25766 3.138786 121.9716       7.582556 128.6449       10.26924 113.9720       11.24358 101.3330 4.167534 94.88718 4.878896 6.445831       6.416539 
1 1 1 9   17 33 o 25.13133 5.893168 8.509370       3.546162 5.017670       4.384041 15.11765       6.031151 20.13570 7.136876 32.83031 7.676558 -12.69461      10.48163 
1 1 1 9   17 34 o 24.39406 5.850563 8.144335       3.433049 7.479589       4.475301 9.094847       5.351468 23.11486 7.186369 25.16654 7.863733 -2.051680      10.65280 
1 1 1 9   17 35 o 16.71280 6.646037 2.790380       4.051316 2.790380       4.051316 0.000000       0.000000 16.71280 6.646037 ?        ?        0.000000       6.646037 
1 1 1 9   17 36 o 16.28058 6.156944 3.218206       3.345950 6.644019       4.447402 -1.249785      5.079030 21.15476 7.205953 14.36764 6.552593 6.787121       9.739724 
1 1 1 9   17 37 f 13.38116 5.668532 1.135834       3.198249 5.182751       4.146460 -4.808038      5.025161 18.76890 6.901547 12.15365 5.837202 6.615254       9.039042 
1 1 1 9   17 38 o 18.97263 6.485081 5.635824       3.602651 3.876023       4.736569 8.051290       5.549227 17.14992 7.051942 21.36348 7.960439 -4.213556      10.63478 
1 1 1 9   17 39 o 12.33067 5.485988 0.3253969      3.316562 3.543263       4.536122 -3.370525      4.861409 16.27295 6.813748 12.09478 5.790997 4.178177       8.942192 
1 1 1 9   17 40 o 12.03337 5.650463 -1.286738      4.210291 -1.161124      9.182128 -1.320179      4.737700 15.57493 7.578025 12.59337 5.938333 2.981561       9.627578 
1 1 1 9   17 41 o 14.54950 6.216348 3.116493       3.903717 6.479701       5.844218 0.4070274      5.245555 17.33367 7.507713 13.46621 6.318116 3.867458       9.812458 
1 1 1 9   17 42 o 16.17512 6.479912 5.190797       3.879865 19.41001       5.665908 -7.363884      5.323957 30.14526 7.689431 10.34814 5.166263 19.79711       9.263780 
1 1 1 9   18 0  o 469.7231 6.242339 2694.035       71.45380 2829.746       116.4912 2612.176       90.47246 480.6327 9.945893 462.2135 8.032257 18.41916       12.78428 
1 1 1 9   18 1  o 388.5764 6.872454 1844.615       65.07654 1919.188       114.9108 1809.406       78.95876 395.1249 11.94784 384.5952 8.424815 10.52972       14.61946 
1 1 1 9   18 2  o 281.5614 4.055157 966.8729       27.82383 941.2068       42.89022 985.5228       36.56096 277.6067 6.340044 284.1691 5.279644 -6.562378      8.250503 
1 1 1 9   18 3  o 269.0770 3.917120 883.0188       25.68500 894.8997       40.48958 875.0183       33.22608 270.6950 6.138000 267.7680 5.091953 2.927032       7.975151 
1 1 1 9   18 4  o 306.3147 4.872489 1145.032       36.37096 1198.311       74.74417 1128.503       41.63240 312.4639 9.828378 304.0176 5.619486 8.446228       11.32147 
1 1 1 9   18 5  o 115.7775 3.001074 163.5389       8.460001 147.4300       16.72914 169.0742       9.806346 109.6679 6.286098 117.6991 3.422627 -8.031143      7.157471 
1 1 1 9   18 6  o 246.7987 4.071267 743.0918       24.48548 752.8911       34.62255 733.2866       34.63285 248.2673 5.722733 245.0052 5.800651 3.262024       8.148449 
1 1 1 9   18 7  o 252.4972 3.665088 777.6870       22.55159 790.4594       36.06202 769.4842       28.89970 254.3464 5.818196 251.0694 4.723495 3.276993       7.494185 
1 1 1 9   18 8  o 65.76176 2.961509 52.84151       4.733767 0.000000       0.000000 52.84151       4.733767 ?        ?        65.76176 2.961509 0.000000       2.961509 
1 1 1 9   18 9  o 38.46001 2.863095 18.13713       2.664124 30.84009       8.969258 16.90796       2.790043 49.59642 7.668267 37.10358 3.114454 12.49284       8.276602 
1 1 1 9   18 10 o 206.8601 3.582690 522.0995       18.06017 586.2904       40.81906 506.4750       20.13856 218.5403 7.676624 203.7020 4.056925 14.83832       8.682695 
1 1 1 9   18 11 o 361.8539 5.528706 1601.011       48.75204 1587.238       98.87822 1605.435       56.03681 358.1173 11.34455 362.1514 6.349611 -4.034088      13.00063 
1 1 1 9   18 12 o 62.03148 3.408092 47.09253       5.132011 0.000000       0.000000 47.09253       5.132011 ?        ?        62.03148 3.408092 0.000000       3.408092 
1 1 1 9   18 13 o 267.3565 4.945115 873.7535       32.21835 0.000000       0.000000 873.7535       32.21835 ?        ?        267.3565 4.945115 0.000000       4.945115 
1 1 1 9   18 14 o 12.32610 4.343909 1.617733       1.622261 -2.332376      7.861695 1.793410       1.657943 19.33517 8.532006 12.75014 4.397933 6.585031       9.598799 
1 1 1 9   18 15 o 155.4247 3.064726 294.7717       11.60775 320.0661       26.94847 289.0096       12.86210 161.3361 6.870079 153.8695 3.430229 7.466614       7.678832 
1 1 1 9   18 16 o 156.8318 3.476822 300.3094       13.28778 0.000000       0.000000 300.3094       13.28778 ?        ?        156.8318 3.476822 0.000000       3.476822 
1 1 1 9   18 17 o 121.8687 2.843746 181.2353       8.445380 167.7448       19.07579 184.5242       9.418751 116.6526 6.739144 122.9088 3.147254 -6.256195      7.437827 
1 1 1 9   18 18 f 151.9292 3.090520 281.7920       11.44219 247.0240       24.02496 291.9919       13.01279 141.5199 6.988023 154.6173 3.453633 -13.09741      7.794873 
1 1 1 9   18 19 o 33.45850 7.988132 14.37857       6.422790 15.21910       8.343149 13.15577       10.06310 34.47921 9.584710 33.02282 10.83216 1.456394       14.46383 
1 1 1 9   18 20 o 179.4760 3.271363 393.4980       14.30775 411.7632       21.68876 379.4249       19.03786 183.2451 4.861271 175.9904 4.442632 7.254745       6.585509 
1 1 1 9   18 21 o 123.6313 2.773929 186.6140       8.357185 189.6530       12.86500 184.3953       10.99238 124.3927 4.250278 122.7453 3.679095 1.647362       5.621442 
1 1 1 9   18 22 o 9.761518 4.294607 -0.5542040     1.977994 -2.446447      4.272443 -0.3797995E-01 2.231551 13.37982 6.065839 11.04330 4.708627 2.336520       7.678905 
1 1 1 9   18 23 o 50.07662 4.382867 30.97616       5.294609 29.60019       5.925811 36.42243       11.78943 48.83167 5.052688 53.17823 9.443439 -4.346558      10.71019 
1 1 1 9   18 24 o 98.73782 4.228716 119.7881       10.15129 119.7881       10.15129 0.000000       0.000000 98.73782 4.228716 ?        ?        0.000000       4.228716 
1 1 1 9   18 25 o 130.4149 3.098680 208.0556       9.847816 208.9242       13.81864 207.1593       14.03778 130.3648 4.355912 129.7887 4.444950 0.5761108      6.223467 
1 1 1 9   18 26 o 100.6132 3.654086 124.3077       8.944327 118.9344       17.04387 126.3499       10.50745 97.31309 7.239073 101.2954 4.266238 -3.982315      8.402677 
1 1 1 9   18 27 o 31.14591 4.811680 12.24587       3.534461 13.67384       4.715331 10.41473       5.339653 32.64130 6.153635 28.28024 7.590179 4.361063       9.771286 
1 1 1 9   18 28 o 83.92897 2.999245 86.47898       6.124366 97.01488       8.701170 76.13465       8.621700 88.63529 4.039036 78.35764 4.534555 10.27766       6.072561 
1 1 1 9   18 29 o 13.70490 6.202071 -2.213435      4.442495 0.000000       0.000000 -2.213435      4.442495 ?        ?        13.70490 6.202071 0.000000       6.202071 
1 1 1 9   18 30 o 84.77148 3.018660 88.54802       6.225959 86.71631       8.439212 90.73553       9.222511 83.47090 4.162007 85.25871 4.454339 -1.787811      6.096182 
1 1 1 9   18 31 o 71.70734 3.164808 63.63753       5.516657 57.98517       7.293465 71.19520       8.433602 67.93690 4.429624 75.20683 4.624073 -7.269936      6.403407 
1 1 1 9   18 32 o 26.40335 5.919831 9.330893       3.714664 16.69744       4.885609 -0.7628890     5.718916 35.58720 5.835731 16.41361 7.258338 19.17359       9.313390 
1 1 1 9   18 33 o 34.97517 4.711989 15.87672       3.913987 14.74868       5.048888 17.57560       6.196014 32.80487 6.545234 35.36555 7.426250 -2.560673      9.898953 
1 1 1 9   18 34 o 51.12367 3.979635 33.44816       4.918913 36.61872       6.058510 27.31587       8.425762 52.98472 4.742320 42.88088 8.363723 10.10384       9.614648 
1 1 1 9   18 35 o 13.51239 5.681056 0.9743883      3.173315 1.835159       4.092782 -0.3230205     5.024736 15.63330 6.503402 15.05153 6.720866 0.5817719      9.352234 
1 1 1 9   18 36 o 11.15112 5.210726 -2.334522      3.507670 -0.9610046     3.959127 -7.347785      7.563845 12.83558 5.827054 14.41006 6.980053 -1.574475      9.092618 
1 1 1 9   18 37 o 18.40077 6.361588 5.094894       3.469752 10.97567       4.779293 -1.459142      5.045459 25.82709 7.281539 13.71463 6.354406 12.11246       9.664330 
1 1 1 9   18 38 o 29.79260 5.433881 13.12130       3.799756 19.17051       5.427440 7.306036       5.321459 34.68716 6.662921 20.33354 7.747131 14.35361       10.21825 
1 1 1 9   18 39 o 14.52162 5.987377 2.628472       3.426607 8.038881       4.814372 -2.926270      4.878165 20.59848 7.457720 12.16454 5.818078 8.433946       9.458733 
1 1 1 9   18 40 o 10.37748 5.005613 -3.171657      3.789558 -1.994266      6.332614 -3.828511      4.729952 13.46866 6.490156 11.28364 5.478317 2.185013       8.493178 
1 1 1 9   18 41 o 16.39392 6.761261 5.239597       4.371302 1.524394       9.463486 6.247288       4.928601 15.30519 7.499544 17.15215 7.136047 -1.846963      10.35212 
1 1 1 9   18 42 o 13.38189 5.845489 2.503174       3.606379 -0.4679101     5.072216 5.540718       5.128632 12.42737 5.940768 15.94686 6.968283 -3.519485      9.156947 
1 1 1 9   19 0  o 72.04765 3.122956 63.40781       5.470023 65.53504       7.025602 60.13333       8.716613 73.19412 3.953540 70.00143 5.145771 3.192696       6.489178 
1 1 1 9   19 1  o 258.7900 3.823112 816.8472       24.11019 834.4238       38.16449 805.1733       31.10282 261.3670 5.992011 256.8446 4.969278 4.522400       7.784466 
1 1 1 9   19 2  o 108.7955 3.347674 144.4739       8.864884 133.6608       10.15778 179.0250       18.15744 104.6006 3.992330 120.8906 6.184027 -16.29002      7.360767 
1 1 1 9   19 3  o 61.69360 2.998686 46.51637       4.494738 38.44790       5.977690 57.01241       6.817899 55.95871 4.419441 68.23624 4.119331 -12.27753      6.041552 
1 1 1 9   19 4  o 104.4839 3.320355 133.2685       8.443416 137.3383       9.914711 122.5265       16.10773 106.0353 3.843374 99.88210 6.655726 6.153168       7.685715 
1 1 1 9   19 5  o 126.9944 3.104202 196.6679       9.606618 178.8031       18.56244 203.2031       11.22708 120.7681 6.329442 129.0205 3.574296 -8.252403      7.268936 
1 1 1 9   19 6  f 186.0608 3.027616 422.1627       13.72751 395.5537       20.90661 442.3295       18.20071 179.9270 4.772377 190.3990 3.922723 -10.47195      6.177649 
1 1 1 9   19 7  o 127.7673 2.509423 199.0274       7.813213 217.3347       12.75433 188.0303       9.885158 133.3972 3.927788 124.1176 3.271092 9.279579       5.111513 
1 1 1 9   19 8  o 120.6286 2.810870 177.4456       8.262799 172.4912       18.04866 178.7593       9.293947 118.5751 6.268462 121.0204 3.154102 -2.445381      7.017262 
1 1 1 9   19 9  o 222.4178 4.327167 604.0176       23.45358 0.000000       0.000000 604.0176       23.45358 ?        ?        222.4178 4.327167 0.000000       4.327167 
1 1 1 9   19 10 o 77.14750 2.793220 72.68045       5.242587 0.000000       0.000000 72.68045       5.242587 ?        ?        77.14750 2.793220 0.000000       2.793220 
1 1 1 9   19 11 o 148.0249 3.341946 267.3535       12.05508 0.000000       0.000000 267.3535       12.05508 ?        ?        148.0249 3.341946 0.000000       3.341946 
1 1 1 9   19 12 o 146.5829 3.614564 262.2624       12.91146 280.9738       24.58409 255.1353       15.17243 151.2556 6.686227 144.4597 4.314788 6.795975       7.957577 
1 1 1 9   19 13 o 74.78278 2.555625 68.28541       4.650464 55.58154       12.11707 70.47991       5.036139 66.84546 7.571759 75.96553 2.724891 -9.120071      8.047147 
1 1 1 9   19 14 o 103.4782 2.672551 130.7027       6.733598 141.5190       16.85328 128.6480       7.345358 107.2229 6.480265 102.6416 2.939687 4.581268       7.115869 
1 1 1 9   19 15 o 146.8591 3.016827 263.1990       10.79661 220.3836       22.70543 275.7083       12.27290 133.7526 6.990386 150.2812 3.351246 -16.52859      7.752183 
1 1 1 9   19 16 o 100.4316 2.675698 123.1499       6.542695 138.6697       16.33201 120.1831       7.140727 106.0976 6.345809 99.19102 2.957463 6.906609       7.001134 
1 1 1 9   19 17 f 78.80259 2.878900 75.89079       5.519155 0.000000       0.000000 75.89079       5.519155 ?        ?        78.80259 2.878900 0.000000       2.878900 
1 1 1 9   19 18 o 27.65724 8.629171 9.414929       6.446494 5.632115       8.655480 14.12726       9.660541 25.68196 9.856633 33.74463 10.56875 -8.062677      14.45170 
1 1 1 9   19 19 o 174.2808 3.736449 371.3232       15.86882 370.3268       30.93444 371.6790       18.48653 173.0727 7.351362 174.2607 4.353312 -1.188004      8.543643 
1 1 1 9   19 20 o 14.46127 5.201377 2.152705       2.337181 6.989080       8.173148 1.722005       2.439030 26.33937 9.688807 13.93420 5.259586 12.40517       11.02435 
1 1 1 9   19 21 o 129.6675 2.619800 205.2680       8.278191 213.8094       13.79474 200.4611       10.34868 132.0511 4.292524 128.0216 3.319958 4.029587       5.426590 
1 1 1 9   19 22 o 177.4489 3.013154 384.7723       13.02958 380.2083       20.86541 387.6897       16.68197 175.9194 4.871868 177.9592 3.846723 -2.039734      6.207445 
1 1 1 9   19 23 o 71.25703 2.968533 62.17000       5.143438 58.63366       7.627151 65.11950       6.965620 68.96448 4.564054 72.79800 3.941184 -3.833519      6.030218 
1 1 1 9   19 24 o 134.2723 3.071392 220.5005       10.04981 216.3914       14.34299 224.4634       14.08566 132.6717 4.442611 135.1687 4.281669 -2.496994      6.170047 
1 1 1 9   19 25 o 47.76059 5.272936 28.48153       6.034985 30.18598       12.07370 27.91385       6.967884 47.66860 10.66126 47.05346 6.229689 0.6151428      12.34794 
1 1 1 9   19 26 o 99.17378 3.033751 120.5553       7.323218 129.2176       10.63133 112.7340       10.10211 102.3839 4.270459 95.59859 4.347733 6.785263       6.094227 
1 1 1 9   19 27 o 89.48006 3.035664 98.26144       6.609775 98.68701       9.291354 97.82540       9.404949 89.35930 4.279245 88.94592 4.352261 0.4133759      6.103615 
1 1 1 9   19 28 o 31.88158 5.123516 12.94423       3.845728 13.68773       5.657727 12.30568       5.243254 32.21636 7.367215 30.57094 7.163957 1.645414       10.27610 
1 1 1 9   19 29 o 22.55552 7.143160 6.489729       4.401382 5.599896       9.114404 6.760340       5.026283 25.06423 9.968020 23.20002 7.657725 1.864206       12.56989 
1 1 1 9   19 30 o 42.27937 3.894387 22.37371       3.967340 21.01706       5.356867 24.02182       5.904334 40.40606 5.589936 43.17642 5.754790 -2.770359      8.022779 
1 1 1 9   19 31 o 50.71857 3.715467 32.19793       4.560292 34.00859       6.103213 29.90927       6.861663 51.63418 4.909488 47.86399 6.015332 3.770187       7.764489 
1 1 1 9   19 32 o 18.07753 6.308502 4.009641       3.415943 3.502764       4.588222 4.639984       5.116601 18.50177 7.156494 20.18614 7.618218 -1.684370      10.45240 
1 1 1 9   19 33 o 14.04968 5.902664 0.8806771      3.421821 -0.7699181     4.171995 4.273283       5.981225 13.81547 6.149374 20.18605 8.059420 -6.370583      10.13751 
1 1 1 9   19 34 o 40.82843 4.087641 21.59010       4.012344 20.06326       5.274192 23.68772       6.181925 38.21441 5.849428 41.16546 6.367833 -2.951054      8.646682 
1 1 1 9   19 35 o 17.51265 6.244139 4.129254       3.360424 2.693620       4.409117 6.118957       5.190674 16.61300 6.814506 20.58965 7.693625 -3.976650      10.27761 
1 1 1 9   19 36 o 19.67211 6.801033 5.898607       3.965670 7.774572       4.563493 0.1125933      8.014466 21.99597 7.298063 17.42215 8.049862 4.573820       10.86563 
1 1 1 9   19 37 o 14.90896 5.973134 2.609422       3.296988 3.925695       4.624604 1.248930       4.701641 17.16831 7.003212 14.95375 6.598377 2.214562       9.622035 
1 1 1 9   19 38 o 13.32426 5.713583 1.382157       3.319757 4.843035       4.636662 -2.258057      4.755276 17.57769 7.069262 12.52176 5.918099 5.055935       9.219456 
1 1 1 9   19 39 o 11.31374 5.278122 -1.187689      3.575264 4.135937       5.801919 -4.446793      4.539594 16.60081 7.327321 10.95941 5.331430 5.641396       9.061666 
1 1 1 9   19 40 o 12.04046 5.417439 0.6332445      3.333235 9.713408       4.891428 -7.238770      4.554407 21.16975 7.535004 9.763463 4.858935 11.40628       8.965798 
1 1 1 9   19 41 f 14.62711 6.510488 3.365425       4.676090 -3.104088      9.180306 5.631988       5.433820 13.88101 6.906515 16.27111 7.139615 -2.390104      9.933481 
1 1 1 9   20 0  o 311.1299 4.401428 1181.360       33.37117 1212.282       53.22392 1161.329       42.83722 314.8034 6.937953 308.3144 5.701530 6.488953       8.980124 
1 1 1 9   20 1  o 61.10311 3.327589 45.66906       4.936135 52.99997       6.238046 33.39084       8.073041 65.79494 3.908240 51.85078 6.533967 13.94415       7.613611 
1 1 1 9   20 2  o 209.4897 3.350986 535.2524       17.10690 562.4072       27.41619 517.9393       21.89129 214.5852 5.242897 206.0035 4.360744 8.581650       6.819388 
1 1 1 9   20 3  o 179.0436 3.067968 390.9284       13.38585 378.8104       20.33507 400.1943       17.78172 176.0781 4.743511 181.0967 4.029276 -5.018539      6.223823 
1 1 1 9   20 4  o 37.53036 3.482935 17.32941       3.149057 19.16311       4.401168 15.40594       4.507619 39.34103 4.682559 35.09840 5.446591 4.242626       7.182737 
1 1 1 9   20 5  o 88.03388 2.610367 94.57648       5.593809 108.7471       8.455237 83.54654       7.459652 94.33672 3.685065 82.66581 3.712497 11.67091       5.230902 
1 1 1 9   20 6  o 129.4827 3.364712 204.6632       10.60785 0.000000       0.000000 204.6632       10.60785 ?        ?        129.4827 3.364712 0.000000       3.364712 
1 1 1 9   20 7  o 96.80492 3.121184 114.4247       7.353343 0.000000       0.000000 114.4247       7.353343 ?        ?        96.80492 3.121184 0.000000       3.121184 
1 1 1 9   20 8  o 234.3879 3.866810 670.5518       22.08636 662.6832       42.54479 673.4547       25.84124 232.3271 7.524603 234.8204 4.515870 -2.493332      8.775690 
1 1 1 9   20 9  o 90.17526 2.702109 99.25652       5.931113 99.05865       13.59693 99.30302       6.591260 89.73576 6.257037 90.17739 3.003593 -0.4416351     6.940611 
1 1 1 9   20 10 o 239.6613 4.002976 701.3057       23.37852 697.2690       48.64274 702.5181       26.65948 237.9844 8.400694 239.7937 4.562236 -1.809341      9.559585 
1 1 1 9   20 11 o 344.5174 5.314545 1451.890       44.61833 1468.323       91.83376 1446.813       51.04857 344.1066 10.96549 343.7021 6.094881 0.4044189      12.54550 
1 1 1 9   20 12 o 108.1398 3.257245 142.8440       8.573865 125.6439       16.01650 149.7526       10.15075 101.0147 6.541673 110.6803 3.768999 -9.665611      7.549757 
1 1 1 9   20 13 o 29.72346 3.301407 10.91589       2.351012 6.121946       8.002936 11.36869       2.459535 25.55192 9.552032 30.33056 3.385292 -4.778645      10.13418 
1 1 1 9   20 14 o 69.98126 2.566042 59.81995       4.368633 46.80446       10.72216 62.41069       4.783706 61.27104 7.326128 71.46963 2.751814 -10.19859      7.825894 
1 1 1 9   20 15 o 162.6771 3.176024 323.0593       12.59060 349.8576       28.72178 316.6847       14.00827 168.5320 7.008770 161.0240 3.569915 7.507965       7.865567 
1 1 1 9   20 16 o 82.76411 2.648868 83.66621       5.335546 86.55696       13.49123 83.13025       5.809145 83.64924 6.673707 82.47876 2.894728 1.170479       7.274463 
1 1 1 9   20 17 o 53.87724 3.947199 35.67741       5.146430 26.78881       10.27349 38.65521       5.946326 45.62040 9.548048 56.03740 4.389470 -10.41700      10.50869 
1 1 1 9   20 18 o 69.24503 3.018682 58.66001       5.081565 0.000000       0.000000 58.66001       5.081565 ?        ?        69.24503 3.018682 0.000000       3.018682 
1 1 1 9   20 19 o 117.4529 2.874876 168.4439       8.228469 185.8981       19.79234 164.7967       9.047409 122.6511 6.646844 116.1012 3.200855 6.549843       7.377398 
1 1 1 9   20 20 o 121.4141 2.924995 180.0504       8.654269 161.3451       19.15900 184.8455       9.700291 114.1013 6.923003 122.9442 3.240555 -8.842911      7.643897 
1 1 1 9   20 21 o 68.53528 2.857523 57.47647       4.761965 52.61961       12.06677 58.37239       5.182593 64.65920 7.816631 69.04375 3.088070 -4.384544      8.404516 
1 1 1 9   20 22 o 83.42599 2.502529 85.06564       5.081892 93.88554       8.907755 80.80986       6.187648 87.41090 4.194069 81.23840 3.131426 6.172501       5.234123 
1 1 1 9   20 23 f 68.24192 2.992129 57.04818       4.963759 54.47968       7.302934 59.25370       6.767262 66.45101 4.537042 69.40405 4.018399 -2.953033      6.060716 
1 1 1 9   20 24 o 92.60377 2.940748 105.0001       6.627834 104.8148       9.711373 105.1617       9.068011 92.25932 4.331603 92.47669 4.033569 -0.2173767     5.918822 
1 1 1 9   20 25 o 90.45806 2.564258 100.1267       5.646856 93.78079       9.397635 103.7127       7.064408 87.16975 4.438627 91.96502 3.156904 -4.795265      5.446784 
1 1 1 9   20 26 o 54.32636 3.145553 36.30363       4.146508 45.71897       8.436775 33.30500       4.761237 60.35671 5.807685 51.91309 3.789735 8.443615       6.934789 
1 1 1 9   20 27 o 33.86101 4.772522 14.47727       3.828978 22.02880       5.652896 8.075484       5.204801 41.64161 5.721790 25.10223 7.740897 16.53937       9.626025 
1 1 1 9   20 28 o 71.48789 3.208745 63.00679       5.575649 66.81042       7.861565 59.15716       7.908964 73.23753 4.425584 68.78559 4.747426 4.451935       6.490289 
1 1 1 9   20 29 o 39.71209 5.381804 20.19313       5.074271 33.96542       10.65116 16.14962       5.771295 49.83078 9.106760 34.85686 7.037118 14.97392       11.50887 
1 1 1 9   20 30 o 30.77690 5.248578 12.30578       3.795347 13.33387       5.278682 11.20553       5.460814 31.38605 7.071753 28.58481 7.677521 2.801243       10.43810 
1 1 1 9   20 31 o 13.76747 5.905600 0.2086322      3.548836 2.451097       4.731818 -2.674432      5.365280 17.65457 7.126865 14.65237 6.702309 3.002195       9.783310 
1 1 1 9   20 32 o 20.73353 6.741889 5.775946       3.902305 6.527253       4.972737 4.571659       6.295814 22.05925 7.616268 20.82961 8.284368 1.229643       11.25337 
1 1 1 9   20 33 o 39.95187 4.339762 20.73347       4.157323 27.13328       5.729010 13.61488       6.042167 45.10095 5.314560 30.06143 8.076621 15.03953       9.668317 
1 1 1 9   20 34 o 41.18214 4.302850 22.27448       4.254538 26.25136       5.837947 17.76988       6.213223 43.69339 5.612328 34.19855 7.647495 9.494843       9.485906 
1 1 1 9   20 35 o 21.15592 6.261632 6.673404       3.455514 1.878716       4.504190 13.53220       5.387167 15.74467 6.700602 29.14668 7.531098 -13.40201      10.08045 
1 1 1 9   20 36 o 25.08834 6.966940 10.14305       4.410654 13.04730       5.112951 1.695762       8.719939 28.16804 7.366416 18.24519 8.418221 9.922848       11.18618 
1 1 1 9   20 37 o 30.96230 5.470549 14.18638       3.976711 15.68532       5.537384 12.58994       5.714642 30.13828 7.554938 25.98503 8.127189 4.153252       11.09632 
1 1 1 9   20 38 o 14.74365 6.141953 2.687724       3.657914 3.060924       5.774385 2.437587       4.727421 16.21403 7.224670 15.21614 6.668538 0.9978924      9.831849 
1 1 1 9   20 39 o 13.17397 5.721911 1.663280       3.413969 1.753602       4.855235 1.574952       4.801379 14.30147 6.476752 14.15108 6.421391 0.1503963      9.120448 
1 1 1 9   20 40 f 13.71552 5.864942 2.522260       3.480108 6.528664       5.140649 -0.8673113     4.728387 17.41078 7.269233 12.33919 5.852302 5.071593       9.332266 
1 1 1 9   20 41 o 17.43233 6.975071 6.773448       4.489859 0.9763531E-01  9.015285 8.975414       5.177651 14.38075 7.099568 18.98477 7.524965 -4.604028      10.34548 
1 1 1 9   21 0  o 163.4253 3.317092 325.7685       13.21031 323.0240       25.08620 326.8216       15.53943 162.3815 6.351859 163.6560 3.896431 -1.274506      7.451731 
1 1 1 9   21 1  o 176.0796 3.867716 378.3293       16.59586 389.1241       28.21112 372.6165       20.52262 178.2147 6.506843 174.6066 4.827842 3.608139       8.102287 
1 1 1 9   21 2  o 97.80766 4.094345 116.9636       9.737150 105.1970       12.17235 137.8732       16.22643 92.62227 5.416544 105.9735 6.311923 -13.35121      8.317410 
1 1 1 9   21 3  o 50.20803 3.704639 30.92610       4.500758 28.61490       6.732631 32.79346       6.051742 48.02030 5.875649 51.58677 4.871700 -3.566467      7.632609 
1 1 1 9   21 4  o 18.38268 6.157805 3.876663       3.247450 0.7931163      4.784942 6.509828       4.421711 16.94053 7.038240 23.09297 7.137201 -6.152447      10.02379 
1 1 1 9   21 5  o 79.36320 2.832851 76.91107       5.469930 64.15004       7.216725 94.14009       8.385471 72.37492 4.108691 87.73495 3.932092 -15.36003      5.687064 
1 1 1 9   21 6  f 103.2165 2.828617 130.0281       7.108040 118.9636       9.327127 145.3559       10.97801 98.64711 3.887574 109.0352 4.139139 -10.38811      5.678529 
1 1 1 9   21 7  o 103.1117 2.783987 129.7630       6.988977 134.9269       9.728482 124.2555       10.04703 105.0696 3.805836 100.7977 4.098808 4.271873       5.593266 
1 1 1 9   21 8  o 173.7561 3.319833 368.3860       14.05699 386.5318       30.21777 363.3747       15.87982 177.4149 7.003098 172.5342 3.776889 4.880692       7.956650 
1 1 1 9   21 9  o 184.0025 3.414948 413.1860       15.31242 386.4567       31.23603 421.6413       17.56816 177.3135 7.244248 185.8327 3.879432 -8.519196      8.217610 
1 1 1 9   21 10 o 232.0320 3.927285 657.4761       22.20631 726.8018       48.85104 639.4198       24.93102 242.8871 8.265450 228.7473 4.472477 14.13980       9.397911 
1 1 1 9   21 11 o 71.91142 2.668230 63.16531       4.667706 59.96017       11.27580 63.82812       5.127678 69.58685 6.733460 72.27084 2.917529 -2.683998      7.338355 
1 1 1 9   21 12 o 76.79226 2.622083 72.01785       4.899622 71.54344       11.81074 72.11647       5.384837 76.10123 6.428758 76.82658 2.881345 -0.7253571     7.044932 
1 1 1 9   21 13 o 72.85018 2.608460 64.82597       4.623271 58.09245       11.23997 66.19720       5.072218 68.43299 6.831237 73.60132 2.833271 -5.168327      7.395487 
1 1 1 9   21 14 o 142.5710 3.338067 248.1942       11.59744 0.000000       0.000000 248.1942       11.59744 ?        ?        142.5710 3.338067 0.000000       3.338067 
1 1 1 9   21 15 o 99.50227 3.956304 121.2115       9.573973 117.3139       15.73618 123.5021       12.06357 97.45828 6.666030 100.3056 4.950607 -2.847336      8.303281 
1 1 1 9   21 16 o 150.1153 3.075972 275.1472       11.25236 266.4902       24.54730 277.4502       12.66090 146.9673 6.873082 150.7019 3.447544 -3.734589      7.689266 
1 1 1 9   21 17 o 66.59611 2.745283 54.22713       4.445697 53.70857       11.59295 54.31654       4.813716 65.57032 7.383416 66.63118 2.972085 -1.060860      7.959153 
1 1 1 9   21 18 o 143.4225 3.055423 251.2342       10.67886 247.8328       23.56948 252.1128       11.97893 141.6099 6.850314 143.6294 3.422462 -2.019501      7.657679 
1 1 1 9   21 19 o 160.6893 3.638350 315.7885       14.24713 0.000000       0.000000 315.7885       14.24713 ?        ?        160.6893 3.638350 0.000000       3.638350 
1 1 1 9   21 20 o 115.0660 2.893306 161.8456       8.106488 136.2112       17.95228 168.4114       9.085526 104.6911 7.078394 117.3392 3.180326 -12.64811      7.760034 
1 1 1 9   21 21 f 130.0453 3.013054 206.7129       9.548556 177.0764       20.32515 215.1062       10.81648 119.3365 7.020159 132.5679 3.350888 -13.23136      7.778887 
1 1 1 9   21 22 o 106.4722 2.888943 138.6692       7.488758 145.3419       17.65452 137.2051       8.269606 108.0841 6.736316 105.8597 3.209370 2.224350       7.461770 
1 1 1 9   21 23 o 104.9080 2.978676 134.7322       7.607254 139.5502       11.07102 130.4226       10.47063 106.5057 4.274269 102.9794 4.181098 3.526222       5.979210 
1 1 1 9   21 24 o 20.28675 5.173844 5.276874       2.565427 7.542616       5.365569 4.605411       2.920933 24.68546 7.894813 19.18499 5.775898 5.500462       9.782079 
1 1 1 9   21 25 o 32.17253 4.005481 12.92504       3.072516 13.05402       7.086370 12.89518       3.409685 31.51655 8.859834 32.03659 4.490640 -0.5200386     9.932899 
1 1 1 9   21 26 o 114.6990 2.656608 161.1315       7.425456 157.0394       12.13064 163.5835       9.390257 112.6326 4.428233 115.3468 3.344219 -2.714111      5.549148 
1 1 1 9   21 27 o 61.14736 3.666763 46.27548       5.438724 46.10909       7.013862 46.52641       8.613212 60.71077 4.779356 60.57679 5.909824 0.1339798      7.600543 
1 1 1 9   21 28 o 49.02088 3.760982 29.91127       4.458499 30.81349       6.281810 28.99544       6.328995 49.25282 5.318026 47.67573 5.551271 1.577087       7.687523 
1 1 1 9   21 29 o 45.94696 4.834052 26.82213       5.331588 22.77898       10.05284 28.40444       6.288919 39.66479 10.30755 46.97663 5.603994 -7.311840      11.73244 
1 1 1 9   21 30 o 40.17170 6.685644 21.61639       6.314917 33.08604       10.34773 14.80975       7.971437 48.21049 9.142245 31.91937 9.526086 16.29112       13.20329 
1 1 1 9   21 31 o 44.32200 4.220023 25.06207       4.503016 29.98784       6.407195 20.25434       6.329961 47.73386 5.615443 38.31758 7.038306 9.416275       9.003941 
1 1 1 9   21 32 o 14.52335 6.017870 1.286175       3.485013 1.033698       4.850501 1.555583       5.010497 16.16343 6.918171 16.79099 7.103192 -0.6275673     9.915464 
1 1 1 9   21 33 o 13.57542 5.800163 0.6560657      3.398506 0.1381950      4.626669 1.262923       5.008425 14.91624 6.565101 16.26271 6.996399 -1.346478      9.594277 
1 1 1 9   21 34 o 24.01994 6.089936 8.428728       3.569046 8.955725       4.932065 7.849387       5.171210 23.86145 7.562133 22.41944 7.765507 1.442009       10.83923 
1 1 1 9   21 35 o 23.97472 6.283385 8.751122       3.714760 12.96580       5.326154 4.758924       5.183670 28.04673 7.603593 18.57897 7.473698 9.467762       10.66165 
1 1 1 9   21 36 o 26.76483 7.050193 11.79379       4.661447 12.55187       5.481928 9.814513       8.857854 26.62519 7.888363 22.09514 9.399669 4.530045       12.27111 
1 1 1 9   21 37 o 16.28154 6.992227 3.321531       4.985882 12.43804       6.199798 -13.36867      8.388687 24.61275 8.503907 12.70557 6.364231 11.90718       10.62167 
1 1 1 9   21 38 f 11.56840 5.259750 -0.1670305     3.240895 3.075799       4.910295 -2.670099      4.314017 15.52518 6.800344 11.45736 5.477532 4.067822       8.732012 
1 1 1 9   21 39 o 9.504151 4.603659 -3.259663      3.290111 -7.542141      4.749891 0.6901147      4.561655 9.926732 4.943754 13.22324 6.096667 -3.296504      7.849207 
1 1 1 9   21 40 o 18.78188 6.588240 7.059357       3.728562 5.036207       5.349885 8.970219       5.199304 15.93228 7.034002 19.29365 7.573554 -3.361362      10.33615 
1 1 1 9   22 0  f 201.4136 3.297329 494.8827       16.18405 522.0486       25.78150 477.2162       20.79078 206.6940 5.118517 197.7017 4.315431 8.992310       6.694936 
1 1 1 9   22 1  o 47.93227 3.246176 28.15481       3.769351 30.58505       5.380336 25.81227       5.282349 49.84652 4.476974 45.71690 4.813635 4.129616       6.573764 
1 1 1 9   22 2  o 195.3756 3.232096 465.6556       15.38830 472.9839       23.92658 460.4861       20.09591 196.6813 4.996125 194.2040 4.246325 2.477234       6.556870 
1 1 1 9   22 3  o 181.7633 4.167048 403.3695       18.45741 372.3521       29.73058 422.8214       23.54408 174.1711 7.019104 185.9168 5.201807 -11.74571      8.736510 
1 1 1 9   22 4  o 120.8602 2.701321 178.1381       7.956017 162.8905       11.54374 191.9338       10.98040 115.4323 4.110332 125.3587 3.598133 -9.926346      5.462727 
1 1 1 9   22 5  o 62.24652 2.831173 47.35515       4.283307 47.38996       6.114645 47.32161       6.001948 62.16919 4.058265 62.13112 3.985134 0.3807449E-01  5.687777 
1 1 1 9   22 6  o 143.2495 2.731128 250.2740       9.533912 236.9696       14.56578 260.2464       12.61057 139.2239 4.298375 146.0269 3.543771 -6.802963      5.570847 
1 1 1 9   22 7  o 79.39138 2.501234 76.94083       4.833053 77.25706       7.365895 76.70177       6.404449 79.45734 3.815279 79.21155 3.325249 0.2457962      5.060991 
1 1 1 9   22 8  o 182.5285 3.405180 406.6316       15.14631 393.8473       20.74122 421.2383       22.17036 179.4313 4.747685 185.5452 4.907592 -6.113892      6.828249 
1 1 1 9   22 9  o 374.1158 8.133245 1722.701       74.14912 1759.622       107.7400 1689.476       102.2043 375.8637 11.77733 368.5458 11.39366 7.317871       16.38661 
1 1 1 9   22 10 o 137.9647 2.994832 232.2592       10.06877 210.3331       20.89737 238.8883       11.49049 130.7667 6.578937 139.8926 3.370602 -9.125946      7.392115 
1 1 1 9   22 11 o 132.3804 2.923259 213.8424       9.430334 233.2554       21.38643 209.1568       10.50696 137.7312 6.389323 130.8545 3.297604 6.876724       7.190107 
1 1 1 9   22 12 o 15.02374 5.054330 2.579231       2.187664 -0.4797225E-01 6.708433 2.891870       2.314173 19.13760 8.162043 15.74767 5.195981 3.389932       9.675596 
1 1 1 9   22 13 o 158.0083 3.487705 304.9294       13.42938 330.4310       27.06033 296.5963       15.46869 163.8029 6.793897 155.7133 4.080056 8.089676       7.924891 
1 1 1 9   22 14 o 15.00888 6.847997 -3.606444      5.554987 -4.789773      7.199338 -1.865359      8.732723 17.00121 7.771830 20.71010 9.070211 -3.708893      11.94446 
1 1 1 9   22 15 o 101.4508 2.727608 125.7053       6.737197 153.0674       17.05069 120.6430       7.333991 111.4129 6.305899 99.35723 3.032589 12.05569       6.997211 
1 1 1 9   22 16 o 90.69519 2.723274 100.4933       6.012007 109.3501       15.08737 98.82145       6.554903 94.01330 6.627970 89.91155 2.995860 4.101746       7.273593 
1 1 1 9   22 17 o 100.0379 2.783178 122.2760       6.778279 94.17619       15.33757 129.0962       7.556232 87.02360 7.299625 102.7671 3.020554 -15.74352      7.899890 
1 1 1 9   22 18 o 82.74868 2.757312 83.70244       5.552342 83.96529       13.58863 83.64976       6.083341 82.19792 6.845984 82.69548 3.023822 -0.4975586     7.484049 
1 1 1 9   22 19 o 20.11751 5.280302 5.154563       2.620844 13.08278       8.726295 4.368507       2.747698 32.28000 10.03477 18.73583 5.593118 13.54416       11.48823 
1 1 1 9   22 20 o 84.40658 3.090336 87.21057       6.345770 0.000000       0.000000 87.21057       6.345770 ?        ?        84.40658 3.090336 0.000000       3.090336 
1 1 1 9   22 21 o 71.75468 2.877979 63.03262       5.022175 67.09382       12.86631 62.30262       5.454897 73.12132 7.318871 71.30421 3.147070 1.817101       7.966801 
1 1 1 9   22 22 o 58.16601 3.806153 41.65962       5.365364 35.66285       10.48750 43.78559       6.244414 52.68272 8.454915 59.54767 4.332838 -6.864944      9.500478 
1 1 1 9   22 23 o 78.69167 4.164087 76.32078       7.956754 0.000000       0.000000 76.32078       7.956754 ?        ?        78.69167 4.164087 0.000000       4.164087 
1 1 1 9   22 24 o 80.38117 2.607313 79.12701       5.100452 83.05183       9.017385 77.28062       6.184893 81.93822 4.533715 79.33353 3.205788 2.604698       5.552625 
1 1 1 9   22 25 o 81.57581 2.652148 81.57717       5.265233 95.41096       9.383922 75.22086       6.360865 87.77610 4.401084 78.18800 3.346150 9.588097       5.528677 
1 1 1 9   22 26 o 57.47645 2.806470 40.62585       3.918967 36.67658       6.527481 42.85170       4.900455 54.05261 5.012667 58.90230 3.428860 -4.849689      6.073212 
1 1 1 9   22 27 o 34.33635 4.801305 14.98359       3.907764 17.92913       5.621047 12.22839       5.436403 37.06646 6.457564 30.22095 7.433962 6.845514       9.847027 
1 1 1 9   22 28 o 43.69024 3.394825 23.74973       3.586069 30.31388       6.257494 20.53961       4.375941 48.69720 5.361651 40.27686 4.537262 8.420341       7.023820 
1 1 1 9   22 29 o 10.73296 4.821087 -1.070092      2.627455 -5.746946      6.798324 -0.2488319     2.848822 15.27180 7.173944 12.01891 5.223503 3.252889       8.874145 
1 1 1 9   22 30 o 59.22863 4.281044 44.56098       6.137291 36.48357       10.63183 48.59772       7.516006 50.24389 9.014588 61.37230 5.070701 -11.12840      10.34286 
1 1 1 9   22 31 o 36.93576 4.673135 17.77853       4.112223 17.91273       5.771672 17.64016       5.860467 35.81739 6.862326 35.42417 7.036973 0.3932228      9.829064 
1 1 1 9   22 32 f 40.08575 4.503748 21.05433       4.323452 19.60205       6.091704 22.52834       6.137120 36.91901 7.027635 40.05457 6.510869 -3.135559      9.580139 
1 1 1 9   22 33 o 24.69575 5.982987 8.773908       3.562254 19.77197       5.491677 0.7847461      4.680558 37.16004 6.288553 15.28415 6.668231 21.87589       9.165762 
1 1 1 9   22 34 f 19.12180 6.361490 5.421048       3.466819 7.768021       5.000938 3.249634       4.810263 21.95403 7.634796 17.12332 7.080307 4.830711       10.41253 
1 1 1 9   22 35 o 29.30292 5.667796 12.61921       3.900883 13.58170       5.649427 11.74215       5.392873 28.01786 7.922745 26.02723 7.850902 1.990629       11.15377 
1 1 1 9   22 36 o 10.51841 5.004525 -2.840157      3.512220 3.394970       5.753878 -6.543061      4.434139 16.97068 7.398883 10.31223 5.069239 6.658450       8.968871 
1 1 1 9   22 37 o 11.54904 5.480369 -2.307968      4.156886 -1.767591      4.866644 -3.765928      7.993814 12.67358 5.988996 14.50455 7.060266 -1.830971      9.258263 
1 1 1 9   22 38 o 14.05124 5.933013 2.541178       3.484854 12.20871       5.243137 -5.109181      4.664169 24.04967 7.814382 10.70732 5.250379 13.34235       9.414406 
1 1 1 9   22 39 o 13.30727 5.782596 2.072702       3.490253 1.617223       5.216885 2.441770       4.696028 14.00455 6.479186 14.25686 6.421108 -0.2523136     9.121978 
1 1 1 9   23 0  o 93.96711 2.684286 107.7692       6.140382 101.1213       8.902905 113.8008       8.480137 90.92086 4.028205 96.49830 3.612556 -5.577438      5.410822 
1 1 1 9   23 1  o 116.4040 3.097490 165.4126       8.778650 175.2978       17.28662 161.9774       10.19046 119.5351 5.953156 115.1464 3.636237 4.388763       6.975836 
1 1 1 9   23 2  o 312.4276 4.447097 1192.355       33.85806 1263.129       54.90630 1148.930       43.00878 320.9608 7.019949 306.4230 5.759697 14.53787       9.080407 
1 1 1 9   23 3  o 156.5049 2.928133 298.7816       11.16747 322.2132       17.66844 283.1932       14.41110 162.3426 4.470366 152.2525 3.887333 10.09013       5.924149 
1 1 1 9   23 4  o 80.45500 3.189649 79.10362       6.241234 80.61863       7.815757 76.43729       10.36862 81.15848 3.963845 78.86098 5.428504 2.297501       6.721661 
1 1 1 9   23 5  o 203.2519 3.762104 504.3724       18.63380 525.8143       25.85086 481.1827       26.88382 207.3498 5.116055 198.2091 5.571376 9.140762       7.564010 
1 1 1 9   23 6  o 69.10377 2.680652 58.33411       4.505612 66.02768       6.826019 52.39422       5.997814 73.43519 3.827621 65.39740 3.779641 8.037788       5.379253 
1 1 1 9   23 7  o 184.0440 3.371149 413.4404       15.11944 435.6012       22.14062 394.0760       20.69659 188.6785 4.819333 179.4671 4.736500 9.211365       6.757248 
1 1 1 9   23 8  o 275.2242 3.977705 925.3114       26.67813 948.4272       42.67064 910.4772       34.18274 278.1077 6.296223 272.7759 5.142387 5.331787       8.129364 
1 1 1 9   23 9  o 141.8179 3.461307 245.5611       11.96210 248.8878       22.79944 244.2975       14.05144 142.2431 6.595391 141.3374 4.083977 0.9057770      7.757452 
1 1 1 9   23 10 o 121.3227 4.139028 180.1063       12.21913 195.9225       19.19522 169.3307       15.84394 126.2089 6.260727 117.4319 5.552295 8.776978       8.368075 
1 1 1 9   23 11 o 66.63673 4.136106 54.48764       6.683367 38.99834       10.14622 66.35938       8.882715 55.75868 7.670184 73.45740 4.991854 -17.69872      9.151521 
1 1 1 9   23 12 o 89.28984 2.724387 97.37823       5.921048 91.09306       13.36746 98.91238       6.604267 85.87244 6.434710 89.96667 3.016626 -4.094238      7.106724 
1 1 1 9   23 13 o 97.19656 3.232358 115.4945       7.645428 124.9692       15.37093 112.3799       8.812930 100.6529 6.298251 95.81606 3.781810 4.836807       7.346431 
1 1 1 9   23 14 o 130.4061 2.929378 207.6138       9.309137 185.9673       20.03050 213.5773       10.51354 122.7292 6.723102 132.2345 3.262631 -9.505318      7.472942 
1 1 1 9   23 15 o 82.14212 2.707795 82.44862       5.412824 77.89734       13.37990 83.33925       5.918784 79.18643 7.005919 82.56341 2.946494 -3.376976      7.600311 
1 1 1 9   23 16 o 130.2160 2.963550 207.0829       9.404005 190.2941       20.67213 211.4639       10.55993 124.0160 6.867050 131.5089 3.297711 -7.492920      7.617826 
1 1 1 9   23 17 o 103.7303 2.803331 131.4959       7.079750 127.8450       16.86194 132.2772       7.800635 101.5275 6.855542 104.0061 3.081158 -2.478645      7.516115 
1 1 1 9   23 18 f 129.9516 2.973516 206.3389       9.416465 219.6304       22.13162 203.4009       10.40528 133.1084 6.845939 128.9374 3.314354 4.171021       7.606039 
1 1 1 9   23 19 o 56.59471 3.015526 39.25963       4.143853 36.81603       11.10739 39.65473       4.466309 53.60673 8.808364 56.85400 3.237054 -3.247276      9.384337 
1 1 1 9   23 20 o 55.59370 3.004771 37.89729       4.055609 37.89212       10.37064 37.89822       4.406535 54.55648 8.041384 55.56225 3.268921 -1.005768      8.680420 
1 1 1 9   23 21 o 63.54833 4.425442 49.86446       6.810434 0.000000       0.000000 49.86446       6.810434 ?        ?        63.54833 4.425442 0.000000       4.425442 
1 1 1 9   23 22 o 43.68496 5.109925 23.86655       5.337136 0.000000       0.000000 23.86655       5.337136 ?        ?        43.68496 5.109925 0.000000       5.109925 
1 1 1 9   23 23 o 46.02099 3.437315 26.12844       3.827040 16.17827       9.774038 27.93016       4.159120 35.00412 10.57161 47.55931 3.615736 -12.55519      11.17285 
1 1 1 9   23 24 o 14.55734 5.669425 1.676360       2.894664 -1.286568      7.549092 2.187093       3.134233 19.12240 8.402228 15.62265 5.947147 3.499753       10.29398 
1 1 1 9   23 25 o 12.36899 5.148436 0.4830797      2.567138 -1.851468      4.797509 1.419719       3.038790 14.58657 6.536249 14.43399 5.750648 0.1525822      8.705889 
1 1 1 9   23 26 o 51.92510 3.002450 33.27135       3.782973 35.94769       6.683384 32.00966       4.588830 53.32776 5.209236 50.75177 3.736546 2.575996       6.410766 
1 1 1 9   23 27 o 62.09377 3.635022 47.93292       5.476305 48.73756       7.132707 46.77752       8.547100 62.18574 4.742593 60.38169 5.883201 1.804050       7.556735 
1 1 1 9   23 28 o 38.69647 3.697220 18.80013       3.444105 19.07680       5.805726 18.64989       4.278198 37.86919 6.526814 38.20253 4.694059 -0.3333435     8.039495 
1 1 1 9   23 29 o 63.36361 3.067718 49.93644       4.722795 43.06165       7.824157 53.87708       5.923676 57.43631 5.663659 65.50926 3.726036 -8.072956      6.779408 
1 1 1 9   23 30 o 45.35643 3.562368 25.98140       3.905860 32.40643       9.373171 24.63129       4.296682 47.24553 8.451513 43.92592 4.059911 3.319607       9.376084 
1 1 1 9   23 31 o 38.10135 3.638352 18.54353       3.337191 17.50284       6.006858 19.00814       4.013584 34.72947 7.328336 38.18855 4.392753 -3.459080      8.544050 
1 1 1 9   23 32 o 28.53670 5.406746 11.26549       3.622300 13.02928       5.271205 9.687340       4.986090 29.31877 7.383265 25.14363 7.541089 4.175140       10.55370 
1 1 1 9   23 33 o 11.77221 5.300263 -0.6922657     3.196602 -1.483133      4.736094 -0.3053247E-01 4.332213 13.58745 6.245513 14.02243 6.252333 -0.4349823     8.837314 
1 1 1 9   23 34 o 12.41701 5.594702 -0.4630020     3.569115 -0.3484306     5.797887 -0.5329106     4.528946 15.21287 6.961927 13.69469 6.223056 1.518185       9.337819 
1 1 1 9   23 35 o 19.09863 6.335096 5.755831       3.438712 8.263675       5.035979 3.565092       4.706836 21.63935 7.651094 16.73323 6.968668 4.906120       10.34899 
1 1 1 9   23 36 o 17.94163 6.382959 5.271384       3.509655 8.315682       5.171992 2.673050       4.778172 20.88927 7.703306 15.55690 6.762971 5.332369       10.25079 
1 1 1 9   23 37 o 20.93759 7.378490 8.693790       4.680494 7.709697       5.497188 11.28744       8.924382 19.27890 7.716595 20.29394 9.015742 -1.015045      11.86716 
1 1 1 9   23 38 o 14.85143 6.124919 3.439740       3.587064 8.443626       5.386718 -0.5470294     4.808185 19.32093 7.669871 12.71902 5.992904 6.601912       9.733541 
1 1 1 9   23 39 o 11.08762 5.270194 -1.433614      3.875951 4.502647       5.244498 -8.578473      5.753661 15.60018 6.921999 10.54831 5.281773 5.051874       8.706962 
1 1 1 9   24 0  o 74.44009 2.837722 67.69220       5.138270 70.05857       7.741629 65.82895       6.869514 75.61665 4.217969 73.32572 3.858018 2.290924       5.716255 
1 1 1 9   24 1  o 184.1836 3.165383 413.9316       14.20736 392.8271       21.32806 430.7668       19.04901 179.1838 4.889029 187.7941 4.162503 -8.610306      6.420984 
1 1 1 9   24 2  o 145.3193 2.892461 257.6212       10.24299 260.7321       15.62860 255.2787       13.56182 146.0119 4.397348 144.5379 3.853787 1.474045       5.847081 
1 1 1 9   24 3  o 169.8405 3.046922 351.9579       12.61068 320.2589       18.41882 379.9291       17.30193 161.7929 4.676512 176.3692 4.025646 -14.57631      6.170542 
1 1 1 9   24 4  o 93.38359 2.730347 106.4668       6.206660 101.9180       8.920473 110.7353       8.641271 91.25696 4.021180 95.15765 3.733718 -3.900688      5.487307 
1 1 1 9   24 5  o 179.0726 3.127620 391.3256       13.64832 380.4941       20.51997 399.9189       18.27737 176.3304 4.779849 180.9219 4.145591 -4.591537      6.327154 
1 1 1 9   24 6  o 84.78446 3.014465 87.82935       6.218288 87.86913       8.101869 87.77235       9.700411 84.72144 3.934990 84.58710 4.724754 0.1343460      6.148776 
1 1 1 9   24 7  o 131.2671 2.922975 210.2608       9.350117 200.4512       12.97981 220.8418       13.48053 128.0040 4.166656 134.3691 4.121784 -6.365021      5.860898 
1 1 1 9   24 8  o 124.1842 3.302511 188.4069       9.985296 199.2271       12.49779 169.3085       16.60404 127.6217 4.023607 117.3790 5.822979 10.24274       7.077888 
1 1 1 9   24 9  o 140.6144 2.697823 241.2485       9.244415 263.4924       14.87098 227.2387       11.80185 146.7562 4.162420 136.3554 3.554777 10.40082       5.473772 
1 1 1 9   24 10 o 102.3463 2.875342 127.9396       7.164193 127.2412       15.60285 128.1261       8.064570 101.5937 6.333837 102.3879 3.236251 -0.7942429     7.112721 
1 1 1 9   24 11 o 238.6907 4.766921 697.5126       27.72742 675.8223       47.77763 708.5278       34.04760 233.6345 8.405430 240.2888 5.814562 -6.654282      10.22059 
1 1 1 9   24 12 o 93.89030 4.650145 108.1880       10.60645 124.7205       15.04612 91.85767       14.95386 100.5639 6.169380 86.04237 7.197788 14.52158       9.479947 
1 1 1 9   24 13 o 167.5757 3.950202 343.4152       16.13119 292.2421       26.77916 372.5590       20.20919 153.7835 7.165505 174.3333 4.761450 -20.54979      8.603248 
1 1 1 9   24 14 o 114.2080 3.544603 159.5838       9.853131 165.3653       18.34947 157.2413       11.67985 115.6976 6.534800 113.2656 4.239067 2.431984       7.789307 
1 1 1 9   24 15 o 38.21603 3.314908 17.98082       3.056614 24.73664       9.140656 17.13026       3.243326 43.84504 8.860211 37.25616 3.617867 6.588879       9.570387 
1 1 1 9   24 16 o 120.9567 2.924757 178.7146       8.620961 169.8693       19.26746 180.9287       9.639728 117.0945 6.781317 121.6240 3.255368 -4.529503      7.522213 
1 1 1 9   24 17 o 104.8999 2.812077 134.5180       7.182014 144.6747       17.26040 132.3913       7.898227 108.0147 6.588748 104.0274 3.119152 3.987259       7.289767 
1 1 1 9   24 18 o 33.09176 3.827888 13.58750       3.029996 9.747117       9.048255 14.07254       3.215655 29.26507 10.26334 33.65789 3.998601 -4.392826      11.01476 
1 1 1 9   24 19 o 84.80230 3.581432 88.21708       7.384508 92.47359       14.32177 86.67564       8.618497 86.06458 6.886072 83.94578 4.226649 2.118797       8.079762 
1 1 1 9   24 20 o 136.1566 4.467968 228.1436       14.80459 0.000000       0.000000 228.1436       14.80459 ?        ?        136.1566 4.467968 0.000000       4.467968 
1 1 1 9   24 21 o 100.1892 3.560805 123.2529       8.679892 129.2938       16.81246 121.0575       10.13507 101.5912 6.830781 99.14175 4.204567 2.449501       8.021094 
1 1 1 9   24 22 o 26.25025 5.341252 8.836601       3.300357 0.000000       0.000000 8.836601       3.300357 ?        ?        26.25025 5.341252 0.000000       5.341252 
1 1 1 9   24 23 o 31.36828 4.413876 12.38234       3.280827 21.68739       9.049188 10.97413       3.520343 40.20538 9.404517 29.33879 5.109426 10.86659       10.70286 
1 1 1 9   24 24 o 30.09841 4.480776 11.46017       3.186445 7.688372       8.360035 12.10126       3.446622 26.35115 9.779919 30.88400 4.729944 -4.532848      10.86366 
1 1 1 9   24 25 f 40.82392 3.712212 20.75994       3.652690 9.799236       8.593462 23.17690       4.035374 28.09254 9.988556 43.11025 3.882765 -15.01771      10.71667 
1 1 1 9   24 26 o 85.35513 3.351248 90.16428       6.957087 80.84050       8.845979 105.2824       11.26416 80.29475 4.539364 91.34733 5.080204 -11.05258      6.812804 
1 1 1 9   24 27 o 44.79536 3.966483 25.22821       4.285165 29.84089       6.371553 21.41869       5.790332 48.08260 5.538863 40.41684 6.066086 7.665760       8.214402 
1 1 1 9   24 28 o 37.66965 3.533731 17.84490       3.205979 17.65568       5.617432 17.93630       3.904279 36.14163 6.622098 37.47052 4.356936 -1.328888      7.926858 
1 1 1 9   24 29 o 45.24351 3.492434 25.79093       3.820745 27.62823       9.382454 25.42568       4.183317 43.00162 9.229706 44.75209 3.874053 -1.750469      10.00978 
1 1 1 9   24 30 o 49.79308 3.716144 31.57390       4.476662 44.47747       10.31104 28.57665       4.969459 55.39095 7.859230 46.95811 4.393744 8.432835       9.004026 
1 1 1 9   24 31 o 13.30856 5.318162 1.531802       2.606672 6.098515       4.881061 -0.2902535     3.083139 20.79770 7.512010 12.10568 5.342406 8.692017       9.218003 
1 1 1 9   24 32 o 16.43763 5.450311 3.701013       2.545324 2.008440       4.672585 4.415182       3.035178 16.12632 6.842384 17.73884 5.953287 -1.612513      9.069721 
1 1 1 9   24 33 o 28.01690 4.486990 10.74335       2.960107 11.78073       6.714594 10.49310       3.297866 25.36945 8.845208 27.21955 5.160630 -1.850098      10.24060 
1 1 1 9   24 34 o 14.43264 5.298643 2.747606       2.442507 2.502875       4.663694 2.840104       2.867177 15.90696 6.795396 14.86509 5.681010 1.041878       8.857273 
1 1 1 9   24 35 o 11.79100 5.302347 -0.1226731     3.188277 -1.415298      4.803066 0.8955642      4.262917 13.02613 6.090338 13.91567 6.203598 -0.8895435     8.693494 
1 1 1 9   24 36 o 11.44280 5.246936 -0.5275611     3.314998 2.816114       4.953155 -3.240416      4.461523 15.45234 6.797221 11.42283 5.489806 4.029509       8.737287 
1 1 1 9   24 37 o 17.54939 6.924261 5.858073       4.365615 13.16270       5.190125 -11.81164      8.072227 25.24397 7.719962 12.11400 6.091942 13.12997       9.834103 
1 1 1 9   24 38 o 14.93034 6.299600 3.644132       3.924143 -1.701734      5.163900 10.95049       6.036971 12.31346 5.914810 20.58790 8.136490 -8.274434      10.05920 
1 1 1 9   25 0  o 113.7600 2.768605 157.8734       7.675143 181.7491       12.14905 142.0155       9.901194 121.9039 4.095490 107.7739 3.775803 14.12996       5.570433 
1 1 1 9   25 1  f 125.7783 3.074668 193.0530       9.424101 176.5219       12.42888 215.4122       14.45473 120.1149 4.252899 132.6751 4.477207 -12.56023      6.175155 
1 1 1 9   25 2  o 114.4178 3.487642 159.9780       9.713021 156.7348       15.50613 162.0723       12.46053 112.9829 5.649825 115.0601 4.452421 -2.077217      7.193370 
1 1 1 9   25 3  o 184.3378 3.529072 414.8973       15.85299 440.5797       22.55260 389.8123       22.28875 189.7151 4.882246 178.3986 5.132273 11.31648       7.083541 
1 1 1 9   25 4  o 43.59039 3.920210 23.39922       4.119809 23.52950       5.233183 23.18688       6.681087 43.56554 5.021055 42.97903 6.588808 0.5865097      8.283923 
1 1 1 9   25 5  o 53.02176 3.217011 34.44285       4.137086 37.37108       5.653935 31.06824       6.069602 55.13206 4.240904 50.13403 5.036262 4.998039       6.584011 
1 1 1 9   25 6  o 114.8387 2.485064 160.8710       6.954437 167.2455       11.43440 157.1286       8.761148 116.9159 4.019296 113.4103 3.173215 3.505623       5.120941 
1 1 1 9   25 7  o 75.78989 2.988733 70.21680       5.509120 69.11282       7.179048 71.79815       8.592128 75.10069 3.936460 76.46803 4.632622 -1.367340      6.079218 
1 1 1 9   25 8  o 192.9990 3.557996 455.0064       16.73388 459.6123       23.36522 450.1561       23.97720 193.6809 4.954546 191.6365 5.138974 2.044388       7.138387 
1 1 1 9   25 9  o 165.2027 3.203123 333.2529       12.89517 351.8800       24.84169 326.3823       15.08706 169.1895 6.034869 163.4209 3.788442 5.768539       7.125443 
1 1 1 9   25 10 o 71.33780 3.803714 62.37987       6.588564 63.24964       12.03008 62.00721       7.874543 71.33197 7.011168 71.02926 4.573687 0.3027115      8.371086 
1 1 1 9   25 11 o 92.27779 2.887711 104.0538       6.485628 126.0181       15.19549 99.16129       7.171669 101.0660 6.199670 90.04239 3.273865 11.02358       7.010999 
1 1 1 9   25 12 o 133.1874 3.020491 216.6235       9.803399 220.5385       21.26798 215.5672       11.04698 133.6779 6.548689 132.7771 3.417002 0.9007111      7.386558 
1 1 1 9   25 13 o 88.37614 2.797908 95.45466       6.018065 109.6330       14.46969 92.48911       6.617574 94.15543 6.343367 86.95779 3.127968 7.197632       7.072658 
1 1 1 9   25 14 o 42.38553 3.228779 22.08027       3.309874 31.77300       9.218027 20.64564       3.546373 50.07231 7.809173 40.93342 3.591611 9.138889       8.595514 
1 1 1 9   25 15 o 92.42764 3.544822 104.6431       7.969418 125.5318       15.62778 97.30190       9.264580 100.6749 6.403192 89.01149 4.283712 11.66343       7.703963 
1 1 1 9   25 16 o 129.9958 3.669874 206.9877       11.61399 202.9742       20.97732 208.7617       13.94651 127.9320 6.752670 130.4043 4.394997 -2.472290      8.056956 
1 1 1 9   25 17 o 53.24479 4.155280 34.96522       5.348882 31.38516       10.55226 36.20316       6.205142 49.29742 9.119667 54.08549 4.756381 -4.788078      10.28550 
1 1 1 9   25 18 o 13.35534 6.044728 -2.297363      4.221704 0.000000       0.000000 -2.297363      4.221704 ?        ?        13.35534 6.044728 0.000000       6.044728 
1 1 1 9   25 19 o 137.7907 3.766665 233.0181       12.63588 250.1428       23.72001 226.2330       14.93076 141.5841 6.895606 135.5510 4.526397 6.033035       8.248494 
1 1 1 9   25 20 o 106.1956 2.925581 138.1313       7.563811 124.4302       16.84038 141.5938       8.465774 99.56123 6.985384 107.4568 3.236623 -7.895531      7.698787 
1 1 1 9   25 21 o 16.02869 5.710442 2.763988       2.809985 8.047465       8.226142 2.066046       2.989828 26.88222 9.746225 15.26372 5.809000 11.61850       11.34607 
1 1 1 9   25 22 o 49.85457 3.213100 30.63386       3.882815 31.17189       9.833818 30.53448       4.226199 48.68043 8.604195 49.71849 3.510731 -1.038059      9.292869 
1 1 1 9   25 23 f 19.95370 5.877745 5.089511       3.050793 0.000000       0.000000 5.089511       3.050793 ?        ?        19.95370 5.877745 0.000000       5.877745 
1 1 1 9   25 24 o 28.76814 5.099428 10.64090       3.444076 24.30704       8.565602 8.005414       3.761536 42.43039 8.579342 24.66707 6.250914 17.76332       10.61504 
1 1 1 9   25 25 o 36.42860 4.367202 16.77561       3.799690 11.16709       8.496787 18.17756       4.248129 28.99983 9.957961 37.83300 4.709440 -8.833168      11.01544 
1 1 1 9   25 26 o 18.13530 6.604473 3.689184       3.783235 10.26136       7.171872 1.155257       4.453229 27.44831 9.150227 16.19251 6.763563 11.25579       11.37860 
1 1 1 9   25 27 o 17.34441 5.889733 3.715648       2.970792 17.43661       7.992251 1.515925       3.200080 34.48364 9.299550 14.56983 5.868227 19.91381       10.99626 
1 1 1 9   25 28 o 39.42291 3.500257 19.60543       3.327756 24.84176       5.837857 17.08498       4.050220 43.30758 5.667495 36.29173 4.689170 7.015850       7.355870 
1 1 1 9   25 29 o 53.02035 3.325445 35.44617       4.274997 27.06666       9.186879 37.76216       4.829776 41.84290 9.255384 54.54277 3.654833 -12.69987      9.950876 
1 1 1 9   25 30 o 22.57322 5.815905 7.177701       3.219015 21.23940       8.813397 5.013094       3.457912 35.42987 9.851923 19.06280 6.353611 16.36707       11.72300 
1 1 1 9   25 31 o 20.26951 5.271516 5.792207       2.627976 3.075601       4.706122 7.023174       3.167912 17.19003 7.044517 22.07325 5.810902 -4.883221      9.131911 
1 1 1 9   25 32 o 13.68895 5.296319 2.086713       2.513499 4.893898       5.890121 1.461714       2.779256 19.12696 7.864298 13.19241 5.410743 5.934550       9.545854 
1 1 1 9   25 33 o 10.83464 4.758553 0.2986321E-01  2.418904 2.345315       5.097668 -0.6429877     2.747977 16.21660 7.017859 10.81685 4.888142 5.399751       8.552444 
1 1 1 9   25 34 f 23.07959 4.900156 7.741648       2.670686 6.223500       5.148235 8.300621       3.123897 19.14600 7.530025 23.37721 5.564304 -4.231211      9.362840 
1 1 1 9   25 35 o 12.85217 5.124705 1.946805       2.415250 0.9224244E-02  4.946855 2.553243       2.767530 13.74808 6.342309 13.97186 5.512989 -0.2237787     8.403448 
1 1 1 9   25 36 o 7.377451 3.639245 -4.139546      2.352617 4.667935       4.621546 -7.220188      2.733266 16.52356 6.895146 6.975084 3.512511 9.548479       7.738267 
1 1 1 9   25 37 o 19.23680 7.184795 7.760269       4.525739 8.269011       5.267184 6.325161       8.846517 19.13055 7.587507 17.05486 8.063983 2.075684       11.07240 
1 1 1 9   26 0  o 160.1076 4.019821 313.4278       15.67152 325.1812       26.18659 306.8694       19.56115 162.6057 6.622420 158.2588 5.078705 4.346909       8.345639 
1 1 1 9   26 1  o 135.1849 2.874513 223.0001       9.469536 232.8295       14.50574 215.7002       12.50072 137.9369 4.320750 132.8187 3.866359 5.118210       5.798070 
1 1 1 9   26 2  o 120.1911 2.784009 176.2642       8.154152 185.4030       12.37591 169.2534       10.83962 123.0944 4.131602 117.6457 3.785889 5.448730       5.603847 
1 1 1 9   26 3  o 24.89285 5.410883 7.883693       3.188426 6.638956       4.121324 9.739334       5.032050 23.08200 6.840006 27.64861 7.344860 -4.566618      10.03657 
1 1 1 9   26 4  o 90.45364 2.760238 99.93002       6.077154 92.77749       8.549695 107.2341       8.639801 87.03111 4.042295 93.60730 3.795417 -6.576195      5.544847 
1 1 1 9   26 5  o 75.23512 2.919706 69.18807       5.342822 67.55742       7.608479 70.77441       7.504378 74.21161 4.224619 75.98167 4.067763 -1.770058      5.864649 
1 1 1 9   26 6  o 83.17993 2.555865 84.49529       5.174603 85.40475       7.998446 83.84064       6.786085 83.49665 3.942108 82.78700 3.370778 0.7096481      5.186749 
1 1 1 9   26 7  o 22.12671 5.502329 6.239858       2.954403 8.542039       3.976861 3.404417       4.413479 25.85865 6.356603 19.04573 7.098754 6.812918       9.528836 
1 1 1 9   26 8  o 173.8661 3.024737 369.0748       12.81559 364.7829       19.73264 372.2058       16.85388 172.5434 4.697370 174.4757 3.963956 -1.932220      6.146400 
1 1 1 9   26 9  o 76.02536 2.907435 70.66428       5.376547 67.00409       6.985159 75.98512       8.421992 73.92592 3.891128 78.67155 4.410659 -4.745636      5.881733 
1 1 1 9   26 10 o 63.14824 3.797309 48.93353       5.816506 61.40217       11.09741 44.21081       6.829795 70.32581 6.550802 59.89141 4.717646 10.43440       8.072743 
1 1 1 9   26 11 o 124.1125 3.022769 188.1313       9.142325 209.6317       20.39883 182.7272       10.22696 130.3163 6.443462 122.2270 3.436960 8.089310       7.302801 
1 1 1 9   26 12 o 105.4290 2.897126 135.8493       7.436208 136.6957       16.41803 135.6308       8.340797 105.1283 6.439529 105.3019 3.254293 -0.1736603     7.215120 
1 1 1 9   26 13 o 11.31583 4.957186 -0.6197528     2.609982 -1.497754      7.386283 -0.4944845     2.789965 19.06125 8.345063 11.86544 5.162892 7.195815       9.813029 
1 1 1 9   26 14 o 24.67855 5.006677 7.746389       2.907892 8.405313       8.273634 7.653522       3.106055 27.60367 9.802324 24.48332 5.355367 3.120344       11.16985 
1 1 1 9   26 15 o 101.7219 2.867146 126.5317       7.100138 122.3187       16.60765 127.4739       7.854093 99.15511 6.916534 102.0607 3.161736 -2.905563      7.604934 
1 1 1 9   26 16 o 190.4761 4.005035 444.7554       18.59015 0.000000       0.000000 444.7554       18.59015 ?        ?        190.4761 4.005035 0.000000       4.005035 
1 1 1 9   26 17 o 213.1536 3.784433 556.9798       19.65756 543.3458       40.93160 561.0671       22.41124 208.1424 8.085163 213.7443 4.302643 -5.601883      9.158745 
1 1 1 9   26 18 o 63.84149 2.903501 49.96299       4.505290 41.63040       11.07349 51.61589       4.931934 57.01594 8.205912 64.85968 3.129608 -7.843739      8.782451 
1 1 1 9   26 19 o 27.63772 4.486774 9.642549       2.918310 -2.918221      7.995851 11.57290       3.134543 18.90100 8.456218 30.36190 4.361553 -11.46090      9.514766 
1 1 1 9   26 20 o 99.32349 2.875886 120.9348       6.953480 109.9654       15.63022 123.6415       7.764106 93.35356 6.919856 100.3626 3.178566 -7.009071      7.614965 
1 1 1 9   26 21 o 77.87193 2.894200 74.45187       5.482634 76.42808       13.30534 74.04768       6.017232 77.44704 7.129902 77.59705 3.188906 -0.1500092     7.810546 
1 1 1 9   26 22 f 44.48676 3.438212 24.50974       3.698439 31.50151       9.204267 23.16350       4.038833 48.93892 7.993583 43.14334 3.883050 5.795574       8.886813 
1 1 1 9   26 23 o 36.03749 4.180254 16.31975       3.603051 26.58139       8.811685 14.25962       3.948195 44.46106 8.441497 33.43190 4.999496 11.02916       9.810904 
1 1 1 9   26 24 o 67.99647 4.298890 57.87909       7.086795 0.000000       0.000000 57.87909       7.086795 ?        ?        67.99647 4.298890 0.000000       4.298890 
1 1 1 9   26 25 o 32.69165 5.417420 13.91965       4.164826 6.106260       8.063502 16.76247       4.863831 24.07009 9.436696 35.79948 5.771479 -11.72939      11.06170 
1 1 1 9   26 26 o 49.59566 4.272475 31.19917       5.113394 24.62035       9.502698 33.88043       6.066563 40.84047 9.694192 51.38412 4.904242 -10.54365      10.86411 
1 1 1 9   26 27 o 38.11643 3.918790 18.48813       3.588195 17.67525       8.440288 18.66746       3.964270 33.94746 9.712114 38.12118 4.344843 -4.173717      10.63968 
1 1 1 9   26 28 o 13.42533 5.448811 1.288959       2.782796 -5.489296      6.453223 2.837345       3.084305 14.47313 6.856328 15.88689 5.931748 -1.413755      9.066138 
1 1 1 9   26 29 o 33.44913 4.251803 14.64756       3.387515 19.61537       8.035384 13.57383       3.735706 34.66828 9.313861 31.78379 4.987133 2.884489       10.56501 
1 1 1 9   26 30 o 21.68935 5.409026 6.644570       2.849088 1.789120       5.559365 8.374035       3.317922 16.93633 7.329051 24.23110 5.712733 -7.294773      9.292487 
1 1 1 9   26 31 o 24.13181 5.241592 8.269275       2.993993 10.83745       6.618166 7.608436       3.357171 24.78020 8.770150 22.66115 5.989681 2.119045       10.62035 
1 1 1 9   26 32 o 12.16745 5.018615 1.157525       2.408662 1.719041       4.702816 0.9578465      2.804418 15.47147 6.717773 12.53063 5.308138 2.940841       8.561822 
1 1 1 9   26 33 o 17.00112 5.359401 4.294497       2.480255 7.549296       4.940231 3.197631       2.867886 20.76536 7.549356 15.25645 5.715076 5.508907       9.468625 
1 1 1 9   26 34 o 8.341735 3.987871 -2.352620      2.286174 9.518067       4.899278 -5.656951      2.584853 22.47186 7.563807 7.309209 3.641263 15.16265       8.394639 
1 1 1 9   26 35 o 8.051997 3.916214 -3.262498      2.445820 1.599678       4.794523 -4.972876      2.843650 14.33230 6.468606 8.035582 3.970801 6.296722       7.590134 
1 1 1 9   26 36 o 10.46164 4.750951 -0.2002091     2.634602 -8.058788      4.976582 2.859913       3.105479 10.07727 5.025358 14.10085 5.743767 -4.023582      7.631846 
1 1 1 9   27 0  o 165.3201 3.084620 333.6335       12.42691 329.8628       18.92725 336.4905       16.47537 164.1075 4.737813 165.9109 4.074967 -1.803406      6.249179 
1 1 1 9   27 1  f 96.41055 3.228757 113.6168       7.575004 132.5674       14.78780 106.8752       8.820058 103.7881 5.870759 93.43546 3.882135 10.35267       7.038238 
1 1 1 9   27 2  o 128.4311 3.227650 201.5295       10.09366 182.0534       12.91217 232.1310       16.18523 121.9235 4.352842 137.6163 4.833792 -15.69276      6.504827 
1 1 1 9   27 3  o 139.8266 3.208030 238.7337       10.93111 234.8504       14.83489 243.3469       16.16898 138.4854 4.401453 140.9191 4.715077 -2.433685      6.450173 
1 1 1 9   27 4  o 202.2148 3.380313 499.4452       16.65735 497.8883       25.41136 500.6182       22.05722 201.5046 5.179252 202.2673 4.474957 -0.7627869     6.844698 
1 1 1 9   27 5  o 119.1680 3.126326 173.5205       9.070991 161.7592       11.81955 190.3748       14.14909 114.9193 4.227781 124.6144 4.667585 -9.695068      6.297657 
1 1 1 9   27 6  o 180.0838 2.902339 395.9009       12.73675 371.8130       20.53584 410.9596       16.23701 174.1563 4.843499 183.3773 3.633493 -9.221024      6.054895 
1 1 1 9   27 7  o 313.8950 5.017588 1207.716       38.38092 1253.178       54.98127 1164.506       53.60263 318.8119 7.076916 307.2840 7.158302 11.52789       10.06598 
1 1 1 9   27 8  o 96.32099 2.967880 113.3974       6.958009 125.2201       9.534683 99.92844       10.17690 101.1143 3.876706 90.20277 4.645422 10.91153       6.050519 
1 1 1 9   27 9  o 113.3033 2.609852 156.6978       7.206007 132.9550       10.36668 178.8954       10.02364 104.1530 4.092397 120.9401 3.404486 -16.78703      5.323368 
1 1 1 9   27 10 o 58.17892 3.367728 41.50814       4.754212 41.26921       9.958622 41.57867       5.410581 57.33928 7.291774 58.17286 3.838140 -0.8335762     8.240224 
1 1 1 9   27 11 o 102.3184 2.985312 128.0041       7.435581 122.1929       15.68991 129.6872       8.444016 99.31457 6.518974 102.9406 3.370640 -3.625984      7.338817 
1 1 1 9   27 12 o 57.76943 3.697391 41.00275       5.177783 61.13506       10.95924 35.21752       5.874812 70.08395 6.490637 53.39773 4.558311 16.68623       7.931366 
1 1 1 9   27 13 o 86.16003 3.986973 91.12377       8.348457 0.000000       0.000000 91.12377       8.348457 ?        ?        86.16003 3.986973 0.000000       3.986973 
1 1 1 9   27 14 o 130.3932 3.434463 208.1986       10.90365 0.000000       0.000000 208.1986       10.90365 ?        ?        130.3932 3.434463 0.000000       3.434463 
1 1 1 9   27 15 o 130.7284 3.018206 209.0032       9.615129 189.1803       20.05054 214.9230       10.95719 123.3129 6.697530 132.4588 3.397357 -9.145844      7.509923 
1 1 1 9   27 16 o 141.8818 3.100863 246.3419       10.72125 257.0280       23.66307 243.5816       12.02648 143.6093 6.780799 141.0013 3.500091 2.608002       7.630850 
1 1 1 9   27 17 o 105.5750 2.888777 136.4846       7.425111 116.2320       15.91656 142.1180       8.394508 96.31369 6.825713 107.6727 3.202850 -11.35902      7.539801 
1 1 1 9   27 18 o 47.66597 3.227075 27.97591       3.726368 26.91438       9.729729 28.15838       4.033942 45.19067 9.149416 47.78002 3.488593 -2.589355      9.791941 
1 1 1 9   27 19 o 105.0268 2.894588 135.2597       7.401311 115.5334       15.94307 140.6789       8.356334 95.63969 6.886768 107.0348 3.207338 -11.39515      7.597013 
1 1 1 9   27 20 o 65.40502 2.931495 52.58088       4.660486 52.90841       11.11875 52.51107       5.133178 64.22610 7.229516 65.29955 3.235899 -1.073441      7.920666 
1 1 1 9   27 21 o 50.71927 3.411175 31.82182       4.191603 34.29210       9.581929 31.23724       4.661255 51.06716 7.959079 50.14778 3.843597 0.9193840      8.838562 
1 1 1 9   27 22 o 75.21555 3.476105 69.98728       6.354198 64.27519       12.48936 71.98222       7.380852 70.23105 7.409034 76.10002 3.994005 -5.868973      8.416999 
1 1 1 9   27 23 o 88.77905 3.449879 97.67869       7.449430 91.75015       13.84468 100.0946       8.837866 84.01541 6.820817 89.58395 4.058923 -5.568535      7.937152 
1 1 1 9   27 24 o 58.42133 3.680387 42.62769       5.213009 36.85914       9.904246 44.83815       6.130978 51.97217 8.082755 59.68625 4.242874 -7.714077      9.128686 
1 1 1 9   27 25 o 40.00506 5.486556 20.92072       5.207975 0.000000       0.000000 20.92072       5.207975 ?        ?        40.00506 5.486556 0.000000       5.486556 
1 1 1 9   27 26 o 18.58599 5.900321 4.546104       3.001449 7.913949       7.752017 3.952195       3.255358 24.60718 9.356388 17.79221 6.161385 6.814970       11.20289 
1 1 1 9   27 27 o 12.27946 5.249101 0.3021367      2.785937 -0.2058563     6.859064 0.4024989      3.048744 17.64495 7.867391 12.87288 5.496624 4.772069       9.597329 
1 1 1 9   27 28 o 13.26515 5.376241 1.349299       2.704777 -0.7902563     6.921479 1.734916       2.938430 17.06179 7.729318 14.10187 5.642651 2.959922       9.569841 
1 1 1 9   27 29 f 15.42585 5.833724 2.804971       3.003873 0.000000       0.000000 2.804971       3.003873 ?        ?        15.42585 5.833724 0.000000       5.833724 
1 1 1 9   27 30 o 32.16419 3.920897 13.67926       3.009788 18.38860       5.757713 11.90853       3.530576 34.62507 7.063300 29.18631 5.152295 5.438759       8.742788 
1 1 1 9   27 31 o 8.725773 4.113229 -1.994027      2.269618 -0.2071061     4.409607 -2.638008      2.647182 13.76318 6.208382 9.138520 4.347068 4.624656       7.578984 
1 1 1 9   27 32 o 18.84483 5.439126 5.322326       2.636122 2.955911       4.931888 6.268808       3.119062 16.36365 6.989207 20.12208 5.947283 -3.758429      9.177101 
1 1 1 9   27 33 o 10.83197 4.753743 0.2371871      2.409833 1.238029       4.845464 -0.9171969E-01 2.777724 14.61606 6.557638 11.13472 4.982687 3.481334       8.235884 
1 1 1 9   27 34 o 11.68733 5.056844 0.8549318      2.645819 -5.741885      4.961500 3.476400       3.127650 11.00192 5.398984 15.20855 5.901526 -4.206628      7.998565 
1 1 1 9   27 35 o 12.76772 5.216961 1.985284       2.571654 3.507809       5.012147 1.441251       2.996084 15.53796 6.836134 12.54253 5.403770 2.995428       8.713981 
1 1 1 9   27 36 f 26.08774 5.075847 10.68782       3.110695 15.78027       5.944040 8.767094       3.650494 26.05124 8.307117 21.78412 6.432856 4.267124       10.50666 
1 1 1 9   28 0  o 177.9224 3.195181 386.5797       13.85359 388.5728       21.16242 385.0850       18.32611 178.0495 4.882008 177.4277 4.238508 0.6218414      6.465210 
1 1 1 9   28 1  o 87.01656 2.883420 92.53139       6.105845 87.98338       8.679825 96.98658       8.590802 84.70435 4.218303 88.97376 3.972208 -4.269409      5.794180 
1 1 1 9   28 2  o 29.76712 6.320613 11.30158       4.443084 13.18797       7.718678 10.36679       5.433556 32.22305 9.309213 28.49524 7.660472 3.727804       12.05588 
1 1 1 9   28 3  o 32.16599 4.748261 12.94130       3.610163 9.220554       4.853484 17.54962       5.401447 26.89199 7.244638 37.30890 6.155507 -10.41690      9.506579 
1 1 1 9   28 4  o 63.37372 3.060462 49.15882       4.712447 43.81409       6.488871 55.12371       6.855004 59.65482 4.496730 66.98756 4.220762 -7.332737      6.167285 
1 1 1 9   28 5  o 113.8790 2.854831 158.4315       7.916216 168.2071       11.77468 150.3685       10.69367 117.1754 4.130057 110.8039 3.966772 6.371559       5.726487 
1 1 1 9   28 6  o 119.1009 2.898457 173.2115       8.412360 171.3562       12.09417 174.9505       11.70893 118.2465 4.203811 119.5102 4.026210 -1.263657      5.820858 
1 1 1 9   28 7  o 40.55054 3.800970 20.28775       3.712233 20.72417       5.264739 19.85621       5.235167 40.72796 5.440500 39.83219 5.543365 0.8957672      7.767106 
1 1 1 9   28 8  o 133.4371 2.777610 217.4262       9.032005 215.0619       13.79123 219.2018       11.95172 132.4428 4.278671 133.8223 3.668394 -1.379486      5.635969 
1 1 1 9   28 9  o 68.48599 2.751553 57.37052       4.582798 61.99064       6.783563 53.49152       6.215714 71.05627 3.932935 65.99680 3.881989 5.059464       5.526103 
1 1 1 9   28 10 o 184.4974 4.186791 417.0399       18.82381 412.3880       33.29032 419.2262       22.82265 182.2120 7.513417 184.6744 5.076160 -2.462372      9.067461 
1 1 1 9   28 11 o 117.6832 3.464494 169.5679       9.924695 0.000000       0.000000 169.5679       9.924695 ?        ?        117.6832 3.464494 0.000000       3.464494 
1 1 1 9   28 12 o 19.18153 6.469364 4.258430       3.584011 0.000000       0.000000 4.258430       3.584011 ?        ?        19.18153 6.469364 0.000000       6.469364 
1 1 1 9   28 13 o 18.68974 6.011344 4.211670       3.107627 2.534721       7.514968 4.557587       3.413127 21.89827 8.929355 19.46940 6.303210 2.428869       10.92995 
1 1 1 9   28 14 o 59.31384 3.570012 43.25849       5.136259 51.85042       10.85987 40.78278       5.829469 64.17767 7.060410 57.48509 4.190157 6.692581       8.210164 
1 1 1 9   28 15 o 22.42461 5.864479 6.456683       3.240520 8.667889       7.523461 5.953016       3.590666 27.16250 9.368586 21.69563 6.372843 5.466877       11.33064 
1 1 1 9   28 16 o 54.40200 3.447837 36.43815       4.547342 31.54754       9.205216 38.01688       5.230051 49.49567 7.897074 55.49530 3.892028 -5.999622      8.804070 
1 1 1 9   28 17 o 62.01098 3.330426 47.31149       5.014276 52.00747       10.83562 46.03184       5.656362 63.99016 7.066267 61.07063 3.819874 2.919537       8.032656 
1 1 1 9   28 18 o 61.48661 3.354295 46.57330       5.006911 43.39273       10.31845 47.55281       5.726230 58.10540 7.459058 62.03519 3.806189 -3.929787      8.374044 
1 1 1 9   28 19 o 26.74589 5.312612 9.218811       3.340490 17.98781       7.505696 7.052819       3.730306 36.63077 8.562689 23.28368 6.384441 13.34709       10.68086 
1 1 1 9   28 20 o 38.90646 4.337993 19.00264       4.043002 27.67949       8.322968 16.32284       4.625385 45.81682 7.729210 35.69991 5.492511 10.11691       9.482002 
1 1 1 9   28 21 o 36.48163 4.304281 16.77605       3.752996 9.091274       7.834099 19.06499       4.275542 26.95640 9.541712 38.83167 4.607965 -11.87526      10.59611 
1 1 1 9   28 22 o 66.39053 3.499580 54.75380       5.641852 57.99483       11.27311 53.67074       6.516692 66.44652 7.070475 65.49476 4.103672 0.9517593      8.175068 
1 1 1 9   28 23 o 71.46463 3.483501 63.60132       6.048294 54.70235       11.44876 67.04648       7.123497 63.81978 7.504785 73.12353 4.012990 -9.303745      8.510340 
1 1 1 9   28 24 o 49.72429 3.340975 30.90796       4.024853 44.23598       9.724964 28.15318       4.421278 57.18612 7.133157 47.23991 3.874652 9.946201       8.117565 
1 1 1 9   28 25 o 25.00713 5.162266 8.345107       3.041560 13.09359       7.768274 7.485363       3.305459 29.42439 9.507889 23.44403 5.814346 5.980364       11.14480 
1 1 1 9   28 26 o 20.65125 6.084675 5.885475       3.269058 0.000000       0.000000 5.885475       3.269058 ?        ?        20.65125 6.084675 0.000000       6.084675 
1 1 1 9   28 27 o 53.98042 4.100036 37.68826       5.353028 31.72848       10.28422 39.90297       6.269238 43.90400 9.854752 55.04383 4.719298 -11.13983      10.92648 
1 1 1 9   28 28 o 23.06032 5.810876 7.616868       3.263628 0.000000       0.000000 7.616868       3.263628 ?        ?        23.06032 5.810876 0.000000       5.810876 
1 1 1 9   28 29 o 22.03845 5.521712 6.996269       2.959028 15.61469       8.288570 5.737412       3.167771 28.55922 9.834129 19.76806 6.028436 8.791161       11.53482 
1 1 1 9   28 30 o 19.88759 5.583485 5.824310       2.816299 3.474060       7.012198 6.276332       3.075225 18.43961 8.100215 20.49113 5.862381 -2.051516      9.999049 
1 1 1 9   28 31 o 20.89024 5.708162 6.625487       2.987895 3.168625       8.244080 7.148227       3.205857 18.30395 8.347971 21.55568 5.921860 -3.251726      10.23509 
1 1 1 9   28 32 o 15.38917 5.546329 3.445669       2.659036 5.758059       5.285290 2.662030       3.076777 18.49409 7.508051 14.50138 5.783508 3.992718       9.477330 
1 1 1 9   28 33 o 12.02009 5.145608 1.079944       2.684154 6.441407       4.815654 -1.336424      3.232921 18.62213 7.295076 10.75475 5.017912 7.867382       8.854241 
1 1 1 9   28 34 o 11.06766 4.900361 0.3937036      2.614598 4.911490       5.243896 -1.101005      3.016264 16.76156 7.184115 10.44581 4.864779 6.315745       8.676266 
1 1 1 9   28 35 o 18.27938 5.726732 5.724519       2.836192 11.48359       5.359047 3.483894       3.342690 22.50077 7.898021 14.83011 5.988866 7.670664       9.911875 
1 1 1 9   29 0  o 23.05856 6.182293 6.764505       3.544744 6.060461       4.965259 7.496308       5.062199 22.78331 7.613931 24.66009 7.639201 -1.876787      10.78561 
1 1 1 9   29 1  o 87.42407 2.884503 93.42336       6.136817 89.45454       8.842241 97.11166       8.524042 85.38165 4.263219 89.01395 3.939385 -3.632301      5.804636 
1 1 1 9   29 2  o 93.22601 2.872116 106.2234       6.517137 104.9053       9.325920 107.4814       9.111080 92.49033 4.148259 93.64198 4.001895 -1.151642      5.763958 
1 1 1 9   29 3  o 60.22806 3.888458 44.55919       5.676560 54.25040       10.86495 40.92053       6.657469 65.97141 6.858253 57.58068 4.787841 8.390720       8.364153 
1 1 1 9   29 4  o 60.62438 3.774315 45.13026       5.548326 52.05518       9.836629 41.89911       6.719198 64.70860 6.318449 58.26561 4.774092 6.442982       7.919265 
1 1 1 9   29 5  o 74.60532 3.036909 68.10927       5.509713 54.84774       7.304356 85.61526       8.392250 66.74772 4.517262 83.51914 4.136277 -16.77142      6.124904 
1 1 1 9   29 6  o 55.25830 3.106664 37.42820       4.166540 28.05968       5.995925 46.17638       5.794014 47.51019 5.267240 61.30102 3.898811 -13.79084      6.553208 
1 1 1 9   29 7  o 83.62504 2.910668 85.53260       5.922464 83.96465       10.76100 86.21390       7.093408 82.47472 5.383643 83.89002 3.477372 -1.415306      6.409034 
1 1 1 9   29 8  o 56.04727 3.376964 38.55368       4.590899 34.44208       7.305850 41.23665       5.901650 52.57432 5.798654 57.85889 4.214594 -5.284565      7.168486 
1 1 1 9   29 9  o 48.46646 3.492414 28.88837       4.097143 22.90866       6.144114 33.67663       5.498039 42.67967 6.079137 52.22431 4.359895 -9.544643      7.480948 
1 1 1 9   29 10 o 115.3390 3.095743 162.7858       8.693289 155.1191       17.70282 165.2222       9.979425 111.7651 6.528221 116.1252 3.530593 -4.360085      7.421776 
1 1 1 9   29 11 o 107.6911 3.022093 141.9377       7.923084 145.4244       16.92462 140.9591       8.966269 108.1638 6.450267 107.2495 3.435112 0.9143143      7.307936 
1 1 1 9   29 12 o 41.85884 3.990311 21.68815       4.021143 15.07506       8.875482 23.39619       4.510643 34.08175 10.02163 43.43433 4.318720 -9.352589      10.91258 
1 1 1 9   29 13 o 96.70920 2.951039 114.5390       6.946570 101.6292       14.72551 118.2342       7.878260 90.11007 6.755126 98.19678 3.296957 -8.086708      7.516758 
1 1 1 9   29 14 o 48.89584 3.326453 29.43590       3.939995 32.57047       9.515030 28.78720       4.328524 50.28144 8.035860 48.29074 3.706573 1.990707       8.849504 
1 1 1 9   29 15 o 91.56497 2.888899 102.7708       6.438046 102.1213       14.09105 102.9421       7.237632 90.21082 6.452473 91.56905 3.248630 -1.358231      7.224127 
1 1 1 9   29 16 o 42.48655 3.450643 22.31575       3.541898 22.40234       8.578076 22.29795       3.888880 41.09021 8.829887 42.40411 3.803769 -1.313904      9.614342 
1 1 1 9   29 17 o 92.79527 3.142720 105.8599       7.096438 111.5122       14.36070 104.0338       8.162710 94.00391 6.305400 91.84700 3.654273 2.156906       7.287783 
1 1 1 9   29 18 o 53.58146 3.271908 35.44963       4.251833 36.69267       9.209358 35.11289       4.793264 53.18133 7.298454 53.22308 3.719091 -0.4175568E-01 8.191402 
1 1 1 9   29 19 o 44.47720 3.267707 24.50014       3.517017 27.33730       8.633190 23.93559       3.851069 45.26761 8.124684 43.87487 3.634461 1.392742       8.900551 
1 1 1 9   29 20 o 17.13729 5.448410 3.668882       2.558495 3.772719       6.184700 3.647443       2.810231 20.81057 8.231997 17.28711 5.726737 3.523455       10.02803 
1 1 1 9   29 21 o 40.03226 3.567052 20.03331       3.443402 20.45691       8.121959 19.94049       3.802008 38.20188 8.891733 39.81952 3.971041 -1.617634      9.738176 
1 1 1 9   29 22 f 29.79922 4.458737 11.40504       3.138457 19.70052       8.142153 9.957435       3.401290 37.02850 9.091300 27.53919 5.259986 9.489311       10.50329 
1 1 1 9   29 23 o 59.38596 3.059371 43.88935       4.412510 62.87220       11.07083 40.30423       4.811177 68.55180 6.713089 56.71958 3.497841 11.83222       7.569707 
1 1 1 9   29 24 o 16.32932 5.666752 3.276769       2.754315 17.86988       7.175203 0.7548138      2.982833 34.77280 8.532565 13.20819 5.527547 21.56461       10.16654 
1 1 1 9   29 25 o 22.32087 5.590745 6.848863       3.034155 -1.846106      7.068809 8.812624       3.359360 16.92237 7.722541 25.37001 5.585273 -8.447643      9.530631 
1 1 1 9   29 26 o 17.70693 6.005405 4.194534       3.088541 0.000000       0.000000 4.194534       3.088541 ?        ?        17.70693 6.005405 0.000000       6.005405 
1 1 1 9   29 27 o 33.76995 4.546047 15.25840       3.646173 0.000000       0.000000 15.25840       3.646173 ?        ?        33.76995 4.546047 0.000000       4.546047 
1 1 1 9   29 28 o 72.27351 3.703684 67.86948       6.501274 59.39011       12.35905 71.11346       7.644385 59.96271 8.712785 73.19489 4.304744 -13.23218      9.718202 
1 1 1 9   29 29 o 17.62650 5.714972 4.514349       2.805193 5.884217       7.786793 4.310053       3.007103 20.29677 8.727720 17.29929 5.924543 2.997478       10.54862 
1 1 1 9   29 30 o 24.38689 5.339085 8.733863       3.084747 26.56039       8.797082 6.234617       3.293895 36.47453 9.721388 20.00490 6.156116 16.46963       11.50666 
1 1 1 9   29 31 o 25.14132 5.906432 9.862713       3.556824 26.44107       9.542933 7.188116       3.833013 33.15405 10.52035 20.67418 6.678553 12.47986       12.46117 
1 1 1 9   29 32 f 25.07627 5.433529 9.716610       3.224223 22.72887       9.264829 7.923558       3.439201 28.62963 10.34830 21.78613 6.188760 6.843500       12.05770 
1 1 1 9   29 33 o 21.71699 5.910308 7.863439       3.210765 23.82066       9.360455 5.735577       3.418142 28.03091 10.35859 18.11286 6.311198 9.918053       12.12978 
1 1 1 9   29 34 o 14.48764 5.706633 3.217880       2.960795 4.427995       5.151843 2.621080       3.617963 16.09152 7.008568 14.09260 6.001694 1.998922       9.227153 
1 1 1 9   30 0  f 56.40933 3.355237 39.03288       4.591383 41.30688       6.372332 36.57777       6.621212 57.87643 4.554831 54.36147 5.056125 3.514969       6.805209 
1 1 1 9   30 1  o 57.06147 3.447905 39.95433       4.772030 43.49767       6.775237 36.46602       6.722413 59.37180 4.721693 54.25938 5.145597 5.112427       6.983663 
1 1 1 9   30 2  o 140.1437 2.984075 239.9410       10.19106 238.6409       15.21080 240.9999       13.72771 139.4613 4.481529 140.2445 4.020913 -0.7832031     6.020950 
1 1 1 9   30 3  o 93.59908 4.028376 107.4705       9.166842 0.000000       0.000000 107.4705       9.166842 ?        ?        93.59908 4.028376 0.000000       4.028376 
1 1 1 9   30 4  o 55.11528 4.246202 37.44005       5.659133 51.12788       8.989646 28.45497       7.283435 64.18237 5.810540 47.59958 6.444488 16.58279       8.677199 
1 1 1 9   30 5  o 21.03652 7.585149 4.634485       4.973947 0.000000       0.000000 4.634485       4.973947 ?        ?        21.03652 7.585149 0.000000       7.585149 
1 1 1 9   30 6  o 84.83918 3.816153 88.32021       7.869464 0.000000       0.000000 88.32021       7.869464 ?        ?        84.83918 3.816153 0.000000       3.816153 
1 1 1 9   30 7  o 23.44203 5.607882 7.041920       3.160468 7.217135       4.298785 6.835801       4.662489 23.88689 6.960946 23.51657 7.338863 0.3703232      10.11502 
1 1 1 9   30 8  o 61.14040 3.054260 45.82632       4.536209 50.49478       6.615417 41.68324       6.232068 64.00889 4.265461 58.10104 4.435135 5.907848       6.153420 
1 1 1 9   30 9  o 139.7279 2.852245 238.6965       9.711939 233.5157       14.70267 242.7070       12.93585 137.8177 4.383367 140.6676 3.777097 -2.849899      5.786223 
1 1 1 9   30 10 o 17.21090 6.445198 2.786182       3.646866 3.123362       6.701908 2.644343       4.346756 21.38426 8.533376 17.98811 6.963514 3.396151       11.01404 
1 1 1 9   30 11 o 57.11520 3.541895 40.14296       4.905478 24.19448       9.788836 45.49123       5.668633 42.81659 9.617322 60.76306 3.848037 -17.94646      10.35858 
1 1 1 9   30 12 o 128.0651 3.112625 200.8809       9.713898 246.1347       22.02409 189.9514       10.82354 140.4173 6.453631 124.3789 3.574681 16.03839       7.377513 
1 1 1 9   30 13 o 97.66616 2.973909 116.9482       7.069710 114.1985       14.99780 117.7337       8.016194 95.40717 6.489379 97.90919 3.364764 -2.502014      7.309834 
1 1 1 9   30 14 o 127.5174 3.053116 199.3755       9.487438 221.4148       20.86797 193.6331       10.65197 132.7954 6.467990 125.5012 3.486316 7.294136       7.347740 
1 1 1 9   30 15 o 39.16654 4.223712 19.15739       3.967636 21.82249       8.152004 18.33010       4.541888 40.52851 8.524712 38.11247 5.011595 2.416046       9.888721 
1 1 1 9   30 16 o 83.74413 2.883182 86.16987       5.875086 72.77839       12.00599 90.38624       6.736791 75.61693 6.580912 85.67974 3.232349 -10.06281      7.331881 
1 1 1 9   30 17 o 42.88668 3.473119 22.82062       3.598730 46.74312       9.500740 18.81332       3.888480 60.35438 6.565385 38.74683 4.184499 21.60755       7.785519 
1 1 1 9   30 18 o 54.09977 3.080877 36.16256       4.044890 37.21498       9.366918 35.92133       4.484575 53.19460 7.428198 53.82761 3.436802 -0.6330070     8.184726 
1 1 1 9   30 19 o 37.82901 3.611475 17.89212       3.288883 22.79404       8.347122 16.99125       3.578357 40.62350 8.694415 36.73059 4.065780 3.892918       9.598095 
1 1 1 9   30 20 o 41.51509 3.547123 21.55640       3.554198 18.41624       8.387218 22.24373       3.923939 35.79819 9.469780 42.07461 3.870404 -6.276421      10.23019 
1 1 1 9   30 21 o 9.968750 4.531059 -1.293630      2.402822 0.9812564      5.864484 -1.752569      2.634069 17.81095 7.614766 10.13646 4.658687 7.674489       8.926815 
1 1 1 9   30 22 o 48.58749 3.816431 29.82043       4.482502 24.82847       8.941187 31.49628       5.180555 41.03451 9.172358 49.69885 4.320426 -8.664341      10.13895 
1 1 1 9   30 23 f 18.51826 5.675652 4.581646       2.803322 15.81261       7.196206 2.572397       3.043770 32.33089 8.868454 15.54330 5.873640 16.78759       10.63716 
1 1 1 9   30 24 o 18.92044 6.099033 4.850914       3.197763 0.000000       0.000000 4.850914       3.197763 ?        ?        18.92044 6.099033 0.000000       6.099033 
1 1 1 9   30 25 o 23.53473 5.767286 7.798000       3.281350 0.000000       0.000000 7.798000       3.281350 ?        ?        23.53473 5.767286 0.000000       5.767286 
1 1 1 9   30 26 f 13.05255 5.384133 1.216646       2.772604 7.267046       7.667977 0.3066295      2.973812 22.22591 9.035903 12.38022 5.358883 9.845685       10.50548 
1 1 1 9   30 27 o 73.58283 3.613052 70.13811       6.458875 59.60764       12.11854 74.31627       7.633419 60.52574 8.445951 74.98212 4.194302 -14.45638      9.430072 
1 1 1 9   30 28 o 14.71891 5.721241 2.559046       2.943332 0.000000       0.000000 2.559046       2.943332 ?        ?        14.71891 5.721241 0.000000       5.721241 
1 1 1 9   30 29 o 29.89626 4.797699 12.60557       3.377114 10.60973       9.351745 12.90488       3.621496 22.51648 9.620916 29.96079 5.145510 -7.444315      10.91047 
1 1 1 9   30 30 o 19.23932 6.127696 5.926750       3.235034 5.997321       7.570972 5.910987       3.578133 19.03816 8.387992 19.01997 6.463729 0.1818657E-01  10.58953 
1 1 1 9   30 31 o 15.55413 5.786901 3.656553       2.930421 2.696363       7.662550 3.821044       3.171511 16.72369 7.776764 15.82205 5.991862 0.9016314      9.817355 
1 1 1 9   30 32 o 10.18808 4.733855 -1.107466      2.830543 7.343270       8.451203 -2.175218      3.004045 18.46988 8.434559 9.767734 4.641929 8.702146       9.627528 
1 1 1 9   30 33 o 14.37286 5.741406 3.067226       3.036985 3.399019       8.707567 3.021276       3.240466 16.35950 7.810429 14.39406 5.865746 1.965445       9.767793 
1 1 1 9   31 0  o 140.0904 4.664805 241.1730       15.90274 240.7898       21.72791 241.6152       23.33805 139.4547 6.410799 139.5243 6.885289 -0.6961060E-01 9.407739 
1 1 1 9   31 1  o 109.5624 3.700958 147.1301       9.867067 161.4621       16.24094 138.7450       12.42255 114.2856 5.851021 106.1724 4.813869 8.113205       7.576792 
1 1 1 9   31 2  o 88.05019 3.671212 95.08541       7.859992 88.92403       9.065757 113.7368       15.77324 85.02335 4.390390 95.58788 6.816183 -10.56454      8.107766 
1 1 1 9   31 3  o 45.05170 4.105474 25.08739       4.457773 34.28809       6.007083 13.81063       6.650368 52.62170 4.735081 32.63220 8.334399 19.98950       9.585573 
1 1 1 9   31 4  o 40.26552 4.268223 20.11155       4.124391 22.68216       5.592900 17.04723       6.106409 42.55315 5.523703 36.45088 7.130020 6.102276       9.019340 
1 1 1 9   31 5  o 36.95525 4.330703 16.98968       3.826157 17.40411       5.206803 16.50321       5.641282 37.08309 5.964008 35.93112 6.688824 1.151970       8.961571 
1 1 1 9   31 6  o 27.56891 5.012098 9.641411       3.243251 10.57393       4.525761 8.656968       4.650064 28.63739 6.617968 25.96555 7.131556 2.671839       9.729161 
1 1 1 9   31 7  o 67.16518 3.335335 55.37505       5.442005 59.28640       10.57381 53.96568       6.347180 68.85038 6.374522 66.20354 3.952255 2.646843       7.500323 
1 1 1 9   31 8  o 95.85577 3.252414 112.6535       7.586313 116.2537       15.10657 111.4393       8.772745 96.50899 6.460568 95.23205 3.787769 1.276939       7.489068 
1 1 1 9   31 9  o 23.86529 5.471416 7.322561       3.113944 3.912217       3.999503 12.57211       4.962128 19.05611 6.810108 31.18521 6.727397 -12.12910      9.572640 
1 1 1 9   31 10 o 70.77744 3.363959 61.56479       5.785446 64.69904       11.36831 60.46935       6.720857 71.71645 6.578107 70.02889 3.954390 1.687561       7.675200 
1 1 1 9   31 11 o 77.39935 3.243443 73.59607       6.104023 62.77962       12.00990 77.36328       7.087730 70.36410 7.101149 79.26694 3.679301 -8.902847      7.997723 
1 1 1 9   31 12 o 134.9583 3.585713 224.0560       11.78220 191.0821       20.15781 241.1668       14.52091 123.1364 6.743441 139.7447 4.269058 -16.60830      7.981156 
1 1 1 9   31 13 o 59.84020 3.605053 44.22442       5.232654 55.24038       10.10257 40.18561       6.117134 66.03088 6.356864 56.82822 4.452741 9.202667       7.761226 
1 1 1 9   31 14 o 30.96915 5.378289 12.29653       3.911732 15.83803       7.435041 10.94102       4.599821 34.27636 8.842854 28.86967 6.672073 5.406689       11.07757 
1 1 1 9   31 15 o 118.4957 3.033624 172.7218       8.752724 166.4181       18.00111 174.6737       10.01651 114.3977 6.483774 118.9954 3.457888 -4.597794      7.348218 
1 1 1 9   31 16 o 76.10830 2.919310 71.34670       5.404335 89.86700       12.32417 66.93745       6.013345 83.99461 6.061797 73.58552 3.362303 10.40910       6.931844 
1 1 1 9   31 17 o 32.70574 4.065376 13.49752       3.170382 12.55780       6.608665 13.77844       3.613318 30.23424 8.575650 32.88445 4.637607 -2.650215      9.749316 
1 1 1 9   31 18 o 11.66861 4.992634 0.4607398E-01  2.524613 1.556921       5.685193 -0.3250429     2.817671 18.22722 7.629794 11.90884 5.185034 6.318383       9.224875 
1 1 1 9   31 19 o 77.20982 3.323764 74.11855       6.239078 68.04195       11.58613 76.60027       7.404305 71.81871 6.697309 78.20297 3.897587 -6.384262      7.748879 
1 1 1 9   31 20 o 54.27486 3.104800 36.67769       4.089335 31.43795       9.521262 37.86287       4.528263 47.04352 8.623038 55.03418 3.392967 -7.990658      9.266554 
1 1 1 9   31 21 o 55.81078 3.600428 39.22372       4.870628 40.99961       9.562652 38.60161       5.659795 54.38843 7.407302 55.01495 4.254706 -0.6265221     8.542287 
1 1 1 9   31 22 o 11.85544 5.081534 0.1887401      2.623799 3.286551       7.070946 -0.3059101     2.825525 20.20335 8.486379 11.74913 5.152107 8.454217       9.927882 
1 1 1 9   31 23 o 11.80182 5.132548 -0.3567523E-01 2.754275 0.000000       0.000000 -0.3567523E-01 2.754275 ?        ?        11.80182 5.132548 0.000000       5.132548 
1 1 1 9   31 24 f 18.69069 5.756833 4.867174       2.879688 -6.951662      6.569747 7.677951       3.203867 13.73252 6.615602 23.34197 5.685867 -9.609457      8.723260 
1 1 1 9   31 25 o 15.61284 5.673895 3.087805       2.790174 -7.713193      6.836802 5.246261       3.056277 13.60494 6.600905 19.14389 5.936626 -5.538942      8.877809 
1 1 1 9   31 26 o 36.47421 4.056405 17.63025       3.544562 29.53670       9.232604 15.57194       3.838735 40.95350 9.444083 33.72869 4.806201 7.224808       10.59671 
1 1 1 9   31 27 o 12.06731 5.169245 0.6319671      2.712161 16.59584       7.861812 -1.524551      2.889549 29.04309 9.576774 10.43257 4.825002 18.61052       10.72358 
1 1 1 9   31 28 o 32.19749 4.569819 14.42533       3.484960 19.70178       8.789284 13.44106       3.796111 29.75364 10.13022 30.43027 5.312307 -0.6766281     11.43861 
1 1 1 9   31 29 o 19.04346 6.097275 5.787658       3.199717 0.000000       0.000000 5.787658       3.199717 ?        ?        19.04346 6.097275 0.000000       6.097275 
1 1 1 9   31 30 o 10.89278 4.926425 -0.3080884     2.797832 -1.115809      7.687401 -0.1847620     3.003840 15.23687 7.291873 11.32354 5.114489 3.913330       8.906706 
1 1 1 9   31 31 o 19.04521 6.041571 6.130171       3.147381 11.51569       8.156400 5.187958       3.411612 20.91732 8.962408 17.43860 6.282702 3.478714       10.94519 
1 1 1 9   31 32 o 12.12449 5.286835 1.080253       2.938733 1.968368       7.954944 0.9398941      3.162439 15.75526 7.506153 12.24190 5.406243 3.513353       9.250394 
1 1 1 9   32 0  o 17.12855 6.400920 2.770514       3.593076 1.632738       4.691032 4.385463       5.588811 17.44453 7.076528 21.34127 7.981464 -3.896740      10.66682 
1 1 1 9   32 1  o 90.80093 3.033778 100.9679       6.703476 117.7885       9.858377 86.50206       9.142357 97.87456 4.142694 83.77667 4.494606 14.09789       6.112560 
1 1 1 9   32 2  o 89.49909 3.301933 98.20203       7.189154 97.12892       9.180184 99.90376       11.56045 88.82832 4.253315 89.84024 5.304011 -1.011925      6.798766 
1 1 1 9   32 3  o 34.54279 4.666280 14.94142       3.827570 14.52596       5.119961 15.46778       5.762902 33.66518 6.476032 34.63726 7.067096 -0.9720840     9.585554 
1 1 1 9   32 4  o 125.2479 2.945040 191.9349       8.988719 193.9670       13.19928 190.1774       12.27493 125.5369 4.321062 124.3776 4.055289 1.159325       5.925955 
1 1 1 9   32 5  o 79.12032 2.811450 76.67529       5.412073 83.63347       8.236826 71.38909       7.179339 82.39675 4.115195 76.15815 3.881204 6.238602       5.656728 
1 1 1 9   32 6  o 42.20982 3.837266 22.05585       3.903942 24.06321       5.164180 19.37878       5.963755 43.89409 4.912046 38.95035 6.512847 4.943741       8.157536 
1 1 1 9   32 7  o 14.81596 5.819716 1.620575       3.071817 3.720432       3.934139 -1.659194      4.916732 18.71586 6.746204 15.02540 6.682550 3.690466       9.495670 
1 1 1 9   32 8  o 14.86626 6.069517 1.084640       3.477396 5.071943       6.000893 -0.9311948     4.266814 22.31265 8.284983 14.40436 6.323387 7.908288       10.42239 
1 1 1 9   32 9  o 99.76506 3.696439 122.5490       8.971116 143.9960       15.87153 112.4801       10.87499 107.2180 6.099728 95.26544 4.698936 11.95252       7.699785 
1 1 1 9   32 10 o 45.69548 4.692662 26.11139       5.151335 26.55086       8.217896 25.82693       6.611521 45.13772 7.750186 45.02551 6.189284 0.1122055      9.918297 
1 1 1 9   32 11 o 38.82049 4.407592 18.87652       4.095919 11.23239       6.936736 22.96825       5.075104 29.24687 8.921178 42.72488 4.966960 -13.47801      10.21069 
1 1 1 9   32 12 o 24.43419 6.176123 7.804197       3.678698 27.01838       7.572383 1.868729       4.208712 45.63948 7.034262 16.78359 6.740252 28.85590       9.742271 
1 1 1 9   32 13 o 60.92648 3.342055 45.85968       4.942984 55.76326       10.16144 42.78978       5.657459 66.06239 6.391715 58.67564 3.980207 7.386749       7.529679 
1 1 1 9   32 14 o 65.19201 3.185545 52.48847       5.045420 47.43772       10.12048 54.15895       5.820278 60.43565 7.001179 66.09324 3.627597 -5.657589      7.885174 
1 1 1 9   32 15 o 92.95545 3.423733 106.9719       7.742269 87.56438       13.29072 116.9405       9.525337 82.26654 6.687250 96.89703 4.042862 -14.63049      7.814349 
1 1 1 9   32 16 o 40.34491 3.815403 20.41027       3.706594 23.10914       7.449648 19.52232       4.273058 41.33784 7.677806 39.21527 4.556161 2.122562       8.927896 
1 1 1 9   32 17 o 30.37615 4.428657 11.81662       3.181825 12.85106       6.532024 11.49481       3.643285 30.23218 8.508874 29.68208 5.227782 0.5501041      9.986523 
1 1 1 9   32 18 o 34.15826 3.988651 14.81243       3.257731 7.884216       6.529212 17.10890       3.759068 24.51238 8.707526 36.63074 4.292451 -12.11836      9.708046 
1 1 1 9   32 19 o 45.52891 3.357922 25.99462       3.699365 22.71564       7.635194 27.00051       4.228895 39.95263 8.119363 46.23050 3.786881 -6.277866      8.959046 
1 1 1 9   32 20 f 20.07238 5.461801 5.449136       2.742224 1.528086       6.304992 6.363894       3.045344 18.34878 7.871202 21.60829 5.701597 -3.259508      9.719260 
1 1 1 9   32 21 o 20.74141 7.380448 5.763504       4.692512 0.000000       0.000000 5.763504       4.692512 ?        ?        20.74141 7.380448 0.000000       7.380448 
1 1 1 9   32 22 o 15.01648 5.541483 2.624129       2.677227 2.128347       6.477895 2.726255       2.940066 18.43411 7.943960 15.43733 5.785780 2.996783       9.827601 
1 1 1 9   32 23 o 19.21151 5.466864 5.174645       2.681334 1.024287       6.330041 6.082168       2.960006 17.27078 7.636903 20.71266 5.690262 -3.441881      9.523727 
1 1 1 9   32 24 o 17.13356 5.794095 4.044381       2.874892 -0.4905534     7.220994 4.898600       3.133981 16.98008 7.770226 18.54398 6.042680 -1.563902      9.843291 
1 1 1 9   32 25 o 52.47486 3.908643 36.18783       4.962298 48.88290       10.75796 32.75669       5.592828 54.75623 8.324095 49.09716 4.733138 5.659069       9.575654 
1 1 1 9   32 26 o 15.72231 5.688370 3.355009       2.800318 -1.341246      6.944342 4.266973       3.060158 15.75847 7.353115 17.19982 5.972857 -1.441347      9.473295 
1 1 1 9   32 27 o 34.84240 6.135057 18.47318       5.018917 20.30949       8.893053 17.61496       6.079658 30.03080 10.19034 31.85551 7.876603 -1.824705      12.87959 
1 1 1 9   32 28 o 11.66595 5.080275 0.5283170      2.706084 11.11488       8.163061 -0.7787259     2.868273 22.18488 9.202896 10.74118 4.908407 11.44370       10.43004 
1 1 1 9   32 29 o 23.03919 5.572176 8.297914       3.093901 8.481579       8.086154 8.266415       3.348715 19.80590 8.699478 22.57215 5.989585 -2.766245      10.56201 
1 1 1 9   32 30 o 15.53924 5.993743 3.744333       3.211815 0.000000       0.000000 3.744333       3.211815 ?        ?        15.53924 5.993743 0.000000       5.993743 
1 1 1 9   33 0  o 91.03046 3.253978 101.6701       7.206731 102.0508       9.600621 101.1788       10.90777 90.95605 4.343989 90.39514 4.970839 0.5609131      6.601475 
1 1 1 9   33 1  o 140.1236 3.343847 240.7140       11.41809 225.2708       14.87382 262.8738       17.81704 135.1378 4.522951 145.7880 5.022581 -10.65019      6.758950 
1 1 1 9   33 2  o 124.5246 2.969887 189.8854       9.012209 188.0942       13.18097 191.4579       12.34996 123.4967 4.386782 124.7018 4.069479 -1.205032      5.983687 
1 1 1 9   33 3  f 19.65536 6.592275 4.567401       3.721752 2.034454       4.384521 11.09777       7.040086 17.32658 6.906113 29.35790 8.993646 -12.03132      11.33931 
1 1 1 9   33 4  o 27.22836 5.482620 9.516749       3.511872 6.791168       4.346106 14.64463       5.961284 23.16568 7.060521 33.46723 7.496029 -10.30155      10.29764 
1 1 1 9   33 5  o 92.70381 3.048933 105.4666       6.878447 119.9954       13.36508 100.2317       8.022491 98.07320 5.615705 90.22949 3.656159 7.843712       6.701018 
1 1 1 9   33 6  o 18.52992 6.193524 4.079868       3.285466 7.660727       4.076630 -2.556235      5.549633 24.30741 6.677859 15.44552 6.966267 8.861892       9.650009 
1 1 1 9   33 7  o 49.10430 4.438715 30.04358       5.254151 29.05628       9.071949 30.54191       6.445145 47.07819 8.205737 49.23847 5.463299 -2.160275      9.858081 
1 1 1 9   33 8  o 50.22489 3.493010 31.18206       4.248544 31.89354       5.713738 30.30226       6.353799 50.51068 4.695734 49.02120 5.408603 1.489483       7.162604 
1 1 1 9   33 9  o 66.24762 3.211510 54.07518       5.169159 51.25088       6.512720 58.88334       8.497619 64.24071 4.182964 68.56429 5.122876 -4.323586      6.613702 
1 1 1 9   33 10 o 61.96463 3.672618 47.53801       5.520817 52.08702       9.968325 45.52531       6.630610 63.83391 6.498701 60.38116 4.539495 3.452744       7.927177 
1 1 1 9   33 11 o 110.7806 3.176676 151.2214       8.566907 162.6801       17.03473 147.3421       9.911504 113.1575 6.201248 109.1174 3.732928 4.040146       7.238110 
1 1 1 9   33 12 o 101.7595 3.123571 127.7054       7.736561 125.9981       15.17050 128.3055       8.994017 99.26804 6.303815 101.7839 3.631912 -2.515823      7.275223 
1 1 1 9   33 13 f 46.49800 3.792669 26.99467       4.260198 22.46983       8.256770 28.63630       4.973322 40.42968 8.642562 47.73183 4.322460 -7.302158      9.663205 
1 1 1 9   33 14 o 16.78957 6.032207 3.160122       3.142480 2.138599       5.591875 3.631645       3.799139 18.61063 7.658423 18.11753 6.615224 0.4931049      10.11991 
1 1 1 9   33 15 o 22.25315 5.865165 6.594571       3.224905 7.383920       6.345458 6.319691       3.744552 24.12450 8.582644 21.82483 6.532674 2.299667       10.78599 
1 1 1 9   33 16 o 104.2389 3.464465 135.4078       8.788172 120.8705       15.33016 142.5236       10.72548 95.70792 6.613655 106.4395 4.142932 -10.73162      7.804122 
1 1 1 9   33 17 o 21.61129 5.823842 6.299195       3.135866 6.817352       6.446822 6.138599       3.589078 23.21742 8.593534 21.33365 6.397931 1.883778       10.71365 
1 1 1 9   33 18 o 46.14425 3.408154 26.78791       3.805371 23.85465       8.363236 27.55375       4.273367 40.20126 8.783058 46.62967 3.793469 -6.428406      9.567264 
1 1 1 9   33 19 o 20.47964 5.837358 5.747741       3.054582 0.000000       0.000000 5.747741       3.054582 ?        ?        20.47964 5.837358 0.000000       5.837358 
1 1 1 9   33 20 o 21.01609 5.278013 6.058012       2.699001 11.48421       6.614622 4.974130       2.956300 27.14985 8.773581 19.03913 5.827163 8.110729       10.53240 
1 1 1 9   33 21 o 24.70747 4.956333 8.313272       2.880275 5.890473       7.019605 8.803757       3.158397 21.43473 8.670534 25.26695 5.299034 -3.832228      10.16159 
1 1 1 9   33 22 o 14.82665 5.556397 2.579080       2.711435 -6.686167      6.890317 4.276716       2.949396 14.09407 6.786057 17.61156 5.867815 -3.517482      8.971167 
1 1 1 9   33 23 o 28.49209 4.636438 11.03050       3.108594 20.59883       7.786711 9.216430       3.390492 34.53938 9.118704 25.39013 5.627685 9.149254       10.71548 
1 1 1 9   33 24 o 47.96807 4.083602 30.53460       4.728105 23.11053       9.686558 32.85662       5.417279 33.54050 10.59377 49.27914 4.562905 -15.73863      11.53465 
1 1 1 9   33 25 o 15.05322 5.904223 2.738461       3.157702 12.64810       8.545114 1.171243       3.398238 24.66712 9.701288 13.55813 5.796541 11.10898       11.30110 
1 1 1 9   33 26 o 42.23115 4.437332 24.63190       4.498441 20.15472       8.949833 26.14534       5.203503 29.60790 10.21789 42.75032 5.094975 -13.14242      11.41771 
1 1 1 9   33 27 o 22.52387 5.654267 7.855680       3.098475 4.062603       7.497452 8.636942       3.402643 17.81126 8.059072 23.36959 5.957757 -5.558336      10.02215 
1 1 1 9   33 28 o 17.05662 5.953522 4.655324       3.042422 0.6085958      8.278543 5.287226       3.271348 16.18607 7.696054 17.92140 6.177875 -1.735329      9.868910 
1 1 1 9   33 29 o 11.12718 4.930990 0.3091196      2.653023 -3.160529      7.461079 0.8113127      2.838535 14.11075 6.857722 11.88348 5.188574 2.227270       8.599399 
1 1 1 9   34 0  o 130.7322 3.021812 209.5943       9.626895 225.6606       14.55974 197.1143       12.83227 135.0821 4.429015 126.3453 4.173541 8.736832       6.085607 
1 1 1 9   34 1  f 78.45335 3.355397 75.74369       6.400110 76.15364       8.123570 75.07284       10.39191 78.42789 4.266570 77.44809 5.542802 0.9797974      6.994732 
1 1 1 9   34 2  o 18.13653 6.452381 3.619537       3.586423 2.358752       3.946285 9.601961       8.596200 16.99722 6.619640 28.31370 9.997536 -11.31647      11.99043 
1 1 1 9   34 3  o 23.86592 6.373781 7.408623       3.776838 7.546389       4.596858 7.122433       6.625499 24.20728 7.236231 24.75187 8.773585 -0.5445862     11.37272 
1 1 1 9   34 4  o 16.13474 6.191706 2.286256       3.415224 3.691467       4.318518 -0.5992125E-01 5.580131 18.99663 7.033025 17.15104 7.381820 1.845589       10.19582 
1 1 1 9   34 5  o 19.00140 6.891619 3.888298       4.113581 2.662894       6.166170 4.871030       5.521961 20.08538 8.125780 21.49672 7.953882 -1.411339      11.37069 
1 1 1 9   34 6  o 99.30697 2.733518 121.0649       6.608829 136.8478       10.56030 110.9040       8.473199 105.0907 4.131643 94.75755 3.676396 10.33316       5.530494 
1 1 1 9   34 7  o 37.01627 3.849574 17.10907       3.421831 15.22428       4.663525 19.30726       5.036352 34.37447 5.771620 38.90260 5.462838 -4.528130      7.946961 
1 1 1 9   34 8  o 38.84948 3.784675 18.83350       3.537654 22.89853       5.048947 14.91314       4.958282 42.54050 4.963529 33.82244 6.245784 8.718056       7.977871 
1 1 1 9   34 9  o 17.51655 5.817105 3.726796       2.899155 1.419748       3.621910 7.841039       4.836757 15.32807 6.218026 24.44581 7.447961 -9.117735      9.702370 
1 1 1 9   34 10 o 42.17160 5.148662 22.67125       5.181579 25.10481       7.970976 20.89032       6.818886 43.24603 7.852750 39.59244 7.337624 3.653587       10.74739 
1 1 1 9   34 11 f 42.63965 4.968574 23.16666       5.066137 24.25640       7.457549 22.23277       6.903667 42.55156 7.463958 40.82220 7.203020 1.729351       10.37276 
1 1 1 9   34 12 o 42.52995 4.235662 22.83273       4.331574 26.20194       8.079763 21.47385       5.131264 43.90665 7.839133 40.84567 5.278457 3.060982       9.450615 
1 1 1 9   34 13 o 48.95119 3.717074 30.02115       4.400904 28.74216       8.001716 30.57582       5.269484 46.12683 7.366233 49.11612 4.450855 -2.989285      8.606481 
1 1 1 9   34 14 o 38.03991 4.408593 18.47449       4.011147 32.13921       8.230377 14.21783       4.593609 48.76117 7.137794 32.67792 5.989150 16.08324       9.317619 
1 1 1 9   34 15 o 22.20653 6.045974 6.681825       3.359063 12.40772       6.564452 4.650715       3.909700 29.25088 8.623366 19.29650 6.748014 9.954384       10.94980 
1 1 1 9   34 16 o 24.04169 6.197491 7.947712       3.653976 0.000000       0.000000 7.947712       3.653976 ?        ?        24.04169 6.197491 0.000000       6.197491 
1 1 1 9   34 17 o 15.47178 6.179482 2.070429       3.517604 0.000000       0.000000 2.070429       3.517604 ?        ?        15.47178 6.179482 0.000000       6.179482 
1 1 1 9   34 18 o 31.50729 4.431558 13.00686       3.308641 27.03078       7.677372 9.808161       3.666608 43.19837 7.568763 26.63359 5.812960 16.56478       9.543410 
1 1 1 9   34 19 o 27.34392 4.763179 10.02865       3.058624 15.58830       6.987975 8.711126       3.401790 31.21259 8.806439 24.97092 5.714281 6.241667       10.49792 
1 1 1 9   34 20 o 23.45596 5.407753 7.692937       3.027787 10.99936       7.673803 7.083288       3.295121 25.66056 9.396593 22.23774 5.959939 3.422825       11.12730 
1 1 1 9   34 21 o 19.30333 5.784730 5.321704       2.934887 8.286574       7.934683 4.851785       3.158920 23.00388 9.249065 18.51186 6.068834 4.492016       11.06237 
1 1 1 9   34 22 o 33.67036 5.587415 16.05719       4.423902 29.99018       8.734794 11.25018       5.130600 42.36911 8.749817 26.46663 7.572229 15.90248       11.57143 
1 1 1 9   34 23 o 13.75474 5.615846 1.744056       2.977069 1.581515       6.988278 1.780095       3.290601 17.41168 7.838292 14.17238 5.857704 3.239297       9.785271 
1 1 1 9   34 24 o 14.63022 5.708311 2.592327       2.938835 -0.4548630     7.493730 3.146162       3.194762 16.39460 7.646125 15.54951 5.983018 0.8450928      9.708746 
1 1 1 9   34 25 o 34.44267 5.332665 17.33708       4.331338 26.36578       10.11162 15.30816       4.793363 32.88983 10.86165 31.05397 6.541040 1.835854       12.67914 
1 1 1 9   34 26 o 12.44789 5.312982 1.117772       2.846351 4.097469       7.829116 0.6639442      3.055431 17.86064 8.141696 12.26681 5.368930 5.593830       9.752570 
1 1 1 9   34 27 o 9.559235 4.477601 -1.570634      2.616058 -4.129994      6.861609 -1.135333      2.829798 13.60509 6.603751 10.27986 4.761539 3.325230       8.141362 
1 1 1 9   34 28 o 11.33574 5.039577 0.3027716      2.793464 -0.6101786     8.349211 0.4178520      2.964303 15.44341 7.444368 11.68267 5.192741 3.760742       9.076518 
1 1 1 9   35 0  o 50.39678 3.925847 31.57042       4.783380 31.43941       5.908717 31.81955       8.148081 50.01554 4.911141 49.59669 6.930631 0.4188423      8.494290 
1 1 1 9   35 1  o 71.12623 3.068284 62.30571       5.305651 57.77222       7.263829 67.49062       7.768183 68.09851 4.400717 73.64309 4.347988 -5.544579      6.186381 
1 1 1 9   35 2  o 10.12920 4.790717 -3.523338      3.126485 -4.715651      3.905803 -1.396712      5.216280 11.11591 5.285586 15.55458 6.902472 -4.438665      8.693764 
1 1 1 9   35 3  o 62.47158 3.416235 48.25869       5.180960 50.31942       6.757222 45.31918       8.070402 63.49585 4.394139 59.79684 5.603638 3.699017       7.121040 
1 1 1 9   35 4  o 65.37777 3.340046 52.83507       5.303677 63.78766       10.35132 48.93628       6.175925 70.74372 6.062829 62.69614 4.064167 8.047577       7.298996 
1 1 1 9   35 5  o 96.22878 2.949833 114.0421       6.909163 129.6989       10.23339 100.9265       9.366163 102.1181 4.120727 89.98731 4.283442 12.13076       5.943759 
1 1 1 9   35 6  o 42.83955 3.513628 22.83518       3.635858 22.59190       5.119315 23.08281       5.164746 42.13840 5.088272 42.60441 5.074197 -0.4660072     7.185958 
1 1 1 9   35 7  o 13.17421 5.526913 0.4982974      2.993362 1.407521       3.651732 -1.363868      5.226038 15.32150 6.233143 15.48230 6.887422 -0.1607943     9.289168 
1 1 1 9   35 8  o 35.89493 4.397898 16.33328       3.766654 13.21547       4.673291 22.11409       6.363441 31.60262 6.289518 40.97463 6.596881 -9.372007      9.114653 
1 1 1 9   35 9  o 16.75587 5.765462 3.341065       2.848719 4.332852       3.854050 2.146653       4.229464 19.07473 6.697630 16.87646 6.763958 2.198269       9.518896 
1 1 1 9   35 10 o 23.79326 6.391374 7.603519       3.784168 12.23677       6.362604 5.067560       4.707207 29.56529 8.424014 20.59571 7.384860 8.969585       11.20269 
1 1 1 9   35 11 o 22.58790 6.509262 6.860076       3.778238 7.207562       6.368578 6.671352       4.693410 23.83542 8.584395 22.49905 7.398569 1.336370       11.33273 
1 1 1 9   35 12 o 18.29856 6.969659 3.532776       4.306139 4.745815       6.765329 2.706637       5.583136 21.64895 8.595016 18.81341 7.687030 2.835537       11.53103 
1 1 1 9   35 13 o 24.22438 7.064160 8.137863       4.425860 6.868265       6.556723 9.200541       5.998664 23.25995 8.655699 25.55444 8.362169 -2.294489      12.03524 
1 1 1 9   35 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 9   35 15 o 78.64774 3.632292 78.14460       6.942705 0.000000       0.000000 78.14460       6.942705 ?        ?        78.64774 3.632292 0.000000       3.632292 
1 1 1 9   35 16 o 14.61779 5.823449 1.881770       3.115992 -3.549381      6.384980 3.579634       3.569975 15.19369 7.076618 17.28117 6.395134 -2.087479      9.538148 
1 1 1 9   35 17 o 65.21692 3.691743 54.32735       5.843198 59.75620       10.74899 52.05017       6.961645 64.86385 6.906392 63.07703 4.559803 1.786819       8.275871 
1 1 1 9   35 18 o 30.61299 4.758489 12.58707       3.434601 9.506928       7.638583 13.36759       3.845230 24.46701 9.291295 31.27800 5.229307 -6.810984      10.66179 
1 1 1 9   35 19 o 24.81838 5.277684 8.585328       3.093612 12.79753       6.939207 7.540477       3.456069 27.47854 8.993995 22.79809 6.100930 4.680450       10.86799 
1 1 1 9   35 20 o 26.96422 5.172629 10.13746       3.275275 1.401978       7.457926 12.22484       3.645654 18.09940 8.126821 29.62365 5.241874 -11.52425      9.670701 
1 1 1 9   35 21 o 16.40483 6.057856 3.573462       3.200337 7.256043       7.785590 2.824700       3.510648 21.57004 8.971094 15.67009 6.201000 5.899945       10.90564 
1 1 1 9   35 22 o 19.65740 5.859355 5.787624       3.017279 12.94353       7.841644 4.544059       3.268956 25.46897 9.468181 17.63105 6.170000 7.837921       11.30112 
1 1 1 9   35 23 o 13.18744 5.472026 1.522225       2.887146 1.878333       7.623482 1.462598       3.119511 17.42778 7.978383 13.40711 5.634491 4.020673       9.767399 
1 1 1 9   35 24 o 10.36795 4.781422 -1.156932      2.808295 -15.80196      7.543623 1.199228       3.025780 11.59622 5.839069 12.85884 5.482817 -1.262620      8.009745 
1 1 1 9   35 25 o 21.74450 5.767363 7.448877       3.105726 13.42025       9.540281 6.741049       3.284644 22.66208 9.701097 20.35013 6.124571 2.311947       11.47265 
1 1 1 9   35 26 o 13.53141 5.529795 2.153219       2.889825 4.425143       8.864594 1.883063       3.056816 17.76940 8.296838 13.36965 5.595438 4.399749       10.00732 
1 1 1 9   36 0  o 34.62630 4.404094 15.17760       3.632227 16.80786       4.681105 12.71097       5.757997 36.11526 5.491660 30.62584 7.719013 5.489416       9.473198 
1 1 1 9   36 1  o 13.87217 5.739345 0.8376632      3.163269 -1.445264      4.091492 4.229922       4.987469 13.50742 6.045655 20.06597 7.532531 -6.558547      9.658622 
1 1 1 9   36 2  f 47.81792 4.453464 28.80372       5.129827 30.24483       8.312465 27.91730       6.519319 47.72078 7.386450 46.51509 5.882725 1.205681       9.442780 
1 1 1 9   36 3  f 64.75713 3.017244 51.83052       4.748305 59.52660       7.189072 45.87511       6.324028 68.91666 4.302135 60.46077 4.320720 8.455883       6.097293 
1 1 1 9   36 4  o 57.56630 3.115001 41.04462       4.353533 42.86448       6.507153 39.56995       5.857599 58.27552 4.619923 56.10194 4.317747 2.173580       6.323498 
1 1 1 9   36 5  o 86.03305 2.708125 91.25239       5.670598 93.82271       8.680082 89.33866       7.489804 86.57478 4.126180 84.72900 3.635919 1.845779       5.499569 
1 1 1 9   36 6  o 29.94715 4.670852 11.53824       3.297505 10.96052       4.580012 12.16002       4.751464 28.48581 6.709235 30.04583 6.664034 -1.560024      9.456384 
1 1 1 9   36 7  o 71.95976 2.780541 63.99538       4.866728 59.34806       7.210297 67.88439       6.595859 68.60419 4.335038 73.72987 3.682721 -5.125679      5.688145 
1 1 1 9   36 8  o 11.75865 5.085848 -0.1219684     2.674310 -0.3216534     3.639030 0.1125130      3.943366 13.46130 5.876195 14.37414 6.196226 -0.9128428     8.539491 
1 1 1 9   36 9  o 25.84114 5.393209 8.870687       3.286291 10.15165       4.206129 6.863372       5.265284 27.30187 6.429000 22.83133 7.838911 4.470545       10.13808 
1 1 1 9   36 10 o 16.02727 6.468124 1.971937       3.896298 2.351155       5.469129 1.581110       5.552206 18.29528 7.555808 17.75290 7.492062 0.5423756      10.64055 
1 1 1 9   36 11 o 24.80818 7.035049 8.607108       4.447974 0.000000       0.000000 8.607108       4.447974 ?        ?        24.80818 7.035049 0.000000       7.035049 
1 1 1 9   36 12 o 31.44894 6.348439 13.61557       4.697433 0.000000       0.000000 13.61557       4.697433 ?        ?        31.44894 6.348439 0.000000       6.348439 
1 1 1 9   36 13 o 15.58863 6.018133 2.480201       3.240085 5.485788       6.402813 1.445600       3.756579 21.40748 8.404155 15.07624 6.247540 6.331241       10.47194 
1 1 1 9   36 14 o 57.31753 3.423211 41.58483       4.759641 49.98819       9.766929 38.96764       5.450664 59.73116 6.832783 55.03965 4.093151 4.691517       7.964974 
1 1 1 9   36 15 o 19.87188 6.697718 5.490390       3.841500 2.367833       6.017557 7.638252       4.990777 18.17184 7.739609 22.78469 7.633785 -4.612854      10.87089 
1 1 1 9   36 16 o 25.36130 6.552226 9.384276       4.078088 23.10758       7.668045 3.971902       4.815587 38.40767 8.424984 18.40692 7.269324 20.00075       11.12760 
1 1 1 9   36 17 o 18.79327 6.810551 4.832816       4.016288 10.94231       6.883963 1.680072       4.945158 25.64994 8.955210 16.31037 6.983303 9.339577       11.35616 
1 1 1 9   36 18 o 12.01007 5.309213 -0.1983895     3.057323 -5.263579      7.060938 0.9703562      3.391756 14.70636 7.024498 13.66541 5.815102 1.040955       9.119155 
1 1 1 9   36 19 o 13.80271 5.794465 1.330174       3.293600 2.377682       7.181520 1.051162       3.706372 18.27587 8.105137 14.07043 6.035399 4.205440       10.10541 
1 1 1 9   36 20 o 16.90325 6.048487 4.013416       3.155987 10.30431       7.604402 2.704386       3.468835 23.56425 9.185704 15.38520 6.139301 8.179051       11.04845 
1 1 1 9   36 21 o 23.14201 5.713275 8.012676       3.202352 21.76561       8.045044 5.423304       3.490825 33.48904 9.449184 18.79947 6.384443 14.68957       11.40387 
1 1 1 9   36 22 o 11.10121 5.000289 -0.4193602     2.848468 4.633505       7.493284 -1.272849      3.079656 18.62022 8.267354 10.82341 4.997053 7.796809       9.660212 
1 1 1 9   36 23 o 25.12462 5.647508 9.650904       3.373392 13.58577       9.200479 9.039761       3.625910 23.40414 9.744571 23.75694 6.198756 -0.3527927     11.54908 
1 1 1 9   36 24 o 12.14099 5.305125 0.6987212      2.972498 5.646825       8.034349 -0.8598967E-01 3.199530 18.51875 8.364401 11.75976 5.297969 6.758994       9.901095 
1 1 1 9   36 25 o 21.21381 5.725735 7.211040       3.028227 13.72100       8.992538 6.378389       3.216063 22.39727 9.497250 19.58672 6.092417 2.810555       11.28341 
1 1 1 9   37 0  o 26.61621 6.665576 9.587758       4.313426 12.65041       6.885250 7.609264       5.533987 29.94350 8.832612 24.03078 8.038300 5.912720       11.94275 
1 1 1 9   37 1  o 12.12326 5.379255 -0.8382885     3.167282 -2.181399      4.083443 1.190012       5.018070 12.86843 5.871359 16.96486 7.138965 -4.096432      9.243251 
1 1 1 9   37 2  o 74.64391 3.104811 69.12139       5.635292 81.16800       8.259423 58.62930       7.708121 80.29300 4.236188 67.96007 4.682976 12.33293       6.314710 
1 1 1 9   37 3  o 22.78486 6.043256 6.973008       3.409986 7.289297       4.386219 6.489780       5.421565 23.24174 7.094870 22.57678 7.942416 0.6649628      10.64984 
1 1 1 9   37 4  o 25.67970 5.153372 8.692662       3.112685 13.29202       4.472604 4.372676       4.334640 31.54056 6.038943 19.34962 7.065926 12.19094       9.294952 
1 1 1 9   37 5  o 31.51883 4.359462 12.75990       3.258859 18.69012       4.769407 7.566579       4.463255 37.82973 5.320437 23.53535 7.151393 14.29438       8.913444 
1 1 1 9   37 6  o 23.49008 5.610525 7.418554       3.167367 7.866290       4.184776 6.818059       4.846364 23.91182 6.837916 22.55218 7.521919 1.359634       10.16545 
1 1 1 9   37 7  o 13.62718 5.500660 1.304943       2.818540 3.033335       3.780664 -0.8576183     4.228935 17.07345 6.523884 13.94695 6.200544 3.126501       9.000434 
1 1 1 9   37 8  o 31.22281 5.160735 12.88047       3.789569 9.459370       6.236093 14.88348       4.771678 25.69748 8.531466 33.11991 6.138132 -7.422430      10.51012 
1 1 1 9   37 9  o 15.47213 5.988827 2.359947       3.214798 4.046054       4.633545 0.7949638      4.464015 18.90751 7.222929 15.53827 6.643381 3.369243       9.813522 
1 1 1 9   37 10 o 33.40235 5.130158 14.82143       4.042530 22.58075       7.135300 11.15346       4.905834 39.58013 7.674794 27.85645 7.181183 11.72368       10.51056 
1 1 1 9   37 11 o 22.52923 6.852805 7.212186       4.096890 7.773111       5.939681 6.703146       5.658309 23.31879 8.302882 22.10679 8.072979 1.212000       11.58062 
1 1 1 9   37 12 o 18.41452 6.625654 4.385190       3.792786 5.660249       5.634465 3.328743       5.128749 20.84771 7.964743 18.26256 7.402623 2.585150       10.87364 
1 1 1 9   37 13 o 24.19994 5.954707 8.282859       3.487319 10.25165       6.416770 7.457616       4.154394 25.53575 8.656176 22.61037 6.905358 2.925377       11.07309 
1 1 1 9   37 14 o 11.52019 5.208369 -1.031211      3.124032 -0.9474920E-02 5.884850 -1.432133      3.686349 16.24018 7.260975 12.23948 5.582164 4.000690       9.158729 
1 1 1 9   37 15 o 51.62093 3.658173 34.33334       4.571972 58.34784       10.37609 28.54759       5.093036 63.42456 6.820420 46.35443 4.567975 17.07013       8.208808 
1 1 1 9   37 16 o 17.25256 6.270306 3.972155       3.407678 8.950454       6.970957 2.408978       3.906213 23.39513 8.877900 15.76948 6.434921 7.625648       10.96473 
1 1 1 9   37 17 o 13.18934 5.796816 0.2238535      3.595395 -0.5554843     6.692100 0.5400883      4.262892 16.28911 7.463855 14.36283 6.312315 1.926283       9.775196 
1 1 1 9   37 18 o 13.83424 6.016473 0.7978546      3.784689 -4.760626      6.344891 3.867942       4.715432 13.81586 6.615260 17.55154 7.104005 -3.735683      9.707140 
1 1 1 9   37 19 o 15.77646 6.506198 2.727557       4.047379 3.832975       7.447248 2.264199       4.821599 18.68667 8.272235 15.99624 6.872980 2.690431       10.75489 
1 1 1 9   37 20 o 9.959373 4.820106 -4.308155      3.587524 -0.4762492     6.690330 -5.854646      4.250244 15.61196 7.262128 10.37612 5.071944 5.235841       8.857942 
1 1 1 9   37 21 o 13.69991 6.068399 0.8130350      4.013725 1.280177       7.652288 0.6357418      4.714251 16.80030 7.798428 14.29837 6.437223 2.501927       10.11204 
1 1 1 9   37 22 f 19.18270 6.891309 6.256174       4.101200 10.04240       8.327528 5.043793       4.712291 21.30186 9.089712 17.75938 7.132112 3.542486       11.55378 
1 1 1 9   37 23 o 30.35636 4.933025 13.51083       3.524043 21.53835       9.708415 12.29260       3.782000 27.55760 10.47246 28.13620 5.711276 -0.5785961     11.92858 
1 1 1 9   38 0  f 40.30581 4.113512 20.69324       3.983746 20.93358       5.581220 20.44361       5.688034 39.63974 5.962277 39.04343 6.184124 0.5963058      8.590235 
1 1 1 9   38 1  o 12.38644 5.445109 -0.4540771     3.173915 0.1723948      4.114055 -1.375148      4.988453 14.59178 6.309620 14.78294 6.641390 -0.1911583     9.160751 
1 1 1 9   38 2  o 12.89203 5.825369 -1.489035      3.901687 2.383156       6.542414 -3.626343      4.860638 19.35621 8.148726 13.19301 6.154633 6.163199       10.21182 
1 1 1 9   38 3  f 25.99323 5.317437 9.039293       3.254551 9.885156       4.667954 8.239177       4.539973 26.49526 7.090375 24.24840 7.177328 2.246861       10.08898 
1 1 1 9   38 4  o 17.89684 6.260835 4.002285       3.365736 -0.1081330     4.392547 9.847356       5.238034 14.71638 6.439313 26.18727 7.698478 -11.47089      10.03650 
1 1 1 9   38 5  o 11.84627 5.308717 -0.9707021     3.165384 -2.312820      4.998790 -0.7229614E-01 4.089835 14.08289 6.452146 14.23969 6.222488 -0.1568003     8.963791 
1 1 1 9   38 6  o 33.68019 5.086419 15.03251       4.044698 15.47475       6.566736 14.76217       5.134201 32.19347 8.313019 32.45633 6.713069 -0.2628555     10.68511 
1 1 1 9   38 7  o 12.13206 5.300901 -0.1718827     2.967375 -2.616920      4.013643 2.775717       4.406870 12.19735 5.656987 17.20346 6.901157 -5.006116      8.923423 
1 1 1 9   38 8  o 21.19151 5.767448 6.226936       3.057376 11.25570       4.336593 1.257154       4.311087 28.21745 6.447946 15.56073 6.586057 12.65672       9.216949 
1 1 1 9   38 9  f 12.82050 5.360960 0.8295950      2.802335 3.317068       3.890310 -1.853163      4.040134 17.14414 6.600790 12.65625 5.799283 4.487889       8.786472 
1 1 1 9   38 10 o 20.01311 6.241706 5.626577       3.373166 9.548810       5.908043 3.729665       4.108664 24.91399 8.304947 17.73905 6.795331 7.174938       10.73073 
1 1 1 9   38 11 o 13.11341 5.619235 0.5355230      3.206877 2.349172       5.763457 -0.2777748     3.859502 17.80869 7.579331 13.43347 5.950510 4.375224       9.636121 
1 1 1 9   38 12 o 12.50492 5.456792 0.8052894E-01  3.135732 2.216469       6.053538 -0.7027736     3.665891 17.85325 7.686361 12.73163 5.708670 5.121613       9.574396 
1 1 1 9   38 13 o 15.28407 6.075715 2.399160       3.384665 9.733712       6.240254 -0.6579565     4.028761 24.47655 8.527495 13.27964 5.967036 11.19691       10.40787 
1 1 1 9   38 14 o 18.91666 7.086931 4.956217       4.410195 4.116169       5.870142 6.044834       6.682426 18.85825 7.811814 20.80891 8.444307 -1.950659      11.50351 
1 1 1 9   38 15 o 11.67188 5.545124 -3.647059      4.280208 0.3462267      6.017389 -7.736644      6.089512 16.11979 7.263614 12.53384 6.114549 3.585951       9.494619 
1 1 1 9   38 16 o 27.22963 5.658653 10.76878       3.632103 21.87443       8.108418 7.981039       4.062471 34.44189 9.400162 22.55829 6.816106 11.88361       11.61130 
1 1 1 9   38 17 o 18.02542 6.363777 4.824314       3.482871 5.011834       7.767350 4.777122       3.896554 19.55271 8.558989 18.02463 6.679229 1.528076       10.85672 
1 1 1 9   38 18 o 13.32025 5.708535 1.145711       3.310326 15.09321       8.343057 -1.460337      3.606352 26.24682 9.764501 11.62690 5.381923 14.61992       11.14946 
1 1 1 9   38 19 o 11.98544 5.381887 -0.1661302     3.271242 -3.589755      7.313504 0.6901317      3.657512 14.67899 7.047961 13.23104 5.829741 1.447941       9.146564 
1 1 1 9   38 20 o 8.970530 4.384227 -4.631001      3.172328 6.457548       8.428706 -6.460988      3.424108 19.43298 8.689027 8.676721 4.300075 10.75626       9.694836 
1 1 1 9   38 21 o 15.96584 6.135236 3.771774       3.356350 18.86799       8.946256 1.298905       3.620827 26.93911 10.09344 13.49782 5.877291 13.44129       11.67990 
1 1 1 9   39 0  o 14.70331 6.104679 1.312027       3.596371 4.979317       5.912737 -0.8413857     4.530849 20.62696 8.082560 14.26209 6.374240 6.364875       10.29362 
1 1 1 9   39 1  o 56.83921 3.930267 41.25960       5.410330 32.07593       8.959716 46.53011       6.787538 46.73746 8.163641 59.80177 4.695225 -13.06431      9.417546 
1 1 1 9   39 2  o 38.08531 5.591860 19.56968       5.035336 16.03099       7.800212 22.09786       6.593102 31.69668 9.414357 39.39336 7.130443 -7.696672      11.80988 
1 1 1 9   39 3  o 12.75730 5.754220 -1.163668      3.787246 -1.609912      6.521811 -0.9366235     4.651983 16.34475 7.443039 14.30648 6.421534 2.038271       9.830307 
1 1 1 9   39 4  o 25.72781 6.320168 9.376025       3.933394 9.706525       6.256742 9.160046       5.057881 25.27647 8.547694 24.86525 7.624171 0.4112244      11.45387 
1 1 1 9   39 5  o 38.42027 3.740988 18.94588       3.458234 27.54939       5.253907 12.36881       4.593678 45.70020 4.788704 29.43356 6.570959 16.26664       8.130755 
1 1 1 9   39 6  o 22.18152 5.692985 6.878145       3.092526 9.921974       4.329463 3.707268       4.418893 26.13891 6.750135 17.98361 7.004528 8.155302       9.727678 
1 1 1 9   39 7  f 17.34512 5.852220 4.013767       2.932833 6.570414       4.369436 1.917478       3.956539 21.36130 7.142577 15.59577 6.432334 5.765532       9.612041 
1 1 1 9   39 8  o 16.38485 5.832054 3.426571       2.930316 4.832825       4.353878 2.262084       3.961975 19.09674 7.063275 15.90564 6.484381 3.191094       9.588382 
1 1 1 9   39 9  o 13.11887 5.401718 1.202488       2.784069 0.2226304      3.808845 2.326619       4.079624 13.71531 5.998873 16.03285 6.563284 -2.317545      8.891747 
1 1 1 9   39 10 o 19.84577 6.204931 5.662798       3.331353 15.00552       7.076258 3.002546       3.775968 29.78395 8.995110 16.39054 6.448072 13.39340       11.06750 
1 1 1 9   39 11 o 34.43588 4.840340 16.09570       3.949880 31.06043       7.852298 11.02648       4.570174 45.32222 7.362081 26.97174 6.919796 18.35048       10.10365 
1 1 1 9   39 12 o 14.26330 6.066521 1.236827       3.688213 0.5881695      6.512560 1.543092       4.474992 16.80017 7.564574 15.46342 6.632306 1.336749       10.06033 
1 1 1 9   39 13 o 13.32601 5.685210 0.9533638      3.256536 -7.707458      6.157133 4.317119       3.837171 12.59152 6.143938 17.69643 6.614441 -5.104913      9.027669 
1 1 1 9   39 14 o 14.84432 6.026617 2.282806       3.405523 -7.892130      6.609430 5.960457       3.973593 12.96779 6.335783 19.70711 6.808074 -6.739315      9.300108 
1 1 1 9   39 15 o 14.52763 5.863212 2.276365       3.201775 5.313015       6.812302 1.415381       3.627388 19.37727 8.243305 14.07374 6.002085 5.303528       10.19692 
1 1 1 9   39 16 o 13.13412 5.657215 0.9912913      3.282117 1.919675       6.889224 0.7187086      3.732980 17.03551 7.714963 13.46066 5.911682 3.574854       9.719498 
1 1 1 9   39 17 o 19.25355 6.950109 6.059244       4.177390 8.803688       7.311490 4.729176       5.089975 21.34066 8.766875 17.90383 7.330365 3.436831       11.42770 
1 1 1 9   39 18 o 13.16754 5.954009 0.3540702E-01  4.084283 -2.278894      7.541480 0.9959263      4.858471 15.21174 7.264164 14.64358 6.568489 0.5681629      9.793525 
1 1 1 9   39 19 o 18.77546 6.950828 5.973726       4.218078 9.580213       8.118680 4.640263       4.936666 21.01968 8.972318 17.40017 7.181620 3.619505       11.49253 
1 1 1 9   40 0  o 18.23964 6.275798 4.456296       3.375345 11.69025       4.686564 -3.340189      4.865374 28.32415 6.862804 13.05623 6.112615 15.26793       9.190329 
1 1 1 9   40 1  o 19.02004 6.325711 4.983049       3.427988 6.064351       4.990742 4.017245       4.716674 20.87772 7.588196 18.49834 7.227578 2.379377       10.47944 
1 1 1 9   40 2  o 30.03017 4.666649 12.03374       3.304227 14.25461       4.914180 10.20116       4.463964 31.46443 6.619143 26.34713 6.879537 5.117304       9.546783 
1 1 1 9   40 3  o 41.86992 3.982694 22.74355       4.014759 26.93837       5.792069 18.86436       5.569898 44.47312 5.458769 36.32899 6.531656 8.144131       8.512384 
1 1 1 9   40 4  o 19.66218 5.921058 5.458594       3.069314 10.26561       4.533830 1.391626       4.170256 26.26543 6.969183 15.27361 6.471650 10.99182       9.510613 
1 1 1 9   40 5  o 15.45459 6.108873 2.467247       3.403603 6.111255       6.154219 0.8615335      4.085238 21.06917 8.248874 14.65189 6.311247 6.417283       10.38633 
1 1 1 9   40 6  o 16.26847 6.249387 3.102798       3.481582 4.838150       6.600345 2.433815       4.098079 20.09942 8.300673 16.10420 6.583621 3.995220       10.59458 
1 1 1 9   40 7  o 30.92751 4.752968 12.94684       3.467708 17.91372       4.965732 8.219185       4.844670 35.55482 5.940689 23.05880 7.512944 12.49603       9.577897 
1 1 1 9   40 8  o 22.65629 5.514192 7.322306       3.015254 4.764684       4.289924 9.819520       4.238959 18.64189 6.988460 25.49699 6.726374 -6.855108      9.699622 
1 1 1 9   40 9  o 8.875288 4.257593 -3.213060      2.655545 -2.824815      3.462198 -3.767859      4.138723 10.75700 5.073627 11.41020 5.429890 -0.6532049     7.431379 
1 1 1 9   40 10 o 11.67841 5.488453 -2.733019      3.987045 7.506529       7.144502 -7.364182      4.804814 21.69370 8.757339 10.87148 5.330480 10.82222       10.25207 
1 1 1 9   40 11 o 10.90659 5.000985 -1.252152      3.011332 2.701381       5.663708 -2.810256      3.555546 17.20569 7.421380 10.85249 5.125608 6.353208       9.019354 
1 1 1 9   40 12 o 11.19654 5.103783 -0.9697223     3.076360 -1.850921      5.169633 -0.4865751     3.827917 13.68635 6.372222 12.77687 5.771996 0.9094830      8.597741 
1 1 1 9   40 13 o 25.43682 6.149653 9.908062       3.769545 22.20098       7.625601 5.932765       4.336421 34.69162 8.958264 19.37245 7.068444 15.31917       11.41111 
1 1 1 9   40 14 o 11.11879 5.124812 -1.266963      3.219694 -2.804522      6.326607 -0.7295640     3.740273 14.26274 6.766035 12.32886 5.622895 1.933877       8.797510 
1 1 1 9   40 15 o 15.31997 6.171641 2.903335       3.540353 16.58319       8.052230 -0.3748780     3.941794 27.43039 9.676892 12.79177 5.809969 14.63863       11.28707 
1 1 1 9   40 16 o 30.12271 5.715092 13.72388       4.041771 20.56844       9.154487 12.06664       4.504582 29.00790 10.30992 26.97549 6.843016 2.032412       12.37422 
1 1 1 9   40 17 o 13.46888 5.833235 1.287204       3.527368 -5.396014      7.676141 3.076218       3.971521 14.14573 6.892968 15.56953 6.435245 -1.423804      9.430026 
1 1 1 9   41 0  o 12.93767 5.933607 -1.614099      4.242392 1.020310       6.091195 -4.095877      5.912109 16.92307 7.486899 13.93141 6.588665 2.991662       9.973172 
1 1 1 9   41 1  o 29.69120 6.156364 12.73201       4.308068 10.12532       5.414783 17.22802       7.111299 25.17762 7.916326 32.04881 8.825872 -6.871189      11.85598 
1 1 1 9   41 2  o 26.43418 6.056730 10.13038       3.817730 14.68992       6.776601 8.010403       4.620801 29.44825 8.781888 22.78976 7.330211 6.658487       11.43912 
1 1 1 9   41 3  o 16.07707 5.882729 3.320249       3.006771 5.570008       4.305731 1.178961       4.200649 19.62442 7.059675 14.91065 6.410973 4.713772       9.536225 
1 1 1 9   41 4  o 11.23410 5.026238 -0.5495138     2.825107 2.497689       4.049335 -3.439338      3.943380 15.93973 6.533578 11.27621 5.347074 4.663523       8.442679 
1 1 1 9   41 5  o 17.84935 6.444775 4.438019       3.592273 10.15449       4.666364 -3.878039      5.628250 25.42621 7.204123 13.49590 6.396240 11.93030       9.633861 
1 1 1 9   41 6  f 20.03476 6.140915 5.952700       3.281686 4.204033       4.233572 8.585228       5.194452 17.77961 6.875107 22.94915 7.788120 -5.169546      10.38855 
1 1 1 9   41 7  o 54.33835 4.310524 39.50385       5.661115 47.60583       9.891644 35.55753       6.903501 54.97901 7.584922 49.81799 5.794541 5.161022       9.545038 
1 1 1 9   41 8  o 23.96012 6.436119 8.825065       3.837368 11.94063       7.943721 7.876730       4.382648 24.81746 9.462995 22.15634 7.139951 2.661119       11.85441 
1 1 1 9   41 9  o 11.52609 5.068923 0.6640863E-01  2.753037 -1.471554      3.745140 1.874507       4.060749 11.94807 5.514255 15.01184 6.374472 -3.063766      8.428576 
1 1 1 9   41 10 o 26.90073 5.999660 10.90838       3.832846 23.12614       8.599925 7.879978       4.281598 33.99184 9.828098 21.95686 7.055441 12.03498       12.09838 
1 1 1 9   41 11 o 14.72599 6.039238 2.311503       3.462057 7.747327       7.835521 0.9928738      3.859194 20.95580 8.874713 13.87069 6.053190 7.085113       10.74252 
1 1 1 9   41 12 o 15.86428 6.216250 3.338988       3.497382 7.363017       6.660711 1.807227       4.109467 20.47054 8.383852 14.77180 6.345995 5.698730       10.51478 
1 1 1 9   41 13 o 17.04481 6.403846 4.336482       3.606426 9.610776       7.910153 2.952437       4.052079 21.73086 9.040656 15.69281 6.494503 6.038049       11.13158 
1 1 1 9   41 14 o 24.71409 6.109488 9.621018       3.658312 13.88106       8.106172 8.531457       4.099535 24.59046 9.512118 22.48302 6.858274 2.107447       11.72674 
1 1 1 9   42 0  o 15.92880 6.258540 3.026542       3.553364 1.532819       4.439387 5.689766       5.927778 15.28772 6.582067 19.86172 7.991288 -4.574005      10.35298 
1 1 1 9   42 1  o 16.07100 6.089653 3.322078       3.276999 4.623168       4.675832 2.066129       4.594003 18.34342 7.187652 15.86281 6.759516 2.480615       9.866782 
1 1 1 9   42 2  o 18.89810 6.850843 5.302482       4.064398 6.655989       5.029331 2.754397       6.900601 20.55292 7.593301 18.07199 7.983221 2.480930       11.01771 
1 1 1 9   42 3  o 18.41877 6.410775 5.018589       3.526344 6.830361       4.696120 2.676261       5.339633 20.71200 7.381872 16.89119 7.244722 3.820814       10.34302 
1 1 1 9   42 4  o 39.07797 4.599380 20.90897       4.296153 23.92472       5.977547 17.68673       6.178807 39.98954 6.345634 32.58364 7.870721 7.405903       10.11016 
1 1 1 9   42 5  f 12.51378 5.337887 0.8389041      2.870022 0.1552570      4.078666 1.509408       4.039269 13.59112 6.062882 14.65931 6.294518 -1.068188      8.739536 
1 1 1 9   42 6  o 17.68496 6.084108 4.622370       3.172264 9.380528       4.818402 0.9821442      4.214517 23.61467 7.473318 14.36108 6.295031 9.253594       9.771279 
1 1 1 9   42 7  f 9.492954 4.531200 -2.950738      2.927418 1.069896       3.843821 -8.503503      4.517212 13.96416 6.068230 9.901605 4.912654 4.062558       7.807534 
1 1 1 9   42 8  o 13.67698 5.720129 1.610125       3.191267 1.473180       5.012019 1.703500       4.138629 15.41550 6.806952 14.78351 6.359978 0.6319952      9.315788 
1 1 1 9   42 9  o 13.71919 5.836824 1.452115       3.415959 0.6689261      6.614186 1.737004       3.989154 16.11278 7.396860 14.59627 6.261188 1.516514       9.691028 
1 1 1 9   42 10 o 13.68942 6.019840 0.8857804      3.882151 5.066848       7.432522 -0.6828348     4.552509 18.86069 8.310328 13.35022 6.131621 5.510468       10.32755 
1 1 1 9   42 11 f 30.73193 5.571933 14.07486       4.019224 29.94232       9.675613 10.76587       4.418477 36.99053 10.33620 25.37983 6.944097 11.61070       12.45221 
1 1 1 9   43 0  o 11.99812 5.315377 0.8946008E-02  3.080531 -1.653252      4.220330 1.904480       4.506825 12.50777 5.800908 15.41239 6.633766 -2.904624      8.812343 
1 1 1 9   43 1  o 14.84240 5.914895 2.549092       3.215673 5.671078       4.837805 0.7790735E-01  4.304130 19.13467 7.362497 13.75181 6.174338 5.382859       9.608788 
1 1 1 9   43 2  o 12.30966 5.406363 0.3109713      3.122315 2.382331       4.677928 -1.353204      4.193004 15.89630 6.798677 12.61705 5.827150 3.279243       8.954200 
1 1 1 9   43 3  o 20.63203 6.514032 6.745878       3.662756 13.61328       7.061908 4.218595       4.284033 26.20349 9.074826 17.34728 6.854662 8.856209       11.37272 
1 1 1 9   43 4  o 19.31318 6.457807 5.856151       3.571787 5.622333       4.712347 6.171857       5.475707 18.91017 7.268915 19.52682 7.738937 -0.6166515     10.61736 
1 1 1 9   43 5  o 11.01742 5.175022 -2.208583      3.536360 2.488832       4.846632 -7.556829      5.171496 15.98341 6.879425 11.08979 5.456013 4.893619       8.780351 
1 1 1 9   43 6  o 11.76180 5.235823 -0.3402401E-01 3.025312 -1.401422      4.625947 0.9878802      3.999063 13.04460 6.057917 13.94439 6.121608 -0.8997965     8.612342 
1 1 1 10  0  0  o 190.7234 3.792992 443.7882       17.61304 443.7882       17.61304 443.7882       17.61304 190.7234 3.792992 190.7234 3.792992 0.000000       0.000000 
1 1 1 10  0  1  o 288.7411 5.180557 1017.022       36.42552 1017.022       36.42552 1017.022       36.42552 288.7411 5.180557 288.7411 5.180557 0.000000       0.000000 
1 1 1 10  0  2  o 931.9283 15.37315 10609.75       348.9112 10609.75       348.9112 10609.75       348.9112 931.9283 15.37315 931.9283 15.37315 0.000000       0.000000 
1 1 1 10  0  3  o 315.5987 6.857704 1215.760       52.68499 1215.760       52.68499 1215.760       52.68499 315.5987 6.857704 315.5987 6.857704 0.000000       0.000000 
1 1 1 10  0  4  o 297.7704 9.306595 1084.263       67.38232 1084.263       67.38232 1084.263       67.38232 297.7704 9.306595 297.7704 9.306595 0.000000       0.000000 
1 1 1 10  0  5  o 85.30588 2.881916 88.97664       5.975446 88.97664       5.975446 88.97664       5.975446 85.30588 2.881916 85.30588 2.881916 0.000000       0.000000 
1 1 1 10  0  6  o 108.6057 3.045589 144.0682       8.046128 144.0682       8.046128 144.0682       8.046128 108.6057 3.045589 108.6057 3.045589 0.000000       0.000000 
1 1 1 10  0  7  o 792.6145 13.13655 7672.982       253.5774 7672.982       253.5774 7672.982       253.5774 792.6145 13.13655 792.6145 13.13655 0.000000       0.000000 
1 1 1 10  0  8  o 533.9170 8.995119 3479.052       116.9604 3479.052       116.9604 3479.052       116.9604 533.9170 8.995119 533.9170 8.995119 0.000000       0.000000 
1 1 1 10  0  9  o 11.41231 6.752360 1.751926       3.236236 1.751926       3.236236 1.751926       3.236236 11.41231 6.752360 11.41231 6.752360 0.000000       0.000000 
1 1 1 10  0  10 o 429.7397 9.044051 2255.267       94.61724 2255.267       94.61724 2255.267       94.61724 429.7397 9.044051 429.7397 9.044051 0.000000       0.000000 
1 1 1 10  0  11 o 469.9742 9.823033 2698.098       112.3899 2698.098       112.3899 2698.098       112.3899 469.9742 9.823033 469.9742 9.823033 0.000000       0.000000 
1 1 1 10  0  12 o 130.8361 4.149669 209.2557       13.20036 209.2557       13.20036 209.2557       13.20036 130.8361 4.149669 130.8361 4.149669 0.000000       0.000000 
1 1 1 10  0  13 o 179.6166 6.673385 395.0244       29.11816 395.0244       29.11816 395.0244       29.11816 179.6166 6.673385 179.6166 6.673385 0.000000       0.000000 
1 1 1 10  0  14 o 88.14001 5.728205 95.91551       12.18265 95.91551       12.18265 95.91551       12.18265 88.14001 5.728205 88.14001 5.728205 0.000000       0.000000 
1 1 1 10  0  15 o 230.6022 5.526027 649.5661       31.01336 649.5661       31.01336 649.5661       31.01336 230.6022 5.526027 230.6022 5.526027 0.000000       0.000000 
1 1 1 10  0  16 o 100.8069 4.088520 124.4936       10.00604 124.4936       10.00604 124.4936       10.00604 100.8069 4.088520 100.8069 4.088520 0.000000       0.000000 
1 1 1 10  0  17 o 125.0099 4.229704 191.1958       12.85171 191.1958       12.85171 191.1958       12.85171 125.0099 4.229704 125.0099 4.229704 0.000000       0.000000 
1 1 1 10  0  18 o 131.4347 4.280261 211.3357       13.67637 211.3357       13.67637 211.3357       13.67637 131.4347 4.280261 131.4347 4.280261 0.000000       0.000000 
1 1 1 10  0  19 o 105.4594 4.180720 136.2798       10.70572 136.2798       10.70572 136.2798       10.70572 105.4594 4.180720 105.4594 4.180720 0.000000       0.000000 
1 1 1 10  0  20 o 52.13440 5.183149 34.14241       6.424567 34.14241       6.424567 34.14241       6.424567 52.13440 5.183149 52.13440 5.183149 0.000000       0.000000 
1 1 1 10  0  21 o 228.8423 5.615842 640.6710       31.27491 640.6710       31.27491 640.6710       31.27491 228.8423 5.615842 228.8423 5.615842 0.000000       0.000000 
1 1 1 10  0  22 o 243.5556 5.864522 726.0149       34.76144 726.0149       34.76144 726.0149       34.76144 243.5556 5.864522 243.5556 5.864522 0.000000       0.000000 
1 1 1 10  0  23 o 213.1258 7.672132 558.5719       39.72903 558.5719       39.72903 558.5719       39.72903 213.1258 7.672132 213.1258 7.672132 0.000000       0.000000 
1 1 1 10  0  24 o 29.23041 11.83861 14.62981       8.246418 14.62981       8.246418 14.62981       8.246418 29.23041 11.83861 29.23041 11.83861 0.000000       0.000000 
1 1 1 10  0  25 f 70.97204 4.718333 62.33871       8.076413 62.33871       8.076413 62.33871       8.076413 70.97204 4.718333 70.97204 4.718333 0.000000       0.000000 
1 1 1 10  0  26 o 143.3872 4.651626 252.0050       16.21488 252.0050       16.21488 252.0050       16.21488 143.3872 4.651626 143.3872 4.651626 0.000000       0.000000 
1 1 1 10  0  27 o 10.86463 7.328929 -2.527749      5.622731 -2.527749      5.622731 -2.527749      5.622731 10.86463 7.328929 10.86463 7.328929 0.000000       0.000000 
1 1 1 10  0  28 o 110.2798 4.657711 149.5021       12.46622 149.5021       12.46622 149.5021       12.46622 110.2798 4.657711 110.2798 4.657711 0.000000       0.000000 
1 1 1 10  0  29 o 64.34555 7.579811 53.02309       11.45307 53.02309       11.45307 53.02309       11.45307 64.34555 7.579811 64.34555 7.579811 0.000000       0.000000 
1 1 1 10  0  30 o 98.42179 4.714993 119.4098       11.24919 119.4098       11.24919 119.4098       11.24919 98.42179 4.714993 98.42179 4.714993 0.000000       0.000000 
1 1 1 10  0  31 f 25.80067 10.47390 11.52018       6.450349 11.52018       6.450349 11.52018       6.450349 25.80067 10.47390 25.80067 10.47390 0.000000       0.000000 
1 1 1 10  0  32 o 40.06422 8.676237 22.45409       7.427599 22.45409       7.427599 22.45409       7.427599 40.06422 8.676237 40.06422 8.676237 0.000000       0.000000 
1 1 1 10  0  33 o 83.58575 5.073314 86.92827       10.24571 86.92827       10.24571 86.92827       10.24571 83.58575 5.073314 83.58575 5.073314 0.000000       0.000000 
1 1 1 10  0  34 o 34.51380 12.77366 20.50430       9.961535 20.50430       9.961535 20.50430       9.961535 34.51380 12.77366 34.51380 12.77366 0.000000       0.000000 
1 1 1 10  0  35 o 11.16309 7.523872 -2.208874      5.901859 -2.208874      5.901859 -2.208874      5.901859 11.16309 7.523872 11.16309 7.523872 0.000000       0.000000 
1 1 1 10  0  36 o 12.70637 8.683502 -4.084633      8.435973 -4.084633      8.435973 -4.084633      8.435973 12.70637 8.683502 12.70637 8.683502 0.000000       0.000000 
1 1 1 10  0  37 o 19.74300 10.19542 7.870875       6.298715 7.870875       6.298715 7.870875       6.298715 19.74300 10.19542 19.74300 10.19542 0.000000       0.000000 
1 1 1 10  0  38 o 15.36829 9.136021 4.190495       5.975568 4.190495       5.975568 4.190495       5.975568 15.36829 9.136021 15.36829 9.136021 0.000000       0.000000 
1 1 1 10  0  39 o 22.27162 10.61117 10.62430       6.579719 10.62430       6.579719 10.62430       6.579719 22.27162 10.61117 22.27162 10.61117 0.000000       0.000000 
1 1 1 10  0  40 o 11.61923 8.035239 -3.156151      7.739683 -3.156151      7.739683 -3.156151      7.739683 11.61923 8.035239 11.61923 8.035239 0.000000       0.000000 
1 1 1 10  0  41 o 20.60465 9.722535 9.595527       5.511203 9.595527       5.511203 9.595527       5.511203 20.60465 9.722535 20.60465 9.722535 0.000000       0.000000 
1 1 1 10  0  42 o 32.54906 9.159092 18.77885       6.288509 18.77885       6.288509 18.77885       6.288509 32.54906 9.159092 32.54906 9.159092 0.000000       0.000000 
1 1 1 10  0  43 o 9.336572 6.429535 -1.337720      4.830345 -1.337720      4.830345 -1.337720      4.830345 9.336572 6.429535 9.336572 6.429535 0.000000       0.000000 
1 1 1 10  0  44 o 12.72229 8.002154 4.133948       5.206388 4.133948       5.206388 4.133948       5.206388 12.72229 8.002154 12.72229 8.002154 0.000000       0.000000 
1 1 1 10  0  45 o 10.52040 7.073638 1.445085       5.157904 1.445085       5.157904 1.445085       5.157904 10.52040 7.073638 10.52040 7.073638 0.000000       0.000000 
1 1 1 10  1  0  o 700.6525 10.06497 5990.621       171.8507 5949.966       341.0158 6004.459       198.9611 696.4037 20.11559 701.2813 11.64233 -4.877502      23.24179 
1 1 1 10  1  1  o 584.3903 6.900692 4164.134       98.27245 4111.863       137.8483 4218.154       140.1364 580.5033 9.744528 587.9553 9.780712 -7.451965      13.80645 
1 1 1 10  1  2  o 926.4900 11.83136 10481.26       267.1232 10758.50       429.9235 10306.93       340.9135 937.1362 18.82575 918.1091 15.23750 19.02710       24.21963 
1 1 1 10  1  3  o 476.3763 5.700410 2766.461       66.17477 2787.537       94.03522 2745.783       93.14167 478.0669 8.071714 474.4739 8.055557 3.592987       11.40371 
1 1 1 10  1  4  o 397.0268 5.282219 1921.490       51.10605 1907.670       65.61958 1942.796       81.47720 395.5386 6.807827 399.0880 8.377827 -3.549408      10.79511 
1 1 1 10  1  5  o 288.4648 4.495901 1014.229       31.60427 1021.728       36.56872 992.0959       62.82227 289.5135 5.183281 285.0121 9.056615 4.501465       10.43497 
1 1 1 10  1  6  o 554.7769 6.577864 3752.892       88.92817 3795.072       126.6335 3711.851       124.9110 557.6771 9.318150 551.5308 9.293837 6.146362       13.16067 
1 1 1 10  1  7  o 749.3646 8.781354 6851.729       160.3580 6668.079       222.4993 7050.227       231.3188 738.7472 12.35938 759.5977 12.49658 -20.85046      17.57609 
1 1 1 10  1  8  o 232.6576 3.136869 659.6646       17.78483 650.1176       24.89522 669.6152       25.41597 230.9462 4.423532 234.3832 4.449837 -3.437027      6.274446 
1 1 1 10  1  9  f 144.7856 2.622450 255.4579       9.252707 260.4293       12.05702 248.3358       14.43134 146.1807 3.384651 142.6772 4.155073 3.503464       5.359151 
1 1 1 10  1  10 o 420.3543 5.592421 2154.512       57.28638 2147.942       73.75134 2164.506       90.95840 419.6129 7.212486 421.0996 8.863839 -1.486664      11.42749 
1 1 1 10  1  11 o 401.0355 6.927232 1962.043       67.69843 1917.983       81.78580 2057.934       120.6546 396.3861 8.466880 410.0247 12.08849 -13.63861      14.75872 
1 1 1 10  1  12 o 568.3226 9.563690 3946.108       132.4514 4062.327       165.4860 3738.953       220.9381 576.2280 11.78503 551.5078 16.45770 24.72015       20.24210 
1 1 1 10  1  13 o 34.23023 4.538238 14.53674       3.692406 13.42540       4.919905 15.96999       5.587220 32.60579 6.420529 35.59861 6.686054 -2.992821      9.269655 
1 1 1 10  1  14 o 334.3475 5.159221 1363.625       42.03570 1345.958       58.91456 1381.946       59.99508 331.9878 7.282229 336.3930 7.318677 -4.405212      10.32443 
1 1 1 10  1  15 o 100.4980 3.313593 123.2655       8.103983 138.1896       14.51319 116.5040       9.768774 106.2603 5.624778 97.65424 4.114214 8.606094       6.968851 
1 1 1 10  1  16 o 91.84799 3.339620 102.9973       7.462412 104.8152       13.02788 102.1095       9.103910 92.46855 5.810925 91.40376 4.097636 1.064789       7.110377 
1 1 1 10  1  17 o 141.1093 3.065162 242.7910       10.54011 241.2256       14.83932 244.3849       14.97353 140.5359 4.338213 141.4532 4.349020 -0.9173126     6.142806 
1 1 1 10  1  18 o 125.0171 2.985864 190.5936       9.096523 192.6645       12.84336 188.5089       12.88560 125.5730 4.202995 124.2048 4.263581 1.368187       5.986926 
1 1 1 10  1  19 o 101.3845 2.938773 125.4673       7.252960 133.2849       10.44720 118.1934       10.07726 104.4105 4.114062 98.30324 4.216476 6.107224       5.891025 
1 1 1 10  1  20 o 98.48788 2.967522 118.4277       7.114055 114.5701       10.09106 122.2393       10.03079 96.76069 4.290255 99.96851 4.126392 -3.207817      5.952596 
1 1 1 10  1  21 o 156.6699 3.260121 299.5284       12.44674 302.3119       17.66419 296.7836       17.54115 157.2092 4.615834 155.7625 4.626372 1.446686       6.535230 
1 1 1 10  1  22 o 104.9880 3.495570 134.7146       8.930745 131.6480       15.04309 136.3837       11.09819 103.4769 5.991264 105.5521 4.323840 -2.075142      7.388561 
1 1 1 10  1  23 o 167.6660 3.390748 343.2528       13.85405 344.3098       19.51724 342.1794       19.66880 167.6819 4.781232 167.1527 4.833755 0.5291748      6.798924 
1 1 1 10  1  24 o 61.66840 4.037455 46.68994       6.034085 49.80191       7.333273 40.16553       10.61819 63.60786 4.765624 56.52281 7.926420 7.085056       9.248746 
1 1 1 10  1  25 o 65.52529 3.963436 52.69553       6.299143 56.09338       7.742779 46.04458       10.83269 67.51123 4.736408 60.63782 7.489927 6.873413       8.861861 
1 1 1 10  1  26 o 146.4352 3.303219 262.0203       11.78742 261.7709       16.61738 262.2728       16.72299 146.0839 4.673943 146.2187 4.699366 -0.1347961     6.627954 
1 1 1 10  1  27 o 29.17801 6.213368 10.88106       4.282414 9.143345       5.942249 12.75882       6.177070 27.05888 8.257584 31.46872 8.029752 -4.409836      11.51801 
1 1 1 10  1  28 o 146.9991 3.873365 264.7813       13.86311 262.5604       16.86049 269.4164       24.35702 146.1765 4.739482 147.4243 6.798132 -1.247818      8.287176 
1 1 1 10  1  29 o 85.71207 3.389819 90.04353       7.066384 93.36132       9.987697 86.71816       9.999066 87.04077 4.726493 83.83859 4.915742 3.202179       6.819403 
1 1 1 10  1  30 o 50.52756 5.090619 31.76824       6.182732 24.05552       10.45812 35.91222       7.665818 42.65787 10.19885 53.55493 5.975544 -10.89706      11.82048 
1 1 1 10  1  31 o 28.27282 6.798687 10.36300       4.626410 9.974313       6.518749 10.75747       6.566981 28.02170 8.666852 28.92840 8.649325 -0.9066982     12.24439 
1 1 1 10  1  32 o 91.54166 3.418947 103.0077       7.613483 99.89454       10.63154 106.2848       10.90796 89.73807 4.880009 92.58098 4.851815 -2.842911      6.881468 
1 1 1 10  1  33 o 86.65121 3.485652 92.52505       7.345266 100.7738       10.55128 84.76855       10.23164 89.98051 4.829643 82.39550 5.121034 7.585007       7.039208 
1 1 1 10  1  34 o 43.05689 4.836280 23.40618       4.986837 25.92787       6.973055 20.76628       7.134625 44.71418 6.597385 39.50949 7.687015 5.204681       10.12994 
1 1 1 10  1  35 o 31.99798 6.885634 13.71297       5.209854 20.00158       8.762474 10.27431       6.479530 37.57319 9.550947 27.53707 8.659956 10.03613       12.89246 
1 1 1 10  1  36 o 65.70731 3.761640 54.08836       5.998028 54.86879       8.426782 53.28693       8.539322 65.28698 5.343326 64.22662 5.509140 1.060364       7.674748 
1 1 1 10  1  37 o 58.57156 4.656992 44.13790       6.592355 42.30447       7.986508 48.05813       11.67832 56.45843 5.891458 57.77324 8.553074 -1.314808      10.38578 
1 1 1 10  1  38 o 17.37898 6.835275 3.175861       4.242177 3.164696       5.754486 3.189152       6.278380 18.75242 7.748073 19.21914 8.029542 -0.4667168     11.15823 
1 1 1 10  1  39 o 21.21292 7.085321 6.651449       4.299837 3.502604       6.099596 9.761956       6.062350 18.75707 7.880608 24.64783 8.412794 -5.890762      11.52732 
1 1 1 10  1  40 o 15.05343 6.614248 1.016977       4.677897 -0.6217240     5.717628 4.334651       8.135476 15.08322 6.906718 19.60943 8.665001 -4.526213      11.08084 
1 1 1 10  1  41 o 16.22263 7.248322 1.977095       5.854034 -9.866455      8.139630 14.66709       8.425477 13.54704 6.698642 25.39099 9.729890 -11.84395      11.81281 
1 1 1 10  1  42 f 11.15442 5.176006 -1.187433      3.366858 2.154572       4.927413 -4.114274      4.611211 15.18977 6.726260 11.34677 5.485060 3.842999       8.679196 
1 1 1 10  1  43 f 12.98673 5.675049 1.487801       3.401975 -3.404722      4.508107 7.959333       5.184793 11.20009 5.416400 19.37400 7.575412 -8.173906      9.312586 
1 1 1 10  1  44 o 8.554378 4.243182 -5.422270      3.361989 -2.937948      4.647555 -8.149351      4.869335 11.17933 5.428303 9.711303 4.862123 1.468027       7.287435 
1 1 1 10  1  45 o 10.72857 5.123778 -1.272270      3.753938 0.3253907      5.850020 -2.390678      4.894577 12.96105 6.243637 11.29724 5.504776 1.663807       8.323794 
1 1 1 10  2  0  o 329.6402 5.000782 1324.493       40.17115 1355.312       57.72567 1295.553       55.93767 333.3895 7.105277 325.9589 7.042154 7.430603       10.00384 
1 1 1 10  2  1  o 654.8386 10.89673 5234.249       173.8867 4781.049       283.2924 5508.214       220.2614 624.4973 18.63607 671.4407 13.46153 -46.94348      22.98948 
1 1 1 10  2  2  o 100.9141 2.808554 124.1933       6.899984 125.1453       8.303591 122.0694       12.40276 101.2807 3.369055 99.94193 5.109499 1.338745       6.120254 
1 1 1 10  2  3  o 639.4265 9.213173 4988.380       143.5608 4968.090       202.2921 5008.968       203.7673 637.7067 13.01733 640.3194 13.05875 -2.612732      18.43860 
1 1 1 10  2  4  o 721.0535 9.257571 6343.590       162.6674 6462.891       212.6040 6175.136       252.6330 727.4651 11.99287 710.6954 14.58715 16.76965       18.88422 
1 1 1 10  2  5  f 354.1938 5.341200 1529.301       46.10158 1505.563       52.63461 1607.515       95.54144 351.4072 6.146454 362.7121 10.82130 -11.30496      12.44506 
1 1 1 10  2  6  f 374.1061 6.468834 1706.518       58.97351 1706.518       58.97351 0.000000       0.000000 374.1061 6.468834 ?        ?        0.000000       6.468834 
1 1 1 10  2  7  o 146.7874 4.123248 262.8217       14.73445 255.5755       20.01266 271.3994       21.77389 144.6749 5.687515 149.0756 6.005972 -4.400681      8.271609 
1 1 1 10  2  8  o 461.6126 6.795050 2598.677       76.43748 2648.813       89.27129 2460.934       147.9680 465.9734 7.861666 448.4088 13.55678 17.56451       15.67138 
1 1 1 10  2  9  o 539.5061 7.027293 3550.188       92.38906 3543.944       119.1150 3559.617       146.3731 538.8445 9.071241 539.7985 11.12740 -0.9539795     14.35641 
1 1 1 10  2  10 o 61.29089 2.583174 45.86019       3.849558 41.66916       4.942299 52.32481       6.138196 58.36711 3.490708 65.40602 3.868395 -7.038914      5.210521 
1 1 1 10  2  11 o 227.1634 3.807783 628.9952       21.07883 628.7375       29.72717 629.2557       29.89347 227.0742 5.372169 227.1669 5.400019 -0.9265137E-01 7.617112 
1 1 1 10  2  12 o 282.4850 4.484201 972.8818       30.86858 967.0723       43.40434 978.8273       43.90956 281.5559 6.326047 283.2601 6.361179 -1.704163      8.971258 
1 1 1 10  2  13 o 350.0888 5.351289 1494.884       45.65335 1479.496       64.08346 1510.742       65.05469 348.1053 7.554387 351.7586 7.589230 -3.653351      10.70818 
1 1 1 10  2  14 o 93.44566 2.823951 106.5298       6.423234 112.4384       9.162606 100.8202       9.007041 95.95018 3.926954 90.83998 4.079232 5.110199       5.662252 
1 1 1 10  2  15 o 157.4339 3.153503 302.1571       12.09839 312.6903       17.29806 292.0706       16.92737 160.0514 4.439373 154.6764 4.495628 5.374985       6.318125 
1 1 1 10  2  16 o 50.72264 3.427416 31.51470       4.211600 38.57642       6.088458 25.03532       5.832018 56.05164 4.495065 44.96094 5.432925 11.09070       7.051403 
1 1 1 10  2  17 o 172.1189 3.848442 361.3835       16.14171 377.5078       28.80309 354.0006       19.48985 175.5776 6.744381 170.2383 4.702528 5.339264       8.221950 
1 1 1 10  2  18 o 385.6770 5.862594 1818.340       55.09975 1878.856       79.56297 1762.568       76.38008 391.3876 8.341954 379.1042 8.267714 12.28345       11.74493 
1 1 1 10  2  19 o 155.8958 3.200507 296.4665       12.15876 293.0178       17.09116 300.0003       17.30091 154.8306 4.534683 156.6659 4.536450 -1.835281      6.414259 
1 1 1 10  2  20 o 375.7089 5.752182 1727.266       52.66477 1787.226       76.10590 1672.172       72.95260 381.3428 8.189675 368.8925 8.115303 12.45026       11.52948 
1 1 1 10  2  21 o 42.25313 4.626915 22.07910       4.686352 12.70830       7.527186 28.01053       5.988579 31.76849 9.197552 47.56635 5.253844 -15.79786      10.59235 
1 1 1 10  2  22 o 46.09898 4.002619 26.15449       4.451948 23.22109       6.084842 29.53362       6.530796 43.13319 5.947078 48.79509 5.593279 -5.661900      8.164099 
1 1 1 10  2  23 o 61.09954 3.562035 45.74693       5.280619 46.17915       7.375178 45.29225       7.564256 61.22245 4.986547 60.60231 5.171380 0.6201324      7.183928 
1 1 1 10  2  24 f 165.0255 3.390939 332.6173       13.63663 339.1652       19.27115 326.0503       19.29911 166.3830 4.757828 163.1122 4.860709 3.270859       6.801722 
1 1 1 10  2  25 o 66.51482 3.442131 54.19973       5.560348 50.61918       7.661296 58.18495       8.082650 64.08435 4.944048 68.74581 4.855960 -4.661461      6.929933 
1 1 1 10  2  26 o 108.8596 3.654829 145.0603       9.681746 156.5865       11.99691 123.5333       16.39518 112.9975 4.364977 99.86707 6.777008 13.13044       8.061070 
1 1 1 10  2  27 o 73.82699 3.891601 66.88882       6.976588 72.12191       8.606463 56.86030       11.91418 76.55711 4.634921 67.39372 7.374787 9.163391       8.710337 
1 1 1 10  2  28 f 97.22934 3.267240 115.7253       7.730314 113.9614       10.87563 117.5266       10.98990 96.25461 4.650328 97.75670 4.626420 -1.502090      6.559673 
1 1 1 10  2  29 f 91.69431 3.318432 103.0104       7.402776 97.60173       10.30277 108.7830       10.64377 88.98914 4.768366 93.98470 4.661866 -4.995567      6.668606 
1 1 1 10  2  30 o 20.54185 7.231709 4.663875       4.495288 1.676398       6.202115 7.970246       6.524743 19.57920 8.062121 25.88634 8.728879 -6.307148      11.88239 
1 1 1 10  2  31 o 39.11904 6.236352 19.46963       5.745588 9.241276       9.790259 24.84311       7.096097 29.03075 10.61633 44.13815 6.816692 -15.10739      12.61640 
1 1 1 10  2  32 o 46.53390 4.677150 27.01367       5.231945 22.93109       7.126260 31.78736       7.705857 42.15145 7.195750 50.02421 6.472872 -7.872761      9.678682 
1 1 1 10  2  33 o 13.81804 6.165153 -1.503842      4.219296 -4.765567      5.822663 2.102578       6.122602 14.59904 6.785490 19.59008 8.032331 -4.991034      10.51481 
1 1 1 10  2  34 o 75.70708 4.072729 71.25345       7.486114 78.85389       13.13341 67.59555       9.111174 78.20596 6.964074 73.30475 5.132859 4.901215       8.651275 
1 1 1 10  2  35 o 56.01099 4.049367 39.27213       5.489775 34.02414       7.615593 44.94925       7.920828 51.18428 6.234077 59.27556 5.547976 -8.091274      8.345284 
1 1 1 10  2  36 o 25.75925 7.535356 9.153228       5.029054 5.487279       8.626760 11.04042       6.189598 23.72155 9.606053 27.99792 8.403172 -4.276371      12.76282 
1 1 1 10  2  37 o 39.75486 6.208628 21.35254       5.818271 20.67343       6.985389 22.89097       10.51381 38.08097 7.790295 37.58320 10.86691 0.4977684      13.37081 
1 1 1 10  2  38 o 18.73757 7.008177 4.342540       4.309030 7.415964       6.121039 1.323048       6.067095 22.88089 8.390035 17.62302 7.641224 5.257864       11.34817 
1 1 1 10  2  39 o 17.24289 7.031053 3.069997       4.659377 4.206097       5.715396 0.8187562      8.045424 19.04884 7.779706 18.51747 8.366395 0.5313663      11.42455 
1 1 1 10  2  40 o 26.63706 6.524118 10.88726       4.200725 3.511896       5.625478 20.18349       6.315692 17.75397 7.519261 35.44939 7.542907 -17.69543      10.65057 
1 1 1 10  2  41 o 22.45144 6.526749 8.173028       3.783334 6.671103       5.149580 9.934499       5.576806 19.77794 7.599641 23.11754 8.060975 -3.339598      11.07853 
1 1 1 10  2  42 o 18.07408 6.968062 5.595417       4.339361 0.6199850      8.403811 7.404269       5.067134 16.31729 7.757194 19.81791 7.557554 -3.500626      10.83008 
1 1 1 10  2  43 o 12.95618 5.641797 1.535346       3.336914 -2.552721      4.494535 6.556449       4.981102 11.55208 5.540974 18.08000 7.307329 -6.527916      9.170575 
1 1 1 10  2  44 o 11.41776 5.228393 0.2243374      3.276731 -0.9948579     4.440533 1.681851       4.855174 11.84688 5.633911 13.60469 6.278699 -1.757813      8.435818 
1 1 1 10  2  45 o 15.00322 6.217310 4.459787       3.720336 5.102632       5.146811 3.756355       5.383893 15.25516 6.807562 14.41726 6.638583 0.8379021      9.508612 
1 1 1 10  3  0  o 363.6292 5.469041 1611.829       48.46253 1600.470       97.03152 1615.604       55.93927 361.9304 11.01431 364.0278 6.305885 -2.097412      12.69170 
1 1 1 10  3  1  o 458.0783 6.018250 2558.137       67.18093 2564.674       106.2743 2553.786       86.70200 458.4748 9.512101 457.6046 7.775041 0.8702393      12.28541 
1 1 1 10  3  2  o 342.4987 4.232376 1429.695       35.32477 1422.405       49.73063 1437.119       50.18603 341.5779 5.974452 343.3394 5.998230 -1.761505      8.465981 
1 1 1 10  3  3  o 436.4715 4.872639 2322.094       51.82701 2359.131       69.17274 2274.693       78.25330 439.8770 6.453090 431.8870 7.435265 7.989960       9.845077 
1 1 1 10  3  4  f 243.8451 3.935914 724.6741       23.38815 757.0819       33.79403 694.8820       32.40157 249.2068 5.564727 238.7503 5.569114 10.45657       7.872815 
1 1 1 10  3  5  o 316.7305 4.876480 1222.811       37.63852 1196.790       52.25946 1250.857       54.25437 313.2817 6.845320 320.2762 6.951427 -6.994476      9.756063 
1 1 1 10  3  6  o 458.2064 7.799156 2560.904       87.08530 2622.242       108.2496 2448.383       146.6152 463.5349 9.583142 447.3528 13.46441 16.18219       16.52656 
1 1 1 10  3  7  o 457.8556 6.749428 2556.417       75.30635 2656.766       109.1275 2465.184       104.0522 466.5532 9.598357 449.4244 9.500765 17.12881       13.50530 
1 1 1 10  3  8  f 268.2354 3.826158 876.9286       25.01008 814.5883       37.68563 925.9962       33.43401 258.4710 5.983121 275.6099 4.978031 -17.13889      7.783221 
1 1 1 10  3  9  o 229.1120 4.430808 639.8609       24.73813 643.5367       30.12265 632.2457       43.35663 229.7461 5.380331 227.5081 7.831963 2.237946       9.501979 
1 1 1 10  3  10 o 195.4732 4.015485 465.7444       19.12764 453.3763       22.78563 495.2585       35.19859 192.7822 4.854041 201.3588 7.184809 -8.576569      8.670824 
1 1 1 10  3  11 o 612.9717 8.896553 4587.855       132.8918 4668.171       155.1171 4366.268       257.6507 618.0909 10.29844 595.8424 17.76434 22.24854       20.53362 
1 1 1 10  3  12 o 500.8144 7.355212 3061.188       89.76523 2995.719       125.1013 3130.669       128.8773 495.0193 10.37059 506.0331 10.45109 -11.01376      14.72326 
1 1 1 10  3  13 o 23.62334 5.637851 7.082329       3.200306 7.185607       4.553922 6.981553       4.498420 24.13348 7.199546 23.82518 7.166721 0.3082943      10.15851 
1 1 1 10  3  14 o 274.9664 4.411541 922.0334       29.56011 921.5073       41.73235 922.5632       41.87664 274.7679 6.232621 274.9239 6.250621 -0.1559753     8.826995 
1 1 1 10  3  15 o 152.4040 3.104948 283.1584       11.53153 297.8475       16.53201 269.2393       16.09294 156.2069 4.347220 148.5028 4.452001 7.704132       6.222430 
1 1 1 10  3  16 o 227.7937 3.885297 632.8879       21.56761 652.8171       30.98536 614.1575       30.03905 231.2357 5.498770 224.2846 5.496049 6.951111       7.774511 
1 1 1 10  3  17 o 364.8860 5.579615 1626.346       49.61323 1637.537       70.38310 1615.295       69.94633 365.6783 7.898290 363.1853 7.903157 2.493042       11.17331 
1 1 1 10  3  18 o 45.06337 3.779343 24.95098       4.112068 22.53847       5.848563 27.30944       5.782683 42.55279 5.790139 47.00536 5.131559 -4.452572      7.736834 
1 1 1 10  3  19 o 25.36221 7.406658 8.029173       4.862333 0.000000       0.000000 8.029173       4.862333 ?        ?        25.36221 7.406658 0.000000       7.406658 
1 1 1 10  3  20 o 124.6057 3.436834 189.6191       10.42600 199.9534       17.81772 184.2383       12.85690 127.7011 5.740280 122.7427 4.305042 4.958359       7.175249 
1 1 1 10  3  21 o 75.18388 3.056363 69.08151       5.588040 72.16796       7.897079 65.98630       7.908298 76.74393 4.239130 73.35161 4.445089 3.392319       6.142397 
1 1 1 10  3  22 o 68.98040 3.193219 58.19825       5.353165 51.72522       7.318763 65.64542       7.850179 64.87383 4.660534 73.15040 4.424478 -8.276566      6.426241 
1 1 1 10  3  23 o 205.4094 3.749872 515.4531       18.77037 535.8440       26.91195 496.1367       26.19327 209.0964 5.285800 201.1811 5.347511 7.915298       7.519013 
1 1 1 10  3  24 o 67.38663 3.389822 55.60225       5.548681 56.02825       7.684747 55.13827       8.020025 67.49275 4.701760 66.91736 4.953256 0.5753937      6.829443 
1 1 1 10  3  25 o 119.9562 3.150598 175.8606       9.201864 169.2229       12.57612 183.5091       13.49972 117.4989 4.399918 122.3424 4.535909 -4.843521      6.319315 
1 1 1 10  3  26 o 104.3025 3.602899 133.1699       9.143871 126.3026       10.96094 148.8871       16.58219 101.4506 4.444390 109.8060 6.222444 -8.355324      7.646660 
1 1 1 10  3  27 o 32.28260 6.705343 13.33186       5.102420 12.28531       6.079139 15.82670       9.386036 30.88868 8.009804 35.13890 10.29863 -4.250221      13.04679 
1 1 1 10  3  28 o 45.24621 4.457662 25.34909       4.851256 25.41633       6.795651 25.27922       6.927679 44.93580 6.385412 44.77751 6.541881 0.1582909      9.141646 
1 1 1 10  3  29 o 96.68192 3.302951 114.5071       7.770434 131.6294       11.21036 98.67327       10.78035 103.4455 4.457511 89.42928 4.966222 14.01621       6.673288 
1 1 1 10  3  30 o 97.17664 3.321164 115.7617       7.853254 124.7022       11.11728 106.8568       11.09511 100.6022 4.546518 93.02209 4.911921 7.580070       6.693116 
1 1 1 10  3  31 o 162.6759 3.535185 324.6147       14.01431 323.9781       19.62071 325.2778       20.02387 161.9113 4.978723 162.1927 5.072415 -0.2814331     7.107537 
1 1 1 10  3  32 o 66.00023 4.365763 53.96524       6.982230 50.75962       11.92333 55.63821       8.613606 62.81114 7.968889 66.75127 5.339780 -3.940136      9.592520 
1 1 1 10  3  33 o 103.2408 3.795575 131.5931       9.532903 141.0438       16.43922 126.8051       11.70117 105.6259 6.416948 100.9604 4.769486 4.665459       7.995325 
1 1 1 10  3  34 o 62.42515 3.759585 48.37198       5.692699 50.97667       8.126319 45.86206       7.977138 63.52618 5.297521 60.14948 5.503169 3.376709       7.638626 
1 1 1 10  3  35 o 46.38663 4.532441 27.19997       5.058138 31.91357       7.139424 22.44958       7.167231 49.63065 6.026404 40.85596 7.474137 8.774685       9.601055 
1 1 1 10  3  36 o 20.51031 6.862165 5.414719       4.033007 1.859649       5.622434 9.182568       5.788246 18.19746 7.600302 25.77355 8.195145 -7.576088      11.17698 
1 1 1 10  3  37 o 9.386278 4.628215 -7.615188      3.791189 -14.70205      5.377662 -0.6126248     5.345583 9.991026 5.017266 15.73046 6.983624 -5.739435      8.599067 
1 1 1 10  3  38 f 46.52411 6.958014 30.72104       7.646677 30.72104       7.646677 0.000000       0.000000 46.52411 6.958014 ?        ?        0.000000       6.958014 
1 1 1 10  3  39 f 21.97297 7.046457 7.255647       4.272227 7.229200       6.132915 7.280579       5.954708 21.92484 8.325493 21.94980 8.232501 -0.2495575E-01 11.70845 
1 1 1 10  3  40 o 33.79669 5.526309 16.38887       4.394252 15.99880       6.305408 16.75720       6.127243 30.44336 8.281406 31.61847 7.959038 -1.175110      11.48599 
1 1 1 10  3  41 o 21.77422 6.767016 7.862100       3.968651 13.00427       5.765886 3.232834       5.470774 26.46297 8.145142 16.79761 7.269721 9.665359       10.91752 
1 1 1 10  3  42 o 36.91542 5.056908 20.11503       4.429692 11.81669       5.950951 30.42627       6.633553 23.75382 8.323912 43.20071 6.502564 -19.44689      10.56271 
1 1 1 10  3  43 o 19.54302 7.253056 7.783185       4.598082 4.852761       9.246072 8.746021       5.299907 16.97206 8.087696 19.97131 7.700422 -2.999250      11.16724 
1 1 1 10  3  44 o 13.36351 5.985742 2.024803       4.018944 0.3790018      5.976503 3.383380       5.430010 13.51216 6.456416 14.78955 6.756544 -1.277390      9.345384 
1 1 1 10  3  45 o 10.96115 5.134081 -0.2610714     3.438874 0.1105121      4.676241 -0.6986899     5.074772 12.18995 5.792610 12.08235 5.819056 0.1076002      8.210709 
1 1 1 10  4  0  o 630.1311 8.133765 4842.848       124.8989 4786.053       195.6474 4881.916       162.2665 625.9620 12.82596 632.4549 10.52842 -6.492920      16.59376 
1 1 1 10  4  1  o 451.2502 5.937553 2482.415       65.29216 2580.568       105.7716 2421.987       82.99152 459.8965 9.437849 445.6457 7.642015 14.25079       12.14386 
1 1 1 10  4  2  o 347.1421 4.295720 1468.740       36.33953 1535.343       52.85113 1409.017       50.04715 354.8737 6.111452 339.9633 6.041033 14.91037       8.593248 
1 1 1 10  4  3  o 787.3550 10.09381 7565.728       193.6697 8004.515       318.2628 7307.697       244.0586 808.8455 16.14672 773.4080 12.94939 35.43750       20.69791 
1 1 1 10  4  4  o 407.7217 4.943003 2026.321       49.11237 2066.428       70.08701 1987.627       68.84052 411.6546 6.986640 403.7288 6.997103 7.925812       9.888002 
1 1 1 10  4  5  o 436.1310 5.762607 2318.927       61.24519 2344.714       79.34591 2280.916       96.33180 438.4669 7.425943 432.3553 9.143087 6.111633       11.77882 
1 1 1 10  4  6  o 301.7516 4.186354 1109.793       30.78375 1065.846       38.46335 1188.106       51.34505 295.6874 5.337995 312.1380 6.750188 -16.45053      8.605767 
1 1 1 10  4  7  o 537.7897 7.838366 3528.085       102.7245 3496.066       143.6865 3561.560       146.9160 535.0383 11.02034 540.0103 11.16429 -4.971985      15.68723 
1 1 1 10  4  8  o 596.4183 7.726080 4339.463       112.2914 4396.056       146.2318 4258.136       175.2991 600.0486 10.00044 590.2697 12.18690 9.778992       15.76481 
1 1 1 10  4  9  o 237.5613 3.472750 687.8184       20.10413 689.8574       25.92491 684.7426       31.84169 237.8922 4.471992 236.9812 5.513737 0.9109497      7.099297 
1 1 1 10  4  10 o 285.5532 4.015152 993.9235       27.93992 967.6773       35.41162 1037.209       45.47606 281.7214 5.158102 291.6157 6.399349 -9.894287      8.219348 
1 1 1 10  4  11 o 61.96392 2.891562 46.89527       4.354198 49.37910       6.174715 44.43851       6.140957 63.51980 4.009529 60.22998 4.210476 3.289822       5.814157 
1 1 1 10  4  12 o 653.5504 10.94317 5224.569       174.2843 5145.978       210.9731 5393.460       309.2740 648.0005 13.36028 661.0967 19.21779 -13.09625      23.40557 
1 1 1 10  4  13 o 531.8281 9.009768 3457.165       116.7673 3387.919       140.7717 3609.887       209.0592 526.0727 10.98078 541.4341 15.86193 -15.36139      19.29193 
1 1 1 10  4  14 o 252.1202 4.129054 775.1255       25.36847 780.3330       35.90316 769.9334       35.84977 252.8646 5.826511 251.1718 5.857055 1.692749       8.261558 
1 1 1 10  4  15 o 231.8193 3.906617 655.3695       22.06920 648.5234       30.91776 662.4811       31.51184 230.5058 5.504146 232.9697 5.550578 -2.463882      7.816939 
1 1 1 10  4  16 o 143.9566 3.052984 252.6681       10.71006 250.4332       15.00861 254.9869       15.28789 143.2082 4.305562 144.5026 4.346401 -1.294342      6.117929 
1 1 1 10  4  17 o 68.88850 2.991605 57.97523       5.010147 52.56857       6.962634 63.78083       7.214935 65.48490 4.388444 72.18220 4.118818 -6.697296      6.018563 
1 1 1 10  4  18 o 424.2673 7.357135 2205.215       76.06491 2278.453       133.9375 2170.349       92.41405 428.6997 12.83519 420.3250 9.022288 8.374695       15.68897 
1 1 1 10  4  19 o 12.32448 5.379139 -0.6506528     3.048442 2.937414       4.243576 -4.476714      4.382053 18.32494 6.932962 12.36950 5.794315 5.955444       9.035488 
1 1 1 10  4  20 f 137.0816 3.601931 229.5168       12.02193 223.1628       21.02887 232.6016       14.65246 134.8136 6.419415 137.9228 4.365015 -3.109161      7.762876 
1 1 1 10  4  21 o 141.8789 3.126468 245.6256       10.80956 231.6241       14.81252 261.5769       15.81026 137.6053 4.423054 146.2384 4.441658 -8.633118      6.268312 
1 1 1 10  4  22 o 169.4481 3.365237 350.5137       13.89596 354.1270       19.66259 346.9083       19.64115 170.0939 4.748332 168.3428 4.792680 1.751083       6.746587 
1 1 1 10  4  23 o 56.13676 3.524514 38.63858       4.797174 43.25237       6.771469 33.98985       6.797059 59.26842 4.727543 52.39876 5.400347 6.869663       7.177284 
1 1 1 10  4  24 o 94.88007 3.510320 110.1272       8.102303 114.0611       10.01900 102.6918       13.77403 96.47060 4.272402 91.21680 6.234024 5.253792       7.557544 
1 1 1 10  4  25 o 83.53145 3.576998 85.43356       7.264373 76.62170       8.657905 106.3912       13.35211 78.97909 4.517309 92.86704 5.931000 -13.88795      7.455390 
1 1 1 10  4  26 o 79.58593 3.295166 77.53297       6.376895 75.36720       8.797653 79.93050       9.256409 78.28709 4.632188 80.61439 4.732696 -2.327293      6.622354 
1 1 1 10  4  27 o 42.88787 4.557694 22.80058       4.690531 28.29616       6.580284 17.12386       6.687849 47.61178 5.790366 36.49311 7.759457 11.11868       9.681814 
1 1 1 10  4  28 o 82.11098 3.910972 82.76317       7.803185 82.34856       9.248215 83.78774       14.53822 81.77774 4.660024 81.85846 7.366778 -0.8071899E-01 8.716952 
1 1 1 10  4  29 o 96.78149 3.277620 114.7428       7.718979 126.3440       10.96067 103.3277       10.87244 101.3377 4.449279 91.52865 4.892316 9.809090       6.612929 
1 1 1 10  4  30 o 18.82534 6.985872 3.462901       4.265325 6.076133       5.648153 -0.5171283E-02 6.506711 23.19252 8.110668 18.71388 8.011316 4.478640       11.40018 
1 1 1 10  4  31 o 79.82132 4.095075 78.54945       7.938945 80.42125       9.501165 74.21938       14.45087 80.57867 4.861219 76.39063 7.875531 4.188042       9.255022 
1 1 1 10  4  32 o 146.6416 3.965523 264.9717       14.15777 266.4854       23.58914 264.1195       17.70023 145.5874 6.666629 145.9341 4.984529 -0.3466644     8.324030 
1 1 1 10  4  33 o 85.24377 4.043668 89.96700       8.375956 89.31075       14.51411 90.29469       10.25610 83.51676 7.201778 85.05683 4.969733 -1.540070      8.750077 
1 1 1 10  4  34 o 72.73872 3.553918 65.52173       6.280476 61.06733       8.709739 70.34667       9.064764 69.59136 5.172860 74.79599 5.002022 -5.204628      7.195742 
1 1 1 10  4  35 o 19.71548 7.001907 4.580366       4.221642 9.595190       5.794473 -1.092950      6.163177 26.60076 8.161249 16.96713 7.517469 9.633627       11.09587 
1 1 1 10  4  36 o 96.71560 3.367254 116.5437       7.924020 116.1853       11.05932 116.9219       11.35921 95.51865 4.766265 95.71688 4.886106 -0.1982269     6.825783 
1 1 1 10  4  37 f 26.02822 8.170930 9.828543       5.770905 10.90726       8.467115 8.892723       7.886380 27.16411 9.882210 25.29964 9.477210 1.864470       13.69217 
1 1 1 10  4  38 o 27.58286 6.550729 10.88805       4.337314 5.192544       5.734332 18.50308       6.630594 20.43285 7.973328 35.08385 7.941181 -14.65100      11.25328 
1 1 1 10  4  39 o 30.60917 6.739080 13.92417       4.890426 8.607906       5.723393 28.30556       9.413489 23.27157 8.162587 40.38864 9.688835 -17.11707      12.66891 
1 1 1 10  4  40 o 28.62152 6.177409 12.32484       4.182097 13.16948       5.796264 11.40765       6.040022 27.57683 8.095984 25.25126 8.396667 2.325571       11.66400 
1 1 1 10  4  41 o 17.07220 6.568909 4.340775       3.851096 -1.371846      5.333002 10.56588       5.567080 13.76601 6.430126 23.73246 8.062519 -9.966446      10.31265 
1 1 1 10  4  42 o 14.21917 6.017789 2.234902       3.598775 4.579366       5.202863 0.8429420E-01  4.983119 17.06978 7.230481 13.81148 6.369392 3.258303       9.635819 
1 1 1 10  4  43 o 21.33915 7.636473 9.823699       5.030806 7.586610       6.303224 13.74965       8.350132 18.34376 7.869592 21.25259 9.086256 -2.908831      12.02042 
1 1 1 10  4  44 o 14.54775 6.076038 3.582073       3.593442 4.527155       4.903483 2.485736       5.281315 15.43372 6.776904 14.18519 6.547264 1.248528       9.423008 
1 1 1 10  4  45 f 14.50669 6.085497 4.006841       3.628606 7.544658       4.984074 0.1670685E-01  5.293105 17.13164 7.155550 12.49117 5.997093 4.640464       9.336329 
1 1 1 10  5  0  o 275.0171 4.297421 921.8231       28.80074 886.8264       55.37322 934.8016       33.72084 269.5060 8.441725 276.9326 4.996757 -7.426575      9.809705 
1 1 1 10  5  1  o 1030.780 14.72727 12989.58       369.9340 12602.09       724.1604 13126.42       430.3196 1009.813 29.45930 1035.604 17.05145 -25.79126      34.03825 
1 1 1 10  5  2  o 650.2026 7.655354 5155.915       121.2970 5379.558       176.4164 4955.397       167.0466 663.8382 10.90538 637.1462 10.75877 26.69202       15.31921 
1 1 1 10  5  3  o 816.0856 9.532817 8126.783       189.5802 8182.648       269.1947 8071.811       267.0323 818.2792 13.49985 812.7213 13.48298 5.557861       19.07975 
1 1 1 10  5  4  o 442.0612 5.324769 2382.202       57.36134 2576.600       85.11539 2220.447       77.64120 459.6307 7.599114 426.6905 7.466949 32.94022       10.65373 
1 1 1 10  5  5  o 494.3973 5.905097 2980.058       71.14417 3035.214       101.5865 2926.967       99.66700 498.7982 8.357476 489.8236 8.349792 8.974670       11.81382 
1 1 1 10  5  6  o 423.2164 5.615282 2183.658       57.91221 2180.660       74.33986 2188.287       92.36404 422.8455 7.214463 423.4743 8.950345 -0.6288147     11.49596 
1 1 1 10  5  7  o 92.86127 3.101570 105.2061       7.008780 108.4820       8.250882 96.71627       13.28286 94.27680 3.597968 88.84673 6.173389 5.430069       7.145355 
1 1 1 10  5  8  f 206.5975 3.186548 520.1751       16.04285 497.3485       19.76865 564.2065       27.45603 202.0009 4.015944 215.1246 5.237349 -13.12370      6.599821 
1 1 1 10  5  9  o 551.1741 7.168947 3705.960       96.28979 3687.880       123.8063 3733.640       153.1864 549.6113 9.243810 552.7300 11.37290 -3.118713      14.65575 
1 1 1 10  5  10 o 221.8561 3.733338 599.9362       20.18389 604.6816       28.58151 595.2154       28.50728 222.6922 5.266768 220.9413 5.294715 1.750824       7.468123 
1 1 1 10  5  11 o 426.3846 5.662618 2217.270       58.83759 2273.364       77.05659 2138.836       91.11753 431.6074 7.326301 418.4817 8.934894 13.12573       11.55452 
1 1 1 10  5  12 o 203.3779 3.549963 504.1994       17.59397 516.5020       25.11649 492.3465       24.65323 205.7999 5.008153 200.8658 5.040515 4.934128       7.105518 
1 1 1 10  5  13 o 623.6828 9.052933 4755.638       137.5907 4653.806       191.6625 4863.921       197.6405 615.9368 12.76924 629.6506 12.88072 -13.71387      18.13743 
1 1 1 10  5  14 o 121.5526 2.873523 180.1007       8.511676 178.3532       11.78645 182.0053       12.30494 120.8715 4.007042 122.0962 4.141619 -1.224754      5.762759 
1 1 1 10  5  15 o 103.9014 3.328738 131.7607       8.417371 142.1163       10.13594 108.7495       15.10938 107.8810 3.861748 94.11662 6.630287 13.76438       7.672927 
1 1 1 10  5  16 o 59.99746 3.373985 44.03524       4.913136 46.76742       7.925541 42.32998       6.261391 61.66182 5.326618 58.73543 4.406690 2.926384       6.913160 
1 1 1 10  5  17 o 155.1876 3.578570 293.7733       13.53327 272.4874       21.90120 306.9210       17.21268 149.1831 6.036847 158.5103 4.460537 -9.327164      7.505991 
1 1 1 10  5  18 o 78.82207 2.881152 75.86789       5.524827 72.19052       7.655431 79.86502       7.981327 76.79577 4.105609 80.78902 4.067110 -3.993248      5.779049 
1 1 1 10  5  19 o 230.5444 3.929945 648.8270       22.07888 642.6531       30.95425 655.2211       31.50145 229.2330 5.541241 231.4568 5.585017 -2.223816      7.867513 
1 1 1 10  5  20 o 10.40820 4.844989 -2.774976      2.986242 -4.408981      4.068239 -0.8659487     4.397299 11.77040 5.535556 14.84300 6.469743 -3.072600      8.514691 
1 1 1 10  5  21 o 186.2516 4.085166 423.7477       18.54154 421.3297       32.53385 424.9110       22.56476 185.0835 7.227151 186.3278 4.973999 -1.244247      8.773390 
1 1 1 10  5  22 o 150.2996 3.213186 275.7372       11.76874 268.2382       16.27847 283.9487       17.03425 148.0451 4.517436 152.3113 4.594643 -4.266174      6.443444 
1 1 1 10  5  23 f 120.7148 3.473694 178.1154       10.20790 169.7437       12.34713 196.1949       18.14477 117.7398 4.310627 126.3302 5.910359 -8.590363      7.315317 
1 1 1 10  5  24 o 168.1301 3.389346 345.2936       13.88665 337.7660       19.27551 353.4166       20.02320 166.0158 4.769475 169.8063 4.843817 -3.790451      6.797827 
1 1 1 10  5  25 o 166.8077 3.412705 339.9976       13.87238 336.1621       19.17898 344.2061       20.08971 165.5748 4.758235 167.5076 4.926917 -1.932831      6.849474 
1 1 1 10  5  26 o 115.3881 3.151044 162.7914       8.852070 148.7861       11.90807 180.0895       13.23410 110.1171 4.446768 121.1574 4.490146 -11.04021      6.319427 
1 1 1 10  5  27 o 61.53630 3.671553 46.49175       5.480727 52.99807       7.605833 39.46417       7.904636 65.55055 4.794557 56.32564 5.843717 9.224915       7.558889 
1 1 1 10  5  28 o 120.2657 3.754535 177.2718       10.99010 173.3044       13.06726 186.8610       20.31548 118.7538 4.523724 122.6645 6.823177 -3.910767      8.186563 
1 1 1 10  5  29 o 95.00703 3.800442 110.8005       8.781096 115.1514       10.64622 101.5417       15.53046 96.70847 4.530053 90.09795 7.131610 6.610527       8.448742 
1 1 1 10  5  30 o 34.79920 6.661890 15.53567       5.443716 18.58549       6.556581 8.768117       9.766877 37.97732 7.350341 28.73828 10.58793 9.239044       12.88922 
1 1 1 10  5  31 o 74.92377 3.937891 69.18437       7.164601 71.24197       11.67249 67.94055       9.075323 75.33709 6.419049 73.97105 5.065158 1.366035       8.176798 
1 1 1 10  5  32 o 78.80069 3.404630 76.40810       6.522441 79.89817       9.023902 72.59013       9.438295 80.25318 4.633900 76.33652 5.103012 3.916664       6.893022 
1 1 1 10  5  33 f 98.64715 3.378766 119.9013       8.110305 122.4251       11.27428 117.1946       11.67565 99.18013 4.677929 96.90714 4.960630 2.272995       6.818421 
1 1 1 10  5  34 o 59.92860 4.627151 45.08475       6.705168 52.92831       11.73603 41.28373       8.169870 63.37326 7.761201 56.76806 5.996253 6.605194       9.807716 
1 1 1 10  5  35 o 16.06353 6.576149 1.538811       4.095871 0.8607147      5.639038 2.296060       5.959076 17.60420 7.494852 19.14233 7.894468 -1.538122      10.88556 
1 1 1 10  5  36 o 49.58778 6.086249 32.48875       7.200570 34.17826       10.17671 30.79495       10.18959 48.89014 8.868302 45.91598 9.422706 2.974155       12.93964 
1 1 1 10  5  37 o 59.59875 3.830516 45.05857       5.533819 43.40717       7.472062 47.06469       8.235528 57.39158 5.406334 59.48670 5.752846 -2.095123      7.894535 
1 1 1 10  5  38 o 47.50237 4.963318 29.98764       5.660758 30.13453       9.146191 29.89644       7.206986 43.97242 8.842219 46.02579 6.615478 -2.053364      11.04307 
1 1 1 10  5  39 o 34.33099 5.205594 16.26793       4.218620 17.28348       5.839218 15.15911       6.101479 33.55194 7.345804 30.63977 8.063665 2.912170       10.90796 
1 1 1 10  5  40 o 16.33818 6.749460 3.038671       4.365774 3.607884       5.117988 1.517859       8.365642 17.34317 7.247995 17.99042 8.280723 -0.6472473     11.00472 
1 1 1 10  5  41 o 16.25189 6.436777 3.693018       3.785717 5.077025       5.236710 2.177903       5.479139 18.10011 7.425762 15.95955 7.078643 2.140559       10.25910 
1 1 1 10  5  42 o 13.61225 6.026744 1.252927       3.954275 3.358124       6.197756 -0.1923500     5.135275 16.45187 7.396005 13.74010 6.381524 2.711766       9.768559 
1 1 1 10  5  43 o 12.25000 5.548960 0.5369853      3.566287 -0.5885571     4.977859 1.723909       5.111789 12.88069 6.077832 14.24533 6.525856 -1.364639      8.917782 
1 1 1 10  5  44 o 19.60411 7.346134 9.005441       4.739256 25.59374       9.895799 4.068374       5.398642 24.25223 10.10255 15.09260 6.832849 9.159632       12.19629 
1 1 1 10  5  45 o 15.53713 6.366378 5.113566       3.843075 5.023587       5.175928 5.224118       5.737157 15.08286 6.771483 15.13307 6.925394 -0.5021000E-01 9.685765 
1 1 1 10  6  0  o 469.9375 6.916750 2692.836       79.20969 2572.630       154.3286 2735.827       92.29348 458.6114 13.82489 473.6146 7.996683 -15.00320      15.97105 
1 1 1 10  6  1  o 880.7621 12.61034 9475.815       270.6583 10694.17       588.9731 9149.643       304.7419 931.5343 25.97075 865.1293 14.45490 66.40497       29.72245 
1 1 1 10  6  2  o 131.0560 2.449228 209.2966       7.822077 204.6614       11.82578 212.9019       10.42950 129.5339 3.750313 132.1751 3.238006 -2.641174      4.954749 
1 1 1 10  6  3  f 237.3499 3.147859 686.5249       18.20708 684.8863       25.41348 688.2529       26.09755 237.0477 4.399389 237.6276 4.506783 -0.5799866     6.298072 
1 1 1 10  6  4  o 481.5064 5.757364 2826.577       67.55568 2845.906       95.72195 2807.396       95.35542 483.0113 8.132389 479.7304 8.156653 3.280853       11.51811 
1 1 1 10  6  5  o 363.1666 4.464261 1607.591       39.50860 1597.454       55.32028 1618.145       56.44386 361.9557 6.271808 364.2887 6.358210 -2.332977      8.930980 
1 1 1 10  6  6  o 240.0825 4.476817 702.5768       26.19183 691.0596       31.17233 730.2315       48.30350 238.0864 5.372773 244.5203 8.117643 -6.433945      9.734620 
1 1 1 10  6  7  o 395.0145 5.288291 1902.307       50.90546 1927.205       65.78342 1865.145       80.37009 397.5172 6.790854 390.9643 8.435703 6.552887       10.82944 
1 1 1 10  6  8  o 814.0342 11.68007 8098.471       231.6989 7955.299       263.9072 8579.978       483.9756 806.4152 13.42939 833.5828 23.84983 -27.16760      27.37084 
1 1 1 10  6  9  o 335.3308 5.125981 1370.982       41.88770 1393.530       48.56647 1305.496       82.76764 338.0421 5.895623 326.7327 10.40845 11.30936       11.96220 
1 1 1 10  6  10 o 192.2081 3.313690 450.2769       15.52099 453.3642       18.15300 441.8851       29.92798 192.8555 3.862604 190.2190 6.465753 2.636490       7.531644 
1 1 1 10  6  11 o 192.1962 3.021941 450.2159       14.15360 476.3661       18.66572 414.8408       21.70984 197.6808 3.874753 184.3863 4.835784 13.29453       6.196654 
1 1 1 10  6  12 o 280.0659 3.960773 956.2696       27.03187 994.0071       35.57209 904.6927       41.58630 285.4829 5.113204 272.2888 6.267356 13.19412       8.088548 
1 1 1 10  6  13 o 330.4098 5.091801 1331.730       40.99779 1268.079       56.12291 1404.562       60.03372 322.2355 7.147113 339.1208 7.264483 -16.88528      10.19088 
1 1 1 10  6  14 o 282.4139 5.164026 973.2059       35.53944 983.1078       60.92036 968.0975       43.75686 283.3179 8.834529 281.5652 6.377216 1.752747       10.89577 
1 1 1 10  6  15 o 388.8071 6.761666 1847.402       64.06546 1743.265       105.9465 1907.430       80.43815 376.4468 11.56278 394.7643 8.361574 -18.31757      14.26933 
1 1 1 10  6  16 o 231.0113 5.516305 651.7802       31.05401 644.6821       42.27390 660.1001       45.76790 229.3870 7.572916 232.0238 8.107000 -2.636795      11.09381 
1 1 1 10  6  17 o 96.68829 2.816460 114.0891       6.629037 126.4746       9.401089 101.8407       9.348879 101.7429 3.798403 91.25063 4.215631 10.49229       5.674453 
1 1 1 10  6  18 o 126.0715 2.959996 193.8468       9.093777 196.3949       12.80921 191.2574       12.91249 126.7709 4.151960 125.0918 4.242032 1.679047       5.935791 
1 1 1 10  6  19 o 54.56074 3.260123 36.44905       4.314846 41.15327       6.124263 31.81226       6.080204 57.88316 4.374129 50.77692 4.977665 7.106236       6.626474 
1 1 1 10  6  20 o 172.9274 3.348347 364.9343       14.11011 368.9239       19.89574 360.8970       20.01421 173.6745 4.705309 171.7619 4.786290 1.912567       6.711819 
1 1 1 10  6  21 o 226.6932 3.920600 627.6584       21.65843 600.6435       29.73650 658.1818       31.60844 221.5029 5.509019 231.8526 5.594419 -10.34970      7.851549 
1 1 1 10  6  22 o 191.8223 5.065112 450.6947       23.65615 462.3463       34.68587 440.5620       32.34624 193.7279 7.360629 189.1942 7.028058 4.533676       10.17706 
1 1 1 10  6  23 o 91.22690 3.008938 101.6957       6.680018 96.21893       9.153772 107.9351       9.770281 88.60421 4.251860 93.85147 4.283278 -5.247261      6.035295 
1 1 1 10  6  24 o 126.2005 3.078469 194.4684       9.467422 187.5256       13.02236 202.2521       13.78837 123.7250 4.325785 128.4835 4.410357 -4.758530      6.177674 
1 1 1 10  6  25 o 80.21937 3.220961 78.73790       6.283720 83.42643       8.654762 73.51123       9.137956 82.44212 4.323049 77.29315 4.876308 5.148964       6.516681 
1 1 1 10  6  26 o 14.62748 6.150553 0.3482401      3.720129 3.600419       5.075980 -3.425638      5.467977 20.03160 7.581633 14.93967 6.807846 5.091927       10.18960 
1 1 1 10  6  27 o 217.8767 3.936233 581.2211       20.89911 566.5815       28.79862 597.5084       30.37602 214.5466 5.512821 220.2664 5.663789 -5.719803      7.903778 
1 1 1 10  6  28 o 70.94349 3.464035 61.73289       5.970572 64.42126       8.187627 58.67981       8.725330 72.28279 4.673270 68.86574 5.238578 3.417053       7.020125 
1 1 1 10  6  29 o 90.68079 3.804919 100.9702       8.389397 105.4471       10.04063 90.61624       15.26950 92.53996 4.465594 84.95958 7.450581 7.580376       8.686351 
1 1 1 10  6  30 f 45.74252 4.939950 26.08004       5.419298 21.98166       8.194113 29.26642       7.225110 41.07824 8.467263 48.16859 6.306557 -7.090351      10.55780 
1 1 1 10  6  31 f 26.31536 6.587123 8.983544       4.213925 7.579207       5.544053 10.90483       6.484667 24.76732 8.034585 29.01723 8.575061 -4.249908      11.75101 
1 1 1 10  6  32 f 86.68230 3.304044 92.40683       6.966530 96.19791       9.604815 88.19844       10.11966 88.10420 4.488380 84.19634 4.954045 3.907860       6.684917 
1 1 1 10  6  33 o 67.92451 3.591249 57.03660       5.923279 54.15738       7.934450 60.66118       8.902429 65.74326 4.989821 69.48014 5.297839 -3.736877      7.277734 
1 1 1 10  6  34 o 22.63192 7.769104 6.325079       5.171863 11.92260       9.200728 3.739414       6.253315 29.96846 10.35930 20.87214 8.270818 9.096319       13.25600 
1 1 1 10  6  35 o 30.75753 8.082078 13.14595       6.135547 7.608475       8.817555 18.34384       8.542908 25.71212 9.927505 35.66213 9.613375 -9.950008      13.81927 
1 1 1 10  6  36 f 79.86774 3.470167 79.75862       6.737832 72.34449       9.147087 88.55356       9.962518 75.00919 5.033306 83.09260 4.942393 -8.083412      7.054177 
1 1 1 10  6  37 o 14.25279 6.164437 0.2754923      3.928680 -6.811002      5.250776 9.287982       5.921478 12.21165 5.890787 25.22714 8.311049 -13.01548      10.18700 
1 1 1 10  6  38 o 16.16048 6.400616 2.669806       3.743324 1.438299       5.001026 4.238891       5.644999 16.37555 7.017166 19.34101 7.792531 -2.965462      10.48638 
1 1 1 10  6  39 o 47.26324 4.966710 30.45496       5.635047 31.56432       8.907275 29.71468       7.276186 43.82713 8.647240 44.60666 6.917607 -0.7795372     11.07376 
1 1 1 10  6  40 o 25.08605 7.253779 10.43865       4.684542 6.685030       5.523617 20.05556       8.841305 20.18850 7.840290 30.56020 10.15879 -10.37170      12.83243 
1 1 1 10  6  41 o 19.11139 7.081594 6.157939       4.380064 21.14797       7.224397 -2.554866      5.507815 32.94191 8.823100 13.28526 6.305442 19.65665       10.84462 
1 1 1 10  6  42 o 13.06137 5.767972 1.083318       3.599551 -2.646616      5.079140 4.846909       5.102004 12.39539 5.930712 17.07849 7.193267 -4.683098      9.322898 
1 1 1 10  6  43 o 11.49943 5.324986 -0.3983850     3.535558 -2.303637      5.079388 1.392288       4.924285 12.11879 5.832818 13.86099 6.370200 -1.742200      8.637199 
1 1 1 10  6  44 o 9.768389 4.725504 -2.696953      3.438128 1.360773       4.525274 -8.237342      5.287784 13.08146 6.045884 10.05106 5.037210 3.030400       7.869320 
1 1 1 10  6  45 o 14.15173 6.670791 3.393044       5.968847 -6.607783      8.581017 12.76772       8.308048 12.28100 6.189450 17.74581 8.198190 -5.464812      10.27227 
1 1 1 10  7  0  o 1037.475 14.81361 13161.08       374.5197 12402.01       719.6884 13442.98       438.5847 1001.477 29.52173 1047.893 17.17514 -46.41620      34.15433 
1 1 1 10  7  1  o 511.7378 6.682182 3193.154       83.33011 3185.675       131.5795 3198.162       107.6754 510.8568 10.56946 512.0135 8.629765 -1.156708      13.64501 
1 1 1 10  7  2  o 490.4408 7.181679 2933.305       85.83189 3239.523       182.1018 2845.845       97.32042 514.5091 14.53854 483.0056 8.268291 31.50351       16.72524 
1 1 1 10  7  3  o 289.3900 4.041253 1020.696       28.49939 1007.504       44.27547 1030.029       37.23990 287.4545 6.320595 290.6813 5.257210 -3.226837      8.221203 
1 1 1 10  7  4  o 443.1194 5.335385 2393.712       57.61329 2468.124       82.83877 2323.999       80.18119 449.8373 7.556872 436.5068 7.537814 13.33047       10.67356 
1 1 1 10  7  5  o 255.7801 3.340897 797.3179       20.82408 778.2595       28.64794 818.6699       30.32278 252.6795 4.652510 259.1531 4.801496 -6.473602      6.685822 
1 1 1 10  7  6  o 183.3490 2.937930 409.6743       13.12672 404.8926       16.31026 418.4666       22.11646 182.2670 3.672119 185.2125 4.904464 -2.945541      6.126844 
1 1 1 10  7  7  o 505.1982 6.619004 3112.727       81.48741 3169.409       106.0416 3030.987       127.3414 509.6170 8.538793 498.1645 10.48964 11.45245       13.52566 
1 1 1 10  7  8  o 568.4769 8.260975 3943.941       114.4406 3845.575       129.5360 4293.736       244.2723 561.2009 9.471876 591.3846 16.96748 -30.18372      19.43224 
1 1 1 10  7  9  o 866.1992 12.42681 9178.893       262.3093 9155.543       302.1963 9250.245       528.2661 864.5195 14.34426 863.8725 25.12051 0.6470337      28.92746 
1 1 1 10  7  10 f 67.86253 3.265272 56.26086       5.384052 59.33382       6.114262 45.65138       11.36089 69.67577 3.613370 60.64985 7.872389 9.025928       8.662041 
1 1 1 10  7  11 o 369.2519 5.540247 1663.064       49.85263 1701.463       58.57516 1562.161       94.95325 373.4217 6.436916 357.1677 10.92225 16.25400       12.67791 
1 1 1 10  7  12 f 149.2947 2.890564 271.6709       10.51630 272.1627       14.40286 271.1093       15.39084 149.3550 3.960741 149.0508 4.241640 0.3042145      5.803359 
1 1 1 10  7  13 o 87.95274 2.933335 94.39963       6.278257 81.85068       9.648499 103.6147       8.268079 81.76968 4.864053 92.11172 3.690914 -10.34205      6.105887 
1 1 1 10  7  14 o 177.3232 3.284787 383.3641       14.19413 380.6223       19.84545 386.2358       20.30968 176.5736 4.616063 177.8663 4.689778 -1.292694      6.580430 
1 1 1 10  7  15 o 259.8081 4.225438 823.4810       26.75226 826.4215       37.72575 820.5068       37.94200 260.1119 5.951706 259.1734 6.007499 0.9385376      8.456527 
1 1 1 10  7  16 o 337.0002 5.204820 1386.924       42.74368 1338.131       59.02180 1440.738       61.98434 330.6516 7.324968 343.0758 7.414056 -12.42419      10.42225 
1 1 1 10  7  17 o 204.7336 3.612627 511.3860       18.02389 512.3176       25.32016 510.4290       25.66254 204.7908 5.073644 204.3398 5.157722 0.4510345      7.234912 
1 1 1 10  7  18 o 46.41833 4.035592 26.50016       4.519593 26.05740       5.098500 28.12446       9.765467 45.95904 4.614728 47.08560 8.835205 -1.126560      9.967776 
1 1 1 10  7  19 o 147.7955 3.085240 266.4818       11.11185 259.5072       15.33799 274.1860       16.12023 145.6977 4.324746 149.7541 4.422139 -4.056351      6.185365 
1 1 1 10  7  20 o 193.6850 4.027589 458.1589       19.00978 471.1001       23.77813 435.2375       31.64537 196.2180 4.976837 188.2259 6.910871 7.992157       8.516398 
1 1 1 10  7  21 o 187.0510 3.983282 427.4081       18.15671 412.2245       21.92140 460.5833       32.40317 183.5119 4.906339 193.5631 6.880502 -10.05116      8.450649 
1 1 1 10  7  22 o 90.52241 2.920668 100.1031       6.434364 99.85497       8.810166 100.3868       9.419493 90.30592 4.013453 90.51598 4.282521 -0.2100677     5.869224 
1 1 1 10  7  23 o 142.0187 3.727727 246.6223       12.88992 246.7060       22.79931 246.5829       15.62715 141.5051 6.630144 141.8890 4.525334 -0.3838959     8.027294 
1 1 1 10  7  24 o 78.88663 3.069025 76.10385       5.888580 74.99680       8.012825 77.40380       8.682897 78.18171 4.221416 79.39202 4.506494 -1.210312      6.174856 
1 1 1 10  7  25 o 33.56460 4.881752 14.09446       3.875989 11.11409       5.194529 17.83824       5.821918 29.42764 7.283278 37.51698 6.609346 -8.089344      9.835121 
1 1 1 10  7  26 o 186.2458 3.583490 424.2070       16.26405 426.7357       22.68156 421.5306       23.33401 186.4113 4.997542 185.2179 5.174830 1.193451       7.194046 
1 1 1 10  7  27 o 33.55135 5.281286 14.16605       4.175457 15.64380       5.475824 12.11321       6.453985 35.02218 6.659403 30.68654 8.391118 4.335636       10.71254 
1 1 1 10  7  28 o 79.55009 3.826819 77.70013       7.396717 80.46815       8.724871 70.62733       13.94665 80.85122 4.445400 74.93420 7.749228 5.917023       8.933763 
1 1 1 10  7  29 o 45.03946 4.877155 25.24964       5.267671 17.04294       7.595104 32.85630       7.312172 36.12060 8.727027 51.21032 5.971310 -15.08973      10.57438 
1 1 1 10  7  30 o 18.64107 7.172302 2.968562       4.590962 1.232607       5.136566 9.862489       10.23616 17.69555 7.316677 29.84990 10.86468 -12.15436      13.09867 
1 1 1 10  7  31 o 45.76251 4.331568 26.03073       4.772995 31.21503       6.504378 19.98191       7.025805 49.88800 5.438183 39.19380 7.630588 10.69419       9.370150 
1 1 1 10  7  32 o 84.87788 3.280089 88.62648       6.771705 92.83027       9.224149 83.71254       9.972890 86.54790 4.387863 81.96284 5.017111 4.585060       6.665189 
1 1 1 10  7  33 f 67.58853 3.465364 56.45424       5.688605 53.79934       7.468782 60.12221       8.778881 65.58794 4.704176 69.14014 5.249657 -3.552208      7.048984 
1 1 1 10  7  34 o 38.87265 5.342299 19.38793       4.926969 18.58107       5.941976 21.16333       8.814193 37.50446 6.749640 38.86686 9.408148 -1.362400      11.57890 
1 1 1 10  7  35 o 49.61918 5.040234 31.52305       6.009996 29.23110       10.16147 32.75617       7.453408 45.12811 9.538936 49.95903 6.259155 -4.830925      11.40913 
1 1 1 10  7  36 o 31.49576 5.640985 13.21711       4.170547 12.24085       5.586276 14.44642       6.268607 29.34619 7.712124 31.71250 8.087466 -2.366306      11.17515 
1 1 1 10  7  37 o 13.22951 5.868942 -0.5872295     3.768315 -5.367216      4.901619 6.320876       5.892583 12.25065 5.851840 21.91836 8.195867 -9.667703      10.07056 
1 1 1 10  7  38 o 30.64821 5.816553 13.13474       4.185308 11.88075       5.555246 14.78086       6.364853 27.69533 7.864876 30.57163 8.322035 -2.876303      11.45044 
1 1 1 10  7  39 o 32.97779 5.544384 15.40595       4.297716 12.06455       5.829813 19.38348       6.360591 26.80788 8.178716 34.93844 7.680378 -8.130562      11.21961 
1 1 1 10  7  40 o 28.05959 6.824105 12.61283       4.620641 22.94538       7.290910 5.677157       5.973409 35.95367 8.463014 19.21264 7.911723 16.74102       11.58525 
1 1 1 10  7  41 o 18.30976 6.847366 5.529690       4.113300 4.274489       5.003314 8.147051       7.224921 17.14815 7.166402 20.32345 8.559988 -3.175301      11.16381 
1 1 1 10  7  42 o 12.52546 5.600107 0.6414543      3.500532 5.527976       5.001926 -4.049150      4.900628 17.53421 7.232142 11.54049 5.596762 5.993721       9.144814 
1 1 1 10  7  43 o 9.040640 4.446455 -4.654879      3.425896 -4.388270      4.590791 -4.989954      5.146604 10.71234 5.243681 11.10137 5.457987 -0.3890314     7.568739 
1 1 1 10  7  44 o 13.86575 5.927874 3.048589       3.553773 1.510240       4.650369 5.208096       5.509817 13.18569 6.106268 15.65841 7.011506 -2.472712      9.297727 
1 1 1 10  8  0  o 178.5802 2.932682 388.6293       12.76246 375.9976       20.42581 396.7189       16.34602 175.5681 4.778611 180.4214 3.717817 -4.853302      6.054526 
1 1 1 10  8  1  o 415.7667 5.046694 2107.150       51.13200 2099.063       72.20782 2115.283       72.41577 414.8772 7.142144 416.4774 7.135191 -1.600189      10.09560 
1 1 1 10  8  2  o 82.24789 2.706871 82.52431       5.417967 90.93182       8.938878 77.64198       6.811807 86.26916 4.265206 79.74011 3.514126 6.529045       5.526397 
1 1 1 10  8  3  o 199.1697 3.082320 483.4240       14.96019 481.5824       23.31867 484.7122       19.50284 198.7651 4.814237 199.4229 4.013163 -0.6577454     6.267564 
1 1 1 10  8  4  o 158.2634 3.098326 305.2436       11.94934 358.3355       26.01733 291.0504       13.45207 171.3143 6.242518 154.5355 3.572110 16.77875       7.192287 
1 1 1 10  8  5  o 590.0120 6.980919 4245.733       100.3713 4395.351       144.9031 4107.732       139.1637 600.0201 9.910047 580.0638 9.844965 19.95636       13.96898 
1 1 1 10  8  6  o 64.50677 2.462435 50.78147       3.863741 52.69570       4.159364 38.73310       10.43504 65.70716 2.602784 55.79412 7.895159 9.913040       8.313124 
1 1 1 10  8  7  f 598.4528 10.03303 4373.997       146.3181 4334.860       177.6867 4456.437       257.8868 595.4299 12.24583 602.3630 17.58733 -6.933167      21.43069 
1 1 1 10  8  8  o 533.1063 11.02107 3473.539       143.1772 3256.785       192.3617 3742.781       214.3911 515.2391 15.33760 552.2276 15.94806 -36.98853      22.12651 
1 1 1 10  8  9  o 212.6840 5.069952 551.5600       26.27694 532.5150       34.69656 577.1752       40.23874 208.8067 6.827949 217.3348 7.609384 -8.528122      10.22368 
1 1 1 10  8  10 o 291.7257 6.466230 1038.353       45.96868 1027.702       62.72972 1050.706       67.55744 289.9156 8.889534 293.0768 9.471665 -3.161163      12.98985 
1 1 1 10  8  11 o 205.7636 4.151197 516.2126       20.81507 526.1006       25.15407 494.7338       37.07305 207.6954 4.969875 201.1416 7.577002 6.553757       9.061491 
1 1 1 10  8  12 o 129.2047 2.628559 203.4694       8.276224 205.4947       9.752781 198.2585       15.64407 129.8385 3.082398 127.3861 5.049552 2.452423       5.916008 
1 1 1 10  8  13 o 81.55819 2.259774 81.13235       4.486937 83.16007       5.691510 77.80275       7.293235 82.54767 2.833550 79.78985 3.761498 2.757820       4.709339 
1 1 1 10  8  14 f 344.8512 5.277873 1451.593       44.35339 1505.149       63.97473 1402.027       61.54607 350.8392 7.482801 338.6114 7.458692 12.22781       10.56524 
1 1 1 10  8  15 o 317.9690 4.940183 1234.192       38.27929 1209.534       53.31523 1260.428       54.99396 314.4896 6.956789 321.0254 7.029744 -6.535828      9.890107 
1 1 1 10  8  16 o 141.7182 2.975540 244.9103       10.27608 245.7329       14.43385 244.0648       14.63337 141.8392 4.180458 141.3505 4.253095 0.4887238      5.963644 
1 1 1 10  8  17 o 73.02456 2.729586 65.11674       4.848829 61.52604       6.591648 69.35081       7.157851 70.90210 3.829246 75.28108 3.915215 -4.378983      5.476499 
1 1 1 10  8  18 o 60.05288 2.904828 44.08895       4.238385 44.22597       5.710638 43.92091       6.324170 60.06369 3.923012 59.81139 4.369075 0.2523003      5.871869 
1 1 1 10  8  19 o 213.9759 5.239646 559.9440       27.32139 559.9440       27.32139 0.000000       0.000000 213.9759 5.239646 ?        ?        0.000000       5.239646 
1 1 1 10  8  20 o 112.5478 2.881467 154.6337       7.896404 163.1284       11.05628 145.7893       11.28153 115.5070 3.933678 109.1557 4.249284 6.351326       5.790530 
1 1 1 10  8  21 o 39.01050 3.807148 18.76359       3.573234 18.06073       4.687778 19.73826       5.520308 38.06810 5.188112 39.71112 5.882080 -1.643024      7.843174 
1 1 1 10  8  22 f 181.2458 3.436468 401.1596       15.17807 410.9176       21.41048 391.3016       21.51999 183.1796 4.800514 178.7231 4.945875 4.456558       6.892504 
1 1 1 10  8  23 o 137.1657 3.086369 229.7106       10.31643 217.6430       14.00485 244.0276       15.25439 133.3158 4.316519 141.1534 4.440255 -7.837601      6.192593 
1 1 1 10  8  24 o 145.5801 3.783479 259.2853       13.41100 256.4002       23.95482 260.6023       16.18520 144.1052 6.840991 145.8158 4.560491 -1.710617      8.221753 
1 1 1 10  8  25 o 190.0086 3.578642 441.3967       16.57019 431.6252       22.80662 452.3223       24.11573 187.5270 4.995142 191.9266 5.160876 -4.399643      7.182346 
1 1 1 10  8  26 o 131.3256 3.126553 210.7445       10.00578 197.3529       13.49944 227.0709       14.90543 126.8360 4.374088 136.0345 4.502546 -9.198509      6.277386 
1 1 1 10  8  27 o 195.3727 4.283692 467.9366       20.39474 497.8958       25.20916 411.1794       34.69793 201.1948 5.145909 181.6796 7.855770 19.51517       9.391139 
1 1 1 10  8  28 o 111.6500 3.523485 152.7640       9.574656 155.1014       14.96964 151.1458       12.45559 112.0437 5.499416 110.8277 4.622044 1.216026       7.183792 
1 1 1 10  8  29 o 60.74995 3.518201 45.36120       5.186098 44.88457       6.817464 46.01583       7.989741 60.22772 4.681798 60.82427 5.448020 -0.5965538     7.183325 
1 1 1 10  8  30 o 93.29254 3.178602 106.7367       7.215799 103.0116       9.724940 111.2997       10.76323 91.38249 4.379797 94.91777 4.667593 -3.535278      6.400707 
1 1 1 10  8  31 o 115.3645 3.713531 163.7626       10.42627 161.9290       12.20340 168.7190       20.06369 114.4970 4.381804 115.5879 7.158113 -1.090828      8.392782 
1 1 1 10  8  32 o 26.38015 6.557024 9.106466       4.196979 10.07391       5.315340 7.504585       6.839647 27.66591 7.634944 25.25257 8.917675 2.413336       11.73956 
1 1 1 10  8  33 o 155.0222 3.891929 297.6086       14.69100 290.0677       17.57834 315.0762       26.75376 152.4546 4.737276 156.7007 7.023976 -4.246155      8.472191 
1 1 1 10  8  34 o 56.45152 3.782561 39.73795       5.173496 44.44532       6.866702 33.55774       7.867932 59.31738 4.791136 50.71809 6.516312 8.599297       8.088097 
1 1 1 10  8  35 o 54.98909 3.849143 37.96297       5.125371 44.62438       6.870985 29.60655       7.695656 59.16744 4.806776 46.99517 6.927320 12.17227       8.431659 
1 1 1 10  8  36 o 15.85938 6.786065 0.7430404      4.664559 9.766914       8.363734 -3.330966      5.619719 26.40862 9.785650 14.52616 6.721975 11.88246       11.87198 
1 1 1 10  8  37 o 52.26778 3.836501 34.88557       4.852541 33.01346       6.295873 37.62518       7.616149 49.85697 5.261203 52.57736 6.054723 -2.720390      8.021217 
1 1 1 10  8  38 o 21.19605 6.518185 6.530375       3.693524 8.766253       4.824730 3.364908       5.740738 23.97232 7.463034 18.46642 7.693714 5.505901       10.71868 
1 1 1 10  8  39 o 16.37400 6.603114 3.070213       4.057282 6.398544       6.194403 0.5694492      5.369360 20.54343 8.201893 15.53593 6.941624 5.007499       10.74510 
1 1 1 10  8  40 o 14.54133 6.067013 2.085435       3.577245 -1.110526      4.842047 5.926050       5.307971 13.50262 6.245251 19.20670 7.617111 -5.704078      9.850053 
1 1 1 10  8  41 o 27.43650 6.043926 11.89861       3.931630 14.83540       5.507439 8.846613       5.614433 28.46738 7.737912 21.27635 7.990899 7.191034       11.12339 
1 1 1 10  8  42 o 12.45216 5.686075 0.1297395      3.839907 3.039086       4.767659 -5.242114      6.478427 15.29772 6.700775 12.61259 6.185291 2.685128       9.119113 
1 1 1 10  8  43 o 17.53927 6.427092 5.898661       3.590990 4.822781       4.907173 7.139031       5.268960 15.98295 6.901039 17.80089 7.389805 -1.817936      10.11106 
1 1 1 10  8  44 o 19.06638 6.967620 8.185535       4.216017 5.599297       4.951539 15.00302       8.039294 15.92898 6.904903 19.95465 8.721863 -4.025670      11.12423 
1 1 1 10  9  0  o 130.0507 3.305469 206.2509       10.46718 202.6153       20.19196 207.5868       12.24019 128.7445 6.456573 130.4519 3.854592 -1.707397      7.519656 
1 1 1 10  9  1  o 547.4242 9.178380 3656.933       122.4408 3740.694       214.8299 3616.634       149.0120 552.5767 15.97062 544.1926 11.23654 8.384094       19.52743 
1 1 1 10  9  2  o 131.5790 3.091038 210.9875       9.911217 210.6136       16.60828 211.1942       12.35170 131.3383 5.199436 131.5805 3.856275 -0.2422333     6.473406 
1 1 1 10  9  3  o 468.3392 7.930352 2675.814       90.50844 2691.684       156.5089 2667.840       110.9407 468.9609 13.70985 467.4964 9.738153 1.464478       16.81641 
1 1 1 10  9  4  o 731.3971 12.14652 6537.547       216.4918 7046.350       394.0862 6317.628       259.0880 756.6541 21.39410 718.4693 14.79800 38.18475       26.01323 
1 1 1 10  9  5  o 157.7062 3.383333 303.1173       13.00258 291.8008       14.96160 338.0420       26.28373 154.6761 3.972633 166.3623 6.495784 -11.68619      7.614264 
1 1 1 10  9  6  o 374.2057 6.544868 1707.884       59.68255 1570.834       95.88924 1794.552       76.25309 358.3865 10.99249 383.4772 8.159842 -25.09073      13.69006 
1 1 1 10  9  7  o 605.2753 12.50506 4481.488       184.4484 0.000000       0.000000 4481.488       184.4484 ?        ?        605.2753 12.50506 0.000000       12.50506 
1 1 1 10  9  8  o 498.2021 10.42748 3033.430       126.5964 3165.350       183.7601 2914.259       174.6552 507.9144 14.86251 487.3675 14.72269 20.54688       20.92013 
1 1 1 10  9  9  o 599.9075 12.41015 4406.393       181.4252 4633.753       265.0048 4205.828       248.8997 613.3909 17.74750 584.4459 17.49578 28.94495       24.92140 
1 1 1 10  9  10 o 274.8707 6.360922 921.9472       42.60735 988.3008       62.26072 863.5014       58.43305 284.2385 9.000007 265.6630 9.039085 18.57553       12.75559 
1 1 1 10  9  11 o 207.4608 5.314468 525.3987       26.84567 558.8073       38.71726 494.4644       37.25591 213.7717 7.443573 201.0548 7.617822 12.71693       10.65073 
1 1 1 10  9  12 o 248.8503 4.047734 755.1691       24.54631 751.2922       27.83630 768.7237       52.04832 248.1804 4.602650 250.5704 8.536413 -2.390060      9.698182 
1 1 1 10  9  13 o 354.0686 6.178734 1530.994       53.31176 1551.652       66.25004 1493.039       89.79964 356.2357 7.631546 348.7271 10.57926 7.508667       13.04459 
1 1 1 10  9  14 o 93.54914 2.244927 106.6695       5.117739 113.5923       6.557246 95.88095       8.185863 96.48736 2.791720 88.58157 3.800990 7.905785       4.716060 
1 1 1 10  9  15 o 193.6590 3.436779 457.4168       16.21905 453.8938       22.64028 461.1310       23.24611 192.8195 4.818310 194.2813 4.913961 -1.461868      6.882088 
1 1 1 10  9  16 o 133.1255 2.881672 216.1148       9.348500 211.1571       12.87547 221.6426       13.59545 131.4774 4.023344 134.6948 4.146906 -3.217422      5.777900 
1 1 1 10  9  17 o 81.22142 2.888093 80.55727       5.707240 77.28406       7.116910 86.45494       9.553105 79.49590 3.683774 84.00079 4.685431 -4.504890      5.960155 
1 1 1 10  9  18 o 72.30116 2.738701 63.84585       4.816594 58.57859       6.449693 70.48743       7.242399 69.16612 3.841661 75.88354 3.929894 -6.717422      5.495674 
1 1 1 10  9  19 o 34.03081 3.731741 14.30723       3.044010 19.80159       4.071332 7.342456       4.583861 40.04084 4.236697 24.30149 7.216707 15.73934       8.368422 
1 1 1 10  9  20 o 134.0059 3.467393 219.3619       11.31353 217.7158       13.27331 223.7347       21.63327 133.4357 4.086801 134.8892 6.601305 -1.453568      7.763967 
1 1 1 10  9  21 o 112.8949 2.877590 155.6231       7.910160 151.6722       10.73764 160.3116       11.69716 111.3454 3.963635 114.4485 4.201186 -3.103127      5.775844 
1 1 1 10  9  22 o 39.61665 3.797938 19.35210       3.621733 26.63078       4.839272 10.08422       5.460645 46.46680 4.323268 28.16148 7.725579 18.30532       8.852978 
1 1 1 10  9  23 o 125.8643 2.984691 193.4045       9.154574 186.0855       12.34729 202.3394       13.64242 123.2827 4.115691 128.5223 4.362212 -5.239594      5.997317 
1 1 1 10  9  24 o 202.6873 3.664399 502.2180       18.09945 495.2912       25.04107 509.7953       26.19058 200.9062 5.118908 203.7832 5.278450 -2.877045      7.352908 
1 1 1 10  9  25 o 129.7497 3.745152 206.0855       11.82925 189.1450       20.69552 214.3058       14.41638 123.6025 6.898257 132.1823 4.482038 -8.579750      8.226459 
1 1 1 10  9  26 o 128.2750 4.210747 201.7932       13.14463 180.7903       16.22334 241.9293       22.42682 121.1254 5.510715 139.8285 6.600297 -18.70310      8.598367 
1 1 1 10  9  27 o 186.7266 4.051293 427.2633       18.43469 424.9916       29.87502 428.6602       23.42651 185.2351 6.629024 186.6339 5.155813 -1.398819      8.397998 
1 1 1 10  9  28 o 50.61351 3.731399 31.55584       4.569936 26.51938       5.838189 39.52416       7.343434 46.10125 5.292597 56.37269 5.411979 -10.27144      7.569748 
1 1 1 10  9  29 o 98.73705 3.106827 119.4301       7.466076 117.3869       9.913416 122.1079       11.34880 97.67591 4.174480 99.49771 4.693825 -1.821800      6.281583 
1 1 1 10  9  30 o 63.03061 3.489367 48.88216       5.338708 48.13155       6.995023 49.92940       8.262409 62.31116 4.639976 63.27958 5.409897 -0.9684105     7.127157 
1 1 1 10  9  31 o 63.95427 3.480702 50.39266       5.404213 50.89587       7.137381 49.71655       8.273222 64.01071 4.606426 63.02460 5.439967 0.9861145      7.128281 
1 1 1 10  9  32 o 41.55891 5.776234 22.02137       5.691949 22.02137       5.691949 0.000000       0.000000 41.55891 5.776234 ?        ?        0.000000       5.776234 
1 1 1 10  9  33 o 51.13651 3.930267 32.59140       4.860122 31.05516       6.303014 34.84426       7.632824 49.45475 5.313260 52.08198 6.131315 -2.627228      8.113184 
1 1 1 10  9  34 o 33.47391 5.230876 14.47878       4.127405 12.48222       5.292566 17.57763       6.593647 30.33251 7.257464 35.89210 7.764666 -5.559587      10.62830 
1 1 1 10  9  35 o 47.75414 4.022818 28.80793       4.637928 26.04323       6.020716 32.84288       7.273498 44.62431 5.663991 49.91759 6.106339 -5.293289      8.328755 
1 1 1 10  9  36 o 33.36317 5.315633 14.76667       4.176847 15.62933       5.514297 13.60552       6.397532 33.41682 6.996301 30.36357 8.374935 3.053251       10.91273 
1 1 1 10  9  37 o 57.27644 4.727014 43.00134       6.539113 24.99937       10.80578 53.40287       8.213810 37.58556 11.05943 63.22105 5.382604 -25.63549      12.29973 
1 1 1 10  9  38 o 15.48214 6.361981 2.112680       3.851781 -0.7104083     5.527955 4.776704       5.369963 15.24799 6.907598 19.33157 7.663115 -4.083578      10.31689 
1 1 1 10  9  39 o 15.86776 6.289026 3.010215       3.616273 9.716088       4.844050 -5.432284      5.435212 24.30504 7.462917 12.41825 5.991169 11.88679       9.570227 
1 1 1 10  9  40 o 36.92907 4.837336 19.28665       4.248662 19.42961       5.750969 19.11488       6.304084 34.52540 7.073462 33.06933 7.926097 1.456070       10.62341 
1 1 1 10  9  41 o 18.10765 6.696585 5.514533       3.913328 1.765487       5.945175 8.380765       5.198284 15.61434 7.108857 20.86400 7.717708 -5.249663      10.49280 
1 1 1 10  9  42 o 14.18408 5.903859 2.695402       3.375684 0.6760814      4.509498 5.269204       5.091119 13.36888 6.126223 16.99941 7.174159 -3.630526      9.433937 
1 1 1 10  9  43 o 10.95133 5.204022 -1.482672      3.774211 0.2530213      4.511079 -5.532415      6.890611 12.63712 5.906449 12.25086 6.076372 0.3862600      8.473986 
1 1 1 10  9  44 o 14.84626 6.057959 4.150952       3.461802 7.736889       4.734564 0.3150449E-01  5.074556 17.79246 7.147719 12.51233 5.970590 5.280138       9.313314 
1 1 1 10  10 0  o 416.5537 5.563596 2115.444       56.47584 2261.220       93.69672 2032.260       70.77803 430.4691 8.931950 408.2061 7.115130 22.26300       11.41949 
1 1 1 10  10 1  o 493.3537 6.466367 2968.075       77.74184 2904.870       121.0220 3012.481       101.4392 487.7802 10.18132 496.8940 8.377339 -9.113861      13.18481 
1 1 1 10  10 2  o 548.3952 7.147880 3668.081       95.52278 3386.535       142.9155 3895.420       128.4229 526.5435 11.13805 564.9303 9.328492 -38.38678      14.52849 
1 1 1 10  10 3  o 266.3484 4.293199 864.7173       27.86552 843.2318       38.24402 889.0328       40.68472 262.9712 5.967868 270.0111 6.183204 -7.039917      8.593454 
1 1 1 10  10 4  o 619.3398 8.020799 4680.399       121.0550 4622.786       189.5237 4720.102       157.3310 614.8654 12.64874 621.6616 10.38542 -6.796204      16.36605 
1 1 1 10  10 5  o 710.4672 9.164420 6162.480       158.6665 5821.391       241.2517 6422.476       210.6293 689.5324 14.35752 724.8021 11.92513 -35.26965      18.66407 
1 1 1 10  10 6  o 555.7411 7.274547 3768.237       98.51778 3711.150       125.7301 3859.034       158.5649 551.2715 9.359174 561.8146 11.58185 -10.54303      14.89071 
1 1 1 10  10 7  f 408.7307 7.134200 2038.453       71.05893 2041.753       122.6942 2036.788       87.16559 408.2969 12.34557 408.4160 8.758024 -0.1191711     15.13658 
1 1 1 10  10 8  o 322.0037 7.163665 1265.401       56.21241 1223.796       77.55010 1311.461       81.59692 316.2581 10.07533 327.3783 10.24052 -11.12021      14.36595 
1 1 1 10  10 9  o 327.2408 7.259041 1307.269       57.88723 1275.427       80.26697 1341.779       83.56226 322.7710 10.21771 331.0451 10.37105 -8.274109      14.55886 
1 1 1 10  10 10 o 125.9480 4.420520 193.6763       13.54649 194.1600       18.84001 193.1586       19.49189 125.9849 6.155212 125.6397 6.387317 0.3452148      8.870425 
1 1 1 10  10 11 o 290.6722 6.652907 1031.703       47.12496 1005.185       65.16228 1060.778       68.23325 286.4601 9.347122 294.2529 9.528228 -7.792816      13.34750 
1 1 1 10  10 12 o 323.5567 7.243052 1279.403       57.10946 1267.929       79.88457 1291.398       81.67515 321.4694 10.21030 324.4041 10.34482 -2.934784      14.53497 
1 1 1 10  10 13 f 279.5686 6.506398 955.0219       44.32667 914.8867       60.75845 1000.692       64.81252 273.1047 9.142269 285.6003 9.324954 -12.49561      13.05894 
1 1 1 10  10 14 o 321.1240 4.909861 1258.859       38.42183 1248.864       44.32241 1289.078       77.06996 319.7428 5.688352 323.9015 9.775374 -4.158630      11.30996 
1 1 1 10  10 15 o 190.3875 4.792432 442.8729       22.21699 434.5323       33.07245 449.7321       29.99206 188.2552 7.222532 191.6471 6.431073 -3.391891      9.670764 
1 1 1 10  10 16 o 218.4269 4.209396 582.4260       22.40588 572.9582       27.50774 601.0910       38.62273 216.5349 5.213037 221.3876 7.168470 -4.852676      8.863561 
1 1 1 10  10 17 o 107.5083 2.675924 140.9501       7.010544 130.3133       9.438254 154.0415       10.47075 103.2609 3.757026 112.2741 3.832654 -9.013184      5.366981 
1 1 1 10  10 18 o 258.5519 4.209033 816.4479       26.51955 814.5052       37.16235 818.4637       37.85587 257.9479 5.912008 258.5543 6.008215 -0.6063538     8.429146 
1 1 1 10  10 19 o 70.02351 2.660717 59.89246       4.531980 58.15129       5.982896 62.23652       6.941863 68.92678 3.574155 71.27251 4.013061 -2.345734      5.373941 
1 1 1 10  10 20 o 102.3047 2.729238 127.7738       6.798058 124.6512       9.211271 131.5090       10.07442 100.9582 3.750573 103.6765 3.995001 -2.718376      5.479674 
1 1 1 10  10 21 o 67.19600 3.363996 55.26929       5.491002 54.99974       6.149431 56.32968       12.19684 66.99100 3.782248 67.22460 7.577160 -0.2336044     8.468693 
1 1 1 10  10 22 o 87.33919 2.788688 93.18950       5.927726 92.48818       7.962692 94.06129       8.877933 86.91512 3.768441 87.60566 4.170542 -0.6905365     5.620904 
1 1 1 10  10 23 o 132.3039 2.997925 213.7228       9.665613 198.7543       12.87897 233.0262       14.62548 127.3987 4.153945 137.9232 4.356944 -10.52444      6.019819 
1 1 1 10  10 24 o 70.25052 2.941546 60.37051       5.024573 59.93312       6.659815 60.94846       7.655391 69.88708 3.926260 70.40357 4.485397 -0.5164871     5.961066 
1 1 1 10  10 25 o 74.46249 3.924881 68.04061       7.096819 66.56295       8.493796 71.45766       12.91633 73.52299 4.766388 75.72662 7.081424 -2.203629      8.536101 
1 1 1 10  10 26 o 87.24438 3.727682 93.32323       7.906973 88.69312       14.64550 95.22805       9.393661 84.33099 7.195240 88.02632 4.392995 -3.695328      8.430296 
1 1 1 10  10 27 o 11.22696 5.084637 -1.688668      2.992810 -0.5564378     3.773061 -3.609704      4.914667 13.86001 6.017632 13.82300 6.356851 0.3700161E-01  8.753367 
1 1 1 10  10 28 o 54.66645 3.581267 36.76192       4.744557 38.98539       6.072023 33.27607       7.602780 56.15685 4.474018 51.49842 6.181591 4.658424       7.630786 
1 1 1 10  10 29 o 18.16359 6.348655 3.668271       3.460368 3.228745       4.301008 4.474911       5.826641 18.57573 6.990313 21.63218 8.137108 -3.056448      10.72740 
1 1 1 10  10 30 o 88.95845 3.154609 97.11102       6.827801 98.64024       8.953890 94.98632       10.55420 89.43497 4.119422 87.52062 4.968973 1.914345       6.454481 
1 1 1 10  10 31 o 87.07739 3.477998 93.35085       7.365400 92.03958       8.801378 96.41501       13.45431 86.25940 4.199672 87.46036 6.356061 -1.200958      7.618186 
1 1 1 10  10 32 o 60.76984 4.141690 45.91435       6.096751 48.12873       6.857211 37.55890       13.32007 62.09372 4.563606 51.99296 10.86365 10.10076       11.78326 
1 1 1 10  10 33 o 23.66434 6.394258 7.401109       3.774124 9.697658       4.684268 3.151884       6.371752 26.92642 7.055299 20.49098 8.270773 6.435438       10.87120 
1 1 1 10  10 34 o 58.51903 3.550550 42.68301       5.039419 49.25683       6.605759 33.53038       7.794479 62.53145 4.362348 50.51838 6.480497 12.01307       7.811973 
1 1 1 10  10 35 o 18.41234 6.426232 4.169337       3.544700 5.056450       4.433823 2.598058       5.900865 20.19191 7.175243 19.02265 7.851524 1.169260       10.63628 
1 1 1 10  10 36 o 29.06521 5.639225 11.43603       3.850069 14.73334       5.022893 6.739302       5.994761 32.56886 6.555858 22.51829 8.295276 10.05058       10.57312 
1 1 1 10  10 37 o 19.66183 7.943943 4.353153       5.884575 0.000000       0.000000 4.353153       5.884575 ?        ?        19.66183 7.943943 0.000000       7.943943 
1 1 1 10  10 38 o 12.22765 5.451200 -0.4104784     3.291767 2.445281       4.269717 -4.595102      5.168523 16.15091 6.673707 12.63393 6.027788 3.516979       8.992919 
1 1 1 10  10 39 o 31.86851 5.242905 14.47243       3.930176 13.28571       5.026435 16.33930       6.304400 28.64369 7.207881 30.59042 8.263632 -1.946728      10.96545 
1 1 1 10  10 40 o 9.570820 4.614082 -3.621068      3.209730 -0.1229291     4.301517 -8.015717      4.821311 13.36267 6.069278 10.38055 5.136979 2.982124       7.951395 
1 1 1 10  10 41 o 16.76096 6.291523 4.513399       3.479341 8.387330       4.789596 0.1848705      5.062827 20.96803 7.456892 13.93176 6.423163 7.036274       9.841864 
1 1 1 10  10 42 o 17.89804 7.157302 6.366808       4.724760 3.894418       6.026287 10.31113       7.611626 15.98106 7.228662 19.64336 8.537674 -3.662301      11.18684 
1 1 1 10  10 43 o 9.744651 4.743108 -3.378199      3.606620 -5.279502      4.256450 1.461965       6.791284 9.842557 4.862679 14.30439 6.847791 -4.461828      8.398684 
1 1 1 10  10 44 f 13.68141 5.886676 3.081685       3.546521 2.615903       4.609097 3.757722       5.552772 13.61101 6.220704 14.47423 6.692269 -0.8632202     9.136937 
1 1 1 10  11 0  o 403.7656 6.041536 1987.885       59.44466 1992.337       119.2033 1986.411       68.58068 403.5771 12.13442 403.5656 6.973513 0.1147461E-01  13.99550 
1 1 1 10  11 1  o 507.5507 6.649480 3141.757       82.24380 3053.443       127.2387 3205.132       107.7871 500.0225 10.44224 512.4797 8.630860 -12.45715      13.54740 
1 1 1 10  11 2  o 139.8423 3.610749 238.5051       12.29444 247.8887       20.81189 233.4751       15.23736 142.4516 6.008757 138.3206 4.526598 4.130981       7.522981 
1 1 1 10  11 3  o 70.08906 2.507179 59.94112       4.275347 63.92565       6.339113 56.61636       5.790562 72.33193 3.607741 68.06635 3.502800 4.265587       5.028459 
1 1 1 10  11 4  o 477.4281 6.284859 2779.991       73.12057 2784.383       115.4152 2777.047       94.50683 477.4598 9.919504 477.0194 8.130010 0.4404602      12.82551 
1 1 1 10  11 5  o 558.4115 7.284269 3804.725       99.12347 3946.189       160.3866 3717.298       126.0863 568.0900 11.58550 551.7046 9.378325 16.38544       14.90559 
1 1 1 10  11 6  o 220.3602 5.561703 592.5654       29.84213 0.000000       0.000000 592.5654       29.84213 ?        ?        220.3602 5.561703 0.000000       5.561703 
1 1 1 10  11 7  o 475.0753 8.170659 2755.877       94.59228 2927.043       169.8509 2678.922       113.8883 488.3293 14.28849 468.1490 9.982953 20.18033       17.43044 
1 1 1 10  11 8  o 499.2703 10.49018 3049.396       127.6306 3355.220       191.8247 2806.469       170.9648 522.3848 15.08457 477.8328 14.69980 44.55200       21.06249 
1 1 1 10  11 9  o 41.31659 6.910681 21.40317       6.712409 30.12186       9.392675 12.30264       9.596156 49.00355 8.151751 32.35296 10.57583 16.65059       13.35287 
1 1 1 10  11 10 o 148.2609 4.622965 268.3668       16.68216 281.0373       23.66660 255.8546       23.51837 151.5862 6.421331 144.5981 6.692497 6.988144       9.274859 
1 1 1 10  11 11 o 416.5499 8.943520 2123.609       90.78448 2098.764       126.9934 2149.576       129.8309 413.0063 12.63279 417.9385 12.76259 -4.932220      17.95748 
1 1 1 10  11 12 o 291.9498 9.466619 1045.650       67.26120 1045.650       67.26120 0.000000       0.000000 291.9498 9.466619 ?        ?        0.000000       9.466619 
1 1 1 10  11 13 o 148.5929 6.545157 270.4202       23.64217 270.4202       23.64217 0.000000       0.000000 148.5929 6.545157 ?        ?        0.000000       6.545157 
1 1 1 10  11 14 o 53.54831 7.524207 35.78957       9.547973 35.78957       9.547973 0.000000       0.000000 53.54831 7.524207 ?        ?        0.000000       7.524207 
1 1 1 10  11 15 o 184.7012 4.681402 416.8601       21.05385 452.8623       33.43805 393.2122       27.10020 192.1569 7.153317 179.1844 6.215764 12.97256       9.476585 
1 1 1 10  11 16 o 161.6736 3.709608 318.9872       14.61515 334.6685       27.28412 312.6770       17.30770 165.1548 6.793770 159.9501 4.444676 5.204712       8.118526 
1 1 1 10  11 17 o 113.9283 2.682231 158.2957       7.446701 163.0262       10.36172 153.2426       10.70933 115.5124 3.685730 111.9674 3.931051 3.544960       5.388670 
1 1 1 10  11 18 o 87.79554 2.590751 94.08890       5.536802 94.54594       7.530675 93.55114       8.168613 87.94145 3.521139 87.44890 3.842550 0.4925537      5.211872 
1 1 1 10  11 19 f 128.7409 2.849687 202.2042       8.940250 204.4217       12.36817 199.7778       12.93791 129.3117 3.929486 127.8074 4.159594 1.504318       5.722157 
1 1 1 10  11 20 o 314.0070 4.940092 1206.540       37.80162 1198.760       53.17154 1214.491       53.75234 312.3275 6.986069 314.3584 7.016753 -2.030914      9.901514 
1 1 1 10  11 21 o 98.98319 2.758476 119.6482       6.647265 118.1301       8.934973 121.5299       9.947663 98.26009 3.738288 99.62392 4.106325 -1.363838      5.553081 
1 1 1 10  11 22 o 130.4311 3.463524 207.9702       10.99895 201.3877       12.71040 227.5951       21.94664 128.2678 4.071512 135.8636 6.648897 -7.595795      7.796476 
1 1 1 10  11 23 f 78.04094 2.858566 74.45292       5.427156 73.86327       7.118114 75.27161       8.387469 77.63593 3.773714 78.29247 4.414051 -0.6565399     5.807302 
1 1 1 10  11 24 o 218.1087 5.346875 584.0663       28.41902 542.5126       36.41819 648.7746       45.44570 209.4664 7.145029 228.5793 8.171826 -19.11285      10.85496 
1 1 1 10  11 25 o 60.45344 3.086535 44.77067       4.531986 46.21014       5.900726 42.70024       7.076767 61.31381 3.970569 58.77567 4.987907 2.538139       6.375315 
1 1 1 10  11 26 o 51.91216 3.326965 33.09118       4.186599 29.32178       5.299525 39.34924       6.828427 48.68464 4.518492 56.37255 5.023255 -7.687912      6.756469 
1 1 1 10  11 27 o 45.85725 5.081779 26.18461       5.583639 31.89433       11.09748 24.24921       6.461033 49.53711 9.539074 43.86966 6.217689 5.667450       11.38655 
1 1 1 10  11 28 o 120.7853 3.027229 178.5845       8.903339 170.8151       11.91306 188.4146       13.40017 117.8860 4.153406 123.7384 4.451207 -5.852402      6.088023 
1 1 1 10  11 29 f 37.28399 4.313391 17.32418       3.846819 16.49430       4.760598 18.88555       6.529898 36.09407 5.593224 38.25275 7.270695 -2.158676      9.173177 
1 1 1 10  11 30 o 43.46496 4.282477 23.50395       4.477116 27.64533       5.279448 12.89942       8.448145 47.08837 4.661984 31.53666 9.884227 15.55171       10.92850 
1 1 1 10  11 31 o 68.90635 3.323591 58.49207       5.564425 63.78003       7.321066 51.25863       8.562541 71.72969 4.206781 63.85864 5.557635 7.871048       6.970245 
1 1 1 10  11 32 o 72.37380 3.240637 64.62920       5.700921 66.00645       7.401623 62.62047       8.938815 72.84048 4.187475 70.53255 5.237998 2.307922       6.706084 
1 1 1 10  11 33 o 21.95155 6.727019 6.280673       3.938267 6.120441       4.295799 7.124841       9.860172 21.85852 7.071005 26.32012 10.39955 -4.461601      12.57576 
1 1 1 10  11 34 o 20.50416 6.354997 5.513681       3.502766 8.344729       4.354747 0.3250324      5.895443 24.78326 6.937642 17.43978 7.547124 7.343477       10.25134 
1 1 1 10  11 35 o 11.22516 5.154603 -1.958004      3.215159 -2.390527      3.872763 -0.9987549     5.767424 12.22180 5.628644 16.14184 7.204574 -3.920046      9.142621 
1 1 1 10  11 36 o 37.67159 5.056891 18.77750       4.525160 30.26918       6.691853 9.095235       6.142470 47.30878 5.934802 24.88567 8.468709 22.42311       10.34122 
1 1 1 10  11 37 o 31.66769 5.252998 13.68838       3.911796 16.66271       5.115105 9.498254       6.071177 34.19546 6.372727 24.62806 8.418606 9.567400       10.55863 
1 1 1 10  11 38 o 19.30412 7.285197 5.357314       4.678992 7.624393       9.001292 4.517930       5.477118 22.23223 9.467331 18.79737 7.638692 3.434855       12.16470 
1 1 1 10  11 39 o 17.91956 6.370864 4.825196       3.495829 6.956237       4.467866 1.460896       5.613731 20.58563 7.212567 15.96452 7.117835 4.621102       10.13335 
1 1 1 10  11 40 o 12.52459 5.521695 0.5370216      3.285694 -0.5419137     4.292271 2.064061       5.106396 12.98680 5.960673 15.53275 6.864192 -2.545955      9.091026 
1 1 1 10  11 41 f 12.85665 5.772985 0.6327824      3.763760 2.116613       4.568883 -2.500380      6.639102 14.67326 6.488228 13.82943 6.659288 0.8438311      9.297485 
1 1 1 10  11 42 o 13.37422 5.764402 2.082198       3.411972 8.018570       4.710205 -4.471812      4.949174 19.40462 7.312456 11.13430 5.449026 8.270324       9.119424 
1 1 1 10  11 43 f 18.78862 6.566368 7.186821       3.701706 7.428771       4.994045 6.891806       5.514581 17.74233 7.262223 17.00590 7.329021 0.7364273      10.31768 
1 1 1 10  11 44 o 15.14316 6.359312 4.699880       3.969073 4.274630       4.653302 5.835399       7.603898 14.68725 6.518376 15.33897 7.316418 -0.6517210     9.798939 
1 1 1 10  12 0  o 351.8553 5.370425 1509.460       46.04780 1628.915       96.72549 1474.453       52.36221 364.9764 10.88744 347.7140 6.179590 17.26245       12.51893 
1 1 1 10  12 1  o 550.9350 7.183814 3702.873       96.44762 3660.065       151.2498 3732.208       125.2064 547.2414 11.34174 552.8852 9.292991 -5.643799      14.66270 
1 1 1 10  12 2  o 365.4554 4.953300 1628.317       44.11284 1670.315       70.66968 1601.507       56.46406 369.9691 7.838473 362.3609 6.394325 7.608276       10.11578 
1 1 1 10  12 3  o 629.3412 8.153271 4834.303       125.0415 4932.082       200.2017 4771.764       160.1119 634.8361 12.94107 624.8972 10.51427 9.938904       16.67396 
1 1 1 10  12 4  o 149.8768 2.964638 273.7677       10.82785 257.1859       19.65376 280.9940       12.97446 145.1153 5.568046 151.8345 3.506570 -6.719238      6.580211 
1 1 1 10  12 5  o 195.3970 3.410486 465.3669       16.23941 446.2903       22.41785 486.4305       23.55641 191.2561 4.813797 199.7343 4.839722 -8.478134      6.826093 
1 1 1 10  12 6  o 541.1214 9.206853 3577.927       121.4065 3572.976       209.2872 3580.438       149.0476 538.9863 15.95170 540.9207 11.30721 -1.934387      19.55274 
1 1 1 10  12 7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  12 8  o 290.3903 6.652855 1029.418       47.07890 1002.088       65.15659 1059.274       68.10014 286.0939 9.358331 294.1291 9.513615 -8.035156      13.34493 
1 1 1 10  12 9  o 133.7840 4.579684 218.5578       14.90854 244.6033       21.37577 193.8880       20.80359 141.4170 6.217948 125.8203 6.810413 15.59672       9.221963 
1 1 1 10  12 10 o 534.6360 15.94734 3535.133       207.5376 3535.133       207.5376 0.000000       0.000000 534.6360 15.94734 ?        ?        0.000000       15.94734 
1 1 1 10  12 11 o 282.3517 9.216787 977.6864       63.33208 977.6864       63.33208 0.000000       0.000000 282.3517 9.216787 ?        ?        0.000000       9.216787 
1 1 1 10  12 12 o 265.0418 6.263044 858.4088       40.45163 863.7715       57.00233 852.9683       57.41438 265.3457 8.827740 263.6544 8.949101 1.691254       12.57042 
1 1 1 10  12 13 o 130.7914 4.537203 209.0501       14.43927 206.5852       19.91034 211.7846       20.97138 129.8371 6.311706 131.4337 6.568445 -1.596619      9.109451 
1 1 1 10  12 14 o 206.5729 5.383723 521.7737       27.07833 501.4572       37.26160 544.5103       39.41843 202.1581 7.577109 210.6470 7.691974 -8.488922      10.79718 
1 1 1 10  12 15 o 142.1199 4.667539 246.9627       16.14319 237.6435       22.30183 257.2200       23.39739 139.1659 6.594911 144.7886 6.649024 -5.622681      9.364954 
1 1 1 10  12 16 o 21.02530 4.743173 5.615923       2.372207 -2.795445      8.442600 6.336925       2.471787 19.88407 8.804736 22.35929 4.686581 -2.475222      9.974338 
1 1 1 10  12 17 o 98.27460 3.194873 117.9627       7.641057 142.0118       15.82860 110.6556       8.725007 107.5233 6.065524 95.13219 3.771060 12.39111       7.142232 
1 1 1 10  12 18 o 242.4061 4.023904 717.6918       23.76990 693.2836       32.73451 744.9174       34.57213 237.9718 5.644743 246.6521 5.751818 -8.680344      8.058942 
1 1 1 10  12 19 o 21.18219 4.314782 5.682874       2.151507 7.403403       2.597675 1.924231       3.839453 24.21428 4.569766 16.54852 6.504528 7.665756       7.949317 
1 1 1 10  12 20 o 119.6032 2.822315 174.5550       8.225920 169.4598       11.18274 180.5627       12.14290 117.7014 3.904200 121.4752 4.107936 -3.773834      5.667267 
1 1 1 10  12 21 o 58.37766 2.801271 41.68652       3.973459 46.00277       5.216721 35.72226       6.132295 61.26792 3.508716 53.81825 4.723684 7.449669       5.884240 
1 1 1 10  12 22 o 131.8037 4.077705 212.6751       13.08148 206.0196       16.13107 225.4597       22.35705 129.5460 5.119875 135.1494 6.810299 -5.603455      8.520170 
1 1 1 10  12 23 o 44.94772 4.026379 24.91271       4.363534 25.34743       4.837777 23.01580       10.10554 45.28360 4.441033 42.11478 9.997148 3.168823       10.93918 
1 1 1 10  12 24 o 38.57711 3.658266 18.36209       3.397974 21.04768       4.333728 14.07619       5.474737 41.22366 4.381001 33.15682 6.995992 8.066841       8.254519 
1 1 1 10  12 25 o 93.70782 2.827649 107.3583       6.449712 105.9581       8.545875 109.2112       9.831110 92.96976 3.779943 94.30693 4.289051 -1.337166      5.716985 
1 1 1 10  12 26 o 100.3426 2.924148 123.1565       7.142614 125.9600       9.615807 119.7057       10.66835 101.3275 3.901525 98.67443 4.448102 2.653091       5.916715 
1 1 1 10  12 27 o 92.63548 3.757235 105.3279       8.464079 96.56274       15.64648 108.9540       10.06370 87.76741 7.383964 94.09255 4.401205 -6.325142      8.596134 
1 1 1 10  12 28 f 52.06733 3.646436 33.39756       4.597437 31.09661       5.423327 39.27403       8.667029 50.08748 4.490860 55.87405 6.485737 -5.786564      7.888765 
1 1 1 10  12 29 o 11.64809 5.146764 -0.8576651     2.869835 1.788331       3.450452 -6.796160      5.169156 15.64735 6.161378 12.57897 6.008875 3.068378       8.606344 
1 1 1 10  12 30 o 13.28602 6.102316 -3.117286      4.509562 -1.621341      8.411767 -3.720633      5.342112 20.03512 8.833798 14.40826 6.626555 5.626859       11.04297 
1 1 1 10  12 31 o 73.65400 3.153028 66.78868       5.646174 70.25132       7.435399 62.07250       8.677530 75.28790 4.067793 70.41574 5.091351 4.872154       6.516808 
1 1 1 10  12 32 o 31.25887 5.015558 12.51856       3.691400 12.21275       4.499189 13.14839       6.456820 30.49353 6.264390 31.10620 8.345568 -0.6126652     10.43509 
1 1 1 10  12 33 o 43.07572 4.156177 23.35989       4.308662 25.06695       5.345472 20.19381       7.279849 44.31210 5.039693 38.40594 8.036835 5.906162       9.486265 
1 1 1 10  12 34 o 17.24182 6.443303 3.195580       3.640832 5.434587       4.000623 -7.599607      8.784458 20.51729 6.833931 16.95505 8.022409 3.562244       10.53858 
1 1 1 10  12 35 o 20.50052 6.597140 5.652765       3.742477 7.893512       4.881391 2.457416       5.829165 23.73478 7.523332 18.61480 7.753916 5.119978       10.80388 
1 1 1 10  12 36 o 21.81836 6.206346 6.691698       3.456427 6.398766       4.419629 7.153011       5.546258 21.34971 7.184006 22.47464 8.020935 -1.124933      10.76779 
1 1 1 10  12 37 o 32.10506 5.068896 14.05423       3.834278 14.38244       4.968504 13.57094       6.029056 31.28748 6.717360 29.14568 8.164643 2.141804       10.57281 
1 1 1 10  12 38 o 18.59836 6.411161 5.091229       3.523072 6.160796       4.654498 3.656399       5.390997 20.03221 7.320923 17.81504 7.441528 2.217175       10.43898 
1 1 1 10  12 39 o 12.36649 5.748283 -1.607159      4.179952 6.982354       8.281124 -4.543778      4.842045 20.35822 8.876017 11.78429 5.677666 8.573925       10.53658 
1 1 1 10  12 40 o 15.05894 6.228014 2.801626       3.722959 4.982056       4.447044 -2.307030      6.806969 17.59834 6.974367 14.43187 6.894381 3.166469       9.806849 
1 1 1 10  12 41 o 18.82592 6.398365 6.249683       3.506140 4.898863       4.735877 7.888049       5.215632 16.86203 7.003541 19.58847 7.615416 -2.726439      10.34621 
1 1 1 10  12 42 o 15.88050 6.325099 4.543589       3.675167 2.900338       4.989206 6.493039       5.434201 14.66688 6.611015 17.27843 7.356858 -2.611553      9.890848 
1 1 1 10  12 43 o 11.19051 5.210320 -0.1960694     3.456624 -1.976935      4.704109 1.894048       5.096209 11.47663 5.545931 13.61276 6.334197 -2.136134      8.418991 
1 1 1 10  13 0  o 109.5101 2.815886 146.2486       7.508356 140.4195       14.75166 148.2867       8.722775 107.1574 5.669319 110.2553 3.250076 -3.097916      6.534843 
1 1 1 10  13 1  o 186.3321 3.010086 423.1447       13.66792 426.2008       21.43442 421.0506       17.74327 186.9110 4.709630 185.8544 3.917641 1.056549       6.126053 
1 1 1 10  13 2  o 433.5928 5.765891 2292.901       60.92347 2171.982       92.78003 2384.561       80.77887 421.7128 9.028209 442.0286 7.499137 -20.31577      11.73651 
1 1 1 10  13 3  o 245.8789 3.611956 736.9225       21.64213 741.9288       34.06644 733.5347       28.02396 246.6409 5.667945 245.2796 4.688478 1.361221       7.355775 
1 1 1 10  13 4  o 256.7204 4.734541 803.6155       29.61927 779.0184       49.46156 817.3677       36.98372 252.4569 8.050074 258.8566 5.862938 -6.399628      9.958802 
1 1 1 10  13 5  o 242.4184 3.579082 716.3715       21.14332 715.4775       32.99607 716.9943       27.54034 242.1863 5.590833 242.4846 4.660676 -0.2983704     7.278689 
1 1 1 10  13 6  o 223.1944 5.563505 607.7307       30.25993 683.8334       45.00848 544.9575       40.87722 236.4859 7.820792 211.0676 7.961648 25.41835       11.16031 
1 1 1 10  13 7  o 206.2487 7.461890 520.2816       37.44207 520.2816       37.44207 0.000000       0.000000 206.2487 7.461890 ?        ?        0.000000       7.461890 
1 1 1 10  13 8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  13 9  o 305.3086 6.941465 1138.875       51.64476 1173.771       73.82626 1105.432       72.27197 309.3767 9.804735 300.2087 9.892453 9.167999       13.92815 
1 1 1 10  13 10 o 306.8732 6.959931 1151.022       52.04751 1117.484       71.93307 1187.873       75.40199 301.7513 9.795331 311.0818 9.959374 -9.330475      13.96917 
1 1 1 10  13 11 o 82.68735 4.666225 83.70605       9.364291 75.88828       12.68666 93.06351       13.87985 78.50728 6.695167 87.00787 6.595336 -8.500587      9.398069 
1 1 1 10  13 12 o 251.8065 6.063132 774.9877       37.20490 713.0297       49.85217 852.8803       55.89640 241.0222 8.501028 263.5799 8.714308 -22.55771      12.17402 
1 1 1 10  13 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  13 14 o 317.5244 7.210093 1235.397       55.78971 1243.776       78.88136 1227.010       78.91576 317.5473 10.20691 315.3692 10.28228 2.178070       14.48814 
1 1 1 10  13 15 o 162.2737 4.869037 322.0525       19.23250 348.2828       27.87021 298.2057       26.57381 168.4651 6.802808 155.8266 7.016028 12.63850       9.772555 
1 1 1 10  13 16 o 158.6704 4.878607 308.0060       18.84134 293.8004       26.02986 323.6402       27.30736 154.6446 6.924750 162.3237 6.919254 -7.679062      9.789189 
1 1 1 10  13 17 o 81.82309 3.583120 81.88168       7.127201 79.22535       13.33015 82.94502       8.433936 80.07171 6.898759 82.29453 4.219643 -2.222816      8.086919 
1 1 1 10  13 18 o 158.4931 3.731007 306.7576       14.41028 346.7810       28.04867 292.4051       16.79649 167.9323 6.868461 154.6030 4.462922 13.32930       8.191058 
1 1 1 10  13 19 o 301.0884 4.765808 1109.035       34.96767 1111.470       49.22649 1106.555       49.68016 300.8230 6.715088 300.1294 6.792635 0.6935730      9.551560 
1 1 1 10  13 20 o 150.4771 3.078932 276.4120       11.29033 271.8104       15.59349 281.4825       16.36856 149.0264 4.298314 151.6353 4.434462 -2.608917      6.175756 
1 1 1 10  13 21 o 50.58139 3.085377 31.35355       3.784985 31.77803       5.130669 30.84669       5.606477 50.80314 4.181240 49.98453 4.656320 0.8186111      6.258121 
1 1 1 10  13 22 o 152.6304 3.703388 284.7845       13.77452 288.6052       16.23747 274.9773       26.01474 153.4954 4.345343 149.1398 7.179053 4.355637       8.391710 
1 1 1 10  13 23 o 228.1121 5.520661 639.1555       30.68849 639.1555       30.68849 0.000000       0.000000 228.1121 5.520661 ?        ?        0.000000       5.520661 
1 1 1 10  13 24 o 15.21731 5.304045 2.537068       2.414352 1.914052       2.779374 4.452658       4.873587 14.79006 5.607342 20.74437 7.504422 -5.954309      9.367958 
1 1 1 10  13 25 o 226.2728 3.936065 627.0379       21.70355 611.4698       29.79768 644.6296       31.67520 222.9107 5.485490 228.7930 5.681204 -5.882385      7.897258 
1 1 1 10  13 26 f 87.08483 2.877966 92.79523       6.099122 88.45950       7.979008 98.88948       9.459712 84.87817 3.867761 89.66539 4.342202 -4.787224      5.815006 
1 1 1 10  13 27 o 34.51192 4.139498 14.82360       3.412004 12.83705       3.970629 20.43135       6.671186 31.85693 5.300887 39.95670 7.112095 -8.099770      8.870248 
1 1 1 10  13 28 o 128.4447 3.758275 202.6433       11.75097 215.4903       21.96124 197.4896       13.90972 131.2331 6.891315 126.5741 4.516834 4.658936       8.239661 
1 1 1 10  13 29 o 51.50225 4.540247 32.97101       5.639971 49.37752       11.44433 27.70819       6.481739 62.10798 7.728183 46.87247 5.798134 15.23550       9.661427 
1 1 1 10  13 30 o 53.45294 3.388454 35.25428       4.391047 31.68362       5.535724 41.31318       7.211029 50.40181 4.556202 57.41892 5.210209 -7.017113      6.921362 
1 1 1 10  13 31 o 27.71666 5.361457 9.922162       3.490299 12.20226       4.384493 5.977511       5.766955 30.60836 6.092482 22.80012 8.174141 7.808239       10.19485 
1 1 1 10  13 32 o 86.12858 3.175533 91.62762       6.653586 98.98967       8.900482 82.30190       10.01742 89.12383 4.109169 80.74858 5.117106 8.375244       6.562777 
1 1 1 10  13 33 o 42.31196 4.114233 22.58738       4.188671 17.82924       5.145792 31.93139       7.211079 36.85888 5.930064 49.45028 6.114158 -12.59140      8.517546 
1 1 1 10  13 34 o 21.00607 6.938056 5.811060       4.125723 6.041323       4.541614 4.723735       9.869102 21.47749 7.282355 23.80641 10.01443 -2.328924      12.38231 
1 1 1 10  13 35 o 21.18483 6.125216 6.173772       3.340395 5.554828       4.089796 7.414088       5.789516 20.37187 6.910597 23.15503 8.202011 -2.783167      10.72517 
1 1 1 10  13 36 o 44.56150 3.935986 25.61890       4.230250 30.82831       5.440429 17.65338       6.727379 48.38012 4.672636 33.85841 8.233970 14.52171       9.467406 
1 1 1 10  13 37 o 17.50175 6.191823 4.184824       3.298576 2.396249       4.121027 7.373932       5.502835 15.97176 6.573717 21.85766 7.964473 -5.885894      10.32698 
1 1 1 10  13 38 o 27.57544 5.631061 11.11003       3.655884 11.49364       4.703018 10.52425       5.811567 26.71713 7.102169 24.39280 8.238028 2.324327       10.87685 
1 1 1 10  13 39 o 25.85070 8.149952 12.42053       5.735398 5.744002       8.793224 17.36410       7.566467 19.51045 8.786969 28.78500 9.389822 -9.274542      12.86000 
1 1 1 10  13 40 o 15.86977 6.136718 3.771200       3.373078 4.410669       4.424211 2.883491       5.212686 16.83420 6.856231 15.86213 6.975410 0.9720650      9.780810 
1 1 1 10  13 41 o 10.91909 5.073126 -0.8907897     3.249842 -0.6896024     4.302861 -1.157959      4.958501 12.33057 5.764921 12.72233 6.021933 -0.3917570     8.336546 
1 1 1 10  13 42 o 13.38892 5.833659 2.226945       3.572172 0.5210501      4.759804 4.426765       5.405135 12.98690 6.069003 15.60793 6.969879 -2.621029      9.241861 
1 1 1 10  13 43 o 10.13779 4.884130 -2.177790      3.582052 -0.9630564     5.071966 -3.386620      5.059629 12.11613 5.830777 11.16887 5.474998 0.9472618      7.998347 
1 1 1 10  14 0  o 154.2226 3.044578 289.8866       11.44225 279.4624       15.88484 301.1283       16.49602 151.3410 4.311545 157.1025 4.312915 -5.761536      6.098414 
1 1 1 10  14 1  o 212.3160 5.078022 549.7148       26.27324 516.1965       37.06572 583.5615       37.24688 205.5107 7.413343 218.5603 7.002343 -13.04959      10.19757 
1 1 1 10  14 2  f 84.30910 2.643890 86.71346       5.425213 92.86601       7.790581 80.92056       7.559458 87.20464 3.674248 81.38403 3.822350 5.820610       5.301929 
1 1 1 10  14 3  o 309.7280 4.806272 1169.868       36.27646 1183.007       51.64194 1157.069       50.96998 311.3291 6.806858 307.8982 6.793150 3.430908       9.616663 
1 1 1 10  14 4  o 94.18506 2.559657 108.1943       5.869444 105.3480       8.185581 111.2064       8.420708 92.88950 3.623101 95.44098 3.627177 -2.551476      5.126721 
1 1 1 10  14 5  o 101.2822 2.414118 125.0210       5.958373 114.9060       8.778810 133.6606       8.113307 97.01040 3.720377 104.6650 3.184679 -7.654648      4.897284 
1 1 1 10  14 6  o 101.8251 2.795653 126.4754       6.930475 124.0491       8.635006 130.8679       11.61828 100.8091 3.520413 103.4808 4.618936 -2.671646      5.807571 
1 1 1 10  14 7  o 101.6030 4.384557 126.1447       10.83041 140.1256       15.28350 112.0423       15.34975 106.9802 5.885178 95.55302 6.633231 11.42721       8.867641 
1 1 1 10  14 8  o 281.1414 6.524619 965.5065       44.70087 964.7167       62.73668 966.3209       63.70768 280.5297 9.189524 280.7379 9.325191 -0.2081604     13.09223 
1 1 1 10  14 9  o 259.8614 8.840879 828.0233       55.90369 0.000000       0.000000 828.0233       55.90369 ?        ?        259.8614 8.840879 0.000000       8.840879 
1 1 1 10  14 10 o 371.9936 8.146841 1694.535       73.85175 1659.517       102.7291 1731.990       106.2439 367.0475 11.49929 374.9334 11.64234 -7.885895      16.36392 
1 1 1 10  14 11 o 328.3433 7.371086 1319.726       58.97878 1272.674       81.25878 1372.109       85.73858 321.5402 10.38410 333.8221 10.55288 -12.28189      14.80516 
1 1 1 10  14 12 o 180.4925 5.046066 398.2235       22.17287 402.1727       31.30587 394.2483       31.40873 181.1001 7.107470 179.2888 7.203546 1.811356       10.11964 
1 1 1 10  14 13 o 349.3722 7.771602 1496.907       66.16601 1515.394       93.99065 1478.745       93.16059 350.2134 11.02700 345.9319 11.06533 4.281494       15.62166 
1 1 1 10  14 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  14 15 o 32.75336 7.800096 13.69923       6.136154 13.55309       8.377830 13.86834       9.012558 32.91373 9.751909 33.42851 10.16319 -0.5147820     14.08510 
1 1 1 10  14 16 o 172.7566 5.042037 365.2494       21.20371 416.2871       31.71591 324.0013       28.51241 184.0576 7.084333 162.3168 7.226442 21.74074       10.11975 
1 1 1 10  14 17 o 107.7573 4.658031 142.2206       12.20277 123.5729       16.50585 164.6980       18.12174 100.1212 6.805579 115.7130 6.452155 -15.59184      9.377964 
1 1 1 10  14 18 o 192.9561 3.338177 454.5225       15.69655 441.8342       22.73314 466.0830       21.69945 189.9689 4.914799 195.2327 4.561000 -5.263763      6.705070 
1 1 1 10  14 19 o 159.5665 3.541772 310.9691       13.77204 343.2997       23.27289 293.5462       17.08454 167.2431 5.718807 154.8499 4.532354 12.39320       7.297053 
1 1 1 10  14 20 o 136.8641 2.971240 228.6575       9.909764 226.0333       13.70975 231.5288       14.34057 135.8957 4.144726 137.5182 4.284501 -1.622513      5.961183 
1 1 1 10  14 21 o 232.3291 4.635026 660.9273       26.24170 657.5853       31.29229 668.8471       48.17210 231.4951 5.547016 232.2114 8.527352 -0.7162170     10.17276 
1 1 1 10  14 22 o 46.89058 3.113205 26.97359       3.537228 27.60233       4.618442 26.08147       5.501399 47.32758 4.043156 45.85371 5.004513 1.473877       6.433682 
1 1 1 10  14 23 o 108.7391 2.858728 144.4988       7.568642 136.8154       10.11594 154.2694       11.40740 105.6651 3.935482 112.1720 4.180486 -6.506866      5.741470 
1 1 1 10  14 24 o 79.81149 3.319542 78.01353       6.442147 75.65616       7.189010 87.62333       14.51487 78.53582 3.767329 83.84032 7.173198 -5.304504      8.102316 
1 1 1 10  14 25 o 45.80687 3.316218 25.79843       3.676710 24.62795       4.567778 27.95222       6.196225 44.61774 4.252452 47.34218 5.471420 -2.724438      6.929631 
1 1 1 10  14 26 o 103.3005 3.182791 130.6720       8.002547 133.3676       9.835849 125.3932       13.76402 104.2361 3.878964 100.6540 5.633974 3.582100       6.840177 
1 1 1 10  14 27 o 38.59326 3.711103 18.42930       3.447228 16.73002       4.229338 21.79265       5.950111 36.54293 4.870500 41.52593 6.058276 -4.982998      7.773318 
1 1 1 10  14 28 o 85.24389 3.757748 89.40348       7.786790 89.32121       14.57613 89.43634       9.211338 84.14266 7.177143 85.09263 4.457711 -0.9499664     8.448820 
1 1 1 10  14 29 o 60.96023 4.193492 46.02690       6.191625 59.03064       12.24938 41.56437       7.175805 67.94717 7.523784 57.67004 5.160524 10.27712       9.123504 
1 1 1 10  14 30 o 55.85928 3.257595 38.48594       4.415092 35.49233       5.550244 43.64450       7.285829 53.39075 4.302294 58.99357 5.118626 -5.602825      6.686558 
1 1 1 10  14 31 o 42.22056 3.937374 22.26412       4.004335 26.08919       4.928288 14.83271       6.869292 45.57163 4.496293 33.01663 8.490436 12.55500       9.607505 
1 1 1 10  14 32 o 100.4170 3.076593 124.5569       7.519704 123.3350       9.810198 126.2975       11.70890 99.42506 4.057506 100.1407 4.812181 -0.7156754     6.294477 
1 1 1 10  14 33 o 20.27037 6.365434 5.381923       3.502052 3.472682       4.322969 9.027123       5.973273 18.32285 6.982222 25.67406 8.340645 -7.351208      10.87740 
1 1 1 10  14 34 o 54.26022 3.512013 37.00816       4.618857 39.01506       5.890458 33.80434       7.442537 55.23691 4.412730 50.25963 6.208523 4.977280       7.616951 
1 1 1 10  14 35 o 58.94252 3.831094 44.28254       5.473034 43.33400       6.111851 48.12175       12.29608 57.93179 4.361345 55.95010 9.347971 1.981693       10.31532 
1 1 1 10  14 36 o 13.16497 5.551965 0.8561994      3.045533 0.7946324      3.720361 0.9812700      5.302605 14.12944 6.053468 16.27484 7.099037 -2.145404      9.329566 
1 1 1 10  14 37 o 12.71778 5.457611 0.6493524      3.033199 1.087384       3.777705 -0.1454042     5.088531 14.19818 6.091754 14.84956 6.686408 -0.6513805     9.045303 
1 1 1 10  14 38 o 17.45895 6.512671 4.442935       3.716294 7.163758       4.342775 -2.999716      7.182590 20.91812 7.120771 15.08655 7.171917 5.831572       10.10652 
1 1 1 10  14 39 o 14.84111 5.979873 2.736092       3.324444 3.640768       4.336734 1.446862       5.177041 16.39701 6.745613 15.19010 6.799537 1.206908       9.577943 
1 1 1 10  14 40 o 11.77060 5.561604 -1.878651      4.194440 5.070755       8.545433 -4.084329      4.814280 17.79995 8.255044 11.49540 5.568340 6.304551       9.957518 
1 1 1 10  14 41 o 22.21501 6.406877 8.931013       3.658958 11.18315       5.057995 6.458633       5.299549 22.75278 7.685386 17.64030 7.374040 5.112480       10.65090 
1 1 1 10  14 42 o 12.45912 5.555164 1.380822       3.419756 -0.6419109     4.592507 3.898313       5.123473 12.14524 5.762436 15.06571 6.752517 -2.920471      8.877058 
1 1 1 10  14 43 o 12.36526 5.581964 1.473684       3.572372 0.8485371      4.826136 2.231350       5.313091 12.74526 6.004904 13.67544 6.397703 -0.9301786     8.774364 
1 1 1 10  15 0  o 126.0519 2.923805 193.6632       8.981192 207.2991       18.25761 189.3103       10.31558 130.2253 5.767549 124.5737 3.401246 5.651657       6.695752 
1 1 1 10  15 1  o 157.6138 3.170752 302.8093       12.17846 354.3812       26.35793 288.8113       13.73214 170.2861 6.362981 153.9173 3.661126 16.36876       7.341074 
1 1 1 10  15 2  o 497.8008 7.324011 3026.233       88.84657 2974.367       174.6595 3044.339       103.1956 491.6543 14.59410 499.0944 8.484817 -7.440094      16.88135 
1 1 1 10  15 3  o 100.4680 2.476137 123.0217       6.062315 114.5135       9.007948 130.0657       8.196239 96.83760 3.824729 103.2423 3.261866 -6.404694      5.026761 
1 1 1 10  15 4  o 288.9070 4.097975 1017.833       28.85118 1033.876       45.68007 1007.187       37.21288 291.0004 6.441648 287.3122 5.314999 3.688202       8.351291 
1 1 1 10  15 5  o 174.7686 2.918536 372.3294       12.42982 342.3884       18.47802 397.0752       16.79858 167.4804 4.531632 180.4541 3.820055 -12.97375      5.926931 
1 1 1 10  15 6  o 180.9166 3.293890 399.0563       14.52191 381.1715       26.32558 406.8789       17.41046 176.5749 6.127333 182.6579 3.911433 -6.082932      7.269354 
1 1 1 10  15 7  o 181.6713 4.996317 403.0803       22.09835 424.8544       31.59020 382.2148       30.92402 186.3156 6.970008 176.6783 7.197585 9.637314       10.01929 
1 1 1 10  15 8  f 379.1983 8.269374 1760.446       76.41438 1699.016       105.2413 1828.945       111.1316 371.4754 11.64009 385.3590 11.84820 -13.88367      16.60938 
1 1 1 10  15 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  15 10 f 117.7038 6.496439 169.9423       18.56155 0.000000       0.000000 169.9423       18.56155 ?        ?        117.7038 6.496439 0.000000       6.496439 
1 1 1 10  15 11 o 217.4633 5.579956 578.3398       29.54568 604.8868       42.56941 553.6656       41.04034 221.9982 7.881367 212.3664 7.944293 9.631836       11.19052 
1 1 1 10  15 12 o 365.3711 8.069664 1638.007       71.84983 1646.423       101.7143 1629.625       101.5081 364.8474 11.45442 362.9624 11.49080 1.884918       16.22474 
1 1 1 10  15 13 o 89.92709 4.591964 99.03449       10.02963 97.71500       13.96363 100.4407       14.41522 89.10110 6.475199 90.32500 6.594469 -1.223907      9.242036 
1 1 1 10  15 14 o 143.3362 4.716496 251.3108       16.45203 286.8653       24.48859 222.0620       22.21115 152.8776 6.588775 134.4358 6.801950 18.44180       9.469872 
1 1 1 10  15 15 o 204.7305 5.435637 513.1513       27.09472 485.9144       37.14096 544.1360       39.61391 198.7442 7.683187 210.3151 7.742535 -11.57089      10.90771 
1 1 1 10  15 16 o 137.4533 4.738683 231.2635       15.84889 228.6688       22.31465 233.9049       22.51411 136.3609 6.736128 137.9202 6.718923 -1.559280      9.514166 
1 1 1 10  15 17 o 121.2042 6.744069 180.9069       19.84085 0.000000       0.000000 180.9069       19.84085 ?        ?        121.2042 6.744069 0.000000       6.744069 
1 1 1 10  15 18 o 150.6619 7.026207 279.6678       25.72543 0.000000       0.000000 279.6678       25.72543 ?        ?        150.6619 7.026207 0.000000       7.026207 
1 1 1 10  15 19 o 234.6317 4.507473 673.5401       25.77246 577.5996       44.56729 721.7432       31.59022 215.9978 8.483521 242.6815 5.341705 -26.68369      10.02517 
1 1 1 10  15 20 o 95.88668 4.857181 112.8987       11.31258 123.3547       16.30988 103.2049       15.70412 99.89420 6.739440 91.25314 7.118311 8.641052       9.802571 
1 1 1 10  15 21 o 18.32921 5.264157 4.213958       2.475025 4.050703       3.171122 4.468409       3.958964 18.53637 6.080749 19.87400 6.798086 -1.337633      9.120827 
1 1 1 10  15 22 o 214.0012 3.766770 560.1296       19.64362 568.7877       27.68302 551.3486       27.87855 215.2562 5.277420 211.8251 5.405199 3.431152       7.554292 
1 1 1 10  15 23 o 80.56657 2.803756 79.36985       5.496280 82.30629       7.423565 75.80734       8.176732 81.93545 3.727724 78.54703 4.288094 3.388420       5.681872 
1 1 1 10  15 24 o 69.80029 3.855516 59.83810       6.532592 59.83810       6.532592 0.000000       0.000000 69.80029 3.855516 ?        ?        0.000000       3.855516 
1 1 1 10  15 25 o 104.3376 2.902142 133.1723       7.371802 142.2757       10.16942 123.0913       10.70153 107.6815 3.881773 100.0468 4.400177 7.634651       5.867685 
1 1 1 10  15 26 o 63.46225 3.039148 49.37880       4.686401 48.51685       6.073801 50.64687       7.366971 62.76305 3.991875 63.98996 4.758397 -1.226913      6.211071 
1 1 1 10  15 27 o 68.06857 3.917455 57.08307       6.470658 83.21089       13.71777 49.60598       7.338346 81.34861 6.987492 63.25857 4.796131 18.09004       8.475135 
1 1 1 10  15 28 o 67.13556 3.017636 55.33384       4.924295 56.27390       6.505730 54.07274       7.535131 67.52031 3.971436 66.00711 4.715570 1.513199       6.165136 
1 1 1 10  15 29 o 83.75268 3.773826 86.55782       7.682448 90.66556       14.63182 84.99441       9.026802 84.36028 7.185779 82.77464 4.491908 1.585648       8.474235 
1 1 1 10  15 30 o 22.71413 5.591219 6.722699       3.073696 5.938245       3.761122 8.300079       5.333375 21.53888 6.568875 25.29044 7.842253 -3.751568      10.22991 
1 1 1 10  15 31 o 86.83209 3.082851 93.03654       6.512973 84.76079       8.252294 106.7058       10.60580 82.46730 4.119400 92.22861 4.734757 -9.761314      6.275936 
1 1 1 10  15 32 o 12.98654 5.575394 0.5061451E-01  3.168132 -0.9760535     3.891290 2.069140       5.456269 13.43413 5.961597 18.33302 7.556720 -4.898884      9.625210 
1 1 1 10  15 33 o 43.92255 3.795423 24.33129       4.022592 28.26225       5.158754 18.23360       6.425063 47.02191 4.559176 36.21290 7.526715 10.80901       8.799860 
1 1 1 10  15 34 o 15.95459 5.917120 2.851054       3.059251 0.9209506      3.652362 7.388875       5.600248 14.46588 6.089124 23.14767 8.077480 -8.681787      10.11549 
1 1 1 10  15 35 o 16.50722 5.873153 3.417251       2.971470 4.108659       3.579145 1.883609       5.330573 17.90977 6.437310 17.20208 7.303940 0.7076855      9.735836 
1 1 1 10  15 36 o 24.43351 5.670544 8.489459       3.311093 10.63641       4.139159 4.674159       5.517796 26.93341 6.401217 19.29751 7.728667 7.635900       10.03533 
1 1 1 10  15 37 o 12.84694 5.635260 0.3260673      3.382680 1.226916       3.879497 -2.530936      6.908835 14.32026 6.159131 15.31045 7.204567 -0.9901829     9.478433 
1 1 1 10  15 38 f 20.27118 6.323266 6.488580       3.461739 10.69103       4.572403 0.8448087      5.298803 25.32029 7.116415 15.17117 6.827885 10.14912       9.862220 
1 1 1 10  15 39 o 10.96901 5.078488 -1.193239      3.213738 1.645900       4.242498 -5.015970      4.922833 14.40916 6.316007 11.45134 5.566444 2.957821       8.418862 
1 1 1 10  15 40 o 12.49659 5.849482 -0.8774649     4.451923 5.852461       9.236431 -2.914118      5.081098 17.80620 8.363690 12.16131 5.848295 5.644881       10.20558 
1 1 1 10  15 41 o 14.35663 5.955317 3.142057       3.418161 2.003398       4.748675 4.366407       4.924118 14.02279 6.372181 15.74579 6.855035 -1.723000      9.359283 
1 1 1 10  15 42 o 17.82750 6.529745 6.532309       3.705965 7.573250       5.120360 5.387117       5.370645 17.68640 7.308268 15.87666 7.026751 1.809736       10.13834 
1 1 1 10  16 0  o 126.4276 2.905039 194.8335       8.950147 178.5622       16.52181 201.5916       10.64783 120.8367 5.626216 128.5472 3.402078 -7.710457      6.574834 
1 1 1 10  16 1  o 401.2550 5.401091 1964.579       52.81266 1886.588       81.11687 2021.964       69.58019 392.7988 8.474321 406.8727 7.017639 -14.07385      11.00279 
1 1 1 10  16 2  o 236.3313 3.990037 681.0903       22.97916 692.7161       46.49493 677.3328       26.43314 237.9081 8.031253 235.6465 4.603113 2.261658       9.256872 
1 1 1 10  16 3  o 118.5717 2.556778 171.3655       7.387712 161.0632       11.09790 179.5638       9.900018 114.8548 3.971086 121.3130 3.352038 -6.458244      5.196699 
1 1 1 10  16 4  o 122.3383 2.587362 182.4322       7.713578 178.9906       11.65532 185.1143       10.28924 121.0827 3.955389 123.1683 3.431402 -2.085602      5.236375 
1 1 1 10  16 5  o 179.9729 2.986815 394.8799       13.09940 365.8967       19.49603 418.7328       17.68658 173.1125 4.625630 185.2913 3.916993 -12.17874      6.061295 
1 1 1 10  16 6  o 112.4795 2.469939 154.2180       6.770108 164.2404       10.36099 146.7504       8.943421 115.9896 3.670228 109.6520 3.350895 6.337593       4.969816 
1 1 1 10  16 7  o 247.4682 4.046033 747.1069       24.39973 693.3284       48.49949 765.3309       28.23283 237.7660 8.383617 250.4206 4.626453 -12.65463      9.575443 
1 1 1 10  16 8  o 301.8596 6.902941 1114.653       50.77797 1124.417       71.90601 1104.941       71.71615 302.4249 9.769711 299.7750 9.830445 2.649902       13.85947 
1 1 1 10  16 9  o 338.3526 7.559624 1402.219       62.33125 1497.396       91.44778 1319.633       85.18452 348.5485 10.77944 327.2146 10.69734 21.33389       15.18649 
1 1 1 10  16 10 o 371.1057 8.163518 1689.285       73.82629 1702.937       104.6840 1675.776       104.1304 371.1774 11.58765 368.1879 11.62027 2.989502       16.41049 
1 1 1 10  16 11 o 97.63667 6.440763 117.1810       15.23891 0.000000       0.000000 117.1810       15.23891 ?        ?        97.63667 6.440763 0.000000       6.440763 
1 1 1 10  16 12 o 78.82492 4.760354 76.18410       9.101439 72.54527       12.68267 80.04787       13.06877 76.64668 6.862727 80.56331 6.717823 -3.916634      9.603445 
1 1 1 10  16 13 o 204.7769 5.428236 513.2100       27.06405 534.7056       39.02460 493.2914       37.56576 208.5634 7.691463 200.3083 7.710259 8.255112       10.89067 
1 1 1 10  16 14 o 143.7479 4.754940 252.8298       16.63354 246.9395       23.26953 258.9843       23.78570 141.7591 6.755417 145.1852 6.741319 -3.426086      9.543639 
1 1 1 10  16 15 o 36.21985 9.877865 16.74375       8.957458 0.000000       0.000000 16.74375       8.957458 ?        ?        36.21985 9.877865 0.000000       9.877865 
1 1 1 10  16 16 o 231.5793 8.364192 661.8381       47.12441 0.000000       0.000000 661.8381       47.12441 ?        ?        231.5793 8.364192 0.000000       8.364192 
1 1 1 10  16 17 o 137.7980 4.828225 232.6145       16.18807 220.3359       22.25608 246.4076       23.58878 133.7393 6.851783 141.4470 6.863953 -7.707703      9.698493 
1 1 1 10  16 18 o 373.3681 8.348634 1722.007       75.96066 1794.663       109.9582 1655.682       105.0584 378.3067 11.94240 363.4039 11.87925 14.90277       16.84451 
1 1 1 10  16 19 o 100.5007 4.888788 123.9931       11.93718 127.9567       16.84866 119.9982       16.91497 101.7411 6.835343 98.45613 7.097690 3.284958       9.853889 
1 1 1 10  16 20 o 101.6114 2.513988 125.9922       6.225035 138.1213       10.00625 118.3339       7.950985 106.2109 3.872522 98.36421 3.321783 7.846703       5.102026 
1 1 1 10  16 21 o 219.9833 3.843928 591.8999       20.60635 583.0626       28.80873 601.1581       29.48666 217.9224 5.424829 221.2646 5.468617 -3.342224      7.702892 
1 1 1 10  16 22 o 34.11674 3.902496 14.42739       3.186180 17.72753       4.270224 10.28265       4.785560 37.73054 4.749300 28.30060 6.982657 9.429941       8.444723 
1 1 1 10  16 23 o 28.93291 4.774948 10.53964       3.249302 13.31628       4.109040 5.905666       5.308327 32.49073 5.377686 22.81961 7.869496 9.671120       9.531446 
1 1 1 10  16 24 o 26.22868 4.819157 8.713905       2.966759 8.790969       3.794716 8.592744       4.758136 26.17285 6.068017 25.93482 7.248891 0.2380257      9.453425 
1 1 1 10  16 25 o 40.54657 4.319867 20.40611       4.202708 19.01512       4.529954 29.00332       11.26191 39.02419 4.869117 46.98933 10.13341 -7.965137      11.24252 
1 1 1 10  16 26 o 101.8413 3.669719 127.3483       9.092477 108.6856       16.47385 135.5242       10.90372 92.99301 7.328764 104.9223 4.273469 -11.92926      8.483709 
1 1 1 10  16 27 o 27.54192 4.859028 9.632238       3.142053 9.732468       4.055024 9.481645       4.970503 27.43959 6.209676 27.03602 7.351963 0.4035683      9.623484 
1 1 1 10  16 28 o 59.25404 3.140939 43.18857       4.519178 46.69482       5.926634 38.31795       6.985202 61.44758 3.979321 55.32455 5.243730 6.123032       6.582682 
1 1 1 10  16 29 o 56.48822 3.241060 39.35357       4.442774 39.64543       5.693610 38.89920       7.103955 56.47816 4.166189 55.60366 5.307075 0.8744965      6.747012 
1 1 1 10  16 30 o 57.76102 4.420451 41.73774       6.174833 44.77246       11.83454 40.60254       7.238196 57.83223 8.663801 56.64377 5.305493 1.188461       10.15922 
1 1 1 10  16 31 o 23.84753 6.086477 7.546700       3.548471 12.83825       4.670951 0.3248999      5.456781 31.11402 6.374955 17.00718 7.309578 14.10684       9.698968 
1 1 1 10  16 32 o 37.36193 4.345816 17.77751       3.882973 20.91085       4.898883 12.48217       6.368553 40.24547 5.110155 29.71782 8.414782 10.52765       9.844909 
1 1 1 10  16 33 o 41.97554 4.095132 22.44929       4.135695 29.88841       5.312140 11.00169       6.589705 48.23816 4.573638 27.51181 8.743685 20.72635       9.867634 
1 1 1 10  16 34 o 14.92596 5.769145 2.230225       2.980110 2.991547       3.676844 0.7724511      5.087871 16.69049 6.419474 16.22513 7.016327 0.4653606      9.509915 
1 1 1 10  16 35 o 11.09252 5.013007 -1.013590      2.890651 0.9780209      3.540861 -4.993094      5.005196 14.07346 5.963233 12.40092 5.920796 1.672541       8.403331 
1 1 1 10  16 36 o 31.55427 6.227002 14.55777       4.618117 14.55777       4.618117 0.000000       0.000000 31.55427 6.227002 ?        ?        0.000000       6.227002 
1 1 1 10  16 37 o 12.17784 5.399478 0.1356631E-01  3.185294 5.257573       4.135334 -7.636620      4.994764 18.63511 6.885306 10.91903 5.370027 7.716073       8.731817 
1 1 1 10  16 38 o 11.53711 5.271152 -0.7808589     3.305896 -0.6649547E-01 4.337579 -1.770916      5.106436 13.44597 6.102198 13.31310 6.242289 0.1328678      8.729432 
1 1 1 10  16 39 o 23.81562 6.294912 9.430605       3.708015 8.606062       5.036145 10.40680       5.479745 21.04260 7.626291 22.65928 7.983790 -1.616678      11.04089 
1 1 1 10  16 40 o 10.65014 5.007268 -1.435228      3.324591 -1.120486      4.609329 -1.776522      4.799819 12.37939 5.843486 12.24227 5.831951 0.1371193      8.255784 
1 1 1 10  16 41 o 13.13625 6.051832 1.075305       4.482349 8.074777       9.405960 -0.9812647     5.098498 17.16666 8.173933 12.50579 5.972204 4.660870       10.12326 
1 1 1 10  16 42 o 15.84878 6.434619 5.088582       3.882382 6.689803       5.874272 3.846697       5.173318 16.45516 7.312212 14.71726 6.673215 1.737897       9.899508 
1 1 1 10  17 0  o 351.9849 4.836580 1511.610       41.48571 1400.640       62.32572 1599.889       55.58970 338.4904 7.555876 361.9470 6.302506 -23.45660      9.839353 
1 1 1 10  17 1  o 235.0669 3.545752 673.7761       20.31121 678.7073       31.87944 670.4066       26.35219 235.7971 5.547996 234.4173 4.613081 1.379807       7.215315 
1 1 1 10  17 2  o 51.23403 2.952158 32.10680       3.670214 31.42276       5.368955 32.70687       5.028673 50.56193 4.401238 51.62762 4.028890 -1.065685      5.966812 
1 1 1 10  17 3  o 329.1384 5.144918 1322.285       41.26607 1171.004       76.93111 1383.396       48.89564 308.7724 10.23831 336.5572 5.961770 -27.78479      11.84761 
1 1 1 10  17 4  o 142.1790 2.733464 246.4376       9.470763 268.8368       15.00336 231.5999       12.21112 148.3907 4.153105 137.7562 3.640735 10.63451       5.522974 
1 1 1 10  17 5  o 79.13264 2.664608 76.42645       5.131037 65.88463       8.312195 82.91635       6.521935 73.32480 4.676251 82.39561 3.254553 -9.070816      5.697319 
1 1 1 10  17 6  f 110.9142 2.493850 149.9695       6.740520 149.4366       10.08857 150.3992       9.059340 110.6180 3.747964 110.9995 3.353031 -0.3814774     5.028922 
1 1 1 10  17 7  o 190.8517 2.997846 444.1671       13.94252 456.4211       22.44025 436.4624       17.79385 193.3484 4.762675 189.1393 3.860575 4.209152       6.130833 
1 1 1 10  17 8  o 310.4253 5.649678 1177.764       42.73827 1197.046       75.85007 1168.794       51.73214 311.7809 9.996132 309.0137 6.869841 2.767242       12.12920 
1 1 1 10  17 9  f 227.9906 5.709992 635.8912       31.69908 638.7429       44.77298 633.0252       44.88576 228.0475 8.069367 227.0104 8.126960 1.037155       11.45261 
1 1 1 10  17 10 o 206.8465 5.413105 523.3838       27.26197 518.3761       38.08864 528.6440       39.03736 205.4559 7.620684 207.4591 7.735227 -2.003159      10.85857 
1 1 1 10  17 11 o 259.0791 6.223453 821.6416       39.29161 793.7256       54.33010 852.2522       56.89182 253.9081 8.793950 263.0847 8.886731 -9.176575      12.50230 
1 1 1 10  17 12 o 177.0790 7.231989 385.2603       31.14197 0.000000       0.000000 385.2603       31.14197 ?        ?        177.0790 7.231989 0.000000       7.231989 
1 1 1 10  17 13 o 88.17005 6.567817 95.80270       14.01030 0.000000       0.000000 95.80270       14.01030 ?        ?        88.17005 6.567817 0.000000       6.567817 
1 1 1 10  17 14 o 138.7047 6.780097 236.5953       22.84785 0.000000       0.000000 236.5953       22.84785 ?        ?        138.7047 6.780097 0.000000       6.780097 
1 1 1 10  17 15 o 300.1532 6.999876 1106.579       51.19994 1140.205       73.70123 1075.215       71.17987 303.2697 9.986244 294.5184 9.931856 8.751343       14.08428 
1 1 1 10  17 16 o 42.65948 6.464928 22.83188       6.510355 25.75768       9.274592 19.98981       9.140929 44.92238 8.787086 39.41010 9.606607 5.512287       13.01921 
1 1 1 10  17 17 o 78.67464 5.053756 76.10134       9.637895 85.39178       13.93384 67.57917       13.34529 83.04306 6.949093 73.69529 7.537120 9.347771       10.25173 
1 1 1 10  17 18 o 38.53132 7.601470 18.93271       6.883890 19.70556       9.254909 17.97561       10.29919 39.06794 9.752155 37.48723 10.72960 1.580708       14.49927 
1 1 1 10  17 19 o 238.2137 6.065049 697.7697       35.17902 697.2375       49.49915 698.3129       50.00603 237.0449 8.583186 237.1864 8.666171 -0.1414337     12.19728 
1 1 1 10  17 20 o 245.5121 4.123300 737.5970       24.66914 652.9991       48.98595 766.3417       28.55425 229.1103 8.790170 250.0941 4.685232 -20.98387      9.960847 
1 1 1 10  17 21 f 95.25957 2.513534 110.8369       5.829749 117.7113       9.343879 106.4554       7.459736 98.00311 3.920383 93.27473 3.287023 4.728378       5.116046 
1 1 1 10  17 22 o 37.26907 2.837624 17.06351       2.557776 16.63891       4.666371 17.24586       3.058101 36.40239 5.425832 37.40372 3.391905 -1.001331      6.398802 
1 1 1 10  17 23 o 104.5084 2.907379 133.5716       7.397185 136.2145       10.33869 130.7996       10.58817 105.3592 4.034224 103.2065 4.218854 2.152740       5.837267 
1 1 1 10  17 24 o 86.78988 2.887952 92.17843       6.099439 89.19920       8.324048 95.63274       8.963188 85.20025 4.020541 88.19588 4.182320 -2.995628      5.801426 
1 1 1 10  17 25 o 32.00403 5.841102 13.04915       4.387690 13.12992       4.886340 12.71290       9.969822 31.97348 6.493204 32.18252 10.78955 -0.2090416     12.59270 
1 1 1 10  17 26 o 52.06283 3.256880 33.33958       4.111352 35.57972       5.545305 30.60505       6.126738 53.61264 4.279969 49.51507 5.152858 4.097569       6.698514 
1 1 1 10  17 27 o 27.61400 5.003144 9.716720       3.242801 12.10691       4.242002 6.355938       5.030077 30.70048 5.884177 22.94947 7.663350 7.751005       9.661804 
1 1 1 10  17 28 o 71.65802 3.023201 63.12215       5.267337 55.26248       6.734240 75.50861       8.453954 66.77178 4.159312 77.99396 4.466658 -11.22218      6.103352 
1 1 1 10  17 29 o 27.63013 5.299646 9.855783       3.438562 6.854505       4.382989 14.65974       5.545195 23.06976 7.101652 33.31356 7.050758 -10.24381      10.00733 
1 1 1 10  17 30 o 29.95065 7.722519 12.15370       5.672607 0.000000       0.000000 12.15370       5.672607 ?        ?        29.95065 7.722519 0.000000       7.722519 
1 1 1 10  17 31 o 79.61800 3.100437 78.50723       6.003981 78.01164       7.890689 79.18871       9.252899 78.88095 4.119212 79.06461 4.825394 -0.1836548     6.344473 
1 1 1 10  17 32 o 15.80170 6.112282 2.368906       3.347031 5.108586       4.155787 -2.689072      5.646665 20.09941 6.961483 15.02842 6.874884 5.070992       9.783980 
1 1 1 10  17 33 o 44.92064 3.868110 25.66857       4.193094 27.35591       5.532058 23.39030       6.428189 45.72898 5.048239 41.27065 6.615000 4.458332       8.321235 
1 1 1 10  17 34 o 29.10520 5.282417 11.49497       3.608674 13.08478       4.628008 9.029081       5.763779 30.39064 6.448977 24.50959 8.203575 5.881052       10.43494 
1 1 1 10  17 35 o 16.65748 6.200753 3.488122       3.365420 4.421485       3.948838 1.010818       6.433300 18.21531 6.728605 17.26580 7.663473 0.9495125      10.19818 
1 1 1 10  17 36 o 49.82431 3.788290 32.59930       4.565128 38.08314       6.118640 25.71354       6.856278 52.73912 4.813882 40.72058 7.171207 12.01854       8.637110 
1 1 1 10  17 37 o 22.00306 6.867061 7.909667       4.082191 7.143126       4.638304 10.54368       8.598059 20.68102 7.339862 22.72752 9.437925 -2.046495      11.95609 
1 1 1 10  17 38 o 19.91166 6.409184 6.529573       3.532120 4.144882       4.665569 9.731485       5.406215 16.91972 6.982318 22.56023 7.931606 -5.640509      10.56708 
1 1 1 10  17 39 o 13.26714 5.758413 1.530331       3.452764 5.235713       4.873356 -2.204360      4.892593 17.31369 7.139627 12.35402 5.885988 4.959664       9.253060 
1 1 1 10  17 40 o 12.95065 5.699544 1.555354       3.486487 0.9407191      4.776856 2.256041       5.100296 13.49252 6.227260 14.47932 6.589105 -0.9868002     9.066150 
1 1 1 10  17 41 o 14.26410 6.523187 2.676017       5.078433 0.000000       0.000000 2.676017       5.078433 ?        ?        14.26410 6.523187 0.000000       6.523187 
1 1 1 10  18 0  o 385.5315 5.238837 1814.533       49.21878 1838.895       78.13046 1798.505       63.37477 387.5525 8.272822 383.5751 6.780004 3.977448       10.69617 
1 1 1 10  18 1  o 60.63591 2.733789 44.91418       4.029142 38.99444       5.728866 50.70831       5.667762 56.37963 4.199924 64.37862 3.627389 -7.998997      5.549533 
1 1 1 10  18 2  o 170.8567 2.972366 355.9288       12.37572 356.8369       19.17125 355.2800       16.20431 170.9321 4.606667 170.6596 3.896400 0.2724457      6.033516 
1 1 1 10  18 3  o 189.0464 3.531233 435.8912       16.26788 463.0604       33.56578 427.5501       18.59814 194.4257 7.096368 187.1977 4.076927 7.227982       8.184117 
1 1 1 10  18 4  o 304.2838 4.308476 1129.921       31.94762 1102.368       49.27843 1149.898       41.96028 300.2098 6.735904 306.7936 5.612495 -6.583801      8.767696 
1 1 1 10  18 5  o 170.3456 2.947264 353.8407       12.23449 373.5109       19.29799 340.6215       15.82009 174.8645 4.532528 167.0850 3.885397 7.779495       5.969934 
1 1 1 10  18 6  o 83.63481 2.449168 85.34970       4.986246 80.88336       7.181017 89.50800       6.928968 81.34315 3.631829 85.59928 3.328056 -4.256134      4.926067 
1 1 1 10  18 7  o 140.5180 2.552343 240.7463       8.739915 226.6544       13.52879 250.8401       11.44991 136.2122 4.080344 143.4026 3.276489 -7.190445      5.233028 
1 1 1 10  18 8  o 184.9606 3.327948 417.3376       15.00002 485.9918       34.72392 401.5872       16.63188 199.0323 7.170994 181.4064 3.762292 17.62589       8.098024 
1 1 1 10  18 9  o 127.1992 2.743282 197.3115       8.503366 215.9650       20.24502 193.3158       9.369960 132.6855 6.279030 125.8916 3.054253 6.793922       6.982455 
1 1 1 10  18 10 o 279.1098 9.377710 960.4647       63.69287 0.000000       0.000000 960.4647       63.69287 ?        ?        279.1098 9.377710 0.000000       9.377710 
1 1 1 10  18 11 o 204.1104 7.723583 512.2886       38.34739 0.000000       0.000000 512.2886       38.34739 ?        ?        204.1104 7.723583 0.000000       7.723583 
1 1 1 10  18 12 o 138.7871 4.683680 235.6841       15.81793 242.9155       22.38633 228.4740       22.35357 140.6235 6.550644 136.3357 6.749216 4.287766       9.405470 
1 1 1 10  18 13 o 140.6234 6.808910 243.2119       23.26370 0.000000       0.000000 243.2119       23.26370 ?        ?        140.6234 6.808910 0.000000       6.808910 
1 1 1 10  18 14 o 45.24239 6.391792 25.59425       6.850929 28.78176       9.481275 22.11174       9.910313 47.63050 8.479428 41.44911 9.939940 6.181393       13.06534 
1 1 1 10  18 15 o 135.3668 4.746272 224.4386       15.63249 214.9076       21.60598 234.9092       22.64604 132.1072 6.733582 138.1299 6.748151 -6.022675      9.533031 
1 1 1 10  18 16 f 189.3195 5.359371 439.4934       24.70063 401.5716       33.38977 485.3311       36.70969 180.3756 7.613378 198.3271 7.609729 -17.95149      10.76436 
1 1 1 10  18 17 o 124.8187 4.809292 191.0336       14.60103 194.1032       20.58111 187.9232       20.71752 125.4370 6.757926 123.3818 6.918207 2.055275       9.671150 
1 1 1 10  18 18 o 129.1980 6.864625 206.1401       21.53512 206.1401       21.53512 0.000000       0.000000 129.1980 6.864625 ?        ?        0.000000       6.864625 
1 1 1 10  18 19 o 136.4966 4.148072 228.1925       13.78162 240.9668       23.33011 221.3456       17.08024 139.6464 6.876839 134.2258 5.231840 5.420624       8.640779 
1 1 1 10  18 20 o 146.1137 3.389094 260.9390       12.06731 241.4314       24.25766 267.3541       13.91070 139.6235 7.153264 147.7798 3.866079 -8.156311      8.131159 
1 1 1 10  18 21 o 140.9435 3.021990 242.7076       10.37944 223.4612       23.16740 247.5410       11.60981 134.2326 7.107780 142.2958 3.348088 -8.063171      7.856859 
1 1 1 10  18 22 o 112.8199 2.676477 155.4611       7.358433 148.6650       11.21052 160.6056       9.753700 110.0571 4.187595 114.5213 3.499105 -4.464195      5.457077 
1 1 1 10  18 23 o 82.96589 2.456424 84.13344       4.960900 79.33775       8.274306 86.82478       6.198540 80.31169 4.242875 84.21606 3.025273 -3.904366      5.210976 
1 1 1 10  18 24 f 200.9921 3.693218 495.0833       18.08923 510.6823       25.80820 480.0194       25.36171 203.4896 5.208786 197.2488 5.281034 6.240814       7.417599 
1 1 1 10  18 25 o 45.44109 3.615788 25.48187       3.970947 32.21626       5.607900 18.70956       5.623666 50.95620 4.564433 38.35040 6.231161 12.60581       7.724080 
1 1 1 10  18 26 o 55.85455 4.025627 38.57219       5.442581 37.98642       6.040814 41.09796       12.54383 55.32206 4.520228 55.91890 9.547740 -0.5968437     10.56370 
1 1 1 10  18 27 o 39.94242 3.906760 19.83515       3.754089 18.91546       5.020674 21.00137       5.653686 38.62164 5.488893 40.62214 5.882267 -2.000500      8.045434 
1 1 1 10  18 28 o 15.39953 5.955605 2.008418       3.177202 3.086558       4.188217 0.5468793      4.876369 18.09393 6.877872 16.53675 7.002103 1.557177       9.815018 
1 1 1 10  18 29 o 27.02200 5.236584 9.458279       3.323735 12.68612       4.274477 4.522096       5.285943 31.22004 5.832837 20.73599 7.760740 10.48405       9.708300 
1 1 1 10  18 30 o 52.32957 3.487386 34.08050       4.421787 32.50898       5.655725 36.55148       7.091904 50.70079 4.628589 53.38190 5.531792 -2.681110      7.212805 
1 1 1 10  18 31 o 16.73604 6.877668 1.761564       4.501881 -3.260772      8.220443 3.913119       5.380449 18.16322 8.303665 19.81348 7.725750 -1.650259      11.34187 
1 1 1 10  18 32 o 80.05186 3.155458 79.94930       6.143536 81.45634       8.112793 77.92326       9.406624 80.11208 4.169979 77.68098 4.995642 2.431099       6.507316 
1 1 1 10  18 33 o 16.80302 6.341121 3.196438       3.544824 4.001864       4.276033 1.426659       6.338517 18.41169 6.960856 18.09215 7.827516 0.3195362      10.47490 
1 1 1 10  18 34 o 18.09224 6.297516 4.399545       3.402873 1.403890       4.399382 8.861055       5.368917 15.60046 6.630084 24.07066 7.912987 -8.470196      10.32344 
1 1 1 10  18 35 o 15.68855 6.095665 2.875852       3.340135 0.4786187      4.292238 6.556249       5.318340 14.38927 6.328623 20.81787 7.785892 -6.428598      10.03352 
1 1 1 10  18 36 o 40.43415 4.316631 22.15169       4.187625 34.39315       5.852578 9.309919       5.994359 49.77501 4.888000 22.90571 8.317562 26.86930       9.647507 
1 1 1 10  18 37 o 26.30221 6.663420 11.21708       4.275216 11.97259       4.877716 8.713062       8.880057 26.43991 7.320573 21.06775 9.188279 5.372160       11.74799 
1 1 1 10  18 38 f 15.56386 6.085657 3.534848       3.346081 0.5475906      4.599527 6.893099       4.876783 13.80435 6.272288 19.34936 7.405545 -5.545015      9.704828 
1 1 1 10  18 39 o 13.32247 5.702353 1.896784       3.295591 1.799285       4.649155 1.995254       4.672271 14.23491 6.402002 14.38522 6.447863 -0.1503105     9.086285 
1 1 1 10  18 40 o 13.06571 5.797065 1.661108       3.677818 -2.821650      5.415195 5.499273       5.010756 12.08326 5.865421 16.57316 7.060749 -4.489898      9.179180 
1 1 1 10  18 41 o 12.84722 5.695049 1.870121       3.541692 2.948851       4.959656 0.7476339      5.059246 14.24276 6.487725 13.04881 6.148010 1.193956       8.938043 
1 1 1 10  19 0  o 111.1627 3.040162 150.7959       8.227807 165.8829       11.24668 133.4234       12.06849 116.5353 3.966105 104.4359 4.754534 12.09943       6.191573 
1 1 1 10  19 1  o 199.5672 3.572815 485.8128       17.37544 476.8463       24.18358 495.3804       24.98098 197.5455 5.027711 201.3428 5.095497 -3.797226      7.158350 
1 1 1 10  19 2  f 85.73759 2.593488 89.70359       5.412426 95.49903       8.198219 85.22601       7.206058 88.39094 3.815043 83.51122 3.549017 4.879715       5.210574 
1 1 1 10  19 3  o 90.05570 2.565169 98.95775       5.623681 95.90071       8.368204 101.4754       7.594188 88.56918 3.886622 91.14474 3.425209 -2.575562      5.180529 
1 1 1 10  19 4  o 190.2543 3.573678 441.5927       16.56861 405.6900       31.75023 455.0286       19.42297 181.8700 7.177998 193.0863 4.127888 -11.21631      8.280285 
1 1 1 10  19 5  o 264.8668 4.301004 856.4295       27.76089 817.5822       38.05123 900.6367       40.59143 258.5500 6.039319 271.3480 6.138632 -12.79797      8.611399 
1 1 1 10  19 6  o 167.4697 4.242264 342.6121       17.29897 342.9987       24.40433 342.2217       24.52499 167.3492 5.993897 167.1540 6.030710 0.1951904      8.502721 
1 1 1 10  19 7  o 95.83588 2.994420 112.1315       6.984636 0.000000       0.000000 112.1315       6.984636 ?        ?        95.83588 2.994420 0.000000       2.994420 
1 1 1 10  19 8  o 205.2620 4.091258 514.3895       20.46452 0.000000       0.000000 514.3895       20.46452 ?        ?        205.2620 4.091258 0.000000       4.091258 
1 1 1 10  19 9  o 38.80115 2.819350 18.45912       2.647626 16.13524       7.934067 18.75033       2.808622 35.53461 9.117908 39.09435 2.970338 -3.559731      9.589534 
1 1 1 10  19 10 o 93.05593 2.527392 105.6783       5.725988 108.5172       14.11217 105.1188       6.264862 93.92941 6.199998 92.79398 2.773597 1.135429       6.792114 
1 1 1 10  19 11 o 52.05940 5.505457 33.53198       6.878699 34.43970       9.328869 32.45042       10.18306 52.43269 7.515777 50.66691 8.551491 1.765781       11.38485 
1 1 1 10  19 12 o 54.90230 5.590018 37.28182       7.374734 46.30126       10.39044 28.12564       10.46890 60.99966 7.123861 46.90163 9.485931 14.09804       11.86306 
1 1 1 10  19 13 o 175.1491 5.098322 375.7210       21.73746 372.8549       30.29138 378.7639       31.21211 174.0447 7.157310 175.3803 7.319171 -1.335602      10.23706 
1 1 1 10  19 14 o 194.2259 7.697577 465.2687       36.36105 0.000000       0.000000 465.2687       36.36105 ?        ?        194.2259 7.697577 0.000000       7.697577 
1 1 1 10  19 15 o 240.5835 6.057670 710.7101       35.48640 743.7192       51.04996 679.8463       49.36322 245.1779 8.557450 234.3581 8.658339 10.81975       12.17361 
1 1 1 10  19 16 o 51.51704 5.919521 32.99382       7.296571 28.05060       9.721920 39.36988       11.04138 46.86420 8.836833 55.84548 8.370949 -8.981285      12.17220 
1 1 1 10  19 17 o 37.30957 9.048450 17.95322       8.141145 17.95322       8.141145 0.000000       0.000000 37.30957 9.048450 ?        ?        0.000000       9.048450 
1 1 1 10  19 18 o 98.85327 6.609200 120.8638       15.82974 120.8638       15.82974 0.000000       0.000000 98.85327 6.609200 ?        ?        0.000000       6.609200 
1 1 1 10  19 19 o 46.68010 6.573631 27.36434       7.270959 19.61223       9.643196 37.57831       11.06900 38.87582 10.09176 54.36517 8.644177 -15.48936      13.28779 
1 1 1 10  19 20 o 176.4063 3.342765 380.4178       14.36997 385.8150       31.90760 379.0446       16.09457 176.3641 7.440886 176.0125 3.752318 0.3515625      8.333467 
1 1 1 10  19 21 o 165.1647 3.278242 333.5575       13.19454 314.4080       28.82783 338.6323       14.84024 159.0244 7.459746 166.3441 3.660980 -7.319672      8.309668 
1 1 1 10  19 22 o 66.22747 2.835189 53.69701       4.565099 54.11080       12.80921 53.63681       4.885926 65.35988 8.223840 66.16697 3.038297 -0.8070908     8.767142 
1 1 1 10  19 23 o 51.66365 2.842860 32.72759       3.565326 39.56471       6.349336 29.57895       4.308770 56.54763 4.648642 49.00554 3.633904 7.542091       5.900435 
1 1 1 10  19 24 o 48.31083 2.829543 28.64461       3.316587 34.32569       6.047470 26.20091       3.966263 52.57920 4.771710 46.09623 3.558383 6.482964       5.952420 
1 1 1 10  19 25 o 145.9710 2.771108 260.7524       9.857257 277.6814       16.38286 251.1460       12.34106 150.0437 4.485632 143.0609 3.539939 6.982834       5.714198 
1 1 1 10  19 26 o 58.38452 4.106903 42.21314       5.805890 43.11953       6.623640 39.20722       12.06224 58.87800 4.654275 54.44633 9.432813 4.431667       10.51857 
1 1 1 10  19 27 o 39.24381 4.367191 19.28853       4.105806 20.13610       6.158813 18.61051       5.508442 39.44699 6.642652 38.04426 6.151430 1.402725       9.053447 
1 1 1 10  19 28 o 34.03579 4.487115 14.64419       3.631113 11.72840       4.727377 18.83978       5.670722 29.79300 6.676995 38.08233 6.332848 -8.289330      9.202566 
1 1 1 10  19 29 o 43.35020 3.848586 23.50972       4.023425 23.46219       5.252040 23.57724       6.259623 42.88276 5.127343 42.55452 6.219961 0.3282471      8.060866 
1 1 1 10  19 30 o 9.071844 4.395997 -4.777714      3.007617 -6.346323      3.781392 -2.076629      4.962078 9.974756 4.855462 14.45838 6.547736 -4.483621      8.151586 
1 1 1 10  19 31 o 72.07833 4.031672 65.60263       7.053290 88.97477       13.96970 57.60601       8.171301 81.08198 7.143076 66.86305 5.052362 14.21893       8.749280 
1 1 1 10  19 32 o 35.81332 5.203972 16.98464       4.408855 19.45098       5.381712 11.95138       7.688079 37.87856 6.032435 27.98636 9.475039 9.892191       11.23239 
1 1 1 10  19 33 o 27.83517 5.693040 10.72161       3.731304 11.16483       4.834729 10.06876       5.867750 27.55357 7.142160 25.62971 8.261781 1.923859       10.92097 
1 1 1 10  19 34 o 16.61848 6.103473 3.541245       3.241360 5.183406       4.232399 1.211863       5.040795 19.24115 6.988733 15.98182 6.947031 3.259324       9.854117 
1 1 1 10  19 35 o 27.61201 5.530196 10.98041       3.591284 14.75508       4.822504 6.280895       5.380949 31.19652 6.552326 20.18945 7.765720 11.00708       10.16068 
1 1 1 10  19 36 o 25.17088 5.971569 9.636158       3.607314 11.25213       4.896216 7.717564       5.335007 25.80891 7.401447 21.14978 7.819424 4.659136       10.76684 
1 1 1 10  19 37 o 11.71315 5.466631 -1.592829      3.841370 0.8273137E-01  4.382629 -7.147326      7.979524 13.48222 6.124623 13.90219 6.827219 -0.4199648     9.171800 
1 1 1 10  19 38 o 11.20928 5.139198 -0.5513350     3.178876 -3.025971      4.588300 1.732967       4.408319 11.65441 5.592268 14.26988 6.338169 -2.615464      8.452564 
1 1 1 10  19 39 o 21.81462 6.489882 8.718902       3.704388 13.87469       5.433843 4.242215       5.063348 25.33413 7.925208 15.90329 6.936997 9.430844       10.53237 
1 1 1 10  19 40 o 13.64742 5.890217 2.559134       3.572053 5.342150       5.104677 -0.1111640     5.000235 16.19059 7.014610 12.78064 6.048848 3.409948       9.262468 
1 1 1 10  20 0  o 251.6297 5.950567 774.1864       36.48854 746.9359       49.46737 806.7083       54.04052 246.6326 8.242192 256.2175 8.667630 -9.584854      11.96083 
1 1 1 10  20 1  o 37.77776 4.483676 17.66792       4.047279 24.61206       6.441217 13.13770       5.202571 44.44935 6.107902 32.15556 6.849279 12.29379       9.177096 
1 1 1 10  20 2  o 100.7150 3.234479 123.8543       7.928135 120.9573       12.85808 125.6313       10.07021 99.34737 5.330607 101.3726 4.084815 -2.025192      6.715734 
1 1 1 10  20 3  o 55.72149 4.433456 38.14915       5.970464 0.000000       0.000000 38.14915       5.970464 ?        ?        55.72149 4.433456 0.000000       4.433456 
1 1 1 10  20 4  o 145.5264 3.482453 258.3879       12.34990 276.7395       20.98193 248.6598       15.27646 150.3248 5.738214 142.6363 4.400239 7.688553       7.231127 
1 1 1 10  20 5  o 230.9700 4.019774 651.2109       22.62525 599.9881       43.37732 670.3548       26.51826 220.9377 8.070250 234.2677 4.645115 -13.32999      9.311607 
1 1 1 10  20 6  o 53.82717 2.758984 35.42750       3.606911 26.40162       4.861012 46.48485       5.380313 46.29313 4.360331 61.61419 3.599032 -15.32106      5.653805 
1 1 1 10  20 7  o 163.6142 2.804209 326.4948       11.18067 326.7990       17.74648 326.2945       14.39736 163.5073 4.458045 163.5109 3.613266 -0.3646851E-02 5.738455 
1 1 1 10  20 8  o 25.79771 4.284120 8.344812       2.598835 18.75313       7.418891 6.888961       2.774643 38.34525 8.188494 23.29378 5.035033 15.05147       9.612647 
1 1 1 10  20 9  o 111.0354 2.699839 150.3746       7.305254 163.9666       17.08248 147.3325       8.081513 115.5455 6.088313 109.8509 3.021799 5.694603       6.796972 
1 1 1 10  20 10 o 150.1328 3.019440 275.0129       11.04684 276.4629       24.31499 274.6358       12.40051 149.9845 6.669281 150.0028 3.392376 -0.1831055E-01 7.482481 
1 1 1 10  20 11 o 107.9601 2.625940 142.1711       6.908504 162.7056       17.26344 138.2555       7.538445 115.0436 6.180537 106.4100 2.909853 8.633522       6.831272 
1 1 1 10  20 12 o 151.9224 3.007344 281.6555       11.13374 285.5441       24.78318 280.6722       12.46210 152.3621 6.691208 151.6270 3.372707 0.7351074      7.493158 
1 1 1 10  20 13 o 113.4190 4.638437 157.6176       12.79312 177.3627       18.30141 138.7502       17.89000 120.0566 6.277314 106.0194 6.963050 14.03721       9.374899 
1 1 1 10  20 14 o 114.3158 4.688194 160.1803       13.03243 181.9622       18.80293 140.0420       18.07962 121.5582 6.369763 106.4717 7.007123 15.08649       9.469618 
1 1 1 10  20 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 10  20 16 o 217.5604 8.085497 586.0798       42.79239 586.0798       42.79239 0.000000       0.000000 217.5604 8.085497 ?        ?        0.000000       8.085497 
1 1 1 10  20 17 o 151.8457 4.953903 282.9232       18.30646 295.0270       25.88396 270.8095       25.89454 154.5617 6.889464 147.9767 7.202529 6.585007       9.967003 
1 1 1 10  20 18 o 52.02738 6.071637 33.74279       7.553391 36.03091       10.28441 31.06304       11.12982 53.32605 8.174378 49.08619 9.648644 4.239868       12.64582 
1 1 1 10  20 19 o 166.2737 5.160045 339.8025       20.88273 375.7128       30.36715 307.5851       28.76335 174.1556 7.170681 157.4178 7.519817 16.73785       10.39068 
1 1 1 10  20 20 o 43.63655 2.959795 23.37289       3.128747 31.96839       9.517162 22.33137       3.312884 50.10489 8.068499 42.61989 3.213429 7.484993       8.684860 
1 1 1 10  20 21 o 100.2245 2.762527 122.8217       6.740652 130.3573       16.48038 121.3078       7.386776 102.4181 6.638972 99.56650 3.048017 2.851624       7.305228 
1 1 1 10  20 22 o 54.12478 2.982545 35.92930       3.918656 69.33913       12.86891 32.51482       4.114028 74.34337 7.193108 51.44130 3.299248 22.90207       7.913649 
1 1 1 10  20 23 o 101.6713 2.864861 126.5366       7.090954 139.2393       17.91544 124.1770       7.721523 105.4713 7.010176 100.6691 3.151418 4.802269       7.685961 
1 1 1 10  20 24 o 64.71597 2.633191 51.30805       4.144022 49.50995       7.200658 52.19853       5.067294 63.19273 4.709810 65.19268 3.199409 -1.999947      5.693727 
1 1 1 10  20 25 o 82.99197 2.694251 84.40919       5.441697 98.02923       11.24930 80.24847       6.217565 88.76070 5.223877 80.82983 3.162653 7.930878       6.106658 
1 1 1 10  20 26 o 18.89323 5.471909 4.551092       2.663754 5.150322       4.841475 4.290946       3.189985 21.24819 7.502874 18.74949 6.095500 2.498703       9.666863 
1 1 1 10  20 27 o 44.72422 2.949223 24.68602       3.196361 29.07406       5.965303 22.91878       3.785683 47.95621 5.186934 42.93829 3.652594 5.017921       6.343952 
1 1 1 10  20 28 o 19.21824 6.217930 4.624991       3.321715 9.859687       4.768710 -0.3087662     4.629606 27.12816 7.123659 15.32939 6.660600 11.79877       9.752441 
1 1 1 10  20 29 o 54.35801 3.418723 36.78066       4.505661 43.57050       6.323715 29.77956       6.421340 58.76516 4.448921 48.02964 5.590692 10.73552       7.144839 
1 1 1 10  20 30 o 14.97320 5.968534 1.763787       3.275078 3.544444       4.387259 -0.4774474     4.922058 18.40383 7.028879 15.40676 6.776557 2.997070       9.763548 
1 1 1 10  20 31 o 45.34570 4.361591 26.39091       4.760291 30.49019       6.221426 20.60178       7.393382 48.14946 5.394935 37.63304 8.286527 10.51642       9.887965 
1 1 1 10  20 32 o 50.80950 4.720894 33.78343       5.778416 54.94040       11.56061 26.73726       6.671613 61.40910 7.908663 43.91420 6.424372 17.49490       10.18919 
1 1 1 10  20 33 o 32.47441 4.807032 14.17497       3.689375 17.36541       5.063920 10.56564       5.386098 35.03054 6.156632 26.06324 7.842480 8.967304       9.970387 
1 1 1 10  20 34 o 15.58039 6.082511 2.823090       3.338308 6.981579       4.532071 -2.109494      4.935898 21.23727 7.273258 13.47772 6.258553 7.759545       9.595299 
1 1 1 10  20 35 o 23.01096 6.165559 8.100989       3.526976 15.86548       5.096015 0.9621727      4.886381 31.91463 6.762902 15.08680 6.688524 16.82784       9.511740 
1 1 1 10  20 36 o 47.91295 4.472485 31.81618       5.161682 41.30269       6.648447 17.42184       8.189605 53.59929 5.153525 27.90569 9.765875 25.69360       11.04224 
1 1 1 10  20 37 o 8.521351 4.210638 -5.605223      3.196142 -1.343644      5.106192 -8.350447      4.098271 13.20585 6.207823 9.073993 4.530547 4.131857       7.685241 
1 1 1 10  20 38 o 11.48874 5.411114 -1.436165      3.913083 0.4909649      4.536527 -7.037803      7.734381 13.30079 6.113296 13.00867 6.449697 0.2921228      8.886561 
1 1 1 10  20 39 o 12.45039 5.541623 1.160410       3.387876 2.293453       4.718794 -0.4492466E-01 4.867002 14.20569 6.413847 12.91264 6.067067 1.293047       8.828745 
1 1 1 10  20 40 o 16.97011 6.385430 5.705575       3.588662 14.08557       5.229176 -1.754914      4.933952 24.75779 7.778791 11.86786 5.721283 12.88993       9.656224 
1 1 1 10  21 0  o 124.3470 3.062453 188.5933       9.279851 195.9589       18.31396 186.0488       10.76403 126.4312 5.960963 123.4301 3.582426 3.001091       6.954628 
1 1 1 10  21 1  o 205.5680 3.750001 515.7071       18.78551 551.3722       26.64405 480.4530       26.49007 212.4094 5.147429 198.1633 5.490890 14.24612       7.526347 
1 1 1 10  21 2  o 14.54019 5.569093 1.734275       2.759334 -0.6708196     3.760002 4.541306       4.062054 13.79759 5.998717 20.12894 6.886007 -6.331344      9.132453 
1 1 1 10  21 3  o 218.7607 3.428603 583.9153       18.27774 586.8555       28.54424 581.8720       23.79606 219.0926 5.346318 218.2709 4.473765 0.8216705      6.971204 
1 1 1 10  21 4  o 174.4296 3.029259 371.1368       12.87635 352.6290       19.30847 385.9597       17.27977 169.8300 4.669924 177.8056 3.988010 -7.975647      6.141044 
1 1 1 10  21 5  o 163.7690 3.232055 327.2234       12.89872 297.2638       17.13793 366.3699       19.59009 155.9290 4.514950 173.1042 4.648211 -17.17517      6.480019 
1 1 1 10  21 6  o 84.64983 3.932860 87.67625       8.090624 91.56455       12.77522 85.07240       10.45433 86.26026 6.117137 83.25085 5.178779 3.009407       8.014931 
1 1 1 10  21 7  o 45.19320 2.631298 24.99421       2.885338 30.94122       4.554189 21.00645       3.729292 50.20390 3.749606 41.31247 3.744967 8.891434       5.299465 
1 1 1 10  21 8  o 206.1193 3.209741 518.4500       16.12221 482.4328       24.54793 545.7697       21.37954 198.5390 5.077962 211.3719 4.150640 -12.83287      6.558469 
1 1 1 10  21 9  o 123.0094 2.812944 184.5950       8.432095 226.6210       20.10884 175.6291       9.288113 135.8512 6.089656 119.9222 3.181086 15.92901       6.870460 
1 1 1 10  21 10 o 47.70642 2.790868 27.86086       3.230363 44.04351       9.644939 25.81617       3.428374 59.52371 6.769382 45.89124 3.083545 13.63247       7.438601 
1 1 1 10  21 11 o 149.8534 3.011766 274.0540       10.99826 320.4683       25.92237 263.8647       12.14563 161.4234 6.603742 147.0098 3.390295 14.41360       7.423174 
1 1 1 10  21 12 o 183.2747 3.354520 410.1339       14.98197 404.8902       31.94396 411.6125       16.96340 181.2613 7.246425 183.5511 3.792450 -2.289810      8.178836 
1 1 1 10  21 13 o 153.5785 6.754148 290.5553       25.21585 290.5553       25.21585 0.000000       0.000000 153.5785 6.754148 ?        ?        0.000000       6.754148 
1 1 1 10  21 14 o 19.58377 8.416253 -0.4343974     7.233000 -0.4343974     7.233000 0.000000       0.000000 19.58377 8.416253 ?        ?        0.000000       8.416253 
1 1 1 10  21 15 o 138.4133 4.813754 234.9548       16.21199 214.4214       21.60412 261.4211       24.52756 131.8019 6.748809 145.5139 6.936909 -13.71207      9.678179 
1 1 1 10  21 16 o 22.47450 9.351908 1.586025       8.466633 0.000000       0.000000 1.586025       8.466633 ?        ?        22.47450 9.351908 0.000000       9.351908 
1 1 1 10  21 17 o 118.8166 4.811296 173.3572       13.90197 156.6278       18.60862 194.4871       20.91327 112.4809 6.820953 125.3689 6.871633 -12.88795      9.682187 
1 1 1 10  21 18 o 125.0200 4.858337 192.0400       14.77324 182.1049       20.16628 203.5473       21.70333 121.2372 6.853714 128.1597 6.975563 -6.922462      9.779156 
1 1 1 10  21 19 o 81.33887 2.657496 80.88234       5.260458 89.61048       13.63337 79.35557       5.702017 84.90623 6.641945 80.53983 2.910022 4.366409       7.251460 
1 1 1 10  21 20 o 63.01198 2.798730 48.60868       4.286820 31.72898       11.11361 51.55912       4.646391 49.45691 9.567287 64.88355 2.946319 -15.42665      10.01068 
1 1 1 10  21 21 o 77.65572 2.721496 73.78297       5.142158 72.86827       12.83456 73.95788       5.612291 76.29912 6.980044 77.71730 2.968833 -1.418182      7.585182 
1 1 1 10  21 22 o 79.70732 2.771755 77.77896       5.375610 57.06258       12.27945 82.69041       5.978974 67.13679 7.641381 82.15682 2.991387 -15.02003      8.206040 
1 1 1 10  21 23 o 77.78808 2.866294 74.15165       5.424087 71.02152       13.63922 74.73968       5.911664 74.85628 7.581384 78.05623 3.114144 -3.199951      8.196053 
1 1 1 10  21 24 o 13.20350 5.323263 0.9986352      2.636201 0.000000       0.000000 0.9986352      2.636201 ?        ?        13.20350 5.323263 0.000000       5.323263 
1 1 1 10  21 25 o 37.56469 3.307752 17.46848       2.997056 20.42766       5.789630 16.38522       3.502924 39.94916 6.143622 36.22983 4.036052 3.719330       7.350769 
1 1 1 10  21 26 o 70.85970 2.987478 61.80513       5.147125 60.03137       7.628604 63.28740       6.973673 69.37637 4.537190 71.41447 4.023457 -2.038094      6.064182 
1 1 1 10  21 27 o 37.22784 3.408199 17.25039       3.057656 14.03680       5.578157 18.63071       3.655815 32.39657 7.247331 38.56698 3.945383 -6.170410      8.251657 
1 1 1 10  21 28 o 41.56496 3.191510 21.47891       3.207926 25.58949       5.954999 19.79837       3.807622 44.52673 5.612570 39.67052 3.992931 4.856205       6.887992 
1 1 1 10  21 29 o 7.919832 3.818814 -3.284949      2.200963 -3.912297      4.536986 -3.091873      2.516968 12.59587 5.898907 8.866350 4.223582 3.729521       7.255049 
1 1 1 10  21 30 o 64.61100 3.655010 52.52743       5.731342 54.64037       7.356198 49.26361       9.142677 65.26866 4.655577 60.75112 6.265419 4.517540       7.805759 
1 1 1 10  21 31 o 26.99928 5.694483 9.972251       3.628544 13.04026       5.139745 6.923767       5.123366 30.15746 7.110373 22.30163 7.729250 7.855822       10.50232 
1 1 1 10  21 32 o 47.77538 4.765608 30.21548       5.474344 47.58239       11.73974 25.38985       6.188343 54.97016 9.080641 42.70120 6.121884 12.26896       10.95151 
1 1 1 10  21 33 o 22.91505 5.963974 7.637506       3.362074 11.53684       4.823418 3.952757       4.688819 27.38528 7.151426 17.99644 7.152003 9.388840       10.11405 
1 1 1 10  21 34 o 25.45307 6.273526 9.818622       3.865917 6.665450       4.965799 14.66996       6.159507 20.50718 7.550656 29.12184 8.285446 -8.614664      11.20986 
1 1 1 10  21 35 o 18.34337 6.405313 5.183464       3.521909 11.35154       5.181971 -0.1115697     4.801252 25.50891 7.696140 14.09504 6.405933 11.41388       10.01332 
1 1 1 10  21 36 o 17.39368 6.451772 4.795745       3.637316 9.378522       5.927333 2.027636       4.606664 21.73495 8.200288 15.04825 6.589209 6.686700       10.51962 
1 1 1 10  21 37 o 11.33851 5.212697 -0.6059719     3.301211 1.005238       4.698729 -2.176533      4.639079 13.97378 6.345452 12.10734 5.757978 1.866438       8.568493 
1 1 1 10  21 38 o 11.21649 5.341533 -1.945804      4.019742 -1.011911      4.608210 -4.917897      8.220818 12.34032 5.830396 13.61006 6.730198 -1.269742      8.904443 
1 1 1 10  21 39 o 11.03335 5.133611 -0.5045198     3.346514 -0.7094508     4.800472 -0.3107688     4.667691 12.36896 5.875194 12.46182 5.881781 -0.9286118E-01 8.313438 
1 1 1 10  22 0  o 239.8109 3.656708 701.8674       21.36954 678.9590       32.70245 718.9388       28.23051 235.5901 5.696225 242.5699 4.775796 -6.979782      7.433384 
1 1 1 10  22 1  o 112.4733 2.668743 154.2739       7.314630 149.9611       10.91735 157.7870       9.853204 110.7520 4.051932 113.6516 3.562068 -2.899612      5.395042 
1 1 1 10  22 2  o 61.80833 3.365825 46.75336       5.050481 49.39508       6.283414 41.93128       8.489245 63.47204 4.084022 58.21391 6.073431 5.258129       7.318866 
1 1 1 10  22 3  o 125.0400 2.712854 190.6906       8.266305 180.0808       12.25199 199.5557       11.19943 121.3619 4.148845 127.8156 3.599223 -6.453735      5.492478 
1 1 1 10  22 4  o 205.5498 3.324287 515.5875       16.65143 508.1118       25.51029 521.1371       21.97956 203.7741 5.141350 206.5389 4.366978 -2.764801      6.745664 
1 1 1 10  22 5  o 130.5212 2.717588 207.7923       8.643725 210.3157       13.09521 205.8441       11.50647 131.1588 4.102166 129.8024 3.641266 1.356369       5.485124 
1 1 1 10  22 6  o 178.9178 3.071122 390.5937       13.39019 350.7442       19.44167 426.5553       18.46892 169.3186 4.716460 186.8750 4.055592 -17.55643      6.220355 
1 1 1 10  22 7  o 163.1701 2.943037 324.8432       11.70233 319.2957       17.64497 329.1992       15.63577 161.5649 4.485991 164.1759 3.908175 -2.610962      5.949617 
1 1 1 10  22 8  o 80.07887 2.813484 78.33172       5.481802 73.67422       12.32946 79.47925       6.119965 77.20682 6.616928 80.64085 3.120168 -3.434029      7.315681 
1 1 1 10  22 9  o 101.6013 2.779529 126.0404       6.875403 109.2440       14.87189 130.6062       7.753755 94.12016 6.524450 103.4022 3.080568 -9.282021      7.215147 
1 1 1 10  22 10 o 213.5705 4.196183 557.5479       21.83895 529.4731       39.33718 570.0564       26.25712 207.1672 7.805912 215.8092 4.992762 -8.642075      9.266064 
1 1 1 10  22 11 o 124.8907 4.048725 190.8508       12.30581 201.4191       19.84920 184.2527       15.68359 127.9121 6.388101 122.5316 5.264723 5.380470       8.277991 
1 1 1 10  22 12 o 49.14190 3.242615 29.61548       3.861443 28.45495       9.502934 29.84500       4.226063 47.27312 8.564367 49.30232 3.541072 -2.029205      9.267555 
1 1 1 10  22 13 o 24.42457 3.794396 7.462990       2.185156 15.66755       7.885862 6.780623       2.274210 34.90755 9.157876 23.19583 4.176914 11.71173       10.06545 
1 1 1 10  22 14 o 216.8779 3.749105 574.9852       19.81432 538.6428       40.47577 586.4393       22.72327 208.5689 7.978314 218.9236 4.259338 -10.35475      9.044084 
1 1 1 10  22 15 o 110.1549 2.727057 148.1217       7.320392 165.9711       17.96703 144.5688       8.015896 115.9537 6.383137 108.7607 3.027379 7.193069       7.064663 
1 1 1 10  22 16 o 64.61905 2.626872 51.05637       4.127902 66.90688       12.12058 48.97669       4.390360 73.32884 6.862576 63.26664 2.855024 10.06220       7.432772 
1 1 1 10  22 17 o 146.7675 3.067150 263.1913       10.96986 279.5446       26.47936 259.8032       12.05281 150.1369 7.258932 145.7746 3.392895 4.362366       8.012729 
1 1 1 10  22 18 o 86.42673 2.681401 91.31376       5.640534 104.8599       14.72448 88.98409       6.106334 91.88501 6.620344 85.28716 2.942468 6.597855       7.244796 
1 1 1 10  22 19 o 118.1658 2.869026 170.6337       8.261571 162.6835       18.97758 172.4927       9.176776 114.4044 6.838305 118.7268 3.174644 -4.322433      7.539283 
1 1 1 10  22 20 o 27.20635 4.080591 9.275646       2.622048 14.84298       8.564810 8.699898       2.754293 33.86169 9.813250 26.26154 4.463391 7.600153       10.78062 
1 1 1 10  22 21 o 42.24089 3.197512 21.96611       3.266960 17.71008       8.946243 22.62100       3.509320 36.67604 9.816244 42.84282 3.388896 -6.166775      10.38476 
1 1 1 10  22 22 o 42.51114 3.517958 22.31259       3.611829 0.000000       0.000000 22.31259       3.611829 ?        ?        42.51114 3.517958 0.000000       3.517958 
1 1 1 10  22 23 o 61.61076 2.983444 46.61570       4.465989 37.17043       11.16379 48.41525       4.872892 53.31111 8.907290 62.75547 3.196925 -9.444366      9.463622 
1 1 1 10  22 24 o 50.91348 3.153723 31.93932       3.893635 39.55066       10.47478 30.71903       4.194160 55.16499 8.027245 49.86821 3.473024 5.296780       8.746345 
1 1 1 10  22 25 o 91.39405 2.853314 102.6382       6.347040 106.0489       14.51422 101.8318       7.057625 91.28329 6.568707 90.93861 3.189681 0.3446884      7.302190 
1 1 1 10  22 26 o 35.21454 3.971653 15.55921       3.348848 21.06855       5.309929 11.92057       4.315271 40.56717 5.513876 30.17243 6.079307 10.39474       8.207363 
1 1 1 10  22 27 o 45.45021 3.050538 25.60266       3.359124 23.47866       5.748165 26.70419       4.139509 42.63843 5.672740 46.23964 3.704624 -3.601208      6.775265 
1 1 1 10  22 28 o 41.58746 3.422039 21.62731       3.437379 25.13686       5.903115 19.82683       4.228150 43.95077 5.641555 39.44732 4.477538 4.503448       7.202464 
1 1 1 10  22 29 o 10.19667 4.606684 -1.106275      2.438771 5.757024       4.964915 -3.288848      2.799817 21.28558 7.589771 9.394747 4.469430 11.89083       8.807976 
1 1 1 10  22 30 o 20.66661 6.305134 5.855409       3.464753 5.023232       5.176722 6.530679       4.663214 20.29636 7.662174 21.81190 7.379325 -1.515539      10.63783 
1 1 1 10  22 31 o 40.70172 3.292782 21.01316       3.238105 19.75918       5.867376 21.56236       3.882986 37.30318 6.700759 40.88964 3.945830 -3.586460      7.776230 
1 1 1 10  22 32 o 28.59708 6.471944 11.97331       4.404602 9.598529       9.608797 12.60505       4.955953 24.29292 10.02222 28.87730 7.094539 -4.584381      12.27914 
1 1 1 10  22 33 o 12.06724 5.327048 -0.3656433E-01 3.067636 -1.956900      4.604838 1.495646       4.113248 13.04457 6.053156 14.90556 6.375052 -1.860988      8.791018 
1 1 1 10  22 34 o 13.58466 5.646739 1.586179       3.082088 4.777227       4.534872 -1.153130      4.201640 18.13625 7.086680 12.78676 5.879340 5.349491       9.208022 
1 1 1 10  22 35 o 15.61486 6.235052 3.206887       3.580241 7.551697       5.852419 0.6084095      4.525947 20.39221 8.025967 14.10236 6.331607 6.289854       10.22279 
1 1 1 10  22 36 o 13.48680 5.748037 1.735354       3.323008 2.665510       4.967805 0.9821566      4.470345 15.49645 6.812271 13.92835 6.269747 1.568105       9.258335 
1 1 1 10  22 37 o 9.501704 4.579410 -2.990900      3.156102 5.000234       4.788515 -9.128628      4.196627 16.76078 7.008158 8.832623 4.435083 7.928154       8.293627 
1 1 1 10  22 38 o 16.11668 6.352543 4.693859       3.671139 8.006215       5.165815 1.314073       5.218130 18.83325 7.499653 13.88362 6.442898 4.949636       9.887150 
1 1 1 10  23 0  o 78.57899 2.718375 75.40221       5.197536 79.16371       7.753641 72.33270       7.004210 80.41911 3.968752 76.88231 3.749804 3.536804       5.460038 
1 1 1 10  23 1  o 107.8937 2.680686 141.9846       7.048198 140.6762       10.44258 143.0794       9.552145 107.2541 4.002399 108.2026 3.627786 -0.9484711     5.401855 
1 1 1 10  23 2  o 118.4968 3.031734 171.4281       8.747363 146.4461       15.11628 184.0052       10.72558 109.2278 5.698761 122.7216 3.590301 -13.49384      6.735440 
1 1 1 10  23 3  f 139.0349 3.199632 235.8942       10.84077 232.1713       14.27414 240.9682       16.66416 137.7874 4.256236 140.2962 4.881617 -2.508835      6.476552 
1 1 1 10  23 4  o 226.5457 4.003540 626.8829       22.10223 605.7445       29.73327 652.9884       33.04253 222.4538 5.484876 230.8132 5.879361 -8.359421      8.040569 
1 1 1 10  23 5  o 219.2652 3.468969 586.9178       18.53559 599.4620       28.95772 578.2109       24.12549 221.3007 5.369643 217.4826 4.552139 3.818100       7.039534 
1 1 1 10  23 6  o 51.71127 2.973541 32.73735       3.731299 40.73379       5.483525 25.84226       5.091918 57.61249 3.929292 45.74029 4.631994 11.87220       6.074101 
1 1 1 10  23 7  o 194.7066 3.163863 462.7232       15.01186 493.6292       24.16344 443.2963       19.15751 200.8542 4.936758 190.4596 4.127624 10.39459       6.434971 
1 1 1 10  23 8  o 162.1545 3.597101 321.1321       14.21405 332.3603       17.86366 301.7549       23.46729 164.8028 4.452130 156.7138 6.156952 8.089081       7.597994 
1 1 1 10  23 9  o 271.7027 4.438323 902.8665       29.38657 915.7932       60.52133 898.8786       33.61520 271.8456 9.148911 270.9418 5.091240 0.9037781      10.47011 
1 1 1 10  23 10 o 119.2566 4.642051 174.2988       13.46475 168.7705       18.30081 180.8231       19.88128 117.0322 6.441801 121.0827 6.764819 -4.050591      9.341284 
1 1 1 10  23 11 o 304.1935 4.824385 1133.053       35.76250 1067.898       70.73612 1155.426       41.45022 292.8377 9.926735 306.9407 5.541615 -14.10294      11.36880 
1 1 1 10  23 12 o 127.3500 2.895154 197.9804       8.984762 168.3149       18.94362 206.5905       10.20568 116.7614 6.685697 130.0607 3.220029 -13.29929      7.420723 
1 1 1 10  23 13 o 82.49496 2.646120 83.14357       5.312646 85.85162       13.37234 82.63603       5.789122 83.24723 6.646930 82.22087 2.893824 1.026360       7.249545 
1 1 1 10  23 14 o 177.6721 3.329868 385.7262       14.41725 447.3038       33.60453 371.8351       15.96079 190.1845 7.264165 174.3762 3.756048 15.80830       8.177774 
1 1 1 10  23 15 o 201.5674 3.594344 496.8151       17.65534 495.0613       37.66286 497.3091       19.98751 199.7756 7.751033 201.5666 4.069153 -1.791016      8.754229 
1 1 1 10  23 16 f 99.85309 2.711792 121.8451       6.592524 135.1974       16.61341 119.3496       7.182206 104.4645 6.559209 98.79343 2.986708 5.671112       7.207194 
1 1 1 10  23 17 f 10.29350 4.434806 -0.1983596     2.017946 8.481720       7.759188 -0.8280473     2.089859 27.31073 9.509237 9.761603 4.348170 17.54912       10.45620 
1 1 1 10  23 18 o 220.9444 3.849442 597.9678       20.72606 596.6293       44.37783 598.3412       23.43946 218.4155 8.353100 220.8497 4.355267 -2.434158      9.420330 
1 1 1 10  23 19 o 83.94357 2.728180 86.20734       5.573390 84.58730       13.73777 86.52652       6.097755 82.25218 6.917870 84.06599 2.981272 -1.813812      7.532921 
1 1 1 10  23 20 o 17.47559 5.495530 3.732515       2.609373 0.000000       0.000000 3.732515       2.609373 ?        ?        17.47559 5.495530 0.000000       5.495530 
1 1 1 10  23 21 o 139.8315 3.420829 239.7258       11.65661 0.000000       0.000000 239.7258       11.65661 ?        ?        139.8315 3.420829 0.000000       3.420829 
1 1 1 10  23 22 o 76.54947 2.824270 71.85143       5.259438 80.74345       13.29927 70.20295       5.726243 79.95423 6.892983 75.61346 3.114333 4.340775       7.563880 
1 1 1 10  23 23 o 58.53306 2.970713 42.12609       4.223530 45.07065       10.42621 41.54804       4.619526 59.22791 7.383680 58.07201 3.277637 1.155895       8.078467 
1 1 1 10  23 24 o 67.50049 2.912658 56.04675       4.779795 59.14916       11.51945 55.40152       5.253376 67.82941 7.072906 67.03843 3.225183 0.7909851      7.773532 
1 1 1 10  23 25 o 41.00466 3.547780 20.91721       3.510238 26.48458       8.601954 19.80487       3.844945 44.42286 8.249736 39.77380 4.022168 4.649059       9.178016 
1 1 1 10  23 26 o 31.85184 6.052082 13.33760       4.525897 22.22989       8.602024 9.933685       5.322106 39.91924 9.051883 27.08321 7.700417 12.83602       11.88415 
1 1 1 10  23 27 o 73.15862 2.784429 66.13445       4.955006 69.87072       7.769655 63.57317       6.432958 74.49258 4.298339 71.34029 3.713104 3.152298       5.680040 
1 1 1 10  23 28 o 50.53605 2.911462 31.75073       3.570312 32.68120       6.149722 31.27765       4.384980 50.27252 5.089880 49.88234 3.632209 0.3901787      6.252985 
1 1 1 10  23 29 o 26.93849 4.211617 9.420885       2.674293 5.502560       4.511302 11.54386       3.320655 20.53421 7.243249 29.64656 4.757208 -9.112349      8.665777 
1 1 1 10  23 30 o 14.14090 5.830408 1.335143       3.249299 -5.205619      4.605517 7.817635       4.584957 11.77200 5.636469 23.22387 7.282053 -11.45187      9.208588 
1 1 1 10  23 31 o 27.95093 4.018391 10.26806       2.658487 6.357328       4.632474 12.18849       3.246258 20.92623 7.343298 30.20112 4.552176 -9.274889      8.639811 
1 1 1 10  23 32 o 24.50650 5.165257 8.451863       2.987265 8.396539       9.734267 8.457615       3.138715 22.83159 9.786976 24.35116 5.427944 -1.519573      11.19140 
1 1 1 10  23 33 o 9.303015 4.349882 -1.789288      2.450786 -12.05172      8.999232 -0.9672034     2.547056 14.14025 7.001235 10.18227 4.642430 3.957984       8.400562 
1 1 1 10  23 34 o 19.23789 6.455254 5.877063       3.568608 5.777701       5.765854 5.938758       4.543375 19.04503 7.800237 19.12110 7.186919 -0.7607269E-01 10.60639 
1 1 1 10  23 35 o 10.67754 4.968526 -1.398145      3.135906 -5.708029      4.602675 2.335808       4.284123 10.74073 5.256080 14.97181 6.456163 -4.231073      8.325168 
1 1 1 10  23 36 o 13.40732 5.706687 1.898635       3.267871 3.379299       4.879622 0.6945305      4.400379 15.66761 6.822454 13.43212 6.115569 2.235491       9.162209 
1 1 1 10  23 37 o 12.54155 5.557312 1.150215       3.369109 -1.501738      4.983404 3.382738       4.572367 12.43604 5.929336 15.12913 6.595823 -2.693093      8.869155 
1 1 1 10  23 38 o 12.22499 5.609999 0.5167331      3.799726 0.4028843      5.016061 0.6700248      5.820467 13.10525 6.158103 13.70782 6.498979 -0.6025648     8.953154 
1 1 1 10  24 0  o 137.0961 3.217740 229.3799       10.75009 225.8313       14.39555 233.8536       16.16340 135.8716 4.353354 138.2071 4.806489 -2.335464      6.484907 
1 1 1 10  24 1  o 30.61312 4.943535 11.75162       3.562304 13.32879       4.552779 9.261601       5.720568 32.47832 5.972386 27.23081 8.055797 5.247511       10.02822 
1 1 1 10  24 2  o 106.2951 2.990259 137.9769       7.737954 151.9552       10.85127 123.5152       11.03735 111.4581 4.001642 100.4153 4.522147 11.04280       6.038456 
1 1 1 10  24 3  o 162.6810 3.295089 323.0463       13.06291 311.8932       17.81313 336.0222       19.21378 159.6484 4.583417 165.6854 4.763689 -6.037064      6.610631 
1 1 1 10  24 4  o 207.2918 3.731278 524.8157       18.84846 521.3954       26.11118 528.5372       27.23588 206.3196 5.197514 207.6887 5.385909 -1.369064      7.484796 
1 1 1 10  24 5  o 127.7862 3.568290 199.5678       11.10082 200.1138       12.86050 197.9720       21.98572 127.8952 4.131783 126.6977 7.149928 1.197517       8.257912 
1 1 1 10  24 6  o 286.6797 3.796901 1004.044       26.52543 942.3838       43.68125 1040.064       33.38585 277.0393 6.470198 291.5714 4.698740 -14.53210      7.996350 
1 1 1 10  24 7  o 91.93635 2.393100 103.1690       5.356915 103.0747       8.473574 103.2318       6.913818 91.77128 3.797195 91.91006 3.091273 -0.1387787     4.896392 
1 1 1 10  24 8  o 128.3112 2.617747 200.8783       8.185184 206.6721       12.75158 196.8182       10.67459 129.9642 4.031157 126.8965 3.455171 3.067635       5.309278 
1 1 1 10  24 9  o 116.8355 4.650219 167.3413       13.21344 167.3393       18.02165 167.3435       19.43110 116.5256 6.370775 116.4179 6.879902 0.1077271      9.376557 
1 1 1 10  24 10 o 38.73832 3.706770 18.50622       3.456598 52.54995       10.34511 14.22787       3.667371 65.03278 6.619983 33.79179 4.570642 31.24099       8.044559 
1 1 1 10  24 11 o 35.84883 3.648965 15.86801       3.143340 22.57520       8.685251 14.85706       3.371921 41.91641 8.784307 34.61648 4.075213 7.299931       9.683564 
1 1 1 10  24 12 f 132.9014 2.966438 215.6810       9.607290 206.1113       20.81889 218.2704       10.82931 129.1932 6.634968 133.6595 3.324796 -4.466263      7.421393 
1 1 1 10  24 13 o 84.14244 2.692061 86.51854       5.512859 107.1800       14.53052 83.04438       5.958345 93.06378 6.446990 82.40727 2.971911 10.65651       7.099010 
1 1 1 10  24 14 o 146.1742 3.048163 261.0355       10.85788 245.1147       23.49146 265.3607       12.24426 140.7272 6.870851 147.3311 3.410374 -6.603912      7.670674 
1 1 1 10  24 15 o 18.36620 4.809190 4.290788       2.177412 2.678806       7.550290 4.437014       2.274027 22.12524 8.976855 18.67873 4.926139 3.446512       10.23967 
1 1 1 10  24 16 o 103.2812 2.754735 130.3959       6.927067 141.5032       16.88300 128.1475       7.595873 106.8140 6.517143 102.3487 3.048902 4.465263       7.195065 
1 1 1 10  24 17 o 129.9666 2.935023 206.4633       9.295638 218.2734       21.77721 203.8321       10.27913 132.5695 6.763325 129.0455 3.271355 3.524002       7.512945 
1 1 1 10  24 18 o 53.62585 3.122623 35.29960       4.063002 0.000000       0.000000 35.29960       4.063002 ?        ?        53.62585 3.122623 0.000000       3.122623 
1 1 1 10  24 19 o 134.9333 3.335971 223.0071       10.96926 0.000000       0.000000 223.0071       10.96926 ?        ?        134.9333 3.335971 0.000000       3.335971 
1 1 1 10  24 20 o 105.3034 2.835503 135.7967       7.269642 122.9598       16.46180 138.9066       8.102509 98.97983 6.867458 106.4453 3.127000 -7.465508      7.545866 
1 1 1 10  24 21 f 80.29742 2.804258 79.04806       5.478840 84.20163       13.35219 78.00465       6.007922 81.69625 6.767449 79.71078 3.098840 1.985466       7.443197 
1 1 1 10  24 22 f 69.77467 2.951471 59.81376       5.007146 50.06710       11.73986 61.98100       5.535916 62.22203 7.921904 70.97686 3.208938 -8.754829      8.547153 
1 1 1 10  24 23 o 64.21487 3.678086 51.02206       5.731565 44.59329       10.99400 53.42148       6.716532 58.41061 7.928230 65.55401 4.226986 -7.143402      8.984668 
1 1 1 10  24 24 o 22.82939 5.327390 6.796019       2.909407 11.85212       7.295488 5.839839       3.172606 29.65751 9.167970 21.17447 5.919476 8.483046       10.91292 
1 1 1 10  24 25 o 33.20911 4.319192 13.98110       3.412656 15.88505       8.007201 13.55849       3.772434 33.60755 9.407271 32.51365 4.914448 1.093903       10.61360 
1 1 1 10  24 26 f 22.60523 6.198013 6.828135       3.515763 -0.2892706     7.214010 9.045179       4.026272 18.70314 8.215966 25.91763 6.410774 -7.214489      10.42114 
1 1 1 10  24 27 o 43.01807 3.640434 23.28799       3.780483 31.39314       9.569469 21.78908       4.115230 46.92064 8.689200 41.41168 4.133028 5.508957       9.622065 
1 1 1 10  24 28 o 27.43703 4.275451 9.770025       2.765483 10.15484       4.758204 9.573725       3.398407 26.77172 7.156009 26.70067 5.408570 0.7105064E-01  8.970011 
1 1 1 10  24 29 o 21.85346 4.970690 6.460532       2.587172 7.976512       4.454220 5.688687       3.178264 23.52685 7.143194 20.27515 6.006261 3.251703       9.332760 
1 1 1 10  24 30 o 15.05298 5.782386 2.474852       2.980656 -0.2831154     4.372742 4.868490       4.073696 14.18090 6.304788 18.99805 6.862581 -4.817153      9.319086 
1 1 1 10  24 31 o 32.37605 3.567947 13.62838       2.768378 16.45805       5.047449 12.41093       3.310784 33.48835 6.418568 30.24919 4.639187 3.239157       7.919600 
1 1 1 10  24 32 o 12.78573 5.294567 1.254755       2.695282 0.000000       0.000000 1.254755       2.695282 ?        ?        12.78573 5.294567 0.000000       5.294567 
1 1 1 10  24 33 o 28.09321 4.834272 11.15801       3.190201 19.77332       10.46152 10.27472       3.349751 28.04987 10.81785 26.51510 5.368580 1.534773       12.07674 
1 1 1 10  24 34 o 12.98344 5.046935 2.022982       2.290511 2.255974       4.597907 1.946075       2.641628 15.26743 6.635681 13.23202 5.330864 2.035414       8.511778 
1 1 1 10  24 35 o 11.31816 4.832274 0.8609160      2.355875 5.694019       4.902055 -0.5906225     2.686454 17.87494 7.240205 10.41525 4.755973 7.459692       8.662555 
1 1 1 10  24 36 o 11.97357 5.382145 0.4808215      3.281034 4.032465       4.954775 -2.292858      4.378622 15.90970 6.901798 11.54059 5.517615 4.369114       8.836226 
1 1 1 10  24 37 o 14.03112 6.016917 2.731752       3.681864 2.166851       5.005132 3.397930       5.435311 14.23356 6.496544 15.15047 6.857833 -0.9169102     9.446425 
1 1 1 10  25 0  o 271.3278 4.031950 899.5383       26.65910 923.1418       42.32413 884.0146       34.32386 274.2988 6.331812 268.7154 5.241643 5.583374       8.219894 
1 1 1 10  25 1  o 23.16649 5.769301 6.836188       3.244586 8.869111       4.444296 4.516124       4.747802 26.38338 6.852170 20.75396 7.419545 5.629423       10.09960 
1 1 1 10  25 2  o 196.6431 3.289493 472.0747       15.76318 491.5774       24.70841 458.6890       20.46999 200.3334 5.065284 193.6959 4.336718 6.637497       6.668150 
1 1 1 10  25 3  o 206.7858 3.376386 522.1083       17.01410 487.9711       25.29900 550.2976       22.98959 199.5560 5.206831 212.1312 4.447241 -12.57515      6.847558 
1 1 1 10  25 4  o 221.6449 3.517823 599.9891       19.00062 639.9965       30.32794 574.1396       24.37799 228.5406 5.445570 216.6337 4.617808 11.90692       7.139915 
1 1 1 10  25 5  o 88.65118 2.726350 95.98859       5.882822 93.16958       8.299219 98.83541       8.340064 87.22617 3.914373 89.85506 3.817521 -2.628891      5.467704 
1 1 1 10  25 6  o 56.26325 3.087924 38.76115       4.217539 43.17598       5.794503 33.78736       6.150395 59.29354 4.034290 52.30843 4.881335 6.985115       6.332687 
1 1 1 10  25 7  o 77.17081 2.746504 72.77009       5.156753 67.72318       7.075489 78.48827       7.531337 74.32982 3.920084 80.04014 3.872746 -5.710320      5.510465 
1 1 1 10  25 8  o 118.2338 2.916057 170.6490       8.401829 159.2841       11.18310 185.3772       12.73072 114.0614 4.029678 123.0281 4.252714 -8.966682      5.858659 
1 1 1 10  25 9  o 210.4561 3.750408 541.4216       19.23428 541.7957       39.62508 541.3063       21.99993 209.2742 7.783513 210.3283 4.292274 -1.054062      8.888571 
1 1 1 10  25 10 o 138.5285 3.077548 234.3641       10.38915 213.7423       21.22952 240.8579       11.91315 131.5757 6.642560 140.3891 3.482227 -8.813339      7.499968 
1 1 1 10  25 11 o 112.6442 3.534603 155.2562       9.690536 171.0630       17.96839 148.7730       11.50749 117.7250 6.286108 110.1539 4.295143 7.571053       7.613369 
1 1 1 10  25 12 o 63.89705 2.826630 49.95422       4.390456 59.45208       11.02178 48.16287       4.786614 69.12807 6.623700 62.70750 3.142382 6.420570       7.331300 
1 1 1 10  25 13 o 137.8744 3.012294 232.2479       10.12085 219.6501       22.03194 235.6173       11.39423 133.1765 6.811363 138.8239 3.368096 -5.647446      7.598601 
1 1 1 10  25 14 o 31.74353 3.524345 12.47650       2.680381 20.12197       8.852408 11.70482       2.812399 39.32443 9.371246 30.68510 3.845289 8.639324       10.12949 
1 1 1 10  25 15 o 140.0687 3.010447 239.8008       10.27563 216.0755       21.80256 246.5758       11.65076 131.9468 6.803645 141.9778 3.367423 -10.03096      7.591384 
1 1 1 10  25 16 o 108.0370 3.084749 142.8531       8.113042 0.000000       0.000000 142.8531       8.113042 ?        ?        108.0370 3.084749 0.000000       3.084749 
1 1 1 10  25 17 o 36.03773 3.662733 16.07710       3.171970 0.000000       0.000000 16.07710       3.171970 ?        ?        36.03773 3.662733 0.000000       3.662733 
1 1 1 10  25 18 o 133.1983 3.556342 217.6601       11.53319 210.7081       21.51746 220.4624       13.66131 129.8696 6.822969 133.8760 4.192657 -4.006348      8.008202 
1 1 1 10  25 19 f 47.83194 3.110771 28.14435       3.606283 34.78199       9.611904 27.05692       3.890490 52.02699 7.823275 46.84585 3.431792 5.181133       8.542881 
1 1 1 10  25 20 o 76.75350 3.557993 72.52502       6.636760 94.45837       13.53853 65.58698       7.614431 86.65356 6.457773 72.80394 4.311171 13.84962       7.764601 
1 1 1 10  25 21 o 50.53400 3.107823 31.46321       3.808641 26.91315       9.222932 32.39865       4.181864 45.03868 8.718382 51.23366 3.368170 -6.194977      9.346376 
1 1 1 10  25 22 o 52.42114 3.074530 33.88786       3.910303 42.08448       10.00671 32.41067       4.248071 56.95276 7.383710 51.18760 3.425292 5.765160       8.139521 
1 1 1 10  25 23 o 44.98997 3.637524 25.17480       3.954044 29.90492       9.348657 24.14428       4.363556 47.17567 8.441922 43.92564 4.124754 3.250027       9.395725 
1 1 1 10  25 24 o 13.24392 5.413794 0.9305996      2.770792 0.2562721      6.217334 1.097719       3.095150 17.99686 7.769211 14.03374 5.727506 3.963129       9.652200 
1 1 1 10  25 25 o 31.20698 5.616165 12.78589       4.113949 23.33314       8.522847 9.581903       4.697427 40.67916 8.849870 26.51566 7.120221 14.16351       11.35860 
1 1 1 10  25 26 o 41.17564 4.562233 21.72121       4.501051 14.84721       8.663417 24.26273       5.267826 31.52157 10.02637 43.29390 5.090224 -11.77233      11.24449 
1 1 1 10  25 27 o 15.62206 5.579640 2.867471       2.684395 4.387158       6.539549 2.559516       2.943845 20.84445 8.391133 15.44754 5.789520 5.396914       10.19459 
1 1 1 10  25 28 o 58.94141 4.439422 44.95136       6.329642 59.22847       11.05102 37.98086       7.721721 64.92169 7.100834 52.81044 6.112839 12.11125       9.369559 
1 1 1 10  25 29 o 16.15759 5.511387 3.402621       2.601776 6.657843       6.750756 2.834749       2.819597 21.99753 8.631374 15.42674 5.687964 6.570796       10.33700 
1 1 1 10  25 30 o 15.57002 5.794765 2.992239       2.938865 7.055043       4.377157 -0.3425088     3.965616 21.56825 7.147219 13.36739 5.969643 8.200860       9.312324 
1 1 1 10  25 31 o 19.50610 5.401819 5.502102       2.655582 -0.7998048     5.701639 7.247890       3.000955 15.02102 6.885266 22.33030 5.541191 -7.309279      8.838081 
1 1 1 10  25 32 o 14.74748 5.256739 2.931175       2.381508 2.250819       4.656929 3.172112       2.771295 15.78552 6.768032 15.34478 5.642251 0.4407406      8.811427 
1 1 1 10  25 33 o 9.660966 4.436583 -0.9973930     2.382299 6.353198       8.116325 -1.690376      2.492067 19.47586 8.627998 9.335411 4.371937 10.14045       9.672444 
1 1 1 10  25 34 f 11.27284 4.813327 0.7990347      2.337788 4.661092       4.703529 -0.4680565     2.694129 17.07826 7.025399 10.58524 4.805995 6.493020       8.511981 
1 1 1 10  25 35 o 10.63686 4.702907 0.2811358      2.399815 -1.457903      4.757131 0.8747706      2.779394 12.44963 5.894494 11.79131 5.141534 0.6583233      7.821792 
1 1 1 10  25 36 o 11.89761 5.118872 1.257626       2.681408 1.086477       4.955815 1.328469       3.188425 13.69795 6.329446 12.48427 5.473767 1.213678       8.368035 
1 1 1 10  26 0  o 105.3253 2.789882 135.4650       7.154377 142.5114       10.75639 129.8745       9.580951 107.8967 4.098382 103.0268 3.822750 4.869888       5.604476 
1 1 1 10  26 1  f 91.37829 2.776098 101.9877       6.174616 98.98902       8.904096 104.7655       8.569940 89.89643 4.075136 92.51747 3.809323 -2.621040      5.578322 
1 1 1 10  26 2  o 51.34756 3.275960 32.32438       4.077778 28.31259       5.460944 37.38054       6.130688 47.86531 4.744131 55.08127 4.609637 -7.215961      6.614796 
1 1 1 10  26 3  o 89.26466 2.788485 97.33727       6.058302 105.0064       8.821605 90.49154       8.334590 92.60567 3.917927 85.94687 3.990295 6.658798       5.592191 
1 1 1 10  26 4  o 46.70678 3.482045 26.79528       3.934724 25.09381       5.335290 28.82422       5.826131 44.99926 4.946865 48.25284 5.028436 -3.253578      7.053839 
1 1 1 10  26 5  o 70.75356 2.864353 61.20423       4.928471 59.39698       6.897176 63.08978       7.044993 69.57550 4.085967 71.71740 4.047493 -2.141899      5.751289 
1 1 1 10  26 6  o 177.6264 3.149102 385.2908       13.63109 366.0712       20.15837 401.4825       18.50244 172.8216 4.791159 181.1651 4.191008 -8.343430      6.365512 
1 1 1 10  26 7  o 156.3500 3.001088 298.4850       11.43438 308.2213       17.27586 290.8946       15.25360 158.6122 4.474053 154.1603 4.063896 4.451904       6.044204 
1 1 1 10  26 8  o 84.89962 3.372147 88.20818       6.962795 84.85777       7.840803 100.7050       15.14299 83.21011 3.877432 90.12074 6.948888 -6.910629      7.957482 
1 1 1 10  26 9  o 131.2608 2.668213 210.3188       8.534765 198.7704       12.86991 219.3842       11.40279 127.3727 4.151869 133.9261 3.496887 -6.553360      5.428281 
1 1 1 10  26 10 o 154.4276 3.215906 291.4009       12.10220 296.7879       25.64584 289.8576       13.72671 154.9408 6.808901 153.9538 3.658811 0.9869385      7.729685 
1 1 1 10  26 11 o 30.67663 4.430059 11.76632       3.215899 16.71403       7.645522 10.70278       3.544728 35.93027 8.802458 29.09488 5.189929 6.835390       10.21854 
1 1 1 10  26 12 o 42.63496 4.700026 22.56595       4.802242 24.72927       9.189377 21.75319       5.632557 43.75831 8.920546 41.66792 5.696081 2.090393       10.58402 
1 1 1 10  26 13 o 90.13770 3.572739 99.57318       7.832182 79.97528       13.84099 108.8045       9.499362 80.02666 7.173366 94.13650 4.151161 -14.10984      8.287902 
1 1 1 10  26 14 o 139.7739 4.513994 240.0640       15.35512 0.000000       0.000000 240.0640       15.35512 ?        ?        139.7739 4.513994 0.000000       4.513994 
1 1 1 10  26 15 o 142.3666 3.068555 247.9085       10.64579 297.6536       25.76414 237.6666       11.69046 154.6765 6.852270 139.3255 3.443221 15.35101       7.668726 
1 1 1 10  26 16 o 74.57020 2.805427 68.09155       5.088916 60.66245       11.99361 69.72268       5.619879 69.40362 7.195677 75.42358 3.063999 -6.019966      7.820861 
1 1 1 10  26 17 o 82.53103 2.725415 83.39835       5.473814 84.77689       13.10315 83.10692       6.024694 82.25686 6.591968 82.34299 3.007478 -0.8613586E-01 7.245616 
1 1 1 10  26 18 o 122.5196 2.929396 183.8244       8.746206 181.4314       19.66861 184.4142       9.764766 120.2577 6.738533 122.5972 3.271398 -2.339546      7.490652 
1 1 1 10  26 19 o 82.04053 2.807163 82.54478       5.603920 94.33602       14.19503 80.36781       6.099336 86.39854 6.796771 80.89248 3.099865 5.506058       7.470291 
1 1 1 10  26 20 f 22.22797 5.154594 6.387369       2.737748 2.241562       7.484172 7.027837       2.941628 21.29745 8.821281 23.30721 5.299479 -2.009758      10.29075 
1 1 1 10  26 21 o 47.54697 3.432240 27.99359       3.950061 38.28146       10.22243 26.18785       4.282714 53.95175 8.018685 45.87983 3.866502 8.071926       8.902200 
1 1 1 10  26 22 o 17.31893 5.863771 3.577520       2.944490 10.52851       7.614143 2.355228       3.192898 28.30752 9.427932 15.81904 6.007107 12.48848       11.17905 
1 1 1 10  26 23 o 45.69390 3.365171 25.96184       3.720867 34.38599       9.323926 24.36614       4.057997 50.63973 7.806159 44.13404 3.810413 6.505688       8.686505 
1 1 1 10  26 24 o 77.74374 5.080935 76.99622       9.573239 78.88152       13.00109 74.76336       14.14882 77.23580 6.982924 74.35377 7.931037 2.882034       10.56705 
1 1 1 10  26 25 o 93.39080 4.928730 111.5662       11.17725 120.3289       15.69751 102.5546       15.91885 94.97218 6.828209 86.75671 7.606492 8.215469       10.22170 
1 1 1 10  26 26 o 13.47307 5.816486 0.1401661      3.484974 8.192848       6.954555 -2.559945      4.027076 24.49344 8.949183 12.35699 5.708335 12.13646       10.61475 
1 1 1 10  26 27 o 29.57977 4.553168 11.50224       3.176934 12.67356       7.927231 11.27812       3.467579 28.31274 9.620913 29.03330 5.086380 -0.7205544     10.88270 
1 1 1 10  26 28 o 21.51174 5.269089 6.398293       2.739890 12.71529       7.937295 5.543751       2.919335 27.59933 9.617254 19.91235 5.716646 7.686975       11.18801 
1 1 1 10  26 29 f 39.98001 5.462883 22.15206       5.183253 39.71814       9.710723 15.15342       6.129442 50.27233 8.209671 30.72295 8.080482 19.54938       11.51924 
1 1 1 10  26 30 o 27.32959 6.854315 11.54580       4.556311 0.000000       0.000000 11.54580       4.556311 ?        ?        27.32959 6.854315 0.000000       6.854315 
1 1 1 10  26 31 o 12.84445 4.991701 1.808399       2.240230 6.287758       4.245144 0.7949810E-01  2.637361 19.92613 7.026543 11.31706 4.969662 8.609072       8.606384 
1 1 1 10  26 32 o 7.605367 3.695901 -3.181349      2.166131 -0.7300185E-01 4.339653 -4.212769      2.499815 13.46640 6.108376 7.827928 3.839546 5.638473       7.214871 
1 1 1 10  26 33 o 11.91193 5.027899 1.097747       2.501228 2.515408       8.528508 0.9643356      2.616273 17.19887 8.065192 11.91837 5.090538 5.280499       9.537343 
1 1 1 10  26 34 o 13.26273 5.278307 2.266242       2.557395 -3.285370      4.702310 4.598012       3.047506 11.60884 5.593637 16.71129 5.947605 -5.102456      8.164728 
1 1 1 10  26 35 o 17.85551 5.418204 5.238770       2.563195 11.74323       5.196107 3.146992       2.946661 23.33898 7.788700 14.41679 5.688591 8.922190       9.644890 
1 1 1 10  27 0  o 72.36569 3.363973 64.09859       5.916043 50.74610       9.883155 71.55475       7.385369 63.94045 6.430050 76.40146 3.980474 -12.46101      7.562388 
1 1 1 10  27 1  o 85.85684 2.852918 90.07444       5.960694 82.67860       8.378423 97.65413       8.481919 82.11078 4.201188 89.29160 3.907512 -7.180817      5.737475 
1 1 1 10  27 2  o 16.33342 6.113276 2.452873       3.279998 4.951008       4.396297 -0.6835243     4.926003 20.92742 7.163587 15.89167 6.887910 5.035743       9.937820 
1 1 1 10  27 3  o 100.7756 2.800006 124.0595       6.869569 113.8321       9.830729 133.8193       9.603337 96.37159 4.196070 104.5607 3.775123 -8.189079      5.644338 
1 1 1 10  27 4  o 117.6342 2.814157 168.9211       8.067114 168.4122       11.78835 169.3694       11.06337 117.2588 4.131910 117.6303 3.864754 -0.3715286     5.657650 
1 1 1 10  27 5  o 192.7509 3.737763 454.2292       17.55676 432.6266       23.22070 483.0600       26.82565 187.7749 5.079264 198.2913 5.556981 -10.51646      7.528543 
1 1 1 10  27 6  o 193.7675 3.555917 458.9458       16.79069 461.9863       23.77808 455.9219       23.71329 194.0327 5.033064 192.7488 5.052877 1.283920       7.131851 
1 1 1 10  27 7  o 121.9838 2.554322 181.6198       7.593008 179.7073       12.19918 182.8293       9.701243 121.0996 4.139909 122.2799 3.258544 -1.180214      5.268487 
1 1 1 10  27 8  o 81.89730 2.636237 81.96674       5.254411 78.18285       7.754581 85.17872       7.144564 79.82615 3.999102 83.39212 3.523664 -3.565971      5.330011 
1 1 1 10  27 9  o 84.00591 2.883981 86.29900       5.895137 89.21402       7.868261 82.56863       8.900875 85.30273 3.794618 81.95653 4.473660 3.346199       5.866240 
1 1 1 10  27 10 o 77.76465 3.032487 74.00652       5.735667 79.52185       12.48580 72.53133       6.457323 80.01728 6.458009 76.93447 3.453057 3.082809       7.323215 
1 1 1 10  27 11 o 35.31895 4.789008 15.58741       4.015729 0.000000       0.000000 15.58741       4.015729 ?        ?        35.31895 4.789008 0.000000       4.789008 
1 1 1 10  27 12 o 90.77020 3.215850 100.8892       7.102128 0.000000       0.000000 100.8892       7.102128 ?        ?        90.77020 3.215850 0.000000       3.215850 
1 1 1 10  27 13 o 57.58883 3.038522 40.66900       4.249103 41.37052       10.29665 40.52502       4.664826 57.15919 7.578783 57.44746 3.346672 -0.2882690     8.284816 
1 1 1 10  27 14 o 85.73756 2.826873 89.97561       5.898196 96.00317       13.86230 88.64318       6.517591 87.72350 6.531473 85.05289 3.150017 2.670609       7.251396 
1 1 1 10  27 15 o 145.4172 3.783689 259.6153       13.39671 257.6997       23.79788 260.5040       16.20897 143.6688 6.816797 145.4111 4.579979 -1.742386      8.212486 
1 1 1 10  27 16 o 100.6319 3.523969 124.3781       8.628458 140.4948       16.07565 117.8561       10.22636 106.0805 6.246303 97.76299 4.303042 8.317551       7.585016 
1 1 1 10  27 17 o 88.01029 3.589229 95.29493       7.681721 80.79408       13.59803 102.0916       9.309489 79.91131 7.055222 90.93703 4.212408 -11.02573      8.217088 
1 1 1 10  27 18 o 24.62611 4.722272 7.750213       2.730810 17.39825       7.667038 6.348423       2.922468 36.10610 8.796174 22.15780 5.450543 13.94830       10.34800 
1 1 1 10  27 19 o 8.982607 4.173285 -1.915918      2.198947 -0.6699609     6.260912 -2.091239      2.348566 17.68073 7.713059 9.241838 4.300234 8.438891       8.830815 
1 1 1 10  27 20 o 24.16812 5.171665 7.568589       2.953824 10.38317       7.291979 7.016089       3.230759 28.21517 9.218838 23.17463 5.748703 5.040541       10.86437 
1 1 1 10  27 21 o 27.94024 4.573938 9.977579       3.006611 22.35805       8.560540 8.235512       3.211183 40.32632 8.945383 25.12303 5.405548 15.20329       10.45179 
1 1 1 10  27 22 o 62.15340 3.906633 48.24838       5.887098 68.32713       12.23804 42.20304       6.715115 72.15076 7.050272 57.74442 4.815883 14.40634       8.538095 
1 1 1 10  27 23 o 53.85065 4.070443 36.49264       5.302015 56.27544       10.54401 29.79761       6.133921 65.28977 6.723118 48.08392 5.323911 17.20585       8.575800 
1 1 1 10  27 24 o 110.5524 3.665164 153.0261       9.860453 164.4700       18.48760 148.4764       11.65688 110.9625 6.870743 108.2289 4.429159 2.733574       8.174628 
1 1 1 10  27 25 o 59.86223 5.403034 46.98762       7.797070 35.85772       10.17375 62.82981       12.13789 49.54748 8.745670 67.14954 7.548169 -17.60206      11.55256 
1 1 1 10  27 26 o 15.68796 5.590679 2.975786       2.693543 6.767695       6.762802 2.260849       2.936509 22.65819 8.708357 14.90343 5.735666 7.754759       10.42753 
1 1 1 10  27 27 o 9.554315 4.409505 -1.552816      2.394853 7.325340       7.110385 -2.688838      2.543462 22.75080 8.878386 9.053771 4.293537 13.69703       9.862058 
1 1 1 10  27 28 o 16.37959 5.683447 3.573035       2.770525 0.000000       0.000000 3.573035       2.770525 ?        ?        16.37959 5.683447 0.000000       5.683447 
1 1 1 10  27 29 o 20.74026 6.490502 6.490529       3.644193 9.657200       7.833152 5.615831       4.116841 23.46454 9.269820 19.45309 6.913870 4.011450       11.56422 
1 1 1 10  27 30 o 24.27888 6.917008 9.433567       4.289994 9.155600       8.083449 9.542556       5.061633 22.38187 9.208835 23.74674 7.674931 -1.364874      11.98779 
1 1 1 10  27 31 o 18.37765 5.457040 5.068408       2.621097 9.502312       7.401665 4.432659       2.802716 21.92618 8.891000 17.19941 5.719767 4.726767       10.57193 
1 1 1 10  27 32 o 11.19306 4.876996 0.4375142      2.496736 13.63750       8.231777 -0.8998283     2.620163 23.67239 9.453697 10.15276 4.658872 13.51963       10.53933 
1 1 1 10  27 33 o 13.85197 5.588400 2.484650       2.907454 6.924987       8.063558 1.821101       3.117133 18.50865 8.367834 13.25906 5.605525 5.249597       10.07187 
1 1 1 10  27 34 o 13.38473 5.325639 2.427711       2.602885 2.009746       4.788675 2.602980       3.100973 14.40566 6.486480 13.89916 5.709584 0.5065031      8.641398 
1 1 1 10  27 35 o 13.08137 5.282679 2.326983       2.600856 0.3528980      4.983546 3.065923       3.049020 13.27044 6.204282 14.21679 5.727338 -0.9463501     8.443667 
1 1 1 10  28 0  o 166.4019 3.124786 338.1819       12.67111 371.5950       20.11968 316.2174       16.31260 174.0963 4.746798 160.7060 4.168905 13.39030       6.317584 
1 1 1 10  28 1  o 123.3891 3.304971 186.1400       9.928630 180.3618       18.46180 188.4911       11.77666 120.9180 6.286964 124.0840 3.899506 -3.166008      7.398113 
1 1 1 10  28 2  o 57.54045 3.291347 40.58326       4.595869 44.21507       6.488711 36.92710       6.510422 59.92351 4.475831 54.66438 4.940575 5.259132       6.666509 
1 1 1 10  28 3  o 164.3901 3.099308 330.0973       12.41585 311.0416       18.23158 346.5781       16.95515 159.2481 4.703165 168.2804 4.134586 -9.032349      6.262153 
1 1 1 10  28 4  o 95.29700 3.987080 111.3189       9.238678 124.8647       14.83707 102.7410       11.80692 100.5534 6.083476 91.32633 5.328375 9.227028       8.087043 
1 1 1 10  28 5  o 122.5583 2.865363 183.4393       8.557726 177.9807       12.51874 188.2278       11.72511 120.4773 4.270776 123.9678 3.886053 -3.490532      5.774161 
1 1 1 10  28 6  o 35.91953 3.918994 15.97574       3.374793 19.20139       4.920940 13.11152       4.637056 39.19372 5.286939 32.10489 6.150850 7.088833       8.110776 
1 1 1 10  28 7  o 44.92467 3.219694 24.79358       3.501437 26.52402       5.139588 23.29483       4.783162 46.28231 4.618584 43.34770 4.598114 2.934612       6.517206 
1 1 1 10  28 8  o 28.26794 4.841290 10.07912       3.215082 9.183221       4.664137 10.89021       4.437919 26.76316 7.053401 29.15074 6.421093 -2.387571      9.538391 
1 1 1 10  28 9  o 125.7168 2.948598 193.1345       9.033269 197.8913       16.52745 191.1081       10.78704 126.7198 5.364245 124.9246 3.546976 1.795250       6.430876 
1 1 1 10  28 10 o 136.3578 3.144183 227.3710       10.44778 253.3573       22.93295 220.5649       11.73651 142.9186 6.602528 134.1803 3.592568 8.738312       7.516643 
1 1 1 10  28 11 o 53.19677 3.964958 34.88435       5.102996 49.92611       10.64084 30.39175       5.815346 63.02517 7.048867 49.47544 4.887125 13.54973       8.577326 
1 1 1 10  28 12 o 72.45300 3.043925 64.32869       5.362382 72.55829       12.25685 62.38061       5.963384 76.16734 6.670766 71.28833 3.442898 4.879005       7.506841 
1 1 1 10  28 13 o 46.19368 3.351966 26.27342       3.747603 29.72462       8.799032 25.50864       4.142073 48.15343 7.762313 45.44885 3.773905 2.704586       8.631099 
1 1 1 10  28 14 o 106.1374 2.898253 137.9708       7.489175 148.8712       16.85425 135.2891       8.359820 109.1997 6.361161 105.0260 3.270345 4.173683       7.152589 
1 1 1 10  28 15 o 149.2300 3.144989 272.9461       11.43698 270.1089       24.38257 273.7464       12.95000 146.7088 6.838863 149.3256 3.558765 -2.616837      7.709401 
1 1 1 10  28 16 o 53.84088 2.961007 35.63643       3.870012 47.82828       9.959486 33.46819       4.200066 61.36769 6.772301 52.11098 3.324772 9.256702       7.544413 
1 1 1 10  28 17 o 26.40525 4.396491 8.844997       2.729570 6.333909       6.884793 9.313310       2.973224 24.15431 8.891176 27.04712 4.680338 -2.892811      10.04782 
1 1 1 10  28 18 o 24.98649 7.017591 8.180721       4.447956 14.77199       7.654322 4.820173       5.465465 33.03272 9.179737 21.35550 7.910991 11.67723       12.11822 
1 1 1 10  28 19 o 15.65456 6.340892 1.494620       3.759939 5.265720       7.188912 0.7459129E-01  4.411413 23.19257 8.961449 15.34612 6.583563 7.846452       11.11984 
1 1 1 10  28 20 o 33.96863 5.529580 14.91946       4.419972 30.66843       8.727095 9.486019       5.126029 47.95557 7.730625 26.58125 7.557083 21.37432       10.81074 
1 1 1 10  28 21 o 35.36672 5.136698 16.10970       4.297694 24.92269       8.680635 13.24810       4.946463 42.36661 8.699484 31.46006 6.659888 10.90655       10.95605 
1 1 1 10  28 22 o 17.36595 6.458118 3.252194       3.648868 3.673902       6.719639 3.075849       4.345325 20.88867 8.471042 17.91898 6.955326 2.969694       10.96062 
1 1 1 10  28 23 o 73.95874 5.049579 70.36959       9.046232 76.91153       12.75700 63.75264       12.82992 75.54053 7.009958 67.87261 7.904757 7.667915       10.56526 
1 1 1 10  28 24 o 32.92709 4.250430 13.98539       3.331052 20.53815       8.771761 12.88120       3.600785 36.38158 9.712263 31.31293 4.877694 5.068651       10.86830 
1 1 1 10  28 25 o 10.89868 4.886035 -0.8500492     2.684340 5.892079       6.844611 -2.075527      2.918118 21.89793 8.660702 10.40140 4.823877 11.49653       9.913503 
1 1 1 10  28 26 o 40.69270 3.606164 21.22972       3.539019 32.53626       9.985024 19.60530       3.784717 44.82541 9.439672 38.84013 4.058510 5.985287       10.27516 
1 1 1 10  28 27 o 18.12292 5.884053 4.608928       2.973049 0.000000       0.000000 4.608928       2.973049 ?        ?        18.12292 5.884053 0.000000       5.884053 
1 1 1 10  28 28 o 11.86107 5.016570 0.6829993      2.498229 6.589458       7.416152 -0.7303974E-01 2.653305 21.14939 8.772421 11.32181 4.977770 9.827589       10.08631 
1 1 1 10  28 29 o 15.00650 6.129865 2.343093       3.549082 1.290844       7.686870 2.628177       4.001073 17.59716 8.039099 15.71468 6.473594 1.882483       10.32156 
1 1 1 10  28 30 o 15.08325 5.525653 3.112360       2.654044 3.058845       7.657085 3.119667       2.829446 17.94392 8.129237 15.18692 5.679177 2.757005       9.916529 
1 1 1 10  28 31 o 10.30157 4.701197 -0.7456705     2.619765 0.7585722      6.972703 -0.9929168     2.826878 15.92373 7.409399 10.47960 4.819969 5.444133       8.839190 
1 1 1 10  28 32 o 11.85459 5.159392 0.7908323      2.787567 2.028631       8.070086 0.6231359      2.970400 16.43857 7.751153 11.93521 5.256428 4.503363       9.365384 
1 1 1 10  28 33 o 10.70806 4.881284 -0.3512985     2.814283 5.243936       8.291794 -1.079766      2.991881 17.29648 8.058811 10.42952 4.853110 6.866958       9.407290 
1 1 1 10  28 34 o 10.30131 4.743187 -0.5808873     2.748105 7.228981       8.199641 -1.569137      2.916798 17.60947 8.138505 9.861378 4.652934 7.748095       9.374703 
1 1 1 10  29 0  o 14.49737 5.996947 0.7039703      3.452760 0.9394427      4.571513 0.3912666      5.268129 16.66109 6.897001 17.28460 7.296335 -0.6235046     10.04018 
1 1 1 10  29 1  o 123.7695 2.890659 187.0955       8.718597 183.8996       12.93266 189.7580       11.80436 122.4504 4.340895 124.4666 3.896627 -2.016174      5.833272 
1 1 1 10  29 2  o 69.13139 4.323526 58.77171       7.247191 51.61890       10.55460 65.15237       9.968637 64.30592 6.840095 72.56953 5.682245 -8.263618      8.892401 
1 1 1 10  29 3  o 75.45890 3.534249 69.78717       6.480903 76.01722       12.15292 67.31133       7.661193 78.25351 6.429612 74.00531 4.266208 4.248199       7.716245 
1 1 1 10  29 4  o 54.45265 4.070383 36.51067       5.362121 41.46904       8.320712 32.98898       7.012399 57.72067 6.003117 51.47599 5.684766 6.244686       8.267646 
1 1 1 10  29 5  o 28.48392 5.922425 10.35914       3.976672 14.27685       6.358230 7.842019       5.096503 33.24701 7.954520 25.07469 7.646480 8.172319       11.03372 
1 1 1 10  29 6  o 57.97789 3.422343 41.25962       4.813776 37.86028       7.765935 43.38070       6.134435 55.12430 5.871405 59.33643 4.271028 -4.212128      7.260515 
1 1 1 10  29 7  o 40.31253 3.568393 20.04453       3.469323 28.88985       5.129067 12.58444       4.710358 48.33003 4.403274 31.36112 6.380861 16.96891       7.752690 
1 1 1 10  29 8  o 94.86105 2.543617 109.9922       5.874674 109.7613       9.199476 110.1512       7.633919 94.54063 4.002138 94.82577 3.308651 -0.2851334     5.192714 
1 1 1 10  29 9  f 62.73061 2.771229 48.19022       4.225858 48.70101       6.013179 47.69177       5.940024 62.90179 3.942710 62.24513 3.936196 0.6566582      5.571230 
1 1 1 10  29 10 o 96.88039 3.022047 114.9299       7.125933 109.2742       14.63171 116.6885       8.158928 93.63948 6.451527 97.54884 3.437591 -3.909363      7.310214 
1 1 1 10  29 11 o 60.88559 3.273493 45.52911       4.839075 32.36933       9.922362 49.63588       5.542947 50.08330 8.428939 63.52955 3.595049 -13.44625      9.163590 
1 1 1 10  29 12 o 35.29555 4.226268 15.53412       3.562890 13.93419       7.757005 15.96191       4.011023 32.63219 9.302570 35.68492 4.728757 -3.052731      10.43547 
1 1 1 10  29 13 o 124.4880 3.497841 190.3321       10.60066 190.0489       19.48833 190.4510       12.63310 123.2021 6.514281 124.3183 4.175956 -1.116150      7.737859 
1 1 1 10  29 14 o 167.7959 3.910054 346.5243       15.98822 342.8762       28.55772 348.1898       19.29570 164.8705 7.124768 167.7497 4.724932 -2.879196      8.549110 
1 1 1 10  29 15 o 26.97278 4.904500 9.290806       3.105000 14.51350       7.113389 8.061485       3.451135 32.98362 8.719102 24.92730 5.792053 8.056324       10.46760 
1 1 1 10  29 16 o 86.96784 3.056602 93.00798       6.467822 109.1776       13.83436 88.48516       7.316679 92.98136 6.139947 84.68756 3.553238 8.293800       7.093973 
1 1 1 10  29 17 o 33.24947 3.638571 13.80055       2.900082 30.66843       7.995842 11.24545       3.111989 48.61711 6.946221 29.79278 4.420211 18.82433       8.233362 
1 1 1 10  29 18 o 87.05547 4.693044 94.90347       9.919238 96.76327       13.22612 92.51270       14.99579 86.99104 6.281401 84.30981 7.372977 2.681229       9.685906 
1 1 1 10  29 19 o 20.74342 5.193439 5.636091       2.619036 6.210605       5.954556 5.498288       2.916270 22.90858 8.293962 20.48490 5.656088 2.423683       10.03898 
1 1 1 10  29 20 o 67.03206 3.774141 56.11706       6.140151 71.96318       11.68767 50.07640       7.216199 74.21679 6.528815 62.86384 4.745594 11.35295       8.071313 
1 1 1 10  29 21 o 30.22787 4.299952 11.70915       3.078200 13.57551       7.924899 11.37754       3.340489 30.56047 9.572510 29.61917 4.791621 0.9412975      10.70479 
1 1 1 10  29 22 o 33.10041 4.003027 13.98187       3.163412 23.91937       8.095965 12.19126       3.436618 40.82116 8.418254 30.59207 4.764987 10.22908       9.673267 
1 1 1 10  29 23 o 14.02265 5.429673 1.860788       2.643206 8.662160       7.139482 0.7804810      2.845392 24.82954 9.068105 12.97015 5.411160 11.85939       10.55989 
1 1 1 10  29 24 o 84.66611 3.487436 90.64201       7.179947 74.65385       13.18493 97.38183       8.560563 72.08831 7.620677 87.22572 4.038331 -15.13741      8.624549 
1 1 1 10  29 25 o 30.71997 4.745311 12.62964       3.438059 0.000000       0.000000 12.62964       3.438059 ?        ?        30.71997 4.745311 0.000000       4.745311 
1 1 1 10  29 26 f 10.26007 4.655676 -0.9885584     2.523783 4.801808       6.560362 -1.994361      2.734205 19.90265 8.252626 9.905192 4.619253 9.997460       9.457449 
1 1 1 10  29 27 o 19.61272 5.481620 5.535536       2.720952 4.590210       7.356095 5.685376       2.928667 19.76180 8.490090 19.77155 5.740879 -0.9750366E-02 10.24887 
1 1 1 10  29 28 o 12.30210 5.422668 0.1305792      3.167614 10.68829       7.420895 -2.221628      3.502750 23.82157 9.130689 11.08110 5.187450 12.74046       10.50139 
1 1 1 10  29 29 o 20.18358 6.440984 6.480053       3.572890 4.966140       7.916359 6.867321       4.003879 19.10777 8.489902 20.50226 6.836901 -1.394489      10.90053 
1 1 1 10  29 30 o 13.65393 5.539454 2.096890       2.874869 -2.322722      7.184228 2.939543       3.136984 14.81712 7.079634 14.91071 5.873759 -0.9358501E-01 9.199036 
1 1 1 10  29 31 o 8.988673 4.272220 -2.160390      2.546138 -1.382931      6.801353 -2.287104      2.745800 14.49160 6.914262 9.302609 4.425742 5.188986       8.209397 
1 1 1 10  29 32 o 16.01729 5.821661 4.148346       2.937532 16.64789       9.200132 2.729387       3.099787 23.12282 9.694306 14.16053 5.749465 8.962287       11.27102 
1 1 1 10  29 33 o 12.94349 5.372380 2.033463       2.784104 7.843009       8.170609 1.270321       2.961323 18.06003 8.264777 12.27788 5.330935 5.782146       9.834908 
1 1 1 10  30 0  f 63.56811 4.012531 49.68732       6.184038 39.12549       9.520529 57.39579       8.133459 55.76889 7.171185 68.19164 4.927735 -12.42274      8.701060 
1 1 1 10  30 1  o 135.7561 4.654283 226.4378       15.37466 237.3036       21.07250 214.0698       22.48200 138.5185 6.258866 131.2839 7.053173 7.234543       9.429775 
1 1 1 10  30 2  o 108.5285 3.132083 144.1169       8.274825 144.2252       11.20822 143.9871       12.26823 108.3787 4.252066 108.2050 4.663581 0.1737671      6.311026 
1 1 1 10  30 3  o 69.42966 3.180292 59.06868       5.366526 66.58102       7.552749 51.40867       7.626618 73.56834 4.230711 64.50121 4.888479 9.067123       6.464994 
1 1 1 10  30 4  o 49.21700 4.200467 29.91897       4.989786 25.70111       8.662798 32.01317       6.104098 44.70512 8.255845 50.78527 4.996926 -6.080158      9.650298 
1 1 1 10  30 5  o 44.63107 3.490284 24.53177       3.765899 30.03650       5.515265 19.72348       5.154582 49.23070 4.652395 39.64192 5.482440 9.588779       7.190405 
1 1 1 10  30 6  o 26.94385 5.086648 9.224553       3.217456 9.341119       4.441472 9.095835       4.667259 26.92106 6.776105 26.58648 7.078630 0.3345795      9.799112 
1 1 1 10  30 7  o 54.42739 3.079479 36.35685       4.067761 41.02788       6.040498 32.48089       5.502442 57.63588 4.332458 51.22400 4.452224 6.411880       6.212286 
1 1 1 10  30 8  o 31.02870 4.353350 12.05807       3.201297 14.56249       4.435871 9.335927       4.624664 33.90660 5.561193 26.88311 6.993770 7.023491       8.935306 
1 1 1 10  30 9  f 61.10669 2.915066 45.79310       4.328316 53.65545       6.404772 39.18399       5.872173 65.97720 4.002409 56.28689 4.313979 9.690304       5.884700 
1 1 1 10  30 10 o 17.79419 6.400511 3.355086       3.539093 0.3367001      6.585563 4.580778       4.196588 19.00765 8.096155 20.10794 6.993841 -1.100294      10.69867 
1 1 1 10  30 11 o 108.9422 3.013419 145.5075       7.992345 142.5343       16.64528 146.3983       9.111381 106.6608 6.433901 109.1764 3.428927 -2.515610      7.290585 
1 1 1 10  30 12 o 49.69649 3.521395 30.48948       4.236963 38.16605       9.084553 28.35547       4.789813 54.68989 6.974993 47.79261 4.153867 6.897285       8.118197 
1 1 1 10  30 13 o 98.56589 3.277783 119.4597       7.862098 131.5807       15.23749 115.0620       9.178194 102.3098 6.139925 96.54720 3.909133 5.762566       7.278736 
1 1 1 10  30 14 o 11.52635 5.069543 -0.6657508     2.754346 -2.268985      6.027445 -0.2426032     3.096569 16.31481 7.317295 12.68976 5.480572 3.625051       9.142181 
1 1 1 10  30 15 o 51.54200 3.579987 32.91331       4.468598 41.01982       9.120772 30.35283       5.125961 56.46350 6.763080 49.30124 4.309886 7.162262       8.019625 
1 1 1 10  30 16 o 54.79731 3.430639 37.19159       4.558122 32.83640       9.115211 38.64376       5.263464 49.84241 7.756939 55.73024 3.900273 -5.887821      8.682294 
1 1 1 10  30 17 o 16.80014 5.515876 3.457598       2.609094 -5.412983      5.763981 5.743526       2.926023 14.03390 6.596601 20.93903 5.618161 -6.905133      8.664806 
1 1 1 10  30 18 o 19.06874 5.150484 4.753844       2.449253 4.993627       6.169291 4.708980       2.668568 21.77955 8.330867 19.01402 5.467754 2.765524       9.964923 
1 1 1 10  30 19 o 19.57998 5.374692 5.054121       2.642027 16.73163       7.120232 3.189585       2.845145 34.41241 8.533004 16.46430 5.756551 17.94812       10.29320 
1 1 1 10  30 20 o 29.47072 4.130616 11.11762       2.885142 20.90885       7.567883 9.452558       3.120834 38.38251 8.330673 26.85614 4.950964 11.52637       9.690828 
1 1 1 10  30 21 o 65.15682 3.399359 53.21261       5.378837 56.40853       10.63592 52.11435       6.234919 64.42818 6.880662 64.13154 4.009604 0.2966385      7.963695 
1 1 1 10  30 22 f 14.83793 5.455686 2.471419       2.591017 6.678506       6.915331 1.784364       2.794588 22.82934 8.797711 14.11527 5.548959 8.714065       10.40147 
1 1 1 10  30 23 o 58.19857 4.260976 43.78969       6.001188 0.000000       0.000000 43.78969       6.001188 ?        ?        58.19857 4.260976 0.000000       4.260976 
1 1 1 10  30 24 o 17.66348 5.534800 4.281941       2.649142 13.97571       7.246607 2.786614       2.846141 28.95892 9.164973 15.34950 5.704551 13.60941       10.79531 
1 1 1 10  30 25 o 19.15932 5.548820 5.212815       2.739195 8.333364       7.689811 4.759317       2.931484 22.97500 9.149776 18.34224 5.832114 4.632767       10.85044 
1 1 1 10  30 26 o 39.45003 4.448572 20.92473       4.202165 17.29884       8.452254 22.11521       4.843122 29.95004 9.932029 40.02061 5.080311 -10.07058      11.15593 
1 1 1 10  30 27 o 25.06969 5.882633 9.351618       3.531592 13.91059       7.597609 8.095082       3.988695 26.64102 9.399632 22.65913 6.732647 3.981890       11.56208 
1 1 1 10  30 28 o 33.58237 5.138364 16.17632       4.071552 19.38940       9.109469 15.37419       4.551484 28.99072 10.28648 31.78732 6.097491 -2.796597      11.95789 
1 1 1 10  30 29 o 8.356595 4.044483 -3.262536      2.526186 -13.16004      7.218570 -1.881224      2.696710 11.75907 5.892086 9.590079 4.509134 2.168991       7.419499 
1 1 1 10  30 30 o 9.876392 4.578943 -1.164105      2.626156 4.744889       7.828374 -1.913415      2.787696 17.72755 8.104011 9.638964 4.548236 8.088585       9.293085 
1 1 1 10  30 31 o 11.42279 5.059865 0.4358360      2.790632 5.206289       7.931607 -0.2381235     2.981249 17.45690 8.045230 11.10619 5.047662 6.350716       9.497611 
1 1 1 10  30 32 o 12.06082 5.179296 1.259664       2.735294 0.8140311      8.112955 1.316816       2.905404 15.34812 7.383147 12.30587 5.311715 3.042251       9.095339 
1 1 1 10  31 0  o 166.9725 3.169276 341.0539       12.89559 340.5230       19.54374 341.4633       17.16179 166.3396 4.826532 166.7630 4.226462 -0.4233246     6.415481 
1 1 1 10  31 1  o 43.07861 3.942955 22.94056       4.093375 23.98768       5.403222 21.53005       6.271048 43.84262 5.155752 41.22050 6.454624 2.622128       8.260989 
1 1 1 10  31 2  f 71.37053 3.112741 62.43307       5.400730 69.79550       7.796256 55.64025       7.488601 75.28085 4.267245 67.12500 4.605963 8.155846       6.278875 
1 1 1 10  31 3  o 55.15458 3.373026 37.38550       4.511859 43.06020       6.378429 31.70259       6.383039 59.02807 4.467405 50.44116 5.270549 8.586914       6.909153 
1 1 1 10  31 4  f 78.76835 2.976476 76.00891       5.703064 85.49982       8.253613 67.33711       7.889410 83.35715 4.075526 73.88844 4.401540 9.468712       5.998622 
1 1 1 10  31 5  o 41.18311 4.436521 21.09383       4.382279 29.87533       8.062505 17.41164       5.220824 48.48186 7.029009 37.03991 5.988299 11.44195       9.233996 
1 1 1 10  31 6  o 30.44965 5.843870 11.86167       4.178647 8.479056       7.537323 13.36266       5.020878 26.96143 9.373220 32.19938 6.620053 -5.237942      11.47529 
1 1 1 10  31 7  o 66.07693 3.347838 53.65799       5.373199 64.11759       10.88580 50.28876       6.178287 71.51147 6.311378 63.84673 3.990899 7.664745       7.467313 
1 1 1 10  31 8  o 128.9958 3.144507 203.9219       9.884719 214.6582       13.64970 192.0829       14.33357 131.9684 4.249949 124.6584 4.726985 7.309990       6.356606 
1 1 1 10  31 9  o 76.28183 2.609048 71.28980       4.842834 65.60800       7.053909 76.35567       6.660603 72.90616 3.985515 78.78428 3.477839 -5.878120      5.289584 
1 1 1 10  31 10 f 54.93118 4.204451 37.43037       5.585358 29.27839       8.887356 42.75193       7.180592 47.41233 7.974887 58.49711 5.087765 -11.08478      9.459608 
1 1 1 10  31 11 o 91.02213 3.407331 101.9931       7.544492 90.86661       12.98642 107.6614       9.269129 84.84077 6.326840 93.31342 4.086137 -8.472649      7.531628 
1 1 1 10  31 12 o 79.08375 3.065520 76.92916       5.896635 71.20058       11.78783 78.84105       6.809895 74.83856 6.528863 79.94723 3.503943 -5.108665      7.409701 
1 1 1 10  31 13 o 20.25638 5.910792 5.273873       3.097748 13.16495       6.710283 3.136724       3.492126 31.27152 8.558147 17.30491 6.338522 13.96660       10.64982 
1 1 1 10  31 14 o 74.05237 2.992898 67.56341       5.389783 76.00422       11.56480 65.22133       6.091816 77.19063 6.200159 72.62267 3.452102 4.567955       7.096406 
1 1 1 10  31 15 f 26.25820 4.975266 8.914972       3.067089 10.46968       6.810975 8.519508       3.435092 27.94742 8.890101 25.48089 5.677425 2.466524       10.54832 
1 1 1 10  31 16 o 40.81639 3.417136 20.76104       3.367690 35.23116       7.746809 17.38926       3.739527 52.09502 6.225339 37.10923 4.209498 14.98579       7.514967 
1 1 1 10  31 17 o 11.13820 4.743546 0.1165948      2.260123 5.711072       5.223529 -1.172007      2.506938 21.71226 7.780036 10.36246 4.677125 11.34979       9.077690 
1 1 1 10  31 18 o 33.01654 4.078963 13.86696       3.212125 8.160361       6.299895 15.87164       3.733936 24.75338 8.571316 35.21999 4.449656 -10.46661      9.657478 
1 1 1 10  31 19 o 54.98903 3.508328 37.93120       4.676719 35.31655       8.964639 38.90887       5.481784 50.59605 7.497296 55.41520 4.088137 -4.819149      8.539456 
1 1 1 10  31 20 o 45.60591 3.790356 26.38471       4.174434 29.22368       8.368552 25.44430       4.816451 45.30974 7.864260 44.42015 4.512039 0.8895836      9.066702 
1 1 1 10  31 21 o 22.50583 6.223074 7.072201       3.527406 0.000000       0.000000 7.072201       3.527406 ?        ?        22.50583 6.223074 0.000000       6.223074 
1 1 1 10  31 22 o 41.72565 4.659519 22.94142       4.657062 0.000000       0.000000 22.94142       4.657062 ?        ?        41.72565 4.659519 0.000000       4.659519 
1 1 1 10  31 23 o 21.44418 6.167001 6.626940       3.394645 -1.183562      6.595251 9.441916       3.959398 16.27191 7.438513 25.46795 6.390792 -9.196041      9.806819 
1 1 1 10  31 24 o 14.40035 5.871353 1.832154       3.248694 2.564148       7.000775 1.631268       3.667484 18.53251 8.118693 14.70032 6.138931 3.832198       10.17839 
1 1 1 10  31 25 o 20.22795 6.219189 6.096509       3.362658 8.929578       7.651086 5.418259       3.743598 22.86922 9.120410 19.15306 6.608494 3.716166       11.26295 
1 1 1 10  31 26 o 53.23529 3.899838 37.54314       5.024101 49.43632       11.64866 34.82513       5.568678 52.19867 9.507751 50.51927 4.572808 1.679398       10.55026 
1 1 1 10  31 27 o 11.18386 4.979522 -0.1467156     2.737741 2.442374       7.097602 -0.5992688     2.967378 17.35422 7.847824 11.18567 5.064754 6.168558       9.340240 
1 1 1 10  31 28 o 12.75550 5.213561 1.639102       2.569272 -5.176648      7.209248 2.630722       2.749829 13.84257 6.730498 14.25036 5.532525 -0.4077921     8.712545 
1 1 1 10  31 29 o 16.72508 5.736709 4.408718       2.819723 3.114390       8.600750 4.564590       2.984683 17.24450 8.090631 16.92266 5.897409 0.3218441      10.01188 
1 1 1 10  31 30 o 13.52486 5.491791 2.305787       2.828418 -4.995310      7.764616 3.422811       3.037086 13.73163 6.741680 15.06559 5.823787 -1.333966      8.908801 
1 1 1 10  32 0  o 42.10922 4.499362 22.06349       4.545584 19.80664       5.577144 26.52918       7.845226 39.54954 5.972696 45.53162 7.318551 -5.982079      9.446390 
1 1 1 10  32 1  o 23.76162 6.282976 7.268726       3.693088 8.857827       4.577663 4.306276       6.250197 26.18240 7.028047 21.89025 8.382300 4.292152       10.93876 
1 1 1 10  32 2  o 78.91753 3.368515 76.47756       6.463206 74.21998       8.260781 80.04066       10.37798 77.53139 4.390214 80.27689 5.335288 -2.745491      6.909362 
1 1 1 10  32 3  o 168.0557 3.556281 346.5247       14.56416 343.3193       19.51053 350.5587       21.88746 166.7329 4.806901 168.2174 5.346139 -1.484436      7.189402 
1 1 1 10  32 4  o 46.73436 3.708566 26.98797       4.188951 31.97963       5.738691 21.29485       6.128660 50.69974 4.698284 40.88149 6.358420 9.818253       7.905908 
1 1 1 10  32 5  o 56.39087 3.431285 39.16633       4.692899 50.42960       6.649957 27.99201       6.623645 63.83323 4.300089 47.08769 5.901634 16.74553       7.302058 
1 1 1 10  32 6  o 25.30311 6.958689 8.303959       4.424083 13.03267       7.218304 5.458932       5.598956 31.44713 8.976677 22.32811 8.048037 9.119013       12.05619 
1 1 1 10  32 7  o 77.03883 3.491149 73.08194       6.537086 76.34623       11.99975 71.70436       7.795361 77.80712 6.384851 76.12408 4.218711 1.683037       7.652702 
1 1 1 10  32 8  o 62.41679 3.761345 48.14686       5.694568 76.30067       11.02222 37.89576       6.650979 77.92617 5.846933 55.03111 5.014564 22.89506       7.702757 
1 1 1 10  32 9  o 55.06501 2.914907 37.30523       3.897505 36.11211       5.582458 38.43987       5.443960 53.87214 4.287663 55.65445 4.041553 -1.782307      5.892216 
1 1 1 10  32 10 o 31.82022 5.402909 12.98032       4.039872 11.96376       7.355182 13.41948       4.834379 30.01503 9.192285 32.08471 6.407540 -2.069685      11.20512 
1 1 1 10  32 11 o 110.2086 3.126199 149.5356       8.387436 155.3475       16.73180 147.5850       9.693309 110.6592 6.229833 109.2844 3.644902 1.374756       7.217765 
1 1 1 10  32 12 o 54.57629 3.408540 36.89231       4.510605 38.98693       8.873260 36.16245       5.237834 54.84650 6.783370 53.86111 4.019605 0.9853821      7.884880 
1 1 1 10  32 13 o 60.76905 3.357318 45.75064       4.952449 31.09236       9.761227 50.83184       5.747069 47.78503 8.703096 63.95222 3.703536 -16.16720      9.458333 
1 1 1 10  32 14 o 62.22800 3.151495 47.94016       4.763456 51.00567       9.642892 46.95064       5.478577 62.69701 6.401094 61.40554 3.678062 1.291470       7.382557 
1 1 1 10  32 15 o 32.81763 4.480763 13.75310       3.489911 17.06008       7.370808 12.79751       3.962179 34.79792 8.712638 31.32833 5.383906 3.469589       10.24190 
1 1 1 10  32 16 o 25.11247 5.109743 8.292098       3.020459 16.69746       6.822206 6.242795       3.368603 34.42982 8.241012 21.61358 6.119916 12.81624       10.26487 
1 1 1 10  32 17 o 37.53032 3.626136 17.76183       3.275111 20.66967       7.322262 17.03459       3.661824 38.21335 8.114118 36.54362 4.187516 1.669731       9.130947 
1 1 1 10  32 18 o 15.57896 5.515729 2.871506       2.617962 0.9138155      5.948651 3.341755       2.915480 17.61309 7.601490 16.59935 5.825537 1.013742       9.577031 
1 1 1 10  32 19 o 37.87426 3.931025 18.35352       3.575450 0.000000       0.000000 18.35352       3.575450 ?        ?        37.87426 3.931025 0.000000       3.931025 
1 1 1 10  32 20 o 18.21191 5.691586 4.486837       2.803258 0.000000       0.000000 4.486837       2.803258 ?        ?        18.21191 5.691586 0.000000       5.691586 
1 1 1 10  32 21 o 20.71129 5.156239 5.915156       2.592263 0.4589491      6.251729 7.048034       2.848697 17.02296 7.555185 22.58505 5.272298 -5.562084      9.212923 
1 1 1 10  32 22 o 16.94829 5.535861 3.921592       2.629538 13.83284       6.627697 2.069998       2.864649 28.89787 8.700489 14.29656 5.618731 14.60131       10.35706 
1 1 1 10  32 23 o 20.05044 5.446984 5.733335       2.729972 13.09549       7.947108 4.748333       2.906866 26.80257 9.597215 18.27073 5.807363 8.531836       11.21749 
1 1 1 10  32 24 o 24.02698 5.137853 8.171263       2.917173 14.01907       8.737279 7.437603       3.094760 26.52891 9.967487 22.58844 5.639796 3.940475       11.45243 
1 1 1 10  32 25 o 15.03750 5.740600 2.856275       2.925557 -0.8529072     7.595569 3.502398       3.170142 16.42419 7.672453 16.08246 6.011923 0.3417320      9.747294 
1 1 1 10  32 26 f 22.94000 5.555618 7.906409       3.072374 10.00542       9.186436 7.642056       3.260109 21.95224 9.460056 22.25961 5.911272 -0.3073616     11.15508 
1 1 1 10  32 27 o 19.89348 5.702365 6.186191       2.906931 15.58260       9.096549 5.117479       3.067792 24.63150 9.903235 17.99088 5.984173 6.640627       11.57084 
1 1 1 10  32 28 o 15.51176 5.702357 3.623254       2.830393 10.30059       8.006453 2.669592       3.025770 20.91487 8.918311 14.29435 5.723784 6.620520       10.59707 
1 1 1 10  32 29 o 12.79157 5.353114 1.706850       2.797480 -4.251253      8.244827 2.482020       2.973898 14.26360 6.991414 13.85597 5.629405 0.4076309      8.976083 
1 1 1 10  33 0  o 25.04209 5.919491 8.119181       3.554936 6.792617       4.676938 9.934277       5.470757 23.29789 7.361491 27.61587 7.792109 -4.317974      10.71954 
1 1 1 10  33 1  o 55.98449 4.300711 38.88172       5.822446 36.32119       6.342223 52.61026       14.68548 53.96007 4.875726 63.07103 9.878882 -9.110962      11.01658 
1 1 1 10  33 2  o 133.6336 3.795604 219.9369       12.34789 223.6147       14.43438 209.9019       23.84284 134.4969 4.409989 128.4673 7.650699 6.029633       8.830696 
1 1 1 10  33 3  o 67.49998 5.820445 57.26059       9.480629 0.000000       0.000000 57.26059       9.480629 ?        ?        67.49998 5.820445 0.000000       5.820445 
1 1 1 10  33 4  o 60.61023 4.400155 45.64360       6.454793 54.68964       9.639409 38.29005       8.690995 65.82658 6.077742 54.79202 6.644653 11.03456       9.005018 
1 1 1 10  33 5  o 91.31204 2.975982 102.4174       6.613236 107.0744       9.485332 98.01234       9.225149 93.00079 4.196139 88.94573 4.268563 4.055061       5.985668 
1 1 1 10  33 6  o 67.08208 3.368416 55.49089       5.488789 54.51553       6.845491 57.24685       9.185059 66.25189 4.262662 67.42725 5.641650 -1.175362      7.070962 
1 1 1 10  33 7  f 85.92783 2.906786 90.75320       6.077952 93.67339       8.651453 87.90734       8.540663 86.93233 4.095380 84.17975 4.176438 2.752586       5.849339 
1 1 1 10  33 8  o 35.56330 5.024276 16.07565       4.233086 19.14406       7.805901 14.79737       5.038253 37.60063 8.692875 33.69028 6.370073 3.910351       10.77701 
1 1 1 10  33 9  o 41.18333 4.277514 21.27979       4.230423 32.14278       8.476747 17.67686       4.881824 49.57061 7.230071 37.11236 5.569666 12.45825       9.126616 
1 1 1 10  33 10 o 58.28654 3.623451 42.18267       5.121223 50.52335       9.879128 39.11766       5.988717 62.54104 6.580616 55.85943 4.435880 6.681614       7.936091 
1 1 1 10  33 11 o 29.44845 5.381747 11.26045       3.719814 12.36547       6.854376 10.79915       4.428709 29.99800 8.803229 28.48888 6.520457 1.509121       10.95505 
1 1 1 10  33 12 f 70.87627 3.191195 62.20836       5.497623 62.94386       10.88426 61.95645       6.369906 69.58331 6.493847 70.53005 3.719294 -0.9467468     7.483529 
1 1 1 10  33 13 o 10.95464 5.036511 -2.061180      3.082446 -5.759314      5.571637 -0.4300284     3.700315 13.46194 6.375382 13.53092 5.915629 -0.6897926E-01 8.697136 
1 1 1 10  33 14 o 22.37888 5.853184 6.699662       3.227809 9.649745       6.300243 5.649725       3.758563 26.44020 8.564058 20.76696 6.603871 5.673237       10.81454 
1 1 1 10  33 15 o 38.75477 3.816990 18.99092       3.558072 22.08307       7.177703 17.98355       4.096862 39.83723 7.671982 37.40381 4.590851 2.433426       8.940650 
1 1 1 10  33 16 o 22.93234 5.525326 7.093130       3.051032 7.407920       6.507246 7.004427       3.454250 23.68385 8.656094 22.64673 6.116430 1.037119       10.59899 
1 1 1 10  33 17 o 30.58138 4.935789 12.33958       3.553110 0.000000       0.000000 12.33958       3.553110 ?        ?        30.58138 4.935789 0.000000       4.935789 
1 1 1 10  33 18 o 10.31388 4.635880 -0.8751046     2.433904 -7.069581      6.489776 0.1387675      2.625542 13.84332 6.644756 11.76857 5.064330 2.074749       8.354652 
1 1 1 10  33 19 o 15.01444 5.289800 2.780657       2.405551 -4.311487      5.668183 4.338644       2.656667 13.76348 6.491702 17.85993 5.534341 -4.096445      8.530600 
1 1 1 10  33 20 o 10.74854 4.717152 -0.2064734     2.372903 -5.187936      6.224566 0.6405553      2.566727 13.96485 6.649396 12.08921 5.097514 1.875640       8.378492 
1 1 1 10  33 21 o 12.58629 5.100390 1.266677       2.433948 4.471011       6.138438 0.6689126      2.651271 19.44589 8.015295 12.21065 5.166352 7.235237       9.536045 
1 1 1 10  33 22 o 15.55705 5.534714 3.173279       2.638836 -0.5716519     7.082600 3.776932       2.843573 16.67717 7.655342 16.62352 5.758428 0.5364227E-01  9.579340 
1 1 1 10  33 23 o 23.52223 5.161371 7.875631       2.877118 11.63537       7.717849 7.268808       3.100621 24.81568 9.358416 22.24431 5.695888 2.571363       10.95550 
1 1 1 10  33 24 o 19.48180 5.775082 5.710269       2.937522 -6.232719      6.889810 8.363599       3.247479 13.64854 6.623084 23.67934 5.697338 -10.03080      8.736413 
1 1 1 10  33 25 o 19.36275 5.779960 5.766281       2.934402 11.39705       7.945532 4.876987       3.157633 23.08499 9.264482 17.81314 6.071743 5.271852       11.07685 
1 1 1 10  33 26 o 12.59023 5.214219 1.491516       2.614521 3.196278       7.442369 1.251505       2.792510 17.29887 7.905633 12.53113 5.302073 4.767745       9.518981 
1 1 1 10  33 27 o 18.86311 5.676459 5.676225       2.821683 16.93197       9.063262 4.468135       2.969251 24.68932 9.899369 16.78371 5.879860 7.905615       11.51392 
1 1 1 10  33 28 o 16.62412 5.725834 4.457763       2.809924 1.848892       7.936829 4.831624       3.004521 16.13759 7.632617 17.12851 5.919852 -0.9909191     9.659270 
1 1 1 10  34 0  o 66.90307 3.207134 55.13313       5.213539 56.29681       7.263306 53.89635       7.487939 67.27310 4.455647 65.73942 4.705240 1.533684       6.480129 
1 1 1 10  34 1  o 89.79607 3.286925 99.29636       7.180420 96.70814       9.136215 103.4780       11.61286 88.30052 4.258426 90.92847 5.263363 -2.627953      6.770317 
1 1 1 10  34 2  o 12.02337 5.319456 -0.8846987     3.075228 -2.041495      3.989733 0.8085290      4.826953 12.96661 5.871800 16.68835 7.010889 -3.721749      9.144977 
1 1 1 10  34 3  o 26.90361 5.795282 9.422248       3.687147 12.12749       4.658030 4.882987       6.033810 30.42327 6.481447 21.91754 8.272633 8.505730       10.50931 
1 1 1 10  34 4  o 61.87647 3.322006 47.28868       4.990764 56.17318       6.910545 37.60322       7.215328 67.17873 4.242958 54.49240 5.509141 12.68634       6.953656 
1 1 1 10  34 5  o 19.10106 5.963946 4.602439       3.078713 7.519734       4.361436 1.705070       4.346517 23.96550 7.019258 16.75641 6.806448 7.209084       9.777409 
1 1 1 10  34 6  o 34.22666 4.208709 14.75844       3.436517 18.70134       4.907093 10.96343       4.814178 38.21778 5.420853 28.69325 6.957719 9.524527       8.820176 
1 1 1 10  34 7  o 62.45224 3.294877 48.26138       4.996709 45.49821       8.263825 49.85376       6.273391 59.70717 5.750663 63.21700 4.094252 -3.509830      7.059250 
1 1 1 10  34 8  o 92.01660 3.073652 104.5170       6.882512 99.94728       8.782579 111.7894       11.07945 89.56267 4.034366 94.27930 4.838611 -4.716637      6.299862 
1 1 1 10  34 9  o 122.9310 2.863285 186.2171       8.577529 171.4289       12.12010 201.0559       12.14084 117.0884 4.254798 127.0542 3.925952 -9.965752      5.789336 
1 1 1 10  34 10 o 18.34526 6.393877 4.016723       3.508413 3.607216       6.345152 4.197054       4.210622 20.63546 8.279873 19.19044 6.970670 1.445023       10.82343 
1 1 1 10  34 11 o 75.59402 3.314318 71.01435       6.090611 90.26679       12.36744 64.85008       6.998060 83.34712 6.132028 71.90636 4.009568 11.44076       7.326554 
1 1 1 10  34 12 o 15.22285 5.991005 1.964733       3.260725 5.584560       5.809732 0.3001097      3.939763 21.80964 8.141494 14.52942 6.227214 7.280211       10.24998 
1 1 1 10  34 13 o 18.35838 6.147112 4.279282       3.236220 0.9428242      6.152697 5.555390       3.805104 18.01726 7.752927 20.52783 6.656071 -2.510571      10.21818 
1 1 1 10  34 14 o 32.13146 4.660082 13.42239       3.542525 10.57290       6.988948 14.40761       4.109566 26.99112 9.033477 33.03053 5.283558 -6.039408      10.46517 
1 1 1 10  34 15 o 18.53496 6.379882 4.411810       3.488343 0.000000       0.000000 4.411810       3.488343 ?        ?        18.53496 6.379882 0.000000       6.379882 
1 1 1 10  34 16 o 24.79203 5.299006 8.338129       3.104331 8.162263       6.284006 8.394903       3.570416 23.87119 8.535678 24.57409 6.012305 -0.7028961     10.44058 
1 1 1 10  34 17 o 21.20681 5.522613 6.226382       2.881749 15.28178       6.559784 4.060866       3.207868 31.44496 8.400908 17.63462 6.115780 13.81034       10.39125 
1 1 1 10  34 18 o 44.58179 3.369936 25.33101       3.634020 36.41734       8.872432 23.09626       3.983485 49.54501 7.590047 42.23764 3.914688 7.307365       8.540117 
1 1 1 10  34 19 o 49.99693 3.825978 32.37098       4.626047 40.36716       9.990702 30.18869       5.219269 50.79998 8.361052 47.70438 4.544522 3.095600       9.516294 
1 1 1 10  34 20 o 14.82857 5.400064 2.732861       2.529182 9.713317       6.549618 1.509535       2.741860 24.15671 8.704853 13.33416 5.409768 10.82254       10.24891 
1 1 1 10  34 21 o 14.09008 5.449533 2.222117       2.660308 9.470695       7.094200 1.036003       2.869724 23.39680 8.937479 12.86579 5.405427 10.53101       10.44496 
1 1 1 10  34 22 o 28.39544 4.987569 11.33875       3.325360 16.36409       8.270588 10.36969       3.631857 28.36941 9.820980 26.52696 5.781913 1.842449       11.39659 
1 1 1 10  34 23 o 24.72777 5.071654 8.804605       2.953490 21.80919       8.223937 6.878952       3.164613 32.93577 9.636466 21.21251 5.905361 11.72326       11.30198 
1 1 1 10  34 24 o 24.04600 5.351548 8.620445       3.055108 14.73417       8.420566 7.693672       3.278501 25.12147 9.700917 22.18362 5.944647 2.937847       11.37746 
1 1 1 10  34 25 o 15.18833 5.604347 3.329292       2.738199 2.746094       7.522049 3.418378       2.939905 17.05651 7.851314 15.38429 5.781475 1.672221       9.750312 
1 1 1 10  34 26 o 16.77187 5.793906 4.457650       2.877907 26.29880       9.175198 2.074364       3.030859 32.22502 10.32568 13.57249 5.616890 18.65253       11.75454 
1 1 1 10  34 27 o 13.38581 5.370140 2.265941       2.668665 3.369149       8.560349 2.147182       2.808633 16.95010 7.989524 13.34625 5.452537 3.603854       9.672779 
1 1 1 10  35 0  o 39.05030 4.070393 19.11534       3.816645 19.83235       4.926908 18.03944       6.035304 39.42768 5.258895 36.97604 6.953120 2.451633       8.717904 
1 1 1 10  35 1  o 32.26531 5.750452 13.51263       4.355590 14.82064       6.935354 12.66072       5.597067 32.91894 8.564844 30.67966 7.540748 2.239281       11.41137 
1 1 1 10  35 2  o 74.17078 3.012650 67.85519       5.433915 75.21445       7.815756 60.96959       7.560054 77.68237 4.143683 69.78864 4.468812 7.893738       6.094292 
1 1 1 10  35 3  o 80.24090 3.000887 79.42609       5.857545 87.49992       8.565764 72.33421       8.028002 83.73550 4.211305 76.05424 4.349735 7.681259       6.054361 
1 1 1 10  35 4  o 25.79881 5.378433 8.697691       3.271635 9.862349       4.572904 7.476472       4.682629 27.12143 6.902665 23.82882 7.341295 3.292606       10.07677 
1 1 1 10  35 5  o 103.1972 3.216985 131.7101       8.080206 134.4824       10.55270 127.7812       12.56256 103.7519 4.182369 100.4936 5.146982 3.258232       6.632016 
1 1 1 10  35 6  o 12.53030 5.256965 0.4556481      2.708247 2.871572       3.468097 -3.320075      4.335605 16.76087 6.283468 12.65333 5.872269 4.107541       8.600321 
1 1 1 10  35 7  o 24.85096 5.039121 8.072921       2.947098 6.452666       3.825118 10.43959       4.622978 22.07026 6.601743 27.76202 6.870844 -5.691761      9.528458 
1 1 1 10  35 8  o 35.37254 3.978093 15.82231       3.369701 17.22351       4.721009 14.36705       4.811226 36.35630 5.500395 32.84616 6.238905 3.510139       8.317348 
1 1 1 10  35 9  o 72.15137 2.875208 64.46564       5.045212 71.74346       7.193472 57.41972       7.077945 75.60948 3.917507 67.40005 4.332283 8.209435       5.840851 
1 1 1 10  35 10 o 78.36748 4.702435 78.30103       8.939073 70.18825       11.66632 89.83689       13.91149 72.58432 6.670132 81.77442 7.049803 -9.190102      9.705173 
1 1 1 10  35 11 o 26.17030 6.170423 9.338721       3.870613 8.360979       7.169421 9.740934       4.598329 24.94248 9.090520 26.43510 7.020601 -1.492626      11.48592 
1 1 1 10  35 12 o 40.10858 5.049214 21.02600       4.825994 0.000000       0.000000 21.02600       4.825994 ?        ?        40.10858 5.049214 0.000000       5.049214 
1 1 1 10  35 13 o 23.45138 6.776706 7.723652       4.089839 0.000000       0.000000 7.723652       4.089839 ?        ?        23.45138 6.776706 0.000000       6.776706 
1 1 1 10  35 14 o 21.19306 6.094391 6.239661       3.315280 12.85650       7.030016 4.347230       3.759595 28.74602 9.017546 18.47002 6.602468 10.27600       11.17626 
1 1 1 10  35 15 o 12.12706 5.246253 0.1165113      2.846810 -0.9591830     5.655674 0.4815419      3.294614 15.59408 7.032959 13.28938 5.695131 2.304707       9.049699 
1 1 1 10  35 16 o 53.38431 3.340278 36.21933       4.323649 44.48225       9.560607 34.09495       4.847692 55.24942 7.277851 51.40830 3.898664 3.841118       8.256312 
1 1 1 10  35 17 o 20.88198 5.872452 6.219758       3.112631 18.07122       7.871439 4.023084       3.388839 32.55580 9.399531 17.46556 6.265525 15.09024       11.29637 
1 1 1 10  35 18 f 51.81126 4.023668 35.08691       5.040423 52.48803       10.68301 30.10396       5.716733 58.69464 7.650867 47.06081 5.064476 11.63384       9.175220 
1 1 1 10  35 19 o 11.62711 5.033456 0.2541131      2.624187 4.088934       5.999228 -0.6532399     2.918172 18.77388 7.846662 11.30310 5.078700 7.470786       9.346833 
1 1 1 10  35 20 o 17.20317 5.941358 4.205686       3.026177 23.41156       8.720376 1.576147       3.226696 35.09847 9.814615 13.89233 5.776415 21.20613       11.38831 
1 1 1 10  35 21 o 16.57433 5.787189 3.923478       2.874938 -1.670148      7.235379 4.972188       3.132868 15.75997 7.402534 18.22770 6.046831 -2.467732      9.558330 
1 1 1 10  35 22 o 22.54297 5.495974 7.598514       2.991476 8.077682       7.678139 7.512761       3.248144 20.94260 8.822782 22.08646 5.916374 -1.143860      10.62285 
1 1 1 10  35 23 o 12.33237 5.196527 1.168810       2.664512 -10.33678      7.600274 2.781090       2.845083 12.79950 6.354187 14.56007 5.634445 -1.760571      8.492507 
1 1 1 10  35 24 o 24.06479 5.319746 8.763834       3.036622 30.75843       10.02781 6.543309       3.186222 35.24694 10.72123 20.11059 6.027496 15.13635       12.29941 
1 1 1 10  35 25 o 12.75983 5.307686 1.646984       2.725872 0.7501971      8.198903 1.758429       2.890287 16.11272 7.660543 13.06126 5.451769 3.051459       9.402431 
1 1 1 10  36 0  o 85.14584 3.045859 89.64076       6.309706 93.41656       8.888071 85.80456       8.958895 86.34048 4.237263 82.61262 4.466735 3.727867       6.156795 
1 1 1 10  36 1  o 69.52097 3.181437 59.90074       5.375546 69.99557       7.699902 50.30264       7.508070 74.67993 4.248548 62.94378 4.934264 11.73615       6.511308 
1 1 1 10  36 2  o 17.82889 6.197634 3.793142       3.295229 3.362522       4.166821 4.512085       5.383999 18.12475 6.867073 20.56127 7.802266 -2.436516      10.39385 
1 1 1 10  36 3  o 66.22401 3.450694 54.59502       5.549543 53.71399       6.931827 56.16772       9.261369 65.26408 4.383933 65.91032 5.826078 -0.6462402     7.291232 
1 1 1 10  36 4  o 47.34722 3.569655 28.04729       4.088333 37.52354       5.890183 19.23793       5.679142 54.41666 4.481504 38.05658 6.347160 16.36008       7.769834 
1 1 1 10  36 5  o 14.74478 5.663178 2.036489       2.858742 5.143693       3.840603 -1.823957      4.280882 20.06011 6.696193 13.44057 6.084763 6.619548       9.047836 
1 1 1 10  36 6  o 58.42104 4.971961 43.79078       7.011177 0.000000       0.000000 43.79078       7.011177 ?        ?        58.42104 4.971961 0.000000       4.971961 
1 1 1 10  36 7  o 49.97945 3.677642 31.41709       4.447798 36.99188       5.682869 22.60277       7.145749 53.92225 4.361981 40.36207 7.542301 13.56018       8.712817 
1 1 1 10  36 8  o 31.49858 4.270043 12.75986       3.193297 11.86181       4.393430 13.76562       4.649444 29.49948 6.302935 31.88178 6.207776 -2.382301      8.846664 
1 1 1 10  36 9  o 17.06979 6.157749 3.448273       3.278523 2.377286       4.736256 4.433579       4.542853 17.39079 7.089777 19.36595 7.205169 -1.975164      10.10838 
1 1 1 10  36 10 f 19.19402 7.108998 4.449887       4.413128 0.000000       0.000000 4.449887       4.413128 ?        ?        19.19402 7.108998 0.000000       7.108998 
1 1 1 10  36 11 f 76.26146 4.838475 75.65552       8.945499 62.75273       11.68763 93.90454       13.89967 66.82414 7.295605 82.24763 7.001470 -15.42349      10.11170 
1 1 1 10  36 12 o 25.64707 6.799928 9.443456       4.318365 13.60637       6.799957 6.629828       5.590371 29.55946 8.792624 21.96842 8.024068 7.591038       11.90361 
1 1 1 10  36 13 o 46.59024 3.839094 27.88549       4.320085 31.91675       8.249459 26.36220       5.071031 46.77707 7.489548 44.71056 4.725680 2.066513       8.855811 
1 1 1 10  36 14 o 13.91915 5.788727 1.247355       3.241399 8.637671       6.679654 -1.028958      3.707136 23.77400 8.756590 12.60270 5.687979 11.17130       10.44179 
1 1 1 10  36 15 o 30.50913 4.924577 12.60968       3.536650 15.09806       7.661963 11.93596       3.986773 29.66903 9.428140 29.10600 5.824334 0.5630226      11.08209 
1 1 1 10  36 16 o 18.05524 6.201146 4.524560       3.295070 7.439203       7.674180 3.865762       3.648507 22.37123 9.059843 17.30550 6.453480 5.065727       11.12332 
1 1 1 10  36 17 o 30.81580 5.350166 13.29196       3.872032 29.00545       8.391667 9.041595       4.364402 42.21683 8.452004 24.20319 7.002444 18.01364       10.97591 
1 1 1 10  36 18 o 11.00704 5.044796 -1.273637      3.059732 1.925541       7.003368 -2.028341      3.401544 17.75156 7.929964 11.09557 5.166966 6.655986       9.464769 
1 1 1 10  36 19 o 17.29278 5.983232 4.326311       3.069545 10.31131       8.837239 3.505175       3.273348 23.14014 9.585139 16.18810 6.096883 6.952036       11.35988 
1 1 1 10  36 20 o 27.85466 6.095608 11.82181       4.022429 14.68494       8.680370 11.03888       4.539207 25.77698 9.876431 25.97510 7.009847 -0.1981201     12.11123 
1 1 1 10  36 21 o 26.76270 5.119270 10.43264       3.217062 15.42131       8.842566 9.671597       3.453743 25.45018 9.909752 25.19394 5.752310 0.2562370      11.45828 
1 1 1 10  36 22 o 11.90784 5.148234 0.7180765      2.738050 10.48184       8.037014 -0.5639270     2.912264 21.77256 9.089697 10.98907 4.992267 10.78349       10.37041 
1 1 1 10  36 23 o 15.14885 5.711399 3.318822       2.874172 18.30982       8.951208 1.595568       3.034876 26.20922 10.03251 13.11914 5.537947 13.09008       11.45950 
1 1 1 10  36 24 o 12.19424 5.231283 1.086223       2.785194 7.504425       9.126963 0.4271657      2.924700 19.08149 8.733301 11.72310 5.187073 7.358388       10.15757 
1 1 1 10  37 0  o 28.16840 5.177052 10.43655       3.422784 12.62100       4.561419 7.621496       5.178113 30.55642 6.333970 23.72729 7.769516 6.829132       10.02420 
1 1 1 10  37 1  o 14.04455 5.796100 1.058834       3.215183 3.007466       4.241110 -1.574475      4.930212 17.62430 6.862858 14.62971 6.584996 2.994593       9.511099 
1 1 1 10  37 2  o 47.70361 3.500962 28.55664       4.041471 26.50978       5.388059 31.18959       6.110958 45.29789 4.962220 49.04330 5.191958 -3.745407      7.181926 
1 1 1 10  37 3  o 61.48976 3.883125 47.69537       5.788907 45.68311       6.591129 54.48521       12.10732 59.79182 4.557925 62.34885 8.164606 -2.557030      9.350694 
1 1 1 10  37 4  o 14.00005 5.579060 1.546969       2.860807 5.478229       4.103745 -2.169806      3.990227 20.46196 6.922519 12.58278 5.764771 7.879174       9.008543 
1 1 1 10  37 5  o 17.83767 6.123355 4.007487       3.212802 1.440395       5.124929 5.669539       4.123724 17.02384 7.191895 20.67630 6.939202 -3.652452      9.993792 
1 1 1 10  37 6  o 41.22483 4.260654 21.82128       4.218665 28.87093       7.097555 17.97012       5.245906 46.04336 6.506793 36.40199 6.131361 9.641365       8.940466 
1 1 1 10  37 7  o 35.75226 4.616751 16.65885       3.928506 18.39046       6.378345 15.60048       4.986591 35.80697 7.548053 33.67760 6.307867 2.129368       9.836783 
1 1 1 10  37 8  o 12.77497 5.371766 0.6631998      2.837812 6.458729       4.022195 -5.081185      4.004409 21.52975 6.829788 10.82779 5.203092 10.70195       8.585929 
1 1 1 10  37 9  o 54.87376 3.331697 38.02809       4.434198 38.60685       5.978795 37.32057       6.610487 54.48169 4.544615 53.07142 5.177108 1.410267       6.888830 
1 1 1 10  37 10 o 34.67783 4.606968 15.85969       3.796945 21.31906       6.718861 13.29815       4.602300 38.14238 7.495984 30.68851 6.363101 7.453867       9.832540 
1 1 1 10  37 11 o 29.57472 5.269013 11.91811       3.658146 18.86233       7.907960 10.02756       4.126169 33.93930 9.291488 26.40160 6.465670 7.537699       11.31975 
1 1 1 10  37 12 o 26.91391 5.842236 10.20136       3.721543 13.67396       7.081757 8.876472       4.374238 28.77339 9.054102 24.45017 6.990713 4.323214       11.43883 
1 1 1 10  37 13 f 24.16280 6.911261 8.728211       4.274557 14.55341       7.351846 5.753264       5.253886 29.25516 9.227757 20.36662 7.712233 8.888540       12.02622 
1 1 1 10  37 14 o 13.59549 5.864263 0.6422263      3.536472 3.119651       5.899088 -0.7476622     4.418498 18.19578 7.702873 13.75934 6.209912 4.436440       9.894304 
1 1 1 10  37 15 o 19.12297 6.482087 5.306633       3.598271 3.634285       6.709537 5.981799       4.263189 18.92954 8.120055 20.07663 7.044577 -1.147093      10.74995 
1 1 1 10  37 16 o 20.37526 6.504231 6.281088       3.643173 12.44031       6.881931 3.882916       4.294254 26.22119 8.963116 17.41662 6.868810 8.804573       11.29239 
1 1 1 10  37 17 o 18.30004 6.190197 4.964158       3.281409 14.85039       7.875036 2.886999       3.609708 27.33606 9.575757 15.68267 6.261147 11.65339       11.44103 
1 1 1 10  37 18 f 12.26637 5.341780 0.4747451      2.991882 5.638561       7.637604 -0.4612941     3.251763 19.69502 8.556252 11.84250 5.337628 7.852523       10.08463 
1 1 1 10  37 19 o 14.30462 5.738312 2.363047       3.046888 3.602244       7.436184 2.113030       3.340142 18.05881 8.111265 14.28877 5.903321 3.770042       10.03204 
1 1 1 10  37 20 o 38.08618 4.175909 19.94132       3.812262 33.90193       10.20332 17.67623       4.109910 39.02588 10.50009 35.07724 4.945126 3.948635       11.60630 
1 1 1 10  37 21 o 24.88059 5.594781 9.504827       3.309621 14.47607       9.087179 8.744557       3.553696 23.70600 9.759803 23.26647 6.168493 0.4395237      11.54574 
1 1 1 10  37 22 o 17.14814 6.617643 4.757296       3.916681 10.66629       7.993069 2.890178       4.493065 21.31011 8.991071 15.47993 6.642648 5.830182       11.17874 
1 1 1 10  38 0  o 22.53134 7.588804 7.003495       4.931686 0.000000       0.000000 7.003495       4.931686 ?        ?        22.53134 7.588804 0.000000       7.588804 
1 1 1 10  38 1  o 48.25409 5.443963 30.81435       6.289937 0.000000       0.000000 30.81435       6.289937 ?        ?        48.25409 5.443963 0.000000       5.443963 
1 1 1 10  38 2  o 30.90997 7.307327 13.70089       5.416807 25.31863       7.841289 3.095937       7.491707 41.78408 7.992008 20.42574 8.665212 21.35835       11.78805 
1 1 1 10  38 3  o 31.09415 4.931598 12.80287       3.612246 17.22968       5.050035 8.165016       5.169017 35.51553 6.051759 23.84728 7.759701 11.66825       9.840567 
1 1 1 10  38 4  o 26.63126 5.387259 9.622137       3.375962 13.10322       4.614340 5.612611       4.952209 30.62485 6.389949 20.68097 7.552456 9.943888       9.892980 
1 1 1 10  38 5  o 17.14213 5.882117 3.789619       2.964557 1.253391       4.030996 6.777407       4.375152 15.19575 6.396693 21.88900 7.140140 -6.693254      9.586411 
1 1 1 10  38 6  o 16.85400 5.841496 3.647211       2.926382 7.440940       4.179856 -0.1067165E-03 4.098406 22.74513 6.922527 14.14640 6.204126 8.598726       9.295836 
1 1 1 10  38 7  o 28.73866 4.718955 11.01072       3.190221 14.15345       4.594754 8.085488       4.432905 31.79178 6.153210 23.51536 7.123247 8.276426       9.412897 
1 1 1 10  38 8  o 28.99405 4.424398 11.12183       3.027213 17.96158       4.365093 4.784179       4.201824 36.59463 5.027608 19.05026 6.956798 17.54437       8.583348 
1 1 1 10  38 9  o 17.73465 5.734798 4.293634       2.825812 6.878802       4.056360 1.856098       3.938834 21.74031 6.853944 15.47323 6.403320 6.267079       9.379716 
1 1 1 10  38 10 o 20.10064 6.158263 5.767692       3.300737 -0.6623167     5.569029 9.249641       4.098123 15.43179 6.967563 25.08404 6.611920 -9.652249      9.605436 
1 1 1 10  38 11 o 35.32314 5.379693 17.21596       4.484743 29.92554       8.056738 11.50976       5.398424 44.24321 7.755249 27.03584 7.777558 17.20737       10.98336 
1 1 1 10  38 12 o 14.66822 6.271087 1.189814       3.977362 13.38112       7.152534 -4.267538      4.785484 27.68564 9.134805 12.24239 5.829539 15.44325       10.83643 
1 1 1 10  38 13 o 21.08804 6.931127 6.785988       4.119285 28.26980       8.018170 -0.9174879     4.801346 41.91177 8.144117 14.02730 6.387164 27.88446       10.35000 
1 1 1 10  38 14 o 30.74041 5.238231 13.30489       3.783454 17.66294       8.013217 12.05464       4.291980 30.43682 9.638172 28.32456 6.372722 2.112261       11.55448 
1 1 1 10  38 15 o 12.75726 5.782629 -0.6477125     3.880832 1.711785       6.751704 -1.811888      4.742561 17.21696 7.731384 13.19960 6.131234 4.017364       9.867437 
1 1 1 10  38 16 o 15.43370 6.440949 2.457914       4.033286 -4.027734      7.163359 5.468349       4.880391 14.67691 7.027935 18.88692 7.359832 -4.210011      10.17639 
1 1 1 10  38 17 o 16.10146 6.600145 3.213120       4.132485 8.041873       8.255752 1.598736       4.773561 20.91194 8.989394 15.19795 6.679515 5.713988       11.19934 
1 1 1 10  38 18 o 13.56956 5.678547 1.697819       3.147831 2.643110       7.900356 1.519427       3.432025 17.59121 8.078714 13.69644 5.839604 3.894776       9.968280 
1 1 1 10  38 19 o 16.18036 6.155718 3.855540       3.356657 20.75193       9.120176 1.208164       3.610058 28.76843 10.28346 13.49114 5.871540 15.27729       11.84165 
1 1 1 10  38 20 o 15.28541 5.908503 3.317036       3.125987 16.88572       8.344675 1.102094       3.371489 26.01737 9.748151 13.03620 5.673870 12.98117       11.27915 
1 1 1 10  39 0  o 25.92473 5.541441 9.247205       3.394697 7.515199       4.539500 11.44465       5.113194 22.78867 7.258815 27.81881 7.410149 -5.030140      10.37308 
1 1 1 10  39 1  f 32.78383 4.656280 14.21577       3.615429 19.39553       5.219375 9.437802       5.012853 37.56274 5.895923 25.18516 7.563076 12.37758       9.589683 
1 1 1 10  39 2  o 11.89656 5.498760 -2.200089      3.744549 8.543878       6.611519 -7.274032      4.543513 23.93467 8.728676 10.75618 5.254774 13.17848       10.18835 
1 1 1 10  39 3  o 14.07821 5.797139 1.390777       3.206890 2.916687       4.328914 -0.4651693     4.774162 17.06408 6.841697 14.70539 6.559739 2.358693       9.478343 
1 1 1 10  39 4  o 20.10595 5.787388 5.661142       2.988309 8.166937       4.507594 3.696275       3.991523 23.50855 7.195467 17.59264 6.707952 5.915907       9.837244 
1 1 1 10  39 5  o 20.89042 5.809329 6.156158       3.064349 7.720753       4.438561 4.731225       4.235831 22.85164 7.164785 18.94189 6.973757 3.909746       9.998371 
1 1 1 10  39 6  o 17.03201 5.933656 3.831311       3.021356 7.612181       4.225682 -0.1231848     4.321619 22.67972 6.971504 14.21036 6.295558 8.469367       9.393397 
1 1 1 10  39 7  f 27.30899 4.809717 10.11295       3.083946 11.89707       4.539467 8.583727       4.202694 28.44584 6.665759 23.99413 6.849662 4.451710       9.557730 
1 1 1 10  39 8  o 9.108930 4.288177 -2.224932      2.452212 -1.057835      3.474917 -3.382719      3.461028 12.07837 5.473690 10.50498 4.989476 1.573392       7.406494 
1 1 1 10  39 9  o 20.44872 5.886279 6.043659       3.091249 4.895408       4.212175 7.383957       4.550809 18.80807 6.949023 21.97380 7.287821 -3.165733      10.06982 
1 1 1 10  39 10 o 23.54101 6.359233 8.282249       3.733489 13.20901       6.710436 6.073451       4.493123 27.53940 8.831150 20.17329 7.217134 7.366112       11.40510 
1 1 1 10  39 11 o 42.78777 4.714802 24.90497       4.834683 0.000000       0.000000 24.90497       4.834683 ?        ?        42.78777 4.714802 0.000000       4.714802 
1 1 1 10  39 12 f 17.70873 6.262293 4.508372       3.373783 10.78657       7.402771 2.862509       3.790299 24.14006 9.151474 15.86921 6.388283 8.270851       11.16063 
1 1 1 10  39 13 o 20.51254 7.285713 6.764819       4.570909 10.31678       7.453732 4.623984       5.786705 23.36268 9.097914 18.56671 7.729092 4.795977       11.93779 
1 1 1 10  39 14 o 15.23972 6.144090 2.712539       3.511791 -5.947134      7.508002 5.137681       3.973216 14.29199 6.930279 18.35148 6.754506 -4.059490      9.677402 
1 1 1 10  39 15 o 35.94033 4.693427 18.08176       4.012515 22.77449       9.559200 17.07809       4.420832 31.23232 10.56538 34.13598 5.501371 -2.903662      11.91185 
1 1 1 10  39 16 o 16.90506 6.319085 4.254826       3.502260 7.896225       7.795248 3.333903       3.920191 20.55711 8.783787 15.98862 6.475187 4.568488       10.91251 
1 1 1 10  39 17 o 15.78608 6.168771 3.488928       3.436374 -2.135481      7.570740 4.948399       3.856538 15.22209 7.271613 17.67982 6.626423 -2.457723      9.837979 
1 1 1 10  39 18 o 15.42183 6.483085 2.882855       4.131786 5.423913       8.001474 1.958930       4.824821 18.58830 8.375937 15.13698 6.681526 3.451321       10.71443 
1 1 1 10  40 0  o 12.80935 5.508371 0.4382372      3.102025 -1.454747      4.278025 2.537037       4.504590 13.18412 6.013179 16.70048 6.873155 -3.516363      9.132282 
1 1 1 10  40 1  o 14.26528 5.784159 1.738604       3.132396 0.7491983E-01  4.248393 3.720397       4.636800 14.23157 6.276302 17.95678 7.119952 -3.725204      9.491347 
1 1 1 10  40 2  f 52.79544 4.089417 36.34079       5.220320 37.49240       6.661903 34.50864       8.402853 52.52217 5.276390 48.12205 7.402340 4.400116       9.090376 
1 1 1 10  40 3  o 17.08010 5.945431 3.912305       3.033024 5.736107       4.538094 2.439949       4.077473 20.06154 7.243666 16.08296 6.570056 3.978577       9.779383 
1 1 1 10  40 4  o 32.74691 4.981925 14.62480       3.850447 34.93358       8.603874 9.538766       4.305680 47.89216 7.627754 25.16090 6.842889 22.73126       10.24733 
1 1 1 10  40 5  o 28.96328 5.267401 11.67437       3.580840 22.18281       5.089694 1.374894       5.038834 40.05052 5.348497 16.02851 6.956676 24.02201       8.775065 
1 1 1 10  40 6  o 13.76062 5.549501 1.737515       2.865959 3.204560       3.841244 -0.1045724     4.304328 16.52153 6.502360 13.97796 6.232362 2.543571       9.006832 
1 1 1 10  40 7  o 7.735976 3.823581 -5.351266      2.641795 -4.004215      3.413620 -7.362761      4.171408 9.989880 4.801357 9.889663 4.872271 0.1002169      6.840472 
1 1 1 10  40 8  o 18.19265 5.679957 4.776707       2.792538 5.255402       3.893799 4.269743       4.007128 18.91625 6.723880 17.71184 6.728733 1.204409       9.512434 
1 1 1 10  40 9  o 18.71253 6.176965 5.185263       3.270357 4.036672       5.240821 5.917746       4.185193 18.00508 7.412191 19.68252 6.973443 -1.677446      10.17691 
1 1 1 10  40 10 o 13.95366 5.872271 1.518437       3.395708 3.633433       5.694394 0.3512990      4.230130 17.76962 7.547162 13.94792 6.201170 3.821704       9.768017 
1 1 1 10  40 11 o 17.52324 6.206548 4.523190       3.315076 5.110388       6.353503 4.303526       3.885984 19.02209 8.020373 17.37445 6.620140 1.647638       10.39965 
1 1 1 10  40 12 o 11.99256 5.429455 -0.5456768     3.408889 7.071486       7.628190 -2.446424      3.810544 20.47723 8.717522 11.34850 5.343417 9.128736       10.22484 
1 1 1 10  40 13 o 22.84785 6.550052 8.411066       3.835197 18.97472       8.488275 5.701399       4.299029 29.30170 9.955569 18.88063 7.012094 10.42107       12.17714 
1 1 1 10  40 14 o 29.05215 6.067057 13.03276       4.156466 29.64866       10.07925 9.628157       4.562469 35.80217 10.71811 23.60743 7.241659 12.19474       12.93520 
1 1 1 10  40 15 o 19.89960 7.240516 6.858312       4.545584 6.343798       7.975456 7.105859       5.532049 19.36471 8.567053 19.89678 7.811592 -0.5320683     11.59376 
1 1 1 10  41 0  o 23.87304 7.114357 8.864433       4.448611 7.351350       4.818824 17.59216       11.57337 21.73253 7.497741 28.37288 11.24903 -6.640352      13.51876 
1 1 1 10  41 1  o 15.95255 6.307829 2.902755       3.630031 6.814885       4.756625 -2.553293      5.617347 21.04434 7.436301 14.13187 6.600460 6.912471       9.943069 
1 1 1 10  41 2  o 12.05482 5.363459 -0.2907331     3.170371 0.6412202      4.279472 -1.424428      4.719992 14.45027 6.338474 13.58111 6.239769 0.8691578      8.894434 
1 1 1 10  41 3  o 14.32933 5.977273 1.641316       3.471102 3.106160       4.467127 -0.5908776     5.514405 16.77735 6.867973 15.01203 6.839222 1.765318       9.692472 
1 1 1 10  41 4  o 25.65528 5.269527 9.356126       3.184132 9.526741       4.558488 9.193565       4.449573 24.44580 7.180483 24.07395 7.100297 0.3718548      10.09820 
1 1 1 10  41 5  o 16.31244 6.298700 3.404461       3.549700 15.19175       7.670583 0.1922583      4.004267 28.08113 9.464346 13.61274 6.043821 14.46839       11.22950 
1 1 1 10  41 6  o 25.92019 6.680647 10.48756       4.246380 19.14261       7.864198 6.925539       5.045074 31.64035 9.466296 20.71564 7.613533 10.92471       12.14811 
1 1 1 10  41 7  o 29.72588 4.802067 12.33122       3.360022 18.07695       5.174138 8.141331       4.418421 34.56033 6.378543 22.33316 7.166406 12.22717       9.593914 
1 1 1 10  41 8  o 30.45550 4.812871 12.98993       3.453419 16.07928       5.465552 10.93690       4.455512 31.45841 7.274676 26.08796 6.902527 5.370459       10.02825 
1 1 1 10  41 9  o 12.89365 5.455629 1.150922       2.956754 2.727714       4.253877 -0.3229185     4.112661 15.83100 6.611345 13.17282 5.963736 2.658179       8.903708 
1 1 1 10  41 10 o 30.49747 5.351812 13.53681       3.832418 19.46706       7.861773 11.68834       4.389253 30.89709 9.511182 27.00079 6.702200 3.896309       11.63538 
1 1 1 10  41 11 o 14.23901 5.875641 2.111178       3.303500 1.734161       6.900814 2.223264       3.762647 16.75576 7.640256 14.78053 6.198397 1.975234       9.838375 
1 1 1 10  41 12 o 12.64160 5.548230 0.5965637      3.283062 -5.649840      6.923439 2.408593       3.728975 13.58169 6.601844 14.87091 6.198646 -1.289217      9.055802 
1 1 1 10  42 0  o 17.26735 6.257720 4.240726       3.390753 10.75308       5.166265 -0.6874293     4.494173 25.28589 7.696192 13.57136 6.179522 11.71453       9.870049 
1 1 1 10  42 1  o 15.84460 6.241180 3.090450       3.541478 4.587143       4.718071 1.158841       5.359914 18.13376 7.184646 15.73010 6.987683 2.403658       10.02232 
1 1 1 10  42 2  o 11.47274 5.119629 -0.2835758     2.910866 0.6138183      4.198045 -1.114547      4.039694 14.09052 6.225461 12.62814 5.791079 1.462386       8.502527 
1 1 1 10  42 3  o 11.02026 4.997871 -0.7720834     2.903533 -1.050575      4.110238 -0.4946792     4.102207 12.74826 5.844402 13.11769 5.945714 -0.3694315     8.337178 
1 1 1 10  42 4  o 19.54835 5.982604 5.803453       3.116192 4.661326       4.490620 6.864265       4.327811 17.98815 7.045214 20.58637 7.105350 -2.598219      10.00605 
1 1 1 10  42 5  o 24.56730 5.933036 9.145733       3.511585 9.067632       5.002178 9.221622       4.930853 22.93632 7.641685 23.18152 7.581202 -0.2452087     10.76429 
1 1 1 10  42 6  o 15.22942 5.880427 2.994011       3.093873 5.366403       4.770558 1.271855       4.064548 18.64913 7.273862 14.32000 6.231255 4.329123       9.577975 
1 1 1 10  42 7  o 17.55225 6.604014 4.609149       3.838413 4.821851       6.764640 4.508146       4.661513 18.65004 8.077594 17.67052 7.094564 0.9795265      10.75083 
1 1 1 10  42 8  o 22.05602 6.450858 7.815416       3.685942 7.684173       7.891836 7.852034       4.168548 20.59193 8.819273 21.67647 6.961320 -1.084541      11.23564 
1 1 1 10  43 0  o 11.46009 5.221592 -0.8359841     3.215457 4.069323       5.183702 -3.903851      4.099446 17.59080 7.318459 11.03331 5.292060 6.557493       9.031376 
1 1 1 10  43 1  o 26.27806 5.577637 10.22783       3.461120 17.64400       5.901087 6.338710       4.273341 32.39699 7.605664 19.78072 7.042627 12.61628       10.36555 
1 1 1 10  43 2  o 8.723003 4.278083 -5.052504      3.100698 -7.707954      4.696697 -3.000988      4.128202 10.38754 5.127462 11.51325 5.462814 -1.125710      7.492210 
1 1 1 11  0  0  o 211.5662 7.003953 547.3851       36.02008 547.3851       36.02008 547.3851       36.02008 211.5662 7.003953 211.5662 7.003953 0.000000       0.000000 
1 1 1 11  0  1  o 438.7946 13.03220 2355.480       139.0742 2355.480       139.0742 2355.480       139.0742 438.7946 13.03220 438.7946 13.03220 0.000000       0.000000 
1 1 1 11  0  2  o 153.7250 4.154437 288.6078       15.53728 288.6078       15.53728 288.6078       15.53728 153.7250 4.154437 153.7250 4.154437 0.000000       0.000000 
1 1 1 11  0  3  o 818.7124 16.61741 8197.011       331.2279 8197.011       331.2279 8197.011       331.2279 818.7124 16.61741 818.7124 16.61741 0.000000       0.000000 
1 1 1 11  0  4  o 246.7212 4.641108 742.6177       27.88159 742.6177       27.88159 742.6177       27.88159 246.7212 4.641108 246.7212 4.641108 0.000000       0.000000 
1 1 1 11  0  5  o 404.4655 8.543423 1997.347       84.12244 1997.347       84.12244 1997.347       84.12244 404.4655 8.543423 404.4655 8.543423 0.000000       0.000000 
1 1 1 11  0  6  o 162.9793 4.345018 324.3986       17.22907 324.3986       17.22907 324.3986       17.22907 162.9793 4.345018 162.9793 4.345018 0.000000       0.000000 
1 1 1 11  0  7  o 535.5502 9.023764 3500.802       117.6917 3500.802       117.6917 3500.802       117.6917 535.5502 9.023764 535.5502 9.023764 0.000000       0.000000 
1 1 1 11  0  8  o 506.9013 8.577718 3136.267       105.8890 3136.267       105.8890 3136.267       105.8890 506.9013 8.577718 506.9013 8.577718 0.000000       0.000000 
1 1 1 11  0  9  o 14.93355 7.472318 3.996987       3.322556 3.996987       3.322556 3.996987       3.322556 14.93355 7.472318 14.93355 7.472318 0.000000       0.000000 
1 1 1 11  0  10 o 145.5993 3.471378 258.7885       12.30097 258.7885       12.30097 258.7885       12.30097 145.5993 3.471378 145.5993 3.471378 0.000000       0.000000 
1 1 1 11  0  11 o 241.4862 5.640962 712.1155       33.15477 712.1155       33.15477 712.1155       33.15477 241.4862 5.640962 241.4862 5.640962 0.000000       0.000000 
1 1 1 11  0  12 o 292.6794 9.239101 1048.776       65.74702 1048.776       65.74702 1048.776       65.74702 292.6794 9.239101 292.6794 9.239101 0.000000       0.000000 
1 1 1 11  0  13 o 119.2551 5.642777 174.5881       16.31458 174.5881       16.31458 174.5881       16.31458 119.2551 5.642777 119.2551 5.642777 0.000000       0.000000 
1 1 1 11  0  14 o 21.53415 8.850214 7.923078       4.589924 7.923078       4.589924 7.923078       4.589924 21.53415 8.850214 21.53415 8.850214 0.000000       0.000000 
1 1 1 11  0  15 o 111.8606 4.093793 153.1676       11.12540 153.1676       11.12540 153.1676       11.12540 111.8606 4.093793 111.8606 4.093793 0.000000       0.000000 
1 1 1 11  0  16 o 125.2866 4.170856 192.0385       12.70202 192.0385       12.70202 192.0385       12.70202 125.2866 4.170856 125.2866 4.170856 0.000000       0.000000 
1 1 1 11  0  17 o 61.14934 4.620134 46.38571       6.792089 46.38571       6.792089 46.38571       6.792089 61.14934 4.620134 61.14934 4.620134 0.000000       0.000000 
1 1 1 11  0  18 o 149.4059 4.460439 273.0340       16.20705 273.0340       16.20705 273.0340       16.20705 149.4059 4.460439 149.4059 4.460439 0.000000       0.000000 
1 1 1 11  0  19 o 256.4535 6.037534 804.6447       37.68429 804.6447       37.68429 804.6447       37.68429 256.4535 6.037534 256.4535 6.037534 0.000000       0.000000 
1 1 1 11  0  20 o 106.4048 4.207594 138.7799       10.87133 138.7799       10.87133 138.7799       10.87133 106.4048 4.207594 106.4048 4.207594 0.000000       0.000000 
1 1 1 11  0  21 o 155.4356 4.653646 295.7074       17.59128 295.7074       17.59128 295.7074       17.59128 155.4356 4.653646 155.4356 4.653646 0.000000       0.000000 
1 1 1 11  0  22 o 268.5696 6.298225 883.6215       41.16911 883.6215       41.16911 883.6215       41.16911 268.5696 6.298225 268.5696 6.298225 0.000000       0.000000 
1 1 1 11  0  23 o 36.90778 11.20331 20.76132       8.792525 20.76132       8.792525 20.76132       8.792525 36.90778 11.20331 36.90778 11.20331 0.000000       0.000000 
1 1 1 11  0  24 o 65.80085 4.911829 53.78064       7.772850 53.78064       7.772850 53.78064       7.772850 65.80085 4.911829 65.80085 4.911829 0.000000       0.000000 
1 1 1 11  0  25 o 97.88943 4.552139 117.8318       10.80527 117.8318       10.80527 117.8318       10.80527 97.88943 4.552139 97.88943 4.552139 0.000000       0.000000 
1 1 1 11  0  26 o 28.84565 9.730780 13.19477       6.114141 13.19477       6.114141 13.19477       6.114141 28.84565 9.730780 28.84565 9.730780 0.000000       0.000000 
1 1 1 11  0  27 o 151.1331 4.805216 280.2287       17.65681 280.2287       17.65681 280.2287       17.65681 151.1331 4.805216 151.1331 4.805216 0.000000       0.000000 
1 1 1 11  0  28 o 64.89524 5.373414 52.64048       8.358921 52.64048       8.358921 52.64048       8.358921 64.89524 5.373414 64.89524 5.373414 0.000000       0.000000 
1 1 1 11  0  29 o 19.53375 11.45676 5.753531       9.175281 5.753531       9.175281 5.753531       9.175281 19.53375 11.45676 19.53375 11.45676 0.000000       0.000000 
1 1 1 11  0  30 o 63.59208 5.565923 50.79206       8.466738 50.79206       8.466738 50.79206       8.466738 63.59208 5.565923 63.59208 5.565923 0.000000       0.000000 
1 1 1 11  0  31 o 91.02612 4.782956 102.5366       10.54230 102.5366       10.54230 102.5366       10.54230 91.02612 4.782956 91.02612 4.782956 0.000000       0.000000 
1 1 1 11  0  32 o 105.0966 6.859770 138.8506       17.39441 138.8506       17.39441 138.8506       17.39441 105.0966 6.859770 105.0966 6.859770 0.000000       0.000000 
1 1 1 11  0  33 o 24.24781 10.37521 10.61825       6.257604 10.61825       6.257604 10.61825       6.257604 24.24781 10.37521 24.24781 10.37521 0.000000       0.000000 
1 1 1 11  0  34 o 15.74511 9.304167 3.883413       6.130574 3.883413       6.130574 3.883413       6.130574 15.74511 9.304167 15.74511 9.304167 0.000000       0.000000 
1 1 1 11  0  35 o 65.14105 5.372365 54.04545       8.390121 54.04545       8.390121 54.04545       8.390121 65.14105 5.372365 65.14105 5.372365 0.000000       0.000000 
1 1 1 11  0  36 o 13.20207 8.900179 -2.154941      8.267579 -2.154941      8.267579 -2.154941      8.267579 13.20207 8.900179 13.20207 8.900179 0.000000       0.000000 
1 1 1 11  0  37 o 9.622621 6.710466 -4.488000      5.701907 -4.488000      5.701907 -4.488000      5.701907 9.622621 6.710466 9.622621 6.710466 0.000000       0.000000 
1 1 1 11  0  38 o 19.37898 11.25490 8.590840       8.713477 8.590840       8.713477 8.590840       8.713477 19.37898 11.25490 19.37898 11.25490 0.000000       0.000000 
1 1 1 11  0  39 o 18.38750 9.820091 7.785509       5.996235 7.785509       5.996235 7.785509       5.996235 18.38750 9.820091 18.38750 9.820091 0.000000       0.000000 
1 1 1 11  0  40 o 23.07938 10.11654 11.62687       5.935126 11.62687       5.935126 11.62687       5.935126 23.07938 10.11654 23.07938 10.11654 0.000000       0.000000 
1 1 1 11  0  41 o 7.474504 5.366369 -6.136687      4.675361 -6.136687      4.675361 -6.136687      4.675361 7.474504 5.366369 7.474504 5.366369 0.000000       0.000000 
1 1 1 11  0  42 o 7.637713 5.458025 -5.026598      4.609600 -5.026598      4.609600 -5.026598      4.609600 7.637713 5.458025 7.637713 5.458025 0.000000       0.000000 
1 1 1 11  0  43 o 8.359426 5.908818 -3.299422      4.894710 -3.299422      4.894710 -3.299422      4.894710 8.359426 5.908818 8.359426 5.908818 0.000000       0.000000 
1 1 1 11  0  44 o 9.205914 6.413022 -1.288745      5.169780 -1.288745      5.169780 -1.288745      5.169780 9.205914 6.413022 9.205914 6.413022 0.000000       0.000000 
1 1 1 11  1  0  o 721.3436 10.36165 6351.024       182.1409 6490.283       261.5431 6219.884       253.8034 728.5647 14.73123 713.2482 14.60228 15.31647       20.74212 
1 1 1 11  1  1  o 874.8709 11.18411 9345.271       238.4414 9513.589       311.7673 9108.075       370.1005 882.0937 14.50373 862.3804 17.61103 19.71326       22.81461 
1 1 1 11  1  2  o 239.0750 3.894546 696.6048       22.68961 710.3536       26.45261 658.3284       44.13680 241.4124 4.496483 232.1924 7.811519 9.219955       9.013224 
1 1 1 11  1  3  o 571.1349 8.279613 3979.319       115.2351 4067.228       165.2932 3896.190       160.7364 577.0550 11.75444 564.8002 11.67840 12.25482       16.56960 
1 1 1 11  1  4  o 168.1697 3.558807 344.6694       14.58439 328.1774       17.39269 383.7325       26.76786 164.0298 4.355042 177.2933 6.205194 -13.26352      7.580952 
1 1 1 11  1  5  o 391.6777 6.749103 1870.879       64.41856 1870.879       64.41856 0.000000       0.000000 391.6777 6.749103 ?        ?        0.000000       6.749103 
1 1 1 11  1  6  o 454.6609 6.694717 2521.056       74.17473 2499.155       85.12367 2590.140       151.1870 452.6130 7.717688 460.0016 13.50172 -7.388580      15.55182 
1 1 1 11  1  7  f 823.3399 10.54805 8280.198       211.6350 8253.085       272.6430 8321.302       335.6920 821.3123 13.62229 823.8399 16.72099 -2.527588      21.56753 
1 1 1 11  1  8  o 310.1412 4.288713 1172.519       32.41324 1141.982       41.19753 1222.135       52.51335 306.0306 5.524209 316.5272 6.808047 -10.49658      8.767348 
1 1 1 11  1  9  o 253.9142 3.668675 785.8494       22.70034 778.3180       29.16223 797.4300       36.16150 252.6637 4.736327 255.7079 5.803182 -3.044205      7.490642 
1 1 1 11  1  10 o 487.7276 6.410961 2902.135       76.19677 2906.488       98.41703 2895.622       120.3907 487.8848 8.277838 486.7104 10.15047 1.174377       13.09789 
1 1 1 11  1  11 o 269.6661 3.865205 886.5358       25.40008 889.1986       32.82673 882.5630       40.09632 270.0217 4.988763 268.9507 6.117808 1.071014       7.894006 
1 1 1 11  1  12 o 257.9269 4.196387 811.2096       26.37596 835.0040       37.86921 788.7910       36.75808 261.5814 5.940777 254.2403 5.932972 7.341064       8.396010 
1 1 1 11  1  13 o 101.7391 2.790869 126.2656       6.912783 132.5631       9.853435 120.1618       9.700659 104.1922 3.887574 99.18376 4.021853 5.008438       5.593615 
1 1 1 11  1  14 o 260.4669 4.896249 827.8677       31.07793 833.2798       53.92189 825.1757       38.02967 260.7888 8.496108 259.9453 6.003500 0.8435669      10.40317 
1 1 1 11  1  15 o 59.33713 3.703619 43.11081       5.328659 52.29206       9.369270 38.72111       6.478465 65.15412 5.967222 56.12275 4.782449 9.031376       7.647193 
1 1 1 11  1  16 o 51.79233 3.373908 32.85573       4.235106 29.92567       5.897593 35.97549       6.085518 49.25443 4.981951 54.08565 4.662685 -4.831226      6.823523 
1 1 1 11  1  17 f 247.6095 4.128916 748.3737       24.91377 746.2063       35.15722 750.5598       35.31006 247.0296 5.840222 247.7479 5.848607 -0.7182770     8.265252 
1 1 1 11  1  18 o 203.2253 3.647889 504.0327       18.06572 500.0545       25.46649 508.0628       25.63190 202.1923 5.172792 203.8071 5.165059 -1.614822      7.309967 
1 1 1 11  1  19 o 144.0275 3.111974 253.0836       10.92238 248.6872       15.33867 257.6059       15.55681 142.6086 4.419063 145.1476 4.403288 -2.538910      6.238355 
1 1 1 11  1  20 o 55.67644 3.454161 37.98254       4.663436 38.94956       6.685464 37.06609       6.508294 56.22333 4.929361 54.83740 4.922606 1.385933       6.966394 
1 1 1 11  1  21 o 171.6097 3.396662 359.5336       14.20464 352.4581       20.00298 366.7313       20.17491 169.6733 4.842721 173.0867 4.787724 -3.413391      6.809865 
1 1 1 11  1  22 o 102.2743 3.543314 127.9075       8.817713 123.5487       15.11999 130.1539       10.85469 100.1378 6.226895 103.0792 4.330907 -2.941376      7.584918 
1 1 1 11  1  23 o 39.13107 4.611478 18.99835       4.313073 24.70439       6.232561 13.75449       5.974812 44.48395 5.894386 32.75045 7.628788 11.73349       9.640654 
1 1 1 11  1  24 o 31.17953 6.480697 12.40009       4.763220 16.07494       5.723902 4.124382       8.589637 35.53853 6.857756 24.42616 9.688906 11.11238       11.87029 
1 1 1 11  1  25 o 80.89317 3.270662 80.08945       6.434091 82.88869       8.916958 77.04910       9.293048 82.13977 4.471653 79.12731 4.842623 3.012459       6.591409 
1 1 1 11  1  26 o 210.4937 3.868317 542.2708       19.84254 542.4893       27.96626 542.0494       28.15789 210.0017 5.469470 209.9018 5.509643 0.9988403E-01  7.763457 
1 1 1 11  1  27 o 60.13087 3.827606 44.44997       5.579567 48.30285       7.852530 40.52125       7.929431 62.46688 5.205781 57.06525 5.781794 5.401634       7.780057 
1 1 1 11  1  28 o 103.9182 3.785370 132.4888       9.569954 135.1353       11.77365 127.3355       16.42899 104.7769 4.622530 101.1340 6.704031 3.642960       8.143207 
1 1 1 11  1  29 o 168.3508 3.553468 347.2790       14.57819 350.4766       20.53490 344.0299       20.69944 168.5886 5.003908 166.9940 5.092481 1.594513       7.139500 
1 1 1 11  1  30 o 30.03654 7.478523 11.75703       5.452749 11.25375       8.915565 12.05778       6.892024 30.27014 10.20354 30.45445 8.796098 -0.1843128     13.47159 
1 1 1 11  1  31 o 91.00468 3.944083 102.1245       8.725965 103.9524       10.70770 98.51063       15.05598 91.55148 4.816431 88.23039 7.061428 3.321083       8.547618 
1 1 1 11  1  32 o 44.63861 4.582171 24.94452       4.913773 24.47630       7.134102 25.36715       6.777827 43.47778 6.968742 44.46026 6.443367 -0.9824791     9.491066 
1 1 1 11  1  33 o 56.68157 4.637421 40.29436       6.349575 36.41983       11.17579 42.14123       7.715888 51.79964 9.190040 57.62168 5.564080 -5.822037      10.74318 
1 1 1 11  1  34 o 51.20557 4.283434 32.96358       5.296043 42.71326       7.695977 24.19321       7.299234 57.77219 5.534074 42.55183 7.302036 15.22036       9.162189 
1 1 1 11  1  35 o 67.52225 4.330873 57.63707       7.088635 68.77509       12.85172 52.76688       8.498259 71.32551 7.506410 63.88501 5.512645 7.440502       9.313187 
1 1 1 11  1  36 o 38.48425 5.130374 19.42504       4.691617 18.30194       6.605492 20.56839       6.664802 35.77206 7.798030 38.24032 7.419752 -2.468262      10.76392 
1 1 1 11  1  37 o 12.94190 6.067075 -3.577525      4.819860 -1.920194      5.881706 -6.965728      8.409757 15.37138 7.025998 16.10334 7.684700 -0.7319565     10.41246 
1 1 1 11  1  38 o 16.86429 6.822520 2.944810       4.346761 3.860856       5.864795 1.828268       6.474881 18.88113 7.813572 17.86188 7.816785 1.019253       11.05233 
1 1 1 11  1  39 o 11.64932 5.574629 -4.199618      4.491381 0.7501904      5.767122 -11.82922      7.160046 15.96106 7.158172 12.49392 6.196423 3.467144       9.467580 
1 1 1 11  1  40 o 27.62323 7.311991 12.91671       4.998385 17.65702       6.172877 3.890319       8.518070 31.60265 8.007193 18.62012 8.489624 12.98253       11.67000 
1 1 1 11  1  41 o 13.94713 6.252880 0.9636568      4.396616 10.70413       8.479994 -2.617274      5.141663 21.26939 9.126336 12.66754 6.034966 8.601849       10.94124 
1 1 1 11  1  42 f 16.95827 6.556579 5.079893       3.849967 3.601145       5.373835 6.639268       5.518393 15.80147 7.009315 18.10244 7.542752 -2.300969      10.29678 
1 1 1 11  1  43 o 11.23023 5.223531 -0.3961853     3.460410 0.8792284      5.004324 -1.564796      4.790212 13.30906 6.220662 11.94289 5.726287 1.366169       8.454998 
1 1 1 11  1  44 o 9.212249 4.507484 -3.510798      3.381510 -5.924223      4.520072 -0.4433003     5.095896 9.757464 4.853416 12.29418 5.897739 -2.536716      7.637995 
1 1 1 11  2  0  o 474.3500 6.218178 2743.327       71.87835 2695.904       112.2799 2776.258       93.56327 470.0121 9.802956 477.0870 8.047699 -7.074890      12.68319 
1 1 1 11  2  1  o 582.2596 6.882454 4134.117       97.65536 4133.682       138.0676 4134.552       138.1435 581.9990 9.734941 582.0599 9.739277 -0.6085205E-01 13.77035 
1 1 1 11  2  2  o 421.9778 5.103664 2170.599       52.48169 2138.403       73.48151 2204.122       74.98186 418.7437 7.201014 425.1278 7.237700 -6.384033      10.20975 
1 1 1 11  2  3  o 761.9863 8.932754 7084.637       165.8703 7005.369       232.2425 7167.173       236.9813 757.1819 12.58651 765.8572 12.69785 -8.675232      17.87892 
1 1 1 11  2  4  o 192.8389 3.017270 453.1779       14.17898 473.6215       22.44460 439.6006       18.29104 197.1172 4.672521 189.9167 3.952203 7.200562       6.119833 
1 1 1 11  2  5  o 71.80156 2.695678 62.91394       4.708322 59.95333       6.249031 66.80159       7.160867 70.04066 3.674073 73.92510 3.989788 -3.884445      5.423764 
1 1 1 11  2  6  o 423.0061 5.614737 2181.651       57.87782 2158.143       73.99088 2218.711       92.90314 420.6307 7.218403 426.3686 8.941474 -5.737915      11.49153 
1 1 1 11  2  7  o 274.2079 3.546366 916.4097       23.69734 902.7379       33.15012 930.6971       33.88828 272.1166 4.999125 276.2974 5.033113 -4.180725      7.093904 
1 1 1 11  2  8  o 320.2718 4.027407 1250.312       31.43260 1210.341       43.45237 1294.187       45.52485 315.0490 5.659776 325.7754 5.734481 -10.72635      8.057130 
1 1 1 11  2  9  o 53.42000 2.495812 34.85261       3.240034 38.23069       4.505062 31.23315       4.663231 55.90777 3.321655 50.47530 3.819505 5.432476       5.061819 
1 1 1 11  2  10 o 71.66839 2.615714 62.68065       4.560630 66.39115       5.641778 55.68393       7.747238 73.73760 3.146956 67.41171 4.746356 6.325890       5.694842 
1 1 1 11  2  11 o 397.0554 5.327042 1922.954       51.54342 1920.624       66.46318 1926.469       81.64324 396.6748 6.875597 397.1007 8.436911 -0.4259338     10.88372 
1 1 1 11  2  12 o 212.1518 3.272090 548.6649       16.91641 547.4151       21.74357 550.5812       26.92540 211.8769 4.211250 212.4446 5.200922 -0.5677338     6.692101 
1 1 1 11  2  13 o 336.4004 5.183079 1380.836       42.48938 1359.070       59.46985 1403.532       60.72802 333.5013 7.317509 338.9080 7.353113 -5.406708      10.37373 
1 1 1 11  2  14 o 310.6074 4.861339 1177.287       36.79626 1165.341       51.65728 1189.592       52.42681 308.7970 6.864712 311.9893 6.895687 -3.192352      9.730096 
1 1 1 11  2  15 o 39.17607 3.925036 18.90926       3.696733 20.59811       5.257859 17.25828       5.198585 40.71278 5.435251 37.12555 5.946798 3.587227       8.056449 
1 1 1 11  2  16 o 456.6695 7.870262 2555.326       87.58450 2639.683       155.0535 2515.798       106.1396 461.2763 13.80936 452.4965 9.625561 8.779877       16.83300 
1 1 1 11  2  17 o 205.7525 4.234059 516.8029       21.22942 523.3226       37.23264 513.6622       25.84171 206.5100 7.410563 204.9648 5.177901 1.545258       9.040304 
1 1 1 11  2  18 o 142.2497 3.081166 246.8375       10.68077 263.0916       15.50565 232.1616       14.73368 146.7113 4.341785 137.8045 4.393061 8.906845       6.176576 
1 1 1 11  2  19 o 237.2390 4.027205 687.2811       23.28230 686.8195       32.89289 687.7446       32.95949 236.8985 5.697753 237.0565 5.705484 -0.1580963     8.063308 
1 1 1 11  2  20 o 164.1676 3.794296 329.0978       15.17940 310.6692       25.38826 339.3507       18.93691 159.0283 6.565345 166.5473 4.670510 -7.519073      8.057136 
1 1 1 11  2  21 o 322.2612 5.099085 1271.018       40.04389 1297.060       57.39629 1246.321       55.89479 324.8105 7.251329 318.4129 7.203518 6.397644       10.22118 
1 1 1 11  2  22 o 173.2509 3.418624 366.5489       14.43321 358.8441       20.22432 374.5459       20.60427 171.1579 4.853776 174.8680 4.839816 -3.710098      6.854412 
1 1 1 11  2  23 o 108.3930 3.069872 143.5613       8.100651 139.7137       11.23615 147.7255       11.68939 106.7797 4.327062 109.7963 4.377634 -3.016602      6.155253 
1 1 1 11  2  24 o 28.73812 6.091025 10.53148       4.132992 6.066246       5.639383 15.71273       6.074736 23.33013 8.107852 35.04584 7.348215 -11.71571      10.94228 
1 1 1 11  2  25 o 31.15585 6.636293 12.41279       4.884070 10.50294       5.676528 17.85656       9.583685 28.67176 7.881294 37.17475 10.24917 -8.502995      12.92905 
1 1 1 11  2  26 o 90.83860 4.491070 101.3911       9.910778 101.3911       9.910778 0.000000       0.000000 90.83860 4.491070 ?        ?        0.000000       4.491070 
1 1 1 11  2  27 o 67.06615 4.067038 55.31133       6.615635 58.21042       8.139128 49.66674       11.35698 68.66939 4.895949 62.80913 7.572636 5.860260       9.017490 
1 1 1 11  2  28 o 36.78712 5.381649 17.01644       4.681733 15.94561       6.346379 18.29497       6.934595 35.12556 7.632804 37.63789 7.816527 -2.512329      10.92510 
1 1 1 11  2  29 o 87.16069 3.386007 93.18060       7.178236 103.1976       10.25585 83.56088       10.05039 91.48009 4.615453 82.19503 5.041920 9.285057       6.835449 
1 1 1 11  2  30 o 145.0465 3.445210 258.0005       12.17753 261.2925       17.13373 254.6400       17.31089 145.4371 4.841123 143.5243 4.956900 1.912781       6.928732 
1 1 1 11  2  31 o 65.23611 4.403347 52.74919       6.959133 56.77149       12.17787 50.79869       8.480215 66.59843 7.641906 63.70557 5.516847 2.892868       9.425197 
1 1 1 11  2  32 o 27.50569 6.723460 9.930934       4.468068 3.811234       6.369555 15.85940       6.269243 21.31996 8.378534 34.62510 7.635568 -13.30514      11.33586 
1 1 1 11  2  33 o 43.55330 4.701983 23.91882       4.911425 26.51239       7.174105 21.63098       6.737996 45.13415 6.727929 40.55040 7.075906 4.583752       9.763886 
1 1 1 11  2  34 o 60.89782 4.596366 46.75326       6.770714 48.76055       11.48147 45.68304       8.383575 60.23885 8.020524 59.58468 5.849050 0.6541710      9.926741 
1 1 1 11  2  35 o 50.02937 4.368484 31.77024       5.272519 31.15842       7.462730 32.38000       7.450222 48.41620 6.488335 49.46708 6.324904 -1.050877      9.061066 
1 1 1 11  2  36 o 64.07368 3.865311 51.96185       6.007251 50.86363       8.590619 53.01276       8.403543 62.01991 5.749492 63.54987 5.479872 -1.529961      7.942648 
1 1 1 11  2  37 o 17.19230 6.729226 3.153944       4.094653 5.899930       5.740519 0.3097708      5.842248 21.20833 8.054439 16.67613 7.356986 4.532202       10.90868 
1 1 1 11  2  38 o 34.38713 6.423015 17.09019       5.184462 19.07585       6.258876 12.74921       9.254178 35.39887 7.489623 26.58211 10.19443 8.816759       12.64994 
1 1 1 11  2  39 o 13.14502 6.033142 -1.214363      4.396894 -2.261094      5.308145 1.073823       7.848217 13.72100 6.411078 17.72930 8.108392 -4.008299      10.33673 
1 1 1 11  2  40 o 11.85729 5.467687 -1.176610      3.670890 1.493711       5.109859 -4.024502      5.277021 15.35533 6.821883 12.50953 6.001203 2.845795       9.085841 
1 1 1 11  2  41 o 15.55367 6.261823 3.397503       3.642074 1.661018       5.271956 4.982901       5.037387 15.10828 6.804120 17.52381 7.245685 -2.415533      9.939617 
1 1 1 11  2  42 o 13.12731 6.014673 0.5319058      4.344713 8.426454       8.377054 -2.373084      5.081594 18.61746 8.461400 12.28488 5.892271 6.332583       10.31087 
1 1 1 11  2  43 o 11.07855 5.182037 -0.6572582     3.483610 -4.616054      4.726294 4.051684       5.154670 10.65070 5.235212 15.26611 6.812582 -4.615409      8.591783 
1 1 1 11  2  44 o 12.34758 5.573300 1.478456       3.560023 0.1939153      4.806638 3.039334       5.298488 12.38927 5.883145 14.08318 6.520499 -1.693911      8.782272 
1 1 1 11  3  0  o 478.1187 6.266118 2787.146       73.00800 2778.909       114.9457 2792.716       94.52258 477.1812 9.884920 478.4916 8.106346 -1.310394      12.78376 
1 1 1 11  3  1  o 421.2527 5.580980 2163.319       57.29138 2185.906       91.06665 2148.524       73.70445 423.2785 8.828707 419.7359 7.205788 3.542542       11.39603 
1 1 1 11  3  2  o 794.9393 9.302532 7711.340       180.2068 7621.680       252.4280 7804.526       257.3450 789.7159 13.11688 799.1146 13.21511 -9.398621      18.61966 
1 1 1 11  3  3  f 568.4993 6.739202 3941.150       93.36294 3920.182       131.2524 3962.626       132.8320 566.7548 9.503336 569.8085 9.566162 -3.053711      13.48425 
1 1 1 11  3  4  o 318.0429 4.356220 1232.914       33.76226 1275.398       44.35073 1174.365       52.06600 323.4373 5.626968 310.3161 6.885157 13.12122       8.892028 
1 1 1 11  3  5  o 192.2375 3.350533 450.3805       15.69597 450.5096       17.92785 449.9566       32.48308 192.2585 3.826542 191.9503 6.955863 0.3081970      7.938920 
1 1 1 11  3  6  o 262.7093 3.763561 841.1787       24.09409 849.5326       30.96610 828.3616       38.35627 263.9852 4.813609 260.6382 6.038962 3.347076       7.722686 
1 1 1 11  3  7  o 294.9596 4.131348 1060.481       29.69549 1069.224       38.19820 1047.125       47.21064 296.1356 5.293175 293.0060 6.611915 3.129517       8.469659 
1 1 1 11  3  8  o 423.5342 5.634312 2187.428       58.15210 2160.309       74.18842 2230.641       93.64893 420.7903 7.234929 427.4304 8.990861 -6.640076      11.54035 
1 1 1 11  3  9  o 120.0486 4.016994 175.8758       11.73498 185.2587       15.83634 164.4491       17.47611 123.1441 5.289551 115.9457 6.207837 7.198441       8.155770 
1 1 1 11  3  10 o 526.5483 6.284633 3382.558       80.64069 3301.174       112.0224 3470.091       116.1773 519.8457 8.842894 532.9639 8.945149 -13.11816      12.57825 
1 1 1 11  3  11 o 266.0854 3.817814 863.1630       24.75551 834.0763       31.23345 912.3103       40.59962 261.5160 4.901012 273.4366 6.092972 -11.92065      7.819478 
1 1 1 11  3  12 o 133.9861 2.606479 218.8074       8.510405 220.7787       10.93744 215.7827       13.54852 134.5749 3.335153 132.9582 4.186802 1.616730       5.352808 
1 1 1 11  3  13 o 166.4896 3.198167 337.9286       12.97551 342.2479       18.34910 333.6084       18.35118 167.4438 4.500945 165.3113 4.559743 2.132492       6.407009 
1 1 1 11  3  14 o 246.7676 4.074704 742.7699       24.50306 720.7080       33.99783 766.6171       35.34663 242.9451 5.742578 250.5591 5.788976 -7.613968      8.154106 
1 1 1 11  3  15 o 42.21123 3.665292 21.89615       3.732936 26.03912       5.339488 17.93524       5.220849 45.93334 4.842995 37.87770 5.843931 8.055641       7.589870 
1 1 1 11  3  16 o 318.9962 4.985026 1242.742       38.75154 1250.516       54.98581 1235.071       54.62191 319.6214 7.059576 317.6422 7.056554 1.979279       9.981611 
1 1 1 11  3  17 o 161.4586 3.219200 317.9930       12.66617 320.7565       17.93855 315.2454       17.88689 162.0044 4.548355 160.6027 4.574975 1.401733       6.451196 
1 1 1 11  3  18 o 17.55381 6.985869 1.929902       4.479578 0.000000       0.000000 1.929902       4.479578 ?        ?        17.55381 6.985869 0.000000       6.985869 
1 1 1 11  3  19 f 141.9884 3.569622 246.2320       12.34146 235.8752       20.75187 251.8996       15.35130 138.6402 6.157676 143.5270 4.394277 -4.886765      7.564829 
1 1 1 11  3  20 o 180.2147 3.441007 396.4352       15.11165 396.5240       21.30559 396.3453       21.43721 180.0080 4.861423 179.9624 4.892756 0.4563904E-01  6.897282 
1 1 1 11  3  21 f 122.2452 3.053094 182.3781       9.095112 185.8270       12.88801 178.9564       12.83700 123.2236 4.298544 120.9132 4.363818 2.310448       6.125389 
1 1 1 11  3  22 o 67.82840 3.275064 56.30366       5.397368 51.13427       7.490097 61.88736       7.784474 64.46141 4.802680 70.98543 4.523656 -6.524017      6.597666 
1 1 1 11  3  23 o 109.4254 3.064686 146.3082       8.164175 143.8202       11.42225 148.9070       11.67363 108.3369 4.335277 110.2365 4.354114 -1.899551      6.144341 
1 1 1 11  3  24 o 167.8638 3.417289 344.3127       13.97896 344.2579       19.61684 344.3692       19.92525 167.5500 4.809478 167.5602 4.884955 -0.1014709E-01 6.855207 
1 1 1 11  3  25 o 102.1321 3.539132 127.6804       8.795047 131.7172       10.87108 120.0321       14.96353 103.6217 4.314567 98.53590 6.264087 5.085793       7.606200 
1 1 1 11  3  26 o 79.94775 3.393202 78.28913       6.595738 84.63180       9.061563 71.14220       9.618934 82.96864 4.498632 75.92265 5.230968 7.045990       6.899327 
1 1 1 11  3  27 o 83.66010 3.866149 85.89852       7.860629 88.96024       9.379318 78.67290       14.40875 85.02586 4.543221 79.24146 7.552950 5.784393       8.814075 
1 1 1 11  3  28 o 90.22301 3.343595 99.76210       7.338633 107.2430       10.39351 92.32453       10.36335 93.31574 4.584612 86.48990 4.937494 6.825844       6.737768 
1 1 1 11  3  29 o 75.62666 3.540522 70.23658       6.506856 76.37402       9.124713 63.88646       9.281457 78.62135 4.785245 71.75331 5.346516 6.868034       7.175221 
1 1 1 11  3  30 o 113.4103 3.338009 157.8156       9.215166 158.9973       12.85712 156.5673       13.21465 113.4608 4.660013 112.5328 4.830066 0.9280472      6.711576 
1 1 1 11  3  31 o 57.25689 3.969957 40.55664       5.504932 48.78432       7.917514 32.85705       7.659210 62.49022 5.247681 50.89373 6.310782 11.59648       8.207565 
1 1 1 11  3  32 o 50.36331 4.988871 31.84793       6.042461 18.15670       10.15066 39.36222       7.519990 36.37360 10.72321 55.83803 5.602107 -19.46443      12.09838 
1 1 1 11  3  33 f 53.98971 4.740236 36.65690       6.173345 34.73366       10.32351 37.72746       7.702199 50.78777 8.651065 54.31989 5.913992 -3.532112      10.47932 
1 1 1 11  3  34 o 26.98100 6.712506 9.782549       4.395432 8.330461       6.137796 11.31116       6.297435 25.22055 8.465875 28.66598 8.444904 -3.445425      11.95774 
1 1 1 11  3  35 o 29.71473 6.539742 11.99365       4.606881 15.70697       6.466335 8.166137       6.565013 33.36190 8.047398 24.79899 8.738613 8.562908       11.87956 
1 1 1 11  3  36 o 13.94079 6.106250 -0.2197419     3.958949 1.572361       5.865561 -1.719253      5.365410 17.93574 7.640216 15.03143 6.807812 2.904302       10.23324 
1 1 1 11  3  37 o 26.41800 6.755114 10.06144       4.365284 6.722754       6.128439 13.50003       6.219456 22.13386 8.340991 29.63711 8.289036 -7.503248      11.75926 
1 1 1 11  3  38 o 16.98567 7.390984 1.628436       5.717924 1.628436       5.717924 0.000000       0.000000 16.98567 7.390984 ?        ?        0.000000       7.390984 
1 1 1 11  3  39 o 12.02456 5.530247 -1.368991      3.720690 -5.670876      5.111553 3.478868       5.426234 11.87768 5.749726 17.57407 7.411053 -5.696393      9.379928 
1 1 1 11  3  40 o 16.00450 6.379327 3.407806       3.741247 0.8899294      5.197579 6.115043       5.389482 15.00345 6.756516 19.22596 7.658890 -4.222508      10.21318 
1 1 1 11  3  41 o 14.96762 6.097861 2.957035       3.500883 -1.042975      4.976898 6.874845       4.925494 13.23969 6.193243 19.32812 7.430995 -6.088421      9.673466 
1 1 1 11  3  42 o 20.00665 6.506781 7.299258       3.634787 8.448574       5.160276 6.167511       5.120683 19.87268 7.614767 17.70382 7.311308 2.168858       10.55651 
1 1 1 11  3  43 o 11.21367 5.389213 -2.058453      4.299200 -1.545097      8.079077 -2.261248      5.077857 13.88289 6.828059 11.86636 5.740997 2.016529       8.920843 
1 1 1 11  3  44 o 13.12751 5.913426 2.230118       3.984650 5.626704       5.992967 -0.4611945     5.334609 15.51390 7.091520 12.39944 5.970352 3.114460       9.270100 
1 1 1 11  4  0  o 802.2543 10.27695 7856.047       200.9149 7628.776       311.1418 8018.588       263.1284 789.5280 16.17167 810.0192 13.33019 -20.49121      20.95750 
1 1 1 11  4  1  o 406.2047 5.404004 2011.479       53.49296 1961.192       83.07057 2047.103       69.91896 400.9455 8.502091 409.7156 7.002874 -8.770172      11.01480 
1 1 1 11  4  2  o 456.1439 5.480856 2536.546       60.92372 2491.291       85.03797 2584.270       87.32587 451.9371 7.721448 460.2893 7.785310 -8.352203      10.96503 
1 1 1 11  4  3  o 354.1544 4.363103 1528.777       37.65514 1512.063       52.62411 1546.315       53.90376 352.1526 6.132220 356.1157 6.211434 -3.963043      8.728461 
1 1 1 11  4  4  o 504.6744 6.019230 3105.511       74.02670 3108.559       104.5165 3102.443       104.8635 504.7465 8.497189 504.2467 8.533854 0.4998169      12.04279 
1 1 1 11  4  5  o 264.2341 4.221083 851.0256       27.17996 860.5985       38.49051 841.5046       38.38624 265.6683 5.945355 262.7030 5.996177 2.965332       8.444016 
1 1 1 11  4  6  o 340.9305 6.019847 1417.374       50.01351 1449.198       61.77340 1356.820       85.21024 344.6689 7.354671 333.1317 10.50953 11.53723       12.82737 
1 1 1 11  4  7  o 522.8799 7.656450 3335.947       97.55859 3273.376       135.7468 3402.788       140.3034 517.5991 10.76217 527.7112 10.91028 -10.11212      15.32509 
1 1 1 11  4  8  o 177.1263 3.321680 382.3830       14.33761 381.2699       19.65718 383.6483       20.95819 176.7865 4.566672 177.3235 4.854676 -0.5369720     6.665011 
1 1 1 11  4  9  o 153.3740 2.739146 286.6862       10.23771 292.6516       16.02733 282.5746       13.30609 154.8788 4.250536 152.2580 3.586197 2.620865       5.561283 
1 1 1 11  4  10 o 255.4698 4.822796 795.8537       30.02441 800.2999       36.54229 786.6157       52.67305 256.1338 5.854541 253.6238 8.534566 2.509964       10.34961 
1 1 1 11  4  11 o 296.4756 4.661548 1071.933       33.67870 1074.888       38.68547 1062.682       68.44827 296.8426 5.347929 294.6257 9.546175 2.216827       10.94211 
1 1 1 11  4  12 o 401.1804 6.023392 1964.484       58.88665 1913.515       66.59377 2147.241       126.1005 395.8328 6.903759 418.0627 12.39135 -22.22992      14.18476 
1 1 1 11  4  13 o 256.0240 4.172605 799.4678       26.03298 768.7196       35.87437 833.6713       37.83633 250.9299 5.866724 261.3093 5.941800 -10.37938      8.350056 
1 1 1 11  4  14 o 298.2141 4.700747 1085.216       34.16104 1058.106       47.48019 1114.311       49.18701 294.2479 6.621602 301.9531 6.684592 -7.705200      9.409005 
1 1 1 11  4  15 o 87.99002 2.805326 94.49110       6.007553 93.60313       8.467708 95.39102       8.524504 87.50149 3.981565 88.33575 3.970158 -0.8342590     5.622723 
1 1 1 11  4  16 o 21.06151 5.896379 5.573383       3.145483 11.09842       4.757145 1.281337       4.192866 29.53165 6.757046 16.44864 6.683719 13.08302       9.504197 
1 1 1 11  4  17 o 158.5221 3.633062 306.6378       14.03456 311.2547       23.93478 304.2187       17.32563 159.3716 6.174542 157.7686 4.511059 1.602997       7.646870 
1 1 1 11  4  18 o 96.40919 2.860915 113.4677       6.713961 105.2135       9.270120 122.5744       9.737028 92.73554 4.112297 100.1187 3.998984 -7.383171      5.736102 
1 1 1 11  4  19 o 72.70964 3.011483 64.60738       5.324360 71.86392       7.593604 57.58977       7.467543 76.60117 4.082704 68.50634 4.498005 8.094833       6.074580 
1 1 1 11  4  20 o 96.76215 3.473739 114.4428       8.177744 134.9227       15.48878 106.5273       9.629284 104.7534 6.093857 93.27656 4.247433 11.47681       7.428041 
1 1 1 11  4  21 o 130.2390 3.074166 207.0213       9.756733 203.7091       13.64668 210.4846       13.95468 129.0128 4.346892 131.1397 4.372779 -2.126892      6.165766 
1 1 1 11  4  22 o 124.6260 3.068117 189.5956       9.317871 189.3920       13.07591 189.8056       13.28141 124.3718 4.320898 124.4988 4.384515 -0.1269379     6.155821 
1 1 1 11  4  23 o 19.23406 6.448758 4.271670       3.561496 7.841372       4.998188 0.5897409      5.076149 25.09785 7.555418 17.17694 7.201152 7.920916       10.43748 
1 1 1 11  4  24 o 115.4216 3.510987 162.9655       9.863863 168.5462       12.23074 152.5825       16.68280 117.2706 4.287055 111.2157 6.179846 6.054825       7.521259 
1 1 1 11  4  25 o 64.26366 3.491035 50.63602       5.446556 53.50795       7.610418 47.62061       7.798202 65.89243 4.771879 62.07238 5.203210 3.820045       7.060045 
1 1 1 11  4  26 o 18.18690 6.743159 3.182764       3.972521 7.064884       5.406482 -1.372434      5.856443 24.27575 7.938388 16.87849 7.408911 7.397259       10.85863 
1 1 1 11  4  27 o 104.8623 3.241177 134.6021       8.272493 122.0747       11.23405 149.4420       12.22707 99.61320 4.640649 110.2536 4.560708 -10.64038      6.506588 
1 1 1 11  4  28 o 164.7054 4.050073 332.7448       16.25574 337.0602       19.70799 323.5602       28.75184 165.4479 4.893533 161.0426 7.345713 4.405350       8.826447 
1 1 1 11  4  29 o 79.12550 3.493924 76.86436       6.720381 71.55936       9.109776 83.19868       9.954396 76.05022 4.942309 82.01022 5.004765 -5.959991      7.033782 
1 1 1 11  4  30 o 67.00967 3.667760 55.28873       5.966442 57.27843       8.290548 53.15108       8.593234 67.89717 5.046755 65.28535 5.451086 2.611816       7.428599 
1 1 1 11  4  31 o 139.2654 3.383178 238.1887       11.48164 254.4172       16.37504 222.4941       16.10336 143.3380 4.694304 133.9167 4.943014 9.421295       6.816881 
1 1 1 11  4  32 o 19.86195 7.499799 3.871238       4.960250 3.482996       8.144656 4.100139       6.253817 22.82971 9.300902 21.43288 8.337148 1.396826       12.49059 
1 1 1 11  4  33 o 39.53034 6.019665 20.21329       5.615991 13.79757       9.383245 23.79428       7.010233 31.79717 10.46141 42.55294 7.003764 -10.75577      12.58943 
1 1 1 11  4  34 o 16.10926 6.514272 1.762848       3.960934 -1.466526      5.320796 5.776967       5.932154 15.48909 6.916152 22.34707 8.248405 -6.857980      10.76426 
1 1 1 11  4  35 o 49.51772 5.192684 31.69996       6.172883 25.46049       10.43753 35.05626       7.655154 40.91890 10.43606 51.47467 6.229306 -10.55577      12.15383 
1 1 1 11  4  36 o 16.34281 6.575037 2.252375       4.012587 0.6142044E-01  5.615596 4.537983       5.735617 16.51292 7.251499 20.28508 7.957016 -3.772160      10.76561 
1 1 1 11  4  37 o 26.71465 7.375320 10.58984       4.958903 11.91195       6.108206 8.033777       8.493074 27.73405 8.353099 23.93378 9.587531 3.800266       12.71593 
1 1 1 11  4  38 o 17.26425 6.629581 3.704242       3.917142 0.4171808      5.462780 7.183123       5.619913 15.84562 7.045810 21.74473 8.027981 -5.899108      10.68138 
1 1 1 11  4  39 o 15.42446 6.567467 2.002958       4.330584 -1.265466      5.077609 10.72443       8.294401 13.92203 6.423639 23.57312 9.463858 -9.651092      11.43800 
1 1 1 11  4  40 o 14.45715 6.090507 2.029265       3.658853 5.425481       5.335995 -0.9845831     5.026648 18.53700 7.537138 13.67220 6.337455 4.864799       9.847425 
1 1 1 11  4  41 o 12.69794 5.835854 -0.3645034     4.133216 0.6746112      4.863937 -3.064623      7.840571 14.09711 6.422708 14.69392 7.114937 -0.5968142     9.585067 
1 1 1 11  4  42 o 14.54040 6.066268 3.013252       3.576058 3.675515       4.837676 2.215399       5.309859 15.57089 6.786513 14.76170 6.719746 0.8091965      9.550484 
1 1 1 11  4  43 o 11.44547 5.376754 -0.6112496     3.819521 -3.309600      5.620027 1.704921       5.206843 11.89867 5.819605 13.78528 6.410446 -1.886604      8.658038 
1 1 1 11  4  44 o 12.15568 5.749770 0.2125615      4.505794 -6.303029      8.389009 2.854302       5.341692 12.38364 6.225238 13.92859 6.482440 -1.544949      8.987526 
1 1 1 11  5  0  o 520.6569 6.791813 3305.654       86.17344 3168.729       132.2794 3406.606       113.5817 509.4615 10.65479 528.4020 8.820793 -18.94043      13.83224 
1 1 1 11  5  1  o 832.3994 10.65845 8459.567       216.2030 8344.304       338.6953 8538.834       280.8729 825.4626 16.83743 835.7208 13.79153 -10.25824      21.76477 
1 1 1 11  5  2  o 334.7884 4.569437 1366.197       37.27943 1382.031       48.47378 1343.275       58.32455 336.6795 5.908185 331.8732 7.211791 4.806335       9.322906 
1 1 1 11  5  3  o 474.8936 6.238933 2749.927       72.20093 2806.276       115.4909 2713.773       92.50694 479.4661 9.884477 471.6454 8.048641 7.820648       12.74690 
1 1 1 11  5  4  f 349.4392 4.749636 1488.490       40.44530 1441.904       62.35020 1522.334       53.14325 343.8141 7.441801 353.3343 6.172005 -9.520203      9.668198 
1 1 1 11  5  5  o 451.0995 5.429724 2480.985       59.68789 2543.343       85.47389 2421.633       83.38762 456.5896 7.681948 445.5309 7.680467 11.05869       10.86287 
1 1 1 11  5  6  o 481.9775 7.069845 2833.730       83.03722 2787.738       94.65041 2987.414       173.0178 477.9620 8.126304 493.7773 14.39419 -15.81528      16.52966 
1 1 1 11  5  7  f 338.5349 5.163792 1397.343       42.59987 1404.262       49.04227 1376.075       85.98196 339.3359 5.930683 335.4312 10.53189 3.904724       12.08692 
1 1 1 11  5  8  o 234.1649 3.885107 668.3929       22.16975 663.3129       30.37060 674.1877       32.43681 233.2296 5.343595 235.1223 5.661197 -1.892654      7.784802 
1 1 1 11  5  9  o 472.3387 6.230264 2721.732       71.71271 2755.847       92.90218 2671.433       112.8047 475.0982 8.024287 467.5174 9.901328 7.580780       12.74463 
1 1 1 11  5  10 o 227.8546 3.390771 632.8567       18.82749 659.2785       24.75621 596.6105       28.99573 232.5301 4.368868 221.1625 5.380051 11.36755       6.930509 
1 1 1 11  5  11 f 379.0224 5.718509 1752.873       52.81821 1693.929       73.01832 1817.564       76.49540 372.3372 8.047470 385.6734 8.139158 -13.33624      11.44586 
1 1 1 11  5  12 o 465.4204 6.879040 2645.768       78.02061 2611.416       109.3288 2681.418       111.3753 461.8324 9.714357 467.9693 9.766417 -6.136902      13.77504 
1 1 1 11  5  13 o 62.76331 2.905182 48.12469       4.431345 51.57075       6.153653 44.41283       6.386573 64.91040 3.908401 60.18011 4.384996 4.730293       5.873993 
1 1 1 11  5  14 o 458.0623 9.658643 2573.671       107.8144 2669.020       154.9912 2484.278       150.0729 464.7156 13.70119 448.3061 13.75325 16.40952       19.41325 
1 1 1 11  5  15 o 171.8581 3.724566 360.2971       15.59846 360.8804       26.36450 359.9829       19.34818 171.6921 6.312087 171.6657 4.629320 0.2641296E-01  7.827710 
1 1 1 11  5  16 o 287.3764 4.588355 1008.382       32.13248 967.2610       44.25357 1054.238       46.73202 281.1651 6.458783 293.5202 6.533419 -12.35504      9.187026 
1 1 1 11  5  17 o 55.31800 3.137011 37.44727       4.211482 34.37426       5.831714 40.79681       6.088447 52.85497 4.572595 57.63678 4.367321 -4.781815      6.323141 
1 1 1 11  5  18 o 90.32800 2.834864 99.61588       6.232364 97.64233       8.646344 101.7502       8.991576 89.33938 3.981492 91.19615 4.056124 -1.856773      5.683698 
1 1 1 11  5  19 o 218.8504 3.809433 584.7938       20.31627 580.3024       28.47515 589.4506       28.99497 217.7863 5.365366 219.4869 5.420982 -1.700562      7.627202 
1 1 1 11  5  20 o 204.2034 3.671332 509.1764       18.26933 503.6322       25.51340 515.0108       26.17270 202.8097 5.166509 205.0748 5.241507 -2.265076      7.359770 
1 1 1 11  5  21 o 212.4561 4.420856 551.9202       22.88820 549.6359       40.07632 553.0258       27.88285 211.0916 7.804211 212.4195 5.390857 -1.327850      9.485096 
1 1 1 11  5  22 o 14.98060 6.177134 0.8025625      3.647654 2.468420       4.594872 -2.036369      5.998353 18.24947 7.132684 16.71466 7.410381 1.534809       10.28537 
1 1 1 11  5  23 o 30.56021 5.800623 11.83882       4.161871 13.00022       5.257377 9.889278       6.811492 31.88470 6.961909 28.34513 8.874047 3.539564       11.27905 
1 1 1 11  5  24 f 71.01402 3.263654 61.73981       5.632764 58.10525       7.783893 65.73544       8.161370 68.71127 4.676585 73.11349 4.604052 -4.402214      6.562602 
1 1 1 11  5  25 o 141.3162 3.240630 244.0440       11.15983 226.9776       15.12111 264.4605       16.53876 136.0130 4.568608 146.8131 4.628552 -10.80005      6.503513 
1 1 1 11  5  26 o 145.4317 3.301571 258.5913       11.70080 257.7664       16.32564 259.4626       16.77852 144.8876 4.629785 145.3361 4.743799 -0.4485168     6.628614 
1 1 1 11  5  27 o 71.92493 3.479934 63.45238       6.081294 66.46848       8.434752 60.18738       8.775884 73.41479 4.740017 69.75752 5.199950 3.657272       7.036139 
1 1 1 11  5  28 o 25.14090 7.147137 8.067220       4.585119 19.68901       6.246341 -5.511521      6.751791 39.30202 6.765963 15.85787 7.348600 23.44416       9.989002 
1 1 1 11  5  29 o 103.5513 3.766417 131.7064       9.488461 138.3589       11.46855 117.2731       16.89264 105.9711 4.450951 96.66117 7.223728 9.309967       8.484881 
1 1 1 11  5  30 o 142.8463 3.370344 250.2656       11.73220 263.1822       16.70371 237.6893       16.48218 145.9614 4.702251 138.6286 4.886582 7.332748       6.781582 
1 1 1 11  5  31 o 76.00542 3.979951 71.37425       7.345857 79.57631       12.29300 66.81875       9.161467 79.41968 6.406068 73.18380 5.170333 6.235878       8.232257 
1 1 1 11  5  32 o 30.59279 6.115843 12.17180       4.399949 18.65800       5.969195 4.454750       6.510980 37.86623 6.714699 21.98491 8.519320 15.88131       10.84739 
1 1 1 11  5  33 o 25.00491 6.781909 8.301855       4.236110 5.625032       5.719112 11.55543       6.305208 22.23485 8.116783 29.18057 8.408777 -6.945717      11.68716 
1 1 1 11  5  34 o 30.49471 7.353266 12.69418       5.400367 19.35228       9.617655 9.628325       6.526337 36.34388 10.35759 26.67088 8.721887 9.672998       13.54071 
1 1 1 11  5  35 o 15.66600 6.527864 1.250625       4.133564 5.928020       5.982203 -3.023062      5.718214 22.15331 8.263109 14.94529 6.867061 7.208014       10.74409 
1 1 1 11  5  36 f 14.50157 6.708764 -3.107617      5.591996 -8.758947      7.736974 3.073471       8.091486 14.93666 7.191535 20.94532 8.949385 -6.008662      11.48084 
1 1 1 11  5  37 o 13.44152 5.958514 -0.3744323     3.876992 1.350910       5.317538 -2.332413      5.664704 16.71149 7.199470 14.74675 6.797229 1.964747       9.901247 
1 1 1 11  5  38 o 24.78139 6.666099 9.237629       4.112978 7.627207       5.818174 10.84634       5.815087 22.11924 8.167986 25.69688 8.218931 -3.577642      11.58736 
1 1 1 11  5  39 o 16.77778 6.440533 3.822822       3.696044 4.051668       5.157186 3.581152       5.299719 17.76625 7.337228 17.44278 7.338120 0.3234653      10.37704 
1 1 1 11  5  40 o 26.83648 7.000453 12.05636       4.625249 11.81184       5.671466 12.54194       7.992273 25.03884 8.126671 23.72745 9.366674 1.311390       12.40070 
1 1 1 11  5  41 o 13.80715 5.922750 1.849021       3.569620 3.713182       4.982296 -0.1171494     5.116800 16.27902 6.990406 13.79766 6.395063 2.481359       9.474313 
1 1 1 11  5  42 o 11.10304 5.219042 -1.264791      3.608231 -2.142410      5.212050 -0.4570784     5.000162 12.40290 5.953743 13.00634 6.123058 -0.6034384     8.540426 
1 1 1 11  5  43 o 16.32602 6.342135 5.168583       3.615167 2.896191       4.697279 8.470296       5.662058 14.25562 6.421132 18.25775 7.626373 -4.002127      9.969579 
1 1 1 11  5  44 o 10.99615 5.172429 -0.3955893     3.555035 -4.282046      4.768368 4.468040       5.334247 10.48399 5.173450 14.80290 6.737204 -4.318916      8.494380 
1 1 1 11  6  0  o 413.4117 5.493467 2083.567       55.34335 2114.407       88.30637 2063.618       71.02178 416.2893 8.704838 411.3538 7.085001 4.935486       11.22370 
1 1 1 11  6  1  o 226.2577 3.735720 623.9135       20.59746 586.8013       28.26874 665.9153       30.07336 219.3969 5.287371 233.7194 5.280209 -14.32248      7.472409 
1 1 1 11  6  2  o 350.5110 4.778944 1497.609       40.81969 1566.126       66.68063 1456.543       51.62290 358.3182 7.636506 345.6233 6.129192 12.69485       9.791998 
1 1 1 11  6  3  o 230.8487 3.409883 649.4739       19.18241 620.8044       29.23938 671.1368       25.41658 225.6586 5.317165 234.6480 4.444922 -8.989410      6.930337 
1 1 1 11  6  4  o 478.7692 5.732408 2794.852       66.88048 2801.087       94.37962 2788.563       94.78828 479.1392 8.083145 478.0626 8.136428 1.076630       11.46903 
1 1 1 11  6  5  o 132.9157 2.571882 215.2898       8.330357 208.8559       12.54403 220.3659       11.14201 130.8423 3.938651 134.4230 3.404108 -3.580704      5.205855 
1 1 1 11  6  6  o 99.59752 2.365710 120.8822       5.741773 124.2585       6.883675 113.1613       10.40947 100.9373 2.801256 96.24508 4.450319 4.692184       5.258553 
1 1 1 11  6  7  o 394.2160 5.890542 1895.286       56.58817 1879.846       64.74419 1945.251       116.4660 392.5491 6.768161 398.6218 12.00320 -6.072693      13.77987 
1 1 1 11  6  8  o 257.7886 4.150843 810.1329       26.07571 825.1578       30.07837 764.6808       52.31486 260.1476 4.744587 250.0950 8.596668 10.05264       9.819053 
1 1 1 11  6  9  o 259.1752 3.758176 818.8452       23.73595 853.0801       30.80379 768.8092       37.24012 264.4984 4.779087 251.0340 6.087550 13.46449       7.739375 
1 1 1 11  6  10 f 95.18402 2.666454 110.5089       6.178828 114.1533       6.873568 95.16521       14.10367 96.73203 2.919262 88.05251 6.621365 8.679512       7.236337 
1 1 1 11  6  11 o 333.8651 4.568870 1359.480       37.17199 1311.188       46.77278 1442.275       61.24333 327.7787 5.855666 343.6191 7.313838 -15.84039      9.369154 
1 1 1 11  6  12 o 172.0987 3.150663 361.0758       13.21343 344.2490       17.86116 381.4174       19.63822 167.9420 4.368007 176.7684 4.562729 -8.826416      6.316485 
1 1 1 11  6  13 o 212.3915 3.600151 550.1040       18.63348 551.6607       25.99986 548.4601       26.71826 212.6078 5.018291 211.9794 5.172237 0.6283722      7.206614 
1 1 1 11  6  14 o 50.56382 2.999378 31.28287       3.679184 30.11652       5.220813 32.43356       5.185670 49.48810 4.374125 51.39037 4.176805 -1.902275      6.048030 
1 1 1 11  6  15 o 161.2029 3.150265 316.9146       12.37531 309.5689       17.19248 324.8128       17.82746 159.1920 4.436134 163.0623 4.490695 -3.870255      6.312339 
1 1 1 11  6  16 o 248.2995 4.771379 753.0030       28.87060 742.9716       34.67403 775.6763       52.12888 246.5036 5.772249 251.2111 8.527732 -4.707550      10.29762 
1 1 1 11  6  17 f 202.9336 3.606418 502.5613       17.83471 525.5740       25.71398 481.2290       24.75739 207.3683 5.088512 198.3572 5.126073 9.011093       7.222851 
1 1 1 11  6  18 o 247.4211 4.119431 747.5794       24.83762 780.5902       35.86811 717.1669       34.42757 252.5404 5.828294 242.0621 5.836379 10.47835       8.248171 
1 1 1 11  6  19 o 133.0667 3.006005 216.0339       9.747545 215.1117       13.59057 217.0109       13.98825 132.6315 4.210227 133.2043 4.315019 -0.5727844     6.028714 
1 1 1 11  6  20 o 200.5733 3.628453 491.2442       17.73498 492.5945       24.89533 489.8528       25.27099 200.5728 5.097555 199.9956 5.189588 0.5772247      7.274400 
1 1 1 11  6  21 o 195.1103 4.088873 465.2775       19.44105 456.4999       23.69552 483.3543       34.00484 193.0410 5.041413 198.1377 7.053929 -5.096649      8.670280 
1 1 1 11  6  22 o 149.1486 3.775052 272.0232       13.70974 287.6993       24.82506 265.1443       16.44492 152.8114 6.682664 147.1224 4.592501 5.689072       8.108580 
1 1 1 11  6  23 o 169.8895 3.382381 352.6035       14.00313 327.6252       18.97045 382.5072       20.75673 163.4807 4.766933 176.6409 4.826571 -13.16020      6.783763 
1 1 1 11  6  24 o 41.81913 4.161012 21.61239       4.184227 22.83925       5.752899 20.23444       6.096851 42.75636 5.660324 40.04467 6.468139 2.711689       8.595120 
1 1 1 11  6  25 o 78.38265 3.177862 75.19798       6.057449 74.71568       8.348220 75.73425       8.802907 77.96780 4.411824 78.46587 4.624224 -0.4980698     6.391216 
1 1 1 11  6  26 o 54.59914 3.809698 36.66752       5.037084 39.84580       6.836987 32.89439       7.449369 56.74380 4.995303 51.30933 6.075569 5.434467       7.865469 
1 1 1 11  6  27 o 139.8294 3.831522 239.6981       13.04357 242.5605       15.61354 233.0854       23.73110 140.4826 4.566887 136.8560 7.140405 3.626648       8.475957 
1 1 1 11  6  28 o 132.2438 3.250547 214.0394       10.47534 227.3134       14.77728 200.6315       14.85172 135.9430 4.466751 127.6172 4.784108 8.325760       6.545194 
1 1 1 11  6  29 o 41.11115 4.845483 21.11060       4.761229 14.03322       6.457280 29.54272       7.048255 32.77405 8.125647 48.43301 6.107297 -15.65896      10.16490 
1 1 1 11  6  30 o 99.04659 4.526663 121.2478       10.89693 123.4055       14.25369 118.2130       16.90429 99.43515 5.909003 96.74854 7.222059 2.686615       9.331369 
1 1 1 11  6  31 o 36.09194 5.291969 16.52241       4.516191 16.53012       6.144884 16.51336       6.659873 35.52868 7.340353 35.35175 7.926814 0.1769295      10.80348 
1 1 1 11  6  32 o 60.13911 3.708489 44.80561       5.408446 46.79640       7.336931 42.43642       8.003915 61.07199 4.972882 57.85509 5.753235 3.216896       7.604556 
1 1 1 11  6  33 o 27.83712 7.599758 10.45058       5.298967 17.90723       9.110766 6.638690       6.514081 35.57477 10.06177 23.79198 8.666018 11.78279       13.27927 
1 1 1 11  6  34 o 51.25100 4.142475 33.06902       5.129612 45.39304       7.194052 20.32285       7.316226 59.68652 4.991755 38.33119 8.087170 21.35533       9.503680 
1 1 1 11  6  35 o 63.20512 5.355944 51.84144       8.171843 66.79568       12.34096 40.16434       10.90522 70.00687 7.343047 53.01136 8.746450 16.99551       11.42019 
1 1 1 11  6  36 o 14.29845 6.053119 0.8118619      3.642934 -0.5351183     4.698380 2.842317       5.768518 14.76848 6.552396 18.70231 7.745256 -3.933832      10.14509 
1 1 1 11  6  37 o 21.45385 7.399845 6.631032       4.693707 10.34254       7.395492 4.127607       6.073779 25.45197 9.239151 19.53158 8.003379 5.920389       12.22358 
1 1 1 11  6  38 o 18.52157 6.764562 4.809033       3.972996 2.706518       5.561362 7.000492       5.677777 17.44562 7.435707 21.34569 8.031814 -3.900074      10.94531 
1 1 1 11  6  39 o 20.12556 6.799083 6.431051       3.958659 5.011730       5.289120 8.238795       5.969139 18.58648 7.523440 21.67937 8.217905 -3.092888      11.14164 
1 1 1 11  6  40 o 10.65408 5.016735 -2.149143      3.359695 -1.276135      4.684127 -3.074108      4.821503 13.04093 6.069664 12.27235 5.845950 0.7685804      8.427096 
1 1 1 11  6  41 o 14.91173 6.528375 2.397178       4.520377 6.235421       6.375547 -1.482843      6.410151 18.26349 7.875773 14.11203 6.727405 4.151459       10.35788 
1 1 1 11  6  42 f 11.77659 5.437309 -0.2237818     3.646664 -1.507851      5.011472 1.221272       5.316344 12.44654 5.937582 14.04894 6.513967 -1.602407      8.814002 
1 1 1 11  6  43 o 14.35284 6.047280 3.427723       3.607787 -0.4425722     4.687893 9.049932       5.650140 12.25305 5.816020 18.64116 7.687377 -6.388106      9.639598 
1 1 1 11  6  44 o 12.81771 5.693019 2.188019       3.556328 6.308280       4.885623 -2.455677      5.186681 16.14713 6.927816 11.45029 5.598263 4.696846       8.907030 
1 1 1 11  7  0  f 290.9937 4.527452 1032.145       32.10506 1048.351       63.76939 1026.642       37.15773 292.9697 8.942567 290.1976 5.254353 2.772095       10.37197 
1 1 1 11  7  1  o 208.1989 4.151748 528.3332       21.06422 522.4811       37.85189 530.9584       25.35250 206.8274 7.522592 208.7001 4.984964 -1.872650      9.024370 
1 1 1 11  7  2  o 325.5521 5.814585 1292.239       46.12914 1261.468       78.28854 1308.603       57.09244 321.2832 10.01162 327.5498 7.152620 -6.266602      12.30417 
1 1 1 11  7  3  o 200.9869 3.437474 492.3227       16.83617 465.3860       22.84833 524.3249       24.90416 195.3881 4.798664 207.3891 4.927763 -12.00101      6.878228 
1 1 1 11  7  4  o 550.8904 6.541638 3701.281       87.81887 3510.793       119.5308 3924.698       129.4508 536.2825 9.146400 566.9883 9.369025 -30.70581      13.09333 
1 1 1 11  7  5  o 588.8574 6.972204 4229.916       100.0498 4226.373       140.9729 4233.513       142.0165 588.2723 9.833795 588.7600 9.898383 -0.4876709     13.95283 
1 1 1 11  7  6  o 733.9780 10.55914 6583.043       188.8634 6522.359       216.3852 6777.121       386.9691 730.2437 12.15972 741.0855 21.45009 -10.84180      24.65695 
1 1 1 11  7  7  o 505.0982 7.395385 3113.440       91.02752 3069.998       103.7918 3258.196       189.4619 501.4362 8.493979 515.2075 15.10681 -13.77127      17.33099 
1 1 1 11  7  8  o 312.2719 6.701220 1189.878       50.99444 1189.878       50.99444 0.000000       0.000000 312.2719 6.701220 ?        ?        0.000000       6.701220 
1 1 1 11  7  9  o 297.2961 5.345117 1078.070       38.72421 1138.997       48.18399 966.9403       65.07501 305.5057 6.472132 281.0731 9.514489 24.43265       11.50713 
1 1 1 11  7  10 o 351.9171 6.162770 1511.484       52.85091 1534.042       64.54064 1465.568       92.07996 354.3960 7.473230 345.7473 10.94252 8.648712       13.25096 
1 1 1 11  7  11 o 335.2398 7.157928 1372.934       58.47618 1372.934       58.47618 0.000000       0.000000 335.2398 7.157928 ?        ?        0.000000       7.157928 
1 1 1 11  7  12 o 67.26991 2.297787 55.21920       3.761219 61.35371       4.917109 46.56783       5.839320 70.88617 2.852331 61.67036 3.905588 9.215813       4.836260 
1 1 1 11  7  13 o 154.8459 2.691249 292.2974       10.15523 294.7442       13.04480 288.5333       16.17953 155.4677 3.443192 153.7238 4.323350 1.743881       5.526927 
1 1 1 11  7  14 o 150.4122 2.674962 275.8217       9.804755 281.6986       12.66943 267.0464       15.48154 151.9778 3.420905 147.8689 4.300933 4.108810       5.495509 
1 1 1 11  7  15 o 132.3630 2.879604 213.6416       9.288280 211.5217       13.02645 215.8340       13.24756 131.5899 4.067141 132.9235 4.094646 -1.333618      5.771288 
1 1 1 11  7  16 o 119.7482 2.826060 174.8750       8.246820 176.1351       11.58126 173.5788       11.74602 120.0626 3.963764 119.1798 4.050266 0.8828125      5.667105 
1 1 1 11  7  17 f 245.0791 4.752314 733.8979       28.38230 710.1116       33.67653 792.2177       52.73170 240.9209 5.736101 253.7006 8.541493 -12.77977      10.28883 
1 1 1 11  7  18 o 297.5938 5.492612 1083.544       39.83263 1072.429       48.03921 1107.999       71.25722 295.7759 6.664951 299.4455 9.778172 -3.669617      11.83360 
1 1 1 11  7  19 o 145.4898 3.480314 258.3855       12.33920 263.8333       15.44661 248.7789       20.51207 146.8798 4.320233 142.3909 5.924352 4.488876       7.332283 
1 1 1 11  7  20 o 221.1637 4.379097 597.9464       23.60122 584.5490       28.74161 625.6818       41.35412 218.4856 5.398240 225.3867 7.539910 -6.901108      9.273146 
1 1 1 11  7  21 o 43.53667 3.671398 23.31749       3.858871 20.64915       5.258106 26.43222       5.680922 40.69816 5.437684 46.18011 5.134820 -5.481945      7.478956 
1 1 1 11  7  22 o 151.7625 3.186798 281.2390       11.78569 269.0429       16.09755 295.3294       17.30258 148.2152 4.461961 155.2727 4.577770 -7.057510      6.392580 
1 1 1 11  7  23 o 51.31552 4.389104 32.46384       5.435940 36.80328       10.29443 30.78604       6.401134 53.97790 8.073833 49.81546 5.357076 4.162434       9.689429 
1 1 1 11  7  24 o 48.98388 4.540170 29.64268       5.357857 29.29000       9.903749 29.78860       6.370610 47.82386 8.823013 48.96151 5.430591 -1.137657      10.36035 
1 1 1 11  7  25 o 102.2154 3.033233 127.7575       7.547053 134.0720       10.53445 121.0991       10.81747 104.5543 4.142801 99.30257 4.481773 5.251778       6.103203 
1 1 1 11  7  26 o 137.9152 3.732552 232.9937       12.53299 227.9271       14.83723 245.6126       23.41554 136.2479 4.474831 140.7300 6.848374 -4.482101      8.180730 
1 1 1 11  7  27 o 26.94628 6.331882 9.335733       4.086951 14.40399       5.477077 2.968334       6.139043 33.48232 6.940813 20.63661 8.189319 12.84571       10.73498 
1 1 1 11  7  28 o 47.27623 4.671893 27.75018       5.312059 22.09558       7.992512 32.22442       7.109543 41.30322 8.229885 50.72903 5.858594 -9.425816      10.10219 
1 1 1 11  7  29 o 40.02043 4.705289 20.00121       4.501281 22.24542       6.056242 17.23137       6.728194 41.91090 6.109439 36.37754 7.822380 5.533352       9.925467 
1 1 1 11  7  30 o 16.97307 6.558133 2.415998       3.849995 2.276786       5.062151 2.607009       5.929594 18.48943 7.403484 19.89959 7.997389 -1.410152      10.89816 
1 1 1 11  7  31 o 80.62369 3.886288 80.31783       7.612947 82.31030       8.864640 74.71889       14.85998 81.43377 4.484358 75.98828 8.152119 5.445488       9.304112 
1 1 1 11  7  32 o 38.20631 6.101981 18.85340       5.490200 15.75698       9.176566 20.57965       6.851758 33.84231 10.24826 39.47775 7.393836 -5.635441      12.63708 
1 1 1 11  7  33 o 27.90060 6.187633 10.30595       4.096742 14.14151       5.460886 5.368579       6.195788 32.47027 7.099804 22.26262 8.387311 10.20764       10.98882 
1 1 1 11  7  34 o 36.54673 5.803361 17.53423       4.995933 15.89713       5.902905 21.66790       9.379838 34.08212 7.325436 38.40647 9.944479 -4.324345      12.35130 
1 1 1 11  7  35 o 22.34573 6.643548 6.825725       3.882890 1.570076       5.052535 14.40744       6.068477 17.10518 7.178588 31.74689 7.880857 -14.64172      10.66021 
1 1 1 11  7  36 o 11.05664 5.333456 -5.746003      4.303431 -4.931293      7.086556 -6.221971      5.416542 15.51233 7.298656 12.67863 6.081716 2.833698       9.500402 
1 1 1 11  7  37 o 34.42413 5.200962 16.10365       4.227047 11.54377       5.444077 23.02594       6.707678 27.33868 7.793144 39.54535 7.226721 -12.20667      10.62820 
1 1 1 11  7  38 o 34.69296 5.189479 16.74296       4.252758 13.34555       5.844377 20.56638       6.199979 28.35873 8.071505 36.53917 7.219110 -8.180445      10.82888 
1 1 1 11  7  39 o 10.61130 5.014935 -2.592349      3.413882 -2.239491      4.579042 -3.033926      5.122448 12.60116 5.909328 12.89366 6.108240 -0.2925043     8.498867 
1 1 1 11  7  40 o 17.83687 6.751390 5.104044       4.025288 5.201950       6.198580 5.032650       5.293250 18.24201 7.814533 17.91876 7.419917 0.3232536      10.77600 
1 1 1 11  7  41 o 26.12629 6.251980 11.39746       3.927190 10.93026       5.532898 11.87182       5.575111 22.75404 8.021969 23.76751 8.068409 -1.013466      11.37766 
1 1 1 11  7  42 o 14.28895 6.180737 2.796026       3.950326 6.328112       4.959886 -3.331386      6.532729 17.47213 7.203625 12.86790 6.289539 4.604229       9.562976 
1 1 1 11  7  43 o 11.22805 5.327909 -1.023368      3.928325 -1.117619      4.696517 -0.8038452     7.167590 11.89274 5.693638 13.48877 6.591944 -1.596026      8.710409 
1 1 1 11  7  44 o 15.81070 6.558876 5.546132       4.146465 7.736642       4.902234 0.3899312E-01  7.772923 17.31002 7.151650 13.44513 6.629079 3.864899       9.751451 
1 1 1 11  8  0  o 363.0682 5.483974 1607.104       48.51988 1537.628       66.89119 1684.245       70.48470 355.0282 7.731610 371.5663 7.784350 -16.53809      10.97150 
1 1 1 11  8  1  o 254.7884 5.777049 791.5256       35.86921 0.000000       0.000000 791.5256       35.86921 ?        ?        254.7884 5.777049 0.000000       5.777049 
1 1 1 11  8  2  o 359.6003 6.246172 1576.925       54.73562 1637.988       96.22934 1547.720       66.55003 366.0326 10.80008 356.1789 7.667327 9.853668       13.24498 
1 1 1 11  8  3  o 103.8157 3.733194 131.5315       9.429137 0.000000       0.000000 131.5315       9.429137 ?        ?        103.8157 3.733194 0.000000       3.733194 
1 1 1 11  8  4  o 387.9870 5.782639 1835.652       54.67382 1815.051       76.20552 1857.503       78.48580 385.6538 8.108727 390.1265 8.255616 -4.472687      11.57180 
1 1 1 11  8  5  o 220.4637 3.715490 592.4277       19.96132 583.3256       26.78711 603.7935       29.93335 218.7311 5.025497 222.5205 5.520128 -3.789368      7.465081 
1 1 1 11  8  6  o 492.6038 7.226986 2961.050       86.75432 2957.640       121.5577 2964.591       123.8528 491.9671 10.13935 492.5192 10.31921 -0.5521240     14.46695 
1 1 1 11  8  7  o 217.5102 3.678697 576.7014       19.49888 558.1119       25.80900 601.4227       29.76290 213.9388 4.950460 222.0646 5.499963 -8.125854      7.399774 
1 1 1 11  8  8  o 170.0937 2.858077 352.6226       11.84672 358.7691       14.71633 341.3058       19.96859 171.5567 3.520107 167.2224 4.905537 4.334244       6.037834 
1 1 1 11  8  9  o 104.0941 3.231197 132.2098       8.186522 132.2098       8.186522 0.000000       0.000000 104.0941 3.231197 ?        ?        0.000000       3.231197 
1 1 1 11  8  10 o 138.8669 2.833043 235.0561       9.587115 235.7229       10.66294 232.2426       21.90188 139.0574 3.146636 137.7636 6.542647 1.293808       7.259996 
1 1 1 11  8  11 o 198.8685 3.453725 482.1997       16.73747 472.8698       18.70838 519.6126       37.46361 196.9172 3.898670 206.0529 7.473341 -9.135666      8.429144 
1 1 1 11  8  12 o 132.2421 2.823518 213.1919       9.099056 212.6653       10.08916 215.4868       21.06170 132.0707 3.134819 132.6426 6.536027 -0.5718842     7.248913 
1 1 1 11  8  13 o 87.98443 2.220867 94.41850       4.757921 90.49110       5.965906 101.2817       7.886569 86.10516 2.847139 91.05887 3.560966 -4.953712      4.559241 
1 1 1 11  8  14 o 171.6042 2.831681 359.0648       11.84155 360.6089       15.19242 356.6748       18.90173 171.9335 3.626022 170.8760 4.543286 1.057526       5.812872 
1 1 1 11  8  15 o 280.9711 3.987326 963.4722       27.30106 992.0541       35.69651 923.1929       42.37614 284.9542 5.140609 274.6943 6.330465 10.25986       8.154794 
1 1 1 11  8  16 o 143.0384 2.963654 249.5490       10.33038 254.2297       14.64326 244.9114       14.57570 144.2415 4.170303 141.5653 4.229839 2.676224       5.939947 
1 1 1 11  8  17 o 327.1173 5.830300 1309.531       46.47619 1311.400       57.25750 1305.921       79.57328 326.9800 7.185800 325.1170 10.05574 1.863007       12.35935 
1 1 1 11  8  18 o 188.5018 3.893696 433.8846       17.88601 443.7278       22.38713 416.5137       29.74022 190.4572 4.827419 184.1948 6.636532 6.262436       8.206554 
1 1 1 11  8  19 o 36.44561 4.547134 16.48687       3.950880 13.91321       4.335927 29.07722       9.590148 33.27163 5.542651 47.88041 8.532129 -14.60878      10.17439 
1 1 1 11  8  20 o 131.7685 2.983761 211.8934       9.581020 211.3966       13.28368 212.4322       13.83218 131.4516 4.152038 131.7524 4.314017 -0.3007507     5.987501 
1 1 1 11  8  21 o 342.9378 5.330559 1441.022       44.54759 1422.208       62.23103 1460.795       63.79779 339.7549 7.516317 344.2885 7.604087 -4.533539      10.69192 
1 1 1 11  8  22 o 60.27893 3.124473 44.48634       4.573973 49.37814       6.302068 39.04110       6.649016 63.41139 4.100286 56.24734 4.899716 7.164047       6.389019 
1 1 1 11  8  23 o 241.6183 4.108857 714.2624       24.19285 696.6167       33.47077 733.5670       35.00873 238.1398 5.767632 244.3353 5.879686 -6.195450      8.236279 
1 1 1 11  8  24 o 93.38663 2.991815 106.6291       6.799779 101.5322       9.233213 112.6694       10.05149 90.97446 4.175968 95.82261 4.315614 -4.848145      6.005267 
1 1 1 11  8  25 o 64.02974 5.327030 50.72277       8.236731 55.73723       11.71772 45.82507       11.58049 66.71193 7.328332 60.22432 8.095614 6.487614       10.91986 
1 1 1 11  8  26 o 96.79425 3.033974 114.6305       7.147611 117.7380       9.912269 111.2645       10.31633 97.92195 4.163410 95.13201 4.462462 2.789940       6.103077 
1 1 1 11  8  27 o 31.34106 5.803109 12.50134       4.268922 10.14894       6.095655 14.76558       5.980330 28.21784 8.307350 33.80536 7.459692 -5.587519      11.16508 
1 1 1 11  8  28 o 59.59623 3.529841 43.66873       5.103408 41.06479       6.698736 47.27070       7.878576 57.55791 4.820087 61.67972 5.292786 -4.121803      7.158689 
1 1 1 11  8  29 o 107.5526 3.159438 141.8327       8.271722 152.2663       11.46605 130.5099       11.94458 111.1661 4.240358 102.7478 4.783611 8.418289       6.392462 
1 1 1 11  8  30 o 69.27937 3.371971 59.05726       5.675673 55.59648       7.493452 63.71430       8.692614 66.92451 4.623147 71.55197 5.017112 -4.627457      6.822382 
1 1 1 11  8  31 o 41.25294 5.255558 21.52691       5.163564 22.01269       5.877811 19.88456       10.80760 41.50474 5.984064 37.96242 11.02989 3.542320       12.54861 
1 1 1 11  8  32 o 43.71695 4.396513 23.99226       4.620225 30.52955       6.066957 14.96674       7.128668 49.11832 5.144883 33.11858 8.716043 15.99973       10.12123 
1 1 1 11  8  33 o 29.12552 6.466742 11.30499       4.470191 9.388071       5.310987 15.96271       8.278668 26.36461 7.752250 33.57576 9.622797 -7.211145      12.35701 
1 1 1 11  8  34 o 32.14478 5.445316 13.55698       4.113382 9.980467       5.370757 18.63150       6.397397 26.80955 7.771320 36.84963 7.381678 -10.04008      10.71833 
1 1 1 11  8  35 o 58.78345 3.638650 43.53283       5.186775 42.07544       6.870702 45.46387       7.908765 56.96993 4.999656 58.80566 5.585904 -1.835728      7.496592 
1 1 1 11  8  36 o 48.23161 5.087240 30.77261       5.889332 29.38179       10.11617 31.48565       7.243355 42.73262 9.907681 47.76154 6.383024 -5.028915      11.78580 
1 1 1 11  8  37 o 18.53672 6.514167 4.704789       3.646324 6.847054       4.766242 1.681573       5.662055 21.53166 7.455384 17.09306 7.396655 4.438599       10.50206 
1 1 1 11  8  38 o 18.72019 6.433346 5.148988       3.546610 5.704332       4.817223 4.491679       5.240839 19.58855 7.392140 18.51755 7.491377 1.071001       10.52447 
1 1 1 11  8  39 o 12.99498 5.832145 -0.7960438E-02 3.835924 -1.311587      5.617023 1.131338       5.251078 14.25503 6.638752 15.33730 6.857967 -1.082273      9.544880 
1 1 1 11  8  40 o 20.67521 6.438682 7.114236       3.590853 6.655966       4.917625 7.637680       5.255682 19.34378 7.428126 20.26031 7.703888 -0.9165382     10.70173 
1 1 1 11  8  41 o 23.09770 6.337507 9.188606       3.674315 8.845304       5.044325 9.576630       5.362820 20.76539 7.616102 21.25794 7.843276 -0.4925480     10.93261 
1 1 1 11  8  42 o 12.36390 5.634150 0.6659236      3.745229 2.047854       4.653506 -1.875111      6.310191 13.96272 6.330289 13.10551 6.354594 0.8572130      8.969584 
1 1 1 11  8  43 o 11.54669 5.339848 0.2220435      3.538051 0.2897466      4.653196 0.1292632      5.447218 12.49702 5.890521 12.91327 6.168514 -0.4162502     8.529290 
1 1 1 11  9  0  o 603.7806 7.143848 4446.760       105.1108 4466.902       149.2135 4426.920       148.0912 604.8102 10.12402 602.1015 10.09307 2.708679       14.29566 
1 1 1 11  9  1  o 237.8222 4.528626 689.4623       26.24551 0.000000       0.000000 689.4623       26.24551 ?        ?        237.8222 4.528626 0.000000       4.528626 
1 1 1 11  9  2  f 384.9303 5.167106 1806.515       48.46916 1885.062       78.37945 1757.879       61.67577 393.0246 8.183638 379.6345 6.666729 13.39005       10.55543 
1 1 1 11  9  3  o 289.8467 5.199751 1024.314       36.72713 1024.985       62.67211 1023.963       45.32555 289.6201 8.890457 289.7463 6.419321 -0.1262207     10.96576 
1 1 1 11  9  4  o 401.7465 5.370728 1968.073       52.58008 1935.854       81.81916 1990.741       68.62716 398.2221 8.431280 403.9479 6.971633 -5.725800      10.94030 
1 1 1 11  9  5  o 589.3336 6.984303 4237.763       100.3045 4322.677       143.4458 4156.521       140.3101 594.7894 9.896658 583.2501 9.871838 11.53931       13.97845 
1 1 1 11  9  6  o 332.4915 4.565932 1347.887       36.99525 1306.927       46.28020 1420.390       61.57338 327.3343 5.801866 341.1333 7.406838 -13.79901      9.408660 
1 1 1 11  9  7  o 630.1964 9.153843 4853.474       140.5774 4879.871       198.8004 4827.073       198.8125 630.9740 12.92914 627.5306 13.00088 3.443420       18.33536 
1 1 1 11  9  8  o 374.8849 5.706206 1714.647       52.12925 1733.771       73.51337 1695.305       73.93221 376.7292 8.007574 372.5100 8.144411 4.219208       11.42159 
1 1 1 11  9  9  o 266.1328 6.219576 864.5422       40.33624 910.0931       58.15657 822.3175       55.99302 272.6727 8.763658 259.1600 8.879159 13.51276       12.47562 
1 1 1 11  9  10 o 198.0412 7.242226 479.8572       34.89248 479.8572       34.89248 0.000000       0.000000 198.0412 7.242226 ?        ?        0.000000       7.242226 
1 1 1 11  9  11 o 97.64681 4.399775 116.5520       10.44257 131.8519       14.43415 99.74979       15.12620 103.7630 5.730634 90.08084 6.944235 13.68212       9.003475 
1 1 1 11  9  12 o 152.1135 2.958923 282.1073       10.96825 288.5820       12.33774 257.7028       23.95302 153.8377 3.291065 145.0331 6.796208 8.804642       7.551129 
1 1 1 11  9  13 o 222.1030 4.394616 602.0282       23.78546 626.3542       29.12499 553.3147       41.21494 226.4650 5.277505 212.3873 7.977423 14.07770       9.565110 
1 1 1 11  9  14 o 183.2553 2.916681 409.5210       13.02512 418.1487       16.80801 396.5511       20.60802 185.1276 3.725711 180.1512 4.698226 4.976395       5.996186 
1 1 1 11  9  15 o 73.47799 2.350691 65.89119       4.203680 66.19827       5.020644 65.17112       7.688125 73.62397 2.803485 72.93076 4.345576 0.6932068      5.171418 
1 1 1 11  9  16 o 64.00436 2.801116 50.05770       4.358366 52.85421       5.637720 45.90391       6.870952 65.71754 3.533344 61.12340 4.647736 4.594139       5.838319 
1 1 1 11  9  17 o 242.0420 4.012548 715.3647       23.66721 698.6149       32.84090 733.4636       34.13773 238.9397 5.640152 244.8113 5.722253 -5.871643      8.034643 
1 1 1 11  9  18 o 173.1464 3.261267 365.8622       13.76056 357.8788       19.06058 374.5525       19.88641 171.0558 4.576701 174.9847 4.667757 -3.928925      6.537136 
1 1 1 11  9  19 o 135.2726 2.932544 223.2796       9.666975 223.6055       13.41941 222.9280       13.93764 135.2201 4.077111 134.9945 4.242059 0.2256165      5.883698 
1 1 1 11  9  20 o 73.29461 3.385065 65.73402       6.029771 66.33061       6.843639 63.66377       12.74864 73.58386 3.829708 71.54871 7.419398 2.035149       8.349499 
1 1 1 11  9  21 o 183.7276 3.426160 412.2953       15.33974 406.4518       21.23081 418.6776       22.18818 182.1490 4.787188 184.8398 4.930353 -2.690857      6.872085 
1 1 1 11  9  22 o 52.36428 3.220472 33.61496       4.089637 33.25457       5.403726 34.09813       6.256848 51.95626 4.306606 52.52551 4.946437 -0.5692482     6.558514 
1 1 1 11  9  23 o 150.9213 3.167599 278.2370       11.64976 279.5471       16.18931 276.8300       16.77688 151.0338 4.403338 150.2606 4.587106 0.7731934      6.358532 
1 1 1 11  9  24 o 91.02753 3.418373 101.4336       7.569306 108.3434       8.916811 83.61266       14.31994 94.01630 3.900449 81.93044 7.246975 12.08586       8.229955 
1 1 1 11  9  25 o 116.0151 3.012423 164.5762       8.509400 171.2977       11.95873 157.6826       12.11094 118.1752 4.159105 113.3315 4.393538 4.843758       6.049904 
1 1 1 11  9  26 o 114.9649 4.405910 162.3940       12.32061 0.000000       0.000000 162.3940       12.32061 ?        ?        114.9649 4.405910 0.000000       4.405910 
1 1 1 11  9  27 o 53.86513 3.477706 35.67357       4.540560 40.84409       6.240839 29.85846       6.618427 57.48973 4.490277 48.86938 5.662184 8.620346       7.226542 
1 1 1 11  9  28 o 92.54003 3.072514 104.9267       6.919218 118.5424       9.597975 90.19382       9.983936 98.17788 4.020217 85.43529 4.814926 12.74259       6.272612 
1 1 1 11  9  29 o 47.75448 3.952435 28.22202       4.558389 31.86050       6.036976 23.39609       6.952636 50.54610 4.965129 42.73907 6.911349 7.807030       8.509951 
1 1 1 11  9  30 o 109.3892 3.158700 146.9464       8.411317 162.2029       11.72031 130.7430       12.07857 114.5913 4.204246 102.6317 4.843114 11.95959       6.413380 
1 1 1 11  9  31 o 15.09547 6.282653 0.8138372      3.822265 1.322561       4.511882 -0.4793272     7.193557 16.68646 6.874220 19.03671 8.286647 -2.350250      10.76677 
1 1 1 11  9  32 o 93.87588 4.208379 109.7632       9.602835 109.7632       9.602835 0.000000       0.000000 93.87588 4.208379 ?        ?        0.000000       4.208379 
1 1 1 11  9  33 o 58.36007 3.549620 42.40982       5.024295 42.00926       6.606870 42.95916       7.737082 57.59990 4.749088 57.85742 5.555798 -0.2575188     7.308949 
1 1 1 11  9  34 o 55.15080 3.643840 38.14492       4.869751 39.73499       6.367767 35.90496       7.557889 55.76062 4.730842 52.22807 6.050048 3.532543       7.680101 
1 1 1 11  9  35 f 28.85407 5.818490 11.29508       3.949847 8.998841       4.999250 15.10975       6.443539 25.11762 7.555070 32.08421 8.208724 -6.966591      11.15626 
1 1 1 11  9  36 f 55.79736 3.665251 39.69817       4.956122 38.40094       6.427248 41.60091       7.784069 53.91018 4.947478 55.28016 5.867837 -1.369987      7.675224 
1 1 1 11  9  37 f 14.20812 6.350027 -0.3062584     4.496317 -2.409703      8.105385 0.6287611      5.404039 17.01662 7.941467 15.97093 7.059456 1.045686       10.62557 
1 1 1 11  9  38 o 32.82127 5.503208 15.42531       4.245909 21.07165       6.545139 11.32269       5.579132 36.06688 7.682342 25.70927 8.028649 10.35761       11.11205 
1 1 1 11  9  39 o 9.767886 4.738936 -4.431838      3.522363 0.5794573      5.225379 -8.605368      4.768640 14.87714 6.730083 10.16681 5.044802 4.710332       8.410948 
1 1 1 11  9  40 o 23.98266 6.208271 9.371351       3.656308 11.47309       5.070343 7.094389       5.277477 24.75369 7.641453 19.54200 7.642319 5.211697       10.80726 
1 1 1 11  9  41 o 10.14847 4.834267 -2.269036      3.297215 -0.8854110     4.486551 -3.893905      4.861974 12.45320 5.842936 11.45016 5.558018 1.003046       8.064209 
1 1 1 11  9  42 o 18.61712 6.512928 6.774499       3.642248 5.690100       4.949664 8.055132       5.378899 16.61438 7.045603 18.44960 7.542548 -1.835220      10.32136 
1 1 1 11  9  43 o 13.03464 5.823050 2.098680       3.776680 -0.2039253     4.320466 9.557668       7.776083 11.91680 5.634836 17.20742 7.943030 -5.290618      9.738743 
1 1 1 11  10 0  o 158.2156 2.818222 305.0609       10.86577 288.6941       17.33491 315.6530       13.94534 153.8186 4.629895 160.9299 3.555956 -7.111221      5.837873 
1 1 1 11  10 1  o 219.8186 3.670926 588.9514       19.66420 614.7572       28.51915 565.5637       27.15008 224.5449 5.211914 215.3746 5.172978 9.170380       7.343279 
1 1 1 11  10 2  o 209.6486 4.074199 535.7682       20.81470 516.0142       34.73562 546.8356       25.99969 205.5463 6.944698 211.7788 5.037901 -6.232452      8.579585 
1 1 1 11  10 3  o 524.6976 6.860351 3358.828       87.71857 3210.994       134.2901 3468.846       115.8484 512.5372 10.75183 532.9831 8.919504 -20.44592      13.96995 
1 1 1 11  10 4  o 329.7519 4.534453 1325.702       36.43747 1326.025       57.23030 1325.481       47.25224 329.6444 7.124333 329.6557 5.882009 -0.1135254E-01 9.238731 
1 1 1 11  10 5  o 411.4039 5.010000 2063.941       50.22758 2006.225       69.35458 2127.602       72.83845 405.4516 7.019401 417.5230 7.158865 -12.07147      10.02603 
1 1 1 11  10 6  o 452.3232 6.721613 2496.967       74.08981 2483.139       103.7960 2511.332       105.7901 450.7101 9.450338 453.2417 9.578091 -2.531647      13.45543 
1 1 1 11  10 7  o 82.25645 2.291034 82.52306       4.587905 82.46144       5.201988 82.73883       9.733776 82.21402 2.599762 82.22054 4.880035 -0.6523132E-02 5.529331 
1 1 1 11  10 8  o 306.4829 5.652026 1146.199       42.21302 1072.814       69.40048 1189.294       53.18219 295.9383 9.636172 312.0689 6.993258 -16.13062      11.90636 
1 1 1 11  10 9  o 153.9484 4.641104 289.3623       17.39148 289.9124       23.99245 288.7531       25.24591 153.9530 6.409163 153.6108 6.760806 0.3422089      9.315893 
1 1 1 11  10 10 o 360.3777 7.893483 1588.359       69.32066 1514.611       94.63900 1673.728       101.8232 351.1066 11.07487 369.0337 11.33600 -17.92712      15.84795 
1 1 1 11  10 11 o 286.3617 9.310265 1006.181       64.88367 1006.181       64.88367 0.000000       0.000000 286.3617 9.310265 ?        ?        0.000000       9.310265 
1 1 1 11  10 12 o 462.7438 9.847789 2629.317       111.0492 2419.184       148.1204 2899.032       167.8108 442.0433 13.76714 483.6660 14.25319 -41.62268      19.81635 
1 1 1 11  10 13 o 242.1618 8.271671 719.8463       48.74128 719.8463       48.74128 0.000000       0.000000 242.1618 8.271671 ?        ?        0.000000       8.271671 
1 1 1 11  10 14 o 158.4084 6.642361 307.6906       25.58421 307.6906       25.58421 0.000000       0.000000 158.4084 6.642361 ?        ?        0.000000       6.642361 
1 1 1 11  10 15 o 126.1130 2.754713 193.9596       8.465881 203.2872       12.11178 185.0488       11.83804 128.9975 3.857259 123.0611 3.952633 5.936348       5.522840 
1 1 1 11  10 16 o 260.6140 3.747399 829.0585       23.79928 829.9183       30.55038 827.7314       37.95724 260.5969 4.810733 260.0411 5.989858 0.5558167      7.682549 
1 1 1 11  10 17 o 190.4085 3.398232 442.4729       15.76796 430.9203       21.79099 455.1700       22.84484 187.6984 4.767952 192.8959 4.863800 -5.197433      6.811014 
1 1 1 11  10 18 o 122.0348 2.783612 181.6772       8.278057 173.0228       11.23419 191.9588       12.24488 118.9619 3.880426 125.2945 4.015573 -6.332642      5.584133 
1 1 1 11  10 19 o 184.5878 3.391705 415.9929       15.25658 402.6486       20.97481 430.9850       22.23218 181.3667 4.749835 187.6229 4.866615 -6.256226      6.800358 
1 1 1 11  10 20 o 65.03535 2.738185 51.70105       4.329877 48.59904       5.718897 55.86758       6.627918 62.95985 3.744369 67.48673 4.048780 -4.526882      5.514791 
1 1 1 11  10 21 o 72.12988 3.324401 63.67669       5.827674 61.63371       6.511482 71.89983       13.06367 70.91365 3.781702 76.08135 7.129177 -5.167702      8.070095 
1 1 1 11  10 22 o 232.5656 3.959483 661.4725       22.43985 622.7988       30.35637 708.0652       33.31971 225.2675 5.529874 240.1414 5.693744 -14.87392      7.937142 
1 1 1 11  10 23 o 117.8117 3.433030 169.7837       9.845517 165.4286       11.40173 182.5513       19.52198 116.2023 4.032537 121.5284 6.616849 -5.326073      7.748809 
1 1 1 11  10 24 o 17.57093 5.966841 3.519611       3.049090 -1.166015      3.863929 11.25298       4.963977 13.53873 5.977530 29.59754 6.994005 -16.05882      9.200379 
1 1 1 11  10 25 o 40.30919 4.002367 20.09449       3.879617 18.41619       5.319236 22.00200       5.670841 38.22902 5.899402 41.89901 5.701829 -3.669983      8.204498 
1 1 1 11  10 26 o 35.75373 4.306068 15.90622       3.676344 19.82524       5.035016 11.43105       5.380429 39.78289 5.327384 29.74725 7.441541 10.03564       9.151916 
1 1 1 11  10 27 o 50.41653 4.568343 31.49505       5.551790 38.02492       10.70981 29.09553       6.492196 54.49625 8.328504 48.22798 5.629806 6.268265       10.05279 
1 1 1 11  10 28 o 78.25785 3.024556 75.07960       5.757145 75.26263       7.735415 74.85233       8.619872 78.15957 4.075381 77.83694 4.564458 0.3226318      6.119069 
1 1 1 11  10 29 o 33.96057 4.751662 14.51010       3.824913 13.38501       4.913177 16.24104       6.094085 32.19032 6.487645 35.32845 7.319451 -3.138130      9.780792 
1 1 1 11  10 30 o 80.87644 3.462109 80.56585       6.807582 78.51662       8.188238 85.15276       12.25055 79.62674 4.235067 82.21309 6.159524 -2.586349      7.474994 
1 1 1 11  10 31 o 24.22235 6.080524 7.683520       3.583303 8.775703       4.587574 5.974515       5.738613 25.79674 7.082793 22.77744 8.155443 3.019295       10.80172 
1 1 1 11  10 32 o 59.74311 3.422519 44.25529       4.961909 43.48964       6.458302 45.35837       7.751884 58.83878 4.539281 59.73952 5.382538 -0.9007454     7.041079 
1 1 1 11  10 33 o 88.11240 3.625259 96.71507       7.767541 99.12691       8.931938 89.23146       15.73357 88.91582 4.133526 81.23689 8.053535 7.678940       9.052374 
1 1 1 11  10 34 o 56.20186 3.565284 39.62654       4.857765 38.48004       6.184497 41.47327       7.849105 54.81989 4.673995 56.20383 5.814718 -1.383938      7.460374 
1 1 1 11  10 35 o 42.69027 4.233371 23.44112       4.346093 28.69125       5.620285 15.63212       6.854431 46.79838 5.005903 32.23215 8.576788 14.56623       9.930779 
1 1 1 11  10 36 o 36.48329 4.607015 17.59591       4.004747 16.63142       5.048560 19.23279       6.577000 34.37970 6.256414 35.78675 7.765280 -1.407047      9.972075 
1 1 1 11  10 37 o 17.02027 6.472729 3.672543       3.710387 6.898618       5.396150 0.7794435      5.110089 21.30254 7.866215 15.63925 6.890820 5.663285       10.45757 
1 1 1 11  10 38 f 18.85378 7.064668 5.385711       4.382949 11.37691       9.201922 3.627640       4.984711 23.66583 9.789865 17.30189 7.185615 6.363939       12.14391 
1 1 1 11  10 39 o 14.60016 5.976641 2.409816       3.382816 0.3770639      4.518253 5.002756       5.102987 13.96266 6.292633 18.08863 7.364813 -4.125978      9.686986 
1 1 1 11  10 40 o 17.59054 6.515882 5.154359       3.707656 4.486991       5.443104 5.732050       5.064209 17.07596 7.319094 18.08455 7.346560 -1.008587      10.37020 
1 1 1 11  10 41 o 29.64300 5.710757 14.22508       3.975652 16.21408       5.463287 11.98619       5.796322 28.53896 7.685409 22.79003 8.191946 5.748928       11.23270 
1 1 1 11  10 42 o 14.53506 6.199425 3.420525       3.870500 6.921564       4.657096 -4.398506      6.959742 17.72922 7.100420 12.55526 6.205657 5.173953       9.430065 
1 1 1 11  10 43 o 8.488883 4.197025 -4.569016      3.191927 -6.775295      4.101417 -1.180244      5.083053 9.007482 4.502658 11.97671 5.782030 -2.969230      7.328424 
1 1 1 11  11 0  o 315.6533 4.897994 1214.803       37.67599 1356.295       80.91505 1175.635       42.57258 333.0444 9.981170 310.4911 5.626584 22.55334       11.45784 
1 1 1 11  11 1  o 327.9057 4.508289 1310.844       36.02441 1285.776       56.07846 1328.456       47.00620 324.6195 7.089008 330.0374 5.844615 -5.417938      9.187685 
1 1 1 11  11 2  o 206.9740 3.195804 522.1180       16.11877 519.1622       25.17288 524.1721       20.98510 206.3422 5.006207 207.3593 4.152899 -1.017120      6.504513 
1 1 1 11  11 3  o 623.2474 9.029982 4745.081       137.1461 4534.628       264.8246 4822.208       160.3192 606.7251 17.93111 628.0134 10.47564 -21.28833      20.76689 
1 1 1 11  11 4  o 462.8683 6.834508 2614.669       77.09049 2561.436       150.5761 2633.579       89.74415 456.8673 13.53970 464.4104 7.929908 -7.543060      15.69099 
1 1 1 11  11 5  o 316.9479 4.000489 1224.740       30.89847 1206.349       42.86153 1244.637       44.58338 314.4688 5.593120 319.4110 5.727790 -4.942230      8.005658 
1 1 1 11  11 6  o 738.1874 8.701561 6660.645       156.5308 6605.754       219.8372 6717.092       222.9313 733.9843 12.29075 740.1176 12.36045 -6.133240      17.43110 
1 1 1 11  11 7  o 493.2852 8.463812 2974.838       101.7420 2854.822       170.7887 3040.859       126.6719 481.4326 14.57430 498.2948 10.43176 -16.86218      17.92295 
1 1 1 11  11 8  o 273.9124 5.211963 915.4874       34.78957 907.4106       59.14016 919.7612       43.02048 272.1798 8.928500 274.4481 6.432488 -2.268250      11.00432 
1 1 1 11  11 9  o 354.8839 7.796741 1540.123       67.42728 1491.412       92.99631 1594.112       97.90619 348.4413 10.96581 360.1961 11.16760 -11.75479      15.65134 
1 1 1 11  11 10 o 152.4412 6.454191 284.4512       23.92194 284.4512       23.92194 0.000000       0.000000 152.4412 6.454191 ?        ?        0.000000       6.454191 
1 1 1 11  11 11 o 293.2107 9.476588 1055.928       67.62342 1055.928       67.62342 0.000000       0.000000 293.2107 9.476588 ?        ?        0.000000       9.476588 
1 1 1 11  11 12 o 53.18138 7.307079 35.26426       9.219685 35.26426       9.219685 0.000000       0.000000 53.18138 7.307079 ?        ?        0.000000       7.307079 
1 1 1 11  11 13 o 360.6089 7.940087 1594.541       69.77468 1635.844       99.86294 1555.145       97.53098 363.9139 11.27441 354.8072 11.29452 9.106781       15.95865 
1 1 1 11  11 14 o 74.46314 4.594700 67.97646       8.296871 67.37206       11.69109 68.58971       11.77647 73.89410 6.560576 74.56584 6.547364 -0.6717377     9.268718 
1 1 1 11  11 15 o 93.69943 4.504604 107.4896       10.25547 120.5139       14.51448 94.50494       14.49240 99.04662 6.042224 87.55225 6.847038 11.49438       9.131835 
1 1 1 11  11 16 o 117.0702 3.248579 167.3602       9.258824 169.0916       17.92516 166.7301       10.81296 117.3232 6.292665 116.8019 3.803979 0.5213089      7.353087 
1 1 1 11  11 17 o 128.6061 2.829377 201.7654       8.867243 211.3984       12.79843 192.8726       12.29694 131.5021 3.998461 125.5998 4.022839 5.902275       5.671942 
1 1 1 11  11 18 o 160.4029 3.737222 314.2247       14.60821 319.8023       26.91857 311.8964       17.39200 161.2333 6.866838 159.6652 4.474369 1.568130       8.195940 
1 1 1 11  11 19 o 273.5755 4.411340 915.1859       29.40924 922.8953       41.49763 907.4069       41.68490 274.2468 6.209344 271.9105 6.290956 2.336304       8.839235 
1 1 1 11  11 20 o 165.8729 3.198034 335.9406       12.92691 341.0503       18.07258 330.5876       18.49764 166.9090 4.447250 164.2953 4.624742 2.613647       6.416095 
1 1 1 11  11 21 o 304.3129 4.820071 1134.261       35.74455 1131.417       50.11551 1137.207       50.99686 303.1583 6.783700 303.8854 6.886483 -0.7271423     9.666553 
1 1 1 11  11 22 o 168.7544 3.841033 348.2656       15.79572 341.1147       18.49730 367.5239       30.35539 166.8279 4.554178 172.4070 7.241238 -5.579117      8.554301 
1 1 1 11  11 23 o 141.9108 3.437991 246.1742       11.88930 243.2365       18.51665 248.2349       15.50848 140.6243 5.413497 142.2742 4.478663 -1.649902      7.025979 
1 1 1 11  11 24 o 52.09933 3.122813 33.28966       3.946538 31.49090       5.050775 36.10954       6.323926 50.53922 4.137211 54.03088 4.854657 -3.491661      6.378417 
1 1 1 11  11 25 o 69.63955 2.926528 59.36948       4.955364 52.47954       6.338130 70.20349       7.947824 65.32722 4.000539 75.53854 4.335826 -10.21132      5.899467 
1 1 1 11  11 26 o 92.17197 2.885449 103.9569       6.473112 102.5549       8.645322 105.7459       9.765397 91.38870 3.890877 92.71675 4.334102 -1.328049      5.824377 
1 1 1 11  11 27 o 22.05652 7.151309 5.898671       4.392437 3.012626       8.540095 6.936743       5.121829 23.33203 9.517065 23.84747 7.721504 -0.5154362     12.25545 
1 1 1 11  11 28 o 36.50610 4.156892 16.59605       3.632228 13.50704       4.635335 21.51010       5.846446 32.47145 6.081349 41.21095 5.997460 -8.739498      8.541215 
1 1 1 11  11 29 o 36.13445 4.722208 16.40323       4.058778 15.93471       4.870518 17.46805       7.342658 35.32722 5.863010 36.33764 8.452033 -1.010422      10.28648 
1 1 1 11  11 30 o 23.65603 6.020707 7.286136       3.478986 7.988746       4.397920 6.111294       5.686957 24.75731 6.986733 22.99105 8.130437 1.766260       10.72000 
1 1 1 11  11 31 o 22.33143 6.116158 6.520873       3.425690 3.592062       4.324742 11.45348       5.612454 18.77601 7.021270 29.22068 7.754312 -10.44467      10.46076 
1 1 1 11  11 32 o 25.12986 5.772058 8.331708       3.460191 6.899838       4.305943 10.94180       5.813587 22.92337 7.035748 28.32850 8.046002 -5.405136      10.68831 
1 1 1 11  11 33 o 20.04432 6.186606 5.265362       3.323629 7.587188       4.132792 1.014387       5.592075 23.68264 6.802603 17.54262 7.465931 6.140020       10.10027 
1 1 1 11  11 34 o 47.79919 4.447762 29.27041       5.121366 29.26394       5.698808 29.29759       11.67611 47.49471 4.998682 42.75992 11.10699 4.734791       12.17999 
1 1 1 11  11 35 o 47.28855 3.749558 28.48730       4.285533 25.30554       5.406372 33.86659       7.029666 43.70881 5.176099 50.08966 5.870291 -6.380852      7.826386 
1 1 1 11  11 36 o 12.81742 5.653553 -0.1977558     3.448459 -0.3603292     4.648966 0.1122623E-02  5.141922 14.50778 6.472271 15.40119 6.842698 -0.8934088     9.418747 
1 1 1 11  11 37 o 7.381217 3.694385 -7.140730      2.801189 -7.918953      3.471117 -5.687505      4.743335 8.446719 4.209805 11.45739 5.544469 -3.010672      6.961579 
1 1 1 11  11 38 o 15.00879 5.965351 2.674537       3.262327 3.673405       4.292814 1.309081       5.019114 16.82251 6.789199 15.36175 6.796165 1.460762       9.606304 
1 1 1 11  11 39 o 15.39761 6.483153 2.718890       4.142208 13.26570       9.405417 0.1810117      4.613739 23.19894 9.768628 13.83076 6.283379 9.368179       11.61495 
1 1 1 11  11 40 o 11.14040 5.106758 -0.5814778     3.137091 1.278999       4.224464 -2.868814      4.684083 13.81275 6.165449 11.86154 5.680681 1.951209       8.383490 
1 1 1 11  11 41 o 9.988503 4.835371 -3.279575      3.615804 -2.397892      4.416543 -5.071783      6.296809 11.42755 5.484247 12.22462 6.015525 -0.7970648     8.140241 
1 1 1 11  11 42 o 17.20995 6.333939 5.802125       3.493744 9.712672       4.808437 1.428886       5.084952 20.40378 7.443444 13.52471 6.304605 6.879070       9.754635 
1 1 1 11  11 43 o 10.17786 4.816588 -1.053504      3.169198 -2.902955      4.113196 1.648563       4.971714 10.35737 5.046690 13.18048 6.173452 -2.823111      7.973744 
1 1 1 11  12 0  o 260.5681 3.761857 827.6364       23.88689 870.1523       38.64418 801.3477       30.38733 267.0895 5.937331 256.3586 4.864167 10.73090       7.675416 
1 1 1 11  12 1  o 422.4180 6.307053 2176.976       64.92396 2178.953       130.1570 2176.321       74.90853 421.5923 12.68332 422.2637 7.279665 -0.6714783     14.62395 
1 1 1 11  12 2  o 520.9676 6.821097 3312.272       86.59664 3314.600       136.7747 3310.715       111.8758 520.5240 10.78273 520.5642 8.819129 -0.4016113E-01 13.92998 
1 1 1 11  12 3  o 229.3803 3.434407 641.3699       19.19747 656.4388       30.40018 631.3748       24.75872 231.9856 5.377482 227.5516 4.464905 4.433990       6.989470 
1 1 1 11  12 4  o 114.7107 3.403809 160.5456       9.504399 154.8034       13.59745 166.0314       13.29031 112.5510 4.969858 116.5870 4.687434 -4.035973      6.831656 
1 1 1 11  12 5  o 289.8126 4.545454 1024.326       32.10189 1001.465       44.69893 1048.677       46.13287 286.4313 6.403841 293.1006 6.458887 -6.669281      9.095406 
1 1 1 11  12 6  o 438.5822 9.331593 2353.715       99.73391 2239.309       136.0864 2486.461       146.5885 426.7165 13.10250 449.5764 13.39506 -22.85992      18.73775 
1 1 1 11  12 7  o 103.2012 4.457405 130.1518       11.18350 131.1916       14.84558 128.7875       17.00521 103.4991 5.910632 102.4523 6.850575 1.046791       9.047980 
1 1 1 11  12 8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  12 9  o 381.3330 11.74410 1790.117       109.0040 1790.117       109.0040 0.000000       0.000000 381.3330 11.74410 ?        ?        0.000000       11.74410 
1 1 1 11  12 10 f 371.4431 8.113560 1689.668       73.44122 1634.015       101.2631 1751.424       106.6709 364.1942 11.42403 376.9907 11.62515 -12.79642      16.29886 
1 1 1 11  12 11 f 197.5381 5.201131 476.9113       25.01536 479.7791       35.13308 473.9624       35.62620 197.8393 7.299834 196.6103 7.449262 1.228943       10.42972 
1 1 1 11  12 12 o 197.2085 5.221957 475.4756       25.07337 468.8548       34.88800 482.5484       36.05918 195.5078 7.335791 198.3211 7.474614 -2.813324      10.47300 
1 1 1 11  12 13 o 44.07677 8.747756 24.69534       9.064331 24.69534       9.064331 0.000000       0.000000 44.07677 8.747756 ?        ?        0.000000       8.747756 
1 1 1 11  12 14 o 269.8827 6.385618 891.8484       41.99659 914.7910       59.89096 869.6547       58.90559 272.5197 9.030828 265.6782 9.111874 6.841461       12.82896 
1 1 1 11  12 15 o 104.0688 4.506771 132.5591       11.40228 126.5913       15.80288 139.0399       16.46819 101.4550 6.424851 106.3512 6.383680 -4.896179      9.057047 
1 1 1 11  12 16 o 77.65479 4.802993 73.99706       9.044523 75.67611       12.78702 72.31597       12.79476 78.26610 6.770925 76.46842 6.941723 1.797676       9.697058 
1 1 1 11  12 17 o 198.7641 5.343661 483.9094       25.85942 474.2206       35.97980 494.2618       37.19181 196.2541 7.537231 200.3378 7.632084 -4.083710      10.72654 
1 1 1 11  12 18 o 130.7704 3.424091 208.9374       10.90227 205.8577       20.40558 210.1677       12.89739 129.3423 6.494774 131.0846 4.042347 -1.742249      7.650010 
1 1 1 11  12 19 o 93.64275 2.608428 107.0690       5.946560 102.3308       8.055318 112.7435       8.815398 91.45554 3.621563 95.98626 3.776113 -4.530724      5.232088 
1 1 1 11  12 20 o 71.80242 2.614274 62.99291       4.566682 66.40416       6.201716 58.95240       6.749531 73.64804 3.465246 69.32391 4.012493 4.324127       5.301701 
1 1 1 11  12 21 o 76.49321 3.632416 71.67513       6.751683 72.98818       7.837948 67.89832       13.29304 77.12558 4.185995 73.79832 7.495533 3.327255       8.585195 
1 1 1 11  12 22 o 79.96043 2.965350 78.18837       5.768120 81.29866       8.338986 75.33504       7.987095 81.38811 4.218919 78.34071 4.199089 3.047401       5.952447 
1 1 1 11  12 23 o 152.3193 3.744087 283.8315       13.89751 279.7687       16.23233 294.9857       26.89630 151.0438 4.414772 154.3009 7.172623 -3.257095      8.422394 
1 1 1 11  12 24 o 119.4208 2.896269 174.2365       8.428590 169.9350       11.32938 179.5682       12.61338 117.7350 3.954406 120.9658 4.285679 -3.230774      5.831327 
1 1 1 11  12 25 o 22.40954 5.229213 6.425547       2.803251 8.351973       3.401333 2.346082       4.949652 25.54612 5.616953 18.53560 7.354057 7.010523       9.253773 
1 1 1 11  12 26 o 65.10380 2.979062 51.94115       4.713781 50.06926       6.066116 54.79429       7.489115 63.78231 3.921745 66.60571 4.643131 -2.823395      6.077726 
1 1 1 11  12 27 o 26.14789 4.991230 8.705165       3.064410 7.340412       3.699229 11.68998       5.470701 23.88353 6.275428 29.98757 7.504871 -6.104040      9.782846 
1 1 1 11  12 28 o 59.63766 4.804875 44.19371       6.923887 53.92776       11.89855 39.20998       8.513815 65.02013 7.656072 55.72918 6.384214 9.290951       9.968632 
1 1 1 11  12 29 o 62.89498 3.135440 48.65719       4.790480 45.68910       6.144857 53.25620       7.649004 60.71763 4.178468 65.39617 4.833897 -4.678543      6.389534 
1 1 1 11  12 30 o 24.49393 5.588134 7.800872       3.261539 6.410206       4.177885 9.970920       5.218909 22.41515 6.939315 27.45776 7.560633 -5.042610      10.26242 
1 1 1 11  12 31 o 13.13973 5.564906 0.2864895      3.081133 1.280601       3.874034 -1.424824      5.082889 15.57381 6.387872 15.25809 6.789773 0.3157177      9.322335 
1 1 1 11  12 32 f 47.94543 3.746027 28.74676       4.342056 28.81581       5.582655 28.64103       6.908147 47.58410 4.883637 46.84577 6.203741 0.7383308      7.895335 
1 1 1 11  12 33 o 15.78528 5.992972 2.502787       3.177465 1.396566       3.951025 4.528192       5.346194 15.57603 6.426386 20.34211 7.761558 -4.766085      10.07672 
1 1 1 11  12 34 o 41.71051 4.066593 22.22436       4.081017 26.09136       5.265982 16.40958       6.457418 44.77261 4.906766 33.63821 7.995705 11.13440       9.381239 
1 1 1 11  12 35 o 61.71255 4.533193 49.57707       6.769751 53.49637       8.127079 40.69374       12.23539 63.37671 5.311017 49.62666 10.44825 13.75005       11.72062 
1 1 1 11  12 36 o 19.41986 6.253889 5.377752       3.362755 9.975681       4.361342 -1.363159      5.280783 25.84168 6.825366 14.58706 6.663664 11.25463       9.538870 
1 1 1 11  12 37 o 38.42380 4.314480 19.85664       3.970135 22.69014       5.242426 16.04627       6.079308 39.96176 5.531496 31.05749 7.987677 8.904274       9.715988 
1 1 1 11  12 38 o 13.62167 5.745099 1.509875       3.261593 3.238973       4.201589 -1.112105      5.173904 16.22111 6.652805 13.89385 6.436518 2.327251       9.256813 
1 1 1 11  12 39 o 14.06052 6.242980 1.139522       4.273124 7.229115       8.410550 -0.9793458     4.961148 19.58092 8.722415 13.39038 6.237100 6.190545       10.72296 
1 1 1 11  12 40 o 11.81131 5.451305 -0.5390831     3.660523 0.1928032      4.574712 -1.841702      6.103103 13.26476 6.112057 13.55295 6.489004 -0.2881918     8.914282 
1 1 1 11  12 41 o 11.10230 5.173633 -0.6812371     3.419587 1.526303       4.755767 -3.044350      4.920492 13.72445 6.289951 11.57637 5.612734 2.148082       8.430081 
1 1 1 11  12 42 o 13.43105 5.790983 2.584201       3.445917 3.881242       4.676056 1.042687       5.097728 14.81379 6.556473 13.21599 6.209475 1.597797       9.030223 
1 1 1 11  13 0  f 308.5358 5.504416 1161.193       41.38595 1092.457       68.86416 1200.055       51.78005 298.7882 9.469833 313.5656 6.776383 -14.77734      11.64462 
1 1 1 11  13 1  o 353.8433 6.220307 1527.849       53.63631 1450.056       90.46897 1570.013       66.60426 344.0297 10.80454 358.5576 7.622667 -14.52792      13.22283 
1 1 1 11  13 2  o 171.4976 3.172258 358.5107       13.25753 337.5506       18.29585 381.6838       19.23754 166.3121 4.518507 176.8611 4.467133 -10.54890      6.353911 
1 1 1 11  13 3  o 179.5426 3.253764 392.9561       14.23605 408.6043       20.52818 378.4580       19.75946 182.9817 4.607361 176.0978 4.608488 6.883896       6.516589 
1 1 1 11  13 4  o 136.3013 2.840175 226.4504       9.433681 226.2038       13.31155 226.6993       13.37113 136.1417 4.016764 136.2901 4.030370 -0.1484222     5.690191 
1 1 1 11  13 5  o 212.4184 3.637167 550.1589       18.82745 531.3465       35.19040 557.7033       22.28518 208.4522 6.937247 213.8419 4.276489 -5.389694      8.149463 
1 1 1 11  13 6  f 114.7815 3.630468 160.8085       10.14202 152.4146       16.29594 166.1153       12.95727 111.5674 6.016105 116.6037 4.568848 -5.036263      7.554329 
1 1 1 11  13 7  o 93.45117 3.682675 106.6640       8.370148 109.2783       13.25189 104.9288       10.79631 94.42764 5.786728 92.60832 4.800363 1.819321       7.518624 
1 1 1 11  13 8  o 145.1908 4.567105 257.4812       16.13896 255.8422       22.30977 259.2805       23.37538 144.5628 6.348379 145.5042 6.609715 -0.9413605     9.164619 
1 1 1 11  13 9  o 205.8102 5.326663 517.6035       26.69273 559.7391       38.94924 480.2880       36.65369 213.7325 7.489692 197.9445 7.612869 15.78796       10.67948 
1 1 1 11  13 10 o 286.1304 6.610036 1001.393       46.08971 989.2401       64.27725 1014.255       66.12334 283.7047 9.309859 287.2330 9.459695 -3.528259      13.27250 
1 1 1 11  13 11 o 194.1779 5.179328 460.9519       24.48621 470.6071       34.64633 451.3163       34.61115 195.8878 7.270563 191.7994 7.419121 4.088394       10.38771 
1 1 1 11  13 12 o 218.2485 5.545955 582.6823       29.47214 549.4087       40.04554 622.0024       43.53223 211.5125 7.782573 225.0324 7.950834 -13.51987      11.12583 
1 1 1 11  13 13 o 230.0967 5.748528 647.6290       32.23318 642.5838       45.01088 652.9398       46.18082 228.6214 8.091888 230.4214 8.237628 -1.799927      11.54717 
1 1 1 11  13 14 o 81.05402 6.539927 81.00173       12.80806 81.00173       12.80806 0.000000       0.000000 81.05402 6.539927 ?        ?        0.000000       6.539927 
1 1 1 11  13 15 o 229.6963 5.798011 646.2783       32.42812 660.9339       46.07796 631.8964       45.64568 231.6853 8.174095 226.5004 8.283747 5.184906       11.63771 
1 1 1 11  13 16 o 62.23984 5.141586 47.71113       7.728827 51.63803       10.97961 43.85411       10.88147 64.46892 7.106531 59.23638 7.721747 5.232536       10.49420 
1 1 1 11  13 17 o 141.9977 4.768778 246.9037       16.47813 250.7986       23.17746 242.9229       23.43182 142.7763 6.680045 140.4734 6.865834 2.302841       9.579284 
1 1 1 11  13 18 o 144.6853 4.816354 256.4477       16.95794 282.9957       24.65033 232.5949       23.36553 151.6274 6.687726 137.3660 7.003191 14.26147       9.683510 
1 1 1 11  13 19 o 17.44446 5.689461 3.593241       2.777988 0.000000       0.000000 3.593241       2.777988 ?        ?        17.44446 5.689461 0.000000       5.689461 
1 1 1 11  13 20 o 199.1900 5.056562 486.5345       24.52492 538.1620       33.93150 430.0627       35.48777 209.0118 6.670412 186.4301 7.828783 22.58170       10.28515 
1 1 1 11  13 21 o 194.7576 3.519666 463.5867       16.70444 459.4171       23.21569 468.0627       24.05390 193.5334 4.926548 195.3122 5.058080 -1.778732      7.060811 
1 1 1 11  13 22 o 52.89877 2.891841 34.27453       3.713650 38.11954       4.861486 28.88714       5.754528 55.72015 3.599570 48.28048 4.961584 7.439667       6.129782 
1 1 1 11  13 23 o 93.06885 2.747647 105.8734       6.224802 106.8459       8.359611 104.6630       9.325835 93.37920 3.680878 92.34744 4.154706 1.031761       5.550716 
1 1 1 11  13 24 o 206.0963 4.347504 520.8950       21.83466 519.9703       26.01348 523.1000       40.16849 205.5661 5.197078 204.7821 8.065059 0.7839966      9.594519 
1 1 1 11  13 25 o 12.53248 5.024793 0.9236358      2.335005 2.875684       2.752072 -4.092760      4.411745 16.18798 5.661494 12.58562 5.868714 3.602359       8.154406 
1 1 1 11  13 26 o 60.83551 3.194308 45.42060       4.718953 46.52106       5.692974 43.00419       8.435972 61.47635 3.818957 58.65660 5.985567 2.819748       7.100101 
1 1 1 11  13 27 o 31.28252 4.119713 12.23234       3.064284 11.09451       3.765072 14.46472       5.273744 29.49750 5.438147 33.49855 6.694641 -4.001053      8.625060 
1 1 1 11  13 28 o 32.04315 4.234703 12.86493       3.225827 15.29909       3.972363 8.151283       5.527810 34.86654 4.802687 25.41199 7.999687 9.454554       9.330637 
1 1 1 11  13 29 o 43.85309 4.876763 24.14835       5.123518 30.18828       9.987633 21.99127       5.968705 47.64711 8.929832 41.48019 6.085661 6.166920       10.80635 
1 1 1 11  13 30 o 75.60394 2.985476 70.37650       5.489584 66.13422       7.147753 76.47741       8.571698 72.97200 4.035259 78.30585 4.511059 -5.333855      6.052518 
1 1 1 11  13 31 o 59.59140 3.332226 44.00776       4.819710 45.84436       6.435224 41.66137       7.273740 60.45526 4.398191 57.25870 5.272058 3.196560       6.865762 
1 1 1 11  13 32 o 33.27098 4.726171 14.21976       3.724198 15.32753       4.732194 12.41726       6.036334 34.10638 5.907539 29.84105 8.096608 4.265335       10.02268 
1 1 1 11  13 33 o 36.98139 4.250785 17.48638       3.761210 21.58418       4.834782 11.20465       5.986059 40.80587 4.964045 27.97457 8.231425 12.83130       9.612393 
1 1 1 11  13 34 o 65.67040 3.610384 54.49964       5.755525 48.88974       8.062317 60.32975       8.219029 60.77209 5.503623 68.01589 4.993577 -7.243797      7.431398 
1 1 1 11  13 35 o 38.59346 4.773527 19.77384       4.393802 19.22979       4.854139 22.24101       10.33695 37.59801 5.457283 35.00517 10.92787 2.592838       12.21476 
1 1 1 11  13 36 o 11.57227 5.161026 -0.4700502     2.953620 2.615432       3.746121 -5.539657      4.801837 15.81998 6.357049 11.67941 5.633862 4.140565       8.494262 
1 1 1 11  13 37 o 46.47943 3.891937 28.65832       4.367777 30.14771       5.633816 26.41437       6.915206 46.42104 5.062183 40.93642 7.194461 5.484627       8.796929 
1 1 1 11  13 38 o 16.38308 6.127603 3.872057       3.294218 9.316642       4.411154 -2.993054      4.953288 23.44024 7.106853 12.56885 5.969517 10.87139       9.281298 
1 1 1 11  13 39 o 17.77788 6.568857 5.250381       3.764018 9.990626       4.667975 -3.560636      6.364161 23.28974 7.353856 13.45197 6.488163 9.837770       9.806909 
1 1 1 11  13 40 o 13.21656 6.007598 0.7993315      4.224704 1.090183       8.559389 0.7056539      4.857640 15.73941 7.574486 13.67379 6.299697 2.065617       9.851853 
1 1 1 11  13 41 f 11.25027 5.192674 -0.1940460     3.322132 -0.4644908     4.435654 0.1514761      5.013675 12.22907 5.760206 13.00796 6.126141 -0.7788906     8.408898 
1 1 1 11  13 42 o 12.50913 5.664244 1.415366       3.711895 1.152417       5.220980 1.684122       5.278316 13.22328 6.234904 13.51591 6.340281 -0.2926311     8.892311 
1 1 1 11  14 0  o 66.63437 2.870107 54.22086       4.649572 66.81681       8.790079 49.32741       5.478794 73.85007 4.912263 63.50983 3.554218 10.34024       6.063233 
1 1 1 11  14 1  o 161.8680 3.186151 319.3994       12.56792 301.4700       24.59779 325.7335       14.62036 157.0132 6.442393 163.4525 3.670542 -6.439331      7.414669 
1 1 1 11  14 2  o 210.1236 3.249629 538.2468       16.63968 518.5511       25.52890 552.7950       21.94071 206.1661 5.081347 212.9061 4.228891 -6.740021      6.610870 
1 1 1 11  14 3  o 353.6520 4.832327 1525.769       41.64554 1595.195       67.46239 1483.023       52.93592 361.2746 7.662812 348.5216 6.232821 12.75299       9.877588 
1 1 1 11  14 4  o 68.72564 2.348842 57.63482       3.927987 55.51625       6.060431 59.16947       5.158060 67.37289 3.705595 69.60122 3.048514 -2.228333      4.798424 
1 1 1 11  14 5  o 169.0211 2.862226 348.2610       11.78911 352.9931       18.30163 344.9048       15.41274 170.0495 4.420247 168.1742 3.760835 1.875320       5.803659 
1 1 1 11  14 6  o 46.65487 7.003222 27.19416       7.716577 0.000000       0.000000 27.19416       7.716577 ?        ?        46.65487 7.003222 0.000000       7.003222 
1 1 1 11  14 7  o 81.98716 3.824307 82.16829       7.619674 66.42137       11.68545 93.81630       10.05018 73.42246 6.601417 87.54899 4.728255 -14.12653      8.120043 
1 1 1 11  14 8  o 157.8039 3.916234 303.7968       15.05992 281.4893       24.28862 317.7292       19.19512 151.5852 6.590966 161.2520 4.890483 -9.666809      8.207171 
1 1 1 11  14 9  o 324.1362 7.282193 1286.263       57.52091 1254.469       79.82491 1320.602       82.95932 319.1942 10.27575 327.4636 10.40922 -8.269440      14.62679 
1 1 1 11  14 10 o 56.93401 5.196150 39.92810       7.129866 42.06914       9.863667 37.58530       10.31797 58.18960 7.102999 54.80943 7.957446 3.380169       10.66647 
1 1 1 11  14 11 o 325.2774 7.318254 1296.670       58.00927 1333.109       83.02700 1261.919       81.08255 328.7000 10.37834 319.7788 10.41890 8.921234       14.70590 
1 1 1 11  14 12 o 231.7836 5.769536 657.1599       32.58814 650.4293       45.49573 664.2518       46.70109 230.0113 8.129593 232.4123 8.258910 -2.400986      11.58878 
1 1 1 11  14 13 o 195.9886 5.290456 470.0204       25.24425 504.0482       36.57780 439.0712       34.88393 202.5529 7.422976 188.9927 7.589770 13.56027       10.61627 
1 1 1 11  14 14 o 132.6237 4.607972 215.1941       14.86986 201.7682       20.32353 230.6611       21.81377 128.1461 6.529679 137.0325 6.551350 -8.886444      9.249697 
1 1 1 11  14 15 o 154.2736 4.960275 291.3651       18.62381 271.2672       24.56157 318.5501       28.56571 148.5403 6.803473 160.8844 7.305156 -12.34419      9.982613 
1 1 1 11  14 16 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  14 17 o 144.2030 6.872868 256.0931       24.08223 0.000000       0.000000 256.0931       24.08223 ?        ?        144.2030 6.872868 0.000000       6.872868 
1 1 1 11  14 18 o 119.9843 7.451709 178.0038       21.68042 0.000000       0.000000 178.0038       21.68042 ?        ?        119.9843 7.451709 0.000000       7.451709 
1 1 1 11  14 19 o 90.63973 4.864705 100.9030       10.70575 100.1450       15.02708 101.6843       15.25595 89.93588 6.909472 90.61745 6.961947 -0.6815643     9.808644 
1 1 1 11  14 20 o 243.7068 4.799532 727.6636       28.50380 740.9254       51.55990 721.8267       34.20613 244.2576 8.675971 242.4248 5.790164 1.832840       10.43065 
1 1 1 11  14 21 o 134.6015 2.921932 221.2455       9.584205 206.9016       12.97179 238.4889       14.22263 129.9610 4.101046 139.5227 4.187846 -9.561707      5.861454 
1 1 1 11  14 22 o 49.99789 2.937558 30.63917       3.563334 36.60178       4.747876 22.94902       5.391983 54.59028 3.588918 42.91360 5.266332 11.67668       6.372957 
1 1 1 11  14 23 o 117.3079 3.440294 168.4573       9.824024 162.2083       11.11725 190.7266       20.98689 115.0199 3.972287 123.9537 6.976035 -8.933784      8.027710 
1 1 1 11  14 24 o 32.45775 3.695489 13.06517       2.870987 13.12659       3.583565 12.95510       4.797307 32.36674 4.679016 31.81831 6.408906 0.5484352      7.935191 
1 1 1 11  14 25 o 43.22324 4.167984 23.13439       4.335770 23.13439       4.335770 0.000000       0.000000 43.22324 4.167984 ?        ?        0.000000       4.167984 
1 1 1 11  14 26 o 70.04803 2.867109 60.12502       4.883794 56.32744       6.288632 65.89597       7.752229 67.64382 3.830633 73.07280 4.373474 -5.428978      5.813865 
1 1 1 11  14 27 o 72.81891 2.858083 65.01331       5.061869 60.72950       6.542242 71.40283       7.989984 70.19748 3.839064 76.02054 4.330912 -5.823059      5.787505 
1 1 1 11  14 28 o 85.81421 2.870744 90.34911       5.994846 87.88098       7.872629 93.75541       9.248610 84.40391 3.837592 87.02688 4.375041 -2.622971      5.819630 
1 1 1 11  14 29 o 65.82166 2.968516 53.30471       4.749252 50.45670       6.026940 57.97025       7.713953 63.81177 3.894332 68.17254 4.671586 -4.360771      6.081902 
1 1 1 11  14 30 o 53.83218 4.417764 36.30519       5.744420 52.77263       11.37444 30.66707       6.655549 63.49068 7.495993 49.00157 5.678630 14.48911       9.404081 
1 1 1 11  14 31 o 38.64167 3.895630 18.75730       3.618318 16.29953       4.472203 23.41508       6.156591 35.52646 5.330016 42.35852 6.143430 -6.832062      8.133314 
1 1 1 11  14 32 o 11.33082 5.060256 -0.9435859     2.849597 -2.382423      3.377038 2.613970       5.310140 11.31652 5.227573 18.50397 7.520652 -7.187446      9.159024 
1 1 1 11  14 33 o 13.44707 5.680824 0.6049756      3.197574 3.115244       4.068709 -3.449768      5.171044 17.42954 6.739867 13.77123 6.398621 3.658314       9.293447 
1 1 1 11  14 34 o 13.96195 5.636028 1.524510       2.959110 0.8078980      3.654429 2.889056       5.042797 14.24255 6.047454 17.90846 7.310025 -3.665918      9.487264 
1 1 1 11  14 35 o 24.75395 5.496667 8.560714       3.229360 12.53455       4.052497 1.646716       5.345424 29.91661 5.767791 16.79682 7.227085 13.11979       9.246522 
1 1 1 11  14 36 o 21.66136 6.423107 7.076840       3.633311 6.535304       4.032762 9.411351       8.373115 20.71020 6.860194 23.30149 9.453625 -2.591284      11.68047 
1 1 1 11  14 37 o 15.07904 6.105101 2.567241       3.483768 -0.1625698     4.121718 9.395610       6.518843 13.33159 6.009023 22.57667 8.581002 -9.245082      10.47578 
1 1 1 11  14 38 o 14.12974 5.817271 2.176405       3.228408 3.390725       4.240268 0.5016709      4.979658 16.11710 6.654312 14.41530 6.540588 1.701800       9.330550 
1 1 1 11  14 39 o 20.30534 6.372839 7.072610       3.510692 7.054822       4.727594 7.094478       5.241874 19.33658 7.317225 19.16202 7.579008 0.1745644      10.53485 
1 1 1 11  14 40 o 12.19364 5.433106 0.8504844      3.265381 -0.6576319     4.345608 2.806383       4.948874 12.27888 5.757728 14.87217 6.653287 -2.593287      8.798731 
1 1 1 11  14 41 o 14.73086 6.461016 3.523471       4.445709 25.62278       10.15184 -1.720241      4.945097 24.40045 10.20344 11.97635 5.761948 12.42410       11.71795 
1 1 1 11  14 42 o 10.58428 4.991554 -0.8399985     3.349236 1.514344       4.436811 -3.958779      5.106561 12.95077 5.985843 10.99905 5.413383 1.951716       8.070627 
1 1 1 11  15 0  o 388.5845 5.246386 1842.530       49.68002 1862.181       78.93968 1829.643       63.92765 390.2207 8.301353 387.0332 6.778045 3.187561       10.71701 
1 1 1 11  15 1  o 606.3529 7.896059 4495.339       116.6734 4636.458       188.2370 4407.302       148.6773 614.1656 12.57718 599.7016 10.17357 14.46399       16.17674 
1 1 1 11  15 2  o 177.9035 2.970941 385.8330       12.87997 371.4106       19.72421 396.5549       17.00650 174.4202 4.644653 180.3260 3.870085 -5.905762      6.045690 
1 1 1 11  15 3  o 284.7274 4.529067 989.0480       31.42491 990.0668       61.53947 988.6886       36.54948 284.2206 8.896048 284.6116 5.269782 -0.3909302     10.33974 
1 1 1 11  15 4  o 197.4989 3.142872 475.5772       15.12612 464.4238       23.26985 483.7384       19.90520 195.0164 4.900390 199.1403 4.101769 -4.123947      6.390488 
1 1 1 11  15 5  o 122.0466 2.508828 181.5741       7.461610 193.6931       11.67325 173.2016       9.702552 125.9592 3.807367 119.1317 3.345436 6.827522       5.068331 
1 1 1 11  15 6  o 169.7927 3.562810 351.6220       14.74171 394.7494       25.76215 330.6252       17.97555 179.6538 5.892472 164.5364 4.487349 15.11740       7.406586 
1 1 1 11  15 7  o 100.0516 4.711614 122.4708       11.45534 0.000000       0.000000 122.4708       11.45534 ?        ?        100.0516 4.711614 0.000000       4.711614 
1 1 1 11  15 8  o 134.2929 3.799510 220.2122       12.42167 227.3409       20.97905 216.3639       15.41408 136.1950 6.338421 133.0317 4.762417 3.163315       7.928191 
1 1 1 11  15 9  o 263.8980 6.271993 851.9331       40.33460 822.0742       55.63208 885.0226       58.56430 258.5788 8.841696 268.2720 8.970832 -9.693207      12.59569 
1 1 1 11  15 10 o 248.3644 6.016343 754.5787       36.41314 723.3536       49.96130 789.9585       53.18131 242.5583 8.465405 253.4500 8.623103 -10.89172      12.08391 
1 1 1 11  15 11 o 86.20061 4.596399 91.01842       9.620358 95.74908       13.58625 86.26121       13.62431 88.21095 6.363110 83.65005 6.740660 4.560898       9.269609 
1 1 1 11  15 12 o 69.59854 4.810599 59.47335       8.108773 42.81883       10.59673 83.00381       12.59566 58.58898 7.600965 82.08688 6.345913 -23.49790      9.901782 
1 1 1 11  15 13 o 275.2298 6.499487 928.2991       43.59238 941.7985       61.87537 914.9956       61.42499 276.2834 9.203086 272.2944 9.270521 3.988983       13.06290 
1 1 1 11  15 14 o 102.4279 4.630620 128.4997       11.52839 125.6411       15.96676 131.6130       16.66271 101.0208 6.520726 103.3825 6.649229 -2.361702      9.313007 
1 1 1 11  15 15 o 247.3588 8.766328 755.7604       52.75869 0.000000       0.000000 755.7604       52.75869 ?        ?        247.3588 8.766328 0.000000       8.766328 
1 1 1 11  15 16 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  15 17 o 178.8889 5.202556 392.2932       22.65556 403.9072       32.10412 380.7718       31.97585 180.9947 7.293723 175.6706 7.486588 5.324097       10.45215 
1 1 1 11  15 18 o 68.00713 5.216843 57.00413       8.579653 61.05078       12.22968 53.08237       12.03948 70.03101 7.271940 65.15451 7.733420 4.876503       10.61541 
1 1 1 11  15 19 o 111.4530 4.762765 152.4204       12.90579 138.0301       17.33605 170.3100       19.32929 105.6663 6.768104 117.4134 6.784465 -11.74712      9.583120 
1 1 1 11  15 20 f 104.5172 4.815187 134.1609       12.23118 124.7183       16.63010 145.2875       18.05230 100.3550 6.841079 108.3411 6.873020 -7.986153      9.697358 
1 1 1 11  15 21 o 157.3044 3.781832 302.6961       14.49704 287.1001       26.55769 309.3157       17.30225 152.2564 7.177995 158.8279 4.474792 -6.571533      8.458569 
1 1 1 11  15 22 o 66.44749 2.751962 54.01504       4.446477 54.69901       6.091645 53.23503       6.505250 66.75203 3.760047 65.80651 4.076586 0.9455185      5.545855 
1 1 1 11  15 23 o 97.34801 3.012321 115.9421       7.137425 123.8062       9.147788 103.7053       11.41100 100.4885 3.742165 91.69879 5.126922 8.789711       6.347372 
1 1 1 11  15 24 f 13.76656 5.169816 1.729627       2.349843 2.790817       2.836224 -0.5934071     4.196350 16.16006 5.739136 14.61890 6.346673 1.541158       8.556748 
1 1 1 11  15 25 o 23.99870 5.091348 7.362565       2.885188 5.020149       3.630483 11.37793       4.753296 20.30586 6.494050 29.68752 6.726565 -9.381662      9.349832 
1 1 1 11  15 26 f 56.42670 3.552066 39.20755       4.859511 37.85546       5.310929 46.16211       12.04491 55.36960 3.962262 59.88667 8.491298 -4.517075      9.370254 
1 1 1 11  15 27 o 12.74988 5.131858 0.9450123      2.445621 2.778251       2.966191 -2.947010      4.321926 16.24254 5.857390 13.05257 5.987292 3.189975       8.375958 
1 1 1 11  15 28 f 26.77335 4.603713 9.118923       2.895372 9.155034       3.496563 9.040144       5.164438 26.61540 5.570136 26.31822 7.618126 0.2971783      9.437281 
1 1 1 11  15 29 o 59.93707 3.031759 44.28405       4.413809 40.94896       5.617432 49.66538       7.135572 57.36922 4.044031 62.99532 4.681663 -5.626102      6.186450 
1 1 1 11  15 30 o 65.09907 3.125334 52.38128       4.943527 49.21095       6.414006 57.02039       7.758805 62.72594 4.220671 67.30946 4.760955 -4.583519      6.362450 
1 1 1 11  15 31 o 21.85087 7.884392 5.752902       5.375300 0.000000       0.000000 5.752902       5.375300 ?        ?        21.85087 7.884392 0.000000       7.884392 
1 1 1 11  15 32 o 13.08272 5.480484 0.6465440      2.936675 2.365205       3.498711 -3.451373      5.402497 15.97940 6.230188 14.21744 6.583196 1.761958       9.063869 
1 1 1 11  15 33 o 23.15541 5.706022 7.328962       3.198626 12.36299       4.010504 -1.470765      5.302439 30.26272 5.645815 15.04966 6.796541 15.21305       8.835621 
1 1 1 11  15 34 o 19.30524 5.888246 5.159900       3.021992 3.038436       3.710339 9.340601       5.208591 16.62752 6.434454 24.94216 7.752532 -8.314640      10.07492 
1 1 1 11  15 35 o 10.32988 4.737175 -1.366651      2.703223 0.4740545      3.291584 -5.180199      4.737806 13.06989 5.647649 11.77881 5.659944 1.291082       7.995680 
1 1 1 11  15 36 o 27.80411 5.505809 11.14199       3.598474 14.08879       4.201513 3.029623       6.971149 31.14152 5.748138 18.23303 8.040433 12.90848       9.883807 
1 1 1 11  15 37 f 26.78944 6.474285 11.31860       4.179214 12.32621       4.808723 8.208170       8.448760 27.26065 7.151091 21.10747 9.083906 6.153179       11.56094 
1 1 1 11  15 38 o 9.515028 4.555463 -2.900313      3.007048 -3.518891      3.967702 -2.065519      4.609265 10.79626 5.185668 12.40427 5.851645 -1.608012      7.818753 
1 1 1 11  15 39 o 14.57421 5.948610 2.945701       3.339090 1.456042       4.502924 4.765504       4.976951 14.03188 6.306452 16.80260 7.092295 -2.770711      9.490626 
1 1 1 11  15 40 o 15.31699 6.165673 3.964751       3.530553 5.496087       4.870150 2.268594       5.125547 16.71591 7.033509 14.41325 6.576901 2.302659       9.629429 
1 1 1 11  15 41 o 12.50060 5.834691 0.4769592      4.377732 5.874544       8.997417 -1.197162      5.010851 15.99428 7.714414 12.14458 5.831817 3.849693       9.670691 
1 1 1 11  16 0  o 268.2809 3.885700 877.8190       25.40359 863.6641       39.61940 887.7012       33.10426 265.9198 6.113940 269.6982 5.036973 -3.778473      7.921575 
1 1 1 11  16 1  o 103.9284 2.497881 131.6603       6.326187 129.5425       9.696601 133.2298       8.347394 102.9867 3.870577 104.4788 3.282660 -1.492081      5.075158 
1 1 1 11  16 2  o 92.80083 2.849334 105.0908       6.436009 102.5832       13.07213 105.8932       7.394315 91.45650 5.896802 93.13301 3.263095 -1.676514      6.739441 
1 1 1 11  16 3  o 95.53069 2.434763 111.3177       5.663457 101.2187       8.424804 119.6443       7.649839 91.01563 3.806866 99.00523 3.174826 -7.989601      4.956990 
1 1 1 11  16 4  o 153.1423 2.747510 285.9273       10.25347 284.8602       15.78513 286.7061       13.48597 152.7345 4.245183 153.3176 3.609559 -0.5831451     5.572297 
1 1 1 11  16 5  o 86.72895 2.369429 91.76221       5.003072 85.75140       7.442016 96.71906       6.758145 83.76474 3.654598 89.00374 3.120727 -5.238998      4.805728 
1 1 1 11  16 6  o 104.7557 2.402172 133.7794       6.132225 140.0204       9.341286 129.0530       8.129079 107.0773 3.584974 102.8152 3.248578 4.262077       4.837902 
1 1 1 11  16 7  o 126.3633 3.788434 195.0042       11.65269 204.4879       19.38995 189.6427       14.57907 129.1617 6.178282 124.5240 4.813481 4.637733       7.832035 
1 1 1 11  16 8  o 78.49557 3.960042 75.38861       7.550502 58.60498       11.70483 87.35010       9.881320 68.81532 7.080753 84.43057 4.822690 -15.61525      8.567112 
1 1 1 11  16 9  f 211.8008 5.500490 548.8042       28.36595 542.1050       39.68915 555.7993       40.55593 210.0824 7.765944 212.7071 7.837536 -2.624695      11.03344 
1 1 1 11  16 10 o 296.5473 6.843197 1077.476       49.45259 1049.764       68.69312 1107.289       71.24999 291.7477 9.675443 299.6069 9.771882 -7.859192      13.75150 
1 1 1 11  16 11 o 113.8266 4.507734 158.5219       12.47897 174.4277       18.08412 144.0631       17.24184 119.1911 6.247936 108.2438 6.567386 10.94731       9.064616 
1 1 1 11  16 12 o 108.3208 4.501998 143.6049       11.85784 149.8673       17.04217 137.7278       16.50955 110.4211 6.360310 105.8286 6.432084 4.592491       9.045731 
1 1 1 11  16 13 o 107.6351 6.480367 142.5458       16.91896 0.000000       0.000000 142.5458       16.91896 ?        ?        107.6351 6.480367 0.000000       6.480367 
1 1 1 11  16 14 o 236.8266 8.476811 692.1777       48.84253 0.000000       0.000000 692.1777       48.84253 ?        ?        236.8266 8.476811 0.000000       8.476811 
1 1 1 11  16 15 o 38.57240 7.307492 18.88783       6.617426 21.41271       9.565865 16.57064       9.163974 40.78304 9.756332 36.03696 10.05534 4.746078       14.01056 
1 1 1 11  16 16 o 164.2608 5.019385 330.6424       20.06830 343.4224       28.76670 318.5258       28.01015 166.9393 7.087362 160.7423 7.168746 6.196991       10.08075 
1 1 1 11  16 17 o 183.0999 7.443264 413.8394       33.14220 413.8394       33.14220 0.000000       0.000000 183.0999 7.443264 ?        ?        0.000000       7.443264 
1 1 1 11  16 18 o 47.91761 6.561610 28.75724       7.460958 38.03905       10.86956 20.48791       10.25961 54.83932 8.400805 39.79752 10.44802 15.04180       13.40652 
1 1 1 11  16 19 o 81.08712 5.028212 80.91636       9.886887 82.08795       13.69342 79.64046       14.28999 81.30576 6.978658 79.97829 7.416501 1.327461       10.18362 
1 1 1 11  16 20 o 58.78736 5.770499 42.88015       8.160323 37.73424       11.28967 48.51010       11.80870 54.43866 8.811047 62.08674 7.989910 -7.648075      11.89425 
1 1 1 11  16 21 o 110.8304 6.884327 152.3294       18.50150 152.3294       18.50150 0.000000       0.000000 110.8304 6.884327 ?        ?        0.000000       6.884327 
1 1 1 11  16 22 o 98.79680 2.918509 119.3701       7.018814 128.6259       16.70898 117.3870       7.734271 101.7559 6.776984 97.92916 3.245425 3.826729       7.514007 
1 1 1 11  16 23 o 131.9527 2.974623 212.8534       9.565031 218.5105       13.44091 207.0492       13.61475 133.4256 4.138845 129.8358 4.309049 3.589798       5.974775 
1 1 1 11  16 24 o 108.0248 2.850261 142.7699       7.496602 150.5700       10.48407 134.6093       10.72358 110.7446 3.890868 104.6337 4.214261 6.110909       5.735752 
1 1 1 11  16 25 o 88.02250 2.841660 94.88368       6.087409 101.4183       8.357165 87.49787       8.884836 90.83163 3.783885 84.23598 4.342946 6.595642       5.760118 
1 1 1 11  16 26 o 36.61472 4.446875 16.75930       3.886524 17.80058       4.239425 11.27444       9.729829 37.69295 4.718508 30.58377 10.64856 7.109180       11.64715 
1 1 1 11  16 27 o 88.18800 2.852925 95.41436       6.122998 96.93342       8.278238 93.57948       9.098176 88.64230 3.841431 86.95449 4.307050 1.687805       5.771245 
1 1 1 11  16 28 o 40.30585 3.627640 20.18406       3.525018 21.48988       4.529196 18.17787       5.613912 41.37361 4.568201 37.48167 6.374248 3.891941       7.842162 
1 1 1 11  16 29 o 50.85577 3.246427 32.01183       4.002288 32.33430       5.094942 31.49216       6.467729 50.86497 4.146340 49.75727 5.421667 1.107700       6.825438 
1 1 1 11  16 30 o 48.77963 3.652936 29.69401       4.310731 31.70571       5.849732 27.30338       6.376917 49.96996 4.865404 45.93583 5.827671 4.034130       7.591700 
1 1 1 11  16 31 o 29.11764 6.813652 11.57587       4.748510 12.13797       8.764252 11.34230       5.649594 29.20645 10.10988 28.47162 7.876783 0.7348289      12.81614 
1 1 1 11  16 32 o 49.69289 3.491015 31.05806       4.200588 33.53598       5.406921 27.28554       6.671463 51.20070 4.375385 45.06117 6.243011 6.139523       7.623594 
1 1 1 11  16 33 o 22.62250 5.805791 7.084347       3.216438 7.361485       4.103372 6.642722       5.179889 22.77311 6.843577 21.92975 7.759099 0.8433628      10.34593 
1 1 1 11  16 34 o 21.47902 5.892402 6.549157       3.176620 9.902968       4.077676 1.371630       5.066459 26.14620 6.442275 16.32853 7.030896 9.817678       9.536058 
1 1 1 11  16 35 f 14.93496 6.016370 2.245309       3.364349 3.881733       3.918557 -2.343720      6.562036 17.31848 6.635749 15.30379 7.143233 2.014691       9.749818 
1 1 1 11  16 36 f 17.98845 6.154020 4.815465       3.244364 7.844181       4.272066 0.6884256      4.986869 21.97897 7.046119 14.97764 6.691157 7.001329       9.716963 
1 1 1 11  16 37 o 25.73099 6.533051 10.68165       4.103204 11.45724       4.659748 8.004148       8.657863 25.99509 7.138703 20.58052 9.021870 5.414568       11.50457 
1 1 1 11  16 38 o 9.286728 4.487751 -3.442386      3.080503 -2.790096      4.223840 -4.183576      4.502477 11.41272 5.446244 11.13943 5.393304 0.2732878      7.664809 
1 1 1 11  16 39 o 21.01648 6.519349 8.017375       3.685391 14.35236       5.150214 1.369367       5.275920 27.00344 7.539469 14.30045 6.580032 12.70299       10.00702 
1 1 1 11  16 40 o 10.78682 5.062385 -0.9874505     3.371635 -1.570082      4.457470 -0.2083408     5.154552 11.69453 5.584611 12.94271 6.130260 -1.248174      8.292645 
1 1 1 11  16 41 o 16.29977 6.528314 5.479047       3.937088 6.674974       5.856115 4.492655       5.318410 16.53026 7.325656 15.19770 6.840108 1.332552       10.02259 
1 1 1 11  17 0  o 144.5801 2.733935 254.8429       9.632363 249.6134       14.85940 258.6331       12.65017 142.9665 4.269901 145.6221 3.564782 -2.655548      5.562349 
1 1 1 11  17 1  o 96.28807 2.511861 113.1003       5.888886 103.8234       8.802345 120.6167       7.923151 92.16920 3.928018 99.39862 3.275480 -7.229416      5.114499 
1 1 1 11  17 2  o 183.6602 3.047287 411.3113       13.63844 426.6180       21.66728 401.2672       17.55173 186.8825 4.761607 181.3551 3.971495 5.527328       6.200458 
1 1 1 11  17 3  o 179.6057 2.997433 393.3563       13.11915 359.2874       19.55770 421.2266       17.68926 171.4915 4.684313 185.8089 3.906673 -14.31740      6.099581 
1 1 1 11  17 4  o 70.32465 2.480922 60.36785       4.244982 55.89569       6.195083 64.32616       5.828313 67.58152 3.776714 72.54781 3.305407 -4.966293      5.018893 
1 1 1 11  17 5  o 81.51415 2.407734 81.07639       4.777507 77.22160       7.067266 84.32043       6.483276 79.47430 3.658942 83.08530 3.208123 -3.611000      4.866201 
1 1 1 11  17 6  o 176.0313 2.954268 377.8984       12.67290 396.2523       19.93802 365.4569       16.41553 180.0880 4.546828 173.0523 3.892616 7.035751       5.985491 
1 1 1 11  17 7  o 22.24578 4.642652 6.269602       2.435340 14.11190       7.044753 5.205204       2.595351 33.28069 8.618689 20.25974 5.223420 13.02094       10.07799 
1 1 1 11  17 8  o 134.8227 3.867672 222.0404       12.69404 222.2781       20.90425 221.9016       15.97712 134.6012 6.391340 134.6803 4.876137 -0.7905579E-01 8.039026 
1 1 1 11  17 9  o 176.3834 5.001499 380.5256       21.47610 388.8758       30.48494 372.2982       30.25989 177.9780 7.042734 174.1175 7.146819 3.860413       10.03380 
1 1 1 11  17 10 o 183.0267 7.313608 411.6246       32.55420 0.000000       0.000000 411.6246       32.55420 ?        ?        183.0267 7.313608 0.000000       7.313608 
1 1 1 11  17 11 f 287.8381 9.604490 1023.469       67.27444 0.000000       0.000000 1023.469       67.27444 ?        ?        287.8381 9.604490 0.000000       9.604490 
1 1 1 11  17 12 o 140.1203 4.743645 240.3065       16.17419 265.4890       23.82266 218.7715       22.02991 146.9732 6.668822 133.3639 6.801030 13.60922       9.525083 
1 1 1 11  17 13 o 52.10762 5.984584 33.70449       7.461475 32.57992       10.65020 34.78856       10.45670 50.65963 8.954437 52.49049 8.462524 -1.830860      12.32056 
1 1 1 11  17 14 o 148.0070 4.835237 268.2821       17.41618 269.5212       24.37895 266.9906       24.88937 147.9861 6.778174 147.2494 6.955909 0.7367096      9.712276 
1 1 1 11  17 15 o 51.35905 6.092919 32.80889       7.477274 32.30288       10.35021 33.36127       10.81395 50.43406 8.737910 51.21850 8.991923 -0.7844467     12.53817 
1 1 1 11  17 16 o 150.3611 4.923553 277.1325       18.01625 284.6986       25.50901 269.6021       25.44875 151.9651 6.906376 147.8275 7.085022 4.137650       9.894219 
1 1 1 11  17 17 o 117.2792 4.722521 168.6891       13.46920 175.8684       18.89951 161.2791       19.20071 119.4052 6.519916 114.2385 6.929728 5.166763       9.514749 
1 1 1 11  17 18 o 94.81348 6.852540 111.3311       15.72598 111.3311       15.72598 0.000000       0.000000 94.81348 6.852540 ?        ?        0.000000       6.852540 
1 1 1 11  17 19 f 100.9645 5.019674 125.3268       12.31165 112.8092       16.35521 141.6953       18.70252 95.34332 7.090055 106.8781 7.223275 -11.53474      10.12149 
1 1 1 11  17 20 o 43.94459 9.975113 25.11949       10.43694 25.11949       10.43694 0.000000       0.000000 43.94459 9.975113 ?        ?        0.000000       9.975113 
1 1 1 11  17 21 o 57.22300 5.896783 40.75482       8.105239 31.29258       10.67337 53.64461       12.45740 49.26663 9.229280 65.22761 8.004807 -15.96098      12.21706 
1 1 1 11  17 22 o 80.82889 2.621313 79.88620       5.156404 73.72396       13.93216 80.86428       5.550555 76.64930 7.557087 81.30194 2.805762 -4.652641      8.061133 
1 1 1 11  17 23 f 178.4016 2.969774 389.1759       12.91095 418.6038       21.55517 372.7111       16.12318 184.4368 4.799953 174.3918 3.793923 10.04503       6.118284 
1 1 1 11  17 24 o 56.57701 4.133930 39.52155       5.660197 37.79117       11.39349 40.08855       6.521945 54.03537 8.966678 56.86517 4.749809 -2.829792      10.14702 
1 1 1 11  17 25 o 32.49824 4.185777 13.20108       3.238014 12.51925       4.409852 13.99876       4.769784 31.24295 6.010282 33.04967 6.148601 -1.806713      8.598185 
1 1 1 11  17 26 o 31.70163 4.278418 12.61003       3.220929 13.81289       4.202133 10.89672       5.015100 32.94071 5.423385 28.86049 7.164270 4.080223       8.985537 
1 1 1 11  17 27 o 11.37167 5.123036 -1.429121      2.991575 -0.9382272     3.175872 -5.294238      8.911496 12.20560 5.402661 18.72068 8.591036 -6.515085      10.14863 
1 1 1 11  17 28 o 63.77163 3.072752 50.14680       4.761142 53.64099       6.319935 45.56118       7.239999 65.70622 3.965483 60.19498 4.980151 5.511238       6.366079 
1 1 1 11  17 29 o 69.43827 3.310302 59.69946       5.585346 58.10299       7.823374 61.35908       7.976600 67.93030 4.756057 69.83516 4.714771 -1.904861      6.696951 
1 1 1 11  17 30 o 42.89387 3.624965 23.04615       3.753653 22.07817       4.748736 24.65819       6.128187 41.56587 4.774799 43.42960 5.946407 -1.863728      7.626170 
1 1 1 11  17 31 o 26.39077 5.213289 9.221701       3.233769 13.59677       4.151391 2.470522       5.156927 32.05547 5.513156 18.08372 7.388211 13.97174       9.218490 
1 1 1 11  17 32 o 29.69218 6.517393 12.26752       4.586146 13.84640       8.967282 11.70827       5.336921 29.62796 10.22771 28.45812 7.566006 1.169840       12.72205 
1 1 1 11  17 33 o 31.93591 4.856535 13.60505       3.660651 7.941983       4.584873 23.56310       6.079787 23.29193 7.278849 41.14246 6.261255 -17.85054      9.601300 
1 1 1 11  17 34 o 23.56479 6.245867 8.123858       3.644041 12.17377       4.476463 0.1680208      6.274151 28.76587 6.535083 16.56746 7.445251 12.19841       9.906516 
1 1 1 11  17 35 o 14.61263 5.794491 2.343373       3.071360 5.034490       3.946932 -1.787779      4.890225 18.54600 6.747067 13.47671 6.248232 5.069292       9.195832 
1 1 1 11  17 36 o 11.09521 5.068290 -0.9424683     3.054439 2.466521       4.037174 -5.506058      4.671087 15.38550 6.434138 11.17594 5.430202 4.209556       8.419336 
1 1 1 11  17 37 o 11.27487 5.144541 -0.6664074     3.135546 -4.625267      4.186411 4.392098       4.732253 10.64764 5.165896 17.18330 7.055369 -6.535654      8.744410 
1 1 1 11  17 38 o 20.71621 7.075009 8.041310       4.287722 9.985073       5.000160 2.640826       8.334482 22.34163 7.639964 16.62920 7.851995 5.712435       10.95549 
1 1 1 11  17 39 o 16.57676 6.317318 4.925470       3.539004 5.073676       4.911306 4.765401       5.104072 16.50333 7.009177 16.25661 7.028712 0.2467213      9.926296 
1 1 1 11  17 40 o 13.57987 5.951262 2.420581       3.764889 7.149238       5.866466 -0.8908033     4.909219 17.25120 7.496656 12.30433 5.871665 4.946869       9.522410 
1 1 1 11  18 0  f 60.73383 2.775725 45.06842       4.097260 44.93929       6.118981 45.17337       5.516536 60.54057 4.173129 60.73566 3.745453 -0.1950912     5.607444 
1 1 1 11  18 1  f 236.6111 3.574270 682.9513       20.60907 631.7170       30.92676 723.8761       27.64058 227.3697 5.581690 243.4967 4.658197 -16.12703      7.270080 
1 1 1 11  18 2  o 262.1717 3.850968 838.6747       24.60321 890.7975       40.01491 806.9931       31.19688 269.9098 6.083690 257.0497 4.980330 12.86014       7.862250 
1 1 1 11  18 3  o 334.1601 5.215583 1364.236       42.47110 1338.499       84.13841 1373.036       49.19908 329.4789 10.49264 335.0848 6.025126 -5.605896      12.09949 
1 1 1 11  18 4  o 247.9209 3.690388 749.9727       22.29571 762.8109       35.16854 741.3454       28.82968 249.7784 5.777811 246.3704 4.801923 3.407974       7.512760 
1 1 1 11  18 5  o 235.1792 4.490507 675.3866       25.73537 674.6403       43.42238 675.7908       31.95187 234.4499 7.610326 235.1105 5.576840 -0.6606293     9.434946 
1 1 1 11  18 6  o 149.4428 3.378807 272.4687       12.30480 268.4001       20.04320 274.9295       15.58806 148.0559 5.565177 149.9981 4.268862 -1.942200      7.013871 
1 1 1 11  18 7  o 196.2559 3.750700 470.0844       17.93788 435.2039       29.76511 489.9772       22.47835 188.4112 6.492530 200.2807 4.605631 -11.86946      7.960200 
1 1 1 11  18 8  o 117.5636 6.487579 169.7970       18.51418 0.000000       0.000000 169.7970       18.51418 ?        ?        117.5636 6.487579 0.000000       6.487579 
1 1 1 11  18 9  o 247.6743 6.060872 751.0583       36.58071 739.6119       51.06803 763.1209       52.42450 245.0445 8.565176 248.8843 8.656901 -3.839752      12.17802 
1 1 1 11  18 10 o 161.1994 4.872526 317.9729       19.11855 310.2716       26.47420 326.3665       27.63881 158.9013 6.853012 162.9532 6.976324 -4.051926      9.779206 
1 1 1 11  18 11 o 139.3840 4.709297 237.7898       15.97280 246.4140       22.61614 229.2069       22.56186 141.5932 6.572437 136.5062 6.803892 5.086960       9.459909 
1 1 1 11  18 12 o 172.7550 5.025887 365.4438       21.13574 369.6076       29.75328 361.2023       30.02954 173.3223 7.059175 171.3012 7.209820 2.021164       10.09027 
1 1 1 11  18 13 o 120.9213 4.618625 179.0859       13.58478 179.2921       18.86555 178.8639       19.57779 120.6983 6.437334 120.5051 6.693170 0.1931992      9.286430 
1 1 1 11  18 14 o 52.88444 5.829120 34.70309       7.387732 42.28130       10.79434 28.02547       10.13268 58.06777 7.827411 46.80367 9.212139 11.26410       12.08850 
1 1 1 11  18 15 o 80.81654 4.811981 80.23579       9.433860 71.19691       12.59127 91.80341       14.24408 75.77046 6.894628 86.12679 6.842937 -10.35632      9.713994 
1 1 1 11  18 16 o 81.01489 4.946295 80.69759       9.718656 86.18896       13.61457 74.99187       13.87772 83.42145 6.754884 77.64005 7.425298 5.781403       10.03810 
1 1 1 11  18 17 f 61.76926 5.878399 47.28428       8.741910 35.99251       11.63889 61.89956       13.24141 53.06682 9.341210 70.34204 7.858856 -17.27522      12.20737 
1 1 1 11  18 18 o 57.12033 8.633622 41.36848       11.64301 41.36848       11.64301 0.000000       0.000000 57.12033 8.633622 ?        ?        0.000000       8.633622 
1 1 1 11  18 19 o 76.05781 7.450089 72.24216       13.63141 72.24216       13.63141 0.000000       0.000000 76.05781 7.450089 ?        ?        0.000000       7.450089 
1 1 1 11  18 20 o 56.10031 5.924833 39.18535       7.977644 50.75455       10.96754 26.18674       11.62536 63.64027 7.198196 44.69016 10.79667 18.95011       12.97621 
1 1 1 11  18 21 o 32.73493 8.700457 13.87664       7.058675 17.46107       9.778531 9.976754       10.19973 36.66182 10.44243 30.17447 10.86429 6.487350       15.06908 
1 1 1 11  18 22 o 60.22873 5.885334 45.20252       8.527854 40.29569       11.38842 51.46608       12.86688 56.11625 8.601787 63.58414 8.518109 -7.467896      12.10574 
1 1 1 11  18 23 o 88.28830 3.301141 95.57602       7.089862 95.96001       14.82850 95.46223       8.072325 87.51333 7.011860 88.15228 3.766441 -0.6389465     7.959414 
1 1 1 11  18 24 o 95.32950 2.391549 111.1324       5.551364 120.0643       9.408950 106.3628       6.875634 98.79183 3.916023 93.15658 3.032790 5.635254       4.953085 
1 1 1 11  18 25 o 73.75642 2.439631 66.60413       4.378871 69.55373       7.554175 65.11150       5.373792 75.03738 4.147303 72.82820 3.034574 2.209175       5.138946 
1 1 1 11  18 26 o 40.66285 3.787102 20.53774       3.709531 23.84769       5.264539 17.27384       5.227791 43.54199 5.055398 36.69728 6.056986 6.844711       7.889494 
1 1 1 11  18 27 o 103.0704 3.284462 130.9050       8.239095 142.8382       13.08494 123.0657       10.60552 106.8732 5.038383 99.49807 4.384792 7.375130       6.679199 
1 1 1 11  18 28 o 64.44688 3.795805 51.63359       5.934915 54.23199       6.682716 41.93361       12.91176 65.91557 4.181901 54.92096 10.01636 10.99461       10.85430 
1 1 1 11  18 29 o 36.61852 4.111990 16.93838       3.606023 15.22962       4.651767 19.51145       5.708234 34.11075 5.803831 38.49060 6.303720 -4.379845      8.568625 
1 1 1 11  18 30 o 43.04477 3.671356 23.29103       3.814360 24.76282       5.084056 21.39573       5.769334 43.91686 4.830189 40.20000 6.078939 3.716854       7.764292 
1 1 1 11  18 31 o 30.80567 4.629492 12.36110       3.367976 14.89638       4.488706 9.095050       5.094716 33.35005 5.729569 25.31635 7.629541 8.033707       9.541377 
1 1 1 11  18 32 o 20.95691 7.144067 6.053253       4.371473 16.48593       9.359267 3.142209       4.943885 31.30704 10.45325 18.05169 7.285658 13.25535       12.74172 
1 1 1 11  18 33 o 51.46494 3.946661 34.27852       4.911916 35.88720       6.151094 31.44736       8.160181 51.83863 4.928478 45.97794 7.544508 5.860691       9.011631 
1 1 1 11  18 34 o 20.53076 6.015055 6.190315       3.202361 11.84530       4.222844 -1.463134      4.912675 28.31820 6.283596 13.84544 6.362918 14.47277       8.942612 
1 1 1 11  18 35 o 30.39487 5.159054 13.12381       3.684780 18.64950       5.094038 7.059474       5.336547 35.36618 6.132885 20.71842 7.788663 14.64776       9.913403 
1 1 1 11  18 36 o 20.51976 6.239378 6.698186       3.396657 7.838249       4.592629 5.321601       5.046597 21.28634 7.320633 18.41460 7.385751 2.871738       10.39909 
1 1 1 11  18 37 o 14.60430 5.925126 2.751432       3.289182 2.106578       4.468019 3.514350       4.859856 14.82384 6.490164 16.18013 6.925068 -1.356281      9.490986 
1 1 1 11  18 38 o 10.95895 5.072123 -0.7733838     3.201674 -3.155004      4.439337 1.808126       4.621881 11.26722 5.430525 14.23560 6.394331 -2.968378      8.389164 
1 1 1 11  18 39 o 12.05062 5.506897 0.3889320      3.610628 1.046664       5.046865 -0.3006670     5.167676 13.60606 6.321689 12.99075 6.148586 0.6153107      8.818666 
1 1 1 11  18 40 o 9.716875 4.694715 -2.635669      3.367184 1.815677       4.791110 -6.980151      4.733251 13.53313 6.242621 9.817169 4.896490 3.715964       7.933847 
1 1 1 11  19 0  o 52.19517 3.672406 33.40392       4.641263 32.48042       7.544086 33.96633       5.887265 51.16490 6.175357 52.53703 4.646301 -1.372135      7.728076 
1 1 1 11  19 1  o 89.44697 3.172624 97.70966       6.904497 80.24352       10.74973 109.9753       9.008325 80.84111 5.489244 94.84911 3.905754 -14.00800      6.736966 
1 1 1 11  19 2  o 387.7190 6.786187 1840.689       64.11786 1672.563       103.7645 1944.533       81.54961 367.6830 11.59532 397.9824 8.408566 -30.29935      14.32324 
1 1 1 11  19 3  o 289.5289 5.299941 1024.552       37.39375 1007.640       63.26171 1033.634       46.35964 286.1339 9.084189 290.5732 6.547091 -4.439331      11.19763 
1 1 1 11  19 4  o 269.4674 6.192996 888.6169       40.66709 0.000000       0.000000 888.6169       40.66709 ?        ?        269.4674 6.192996 0.000000       6.192996 
1 1 1 11  19 5  o 209.6246 3.310417 536.1117       16.91068 540.0190       26.30645 533.3599       22.07644 210.1950 5.135749 208.9889 4.334807 1.206131       6.720600 
1 1 1 11  19 6  o 103.9462 2.524527 131.7547       6.394764 149.6590       9.968978 119.2365       8.335729 110.6721 3.701586 98.78976 3.467925 11.88236       5.072301 
1 1 1 11  19 7  o 199.2077 2.872437 484.0433       13.94417 484.3251       23.80451 483.8961       17.20502 199.0609 4.907237 199.1215 3.545691 -0.6053162E-01 6.054164 
1 1 1 11  19 8  o 76.82260 2.327890 72.02897       4.352975 93.28989       12.38708 69.03353       4.649518 87.09908 5.870341 75.19448 2.541032 11.90460       6.396698 
1 1 1 11  19 9  o 173.4146 4.995947 368.0701       21.09049 356.7036       29.08021 380.6831       30.63327 170.3401 7.020632 175.9511 7.159344 -5.610947      10.02724 
1 1 1 11  19 10 o 207.2087 5.479314 525.9663       27.64325 564.8374       40.17537 491.0176       38.09449 214.1778 7.710073 199.6358 7.845744 14.54201       11.00004 
1 1 1 11  19 11 o 136.3012 4.674341 227.4483       15.50290 233.6876       21.81926 221.0872       22.03110 137.8534 6.513528 134.0278 6.767256 3.825592       9.392647 
1 1 1 11  19 12 o 164.1115 5.027244 329.9498       20.08133 347.0629       28.92791 314.0328       27.89864 167.8727 7.087271 159.6452 7.189636 8.227478       10.09556 
1 1 1 11  19 13 o 233.6777 5.914205 670.1983       33.65121 648.9783       46.40763 693.7276       48.86760 229.1310 8.325148 236.8453 8.480503 -7.714325      11.88390 
1 1 1 11  19 14 o 124.1150 4.662538 188.7935       14.07699 175.9700       19.03560 204.2701       20.91220 119.4742 6.563385 128.7213 6.689686 -9.247124      9.371761 
1 1 1 11  19 15 o 146.5651 6.768511 264.9325       24.10936 264.9325       24.10936 0.000000       0.000000 146.5651 6.768511 ?        ?        0.000000       6.768511 
1 1 1 11  19 16 o 122.1406 6.617396 184.1823       19.62268 184.1823       19.62268 0.000000       0.000000 122.1406 6.617396 ?        ?        0.000000       6.617396 
1 1 1 11  19 17 o 105.9224 4.843092 137.8042       12.46797 136.8569       17.46816 138.7879       17.80131 105.1376 6.855322 105.8593 6.938852 -0.7217026     9.754132 
1 1 1 11  19 18 o 175.9343 5.277693 380.4202       22.60161 428.1743       33.46949 340.3883       30.64409 185.8969 7.403042 165.6358 7.612357 20.26106       10.61852 
1 1 1 11  19 19 o 173.7992 5.271963 371.5410       22.30251 412.3686       32.80897 336.4688       30.40865 182.2865 7.401266 164.5453 7.604164 17.74127       10.61141 
1 1 1 11  19 20 o 47.83141 9.593640 29.70466       10.79292 29.70466       10.79292 0.000000       0.000000 47.83141 9.593640 ?        ?        0.000000       9.593640 
1 1 1 11  19 21 o 115.9451 4.970348 165.6307       14.01088 159.7322       19.42665 172.0247       20.22630 113.2161 7.076703 117.4997 7.096970 -4.283592      10.02231 
1 1 1 11  19 22 o 95.21481 5.049784 112.0008       11.67502 113.9686       16.16136 109.8530       16.88429 95.45477 6.996348 93.53787 7.469297 1.916893       10.23422 
1 1 1 11  19 23 o 39.38644 8.220537 20.22047       7.634760 18.85559       10.23309 21.93410       11.46618 37.70377 10.66337 40.49076 11.22894 -2.786991      15.48537 
1 1 1 11  19 24 o 95.65260 2.767626 112.0862       6.444412 103.3431       16.17730 113.7354       7.025961 90.34219 7.413323 96.30949 2.997296 -5.967293      7.996320 
1 1 1 11  19 25 o 90.91063 2.449939 101.2127       5.422630 92.82191       8.921117 106.1295       6.829011 86.61838 4.239301 92.97359 3.018130 -6.355209      5.203919 
1 1 1 11  19 26 o 70.55739 2.655499 61.12633       4.557735 75.38403       9.595733 56.97271       5.179250 77.60092 5.102601 68.01141 3.133413 9.589516       5.987888 
1 1 1 11  19 27 o 56.99448 3.270327 40.17318       4.523067 44.59194       6.354650 35.63584       6.439356 59.71058 4.398075 53.12530 5.034050 6.585285       6.684663 
1 1 1 11  19 28 o 30.72893 5.903298 12.40361       4.259955 13.18794       4.696236 8.760946       10.12069 31.55842 6.327056 27.55147 10.63632 4.006945       12.37590 
1 1 1 11  19 29 o 92.61401 3.584802 106.9467       8.075270 113.3836       9.425176 89.17877       15.65922 95.04774 4.078715 80.93677 8.045839 14.11098       9.020612 
1 1 1 11  19 30 o 47.02708 3.518694 27.79856       4.003184 37.68491       5.643349 17.78501       5.679539 54.40665 4.291180 36.07977 6.706508 18.32688       7.961877 
1 1 1 11  19 31 o 26.92269 5.525989 9.830679       3.503894 10.39666       4.363642 8.803395       5.878886 27.16650 6.646783 24.65779 8.285470 2.508711       10.62209 
1 1 1 11  19 32 f 16.21285 6.006176 3.135162       3.150425 4.293436       4.239047 1.706074       4.708603 18.52004 6.946040 16.32667 6.895287 2.193375       9.787362 
1 1 1 11  19 33 o 61.73414 5.769043 53.17996       8.578406 62.64281       12.91875 45.71668       11.47293 62.33280 8.745092 52.33158 9.339167 10.00122       12.79440 
1 1 1 11  19 34 o 59.77983 3.424226 46.29948       4.967439 55.63150       6.944324 36.52074       7.108595 64.23858 4.463834 50.22898 5.921208 14.00960       7.415289 
1 1 1 11  19 35 o 11.53196 5.174410 -0.3386399     3.017679 2.885798       4.075118 -4.253601      4.490316 15.83210 6.528730 11.45524 5.505928 4.376856       8.540466 
1 1 1 11  19 36 o 13.35583 5.632287 1.600265       3.134139 4.634026       4.319558 -1.772408      4.554448 17.32990 6.871852 12.54912 5.887633 4.780786       9.049121 
1 1 1 11  19 37 o 16.58236 6.179664 4.477938       3.344370 1.142991       4.529463 8.475351       4.958973 13.95083 6.292684 20.67524 7.556478 -6.724417      9.833526 
1 1 1 11  19 38 o 13.58752 5.836305 2.187186       3.474825 -1.114228      5.026939 5.208065       4.808618 12.67557 6.018334 16.70728 7.006839 -4.031717      9.236673 
1 1 1 11  19 39 o 14.88561 6.356191 3.713088       4.077003 -0.9642373E-02 4.593091 17.54223       8.852622 12.55649 5.897882 21.69552 9.317192 -9.139027      11.02702 
1 1 1 11  20 0  o 257.9699 4.304813 812.5488       27.06197 771.3540       36.49916 862.8442       40.32972 251.1051 5.964736 265.5310 6.232666 -14.42593      8.626945 
1 1 1 11  20 1  o 106.3983 2.862511 138.1649       7.415205 140.9152       10.42031 135.3433       10.55434 107.3695 3.989510 105.2106 4.124559 2.158882       5.738307 
1 1 1 11  20 2  o 135.1869 2.733992 222.8735       9.006747 224.4338       13.77837 221.7092       11.90165 135.5157 4.177258 134.7396 3.628033 0.7760925      5.532821 
1 1 1 11  20 3  o 128.7673 2.979666 202.2485       9.349948 195.4681       16.88394 205.2476       11.22895 126.3086 5.498529 129.6402 3.557739 -3.331604      6.549147 
1 1 1 11  20 4  o 83.84205 2.560167 85.80069       5.224648 74.69996       7.463744 96.46632       7.316007 78.12497 3.933054 88.85036 3.385119 -10.72539      5.189214 
1 1 1 11  20 5  o 103.2894 2.549867 130.1035       6.418144 138.7027       9.789649 123.6212       8.499684 106.5274 3.777091 100.5870 3.472775 5.940376       5.130943 
1 1 1 11  20 6  o 289.6494 4.157311 1024.680       29.34413 1016.623       45.49749 1030.418       38.39774 288.0174 6.482353 290.2153 5.429368 -2.197906      8.455705 
1 1 1 11  20 7  o 239.8430 3.266209 701.9971       19.09005 694.0453       32.48446 706.1921       23.59410 238.1226 5.598077 240.4615 4.026445 -2.338882      6.895704 
1 1 1 11  20 8  o 132.1638 3.093816 213.1412       9.964213 191.5598       19.61581 220.6464       11.56779 124.8219 6.470899 134.3943 3.535173 -9.572388      7.373600 
1 1 1 11  20 9  o 150.5580 4.777938 277.4865       17.50775 297.7632       24.94141 257.7901       24.58191 155.6456 6.590709 144.7214 6.990902 10.92418       9.607818 
1 1 1 11  20 10 o 78.08563 4.715977 74.84597       8.932024 85.05442       12.36779 63.71686       12.91345 83.05623 6.154325 71.58587 7.514393 11.47036       9.712972 
1 1 1 11  20 11 o 82.91509 4.700648 84.37119       9.458990 91.89640       13.25045 76.55141       13.50731 86.30126 6.344890 78.58636 7.130735 7.714905       9.544894 
1 1 1 11  20 12 o 140.4675 4.766291 241.7487       16.29157 244.0607       22.71482 239.2995       23.37905 140.7744 6.640111 139.3306 6.907171 1.443756       9.581236 
1 1 1 11  20 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  20 14 o 75.98201 6.693195 71.57646       12.26656 71.57646       12.26656 0.000000       0.000000 75.98201 6.693195 ?        ?        0.000000       6.693195 
1 1 1 11  20 15 o 85.87720 4.756822 90.61462       9.915871 79.63758       13.07101 105.4962       15.21916 80.13689 6.756176 92.29871 6.814475 -12.16181      9.595987 
1 1 1 11  20 16 o 117.3834 4.735631 169.1231       13.51849 177.6356       18.89861 160.2035       19.34527 119.9268 6.490814 113.7423 7.013485 6.184494       9.556131 
1 1 1 11  20 17 o 71.91526 5.148939 63.79835       8.963787 63.63689       12.34454 63.97844       13.03722 71.41093 7.191563 71.50729 7.597836 -0.9635162E-01 10.46163 
1 1 1 11  20 18 o 128.9981 4.849331 204.5023       15.21695 193.4094       20.63056 217.7383       22.53540 124.9276 6.802336 132.5077 7.003791 -7.580093      9.763445 
1 1 1 11  20 19 o 64.35170 5.535266 51.34971       8.596036 50.15831       11.96251 52.62172       12.36052 63.01357 7.968110 64.54670 8.031504 -1.533134      11.31352 
1 1 1 11  20 20 o 74.14429 5.421434 68.06824       9.727827 72.10875       13.66022 63.91088       13.85633 75.79037 7.494178 71.11859 8.141775 4.671783       11.06577 
1 1 1 11  20 21 o 67.24665 7.821789 57.24218       12.57885 57.24218       12.57885 0.000000       0.000000 67.24665 7.821789 ?        ?        0.000000       7.821789 
1 1 1 11  20 22 o 107.8993 4.939996 143.8614       12.95470 139.1843       17.88136 149.0281       18.79414 105.3886 7.002300 109.0189 7.113166 -3.630219      9.981449 
1 1 1 11  20 23 o 53.62080 6.150725 36.23703       7.891707 32.66774       10.73345 40.43693       11.64308 49.89209 9.165855 55.75633 8.865643 -5.864243      12.75196 
1 1 1 11  20 24 o 71.70358 2.921210 63.12095       5.093655 0.000000       0.000000 63.12095       5.093655 ?        ?        71.70358 2.921210 0.000000       2.921210 
1 1 1 11  20 25 o 41.30756 3.207325 21.09535       3.203278 32.01895       11.00545 20.08427       3.348244 48.68777 9.617102 40.25394 3.446414 8.433830       10.21599 
1 1 1 11  20 26 o 38.37822 3.066919 18.23457       2.844441 15.74872       5.102550 19.35535       3.426182 34.77922 6.250216 39.43164 3.605428 -4.652412      7.215560 
1 1 1 11  20 27 o 31.88045 3.454243 12.71274       2.640750 16.91422       4.948295 11.03966       3.122584 36.08431 5.825689 29.41085 4.499673 6.673466       7.361094 
1 1 1 11  20 28 o 27.69081 3.857531 9.733965       2.532476 10.39720       4.677181 9.458875       3.012232 27.64731 6.950616 27.02357 4.747286 0.6237392      8.417113 
1 1 1 11  20 29 o 78.48717 3.674388 77.22271       7.008300 74.12508       7.980794 87.66013       14.64966 76.50060 4.298287 80.12407 7.593511 -3.623474      8.725634 
1 1 1 11  20 30 o 53.48257 3.678414 36.16213       4.764924 46.76548       6.328424 22.28196       7.240547 60.44550 4.324887 39.45621 7.806963 20.98930       8.924870 
1 1 1 11  20 31 o 28.72460 5.168034 11.13094       3.484558 17.29918       4.910124 4.872515       4.945888 35.50827 5.880105 19.73028 7.480130 15.77799       9.514620 
1 1 1 11  20 32 o 41.21651 3.871962 22.04597       3.843458 28.34265       5.382677 15.49605       5.489848 45.98827 4.877297 32.18169 7.182548 13.80658       8.681993 
1 1 1 11  20 33 o 17.68977 6.083811 4.435348       3.171875 12.67996       4.452662 -4.058650      4.519502 29.12074 6.445138 11.83795 5.644854 17.28279       8.567624 
1 1 1 11  20 34 o 31.55548 6.010122 14.82050       4.452893 33.19304       10.01742 10.29625       4.971014 41.32675 10.04608 24.72447 7.554121 16.60228       12.56935 
1 1 1 11  20 35 o 12.92557 5.520104 1.149391       3.075827 0.9056442      4.231453 1.422470       4.478834 14.05620 6.228284 14.69990 6.464999 -0.6436920     8.977067 
1 1 1 11  20 36 o 21.65799 6.223317 7.771384       3.458290 9.302243       4.843034 6.178657       4.939929 22.15962 7.520065 18.59737 7.356915 3.562250       10.52025 
1 1 1 11  20 37 o 10.14255 4.857858 -2.643158      3.427070 -7.109339      4.908722 1.603910       4.786795 10.37562 5.143178 14.21194 6.434096 -3.836319      8.237103 
1 1 1 11  20 38 o 19.27298 6.352925 6.915051       3.459751 7.509188       4.874776 6.312030       4.911080 18.59536 7.323085 17.42526 7.174539 1.170097       10.25191 
1 1 1 11  20 39 o 10.35780 4.896287 -1.270904      3.257843 -1.042414      4.568075 -1.507411      4.647523 11.90712 5.677077 11.75832 5.638469 0.1487989      8.001347 
1 1 1 11  21 0  f 162.2204 2.939014 320.9861       11.61832 331.0942       18.26768 314.1201       15.05577 164.5673 4.559555 160.4140 3.851453 4.153320       5.968520 
1 1 1 11  21 1  o 16.93241 6.249856 2.742579       3.405754 3.344887       4.040771 1.265150       6.328608 18.54810 6.814259 19.62318 8.118285 -1.075087      10.59909 
1 1 1 11  21 2  o 168.6617 2.980422 347.0148       12.24984 338.2021       18.66071 353.6881       16.23853 166.3077 4.608914 170.2035 3.915095 -3.895813      6.047318 
1 1 1 11  21 3  f 176.4268 3.040959 379.7371       13.07408 353.7223       19.49422 401.0039       17.62574 170.0621 4.708476 181.2173 3.991274 -11.15520      6.172521 
1 1 1 11  21 4  o 123.8560 2.674519 187.1028       8.072330 176.3188       11.89924 196.2972       10.98723 120.0851 4.072141 126.7635 3.560314 -6.678383      5.409082 
1 1 1 11  21 5  o 22.61773 5.987690 6.488718       3.351551 2.361317       6.702919 7.864618       3.870072 20.98624 8.478589 24.86165 6.362151 -3.875406      10.60016 
1 1 1 11  21 6  o 171.4793 2.982403 358.7739       12.46276 344.7256       18.65238 370.1035       16.75060 167.8740 4.563708 174.0767 3.948697 -6.202652      6.034868 
1 1 1 11  21 7  o 196.3394 2.892684 470.3284       13.84027 431.2157       22.52377 494.0553       17.54293 187.6961 4.928624 201.1596 3.578700 -13.46349      6.090848 
1 1 1 11  21 8  o 364.7159 5.027282 1627.687       44.68111 1521.119       96.56962 1656.714       50.40034 349.3591 11.35821 367.7566 5.623892 -18.39743      12.67427 
1 1 1 11  21 9  o 114.8305 2.736598 160.8786       7.657802 140.0653       16.76593 166.3653       8.608177 106.6265 6.483114 116.7156 3.029099 -10.08909      7.155851 
1 1 1 11  21 10 o 282.8809 9.436481 992.3718       64.95932 992.3718       64.95932 0.000000       0.000000 282.8809 9.436481 ?        ?        0.000000       9.436481 
1 1 1 11  21 11 f 200.9559 7.611852 498.3979       37.20842 498.3979       37.20842 0.000000       0.000000 200.9559 7.611852 ?        ?        0.000000       7.611852 
1 1 1 11  21 12 o 84.26485 4.824066 87.22363       9.864548 85.81493       13.26402 88.96708       14.75612 83.28697 6.588892 84.68639 7.219028 -1.399422      9.773835 
1 1 1 11  21 13 o 35.60887 7.102705 16.16441       5.947145 12.17307       7.631015 22.33870       9.491091 31.12256 9.328046 41.58684 9.564939 -10.46427      13.36041 
1 1 1 11  21 14 o 208.4739 8.077569 538.6097       40.95868 0.000000       0.000000 538.6097       40.95868 ?        ?        208.4739 8.077569 0.000000       8.077569 
1 1 1 11  21 15 o 142.3297 4.860210 248.6281       16.83252 234.1298       22.63913 266.5510       25.17126 137.6421 6.770285 146.7967 7.057105 -9.154602      9.779545 
1 1 1 11  21 16 o 104.1382 4.776624 133.2596       12.08952 131.2312       16.52751 135.5939       17.73012 102.9420 6.623530 104.5488 6.999475 -1.606850      9.636586 
1 1 1 11  21 17 o 191.6025 5.432783 451.7355       25.34083 473.2716       36.19360 431.0268       35.49142 195.2009 7.623418 186.1694 7.840654 9.031418       10.93583 
1 1 1 11  21 18 o 47.24422 6.045075 27.96335       6.800392 25.15137       8.986895 31.73059       10.40195 44.15784 8.661110 49.66508 8.922575 -5.507236      12.43492 
1 1 1 11  21 19 o 75.98268 6.907624 72.15196       12.65060 72.15196       12.65060 0.000000       0.000000 75.98268 6.907624 ?        ?        0.000000       6.907624 
1 1 1 11  21 20 o 112.7870 4.863025 156.8461       13.33460 154.1930       18.25986 159.8777       19.51899 111.2156 6.769517 113.1210 7.116796 -1.905472      9.822177 
1 1 1 11  21 21 o 144.2114 5.028141 256.8356       17.64324 245.4234       23.94452 270.3916       26.09680 140.0712 7.037438 146.8888 7.313586 -6.817627      10.14959 
1 1 1 11  21 22 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  21 23 o 71.27481 7.836849 65.15008       13.38743 0.000000       0.000000 65.15008       13.38743 ?        ?        71.27481 7.836849 0.000000       7.836849 
1 1 1 11  21 24 o 80.31951 2.686260 79.15868       5.250415 111.5629       15.58762 75.01173       5.576266 93.65730 6.877670 78.13187 2.933941 15.52542       7.477322 
1 1 1 11  21 25 o 69.68279 2.759207 59.70825       4.676129 80.31767       13.21809 56.75997       4.999425 79.04204 6.932493 67.87378 3.030249 11.16826       7.565836 
1 1 1 11  21 26 o 13.82113 5.179863 1.851543       2.356471 8.567007       7.137550 1.030012       2.496451 26.05770 9.117199 12.86745 5.182900 13.19025       10.48741 
1 1 1 11  21 27 o 22.32363 4.462097 6.460047       2.342464 8.127296       4.606658 5.878610       2.720428 24.56548 7.219047 21.11918 5.296121 3.446293       8.953409 
1 1 1 11  21 28 o 34.97743 3.302196 15.33641       2.781350 16.81288       5.139235 14.72483       3.307609 35.49906 6.164318 34.02181 4.070190 1.477249       7.386831 
1 1 1 11  21 29 o 14.79593 5.650666 2.184179       2.835351 4.519088       4.584522 0.7378895      3.608167 19.50042 7.241391 14.26842 6.031509 5.232002       9.424269 
1 1 1 11  21 30 o 16.91552 5.178102 3.807626       2.334271 6.286143       4.464437 2.875113       2.738408 21.30779 7.220255 15.56599 5.626050 5.741800       9.153389 
1 1 1 11  21 31 o 25.20822 5.540949 8.847736       3.310802 8.597482       4.705135 9.093166       4.659559 23.95599 7.355017 24.64584 7.265102 -0.6898499     10.33818 
1 1 1 11  21 32 o 13.92369 5.709107 1.612392       3.093143 3.365698       4.481229 0.1690189E-01  4.274797 17.21775 6.940886 14.04848 6.240546 3.169277       9.333826 
1 1 1 11  21 33 o 37.73140 4.124412 19.06213       3.730590 25.32014       5.377456 13.25571       5.179795 42.33766 5.329972 28.60732 7.381142 13.73034       9.104386 
1 1 1 11  21 34 o 16.40858 6.535328 3.572970       3.923469 6.135084       9.078246 2.984494       4.350778 20.06514 8.991233 16.07675 6.697956 3.988394       11.21182 
1 1 1 11  21 35 o 12.38706 5.441415 0.6221817      3.164332 -5.771150      4.465124 7.072632       4.485025 10.56478 5.171442 20.00790 7.204204 -9.443119      8.868166 
1 1 1 11  21 36 o 13.41758 5.808993 1.631490       3.495658 2.678718       5.312745 0.8319754      4.642067 15.47330 6.909886 13.81247 6.285838 1.660830       9.341214 
1 1 1 11  21 37 o 12.43343 5.526646 1.008032       3.358090 8.409387       4.813470 -6.009988      4.687162 19.92380 7.415906 10.35810 5.114670 9.565701       9.008636 
1 1 1 11  21 38 o 10.93869 5.087863 -0.5521565     3.282835 -4.055739      4.629790 2.990566       4.655579 10.78841 5.277745 14.49661 6.471434 -3.708197      8.350692 
1 1 1 11  22 0  o 62.84072 2.820056 48.26637       4.307518 49.40275       6.470464 47.36191       5.772593 63.45816 4.207963 62.16521 3.829130 1.292953       5.689393 
1 1 1 11  22 1  o 118.2251 3.359837 170.7173       9.669928 172.7878       16.08225 169.5448       12.10195 118.6901 5.575858 117.7352 4.224913 0.9549637      6.995719 
1 1 1 11  22 2  o 195.7680 3.657870 467.8907       17.45043 438.4483       23.10202 507.0107       26.62946 189.2796 5.012938 203.4861 5.374921 -14.20641      7.349784 
1 1 1 11  22 3  o 185.8309 3.469720 421.5332       15.71262 392.5405       21.22256 456.7054       23.37507 179.1037 4.866981 193.1808 4.969510 -14.07709      6.955827 
1 1 1 11  22 4  o 211.9299 3.378069 548.2305       17.44604 511.6698       25.99478 578.1951       23.53330 204.4232 5.222467 217.5040 4.439964 -13.08083      6.854739 
1 1 1 11  22 5  o 47.45891 3.129956 27.60635       3.599654 25.18546       4.992483 30.22753       5.194907 45.15530 4.601249 49.54314 4.346871 -4.387844      6.329832 
1 1 1 11  22 6  o 133.3861 3.591290 217.4141       11.66277 212.0220       20.25597 220.0882       14.26443 131.3149 6.348800 134.1113 4.370521 -2.796402      7.707705 
1 1 1 11  22 7  f 183.1581 3.007599 409.4036       13.42400 403.4479       20.84731 413.6222       17.54559 181.5493 4.716146 183.9977 3.913088 -2.448318      6.128155 
1 1 1 11  22 8  o 140.8273 2.649901 241.9610       9.093951 229.5650       13.85385 251.3462       12.05462 136.9802 4.155077 143.4679 3.447965 -6.487656      5.399364 
1 1 1 11  22 9  o 191.9337 5.327187 451.6754       24.89231 473.9380       35.17143 429.3327       35.23473 196.0549 7.374813 186.4651 7.771237 9.589828       10.71354 
1 1 1 11  22 10 o 196.8338 3.499486 473.2606       16.78572 482.2433       35.92558 470.7519       18.98552 197.6733 7.471402 196.2405 3.970068 1.432816       8.460690 
1 1 1 11  22 11 o 110.2289 2.678226 148.2773       7.194139 139.1725       16.45252 150.4297       7.999427 106.2175 6.385727 110.9676 2.960838 -4.750137      7.038755 
1 1 1 11  22 12 o 110.3912 4.705595 149.5051       12.62954 167.3132       17.98744 132.1896       17.73692 116.4726 6.361530 103.3292 7.086907 13.14339       9.523304 
1 1 1 11  22 13 o 78.93026 4.906656 76.64642       9.391008 73.30643       12.59229 80.83199       14.09641 76.84197 6.794599 80.61823 7.252735 -3.776253      9.938246 
1 1 1 11  22 14 o 60.44014 5.472914 45.21926       7.973560 51.38575       10.75343 37.68829       11.88374 64.16432 6.990172 54.28296 9.319217 9.881359       11.64948 
1 1 1 11  22 15 o 175.3016 7.559717 381.2336       32.21851 0.000000       0.000000 381.2336       32.21851 ?        ?        175.3016 7.559717 0.000000       7.559717 
1 1 1 11  22 16 o 83.25827 4.938240 85.39999       9.974255 96.66291       14.16036 74.30925       14.05172 88.22272 6.635170 77.05068 7.581812 11.17204       10.07518 
1 1 1 11  22 17 f 140.3101 4.913143 242.1419       16.77311 253.0978       23.54787 230.8583       23.89752 142.8529 6.783739 136.2571 7.222902 6.595734       9.909058 
1 1 1 11  22 18 o 178.3324 5.275556 391.8734       22.90112 377.5621       31.36295 408.2196       33.51857 174.0993 7.409310 180.9286 7.619307 -6.829239      10.62787 
1 1 1 11  22 19 o 105.4108 5.060390 137.1813       12.96089 144.7477       17.43493 127.8350       19.37751 107.7729 6.671272 100.7789 7.954737 6.994064       10.38189 
1 1 1 11  22 20 o 75.38850 5.397891 70.57911       9.851030 72.34426       13.80111 68.74566       14.06557 75.64941 7.588766 73.58995 7.970456 2.059456       11.00534 
1 1 1 11  22 21 o 110.2033 7.301260 153.0618       19.49723 0.000000       0.000000 153.0618       19.49723 ?        ?        110.2033 7.301260 0.000000       7.301260 
1 1 1 11  22 22 o 40.17669 7.097680 20.87361       6.695011 17.92105       8.532017 25.60485       10.80041 36.58215 9.490622 43.50359 10.34062 -6.921440      14.03568 
1 1 1 11  22 23 o 63.93717 7.410057 52.61269       11.33193 52.61269       11.33193 0.000000       0.000000 63.93717 7.410057 ?        ?        0.000000       7.410057 
1 1 1 11  22 24 o 66.09924 5.403143 55.09161       8.627329 54.06405       11.12784 56.63987       13.65942 64.65784 7.183530 65.28728 8.810184 -0.6294479     11.36761 
1 1 1 11  22 25 o 41.66807 3.156665 21.52238       3.181450 26.08880       9.047233 20.87803       3.398506 43.69199 8.801849 40.97144 3.435458 2.720551       9.448541 
1 1 1 11  22 26 o 58.63224 3.104897 42.58944       4.420474 72.70462       12.58400 38.35026       4.721359 74.35398 7.028518 55.50129 3.508783 18.85269       7.855674 
1 1 1 11  22 27 o 46.63183 4.155071 27.50787       4.672284 44.45266       10.74246 23.55460       5.188766 56.89631 7.965872 42.73370 5.082045 14.16261       9.448931 
1 1 1 11  22 28 o 18.91438 4.870757 4.754029       2.258555 10.46069       4.363794 2.666030       2.639601 27.52250 6.593100 15.29513 5.524228 12.22738       8.601515 
1 1 1 11  22 29 o 36.02694 3.780395 16.58613       3.269571 17.83919       5.051150 15.68250       4.289415 36.23294 5.925336 34.27782 5.306413 1.955112       7.954094 
1 1 1 11  22 30 o 30.37953 3.627543 11.88126       2.632521 12.14527       4.804471 11.76800       3.146979 28.86303 6.920418 29.83770 4.465109 -0.9746704     8.235860 
1 1 1 11  22 31 o 15.83223 5.062076 3.391269       2.206028 6.580321       4.223193 2.194574       2.587034 21.03825 7.021785 14.10441 5.394848 6.933845       8.854934 
1 1 1 11  22 32 o 33.05014 4.726836 14.98252       3.698687 19.35662       5.508709 11.39196       4.990993 35.95806 6.526938 26.56384 7.423944 9.394213       9.885134 
1 1 1 11  22 33 o 11.13197 5.030605 -0.6293294     2.910593 -4.533098      4.005071 3.739911       4.237124 10.61856 5.127850 16.89185 6.770096 -6.273288      8.492882 
1 1 1 11  22 34 o 12.62623 5.552713 0.5714730      3.303591 2.864186       5.167228 -1.013549      4.296358 16.25264 7.049405 12.74949 5.891936 3.503151       9.187438 
1 1 1 11  22 35 o 13.86018 6.098824 1.463451       3.990570 3.885611       9.881320 0.9914247      4.362112 17.83068 8.457805 13.83593 6.213647 3.994758       10.49495 
1 1 1 11  22 36 o 13.21208 5.664538 1.824648       3.262007 4.295614       4.878665 -0.1731790     4.386787 16.18802 6.933672 12.73869 5.910143 3.449330       9.110741 
1 1 1 11  22 37 o 10.21659 4.848657 -1.760845      3.255693 -0.4807545     4.636500 -3.005923      4.572653 12.51614 5.893493 11.25357 5.445344 1.262577       8.024029 
1 1 1 11  23 0  o 235.3135 4.024805 676.3986       23.07957 645.9740       31.58131 711.2721       33.81160 229.6793 5.642508 240.9838 5.757605 -11.30443      8.061507 
1 1 1 11  23 1  f 170.8271 3.360698 356.2100       13.99015 376.4756       20.02757 336.8971       19.55114 175.4071 4.689590 165.9006 4.841197 9.506470       6.740137 
1 1 1 11  23 2  o 201.2551 3.661058 494.5973       17.95517 477.1895       24.59932 514.4463       26.26760 197.4102 5.117805 204.9478 5.263814 -7.537628      7.341640 
1 1 1 11  23 3  o 65.59866 3.710166 52.71999       5.906775 52.80735       6.559364 52.34531       13.58395 65.61108 4.123349 64.54042 8.871374 1.070663       9.782805 
1 1 1 11  23 4  o 231.3755 3.966382 654.0691       22.36393 594.3813       29.66451 732.6619       34.03973 220.2146 5.532214 244.5254 5.712499 -24.31076      7.952235 
1 1 1 11  23 5  o 45.09414 3.492270 24.97892       3.807750 28.75463       5.049939 20.00352       5.796964 48.30556 4.336040 39.92741 6.155474 8.378155       7.529349 
1 1 1 11  23 6  o 27.24147 4.206726 9.282553       2.702767 6.483399       3.570261 13.04006       4.136536 22.64513 6.260444 32.18578 5.469479 -9.540649      8.313144 
1 1 1 11  23 7  o 123.2322 3.155266 185.5141       9.467574 208.6517       19.66070 178.5289       10.80256 130.2277 6.213181 120.8325 3.672920 9.395187       7.217615 
1 1 1 11  23 8  o 238.4748 3.655671 694.8219       21.24446 692.8037       32.81536 696.2781       27.87417 237.6756 5.665738 238.4908 4.796166 -0.8151855     7.423193 
1 1 1 11  23 9  o 59.01138 2.860906 42.60394       4.101848 62.93018       10.88822 39.24212       4.428084 71.28831 6.333469 56.59701 3.223935 14.69130       7.106799 
1 1 1 11  23 10 o 204.6330 4.114378 512.1577       20.51710 0.000000       0.000000 512.1577       20.51710 ?        ?        204.6330 4.114378 0.000000       4.114378 
1 1 1 11  23 11 o 148.6406 3.037147 269.7926       11.00118 268.9039       24.23570 270.0232       12.34645 147.6118 6.755402 148.6621 3.408048 -1.050308      7.566390 
1 1 1 11  23 12 o 104.8847 2.662302 134.3658       6.799148 128.9993       16.33101 135.4910       7.478067 102.1262 6.597352 105.2977 2.917113 -3.171432      7.213501 
1 1 1 11  23 13 o 172.2151 5.153702 364.2943       21.60418 355.3983       29.68388 374.3141       31.50306 169.4487 7.205077 173.8123 7.454989 -4.363556      10.36774 
1 1 1 11  23 14 o 123.6928 4.754571 187.9317       14.30483 197.7383       20.17943 178.0261       20.28111 126.4271 6.572436 119.8270 6.975623 6.600128       9.584166 
1 1 1 11  23 15 o 114.1270 4.729267 160.1106       13.12430 172.8719       18.69901 147.7204       18.42514 118.1360 6.520607 109.0474 6.970101 9.088654       9.544664 
1 1 1 11  23 16 o 69.49798 7.840650 60.80820       13.04732 0.000000       0.000000 60.80820       13.04732 ?        ?        69.49798 7.840650 0.000000       7.840650 
1 1 1 11  23 17 o 126.3053 4.857353 196.4220       14.92269 218.4436       21.40409 175.5940       20.81593 132.6178 6.644228 118.6533 7.233495 13.96442       9.821875 
1 1 1 11  23 18 o 22.68546 8.369981 5.209084       6.107275 2.787955       8.194619 8.234080       9.159723 22.81348 9.316129 27.92281 10.25934 -5.109329      13.85800 
1 1 1 11  23 19 o 32.89822 10.77477 13.62691       9.958397 0.000000       0.000000 13.62691       9.958397 ?        ?        32.89822 10.77477 0.000000       10.77477 
1 1 1 11  23 20 o 128.0236 4.961688 202.8186       15.45015 207.2158       21.21317 197.8510       22.54744 128.5491 6.795887 125.2634 7.419708 3.285736       10.06162 
1 1 1 11  23 21 o 41.95133 6.864118 22.64033       6.774787 20.63542       8.743571 25.65226       10.71674 39.29510 9.280115 43.56413 10.26447 -4.269028      13.83762 
1 1 1 11  23 22 o 50.04607 6.268728 31.92476       7.477887 29.84062       9.672279 35.02146       11.79007 47.43874 8.686826 50.94975 9.852341 -3.511005      13.13505 
1 1 1 11  23 23 o 21.64645 5.198536 6.086074       2.707657 26.01123       8.332050 3.733434       2.863050 44.27473 8.017645 17.54403 5.778995 26.73070       9.883289 
1 1 1 11  23 24 f 73.94931 7.030942 70.98106       12.51795 70.98106       12.51795 0.000000       0.000000 73.94931 7.030942 ?        ?        0.000000       7.030942 
1 1 1 11  23 25 o 23.52189 4.683750 7.177467       2.590350 14.49801       7.588464 6.211957       2.755883 32.08212 9.218676 21.73854 5.259850 10.34358       10.61367 
1 1 1 11  23 26 o 21.75426 5.129163 6.254344       2.674521 2.294459       7.310681 6.866214       2.873732 20.40924 8.604187 22.76937 5.281694 -2.360125      10.09596 
1 1 1 11  23 27 o 32.74020 4.083964 13.70548       3.187707 0.000000       0.000000 13.70548       3.187707 ?        ?        32.74020 4.083964 0.000000       4.083964 
1 1 1 11  23 28 o 10.48640 4.582185 -0.2486786     2.217614 0.6606627      6.865916 -0.3545917     2.343203 18.27485 8.021955 10.66265 4.683242 7.612190       9.288947 
1 1 1 11  23 29 o 10.37711 4.432792 0.1690541      1.984300 -1.355260      3.830503 0.7281347      2.319829 12.65171 5.738847 11.81674 4.904302 0.8349705      7.548943 
1 1 1 11  23 30 o 11.34986 4.806146 0.4746242      2.297632 5.624321       4.155303 -1.793236      2.757529 19.86614 6.956055 10.13598 4.696789 9.730161       8.393243 
1 1 1 11  23 31 o 32.68380 3.503647 13.90373       2.747044 19.39456       5.177488 11.75238       3.240821 36.62323 6.009568 29.30149 4.697328 7.321747       7.627569 
1 1 1 11  23 32 o 16.71654 5.190253 3.994545       2.335288 7.366710       4.555744 2.792659       2.719797 21.29064 7.292209 14.82356 5.562931 6.467079       9.171832 
1 1 1 11  23 33 o 10.49005 4.901898 -1.819689      3.104419 -2.384691      4.832530 -1.422694      4.050814 12.74277 6.005313 12.25609 5.683846 0.4866858      8.268610 
1 1 1 11  23 34 o 16.33259 5.329232 4.046973       2.437210 5.253118       4.770855 3.621049       2.835062 17.81913 7.169271 15.61110 5.712276 2.208034       9.166709 
1 1 1 11  23 35 o 19.41452 5.725653 6.193041       2.893531 29.82983       10.71371 4.333277       3.005209 30.22749 11.09730 16.31993 5.894398 13.90756       12.56559 
1 1 1 11  23 36 o 8.524319 4.186488 -4.332907      3.002090 -7.266529      4.255581 -1.426658      4.235682 9.391292 4.677472 11.74015 5.559606 -2.348857      7.265532 
1 1 1 11  23 37 o 12.88000 5.594280 1.857495       3.263427 0.3387984      4.551761 3.463886       4.681333 12.76799 5.956197 14.87303 6.572488 -2.105043      8.869830 
1 1 1 11  24 0  o 117.0442 2.726451 167.1347       7.776494 162.6735       11.63399 170.7379       10.45543 115.3000 4.147354 118.1844 3.634643 -2.884422      5.514633 
1 1 1 11  24 1  o 90.84743 2.728103 100.7842       6.032775 94.98204       8.755592 106.0285       8.324024 88.06681 4.090962 93.10095 3.676188 -5.034142      5.500030 
1 1 1 11  24 2  o 144.4798 2.862902 254.7203       10.07975 251.0009       15.24570 257.6088       13.43518 143.2139 4.373563 145.1655 3.801176 -1.951599      5.794566 
1 1 1 11  24 3  o 178.8405 3.124175 390.4122       13.61562 387.1562       20.67194 392.9071       18.09511 177.8155 4.774951 179.2884 4.141646 -1.472916      6.320869 
1 1 1 11  24 4  o 115.4967 3.153688 162.9649       8.867836 167.8920       11.42775 155.5074       14.05934 117.1365 4.009343 112.5724 5.138588 4.564087       6.517663 
1 1 1 11  24 5  o 358.3972 5.576886 1574.731       48.70712 1617.201       96.77144 1560.322       56.36750 359.8283 11.04920 356.3665 6.490765 3.461823       12.81463 
1 1 1 11  24 6  o 153.7293 2.920367 288.4568       10.94032 294.2278       16.57875 284.0051       14.56083 155.0268 4.392855 152.3810 3.924469 2.645813       5.890555 
1 1 1 11  24 7  o 203.1231 3.323011 503.9041       16.44853 502.4183       25.10460 505.0217       21.77300 202.4395 5.092920 203.1687 4.397699 -0.7292175     6.728862 
1 1 1 11  24 8  o 43.47212 3.443262 23.23074       3.617910 34.54100       8.454215 20.69508       4.002970 52.55920 6.756801 40.93826 4.066206 11.62094       7.885962 
1 1 1 11  24 9  o 181.1929 3.404324 401.1144       15.03170 416.4463       32.20425 396.8437       16.99682 183.6209 7.211079 180.1541 3.871573 3.466797       8.184665 
1 1 1 11  24 10 o 80.49988 2.707934 79.19085       5.304577 87.15571       12.89173 77.56748       5.820106 83.92358 6.350773 79.64236 3.004207 4.281212       7.025495 
1 1 1 11  24 11 f 130.7073 2.921544 208.6333       9.305688 205.2254       20.66111 209.5006       10.42270 128.8792 6.600605 130.9419 3.266371 -2.062759      7.364589 
1 1 1 11  24 12 o 159.6477 3.139974 311.4164       12.21588 322.2498       27.11120 308.6567       13.68368 161.3990 6.909039 158.8798 3.534257 2.519241       7.760528 
1 1 1 11  24 13 f 66.14388 2.613106 53.50181       4.203657 46.19475       11.18967 54.70251       4.535902 60.55008 7.761713 66.86626 2.789816 -6.316181      8.247864 
1 1 1 11  24 14 f 82.01874 2.576849 82.22517       5.143978 71.40813       12.79021 84.31244       5.618393 75.63553 7.019394 83.03289 2.780603 -7.397362      7.550076 
1 1 1 11  24 15 o 27.96501 8.352631 9.897498       6.126607 14.55001       8.242927 4.154969       9.157763 33.57533 9.595399 24.88340 9.959813 8.691936       13.83002 
1 1 1 11  24 16 o 186.2646 7.729935 433.5410       35.01043 0.000000       0.000000 433.5410       35.01043 ?        ?        186.2646 7.729935 0.000000       7.729935 
1 1 1 11  24 17 o 60.31935 8.329098 46.48227       11.91667 0.000000       0.000000 46.48227       11.91667 ?        ?        60.31935 8.329098 0.000000       8.329098 
1 1 1 11  24 18 o 16.47795 7.167426 -0.7265394     5.373115 0.2262742      7.006816 -2.086634      8.371463 19.51798 8.333430 19.87334 8.785321 -0.3553619     12.10900 
1 1 1 11  24 19 o 74.94125 5.058794 69.75925       9.184421 77.40517       12.51134 60.82384       13.52530 78.44885 6.605890 68.87183 8.220918 9.577026       10.54615 
1 1 1 11  24 20 o 90.22449 4.985431 101.1735       10.91872 120.5606       15.49285 82.04190       15.39046 97.84535 6.535097 79.96687 8.005295 17.87848       10.33403 
1 1 1 11  24 21 o 28.08209 8.230824 10.37073       5.995154 1.966079       7.611423 24.10668       9.730499 21.23034 8.853203 42.14190 9.679294 -20.91156      13.11747 
1 1 1 11  24 22 o 72.74239 5.107321 66.41386       8.995973 58.06379       11.68583 78.56086       14.09447 66.99087 7.274934 77.87291 7.520688 -10.88204      10.46353 
1 1 1 11  24 23 o 46.34080 6.396674 27.84347       7.031141 32.05316       9.034754 21.37826       11.19651 49.09884 7.812584 38.50599 11.23773 10.59285       13.68660 
1 1 1 11  24 24 o 28.52248 9.595835 11.03629       7.885313 11.03629       7.885313 0.000000       0.000000 28.52248 9.595835 ?        ?        0.000000       9.595835 
1 1 1 11  24 25 o 18.05444 7.782819 0.6336030      6.221583 0.6336030      6.221583 0.000000       0.000000 18.05444 7.782819 ?        ?        0.000000       7.782819 
1 1 1 11  24 26 o 44.39509 3.191593 24.63891       3.429815 32.76167       8.780962 23.17655       3.725785 48.60015 7.668237 42.90415 3.596617 5.695995       8.469799 
1 1 1 11  24 27 f 13.49472 5.045301 1.906704       2.232840 1.259806       6.131328 2.005612       2.397467 17.93724 7.729178 13.88565 5.220370 4.051589       9.326975 
1 1 1 11  24 28 o 10.18193 4.465891 -0.2768558     2.124063 8.597434       6.296697 -1.416336      2.256313 24.12512 8.552949 9.368526 4.307928 14.75659       9.576595 
1 1 1 11  24 29 o 20.49950 5.130785 5.828782       2.556796 32.61602       8.442668 3.123965       2.682777 46.53318 7.715387 15.69644 5.580989 30.83674       9.522323 
1 1 1 11  24 30 o 17.11924 5.929948 4.051982       3.015482 10.40619       8.242477 3.070092       3.240101 24.24989 9.530747 15.84635 6.043282 8.403534       11.28523 
1 1 1 11  24 31 f 15.93734 5.114176 3.557733       2.250163 7.720581       4.347803 2.034813       2.629743 21.96324 7.114393 13.70059 5.383758 8.262648       8.921851 
1 1 1 11  24 32 o 9.412328 4.317986 -1.029068      2.248781 -0.4985660     4.852749 -1.174143      2.537705 13.90867 6.366651 9.911102 4.561514 3.997571       7.832092 
1 1 1 11  24 33 o 14.63216 5.777480 2.778025       3.041325 -1.096288      4.539199 5.934088       4.096893 12.89603 5.992992 18.80291 6.868928 -5.906879      9.115817 
1 1 1 11  24 34 o 7.671641 3.692223 -2.396819      2.034771 -0.8821971     4.367136 -2.816800      2.299638 12.52910 5.841228 8.023428 3.877317 4.505668       7.010957 
1 1 1 11  24 35 o 11.61575 4.921263 1.189903       2.411083 2.472944       4.745806 0.7435230      2.799254 14.69113 6.547657 11.62587 5.112102 3.065253       8.306949 
1 1 1 11  24 36 o 10.48468 4.826005 -0.4476913     2.841569 0.3001129E-01  9.248221 -0.4974907     2.986011 15.03581 7.377028 10.65577 4.919951 4.380038       8.867157 
1 1 1 11  25 0  o 97.91811 2.760703 117.0878       6.580897 104.5914       9.526569 128.4941       9.101560 92.39376 4.242466 102.4967 3.649753 -10.10299      5.596357 
1 1 1 11  25 1  o 203.9621 3.357491 507.9992       16.68786 512.5099       25.84023 504.7719       21.85708 204.4883 5.189709 203.1501 4.415083 1.338135       6.813666 
1 1 1 11  25 2  o 76.51456 2.850412 71.54816       5.305519 74.09023       7.690842 69.23995       7.328537 77.74445 4.073675 75.15601 4.016033 2.588432       5.720433 
1 1 1 11  25 3  o 107.9580 3.137247 142.4149       8.244773 132.6265       10.47079 158.3860       13.37497 104.0669 4.137107 113.6390 4.840892 -9.572044      6.367880 
1 1 1 11  25 4  o 172.9990 3.078567 365.3925       12.97861 349.0176       19.34842 378.7875       17.49959 168.7884 4.708594 176.0089 4.079971 -7.220474      6.230331 
1 1 1 11  25 5  o 45.65915 3.921075 25.67220       4.320631 20.94696       4.963568 40.44983       8.777779 41.04211 5.070532 57.01105 6.430194 -15.96894      8.188876 
1 1 1 11  25 6  o 92.83981 2.428294 105.2324       5.489068 107.6743       8.842838 103.7016       7.001187 93.76669 3.878337 92.10072 3.123932 1.665962       4.980005 
1 1 1 11  25 7  o 94.00270 2.411612 107.8872       5.519823 112.8017       8.812956 104.7147       7.080710 95.98213 3.775226 92.54304 3.144331 3.439095       4.913161 
1 1 1 11  25 8  o 193.1771 2.938167 455.6645       13.83147 479.8317       23.72705 443.2247       17.02304 197.8530 4.921132 190.4084 3.668723 7.444611       6.138165 
1 1 1 11  25 9  o 62.58821 3.736737 48.07344       5.673347 56.91201       10.73637 44.64931       6.682537 67.64918 6.596359 60.19670 4.590075 7.452477       8.036215 
1 1 1 11  25 10 o 125.1404 2.943755 191.2711       8.977084 168.1261       18.79509 198.1118       10.21793 116.5692 6.643955 127.2772 3.297177 -10.70801      7.417109 
1 1 1 11  25 11 o 32.86840 3.629447 13.37407       2.858710 15.60069       7.597746 13.00686       3.085444 34.71955 8.929759 32.35292 3.998537 2.366634       9.784114 
1 1 1 11  25 12 o 34.80281 3.357954 14.94730       2.812581 6.828736       7.926028 16.11687       3.008359 25.92542 9.540411 36.13765 3.458266 -10.21223      10.14786 
1 1 1 11  25 13 o 156.9974 3.120306 301.3225       11.93784 279.3932       25.32839 307.5852       13.53557 150.0448 6.945930 158.5522 3.503225 -8.507385      7.779366 
1 1 1 11  25 14 o 52.73733 2.907293 34.09785       3.721855 0.000000       0.000000 34.09785       3.721855 ?        ?        52.73733 2.907293 0.000000       2.907293 
1 1 1 11  25 15 o 102.7338 3.987839 129.6470       9.964640 0.000000       0.000000 129.6470       9.964640 ?        ?        102.7338 3.987839 0.000000       3.987839 
1 1 1 11  25 16 o 54.98368 5.697955 37.77564       7.524114 33.30502       10.15661 43.21329       11.20135 50.81209 8.502657 58.15451 8.125582 -7.342419      11.76096 
1 1 1 11  25 17 o 52.80964 5.684875 34.93920       7.200846 30.26049       9.556778 41.08416       10.95235 48.30953 8.424017 56.55193 8.185124 -8.242405      11.74565 
1 1 1 11  25 18 o 54.84966 8.880504 39.24417       11.46443 0.000000       0.000000 39.24417       11.46443 ?        ?        54.84966 8.880504 0.000000       8.880504 
1 1 1 11  25 19 o 31.13718 7.602082 12.76460       5.717299 20.02964       8.021720 5.263891       8.150789 38.81623 8.696570 24.36134 9.506092 14.45489       12.88395 
1 1 1 11  25 20 o 31.63513 7.883515 13.31322       6.055399 20.47917       7.952783 3.427192       9.341001 39.12099 8.578824 23.97086 9.884682 15.15014       13.08828 
1 1 1 11  25 21 o 21.62670 5.069687 6.070227       2.625055 17.65270       7.874291 4.622056       2.784330 35.96939 9.004920 19.01131 5.619133 16.95808       10.61429 
1 1 1 11  25 22 o 48.61533 7.684916 31.38511       8.802094 31.38511       8.802094 0.000000       0.000000 48.61533 7.684916 ?        ?        0.000000       7.684916 
1 1 1 11  25 23 o 14.57348 4.780153 2.585240       1.959693 1.694308       6.708829 2.668351       2.049061 19.56494 8.245006 14.82367 4.889225 4.741269       9.585648 
1 1 1 11  25 24 o 32.87540 3.585372 13.60538       2.825880 29.97593       8.594865 11.62121       2.992236 46.77986 7.815020 30.17635 4.181260 16.60351       8.863265 
1 1 1 11  25 25 o 17.40879 5.238207 3.962264       2.402906 13.02744       6.996887 2.750153       2.558515 29.85596 8.928256 15.37290 5.451785 14.48306       10.46115 
1 1 1 11  25 26 o 21.78938 4.884955 6.343564       2.529599 11.32751       7.138667 5.627891       2.705129 27.50812 9.127858 20.39768 5.369670 7.110435       10.59014 
1 1 1 11  25 27 o 51.96054 3.866057 34.53726       4.860207 47.71095       10.27611 30.74127       5.516173 57.65985 7.490253 48.43972 4.733381 9.220135       8.860518 
1 1 1 11  25 28 o 23.51733 4.542697 7.444067       2.509135 24.63454       8.450896 5.782151       2.627625 38.96395 9.070620 20.39724 5.254214 18.56671       10.48250 
1 1 1 11  25 29 o 15.25526 5.177129 3.092125       2.295369 19.39104       7.552018 1.433174       2.409353 33.58371 9.032401 12.72695 5.103684 20.85676       10.37458 
1 1 1 11  25 30 o 20.71570 6.359781 6.514003       3.518013 0.000000       0.000000 6.514003       3.518013 ?        ?        20.71570 6.359781 0.000000       6.359781 
1 1 1 11  25 31 o 9.248982 4.277436 -1.296745      2.270602 4.056125       6.989521 -1.928297      2.400815 18.46266 8.099440 9.044295 4.253155 9.418363       9.148237 
1 1 1 11  25 32 o 9.164942 4.191815 -0.8498321     2.097987 -1.193809      3.986232 -0.7180455     2.467366 12.20681 5.653123 10.07291 4.583520 2.133898       7.277805 
1 1 1 11  25 33 o 19.39665 5.870179 6.104520       3.011449 10.70107       4.462462 2.260692       4.080754 24.42668 7.084704 14.60824 6.300235 9.818439       9.480822 
1 1 1 11  25 34 o 8.396758 3.984642 -1.831027      2.197836 5.431728       4.486281 -4.124572      2.521096 17.29781 6.954732 7.750825 3.812535 9.546984       7.931186 
1 1 1 11  25 35 o 10.40153 4.662194 0.1039758      2.442643 3.223079       4.606196 -1.116319      2.881110 14.95819 6.568174 10.10135 4.720932 4.856846       8.088765 
1 1 1 11  26 0  o 89.50950 2.830933 97.88384       6.167205 108.3934       9.486237 90.19003       8.116554 94.05742 4.148917 85.81062 3.891583 8.246796       5.688403 
1 1 1 11  26 1  o 209.2752 3.867863 535.3577       19.72536 616.3682       41.60931 511.8743       22.40266 223.3775 7.655212 204.5182 4.495018 18.85924       8.877357 
1 1 1 11  26 2  o 240.3682 3.722025 706.1439       21.80180 714.7096       33.95718 700.1368       28.43691 241.3020 5.774769 239.0802 4.880933 2.221802       7.561181 
1 1 1 11  26 3  o 107.7225 2.759259 141.7283       7.237314 133.2177       10.43741 149.6096       10.04413 104.2813 4.115319 110.5713 3.732992 -6.289917      5.556175 
1 1 1 11  26 4  o 114.5734 3.176812 160.4478       8.861189 165.6181       11.56469 153.0962       13.79025 116.2881 4.087321 111.6412 5.082204 4.646873       6.521886 
1 1 1 11  26 5  o 64.42905 2.971352 50.79469       4.652657 46.68416       6.445960 55.26540       6.722446 61.60956 4.320815 67.08290 4.132305 -5.473339      5.978745 
1 1 1 11  26 6  o 262.4373 3.952708 842.5200       25.27880 851.1778       39.19780 836.3554       33.07599 263.0578 6.114691 261.0986 5.198431 1.959198       8.025779 
1 1 1 11  26 7  o 100.4544 2.455663 123.1521       6.011378 112.3390       9.241806 131.0823       7.914447 95.73797 3.969903 103.5383 3.140406 -7.800308      5.061845 
1 1 1 11  26 8  o 98.30889 2.424386 117.9535       5.808055 120.5227       9.268072 116.2921       7.453086 99.17642 3.842087 97.50925 3.140661 1.667175       4.962397 
1 1 1 11  26 9  o 76.83419 2.828562 72.19945       5.287063 70.68037       12.28312 72.54489       5.857447 75.36154 6.760153 76.98611 3.128712 -1.624573      7.449060 
1 1 1 11  26 10 o 172.8849 3.984955 366.0023       16.78868 359.3699       29.43656 369.1997       20.43880 170.2490 7.110885 173.3673 4.842590 -3.118317      8.603218 
1 1 1 11  26 11 o 39.11406 3.952693 18.92636       3.715933 0.000000       0.000000 18.92636       3.715933 ?        ?        39.11406 3.952693 0.000000       3.952693 
1 1 1 11  26 12 o 186.9109 3.945922 428.0997       17.97294 0.000000       0.000000 428.0997       17.97294 ?        ?        186.9109 3.945922 0.000000       3.945922 
1 1 1 11  26 13 o 56.43558 2.835798 39.03032       3.887502 46.31529       10.35336 37.83466       4.194408 60.64094 7.143023 55.52941 3.112094 5.111526       7.791528 
1 1 1 11  26 14 o 65.96984 2.663799 53.27987       4.273551 61.50742       11.13920 51.85988       4.627666 70.08327 6.600050 65.05114 2.926744 5.032127       7.219868 
1 1 1 11  26 15 o 42.28083 2.916403 21.97619       2.986470 45.50717       9.437525 19.35762       3.148258 60.14666 6.544277 39.61825 3.290586 20.52841       7.324993 
1 1 1 11  26 16 o 63.28222 2.704791 49.08347       4.161488 42.68472       10.66655 50.23230       4.519652 57.75023 7.776876 63.99102 2.905927 -6.240791      8.302061 
1 1 1 11  26 17 o 46.83543 6.282408 27.85367       6.989619 36.94580       9.440495 16.82277       10.39842 53.67119 7.415974 35.57982 10.93594 18.09137       13.21331 
1 1 1 11  26 18 o 49.98189 2.780246 30.70903       3.373007 31.83797       9.524344 30.54714       3.606760 49.31944 8.213383 49.81621 2.984741 -0.4967690     8.738897 
1 1 1 11  26 19 o 18.43067 4.899394 4.375011       2.238099 0.000000       0.000000 4.375011       2.238099 ?        ?        18.43067 4.899394 0.000000       4.899394 
1 1 1 11  26 20 o 60.09976 7.307243 46.97462       10.48227 46.97462       10.48227 0.000000       0.000000 60.09976 7.307243 ?        ?        0.000000       7.307243 
1 1 1 11  26 21 o 78.36814 5.120877 77.51502       9.726007 89.99411       13.45209 63.84649       14.07859 83.48889 6.667235 68.99526 8.556709 14.49363       10.84755 
1 1 1 11  26 22 o 28.51522 7.919948 11.16153       5.699309 11.91136       7.523713 10.15193       8.730289 29.31077 9.345940 27.90741 10.05086 1.403366       13.72466 
1 1 1 11  26 23 o 16.95898 5.096728 3.714695       2.275863 10.01977       6.973332 2.963047       2.407701 26.95793 9.023395 15.65242 5.302389 11.30550       10.46599 
1 1 1 11  26 24 o 71.61471 3.463246 64.17295       6.026043 70.51219       11.97461 62.02314       6.973379 72.40044 6.869279 70.03288 4.104052 2.367569       8.001889 
1 1 1 11  26 25 o 58.89803 3.567993 43.75341       5.097052 49.50984       10.31161 41.89214       5.863464 59.69984 7.235383 57.23384 4.234005 2.466000       8.383172 
1 1 1 11  26 26 o 79.36346 3.454082 79.61633       6.664201 83.99809       13.08190 78.08071       7.744415 77.34584 7.016889 78.03420 4.086805 -0.6883621     8.120265 
1 1 1 11  26 27 f 35.10958 3.509737 15.82250       2.962664 39.92171       9.411051 13.17146       3.121367 51.74084 7.698072 31.69264 4.140485 20.04820       8.740934 
1 1 1 11  26 28 o 11.42838 4.771175 0.7070159      2.214358 9.650946       7.646735 -0.1116547     2.313484 23.94219 9.244723 10.65152 4.666622 13.29067       10.35578 
1 1 1 11  26 29 f 31.49132 4.123497 13.26235       3.088463 0.000000       0.000000 13.26235       3.088463 ?        ?        31.49132 4.123497 0.000000       4.123497 
1 1 1 11  26 30 o 11.04764 4.933589 -0.3192192     2.708431 0.4184595      7.674947 -0.4241522     2.894662 16.99997 7.862803 11.29081 5.066894 5.709158       9.353988 
1 1 1 11  26 31 o 11.53666 5.122880 0.4268071E-01  2.878057 4.181495       7.708628 -0.6276917     3.102396 18.31058 8.238568 11.32797 5.148750 6.982610       9.715124 
1 1 1 11  26 32 o 10.10620 4.531895 -0.2571100     2.310908 -7.942091      7.440428 0.5633687      2.431141 13.03893 6.439478 11.18139 4.842631 1.857543       8.057168 
1 1 1 11  26 33 o 12.88563 5.630250 1.275626       3.347670 1.487278       7.303470 1.219331       3.766663 15.66212 7.381593 13.24529 5.872241 2.416822       9.432451 
1 1 1 11  26 34 o 9.777477 4.663634 -2.212204      3.089330 -2.327822      4.126551 -2.064770      4.659843 11.17727 5.347303 11.90458 5.691750 -0.7273026     7.809588 
1 1 1 11  27 0  o 77.84363 2.927330 74.08852       5.543147 71.99305       8.055014 75.97354       7.639841 76.57465 4.334331 78.71344 3.995973 -2.138794      5.895271 
1 1 1 11  27 1  o 50.59017 3.425073 31.41572       4.197630 26.42295       5.883090 36.59347       5.991073 46.10743 5.334260 54.47736 4.554509 -8.369926      7.014120 
1 1 1 11  27 2  o 147.1343 3.343923 264.5141       11.98964 251.3880       15.66080 283.1025       18.63663 143.2068 4.493160 151.8643 5.042879 -8.657440      6.754193 
1 1 1 11  27 3  o 113.3557 2.791320 156.8787       7.710616 160.4865       11.54964 153.9778       10.35657 114.4391 4.148365 112.1440 3.795161 2.295113       5.622471 
1 1 1 11  27 4  o 109.9360 2.794177 147.6625       7.479591 154.7378       11.10311 141.7840       10.12052 112.3726 4.061278 107.5891 3.866388 4.783577       5.607400 
1 1 1 11  27 5  o 98.94975 2.784366 119.6510       6.707259 114.6701       9.555765 124.4880       9.416756 96.70423 4.063994 100.7992 3.840636 -4.094994      5.591649 
1 1 1 11  27 6  o 60.19544 2.826485 44.34940       4.134584 46.59687       6.270905 42.62105       5.499175 61.54163 4.206729 58.89279 3.852926 2.648842       5.704525 
1 1 1 11  27 7  f 166.9473 3.087856 340.5774       12.56240 358.9915       19.23735 326.8868       16.58754 171.0357 4.619769 163.3114 4.171430 7.724289       6.224395 
1 1 1 11  27 8  o 152.7301 3.141782 285.1102       11.69329 282.0366       21.67717 286.3716       13.88701 151.2005 5.894486 152.9708 3.725326 -1.770264      6.973021 
1 1 1 11  27 9  o 97.78716 3.357542 117.0903       7.989040 0.000000       0.000000 117.0903       7.989040 ?        ?        97.78716 3.357542 0.000000       3.357542 
1 1 1 11  27 10 o 37.16149 4.620072 17.21268       4.093785 0.000000       0.000000 17.21268       4.093785 ?        ?        37.16149 4.620072 0.000000       4.620072 
1 1 1 11  27 11 o 156.8152 3.846517 301.3967       14.69914 296.2630       25.86134 303.8467       17.86555 154.3308 6.893821 157.1655 4.669873 -2.834763      8.326612 
1 1 1 11  27 12 o 89.61744 3.538346 98.53944       7.712132 85.05158       13.67303 104.8326       9.339577 82.44041 6.868282 92.31833 4.162186 -9.877922      8.031008 
1 1 1 11  27 13 o 69.29056 2.787654 58.81156       4.697443 58.01667       11.35828 58.97557       5.159348 67.88860 6.964242 69.34962 3.060452 -1.461029      7.607038 
1 1 1 11  27 14 o 118.9303 2.866173 173.1013       8.306745 212.7448       20.13006 164.9653       9.119392 130.5912 6.344485 115.9890 3.229505 14.60225       7.119143 
1 1 1 11  27 15 o 46.21641 2.914628 26.26185       3.265864 33.00522       8.984468 25.23517       3.505673 50.70079 7.497585 45.25809 3.199241 5.442696       8.151621 
1 1 1 11  27 16 o 115.7598 2.828033 164.1820       7.977712 183.5736       18.92190 159.9898       8.797886 120.8561 6.448146 114.1497 3.165824 6.706390       7.183385 
1 1 1 11  27 17 f 106.1037 2.751345 138.1013       7.107963 160.3754       17.21810 133.5255       7.803976 112.7825 6.289716 104.2423 3.075465 8.540184       7.001358 
1 1 1 11  27 18 o 63.92340 2.922440 50.28582       4.540369 69.67780       11.53724 46.73214       4.938901 73.94700 6.467465 61.53239 3.305886 12.41461       7.263401 
1 1 1 11  27 19 o 89.37540 3.333498 98.62699       7.247574 82.57250       13.69415 104.8735       8.541949 79.91066 7.106290 91.97840 3.819275 -12.06774      8.067603 
1 1 1 11  27 20 o 55.32486 3.063222 37.85128       4.113735 0.000000       0.000000 37.85128       4.113735 ?        ?        55.32486 3.063222 0.000000       3.063222 
1 1 1 11  27 21 o 18.16996 5.125876 4.299425       2.367641 9.862803       6.869244 3.549396       2.522194 27.01476 8.953607 16.83762 5.415594 10.17714       10.46402 
1 1 1 11  27 22 o 89.26955 4.893619 101.4964       10.60487 109.8167       14.66807 92.38418       15.35028 91.23611 6.642869 82.56207 7.719042 8.674049       10.18388 
1 1 1 11  27 23 o 47.69741 6.089026 30.23563       6.916321 35.43412       9.486507 24.33710       10.10508 50.26331 8.013859 39.71476 10.34116 10.54855       13.08287 
1 1 1 11  27 24 o 59.38960 3.589221 44.52019       5.170289 42.04929       10.31419 45.34946       5.975240 54.16354 8.059496 59.60473 4.139476 -5.441189      9.060394 
1 1 1 11  27 25 o 12.85811 4.940295 1.611785       2.176038 15.04057       7.324367 0.3117320      2.278937 30.82007 9.114782 11.23330 4.772892 19.58677       10.28882 
1 1 1 11  27 26 o 14.58090 5.119034 2.644550       2.251340 10.81238       6.961086 1.690399       2.379207 25.84416 9.006394 13.18745 5.138778 12.65671       10.36929 
1 1 1 11  27 27 o 21.12627 5.221953 6.285221       2.672847 0.000000       0.000000 6.285221       2.672847 ?        ?        21.12627 5.221953 0.000000       5.221953 
1 1 1 11  27 28 o 11.33389 4.749651 0.6997855      2.206928 2.811264       7.443094 0.4962589      2.310845 18.60234 8.250592 11.27556 4.799071 7.326775       9.544808 
1 1 1 11  27 29 o 31.37148 3.981852 13.20363       2.975598 27.66882       9.882936 11.76161       3.120392 36.36531 10.54212 29.20775 4.530730 7.157560       11.47449 
1 1 1 11  27 30 o 14.55668 5.843060 2.506579       3.161203 10.63088       7.603370 0.8087308      3.475863 22.64263 9.071073 13.12485 5.735857 9.517782       10.73240 
1 1 1 11  27 31 o 13.95620 5.740870 2.215645       3.140621 3.271341       7.822496 2.012776       3.429129 17.37123 7.999950 13.99191 5.895455 3.379316       9.937585 
1 1 1 11  27 32 o 9.863400 4.538440 -0.8373467     2.509928 4.119216       7.712071 -1.424546      2.654443 17.09332 7.897431 9.675743 4.525089 7.417572       9.101970 
1 1 1 11  27 33 o 10.23654 4.629995 -0.2100033     2.471836 3.085218       7.156721 -0.6563413     2.633927 15.97883 7.458838 10.12642 4.655714 5.852415       8.792607 
1 1 1 11  28 0  o 154.0608 3.448988 290.1412       12.94852 308.9758       25.32144 283.4721       15.06758 158.1703 6.583818 152.1294 4.068030 6.040924       7.739221 
1 1 1 11  28 1  o 79.73499 3.390061 77.85258       6.572043 71.70412       8.232385 88.65642       10.91268 76.37562 4.442356 84.80534 5.307069 -8.429718      6.920948 
1 1 1 11  28 2  f 149.1067 3.009130 271.5958       10.93388 289.6113       16.99789 258.8802       14.28038 153.6528 4.544603 145.3696 4.035065 8.283203       6.077431 
1 1 1 11  28 3  o 102.4771 3.204692 128.4660       7.993099 129.5176       14.03825 127.9615       9.723083 102.4716 5.643568 102.1761 3.912204 0.2954254      6.866964 
1 1 1 11  28 4  o 167.7707 3.911571 344.5430       15.99202 326.9278       25.73089 355.6299       20.41346 162.6407 6.505287 170.1489 4.928437 -7.508148      8.161388 
1 1 1 11  28 5  o 64.75131 3.666954 51.46479       5.762507 56.89603       8.845937 47.46088       7.595150 67.81509 5.397302 61.95823 5.074814 5.856865       7.408414 
1 1 1 11  28 6  f 171.0908 3.373422 358.0107       14.06480 372.2575       27.06206 352.7384       16.46287 173.4980 6.411769 169.7010 3.980934 3.796951       7.547093 
1 1 1 11  28 7  o 84.39815 2.551910 87.06993       5.242461 95.04491       8.254779 81.67911       6.786843 88.00508 3.858500 81.63536 3.419132 6.369720       5.155433 
1 1 1 11  28 8  o 198.0689 3.028287 479.6727       14.61671 460.8152       23.96172 490.8480       18.44613 193.4626 5.087002 200.1692 3.781569 -6.706604      6.338600 
1 1 1 11  28 9  o 147.4835 3.422305 266.2869       12.29980 278.3128       24.40760 262.1934       14.24013 149.6327 6.710715 146.1652 4.001683 3.467575       7.813268 
1 1 1 11  28 10 o 65.21468 3.822624 52.32683       6.048316 67.49446       11.35332 46.31633       7.146930 73.50719 6.401866 61.15720 4.834827 12.34999       8.022433 
1 1 1 11  28 11 o 58.12633 3.171868 41.48661       4.475847 32.20329       9.453287 44.16901       5.081512 50.07951 8.016444 59.93332 3.494431 -9.853813      8.744966 
1 1 1 11  28 12 o 139.7481 3.613305 239.7568       12.29482 250.2966       22.85736 235.4658       14.58439 141.5368 6.645609 138.2636 4.333920 3.273254       7.933914 
1 1 1 11  28 13 o 88.95358 3.588087 97.29984       7.761941 83.98479       13.54222 103.8142       9.472260 81.62753 6.871711 91.72167 4.249398 -10.09415      8.079468 
1 1 1 11  28 14 o 94.07648 2.752159 108.4720       6.302656 133.2838       15.33977 103.4327       6.913129 103.1382 6.130944 91.79190 3.094965 11.34628       6.867844 
1 1 1 11  28 15 o 84.60831 2.745283 87.81556       5.652764 94.84917       13.07314 86.19810       6.269118 86.75243 6.225280 83.75227 3.076895 3.000160       6.944163 
1 1 1 11  28 16 f 40.15149 3.465803 19.99062       3.357945 19.50908       8.189048 20.08795       3.681709 38.00668 8.984474 40.17863 3.805625 -2.171947      9.757232 
1 1 1 11  28 17 o 42.94948 3.116031 22.80789       3.239157 25.30798       8.205578 22.34639       3.525466 43.63823 8.011383 42.44335 3.437965 1.194878       8.717905 
1 1 1 11  28 18 o 62.76564 2.800121 48.52905       4.272088 39.28023       9.843019 50.67567       4.742011 54.56861 7.608615 64.07830 3.045511 -9.509689      8.195497 
1 1 1 11  28 19 o 40.96508 3.207436 20.85213       3.176389 16.82168       7.448549 21.74800       3.511708 34.74825 8.791116 41.76996 3.481625 -7.021709      9.455444 
1 1 1 11  28 20 f 38.05045 3.282982 18.06662       3.014396 20.79513       7.418108 17.52697       3.299057 38.77916 8.110973 37.36409 3.670585 1.415070       8.902869 
1 1 1 11  28 21 o 64.12059 4.131155 51.86871       6.420782 0.000000       0.000000 51.86871       6.420782 ?        ?        64.12059 4.131155 0.000000       4.131155 
1 1 1 11  28 22 o 46.49580 3.106843 27.00811       3.500016 26.09282       8.731837 27.18332       3.820349 42.35743 8.749144 46.53767 3.391990 -4.180248      9.383662 
1 1 1 11  28 23 o 20.38016 5.018000 5.588874       2.475284 9.240417       6.898365 5.049247       2.651884 25.27989 8.953229 19.32524 5.415349 5.954645       10.46357 
1 1 1 11  28 24 o 16.48202 5.265794 3.587840       2.387512 26.73825       7.705106 1.128998       2.511103 42.80444 7.668403 12.71088 5.169650 30.09356       9.248226 
1 1 1 11  28 25 o 17.13465 5.419458 3.994186       2.534219 0.000000       0.000000 3.994186       2.534219 ?        ?        17.13465 5.419458 0.000000       5.419458 
1 1 1 11  28 26 o 37.55365 4.998173 19.23723       4.460567 0.000000       0.000000 19.23723       4.460567 ?        ?        37.55365 4.998173 0.000000       4.998173 
1 1 1 11  28 27 o 21.59730 4.869368 6.532183       2.501357 5.358361       8.122187 6.655177       2.629141 20.47524 8.859612 21.69799 5.064932 -1.222748      10.20521 
1 1 1 11  28 28 o 20.21159 5.604743 6.051317       2.856722 0.000000       0.000000 6.051317       2.856722 ?        ?        20.21159 5.604743 0.000000       5.604743 
1 1 1 11  28 29 o 17.72199 5.225808 4.645962       2.410509 9.600817       7.699214 4.107494       2.538113 21.92840 9.001014 16.68631 5.438014 5.242083       10.51619 
1 1 1 11  28 30 o 10.29143 4.770165 -1.269475      2.847380 -2.932581      7.809072 -1.014458      3.057902 14.95963 7.208244 10.85008 4.998589 4.109556       8.771811 
1 1 1 11  28 31 o 12.78125 5.602389 1.063618       3.337910 12.11793       7.912403 -1.329552      3.681537 21.83002 9.058518 11.41636 5.335860 10.41366       10.51324 
1 1 1 11  28 32 o 10.92063 4.784536 0.5148875      2.431888 3.943697       7.092923 0.5812370E-01  2.588805 16.49465 7.604007 10.70920 4.799910 5.785451       8.992222 
1 1 1 11  29 0  o 156.7065 3.908285 300.6493       14.92483 292.0680       24.69279 305.5887       18.73412 153.6363 6.610857 157.7042 4.880641 -4.067947      8.217303 
1 1 1 11  29 1  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 11  29 2  o 87.40772 3.726041 93.69062       7.918375 103.2000       13.63767 88.85432       9.725689 91.25160 6.169131 84.95198 4.716490 6.299622       7.765530 
1 1 1 11  29 3  o 62.76523 3.161016 48.28804       4.819274 47.96975       6.859100 48.59837       6.772686 62.35960 4.544849 62.78379 4.455621 -0.4241982     6.364606 
1 1 1 11  29 4  o 55.43999 3.350362 37.73798       4.505255 44.62287       6.369780 30.84612       6.373005 60.15260 4.375357 49.78248 5.336478 10.37012       6.900851 
1 1 1 11  29 5  o 34.76841 4.343378 15.05979       3.599956 13.18615       4.906188 17.24516       5.298645 32.08424 6.498085 36.89256 6.107211 -4.808327      8.917575 
1 1 1 11  29 6  o 95.47305 2.560442 111.4335       5.951682 109.6161       9.320198 112.6849       7.733912 94.45287 4.058715 95.90062 3.314324 -1.447754      5.240030 
1 1 1 11  29 7  o 90.76373 3.241165 100.9517       7.157343 128.4294       14.56770 92.20824       8.217562 101.7520 5.900366 86.62590 3.902796 15.12606       7.074329 
1 1 1 11  29 8  o 140.6405 2.796938 241.8662       9.585825 242.0908       14.70566 241.7002       12.64035 140.2999 4.306312 140.3577 3.698839 -0.5776978E-01 5.676771 
1 1 1 11  29 9  o 205.2453 3.312966 516.0657       16.57014 509.1944       25.60760 521.0151       21.73354 203.0202 5.180224 205.8325 4.332917 -2.812332      6.753435 
1 1 1 11  29 10 o 118.1510 3.558487 171.4056       10.23395 185.8155       19.04264 165.5534       12.13542 121.9799 6.428936 115.9086 4.303857 6.071259       7.736563 
1 1 1 11  29 11 o 65.12598 3.156127 52.10503       4.994017 72.26352       11.07937 46.96502       5.594593 75.96940 6.034215 61.71843 3.737297 14.25097       7.097826 
1 1 1 11  29 12 o 122.6598 3.000476 184.4155       8.968680 162.7758       18.04377 191.5161       10.33590 113.8105 6.533377 124.8484 3.400429 -11.03796      7.365320 
1 1 1 11  29 13 o 64.80695 3.204870 51.69053       5.045668 58.78323       10.57345 49.59910       5.741585 68.13108 6.445086 63.36515 3.734870 4.765926       7.449053 
1 1 1 11  29 14 o 71.10258 4.279243 62.76320       7.380296 73.00928       11.57081 55.73566       9.582672 75.91051 6.312034 66.39529 5.986854 9.515221       8.699666 
1 1 1 11  29 15 o 67.26701 3.764874 56.04096       6.146845 65.81364       10.68422 51.20590       7.515140 71.98106 6.149851 63.94317 4.859268 8.037891       7.837930 
1 1 1 11  29 16 o 16.83441 5.037470 3.595325       2.226848 13.22699       7.256646 2.594027       2.339736 31.15248 9.034174 15.06319 5.223134 16.08929       10.43539 
1 1 1 11  29 17 o 39.01704 3.252059 18.91935       3.063976 19.88449       7.476989 18.72457       3.358957 38.17146 8.276999 38.72924 3.600237 -0.5577736     9.026096 
1 1 1 11  29 18 o 61.43732 3.002841 46.69456       4.482116 57.76582       10.24782 44.07571       4.984114 66.67354 6.385211 59.54156 3.449812 7.131981       7.257556 
1 1 1 11  29 19 o 26.82180 4.199686 9.219981       2.654984 15.72505       7.099541 8.162333       2.862694 33.27221 8.670042 25.00178 4.873779 8.270433       9.946022 
1 1 1 11  29 20 o 22.00205 4.827794 6.383321       2.517248 -0.6383129     6.568381 7.592132       2.725326 17.51014 7.759220 24.04186 4.819691 -6.531723      9.134272 
1 1 1 11  29 21 o 12.93987 5.008855 1.516904       2.248846 1.408290       6.428787 1.532048       2.400507 18.49942 7.942170 13.21492 5.158215 5.284492       9.470230 
1 1 1 11  29 22 o 14.46064 5.336665 2.318059       2.483039 0.000000       0.000000 2.318059       2.483039 ?        ?        14.46064 5.336665 0.000000       5.336665 
1 1 1 11  29 23 o 64.54723 3.565853 52.95078       5.587098 58.40690       11.52030 51.27282       6.388715 63.45906 7.600638 63.02840 4.183172 0.4306679      8.675750 
1 1 1 11  29 24 o 52.79060 4.314713 36.50172       5.502283 0.000000       0.000000 36.50172       5.502283 ?        ?        52.79060 4.314713 0.000000       4.314713 
1 1 1 11  29 25 o 9.113296 4.187531 -1.217706      2.126622 -3.460863      6.383459 -0.9376659     2.255465 14.71032 6.923117 9.685138 4.397338 5.025186       8.201593 
1 1 1 11  29 26 o 12.23582 4.920053 1.309529       2.245517 4.533237       6.929822 0.9313298      2.373585 19.44104 8.293669 11.93581 4.957868 7.505222       9.662577 
1 1 1 11  29 27 o 11.90912 4.888384 1.115299       2.270886 -8.239937      7.070631 2.191293       2.397926 13.28792 6.505093 13.62939 5.198634 -0.3414698     8.327187 
1 1 1 11  29 28 o 10.70653 4.647343 0.2701944      2.249227 -9.087657      7.661564 1.152765       2.352904 13.36034 6.586158 11.96309 4.949737 1.397249       8.238773 
1 1 1 11  29 29 o 9.985019 4.486723 -0.3636203     2.277902 5.072214       7.341202 -0.9427397     2.396173 18.30893 8.152855 9.691804 4.450280 8.617122       9.288382 
1 1 1 11  29 30 o 12.19803 5.388910 0.6383031      3.145039 10.75607       8.511797 -0.9614181     3.384551 20.79326 9.033019 11.26320 5.213649 9.530059       10.42965 
1 1 1 11  29 31 o 39.40577 7.755017 29.25632       7.181649 36.62769       10.48583 22.74368       9.856157 36.16566 10.95564 26.31147 10.39703 9.854193       15.10378 
1 1 1 11  30 0  o 198.9532 3.398296 484.4187       16.47587 476.2711       25.05769 490.6238       21.86754 196.6135 5.234535 199.8964 4.489097 -3.282913      6.895821 
1 1 1 11  30 1  o 107.2958 2.902588 140.8374       7.582370 139.3597       11.13299 142.1160       10.35537 106.4761 4.299500 107.5976 3.956097 -1.121506      5.842637 
1 1 1 11  30 2  o 60.78529 3.267009 45.34296       4.821546 36.32734       6.446593 56.78886       7.263693 54.11728 4.942814 67.86223 4.416302 -13.74495      6.628358 
1 1 1 11  30 3  o 109.3252 3.278533 146.4165       8.724586 142.1104       15.83608 148.2932       10.45423 106.9971 6.098765 109.8998 3.909771 -2.902672      7.244394 
1 1 1 11  30 4  o 38.94328 4.075934 18.81232       3.810858 18.21185       5.142367 19.54382       5.675760 37.98106 5.734438 39.28273 6.129083 -1.301670      8.393416 
1 1 1 11  30 5  o 75.85681 2.745804 70.44946       5.067376 79.31203       7.893554 64.23660       6.609033 80.27502 4.048183 72.27457 3.765448 8.000443       5.528687 
1 1 1 11  30 6  o 76.05034 3.106411 70.92281       5.744882 65.39144       11.34824 72.82882       6.661542 72.23001 6.517285 76.99088 3.560219 -4.760872      7.426315 
1 1 1 11  30 7  o 24.54727 5.259122 7.726153       3.051266 8.069577       4.244280 7.358797       4.389676 25.01600 6.789932 24.02908 7.043064 0.9869232      9.783043 
1 1 1 11  30 8  o 100.0960 2.527779 122.6017       6.160903 128.7123       9.804379 118.6143       7.919875 102.2525 3.942068 98.30337 3.310808 3.949165       5.147946 
1 1 1 11  30 9  o 164.5188 2.958550 331.5870       11.86125 332.4855       18.29859 330.9359       15.57687 164.0598 4.581469 164.0308 3.896897 0.2902222E-01  6.014621 
1 1 1 11  30 10 o 44.97039 4.142765 25.13476       4.488978 33.82050       8.791457 22.07160       5.220870 51.32389 7.229227 41.86314 5.231591 9.460747       8.923635 
1 1 1 11  30 11 o 23.71926 6.329586 7.309981       3.726481 17.44764       7.025670 3.341423       4.395774 36.27946 8.146666 18.69872 7.060264 17.58074       10.78033 
1 1 1 11  30 12 o 30.79506 5.337483 12.14657       3.860394 11.46568       7.374826 12.40355       4.530697 29.54678 9.231262 30.89179 6.233659 -1.345013      11.13888 
1 1 1 11  30 13 o 77.20271 2.926252 73.30663       5.495326 61.68085       11.01818 77.15615       6.340185 69.48080 6.586054 79.10838 3.296065 -9.627579      7.364791 
1 1 1 11  30 14 f 30.49725 4.321182 11.77060       3.121608 17.57262       6.922856 10.28984       3.497335 36.12221 8.068450 28.22598 5.278551 7.896231       9.641731 
1 1 1 11  30 15 o 41.61974 3.272519 21.50486       3.292399 24.21845       7.435611 20.84308       3.671986 42.69020 7.416449 40.85731 3.729099 1.832893       8.301199 
1 1 1 11  30 16 o 12.19586 5.522526 -1.714169      3.528723 -14.12836      5.673433 6.118245       4.506449 10.74985 5.361538 21.91821 7.251594 -11.16836      9.018409 
1 1 1 11  30 17 f 31.02114 5.718802 12.65906       4.163898 14.42818       7.121844 11.74023       5.132541 31.93287 8.847351 29.31669 7.230190 2.616179       11.42590 
1 1 1 11  30 18 o 34.56762 5.292859 15.58696       4.316867 25.02040       7.803916 11.42768       5.181875 42.55365 7.813420 28.71903 7.368497 13.83462       10.73985 
1 1 1 11  30 19 o 11.15832 4.712881 0.2961878      2.199957 4.708133       6.137268 -0.3542969     2.356560 21.00721 8.233693 10.75674 4.711370 10.25047       9.486343 
1 1 1 11  30 20 o 18.23841 5.120208 4.443090       2.368401 3.131091       6.740563 4.627880       2.529699 19.96576 8.329029 18.59072 5.316512 1.375032       9.881195 
1 1 1 11  30 21 o 10.08201 4.468617 -0.5128390     2.179758 -1.942507      5.514475 -0.2480943     2.373014 14.95710 6.823837 10.81858 4.733386 4.138519       8.304800 
1 1 1 11  30 22 o 13.57240 5.175969 1.913648       2.376790 0.000000       0.000000 1.913648       2.376790 ?        ?        13.57240 5.175969 0.000000       5.175969 
1 1 1 11  30 23 f 19.90479 6.403999 5.671672       3.526685 0.000000       0.000000 5.671672       3.526685 ?        ?        19.90479 6.403999 0.000000       6.403999 
1 1 1 11  30 24 o 23.44338 4.576098 7.496943       2.520418 19.40638       7.511444 5.985942       2.675533 33.74180 8.978409 20.56103 5.304724 13.18077       10.42842 
1 1 1 11  30 25 o 12.02989 4.844697 1.243571       2.180865 7.679548       6.601900 0.4552254      2.310575 21.76685 8.537227 11.22368 4.788578 10.54317       9.788500 
1 1 1 11  30 26 o 24.26513 4.637791 8.209578       2.642457 14.05289       7.852963 7.463481       2.806089 26.42149 9.530296 22.76549 5.175691 3.655994       10.84501 
1 1 1 11  30 27 o 17.49671 5.345327 4.543289       2.489078 9.368403       7.618276 3.966658       2.633611 21.80500 8.952322 16.44294 5.545653 5.362057       10.53083 
1 1 1 11  30 28 o 16.66231 5.546378 4.225018       2.635235 22.89590       9.401258 2.632918       2.745293 29.97903 10.46534 14.22139 5.526099 15.75764       11.83474 
1 1 1 11  30 29 o 11.10233 5.055885 -0.4390285     3.009513 2.801816       7.739507 -1.016355      3.266591 16.76535 7.802755 11.06477 5.121863 5.700583       9.333621 
1 1 1 11  30 30 o 12.62752 5.566682 1.021679       3.338902 3.179619       7.975786 0.5631378      3.676570 16.54902 7.772810 12.61327 5.681138 3.935746       9.627664 
1 1 1 11  31 0  o 25.72854 5.649807 8.498570       3.445112 3.574635       4.502612 15.45195       5.350647 19.22607 7.169270 34.71745 6.564882 -15.49138      9.720910 
1 1 1 11  31 1  o 13.75042 5.767264 0.3995923      3.258169 1.398418       4.161967 -1.181486      5.236372 16.37473 6.657063 15.93439 6.999746 0.4403496      9.659862 
1 1 1 11  31 2  o 77.98344 2.987132 74.54141       5.666163 83.08369       8.192437 66.70798       7.845168 82.12592 4.106547 73.50472 4.399904 8.621201       6.018545 
1 1 1 11  31 3  f 69.61115 3.065768 59.44933       5.187853 56.31622       7.229517 62.77546       7.448864 67.49689 4.419621 71.30261 4.307034 -3.805725      6.171191 
1 1 1 11  31 4  f 75.97997 3.762063 71.06293       6.943982 76.55116       11.37761 67.80511       8.765938 78.26452 6.011568 73.95271 4.891653 4.311806       7.750304 
1 1 1 11  31 5  o 74.11449 2.755879 67.31934       4.968694 63.38493       7.499597 70.39744       6.633443 71.60818 4.317790 75.63735 3.609288 -4.029167      5.627635 
1 1 1 11  31 6  o 76.97194 2.918426 72.67908       5.464241 81.24890       7.877978 64.73374       7.585523 81.15648 3.995699 72.33965 4.322732 8.816826       5.886562 
1 1 1 11  31 7  o 28.07074 4.968279 10.03775       3.274225 6.979144       4.198117 14.78742       5.231474 23.34854 6.899465 33.80444 6.587445 -10.45590      9.539237 
1 1 1 11  31 8  o 43.69299 3.459245 23.60859       3.653198 23.59538       4.747367 23.62777       5.720441 43.44936 4.551114 43.21707 5.560432 0.2322845      7.185474 
1 1 1 11  31 9  o 41.03891 3.290826 20.82766       3.263506 16.16644       4.307163 27.11080       5.000690 35.72199 5.091855 46.59919 4.457963 -10.87719      6.767601 
1 1 1 11  31 10 o 75.00780 2.994713 69.19527       5.462908 86.12827       11.92993 64.70258       6.145035 82.60762 5.966478 72.40567 3.493001 10.20195       6.913748 
1 1 1 11  31 11 o 25.49068 5.737671 8.471931       3.477881 9.341714       6.550721 8.130534       4.104060 26.89642 8.734256 24.87190 6.644926 2.024525       10.97462 
1 1 1 11  31 12 o 24.32941 5.665524 7.743075       3.296091 15.16727       6.934762 5.576403       3.746307 33.38922 8.501670 20.94135 6.584726 12.44786       10.75346 
1 1 1 11  31 13 o 30.09811 5.177991 11.68392       3.660908 11.75440       6.948446 11.65684       4.307215 29.38971 8.921447 29.76855 6.141374 -0.3788395     10.83091 
1 1 1 11  31 14 o 34.61219 4.455746 15.21040       3.671161 21.16006       7.218274 13.13444       4.263798 39.54734 7.767241 31.71312 5.727983 7.834227       9.650897 
1 1 1 11  31 15 o 40.10107 3.358438 20.06227       3.251814 15.30369       6.907581 21.41709       3.685773 33.04754 8.522176 41.34200 3.697476 -8.294456      9.289715 
1 1 1 11  31 16 o 33.82920 3.696872 14.42945       2.998077 25.46050       7.781147 12.50632       3.248922 43.09297 7.691936 31.24958 4.387025 11.84339       8.855047 
1 1 1 11  31 17 o 12.03164 4.832283 0.9834625      2.163414 -2.012624      5.993480 1.432314       2.319814 15.91550 7.203011 12.98494 5.070104 2.930563       8.808479 
1 1 1 11  31 18 o 51.58302 3.051157 33.21500       3.818239 30.10152       8.860861 33.92495       4.231230 45.88201 8.227206 52.00356 3.356786 -6.121552      8.885659 
1 1 1 11  31 19 o 24.98696 6.165288 8.655103       3.730672 17.92688       7.239965 5.303245       4.353092 34.55468 8.625422 20.15265 7.114537 14.40203       11.18099 
1 1 1 11  31 20 o 18.46503 6.637223 4.366299       3.804955 0.000000       0.000000 4.366299       3.804955 ?        ?        18.46503 6.637223 0.000000       6.637223 
1 1 1 11  31 21 o 14.57605 5.792954 1.992585       3.076286 -0.4860642     6.405812 2.735573       3.507176 16.61363 7.489525 15.98739 6.236454 0.6262426      9.746094 
1 1 1 11  31 22 o 9.764354 4.380179 -0.6600956     2.160901 1.789020       5.499146 -1.107324      2.349932 16.93738 7.309250 9.781488 4.459496 7.155893       8.562257 
1 1 1 11  31 23 o 10.57862 4.609004 -0.5309197E-02 2.229604 11.12004       7.319934 -1.143044      2.340835 25.20355 9.185481 9.683095 4.428419 15.52046       10.19725 
1 1 1 11  31 24 o 12.87948 5.116315 1.620210       2.398545 0.000000       0.000000 1.620210       2.398545 ?        ?        12.87948 5.116315 0.000000       5.116315 
1 1 1 11  31 25 o 19.42740 5.255628 5.507158       2.547869 25.93840       9.168511 3.797318       2.652340 35.91480 10.07115 16.32847 5.564787 19.58633       11.50630 
1 1 1 11  31 26 o 22.33800 5.254478 7.371098       2.812091 8.760637       8.652744 7.207001       2.973505 21.21555 9.162087 21.84504 5.569574 -0.6294861     10.72213 
1 1 1 11  31 27 o 9.828603 4.443568 -0.5121521     2.273890 -0.4434862     7.728240 -0.5186601     2.379208 15.83697 7.502632 10.03449 4.540138 5.802488       8.769398 
1 1 1 11  31 28 o 7.167433 3.591669 -6.538182      2.684981 9.431817       7.406296 -8.954636      2.880964 20.48062 8.648637 6.810309 3.450150 13.67031       9.311416 
1 1 1 11  31 29 o 14.25833 5.893980 2.655127       3.332060 11.94758       8.807446 1.102954       3.599606 20.79846 9.108920 12.98937 5.750586 7.809086       10.77226 
1 1 1 11  32 0  o 43.48417 4.510133 23.56614       4.709894 25.62799       5.784732 19.51132       8.112214 45.16718 5.360004 38.39219 8.851892 6.774982       10.34822 
1 1 1 11  32 1  o 97.55148 3.244544 116.8495       7.702274 117.7591       9.999430 115.5224       12.07790 97.67497 4.210922 96.43159 5.158451 1.243378       6.658940 
1 1 1 11  32 2  o 67.73006 3.441936 56.47136       5.662316 53.17157       7.081227 62.32235       9.429310 65.48618 4.464031 70.61129 5.523795 -5.125107      7.102104 
1 1 1 11  32 3  o 14.87876 6.443599 -0.4034593     4.303843 0.6095096      5.887690 -1.565862      6.307033 18.16525 7.692938 17.24726 7.624918 0.9179993      10.83147 
1 1 1 11  32 4  o 80.61736 3.275156 79.93004       6.420835 87.76737       8.479536 69.39681       9.830339 84.25353 4.142682 74.48696 5.453463 9.766571       6.848508 
1 1 1 11  32 5  o 60.68832 3.416636 45.41488       5.032485 42.90290       9.552068 46.38002       5.920852 57.93356 6.901517 61.20066 3.991797 -3.267101      7.972790 
1 1 1 11  32 6  o 18.47849 5.656307 4.288764       2.785364 4.025587       3.714959 4.626663       4.209415 18.80161 6.577607 20.05334 7.002631 -1.251734      9.607380 
1 1 1 11  32 7  o 28.85313 4.529793 10.55807       3.080184 10.74673       4.372802 10.37227       4.339464 28.65995 6.420698 28.14086 6.464181 0.5190907      9.111037 
1 1 1 11  32 8  o 14.26607 5.619546 1.526253       2.871202 -0.4238324E-01 3.507197 4.714006       4.999671 13.67781 5.869062 20.79698 7.589533 -7.119169      9.594108 
1 1 1 11  32 9  o 46.74803 3.134603 27.01234       3.550297 29.54421       5.070966 24.57808       4.972246 48.59687 4.327205 44.18739 4.689116 4.409485       6.380636 
1 1 1 11  32 10 o 45.73706 3.695107 26.03990       4.083392 31.54883       8.494106 24.38410       4.656796 48.98120 7.342237 44.05463 4.396342 4.926575       8.557818 
1 1 1 11  32 11 o 15.23260 5.998477 1.834503       3.270608 -0.7920459     5.730972 3.103103       3.982885 16.64837 7.317812 17.73419 6.715006 -1.085817      9.931851 
1 1 1 11  32 12 o 19.68186 6.153242 4.970625       3.276143 6.371493       6.285657 4.448124       3.838800 23.25543 8.506182 19.26297 6.689696 3.992458       10.82161 
1 1 1 11  32 13 o 35.90892 4.117739 16.31131       3.538165 20.50349       7.363095 15.05269       4.034488 38.55745 8.094646 34.18639 4.989870 4.371067       9.509053 
1 1 1 11  32 14 o 27.40759 4.775631 9.751089       3.073743 5.931082       6.396655 10.89795       3.504910 22.62416 8.522474 28.87211 5.171454 -6.247950      9.968777 
1 1 1 11  32 15 o 33.77290 4.381461 14.62261       3.521070 12.88930       6.642917 15.29986       4.152365 29.92784 8.633144 34.25688 5.131854 -4.329042      10.04326 
1 1 1 11  32 16 o 18.85608 5.687386 4.719674       2.830202 10.18417       6.454361 3.418857       3.149099 26.62767 8.671431 16.94744 6.044398 9.680225       10.57017 
1 1 1 11  32 17 o 18.57154 5.414006 4.621333       2.600008 0.000000       0.000000 4.621333       2.600008 ?        ?        18.57154 5.414006 0.000000       5.414006 
1 1 1 11  32 18 o 78.78328 3.780354 78.85516       7.236581 0.000000       0.000000 78.85516       7.236581 ?        ?        78.78328 3.780354 0.000000       3.780354 
1 1 1 11  32 19 f 19.83984 5.093433 5.387666       2.474968 5.228897       6.017944 5.419986       2.715221 20.60324 8.129543 19.80996 5.452923 0.7932816      9.788966 
1 1 1 11  32 20 o 13.45737 5.105197 1.947518       2.304713 10.98478       6.559831 0.6748870      2.461646 26.03415 8.752207 11.94048 5.010867 14.09367       10.08513 
1 1 1 11  32 21 o 11.70039 5.212441 -0.4721098     3.004203 -5.546821      6.017693 1.212512       3.467173 13.43141 6.434188 14.06397 5.927067 -0.6325588     8.748079 
1 1 1 11  32 22 o 18.08429 6.303367 4.626864       3.409820 4.992441       7.089251 4.516835       3.889252 20.01782 8.457770 18.09078 6.678529 1.927038       10.77667 
1 1 1 11  32 23 o 16.90527 6.183825 3.937540       3.322043 12.52862       7.927163 2.107352       3.658825 25.49430 9.511463 14.95227 6.178089 10.54202       11.34181 
1 1 1 11  32 24 o 10.46025 4.854517 -1.602445      2.963055 -8.645488      7.133762 -0.1340406     3.257327 13.14178 6.454087 12.13302 5.414908 1.008759       8.424754 
1 1 1 11  32 25 o 11.82479 5.367746 -0.5446771     3.358751 0.000000       0.000000 -0.5446771     3.358751 ?        ?        11.82479 5.367746 0.000000       5.367746 
1 1 1 11  32 26 o 15.41325 5.983296 3.349348       3.215886 0.4207993      7.432841 4.023809       3.567033 15.98762 7.507380 16.37821 6.316723 -0.3905869     9.811307 
1 1 1 11  32 27 o 10.35784 4.872954 -1.823414      3.157503 6.544662       8.281096 -3.246941      3.415528 18.69293 8.462731 9.964826 4.792758 8.728106       9.725655 
1 1 1 11  32 28 o 10.55048 4.945483 -1.483772      3.201123 -4.816176      7.719407 -0.7917096     3.517853 13.76374 6.750221 11.47578 5.313198 2.287957       8.590433 
1 1 1 11  33 0  o 105.4132 2.874254 136.3777       7.376508 127.5472       10.58753 144.7075       10.28305 101.4897 4.290595 108.2598 3.904186 -6.770073      5.801023 
1 1 1 11  33 1  o 114.1352 3.859929 160.8262       10.72036 153.8113       16.46398 165.9896       14.12512 110.5183 6.137245 115.4305 5.033626 -4.912201      7.937453 
1 1 1 11  33 2  o 37.86082 4.224856 17.93687       3.831615 21.95319       5.215626 13.22780       5.647555 41.66034 5.254067 31.62180 7.451833 10.03854       9.117842 
1 1 1 11  33 3  o 56.88083 3.309223 39.93256       4.567185 42.76453       6.380078 36.95604       6.540875 58.55810 4.505600 54.26351 5.002711 4.294586       6.732574 
1 1 1 11  33 4  f 36.68148 4.094039 16.84552       3.597291 14.31249       4.616821 20.75961       5.739028 33.28677 5.907986 40.20057 6.045263 -6.913792      8.452781 
1 1 1 11  33 5  o 19.86680 6.068140 5.020697       3.207970 0.9461534      4.138294 11.15604       5.078101 15.71404 6.538429 28.97590 7.218525 -13.26186      9.739515 
1 1 1 11  33 6  o 10.63725 4.832618 -1.537925      2.729295 -3.351427      3.502682 1.264902       4.354514 11.05841 5.180236 16.33252 6.743317 -5.274107      8.503362 
1 1 1 11  33 7  o 30.05085 5.446154 11.68773       3.841440 17.02111       6.596872 8.951392       4.725221 35.55562 7.826161 25.93722 7.214271 9.618406       10.64399 
1 1 1 11  33 8  o 43.51863 3.180787 23.47849       3.349933 18.70002       4.490271 29.47641       5.030698 38.33237 4.920290 48.46583 4.304198 -10.13346      6.537229 
1 1 1 11  33 9  o 69.06915 2.675136 58.76191       4.494114 60.14559       6.588834 57.55814       6.145569 69.45697 3.908520 68.01405 3.722081 1.442917       5.397261 
1 1 1 11  33 10 o 98.53852 3.125694 120.0951       7.496161 131.5208       15.31134 116.4931       8.596938 100.9168 6.256835 96.78596 3.651530 4.130875       7.244423 
1 1 1 11  33 11 o 17.04726 6.140979 3.286133       3.259317 7.003007       6.316873 1.937593       3.804917 23.73789 8.549451 16.03356 6.419121 7.704325       10.69104 
1 1 1 11  33 12 o 30.59211 5.026978 12.17246       3.617539 18.95496       6.712290 9.395956       4.294619 37.03857 7.688632 26.27298 6.690738 10.76558       10.19220 
1 1 1 11  33 13 o 42.74483 3.829659 23.06579       3.946918 23.56948       8.106202 22.90927       4.518731 40.69697 8.450429 42.34683 4.445023 -1.649860      9.548193 
1 1 1 11  33 14 o 57.25563 3.193606 40.95133       4.438246 33.86522       8.890022 43.30379       5.122249 49.30232 7.646990 58.68939 3.598805 -9.387070      8.451500 
1 1 1 11  33 15 o 29.58136 5.356290 11.68598       3.719047 0.000000       0.000000 11.68598       3.719047 ?        ?        29.58136 5.356290 0.000000       5.356290 
1 1 1 11  33 16 o 19.50378 5.912051 5.181945       3.052862 0.000000       0.000000 5.181945       3.052862 ?        ?        19.50378 5.912051 0.000000       5.912051 
1 1 1 11  33 17 o 18.00349 5.573438 4.392363       2.695082 1.995987       5.361245 5.202717       3.117639 17.36941 7.347731 19.42457 5.991213 -2.055161      9.480706 
1 1 1 11  33 18 o 28.18742 4.617188 10.61475       3.061824 13.68754       6.622742 9.779439       3.453003 29.19165 8.675833 26.55603 5.516262 2.635628       10.28101 
1 1 1 11  33 19 o 29.24497 4.113003 11.27855       2.850325 10.98684       7.631632 11.32584       3.072679 25.55629 9.368735 29.11271 4.474060 -3.556416      10.38222 
1 1 1 11  33 20 o 12.50524 5.039346 1.310777       2.361267 2.038207       6.705016 1.207788       2.522888 17.99637 7.912639 12.62540 5.164030 5.370970       9.448653 
1 1 1 11  33 21 o 10.88602 4.697480 0.2219731      2.271010 6.451837       7.095269 -0.4891076     2.397116 20.94225 8.623219 10.38663 4.639691 10.55562       9.792172 
1 1 1 11  33 22 o 11.83007 5.016704 0.7194126      2.509410 -0.5334514E-01 6.576897 0.8510785      2.714788 16.12559 7.392806 12.31755 5.220457 3.808040       9.050234 
1 1 1 11  33 23 o 28.60732 4.348366 11.26209       2.936063 23.29179       8.872185 9.782652       3.111371 33.30830 10.07481 26.10412 5.073921 7.204178       11.28035 
1 1 1 11  33 24 o 27.68164 5.184128 11.21297       3.368580 26.56278       9.389196 8.945291       3.608838 34.24471 10.36551 23.77178 6.174984 10.47292       12.06541 
1 1 1 11  33 25 o 8.391983 3.965574 -1.810574      2.133400 5.002454       8.056576 -2.324330      2.212376 18.32170 8.315547 8.207908 3.923644 10.11379       9.194743 
1 1 1 11  33 26 f 14.08534 5.416062 2.716503       2.616761 0.000000       0.000000 2.716503       2.616761 ?        ?        14.08534 5.416062 0.000000       5.416062 
1 1 1 11  33 27 o 15.50784 6.112517 3.678993       3.398935 0.9720067      7.385437 4.406412       3.828473 15.56001 7.360417 16.42171 6.482758 -0.8616972     9.808256 
1 1 1 11  34 0  o 27.21070 6.158482 9.721695       3.988106 12.45089       6.350009 7.943974       5.124947 30.37508 8.330239 24.72112 7.691021 5.653959       11.33776 
1 1 1 11  34 1  o 59.03783 3.197403 43.05444       4.582898 45.38264       6.459215 40.69428       6.503403 60.24770 4.430485 56.93175 4.730285 3.315952       6.481111 
1 1 1 11  34 2  o 15.00807 5.946243 1.673276       3.231760 1.559990       3.782385 1.979630       6.219987 15.74186 6.365736 19.42277 8.043038 -3.680902      10.25734 
1 1 1 11  34 3  f 25.97777 5.594841 8.820023       3.437057 14.66826       4.589183 1.348893       5.186997 33.62359 5.810983 17.55974 7.314387 16.06385       9.341722 
1 1 1 11  34 4  o 62.02393 2.916076 47.45535       4.395179 44.82214       6.292460 49.96391       6.141723 59.82683 4.345696 63.30819 4.001493 -3.481361      5.907370 
1 1 1 11  34 5  o 29.37991 4.670195 11.05308       3.231875 17.80755       4.525678 4.023854       4.616807 37.29888 5.113586 19.46871 7.259639 17.83017       8.879816 
1 1 1 11  34 6  o 20.95915 5.764752 5.774568       3.035984 5.577970       3.831680 6.106173       4.976346 20.85720 6.671694 22.15519 7.620287 -1.297989      10.12819 
1 1 1 11  34 7  o 37.21882 3.849010 17.41352       3.440669 16.36402       4.645324 18.68901       5.121072 35.49133 5.552922 37.90779 5.721645 -2.416458      7.973216 
1 1 1 11  34 8  o 32.40119 5.207551 13.62324       3.972495 25.95128       7.671007 9.105613       4.643660 43.82667 7.448846 25.88455 7.133495 17.94212       10.31368 
1 1 1 11  34 9  o 58.94567 2.766204 42.97577       3.962408 40.92535       5.734024 44.84980       5.481858 56.98774 4.157575 59.83959 3.778560 -2.851852      5.618091 
1 1 1 11  34 10 o 21.27469 5.978641 6.060147       3.227415 0.3174018      5.738967 8.716402       3.903093 17.14327 7.432471 25.34453 6.336923 -8.201258      9.767201 
1 1 1 11  34 11 o 39.02598 4.169017 19.40816       3.903482 26.57942       7.824754 17.03219       4.503945 43.76050 7.613944 36.06051 5.281941 7.699989       9.266663 
1 1 1 11  34 12 o 19.04325 6.831150 4.452469       4.028261 0.000000       0.000000 4.452469       4.028261 ?        ?        19.04325 6.831150 0.000000       6.831150 
1 1 1 11  34 13 o 75.22774 4.353969 72.40293       7.947670 0.000000       0.000000 72.40293       7.947670 ?        ?        75.22774 4.353969 0.000000       4.353969 
1 1 1 11  34 14 o 12.97642 5.389628 0.8885035      2.804641 3.317457       5.510275 0.3923101E-01  3.258271 18.81242 7.655475 12.88675 5.593591 5.925667       9.481275 
1 1 1 11  34 15 o 21.84325 5.509902 6.585805       2.932136 17.52072       6.678559 3.974775       3.263481 34.04357 8.157158 17.57084 6.163651 16.47273       10.22398 
1 1 1 11  34 16 o 49.89447 3.680168 31.89737       4.443130 51.51364       9.196279 25.92403       5.074726 60.79503 6.298510 44.21395 4.786182 16.58108       7.910674 
1 1 1 11  34 17 o 17.76523 5.555543 4.356391       2.670406 5.518172       6.550396 4.124823       2.924456 20.75533 8.382904 17.42988 5.843623 3.325451       10.21866 
1 1 1 11  34 18 o 59.50029 3.507714 45.44975       5.063470 53.87775       10.76648 43.05623       5.737598 59.68095 7.573189 57.34664 4.133421 2.334309       8.627767 
1 1 1 11  34 19 o 13.81521 5.241103 2.174207       2.429099 2.856159       6.676083 2.070149       2.607848 18.35538 7.986635 13.86880 5.386853 4.486586       9.633511 
1 1 1 11  34 20 o 17.24088 6.225461 4.147796       3.352010 2.902131       6.930157 4.528221       3.829807 18.25814 8.035463 17.91422 6.624795 0.3439217      10.41425 
1 1 1 11  34 21 o 13.31642 5.689644 1.079900       3.270368 1.668481       7.338948 0.9340630      3.653132 17.46118 7.929554 13.67343 5.929012 3.787755       9.901062 
1 1 1 11  34 22 o 16.20661 6.014478 3.719866       3.161691 0.7540240      7.843144 4.295336       3.454837 16.97141 7.883750 17.07601 6.296159 -0.1045971     10.08936 
1 1 1 11  34 23 f 29.22072 4.298185 11.88473       2.969272 22.49115       9.164430 10.64073       3.138575 30.54977 10.34485 27.11062 4.932338 3.439150       11.46054 
1 1 1 11  34 24 o 14.04024 5.308966 2.660600       2.487562 7.066447       7.923008 2.178799       2.620048 19.34487 8.549462 13.44845 5.345718 5.896411       10.08315 
1 1 1 11  34 25 o 20.32886 5.253239 6.378495       2.621004 10.90379       8.574049 5.912033       2.752777 20.93159 9.079736 19.30689 5.553783 1.624704       10.64359 
1 1 1 11  35 0  o 55.44621 3.340210 38.15469       4.492241 35.10270       6.005085 42.03294       6.769334 52.69181 4.726876 57.63358 4.865256 -4.941772      6.783367 
1 1 1 11  35 1  o 23.93622 5.705573 7.570486       3.280798 12.08860       4.426720 2.064358       4.886823 30.20634 6.221029 17.69163 7.205653 12.51471       9.519592 
1 1 1 11  35 2  o 70.38846 2.998142 61.25548       5.130905 55.71824       6.937313 67.94234       7.623525 66.61656 4.296303 73.60049 4.268809 -6.983925      6.056480 
1 1 1 11  35 3  o 46.89132 3.548873 27.44254       4.025156 21.79971       5.252568 35.47098       6.265252 41.11897 5.370154 52.80044 4.926130 -11.68147      7.287339 
1 1 1 11  35 4  o 39.97067 3.926392 20.11270       3.775165 21.41160       5.030864 18.43860       5.711441 40.78868 5.177877 37.23350 6.532845 3.555180       8.335975 
1 1 1 11  35 5  o 26.38846 4.902311 9.071883       3.036452 8.623005       4.071587 9.634373       4.557816 25.25283 6.558567 26.58668 6.956084 -1.333849      9.560434 
1 1 1 11  35 6  o 18.07140 5.979727 4.111995       3.064261 3.913882       3.849733 4.454530       5.062050 18.40100 6.667917 20.09207 7.578650 -1.691078      10.09441 
1 1 1 11  35 7  o 41.49545 3.431612 21.58306       3.439045 23.62941       4.939381 19.65773       4.791096 42.87632 4.810208 38.90197 5.182730 3.974354       7.070982 
1 1 1 11  35 8  o 16.34551 5.709554 3.203202       2.798481 1.536620       3.414848 6.611267       4.883284 14.88327 6.037638 22.32032 7.551442 -7.437054      9.668369 
1 1 1 11  35 9  o 10.45105 4.819031 -1.933596      2.851136 -6.948695      3.879941 3.953456       4.203725 9.843919 4.819021 18.58589 6.927886 -8.741967      8.439110 
1 1 1 11  35 10 o 48.98760 5.672709 31.79095       6.646923 0.000000       0.000000 31.79095       6.646923 ?        ?        48.98760 5.672709 0.000000       5.672709 
1 1 1 11  35 11 o 14.07523 5.841599 1.113656       3.291250 -6.241007      6.059922 4.190793       3.919756 13.67124 6.523868 18.47841 6.723603 -4.807163      9.368441 
1 1 1 11  35 12 o 60.08032 3.387466 45.55590       4.939472 61.68217       10.71708 41.20629       5.565895 66.81030 6.671714 56.70930 4.054331 10.10100       7.807007 
1 1 1 11  35 13 o 21.72522 6.004823 6.621283       3.285056 6.682320       6.686743 6.601864       3.771581 22.30042 8.635737 21.57561 6.577591 0.7248039      10.85544 
1 1 1 11  35 14 f 25.34628 5.427633 8.879470       3.251374 13.57023       6.552402 7.347204       3.744951 29.18691 8.618311 22.58092 6.472211 6.605989       10.77798 
1 1 1 11  35 15 o 27.99139 5.077904 10.69616       3.336217 11.92334       7.236711 10.36495       3.759569 26.75795 9.189898 27.07931 5.867106 -0.3213558     10.90308 
1 1 1 11  35 16 o 28.31713 4.825728 10.89694       3.210740 16.61000       7.611104 9.660173       3.541260 31.02526 9.319763 26.09483 5.726431 4.930435       10.93846 
1 1 1 11  35 17 o 52.26756 3.896334 35.66759       4.927071 45.83916       10.30005 32.64949       5.610631 53.94281 8.084278 49.22887 4.735217 4.713943       9.368982 
1 1 1 11  35 18 o 23.19088 5.634552 7.801494       3.152479 16.16552       8.495180 6.465760       3.394885 28.73690 9.953167 20.80293 6.218637 7.933968       11.73614 
1 1 1 11  35 19 o 38.33346 3.670282 19.32931       3.386748 32.83797       8.934921 17.06280       3.659855 43.66951 8.701736 35.50938 4.318121 8.160130       9.714236 
1 1 1 11  35 20 o 12.06522 5.107876 0.8751351      2.594172 -0.8555409     7.923720 1.082911       2.745481 16.51366 7.753420 12.53287 5.277607 3.980784       9.379161 
1 1 1 11  35 21 o 8.611433 4.091187 -2.229277      2.330017 -5.184298      7.598461 -1.922577      2.447948 14.38211 6.973490 9.094954 4.282479 5.287157       8.183470 
1 1 1 11  35 22 o 15.89206 5.937881 3.686645       3.091783 14.29241       8.185260 1.921621       3.339156 24.56768 9.543252 13.91249 5.837083 10.65519       11.18683 
1 1 1 11  35 23 o 31.32878 5.099682 14.49675       3.759555 20.11129       9.046286 13.32458       4.133416 27.60131 10.18622 28.99916 6.045278 -1.397842      11.84502 
1 1 1 11  35 24 o 15.92434 6.026301 3.914250       3.206729 -1.064029      8.016951 4.862458       3.498818 15.36064 7.376263 17.18225 6.335973 -1.821613      9.723878 
1 1 1 11  36 0  f 17.55341 5.978190 3.784130       3.060978 3.840770       3.889605 3.691986       4.961071 18.34268 6.694129 19.19707 7.437198 -0.8543987     10.00616 
1 1 1 11  36 1  o 20.41048 6.230612 5.508129       3.382690 6.639741       4.397160 3.867495       5.294554 22.32743 7.147592 19.66620 7.665117 2.661224       10.48056 
1 1 1 11  36 2  o 37.93037 4.033066 18.24823       3.670765 24.68784       5.082032 11.22371       5.307818 43.82859 4.838662 28.35109 7.548914 15.47750       8.966536 
1 1 1 11  36 3  o 51.66722 3.358848 33.37439       4.206116 33.49111       5.717558 33.23672       6.209546 51.18053 4.634443 50.74244 5.090396 0.4380989      6.884053 
1 1 1 11  36 4  o 94.46271 2.918323 110.7185       6.709785 112.8656       9.744132 108.7823       9.253042 94.43444 4.245104 92.82294 4.100780 1.611504       5.902313 
1 1 1 11  36 5  o 18.83350 6.609418 4.407857       3.752862 5.691856       5.499522 3.288862       5.134009 21.49592 7.940565 18.76784 7.475567 2.728081       10.90581 
1 1 1 11  36 6  o 14.65367 5.948540 1.521145       3.317419 4.138658       4.955364 -0.6047331     4.465811 19.38755 7.453584 14.48891 6.410290 4.898643       9.830957 
1 1 1 11  36 7  o 47.81158 3.939954 29.07667       4.549801 40.41453       7.679502 22.94454       5.647720 55.14849 5.801073 41.46609 5.743127 13.68241       8.163085 
1 1 1 11  36 8  o 70.68233 3.637692 63.12915       6.244669 79.70119       10.02651 52.62712       7.981752 77.90919 5.312896 63.33358 5.217882 14.57561       7.446688 
1 1 1 11  36 9  o 34.33297 4.175475 15.25054       3.421695 16.11179       4.486790 14.05344       5.289763 34.60080 5.505526 31.32926 7.094140 3.271536       8.979846 
1 1 1 11  36 10 o 37.80115 4.404876 18.63772       3.981712 24.13353       8.433375 17.06120       4.516845 39.41501 8.981092 35.59573 5.374433 3.819275       10.46635 
1 1 1 11  36 11 o 21.46180 6.077424 6.499610       3.321851 0.7414367      6.365191 8.654889       3.894223 17.42213 7.682930 24.57734 6.429510 -7.155214      10.01828 
1 1 1 11  36 12 o 13.23626 5.601791 0.7805058      3.118408 -1.807377      6.905609 1.443410       3.495062 16.42499 7.546762 14.49967 6.018928 1.925323       9.653036 
1 1 1 11  36 13 o 23.16155 6.098167 7.708625       3.488587 13.92312       7.566015 6.030690       3.931443 28.60718 9.393007 20.47374 6.773154 8.133442       11.58034 
1 1 1 11  36 14 o 13.66271 5.629095 1.395269       3.025830 5.308115       6.496293 0.3111913      3.419396 20.37453 8.304346 13.14143 5.716923 7.233105       10.08193 
1 1 1 11  36 15 o 24.71310 5.927912 8.855885       3.524038 16.52839       7.470089 6.659569       3.996728 30.65435 9.238553 21.07063 6.820778 9.583715       11.48363 
1 1 1 11  36 16 o 47.39120 4.994088 30.82955       5.680923 45.07812       10.27964 24.56450       6.816390 52.75560 8.267397 39.90844 7.276999 12.84716       11.01383 
1 1 1 11  36 17 o 17.00855 5.951593 4.097322       3.041578 16.70420       8.413329 2.201934       3.262219 28.76966 9.907814 14.61382 5.911022 14.15584       11.53711 
1 1 1 11  36 18 o 27.63379 4.948532 10.79606       3.209988 21.42187       8.067723 8.797513       3.498863 33.25421 9.489394 24.10733 5.983880 9.146873       11.21853 
1 1 1 11  36 19 o 10.28909 4.678443 -0.7715876     2.564716 1.160272       7.220942 -1.050476      2.743602 16.75036 7.703899 10.40253 4.771209 6.347837       9.061706 
1 1 1 11  36 20 o 13.70269 5.329953 2.300807       2.555888 19.25142       7.969609 0.3575471      2.698421 29.71726 9.632586 11.53115 5.046270 18.18612       10.87435 
1 1 1 11  36 21 o 19.85892 5.619080 6.134884       2.840837 -0.7906643     8.435479 7.020830       3.017076 16.12484 7.695372 21.19754 5.712524 -5.072697      9.583928 
1 1 1 11  36 22 o 9.546947 4.421895 -1.160057      2.440157 0.2030187      7.935511 -1.302402      2.564406 15.96312 7.574126 9.681711 4.501037 6.281406       8.810603 
1 1 1 11  37 0  o 46.55106 4.038206 27.56926       4.535663 16.38165       6.954809 35.84903       5.983096 33.39215 8.520125 52.74455 4.704240 -19.35241      9.732544 
1 1 1 11  37 1  o 63.86612 3.914908 51.66214       6.063682 64.01041       9.772674 43.93235       7.732042 69.57662 5.817057 57.77217 5.560723 11.80445       8.047347 
1 1 1 11  37 2  o 52.85155 4.279598 35.75182       5.464733 26.52751       7.937075 44.06563       7.535176 43.13286 7.839900 57.91586 5.401278 -14.78300      9.520390 
1 1 1 11  37 3  o 63.54543 3.997041 51.36847       6.158193 50.43725       9.804100 51.97528       7.914265 60.69317 6.742399 63.01793 5.199828 -2.324757      8.514585 
1 1 1 11  37 4  o 38.57070 3.937795 19.03854       3.649364 25.86381       5.201922 12.42400       5.120988 44.47864 4.879283 29.46227 7.195677 15.01637       8.693974 
1 1 1 11  37 5  o 28.35466 4.722324 10.62464       3.148287 10.02793       4.398997 11.25121       4.507691 26.56022 6.775665 28.21762 6.662745 -1.657398      9.502727 
1 1 1 11  37 6  o 20.69331 5.586000 5.891803       2.881992 6.669812       4.045686 5.090230       4.106499 21.75641 6.843016 19.60996 6.911211 2.146448       9.725826 
1 1 1 11  37 7  o 23.24436 5.665971 7.492835       3.179826 9.799934       4.094378 3.986291       5.047710 26.24800 6.448355 18.87236 7.445781 7.375639       9.849920 
1 1 1 11  37 8  o 36.01061 4.249115 16.91833       3.657046 12.70830       5.974249 19.44122       4.624762 28.73743 8.154505 38.10075 5.109737 -9.363325      9.623168 
1 1 1 11  37 9  o 21.70587 5.313411 6.519967       2.787455 8.725616       3.863011 4.124075       4.026162 24.63385 6.383626 18.12979 6.775583 6.504066       9.309093 
1 1 1 11  37 10 o 16.69587 6.289332 3.352078       3.483628 5.118093       5.770347 2.339293       4.369815 20.12073 7.953869 16.41633 6.764255 3.704407       10.44123 
1 1 1 11  37 11 o 35.48591 5.201548 17.18134       4.364557 26.09693       8.181044 13.63422       5.160256 40.54174 8.550321 30.14717 7.135632 10.39458       11.13666 
1 1 1 11  37 12 o 18.50333 6.326040 4.803952       3.428153 7.765692       7.280885 3.960330       3.885838 22.55634 8.928869 17.57235 6.637424 4.983995       11.12565 
1 1 1 11  37 13 o 12.19495 5.525014 -0.9541432     3.537480 4.379297       7.421682 -2.522036      4.023989 19.87904 8.533956 11.94969 5.582959 7.929354       10.19793 
1 1 1 11  37 14 o 9.946150 4.683239 -2.417011      2.927444 -1.435880      6.452638 -2.671293      3.284968 15.54678 7.197293 10.48901 4.945651 5.057761       8.732725 
1 1 1 11  37 15 o 12.37137 5.386524 0.3820783      3.041042 -0.4633515     7.077093 0.5735327      3.367820 16.40801 7.575305 13.04935 5.675290 3.358666       9.465420 
1 1 1 11  37 16 o 14.25396 5.729496 2.176160       3.043988 -2.513421      7.023144 3.260893       3.377739 15.23544 7.198103 15.88142 6.141029 -0.6459770     9.461761 
1 1 1 11  37 17 o 21.96196 5.787761 7.336215       3.140575 4.796888       7.164097 7.940298       3.494221 18.82226 8.230028 22.55972 6.176367 -3.737461      10.28984 
1 1 1 11  37 18 o 17.80819 5.984900 4.876755       3.067421 15.97065       8.633496 3.274019       3.281524 26.13032 9.888213 15.56780 6.043839 10.56252       11.58899 
1 1 1 11  37 19 o 55.29495 4.071920 41.73892       5.448336 44.08520       11.53498 41.06516       6.181310 44.31475 10.78501 53.80702 4.763327 -9.492268      11.79007 
1 1 1 11  37 20 o 19.47940 5.783372 6.014153       2.944122 12.29649       8.631766 5.187077       3.131930 22.40931 9.392287 17.99071 6.047514 4.418598       11.17083 
1 1 1 11  38 0  o 60.99377 3.706218 47.31304       5.482744 61.31730       10.36299 41.86924       6.461093 66.76978 6.449137 56.62961 4.724965 10.14016       7.994789 
1 1 1 11  38 1  o 68.18866 3.094054 58.39418       5.127942 56.73300       7.265061 60.04348       7.239018 66.09180 4.538369 68.14047 4.382759 -2.048676      6.309149 
1 1 1 11  38 2  o 17.85778 6.191337 4.158082       3.287509 2.718368       4.245833 6.313393       5.194932 16.87754 6.772696 21.43369 7.748686 -4.556145      10.29133 
1 1 1 11  38 3  o 53.08229 3.131428 35.50951       4.032687 43.40602       6.351624 30.17669       5.219706 57.67443 4.556225 48.07205 4.508321 9.602383       6.409692 
1 1 1 11  38 4  o 18.70458 5.633935 4.808845       2.778634 3.439134       3.718729 6.540184       4.180914 17.12469 6.487529 21.41382 6.979489 -4.289129      9.528972 
1 1 1 11  38 5  o 77.85658 4.083113 78.18988       7.719731 84.43384       11.93689 73.70103       10.12113 77.96959 6.337052 73.71607 5.677899 4.253517       8.508629 
1 1 1 11  38 6  o 21.03494 5.563242 6.186220       2.895028 11.04745       4.264565 2.031043       3.942725 27.71867 6.437113 15.68190 6.439555 12.03677       9.105180 
1 1 1 11  38 7  o 29.03732 4.449347 11.21195       3.048222 11.29950       4.440355 11.13393       4.192028 27.82267 6.641450 27.82096 6.326710 0.1710892E-02  9.172575 
1 1 1 11  38 8  o 7.989102 3.933262 -5.214349      2.703127 -5.431157      3.447797 -4.868485      4.354678 9.457441 4.610920 11.36055 5.450415 -1.903111      7.139160 
1 1 1 11  38 9  o 20.09970 5.906874 5.792583       3.084154 6.015364       3.809879 5.369033       5.253206 20.31410 6.665157 19.85588 7.663637 0.4582176      10.15656 
1 1 1 11  38 10 o 13.31286 5.763626 0.5265667      3.441232 5.967264       6.309156 -1.777489      4.105731 20.65453 8.266984 12.56657 5.790329 8.087962       10.09311 
1 1 1 11  38 11 o 17.45279 6.430185 4.130148       3.602331 9.338055       6.995594 2.250865       4.202319 23.45646 8.895332 15.80157 6.582950 7.654898       11.06626 
1 1 1 11  38 12 o 14.81224 6.189311 1.847246       3.731189 11.89064       7.711853 -1.222326      4.263413 25.21998 9.386827 13.01693 5.961868 12.20305       11.12009 
1 1 1 11  38 13 o 9.952873 4.795468 -4.078875      3.454997 -3.923496      7.002283 -4.128875      3.972189 14.78727 7.044248 10.83496 5.200167 3.952308       8.755751 
1 1 1 11  38 14 o 52.33533 4.506380 37.42045       5.691320 54.28030       11.10280 31.41139       6.628402 56.56553 8.301492 46.02574 6.056628 10.53979       10.27606 
1 1 1 11  38 15 f 11.77372 5.271729 -0.2247337     3.114259 3.093818       7.302310 -0.9625047     3.443077 17.90696 8.040906 11.71771 5.363386 6.189245       9.665509 
1 1 1 11  38 16 o 17.47535 6.249290 4.652880       3.368468 27.59081       9.221330 1.120787       3.618532 36.04737 10.09717 13.58495 5.895698 22.46242       11.69239 
1 1 1 11  38 17 o 12.17937 5.329098 0.5487486      3.008317 4.298490       7.426758 -0.1872618     3.290339 18.15026 8.132836 11.94264 5.377168 6.207622       9.749716 
1 1 1 11  38 18 o 16.77371 6.111725 4.334852       3.240360 4.771697       8.464046 4.259830       3.507584 18.41248 8.420713 16.69674 6.306235 1.715746       10.52031 
1 1 1 11  39 0  o 21.29290 6.120848 6.446025       3.344711 7.462542       4.702919 5.405632       4.757829 22.50213 7.406381 20.00638 7.386548 2.495752       10.46019 
1 1 1 11  39 1  o 18.49679 6.628423 4.554748       3.791675 4.102160       6.374311 4.802577       4.716915 19.66491 8.142657 19.27489 7.305515 0.3900261      10.93953 
1 1 1 11  39 2  o 30.84276 4.864031 12.81024       3.534826 12.54408       5.041264 13.06766       4.957778 28.98009 7.176502 29.75790 6.961283 -0.7778072     9.998082 
1 1 1 11  39 3  o 25.02264 5.330897 8.686613       3.151068 12.17055       4.785772 6.020375       4.186649 28.65267 6.930477 20.47462 6.991156 8.178049       9.844174 
1 1 1 11  39 4  f 31.14048 4.511020 12.93993       3.323653 15.53335       4.952168 10.81423       4.483422 32.82360 6.421259 26.98196 6.817243 5.841635       9.365221 
1 1 1 11  39 5  o 26.48091 4.843972 9.559369       3.010714 13.35417       4.466960 6.400536       4.075501 30.44930 6.230186 20.86578 6.895863 9.583525       9.293447 
1 1 1 11  39 6  o 17.94770 5.788889 4.519379       2.880533 5.379231       3.957652 3.550734       4.200568 19.38379 6.788499 17.28453 6.800592 2.099258       9.608942 
1 1 1 11  39 7  o 10.87552 4.853320 -0.5018091     2.616192 0.4721462      3.323097 -2.089561      4.242920 13.05917 5.658786 12.56164 5.822608 0.4975357      8.119399 
1 1 1 11  39 8  o 11.66499 5.027156 0.3446561      2.594474 -1.638564      3.603315 2.479714       3.738709 11.76911 5.423464 15.57149 6.317225 -3.802379      8.325942 
1 1 1 11  39 9  o 16.70649 5.418849 3.920108       2.521875 -0.3542653     3.253326 10.35538       3.991856 12.10840 5.407231 26.27784 6.312884 -14.16943      8.312079 
1 1 1 11  39 10 o 24.34872 6.789372 9.283545       4.179351 16.28196       7.095876 5.566255       5.171533 29.86314 9.005075 19.40632 7.572183 10.45682       11.76560 
1 1 1 11  39 11 o 18.31425 6.293200 5.008801       3.393747 5.669780       7.466896 4.836709       3.810014 19.92387 8.556664 18.11216 6.622891 1.811712       10.82031 
1 1 1 11  39 12 o 22.71708 6.078378 7.916967       3.430870 8.768567       7.852869 7.716071       3.814141 21.80880 9.034778 22.03425 6.592566 -0.2254486     11.18433 
1 1 1 11  39 13 o 14.70653 5.972868 2.418939       3.346482 7.037317       7.895069 1.407445       3.694818 20.39328 8.778926 14.01873 6.019819 6.374546       10.64461 
1 1 1 11  39 14 o 17.09403 6.796606 4.176548       4.236345 12.28524       8.324724 1.342836       4.921214 23.63876 9.484263 15.08802 6.699422 8.550737       11.61178 
1 1 1 11  39 15 o 10.84181 5.063082 -1.724732      3.303401 -4.450606      7.916887 -1.150093      3.634956 14.76463 7.149246 11.75179 5.426824 3.012839       8.975641 
1 1 1 11  39 16 o 13.41183 5.680665 1.571002       3.211144 9.411979       7.245524 -0.3455451     3.582157 21.29842 8.735930 12.19129 5.537768 9.107134       10.34328 
1 1 1 11  40 0  o 17.43084 6.102648 4.143673       3.198199 5.387362       4.453719 2.819550       4.595484 19.50894 7.156188 16.86089 6.940973 2.648052       9.969359 
1 1 1 11  40 1  o 20.97303 6.505499 6.513219       3.669808 16.04212       4.825209 -6.561512      5.652117 33.34919 6.164389 12.50020 6.049885 20.84899       8.637176 
1 1 1 11  40 2  f 11.25069 5.275603 -2.619330      3.648342 0.6210690E-01  5.955990 -4.229686      4.615632 16.04380 7.228174 11.97629 5.709078 4.067513       9.210867 
1 1 1 11  40 3  o 23.50078 6.053949 8.117815       3.488283 8.050718       4.951566 8.183925       4.914993 22.56453 7.604095 22.74156 7.574748 -0.1770306     10.73308 
1 1 1 11  40 4  o 13.10747 5.307872 1.504586       2.633892 1.306557       3.806383 1.686518       3.648409 14.45072 6.155159 14.63037 6.117295 -0.1796503     8.677977 
1 1 1 11  40 5  o 23.66475 5.453159 8.042270       3.080123 14.69906       4.383084 1.547796       4.329317 31.89527 5.854894 15.22103 6.525810 16.67423       8.767324 
1 1 1 11  40 6  f 22.14753 5.466854 7.106283       2.932426 8.882044       4.177752 5.381734       4.117068 23.83048 6.837759 19.04659 6.896431 4.783895       9.711628 
1 1 1 11  40 7  o 20.91628 5.626414 6.443640       2.930055 9.583486       4.312595 3.751581       3.993253 24.58665 6.911652 16.95576 6.642803 7.630899       9.586332 
1 1 1 11  40 8  o 14.11189 5.496029 2.300771       2.720343 -1.625136      3.805109 6.405089       3.890609 11.94040 5.527458 20.21910 6.739429 -8.278702      8.716231 
1 1 1 11  40 9  o 13.17045 5.358936 1.641143       2.699772 1.613671       3.764470 1.670236       3.873995 14.39445 6.125842 14.56465 6.206826 -0.1701994     8.720701 
1 1 1 11  40 10 o 20.91558 6.352975 6.873655       3.522737 17.63575       8.146146 4.398139       3.906938 28.93008 9.753326 17.40978 6.636913 11.52030       11.79729 
1 1 1 11  40 11 o 28.45276 5.628851 12.02800       3.764568 27.44381       9.060269 8.811225       4.138744 36.66612 9.907162 23.15187 6.852856 13.51425       12.04631 
1 1 1 11  40 12 o 12.45000 5.714403 -0.8544417     3.945177 -2.683922      7.533565 -0.1631408     4.630952 15.20367 7.260321 13.75059 6.265667 1.453077       9.590143 
1 1 1 11  40 13 o 24.33399 5.983981 9.235414       3.523325 9.851145       8.342677 9.101753       3.886973 21.60318 9.153528 23.61016 6.534139 -2.006979      11.24642 
1 1 1 11  41 0  o 9.091949 4.381118 -3.629369      2.885530 -2.841799      3.871676 -4.613453      4.327831 11.38835 5.369536 11.21728 5.395110 0.1710739      7.611776 
1 1 1 11  41 1  o 21.01114 6.150390 6.658512       3.349357 8.583576       4.915998 4.990739       4.575700 22.85134 7.574445 18.64038 7.163383 4.210960       10.42527 
1 1 1 11  41 2  o 29.30431 5.306016 12.22811       3.649637 16.15681       5.349962 8.808371       4.991404 32.11768 7.030965 23.02857 7.632285 9.089106       10.37720 
1 1 1 11  41 3  o 14.36014 5.790087 2.147256       3.119133 3.395452       4.269579 0.7186404      4.567741 16.71257 6.761485 14.64385 6.480734 2.068719       9.365767 
1 1 1 11  41 4  o 24.42146 6.242405 9.118000       3.728693 13.52684       8.074351 7.922943       4.203775 25.83044 9.606668 22.20263 6.974333 3.627813       11.87137 
1 1 1 11  41 5  o 23.95797 5.716427 8.534105       3.290716 8.148489       5.090152 8.810998       4.313289 21.93614 7.697519 23.28849 7.020461 -1.352348      10.41819 
1 1 1 11  41 6  o 15.70572 5.797581 3.357847       2.930780 3.792775       4.258473 2.966465       4.039674 16.94918 6.789156 15.95795 6.531666 0.9912300      9.421003 
1 1 1 11  41 7  o 15.61350 5.825132 3.311935       2.973276 2.974890       4.521736 3.568671       3.946429 16.24360 6.802297 16.47039 6.556235 -0.2267876     9.447512 
1 1 1 11  41 8  o 24.63411 5.417393 8.962702       3.163444 9.290469       4.718245 8.695036       4.263767 23.25714 7.399469 22.87220 6.997666 0.3849430      10.18428 
1 1 1 11  41 9  o 15.28454 5.688601 3.205474       2.832187 2.589021       4.267262 3.690812       3.786359 15.55859 6.567198 16.38179 6.453175 -0.8232002     9.207148 
1 1 1 11  41 10 o 13.02554 5.709364 0.7296079      3.466456 10.67504       7.978251 -1.584805      3.848720 22.46511 9.185282 11.82875 5.504254 10.63636       10.70823 
1 1 1 11  42 0  o 11.61565 5.343757 -1.272022      3.477546 -2.045491      4.229478 0.3420517      6.109799 12.27371 5.730854 15.76816 7.189590 -3.494448      9.194177 
1 1 1 11  42 1  o 14.20131 5.917070 1.842051       3.395825 3.455728       4.988478 0.4485116      4.635743 17.03710 7.140356 14.37991 6.435755 2.657187       9.612680 
1 1 1 11  42 2  o 28.01341 5.300735 11.35803       3.486085 12.77871       5.366488 10.32086       4.585303 27.25079 7.727237 24.96499 7.163593 2.285799       10.53695 
1 1 1 11  42 3  o 10.02423 4.769659 -2.883661      3.191154 1.063461       4.625639 -6.468352      4.408160 14.75138 6.525321 10.41231 5.105419 4.339070       8.285234 
1 1 1 11  42 4  o 30.70973 4.995741 13.43102       3.610243 16.66401       5.382849 10.78766       4.867298 32.05194 7.080710 25.13436 7.429510 6.917585       10.26324 
1 1 1 11  42 5  o 23.89220 6.455365 9.085381       3.846768 21.34168       7.984595 5.380756       4.389806 32.57111 9.485477 18.54024 7.042876 14.03087       11.81425 
1 1 1 12  0  0  o 140.9985 3.281813 242.6525       11.26244 242.6525       11.26244 242.6525       11.26244 140.9985 3.281813 140.9985 3.281813 0.000000       0.000000 
1 1 1 12  0  1  o 93.25261 3.656974 106.4587       8.281260 106.4587       8.281260 106.4587       8.281260 93.25261 3.656974 93.25261 3.656974 0.000000       0.000000 
1 1 1 12  0  2  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  0  3  o 157.5287 4.325103 303.1058       16.57492 303.1058       16.57492 303.1058       16.57492 157.5287 4.325103 157.5287 4.325103 0.000000       0.000000 
1 1 1 12  0  4  o 508.0996 10.53444 3153.720       130.3091 3153.720       130.3091 3153.720       130.3091 508.0996 10.53444 508.0996 10.53444 0.000000       0.000000 
1 1 1 12  0  5  o 268.6245 8.536490 882.6827       55.75268 882.6827       55.75268 882.6827       55.75268 268.6245 8.536490 268.6245 8.536490 0.000000       0.000000 
1 1 1 12  0  6  o 22.77239 10.48670 9.218470       6.385667 9.218470       6.385667 9.218470       6.385667 22.77239 10.48670 22.77239 10.48670 0.000000       0.000000 
1 1 1 12  0  7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  0  8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  0  9  o 592.9114 12.19926 4301.704       176.0940 4301.704       176.0940 4301.704       176.0940 592.9114 12.19926 592.9114 12.19926 0.000000       0.000000 
1 1 1 12  0  10 o 269.5042 6.097894 887.1237       40.00177 887.1237       40.00177 887.1237       40.00177 269.5042 6.097894 269.5042 6.097894 0.000000       0.000000 
1 1 1 12  0  11 o 286.2102 5.256978 999.8740       36.63758 999.8740       36.63758 999.8740       36.63758 286.2102 5.256978 286.2102 5.256978 0.000000       0.000000 
1 1 1 12  0  12 o 249.0901 4.741523 757.3638       28.75779 757.3638       28.75779 757.3638       28.75779 249.0901 4.741523 249.0901 4.741523 0.000000       0.000000 
1 1 1 12  0  13 o 38.02644 6.007688 18.90733       5.151922 18.90733       5.151922 18.90733       5.151922 38.02644 6.007688 38.02644 6.007688 0.000000       0.000000 
1 1 1 12  0  14 o 60.73238 4.434603 45.69457       6.481006 45.69457       6.481006 45.69457       6.481006 60.73238 4.434603 60.73238 4.434603 0.000000       0.000000 
1 1 1 12  0  15 o 148.1985 4.373567 268.5658       15.76371 268.5658       15.76371 268.5658       15.76371 148.1985 4.373567 148.1985 4.373567 0.000000       0.000000 
1 1 1 12  0  16 o 156.8591 4.503177 300.8901       17.18124 300.8901       17.18124 300.8901       17.18124 156.8591 4.503177 156.8591 4.503177 0.000000       0.000000 
1 1 1 12  0  17 o 261.1149 6.090974 834.0964       38.70976 834.0964       38.70976 834.0964       38.70976 261.1149 6.090974 261.1149 6.090974 0.000000       0.000000 
1 1 1 12  0  18 f 74.07726 4.282811 67.61613       7.671618 67.61613       7.671618 67.61613       7.671618 74.07726 4.282811 74.07726 4.282811 0.000000       0.000000 
1 1 1 12  0  19 o 209.3055 5.292039 536.0010       26.95330 536.0010       26.95330 536.0010       26.95330 209.3055 5.292039 209.3055 5.292039 0.000000       0.000000 
1 1 1 12  0  20 o 313.7319 7.045734 1206.439       53.80545 1206.439       53.80545 1206.439       53.80545 313.7319 7.045734 313.7319 7.045734 0.000000       0.000000 
1 1 1 12  0  21 o 148.1122 4.539854 268.5945       16.35097 268.5945       16.35097 268.5945       16.35097 148.1122 4.539854 148.1122 4.539854 0.000000       0.000000 
1 1 1 12  0  22 o 108.3590 6.325302 145.1517       16.57113 145.1517       16.57113 145.1517       16.57113 108.3590 6.325302 108.3590 6.325302 0.000000       0.000000 
1 1 1 12  0  23 o 193.1954 7.454836 459.9227       34.97821 459.9227       34.97821 459.9227       34.97821 193.1954 7.454836 193.1954 7.454836 0.000000       0.000000 
1 1 1 12  0  24 o 62.66334 5.144375 48.97421       7.729717 48.97421       7.729717 48.97421       7.729717 62.66334 5.144375 62.66334 5.144375 0.000000       0.000000 
1 1 1 12  0  25 o 115.2697 4.564311 163.1738       12.77538 163.1738       12.77538 163.1738       12.77538 115.2697 4.564311 115.2697 4.564311 0.000000       0.000000 
1 1 1 12  0  26 o 110.7244 4.606468 150.7057       12.38030 150.7057       12.38030 150.7057       12.38030 110.7244 4.606468 110.7244 4.606468 0.000000       0.000000 
1 1 1 12  0  27 o 17.12123 9.551314 4.967933       5.934318 4.967933       5.934318 4.967933       5.934318 17.12123 9.551314 17.12123 9.551314 0.000000       0.000000 
1 1 1 12  0  28 o 61.52316 5.583350 47.56755       8.204279 47.56755       8.204279 47.56755       8.204279 61.52316 5.583350 61.52316 5.583350 0.000000       0.000000 
1 1 1 12  0  29 o 19.86890 11.20553 6.740892       8.280034 6.740892       8.280034 6.740892       8.280034 19.86890 11.20553 19.86890 11.20553 0.000000       0.000000 
1 1 1 12  0  30 o 19.05347 11.41075 5.132038       9.453282 5.132038       9.453282 5.132038       9.453282 19.05347 11.41075 19.05347 11.41075 0.000000       0.000000 
1 1 1 12  0  31 o 60.31112 5.435956 45.93411       7.832693 45.93411       7.832693 45.93411       7.832693 60.31112 5.435956 60.31112 5.435956 0.000000       0.000000 
1 1 1 12  0  32 o 45.98288 6.828707 27.99918       7.156259 27.99918       7.156259 27.99918       7.156259 45.98288 6.828707 45.98288 6.828707 0.000000       0.000000 
1 1 1 12  0  33 o 58.41193 5.720940 43.67950       7.951588 43.67950       7.951588 43.67950       7.951588 58.41193 5.720940 58.41193 5.720940 0.000000       0.000000 
1 1 1 12  0  34 o 17.02919 9.516242 5.420129       5.903052 5.420129       5.903052 5.420129       5.903052 17.02919 9.516242 17.02919 9.516242 0.000000       0.000000 
1 1 1 12  0  35 o 31.22198 9.555474 15.77471       6.352218 15.77471       6.352218 15.77471       6.352218 31.22198 9.555474 31.22198 9.555474 0.000000       0.000000 
1 1 1 12  0  36 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  0  37 o 18.40381 9.844560 7.397299       6.034670 7.397299       6.034670 7.397299       6.034670 18.40381 9.844560 18.40381 9.844560 0.000000       0.000000 
1 1 1 12  0  38 o 30.36517 10.13755 16.82039       6.684295 16.82039       6.684295 16.82039       6.684295 30.36517 10.13755 30.36517 10.13755 0.000000       0.000000 
1 1 1 12  0  39 o 9.285183 6.466399 -3.125462      5.246055 -3.125462      5.246055 -3.125462      5.246055 9.285183 6.466399 9.285183 6.466399 0.000000       0.000000 
1 1 1 12  0  40 o 8.260023 5.854362 -4.549470      4.915895 -4.549470      4.915895 -4.549470      4.915895 8.260023 5.854362 8.260023 5.854362 0.000000       0.000000 
1 1 1 12  0  41 o 9.727394 6.973327 -6.878283      7.769570 -6.878283      7.769570 -6.878283      7.769570 9.727394 6.973327 9.727394 6.973327 0.000000       0.000000 
1 1 1 12  0  42 o 14.13343 8.558799 5.685251       5.439056 5.685251       5.439056 5.685251       5.439056 14.13343 8.558799 14.13343 8.558799 0.000000       0.000000 
1 1 1 12  0  43 o 7.398168 5.327519 -5.483013      4.763457 -5.483013      4.763457 -5.483013      4.763457 7.398168 5.327519 7.398168 5.327519 0.000000       0.000000 
1 1 1 12  1  0  o 388.2307 5.807378 1837.678       54.94219 1809.116       76.64906 1867.862       78.79539 385.0788 8.168100 391.2751 8.263851 -6.196259      11.61934 
1 1 1 12  1  1  o 458.6638 6.039346 2565.147       67.50260 2547.757       106.0111 2577.006       87.54408 456.8586 9.522110 459.6096 7.816307 -2.750946      12.31930 
1 1 1 12  1  2  o 465.5625 6.845677 2643.549       77.66592 2588.370       108.2362 2702.115       111.5094 460.4562 9.646015 470.4571 9.726471 -10.00092      13.69853 
1 1 1 12  1  3  o 367.8213 4.960528 1649.359       44.46321 1638.604       57.14668 1665.859       70.77908 366.5542 6.397594 369.5052 7.860466 -2.951019      10.13490 
1 1 1 12  1  4  o 618.9584 8.957724 4676.756       135.1124 4418.358       183.5755 4982.180       199.5821 601.0765 12.53282 638.2202 12.83261 -37.14362      17.93732 
1 1 1 12  1  5  o 443.9041 6.563439 2403.573       70.99974 2349.281       98.73227 2461.716       102.1737 438.6281 9.236906 448.9910 9.338250 -10.36282      13.13481 
1 1 1 12  1  6  o 372.8050 5.022342 1694.623       45.62723 1697.648       58.83629 1690.059       72.26885 373.0515 6.472027 372.1053 7.969832 0.9461670      10.26671 
1 1 1 12  1  7  o 132.0696 2.325025 212.5615       7.482842 222.2752       10.71160 203.3029       10.45764 135.0428 3.254971 129.1072 3.326665 5.935593       4.654196 
1 1 1 12  1  8  o 465.9927 5.610788 2648.785       63.71462 2532.973       87.40176 2780.128       93.07802 455.4465 7.874930 477.1322 8.005202 -21.68567      11.22933 
1 1 1 12  1  9  o 135.3414 2.608919 223.2483       8.604536 233.3574       13.73664 216.7205       11.03843 138.2839 4.080825 133.2918 3.401126 4.992126       5.312325 
1 1 1 12  1  10 o 144.2348 2.437767 253.5533       8.568372 243.0741       11.84502 265.0555       12.40971 141.2029 3.442357 147.4490 3.453693 -6.246109      4.876250 
1 1 1 12  1  11 o 289.4173 4.093302 1021.547       28.86918 984.7068       36.43466 1083.693       47.32182 284.0647 5.263340 297.8784 6.519078 -13.81375      8.378612 
1 1 1 12  1  12 o 191.5172 3.089503 447.1884       14.41891 452.7534       22.79075 443.4744       18.61885 192.5563 4.860848 190.6801 4.006928 1.876282       6.299470 
1 1 1 12  1  13 o 99.64739 2.811190 121.1557       6.819585 121.2292       9.697674 121.0838       9.591895 99.60632 4.003412 99.54938 3.961850 0.5693817E-01  5.632368 
1 1 1 12  1  14 o 84.81229 3.214062 87.85090       6.630749 86.00780       11.24416 88.83358       8.210256 83.71999 5.542598 85.23415 3.963673 -1.514153      6.814037 
1 1 1 12  1  15 o 224.9334 3.845233 617.4149       21.07719 633.1010       30.24822 602.6105       29.38577 227.5972 5.453771 222.0518 5.430586 5.545334       7.696420 
1 1 1 12  1  16 f 153.3977 3.139791 287.0418       11.73696 291.2107       16.72403 282.9957       16.47590 154.3541 4.450824 152.1598 4.448150 2.194275       6.292525 
1 1 1 12  1  17 o 167.6043 3.289843 342.7574       13.43682 343.4140       19.00941 342.1017       18.99566 167.5822 4.659360 167.2608 4.664966 0.3214722      6.593295 
1 1 1 12  1  18 o 26.70979 5.467258 9.047172       3.438626 7.968501       4.795801 10.18844       4.933004 25.23722 7.351747 28.27059 7.155311 -3.033373      10.25898 
1 1 1 12  1  19 o 252.2337 4.211040 777.4027       25.88384 748.3487       35.80011 809.2258       37.46732 247.1277 5.944657 256.9736 5.983125 -9.845825      8.434259 
1 1 1 12  1  20 o 186.1598 3.518562 423.1996       15.96200 421.5100       22.51845 424.9058       22.62930 185.5139 4.985627 186.2594 4.990088 -0.7454376     7.053896 
1 1 1 12  1  21 o 121.0344 3.533066 179.0921       10.40954 175.2259       18.22031 180.9655       12.68325 119.2870 6.290199 121.5707 4.287916 -2.283714      7.612676 
1 1 1 12  1  22 o 83.94037 3.103301 86.15304       6.336983 82.65734       8.879462 89.78156       9.046569 82.06271 4.456951 85.54979 4.353707 -3.487083      6.230504 
1 1 1 12  1  23 o 78.86957 3.248719 76.11918       6.230559 75.53877       8.790645 76.70509       8.832186 78.39544 4.621950 79.00247 4.607661 -0.6070328     6.526328 
1 1 1 12  1  24 o 228.2388 4.670608 638.5530       25.97760 624.6139       31.30127 669.4014       46.56488 225.3318 5.704962 232.0804 8.246594 -6.748657      10.02761 
1 1 1 12  1  25 o 159.9871 3.429689 313.0078       13.37136 321.4957       19.13019 304.8999       18.69717 161.7753 4.858065 157.5359 4.876221 4.239365       6.883191 
1 1 1 12  1  26 o 95.37451 3.268200 111.3785       7.584640 115.4720       10.76061 107.3369       10.69231 96.88939 4.570362 93.37785 4.714101 3.511536       6.565893 
1 1 1 12  1  27 o 62.58157 4.322848 48.30423       6.552028 46.49854       7.982385 52.03288       11.47063 61.18418 5.409411 64.22578 7.468067 -3.041603      9.221375 
1 1 1 12  1  28 f 28.78012 7.406970 10.73433       5.225089 7.095487       6.277933 18.93738       9.425888 24.76840 8.557343 37.87146 10.04872 -13.10306      13.19867 
1 1 1 12  1  29 o 37.60777 6.305758 18.06203       5.574607 17.91236       6.689860 18.40208       10.08371 37.10248 7.653241 37.16956 10.60971 -0.6707764E-01 13.08198 
1 1 1 12  1  30 o 25.07850 7.615918 8.050097       5.062906 11.47378       8.742801 6.322670       6.210168 30.18266 10.10359 23.71343 8.484679 6.469225       13.19364 
1 1 1 12  1  31 o 64.53826 3.796496 51.55482       5.944479 54.04279       8.637914 49.31643       8.193227 65.54894 5.457086 62.61036 5.423413 2.938580       7.693711 
1 1 1 12  1  32 o 25.13282 6.796139 8.369623       4.261528 6.962894       6.004138 9.797707       6.049540 23.90083 8.362075 27.13925 8.341240 -3.238424      11.81104 
1 1 1 12  1  33 o 114.7252 3.396272 163.1485       9.484600 160.3454       13.41424 165.9508       13.41226 112.7068 4.895726 114.7338 4.807704 -2.027031      6.861644 
1 1 1 12  1  34 o 71.16772 3.638652 63.39098       6.289495 67.28870       8.968968 59.61976       8.822226 72.40927 5.115841 67.96506 5.370289 4.444214       7.416996 
1 1 1 12  1  35 o 69.62041 5.308501 63.36324       8.938354 0.000000       0.000000 63.36324       8.938354 ?        ?        69.62041 5.308501 0.000000       5.308501 
1 1 1 12  1  36 f 11.23225 5.314899 -3.665871      3.856575 -1.167724      5.256981 -6.577122      5.675018 14.96811 6.762810 12.82920 6.172339 2.138911       9.156056 
1 1 1 12  1  37 o 12.12612 5.765890 -4.186098      4.647712 -4.314452      5.407701 -3.823287      9.091764 13.17892 6.252909 17.32484 8.186639 -4.145916      10.30145 
1 1 1 12  1  38 o 12.04744 5.612527 -2.084714      4.020003 5.893228       5.851214 -9.217093      5.532454 19.85678 7.956673 11.23017 5.547414 8.626613       9.699611 
1 1 1 12  1  39 o 30.93324 5.887346 14.45284       4.275858 14.56989       6.059903 14.33678       6.034132 28.07913 8.287285 27.83882 8.283185 0.2403145      11.71709 
1 1 1 12  1  40 o 19.35733 7.249009 6.727681       4.613228 9.809465       5.503181 -0.5571435     8.461010 22.22288 7.982849 16.01525 7.660496 6.207623       11.06386 
1 1 1 12  1  41 o 14.02527 6.239575 1.840156       4.289691 7.357621       8.176801 -0.2550210     5.038763 18.19548 8.304378 13.29096 6.221887 4.904521       10.37664 
1 1 1 12  1  42 o 15.03393 6.145628 3.891754       3.570618 7.685032       5.251774 0.6310828      4.869140 18.15171 7.440510 13.11838 6.133017 5.033334       9.642360 
1 1 1 12  1  43 f 19.24262 6.797290 8.116420       3.973990 2.849901       5.422995 14.22470       5.840321 14.07630 6.544547 22.67505 8.213378 -8.598751      10.50194 
1 1 1 12  2  0  o 358.8704 6.236371 1570.409       54.53882 1570.363       66.84715 1570.501       94.32026 358.7964 7.645374 358.4453 10.81042 0.3511353      13.24073 
1 1 1 12  2  1  o 158.3042 3.024957 305.4017       11.66937 308.1548       13.41166 296.8226       23.67542 159.0115 3.461130 155.8929 6.244749 3.118607       7.139769 
1 1 1 12  2  2  o 194.3776 2.783844 460.4365       13.18643 470.4198       18.73120 450.6277       18.56674 196.4578 3.912552 192.2798 3.962469 4.178009       5.568593 
1 1 1 12  2  3  o 252.6368 3.340580 777.8711       20.56622 765.4472       28.70091 790.9831       29.48500 250.5805 4.700155 254.7247 4.750006 -4.144119      6.682366 
1 1 1 12  2  4  o 446.8304 6.601824 2435.243       71.88573 2473.036       102.3794 2398.493       100.9590 450.0508 9.335016 443.2149 9.347481 6.835876       13.21052 
1 1 1 12  2  5  o 88.94317 2.363129 96.47167       5.117421 102.6545       6.433213 85.81815       8.444666 91.73300 2.881411 83.80312 4.147993 7.929886       5.050581 
1 1 1 12  2  6  o 332.6093 4.554323 1348.743       36.91426 1354.883       47.53796 1339.418       58.58566 333.3018 5.852842 331.3082 7.256432 1.993652       9.322637 
1 1 1 12  2  7  o 63.71137 2.637834 49.55399       4.086581 51.10489       4.933470 46.16344       7.294487 64.67704 3.139537 61.33241 4.921833 3.344627       5.837904 
1 1 1 12  2  8  o 113.1948 2.238729 156.1484       6.175384 158.1714       8.637340 154.0328       8.832555 113.8735 3.115513 112.3681 3.228924 1.505409       4.486911 
1 1 1 12  2  9  f 362.0243 4.481097 1598.251       39.53286 1626.692       56.39911 1570.779       55.42932 365.0785 6.339425 358.7492 6.340339 6.329254       8.965946 
1 1 1 12  2  10 o 154.9808 2.735725 292.7654       10.33205 292.9674       13.32365 292.4608       16.36403 155.0156 3.527051 154.7966 4.342319 0.2189178      5.594267 
1 1 1 12  2  11 o 47.56398 2.868329 27.67822       3.309180 28.49882       4.334962 26.53222       5.122873 48.20092 3.719322 46.41106 4.589588 1.789860       5.907425 
1 1 1 12  2  12 o 74.22620 2.788807 67.25970       5.035456 68.39040       7.129512 66.13425       7.112936 74.77874 3.926176 73.52726 3.984650 1.251480       5.593952 
1 1 1 12  2  13 o 245.0350 3.623571 732.3247       21.63720 732.8524       27.97597 731.5391       34.13385 245.0398 4.685031 244.7179 5.723788 0.3218994      7.396706 
1 1 1 12  2  14 o 184.6926 3.399847 416.0641       15.30189 410.5844       21.45948 421.7324       21.82543 183.3137 4.807985 185.7856 4.824835 -2.471832      6.811443 
1 1 1 12  2  15 o 124.9212 3.388696 190.5101       10.30632 176.8459       17.35667 197.9519       12.80899 120.1066 5.948631 127.2802 4.135182 -7.173645      7.244719 
1 1 1 12  2  16 o 304.8147 5.566916 1136.231       41.35107 1173.677       73.23141 1118.703       50.10297 308.4844 9.753808 302.1821 6.803911 6.302307       11.89243 
1 1 1 12  2  17 o 165.8618 3.261948 335.6629       13.18437 354.7715       19.10670 318.2940       18.21620 170.3380 4.607200 161.3329 4.638203 9.005096       6.537524 
1 1 1 12  2  18 o 118.1526 2.950849 170.3096       8.496231 173.5467       12.02730 167.0851       12.00371 119.1253 4.149458 116.8763 4.221501 2.249023       5.919382 
1 1 1 12  2  19 o 14.67168 6.190530 0.2272127      3.789505 6.426453       6.455023 -3.032879      4.681052 24.46514 8.661122 13.80645 6.294338 10.65869       10.70671 
1 1 1 12  2  20 o 173.7761 3.933339 368.9801       16.65664 374.5099       29.13626 366.2955       20.30119 174.4427 6.867429 172.9550 4.821435 1.487778       8.390937 
1 1 1 12  2  21 o 124.6246 3.065897 189.6006       9.311028 179.2429       12.94736 200.6950       13.39986 120.9722 4.399296 128.0300 4.301001 -7.057777      6.152431 
1 1 1 12  2  22 o 40.64385 4.293517 20.43336       4.188300 18.73253       6.008282 22.04111       5.841537 38.48663 6.646473 41.97284 5.871557 -3.486210      8.868528 
1 1 1 12  2  23 o 51.39207 3.879204 32.48386       4.822324 34.77559       6.855630 30.23943       6.784518 52.96455 5.386466 49.28737 5.756988 3.677177       7.883966 
1 1 1 12  2  24 o 52.28213 3.882399 33.62639       4.911102 33.39476       6.856349 33.87046       7.037903 51.84987 5.510672 52.20195 5.620970 -0.3520775     7.871646 
1 1 1 12  2  25 o 86.76132 3.775622 92.29856       7.963605 94.23080       9.672948 88.23376       14.02966 87.54326 4.549807 84.20508 6.897510 3.338181       8.262953 
1 1 1 12  2  26 o 69.28178 4.103075 59.03575       6.896288 68.61449       8.652164 42.34951       11.41957 74.59063 4.785212 57.69263 8.366390 16.89800       9.638191 
1 1 1 12  2  27 f 111.4591 3.241463 152.1431       8.794902 138.6675       12.01019 167.7250       12.91475 106.1138 4.655866 116.7496 4.548060 -10.63586      6.508605 
1 1 1 12  2  28 o 34.83285 6.470666 15.52923       5.290409 17.74877       6.448423 10.95937       9.252804 37.08010 7.395831 30.27563 10.39169 6.804470       12.75482 
1 1 1 12  2  29 o 135.8092 3.361757 226.1748       11.12581 211.8677       15.34804 242.0184       16.15121 130.9189 4.818992 139.9672 4.742095 -9.048294      6.760928 
1 1 1 12  2  30 o 38.60214 5.117727 18.78947       4.695713 18.84707       6.686931 18.73343       6.595494 37.99654 7.488207 37.90320 7.406272 0.9333420E-01  10.53215 
1 1 1 12  2  31 o 67.86147 4.269722 57.22266       7.025094 74.24925       12.81840 49.91317       8.398728 76.17154 6.983289 62.94112 5.531964 13.23042       8.908925 
1 1 1 12  2  32 o 29.41414 6.348703 11.40522       4.417108 5.013094       6.040699 18.75044       6.475400 21.90645 8.275374 37.54715 7.340251 -15.64070      11.06170 
1 1 1 12  2  33 o 29.47575 6.523829 11.62299       4.561983 18.48480       6.432385 4.678494       6.471025 36.97653 7.397066 21.72953 8.472692 15.24700       11.24736 
1 1 1 12  2  34 o 25.84306 7.532625 9.264937       5.033386 28.71602       9.642753 1.980246       5.901124 44.58076 9.181856 18.58473 7.775965 25.99603       12.03213 
1 1 1 12  2  35 o 57.80123 3.990699 42.46641       5.586607 37.53804       7.707598 47.92146       8.108987 52.90910 6.088838 60.26034 5.585598 -7.351234      8.262739 
1 1 1 12  2  36 o 12.62330 5.807151 -2.089249      4.106395 -7.421742      5.680966 3.745526       5.942499 12.49857 6.052973 19.31362 7.915505 -6.815051      9.964622 
1 1 1 12  2  37 o 17.80891 6.850823 3.985282       4.188076 6.060369       5.825594 1.765623       6.025113 20.73220 8.051665 17.36113 7.570152 3.371069       11.05154 
1 1 1 12  2  38 o 23.58169 7.718916 9.312518       5.111104 5.157161       6.106456 19.03468       9.340420 19.27917 7.975109 29.85980 10.43090 -10.58064      13.13035 
1 1 1 12  2  39 o 15.32405 6.543934 2.288457       4.322029 2.416790       5.112867 1.967172       8.089836 16.02664 6.981132 17.52781 8.094754 -1.501167      10.68931 
1 1 1 12  2  40 o 12.87505 5.648510 0.9298362      3.399855 -3.776967      4.785632 5.726165       4.830930 11.72732 5.648772 18.22230 7.253761 -6.494977      9.193785 
1 1 1 12  2  41 o 9.190604 4.480580 -3.955481      3.254375 -7.247482      4.611698 -0.6899485     4.593122 9.944583 4.939065 12.63989 5.924584 -2.695309      7.713305 
1 1 1 12  2  42 o 20.44212 7.333602 9.302252       4.642749 16.12192       9.048226 6.865078       5.409101 20.68760 9.139937 17.34914 7.361604 3.338455       11.73591 
1 1 1 12  2  43 o 11.27884 5.220624 0.1726977      3.392977 -0.5586281     4.719038 0.9553701      4.881891 12.00278 5.735728 12.85238 6.050462 -0.8495970     8.337066 
1 1 1 12  3  0  o 81.19173 2.915785 80.43833       5.759669 76.70042       6.886477 89.14026       10.50729 79.24998 3.575045 85.36057 5.074127 -6.110588      6.207070 
1 1 1 12  3  1  o 692.8153 8.915163 5858.100       150.5161 5955.335       196.5283 5720.148       234.0878 698.1513 11.55153 683.7746 14.04849 14.37671       18.18785 
1 1 1 12  3  2  o 173.4164 3.656048 366.5325       15.45035 405.5076       26.81451 347.1618       18.90382 182.2578 6.045734 168.6948 4.602754 13.56300       7.598437 
1 1 1 12  3  3  o 253.4602 3.349301 782.9558       20.68712 794.5543       29.36831 771.5330       29.14499 255.2983 4.720574 251.5717 4.754075 3.726578       6.699631 
1 1 1 12  3  4  o 412.8738 5.018381 2078.299       50.49136 2127.397       72.32221 2031.613       70.52290 417.5931 7.106934 408.0851 7.091586 9.508057       10.03988 
1 1 1 12  3  5  o 345.8416 4.702742 1458.192       39.63368 1453.996       50.77848 1464.733       63.40078 345.2783 6.034959 346.4594 7.509417 -1.181122      9.633902 
1 1 1 12  3  6  o 576.9465 7.499524 4062.456       105.4400 4087.583       136.5033 4025.285       166.0228 578.4121 9.684332 573.5932 11.87757 4.818909       15.32524 
1 1 1 12  3  7  o 204.1962 3.173460 508.2115       15.79127 506.7597       20.03527 510.5924       25.65794 203.8838 4.032519 204.5544 5.151369 -0.6705933     6.542004 
1 1 1 12  3  8  o 200.3815 3.147400 489.4200       15.36900 475.8494       19.21330 513.5311       25.61015 197.5617 3.990829 205.1955 5.121628 -7.633865      6.492903 
1 1 1 12  3  9  o 209.9695 2.946222 537.3798       15.07502 524.3593       20.85604 551.6251       21.81486 207.3728 4.127090 212.6928 4.208851 -5.320068      5.894684 
1 1 1 12  3  10 o 224.0069 3.088190 611.6974       16.85782 602.3471       23.46222 621.6762       24.23780 222.2367 4.332287 225.7707 4.405443 -3.533981      6.178724 
1 1 1 12  3  11 o 334.3096 4.201613 1363.171       34.22953 1361.344       48.16117 1365.035       48.65841 333.9167 5.918652 334.3629 5.971779 -0.4461975     8.407888 
1 1 1 12  3  12 o 387.8653 5.227193 1836.422       49.40667 1817.131       63.30648 1866.480       79.02090 385.5867 6.737364 390.4761 8.304461 -4.889404      10.69374 
1 1 1 12  3  13 o 193.6076 3.097070 457.0696       14.61200 447.9444       18.64446 471.5980       23.52538 191.6169 3.992822 196.5471 4.911722 -4.930222      6.329901 
1 1 1 12  3  14 o 173.6180 2.933878 367.5723       12.41289 370.0828       16.08337 363.8741       19.52066 174.1633 3.789520 172.5763 4.645928 1.587051       5.995424 
1 1 1 12  3  15 o 172.2605 3.289779 361.9752       13.80984 349.5287       19.22572 375.2422       19.84932 169.1101 4.669741 175.2266 4.652581 -6.116470      6.591888 
1 1 1 12  3  16 o 35.05349 4.081451 15.20333       3.421301 17.13512       4.822976 13.24655       4.854075 37.03415 5.511850 32.33565 6.386782 4.698498       8.436319 
1 1 1 12  3  17 o 218.5418 5.373591 584.1621       28.61773 0.000000       0.000000 584.1621       28.61773 ?        ?        218.5418 5.373591 0.000000       5.373591 
1 1 1 12  3  18 o 184.4561 4.913788 416.3208       22.06778 0.000000       0.000000 416.3208       22.06778 ?        ?        184.4561 4.913788 0.000000       4.913788 
1 1 1 12  3  19 o 276.4825 4.505415 934.5181       30.35558 944.6206       43.17549 924.6427       42.68722 277.5082 6.384477 274.5592 6.380075 2.948944       9.025902 
1 1 1 12  3  20 o 40.21984 4.057921 19.96861       3.922897 18.93507       5.554255 20.99738       5.541395 38.83648 6.067142 41.00568 5.699317 -2.169209      8.324207 
1 1 1 12  3  21 o 17.28051 6.363250 2.898327       3.526922 4.770718       5.160764 1.257458       4.831175 21.45432 7.727515 17.39618 7.134202 4.058136       10.51719 
1 1 1 12  3  22 o 37.87249 4.489838 17.79902       4.063203 16.97796       5.641229 18.68420       5.857338 36.61001 6.564364 38.46589 6.478661 -1.855885      9.223010 
1 1 1 12  3  23 o 69.83639 3.261304 59.71402       5.534878 58.58549       7.773121 60.87468       7.883036 68.99853 4.650111 70.34328 4.624343 -1.344757      6.558055 
1 1 1 12  3  24 o 37.44275 4.865410 17.47810       4.334506 17.47410       5.949692 17.48262       6.327578 37.06102 6.839724 36.98619 7.279714 0.7482910E-01  9.988796 
1 1 1 12  3  25 o 41.19688 5.247851 21.18591       5.149011 21.05501       6.309186 21.44698       8.909989 40.79991 6.568642 40.64281 9.209955 0.1570930      11.31240 
1 1 1 12  3  26 o 46.44233 5.139438 26.84273       5.719337 27.42764       6.698501 25.26918       10.98684 46.77438 6.015835 43.85545 10.43291 2.918922       12.04308 
1 1 1 12  3  27 o 56.60160 4.582089 39.62310       6.266172 38.78823       7.404249 41.73013       11.76269 55.81231 5.516012 57.04060 8.740355 -1.228287      10.33539 
1 1 1 12  3  28 o 85.51901 3.386570 89.73573       7.043674 90.22217       9.854816 89.22768       10.07123 85.46471 4.750483 84.95788 4.885147 0.5068359      6.814085 
1 1 1 12  3  29 o 30.43547 6.173299 11.92897       4.421821 11.49485       6.318155 12.34573       6.190595 29.69164 8.372508 30.70232 8.142256 -1.010683      11.67884 
1 1 1 12  3  30 o 90.77521 3.352032 101.3364       7.402270 107.2594       10.59949 95.69757       10.34204 92.98753 4.692783 87.76492 4.854496 5.222610       6.751914 
1 1 1 12  3  31 o 62.91387 3.774547 49.01035       5.760307 51.49626       8.085167 46.44781       8.208851 64.03622 5.226584 60.65499 5.617481 3.381226       7.672893 
1 1 1 12  3  32 o 112.7091 3.996163 157.8287       10.95848 133.1893       18.87257 170.3619       13.46005 100.8825 7.735799 116.6464 4.745114 -15.76396      9.075170 
1 1 1 12  3  33 o 46.03591 5.357479 27.22773       5.898095 38.63837       10.58300 22.08675       7.103576 53.12264 8.458457 40.42945 7.485751 12.69319       11.29522 
1 1 1 12  3  34 o 69.40713 3.753618 60.44656       6.325156 48.08609       8.582860 75.13890       9.357502 60.60855 5.885148 76.53664 5.045258 -15.92810      7.751748 
1 1 1 12  3  35 o 47.23687 4.546229 28.80325       5.168658 29.42124       7.177193 28.13746       7.449587 46.43803 6.521755 45.03641 7.016366 1.401619       9.579284 
1 1 1 12  3  36 o 27.11883 6.738199 10.61967       4.433289 9.953696       6.176639 11.32732       6.366925 25.45745 8.491759 26.94537 8.598127 -1.487919      12.08461 
1 1 1 12  3  37 o 24.36134 6.893355 8.974368       4.275306 15.58346       6.243790 3.140378       5.866247 31.14880 8.137659 18.19705 7.691352 12.95175       11.19725 
1 1 1 12  3  38 o 17.20846 6.945730 3.741083       4.493597 1.030311       5.342019 10.30054       8.309844 15.66104 6.965394 23.32103 9.433705 -7.659989      11.72653 
1 1 1 12  3  39 o 13.67292 6.103356 0.5016966      4.140375 -0.4485534     4.945082 2.729785       7.572177 13.92530 6.393823 17.60857 8.019132 -3.683275      10.25609 
1 1 1 12  3  40 o 9.021621 4.416742 -4.707056      3.260711 -6.146355      4.653013 -3.318186      4.570772 10.60567 5.209353 11.64659 5.586690 -1.040925      7.638617 
1 1 1 12  3  41 o 11.77079 5.404041 -0.2006800     3.531358 2.945909       4.929541 -3.517662      5.061253 15.13328 6.713091 11.77189 5.703961 3.361385       8.809130 
1 1 1 12  3  42 o 20.21486 6.640290 8.114874       3.781056 15.27329       5.331777 0.8729146      5.362799 26.35680 7.772047 13.50415 6.352374 12.85264       10.03780 
1 1 1 12  3  43 o 13.93596 6.348170 2.972253       4.749046 3.952204       9.078177 2.603036       5.572334 14.94838 7.328956 13.94291 6.532219 1.005476       9.817509 
1 1 1 12  4  0  o 922.2128 11.79452 10392.41       265.0621 10209.08       414.0825 10519.68       345.0090 912.0883 18.63004 926.9427 15.27360 -14.85443      24.09069 
1 1 1 12  4  1  o 532.7994 6.946346 3462.446       90.18955 3410.842       141.0542 3498.132       117.3003 528.4080 10.95420 535.3511 8.991339 -6.943115      14.17175 
1 1 1 12  4  2  o 216.1148 3.640242 569.2518       19.17127 579.3479       22.27588 540.4143       37.64740 218.0123 4.192931 210.3451 7.355895 7.667175       8.466987 
1 1 1 12  4  3  o 481.7889 7.062916 2831.611       82.92337 2912.720       119.0464 2755.165       115.5735 488.3500 10.00343 474.9604 9.985379 13.38959       14.13423 
1 1 1 12  4  4  o 374.6406 4.601701 1711.074       42.01161 1763.016       60.22393 1661.837       58.63472 380.1830 6.500403 369.1115 6.518703 11.07156       9.205907 
1 1 1 12  4  5  o 401.7066 4.897102 1967.483       47.93848 1985.246       67.82881 1949.756       67.76173 403.3845 6.900156 399.7584 6.955860 3.626099       9.797762 
1 1 1 12  4  6  o 206.2312 3.182931 518.3805       15.99623 542.4378       20.73989 483.0560       25.13163 210.9426 4.034652 198.9622 5.187817 11.98036       6.572051 
1 1 1 12  4  7  o 81.82851 2.634945 81.68991       5.247419 85.50629       5.860380 66.25580       11.78531 83.71017 2.877116 73.38471 6.662763 10.32546       7.257425 
1 1 1 12  4  8  o 261.3157 3.775306 832.4916       24.04107 850.2408       31.02589 805.8204       38.03249 264.0402 4.821899 256.9817 6.073184 7.058472       7.754629 
1 1 1 12  4  9  o 112.3644 2.510639 153.8820       6.874628 159.5939       8.516138 143.1970       11.64769 114.3821 3.058006 108.2705 4.423944 6.111633       5.377981 
1 1 1 12  4  10 o 426.4432 5.183218 2218.913       53.86377 2171.269       74.88513 2269.986       77.53363 421.5502 7.289709 431.0114 7.381852 -9.461151      10.37457 
1 1 1 12  4  11 o 339.9399 4.257855 1409.577       35.27192 1395.239       49.33419 1424.571       50.44853 338.0244 5.989131 341.5501 6.061191 -3.525696      8.521017 
1 1 1 12  4  12 o 131.3676 2.564620 210.3702       8.210078 202.4102       10.41897 223.4090       13.33489 128.7953 3.322397 135.2702 4.049865 -6.474930      5.238294 
1 1 1 12  4  13 o 222.8167 3.380515 605.4972       18.35552 592.8945       23.38955 625.7029       29.61611 220.4170 4.354524 226.3410 5.369436 -5.924072      6.913228 
1 1 1 12  4  14 o 283.3034 4.037107 979.4649       27.87136 1004.635       36.52079 944.3595       43.13085 286.7690 5.226029 277.8568 6.369874 8.912170       8.239337 
1 1 1 12  4  15 o 128.9465 3.339111 202.9761       10.48361 184.3142       17.15899 214.0914       13.24266 122.6359 5.757744 132.3693 4.110346 -9.733452      7.074359 
1 1 1 12  4  16 o 131.8209 3.394637 212.1650       10.89563 224.1423       18.75273 206.0612       13.38706 135.2431 5.702811 129.8341 4.236843 5.408997       7.104428 
1 1 1 12  4  17 o 28.45963 4.859242 10.17580       3.249143 13.57100       4.713268 7.101259       4.485178 32.76812 6.127698 23.92850 7.146579 8.839621       9.413940 
1 1 1 12  4  18 o 277.5418 4.502771 941.3922       30.45400 927.2307       42.61753 956.1692       43.53401 275.0356 6.358625 279.2845 6.396549 -4.248901      9.019310 
1 1 1 12  4  19 o 113.2241 3.461188 156.6601       9.538715 155.7726       16.80861 157.0817       11.58482 112.5472 6.151989 113.2978 4.203251 -0.7506256     7.450791 
1 1 1 12  4  20 o 112.9269 3.475997 155.8785       9.554229 161.6963       16.93272 153.1612       11.57238 114.6460 6.082593 111.8485 4.253522 2.797508       7.422290 
1 1 1 12  4  21 o 196.5024 3.623374 471.7674       17.35070 480.8308       24.64819 462.8647       24.42849 198.0490 5.111395 194.2990 5.163866 3.749908       7.265801 
1 1 1 12  4  22 o 129.5272 3.106706 204.8781       9.806119 189.9119       13.42729 221.9839       14.35505 124.4853 4.433309 134.6077 4.382056 -10.12235      6.233510 
1 1 1 12  4  23 o 118.9984 3.549734 173.2506       10.28223 177.0995       12.87301 166.4674       17.08943 120.1822 4.402897 116.1860 6.056754 3.996216       7.487975 
1 1 1 12  4  24 o 120.7439 3.131335 178.2518       9.205852 181.4199       12.93230 174.9972       13.10755 121.6154 4.370769 119.4142 4.512442 2.201256       6.282177 
1 1 1 12  4  25 o 137.9415 3.221978 232.6140       10.83062 242.7593       15.38501 222.6467       15.24952 140.6270 4.495223 134.6330 4.655029 5.994003       6.471192 
1 1 1 12  4  26 o 92.92688 3.772821 105.9350       8.525891 108.5175       10.12608 99.64527       15.80276 93.93396 4.436204 89.28068 7.327820 4.653282       8.566029 
1 1 1 12  4  27 o 37.86138 5.256518 17.99210       4.719235 20.79640       6.531732 14.92942       6.826004 40.38608 6.883435 33.86334 8.330119 6.522736       10.80614 
1 1 1 12  4  28 o 106.1190 3.808822 138.3596       9.833652 139.0838       11.71225 136.6292       18.10323 106.2133 4.535511 104.3652 7.161506 1.848083       8.476912 
1 1 1 12  4  29 o 89.12666 3.328473 97.55318       7.216475 98.46719       10.06518 96.58633       10.35214 89.21421 4.645691 88.30204 4.829249 0.9121704      6.701052 
1 1 1 12  4  30 f 42.58603 4.721980 22.71558       4.818097 21.29943       6.586401 24.34573       7.066545 40.60614 6.902939 43.47614 6.900142 -2.869995      9.760252 
1 1 1 12  4  31 o 37.03941 6.247580 17.73552       5.438709 27.05852       8.828598 12.03361       6.904367 45.10797 8.338684 30.01016 8.842918 15.09781       12.15446 
1 1 1 12  4  32 o 41.82940 5.642301 22.47178       5.604874 11.63327       8.798316 29.87438       7.271208 29.61863 10.13426 48.01616 6.371257 -18.39753      11.97064 
1 1 1 12  4  33 o 35.76775 7.882679 17.59955       6.685198 0.000000       0.000000 17.59955       6.685198 ?        ?        35.76775 7.882679 0.000000       7.882679 
1 1 1 12  4  34 o 18.58948 6.868567 3.942249       4.115282 1.738631       5.743678 6.266828       5.899213 18.16855 7.641127 22.45277 8.236021 -4.284216      11.23472 
1 1 1 12  4  35 o 10.88010 5.181784 -4.232619      3.784572 -3.822806      5.478345 -4.606743      5.234373 13.96299 6.520497 13.19769 6.228945 0.7653008      9.017573 
1 1 1 12  4  36 o 27.81915 6.538442 11.10440       4.357172 8.568929       6.004849 13.92377       6.332110 23.87944 8.361995 29.89685 8.364529 -6.017410      11.82744 
1 1 1 12  4  37 o 11.78033 5.598244 -3.901156      4.368793 -5.233416      5.331883 -1.179439      7.620924 12.60436 6.042897 17.02938 7.861753 -4.425024      9.915834 
1 1 1 12  4  38 o 39.11475 4.917940 21.30196       4.584326 26.79119       6.508410 15.89691       6.458312 42.01113 6.572602 29.94270 8.472311 12.06843       10.72283 
1 1 1 12  4  39 o 13.79739 6.397459 -0.9542835     5.128249 -0.9542835     5.128249 0.000000       0.000000 13.79739 6.397459 ?        ?        0.000000       6.397459 
1 1 1 12  4  40 o 11.10251 5.174973 -1.366225      3.424645 3.890460       4.649494 -7.600186      5.063279 16.38233 6.881473 10.63629 5.263678 5.746037       8.663774 
1 1 1 12  4  41 o 11.46390 5.262131 -0.2703643     3.346129 0.6618272      4.710691 -1.219730      4.753888 13.45696 6.201199 12.45803 5.896695 0.9989309      8.557212 
1 1 1 12  4  42 o 14.74214 6.145889 3.679383       3.666570 3.512689       4.971649 3.878166       5.429125 14.83496 6.650203 15.15584 6.857717 -0.3208790     9.552669 
1 1 1 12  4  43 o 14.19882 6.171956 3.561435       3.978700 1.147483       5.647058 5.940941       5.606624 13.25528 6.317669 15.79678 7.073199 -2.541509      9.483832 
1 1 1 12  5  0  o 290.0823 4.062350 1025.660       28.71671 1016.157       45.08332 1032.147       37.25142 288.6588 6.409069 290.9634 5.253737 -2.304596      8.287214 
1 1 1 12  5  1  o 526.0262 6.867738 3375.044       88.03536 3285.934       136.4794 3438.542       115.2077 518.6327 10.79869 530.7604 8.907320 -12.12769      13.99829 
1 1 1 12  5  2  o 243.0780 3.564660 720.1568       21.11543 723.2071       33.35427 718.1168       27.27744 243.5383 5.620153 242.7091 4.611917 0.8292084      7.270206 
1 1 1 12  5  3  o 199.6512 3.934942 485.8666       19.14460 439.5117       30.34612 516.5137       24.67455 189.7096 6.574075 205.8293 4.919330 -16.11971      8.210863 
1 1 1 12  5  4  o 401.0207 5.343733 1960.970       52.22129 1944.098       66.76656 1987.554       83.80972 399.1930 6.863411 403.4923 8.523599 -4.299316      10.94341 
1 1 1 12  5  5  f 79.98409 2.172106 78.01770       4.229787 85.39230       5.531033 67.62975       6.564506 83.66251 2.716535 74.39884 3.631733 9.263664       4.535311 
1 1 1 12  5  6  o 240.9906 3.995114 707.9954       23.46202 663.3404       31.47201 763.8588       35.20084 233.2114 5.537817 250.2473 5.772281 -17.03595      7.999166 
1 1 1 12  5  7  o 217.1701 3.736335 574.9465       19.77342 570.9894       27.28152 579.3259       28.70006 216.3708 5.174087 217.9349 5.404057 -1.564117      7.481645 
1 1 1 12  5  8  o 359.1319 5.483794 1573.473       47.99226 1547.473       66.65838 1601.455       69.15296 355.9373 7.685021 362.0744 7.837487 -6.137085      10.97660 
1 1 1 12  5  9  o 161.2263 3.191029 316.8772       12.53726 311.0746       16.97572 323.8399       18.59553 159.6496 4.367496 162.8744 4.689990 -3.224777      6.408668 
1 1 1 12  5  10 o 441.2924 7.594216 2380.361       81.66680 2428.611       100.9349 2288.898       138.9680 445.3888 9.299641 431.1370 13.24276 14.25180       16.18190 
1 1 1 12  5  11 o 259.4871 5.990596 822.3086       37.88104 786.6353       51.09245 865.8575       56.45127 253.3976 8.285188 265.7867 8.727577 -12.38907      12.03391 
1 1 1 12  5  12 o 224.7637 4.369735 616.4178       23.93411 617.6589       28.83788 613.6707       42.90562 224.9181 5.261419 223.7682 7.880580 1.149872       9.475552 
1 1 1 12  5  13 o 152.4517 3.508292 283.4876       13.03359 279.3700       15.41823 293.7971       24.39676 151.2486 4.187215 154.8661 6.478880 -3.617523      7.714185 
1 1 1 12  5  14 o 198.3667 3.484215 480.0311       16.84262 479.7079       23.54010 480.3700       24.10818 198.1852 4.874174 198.2479 4.994199 -0.6268311E-01 6.978509 
1 1 1 12  5  15 o 89.06472 2.464621 96.79368       5.344096 94.83370       6.856635 99.82692       8.529802 88.11356 3.198552 90.35518 3.882976 -2.241623      5.030729 
1 1 1 12  5  16 o 69.96397 2.823982 59.79906       4.804842 60.30428       6.779311 59.28912       6.810946 70.16914 3.980967 69.56918 4.034800 0.5999680      5.668131 
1 1 1 12  5  17 o 101.2875 2.851355 125.2411       7.030896 121.9314       9.774384 128.7897       10.12105 99.84357 4.025544 102.6147 4.055424 -2.771095      5.714146 
1 1 1 12  5  18 o 88.80880 2.884496 96.32188       6.234270 102.3725       8.893416 90.47594       8.741720 91.46352 3.999779 85.95561 4.185954 5.507904       5.789684 
1 1 1 12  5  19 o 124.7949 2.987116 190.0491       9.084165 186.7614       12.63698 193.5646       13.06775 123.5472 4.203460 125.7716 4.269846 -2.224396      5.991716 
1 1 1 12  5  20 o 207.6505 3.716401 526.7565       18.80579 549.4323       27.02145 505.4565       26.18889 211.8002 5.235355 203.0672 5.296783 8.733063       7.447473 
1 1 1 12  5  21 o 20.17015 7.274071 4.196224       4.574582 -3.216751      7.266337 9.063371       5.887846 17.93892 8.040840 27.01020 8.215109 -9.071287      11.49535 
1 1 1 12  5  22 o 159.6530 3.729343 311.5862       14.50927 303.0323       17.66816 329.3023       25.42694 157.2435 4.615863 163.4919 6.394406 -6.248383      7.886356 
1 1 1 12  5  23 o 64.75896 3.256549 51.36819       5.122684 60.76208       7.305997 42.28371       7.184665 70.32074 4.283761 58.49498 5.090907 11.82576       6.653416 
1 1 1 12  5  24 o 207.2683 3.785203 525.6113       19.11869 514.4402       26.55834 537.6272       27.54443 204.5719 5.331989 209.1073 5.409952 -4.535446      7.595900 
1 1 1 12  5  25 o 164.5778 3.418235 331.2821       13.70911 328.9210       19.09920 333.7914       19.68949 163.6218 4.795199 164.7974 4.908313 -1.175552      6.861886 
1 1 1 12  5  26 o 93.41380 3.271158 106.8772       7.434947 99.49500       9.920545 116.3368       11.22999 89.90662 4.542734 97.19073 4.755972 -7.284111      6.576907 
1 1 1 12  5  27 o 76.52105 3.390471 71.83264       6.306631 76.05215       8.778954 67.33288       9.065808 78.51967 4.608310 73.76691 5.074140 4.752754       6.854445 
1 1 1 12  5  28 o 80.20393 3.388287 78.97121       6.607429 80.77055       9.256443 77.10187       9.434739 80.83184 4.719750 78.91654 4.930615 1.915298       6.825468 
1 1 1 12  5  29 o 93.48105 3.818123 107.5938       8.679499 107.7214       10.32636 107.2867       16.02025 93.33258 4.553979 92.14510 7.191371 1.187485       8.512024 
1 1 1 12  5  30 o 83.33164 3.891915 85.75542       7.881485 84.06886       12.91907 86.75523       9.946969 81.51664 6.558843 83.48978 4.910699 -1.973137      8.193497 
1 1 1 12  5  31 f 119.8155 3.297089 176.8657       9.617599 182.5962       13.41812 170.8112       13.79227 121.1408 4.553431 116.9987 4.847977 4.142097       6.651062 
1 1 1 12  5  32 o 25.09515 7.594278 8.351281       5.040290 1.595040       8.388434 12.16877       6.305464 21.45748 9.138449 29.85754 8.344502 -8.400066      12.37505 
1 1 1 12  5  33 o 43.11805 4.712442 23.69258       4.871024 23.41451       6.773232 23.99045       7.010215 41.87506 6.875938 42.30760 7.047277 -0.4325371     9.845945 
1 1 1 12  5  34 o 18.44514 7.697001 2.108214       5.758948 0.000000       0.000000 2.108214       5.758948 ?        ?        18.44514 7.697001 0.000000       7.697001 
1 1 1 12  5  35 o 12.92567 5.770246 -0.8594852     3.701519 3.874369       5.130511 -5.998555      5.345588 19.07625 7.512641 12.70578 6.080585 6.370473       9.665055 
1 1 1 12  5  36 o 9.267910 4.597973 -8.480566      3.954792 -5.132087      4.919755 -14.59615      6.648732 12.23920 5.850810 11.61553 5.795001 0.6236620      8.234926 
1 1 1 12  5  37 o 23.21301 6.724816 8.158936       4.022757 -0.4559324     5.430092 18.63832       5.988950 15.16029 6.859168 34.89317 7.279117 -19.73288      10.00169 
1 1 1 12  5  38 o 20.34772 6.714412 6.521912       3.864322 3.334641       5.338176 10.03109       5.601264 17.23904 7.313963 23.85809 8.087436 -6.619051      10.90416 
1 1 1 12  5  39 o 14.40715 6.037282 2.099142       3.565483 -1.673787      4.769079 6.880506       5.368724 12.96238 6.063208 19.84137 7.722813 -6.878992      9.818570 
1 1 1 12  5  40 o 12.73416 5.742769 0.3410882      3.770267 -4.478226      4.598487 10.22488       6.585429 11.11849 5.398947 21.47024 8.494012 -10.35176      10.06463 
1 1 1 12  5  41 o 17.39400 6.299776 5.415864       3.435798 6.278587       4.603249 4.330729       5.162624 17.84388 7.088040 16.08528 7.010720 1.758604       9.969479 
1 1 1 12  5  42 o 14.22400 6.152037 3.127762       3.912956 6.976408       5.576648 -0.6047133     5.491838 17.19126 7.389071 12.82640 6.144969 4.364860       9.610359 
1 1 1 12  5  43 o 14.28290 6.053276 3.706328       3.649915 5.309821       4.848192 1.608579       5.545274 15.49450 6.772755 13.38729 6.345981 2.107205       9.281254 
1 1 1 12  6  0  o 299.5924 5.351852 1094.336       39.07248 1102.421       48.31881 1079.059       66.41537 300.6464 6.595141 297.1649 9.182403 3.481476       11.30542 
1 1 1 12  6  1  o 339.6560 5.181624 1406.568       42.88855 1378.155       59.78715 1436.689       61.55878 336.1029 7.299607 343.1626 7.361290 -7.059723      10.36691 
1 1 1 12  6  2  o 371.2552 5.600480 1680.697       50.66801 1751.064       73.40402 1616.657       70.02604 378.7975 7.952006 363.9736 7.895026 14.82388       11.20562 
1 1 1 12  6  3  o 251.9831 4.045957 773.9934       24.84442 760.2445       28.07453 823.6409       53.34915 249.7188 4.613442 259.6141 8.443864 -9.895264      9.621989 
1 1 1 12  6  4  o 274.9866 5.002999 922.0198       33.52571 974.5381       42.47845 835.2688       54.59466 282.6573 6.166977 261.4091 8.581879 21.24814       10.56789 
1 1 1 12  6  5  o 447.2447 6.617964 2440.573       72.12830 2457.318       102.2394 2423.981       101.7719 448.4699 9.355110 445.4147 9.376204 3.055206       13.24505 
1 1 1 12  6  6  o 293.3515 4.591043 1049.308       32.81979 1077.220       38.12765 969.4714       64.48335 297.1930 5.264600 281.4828 9.413931 15.71014       10.78601 
1 1 1 12  6  7  o 385.4742 6.673209 1813.677       62.68536 1772.158       74.93970 1910.415       114.3890 380.8813 8.073953 394.6885 11.90668 -13.80722      14.38603 
1 1 1 12  6  8  o 252.9770 4.715400 780.5565       29.06938 791.6307       35.16777 756.6684       51.65111 254.7085 5.665853 248.6469 8.537000 6.061691       10.24609 
1 1 1 12  6  9  f 229.5652 4.388354 642.7616       24.54957 645.0107       29.45436 637.6442       44.42942 229.9168 5.257057 228.2475 8.000193 1.669281       9.572864 
1 1 1 12  6  10 o 299.1240 4.695689 1091.629       34.22840 1079.691       47.08717 1105.004       49.84282 297.3066 6.499231 300.7358 6.801134 -3.429230      9.407202 
1 1 1 12  6  11 o 282.1564 5.145223 971.7830       35.37775 964.7123       42.50726 987.7200       63.81701 281.0128 6.207275 283.7444 9.241721 -2.731598      11.13282 
1 1 1 12  6  12 o 332.1349 5.112598 1346.895       41.38018 1389.584       59.64904 1307.290       57.45350 337.0029 7.263296 326.8811 7.212579 10.12180       10.23605 
1 1 1 12  6  13 o 129.4504 2.847368 204.3315       8.982208 203.2146       12.70214 205.4486       12.70338 128.9842 4.046150 129.6937 4.024299 -0.7094879     5.706690 
1 1 1 12  6  14 f 94.68848 2.678632 109.4138       6.174611 107.7432       8.727590 111.0881       8.736855 93.88642 3.822650 95.33923 3.767936 -1.452805      5.367494 
1 1 1 12  6  15 o 45.95089 3.390372 25.90148       3.769711 25.31272       4.147643 28.69764       9.038837 45.38440 3.784655 47.70980 8.061339 -2.325397      8.905549 
1 1 1 12  6  16 o 48.42285 3.855349 28.80471       4.511822 27.19166       5.123860 34.37259       9.519601 46.96187 4.533590 52.37130 7.687877 -5.409435      8.925071 
1 1 1 12  6  17 o 159.1594 3.175673 309.0945       12.31698 318.2622       17.56484 300.2254       17.27641 161.3279 4.472165 156.6788 4.529635 4.649063       6.365364 
1 1 1 12  6  18 o 42.32429 3.606601 22.02898       3.684433 22.77116       5.123253 21.23395       5.302520 42.85929 4.999044 41.30591 5.396802 1.553387       7.356352 
1 1 1 12  6  19 o 56.75367 3.142996 39.43404       4.329867 33.24784       5.843458 46.96589       6.447758 51.93063 4.667271 61.83603 4.305789 -9.905399      6.350058 
1 1 1 12  6  20 o 96.10950 3.228603 112.9037       7.550925 112.5890       9.383721 113.4816       12.71833 95.89180 4.024613 96.07658 5.454618 -0.1847763     6.778670 
1 1 1 12  6  21 o 35.95550 4.228693 16.02858       3.634409 15.87790       4.959980 16.20327       5.340781 35.49437 5.944356 35.78968 6.356514 -0.2953072     8.702910 
1 1 1 12  6  22 o 72.21381 3.684183 63.91123       6.461896 57.93318       11.30879 66.80932       7.873945 68.23022 6.896030 73.74751 4.401383 -5.517288      8.180917 
1 1 1 12  6  23 o 108.6058 3.058716 144.1908       8.087153 148.8155       11.44989 139.5871       11.42407 110.1650 4.273131 106.6680 4.404394 3.497002       6.136639 
1 1 1 12  6  24 o 59.85835 3.484270 43.96082       5.060473 52.46801       7.226079 35.77318       7.089067 65.26234 4.572573 53.67180 5.497699 11.59054       7.150743 
1 1 1 12  6  25 o 81.18008 3.191665 80.69495       6.301671 87.21296       8.942909 74.26655       8.881228 84.22304 4.372212 77.64329 4.716133 6.579750       6.431030 
1 1 1 12  6  26 o 110.8250 3.133090 150.3365       8.452991 140.5548       11.55599 161.5936       12.39693 106.9070 4.445430 114.6417 4.445898 -7.734680      6.287118 
1 1 1 12  6  27 o 60.83885 3.562105 45.50113       5.257989 43.40735       7.242258 47.83487       7.645998 59.14604 5.073695 62.10457 5.096939 -2.958527      7.191743 
1 1 1 12  6  28 o 44.91168 4.306491 25.03564       4.655552 19.65505       6.232224 31.82911       7.002839 39.17574 6.773104 50.35109 5.813939 -11.17535      8.926188 
1 1 1 12  6  29 f 156.3223 3.945219 300.8560       15.01692 301.9515       24.78255 300.2204       18.87723 155.1970 6.567641 155.6799 4.982292 -0.4829407     8.243612 
1 1 1 12  6  30 o 92.08409 3.822037 104.6764       8.557963 110.5168       10.09419 89.74836       16.13799 94.42546 4.398874 83.40652 8.039364 11.01894       9.164140 
1 1 1 12  6  31 o 38.24225 5.947022 18.83645       5.362109 25.23872       9.434226 15.78131       6.517105 43.00117 9.275902 34.29089 7.953551 8.710274       12.21889 
1 1 1 12  6  32 o 60.59814 3.756547 45.71717       5.520058 51.38765       7.614745 39.43711       8.013599 63.77928 4.937794 55.33003 6.041389 8.449253       7.802576 
1 1 1 12  6  33 o 20.38593 6.889715 5.251348       4.064909 8.210698       5.487946 1.654280       6.050425 24.70411 7.992211 18.63500 7.840217 6.069103       11.19573 
1 1 1 12  6  34 o 27.65622 6.803760 10.60013       4.553402 14.93770       5.621888 2.328280       7.763553 32.71073 7.243921 20.54808 8.772534 12.16265       11.37681 
1 1 1 12  6  35 o 21.52041 7.429998 6.339016       4.732462 9.987316       8.209848 4.523500       5.791485 25.99437 9.683198 20.14911 7.967376 5.845261       12.53967 
1 1 1 12  6  36 o 22.65939 6.703827 7.486790       3.961475 7.628204       5.299229 7.307653       5.964298 22.64065 7.860023 22.36273 8.267766 0.2779140      11.40771 
1 1 1 12  6  37 o 14.04474 5.937821 1.267903       3.497785 6.447916       5.051321 -3.503820      4.848162 20.64447 7.612932 12.63936 5.974261 8.005116       9.677217 
1 1 1 12  6  38 o 35.69712 5.101506 18.05866       4.311739 12.48074       5.888623 24.50574       6.330800 26.33339 8.252006 39.67929 6.791267 -13.34590      10.68723 
1 1 1 12  6  39 o 12.91070 5.646672 0.8102959      3.374366 7.624754       4.842388 -5.622249      4.704737 20.69405 7.481163 11.02143 5.376250 9.672619       9.212592 
1 1 1 12  6  40 o 21.93443 6.462904 8.294885       3.688069 7.438392       4.899451 9.414769       5.602372 19.64127 7.445265 21.23660 7.980966 -1.595331      10.91457 
1 1 1 12  6  41 o 15.41954 6.595243 3.794369       4.402731 4.587337       5.564211 2.466585       7.200108 16.21332 7.165105 15.47332 7.303752 0.7400064      10.23150 
1 1 1 12  6  42 o 10.56507 4.994620 -1.195127      3.391121 -2.906953      4.568476 0.9054943      5.060756 11.05902 5.372663 13.22038 6.203746 -2.161363      8.206825 
1 1 1 12  6  43 o 10.48320 4.981888 -1.101253      3.459985 0.7661560      4.632594 -3.457101      5.203293 12.50742 5.889886 11.15133 5.483621 1.356086       8.047413 
1 1 1 12  7  0  o 227.4830 3.785141 630.7478       20.98298 641.1277       30.17498 621.0292       29.19798 229.3058 5.400025 225.6856 5.309000 3.620163       7.572698 
1 1 1 12  7  1  o 539.3263 7.036032 3548.589       92.47312 3593.108       147.3621 3519.670       118.7687 542.1835 11.15330 536.9000 9.077635 5.283508       14.38053 
1 1 1 12  7  2  o 219.6226 3.681044 587.9196       19.70081 603.2694       38.31764 582.4039       22.96925 222.2496 7.083972 218.5751 4.312310 3.674438       8.293291 
1 1 1 12  7  3  o 423.7600 6.301497 2190.490       65.07285 2303.894       133.3222 2155.024       74.55685 433.6651 12.62917 420.2354 7.280460 13.42966       14.57741 
1 1 1 12  7  4  o 96.55587 2.923655 113.7304       6.871322 103.0624       10.19513 122.6098       9.301299 91.82692 4.570394 100.2184 3.815524 -8.391441      5.953714 
1 1 1 12  7  5  o 652.9499 9.424129 5210.607       149.9537 5352.635       215.4968 5077.276       208.7950 660.7684 13.38306 643.5682 13.31341 17.20013       18.87733 
1 1 1 12  7  6  o 52.07247 2.907536 33.15229       3.674865 31.27170       3.916513 46.99661       10.62645 50.55019 3.195725 61.62641 7.212216 -11.07622      7.888518 
1 1 1 12  7  7  o 516.5205 8.728361 3261.440       109.8642 3272.789       134.0949 3238.268       191.6141 517.0052 10.64342 512.7001 15.35386 4.305054       18.68217 
1 1 1 12  7  8  o 150.4978 2.699411 276.0718       9.900003 271.6692       12.06067 285.1657       17.33365 149.2794 3.315397 152.8316 4.659599 -3.552170      5.718716 
1 1 1 12  7  9  o 226.9237 3.420828 627.8412       18.91678 621.4431       23.62207 639.2798       31.58486 225.7220 4.294455 228.8513 5.663560 -3.129318      7.107620 
1 1 1 12  7  10 o 62.20360 2.480530 47.23861       3.752532 48.95283       4.249873 41.17345       7.993980 63.30938 2.761325 57.78582 5.753181 5.523556       6.381536 
1 1 1 12  7  11 o 353.8182 5.388700 1528.597       46.46227 1521.248       53.13491 1552.468       95.76525 352.8483 6.179535 355.1836 11.07772 -2.335327      12.68473 
1 1 1 12  7  12 o 186.4829 3.354521 424.1299       15.24423 420.3781       17.19542 437.9046       32.94813 185.6311 3.801247 189.0317 7.165506 -3.400681      8.111347 
1 1 1 12  7  13 o 234.6454 3.463953 671.6392       19.80707 702.3617       26.09172 629.8546       30.42858 239.8598 4.463845 227.0284 5.500034 12.83150       7.083523 
1 1 1 12  7  14 o 38.22333 3.219666 17.94791       2.971137 26.52314       4.535939 11.50384       3.932101 46.43938 4.048590 30.20530 5.546345 16.23408       6.866806 
1 1 1 12  7  15 o 202.3210 3.557508 499.5235       17.53973 499.8170       24.76648 499.2281       24.84355 202.2258 5.025643 202.1043 5.044312 0.1214600      7.120546 
1 1 1 12  7  16 o 158.9510 3.138556 308.2489       12.15708 311.9337       17.24321 304.6070       17.14265 159.7332 4.434117 157.8414 4.461253 1.891800       6.290006 
1 1 1 12  7  17 o 59.72681 3.591728 43.70389       5.203525 42.24379       5.946919 48.47332       10.74816 58.65817 4.187876 62.43475 7.195812 -3.776581      8.325745 
1 1 1 12  7  18 o 213.2036 5.245526 556.3515       27.25334 556.3515       27.25334 0.000000       0.000000 213.2036 5.245526 ?        ?        0.000000       5.245526 
1 1 1 12  7  19 o 185.4595 3.907584 420.2505       17.66012 434.9262       22.24548 395.2368       29.04235 188.4680 4.847620 179.2631 6.659789 9.204895       8.237245 
1 1 1 12  7  20 o 124.4888 2.969664 189.1656       9.008942 184.7028       12.50677 193.9785       12.98799 122.8332 4.184347 125.8754 4.240190 -3.042183      5.957178 
1 1 1 12  7  21 o 46.56624 3.535771 26.64594       3.982292 24.49626       5.489596 29.03376       5.785684 44.41186 5.168779 48.43074 4.972838 -4.018887      7.172544 
1 1 1 12  7  22 o 37.80321 4.082489 17.68531       3.701300 16.10560       5.079089 19.47421       5.404951 35.71572 6.051507 39.40460 5.802217 -3.688877      8.383701 
1 1 1 12  7  23 o 32.17229 4.911541 12.97976       3.728812 15.18182       5.122046 10.49686       5.438876 34.58871 6.309169 28.62766 7.650146 5.961052       9.916166 
1 1 1 12  7  24 o 37.17760 5.673284 17.38375       4.977318 21.66387       9.648424 15.83169       5.810091 40.77938 9.825863 35.18192 7.022976 5.597458       12.07766 
1 1 1 12  7  25 o 46.48124 3.889385 26.64410       4.365142 25.13118       5.938991 28.42171       6.437596 44.84660 5.552866 47.71402 5.645835 -2.867424      7.918951 
1 1 1 12  7  26 o 50.51350 3.760475 31.43410       4.595781 28.31979       6.303435 34.96826       6.714891 47.61407 5.535662 53.02907 5.265724 -5.415001      7.640118 
1 1 1 12  7  27 o 96.43159 3.121983 113.9197       7.326781 112.4073       10.18398 115.5424       10.54892 95.53753 4.385991 96.84066 4.482224 -1.303131      6.271144 
1 1 1 12  7  28 o 70.50256 3.908033 61.25066       6.688007 59.08617       10.35313 62.80077       8.761424 68.64207 6.258104 71.11819 5.089065 -2.476120      8.066129 
1 1 1 12  7  29 o 51.45137 3.904525 32.76111       4.858997 33.07682       6.480954 32.35585       7.342777 51.38459 5.249381 50.58236 6.078621 0.8022308      8.031540 
1 1 1 12  7  30 o 112.7886 3.872886 157.1018       10.62897 151.8325       18.06795 159.8904       13.14395 109.3619 6.813485 113.3981 4.767095 -4.036163      8.315574 
1 1 1 12  7  31 o 51.21208 4.755546 32.98169       5.867034 30.36310       6.605294 42.77094       12.77122 48.80471 5.658599 55.92609 9.723730 -7.121387      11.25036 
1 1 1 12  7  32 o 36.23663 5.064894 16.83233       4.350534 16.39722       5.714568 17.43219       6.709718 35.04958 6.936232 35.75272 7.910881 -0.7031441     10.52109 
1 1 1 12  7  33 o 41.45198 5.036774 22.13315       4.983554 27.86289       6.113447 10.78382       8.604067 46.33117 5.523370 28.02771 9.991627 18.30346       11.41666 
1 1 1 12  7  34 o 27.06836 6.216946 10.02872       4.014338 9.107680       5.080445 11.55950       6.549664 25.38757 7.611614 28.11393 8.686010 -2.726357      11.54917 
1 1 1 12  7  35 f 19.56705 6.690620 5.127116       3.834707 9.940334       5.074647 -1.279858      5.854833 26.03513 7.556177 15.77854 7.132225 10.25659       10.39059 
1 1 1 12  7  36 o 12.69365 5.881395 -2.342821      4.322374 1.578149       7.699988 -4.146829      5.222910 18.86060 8.376976 13.08719 6.190400 5.773407       10.41608 
1 1 1 12  7  37 o 9.324586 4.516664 -4.333836      3.166863 -1.928411      4.276828 -7.253635      4.711967 12.62547 5.849984 10.78215 5.285039 1.843320       7.883778 
1 1 1 12  7  38 o 12.98729 5.691096 0.5743460      3.442278 1.590180       4.854688 -0.4528057     4.881656 15.37663 6.747737 14.01090 6.402906 1.365734       9.302105 
1 1 1 12  7  39 o 13.29499 5.786585 1.109722       3.506872 0.7794906      4.789636 1.491329       5.148746 14.35676 6.473780 15.13654 6.777846 -0.7797823     9.372782 
1 1 1 12  7  40 o 11.69937 5.414257 -0.7558526     3.646792 -3.878526      5.693455 1.416567       4.748807 12.47625 6.046312 14.27273 6.440075 -1.796476      8.833598 
1 1 1 12  7  41 o 10.30410 4.996210 -3.381555      3.900548 1.414387       4.645377 -14.84486      7.181891 13.66296 6.244709 10.72432 5.434592 2.938636       8.278356 
1 1 1 12  7  42 o 13.42924 5.934286 2.353944       3.816059 2.630133       4.511907 1.659903       7.152348 13.92819 6.281656 14.33984 6.906796 -0.4116564     9.336115 
1 1 1 12  8  0  o 577.2030 7.505099 4065.495       105.5653 4086.773       167.7288 4051.538       135.8457 578.0560 11.90698 575.9257 9.679288 2.130310       15.34486 
1 1 1 12  8  1  o 379.7589 5.120809 1758.487       47.38956 1762.774       75.08675 1755.649       61.09449 380.0125 8.108293 379.3602 6.608672 0.6522827      10.46035 
1 1 1 12  8  2  o 348.2228 5.315717 1478.707       45.10816 1308.604       83.56677 1548.648       53.58521 327.0205 10.49991 356.3113 6.171337 -29.29080      12.17923 
1 1 1 12  8  3  o 165.4405 3.182743 333.6026       12.83156 296.1933       24.13488 348.3436       15.15019 155.6835 6.375085 169.0471 3.677682 -13.36356      7.359827 
1 1 1 12  8  4  o 418.7131 5.081787 2138.096       51.85243 2133.802       72.81662 2142.512       73.85525 418.1100 7.146671 418.9535 7.234016 -0.8434448     10.16887 
1 1 1 12  8  5  o 281.5995 3.627100 966.6904       24.89015 972.6709       34.85874 960.4699       35.55145 282.4019 5.065332 280.6178 5.198834 1.784088       7.258475 
1 1 1 12  8  6  o 158.1334 3.037322 304.8062       11.70444 312.7870       13.25058 276.4703       24.96788 160.1824 3.394564 150.3298 6.833414 9.852615       7.630113 
1 1 1 12  8  7  o 92.42130 2.366890 104.1720       5.326338 108.4073       6.300572 93.56461       9.971142 94.26793 2.745636 87.45830 4.695729 6.809631       5.439521 
1 1 1 12  8  8  o 228.6991 3.799709 637.7819       21.17633 644.7574       24.15304 614.5992       44.03161 229.9207 4.310799 224.0542 8.077680 5.866455       9.155976 
1 1 1 12  8  9  o 214.0656 3.284736 558.7097       17.13497 551.0474       21.28494 572.8196       28.88387 212.5531 4.109310 216.5559 5.477697 -4.002838      6.847744 
1 1 1 12  8  10 o 416.1784 5.570481 2114.966       56.49478 2074.050       71.35452 2183.704       92.48579 411.8536 7.109556 422.1571 8.990106 -10.30350      11.46158 
1 1 1 12  8  11 o 194.3363 3.419248 460.5963       16.19275 468.5820       18.49672 434.3974       33.50260 195.9879 3.872839 188.2736 7.316114 7.714294       8.277947 
1 1 1 12  8  12 o 198.7405 3.473994 481.7899       16.82486 497.6965       19.36218 432.7496       33.99707 201.9632 3.934106 187.8383 7.441864 14.12492       8.417750 
1 1 1 12  8  13 o 223.6078 3.765232 610.1210       20.51705 601.9865       23.13864 640.0407       44.37617 222.0651 4.275838 228.3040 7.988586 -6.238861      9.060922 
1 1 1 12  8  14 o 50.98643 2.390717 31.76527       2.962155 30.14002       3.774279 34.37192       4.779863 49.60883 3.138126 52.93987 3.728925 -3.331047      4.873676 
1 1 1 12  8  15 o 77.92627 2.281748 74.10210       4.328322 77.07896       5.578009 69.59722       6.861860 79.44221 2.886118 75.41838 3.745324 4.023827       4.728333 
1 1 1 12  8  16 o 213.1100 3.604967 554.3619       18.72152 550.4064       21.70951 565.8379       36.97806 212.2807 4.196657 214.6412 7.079287 -2.360458      8.229716 
1 1 1 12  8  17 o 283.5201 5.191782 983.4619       35.87041 967.1313       43.84850 1016.500       62.36785 280.8555 6.406721 286.9599 8.929605 -6.104462      10.99017 
1 1 1 12  8  18 o 154.5802 3.107613 291.6272       11.70623 276.8047       16.04395 308.5015       17.11845 150.4154 4.381734 158.7941 4.428108 -8.378723      6.229586 
1 1 1 12  8  19 o 216.4362 4.404260 572.8518       23.22945 571.0165       27.85586 577.0421       42.09062 215.9152 5.294162 216.1840 8.003428 -0.2687988     9.595989 
1 1 1 12  8  20 o 75.68633 2.846293 70.01392       5.240330 67.55306       7.135154 72.89577       7.721409 74.23375 3.958576 77.10210 4.124560 -2.868355      5.716845 
1 1 1 12  8  21 o 44.73312 3.473095 24.59538       3.756370 23.83760       5.055635 25.52930       5.612517 43.85606 4.809329 45.34624 5.171347 -1.490177      7.062045 
1 1 1 12  8  22 o 96.50543 2.912795 113.8260       6.842274 118.2960       9.541787 109.0944       9.816952 98.25321 3.993492 94.30704 4.282836 3.946175       5.855823 
1 1 1 12  8  23 o 57.27168 3.277522 40.21609       4.555168 43.86778       6.282568 36.16874       6.614176 59.68847 4.349116 54.05474 5.080752 5.633720       6.687963 
1 1 1 12  8  24 o 66.46545 3.116304 54.10896       5.033394 55.41320       6.953700 52.67349       7.295159 67.11123 4.274126 65.37207 4.608919 1.739159       6.285721 
1 1 1 12  8  25 o 57.51293 4.220354 40.77382       5.873756 55.23598       11.79604 36.00572       6.773167 66.28804 7.430104 53.85197 5.226904 12.43607       9.084435 
1 1 1 12  8  26 o 29.94852 5.637235 11.41987       3.963198 14.55709       6.024690 9.026651       5.262025 33.53829 7.553662 26.59769 7.686993 6.940599       10.77718 
1 1 1 12  8  27 o 64.85029 3.685714 51.73657       5.800668 48.72240       8.974266 53.89952       7.602181 62.43826 5.970743 65.98983 4.759404 -3.551575      7.635554 
1 1 1 12  8  28 o 145.4570 3.258198 259.3575       11.54910 256.6927       15.84058 262.3815       16.87416 144.2417 4.512098 145.7319 4.757886 -1.490158      6.557172 
1 1 1 12  8  29 o 79.86661 4.011170 78.78599       7.781798 77.68002       13.34503 79.35580       9.578968 78.20109 7.079393 79.87688 4.945344 -1.675789      8.635638 
1 1 1 12  8  30 o 94.90299 3.176674 110.8307       7.336284 116.3342       9.957366 104.2959       10.85018 96.86900 4.228351 91.44501 4.886758 5.423988       6.462148 
1 1 1 12  8  31 o 83.45462 3.236583 85.98544       6.569754 90.13160       8.902878 81.02817       9.734832 85.02004 4.311148 80.28358 5.000659 4.736458       6.602468 
1 1 1 12  8  32 o 33.59518 6.795680 15.09609       5.372134 15.09609       5.372134 0.000000       0.000000 33.59518 6.795680 ?        ?        0.000000       6.795680 
1 1 1 12  8  33 o 18.33863 6.547980 3.989654       3.696722 5.303604       4.751404 1.974399       5.884338 20.77369 7.422840 18.58419 7.769545 2.189507       10.74543 
1 1 1 12  8  34 o 44.45979 4.254852 25.31592       4.553682 31.83144       6.084809 17.02155       6.865373 49.37637 5.131753 34.08627 8.335566 15.29010       9.788592 
1 1 1 12  8  35 o 32.80600 5.109896 14.40692       3.952080 14.43557       5.143878 14.36565       6.174341 31.77007 6.846201 30.79695 8.114832 0.9731255      10.61701 
1 1 1 12  8  36 o 23.11817 6.470372 7.847195       3.788253 6.716950       5.114452 9.220983       5.638620 21.35139 7.692465 24.18921 8.114259 -2.837828      11.18102 
1 1 1 12  8  37 o 42.81367 5.356444 25.76996       5.466546 33.90502       10.66493 22.87100       6.366484 41.82906 10.48429 38.55910 7.034544 3.269962       12.62558 
1 1 1 12  8  38 o 7.610579 3.822669 -8.180793      3.130062 -3.360893      4.272764 -13.76310      4.598292 11.53498 5.497094 8.614928 4.363765 2.920049       7.018582 
1 1 1 12  8  39 o 11.78612 5.416481 -0.7946839     3.559823 0.6865746      5.344598 -1.975816      4.772532 14.69564 6.709661 12.64424 5.961649 2.051402       8.975567 
1 1 1 12  8  40 o 23.83972 6.249671 9.661549       3.674364 7.811036       4.993395 11.84677       5.426219 19.68412 7.503367 23.75190 7.959869 -4.067785      10.93892 
1 1 1 12  8  41 o 14.61277 5.978899 3.401989       3.383321 3.765840       4.663763 2.997776       4.915644 15.21867 6.647637 14.73130 6.607495 0.4873714      9.372837 
1 1 1 12  8  42 o 10.70902 5.011211 -0.6070540     3.263201 3.731436       4.341393 -6.241537      4.947511 14.62471 6.400394 10.22239 5.083520 4.402319       8.173569 
1 1 1 12  9  0  o 409.9438 5.481877 2049.467       54.76332 1940.200       83.69637 2131.266       72.41650 398.6058 8.616421 417.9180 7.110668 -19.31216      11.17159 
1 1 1 12  9  1  f 487.2571 6.398643 2896.516       75.97701 3001.308       122.6621 2831.285       96.77676 495.5135 10.15825 481.5366 8.247184 13.97696       13.08457 
1 1 1 12  9  2  o 365.4308 5.543242 1628.766       49.36341 1697.703       101.3086 1607.304       56.52785 372.3379 11.17803 362.9544 6.391081 9.383484       12.87611 
1 1 1 12  9  3  o 483.9090 6.363937 2857.336       75.04568 2944.669       120.5984 2802.147       95.86867 490.7131 10.08504 478.9826 8.213360 11.73050       13.00644 
1 1 1 12  9  4  o 539.9645 6.429014 3558.238       84.59520 3563.824       119.3200 3552.592       119.9538 539.9591 9.068101 539.0956 9.130872 0.8635254      12.86869 
1 1 1 12  9  5  f 135.0490 2.589984 222.2869       8.523628 234.7231       10.57011 199.1642       14.41300 138.7662 3.125790 127.7075 4.638997 11.05869       5.593822 
1 1 1 12  9  6  f 226.2910 3.405441 624.2822       18.77918 643.2793       23.96235 594.0411       30.23315 229.6714 4.281406 220.5649 5.629449 9.106461       7.072562 
1 1 1 12  9  7  o 204.0015 3.184862 507.3486       15.83288 487.1585       19.30646 548.8142       27.66799 199.8716 3.963833 212.0024 5.359808 -12.13077      6.666297 
1 1 1 12  9  8  f 99.46842 2.407503 120.5943       5.835637 126.4775       6.861397 105.2114       11.09498 101.8226 2.767804 92.72662 4.927746 9.095970       5.651851 
1 1 1 12  9  9  o 188.2711 3.332319 432.2134       15.28855 439.2404       17.35790 407.9007       32.28709 189.7764 3.753349 182.4994 7.274488 7.277039       8.185707 
1 1 1 12  9  10 o 179.4274 3.354219 392.6074       14.66616 369.5490       19.08939 425.8257       22.91216 173.9602 4.506839 186.6951 5.040743 -12.73488      6.761707 
1 1 1 12  9  11 o 341.4339 6.073519 1425.006       50.53393 1387.701       60.25302 1513.480       92.79077 336.6853 7.343762 350.4697 10.87788 -13.78436      13.12475 
1 1 1 12  9  12 o 225.8169 4.413527 622.5184       24.28725 625.5420       29.21176 615.7485       43.71011 226.2691 5.297810 223.9510 8.022226 2.318039       9.613684 
1 1 1 12  9  13 o 219.0248 4.194001 585.6399       22.38504 585.6399       22.38504 0.000000       0.000000 219.0248 4.194001 ?        ?        0.000000       4.194001 
1 1 1 12  9  14 o 103.4809 2.854848 130.7026       7.192240 130.7026       7.192240 0.000000       0.000000 103.4809 2.854848 ?        ?        0.000000       2.854848 
1 1 1 12  9  15 o 161.8711 2.734267 319.5742       10.78565 316.8387       13.69648 324.0397       17.49935 161.1271 3.488223 162.8102 4.414741 -1.683090      5.626512 
1 1 1 12  9  16 o 142.6445 2.596209 248.1630       9.024656 259.6751       11.73751 231.5166       14.11422 145.8719 3.301933 137.6044 4.214061 8.267578       5.353603 
1 1 1 12  9  17 o 176.2344 2.914233 378.9475       12.51558 386.3798       16.17883 367.8720       19.74996 177.8767 3.732432 173.3914 4.678424 4.485291       5.984873 
1 1 1 12  9  18 o 138.6235 2.950394 234.5039       9.966737 248.1135       14.26426 221.5213       13.93181 142.4268 4.114119 134.5532 4.254255 7.873642       5.918164 
1 1 1 12  9  19 o 142.2715 3.001198 247.0647       10.40516 253.6651       14.67664 240.3945       14.75390 143.9788 4.187489 140.1386 4.325468 3.840210       6.020360 
1 1 1 12  9  20 o 85.91895 3.332230 90.29701       6.963632 92.59898       8.009689 83.17019       14.09336 86.95995 3.788819 81.86967 7.135293 5.090271       8.078834 
1 1 1 12  9  21 o 69.44611 3.447679 59.07333       5.816354 54.00570       6.451496 81.07561       13.44286 66.32891 4.010097 80.83238 6.890109 -14.50347      7.972106 
1 1 1 12  9  22 o 90.77637 2.842616 100.7161       6.280460 100.3178       8.600537 101.1713       9.192843 90.47157 3.910245 90.82079 4.164722 -0.3492203     5.712698 
1 1 1 12  9  23 o 55.40188 3.130265 37.62414       4.208928 33.88125       5.580203 42.56361       6.410429 52.40157 4.410789 58.75975 4.511341 -6.358189      6.309299 
1 1 1 12  9  24 o 46.25657 3.521392 26.32635       3.939562 21.24023       5.146680 33.52330       6.122208 41.24533 5.238563 52.02618 4.886110 -10.78085      7.163561 
1 1 1 12  9  25 o 39.63348 4.359222 19.50337       4.140812 13.51684       5.739678 26.00100       5.979678 32.34696 7.437083 45.62000 5.488956 -13.27304      9.243313 
1 1 1 12  9  26 o 32.01550 6.044839 13.08137       4.543254 14.31379       9.356032 12.70109       5.197141 33.46979 10.38826 31.37030 6.978578 2.099489       12.51465 
1 1 1 12  9  27 o 50.77880 3.529163 31.76450       4.339895 39.11086       6.042520 23.93718       6.237186 56.20537 4.447919 43.53299 6.042076 12.67238       7.502711 
1 1 1 12  9  28 o 93.69734 3.720815 108.0297       8.478850 117.6477       15.63829 104.0252       10.09076 96.75827 6.673184 91.72464 4.528418 5.033630       8.064610 
1 1 1 12  9  29 o 80.82143 3.194917 80.31786       6.280087 81.30602       8.339959 79.02377       9.544104 81.04096 4.237745 79.66707 4.940403 1.373894       6.508923 
1 1 1 12  9  30 f 64.89619 3.401775 52.01170       5.360951 51.78890       7.071663 52.31276       8.220413 64.42440 4.533321 64.48507 5.277283 -0.6066895E-01 6.957063 
1 1 1 12  9  31 o 105.4569 3.497863 137.6414       8.976613 148.6362       11.12378 117.1138       15.19951 109.2285 4.186830 95.39849 6.578384 13.83001       7.797735 
1 1 1 12  9  32 f 35.34534 4.852710 16.02841       4.069551 18.02957       5.126397 12.61830       6.691979 37.12362 5.860898 30.02450 8.666165 7.099123       10.46196 
1 1 1 12  9  33 o 67.21277 3.844316 56.80893       6.270350 57.23484       7.121187 55.33922       13.22836 67.15992 4.374984 62.31344 8.969441 4.846481       9.979548 
1 1 1 12  9  34 o 31.21494 5.236763 12.96189       3.842530 19.03607       4.957272 3.819178       6.081858 37.77855 5.550035 19.88944 8.061499 17.88910       9.787270 
1 1 1 12  9  35 o 14.17447 5.902207 1.236203       3.375736 1.394823       4.253353 0.9662334      5.548954 15.52620 6.555160 16.71950 7.277988 -1.193301      9.794857 
1 1 1 12  9  36 o 24.61757 6.084420 8.805500       3.628886 14.25667       5.044888 2.960775       5.223827 30.87686 6.880767 17.54170 7.326141 13.33516       10.05074 
1 1 1 12  9  37 o 12.60196 5.650155 -0.3031839     3.590483 -0.5446213     5.233140 -0.8844213E-01 4.935353 14.55698 6.643665 14.51010 6.554573 0.4687500E-01  9.332776 
1 1 1 12  9  38 o 20.94596 7.805549 7.753713       5.335609 0.000000       0.000000 7.753713       5.335609 ?        ?        20.94596 7.805549 0.000000       7.805549 
1 1 1 12  9  39 o 16.67633 6.176235 4.344481       3.330955 5.244655       4.531070 3.285943       4.913499 17.77750 7.041673 16.09739 6.927580 1.680109       9.878083 
1 1 1 12  9  40 o 16.98641 6.279573 4.979594       3.440550 3.825896       4.663096 6.358079       5.097173 15.80370 6.774104 18.01986 7.351663 -2.216161      9.996771 
1 1 1 12  9  41 o 13.49370 5.789348 2.389405       3.411787 4.654963       4.521240 -0.6069329     5.199547 15.82680 6.723586 12.78310 6.084045 3.043694       9.067647 
1 1 1 12  9  42 o 10.51138 5.027445 -1.637700      3.642611 -1.880973      4.230546 -0.9403634     7.162589 11.02904 5.312087 13.30204 6.519339 -2.272999      8.409521 
1 1 1 12  10 0  o 316.2324 4.393804 1219.277       33.85971 1203.238       43.54477 1243.807       53.84991 314.0762 5.689378 319.2432 6.921931 -5.166992      8.960032 
1 1 1 12  10 1  o 268.6136 6.066747 880.2994       39.71184 0.000000       0.000000 880.2994       39.71184 ?        ?        268.6136 6.066747 0.000000       6.066747 
1 1 1 12  10 2  o 463.1744 6.863301 2618.605       77.46646 2666.950       110.2690 2571.494       108.8530 467.0174 9.689117 458.5747 9.740788 8.442627       13.73907 
1 1 1 12  10 3  o 399.4372 5.355845 1946.309       52.13299 1881.027       80.28694 1993.900       68.55058 392.3465 8.397288 404.1282 6.960748 -11.78174      10.90718 
1 1 1 12  10 4  o 245.0547 3.594595 732.1191       21.46590 719.0308       33.15862 741.5615       28.16399 242.7546 5.605221 246.5804 4.687049 -3.825745      7.306636 
1 1 1 12  10 5  o 35.48075 2.623274 15.42773       2.252112 15.36994       2.728508 15.55126       3.989234 35.36357 3.200784 35.39162 4.744873 -0.2804184E-01 5.723534 
1 1 1 12  10 6  o 306.0783 3.892028 1142.415       29.02984 1171.540       41.17040 1113.616       40.93936 309.8343 5.452799 302.0679 5.561607 7.766327       7.788742 
1 1 1 12  10 7  o 88.39213 3.102010 95.37089       6.671434 95.44063       7.482152 95.10037       14.73594 88.40393 3.479910 87.95007 6.931509 0.4538574      7.756003 
1 1 1 12  10 8  f 130.3541 3.685357 207.3930       11.69511 220.7612       19.62778 200.0342       14.56247 134.3092 6.012178 127.9512 4.678280 6.357948       7.617913 
1 1 1 12  10 9  o 415.6637 7.300254 2113.613       73.94627 2064.884       125.0849 2139.792       91.68242 409.0622 12.56303 417.7958 9.005046 -8.733612      15.45706 
1 1 1 12  10 10 o 466.2119 14.11411 2695.509       160.1668 2695.509       160.1668 0.000000       0.000000 466.2119 14.11411 ?        ?        0.000000       14.11411 
1 1 1 12  10 11 o 335.8751 10.57564 1390.523       86.45283 1390.523       86.45283 0.000000       0.000000 335.8751 10.57564 ?        ?        0.000000       10.57564 
1 1 1 12  10 12 o 352.1698 11.02732 1532.057       94.51978 1532.057       94.51978 0.000000       0.000000 352.1698 11.02732 ?        ?        0.000000       11.02732 
1 1 1 12  10 13 o 112.3530 4.330580 154.3700       11.83458 171.9962       17.00078 137.7982       16.48441 118.4248 5.909688 105.9002 6.417764 12.52451       8.724225 
1 1 1 12  10 14 o 42.69359 5.874435 22.71982       5.949893 23.86965       8.368800 21.54458       8.460793 43.37701 8.217874 41.09042 8.719785 2.286583       11.98199 
1 1 1 12  10 15 o 41.68400 3.217816 21.32712       3.243351 20.78788       3.459864 25.23554       9.314700 41.12384 3.485258 44.49843 8.901016 -3.374596      9.559032 
1 1 1 12  10 16 o 180.1180 2.895962 395.7982       12.71118 397.2521       16.24827 393.5048       20.40681 180.3762 3.696509 179.3521 4.673073 1.024155       5.958338 
1 1 1 12  10 17 o 128.5101 2.469261 201.4311       7.732862 199.2824       9.771844 205.0311       12.64831 127.7824 3.138118 129.4826 4.013376 -1.700157      5.094603 
1 1 1 12  10 18 o 78.23278 2.276165 74.70768       4.334775 77.94536       5.516061 69.47964       7.009412 79.87236 2.838490 75.31503 3.831716 4.557327       4.768550 
1 1 1 12  10 19 o 11.63222 4.696853 0.7072925      2.055695 1.479457       2.694695 -0.3676774     3.179456 14.04836 5.470408 12.86749 5.555368 1.180879       7.796632 
1 1 1 12  10 20 o 164.0842 3.195509 328.8041       12.77741 330.0442       17.79736 327.4850       18.35554 164.1565 4.453103 163.4877 4.611903 0.6688080      6.410911 
1 1 1 12  10 21 o 107.4567 2.803648 141.0635       7.335371 140.5368       10.05445 141.6628       10.72560 107.1304 3.857620 107.5246 4.100855 -0.3942871     5.630119 
1 1 1 12  10 22 o 74.00771 3.360186 67.07822       6.044244 70.51693       6.869123 55.28451       12.72121 75.84100 3.728157 66.32028 8.034951 9.520714       8.857742 
1 1 1 12  10 23 o 29.82468 4.628014 11.16156       3.254665 9.227599       4.411235 13.47217       4.821685 26.81801 6.754579 32.51727 6.312508 -5.699261      9.245111 
1 1 1 12  10 24 o 50.93258 3.526161 31.89297       4.349553 37.43200       6.301261 26.85186       6.011367 55.01453 4.746548 46.40608 5.417520 8.608444       7.202724 
1 1 1 12  10 25 o 94.81089 2.888680 109.9861       6.666331 108.4686       9.031569 111.8025       9.880795 93.98294 3.952287 95.35865 4.262800 -1.375710      5.813092 
1 1 1 12  10 26 o 78.88779 2.946841 76.22529       5.655077 69.12958       7.428782 86.00342       8.720623 74.93687 4.083477 83.56417 4.296868 -8.627296      5.927720 
1 1 1 12  10 27 o 53.90553 4.336457 35.98559       5.648425 48.99567       11.30545 31.65768       6.520587 62.02819 7.640617 50.30543 5.403683 11.72276       9.358356 
1 1 1 12  10 28 o 47.51606 3.603426 27.89534       4.141353 27.50342       5.486397 28.41439       6.313915 46.91259 4.869891 47.51601 5.557709 -0.6034164     7.389450 
1 1 1 12  10 29 o 81.74254 3.382383 82.29895       6.723072 91.75048       8.503362 66.53923       10.98029 86.11509 4.063516 72.51574 6.275331 13.59935       7.476091 
1 1 1 12  10 30 o 76.16542 3.458285 71.69065       6.402065 73.14816       7.871212 68.84187       11.00442 76.67280 4.229116 73.50359 6.201391 3.169212       7.506176 
1 1 1 12  10 31 o 21.21431 6.282071 5.874421       3.477400 5.534905       4.370993 6.459814       5.739505 21.12088 7.144377 23.06632 8.166897 -1.945436      10.85082 
1 1 1 12  10 32 o 13.02195 5.623546 -0.6647754E-01 3.259674 5.657796       4.166685 -9.096322      5.233239 20.99076 6.973841 11.52360 5.631801 9.467162       8.963907 
1 1 1 12  10 33 o 32.42103 5.030774 13.75476       3.845901 16.09187       4.927984 10.11375       6.150934 34.62305 6.061460 26.62468 8.445889 7.998373       10.39588 
1 1 1 12  10 34 o 21.73321 6.705507 6.578102       3.904959 6.883523       4.354096 5.322583       8.827953 22.17892 7.113767 22.76626 9.517118 -0.5873413     11.88197 
1 1 1 12  10 35 o 24.57747 6.022845 8.572927       3.578586 16.45022       4.626155 -3.163935      5.646870 34.53351 5.695609 14.23244 6.637618 20.30107       8.746309 
1 1 1 12  10 36 o 15.39463 6.089018 2.585952       3.383474 0.2308723      4.423724 5.905648       5.252117 14.38911 6.372388 20.17065 7.693734 -5.781536      9.990039 
1 1 1 12  10 37 o 13.27372 5.785008 0.6969169      3.514832 2.958469       4.927397 -1.645964      5.015213 16.66031 7.045791 13.57010 6.303905 3.090219       9.454226 
1 1 1 12  10 38 o 15.81150 6.097206 3.465832       3.323048 2.727787       4.636854 4.245154       4.764754 15.85521 6.774618 17.27007 7.084014 -1.414853      9.801974 
1 1 1 12  10 39 o 15.54666 6.654460 3.061489       4.488096 -2.947874      8.956543 5.076358       5.186205 15.33938 7.468138 17.48476 7.300838 -2.145372      10.44391 
1 1 1 12  10 40 o 27.91178 5.817770 12.76844       3.828659 10.88884       5.104635 15.18559       5.788743 22.61388 7.719703 26.47821 8.163307 -3.864334      11.23536 
1 1 1 12  10 41 o 10.01938 4.838239 -2.741690      3.564287 -1.292893      4.128641 -6.981144      7.062498 11.43557 5.436637 11.99661 5.983150 -0.5610418     8.084251 
1 1 1 12  10 42 o 12.68846 5.602016 1.963450       3.393549 -3.151066      4.398041 9.489030       5.334909 10.61400 5.181987 18.85298 7.582633 -8.238983      9.184189 
1 1 1 12  11 0  o 105.8904 2.711084 136.7504       6.990017 150.8144       13.57451 131.6755       8.154209 111.0863 5.027531 103.8848 3.224928 7.201485       5.972959 
1 1 1 12  11 1  o 89.76597 2.684658 98.29839       5.866086 105.3910       12.17342 96.15338       6.694618 92.79062 5.407021 88.76238 3.099759 4.028236       6.232526 
1 1 1 12  11 2  o 166.4091 2.824113 337.5300       11.45237 349.0411       18.08259 329.8201       14.79871 169.1242 4.391231 164.4772 3.692173 4.647003       5.737164 
1 1 1 12  11 3  o 18.65931 4.669073 4.413679       2.117708 7.656146       3.378995 2.316229       2.717663 24.55734 5.748524 15.34609 5.596276 9.211245       8.022707 
1 1 1 12  11 4  o 120.0261 3.882971 175.8501       11.34237 0.000000       0.000000 175.8501       11.34237 ?        ?        120.0261 3.882971 0.000000       3.882971 
1 1 1 12  11 5  o 402.9640 5.373803 1981.672       52.76964 2031.344       69.01024 1911.736       81.88585 407.7652 6.944921 395.3164 8.500175 12.44876       10.97656 
1 1 1 12  11 6  o 80.24520 3.050384 78.61685       5.954128 79.73135       6.672225 74.25918       13.19344 80.79357 3.396468 77.63412 7.050621 3.159454       7.826062 
1 1 1 12  11 7  o 269.0118 6.267927 884.0876       41.08954 921.8312       58.89929 848.3032       57.35044 274.1994 8.826196 262.9995 8.961497 11.19989       12.57816 
1 1 1 12  11 8  o 111.4531 4.430006 151.8139       12.00788 160.1775       16.12212 141.3940       17.99529 114.3657 5.803801 107.3110 6.918291 7.054680       9.030330 
1 1 1 12  11 9  o 202.3406 5.301782 500.3726       26.11961 473.5748       35.03886 533.8882       39.18538 196.5693 7.327553 208.6625 7.719566 -12.09315      10.64353 
1 1 1 12  11 10 o 181.7612 6.946390 404.9379       30.71118 404.9379       30.71118 0.000000       0.000000 181.7612 6.946390 ?        ?        0.000000       6.946390 
1 1 1 12  11 11 f 248.9662 5.979108 758.0397       36.27546 762.1546       51.01305 753.8304       51.59438 249.0516 8.417447 247.6503 8.562118 1.401321       12.00680 
1 1 1 12  11 12 o 90.63206 4.401344 100.5398       9.691765 103.2907       13.46589 97.58329       13.95990 91.68363 6.061088 89.04868 6.477367 2.634956       8.870912 
1 1 1 12  11 13 o 68.75743 4.775115 58.04039       7.951203 63.42131       11.25385 52.67693       11.23557 71.66890 6.514806 65.15653 7.195957 6.512367       9.706931 
1 1 1 12  11 14 o 116.0238 4.473929 164.7021       12.62577 170.0830       17.58789 158.9807       18.13577 117.6928 6.153743 113.7131 6.572704 3.979660       9.003833 
1 1 1 12  11 15 f 101.0003 4.471780 124.8982       10.97896 132.0295       15.44341 117.6112       15.61113 103.6323 6.142775 97.72047 6.594215 5.911858       9.012068 
1 1 1 12  11 16 o 168.9806 4.934335 349.5844       20.29720 336.6162       27.89939 364.1656       29.58376 165.4284 6.936064 172.0445 7.071363 -6.616104      9.905209 
1 1 1 12  11 17 o 82.08507 3.080452 82.35139       6.150968 84.30896       12.88792 81.77397       6.999609 82.63326 6.451270 81.75775 3.521505 0.8755035      7.349822 
1 1 1 12  11 18 o 84.79343 2.215219 87.74917       4.573439 83.72180       5.600521 95.81060       7.923622 82.78360 2.780127 88.48209 3.682840 -5.698486      4.614370 
1 1 1 12  11 19 o 239.6699 3.995243 702.2870       23.33419 681.9270       32.22673 724.7242       33.83075 235.7807 5.608823 243.0366 5.712204 -7.255890      8.005509 
1 1 1 12  11 20 o 86.00089 2.617569 90.34669       5.479380 90.92699       7.491383 89.67909       8.035193 86.18293 3.574774 85.55454 3.864022 0.6283875      5.263998 
1 1 1 12  11 21 o 173.4771 3.301306 367.7177       13.95610 353.2082       19.07303 384.4392       20.47530 169.7306 4.615585 177.0486 4.750007 -7.318024      6.623156 
1 1 1 12  11 22 f 123.3700 3.209476 186.1190       9.640752 175.4392       14.53536 194.5075       12.88203 119.4657 5.003909 125.9610 4.202626 -6.495331      6.534613 
1 1 1 12  11 23 o 128.1005 3.469273 200.8579       10.81995 192.6380       12.36559 227.7107       22.35002 125.3453 4.053613 135.5499 6.787763 -10.20465      7.906042 
1 1 1 12  11 24 o 141.2595 3.070537 243.9654       10.56983 239.3533       14.41631 249.3266       15.54323 139.6384 4.241473 142.4593 4.482863 -2.820816      6.171398 
1 1 1 12  11 25 o 39.36258 3.638103 19.13985       3.450280 20.18505       4.426003 17.52080       5.508613 40.27484 4.591554 37.12865 6.314155 3.146187       7.807107 
1 1 1 12  11 26 o 74.84820 3.789258 68.90459       6.889004 99.10316       14.39008 59.92569       7.846599 88.99923 6.683829 69.61758 4.651850 19.38165       8.143296 
1 1 1 12  11 27 o 44.34769 3.555315 24.28799       3.810084 24.93439       4.928491 23.32786       6.006594 44.74329 4.584895 42.95538 5.893385 1.787903       7.466810 
1 1 1 12  11 28 o 72.85744 4.480398 65.82057       7.916276 62.17286       12.72548 68.12330       10.11079 69.67108 7.619325 73.74672 5.669573 -4.075638      9.497272 
1 1 1 12  11 29 o 110.8920 2.996218 151.1127       8.089314 150.4568       10.91098 151.9133       12.05432 110.2584 4.067812 110.6091 4.481422 -0.3506546     6.052292 
1 1 1 12  11 30 o 57.61145 3.312062 41.06401       4.630301 45.36132       6.194318 35.62198       6.970686 60.27455 4.244329 52.93876 5.482652 7.335789       6.933527 
1 1 1 12  11 31 f 43.50877 3.854302 23.71648       4.044336 25.49743       5.246151 21.10751       6.349652 44.76382 4.888625 39.91090 6.770335 4.852921       8.350814 
1 1 1 12  11 32 o 47.61260 3.728580 28.47131       4.291667 36.16121       5.660437 18.07384       6.581931 53.39883 4.388623 36.08202 7.719025 17.31681       8.879378 
1 1 1 12  11 33 f 27.24812 5.360589 9.919309       3.432616 11.52278       4.383597 7.377499       5.519144 28.95192 6.385071 23.25941 8.024108 5.692507       10.25453 
1 1 1 12  11 34 f 47.44618 4.411411 29.20048       5.042095 29.37326       5.621627 28.48971       11.40197 47.21834 4.959510 40.55080 11.17897 6.667538       12.22972 
1 1 1 12  11 35 o 40.54418 4.700389 21.89775       4.558118 19.34154       5.071413 32.64248       10.39749 37.31160 5.763094 43.80597 9.965439 -6.494370      11.51187 
1 1 1 12  11 36 f 12.64772 5.554725 0.1578287      3.295875 -3.378803      4.435403 4.518515       4.925107 12.04673 5.700153 18.47280 7.333657 -6.426072      9.288394 
1 1 1 12  11 37 o 15.35232 6.025522 2.943865       3.290636 0.5822324      4.357844 6.076772       5.019255 14.14790 6.291848 19.50801 7.501070 -5.360105      9.790476 
1 1 1 12  11 38 f 15.56881 6.069443 3.352311       3.320211 2.544847       4.317134 4.521406       5.194685 15.35388 6.547967 17.50596 7.308033 -2.152077      9.812401 
1 1 1 12  11 39 o 16.87626 6.847368 4.703310       4.393145 5.546074       8.513233 4.397433       5.128787 17.97048 8.300856 16.72331 7.134648 1.247162       10.94566 
1 1 1 12  11 40 o 12.69993 5.715299 0.9697068      3.711931 0.3755154      4.393126 2.452564       6.940009 12.89452 5.958589 15.35612 7.224422 -2.461599      9.364672 
1 1 1 12  11 41 o 9.969112 4.742700 -1.684784      3.152727 -4.635673      4.044514 2.885027       5.033140 9.802993 4.823340 14.38195 6.545100 -4.578956      8.130372 
1 1 1 12  11 42 o 10.03863 4.781695 -1.446950      3.225023 -2.801778      4.136465 0.6532256      5.150093 10.45337 5.086150 12.81965 6.088150 -2.366286      7.933125 
1 1 1 12  12 0  o 478.3246 8.118608 2796.147       94.63251 2787.990       163.1494 2800.283       116.1718 475.9885 14.08090 478.3135 9.966718 -2.325043      17.25130 
1 1 1 12  12 1  o 125.9205 3.856188 193.5151       11.81895 0.000000       0.000000 193.5151       11.81895 ?        ?        125.9205 3.856188 0.000000       3.856188 
1 1 1 12  12 2  o 187.4044 3.767184 428.2304       17.20413 433.9631       21.65183 418.4123       28.33550 188.6165 4.710629 185.0184 6.293794 3.598053       7.861416 
1 1 1 12  12 3  o 283.3602 4.464532 979.3815       30.82840 917.2964       41.89153 1052.724       45.53144 274.0881 6.271911 293.6156 6.363503 -19.52747      8.934822 
1 1 1 12  12 4  o 372.8886 5.053603 1696.720       45.92153 1758.921       73.86290 1657.529       58.62983 379.2393 7.992394 368.3736 6.531216 10.86572       10.32159 
1 1 1 12  12 5  o 215.8135 2.989176 567.8171       15.72049 566.8951       21.73831 568.8278       22.76122 215.5824 4.137865 215.9387 4.325426 -0.3563538     5.985919 
1 1 1 12  12 6  o 127.7622 2.917469 199.0064       9.083323 186.7177       11.53148 219.0965       14.74418 123.6691 3.830997 133.9245 4.524269 -10.25542      5.928368 
1 1 1 12  12 7  o 303.6235 6.880207 1127.327       50.90647 1037.501       67.87071 1242.853       76.97002 290.6250 9.596421 318.0245 9.943950 -27.39948      13.81931 
1 1 1 12  12 8  o 262.0638 5.068283 838.6183       32.36712 785.1807       53.05832 870.2907       40.84802 252.9135 8.621458 266.8113 6.282474 -13.89780      10.66766 
1 1 1 12  12 9  o 206.7987 4.379381 522.0100       22.06971 521.9463       37.26919 522.0444       27.38814 206.3093 7.425128 206.6338 5.443816 -0.3245392     9.206936 
1 1 1 12  12 10 o 218.2109 5.522592 582.3574       29.34312 564.5590       40.39172 602.2475       42.69923 214.4593 7.741489 221.4723 7.924376 -7.013031      11.07819 
1 1 1 12  12 11 o 256.0834 8.624734 806.5649       53.74562 806.5649       53.74562 0.000000       0.000000 256.0834 8.624734 ?        ?        0.000000       8.624734 
1 1 1 12  12 12 o 108.4178 4.436986 143.7996       11.69785 141.2737       16.21835 146.5385       16.88850 107.2489 6.232366 109.2160 6.373236 -1.967102      8.914063 
1 1 1 12  12 13 o 171.3232 4.932781 359.0610       20.57273 353.4298       28.45551 365.2277       29.77798 169.6512 6.897314 172.4240 7.102186 -2.772842      9.900201 
1 1 1 12  12 14 o 105.9810 4.484086 137.4870       11.55462 128.6802       15.65491 148.0258       17.12529 102.2886 6.311135 109.7163 6.433403 -7.427719      9.012164 
1 1 1 12  12 15 o 230.9276 5.794071 653.5737       32.58012 604.2184       43.74641 715.0424       48.82056 221.4061 8.121822 240.8098 8.331964 -19.40369      11.63553 
1 1 1 12  12 16 o 145.0150 4.698318 257.4641       16.58127 272.8554       23.67752 242.6518       23.22787 148.9620 6.538590 140.4039 6.809117 8.558060       9.440192 
1 1 1 12  12 17 f 51.14958 5.654884 32.45182       6.931026 26.39290       9.291274 40.05368       10.40729 45.48880 8.698657 56.50801 7.762662 -11.01921      11.65871 
1 1 1 12  12 18 o 156.1532 3.649635 297.9143       13.88790 343.0028       27.53182 282.5259       16.08415 166.8634 6.784917 151.9186 4.349089 14.94473       8.059135 
1 1 1 12  12 19 o 40.11779 2.908523 19.74989       2.824141 20.10476       4.196601 19.45615       3.818059 40.30560 4.341008 39.68979 4.002150 0.6158066      5.904367 
1 1 1 12  12 20 o 128.2299 3.166579 200.8436       9.895000 201.6564       15.46962 200.2808       12.87282 128.1649 4.962446 127.8727 4.136486 0.2921524      6.460371 
1 1 1 12  12 21 o 62.92477 2.606464 48.41552       3.988120 50.57658       5.337569 45.68423       6.000578 64.23592 3.422154 60.96329 4.062315 3.272636       5.311642 
1 1 1 12  12 22 o 98.13842 2.723611 117.7020       6.507289 118.0781       8.793035 117.2466       9.675527 98.17416 3.681932 97.76842 4.069965 0.4057312      5.488282 
1 1 1 12  12 23 o 244.7972 4.104908 734.3176       24.48759 715.4133       33.74321 755.3502       35.59206 240.9722 5.746235 247.5325 5.900446 -6.560349      8.236170 
1 1 1 12  12 24 o 86.54045 3.303473 91.76557       6.953890 91.90804       7.809302 91.22006       15.28137 86.54439 3.711486 85.32770 7.422928 1.216690       8.299096 
1 1 1 12  12 25 o 54.39353 3.082775 36.31273       4.069525 40.21034       5.447112 31.38912       6.122218 57.12243 3.937207 50.23031 5.070932 6.892117       6.419965 
1 1 1 12  12 26 o 61.39652 2.953101 46.24243       4.405375 45.76231       5.711858 46.94736       6.921140 60.92911 3.866900 61.55994 4.647973 -0.6308365     6.046203 
1 1 1 12  12 27 o 24.80915 5.162280 7.896326       3.019250 6.927646       3.492336 10.76283       6.007613 23.16253 6.102880 28.73841 8.184729 -5.575884      10.20955 
1 1 1 12  12 28 o 46.85325 3.362807 27.11364       3.813992 26.55038       4.809215 28.06837       6.261225 46.15782 4.325967 47.14106 5.556999 -0.9832344     7.042317 
1 1 1 12  12 29 o 120.3265 4.939262 180.8423       14.45224 173.3362       19.69875 189.5924       21.26852 116.3924 6.977122 121.5466 7.212995 -5.154243      10.03531 
1 1 1 12  12 30 o 57.79799 3.220936 41.33881       4.518661 42.36217       5.907878 39.89623       7.014329 58.20445 4.193340 56.09612 5.190011 2.108330       6.672355 
1 1 1 12  12 31 o 82.77750 3.071173 84.81470       6.184420 80.47800       7.960389 91.41744       9.822385 80.14767 4.089264 85.02663 4.759516 -4.878960      6.274956 
1 1 1 12  12 32 o 15.72829 5.958592 2.514700       3.137087 -0.3230754     3.938541 7.439488       5.188480 13.94360 6.099405 23.48037 7.781481 -9.536767      9.887072 
1 1 1 12  12 33 o 41.50325 3.920621 21.96297       3.918277 22.01856       5.080102 21.88133       6.156233 40.88084 5.218162 39.92945 6.554013 0.9513969      8.377606 
1 1 1 12  12 34 o 23.37293 6.228686 7.747453       3.611682 11.66628       4.922036 3.176069       5.316071 28.20775 7.151694 18.28346 7.489241 9.924292       10.35546 
1 1 1 12  12 35 o 37.15652 4.946051 18.71425       4.367339 19.53285       4.942631 15.79908       9.327322 37.47772 5.581946 28.93053 10.39268 8.547192       11.79686 
1 1 1 12  12 36 o 20.71629 6.108143 6.455862       3.293355 8.906540       4.274976 2.878035       5.165356 23.71796 6.950046 16.96505 7.196028 6.752907       10.00430 
1 1 1 12  12 37 o 12.20714 5.368223 0.3206708      3.087468 -2.630362      3.954946 4.925341       4.940294 11.44334 5.405021 18.19575 7.304254 -6.752405      9.086604 
1 1 1 12  12 38 o 20.86885 6.233572 7.121097       3.412211 6.034492       4.489198 8.607813       5.251060 18.76055 7.123189 21.30141 7.777320 -2.540857      10.54640 
1 1 1 12  12 39 o 12.87622 5.879105 0.2945496      4.103659 6.441642       5.161684 -10.26523      6.765251 18.26481 7.417981 11.56405 5.780972 6.700766       9.404577 
1 1 1 12  12 40 o 14.57735 6.402629 2.993065       4.379550 6.326245       8.839952 1.908817       5.041790 16.92688 8.020488 14.13398 6.477152 2.792902       10.30930 
1 1 1 12  12 41 o 15.26881 6.153263 4.319862       3.520687 4.698753       4.726031 3.847389       5.277496 15.46962 6.725489 14.89710 6.748905 0.5725193      9.527850 
1 1 1 12  13 0  o 153.9149 2.734493 288.7625       10.25637 279.4963       15.82263 295.4774       13.46931 151.3203 4.295216 155.6729 3.550553 -4.352615      5.572729 
1 1 1 12  13 1  o 122.0899 2.854556 181.7033       8.492867 202.4737       17.74497 175.5319       9.672647 128.6686 5.673298 119.9435 3.312443 8.725082       6.569520 
1 1 1 12  13 2  o 47.26069 2.679301 27.31373       3.073088 24.63199       4.938736 29.00809       3.925638 44.69921 4.599557 48.66341 3.330409 -3.964203      5.678693 
1 1 1 12  13 3  o 70.71588 2.424573 61.02522       4.172012 55.73527       6.351364 65.03999       5.533137 67.49076 3.878100 72.97256 3.118734 -5.481804      4.976562 
1 1 1 12  13 4  o 135.8479 2.605762 224.9628       8.626287 244.2287       13.71594 212.3555       11.09538 141.4465 3.983181 131.9186 3.454411 9.527893       5.272446 
1 1 1 12  13 5  o 175.5838 3.339648 375.9483       14.28964 377.9577       19.36652 373.5470       21.17102 175.9350 4.520883 174.8652 4.973289 1.069778       6.721011 
1 1 1 12  13 6  o 92.90318 3.575739 105.4264       8.080177 97.38956       12.63311 110.9904       10.51141 89.09161 5.851241 95.25626 4.541340 -6.164650      7.406807 
1 1 1 12  13 7  o 52.89548 4.546267 34.40311       5.803370 32.45156       8.570403 36.05566       7.886583 51.01622 7.084705 53.97049 6.103459 -2.954277      9.351217 
1 1 1 12  13 8  o 196.6628 4.276064 472.0654       20.49286 458.7683       34.00341 479.6497       25.68059 193.4303 7.226470 198.0711 5.325275 -4.640808      8.976660 
1 1 1 12  13 9  o 222.2361 4.583278 603.0773       24.82144 571.4066       40.84052 621.6280       31.25666 215.7473 7.780753 225.4251 5.694454 -9.677780      9.641935 
1 1 1 12  13 10 o 129.7132 4.503209 205.7174       14.21291 205.5693       19.68661 205.8787       20.54078 129.4594 6.258783 129.5193 6.529041 -0.5984497E-01 9.044376 
1 1 1 12  13 11 o 104.3909 4.389914 133.3183       11.14254 134.7372       15.52678 131.8118       15.99971 104.7490 6.109205 103.5664 6.370358 1.182571       8.826316 
1 1 1 12  13 12 o 153.4982 6.621621 289.2280       24.71047 289.2280       24.71047 0.000000       0.000000 153.4982 6.621621 ?        ?        0.000000       6.621621 
1 1 1 12  13 13 o 158.3323 4.813620 306.7119       18.55123 305.8326       25.83543 307.6479       26.65453 157.7957 6.734172 158.2270 6.929610 -0.4313049     9.662742 
1 1 1 12  13 14 o 127.3543 4.560167 198.4977       14.12957 199.8677       19.73187 197.0559       20.24237 127.5272 6.369511 126.5875 6.584608 0.9396820      9.161208 
1 1 1 12  13 15 o 64.75919 5.090152 51.63069       7.968301 42.58206       10.75858 62.62581       11.85943 58.32952 7.761297 71.08010 6.934769 -12.75058      10.40811 
1 1 1 12  13 16 o 221.3878 5.669669 601.0427       30.56258 601.2364       42.78494 600.8408       43.67276 220.7366 7.966975 220.6039 8.137786 0.1326599      11.38843 
1 1 1 12  13 17 o 158.6133 4.893828 308.2812       18.89316 306.5529       26.32145 310.1180       27.13506 157.7376 6.864032 158.6090 7.038006 -0.8714142     9.830996 
1 1 1 12  13 18 o 110.0043 6.648461 149.3793       17.73924 0.000000       0.000000 149.3793       17.73924 ?        ?        110.0043 6.648461 0.000000       6.648461 
1 1 1 12  13 19 o 151.8820 7.056071 284.9810       26.04454 0.000000       0.000000 284.9810       26.04454 ?        ?        151.8820 7.056071 0.000000       7.056071 
1 1 1 12  13 20 o 71.13527 3.215884 61.94617       5.560282 61.51206       11.83706 62.06908       6.298409 70.27307 7.005476 71.15871 3.644312 -0.8856354     7.896690 
1 1 1 12  13 21 o 135.2553 2.909836 223.4414       9.590887 240.1036       13.68859 207.3743       13.44190 139.9981 4.016517 130.0562 4.246941 9.941833       5.845418 
1 1 1 12  13 22 o 66.28915 2.649932 53.74636       4.272058 59.22373       5.794613 47.22426       6.323129 69.50406 3.431810 61.94013 4.214228 7.563931       5.434798 
1 1 1 12  13 23 o 25.18739 4.014599 7.964590       2.381466 9.828436       2.927938 4.321377       4.093541 27.96470 4.445107 19.75564 6.905104 8.209063       8.212152 
1 1 1 12  13 24 o 40.17290 4.600529 20.08376       4.422636 22.90324       9.104444 19.21297       5.059711 41.88706 9.173968 39.11287 5.456821 2.774193       10.67420 
1 1 1 12  13 25 o 96.95795 3.740257 115.4724       8.820753 115.4724       8.820753 0.000000       0.000000 96.95795 3.740257 ?        ?        0.000000       3.740257 
1 1 1 12  13 26 o 31.88050 3.933212 12.67516       2.990965 12.30893       3.533746 13.60028       5.616341 31.23674 4.795287 32.32034 7.303442 -1.083603      8.736993 
1 1 1 12  13 27 o 46.08983 3.177062 26.18156       3.546514 23.08427       4.415755 31.81026       5.952755 43.05877 4.264253 50.45904 4.902822 -7.400269      6.497809 
1 1 1 12  13 28 o 82.32515 2.844223 83.23856       5.697437 80.22262       7.377999 87.69382       8.967319 80.57697 3.767870 84.04694 4.393547 -3.469971      5.787927 
1 1 1 12  13 29 o 59.72035 3.042001 43.99509       4.412501 42.58208       5.565683 46.38602       7.239835 58.51255 3.926034 60.73272 4.934285 -2.220169      6.305625 
1 1 1 12  13 30 o 24.54831 7.047041 8.042585       4.436402 7.978313       8.940946 8.063578       5.109801 26.35554 10.04183 24.66772 7.680478 1.687828       12.64232 
1 1 1 12  13 31 o 60.39921 3.292608 45.39865       4.827940 46.30031       6.261374 44.07650       7.582115 60.57193 4.269265 58.50779 5.378027 2.064137       6.866571 
1 1 1 12  13 32 o 68.46931 3.178495 58.48608       5.288919 69.31445       7.099612 44.98302       7.928103 74.09154 3.946384 58.57669 5.623012 15.51485       6.869658 
1 1 1 12  13 33 o 36.96012 4.708296 17.88166       4.144524 24.54099       5.805135 10.95852       5.919008 42.72883 5.718578 27.11245 8.234905 15.61638       10.02576 
1 1 1 12  13 34 o 36.85694 4.243618 17.77530       3.741977 19.44075       4.740211 15.02110       6.095770 37.88897 5.276903 31.25048 7.978156 6.638487       9.565389 
1 1 1 12  13 35 o 29.54392 4.849307 11.95468       3.370252 11.04268       4.343175 13.33503       5.343265 27.11197 6.629803 29.11511 7.488750 -2.003141      10.00178 
1 1 1 12  13 36 o 42.22191 4.507683 24.34176       4.566307 24.53539       5.151812 23.63223       9.862081 41.70052 5.181106 32.79848 10.72135 8.902042       11.90761 
1 1 1 12  13 37 f 19.77818 6.150841 6.172230       3.278207 6.522307       4.260397 5.664129       5.132667 19.79001 7.033405 18.76097 7.474010 1.029047       10.26302 
1 1 1 12  13 38 o 18.68806 6.743475 6.021081       3.932240 8.430704       4.718625 0.5441892      7.113904 21.19830 7.413291 15.62800 7.340416 5.570300       10.43257 
1 1 1 12  13 39 o 13.01088 5.603136 1.657261       3.218563 2.070901       4.367247 1.165511       4.761771 14.23757 6.317038 13.88231 6.336381 0.3552599      8.947329 
1 1 1 12  13 40 o 19.52226 6.685137 7.566074       3.828743 10.45896       5.668390 5.138810       5.192214 20.46863 7.944232 16.19487 7.044999 4.273752       10.61804 
1 1 1 12  13 41 o 14.90433 6.502757 4.134343       4.451489 15.45297       9.704624 1.118271       5.009596 18.88172 8.770600 13.13457 6.166276 5.747148       10.72131 
1 1 1 12  14 0  o 285.1393 4.053465 991.6649       28.16564 1011.057       44.81233 979.0015       36.21241 287.6951 6.391885 283.2150 5.246927 4.480072       8.269608 
1 1 1 12  14 1  o 111.0972 3.503712 150.6572       9.473803 147.5577       15.24768 152.6062       12.09086 109.7821 5.719212 111.7535 4.448655 -1.971367      7.245682 
1 1 1 12  14 2  o 231.7007 3.472840 654.6670       19.60867 646.4537       30.56025 660.4147       25.56522 230.1034 5.450016 232.6495 4.509321 -2.546143      7.073659 
1 1 1 12  14 3  o 218.6441 3.343660 582.9564       17.81541 553.1492       27.18310 605.3994       23.58737 212.8545 5.240589 222.7505 4.345351 -9.895966      6.807778 
1 1 1 12  14 4  o 111.1804 2.452325 150.6839       6.644195 146.2490       10.15306 154.0056       8.786922 109.4295 3.813210 112.3345 3.213173 -2.904961      4.986487 
1 1 1 12  14 5  o 219.7059 3.353519 588.7065       17.95471 567.8279       27.40677 604.4045       23.76455 215.6306 5.215685 222.5416 4.382099 -6.911041      6.812207 
1 1 1 12  14 6  o 246.2206 4.876535 740.2624       29.25983 744.5143       49.93343 738.0389       36.10863 246.2830 8.331951 245.7113 6.030451 0.5716705      10.28532 
1 1 1 12  14 7  o 259.7614 5.065100 824.2106       32.06260 877.3799       56.71759 799.2396       38.86924 267.2172 8.721667 255.6315 6.239582 11.58562       10.72380 
1 1 1 12  14 8  o 214.4764 4.502208 561.6740       23.53104 526.1910       38.50519 582.8242       29.72806 207.0411 7.644920 218.2810 5.593357 -11.23985      9.472616 
1 1 1 12  14 9  o 272.0502 5.244884 904.5638       34.77131 963.7609       61.49900 876.7481       42.15628 279.8273 9.030480 267.6218 6.464051 12.20557       11.10556 
1 1 1 12  14 10 o 255.6498 6.144481 799.9215       38.27954 834.3235       54.94940 767.4850       53.35662 260.3709 8.672430 249.6801 8.783047 10.69083       12.34313 
1 1 1 12  14 11 f 137.0585 4.575250 229.7507       15.25976 236.0039       21.27551 223.1257       21.89912 138.6797 6.312060 134.7755 6.688654 3.904190       9.196750 
1 1 1 12  14 12 o 134.6620 4.629844 221.8593       15.17054 211.8400       20.80298 233.2398       22.17109 131.3153 6.521311 137.7866 6.622429 -6.471268      9.294303 
1 1 1 12  14 13 o 206.8093 7.649340 526.4000       38.48408 526.4000       38.48408 0.000000       0.000000 206.8093 7.649340 ?        ?        0.000000       7.649340 
1 1 1 12  14 14 o 51.08155 5.696680 32.35110       6.970691 31.13573       9.165391 34.01868       10.73594 49.72068 7.822578 51.81874 8.817436 -2.098057      11.78728 
1 1 1 12  14 15 o 52.13669 5.697962 33.69923       7.121615 31.00131       10.04474 36.42609       10.09845 49.42269 8.655422 53.82227 7.937356 -4.399578      11.74385 
1 1 1 12  14 16 o 193.0944 7.661046 460.1392       35.97750 0.000000       0.000000 460.1392       35.97750 ?        ?        193.0944 7.661046 0.000000       7.661046 
1 1 1 12  14 17 o 31.14310 10.27245 11.58735       9.045254 0.000000       0.000000 11.58735       9.045254 ?        ?        31.14310 10.27245 0.000000       10.27245 
1 1 1 12  14 18 o 241.9161 6.067310 719.5352       35.73997 741.0777       51.01372 698.7684       50.08692 244.4235 8.577912 237.2867 8.676544 7.136887       12.20094 
1 1 1 12  14 19 o 269.5206 6.515655 894.4849       42.79432 887.0264       59.73055 902.3512       61.34224 266.8595 9.198725 269.0472 9.370407 -2.187744      13.13092 
1 1 1 12  14 20 o 76.26692 5.190453 71.71577       9.589190 80.01079       13.38360 62.96547       13.74599 80.22795 6.912947 70.81721 8.111485 9.410736       10.65763 
1 1 1 12  14 21 o 74.34760 5.182315 68.21813       9.330381 62.86012       12.56140 74.81261       13.93564 70.88138 7.380224 77.36286 7.485340 -6.481483      10.51180 
1 1 1 12  14 22 o 93.50025 2.633642 106.8557       5.994774 106.8376       8.278212 106.8757       8.692753 93.35826 3.645720 93.34608 3.829555 0.1218414E-01  5.287416 
1 1 1 12  14 23 o 61.24932 3.647138 46.10238       5.418992 62.80147       12.05251 41.87125       6.066790 70.78461 7.082188 58.25985 4.303584 12.52477       8.287232 
1 1 1 12  14 24 o 38.30721 3.415905 18.11122       3.155347 23.22793       3.923086 8.737016       5.310063 43.37056 3.748667 26.21895 7.762636 17.15161       8.620384 
1 1 1 12  14 25 o 78.77473 2.731477 75.99165       5.235557 78.01659       6.962879 73.35737       7.941693 79.67337 3.595506 77.12129 4.242078 2.552078       5.560835 
1 1 1 12  14 26 o 100.0602 3.318640 122.9506       8.080838 122.4639       9.126790 124.7164       17.38434 99.75122 3.761338 99.34811 7.230116 0.4031143      8.149984 
1 1 1 12  14 27 o 23.82765 4.834015 7.283600       2.710804 6.326861       3.233799 9.544960       4.971657 22.11135 5.894451 26.99226 7.358104 -4.880913      9.427950 
1 1 1 12  14 28 o 43.30278 3.551308 23.26922       3.714592 26.61033       4.853867 18.54661       5.770766 46.12249 4.370712 37.79333 6.500212 8.329163       7.833000 
1 1 1 12  14 29 o 83.16405 3.351612 85.52431       6.778522 85.14024       7.527120 87.17223       15.59142 82.82894 3.738795 81.27709 7.974475 1.551849       8.807431 
1 1 1 12  14 30 o 49.80033 3.221382 30.80742       3.888429 31.13350       4.872572 30.23558       6.452478 49.79108 4.050751 48.43491 5.567944 1.356171       6.885534 
1 1 1 12  14 31 o 41.84445 5.314804 22.76238       5.297424 31.45284       10.13407 19.49486       6.214016 46.67812 9.236259 37.83708 6.997023 8.841042       11.58736 
1 1 1 12  14 32 o 19.93762 6.020796 5.364035       3.170400 2.612930       3.908923 10.65310       5.419924 16.64725 6.557083 27.18871 7.784082 -10.54146      10.17778 
1 1 1 12  14 33 o 33.13282 4.401581 14.36320       3.466051 18.17602       4.425074 8.310512       5.575343 36.95675 5.045079 23.79588 8.068679 13.16087       9.516112 
1 1 1 12  14 34 f 13.66177 5.543376 1.535673       2.879388 3.483430       3.558744 -2.156460      4.899684 16.85358 6.355022 13.64089 6.299679 3.212693       8.948310 
1 1 1 12  14 35 o 32.34632 4.534256 14.20535       3.476079 18.17692       4.484216 8.225468       5.502394 36.04746 5.259665 22.40911 7.990073 13.63835       9.565842 
1 1 1 12  14 36 f 15.19067 5.922096 2.885927       3.160989 2.053581       3.974445 4.318758       5.214615 14.98727 6.332561 17.88469 7.381255 -2.897428      9.725444 
1 1 1 12  14 37 o 14.79501 6.312812 2.164004       4.016216 2.164004       4.016216 0.000000       0.000000 14.79501 6.312812 ?        ?        0.000000       6.312812 
1 1 1 12  14 38 o 11.17661 5.106648 -0.4825416     3.103176 -0.6523319     4.166901 -0.2711160     4.649813 12.45583 5.772400 13.19901 6.110153 -0.7431841     8.405627 
1 1 1 12  14 39 o 14.84957 6.004499 3.438073       3.365030 6.711987       4.647868 -0.1684079     4.878226 18.19047 7.154585 13.02613 6.105645 5.164335       9.405689 
1 1 1 12  14 40 o 11.81187 5.355465 0.6211082      3.331227 -1.924453      4.464609 3.818182       5.003432 11.45991 5.503492 15.08155 6.722259 -3.621634      8.687760 
1 1 1 12  15 0  o 257.9841 3.762441 811.7904       23.65368 768.9935       36.05215 844.1368       31.34278 250.9018 5.896459 262.9794 4.890798 -12.07759      7.660818 
1 1 1 12  15 1  o 198.9938 3.157753 482.8544       15.31277 480.2085       23.88260 484.7014       19.95409 198.3384 4.941272 199.3214 4.108108 -0.9830322     6.425941 
1 1 1 12  15 2  o 64.69135 2.802024 51.11918       4.406797 46.21696       9.350578 52.51891       4.996480 61.16190 6.366750 65.55236 3.136908 -4.390461      7.097584 
1 1 1 12  15 3  o 303.6161 4.267780 1124.925       31.57642 1089.765       48.70261 1150.422       41.47474 298.4989 6.695353 306.8754 5.546071 -8.376526      8.694058 
1 1 1 12  15 4  o 167.8241 2.875398 343.4277       11.75948 357.2531       18.64987 334.3034       15.15091 171.0205 4.478839 165.5365 3.755855 5.483978       5.845208 
1 1 1 12  15 5  o 366.6146 5.578348 1642.505       49.83695 1589.925       95.84421 1661.990       58.34484 359.0253 10.96767 368.5895 6.495661 -9.564240      12.74690 
1 1 1 12  15 6  o 220.2344 4.571579 592.2297       24.53508 609.3091       42.26118 583.5465       30.13329 222.8076 7.795520 218.4182 5.666155 4.389420       9.637191 
1 1 1 12  15 7  o 71.15993 3.975608 61.99498       6.866653 50.25792       10.37826 71.13364       9.157696 63.71235 6.788882 76.14677 4.962160 -12.43443      8.409039 
1 1 1 12  15 8  o 285.1382 5.446041 993.9784       37.84185 1009.869       65.08867 985.8648       46.51016 286.3293 9.340820 283.7219 6.726960 2.607452       11.51099 
1 1 1 12  15 9  o 112.7309 3.726998 155.2702       10.22447 153.7984       16.71333 156.1503       12.92523 111.9292 6.151151 112.9583 4.705829 -1.029137      7.744772 
1 1 1 12  15 10 o 169.5539 4.919281 351.6642       20.30422 389.7897       29.73405 318.3536       27.79311 178.1933 6.860229 160.9680 7.102844 17.22536       9.874873 
1 1 1 12  15 11 o 80.07906 4.568578 78.61115       8.878313 79.54756       12.34275 77.60716       12.78035 80.33038 6.356946 79.29069 6.676267 1.039688       9.218638 
1 1 1 12  15 12 o 504.3702 10.77337 3153.340       132.4150 3175.088       187.6465 3131.769       186.8820 501.4886 15.37292 498.0022 15.41784 3.486450       21.77238 
1 1 1 12  15 13 o 24.85996 9.563891 5.117175       8.162411 0.000000       0.000000 5.117175       8.162411 ?        ?        24.85996 9.563891 0.000000       9.563891 
1 1 1 12  15 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  15 15 o 254.6961 6.229963 796.2184       38.66731 779.7083       53.58933 814.1496       55.84826 250.9959 8.774940 256.4052 8.951863 -5.409256      12.53537 
1 1 1 12  15 16 o 115.2750 4.696576 162.9104       13.16565 158.1448       17.93678 168.4770       19.38559 113.2490 6.527062 116.8351 6.838686 -3.586128      9.453580 
1 1 1 12  15 17 o 237.0198 5.990065 690.4138       34.57038 646.4590       46.74145 743.4940       51.36474 228.3946 8.412460 244.8548 8.621816 -16.46021      12.04596 
1 1 1 12  15 18 o 203.4958 5.510273 508.6458       27.30013 546.0613       39.68398 475.0291       37.61544 210.0294 7.766901 195.8210 7.898833 14.20836       11.07774 
1 1 1 12  15 19 o 58.27039 5.550185 42.07413       7.786109 50.66895       11.47228 34.73437       10.60163 63.58614 7.551009 52.23407 8.629906 11.35207       11.46704 
1 1 1 12  15 20 o 32.90663 8.356843 13.97389       6.712831 12.78716       9.230747 15.30598       9.779779 32.21371 10.36030 34.74604 10.59161 -2.532326      14.81614 
1 1 1 12  15 21 o 52.98345 6.209137 35.08676       7.865011 28.94864       10.38319 43.34956       12.04694 47.30900 9.338037 58.33280 8.743873 -11.02380      12.79274 
1 1 1 12  15 22 o 58.38598 7.831836 43.16694       10.86237 43.16694       10.86237 0.000000       0.000000 58.38598 7.831836 ?        ?        0.000000       7.831836 
1 1 1 12  15 23 o 76.44466 3.359236 71.66818       6.242550 92.96114       14.08527 66.46340       6.963835 86.29676 6.751547 73.52634 3.900552 12.77042       7.797287 
1 1 1 12  15 24 o 71.07872 2.717130 61.86655       4.697704 72.54046       6.569252 50.69566       6.720441 76.85110 3.517083 64.07216 4.329625 12.77894       5.578129 
1 1 1 12  15 25 o 91.36452 2.747329 102.2362       6.109852 110.8973       8.494205 92.95105       8.794910 94.96868 3.677289 86.81787 4.169245 8.150810       5.559232 
1 1 1 12  15 26 o 13.03567 5.128596 1.233988       2.388860 -0.1084033     2.929227 3.899719       4.127828 12.50430 5.364580 19.10365 6.907039 -6.599356      8.745623 
1 1 1 12  15 27 o 57.43840 3.540847 40.77411       4.932072 43.93635       5.423824 25.66911       11.85408 59.58084 3.754715 42.88160 11.21748 16.69925       11.82919 
1 1 1 12  15 28 o 32.78080 3.912517 13.48456       3.063815 16.52817       3.808113 7.898714       5.158930 36.20922 4.406347 24.65590 7.723462 11.55332       8.892005 
1 1 1 12  15 29 f 17.40751 5.446563 3.828500       2.566315 2.281067       3.086430 7.294853       4.619413 15.51661 5.902846 23.55135 7.297749 -8.034744      9.386199 
1 1 1 12  15 30 o 15.25006 5.433653 2.634576       2.544251 3.573651       3.052509 0.4975981      4.604758 17.24737 5.966650 15.78463 6.747966 1.462742       9.007551 
1 1 1 12  15 31 o 31.82420 4.534808 13.09559       3.417459 13.67085       4.382292 12.20282       5.459313 31.96077 5.841827 29.37459 7.576946 2.586178       9.567500 
1 1 1 12  15 32 o 24.54989 6.956680 8.561493       4.351046 7.193916       8.421636 9.059460       5.081833 23.90980 9.557537 25.03737 7.635539 -1.127571      12.23307 
1 1 1 12  15 33 o 24.20570 5.386451 8.086255       3.095407 12.25162       3.850295 0.4744150      5.204902 29.88090 5.489914 15.91903 6.986290 13.96186       8.885235 
1 1 1 12  15 34 o 22.67609 5.609526 7.348792       3.082498 11.32478       3.837097 0.1135504      5.176151 28.17917 5.781792 15.28522 6.823555 12.89395       8.943714 
1 1 1 12  15 35 o 9.372697 4.433117 -2.405316      2.677712 -4.361638      3.351707 1.046405       4.452088 9.613617 4.654261 14.78542 6.475826 -5.171803      7.974865 
1 1 1 12  15 36 o 32.81975 5.021703 15.36647       3.888749 18.65642       4.838815 9.366322       6.534698 35.38121 5.813927 22.21735 8.554705 13.16386       10.34334 
1 1 1 12  15 37 o 16.95326 6.173040 4.501356       3.304924 6.091448       4.386607 2.413828       5.026129 18.80980 7.063550 15.57170 6.848509 3.238098       9.838486 
1 1 1 12  15 38 o 20.89154 7.057442 8.273563       4.265224 11.28069       4.949804 -0.3983287     8.405614 23.83507 7.578350 15.42338 7.443363 8.411686       10.62238 
1 1 1 12  15 39 o 12.19104 5.429218 0.9712382      3.256489 5.875394       4.366443 -5.175387      4.888369 17.23355 6.884257 10.78323 5.305065 6.450321       8.691186 
1 1 1 12  15 40 o 21.51378 6.493276 9.021576       3.688223 11.30097       5.181206 6.680030       5.251373 21.51345 7.743573 16.98078 7.231146 4.532673       10.59492 
1 1 1 12  16 0  o 321.0424 4.472086 1257.971       34.98716 1259.647       55.20170 1256.845       45.23273 320.8491 7.060175 320.7147 5.787591 0.1344299      9.129200 
1 1 1 12  16 1  o 282.8522 4.047947 976.2308       27.90169 1005.283       44.65678 957.6269       35.73555 286.7214 6.391330 280.0080 5.237136 6.713379       8.262971 
1 1 1 12  16 2  o 103.7112 3.126500 131.2923       7.892667 119.4724       14.27982 136.4916       9.470777 98.68250 5.965953 105.7105 3.682096 -7.027954      7.010737 
1 1 1 12  16 3  o 332.1240 5.128926 1347.405       41.51096 1250.599       56.09452 1464.596       61.71836 319.5809 7.202836 345.8154 7.323757 -26.23447      10.27221 
1 1 1 12  16 4  o 124.5697 2.565131 189.1985       7.786786 189.6282       12.02160 188.8880       10.22065 124.5913 3.964530 124.3919 3.374831 0.1994324      5.206437 
1 1 1 12  16 5  o 316.1147 4.922382 1220.676       37.91893 1160.445       71.73216 1244.034       44.67043 306.9797 9.600689 318.9777 5.746769 -11.99799      11.18922 
1 1 1 12  16 6  o 175.1688 3.245191 374.3044       13.85266 332.8676       24.11319 394.7166       16.92412 164.8473 6.012636 179.8382 3.861786 -14.99086      7.145991 
1 1 1 12  16 7  o 99.94299 3.721087 122.0691       9.046888 129.5068       15.15690 117.9527       11.27579 102.6986 6.083593 98.14994 4.728247 4.548622       7.704960 
1 1 1 12  16 8  o 202.6417 4.396449 501.5231       21.71036 484.8691       36.04362 511.0056       27.19768 198.6717 7.458098 204.3445 5.466674 -5.672775      9.247041 
1 1 1 12  16 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  16 10 o 74.57435 6.871946 68.77274       12.34800 0.000000       0.000000 68.77274       12.34800 ?        ?        74.57435 6.871946 0.000000       6.871946 
1 1 1 12  16 11 o 179.8385 7.288253 397.8530       31.87436 0.000000       0.000000 397.8530       31.87436 ?        ?        179.8385 7.288253 0.000000       7.288253 
1 1 1 12  16 12 o 174.5942 7.298944 375.2500       30.98611 0.000000       0.000000 375.2500       30.98611 ?        ?        174.5942 7.298944 0.000000       7.298944 
1 1 1 12  16 13 o 318.3497 7.289786 1246.215       56.55296 1292.989       81.40791 1202.589       78.62081 322.6111 10.36849 311.1083 10.38482 11.50284       14.67481 
1 1 1 12  16 14 o 119.4304 4.648692 174.7594       13.50366 186.0078       19.31417 164.0028       18.88712 122.9078 6.471329 115.3335 6.749576 7.574333       9.350662 
1 1 1 12  16 15 o 109.5552 6.500675 147.9981       17.27709 147.9981       17.27709 0.000000       0.000000 109.5552 6.500675 ?        ?        0.000000       6.500675 
1 1 1 12  16 16 o 206.8915 5.547328 525.4307       27.94284 560.6479       40.31585 492.8723       38.76411 212.9623 7.781579 199.5809 7.986427 13.38141       11.15060 
1 1 1 12  16 17 o 45.74955 6.067110 26.16193       6.597435 27.92182       9.067468 24.18220       9.617138 46.83665 8.245473 43.29737 9.386029 3.539280       12.49341 
1 1 1 12  16 18 o 196.1812 5.440386 472.8625       25.98385 469.7607       36.15785 476.1750       37.36533 194.7571 7.633348 195.9979 7.838955 -1.240799      10.94154 
1 1 1 12  16 19 o 18.16406 7.869925 -0.7770395     6.425934 -14.03157      8.232471 19.89119       10.28016 14.85100 7.214260 39.12502 10.54511 -24.27402      12.77673 
1 1 1 12  16 20 o 111.3361 6.741877 153.7230       18.20592 153.7230       18.20592 0.000000       0.000000 111.3361 6.741877 ?        ?        0.000000       6.741877 
1 1 1 12  16 21 o 93.49167 6.805105 108.7844       15.39785 108.7844       15.39785 0.000000       0.000000 93.49167 6.805105 ?        ?        0.000000       6.805105 
1 1 1 12  16 22 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  16 23 o 16.98252 7.543500 -2.026645      6.245382 -1.957892      8.619345 -2.102638      9.061871 20.30272 8.947344 20.77349 9.163692 -0.4707794     12.80735 
1 1 1 12  16 24 o 28.90922 5.143310 10.62293       3.490579 20.88461       9.502481 9.022302       3.752951 39.63745 9.874516 26.45574 5.964237 13.18172       11.53595 
1 1 1 12  16 25 o 51.90902 2.978606 33.12328       3.752017 41.34031       5.233352 24.43257       5.382080 57.87608 3.730474 44.13893 5.097247 13.73715       6.316514 
1 1 1 12  16 26 o 11.11565 4.793573 -0.1940781     2.361994 1.240179       3.019452 -2.455688      3.791609 14.19862 5.706669 12.30679 5.631240 1.891834       8.017289 
1 1 1 12  16 27 o 10.84634 4.717637 -0.3367506     2.327605 -0.2498623     2.845792 -0.5123479     4.045585 12.12832 5.246058 14.24438 6.207265 -2.116055      8.127192 
1 1 1 12  16 28 o 44.56250 3.943578 24.82609       4.238327 23.44158       4.536749 34.32347       11.88224 43.16648 4.373095 49.41757 10.20502 -6.251091      11.10254 
1 1 1 12  16 29 o 11.75441 5.093640 -0.2060186     2.692731 1.060590       3.405300 -2.319566      4.398860 14.47983 5.969296 13.38512 6.102029 1.094706       8.536232 
1 1 1 12  16 30 o 26.19349 4.748755 8.949215       2.919576 8.365024       3.630491 10.01859       4.911943 24.89518 6.045446 26.87538 7.308630 -1.980198      9.484908 
1 1 1 12  16 31 f 22.73729 5.288041 6.955434       2.874485 4.593390       3.568756 11.31833       4.850207 18.89379 6.454593 28.34126 7.051387 -9.447475      9.559489 
1 1 1 12  16 32 o 15.58609 5.690699 2.861432       2.811388 5.573843       3.523751 -1.889076      4.663343 20.08664 6.395033 13.69316 6.257853 6.393474       8.947467 
1 1 1 12  16 33 o 26.51619 6.728019 10.36354       4.353764 22.30914       9.494861 7.183183       4.899168 35.22432 10.36750 21.98203 7.560956 13.24229       12.83172 
1 1 1 12  16 34 o 10.10013 4.670277 -1.571151      2.705130 -2.035639      3.459549 -0.8403009     4.339564 11.23242 5.223985 13.43361 6.099355 -2.201186      8.030701 
1 1 1 12  16 35 o 27.67551 5.533419 11.18359       3.601342 9.664248       4.304606 14.72773       6.574483 24.48906 6.912624 28.22302 8.699442 -3.733961      11.11147 
1 1 1 12  16 36 o 14.17792 5.753052 2.275851       3.101480 1.987390       3.995346 2.713263       4.919889 14.69100 6.283147 16.01225 6.911815 -1.321250      9.340832 
1 1 1 12  16 37 o 16.89658 6.126846 4.590501       3.251016 7.958728       4.452313 0.7436041      4.758175 20.74737 7.204503 14.01878 6.373570 6.728590       9.619109 
1 1 1 12  16 38 o 20.50228 6.298501 7.463435       3.449822 3.664360       4.734043 11.76546       5.037671 15.57865 6.752303 23.86122 7.651682 -8.282562      10.20499 
1 1 1 12  16 39 o 10.60168 5.095566 -2.424655      3.845506 -2.591049      4.444565 -1.929187      7.669528 11.22081 5.414526 13.78625 6.754461 -2.565445      8.656779 
1 1 1 12  16 40 o 13.99546 5.900633 3.178740       3.438596 4.885955       4.737654 1.278238       4.998655 15.55459 6.748310 13.26696 6.206246 2.287636       9.168270 
1 1 1 12  17 0  o 115.7827 2.564568 163.4442       7.235924 164.4022       11.15956 162.7493       9.504762 116.0038 3.953427 115.4599 3.381755 0.5439072      5.202485 
1 1 1 12  17 1  o 66.38496 2.559735 53.81109       4.133198 57.84000       6.505347 51.08377       5.352351 68.73679 3.899693 64.62283 3.410854 4.113953       5.180881 
1 1 1 12  17 2  o 197.9579 3.584153 478.1044       17.29002 496.0944       35.44965 472.4890       19.80548 201.1124 7.245148 196.7495 4.130813 4.362823       8.340011 
1 1 1 12  17 3  o 77.52379 2.467880 73.34926       4.656305 73.28263       7.053637 73.40071       6.198877 77.40460 3.750634 77.50119 3.289709 -0.9658813E-01 4.988933 
1 1 1 12  17 4  o 222.1882 3.753193 602.4489       20.32160 604.8716       28.81972 600.0531       28.65911 222.4614 5.316172 221.5747 5.307701 0.8867645      7.512215 
1 1 1 12  17 5  o 20.51460 4.124245 5.321751       1.990220 -0.5991261     3.273633 8.793259       2.506663 12.86381 5.594975 26.54532 3.999040 -13.68151      6.877214 
1 1 1 12  17 6  o 194.6733 3.876144 462.5939       18.38833 457.4331       30.48319 465.5461       23.05550 193.1652 6.485023 195.1946 4.846973 -2.029404      8.096213 
1 1 1 12  17 7  f 206.3167 7.736780 523.2731       38.82939 0.000000       0.000000 523.2731       38.82939 ?        ?        206.3167 7.736780 0.000000       7.736780 
1 1 1 12  17 8  o 197.4894 5.454199 477.4631       26.22375 0.000000       0.000000 477.4631       26.22375 ?        ?        197.4894 5.454199 0.000000       5.454199 
1 1 1 12  17 9  o 234.3876 4.850599 671.6334       27.70552 610.6949       45.28191 708.0959       35.02693 222.6160 8.361900 240.4572 5.977618 -17.84129      10.27878 
1 1 1 12  17 10 o 197.3161 5.337060 476.7883       25.63903 461.0379       35.35152 494.2667       37.24031 193.5484 7.509434 200.3770 7.640569 -6.828613      10.71307 
1 1 1 12  17 11 o 102.6918 4.627101 129.1980       11.54952 125.1305       16.15493 133.4504       16.51810 100.7697 6.615268 104.0915 6.545048 -3.321815      9.305882 
1 1 1 12  17 12 o 181.8491 5.153767 405.1173       22.81570 397.4088       31.68690 413.4166       32.87864 179.6337 7.253538 183.1873 7.380273 -3.553589      10.34805 
1 1 1 12  17 13 o 265.3011 6.399752 864.1765       41.37503 895.4209       59.24250 834.4247       57.81005 268.8867 9.054152 259.5092 9.155782 9.377502       12.87657 
1 1 1 12  17 14 o 164.4661 5.029120 331.5631       20.13233 312.7633       27.35583 353.7761       29.73564 159.2643 7.066069 169.3599 7.221522 -10.09560      10.10345 
1 1 1 12  17 15 o 144.4253 4.857641 255.7381       17.07208 248.3785       23.55970 263.8754       24.77311 141.8983 6.833368 146.2314 6.971984 -4.333084      9.762350 
1 1 1 12  17 16 o 92.46897 6.690573 105.8068       14.97436 105.8068       14.97436 0.000000       0.000000 92.46897 6.690573 ?        ?        0.000000       6.690573 
1 1 1 12  17 17 o 89.52933 4.852474 98.52757       10.54723 96.37275       14.59638 100.8821       15.25765 88.15908 6.847926 90.17561 6.997980 -2.016533      9.791109 
1 1 1 12  17 18 o 128.9460 6.651063 205.5966       20.82883 205.5966       20.82883 0.000000       0.000000 128.9460 6.651063 ?        ?        0.000000       6.651063 
1 1 1 12  17 19 o 89.75228 6.763155 100.0601       14.68331 100.0601       14.68331 0.000000       0.000000 89.75228 6.763155 ?        ?        0.000000       6.763155 
1 1 1 12  17 20 o 138.8196 4.957757 237.0751       16.74458 231.0475       23.11610 243.7295       24.28818 136.4023 6.977538 140.0432 7.140569 -3.640839      9.983675 
1 1 1 12  17 21 o 86.76711 5.073253 92.92719       10.68019 101.4403       15.18542 84.59414       15.02402 90.16898 6.964830 82.10835 7.594707 8.060631       10.30478 
1 1 1 12  17 22 o 44.50258 7.274640 25.27603       7.616884 36.31895       10.49176 12.96955       11.07575 53.21331 8.366649 32.91623 11.36653 20.29709       14.11378 
1 1 1 12  17 23 o 105.9218 4.882660 138.6280       12.56921 157.7079       17.97941 120.3896       17.57848 112.3624 6.595261 97.79015 7.432156 14.57229       9.936519 
1 1 1 12  17 24 o 23.64525 8.421873 6.258271       6.111621 7.138447       8.263601 5.195524       9.080284 26.13697 9.718995 25.26912 9.981205 0.8678455      13.93138 
1 1 1 12  17 25 o 39.43559 4.146807 19.38647       3.925529 28.33616       9.545119 17.56463       4.306585 46.29852 8.781366 37.35777 4.844580 8.940746       10.02908 
1 1 1 12  17 26 o 36.58657 3.584965 16.64831       3.155282 21.92588       4.482916 11.46698       4.441851 41.82594 4.467324 29.62621 6.343780 12.19972       7.758900 
1 1 1 12  17 27 f 22.45125 5.227315 6.567693       2.806297 8.417493       3.777759 4.290117       4.191875 25.27431 6.184899 19.47355 6.970510 5.800756       9.318851 
1 1 1 12  17 28 o 33.08035 4.259379 13.86907       3.354024 16.11787       4.661535 11.45525       4.829536 35.24162 5.616313 29.19089 6.899132 6.050722       8.896123 
1 1 1 12  17 29 o 51.50544 3.808558 33.28970       4.746423 31.27955       5.183011 43.73608       11.81546 49.71105 4.321411 55.75343 9.003118 -6.042374      9.986527 
1 1 1 12  17 30 o 21.74178 5.283659 6.329005       2.771587 5.067683       3.501360 8.445531       4.535609 19.64572 6.386008 24.63884 7.141440 -4.993122      9.580254 
1 1 1 12  17 31 o 51.70155 3.810277 34.00067       4.766880 37.10826       5.335129 21.69950       10.61466 53.85009 4.096314 35.74313 11.06016 18.10696       11.79436 
1 1 1 12  17 32 f 25.53442 4.975987 8.833452       2.984962 8.065789       3.847310 9.994368       4.731212 23.67670 6.480410 25.96373 7.217794 -2.287025      9.700116 
1 1 1 12  17 33 o 24.93422 5.598217 8.836216       3.318052 12.77331       4.196337 2.268518       5.419870 29.84174 5.978980 17.11280 7.318455 12.72894       9.450290 
1 1 1 12  17 34 o 18.05862 6.838002 4.629568       4.130182 5.709441       8.834601 4.327546       4.672190 20.58475 9.065521 17.95378 7.137925 2.630972       11.53836 
1 1 1 12  17 35 o 16.40225 5.903150 3.864958       3.010931 6.895061       4.072537 0.2119597      4.471581 20.56260 6.895944 13.94889 6.275519 6.613714       9.323957 
1 1 1 12  17 36 o 14.12618 5.738881 2.345959       3.090497 2.970796       4.160035 1.576372       4.616815 15.55399 6.519782 14.72443 6.515971 0.8295593      9.217669 
1 1 1 12  17 37 o 23.96914 5.886024 9.355927       3.412491 11.81449       4.756839 6.749013       4.898250 25.05931 7.328019 18.77479 7.356633 6.284517       10.38364 
1 1 1 12  17 38 o 10.52028 4.919957 -1.091895      3.137660 -0.4423071     4.362511 -1.788032      4.516116 12.37859 5.793015 11.82439 5.639598 0.5542002      8.084806 
1 1 1 12  17 39 o 12.36174 5.693882 0.5981067      3.964987 4.183559       4.719076 -8.009485      7.311826 15.28046 6.680519 11.90278 5.959135 3.377685       8.952128 
1 1 1 12  18 0  o 55.84200 3.292039 38.17073       4.459961 36.17842       7.543286 39.24150       5.530095 54.08512 5.814514 56.55806 4.038964 -2.472935      7.079675 
1 1 1 12  18 1  o 44.52775 3.539493 24.34348       3.809095 17.68441       6.407730 27.98260       4.736913 37.35509 7.300947 47.70249 4.115105 -10.34740      8.380806 
1 1 1 12  18 2  o 141.5668 3.378566 244.5026       11.65547 249.2410       19.88720 242.0234       14.38496 142.6472 5.732708 140.7361 4.199070 1.911087       7.106063 
1 1 1 12  18 3  o 260.3116 6.013672 829.0984       38.14779 0.000000       0.000000 829.0984       38.14779 ?        ?        260.3116 6.013672 0.000000       6.013672 
1 1 1 12  18 4  o 73.03524 2.712308 65.14048       4.818950 64.45664       8.464876 65.46837       5.861484 72.47314 4.820398 73.17995 3.295300 -0.7068024     5.839113 
1 1 1 12  18 5  o 191.7897 3.121346 448.7290       14.58825 421.5284       21.92550 470.3361       19.54150 185.6639 4.850181 196.2680 4.085756 -10.60406      6.341740 
1 1 1 12  18 6  o 78.62727 2.345256 75.44859       4.488630 84.50890       6.852394 68.63910       5.940568 83.15008 3.388867 74.93264 3.261084 8.217438       4.703093 
1 1 1 12  18 7  o 256.8215 4.290022 805.7093       26.84893 785.4133       53.32066 812.6033       31.07610 252.4272 8.681006 257.8096 4.946424 -5.382385      9.991345 
1 1 1 12  18 8  o 98.76965 4.942918 119.5878       11.85934 0.000000       0.000000 119.5878       11.85934 ?        ?        98.76965 4.942918 0.000000       4.942918 
1 1 1 12  18 9  o 64.65169 4.326212 51.30399       6.776684 39.56088       10.10489 60.90228       9.135603 56.24043 7.564697 70.33929 5.370307 -14.09886      9.277114 
1 1 1 12  18 10 o 188.5278 5.209177 435.3340       23.90915 434.7978       33.36171 435.9003       34.28236 187.9420 7.298180 188.1290 7.492877 -0.1869354     10.45976 
1 1 1 12  18 11 o 63.27131 5.161459 49.32845       7.889126 44.96770       10.79731 54.32270       11.55501 59.99010 7.552878 66.07009 7.298271 -6.079994      10.50289 
1 1 1 12  18 12 o 82.13258 4.776455 82.82189       9.518736 83.80508       13.54105 81.86147       13.38338 82.30071 6.812672 81.33393 6.815002 0.9667816      9.636222 
1 1 1 12  18 13 o 225.8099 5.801589 625.9084       31.89820 591.7789       43.43326 665.8721       46.99922 218.7713 8.161272 232.0120 8.326237 -13.24069      11.65901 
1 1 1 12  18 14 o 152.3330 4.900266 284.5078       18.16705 302.4201       25.95143 267.2941       25.44037 156.6122 6.816175 147.1393 7.116202 9.472961       9.853962 
1 1 1 12  18 15 o 113.9094 4.774405 159.2113       13.22363 174.4439       19.01237 144.9371       18.40452 118.8767 6.588790 108.2271 7.016156 10.64960       9.624894 
1 1 1 12  18 16 o 112.7569 6.575235 157.0997       17.98880 157.0997       17.98880 0.000000       0.000000 112.7569 6.575235 ?        ?        0.000000       6.575235 
1 1 1 12  18 17 o 17.29939 7.874479 -4.403746      7.290215 -4.403746      7.290215 0.000000       0.000000 17.29939 7.874479 ?        ?        0.000000       7.874479 
1 1 1 12  18 18 o 147.5616 4.950401 267.5548       17.77602 275.1524       25.15275 259.9737       25.12547 149.0441 6.944324 144.7975 7.142652 4.246658       9.961984 
1 1 1 12  18 19 o 125.6285 4.886606 194.1242       14.93147 174.5254       20.11215 218.1922       22.28758 118.5182 6.994762 132.5872 6.922003 -14.06904      9.840774 
1 1 1 12  18 20 o 50.50471 6.283138 31.99187       7.566205 30.06871       10.30172 34.24434       11.14888 48.22033 9.100392 51.50405 9.221522 -3.283718      12.95583 
1 1 1 12  18 21 o 97.52391 5.021214 117.4039       11.89300 114.1945       16.31070 121.0473       17.37851 95.57932 7.052485 98.33067 7.304668 -2.751350      10.15361 
1 1 1 12  18 22 o 67.44287 5.523503 56.59944       8.998470 59.60527       12.56072 53.43027       12.89748 68.58978 7.644607 64.64536 8.384450 3.944412       11.34632 
1 1 1 12  18 23 o 24.22932 8.480451 6.742027       6.175721 2.396423       8.049559 12.95977       9.628603 22.24881 9.175412 32.06114 10.59951 -9.812328      14.01919 
1 1 1 12  18 24 o 17.66745 7.691015 -0.6927628     6.197289 -2.318753      8.134713 1.556238       9.567053 19.31190 8.591880 23.20664 9.816161 -3.894743      13.04521 
1 1 1 12  18 25 o 24.92537 8.642761 7.467437       6.406330 12.90119       8.695558 1.016867       9.474289 31.31203 10.05406 22.62287 9.675501 8.689152       13.95347 
1 1 1 12  18 26 o 75.04402 2.927465 69.32345       5.343306 65.05193       8.525916 72.08635       6.856987 72.03804 4.885626 76.29774 3.698976 -4.259705      6.127949 
1 1 1 12  18 27 o 63.25900 3.867443 49.84840       5.933375 51.30568       6.655612 44.20581       13.09647 64.02038 4.290903 56.31418 9.904789 7.706196       10.79429 
1 1 1 12  18 28 o 70.36613 3.677974 61.77172       6.284897 59.93402       6.992909 69.49326       14.33417 69.07776 4.173634 71.32778 8.408020 -2.250023      9.386907 
1 1 1 12  18 29 o 27.60522 4.636708 9.902656       3.008684 15.60653       4.194046 3.855169       4.318527 34.59516 5.130060 18.67343 7.009328 15.92173       8.686092 
1 1 1 12  18 30 o 41.03622 4.494148 21.73860       4.420764 22.31469       4.891042 19.16766       10.33248 41.34012 4.953564 34.17217 10.95835 7.167950       12.02594 
1 1 1 12  18 31 o 18.45839 5.743544 4.629785       2.857998 7.315679       3.732453 0.8229846      4.443549 22.71159 6.445727 15.34193 6.595028 7.369656       9.221811 
1 1 1 12  18 32 o 37.15520 4.124828 18.08448       3.671891 24.14129       4.764805 9.227908       5.761768 42.58559 4.667811 24.24594 8.202607 18.33965       9.437756 
1 1 1 12  18 33 o 15.71884 5.603046 3.274661       2.705633 4.121211       3.577366 2.143199       4.135778 17.38361 6.407314 15.58764 6.514992 1.795975       9.137768 
1 1 1 12  18 34 o 10.98350 5.177988 -2.586799      3.598291 -1.045797      8.789655 -2.897052      3.943917 17.16493 8.092328 11.37554 5.380330 5.789392       9.717701 
1 1 1 12  18 35 o 20.68030 6.010694 6.710543       3.208990 6.430786       4.267850 7.074424       4.867424 19.63297 7.032713 20.21165 7.469564 -0.5786781     10.25931 
1 1 1 12  18 36 o 12.65640 5.446303 1.188041       3.036446 4.204663       4.077322 -2.568200      4.549788 16.52386 6.634809 11.95737 5.691091 4.566500       8.741236 
1 1 1 12  18 37 o 14.72187 5.890842 3.226789       3.202667 1.671808       4.452761 4.893410       4.609832 14.00786 6.285408 16.69277 6.919407 -2.684901      9.347970 
1 1 1 12  18 38 o 15.99573 6.303848 4.593118       3.614551 5.146095       5.403157 4.145193       4.862914 16.33687 7.145223 15.56930 6.794684 0.7675772      9.860120 
1 1 1 12  18 39 o 18.75573 6.321517 6.864145       3.422077 7.331998       4.904566 6.420303       4.777049 17.74848 7.222488 16.98574 7.042580 0.7627354      10.08773 
1 1 1 12  19 0  o 225.1157 3.477883 618.3456       19.07906 612.1443       29.74267 622.6815       24.87013 223.7536 5.454739 225.7938 4.519911 -2.040253      7.084050 
1 1 1 12  19 1  o 191.2275 3.152269 446.0899       14.68959 438.1623       22.68789 451.8121       19.27525 189.2959 4.922499 192.3701 4.111747 -3.074203      6.413849 
1 1 1 12  19 2  o 55.33474 2.756943 37.43515       3.705884 42.04093       5.694459 34.05137       4.880918 58.54531 4.015710 52.67906 3.828258 5.866253       5.548107 
1 1 1 12  19 3  o 98.16613 2.906170 117.6454       6.944489 119.1901       13.99913 117.1413       7.997939 98.51818 5.857515 97.92353 3.356584 0.5946503      6.751084 
1 1 1 12  19 4  f 166.1736 2.915699 336.8369       11.80703 331.3730       18.08160 340.8985       15.58952 164.6298 4.511302 167.1043 3.828327 -2.474503      5.916750 
1 1 1 12  19 5  o 154.6224 2.799670 291.6244       10.54910 303.8661       16.48103 283.1282       13.73022 157.6605 4.293684 152.2915 3.699692 5.368927       5.667755 
1 1 1 12  19 6  o 239.7403 3.604230 701.6290       21.05667 677.5725       32.09094 719.8170       27.90348 235.2817 5.597036 242.6645 4.718631 -7.382797      7.320676 
1 1 1 12  19 7  o 178.0574 2.913931 386.8019       12.64374 403.3451       26.78741 382.0599       14.34186 181.3341 6.070546 176.9279 3.326388 4.406143       6.922166 
1 1 1 12  19 8  o 358.3538 6.530155 1575.371       57.02583 1480.422       94.05360 1630.566       71.71014 344.9523 11.20358 363.9204 8.086081 -18.96808      13.81683 
1 1 1 12  19 9  f 94.92005 5.101827 110.5810       11.75766 0.000000       0.000000 110.5810       11.75766 ?        ?        94.92005 5.101827 0.000000       5.101827 
1 1 1 12  19 10 o 50.53460 5.709707 31.68957       6.908354 38.25447       9.401082 23.98295       10.18581 55.33480 7.137877 43.14965 9.897747 12.18515       12.20306 
1 1 1 12  19 11 o 153.6477 4.846293 289.2233       18.12293 279.6042       24.78831 300.2689       26.56300 150.6770 6.768213 156.0991 7.000793 -5.422119      9.737546 
1 1 1 12  19 12 o 179.0768 5.168170 393.1833       22.52982 431.5476       32.75239 358.7247       31.04043 187.0782 7.197717 170.4543 7.491099 16.62386       10.38863 
1 1 1 12  19 13 o 103.6493 6.604496 132.6636       16.59499 132.6636       16.59499 0.000000       0.000000 103.6493 6.604496 ?        ?        0.000000       6.604496 
1 1 1 12  19 14 o 72.26263 7.082574 64.96116       12.31213 64.96116       12.31213 0.000000       0.000000 72.26263 7.082574 ?        ?        0.000000       7.082574 
1 1 1 12  19 15 o 65.22958 5.438055 52.57988       8.565622 57.61683       11.71903 46.80240       12.55095 67.96584 7.184234 60.82296 8.716690 7.142879       11.29575 
1 1 1 12  19 16 o 88.75402 4.961517 96.91740       10.68824 100.6937       14.85457 92.86362       15.39060 90.09241 6.816640 86.36283 7.383715 3.729584       10.04917 
1 1 1 12  19 17 o 30.29510 8.863203 11.66665       6.957277 -3.235145      9.332470 30.30915       10.43829 20.65997 9.196493 48.52800 9.162519 -27.86803      12.98180 
1 1 1 12  19 18 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  19 19 o 77.62154 5.242379 74.46874       9.858066 71.81916       13.62758 77.37727       14.27797 75.66451 7.488913 78.54469 7.552552 -2.880180      10.63602 
1 1 1 12  19 20 o 44.12093 7.103273 24.77670       7.378055 25.80707       10.18429 23.63863       10.70334 44.38044 9.689174 42.30843 10.44503 2.072002       14.24706 
1 1 1 12  19 21 o 69.26550 5.509184 59.65120       9.222525 48.22042       12.29089 74.37969       13.95163 61.37153 8.441677 76.76350 7.556040 -15.39197      11.32942 
1 1 1 12  19 22 o 105.3189 4.974169 137.2739       12.73016 126.1542       17.09703 151.1088       19.07056 100.1716 7.048901 109.6117 7.179060 -9.440048      10.06111 
1 1 1 12  19 23 o 45.07593 6.934153 26.06145       7.373106 23.03732       9.809706 29.98811       11.17808 41.42163 9.860978 47.31599 10.00751 -5.894352      14.04953 
1 1 1 12  19 24 o 60.00516 6.009617 45.52468       8.669495 41.73264       11.72679 50.09526       12.87446 56.26740 8.843802 61.76444 8.802521 -5.497044      12.47787 
1 1 1 12  19 25 o 98.13427 7.538568 124.3962       17.88987 0.000000       0.000000 124.3962       17.88987 ?        ?        98.13427 7.538568 0.000000       7.538568 
1 1 1 12  19 26 o 54.66582 3.367322 37.03053       4.463995 43.90998       10.74995 35.59706       4.907085 57.56022 7.869729 53.47386 3.790267 4.086357       8.734916 
1 1 1 12  19 27 o 36.00583 2.784243 16.06703       2.423992 21.35724       4.431424 13.80832       2.895590 41.03831 4.505148 33.15627 3.643707 7.882046       5.794218 
1 1 1 12  19 28 o 56.52618 2.911679 39.62907       3.997267 43.10836       6.232128 37.19733       5.210139 58.30930 4.418834 54.35399 3.960705 3.955307       5.934078 
1 1 1 12  19 29 o 10.47327 4.765595 -1.381064      2.667113 -2.179698      3.901149 -0.6801713     3.654640 12.40167 5.688592 13.07637 5.791475 -0.6746950     8.117959 
1 1 1 12  19 30 o 25.52942 6.581337 9.220184       4.120473 9.220184       4.120473 0.000000       0.000000 25.52942 6.581337 ?        ?        0.000000       6.581337 
1 1 1 12  19 31 o 35.05922 4.279060 16.11582       3.580174 21.60921       4.679527 8.361448       5.559750 40.26583 4.867702 23.53672 8.055936 16.72912       9.412365 
1 1 1 12  19 32 o 34.25548 4.032979 15.46594       3.302166 16.14705       4.538373 14.69968       4.813718 33.81170 5.711253 31.63060 6.463605 2.181103       8.625347 
1 1 1 12  19 33 o 25.34069 5.339663 9.219787       3.193176 11.16165       4.401669 7.062533       4.639368 26.77188 6.749635 21.01538 7.350666 5.756500       9.979472 
1 1 1 12  19 34 o 16.55548 5.983407 3.956069       3.097290 8.122916       4.367440 -0.2599424     4.393130 22.04689 7.129539 13.52942 6.140498 8.517468       9.409360 
1 1 1 12  19 35 o 12.75432 5.749499 0.1096683      3.774654 9.066257       8.982943 -1.810915      4.159718 20.60484 9.104980 11.99257 5.626581 8.612275       10.70323 
1 1 1 12  19 36 o 11.78192 5.220172 0.4929452      2.971970 2.549865       4.147910 -1.676998      4.260345 14.74098 6.354631 11.92827 5.626702 2.812707       8.487703 
1 1 1 12  19 37 o 11.74755 5.288199 0.4326620      3.180430 2.076117       4.746107 -0.9068403     4.284799 14.28224 6.441864 12.08004 5.681114 2.202207       8.589101 
1 1 1 12  19 38 o 12.57541 5.471350 1.675328       3.132739 0.7239755      4.378685 2.672954       4.483912 12.82620 5.934684 14.18168 6.339521 -1.355481      8.683893 
1 1 1 12  20 0  o 186.8962 3.549692 426.3037       16.16692 430.0798       22.22013 422.0564       23.56614 187.5245 4.866532 185.7147 5.212376 1.809814       7.131059 
1 1 1 12  20 1  o 244.7719 3.688042 731.3369       21.99852 777.5146       35.63361 702.8989       27.96354 252.0445 5.801581 239.8172 4.784930 12.22729       7.520233 
1 1 1 12  20 2  o 245.4877 4.163600 736.0382       24.90777 652.1217       46.57980 769.6419       29.47592 230.1059 8.320498 250.9273 4.820402 -20.82143      9.615974 
1 1 1 12  20 3  o 93.51438 2.536196 106.7277       5.774257 112.5170       8.886200 102.4968       7.596660 95.92239 3.809118 91.57884 3.409970 4.343544       5.112463 
1 1 1 12  20 4  o 171.2319 3.385591 357.8539       14.12717 342.8618       27.76733 363.0899       16.40971 167.0385 6.835967 172.4321 3.905231 -5.393600      7.872818 
1 1 1 12  20 5  o 77.12851 2.613464 72.64140       4.905008 69.13358       6.886815 76.25280       6.987744 75.14996 3.772635 78.94562 3.642039 -3.795662      5.243780 
1 1 1 12  20 6  o 90.41779 2.424205 99.77698       5.336634 104.6316       8.002156 95.88839       7.161847 92.50686 3.556368 88.57175 3.324030 3.935104       4.867949 
1 1 1 12  20 7  o 170.8761 2.645205 356.1879       11.01480 381.4843       19.28876 343.9473       13.41769 176.5891 4.485967 167.8613 3.280128 8.727737       5.557261 
1 1 1 12  20 8  o 142.9439 3.959105 249.8400       13.77782 250.3070       22.60525 249.5639       17.37892 142.6515 6.519987 142.7156 5.004815 -0.6413269E-01 8.219392 
1 1 1 12  20 9  o 171.2216 4.170233 358.3603       17.40023 359.7620       28.99317 357.5713       21.75332 170.9253 6.975360 170.7968 5.232659 0.1285400      8.719883 
1 1 1 12  20 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  20 11 o 46.17985 8.316687 27.13069       9.015042 27.13069       9.015042 0.000000       0.000000 46.17985 8.316687 ?        ?        0.000000       8.316687 
1 1 1 12  20 12 o 206.5191 7.747937 527.2654       38.92347 527.2654       38.92347 0.000000       0.000000 206.5191 7.747937 ?        ?        0.000000       7.747937 
1 1 1 12  20 13 o 112.7525 4.636004 155.9427       12.71098 161.4088       17.74128 150.1775       18.22037 114.3759 6.390648 110.2162 6.817205 4.159622       9.344232 
1 1 1 12  20 14 o 121.5183 4.654830 181.1700       13.75871 184.0670       18.99524 177.9726       19.95578 122.1150 6.405619 119.9583 6.855103 2.156647       9.382131 
1 1 1 12  20 15 o 142.5079 4.841945 249.3107       16.79050 224.3707       22.17228 282.8418       25.70903 134.6955 6.776707 151.1983 6.996516 -16.50279      9.740379 
1 1 1 12  20 16 o 117.6466 4.825619 170.0916       13.80530 158.8172       18.63516 183.8055       20.55267 113.1989 6.786623 121.7569 6.955834 -8.558067      9.718122 
1 1 1 12  20 17 o 149.6264 4.994029 275.3297       18.18387 280.8438       25.47598 269.6028       25.96269 150.4661 6.966851 147.3074 7.254830 3.158707       10.05831 
1 1 1 12  20 18 o 24.75101 8.571306 6.979639       6.299945 15.86205       8.766857 -2.505192      9.059273 34.97789 9.862136 20.64235 9.131535 14.33554       13.44049 
1 1 1 12  20 19 o 98.53085 4.982113 119.7729       11.92368 119.7540       16.43547 119.7939       17.32492 97.96143 6.929516 97.84537 7.319022 0.1160583      10.07900 
1 1 1 12  20 20 o 53.55787 6.022161 35.96107       7.723764 32.86759       10.19770 40.12348       11.82907 50.44419 8.604154 55.71282 9.021028 -5.268631      12.46637 
1 1 1 12  20 21 o 49.63329 6.936059 31.33183       8.160460 30.54482       11.08228 32.26399       12.06101 48.07743 9.792146 49.24002 10.37915 -1.162598      14.26930 
1 1 1 12  20 22 o 75.24012 5.309550 70.53625       9.672647 71.12939       13.40758 69.89249       13.96800 74.76900 7.457937 73.93346 7.873769 0.8355331      10.84514 
1 1 1 12  20 23 o 52.78436 9.172117 36.94426       11.37013 0.000000       0.000000 36.94426       11.37013 ?        ?        52.78436 9.172117 0.000000       9.172117 
1 1 1 12  20 24 o 31.10938 8.441684 12.99867       6.561399 14.68030       8.763855 10.85376       9.897696 32.90291 10.02573 29.75264 10.70352 3.150265       14.66562 
1 1 1 12  20 25 o 101.3623 4.931195 128.8812       12.14394 135.3874       16.63697 121.4613       17.76691 102.6809 6.685225 96.50701 7.616392 6.173935       10.13418 
1 1 1 12  20 26 o 28.78004 8.615255 11.38807       6.512389 5.388441       8.574673 19.56617       10.01109 24.06670 9.635960 36.67588 10.60374 -12.60917      14.32798 
1 1 1 12  20 27 o 21.82191 8.134831 5.525285       5.796273 10.10743       8.016938 0.5066144      8.390125 27.31964 9.654068 20.39240 8.911733 6.927240       13.13849 
1 1 1 12  20 28 o 33.59134 2.974987 14.10715       2.410124 19.14823       4.337201 11.85513       2.898902 38.50512 4.720926 30.45029 4.003557 8.054834       6.189960 
1 1 1 12  20 29 o 50.44966 3.176367 31.94149       3.885214 34.99284       5.738172 29.35846       5.279489 52.02433 4.572646 47.60200 4.608839 4.422333       6.492340 
1 1 1 12  20 30 o 31.58162 3.318361 12.70433       2.515737 18.39364       4.769519 10.51135       2.961156 36.83379 5.480322 28.20855 4.455449 8.625240       7.062928 
1 1 1 12  20 31 o 41.05624 5.392134 23.17241       5.264534 19.18332       6.099835 34.81916       10.42279 35.72966 7.253749 45.21905 9.746111 -9.489391      12.14922 
1 1 1 12  20 32 o 24.13250 5.476005 8.377726       3.146247 6.877667       4.464190 9.858152       4.434884 21.00171 7.217733 25.07379 6.994701 -4.072081      10.05095 
1 1 1 12  20 33 o 42.15054 3.657779 23.42562       3.719976 28.04702       5.288869 18.90091       5.233253 44.83015 4.922096 35.37107 6.302505 9.459084       7.996787 
1 1 1 12  20 34 o 10.92338 4.973661 -0.7266832     2.911073 -2.111377      4.185710 0.5705320      4.051337 11.97990 5.628064 13.57956 6.051113 -1.599654      8.263841 
1 1 1 12  20 35 o 15.62705 5.887317 3.667156       3.052689 1.098120       4.289550 6.303402       4.345299 13.87363 6.201293 18.83655 7.039145 -4.962928      9.381129 
1 1 1 12  20 36 o 11.59907 5.493483 -1.720657      4.137997 0.000000       0.000000 -1.720657      4.137997 ?        ?        11.59907 5.493483 0.000000       5.493483 
1 1 1 12  20 37 o 17.32298 6.166383 5.450678       3.275965 12.09439       4.682056 -0.9212487     4.585287 24.41315 7.304208 12.24918 5.795866 12.16397       9.324350 
1 1 1 12  21 0  o 97.78108 2.633541 116.6983       6.269536 122.4640       9.602312 112.4139       8.277408 100.0642 3.945601 95.89970 3.548055 4.164497       5.306266 
1 1 1 12  21 1  o 191.1644 3.614762 446.1238       16.83926 443.2864       22.84813 449.4976       24.91442 190.3353 4.930162 191.5948 5.341400 -1.259521      7.268909 
1 1 1 12  21 2  o 112.1984 2.637823 153.5448       7.212210 159.4131       11.07429 149.2227       9.504043 114.1765 3.986299 110.5058 3.533832 3.670662       5.327152 
1 1 1 12  21 3  o 215.0617 3.394116 564.5618       17.78794 533.4608       26.80062 589.0495       23.78110 208.7239 5.273324 219.5355 4.445197 -10.81160      6.896935 
1 1 1 12  21 4  o 164.2470 2.926605 329.1581       11.71379 321.5323       17.76802 335.0204       15.57866 162.1176 4.501876 165.6181 3.859990 -3.500458      5.930127 
1 1 1 12  21 5  o 101.9627 2.978953 126.9708       7.393927 135.3819       15.03918 124.2897       8.490997 104.9391 5.904813 100.8381 3.460526 4.101013       6.844125 
1 1 1 12  21 6  o 56.42261 2.688413 38.92609       3.685819 40.50665       5.019273 37.07629       5.429993 57.48107 3.601370 54.93225 4.085606 2.548813       5.446287 
1 1 1 12  21 7  o 257.1677 3.738367 807.8831       23.42796 838.7319       37.79621 788.6353       29.85515 261.5261 5.930579 253.8700 4.825827 7.656113       7.645938 
1 1 1 12  21 8  o 87.00553 3.284846 92.55709       6.952121 123.0149       14.17891 82.91730       7.976772 99.98558 5.844768 82.27238 3.990564 17.71320       7.077140 
1 1 1 12  21 9  o 179.2143 5.272325 393.8718       23.00057 371.8808       30.21992 424.1511       35.46039 173.6625 7.156202 185.2581 7.872657 -11.59563      10.63908 
1 1 1 12  21 10 o 57.17599 5.109511 40.36731       7.044216 32.32892       8.963527 53.34984       11.39132 50.68504 7.481748 65.41484 7.268551 -14.72980      10.43113 
1 1 1 12  21 11 o 93.46320 6.828136 108.1048       15.44444 0.000000       0.000000 108.1048       15.44444 ?        ?        93.46320 6.828136 0.000000       6.828136 
1 1 1 12  21 12 o 26.92588 8.183584 9.026857       5.844163 13.12976       8.168051 4.723432       8.365268 32.26283 9.646242 24.65986 9.628109 7.602970       13.62903 
1 1 1 12  21 13 o 187.9195 5.295909 433.7139       24.22786 419.2621       33.17166 450.2380       35.47049 184.0617 7.410652 190.6544 7.650096 -6.592697      10.65090 
1 1 1 12  21 14 o 26.91743 8.364506 8.969416       6.063764 9.881989       7.975146 7.718952       9.335563 28.86427 9.649620 27.86283 10.33594 1.001432       14.14026 
1 1 1 12  21 15 o 136.9273 4.843033 230.3460       16.13464 254.5764       22.93588 206.6080       22.70158 143.4671 6.577853 129.0042 7.250491 14.46288       9.789677 
1 1 1 12  21 16 o 34.06833 7.932022 14.99618       6.461724 18.23901       8.476660 10.49780       9.983681 37.43693 9.326299 30.50675 10.77399 6.930185       14.24987 
1 1 1 12  21 17 o 89.52320 4.839297 98.75200       10.51808 105.0501       14.35039 91.44101       15.46129 91.95393 6.444896 85.46258 7.499875 6.491348       9.888620 
1 1 1 12  21 18 o 46.91284 6.343327 27.72112       7.066145 30.90440       9.195173 23.13016       11.04267 49.15979 7.946608 41.81642 10.77092 7.343369       13.38511 
1 1 1 12  21 19 o 32.03098 8.845381 13.35940       7.131695 14.01753       9.933005 12.65919       10.24574 33.29844 10.75061 32.22832 10.93790 1.070110       15.33667 
1 1 1 12  21 20 o 110.9871 4.954602 152.3374       13.36660 145.7921       17.89352 160.6012       20.10575 107.8517 6.843499 112.9826 7.342286 -5.130913      10.03706 
1 1 1 12  21 21 o 42.24828 10.65046 24.13695       10.96033 0.000000       0.000000 24.13695       10.96033 ?        ?        42.24828 10.65046 0.000000       10.65046 
1 1 1 12  21 22 o 27.60659 9.026690 9.642812       6.990567 14.62524       10.44853 5.605223       9.405796 33.45816 11.04076 25.65976 10.15130 7.798403       14.99824 
1 1 1 12  21 23 o 52.43574 6.102171 35.04145       7.651852 38.43852       10.80913 31.62898       10.83362 53.90348 8.510953 48.32103 9.539021 5.582447       12.78395 
1 1 1 12  21 24 o 68.12359 5.381581 58.64836       8.861431 63.59500       12.05926 52.84224       13.06498 70.01453 7.169118 62.83443 8.771163 7.180096       11.32826 
1 1 1 12  21 25 o 22.72814 8.432306 5.853776       6.213833 7.300097       8.292090 4.001359       9.384286 25.43032 9.675060 23.82261 9.873455 1.607716       13.82360 
1 1 1 12  21 26 f 33.30767 7.826099 15.35989       6.243830 16.61654       8.697880 14.02380       8.968558 33.76017 9.919182 31.20805 10.22550 2.552118       14.24609 
1 1 1 12  21 27 o 37.24730 9.310574 20.47843       8.427265 20.47843       8.427265 0.000000       0.000000 37.24730 9.310574 ?        ?        0.000000       9.310574 
1 1 1 12  21 28 o 19.93342 8.569740 2.118083       7.504561 2.118083       7.504561 0.000000       0.000000 19.93342 8.569740 ?        ?        0.000000       8.569740 
1 1 1 12  21 29 o 17.35534 4.265707 4.016169       1.791094 7.770436       3.410350 2.586215       2.104735 23.59246 5.937327 14.44817 4.956289 9.144286       7.734123 
1 1 1 12  21 30 o 8.954046 3.977075 -0.4325082     1.735701 -3.141644      3.632452 0.3690694      1.975865 11.01770 5.196677 10.56240 4.464055 0.4553003      6.850783 
1 1 1 12  21 31 o 10.32679 4.312062 0.5266178      1.809187 6.039575       3.757202 -1.137507      2.064264 20.13651 6.619558 9.008316 4.134272 11.12819       7.804534 
1 1 1 12  21 32 o 17.97981 5.241011 4.662699       2.436607 4.597599       4.133524 4.697367       3.016398 17.96647 6.832016 17.90354 5.933162 0.6292534E-01  9.048693 
1 1 1 12  21 33 o 12.08026 5.166235 0.7934313      2.700834 2.592374       3.937093 -0.8056509     3.711953 15.35569 6.382429 12.21272 5.581982 3.142976       8.479029 
1 1 1 12  21 34 o 9.990827 4.635531 -1.296016      2.699257 -2.032739      4.014627 -0.6882026     3.646519 11.64187 5.482508 11.97700 5.496026 -0.3351278     7.763001 
1 1 1 12  21 35 o 23.41323 6.051624 9.100206       3.477701 11.74784       5.532392 7.370525       4.471644 23.63553 8.037249 19.66577 7.177445 3.969763       10.77558 
1 1 1 12  21 36 o 9.357628 4.463643 -2.166631      2.830936 -0.3656482     4.086668 -3.828194      3.925303 12.19850 5.674801 10.20497 4.962869 1.993525       7.538795 
1 1 1 12  21 37 o 11.12015 5.289066 -1.537489      3.916388 -3.058984      9.091742 -1.190842      4.339656 14.05051 6.970850 11.75213 5.583321 2.298382       8.931193 
1 1 1 12  22 0  o 216.6105 3.799465 573.0162       20.05571 586.5322       28.56053 559.8677       28.16963 218.9018 5.354030 213.7903 5.411357 5.111511       7.612386 
1 1 1 12  22 1  o 143.4183 3.658320 251.3290       12.77520 253.4534       15.12579 246.0423       23.86096 143.9441 4.316969 141.3808 6.946935 2.563339       8.179006 
1 1 1 12  22 2  o 185.2392 3.452726 418.9250       15.58587 409.0269       21.57712 429.7241       22.53774 182.7978 4.848083 187.3522 4.940771 -4.554428      6.922075 
1 1 1 12  22 3  o 46.78154 3.349864 26.85336       3.793620 28.39306       5.074022 24.90177       5.712534 47.99550 4.386710 44.78603 5.339217 3.209469       6.910171 
1 1 1 12  22 4  o 172.6744 3.320903 364.0096       13.97398 370.2309       19.65496 357.6507       19.87121 173.9203 4.641669 170.9152 4.775661 3.005188       6.659732 
1 1 1 12  22 5  o 85.82481 3.055185 90.01686       6.379596 90.24323       12.46548 89.93654       7.425768 85.56915 6.016342 85.74078 3.561760 -0.1716309     6.991602 
1 1 1 12  22 6  o 175.4391 3.017557 375.6778       12.90084 386.3412       19.95324 368.0182       16.91096 177.6459 4.613067 173.5273 3.999120 4.118668       6.105191 
1 1 1 12  22 7  o 114.1357 2.308082 158.8958       6.419610 147.4475       10.36822 166.0132       8.175109 109.7721 3.882042 116.6295 2.876399 -6.857376      4.831555 
1 1 1 12  22 8  o 114.7438 2.589511 160.6476       7.240740 156.8667       17.36341 161.4435       7.966476 112.8172 6.341259 115.0111 2.842434 -2.193947      6.949172 
1 1 1 12  22 9  o 97.21247 2.454396 115.3717       5.809721 133.7645       15.46089 112.3476       6.269167 104.1754 6.117142 95.91055 2.684942 8.264870       6.680444 
1 1 1 12  22 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  22 11 o 40.62150 6.786377 20.86343       6.481025 23.15371       8.620169 17.88543       9.829553 42.46922 8.624002 37.27009 10.41948 5.199131       13.52549 
1 1 1 12  22 12 o 40.47966 9.763012 21.25992       9.518307 0.000000       0.000000 21.25992       9.518307 ?        ?        40.47966 9.763012 0.000000       9.763012 
1 1 1 12  22 13 o 19.38015 7.781347 2.250457       5.607992 -4.241436      6.909919 14.77805       9.598892 16.80874 7.657031 34.21632 10.50532 -17.40758      12.99969 
1 1 1 12  22 14 o 95.10896 4.737069 111.2524       10.94456 109.0665       14.93316 113.7891       16.08706 93.76360 6.577255 95.68454 6.946505 -1.920937      9.566306 
1 1 1 12  22 15 o 29.46856 8.264160 11.13009       6.173339 14.65633       7.954360 5.789217       9.789380 33.68108 9.357176 26.68076 10.41595 7.000320       14.00174 
1 1 1 12  22 16 o 104.8643 4.699952 135.3281       11.97987 151.7560       16.92397 118.8297       16.96029 110.6323 6.303548 97.59398 7.181686 13.03833       9.555696 
1 1 1 12  22 17 o 50.28466 6.160290 31.73455       7.391223 34.55685       9.786135 27.98663       11.27729 52.02619 7.972548 46.08524 10.30101 5.940948       13.02583 
1 1 1 12  22 18 o 39.52552 7.249923 20.07055       6.725822 35.62412       9.463901 4.198405       9.560330 52.88356 7.558416 25.16594 10.14047 27.71762       12.64748 
1 1 1 12  22 19 o 83.97887 7.388448 89.05109       14.96626 0.000000       0.000000 89.05109       14.96626 ?        ?        83.97887 7.388448 0.000000       7.388448 
1 1 1 12  22 20 o 59.14901 8.564160 45.35585       11.98557 0.000000       0.000000 45.35585       11.98557 ?        ?        59.14901 8.564160 0.000000       8.564160 
1 1 1 12  22 21 o 65.41845 5.772659 53.80768       9.108316 70.06665       13.30944 39.48541       12.49163 73.98737 7.484692 54.36612 9.788702 19.62126       12.32231 
1 1 1 12  22 22 o 47.46270 6.430098 28.91194       7.246034 36.17646       10.28583 21.75489       10.20947 52.36182 8.340532 39.64679 10.42919 12.71503       13.35412 
1 1 1 12  22 23 o 33.53009 8.002378 15.16029       6.447522 21.16100       8.795486 8.190413       9.479198 39.19114 9.342103 27.20452 10.34578 11.98661       13.93951 
1 1 1 12  22 24 o 39.03230 7.245965 20.32813       6.638500 25.75420       9.233289 14.52184       9.551298 43.10507 9.077374 32.22359 10.55214 10.88148       13.91928 
1 1 1 12  22 25 o 91.48624 5.030127 106.3064       11.17111 115.3967       15.85791 97.35139       15.73942 93.58057 7.004656 85.30360 7.652796 8.276978       10.37451 
1 1 1 12  22 26 o 24.16093 9.507846 6.608704       8.211987 6.608704       8.211987 0.000000       0.000000 24.16093 9.507846 ?        ?        0.000000       9.507846 
1 1 1 12  22 27 o 17.17835 7.369181 1.033523       5.526471 4.041206       7.446489 -2.654413      8.245694 21.30163 8.808796 18.11456 8.294588 3.187073       12.09938 
1 1 1 12  22 28 o 46.24868 6.896937 29.99126       7.535769 30.56432       10.40545 29.35918       10.92813 43.66540 9.995193 41.97861 10.66358 1.686790       14.61560 
1 1 1 12  22 29 f 41.82312 7.285612 25.63535       7.155676 29.49626       10.24783 21.96173       9.996172 41.57511 10.19438 34.83142 10.72530 6.743687       14.79722 
1 1 1 12  22 30 o 29.34437 3.808679 11.29520       2.659356 39.00644       11.09372 9.605706       2.739225 47.13177 9.970617 26.74444 4.352519 20.38732       10.87923 
1 1 1 12  22 31 f 19.80137 4.503121 5.441188       2.123660 8.750662       4.027515 4.166698       2.499344 23.74568 6.680737 17.10278 5.378435 6.642900       8.576702 
1 1 1 12  22 32 o 7.918493 3.774281 -2.192132      2.016036 -3.638736      3.569037 -1.514264      2.443143 10.30515 4.941497 9.455973 4.395152 0.8491802      6.613301 
1 1 1 12  22 33 o 13.61407 4.949873 2.477113       2.123870 -2.721261      4.545993 3.928591       2.402150 12.07801 5.731307 16.26583 5.289612 -4.187812      7.799222 
1 1 1 12  22 34 o 9.085814 4.099736 -0.4299134     1.924590 -2.984312      4.031256 0.3241810      2.190327 11.02687 5.277998 10.45245 4.560890 0.5744123      6.975599 
1 1 1 12  22 35 f 15.29733 5.787945 3.716370       2.957755 4.699401       4.311657 2.842584       4.065023 16.48505 6.747754 14.68533 6.310256 1.799727       9.238587 
1 1 1 12  22 36 o 13.24071 5.612875 2.192623       3.139359 5.352701       4.512165 -0.7723615     4.370662 16.64667 6.867800 12.11533 5.710083 4.531337       8.931501 
1 1 1 12  23 0  o 125.7460 3.024221 192.9714       9.267102 192.8090       12.83876 193.1481       13.38993 125.5296 4.202946 125.6173 4.380845 -0.8769226E-01 6.070960 
1 1 1 12  23 1  o 151.0647 2.881872 278.4698       10.60899 281.7095       16.39660 276.1369       13.91397 151.7220 4.439524 150.3003 3.801929 1.421738       5.845001 
1 1 1 12  23 2  o 76.69090 3.073462 71.90173       5.732278 67.66741       7.155907 79.48486       9.576300 74.31029 3.966026 80.44258 4.908491 -6.132294      6.310519 
1 1 1 12  23 3  o 148.8444 2.862095 270.3614       10.38132 275.7122       15.97844 266.4528       13.65633 150.0920 4.373248 147.6290 3.799157 2.462997       5.793004 
1 1 1 12  23 4  o 108.3088 2.648149 143.1292       6.989437 138.3524       10.31314 147.1870       9.505320 106.3199 3.987589 109.7155 3.559902 -3.395592      5.345444 
1 1 1 12  23 5  o 120.7864 3.130921 178.2345       9.207886 182.1176       11.93898 172.5340       14.46557 121.9919 4.021558 118.5907 5.016849 3.401154       6.429751 
1 1 1 12  23 6  o 46.38581 3.886704 26.48218       4.353061 27.89047       8.941905 26.04476       4.983443 46.87614 8.121964 45.91748 4.511843 0.9586563      9.291018 
1 1 1 12  23 7  o 175.3340 2.736911 375.1866       11.69400 373.1706       19.61798 376.2976       14.56432 174.5398 4.616418 175.5150 3.405178 -0.9752197     5.736423 
1 1 1 12  23 8  o 102.4140 3.053627 128.1834       7.612476 159.0464       16.63562 120.0090       8.561447 113.6240 6.029628 99.03802 3.553149 14.58595       6.998663 
1 1 1 12  23 9  o 191.1803 3.190299 446.4376       14.86314 428.1150       33.71052 450.8589       16.55961 186.0580 7.450061 192.0704 3.537965 -6.012405      8.247460 
1 1 1 12  23 10 o 96.71236 4.021250 114.6309       9.456504 133.9184       15.49730 103.1888       11.93634 104.1628 6.132437 91.53493 5.374815 12.62788       8.154472 
1 1 1 12  23 11 o 103.6655 4.727273 132.0096       11.91068 145.6640       16.71767 117.9337       16.97373 108.5625 6.346850 97.43926 7.199216 11.12321       9.597459 
1 1 1 12  23 12 o 62.58655 5.301819 48.45814       8.010145 35.23130       10.56737 66.32218       12.28086 52.58104 8.539851 72.93390 6.995429 -20.35286      11.03925 
1 1 1 12  23 13 o 39.39607 10.44573 20.25625       10.19005 0.000000       0.000000 20.25625       10.19005 ?        ?        39.39607 10.44573 0.000000       10.44573 
1 1 1 12  23 14 o 100.2722 4.716739 123.7027       11.49316 131.8430       15.86093 114.7028       16.67735 103.1316 6.341708 95.93087 7.186219 7.200699       9.584311 
1 1 1 12  23 15 o 30.57967 7.981733 12.09335       6.010396 11.64514       8.293796 12.58908       8.722357 30.61533 9.817937 31.69874 10.05779 -1.083410      14.05528 
1 1 1 12  23 16 o 43.88681 6.421221 24.35290       6.664136 19.91220       8.598495 31.03283       10.54589 38.98589 9.199944 48.87635 9.191471 -9.890457      13.00469 
1 1 1 12  23 17 o 55.12453 8.854803 39.25270       11.49218 0.000000       0.000000 39.25270       11.49218 ?        ?        55.12453 8.854803 0.000000       8.854803 
1 1 1 12  23 18 o 67.01871 5.344693 55.91303       8.656541 64.32224       12.36967 47.84175       12.11858 71.31947 7.216471 61.00649 8.372129 10.31298       11.05305 
1 1 1 12  23 19 o 17.33649 7.353745 0.4250727      5.394462 -1.769622      6.871362 3.950588       8.708976 17.96169 7.948890 23.97239 9.671748 -6.010706      12.51909 
1 1 1 12  23 20 o 66.06456 5.128444 54.52843       8.191772 44.22580       10.23379 72.90327       13.66703 58.68991 7.313714 75.44237 7.534679 -16.75246      10.50056 
1 1 1 12  23 21 o 52.02526 5.766942 34.33112       7.188673 33.38580       9.175829 35.83339       11.56716 50.54649 7.691577 51.51731 9.565842 -0.9708214     12.27460 
1 1 1 12  23 22 o 67.44989 5.156199 57.29271       8.410898 62.47417       11.05748 50.17860       12.95659 69.75813 6.582502 61.15176 8.960284 8.606373       11.11827 
1 1 1 12  23 23 o 44.05257 6.414073 25.31103       6.683538 27.96694       8.674489 21.43104       10.48461 45.50882 8.119788 38.49292 10.76097 7.015907       13.48070 
1 1 1 12  23 24 o 50.02720 8.805424 34.77653       10.34290 34.77653       10.34290 0.000000       0.000000 50.02720 8.805424 ?        ?        0.000000       8.805424 
1 1 1 12  23 25 o 41.62972 9.556853 25.42020       9.489847 25.42020       9.489847 0.000000       0.000000 41.62972 9.556853 ?        ?        0.000000       9.556853 
1 1 1 12  23 26 o 70.31973 5.209067 64.22330       8.862953 83.01878       12.70813 46.42323       12.36704 78.44672 6.712129 56.05832 9.384353 22.38839       11.53771 
1 1 1 12  23 27 o 41.39629 7.004426 24.09993       6.814183 22.63901       9.291152 25.80039       10.02393 37.49552 9.989352 39.85242 10.26053 -2.356907      14.32011 
1 1 1 12  23 28 f 20.75974 8.194756 5.427927       6.117206 -0.4120711     8.144676 12.98559       9.265336 18.41244 8.358374 27.66528 10.29047 -9.252840      13.25731 
1 1 1 12  23 29 o 23.55906 8.205160 8.818704       5.777160 8.343416       7.487705 9.517817       9.081225 23.07872 9.079823 24.11329 9.822137 -1.034567      13.37601 
1 1 1 12  23 30 o 50.42810 6.784158 38.16142       8.125608 48.65097       12.02622 29.35050       11.02202 52.09111 9.834317 37.38758 11.21175 14.70353       14.91366 
1 1 1 12  23 31 o 16.17180 5.077636 3.717102       2.228462 -2.022032      8.562537 4.134078       2.307997 16.65236 7.891358 16.95983 5.140368 -0.3074665     9.417904 
1 1 1 12  23 32 o 12.17400 4.738474 1.641737       2.021148 5.804091       4.271668 0.4411122      2.294203 18.89603 6.994957 10.96270 4.725924 7.933327       8.441788 
1 1 1 12  23 33 o 11.19398 4.725358 0.8704870      2.209653 0.4436665      3.720568 1.103073       2.746490 12.84893 5.756952 12.24246 5.221937 0.6064701      7.772459 
1 1 1 12  23 34 o 11.51922 4.683219 1.390211       2.059860 -7.761735      4.124372 4.431697       2.377629 9.171726 4.573956 16.76435 5.242097 -7.592621      6.957058 
1 1 1 12  23 35 o 11.29579 5.079820 0.2829009      2.926551 3.032544       4.349880 -1.990966      3.955685 14.78444 6.439633 11.11219 5.293813 3.672253       8.336267 
1 1 1 12  24 0  o 106.1971 2.729973 137.7033       7.059058 139.2278       10.74226 136.5446       9.364911 106.6387 4.141627 105.6624 3.642480 0.9763641      5.515499 
1 1 1 12  24 1  o 29.11162 4.891341 10.65431       3.347076 7.967856       4.576753 13.74306       4.907496 25.12968 7.139502 32.90836 6.349568 -7.778681      9.554554 
1 1 1 12  24 2  o 91.31948 2.715589 101.8502       6.036439 99.59979       8.862089 103.7980       8.244912 90.17345 4.043220 92.09885 3.681048 -1.925400      5.467883 
1 1 1 12  24 3  o 16.24656 6.081109 2.422382       3.245665 2.554352       3.642415 1.913676       7.151310 16.99498 6.424639 21.15024 8.677470 -4.155258      10.79697 
1 1 1 12  24 4  o 137.1117 3.217702 229.5690       10.75119 220.1903       13.88808 243.5949       16.98381 134.1045 4.255127 140.9402 4.952674 -6.835632      6.529555 
1 1 1 12  24 5  f 92.91948 2.658457 105.4511       6.013480 103.7833       8.697480 106.9786       8.323531 92.05660 3.885798 93.49187 3.660478 -1.435265      5.338401 
1 1 1 12  24 6  o 183.6074 3.154753 411.7045       14.11535 435.6709       22.06154 395.0935       18.36675 188.5299 4.805887 179.7069 4.194030 8.823013       6.378592 
1 1 1 12  24 7  o 61.40228 2.949501 46.14027       4.400452 55.72998       10.84210 44.24904       4.814856 66.93764 6.738306 60.09389 3.300560 6.843750       7.503230 
1 1 1 12  24 8  o 60.36727 2.321179 44.52894       3.408288 39.45197       5.194020 48.36819       4.516731 56.67479 3.782427 62.86641 2.956568 -6.191616      4.800838 
1 1 1 12  24 9  o 37.03010 3.319240 16.89046       2.963488 32.97378       9.155904 15.00836       3.132088 51.10030 7.582209 34.83187 3.748910 16.26843       8.458382 
1 1 1 12  24 10 o 135.6578 2.751971 224.7204       9.097558 204.3442       20.98844 229.4345       10.09522 128.4987 6.726050 137.0425 3.022904 -8.543839      7.374124 
1 1 1 12  24 11 o 41.86200 2.584488 21.47714       2.623662 28.58093       8.996012 20.81673       2.742907 47.33558 8.089115 41.19494 2.748031 6.140640       8.543153 
1 1 1 12  24 12 o 118.2155 4.690400 171.7641       13.48520 197.5068       19.56159 148.4514       18.61548 126.3269 6.374971 109.2866 7.027145 17.04031       9.487941 
1 1 1 12  24 13 o 21.35542 8.115952 4.097050       5.831022 0.9525853      7.534048 8.794300       9.208243 20.81370 8.752356 28.54481 10.31678 -7.731106      13.52922 
1 1 1 12  24 14 o 51.07455 9.115943 33.72008       10.92970 0.000000       0.000000 33.72008       10.92970 ?        ?        51.07455 9.115943 0.000000       9.115943 
1 1 1 12  24 15 o 105.3074 7.004186 138.6010       17.87216 0.000000       0.000000 138.6010       17.87216 ?        ?        105.3074 7.004186 0.000000       7.004186 
1 1 1 12  24 16 o 127.4785 4.806695 200.5395       14.90531 204.0043       20.52673 196.6747       21.67902 127.8629 6.610224 125.2987 7.129397 2.564125       9.722313 
1 1 1 12  24 17 o 65.67527 5.170916 53.66033       8.209003 46.41203       10.37881 65.77098       13.41570 60.45813 7.184969 71.87756 7.783246 -11.41943      10.59258 
1 1 1 12  24 18 o 48.52125 6.270151 29.86661       7.240725 41.49276       9.994114 17.02188       10.50483 56.93185 7.376924 35.75674 10.99201 21.17511       13.23795 
1 1 1 12  24 19 o 91.92847 4.762324 105.0285       10.63217 97.82056       13.96191 114.9782       16.40388 87.93675 6.562682 95.06430 7.132989 -7.127548      9.692695 
1 1 1 12  24 20 o 23.27922 8.067482 6.489805       5.581531 13.34066       6.879943 -6.700932      9.546564 31.50254 8.683345 18.83215 8.730790 12.67039       12.31370 
1 1 1 12  24 21 o 20.40193 7.735464 4.163688       5.289593 6.449390       6.781084 0.6113678      8.453671 23.93523 8.821635 21.06641 9.076590 2.868824       12.65724 
1 1 1 12  24 22 o 61.30291 7.161806 49.31120       10.49756 49.31120       10.49756 0.000000       0.000000 61.30291 7.161806 ?        ?        0.000000       7.161806 
1 1 1 12  24 23 o 15.26775 7.104771 -4.691705      6.413282 -4.691705      6.413282 0.000000       0.000000 15.26775 7.104771 ?        ?        0.000000       7.104771 
1 1 1 12  24 24 o 19.69110 7.596580 4.032371       5.159977 0.2125605      6.360762 11.38414       8.824381 17.85771 7.782553 28.45926 10.12157 -10.60156      12.76770 
1 1 1 12  24 25 o 54.70530 5.621351 39.33422       7.387356 44.43506       9.952569 33.07602       11.02399 56.76685 7.368243 46.65281 9.997408 10.11404       12.41931 
1 1 1 12  24 26 o 30.38869 7.825450 13.56496       5.829901 14.10421       7.793559 12.87985       8.784569 29.97334 9.506843 28.57450 10.10495 1.398840       13.87408 
1 1 1 12  24 27 o 27.66565 8.438552 11.92112       6.206572 16.01454       8.651484 7.580371       8.909017 30.69655 10.04224 23.70685 9.701196 6.989702       13.96280 
1 1 1 12  24 28 o 23.55429 8.437404 8.757625       6.143014 10.61691       8.591744 6.813047       8.786601 25.07692 9.767120 22.41357 9.440084 2.663351       13.58351 
1 1 1 12  24 29 o 53.75860 6.457215 42.36402       8.290078 52.80316       12.40934 33.94999       11.14085 54.98552 9.610826 41.68152 10.86067 13.30400       14.50249 
1 1 1 12  24 30 o 24.10714 8.701557 10.59775       6.547971 13.47109       10.00660 8.446065       8.659288 25.02744 10.26602 22.01008 9.325754 3.017355       13.86942 
1 1 1 12  24 31 o 18.83766 5.028654 5.182830       2.351572 0.000000       0.000000 5.182830       2.351572 ?        ?        18.83766 5.028654 0.000000       5.028654 
1 1 1 12  24 32 o 8.093162 3.854787 -2.098576      2.095274 6.528731       7.457695 -2.837939      2.183211 19.13690 8.381558 7.809961 3.775069 11.32693       9.192478 
1 1 1 12  24 33 o 12.62730 4.812470 2.071307       2.053842 7.941948       4.126368 0.1379294      2.368010 20.78246 6.940916 10.51458 4.659107 10.26788       8.359640 
1 1 1 12  24 34 o 9.903775 4.490572 -0.3196705     2.342503 -0.3921971     3.938100 -0.2799574     2.914101 12.09852 5.608504 10.87207 4.960292 1.226450       7.487310 
1 1 1 12  24 35 o 9.277839 4.297565 -0.8362452     2.305497 -1.736567      4.192030 -0.4458411     2.760468 11.41698 5.441993 10.37093 4.767439 1.046044       7.234899 
1 1 1 12  25 0  o 111.8027 2.750779 152.5495       7.494523 153.7050       11.29389 151.6403       10.01814 112.0351 4.143835 111.3359 3.697589 0.6992188      5.553695 
1 1 1 12  25 1  o 93.09158 2.751935 105.8575       6.236021 103.5854       9.232526 107.7636       8.456601 91.94041 4.131320 93.83142 3.705666 -1.891006      5.549753 
1 1 1 12  25 2  o 21.26875 6.539711 5.562317       3.718105 4.811269       4.310265 7.746280       7.350091 20.66761 7.092578 26.43501 9.251753 -5.767395      11.65760 
1 1 1 12  25 3  o 20.57638 5.823467 5.333444       3.050891 7.616579       4.072910 2.414574       4.605177 24.47940 6.654439 18.19401 7.131943 6.285389       9.754291 
1 1 1 12  25 4  o 71.70930 3.240931 62.93866       5.648816 58.41994       6.854293 72.50517       9.973133 68.98598 4.095669 76.69428 5.370141 -7.708305      6.753734 
1 1 1 12  25 5  f 62.83673 2.920429 48.31467       4.459712 49.59975       6.293608 47.01860       6.320447 63.54163 4.086142 61.84216 4.219259 1.699463       5.873559 
1 1 1 12  25 6  o 54.46208 2.719838 36.29943       3.598296 35.67945       5.342392 36.81422       4.868128 53.84241 4.102583 54.75045 3.669895 -0.9080353     5.504481 
1 1 1 12  25 7  o 45.35996 3.166667 25.25956       3.478364 25.82658       4.657748 24.54461       5.230158 45.73650 4.226844 44.47253 4.907509 1.263966       6.476871 
1 1 1 12  25 8  o 56.68431 3.041003 39.36662       4.185266 43.44184       9.369949 38.35091       4.677847 58.97960 6.634195 55.90138 3.450718 3.078217       7.477967 
1 1 1 12  25 9  o 36.71351 3.596501 16.64364       3.176440 23.01867       8.672314 15.65588       3.413666 42.24356 8.713758 35.53670 4.011979 6.706867       9.592996 
1 1 1 12  25 10 o 112.7187 2.789227 155.1956       7.661533 140.7634       16.87576 158.9425       8.598768 106.5661 6.529776 113.9964 3.098216 -7.430290      7.227511 
1 1 1 12  25 11 o 103.9634 2.963562 132.1990       7.500449 0.000000       0.000000 132.1990       7.500449 ?        ?        103.9634 2.963562 0.000000       2.963562 
1 1 1 12  25 12 o 14.79346 4.205794 2.751126       1.587702 0.000000       0.000000 2.751126       1.587702 ?        ?        14.79346 4.205794 0.000000       4.205794 
1 1 1 12  25 13 o 29.63558 10.48712 10.00303       9.462887 0.000000       0.000000 10.00303       9.462887 ?        ?        29.63558 10.48712 0.000000       10.48712 
1 1 1 12  25 14 o 92.83402 4.738956 106.3662       10.68530 110.7684       14.73010 101.4770       15.52369 94.23417 6.453433 89.94126 7.141303 4.292908       9.625227 
1 1 1 12  25 15 o 132.2030 6.983997 218.9218       22.42013 0.000000       0.000000 218.9218       22.42013 ?        ?        132.2030 6.983997 0.000000       6.983997 
1 1 1 12  25 16 o 79.21951 4.830988 77.79907       9.281850 80.61068       12.56359 74.42030       13.77259 80.10045 6.491991 76.56680 7.476560 3.533646       9.901762 
1 1 1 12  25 17 o 16.59443 7.178635 -0.3763255     5.329854 -0.2654581E-02 6.916507 -0.9226246     8.362911 19.12541 8.224809 20.38060 8.902115 -1.255190      12.12003 
1 1 1 12  25 18 o 28.88426 8.149858 11.01948       5.984685 15.20612       8.070540 5.904705       8.920371 33.61433 9.457026 25.40615 9.935759 8.208176       13.71695 
1 1 1 12  25 19 o 48.05864 5.857387 29.42540       6.718260 31.20992       8.987236 27.16516       10.11445 48.72521 7.834497 44.62543 9.586855 4.099781       12.38092 
1 1 1 12  25 20 o 23.69319 8.771751 6.270926       6.717717 6.270926       6.717717 0.000000       0.000000 23.69319 8.771751 ?        ?        0.000000       8.771751 
1 1 1 12  25 21 o 21.22789 8.431548 3.938438       6.513162 3.938438       6.513162 0.000000       0.000000 21.22789 8.431548 ?        ?        0.000000       8.431548 
1 1 1 12  25 22 o 53.43260 5.589305 36.79747       7.170262 34.90340       9.436491 39.38494       11.02939 50.71077 7.892871 53.29651 8.798901 -2.585739      11.82024 
1 1 1 12  25 23 o 36.37946 9.293195 19.34250       8.267440 19.34250       8.267440 0.000000       0.000000 36.37946 9.293195 ?        ?        0.000000       9.293195 
1 1 1 12  25 24 o 27.13265 8.010415 10.55003       5.661033 13.83835       7.342308 5.729762       8.889583 30.46059 9.154524 23.60372 9.678392 6.856867       13.32203 
1 1 1 12  25 25 o 25.56667 8.124749 9.576628       5.689908 15.05484       7.129680 -0.3243748E-01 9.442595 31.34628 8.912714 20.23110 9.109098 11.11518       12.74410 
1 1 1 12  25 26 o 51.27600 5.951993 35.97682       7.299235 48.27073       10.23947 23.27502       10.40795 57.78859 7.443795 36.25985 10.89983 21.52874       13.19911 
1 1 1 12  25 27 o 14.06471 6.448835 -1.679428      5.006759 -7.491374      6.372688 7.693719       8.092908 13.22304 6.405514 22.91135 9.294554 -9.688313      11.28802 
1 1 1 12  25 28 o 13.53111 6.266561 -1.981557      4.898692 0.2579737      6.492081 -4.942585      7.464946 16.59363 7.504569 15.14615 7.231293 1.447480       10.42162 
1 1 1 12  25 29 o 22.48730 9.414275 8.924563       8.657254 0.000000       0.000000 8.924563       8.657254 ?        ?        22.48730 9.414275 0.000000       9.414275 
1 1 1 12  25 30 o 13.00518 6.255204 -4.639358      5.818669 -6.423383      8.536034 -3.090875      7.952592 14.97979 7.292540 15.60839 7.455211 -0.6285915     10.42887 
1 1 1 12  25 31 o 15.45218 4.981490 3.480172       2.133223 4.220129       7.631907 3.417461       2.221779 18.05751 8.154507 15.32607 5.092474 2.731439       9.614014 
1 1 1 12  25 32 f 11.36624 4.704647 1.146631       2.126812 10.75556       9.217804 0.6063297      2.185788 20.59922 9.156401 10.76624 4.626736 9.832979       10.25896 
1 1 1 12  25 33 o 9.402959 4.326129 -0.7824812     2.279764 10.30595       8.815477 -1.577212      2.360048 19.60668 8.816940 8.925786 4.203464 10.68089       9.767678 
1 1 1 12  25 34 o 10.97238 5.062437 -0.4673378     3.153152 -4.640825      8.042859 0.2906161      3.427538 13.50636 6.674895 11.87719 5.403635 1.629171       8.587985 
1 1 1 12  26 0  o 54.36558 3.309241 36.23968       4.363415 40.94289       6.354317 32.04311       6.002318 57.64681 4.560450 50.90468 4.899092 6.742130       6.693191 
1 1 1 12  26 1  o 170.3490 3.509370 354.6459       14.56816 372.8618       20.12809 334.6054       21.11210 174.3893 4.740778 165.0756 5.254920 9.313705       7.077369 
1 1 1 12  26 2  o 38.47547 4.091028 18.31498       3.777031 19.37115       5.221839 17.15610       5.469845 39.33230 5.606538 36.83511 6.321181 2.497185       8.449296 
1 1 1 12  26 3  o 129.7780 2.827741 205.6410       8.942867 201.5851       13.29505 208.9925       12.08554 128.2535 4.259784 130.6677 3.799473 -2.414154      5.708043 
1 1 1 12  26 4  o 118.7899 2.793288 172.2980       8.085956 182.8406       12.15201 163.9214       10.83202 122.1561 4.087985 115.6940 3.847397 6.462074       5.613741 
1 1 1 12  26 5  o 83.07172 3.265666 84.46600       6.598028 81.67770       7.941738 90.67908       11.85491 81.59284 4.006428 85.68993 5.709751 -4.097092      6.975150 
1 1 1 12  26 6  o 14.15899 5.367265 1.751606       2.546239 0.6919960      3.537611 2.890618       3.667765 14.63795 6.064031 17.42814 6.476047 -2.790195      8.871959 
1 1 1 12  26 7  o 51.53749 2.785943 32.53408       3.485893 30.81249       5.137616 34.00280       4.745317 49.97104 4.259544 52.58503 3.727269 -2.613995      5.660058 
1 1 1 12  26 8  o 80.17004 3.081831 78.66715       6.009625 86.19912       9.159750 72.97459       7.963119 83.71752 4.506452 77.04919 4.257658 6.668335       6.199658 
1 1 1 12  26 9  o 93.06022 3.148892 106.0025       7.130696 0.000000       0.000000 106.0025       7.130696 ?        ?        93.06022 3.148892 0.000000       3.148892 
1 1 1 12  26 10 o 49.74565 3.263867 30.40173       3.934759 0.000000       0.000000 30.40173       3.934759 ?        ?        49.74565 3.263867 0.000000       3.263867 
1 1 1 12  26 11 f 134.1238 2.939786 219.9644       9.608548 195.4211       20.50680 226.8685       10.87635 125.3121 6.740155 136.1540 3.278059 -10.84195      7.495022 
1 1 1 12  26 12 o 80.37109 2.622068 79.03130       5.128593 78.57755       12.66093 79.12036       5.609406 79.27341 6.614148 80.38393 2.868191 -1.110519      7.209263 
1 1 1 12  26 13 f 92.26223 4.707199 105.1226       10.54836 105.8620       14.35489 104.2547       15.55220 92.05627 6.439590 91.12699 7.058388 0.9292755      9.554536 
1 1 1 12  26 14 f 36.50399 7.264055 17.25892       6.234468 15.38094       8.111224 19.97011       9.745881 34.14107 9.435309 38.67603 10.19719 -4.534954      13.89272 
1 1 1 12  26 15 o 24.96401 7.952184 7.809534       5.448090 8.918895       7.480089 6.556102       7.950978 27.21658 9.343298 25.35040 9.511842 1.866179       13.33313 
1 1 1 12  26 16 o 47.77417 9.333607 30.42051       10.47640 0.000000       0.000000 30.42051       10.47640 ?        ?        47.77417 9.333607 0.000000       9.333607 
1 1 1 12  26 17 o 50.50751 5.770020 32.33221       6.974543 44.69395       9.879285 20.04919       9.847776 58.99177 7.009092 38.19794 10.33204 20.79383       12.48513 
1 1 1 12  26 18 o 51.37733 7.475273 34.48978       9.084807 34.48978       9.084807 0.000000       0.000000 51.37733 7.475273 ?        ?        0.000000       7.475273 
1 1 1 12  26 19 o 63.39559 6.924860 52.14648       10.52431 52.14648       10.52431 0.000000       0.000000 63.39559 6.924860 ?        ?        0.000000       6.924860 
1 1 1 12  26 20 o 54.97695 5.388550 38.58820       7.126569 41.81533       9.313420 34.02932       11.06953 56.45201 6.914259 49.30222 9.558643 7.149784       11.79723 
1 1 1 12  26 21 o 57.44329 5.365685 42.35411       7.424150 46.87089       9.846551 36.40343       11.30193 59.49236 6.920885 50.61222 9.512637 8.880135       11.76388 
1 1 1 12  26 22 o 25.96016 7.836099 9.373347       5.371222 7.937552       6.746073 11.85979       8.877561 24.61889 8.839083 28.83944 10.16187 -4.220543      13.46822 
1 1 1 12  26 23 o 95.29706 4.929705 116.9422       11.40927 121.5382       15.14202 110.9057       17.35339 95.21268 6.566298 88.87521 8.101460 6.337479       10.42832 
1 1 1 12  26 24 o 29.08174 9.463298 13.16911       7.687780 13.16911       7.687780 0.000000       0.000000 29.08174 9.463298 ?        ?        0.000000       9.463298 
1 1 1 12  26 25 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  26 26 o 16.18604 7.008121 1.258741       5.088617 1.086206       6.389549 1.557934       8.414076 17.38044 7.679636 19.29586 8.650566 -1.915422      11.56759 
1 1 1 12  26 27 o 21.65493 9.094994 6.739621       8.119963 0.000000       0.000000 6.739621       8.119963 ?        ?        21.65493 9.094994 0.000000       9.094994 
1 1 1 12  26 28 o 25.43178 9.668383 12.62875       8.276814 0.000000       0.000000 12.62875       8.276814 ?        ?        25.43178 9.668383 0.000000       9.668383 
1 1 1 12  26 29 o 17.76044 7.594471 3.795856       5.835069 6.350709       8.260445 1.251382       8.243649 20.26044 8.848566 17.64014 8.155375 2.620300       12.03359 
1 1 1 12  26 30 o 25.84407 8.293453 12.83910       5.917399 9.539250       8.035111 16.74965       8.747081 21.41736 9.024322 26.32999 9.955466 -4.912630      13.43688 
1 1 1 12  26 31 o 9.675815 4.209386 0.2029693      1.853901 -0.1391326     7.008200 0.2287101      1.922382 15.24737 7.199722 9.848953 4.285547 5.398415       8.378658 
1 1 1 12  26 32 f 16.05376 5.125962 4.007144       2.262654 7.894854       7.959754 3.665383       2.360012 18.78135 8.417314 15.38638 5.249062 3.394975       9.919869 
1 1 1 12  26 33 o 7.838830 3.876252 -4.745227      2.726589 9.092438       7.717321 -6.718899      2.914557 18.81585 8.370028 7.449505 3.734313 11.36634       9.165285 
1 1 1 12  27 0  o 56.75531 3.327278 39.50102       4.581657 44.42266       6.625146 34.98972       6.342946 60.03988 4.562292 53.18459 4.950920 6.855293       6.732468 
1 1 1 12  27 1  o 18.88676 6.208807 4.207434       3.305387 2.370945       4.362840 6.681875       5.064233 17.78391 6.950393 23.60801 7.680562 -5.824106      10.35852 
1 1 1 12  27 2  o 93.60326 2.789393 107.0867       6.355533 104.1075       9.279937 109.7184       8.722135 92.11764 4.144573 94.62453 3.790204 -2.506889      5.616327 
1 1 1 12  27 3  o 34.91695 5.009835 15.26233       4.140865 14.58140       6.230092 15.80120       5.542214 33.64346 7.757605 35.21566 6.702988 -1.572201      10.25234 
1 1 1 12  27 4  o 152.5953 3.720715 284.9128       13.83578 281.5050       22.52351 286.9780       17.53391 151.0176 6.133054 152.8830 4.711965 -1.865417      7.734143 
1 1 1 12  27 5  o 84.76540 3.367651 87.99929       6.942511 82.80231       10.57139 91.94048       9.205999 81.90042 5.325637 86.49422 4.381926 -4.593803      6.896643 
1 1 1 12  27 6  o 100.0704 3.377124 122.6219       8.223677 122.7335       12.58489 122.5388       10.86403 99.78108 5.193527 99.85030 4.476214 -0.6921387E-01 6.856327 
1 1 1 12  27 7  o 42.29408 3.196745 21.99891       3.270365 21.47236       4.819030 22.44844       4.452656 41.52898 4.853215 42.56063 4.354450 -1.031654      6.520348 
1 1 1 12  27 8  o 59.36093 2.522462 43.11666       3.640578 37.87075       5.376669 47.55800       4.947211 55.43784 4.006927 62.26253 3.272086 -6.824688      5.173202 
1 1 1 12  27 9  o 79.55769 3.285203 77.59371       6.355431 81.55256       12.67549 76.26424       7.345465 80.86759 6.486475 78.78429 3.837532 2.083298       7.536644 
1 1 1 12  27 10 o 98.91929 2.716156 119.7075       6.541246 129.0778       15.37209 117.6356       7.228332 101.8679 6.222084 98.01050 3.030061 3.857414       6.920665 
1 1 1 12  27 11 o 94.77997 2.767961 109.9600       6.386268 113.0634       14.77201 109.2466       7.082325 95.17307 6.406593 94.41986 3.082185 0.7532120      7.109452 
1 1 1 12  27 12 o 37.59061 3.229222 17.44018       2.929467 22.62722       8.608617 16.76085       3.115397 41.51463 8.783835 36.80125 3.516598 4.713379       9.461618 
1 1 1 12  27 13 o 79.37138 2.584336 77.15250       4.991944 96.64050       13.34277 73.98072       5.382870 87.80386 6.277268 77.67823 2.848489 10.12563       6.893330 
1 1 1 12  27 14 o 94.87801 4.689724 111.6063       10.80938 99.16293       14.21541 128.6640       16.64374 88.65394 6.627963 100.9514 6.805306 -12.29747      9.499583 
1 1 1 12  27 15 o 46.49416 5.934867 27.46940       6.571186 31.22609       8.771677 22.66470       9.920039 49.02489 7.587108 40.77454 10.04919 8.250343       12.59168 
1 1 1 12  27 16 o 110.4146 6.488721 154.6579       17.38214 154.6579       17.38214 0.000000       0.000000 110.4146 6.488721 ?        ?        0.000000       6.488721 
1 1 1 12  27 17 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  27 18 f 82.04134 4.728206 84.48069       9.412860 83.27812       12.56604 86.01813       14.20832 80.44618 6.464359 81.21645 7.255303 -0.7702713     9.717374 
1 1 1 12  27 19 o 114.7116 4.725926 165.6178       13.18255 171.3291       17.97321 158.9681       19.39359 115.1306 6.431739 110.0153 7.274678 5.115372       9.710212 
1 1 1 12  27 20 o 13.23321 6.101107 -2.967472      4.567870 -0.9604859     5.607188 -6.927391      7.876189 16.17159 7.167407 16.21364 7.648871 -0.4205513E-01 10.48222 
1 1 1 12  27 21 o 21.23442 7.785223 5.457798       5.270066 9.230389       6.713006 -0.6019552     8.507946 25.87554 8.852231 19.70303 8.775043 6.172508       12.46448 
1 1 1 12  27 22 o 75.13308 5.028335 73.04218       9.153436 73.96214       11.86273 71.68848       14.39010 74.03456 6.645918 70.77647 8.514091 3.258087       10.80083 
1 1 1 12  27 23 o 20.44399 7.721285 5.169533       5.258217 4.845565       6.583785 5.740160       8.737773 21.00202 8.431659 22.98095 9.526189 -1.978924      12.72168 
1 1 1 12  27 24 o 19.46070 7.396375 4.753013       4.843079 4.880691       6.018955 4.518545       8.156546 20.30421 8.092031 21.33881 9.046580 -1.034605      12.13761 
1 1 1 12  27 25 o 25.01790 9.216252 10.27115       7.399839 10.27115       7.399839 0.000000       0.000000 25.01790 9.216252 ?        ?        0.000000       9.216252 
1 1 1 12  27 26 o 27.22934 10.03651 14.08947       8.777690 0.000000       0.000000 14.08947       8.777690 ?        ?        27.22934 10.03651 0.000000       10.03651 
1 1 1 12  27 27 o 33.09195 7.781294 17.81709       6.168781 16.38352       8.523666 19.39380       8.939101 28.62822 9.966764 30.98716 10.21159 -2.358938      14.26930 
1 1 1 12  27 28 o 14.89008 6.715416 0.3589857      5.156404 11.40886       7.051532 -12.34004      7.559448 24.28470 8.987724 12.62450 6.279006 11.66019       10.96381 
1 1 1 12  27 29 o 14.86932 6.811882 0.2413092      5.570178 1.963884       7.638770 -1.714710      8.139935 17.15276 7.901546 15.91641 7.585728 1.236355       10.95343 
1 1 1 12  27 30 o 8.246203 3.852147 -1.313365      1.914662 0.6031463      7.822663 -1.435493      1.974725 16.10223 7.604352 8.290085 3.885405 7.812147       8.539470 
1 1 1 12  27 31 o 16.03649 7.503470 2.145402       7.313344 2.145402       7.313344 0.000000       0.000000 16.03649 7.503470 ?        ?        0.000000       7.503470 
1 1 1 12  27 32 o 10.17866 4.666409 -0.5576462     2.620368 -3.010338      7.842437 -0.2494148     2.780149 14.05869 6.875759 10.69383 4.865792 3.364859       8.423301 
1 1 1 12  28 0  o 144.2909 4.684484 255.6783       16.44981 0.000000       0.000000 255.6783       16.44981 ?        ?        144.2909 4.684484 0.000000       4.684484 
1 1 1 12  28 1  o 140.2807 3.741339 241.0224       12.77830 246.7622       21.44192 237.8612       15.91277 141.2945 6.242748 139.1488 4.699522 2.145630       7.813925 
1 1 1 12  28 2  o 174.1576 3.160908 370.7983       13.41499 338.3257       19.54723 399.7094       18.44412 165.9178 4.839724 180.5923 4.191049 -14.67450      6.402173 
1 1 1 12  28 3  o 122.2466 2.841533 182.5988       8.464976 204.6704       13.15563 167.0039       11.05826 129.1463 4.185695 116.7027 3.893842 12.44360       5.716821 
1 1 1 12  28 4  o 88.85992 2.806733 96.58015       6.070131 94.05114       8.714120 98.96404       8.460423 87.49681 4.098299 89.79613 3.875449 -2.299316      5.640493 
1 1 1 12  28 5  o 205.0288 3.409411 514.4649       17.03454 498.5818       25.74937 526.8260       22.71576 201.1625 5.257218 207.1386 4.500184 -5.976105      6.920260 
1 1 1 12  28 6  o 128.1775 2.919476 200.8708       9.119121 210.1889       20.06392 198.4447       10.23763 130.1444 6.345492 127.2980 3.303001 2.846344       7.153677 
1 1 1 12  28 7  o 131.6226 3.148294 211.9870       10.09816 206.1211       13.25761 220.0930       15.58491 129.5072 4.206410 133.6603 4.792577 -4.153091      6.376729 
1 1 1 12  28 8  o 42.41405 3.103565 22.13266       3.185591 27.96733       4.553571 16.53994       4.458155 47.57639 3.963547 36.26620 5.192472 11.31019       6.532340 
1 1 1 12  28 9  o 61.10439 3.066219 45.82113       4.551156 40.32211       10.00869 47.25456       5.110017 56.29370 7.480952 62.00574 3.394802 -5.712044      8.215189 
1 1 1 12  28 10 o 72.17215 3.396984 64.00723       5.957702 79.03094       11.49006 58.48282       6.967487 79.55159 5.970594 68.82928 4.173617 10.72231       7.284716 
1 1 1 12  28 11 f 62.54522 2.800821 47.98560       4.258067 60.24694       10.27932 45.44585       4.678324 69.27349 6.153163 60.80655 3.168140 8.466942       6.920876 
1 1 1 12  28 12 o 99.28824 2.771016 120.8352       6.698044 132.8691       15.41058 118.0323       7.437276 102.9321 6.172079 98.05167 3.116554 4.880402       6.914295 
1 1 1 12  28 13 o 77.85994 2.855588 74.42426       5.408905 93.79542       12.58414 70.03456       5.990492 86.35452 6.017668 75.43751 3.266401 10.91701       6.847022 
1 1 1 12  28 14 o 54.34812 2.838781 36.33627       3.746660 37.56255       9.326607 36.10030       4.091296 53.88334 7.289658 54.11818 3.115451 -0.2348404     7.927493 
1 1 1 12  28 15 o 134.3024 2.927474 221.6064       9.581046 208.4417       20.56646 225.2554       10.82776 127.9450 6.618795 135.2587 3.285016 -7.313667      7.389166 
1 1 1 12  28 16 o 66.33540 3.089479 54.30318       4.980491 68.80415       11.22230 50.74654       5.557811 73.27229 6.347561 63.98231 3.578838 9.289982       7.286948 
1 1 1 12  28 17 o 67.44228 4.976849 57.47853       8.121804 51.38876       10.39850 67.00547       13.00609 62.71712 6.918589 71.21581 7.612273 -8.498688      10.28657 
1 1 1 12  28 18 o 31.07067 7.608040 13.23610       5.713625 16.45670       7.638820 9.146091       8.608356 34.09559 9.045803 26.93347 9.937160 7.162121       13.43777 
1 1 1 12  28 19 o 21.88271 7.563020 6.101745       4.903932 11.83068       6.448027 -1.758170      7.552641 28.94254 8.550235 18.17339 8.167660 10.76915       11.82443 
1 1 1 12  28 20 f 20.81618 7.707729 5.173656       5.187164 8.406895       6.640989 0.1146059      8.307077 24.92429 8.788493 19.82292 8.757776 5.101372       12.40710 
1 1 1 12  28 21 o 15.95009 6.889035 0.5268787      4.893169 -2.916030      5.873520 8.336720       8.846203 15.06897 6.936936 25.25667 9.889356 -10.18770      12.07975 
1 1 1 12  28 22 o 32.08500 7.541093 14.97761       5.795931 15.42532       7.508834 14.31768       9.116448 31.38574 9.214850 29.66125 10.30864 1.724495       13.82684 
1 1 1 12  28 23 o 17.43649 7.263532 2.480082       5.115613 -2.092660      6.591965 9.403412       8.111179 16.02860 7.367842 24.83602 9.539201 -8.807421      12.05328 
1 1 1 12  28 24 o 38.27045 10.54051 26.60647       10.14209 0.000000       0.000000 26.60647       10.14209 ?        ?        38.27045 10.54051 0.000000       10.54051 
1 1 1 12  28 25 o 34.49847 7.807967 18.82975       6.410499 23.12591       8.857979 14.10533       9.289000 35.67448 9.860459 27.03448 10.25070 8.640003       14.22342 
1 1 1 12  28 26 f 14.18695 6.788054 -4.803478      6.654549 -4.803478      6.654549 0.000000       0.000000 14.18695 6.788054 ?        ?        0.000000       6.788054 
1 1 1 12  28 27 o 28.86019 8.359213 14.87835       6.216295 20.17381       8.734246 9.442563       8.849217 30.96551 10.08757 22.32131 9.441153 8.644199       13.81646 
1 1 1 12  28 28 o 18.77584 7.784804 5.608519       5.837046 2.706857       7.993167 8.923882       8.543996 17.72324 8.134431 21.16523 9.122108 -3.441988      12.22219 
1 1 1 12  28 29 o 17.83071 7.667716 5.049608       6.010818 5.445459       8.492716 4.652287       8.508466 18.51894 8.456308 18.15565 8.354716 0.3632851      11.88741 
1 1 1 12  28 30 o 17.48219 8.052150 4.711396       7.928736 4.711396       7.928736 0.000000       0.000000 17.48219 8.052150 ?        ?        0.000000       8.052150 
1 1 1 12  28 31 o 23.13489 8.427123 12.58956       6.159999 14.27930       9.071280 11.14359       8.391488 21.48352 9.329089 20.10599 8.845675 1.377535       12.85604 
1 1 1 12  29 0  o 118.4711 2.898324 171.5552       8.367496 182.7208       12.76382 163.1401       11.08073 121.9604 4.301365 115.3069 3.949283 6.653442       5.839399 
1 1 1 12  29 1  o 55.39004 3.876584 37.78061       5.199560 54.48594       9.333245 30.26262       6.261175 66.18721 5.846645 49.29602 5.294941 16.89119       7.887944 
1 1 1 12  29 2  o 98.98806 2.850337 119.8781       6.868512 112.7337       9.767799 126.8659       9.660181 95.76138 4.195906 101.6555 3.906856 -5.894127      5.733162 
1 1 1 12  29 3  o 81.90157 2.921544 82.12591       5.821628 88.18134       8.418022 76.57500       8.059712 84.67976 4.091489 78.87514 4.208413 5.804619       5.869499 
1 1 1 12  29 4  o 116.4503 2.846693 165.8156       8.078250 165.3874       11.77508 166.1963       11.10324 115.9914 4.172632 116.3347 3.922164 -0.3432617     5.726624 
1 1 1 12  29 5  o 97.09636 2.803800 115.3850       6.627214 115.7394       9.557095 115.0569       9.197820 97.01138 4.051578 96.75530 3.909031 0.2560730      5.629902 
1 1 1 12  29 6  o 59.13043 2.820790 42.86510       4.052880 43.95446       5.971717 41.93487       5.518366 59.67168 4.132241 58.31903 3.905483 1.352650       5.685791 
1 1 1 12  29 7  o 40.24387 3.289792 19.97674       3.198168 22.63172       4.506857 17.28365       4.539099 42.66077 4.398163 37.06126 5.166106 5.599506       6.784725 
1 1 1 12  29 8  o 126.9256 2.821825 197.1895       8.728013 197.1399       12.55290 197.2360       12.14382 126.5338 4.076322 126.6078 3.940832 -0.7399750E-01 5.669793 
1 1 1 12  29 9  o 25.55062 5.788327 8.432489       3.520235 10.83531       7.497377 7.752964       3.987051 29.17719 9.332399 24.47360 6.554440 4.703594       11.40414 
1 1 1 12  29 10 o 106.6175 3.249752 139.6463       8.433492 130.3407       15.59352 143.4934       10.02638 101.8483 6.313860 107.9102 3.818834 -6.061905      7.378911 
1 1 1 12  29 11 o 55.29826 4.508628 38.07894       6.022956 48.57446       9.765446 31.63539       7.651603 61.80392 6.585258 49.78872 6.458499 12.01519       9.223764 
1 1 1 12  29 12 o 102.3726 4.049668 129.6773       10.08281 132.0489       15.50038 127.9377       13.27529 102.2382 6.251359 101.0801 5.409118 1.158005       8.266684 
1 1 1 12  29 13 o 48.19480 2.969643 28.64379       3.470774 39.78910       8.715135 26.54294       3.783774 55.68744 6.547088 46.30443 3.376459 9.383011       7.366467 
1 1 1 12  29 14 o 29.74844 3.492897 11.06816       2.483949 7.679604       6.493028 11.64909       2.688454 24.97321 8.698620 30.48411 3.694333 -5.510906      9.450613 
1 1 1 12  29 15 o 13.42794 5.637251 0.5057943      3.117402 -1.918238      6.158457 1.340908       3.614727 16.54114 7.409309 15.20220 6.195169 1.338934       9.658052 
1 1 1 12  29 16 o 43.18575 2.908261 23.09285       3.042778 25.28989       8.204674 22.74249       3.276422 43.08029 8.112895 42.79279 3.164291 0.2875023      8.708146 
1 1 1 12  29 17 o 87.95455 3.167305 95.90102       6.777580 95.05427       13.33110 96.19618       7.870667 85.30508 6.460948 87.82481 3.685740 -2.519730      7.438315 
1 1 1 12  29 18 o 28.50429 7.395124 11.28828       5.180203 3.907698       6.462076 24.55921       8.665176 20.75324 8.345870 41.42046 8.853206 -20.66722      12.16687 
1 1 1 12  29 19 f 45.99282 5.966918 28.09323       6.530207 30.37668       9.089680 25.65757       9.387747 46.11513 8.397813 41.43391 9.500596 4.681217       12.68009 
1 1 1 12  29 20 o 35.32427 7.067021 17.52245       5.870802 15.13479       7.594342 21.06843       9.254894 31.38805 9.280859 36.43850 10.08178 -5.050453      13.70316 
1 1 1 12  29 21 o 19.83840 7.386050 4.980668       4.775391 3.188708       6.016922 8.030485       7.849594 19.06823 7.904744 24.07638 9.347440 -5.008154      12.24172 
1 1 1 12  29 22 o 17.45341 7.907456 -0.5986342     7.246196 0.000000       0.000000 -0.5986342     7.246196 ?        ?        17.45341 7.907456 0.000000       7.907456 
1 1 1 12  29 23 o 27.12537 7.737144 11.52956       5.364475 10.26383       6.739680 13.71780       8.861669 24.98304 8.849504 27.51437 10.09407 -2.531332      13.42401 
1 1 1 12  29 24 o 33.07504 7.594216 17.15443       5.991506 17.22541       7.927607 17.05989       9.149732 30.79325 9.563223 29.54449 10.32366 1.248758       14.07243 
1 1 1 12  29 25 o 32.12920 8.143927 17.27803       6.383658 12.70106       8.641936 22.77481       9.470572 25.41974 9.824522 33.47253 10.46149 -8.052790      14.35144 
1 1 1 12  29 26 o 26.24189 8.479844 12.61624       6.179162 25.93392       9.192953 1.640327       8.345671 35.75737 10.10486 17.95471 8.266660 17.80267       13.05549 
1 1 1 12  29 27 o 33.22508 10.59789 25.77938       9.673723 25.77938       9.673723 0.000000       0.000000 33.22508 10.59789 ?        ?        0.000000       10.59789 
1 1 1 12  29 28 o 16.25290 7.439638 2.058348       6.626051 2.058348       6.626051 0.000000       0.000000 16.25290 7.439638 ?        ?        0.000000       7.439638 
1 1 1 12  29 29 o 13.14116 6.252270 -1.952355      5.481345 -7.405255      7.300541 5.093399       8.298603 12.88260 6.365301 17.81132 8.215991 -4.928720      10.39325 
1 1 1 12  29 30 o 29.27807 8.783498 19.18011       6.763671 18.69275       9.453738 19.69116       9.680856 24.02408 9.929050 24.39702 10.06190 -0.3729401     14.13605 
1 1 1 12  30 0  o 32.37144 4.801564 13.17507       3.673114 15.36238       5.080192 10.77905       5.317034 34.69445 6.238061 28.83780 7.497427 5.856642       9.753195 
1 1 1 12  30 1  o 63.70124 3.153294 49.79805       4.879737 51.84380       7.011992 47.87691       6.795098 64.77065 4.469909 62.22304 4.511997 2.547604       6.351236 
1 1 1 12  30 2  o 28.07397 6.405513 10.17647       4.285106 17.95379       7.374998 6.212716       5.265026 37.05415 8.366217 23.02780 7.840469 14.02635       11.46589 
1 1 1 12  30 3  o 42.95400 4.533030 22.96492       4.673438 18.51496       8.108090 25.17885       5.719028 37.48451 8.991870 44.82463 5.340541 -7.340118      10.45825 
1 1 1 12  30 4  f 63.96820 3.070096 50.22895       4.771803 46.39939       6.581525 54.47298       6.928538 61.22385 4.441535 66.39152 4.305679 -5.167667      6.185960 
1 1 1 12  30 5  o 47.23257 3.451031 27.51331       3.944746 25.42592       5.097236 30.63034       6.228788 45.15758 4.700719 49.48104 5.245495 -4.323460      7.043577 
1 1 1 12  30 6  f 65.20764 2.766097 52.14841       4.385452 58.28877       6.727114 47.61021       5.783276 68.70213 4.035892 62.10908 3.839826 6.593056       5.570699 
1 1 1 12  30 7  o 89.41151 2.659937 97.95876       5.789189 89.34412       8.084710 107.0243       8.293586 85.10544 3.908699 93.23080 3.657550 -8.125359      5.353093 
1 1 1 12  30 8  o 77.49623 2.678542 73.64710       5.050819 71.68175       7.038036 75.73416       7.252672 76.20640 3.801873 78.33356 3.810827 -2.127159      5.382995 
1 1 1 12  30 9  o 114.2218 3.600680 160.7648       10.00984 164.1120       17.29604 159.0791       12.27425 114.1400 6.242073 113.2854 4.454841 0.8546295      7.668708 
1 1 1 12  30 10 o 44.83453 4.067523 25.03994       4.395737 25.87621       8.204865 24.70328       5.205886 44.33472 7.883262 44.31236 4.902876 0.2236557E-01  9.283535 
1 1 1 12  30 11 o 47.33593 3.293134 27.71582       3.775025 29.52512       8.281224 27.24122       4.241340 47.51804 7.391789 46.82372 3.748353 0.6943169      8.287865 
1 1 1 12  30 12 o 16.74832 5.642979 3.342173       2.726872 3.389114       5.695075 3.328210       3.106069 20.05290 7.909676 17.10331 6.012102 2.949587       9.935207 
1 1 1 12  30 13 o 22.04366 6.628195 6.333048       3.848335 4.334001       6.590972 7.367068       4.740262 21.71340 8.525998 23.74515 7.398216 -2.031755      11.28832 
1 1 1 12  30 14 o 55.85474 2.795265 38.50841       3.792598 48.78104       9.327901 36.47388       4.151211 61.35587 6.329397 54.25987 3.153080 7.096001       7.071292 
1 1 1 12  30 15 o 13.15320 4.705781 1.893767       1.910229 1.311882       6.305867 1.952559       2.004409 18.74260 7.950479 13.39960 4.817206 5.343002       9.295999 
1 1 1 12  30 16 o 54.61340 3.241201 37.13296       4.294214 46.37543       9.476415 34.74467       4.817189 59.12863 6.694359 52.61889 3.782009 6.509743       7.688826 
1 1 1 12  30 17 o 29.48108 3.582005 11.00841       2.520648 9.764751       6.936724 11.19761       2.705596 26.39695 8.999287 29.65707 3.833252 -3.260120      9.781666 
1 1 1 12  30 18 o 40.84362 5.956368 22.32872       5.754019 19.54325       7.564926 26.15234       8.863248 36.42836 8.651194 42.09875 8.917279 -5.670383      12.42421 
1 1 1 12  30 19 o 57.95898 5.108228 44.03189       7.141090 49.88592       10.00962 37.96394       10.19087 59.97258 6.979272 50.79260 8.535755 9.179985       11.02585 
1 1 1 12  30 20 o 21.31775 8.907578 4.689577       7.728169 0.000000       0.000000 4.689577       7.728169 ?        ?        21.31775 8.907578 0.000000       8.907578 
1 1 1 12  30 21 o 41.74863 6.462561 24.71173       6.362560 24.53912       8.499289 24.93179       9.596292 38.95074 9.116511 37.96830 10.16863 0.9824409      13.65694 
1 1 1 12  30 22 o 23.28496 7.792923 8.447328       5.201194 12.57131       7.113230 3.709131       7.624562 27.10959 9.113910 19.82403 8.580871 7.285568       12.51777 
1 1 1 12  30 23 o 21.60715 7.719521 7.262228       5.138618 0.2307803      6.315819 21.03157       8.838202 16.44538 7.423098 33.49419 10.03878 -17.04881      12.48517 
1 1 1 12  30 24 o 16.20254 6.934219 2.196984       4.872140 -0.3026541     6.129702 6.485649       8.029007 15.70474 7.176175 20.93500 8.929000 -5.230261      11.45533 
1 1 1 12  30 25 o 20.36356 7.801445 6.862062       5.415728 8.542781       7.412162 4.937205       7.932254 21.70438 8.861344 19.40139 8.565331 2.302996       12.32430 
1 1 1 12  30 26 o 20.14087 8.518618 7.239109       7.203928 7.239109       7.203928 0.000000       0.000000 20.14087 8.518618 ?        ?        0.000000       8.518618 
1 1 1 12  30 27 f 36.49400 10.65816 32.12816       10.06824 32.12816       10.06824 0.000000       0.000000 36.49400 10.65816 ?        ?        0.000000       10.65816 
1 1 1 12  30 28 o 14.34202 6.755039 -0.5202538     6.098401 3.909412       8.103789 -6.304532      9.260346 17.30722 8.030793 14.54526 7.183508 2.761961       10.77481 
1 1 1 12  30 29 o 12.55564 6.033668 -2.675514      5.386400 0.3424498      7.601034 -5.719804      7.634114 15.27223 7.292980 13.37379 6.589251 1.898446       9.828824 
1 1 1 12  31 0  o 33.88409 4.610536 14.41455       3.708341 12.68652       4.914043 16.70038       5.651774 31.29940 6.648155 36.01316 6.686114 -4.713757      9.428790 
1 1 1 12  31 1  o 11.18266 5.154947 -2.481779      3.259232 -4.006512      3.934494 0.8524709      5.818231 11.63791 5.463975 18.29801 7.692764 -6.660095      9.435764 
1 1 1 12  31 2  o 28.02945 5.662880 10.10252       3.734731 9.547926       4.526296 11.28550       6.610615 27.07510 6.854698 29.42502 8.648037 -2.349915      11.03519 
1 1 1 12  31 3  o 58.52138 4.260017 42.45124       6.033617 48.48245       9.160476 37.82980       8.018703 62.01991 6.141658 54.72349 6.117589 7.296421       8.668613 
1 1 1 12  31 4  o 43.57125 4.088108 23.60210       4.289986 30.82384       5.482266 12.19486       6.890162 49.72999 4.575062 30.42533 8.797088 19.30466       9.915641 
1 1 1 12  31 5  o 53.11773 3.048742 34.72884       3.929779 41.35621       5.896783 29.43378       5.270840 57.72800 4.220894 48.58371 4.503225 9.144291       6.172113 
1 1 1 12  31 6  o 27.95984 4.537389 9.916659       2.985671 6.938503       4.156253 13.09217       4.291759 23.21642 6.866152 31.91461 5.728871 -8.698185      8.942260 
1 1 1 12  31 7  o 31.40804 3.943440 12.36167       2.951867 10.80943       3.966036 14.28950       4.419885 28.88382 5.835711 33.37482 5.634877 -4.490999      8.112173 
1 1 1 12  31 8  o 61.87622 2.638651 47.03466       3.969571 44.72534       5.665208 49.26204       5.563807 60.04542 3.892663 63.09922 3.633729 -3.053806      5.325112 
1 1 1 12  31 9  o 72.00196 3.022510 63.86177       5.291529 61.39721       10.57730 64.68449       6.111240 69.33826 6.329601 72.33867 3.476932 -3.000404      7.221697 
1 1 1 12  31 10 o 26.22336 5.273827 8.923103       3.253238 16.03808       6.226892 6.251938       3.815353 34.58792 7.596034 21.95700 6.599189 12.63092       10.06226 
1 1 1 12  31 11 o 39.22517 4.315720 19.39011       4.057208 16.60551       7.472989 20.55395       4.831236 34.65157 8.826674 40.16265 5.047485 -5.511082      10.16795 
1 1 1 12  31 12 o 54.33584 3.192772 36.59516       4.208935 50.34311       9.583709 33.30986       4.684918 62.28085 6.405794 51.66379 3.746629 10.61706       7.421012 
1 1 1 12  31 13 o 26.27914 4.609920 8.916673       2.844562 8.773990       6.288193 8.953383       3.189569 25.65785 8.568303 26.16051 5.186519 -0.5026550     10.01578 
1 1 1 12  31 14 o 36.67467 4.918924 17.32830       4.285403 22.01754       7.659718 15.19176       5.170307 39.73891 8.182420 33.62460 6.545463 6.114315       10.47831 
1 1 1 12  31 15 o 48.01786 2.921236 28.65881       3.402091 41.61160       8.998015 26.49829       3.674888 55.72044 6.765113 46.04073 3.297240 9.679707       7.525859 
1 1 1 12  31 16 o 17.91007 4.724047 4.247113       2.091095 4.173237       6.285508 4.256308       2.217403 20.57313 8.245662 17.92045 4.925757 2.652681       9.604896 
1 1 1 12  31 17 o 31.28724 3.381879 12.39699       2.537535 20.50698       7.233817 11.25901       2.709725 37.52070 8.145614 29.63768 3.842181 7.883015       9.006297 
1 1 1 12  31 18 o 22.56775 4.467207 6.755793       2.369767 0.000000       0.000000 6.755793       2.369767 ?        ?        22.56775 4.467207 0.000000       4.467207 
1 1 1 12  31 19 o 38.09297 6.587756 20.53749       5.894101 18.80062       7.806555 22.84035       8.988988 34.13981 9.183965 37.10722 9.797782 -2.967407      13.42914 
1 1 1 12  31 20 o 21.75527 7.771132 6.979599       5.207338 2.955185       6.768333 12.81718       8.151675 18.96630 8.146017 27.25025 9.724211 -8.283943      12.68534 
1 1 1 12  31 21 o 21.79189 7.940619 7.229194       5.469949 8.516814       7.224615 5.499608       8.373208 23.14011 8.972115 21.23403 9.089047 1.906078       12.77144 
1 1 1 12  31 22 o 16.91294 5.019579 3.996841       2.218150 10.30651       6.770743 3.238223       2.347712 24.40061 8.842741 15.49934 5.235989 8.901271       10.27666 
1 1 1 12  31 23 o 20.36448 7.856944 6.479256       5.520040 1.007562       7.490766 12.98169       8.165884 17.46329 7.961821 25.67780 9.638515 -8.214506      12.50166 
1 1 1 12  31 24 o 21.48639 8.173855 8.128667       5.918159 15.17138       8.479875 1.440933       8.263404 26.45760 9.843985 17.70978 8.179624 8.747820       12.79884 
1 1 1 12  31 25 o 24.49379 9.644269 13.82662       8.453526 13.82662       8.453526 0.000000       0.000000 24.49379 9.644269 ?        ?        0.000000       9.644269 
1 1 1 12  31 26 o 21.47240 8.449182 9.602405       6.484599 21.19402       9.512091 -0.4622128     8.863446 28.04354 10.42748 16.34342 7.823682 11.70013       13.03619 
1 1 1 12  31 27 o 16.50354 7.296247 3.664350       5.775252 6.635888       8.314151 0.8936763      8.028231 18.65304 8.458595 16.07800 7.625609 2.575045       11.38849 
1 1 1 12  31 28 o 15.10868 6.874722 2.094093       5.550055 0.3136356      7.485619 4.267720       8.270933 15.26076 7.273584 17.10085 7.994354 -1.840089      10.80809 
1 1 1 12  32 0  o 70.66552 3.534087 61.57375       6.066530 62.54394       10.41586 61.07567       7.463016 70.39791 6.132692 70.15456 4.387346 0.2433472      7.540473 
1 1 1 12  32 1  o 100.3910 2.872823 123.6954       7.020902 125.5119       10.22444 122.0746       9.657875 100.7229 4.174629 99.39503 3.995460 1.327827       5.778514 
1 1 1 12  32 2  o 68.65635 3.065336 57.98625       5.115622 59.07636       7.147485 56.84133       7.324943 68.99335 4.272141 67.61201 4.470837 1.381332       6.183815 
1 1 1 12  32 3  o 61.86013 3.124007 47.13012       4.694083 54.89099       6.720340 39.73640       6.559456 66.50433 4.167678 56.35815 4.822418 10.14618       6.373794 
1 1 1 12  32 4  f 65.74184 3.571803 53.41736       5.700739 62.88984       10.00500 48.86361       6.936968 70.53434 5.874042 62.58056 4.580497 7.953781       7.448847 
1 1 1 12  32 5  o 38.75261 3.681497 18.69520       3.434948 16.37426       4.789625 21.15304       4.928868 35.70785 5.695498 40.88223 5.054970 -5.174381      7.615210 
1 1 1 12  32 6  o 67.01590 2.873774 55.28434       4.682266 62.27676       6.772284 48.88092       6.480779 70.82635 3.939295 62.61702 4.272762 8.209339       5.811586 
1 1 1 12  32 7  o 54.53928 2.886044 36.67620       3.822080 28.86163       5.355340 44.78896       5.456556 47.89252 4.646969 60.05324 3.747277 -12.16072      5.969624 
1 1 1 12  32 8  o 79.08847 2.575639 76.89557       4.957408 72.65570       7.290324 80.54232       6.761207 76.42551 3.927639 80.66346 3.447577 -4.237953      5.226101 
1 1 1 12  32 9  o 50.28963 2.865481 31.24093       3.497123 32.90650       4.839047 29.42002       5.059686 51.32541 3.898085 48.37100 4.338452 2.954411       5.832429 
1 1 1 12  32 10 o 20.82930 6.131640 5.687328       3.320964 9.117043       6.361293 4.402369       3.893686 26.15392 8.614067 19.22323 6.733331 6.930696       10.93343 
1 1 1 12  32 11 o 82.41306 2.991676 84.02239       5.998262 94.48918       12.63250 80.97560       6.815597 85.41777 6.109168 80.69128 3.474241 4.726494       7.027965 
1 1 1 12  32 12 o 29.06339 5.157091 11.04033       3.518717 13.09775       6.125442 10.02704       4.298748 30.53975 8.099366 27.19040 6.563100 3.349346       10.42468 
1 1 1 12  32 13 o 43.32980 3.415043 23.52688       3.576814 16.01698       7.684727 25.60375       4.041246 33.02728 9.205319 45.10295 3.709596 -12.07567      9.924666 
1 1 1 12  32 14 o 50.79256 3.122560 32.21353       3.846295 34.99362       9.039578 31.59894       4.250234 50.15056 7.637487 50.14943 3.499814 0.1125336E-02  8.401185 
1 1 1 12  32 15 o 10.34741 4.936416 -4.074790      3.464722 0.000000       0.000000 -4.074790      3.464722 ?        ?        10.34741 4.936416 0.000000       4.936416 
1 1 1 12  32 16 o 12.19991 5.421513 -0.6599703     3.229541 0.000000       0.000000 -0.6599703     3.229541 ?        ?        12.19991 5.421513 0.000000       5.421513 
1 1 1 12  32 17 o 14.00483 4.901122 2.377791       2.062678 -0.7027700     5.899037 2.806899       2.201657 16.07777 7.222707 14.92076 5.070260 1.157010       8.824683 
1 1 1 12  32 18 o 34.32185 3.247295 15.00605       2.683695 16.64082       7.161001 14.73893       2.894659 32.07188 8.866191 33.86593 3.560710 -1.794052      9.554475 
1 1 1 12  32 19 o 42.33300 3.693662 23.14981       3.772295 20.44454       8.448117 23.82353       4.215932 34.28096 9.686590 42.66970 4.105105 -8.388737      10.52055 
1 1 1 12  32 20 o 20.10612 7.568681 5.814042       5.043073 5.891800       6.220394 5.664912       8.614491 20.55708 8.215148 21.29928 9.169578 -0.7422047     12.31137 
1 1 1 12  32 21 f 28.19543 8.271834 13.45708       6.052598 15.20619       8.236096 11.40330       8.924636 28.08341 9.795918 24.62951 9.840974 3.453892       13.88542 
1 1 1 12  32 22 o 33.90718 7.952133 19.20919       6.456257 17.69294       8.925381 20.87332       9.350500 28.89293 10.18847 31.24585 10.44865 -2.352928      14.59381 
1 1 1 12  32 23 o 14.01036 6.729032 -4.366350      6.678444 -4.366350      6.678444 0.000000       0.000000 14.01036 6.729032 ?        ?        0.000000       6.729032 
1 1 1 12  32 24 o 16.50580 7.315944 2.671748       5.842814 8.184731       8.117162 -3.255995      8.416965 20.55637 8.875696 15.50461 7.474030 5.051765       11.60341 
1 1 1 12  32 25 o 10.12886 5.049062 -9.257589      5.002309 -10.61236      7.241049 -8.020780      6.918628 12.25239 6.102316 12.61372 6.225762 -0.3613348     8.717704 
1 1 1 12  32 26 o 14.80495 6.765541 1.237646       5.449629 4.719194       7.424108 -2.830057      8.024773 17.56672 7.976673 14.77773 7.165583 2.788985       10.72254 
1 1 1 12  32 27 o 11.34629 5.591588 -6.490790      5.507991 -5.521183      7.246948 -7.817008      8.475490 13.22112 6.495467 13.49852 6.702723 -0.2774029     9.333680 
1 1 1 12  33 0  o 97.31080 3.251810 116.7110       7.700375 113.2262       10.00817 121.7671       12.05525 95.43226 4.314677 98.62239 5.032722 -3.190132      6.629082 
1 1 1 12  33 1  o 103.5723 2.897007 131.9255       7.304701 134.9384       10.68659 129.2833       10.00762 104.2137 4.216733 102.0885 4.030622 2.125183       5.833246 
1 1 1 12  33 2  o 135.3716 2.973010 225.3859       9.807537 228.5910       14.56333 222.7260       13.26703 135.5040 4.416241 133.9686 4.068538 1.535446       6.004680 
1 1 1 12  33 3  o 16.28440 6.042488 2.697113       3.190999 3.458336       4.035311 1.426697       5.213075 18.27557 6.792432 17.68147 7.346249 0.5940971      10.00522 
1 1 1 12  33 4  o 33.65218 4.323383 14.31237       3.463651 15.28817       4.494558 12.88547       5.435052 34.42417 5.546229 30.99631 7.314217 3.427864       9.179238 
1 1 1 12  33 5  o 15.09856 6.010400 1.665025       3.316793 0.8967019      5.543521 2.093440       4.139482 17.62982 7.465376 16.79157 6.704540 0.8382473      10.03408 
1 1 1 12  33 6  o 39.95655 3.506170 19.91208       3.379382 26.82525       4.891981 13.60177       4.673817 46.14079 4.404115 32.13358 6.193204 14.00721       7.599474 
1 1 1 12  33 7  o 32.88070 3.872148 13.62534       3.043204 18.80929       4.280303 8.326270       4.327566 38.44738 4.663724 24.90487 6.895321 13.54251       8.324409 
1 1 1 12  33 8  o 87.84363 2.653455 95.11707       5.673615 87.88496       8.051328 102.2508       7.996361 83.84718 3.951541 90.63168 3.627895 -6.784508      5.364355 
1 1 1 12  33 9  o 57.70747 2.703162 41.15315       3.790806 37.88894       5.356730 44.42781       5.365298 54.89419 4.032540 59.60077 3.712511 -4.706581      5.481251 
1 1 1 12  33 10 o 71.68868 3.148910 63.86409       5.487647 66.64864       10.82434 62.90081       6.366460 71.21311 6.302423 70.88393 3.698443 0.3291779      7.307464 
1 1 1 12  33 11 o 73.22259 3.071654 66.67373       5.468747 66.54022       10.95636 66.71803       6.311147 70.81158 6.418961 72.99607 3.558635 -2.184494      7.339410 
1 1 1 12  33 12 o 12.52048 5.308659 0.3910012      2.809254 3.959530       5.846934 -0.6800305     3.203205 20.01465 7.975913 12.23327 5.419835 7.781380       9.643122 
1 1 1 12  33 13 o 29.33918 5.006424 11.38121       3.451069 0.000000       0.000000 11.38121       3.451069 ?        ?        29.33918 5.006424 0.000000       5.006424 
1 1 1 12  33 14 o 19.97980 6.470243 5.424842       3.596267 0.000000       0.000000 5.424842       3.596267 ?        ?        19.97980 6.470243 0.000000       6.470243 
1 1 1 12  33 15 o 8.686495 4.060180 -1.843621      2.132114 1.060901       5.596111 -2.336838      2.306047 16.93578 7.340961 8.753225 4.132237 8.182556       8.424078 
1 1 1 12  33 16 o 30.89473 3.584442 12.28044       2.648595 26.57336       7.231040 10.06575       2.846408 42.76095 7.194495 27.57599 4.382195 15.18497       8.424036 
1 1 1 12  33 17 o 10.85525 4.904643 -0.9567085     2.765148 6.570497       5.841802 -3.130125      3.139073 21.44550 8.129658 10.05283 4.768052 11.39267       9.424736 
1 1 1 12  33 18 o 14.89307 5.540574 2.651276       2.686169 11.21340       7.196059 1.265071       2.895460 25.67615 9.139267 13.30607 5.496731 12.37007       10.66491 
1 1 1 12  33 19 o 41.73929 3.759784 22.73293       3.783284 23.05939       8.671984 22.65618       4.204498 35.72360 9.709535 41.30779 4.236801 -5.584194      10.59366 
1 1 1 12  33 20 o 8.590839 3.967709 -1.219526      1.944079 7.530879       6.781503 -2.003041      2.029250 21.55062 8.589156 8.150751 3.856357 13.39987       9.415153 
1 1 1 12  33 21 o 30.57299 10.28066 20.07422       9.051031 20.07422       9.051031 0.000000       0.000000 30.57299 10.28066 ?        ?        0.000000       10.28066 
1 1 1 12  33 22 o 39.79717 7.419977 26.10294       6.931337 41.10253       10.70961 15.29115       9.092492 45.62370 9.916381 25.63197 10.02908 19.99172       14.10380 
1 1 1 12  33 23 o 12.52288 4.683208 1.948723       1.924108 0.000000       0.000000 1.948723       1.924108 ?        ?        12.52288 4.683208 0.000000       4.683208 
1 1 1 12  33 24 o 26.14708 8.572598 14.15340       6.303030 12.84640       8.584485 15.68218       9.284242 22.71285 9.431036 24.13188 9.892472 -1.419033      13.66768 
1 1 1 12  33 25 o 16.08640 7.208038 3.013184       5.833730 -3.985378      8.137088 10.41466       8.368039 14.48526 7.066899 20.66129 8.966192 -6.176023      11.41638 
1 1 1 12  34 0  o 52.65422 3.396123 34.41579       4.334414 43.08528       6.090165 25.51697       6.170192 58.63086 4.292264 44.47545 5.833502 14.15541       7.242464 
1 1 1 12  34 1  o 26.26757 5.653129 9.067134       3.511338 9.042548       4.066632 9.139169       6.960968 26.04442 6.443233 26.46186 9.015125 -0.4174423     11.08096 
1 1 1 12  34 2  o 29.18991 4.942288 10.99376       3.390256 10.54206       4.321645 11.71657       5.466825 28.11045 6.446406 29.32911 7.590822 -1.218664      9.958752 
1 1 1 12  34 3  o 60.03043 3.233406 44.68933       4.712616 50.78956       6.531426 38.06471       6.806364 63.61941 4.237059 54.63892 5.173456 8.980492       6.687101 
1 1 1 12  34 4  o 12.46408 5.275147 0.3055699      2.765473 -0.4618667     3.341264 1.974766       4.927688 12.83978 5.617204 17.60848 7.211358 -4.768704      9.140933 
1 1 1 12  34 5  o 39.24411 3.813666 19.36522       3.601210 19.13878       4.790729 19.65940       5.460510 38.49631 5.242889 38.70984 5.981219 -0.2135315     7.953796 
1 1 1 12  34 6  o 46.49501 3.724684 27.11891       4.184918 34.55330       8.093388 24.40576       4.889278 51.03276 6.667243 43.73810 4.658829 7.294655       8.133685 
1 1 1 12  34 7  o 25.81167 5.686032 8.890956       3.479770 5.857361       5.794411 10.60215       4.351912 22.07204 8.151157 27.93600 6.513175 -5.863964      10.43373 
1 1 1 12  34 8  o 39.95331 3.311273 19.99583       3.194986 19.74823       4.346537 20.28686       4.712391 39.19927 4.640053 39.57745 4.997237 -0.3781853     6.819272 
1 1 1 12  34 9  f 21.29663 5.339444 6.077925       2.765556 3.968656       3.817357 8.407867       4.012078 18.30202 6.638720 24.71185 6.555447 -6.409828      9.329870 
1 1 1 12  34 10 o 24.71057 6.793444 8.513212       4.217269 0.000000       0.000000 8.513212       4.217269 ?        ?        24.71057 6.793444 0.000000       6.793444 
1 1 1 12  34 11 o 39.73328 4.589616 20.48431       4.362336 0.000000       0.000000 20.48431       4.362336 ?        ?        39.73328 4.589616 0.000000       4.589616 
1 1 1 12  34 12 o 50.16837 3.207759 31.66804       3.901095 46.64736       9.734271 28.80193       4.257984 57.71348 7.068739 47.58649 3.700922 10.12699       7.978966 
1 1 1 12  34 13 o 10.31327 4.648876 -0.9327291     2.467468 5.104145       5.379245 -2.541408      2.776834 20.22547 7.768374 9.732016 4.575795 10.49346       9.015849 
1 1 1 12  34 14 o 16.65225 5.592194 3.655347       2.678117 0.9815583      5.294810 4.574558       3.104521 16.38025 7.120073 18.31414 6.017024 -1.933891      9.322018 
1 1 1 12  34 15 o 12.76799 5.401717 0.7175784      2.897948 -1.185351      5.978500 1.302013       3.313210 15.64344 7.124683 14.04909 5.848427 1.594353       9.217657 
1 1 1 12  34 16 o 10.87515 4.690080 0.1470545      2.261313 0.7575794      5.805882 0.3787553E-01  2.455194 16.51881 7.308685 11.15402 4.848403 5.364787       8.770626 
1 1 1 12  34 17 o 46.88035 3.669561 28.49524       4.158808 32.38607       9.107956 27.47034       4.674574 44.47367 8.715708 45.55659 4.260109 -1.082924      9.701138 
1 1 1 12  34 18 o 20.75723 6.590841 6.521995       3.744933 15.20253       7.719774 3.850515       4.282598 28.52692 9.492894 17.43190 6.864200 11.09502       11.71462 
1 1 1 12  34 19 o 27.69043 6.098454 11.46507       4.003700 28.79644       8.616570 6.692897       4.521432 40.39505 8.985313 20.53864 7.250798 19.85641       11.54599 
1 1 1 12  34 20 o 40.98195 3.989858 22.53023       3.934227 37.10430       10.07419 19.90755       4.273583 44.28601 9.611378 37.81648 4.741340 6.469536       10.71722 
1 1 1 12  34 21 o 13.72877 5.024639 2.476756       2.193769 9.645638       7.110776 1.722642       2.306269 22.00243 8.786563 12.65261 5.019917 9.349822       10.11945 
1 1 1 12  34 22 o 10.50824 4.443574 0.6232071      1.959523 8.304568       8.246255 0.1635142      2.017305 20.37473 8.870640 10.04186 4.379468 10.33287       9.892825 
1 1 1 12  34 23 o 18.18663 4.906407 4.946870       2.224202 11.84721       8.728580 4.467701       2.300132 21.88294 9.320842 17.17078 5.115301 4.712166       10.63223 
1 1 1 12  34 24 o 17.06359 7.953112 3.333007       8.087090 0.000000       0.000000 3.333007       8.087090 ?        ?        17.06359 7.953112 0.000000       7.953112 
1 1 1 12  35 0  o 53.69578 3.404045 35.94213       4.431289 38.89966       6.171783 32.79522       6.366322 55.35826 4.617012 50.50210 5.249516 4.856159       6.991009 
1 1 1 12  35 1  o 19.78295 5.894669 5.147904       3.054184 1.897272       3.928999 10.11141       4.855033 16.12048 6.498944 27.12979 7.217947 -11.00932      9.712623 
1 1 1 12  35 2  o 59.76613 3.543806 44.64070       5.138155 43.12127       6.265759 47.76020       8.977917 58.32275 4.442003 60.32918 6.194685 -2.006435      7.622697 
1 1 1 12  35 3  o 43.35184 4.087864 23.79828       4.267587 18.54904       5.001663 37.84824       8.182837 37.58382 5.634514 53.43542 6.411948 -15.85160      8.535855 
1 1 1 12  35 4  o 15.92903 5.678695 2.937299       2.779272 6.545911       3.748475 -1.468496      4.141872 22.01920 6.522818 13.40368 6.034166 8.615520       8.885849 
1 1 1 12  35 5  o 73.51505 3.651805 67.80856       6.521662 67.38010       9.795053 68.14973       8.740771 71.87338 5.637543 72.82784 4.954616 -0.9544601     7.505338 
1 1 1 12  35 6  o 36.98886 4.576774 17.65472       4.037478 11.47149       5.328226 25.99258       6.187311 28.43954 7.559278 44.25126 5.883372 -15.81172      9.578975 
1 1 1 12  35 7  f 42.68294 3.867924 23.13811       3.979539 17.96915       6.167197 26.82586       5.209161 35.75366 7.324839 45.52328 4.766242 -9.769623      8.739012 
1 1 1 12  35 8  o 30.93222 5.427114 12.80329       3.941756 19.86557       8.177125 10.66547       4.498974 36.02772 9.262821 27.55425 6.753560 8.473475       11.46344 
1 1 1 12  35 9  o 9.978555 4.484287 -0.8522695     2.276092 -1.471338      3.039068 -0.6142506E-01 3.434920 11.14796 5.078207 13.11738 5.717836 -1.969414      7.647342 
1 1 1 12  35 10 o 14.66333 5.816726 1.934079       3.096047 2.457161       5.934396 1.738461       3.629080 18.39714 7.753798 15.15454 6.195426 3.242605       9.924953 
1 1 1 12  35 11 o 40.31346 4.340888 21.18949       4.197336 0.000000       0.000000 21.18949       4.197336 ?        ?        40.31346 4.340888 0.000000       4.340888 
1 1 1 12  35 12 o 22.74229 5.560806 7.215075       3.055687 6.949307       6.570377 7.288422       3.451686 22.26252 8.576475 22.62751 6.115412 -0.3649960     10.53348 
1 1 1 12  35 13 o 20.43217 5.763000 5.896902       2.993079 5.327930       6.729319 6.037221       3.341837 20.75947 8.455450 20.56299 6.175193 0.1964779      10.47032 
1 1 1 12  35 14 o 10.74981 4.818498 -0.6839240     2.609464 4.854334       6.402894 -1.787000      2.857541 20.01243 8.210778 10.35013 4.790850 9.662299       9.506268 
1 1 1 12  35 15 o 13.85389 5.459350 1.934226       2.710791 2.173449       6.199489 1.877675       3.014218 17.67566 7.693513 14.16391 5.698582 3.511751       9.574130 
1 1 1 12  35 16 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 12  35 17 o 25.52583 5.698901 9.519274       3.455123 3.566453       7.300451 11.23751       3.922200 18.78513 8.258073 27.54677 6.012060 -8.761642      10.21473 
1 1 1 12  35 18 f 19.13890 5.253965 5.341673       2.524573 1.943506       7.728304 5.747612       2.671111 17.80691 8.106323 19.77874 5.394079 -1.971823      9.736969 
1 1 1 12  35 19 o 24.31020 4.812772 8.424400       2.750221 31.32475       8.830199 5.964312       2.894175 41.04001 9.070962 19.81942 5.692585 21.22060       10.70924 
1 1 1 12  35 20 o 12.97137 5.588013 1.070527       3.203300 -0.6578745     8.033059 1.397332       3.493036 16.20878 7.670000 13.62996 5.853010 2.578817       9.648141 
1 1 1 12  35 21 o 10.29619 4.798417 -1.517669      2.942618 0.5705741      7.385847 -1.911685      3.208241 16.08447 7.530665 10.49560 4.929659 5.588873       9.000691 
1 1 1 12  35 22 o 13.69216 5.656985 2.098972       3.067309 12.82116       8.208250 0.3586982      3.306875 22.70371 9.303688 12.24617 5.461299 10.45754       10.78816 
1 1 1 12  36 0  o 47.14334 4.033125 28.20573       4.588917 22.61025       7.419647 31.67204       5.839809 40.00476 7.891342 49.51804 4.903819 -9.513279      9.290895 
1 1 1 12  36 1  o 39.38090 4.991460 20.19320       4.682704 18.28010       6.905307 21.82197       6.371540 35.66302 8.127274 39.94268 6.788629 -4.279667      10.58953 
1 1 1 12  36 2  o 41.35683 4.687351 22.12023       4.640808 34.32243       7.340739 13.99642       5.989639 50.71794 6.059118 31.18359 7.880031 19.53436       9.940211 
1 1 1 12  36 3  o 17.78389 6.508834 3.734520       3.681196 7.436006       5.494048 0.7189173      4.958970 23.25418 8.006529 16.18995 6.963392 7.064232       10.61100 
1 1 1 12  36 4  f 28.89082 5.367037 11.18085       3.639534 11.60905       4.454920 10.32148       6.311178 28.90585 6.484398 26.49536 8.570637 2.410490       10.74724 
1 1 1 12  36 5  o 11.98648 5.044149 0.5068103      2.505301 0.1662145      3.292073 0.9754925      3.861794 13.09635 5.653533 14.79537 6.246351 -1.699020      8.424923 
1 1 1 12  36 6  o 47.94430 3.132199 28.88697       3.639468 31.35561       5.436823 26.88254       4.899052 49.12415 4.594973 45.53392 4.472763 3.590237       6.412440 
1 1 1 12  36 7  o 12.48967 5.255816 0.6331046      2.719900 0.6844673      3.528324 0.5578802      4.269956 13.91614 5.926721 14.90698 6.436934 -0.9908409     8.749866 
1 1 1 12  36 8  o 30.64673 4.166025 12.25270       3.030820 15.04905       4.416515 9.763598       4.166828 33.16413 5.668284 26.11113 6.558238 7.052999       8.668328 
1 1 1 12  36 9  o 21.74923 5.803520 6.638876       3.132909 13.56681       6.402639 4.457947       3.592345 29.39370 8.474508 18.34948 6.464334 11.04422       10.65856 
1 1 1 12  36 10 o 41.74578 3.876532 22.52087       3.898538 35.30812       9.333963 19.81875       4.290720 48.09065 8.262343 38.66847 4.646381 9.422176       9.479198 
1 1 1 12  36 11 o 25.20052 5.334825 8.809737       3.173936 13.26497       6.911255 7.618983       3.572999 28.29598 8.949797 22.96217 6.228794 5.333811       10.90398 
1 1 1 12  36 12 o 10.45666 4.819849 -1.611669      2.848372 -6.855029      6.109523 -0.1554516     3.219701 13.07079 6.317275 12.38873 5.463708 0.6820631      8.352249 
1 1 1 12  36 13 o 22.37525 5.942177 7.277533       3.294219 15.94188       7.657591 5.309950       3.649141 29.91471 9.415256 19.19862 6.527506 10.71609       11.45667 
1 1 1 12  36 14 o 14.62222 5.802973 2.260349       3.082708 5.235064       7.415018 1.638771       3.389512 20.22685 8.602321 14.26033 5.924128 5.966517       10.44487 
1 1 1 12  36 15 o 13.83120 5.943862 1.033503       3.607385 0.000000       0.000000 1.033503       3.607385 ?        ?        13.83120 5.943862 0.000000       5.943862 
1 1 1 12  36 16 o 8.529529 4.090112 -2.871845      2.445334 0.2521093      6.474977 -3.391523      2.640907 16.11836 7.369098 8.657710 4.176724 7.460654       8.470456 
1 1 1 12  36 17 o 16.23974 5.574666 3.799912       2.662822 5.042801       7.515261 3.621473       2.847561 19.14824 8.399415 15.99904 5.742912 3.149204       10.17503 
1 1 1 12  36 18 o 12.57386 5.376169 0.9952587      2.923650 1.661269       7.375750 0.8711064      3.184514 16.95927 7.794878 12.80107 5.543258 4.158200       9.564927 
1 1 1 12  36 19 o 12.85287 5.457920 1.269675       2.977147 2.211017       7.478399 1.092392       3.245405 17.03873 7.837805 13.00358 5.613401 4.035147       9.640615 
1 1 1 12  36 20 o 9.606592 4.347848 -0.5325678     2.183902 18.13671       8.125919 -1.986047      2.267322 27.52933 9.720249 8.570202 4.061153 18.95913       10.53452 
1 1 1 12  37 0  o 13.66713 5.541643 1.360933       2.875245 1.491861       3.879535 1.201378       4.282717 15.29087 6.343831 15.55956 6.573927 -0.2686882     9.135683 
1 1 1 12  37 1  o 20.01925 6.083367 5.505440       3.229606 8.610742       4.489989 2.176498       4.648860 24.47451 7.108851 16.87939 6.968146 7.595123       9.954437 
1 1 1 12  37 2  o 20.79073 5.986331 5.993127       3.196825 9.124497       4.272686 2.010922       4.818321 25.24492 6.795815 16.88181 7.042200 8.363115       9.786505 
1 1 1 12  37 3  o 14.69840 5.638344 2.238392       2.831314 2.302915       3.705595 2.147887       4.388684 15.84559 6.337859 16.47968 6.783413 -0.6340876     9.283487 
1 1 1 12  37 4  o 13.24123 5.316440 1.406247       2.617787 2.428419       3.576890 0.2272606      3.841475 15.80732 6.257987 13.94363 6.062772 1.863689       8.713185 
1 1 1 12  37 5  o 39.93603 4.045105 20.63913       3.882453 23.36154       5.170970 17.12139       5.877964 41.75862 5.193375 34.21905 7.273267 7.539570       8.937089 
1 1 1 12  37 6  o 16.54259 5.675877 3.557554       2.760297 0.4007484      3.945590 6.583615       3.863019 14.18468 6.156170 21.43528 6.678679 -7.250603      9.083126 
1 1 1 12  37 7  o 19.49667 5.477941 5.287800       2.709740 6.700019       3.937672 4.017430       3.734683 21.52851 6.748197 17.77387 6.547459 3.754639       9.402519 
1 1 1 12  37 8  o 16.75759 5.718087 3.730523       2.800635 2.136440       3.685650 5.908622       4.308215 15.42453 6.266851 20.36091 7.085980 -4.936381      9.459627 
1 1 1 12  37 9  o 24.67864 5.739631 8.647022       3.386358 2.905983       4.774302 14.45947       4.803903 17.21815 7.079983 31.57582 6.461068 -14.35767      9.584966 
1 1 1 12  37 10 o 17.12119 6.307187 3.817098       3.465646 20.90769       6.904369 -1.939276      4.007006 36.45794 7.992223 12.33667 5.697223 24.12128       9.814987 
1 1 1 12  37 11 o 21.71071 6.279387 6.990969       3.510118 10.16447       7.107210 5.967168       4.036803 24.33175 9.019825 20.05952 6.864508 4.272234       11.33485 
1 1 1 12  37 12 o 12.14034 5.321235 0.1157426      3.011004 -1.316503      7.171050 0.4222963      3.317626 16.28743 7.556531 12.92262 5.626348 3.364814       9.421090 
1 1 1 12  37 13 o 18.50919 5.989530 5.040251       3.082087 3.879572       7.187504 5.301763       3.411676 18.92196 8.259154 18.87368 6.311418 0.4828072E-01  10.39460 
1 1 1 12  37 14 o 19.61207 6.654220 5.959900       3.791986 19.22437       8.873467 2.996352       4.194252 30.12606 10.17941 16.19309 6.644783 13.93297       12.15622 
1 1 1 12  37 15 o 12.17098 5.200418 0.7945533      2.732310 9.319244       6.971412 -0.7525746     2.969919 22.22764 8.756238 11.10174 5.042661 11.12590       10.10446 
1 1 1 12  37 16 o 18.39000 5.876050 5.180839       2.972892 11.36571       7.463725 4.014561       3.241092 23.41035 9.107533 16.59277 6.101672 6.817585       10.96255 
1 1 1 12  37 17 o 14.06851 5.496264 2.454990       2.727422 -4.933634      7.416432 3.610527       2.932954 14.22711 6.896238 15.82619 5.806954 -1.599083      9.015477 
1 1 1 12  37 18 o 17.09186 5.672287 4.491498       2.756715 -2.913923      7.052406 5.827080       2.995005 14.46642 6.939369 19.20071 5.862983 -4.734282      9.084570 
1 1 1 12  38 0  o 30.43071 4.853050 12.38550       3.478048 15.10947       4.942917 9.714268       4.894841 32.65753 6.439983 25.52917 7.424534 7.128363       9.828382 
1 1 1 12  38 1  o 42.27216 3.894600 23.04736       3.966860 27.35725       5.782345 19.21560       5.452175 45.01476 5.377486 37.01469 6.267951 8.000061       8.258605 
1 1 1 12  38 2  o 26.74396 5.137281 9.750700       3.226420 9.382770       4.416393 10.17183       4.724911 25.23680 6.957434 26.14453 7.191898 -0.9077263     10.00646 
1 1 1 12  38 3  o 14.30647 5.524512 2.133424       2.730858 4.202239       3.925737 0.1936825      3.801302 18.11085 6.705478 13.73919 6.001477 4.371660       8.998953 
1 1 1 12  38 4  o 14.62972 5.570957 2.364496       2.750813 1.645463       3.878281 3.092464       3.902305 15.15325 6.319332 16.71900 6.561756 -1.565749      9.109918 
1 1 1 12  38 5  o 21.51616 5.483970 6.513817       2.883445 5.053665       4.078997 7.972266       4.076616 19.14905 6.873437 23.18811 6.784710 -4.039063      9.657972 
1 1 1 12  38 6  o 15.15395 5.895012 2.500448       3.126777 3.171279       3.661325 0.6929737      6.009905 16.49739 6.389713 16.67714 7.404333 -0.1797562     9.780213 
1 1 1 12  38 7  o 19.89420 6.122736 5.727293       3.258160 5.509719       3.802065 6.328756       6.321512 19.53658 6.662509 21.04501 8.323238 -1.508423      10.66139 
1 1 1 12  38 8  o 22.43199 5.445734 7.171838       2.946570 9.135040       3.988811 4.813751       4.371605 24.67109 6.532598 18.69678 7.044938 5.974302       9.607600 
1 1 1 12  38 9  o 26.80847 4.464993 9.759181       2.814403 5.550015       3.796604 14.89371       4.193221 19.38741 6.656447 32.45793 5.497426 -13.07052      8.633075 
1 1 1 12  38 10 o 39.85338 4.747910 21.72225       4.520529 29.02727       9.145173 19.36020       5.200273 40.16560 9.494279 36.40747 6.075325 3.758129       11.27169 
1 1 1 12  38 11 o 15.87164 5.960301 3.304057       3.123367 8.745543       7.469207 2.150900       3.438427 22.29397 8.970172 14.71628 6.025032 7.577689       10.80579 
1 1 1 12  38 12 o 8.987849 4.360300 -4.085283      2.981098 4.923884       7.636361 -5.705124      3.238026 19.38451 8.485908 8.748184 4.306569 10.63633       9.516153 
1 1 1 12  38 13 o 17.51926 6.268552 4.573543       3.389766 2.072266       7.994370 5.121830       3.742895 17.79103 8.154204 18.28722 6.581669 -0.4961910     10.47900 
1 1 1 12  38 14 o 13.25262 5.537218 1.509408       2.986058 -0.3547348E-01 7.226158 1.827532       3.279122 16.16305 7.528186 13.93590 5.811121 2.227144       9.510138 
1 1 1 12  38 15 o 11.15570 5.023230 -0.3650358     2.872057 11.33946       7.062286 -2.684362      3.143764 23.32911 8.915945 9.971673 4.741649 13.35744       10.09838 
1 1 1 12  38 16 o 12.14639 5.239871 0.8105624      2.824173 6.025980       7.326994 -0.9949998E-01 3.060673 19.01998 8.319623 11.63724 5.217213 7.382740       9.820154 
1 1 1 12  39 0  o 32.10724 5.952029 14.60083       4.485535 18.05360       8.064005 13.05390       5.397623 32.18670 9.575274 29.07618 7.551346 3.110518       12.19462 
1 1 1 12  39 1  o 10.34640 4.878349 -2.782778      3.195997 -2.101849      3.822045 -4.365813      5.827606 11.94271 5.532442 13.70936 6.500660 -1.766643      8.536188 
1 1 1 12  39 2  f 18.10758 6.162954 4.574818       3.253034 4.861594       4.117372 4.098446       5.306660 18.77832 6.881895 18.60317 7.533836 0.1751518      10.20388 
1 1 1 12  39 3  o 21.75388 6.008605 6.894382       3.290458 14.31624       4.665056 -0.4538230     4.641852 31.33373 6.327725 14.23128 6.398956 17.10245       8.999264 
1 1 1 12  39 4  o 30.87487 4.270201 12.72900       3.126922 13.47278       4.475848 12.01989       4.370313 30.35487 6.258796 28.47584 6.448319 1.879028       8.986286 
1 1 1 12  39 5  o 20.43637 5.344424 5.963403       2.691304 5.458172       3.810036 6.466540       3.802133 19.29638 6.666473 20.72765 6.647522 -1.431273      9.414426 
1 1 1 12  39 6  o 14.28364 5.431740 2.392262       2.612819 4.404464       3.722590 0.4384516      3.668180 17.79286 6.539855 13.44758 5.884289 4.345284       8.797418 
1 1 1 12  39 7  o 18.29392 5.596001 4.847460       2.726883 5.653889       3.883120 4.062855       3.830214 19.39317 6.728576 17.32742 6.579495 2.065746       9.410817 
1 1 1 12  39 8  o 12.62028 5.334311 0.9665791      2.821787 0.7795643      3.464478 1.335157       4.863675 13.35397 5.782239 15.43688 6.764654 -2.082903      8.899148 
1 1 1 12  39 9  o 11.48792 5.213722 -0.7838163     3.166705 4.942233       6.436348 -2.612592      3.637410 19.03852 8.052176 11.04264 5.205925 7.995887       9.588492 
1 1 1 12  39 10 o 17.50066 6.258801 4.517025       3.378793 9.289340       8.138116 3.523061       3.714025 22.16207 9.190721 16.34545 6.405563 5.816616       11.20270 
1 1 1 12  39 11 o 21.30516 6.878138 7.422616       4.065929 19.44911       9.081973 4.407938       4.547064 29.26954 10.28108 17.59854 7.026825 11.67100       12.45299 
1 1 1 12  39 12 o 15.45131 6.026318 3.139004       3.274364 23.28841       8.888517 -0.2469671E-01 3.522053 32.67501 10.12271 12.50482 5.602134 20.17019       11.56950 
1 1 1 12  39 13 o 13.42969 5.967222 0.5928990      3.911103 -3.141201      8.121141 1.720490       4.462723 15.40409 7.404097 14.88714 6.502800 0.5169525      9.854292 
1 1 1 12  39 14 o 15.41932 5.841887 3.331735       3.015510 -0.3498210E-01 7.620749 3.956746       3.283507 16.12459 7.581113 16.36150 6.118019 -0.2369156     9.741839 
1 1 1 12  40 0  o 21.32603 6.234076 6.794352       3.443161 3.833665       4.797090 9.940441       4.945010 17.74622 7.171566 24.83958 7.523261 -7.093359      10.39379 
1 1 1 12  40 1  o 32.06069 5.710068 14.74948       4.297609 29.89712       8.326098 9.248131       5.017690 42.68388 8.303618 23.82209 7.636228 18.86179       11.28105 
1 1 1 12  40 2  o 16.72828 5.885140 3.884426       2.976704 7.435363       4.499068 1.119777       3.969822 21.66242 7.247832 14.39057 6.210230 7.271852       9.544529 
1 1 1 12  40 3  o 17.49705 5.854719 4.405250       2.935737 7.183836       4.329380 2.040071       3.994347 21.31455 7.109416 15.22065 6.384902 6.093897       9.555667 
1 1 1 12  40 4  o 38.24742 3.785649 19.31786       3.482170 29.70851       5.470885 12.24169       4.514769 46.33361 4.920498 28.12011 6.686725 18.21350       8.302023 
1 1 1 12  40 5  o 10.48396 4.798618 -1.110892      2.756027 0.8427393      4.088102 -2.738550      3.731486 14.16807 6.205449 11.14860 5.261045 3.019472       8.135489 
1 1 1 12  40 6  o 15.00822 5.600343 2.924835       2.748480 4.399131       3.989661 1.593172       3.791760 17.57774 6.705389 14.44045 6.146801 3.137286       9.096451 
1 1 1 12  40 7  o 18.99256 5.743402 5.408813       2.883568 6.358267       4.027894 4.410620       4.129984 19.98939 6.856437 17.56842 6.791276 2.420967       9.650500 
1 1 1 12  40 8  o 10.33612 4.737049 -1.065015      2.697341 -3.591360      3.954866 1.132245       3.688301 10.95952 5.240894 13.79476 5.969604 -2.835241      7.943748 
1 1 1 12  40 9  o 16.74029 6.761879 3.755448       4.262433 -0.2666166     7.666445 5.555037       5.128096 16.40064 7.676650 18.80490 7.477499 -2.404261      10.71653 
1 1 1 12  40 10 o 11.97515 5.579260 -1.675370      3.973647 -8.333258      7.076054 1.391290       4.802372 12.97426 6.382935 15.00809 6.643357 -2.033830      9.212820 
1 1 1 12  41 0  o 24.27336 5.916238 8.822314       3.467186 14.84272       5.275678 4.245010       4.600132 30.38675 7.229958 17.71757 7.069924 12.66918       10.11218 
1 1 1 12  41 1  o 23.18147 6.364564 8.320001       3.704404 12.51716       5.495118 4.823769       5.015330 27.02787 7.868421 18.42153 7.371583 8.606340       10.78204 
1 1 1 12  41 2  o 16.78631 6.458100 3.847245       3.721940 14.42440       8.056314 0.9771221      4.196644 26.43255 9.635974 14.33837 6.283468 12.09418       11.50365 
1 1 1 12  41 3  o 19.71095 6.537432 6.076686       3.661906 8.692351       7.242598 5.178381       4.244388 21.83627 8.816412 18.48358 6.946606 3.352690       11.22428 
1 1 1 12  41 4  f 23.84210 5.671180 8.495277       3.246764 6.232074       4.660103 10.63016       4.526065 19.65243 7.300271 25.45187 7.053568 -5.799435      10.15120 
1 1 1 12  41 5  o 15.32950 5.839221 3.105714       3.022700 3.283057       4.565704 2.967330       4.033147 16.51631 6.869645 15.85758 6.512477 0.6587248      9.465959 
1 1 1 12  41 6  o 10.90530 4.915823 -0.4998927     2.759102 -0.3149062     4.004439 -0.6670843     3.806967 12.97269 5.877773 12.45273 5.676854 0.5199594      8.171590 
1 1 1 13  0  0  f 506.6714 10.48850 3136.436       129.3766 3136.436       129.3766 3136.436       129.3766 506.6714 10.48850 506.6714 10.48850 0.000000       0.000000 
1 1 1 13  0  1  o 224.1270 4.340172 612.9067       23.68480 612.9067       23.68480 612.9067       23.68480 224.1270 4.340172 224.1270 4.340172 0.000000       0.000000 
1 1 1 13  0  2  o 231.1042 4.443232 651.6694       25.00234 651.6694       25.00234 651.6694       25.00234 231.1042 4.443232 231.1042 4.443232 0.000000       0.000000 
1 1 1 13  0  3  o 240.3719 4.581053 704.9996       26.81200 704.9996       26.81200 704.9996       26.81200 240.3719 4.581053 240.3719 4.581053 0.000000       0.000000 
1 1 1 13  0  4  o 453.8265 7.768060 2514.296       85.85223 2514.296       85.85223 2514.296       85.85223 453.8265 7.768060 453.8265 7.768060 0.000000       0.000000 
1 1 1 13  0  5  o 166.6585 4.453389 339.2753       18.05729 339.2753       18.05729 339.2753       18.05729 166.6585 4.453389 166.6585 4.453389 0.000000       0.000000 
1 1 1 13  0  6  o 368.0198 7.889636 1654.701       70.68275 1654.701       70.68275 1654.701       70.68275 368.0198 7.889636 368.0198 7.889636 0.000000       0.000000 
1 1 1 13  0  7  o 408.2222 8.666469 2036.881       86.12572 2036.881       86.12572 2036.881       86.12572 408.2222 8.666469 408.2222 8.666469 0.000000       0.000000 
1 1 1 13  0  8  o 93.66441 3.085770 107.2696       7.025931 107.2696       7.025931 107.2696       7.025931 93.66441 3.085770 93.66441 3.085770 0.000000       0.000000 
1 1 1 13  0  9  o 257.5262 4.831118 809.5030       30.29425 809.5030       30.29425 809.5030       30.29425 257.5262 4.831118 257.5262 4.831118 0.000000       0.000000 
1 1 1 13  0  10 o 116.1416 3.935135 165.0093       11.10839 165.0093       11.10839 165.0093       11.10839 116.1416 3.935135 116.1416 3.935135 0.000000       0.000000 
1 1 1 13  0  11 o 195.0716 4.030008 464.5529       19.13893 464.5529       19.13893 464.5529       19.13893 195.0716 4.030008 195.0716 4.030008 0.000000       0.000000 
1 1 1 13  0  12 o 91.78384 3.219256 103.0726       7.180310 103.0726       7.180310 103.0726       7.180310 91.78384 3.219256 91.78384 3.219256 0.000000       0.000000 
1 1 1 13  0  13 f 186.2619 3.965851 423.6440       17.98258 423.6440       17.98258 423.6440       17.98258 186.2619 3.965851 186.2619 3.965851 0.000000       0.000000 
1 1 1 13  0  14 o 82.57497 4.317439 83.84978       8.633275 83.84978       8.633275 83.84978       8.633275 82.57497 4.317439 82.57497 4.317439 0.000000       0.000000 
1 1 1 13  0  15 o 167.9517 4.622633 344.9443       18.88711 344.9443       18.88711 344.9443       18.88711 167.9517 4.622633 167.9517 4.622633 0.000000       0.000000 
1 1 1 13  0  16 o 334.4480 7.377079 1370.069       60.05815 1370.069       60.05815 1370.069       60.05815 334.4480 7.377079 334.4480 7.377079 0.000000       0.000000 
1 1 1 13  0  17 o 354.0670 7.754474 1536.806       66.83492 1536.806       66.83492 1536.806       66.83492 354.0670 7.754474 354.0670 7.754474 0.000000       0.000000 
1 1 1 13  0  18 o 95.29333 4.188028 111.4513       9.682553 111.4513       9.682553 111.4513       9.682553 95.29333 4.188028 95.29333 4.188028 0.000000       0.000000 
1 1 1 13  0  19 o 181.4437 4.925619 402.9477       21.74276 402.9477       21.74276 402.9477       21.74276 181.4437 4.925619 181.4437 4.925619 0.000000       0.000000 
1 1 1 13  0  20 o 64.94020 4.647412 52.28484       7.266392 52.28484       7.266392 52.28484       7.266392 64.94020 4.647412 64.94020 4.647412 0.000000       0.000000 
1 1 1 13  0  21 o 46.59270 5.621683 27.67584       6.136505 27.67584       6.136505 27.67584       6.136505 46.59270 5.621683 46.59270 5.621683 0.000000       0.000000 
1 1 1 13  0  22 o 93.43754 6.246563 108.3261       14.07514 108.3261       14.07514 108.3261       14.07514 93.43754 6.246563 93.43754 6.246563 0.000000       0.000000 
1 1 1 13  0  23 o 52.53859 5.694552 34.94914       7.073987 34.94914       7.073987 34.94914       7.073987 52.53859 5.694552 52.53859 5.694552 0.000000       0.000000 
1 1 1 13  0  24 f 64.42128 5.094123 51.71490       7.878768 51.71490       7.878768 51.71490       7.878768 64.42128 5.094123 64.42128 5.094123 0.000000       0.000000 
1 1 1 13  0  25 o 11.68958 7.761513 -1.557914      5.876064 -1.557914      5.876064 -1.557914      5.876064 11.68958 7.761513 11.68958 7.761513 0.000000       0.000000 
1 1 1 13  0  26 o 115.4769 4.744299 164.0608       13.29934 164.0608       13.29934 164.0608       13.29934 115.4769 4.744299 115.4769 4.744299 0.000000       0.000000 
1 1 1 13  0  27 o 60.84298 5.662886 46.61116       8.219645 46.61116       8.219645 46.61116       8.219645 60.84298 5.662886 60.84298 5.662886 0.000000       0.000000 
1 1 1 13  0  28 o 95.86511 6.770167 115.1385       15.63140 115.1385       15.63140 115.1385       15.63140 95.86511 6.770167 95.86511 6.770167 0.000000       0.000000 
1 1 1 13  0  29 o 55.84019 5.700198 39.59692       7.555984 39.59692       7.555984 39.59692       7.555984 55.84019 5.700198 55.84019 5.700198 0.000000       0.000000 
1 1 1 13  0  30 o 41.46989 7.358354 23.26253       6.738189 23.26253       6.738189 23.26253       6.738189 41.46989 7.358354 41.46989 7.358354 0.000000       0.000000 
1 1 1 13  0  31 o 30.61321 9.745272 14.91084       6.399928 14.91084       6.399928 14.91084       6.399928 30.61321 9.745272 30.61321 9.745272 0.000000       0.000000 
1 1 1 13  0  32 o 79.60180 5.129826 79.67770       9.854858 79.67770       9.854858 79.67770       9.854858 79.60180 5.129826 79.60180 5.129826 0.000000       0.000000 
1 1 1 13  0  33 o 17.35444 9.390352 5.798090       5.549372 5.798090       5.549372 5.798090       5.549372 17.35444 9.390352 17.35444 9.390352 0.000000       0.000000 
1 1 1 13  0  34 o 19.19594 10.72807 7.497164       7.503054 7.497164       7.503054 7.497164       7.503054 19.19594 10.72807 19.19594 10.72807 0.000000       0.000000 
1 1 1 13  0  35 o 12.86499 8.082173 1.904272       5.293713 1.904272       5.293713 1.904272       5.293713 12.86499 8.082173 12.86499 8.082173 0.000000       0.000000 
1 1 1 13  0  36 o 16.82782 10.37365 5.520549       8.313794 5.520549       8.313794 5.520549       8.313794 16.82782 10.37365 16.82782 10.37365 0.000000       0.000000 
1 1 1 13  0  37 f 11.62223 7.589278 0.8675650      5.267184 0.8675650      5.267184 0.8675650      5.267184 11.62223 7.589278 11.62223 7.589278 0.000000       0.000000 
1 1 1 13  0  38 o 12.14315 7.778230 1.979293       5.186895 1.979293       5.186895 1.979293       5.186895 12.14315 7.778230 12.14315 7.778230 0.000000       0.000000 
1 1 1 13  0  39 o 6.791517 4.923269 -7.490846      4.412700 -7.490846      4.412700 -7.490846      4.412700 6.791517 4.923269 6.791517 4.923269 0.000000       0.000000 
1 1 1 13  0  40 o 13.25662 8.206404 4.149798       5.255331 4.149798       5.255331 4.149798       5.255331 13.25662 8.206404 13.25662 8.206404 0.000000       0.000000 
1 1 1 13  0  41 o 16.09348 10.22548 9.737702       8.747765 9.737702       8.747765 9.737702       8.747765 16.09348 10.22548 16.09348 10.22548 0.000000       0.000000 
1 1 1 13  0  42 o 6.670964 4.863876 -7.981229      4.673168 -7.981229      4.673168 -7.981229      4.673168 6.670964 4.863876 6.670964 4.863876 0.000000       0.000000 
1 1 1 13  1  0  o 560.6309 6.650942 3834.100       90.86494 3783.150       127.2973 3887.025       129.7424 556.5741 9.385560 564.1563 9.437272 -7.582153      13.30980 
1 1 1 13  1  1  o 581.3138 6.886366 4122.823       97.55215 4068.690       136.6805 4179.031       139.2752 577.1113 9.718762 584.8762 9.771783 -7.764893      13.78195 
1 1 1 13  1  2  o 99.67429 2.219569 121.0696       5.391231 116.9959       7.498445 125.4288       7.756823 97.92545 3.146325 101.3969 3.143027 -3.471405      4.447244 
1 1 1 13  1  3  o 359.5509 4.452826 1576.155       39.01506 1549.805       54.56469 1603.719       55.80754 356.4223 6.282185 362.5664 6.316395 -6.144073      8.908574 
1 1 1 13  1  4  o 123.6298 2.804235 186.2818       8.448381 173.1600       15.41240 191.9181       10.10117 119.0350 5.326733 125.4359 3.307444 -6.400902      6.270030 
1 1 1 13  1  5  o 492.0560 8.344712 2957.954       100.0603 2994.083       173.9725 2940.094       122.3160 493.5269 14.48117 490.2390 10.23857 3.287933       17.73507 
1 1 1 13  1  6  o 395.5797 6.847998 1910.497       66.01364 1815.465       109.8235 1964.257       82.60148 384.6946 11.72871 400.8958 8.455130 -16.20114      14.45863 
1 1 1 13  1  7  o 182.3804 3.316842 405.5022       14.74141 435.2248       21.15188 377.4311       20.55590 188.9001 4.594947 175.8380 4.801692 13.06216       6.646036 
1 1 1 13  1  8  o 141.2802 2.917309 243.3160       10.04384 244.2383       19.62730 242.9888       11.69048 141.3402 5.710233 141.1735 3.398152 0.1666870      6.644863 
1 1 1 13  1  9  o 220.5735 4.355519 593.5040       23.41151 594.1489       39.90841 593.1657       28.90830 220.3204 7.443851 220.4425 5.381349 -0.1220551     9.185305 
1 1 1 13  1  10 o 254.7761 3.709856 791.6752       23.03307 763.9493       35.46337 811.9043       30.29188 250.0970 5.818826 257.9242 4.819456 -7.827133      7.555521 
1 1 1 13  1  11 o 226.6763 3.422207 626.6621       18.90377 622.4880       29.61147 629.5334       24.55960 225.7613 5.382382 227.1211 4.437391 -1.359863      6.975706 
1 1 1 13  1  12 f 86.14688 2.265880 90.53008       4.752644 87.79160       6.636444 93.41314       6.809398 84.78172 3.218001 87.45890 3.200381 -2.677177      4.538498 
1 1 1 13  1  13 o 101.1884 2.304645 124.8275       5.682909 124.8573       7.992176 124.7971       8.082277 101.1207 3.247525 101.0937 3.285114 0.2692413E-01  4.619350 
1 1 1 13  1  14 o 127.7041 2.415123 198.8436       7.515883 195.4412       10.55381 202.3448       10.70595 126.5170 3.426293 128.7345 3.415685 -2.217537      4.838015 
1 1 1 13  1  15 o 182.3788 3.398878 405.8789       15.10588 409.3835       21.43780 402.4229       21.28886 182.9661 4.812278 181.4018 4.820139 1.564270       6.811150 
1 1 1 13  1  16 o 201.4419 3.610224 495.3358       17.72230 494.1166       25.02972 496.5615       25.09664 200.9446 5.115603 201.4413 5.116615 -0.4966736     7.235271 
1 1 1 13  1  17 o 64.54879 3.112872 50.96142       4.882062 48.37231       6.832186 53.66277       6.978703 62.74960 4.497827 66.12445 4.355131 -3.374847      6.260799 
1 1 1 13  1  18 o 190.9993 3.538701 445.4644       16.47069 446.9387       23.32495 443.9982       23.26131 191.0414 5.014561 190.4109 5.017471 0.6304779      7.093718 
1 1 1 13  1  19 o 13.41345 5.693558 0.5254169E-01  3.237432 -4.776463      4.540068 5.048239       4.617763 12.49632 5.867763 21.26836 7.339566 -8.772041      9.396801 
1 1 1 13  1  20 o 188.9058 4.112895 436.3707       18.93341 467.9020       33.81462 421.9709       22.85131 194.7852 7.135873 185.5246 5.059168 9.260635       8.747335 
1 1 1 13  1  21 o 113.5509 3.080921 157.5694       8.517374 159.1890       12.18942 156.0243       11.90634 113.9596 4.397562 112.8285 4.338436 1.131096       6.177424 
1 1 1 13  1  22 o 17.03417 6.468397 2.532302       3.702044 9.024404       5.547738 -2.679372      4.970636 26.79323 7.934916 14.53617 6.571048 12.25706       10.30250 
1 1 1 13  1  23 o 79.14275 3.767368 76.80085       7.244969 75.00055       8.821677 80.53114       12.69841 78.07724 4.657674 80.55238 6.524774 -2.475136      8.016644 
1 1 1 13  1  24 o 64.86285 4.152104 51.75603       6.528505 56.98811       7.967097 41.06232       11.39008 67.96322 4.842217 56.81471 8.486524 11.14851       9.770781 
1 1 1 13  1  25 o 48.96169 4.227221 29.61682       4.994332 23.10132       6.929056 36.66186       7.205134 42.65406 6.901805 54.27653 5.524369 -11.62247      8.840450 
1 1 1 13  1  26 o 67.10464 3.695178 55.34566       6.019277 46.91413       8.341513 64.50599       8.694546 61.39473 5.638331 72.22146 4.970512 -10.82673      7.516433 
1 1 1 13  1  27 o 200.9132 4.437233 496.6736       21.72485 476.2195       25.99588 544.0384       39.55867 196.1796 5.442952 208.0228 7.817503 -11.84323      9.525707 
1 1 1 13  1  28 o 49.41439 4.324523 30.30591       5.155052 32.26198       7.386714 28.44869       7.197650 50.55077 6.120876 47.34747 6.402066 3.203300       8.857289 
1 1 1 13  1  29 o 25.99388 6.676161 8.819649       4.250855 7.971795       6.095681 9.622293       5.930938 25.38341 8.435109 27.24298 8.236634 -1.859577      11.78954 
1 1 1 13  1  30 o 68.81229 4.081510 58.78647       6.813458 59.81299       11.40864 58.21735       8.494758 68.23559 6.958259 68.10331 5.156872 0.1322784      8.660872 
1 1 1 13  1  31 o 28.03080 6.356771 10.39838       4.241880 9.001858       5.926881 11.86492       6.073660 26.11395 8.291451 29.55315 8.163611 -3.439201      11.63584 
1 1 1 13  1  32 o 62.04808 3.800829 48.10957       5.719445 41.33564       7.771473 56.11388       8.447824 56.61034 5.711422 66.28909 5.273003 -9.678757      7.773346 
1 1 1 13  1  33 o 44.90427 5.201750 26.15392       5.586946 28.93753       9.325122 24.59522       6.977989 44.91340 8.834952 42.54881 6.971061 2.364590       11.25398 
1 1 1 13  1  34 o 13.47542 5.973610 -0.6264204     3.896776 0.2343550      5.558441 -1.458348      5.464506 16.54003 7.240305 15.29155 6.903275 1.248478       10.00386 
1 1 1 13  1  35 o 22.20186 7.499682 7.128160       4.816514 3.520040       8.665513 8.741194       5.793962 20.99770 9.118087 24.10726 8.224547 -3.109560      12.27936 
1 1 1 13  1  36 o 18.67833 6.791119 4.825250       3.997803 5.558302       5.781880 4.153760       5.533772 20.17510 7.966047 18.78254 7.661093 1.392563       11.05216 
1 1 1 13  1  37 o 19.15353 7.070209 5.565747       4.358647 6.474603       5.395403 3.858341       7.395112 20.23771 7.778245 18.86476 8.301605 1.372953       11.37619 
1 1 1 13  1  38 o 13.00956 5.742290 0.5370854      3.563421 7.048684       5.048862 -5.926127      5.030069 20.22695 7.581720 11.42847 5.571321 8.798482       9.408618 
1 1 1 13  1  39 o 14.70570 6.163310 2.551950       3.716743 7.479610       5.229282 -2.478761      5.283679 19.88933 7.654143 12.87179 6.128180 7.017540       9.805125 
1 1 1 13  1  40 o 11.81908 5.543942 -1.091012      4.034546 2.360297       4.784144 -9.589474      7.507279 14.68678 6.557992 12.22341 6.107433 2.463367       8.961473 
1 1 1 13  1  41 o 13.69009 5.909059 2.541566       3.595453 4.041895       5.021066 0.9626452      5.150897 15.30956 6.784053 13.47673 6.302969 1.832823       9.260173 
1 1 1 13  1  42 o 10.84970 5.230279 -1.956800      4.122632 6.746507       8.357719 -4.755422      4.739339 15.89611 7.606229 10.39237 5.133717 5.503745       9.176589 
1 1 1 13  2  0  o 90.05052 3.022050 98.94024       6.622292 103.0815       8.047355 90.25271       11.65560 91.89235 3.600635 85.84698 5.602120 6.045372       6.659454 
1 1 1 13  2  1  o 274.4684 3.891923 918.2806       26.03111 928.7682       41.32253 911.3806       33.51777 275.9436 6.145121 273.3962 5.030909 2.547394       7.941823 
1 1 1 13  2  2  o 485.9809 6.382842 2881.191       75.59087 2846.981       118.4528 2904.694       98.18133 482.6508 10.07109 487.7593 8.260138 -5.108459      13.02523 
1 1 1 13  2  3  o 292.8932 5.295005 1046.206       37.79304 1032.879       46.01546 1073.831       66.24786 290.9556 6.489943 296.3250 9.185279 -5.369324      11.24672 
1 1 1 13  2  4  o 409.6692 6.106929 2047.594       60.96664 2031.985       85.50695 2063.736       86.95089 407.8408 8.603490 411.0051 8.681420 -3.164276      12.22240 
1 1 1 13  2  5  o 237.8289 3.916185 689.5971       22.69676 667.7783       31.17011 714.2224       33.11416 233.9697 5.466920 241.9615 5.616056 -7.991760      7.837557 
1 1 1 13  2  6  o 90.09033 2.645759 99.00790       5.802216 103.8404       6.552099 81.44681       12.49016 92.25337 2.918157 81.44154 6.343407 10.81184       6.982439 
1 1 1 13  2  7  o 183.4445 2.976603 410.2087       13.30643 417.2344       17.06549 399.3128       21.25224 184.9838 3.785724 180.8633 4.826211 4.120468       6.133842 
1 1 1 13  2  8  o 472.0580 6.234913 2721.038       71.72356 2730.734       92.59057 2706.492       113.4125 472.5605 8.040318 470.0236 9.901599 2.536896       12.75494 
1 1 1 13  2  9  o 253.1326 3.361341 781.2896       20.73466 747.7136       28.48621 819.1237       30.23865 247.5478 4.722147 259.0941 4.789264 -11.54626      6.725751 
1 1 1 13  2  10 o 263.0581 3.467029 843.8901       22.22518 827.2779       30.94901 861.5793       31.93655 260.3455 4.878210 265.6830 4.932739 -5.337433      6.937496 
1 1 1 13  2  11 o 161.0516 2.566468 316.2084       10.07249 313.8069       14.07399 318.7300       14.42169 160.3965 3.600693 161.6469 3.661109 -1.250351      5.135047 
1 1 1 13  2  12 o 176.5065 2.709950 379.8645       11.65623 383.3951       16.49929 376.3467       16.46953 177.2642 3.819515 175.6254 3.848202 1.638794       5.421933 
1 1 1 13  2  13 o 132.9601 2.648739 215.5622       8.582159 204.0509       13.18298 224.0291       11.30608 129.2212 4.191974 135.4689 3.427560 -6.247696      5.414870 
1 1 1 13  2  14 f 184.2885 3.403269 414.3763       15.28377 416.5984       21.67236 412.1779       21.55713 184.5927 4.822004 183.6101 4.822080 0.9826508      6.819397 
1 1 1 13  2  15 o 117.5569 2.576669 168.5286       7.381468 166.0687       9.565742 172.1493       11.60536 116.6119 3.369732 118.6728 4.018820 -2.060837      5.244617 
1 1 1 13  2  16 o 123.6158 2.931949 186.4153       8.832151 192.5571       12.60144 180.4851       12.38253 125.4937 4.126225 121.4853 4.188899 4.008400       5.879847 
1 1 1 13  2  17 o 217.8370 3.798340 579.5016       20.16330 604.6892       29.19338 556.5258       27.88221 222.2656 5.389842 213.1669 5.371771 9.098709       7.609620 
1 1 1 13  2  18 o 77.76386 3.427078 73.97575       6.478434 78.22113       11.37996 71.94019       7.879957 79.66656 5.903724 76.60299 4.237772 3.063568       7.267232 
1 1 1 13  2  19 f 192.8203 4.127963 454.5065       19.39656 456.6514       33.54080 453.4288       23.77537 192.5114 7.162070 192.3640 5.076296 0.1474152      8.778612 
1 1 1 13  2  20 o 116.8865 3.026016 166.9069       8.612050 158.7434       11.95001 175.7284       12.42227 113.8344 4.315648 119.7855 4.262392 -5.951126      6.065707 
1 1 1 13  2  21 o 202.5489 3.713492 501.5108       18.32941 487.6418       25.54835 516.2213       26.31191 199.3337 5.264127 205.0943 5.268931 -5.760574      7.447997 
1 1 1 13  2  22 o 150.4902 3.287944 276.7271       12.05782 278.2554       17.13817 275.2290       16.96776 150.6167 4.675000 149.7991 4.653787 0.8175964      6.596466 
1 1 1 13  2  23 o 56.27452 3.686657 38.90201       5.027853 40.06771       7.126069 37.74646       7.094949 56.89128 5.197406 55.17961 5.343145 1.711674       7.454007 
1 1 1 13  2  24 o 47.12322 4.224309 27.42861       4.799539 26.07149       6.718152 28.84332       6.859193 45.56821 6.211490 48.01533 5.992219 -2.447121      8.630718 
1 1 1 13  2  25 o 112.4363 4.557227 155.4810       12.46070 155.4810       12.46070 0.000000       0.000000 112.4363 4.557227 ?        ?        0.000000       4.557227 
1 1 1 13  2  26 o 56.97237 5.616952 40.44745       7.696992 40.44745       7.696992 0.000000       0.000000 56.97237 5.616952 ?        ?        0.000000       5.616952 
1 1 1 13  2  27 o 46.80990 4.524123 27.21637       5.096455 33.48587       7.275049 21.17451       7.141750 51.65928 5.883729 40.51794 7.509509 11.14134       9.539968 
1 1 1 13  2  28 o 19.77313 6.960746 4.366595       4.164696 2.512917       5.884819 6.226526       5.894733 19.77711 7.960517 23.43712 8.278591 -3.660007      11.48499 
1 1 1 13  2  29 o 42.27281 5.344880 22.56504       5.383120 31.66726       9.534204 18.30550       6.522171 49.18037 8.246974 37.40816 7.416776 11.77221       11.09149 
1 1 1 13  2  30 o 80.59879 3.414160 80.16209       6.690580 89.89680       9.559566 70.81524       9.367186 84.91812 4.637169 75.13877 5.146827 9.779350       6.927710 
1 1 1 13  2  31 o 27.68543 7.185496 10.28055       4.889398 17.46099       8.674075 6.936582       5.919414 35.25811 9.762252 23.75482 8.303438 11.50329       12.81595 
1 1 1 13  2  32 o 54.69072 4.676060 37.91838       6.172299 46.39788       10.67934 33.66504       7.563530 58.76303 7.638267 50.74597 6.248036 8.017063       9.868186 
1 1 1 13  2  33 o 46.58664 5.575140 28.39044       6.203734 21.18844       11.38848 31.42930       7.397670 36.42120 11.48458 48.53331 6.411560 -12.11211      13.15309 
1 1 1 13  2  34 o 17.22279 6.752765 2.965243       4.129309 1.365760       6.103415 4.315364       5.607501 17.96899 7.726857 19.93141 7.852671 -1.962420      11.01675 
1 1 1 13  2  35 o 18.66524 6.800162 4.519241       4.011315 2.599947       5.639453 6.484691       5.706861 18.03387 7.577193 21.63444 8.070483 -3.600574      11.07007 
1 1 1 13  2  36 o 27.38268 6.591054 11.14880       4.344852 12.56213       6.142672 9.733739       6.146427 27.56215 8.392618 24.35986 8.464572 3.202295       11.91994 
1 1 1 13  2  37 o 21.31710 6.811402 7.178797       3.994663 4.590728       5.522384 10.01927       5.785403 18.48623 7.609320 23.88649 8.216400 -5.400253      11.19870 
1 1 1 13  2  38 o 13.51935 6.003582 0.5853612      3.953150 0.9110191      4.676423 -0.2300126     7.399653 14.53652 6.487805 16.11325 7.542055 -1.576727      9.948579 
1 1 1 13  2  39 o 14.06069 6.166992 1.556753       4.050165 3.995379       4.847769 -4.079808      7.370152 16.59717 7.002303 14.09629 6.842618 2.500884       9.790489 
1 1 1 13  2  40 o 12.46611 5.566626 0.8192337      3.447390 -0.1660388     4.703983 1.962406       5.066913 13.02060 6.067682 14.55922 6.602619 -1.538628      8.967237 
1 1 1 13  2  41 o 20.04630 6.729260 8.075174       3.877958 13.60913       5.419425 2.268234       5.551481 24.14797 7.950702 14.34576 6.653275 9.802202       10.36724 
1 1 1 13  2  42 o 11.80061 5.437050 0.6047238      3.619194 0.7881790      5.242821 0.4377165      5.002275 12.98103 6.158387 12.68256 6.016399 0.2984715      8.609459 
1 1 1 13  3  0  o 219.0547 3.296133 584.8457       17.59517 572.5843       27.32113 593.5351       22.99978 216.6988 5.173757 220.6534 4.277371 -3.954620      6.712948 
1 1 1 13  3  1  o 172.0348 3.646129 360.7497       15.28567 364.9315       18.84205 352.6993       26.14295 172.9544 4.474302 169.9215 6.324536 3.032928       7.747202 
1 1 1 13  3  2  o 284.6219 4.475402 987.6692       31.04106 987.3133       35.84858 988.7355       62.05379 284.5413 5.170002 284.3705 8.965833 0.1707153      10.34964 
1 1 1 13  3  3  o 605.7054 7.856853 4479.446       115.9701 4421.630       148.2533 4570.603       186.1559 601.3766 10.11630 610.8737 12.50516 -9.497131      16.08473 
1 1 1 13  3  4  o 267.0757 3.821157 869.5740       24.86940 936.4059       40.51785 829.1769       31.50138 277.0406 6.001598 260.7508 4.957559 16.28979       7.784379 
1 1 1 13  3  5  o 389.9179 5.238203 1854.535       49.77275 1812.660       62.88729 1924.746       81.43160 385.3551 6.696775 396.8818 8.419683 -11.52673      10.75815 
1 1 1 13  3  6  o 133.0309 2.556614 215.6947       8.288075 217.7812       10.41832 212.0981       13.67859 133.6615 3.198566 131.8135 4.263998 1.848007       5.330338 
1 1 1 13  3  7  o 212.1061 3.260617 548.4626       16.85346 552.9833       21.51351 541.2808       27.11606 212.9430 4.145832 210.5541 5.288966 2.388962       6.720200 
1 1 1 13  3  8  o 63.69144 2.599103 49.52880       4.025570 52.02084       4.852987 44.03158       7.207806 65.25187 3.060496 59.86553 4.985942 5.386337       5.850321 
1 1 1 13  3  9  o 64.60011 2.623153 50.95433       4.120869 53.12344       4.971797 46.19358       7.365632 65.93636 3.102932 61.32324 4.971485 4.613113       5.860363 
1 1 1 13  3  10 o 211.9748 2.977093 547.8483       15.37845 532.7156       21.26539 564.4385       22.26592 208.9602 4.176127 215.0871 4.248056 -6.126923      5.957014 
1 1 1 13  3  11 o 242.8120 3.277444 719.0238       19.39284 719.5615       27.29168 718.4755       27.56155 242.7940 4.612711 242.6060 4.661933 0.1880035      6.558257 
1 1 1 13  3  12 f 116.5470 2.312305 165.5892       6.567227 161.0071       9.055545 170.6726       9.538162 114.8492 3.238803 118.2440 3.313430 -3.394844      4.633429 
1 1 1 13  3  13 o 145.1888 2.691785 257.0470       9.523783 253.1352       12.21196 263.1195       15.21522 144.0419 3.479048 146.7459 4.259279 -2.703949      5.499567 
1 1 1 13  3  14 o 79.26134 2.769018 76.71057       5.340178 68.28910       7.458073 85.57079       7.649882 74.67578 4.114265 83.64807 3.762494 -8.972290      5.575262 
1 1 1 13  3  15 o 197.7798 3.534846 477.3948       17.03682 494.2101       24.47295 461.5829       23.73156 201.0698 4.994630 194.2524 5.017502 6.817459       7.079665 
1 1 1 13  3  16 o 74.69691 4.204067 68.37066       7.621703 0.000000       0.000000 68.37066       7.621703 ?        ?        74.69691 4.204067 0.000000       4.204067 
1 1 1 13  3  17 o 79.86622 4.195286 78.15135       8.136453 0.000000       0.000000 78.15135       8.136453 ?        ?        79.86622 4.195286 0.000000       4.195286 
1 1 1 13  3  18 o 94.90645 2.904277 110.0145       6.709011 110.9740       9.418004 109.0260       9.559528 95.20943 4.068602 94.35751 4.167702 0.8519211      5.824368 
1 1 1 13  3  19 o 142.5354 3.122916 248.0174       10.84724 252.0164       15.43808 244.1181       15.24438 143.4751 4.420779 141.2045 4.435720 2.270615       6.262500 
1 1 1 13  3  20 o 148.0614 3.198226 267.7016       11.53951 251.3437       15.94810 285.6764       16.71774 143.2289 4.575090 152.7214 4.496916 -9.492432      6.415115 
1 1 1 13  3  21 o 39.41574 4.349871 19.24320       4.108720 19.42916       5.899098 19.06799       5.725984 39.25186 6.386577 38.90309 6.251649 0.3487663      8.937084 
1 1 1 13  3  22 o 180.2567 3.511036 397.1957       15.42278 383.2952       21.33462 412.4114       22.32102 176.7204 4.958973 183.3033 5.001656 -6.582870      7.043293 
1 1 1 13  3  23 o 28.38813 5.862772 10.27686       3.921438 12.99295       5.593199 7.651007       5.499491 31.78203 7.365876 25.05120 7.990685 6.730833       10.86771 
1 1 1 13  3  24 o 81.74717 3.687771 81.95392       7.327453 76.52849       9.029250 92.41886       12.54016 78.82335 4.722332 86.37973 5.994566 -7.556381      7.631202 
1 1 1 13  3  25 o 38.47179 5.623003 18.62011       5.115951 18.71660       6.127245 18.39801       9.296254 38.31267 6.812419 37.49220 9.993742 0.8204727      12.09479 
1 1 1 13  3  26 o 121.1498 3.810190 180.1210       11.23480 180.9044       13.49947 178.3557       20.26422 121.2218 4.578054 119.5530 6.986017 1.668785       8.352426 
1 1 1 13  3  27 o 72.59679 3.472996 64.75716       6.126275 65.49841       8.441096 63.93215       8.905247 72.74040 4.788608 71.77982 5.124765 0.9605865      7.013843 
1 1 1 13  3  28 o 28.11411 6.418526 10.25080       4.300368 10.14685       6.060560 10.35622       6.102938 28.01038 8.293091 28.26936 8.309586 -0.2589817     11.73987 
1 1 1 13  3  29 o 99.59476 3.280781 121.9771       7.951640 125.9686       11.19363 117.9110       11.29773 100.7823 4.569639 97.42110 4.773380 3.361214       6.608083 
1 1 1 13  3  30 o 53.70637 4.558959 36.09045       5.910280 32.73339       9.862864 37.97139       7.382636 49.58804 8.465515 54.73720 5.614158 -5.149158      10.15794 
1 1 1 13  3  31 o 59.65413 3.899096 44.34885       5.637074 41.16470       7.890544 47.66801       8.056087 56.70682 5.791211 61.21827 5.457321 -4.511444      7.957416 
1 1 1 13  3  32 o 18.30998 7.663903 1.662115       5.735537 0.000000       0.000000 1.662115       5.735537 ?        ?        18.30998 7.663903 0.000000       7.663903 
1 1 1 13  3  33 o 50.88880 4.318195 32.94967       5.304497 30.00267       7.425179 36.02134       7.580621 47.22967 6.634062 52.18767 6.074136 -4.958000      8.994771 
1 1 1 13  3  34 o 13.30361 5.950213 -0.9504966     3.955799 -3.720839      5.566826 1.875309       5.622275 14.12847 6.589550 17.80615 7.528098 -3.677689      10.00472 
1 1 1 13  3  35 o 45.11986 4.559046 26.75030       4.944077 21.74897       6.861577 32.15075       7.130115 38.28026 7.623490 48.07387 6.232847 -9.793610      9.847131 
1 1 1 13  3  36 o 17.64736 7.060458 3.667159       4.600025 2.962444       5.950854 4.713431       7.250952 18.03568 7.689582 20.09146 8.524181 -2.055786      11.48004 
1 1 1 13  3  37 o 13.76439 6.152153 0.1372086      4.221269 -1.711942      5.139316 3.971545       7.400555 13.71929 6.376011 18.84460 8.298252 -5.125314      10.46492 
1 1 1 13  3  38 o 15.99551 6.273694 3.495259       3.565212 4.562554       4.792862 2.173127       5.334454 17.62367 7.151556 15.95532 7.034860 1.668349       10.03165 
1 1 1 13  3  39 f 15.16528 6.244620 3.042770       3.720959 6.327422       4.730553 -2.287115      6.025960 18.77419 7.265353 13.62508 6.502867 5.149111       9.750520 
1 1 1 13  3  40 o 10.19229 4.870021 -2.409535      3.400036 -2.022040      4.742775 -2.819237      4.876778 12.07630 5.765170 11.85661 5.708832 0.2196903      8.113443 
1 1 1 13  3  41 o 11.04951 5.186014 -0.8206918     3.539331 -1.654913      5.038808 -0.8252718E-02 4.972590 12.11567 5.825718 12.82726 6.059274 -0.7115908     8.405581 
1 1 1 13  3  42 o 12.11421 5.489576 1.194573       3.494433 2.131984       4.712691 0.4971125E-01  5.208116 13.43002 6.193717 12.60508 6.024115 0.8249331      8.640143 
1 1 1 13  4  0  o 330.0655 5.858798 1328.726       47.12428 1355.026       58.14852 1278.401       80.43609 333.2347 7.160648 323.2683 10.22347 9.966461       12.48175 
1 1 1 13  4  1  o 187.6134 3.005079 428.9953       13.73902 439.8875       17.76669 412.7929       21.66909 189.9637 3.837953 183.9327 4.838635 6.031006       6.175944 
1 1 1 13  4  2  o 285.2924 3.670821 992.1480       25.52052 992.7165       35.95280 991.5707       36.23177 285.3128 5.171010 285.1460 5.214181 0.1667786      7.343503 
1 1 1 13  4  3  o 289.7863 4.065501 1023.796       28.70966 1124.568       47.42350 965.4979       36.07059 303.5827 6.410332 281.3597 5.260843 22.22299       8.292697 
1 1 1 13  4  4  o 457.3853 6.037252 2552.573       67.29111 2443.372       102.8552 2634.290       88.97476 447.0431 9.441494 464.4231 7.861709 -17.37997      12.28610 
1 1 1 13  4  5  o 82.23276 2.189959 82.46925       4.384602 93.64863       5.888598 68.55930       6.568495 87.61165 2.761574 74.90440 3.609128 12.70725       4.544458 
1 1 1 13  4  6  o 76.55286 2.402337 71.49485       4.476036 78.57274       5.450609 56.83688       7.843865 80.23988 2.791777 68.09674 4.756716 12.14314       5.515466 
1 1 1 13  4  7  o 143.4368 2.653261 250.7778       9.274204 257.8908       11.68800 238.6865       15.23871 145.4420 3.297722 139.8166 4.478309 5.625458       5.561494 
1 1 1 13  4  8  o 403.9099 5.418040 1991.297       53.32892 1965.862       67.91990 2032.184       86.11501 401.0958 6.948848 407.4788 8.672368 -6.383057      11.11290 
1 1 1 13  4  9  o 169.8693 3.196458 351.8320       13.23183 359.6868       15.18612 327.0695       26.96350 171.7379 3.628645 163.4456 6.784411 8.292328       7.693849 
1 1 1 13  4  10 o 241.4889 3.990064 711.4339       23.48082 703.3423       26.70752 738.9824       49.27947 240.0661 4.565271 245.4904 8.249215 -5.424301      9.428216 
1 1 1 13  4  11 o 257.2642 3.724925 807.4119       23.35248 790.8195       29.72117 834.1818       37.75151 254.5054 4.792177 261.2498 5.929831 -6.744431      7.624162 
1 1 1 13  4  12 o 66.55247 2.471468 54.07488       4.001293 53.42602       5.258049 54.96761       6.167504 66.10156 3.274392 67.01147 3.792279 -0.9099121     5.010292 
1 1 1 13  4  13 o 231.8387 3.491095 655.7897       19.72349 637.6656       30.24931 669.1937       26.01383 228.3933 5.434956 234.0845 4.560322 -5.691223      7.094736 
1 1 1 13  4  14 o 220.6464 3.757477 594.2194       20.20362 602.0030       28.61513 586.4822       28.52954 221.8993 5.291803 219.0125 5.345517 2.886795       7.521817 
1 1 1 13  4  15 o 46.97372 2.989363 27.02585       3.404165 24.40354       4.491099 30.56693       5.218891 44.50584 4.190253 49.83721 4.340485 -5.331367      6.033078 
1 1 1 13  4  16 o 79.19311 2.792836 76.59697       5.381318 75.22008       6.396989 79.93001       9.952821 78.43570 3.354516 80.68346 5.087949 -2.247757      6.094260 
1 1 1 13  4  17 o 195.9767 3.559050 468.9330       16.99709 483.4425       24.28266 454.9951       23.79964 198.7207 5.018393 192.7720 5.070698 5.948730       7.134161 
1 1 1 13  4  18 o 121.5856 3.471565 180.6598       10.27540 191.5809       18.52565 175.8071       12.34907 124.8284 6.108642 119.8528 4.234802 4.975655       7.432971 
1 1 1 13  4  19 o 142.9601 3.634961 249.8385       12.65313 244.2679       21.89622 252.6313       15.50382 140.8729 6.394986 143.6430 4.434439 -2.770050      7.782037 
1 1 1 13  4  20 o 103.6238 2.976652 131.1976       7.508847 132.3037       10.67450 130.1140       10.56458 103.9152 4.224142 103.0515 4.215798 0.8637848      5.967942 
1 1 1 13  4  21 f 35.09720 4.670852 15.34989       3.895803 17.79090       5.520329 12.92795       5.498729 37.54506 6.253445 31.75025 7.264634 5.794807       9.585430 
1 1 1 13  4  22 f 137.4015 3.588055 230.9814       12.00369 233.2323       14.92424 226.8573       20.20102 137.9186 4.446327 135.6353 6.127560 2.283325       7.570787 
1 1 1 13  4  23 o 150.6538 3.734673 277.6975       13.71099 286.4938       17.13878 262.0598       22.85153 152.7877 4.608423 145.6138 6.455914 7.173889       7.931985 
1 1 1 13  4  24 o 200.9913 4.346241 495.3500       21.28763 483.1882       25.46621 523.5604       38.78544 198.1434 5.278804 205.0775 7.775025 -6.934113      9.397701 
1 1 1 13  4  25 o 184.7207 3.597266 417.8331       16.19289 398.1673       22.21963 440.1074       23.64740 179.8092 5.076022 189.0244 5.138455 -9.215164      7.222861 
1 1 1 13  4  26 o 74.01670 3.433639 67.23746       6.176401 66.52212       8.475547 68.04753       9.019286 73.37629 4.765756 74.16058 5.020307 -0.7842865     6.922132 
1 1 1 13  4  27 o 151.9666 3.397017 283.0873       12.58004 282.4512       17.51668 283.7648       18.07833 151.2875 4.757214 151.5807 4.900604 -0.2931519     6.829861 
1 1 1 13  4  28 o 41.32343 5.576546 21.57104       5.472423 21.36070       6.504576 22.08060       10.12401 40.78635 6.782475 40.49436 10.25138 0.2919922      12.29198 
1 1 1 13  4  29 o 68.34803 3.556204 57.63274       5.902724 62.09682       8.409859 53.29823       8.286923 70.56172 4.921694 65.23904 5.257021 5.322678       7.201344 
1 1 1 13  4  30 o 57.18459 4.056487 40.68962       5.616126 42.44844       8.006841 38.98631       7.879493 57.81912 5.759196 55.31923 5.937848 2.499897       8.272023 
1 1 1 13  4  31 o 27.66261 7.314501 10.30694       5.005264 -1.989704      8.113153 17.86296       6.359796 19.03495 8.516944 36.48804 7.405807 -17.45309      11.28647 
1 1 1 13  4  32 o 14.22145 6.151815 -0.5649231E-01 3.913789 -0.8946541     5.401553 0.8698893      5.678710 15.93011 7.048841 17.59178 7.506351 -1.661668      10.29716 
1 1 1 13  4  33 o 28.01596 7.282824 10.99674       5.017436 14.89630       8.616334 8.995981       6.171796 31.37303 10.00135 25.38970 8.488821 5.983337       13.11820 
1 1 1 13  4  34 o 17.88609 6.610246 3.809603       3.811953 6.607476       5.235562 0.6531228      5.560974 22.04060 7.800463 16.78058 7.295434 5.260014       10.68038 
1 1 1 13  4  35 o 16.73837 6.594035 2.990188       3.953669 4.140040       5.610409 1.855842       5.572449 19.23856 7.762472 17.31393 7.412989 1.924629       10.73352 
1 1 1 13  4  36 o 21.63282 7.240496 7.176888       4.489913 11.14299       5.586462 -0.5925953E-01 7.545857 26.11810 8.013471 17.40960 7.957818 8.708498       11.29348 
1 1 1 13  4  37 o 16.43106 6.683438 3.258387       4.197589 3.516527       4.988036 2.631956       7.770316 17.17965 7.165698 18.19934 8.222437 -1.019688      10.90668 
1 1 1 13  4  38 o 11.97729 5.436240 -0.4794328     3.443600 -5.450825      4.779241 4.888310       4.966104 11.23277 5.465754 17.92947 7.278185 -6.696701      9.102002 
1 1 1 13  4  39 o 17.45633 6.406564 5.043769       3.570249 4.035330       4.842473 6.244780       5.284644 16.52053 6.985653 18.51236 7.510481 -1.991825      10.25703 
1 1 1 13  4  40 o 14.62159 6.180511 3.002400       3.788348 2.271591       4.611290 4.519709       6.644426 14.43421 6.442280 16.49843 7.512890 -2.064226      9.896792 
1 1 1 13  4  41 f 9.357488 4.557511 -3.436339      3.344305 -4.181562      4.375328 -2.389130      5.186615 10.40610 5.099064 11.91161 5.772255 -1.505508      7.701908 
1 1 1 13  4  42 o 12.43944 5.639149 1.466578       3.691788 5.704941       5.194923 -2.857891      5.247427 15.78415 6.951487 11.46008 5.608955 4.324065       8.932163 
1 1 1 13  5  0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  5  1  o 274.9554 4.376236 921.7211       29.32237 920.2310       41.29567 923.2363       41.64271 274.6491 6.170071 275.0949 6.211840 -0.4458008     8.755383 
1 1 1 13  5  2  o 331.4261 4.546527 1339.336       36.71999 1354.734       47.61095 1316.730       57.68764 333.2470 5.862792 328.4397 7.207606 4.807251       9.290958 
1 1 1 13  5  3  o 383.7356 5.750982 1796.416       53.77869 1814.944       75.93401 1777.771       76.17567 385.4772 8.083540 381.4964 8.193883 3.980835       11.51014 
1 1 1 13  5  4  o 447.7886 5.917736 2446.665       64.57504 2446.440       83.08778 2447.008       102.6197 447.5575 7.618198 447.3300 9.413836 0.2274475      12.11021 
1 1 1 13  5  5  o 417.2029 5.553050 2123.764       56.45664 2061.233       71.17990 2229.822       92.70070 410.8323 7.109788 427.0257 8.908261 -16.19333      11.39764 
1 1 1 13  5  6  o 149.1974 2.952268 271.3430       10.73379 274.6934       12.14415 259.3795       22.94816 150.1070 3.319937 145.6064 6.483685 4.500656       7.284240 
1 1 1 13  5  7  o 204.0141 4.064036 507.6072       20.20477 512.1655       24.27311 497.3236       36.45848 204.8873 4.861544 201.5829 7.434527 3.304352       8.882950 
1 1 1 13  5  8  o 134.4924 3.291577 220.5452       10.78793 238.8879       13.03787 180.7234       19.21032 139.9046 3.827779 121.4528 6.514533 18.45188       7.555861 
1 1 1 13  5  9  o 284.9373 4.525329 990.6894       31.42212 988.7605       43.54182 992.7856       45.39101 284.4679 6.281122 285.0134 6.535346 -0.5454712     9.064394 
1 1 1 13  5  10 o 163.7315 3.151483 326.9041       12.57428 319.9247       16.82285 335.7396       18.92818 161.8639 4.268672 165.7824 4.689981 -3.918564      6.341726 
1 1 1 13  5  11 o 218.8607 3.752441 584.3906       20.01325 579.0042       27.32711 590.6214       29.39155 217.7254 5.150488 219.8629 5.485729 -2.137466      7.524677 
1 1 1 13  5  12 o 243.7689 3.286689 724.8459       19.52418 739.2474       27.65816 710.5414       27.56481 246.0460 4.612866 241.2127 4.689415 4.833298       6.577929 
1 1 1 13  5  13 o 131.2674 2.565470 210.1095       8.206537 212.5701       10.59798 206.4243       12.96946 132.0017 3.294637 129.9712 4.099985 2.030533       5.259706 
1 1 1 13  5  14 o 182.9581 2.996988 408.3148       13.36204 397.5932       16.97561 425.7765       21.66402 180.4737 3.859894 186.6095 4.767879 -6.135773      6.134447 
1 1 1 13  5  15 o 128.0210 2.581926 199.8766       8.054915 194.7785       10.24992 208.1089       13.02510 126.2959 3.333303 130.4768 4.101585 -4.180901      5.285254 
1 1 1 13  5  16 o 12.45938 5.094062 0.6543604      2.453756 2.480067       3.294723 -1.619489      3.676920 16.41356 6.130277 12.82641 5.736718 3.587149       8.395846 
1 1 1 13  5  17 o 351.7070 5.435326 1514.624       46.58464 1560.443       67.08653 1471.957       64.73750 356.0943 7.730975 345.8728 7.680746 10.22147       10.89779 
1 1 1 13  5  18 o 211.3834 3.734502 545.8286       19.23710 554.0883       27.30697 537.6906       27.10490 212.7086 5.268081 209.4619 5.314439 3.246674       7.483044 
1 1 1 13  5  19 o 184.7119 3.481442 416.7384       15.67076 405.5966       21.74211 428.7840       22.60678 181.9403 4.908328 187.0605 4.963688 -5.120209      6.980679 
1 1 1 13  5  20 o 162.2834 4.617424 322.6788       18.24182 338.2146       27.31754 310.1758       24.50644 165.6206 6.782833 158.7125 6.349072 6.908035       9.290723 
1 1 1 13  5  21 o 225.8448 5.546787 626.2189       30.52725 621.3352       43.76034 630.8486       42.60686 223.8975 8.033406 225.7362 7.756896 -1.838699      11.16714 
1 1 1 13  5  22 o 80.96177 3.084382 80.18919       6.074202 84.59545       8.641009 75.88502       8.540312 83.00740 4.286323 78.57773 4.478580 4.429672       6.199213 
1 1 1 13  5  23 o 27.94320 6.822650 10.02817       4.604834 9.296535       5.391640 12.00064       8.852736 27.05563 7.769372 31.29574 10.15290 -4.240107      12.78454 
1 1 1 13  5  24 o 118.2570 3.095290 171.0733       8.912318 174.6434       12.51811 167.4035       12.69152 119.2642 4.314285 116.7299 4.469912 2.534340       6.212339 
1 1 1 13  5  25 o 200.2340 3.723561 491.1781       18.16906 467.9733       24.91649 517.5276       26.55121 194.8575 5.252061 204.8905 5.322238 -10.03297      7.477323 
1 1 1 13  5  26 o 116.3013 3.132021 165.6473       8.868496 165.9054       12.41784 165.3786       12.66985 116.1070 4.396802 115.8964 4.494586 0.2106323      6.287540 
1 1 1 13  5  27 o 17.49806 6.626520 2.793505       3.878929 5.027471       5.476322 0.5442789      5.494994 21.83101 7.946691 17.62760 7.446997 4.203403       10.89071 
1 1 1 13  5  28 o 103.8235 3.211294 132.3444       8.115014 142.4829       11.50350 122.3010       11.44941 107.3755 4.405673 99.35497 4.742565 8.020538       6.473166 
1 1 1 13  5  29 f 56.54972 4.668226 39.90580       6.375822 38.47474       7.370319 44.16126       12.70956 55.25185 5.549029 57.60260 9.376448 -2.350750      10.89539 
1 1 1 13  5  30 f 32.91794 6.671298 14.25060       5.168043 1.212849       8.462592 22.00490       6.526398 21.47299 9.162942 41.07580 6.754640 -19.60281      11.38353 
1 1 1 13  5  31 o 18.28947 6.775683 3.557374       4.009455 -0.2898843     5.555156 7.740771       5.792756 16.71540 7.279049 24.51493 8.224426 -7.799524      10.98298 
1 1 1 13  5  32 o 32.36108 5.868967 13.84309       4.457902 17.62321       6.348311 10.16572       6.261438 35.82855 7.511456 27.08315 8.512382 8.745403       11.35265 
1 1 1 13  5  33 o 27.22536 6.483282 10.19299       4.239398 9.392582       5.919823 11.03563       6.073978 25.75734 8.297949 27.67855 8.328167 -1.921211      11.75646 
1 1 1 13  5  34 o 26.32123 7.035432 9.931933       4.599270 11.19140       8.165387 9.346660       5.566258 27.02444 9.721852 25.24079 8.037692 1.783648       12.61423 
1 1 1 13  5  35 o 10.49892 5.076776 -5.339550      3.957897 -5.754384      4.987984 -4.634361      6.503409 12.03762 5.790260 14.61272 6.910709 -2.575102      9.015820 
1 1 1 13  5  36 o 18.77312 6.584750 5.071098       3.724574 3.073987       5.220471 7.141578       5.315501 17.44096 7.306716 21.42793 7.824680 -3.986963      10.70578 
1 1 1 13  5  37 f 17.81636 6.454084 4.702968       3.606417 5.423736       4.973131 3.903493       5.237630 18.91177 7.411957 17.59787 7.341666 1.313902       10.43251 
1 1 1 13  5  38 o 13.89615 5.859272 1.790186       3.391032 1.446597       4.689656 2.166691       4.909160 14.83095 6.564940 15.54222 6.803894 -0.7112694     9.454703 
1 1 1 13  5  39 o 17.75764 6.477854 5.343980       3.641766 6.897487       4.893597 3.415704       5.452006 19.13357 7.393520 16.17419 7.122411 2.959379       10.26610 
1 1 1 13  5  40 o 15.85486 6.145546 4.251572       3.388805 5.697778       4.548301 2.446928       5.080775 17.24468 6.977998 14.72323 6.650681 2.521450       9.639710 
1 1 1 13  5  41 o 10.00196 4.822863 -2.562961      3.510821 -0.1311097     4.370715 -6.985778      5.894316 12.23663 5.749436 11.03066 5.495740 1.205975       7.953563 
1 1 1 13  5  42 o 24.49947 6.471661 11.75030       3.920716 11.46439       5.326392 12.08843       5.792325 20.66210 7.778292 20.46558 8.005569 0.1965199      11.16203 
1 1 1 13  6  0  o 167.3709 2.821286 341.4134       11.50703 327.3868       17.78899 351.5054       15.08907 163.8038 4.460625 169.8116 3.646356 -6.007797      5.761344 
1 1 1 13  6  1  f 349.6089 4.766249 1490.444       40.60648 1436.636       62.64403 1529.438       53.32702 343.0399 7.493746 354.0570 6.180705 -11.01709      9.713771 
1 1 1 13  6  2  f 359.4863 4.454052 1575.769       39.01879 1565.333       54.79694 1586.503       55.57306 358.1630 6.278262 360.5729 6.324629 -2.409912      8.911650 
1 1 1 13  6  3  o 296.1304 4.602891 1069.409       33.21619 1044.468       45.68685 1097.375       48.37818 292.5394 6.408711 299.8403 6.620997 -7.300903      9.214618 
1 1 1 13  6  4  o 63.98247 2.692116 49.98439       4.188121 44.76116       6.199253 54.37002       5.680486 60.43862 4.235915 66.68990 3.507673 -6.251274      5.499704 
1 1 1 13  6  5  o 561.9655 7.319820 3857.925       100.2412 3803.329       156.1723 3896.177       130.7233 556.9128 11.50750 564.2419 9.507173 -7.329163      14.92678 
1 1 1 13  6  6  o 429.0861 6.385360 2248.249       66.76762 2188.312       91.85979 2315.378       97.21497 422.8901 8.913779 434.9403 9.172071 -12.05020      12.78993 
1 1 1 13  6  7  o 87.19711 2.828779 92.78419       6.002914 106.7780       8.121846 75.93569       8.911850 93.50975 3.570759 78.75551 4.664448 14.75424       5.874300 
1 1 1 13  6  8  o 251.3270 4.152226 770.5226       25.43058 811.1081       36.46732 732.1018       35.48148 257.7191 5.806589 244.8325 5.946981 12.88663       8.311622 
1 1 1 13  6  9  o 374.7044 5.707754 1714.963       52.11829 1623.990       70.55887 1824.195       77.31658 364.2093 7.949952 385.9431 8.220786 -21.73380      11.43604 
1 1 1 13  6  10 o 101.4651 2.870536 125.6298       7.090534 117.8391       9.134505 137.4405       11.24692 98.20687 3.824177 106.0315 4.362052 -7.824661      5.801019 
1 1 1 13  6  11 o 86.74319 2.870078 91.85339       6.058525 83.40344       7.718164 105.4187       9.779160 82.58705 3.845564 92.83102 4.334841 -10.24397      5.794757 
1 1 1 13  6  12 o 130.9200 3.015585 209.0454       9.620853 202.3281       12.71977 218.0263       14.70755 128.6847 4.061255 133.5452 4.525889 -4.860474      6.080910 
1 1 1 13  6  13 o 295.1004 4.666132 1063.794       33.55544 1079.484       38.78497 1017.096       66.91208 297.1479 5.356173 287.2204 9.573273 9.927551       10.96978 
1 1 1 13  6  14 o 82.55399 2.753102 83.21161       5.530807 84.54047       6.182313 77.88482       12.37782 83.19151 3.054738 79.48344 6.445713 3.708069       7.132926 
1 1 1 13  6  15 o 219.0076 3.776130 585.5826       20.15311 589.0434       23.05075 574.3550       41.51873 219.5881 4.307648 216.0339 7.899832 3.554138       8.997954 
1 1 1 13  6  16 o 187.9005 3.062319 430.8158       14.02214 428.0041       17.97870 435.1821       22.40440 187.1973 3.941147 188.5778 4.879458 -1.380463      6.272300 
1 1 1 13  6  17 o 118.5062 2.581360 171.3101       7.454620 167.7764       9.563323 176.7822       11.90072 117.1841 3.352360 120.2142 4.068248 -3.030106      5.271523 
1 1 1 13  6  18 o 110.6943 3.220198 149.7158       8.677246 142.3539       10.76938 163.3403       14.65062 107.8408 4.105491 115.3705 5.224608 -7.529625      6.644666 
1 1 1 13  6  19 o 189.5162 3.981605 439.0647       18.38826 439.3362       22.76497 438.5550       31.19118 189.3442 4.937986 188.6957 6.794276 0.6484375      8.399160 
1 1 1 13  6  20 o 182.4535 3.456234 406.7203       15.36708 405.6943       21.49935 407.7921       21.97306 181.9187 4.854004 182.3670 4.948914 -0.4483032     6.932035 
1 1 1 13  6  21 o 89.50503 2.977753 97.93804       6.485855 104.7929       9.112095 90.89874       9.233887 92.45924 4.054048 86.04855 4.418364 6.410690       5.996436 
1 1 1 13  6  22 o 102.5267 4.617853 129.0949       11.50793 139.1789       16.46804 119.4711       16.08795 106.0884 6.399739 98.17462 6.765959 7.913734       9.313155 
1 1 1 13  6  23 o 105.7200 3.010365 136.6763       7.747654 144.6523       11.01874 128.8770       10.89597 108.5855 4.171889 102.4489 4.374449 6.136597       6.044871 
1 1 1 13  6  24 o 91.67342 3.064206 102.8515       6.835759 97.63343       9.518229 108.4096       9.823441 89.10505 4.397048 93.92249 4.303418 -4.817436      6.152515 
1 1 1 13  6  25 o 71.22076 3.301589 62.20632       5.714554 61.55255       7.903562 62.92250       8.272239 70.62690 4.617476 71.37927 4.783315 -0.7523727     6.648397 
1 1 1 13  6  26 o 123.7937 3.151062 187.7076       9.498137 175.7228       12.99286 201.4634       13.91978 119.4555 4.471260 127.9165 4.472377 -8.461021      6.324107 
1 1 1 13  6  27 f 23.40114 6.559836 7.027570       3.890504 9.844021       5.456635 4.115466       5.548522 27.57334 7.782717 20.93335 7.925830 6.639997       11.10808 
1 1 1 13  6  28 o 116.3789 3.685838 166.7092       10.43995 156.7964       16.79146 172.9559       13.32949 111.8402 6.185131 118.1962 4.636787 -6.355980      7.730177 
1 1 1 13  6  29 o 70.93629 3.986495 62.32271       6.863487 57.59656       11.29247 65.09139       8.643153 67.05408 7.014446 72.18966 4.942990 -5.135582      8.581120 
1 1 1 13  6  30 o 119.6231 3.863523 177.3453       11.24773 178.2632       13.29452 175.0335       21.09813 119.5306 4.572556 116.1828 7.491820 3.347809       8.776995 
1 1 1 13  6  31 o 28.81133 6.119776 10.98553       4.163909 9.412007       5.673128 12.82316       6.130777 26.42163 8.069466 30.54857 8.103443 -4.126934      11.43600 
1 1 1 13  6  32 o 54.82047 3.910587 37.77814       5.189905 35.86272       7.063638 40.02519       7.650734 52.57258 5.599646 55.48197 5.741553 -2.909386      8.020066 
1 1 1 13  6  33 o 18.29077 6.738954 3.906549       3.956603 -0.1440063     5.434208 8.476357       5.772021 16.23459 7.131215 24.60880 8.208917 -8.374208      10.87385 
1 1 1 13  6  34 o 19.22876 7.034817 4.687580       4.299536 8.593872       5.577236 -1.034629      6.750229 24.24773 8.068738 16.98697 7.670238 7.260759       11.13270 
1 1 1 13  6  35 o 28.55971 7.250088 12.25853       5.053902 17.38659       9.517278 10.24458       5.964314 30.78859 10.54004 25.45074 8.338780 5.337854       13.43978 
1 1 1 13  6  36 o 19.68279 6.655333 5.771868       3.793057 8.839831       5.214287 2.323863       5.527818 23.29794 7.802809 17.01076 7.334515 6.287180       10.70882 
1 1 1 13  6  37 o 26.94704 6.050514 11.01964       3.875654 13.54451       5.342691 8.215267       5.630642 28.29482 7.591565 21.65855 8.028463 6.636263       11.04935 
1 1 1 13  6  38 o 10.11051 4.851948 -3.357348      3.455912 -4.431538      4.759167 -2.159048      5.026586 11.55899 5.583909 12.93704 6.105360 -1.378057      8.273781 
1 1 1 13  6  39 o 17.64758 6.280075 5.248396       3.397642 2.994044       4.628705 7.882174       5.003088 15.41197 6.678419 20.01641 7.537815 -4.604430      10.07075 
1 1 1 13  6  40 o 16.35854 6.220026 4.720794       3.425969 3.617273       4.620226 6.068698       5.106255 15.29130 6.648852 17.32400 7.239811 -2.032700      9.829655 
1 1 1 13  6  41 o 8.282924 4.109434 -5.225866      3.159989 -2.878681      4.166415 -8.404537      4.848547 10.64797 5.163117 9.589921 4.808578 1.058052       7.055508 
1 1 1 13  6  42 f 14.78418 6.002697 4.146778       3.378868 4.199921       4.525748 4.079853       5.078812 14.69929 6.480441 14.62297 6.623087 0.7631874E-01  9.266142 
1 1 1 13  7  0  o 273.2824 3.899111 910.4764       25.96650 899.6905       40.72830 917.8631       33.70497 271.5474 6.154809 274.3380 5.041641 -2.790619      7.956118 
1 1 1 13  7  1  o 220.4045 3.351141 592.1525       17.99903 561.7962       27.64048 614.5019       23.71665 214.6121 5.285124 224.4928 4.335257 -9.880661      6.835714 
1 1 1 13  7  2  o 240.7435 3.948522 706.6302       23.16463 723.9767       45.30530 700.4902       26.95436 243.3479 7.649360 239.6674 4.615131 3.680496       8.933764 
1 1 1 13  7  3  o 32.02720 3.149337 12.62429       2.426198 16.25622       3.027077 6.099808       4.057211 36.35290 3.458649 22.33958 6.824396 14.01332       7.650793 
1 1 1 13  7  4  o 104.5754 3.139040 133.4323       7.990436 129.9586       9.200572 144.0934       16.11824 103.1778 3.665075 108.4781 6.122173 -5.300331      7.135389 
1 1 1 13  7  5  o 53.59994 2.778729 35.11354       3.617107 39.34545       5.081616 30.76732       5.149788 56.68498 3.698933 50.04608 4.263178 6.638897       5.644182 
1 1 1 13  7  6  o 203.9960 3.612743 507.4321       17.95952 508.7872       24.67235 505.9047       26.19300 204.2000 4.958139 203.5327 5.285458 0.6672668      7.247014 
1 1 1 13  7  7  o 135.9812 2.586142 225.3985       8.569736 228.8027       10.55034 218.7968       14.69231 136.9897 3.160402 133.8405 4.511152 3.149170       5.508052 
1 1 1 13  7  8  o 149.2681 2.692795 271.6236       9.795043 270.8027       12.04037 273.2301       16.84325 149.0222 3.315527 149.5613 4.626935 -0.5390167     5.692209 
1 1 1 13  7  9  o 289.1642 4.094940 1020.203       28.85547 1029.020       36.85641 1006.241       46.38194 290.2887 5.210109 286.8615 6.634994 3.427216       8.436135 
1 1 1 13  7  10 o 272.6699 3.919680 907.1699       26.04497 888.4154       32.61761 940.1654       43.26389 269.7229 4.962474 277.2609 6.403256 -7.537933      8.101101 
1 1 1 13  7  11 o 87.30103 2.423200 92.99023       5.150203 92.09830       6.027490 95.40279       9.913205 86.85810 2.851537 88.27055 4.624659 -1.412453      5.433115 
1 1 1 13  7  12 o 205.5488 3.236406 515.3997       16.21116 547.4637       20.96025 467.6656       25.57413 211.7749 4.061493 195.5254 5.372463 16.24956       6.734915 
1 1 1 13  7  13 o 122.3839 2.821456 182.6734       8.414607 178.9144       9.338742 198.8961       19.40056 121.0616 3.168248 127.3080 6.272806 -6.246338      7.027510 
1 1 1 13  7  14 o 84.89186 2.621290 87.97211       5.416224 85.78673       7.703103 90.10891       7.617017 83.74451 3.784399 85.84386 3.649485 -2.099350      5.257415 
1 1 1 13  7  15 o 39.99685 3.208269 19.64595       3.100830 18.33584       4.549752 20.78234       4.237365 38.40686 4.978199 41.02153 4.302810 -2.614666      6.580018 
1 1 1 13  7  16 o 11.71241 5.204427 -1.120302      2.975442 -1.120302      2.975442 0.000000       0.000000 11.71241 5.204427 ?        ?        0.000000       5.204427 
1 1 1 13  7  17 o 153.3177 4.261015 287.5488       15.90451 287.5488       15.90451 0.000000       0.000000 153.3177 4.261015 ?        ?        0.000000       4.261015 
1 1 1 13  7  18 o 78.83611 2.518820 75.89891       4.832820 79.01804       6.324586 71.52198       7.492053 80.38362 3.235316 76.38821 4.039100 3.995407       5.175094 
1 1 1 13  7  19 o 176.5696 3.364432 380.7926       14.47651 376.2740       20.17367 385.5894       20.78580 175.2499 4.728116 177.3900 4.812858 -2.140121      6.746753 
1 1 1 13  7  20 o 52.11972 3.216481 33.30465       4.065352 32.29884       5.554258 34.46527       5.966392 51.16957 4.500081 52.84483 4.681499 -1.675266      6.493625 
1 1 1 13  7  21 o 77.17796 3.592276 72.97503       6.737612 70.16430       7.724929 81.91074       13.77368 75.59559 4.209988 81.17982 7.031785 -5.584229      8.195730 
1 1 1 13  7  22 o 41.02019 4.018045 20.79138       3.965044 22.29890       5.592523 19.26769       5.622436 42.23839 5.568845 39.10846 6.098396 3.129929       8.258478 
1 1 1 13  7  23 o 123.6663 3.057319 186.9010       9.213577 185.6573       12.89689 188.1974       13.16724 122.9985 4.309438 123.8256 4.370489 -0.8270264     6.137787 
1 1 1 13  7  24 o 74.84796 3.751977 68.78155       6.821646 60.35272       12.09815 72.71055       8.259937 69.35488 7.265958 76.84883 4.429425 -7.493950      8.509639 
1 1 1 13  7  25 o 180.7047 3.492518 399.8751       15.37958 385.0020       21.19433 416.4170       22.35181 176.8095 4.923807 183.8592 4.993366 -7.049683      7.012673 
1 1 1 13  7  26 o 72.94203 3.211228 65.27811       5.694026 69.00681       8.113235 61.65889       7.993245 74.76239 4.473688 70.61259 4.671465 4.149803       6.468112 
1 1 1 13  7  27 o 33.63985 5.629835 14.39979       4.452204 10.68707       7.000260 16.92172       5.769462 28.90955 8.987830 36.24004 6.782195 -7.330484      11.25963 
1 1 1 13  7  28 o 37.87325 5.639746 18.23259       5.046563 29.68739       9.448698 13.66077       5.969294 47.55329 8.463994 32.19635 7.710126 15.35693       11.44925 
1 1 1 13  7  29 o 17.14106 6.429612 2.866038       3.632373 3.543732       4.944621 2.071593       5.353625 19.48647 7.457159 18.54674 7.546426 0.9397259      10.60932 
1 1 1 13  7  30 o 70.17609 3.442327 60.95264       5.868811 61.72086       8.021151 60.06759       8.609557 70.14306 4.720106 69.00220 5.157448 1.140862       6.991328 
1 1 1 13  7  31 o 26.66304 7.018081 9.605832       4.621330 7.669039       5.198390 16.90540       10.09196 24.12045 7.776379 34.10814 10.81822 -9.987692      13.32314 
1 1 1 13  7  32 o 22.26320 6.499147 6.676218       3.744432 9.277733       4.969020 3.257854       5.695956 25.89546 7.465626 19.46705 7.833127 6.428415       10.82097 
1 1 1 13  7  33 o 52.12585 4.352180 34.79424       5.477950 40.64547       6.781809 23.80997       9.291960 55.92195 5.030235 39.35088 9.742162 16.57107       10.96417 
1 1 1 13  7  34 o 15.11158 6.172547 1.760708       3.598508 3.725512       4.996473 -0.3567916     5.186990 18.61181 7.387321 15.44419 6.866580 3.167615       10.08575 
1 1 1 13  7  35 o 24.85457 6.497395 9.062449       3.978754 14.47357       5.588398 3.499970       5.666019 30.75866 7.519697 18.49101 7.668593 12.26764       10.74026 
1 1 1 13  7  36 o 17.15382 6.876983 3.593960       4.373222 10.94859       8.621716 1.046223       5.074470 24.18960 9.670060 15.57152 6.863639 8.618074       11.85831 
1 1 1 13  7  37 o 14.15331 5.884042 1.898892       3.347336 -1.671825      4.634153 5.794301       4.840266 12.96606 6.035622 19.11722 7.362131 -6.151159      9.519963 
1 1 1 13  7  38 o 17.01220 6.284458 4.489296       3.444792 3.561724       4.802298 5.472471       4.944142 16.44446 6.955201 18.22292 7.309872 -1.778460      10.09005 
1 1 1 13  7  39 o 13.64773 6.027360 1.486959       3.931271 3.608583       4.746121 -3.150365      7.016787 15.86438 6.817687 13.81238 6.698187 2.052003       9.557540 
1 1 1 13  7  40 o 13.08332 5.694186 1.827725       3.395437 -0.8500049     4.687666 4.783289       4.924855 12.39025 5.861898 16.15050 6.942819 -3.760247      9.086505 
1 1 1 13  7  41 o 12.64993 5.594456 1.704313       3.398158 5.909998       4.616006 -3.271602      5.020933 16.55973 6.899129 11.32434 5.530529 5.235386       8.842214 
1 1 1 13  8  0  o 211.8737 3.264892 547.2006       16.85707 556.6551       26.97233 541.1407       21.59380 213.6267 5.181157 210.6675 4.206254 2.959259       6.673602 
1 1 1 13  8  1  o 170.9966 2.898256 356.3989       12.07704 352.1379       19.09769 359.2384       15.59018 169.8621 4.617972 171.6564 3.726961 -1.794312      5.934299 
1 1 1 13  8  2  o 182.8112 2.955285 407.3649       13.16553 405.8976       20.20112 408.4482       17.35830 182.4326 4.543987 183.0276 3.891835 -0.5950470     5.982825 
1 1 1 13  8  3  o 189.2935 2.738244 436.7527       12.63118 430.7075       17.28409 443.6820       18.50467 187.9481 3.773745 190.7505 3.980885 -2.802399      5.485307 
1 1 1 13  8  4  o 64.18027 2.707902 50.29771       4.225651 50.86480       5.568597 49.52786       6.488205 64.49157 3.557067 63.58754 4.210849 0.9040260      5.512166 
1 1 1 13  8  5  o 288.8925 4.046312 1017.859       28.48602 1043.711       37.01431 980.3036       44.61170 292.4493 5.193773 283.3065 6.461840 9.142822       8.290396 
1 1 1 13  8  6  o 181.5589 3.384789 401.9349       14.97564 407.1805       20.49894 395.9309       21.93101 182.6254 4.609792 180.0515 5.003191 2.573975       6.803096 
1 1 1 13  8  7  o 349.1136 4.773286 1487.421       40.60881 1454.541       51.10481 1543.748       66.88878 345.0622 6.077546 355.2028 7.727531 -10.14063      9.831140 
1 1 1 13  8  8  o 175.8513 2.920781 377.0406       12.51644 369.7884       15.37319 391.3005       21.55694 174.1205 3.623080 178.9660 4.947634 -4.845444      6.132356 
1 1 1 13  8  9  o 349.3292 4.784706 1489.859       40.73111 1443.099       50.93036 1572.839       67.84621 343.5919 6.082717 358.3396 7.769529 -14.74762      9.867372 
1 1 1 13  8  10 o 156.1501 2.751916 297.3103       10.47161 286.5391       12.64110 320.8653       18.69365 153.2665 3.384555 162.0318 4.739412 -8.765366      5.823851 
1 1 1 13  8  11 o 134.8843 3.222804 221.9276       10.59330 213.7960       11.95986 251.5352       22.82130 132.3143 3.712895 143.2031 6.557011 -10.88884      7.535250 
1 1 1 13  8  12 o 155.7164 2.768596 295.7081       10.50582 288.5305       12.76330 310.7891       18.50082 153.7796 3.405869 159.4270 4.767395 -5.647369      5.859010 
1 1 1 13  8  13 o 183.6938 3.762056 411.8789       16.84053 411.8789       16.84053 0.000000       0.000000 183.6938 3.762056 ?        ?        0.000000       3.762056 
1 1 1 13  8  14 o 281.5200 5.130619 969.1455       35.19777 969.1455       35.19777 0.000000       0.000000 281.5200 5.130619 ?        ?        0.000000       5.130619 
1 1 1 13  8  15 o 128.6013 2.706327 201.7329       8.481285 205.8696       10.08557 191.7431       15.67299 129.8854 3.186428 125.0908 5.152537 4.794678       6.058214 
1 1 1 13  8  16 o 173.3932 2.885525 366.8365       12.19251 365.5845       15.60043 368.8016       19.54419 173.0199 3.700023 173.6077 4.623802 -0.5878448     5.921969 
1 1 1 13  8  17 o 189.8484 3.440804 440.1038       15.91853 425.8329       22.06501 455.5932       22.98774 186.4832 4.859577 192.8870 4.894499 -6.403763      6.897218 
1 1 1 13  8  18 o 225.3040 3.844793 620.3447       21.10950 610.0057       29.41743 631.3199       30.30922 223.0946 5.411027 226.9415 5.480557 -3.846909      7.701670 
1 1 1 13  8  19 o 210.7563 4.342034 543.4662       22.30026 539.8493       26.65275 551.9081       40.71869 209.8622 5.211607 211.2261 7.924664 -1.363968      9.484786 
1 1 1 13  8  20 o 146.7604 3.676671 263.4633       13.13886 261.4866       15.54385 268.4100       24.58950 146.0908 4.371075 147.4243 6.863379 -1.333511      8.137093 
1 1 1 13  8  21 o 62.93927 3.026172 48.49570       4.627827 50.26397       6.485737 46.66159       6.605373 63.94407 4.185203 61.56587 4.432389 2.378204       6.096064 
1 1 1 13  8  22 o 24.99369 5.413594 7.970116       3.201682 9.965922       4.477166 5.881282       4.580321 27.86629 6.679957 22.24563 7.308563 5.620663       9.901360 
1 1 1 13  8  23 o 14.93607 5.827209 1.680090       3.062351 0.3682328      4.193673 3.178781       4.482366 15.47973 6.520831 18.81594 7.123850 -3.336209      9.657664 
1 1 1 13  8  24 o 76.56822 3.048536 71.79836       5.676845 75.94526       8.002767 67.59817       8.054020 78.57713 4.194541 74.06939 4.483074 4.507736       6.139391 
1 1 1 13  8  25 o 104.3559 4.284949 133.9544       10.87362 0.000000       0.000000 133.9544       10.87362 ?        ?        104.3559 4.284949 0.000000       4.284949 
1 1 1 13  8  26 o 59.99913 3.738860 44.34397       5.439471 50.85907       8.662323 40.10247       6.989300 63.85736 5.623970 56.77219 5.106493 7.085178       7.596401 
1 1 1 13  8  27 o 81.68873 3.669198 82.13755       7.285501 79.14475       12.84836 83.55586       8.844933 79.24917 6.716179 82.20322 4.431781 -2.954048      8.046598 
1 1 1 13  8  28 o 74.40083 3.245858 68.10810       5.870798 62.23892       8.145163 74.45393       8.469453 70.71970 4.753940 77.45475 4.506621 -6.735054      6.550540 
1 1 1 13  8  29 o 37.72019 4.528796 17.91119       4.079720 18.54947       5.492591 17.12568       6.093235 37.90718 6.157000 36.05100 7.188064 1.856186       9.464508 
1 1 1 13  8  30 o 58.20799 3.590807 42.07535       5.068641 50.76414       7.014538 32.58152       7.332297 63.60583 4.555663 50.27542 6.110076 13.33041       7.621489 
1 1 1 13  8  31 o 66.24313 3.481759 54.59985       5.600774 69.33276       7.715133 38.18505       8.143606 74.28703 4.279930 54.06816 6.298522 20.21888       7.615063 
1 1 1 13  8  32 o 35.68217 6.318984 17.09931       5.293511 17.09931       5.293511 0.000000       0.000000 35.68217 6.318984 ?        ?        0.000000       6.318984 
1 1 1 13  8  33 o 19.23762 6.365997 4.891742       3.472914 6.234745       4.616249 3.140332       5.271626 21.49094 7.341017 18.57943 7.514452 2.911510       10.50512 
1 1 1 13  8  34 o 46.52251 4.493781 28.28792       5.031271 36.46525       7.594998 21.89322       6.716330 51.40115 6.187739 38.75826 7.380492 12.64289       9.631187 
1 1 1 13  8  35 o 20.00452 6.495187 5.801734       3.622681 10.46445       5.056418 0.8841079      5.192793 25.89805 7.550178 15.91489 6.981504 9.983163       10.28332 
1 1 1 13  8  36 o 35.55626 5.046033 17.64310       4.249572 31.72053       6.084136 4.233223       5.938130 47.43309 5.357214 18.50804 7.775767 28.92505       9.442579 
1 1 1 13  8  37 o 11.89366 5.569064 -2.051461      4.040801 -2.284123      7.547761 -1.957985      4.784157 15.50002 7.363740 12.94963 6.062280 2.550393       9.538129 
1 1 1 13  8  38 o 14.44929 6.204208 2.024228       3.924040 3.593748       5.928759 0.8006810      5.234686 16.86245 7.426324 14.64786 6.669512 2.214585       9.981618 
1 1 1 13  8  39 o 10.82462 5.067935 -1.344216      3.344739 -4.632003      4.541122 2.554382       4.944992 10.82534 5.280890 15.04110 6.694891 -4.215759      8.526979 
1 1 1 13  8  40 o 11.92133 5.396229 0.5650894      3.365479 2.860687       4.471755 -2.433819      5.111068 14.46343 6.406016 11.98473 5.788862 2.478706       8.634117 
1 1 1 13  8  41 o 12.31063 5.483857 1.439686       3.324524 0.9505121      4.254974 2.206320       5.326716 12.63284 5.846979 13.89972 6.470469 -1.266880      8.720901 
1 1 1 13  9  0  o 413.4497 5.533370 2085.696       55.75046 2066.024       87.77292 2099.000       72.18058 411.0681 8.762151 414.5755 7.144644 -3.507477      11.30581 
1 1 1 13  9  1  o 348.2203 5.315928 1479.436       45.10963 1465.127       63.70824 1493.823       63.88142 346.2965 7.549381 349.6780 7.496701 -3.381439      10.63925 
1 1 1 13  9  2  o 108.6963 2.417115 144.0002       6.402479 156.5826       9.861856 134.8331       8.417629 113.2695 3.577291 105.1151 3.290212 8.154472       4.860299 
1 1 1 13  9  3  o 294.3937 4.657195 1057.232       33.41097 1099.919       68.13808 1043.720       38.33599 299.6061 9.344032 292.4494 5.379228 7.156738       10.78179 
1 1 1 13  9  4  o 437.3384 5.297043 2334.265       56.45304 2313.296       78.93555 2356.219       80.76933 435.0238 7.446009 439.0213 7.549613 -3.997559      10.60376 
1 1 1 13  9  5  o 120.9060 2.413348 178.1812       7.110560 194.5414       9.132264 152.9919       11.33164 126.3228 2.966610 111.9165 4.162171 14.40636       5.111208 
1 1 1 13  9  6  o 261.3089 4.193216 833.0034       26.70162 813.2085       30.00214 908.4144       58.55885 258.1390 4.769386 272.1660 8.840955 -14.02695      10.04537 
1 1 1 13  9  7  o 234.3157 3.492775 669.6041       19.94381 646.3148       24.57891 714.4922       34.12326 230.1426 4.382576 241.8433 5.790024 -11.70068      7.261636 
1 1 1 13  9  8  o 135.1220 2.572553 222.5892       8.470842 208.4047       9.980017 259.1413       16.02064 130.7280 3.132756 145.6393 4.519507 -14.91135      5.499101 
1 1 1 13  9  9  o 99.84650 2.378833 121.5356       5.788059 119.0208       6.767196 128.3890       11.17139 98.75755 2.814788 102.4557 4.485273 -3.698105      5.295348 
1 1 1 13  9  10 o 327.6135 5.052043 1311.221       40.33341 1301.866       45.92764 1342.758       84.32604 326.3108 5.775726 329.9280 10.50171 -3.617218      11.98520 
1 1 1 13  9  11 o 200.9833 3.488731 492.8574       17.08691 478.1376       18.94002 557.2302       39.60769 197.9230 3.926883 213.0181 7.642427 -15.09505      8.592271 
1 1 1 13  9  12 o 120.4975 3.441927 177.3130       10.09649 177.3130       10.09649 0.000000       0.000000 120.4975 3.441927 ?        ?        0.000000       3.441927 
1 1 1 13  9  13 o 224.5132 3.777517 615.3268       20.66733 631.9820       23.76226 563.5902       41.88041 227.4700 4.286744 214.0114 8.044734 13.45853       9.115586 
1 1 1 13  9  14 o 94.74899 2.582514 109.5700       5.957283 112.2405       6.566643 97.15157       14.16069 95.88248 2.813442 88.77801 6.592552 7.104469       7.167789 
1 1 1 13  9  15 o 98.23129 2.618329 117.7837       6.262140 122.9225       6.967537 96.19031       14.28271 100.3362 2.852505 88.29084 6.688076 12.04538       7.270979 
1 1 1 13  9  16 o 152.4709 2.670345 283.6069       9.921799 284.1871       12.67709 282.6896       15.93979 152.5674 3.409745 152.0134 4.307274 0.5539551      5.493539 
1 1 1 13  9  17 o 98.29347 2.347786 117.8453       5.623662 115.4097       7.137519 121.8326       9.132268 97.19254 3.017203 99.79002 3.762130 -2.597473      4.822566 
1 1 1 13  9  18 o 67.11189 2.399428 55.01472       3.917815 53.09386       5.025854 57.98990       6.254872 65.86935 3.140095 68.78632 3.745606 -2.916962      4.887715 
1 1 1 13  9  19 o 79.20692 3.340857 76.77223       6.433996 76.10085       7.302729 79.10117       13.60132 78.80772 3.813920 79.81752 7.065638 -1.009796      8.029273 
1 1 1 13  9  20 o 181.6426 3.393731 403.1786       15.02212 413.1053       21.31109 393.3750       21.17851 183.5464 4.768609 179.0852 4.857366 4.461182       6.806881 
1 1 1 13  9  21 o 138.7242 3.598184 235.4733       12.15360 235.6484       14.29139 235.0160       23.10071 138.6637 4.234330 137.8171 6.900330 0.8465576      8.095931 
1 1 1 13  9  22 o 77.29332 2.856286 73.07423       5.370715 75.47387       7.421066 70.43515       7.782493 78.42589 3.895220 75.70652 4.235300 2.719368       5.754173 
1 1 1 13  9  23 o 54.33935 3.171173 36.22506       4.180989 40.71165       5.813124 31.41696       6.017809 57.48072 4.178565 50.32418 4.972008 7.156536       6.494711 
1 1 1 13  9  24 o 54.77240 3.549400 36.88618       4.712027 40.58328       7.266000 34.20284       6.190167 57.16606 5.275269 52.51448 4.893446 4.651573       7.195434 
1 1 1 13  9  25 o 26.64990 5.281852 9.061359       3.308916 8.252881       4.427389 10.08437       4.980282 25.34701 6.957530 27.92309 7.254374 -2.576084      10.05153 
1 1 1 13  9  26 o 119.4986 3.638848 175.3932       10.58416 185.7143       19.20463 170.8907       12.68442 121.9224 6.487126 117.7270 4.429284 4.195381       7.855022 
1 1 1 13  9  27 o 95.33091 3.626798 111.8364       8.410087 120.1386       15.24611 108.2053       10.08290 97.79557 6.433129 93.53905 4.436040 4.256516       7.814320 
1 1 1 13  9  28 o 71.42965 3.106524 62.76597       5.394480 55.46237       7.150259 72.41547       8.218747 66.80602 4.416862 76.36739 4.435418 -9.561363      6.259521 
1 1 1 13  9  29 o 66.53773 3.258872 54.65630       5.268032 52.79288       7.068064 56.98519       7.901688 65.01169 4.488979 67.42243 4.841505 -2.410744      6.602356 
1 1 1 13  9  30 f 28.25042 6.028939 10.52371       4.024040 15.66454       4.971062 0.7515280      6.853754 34.59055 6.121276 19.16300 8.213272 15.42755       10.24343 
1 1 1 13  9  31 o 33.75324 4.813732 14.66024       3.847381 15.30403       5.075340 13.79049       5.899153 33.86810 6.383553 31.55663 7.732719 2.311476       10.02720 
1 1 1 13  9  32 o 24.17626 6.039065 7.942382       3.547250 7.167626       4.538744 9.158358       5.686114 22.91919 7.253200 25.53194 8.123009 -2.612753      10.89000 
1 1 1 13  9  33 o 16.45134 6.445844 2.669086       3.760285 2.184659       4.156029 4.855496       8.829389 16.38477 6.655576 22.51735 9.472211 -6.132578      11.57668 
1 1 1 13  9  34 o 11.20754 5.123551 -1.493669      3.129285 3.098271       4.128107 -7.696897      4.798017 17.03781 6.729891 10.99030 5.375721 6.047503       8.613350 
1 1 1 13  9  35 o 40.23241 4.986884 22.07163       4.784642 27.96004       7.072185 17.10161       6.497318 43.36748 6.924736 32.44810 8.211382 10.91937       10.74145 
1 1 1 13  9  36 o 13.56986 5.782272 1.186835       3.361516 3.494867       4.519323 -1.671438      5.029263 16.93109 6.916744 13.61488 6.320605 3.316206       9.369706 
1 1 1 13  9  37 o 14.89501 6.181441 2.405879       3.685003 14.47253       5.709049 -6.211776      4.824641 28.44394 7.936627 11.04049 5.398211 17.40345       9.598475 
1 1 1 13  9  38 o 20.90678 7.221995 7.983119       4.471429 15.40493       9.065592 5.597106       5.140173 23.90047 9.783904 18.07409 7.379266 5.826389       12.25473 
1 1 1 13  9  39 o 9.385343 4.528751 -3.078895      3.108969 -5.888170      4.169596 0.4384789      4.665585 9.812471 4.841264 13.37122 6.165196 -3.558751      7.838844 
1 1 1 13  9  40 o 9.120312 4.432309 -3.279073      3.116301 -5.324205      4.008076 -0.1530083     4.955349 9.581649 4.730972 12.82347 6.054846 -3.241818      7.683960 
1 1 1 13  9  41 o 15.51583 6.139487 4.624437       3.441102 5.251004       4.562487 3.797786       5.240580 15.78315 6.731265 14.70130 6.685823 1.081854       9.487369 
1 1 1 13  10 0  o 81.01582 3.268816 80.14681       6.440264 73.58883       9.327186 86.12242       8.903404 77.50799 4.964292 83.91877 4.368767 -6.410782      6.612890 
1 1 1 13  10 1  f 395.9112 6.823478 1914.592       65.83240 2007.176       117.0213 1871.723       79.62782 404.1833 11.89387 391.2130 8.352480 12.97034       14.53369 
1 1 1 13  10 2  o 199.3181 3.447777 484.3852       16.74643 452.2947       22.76733 522.2130       24.71890 192.4781 4.857827 206.8838 4.903053 -14.40576      6.902059 
1 1 1 13  10 3  o 416.1506 7.182143 2116.676       72.83509 1999.516       121.9516 2181.639       90.81023 403.0396 12.43149 422.1548 8.827281 -19.11514      15.24673 
1 1 1 13  10 4  f 149.6537 2.616909 273.0075       9.543601 292.0151       12.42152 245.6207       14.91012 154.7557 3.293760 141.8293 4.319023 12.92638       5.431649 
1 1 1 13  10 5  o 257.6463 3.693461 809.6038       23.18961 807.5338       29.64489 812.8677       37.22432 257.2374 4.729113 257.9700 5.921360 -0.7325439     7.578061 
1 1 1 13  10 6  o 212.5172 3.220568 550.7354       16.67872 564.9799       21.51740 529.2952       26.39850 215.1941 4.103206 208.2049 5.202981 6.989197       6.626258 
1 1 1 13  10 7  o 49.87663 2.653774 30.41482       3.213891 31.17774       3.347042 21.39439       11.50895 50.49511 2.730197 41.02857 11.19968 9.466537       11.52766 
1 1 1 13  10 8  o 386.8968 5.824624 1829.637       54.91603 1802.216       62.38837 1923.982       115.7224 383.7985 6.670591 394.5393 12.05037 -10.74088      13.77346 
1 1 1 13  10 9  o 82.65816 3.048626 83.44019       6.130293 87.39413       6.833068 67.13003       13.87810 84.57885 3.321721 73.58524 7.860945 10.99361       8.533950 
1 1 1 13  10 10 o 181.5796 4.092752 402.4761       18.11000 404.9833       30.42720 401.1006       22.53654 181.7106 6.883854 181.1044 5.111600 0.6062469      8.574142 
1 1 1 13  10 11 o 106.1936 3.631552 137.7799       9.383982 141.7183       15.35814 135.4336       11.85411 107.4679 5.886888 105.1939 4.635646 2.274025       7.492974 
1 1 1 13  10 12 o 388.3106 8.467257 1854.041       80.12317 1955.701       116.6518 1763.246       110.2422 396.7848 12.07831 376.7717 12.02236 20.01309       17.04180 
1 1 1 13  10 13 o 72.77530 4.582592 64.97252       8.085756 66.24003       11.08416 63.53080       11.82138 73.27106 6.267895 71.65683 6.853180 1.614235       9.287227 
1 1 1 13  10 14 o 268.0268 6.344406 880.6586       41.43861 911.9895       59.19861 850.5575       58.02511 271.7955 8.950057 262.4188 9.087422 9.376678       12.75479 
1 1 1 13  10 15 o 76.60251 3.037679 71.71925       5.659252 72.48578       6.421398 69.05288       11.97635 76.97877 3.431750 74.71953 6.646697 2.259239       7.480340 
1 1 1 13  10 16 o 98.50069 2.565690 118.4389       6.153322 118.3147       6.711799 119.0937       15.40774 98.43140 2.800987 98.28592 6.468935 0.1454773      7.049302 
1 1 1 13  10 17 o 75.82530 2.194148 70.17973       4.050039 70.23462       5.104310 70.08644       6.654363 75.81496 2.767421 75.65850 3.619713 0.1564636      4.556418 
1 1 1 13  10 18 o 126.3296 2.831154 194.7925       8.715751 192.7916       9.617044 203.9914       20.62049 125.6540 3.140721 128.6189 6.601054 -2.964912      7.310133 
1 1 1 13  10 19 o 100.3481 2.379645 122.8600       5.819122 123.8185       7.389441 121.2953       9.441636 100.6527 3.016060 99.51832 3.900768 1.134422       4.930782 
1 1 1 13  10 20 o 125.4260 2.542680 192.0046       7.771690 199.3353       10.02227 180.9485       12.30829 127.6925 3.223384 121.5197 4.162524 6.172836       5.264676 
1 1 1 13  10 21 o 91.91278 2.739513 103.2477       6.129153 103.9720       8.427505 102.4344       8.930182 92.11132 3.762400 91.38961 4.019676 0.7217102      5.505765 
1 1 1 13  10 22 o 90.36758 3.903652 100.1737       8.576189 98.89870       10.24767 103.1542       15.66801 89.65305 4.707044 91.00642 7.121575 -1.353371      8.536573 
1 1 1 13  10 23 o 144.1926 3.471586 254.4540       12.19852 256.1885       19.47079 253.3333       15.65079 144.0856 5.555736 143.5968 4.478024 0.4887238      7.135747 
1 1 1 13  10 24 o 40.31105 3.638582 20.06592       3.535873 20.46536       4.718208 19.55420       5.340343 40.50291 4.878412 39.40303 5.729386 1.099884       7.524943 
1 1 1 13  10 25 o 41.54927 4.703679 21.52174       4.678856 21.75682       9.358111 21.44339       5.402601 40.58946 9.610626 41.30202 5.504728 -0.7125626     11.07548 
1 1 1 13  10 26 o 119.9036 2.983573 176.0690       8.717763 169.4241       11.78438 184.1014       12.95635 117.2762 4.129894 122.1817 4.358497 -4.905411      6.004375 
1 1 1 13  10 27 o 107.6504 2.934458 142.1537       7.690848 143.0937       10.50344 141.0671       11.29237 107.6944 4.009230 106.8115 4.347498 0.8829117      5.913938 
1 1 1 13  10 28 o 97.64284 3.639524 117.6622       8.644908 112.6481       15.32096 120.0043       10.47104 94.10873 6.724993 98.33263 4.380743 -4.223907      8.025986 
1 1 1 13  10 29 o 40.34871 4.230701 20.43447       4.098067 21.65795       5.027561 18.01208       7.074272 41.28605 5.105797 36.50167 8.158475 4.784378       9.624441 
1 1 1 13  10 30 o 44.27808 3.751037 24.51584       4.009352 22.43434       5.184566 27.61261       6.323795 41.85285 5.194825 46.26286 5.731815 -4.410007      7.735626 
1 1 1 13  10 31 o 33.88607 4.566141 14.73429       3.674696 16.36542       4.885333 12.60887       5.576621 35.18826 5.906241 30.11353 7.600111 5.074732       9.625247 
1 1 1 13  10 32 o 17.36342 6.049172 3.715082       3.140145 5.512777       4.127648 1.245212       4.838177 20.49346 6.942589 16.52276 6.984377 3.970703       9.847897 
1 1 1 13  10 33 o 18.39715 6.116484 4.494377       3.205032 6.368080       4.267592 2.070342       4.854024 21.38626 7.056023 17.00137 7.078277 4.384899       9.994472 
1 1 1 13  10 34 o 31.28200 5.752786 13.63288       4.223845 17.82070       4.819448 -0.2384899     8.771290 35.89578 5.699870 18.82574 8.595441 17.07004       10.31359 
1 1 1 13  10 35 o 40.97705 4.197342 22.29992       4.132159 28.53918       5.599532 14.83959       6.123002 45.50584 5.139318 29.93783 8.167715 15.56801       9.650085 
1 1 1 13  10 36 o 14.51739 6.040607 1.980382       3.532201 0.2172618      5.051228 3.667503       4.941164 14.69939 6.636416 17.23918 7.156398 -2.539783      9.759921 
1 1 1 13  10 37 o 25.93038 5.809239 10.30348       3.579570 10.39134       4.789281 10.19228       5.387997 24.29022 7.413447 23.39035 7.931949 0.8998756      10.85703 
1 1 1 13  10 38 o 19.84039 6.357468 6.700835       3.478120 7.490028       4.717252 5.760707       5.148618 19.92501 7.355252 18.02628 7.375557 1.898727       10.41626 
1 1 1 13  10 39 o 14.75604 6.421779 2.911474       4.318007 16.88270       9.145663 -1.096283      4.898336 22.54350 9.569273 12.62857 5.979842 9.914933       11.28404 
1 1 1 13  10 40 o 9.969175 4.730865 -1.621771      3.098241 -1.843003      3.968565 -1.276489      4.957889 10.98143 5.250991 12.21814 5.849556 -1.236704      7.860675 
1 1 1 13  10 41 o 19.81713 6.860854 8.588593       4.036329 10.74017       4.805848 3.436876       7.436478 21.06605 7.471770 14.74680 7.087379 6.319253       10.29846 
1 1 1 13  11 0  o 94.80209 2.485929 109.6211       5.738096 106.1053       9.489551 111.6476       7.204390 93.17715 4.189986 95.64786 3.094981 -2.470703      5.209116 
1 1 1 13  11 1  o 299.7999 4.199019 1096.301       30.67719 1143.291       49.50274 1067.003       39.08752 305.9145 6.640381 295.6621 5.425083 10.25244       8.574741 
1 1 1 13  11 2  o 104.0481 2.756638 132.0652       6.983403 149.2020       14.38043 126.7768       7.988603 110.4282 5.359879 101.9195 3.220497 8.508644       6.252991 
1 1 1 13  11 3  o 129.1706 2.551857 203.3881       8.032599 192.5760       12.03764 212.0670       10.78494 125.5904 3.938092 131.8337 3.359768 -6.243225      5.176544 
1 1 1 13  11 4  o 214.9187 3.297380 563.2485       17.26948 530.3258       26.01713 589.1790       23.08958 208.4258 5.122379 219.7481 4.311762 -11.32228      6.695526 
1 1 1 13  11 5  o 117.2376 2.388167 167.5469       6.822882 167.0747       9.874592 167.9782       9.438216 116.9918 3.467425 117.3178 3.304631 -0.3259583     4.789950 
1 1 1 13  11 6  o 262.7726 3.452969 842.1917       22.11103 826.0284       30.43960 860.2467       32.17167 260.1146 4.802177 265.4285 4.973818 -5.313873      6.913738 
1 1 1 13  11 7  o 248.9622 4.738188 756.7993       28.74629 761.1786       34.67470 747.1743       51.40539 249.5648 5.701555 246.6451 8.565638 2.919678       10.28970 
1 1 1 13  11 8  o 179.1184 4.051987 391.5656       17.68660 369.6887       28.78448 404.8350       22.41771 173.6489 6.815449 181.9743 5.060193 -8.325378      8.488574 
1 1 1 13  11 9  o 253.1827 6.170539 784.2722       38.07090 0.000000       0.000000 784.2722       38.07090 ?        ?        253.1827 6.170539 0.000000       6.170539 
1 1 1 13  11 10 o 56.13596 4.325227 38.70654       5.871197 35.49873       8.707110 41.38116       7.950614 53.40177 6.848297 57.88972 5.710172 -4.487953      8.916571 
1 1 1 13  11 11 o 55.87961 4.438899 38.37844       5.994924 42.91760       9.347068 35.20640       7.813703 58.82116 6.636607 53.28288 6.129253 5.538280       9.033952 
1 1 1 13  11 12 f 178.1025 4.993105 388.0929       21.64951 411.6541       31.13593 366.0395       30.12323 183.0763 6.991856 172.5824 7.178244 10.49397       10.02064 
1 1 1 13  11 13 o 89.87418 4.400899 98.93221       9.609260 94.67503       13.20668 103.7215       14.00776 87.68330 6.221143 91.78475 6.300931 -4.101448      8.854624 
1 1 1 13  11 14 o 129.6295 4.554321 205.6768       14.36443 208.0280       20.03538 203.1899       20.60535 130.0948 6.338853 128.5221 6.601207 1.572693       9.151884 
1 1 1 13  11 15 o 71.88256 4.722722 63.47177       8.226964 64.40984       11.31462 62.41950       11.98354 72.15542 6.504557 70.93269 7.024878 1.222733       9.573828 
1 1 1 13  11 16 o 175.9685 5.017015 379.4074       21.49180 404.4846       30.88132 355.8529       29.92905 181.2207 7.006009 169.8967 7.245533 11.32408       10.07878 
1 1 1 13  11 17 o 103.6125 4.533422 131.6131       11.41884 143.3623       16.21194 120.0455       16.08615 107.8688 6.193448 98.57192 6.737234 9.296890       9.151454 
1 1 1 13  11 18 o 164.1135 3.129697 328.8970       12.51650 331.7104       17.70741 326.0877       17.69460 164.5741 4.419272 163.1656 4.454331 1.408463       6.274634 
1 1 1 13  11 19 o 84.44057 2.223564 87.04447       4.571502 84.74043       5.703360 91.18484       7.645496 83.26627 2.814818 86.29008 3.644076 -3.023804      4.604617 
1 1 1 13  11 20 o 71.05743 2.443855 61.69318       4.225462 63.26572       5.557417 59.53845       6.505325 71.88977 3.180138 69.65870 3.847224 2.231071       4.991433 
1 1 1 13  11 21 o 79.76751 2.866203 77.81911       5.562404 77.98813       8.276358 77.67989       7.511937 79.67182 4.278527 79.57151 3.885737 0.1003113      5.779684 
1 1 1 13  11 22 o 61.66433 2.759604 46.54308       4.136330 49.45669       5.539660 42.87188       6.218286 63.47082 3.596280 58.97036 4.357930 4.500458       5.650202 
1 1 1 13  11 23 o 55.61024 2.910125 37.90469       3.929964 42.25129       5.261305 32.41862       5.910845 58.61843 3.702092 51.13844 4.799227 7.479996       6.061193 
1 1 1 13  11 24 o 110.6595 4.803693 150.9762       12.92303 150.0683       17.70428 152.0116       18.90677 109.7389 6.651597 110.2910 7.071889 -0.5521622     9.708520 
1 1 1 13  11 25 o 40.52236 3.421813 20.26918       3.347441 24.17569       4.434433 15.09425       5.103826 44.15455 4.170646 34.32899 6.334269 9.825558       7.584013 
1 1 1 13  11 26 o 39.33652 3.616349 19.16187       3.427823 17.85836       4.489062 20.98484       5.308725 37.67841 5.013376 40.78032 5.480617 -3.101910      7.427725 
1 1 1 13  11 27 o 62.77786 3.262693 48.53463       4.974231 49.12597       6.079412 47.33691       8.652032 62.99828 3.980363 61.27774 5.865524 1.720543       7.088559 
1 1 1 13  11 28 o 57.97196 3.313486 41.50764       4.661510 44.04904       5.695807 36.35258       8.112146 59.56119 3.946499 53.26595 6.376097 6.295235       7.498631 
1 1 1 13  11 29 o 67.06634 3.897874 55.97586       6.342973 73.97885       11.98970 48.97893       7.474633 75.75829 6.558999 62.31162 4.963482 13.44667       8.225365 
1 1 1 13  11 30 o 11.76861 5.184194 -0.6191633     2.890798 -1.639144      3.643175 1.114701       4.749978 12.45271 5.627758 16.59276 6.961731 -4.140046      8.951947 
1 1 1 13  11 31 o 32.16973 4.658581 13.36453       3.545880 12.89131       4.511195 14.12952       5.735781 30.95603 6.196506 31.82617 7.516388 -0.8701363     9.741292 
1 1 1 13  11 32 o 25.01445 5.650549 8.492435       3.362860 10.53006       4.320103 5.359218       5.357071 27.51894 6.539146 20.87809 7.813014 6.640852       10.18841 
1 1 1 13  11 33 o 24.27160 5.699634 8.168261       3.313279 8.069860       4.280978 8.315250       5.232245 23.62840 6.963325 23.77303 7.811439 -0.1446342     10.46453 
1 1 1 13  11 34 o 11.62140 5.157947 -0.4086666     2.913969 -0.1224413     3.604193 -0.9488760     4.951482 13.07782 5.773620 14.42888 6.536921 -1.351058      8.721583 
1 1 1 13  11 35 o 13.64261 5.965890 0.5542935      3.765435 4.013419       4.370632 -9.406290      7.416576 17.57953 6.930685 13.47772 6.611285 4.101810       9.578281 
1 1 1 13  11 36 o 19.33840 6.297137 5.805675       3.403789 4.274796       4.492329 7.869193       5.215612 17.48642 6.983621 21.36421 7.758393 -3.877783      10.43856 
1 1 1 13  11 37 o 17.08223 6.117603 4.515988       3.229232 5.696015       4.295059 2.981591       4.897700 18.51916 6.981899 16.05682 6.913344 2.462336       9.825541 
1 1 1 13  11 38 o 16.28422 6.134123 4.264610       3.313768 5.844251       4.495883 2.385679       4.903333 17.99927 7.049409 15.06451 6.688207 2.934760       9.717319 
1 1 1 13  11 39 f 20.70334 6.414415 7.881570       3.568941 5.733799       4.718087 10.75428       5.456550 17.09687 7.034996 21.55936 7.918883 -4.462482      10.59244 
1 1 1 13  11 40 o 11.33473 5.565748 -4.137995      5.298532 -7.268524      8.507562 -2.154258      6.772334 12.71969 6.376727 13.03621 6.378608 -0.3165255     9.019383 
1 1 1 13  12 0  o 207.1543 3.214024 523.2246       16.22480 514.6046       25.14625 529.3727       21.23667 205.3404 5.025308 208.3189 4.183325 -2.978485      6.538649 
1 1 1 13  12 1  f 128.8136 3.139228 202.3128       9.854188 200.3433       16.73263 203.3586       12.19289 127.9893 5.376787 129.0649 3.881112 -1.075615      6.631204 
1 1 1 13  12 2  o 43.27405 3.179701 22.95683       3.329715 16.15363       6.747497 25.14682       3.828312 35.63234 7.970572 45.27500 3.496950 -9.642654      8.703946 
1 1 1 13  12 3  o 198.7982 3.131197 481.9024       15.16907 475.8215       23.47566 486.2612       19.87560 197.4335 4.879337 199.6423 4.085371 -2.208786      6.363818 
1 1 1 13  12 4  o 101.4402 2.407473 125.4393       5.951244 121.0993       8.889157 128.9649       8.011726 99.57115 3.669734 102.7873 3.202438 -3.216141      4.870581 
1 1 1 13  12 5  o 174.8803 2.626552 372.8651       11.19342 350.8112       14.92170 401.2449       16.92704 169.5838 3.610753 181.3515 3.830220 -11.76772      5.263851 
1 1 1 13  12 6  o 136.6834 2.331414 227.7514       7.765534 231.9302       10.55621 222.8230       11.46413 137.9027 3.141226 135.1088 3.484849 2.793930       4.691639 
1 1 1 13  12 7  o 283.4758 5.358932 981.9760       37.01948 1021.320       64.61899 962.7547       45.16591 288.1383 9.214712 280.4758 6.608140 7.662506       11.33924 
1 1 1 13  12 8  o 166.8607 4.859410 340.4002       19.73835 346.8968       27.25269 333.2321       28.62643 168.1976 6.662136 164.7672 7.146515 3.430359       9.770196 
1 1 1 13  12 9  o 275.7810 5.292477 929.6900       35.56800 1056.156       65.32041 876.3897       42.40593 292.8589 9.164085 267.5387 6.504349 25.32028       11.23775 
1 1 1 13  12 10 o 256.5833 6.128164 805.8765       38.31730 820.3401       54.14353 791.3643       54.23427 258.1551 8.618647 253.4973 8.792703 4.657806       12.31230 
1 1 1 13  12 11 o 281.6545 5.387244 970.2902       36.97596 948.6111       62.14487 982.1710       46.00554 277.3270 9.208305 283.0860 6.668921 -5.759033      11.36958 
1 1 1 13  12 12 o 182.0834 5.053819 405.7546       22.40299 424.0486       31.94183 388.0427       31.42959 185.7587 7.069162 177.6403 7.275807 8.118362       10.14448 
1 1 1 13  12 13 o 224.7615 5.675049 619.0223       31.05848 613.9749       43.37741 624.3322       44.49037 223.2266 7.986970 225.0603 8.125394 -1.833710      11.39358 
1 1 1 13  12 14 o 161.6178 4.833655 319.8012       19.01571 333.8697       26.92995 305.8112       26.85476 164.7713 6.720945 157.6197 7.009100 7.151627       9.710747 
1 1 1 13  12 15 o 277.0435 6.531127 942.5700       44.09326 945.7516       62.03782 939.3220       62.68175 276.2900 9.227094 275.2836 9.357427 1.006409       13.14156 
1 1 1 13  12 16 f 185.0747 5.160067 419.8954       23.24954 424.8191       32.52435 414.7505       33.24719 185.6260 7.203756 183.3328 7.457378 2.293228       10.36854 
1 1 1 13  12 17 o 50.26912 5.520181 31.35867       6.651115 34.19271       9.065907 28.05539       9.787704 52.17919 7.331775 46.84259 8.899696 5.336594       11.53081 
1 1 1 13  12 18 o 118.1469 6.610359 172.3666       18.95607 0.000000       0.000000 172.3666       18.95607 ?        ?        118.1469 6.610359 0.000000       6.610359 
1 1 1 13  12 19 o 35.97121 9.886189 16.67533       8.932743 0.000000       0.000000 16.67533       8.932743 ?        ?        35.97121 9.886189 0.000000       9.886189 
1 1 1 13  12 20 o 86.19434 2.601340 90.78156       5.457764 91.13838       7.755715 90.43150       7.681704 86.23911 3.699069 85.90622 3.677927 0.3328934      5.216345 
1 1 1 13  12 21 o 43.03918 2.510524 22.69190       2.621651 20.16301       3.219691 27.66739       4.516143 40.47724 3.292540 47.37271 3.947895 -6.895473      5.140690 
1 1 1 13  12 22 o 131.2175 2.898123 210.4295       9.267120 208.3579       12.78151 212.7255       13.45585 130.3250 4.029399 131.6469 4.199724 -1.321838      5.820115 
1 1 1 13  12 23 o 22.51019 6.346154 6.444175       3.630336 22.50228       9.031845 3.349862       3.964711 41.51520 9.172374 18.34805 6.748291 23.16715       11.38736 
1 1 1 13  12 24 o 121.7530 2.880959 181.3289       8.547773 172.5652       11.46660 192.2897       12.82368 118.4999 3.976455 125.0314 4.214818 -6.531487      5.794557 
1 1 1 13  12 25 o 24.65219 5.217853 7.792476       3.036751 6.925648       3.178102 16.89209       10.29705 23.18180 5.672817 35.80505 10.85871 -12.62325      12.25122 
1 1 1 13  12 26 o 42.71633 3.437038 22.55034       3.547608 20.60328       4.241312 27.08556       6.473070 40.64062 4.350156 46.27183 5.872704 -5.631210      7.308386 
1 1 1 13  12 27 o 32.83904 3.765752 13.46142       2.959095 12.07724       3.631186 16.19781       5.105535 30.79385 5.011057 35.45183 6.131520 -4.657978      7.918726 
1 1 1 13  12 28 o 50.08846 3.135632 31.00005       3.808156 32.59398       4.871879 28.49654       6.105710 51.16378 3.937761 47.37206 5.384483 3.791729       6.670729 
1 1 1 13  12 29 o 80.00526 2.910386 78.94975       5.664752 79.14862       7.463463 78.67950       8.700370 79.74403 3.852056 79.19085 4.527308 0.5531769      5.944313 
1 1 1 13  12 30 o 85.53876 3.779120 91.42699       7.858080 94.33813       14.09433 90.11392       9.465814 84.49946 6.904854 84.40549 4.619661 0.9396362E-01  8.307724 
1 1 1 13  12 31 o 17.38713 5.815497 3.813039       2.896574 5.189726       3.565952 1.142918       4.966192 19.87309 6.443488 16.66849 7.062466 3.204601       9.560176 
1 1 1 13  12 32 o 31.28330 4.583979 12.80107       3.390893 14.91752       4.421979 9.780219       5.282969 33.26291 5.657710 25.93036 7.758938 7.332550       9.602646 
1 1 1 13  12 33 o 19.33906 5.977804 5.199760       3.101708 4.192520       3.870989 7.006308       5.184177 18.14531 6.669013 22.03756 7.765425 -3.892248      10.23609 
1 1 1 13  12 34 o 12.18971 5.312305 0.1542713      2.963581 1.111468       3.929463 -1.108428      4.513178 14.54210 6.225566 13.62250 6.198830 0.9195967      8.785395 
1 1 1 13  12 35 o 27.27179 5.381412 10.68632       3.449341 17.18440       4.598496 2.326459       5.215826 34.47591 5.670456 16.49177 7.117718 17.98413       9.100328 
1 1 1 13  12 36 o 29.54947 5.921187 13.20548       4.115099 15.53194       4.795048 6.702775       8.016646 31.53840 6.456605 20.09419 8.747416 11.44421       10.87221 
1 1 1 13  12 37 o 9.845094 4.697663 -2.729682      3.140777 -0.9712755     4.334088 -4.674311      4.557812 12.65827 5.873418 11.09670 5.385262 1.561564       7.968568 
1 1 1 13  12 38 o 24.78205 6.033796 10.20074       3.609268 13.61631       4.896695 6.137658       5.340710 26.98254 7.280186 17.91216 7.438314 9.070377       10.40815 
1 1 1 13  12 39 o 10.39924 4.965960 -2.094603      3.524237 -0.8765383     4.153206 -5.227560      6.660789 11.82808 5.572088 12.34363 6.095471 -0.5155487     8.258507 
1 1 1 13  12 40 o 12.48459 5.542618 1.556103       3.367181 3.034138       4.400563 -0.5315684     5.229942 14.17283 6.311566 12.58023 6.018870 1.592607       8.721391 
1 1 1 13  13 0  o 118.0775 2.752456 169.9762       7.919975 182.3091       15.71218 165.7752       9.170192 122.0784 5.294137 116.5520 3.231781 5.526375       6.202603 
1 1 1 13  13 1  o 205.0345 3.196501 512.6345       15.97121 506.5207       24.88531 516.9166       20.82628 203.6893 5.013474 205.8325 4.152040 -2.143219      6.509559 
1 1 1 13  13 2  o 115.0605 2.824486 161.4149       7.919577 143.6567       15.53029 167.6556       9.206587 108.2676 5.908732 117.2077 3.226410 -8.940125      6.732224 
1 1 1 13  13 3  o 245.0764 4.007604 732.8459       23.93439 743.1935       34.11326 722.8136       33.58949 246.6283 5.676024 243.2243 5.667092 3.403976       8.020798 
1 1 1 13  13 4  o 263.3521 3.818959 846.1763       24.50857 839.0986       38.17451 851.1391       31.96661 261.9944 5.979230 264.0011 4.968838 -2.006653      7.774352 
1 1 1 13  13 5  o 20.19890 3.349561 5.109260       1.591009 4.150601       1.896729 7.385101       2.922431 18.07966 4.356731 24.13355 5.127548 -6.053894      6.728511 
1 1 1 13  13 6  o 117.2609 2.471591 167.6435       7.062623 161.8851       10.46911 172.4529       9.567750 115.1225 3.736710 118.8557 3.306556 -3.733200      4.989621 
1 1 1 13  13 7  o 142.1620 4.739964 247.1263       16.39786 0.000000       0.000000 247.1263       16.39786 ?        ?        142.1620 4.739964 0.000000       4.739964 
1 1 1 13  13 8  o 415.0722 7.318141 2112.206       74.02194 1936.933       120.3670 2218.808       93.87080 394.9528 12.52204 424.7170 9.069737 -29.76422      15.46162 
1 1 1 13  13 9  o 135.9809 4.644408 226.1587       15.36761 203.8624       19.80685 259.8803       24.35868 128.8803 6.325891 145.4597 6.891466 -16.57944      9.354634 
1 1 1 13  13 10 o 194.7832 4.301634 463.4052       20.41836 440.3531       33.39769 477.1643       25.80212 189.3193 7.252528 197.4487 5.367451 -8.129425      9.022676 
1 1 1 13  13 11 o 247.6490 6.013722 751.1006       36.29243 723.8467       49.71507 782.1954       53.10274 242.3775 8.429879 251.8900 8.663970 -9.512482      12.08831 
1 1 1 13  13 12 o 174.9666 4.981393 374.7319       21.21778 361.3182       29.06027 390.0469       31.05155 171.4245 6.971039 178.0739 7.170276 -6.649384      10.00041 
1 1 1 13  13 13 o 164.6604 4.866862 331.9412       19.50731 343.9855       27.65571 320.0149       27.51980 167.2473 6.799798 161.2557 7.019979 5.991608       9.773298 
1 1 1 13  13 14 o 161.0301 4.857330 317.5771       19.03899 337.7543       27.32913 298.5502       26.53867 165.6737 6.783528 155.6918 7.012832 9.981842       9.756846 
1 1 1 13  13 15 o 202.4381 5.405550 502.5237       26.64277 493.2678       36.85464 512.6562       38.56034 199.9520 7.577341 203.7813 7.779270 -3.829208      10.85970 
1 1 1 13  13 16 o 119.6731 6.612996 176.6332       19.21052 0.000000       0.000000 176.6332       19.21052 ?        ?        119.6731 6.612996 0.000000       6.612996 
1 1 1 13  13 17 o 98.74652 6.804921 120.6244       16.27486 0.000000       0.000000 120.6244       16.27486 ?        ?        98.74652 6.804921 0.000000       6.804921 
1 1 1 13  13 18 o 83.79881 4.688517 86.29535       9.536176 87.46474       13.11673 84.98425       13.88874 84.05051 6.453332 82.73728 6.952771 1.313232       9.486122 
1 1 1 13  13 19 o 104.9908 4.662257 135.3700       11.89869 150.2519       17.13261 121.5035       16.53773 110.2504 6.404434 98.98676 6.899055 11.26369       9.413486 
1 1 1 13  13 20 o 41.28806 6.826864 21.59659       6.628975 18.59330       8.773526 25.59200       10.11945 37.82581 9.525216 44.40047 9.630324 -6.574665      13.54522 
1 1 1 13  13 21 o 83.94534 3.179917 86.27871       6.493257 98.42921       14.38859 83.17142       7.276309 88.96709 6.685616 82.35614 3.634545 6.610954       7.609690 
1 1 1 13  13 22 o 37.11256 4.096965 17.09010       3.643667 9.814256       8.445181 18.75427       4.038929 28.92874 9.927874 38.85793 4.339290 -9.929188      10.83476 
1 1 1 13  13 23 o 81.35133 2.621161 80.96049       5.189521 81.79330       7.031377 79.96406       7.691096 81.63501 3.542935 80.64862 3.925198 0.9863892      5.287680 
1 1 1 13  13 24 o 76.32594 2.845318 71.37364       5.282969 74.79799       6.632023 65.42783       8.739019 78.03030 3.496643 72.65951 4.965375 5.370796       6.073011 
1 1 1 13  13 25 o 21.04326 4.730644 5.680593       2.366743 6.514567       2.779325 3.480361       4.514372 22.50253 5.176300 19.06853 7.164626 3.434004       8.838888 
1 1 1 13  13 26 o 44.40263 3.732032 24.43606       4.000885 26.96267       4.345497 10.37487       10.25135 46.63052 3.858648 29.85700 10.87193 16.77352       11.53637 
1 1 1 13  13 27 o 89.87106 2.785937 99.21034       6.094001 96.16003       8.004461 103.4161       9.398958 88.19508 3.732801 91.28032 4.236945 -3.085236      5.646725 
1 1 1 13  13 28 o 99.70171 2.843318 122.3432       6.901133 116.9980       9.090052 129.6160       10.60307 97.09316 3.849490 101.9872 4.275771 -4.894005      5.753329 
1 1 1 13  13 29 o 64.02222 3.366513 50.89119       5.233813 46.31873       5.662269 77.72051       13.71578 60.90041 3.834817 76.59123 7.442332 -15.69082      8.372223 
1 1 1 13  13 30 o 61.26469 3.093926 46.63866       4.604136 45.07153       6.049857 48.79543       7.097330 59.74746 4.181576 61.87315 4.743303 -2.125690      6.323330 
1 1 1 13  13 31 o 27.57429 6.519502 10.51641       4.311368 8.512870       7.914143 11.36193       5.141229 25.16187 9.479364 28.29410 7.380569 -3.132236      12.01379 
1 1 1 13  13 32 o 31.06818 4.735505 12.75225       3.472049 12.91914       4.745906 12.56007       5.092871 30.22839 6.625907 29.47004 7.162611 0.7583447      9.757339 
1 1 1 13  13 33 o 21.87521 6.033388 6.837286       3.320343 11.68069       4.482709 0.9500830      4.942195 28.31958 6.615634 15.84617 6.883495 12.47341       9.547204 
1 1 1 13  13 34 o 17.82848 5.812231 4.520658       2.899326 2.587849       3.567655 8.279819       4.975467 15.52739 6.216003 22.77886 7.621919 -7.251476      9.835260 
1 1 1 13  13 35 o 14.76958 5.742118 2.639841       2.965326 4.959394       3.783864 -1.052137      4.773785 18.21524 6.609205 13.61391 6.262292 4.601330       9.104828 
1 1 1 13  13 36 o 10.25443 4.764915 -1.489216      2.868340 -1.630572      3.702471 -1.277028      4.536236 11.56627 5.387676 12.92035 5.999763 -1.354081      8.063760 
1 1 1 13  13 37 o 16.67803 6.490097 4.413481       3.790930 1.197485       4.208123 18.26290       8.732656 13.86256 6.172791 26.10500 9.929465 -12.24244      11.69178 
1 1 1 13  13 38 o 8.145604 4.055823 -6.209673      3.189683 -3.759937      3.926706 -10.96165      5.468973 10.29636 4.997247 9.972448 5.014901 0.3239155      7.079669 
1 1 1 13  13 39 o 14.27040 5.843345 3.188259       3.234781 3.255818       4.268259 3.097092       4.958228 14.62669 6.374804 14.72112 6.616800 -0.9442902E-01 9.188046 
1 1 1 13  13 40 o 11.84684 5.312054 1.058895       3.174389 -1.231199      4.116642 4.417951       4.985687 11.27370 5.379012 15.15331 6.734941 -3.879612      8.619350 
1 1 1 13  14 0  o 135.1946 2.870794 222.8589       9.457960 234.8090       13.79413 212.2567       12.99295 138.6621 4.086717 131.8319 4.049172 6.830170       5.753004 
1 1 1 13  14 1  o 116.1747 2.751734 164.5584       7.790300 178.1463       15.32730 159.8255       9.045847 120.6586 5.225186 114.4309 3.247200 6.227676       6.151982 
1 1 1 13  14 2  o 165.5484 3.236531 334.2525       13.05692 346.8000       26.78560 330.3418       14.95390 168.2509 6.545414 164.5511 3.729216 3.699860       7.533226 
1 1 1 13  14 3  o 65.19454 2.449833 51.89086       3.885174 47.75095       5.913825 55.03443       5.153289 62.43460 3.906509 67.10055 3.160417 -4.665951      5.024844 
1 1 1 13  14 4  o 189.2196 3.061751 436.6659       14.11797 453.7491       22.37706 425.3693       18.19668 192.7560 4.763860 186.6937 3.999691 6.062332       6.220281 
1 1 1 13  14 5  o 36.07729 2.922471 15.97709       2.547353 21.45538       3.862957 11.76189       3.388494 41.75499 3.839382 30.68635 4.679139 11.06863       6.052701 
1 1 1 13  14 6  o 272.4225 4.439210 906.2381       29.47031 835.3232       56.31821 932.9785       34.58309 260.5453 8.883114 276.3102 5.136068 -15.76495      10.26104 
1 1 1 13  14 7  o 140.4191 4.524968 241.0703       15.46359 214.7356       20.30280 277.4534       23.86391 132.2978 6.315725 150.3875 6.527236 -18.08969      9.082577 
1 1 1 13  14 8  o 79.70413 3.834104 77.72393       7.425148 96.88828       12.32411 66.80326       9.303218 88.81079 5.724976 73.73918 5.210804 15.07161       7.741307 
1 1 1 13  14 9  o 207.9306 4.445554 528.1625       22.52581 471.2484       35.82887 565.3634       28.96675 195.7957 7.523201 214.9054 5.535770 -19.10974      9.340413 
1 1 1 13  14 10 o 156.3771 4.880329 299.2495       18.57489 324.1149       25.97444 273.2237       26.57353 162.4699 6.574078 149.0019 7.341089 13.46803       9.854445 
1 1 1 13  14 11 o 110.7505 3.753583 149.9429       10.11579 133.5497       15.86852 161.1652       13.12936 104.1944 6.278792 114.7197 4.706438 -10.52539      7.846897 
1 1 1 13  14 12 o 151.2465 4.760669 280.0341       17.52461 271.7733       23.98701 289.4910       25.66507 148.6679 6.637728 153.3948 6.883410 -4.726883      9.562467 
1 1 1 13  14 13 o 108.8886 6.650848 146.1273       17.56383 0.000000       0.000000 146.1273       17.56383 ?        ?        108.8886 6.650848 0.000000       6.650848 
1 1 1 13  14 14 o 29.77229 9.960119 10.40385       8.496438 0.000000       0.000000 10.40385       8.496438 ?        ?        29.77229 9.960119 0.000000       9.960119 
1 1 1 13  14 15 o 243.7905 8.670553 736.2834       51.42894 0.000000       0.000000 736.2834       51.42894 ?        ?        243.7905 8.670553 0.000000       8.670553 
1 1 1 13  14 16 o 109.8261 4.596323 147.9162       12.27415 156.2112       17.32839 139.5638       17.38829 112.5477 6.343767 106.2761 6.748923 6.271576       9.262362 
1 1 1 13  14 17 o 127.9141 4.686684 200.6877       14.58429 202.7586       20.24006 198.4512       21.03342 128.1846 6.500697 126.7278 6.836164 1.456802       9.433568 
1 1 1 13  14 18 o 107.0691 4.682611 140.7488       12.18812 125.6404       16.03214 161.4382       18.76098 100.7701 6.564380 114.2271 6.770218 -13.45693      9.430108 
1 1 1 13  14 19 o 71.67841 5.084027 63.37858       8.822762 52.54082       11.72300 77.53631       13.39879 64.71263 7.577152 78.90769 7.041956 -14.19506      10.34420 
1 1 1 13  14 20 o 134.8796 4.863948 223.6428       15.96098 229.0154       22.19559 217.8895       22.96874 135.9504 6.720450 132.4558 7.142321 3.494583       9.806998 
1 1 1 13  14 21 o 71.97981 5.276201 64.09571       9.190526 65.30846       12.62269 62.72746       13.40752 72.17943 7.275507 70.53737 7.937596 1.642059       10.76747 
1 1 1 13  14 22 o 83.40837 7.068709 87.05817       14.23248 87.05817       14.23248 0.000000       0.000000 83.40837 7.068709 ?        ?        0.000000       7.068709 
1 1 1 13  14 23 o 62.23032 2.816756 47.45956       4.260495 52.65607       5.850623 41.59277       6.216509 65.42610 3.684456 57.99120 4.432534 7.434898       5.763903 
1 1 1 13  14 24 o 37.52671 3.077939 17.36333       2.790015 18.67697       3.726923 15.68857       4.208108 38.77881 4.001228 35.29535 5.035100 3.483463       6.431334 
1 1 1 13  14 25 o 53.26761 3.440627 34.98889       4.442298 34.68032       4.809739 36.78008       11.58822 52.97209 3.750206 52.75600 9.356394 0.2160835      10.07999 
1 1 1 13  14 26 o 33.52134 3.574593 13.98681       2.875009 15.72869       3.644650 11.11747       4.677765 35.41005 4.312540 29.11824 6.727554 6.291809       7.991119 
1 1 1 13  14 27 o 19.02528 5.438128 4.660341       2.647387 4.757839       2.763034 3.568237       9.247427 19.23506 5.573553 23.76278 9.820493 -4.527721      11.29188 
1 1 1 13  14 28 o 32.06545 3.755242 12.91619       2.878826 11.86549       3.471853 15.22834       5.150263 30.41279 4.847129 33.97682 6.456258 -3.564030      8.073285 
1 1 1 13  14 29 o 78.71581 2.808522 76.55008       5.378724 76.09868       7.049379 77.17905       8.321167 78.08232 3.715436 78.27561 4.379829 -0.1932907     5.743463 
1 1 1 13  14 30 o 16.68457 5.256141 3.575843       2.385972 2.400222       2.824162 6.507325       4.459638 15.15566 5.672570 22.05731 7.209632 -6.901643      9.173704 
1 1 1 13  14 31 o 23.54167 5.088478 7.432562       2.833928 8.069622       3.669829 6.491457       4.460413 24.13903 6.204895 21.76028 7.215010 2.378748       9.516150 
1 1 1 13  14 32 o 16.58135 6.528481 2.845607       3.873513 5.194111       8.450277 2.220868       4.358375 21.95964 9.253764 16.44582 6.763712 5.513815       11.46211 
1 1 1 13  14 33 o 18.28160 5.651699 4.690500       2.772416 7.086854       3.529243 0.8284664      4.480373 22.02484 6.273461 15.06112 6.548122 6.963718       9.068308 
1 1 1 13  14 34 o 36.45258 4.074332 17.70850       3.557441 19.07022       4.552299 15.57251       5.701442 36.89631 5.207686 31.01912 7.602653 5.877193       9.215222 
1 1 1 13  14 35 o 14.36546 5.700128 2.382166       2.973940 1.907450       3.832246 3.100874       4.715338 14.68095 6.211418 16.49622 6.929714 -1.815271      9.306054 
1 1 1 13  14 36 o 28.34357 5.608881 12.16327       3.736860 15.21250       4.555140 5.887836       6.534736 31.08664 6.230210 18.81295 8.040519 12.27369       10.17180 
1 1 1 13  14 37 o 22.64378 6.280650 8.682819       3.586827 16.25210       4.877127 -0.2340332     5.293495 30.90284 6.671987 13.76363 6.421496 17.13921       9.260185 
1 1 1 13  14 38 o 17.27561 6.601685 5.572529       3.871586 7.597131       4.499943 -0.1965466     7.596095 19.22791 7.167698 14.62501 7.062459 4.602897       10.06252 
1 1 1 13  14 39 o 12.85879 5.566984 1.947917       3.210359 2.579402       4.341895 1.186321       4.768264 14.00155 6.250082 13.31477 6.172001 0.6867809      8.783914 
1 1 1 13  15 0  o 331.4055 4.588942 1340.896       37.06025 1357.574       58.82182 1329.918       47.72358 332.9624 7.249485 329.8238 5.937655 3.138672       9.370740 
1 1 1 13  15 1  o 302.7859 4.260405 1119.052       31.43566 1064.927       48.13391 1159.307       41.51116 294.9876 6.695935 307.9962 5.530741 -13.00861      8.684736 
1 1 1 13  15 2  o 156.2536 3.621928 297.8812       13.79133 0.000000       0.000000 297.8812       13.79133 ?        ?        156.2536 3.621928 0.000000       3.621928 
1 1 1 13  15 3  o 191.0459 3.082523 445.1599       14.35093 448.3732       22.51443 442.9609       18.62490 191.5349 4.827510 190.5075 4.011859 1.027420       6.276932 
1 1 1 13  15 4  o 216.0328 3.333210 569.3410       17.54763 551.2980       26.89963 582.7068       23.15209 212.3979 5.197085 218.4609 4.348909 -6.062973      6.776629 
1 1 1 13  15 5  o 16.35155 4.392980 3.375873       1.787573 0.6487298      2.745591 5.382471       2.355115 13.08041 5.372772 20.58089 4.786534 -7.500480      7.195665 
1 1 1 13  15 6  o 222.0157 3.855044 601.6502       20.85687 512.2454       38.61681 638.4709       24.78235 204.1577 7.776232 228.6414 4.447865 -24.48367      8.958420 
1 1 1 13  15 7  o 309.6991 5.756145 1173.521       43.44179 1172.786       74.34924 1173.902       53.52992 308.1954 9.912414 309.4152 7.099355 -1.219757      12.19249 
1 1 1 13  15 8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  15 9  o 180.7870 5.064365 400.0073       22.28949 407.8878       31.20250 391.7953       31.85173 182.1864 7.041346 178.4853 7.338745 3.701111       10.17043 
1 1 1 13  15 10 o 78.78266 6.848300 76.72855       13.01719 0.000000       0.000000 76.72855       13.01719 ?        ?        78.78266 6.848300 0.000000       6.848300 
1 1 1 13  15 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  15 12 o 159.0421 7.011621 311.4531       27.10803 0.000000       0.000000 311.4531       27.10803 ?        ?        159.0421 7.011621 0.000000       7.011621 
1 1 1 13  15 13 o 27.62196 8.316503 9.501834       6.055551 16.80115       8.364795 1.463907       8.777811 36.16709 9.404286 22.81541 9.510252 13.35168       13.37481 
1 1 1 13  15 14 o 225.2525 5.773330 622.8089       31.66461 659.1128       45.52746 588.7934       44.06917 230.9108 8.103390 218.1512 8.304911 12.75958       11.60330 
1 1 1 13  15 15 o 107.2117 4.617102 140.9648       12.03451 135.1075       16.36031 147.8711       17.76509 104.6324 6.447683 109.4281 6.693998 -4.795654      9.294205 
1 1 1 13  15 16 o 17.51390 7.568341 -0.6370842     5.911734 -0.6983992     8.274012 -0.5731384     8.449663 20.77941 8.966462 21.07924 9.078205 -0.2998295     12.75975 
1 1 1 13  15 17 o 47.16618 6.325377 27.85514       7.087202 24.15060       9.736903 32.02916       10.33549 43.21823 9.504317 50.08846 8.787873 -6.870224      12.94445 
1 1 1 13  15 18 o 90.05691 4.739151 99.71201       10.36388 98.72247       14.19396 100.8420       15.16795 89.23997 6.573043 90.10509 6.961781 -0.8651276     9.574512 
1 1 1 13  15 19 o 58.49627 5.554801 42.45963       7.823411 41.96396       10.92082 42.98217       11.21291 57.60150 7.995385 58.27690 8.115468 -0.6754036     11.39241 
1 1 1 13  15 20 o 55.33100 8.128572 38.91153       10.63371 38.91153       10.63371 0.000000       0.000000 55.33100 8.128572 ?        ?        0.000000       8.128572 
1 1 1 13  15 21 o 144.3745 6.936767 259.2402       24.33387 259.2402       24.33387 0.000000       0.000000 144.3745 6.936767 ?        ?        0.000000       6.936767 
1 1 1 13  15 22 o 75.61594 5.080201 70.77782       9.306855 67.89388       12.59576 74.24556       13.81192 73.49747 7.121741 76.77091 7.477443 -3.273438      10.32625 
1 1 1 13  15 23 o 74.85870 5.366244 69.64054       9.724296 67.28875       13.60576 72.09641       13.90354 72.79787 7.790505 75.42389 7.671129 -2.626015      10.93335 
1 1 1 13  15 24 o 112.4897 4.810726 156.6643       13.15696 141.1585       17.36088 177.5861       20.16614 105.9477 6.759512 118.7494 6.999803 -12.80173      9.730788 
1 1 1 13  15 25 o 37.40406 4.307710 17.50206       3.854840 14.35194       9.048251 18.20060       4.260864 32.89740 10.21684 38.06272 4.692955 -5.165321      11.24311 
1 1 1 13  15 26 o 83.02066 3.299137 84.96365       6.661270 83.88959       7.376991 89.70696       15.50271 82.37588 3.684202 83.21372 7.733490 -0.8378448     8.566225 
1 1 1 13  15 27 o 53.48917 3.556977 35.51717       4.610081 35.51634       4.989932 35.52201       12.04650 53.40131 3.860543 50.42009 10.15595 2.981228       10.86495 
1 1 1 13  15 28 o 42.54355 3.182125 22.49295       3.275136 27.36290       4.309066 15.83130       5.039784 46.75720 3.814928 34.66047 6.194149 12.09673       7.274693 
1 1 1 13  15 29 o 37.27258 3.499145 17.43960       3.141077 19.46829       4.024178 14.27637       5.024984 39.12103 4.291513 32.51313 6.568545 6.607895       7.846201 
1 1 1 13  15 30 o 12.43342 5.046462 0.9899082      2.387123 -0.6558161     3.012152 3.768799       3.914119 11.86433 5.256082 18.08053 6.695311 -6.216194      8.511968 
1 1 1 13  15 31 o 19.25471 5.226689 5.033595       2.514789 8.199870       3.229353 0.1551048      4.008519 24.47558 5.543463 14.21951 6.187833 10.25608       8.307783 
1 1 1 13  15 32 o 23.42183 5.047764 7.513511       2.796067 13.06983       3.598546 -0.9516394     4.441716 31.16949 4.899077 13.82503 6.234097 17.34445       7.928740 
1 1 1 13  15 33 o 19.96745 6.908464 5.893660       4.092268 26.72044       10.22589 1.922241       4.465427 37.11930 10.71235 15.82261 6.700181 21.29670       12.63515 
1 1 1 13  15 34 o 24.88975 5.394975 8.971394       3.177655 12.49758       4.107544 3.715504       5.014788 28.97368 6.014648 17.45375 7.224251 11.51993       9.400309 
1 1 1 13  15 35 o 29.28371 5.324687 12.53223       3.659833 17.69923       4.529102 2.809680       6.212734 34.66341 5.548813 17.01638 7.543027 17.64703       9.364112 
1 1 1 13  15 36 o 16.74208 6.085850 4.389388       3.210332 6.893701       4.265014 1.115711       4.876340 19.74080 7.034978 14.49178 6.533617 5.249022       9.600993 
1 1 1 13  15 37 o 8.053669 3.989716 -5.337610      2.936782 -4.061397      3.893969 -7.021066      4.472307 10.18477 4.950754 9.882442 4.900546 0.3023291      6.966012 
1 1 1 13  15 38 o 12.24801 5.415828 1.125144       3.183372 1.683963       4.209408 0.3785651      4.865452 13.52673 6.086910 13.16953 6.148306 0.3572054      8.651713 
1 1 1 13  15 39 o 11.30988 5.392148 -1.343908      4.120345 0.9527050      4.954729 -6.493099      7.419001 13.17721 6.169007 12.21633 6.098895 0.9608793      8.674858 
1 1 1 13  16 0  o 300.6632 4.254062 1103.535       31.16881 1130.709       49.73672 1085.962       39.99693 303.9154 6.715654 298.0700 5.506458 5.845428       8.684531 
1 1 1 13  16 1  o 39.97025 3.074021 19.60062       2.971209 18.05283       4.612842 20.69811       3.884303 38.10397 5.095379 40.99416 3.936585 -2.890194      6.438912 
1 1 1 13  16 2  o 152.3373 3.534875 283.1484       13.12250 310.8232       24.55351 272.0830       15.52584 159.2424 6.339977 149.2230 4.273966 10.01941       7.646051 
1 1 1 13  16 3  o 134.4835 3.206584 220.6229       10.50867 214.8284       17.62474 223.8193       13.08998 132.4462 5.472474 135.3540 3.972849 -2.907761      6.762507 
1 1 1 13  16 4  o 169.5386 3.184010 350.6412       13.15465 356.3668       18.80204 345.1513       18.41108 170.7540 4.522521 168.0462 4.499927 2.707733       6.379854 
1 1 1 13  16 5  o 88.80518 2.811529 96.28051       6.076722 90.93002       9.638687 99.81004       7.828519 86.15283 4.607814 90.36705 3.561926 -4.214218      5.824025 
1 1 1 13  16 6  o 217.3601 5.277493 577.7319       27.95398 0.000000       0.000000 577.7319       27.95398 ?        ?        217.3601 5.277493 0.000000       5.277493 
1 1 1 13  16 7  o 156.9701 6.897458 302.7504       26.31967 0.000000       0.000000 302.7504       26.31967 ?        ?        156.9701 6.897458 0.000000       6.897458 
1 1 1 13  16 8  o 221.0393 5.751671 598.5883       30.95498 0.000000       0.000000 598.5883       30.95498 ?        ?        221.0393 5.751671 0.000000       5.751671 
1 1 1 13  16 9  o 55.37036 4.570815 37.72919       6.112585 30.08820       9.172878 43.83241       8.198035 48.83924 7.982787 59.55832 5.718665 -10.71908      9.819777 
1 1 1 13  16 10 o 85.64965 3.915520 89.79368       8.150811 86.59266       12.67896 92.04836       10.64098 83.80540 6.253422 86.58909 5.065042 -2.783691      8.047357 
1 1 1 13  16 11 o 215.2642 4.619552 566.7387       24.23303 561.8159       40.49379 569.4854       30.24709 213.4502 7.798058 215.4843 5.765305 -2.034119      9.697858 
1 1 1 13  16 12 o 191.1942 7.417711 450.6650       34.49499 450.6650       34.49499 0.000000       0.000000 191.1942 7.417711 ?        ?        0.000000       7.417711 
1 1 1 13  16 13 o 30.30341 7.875372 11.74765       5.868144 9.887751       7.780524 14.20137       8.936705 28.85761 9.527640 33.61246 10.09922 -4.754848      13.88417 
1 1 1 13  16 14 f 244.3037 6.075962 733.0530       36.17272 747.0570       51.10920 718.9976       51.20282 245.5270 8.555155 240.7777 8.741035 4.749298       12.23096 
1 1 1 13  16 15 o 261.0097 6.356991 837.9075       40.43378 872.8911       57.93285 804.6805       56.45961 265.0284 8.983063 254.3730 9.122936 10.65544       12.80326 
1 1 1 13  16 16 o 135.7734 4.743127 226.1489       15.66924 229.0676       21.80935 223.0349       22.52740 136.2204 6.589534 134.3250 6.905233 1.895416       9.544852 
1 1 1 13  16 17 o 80.94736 4.939368 80.66566       9.697008 97.58340       13.92372 64.73176       13.51279 88.75319 6.482468 71.87971 7.841422 16.87347       10.17400 
1 1 1 13  16 18 o 112.4703 6.463572 156.5686       17.64061 156.5686       17.64061 0.000000       0.000000 112.4703 6.463572 ?        ?        0.000000       6.463572 
1 1 1 13  16 19 o 107.4054 6.501688 143.0653       16.93752 143.0653       16.93752 0.000000       0.000000 107.4054 6.501688 ?        ?        0.000000       6.501688 
1 1 1 13  16 20 o 32.91007 8.185774 14.04492       6.537652 12.81178       8.341582 16.00853       10.52616 31.80206 9.798436 35.42684 11.02246 -3.624781      14.74802 
1 1 1 13  16 21 o 153.9418 5.034722 292.1567       18.86182 270.9148       25.30157 318.7291       28.29862 147.4000 7.064473 159.7902 7.286575 -12.39017      10.14894 
1 1 1 13  16 22 f 33.63451 8.310996 14.79715       6.772045 6.007729       8.936721 26.65114       10.37840 25.88665 9.994504 44.93430 9.758088 -19.04765      13.96819 
1 1 1 13  16 23 o 30.69051 8.389683 12.33424       6.452898 9.469755       8.662578 15.90537       9.672226 28.46618 10.03741 34.76234 10.52023 -6.296154      14.54046 
1 1 1 13  16 24 o 32.37572 8.197472 13.86740       6.472860 13.48102       8.583426 14.37683       9.855951 32.05116 9.950449 33.17609 10.70863 -1.124939      14.61801 
1 1 1 13  16 25 o 32.00657 8.122316 13.67155       6.344606 11.47512       8.153325 17.04326       10.10185 29.74650 9.749860 35.34475 10.76270 -5.598251      14.52224 
1 1 1 13  16 26 o 13.00634 5.284183 0.9300904      2.620317 3.436134       7.496369 0.5812797      2.796736 21.98688 8.935889 12.92586 5.376450 9.061020       10.42863 
1 1 1 13  16 27 o 68.06738 3.405469 57.43946       5.630805 56.28187       6.171170 63.19455       13.75996 67.24213 3.781318 68.56685 8.411037 -1.324715      9.221926 
1 1 1 13  16 28 o 41.32478 4.437880 21.69484       4.399181 21.35027       4.881917 23.18322       10.14630 40.76365 5.020465 39.54147 10.39467 1.222179       11.54358 
1 1 1 13  16 29 o 33.64657 3.670027 14.32277       2.960439 18.93856       3.895957 8.015966       4.554035 38.53162 4.218008 24.11012 7.201324 14.42150       8.345696 
1 1 1 13  16 30 o 14.68104 5.316048 2.463208       2.446386 2.271802       3.249774 2.713530       3.716416 15.39868 6.004261 16.49751 6.424257 -1.098832      8.793305 
1 1 1 13  16 31 o 25.55293 4.538388 8.679065       2.722515 11.35417       3.572764 4.974650       4.204303 28.93644 5.260389 19.39629 6.976228 9.540146       8.737245 
1 1 1 13  16 32 o 18.67317 5.586263 4.900976       2.738739 6.340592       3.495445 2.612002       4.407574 20.89112 6.324732 16.58412 6.809159 4.307001       9.293379 
1 1 1 13  16 33 o 18.14440 5.698961 4.756100       2.806962 6.436601       3.612301 2.194875       4.459524 20.61482 6.463611 15.88560 6.709793 4.729219       9.316629 
1 1 1 13  16 34 o 11.20761 5.406221 -4.663735      4.421344 7.478805       10.16329 -7.498149      4.910337 21.20906 9.507875 10.81935 5.321680 10.38971       10.89587 
1 1 1 13  16 35 o 17.87941 5.863509 4.945038       2.948678 6.784152       4.012738 2.786302       4.347467 20.10486 6.844830 15.64543 6.617465 4.459426       9.520638 
1 1 1 13  16 36 o 12.76036 5.420881 1.448605       2.938958 2.342461       3.875028 0.2381618      4.509345 14.48571 6.191392 13.42187 6.141346 1.063840       8.720634 
1 1 1 13  16 37 o 17.16771 6.039909 5.101251       3.135344 3.766894       4.225638 6.735669       4.676682 15.48534 6.535624 18.34137 7.187873 -2.856030      9.714931 
1 1 1 13  16 38 o 14.14788 5.866539 3.048961       3.315280 2.382851       4.526481 3.819788       4.869293 14.07746 6.325263 15.21777 6.714929 -1.140310      9.224923 
1 1 1 13  17 0  o 71.23653 3.036021 62.00826       5.258315 57.24226       9.208870 64.31396       6.405188 68.19505 5.590402 72.50739 3.636656 -4.312332      6.669172 
1 1 1 13  17 1  o 154.2213 3.109149 290.1223       11.68482 284.3790       22.36248 292.2793       13.70448 152.3333 6.036005 154.7618 3.633813 -2.428558      7.045421 
1 1 1 13  17 2  o 132.0928 2.917238 212.8163       9.390469 203.1356       17.64714 216.6403       11.09111 128.7533 5.638117 133.2054 3.419609 -4.452087      6.594095 
1 1 1 13  17 3  o 320.8362 5.006424 1258.086       39.14236 1226.943       75.73262 1269.438       45.72298 315.2956 9.868795 322.1052 5.825065 -6.809570      11.45969 
1 1 1 13  17 4  o 33.87000 3.086119 14.11053       2.519258 16.91132       4.798077 13.04452       2.960114 36.78002 5.523782 32.46764 3.813936 4.312378       6.712546 
1 1 1 13  17 5  o 176.0121 2.955192 377.9231       12.67548 360.8346       19.14959 391.2486       16.91022 171.7845 4.578535 179.0123 3.876415 -7.227753      5.999131 
1 1 1 13  17 6  o 133.4168 2.602786 217.0932       8.462238 207.6099       12.60724 224.8691       11.41606 130.3265 3.974283 135.6916 3.455258 -5.365082      5.266283 
1 1 1 13  17 7  o 300.5583 5.668854 1105.972       41.52027 1078.327       69.96261 1121.003       51.58689 295.2518 9.737148 302.2135 7.004697 -6.961731      11.99491 
1 1 1 13  17 8  o 207.6883 4.533119 527.2689       22.94274 508.5126       37.67769 538.3216       28.92316 203.2248 7.621520 209.5883 5.668153 -6.363434      9.498185 
1 1 1 13  17 9  o 161.3265 4.061125 318.1899       15.95302 375.0417       28.61163 292.5418       19.21752 174.6553 6.735030 154.5293 5.110319 20.12592       8.454348 
1 1 1 13  17 10 o 39.94284 5.870764 19.96776       5.544020 13.22645       8.206429 25.62758       7.519400 32.45912 9.660232 45.13587 7.068164 -12.67675      11.96992 
1 1 1 13  17 11 o 202.6703 4.498812 502.3940       22.21898 518.1721       37.79530 494.0614       27.46642 204.9761 7.579615 200.6908 5.621686 4.285309       9.436838 
1 1 1 13  17 12 o 230.9547 5.863064 654.8269       32.97132 671.6499       46.71593 638.1293       46.54153 233.0582 8.238499 227.0847 8.425008 5.973541       11.78362 
1 1 1 13  17 13 f 204.7817 7.748128 518.3046       38.59579 518.3046       38.59579 0.000000       0.000000 204.7817 7.748128 ?        ?        0.000000       7.748128 
1 1 1 13  17 14 o 213.4525 5.630000 559.5975       29.25947 598.9617       42.28351 523.4297       40.53041 219.9977 7.899916 205.5558 8.107142 14.44191       11.31965 
1 1 1 13  17 15 o 118.1928 4.675606 171.3951       13.44024 203.0479       19.77946 144.2435       18.31918 128.3009 6.345973 107.9323 7.002764 20.36868       9.450401 
1 1 1 13  17 16 o 178.9262 7.263961 396.2705       31.60674 396.2705       31.60674 0.000000       0.000000 178.9262 7.263961 ?        ?        0.000000       7.263961 
1 1 1 13  17 17 o 48.14350 8.939975 29.77340       10.10239 29.77340       10.10239 0.000000       0.000000 48.14350 8.939975 ?        ?        0.000000       8.939975 
1 1 1 13  17 18 o 115.2217 4.789225 163.2599       13.41800 161.8775       18.57826 164.7675       19.40027 114.2315 6.703413 115.1755 6.944385 -0.9439621     9.651955 
1 1 1 13  17 19 o 54.66974 5.936883 37.29536       7.782524 32.76578       10.47851 42.86793       11.62247 50.47194 8.841536 58.00703 8.471996 -7.535095      12.24530 
1 1 1 13  17 20 o 88.80341 4.957273 97.34224       10.68517 85.88665       14.27446 111.9416       16.11454 82.81228 7.143160 94.65384 7.036574 -11.84156      10.02687 
1 1 1 13  17 21 o 158.7915 5.123798 311.3541       19.80097 336.0798       28.27683 287.5641       27.73659 163.9979 7.092253 151.4301 7.540025 12.56773       10.35143 
1 1 1 13  17 22 o 18.33058 7.839634 0.1017050      6.219855 -0.5478200     8.421039 0.8814140      9.226437 20.78415 9.007139 22.57631 9.598397 -1.792160      13.16274 
1 1 1 13  17 23 o 56.29507 5.845824 39.87096       7.902964 39.91112       10.61953 39.82112       11.83138 55.55390 8.081061 55.06714 9.136802 0.4867592      12.19773 
1 1 1 13  17 24 o 14.52287 6.741341 -4.598233      5.718533 -3.670795      7.523697 -5.866983      8.799885 17.70752 8.036416 18.34568 8.461771 -0.6381645     11.66986 
1 1 1 13  17 25 o 23.00554 8.418537 5.901498       6.157837 7.493892       8.025887 3.622582       9.601341 25.82469 9.582861 24.17629 10.00046 1.648403       13.85065 
1 1 1 13  17 26 o 20.67896 8.204349 3.618049       6.160333 9.090723       8.392615 -2.774996      9.070921 27.17624 9.845543 19.80348 8.921289 7.372763       13.28624 
1 1 1 13  17 27 f 53.18524 4.055827 35.49701       5.216976 0.000000       0.000000 35.49701       5.216976 ?        ?        53.18524 4.055827 0.000000       4.055827 
1 1 1 13  17 28 o 24.03833 4.605144 7.534467       2.599458 11.08438       3.605977 3.693952       3.750670 29.03205 5.291848 17.99456 6.572491 11.03750       8.438086 
1 1 1 13  17 29 o 13.28851 5.148407 1.606709       2.377493 6.222259       3.329125 -3.197418      3.396453 21.37869 6.094182 10.74205 5.053792 10.63664       7.917062 
1 1 1 13  17 30 o 11.16914 4.734521 0.3246347      2.233533 -0.6120713     3.015276 1.463477       3.324737 11.80521 5.242776 14.44637 5.920701 -2.641157      7.908312 
1 1 1 13  17 31 o 28.27621 5.146742 10.89994       3.415806 12.60506       3.789571 3.512629       7.887797 30.35206 5.317167 20.25499 8.747498 10.09707       10.23675 
1 1 1 13  17 32 o 14.50670 5.551277 2.401028       2.740068 3.021077       3.318149 1.071748       4.858371 15.88470 6.101205 15.55302 6.789472 0.3316774      9.128069 
1 1 1 13  17 33 o 11.69448 4.985433 0.6150821      2.500890 0.3679408      3.248388 0.9747577      3.918778 12.65222 5.536785 14.10292 6.127834 -1.450698      8.258713 
1 1 1 13  17 34 o 10.05932 4.644198 -1.278581      2.659920 5.169247       3.642379 -8.646369      3.893560 18.26108 6.501909 8.817940 4.404737 9.443136       7.853441 
1 1 1 13  17 35 o 12.88643 5.830492 0.9968885E-01  3.923746 10.91410       9.514627 -2.116353      4.307043 21.31751 9.397312 11.97900 5.652707 9.338515       10.96643 
1 1 1 13  17 36 o 14.39482 5.660401 2.946093       2.908656 -0.1550852     3.913944 6.771443       4.346972 12.39420 5.689880 18.99285 7.051593 -6.598655      9.060888 
1 1 1 13  17 37 o 13.90584 5.741961 2.720676       3.157699 5.272127       4.281779 -0.3215299     4.675467 16.75774 6.774239 12.72013 5.967065 4.037605       9.027523 
1 1 1 13  17 38 o 8.642496 4.230510 -3.745082      2.988226 -3.182438      4.182038 -4.332016      4.271356 10.58232 5.140920 10.22526 5.016133 0.3570595      7.182663 
1 1 1 13  18 0  f 152.3547 2.806398 283.1010       10.41937 271.6423       15.91252 291.7013       13.78568 149.0708 4.385132 154.5988 3.659199 -5.527985      5.711315 
1 1 1 13  18 1  o 89.40741 2.503569 97.55261       5.449309 109.1606       8.727391 90.13536       6.976351 94.48942 3.797965 85.88355 3.339726 8.605865       5.057500 
1 1 1 13  18 2  o 120.7744 2.585260 177.8845       7.608786 181.2532       11.90587 175.5587       9.892570 121.7712 4.017683 119.8968 3.389233 1.874359       5.256299 
1 1 1 13  18 3  o 56.39354 2.974574 38.90371       4.073349 32.38594       8.150451 41.07364       4.702777 50.96619 6.726463 57.91979 3.346139 -6.953598      7.512786 
1 1 1 13  18 4  f 139.3142 2.689255 236.7237       9.129847 218.6771       13.65663 251.3071       12.27647 133.7352 4.195649 143.4895 3.510891 -9.754333      5.470816 
1 1 1 13  18 5  o 69.42560 2.574692 58.86612       4.348385 65.16403       7.608528 55.81122       5.299085 72.90556 4.301682 67.55085 3.228441 5.354706       5.378410 
1 1 1 13  18 6  o 270.6294 3.932660 894.5195       25.93567 902.3372       40.62008 889.1389       33.69901 271.3452 6.143027 269.5895 5.129535 1.755707       8.003057 
1 1 1 13  18 7  o 30.07658 6.802518 11.54215       4.868634 13.76812       7.058533 9.522042       6.724204 32.83252 8.688349 27.96474 8.825645 4.867779       12.38464 
1 1 1 13  18 8  o 87.14749 3.895184 92.96132       8.251256 97.34695       13.01867 90.01674       10.66749 88.90442 6.045024 85.60732 5.137097 3.297096       7.932974 
1 1 1 13  18 9  o 138.2389 3.916148 233.6756       13.17916 242.8897       21.77362 228.3481       16.55649 140.5331 6.374529 136.5016 4.985681 4.031464       8.092690 
1 1 1 13  18 10 o 92.32780 3.910997 104.3548       8.779531 91.74335       13.62815 113.3021       11.47891 86.17939 6.538075 96.08438 4.918804 -9.904991      8.181752 
1 1 1 13  18 11 o 82.39874 4.156091 83.22639       8.318349 83.32790       12.86496 83.15345       10.90447 82.09824 6.482988 82.18159 5.476197 -0.8334351E-01 8.486334 
1 1 1 13  18 12 o 178.9452 5.172875 392.7481       22.53367 385.4933       31.10463 400.7610       32.68924 176.7271 7.237788 180.1257 7.463369 -3.398636      10.39651 
1 1 1 13  18 13 o 225.3396 8.189740 629.0699       44.89735 629.0699       44.89735 0.000000       0.000000 225.3396 8.189740 ?        ?        0.000000       8.189740 
1 1 1 13  18 14 o 31.92578 9.858821 12.72574       8.439014 12.72574       8.439014 0.000000       0.000000 31.92578 9.858821 ?        ?        0.000000       9.858821 
1 1 1 13  18 15 o 50.80934 8.798451 32.96930       10.49959 32.96930       10.49959 0.000000       0.000000 50.80934 8.798451 ?        ?        0.000000       8.798451 
1 1 1 13  18 16 o 25.18809 8.394343 7.493549       6.035985 6.807510       8.018291 8.390701       9.169388 26.01137 9.591666 28.26611 10.28376 -2.254742      14.06256 
1 1 1 13  18 17 o 239.6141 6.096225 708.4707       35.56777 749.1486       51.31931 670.8702       49.33991 244.8801 8.613267 231.6216 8.757217 13.25856       12.28321 
1 1 1 13  18 18 o 152.2612 4.964602 285.2425       18.39623 267.8326       24.98949 305.8397       27.18083 146.8307 7.004199 156.8709 7.128870 -10.04022      9.993978 
1 1 1 13  18 19 o 117.6678 4.801167 170.5223       13.73813 169.8886       19.24126 171.1813       19.62161 116.8299 6.787621 117.2345 6.898698 -0.4045334     9.678007 
1 1 1 13  18 20 f 180.8351 5.402184 404.1325       23.77941 365.6868       30.97097 459.3455       37.11512 170.9243 7.453498 191.2332 7.981919 -20.30890      10.92088 
1 1 1 13  18 21 o 88.79989 4.953215 97.61719       10.67607 89.92768       14.32561 107.2225       16.01107 84.54732 7.016212 92.30286 7.174486 -7.755539      10.03496 
1 1 1 13  18 22 o 24.86958 8.635794 7.248865       6.397074 3.020772       8.378949 13.15731       9.904987 22.98664 9.407519 32.23170 10.75351 -9.245060      14.28774 
1 1 1 13  18 23 o 18.43674 7.708650 1.164667       5.793304 0.2204581      7.341364 2.723192       9.431911 19.77239 8.487904 23.71371 9.869342 -3.941313      13.01724 
1 1 1 13  18 24 f 38.98001 7.590773 20.06884       6.951073 20.15071       9.034077 19.95004       10.88259 38.33423 9.672489 37.81755 11.09084 0.5166817      14.71611 
1 1 1 13  18 25 o 57.52881 9.217036 44.91769       12.48538 0.000000       0.000000 44.91769       12.48538 ?        ?        57.52881 9.217036 0.000000       9.217036 
1 1 1 13  18 26 f 24.62414 8.575406 7.688194       6.310227 3.845822       8.409055 12.64071       9.546857 22.82879 9.392569 30.40359 10.55017 -7.574802      14.12538 
1 1 1 13  18 27 o 23.39496 8.479589 6.804155       6.226355 -0.3496001     8.110029 17.07382       9.717029 19.61145 8.659307 33.84087 10.59971 -14.22942      13.68713 
1 1 1 13  18 28 o 34.74082 8.012249 17.20946       6.644706 24.61521       9.315557 9.538842       9.480685 40.56383 9.578254 26.76337 10.30441 13.80046       14.06854 
1 1 1 13  18 29 o 61.95015 3.543613 48.44003       5.327326 46.57626       5.921294 56.35681       12.20379 60.42838 4.044335 62.45815 8.217196 -2.029778      9.158545 
1 1 1 13  18 30 o 16.33315 5.345080 3.511509       2.450877 6.178580       3.572645 1.140552       3.368484 20.92059 6.406409 14.06923 5.879961 6.851364       8.695746 
1 1 1 13  18 31 o 17.29264 5.587646 4.123588       2.682968 7.230460       3.443847 -0.6737896     4.279413 22.30220 6.141998 13.64712 6.139521 8.655085       8.684345 
1 1 1 13  18 32 o 12.65209 5.232512 1.190883       2.627841 4.930167       3.453471 -3.951972      4.050081 18.39657 6.347262 11.10659 5.309155 7.289979       8.274954 
1 1 1 13  18 33 o 18.10219 5.728192 4.867193       2.830879 8.002088       3.957036 1.580719       4.051573 22.38156 6.719199 14.66931 6.301537 7.712250       9.211785 
1 1 1 13  18 34 o 13.71857 5.498761 2.143718       2.795445 5.209428       3.777476 -1.567781      4.156339 18.11573 6.599128 12.23685 5.702819 5.878884       8.721848 
1 1 1 13  18 35 o 11.92263 5.176735 0.8036504      2.792540 -3.985680      3.740945 6.831120       4.196734 10.12298 4.904727 19.49405 6.974931 -9.371069      8.526781 
1 1 1 13  18 36 o 11.17843 5.285318 -1.670434      3.799818 2.655313       8.143361 -2.874424      4.296200 16.09754 7.647939 11.18635 5.378980 4.911189       9.350101 
1 1 1 13  18 37 o 15.07089 5.833594 3.792272       3.050328 4.733607       4.133023 2.666100       4.520619 16.05479 6.592951 14.35868 6.395534 1.696107       9.185307 
1 1 1 13  19 0  o 165.5232 3.252501 334.3134       13.11935 315.1249       24.74414 341.8168       15.47326 160.2531 6.348777 167.3266 3.794729 -7.073471      7.396414 
1 1 1 13  19 1  o 142.5124 2.739296 247.7245       9.513222 253.3209       14.90417 243.8768       12.35814 143.9439 4.253585 141.3024 3.591864 2.641510       5.567268 
1 1 1 13  19 2  o 145.5869 2.765973 258.5415       9.813098 271.8612       15.51672 249.6634       12.66819 149.1150 4.274556 142.9616 3.639254 6.153351       5.613911 
1 1 1 13  19 3  o 87.86451 2.902862 94.28646       6.206967 91.87495       12.48068 95.07891       7.154480 86.40441 5.964016 88.20058 3.334674 -1.796173      6.832974 
1 1 1 13  19 4  o 69.36734 2.500819 58.76203       4.220482 57.61654       6.457156 59.61639       5.576534 68.57710 3.879727 69.81367 3.287071 -1.236565      5.084989 
1 1 1 13  19 5  o 71.69605 2.428239 62.76342       4.236386 59.15795       6.330418 65.68775       5.701176 69.49975 3.751681 73.29411 3.199683 -3.794357      4.930830 
1 1 1 13  19 6  o 112.2022 2.735086 153.5875       7.478399 163.6753       13.25720 148.8792       9.056979 115.5900 4.716374 110.3819 3.371000 5.208122       5.797226 
1 1 1 13  19 7  o 97.28609 3.852405 115.8020       9.115054 108.9076       14.20942 120.6228       11.88186 94.01819 6.237217 99.16403 4.932413 -5.145844      7.951829 
1 1 1 13  19 8  o 161.6375 4.062697 319.5138       15.98999 324.2739       26.67847 316.8452       19.97550 162.3134 6.759619 160.7896 5.104510 1.523758       8.470447 
1 1 1 13  19 9  o 155.7904 4.059870 296.8751       15.39993 315.4539       25.87360 286.6825       19.16418 160.0803 6.647047 152.9096 5.150387 7.170746       8.408907 
1 1 1 13  19 10 o 120.2508 4.734547 177.2786       13.84691 171.4860       18.10557 185.4406       21.49197 117.9823 6.320438 122.4988 7.231774 -4.516510      9.604504 
1 1 1 13  19 11 o 88.31738 5.094429 95.89111       10.91770 114.8528       14.49369 71.01885       16.59960 96.48917 6.196781 75.10701 9.265678 21.38216       11.14688 
1 1 1 13  19 12 o 117.9120 6.518846 171.5805       18.65828 171.5805       18.65828 0.000000       0.000000 117.9120 6.518846 ?        ?        0.000000       6.518846 
1 1 1 13  19 13 o 48.03586 6.382385 28.88217       7.286401 37.07095       10.36936 20.89503       10.24089 54.14978 8.107171 40.12976 10.39101 14.02002       13.17950 
1 1 1 13  19 14 o 214.0804 5.663310 563.6176       29.51901 528.8063       39.84996 605.9446       43.94170 206.4411 7.936065 220.8838 8.177629 -14.44267      11.39538 
1 1 1 13  19 15 o 81.72812 6.954824 83.10822       13.71995 83.10822       13.71995 0.000000       0.000000 81.72812 6.954824 ?        ?        0.000000       6.954824 
1 1 1 13  19 16 o 55.72163 5.758042 38.63034       7.706205 43.15324       10.88897 34.09204       10.90750 58.44333 7.843510 51.52854 9.014567 6.914791       11.94919 
1 1 1 13  19 17 o 57.07791 5.860016 40.57901       8.035219 33.04240       10.47316 51.36305       12.52795 50.72192 8.791608 63.67448 8.268921 -12.95256      12.06928 
1 1 1 13  19 18 o 91.12287 4.875496 102.3995       10.78694 99.49059       14.61986 105.8752       15.98091 89.32081 6.767026 92.02636 7.182984 -2.705551      9.868530 
1 1 1 13  19 19 o 66.62578 5.382332 55.13425       8.664413 49.29774       11.49879 62.80107       13.17901 62.33600 7.735569 70.43680 7.809027 -8.100796      10.99181 
1 1 1 13  19 20 o 56.93117 6.161681 40.70499       8.412330 29.15412       10.42297 62.28937       14.24800 47.10506 9.409528 69.72928 8.564679 -22.62421      12.72372 
1 1 1 13  19 21 o 151.5247 5.087829 284.4465       18.76012 281.9142       25.71794 287.3264       27.42600 149.7057 7.069528 150.8551 7.483840 -1.149384      10.29495 
1 1 1 13  19 22 o 117.8118 4.867950 172.2903       13.94551 161.7431       18.64471 185.6837       21.01041 113.1593 6.792553 121.0395 7.155056 -7.880203      9.865779 
1 1 1 13  19 23 f 38.78559 10.82821 20.88427       10.62371 0.000000       0.000000 20.88427       10.62371 ?        ?        38.78559 10.82821 0.000000       10.82821 
1 1 1 13  19 24 o 33.44176 10.84068 15.37808       10.09391 0.000000       0.000000 15.37808       10.09391 ?        ?        33.44176 10.84068 0.000000       10.84068 
1 1 1 13  19 25 o 23.32857 8.412786 6.488059       6.118868 9.266882       8.416452 3.372707       8.911528 27.20859 9.859199 23.03862 9.591192 4.169971       13.75481 
1 1 1 13  19 26 o 46.98475 6.407761 29.06874       7.145688 30.65495       9.273578 26.75058       11.21089 47.09288 8.388417 42.29919 10.83049 4.793686       13.69909 
1 1 1 13  19 27 o 16.92608 7.348431 0.2907777      5.625780 -1.342549      7.404729 2.520823       8.652257 18.08556 8.111000 21.59942 9.242211 -3.513861      12.29662 
1 1 1 13  19 28 o 26.70324 8.407148 10.40447       6.105096 3.438528       8.082905 19.65698       9.315522 21.30787 9.018303 35.18388 10.24534 -13.87601      13.64906 
1 1 1 13  19 29 o 24.31614 9.541326 8.295532       8.249297 8.295532       8.249297 0.000000       0.000000 24.31614 9.541326 ?        ?        0.000000       9.541326 
1 1 1 13  19 30 o 9.460541 3.950414 0.3588059      1.518481 0.8069875      3.152396 0.2233978      1.732751 13.27789 5.626398 9.797597 4.162310 3.480289       6.998655 
1 1 1 13  19 31 o 25.16557 4.771043 8.718525       2.818832 12.89627       4.139495 5.106226       3.849179 29.91895 5.887368 18.84805 6.686690 11.07089       8.909148 
1 1 1 13  19 32 o 14.06335 5.332892 2.384294       2.514262 3.202474       3.502848 1.514798       3.611025 15.97468 6.232286 14.22839 6.025146 1.746288       8.668551 
1 1 1 13  19 33 o 14.78293 5.561676 2.884459       2.722265 6.573587       3.933343 -0.5072975     3.771485 20.10874 6.777309 12.50868 5.682053 7.600064       8.844074 
1 1 1 13  19 34 o 17.99113 5.872677 5.123871       2.959480 9.713131       4.278460 0.9134998      4.098041 23.64558 6.959393 13.69063 6.094167 9.954948       9.250515 
1 1 1 13  19 35 o 13.27450 5.472165 2.069447       2.861559 0.8506040      4.050799 3.283555       4.042923 13.25323 5.966857 15.28820 6.419086 -2.034967      8.764020 
1 1 1 13  19 36 o 12.81598 5.511735 1.697087       3.106364 7.560145       4.412162 -4.065536      4.374207 19.28526 7.114425 10.67420 5.201801 8.611055       8.813273 
1 1 1 13  19 37 o 9.903646 4.862624 -4.515980      4.041638 0.000000       0.000000 -4.515980      4.041638 ?        ?        9.903646 4.862624 0.000000       4.862624 
1 1 1 13  20 0  o 162.4570 3.332781 322.1112       13.19414 311.7768       17.63195 335.2623       19.89015 159.6526 4.536582 165.5030 4.937212 -5.850403      6.704971 
1 1 1 13  20 1  o 114.6782 2.616410 160.4079       7.311776 156.8747       11.14292 163.0796       9.689565 113.2537 4.043970 115.5335 3.445448 -2.279785      5.312702 
1 1 1 13  20 2  o 216.2219 3.384964 570.6855       17.83569 553.7974       27.38300 583.1296       23.50560 212.7209 5.282443 218.4271 4.415997 -5.706253      6.885146 
1 1 1 13  20 3  o 151.6560 2.810799 280.5988       10.38785 261.8059       15.54154 295.7739       13.96575 146.2921 4.364384 155.6311 3.682407 -9.338989      5.710339 
1 1 1 13  20 4  o 130.8840 3.055945 209.0569       9.746943 236.6874       20.67892 201.1649       11.05161 138.8023 6.128680 128.3070 3.537967 10.49535       7.076576 
1 1 1 13  20 5  o 26.50145 3.613689 8.734616       2.273028 7.745656       3.600950 9.389678       2.930686 24.64841 6.042486 27.34775 4.557892 -2.699341      7.568753 
1 1 1 13  20 6  o 29.57937 4.443988 10.93489       3.104364 11.26765       3.255997 7.609781       10.29243 30.01033 4.598541 28.68334 10.80934 1.326986       11.74685 
1 1 1 13  20 7  o 198.7809 3.517066 482.5936       17.03692 477.8548       35.63559 483.9976       19.39734 196.8604 7.441700 199.0009 3.999917 -2.140549      8.448565 
1 1 1 13  20 8  o 108.8030 4.842377 145.2046       12.80696 159.0506       16.87247 126.3835       19.67158 113.6643 6.113920 100.8766 8.069501 12.78773       10.12407 
1 1 1 13  20 9  o 35.61380 8.186321 16.28677       6.955716 12.93357       8.205437 24.84921       13.11206 32.11077 9.683722 43.78551 11.95511 -11.67474      15.38503 
1 1 1 13  20 10 o 90.18129 3.953202 99.62598       8.666527 86.45310       12.98404 110.2104       11.63867 83.61131 6.421638 94.70327 5.061543 -11.09196      8.176591 
1 1 1 13  20 11 o 131.8054 3.992176 212.6660       12.80791 216.8132       20.75097 210.1138       16.27867 132.5949 6.441349 130.8159 5.116354 1.779037       8.226060 
1 1 1 13  20 12 o 46.12751 5.889297 26.56509       6.469243 23.73536       8.530707 30.39496       9.924430 43.03933 8.435347 48.79510 8.663624 -5.755772      12.09188 
1 1 1 13  20 13 o 104.7038 4.708183 134.6505       11.98228 122.9964       16.13544 148.9790       17.89127 99.65077 6.683165 109.7029 6.724796 -10.05209      9.480906 
1 1 1 13  20 14 o 98.61845 4.870290 119.6178       11.66819 106.0062       15.53415 137.2397       17.67499 92.36548 6.952507 105.1643 6.935633 -12.79881      9.820405 
1 1 1 13  20 15 o 144.3495 4.916911 256.1604       17.27067 237.5613       23.28094 278.9223       25.75483 138.3968 6.925009 149.9337 7.068837 -11.53685      9.895666 
1 1 1 13  20 16 o 28.63292 10.07057 9.265995       8.715833 9.265995       8.715833 0.000000       0.000000 28.63292 10.07057 ?        ?        0.000000       10.07057 
1 1 1 13  20 17 o 39.75546 7.296898 20.24219       6.808784 18.82410       9.472577 21.75802       9.793591 37.88387 10.08350 40.69135 9.958762 -2.807480      14.17229 
1 1 1 13  20 18 o 42.86862 7.167289 23.47864       7.223262 23.95862       9.724604 22.88790       10.78850 42.68911 9.583496 41.52866 10.61991 1.160450       14.30475 
1 1 1 13  20 19 o 17.80786 7.615596 0.4785296E-01  5.868767 4.842609       8.122600 -5.189099      8.488893 24.21774 9.478114 18.44488 8.434598 5.772861       12.68767 
1 1 1 13  20 20 o 17.00834 7.364601 -0.4739811     5.620144 -5.228409      7.873166 4.465818       8.025182 17.53628 8.057647 23.73784 9.381203 -6.201555      12.36659 
1 1 1 13  20 21 o 88.23063 7.610041 99.35905       16.20247 0.000000       0.000000 99.35905       16.20247 ?        ?        88.23063 7.610041 0.000000       7.610041 
1 1 1 13  20 22 o 81.90609 7.563612 86.33616       14.92624 0.000000       0.000000 86.33616       14.92624 ?        ?        81.90609 7.563612 0.000000       7.563612 
1 1 1 13  20 23 o 77.70784 5.053879 75.79346       9.518387 80.82619       13.10494 70.17399       13.84782 79.31007 6.847643 73.25330 7.881277 6.056770       10.44053 
1 1 1 13  20 24 o 20.77020 7.943876 4.328936       5.609022 0.1276972      7.324478 10.28632       8.721997 19.34279 8.391292 28.31008 10.06328 -8.967293      13.10280 
1 1 1 13  20 25 o 57.23070 5.799613 42.30410       7.976886 40.34636       10.79924 44.65484       11.83362 54.24353 8.444505 56.82774 8.831868 -2.584202      12.21931 
1 1 1 13  20 26 o 21.53606 8.013646 5.471623       5.619902 3.410986       7.310369 8.449075       8.787410 21.11774 8.729874 25.98277 9.941669 -4.865034      13.23055 
1 1 1 13  20 27 o 19.54721 7.717686 3.884182       5.426689 2.759106       7.408911 5.186400       7.970858 20.41649 8.637256 22.57930 9.200289 -2.162813      12.61933 
1 1 1 13  20 28 o 45.33698 9.220700 31.53630       9.839863 31.53630       9.839863 0.000000       0.000000 45.33698 9.220700 ?        ?        0.000000       9.220700 
1 1 1 13  20 29 o 12.75560 6.104540 -5.558802      5.388318 -1.605522      7.263047 -10.39816      8.035893 16.93965 7.767079 14.40885 7.028125 2.530802       10.47483 
1 1 1 13  20 30 o 19.33932 7.916343 4.551471       5.934624 6.943058       8.566618 2.344571       8.229199 22.16657 9.327748 19.28582 8.606989 2.880749       12.69201 
1 1 1 13  20 31 o 25.21345 3.366512 8.306050       2.016824 14.33645       3.757107 5.864921       2.390429 32.12558 4.958598 20.39198 4.876354 11.73360       6.954605 
1 1 1 13  20 32 o 14.21210 4.681307 2.767412       1.878710 7.400270       3.709903 1.169582       2.178730 21.63513 6.508458 11.78759 4.807418 9.847534       8.091434 
1 1 1 13  20 33 o 32.57429 5.218780 15.52676       4.002851 13.29974       4.480467 24.33359       8.909855 28.71759 6.548118 32.82308 10.12911 -4.105484      12.06137 
1 1 1 13  20 34 o 28.67810 4.743159 11.99625       3.199003 16.52830       4.691058 8.056588       4.373738 31.92958 6.252782 20.90659 7.145485 11.02299       9.495011 
1 1 1 13  20 35 o 6.662856 3.360891 -7.103836      2.560943 -5.569958      3.983501 -8.184393      3.343439 9.652164 4.756417 7.777825 3.912577 1.874339       6.158877 
1 1 1 13  20 36 o 10.57269 4.843034 -0.2951643     2.814641 -0.8141033     3.944370 0.2432355      4.017649 11.64654 5.468913 12.37136 5.710229 -0.7248135     7.906689 
1 1 1 13  21 0  o 73.69756 2.916744 66.37392       5.227920 72.72944       7.397411 60.03219       7.389385 77.05983 3.952473 69.94859 4.356670 7.111237       5.882399 
1 1 1 13  21 1  o 183.4322 3.420055 410.7841       15.28779 395.5422       21.11151 427.5891       22.16752 179.7579 4.823783 186.8946 4.871409 -7.136719      6.855619 
1 1 1 13  21 2  o 127.4804 3.245728 198.5020       10.07484 194.0826       12.64198 206.1941       16.67843 125.9565 4.124243 129.6670 5.289348 -3.710510      6.707204 
1 1 1 13  21 3  o 64.35559 2.859791 50.63655       4.473739 44.35488       6.126609 57.81215       6.548041 60.09395 4.210268 68.67627 3.929024 -8.582317      5.758784 
1 1 1 13  21 4  o 168.3853 3.812997 346.3979       15.64612 343.8288       27.55815 347.6200       19.00643 167.1443 6.779924 168.5121 4.632822 -1.367828      8.211602 
1 1 1 13  21 5  o 198.2406 3.690913 480.0923       17.83046 490.7697       24.23251 467.4863       26.33003 200.2215 4.966514 195.2249 5.540123 4.996552       7.440377 
1 1 1 13  21 6  o 30.83306 3.263386 11.73711       2.414831 8.348326       3.515403 14.76491       3.322896 25.58956 5.774938 34.52359 4.025128 -8.934023      7.039287 
1 1 1 13  21 7  o 224.9197 3.131525 617.6566       17.16404 603.2469       28.82711 625.5708       21.36372 221.8515 5.332152 226.2336 3.875107 -4.382050      6.591533 
1 1 1 13  21 8  o 144.2780 4.016668 254.7185       14.10845 249.7835       22.79183 257.7842       17.96384 142.3602 6.587696 144.9573 5.093290 -2.597107      8.327024 
1 1 1 13  21 9  o 170.6042 4.253281 356.1041       17.68275 394.3483       30.46134 336.6666       21.71630 178.7702 7.005829 165.5909 5.388801 13.17928       8.838598 
1 1 1 13  21 10 o 44.70795 5.722913 24.93844       6.092236 28.08846       9.146443 22.42644       8.167816 46.95935 8.296015 41.84694 8.302685 5.112404       11.73705 
1 1 1 13  21 11 o 83.23365 4.283401 85.03455       8.658857 92.30119       13.60263 80.08414       11.22735 86.32536 6.514257 80.52589 5.759472 5.799469       8.695232 
1 1 1 13  21 12 o 117.4403 4.688131 169.3443       13.38996 166.2485       18.09981 173.0867       19.90055 115.9704 6.429750 118.2007 6.939430 -2.230324      9.460305 
1 1 1 13  21 13 o 59.96732 5.382939 44.54642       7.782690 48.56394       10.43007 39.49952       11.69017 62.29997 6.990549 55.62294 8.926295 6.677025       11.33784 
1 1 1 13  21 14 o 162.9534 5.029341 326.5167       19.94759 308.4010       26.73173 349.2789       29.96454 157.7010 6.973191 167.6854 7.350771 -9.984329      10.13209 
1 1 1 13  21 15 o 94.06394 4.737186 108.9340       10.82379 103.0905       14.60745 116.0487       16.11811 91.04662 6.629188 96.54875 6.896049 -5.502136      9.565649 
1 1 1 13  21 16 o 84.26678 5.075655 87.71720       10.37449 89.32908       14.40824 85.98178       14.95025 84.50909 7.060819 82.76507 7.493628 1.744019       10.29610 
1 1 1 13  21 17 o 47.99481 9.453095 30.10086       10.66261 30.10086       10.66261 0.000000       0.000000 47.99481 9.453095 ?        ?        0.000000       9.453095 
1 1 1 13  21 18 o 103.1661 4.837963 131.5123       12.12898 135.3391       16.68139 127.2199       17.66694 104.0381 6.613908 100.5957 7.255605 3.442413       9.817719 
1 1 1 13  21 19 o 65.02195 8.178167 54.28601       12.67244 0.000000       0.000000 54.28601       12.67244 ?        ?        65.02195 8.178167 0.000000       8.178167 
1 1 1 13  21 20 o 46.68446 9.554706 29.11411       10.50343 0.000000       0.000000 29.11411       10.50343 ?        ?        46.68446 9.554706 0.000000       9.554706 
1 1 1 13  21 21 o 58.11440 5.641775 42.60978       7.889379 54.05167       11.37990 32.02143       10.94721 64.80231 7.335114 48.74287 9.558022 16.05944       12.04822 
1 1 1 13  21 22 o 48.80804 6.214822 30.56902       7.224483 36.05795       10.13722 24.90391       10.29862 52.14480 8.251921 42.33815 10.11973 9.806656       13.05768 
1 1 1 13  21 23 o 31.71185 7.714600 13.60552       5.903919 19.11813       7.901493 6.637890       8.883280 37.23674 8.840480 25.44160 9.925076 11.79514       13.29140 
1 1 1 13  21 24 o 95.39574 4.888262 115.0347       11.32581 103.7218       14.89196 130.5556       17.44307 88.97692 6.922562 99.55370 7.239481 -10.57678      10.01658 
1 1 1 13  21 25 o 35.89335 7.831767 17.92768       6.657284 20.40578       8.989169 14.91751       9.907294 37.18872 9.787744 31.74568 10.75591 5.443048       14.54268 
1 1 1 13  21 26 o 51.40898 8.317512 37.51379       10.06434 37.51379       10.06434 0.000000       0.000000 51.40898 8.317512 ?        ?        0.000000       8.317512 
1 1 1 13  21 27 f 27.89103 9.669844 11.98415       8.019306 11.98415       8.019306 0.000000       0.000000 27.89103 9.669844 ?        ?        0.000000       9.669844 
1 1 1 13  21 28 o 20.54228 7.941323 5.366670       5.647421 3.036485       7.823120 7.902422       8.160905 20.17217 8.711646 23.73616 9.434703 -3.563982      12.84159 
1 1 1 13  21 29 o 22.58513 8.007984 7.827131       5.520000 10.95619       7.367206 3.821996       8.334985 25.52018 9.227401 20.37721 8.894198 5.142971       12.81607 
1 1 1 13  21 30 o 15.93009 7.102018 0.7261924      5.587867 -3.247765      8.036336 4.445905       7.775015 16.22821 7.676922 19.81750 8.620923 -3.589287      11.54363 
1 1 1 13  21 31 f 25.03038 3.698796 8.340881       2.188265 37.82025       10.88326 7.098879       2.233887 43.88568 10.34638 22.80045 4.174295 21.08523       11.15671 
1 1 1 13  21 32 o 13.45538 4.454642 2.470831       1.700482 2.716096       3.259449 2.379111       1.993242 14.91148 5.950840 13.43593 4.806942 1.475549       7.649784 
1 1 1 13  21 33 o 11.09290 4.425790 1.238036       1.802427 4.370055       3.680902 0.2501883      2.067222 16.74814 6.427793 10.19445 4.439861 6.553697       7.812099 
1 1 1 13  21 34 o 7.941451 3.713598 -1.211280      1.786945 1.696652       3.968634 -1.950757      2.001296 13.80122 6.077118 7.875107 3.755511 5.926112       7.143894 
1 1 1 13  21 35 o 12.81783 5.274883 2.028862       2.652960 3.962105       3.793804 0.1788273      3.711262 15.50428 6.335973 12.15187 5.564449 3.352415       8.432535 
1 1 1 13  21 36 o 10.82079 5.103425 -1.195918      3.502076 0.4844223      4.226521 -4.876721      6.255407 12.60418 5.831498 12.03044 5.934473 0.5737381      8.320116 
1 1 1 13  22 0  o 108.0957 2.975864 142.7067       7.831485 152.0555       15.12422 139.2816       9.154331 111.2589 5.596271 106.7388 3.524228 4.520111       6.613504 
1 1 1 13  22 1  o 144.6788 3.232742 255.5380       11.39756 237.3626       14.82407 281.8161       17.82475 139.2592 4.373673 151.6798 4.828511 -12.42062      6.514870 
1 1 1 13  22 2  o 84.51369 2.606839 87.22308       5.362381 89.42783       8.087631 85.49350       7.163322 85.46007 3.893718 83.59290 3.524395 1.867165       5.251894 
1 1 1 13  22 3  o 77.91399 2.616043 74.14868       4.959982 76.66694       7.390182 72.08452       6.690797 79.11681 3.844611 76.73672 3.587918 2.380089       5.258725 
1 1 1 13  22 4  o 63.00557 3.335641 48.61182       5.103218 42.39544       5.985738 65.15471       9.764597 58.73325 4.210055 72.69238 5.554317 -13.95912      6.969577 
1 1 1 13  22 5  o 97.32270 3.026660 115.7387       7.169446 125.0477       14.53321 112.7447       8.242155 100.7646 5.944995 96.00465 3.529003 4.759972       6.913525 
1 1 1 13  22 6  o 119.0156 2.601412 172.8418       7.544824 170.6841       11.22656 174.6191       10.18876 118.0983 3.906295 119.5042 3.502442 -1.405838      5.246546 
1 1 1 13  22 7  o 112.0835 2.264515 153.2476       6.185188 170.3837       10.65134 144.5293       7.597387 118.0113 3.708377 108.7728 2.868712 9.238434       4.688450 
1 1 1 13  22 8  o 54.67500 4.893445 36.91950       6.451018 42.15141       9.608727 32.62607       8.704396 58.08931 6.924011 50.94568 7.212698 7.143631       9.998247 
1 1 1 13  22 9  o 27.92802 7.655218 9.949070       5.364163 4.595356       7.618946 15.21137       7.553620 23.78675 9.216217 34.35652 8.938255 -10.56977      12.83866 
1 1 1 13  22 10 o 184.1618 5.274355 416.6685       23.64598 455.3001       34.25350 381.4987       32.68271 191.7857 7.342699 175.4068 7.664525 16.37889       10.61415 
1 1 1 13  22 11 o 124.8001 4.003743 190.8454       12.16060 177.8591       18.79355 200.1988       15.94964 119.9323 6.454154 127.5951 5.140087 -7.662811      8.250854 
1 1 1 13  22 12 o 57.85088 5.418653 41.49876       7.550114 38.10327       10.03959 45.91897       11.45477 54.91189 7.715122 60.30238 7.991539 -5.390484      11.10801 
1 1 1 13  22 13 o 92.56051 4.713702 105.4255       10.59721 94.32679       13.99769 120.3285       16.22018 87.10832 6.644312 98.39782 6.806417 -11.28950      9.511792 
1 1 1 13  22 14 o 44.83075 6.069711 25.24741       6.460832 24.34179       8.435310 26.53270       10.04908 43.48623 8.261988 45.15474 9.436897 -1.668507      12.54255 
1 1 1 13  22 15 o 58.06571 5.528948 41.95582       7.729135 41.17242       10.22817 42.99870       11.80109 57.00994 7.547500 57.96051 8.616891 -0.9505615     11.45494 
1 1 1 13  22 16 f 41.58506 6.678540 22.00454       6.538847 23.01372       8.641539 20.65274       10.00145 42.01476 8.725817 39.49896 10.28950 2.515797       13.49124 
1 1 1 13  22 17 o 68.18130 7.641794 59.01429       12.47865 0.000000       0.000000 59.01429       12.47865 ?        ?        68.18130 7.641794 0.000000       7.641794 
1 1 1 13  22 18 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  22 19 o 108.1879 4.766458 145.1552       12.53555 132.9930       16.77429 160.5386       18.86522 102.6489 6.743194 112.7264 6.900589 -10.07756      9.648253 
1 1 1 13  22 20 o 38.50430 7.179599 19.37598       6.488912 23.99650       9.167312 14.73647       9.186132 42.20338 9.175903 33.14186 10.29465 9.061516       13.79047 
1 1 1 13  22 21 o 84.47495 4.953125 89.34847       10.15158 101.0072       14.33370 77.61526       14.37942 88.89112 6.665583 77.22733 7.745146 11.66379       10.21848 
1 1 1 13  22 22 f 84.18870 4.929846 89.12070       10.06975 91.14883       13.84489 86.84280       14.67268 83.97527 6.824305 81.49915 7.470922 2.476112       10.11859 
1 1 1 13  22 23 o 33.84319 7.817136 15.69315       6.317059 23.24085       9.191066 8.935471       8.696754 40.46154 9.487169 26.87596 9.974885 13.58558       13.76607 
1 1 1 13  22 24 o 18.35973 7.498669 2.409593       5.310275 1.535876       7.027829 3.572234       8.106975 19.59748 8.356007 22.04130 9.159676 -2.443819      12.39849 
1 1 1 13  22 25 o 51.80671 8.402772 38.03794       10.24517 38.03794       10.24517 0.000000       0.000000 51.80671 8.402772 ?        ?        0.000000       8.402772 
1 1 1 13  22 26 o 34.67620 7.696845 17.32980       6.334228 21.42075       8.667963 12.64161       9.279140 37.18477 9.524496 28.56865 10.35214 8.616127       14.06708 
1 1 1 13  22 27 o 20.96404 7.937251 5.736202       5.564442 9.543034       7.877459 1.945083       7.861184 25.17390 9.463078 19.65218 8.606327 5.521719       12.79135 
1 1 1 13  22 28 o 45.07602 6.706336 29.25861       7.142561 32.41526       9.877582 25.79912       10.34053 44.31350 9.436451 37.48731 10.75794 6.826183       14.31013 
1 1 1 13  22 29 o 21.10402 8.109141 6.775136       5.863189 9.724205       7.938824 3.236309       8.696477 23.75028 9.347725 19.76499 8.832535 3.985291       12.86055 
1 1 1 13  22 30 o 22.30082 8.297385 8.487840       6.024626 3.500466       8.382466 13.81679       8.664761 19.22102 8.624301 26.04209 9.894260 -6.821072      13.12536 
1 1 1 13  22 31 o 29.01220 8.484738 15.51233       6.376828 15.46371       9.414637 15.55354       8.667959 25.76054 10.16704 26.39494 9.925584 -0.6344051     14.20866 
1 1 1 13  22 32 o 16.51716 7.383329 2.726912       6.081589 4.762180       9.317654 1.216348       8.027224 18.68444 8.649473 16.75207 7.845683 1.932373       11.67768 
1 1 1 13  22 33 o 14.39076 4.570396 3.030478       1.800732 2.895388       3.620394 3.074884       2.075702 14.81451 6.135637 14.44915 4.922876 0.3653593      7.866432 
1 1 1 13  22 34 o 13.52487 4.796888 2.684424       1.980793 9.664347       3.845186 0.1631346      2.311018 23.24765 6.523208 10.33062 4.588769 12.91703       7.975528 
1 1 1 13  22 35 f 11.33254 4.823342 1.152326       2.334294 1.108393       3.953029 1.175846       2.892443 12.91010 5.845617 11.99000 5.236296 0.9201031      7.847932 
1 1 1 13  23 0  o 116.6842 3.051096 166.3123       8.668248 166.4551       16.23011 166.2553       10.25305 116.3639 5.741302 116.6053 3.612626 -0.2414246     6.783333 
1 1 1 13  23 1  o 157.8964 2.925713 304.2987       11.25745 329.8496       17.94799 287.7271       14.45419 164.1394 4.491333 153.3895 3.869982 10.74994       5.928645 
1 1 1 13  23 2  o 75.61450 3.210834 69.93857       5.902953 64.66604       7.281857 80.04388       10.08109 72.60670 4.132629 80.66855 5.155205 -8.061844      6.607176 
1 1 1 13  23 3  o 141.8813 2.821986 245.6907       9.756994 246.2025       14.90810 245.3072       12.90466 141.8037 4.319221 141.6310 3.742251 0.1726379      5.714902 
1 1 1 13  23 4  o 84.71439 2.606959 87.65538       5.375394 80.58318       7.721724 94.30521       7.487592 81.09344 3.919043 87.78790 3.507085 -6.694466      5.259140 
1 1 1 13  23 5  o 83.83202 2.633063 85.85035       5.372401 88.41764       8.001598 83.74305       7.249415 84.95199 3.875364 82.70210 3.605748 2.249893       5.293379 
1 1 1 13  23 6  o 165.0262 2.955956 332.5191       11.88740 312.9767       17.64258 348.7682       16.08747 159.8152 4.534688 168.8787 3.909101 -9.063538      5.987024 
1 1 1 13  23 7  o 68.11603 2.502477 56.69819       4.146834 65.16486       6.048950 49.19081       5.695973 72.94582 3.412312 63.32238 3.707479 9.623440       5.038777 
1 1 1 13  23 8  o 153.9468 2.862928 289.3943       10.74032 256.3126       23.88991 297.7745       12.02397 143.9953 6.827611 156.1228 3.160423 -12.12752      7.523600 
1 1 1 13  23 9  f 221.0143 5.739743 601.1093       30.88739 597.8635       42.92038 604.5958       44.48433 219.3781 8.042108 220.4770 8.294356 -1.098938      11.55300 
1 1 1 13  23 10 o 115.2844 4.039559 162.9295       11.33102 138.0811       17.08674 182.4345       15.13853 105.5460 6.677494 121.7802 5.112557 -16.23417      8.409945 
1 1 1 13  23 11 o 62.37563 5.264734 48.15585       7.927885 57.12170       11.25536 39.32770       11.16859 67.61617 6.928705 55.57903 8.517177 12.03714       10.97949 
1 1 1 13  23 12 o 102.1347 4.675318 128.3188       11.60559 106.5376       15.06528 160.1125       18.20149 92.55843 6.725088 113.6013 6.603340 -21.04286      9.425014 
1 1 1 13  23 13 o 63.46065 5.255800 49.91590       8.055092 43.30881       10.55633 59.12499       12.46282 58.52591 7.579486 68.51852 7.591205 -9.992611      10.72730 
1 1 1 13  23 14 o 32.26027 8.016880 13.52548       6.274827 5.717915       8.382172 23.47812       9.463851 25.25623 9.698101 42.33121 9.417291 -17.07498      13.51808 
1 1 1 13  23 15 o 33.61164 10.56566 14.47331       9.646093 0.000000       0.000000 14.47331       9.646093 ?        ?        33.61164 10.56566 0.000000       10.56566 
1 1 1 13  23 16 o 96.96534 7.119662 118.2537       16.70604 0.000000       0.000000 118.2537       16.70604 ?        ?        96.96534 7.119662 0.000000       7.119662 
1 1 1 13  23 17 o 79.58502 4.940287 78.62297       9.533953 93.29842       13.54890 64.22940       13.41814 86.16245 6.500775 70.86378 7.904638 15.29866       10.23442 
1 1 1 13  23 18 o 47.26274 5.892579 28.28983       6.639716 28.02356       8.731939 28.65482       10.22341 46.32228 8.026083 46.33959 9.375656 -0.1731491E-01 12.34184 
1 1 1 13  23 19 o 68.84904 6.747322 60.49105       11.17529 60.49105       11.17529 0.000000       0.000000 68.84904 6.747322 ?        ?        0.000000       6.747322 
1 1 1 13  23 20 o 22.34883 7.844945 5.903349       5.287292 1.996248       6.931539 11.33992       8.176450 20.34324 8.463129 29.43071 9.768931 -9.087479      12.92504 
1 1 1 13  23 21 o 88.36294 4.863261 98.06791       10.43172 112.6030       14.87518 84.00199       14.63315 93.58044 6.564547 80.06043 7.591076 13.52000       10.03582 
1 1 1 13  23 22 o 28.89622 8.103863 11.47996       5.936096 9.945185       8.056355 13.30287       8.780072 27.51867 9.681802 30.82111 10.11852 -3.302446      14.00435 
1 1 1 13  23 23 f 36.33057 10.26227 19.63615       9.483753 19.63615       9.483753 0.000000       0.000000 36.33057 10.26227 ?        ?        0.000000       10.26227 
1 1 1 13  23 24 o 18.42520 7.644119 2.257539       5.632822 6.258425       7.324603 -3.533353      8.812086 23.22102 9.025516 18.51289 8.513041 4.708136       12.40693 
1 1 1 13  23 25 o 39.91043 7.295918 22.39583       6.834418 28.37338       9.333476 15.48552       10.03529 43.51530 9.095042 30.99248 10.81292 12.52282       14.12937 
1 1 1 13  23 26 o 39.47486 7.512692 22.58536       6.962965 31.24561       9.805333 13.77591       9.889443 44.80140 9.286464 28.79218 10.64594 16.00923       14.12709 
1 1 1 13  23 27 o 44.85187 6.606801 28.69881       7.005098 38.41101       10.10916 19.72746       9.715949 49.54317 8.689990 32.83406 10.63516 16.70911       13.73399 
1 1 1 13  23 28 o 10.86960 5.385279 -10.11504      5.355945 -12.34240      7.443778 -7.724102      7.712256 12.89592 6.381969 14.51793 7.036075 -1.622002      9.499257 
1 1 1 13  23 29 o 17.15524 7.328280 2.796071       5.423312 2.459078       8.053476 3.075699       7.336067 18.66436 8.407286 18.59540 8.222072 0.6896782E-01  11.75946 
1 1 1 13  23 30 o 10.83688 5.373428 -9.452617      5.373190 -16.23346      7.780389 -3.269721      7.429430 11.99133 6.023568 15.21379 7.249812 -3.222467      9.425664 
1 1 1 13  23 31 o 15.77404 7.451447 -0.8876117     7.520977 0.000000       0.000000 -0.8876117     7.520977 ?        ?        15.77404 7.451447 0.000000       7.451447 
1 1 1 13  23 32 o 19.94237 8.150641 8.055115       6.279102 -1.505631      8.994751 17.14304       8.769514 15.84993 7.661608 25.27884 9.861393 -9.428916      12.48789 
1 1 1 13  23 33 o 19.02321 8.005485 7.867924       6.310612 7.729653       9.640987 7.971576       8.347267 18.45979 8.630119 18.66789 8.469331 -0.2080994     12.09167 
1 1 1 13  23 34 o 10.61904 4.745154 0.2062460      2.509638 8.657624       8.676862 -0.5653068     2.621692 18.19367 8.395505 10.11215 4.647591 8.081525       9.596072 
1 1 1 13  24 0  o 67.34393 2.862026 55.45720       4.686156 63.00994       7.043098 49.45764       6.277271 71.67077 4.049073 63.46602 4.080381 8.204750       5.748435 
1 1 1 13  24 1  o 166.8089 4.104436 340.3100       16.68433 307.7434       26.13713 362.7058       21.67483 157.9682 6.805690 171.9433 5.178805 -13.97513      8.552043 
1 1 1 13  24 2  o 114.8097 2.713797 160.8773       7.592630 149.5422       11.11525 170.7929       10.39600 110.4921 4.135415 118.1634 3.614584 -7.671310      5.492438 
1 1 1 13  24 3  o 141.7325 2.850740 245.2315       9.846072 241.0028       14.82300 248.5705       13.17171 140.2620 4.341936 142.5388 3.795415 -2.276871      5.766939 
1 1 1 13  24 4  o 161.3069 2.974310 317.7258       11.69164 289.0377       17.09012 342.9643       16.02972 153.5592 4.572113 167.4565 3.928148 -13.89731      6.027816 
1 1 1 13  24 5  o 85.29436 2.648525 88.88738       5.498369 91.44744       8.053664 86.65240       7.524968 86.38662 3.835261 84.10599 3.680394 2.280632       5.315499 
1 1 1 13  24 6  o 33.68346 4.577586 14.15224       3.660273 11.99848       7.782214 14.76404       4.147683 30.93330 9.451894 34.32273 5.114893 -3.389433      10.74711 
1 1 1 13  24 7  o 86.19925 2.286128 90.73199       4.797960 91.19699       7.706621 90.43767       6.131115 86.27178 3.674131 85.99904 2.929844 0.2727432      4.699279 
1 1 1 13  24 8  f 107.1902 3.073773 140.5038       8.020733 149.1958       16.97600 138.0059       9.100570 109.8173 6.370847 106.1720 3.522281 3.645256       7.279708 
1 1 1 13  24 9  o 56.36581 2.464757 38.85860       3.377340 59.91262       10.82254 36.58705       3.554868 69.37884 6.476085 54.67117 2.676399 14.70767       7.007338 
1 1 1 13  24 10 f 135.1491 4.716689 224.4762       15.51031 252.3452       22.34982 198.5848       21.54224 142.7843 6.439865 126.4410 7.018989 16.34328       9.525653 
1 1 1 13  24 11 f 112.4809 4.739455 155.6994       12.96191 159.5656       18.13908 151.6653       18.52896 113.3510 6.595290 110.3937 6.922489 2.957268       9.561313 
1 1 1 13  24 12 o 98.43863 7.022978 120.9890       16.73635 0.000000       0.000000 120.9890       16.73635 ?        ?        98.43863 7.022978 0.000000       7.022978 
1 1 1 13  24 13 o 75.09796 7.404667 71.01441       13.37484 0.000000       0.000000 71.01441       13.37484 ?        ?        75.09796 7.404667 0.000000       7.404667 
1 1 1 13  24 14 o 146.8303 4.922542 266.1271       17.58842 257.7579       23.91816 275.9817       25.95394 143.6325 6.853204 148.4466 7.196023 -4.814163      9.937261 
1 1 1 13  24 15 o 98.93237 4.708198 121.0028       11.31830 123.6200       15.46744 117.9861       16.60614 99.38947 6.420545 96.81078 7.088089 2.578682       9.563703 
1 1 1 13  24 16 o 35.78315 7.429307 16.70233       6.266137 20.10108       8.219877 11.98710       9.681827 38.93259 8.863428 31.09321 10.63114 7.839373       13.84129 
1 1 1 13  24 17 o 34.89734 7.140485 15.91317       5.867518 18.85481       7.477504 11.19953       9.465430 37.69197 8.359914 30.14300 10.50240 7.548964       13.42343 
1 1 1 13  24 18 f 100.0006 4.737753 124.4963       11.51262 119.7320       15.14981 131.0078       17.71123 97.19796 6.432261 101.1834 7.230619 -3.985405      9.677594 
1 1 1 13  24 19 o 60.17196 5.335176 45.71165       7.742103 43.58292       10.02583 48.85619       12.18537 57.89910 7.265336 60.69943 8.468120 -2.800327      11.15769 
1 1 1 13  24 20 o 78.12354 6.500586 78.59053       12.26369 78.59053       12.26369 0.000000       0.000000 78.12354 6.500586 ?        ?        0.000000       6.500586 
1 1 1 13  24 21 o 37.65491 8.727688 19.78160       7.852017 19.78160       7.852017 0.000000       0.000000 37.65491 8.727688 ?        ?        0.000000       8.727688 
1 1 1 13  24 22 o 13.91600 6.377396 -2.720041      4.888033 1.709600       6.143498 -10.36185      8.069184 18.75814 7.896636 15.18388 7.319062 3.574261       10.76687 
1 1 1 13  24 23 o 14.65677 6.536249 -1.066479      4.736626 4.396796       6.022651 -9.924953      7.669034 20.68045 8.141110 14.68051 7.090986 5.999940       10.79628 
1 1 1 13  24 24 o 11.95715 5.795886 -7.514954      5.238269 -5.880371      6.971727 -9.634064      7.938048 15.11681 7.150926 14.93849 7.215274 0.1783161      10.15854 
1 1 1 13  24 25 o 26.79880 8.041421 10.74724       5.668638 12.03411       7.366395 8.878690       8.876460 27.72971 9.274094 25.03166 9.874408 2.698048       13.54669 
1 1 1 13  24 26 o 21.44338 8.113910 6.413985       5.812864 7.314311       7.948776 5.379019       8.522432 22.91847 9.242312 21.81067 9.246968 1.107803       13.07390 
1 1 1 13  24 27 o 33.60593 7.941455 17.87894       6.399808 22.63852       9.321199 13.63438       8.802452 34.92014 10.27073 27.12692 10.04137 7.793222       14.36374 
1 1 1 13  24 28 o 36.05976 7.902012 21.02651       6.751581 27.83163       10.18317 15.68859       9.018853 37.40704 10.65682 27.86125 10.18936 9.545794       14.74418 
1 1 1 13  24 29 o 18.37181 7.785850 4.286350       6.037822 7.013820       9.528713 2.456597       7.804597 21.08688 9.344803 18.14405 8.214804 2.942835       12.44220 
1 1 1 13  24 30 o 16.98613 7.955606 0.6370146      8.255061 0.000000       0.000000 0.6370146      8.255061 ?        ?        16.98613 7.955606 0.000000       7.955606 
1 1 1 13  24 31 o 15.85956 7.222401 1.864667       6.141709 -2.997457      9.118406 5.902162       8.309253 15.64854 7.599571 18.73299 8.479358 -3.084447      11.38653 
1 1 1 13  24 32 o 24.48163 8.729188 13.94160       6.567494 21.99347       9.951725 7.729378       8.741246 26.20243 10.41741 18.78446 8.578162 7.417971       13.49471 
1 1 1 13  24 33 o 19.69549 8.223673 9.452147       6.579836 11.39938       10.11295 8.022725       8.664621 19.32435 8.968316 18.21912 8.400917 1.105230       12.28845 
1 1 1 13  25 0  o 125.3879 2.803739 191.9335       8.567015 180.2117       12.71947 201.6665       11.59028 121.2648 4.311116 128.3827 3.708572 -7.117867      5.686759 
1 1 1 13  25 1  o 154.0173 2.957347 289.6636       11.09962 306.6160       17.33173 277.8763       14.45218 158.1702 4.501147 150.6730 3.939442 7.497147       5.981598 
1 1 1 13  25 2  o 23.91088 5.577052 7.301583       3.189751 4.180406       4.367263 10.87034       4.669909 19.90571 7.116030 29.12859 6.716242 -9.222872      9.784978 
1 1 1 13  25 3  o 107.2188 3.128785 140.5560       8.166161 136.5671       10.32970 147.2032       13.33479 105.5656 4.022765 109.4351 5.013587 -3.869553      6.427961 
1 1 1 13  25 4  o 63.82100 2.916328 49.84916       4.523626 53.99668       6.538321 46.04094       6.265166 66.29511 4.066713 61.17512 4.228656 5.119995       5.866829 
1 1 1 13  25 5  o 159.9789 2.975343 312.6346       11.59941 316.3292       17.64364 309.8222       15.39368 160.5940 4.512878 159.0999 3.970419 1.494049       6.010848 
1 1 1 13  25 6  o 71.30251 2.688973 62.16819       4.663891 59.97853       6.587658 64.36863       6.603848 69.89684 3.882822 72.43443 3.754053 -2.537590      5.400853 
1 1 1 13  25 7  o 124.4124 2.955383 189.1153       8.960114 195.6475       19.26843 187.3130       10.12096 125.7795 6.306498 123.7235 3.359972 2.055962       7.145721 
1 1 1 13  25 8  o 78.77716 3.053586 75.96432       5.850909 0.000000       0.000000 75.96432       5.850909 ?        ?        78.77716 3.053586 0.000000       3.053586 
1 1 1 13  25 9  o 53.63946 2.934647 35.27134       3.821366 0.000000       0.000000 35.27134       3.821366 ?        ?        53.63946 2.934647 0.000000       2.934647 
1 1 1 13  25 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  25 11 o 94.73126 4.159559 110.3636       9.578923 118.8603       14.96926 104.4719       12.46520 97.73907 6.318728 91.81703 5.597687 5.922043       8.441589 
1 1 1 13  25 12 o 153.5694 4.945954 290.9723       18.48520 269.5711       24.97864 316.8831       27.48471 146.8927 6.998153 159.2297 7.101089 -12.33702      9.969934 
1 1 1 13  25 13 o 84.98677 7.118203 90.93864       14.60674 0.000000       0.000000 90.93864       14.60674 ?        ?        84.98677 7.118203 0.000000       7.118203 
1 1 1 13  25 14 o 102.5382 4.727032 130.0825       11.77987 141.5086       16.45189 118.0615       16.87466 106.3050 6.380126 96.70004 7.212932 9.604919       9.629766 
1 1 1 13  25 15 o 51.50983 5.788158 33.44954       7.139940 28.37172       9.180993 41.22036       11.35755 46.52807 8.406586 56.23766 8.556907 -9.709595      11.99547 
1 1 1 13  25 16 o 22.24888 8.066522 5.444462       5.635054 7.476368       7.652782 3.037979       8.328350 25.77364 9.392188 22.78016 9.357283 2.993475       13.25790 
1 1 1 13  25 17 o 78.53078 4.763042 76.95612       9.072220 79.57929       12.44626 73.98247       13.25170 79.06511 6.517613 75.82874 7.259915 3.236374       9.756313 
1 1 1 13  25 18 f 70.72614 4.997643 62.83480       8.558065 58.08405       10.81736 70.78336       13.99216 67.19267 6.695400 73.47997 7.940066 -6.287308      10.38619 
1 1 1 13  25 19 o 38.88366 8.929976 20.91009       8.282988 20.91009       8.282988 0.000000       0.000000 38.88366 8.929976 ?        ?        0.000000       8.929976 
1 1 1 13  25 20 o 38.13959 6.505099 19.23540       5.829257 17.80674       7.265147 21.81734       9.766844 35.78302 8.464932 38.76545 10.20216 -2.982430      13.25667 
1 1 1 13  25 21 o 24.16953 8.484922 7.589104       6.185242 7.589104       6.185242 0.000000       0.000000 24.16953 8.484922 ?        ?        0.000000       8.484922 
1 1 1 13  25 22 f 26.00889 7.742078 9.495128       5.270609 12.25832       6.743407 5.157015       8.449373 29.07465 8.781032 23.10845 9.450958 5.966204       12.90066 
1 1 1 13  25 23 o 28.61800 7.647517 11.80761       5.435160 9.643615       6.581443 16.44857       9.638215 25.80554 8.766331 31.97907 10.60600 -6.173532      13.75993 
1 1 1 13  25 24 o 22.15137 7.876334 6.812296       5.343350 7.343009       6.889020 6.010877       8.465594 23.18016 8.818702 22.82380 9.410736 0.3563633      12.89696 
1 1 1 13  25 25 o 24.36491 8.006587 9.065955       5.496893 15.65330       7.415537 1.031759       8.189525 30.83625 9.184330 19.10225 8.551271 11.73400       12.54895 
1 1 1 13  25 26 o 20.97696 7.781750 6.481504       5.291751 2.539986       6.495762 14.25846       9.124377 18.24238 7.908180 27.62791 10.22397 -9.385534      12.92552 
1 1 1 13  25 27 o 16.99242 7.446817 1.878652       5.894953 5.189599       8.623985 -1.025165      8.076376 20.63402 9.025799 17.19482 7.991819 3.439199       12.05546 
1 1 1 13  25 28 o 17.50090 7.900877 1.782424       7.158531 0.000000       0.000000 1.782424       7.158531 ?        ?        17.50090 7.900877 0.000000       7.900877 
1 1 1 13  25 29 o 16.33656 7.248383 2.151573       5.750029 -1.062687      8.390432 4.997916       7.895642 16.51392 7.821599 19.05717 8.472439 -2.543247      11.53081 
1 1 1 13  25 30 o 22.88730 8.458044 10.77150       6.240805 14.86454       9.349681 7.482500       8.381194 23.88613 9.873357 19.76361 8.760932 4.122520       13.19989 
1 1 1 13  25 31 o 26.42293 8.540545 15.02486       6.267691 10.02204       8.631067 20.60630       9.116553 20.20146 8.925886 26.86853 10.16255 -6.667074      13.52586 
1 1 1 13  25 32 o 16.98862 7.579373 5.086492       6.376187 11.23708       9.795295 0.5640174      8.399382 19.67334 9.020327 15.54746 7.487503 4.125879       11.72301 
1 1 1 13  25 33 f 13.24358 6.593463 -6.676117      8.420294 -6.676117      8.420294 0.000000       0.000000 13.24358 6.593463 ?        ?        0.000000       6.593463 
1 1 1 13  26 0  o 31.59614 4.855700 12.52162       3.619251 13.77541       5.001543 11.14342       5.243838 32.87900 6.472884 29.45225 7.334332 3.426754       9.782160 
1 1 1 13  26 1  o 112.4400 2.803068 154.3870       7.680521 151.5679       11.50828 156.6512       10.31348 111.1681 4.255954 113.1017 3.747137 -1.933670      5.670466 
1 1 1 13  26 2  o 70.62952 3.531669 61.15261       6.059299 55.11842       9.270689 65.65278       8.006024 66.69767 5.760206 73.05177 4.519411 -6.354103      7.321547 
1 1 1 13  26 3  o 53.37214 3.818080 35.03526       4.933072 38.15365       7.694288 32.85880       6.428052 55.39025 5.785531 51.46834 5.196187 3.921909       7.776421 
1 1 1 13  26 4  o 22.28749 7.266465 5.945007       4.531621 4.206422       5.283743 10.78124       8.812469 20.89722 7.771368 30.12434 10.14435 -9.227116      12.77896 
1 1 1 13  26 5  o 54.30452 3.632751 36.24610       4.779722 40.72108       7.458178 33.12717       6.226438 57.28992 5.406103 51.69492 5.005146 5.595005       7.367321 
1 1 1 13  26 6  o 228.1741 4.547703 638.9503       25.28684 0.000000       0.000000 638.9503       25.28684 ?        ?        228.1741 4.547703 0.000000       4.547703 
1 1 1 13  26 7  o 50.45955 2.877553 31.21943       3.523697 27.86032       4.710325 35.48811       5.309897 47.49459 4.110191 53.64829 4.092458 -6.153702      5.800162 
1 1 1 13  26 8  o 51.16232 2.538589 32.05360       3.155151 37.20014       4.758066 28.01444       4.215206 55.00160 3.569199 47.68575 3.655254 7.315849       5.108822 
1 1 1 13  26 9  o 48.60162 2.927784 28.99048       3.451497 30.41011       8.332172 28.69643       3.792150 48.93053 7.203144 48.31436 3.239592 0.6161766      7.898116 
1 1 1 13  26 10 o 23.56070 3.945103 6.993586       2.185066 8.646901       7.424191 6.836789       2.286332 27.10238 9.308177 23.24533 4.190268 3.857050       10.20786 
1 1 1 13  26 11 o 142.0576 4.812501 249.0990       16.63581 231.9037       22.32814 270.5548       24.94134 136.2131 6.747634 147.0225 6.981397 -10.80943      9.709298 
1 1 1 13  26 12 o 37.15353 6.765582 17.75672       5.899895 20.38910       8.746453 15.55893       7.991927 39.20526 9.296768 34.30442 9.319902 4.900845       13.16398 
1 1 1 13  26 13 o 105.7636 4.650682 138.4519       11.95710 140.5355       16.57928 136.1933       17.26112 105.7991 6.461355 103.9558 6.851924 1.843369       9.417960 
1 1 1 13  26 14 o 60.02173 8.206144 46.78286       11.68887 0.000000       0.000000 46.78286       11.68887 ?        ?        60.02173 8.206144 0.000000       8.206144 
1 1 1 13  26 15 o 17.81939 7.235739 1.896633       4.910120 -0.9042266     5.957408 7.829689       8.670634 17.09100 7.488195 26.70402 9.950509 -9.613020      12.45334 
1 1 1 13  26 16 o 64.98914 6.731202 54.18632       10.50614 54.18632       10.50614 0.000000       0.000000 64.98914 6.731202 ?        ?        0.000000       6.731202 
1 1 1 13  26 17 o 73.07784 6.521759 68.59748       11.49220 68.59748       11.49220 0.000000       0.000000 73.07784 6.521759 ?        ?        0.000000       6.521759 
1 1 1 13  26 18 o 71.38607 4.837342 64.24240       8.365342 68.08339       11.05368 59.09368       12.79779 72.66798 6.304372 66.53331 8.057286 6.134666       10.23059 
1 1 1 13  26 19 o 77.79833 4.745972 76.50801       8.954891 76.81392       11.80251 76.09299       13.74699 76.87259 6.357163 75.54427 7.569259 1.328323       9.884696 
1 1 1 13  26 20 o 76.30331 4.675755 73.93185       8.652483 69.86758       11.20333 79.93931       13.62078 72.92897 6.367720 77.15399 7.332521 -4.225021      9.711526 
1 1 1 13  26 21 o 29.61616 7.471622 12.34619       5.391177 10.86497       6.538331 15.49207       9.528582 27.49251 8.706158 31.76398 10.54586 -4.271475      13.67525 
1 1 1 13  26 22 o 24.94949 7.952542 8.921380       5.447892 10.96252       6.843760 5.390560       9.001106 27.17476 8.933998 23.15219 9.638939 4.022566       13.14251 
1 1 1 13  26 23 o 13.33037 6.074203 -1.723673      4.352284 -5.567008      5.171336 7.609500       8.058670 12.55313 6.000244 23.79987 9.402308 -11.24674      11.15376 
1 1 1 13  26 24 o 13.29475 6.146694 -2.373402      4.683662 0.7115393      5.944768 -7.422308      7.605191 16.86801 7.432266 14.86003 7.148357 2.007979       10.31201 
1 1 1 13  26 25 o 15.28441 6.730702 0.5409633      4.869001 2.016485       6.059828 -2.146876      8.178792 17.54824 7.622528 17.16704 8.000242 0.3812027      11.05019 
1 1 1 13  26 26 o 16.04913 7.502243 -2.189757      7.282197 0.000000       0.000000 -2.189757      7.282197 ?        ?        16.04913 7.502243 0.000000       7.502243 
1 1 1 13  26 27 f 25.83346 8.444223 11.89358       6.117739 14.42878       8.688056 9.400281       8.615973 26.41317 9.936089 22.68731 9.436713 3.725864       13.70319 
1 1 1 13  26 28 o 15.05813 6.692378 1.156505       4.922385 0.5761465      6.937661 1.744842       6.985190 16.34031 7.528341 16.97237 7.718745 -0.6320591     10.78216 
1 1 1 13  26 29 f 15.95594 7.209666 1.851107       5.975970 -11.60303      8.668208 14.03803       8.249898 13.37667 6.664581 24.33449 9.543718 -10.95782      11.64041 
1 1 1 13  26 30 o 14.46252 6.764822 -0.7928632E-01 5.936353 2.344643       9.062325 -1.901173      7.856703 17.01009 8.077587 14.99680 7.227170 2.013292       10.83879 
1 1 1 13  26 31 o 15.27998 7.053410 1.956761       6.132072 -8.741472      8.803920 12.03723       8.545952 13.42818 6.694443 20.83747 9.051685 -7.409291      11.25827 
1 1 1 13  26 32 o 12.46993 6.217453 -8.208979      7.603514 -8.208979      7.603514 0.000000       0.000000 12.46993 6.217453 ?        ?        0.000000       6.217453 
1 1 1 13  27 0  o 128.8199 3.617340 203.1940       11.34431 204.7583       19.09326 202.3404       14.10365 128.7346 6.103620 128.3730 4.515425 0.3615570      7.592314 
1 1 1 13  27 1  o 76.81915 2.904166 72.20388       5.426806 68.93758       7.723832 75.38832       7.626420 74.87838 4.250377 78.35195 4.007559 -3.473572      5.841766 
1 1 1 13  27 2  o 23.50890 5.676668 7.077667       3.215002 8.119884       4.284317 5.734304       4.864061 25.19643 6.814690 22.24583 7.536497 2.950600       10.16065 
1 1 1 13  27 3  o 151.2466 2.950285 279.5864       10.87391 251.1967       15.73097 305.5640       15.04783 142.9963 4.520020 157.9333 3.909884 -14.93707      5.976436 
1 1 1 13  27 4  o 87.13083 2.756899 92.85444       5.846311 88.35706       8.324115 97.23241       8.212871 84.80582 4.039491 89.01409 3.794878 -4.208275      5.542435 
1 1 1 13  27 5  o 225.5091 4.860541 625.3394       26.71067 595.9796       42.74738 644.1450       34.21175 218.2857 8.049938 228.1662 6.158647 -9.880432      10.13560 
1 1 1 13  27 6  f 15.83890 5.487413 2.793447       2.582252 1.734251       3.505407 4.050197       3.818339 15.71610 6.203518 19.09577 6.669334 -3.379668      9.108439 
1 1 1 13  27 7  o 112.0607 2.420991 153.4044       6.611235 155.1744       10.63615 152.2899       8.439702 112.4100 3.888638 111.5166 3.108675 0.8934097      4.978490 
1 1 1 13  27 8  o 51.65933 2.805647 32.73402       3.518721 27.80893       4.632002 39.45422       5.410697 47.41996 4.047046 56.55856 3.950553 -9.138596      5.655569 
1 1 1 13  27 9  o 153.2117 3.136962 287.4829       11.71217 326.2476       26.33384 277.9240       13.07671 161.6236 6.700637 150.5312 3.564806 11.09244       7.589887 
1 1 1 13  27 10 o 53.14816 2.774464 34.66236       3.580940 37.05999       9.351513 34.25037       3.876404 53.88808 7.309474 52.79518 3.025667 1.092899       7.910947 
1 1 1 13  27 11 o 51.77713 2.527679 32.87462       3.179667 48.28763       9.845428 31.07980       3.359704 61.76715 6.645368 50.31034 2.750826 11.45681       7.192215 
1 1 1 13  27 12 o 66.32240 2.976604 54.04151       4.798542 79.43323       12.03895 49.24561       5.232120 79.40485 6.272563 63.22223 3.408636 16.18262       7.138897 
1 1 1 13  27 13 o 59.95025 5.496206 45.20181       7.940267 43.20480       10.01651 48.57889       13.02562 57.94149 7.252408 60.62049 9.097984 -2.679001      11.63489 
1 1 1 13  27 14 o 28.21453 9.003144 10.37826       6.980878 10.37826       6.980878 0.000000       0.000000 28.21453 9.003144 ?        ?        0.000000       9.003144 
1 1 1 13  27 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  27 16 o 15.17878 6.605650 -0.3843771     4.568670 -1.966075      5.714898 2.416464       7.604856 15.87597 7.122404 21.23294 8.851455 -5.356969      11.36120 
1 1 1 13  27 17 o 31.13170 7.394340 13.14332       5.525908 20.09141       7.271953 3.648649       8.500770 38.36200 8.036585 22.78606 9.416153 15.57594       12.37944 
1 1 1 13  27 18 o 59.66259 5.264484 45.58165       7.575658 51.63137       10.15495 37.98972       11.37591 62.57510 6.767009 51.85228 9.346658 10.72282       11.53917 
1 1 1 13  27 19 o 45.76190 5.766200 27.41813       6.287823 27.05168       8.308941 27.90922       9.618822 44.09929 8.027393 43.92686 9.277154 0.1724319      12.26803 
1 1 1 13  27 20 o 46.11640 5.953281 28.24062       6.534402 24.38095       8.067519 35.60227       11.14175 41.25860 8.311619 48.83406 9.704573 -7.575462      12.77739 
1 1 1 13  27 21 o 33.17657 7.105084 15.54861       5.571180 13.58259       6.771351 19.66802       9.801640 30.02599 8.732525 34.67767 10.60982 -4.651682      13.74137 
1 1 1 13  27 22 o 15.29958 6.732811 0.1600811E-01  4.864379 -3.249233      5.936115 6.690816       8.487193 14.75588 6.855962 23.23088 9.483101 -8.475003      11.70185 
1 1 1 13  27 23 o 24.17693 7.677016 8.843378       5.080928 10.89930       6.290582 4.984924       8.617758 26.22396 8.562098 21.62692 9.238096 4.597036       12.59571 
1 1 1 13  27 24 o 20.56742 8.718032 4.959197       7.572638 0.000000       0.000000 4.959197       7.572638 ?        ?        20.56742 8.718032 0.000000       8.718032 
1 1 1 13  27 25 o 21.46837 9.148708 6.518404       8.416354 0.000000       0.000000 6.518404       8.416354 ?        ?        21.46837 9.148708 0.000000       9.148708 
1 1 1 13  27 26 o 14.70212 6.614228 0.1224607      4.966947 -4.691460      6.831906 5.519665       7.233973 14.32485 6.860440 19.93307 8.487684 -5.608214      10.91359 
1 1 1 13  27 27 o 13.65449 6.398606 -1.984699      5.352038 0.8314934      7.210766 -5.439302      7.986368 16.70034 7.687286 14.81727 7.176126 1.883070       10.51623 
1 1 1 13  27 28 o 35.54642 8.404086 23.34556       7.164397 36.08658       10.39114 11.80080       9.891303 40.43901 10.46487 22.21011 9.691729 18.22890       14.26335 
1 1 1 13  27 29 o 24.94034 8.470059 13.16217       6.144056 25.00320       9.188978 3.588128       8.262666 31.16740 10.35648 17.37810 8.079201 13.78930       13.13508 
1 1 1 13  27 30 o 14.02640 6.814034 -3.113184      7.346845 -3.113184      7.346845 0.000000       0.000000 14.02640 6.814034 ?        ?        0.000000       6.814034 
1 1 1 13  27 31 o 16.47348 7.259844 4.659014       5.674726 4.609287       8.099392 4.706963       7.953156 16.78426 7.867215 16.80590 7.850836 -0.2164459E-01 11.11435 
1 1 1 13  28 0  o 44.64919 3.733312 24.58642       4.024888 21.41641       5.220016 29.23426       6.320730 41.37904 5.298123 48.41518 5.452019 -7.036140      7.602278 
1 1 1 13  28 1  o 79.84222 2.968488 78.04787       5.765634 82.89291       8.188360 73.28367       8.119748 82.11013 4.105290 77.15059 4.336294 4.959541       5.971335 
1 1 1 13  28 2  o 135.6198 2.925052 224.8837       9.667020 223.0879       14.25465 226.4130       13.15404 134.7271 4.347449 135.8234 3.978477 -1.096268      5.893096 
1 1 1 13  28 3  o 101.2862 3.238029 125.6810       7.981943 109.6680       13.99835 133.3958       9.716285 93.93040 6.149349 104.2398 3.831511 -10.30942      7.245341 
1 1 1 13  28 4  o 169.2968 3.089960 350.7116       12.74788 358.0764       19.49951 345.2146       16.84651 170.5291 4.696807 167.6875 4.122617 2.841568       6.249477 
1 1 1 13  28 5  o 180.5793 3.174275 399.2166       13.96846 397.6295       21.16769 400.4408       18.59097 179.5927 4.841111 180.5252 4.225985 -0.9325714     6.426142 
1 1 1 13  28 6  o 100.2552 3.139316 123.1965       7.660242 132.6798       9.733130 107.7623       12.41696 103.8928 3.851085 93.18101 5.492655 10.71182       6.708213 
1 1 1 13  28 7  o 162.6517 2.718931 323.6466       10.77688 325.5310       17.85777 322.5672       13.51544 162.4921 4.514191 162.1910 3.419538 0.3010712      5.663141 
1 1 1 13  28 8  o 79.99091 2.383510 78.29317       4.640974 76.31879       7.028698 79.81934       6.179631 78.74622 3.672884 80.64111 3.150696 -1.894882      4.839108 
1 1 1 13  28 9  o 34.98035 3.910117 15.23869       3.276163 14.17021       7.230588 15.51471       3.675050 32.71655 8.854921 35.20483 4.378080 -2.488277      9.878118 
1 1 1 13  28 10 o 115.0617 3.134920 162.5738       8.781903 187.4734       18.50109 155.3320       9.977574 122.1949 6.233696 112.3126 3.650378 9.882347       7.223865 
1 1 1 13  28 11 o 19.57977 4.932220 4.944289       2.351816 5.425152       6.758877 4.878047       2.508579 23.18990 8.754985 19.46131 5.193221 3.728588       10.17936 
1 1 1 13  28 12 o 33.24591 3.036320 13.68728       2.432800 27.95091       7.888191 12.18796       2.557468 46.36677 7.215942 31.28748 3.409403 15.07929       7.980843 
1 1 1 13  28 13 o 61.09593 3.093907 46.02821       4.591342 48.24800       9.580578 45.36640       5.231184 61.34830 6.507588 60.53718 3.561762 0.8111191      7.418548 
1 1 1 13  28 14 o 80.71553 4.726186 81.64328       9.255495 84.95967       12.63917 77.80851       13.59111 81.40672 6.423221 77.33401 7.298188 4.072716       9.722207 
1 1 1 13  28 15 o 46.23536 5.714612 27.49343       6.301776 32.47999       8.424229 21.15761       9.495802 49.60531 7.177276 38.54449 10.01864 11.06083       12.32422 
1 1 1 13  28 16 o 29.58855 9.991057 12.10228       8.548097 0.000000       0.000000 12.10228       8.548097 ?        ?        29.58855 9.991057 0.000000       9.991057 
1 1 1 13  28 17 o 54.47152 5.206732 38.10209       6.827463 29.31966       8.750372 51.76890       10.91573 46.10343 8.083104 62.08928 7.357213 -15.98585      10.93001 
1 1 1 13  28 18 o 20.94943 7.542050 5.412030       4.915322 1.961870       6.297263 10.79161       7.863325 18.97300 7.991409 27.62742 9.575503 -8.654415      12.47208 
1 1 1 13  28 19 o 19.31062 7.385933 4.148845       4.848912 8.816483       6.455816 -1.892529      7.344639 25.07071 8.676961 17.53168 7.950108 7.539032       11.76834 
1 1 1 13  28 20 o 44.22219 6.077561 26.47063       6.376418 24.16678       8.212309 29.96801       10.11835 40.27586 8.627119 43.92925 9.710487 -3.653389      12.98925 
1 1 1 13  28 21 o 24.85979 7.551175 9.124726       4.976816 8.602676       6.210672 10.06146       8.319389 24.11021 8.499203 25.65736 9.707250 -1.547144      12.90222 
1 1 1 13  28 22 o 21.05120 8.839601 4.979444       7.667873 0.000000       0.000000 4.979444       7.667873 ?        ?        21.05120 8.839601 0.000000       8.839601 
1 1 1 13  28 23 o 18.61595 8.398140 1.160663       8.070863 0.000000       0.000000 1.160663       8.070863 ?        ?        18.61595 8.398140 0.000000       8.398140 
1 1 1 13  28 24 o 23.97616 8.082825 9.483563       5.594652 11.51581       7.550263 7.009096       8.331345 25.28623 9.310430 21.76373 9.180744 3.522495       13.07556 
1 1 1 13  28 25 o 16.33112 7.097654 2.017848       5.259882 -1.592850      7.027387 6.617521       7.931618 15.81238 7.384432 20.86309 8.885749 -5.050715      11.55363 
1 1 1 13  28 26 o 19.28352 7.809246 5.834126       5.701637 -0.1575367     7.510839 13.98258       8.758959 16.46401 7.670604 25.15930 9.843630 -8.695290      12.47939 
1 1 1 13  28 27 o 19.14168 7.829154 6.230417       5.798813 14.92575       8.613562 -0.9771580     7.842136 24.98650 9.765800 15.91888 7.546212 9.067627       12.34164 
1 1 1 13  28 28 o 29.66712 8.646437 17.99505       6.632235 12.59078       8.727294 25.38231       10.20358 22.21435 9.384913 29.70211 10.84182 -7.487762      14.33951 
1 1 1 13  28 29 o 16.93341 7.973144 3.294951       8.484531 3.294951       8.484531 0.000000       0.000000 16.93341 7.973144 ?        ?        0.000000       7.973144 
1 1 1 13  28 30 o 18.56781 7.796069 7.394588       5.963451 7.685831       8.625027 7.127840       8.254366 18.26636 8.407872 18.03894 8.274488 0.2274151      11.79659 
1 1 1 13  29 0  o 51.11780 3.989418 32.26477       4.930229 48.55151       8.720750 24.61400       5.977086 62.38049 5.803354 44.27152 5.670252 18.10896       8.113610 
1 1 1 13  29 1  o 69.63625 3.028626 59.45673       5.127165 66.59368       7.388101 52.82634       7.121082 73.51192 4.140934 65.37707 4.497159 8.134857       6.113245 
1 1 1 13  29 2  f 82.86669 3.996214 84.53074       8.046050 0.000000       0.000000 84.53074       8.046050 ?        ?        82.86669 3.996214 0.000000       3.996214 
1 1 1 13  29 3  o 155.4911 3.018260 296.0026       11.43664 285.1854       16.95080 305.0413       15.49478 152.0853 4.578908 157.4994 4.040446 -5.414139      6.106685 
1 1 1 13  29 4  o 91.58527 2.776695 102.7324       6.189963 91.76028       8.691318 114.0266       8.817916 86.27303 4.146174 96.28816 3.765260 -10.01513      5.600709 
1 1 1 13  29 5  o 83.40598 2.736167 85.22749       5.553769 86.33559       7.878615 84.13300       7.830039 83.71908 3.872285 82.63573 3.899300 1.083344       5.495373 
1 1 1 13  29 6  o 50.62024 3.077253 31.52375       3.778044 27.73318       5.003155 36.55308       5.762970 47.22159 4.398355 54.26769 4.395406 -7.046101      6.218128 
1 1 1 13  29 7  o 8.923000 4.210264 -2.664931      2.388432 -4.108139      2.630794 4.102945       5.697031 8.619548 4.160891 20.99038 8.011386 -12.37084      9.027475 
1 1 1 13  29 8  o 68.91718 2.632693 58.25520       4.413311 60.74576       6.181097 55.66509       6.303430 70.17197 3.626954 67.10714 3.870963 3.064835       5.304634 
1 1 1 13  29 9  o 72.11164 3.486296 64.13480       6.108254 49.88254       10.39151 71.65909       7.550398 62.42493 6.948640 76.06522 4.088334 -13.64028      8.062138 
1 1 1 13  29 10 o 8.459805 4.072748 -3.700671      2.480062 4.572097       5.815616 -5.539561      2.741879 21.43826 8.114955 8.137667 3.997467 13.30060       9.046117 
1 1 1 13  29 11 o 54.81388 2.792735 36.98645       3.718114 48.45501       9.609397 34.96718       4.032175 61.47776 6.513142 53.22409 3.122533 8.253674       7.222965 
1 1 1 13  29 12 o 27.18377 3.660056 9.294188       2.363015 13.23891       6.270382 8.641234       2.551100 31.25189 8.150239 26.07803 4.153558 5.173861       9.147593 
1 1 1 13  29 13 o 24.43544 3.534214 7.533508       2.043448 10.93457       7.215726 7.236965       2.130672 28.48170 9.159962 23.88101 3.787498 4.600691       9.912116 
1 1 1 13  29 14 o 56.46003 5.143989 40.58367       6.999818 39.43456       9.266952 42.11037       10.68155 54.60163 7.135118 55.85483 8.082274 -1.253193      10.78114 
1 1 1 13  29 15 o 42.90007 6.090117 24.13298       6.188076 25.19682       8.305165 22.80533       9.277942 42.65097 8.289371 39.69971 9.679030 2.951260       12.74352 
1 1 1 13  29 16 o 26.51937 7.701278 9.767731       5.270002 8.592710       6.864940 11.45384       8.223504 25.37745 8.936544 28.46665 9.795721 -3.089195      13.25964 
1 1 1 13  29 17 o 33.48471 10.30548 17.29022       9.230330 0.000000       0.000000 17.29022       9.230330 ?        ?        33.48471 10.30548 0.000000       10.30548 
1 1 1 13  29 18 o 50.80299 5.433266 33.98127       6.622135 38.10237       9.025870 29.17659       9.745730 52.37419 7.267455 43.97539 9.380530 8.398800       11.86635 
1 1 1 13  29 19 o 17.65221 7.216929 2.660711       4.924813 -1.782405      6.280292 9.755810       7.936248 16.06670 7.311562 25.70956 9.531239 -9.642860      12.01264 
1 1 1 13  29 20 o 28.15668 10.24255 13.31292       9.095618 0.000000       0.000000 13.31292       9.095618 ?        ?        28.15668 10.24255 0.000000       10.24255 
1 1 1 13  29 21 o 24.14139 9.607277 9.056553       8.472001 0.000000       0.000000 9.056553       8.472001 ?        ?        24.14139 9.607277 0.000000       9.607277 
1 1 1 13  29 22 o 22.96389 7.858205 8.270476       5.290112 4.020671       6.781367 14.87720       8.455239 19.43582 8.244675 28.43265 9.924881 -8.996826      12.90263 
1 1 1 13  29 23 o 13.84555 6.364159 -1.433533      4.917770 -6.499660      6.237943 6.885727       7.993660 13.17196 6.370337 21.54697 9.035162 -8.375016      11.05511 
1 1 1 13  29 24 o 11.10804 5.427950 -6.728996      4.856304 -4.467910      6.104539 -10.62652      8.014723 13.62238 6.513469 13.64853 6.729753 -0.2615166E-01 9.365622 
1 1 1 13  29 25 o 17.29435 7.485036 3.305893       5.800159 6.824419       7.898848 -0.8113199     8.544467 20.34794 8.770412 16.86115 7.958113 3.486790       11.84279 
1 1 1 13  29 26 o 10.48077 5.203448 -8.844182      5.100261 -7.663920      7.230972 -10.01269      7.194879 13.20180 6.486441 12.53468 6.215740 0.6671209      8.983837 
1 1 1 13  29 27 o 14.05290 6.759899 -2.981562      6.799976 -2.981562      6.799976 0.000000       0.000000 14.05290 6.759899 ?        ?        0.000000       6.759899 
1 1 1 13  29 28 o 13.34146 6.285237 -1.066030      5.285129 0.6429615E-01  7.407992 -2.237751      7.542422 15.31767 7.282302 14.56109 7.033033 0.7565861      10.12401 
1 1 1 13  29 29 o 14.53886 6.692561 1.394319       5.466010 0.9453142      8.068267 1.775216       7.431184 15.59558 7.465367 15.66626 7.402431 -0.7067966E-01 10.51322 
1 1 1 13  30 0  o 31.86094 6.087562 13.03592       4.554211 16.16677       6.293277 9.593677       6.598835 35.20785 7.560844 27.55750 8.748738 7.650349       11.56316 
1 1 1 13  30 1  o 100.0628 3.703959 123.1874       9.016228 133.3112       14.59932 116.9455       11.46360 103.3789 5.818635 97.15279 4.857462 6.226112       7.579673 
1 1 1 13  30 2  o 25.53275 6.110070 8.449000       3.750873 11.88283       4.654528 2.088632       6.334719 30.27342 6.503284 19.95401 8.174644 10.31941       10.44593 
1 1 1 13  30 3  o 42.90390 3.931279 22.84505       4.064596 17.77810       4.910917 33.86517       7.242402 37.43267 5.551617 51.82512 5.835982 -14.39245      8.054758 
1 1 1 13  30 4  o 78.70918 3.099765 76.11443       5.933898 78.62770       7.616127 72.23209       9.465898 79.80176 3.928461 76.12309 5.132816 3.678673       6.463637 
1 1 1 13  30 5  o 50.31641 3.320449 31.23580       4.048631 34.25688       5.494325 27.64643       5.988841 52.48243 4.334617 46.85014 5.340880 5.632294       6.878510 
1 1 1 13  30 6  o 79.96774 2.499064 78.38516       4.864014 79.58809       7.375856 77.45949       6.470275 80.27306 3.781193 79.30402 3.355630 0.9690323      5.055460 
1 1 1 13  30 7  o 61.63594 2.583221 46.63547       3.871397 41.52695       5.527542 51.55421       5.423894 57.86370 3.943602 64.62521 3.456656 -6.761501      5.244089 
1 1 1 13  30 8  o 16.96411 5.332508 3.573749       2.457102 2.309030       2.876652 6.985870       4.725006 15.35538 5.729526 23.40101 7.399883 -8.045633      9.358726 
1 1 1 13  30 9  o 23.02704 5.735269 6.934428       3.206135 4.568730       5.714974 8.020931       3.873025 21.24429 8.043773 24.68437 6.389455 -3.440081      10.27265 
1 1 1 13  30 10 f 41.56155 4.201718 21.67439       4.197158 28.06689       7.725728 18.99768       4.999248 46.25350 7.079080 38.48716 5.485380 7.766346       8.955599 
1 1 1 13  30 11 f 13.49119 5.189375 1.591973       2.402872 5.252341       5.225392 0.6103992      2.705939 21.40123 7.766553 12.74225 5.293290 8.658974       9.398844 
1 1 1 13  30 12 o 15.88442 5.241791 3.080920       2.355133 9.426302       6.682845 2.181094       2.516587 26.59836 8.831816 14.54725 5.371891 12.05111       10.33722 
1 1 1 13  30 13 o 40.95114 2.875534 20.79583       2.851355 30.54609       8.129148 19.42797       3.044802 47.75929 7.209033 39.49438 3.190788 8.264912       7.883608 
1 1 1 13  30 14 o 30.64181 7.387075 12.97293       5.451090 10.26247       6.908885 17.44281       8.872259 27.17588 8.978351 34.31482 10.00043 -7.138943      13.43947 
1 1 1 13  30 15 o 32.33255 7.017743 14.41726       5.370313 12.92307       6.969253 16.60136       8.425969 29.80831 8.909805 33.25597 9.760704 -3.447662      13.21575 
1 1 1 13  30 16 o 36.16077 6.727104 17.97123       5.709802 14.46378       7.268711 23.62306       9.226896 31.09206 9.048983 39.37440 9.684387 -8.282341      13.25411 
1 1 1 13  30 17 o 66.72845 4.916173 57.89383       7.938059 53.52356       10.48358 63.76643       12.15265 62.16281 7.044631 67.32797 7.536094 -5.165161      10.31598 
1 1 1 13  30 18 o 40.84567 10.09114 27.23315       9.985024 0.000000       0.000000 27.23315       9.985024 ?        ?        40.84567 10.09114 0.000000       10.09114 
1 1 1 13  30 19 o 16.32329 7.593367 -3.043453      7.315893 0.000000       0.000000 -3.043453      7.315893 ?        ?        16.32329 7.593367 0.000000       7.593367 
1 1 1 13  30 20 o 31.91479 7.072517 15.17952       5.355786 18.35949       7.385740 11.65287       7.777920 33.35875 8.914980 26.18041 9.479056 7.178339       13.01266 
1 1 1 13  30 21 o 19.21491 7.408515 5.001164       4.905584 6.825220       6.139124 1.779266       8.159121 21.40331 8.278301 18.90597 8.493711 2.497347       11.86058 
1 1 1 13  30 22 o 19.62744 7.619270 5.560852       5.214935 4.899764       6.645127 6.620778       8.414176 19.60938 8.231254 21.39278 9.132934 -1.783400      12.29488 
1 1 1 13  30 23 f 22.00483 7.992197 8.185324       5.534972 6.135660       7.302803 10.95216       8.484764 20.29477 8.579964 23.74135 9.557753 -3.446579      12.84392 
1 1 1 13  30 24 o 23.96008 8.447456 10.80329       6.135437 -0.2386052     8.208613 24.78071       9.235520 16.83843 7.901360 33.92020 10.28308 -17.08178      12.96816 
1 1 1 13  30 25 o 22.13136 9.072482 10.54776       7.808988 10.54776       7.808988 0.000000       0.000000 22.13136 9.072482 ?        ?        0.000000       9.072482 
1 1 1 13  30 26 o 17.84002 7.537210 5.220697       5.629513 8.029690       7.405904 1.376295       8.663976 19.84534 8.522271 16.79744 7.953577 3.047901       11.65712 
1 1 1 13  30 27 o 15.34589 6.932351 2.192858       5.521196 4.746525       7.360767 -1.092118      8.348472 17.44496 7.929703 15.41878 7.435381 2.026183       10.87038 
1 1 1 13  30 28 o 11.54430 5.655171 -5.277133      5.369990 -9.143144      7.555174 -1.329962      7.634066 12.45557 6.208280 14.68319 7.087969 -2.227618      9.422422 
1 1 1 13  31 0  o 70.36191 2.968554 60.82975       5.078574 54.23859       7.028265 68.03168       7.346689 66.10138 4.388005 74.14978 4.081540 -8.048401      5.992792 
1 1 1 13  31 1  o 10.97778 5.008563 -1.857266      2.971179 -2.509649      3.873723 -0.9250329     4.630624 12.43440 5.690481 15.00006 6.586094 -2.565663      8.703918 
1 1 1 13  31 2  o 66.78802 3.537088 55.04949       5.736265 67.64697       10.49287 49.67979       6.850580 73.25749 5.928286 63.19239 4.477631 10.06510       7.429249 
1 1 1 13  31 3  o 65.01547 3.039331 52.01754       4.802056 58.07290       6.722401 45.70805       6.862016 68.44878 4.048242 60.51543 4.689752 7.933350       6.195323 
1 1 1 13  31 4  o 110.1247 2.802838 148.9038       7.515639 150.3603       10.95043 147.6068       10.33379 110.1915 4.085070 109.2594 3.887384 0.9320984      5.639109 
1 1 1 13  31 5  o 52.95735 3.002827 34.57364       3.859308 38.44720       5.797530 31.49122       5.171698 55.52086 4.318948 50.23157 4.265230 5.289295       6.070049 
1 1 1 13  31 6  o 35.81274 3.470605 15.96268       2.990934 18.03070       4.125847 13.67222       4.342072 37.80822 4.570737 32.53443 5.683417 5.273785       7.293344 
1 1 1 13  31 7  o 25.58875 4.295408 8.348543       2.583672 9.463013       3.352895 6.719414       4.053812 27.02313 5.280936 22.71453 6.796644 4.308605       8.607128 
1 1 1 13  31 8  o 30.32984 3.731901 11.55728       2.700180 15.39737       3.599538 6.615623       4.083311 34.91234 4.323183 22.52906 6.839128 12.38328       8.090957 
1 1 1 13  31 9  o 42.43731 4.242588 22.66668       4.328723 23.36971       7.286659 22.28326       5.381175 41.81179 7.423345 41.65898 5.429779 0.1528053      9.197204 
1 1 1 13  31 10 o 46.50412 3.330443 26.90102       3.749252 49.45438       8.511484 21.47136       4.176249 62.05418 5.691914 41.25709 4.212927 20.79710       7.081429 
1 1 1 13  31 11 o 31.50791 5.270045 12.92102       3.903617 19.86690       7.530319 10.36859       4.564852 37.71497 8.408024 27.65426 6.817693 10.06071       10.82478 
1 1 1 13  31 12 o 34.57832 3.610092 15.05113       2.997232 24.03287       7.452991 13.31831       3.273613 41.87680 7.582415 32.29889 4.263135 9.577919       8.698698 
1 1 1 13  31 13 o 34.57070 3.232753 14.98285       2.691850 27.45881       8.202752 13.47714       2.849662 44.39427 7.870348 32.64697 3.643970 11.74731       8.672998 
1 1 1 13  31 14 o 13.82269 4.530275 2.367197       1.760316 7.179852       5.644722 1.848739       1.852709 23.13497 8.106925 12.89284 4.631788 10.24213       9.336793 
1 1 1 13  31 15 o 10.35326 5.036164 -6.399425      4.048549 -4.931420      5.047637 -9.047090      6.778850 12.76125 6.050774 13.64160 6.607850 -0.8803587     8.959662 
1 1 1 13  31 16 o 15.28005 5.279715 2.888692       2.389814 0.000000       0.000000 2.888692       2.389814 ?        ?        15.28005 5.279715 0.000000       5.279715 
1 1 1 13  31 17 o 16.09079 6.895563 1.197064       4.829743 -2.076026      6.261810 6.003802       7.588329 15.69700 7.202710 22.10086 8.987448 -6.403867      11.51752 
1 1 1 13  31 18 o 20.16663 7.299408 5.653490       4.611745 5.776993       5.849592 5.450648       7.496592 20.77304 8.068036 21.27346 8.821520 -0.5004196     11.95460 
1 1 1 13  31 19 o 22.73876 9.257718 7.641447       8.062815 0.000000       0.000000 7.641447       8.062815 ?        ?        22.73876 9.257718 0.000000       9.257718 
1 1 1 13  31 20 o 17.64022 7.383273 3.125466       5.322868 2.681405       6.814023 3.820657       8.525782 18.41062 8.038724 20.11082 8.879202 -1.700197      11.97753 
1 1 1 13  31 21 o 17.89887 7.327832 3.884859       5.086020 3.006044       6.781478 5.014674       7.689166 18.29432 8.003024 20.03684 8.644886 -1.742527      11.78060 
1 1 1 13  31 22 o 17.31247 7.440692 3.116043       5.654156 10.62644       8.426755 -3.034032      7.625516 23.34616 9.479409 15.59212 7.405788 7.754037       12.02934 
1 1 1 13  31 23 o 16.86441 7.796896 0.9101443      7.535410 0.9101443      7.535410 0.000000       0.000000 16.86441 7.796896 ?        ?        0.000000       7.796896 
1 1 1 13  31 24 o 23.15502 8.266474 10.53254       5.891506 19.19508       8.398638 2.140176       8.266625 28.69463 9.898441 17.34045 8.068279 11.35418       12.77013 
1 1 1 13  31 25 f 15.22827 6.945066 1.329142       5.705586 4.328632       7.733232 -2.254256      8.452491 17.75462 8.092719 15.44412 7.456021 2.310493       11.00383 
1 1 1 13  31 26 o 15.43587 7.354966 -0.6579227E-01 7.642916 -0.6579227E-01 7.642916 0.000000       0.000000 15.43587 7.354966 ?        ?        0.000000       7.354966 
1 1 1 13  32 0  f 63.87090 3.147880 50.30172       4.884468 54.54429       6.921911 46.09387       6.893538 66.17929 4.315621 60.69065 4.697599 5.488644       6.379030 
1 1 1 13  32 1  o 20.25281 6.049962 5.259551       3.214076 7.603156       4.232237 2.066256       4.940230 24.08590 6.872991 17.94416 7.268306 6.141739       10.00331 
1 1 1 13  32 2  o 58.85174 3.118763 42.74657       4.456814 43.08872       6.052405 42.34127       6.587286 58.76781 4.255040 58.10747 4.691852 0.6603355      6.333943 
1 1 1 13  32 3  o 83.18130 3.290693 85.43517       6.657195 89.71788       12.04167 83.55003       7.989114 84.02645 5.918642 81.99466 4.010480 2.031792       7.149425 
1 1 1 13  32 4  o 37.32590 3.985699 17.47040       3.569324 18.66903       4.800466 15.98845       5.337746 38.20388 5.298785 34.88975 6.517647 3.314129       8.399812 
1 1 1 13  32 5  f 57.92469 2.821454 41.37537       3.970675 42.10027       5.751426 40.71522       5.488558 58.05404 4.091643 57.12877 3.967104 0.9252739      5.699075 
1 1 1 13  32 6  o 13.48697 5.269062 1.473817       2.506590 1.904259       3.287470 0.8760743      3.874018 15.32379 6.020129 15.11477 6.310522 0.2090178      8.721504 
1 1 1 13  32 7  o 32.43031 3.716015 13.22414       2.883757 18.75473       3.957144 6.960604       4.211198 38.51707 4.288567 22.94481 6.941225 15.57226       8.159192 
1 1 1 13  32 8  o 47.41194 2.904948 27.84171       3.340199 34.97363       4.813174 21.21622       4.639141 52.88333 3.759392 40.78348 4.757076 12.09985       6.063234 
1 1 1 13  32 9  o 16.24465 5.764380 3.037565       2.860700 -1.721916      4.926866 5.458246       3.513660 14.63021 6.584203 20.43218 6.370049 -5.801965      9.161291 
1 1 1 13  32 10 o 16.25088 6.139275 2.704717       3.324759 10.22663       6.189255 -0.3462426     3.941781 27.02056 8.458963 13.96548 6.105607 13.05508       10.43228 
1 1 1 13  32 11 o 34.04314 4.038226 14.76611       3.284908 22.76383       7.434381 12.82588       3.661749 40.30400 7.851764 31.35231 4.957360 8.951689       9.285774 
1 1 1 13  32 12 o 58.13924 3.751287 42.63284       5.286419 46.74040       9.310457 40.67857       6.422019 58.88720 6.601562 56.22860 4.730649 2.658600       8.121555 
1 1 1 13  32 13 o 25.93912 5.466314 9.076846       3.346140 0.000000       0.000000 9.076846       3.346140 ?        ?        25.93912 5.466314 0.000000       5.466314 
1 1 1 13  32 14 o 14.12973 4.984022 2.371668       2.135961 0.000000       0.000000 2.371668       2.135961 ?        ?        14.12973 4.984022 0.000000       4.984022 
1 1 1 13  32 15 o 12.99277 4.562068 2.004348       1.788126 10.69962       6.506195 1.293897       1.859742 26.33160 8.713299 11.79521 4.557879 14.53640       9.833405 
1 1 1 13  32 16 o 17.06265 7.045720 2.544545       4.754689 5.005931       6.075204 -1.346414      7.638346 20.28538 8.114617 17.41576 7.977855 2.869619       11.37951 
1 1 1 13  32 17 o 12.15592 5.772253 -4.159464      4.626797 -10.99964      5.916769 6.606679       7.423030 11.50379 5.692454 21.95126 8.902853 -10.44747      10.56716 
1 1 1 13  32 18 o 19.42585 7.529091 5.068120       5.086087 1.679506       7.022345 8.806973       7.376329 18.10031 8.021698 23.40576 9.068376 -5.305449      12.10715 
1 1 1 13  32 19 f 53.13032 5.603928 39.60510       7.146395 40.25285       10.02454 38.93571       10.19057 49.52428 8.619260 48.10437 9.024570 1.419907       12.47936 
1 1 1 13  32 20 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 13  32 21 o 22.94453 9.085965 10.07123       7.541986 10.07123       7.541986 0.000000       0.000000 22.94453 9.085965 ?        ?        0.000000       9.085965 
1 1 1 13  32 22 f 20.50521 8.129086 7.459811       6.043392 19.62108       8.700484 -3.877810      8.400690 29.49607 10.07814 15.49633 7.469227 13.99974       12.54425 
1 1 1 13  32 23 o 12.63473 6.068178 -3.767919      5.430298 -4.900112      7.413226 -2.456998      7.976921 14.11692 6.854941 15.35338 7.368869 -1.236467      10.06432 
1 1 1 13  32 24 o 14.87408 6.844454 0.7058551      5.709874 -6.614821      7.708728 9.604335       8.498946 13.63101 6.697317 20.61239 8.989326 -6.981381      11.20991 
1 1 1 13  32 25 o 16.56752 7.357563 3.791167       5.938067 11.16729       8.529530 -3.145919      8.271792 20.94506 9.070955 14.76745 7.186823 6.177607       11.57293 
1 1 1 13  33 0  o 95.77392 3.238423 113.3495       7.547303 107.1075       9.582507 123.5483       12.24872 92.62547 4.256722 98.98831 5.094884 -6.362846      6.639091 
1 1 1 13  33 1  o 75.93631 3.004224 71.18430       5.548302 82.83025       7.878560 59.72612       7.814795 81.53136 3.977393 68.90019 4.682189 12.63116       6.143496 
1 1 1 13  33 2  o 52.08791 3.320369 33.67711       4.192687 36.72895       5.649442 29.93540       6.255473 54.06957 4.323621 48.36509 5.399529 5.704483       6.917270 
1 1 1 13  33 3  o 72.36150 3.003315 64.71518       5.284447 73.84193       7.534180 55.87740       7.413944 76.87472 4.035899 66.59394 4.596755 10.28078       6.117078 
1 1 1 13  33 4  o 10.74525 5.003748 -2.699382      3.189837 -3.482975      4.315379 -1.755533      4.736146 12.51076 5.823902 14.35251 6.457684 -1.841749      8.695949 
1 1 1 13  33 5  o 17.34463 5.565167 3.793279       2.664572 4.208819       3.484955 3.208476       4.134238 18.58124 6.377474 17.90061 6.826469 0.6806335      9.341994 
1 1 1 13  33 6  o 38.60526 3.353297 18.63101       3.123413 20.46858       4.267054 16.51001       4.584340 40.11131 4.439644 35.58668 5.460395 4.524624       7.037496 
1 1 1 13  33 7  f 20.04646 5.117832 5.317338       2.508383 3.283700       3.175627 8.691156       4.090284 16.89311 6.064609 25.27447 6.578316 -8.381361      8.947275 
1 1 1 13  33 8  o 37.57270 3.300287 17.69214       2.991090 17.68480       4.107219 17.70044       4.364583 37.07233 4.648245 36.95124 4.973198 0.1210823      6.807267 
1 1 1 13  33 9  o 70.83810 3.002122 62.41409       5.170654 68.79688       11.28623 60.71851       5.817039 71.75819 6.525478 69.64718 3.438006 2.111008       7.375755 
1 1 1 13  33 10 o 13.10222 5.704818 -0.1318462     3.411159 0.000000       0.000000 -0.1318462     3.411159 ?        ?        13.10222 5.704818 0.000000       5.704818 
1 1 1 13  33 11 o 22.49214 7.039248 7.048316       4.286366 0.000000       0.000000 7.048316       4.286366 ?        ?        22.49214 7.039248 0.000000       7.039248 
1 1 1 13  33 12 o 23.25279 5.408895 7.374628       3.006936 0.000000       0.000000 7.374628       3.006936 ?        ?        23.25279 5.408895 0.000000       5.408895 
1 1 1 13  33 13 o 16.76113 5.357135 3.726487       2.470865 8.915359       7.054840 3.000996       2.637949 24.49863 9.003300 15.62278 5.536219 8.875853       10.56925 
1 1 1 13  33 14 o 42.27111 5.449252 24.24478       5.482830 0.000000       0.000000 24.24478       5.482830 ?        ?        42.27111 5.449252 0.000000       5.449252 
1 1 1 13  33 15 o 19.23098 4.634727 5.038538       2.146306 12.80400       6.723832 4.157511       2.264790 27.95518 8.825763 17.41391 5.046128 10.54127       10.16649 
1 1 1 13  33 16 o 17.48865 4.642029 4.191240       2.011035 15.28271       7.519174 3.336723       2.087066 29.72638 9.326127 15.71756 4.910841 14.00883       10.54007 
1 1 1 13  33 17 o 13.35170 4.541571 2.278118       1.766502 3.933223       6.851408 2.160257       1.828318 19.27824 8.236041 13.17036 4.613918 6.107878       9.440372 
1 1 1 13  33 18 o 14.75539 6.739054 -0.8030792     5.397025 10.67297       7.615194 -12.38432      7.650016 24.30380 9.265704 12.97190 6.428475 11.33191       11.27735 
1 1 1 13  33 19 o 39.31533 9.765067 29.17149       9.313353 29.17149       9.313353 0.000000       0.000000 39.31533 9.765067 ?        ?        0.000000       9.765067 
1 1 1 13  33 20 o 24.96520 8.185296 11.29731       5.746352 13.32702       8.729223 9.745104       7.633656 24.76332 9.784812 22.46069 9.057417 2.302633       13.33339 
1 1 1 13  33 21 o 13.58825 6.653327 -7.123936      7.406685 0.000000       0.000000 -7.123936      7.406685 ?        ?        13.58825 6.653327 0.000000       6.653327 
1 1 1 13  33 22 o 17.98939 7.553977 5.097251       5.599724 3.317225       7.386839 7.502240       8.586219 17.41773 7.927625 19.84895 8.829180 -2.431215      11.86599 
1 1 1 13  33 23 o 29.69218 8.656489 18.00806       6.646730 13.92005       9.134343 22.60859       9.690042 22.85799 9.626043 28.44669 10.53445 -5.588705      14.27009 
1 1 1 13  33 24 o 17.80566 7.692522 5.540564       6.104340 16.45242       8.664712 -5.212210      8.601318 24.41409 9.715887 14.40464 7.076828 10.00945       12.01998 
1 1 1 13  34 0  o 56.21045 3.571240 39.43255       4.866545 40.04772       6.093183 38.34882       8.087360 56.27160 4.480406 54.14639 6.243346 2.125202       7.684622 
1 1 1 13  34 1  o 25.12361 5.597574 8.376151       3.339271 7.377491       4.321085 9.856769       5.261449 23.42083 7.019254 26.75118 7.672812 -3.330347      10.39913 
1 1 1 13  34 2  o 26.75792 4.954085 9.347069       3.111425 9.351159       3.958857 9.340461       5.032206 26.34067 6.260183 26.05372 7.513459 0.2869473      9.779671 
1 1 1 13  34 3  o 60.27436 3.168491 45.18708       4.637599 48.59034       6.329662 41.24279       6.814223 62.03267 4.212186 56.73239 4.979348 5.300282       6.521995 
1 1 1 13  34 4  o 72.88387 3.181170 66.08952       5.636469 66.49534       7.241494 65.46576       8.977817 72.61060 4.109304 71.32533 5.200988 1.285271       6.628473 
1 1 1 13  34 5  o 40.74451 5.022450 21.52026       4.881360 0.000000       0.000000 21.52026       4.881360 ?        ?        40.74451 5.022450 0.000000       5.022450 
1 1 1 13  34 6  o 26.27015 5.286796 9.179195       3.267171 2.202992       4.434246 17.46421       4.832334 16.93915 6.876959 36.30476 5.645465 -19.36561      8.897407 
1 1 1 13  34 7  f 22.70028 5.716489 6.993689       3.159912 8.923339       4.584956 5.247924       4.361028 25.20507 7.140851 20.24215 7.123172 4.962915       10.08619 
1 1 1 13  34 8  o 21.97854 4.998025 6.469329       2.616197 1.832546       3.393720 13.26099       4.107292 15.07265 6.052766 31.44089 5.564311 -16.36824      8.221772 
1 1 1 13  34 9  o 34.80725 4.212292 15.65358       3.500328 22.92199       8.203142 14.03555       3.870373 38.93518 8.847407 32.54348 5.043442 6.391693       10.18395 
1 1 1 13  34 10 o 23.68277 5.432538 7.671298       3.068449 13.38879       6.944855 6.284424       3.420415 29.33036 8.922357 21.23485 6.215128 8.095514       10.87365 
1 1 1 13  34 11 o 24.27043 5.285440 8.059247       3.037278 12.41057       7.569089 7.224121       3.315958 27.75995 9.401409 22.69627 5.930794 5.063688       11.11579 
1 1 1 13  34 12 o 28.28703 5.325254 10.95041       3.536167 12.23984       6.671254 10.44657       4.170206 27.64424 8.798993 26.97264 6.434758 0.6715965      10.90084 
1 1 1 13  34 13 f 15.17114 5.419869 2.856850       2.533015 7.230590       6.334918 2.024503       2.763547 22.28038 8.461261 14.17570 5.534163 8.104683       10.11039 
1 1 1 13  34 14 o 11.58838 4.802157 0.7824965      2.219440 7.617960       6.660372 -0.7134420E-01 2.353981 22.47457 8.641029 10.82833 4.726494 11.64624       9.849220 
1 1 1 13  34 15 o 30.00720 5.094159 12.41636       3.592005 24.92843       8.214510 9.458320       3.994101 38.68610 8.898952 25.22639 6.467406 13.45971       11.00085 
1 1 1 13  34 16 o 18.33845 4.927022 4.723698       2.248543 3.733284       6.275894 4.869557       2.408431 18.61510 7.915336 18.54173 5.147946 0.7336617E-01  9.442134 
1 1 1 13  34 17 o 9.685672 4.212290 0.1327982E-01  1.855183 5.226674       6.604671 -0.4332846     1.933005 19.57654 8.211084 9.347233 4.171508 10.22931       9.209961 
1 1 1 13  34 18 o 19.59877 4.283606 5.324988       1.988602 11.24789       8.091722 4.944270       2.051519 23.75829 9.410307 18.74404 4.539965 5.014257       10.44821 
1 1 1 13  34 19 o 30.16885 8.223987 16.41666       6.210632 16.91166       8.352500 15.80454       9.288135 27.63377 9.845197 25.85140 10.13007 1.782368       14.12609 
1 1 1 13  34 20 o 29.96016 8.569106 17.22696       6.571381 23.13226       9.339827 11.43779       9.247533 31.04064 10.44342 22.33679 9.556221 8.703857       14.15579 
1 1 1 13  34 21 f 21.68593 8.364191 9.549404       6.254404 8.045188       8.757416 11.11538       8.935394 20.04262 8.915961 21.73013 9.346745 -1.687511      12.91728 
1 1 1 13  34 22 o 25.18694 10.18013 18.28575       9.667958 0.000000       0.000000 18.28575       9.667958 ?        ?        25.18694 10.18013 0.000000       10.18013 
1 1 1 13  35 0  o 28.73977 5.737184 11.05863       3.877260 10.04390       6.004695 11.78424       5.077692 26.60350 8.332399 29.05511 7.206658 -2.451609      11.01657 
1 1 1 13  35 1  o 60.64153 4.010392 46.51828       5.893156 47.09856       9.025361 46.08700       7.780805 59.44532 6.327446 59.46579 5.429166 -0.2047348E-01 8.337411 
1 1 1 13  35 2  o 17.02962 6.685304 2.747824       4.051486 0.3095060      4.939089 7.763304       7.083663 15.91368 6.897251 24.27926 9.004033 -8.365585      11.34216 
1 1 1 13  35 3  o 46.03657 4.393950 27.18263       4.869672 22.36475       6.913458 31.92680       6.860361 39.98265 7.366939 49.01920 5.858966 -9.036552      9.412719 
1 1 1 13  35 4  o 34.62396 4.201947 15.42427       3.472904 17.03367       4.829277 13.70050       4.997921 35.63655 5.757154 31.36899 6.739133 4.267561       8.863450 
1 1 1 13  35 5  o 44.45439 3.493980 24.97217       3.754646 23.46596       5.168635 26.65505       5.463356 42.23533 5.126707 45.08482 5.059930 -2.849491      7.203194 
1 1 1 13  35 6  o 34.17096 4.681957 15.29896       3.796299 30.83362       7.961654 10.72767       4.318888 46.78040 7.215760 27.63969 6.518668 19.14071       9.724208 
1 1 1 13  35 7  o 35.41113 3.628332 16.00833       3.086773 17.51376       4.553201 14.72801       4.198993 36.16092 5.326403 33.07373 5.395713 3.087185       7.581839 
1 1 1 13  35 8  o 29.90997 3.883210 11.57168       2.763618 12.26986       3.976214 10.91921       3.843839 29.90644 5.663228 28.09490 5.806437 1.811535       8.110909 
1 1 1 13  35 9  o 13.88337 5.561197 1.645849       2.857363 5.057443       6.230210 0.7371014      3.215479 20.53891 8.216997 13.39379 5.679260 7.145126       9.988646 
1 1 1 13  35 10 o 15.85502 5.765153 3.079958       2.881209 -0.5550324E-01 6.787900 3.769016       3.182090 17.25612 7.750272 17.09317 6.078139 0.1629524      9.849391 
1 1 1 13  35 11 o 34.06776 4.152925 15.21986       3.376569 20.39694       7.501842 13.90458       3.781241 35.65395 8.710011 32.04897 5.005090 3.604984       10.04566 
1 1 1 13  35 12 o 10.99876 4.874492 -0.3850231     2.593112 0.7302034      6.485157 -0.5972620     2.829120 17.16432 7.651722 11.27395 5.037950 5.890368       9.161320 
1 1 1 13  35 13 o 23.51380 6.651851 8.303519       3.981501 6.665637       8.164051 8.814633       4.560614 21.80947 9.137136 23.88151 7.223211 -2.072041      11.64741 
1 1 1 13  35 14 o 18.55165 5.676688 4.948485       2.805793 26.27362       8.690581 2.467003       2.964548 38.74269 9.319217 14.77440 5.742101 23.96828       10.94621 
1 1 1 13  35 15 f 10.33926 4.544983 -0.1190652     2.211094 -8.528310      6.851610 0.8585031      2.336080 13.09390 6.408731 11.74358 4.901495 1.350322       8.068238 
1 1 1 13  35 16 o 9.351791 4.417427 -2.295216      2.642556 0.2726192      6.004735 -2.911974      2.942847 15.73205 7.155406 9.582187 4.565242 6.149859       8.487713 
1 1 1 13  35 17 o 12.10248 4.775379 1.506031       2.076511 8.104050       7.317180 0.9281222      2.165541 21.17671 8.742127 11.40867 4.736974 9.768037       9.943024 
1 1 1 13  35 18 o 28.31095 3.657362 10.74364       2.464342 11.84205       8.988000 10.65435       2.562544 22.96192 9.601249 28.05960 3.848924 -5.097675      10.34399 
1 1 1 13  35 19 o 12.13249 4.496653 1.821000       1.766212 2.990501       6.456403 1.726401       1.836256 16.95481 7.591126 12.03788 4.559159 4.916928       8.855006 
1 1 1 13  35 20 o 25.55549 8.553223 13.49592       6.265579 13.73873       8.539423 13.21277       9.221578 23.45698 9.535857 22.69439 9.620088 0.7625904      13.54543 
1 1 1 13  36 0  o 25.22416 5.167706 8.548345       3.069616 8.019524       3.995239 9.310317       4.795768 23.88679 6.629782 25.45864 7.332675 -1.571848      9.885450 
1 1 1 13  36 1  o 13.27484 5.417900 1.176797       2.769645 1.990529       3.611872 0.1541041E-01  4.314993 15.47475 6.233782 14.60471 6.386524 0.8700428      8.924558 
1 1 1 13  36 2  o 23.14974 5.531200 7.341804       3.077577 9.591483       4.267949 4.904932       4.441967 25.98366 6.697892 19.60614 7.153912 6.377520       9.800012 
1 1 1 13  36 3  f 19.55333 6.457131 5.192306       3.573630 7.722136       4.335377 -0.1703251     6.312047 23.21730 7.046853 16.97880 7.560234 6.238503       10.33515 
1 1 1 13  36 4  o 45.98018 3.236615 26.70134       3.603415 34.41370       5.716385 21.61604       4.641794 51.33240 4.619114 40.50029 4.796157 10.83211       6.658779 
1 1 1 13  36 5  o 16.19966 5.568344 3.357175       2.657044 3.930950       3.732136 2.767452       3.783649 17.79045 6.546659 16.41338 6.455365 1.377068       9.194046 
1 1 1 13  36 6  o 15.36321 5.668285 2.768932       2.800908 3.128947       3.745682 2.312291       4.218503 16.75445 6.470011 16.34603 6.680733 0.4084206      9.300174 
1 1 1 13  36 7  o 20.96152 6.000505 6.211885       3.220921 9.320972       6.956332 5.363439       3.633924 24.52782 8.952104 19.61161 6.512665 4.916212       11.07045 
1 1 1 13  36 8  o 14.56397 5.318555 2.522258       2.455888 -0.9142469     3.431235 6.131963       3.516639 12.19318 5.490435 20.69552 6.359449 -8.502337      8.401635 
1 1 1 13  36 9  o 29.77883 4.825769 11.98851       3.382201 21.43248       7.544954 9.613497       3.783660 36.53647 8.615234 25.86247 6.102646 10.67400       10.55768 
1 1 1 13  36 10 o 12.77064 5.489789 0.5076902      3.079076 11.87641       6.551167 -2.715783      3.488389 26.64534 8.739922 10.94937 5.142031 15.69597       10.14035 
1 1 1 13  36 11 o 16.29844 5.980494 3.430496       3.110929 22.26785       7.992906 0.6746037E-01  3.377228 36.11482 9.090055 12.77872 5.617207 23.33610       10.68560 
1 1 1 13  36 12 o 22.01311 5.566863 7.000825       2.987676 14.28095       8.074132 5.845871       3.215946 27.44109 9.689214 19.91911 6.074024 7.521980       11.43567 
1 1 1 13  36 13 o 33.83244 4.171281 15.34467       3.366314 29.54637       9.339328 13.22407       3.608903 40.13306 9.665327 30.80924 4.976370 9.323828       10.87119 
1 1 1 13  36 14 o 21.77962 5.265734 6.873715       2.763692 8.488123       8.052459 6.658157       2.942420 21.92715 9.121910 21.21880 5.607058 0.7083569      10.70740 
1 1 1 13  36 15 o 13.71675 5.733132 1.621513       3.202755 7.811753       7.666097 0.3125996      3.525138 21.04198 8.837330 12.87746 5.696414 8.164515       10.51416 
1 1 1 13  36 16 o 20.73076 5.143873 6.318185       2.586178 10.75861       8.463795 5.860909       2.716079 22.58923 9.370779 19.75470 5.460061 2.834522       10.84545 
1 1 1 13  36 17 o 17.97611 6.163143 5.049476       3.254414 16.65847       7.998855 2.746568       3.562614 27.22344 9.641023 15.08084 6.148605 12.14261       11.43480 
1 1 1 13  36 18 o 14.31068 5.092308 2.868937       2.233940 1.608550       8.246567 2.968754       2.320713 16.98605 7.954262 14.51524 5.187520 2.470816       9.496348 
1 1 1 13  37 0  o 31.25887 4.822882 13.01363       3.555754 15.14485       4.986256 10.80845       5.072034 32.73225 6.480577 26.96597 7.464484 5.766272       9.885159 
1 1 1 13  37 1  o 13.25115 5.473441 1.107418       2.870547 5.998726       3.927567 -4.501548      4.205838 20.64613 6.766939 11.39480 5.436844 9.251329       8.680480 
1 1 1 13  37 2  o 15.99802 5.793889 3.135066       2.906101 0.1391056      4.029537 6.382372       4.195162 14.09855 6.168270 21.16077 6.996487 -7.062220      9.327292 
1 1 1 13  37 3  o 15.65110 5.758698 2.930919       2.887650 2.372882       3.995311 3.541258       4.178345 16.11320 6.532820 17.55800 6.818943 -1.444801      9.443290 
1 1 1 13  37 4  o 37.84308 4.134462 18.69202       3.750820 21.36750       5.081434 15.48921       5.559690 39.60733 5.405634 32.29745 7.242978 7.309879       9.037787 
1 1 1 13  37 5  o 17.49356 5.503111 4.198812       2.616355 1.774370       3.644591 6.776748       3.758193 14.98501 6.176301 21.58867 6.562762 -6.603666      9.012022 
1 1 1 13  37 6  o 13.64186 5.422843 1.729405       2.696313 3.447180       3.566938 -0.5608096     4.118608 16.79770 6.355997 13.53299 6.060742 3.264704       8.782442 
1 1 1 13  37 7  o 28.93977 5.898674 11.93060       4.018640 12.98829       5.627689 10.83012       5.740418 28.67435 7.833413 25.92212 8.150953 2.752228       11.30488 
1 1 1 13  37 8  o 27.53628 6.055491 10.99707       3.952632 35.40260       8.262397 3.754161       4.501098 48.51816 7.206814 17.65556 7.010336 30.86260       10.05400 
1 1 1 13  37 9  o 11.40323 5.097226 -0.4990168     2.898354 4.996132       6.778139 -1.728597      3.206263 19.86934 8.325011 11.00035 5.085818 8.868997       9.755581 
1 1 1 13  37 10 o 17.71998 6.034943 4.487525       3.119372 12.93050       7.511338 2.727948       3.429050 26.33873 9.341162 15.48674 6.128489 10.85199       11.17209 
1 1 1 13  37 11 o 28.91382 5.677030 12.13113       3.857191 0.000000       0.000000 12.13113       3.857191 ?        ?        28.91382 5.677030 0.000000       5.677030 
1 1 1 13  37 12 o 13.18123 5.433093 1.498057       2.820411 -1.268356      6.693314 2.095304       3.109997 15.51852 7.233780 14.23806 5.766964 1.280468       9.251241 
1 1 1 13  37 13 o 11.52332 5.047225 0.2117962      2.704638 4.396156       7.098797 -0.4987511     2.925276 18.68887 8.181567 11.24631 5.066308 7.442568       9.623176 
1 1 1 13  37 14 f 15.32872 5.604259 3.247695       2.727993 11.55422       7.135655 1.825825       2.952256 23.86890 8.999146 13.59052 5.575599 10.27839       10.58640 
1 1 1 13  37 15 o 13.56155 5.409695 2.082474       2.692401 18.41082       7.751157 -0.1579463     2.871179 29.42361 9.496530 11.34743 5.072708 18.07618       10.76645 
1 1 1 13  37 16 o 31.72083 5.191740 14.74647       3.874521 24.50249       10.16146 13.08679       4.191149 30.45559 10.85819 28.88098 6.144065 1.574606       12.47597 
1 1 1 13  38 0  f 42.09249 3.919442 22.99916       3.974158 34.58921       5.863225 13.14888       5.405281 50.96426 4.776675 29.33495 7.525207 21.62931       8.913213 
1 1 1 13  38 1  o 32.17247 4.897336 13.99764       3.718569 16.72745       4.827557 10.01484       5.831164 34.45060 5.966356 25.09077 8.246507 9.359823       10.17852 
1 1 1 13  38 2  o 17.78955 6.112984 4.334844       3.202162 4.703646       4.082856 3.745425       5.161542 18.64638 6.849772 18.27592 7.419577 0.3704624      10.09799 
1 1 1 13  38 3  o 15.73755 5.860250 3.042479       3.006438 1.188630       4.077991 5.249773       4.449786 14.83754 6.346857 19.38146 7.145609 -4.543923      9.557318 
1 1 1 13  38 4  o 14.05766 5.630780 1.875868       2.929188 5.921064       4.016221 -2.721330      4.281485 20.08238 6.847598 12.27509 5.742756 7.807297       8.936936 
1 1 1 13  38 5  o 15.71854 5.881680 3.072730       3.035800 3.879851       3.784968 1.617028       5.083106 17.28894 6.546125 16.19623 7.008436 1.092716       9.590096 
1 1 1 13  38 6  o 32.52552 4.115895 14.07152       3.189378 23.10903       4.827116 7.069357       4.248928 41.09832 4.917264 21.42741 7.039179 19.67090       8.586589 
1 1 1 13  38 7  o 11.21210 4.856736 0.2176297      2.446143 0.1574252      3.359855 0.2855354      3.568281 12.72824 5.598607 13.15503 5.778552 -0.4267902     8.045873 
1 1 1 13  38 8  o 20.25850 5.577794 6.006670       2.840598 8.037631       3.760837 3.309041       4.334358 22.87792 6.462467 16.75716 6.800536 6.120764       9.381405 
1 1 1 13  38 9  o 12.13571 5.320054 0.2331032      3.010741 9.277205       6.144032 -2.624909      3.453845 22.90274 8.404505 10.73649 5.065036 12.16625       9.812762 
1 1 1 13  38 10 o 11.34421 5.115829 -0.5608544     2.991819 -5.473677      6.962024 0.5518965      3.313363 14.00798 6.763700 12.84239 5.606540 1.165594       8.785268 
1 1 1 13  38 11 o 17.11862 6.031732 4.311687       3.127721 7.151642       8.005613 3.800111       3.397769 20.59801 8.853272 16.47656 6.210336 4.121447       10.81428 
1 1 1 13  38 12 o 18.19510 6.092429 5.078345       3.178899 4.489709       8.175427 5.183196       3.450423 18.90093 8.495931 18.29813 6.342948 0.6027966      10.60254 
1 1 1 13  38 13 o 12.06421 5.224633 0.6510542      2.829442 4.410276       7.890988 0.9642309E-01  3.030990 18.53006 8.336543 11.83834 5.257013 6.691726       9.855665 
1 1 1 13  38 14 f 14.92848 5.687875 3.023989       2.868489 14.37166       7.961865 1.331348       3.074991 25.06854 9.493671 13.05274 5.544997 12.01580       10.99440 
1 1 1 13  39 0  o 16.00705 5.816945 3.338720       2.932603 4.806581       3.916452 1.465311       4.424523 18.48307 6.721439 15.35493 6.590446 3.128144       9.413380 
1 1 1 13  39 1  o 20.79720 5.791438 6.303051       3.043208 4.516582       4.178573 8.320855       4.440887 18.18784 6.879981 23.07097 7.156409 -4.883131      9.927152 
1 1 1 13  39 2  o 26.88525 5.273955 10.20239       3.331814 15.31323       4.754941 5.272503       4.670001 32.23367 6.279233 19.16858 7.268205 13.06509       9.604977 
1 1 1 13  39 3  o 20.46296 5.660567 6.116479       2.917861 2.624344       4.207366 9.352405       4.050083 16.05795 6.629025 24.69964 6.602063 -8.641699      9.355811 
1 1 1 13  39 4  o 12.76078 5.266582 1.268234       2.654749 -0.6204995     3.846590 2.986130       3.668503 12.78885 5.780909 15.92486 6.326996 -3.136013      8.570285 
1 1 1 13  39 5  o 13.19231 5.303217 1.683431       2.608130 -1.682784      3.539946 5.680399       3.857368 11.51341 5.330351 19.32151 6.706089 -7.808102      8.566463 
1 1 1 13  39 6  o 13.09386 5.527599 1.160793       3.023833 3.397601       3.870525 -2.342892      4.844155 16.41581 6.506318 13.01455 6.095093 3.401258       8.915286 
1 1 1 13  39 7  o 12.80019 5.300648 1.328546       2.701544 -1.861017      3.785428 4.639329       3.856690 11.72998 5.458467 17.81040 6.636364 -6.080422      8.592798 
1 1 1 13  39 8  o 10.83212 4.860605 -0.4373738     2.663084 0.8254169      3.884528 -1.557185      3.658011 13.79515 6.045358 11.68773 5.413657 2.107427       8.115050 
1 1 1 13  39 9  o 24.31105 6.739341 9.557617       4.131135 22.63788       8.923792 5.989785       4.660617 32.40095 10.15918 19.29529 7.273292 13.10566       12.49439 
1 1 1 13  39 10 f 14.27797 5.906534 2.085315       3.349700 18.36199       8.491426 -0.9143714     3.645320 28.64515 9.949363 12.01416 5.506398 16.63099       11.37147 
1 1 1 13  39 11 o 14.84833 5.874809 2.770039       3.150524 0.6913527      7.650447 3.194548       3.457289 16.62727 7.744956 15.56750 6.155808 1.059771       9.893348 
1 1 1 13  40 0  o 17.54732 6.667672 4.288636       3.935252 10.59107       6.452824 0.5566789      4.965510 24.22304 8.650918 14.98313 6.686351 9.239909       10.93369 
1 1 1 13  40 1  o 19.85881 6.011405 5.932904       3.157841 7.071514       4.398051 4.721262       4.536910 21.01310 7.165699 18.22862 7.098159 2.784479       10.08618 
1 1 1 13  40 2  o 22.58697 5.787972 7.610255       3.200029 8.797527       4.606639 6.503072       4.448549 23.11978 7.306052 20.22840 7.187257 2.891376       10.24866 
1 1 1 13  40 3  o 10.31028 4.779147 -1.565596      2.858663 -6.624388      4.325566 2.357157       3.809035 10.28608 5.046357 15.20886 6.295702 -4.922780      8.068556 
1 1 1 13  40 4  o 13.41323 5.407948 1.813734       2.720812 -0.6630499     3.900624 4.160772       3.797083 12.68954 5.769816 17.16665 6.543251 -4.477104      8.723812 
1 1 1 13  40 5  o 12.36109 5.283820 0.8323554      2.822745 2.708484       4.084784 -0.8824312     3.905196 15.68911 6.509303 12.50362 5.718913 3.185496       8.664698 
1 1 1 13  40 6  f 11.35935 4.993999 0.1326129      2.670294 -0.5451029     3.906699 0.7268741      3.658263 12.70566 5.776034 13.37445 5.863666 -0.6687908     8.230744 
1 1 1 13  40 7  o 14.27857 5.616390 2.443432       2.864357 0.4285781      4.139197 4.294932       3.967859 13.67745 6.104128 17.20056 6.654600 -3.523107      9.030176 
1 1 1 13  41 0  o 17.79444 6.201826 4.737598       3.300811 9.175355       4.800299 0.7572822      4.546165 23.23937 7.470888 14.48999 6.436186 8.749383       9.860967 
1 1 1 13  41 1  o 15.34397 6.293001 2.628940       3.759362 2.243711       6.457294 2.826458       4.623755 17.03415 7.611654 16.19990 6.836854 0.8342514      10.23132 
1 1 1 14  0  0  o 53.90043 3.425525 35.83440       4.457223 35.83440       4.457223 35.83440       4.457223 53.90043 3.425525 53.90043 3.425525 0.000000       0.000000 
1 1 1 14  0  1  o 434.2216 9.122153 2304.517       96.42999 2304.517       96.42999 2304.517       96.42999 434.2216 9.122153 434.2216 9.122153 0.000000       0.000000 
1 1 1 14  0  2  f 648.9717 10.86245 5149.897       171.6782 5149.897       171.6782 5149.897       171.6782 648.9717 10.86245 648.9717 10.86245 0.000000       0.000000 
1 1 1 14  0  3  o 381.0534 6.655509 1772.761       61.75959 1772.761       61.75959 1772.761       61.75959 381.0534 6.655509 381.0534 6.655509 0.000000       0.000000 
1 1 1 14  0  4  o 67.22963 4.122107 55.71500       6.694515 55.71500       6.694515 55.71500       6.694515 67.22963 4.122107 67.22963 4.122107 0.000000       0.000000 
1 1 1 14  0  5  o 575.4959 11.89378 4057.386       166.6401 4057.386       166.6401 4057.386       166.6401 575.4959 11.89378 575.4959 11.89378 0.000000       0.000000 
1 1 1 14  0  6  o 351.8586 7.606995 1513.432       65.15669 1513.432       65.15669 1513.432       65.15669 351.8586 7.606995 351.8586 7.606995 0.000000       0.000000 
1 1 1 14  0  7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  0  8  o 116.0484 3.992419 164.7781       11.26013 164.7781       11.26013 164.7781       11.26013 116.0484 3.992419 116.0484 3.992419 0.000000       0.000000 
1 1 1 14  0  9  f 342.6601 6.075381 1434.373       50.69500 1434.373       50.69500 1434.373       50.69500 342.6601 6.075381 342.6601 6.075381 0.000000       0.000000 
1 1 1 14  0  10 o 177.7869 3.811461 385.9378       16.49592 385.9378       16.49592 385.9378       16.49592 177.7869 3.811461 177.7869 3.811461 0.000000       0.000000 
1 1 1 14  0  11 o 206.9426 4.178964 522.9382       21.05498 522.9382       21.05498 522.9382       21.05498 206.9426 4.178964 206.9426 4.178964 0.000000       0.000000 
1 1 1 14  0  12 o 27.88943 6.026446 10.71668       3.592438 10.71668       3.592438 10.71668       3.592438 27.88943 6.026446 27.88943 6.026446 0.000000       0.000000 
1 1 1 14  0  13 o 52.49955 3.677806 34.10329       4.651232 34.10329       4.651232 34.10329       4.651232 52.49955 3.677806 52.49955 3.677806 0.000000       0.000000 
1 1 1 14  0  14 o 55.51992 3.729124 38.09983       4.992312 38.09983       4.992312 38.09983       4.992312 55.51992 3.729124 55.51992 3.729124 0.000000       0.000000 
1 1 1 14  0  15 o 267.0451 5.049149 871.5603       32.83134 871.5603       32.83134 871.5603       32.83134 267.0451 5.049149 267.0451 5.049149 0.000000       0.000000 
1 1 1 14  0  16 o 139.8806 3.588782 239.1399       12.21502 239.1399       12.21502 239.1399       12.21502 139.8806 3.588782 139.8806 3.588782 0.000000       0.000000 
1 1 1 14  0  17 o 30.25052 8.101165 13.33796       5.159938 13.33796       5.159938 13.33796       5.159938 30.25052 8.101165 30.25052 8.101165 0.000000       0.000000 
1 1 1 14  0  18 o 324.2922 7.239306 1290.196       57.14532 1290.196       57.14532 1290.196       57.14532 324.2922 7.239306 324.2922 7.239306 0.000000       0.000000 
1 1 1 14  0  19 o 129.7058 4.356366 206.1169       13.73431 206.1169       13.73431 206.1169       13.73431 129.7058 4.356366 129.7058 4.356366 0.000000       0.000000 
1 1 1 14  0  20 o 135.0827 4.432042 223.5936       14.55386 223.5936       14.55386 223.5936       14.55386 135.0827 4.432042 135.0827 4.432042 0.000000       0.000000 
1 1 1 14  0  21 o 102.7961 6.238092 130.8441       15.49344 130.8441       15.49344 130.8441       15.49344 102.7961 6.238092 102.7961 6.238092 0.000000       0.000000 
1 1 1 14  0  22 o 30.25487 8.855577 13.76695       5.670395 13.76695       5.670395 13.76695       5.670395 30.25487 8.855577 30.25487 8.855577 0.000000       0.000000 
1 1 1 14  0  23 o 109.2499 4.459358 146.6500       11.82710 146.6500       11.82710 146.6500       11.82710 109.2499 4.459358 109.2499 4.459358 0.000000       0.000000 
1 1 1 14  0  24 o 15.58324 9.138518 3.555941       5.836467 3.555941       5.836467 3.555941       5.836467 15.58324 9.138518 15.58324 9.138518 0.000000       0.000000 
1 1 1 14  0  25 o 11.45855 7.990498 -7.492291      8.082729 -7.492291      8.082729 -7.492291      8.082729 11.45855 7.990498 11.45855 7.990498 0.000000       0.000000 
1 1 1 14  0  26 o 11.03058 7.345709 -1.542604      5.329391 -1.542604      5.329391 -1.542604      5.329391 11.03058 7.345709 11.03058 7.345709 0.000000       0.000000 
1 1 1 14  0  27 o 14.20055 8.666053 2.307598       5.669554 2.307598       5.669554 2.307598       5.669554 14.20055 8.666053 14.20055 8.666053 0.000000       0.000000 
1 1 1 14  0  28 o 68.46068 6.771758 59.77126       11.02534 59.77126       11.02534 59.77126       11.02534 68.46068 6.771758 68.46068 6.771758 0.000000       0.000000 
1 1 1 14  0  29 o 93.01829 4.679873 107.3963       10.54655 107.3963       10.54655 107.3963       10.54655 93.01829 4.679873 93.01829 4.679873 0.000000       0.000000 
1 1 1 14  0  30 o 21.25853 10.06478 8.534690       5.910455 8.534690       5.910455 8.534690       5.910455 21.25853 10.06478 21.25853 10.06478 0.000000       0.000000 
1 1 1 14  0  31 o 13.11627 8.243132 1.505944       5.512268 1.505944       5.512268 1.505944       5.512268 13.11627 8.243132 13.11627 8.243132 0.000000       0.000000 
1 1 1 14  0  32 o 19.37249 9.929842 7.454790       5.946316 7.454790       5.946316 7.454790       5.946316 19.37249 9.929842 19.37249 9.929842 0.000000       0.000000 
1 1 1 14  0  33 o 16.67452 9.303034 5.447770       5.630483 5.447770       5.630483 5.447770       5.630483 16.67452 9.303034 16.67452 9.303034 0.000000       0.000000 
1 1 1 14  0  34 o 17.34965 9.531265 6.279930       5.806665 6.279930       5.806665 6.279930       5.806665 17.34965 9.531265 17.34965 9.531265 0.000000       0.000000 
1 1 1 14  0  35 o 10.54598 7.352293 -4.433124      6.831431 -4.433124      6.831431 -4.433124      6.831431 10.54598 7.352293 10.54598 7.352293 0.000000       0.000000 
1 1 1 14  0  36 f 13.21680 8.330566 2.747534       5.674906 2.747534       5.674906 2.747534       5.674906 13.21680 8.330566 13.21680 8.330566 0.000000       0.000000 
1 1 1 14  0  37 o 9.508130 6.565550 -2.289009      5.120202 -2.289009      5.120202 -2.289009      5.120202 9.508130 6.565550 9.508130 6.565550 0.000000       0.000000 
1 1 1 14  0  38 o 11.16056 7.320448 1.197050       4.981840 1.197050       4.981840 1.197050       4.981840 11.16056 7.320448 11.16056 7.320448 0.000000       0.000000 
1 1 1 14  0  39 o 7.799143 5.560502 -4.718521      4.678379 -4.718521      4.678379 -4.718521      4.678379 7.799143 5.560502 7.799143 5.560502 0.000000       0.000000 
1 1 1 14  0  40 o 8.166303 5.807758 -4.090519      4.986688 -4.090519      4.986688 -4.090519      4.986688 8.166303 5.807758 8.166303 5.807758 0.000000       0.000000 
1 1 1 14  0  41 o 13.34925 8.916179 5.560665       7.952796 5.560665       7.952796 5.560665       7.952796 13.34925 8.916179 13.34925 8.916179 0.000000       0.000000 
1 1 1 14  1  0  o 488.6671 5.856385 2913.694       69.73950 2893.402       98.16401 2934.374       99.09570 486.6208 8.278002 490.0508 8.298079 -3.429962      11.72107 
1 1 1 14  1  1  o 516.8582 6.178938 3260.383       77.82540 3325.749       111.4054 3198.078       108.7656 521.5768 8.764997 511.4750 8.726315 10.10181       12.36826 
1 1 1 14  1  2  o 593.4003 7.038342 4300.292       101.7781 4260.312       142.9588 4341.384       144.9334 589.9625 9.943751 595.5377 9.986727 -5.575195      14.09301 
1 1 1 14  1  3  o 68.60443 2.327692 57.42842       3.885835 54.27706       5.323951 61.02114       5.684558 66.64401 3.288365 70.67140 3.309979 -4.027390      4.665759 
1 1 1 14  1  4  o 222.8146 3.365705 605.2842       18.27493 564.5038       27.57761 637.2137       24.40207 215.0826 5.261567 228.5673 4.381032 -13.48468      6.846717 
1 1 1 14  1  5  o 210.7773 3.622353 541.7407       18.60590 549.5483       26.35656 533.9847       26.26909 212.2100 5.096673 209.1799 5.153344 3.030151       7.247967 
1 1 1 14  1  6  o 259.0557 4.188796 818.6348       26.44347 820.9296       37.26399 816.3069       37.53088 259.2728 5.897886 258.5358 5.957059 0.7369385      8.382816 
1 1 1 14  1  7  o 124.3964 2.843395 188.6589       8.619483 171.4090       11.61655 209.7904       12.85723 118.4697 4.029642 131.0778 4.029938 -12.60806      5.698984 
1 1 1 14  1  8  o 278.0291 3.964254 943.0641       26.85887 899.3554       33.53073 1021.323       44.86693 271.3996 5.069880 289.0435 6.369819 -17.64392      8.141147 
1 1 1 14  1  9  o 120.6876 2.289309 177.5568       6.732915 185.3385       9.646029 170.1635       9.402211 123.2337 3.214800 118.0740 3.270833 5.159767       4.586206 
1 1 1 14  1  10 o 294.5776 3.790628 1058.840       27.21116 1065.825       38.58944 1051.932       38.37623 295.3353 5.361879 293.4032 5.367368 1.932037       7.586724 
1 1 1 14  1  11 o 322.6655 4.090977 1270.892       32.16737 1316.429       46.45868 1228.959       44.58237 328.0891 5.810842 317.0098 5.771044 11.07922       8.189678 
1 1 1 14  1  12 o 243.2598 3.299167 721.9548       19.55738 710.1130       27.35024 734.3457       27.97704 241.1017 4.655055 245.1773 4.682582 -4.075577      6.602735 
1 1 1 14  1  13 o 83.73785 2.302223 85.56066       4.693458 81.96452       6.500219 89.47762       6.783973 81.89710 3.263577 85.57428 3.259112 -3.677177      4.612239 
1 1 1 14  1  14 o 121.4822 2.391619 179.9615       7.080121 174.9534       9.842387 185.3321       10.19239 119.6847 3.378004 123.1846 3.398590 -3.499832      4.791798 
1 1 1 14  1  15 o 213.0839 3.056865 554.0374       15.87315 556.7304       22.46650 551.3531       22.42958 213.4467 4.319266 212.4114 4.333184 1.035278       6.118214 
1 1 1 14  1  16 o 89.62290 2.609573 98.06560       5.693270 92.00265       7.354461 107.1324       8.993638 86.73564 3.486608 93.56065 3.953539 -6.825012      5.271328 
1 1 1 14  1  17 o 108.0195 2.923206 142.5029       7.687729 136.0085       10.72808 149.3582       11.02206 105.3968 4.185265 110.4662 4.101588 -5.069389      5.859989 
1 1 1 14  1  18 o 68.87248 3.087447 58.02528       5.168634 56.07758       7.260483 60.02654       7.359631 67.56030 4.434508 69.92004 4.340755 -2.359734      6.205402 
1 1 1 14  1  19 o 185.0887 4.059831 418.9726       18.31150 420.9717       31.92877 417.9928       22.35296 184.6894 7.107477 184.6346 4.972575 0.5485535E-01  8.674257 
1 1 1 14  1  20 o 66.81322 3.220429 54.65816       5.227951 51.56204       7.397615 57.74730       7.389270 64.70249 4.724305 68.53195 4.448623 -3.829460      6.489168 
1 1 1 14  1  21 o 109.7956 3.039536 147.3681       8.124756 142.9764       11.37560 151.9411       11.60821 107.9623 4.332603 111.3083 4.287601 -3.345970      6.095488 
1 1 1 14  1  22 o 148.2538 3.277244 268.6853       11.83997 262.4520       16.48873 275.3204       17.01201 146.2128 4.633554 149.7497 4.667500 -3.536850      6.576881 
1 1 1 14  1  23 o 94.69638 3.681696 109.9396       8.479870 109.2225       10.29794 111.4498       14.94555 94.24416 4.496914 94.73155 6.513772 -0.4873886     7.915267 
1 1 1 14  1  24 o 35.44956 5.194041 15.79071       4.353887 18.02181       6.306930 13.75942       6.017885 37.48937 7.164678 32.59314 7.700000 4.896233       10.51773 
1 1 1 14  1  25 o 21.88241 6.913425 5.892369       4.125040 5.314316       5.849903 6.464057       5.817605 22.54269 8.212142 23.75618 8.236138 -1.213486      11.63070 
1 1 1 14  1  26 o 34.14108 7.344327 15.14153       5.928885 11.66852       9.115287 17.68826       7.805646 30.73616 10.31693 36.63561 8.844457 -5.899452      13.58910 
1 1 1 14  1  27 o 44.85974 4.890108 25.18174       5.259337 22.86616       6.589255 29.24646       8.730145 42.25979 6.615259 47.50837 7.812056 -5.248581      10.23669 
1 1 1 14  1  28 o 60.29805 3.707097 44.95679       5.420867 52.72189       7.798718 37.69770       7.540339 64.95664 4.964397 54.61941 5.751320 10.33723       7.597560 
1 1 1 14  1  29 o 47.28301 4.830378 28.16272       5.487622 31.67784       8.780788 25.90994       7.029479 49.08267 7.585557 44.68423 6.658557 4.398438       10.09342 
1 1 1 14  1  30 o 87.17072 3.872511 94.55833       8.205667 107.1733       14.20184 88.23643       10.05367 91.18482 6.432533 83.64654 4.954391 7.538284       8.119328 
1 1 1 14  1  31 o 33.30390 5.850229 14.62681       4.574763 15.86263       6.653313 13.51860       6.300480 33.65321 8.191263 31.04817 8.204999 2.605038       11.59391 
1 1 1 14  1  32 o 16.01373 6.539614 1.786102       4.038142 2.942754       5.580648 0.5148880      5.850495 18.91250 7.701216 17.29609 7.501506 1.616407       10.75088 
1 1 1 14  1  33 o 20.48016 6.884574 5.676929       4.058935 7.230351       5.646956 4.016494       5.838223 22.84069 8.099458 19.75175 7.936380 3.088949       11.33964 
1 1 1 14  1  34 o 29.70339 6.955515 12.93220       4.945536 11.39218       8.707562 13.66553       6.008740 26.28027 9.933785 29.69073 8.087381 -3.410460      12.80960 
1 1 1 14  1  35 o 19.54440 6.807116 5.574996       3.976199 3.456820       5.604095 7.722296       5.642492 18.10407 7.576497 22.13636 8.065075 -4.032290      11.06566 
1 1 1 14  1  36 o 13.27958 5.857484 0.4044852      3.701845 -2.399340      5.283084 3.108912       5.188594 13.50422 6.337451 16.98007 7.207697 -3.475843      9.597613 
1 1 1 14  1  37 o 11.05871 5.215780 -2.361980      3.658438 -5.471768      4.605755 2.954527       6.022110 10.99440 5.353337 16.89233 7.460134 -5.897936      9.182146 
1 1 1 14  1  38 o 28.05245 6.056332 12.60472       4.018732 13.59027       5.737388 11.65545       5.630800 26.07697 8.141456 23.95544 8.108821 2.121532       11.49070 
1 1 1 14  1  39 o 19.77226 7.260501 7.903655       4.586445 6.035518       5.518892 12.07414       8.245951 17.52351 7.435780 20.56254 8.912050 -3.039032      11.60670 
1 1 1 14  1  40 o 11.76692 5.401724 0.2586382      3.527131 7.142025       4.959456 -6.786196      5.017281 17.82947 7.260049 10.29142 5.118075 7.538054       8.882736 
1 1 1 14  1  41 o 8.213830 4.108881 -6.479037      3.443372 -11.92738      4.789774 -0.6514112     4.953690 8.616077 4.373838 12.16461 5.830099 -3.548533      7.288382 
1 1 1 14  2  0  o 211.0703 3.590648 543.1190       18.46869 578.4885       27.03139 512.1534       25.29257 217.7752 5.093588 204.9102 5.065161 12.86491       7.183349 
1 1 1 14  2  1  o 642.3486 7.588114 5040.268       118.7793 5054.222       168.3019 5026.419       167.6585 642.4149 10.75071 640.6490 10.73914 1.765869       15.19562 
1 1 1 14  2  2  o 359.9100 4.459531 1579.799       39.11282 1576.060       55.10310 1583.595       55.52711 359.3167 6.293068 360.1711 6.326451 -0.8543396     8.923379 
1 1 1 14  2  3  o 393.8422 4.833223 1892.190       46.38688 1872.783       65.01501 1912.312       66.20304 391.5887 6.813141 395.6926 6.865685 -4.103882      9.672462 
1 1 1 14  2  4  o 180.1137 2.951774 395.4649       12.95585 408.2225       20.34851 386.7673       16.80148 182.9347 4.564575 178.0912 3.871408 4.843521       5.985244 
1 1 1 14  2  5  o 105.2706 3.097876 135.2217       7.938426 135.2873       12.68489 135.1795       10.17787 105.1775 4.963118 105.2050 3.977104 -0.2753448E-01 6.360023 
1 1 1 14  2  6  o 159.3709 3.552514 309.7337       13.79688 316.7037       23.06956 305.8526       17.21480 160.9289 5.892548 158.2678 4.467947 2.661057       7.394908 
1 1 1 14  2  7  o 422.6221 6.304051 2182.660       64.92441 2153.485       90.55127 2213.525       93.13730 419.1876 8.864414 424.9549 8.993831 -5.767303      12.62802 
1 1 1 14  2  8  o 148.4651 4.217742 269.1790       15.24405 263.3311       20.71812 276.0821       22.50983 146.6923 5.807188 150.1669 6.164336 -3.474548      8.468912 
1 1 1 14  2  9  o 103.4511 2.758322 130.5830       6.947498 133.2655       9.393196 127.3432       10.32298 104.4512 3.696143 102.0664 4.159078 2.384872       5.564117 
1 1 1 14  2  10 o 205.0469 3.199700 512.8170       15.98816 516.0206       25.14717 510.6435       20.71361 205.5308 5.020838 204.5391 4.155691 0.9916382      6.517560 
1 1 1 14  2  11 o 128.0542 2.834771 199.9771       8.846019 192.1777       12.38465 208.1008       12.63956 125.4085 4.057822 130.5127 3.978786 -5.104240      5.683014 
1 1 1 14  2  12 o 351.7382 4.823855 1511.671       41.34755 1506.250       65.04188 1515.347       53.56381 350.3784 7.617627 351.8337 6.247380 -1.455383      9.851802 
1 1 1 14  2  13 o 120.3018 2.551709 176.4894       7.480655 177.4306       9.690784 175.1015       11.76756 120.5428 3.302105 119.6839 4.040525 0.8589249      5.218213 
1 1 1 14  2  14 f 153.1685 2.779104 286.1673       10.37314 294.6085       13.55744 274.2478       16.11033 155.3551 3.581099 149.7550 4.419389 5.600067       5.688169 
1 1 1 14  2  15 o 76.59399 2.570236 71.63632       4.790581 68.02940       6.237996 76.82195       7.479575 74.57310 3.441911 79.21490 3.886527 -4.641800      5.191517 
1 1 1 14  2  16 o 38.70790 4.022825 18.50260       3.739325 13.30367       5.604891 22.67270       5.019768 32.26548 7.299644 42.77181 4.904661 -10.50634      8.794345 
1 1 1 14  2  17 o 14.21223 5.827074 0.8183330      3.222052 -0.6332403     4.935095 1.896776       4.253776 15.95932 6.905785 17.15027 6.813299 -1.190944      9.701077 
1 1 1 14  2  18 o 134.2189 3.074203 219.9310       10.05501 214.4608       14.08625 225.6139       14.35749 132.3350 4.374028 135.7404 4.346038 -3.405380      6.166049 
1 1 1 14  2  19 o 122.2349 3.020081 182.4313       8.996006 178.9438       12.55041 186.1166       12.90140 120.8615 4.267918 123.2576 4.301829 -2.396194      6.059774 
1 1 1 14  2  20 o 273.3759 4.494492 915.2250       29.94173 919.1845       42.38471 911.2806       42.30342 273.2729 6.364679 272.0888 6.380117 1.184113       9.011938 
1 1 1 14  2  21 o 96.83086 3.051159 114.6496       7.190719 115.0045       10.11532 114.2870       10.22398 96.81278 4.298282 96.50015 4.358914 0.3126297      6.121713 
1 1 1 14  2  22 o 232.1191 4.061749 659.8267       22.97524 665.4913       32.66048 654.2775       32.32588 232.5179 5.764082 230.5548 5.753607 1.963104       8.144240 
1 1 1 14  2  23 o 76.78064 3.320715 72.24046       6.198568 71.76688       8.715537 72.72519       8.817554 76.30959 4.709777 76.81489 4.733487 -0.5053024     6.677416 
1 1 1 14  2  24 o 49.31947 4.870350 30.19756       5.777161 28.01588       6.875266 35.43843       10.65602 47.22779 6.117456 52.53894 8.621757 -5.311150      10.57156 
1 1 1 14  2  25 o 66.79952 5.098823 55.32257       8.237303 55.32257       8.237303 0.000000       0.000000 66.79952 5.098823 ?        ?        0.000000       5.098823 
1 1 1 14  2  26 o 56.94064 3.874608 40.00748       5.344306 32.58575       7.314315 48.50776       7.827764 50.88284 6.014989 62.43297 5.191970 -11.55013      7.945857 
1 1 1 14  2  27 o 18.38246 7.227109 2.611769       4.740867 1.805484       8.563498 2.968096       5.692862 22.31982 9.354946 19.91865 7.891961 2.401169       12.23920 
1 1 1 14  2  28 o 25.85222 6.361015 8.734937       3.979575 11.84383       5.622465 5.613843       5.633489 29.90569 7.676617 22.40984 8.073422 7.495850       11.14049 
1 1 1 14  2  29 o 62.27116 3.647824 48.06092       5.511259 42.14157       7.542322 54.84236       8.072895 57.69819 5.427986 66.03628 5.055041 -8.338089      7.417309 
1 1 1 14  2  30 o 20.71198 7.273187 5.130140       4.544973 3.478846       7.422152 6.120813       5.748875 21.72750 8.868629 22.69146 8.158119 -0.9639530     12.05021 
1 1 1 14  2  31 o 33.11519 6.474216 14.70161       5.037257 23.18335       8.747195 10.49322       6.161477 40.26149 9.126813 27.46186 8.413919 12.79963       12.41341 
1 1 1 14  2  32 o 28.24966 6.122145 10.84003       4.092653 14.08674       5.953499 7.931040       5.635366 31.44463 7.805851 24.03736 8.112188 7.407276       11.25784 
1 1 1 14  2  33 o 22.25415 8.189604 6.641760       5.840520 5.471461       8.950240 7.509696       7.707797 22.90255 9.579072 23.78718 9.254935 -0.8846359     13.31963 
1 1 1 14  2  34 o 9.401203 4.613623 -6.444985      3.624032 -8.548498      5.288815 -4.583089      4.975806 11.43309 5.603095 12.56172 5.970990 -1.128628      8.188248 
1 1 1 14  2  35 o 21.75992 6.832791 7.193822       4.035237 0.3492478      5.644962 14.34617       5.770483 15.86657 7.101418 29.87799 7.831683 -14.01142      10.57192 
1 1 1 14  2  36 o 15.42747 6.276986 2.657217       3.703797 4.508727       5.210124 0.7656040      5.266247 18.17407 7.425801 15.30971 6.855115 2.864361       10.10619 
1 1 1 14  2  37 o 12.51214 5.580026 0.1732521      3.452405 -1.997241      4.709713 2.694163       5.075676 12.73059 5.977330 16.12091 6.989500 -3.390326      9.196824 
1 1 1 14  2  38 o 16.34744 6.968339 3.805339       4.885087 3.805339       4.885087 0.000000       0.000000 16.34744 6.968339 ?        ?        0.000000       6.968339 
1 1 1 14  2  39 o 13.01175 5.734507 1.399579       3.541000 2.072493       4.811905 0.6047727      5.229591 14.43229 6.500008 13.81467 6.424222 0.6176233      9.138968 
1 1 1 14  2  40 o 12.85617 5.726585 1.587847       3.624867 -0.1009253     5.068669 3.355722       5.186018 12.85728 6.086596 14.84402 6.710896 -1.986742      9.059955 
1 1 1 14  2  41 o 10.79237 5.099729 -0.8427412     3.527786 -0.3594590     4.831111 -1.394823      5.163551 12.20379 5.823988 11.99064 5.798245 0.2131548      8.218180 
1 1 1 14  3  0  o 290.1237 4.076333 1026.325       28.81967 1040.350       37.36485 1005.729       45.28073 292.0300 5.250487 287.0408 6.473419 4.989258       8.335032 
1 1 1 14  3  1  o 566.7480 7.386940 3923.452       102.0213 3931.523       131.7486 3911.364       161.2369 566.8602 9.537486 564.8105 11.71455 2.049744       15.10610 
1 1 1 14  3  2  o 76.91418 2.784776 72.20230       5.210931 72.26167       6.981885 72.12763       7.829471 76.89397 3.737205 76.79179 4.199891 0.1021729      5.621902 
1 1 1 14  3  3  o 97.75045 2.476504 116.5364       5.894461 115.3895       8.886761 117.4373       7.876438 97.20662 3.758640 98.09145 3.299752 -0.8848267     5.001573 
1 1 1 14  3  4  o 207.1834 3.579982 523.3977       18.07473 500.3719       33.76509 532.6461       21.39891 202.2630 6.860321 208.9771 4.202008 -6.714111      8.044929 
1 1 1 14  3  5  o 95.87530 3.027009 112.1755       7.063371 106.6678       8.176877 128.3681       14.02030 93.45850 3.597030 102.3867 5.641039 -8.928230      6.690288 
1 1 1 14  3  6  o 184.0415 3.308008 413.0119       14.83605 397.9824       16.60432 472.5157       33.03860 180.6415 3.771963 196.4858 6.910845 -15.84427      7.873213 
1 1 1 14  3  7  o 145.0408 2.657559 256.4600       9.393102 271.2625       12.08592 233.8797       14.92718 149.1451 3.325329 138.3717 4.432565 10.77347       5.541249 
1 1 1 14  3  8  o 278.2816 3.976320 944.8336       26.96509 933.5309       34.21928 963.3500       43.79838 276.4955 5.078631 280.6967 6.403016 -4.201172      8.172583 
1 1 1 14  3  9  o 146.8591 3.002373 263.0112       10.74488 274.4634       12.41683 228.8685       21.43954 150.0047 3.396800 136.6363 6.457191 13.36833       7.296134 
1 1 1 14  3  10 o 187.6773 3.394066 429.6795       15.52273 428.4523       17.69332 433.7806       32.34558 187.3754 3.874900 188.0683 7.070290 -0.6928711     8.062496 
1 1 1 14  3  11 o 71.86989 2.409461 63.04782       4.213943 59.29657       5.442143 68.66456       6.659221 69.64648 3.215200 74.92427 3.658303 -5.277786      4.870389 
1 1 1 14  3  12 o 101.7859 2.427581 126.3258       6.021398 131.1804       7.908784 119.6311       9.287488 103.6512 3.134718 98.92308 3.860103 4.728165       4.972610 
1 1 1 14  3  13 o 99.72021 2.547937 121.3463       6.186601 121.0616       9.571612 121.5506       8.107813 99.49753 3.955515 99.75032 3.340152 -0.2527924     5.177134 
1 1 1 14  3  14 o 252.7291 4.182581 780.2042       25.75941 802.0745       51.70902 772.9854       29.70807 255.1679 8.326954 251.4488 4.848291 3.719101       9.635564 
1 1 1 14  3  15 o 76.87373 2.963528 72.21230       5.541263 55.51267       10.42354 78.79099       6.542309 66.97041 6.467353 80.27325 3.351820 -13.30284      7.284323 
1 1 1 14  3  16 o 164.9249 3.256140 332.0319       13.08655 332.9377       18.55442 331.1353       18.46031 164.9317 4.620994 164.4860 4.610015 0.4456482      6.527314 
1 1 1 14  3  17 o 114.7362 2.639481 160.6163       7.379980 147.6161       9.369058 181.8692       11.97927 109.8835 3.503344 121.9159 4.037692 -12.03244      5.345687 
1 1 1 14  3  18 o 89.10484 2.933835 97.02004       6.361808 104.0040       9.245258 90.73905       8.767640 92.13300 4.128310 86.03666 4.194438 6.096336       5.885257 
1 1 1 14  3  19 f 126.4752 3.037471 195.3174       9.361672 192.3179       13.17938 198.3723       13.30026 125.2902 4.323076 127.2538 4.295129 -1.963593      6.094023 
1 1 1 14  3  20 o 60.40873 3.280892 44.71558       4.811657 43.37755       6.688265 46.15104       6.927459 59.32264 4.664031 61.19846 4.680643 -1.875824      6.607692 
1 1 1 14  3  21 o 266.0514 4.425599 867.1714       28.69285 841.6896       39.84424 894.6202       41.35346 261.4054 6.254821 269.4797 6.297233 -8.074280      8.875693 
1 1 1 14  3  22 o 38.76733 4.604257 18.68679       4.264865 18.39486       6.130986 18.96050       5.936573 38.01624 6.870796 38.68187 6.530091 -0.6656303     9.478919 
1 1 1 14  3  23 o 89.87147 3.574281 99.01169       7.812312 102.2291       9.842711 93.53382       12.84309 91.17338 4.443452 86.83766 6.108076 4.335716       7.553334 
1 1 1 14  3  24 o 49.77359 3.923876 30.55628       4.720912 26.07427       6.680287 35.02782       6.672476 45.51744 6.182214 53.08027 5.226141 -7.562832      8.095203 
1 1 1 14  3  25 o 127.7465 3.211008 199.9196       9.988079 188.4099       13.90486 212.1893       14.35651 123.6529 4.622657 131.2738 4.494443 -7.620888      6.447401 
1 1 1 14  3  26 o 94.03377 3.864526 108.8087       8.836693 114.1767       10.61562 96.69523       15.94668 96.15056 4.543470 87.41624 7.560103 8.734322       8.820333 
1 1 1 14  3  27 o 100.5549 3.261417 124.2102       7.981246 132.6295       11.46958 116.3060       11.11323 103.5142 4.558034 96.86636 4.722172 6.647842       6.563123 
1 1 1 14  3  28 o 17.37809 6.993285 1.967201       4.540526 -3.023772      8.025235 4.317063       5.506635 18.68285 8.406061 20.91752 7.901250 -2.234667      11.53653 
1 1 1 14  3  29 f 30.55459 6.681431 12.33200       4.835938 18.64989       8.544589 9.354546       5.865800 36.72738 9.482074 26.62807 8.218857 10.09931       12.54828 
1 1 1 14  3  30 o 15.64169 6.416897 1.348161       3.910236 -2.184866      5.550738 4.828653       5.509314 15.42972 6.962337 21.12739 7.919762 -5.697676      10.54499 
1 1 1 14  3  31 o 19.55150 6.709016 4.754246       3.856656 -1.451826      5.301583 11.72983       5.620663 15.36988 6.880363 29.02572 7.786056 -13.65584      10.39048 
1 1 1 14  3  32 o 28.90368 8.347864 12.11803       6.207623 0.000000       0.000000 12.11803       6.207623 ?        ?        28.90368 8.347864 0.000000       8.347864 
1 1 1 14  3  33 o 26.90583 6.479905 10.18466       4.197720 4.904641       5.776478 16.09305       6.110544 20.46379 7.997602 33.18100 7.705196 -12.71721      11.10548 
1 1 1 14  3  34 o 24.11581 7.362659 8.726223       4.723372 11.61607       6.065804 4.274799       7.528359 27.10884 8.356141 20.52165 8.695301 6.587198       12.05958 
1 1 1 14  3  35 o 10.84048 5.110324 -2.821989      3.504124 -2.160657      5.095273 -3.415460      4.826780 13.69437 6.359029 12.65770 5.976336 1.036665       8.726617 
1 1 1 14  3  36 o 14.42259 6.090975 1.727716       3.674031 1.009558       5.060269 2.528359       5.342978 15.25410 6.782117 16.59038 7.182170 -1.336283      9.878293 
1 1 1 14  3  37 o 14.40174 6.224714 1.665241       4.000583 0.8791926      4.789958 3.478238       7.274540 14.54525 6.523382 17.72557 7.986864 -3.180325      10.31235 
1 1 1 14  3  38 o 11.86878 5.381303 -0.1207927     3.363510 0.3789527E-01  4.598776 -0.3033215     4.932145 13.39758 6.156797 13.51421 6.268844 -0.1166258     8.786613 
1 1 1 14  3  39 f 11.93324 5.514021 -0.2946590     3.761150 0.1797233      4.593978 -1.259068      6.550211 13.05223 6.053018 13.81999 6.644450 -0.7677574     8.988200 
1 1 1 14  3  40 o 9.258487 4.514772 -3.552784      3.309913 -0.8307692     4.515723 -6.713060      4.865692 12.03799 5.712281 10.12738 5.037104 1.910618       7.615942 
1 1 1 14  3  41 o 14.11027 5.965778 3.436145       3.531044 3.016343       4.760575 3.949564       5.264692 14.01159 6.372207 14.67800 6.685314 -0.6664114     9.235716 
1 1 1 14  4  0  o 108.1741 2.439552 142.6166       6.430870 153.0610       10.20915 135.7464       8.280092 111.9822 3.746422 105.4766 3.225176 6.505547       4.943424 
1 1 1 14  4  1  o 107.5664 2.446716 141.0209       6.413516 133.6809       9.745429 146.6285       8.518120 104.6382 3.828314 109.6268 3.191931 -4.988686      4.984416 
1 1 1 14  4  2  o 223.1757 3.382827 607.2285       18.39767 602.9435       28.82606 610.1735       23.89787 222.2917 5.321401 223.6720 4.384412 -1.380371      6.894953 
1 1 1 14  4  3  o 238.0188 3.956328 690.8748       22.94772 695.6053       26.43146 676.3937       46.24517 238.7998 4.542040 235.0551 8.085518 3.744766       9.273928 
1 1 1 14  4  4  o 143.5788 3.343572 251.3472       11.69869 263.7841       14.12562 224.1890       20.87380 147.0163 3.946380 135.3363 6.346915 11.67999       7.473771 
1 1 1 14  4  5  o 145.8967 2.964738 259.5036       10.54066 265.0131       14.41047 253.1638       15.45810 147.3479 4.017018 143.9867 4.410725 3.361145       5.965813 
1 1 1 14  4  6  o 209.7632 4.139219 536.7778       21.15845 532.8126       25.36008 545.8600       38.38068 208.9300 4.980968 211.1095 7.472301 -2.179428      8.980273 
1 1 1 14  4  7  o 134.1296 3.273927 219.3928       10.70113 208.9488       12.42743 249.3473       21.04641 130.8168 3.902722 142.7191 6.065287 -11.90221      7.212416 
1 1 1 14  4  8  o 194.2774 3.969691 460.5197       18.79382 457.4710       22.49097 467.5745       34.21327 193.5744 4.767868 195.3218 7.200319 -1.747437      8.635807 
1 1 1 14  4  9  f 274.8643 4.411448 922.2671       29.54851 934.7228       41.45045 909.3973       42.13373 276.4696 6.152416 272.6677 6.341035 3.801941       8.835212 
1 1 1 14  4  10 o 142.9111 3.007251 249.0878       10.47301 245.7332       14.07359 253.2509       15.67816 141.8307 4.076141 143.9481 4.474875 -2.117386      6.053051 
1 1 1 14  4  11 f 230.2590 3.899879 647.1379       21.88285 629.1385       29.80177 668.1968       32.23533 226.8543 5.390872 233.7505 5.659050 -6.896164      7.815776 
1 1 1 14  4  12 f 17.62153 4.894940 3.905268       2.176910 5.687799       3.249684 2.454219       2.931999 21.28062 6.005879 15.85319 5.807785 5.427428       8.354696 
1 1 1 14  4  13 o 77.88251 2.286498 74.02246       4.334873 76.95420       6.070478 70.97197       6.192207 79.35716 3.145298 76.19032 3.343245 3.166847       4.590227 
1 1 1 14  4  14 o 245.9892 3.342590 738.4989       20.03712 722.3951       27.73717 756.0745       28.97700 243.1010 4.682086 248.6862 4.781516 -5.585205      6.692147 
1 1 1 14  4  15 o 95.87296 2.484830 112.1820       5.800464 112.9445       7.528877 111.0686       9.098393 96.14433 3.217976 95.27637 3.927131 0.8679657      5.077177 
1 1 1 14  4  16 o 142.2846 2.727658 246.9977       9.457665 246.5908       12.19474 247.6118       14.98166 142.1051 3.521492 142.2547 4.326756 -0.1495361     5.578685 
1 1 1 14  4  17 o 230.8310 4.523862 651.8140       25.44718 645.5236       31.34495 663.9755       43.58320 229.4705 5.605372 231.9708 7.720674 -2.500275      9.540913 
1 1 1 14  4  18 o 126.1898 3.034199 194.4051       9.330485 208.0451       13.70764 182.6294       12.73642 130.3394 4.321670 122.1147 4.286646 8.224747       6.087049 
1 1 1 14  4  19 o 71.25857 3.696041 62.23360       6.396216 59.56826       7.503224 69.32043       12.23481 69.61928 4.445879 74.72556 6.792967 -5.106277      8.118512 
1 1 1 14  4  20 o 66.44662 3.162789 54.05575       5.106586 55.27561       7.231662 52.84252       7.211984 67.03802 4.451931 65.52631 4.544670 1.511711       6.361895 
1 1 1 14  4  21 o 87.31252 3.396614 93.33192       7.213225 100.5493       9.282021 82.32759       11.46130 90.51640 4.219646 81.61031 5.800868 8.906090       7.173247 
1 1 1 14  4  22 o 48.22177 4.369680 28.73375       5.079180 30.65308       6.637473 26.02177       7.889875 49.60823 5.587588 45.26363 7.409041 4.344604       9.279818 
1 1 1 14  4  23 o 136.0473 3.182895 226.3471       10.55233 227.5585       14.88303 225.1224       14.96381 136.0919 4.493851 135.3483 4.543277 0.7436523      6.390310 
1 1 1 14  4  24 o 92.32530 3.117804 104.3864       7.004581 99.54133       9.776073 109.4978       10.04119 89.91249 4.475853 94.33274 4.379999 -4.420250      6.262400 
1 1 1 14  4  25 o 168.8663 3.450872 349.4272       14.20064 331.9033       19.55143 368.9944       20.65987 164.0375 4.896498 172.9638 4.906539 -8.926254      6.931798 
1 1 1 14  4  26 o 206.8116 3.841349 525.5027       19.35953 519.3626       27.25152 531.7585       27.50731 204.6606 5.469023 207.0992 5.455215 -2.438629      7.724608 
1 1 1 14  4  27 o 75.80315 4.074340 71.01208       7.498629 77.40714       8.972334 56.19787       13.65597 78.97733 4.682965 65.72069 8.743489 13.25665       9.918607 
1 1 1 14  4  28 o 72.82854 5.266695 66.48402       9.283934 62.19518       12.32500 72.10933       14.11528 69.49841 7.390600 74.61703 7.881713 -5.118622      10.80474 
1 1 1 14  4  29 o 55.45369 3.932701 38.28257       5.279959 34.55482       7.418324 42.10977       7.516626 51.95211 5.967829 57.64246 5.414514 -5.690357      8.058036 
1 1 1 14  4  30 o 18.82265 7.254684 3.400729       4.702776 2.539434       8.253317 3.814816       5.722669 21.80270 9.163970 20.29634 7.952009 1.506359       12.13313 
1 1 1 14  4  31 o 38.38139 5.628505 19.27762       5.108052 27.24304       9.198223 15.72579       6.142218 43.74994 8.930145 33.65944 7.660999 10.09050       11.76598 
1 1 1 14  4  32 o 20.85027 6.807812 5.812012       3.976892 4.564330       5.578546 7.101367       5.670944 20.33747 7.884416 23.03347 8.121345 -2.695993      11.31902 
1 1 1 14  4  33 o 28.22683 7.119336 11.49946       4.895648 9.995125       8.524373 12.23984       5.980247 25.88996 9.819053 28.52151 8.180017 -2.631548      12.77992 
1 1 1 14  4  34 o 32.13749 5.839645 14.43002       4.404946 18.68543       6.480294 10.77497       6.005801 35.02514 7.793330 26.08299 8.353675 8.942144       11.42453 
1 1 1 14  4  35 o 30.65637 6.132826 13.73637       4.421485 21.17128       6.345840 6.721514       6.163974 37.04631 7.288973 21.03001 8.248923 16.01629       11.00790 
1 1 1 14  4  36 o 14.20465 6.205831 1.032251       4.066053 2.459655       5.095176 -1.470816      6.747174 16.31360 7.037834 15.38669 7.201941 0.9269094      10.06971 
1 1 1 14  4  37 o 20.55622 6.512563 6.936487       3.658258 9.904379       5.030335 3.604765       5.329754 23.33990 7.658709 16.88330 7.239615 6.456608       10.53887 
1 1 1 14  4  38 o 9.063795 4.413726 -4.020891      3.132957 -2.655859      4.377541 -5.454262      4.485783 11.62644 5.547185 10.56146 5.172659 1.064974       7.584699 
1 1 1 14  4  39 o 22.44423 6.384353 9.022063       3.657548 6.927059       5.014720 11.40327       5.346295 18.26526 7.349710 22.66554 7.893302 -4.400288      10.78529 
1 1 1 14  4  40 o 15.09688 6.243561 4.024080       3.741449 6.108393       4.743167 0.5911548      6.087223 16.88579 7.010785 13.71078 6.541574 3.175017       9.588706 
1 1 1 14  4  41 o 16.29736 6.397867 5.523849       3.710599 3.435927       5.101952 7.868419       5.406435 14.32103 6.545072 17.34938 7.360668 -3.028347      9.849741 
1 1 1 14  5  0  o 291.9724 4.109250 1039.539       29.23752 1088.643       47.32035 1009.218       37.18436 298.6073 6.502965 287.6054 5.305510 11.00192       8.392674 
1 1 1 14  5  1  o 378.5902 5.725780 1749.292       52.82508 1756.396       74.63507 1742.160       74.77701 379.0483 8.080018 377.5015 8.128555 1.546814       11.46124 
1 1 1 14  5  2  o 184.6244 3.003492 415.5223       13.51299 424.2781       17.37628 402.1244       21.49443 186.5315 3.822686 181.4874 4.864466 5.044083       6.186757 
1 1 1 14  5  3  o 56.53726 2.498590 39.03714       3.433933 43.13698       4.629056 34.02016       5.120708 59.39653 3.210051 52.66299 4.020537 6.733547       5.144817 
1 1 1 14  5  4  o 206.3487 3.176013 519.1371       15.97056 519.6224       24.51217 518.7792       21.05219 206.3574 4.874449 206.2297 4.188996 0.1276703      6.427125 
1 1 1 14  5  5  o 275.0743 3.571992 922.7476       23.94399 937.7917       33.77678 907.5508       33.94771 277.1923 5.000357 272.6762 5.108897 4.516083       7.148734 
1 1 1 14  5  6  o 151.5701 2.981994 280.1059       11.01429 282.7444       12.49167 270.8887       23.34753 152.2684 3.366471 148.7342 6.456988 3.534180       7.281883 
1 1 1 14  5  7  o 95.09265 2.372959 110.2305       5.498868 105.2994       6.603047 121.3889       9.932783 92.88443 2.920825 99.65983 4.098666 -6.775398      5.032919 
1 1 1 14  5  8  f 175.5813 2.928509 375.9247       12.53028 387.7566       15.97727 357.0197       20.19592 178.2830 3.677534 170.9248 4.853582 7.358170       6.089460 
1 1 1 14  5  9  o 302.2510 4.247003 1115.122       31.28142 1160.645       40.91462 1051.071       48.53141 308.1802 5.448008 293.0318 6.796292 15.14844       8.710361 
1 1 1 14  5  10 o 181.1396 2.991846 400.1798       13.20653 381.9055       16.22292 436.0844       22.73962 176.9054 3.763152 188.8682 4.944951 -11.96277      6.214005 
1 1 1 14  5  11 o 168.0174 2.893421 344.3032       11.84682 347.7679       14.90932 338.3690       19.51237 168.8135 3.624220 166.3493 4.818490 2.464218       6.029330 
1 1 1 14  5  12 f 26.66887 4.501546 8.925754       2.821481 9.010413       3.251419 8.667631       5.677394 26.69677 5.184730 26.51088 8.067706 0.1858845      9.590063 
1 1 1 14  5  13 o 152.9858 2.529077 285.4225       9.428643 290.7800       13.17964 279.8062       13.49416 154.3529 3.503908 151.4009 3.657473 2.951965       5.065025 
1 1 1 14  5  14 o 110.6953 2.309426 149.4218       6.229732 147.2296       8.530273 151.9273       9.119563 109.7940 3.191607 111.5192 3.359571 -1.725189      4.633904 
1 1 1 14  5  15 o 66.23818 2.580643 53.59909       4.157580 51.14994       5.430976 57.06630       6.461898 64.63568 3.460634 68.23980 3.902119 -3.604118      5.215604 
1 1 1 14  5  16 o 107.0809 2.523962 139.8714       6.586138 140.0892       8.525522 139.5489       10.37203 107.0728 3.271262 106.7914 3.992608 0.2813950      5.161596 
1 1 1 14  5  17 o 133.2736 2.677861 216.7265       8.696974 208.7125       11.04871 229.7800       14.10098 130.6772 3.472648 137.0186 4.228183 -6.341370      5.471455 
1 1 1 14  5  18 o 200.8709 3.241980 492.7561       15.86951 491.7626       20.39723 494.2797       25.26042 200.5179 4.174284 200.7635 5.167504 -0.2455444     6.642871 
1 1 1 14  5  19 o 44.01064 3.999981 23.88382       4.243129 22.00745       5.384041 26.95950       6.893173 42.01907 5.381433 46.41658 6.253012 -4.397511      8.249847 
1 1 1 14  5  20 o 54.42741 4.676228 36.56334       6.142191 42.84792       9.708077 32.36847       7.931484 58.54036 6.940072 50.85256 6.552511 7.687798       9.544632 
1 1 1 14  5  21 o 75.09586 3.075068 69.01591       5.615485 69.25623       7.872948 68.76704       8.011863 75.06665 4.322093 74.78607 4.415847 0.2805786      6.179013 
1 1 1 14  5  22 o 148.4456 3.222415 269.4031       11.65695 274.5125       16.55762 264.3819       16.41414 149.5297 4.549251 146.7305 4.596186 2.799164       6.466885 
1 1 1 14  5  23 o 35.79582 4.605628 15.98752       3.924520 16.03692       5.733119 15.94396       5.383576 35.38883 6.895917 35.36794 6.485250 0.2089310E-01  9.466369 
1 1 1 14  5  24 o 134.1673 3.156646 220.2368       10.32069 213.7291       14.37627 227.1574       14.82540 131.8208 4.481859 135.9031 4.482658 -4.082260      6.338871 
1 1 1 14  5  25 o 59.19852 3.513878 43.10755       5.046327 45.99490       7.214925 40.34229       7.060740 60.89090 4.903756 56.94911 5.143139 3.941788       7.106244 
1 1 1 14  5  26 o 132.4839 3.206911 215.1468       10.35348 218.5169       14.68204 211.8131       14.60234 133.0465 4.535049 130.9696 4.582319 2.076874       6.447040 
1 1 1 14  5  27 o 134.4301 3.265963 221.8696       10.69901 216.8710       15.05085 226.9757       15.21181 132.3043 4.675566 135.3825 4.617623 -3.078171      6.571405 
1 1 1 14  5  28 o 41.21896 4.534136 21.31962       4.479237 24.56987       6.402755 18.20417       6.268572 43.78284 6.172088 37.25327 7.165211 6.529572       9.457003 
1 1 1 14  5  29 o 44.79669 6.524385 26.07563       6.913215 18.16681       8.533771 41.17517       11.79145 36.13187 9.549397 55.07830 9.102882 -18.94644      13.19293 
1 1 1 14  5  30 o 51.64398 4.070149 33.45557       5.080939 36.90174       7.008610 29.63803       7.376567 53.67432 5.433068 47.52839 6.542292 6.145927       8.504106 
1 1 1 14  5  31 o 20.22222 6.667332 5.281926       3.810596 7.414224       5.318151 3.032096       5.462752 23.58003 7.879851 19.03815 7.667398 4.541880       10.99459 
1 1 1 14  5  32 o 19.44658 6.860266 4.781250       4.046925 7.198260       5.629758 2.196807       5.821488 23.07178 8.095309 18.42484 7.717175 4.646936       11.18431 
1 1 1 14  5  33 o 13.63638 5.969294 -0.6205875E-01 3.778266 -2.875736      5.235888 2.994902       5.457554 13.97975 6.475840 18.37667 7.564404 -4.396919      9.957747 
1 1 1 14  5  34 o 11.66761 5.496750 -3.275749      4.042496 -2.902702      8.025865 -3.402562      4.679420 16.90398 7.893358 12.63686 5.941101 4.267117       9.879361 
1 1 1 14  5  35 o 25.44229 8.159167 10.91570       5.728000 12.80273       8.829745 9.544550       7.526638 25.70337 9.931626 23.39675 9.133384 2.306620       13.49281 
1 1 1 14  5  36 o 17.66359 6.446873 4.628835       3.607695 11.49113       5.215674 -1.666430      4.995544 25.80656 7.706405 13.45857 6.265441 12.34799       9.931990 
1 1 1 14  5  37 o 15.79976 6.184795 3.485218       3.459186 2.891116       4.789423 4.133105       5.001523 15.96200 6.854010 17.10996 7.158826 -1.147960      9.910915 
1 1 1 14  5  38 o 11.59532 5.265319 -0.1777031     3.235070 -1.607119      4.419580 1.472214       4.748241 12.18170 5.741542 14.37017 6.465754 -2.188476      8.647038 
1 1 1 14  5  39 o 12.03696 5.394206 0.6889333      3.268212 3.275094       4.417980 -2.436819      4.857058 14.97611 6.506850 11.88367 5.715579 3.092448       8.660654 
1 1 1 14  5  40 o 10.38339 4.926484 -1.471709      3.356614 -5.722364      4.557864 3.565650       4.961751 10.05203 4.978028 14.81989 6.643504 -4.767858      8.301621 
1 1 1 14  5  41 o 12.40968 5.740480 1.034124       4.092909 -3.866865      5.065265 10.25376       6.947318 10.96387 5.395164 17.86439 7.944452 -6.900516      9.603235 
1 1 1 14  6  0  o 282.3803 5.201356 972.9178       35.79210 978.6990       43.72314 961.1738       62.31721 283.1232 6.337235 280.1193 9.141362 3.003937       11.12318 
1 1 1 14  6  1  o 171.2269 3.254439 357.4359       13.57952 371.1525       19.20837 343.7307       19.20031 174.3766 4.524111 167.7946 4.700263 6.581955       6.523807 
1 1 1 14  6  2  o 70.03111 2.238290 59.83504       3.814919 59.23705       5.028802 60.64572       5.855229 69.64506 2.969862 70.44356 3.421110 -0.7985001     4.530351 
1 1 1 14  6  3  o 147.6237 2.940380 265.6736       10.57781 262.8103       14.09419 269.3664       16.00610 146.7421 3.944966 148.5306 4.427092 -1.788498      5.929747 
1 1 1 14  6  4  o 512.2494 6.714801 3206.754       83.82059 3084.395       105.1406 3420.145       138.8484 501.9037 8.596352 527.7733 10.79586 -25.86957      13.80029 
1 1 1 14  6  5  o 153.2734 2.468035 286.3724       9.218370 290.0426       12.61499 282.1667       13.50384 154.2236 3.356605 152.1042 3.643174 2.119354       4.953737 
1 1 1 14  6  6  o 467.4753 6.179493 2670.779       70.39594 2664.773       90.30104 2680.085       112.3969 466.4896 7.943551 467.1943 9.872355 -0.7046814     12.67136 
1 1 1 14  6  7  o 137.8647 2.593269 231.7214       8.712378 221.6004       10.56136 253.2789       15.41371 134.7991 3.215117 143.9892 4.397953 -9.190140      5.447840 
1 1 1 14  6  8  o 150.9899 2.721214 277.9764       10.01260 281.3410       12.48406 271.9096       16.76356 151.8722 3.373195 149.1635 4.617332 2.708755       5.718235 
1 1 1 14  6  9  f 202.0379 3.183223 497.8832       15.67242 507.6336       19.89478 481.9358       25.44326 203.9445 4.003049 198.5263 5.263829 5.418182       6.613040 
1 1 1 14  6  10 f 252.4235 3.701958 777.5579       22.77180 748.7492       28.26273 830.8677       38.44646 247.5890 4.684321 260.5986 6.054080 -13.00957      7.654720 
1 1 1 14  6  11 o 45.12427 2.860854 24.93392       3.129683 23.35694       3.562238 30.27015       6.552803 43.62299 3.377261 49.44700 5.532896 -5.824009      6.482193 
1 1 1 14  6  12 o 328.8465 4.572237 1321.210       36.64022 1318.027       46.71839 1326.298       59.05817 328.1688 5.841905 328.7670 7.371497 -0.5982056     9.405681 
1 1 1 14  6  13 o 184.1864 3.064388 413.9013       13.75427 402.7219       16.96545 435.3405       23.49425 181.6141 3.833361 188.6047 5.116516 -6.990662      6.393230 
1 1 1 14  6  14 o 79.59461 2.538588 77.34802       4.917634 81.01604       7.660823 74.77726       6.413427 81.35551 3.875277 78.19804 3.373502 3.157471       5.137926 
1 1 1 14  6  15 o 194.2460 3.118081 460.4972       14.75964 450.3996       18.76974 476.8573       23.89149 192.0009 4.011613 197.3539 4.971728 -5.352997      6.388358 
1 1 1 14  6  16 o 97.35405 2.478358 115.6887       5.874905 110.1143       7.471132 124.7201       9.509631 94.91735 3.234743 100.9586 3.872488 -6.041267      5.045763 
1 1 1 14  6  17 o 124.6034 2.847662 189.4876       8.646777 183.5261       10.08473 206.0357       16.80193 122.5401 3.380377 129.5556 5.333305 -7.015511      6.314356 
1 1 1 14  6  18 o 111.6094 2.815403 152.1409       7.651216 149.2473       8.998019 159.6952       14.53878 110.4876 3.345784 114.0170 5.246725 -3.529335      6.222732 
1 1 1 14  6  19 f 120.0741 2.657598 175.9759       7.776330 172.9063       9.960095 180.7683       12.44521 118.9037 3.441036 121.4683 4.210758 -2.564629      5.437941 
1 1 1 14  6  20 o 69.47617 3.029095 59.06867       5.116111 60.32178       7.213761 57.80049       7.256981 70.06657 4.244796 68.56437 4.365996 1.502197       6.089353 
1 1 1 14  6  21 o 167.5114 3.328138 343.0217       13.58570 348.0408       19.21008 337.9994       19.21607 168.3977 4.685752 165.9303 4.757199 2.467377       6.677366 
1 1 1 14  6  22 o 44.45248 4.613075 24.50194       4.924583 17.36025       8.803113 27.75488       5.941189 36.53072 9.719422 47.22825 5.250871 -10.69753      11.04712 
1 1 1 14  6  23 o 12.51653 5.447222 -0.5337154     3.106954 -6.185226      4.486352 4.674801       4.306932 11.63573 5.569034 20.41191 7.086021 -8.776183      9.012538 
1 1 1 14  6  24 o 34.07550 4.722546 14.54594       3.816239 12.59273       5.496444 16.36389       5.302723 31.18417 7.353313 35.84438 6.300603 -4.660208      9.683430 
1 1 1 14  6  25 o 120.7995 3.096288 178.7858       9.107193 182.5791       12.92153 175.0414       12.83791 121.7469 4.362369 119.1845 4.427860 2.562401       6.215803 
1 1 1 14  6  26 o 26.74934 6.108595 9.257575       3.894209 11.49878       5.664291 7.248775       5.362574 29.64290 7.754055 24.25781 7.904373 5.385082       11.07269 
1 1 1 14  6  27 o 71.41300 3.954904 63.04849       6.855671 65.92425       8.213571 56.44319       12.44808 72.82944 4.652278 66.14924 7.876740 6.680206       9.148045 
1 1 1 14  6  28 o 18.35766 6.926778 3.282753       4.229493 6.188845       7.213547 1.760322       5.221113 24.13251 9.058932 18.06933 7.414088 6.063185       11.70611 
1 1 1 14  6  29 o 62.76725 3.541726 48.86193       5.395338 51.43816       7.480552 46.06878       7.789118 63.92877 4.837673 60.26204 5.359926 3.666733       7.220242 
1 1 1 14  6  30 o 24.18312 8.286534 7.544423       5.882998 3.528950       7.228569 15.42164       10.12442 21.42672 8.749800 32.69129 10.87110 -11.26457      13.95492 
1 1 1 14  6  31 o 93.91336 3.316723 109.8324       7.578623 121.2327       10.63469 98.06876       10.80287 97.81918 4.473173 87.46467 5.090394 10.35452       6.776532 
1 1 1 14  6  32 o 22.81247 6.635992 7.217412       3.909909 7.532626       5.240740 6.821714       5.871807 23.29272 7.822833 22.68293 8.232757 0.6097889      11.35672 
1 1 1 14  6  33 o 29.33255 6.105700 12.01016       4.222240 22.36520       5.935642 1.403579       6.007300 40.16180 6.269578 17.60418 7.618327 22.55762       9.866433 
1 1 1 14  6  34 o 39.70857 5.279451 21.55169       4.982220 22.32707       6.302591 20.25996       8.134798 39.04399 6.875145 34.45915 9.419757 4.584843       11.66188 
1 1 1 14  6  35 o 16.07400 6.239072 3.191825       3.496399 9.679726       5.221413 -2.082246      4.707702 24.15339 7.794162 13.10227 6.093719 11.05112       9.893553 
1 1 1 14  6  36 o 15.83775 6.963669 1.852535       5.193405 -5.214543      7.991683 7.018724       6.832875 14.90986 7.210737 20.37756 8.433428 -5.467696      11.09583 
1 1 1 14  6  37 o 12.19463 5.445921 0.1657910      3.300342 -0.4337261     4.735900 0.7318291      4.601766 13.51621 6.224624 14.13153 6.361221 -0.6153240     8.900061 
1 1 1 14  6  38 o 15.56799 6.100569 3.720824       3.368618 0.8992742      4.567430 7.086215       4.988223 13.77702 6.256131 19.08321 7.439446 -5.306182      9.720316 
1 1 1 14  6  39 o 10.88688 5.050220 -0.6508963     3.201244 -1.913844      4.383799 0.7920291      4.685758 11.58543 5.534088 13.32262 6.155505 -1.737187      8.277462 
1 1 1 14  6  40 o 17.21353 6.475414 5.943332       3.690017 0.9463229      5.247698 10.83055       5.189728 13.35061 6.281295 21.03041 7.723135 -7.679799      9.954973 
1 1 1 14  7  0  o 150.8772 3.525052 277.5568       12.96061 269.3244       15.61907 295.7575       23.22399 148.5347 4.319691 155.5166 6.140141 -6.981903      7.507401 
1 1 1 14  7  1  o 89.56913 2.703831 97.88186       5.894900 108.0622       8.479985 88.36191       8.200342 94.06422 3.706684 85.02757 3.968586 9.036652       5.430395 
1 1 1 14  7  2  o 328.6318 5.051827 1317.977       40.45705 1295.505       78.39798 1326.133       47.23200 324.9437 9.912169 329.5552 5.881283 -4.611481      11.52565 
1 1 1 14  7  3  o 194.8154 3.049220 462.7211       14.47599 453.6267       21.85739 469.8271       19.32076 192.8129 4.651854 196.2601 4.039764 -3.447205      6.161123 
1 1 1 14  7  4  o 173.0897 2.615881 365.2252       11.03381 381.2412       15.43650 348.4941       15.77740 176.8064 3.582737 169.0313 3.830293 7.775009       5.244726 
1 1 1 14  7  5  o 98.17822 2.153976 117.4878       5.153379 114.0813       6.677380 122.5054       8.103999 96.69013 2.836989 100.1729 3.324415 -3.482727      4.370382 
1 1 1 14  7  6  o 224.5869 3.379365 615.1682       18.49506 591.1268       22.82274 661.1598       31.56655 220.0925 4.255262 232.6388 5.568124 -12.54625      7.007943 
1 1 1 14  7  7  o 126.4765 2.515374 195.0198       7.752621 188.9176       9.345841 208.4830       13.88195 124.4639 3.081334 130.6202 4.367322 -6.156242      5.344915 
1 1 1 14  7  8  f 149.1985 3.109916 271.4901       11.30705 269.4825       15.22365 273.9603       16.88646 148.5268 4.210331 149.7164 4.634004 -1.189560      6.261061 
1 1 1 14  7  9  o 209.0619 3.689199 533.3268       18.79503 520.9077       25.58333 547.8895       27.70347 206.4772 5.084506 211.6551 5.375526 -5.177841      7.399221 
1 1 1 14  7  10 o 123.3283 2.956264 185.5118       8.884686 187.4329       11.87293 183.0670       13.39378 123.8544 3.938791 122.3493 4.499933 1.505066       5.980257 
1 1 1 14  7  11 o 27.14535 5.076918 9.297843       3.234963 10.35095       3.862804 6.824748       5.919518 28.58292 5.745221 24.49385 8.313904 4.089073       10.10587 
1 1 1 14  7  12 o 254.8334 4.230845 793.1600       26.27360 770.6568       35.88082 819.1744       38.57867 250.9149 5.868131 258.6404 6.120894 -7.725464      8.479404 
1 1 1 14  7  13 o 79.02074 2.990351 76.29164       5.747977 81.87838       7.456854 68.11180       9.022954 81.80517 3.750558 74.46413 5.001398 7.341042       6.251453 
1 1 1 14  7  14 o 32.50037 5.583636 13.29621       4.262928 13.29621       4.262928 0.000000       0.000000 32.50037 5.583636 ?        ?        0.000000       5.583636 
1 1 1 14  7  15 o 133.1483 3.292015 216.4202       10.68153 216.4202       10.68153 0.000000       0.000000 133.1483 3.292015 ?        ?        0.000000       3.292015 
1 1 1 14  7  16 o 139.1170 3.016787 236.2237       10.22730 237.1314       11.52374 232.8570       22.19414 139.3518 3.393474 137.5057 6.643060 1.846069       7.459619 
1 1 1 14  7  17 o 28.10729 3.926346 9.842263       2.616045 10.47545       3.603786 9.136916       3.803589 28.78401 5.334113 26.76357 5.982511 2.020439       8.015185 
1 1 1 14  7  18 o 144.5724 2.725255 255.1027       9.601269 256.4119       12.34960 253.1021       15.26586 144.8633 3.498312 143.7485 4.362996 1.114792       5.592309 
1 1 1 14  7  19 o 134.3979 2.691190 220.4848       8.814002 224.7688       11.38746 214.0830       13.92035 135.5750 3.449563 132.1730 4.327701 3.401993       5.534300 
1 1 1 14  7  20 o 108.4754 2.624030 143.6443       6.936431 145.5953       9.110947 140.9541       10.69834 109.0831 3.431709 107.2317 4.101648 1.851410       5.347910 
1 1 1 14  7  21 o 136.4237 3.056962 227.4174       10.16286 233.3213       14.41188 221.5777       14.33336 137.9269 4.293037 134.3890 4.382576 3.537933       6.134911 
1 1 1 14  7  22 o 204.9234 3.712093 514.1008       18.53730 506.4840       25.89562 522.1062       26.54794 202.8573 5.242805 205.9437 5.294276 -3.086411      7.450931 
1 1 1 14  7  23 o 27.32177 5.426522 9.514784       3.485570 14.36948       5.113651 5.301951       4.763622 33.52131 6.494594 21.60163 7.454580 11.91968       9.886886 
1 1 1 14  7  24 o 56.23462 3.989674 38.99569       5.431854 41.05428       10.63836 38.26975       6.317405 56.76327 7.904965 55.57581 4.708908 1.187458       9.201212 
1 1 1 14  7  25 f 69.86940 3.198659 59.92656       5.431720 58.79924       7.752682 61.01348       7.612462 68.92455 4.642834 70.25539 4.469584 -1.330849      6.444617 
1 1 1 14  7  26 o 117.9826 3.531660 171.1015       10.14248 170.3652       16.92468 171.5141       12.66945 116.7888 5.966569 117.8343 4.419979 -1.045502      7.425373 
1 1 1 14  7  27 o 29.47734 5.694926 11.19939       3.942762 8.889638       5.637452 13.41096       5.516336 26.23874 8.049861 31.93032 7.254917 -5.691578      10.83670 
1 1 1 14  7  28 o 51.09694 3.740247 32.41814       4.625007 28.37398       6.400027 36.83863       6.691178 47.20245 5.677788 54.05737 5.141213 -6.854919      7.659592 
1 1 1 14  7  29 o 26.10115 6.127072 9.009459       3.829969 8.260182       5.268025 9.849520       5.578049 25.01885 7.799838 27.05428 7.942002 -2.035437      11.13162 
1 1 1 14  7  30 o 45.21806 4.164123 25.79006       4.537010 28.44822       6.180655 22.68399       6.681132 46.93716 5.508274 41.19545 6.898979 5.741707       8.828193 
1 1 1 14  7  31 f 19.87754 7.793558 4.000116       5.500236 3.888038       6.669200 4.238463       9.725664 20.80861 8.438963 23.44014 9.905197 -2.631538      13.01265 
1 1 1 14  7  32 o 18.93569 6.815832 4.472385       4.014096 6.730131       5.022889 0.4819033      6.677728 22.20388 7.655087 18.00773 7.907772 4.196150       11.00605 
1 1 1 14  7  33 o 28.48959 5.837951 11.27635       3.916717 14.42629       5.529067 8.103498       5.549136 31.26068 7.377610 23.41249 8.047118 7.848190       10.91720 
1 1 1 14  7  34 o 10.32072 4.894559 -3.169317      3.306041 -5.941693      4.482656 0.1371886      4.895465 11.04791 5.356676 15.02498 6.676056 -3.977065      8.559422 
1 1 1 14  7  35 o 23.92315 6.142320 8.623273       3.599024 5.522085       5.022459 11.89651       5.159902 19.30734 7.482206 26.89686 7.559886 -7.589525      10.63651 
1 1 1 14  7  36 o 11.54204 5.242150 -0.6761914     3.208592 -3.213769      4.413308 2.168928       4.673098 11.80845 5.615916 15.59410 6.733795 -3.785648      8.768267 
1 1 1 14  7  37 o 16.05055 7.064335 2.764654       5.357062 3.843264       8.395517 2.023889       6.957540 17.90248 8.260113 16.47408 7.571433 1.428404       11.20518 
1 1 1 14  7  38 o 14.19406 5.789316 2.700302       3.159912 4.913041       4.269664 0.2057952E-01  4.698656 16.90074 6.788336 13.27004 6.142729 3.630692       9.155033 
1 1 1 14  7  39 o 11.42578 5.223913 0.4660704E-01  3.254293 -1.413383      4.373449 1.857849       4.871216 11.77549 5.597456 14.01867 6.402501 -2.243185      8.504324 
1 1 1 14  7  40 o 9.707311 4.645245 -1.971283      3.118425 1.573903       4.207100 -6.294157      4.645684 13.05569 5.957870 9.914548 4.929696 3.141138       7.732924 
1 1 1 14  8  0  o 364.3042 5.513998 1620.054       48.95160 1591.165       95.44958 1630.364       57.02148 359.9258 10.89495 365.3449 6.404707 -5.419189      12.63805 
1 1 1 14  8  1  o 37.59168 3.581623 17.38824       3.241405 15.96687       4.572720 18.82377       4.595443 35.76606 5.415774 38.96362 4.951533 -3.197559      7.338139 
1 1 1 14  8  2  o 124.3275 2.797183 188.4383       8.474699 188.1879       15.23962 188.5504       10.19675 124.0690 5.051075 124.3042 3.369306 -0.2352524     6.071703 
1 1 1 14  8  3  o 111.9808 2.395097 152.8524       6.535859 152.5516       7.914121 153.4975       11.59060 111.8219 2.906752 112.0869 4.251115 -0.2649460     5.149873 
1 1 1 14  8  4  o 132.8167 2.546099 215.0450       8.240701 225.8349       10.27935 195.6380       13.78596 136.0915 3.099550 126.5367 4.477851 9.554817       5.445949 
1 1 1 14  8  5  o 190.7289 2.769728 443.5243       12.87330 461.9822       18.06482 424.4797       18.34971 194.6017 3.809351 186.5220 4.037039 8.079666       5.550571 
1 1 1 14  8  6  o 190.1996 3.472397 441.2631       16.09441 407.1898       21.15458 488.0888       24.79930 182.5599 4.759195 199.8471 5.096358 -17.28720      6.973006 
1 1 1 14  8  7  o 324.5587 5.065130 1286.702       40.06083 1270.119       55.51234 1304.725       57.87032 322.0787 7.072801 326.3908 7.275818 -4.312134      10.14702 
1 1 1 14  8  8  o 142.3121 2.646175 246.9502       9.176913 250.0410       11.28640 240.9204       15.76435 143.1740 3.234858 140.3835 4.614392 2.790497       5.635327 
1 1 1 14  8  9  o 119.9481 2.501989 175.4282       7.313324 178.2239       8.853982 169.4251       12.97423 120.8812 3.005687 117.6967 4.532036 3.184509       5.438153 
1 1 1 14  8  10 o 164.5200 3.112226 330.1783       12.47745 323.8822       13.89133 356.4699       28.38688 162.9188 3.498940 170.4293 6.848930 -7.510483      7.690931 
1 1 1 14  8  11 o 137.1907 2.874784 229.5721       9.610946 228.0168       10.63353 236.5119       22.46157 136.7082 3.191882 138.7689 6.661656 -2.060684      7.386866 
1 1 1 14  8  12 o 188.5353 3.388617 433.7989       15.56866 425.5452       17.35701 467.7741       35.21537 186.6931 3.815142 195.0484 7.422444 -8.355362      8.345537 
1 1 1 14  8  13 o 170.9729 2.923516 356.6398       12.18060 359.0176       15.03893 352.1053       20.76775 171.4841 3.598795 169.5912 5.030720 1.892853       6.185424 
1 1 1 14  8  14 o 149.2989 3.023990 272.0072       11.00204 279.2896       12.46056 246.2481       23.43506 151.2556 3.380572 141.4550 6.818559 9.800598       7.610585 
1 1 1 14  8  15 o 130.5307 2.884281 207.9154       9.174585 203.6870       10.14516 226.8961       21.49465 129.1724 3.222945 135.7872 6.514847 -6.614822      7.268467 
1 1 1 14  8  16 o 142.2775 2.979557 247.0816       10.33056 245.7548       14.60675 248.4095       14.61250 141.7059 4.234646 142.4730 4.213403 -0.7671204     5.973692 
1 1 1 14  8  17 o 226.2616 3.854692 625.7734       21.25381 644.8703       30.48699 607.7161       29.64552 229.3211 5.455498 222.6145 5.464739 6.706558       7.721776 
1 1 1 14  8  18 o 107.2146 2.868404 140.4319       7.487556 138.4097       8.306512 149.1969       17.29345 106.4040 3.207160 109.9268 6.484484 -3.522804      7.234252 
1 1 1 14  8  19 f 73.16512 2.958639 65.47801       5.264238 62.04440       5.708578 84.99394       13.60964 71.18344 3.299865 82.75855 6.808509 -11.57511      7.566036 
1 1 1 14  8  20 o 31.82755 3.892544 12.57827       2.956310 11.11307       3.946677 14.45138       4.462361 29.57948 5.681717 33.85152 5.605416 -4.272039      7.981391 
1 1 1 14  8  21 o 85.20987 2.879728 88.80088       5.971081 88.62846       8.499640 88.96889       8.390193 84.96104 4.117557 85.13406 4.055863 -0.1730270     5.779645 
1 1 1 14  8  22 o 43.27770 3.681077 23.09536       3.845370 20.97502       5.383223 25.30454       5.494843 40.90554 5.542866 45.08405 5.090364 -4.178505      7.525634 
1 1 1 14  8  23 o 55.16344 3.287049 37.36809       4.398654 34.53935       6.214636 40.20778       6.226652 52.77073 4.888216 57.03825 4.516579 -4.267517      6.655384 
1 1 1 14  8  24 o 113.0794 3.385054 156.7816       9.317425 154.0894       15.06424 158.4497       11.85763 111.5134 5.561047 113.4642 4.296235 -1.950783      7.027295 
1 1 1 14  8  25 o 61.74372 4.522130 47.22106       6.756931 0.000000       0.000000 47.22106       6.756931 ?        ?        61.74372 4.522130 0.000000       4.522130 
1 1 1 14  8  26 o 34.21119 5.361729 14.86346       4.323266 15.65747       8.370629 14.57460       5.048780 34.26509 9.628108 33.60748 6.398374 0.6576080      11.56026 
1 1 1 14  8  27 o 80.59315 3.099058 79.88796       6.075106 74.65903       8.348959 85.77193       8.856480 77.52475 4.437866 83.12855 4.387482 -5.603798      6.240565 
1 1 1 14  8  28 o 41.06201 4.087196 21.09914       4.035546 21.45838       5.622859 20.71754       5.795293 40.88519 5.806700 40.04623 6.133536 0.8389587      8.446184 
1 1 1 14  8  29 o 22.92214 6.190531 6.951864       3.538550 9.241387       4.950819 4.560736       5.059481 26.21022 7.418478 20.46554 7.605836 5.744677       10.62462 
1 1 1 14  8  30 o 27.38734 5.565666 9.915182       3.587725 14.65852       4.972367 4.764002       5.181727 33.10324 6.395410 20.57611 7.687309 12.52713       9.999800 
1 1 1 14  8  31 o 44.06619 4.330715 24.80527       4.590504 28.12577       5.780577 19.13601       7.553228 46.49851 5.189862 36.24596 8.668458 10.25255       10.10331 
1 1 1 14  8  32 o 13.93098 6.010273 0.3018050      3.716337 1.129481       5.909330 -0.2397244     4.779904 17.52123 7.569142 15.09973 6.658332 2.421498       10.08094 
1 1 1 14  8  33 o 27.32406 6.559603 10.77060       4.312339 12.65890       5.077113 5.880425       8.170397 29.25860 7.176242 22.08445 9.187999 7.174149       11.65838 
1 1 1 14  8  34 f 20.98506 6.310925 6.491639       3.488528 8.816432       4.797287 3.882642       5.082067 23.71896 7.450390 18.16945 7.367406 5.549509       10.47793 
1 1 1 14  8  35 f 12.63842 5.533053 0.3730778      3.247005 -1.016471      4.248819 2.323971       5.034405 13.01148 5.956475 16.30385 7.014315 -3.292372      9.202186 
1 1 1 14  8  36 o 13.49227 5.700303 1.484837       3.219894 3.564175       4.495360 -0.7058951     4.614201 16.61796 6.855382 13.42742 6.169262 3.190542       9.222584 
1 1 1 14  8  37 o 21.51878 6.395911 7.748309       3.599213 8.435063       5.057821 7.043765       5.122914 21.05742 7.641119 19.52742 7.559618 1.530003       10.74870 
1 1 1 14  8  38 o 13.34618 6.143332 0.4109438      4.605117 0.000000       0.000000 0.4109438      4.605117 ?        ?        13.34618 6.143332 0.000000       6.143332 
1 1 1 14  8  39 o 19.20407 6.314526 6.901138       3.418835 7.410608       4.609251 6.278029       5.097451 18.56161 7.174697 17.20125 7.214118 1.360353       10.17447 
1 1 1 14  8  40 o 10.42236 4.886280 -0.7821233     3.127258 -2.344517      4.133927 1.308248       4.781666 10.76856 5.202592 13.15832 6.127071 -2.389758      8.037908 
1 1 1 14  9  0  o 159.0417 3.117777 308.3961       12.08348 309.0215       17.56838 307.8346       16.64614 159.0811 4.536499 158.7922 4.305756 0.2889252      6.254547 
1 1 1 14  9  1  o 317.9826 5.638968 1234.742       43.69574 1199.314       73.51740 1254.093       54.33444 312.5714 9.663330 320.2788 6.961630 -7.707428      11.90984 
1 1 1 14  9  2  o 267.4397 4.904059 873.0292       31.96081 883.4537       54.80312 867.6563       39.34444 268.4449 8.387782 266.4912 6.058491 1.953735       10.34699 
1 1 1 14  9  3  o 174.3396 2.835040 370.5718       12.04457 386.2644       15.58253 347.2808       18.98390 177.9586 3.593211 168.6205 4.624333 9.338135       5.856246 
1 1 1 14  9  4  f 258.5625 3.707658 815.5275       23.36153 828.9947       30.13904 795.2575       36.97572 260.5927 4.746036 255.0976 5.948043 5.495117       7.609472 
1 1 1 14  9  5  o 70.16773 2.711723 60.11945       4.628078 67.14191       6.224034 51.43476       6.921575 74.11237 3.455753 64.76585 4.411878 9.346512       5.604185 
1 1 1 14  9  6  o 161.2634 3.065031 317.1550       12.04500 309.4712       13.36911 350.2823       27.75940 159.2790 3.444354 169.0487 6.752064 -9.769714      7.579838 
1 1 1 14  9  7  o 105.5580 2.603782 135.8604       6.697797 130.4636       7.260496 166.6848       17.35178 103.3919 2.884485 116.5768 6.129492 -13.18487      6.774284 
1 1 1 14  9  8  o 103.7448 2.597402 131.3208       6.561452 126.9745       7.116773 155.9551       16.94324 101.9970 2.866093 112.7289 6.191504 -10.73182      6.822698 
1 1 1 14  9  9  o 291.6235 4.126530 1038.288       29.32538 1006.669       36.48130 1096.033       49.29990 286.9775 5.216587 299.1206 6.763378 -12.14310      8.541431 
1 1 1 14  9  10 o 223.2021 3.387502 607.8945       18.42527 596.4952       22.85569 629.0541       31.13945 221.0089 4.243738 226.7653 5.635057 -5.756378      7.054303 
1 1 1 14  9  11 o 100.4535 2.407277 123.0482       5.892877 121.2074       6.875592 128.1426       11.43811 99.64416 2.834417 102.3039 4.599794 -2.659698      5.402964 
1 1 1 14  9  12 o 209.6841 3.272928 536.5630       16.72392 531.7346       20.75712 545.4967       28.23411 208.6472 4.082427 211.0503 5.494417 -2.403030      6.845058 
1 1 1 14  9  13 o 99.89877 2.408816 121.7107       5.864079 122.1175       6.862327 120.6097       11.29013 100.0089 2.818577 99.20897 4.683167 0.7999420      5.465933 
1 1 1 14  9  14 o 14.72260 4.699149 2.591290       1.901681 2.935876       1.965971 -2.420383      7.497558 15.49611 4.753675 18.75193 8.300674 -3.255821      9.565491 
1 1 1 14  9  15 o 200.1399 3.522476 489.2040       17.17979 489.3603       19.39293 488.6342       37.03217 200.1077 3.976889 199.0188 7.649946 1.088898       8.621910 
1 1 1 14  9  16 o 199.4286 3.528256 485.8359       17.14682 477.2253       19.16253 520.4264       38.40734 197.5848 3.979816 205.2880 7.691005 -7.703186      8.659705 
1 1 1 14  9  17 o 133.5494 2.554706 217.6326       8.314172 228.6526       10.85438 201.9882       12.93286 136.8266 3.255356 128.4421 4.137309 8.384506       5.264472 
1 1 1 14  9  18 o 133.9074 2.918490 218.9360       9.523551 210.5063       13.24200 227.9677       13.70668 131.1005 4.150120 136.4385 4.127232 -5.338028      5.852994 
1 1 1 14  9  19 o 111.8026 2.790941 152.6182       7.603940 150.6531       10.62502 154.6813       10.88695 110.8983 3.937845 112.3663 3.982183 -1.467941      5.600394 
1 1 1 14  9  20 o 72.11836 2.539064 63.57058       4.455306 60.16958       5.704691 68.88885       7.133698 70.07752 3.350249 74.92141 3.920909 -4.843887      5.157295 
1 1 1 14  9  21 o 75.41162 3.029840 69.61305       5.556600 65.93217       6.045379 89.65433       14.10620 73.34398 3.391567 84.85315 6.880904 -11.50917      7.671347 
1 1 1 14  9  22 o 172.3488 3.361223 363.4509       14.11698 347.0197       19.45244 381.7335       20.51910 167.9901 4.756546 176.1894 4.783484 -8.199310      6.745847 
1 1 1 14  9  23 o 19.35380 6.046256 4.601763       3.163812 6.849572       4.794882 2.868493       4.210477 23.57420 7.454367 18.07287 6.889858 5.501333       10.15075 
1 1 1 14  9  24 o 65.75745 3.051771 53.04255       4.876935 53.43047       6.795674 52.63058       7.003057 65.78947 4.261703 65.25907 4.429886 0.5304031      6.147032 
1 1 1 14  9  25 o 155.6902 3.233074 297.1638       12.26628 303.5497       17.20116 290.5565       17.49691 156.8404 4.505198 153.3645 4.687167 3.475861       6.501257 
1 1 1 14  9  26 o 39.00040 3.827070 18.90136       3.590452 19.61459       4.905353 18.07830       5.269515 39.41257 5.236874 37.62204 5.944942 1.790524       7.922575 
1 1 1 14  9  27 o 15.81787 6.437485 1.400039       3.896816 -2.261186      7.336016 2.839168       4.599354 18.15361 8.112381 18.32969 7.144186 -0.1760788     10.80972 
1 1 1 14  9  28 o 52.02592 3.375370 33.53572       4.256245 34.23835       5.880882 32.76284       6.167845 52.18018 4.674348 50.90784 5.037777 1.272346       6.872316 
1 1 1 14  9  29 o 62.06876 3.566653 47.92969       5.372019 50.40284       6.764017 43.70485       8.840657 63.31438 4.411552 57.97545 6.361937 5.338932       7.741836 
1 1 1 14  9  30 o 41.31846 4.161474 21.63749       4.133111 18.07394       5.033638 29.01183       7.241073 37.07590 5.757990 46.70152 6.541792 -9.625614      8.714901 
1 1 1 14  9  31 o 21.10578 6.175794 6.047846       3.377627 5.527128       4.469662 6.741064       5.157134 20.66535 7.215887 22.43221 7.755675 -1.766861      10.59337 
1 1 1 14  9  32 o 17.81000 6.135231 4.102880       3.226149 2.948849       4.211561 5.741693       5.018788 17.16875 6.792562 20.84864 7.604700 -3.679893      10.19659 
1 1 1 14  9  33 o 12.72025 5.532554 0.1523791      3.201018 -0.7352725     4.304540 1.250512       4.787765 13.75413 6.175066 15.92008 6.844659 -2.165953      9.218503 
1 1 1 14  9  34 o 40.88715 4.982059 22.90263       4.861632 25.26600       5.691178 16.52164       9.351476 42.31737 5.660686 28.73418 10.39515 13.58319       11.83649 
1 1 1 14  9  35 o 14.56352 5.871628 2.298469       3.207326 1.063302       4.379862 3.726721       4.709774 14.61644 6.411848 17.19698 7.047293 -2.580533      9.527651 
1 1 1 14  9  36 f 23.08538 6.218936 8.464154       3.576525 12.58156       4.915821 3.833497       5.213212 27.12680 7.283649 17.09634 7.239514 10.03046       10.26947 
1 1 1 14  9  37 o 19.59991 6.755632 6.744105       3.911792 17.32020       6.031034 -0.9363429     5.139517 29.99113 8.074183 13.40515 6.278068 16.58598       10.22774 
1 1 1 14  9  38 o 16.53898 6.507486 4.770970       3.846400 5.449332       4.645064 3.291100       6.860765 17.13663 7.007880 15.98966 7.408973 1.146972       10.19820 
1 1 1 14  9  39 o 15.49761 6.593364 4.298765       4.358764 12.88327       8.854839 1.553481       5.007450 19.35464 8.757757 13.75652 6.358568 5.598125       10.82265 
1 1 1 14  9  40 o 11.53917 5.277869 0.5211113      3.326246 3.701452       4.258607 -4.454550      5.326674 14.52996 6.349449 11.09590 5.473997 3.434061       8.383326 
1 1 1 14  10 0  o 125.4085 2.607410 191.7247       7.968426 196.5244       13.05081 188.8718       10.06162 126.8467 4.227947 124.4084 3.321780 2.438324       5.376780 
1 1 1 14  10 1  f 193.2452 3.420697 455.4236       16.10867 446.3826       30.76838 458.8376       18.90694 190.9675 6.621657 193.9360 4.000615 -2.968506      7.736360 
1 1 1 14  10 2  o 58.53939 2.451854 41.84794       3.489926 48.65314       5.265924 36.51788       4.660370 63.06689 3.439410 54.60516 3.521047 8.461739       4.922124 
1 1 1 14  10 3  o 388.8108 5.844486 1847.365       55.37590 1746.225       75.28307 1966.604       81.74170 377.4886 8.183845 400.5472 8.374403 -23.05859      11.70922 
1 1 1 14  10 4  f 87.65653 2.362333 93.73680       5.041565 87.30511       7.249838 99.75964       7.015628 84.52680 3.527388 90.38653 3.190129 -5.859726      4.755985 
1 1 1 14  10 5  o 171.0636 2.812683 356.8233       11.72504 343.4865       14.59033 381.1397       19.70109 167.7972 3.568161 176.6257 4.581071 -8.828522      5.806719 
1 1 1 14  10 6  o 45.80649 2.592509 25.66527       2.882086 23.72759       3.191129 34.24072       6.713239 44.00728 2.993483 52.67139 5.302312 -8.664108      6.088962 
1 1 1 14  10 7  o 296.1955 4.180334 1071.006       30.17348 1091.646       38.75761 1039.247       48.07582 298.8592 5.321747 291.3201 6.772051 7.539093       8.612878 
1 1 1 14  10 8  o 84.60061 2.355987 87.33084       4.852432 84.86686       5.584046 94.92923       9.805966 83.37583 2.752126 88.04121 4.586361 -4.665382      5.348729 
1 1 1 14  10 9  o 151.6702 2.979948 280.5957       11.01400 270.4687       12.05710 331.6437       27.07017 148.8882 3.323122 164.3801 6.772309 -15.49181      7.543694 
1 1 1 14  10 10 o 256.6053 3.749503 803.7823       23.44636 796.8381       29.34105 816.0505       38.99916 255.3577 4.715097 258.1441 6.199505 -2.786407      7.788838 
1 1 1 14  10 11 o 267.2284 4.370384 872.4747       28.46022 847.4631       38.50814 902.5821       42.24915 263.0526 6.007224 271.3814 6.388543 -8.328735      8.769278 
1 1 1 14  10 12 o 88.51158 2.744714 95.65946       5.913002 88.26321       7.102623 112.3609       10.67309 84.96445 3.437502 95.76502 4.586819 -10.80057      5.731957 
1 1 1 14  10 13 o 68.61453 2.794834 57.53346       4.663353 58.63238       5.533926 54.84147       8.661377 69.22890 3.289683 66.71580 5.372888 2.513100       6.299995 
1 1 1 14  10 14 o 80.77101 3.013759 79.73242       5.921583 84.15128       6.756395 65.09221       12.29797 82.95325 3.349187 72.42991 7.056925 10.52334       7.811353 
1 1 1 14  10 15 o 199.5987 4.122838 487.0464       20.05350 504.2422       24.24355 449.7893       35.68531 202.9520 4.901927 190.8779 7.687532 12.07404       9.117403 
1 1 1 14  10 16 o 68.66982 2.503397 57.60918       4.182194 57.09742       4.462659 61.30096       11.98615 68.35007 2.684504 70.20721 7.103498 -1.857140      7.593829 
1 1 1 14  10 17 o 89.73278 2.607608 98.34662       5.695983 98.77715       6.197263 96.00372       14.45701 89.90967 2.832040 88.04086 6.790867 1.868805       7.357739 
1 1 1 14  10 18 o 83.63744 2.238453 85.40177       4.558210 81.81359       5.737558 91.54168       7.505351 81.80628 2.882595 86.46545 3.569664 -4.659164      4.588230 
1 1 1 14  10 19 o 91.14117 2.658009 101.4975       5.897161 98.43085       8.096362 104.9630       8.606706 89.63182 3.714787 92.54807 3.824461 -2.916252      5.331618 
1 1 1 14  10 20 o 125.4178 2.541625 192.0389       7.767956 188.4980       9.824033 197.9461       12.68877 124.1356 3.250357 127.0642 4.103269 -2.928535      5.234657 
1 1 1 14  10 21 o 168.3484 3.684712 346.9551       15.11641 346.0476       24.56139 347.5084       19.17907 167.3635 6.032079 168.1753 4.684382 -0.8118591     7.637370 
1 1 1 14  10 22 o 42.01267 3.120142 21.70483       3.171607 21.87874       4.090139 21.44255       5.022846 42.05233 4.040960 41.44408 5.079447 0.6082573      6.490774 
1 1 1 14  10 23 o 62.87939 3.561558 48.60200       5.435070 44.72410       6.000108 66.33105       12.82933 60.21984 4.113380 72.56208 7.356909 -12.34224      8.428761 
1 1 1 14  10 24 o 37.91878 3.663687 17.80370       3.343277 22.06466       4.607399 13.06501       4.858829 42.08556 4.565535 31.84715 6.481435 10.23840       7.927995 
1 1 1 14  10 25 o 52.10096 3.142908 33.39970       3.971818 28.76592       5.276558 39.45763       6.033165 48.06725 4.559203 56.39186 4.425721 -8.324615      6.354002 
1 1 1 14  10 26 o 10.17888 4.626617 -1.473772      2.505326 1.492675       3.310549 -5.449656      3.832646 15.00677 5.994487 10.62036 5.099999 4.386413       7.870442 
1 1 1 14  10 27 o 83.79736 2.898739 86.35835       5.910458 87.69192       8.007517 84.76219       8.760435 84.12331 3.916871 82.53395 4.371278 1.589363       5.869408 
1 1 1 14  10 28 o 38.36179 5.648109 18.96524       5.122181 25.96838       8.863811 15.45410       6.276223 43.64063 8.640597 33.79847 7.781272 9.842159       11.62790 
1 1 1 14  10 29 o 19.75448 5.866001 5.098497       3.028651 10.20393       3.901859 -2.639853      4.803739 27.72560 5.952943 13.87696 6.345448 13.84864       8.700704 
1 1 1 14  10 30 o 11.89433 5.239607 -0.5536056     2.952970 -1.354951      3.788060 0.6876994      4.714614 12.85751 5.780976 16.01448 6.836611 -3.156966      8.953153 
1 1 1 14  10 31 o 10.08068 4.697260 -2.288796      2.818128 -2.871670      3.711207 -1.494947      4.331082 11.55405 5.386007 13.58412 6.137877 -2.030065      8.165941 
1 1 1 14  10 32 o 16.17432 5.910590 3.132929       3.033827 6.477790       3.877572 -2.146446      4.871493 21.41353 6.694204 13.82744 6.347849 7.586095       9.225376 
1 1 1 14  10 33 o 24.08297 5.666898 8.204401       3.269944 11.45111       4.357051 4.017445       4.947890 28.00072 6.509265 18.44076 7.340939 9.559969       9.811213 
1 1 1 14  10 34 o 15.39491 5.932707 2.854841       3.144697 0.9507371      4.098867 5.579238       4.902909 14.42885 6.268277 19.49883 7.434508 -5.069972      9.724361 
1 1 1 14  10 35 f 25.37254 6.519635 10.12401       4.052562 10.18839       4.689402 9.934095       8.054297 24.69565 7.290569 22.58664 9.231252 2.109005       11.76301 
1 1 1 14  10 36 o 43.58301 4.415596 26.44193       4.625033 34.15767       7.117735 20.80338       6.084660 46.55269 6.447085 35.01743 7.364341 11.53526       9.787667 
1 1 1 14  10 37 o 26.59162 5.770944 11.22190       3.632015 16.93155       5.042393 5.065460       5.235963 31.49779 6.770878 17.32802 7.292078 14.16977       9.950839 
1 1 1 14  10 38 o 18.35247 6.302341 6.109571       3.403456 5.814102       4.478407 6.513526       5.236424 17.34990 6.957960 17.76651 7.370493 -0.4166126     10.13595 
1 1 1 14  10 39 o 11.34553 5.273102 -0.3119259     3.515867 -0.1135425     4.094634 -0.8686664     6.859443 12.05813 5.633008 13.58635 6.596524 -1.528224      8.674382 
1 1 1 14  11 0  o 162.1573 3.114788 320.6438       12.30838 352.4431       24.89727 310.3584       14.15972 169.7175 6.029476 159.5120 3.642713 10.20547       7.044426 
1 1 1 14  11 1  o 89.49966 2.630025 97.74123       5.729887 95.55424       10.52516 98.66240       6.830837 88.33105 4.908975 89.89426 3.122957 -1.563202      5.818152 
1 1 1 14  11 2  o 230.1342 3.443406 645.9901       19.31103 673.3020       30.82041 628.3378       24.77780 234.7699 5.387160 226.8853 4.481469 7.884689       7.007500 
1 1 1 14  11 3  o 144.1169 3.012418 253.2818       10.57953 290.2988       22.24768 242.4650       12.02633 153.9879 5.939876 140.9851 3.500448 13.00275       6.894582 
1 1 1 14  11 4  o 49.23397 2.708497 29.64542       3.237076 30.07503       3.419162 25.93115       10.05355 49.58127 2.841769 45.10804 9.449092 4.473232       9.867167 
1 1 1 14  11 5  o 114.4808 2.224929 159.7695       6.207046 161.2904       8.325599 157.8664       9.313403 114.9629 2.974313 113.7099 3.364744 1.253006       4.490884 
1 1 1 14  11 6  o 335.5892 4.599523 1375.386       37.61464 1371.614       48.20350 1381.261       60.14801 334.8781 5.906848 335.7037 7.352398 -0.8256531     9.431258 
1 1 1 14  11 7  o 149.8121 3.000903 273.7468       10.95557 256.4785       13.80174 303.1609       18.01302 144.9051 3.912116 157.4677 4.699429 -12.56264      6.114677 
1 1 1 14  11 8  o 98.38161 2.380242 118.0141       5.706516 114.9457       6.646885 126.6155       11.12876 97.04023 2.813773 101.7147 4.500947 -4.674431      5.308092 
1 1 1 14  11 9  o 183.5938 4.123572 411.6015       18.44878 448.1043       32.31968 393.9590       22.46909 191.0515 6.953535 179.4336 5.143918 11.61792       8.649366 
1 1 1 14  11 10 o 83.26759 3.716663 84.81130       7.522625 76.67352       11.61879 90.68475       9.870849 78.89159 6.090708 86.00808 4.727731 -7.116493      7.710264 
1 1 1 14  11 11 o 110.9271 3.665494 150.3955       9.894859 152.7131       16.02394 148.9671       12.57980 111.5031 5.918403 110.2889 4.691364 1.214211       7.552244 
1 1 1 14  11 12 o 184.0117 4.190781 413.7473       18.79215 416.9004       31.45805 411.9979       23.43264 184.1072 7.024612 183.3999 5.248473 0.7073517      8.768788 
1 1 1 14  11 13 o 60.41525 4.178183 44.82063       6.113456 41.68396       8.994928 47.51346       8.334283 57.92346 6.483571 62.03164 5.572723 -4.108177      8.549381 
1 1 1 14  11 14 o 64.23197 4.949918 50.79886       7.688200 46.41657       10.53114 55.79979       11.24993 61.00707 7.223679 67.00911 6.992138 -6.002037      10.05343 
1 1 1 14  11 15 o 127.8131 4.579187 200.1591       14.23959 224.6409       20.66271 178.0160       19.65101 135.0894 6.293981 120.1286 6.739808 14.96081       9.221670 
1 1 1 14  11 16 o 177.1891 5.047259 385.0285       21.77138 415.0655       31.45310 357.3996       30.16597 183.4198 7.050022 170.1072 7.294050 13.31262       10.14426 
1 1 1 14  11 17 o 118.9134 4.603153 173.4328       13.31378 157.8591       17.90029 192.7153       19.91798 113.0594 6.524781 124.9459 6.564679 -11.88650      9.255689 
1 1 1 14  11 18 o 130.3035 4.683026 208.3382       14.84609 204.9719       20.44134 212.0961       21.59740 128.8193 6.533000 130.9738 6.789947 -2.154449      9.422498 
1 1 1 14  11 19 o 60.60812 2.708328 44.94193       3.989970 43.87665       4.245503 53.00073       11.67700 59.86400 2.919030 65.01402 7.508136 -5.150013      8.055610 
1 1 1 14  11 20 o 94.87717 2.290097 109.8674       5.294825 105.8826       6.608469 117.0117       8.848709 93.04607 2.918126 97.70709 3.723172 -4.661018      4.730483 
1 1 1 14  11 21 o 79.56655 2.616764 77.41316       5.066874 70.24790       6.858749 86.02158       7.517796 75.64772 3.732121 83.73546 3.693302 -8.087738      5.250639 
1 1 1 14  11 22 o 117.2409 2.817094 168.0230       8.048528 157.3009       10.84113 181.1898       12.01363 113.1976 3.936069 121.4695 4.064273 -8.271950      5.657823 
1 1 1 14  11 23 o 63.02924 2.783632 48.67912       4.264984 48.94730       5.707731 48.34008       6.417696 63.06233 3.730804 62.57826 4.233341 0.4840698      5.642701 
1 1 1 14  11 24 o 78.81152 3.307328 76.28025       6.337774 75.08809       7.049870 81.30325       14.47092 78.11194 3.714271 80.10600 7.500233 -1.994057      8.369546 
1 1 1 14  11 25 o 49.41982 3.052015 30.05959       3.657631 31.73842       4.893831 27.93500       5.505341 50.60864 4.000672 47.26792 4.848124 3.340717       6.285672 
1 1 1 14  11 26 o 89.84553 3.032348 99.22729       6.629623 102.9530       8.265833 92.50848       11.10016 91.31681 3.722297 85.96045 5.325152 5.356361       6.497133 
1 1 1 14  11 27 o 20.54996 5.515460 5.492997       2.819495 8.884297       3.422560 -1.668720      4.973665 26.11958 5.548542 14.94661 6.679442 11.17297       8.683391 
1 1 1 14  11 28 o 74.11913 2.907008 67.77688       5.240463 70.48682       6.978868 64.27341       7.935154 75.25392 3.818047 71.52225 4.576811 3.731667       5.960258 
1 1 1 14  11 29 o 62.92282 3.023341 49.08043       4.622308 47.16143       6.004885 51.87093       7.241183 61.26594 4.044697 63.94324 4.679465 -2.677303      6.185222 
1 1 1 14  11 30 o 49.46650 4.463517 31.26836       5.322701 45.28700       10.45439 26.36287       6.184250 57.22212 7.691820 44.67308 5.818899 12.54903       9.644878 
1 1 1 14  11 31 o 42.55194 3.685630 22.99649       3.784147 23.53869       4.862574 22.16388       6.025778 42.48307 4.779772 40.24073 6.355610 2.242344       7.952358 
1 1 1 14  11 32 o 19.46892 5.920013 5.268396       3.057810 2.708016       3.892380 9.395695       4.941924 16.41011 6.518035 25.07469 7.504651 -8.664583      9.940049 
1 1 1 14  11 33 o 26.46118 5.344314 9.793701       3.327368 13.34688       4.410042 5.097733       5.069873 30.40301 6.163607 19.43096 7.520895 10.97205       9.723885 
1 1 1 14  11 34 o 15.81055 6.005014 3.210752       3.191038 2.894101       4.446675 3.546966       4.581985 16.40527 6.797649 17.12516 6.976409 -0.7198906     9.740550 
1 1 1 14  11 35 o 13.73669 5.637475 1.859399       3.019450 1.350461       3.906808 2.614359       4.758294 14.20297 6.145072 16.04771 6.859966 -1.844740      9.209834 
1 1 1 14  11 36 o 12.34092 5.516820 0.2108531      3.395905 -1.332074      3.837260 5.784511       7.293209 11.83626 5.503784 18.71181 8.238885 -6.875554      9.908121 
1 1 1 14  11 37 o 12.41199 5.429413 1.007243       3.120787 -0.3444986     4.210017 2.655978       4.649566 12.60605 5.828044 15.05221 6.604560 -2.446157      8.808310 
1 1 1 14  11 38 o 9.358435 4.490427 -2.465640      2.957853 -2.357562      3.864149 -2.618576      4.596631 10.75435 5.152870 11.48761 5.534013 -0.7332611     7.561572 
1 1 1 14  11 39 o 9.872431 4.731987 -2.123533      3.265087 0.4196143      3.872367 -8.378558      6.073028 12.11348 5.596472 10.81793 5.418176 1.295546       7.789553 
1 1 1 14  12 0  o 96.67508 2.687020 114.0385       6.324121 122.0373       12.20111 111.1001       7.395034 99.83982 5.031083 95.39267 3.185655 4.447151       5.954846 
1 1 1 14  12 1  o 210.2743 3.246114 539.2664       16.63360 567.8055       26.74280 521.2593       21.24261 215.6131 5.089742 206.6643 4.217998 8.948776       6.610369 
1 1 1 14  12 2  o 299.2428 4.209688 1092.940       30.69797 1162.509       50.05539 1051.000       38.86480 308.2234 6.664218 293.2776 5.438029 14.94583       8.601393 
1 1 1 14  12 3  o 156.0647 3.125267 297.0590       11.88579 307.3192       24.02485 293.7338       13.67680 158.3839 6.236822 155.1629 3.617100 3.220963       7.209810 
1 1 1 14  12 4  o 46.05445 2.776708 25.95811       3.101815 28.67106       4.520337 23.54399       4.264126 48.31638 3.871570 43.73436 4.046913 4.582016       5.600585 
1 1 1 14  12 5  o 171.8901 2.834271 360.3225       11.87212 358.6774       15.01926 363.0622       19.38259 171.4511 3.594778 172.3549 4.618955 -0.9037781     5.852962 
1 1 1 14  12 6  o 30.72274 2.783499 11.60521       2.061359 10.58115       2.417010 14.33726       3.947846 29.24594 3.458204 33.90599 4.921689 -4.660048      6.015164 
1 1 1 14  12 7  o 110.7097 2.631538 149.4664       7.099558 149.2830       7.811090 150.3374       17.02540 110.5938 2.900814 110.6290 6.341849 -0.3515625E-01 6.973792 
1 1 1 14  12 8  o 132.3489 3.721742 213.9742       11.99144 238.9756       20.38324 200.7416       14.82908 139.5959 6.005948 128.0816 4.759345 11.51428       7.663078 
1 1 1 14  12 9  o 176.4883 4.063033 380.3908       17.47441 373.5222       28.97337 384.3177       21.90734 174.3938 6.830818 177.2115 5.078200 -2.817749      8.511650 
1 1 1 14  12 10 o 152.0630 3.909997 282.5714       14.47690 296.5264       24.44584 275.0338       17.96613 155.3846 6.470120 149.8904 4.925325 5.494217       8.131499 
1 1 1 14  12 11 o 87.06136 3.775245 92.73705       7.990486 87.01682       12.20747 97.02499       10.56925 84.05700 5.999014 88.93266 4.895822 -4.875656      7.743207 
1 1 1 14  12 12 o 62.30299 4.096147 47.63484       6.184501 35.97452       9.000888 58.06285       8.511987 53.66072 7.053888 68.68901 5.122068 -15.02829      8.717392 
1 1 1 14  12 13 o 210.0936 4.514380 539.8422       23.11251 549.3541       39.35453 534.8340       28.55593 211.0569 7.664446 208.8279 5.616505 2.229034       9.502045 
1 1 1 14  12 14 o 183.3244 5.103408 411.9375       22.77687 425.5936       32.20747 398.2748       32.21524 185.8210 7.125763 179.6763 7.373237 6.144669       10.25383 
1 1 1 14  12 15 o 50.11560 5.774857 31.22079       6.923815 37.78428       9.605536 24.12245       9.989237 54.89417 7.366337 43.23077 9.718941 11.66341       12.19511 
1 1 1 14  12 16 o 160.0668 7.066283 316.4182       27.49518 0.000000       0.000000 316.4182       27.49518 ?        ?        160.0668 7.066283 0.000000       7.066283 
1 1 1 14  12 17 o 163.0884 7.146315 328.8625       28.33256 0.000000       0.000000 328.8625       28.33256 ?        ?        163.0884 7.146315 0.000000       7.146315 
1 1 1 14  12 18 o 164.8066 4.980721 333.5237       19.98040 343.6309       28.05743 323.1245       28.45997 166.6913 6.922215 161.5169 7.249176 5.174377       10.02335 
1 1 1 14  12 19 o 55.90098 5.558162 38.80426       7.471383 37.04316       10.15215 40.88509       11.03527 54.07667 7.940262 56.79324 8.211615 -2.716564      11.42271 
1 1 1 14  12 20 o 130.0640 4.806587 208.0457       15.20836 205.7433       20.87999 210.6475       22.19603 128.7899 6.675708 130.1980 7.021741 -1.408112      9.688650 
1 1 1 14  12 21 o 48.46909 3.344416 28.88146       3.926002 44.48914       10.15141 26.13643       4.257273 59.44666 7.150916 46.02971 3.830069 13.41695       8.112030 
1 1 1 14  12 22 o 107.0977 2.694840 140.2920       7.027554 146.6990       9.855045 133.6635       10.02403 109.3329 3.704240 104.3046 3.950833 5.028328       5.415761 
1 1 1 14  12 23 o 14.86589 4.540799 2.728865       1.796302 2.456466       2.200115 3.273508       3.110992 14.75302 5.067129 17.19420 6.018938 -2.441180      7.867872 
1 1 1 14  12 24 o 29.15304 3.623756 10.59545       2.519009 11.38799       3.209633 9.324327       4.064794 30.06244 4.521076 26.81542 6.323829 3.247021       7.773734 
1 1 1 14  12 25 o 32.94717 3.600787 13.50858       2.844009 13.70569       3.468750 13.10431       4.967576 33.01802 4.422163 31.72485 6.639027 1.293171       7.976980 
1 1 1 14  12 26 o 30.77088 4.501857 11.98670       3.275861 11.34719       3.464805 17.37509       10.05743 29.81103 4.942441 35.50307 10.72410 -5.692047      11.80822 
1 1 1 14  12 27 o 124.8481 2.953807 191.8291       8.986698 187.6681       12.08942 196.9680       13.43504 122.8915 4.042397 125.6820 4.393374 -2.790558      5.970151 
1 1 1 14  12 28 o 46.17783 3.157841 26.47171       3.532143 27.65199       4.548739 24.67924       5.605648 46.93839 4.015263 43.82527 5.360306 3.113125       6.697404 
1 1 1 14  12 29 o 29.58247 4.155424 11.18580       2.913141 13.11374       3.732105 8.179448       4.660445 31.77413 4.983756 24.46752 7.279399 7.306610       8.821988 
1 1 1 14  12 30 o 16.38271 5.546276 3.346129       2.634260 7.807002       3.308705 -4.376895      4.353533 23.99205 5.736876 11.91148 5.639461 12.08057       8.044580 
1 1 1 14  12 31 o 27.18959 6.458778 10.41799       4.215654 14.76431       7.904083 8.690099       4.983669 30.39164 9.565620 24.43923 7.581199 5.952412       12.20556 
1 1 1 14  12 32 o 10.93433 4.864550 -0.5368335     2.607467 1.743738       3.292164 -4.375309      4.271092 14.53568 5.916505 11.50923 5.487946 3.026452       8.069857 
1 1 1 14  12 33 o 28.73372 5.314597 11.57523       3.584297 14.17361       4.958846 8.732523       5.186755 30.63700 6.817675 23.32974 7.781600 7.307253       10.34572 
1 1 1 14  12 34 o 8.528084 4.133908 -3.722281      2.665515 -4.677064      3.383957 -2.161443      4.326646 9.500171 4.617331 12.39631 5.790798 -2.896142      7.406287 
1 1 1 14  12 35 o 35.62182 4.769655 17.90755       4.036416 18.27694       5.665729 17.52683       5.751956 33.25783 7.199865 32.17097 7.479196 1.086864       10.38154 
1 1 1 14  12 36 o 11.82909 5.244647 0.3443208      3.004955 1.005188       4.010609 -0.5015014     4.537250 13.58909 6.040087 13.10629 6.056128 0.4828053      8.553323 
1 1 1 14  12 37 o 19.26335 6.672279 6.816997       3.817690 6.748955       4.359966 7.040624       7.904218 18.76680 7.043192 18.15145 8.237593 0.6153488      10.83810 
1 1 1 14  12 38 o 11.58446 5.329334 -0.3691411E-01 3.458636 2.636977       4.195002 -5.712251      6.111617 14.19053 6.248307 11.75346 5.810432 2.437073       8.532435 
1 1 1 14  12 39 o 14.83896 5.962583 3.907397       3.295486 10.16088       4.446370 -3.714867      4.908927 21.45358 7.205611 11.04527 5.409928 10.40832       9.010447 
1 1 1 14  13 0  o 97.77528 2.694477 116.6544       6.413948 113.1419       12.17773 118.0029       7.545338 96.09421 5.219953 98.31273 3.153516 -2.218521      6.098571 
1 1 1 14  13 1  o 203.9387 3.201319 507.2862       15.90980 529.7507       25.48321 492.9368       20.36677 208.2489 5.021522 200.9625 4.158828 7.286346       6.520087 
1 1 1 14  13 2  o 203.3689 3.198897 504.4729       15.85335 520.1979       25.10629 494.0451       20.44493 206.3565 4.992619 201.1811 4.170251 5.175369       6.505170 
1 1 1 14  13 3  o 238.3349 3.998865 693.3116       23.22525 675.8375       45.77317 699.3702       26.95247 234.5697 8.019404 239.3049 4.621798 -4.735229      9.255910 
1 1 1 14  13 4  o 85.54567 2.385257 89.29255       4.967585 88.14344       7.470573 90.20338       6.651073 84.91457 3.618532 85.93427 3.181557 -1.019699      4.818307 
1 1 1 14  13 5  o 176.7107 2.659158 380.7947       11.45099 375.2389       15.57887 387.3239       16.88859 175.3531 3.645747 178.1352 3.890518 -2.782166      5.331754 
1 1 1 14  13 6  o 51.47058 2.204713 32.35770       2.758925 31.11800       3.432666 34.61976       4.636857 50.43422 2.804033 53.14025 3.601954 -2.706032      4.564721 
1 1 1 14  13 7  o 346.5291 6.291393 1470.654       53.12790 1568.085       94.73626 1425.954       64.16779 355.8296 10.93841 340.7798 7.726933 15.04984       13.39232 
1 1 1 14  13 8  o 110.7438 4.308460 150.0422       11.60508 147.7018       15.69275 152.8670       17.24031 109.6807 5.892917 111.5168 6.370585 -1.836121      8.678182 
1 1 1 14  13 9  o 263.1870 5.141511 847.2953       32.97549 778.4927       53.21898 890.1722       42.01221 251.2150 8.706465 269.4756 6.397643 -18.26064      10.80428 
1 1 1 14  13 10 o 54.69802 4.495448 36.81504       5.939288 37.09003       8.890348 36.59338       7.981763 54.55557 6.836916 54.30134 6.139426 0.2542267      9.188905 
1 1 1 14  13 11 o 152.2345 4.010414 283.3413       14.86483 284.4626       24.04239 282.6474       18.91294 152.1169 6.500795 151.8861 5.117118 0.2308502      8.273164 
1 1 1 14  13 12 o 40.47702 6.395739 20.59121       6.099312 28.69016       8.354417 11.34756       8.925318 47.73925 7.422391 30.90309 10.20459 16.83616       12.61846 
1 1 1 14  13 13 o 304.7864 10.10386 1155.630       74.94080 0.000000       0.000000 1155.630       74.94080 ?        ?        304.7864 10.10386 0.000000       10.10386 
1 1 1 14  13 14 o 165.7911 7.118887 339.0779       28.69434 0.000000       0.000000 339.0779       28.69434 ?        ?        165.7911 7.118887 0.000000       7.118887 
1 1 1 14  13 15 o 54.77646 8.185302 37.88996       10.59147 0.000000       0.000000 37.88996       10.59147 ?        ?        54.77646 8.185302 0.000000       8.185302 
1 1 1 14  13 16 o 163.8835 4.964675 329.5200       19.80437 348.3541       28.22013 311.2427       27.79983 167.9693 6.909092 158.6612 7.208939 9.308121       9.985207 
1 1 1 14  13 17 o 103.7580 4.602473 132.1729       11.60825 139.0073       16.16241 124.8912       16.68306 106.0723 6.280822 100.3866 6.860924 5.685753       9.301666 
1 1 1 14  13 18 o 95.25116 4.671824 111.5179       10.81100 110.9759       14.91812 112.1173       15.68913 94.63322 6.508597 95.04370 6.819230 -0.4104767     9.426756 
1 1 1 14  13 19 o 134.5890 4.737659 222.6038       15.51428 237.9137       21.94667 207.3111       21.93435 138.6280 6.514755 129.2284 6.991185 9.399597       9.556083 
1 1 1 14  13 20 o 118.7760 4.750371 173.5763       13.72193 175.0977       18.74914 171.8213       20.13654 118.7974 6.501249 117.4870 7.065951 1.310425       9.601765 
1 1 1 14  13 21 o 44.16984 6.735292 24.73122       7.020650 32.93820       9.668880 15.57874       10.21065 50.74115 8.091045 34.88575 10.85631 15.85540       13.53974 
1 1 1 14  13 22 o 21.52844 4.409748 5.904323       2.235583 -5.365763      8.119898 6.828685       2.325456 17.88330 8.204474 23.21532 4.267745 -5.332016      9.248083 
1 1 1 14  13 23 o 76.64031 3.555021 72.22787       6.621415 88.34420       12.82414 66.36966       7.731745 83.99454 6.311454 73.29112 4.348573 10.70341       7.664498 
1 1 1 14  13 24 o 41.92823 2.582808 21.59690       2.626163 21.53309       3.252602 21.71641       4.451128 41.77140 3.220172 41.71305 4.447381 0.5834579E-01  5.490784 
1 1 1 14  13 25 f 39.27060 3.038186 19.04434       2.884893 22.37356       3.774147 14.36522       4.474349 42.45969 3.684011 33.46328 5.690397 8.996414       6.778831 
1 1 1 14  13 26 o 45.51120 2.948700 25.56662       3.252677 27.62849       4.252425 22.65927       5.049566 47.14079 3.732155 42.31528 4.992923 4.825504       6.233639 
1 1 1 14  13 27 o 37.61036 3.819417 17.72268       3.452089 16.76797       3.662953 25.30592       10.32342 36.46853 4.198215 42.16631 10.16610 -5.697781      10.99885 
1 1 1 14  13 28 o 44.36349 3.134247 24.47103       3.366591 26.63917       4.322530 21.12783       5.367537 46.05466 3.887763 40.31422 5.615854 5.740433       6.830265 
1 1 1 14  13 29 o 16.92784 5.218088 3.707453       2.365348 2.319039       2.879224 6.589763       4.148454 15.11841 5.712760 22.11357 6.925713 -6.995164      8.977813 
1 1 1 14  13 30 o 33.37310 4.004266 14.28473       3.191580 20.60995       4.275455 6.323877       4.796498 39.93874 4.469462 21.67048 7.480175 18.26826       8.713731 
1 1 1 14  13 31 o 27.69187 4.570149 10.16261       2.976543 11.76551       3.823838 7.697909       4.741629 29.32023 5.555044 23.01188 7.427584 6.308355       9.275102 
1 1 1 14  13 32 o 35.50364 6.281410 18.03163       5.235779 0.000000       0.000000 18.03163       5.235779 ?        ?        35.50364 6.281410 0.000000       6.281410 
1 1 1 14  13 33 o 14.94796 5.643144 2.739145       2.807994 5.682693       3.541685 -2.242793      4.607586 19.51509 6.427475 12.89200 6.006896 6.623095       8.797457 
1 1 1 14  13 34 f 25.37039 5.211331 9.287790       3.114012 13.16720       4.059567 3.741748       4.853874 29.81347 5.796483 17.22591 7.116534 12.58756       9.178468 
1 1 1 14  13 35 o 9.012264 4.311398 -2.752311      2.682097 0.5845839      3.478485 -7.644974      4.212030 12.85442 5.673643 9.584188 4.753196 3.270233       7.401561 
1 1 1 14  13 36 o 23.28560 5.952711 8.802513       3.390390 17.89565       4.749739 -0.6435536     4.841035 33.48459 6.043194 13.21568 6.157537 20.26892       8.627599 
1 1 1 14  13 37 o 11.80603 5.317117 0.3959471      3.219763 0.6928379      3.932507 -0.2078162     5.607955 12.78899 5.806506 13.63093 6.437652 -0.8419437     8.669422 
1 1 1 14  13 38 f 10.76623 5.055977 -1.016068      3.372472 -1.496303      3.823274 0.6677231      7.159008 11.04254 5.244595 14.36122 6.915298 -3.318676      8.679120 
1 1 1 14  14 0  o 281.3174 4.017851 965.9075       27.54397 924.8583       42.41294 995.8470       36.22174 274.9298 6.330535 285.4799 5.206642 -10.55002      8.196633 
1 1 1 14  14 1  o 162.8078 2.836430 323.2458       11.25339 330.8428       17.75184 318.1418       14.55069 164.5479 4.431088 161.4684 3.697941 3.079575       5.771421 
1 1 1 14  14 2  o 60.43100 2.498922 44.60330       3.672067 47.97989       5.768504 42.30282       4.761389 62.58697 3.800095 58.79193 3.337082 3.795044       5.057355 
1 1 1 14  14 3  f 91.23748 2.396417 101.5637       5.323480 108.9225       8.383119 96.59096       6.891302 94.40608 3.650807 88.92714 3.185172 5.478943       4.844967 
1 1 1 14  14 4  o 74.78957 2.382355 68.26887       4.336401 66.84492       6.620732 69.33865       5.738619 73.91650 3.687244 75.32789 3.133030 -1.411385      4.838559 
1 1 1 14  14 5  o 200.8820 2.872973 492.1941       14.06400 495.8574       19.46095 488.1894       20.34766 201.5345 3.962584 199.9485 4.175998 1.586029       5.756824 
1 1 1 14  14 6  o 57.71132 2.496869 40.69078       3.503193 37.78846       4.924552 43.66421       4.984519 55.52087 3.660191 59.71795 3.439724 -4.197079      5.022818 
1 1 1 14  14 7  f 22.64126 7.411085 6.043677       4.711570 6.793869       6.632687 5.279535       6.694070 25.00979 8.785950 23.56585 8.750399 1.443941       12.40010 
1 1 1 14  14 8  o 152.0153 4.677708 282.7483       17.30770 277.2804       23.55447 289.1651       25.51670 150.2538 6.447981 153.3694 6.844553 -3.115646      9.403423 
1 1 1 14  14 9  o 80.72127 4.444670 79.87922       8.709318 74.17986       11.66853 87.04825       13.08679 77.54433 6.227211 84.00720 6.441790 -6.462868      8.959621 
1 1 1 14  14 10 o 146.0840 6.858015 262.6461       24.34575 0.000000       0.000000 262.6461       24.34575 ?        ?        146.0840 6.858015 0.000000       6.858015 
1 1 1 14  14 11 o 90.96551 5.100935 101.6088       11.26210 0.000000       0.000000 101.6088       11.26210 ?        ?        90.96551 5.100935 0.000000       5.100935 
1 1 1 14  14 12 o 157.4066 5.097508 303.7173       19.52737 0.000000       0.000000 303.7173       19.52737 ?        ?        157.4066 5.097508 0.000000       5.097508 
1 1 1 14  14 13 o 110.5161 4.560138 149.7082       12.25479 140.7076       16.54773 160.6400       18.23691 106.8277 6.385652 114.1272 6.585275 -7.299553      9.172916 
1 1 1 14  14 14 o 114.4803 4.605223 160.6950       12.82124 166.8015       17.80412 154.1171       18.47863 116.3237 6.304380 111.6879 6.821879 4.635735       9.288877 
1 1 1 14  14 15 o 58.91873 5.451483 42.95301       7.738423 34.81087       10.37599 53.15805       11.61631 52.38654 8.412519 65.21585 7.442418 -12.82931      11.23210 
1 1 1 14  14 16 o 154.8513 4.893759 294.2747       18.44370 298.7241       25.57685 289.4545       26.62116 155.5152 6.765162 152.9537 7.162070 2.561493       9.852038 
1 1 1 14  14 17 o 77.84011 4.902170 74.61771       9.251597 68.45428       12.32417 82.57540       14.00362 74.14845 6.899728 81.44086 7.127830 -7.292404      9.920293 
1 1 1 14  14 18 o 86.21599 4.773228 91.49023       9.989363 111.5749       14.14679 71.51704       14.10748 94.93938 6.147757 75.52338 7.776368 19.41600       9.912962 
1 1 1 14  14 19 o 115.2178 4.706567 163.2670       13.18696 151.4003       17.65401 178.2456       19.83415 110.4485 6.589100 119.7952 6.822401 -9.346687      9.484798 
1 1 1 14  14 20 o 61.25581 5.475884 46.60497       8.087941 62.94674       11.49014 30.55608       11.38671 70.95600 6.725359 48.33437 9.997448 22.62163       12.04904 
1 1 1 14  14 21 o 41.78473 9.498523 22.95362       9.451952 22.95362       9.451952 0.000000       0.000000 41.78473 9.498523 ?        ?        0.000000       9.498523 
1 1 1 14  14 22 o 129.6592 4.931975 207.7314       15.55492 231.5460       21.93395 183.6367       22.06256 136.1461 6.631070 120.7725 7.533905 15.37360       10.03647 
1 1 1 14  14 23 o 68.17662 5.333097 57.96492       8.789891 55.75132       11.59232 60.95911       13.48221 66.19436 7.307940 68.89043 8.191123 -2.696075      10.97727 
1 1 1 14  14 24 o 15.63959 4.899416 3.010557       2.075952 6.710977       7.269044 2.681948       2.166167 24.83742 9.137070 15.08777 5.028745 9.749652       10.42949 
1 1 1 14  14 25 o 54.52771 3.482903 36.78009       4.603821 51.77849       11.11083 33.67128       5.058500 63.26323 7.343350 52.03082 4.020732 11.23241       8.372042 
1 1 1 14  14 26 o 47.92846 3.441245 28.50622       3.992500 29.62850       4.282712 21.05720       11.03357 48.81940 3.625784 38.31071 11.14852 10.50869       11.72330 
1 1 1 14  14 27 o 8.892839 3.999525 -0.8295393     1.814590 0.8685985      2.210676 -4.336618      3.176958 12.04140 4.867600 9.713673 4.659008 2.327723       6.737944 
1 1 1 14  14 28 f 39.65044 3.145660 19.60456       3.014564 25.68484       4.013403 11.73325       4.566409 45.24143 3.671863 29.44212 6.535150 15.79931       7.496049 
1 1 1 14  14 29 o 8.237578 3.885880 -2.140998      2.032251 -2.155080      2.110750 -1.962170      7.521850 8.442788 3.975772 17.74194 8.045452 -9.299155      8.974189 
1 1 1 14  14 30 o 20.75089 4.995890 5.811388       2.495832 9.288751       3.256041 0.8575869      3.886280 26.23412 5.276196 14.68491 6.235855 11.54921       8.168484 
1 1 1 14  14 31 o 10.20800 4.460807 -0.1740388     2.101964 -0.8378242E-01 2.514652 -0.3833454     3.829396 11.21935 4.891361 13.33462 5.915903 -2.115271      7.676153 
1 1 1 14  14 32 o 22.57626 5.014084 7.096363       2.686751 5.380439       3.368330 10.09772       4.454760 19.29650 6.262848 25.73361 6.944188 -6.437111      9.351204 
1 1 1 14  14 33 o 31.51185 6.923243 15.47177       5.170884 0.000000       0.000000 15.47177       5.170884 ?        ?        31.51185 6.923243 0.000000       6.923243 
1 1 1 14  14 34 o 16.58373 5.799214 4.012153       2.887541 6.442482       3.735605 0.4044665      4.551375 20.06227 6.600775 14.15301 6.352257 5.909260       9.160863 
1 1 1 14  14 35 o 47.91630 4.269928 31.86839       4.933682 33.19724       5.653042 27.62112       10.10647 48.01027 4.900480 32.62527 10.86179 15.38499       11.91609 
1 1 1 14  14 36 o 15.27365 6.178816 3.434151       3.565091 6.421102       4.698963 -0.6173174     5.472606 18.48412 7.216318 13.65508 6.421405 4.829043       9.659695 
1 1 1 14  14 37 o 17.43954 6.058387 5.389366       3.148571 5.414664       4.162786 5.355545       4.813197 16.94636 6.737521 16.75553 7.017488 0.1908321      9.728275 
1 1 1 14  14 38 o 13.15498 5.595488 2.304976       3.138061 4.027370       4.228679 0.1938820      4.681577 15.11479 6.464196 12.68320 5.956460 2.431588       8.790065 
1 1 1 14  15 0  o 121.3079 2.788487 179.4593       8.243164 190.0166       12.17128 170.5134       11.20391 124.7026 4.010419 118.1324 3.897258 6.570152       5.592145 
1 1 1 14  15 1  o 316.8498 4.936031 1226.697       38.11249 1290.630       55.71235 1170.458       52.25229 324.5285 7.044700 309.0775 6.937482 15.45102       9.887187 
1 1 1 14  15 2  o 189.6986 3.406691 439.0717       15.74827 449.0425       22.73349 429.8722       21.83642 191.6406 4.871861 187.5145 4.782613 4.126129       6.827035 
1 1 1 14  15 3  o 215.4639 4.223006 566.9089       22.17340 573.0439       38.02274 563.7474       27.29518 216.0484 7.232172 214.7379 5.216042 1.310516       8.916917 
1 1 1 14  15 4  o 123.2615 3.114643 185.4739       9.348110 193.6582       15.84809 181.1069       11.57650 125.7466 5.182947 121.7344 3.907427 4.012199       6.490834 
1 1 1 14  15 5  o 64.38284 2.847846 50.66079       4.457042 59.38873       7.238580 45.33116       5.656476 69.59680 4.288869 60.81403 3.836410 8.782772       5.754341 
1 1 1 14  15 6  o 110.6689 2.934173 149.5191       7.906134 147.6447       12.45866 150.7829       10.22985 109.8100 4.666428 111.0650 3.785219 -1.255051      6.008613 
1 1 1 14  15 7  o 100.2629 4.872316 123.2115       11.86888 0.000000       0.000000 123.2115       11.86888 ?        ?        100.2629 4.872316 0.000000       4.872316 
1 1 1 14  15 8  o 199.5408 5.460603 487.7980       26.52772 0.000000       0.000000 487.7980       26.52772 ?        ?        199.5408 5.460603 0.000000       5.460603 
1 1 1 14  15 9  o 135.5878 3.871494 224.7519       12.77881 235.4361       21.10815 218.5706       16.05531 138.4041 6.274746 133.5674 4.941188 4.836731       7.986725 
1 1 1 14  15 10 o 86.43900 4.531096 91.62261       9.511080 86.17873       12.51751 99.05846       14.62948 83.58872 6.189075 89.55147 6.753558 -5.962746      9.160524 
1 1 1 14  15 11 o 167.8407 4.147568 344.3752       16.96394 348.6681       28.05889 341.9020       21.29700 168.2687 6.857119 166.9925 5.239902 1.276260       8.629986 
1 1 1 14  15 12 o 171.0358 4.172720 357.7049       17.39171 344.7398       28.26741 365.6022       22.06155 167.2414 6.951105 172.6567 5.249541 -5.415222      8.710656 
1 1 1 14  15 13 o 170.8191 5.031241 357.8116       20.92060 355.6105       28.89843 360.2355       30.32553 169.7879 6.999445 170.7979 7.302864 -1.010025      10.11553 
1 1 1 14  15 14 f 218.3707 5.676489 585.8075       30.18157 592.1803       42.32855 579.2165       43.04688 218.6992 7.955628 216.1883 8.185753 2.510849       11.41484 
1 1 1 14  15 15 o 63.23016 5.310079 49.40019       8.106517 43.43161       10.74264 57.29393       12.35426 58.78990 7.682050 67.66682 7.624705 -8.876923      10.82359 
1 1 1 14  15 16 o 55.97638 5.534580 38.86611       7.450923 37.77868       10.14459 40.13983       10.97923 54.69658 7.834371 56.31034 8.245345 -1.613754      11.37379 
1 1 1 14  15 17 o 39.37250 7.326165 19.78580       6.770576 24.78073       9.204288 13.89637       9.994536 43.81952 8.923140 33.50075 10.78099 10.31877       13.99472 
1 1 1 14  15 18 o 27.24241 8.436542 9.254385       6.174628 12.92963       8.529975 5.208632       8.949617 32.02484 9.915639 25.47989 9.955689 6.544956       14.05118 
1 1 1 14  15 19 o 30.81758 9.827212 11.83279       8.318398 11.83279       8.318398 0.000000       0.000000 30.81758 9.827212 ?        ?        0.000000       9.827212 
1 1 1 14  15 20 o 138.7506 6.722182 239.6289       22.66142 239.6289       22.66142 0.000000       0.000000 138.7506 6.722182 ?        ?        0.000000       6.722182 
1 1 1 14  15 21 o 73.06100 5.213034 66.23065       9.220392 60.58842       12.06341 74.15788       14.29899 69.27605 7.253185 76.52489 7.775577 -7.248833      10.63336 
1 1 1 14  15 22 o 124.0093 4.809204 190.1553       14.50572 215.4737       20.46393 164.5867       20.56483 131.2831 6.415956 114.1962 7.430224 17.08685       9.816961 
1 1 1 14  15 23 o 75.77171 5.062958 71.49868       9.294979 61.91886       12.18364 84.83854       14.37719 69.67896 7.282706 81.65656 7.302134 -11.97760      10.31305 
1 1 1 14  15 24 o 55.53345 5.841644 39.04733       7.787187 29.40252       9.959441 54.21882       12.49115 46.86664 9.048051 64.50633 8.126223 -17.63969      12.16153 
1 1 1 14  15 25 o 23.99370 8.447812 6.914727       6.134403 1.845089       7.820691 15.02167       9.889748 21.19142 8.914608 33.14481 10.72937 -11.95339      13.94954 
1 1 1 14  15 26 o 21.77500 5.237293 6.207739       2.744957 6.741239       8.041390 6.137376       2.920369 24.86007 9.510749 21.62033 5.523481 3.239744       10.99833 
1 1 1 14  15 27 o 59.84859 3.285854 44.51975       4.773850 44.16939       5.196675 46.41372       12.08245 59.49464 3.601223 57.79243 8.861442 1.702209       9.565247 
1 1 1 14  15 28 o 17.35385 4.972625 3.949964       2.210907 4.502812       3.017345 3.309022       3.248863 18.61516 5.916676 16.94951 6.127760 1.665648       8.518009 
1 1 1 14  15 29 o 13.99924 5.017247 2.243494       2.172473 1.851434       2.876300 2.764220       3.314841 14.36608 5.634917 16.13260 6.122009 -1.766522      8.320535 
1 1 1 14  15 30 o 22.60827 5.218729 6.979741       2.816953 7.296227       3.000862 4.632523       8.172306 23.03722 5.434041 21.56659 9.094875 1.470631       10.59460 
1 1 1 14  15 31 o 16.05103 5.225912 3.450568       2.344276 3.522611       2.951519 3.327452       3.858402 16.48750 5.854705 16.90784 6.556483 -0.4203377     8.790053 
1 1 1 14  15 32 o 44.81423 3.936302 26.42580       4.255102 26.57185       4.724315 25.79821       9.793546 44.52626 4.411932 36.35290 10.48110 8.173367       11.37183 
1 1 1 14  15 33 o 15.85270 5.553511 3.499734       2.648780 5.384392       3.443946 0.7704098      4.144456 18.83065 6.341669 14.13238 6.217071 4.698265       8.880807 
1 1 1 14  15 34 o 11.23688 5.002872 -0.8599610E-01 2.763113 -0.5042303     3.355187 0.7954792      4.870932 11.83927 5.370591 14.61298 6.564054 -2.773704      8.481159 
1 1 1 14  15 35 o 11.07709 5.221612 -1.983082      3.657608 0.5758918      8.248204 -2.609454      4.080774 16.22352 7.704689 11.33497 5.393424 4.888550       9.404852 
1 1 1 14  15 36 o 12.72834 5.406485 1.635343       2.922637 4.088367       3.949124 -1.335162      4.345752 15.87930 6.473776 12.05476 5.685285 3.824543       8.615813 
1 1 1 14  15 37 o 11.38659 5.178035 0.1724228      3.142766 -6.756892      4.528327 6.611620       4.365243 9.829569 4.884017 17.97902 6.973289 -8.149456      8.513542 
1 1 1 14  15 38 o 21.68367 6.026759 8.556704       3.298970 8.692669       4.483595 8.396201       4.871389 19.67032 7.185797 18.85958 7.351939 0.8107471      10.28040 
1 1 1 14  16 0  o 45.61984 3.094275 25.50396       3.419567 23.77778       6.825601 26.08240       3.951191 43.57026 6.637999 46.09605 3.544654 -2.525787      7.525131 
1 1 1 14  16 1  o 179.0309 2.989742 390.9770       13.04361 366.7843       19.85993 409.3292       17.29734 173.1958 4.709857 183.1144 3.876330 -9.918655      6.099892 
1 1 1 14  16 2  o 231.2809 3.498281 652.7979       19.71653 642.5916       30.71262 659.9529       25.71506 229.1971 5.498847 232.4181 4.540268 -3.221008      7.131014 
1 1 1 14  16 3  o 166.2406 3.215405 337.2016       13.02594 350.8601       25.24333 332.2448       15.20692 169.1521 6.134130 164.9699 3.782688 4.182205       7.206682 
1 1 1 14  16 4  o 320.2187 4.480446 1252.932       34.96262 1211.567       53.82978 1283.115       45.98174 314.2405 7.029499 323.7364 5.828513 -9.495941      9.131562 
1 1 1 14  16 5  o 197.9742 3.167382 478.2601       15.28076 467.4590       23.38028 486.3143       20.18963 195.4623 4.912414 199.5285 4.152287 -4.066177      6.432208 
1 1 1 14  16 6  o 79.31770 2.839175 76.84898       5.478949 92.96412       12.20716 72.78365       6.131206 86.93420 5.795288 77.15613 3.268317 9.778076       6.653365 
1 1 1 14  16 7  o 21.52072 7.534838 5.045126       4.875502 -1.947749      6.615507 13.35866       7.213202 17.75005 7.829834 32.39345 8.876236 -14.64340      11.83613 
1 1 1 14  16 8  o 63.02350 4.264762 48.76686       6.511306 44.90113       9.831371 51.78749       8.690551 60.08754 6.835564 64.78895 5.558056 -4.701408      8.810046 
1 1 1 14  16 9  o 169.9013 4.137142 352.8127       17.12904 312.4934       26.86292 380.4389       22.23600 159.3066 6.936263 176.1975 5.184340 -16.89090      8.659626 
1 1 1 14  16 10 o 146.7187 3.972858 263.2735       14.19138 268.0546       23.24628 260.4330       17.91768 147.5902 6.479171 145.7560 5.052154 1.834259       8.216077 
1 1 1 14  16 11 o 40.58709 5.744016 20.59953       5.522625 12.70524       8.136024 27.34467       7.520577 31.86480 9.649820 46.67627 6.812518 -14.81148      11.81226 
1 1 1 14  16 12 o 17.13884 7.034841 1.201133       4.702806 -3.315349      6.629935 5.774843       6.671806 16.92277 7.624995 23.95357 8.763247 -7.030794      11.61615 
1 1 1 14  16 13 o 261.4020 6.339341 840.3658       40.38213 832.4180       56.05656 848.9397       58.22292 258.8570 8.899732 261.2684 9.158899 -2.411407      12.77070 
1 1 1 14  16 14 o 58.38847 5.704576 42.26654       8.013411 44.08079       10.99571 40.21150       11.70265 59.21009 7.810970 56.26509 8.825144 2.944992       11.78535 
1 1 1 14  16 15 o 145.2304 4.807450 258.8831       16.99063 272.0656       23.98732 245.6101       24.06965 148.3965 6.650076 140.8660 7.034021 7.530579       9.679926 
1 1 1 14  16 16 o 104.0854 6.414715 134.1080       16.19154 134.1080       16.19154 0.000000       0.000000 104.0854 6.414715 ?        ?        0.000000       6.414715 
1 1 1 14  16 17 o 76.60355 6.867394 73.16656       12.68380 73.16656       12.68380 0.000000       0.000000 76.60355 6.867394 ?        ?        0.000000       6.867394 
1 1 1 14  16 18 o 112.9794 4.768166 157.0728       13.09812 161.7237       18.16934 152.0407       18.89931 114.1467 6.559522 110.5061 7.055012 3.640633       9.633303 
1 1 1 14  16 19 o 57.95320 5.696471 41.84800       7.941022 40.63638       10.57530 43.41438       12.02432 56.53278 7.891099 58.20330 8.748047 -1.670525      11.78125 
1 1 1 14  16 20 o 126.0960 4.777893 196.0924       14.65506 183.3756       19.63660 212.0806       22.01799 121.2399 6.672093 130.2776 6.960674 -9.037666      9.641981 
1 1 1 14  16 21 o 19.29184 7.771128 2.315771       5.612782 -0.4938975E-01 7.185035 6.018812       8.990375 19.53941 8.392613 25.87207 10.01487 -6.332659      13.06651 
1 1 1 14  16 22 o 65.19237 5.289044 53.05132       8.330421 62.26940       11.44092 42.64951       12.15332 70.15191 6.776719 57.08204 9.037571 13.06987       11.29609 
1 1 1 14  16 23 o 33.13020 7.963345 14.56257       6.349340 17.12713       7.968805 10.10383       10.50734 35.67941 9.128813 29.70990 10.97560 5.969503       14.27582 
1 1 1 14  16 24 o 48.47453 6.220346 30.12019       7.178778 28.52128       9.220459 32.58120       11.43924 46.20552 8.502038 48.72775 9.969834 -2.522228      13.10276 
1 1 1 14  16 25 o 57.22746 5.706522 41.77649       7.852172 46.71977       10.37156 35.13809       12.01899 59.75117 7.272593 50.08370 10.19476 9.667477       12.52293 
1 1 1 14  16 26 o 20.71186 8.110559 4.075889       5.950534 10.99509       7.932947 -4.825855      8.997963 28.45019 9.624792 18.57539 8.563684 9.874798       12.88306 
1 1 1 14  16 27 o 11.35397 4.568498 0.8278282      1.937460 0.000000       0.000000 0.8278282      1.937460 ?        ?        11.35397 4.568498 0.000000       4.568498 
1 1 1 14  16 28 o 9.705128 4.230634 -0.2341934     1.880640 0.6711078      2.654885 -1.145990      2.664393 12.54534 5.229858 10.67669 4.820100 1.868649       7.112298 
1 1 1 14  16 29 o 18.21069 4.844552 4.453865       2.187243 4.827157       2.957240 4.003036       3.249887 18.89639 5.836236 17.70857 6.154902 1.187811       8.482009 
1 1 1 14  16 30 o 10.81907 4.530686 0.4848019      2.005965 1.014390       2.595062 -0.3014150     3.161914 12.64797 5.212229 12.26908 5.412552 0.3788891      7.514191 
1 1 1 14  16 31 o 10.11226 4.606613 -1.090137      2.501164 0.8035775E-02  2.666651 -9.123218      7.212271 11.50202 5.025379 13.57495 6.629399 -2.072934      8.318856 
1 1 1 14  16 32 o 23.37528 4.866391 7.669273       2.681800 8.473393       3.551716 6.602767       4.090340 23.75434 6.103299 20.59921 6.911032 3.155138       9.220229 
1 1 1 14  16 33 o 10.99343 4.873897 -0.1139833     2.594802 0.5086603      3.223751 -1.259543      4.372709 12.61538 5.518322 12.88371 5.950450 -0.2683344     8.115401 
1 1 1 14  16 34 o 10.52075 4.724089 -0.3139918     2.520314 -0.7236701     3.352432 0.2185157      3.822094 11.57767 5.296658 12.93131 5.811125 -1.353642      7.862809 
1 1 1 14  16 35 o 11.36645 4.989436 0.5012283      2.656082 0.6751320      3.555170 0.2815385      3.995867 12.68618 5.659737 12.87224 5.847764 -0.1860533     8.138118 
1 1 1 14  16 36 o 16.99295 6.664165 5.297454       4.022437 1.196757       8.888754 6.353468       4.510730 15.64826 7.576694 17.95847 7.052802 -2.310209      10.35125 
1 1 1 14  16 37 o 12.41345 5.418705 1.508518       3.094362 5.239620       4.231590 -2.779609      4.536479 16.39927 6.695423 11.21301 5.425247 5.186258       8.617539 
1 1 1 14  17 0  o 191.2630 3.110574 446.3066       14.49798 432.7991       22.41159 456.0268       19.01182 188.1032 4.893384 193.2486 4.037116 -5.145386      6.343777 
1 1 1 14  17 1  o 155.1336 3.116279 293.6291       11.78090 262.2880       21.69356 306.7380       14.02998 146.2189 6.101641 158.5208 3.631908 -12.30186      7.100759 
1 1 1 14  17 2  o 182.7110 3.035639 407.2896       13.51609 396.9571       20.92529 414.6865       17.70502 180.1431 4.770901 184.2800 3.942594 -4.136932      6.189147 
1 1 1 14  17 3  o 189.7872 3.105107 439.4950       14.36084 442.7793       22.49200 437.2346       18.65933 190.2398 4.855632 189.2053 4.046939 1.034500       6.320988 
1 1 1 14  17 4  o 157.0252 2.822424 300.7943       10.80010 295.6144       16.58650 304.6069       14.23013 155.4737 4.382232 157.9489 3.697058 -2.475250      5.733428 
1 1 1 14  17 5  o 168.2731 2.901974 345.4761       11.89993 339.0922       18.13602 350.3025       15.76920 166.4982 4.473940 169.3613 3.820845 -2.863083      5.883451 
1 1 1 14  17 6  o 116.4761 2.967506 165.6523       8.416099 169.3042       17.54865 164.5614       9.591056 117.3487 6.158173 116.0538 3.394985 1.294876       7.031999 
1 1 1 14  17 7  o 79.86693 3.960389 78.12379       7.683944 99.66000       12.66890 65.59091       9.664510 89.99101 5.808035 72.97775 5.474319 17.01327       7.981318 
1 1 1 14  17 8  o 122.8744 3.814574 184.6316       11.40821 160.5500       17.61832 202.0187       14.97044 114.1926 6.356349 128.4039 4.792732 -14.21129      7.960744 
1 1 1 14  17 9  o 102.4273 3.877081 128.3859       9.659884 122.0221       15.05071 132.8436       12.59678 99.50715 6.238170 104.0484 4.982557 -4.541206      7.983773 
1 1 1 14  17 10 o 51.18383 5.233702 32.42976       6.436167 42.21656       9.909020 25.28777       8.464861 58.13494 7.144585 44.59459 8.087078 13.54036       10.79101 
1 1 1 14  17 11 o 19.13641 7.299046 3.137656       4.726991 3.177113       6.796760 3.100692       6.578529 21.72233 8.617915 21.39825 8.481927 0.3240738      12.09180 
1 1 1 14  17 12 o 201.6982 4.553367 498.0739       22.38056 500.7643       37.16602 496.5432       28.03310 201.2498 7.591960 201.0285 5.728230 0.2213440      9.510546 
1 1 1 14  17 13 o 73.99365 6.632094 67.96458       11.83193 67.96458       11.83193 0.000000       0.000000 73.99365 6.632094 ?        ?        0.000000       6.632094 
1 1 1 14  17 14 o 37.19016 9.352036 17.90926       8.465890 17.90926       8.465890 0.000000       0.000000 37.19016 9.352036 ?        ?        0.000000       9.352036 
1 1 1 14  17 15 o 82.61166 6.817933 84.83941       13.60348 84.83941       13.60348 0.000000       0.000000 82.61166 6.817933 ?        ?        0.000000       6.817933 
1 1 1 14  17 16 o 96.48669 4.707479 114.5165       11.03517 126.5610       15.30375 101.4708       15.92709 101.0929 6.242588 90.19679 7.308746 10.89610       9.611851 
1 1 1 14  17 17 o 62.40133 5.468094 48.30068       8.231125 50.68338       11.15735 45.45532       12.19255 63.49557 7.346117 59.73539 8.625304 3.760185       11.32967 
1 1 1 14  17 18 o 33.55779 8.233818 14.63468       6.681925 14.43113       9.008810 14.88359       9.962307 33.53873 10.15369 34.21032 10.73514 -0.6715851     14.77635 
1 1 1 14  17 19 o 26.44107 8.616960 8.566353       6.372927 12.80955       9.280663 4.780165       8.766647 31.98365 10.39684 24.84172 9.808893 7.141933       14.29366 
1 1 1 14  17 20 o 103.7971 4.778918 133.1186       12.05547 124.5230       16.20815 143.7622       18.03596 99.71140 6.709469 107.0639 6.950464 -7.352509      9.660535 
1 1 1 14  17 21 o 58.74703 5.545302 43.20741       7.844728 47.16480       10.36152 37.89248       12.00791 60.89639 7.116272 53.59914 9.543224 7.297249       11.90439 
1 1 1 14  17 22 o 63.30679 5.395219 50.21780       8.244061 47.62330       10.73872 53.94143       12.86495 60.91362 7.385044 64.42610 8.393647 -3.512486      11.17999 
1 1 1 14  17 23 o 30.52436 8.301348 12.46574       6.336749 10.76806       8.388115 14.72253       9.671273 29.07957 9.896405 33.08476 10.60115 -4.005194      14.50252 
1 1 1 14  17 24 o 52.98990 6.186183 36.05571       7.838148 33.78200       10.46568 38.96021       11.82867 49.95371 8.924887 53.43502 9.428465 -3.481308      12.98266 
1 1 1 14  17 25 o 31.01755 10.70333 13.20718       9.820339 0.000000       0.000000 13.20718       9.820339 ?        ?        31.01755 10.70333 0.000000       10.70333 
1 1 1 14  17 26 o 25.31347 9.851644 7.294821       8.735758 0.000000       0.000000 7.294821       8.735758 ?        ?        25.31347 9.851644 0.000000       9.851644 
1 1 1 14  17 27 o 28.80939 8.271009 11.89278       6.111047 12.57915       8.201760 11.03619       9.162479 29.25492 9.785854 27.96977 10.26350 1.285151       14.18106 
1 1 1 14  17 28 o 47.55636 6.080476 30.44815       6.885660 30.54149       9.387429 30.33945       10.13056 45.42389 8.798472 44.48885 9.624498 0.9350433      13.04010 
1 1 1 14  17 29 o 10.69574 4.506678 0.3710553      2.003876 7.952940       7.058393 -0.2936090     2.089866 23.59912 8.938441 10.07701 4.424528 13.52211       9.973574 
1 1 1 14  17 30 o 20.72475 4.565671 5.838305       2.243478 8.987044       3.146730 2.583191       3.199442 25.47933 5.242946 15.37434 5.968040 10.10499       7.943927 
1 1 1 14  17 31 o 24.67202 4.609570 8.351497       2.669531 12.14285       3.540525 3.356294       4.063938 29.51991 5.106460 16.76856 6.660219 12.75135       8.392524 
1 1 1 14  17 32 o 11.72652 5.243620 -0.3101961     3.070167 -0.3101961     3.070167 0.000000       0.000000 11.72652 5.243620 ?        ?        0.000000       5.243620 
1 1 1 14  17 33 o 12.74650 5.166750 1.610595       2.498491 3.934471       3.336150 -1.357563      3.770358 16.48437 6.166277 11.87938 5.500243 4.604981       8.262908 
1 1 1 14  17 34 o 16.80942 5.633693 4.388816       2.718134 3.443546       3.662488 5.547861       4.055536 15.62963 6.283906 18.13037 6.795247 -2.500743      9.255423 
1 1 1 14  17 35 o 10.92618 4.890759 0.1101133      2.678225 4.646294       3.651230 -5.173160      3.940448 16.57989 6.391808 9.786947 4.804524 6.792944       7.996165 
1 1 1 14  17 36 o 9.149445 4.355306 -1.972570      2.666621 -2.126511      3.567518 -1.777663      4.014226 10.48852 5.005222 11.24737 5.351038 -0.7588491     7.327064 
1 1 1 14  17 37 o 9.622795 4.688803 -3.517354      3.550693 -0.6936988     7.782027 -4.259734      3.990251 14.00984 6.851308 9.905393 4.856971 4.104448       8.398249 
1 1 1 14  18 0  o 75.14371 2.503541 68.93942       4.578009 63.18465       7.034461 73.16755       6.029635 71.81409 4.035861 77.36802 3.205051 -5.553932      5.153690 
1 1 1 14  18 1  o 128.6980 2.633139 202.0220       8.258131 206.9602       13.00165 198.6825       10.69179 130.1010 4.106065 127.5369 3.443309 2.564110       5.358745 
1 1 1 14  18 2  o 140.2487 2.699918 239.9341       9.227531 215.2707       13.83028 259.7215       12.38793 132.6635 4.283640 145.8628 3.485125 -13.19922      5.522288 
1 1 1 14  18 3  f 85.77153 2.850408 89.85328       5.949528 95.82955       12.38960 88.06216       6.782739 88.26087 5.792417 84.87771 3.285461 3.383163       6.659305 
1 1 1 14  18 4  o 182.6025 3.033733 406.8928       13.49958 422.2852       21.34114 396.6254       17.42982 185.7650 4.718123 180.1864 3.969491 5.578522       6.165837 
1 1 1 14  18 5  o 62.51537 3.062793 47.80959       4.651752 51.34468       5.639208 40.28194       8.229013 64.74461 3.588231 57.01086 6.013666 7.733749       7.002826 
1 1 1 14  18 6  o 97.01390 3.268725 115.0263       7.716631 114.0545       10.28371 116.2787       11.67395 96.48520 4.385202 97.35274 4.936893 -0.8675385     6.603250 
1 1 1 14  18 7  o 188.9327 4.318617 436.4546       19.88328 421.9237       32.57229 445.0853       25.10306 185.0409 7.237404 190.5266 5.412218 -5.485657      9.037263 
1 1 1 14  18 8  o 158.2903 4.060515 306.4892       15.64994 301.1997       25.46463 309.6996       19.83874 156.3923 6.697191 158.9334 5.128989 -2.541107      8.435574 
1 1 1 14  18 9  o 187.9428 4.334539 432.0746       19.85202 467.8586       34.42905 414.2516       24.29803 194.7516 7.267256 183.7421 5.432546 11.00946       9.073343 
1 1 1 14  18 10 f 99.96944 4.865745 122.6897       11.81806 112.8011       14.93228 139.2682       19.33452 95.56937 6.449442 105.9933 7.534585 -10.42397      9.917927 
1 1 1 14  18 11 o 79.44896 5.134345 77.69853       9.887298 65.23246       11.76269 107.7134       18.25197 72.48502 6.736293 92.96925 8.138255 -20.48424      10.56451 
1 1 1 14  18 12 o 149.6993 5.061754 275.1161       18.43877 292.6165       24.81040 253.5245       27.55823 153.9850 6.627310 142.9090 7.944533 11.07597       10.34586 
1 1 1 14  18 13 o 67.86542 4.949785 56.78302       8.129702 57.46545       11.17158 56.01482       11.85291 67.91673 6.843173 66.92310 7.390951 0.9936371      10.07250 
1 1 1 14  18 14 o 34.20049 8.027177 15.08888       6.574544 8.729880       9.127954 21.94425       9.477516 28.52260 10.27660 41.08867 9.633644 -12.56606      14.08601 
1 1 1 14  18 15 o 121.8523 4.737450 182.4914       14.04061 173.7466       19.04401 192.9057       20.78256 118.4018 6.626746 124.7021 6.865436 -6.300339      9.541906 
1 1 1 14  18 16 o 66.29936 5.379921 54.44231       8.617409 60.03090       12.12115 48.73087       12.25364 69.18999 7.298785 61.98517 8.322339 7.204826       11.06949 
1 1 1 14  18 17 f 140.4042 4.880946 242.7224       16.67474 222.2795       22.32157 268.5350       25.08246 133.6667 6.875866 146.8828 7.027887 -13.21616      9.832026 
1 1 1 14  18 18 o 31.08736 8.260036 12.56130       6.363358 16.99073       9.148530 8.409801       8.856853 35.98764 10.04880 27.84432 10.11039 8.143320       14.25477 
1 1 1 14  18 19 o 136.5825 4.907240 230.3804       16.30655 218.4034       21.97848 245.0464       24.32091 132.1442 6.848539 139.8248 7.161575 -7.680679      9.909120 
1 1 1 14  18 20 o 105.2721 4.772271 137.1360       12.21078 136.2174       16.51661 138.2433       18.13375 104.2229 6.536025 104.7087 7.149609 -0.4857559     9.686926 
1 1 1 14  18 21 o 36.30535 7.978661 17.37819       6.865896 19.91896       9.112947 14.04238       10.44184 38.44543 9.722383 33.01952 11.04158 5.425911       14.71194 
1 1 1 14  18 22 o 30.39936 8.005684 12.30335       6.011485 13.20341       7.827144 11.00882       9.386882 31.42978 9.453326 29.76994 10.45260 1.659836       14.09334 
1 1 1 14  18 23 o 26.23410 8.423409 8.944251       6.103681 13.52520       8.092768 2.900518       9.295486 31.54687 9.638498 23.37001 9.767431 8.176851       13.72237 
1 1 1 14  18 24 o 35.05113 10.86488 17.57282       10.23802 0.000000       0.000000 17.57282       10.23802 ?        ?        35.05113 10.86488 0.000000       10.86488 
1 1 1 14  18 25 o 29.40048 8.466365 12.04815       6.393919 15.33786       8.685479 8.156115       9.447203 32.61334 9.989228 26.49403 10.26329 6.119310       14.32201 
1 1 1 14  18 26 o 15.46758 6.956059 -1.628968      5.487982 -2.879405      7.203337 0.1009535      8.472586 17.07089 7.792368 20.08959 8.861422 -3.018705      11.80025 
1 1 1 14  18 27 o 29.09495 8.110034 12.29007       5.964513 9.344963       8.086300 15.80445       8.833304 25.92710 9.619235 31.86121 10.12301 -5.934111      13.96442 
1 1 1 14  18 28 o 14.35412 6.537198 -1.788454      5.032533 -3.552881      6.638845 0.5950979      7.716193 15.55824 7.236120 18.90538 8.391943 -3.347135      11.08089 
1 1 1 14  18 29 o 12.89357 6.072006 -3.752299      4.924503 -7.248731      6.885771 -0.9169537E-01 7.045575 14.06635 6.775522 17.47755 7.868944 -3.411200      10.38403 
1 1 1 14  18 30 o 23.26738 9.218205 8.816754       7.766571 8.816754       7.766571 0.000000       0.000000 23.26738 9.218205 ?        ?        0.000000       9.218205 
1 1 1 14  18 31 o 9.537494 4.177076 -0.1019145     1.852107 1.530386       2.637507 -1.689849      2.601416 13.05834 5.302897 9.739538 4.529780 3.318800       6.974212 
1 1 1 14  18 32 o 21.47965 4.901599 6.621780       2.508873 7.299919       3.504919 5.909176       3.592881 21.59819 6.282965 19.42073 6.476504 2.177465       9.023345 
1 1 1 14  18 33 o 15.88431 5.418243 3.734899       2.514579 7.622160       3.652954 0.2340162      3.466659 21.50521 6.455812 12.49603 5.580924 9.009186       8.533710 
1 1 1 14  18 34 o 10.79854 5.000656 -1.033318      3.118518 2.144280       3.518898 -12.66183      6.731616 14.00083 5.939105 11.13202 5.593408 2.868804       8.158381 
1 1 1 14  18 35 o 13.26856 5.328046 2.342929       2.629560 4.250988       3.709268 0.4152124      3.728325 15.92659 6.350770 12.41146 5.642424 3.515130       8.495247 
1 1 1 14  18 36 o 13.49016 5.457636 2.631901       2.781618 3.007279       3.752589 2.174112       4.144088 14.29301 6.100463 13.77087 6.129192 0.5221462      8.647696 
1 1 1 14  19 0  o 139.4733 2.726093 237.3018       9.265474 242.5655       14.54147 233.7041       12.02187 140.8302 4.242009 138.3079 3.569868 2.522385       5.544240 
1 1 1 14  19 1  o 202.2801 3.238028 499.4055       15.96136 479.3165       24.47391 514.2743       21.05539 197.8593 5.080075 205.1484 4.211716 -7.289017      6.598918 
1 1 1 14  19 2  o 193.5122 3.166130 457.0365       14.93046 449.2262       23.08771 462.6506       19.57431 191.5569 4.950068 194.5830 4.128055 -3.026154      6.445464 
1 1 1 14  19 3  f 333.7379 5.235617 1363.547       42.58037 1314.110       83.46967 1380.938       49.50645 325.1335 10.54888 335.5929 6.053589 -10.45944      12.16243 
1 1 1 14  19 4  o 79.52763 2.672044 77.24750       5.171072 92.05109       9.752789 71.45830       6.098945 86.62933 4.636742 76.43777 3.281887 10.19157       5.680683 
1 1 1 14  19 5  o 221.8483 4.462022 601.8958       24.12258 584.1066       28.26680 649.5737       46.27619 218.3776 5.311687 229.2881 8.295763 -10.91057      9.850569 
1 1 1 14  19 6  o 163.5364 3.135629 326.4864       12.49612 317.4155       17.12053 336.8285       18.28083 161.0457 4.366493 165.8737 4.526769 -4.828018      6.289507 
1 1 1 14  19 7  o 204.3220 5.487029 512.1442       27.29576 503.4611       36.98880 522.5267       40.44659 201.9777 7.528204 205.5707 8.089717 -3.593018      11.05067 
1 1 1 14  19 8  o 92.06938 4.726078 104.0449       10.56809 105.8867       13.48404 101.1121       17.01569 92.67729 6.002791 90.18585 7.819589 2.491440       9.857965 
1 1 1 14  19 9  o 67.40405 4.464679 55.84456       7.292189 63.73508       11.27868 50.17697       9.558827 71.69624 6.526917 63.59769 6.248335 8.098545       9.035616 
1 1 1 14  19 10 o 89.61549 4.072610 98.43944       8.870651 102.1410       13.92834 95.91348       11.50591 90.91215 6.326441 88.25968 5.375101 2.652466       8.301540 
1 1 1 14  19 11 o 61.44066 4.700345 46.51870       6.984123 50.81992       10.44792 43.04402       9.390558 63.85747 6.819435 58.74060 6.678643 5.116867       9.545101 
1 1 1 14  19 12 o 41.81712 6.179727 21.97688       6.107935 24.63355       8.954626 19.66542       8.352611 43.78124 8.699753 38.99466 8.975938 4.786583       12.50013 
1 1 1 14  19 13 o 146.6323 4.932257 264.1596       17.59919 286.7939       24.99705 241.9125       24.78237 152.2497 6.754274 139.6209 7.309227 12.62877       9.952137 
1 1 1 14  19 14 o 37.33398 7.501636 17.88054       6.587823 12.24763       8.611245 25.82955       10.22954 31.40912 9.996771 44.56056 9.696567 -13.15144      13.92691 
1 1 1 14  19 15 o 76.70841 5.066963 72.64265       9.418627 91.66894       13.61510 55.18118       13.04320 85.85837 6.556919 66.03316 8.287692 19.82520       10.56783 
1 1 1 14  19 16 o 83.10329 4.962108 85.25176       10.00319 81.73169       13.56928 89.44193       14.80459 80.85846 6.953927 84.51891 7.258187 -3.660454      10.05179 
1 1 1 14  19 17 f 30.19189 8.248145 11.81269       6.239297 5.112525       8.429406 19.93163       9.279059 24.79520 9.669551 38.89059 9.797158 -14.09539      13.76534 
1 1 1 14  19 18 o 83.28577 4.960155 85.85538       10.02145 82.44616       13.57347 89.94067       14.85848 81.00637 6.942884 84.50588 7.286338 -3.499512      10.06451 
1 1 1 14  19 19 o 96.34680 4.845725 114.9351       11.34059 114.7027       15.45400 115.2063       16.69367 95.57146 6.677557 95.54251 7.223513 0.2895355E-01  9.837119 
1 1 1 14  19 20 o 93.86700 4.847413 109.3721       11.05059 113.0057       15.01639 105.0798       16.32075 94.70895 6.546650 90.88123 7.434270 3.827713       9.905908 
1 1 1 14  19 21 o 70.49971 5.292047 62.28708       9.025385 56.79771       12.00380 69.42622       13.68928 66.35574 7.557989 73.31854 7.780427 -6.962799      10.84704 
1 1 1 14  19 22 o 28.51033 10.66594 9.367743       9.982079 0.000000       0.000000 9.367743       9.982079 ?        ?        28.51033 10.66594 0.000000       10.66594 
1 1 1 14  19 23 o 57.22738 5.702823 41.80867       7.847221 44.73148       10.74137 38.46315       11.49190 58.12813 7.777958 53.00368 9.232444 5.124451       12.07206 
1 1 1 14  19 24 o 17.26606 7.316312 0.9381253      5.330405 2.853799       7.120872 -1.503402      8.039023 20.83674 8.615064 19.06853 8.508691 1.768211       12.10856 
1 1 1 14  19 25 o 11.01177 5.411316 -9.569283      5.039302 -11.05807      6.529643 -7.376514      7.924469 12.84013 6.278546 16.03588 7.596989 -3.195753      9.855678 
1 1 1 14  19 26 o 17.66601 7.453302 1.602021       5.492413 2.570184       7.454962 0.4526165      8.122833 20.40784 8.650193 19.72293 8.689062 0.6849022      12.26074 
1 1 1 14  19 27 o 23.00504 8.170118 7.332402       5.747838 3.713414       7.545471 12.33576       8.872046 20.86936 8.766347 28.14761 10.13280 -7.278252      13.39860 
1 1 1 14  19 28 o 25.62442 9.442112 10.27511       7.767812 10.27511       7.767812 0.000000       0.000000 25.62442 9.442112 ?        ?        0.000000       9.442112 
1 1 1 14  19 29 o 22.84647 9.092927 7.914905       7.589937 7.914905       7.589937 0.000000       0.000000 22.84647 9.092927 ?        ?        0.000000       9.092927 
1 1 1 14  19 30 o 15.37682 6.863380 0.4616112      5.234612 1.007981       7.146142 -0.1709857     7.689392 17.42163 7.876816 17.24082 7.936884 0.1808128      11.18206 
1 1 1 14  19 31 f 17.28543 7.416899 3.141747       5.600787 12.43827       8.341852 -4.488774      7.557520 24.71402 9.624528 14.97990 7.185123 9.734126       12.01073 
1 1 1 14  19 32 f 18.84272 7.830566 5.593902       5.925087 1.737708       8.502692 9.234161       8.261202 17.58840 8.183315 21.48933 9.107155 -3.900932      12.24365 
1 1 1 14  19 33 o 11.20092 4.675775 0.9777675      2.126394 1.783953       3.083424 0.2466712      2.936317 13.37623 5.610408 11.64834 5.173361 1.727891       7.631536 
1 1 1 14  19 34 o 11.40380 4.867844 0.9696400      2.389814 -1.380414      3.386461 3.301039       3.372993 10.86145 5.089770 14.96038 6.024981 -4.098930      7.887087 
1 1 1 14  19 35 o 12.39795 5.449385 1.211476       3.177852 -1.660141      3.478618 15.69657       7.812753 10.65436 5.043322 22.91282 9.189714 -12.25846      10.48265 
1 1 1 14  19 36 o 13.44093 5.961358 2.066753       3.885701 1.727984       4.250115 3.791977       9.591174 13.40498 6.066326 15.83235 7.712631 -2.427376      9.812491 
1 1 1 14  20 0  o 105.9527 3.416067 137.1999       8.808597 124.9819       9.974064 180.5067       18.77804 101.0547 4.058483 121.1244 6.384384 -20.06963      7.565159 
1 1 1 14  20 1  o 303.8854 4.803655 1129.773       35.57277 1064.275       48.59484 1205.393       52.21500 294.3552 6.774581 313.2384 6.840443 -18.88321      9.627389 
1 1 1 14  20 2  o 103.3442 2.806530 130.4120       7.061380 138.3380       10.17210 123.0398       9.810319 106.3321 3.932410 100.2620 4.023404 6.070160       5.625978 
1 1 1 14  20 3  o 43.29670 3.164299 23.00541       3.315578 21.18401       4.953364 24.48390       4.462786 41.29908 5.025109 44.56289 4.157549 -3.263809      6.522035 
1 1 1 14  20 4  o 108.9638 2.555420 144.8507       6.785479 143.4222       10.29842 145.9467       9.020325 108.2633 3.909912 109.2703 3.391643 -1.006981      5.175969 
1 1 1 14  20 5  o 69.14844 2.673069 58.43065       4.495831 54.68861       7.614878 60.43298       5.570281 66.68191 4.716615 70.27574 3.261532 -3.593834      5.734461 
1 1 1 14  20 6  o 63.59883 2.406410 49.41390       3.722810 45.24252       5.334230 53.37510       5.198104 60.74538 3.619900 66.03458 3.240153 -5.289207      4.858216 
1 1 1 14  20 7  o 133.5819 3.926476 218.3394       12.76777 214.4452       20.24787 220.9099       16.45057 131.9440 6.315626 134.1847 5.039812 -2.240677      8.080028 
1 1 1 14  20 8  o 196.8341 4.460206 474.2383       21.39396 539.3171       37.89256 443.7860       25.92052 208.9234 7.454654 190.0783 5.602079 18.84512       9.324975 
1 1 1 14  20 9  o 174.0390 5.080915 371.6982       21.52582 370.4460       29.61656 373.1004       31.34077 173.1850 7.032218 173.6722 7.422425 -0.4871979     10.22470 
1 1 1 14  20 10 o 67.82395 4.514771 56.59156       7.419511 50.55871       10.75106 62.07760       10.25225 63.63275 7.051422 70.80128 5.998529 -7.168537      9.257694 
1 1 1 14  20 11 o 75.85683 4.447783 70.73694       8.185865 86.19855       12.86892 60.22932       10.60881 83.40259 6.380224 69.64436 6.319663 13.75822       8.980278 
1 1 1 14  20 12 o 123.6341 4.050716 187.3678       12.18764 184.3815       19.32796 189.3390       15.70304 122.0627 6.521479 124.0420 5.206497 -1.979286      8.344896 
1 1 1 14  20 13 o 49.71614 5.600843 30.79406       6.667639 32.65988       9.905079 29.24802       9.016383 50.59027 8.323653 47.89362 8.007860 2.696659       11.55028 
1 1 1 14  20 14 f 40.74110 7.496769 21.23846       7.168736 20.28967       9.748268 22.35583       10.57884 39.36924 10.10930 41.26436 10.49698 -1.895123      14.57342 
1 1 1 14  20 15 o 34.69905 7.849057 15.59896       6.481161 20.51666       9.478143 11.28009       8.882332 39.52565 9.870590 30.49484 10.18346 9.030802       14.18208 
1 1 1 14  20 16 o 52.77042 5.951255 34.87639       7.519734 27.14350       9.742663 46.27154       11.82679 45.63758 9.079854 60.20651 8.280028 -14.56893      12.28831 
1 1 1 14  20 17 o 72.88367 5.079818 65.86856       8.965769 69.38607       12.34181 61.93789       13.04654 74.28326 6.896684 69.84497 7.798103 4.438286       10.41031 
1 1 1 14  20 18 o 68.48531 5.278471 58.39918       8.741378 56.42691       11.91351 60.69931       12.86567 66.60560 7.468427 68.98517 7.789214 -2.379570      10.79117 
1 1 1 14  20 19 o 26.22498 8.147725 8.779044       5.753846 2.402184       7.783356 16.46333       8.544075 21.85446 9.018558 35.07650 9.679908 -13.22204      13.23008 
1 1 1 14  20 20 o 80.57829 7.214522 83.02493       14.01673 0.000000       0.000000 83.02493       14.01673 ?        ?        80.57829 7.214522 0.000000       7.214522 
1 1 1 14  20 21 o 29.15666 8.408190 11.36251       6.302112 11.23496       8.157493 11.55133       9.925402 29.36300 9.757946 30.27663 10.73782 -0.9136295     14.50925 
1 1 1 14  20 22 o 34.77273 7.500151 16.20422       6.168420 24.43053       8.475884 6.941278       8.994088 42.43924 8.492294 25.81161 10.00997 16.62762       13.12701 
1 1 1 14  20 23 o 19.61747 7.772233 3.330842       5.521176 8.120156       7.113144 -3.927716      8.756894 25.42433 9.082448 18.73359 8.566654 6.690733       12.48513 
1 1 1 14  20 24 o 27.79608 8.152768 10.76663       5.880196 10.81001       7.846732 10.71108       8.880613 27.95005 9.570346 28.10359 10.13501 -0.1535416     13.93951 
1 1 1 14  20 25 o 20.96184 7.953305 5.057396       5.594059 3.233148       7.369361 7.537933       8.593318 20.87959 8.709448 24.93488 9.751781 -4.055286      13.07485 
1 1 1 14  20 26 o 11.48379 5.595825 -7.958196      5.058763 -12.59420      7.027214 -2.971352      7.288267 12.85937 6.333118 16.79063 7.728715 -3.931259      9.992068 
1 1 1 14  20 27 o 26.86097 9.368446 11.33655       7.532851 11.33655       7.532851 0.000000       0.000000 26.86097 9.368446 ?        ?        0.000000       9.368446 
1 1 1 14  20 28 o 15.87435 7.008182 0.4492033      5.310238 8.860735       7.176946 -9.726446      7.893747 23.83278 9.016315 14.33102 6.984751 9.501764       11.40529 
1 1 1 14  20 29 o 14.32335 6.489352 -0.6614490     4.880228 0.3853946      6.258460 -2.285523      7.795239 16.46954 7.415631 16.53687 7.740560 -0.6732750E-01 10.71951 
1 1 1 14  20 30 o 18.96388 7.658894 5.045768       5.467412 9.547920       7.785012 0.6639949      7.680230 22.95116 9.184178 17.39325 7.979504 5.557913       12.16641 
1 1 1 14  20 31 o 15.11304 6.928893 -0.4779534E-01 5.778192 -5.084845      8.317770 4.650105       8.032869 15.18122 7.345450 19.06226 8.505693 -3.881041      11.23844 
1 1 1 14  20 32 o 29.23823 8.666044 17.00513       6.615009 25.94287       10.22090 10.56285       8.677507 31.25586 10.91195 21.60111 9.249598 9.654749       14.30474 
1 1 1 14  20 33 o 15.14802 6.885782 1.841130       5.550705 2.630969       8.617803 1.281137       7.256361 16.82999 7.958076 15.76914 7.408862 1.060851       10.87300 
1 1 1 14  20 34 o 10.37172 4.835262 -1.101036      2.992045 -1.217571      3.274011 -0.5105589     7.369747 10.71956 5.017232 14.61226 7.031126 -3.892696      8.637671 
1 1 1 14  20 35 o 15.38186 6.079494 4.050933       3.370625 4.755013       3.770500 1.249680       7.520803 16.14457 6.414329 14.84740 7.133585 1.297166       9.593312 
1 1 1 14  21 0  f 163.7017 2.931516 327.0504       11.69450 297.7555       17.35331 351.4238       15.82867 155.9517 4.571148 169.5952 3.829965 -13.64348      5.963558 
1 1 1 14  21 1  o 35.77909 3.553553 15.78866       3.057429 20.40892       4.587481 12.09633       4.101016 40.56864 4.728883 30.93928 5.647352 9.629358       7.365793 
1 1 1 14  21 2  o 24.97741 5.898478 7.959655       3.532481 8.030177       4.118598 7.763419       6.870302 25.11586 6.632253 26.13360 8.954914 -1.017744      11.14349 
1 1 1 14  21 3  o 259.9676 3.855398 825.9492       24.42444 847.6946       38.70779 811.5634       31.48345 262.7918 6.044363 257.4248 5.018752 5.366943       7.856348 
1 1 1 14  21 4  o 45.52309 3.351794 25.44599       3.692235 18.91340       7.971774 27.23009       4.166025 38.35092 8.726919 47.06691 3.660974 -8.715988      9.463713 
1 1 1 14  21 5  o 170.2680 2.962043 353.9164       12.29024 356.8007       18.88339 351.7966       16.18827 170.6808 4.544076 169.6365 3.916021 1.044327       5.998653 
1 1 1 14  21 6  o 91.77315 2.863965 102.9132       6.397164 106.4619       10.28573 100.6745       8.169440 93.14574 4.545158 90.68140 3.704703 2.464348       5.863726 
1 1 1 14  21 7  o 207.4987 4.570160 527.2330       23.10910 502.6804       37.54047 542.2136       29.32345 201.5670 7.656574 210.0500 5.734066 -8.483002      9.565701 
1 1 1 14  21 8  o 37.27801 6.605767 17.61291       5.781192 14.70835       8.110209 20.61342       8.243089 33.86835 9.462977 40.00413 8.703728 -6.135773      12.85701 
1 1 1 14  21 9  o 131.2008 4.041304 210.8571       12.90553 210.7593       20.59899 210.9202       16.55806 130.6258 6.491481 130.9940 5.197385 -0.3682098     8.315777 
1 1 1 14  21 10 o 83.50429 5.302159 85.98777       10.73369 100.6318       13.67278 62.46756       17.32793 90.15988 6.262022 69.79491 10.51404 20.36497       12.23756 
1 1 1 14  21 11 f 117.0834 4.622992 168.3871       13.16437 175.4501       18.22725 160.6855       19.03335 119.1107 6.302062 113.8077 6.895248 5.303040       9.341330 
1 1 1 14  21 12 o 84.96668 4.184928 88.68127       8.638424 101.1681       13.49299 80.00847       11.24509 90.35529 6.164926 80.39233 5.778555 9.962967       8.449735 
1 1 1 14  21 13 f 74.33288 5.133806 68.27822       9.242311 66.23946       12.54488 70.69853       13.66848 72.72680 7.171643 75.04153 7.578231 -2.314728      10.43370 
1 1 1 14  21 14 f 225.3162 5.924617 627.7643       32.50213 675.1882       47.19803 584.9918       44.82373 232.0070 8.361756 215.8018 8.540341 16.20523       11.95226 
1 1 1 14  21 15 o 31.97878 8.500628 13.31773       6.737585 5.273386       8.664324 25.62331       10.71619 25.12942 9.802367 44.01903 10.19123 -18.88961      14.14028 
1 1 1 14  21 16 o 81.77325 4.885344 82.74828       9.690764 65.94692       12.59257 107.1496       15.17569 72.27596 7.247321 92.46826 6.781893 -20.19230      9.925611 
1 1 1 14  21 17 o 56.05301 8.537860 40.69468       11.29448 0.000000       0.000000 40.69468       11.29448 ?        ?        56.05301 8.537860 0.000000       8.537860 
1 1 1 14  21 18 o 48.74613 9.271939 31.49529       10.61168 0.000000       0.000000 31.49529       10.61168 ?        ?        48.74613 9.271939 0.000000       9.271939 
1 1 1 14  21 19 o 61.99369 5.354289 48.24279       8.009623 37.42491       10.57758 62.78279       12.26302 53.38024 8.409442 69.95949 7.300384 -16.57925      11.13617 
1 1 1 14  21 20 o 63.37677 5.110200 50.45983       7.825446 55.92241       10.68343 44.13607       11.49476 66.03444 6.733126 57.78770 8.409117 8.246738       10.77257 
1 1 1 14  21 21 o 14.98901 6.792486 -2.510075      5.350482 -2.536849      6.948160 -2.471068      8.386671 17.33695 7.809235 19.20664 8.621470 -1.869690      11.63245 
1 1 1 14  21 22 o 19.63922 7.786332 3.304240       5.544884 6.795729       7.235080 -1.665447      8.631823 24.28365 9.081362 19.72890 8.809180 4.554750       12.65199 
1 1 1 14  21 23 o 107.9047 4.719279 147.2933       12.37942 137.3581       16.43472 160.3234       18.82125 102.3912 6.622150 110.1396 7.049445 -7.748337      9.671998 
1 1 1 14  21 24 o 27.56820 8.087631 10.76693       5.786089 7.988760       7.451915 14.98465       9.181780 24.86542 9.232539 31.52344 10.34731 -6.658024      13.86747 
1 1 1 14  21 25 o 56.37247 7.905931 44.97224       10.56253 44.97224       10.56253 0.000000       0.000000 56.37247 7.905931 ?        ?        0.000000       7.905931 
1 1 1 14  21 26 o 28.38278 8.102733 12.10876       5.880935 19.44363       8.225123 4.437154       8.411814 34.97869 9.434494 21.74038 9.200594 13.23831       13.17804 
1 1 1 14  21 27 o 25.61604 8.093917 10.18360       5.653898 19.50607       7.874488 0.2635651      8.122937 34.48595 9.200283 18.61157 8.407974 15.87438       12.46352 
1 1 1 14  21 28 o 16.18798 6.997597 1.548940       5.056915 1.977901       6.581427 0.9306849      7.901232 17.85988 7.846445 18.27607 8.270936 -0.4161911     11.40066 
1 1 1 14  21 29 o 18.64563 7.510935 4.649386       5.243305 7.043448       7.036280 1.659961       7.862656 21.21288 8.643890 18.16561 8.232848 3.047268       11.93719 
1 1 1 14  21 30 o 13.31953 6.318681 -3.257775      5.518047 -1.860205      7.481647 -4.924862      8.171270 15.83941 7.466974 15.26777 7.360931 0.5716410      10.48518 
1 1 1 14  21 31 o 14.90155 6.872642 -0.2081578E-01 5.803312 1.946859       8.424365 -1.797848      8.005863 17.47997 8.137138 15.76832 7.517340 1.711651       11.07806 
1 1 1 14  21 32 o 20.80294 8.162139 8.891259       6.036396 1.703950       8.707120 15.54233       8.376010 16.83584 7.972230 24.53506 9.618168 -7.699219      12.49262 
1 1 1 14  21 33 o 13.14487 6.452620 -5.105152      7.104465 0.000000       0.000000 -5.105152      7.104465 ?        ?        13.14487 6.452620 0.000000       6.452620 
1 1 1 14  21 34 o 10.19328 4.435400 0.4878086      2.059197 8.795259       8.793186 0.5787648E-02  2.118094 18.21774 8.422555 9.758973 4.360177 8.458768       9.484227 
1 1 1 14  22 0  o 183.3069 3.106209 410.2211       13.87541 402.3225       21.38403 415.9650       18.23549 181.2146 4.846746 184.4580 4.056802 -3.243362      6.320490 
1 1 1 14  22 1  o 71.74124 3.232276 62.97422       5.636332 63.22319       7.101256 62.55035       9.265749 71.79501 4.075606 71.23595 5.377296 0.5590668      6.747287 
1 1 1 14  22 2  o 226.7359 3.532015 628.0756       19.51546 655.8527       31.10171 610.0369       25.06357 231.2492 5.519095 223.2465 4.607041 8.002701       7.189244 
1 1 1 14  22 3  o 28.17098 4.399525 9.940749       2.921568 12.14866       4.484265 8.312336       3.851083 30.90994 6.169543 25.50658 6.246388 5.403362       8.779557 
1 1 1 14  22 4  o 226.0112 3.973303 624.6611       21.88355 605.6760       42.96668 631.3108       25.42883 221.1973 7.984153 227.0720 4.595435 -5.874710      9.212205 
1 1 1 14  22 5  o 31.55296 3.406420 12.30483       2.577767 13.86437       4.017906 11.21384       3.360561 33.24849 5.123301 29.89019 4.774221 3.358299       7.002956 
1 1 1 14  22 6  o 93.48369 2.499159 106.7258       5.688217 111.3483       8.500211 102.9770       7.654758 95.36494 3.664492 91.73267 3.430340 3.632278       5.019535 
1 1 1 14  22 7  o 75.95929 2.563709 70.50446       4.738740 75.66058       7.647401 67.29066       6.037570 78.53262 4.009288 74.12919 3.350898 4.403435       5.225218 
1 1 1 14  22 8  o 117.5857 4.003936 169.4243       11.45629 171.6017       18.15329 167.9831       14.76872 117.8406 6.344955 116.8578 5.199217 0.9828796      8.203068 
1 1 1 14  22 9  o 30.39526 7.430487 11.89085       5.456795 12.49550       7.779111 11.30510       7.656497 31.41248 9.418862 30.12581 9.404949 1.286669       13.31045 
1 1 1 14  22 10 o 90.71261 4.130824 101.0098       9.107500 108.2865       14.31965 96.06675       11.80221 93.47713 6.323456 88.20241 5.518595 5.274727       8.392913 
1 1 1 14  22 11 o 49.01765 5.324235 29.89495       6.257795 24.79970       8.787596 35.13721       8.913465 43.87197 8.526778 52.80006 7.107868 -8.928093      11.10080 
1 1 1 14  22 12 o 53.46118 5.108098 35.47778       6.573960 41.05126       9.933851 31.13501       8.768743 57.03374 7.315680 49.50435 7.503648 7.529392       10.47969 
1 1 1 14  22 13 f 94.98122 4.773254 111.2367       11.01271 121.6729       15.27128 99.92886       15.89616 98.90170 6.370173 89.27215 7.372690 9.629555       9.743493 
1 1 1 14  22 14 o 34.25735 7.599976 15.22867       6.178541 11.02907       7.753084 22.53710       10.22780 29.67073 9.490208 41.23679 10.22797 -11.56606      13.95261 
1 1 1 14  22 15 o 145.1210 7.243922 264.2608       25.53671 0.000000       0.000000 264.2608       25.53671 ?        ?        145.1210 7.243922 0.000000       7.243922 
1 1 1 14  22 16 o 44.32840 9.620008 26.13010       10.09282 0.000000       0.000000 26.13010       10.09282 ?        ?        44.32840 9.620008 0.000000       9.620008 
1 1 1 14  22 17 o 47.54065 6.324246 28.75148       7.145153 29.29727       9.819216 28.13725       10.41678 47.10154 8.880314 45.85737 9.628637 1.244164       13.09850 
1 1 1 14  22 18 o 56.12638 5.481888 39.67100       7.402319 43.03467       10.11311 35.78921       10.86411 57.76487 7.350562 51.94110 8.903398 5.823776       11.54562 
1 1 1 14  22 19 o 48.68536 6.012528 30.27958       6.981906 29.53668       9.409990 31.18945       10.41398 47.03645 8.523282 48.02454 9.233829 -0.9880905     12.56622 
1 1 1 14  22 20 o 65.11226 5.247445 53.57180       8.255734 59.09821       11.49366 47.68156       11.86599 67.44417 7.099590 59.79847 8.371950 7.645699       10.97696 
1 1 1 14  22 21 o 86.16279 4.801394 93.53497       10.04158 83.29876       13.24561 107.3684       15.39812 79.93754 6.866076 90.68044 7.022855 -10.74290      9.821583 
1 1 1 14  22 22 o 60.33056 5.414642 46.75534       7.875975 44.33501       10.42123 49.97913       12.02722 57.32187 7.651320 60.32627 8.409575 -3.004402      11.36942 
1 1 1 14  22 23 o 14.86605 6.942510 -4.592065      6.211504 -4.592065      6.211504 0.000000       0.000000 14.86605 6.942510 ?        ?        0.000000       6.942510 
1 1 1 14  22 24 o 18.90461 7.916969 2.408619       6.125462 2.408619       6.125462 0.000000       0.000000 18.90461 7.916969 ?        ?        0.000000       7.916969 
1 1 1 14  22 25 o 20.80753 7.832339 5.494293       5.400403 5.633311       7.241514 5.320099       8.106046 21.97586 8.835803 22.24156 9.193404 -0.2656975     12.75108 
1 1 1 14  22 26 o 25.56545 8.131989 10.05380       5.698938 11.84483       7.706950 7.892933       8.465362 26.92470 9.469795 23.65264 9.538077 3.272062       13.44068 
1 1 1 14  22 27 o 44.15942 6.726599 28.43741       7.010291 33.49355       9.439113 22.21807       10.46874 45.41671 8.846828 33.50362 11.05124 11.91308       14.15614 
1 1 1 14  22 28 o 24.27792 8.133436 9.873754       5.665490 17.91813       7.890887 1.314878       8.139314 31.11893 9.519403 18.30603 8.327912 12.81290       12.64805 
1 1 1 14  22 29 o 17.11100 7.299788 3.061878       5.368617 1.134700       7.486513 5.102045       7.702850 17.35254 7.929735 19.66214 8.566703 -2.309601      11.67344 
1 1 1 14  22 30 o 18.80821 7.654282 5.562101       5.509001 8.733146       7.827306 2.449366       7.755006 21.31419 8.939304 17.62990 8.061859 3.684288       12.03764 
1 1 1 14  22 31 o 28.68670 10.21406 20.91067       8.988787 0.000000       0.000000 20.91067       8.988787 ?        ?        28.68670 10.21406 0.000000       10.21406 
1 1 1 14  22 32 o 16.90443 7.812140 3.843259       7.553360 0.000000       0.000000 3.843259       7.553360 ?        ?        16.90443 7.812140 0.000000       7.812140 
1 1 1 14  22 33 o 15.86828 7.175041 3.609646       5.930822 6.634067       9.544819 1.707536       7.569452 17.66726 8.360292 15.50289 7.367745 2.164369       11.14353 
1 1 1 14  22 34 o 12.76503 6.201268 -2.567077      6.084945 -3.753554      9.464380 -1.731057      7.944581 14.24378 7.074513 14.10554 6.903266 0.1382380      9.884523 
1 1 1 14  23 0  o 145.0317 3.135056 256.8575       11.08011 268.8891       15.82964 245.3004       15.51441 148.1685 4.388924 141.4943 4.505201 6.674164       6.289634 
1 1 1 14  23 1  o 104.5192 2.668014 133.4118       6.789928 121.9644       9.993874 143.2263       9.253613 99.76947 4.119412 108.2087 3.513899 -8.439240      5.414521 
1 1 1 14  23 2  f 114.8150 2.693685 160.8993       7.536705 158.5989       11.40205 162.6842       10.04372 113.7864 4.118829 115.3190 3.578354 -1.532684      5.456131 
1 1 1 14  23 3  o 90.41780 2.615225 99.86375       5.756288 96.83056       8.674260 102.2506       7.694722 88.87996 4.015276 91.40729 3.460677 -2.527328      5.300823 
1 1 1 14  23 4  f 102.2594 2.623829 127.7212       6.533046 134.4699       9.977561 122.6564       8.643599 104.7752 3.914662 100.1087 3.548741 4.666512       5.283762 
1 1 1 14  23 5  o 342.7014 5.404737 1442.242       45.13636 1532.487       93.73519 1415.000       51.50029 348.8134 11.04131 339.0130 6.233863 9.800415       12.67958 
1 1 1 14  23 6  f 142.2828 3.642111 247.7531       12.61782 226.9139       21.63347 258.4973       15.53366 135.4879 6.571836 145.1930 4.395337 -9.705093      7.906200 
1 1 1 14  23 7  o 130.3841 2.966846 207.6749       9.426617 0.000000       0.000000 207.6749       9.426617 ?        ?        130.3841 2.966846 0.000000       2.966846 
1 1 1 14  23 8  o 41.58723 8.160277 22.21403       7.974428 0.000000       0.000000 22.21403       7.974428 ?        ?        41.58723 8.160277 0.000000       8.160277 
1 1 1 14  23 9  f 141.1317 4.769859 244.7954       16.38104 263.1131       23.26059 226.7718       23.07313 145.7697 6.564978 135.1471 7.030063 10.62260       9.618770 
1 1 1 14  23 10 o 55.14276 4.964347 37.67545       6.599593 41.87831       9.657760 33.99358       9.039368 57.71209 7.010728 51.82535 7.364555 5.886742       10.16794 
1 1 1 14  23 11 o 85.95030 4.789839 91.10632       9.992708 115.0152       14.57130 69.87904       13.72985 96.22004 6.248154 74.49837 7.672390 21.72166       9.894695 
1 1 1 14  23 12 o 86.00530 7.140555 92.71636       14.83072 0.000000       0.000000 92.71636       14.83072 ?        ?        86.00530 7.140555 0.000000       7.140555 
1 1 1 14  23 13 o 48.71323 8.154724 30.56702       9.338511 0.000000       0.000000 30.56702       9.338511 ?        ?        48.71323 8.154724 0.000000       8.154724 
1 1 1 14  23 14 o 42.54374 6.410806 23.01375       6.440138 17.80417       8.110309 31.90486       10.59532 36.70453 9.110228 49.36450 9.144384 -12.65997      12.90798 
1 1 1 14  23 15 o 70.04143 5.011884 61.00320       8.497912 60.75720       11.21364 61.33507       13.02433 69.35019 6.719431 69.24073 7.857722 0.1094589      10.33898 
1 1 1 14  23 16 f 45.36003 6.425280 26.27437       6.903780 20.63330       8.622848 36.34751       11.52265 39.25468 9.179053 52.33057 9.380252 -13.07589      13.12418 
1 1 1 14  23 17 o 15.48833 6.838053 -1.200826      5.056065 -1.226789      6.358144 -1.156169      8.338760 17.45878 7.689689 20.08916 8.828760 -2.630379      11.70805 
1 1 1 14  23 18 o 21.23472 7.938905 4.689672       5.528410 2.308412       7.014892 8.593007       8.981222 20.69051 8.552288 27.35704 10.13983 -6.666534      13.26491 
1 1 1 14  23 19 o 61.24406 5.253816 47.45184       7.765377 46.59001       10.37195 48.55110       11.71389 59.69747 7.280047 60.45083 8.159941 -0.7533607     10.93543 
1 1 1 14  23 20 o 87.61117 4.701180 96.58204       10.00021 101.8455       13.71826 90.61322       14.60855 88.81037 6.381225 83.03763 7.293333 5.772743       9.690858 
1 1 1 14  23 21 o 47.08662 7.724951 30.13928       8.556884 30.13928       8.556884 0.000000       0.000000 47.08662 7.724951 ?        ?        0.000000       7.724951 
1 1 1 14  23 22 o 25.16694 8.842372 8.518417       6.718307 8.518417       6.718307 0.000000       0.000000 25.16694 8.842372 ?        ?        0.000000       8.842372 
1 1 1 14  23 23 f 35.94034 7.395877 18.16200       6.261369 24.42064       8.354484 10.14150       9.457584 40.88468 8.655435 26.96433 10.31466 13.92035       13.46509 
1 1 1 14  23 24 o 12.95177 6.123642 -4.575715      5.100295 -2.554143      6.530613 -7.736781      8.166316 15.97617 7.339975 15.71619 7.519730 0.2599850      10.50817 
1 1 1 14  23 25 o 32.03884 8.076822 15.68001       6.303254 20.96333       8.698140 9.837214       9.147090 35.52354 9.752462 25.33702 10.01478 10.18652       13.97878 
1 1 1 14  23 26 o 24.78514 8.324734 9.840158       5.934779 12.57532       8.009468 6.510152       8.837598 26.85712 9.632654 22.25234 9.424523 4.604782       13.47626 
1 1 1 14  23 27 o 13.39656 6.269955 -2.727269      5.112255 -9.130368      6.592651 6.930328       8.096541 12.73865 6.245563 21.66285 9.089045 -8.924204      11.02805 
1 1 1 14  23 28 o 34.53041 7.727617 19.45918       6.339926 24.17590       8.895576 14.59005       9.038143 35.31907 9.925831 26.41119 10.08820 8.907885       14.15252 
1 1 1 14  23 29 o 30.87908 8.695878 17.72897       6.820282 26.37300       9.669989 9.172529       9.620871 34.67805 10.52412 21.75813 9.524973 12.91992       14.19444 
1 1 1 14  23 30 o 15.24156 7.272305 -1.900932      7.525179 0.000000       0.000000 -1.900932      7.525179 ?        ?        15.24156 7.272305 0.000000       7.272305 
1 1 1 14  23 31 o 24.98760 8.658662 13.82262       6.429452 25.78988       10.30125 6.185735       8.229067 29.12753 10.84738 18.38188 8.366809 10.74565       13.69924 
1 1 1 14  23 32 o 31.84689 8.711842 21.94441       6.955198 25.34214       10.35733 19.15382       9.386456 27.10530 10.67435 24.34889 9.960121 2.756403       14.59951 
1 1 1 14  23 33 o 22.21104 8.544528 12.84728       6.515006 18.16447       10.07385 9.024433       8.541763 21.89488 9.659951 18.33660 8.413351 3.558285       12.81012 
1 1 1 14  24 0  o 224.6378 4.512979 618.0275       24.70486 598.1686       41.58526 628.8589       30.71185 219.7597 7.777511 226.2942 5.569246 -6.534546      9.565886 
1 1 1 14  24 1  f 233.5069 3.617126 666.6305       20.58256 654.8965       31.69038 675.1918       27.06911 230.8840 5.632454 234.7176 4.732518 -3.833618      7.356716 
1 1 1 14  24 2  o 239.2788 4.174881 700.8918       24.34358 660.8974       32.30755 753.4244       37.02707 231.8773 5.717547 247.4112 6.141349 -15.53398      8.390860 
1 1 1 14  24 3  o 39.51919 3.611315 19.25550       3.439444 21.73759       5.296922 17.44608       4.522563 41.74435 5.328322 37.36803 5.099380 4.376316       7.375276 
1 1 1 14  24 4  o 28.83601 4.292631 10.40425       2.924620 13.79542       4.183886 7.163884       4.089792 33.09913 5.371072 23.78637 6.746039 9.312765       8.623077 
1 1 1 14  24 5  o 129.9890 3.160144 206.4955       10.01036 216.1429       20.12257 203.3229       11.53956 132.2752 6.260414 128.8669 3.678377 3.408310       7.261077 
1 1 1 14  24 6  o 51.70440 3.330754 32.82050       4.174358 36.37934       8.490769 31.68613       4.793696 53.88963 6.603386 50.72606 3.908068 3.163563       7.673181 
1 1 1 14  24 7  o 80.75184 2.432229 79.68209       4.780767 87.22529       8.681396 76.39886       5.727466 84.25129 4.242056 79.01158 2.979989 5.239708       5.184147 
1 1 1 14  24 8  o 100.9881 6.789959 126.8744       16.61277 0.000000       0.000000 126.8744       16.61277 ?        ?        100.9881 6.789959 0.000000       6.789959 
1 1 1 14  24 9  o 30.11551 9.703811 11.23949       8.095398 0.000000       0.000000 11.23949       8.095398 ?        ?        30.11551 9.703811 0.000000       9.703811 
1 1 1 14  24 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  24 11 o 121.3529 4.623464 181.4679       13.64767 181.7718       18.52524 181.1072       20.18254 120.8736 6.311072 120.4072 6.907382 0.4664001      9.356364 
1 1 1 14  24 12 o 34.96746 6.894288 15.76121       5.665860 21.25317       8.071176 10.42547       7.955547 40.32497 8.482720 29.08310 9.635470 11.24187       12.83740 
1 1 1 14  24 13 o 14.85833 6.598621 -1.547532      4.776392 -2.564610      6.236959 -0.1050406     7.427667 16.57802 7.438731 19.79410 8.517979 -3.216085      11.30888 
1 1 1 14  24 14 o 85.10275 4.709646 89.79149       9.729065 80.62357       12.49010 103.9368       15.51448 80.01653 6.460339 90.63074 7.080831 -10.61421      9.585100 
1 1 1 14  24 15 o 14.34347 6.516832 -2.709929      4.964187 -3.356250      6.286002 -1.638867      8.092029 16.11012 7.324904 19.57609 8.646428 -3.465973      11.33203 
1 1 1 14  24 16 o 34.11329 7.429138 15.37698       6.000525 9.017340       7.241865 29.30707       10.71793 26.93016 9.194786 46.42170 9.783468 -19.49154      13.42611 
1 1 1 14  24 17 o 73.27898 6.608570 68.75698       11.67444 68.75698       11.67444 0.000000       0.000000 73.27898 6.608570 ?        ?        0.000000       6.608570 
1 1 1 14  24 18 o 48.97005 5.587115 30.63345       6.548218 36.91139       9.054498 23.74955       9.481404 53.06261 7.186866 41.26068 9.609458 11.80193       11.99970 
1 1 1 14  24 19 o 85.94398 6.438700 95.57491       13.38694 95.57491       13.38694 0.000000       0.000000 85.94398 6.438700 ?        ?        0.000000       6.438700 
1 1 1 14  24 20 o 22.64847 8.690364 5.631570       6.727300 5.631570       6.727300 0.000000       0.000000 22.64847 8.690364 ?        ?        0.000000       8.690364 
1 1 1 14  24 21 f 11.73800 5.663492 -6.787351      4.859572 -2.131146      6.251735 -13.89577      7.724512 16.22673 7.348954 13.59094 6.682905 2.635788       9.933193 
1 1 1 14  24 22 o 30.05153 8.045424 13.07158       6.008611 11.72557       7.774529 15.06812       9.468667 28.12029 9.528104 31.06584 10.51519 -2.945549      14.18993 
1 1 1 14  24 23 o 33.68833 7.671036 16.49310       6.155984 19.31159       7.996311 12.39211       9.645533 35.30822 9.201710 28.12298 10.49190 7.185244       13.95534 
1 1 1 14  24 24 o 12.75884 6.072817 -4.976937      5.181753 4.342928       6.996585 -16.29934      7.711707 20.48768 8.511266 12.57322 6.267772 7.914458       10.57008 
1 1 1 14  24 25 o 22.24285 8.170299 7.426503       5.808633 7.158537       7.654325 7.790358       8.919305 22.40375 9.057096 23.19415 9.620496 -0.7903938     13.21306 
1 1 1 14  24 26 o 20.28404 7.899694 5.937539       5.620045 10.96199       8.130863 1.341095       7.776839 24.78981 9.543184 18.25992 8.240068 6.529890       12.60837 
1 1 1 14  24 27 o 46.19596 6.554840 31.91811       7.172145 42.23677       10.52516 22.97314       9.799555 49.34877 9.086912 33.07054 10.67825 16.27823       14.02130 
1 1 1 14  24 28 o 16.59006 7.729399 -0.2534921     7.626699 0.000000       0.000000 -0.2534921     7.626699 ?        ?        16.59006 7.729399 0.000000       7.729399 
1 1 1 14  24 29 f 22.37654 8.579174 10.06955       6.552706 13.11994       10.43055 8.080776       8.422134 22.87699 9.968066 20.47619 8.938929 2.400799       13.38905 
1 1 1 14  24 30 o 18.22854 7.767727 5.823851       6.066799 3.008309       9.259892 7.941339       8.030369 17.46658 8.256130 19.55795 8.626986 -2.091370      11.94104 
1 1 1 14  24 31 o 17.44701 7.575266 5.489769       5.979555 12.63193       9.610622 0.9786758      7.637964 20.77270 9.283849 15.59440 7.408298 5.178305       11.87740 
1 1 1 14  24 32 o 18.86536 7.915989 8.186243       6.142305 7.481744       9.579268 8.678138       8.004391 17.82726 8.417774 18.55449 8.367579 -0.7272377     11.86909 
1 1 1 14  25 0  o 189.0803 3.237851 436.9032       14.91898 447.9477       23.22154 429.1403       19.46844 191.0025 4.993309 187.1889 4.267907 3.813599       6.568726 
1 1 1 14  25 1  o 31.66516 5.343181 12.64818       3.976460 14.14423       6.608050 11.79890       4.978808 33.10701 8.226817 30.32105 6.894660 2.785952       10.73391 
1 1 1 14  25 2  o 117.6739 3.381638 169.4357       9.687078 171.9130       16.30354 168.0840       12.04352 118.0801 5.682584 117.0639 4.228718 1.016258       7.083348 
1 1 1 14  25 3  o 210.7984 5.408003 546.6901       27.75758 529.3654       37.02137 568.9338       41.94911 206.5805 7.365848 213.7961 8.066152 -7.215622      10.92330 
1 1 1 14  25 4  o 108.4975 3.244145 144.0542       8.567778 139.0380       14.03356 147.0349       10.81789 106.1730 5.442133 109.4819 4.061795 -3.308876      6.790802 
1 1 1 14  25 5  o 33.98643 5.560755 14.58281       4.446363 0.000000       0.000000 14.58281       4.446363 ?        ?        33.98643 5.560755 0.000000       5.560755 
1 1 1 14  25 6  o 22.08817 5.895176 6.230181       3.232234 0.000000       0.000000 6.230181       3.232234 ?        ?        22.08817 5.895176 0.000000       5.895176 
1 1 1 14  25 7  o 62.36545 2.307100 47.55448       3.500237 52.61890       5.593134 44.29423       4.487621 65.46325 3.519012 60.10430 3.074111 5.358952       4.672644 
1 1 1 14  25 8  o 22.57204 4.217534 6.453361       2.234599 13.88043       7.220237 5.666602       2.349977 32.66572 8.851729 21.05980 4.698500 11.60592       10.02143 
1 1 1 14  25 9  o 56.41117 4.726479 39.43573       6.437711 43.89934       9.775620 36.01749       8.554654 59.00077 6.931119 53.42683 6.718864 5.573944       9.653162 
1 1 1 14  25 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  25 11 o 64.11643 4.545056 50.91168       7.055379 56.06097       10.61076 46.83075       9.446105 66.71845 6.613194 60.97424 6.455181 5.744217       9.241412 
1 1 1 14  25 12 o 102.1453 4.665230 129.1093       11.58189 149.7180       16.43626 108.7839       16.32286 109.3880 6.191186 92.71128 7.283267 16.67671       9.559119 
1 1 1 14  25 13 o 88.67423 4.700304 97.56763       10.12058 118.9060       14.52273 77.42076       14.11145 97.30891 6.155897 77.84260 7.533096 19.46632       9.728443 
1 1 1 14  25 14 o 69.09449 4.862726 59.55252       8.135364 57.83003       10.61317 62.00653       12.66790 67.45729 6.538132 69.37584 7.618268 -1.918549      10.03918 
1 1 1 14  25 15 o 46.76144 5.743483 27.81680       6.407541 30.25364       8.420597 24.46508       9.875589 48.15932 7.412438 42.25247 9.784142 5.906849       12.27492 
1 1 1 14  25 16 o 13.58768 6.474758 -7.102460      5.925059 -7.102460      5.925059 0.000000       0.000000 13.58768 6.474758 ?        ?        0.000000       6.474758 
1 1 1 14  25 17 o 38.11086 8.606015 19.93485       7.802900 19.93485       7.802900 0.000000       0.000000 38.11086 8.606015 ?        ?        0.000000       8.606015 
1 1 1 14  25 18 o 47.59244 7.677270 30.45385       8.601002 30.45385       8.601002 0.000000       0.000000 47.59244 7.677270 ?        ?        0.000000       7.677270 
1 1 1 14  25 19 o 20.72875 7.378852 5.216274       4.690915 3.323266       5.721227 9.099198       8.193933 19.66061 7.871290 26.50784 9.709344 -6.847231      12.49914 
1 1 1 14  25 20 o 24.87219 7.604288 8.551873       5.036178 5.570466       6.218181 14.23627       8.586077 21.97891 8.374361 30.94721 9.995487 -8.968296      13.03993 
1 1 1 14  25 21 o 21.33846 7.802427 5.756469       5.287941 6.817148       6.297503 3.220692       9.737152 22.94816 8.493511 22.50854 9.719865 0.4396229      12.90796 
1 1 1 14  25 22 o 33.33032 7.732468 16.19408       6.158709 24.45471       7.910177 3.478665       9.813976 40.75351 8.248411 22.26645 9.685925 18.48706       12.72216 
1 1 1 14  25 23 o 17.03158 7.211422 1.888133       5.172027 3.089099       6.783667 0.2208479      7.992893 19.42494 8.243313 18.69398 8.401926 0.7309608      11.77050 
1 1 1 14  25 24 o 25.34696 8.265776 10.22093       5.863573 8.030852       8.011077 12.74806       8.605483 23.18819 9.303745 26.97831 9.938680 -3.790117      13.61385 
1 1 1 14  25 25 o 28.50066 8.248195 13.42142       6.054592 14.50662       8.293678 12.18316       8.859248 27.89987 9.822751 25.70070 9.943459 2.199171       13.97708 
1 1 1 14  25 26 o 15.77402 6.931227 1.265868       5.137616 10.48073       7.129244 -8.689795      7.410274 24.11836 9.015677 13.67494 6.687132 10.44342       11.22498 
1 1 1 14  25 27 o 16.90903 7.894106 -0.3298812     8.020722 0.000000       0.000000 -0.3298812     8.020722 ?        ?        16.90903 7.894106 0.000000       7.894106 
1 1 1 14  25 28 o 21.76987 8.266939 8.994007       6.047081 8.997721       8.642358 8.990445       8.464155 21.18126 9.151963 21.19412 9.106300 -0.1286316E-01 12.91058 
1 1 1 14  25 29 o 17.88589 7.693408 5.153041       6.054103 5.043731       8.746496 5.253581       8.388322 18.34400 8.452023 18.37514 8.395795 -0.3113937E-01 11.91327 
1 1 1 14  25 30 f 26.25619 8.730644 15.46508       6.530068 15.21161       9.860549 15.66308       8.715007 22.26789 9.697425 23.45996 9.596971 -1.192062      13.64338 
1 1 1 14  25 31 o 15.44722 6.998389 2.960062       5.675529 0.7607389      8.370413 4.831652       7.721608 15.50983 7.470697 16.91049 7.844096 -1.400661      10.83241 
1 1 1 14  26 0  f 108.1878 3.134184 143.1969       8.254313 135.0955       14.88136 146.7971       9.920246 104.5448 5.864739 109.4492 3.724834 -4.904419      6.947630 
1 1 1 14  26 1  o 27.96778 5.117301 9.910293       3.359185 10.22962       4.596072 9.544094       4.921853 28.20109 6.773122 27.26724 7.273334 0.9338474      9.938640 
1 1 1 14  26 2  o 122.6760 2.784351 183.8727       8.323760 180.1088       12.38610 186.9724       11.24028 121.1305 4.202460 123.5141 3.738737 -2.383644      5.624840 
1 1 1 14  26 3  o 114.7152 3.164944 161.0562       8.839100 163.1066       17.11222 160.3101       10.32286 114.7462 6.142106 114.3544 3.709248 0.3917694      7.175234 
1 1 1 14  26 4  f 269.8799 4.460273 894.2872       29.33378 919.5601       41.68107 869.4861       41.29017 272.6501 6.273316 265.0463 6.392766 7.603790       8.956671 
1 1 1 14  26 5  o 107.8283 2.703285 142.1799       7.097710 144.8064       10.46220 139.9403       9.660967 108.5976 3.959993 106.8037 3.717584 1.793892       5.431572 
1 1 1 14  26 6  o 82.18226 2.751410 82.65588       5.502457 80.98893       7.537701 84.55756       8.050927 81.18254 3.820854 82.92314 3.995896 -1.740601      5.528663 
1 1 1 14  26 7  o 166.7542 3.648579 340.9305       14.82643 341.4301       24.25486 340.6325       18.73403 165.8929 6.009704 166.3051 4.627131 -0.4121704     7.584648 
1 1 1 14  26 8  o 74.63531 2.568094 68.18019       4.663844 73.33040       11.26149 67.11400       5.123905 76.63344 6.080136 74.01054 2.846306 2.622902       6.713383 
1 1 1 14  26 9  o 27.67586 3.122776 9.500473       2.069362 11.74693       6.870389 9.276337       2.170142 30.08124 8.809635 27.30987 3.329611 2.771370       9.417854 
1 1 1 14  26 10 o 58.57507 4.801216 42.66760       6.793216 49.59898       10.24350 37.22595       9.076188 62.57445 6.828287 54.03954 7.060889 8.534908       9.822508 
1 1 1 14  26 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  26 12 o 90.60003 4.185680 101.5745       9.216273 108.6808       14.32673 96.55766       12.03765 92.80053 6.373912 87.77303 5.658014 5.027496       8.522903 
1 1 1 14  26 13 o 113.5855 4.684083 160.4496       12.93751 163.8753       17.78870 156.6029       18.85021 113.7772 6.442148 110.8324 7.015323 2.944870       9.524496 
1 1 1 14  26 14 o 76.00443 6.532564 73.78933       11.98199 73.78933       11.98199 0.000000       0.000000 76.00443 6.532564 ?        ?        0.000000       6.532564 
1 1 1 14  26 15 o 28.96574 9.053428 11.27389       7.092664 11.27389       7.092664 0.000000       0.000000 28.96574 9.053428 ?        ?        0.000000       9.053428 
1 1 1 14  26 16 o 75.54742 4.702897 71.78271       8.615135 64.94149       11.06477 82.31527       13.72911 70.85884 6.479484 79.33031 7.179419 -8.471466      9.670976 
1 1 1 14  26 17 o 36.16695 6.773856 17.47255       5.750793 21.40547       7.562355 12.07947       8.855598 39.43531 8.139260 29.59319 10.16589 9.842121       13.02279 
1 1 1 14  26 18 o 31.08752 7.380843 13.32862       5.507532 10.90236       6.829796 17.84003       9.313116 27.88552 8.905951 34.60664 10.28896 -6.721117      13.60803 
1 1 1 14  26 19 o 45.29922 7.927355 28.66842       8.432354 28.66842       8.432354 0.000000       0.000000 45.29922 7.927355 ?        ?        0.000000       7.927355 
1 1 1 14  26 20 o 11.54969 5.552320 -5.869835      4.571031 -8.599627      5.462354 0.5080277      8.349350 11.92144 5.810342 19.80965 8.764651 -7.888212      10.51566 
1 1 1 14  26 21 o 36.49844 6.980786 18.80832       5.982724 24.65711       7.592051 9.225631       9.717835 41.21287 7.845953 25.71020 10.27026 15.50267       12.92428 
1 1 1 14  26 22 o 10.94146 5.276698 -5.446676      4.206561 -7.355742      5.170218 -1.708165      7.235154 11.73492 5.704360 16.95123 7.764832 -5.216312      9.634953 
1 1 1 14  26 23 o 14.36857 6.494730 -0.8861775     4.854622 1.209738       6.334988 -3.868129      7.556301 17.40527 7.670523 16.00491 7.532363 1.400364       10.75051 
1 1 1 14  26 24 o 24.43273 7.969188 9.653792       5.450204 4.651235       7.117036 16.74771       8.475123 19.94002 8.451882 29.92288 9.946169 -9.982866      13.05223 
1 1 1 14  26 25 o 28.40664 10.27450 16.54154       9.135050 0.000000       0.000000 16.54154       9.135050 ?        ?        28.40664 10.27450 0.000000       10.27450 
1 1 1 14  26 26 o 16.28677 7.086094 2.160822       5.254704 2.794077       7.184918 1.432601       7.704842 17.98596 8.033563 17.57050 8.035093 0.4154606      11.36226 
1 1 1 14  26 27 o 18.49024 7.684840 5.210784       5.707407 8.483044       8.403576 2.409088       7.775903 21.01576 9.052165 17.55553 8.044682 3.460230       12.11027 
1 1 1 14  26 28 o 13.96130 6.583438 -1.448609      5.823214 1.031288       8.317388 -3.832929      8.155532 16.65754 7.858861 14.87013 7.213518 1.787401       10.66755 
1 1 1 14  26 29 o 10.58455 5.275692 -9.176198      5.455731 -14.26354      8.386564 -5.443716      7.183523 12.25149 6.167420 13.33471 6.534005 -1.083220      8.985004 
1 1 1 14  26 30 o 17.98223 7.800185 6.548601       6.327461 -1.669834      8.872902 15.05275       9.025820 15.10587 7.371824 22.11266 9.450165 -7.006788      11.98538 
1 1 1 14  27 0  o 17.01534 6.028086 3.115940       3.127332 0.9522887      4.239908 5.697612       4.631411 16.09143 6.649868 21.99142 7.353587 -5.899986      9.914433 
1 1 1 14  27 1  o 54.28171 3.280476 36.18772       4.319114 37.07545       6.192223 35.34661       6.027410 54.72395 4.688502 53.42570 4.676721 1.298248       6.622218 
1 1 1 14  27 2  o 23.09622 6.526754 6.793605       3.835243 7.305522       6.495517 6.519619       4.752009 25.17998 8.704144 23.11801 7.433343 2.061964       11.44625 
1 1 1 14  27 3  f 75.00478 2.821016 68.88358       5.147021 73.66423       7.542926 64.71806       7.040947 77.37755 4.013988 72.51634 3.999857 4.861206       5.666654 
1 1 1 14  27 4  o 142.9949 3.328328 250.4305       11.59799 254.1273       15.15250 245.2009       18.02233 143.7269 4.331177 140.8583 5.259638 2.868591       6.813434 
1 1 1 14  27 5  o 92.17721 2.687400 103.9856       6.030149 109.5124       8.786378 99.06448       8.291003 94.38554 3.827986 89.76889 3.798637 4.616646       5.392877 
1 1 1 14  27 6  o 110.2756 2.544861 148.6836       6.838798 144.2568       10.37999 152.0790       9.090770 108.2918 3.939941 111.3369 3.354446 -3.045128      5.174500 
1 1 1 14  27 7  o 98.48558 3.305984 119.0560       7.923070 127.8600       14.67029 115.4305       9.414113 101.2403 5.972873 96.80785 3.999161 4.432411       7.188080 
1 1 1 14  27 8  o 145.9479 3.354172 261.3742       11.92942 270.3362       23.70082 258.3333       13.80572 146.7928 6.642773 144.8612 3.914436 1.931610       7.710333 
1 1 1 14  27 9  o 117.5179 3.400143 169.7619       9.727032 157.4106       17.67362 175.1288       11.65025 111.8538 6.512099 119.1565 4.017937 -7.302704      7.651879 
1 1 1 14  27 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  27 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  27 12 o 24.00525 10.68921 -2.051418      12.61883 0.000000       0.000000 -2.051418      12.61883 ?        ?        24.00525 10.68921 0.000000       10.68921 
1 1 1 14  27 13 o 33.44220 6.705312 14.72623       5.274105 15.91465       7.546235 13.59139       7.374162 34.08198 8.966777 31.56693 9.092827 2.515049       12.77038 
1 1 1 14  27 14 o 58.09834 4.509496 42.37878       6.334558 49.83291       9.422299 36.23099       8.556928 62.19275 6.303983 52.69533 6.823675 9.497421       9.289927 
1 1 1 14  27 15 o 50.72983 5.410454 32.94078       6.585462 34.82854       8.888145 30.64307       9.805832 51.20108 7.332611 47.10150 8.868373 4.099583       11.50718 
1 1 1 14  27 16 o 46.75925 5.719697 28.36464       6.381907 29.88684       8.272052 26.12632       10.03087 47.06799 7.460450 42.45663 9.881212 4.611355       12.38130 
1 1 1 14  27 17 o 30.98755 6.974558 13.15218       5.139229 13.88031       6.744229 12.14387       7.936360 31.15680 8.600873 29.10967 9.623068 2.047125       12.90653 
1 1 1 14  27 18 o 54.48811 5.332858 38.63884       6.990486 39.28657       9.064190 37.68809       10.98151 53.68280 7.102920 50.83469 9.203485 2.848114       11.62564 
1 1 1 14  27 19 f 22.72159 7.721235 7.100926       5.105789 10.24831       6.379318 1.491325       8.516580 26.45852 8.621185 20.43791 8.953965 6.020611       12.42974 
1 1 1 14  27 20 o 21.50402 8.314135 5.798221       6.190674 5.798221       6.190674 0.000000       0.000000 21.50402 8.314135 ?        ?        0.000000       8.314135 
1 1 1 14  27 21 o 14.22251 6.377879 -0.7579164     4.577170 2.017452       6.049092 -4.475403      7.000911 17.95865 7.706934 15.36956 7.238586 2.589087       10.57327 
1 1 1 14  27 22 o 14.39088 6.385275 -0.7328860E-01 4.462480 -5.685257      5.444489 11.41383       7.789419 12.66859 6.082265 25.94424 9.472389 -13.27565      11.25700 
1 1 1 14  27 23 o 27.16649 9.904866 13.73252       8.512625 0.000000       0.000000 13.73252       8.512625 ?        ?        27.16649 9.904866 0.000000       9.904866 
1 1 1 14  27 24 o 29.88038 7.962595 14.77390       5.902488 18.85219       8.127355 10.22202       8.586297 31.61560 9.658990 23.70276 9.588901 7.912842       13.61040 
1 1 1 14  27 25 o 17.08425 7.291738 3.084546       5.361182 13.78025       7.326434 -9.244582      7.866003 26.55362 9.240582 13.77303 6.766735 12.78059       11.45326 
1 1 1 14  27 26 o 21.93366 8.195010 8.925889       5.888958 10.82156       8.168793 6.874632       8.497416 22.67958 9.286122 20.15232 8.882340 2.527254       12.85022 
1 1 1 14  27 27 o 16.38573 7.148549 3.182478       5.378670 3.036335       6.977741 3.396456       8.443249 17.04011 7.735817 17.75721 8.224910 -0.7171059     11.29124 
1 1 1 14  27 28 o 40.70793 7.458497 29.36657       7.126310 32.14838       10.21839 26.73243       9.943479 34.79145 10.86561 30.71975 10.76016 4.071705       15.29192 
1 1 1 14  27 29 o 11.88927 6.002207 -14.85417      8.266083 -14.85417      8.266083 0.000000       0.000000 11.88927 6.002207 ?        ?        0.000000       6.002207 
1 1 1 14  28 0  o 15.53562 5.925237 2.098054       3.114913 3.203573       4.106459 0.6000078      4.780212 18.30976 6.842822 16.60723 6.976838 1.702534       9.772434 
1 1 1 14  28 1  o 100.8283 2.765799 124.4360       6.789362 112.7682       9.690574 135.6849       9.515049 95.70236 4.165163 105.1004 3.720972 -9.398033      5.585178 
1 1 1 14  28 2  o 57.62861 3.153129 40.79399       4.411214 47.08131       6.371300 35.00521       6.113482 61.72799 4.261709 53.07913 4.777448 8.648857       6.402044 
1 1 1 14  28 3  o 119.5809 2.771757 174.9641       8.077055 155.7869       11.51153 193.5605       11.33585 112.4548 4.208100 125.5144 3.710236 -13.05962      5.610165 
1 1 1 14  28 4  o 37.72592 3.754844 17.65098       3.406194 20.36975       4.628192 14.43815       5.031172 40.34689 4.801296 33.50506 6.395236 6.841827       7.996968 
1 1 1 14  28 5  o 38.48424 4.246839 18.46064       3.916608 17.03527       4.449179 23.36816       8.255583 36.76278 5.103800 42.23859 8.316652 -5.475807      9.757842 
1 1 1 14  28 6  o 22.58391 4.940032 6.554149       2.642895 6.123016       3.399305 7.213048       4.202368 21.83379 6.135794 23.69253 6.876129 -1.858740      9.215700 
1 1 1 14  28 7  o 108.3812 3.084536 144.2244       8.138378 148.9128       10.22608 136.1251       13.44075 109.9063 3.823954 104.5166 5.294430 5.389778       6.530974 
1 1 1 14  28 8  o 85.19489 2.888327 89.11700       5.987804 102.3528       13.14707 85.65290       6.725885 90.19530 6.015877 83.41936 3.315219 6.775948       6.868876 
1 1 1 14  28 9  o 68.55172 2.777804 57.73029       4.630797 65.94257       10.43670 55.71720       5.167298 72.24203 5.981975 67.26255 3.161338 4.979485       6.765950 
1 1 1 14  28 10 o 35.04044 2.846551 15.17197       2.409746 20.09552       6.992618 14.50846       2.566987 38.96700 7.637064 34.21319 3.112940 4.753811       8.247129 
1 1 1 14  28 11 o 26.13147 7.337209 9.057645       4.863029 7.512771       7.033128 10.47285       6.731508 25.13426 9.025052 28.09978 8.825320 -2.965519      12.62291 
1 1 1 14  28 12 o 14.51311 6.335453 -0.5047716     4.230246 -5.971087      6.001266 4.893597       5.963852 14.16792 6.681623 21.68571 8.215652 -7.517789      10.58967 
1 1 1 14  28 13 o 44.65488 7.651509 26.73442       8.026891 0.000000       0.000000 26.73442       8.026891 ?        ?        44.65488 7.651509 0.000000       7.651509 
1 1 1 14  28 14 o 29.76145 7.067850 12.01475       5.049283 8.125582       7.134203 15.91826       7.147345 25.33746 9.090687 33.67703 8.660727 -8.339571      12.55583 
1 1 1 14  28 15 o 45.32415 5.653984 26.72338       6.109396 29.04018       7.968616 23.41960       9.515799 46.35727 7.294647 39.98234 9.835381 6.374928       12.24527 
1 1 1 14  28 16 o 47.51790 5.693166 29.57372       6.461377 29.13722       8.485989 30.17590       9.967226 45.77518 7.892361 45.55168 9.294213 0.2234993      12.19310 
1 1 1 14  28 17 o 44.08417 6.042789 25.96199       6.321008 31.91850       8.639253 19.09975       9.272849 47.74701 7.685789 34.96174 10.23349 12.78527       12.79827 
1 1 1 14  28 18 o 22.82533 7.542519 7.277641       4.875742 3.533459       6.350638 12.65337       7.609526 19.85142 8.164459 28.71630 9.419496 -8.864883      12.46536 
1 1 1 14  28 19 o 18.92000 7.332876 4.136174       4.824367 7.377174       6.690907 0.6266511      6.962568 23.07945 8.711392 18.12650 8.012609 4.952951       11.83597 
1 1 1 14  28 20 o 19.93375 7.262842 5.387509       4.575861 8.662560       5.827703 0.1220994      7.389318 23.88571 8.245131 17.95920 8.074511 5.926510       11.54036 
1 1 1 14  28 21 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  28 22 o 28.97952 7.894067 13.51385       5.724744 15.13589       7.833587 11.65467       8.386707 28.86082 9.561311 25.43197 9.716939 3.428854       13.63223 
1 1 1 14  28 23 o 16.00963 7.056219 1.260341       5.362273 3.248149       6.991185 -1.580102      8.357121 18.55993 8.122362 17.06738 7.997190 1.492552       11.39859 
1 1 1 14  28 24 o 14.72625 6.702913 -0.1908922     5.281560 0.2519534      7.134101 -0.7279725     7.856565 16.60122 7.643346 16.67831 7.795091 -0.7708549E-01 10.91715 
1 1 1 14  28 25 f 15.69525 6.951484 1.765365       5.265492 5.618563       7.018023 -3.197255      7.964520 19.16354 8.263485 15.41438 7.388903 3.749161       11.08517 
1 1 1 14  28 26 o 14.25433 6.527565 0.2222083      5.108156 1.932916       6.876578 -1.883944      7.630085 16.44700 7.547280 15.25657 7.291351 1.190430       10.49406 
1 1 1 14  28 27 o 20.89540 9.001954 10.50261       8.313516 10.50261       8.313516 0.000000       0.000000 20.89540 9.001954 ?        ?        0.000000       9.001954 
1 1 1 14  28 28 o 16.66766 7.367390 4.317266       5.885703 10.14331       8.257086 -1.700485      8.391832 20.04120 8.797261 15.05821 7.307679 4.982985       11.43652 
1 1 1 14  29 0  f 80.11988 3.708543 79.03029       7.221045 67.75124       10.84808 88.00423       9.676278 73.50532 6.111403 84.28968 4.729808 -10.78436      7.727893 
1 1 1 14  29 1  o 98.43713 3.075706 118.8827       7.368968 123.9017       9.871550 112.5661       11.07446 100.2451 4.049307 95.31812 4.783009 4.926987       6.266902 
1 1 1 14  29 2  o 107.7144 3.054210 142.3505       8.008845 147.9795       10.88078 135.6951       11.83127 109.5297 4.083692 104.6883 4.649239 4.841438       6.188050 
1 1 1 14  29 3  o 54.56104 3.365496 36.69182       4.452961 41.64544       5.776398 29.43630       6.990856 57.98330 4.114801 48.18560 6.089298 9.797695       7.349227 
1 1 1 14  29 4  o 32.96527 4.257955 13.62917       3.340718 13.55658       4.033321 13.78781       5.962217 32.64318 5.248163 32.33369 7.681288 0.3094864      9.302979 
1 1 1 14  29 5  o 18.11815 5.626740 4.090887       2.744408 4.181498       3.461252 3.937473       4.503765 18.80528 6.357582 19.50234 7.189055 -0.6970577     9.596946 
1 1 1 14  29 6  o 62.73483 2.900816 48.39078       4.422704 56.24371       6.113768 39.76989       6.405737 67.45099 3.734071 56.42975 4.700933 11.02124       6.003504 
1 1 1 14  29 7  o 23.49719 4.153912 7.025007       2.291551 4.119609       2.955025 11.40794       3.629448 18.27244 5.860420 29.84178 5.178611 -11.56934      7.820648 
1 1 1 14  29 8  f 43.04583 2.959679 22.87597       3.085748 23.93668       3.993559 21.30440       4.861023 43.86206 3.772866 41.04596 4.960316 2.816105       6.232115 
1 1 1 14  29 9  o 37.44281 3.557207 17.46431       3.206801 32.97986       7.847275 14.35384       3.513569 50.51891 6.526604 33.71104 4.380504 16.80788       7.860367 
1 1 1 14  29 10 o 40.29512 3.005518 20.10373       2.930006 25.96326       7.298930 18.97810       3.199081 44.45518 6.966186 39.05784 3.394783 5.397343       7.749341 
1 1 1 14  29 11 f 58.58820 4.549844 43.19955       6.445070 52.76022       9.917400 36.20961       8.479896 63.79662 6.468476 52.59665 6.773066 11.19997       9.365661 
1 1 1 14  29 12 o 41.34327 6.197484 22.39618       6.051730 32.49928       8.500156 12.01116       8.617935 49.35046 7.286960 29.51805 10.03129 19.83240       12.39865 
1 1 1 14  29 13 o 80.14513 4.515862 81.12053       8.784023 84.33730       12.06121 77.48726       12.81830 80.49670 6.196257 76.52031 6.949861 3.976387       9.310970 
1 1 1 14  29 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 14  29 15 o 32.65630 7.059712 14.79121       5.454125 15.98061       7.287992 13.27707       8.222962 32.94973 8.877993 29.81654 9.792430 3.133194       13.21781 
1 1 1 14  29 16 o 24.51715 7.628115 8.511826       5.041354 6.955077       6.423216 11.00924       8.135579 23.07029 8.570566 27.31154 9.717980 -4.241247      12.95738 
1 1 1 14  29 17 o 33.74649 7.184367 16.25204       5.726804 22.50773       7.632139 8.191628       8.663371 38.99021 8.288148 24.66388 9.747108 14.32634       12.79451 
1 1 1 14  29 18 f 63.14672 7.882840 58.43962       11.86679 0.000000       0.000000 58.43962       11.86679 ?        ?        63.14672 7.882840 0.000000       7.882840 
1 1 1 14  29 19 o 32.60025 10.24945 18.85978       9.076993 0.000000       0.000000 18.85978       9.076993 ?        ?        32.60025 10.24945 0.000000       10.24945 
1 1 1 14  29 20 o 33.77311 7.486548 17.42377       5.999662 23.04235       8.150875 10.77986       8.863452 37.21234 9.071808 25.11341 9.879268 12.09893       13.41259 
1 1 1 14  29 21 o 20.38408 7.680737 6.114586       5.196287 3.300938       6.813585 10.02595       8.033497 18.79148 8.122797 24.09728 9.427446 -5.305794      12.44414 
1 1 1 14  29 22 o 20.24961 8.600226 5.602622       7.393994 5.602622       7.393994 0.000000       0.000000 20.24961 8.600226 ?        ?        0.000000       8.600226 
1 1 1 14  29 23 o 29.19493 8.603910 15.50783       6.535802 34.40545       9.476057 -1.638782      9.026372 43.51662 9.222725 17.07310 8.094122 26.44352       12.27084 
1 1 1 14  29 24 o 24.54868 8.537514 11.67120       6.253483 18.14568       8.464298 3.889869       9.279308 28.45992 9.930475 18.88028 8.701469 9.579638       13.20341 
1 1 1 14  29 25 f 19.15151 8.463992 6.377789       7.765351 6.377789       7.765351 0.000000       0.000000 19.15151 8.463992 ?        ?        0.000000       8.463992 
1 1 1 14  29 26 o 20.53236 8.853795 9.646291       8.056627 9.646291       8.056627 0.000000       0.000000 20.53236 8.853795 ?        ?        0.000000       8.853795 
1 1 1 14  29 27 o 13.91522 6.489439 0.2699876E-02  5.396783 -0.5921122     6.991685 0.8794948      8.488696 14.73741 7.025647 16.00248 7.659406 -1.265068      10.39357 
1 1 1 14  30 0  o 66.01242 3.489736 53.73446       5.593822 52.39980       9.494481 54.44406       6.922943 64.39755 6.123760 66.24239 4.312067 -1.844833      7.489616 
1 1 1 14  30 1  o 15.64193 5.765246 2.461115       2.896299 2.297412       3.688912 2.724209       4.676556 16.54798 6.412528 18.35443 7.189320 -1.806458      9.633631 
1 1 1 14  30 2  o 47.58372 3.402271 27.98877       3.919115 32.14995       5.679358 24.20593       5.415019 50.71760 4.646788 43.80890 5.171843 6.908703       6.952740 
1 1 1 14  30 3  o 49.46178 3.230997 30.20329       3.873099 29.84559       5.245248 30.63215       5.743357 48.88187 4.452145 49.42144 4.830460 -0.5395699     6.569242 
1 1 1 14  30 4  f 16.90927 5.705514 3.380185       2.787633 1.288357       3.656161 6.284689       4.308224 15.30388 6.232835 22.28654 7.068290 -6.982653      9.423851 
1 1 1 14  30 5  o 65.21169 2.830913 52.32034       4.487993 57.22884       6.161394 46.77243       6.550416 67.96980 3.734210 61.22017 4.420514 6.749634       5.786645 
1 1 1 14  30 6  o 62.86348 2.791394 48.64095       4.265513 60.29346       6.035313 37.01131       6.029385 69.79090 3.560429 54.32893 4.597248 15.46198       5.814752 
1 1 1 14  30 7  o 57.60362 2.887058 40.91466       4.039752 41.03006       5.275403 40.75104       6.281559 57.44088 3.789937 56.98878 4.561208 0.4520988      5.930282 
1 1 1 14  30 8  o 64.25819 2.470808 50.76391       3.861834 54.90957       5.759398 47.37739       5.205436 66.51856 3.566059 61.80506 3.470121 4.713501       4.975793 
1 1 1 14  30 9  o 19.51169 6.126117 4.869657       3.243813 4.707822       5.772571 4.944344       3.921528 21.21659 8.072341 20.01064 6.767098 1.205948       10.53358 
1 1 1 14  30 10 o 16.97959 5.236845 3.673232       2.382001 13.86606       6.321108 1.986267       2.571574 31.61865 8.151692 14.30998 5.400787 17.30868       9.778476 
1 1 1 14  30 11 o 44.05823 2.867746 24.06854       3.062227 41.13206       8.996557 21.83256       3.256688 55.72874 6.762862 41.85788 3.217403 13.87086       7.489191 
1 1 1 14  30 12 o 24.41585 7.084887 8.152659       4.461741 8.680265       6.405389 7.655396       6.218472 25.31450 8.647370 24.16162 8.505621 1.152874       12.12941 
1 1 1 14  30 13 o 27.58557 7.003251 10.57259       4.715414 12.84763       6.923950 8.604725       6.439570 29.66445 8.884085 25.03717 8.666003 4.627283       12.41074 
1 1 1 14  30 14 o 48.07585 5.018748 30.05743       5.793248 30.15777       8.547557 29.97217       7.878999 46.16578 7.880391 46.56106 7.174121 -0.3952751     10.65686 
1 1 1 14  30 15 f 48.79495 8.970694 35.57005       10.27391 0.000000       0.000000 35.57005       10.27391 ?        ?        48.79495 8.970694 0.000000       8.970694 
1 1 1 14  30 16 o 17.07821 7.858934 -2.422902      7.528699 0.000000       0.000000 -2.422902      7.528699 ?        ?        17.07821 7.858934 0.000000       7.858934 
1 1 1 14  30 17 o 23.24959 9.407034 7.377847       8.265134 0.000000       0.000000 7.377847       8.265134 ?        ?        23.24959 9.407034 0.000000       9.407034 
1 1 1 14  30 18 o 30.47513 7.338539 14.00885       5.384442 11.79085       6.974400 17.28137       8.471608 26.69395 9.024616 31.32844 9.908694 -4.634497      13.40246 
1 1 1 14  30 19 o 17.64375 7.107804 3.507525       4.695890 4.318125       5.994706 2.220186       7.554595 19.24165 7.924963 18.83719 8.335606 0.4044628      11.50162 
1 1 1 14  30 20 o 14.16552 6.408143 -0.6065913     4.737381 -1.596826      6.293571 0.6880196      7.196109 15.39894 7.121536 17.42909 7.889887 -2.030155      10.62857 
1 1 1 14  30 21 o 26.96201 8.056422 12.34994       5.698863 14.43497       7.370419 9.250276       8.986573 27.68636 9.276891 22.81846 9.574856 4.867895       13.33186 
1 1 1 14  30 22 o 43.12445 7.117322 29.43670       7.218870 34.29435       10.00933 24.17110       10.42116 42.05463 9.927350 32.03160 11.02703 10.02303       14.83738 
1 1 1 14  30 23 o 17.81388 8.069617 3.121175       7.543199 3.121175       7.543199 0.000000       0.000000 17.81388 8.069617 ?        ?        0.000000       8.069617 
1 1 1 14  30 24 o 19.28928 8.575850 6.575661       8.090086 6.575661       8.090086 0.000000       0.000000 19.28928 8.575850 ?        ?        0.000000       8.575850 
1 1 1 14  30 25 o 16.96764 7.356115 4.205922       5.621331 7.472020       7.634398 0.3382864      8.307742 19.32587 8.471863 16.15034 7.687733 3.175524       11.44000 
1 1 1 14  30 26 o 26.39694 8.640207 15.37087       6.404005 18.50284       9.119217 12.32343       8.995315 25.03925 9.966543 21.18174 9.242682 3.857506       13.59261 
1 1 1 14  31 0  o 26.80761 5.146953 9.263143       3.240151 8.574203       4.380082 10.09580       4.815309 25.50499 6.887133 27.59874 7.114552 -2.093754      9.901993 
1 1 1 14  31 1  o 76.55877 3.312399 72.34009       6.165167 75.42476       10.80042 70.84917       7.508690 77.18633 5.784082 75.50979 4.095942 1.676537       7.087478 
1 1 1 14  31 2  o 40.03458 3.717451 19.97676       3.585310 13.83189       4.716379 28.38898       5.518332 32.56172 6.169590 47.45701 4.839328 -14.89529      7.841106 
1 1 1 14  31 3  o 75.86048 2.797296 70.82159       5.162329 81.60310       7.462955 60.92960       7.148468 81.11018 3.786164 69.90926 4.215652 11.20092       5.666283 
1 1 1 14  31 4  o 21.91105 5.461102 6.283611       2.905460 8.871017       3.726465 2.272097       4.640011 25.95217 6.010651 17.67309 7.084161 8.279083       9.290493 
1 1 1 14  31 5  f 93.78900 2.506671 108.0963       5.723950 108.4097       8.806039 107.8670       7.532190 93.37575 3.878438 93.39365 3.314798 -0.1789856E-01 5.101977 
1 1 1 14  31 6  o 8.812835 4.085920 -1.720995      2.091209 -4.382001      2.615184 2.997912       3.482571 8.377005 4.068598 16.97795 6.310116 -8.600948      7.508066 
1 1 1 14  31 7  o 42.25378 3.007602 22.14462       3.076618 26.70675       4.386744 17.72822       4.316106 46.14713 3.938477 37.22863 4.874475 8.918495       6.266747 
1 1 1 14  31 8  o 30.26394 3.652857 11.54573       2.639549 13.62871       3.676839 9.330721       3.791578 32.56282 4.775424 26.45496 6.017578 6.107866       7.682182 
1 1 1 14  31 9  o 18.75672 5.640987 4.589100       2.787152 7.649784       5.903710 3.711287       3.161671 24.14340 8.300162 17.54309 6.072230 6.600313       10.28420 
1 1 1 14  31 10 o 20.18096 5.165468 5.402982       2.550737 2.089753       4.933923 6.611499       2.979840 17.55067 7.204947 22.24624 5.522438 -4.695562      9.077917 
1 1 1 14  31 11 o 25.96295 3.930250 8.646310       2.408925 8.238630       6.738875 8.706036       2.579354 24.73691 8.839893 25.95865 4.222472 -1.221743      9.796580 
1 1 1 14  31 12 o 24.74778 3.526433 7.813343       2.066612 14.97867       6.534587 7.017029       2.178423 32.03913 8.302567 23.28793 3.981581 8.751202       9.207910 
1 1 1 14  31 13 f 34.79365 9.734646 19.01429       8.576373 0.000000       0.000000 19.01429       8.576373 ?        ?        34.79365 9.734646 0.000000       9.734646 
1 1 1 14  31 14 o 20.09296 8.578640 2.947781       7.424792 0.000000       0.000000 2.947781       7.424792 ?        ?        20.09296 8.578640 0.000000       8.578640 
1 1 1 14  31 15 o 17.45729 6.842583 3.317827       4.238772 9.880100       5.995368 -3.240773      5.993690 25.42484 8.362090 14.74963 6.865269 10.67522       10.81926 
1 1 1 14  31 16 f 26.76488 9.818016 12.07115       8.383223 0.000000       0.000000 12.07115       8.383223 ?        ?        26.76488 9.818016 0.000000       9.818016 
1 1 1 14  31 17 o 19.51196 7.430494 5.103385       4.893857 7.553978       6.409790 1.678269       7.577848 22.41544 8.511451 18.69166 8.305629 3.723778       11.89236 
1 1 1 14  31 18 o 17.01953 7.060330 2.828110       4.804721 4.144895       6.497913 1.239690       7.136728 19.29854 8.122506 17.85549 7.988697 1.443054       11.39273 
1 1 1 14  31 19 o 28.79418 7.795422 13.49095       5.602904 15.21206       7.888103 11.73841       7.959790 28.45070 9.597612 25.21946 9.505440 3.231247       13.50806 
1 1 1 14  31 20 o 22.39688 8.077460 8.532246       5.640944 14.39295       7.796841 2.095033       8.171328 27.04455 9.523789 18.35489 8.347849 8.689659       12.66448 
1 1 1 14  31 21 o 13.12533 6.411901 -7.312681      6.762668 -7.312681      6.762668 0.000000       0.000000 13.12533 6.411901 ?        ?        0.000000       6.411901 
1 1 1 14  31 22 o 19.03820 8.505806 5.299571       8.060109 5.299571       8.060109 0.000000       0.000000 19.03820 8.505806 ?        ?        0.000000       8.505806 
1 1 1 14  31 23 o 21.45749 8.359701 9.297240       6.295419 21.10942       9.041830 -1.816659      8.770504 29.01780 10.25275 15.96146 7.677763 13.05633       12.80886 
1 1 1 14  31 24 o 12.64133 6.028106 -2.591575      5.154750 -3.122254      7.070077 -1.989345      7.531630 14.15075 6.828516 14.87343 7.144176 -0.7226744     9.882706 
1 1 1 14  31 25 o 17.75972 7.697803 5.618969       6.152892 2.481291       8.413898 9.225598       9.020772 16.66602 7.875387 19.63731 8.866934 -2.971289      11.85935 
1 1 1 14  32 0  o 15.98611 5.854386 2.702739       2.978830 2.777628       3.795269 2.582586       4.807293 17.11163 6.536963 18.16016 7.233703 -1.048532      9.749787 
1 1 1 14  32 1  o 28.84508 4.902500 10.71358       3.322877 7.056890       4.346419 15.85704       5.154842 23.17491 7.060266 34.72594 6.324446 -11.55103      9.478711 
1 1 1 14  32 2  o 42.91138 4.191574 23.16806       4.327321 23.90701       7.148895 22.74073       5.436419 42.38243 7.177684 42.07005 5.429242 0.3123856      8.999767 
1 1 1 14  32 3  o 50.47890 3.224259 31.62532       3.945477 32.98046       5.436570 30.11738       5.734869 51.15723 4.403777 48.67781 4.901204 2.479424       6.589010 
1 1 1 14  32 4  o 89.24301 2.778395 98.24793       6.034968 91.54655       8.349782 105.5778       8.732546 85.57103 4.015366 91.96980 3.905253 -6.398773      5.601264 
1 1 1 14  32 5  o 13.35178 5.173500 1.539378       2.400927 2.383002       3.054467 0.1753972      3.883875 15.54393 5.881683 14.39020 6.175496 1.153728       8.528245 
1 1 1 14  32 6  o 27.81020 3.976694 9.853499       2.618388 10.03023       3.371698 9.584987       4.156037 27.67057 5.190908 26.62403 6.470060 1.046545       8.295011 
1 1 1 14  32 7  o 28.07957 3.961715 10.05837       2.635636 12.33910       3.561489 7.297078       3.918781 30.82098 4.906165 23.20822 6.610644 7.612764       8.232318 
1 1 1 14  32 8  o 14.79910 5.160648 2.577029       2.285715 3.071334       2.721790 1.394381       4.210032 16.07575 5.629684 15.90990 6.605272 0.1658421      8.678880 
1 1 1 14  32 9  o 29.29788 4.601493 11.15761       3.177112 22.17687       7.244627 8.533702       3.535198 39.69017 7.768492 25.09323 5.883927 14.59694       9.745258 
1 1 1 14  32 10 f 26.45490 6.577282 9.725781       4.222163 0.000000       0.000000 9.725781       4.222163 ?        ?        26.45490 6.577282 0.000000       6.577282 
1 1 1 14  32 11 o 39.17570 3.670856 19.50248       3.463635 0.000000       0.000000 19.50248       3.463635 ?        ?        39.17570 3.670856 0.000000       3.670856 
1 1 1 14  32 12 o 19.48540 4.738793 5.103975       2.228183 12.18463       6.319628 4.098795       2.381094 28.29838 8.490438 17.48257 5.203662 10.81580       9.958195 
1 1 1 14  32 13 o 10.86029 4.180233 1.090097       1.559941 2.202043       5.889303 1.006196       1.617723 18.03349 7.667839 10.82406 4.231723 7.209436       8.758039 
1 1 1 14  32 14 o 20.82178 7.402370 6.108915       4.719444 2.480028       6.903240 9.293381       6.466727 18.93572 8.180580 24.49139 8.669107 -5.555670      11.91953 
1 1 1 14  32 15 o 23.61050 7.317117 8.418808       4.643778 11.47687       7.391693 6.424817       5.968733 26.22585 9.269745 21.34158 8.186552 4.884277       12.36721 
1 1 1 14  32 16 o 16.87036 7.128420 2.323091       5.036442 5.973729       7.146667 -1.278794      7.098784 21.12515 8.671737 16.58878 7.632815 4.536369       11.55244 
1 1 1 14  32 17 o 23.11300 9.287479 8.822115       7.995719 0.000000       0.000000 8.822115       7.995719 ?        ?        23.11300 9.287479 0.000000       9.287479 
1 1 1 14  32 18 o 14.79633 6.610500 0.2857490      4.868036 -0.6863496     6.476499 1.548217       7.380662 15.87210 7.298509 17.78636 8.026802 -1.914260      10.84886 
1 1 1 14  32 19 o 14.37669 6.873334 -4.207736      6.793449 -4.207736      6.793449 0.000000       0.000000 14.37669 6.873334 ?        ?        0.000000       6.873334 
1 1 1 14  32 20 f 30.88259 8.366287 17.23591       6.451047 20.50375       8.597071 13.02473       9.759384 30.87123 10.00444 23.90314 10.00050 6.968094       14.14563 
1 1 1 14  32 21 o 16.28144 7.231812 2.396346       5.739400 8.308892       8.049281 -3.718635      8.185918 20.67056 8.880818 15.21428 7.343190 5.456283       11.52351 
1 1 1 14  32 22 f 20.38580 8.015997 7.962963       5.833152 3.803898       8.052596 12.55482       8.461210 17.80647 8.169662 22.83602 9.411282 -5.029547      12.46257 
1 1 1 14  32 23 o 17.57741 7.594892 4.978398       5.951897 9.192789       8.207474 0.3038017      8.643988 20.22495 8.826856 16.26122 7.768538 3.963726       11.75855 
1 1 1 14  33 0  o 34.63140 4.302397 15.24998       3.552864 13.86364       4.651618 17.19119       5.504357 32.32900 6.128628 35.91080 6.530412 -3.581795      8.955801 
1 1 1 14  33 1  o 78.15771 2.912428 75.57137       5.537361 81.26082       7.969943 70.26203       7.699099 80.47461 4.077348 74.72523 4.245482 5.749382       5.886331 
1 1 1 14  33 2  o 38.76191 3.857460 18.94426       3.595389 18.40325       4.782632 19.64737       5.452206 37.62347 5.368489 38.61490 5.987798 -0.9914322     8.042040 
1 1 1 14  33 3  o 29.92575 5.349736 11.76694       3.758130 5.830219       5.375722 17.44196       5.255900 21.79327 7.881862 36.20193 6.179322 -14.40867      10.01538 
1 1 1 14  33 4  o 15.85102 5.658429 2.892530       2.760377 1.626796       3.405292 5.318006       4.713912 15.00763 6.050320 20.73636 7.395269 -5.728730      9.554914 
1 1 1 14  33 5  o 42.74820 3.663406 23.02107       3.779511 28.47794       6.392243 20.08799       4.686446 46.53180 5.760134 39.35805 4.998846 7.173752       7.626769 
1 1 1 14  33 6  f 46.47818 3.940201 27.37007       4.420745 30.63320       6.099148 23.75832       6.416687 48.50063 5.243711 41.94949 6.485974 6.551140       8.340526 
1 1 1 14  33 7  o 17.43001 5.698083 3.914654       2.785625 1.939044       3.655125 6.652065       4.302508 15.60109 6.275788 22.06664 7.070872 -6.465551      9.454245 
1 1 1 14  33 8  o 62.68515 2.679517 48.81949       4.083703 45.73603       5.979577 51.51474       5.590493 59.88619 4.122547 63.90265 3.604621 -4.016453      5.476192 
1 1 1 14  33 9  o 20.77020 6.338499 5.944123       3.501200 12.77732       6.695574 3.372491       4.107527 28.97143 8.749827 17.60094 6.781021 11.37049       11.06986 
1 1 1 14  33 10 o 51.41455 3.056459 33.20152       3.812206 40.06074       9.574258 31.90915       4.155851 52.67284 7.685359 50.21426 3.416577 2.458584       8.410574 
1 1 1 14  33 11 o 15.10174 5.828216 2.383214       3.038077 4.982421       5.946076 1.464951       3.534220 20.36277 8.066316 14.65642 6.065431 5.706347       10.09232 
1 1 1 14  33 12 o 9.488794 4.295680 -0.9181863     2.133507 10.10941       6.924375 -2.074906      2.242612 25.29456 8.968966 8.757143 4.115774 16.53741       9.868229 
1 1 1 14  33 13 o 13.74038 4.715888 2.364847       1.905575 12.84036       7.268316 1.591655       1.974648 27.70219 9.210932 12.41237 4.721586 15.28982       10.35059 
1 1 1 14  33 14 o 30.04172 6.829317 13.40543       4.885984 10.47165       6.760306 16.61390       7.069726 25.15752 8.867407 31.58822 8.838498 -6.430695      12.51998 
1 1 1 14  33 15 o 45.93895 6.009196 30.01632       6.566069 28.29711       8.622938 32.38880       10.12961 41.35046 8.826146 42.77512 9.911978 -1.424660      13.27208 
1 1 1 14  33 16 o 15.53223 7.039147 -0.1652909     5.747343 3.632548       7.421217 -5.856569      9.084724 19.13905 8.372295 16.18925 7.794149 2.949797       11.43871 
1 1 1 14  33 17 o 28.79543 9.898279 16.78106       8.395900 16.78106       8.395900 0.000000       0.000000 28.79543 9.898279 ?        ?        0.000000       9.898279 
1 1 1 14  33 18 o 25.42632 9.552662 13.38579       8.024905 0.000000       0.000000 13.38579       8.024905 ?        ?        25.42632 9.552662 0.000000       9.552662 
1 1 1 14  33 19 f 22.84262 8.224609 9.776789       5.845464 4.227444       8.013180 16.08864       8.545990 18.62136 8.387218 26.55409 9.881822 -7.932728      12.96132 
1 1 1 14  33 20 o 15.91156 7.029701 2.299022       5.352157 1.687204       6.951823 3.189461       8.386681 16.53189 7.587059 17.90483 8.259250 -1.372934      11.21511 
1 1 1 14  33 21 o 17.92701 7.648262 5.109157       5.893907 14.28229       8.638520 -2.880074      8.061817 23.82122 9.624770 15.11033 7.291607 8.710884       12.07492 
1 1 1 14  33 22 o 19.36330 7.858022 7.238988       5.787017 7.389846       7.777885 7.051913       8.661372 19.22561 8.484919 19.03714 8.633026 0.1884766      12.10467 
1 1 1 14  34 0  o 27.60981 7.105212 10.60084       4.808284 15.04563       6.535744 5.356912       7.099005 32.38548 8.257404 22.33401 8.824255 10.05148       12.08521 
1 1 1 14  34 1  o 41.41894 4.829491 22.17116       4.783216 24.93768       7.079616 19.84768       6.488014 42.67628 7.053693 37.83470 7.301463 4.841583       10.15214 
1 1 1 14  34 2  o 68.39178 3.646607 58.79554       6.055586 64.24400       9.365129 54.88071       7.938413 70.14194 5.523522 65.17100 5.037620 4.970940       7.475755 
1 1 1 14  34 3  o 27.92508 5.933772 10.58399       3.913299 7.354101       5.424404 14.08940       5.651031 23.21486 7.956936 31.51408 7.472600 -8.299221      10.91570 
1 1 1 14  34 4  f 36.61605 4.796711 17.48078       4.177256 15.97814       7.417294 18.17874       5.055155 32.51162 9.037074 36.80525 5.830301 -4.293625      10.75459 
1 1 1 14  34 5  o 33.36707 3.844154 14.24041       3.068695 14.14157       4.470275 14.32850       4.220101 32.27466 5.901161 32.71019 5.488455 -0.4355278     8.058960 
1 1 1 14  34 6  o 16.93818 5.368434 3.773259       2.485582 5.053892       3.413967 2.328703       3.625886 19.38182 6.306211 15.87939 6.296183 3.502430       8.911242 
1 1 1 14  34 7  o 24.18911 4.527636 7.756242       2.570801 10.35021       3.555139 4.913189       3.721915 27.57863 5.483039 19.21388 6.590855 8.364750       8.573395 
1 1 1 14  34 8  o 25.50407 4.314159 8.572491       2.585766 11.08573       3.624527 5.967631       3.690005 28.52707 5.411784 20.64776 6.540660 7.879313       8.489266 
1 1 1 14  34 9  f 37.35526 3.773755 17.95484       3.388219 28.18756       8.076009 15.76899       3.732603 43.48663 7.912266 34.58399 4.538357 8.902637       9.121438 
1 1 1 14  34 10 o 33.65674 5.074327 15.28146       4.032609 24.12730       8.439745 12.66445       4.590531 38.72065 9.099384 29.67160 6.526474 9.049049       11.19793 
1 1 1 14  34 11 o 21.18688 5.088196 6.205175       2.593923 7.315804       6.090624 5.959094       2.866923 22.27052 8.331457 20.58015 5.578180 1.690365       10.02643 
1 1 1 14  34 12 o 30.99562 4.537646 12.86557       3.325910 21.00427       7.612876 10.94576       3.697427 35.79096 8.792884 27.88865 5.634612 7.902309       10.44335 
1 1 1 14  34 13 o 32.10935 3.479138 13.34545       2.678876 40.09205       8.947398 10.71174       2.807673 51.52662 7.332426 28.36270 4.188033 23.16393       8.444175 
1 1 1 14  34 14 o 7.773321 3.634741 -1.435012      1.711402 2.544803       7.112555 -1.679590      1.763205 18.33909 8.102888 7.705830 3.630279 10.63326       8.878948 
1 1 1 14  34 15 o 16.15136 7.189038 1.128489       5.701833 2.441264       7.017032 -1.422917      9.782458 17.96451 7.986876 17.96475 8.489891 -0.2422333E-03 11.65626 
1 1 1 14  34 16 o 16.70609 6.923553 3.233364       4.614083 1.673155       6.877727 4.510265       6.222029 17.17625 7.750254 18.63227 7.900301 -1.456017      11.06712 
1 1 1 14  34 17 o 35.48001 7.378550 20.70917       6.171375 21.07940       8.268575 20.24355       9.272779 31.96015 9.738281 29.65264 10.39060 2.307512       14.24074 
1 1 1 14  34 18 o 17.65429 7.485455 4.294877       5.585530 12.80833       8.207330 -3.049935      7.623237 23.93899 9.478747 15.11182 7.239878 8.827176       11.92738 
1 1 1 14  34 19 o 13.84028 6.796264 -7.217401      7.902243 0.000000       0.000000 -7.217401      7.902243 ?        ?        13.84028 6.796264 0.000000       6.796264 
1 1 1 14  34 20 o 29.88414 8.484642 17.64429       6.465961 23.66701       9.789649 12.98376       8.611690 29.50164 10.64084 22.81276 9.456906 6.688875       14.23589 
1 1 1 14  35 0  o 16.57891 5.839730 3.370658       2.931597 2.789393       4.004000 4.042304       4.304050 16.88403 6.640615 18.60124 6.994313 -1.717211      9.644594 
1 1 1 14  35 1  o 28.61316 5.624876 11.10724       3.782184 12.71578       4.584772 7.680688       6.691607 30.23678 6.420822 23.64046 8.754238 6.596321       10.85650 
1 1 1 14  35 2  o 37.24567 4.023168 17.83385       3.593694 20.31309       4.980742 15.14167       5.190231 39.02048 5.381110 32.82461 6.715179 6.195869       8.605229 
1 1 1 14  35 3  o 49.19836 3.304181 30.54453       3.938447 27.09682       5.363839 34.57780       5.801478 45.38335 4.929085 51.50059 4.673477 -6.117241      6.792441 
1 1 1 14  35 4  o 38.11000 3.865422 18.65469       3.540213 20.70043       4.824122 16.26718       5.211525 39.42353 5.143990 34.02765 6.522176 5.395882       8.306589 
1 1 1 14  35 5  o 39.97488 4.038048 20.64068       3.879770 40.06623       8.930928 16.12189       4.307454 53.06458 7.083210 34.60367 5.274676 18.46090       8.831425 
1 1 1 14  35 6  o 53.18946 3.165275 35.71755       4.084177 47.34500       7.451923 30.72531       4.882853 59.59585 5.182655 48.70885 4.153253 10.88700       6.641492 
1 1 1 14  35 7  o 16.59105 5.241951 3.692904       2.371498 7.368364       3.308214 -0.1923810     3.401333 22.84219 5.901448 12.78759 5.628582 10.05460       8.155246 
1 1 1 14  35 8  o 26.17653 4.259918 9.076568       2.624022 15.74023       4.013957 4.103574       3.467569 34.19264 4.962094 17.69690 6.339153 16.49574       8.050294 
1 1 1 14  35 9  o 8.686238 4.175377 -3.359465      2.583595 -3.594744      5.915858 -3.304015      2.871951 14.25171 6.693936 9.372083 4.477500 4.879632       8.053371 
1 1 1 14  35 10 o 15.59807 5.814278 2.961420       2.960930 4.070508       6.735689 2.695768       3.296517 19.51977 8.245592 15.55219 6.052067 3.967579       10.22826 
1 1 1 14  35 11 o 9.240072 4.525700 -5.739182      3.435088 6.459247       6.675642 -10.13235      4.006176 21.13166 8.488003 8.745536 4.383154 12.38612       9.552917 
1 1 1 14  35 12 o 21.91236 5.390077 6.878144       2.858023 5.464329       7.690384 7.104701       3.078510 20.46711 8.734335 22.11118 5.682751 -1.644066      10.42028 
1 1 1 14  35 13 o 16.23563 5.868196 3.576324       2.979223 8.500150       6.567871 2.300747       3.342925 22.33245 8.582251 14.84204 5.990719 7.490403       10.46631 
1 1 1 14  35 14 o 10.52072 4.481243 0.4151175      2.017610 -0.7086939     6.231850 0.5467076      2.132464 15.40891 7.112083 10.91742 4.626918 4.491497       8.484697 
1 1 1 14  35 15 o 26.33607 7.894318 12.19934       5.465275 18.48697       8.923216 8.424680       6.913804 28.76047 10.18310 21.51285 8.639133 7.247625       13.35403 
1 1 1 14  35 16 o 14.08339 6.428993 -0.1728659     4.904028 2.374893       7.626061 -1.969322      6.403678 17.52151 8.005565 14.61433 6.895154 2.907182       10.56561 
1 1 1 14  35 17 o 29.11293 7.828350 15.16820       5.673510 25.70698       9.043915 8.329403       7.285364 34.06336 10.14204 20.75345 8.658467 13.30991       13.33529 
1 1 1 14  35 18 o 13.70261 6.437215 -1.433304      5.475196 -6.203381      7.560708 3.826516       7.939355 13.78207 6.742732 17.83577 8.156422 -4.053697      10.58261 
1 1 1 14  36 0  o 45.46235 3.542962 26.30893       3.894162 31.16676       5.558674 21.62703       5.457084 48.71069 4.742846 39.81022 5.795084 8.900467       7.488496 
1 1 1 14  36 1  o 29.98017 4.834604 11.99398       3.411968 17.74037       4.769791 5.972332       4.882692 36.09078 5.605110 20.86930 7.516491 15.22149       9.376295 
1 1 1 14  36 2  o 35.87845 4.683864 17.02879       3.997508 15.02157       4.837990 21.34809       7.096995 32.66343 6.306467 37.67266 7.979204 -5.009228      10.17051 
1 1 1 14  36 3  o 42.16480 3.705957 22.81800       3.769208 27.71359       5.394916 18.14957       5.268270 45.65151 4.927434 35.96844 6.236426 9.683067       7.948120 
1 1 1 14  36 4  o 15.35047 5.677776 2.786642       2.813356 1.161643       3.698175 5.019003       4.334542 14.49088 6.114926 19.35264 7.066031 -4.861766      9.344576 
1 1 1 14  36 5  o 20.34160 5.385530 5.775567       2.711210 5.861350       3.826403 5.689077       3.842104 20.26167 6.681182 20.01870 6.697788 0.2429695      9.460367 
1 1 1 14  36 6  o 40.26244 4.424783 21.42969       4.269917 47.69361       9.515320 14.80744       4.778001 57.26452 6.961549 32.11130 6.331058 25.15322       9.409860 
1 1 1 14  36 7  o 26.78544 4.609286 9.686948       2.900133 13.98024       4.014758 5.001919       4.193923 31.78032 5.375474 19.04361 6.950892 12.73671       8.786958 
1 1 1 14  36 8  o 13.53447 5.140808 2.033235       2.338734 3.434901       3.113034 0.2170518      3.543572 16.33085 5.984135 13.19102 5.777462 3.139835       8.317988 
1 1 1 14  36 9  o 12.28303 5.273027 0.5155541      2.833484 2.672764       7.131375 0.1111574      3.087670 18.53114 8.153604 12.30869 5.391963 6.222452       9.775199 
1 1 1 14  36 10 o 12.34018 5.240803 0.7506118      2.745531 10.37259       6.169540 -1.625449      3.065839 24.52154 8.482617 10.76972 4.977075 13.75182       9.834942 
1 1 1 14  36 11 o 8.182974 3.952833 -3.245920      2.384184 2.737641       6.279356 -4.253819      2.577175 17.64530 7.710474 8.075850 3.947962 9.569448       8.662436 
1 1 1 14  36 12 o 14.02130 5.866787 1.649016       3.359294 2.177731       7.298589 1.506904       3.783923 17.72951 7.993328 14.36563 6.128505 3.363878       10.07233 
1 1 1 14  36 13 f 8.261892 3.943074 -2.408149      2.215300 3.911133       7.390590 -3.031971      2.322071 18.52359 8.218242 8.112582 3.914422 10.41100       9.102867 
1 1 1 14  36 14 o 11.66983 5.193589 -0.5393127E-01 2.974805 7.039399       7.240931 -1.494268      3.262881 20.23631 8.548812 11.01234 5.105025 9.223963       9.957081 
1 1 1 14  36 15 o 9.687308 4.262467 -0.5283586E-01 1.949037 6.643695       7.222815 -0.5787458     2.024125 19.69420 8.436030 9.283115 4.195121 10.41108       9.421553 
1 1 1 14  36 16 o 69.74544 5.800636 73.46571       9.769720 84.41178       14.57282 64.52989       13.16685 65.75313 9.358668 56.08824 10.00007 9.664890       13.69620 
1 1 1 14  37 0  o 17.43675 6.142101 4.018801       3.243063 4.336681       4.194822 3.546524       5.113058 18.39302 6.907335 18.21262 7.388033 0.1804066      10.11407 
1 1 1 14  37 1  o 18.62847 6.074925 4.836191       3.167205 2.211501       4.019711 9.133436       5.143408 15.86628 6.507243 24.35708 7.722853 -8.490801      10.09885 
1 1 1 14  37 2  f 27.41050 5.231890 10.36526       3.367268 13.43312       4.454667 6.275608       5.143293 30.64021 6.179556 20.88822 7.685534 9.751989       9.861762 
1 1 1 14  37 3  o 15.55547 6.262591 2.384743       3.642997 2.878022       3.925677 -0.6750708     9.777233 16.38282 6.533168 19.06126 8.836535 -2.678446      10.98939 
1 1 1 14  37 4  o 15.54034 5.605692 3.071903       2.716972 3.961518       3.664953 1.986426       4.048349 17.41627 6.473197 15.52929 6.464710 1.886978       9.148483 
1 1 1 14  37 5  o 8.074276 3.943520 -4.260647      2.553963 -2.407552      3.396306 -6.672227      3.874439 10.92934 5.113687 9.674005 4.752106 1.255334       6.980853 
1 1 1 14  37 6  o 13.27092 5.208466 1.788850       2.458669 0.3036551      3.391158 3.434724       3.569889 12.97088 5.667117 16.55598 6.336136 -3.585094      8.500754 
1 1 1 14  37 7  o 17.55693 5.918519 4.378304       2.999666 8.240255       6.869479 3.468426       3.334356 22.33044 8.723117 16.37075 6.156072 5.959690       10.67661 
1 1 1 14  37 8  o 14.27128 5.117577 2.614691       2.260567 0.8146639      3.010353 4.942192       3.423125 12.78710 5.461004 18.37287 6.320121 -5.585766      8.352634 
1 1 1 14  37 9  o 33.21922 4.424341 15.03265       3.492604 16.79218       8.060504 14.62594       3.875287 29.00326 9.701211 32.22546 5.104702 -3.222206      10.96227 
1 1 1 14  37 10 o 14.81575 5.667195 2.743639       2.854915 -0.9312536     7.058076 3.462510       3.121686 15.94786 7.432028 15.98955 5.968082 -0.4168797E-01 9.531686 
1 1 1 14  37 11 o 14.54630 5.567160 2.653618       2.756010 18.34668       7.298795 0.4402071E-01  2.976350 30.92363 9.086646 11.81531 5.230037 19.10833       10.48429 
1 1 1 14  37 12 o 12.25240 5.190597 0.9694862      2.681872 17.71940       7.515175 -1.474902      2.870898 29.57520 9.329827 10.32365 4.786736 19.25155       10.48611 
1 1 1 14  37 13 o 22.33162 6.586475 8.146301       3.828863 15.33725       8.633680 6.385775       4.271929 25.62650 9.841949 19.59527 7.034051 6.031227       12.09718 
1 1 1 14  37 14 f 17.36409 5.568459 4.580557       2.667980 5.232296       8.694266 4.512805       2.803229 18.96799 8.620476 17.20565 5.720246 1.762333       10.34571 
1 1 1 14  38 0  o 13.90046 5.543352 1.875604       2.826310 5.139969       3.939670 -1.585958      4.056921 18.97798 6.761528 12.59402 5.785760 6.383959       8.899061 
1 1 1 14  38 1  o 20.31617 5.882275 6.006883       3.078691 7.978090       4.308338 3.949979       4.400992 22.73615 7.048181 17.72550 6.964925 5.010651       9.908937 
1 1 1 14  38 2  o 23.75523 5.420502 8.047965       3.068369 8.368292       4.210376 7.685152       4.480905 23.28055 6.917190 22.19660 7.224922 1.083950       10.00235 
1 1 1 14  38 3  o 34.87475 3.900534 16.04934       3.258198 23.48309       5.057104 10.77369       4.260260 41.16081 5.154460 26.63519 6.598044 14.52562       8.372733 
1 1 1 14  38 4  o 15.72858 5.904492 3.164680       3.064572 0.4419578      3.760846 8.545313       5.286894 13.53793 5.940032 22.75669 7.853341 -9.218758      9.846772 
1 1 1 14  38 5  o 15.17937 5.502228 3.027819       2.621634 0.4446854      3.698985 5.635017       3.716175 13.40631 5.886359 19.31614 6.586834 -5.909824      8.833776 
1 1 1 14  38 6  o 12.23842 5.172126 0.8726798      2.652150 4.438543       3.658976 -3.074617      3.849702 17.60814 6.481730 11.16626 5.291490 6.441880       8.367358 
1 1 1 14  38 7  o 10.74069 4.778624 -0.2766891     2.516464 1.788541       3.770682 -1.935220      3.379072 14.61458 6.171237 11.02038 5.137936 3.594198       8.030104 
1 1 1 14  38 8  o 11.20883 5.035172 -0.4463848     2.866508 -4.396736      6.082720 0.6813622      3.250018 13.46462 6.455075 12.85765 5.583688 0.6069708      8.534962 
1 1 1 14  38 9  o 16.51364 5.941747 3.920070       3.050211 9.751853       7.724902 2.842895       3.319981 22.37006 9.078642 15.21318 6.027063 7.156880       10.89712 
1 1 1 14  38 10 o 27.46577 5.156013 10.92623       3.324270 29.97471       8.898903 7.836981       3.583708 39.42448 9.396304 22.23497 6.317835 17.18951       11.32279 
1 1 1 14  38 11 o 13.63015 5.576608 1.916179       2.943182 5.735799       7.649101 1.252405       3.188676 19.25039 8.458109 13.18076 5.624526 6.069629       10.15750 
1 1 1 14  39 0  o 13.36325 5.542449 1.422333       2.960045 1.742755       4.080812 1.066556       4.300061 15.02508 6.385535 14.68215 6.398751 0.3429232      9.039860 
1 1 1 14  39 1  f 13.29078 5.528507 1.379743       2.957374 3.808241       4.180200 -1.053776      4.184519 17.13653 6.771179 12.93969 5.918945 4.196846       8.993484 
1 1 1 14  39 2  o 20.30476 6.090998 6.233425       3.252650 5.093722       4.687572 7.291717       4.517050 18.68384 7.231761 21.26673 7.261777 -2.582888      10.24850 
1 1 1 14  39 3  o 11.86092 5.185130 0.2452731      2.842398 0.1027544      4.376754 0.3492242      3.737927 13.93274 6.243175 13.30366 5.876258 0.6290808      8.573660 
1 1 1 14  39 4  o 10.72806 4.810431 -0.4595346     2.603218 0.7344288      3.814267 -1.500618      3.561708 13.69276 5.995726 11.61318 5.366026 2.079581       8.046301 
1 1 1 14  39 5  o 10.30631 4.811122 -1.855926      2.978065 -0.4795566     3.754915 -4.189698      4.889470 12.60329 5.702904 12.08543 5.792161 0.5178528      8.128483 
1 1 1 14  39 6  o 12.87674 5.280051 1.501619       2.645838 4.019610       3.799703 -0.8684770     3.686426 16.91046 6.520148 12.17966 5.565311 4.730796       8.572340 
1 1 1 14  39 7  o 19.54723 5.716166 5.799916       2.894371 5.241488       3.982829 6.424877       4.213416 18.37625 6.762835 19.84599 7.000066 -1.469740      9.733286 
1 1 1 14  39 8  o 23.45251 5.252525 8.087596       2.927127 12.33029       4.571955 5.140485       3.810475 27.52978 6.844194 18.17998 6.627077 9.349794       9.526865 
1 1 1 14  40 0  o 10.79587 4.979172 -1.368244      3.046274 1.902520       4.560974 -4.002351      4.093074 15.43782 6.659341 11.01714 5.285264 4.420687       8.501813 
1 1 1 14  40 1  o 11.33148 5.113215 -0.5587172     2.994046 -2.252661      4.392724 0.9110337      4.091723 12.36557 5.795330 14.11856 6.195277 -1.752986      8.483355 
1 1 1 14  40 2  o 15.69005 5.975585 3.278245       3.165203 3.421237       4.613846 3.151121       4.350315 16.73718 6.928714 16.31441 6.738363 0.4227753      9.665020 
1 1 1 14  40 3  o 12.48798 5.300227 0.9851288      2.805123 -1.171078      4.225753 2.683779       3.750687 12.74038 5.871837 15.37410 6.293316 -2.633723      8.607224 
1 1 1 15  0  0  o 103.2562 3.078897 130.2934       7.731651 130.2934       7.731651 130.2934       7.731651 103.2562 3.078897 103.2562 3.078897 0.000000       0.000000 
1 1 1 15  0  1  o 63.42925 3.240547 49.42093       4.978923 49.42093       4.978923 49.42093       4.978923 63.42925 3.240547 63.42925 3.240547 0.000000       0.000000 
1 1 1 15  0  2  o 213.4342 4.239247 556.0584       22.02938 556.0584       22.02938 556.0584       22.02938 213.4342 4.239247 213.4342 4.239247 0.000000       0.000000 
1 1 1 15  0  3  o 77.16918 3.927240 73.16316       7.341411 73.16316       7.341411 73.16316       7.341411 77.16918 3.927240 77.16918 3.927240 0.000000       0.000000 
1 1 1 15  0  4  o 94.48334 3.243181 109.2018       7.447314 109.2018       7.447314 109.2018       7.447314 94.48334 3.243181 94.48334 3.243181 0.000000       0.000000 
1 1 1 15  0  5  o 10.58626 6.613776 0.7807612      3.493154 0.7807612      3.493154 0.7807612      3.493154 10.58626 6.613776 10.58626 6.613776 0.000000       0.000000 
1 1 1 15  0  6  o 225.4123 5.384226 620.9982       29.53772 620.9982       29.53772 620.9982       29.53772 225.4123 5.384226 225.4123 5.384226 0.000000       0.000000 
1 1 1 15  0  7  o 169.3552 4.550552 350.5843       18.74948 350.5843       18.74948 350.5843       18.74948 169.3552 4.550552 169.3552 4.550552 0.000000       0.000000 
1 1 1 15  0  8  o 181.9095 4.758737 404.5159       21.06256 404.5159       21.06256 404.5159       21.06256 181.9095 4.758737 181.9095 4.758737 0.000000       0.000000 
1 1 1 15  0  9  o 131.0629 4.168491 210.1417       13.28305 210.1417       13.28305 210.1417       13.28305 131.0629 4.168491 131.0629 4.168491 0.000000       0.000000 
1 1 1 15  0  10 f 79.19263 3.158100 76.82520       6.072557 76.82520       6.072557 76.82520       6.072557 79.19263 3.158100 79.19263 3.158100 0.000000       0.000000 
1 1 1 15  0  11 f 100.7505 3.214829 124.1420       7.874764 124.1420       7.874764 124.1420       7.874764 100.7505 3.214829 100.7505 3.214829 0.000000       0.000000 
1 1 1 15  0  12 o 27.31731 6.315278 10.44229       3.658108 10.44229       3.658108 10.44229       3.658108 27.31731 6.315278 27.31731 6.315278 0.000000       0.000000 
1 1 1 15  0  13 o 155.5458 3.648645 295.5928       13.81294 295.5928       13.81294 295.5928       13.81294 155.5458 3.648645 155.5458 3.648645 0.000000       0.000000 
1 1 1 15  0  14 o 15.19876 7.663304 4.154306       3.508201 4.154306       3.508201 4.154306       3.508201 15.19876 7.663304 15.19876 7.663304 0.000000       0.000000 
1 1 1 15  0  15 o 40.56768 4.587313 20.84696       4.385738 20.84696       4.385738 20.84696       4.385738 40.56768 4.587313 40.56768 4.587313 0.000000       0.000000 
1 1 1 15  0  16 o 133.7311 4.316395 218.9999       14.03340 218.9999       14.03340 218.9999       14.03340 133.7311 4.316395 133.7311 4.316395 0.000000       0.000000 
1 1 1 15  0  17 o 133.6673 4.321117 218.8321       14.04194 218.8321       14.04194 218.8321       14.04194 133.6673 4.321117 133.6673 4.321117 0.000000       0.000000 
1 1 1 15  0  18 o 79.97234 4.268676 78.76144       8.264481 78.76144       8.264481 78.76144       8.264481 79.97234 4.268676 79.97234 4.268676 0.000000       0.000000 
1 1 1 15  0  19 o 32.45289 12.04080 17.42410       8.840055 17.42410       8.840055 17.42410       8.840055 32.45289 12.04080 32.45289 12.04080 0.000000       0.000000 
1 1 1 15  0  20 o 42.81473 9.780361 25.77008       8.890173 25.77008       8.890173 25.77008       8.890173 42.81473 9.780361 42.81473 9.780361 0.000000       0.000000 
1 1 1 15  0  21 o 17.44551 9.196837 5.445156       5.202696 5.445156       5.202696 5.445156       5.202696 17.44551 9.196837 17.44551 9.196837 0.000000       0.000000 
1 1 1 15  0  22 o 69.71998 4.688321 60.26513       7.881512 60.26513       7.881512 60.26513       7.881512 69.71998 4.688321 69.71998 4.688321 0.000000       0.000000 
1 1 1 15  0  23 o 35.31625 11.90885 19.96752       9.160068 19.96752       9.160068 19.96752       9.160068 35.31625 11.90885 35.31625 11.90885 0.000000       0.000000 
1 1 1 15  0  24 f 22.52904 10.00463 9.087627       5.801641 9.087627       5.801641 9.087627       5.801641 22.52904 10.00463 22.52904 10.00463 0.000000       0.000000 
1 1 1 15  0  25 o 40.52465 7.311409 22.11819       6.522762 22.11819       6.522762 22.11819       6.522762 40.52465 7.311409 40.52465 7.311409 0.000000       0.000000 
1 1 1 15  0  26 o 65.98988 5.223890 54.56305       8.275909 54.56305       8.275909 54.56305       8.275909 65.98988 5.223890 65.98988 5.223890 0.000000       0.000000 
1 1 1 15  0  27 f 48.07845 7.908775 31.03116       8.513356 31.03116       8.513356 31.03116       8.513356 48.07845 7.908775 48.07845 7.908775 0.000000       0.000000 
1 1 1 15  0  28 o 41.93690 9.422078 25.23290       8.404409 25.23290       8.404409 25.23290       8.404409 41.93690 9.422078 41.93690 9.422078 0.000000       0.000000 
1 1 1 15  0  29 o 12.94234 8.216716 1.069090       5.635199 1.069090       5.635199 1.069090       5.635199 12.94234 8.216716 12.94234 8.216716 0.000000       0.000000 
1 1 1 15  0  30 o 11.82333 7.717576 -0.1065924     5.439087 -0.1065924     5.439087 -0.1065924     5.439087 11.82333 7.717576 11.82333 7.717576 0.000000       0.000000 
1 1 1 15  0  31 f 14.67880 8.776670 3.445349       5.575163 3.445349       5.575163 3.445349       5.575163 14.67880 8.776670 14.67880 8.776670 0.000000       0.000000 
1 1 1 15  0  32 o 29.83734 9.478093 14.79423       6.063909 14.79423       6.063909 14.79423       6.063909 29.83734 9.478093 29.83734 9.478093 0.000000       0.000000 
1 1 1 15  0  33 o 12.52421 7.952431 1.626085       5.280794 1.626085       5.280794 1.626085       5.280794 12.52421 7.952431 12.52421 7.952431 0.000000       0.000000 
1 1 1 15  0  34 f 12.84541 8.107978 2.220721       5.396936 2.220721       5.396936 2.220721       5.396936 12.84541 8.107978 12.84541 8.107978 0.000000       0.000000 
1 1 1 15  0  35 o 10.33124 7.224342 -4.152580      6.736287 -4.152580      6.736287 -4.152580      6.736287 10.33124 7.224342 10.33124 7.224342 0.000000       0.000000 
1 1 1 15  0  36 o 14.58681 8.470928 4.841794       4.935228 4.841794       4.935228 4.841794       4.935228 14.58681 8.470928 14.58681 8.470928 0.000000       0.000000 
1 1 1 15  0  37 o 7.722455 5.516419 -5.282499      4.690625 -5.282499      4.690625 -5.282499      4.690625 7.722455 5.516419 7.722455 5.516419 0.000000       0.000000 
1 1 1 15  0  38 o 12.34176 7.790935 3.266798       4.984656 3.266798       4.984656 3.266798       4.984656 12.34176 7.790935 12.34176 7.790935 0.000000       0.000000 
1 1 1 15  0  39 o 16.73231 9.381988 8.456359       5.761648 8.456359       5.761648 8.456359       5.761648 16.73231 9.381988 16.73231 9.381988 0.000000       0.000000 
1 1 1 15  0  40 o 12.68036 8.596817 4.087203       7.929605 4.087203       7.929605 4.087203       7.929605 12.68036 8.596817 12.68036 8.596817 0.000000       0.000000 
1 1 1 15  1  0  o 217.9075 3.312770 578.9620       17.59137 563.4171       22.22785 605.0180       28.77772 214.9147 4.244193 222.6370 5.304237 -7.722275      6.793240 
1 1 1 15  1  1  o 239.0329 3.532378 696.7554       20.57600 675.5107       26.05270 731.9763       33.54496 235.2968 4.543605 244.8448 5.622122 -9.547974      7.228597 
1 1 1 15  1  2  o 324.1037 4.088533 1281.403       32.29146 1309.142       46.23923 1254.995       45.11554 327.3985 5.795592 320.5591 5.775400 6.839447       8.181939 
1 1 1 15  1  3  o 209.8359 2.969540 536.8516       15.18466 542.4072       21.58772 531.4113       21.36276 210.8487 4.201456 208.7006 4.200466 2.148087       5.941056 
1 1 1 15  1  4  o 318.0201 4.412148 1234.239       34.19328 1234.050       53.73960 1234.368       44.32278 317.6268 6.942905 317.8661 5.721985 -0.2392883     8.996947 
1 1 1 15  1  5  o 101.9684 2.680150 126.8552       6.654019 125.9498       9.209983 127.8439       9.624078 101.5410 3.728373 102.2928 3.867772 -0.7518234     5.372190 
1 1 1 15  1  6  o 337.3182 5.183414 1389.894       42.60807 1418.625       60.87257 1362.297       59.65955 340.3560 7.339257 333.5303 7.340212 6.825745       10.37995 
1 1 1 15  1  7  o 236.6593 4.556421 683.8552       26.27746 670.2631       31.61932 714.2014       47.24574 234.1782 5.540769 241.1862 8.049760 -7.008072      9.772346 
1 1 1 15  1  8  f 55.89291 3.018106 38.21276       4.095561 42.89548       5.713569 33.26381       5.873746 59.14939 3.987182 51.97833 4.687524 7.171055       6.153901 
1 1 1 15  1  9  o 123.2291 2.549437 185.1652       7.655857 188.4139       9.768219 179.9916       12.32679 124.2355 3.229253 121.3474 4.174752 2.888016       5.277938 
1 1 1 15  1  10 f 231.1591 3.170126 651.8815       17.85763 659.6357       25.33082 644.2199       25.17886 232.3868 4.473028 229.6519 4.499144 2.734863       6.344311 
1 1 1 15  1  11 f 83.94490 2.485404 86.00643       5.078658 80.23842       7.942403 89.99615       6.605573 80.96217 4.038377 85.82752 3.163673 -4.865349      5.130041 
1 1 1 15  1  12 f 130.0870 2.398666 206.3657       7.603960 211.8335       10.78633 200.9637       10.72121 131.7032 3.363544 128.2712 3.432963 3.432022       4.806107 
1 1 1 15  1  13 o 204.4057 2.964269 509.7968       14.76545 498.9465       20.61125 521.2354       21.16267 202.0791 4.185494 206.5408 4.204637 -4.461700      5.932734 
1 1 1 15  1  14 o 46.26216 3.022531 26.22878       3.388816 24.27296       4.454611 28.91565       5.221172 44.37356 4.168359 48.42782 4.474809 -4.054260      6.115483 
1 1 1 15  1  15 o 260.0936 3.832689 826.5406       24.29234 811.5795       31.03172 850.2199       39.03986 257.4930 4.945433 263.2415 6.085803 -5.748505      7.841830 
1 1 1 15  1  16 o 110.7330 2.621001 149.6136       7.072624 154.7541       9.392545 142.8819       10.74841 112.5112 3.429723 108.0278 4.090323 4.483353       5.337953 
1 1 1 15  1  17 o 86.21886 2.777634 90.82536       5.828360 90.18089       9.493819 91.21516       7.383509 85.71204 4.561734 86.33245 3.516922 -0.6204071     5.760048 
1 1 1 15  1  18 o 52.83618 3.649293 34.28642       4.669819 32.19593       7.207037 35.79925       6.130942 50.85176 5.926843 53.85516 4.719223 -3.003403      7.576182 
1 1 1 15  1  19 o 31.43570 4.968177 12.41001       3.679577 15.72409       5.305268 9.338084       5.107766 35.19960 6.421445 27.07262 7.489475 8.126978       9.865455 
1 1 1 15  1  20 o 125.6428 3.099666 192.8912       9.490486 176.0822       12.97197 212.2509       13.92142 119.7824 4.451775 131.5464 4.348763 -11.76398      6.223346 
1 1 1 15  1  21 f 43.92612 4.218374 23.86241       4.460040 26.15139       6.350150 21.63399       6.265596 45.71379 5.833030 41.38797 6.420156 4.325825       8.674252 
1 1 1 15  1  22 o 95.20032 3.627502 111.1319       8.400147 118.1992       10.30368 97.12524       14.50554 98.05676 4.322623 88.27383 6.795464 9.782921       8.053782 
1 1 1 15  1  23 o 87.06825 3.148598 92.87589       6.669565 92.49952       9.631655 93.22261       9.244623 86.62873 4.578760 87.01104 4.373950 -0.3823090     6.332178 
1 1 1 15  1  24 o 49.76358 4.052238 30.61923       4.871587 22.71961       6.986672 38.09401       6.796204 42.12965 7.054475 55.32863 5.097857 -13.19898      8.703664 
1 1 1 15  1  25 o 68.77100 3.484831 58.19018       5.821103 56.64310       8.076031 59.86306       8.397968 67.51729 4.942725 69.40421 4.998867 -1.886925      7.029879 
1 1 1 15  1  26 o 69.61718 3.917253 59.89867       6.618791 58.29198       8.210699 62.88023       11.18502 68.38327 4.960864 70.44687 6.591920 -2.063599      8.250065 
1 1 1 15  1  27 f 61.98529 3.552316 47.50608       5.343352 53.09514       7.453458 41.59645       7.664232 65.18789 4.724016 57.37881 5.550492 7.809082       7.288641 
1 1 1 15  1  28 o 79.19216 3.391628 77.56065       6.530095 75.77330       9.222277 79.35786       9.247673 77.65325 4.898477 79.52560 4.794142 -1.872345      6.854113 
1 1 1 15  1  29 o 62.39575 4.162553 48.82368       6.293032 59.64806       11.10857 43.70816       7.636619 67.43718 6.854783 58.44398 5.423868 8.993202       8.741076 
1 1 1 15  1  30 o 23.39483 7.113974 7.419214       4.415560 10.05601       5.735087 3.580946       6.919421 26.82744 8.097016 20.91446 8.553008 5.912973       11.77776 
1 1 1 15  1  31 o 27.27771 6.521958 10.30711       4.276543 12.82060       6.269058 8.119394       5.848691 29.58141 8.339387 24.15438 8.262748 5.427027       11.73961 
1 1 1 15  1  32 o 31.25650 5.696783 13.34130       4.179342 15.63462       5.996165 11.17453       5.828370 32.56452 7.681324 27.21506 8.151073 5.349463       11.20012 
1 1 1 15  1  33 o 23.81328 6.653488 8.340952       4.009379 4.683914       5.647207 12.05794       5.693310 19.57951 7.826491 27.72272 7.990856 -8.143208      11.18516 
1 1 1 15  1  34 o 13.86987 6.108551 0.3602470      4.011637 1.545571       7.676431 -0.8508907E-01 4.705273 18.13552 8.185061 14.42544 6.467880 3.710086       10.43210 
1 1 1 15  1  35 o 15.40686 6.228330 2.750037       3.619597 1.674009       5.072146 3.866660       5.166936 15.69635 6.892339 17.50343 7.296312 -1.807077      10.03696 
1 1 1 15  1  36 o 12.86582 5.815681 -0.6068050E-01 3.892960 -1.687072      4.722027 3.390285       6.878382 12.86192 6.021727 17.43887 7.819468 -4.576946      9.869411 
1 1 1 15  1  37 o 15.98699 6.451981 3.866703       3.876946 3.879858       4.858012 3.843630       6.433818 16.30744 6.950074 16.79711 7.544661 -0.4896622     10.25795 
1 1 1 15  1  38 o 10.42094 4.941433 -1.848261      3.367499 -3.827590      4.672978 0.2900998      4.857080 11.15111 5.421154 13.29180 6.184496 -2.140690      8.224166 
1 1 1 15  1  39 o 11.53847 5.470506 -1.086271      4.124160 2.612309       4.958680 -9.385691      7.428010 14.28585 6.499473 11.72498 5.889202 2.560866       8.770739 
1 1 1 15  1  40 o 11.79191 5.427484 0.5936829      3.593478 1.230696       4.925697 -0.1310962     5.254074 13.07010 6.129140 12.59876 6.029087 0.4713392      8.597456 
1 1 1 15  2  0  o 245.3705 3.276620 734.0895       19.59226 765.0479       28.30898 705.6288       27.14306 250.4047 4.639227 240.4846 4.631646 9.920074       6.555499 
1 1 1 15  2  1  o 415.2629 5.552818 2105.494       56.19177 2042.734       70.98102 2210.858       91.96970 408.7529 7.125990 424.8401 8.883481 -16.08713      11.38841 
1 1 1 15  2  2  o 228.9388 3.443884 639.1665       19.21339 653.7447       24.96200 617.9747       30.09623 231.4709 4.425341 224.9644 5.489871 6.506531       7.051405 
1 1 1 15  2  3  o 113.1034 2.515579 155.9438       6.933456 158.5397       8.833323 151.7778       11.19028 113.9800 3.183354 111.4607 4.126992 2.519287       5.212083 
1 1 1 15  2  4  o 129.9557 2.887666 205.9180       9.144893 208.8094       12.40840 202.4803       13.52992 130.7703 3.898123 128.7399 4.318782 2.030426       5.817839 
1 1 1 15  2  5  o 100.6903 3.935455 123.8895       9.637880 119.8186       13.19525 128.5450       14.11080 98.88178 5.497667 102.4114 5.676357 -3.529587      7.902238 
1 1 1 15  2  6  o 369.8659 6.486988 1673.517       58.46871 1700.350       72.00355 1621.572       100.1825 372.4514 7.933195 362.4199 11.35743 10.03156       13.85376 
1 1 1 15  2  7  o 100.3904 3.110644 123.0367       7.600708 125.1197       9.116777 118.2886       13.76418 101.1968 3.703153 98.19463 5.777633 3.002144       6.862535 
1 1 1 15  2  8  o 42.86868 3.201517 22.54129       3.320354 22.82607       3.681764 21.30068       7.684677 43.10890 3.535759 40.97885 7.982477 2.130051       8.730494 
1 1 1 15  2  9  o 15.25569 5.449547 2.415858       2.560768 2.381899       2.816700 2.577665       6.148365 15.57759 5.694742 20.48458 8.173702 -4.906993      9.961903 
1 1 1 15  2  10 f 116.4233 2.813418 165.3161       7.981973 165.8301       9.067340 163.5466       16.82474 116.5438 3.195690 115.4426 6.001225 1.101234       6.799054 
1 1 1 15  2  11 o 245.3781 3.624691 734.9240       21.67419 758.2150       28.44077 702.6586       33.47464 249.0891 4.685442 239.6150 5.732788 9.474075       7.403933 
1 1 1 15  2  12 o 210.8068 3.275869 542.3248       16.82857 556.7782       22.03621 522.1007       26.06668 213.4846 4.235787 206.5305 5.183330 6.954178       6.693937 
1 1 1 15  2  13 o 117.6940 2.610110 168.9612       7.485987 152.7895       11.40745 181.1931       9.921060 111.7456 4.196568 121.7915 3.345929 -10.04585      5.367162 
1 1 1 15  2  14 o 228.8540 3.502588 639.5037       19.53366 657.4492       31.28100 628.0329       25.00921 231.6749 5.540713 226.6313 4.528392 5.043564       7.155825 
1 1 1 15  2  15 o 52.43439 3.064940 33.67299       3.899209 32.65162       6.415050 34.27142       4.910390 51.37780 5.195056 52.82313 3.840902 -1.445328      6.460738 
1 1 1 15  2  16 o 52.80859 2.844454 34.13423       3.646985 31.59294       5.059600 36.88245       5.261558 50.66467 4.133929 54.78733 3.967810 -4.122658      5.729999 
1 1 1 15  2  17 o 83.33992 2.480158 84.81955       5.031357 79.03477       6.961648 91.14521       7.279839 80.34577 3.564473 86.30368 3.468502 -5.957909      4.973527 
1 1 1 15  2  18 f 61.98096 2.938418 47.01222       4.425574 49.26191       5.944807 44.21555       6.628234 63.35157 3.869194 59.91451 4.574310 3.437057       5.991241 
1 1 1 15  2  19 o 119.4037 2.767008 174.0734       8.051270 169.6892       10.43880 180.5113       12.64944 117.7465 3.642414 121.3437 4.284500 -3.597198      5.623532 
1 1 1 15  2  20 f 55.12841 3.513058 37.31530       4.694954 36.70321       6.586772 37.94745       6.693858 54.45499 5.020094 55.37875 5.014467 -0.9237633     7.095508 
1 1 1 15  2  21 o 189.0542 4.185714 438.0457       19.28378 448.2762       23.61777 417.5849       33.40028 190.9201 5.080863 183.2667 7.494586 7.653351       9.054501 
1 1 1 15  2  22 o 73.88959 3.234280 66.91156       5.809564 73.58103       8.672593 61.48257       7.824616 77.26436 4.627305 70.61323 4.571739 6.651131       6.504825 
1 1 1 15  2  23 o 71.84100 3.334052 63.31869       5.820963 64.92793       8.548278 61.92731       7.948568 72.47317 4.868465 70.82008 4.631115 1.653091       6.719314 
1 1 1 15  2  24 f 78.39807 4.732636 76.00678       8.999481 76.00678       8.999481 0.000000       0.000000 78.39807 4.732636 ?        ?        0.000000       4.732636 
1 1 1 15  2  25 o 112.6207 3.191908 155.6160       8.751179 169.3152       12.73645 143.3647       12.04458 117.0925 4.471800 107.6901 4.600252 9.402397       6.415552 
1 1 1 15  2  26 o 76.57432 3.327668 72.16459       6.194713 66.83844       8.410830 78.47918       9.158089 73.31236 4.733175 79.45748 4.751406 -6.145119      6.706624 
1 1 1 15  2  27 o 79.37016 3.346699 77.68913       6.458538 83.68560       9.084632 71.56120       9.183678 81.96491 4.566288 75.60467 5.012928 6.360245       6.780888 
1 1 1 15  2  28 o 71.44108 3.416059 63.16980       5.929927 69.09543       8.479399 57.49777       8.295976 74.21298 4.713013 67.51422 5.079638 6.698761       6.929301 
1 1 1 15  2  29 o 17.30543 6.583470 2.959062       3.839265 -2.043464      5.243962 8.738193       5.636326 14.99139 6.765634 25.51560 8.083745 -10.52421      10.54138 
1 1 1 15  2  30 o 14.05032 6.144635 -0.3456377     3.995092 -0.1273309     6.608525 -0.4713726     5.015320 17.93415 7.871348 15.57128 6.844981 2.362868       10.43129 
1 1 1 15  2  31 o 32.16756 7.125783 14.53623       5.438587 11.27588       7.807618 17.60931       7.580075 27.59381 9.542652 34.26864 8.972903 -6.674831      13.09867 
1 1 1 15  2  32 o 47.35117 4.184527 28.93939       4.778867 36.83635       7.064519 22.27709       6.488801 52.33771 5.627303 39.60934 6.977285 12.72837       8.963763 
1 1 1 15  2  33 f 38.09838 5.689547 20.11684       5.120653 6.633842       8.567245 27.61079       6.387093 22.39627 9.369920 44.37140 6.065580 -21.97513      11.16184 
1 1 1 15  2  34 o 10.75952 5.087409 -2.950476      3.521093 -3.131869      5.137565 -2.789798      4.835321 13.17189 6.202733 12.93711 6.068647 0.2347794      8.677693 
1 1 1 15  2  35 o 22.46775 6.363885 7.896011       3.641920 6.862477       5.016703 9.047612       5.295503 20.38405 7.573983 22.76620 7.859593 -2.382151      10.91506 
1 1 1 15  2  36 o 18.04107 6.396341 5.171722       3.521674 10.81592       4.982511 -0.4629115     4.978290 24.51631 7.576156 13.82670 6.372777 10.68961       9.900022 
1 1 1 15  2  37 o 14.38393 6.016626 2.518674       3.531406 0.7979319      5.017747 4.207440       4.970907 14.18266 6.485243 16.58894 7.048790 -2.406282      9.578300 
1 1 1 15  2  38 o 14.53850 6.550773 2.324995       4.893612 2.324995       4.893612 0.000000       0.000000 14.53850 6.550773 ?        ?        0.000000       6.550773 
1 1 1 15  2  39 o 12.45366 5.617192 1.121272       3.608891 2.057108       5.192046 0.2465007      5.019795 14.03481 6.482774 12.97088 6.115190 1.063931       8.911898 
1 1 1 15  2  40 o 12.36326 5.550574 1.486529       3.477846 3.285141       4.781929 -0.5331613     5.067301 14.22443 6.436165 12.29820 5.894775 1.926229       8.727691 
1 1 1 15  3  0  o 188.4517 2.752441 432.9350       12.64021 436.6558       17.87845 429.2163       17.87345 189.2133 3.877414 187.5930 3.909811 1.620331       5.506447 
1 1 1 15  3  1  o 140.0901 2.386170 239.2173       8.146011 245.5240       11.56260 233.0024       11.47826 141.8978 3.343828 138.2300 3.407515 3.667755       4.774133 
1 1 1 15  3  2  o 466.0045 5.628740 2652.144       63.92009 2782.905       93.29073 2536.438       87.75623 476.7809 8.029407 455.2100 7.910975 21.57092       11.27186 
1 1 1 15  3  3  o 201.9506 2.899575 497.2591       14.26972 488.2398       19.89541 506.8145       20.47808 200.0460 4.081190 203.8131 4.123074 -3.767044      5.801366 
1 1 1 15  3  4  o 367.0161 4.977667 1644.675       44.51917 1653.078       70.09409 1638.992       57.63733 367.3902 7.829206 366.1212 6.460153 1.268982       10.15037 
1 1 1 15  3  5  o 119.3493 2.760586 173.6778       8.028922 181.4517       11.05618 165.0040       11.67859 121.9000 3.726282 116.2084 4.130552 5.691612       5.562970 
1 1 1 15  3  6  o 47.49139 3.520383 27.66470       4.045216 26.59820       5.666461 28.77312       5.776732 46.38705 5.096640 48.28264 4.981116 -1.895596      7.126518 
1 1 1 15  3  7  o 209.0614 4.201275 533.5172       21.40381 508.9107       34.68709 548.6470       27.19945 203.7352 6.996982 211.8943 5.267503 -8.159073      8.758101 
1 1 1 15  3  8  o 154.1006 3.562914 289.7517       13.37968 282.7562       21.52079 294.1592       17.08231 151.9403 5.823091 155.1361 4.523365 -3.195724      7.373549 
1 1 1 15  3  9  o 27.46931 5.735966 9.573042       3.715514 11.33016       5.129919 7.634190       5.388689 29.81230 7.152856 25.10046 7.897938 4.711836       10.65555 
1 1 1 15  3  10 o 22.67349 6.301067 6.478833       3.606359 5.249050       4.978096 7.837095       5.231673 21.88220 7.616885 25.26573 7.755370 -3.383528      10.87027 
1 1 1 15  3  11 o 226.6574 4.484726 627.6731       24.77091 643.1320       42.08377 619.4778       30.64123 228.7352 7.560362 225.0031 5.588325 3.732117       9.401514 
1 1 1 15  3  12 o 94.94324 2.825338 110.0609       6.529608 117.6182       13.24898 107.6365       7.504254 97.86711 5.578431 93.85622 3.286086 4.010887       6.474353 
1 1 1 15  3  13 o 231.4344 3.509341 653.9218       19.79200 616.8679       30.00762 682.4532       26.33151 224.4601 5.486006 236.2655 4.573401 -11.80545      7.142287 
1 1 1 15  3  14 o 130.7360 2.440300 208.4726       7.774533 200.3604       10.70811 217.5159       11.30594 128.0560 3.434544 133.4246 3.480211 -5.368622      4.889576 
1 1 1 15  3  15 o 245.7743 3.361462 737.5930       20.13264 743.7214       28.45949 731.4540       28.48423 246.5312 4.737172 244.4798 4.781073 2.051407       6.730487 
1 1 1 15  3  16 o 139.3709 2.537954 236.9914       8.619695 245.7898       12.26426 228.4027       12.11725 141.7992 3.552003 136.6771 3.641323 5.122086       5.086842 
1 1 1 15  3  17 o 84.85572 2.448111 87.92661       5.057014 92.24433       7.163712 83.63773       7.139742 86.83013 3.392094 82.65668 3.552907 4.173454       4.912173 
1 1 1 15  3  18 o 39.52544 3.655854 19.25975       3.481398 21.22904       4.797008 17.06825       5.060426 41.34192 4.853846 36.83396 5.831693 4.507954       7.587388 
1 1 1 15  3  19 o 106.4210 2.692039 138.3537       6.975828 143.2135       9.228981 131.8765       10.65448 108.1783 3.505512 103.6994 4.225036 4.478897       5.489950 
1 1 1 15  3  20 o 53.22997 4.326772 34.94347       5.564143 34.07996       6.530953 37.22964       10.62673 52.42628 5.179615 54.12798 8.322525 -1.701691      9.802695 
1 1 1 15  3  21 o 118.8052 3.107177 172.6601       8.988030 178.3659       13.01823 167.4628       12.42453 120.5081 4.440615 116.7758 4.373805 3.732285       6.232915 
1 1 1 15  3  22 o 17.29758 6.631735 2.536061       3.915406 0.2191858      5.177166 5.632005       5.984630 16.95544 7.198601 23.05076 8.319018 -6.095314      11.00118 
1 1 1 15  3  23 o 62.74833 3.807783 48.45195       5.795107 48.39596       7.461915 48.53704       9.199114 62.50295 4.939190 62.31899 6.136989 0.1839600      7.877705 
1 1 1 15  3  24 o 63.60429 3.461318 49.74102       5.344712 45.59917       7.666977 53.65660       7.454623 60.52863 5.249753 65.82915 4.677454 -5.300522      7.031250 
1 1 1 15  3  25 o 83.68900 3.791517 86.26575       7.712372 81.90395       9.117622 97.23570       14.45942 81.32862 4.619464 87.84573 6.807603 -6.517105      8.226962 
1 1 1 15  3  26 o 76.60227 3.935866 72.51844       7.322503 73.81843       8.798972 69.59006       13.20617 77.05579 4.708350 73.71297 7.454183 3.342819       8.816654 
1 1 1 15  3  27 o 50.76279 4.454118 32.21888       5.454114 40.52137       9.410416 28.01920       6.692875 55.98555 7.053822 46.81852 6.004267 9.167027       9.263241 
1 1 1 15  3  28 o 18.24380 6.535717 3.741621       3.686046 9.763930       5.353564 -1.686682      5.082690 26.98012 7.740068 15.06709 6.741407 11.91303       10.26427 
1 1 1 15  3  29 o 38.54101 4.632969 18.91887       4.264154 19.63011       6.165651 18.26677       5.903723 38.34846 6.849081 36.98432 6.801005 1.364140       9.652129 
1 1 1 15  3  30 o 28.49144 6.227590 10.96304       4.202879 4.955073       5.626958 18.54430       6.320921 20.99139 7.973829 36.69926 7.324607 -15.70787      10.82736 
1 1 1 15  3  31 o 23.53766 7.352571 7.756570       4.678728 21.52363       8.595339 1.959849       5.577423 37.58355 9.407702 17.93199 7.534959 19.65156       12.05324 
1 1 1 15  3  32 f 24.96206 7.162687 9.080097       4.584163 7.492679       8.005313 9.854616       5.591759 23.55114 9.349776 25.61975 8.043162 -2.068617      12.33332 
1 1 1 15  3  33 o 21.10401 6.720948 6.506217       3.891832 8.545751       5.673127 4.693124       5.348932 23.45774 8.133195 19.35546 7.655856 4.102289       11.16965 
1 1 1 15  3  34 o 26.34396 6.259646 10.37029       3.958840 11.18423       5.573442 9.541464       5.624192 25.82578 8.018213 23.83935 8.103700 1.986433       11.40007 
1 1 1 15  3  35 o 17.28323 6.426912 4.337617       3.613572 11.12515       5.176688 -2.112864      5.046522 25.38235 7.699539 13.28036 6.220070 12.10199       9.898089 
1 1 1 15  3  36 o 13.56292 5.771970 1.552099       3.342109 1.882297       4.631341 1.193311       4.827682 15.05270 6.598569 14.71384 6.577684 0.3388538      9.317030 
1 1 1 15  3  37 o 13.94446 6.092122 1.759747       3.918365 3.877296       4.747294 -2.766352      6.940512 16.20791 6.887713 13.99696 6.757110 2.210953       9.648788 
1 1 1 15  3  38 o 18.67917 6.566014 6.564736       3.704774 6.644920       5.157176 6.479230       5.325564 17.87087 7.354442 17.67268 7.390172 0.1981888      10.42605 
1 1 1 15  3  39 o 22.52851 6.844244 10.17301       4.088346 10.58034       5.029573 9.379680       7.019132 21.21695 7.630359 18.22265 8.050555 2.994295       11.09206 
1 1 1 15  4  0  o 194.8076 3.087676 462.7023       14.65797 462.1801       23.14096 463.0523       18.94265 194.5412 4.885143 194.8387 3.989601 -0.2974854     6.307261 
1 1 1 15  4  1  o 479.3611 5.768597 2806.543       67.38590 2732.191       93.50016 2886.903       97.20382 472.4140 8.121822 485.5787 8.214622 -13.16470      11.55180 
1 1 1 15  4  2  o 399.3111 4.897676 1946.362       47.65818 1987.426       68.18633 1907.142       66.63804 403.1300 6.940906 394.9070 6.924544 8.222931       9.804360 
1 1 1 15  4  3  o 155.7560 2.533674 295.7478       9.616821 281.4808       13.22205 311.7724       14.01285 151.9137 3.571627 159.8778 3.596684 -7.964142      5.068792 
1 1 1 15  4  4  o 258.8286 4.186797 817.5031       26.40768 794.0871       50.23397 826.4454       31.04325 254.4374 8.112145 260.1679 4.896405 -5.730484      9.475320 
1 1 1 15  4  5  f 251.2419 4.107785 770.3167       25.14988 806.9348       49.90709 757.8522       29.11734 256.4638 7.995229 249.1302 4.796110 7.333572       9.323430 
1 1 1 15  4  6  o 258.0582 4.192000 812.8252       26.36180 832.8270       37.34412 792.9577       37.21862 260.9958 5.871548 254.6531 5.997568 6.342651       8.393205 
1 1 1 15  4  7  f 216.8637 3.314403 573.6998       17.51573 575.0330       22.26016 571.5323       28.38276 217.0384 4.208774 216.2477 5.386008 0.7906494      6.835413 
1 1 1 15  4  8  o 168.0890 2.869078 344.5779       11.75216 364.7632       15.17121 314.2925       18.58321 172.8962 3.600799 160.3320 4.761523 12.56418       5.969744 
1 1 1 15  4  9  o 223.4579 3.400987 609.2565       18.51982 608.3360       23.50361 610.7638       30.07775 223.1939 4.321317 223.4806 5.522930 -0.2866516     7.012598 
1 1 1 15  4  10 o 265.2465 3.856061 858.8842       24.92468 851.5142       31.66449 870.8887       40.41212 263.9475 4.922875 266.6870 6.218329 -2.739441      7.931098 
1 1 1 15  4  11 o 104.8545 2.523285 134.0803       6.447474 135.1379       7.950513 132.0488       11.01917 105.1977 3.104761 103.8750 4.362845 1.322762       5.354807 
1 1 1 15  4  12 o 456.7310 6.098461 2556.082       67.87609 2542.819       86.88244 2576.857       108.7357 454.7108 7.840805 456.5758 9.772894 -1.864990      12.52947 
1 1 1 15  4  13 f 195.7929 2.887296 467.7294       13.77604 467.8105       19.26302 467.6444       19.70917 195.6818 4.039595 195.6346 4.134151 0.4713440E-01  5.780098 
1 1 1 15  4  14 o 201.1829 2.942983 493.9236       14.42829 504.3924       20.36888 483.3809       20.44068 203.1540 4.114391 198.8623 4.218002 4.291702       5.892347 
1 1 1 15  4  15 o 94.07900 2.572230 108.0617       5.891567 117.6061       9.318026 101.7048       7.604544 98.02290 3.908696 91.19453 3.428010 6.828362       5.198957 
1 1 1 15  4  16 o 246.3470 3.709752 741.5848       22.27041 756.1141       35.29527 731.9740       28.70624 248.2189 5.835062 244.5023 4.817894 3.716629       7.567038 
1 1 1 15  4  17 o 209.0461 3.718718 534.1637       18.94399 535.7041       26.91136 532.6506       26.67193 208.9419 5.289607 208.3541 5.257306 0.5877838      7.457829 
1 1 1 15  4  18 o 86.96889 2.628247 92.40170       5.563750 99.46101       7.430860 83.39502       8.393442 90.15617 3.388293 82.44421 4.191518 7.711960       5.389745 
1 1 1 15  4  19 o 41.96328 4.340151 21.79381       4.374254 21.28600       4.912595 23.73731       9.610632 41.36463 4.973183 42.81089 9.464071 -1.446262      10.69117 
1 1 1 15  4  20 o 98.52171 2.988639 118.7009       7.167028 116.3041       8.581632 124.2271       13.03076 97.43786 3.620445 100.3955 5.345495 -2.957619      6.456155 
1 1 1 15  4  21 o 176.0739 3.929203 379.7631       16.85914 379.7661       20.98458 379.7578       28.31415 175.7472 4.904566 175.0869 6.648190 0.6602936      8.261549 
1 1 1 15  4  22 o 85.03480 3.098885 88.54763       6.410787 86.57616       9.070250 90.51560       9.062200 83.85753 4.454531 85.76955 4.349955 -1.912025      6.226151 
1 1 1 15  4  23 o 20.85840 6.372881 5.419464       3.537932 4.648610       5.079795 6.145623       4.930334 21.08801 7.656911 22.74041 7.586851 -1.652403      10.77908 
1 1 1 15  4  24 o 43.80667 4.096508 23.78895       4.322391 28.58584       6.460154 19.90094       5.816027 47.71719 5.666101 39.56011 6.239542 8.157082       8.428320 
1 1 1 15  4  25 o 62.88288 3.424049 48.67818       5.227172 42.49652       7.429720 54.73698       7.355513 58.31801 5.285308 66.43640 4.571154 -8.118389      6.987842 
1 1 1 15  4  26 f 71.17199 4.671292 63.02058       8.057029 0.000000       0.000000 63.02058       8.057029 ?        ?        71.17199 4.671292 0.000000       4.671292 
1 1 1 15  4  27 o 21.62180 7.343466 5.672617       4.618331 6.113258       5.423727 4.510572       8.807785 22.69656 7.947134 24.07683 9.721981 -1.380274      12.55682 
1 1 1 15  4  28 o 56.78959 3.719643 40.11804       5.119281 43.46156       7.348607 36.96553       7.135606 58.56027 5.203637 53.84360 5.516161 4.716671       7.583262 
1 1 1 15  4  29 o 62.99720 3.526241 49.42614       5.391785 53.49900       7.569164 45.23055       7.682366 64.95341 4.816271 59.41626 5.363524 5.537159       7.208596 
1 1 1 15  4  30 o 62.49747 4.290945 49.50053       6.495433 41.47842       10.60841 54.31175       8.215490 54.48124 8.248144 64.87547 5.241154 -10.39422      9.772491 
1 1 1 15  4  31 o 38.91792 4.787799 19.73068       4.445099 19.69968       6.209468 19.76326       6.366096 37.56248 7.042321 37.50030 7.228364 0.6218338E-01  10.09176 
1 1 1 15  4  32 o 16.30376 6.505596 2.552266       3.894967 7.956363       5.708122 -2.156260      5.328122 23.33490 8.154088 14.46468 6.639764 8.870227       10.51549 
1 1 1 15  4  33 o 19.20594 7.063343 5.062753       4.343426 4.496257       7.446901 5.354824       5.347133 20.31782 8.630136 19.94338 7.722564 0.3744354      11.58090 
1 1 1 15  4  34 o 29.33809 5.776843 12.48427       3.983024 13.41944       5.533570 11.47885       5.737664 28.57587 7.751576 25.95385 8.147332 2.622028       11.24571 
1 1 1 15  4  35 o 15.90694 6.170173 3.341341       3.417884 -1.307057      4.689983 8.606244       4.991313 13.26874 6.140349 22.33044 7.633278 -9.061699      9.796470 
1 1 1 15  4  36 o 14.98096 6.309773 2.484420       3.925647 2.670560       4.753967 2.085428       6.960144 15.72369 6.790790 16.64620 7.621628 -0.9225063     10.20804 
1 1 1 15  4  37 f 14.67188 5.981834 2.934027       3.371952 5.148702       4.753207 0.6903161      4.784265 17.28493 7.081112 13.85446 6.334180 3.430468       9.500736 
1 1 1 15  4  38 o 12.46493 5.522985 1.138842       3.327057 -2.755542      4.456049 6.044704       5.001361 11.30083 5.445220 17.31946 7.195660 -6.018631      9.023743 
1 1 1 15  4  39 o 10.70608 5.035769 -0.9736698     3.369017 -2.355845      4.666013 0.5317009      4.869519 11.42755 5.522511 12.96854 6.085516 -1.540998      8.217763 
1 1 1 15  5  0  o 188.9775 3.027978 435.4242       13.94437 420.9701       21.55127 445.8331       18.28860 185.6631 4.767280 191.1800 3.925561 -5.516953      6.175515 
1 1 1 15  5  1  o 86.66674 2.161373 91.55125       4.564764 89.28082       6.178464 94.28015       6.773607 85.52055 2.969158 87.87414 3.168358 -2.353592      4.342165 
1 1 1 15  5  2  o 81.80614 2.432322 81.65178       4.843513 81.03284       7.319639 82.13390       6.460121 81.42263 3.698657 82.00481 3.239070 -0.5821762     4.916466 
1 1 1 15  5  3  o 148.5716 2.978200 269.1555       10.78266 286.1093       20.36975 262.5555       12.70932 152.9461 5.474095 146.7155 3.554761 6.230606       6.527024 
1 1 1 15  5  4  o 122.3331 2.757000 182.4698       8.218961 180.1947       10.89656 185.4724       12.51816 121.4798 3.685122 123.2107 4.175263 -1.730949      5.568927 
1 1 1 15  5  5  o 89.49331 2.914335 97.76857       6.347265 93.33960       7.262065 112.1008       13.06367 87.40923 3.415888 95.60894 5.631947 -8.199707      6.586890 
1 1 1 15  5  6  o 200.2005 3.136685 488.8467       15.30285 483.9480       19.24957 497.2591       25.22528 199.1350 3.966772 201.6807 5.136758 -2.545746      6.490113 
1 1 1 15  5  7  o 341.2297 4.686504 1422.118       38.97014 1445.999       50.39413 1386.594       61.46404 343.8178 6.014720 336.3160 7.499589 7.501801       9.613568 
1 1 1 15  5  8  o 239.7929 3.562134 701.6378       20.81530 676.7289       25.89595 747.1132       34.98999 235.3939 4.514406 247.1426 5.809785 -11.74869      7.357545 
1 1 1 15  5  9  o 41.33375 3.026555 20.95160       3.027390 25.38834       3.525374 8.490363       5.908183 45.50668 3.199414 26.41168 8.264116 19.09500       8.861821 
1 1 1 15  5  10 o 87.51718 2.471156 93.47292       5.264954 95.94399       6.384281 88.21976       9.308493 88.63705 2.959853 84.85749 4.517738 3.779564       5.400989 
1 1 1 15  5  11 o 383.7801 5.215806 1801.591       48.77980 1795.388       62.38174 1811.355       78.25637 382.6410 6.690058 383.6499 8.370443 -1.008942      10.71547 
1 1 1 15  5  12 o 145.8540 2.756651 259.5102       9.797975 259.7704       12.17277 259.0316       16.51164 145.8805 3.424177 145.4862 4.663303 0.3943176      5.785446 
1 1 1 15  5  13 o 200.2169 3.221621 489.2846       15.71850 488.8389       19.81635 490.0408       25.81247 200.0229 4.065444 200.0064 5.300693 0.1652527E-01  6.680208 
1 1 1 15  5  14 o 60.63119 2.853598 44.95743       4.204407 39.66893       4.929373 59.07544       8.054010 56.88083 3.574298 69.32103 4.797314 -12.44020      5.982460 
1 1 1 15  5  15 o 135.5042 2.468276 223.9936       8.150471 225.8462       11.28800 221.9757       11.78079 135.9466 3.410009 134.7545 3.590728 1.192139       4.951918 
1 1 1 15  5  16 o 157.9534 2.632931 304.4461       10.13455 308.3979       14.09562 300.2171       14.58157 158.8674 3.640937 156.7240 3.817972 2.143448       5.275731 
1 1 1 15  5  17 o 94.44556 2.772647 108.9743       6.374436 104.7065       7.542331 119.6438       11.92549 92.51881 3.350868 98.68338 4.975072 -6.164566      5.998305 
1 1 1 15  5  18 o 50.74394 4.121630 31.71490       5.052857 31.71490       5.052857 0.000000       0.000000 50.74394 4.121630 ?        ?        0.000000       4.121630 
1 1 1 15  5  19 o 57.38022 3.356441 40.38083       4.672797 41.06819       7.014340 39.83240       6.265541 57.63433 5.045060 56.83003 4.562535 0.8042984      6.802158 
1 1 1 15  5  20 o 63.44606 3.286167 49.34393       5.063466 48.77861       7.639695 49.78681       6.762011 62.82673 5.031979 63.58190 4.391189 -0.7551689     6.678574 
1 1 1 15  5  21 o 42.69760 3.982635 22.52887       4.096110 24.05537       5.928148 21.13426       5.666269 43.82913 5.684094 41.00581 5.834894 2.823318       8.145852 
1 1 1 15  5  22 o 107.4426 2.991347 141.2606       7.824498 133.0938       10.87560 150.0239       11.26573 104.0491 4.298480 110.5029 4.191193 -6.453735      6.003584 
1 1 1 15  5  23 o 32.60086 4.909741 13.37586       3.779608 16.30569       5.518959 10.78804       5.186833 35.69024 6.588232 28.85138 7.355979 6.838863       9.874980 
1 1 1 15  5  24 o 40.45751 4.194856 20.34328       4.075785 23.22901       6.002409 17.87442       5.551969 42.88124 5.900356 37.41877 6.313069 5.462467       8.641125 
1 1 1 15  5  25 o 86.60903 3.659121 92.35769       7.705421 97.04641       13.82594 90.24523       9.280283 87.81641 6.506979 85.39102 4.475398 2.425385       7.897465 
1 1 1 15  5  26 o 50.68630 3.671456 31.80218       4.504132 31.69282       6.354111 31.91263       6.385615 50.18541 5.274407 50.35863 5.281975 -0.1732216     7.464491 
1 1 1 15  5  27 o 38.08679 5.209997 18.46564       4.708954 23.42446       8.278703 16.09395       5.725356 41.74174 8.429371 34.94804 6.967282 6.793701       10.93606 
1 1 1 15  5  28 o 28.21005 6.575458 10.59537       4.436428 19.32888       7.884336 6.549028       5.366633 37.39471 8.799663 22.97193 7.912991 14.42278       11.83425 
1 1 1 15  5  29 o 34.58054 7.945040 16.56380       6.554324 23.20963       8.345686 5.867462       10.58778 40.67076 8.684764 25.53943 10.52681 15.13133       13.64694 
1 1 1 15  5  30 o 16.69406 6.421120 2.770209       3.678840 6.521281       5.039394 -1.509685      5.382910 22.28216 7.668238 15.34005 6.894726 6.942107       10.31209 
1 1 1 15  5  31 o 44.95632 4.347857 26.00850       4.703858 31.83872       6.549525 19.79756       6.759987 48.97413 5.587772 37.11926 7.724952 11.85487       9.534049 
1 1 1 15  5  32 o 16.79398 6.428581 3.194855       3.675335 6.498302       5.283251 0.9701794E-01  5.116192 21.56627 7.811840 15.59220 6.881482 5.974068       10.41055 
1 1 1 15  5  33 o 14.40509 6.221653 0.8109180      3.990937 -5.279105      5.038823 11.06220       6.537456 12.20287 5.856739 25.77484 8.737198 -13.57197      10.51856 
1 1 1 15  5  34 o 17.34881 6.774805 3.978194       4.142416 5.577622       5.129098 0.9780356      7.024747 19.42276 7.551700 17.13912 7.773266 2.283640       10.83752 
1 1 1 15  5  35 o 14.21827 6.188168 1.225861       4.010141 -2.468892      7.814893 2.546475       4.672167 15.70017 7.468556 15.94184 6.805687 -0.2416687     10.10429 
1 1 1 15  5  36 o 12.39691 5.482816 0.4712186      3.264258 5.373905       4.479828 -5.078264      4.766181 18.09237 7.051015 11.25799 5.473530 6.834386       8.926161 
1 1 1 15  5  37 o 12.24111 5.416708 0.7257540      3.190008 -2.803492      4.444904 4.474223       4.580874 11.54726 5.531123 16.56731 6.885134 -5.020056      8.831670 
1 1 1 15  5  38 o 17.39258 6.406280 5.616042       3.575194 2.311116       4.702471 10.14317       5.503722 14.29956 6.434204 20.77441 7.887284 -6.474844      10.17881 
1 1 1 15  5  39 o 11.67482 5.326482 0.4897965      3.360137 -4.953780      4.481308 7.480655       5.078412 10.20279 5.031018 17.82025 7.311996 -7.617464      8.875609 
1 1 1 15  6  0  o 105.4174 2.437457 135.4651       6.261602 127.0275       9.597726 141.7177       8.262097 101.9735 3.869308 107.7607 3.149635 -5.787109      4.989163 
1 1 1 15  6  1  o 134.2203 2.626592 219.6245       8.591064 203.9272       13.16011 231.2822       11.34103 129.2129 4.184955 137.7117 3.379446 -8.498840      5.379080 
1 1 1 15  6  2  o 177.0616 2.943801 382.2699       12.70191 394.5282       16.43267 364.0744       20.02048 179.8376 3.749656 172.6298 4.763631 7.207825       6.062351 
1 1 1 15  6  3  o 258.6911 4.171742 816.6531       26.29874 803.5477       36.07635 831.5151       38.41808 256.4265 5.773293 260.8139 6.044617 -4.387390      8.358727 
1 1 1 15  6  4  o 65.15942 2.635178 51.85032       4.175673 56.23508       5.230010 44.14075       6.934963 67.83013 3.172845 59.93488 4.787977 7.895248       5.743837 
1 1 1 15  6  5  o 297.1393 3.815835 1077.346       27.63031 1036.059       37.62802 1125.657       40.70324 291.1940 5.302649 303.4914 5.503595 -12.29745      7.642489 
1 1 1 15  6  6  o 79.00443 2.339375 76.16220       4.498925 78.29022       5.386843 71.25525       8.179966 80.07885 2.764599 76.26679 4.420229 3.812057       5.213582 
1 1 1 15  6  7  o 128.3194 2.552170 200.7733       7.980642 206.0494       9.919152 191.0890       13.43861 129.9706 3.131796 125.0182 4.418024 4.952347       5.415449 
1 1 1 15  6  8  o 95.14326 2.415545 110.4437       5.596003 111.3382       6.742483 108.4637       10.03191 95.49999 2.900575 94.14098 4.384939 1.359009       5.257473 
1 1 1 15  6  9  o 294.3028 4.653882 1058.230       33.37688 976.3665       44.02979 1168.825       51.17633 282.3477 6.399210 308.8221 6.800247 -26.47443      9.337732 
1 1 1 15  6  10 o 105.2286 2.755394 135.1505       7.059597 127.6139       8.890012 148.0163       11.61536 102.1893 3.575447 109.9922 4.341989 -7.802864      5.624650 
1 1 1 15  6  11 o 308.0546 4.339616 1159.490       32.57730 1141.559       41.15355 1189.585       53.31495 305.3995 5.529717 311.3275 7.027411 -5.928009      8.942163 
1 1 1 15  6  12 o 170.5607 2.943920 354.9465       12.23604 370.1258       15.51206 329.9458       19.90767 174.1044 3.656147 164.1589 4.982221 9.945572       6.179801 
1 1 1 15  6  13 o 98.18283 2.544812 117.6658       6.083606 123.5048       7.411754 105.6091       10.65042 100.5545 3.028157 92.80309 4.724977 7.751434       5.612054 
1 1 1 15  6  14 o 103.8468 2.846826 131.6964       7.197476 137.3063       8.010991 108.2077       16.39234 106.0148 3.104213 93.50770 7.250396 12.50713       7.886976 
1 1 1 15  6  15 o 212.2651 3.297700 550.2001       17.05791 564.9050       22.21258 529.0629       26.63125 214.9283 4.241010 207.7284 5.265137 7.199921       6.760757 
1 1 1 15  6  16 o 63.56675 2.608604 49.39060       4.032280 48.19400       5.119724 51.34550       6.543886 62.72426 3.361742 64.65817 4.175461 -1.933914      5.360577 
1 1 1 15  6  17 o 80.83776 2.936086 79.89146       5.774270 78.22366       6.429639 86.84415       13.12778 79.95196 3.307197 83.76044 6.481965 -3.808479      7.276910 
1 1 1 15  6  18 o 58.29221 2.720524 41.57196       3.853893 44.68652       5.180423 37.71200       5.767116 60.35925 3.537474 55.33486 4.310838 5.024395       5.576472 
1 1 1 15  6  19 o 104.1442 2.597598 132.4097       6.592391 133.4858       8.581438 130.8600       10.29753 104.4428 3.376110 103.3037 4.098677 1.139023       5.310110 
1 1 1 15  6  20 o 129.9409 2.735636 206.2257       8.662440 208.2127       11.24487 203.3254       13.58546 130.4120 3.541627 128.7183 4.337293 1.693695       5.599574 
1 1 1 15  6  21 o 64.62699 3.229185 51.20837       5.069499 50.58922       7.767077 51.66788       6.691308 63.95220 5.024176 64.76861 4.263162 -0.8164063     6.589150 
1 1 1 15  6  22 o 78.46372 3.533788 75.54494       6.739530 73.88682       12.20366 76.27256       8.084119 76.93487 6.572123 78.72255 4.229557 -1.787682      7.815494 
1 1 1 15  6  23 o 71.00995 3.075914 61.83148       5.310044 70.98393       7.746864 53.72056       7.292764 75.89257 4.205250 65.91791 4.568226 9.974663       6.209092 
1 1 1 15  6  24 o 72.16772 3.665740 64.10026       6.425632 68.05138       11.84002 62.45070       7.650255 73.53474 6.680125 71.06443 4.439792 2.470306       8.020962 
1 1 1 15  6  25 o 93.35351 3.039266 106.9664       6.904882 113.8863       10.01873 100.7058       9.529582 95.98446 4.294144 90.23198 4.346668 5.752480       6.110090 
1 1 1 15  6  26 o 42.44435 4.131474 22.46616       4.219261 17.37221       6.145435 27.00846       5.803140 36.40905 7.181639 46.27572 5.238040 -9.866665      8.888926 
1 1 1 15  6  27 o 47.24774 4.494433 28.01362       5.112530 24.00375       8.931032 29.96810       6.235228 41.95144 9.005448 48.59623 5.353793 -6.644791      10.47670 
1 1 1 15  6  28 o 31.15092 5.994404 12.74386       4.385278 12.00496       7.435008 13.13803       5.430426 29.56606 9.273493 31.20342 7.276060 -1.637367      11.78723 
1 1 1 15  6  29 o 13.71235 5.878382 0.1690667      3.512239 2.161217       4.935644 -1.874618      4.999074 17.71408 7.231464 14.64019 6.606580 3.073891       9.794947 
1 1 1 15  6  30 o 65.68958 4.153594 54.67596       6.614960 57.10395       7.791757 48.40934       12.51784 66.69556 4.826703 57.74916 9.203705 8.946404       10.39256 
1 1 1 15  6  31 o 12.34168 5.483141 -0.6776983     3.301300 1.946035       4.521233 -3.674143      4.831702 16.59202 6.862807 13.01240 6.091880 3.579621       9.176553 
1 1 1 15  6  32 o 17.85826 6.343315 4.157207       3.464947 6.143165       5.034818 2.370341       4.775785 21.01749 7.624138 16.97388 7.040009 4.043613       10.37734 
1 1 1 15  6  33 o 20.42118 6.799779 6.157337       3.960800 4.579780       4.984462 8.860057       6.524186 18.83021 7.408235 23.37982 8.646523 -4.549618      11.38614 
1 1 1 15  6  34 o 12.40155 5.604792 -0.6093964     3.613798 -2.303468      4.464967 2.607957       6.153212 12.55872 5.871889 17.39800 7.616804 -4.839275      9.617420 
1 1 1 15  6  35 o 23.06384 6.312228 8.393643       3.650354 9.844598       5.059625 6.818530       5.271661 23.63907 7.676070 20.07350 7.695303 3.565578       10.86921 
1 1 1 15  6  36 o 17.03026 6.766623 4.489127       4.196287 7.278684       7.925834 3.402624       4.946440 19.53626 8.595820 16.29000 6.979598 3.246267       11.07262 
1 1 1 15  6  37 o 17.45082 6.250096 5.212874       3.370693 5.964611       4.568899 4.315085       4.993050 17.94189 7.082238 16.42126 7.023587 1.520622       9.974411 
1 1 1 15  6  38 o 10.60301 4.963295 -1.036504      3.205651 1.722151       4.350330 -4.314096      4.741885 13.64286 6.159168 10.92313 5.343142 2.719739       8.153804 
1 1 1 15  6  39 o 17.87710 6.346886 6.313810       3.468467 6.082153       4.763188 6.575301       5.060618 16.66314 6.980011 16.95618 7.154104 -0.2930431     9.995087 
1 1 1 15  7  0  o 299.3347 5.357579 1094.277       39.08065 1030.401       64.39810 1131.515       49.16991 289.6872 9.133783 304.1977 6.632959 -14.51053      11.28814 
1 1 1 15  7  1  o 169.5602 4.393209 351.1152       18.13744 362.0569       24.98981 338.9353       26.36590 172.0186 5.970495 166.3608 6.516227 5.657761       8.837874 
1 1 1 15  7  2  o 200.5690 3.482242 490.6808       17.01997 467.9654       22.69157 519.8964       25.73428 195.7807 4.756184 206.3255 5.118269 -10.54480      6.986985 
1 1 1 15  7  3  o 202.3859 3.142225 499.5343       15.49722 524.1714       24.30697 482.6608       20.11584 207.1887 4.814250 198.8705 4.150800 8.318237       6.356583 
1 1 1 15  7  4  o 315.7744 4.375328 1217.236       33.66848 1203.078       52.04683 1227.424       44.15047 313.5143 6.812411 316.8830 5.717422 -3.368683      8.893698 
1 1 1 15  7  5  o 140.7203 2.383060 241.4207       8.171988 252.9054       11.26058 228.6421       11.87800 143.9941 3.209074 136.8495 3.564789 7.144638       4.796444 
1 1 1 15  7  6  o 141.6933 2.620061 244.8107       9.046842 246.3921       11.19112 241.8283       15.36903 142.1225 3.231281 140.6545 4.489659 1.468018       5.531565 
1 1 1 15  7  7  o 115.0099 2.447849 161.2784       6.860506 154.3609       8.211449 177.2687       12.48454 112.4572 2.999055 120.4175 4.261199 -7.960388      5.210773 
1 1 1 15  7  8  o 349.6326 4.799247 1493.662       40.89037 1498.711       52.31508 1485.733       65.55483 349.9113 6.135258 347.9242 7.731861 1.987152       9.870313 
1 1 1 15  7  9  o 188.6587 3.371620 434.3121       15.50071 426.0328       17.39657 466.2078       34.14539 186.8126 3.821389 194.8206 7.204600 -8.008011      8.155321 
1 1 1 15  7  10 o 34.26263 3.357697 14.46320       2.767529 14.52267       2.893587 13.82494       9.479623 34.31612 3.509582 33.53337 10.46436 0.7827492      11.03721 
1 1 1 15  7  11 o 198.8003 3.508629 482.4516       16.99771 491.1216       19.41881 454.0404       35.15264 200.5255 3.973899 192.0685 7.525010 8.457092       8.509855 
1 1 1 15  7  12 o 125.8252 2.845151 193.1599       8.723865 197.7791       9.754316 174.6970       19.50125 127.3021 3.144309 119.1102 6.746156 8.191879       7.442936 
1 1 1 15  7  13 o 145.7081 3.011611 259.1044       10.69347 249.2154       11.74582 306.9918       25.84742 142.8711 3.373673 157.9543 6.730484 -15.08321      7.528684 
1 1 1 15  7  14 o 172.0336 2.963783 361.2139       12.42498 354.9337       15.27178 373.5103       21.36943 170.4543 3.676593 174.5904 5.027927 -4.136078      6.228755 
1 1 1 15  7  15 o 73.06971 2.651611 65.23559       4.713706 68.15657       5.510615 57.27013       9.099993 74.65839 3.035231 68.12243 5.529188 6.535965       6.307500 
1 1 1 15  7  16 o 123.2719 2.927879 185.5143       8.795354 187.2522       9.870732 178.8168       19.37740 123.7748 3.275389 120.3682 6.631766 3.406601       7.396519 
1 1 1 15  7  17 o 93.44338 2.438873 106.6181       5.548843 100.2346       7.088948 116.7163       8.916071 90.52791 3.218509 97.63275 3.754499 -7.104843      4.945207 
1 1 1 15  7  18 o 120.0653 2.590158 175.9643       7.578442 174.2809       9.771697 178.5050       12.00477 119.3690 3.362600 120.6988 4.087348 -1.329819      5.292778 
1 1 1 15  7  19 o 90.63176 2.546899 100.3561       5.619496 96.73717       7.275834 105.7067       8.846869 88.89081 3.364919 92.84940 3.918790 -3.958588      5.165230 
1 1 1 15  7  20 o 76.20387 2.656759 71.00740       4.926069 63.06460       6.369907 82.82509       7.769846 71.69153 3.658199 82.14973 3.892307 -10.45821      5.341579 
1 1 1 15  7  21 o 39.10353 3.585458 18.87494       3.378628 20.56679       4.613639 16.91835       4.961506 40.64575 4.747215 36.61380 5.750023 4.031952       7.456461 
1 1 1 15  7  22 o 62.51982 2.878344 47.89264       4.373505 49.16262       5.812986 46.23600       6.639168 63.21733 3.790762 61.18148 4.484197 2.035854       5.871789 
1 1 1 15  7  23 o 174.4122 4.001253 373.6053       17.00626 380.6970       30.25978 370.3312       20.56053 174.4268 7.134013 173.2484 4.874848 1.178436       8.640502 
1 1 1 15  7  24 o 74.13333 3.630166 67.64086       6.538130 63.68584       12.11524 69.26599       7.766088 70.92585 7.105138 74.87714 4.273901 -3.951286      8.291514 
1 1 1 15  7  25 o 67.24586 3.614953 55.77074       5.902080 48.75135       9.787745 59.78149       7.398539 61.98344 6.580363 69.43236 4.395240 -7.448917      7.913237 
1 1 1 15  7  26 o 106.3488 3.061262 139.0706       7.925328 135.7645       11.21471 142.3689       11.20151 104.5662 4.411000 107.1334 4.299310 -2.567108      6.159626 
1 1 1 15  7  27 o 13.14292 5.687051 -0.2381082     3.346860 -1.706095      4.896708 1.048935       4.585003 14.77370 6.613030 16.45347 6.867012 -1.679773      9.533521 
1 1 1 15  7  28 o 22.04486 6.288332 6.418361       3.543442 1.060754       5.059034 11.57796       4.964667 17.02982 7.167274 29.29161 7.042316 -12.26179      10.04809 
1 1 1 15  7  29 o 76.64434 3.314799 73.07933       6.176542 58.70754       8.438859 89.66134       9.064565 67.68919 5.154739 84.24326 4.431038 -16.55407      6.797458 
1 1 1 15  7  30 o 13.21851 5.676057 0.2087192      3.284734 4.539661       4.797762 -3.612396      4.506534 19.73242 7.391934 12.61030 5.897034 7.122119       9.455987 
1 1 1 15  7  31 o 14.16698 5.924081 1.050514       3.422046 7.560464       4.954883 -4.886504      4.731826 23.04984 7.602921 12.19514 5.804137 10.85470       9.565166 
1 1 1 15  7  32 o 25.11611 7.455199 9.504059       4.892730 9.504059       4.892730 0.000000       0.000000 25.11611 7.455199 ?        ?        0.000000       7.455199 
1 1 1 15  7  33 o 12.03508 5.350569 -0.3270156     3.149004 3.379552       4.581598 -3.645821      4.335327 17.29263 7.001288 11.82157 5.605923 5.471055       8.969080 
1 1 1 15  7  34 o 22.49211 6.143840 7.706839       3.462068 9.474127       4.871420 5.903272       4.921166 23.82503 7.511022 19.54593 7.449334 4.279093       10.57866 
1 1 1 15  7  35 o 14.72356 5.935044 2.552161       3.276313 7.489968       4.480057 -3.124751      4.803663 20.97162 7.229641 12.32815 5.861916 8.643472       9.307511 
1 1 1 15  7  36 o 10.90680 5.035382 -1.019533      3.126704 -1.183128      4.185021 -0.8128480     4.703993 12.29717 5.728097 13.11087 6.095545 -0.8136959     8.364614 
1 1 1 15  7  37 o 10.27315 5.011985 -4.471991      4.093141 -0.8660743     9.072390 -5.393558      4.586457 15.43401 7.514673 10.56923 5.187513 4.864782       9.131298 
1 1 1 15  7  38 o 9.630605 4.595959 -2.069266      3.008445 -6.719660      3.907462 4.700231       4.714418 8.999143 4.482144 15.97684 6.828931 -6.977693      8.168470 
1 1 1 15  7  39 o 12.61735 5.584262 1.707603       3.391992 -3.308156      4.814020 6.653058       4.780163 11.08973 5.415823 17.09322 7.062058 -6.003491      8.899652 
1 1 1 15  8  0  o 48.91032 3.067540 29.28594       3.637762 31.55766       5.215415 27.13360       5.076540 50.67418 4.262926 46.93584 4.493202 3.738338       6.193658 
1 1 1 15  8  1  o 283.9686 5.243807 984.9529       36.28717 978.2719       44.27621 998.6210       63.32969 282.8299 6.424052 285.0792 9.127795 -2.249329      11.16177 
1 1 1 15  8  2  o 265.3235 4.876092 859.6494       31.52708 828.9943       52.33670 877.1088       39.49762 259.8800 8.274679 267.8441 6.051357 -7.964050      10.25130 
1 1 1 15  8  3  o 147.3716 2.892765 264.8434       10.38874 265.6659       14.16008 263.8846       15.28852 147.4960 3.943113 146.9717 4.273237 0.5242615      5.814524 
1 1 1 15  8  4  o 129.1456 2.476197 203.3474       7.792935 204.9667       9.782351 200.5349       12.89230 129.6358 3.096578 128.1110 4.135014 1.524811       5.165959 
1 1 1 15  8  5  o 131.6875 2.493883 211.4396       8.003071 202.9775       9.817824 228.1983       13.81651 129.0009 3.123104 136.6629 4.153519 -7.661972      5.196681 
1 1 1 15  8  6  o 62.28329 2.569253 47.38160       3.891179 46.83443       4.172473 51.03415       10.78024 61.90947 2.772706 64.16560 7.008101 -2.256138      7.536669 
1 1 1 15  8  7  o 66.83820 2.557131 54.55428       4.157306 53.88181       4.463727 58.95397       11.41748 66.41174 2.764186 69.02795 6.878973 -2.616219      7.413568 
1 1 1 15  8  8  o 289.0899 5.324341 1021.950       37.50895 1014.733       45.32373 1037.638       66.81921 287.8236 6.461945 290.0311 9.466793 -2.207550      11.46198 
1 1 1 15  8  9  o 161.6064 3.240328 318.6719       12.76097 311.2370       17.12549 327.9537       19.13469 159.5528 4.408786 163.7338 4.800828 -4.181000      6.518078 
1 1 1 15  8  10 o 304.6642 4.842786 1134.871       35.95447 1116.258       49.56339 1155.545       52.23645 301.6689 6.742088 306.8566 6.985572 -5.187775      9.708448 
1 1 1 15  8  11 o 18.57981 5.897549 4.150978       2.998718 2.767638       3.513123 7.864544       5.756050 17.10464 6.341393 25.55769 8.177385 -8.453047      10.34809 
1 1 1 15  8  12 o 44.66044 3.587338 24.51151       3.871382 26.87843       4.708973 19.57549       6.800228 46.71349 4.180797 39.27831 7.375289 7.435177       8.477851 
1 1 1 15  8  13 o 55.83997 3.249324 38.19407       4.402445 36.27944       5.337386 42.26916       7.786726 54.33432 4.060413 58.47879 5.529802 -4.144474      6.860442 
1 1 1 15  8  14 o 80.02002 3.018439 78.27129       5.875406 88.45022       7.563701 62.78459       9.329598 85.01020 3.659701 71.37590 5.403984 13.63430       6.526596 
1 1 1 15  8  15 o 91.29549 3.027036 101.8669       6.725153 109.8063       8.694421 90.04160       10.61095 94.71214 3.774588 85.57451 5.111607 9.137634       6.354215 
1 1 1 15  8  16 o 43.05597 4.261846 22.90230       4.413038 25.23540       5.103781 15.99034       8.784674 45.15216 4.707560 35.30803 9.842495 9.844128       10.91035 
1 1 1 15  8  17 o 25.02525 5.139793 7.960000       3.029457 8.253401       3.228812 5.801712       8.757233 25.46177 5.372907 25.86949 9.917999 -0.4077187     11.27984 
1 1 1 15  8  18 o 150.8190 3.129792 277.9072       11.50290 273.2409       12.80763 297.3730       26.15886 149.4943 3.515672 155.0394 6.941338 -5.545181      7.780881 
1 1 1 15  8  19 o 77.20928 2.778687 72.90135       5.219591 72.93585       7.543329 72.86966       7.229878 77.07255 4.030314 77.06151 3.862282 0.1103973E-01  5.582173 
1 1 1 15  8  20 o 101.8466 2.553631 126.7518       6.332836 124.2059       8.190489 130.5364       9.986029 100.7141 3.341835 103.1460 3.980339 -2.431892      5.197207 
1 1 1 15  8  21 o 78.28129 2.611129 74.94386       4.974097 77.60311       6.607770 71.46652       7.556093 79.55578 3.416335 76.23518 4.082181 3.320595       5.323114 
1 1 1 15  8  22 o 80.35001 3.085031 79.11393       6.029398 80.52968       9.238523 78.06350       7.957805 80.76328 4.714602 79.63786 4.114457 1.125420       6.257493 
1 1 1 15  8  23 o 96.72593 3.289647 114.7711       7.742759 100.7107       12.35895 123.8550       9.933880 89.99463 5.664185 100.3075 4.072426 -10.31289      6.976220 
1 1 1 15  8  24 o 68.25669 3.385388 57.31044       5.613483 63.63755       9.468806 53.88163       6.970496 71.40380 5.483710 65.97015 4.360362 5.433655       7.005985 
1 1 1 15  8  25 o 57.33553 3.842063 40.67928       5.337163 38.73963       9.815135 41.49358       6.359557 54.76452 7.555754 57.73097 4.557392 -2.966450      8.823789 
1 1 1 15  8  26 o 15.40911 6.276660 1.315318       3.708444 8.225076       7.818196 -0.6906685     4.212492 26.38314 9.510129 14.40047 6.303400 11.98267       11.40944 
1 1 1 15  8  27 o 24.09748 5.792255 7.633151       3.359150 5.485435       4.705561 9.865023       4.796865 21.33681 7.406713 27.15641 7.151165 -5.819601      10.29556 
1 1 1 15  8  28 o 69.88878 3.160632 60.50991       5.368985 58.35044       7.425546 62.87563       7.772085 68.05478 4.502798 70.63576 4.539226 -2.580978      6.393728 
1 1 1 15  8  29 o 39.84693 4.116302 20.14185       3.939566 21.48903       5.619596 18.83993       5.524398 40.38454 5.883018 37.59198 6.249863 2.792557       8.583164 
1 1 1 15  8  30 o 14.63449 6.053212 1.241677       3.517493 0.4795330      4.518605 2.413805       5.603683 15.40991 6.637663 18.36729 7.622579 -2.957382      10.10754 
1 1 1 15  8  31 o 32.11593 4.918950 13.70124       3.727311 16.13673       5.288060 11.29655       5.254526 33.83914 6.649954 27.66933 7.573472 6.169811       10.07866 
1 1 1 15  8  32 o 11.66198 5.226363 -0.7330778     3.068307 -2.772212      4.130888 1.776482       4.582678 12.12304 5.661543 16.10009 6.801172 -3.977050      8.849237 
1 1 1 15  8  33 o 19.97898 6.740580 5.965935       3.890815 6.353003       4.491752 4.802713       7.786697 20.46126 7.226649 20.13254 8.692923 0.3287201      11.30448 
1 1 1 15  8  34 o 22.51945 6.028269 7.713493       3.373578 7.993709       4.620150 7.393452       4.937573 21.96798 7.344621 21.10644 7.563951 0.8615456      10.54309 
1 1 1 15  8  35 o 12.43118 5.409514 0.6886182      3.063415 -1.506856      4.136342 3.355799       4.559093 12.26594 5.707194 16.35371 6.838102 -4.087769      8.906835 
1 1 1 15  8  36 o 10.48393 4.859900 -1.160536      2.956675 -3.071254      3.854087 1.572318       4.609261 10.75229 5.150359 14.47853 6.452848 -3.726233      8.256237 
1 1 1 15  8  37 o 13.64044 5.863493 2.092217       3.512314 8.307791       5.391080 -2.491729      4.629722 19.58171 7.704303 11.74803 5.631979 7.833679       9.543347 
1 1 1 15  8  38 o 11.29858 5.406531 -1.910671      4.223518 -15.55109      8.359157 2.765181       4.894170 11.38579 5.779666 14.49443 6.539208 -3.108644      8.727302 
1 1 1 15  8  39 o 10.65586 4.988054 -0.6397254     3.237768 2.970918       4.325368 -5.241282      4.882960 14.03372 6.253020 10.46116 5.175581 3.572558       8.117074 
1 1 1 15  9  0  o 116.5410 2.908144 165.6153       8.259062 156.0690       11.35485 176.3394       12.03496 113.0127 4.129989 120.1380 4.116898 -7.125336      5.831437 
1 1 1 15  9  1  o 202.1247 3.587482 498.3980       17.67036 471.5055       24.51609 527.4737       25.49178 196.4046 5.126664 207.8140 5.033724 -11.40936      7.184780 
1 1 1 15  9  2  o 252.1935 4.110109 776.2438       25.25942 756.1012       48.22523 783.8591       29.65231 248.2015 7.983607 253.3505 4.802868 -5.148987      9.316948 
1 1 1 15  9  3  o 135.3632 2.552592 223.4079       8.420115 238.9543       12.81200 211.5877       11.17154 139.8885 3.761778 131.6495 3.485295 8.238983       5.128183 
1 1 1 15  9  4  o 162.5019 2.535637 321.9753       10.04111 333.5712       13.95221 309.5165       14.46204 165.3529 3.462542 159.2632 3.726303 6.089737       5.086701 
1 1 1 15  9  5  o 147.3005 2.430708 264.5467       8.725155 269.2570       11.92428 259.1184       12.80076 148.5650 3.293666 145.7236 3.604707 2.841400       4.882842 
1 1 1 15  9  6  o 177.8808 3.358799 386.0496       14.55960 368.4441       19.38000 408.8612       22.06013 173.6176 4.584628 182.8512 4.955354 -9.233505      6.750877 
1 1 1 15  9  7  o 149.6821 3.116931 273.3203       11.36929 259.9146       14.94611 291.7300       17.51489 145.8322 4.210113 154.4561 4.658683 -8.623901      6.279202 
1 1 1 15  9  8  o 131.3960 2.578523 210.5498       8.256374 211.4248       10.04238 208.7249       14.50354 131.6412 3.130464 130.6233 4.563361 1.017868       5.533901 
1 1 1 15  9  9  o 148.4549 2.705215 268.8130       9.786615 268.2319       11.93573 270.0055       17.09615 148.2562 3.303695 148.5495 4.728730 -0.2933197     5.768474 
1 1 1 15  9  10 o 135.0689 2.630562 222.5242       8.658448 222.7505       10.47554 222.0362       15.38244 135.1044 3.181784 134.6841 4.693935 0.4203339      5.670695 
1 1 1 15  9  11 o 192.7440 3.106812 453.3712       14.59258 452.3204       18.08236 455.3333       24.71046 192.4385 3.855911 192.8054 5.264197 -0.3668671     6.525321 
1 1 1 15  9  12 o 87.53976 2.405199 93.53835       5.126025 95.59799       5.988488 87.89259       9.914764 88.47276 2.781066 84.62132 4.828058 3.851440       5.571756 
1 1 1 15  9  13 o 99.11461 2.451325 119.8336       5.920722 119.9120       6.904738 119.6159       11.50759 99.08529 2.862578 98.75008 4.796359 0.3352051      5.585644 
1 1 1 15  9  14 o 151.8279 2.792036 281.3223       10.33020 294.7924       12.76687 255.7815       17.57987 155.3633 3.372097 144.4316 5.002343 10.93169       6.032783 
1 1 1 15  9  15 o 136.8189 2.701184 228.4570       9.006092 228.5323       10.79079 228.2841       16.34965 136.7930 3.237079 136.4223 4.926071 0.3707275      5.894476 
1 1 1 15  9  16 o 98.86971 2.667003 119.3958       6.419868 114.6676       6.946803 147.0633       16.80433 96.86458 2.946382 109.1563 6.344716 -12.29176      6.995469 
1 1 1 15  9  17 f 106.9956 2.751038 139.8571       7.167013 138.0291       7.867382 148.7748       17.37648 106.2624 3.041316 109.7003 6.529610 -3.437958      7.203153 
1 1 1 15  9  18 o 86.00824 2.768658 90.42567       5.795345 89.35696       6.329976 95.96259       14.40812 85.46904 3.044046 87.91504 6.777532 -2.445999      7.429748 
1 1 1 15  9  19 o 97.27728 2.737061 115.6683       6.481865 114.6372       9.246724 116.6644       9.088800 96.67850 3.933050 97.54726 3.830899 -0.8687592     5.490416 
1 1 1 15  9  20 o 87.30239 2.915475 93.25277       6.193868 92.15479       6.783297 98.75970       15.19138 86.74753 3.214396 88.97096 7.064650 -2.223434      7.761548 
1 1 1 15  9  21 o 24.20519 8.064301 6.975248       5.570761 1.489067       7.010035 16.37784       9.177173 20.50237 8.518581 35.46403 10.12115 -14.96166      13.22890 
1 1 1 15  9  22 o 96.13420 2.829382 113.1287       6.621141 105.6283       9.160444 121.3338       9.581133 92.65959 4.066766 99.34442 3.965618 -6.684830      5.680203 
1 1 1 15  9  23 o 23.22582 4.962085 6.909667       2.723192 3.919561       3.699641 10.44530       4.022997 18.74127 6.563488 28.48651 5.985816 -9.745235      8.883094 
1 1 1 15  9  24 o 10.36326 4.737116 -1.762145      2.674176 -8.008693      3.815614 4.268134       3.748980 9.480463 4.668581 19.22734 6.614095 -9.746880      8.095796 
1 1 1 15  9  25 o 74.73724 2.899586 68.62473       5.270895 70.14438       7.237702 66.90863       7.691304 75.29531 3.958448 73.42728 4.317449 1.868034       5.857446 
1 1 1 15  9  26 o 61.72293 3.103704 46.98850       4.653364 48.25315       6.388948 45.55961       6.791154 62.22832 4.238431 60.32005 4.656054 1.908272       6.296280 
1 1 1 15  9  27 o 70.03193 3.709452 60.94847       6.307979 65.93903       11.69481 58.90082       7.491121 71.25164 6.818471 68.52294 4.511254 2.728699       8.175755 
1 1 1 15  9  28 o 17.78362 6.174921 3.785421       3.270672 5.090339       4.123804 1.572665       5.369986 20.23794 6.937717 17.78070 7.427087 2.457233       10.16334 
1 1 1 15  9  29 o 38.49312 4.490294 18.99427       4.133040 18.57233       5.034465 19.86645       7.238234 37.51979 5.684081 37.42682 8.166323 0.9296799E-01  9.949754 
1 1 1 15  9  30 o 44.82797 3.707134 25.47189       4.013531 24.79473       5.585966 26.19453       5.770514 43.30667 5.410802 44.51250 5.432210 -1.205826      7.667182 
1 1 1 15  9  31 o 29.36833 5.057355 11.59453       3.488837 10.96934       4.734928 12.33713       5.160404 27.43912 7.045363 28.96225 7.311788 -1.523129      10.15379 
1 1 1 15  9  32 o 26.05791 5.477908 9.505309       3.367889 14.59457       4.710677 4.183879       4.816928 31.85244 6.292100 18.48896 7.280019 13.36348       9.622329 
1 1 1 15  9  33 o 36.81601 4.335836 18.22071       3.815457 19.81628       5.261906 16.45164       5.540620 36.87798 6.065893 32.44931 7.195482 4.428669       9.411164 
1 1 1 15  9  34 o 13.42245 5.874007 0.7127832      3.656353 2.113367       4.156350 -4.080542      7.689108 15.21996 6.455394 15.12025 7.251115 0.9971046E-01  9.708284 
1 1 1 15  9  35 o 30.95803 4.963117 13.83328       3.617774 17.01888       5.024507 10.40375       5.213324 32.61617 6.549281 23.72014 7.797469 8.896030       10.18301 
1 1 1 15  9  36 o 21.30724 7.167942 8.460817       4.399899 8.071081       5.733708 9.019028       6.861978 19.90235 7.909045 20.21682 8.416363 -0.3144741     11.54938 
1 1 1 15  9  37 o 15.87765 6.110069 4.256351       3.332188 5.103605       4.522568 3.250221       4.928392 16.68966 6.879638 15.22002 6.733914 1.469637       9.626786 
1 1 1 15  9  38 o 9.193355 4.443423 -2.805847      3.023290 -4.627665      3.867404 0.5701549E-01  4.848052 9.632457 4.734905 12.80999 6.030181 -3.177534      7.666969 
1 1 1 15  10 0  o 200.7286 4.173888 491.7705       20.41673 495.4343       25.05328 484.5264       35.22822 201.3254 5.110710 198.7685 7.285215 2.556854       8.899086 
1 1 1 15  10 1  o 105.6812 2.709784 136.2721       6.972844 139.3081       12.84973 135.0050       8.301380 106.6804 4.956351 105.1565 3.243377 1.523827       5.923252 
1 1 1 15  10 2  o 140.2011 3.325541 239.7780       11.36187 244.5972       18.82961 237.0187       14.24802 141.3588 5.476519 139.2812 4.202648 2.077591       6.903224 
1 1 1 15  10 3  o 117.5396 2.471020 168.4459       7.077770 173.8251       8.684805 157.8079       12.21322 119.3461 2.988528 113.5998 4.420242 5.746292       5.335714 
1 1 1 15  10 4  o 25.47061 3.437494 8.058174       2.079206 6.690255       2.459895 11.48045       3.890844 23.00596 4.548982 30.18066 5.492566 -7.174698      7.131726 
1 1 1 15  10 5  o 28.14178 3.802031 9.840769       2.540736 5.003434       3.191200 18.21608       4.199053 20.12769 6.032107 38.34742 4.584147 -18.21972      7.576326 
1 1 1 15  10 6  o 239.6116 3.243396 700.4647       18.93842 693.9216       26.09670 707.7443       27.52640 238.3476 4.493025 240.6825 4.693197 -2.334885      6.497182 
1 1 1 15  10 7  o 100.5844 2.421028 123.3679       5.934259 123.0878       7.042443 124.0536       11.02051 100.4129 2.881024 100.6684 4.503744 -0.2554626     5.346402 
1 1 1 15  10 8  o 127.0826 2.568070 196.9614       7.952961 204.1962       9.727392 182.3754       13.81180 129.3689 3.085534 122.0697 4.651592 7.299202       5.581920 
1 1 1 15  10 9  o 86.57549 2.369389 91.47153       4.994119 89.91091       5.760556 96.19370       10.02043 85.80882 2.758424 88.58731 4.658085 -2.778496      5.413563 
1 1 1 15  10 10 o 64.55411 2.401490 50.89240       3.771230 51.57964       4.233403 48.25044       8.300420 64.97096 2.679583 62.53934 5.502462 2.431622       6.120233 
1 1 1 15  10 11 o 29.18801 2.993846 10.50522       2.099314 8.706855       2.205431 27.85538       6.850238 26.47499 3.504366 47.28143 6.086395 -20.80644      7.023161 
1 1 1 15  10 12 o 30.72167 2.921902 11.62166       2.161186 13.20249       2.306663 0.2616103      6.183454 32.76237 2.919726 18.60879 7.882420 14.15359       8.405791 
1 1 1 15  10 13 o 77.14111 2.389676 72.65827       4.486803 76.53727       5.129249 60.01791       9.259211 79.15591 2.662889 69.76355 5.490620 9.392365       6.102285 
1 1 1 15  10 14 o 118.1742 2.530454 170.3913       7.287141 171.9455       8.550331 166.2659       13.93038 118.6822 2.956387 116.4105 4.921705 2.271690       5.741376 
1 1 1 15  10 15 o 67.67726 2.372337 55.94838       3.906457 54.89902       4.310853 60.76736       9.238007 67.01812 2.644773 70.17410 5.444702 -3.155975      6.053066 
1 1 1 15  10 16 o 69.93346 2.536629 59.76400       4.315768 60.11307       4.640024 57.52508       11.75120 70.12241 2.720520 67.90615 7.211421 2.216263       7.707517 
1 1 1 15  10 17 o 72.26325 2.519348 63.81454       4.429726 61.09433       4.711070 84.57021       13.01326 70.68506 2.740181 82.58474 6.519048 -11.89968      7.071533 
1 1 1 15  10 18 o 147.1417 3.003156 264.5213       10.76837 260.7728       11.90629 281.3676       25.24062 146.0476 3.345382 150.7330 6.889780 -4.685425      7.659024 
1 1 1 15  10 19 o 38.92763 3.520303 18.69083       3.303388 17.36012       3.494610 29.86163       10.12508 37.45265 3.885335 48.13703 8.961116 -10.68438      9.767160 
1 1 1 15  10 20 o 37.28540 3.648385 17.18310       3.272561 16.35185       5.960324 17.54183       3.915555 35.69871 7.101402 37.56406 4.358242 -1.865349      8.332117 
1 1 1 15  10 21 o 64.94035 2.753206 51.64398       4.347133 47.34202       6.011593 56.35910       6.293651 61.99411 4.000626 67.69144 3.830973 -5.697338      5.539076 
1 1 1 15  10 22 o 47.70360 2.993361 27.95970       3.462196 34.42168       4.974942 21.89083       4.821242 52.81118 3.893046 41.87927 4.811452 10.93191       6.189175 
1 1 1 15  10 23 o 61.92402 3.084461 47.09963       4.639865 44.58286       4.973788 63.97760       12.88029 60.18929 3.404918 70.90929 7.570940 -10.72000      8.301362 
1 1 1 15  10 24 o 52.72366 2.796117 34.15392       3.579656 36.43496       4.612638 30.69995       5.675988 54.33533 3.502275 49.57904 4.756202 4.756287       5.906554 
1 1 1 15  10 25 o 50.79399 3.067935 31.81036       3.779769 29.30538       5.062400 34.96590       5.681871 48.45801 4.332677 52.93236 4.445927 -4.474354      6.207927 
1 1 1 15  10 26 o 40.21290 3.514009 20.11457       3.408973 21.71106       4.564266 18.10045       5.126619 41.50202 4.589597 37.46915 5.802016 4.032871       7.397823 
1 1 1 15  10 27 o 40.43774 3.762117 20.47038       3.664754 25.82351       4.741268 12.52551       5.776093 45.26698 4.351654 30.28132 7.784828 14.98566       8.918545 
1 1 1 15  10 28 o 66.17278 2.955008 54.24826       4.753104 54.82442       6.343740 53.51081       7.176908 66.09588 3.956649 64.98814 4.560718 1.107742       6.037816 
1 1 1 15  10 29 o 21.64119 6.699586 6.337404       3.894230 13.12669       7.448170 3.783220       4.568395 29.76761 9.273499 18.74035 7.168786 11.02726       11.72132 
1 1 1 15  10 30 o 28.23473 4.819015 10.54779       3.196814 9.692386       4.166901 11.77156       4.983986 26.26627 6.536245 28.66611 7.157047 -2.399847      9.692565 
1 1 1 15  10 31 f 23.41650 5.845411 7.704165       3.325000 6.925178       4.735661 8.461557       4.669556 21.90399 7.436202 23.91347 7.324392 -2.009476      10.43762 
1 1 1 15  10 32 o 16.34535 5.882211 3.485043       2.989542 2.817008       4.076686 4.262244       4.397182 16.38877 6.615397 18.18738 7.013650 -1.798611      9.641306 
1 1 1 15  10 33 f 28.87302 5.158957 11.77540       3.496639 10.54649       4.699046 13.30009       5.234100 25.58431 7.222603 28.63894 7.435223 -3.054636      10.36574 
1 1 1 15  10 34 o 26.68534 5.651394 10.59453       3.560512 13.05874       4.738630 7.399444       5.395779 28.43485 6.907788 20.74127 7.824272 7.693584       10.43728 
1 1 1 15  10 35 o 23.80727 6.443348 9.314433       3.828569 14.79000       5.510977 4.206507       5.322754 28.56730 7.730021 17.17795 7.296330 11.38935       10.62966 
1 1 1 15  10 36 o 29.48962 6.013823 14.09250       4.175064 12.53067       4.722159 19.68549       8.936040 26.10328 7.193445 26.07835 10.01349 0.2493286E-01  12.32946 
1 1 1 15  10 37 o 10.03261 4.737826 -1.594254      3.036253 -0.8248113     4.049022 -2.582772      4.589385 11.83446 5.552022 11.52687 5.547010 0.3075914      7.848202 
1 1 1 15  10 38 o 10.83184 4.980702 -0.1511238     3.015873 2.529502       3.961684 -3.845616      4.650922 13.76696 6.066535 10.82729 5.295283 2.939668       8.052506 
1 1 1 15  11 0  o 177.4115 3.280029 383.9301       14.18063 394.5113       27.69556 380.1705       16.50879 179.4563 6.343058 176.5046 3.838162 2.951767       7.413898 
1 1 1 15  11 1  o 251.7259 4.121685 773.4718       25.28360 770.1810       49.21432 774.6518       29.47001 250.4236 8.075108 251.8369 4.802031 -1.413315      9.395044 
1 1 1 15  11 2  o 218.5075 3.736497 582.6426       19.89606 584.0058       38.48022 582.1452       23.24422 218.1852 7.247351 218.3530 4.368371 -0.1678619     8.462078 
1 1 1 15  11 3  o 210.1339 3.618822 538.8209       18.53102 536.9091       25.87075 540.8353       26.55634 209.6113 5.064753 210.3622 5.180412 -0.7509003     7.244887 
1 1 1 15  11 4  o 166.6037 2.859967 338.5291       11.61132 336.8638       17.69046 339.7895       15.39050 166.0284 4.376224 166.8528 3.785149 -0.8244781     5.786077 
1 1 1 15  11 5  o 143.4873 2.415974 251.0423       8.447764 246.5990       11.34556 256.5708       12.65536 142.1688 3.274805 144.9959 3.581644 -2.827133      4.853094 
1 1 1 15  11 6  o 119.8920 2.272389 175.2593       6.639097 175.0923       8.870104 175.4720       10.01135 119.7643 3.041703 119.8639 3.430955 -0.9963226E-01 4.585129 
1 1 1 15  11 7  o 108.9638 2.470934 144.7908       6.561141 144.1198       7.779740 146.4438       12.21030 108.6520 2.940971 109.3741 4.591375 -0.7220612     5.452526 
1 1 1 15  11 8  o 84.32944 2.378400 86.79070       4.882770 86.91184       5.643183 86.42985       9.739459 84.36527 2.748554 83.94581 4.780782 0.4194641      5.514565 
1 1 1 15  11 9  o 115.0105 2.480740 161.3249       6.952720 159.0340       8.196852 167.2004       13.12709 114.1302 2.949678 116.8564 4.618872 -2.726265      5.480381 
1 1 1 15  11 10 o 113.0247 2.872853 155.9682       7.906252 149.7702       9.895719 166.9073       13.14667 110.6824 3.673964 116.7384 4.630506 -6.055946      5.910973 
1 1 1 15  11 11 o 85.50314 3.769360 89.47801       7.834606 81.84785       11.84083 95.41969       10.44888 81.47875 6.005712 88.17200 4.882042 -6.693245      7.739697 
1 1 1 15  11 12 o 170.0882 4.073315 353.6268       16.88334 350.7470       27.88183 355.2941       21.21499 168.7816 6.792788 170.2554 5.119167 -1.473785      8.505754 
1 1 1 15  11 13 o 51.38172 4.801353 32.59904       5.942240 39.53274       8.923640 27.07503       7.965019 56.32772 6.627750 46.34280 7.293690 9.984924       9.855202 
1 1 1 15  11 14 o 71.12780 4.661967 62.20420       8.036079 69.24883       11.07250 54.36346       11.68140 74.83113 6.125495 65.99798 7.389941 8.833153       9.598590 
1 1 1 15  11 15 o 128.2937 4.607144 201.8263       14.38028 233.5447       20.91446 173.3854       19.80448 137.6633 6.250674 118.4216 6.892512 19.24173       9.304711 
1 1 1 15  11 16 o 121.9151 6.706295 183.7663       19.84724 0.000000       0.000000 183.7663       19.84724 ?        ?        121.9151 6.706295 0.000000       6.706295 
1 1 1 15  11 17 o 77.19076 7.161777 74.26952       13.31807 0.000000       0.000000 74.26952       13.31807 ?        ?        77.19076 7.161777 0.000000       7.161777 
1 1 1 15  11 18 o 136.6077 4.069575 228.7813       13.53243 219.9373       16.63563 246.0813       23.26680 133.7011 5.115288 140.9243 6.795110 -7.223221      8.505275 
1 1 1 15  11 19 f 82.27147 3.084854 82.86422       6.173764 80.46479       6.824248 93.68090       14.48932 81.01942 3.464442 86.69300 6.915775 -5.673584      7.735005 
1 1 1 15  11 20 o 85.90685 2.588265 90.23966       5.412240 91.66791       5.813910 80.96165       14.81818 86.56382 2.759632 80.25001 7.670520 6.313812       8.151837 
1 1 1 15  11 21 o 67.21784 2.257726 55.24341       3.692964 52.98147       4.629440 59.20150       6.123939 65.75146 2.896369 69.40065 3.633681 -3.649193      4.646783 
1 1 1 15  11 22 o 44.27627 2.622653 24.05743       2.817072 22.28470       3.566531 26.99795       4.593429 42.48974 3.474819 46.69130 4.077940 -4.201557      5.357608 
1 1 1 15  11 23 o 113.0779 2.483509 156.4129       6.843520 147.9219       8.499494 172.0645       11.53960 109.7827 3.180395 118.1610 4.013389 -8.378288      5.120762 
1 1 1 15  11 24 o 19.70764 4.909784 5.007482       2.349185 7.091919       3.144770 2.375688       3.533624 23.38816 5.593256 16.42774 6.299647 6.960423       8.424373 
1 1 1 15  11 25 o 78.91151 3.155729 76.72124       6.056189 76.72124       6.056189 0.000000       0.000000 78.91151 3.155729 ?        ?        0.000000       3.155729 
1 1 1 15  11 26 o 50.84653 3.163524 31.99227       3.900424 31.22425       4.877906 33.35395       6.495088 49.98954 4.038577 51.24055 5.276943 -1.251019      6.645015 
1 1 1 15  11 27 o 42.75132 3.227269 22.73404       3.337350 27.82644       4.474941 16.35196       5.009643 47.10015 3.934699 35.27459 6.045267 11.82556       7.212982 
1 1 1 15  11 28 o 32.43318 3.828874 13.32858       2.967925 15.27624       3.968504 10.85667       4.470808 34.36929 4.874888 28.22717 6.615592 6.142124       8.217700 
1 1 1 15  11 29 o 23.87309 4.845519 7.547082       2.722511 7.685293       3.483133 7.330050       4.364777 23.70619 6.019346 23.01023 7.087517 0.6959629      9.298679 
1 1 1 15  11 30 o 24.56863 6.411300 8.521003       3.878523 10.22917       7.695284 7.939312       4.490611 25.97663 9.425281 23.50891 7.179266 2.467712       11.84811 
1 1 1 15  11 31 o 9.858482 4.723356 -3.876602      3.245798 -1.407452      6.534735 -4.685274      3.739731 16.18524 7.400942 10.40256 5.006301 5.782683       8.935156 
1 1 1 15  11 32 o 26.68266 5.322844 10.01906       3.339656 11.16051       4.685910 8.840762       4.760958 26.88013 7.062993 23.66554 7.420499 3.214582       10.24450 
1 1 1 15  11 33 o 11.74687 5.141389 0.1935711      2.801964 0.9438813      3.616855 -0.9326178     4.431149 13.67112 5.913801 13.30472 6.087790 0.3663969      8.487298 
1 1 1 15  11 34 o 25.46033 5.936689 9.938074       3.615273 18.55996       5.224394 2.015615       5.008005 34.48996 6.453091 15.66217 6.863810 18.82780       9.420949 
1 1 1 15  11 35 o 16.40516 5.908023 4.155842       3.016477 2.893003       3.947885 5.927283       4.675777 15.22008 6.363606 18.47851 7.202980 -3.258422      9.611369 
1 1 1 15  11 36 f 16.74974 6.091807 4.704095       3.217198 10.03372       4.364069 -1.640386      4.761472 23.07351 7.083307 12.39603 5.877358 10.67747       9.204161 
1 1 1 15  11 37 o 21.87325 6.538071 8.942989       3.752727 8.647115       4.258749 9.970817       7.937578 20.59636 7.050622 18.77978 8.411929 1.816586       10.97597 
1 1 1 15  11 38 o 8.548897 4.179139 -3.517615      2.887443 -6.927304      3.548985 3.158728       4.966108 8.308873 4.158642 14.49161 6.557814 -6.182739      7.765257 
1 1 1 15  12 0  o 121.3108 2.821820 179.4663       8.341899 172.0960       15.71506 182.3578       9.843141 118.5285 5.455359 122.2197 3.307927 -3.691154      6.379915 
1 1 1 15  12 1  o 218.5157 3.742805 582.7139       19.93040 585.6433       38.92474 581.6730       23.20264 218.4586 7.322084 218.2589 4.362438 0.1996460      8.523132 
1 1 1 15  12 2  o 157.5005 3.517931 302.6866       13.50223 340.6757       24.10544 285.3184       16.29910 166.7663 5.941074 152.7923 4.382026 13.97409       7.382311 
1 1 1 15  12 3  o 118.8605 2.524977 172.2716       7.313595 163.9364       10.89519 179.1078       9.867045 115.8257 3.865472 121.1148 3.346341 -5.289139      5.112717 
1 1 1 15  12 4  o 111.6371 2.684555 151.9908       7.303264 147.8428       9.947229 156.8416       10.75698 109.9951 3.716352 113.2806 3.902545 -3.285492      5.388982 
1 1 1 15  12 5  o 66.85195 2.175670 54.54638       3.539684 50.25823       4.443890 61.98912       5.854574 64.12675 2.850854 71.19299 3.384287 -7.066231      4.425016 
1 1 1 15  12 6  o 95.49049 2.188343 111.1779       5.092273 115.3284       6.732790 105.6298       7.784212 97.19253 2.845732 92.96801 3.441878 4.224518       4.465950 
1 1 1 15  12 7  o 215.9171 3.333348 568.9753       17.53896 550.5786       21.51438 605.4261       30.28392 212.3009 4.158539 222.3256 5.594119 -10.02469      6.970481 
1 1 1 15  12 8  o 182.6443 3.429665 407.2073       15.26490 387.6080       20.03430 434.3341       23.56968 178.0021 4.622542 188.3455 5.140064 -10.34341      6.912897 
1 1 1 15  12 9  o 181.6172 4.138504 403.0507       18.31624 425.1501       31.28483 391.5249       22.59323 185.9299 6.916815 178.7813 5.191351 7.148636       8.648263 
1 1 1 15  12 10 o 90.37963 3.713337 99.93890       8.161032 86.22813       12.24247 110.9045       10.94851 83.63940 6.047346 95.09921 4.739283 -11.45981      7.683176 
1 1 1 15  12 11 o 167.6537 4.862760 344.2973       19.84600 342.3992       27.23795 346.4454       28.97554 166.7917 6.715101 167.6752 7.107434 -0.8834686     9.777945 
1 1 1 15  12 12 o 132.0080 4.546143 213.4648       14.60262 194.3931       19.29001 239.0635       22.34833 125.6481 6.320294 139.3076 6.601943 -13.65947      9.139571 
1 1 1 15  12 13 o 193.6110 5.327911 459.8995       25.11366 490.6780       36.55501 432.3873       34.56099 199.3093 7.539924 187.0596 7.597569 12.24974       10.70390 
1 1 1 15  12 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 15  12 15 o 246.1549 8.763707 753.4725       52.48545 0.000000       0.000000 753.4725       52.48545 ?        ?        246.1549 8.763707 0.000000       8.763707 
1 1 1 15  12 16 o 112.6408 4.576638 155.7368       12.53641 159.4380       17.25698 151.6007       18.24235 113.6154 6.257077 110.6435 6.798620 2.971870       9.239710 
1 1 1 15  12 17 o 105.1366 4.629026 135.8158       11.83079 131.0584       16.08516 141.4225       17.46205 102.8708 6.448926 106.7966 6.744120 -3.925728      9.331227 
1 1 1 15  12 18 o 67.45688 5.044626 56.22525       8.232558 58.53959       11.30843 53.61560       12.00826 68.44213 6.873138 65.26023 7.698851 3.181900       10.32048 
1 1 1 15  12 19 o 138.8266 4.753533 237.0706       16.05772 236.0662       22.09871 238.1942       23.37292 137.9319 6.593645 138.4151 6.951615 -0.4832001     9.581289 
1 1 1 15  12 20 o 48.08850 6.441156 29.15665       7.358515 23.16511       9.120226 40.33199       12.45565 42.09541 9.152214 55.77549 9.504498 -13.68008      13.19464 
1 1 1 15  12 21 f 96.24382 4.761418 114.3975       11.13256 114.1742       14.92929 114.6771       16.70807 95.62032 6.444616 95.53473 7.230448 0.8558655E-01  9.685683 
1 1 1 15  12 22 f 98.66301 2.664783 119.1840       6.401099 114.8834       8.853851 123.8936       9.265194 96.63161 3.767123 100.3475 3.795731 -3.715919      5.347783 
1 1 1 15  12 23 o 51.59105 2.432549 32.63640       3.049631 31.04419       3.648599 36.32727       5.555094 50.23125 2.994273 54.10167 4.247553 -3.870419      5.196862 
1 1 1 15  12 24 o 46.70212 2.606573 26.81197       2.954718 27.37954       3.600947 25.64234       5.169293 47.09967 3.155554 45.20146 4.764498 1.898212       5.714715 
1 1 1 15  12 25 o 13.40574 4.653420 2.029284       1.857391 5.149913       2.310721 -3.668357      3.122295 19.92916 4.812748 10.02161 4.753841 9.907552       6.764729 
1 1 1 15  12 26 o 93.87377 3.290759 109.0098       7.516302 107.2904       8.395424 115.9536       16.87188 92.93884 3.714368 94.01627 7.424400 -1.077431      8.301702 
1 1 1 15  12 27 o 70.38688 3.267172 61.53423       5.588732 57.61033       6.166617 79.57554       13.22275 67.89999 3.741304 77.48305 7.081109 -9.583054      8.008712 
1 1 1 15  12 28 o 16.60574 5.074003 3.569752       2.242678 4.834663       2.876253 1.608121       3.581836 19.11763 5.726091 15.21698 6.179646 3.900646       8.424734 
1 1 1 15  12 29 o 9.039938 4.159448 -1.412046      2.108074 -0.4396122     2.639395 -3.125264      3.503327 11.24928 4.954600 10.97251 5.152938 0.2767706      7.148484 
1 1 1 15  12 30 o 11.92669 4.881599 0.8981566      2.256403 1.381341       2.826810 0.4971038E-01  3.745864 13.53653 5.492542 13.63598 5.956950 -0.9945393E-01 8.102671 
1 1 1 15  12 31 o 14.10142 5.266096 2.283541       2.431143 0.9065419      3.146710 4.322634       3.829202 13.32581 5.632819 18.06970 6.634309 -4.743890      8.703029 
1 1 1 15  12 32 o 24.41785 7.035016 9.367491       4.413693 0.000000       0.000000 9.367491       4.413693 ?        ?        24.41785 7.035016 0.000000       7.035016 
1 1 1 15  12 33 o 32.70152 4.422184 14.65396       3.433810 21.59030       4.613183 6.036136       5.142029 39.27217 4.928626 19.57007 7.574366 19.70210       9.036723 
1 1 1 15  12 34 o 10.59562 4.804422 -0.6124264     2.681645 -0.6577888     3.458666 -0.5440549     4.246181 11.85154 5.405921 12.99871 5.952130 -1.147177      8.040636 
1 1 1 15  12 35 o 9.437039 4.494493 -2.403488      2.847156 0.9010062E-03  3.786847 -5.530046      4.318259 12.51429 5.688138 10.33206 5.063390 2.182223       7.615302 
1 1 1 15  12 36 o 9.327041 4.436446 -2.065314      2.756220 -3.817092      3.584137 0.4698483      4.311695 9.767496 4.748330 13.03165 5.978625 -3.264152      7.634828 
1 1 1 15  12 37 o 14.52840 5.921118 3.360151       3.302356 2.021550       3.923811 6.610880       6.114669 13.52488 5.994981 17.18589 7.556283 -3.661018      9.645580 
1 1 1 15  12 38 o 15.41011 6.437437 4.519369       4.034766 4.519369       4.034766 0.000000       0.000000 15.41011 6.437437 ?        ?        0.000000       6.437437 
1 1 1 15  13 0  o 185.7735 3.391898 421.0697       15.35545 448.2424       30.92514 412.1781       17.69029 191.1980 6.647423 183.7578 3.950508 7.440186       7.732706 
1 1 1 15  13 1  o 245.0551 4.056096 733.1401       24.22189 731.8420       47.38626 733.5992       28.18182 244.0242 7.979354 245.0467 4.719369 -1.022507      9.270520 
1 1 1 15  13 2  o 300.4315 4.742357 1102.827       34.71968 1208.566       72.23373 1071.058       39.59328 313.0637 9.479203 295.9326 5.490257 17.13116       10.95437 
1 1 1 15  13 3  o 140.6441 3.044800 241.3069       10.43557 237.9065       20.49496 242.4971       12.12505 139.2739 6.053124 140.9171 3.533674 -1.643265      7.009078 
1 1 1 15  13 4  o 150.8547 3.029493 277.6286       11.13692 293.4229       15.87646 262.3277       15.62647 154.9402 4.208776 146.4743 4.382804 8.465866       6.076411 
1 1 1 15  13 5  o 34.93245 2.662496 14.96950       2.249416 13.09185       2.735819 18.88758       3.951994 32.56404 3.502574 39.09791 4.214377 -6.533875      5.479872 
1 1 1 15  13 6  o 132.0441 2.504625 212.6422       8.059308 210.8377       10.07703 215.8451       13.42533 131.4472 3.145900 132.8622 4.151651 -1.415024      5.208924 
1 1 1 15  13 7  o 144.1481 3.477870 253.6553       12.21683 258.1929       14.42738 242.1570       22.96645 145.3236 4.077979 140.3214 6.736031 5.002213       7.874263 
1 1 1 15  13 8  o 156.0259 4.701203 297.9800       17.85444 284.1729       24.07935 314.8416       26.60983 152.0435 6.514012 159.9808 6.841355 -7.937286      9.446507 
1 1 1 15  13 9  o 113.4543 4.493397 157.6383       12.39859 190.2479       18.41841 130.6164       16.76631 124.4036 6.094057 102.9144 6.722155 21.48918       9.073307 
1 1 1 15  13 10 o 210.4317 7.901087 546.5961       40.44474 0.000000       0.000000 546.5961       40.44474 ?        ?        210.4317 7.901087 0.000000       7.901087 
1 1 1 15  13 11 o 144.9465 4.974932 257.5496       17.54635 0.000000       0.000000 257.5496       17.54635 ?        ?        144.9465 4.974932 0.000000       4.974932 
1 1 1 15  13 12 o 211.2188 5.720030 547.7798       29.41488 0.000000       0.000000 547.7798       29.41488 ?        ?        211.2188 5.720030 0.000000       5.720030 
1 1 1 15  13 13 f 186.7746 4.336050 426.8746       19.73550 397.4119       31.54194 445.8296       25.29961 179.3931 7.229984 190.5634 5.453623 -11.17038      9.056195 
1 1 1 15  13 14 o 157.8576 5.030077 305.8085       19.32509 283.1356       24.85101 340.4948       30.73756 151.4507 6.750398 165.8234 7.626971 -14.37271      10.18521 
1 1 1 15  13 15 o 165.3008 4.956105 335.4078       19.94163 318.3540       26.93190 356.1055       29.66996 160.4820 6.902738 169.6440 7.193316 -9.162064      9.969533 
1 1 1 15  13 16 o 116.6055 4.625553 166.9634       13.11765 163.5521       17.74513 171.0734       19.47805 115.0110 6.356179 117.5022 6.831883 -2.491249      9.331432 
1 1 1 15  13 17 o 73.56059 4.944331 66.74773       8.811687 61.25393       11.72463 73.87849       13.35767 70.02498 6.963005 76.90037 7.212139 -6.875389      10.02489 
1 1 1 15  13 18 o 49.87632 5.930243 31.10321       7.066851 32.70967       9.456030 29.07092       10.63574 50.68896 7.913729 47.29828 9.556799 3.390675       12.40804 
1 1 1 15  13 19 o 98.06949 4.690282 118.4798       11.17656 122.7695       15.41058 113.7196       16.23361 99.37231 6.397810 95.42569 7.030293 3.946625       9.505629 
1 1 1 15  13 20 o 42.04494 6.577879 22.46265       6.518880 31.25098       8.894506 12.26321       9.582013 49.45387 7.625295 31.59467 10.57741 17.85920       13.03943 
1 1 1 15  13 21 o 21.10528 8.477676 2.927818       6.659632 2.927818       6.659632 0.000000       0.000000 21.10528 8.477676 ?        ?        0.000000       8.477676 
1 1 1 15  13 22 o 27.49911 9.627480 8.940585       7.959636 8.940585       7.959636 0.000000       0.000000 27.49911 9.627480 ?        ?        0.000000       9.627480 
1 1 1 15  13 23 o 123.6595 4.817806 189.9290       14.49043 167.7611       18.87858 221.7171       22.60676 115.1501 6.757437 132.2227 7.041498 -17.07266      9.759388 
1 1 1 15  13 24 o 26.04037 3.401278 8.489649       2.106829 11.09577       3.269908 6.639843       2.754869 29.52660 4.702044 22.63357 5.115472 6.893032       6.948184 
1 1 1 15  13 25 o 55.46270 2.311450 37.77657       3.117229 38.45005       3.885193 36.55962       5.222600 55.83943 2.864769 54.14305 3.986241 1.696381       4.908872 
1 1 1 15  13 26 o 18.18534 4.132010 4.285608       1.789367 4.634711       2.201850 3.606652       3.070659 18.83906 4.787102 17.38523 5.985690 1.453829       7.664518 
1 1 1 15  13 27 f 42.66097 2.874919 22.59797       2.971318 27.66275       4.009693 16.42938       4.425107 47.00813 3.525969 35.52813 5.270666 11.48000       6.341323 
1 1 1 15  13 28 f 11.32921 4.726833 0.4884280      2.171396 0.1200551      2.252358 5.337855       8.172196 11.04417 4.720362 22.87471 9.317595 -11.83054      10.44507 
1 1 1 15  13 29 o 12.99864 4.820628 1.807532       2.030453 1.685082       2.540114 2.024250       3.379250 13.57259 5.303695 15.19747 6.061127 -1.624875      8.053971 
1 1 1 15  13 30 o 13.60340 5.120712 2.004529       2.308397 3.950676       3.007374 -0.7865174     3.601499 17.29030 5.924711 12.63670 5.662805 4.653604       8.195704 
1 1 1 15  13 31 o 33.54961 4.135190 14.88360       3.309337 22.29437       5.091689 9.463345       4.354516 40.18339 5.331113 24.93961 6.921261 15.24379       8.736397 
1 1 1 15  13 32 f 9.043139 4.239422 -1.866718      2.353506 -1.382286      3.064836 -2.562907      3.674124 10.90015 5.015340 11.19789 5.264522 -0.2977448     7.271095 
1 1 1 15  13 33 o 16.34232 6.440003 3.560372       3.772151 7.840196       9.317961 2.721500       4.125303 21.05277 9.289354 15.69309 6.528807 5.359677       11.35418 
1 1 1 15  13 34 o 13.70519 5.950627 1.361104       3.689776 3.296735       7.599338 0.7640207      4.220674 17.49627 7.993080 13.77173 6.153837 3.724548       10.08757 
1 1 1 15  13 35 o 17.28153 5.974142 4.910267       3.059953 3.353777       3.859234 7.545514       5.021560 15.36024 6.345688 19.61728 7.513021 -4.257032      9.834289 
1 1 1 15  13 36 o 11.16206 5.072955 -0.2311311E-01 3.011016 -3.317590      3.598380 7.670745       5.499027 9.971130 4.826180 18.67670 7.629768 -8.705568      9.028032 
1 1 1 15  13 37 o 14.55960 5.734361 3.501941       2.989353 5.465499       3.921909 0.7794520      4.618051 16.70089 6.571093 13.03265 6.052496 3.668242       8.933754 
1 1 1 15  14 0  o 144.6206 3.382323 255.2056       11.92014 234.7179       19.84476 266.7701       14.90953 138.3676 5.898929 147.7501 4.145049 -9.382477      7.209632 
1 1 1 15  14 1  o 155.2421 4.116518 294.4968       15.55938 288.4316       22.50079 300.0547       21.53927 153.3795 6.031732 156.5018 5.657057 -3.122299      8.269466 
1 1 1 15  14 2  o 92.18596 2.988926 103.7793       6.705662 102.7927       11.34262 104.3094       8.314199 91.54910 5.104419 92.36627 3.701274 -0.8171692     6.305119 
1 1 1 15  14 3  o 124.5395 3.942708 189.5786       11.95061 0.000000       0.000000 189.5786       11.95061 ?        ?        124.5395 3.942708 0.000000       3.942708 
1 1 1 15  14 4  o 80.34431 2.965986 78.86016       5.797146 88.00402       9.699163 73.77809       7.230858 84.71999 4.716610 77.63802 3.833757 7.081978       6.078166 
1 1 1 15  14 5  o 142.8282 3.150098 248.9335       10.96413 238.4934       13.16194 272.6023       19.81781 139.6947 3.870102 149.1422 5.462018 -9.447510      6.694127 
1 1 1 15  14 6  o 77.89908 2.294126 74.06420       4.350231 70.45611       5.767222 78.82702       6.626126 75.91982 3.123950 80.28843 3.394310 -4.368607      4.613069 
1 1 1 15  14 7  o 93.44857 4.799274 107.0904       10.89249 0.000000       0.000000 107.0904       10.89249 ?        ?        93.44857 4.799274 0.000000       4.799274 
1 1 1 15  14 8  o 39.11748 7.710062 19.48054       7.088196 0.000000       0.000000 19.48054       7.088196 ?        ?        39.11748 7.710062 0.000000       7.710062 
1 1 1 15  14 9  o 107.0849 3.801788 140.2735       9.905190 146.4253       15.86322 136.3422       12.68116 109.0980 5.989744 105.4266 4.949791 3.671349       7.770293 
1 1 1 15  14 10 o 81.68224 3.989723 81.74316       7.917547 89.78384       12.30584 76.06347       10.34254 85.33916 5.954702 78.59693 5.433337 6.742226       8.060994 
1 1 1 15  14 11 o 138.1678 3.895376 233.5342       13.10264 225.5273       20.90055 238.7184       16.81774 135.3282 6.355478 139.5240 4.954188 -4.195786      8.058292 
1 1 1 15  14 12 o 81.63924 4.099538 81.71843       8.129766 98.62136       12.92699 70.65891       10.45646 89.41592 5.966764 75.66437 5.713178 13.75156       8.260913 
1 1 1 15  14 13 o 196.6599 4.466980 473.4914       21.40750 506.7555       36.59505 456.1863       26.39495 202.4698 7.429562 192.6833 5.627379 9.786469       9.320182 
1 1 1 15  14 14 o 59.70787 4.658219 43.94429       6.724180 31.48044       9.425177 56.86397       9.595977 49.81379 8.037863 67.76462 5.868787 -17.95082      9.952382 
1 1 1 15  14 15 o 232.2217 5.893533 663.9678       33.32449 650.7295       45.95492 678.6498       48.39563 228.7528 8.257388 233.4624 8.520837 -4.709610      11.86546 
1 1 1 15  14 16 o 22.79734 8.165010 5.541761       5.752542 7.618800       7.648785 2.837041       8.728333 26.43473 9.420978 23.55808 9.616797 2.876652       13.46245 
1 1 1 15  14 17 o 30.76139 8.069555 12.21421       6.123216 13.64719       8.364438 10.55952       8.988243 32.69170 9.758444 29.96708 10.24334 2.724619       14.14755 
1 1 1 15  14 18 o 105.0571 4.682825 135.8622       11.95850 139.1449       16.24634 131.9805       17.66652 105.8817 6.325325 102.8681 7.090871 3.013634       9.502115 
1 1 1 15  14 19 o 27.44763 9.788626 8.412416       8.258778 8.412416       8.258778 0.000000       0.000000 27.44763 9.788626 ?        ?        0.000000       9.788626 
1 1 1 15  14 20 o 26.97265 9.485879 8.359599       7.733039 8.359599       7.733039 0.000000       0.000000 26.97265 9.485879 ?        ?        0.000000       9.485879 
1 1 1 15  14 21 o 69.79025 5.097841 60.56760       8.610164 50.80797       10.94235 76.43443       13.95208 63.22766 7.231720 77.60424 7.469811 -14.37658      10.39692 
1 1 1 15  14 22 o 35.61940 7.449384 16.61190       6.257854 16.39601       7.796110 17.00298       10.49276 35.02721 9.064466 35.62234 10.99196 -0.5951271     14.24737 
1 1 1 15  14 23 o 96.36565 4.766018 115.6431       11.15744 107.1048       14.61870 127.5570       17.26820 91.84026 6.575408 99.90966 7.139626 -8.069397      9.706197 
1 1 1 15  14 24 o 53.60497 6.032671 36.75519       7.743789 34.14326       10.15240 40.38882       11.97453 50.47725 8.558931 54.54766 9.344333 -4.070408      12.67169 
1 1 1 15  14 25 o 26.81471 7.909116 9.693764       5.520907 6.848087       6.871814 14.87477       9.272265 24.16990 8.885195 32.53127 10.37555 -8.361374      13.66012 
1 1 1 15  14 26 o 21.85604 4.027734 6.146005       2.066184 6.632162       3.201191 5.798851       2.705106 22.32330 5.824272 20.95501 5.295857 1.368288       7.871991 
1 1 1 15  14 27 o 12.71115 4.311369 1.918375       1.591841 3.617887       1.920102 -1.817195      2.846694 16.62346 4.589329 10.55924 4.849343 6.064223       6.676681 
1 1 1 15  14 28 o 37.71438 3.443357 17.96583       3.129774 21.32612       4.771605 15.42853       4.146311 40.40075 4.949911 34.19828 5.133681 6.202473       7.131361 
1 1 1 15  14 29 o 12.77928 4.661294 1.822730       1.885585 0.7940994      2.424480 3.397306       2.999651 12.12266 5.020912 16.54541 5.899423 -4.422750      7.746789 
1 1 1 15  14 30 o 25.80357 4.807920 9.033880       2.912039 8.693548       3.103739 11.53643       8.416381 25.06866 5.249196 26.05610 9.784239 -0.9874382     11.10340 
1 1 1 15  14 31 o 26.67585 4.041737 9.488823       2.545168 10.15546       3.290961 8.496675       4.014834 26.89547 5.209414 23.58805 6.681951 3.307426       8.472689 
1 1 1 15  14 32 o 10.60740 4.615604 0.1278706      2.229930 2.093974       2.926367 -2.594635      3.443578 14.06030 5.629348 10.72950 5.060448 3.330792       7.569524 
1 1 1 15  14 33 o 14.71956 5.381194 2.947843       2.515090 2.796375       3.328218 3.149498       3.840221 15.05021 6.010923 15.79899 6.405011 -0.7487803     8.783813 
1 1 1 15  14 34 o 13.10681 5.432544 1.757885       2.841229 6.404140       3.978909 -3.076062      4.058481 19.25134 6.801394 11.09920 5.308075 8.152134       8.627550 
1 1 1 15  14 35 o 16.60962 6.761470 4.684841       4.300259 8.120944       8.420735 3.472606       5.001617 18.74088 8.504058 15.71435 6.873736 3.026523       10.93468 
1 1 1 15  14 36 f 9.620230 4.527749 -1.431212      2.730828 -2.112192      3.526000 -0.4104888     4.316871 10.43242 4.977777 12.31399 5.762736 -1.881571      7.614945 
1 1 1 15  14 37 o 9.677423 4.575753 -1.437743      2.848428 -0.7166854     3.761959 -2.406534      4.360580 11.33169 5.327316 11.10727 5.360579 0.2244186      7.557519 
1 1 1 15  15 0  o 146.0727 3.038466 260.3083       10.81583 242.8364       20.45942 267.0850       12.74187 140.7076 5.980412 147.9292 3.534622 -7.221588      6.946862 
1 1 1 15  15 1  o 116.3202 2.535160 165.0082       7.186159 151.9618       10.92409 174.9606       9.541227 111.4789 4.027827 119.6965 3.274122 -8.217552      5.190691 
1 1 1 15  15 2  o 171.7258 3.268525 359.8679       13.67803 374.9742       26.98862 354.6467       15.86668 174.8094 6.346015 170.4277 3.820410 4.381714       7.407257 
1 1 1 15  15 3  o 266.4816 4.368835 867.6978       28.37063 843.2379       55.74615 876.2474       32.95804 261.4441 8.762218 267.6637 5.052843 -6.219635      10.11473 
1 1 1 15  15 4  o 70.51295 2.459426 60.71226       4.219620 64.27821       6.433168 58.01967       5.590132 72.46577 3.654772 68.86562 3.341038 3.600151       4.951756 
1 1 1 15  15 5  o 198.9817 2.881943 483.0785       13.97445 467.2971       18.89246 502.1448       20.76581 195.5871 3.963804 202.7166 4.203620 -7.129486      5.777730 
1 1 1 15  15 6  o 115.6545 2.751752 163.1880       7.755468 158.7005       10.52914 168.5100       11.46649 113.9245 3.797934 117.3725 4.014837 -3.447968      5.526591 
1 1 1 15  15 7  f 111.3322 3.738529 151.5696       10.12841 149.3380       16.16339 153.0125       12.99648 110.1890 6.042597 111.7340 4.784213 -1.545006      7.707248 
1 1 1 15  15 8  o 16.41407 6.963452 0.1263919      4.838194 -6.803602      5.951469 13.63122       8.308112 14.04051 6.631332 32.88821 9.702742 -18.84770      11.75235 
1 1 1 15  15 9  o 117.0240 3.893559 167.5473       11.08799 174.9717       17.55260 162.6173       14.30315 119.2495 6.060034 115.1161 5.111447 4.133354       7.927856 
1 1 1 15  15 10 o 34.35547 6.538046 14.98243       5.273773 23.85031       7.739936 7.297507       7.205222 43.36916 7.600425 25.90111 9.152337 17.46804       11.89671 
1 1 1 15  15 11 o 148.1919 3.993432 268.7249       14.40823 245.3504       22.62113 284.6807       18.68976 141.0697 6.598564 152.3407 5.041389 -11.27095      8.304014 
1 1 1 15  15 12 o 210.1160 4.579895 540.6108       23.45043 522.1370       38.36612 551.6290       29.62951 205.4373 7.677102 211.8696 5.744083 -6.432297      9.588137 
1 1 1 15  15 13 o 191.8388 4.420554 450.6659       20.66566 434.8912       33.49626 460.3602       26.25881 187.4907 7.345504 193.5281 5.573753 -6.037338      9.220799 
1 1 1 15  15 14 o 32.30548 7.099625 13.38571       5.436359 11.12789       7.684369 15.64800       7.691982 29.97779 9.431238 34.79945 9.002815 -4.821667      13.03836 
1 1 1 15  15 15 o 87.70666 4.809250 94.66834       10.23955 88.13678       13.69719 102.9427       15.41665 84.21159 6.730553 90.97881 7.007623 -6.767220      9.716332 
1 1 1 15  15 16 o 42.25705 9.101371 23.16788       9.095054 23.16788       9.095054 0.000000       0.000000 42.25705 9.101371 ?        ?        0.000000       9.101371 
1 1 1 15  15 17 o 30.89865 9.888791 11.87060       8.417075 11.87060       8.417075 0.000000       0.000000 30.89865 9.888791 ?        ?        0.000000       9.888791 
1 1 1 15  15 18 o 140.9075 6.662045 246.9655       22.81109 246.9655       22.81109 0.000000       0.000000 140.9075 6.662045 ?        ?        0.000000       6.662045 
1 1 1 15  15 19 o 122.2920 4.740089 184.4588       14.09930 190.2447       19.26082 177.7791       20.69518 123.5797 6.417739 119.1316 7.161702 4.448158       9.616514 
1 1 1 15  15 20 o 62.02437 5.316490 47.94535       7.958263 43.01431       10.45150 54.74932       12.27696 58.05331 7.567787 65.49664 7.848013 -7.443321      10.90242 
1 1 1 15  15 21 o 62.54243 5.405340 48.92345       8.157450 53.21130       10.77299 43.16074       12.48905 64.72358 6.938434 57.30504 9.258923 7.418537       11.57020 
1 1 1 15  15 22 o 25.66295 8.348370 8.310701       5.983237 -0.3249264     7.465604 23.81762       10.00416 19.54117 8.474581 41.82254 9.959423 -22.28138      13.07703 
1 1 1 15  15 23 o 72.04631 5.065097 65.11983       8.836075 65.05859       11.85480 65.19639       13.25417 71.13926 6.925890 70.71931 7.821479 0.4199448      10.44718 
1 1 1 15  15 24 o 99.17064 4.897737 123.4859       11.79965 125.6026       15.87555 120.8731       17.63765 98.81819 6.630966 96.15736 7.588468 2.660835       10.07743 
1 1 1 15  15 25 o 28.15738 8.323811 10.90415       6.109373 8.247877       7.946146 14.74442       9.554368 25.89601 9.548542 32.14709 10.55534 -6.251076      14.23341 
1 1 1 15  15 26 o 30.52228 8.217922 13.16620       6.247336 5.334867       8.439419 22.66007       9.292146 23.48865 9.504999 39.22625 9.760321 -15.73760      13.62383 
1 1 1 15  15 27 o 43.45319 3.289227 23.67792       3.457119 41.41404       10.46695 21.50615       3.662668 54.09758 8.196179 41.25260 3.682093 12.84497       8.985274 
1 1 1 15  15 28 o 21.70943 4.297211 6.215147       2.192886 7.653092       3.705357 5.440033       2.720454 23.38708 6.342717 19.98764 5.440629 3.399433       8.356465 
1 1 1 15  15 29 o 28.98622 4.776041 11.24124       3.256222 37.17722       9.679012 7.931206       3.457769 49.52354 8.314530 23.69029 5.987630 25.83324       10.24613 
1 1 1 15  15 30 o 8.455122 3.855817 -0.9079496     1.758274 -0.5418562     2.326599 -1.395467      2.684854 10.24848 4.574939 10.26371 4.712093 -0.1523113E-01 6.567639 
1 1 1 15  15 31 o 33.92754 4.340951 15.52953       3.506887 15.65555       3.819549 14.85299       8.850141 33.73466 4.779921 27.03321 10.05690 6.701450       11.13503 
1 1 1 15  15 32 o 42.31527 4.042859 24.05947       4.118279 26.01721       4.630764 16.65415       9.006323 43.63225 4.415937 27.29669 10.14711 16.33557       11.06636 
1 1 1 15  15 33 o 17.59250 5.655596 4.736655       2.750933 9.465696       3.469158 -3.274146      4.515184 24.73799 5.847658 11.77587 5.622683 12.96211       8.112316 
1 1 1 15  15 34 o 18.13707 5.857744 5.343802       2.948837 7.777929       3.755242 1.428619       4.762581 21.15030 6.584064 14.43277 6.486253 6.717527       9.242369 
1 1 1 15  15 35 o 14.96090 5.685017 3.506748       2.860844 2.182580       3.840475 5.157601       4.288127 13.93538 6.060554 16.89105 6.796538 -2.955665      9.106220 
1 1 1 15  15 36 o 10.51965 5.064563 -2.624705      3.835751 -2.695889      8.761606 -2.607827      4.266322 14.13285 6.981230 11.04957 5.325129 3.083275       8.780352 
1 1 1 15  16 0  o 131.8397 2.881135 212.0421       9.256482 219.1622       13.50783 205.7383       12.70987 133.8850 4.145156 129.7289 4.025262 4.156174       5.777980 
1 1 1 15  16 1  o 131.5583 2.638025 211.1033       8.457333 208.9863       13.21057 212.5735       11.00910 130.7313 4.151998 131.9242 3.427355 -1.192947      5.383851 
1 1 1 15  16 2  o 326.2745 4.554968 1301.272       36.21634 1276.244       56.41588 1318.817       47.23394 322.3539 7.181783 328.1078 5.907469 -5.753906      9.299258 
1 1 1 15  16 3  o 97.77632 2.846414 116.7355       6.774938 106.4711       13.45435 120.2223       7.841671 93.02604 5.966475 99.19536 3.248383 -6.169319      6.793439 
1 1 1 15  16 4  o 171.7114 2.951230 359.7763       12.34919 367.6465       19.25620 354.2782       16.09472 173.3461 4.562450 170.3050 3.878109 3.041138       5.987961 
1 1 1 15  16 5  o 33.74777 3.277926 14.03311       2.661837 11.58880       3.827262 16.32318       3.704547 30.31942 5.376883 36.29667 4.269828 -5.977249      6.866025 
1 1 1 15  16 6  o 111.4595 3.754280 151.9271       10.18262 173.5504       17.07409 139.9912       12.68541 118.8264 5.915016 106.8476 4.884885 11.97884       7.671344 
1 1 1 15  16 7  f 102.5708 4.623738 128.9679       11.52750 124.8775       14.68282 135.5401       18.61173 100.7170 6.009663 104.6872 7.342087 -3.970230      9.488007 
1 1 1 15  16 8  o 189.3711 4.297806 438.5692       19.83337 401.4834       31.48603 462.9637       25.53649 180.4562 7.174247 194.2860 5.398894 -13.82977      8.978745 
1 1 1 15  16 9  o 85.83002 4.535768 90.39819       9.453261 83.64330       12.27083 100.2602       14.82681 82.29961 6.163190 90.02222 6.809172 -7.722610      9.184211 
1 1 1 15  16 10 o 166.8244 4.917515 341.2167       19.96949 320.0585       26.73914 367.9007       30.02844 161.0985 6.826613 172.6400 7.153145 -11.54146      9.887878 
1 1 1 15  16 11 o 207.6380 4.572389 527.9272       23.13588 562.2562       39.71287 510.2900       28.46533 213.2019 7.656137 203.7718 5.738107 9.430130       9.567775 
1 1 1 15  16 12 o 25.49120 7.797207 8.064856       5.294149 10.47577       7.506429 5.678671       7.467836 29.25359 9.336022 24.56928 9.218410 4.684305       13.12023 
1 1 1 15  16 13 o 66.37852 4.683816 54.27443       7.527765 56.77122       10.98642 52.06488       10.33514 67.50820 6.769511 64.64587 6.655532 2.862335       9.493281 
1 1 1 15  16 14 o 90.93813 5.198336 101.9065       11.47185 119.6904       14.65047 73.71981       18.44421 98.36868 6.142303 75.98224 10.22013 22.38644       11.92388 
1 1 1 15  16 15 o 119.4512 6.443762 176.7156       18.68769 176.7156       18.68769 0.000000       0.000000 119.4512 6.443762 ?        ?        0.000000       6.443762 
1 1 1 15  16 16 o 16.27689 7.183091 -1.557296      5.573442 -4.138718      7.674649 1.323308       8.107199 17.94203 8.132434 21.76450 9.110887 -3.822470      12.21248 
1 1 1 15  16 17 o 76.67853 4.884130 72.62185       9.078912 81.90478       12.49667 62.24538       13.21223 81.07954 6.376070 70.19005 7.859179 10.88949       10.12032 
1 1 1 15  16 18 f 33.57631 7.813699 14.66625       6.272851 18.90979       8.636413 9.927810       9.126131 37.90230 9.397310 29.30261 10.30498 8.599688       13.94640 
1 1 1 15  16 19 o 84.73194 4.805323 88.83138       9.881478 86.62415       13.30391 91.54745       14.75798 83.10284 6.624211 85.23993 7.171167 -2.137085      9.762470 
1 1 1 15  16 20 o 100.8938 4.677859 125.9975       11.47002 121.7123       15.38004 131.3674       17.21708 98.47330 6.444601 102.0735 6.963362 -3.600220      9.487955 
1 1 1 15  16 21 o 29.37789 8.305022 11.37835       6.208637 12.18147       8.012559 10.17160       9.821787 30.55270 9.633018 29.45077 10.65348 1.101934       14.36286 
1 1 1 15  16 22 o 45.65178 6.351470 26.76696       6.874819 24.44425       8.789557 30.42708       11.03360 42.66684 8.747551 47.18091 9.912206 -4.514065      13.22012 
1 1 1 15  16 23 o 41.10993 6.858542 22.13581       6.628994 11.53714       8.252169 41.41747       11.13050 29.51225 9.814610 55.67756 8.470131 -26.16531      12.96417 
1 1 1 15  16 24 o 37.50688 7.382534 18.90600       6.507298 20.77081       8.497108 16.26112       10.11944 38.49455 9.186323 33.71528 10.84797 4.779274       14.21503 
1 1 1 15  16 25 f 43.78750 6.522929 25.40073       6.748203 21.90487       8.827059 30.31740       10.46826 39.01446 9.396884 45.90194 9.664565 -6.887486      13.47981 
1 1 1 15  16 26 o 24.36091 9.679048 6.724476       8.585695 0.000000       0.000000 6.724476       8.585695 ?        ?        24.36091 9.679048 0.000000       9.679048 
1 1 1 15  16 27 o 13.30949 6.257736 -4.294529      5.192974 -2.092673      7.003736 -6.983074      7.739162 16.92014 7.708187 15.62013 7.430994 1.300006       10.70681 
1 1 1 15  16 28 o 57.88632 5.625392 45.05771       7.835375 44.22643       10.73796 46.00436       11.45894 54.48251 8.353809 54.99248 8.851105 -0.5099716     12.17079 
1 1 1 15  16 29 f 7.924653 3.626741 -0.9257449     1.573632 5.667850       7.502949 -1.229135      1.609429 21.31863 8.831406 7.718750 3.580677 13.59988       9.529690 
1 1 1 15  16 30 o 15.63901 5.303848 3.299003       2.409076 14.10037       8.028157 2.230123       2.525463 27.43973 9.663942 13.99125 5.335471 13.44848       11.03898 
1 1 1 15  16 31 o 18.11282 4.835051 4.658679       2.174017 3.881239       3.043341 5.468819       3.106686 16.63815 5.941158 19.12527 5.993869 -2.487116      8.439421 
1 1 1 15  16 32 o 14.30866 5.149865 2.755271       2.291551 5.502332       2.988937 -1.161971      3.569216 18.94548 5.870157 11.73980 5.405539 7.205684       7.979887 
1 1 1 15  16 33 o 12.65158 5.477988 1.006297       3.109345 1.617082       3.406407 -2.044501      7.613060 13.58740 5.806135 15.09754 7.233573 -1.510142      9.275548 
1 1 1 15  16 34 o 19.77583 5.500580 6.267166       2.746955 5.806414       3.740257 6.806714       4.047467 18.13183 6.572137 19.24389 6.853713 -1.112055      9.495597 
1 1 1 15  16 35 o 15.75723 5.612028 4.098911       2.713768 4.072852       3.632893 4.131809       4.081930 15.60502 6.263846 15.70064 6.509933 -0.9562111E-01 9.034101 
1 1 1 15  16 36 o 20.54106 5.925179 7.510055       3.129182 10.29453       4.317616 4.429277       4.541533 22.36751 7.073762 15.58647 6.683189 6.781038       9.731553 
1 1 1 15  17 0  o 84.53045 2.774952 87.26187       5.708417 89.79333       11.34440 86.40358       6.605632 85.47158 5.475372 84.07909 3.229972 1.392494       6.357076 
1 1 1 15  17 1  o 182.4601 3.042076 406.2475       13.52615 409.6168       21.26286 403.9572       17.53060 182.9542 4.773251 181.8513 3.955889 1.102844       6.199434 
1 1 1 15  17 2  o 122.3608 2.588049 182.6309       7.717044 187.0833       12.09798 179.5764       10.02036 123.6815 4.019287 121.2374 3.394987 2.444099       5.261236 
1 1 1 15  17 3  o 55.36119 3.029216 37.51398       4.071118 29.21462       8.461435 40.01396       4.643976 48.19046 7.444877 57.15377 3.349008 -8.963306      8.163458 
1 1 1 15  17 4  o 129.5116 2.643555 204.6274       8.343209 209.4336       12.85959 201.1337       10.96398 130.8536 4.037618 128.2927 3.510255 2.560959       5.350163 
1 1 1 15  17 5  o 219.0600 3.870996 586.3236       20.66436 583.0856       27.98373 590.2068       30.64487 218.1980 5.262825 219.3471 5.738031 -1.149139      7.786034 
1 1 1 15  17 6  o 104.0322 2.938813 132.1949       7.442873 112.4711       14.35314 139.4492       8.704655 95.52413 6.199405 106.8122 3.348355 -11.28803      7.045857 
1 1 1 15  17 7  o 103.5629 3.875850 131.2626       9.764285 130.6227       15.30240 131.7021       12.68150 102.9695 6.126078 103.5787 5.039288 -0.6092606     7.932417 
1 1 1 15  17 8  o 162.3356 5.009698 323.1137       19.79436 350.8312       27.63804 293.9232       28.36293 168.7422 6.734736 154.1975 7.571250 14.54474       10.13314 
1 1 1 15  17 9  o 125.9774 3.865952 194.1993       11.85417 202.3904       19.23808 189.1857       15.05094 128.1903 6.176613 124.1632 4.984462 4.027107       7.936965 
1 1 1 15  17 10 o 23.12066 8.818635 4.668320       6.900053 4.668320       6.900053 0.000000       0.000000 23.12066 8.818635 ?        ?        0.000000       8.818635 
1 1 1 15  17 11 o 100.2363 4.870370 123.4476       11.86099 129.7296       15.23241 113.7722       18.90390 102.5172 6.125205 95.47990 8.204087 7.037323       10.23842 
1 1 1 15  17 12 o 65.68265 5.655372 53.41119       8.964014 64.68654       11.16717 32.98342       15.03102 72.17896 6.415646 50.02516 12.39415 22.15379       13.95620 
1 1 1 15  17 13 o 162.0210 4.968198 322.5245       19.59263 304.0865       26.24440 345.7383       29.44779 156.7169 6.888858 166.9819 7.254116 -10.26508      10.00393 
1 1 1 15  17 14 o 42.40089 6.126733 22.61183       6.147184 23.74492       8.921692 21.58771       8.481838 42.86117 8.835546 40.83911 8.783702 2.022060       12.45874 
1 1 1 15  17 15 o 93.39674 4.735330 107.3968       10.74233 100.3910       14.29175 116.4953       16.28693 89.85636 6.572257 96.71738 6.956805 -6.861023      9.570355 
1 1 1 15  17 16 o 191.3447 5.395645 451.6652       25.13402 435.6565       34.19704 470.4724       37.06575 186.8364 7.526285 193.9638 7.858074 -7.127350      10.88091 
1 1 1 15  17 17 o 67.23770 5.168225 56.06696       8.403258 61.75958       11.78772 50.18447       11.98269 70.09815 6.993849 62.80973 8.010786 7.288425       10.63422 
1 1 1 15  17 18 o 98.73824 4.681555 120.3992       11.23241 120.2363       15.47945 120.5802       16.32425 98.06248 6.514572 98.06213 6.874735 0.3433228E-03  9.471094 
1 1 1 15  17 19 o 53.30056 5.723467 35.68007       7.317757 39.39234       10.03004 31.45517       10.70017 55.42962 7.627504 48.83183 9.332006 6.597786       12.05260 
1 1 1 15  17 20 o 40.04848 6.917830 20.72519       6.507330 19.29845       8.580280 22.65689       9.983885 37.91830 9.346426 40.89832 10.08254 -2.980019      13.74821 
1 1 1 15  17 21 o 31.15397 7.681207 12.89390       5.794025 17.69500       7.764551 6.861296       8.703592 36.21898 8.869217 25.90508 9.898539 10.31390       13.29075 
1 1 1 15  17 22 o 18.54495 7.653449 1.785003       5.606002 3.345639       7.408018 -0.3063999     8.575712 21.84650 8.881505 20.68550 9.025371 1.161001       12.66248 
1 1 1 15  17 23 o 31.13574 7.943293 13.20364       6.045556 22.07527       8.189800 2.580970       8.961657 40.10350 8.635769 22.62329 9.531330 17.48022       12.86168 
1 1 1 15  17 24 o 82.05743 7.392335 89.40645       14.62377 0.000000       0.000000 89.40645       14.62377 ?        ?        82.05743 7.392335 0.000000       7.392335 
1 1 1 15  17 25 o 40.99150 6.897563 22.72304       6.645706 19.12670       8.838511 27.40097       10.08035 35.84329 9.827083 43.07746 9.821412 -7.234169      13.89358 
1 1 1 15  17 26 o 23.12710 7.786850 7.317036       5.192466 11.56249       6.979114 2.053409       7.771071 28.02649 9.008051 20.27348 8.718322 7.753010       12.53611 
1 1 1 15  17 27 o 56.12152 5.554611 41.98460       7.497058 39.20316       10.15713 45.31357       11.11198 51.59607 8.364410 55.36053 8.508646 -3.764462      11.93149 
1 1 1 15  17 28 o 13.53058 6.287297 -2.801597      4.994182 3.856448       6.960288 -9.867021      7.170062 19.97060 8.406016 13.56756 6.622352 6.403042       10.70125 
1 1 1 15  17 29 o 31.38580 7.679668 15.41483       5.824883 18.31056       8.070490 12.26616       8.415600 32.10373 9.586040 26.14630 9.790927 5.957426       13.70235 
1 1 1 15  17 30 o 23.42801 9.175520 9.838281       7.616735 9.838281       7.616735 0.000000       0.000000 23.42801 9.175520 ?        ?        0.000000       9.175520 
1 1 1 15  17 31 f 8.124638 3.828657 -1.755685      1.963649 5.186824       7.046169 -2.340272      2.044652 19.27286 8.295039 7.891469 3.772269 11.38139       9.112502 
1 1 1 15  17 32 o 11.97352 4.705763 1.548350       2.009353 0.5917438      2.879168 2.456674       2.805569 12.04130 5.242028 14.12329 5.557498 -2.081984      7.639676 
1 1 1 15  17 33 f 12.51724 4.951431 1.840783       2.237538 5.528049       3.153555 -1.897436      3.175270 18.34014 6.066133 10.34423 4.872766 7.995912       7.780863 
1 1 1 15  17 34 o 15.00055 5.820625 3.474880       3.042412 3.080433       3.334530 5.434867       7.433046 14.60843 5.951334 17.25805 7.892166 -2.649620      9.884566 
1 1 1 15  17 35 o 15.02570 5.457723 3.680203       2.581165 3.108173       3.581983 4.298067       3.722720 14.42522 6.048468 15.70665 6.328183 -1.281436      8.753848 
1 1 1 15  18 0  o 149.8537 3.113526 274.0661       11.36988 245.3503       21.13968 285.7541       13.48671 141.3175 6.153305 152.9716 3.617921 -11.65411      7.138103 
1 1 1 15  18 1  f 172.9292 2.964134 364.9267       12.49114 369.1696       19.66314 362.0560       16.17393 173.6767 4.650141 172.1569 3.855273 1.519791       6.040442 
1 1 1 15  18 2  o 192.1876 3.131546 450.8352       14.66629 432.7990       22.44890 464.2661       19.37211 188.0022 4.904189 194.9107 4.078544 -6.908493      6.378525 
1 1 1 15  18 3  o 89.29890 3.826617 97.60333       8.307859 111.8377       12.94550 87.63568       10.83292 95.36827 5.594879 84.42619 5.292030 10.94209       7.701185 
1 1 1 15  18 4  o 236.3770 3.960341 682.8445       22.81255 676.3615       31.96678 689.5726       32.56519 234.9040 5.584345 237.1744 5.634426 -2.270355      7.932949 
1 1 1 15  18 5  o 89.78659 2.642116 98.44809       5.774665 92.76435       7.913206 104.9230       8.446029 87.05358 3.738896 92.59154 3.750983 -5.537956      5.296151 
1 1 1 15  18 6  o 113.1261 3.353847 156.4307       9.235538 134.3896       15.99379 167.4567       11.31211 104.4048 6.315835 116.9743 3.974187 -12.56951      7.462166 
1 1 1 15  18 7  o 147.6975 4.824976 267.4202       17.34288 242.0439       22.31669 306.1134       27.55704 140.1435 6.552768 157.4617 7.200667 -17.31815      9.735932 
1 1 1 15  18 8  o 29.90203 8.504150 11.35700       6.490214 7.205627       7.790666 20.77286       11.73299 26.25669 9.489540 40.16308 11.43811 -13.90639      14.86209 
1 1 1 15  18 9  o 166.7859 5.096519 341.3927       20.68994 335.8853       27.45844 348.6270       31.47010 164.9584 6.845579 167.7723 7.718037 -2.813950      10.31649 
1 1 1 15  18 10 o 31.24674 7.082154 12.52067       5.267680 7.780979       7.414502 17.35124       7.485250 26.47751 9.290298 36.67742 8.535534 -10.19990      12.61606 
1 1 1 15  18 11 o 60.05792 5.186673 44.59951       7.516621 36.54190       9.618985 57.23651       12.04615 53.84356 7.537112 67.63290 7.431208 -13.78934      10.58447 
1 1 1 15  18 12 o 28.92337 7.797520 10.73122       5.620092 17.69267       8.083952 4.219118       7.818705 36.93370 9.053165 23.63406 9.284384 13.29964       12.96764 
1 1 1 15  18 13 o 154.4934 4.897217 293.3715       18.41393 303.5580       25.73357 282.6830       26.36018 156.5434 6.761678 150.8933 7.189412 5.650131       9.869546 
1 1 1 15  18 14 o 76.46794 4.395449 71.96404       8.156147 69.03291       12.28252 74.27601       10.90842 74.35699 6.855574 77.40334 5.825933 -3.046341      8.996687 
1 1 1 15  18 15 o 129.4218 4.735759 206.1842       14.91077 199.8715       20.42512 213.3872       21.81772 126.8042 6.632963 130.9425 6.861371 -4.138245      9.543302 
1 1 1 15  18 16 o 93.64795 4.750594 108.2051       10.80591 117.3547       14.97093 98.25387       15.61300 97.06669 6.364212 88.46805 7.307194 8.598640       9.690113 
1 1 1 15  18 17 o 26.24690 8.535276 8.489770       6.254446 13.41909       8.539328 2.785209       9.186312 32.25960 9.909295 23.78671 9.804991 8.472893       13.94030 
1 1 1 15  18 18 o 32.52676 7.826794 13.86687       6.128279 12.57827       8.008923 15.68708       9.518701 31.16970 9.600617 34.51254 10.43465 -3.342833      14.17935 
1 1 1 15  18 19 o 86.42657 4.804282 92.73920       10.07858 111.2389       14.29280 74.44275       14.21406 94.08332 6.269805 76.24625 7.757967 17.83707       9.974793 
1 1 1 15  18 20 o 34.84699 7.467968 16.01251       6.150978 17.39881       8.256843 14.28382       9.220274 35.84676 9.354536 32.72873 10.33542 3.118027       13.94017 
1 1 1 15  18 21 o 42.19394 8.996736 24.16011       8.967983 24.16011       8.967983 0.000000       0.000000 42.19394 8.996736 ?        ?        0.000000       8.996736 
1 1 1 15  18 22 o 29.89806 10.35186 11.81697       9.189059 0.000000       0.000000 11.81697       9.189059 ?        ?        29.89806 10.35186 0.000000       10.35186 
1 1 1 15  18 23 o 46.11449 9.628639 30.13391       10.47043 0.000000       0.000000 30.13391       10.47043 ?        ?        46.11449 9.628639 0.000000       9.628639 
1 1 1 15  18 24 o 43.54779 6.289128 25.08977       6.480980 16.66396       8.173779 39.35600       10.63583 33.78330 9.521799 53.16681 8.494863 -19.38350      12.76038 
1 1 1 15  18 25 o 61.33824 5.311094 48.87257       7.860588 56.19900       10.79880 40.61558       11.46411 64.39996 6.993171 52.74867 9.255930 11.65129       11.60072 
1 1 1 15  18 26 o 25.56855 8.049424 9.517483       5.596686 9.722892       7.906143 9.311160       7.923704 25.87998 9.527622 25.52105 9.511765 0.3589344      13.46288 
1 1 1 15  18 27 f 43.67426 6.334682 26.50734       6.545420 34.99998       9.248659 17.98539       9.264604 48.50725 8.110236 32.35763 10.37664 16.14962       13.17007 
1 1 1 15  18 28 o 37.40090 7.440101 21.06011       6.542360 17.72650       8.980124 24.83087       9.550811 31.16799 10.23319 37.37549 10.20255 -6.207506      14.45026 
1 1 1 15  18 29 o 17.44847 7.988916 0.1566236      7.647007 0.1566236      7.647007 0.000000       0.000000 17.44847 7.988916 ?        ?        0.000000       7.988916 
1 1 1 15  18 30 o 12.77359 6.097557 -4.106339      5.303131 0.3848552      7.597658 -8.373284      7.405551 17.11986 7.884169 13.63346 6.670695 3.486393       10.32755 
1 1 1 15  18 31 o 28.26763 8.477262 14.93722       6.301124 18.21094       9.259260 12.11339       8.599536 27.74196 10.29315 23.57149 9.574183 4.170473       14.05752 
1 1 1 15  18 32 o 16.61183 7.254629 3.445877       5.551760 0.7727883      8.025997 5.898356       7.687675 16.42754 7.741040 18.74555 8.345418 -2.318014      11.38287 
1 1 1 15  18 33 o 12.56803 5.212312 1.663863       2.617695 -11.83666      8.196315 3.197333       2.762364 12.47405 6.254353 14.70915 5.587024 -2.235096      8.386403 
1 1 1 15  18 34 o 8.481388 3.956291 -1.127505      2.007779 0.9114407      2.793288 -3.306964      2.887934 11.74529 5.137234 8.829179 4.285261 2.916116       6.689890 
1 1 1 15  18 35 o 9.797126 4.613648 -1.353928      2.842679 -1.569388      3.104325 -0.2349818     7.074384 10.06437 4.764112 14.06460 6.797654 -4.000233      8.300896 
1 1 1 15  19 0  o 322.6826 5.881866 1276.762       46.25161 1282.031       56.35352 1265.886       80.95834 322.8557 7.162695 318.9928 10.42867 3.862976       12.65153 
1 1 1 15  19 1  o 134.8699 3.040844 222.0191       9.994138 224.9525       19.16430 220.9234       11.71299 135.3220 5.825144 134.4446 3.578283 0.8774719      6.836403 
1 1 1 15  19 2  o 312.4271 4.996021 1195.070       38.03724 1224.455       53.62204 1165.307       53.96518 315.5274 6.973810 307.7193 7.196525 7.808136       10.02118 
1 1 1 15  19 3  o 58.36168 2.970353 41.68125       4.210574 45.64468       9.424095 40.69275       4.706446 60.61654 6.480297 57.62785 3.366041 2.988697       7.302361 
1 1 1 15  19 4  o 225.3609 3.481509 620.3622       19.11975 594.3998       29.04519 640.2154       25.39896 220.2068 5.412618 228.7357 4.556652 -8.528900      7.075275 
1 1 1 15  19 5  o 150.2986 2.771878 275.6937       10.15232 296.2856       15.95286 261.6775       13.16152 155.5878 4.211400 146.2890 3.694928 9.298782       5.602534 
1 1 1 15  19 6  o 76.69705 2.943866 71.91874       5.491939 61.86652       11.30449 75.02423       6.283257 70.60461 6.648509 78.30431 3.300182 -7.699699      7.422524 
1 1 1 15  19 7  o 15.60686 6.747635 -0.5545270     4.703806 -1.232421      6.610615 0.1406906      6.694551 18.15923 7.923603 19.21761 8.173436 -1.058378      11.38370 
1 1 1 15  19 8  o 86.14656 4.080321 90.99922       8.541464 106.8447       13.63854 80.77363       10.95617 93.02879 6.048889 80.91755 5.590594 12.11124       8.236734 
1 1 1 15  19 9  o 70.97953 4.302528 61.91045       7.407106 57.59936       11.31461 65.14369       9.798634 67.98645 6.925991 72.61165 5.580391 -4.625198      8.894387 
1 1 1 15  19 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 15  19 11 o 119.2082 4.032505 174.2030       11.69745 198.0947       19.35943 160.4648       14.68029 126.5930 6.295227 114.1530 5.291692 12.44000       8.223861 
1 1 1 15  19 12 o 41.13826 6.773169 21.45270       6.553964 24.16026       8.569142 17.63650       10.17335 43.33447 8.418068 36.92786 10.69314 6.406612       13.60908 
1 1 1 15  19 13 f 50.39453 5.381186 31.60714       6.506276 37.77267       9.656076 26.48033       8.805203 54.66950 7.440976 45.41098 8.261105 9.258514       11.11818 
1 1 1 15  19 14 o 149.9584 4.876323 276.8968       17.79597 280.6771       24.69677 272.8140       25.66578 150.2583 6.762070 147.9662 7.139031 2.292145       9.833177 
1 1 1 15  19 15 o 41.10631 6.936284 21.56904       6.701164 34.52464       9.789986 10.14777       9.192009 51.94461 7.989620 29.55727 10.34612 22.38734       13.07196 
1 1 1 15  19 16 o 66.52544 5.185805 54.97626       8.340609 50.61771       11.20125 60.40012       12.49539 63.18263 7.415998 69.04107 7.549808 -5.858440      10.58285 
1 1 1 15  19 17 o 97.67259 4.769895 118.0555       11.31885 104.4372       14.97615 136.1978       17.28564 91.12646 6.792899 104.0980 6.852180 -12.97156      9.648619 
1 1 1 15  19 18 o 107.5893 4.762238 143.4890       12.45487 132.0352       16.54263 158.4783       18.92433 102.3594 6.668241 112.0113 6.967524 -9.651901      9.644264 
1 1 1 15  19 19 o 28.37148 8.102285 10.61271       5.879299 18.55055       7.855247 0.5024214      8.865237 37.17667 8.806891 21.68496 9.318411 15.49171       12.82163 
1 1 1 15  19 20 o 45.56734 9.054215 28.05376       9.699649 0.000000       0.000000 28.05376       9.699649 ?        ?        45.56734 9.054215 0.000000       9.054215 
1 1 1 15  19 21 o 44.77665 9.654397 27.82579       10.22410 0.000000       0.000000 27.82579       10.22410 ?        ?        44.77665 9.654397 0.000000       9.654397 
1 1 1 15  19 22 o 51.30781 5.709922 33.86806       7.018399 30.58635       8.923099 39.19185       11.36517 47.57508 7.978843 53.25933 9.082276 -5.684254      12.08924 
1 1 1 15  19 23 o 57.42795 5.481963 42.50760       7.578783 57.30022       10.39523 25.72353       11.07287 66.01217 6.548331 41.30841 10.85881 24.70376       12.68047 
1 1 1 15  19 24 o 47.20188 6.279759 29.66986       7.044301 39.14040       9.502606 18.11679       10.49553 53.39499 7.510362 34.01840 11.05627 19.37659       13.36588 
1 1 1 15  19 25 o 18.23626 7.624430 2.243403       5.666968 -1.305804      7.277101 7.712308       9.033227 17.67389 7.973694 24.80941 9.904739 -7.135523      12.71549 
1 1 1 15  19 26 o 18.09378 7.362947 3.045427       5.097136 11.68738       7.023220 -6.572336      7.409132 27.41373 9.052144 15.16724 7.231053 12.24649       11.58574 
1 1 1 15  19 27 o 34.76459 9.793730 20.67186       8.649435 20.67186       8.649435 0.000000       0.000000 34.76459 9.793730 ?        ?        0.000000       9.793730 
1 1 1 15  19 28 o 36.12308 7.875962 20.60122       6.737111 27.47881       9.406431 13.35712       9.653813 39.26674 9.848674 26.43546 10.33678 12.83128       14.27744 
1 1 1 15  19 29 o 22.04184 8.151729 8.071254       5.798871 6.514213       8.315896 9.545010       8.090433 21.04284 9.033507 23.08372 9.318847 -2.040878      12.97864 
1 1 1 15  19 30 o 19.55581 7.924955 6.012706       5.876458 7.259398       8.289819 4.753456       8.331470 20.79628 8.974389 19.37933 8.653728 1.416945       12.46702 
1 1 1 15  19 31 f 23.56696 8.419708 11.02271       6.113077 22.99518       9.790077 3.371559       7.826319 30.02361 10.66275 17.79391 8.122383 12.22970       13.40400 
1 1 1 15  19 32 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 15  19 33 f 15.77753 7.144398 3.197950       5.905785 3.149318       9.090364 3.233467       7.768605 16.64297 7.955193 16.36133 7.680398 0.2816448      11.05774 
1 1 1 15  19 34 o 12.72053 6.074191 -1.272709      5.271533 -6.640321      7.637971 3.609880       7.284715 12.73606 6.330660 15.85969 7.442516 -3.123630      9.770788 
1 1 1 15  20 0  o 30.07613 5.295285 11.40516       3.739343 7.629725       4.475102 20.13979       6.806776 24.62536 7.080386 39.84410 7.278497 -15.21874      10.15423 
1 1 1 15  20 1  o 103.5732 3.058575 131.0683       7.711286 143.0444       10.43836 116.6801       11.44133 108.1068 3.968999 97.51032 4.829962 10.59646       6.251519 
1 1 1 15  20 2  o 112.5060 2.844460 154.5827       7.792253 155.7359       14.81301 154.1415       9.162408 112.5860 5.414997 112.2948 3.351971 0.2911606      6.368509 
1 1 1 15  20 3  o 156.7402 2.852464 299.8663       10.89524 291.0955       16.64934 306.4353       14.40878 154.1768 4.436020 158.3489 3.734015 -4.172073      5.798374 
1 1 1 15  20 4  o 97.93626 2.519090 117.1107       6.007070 133.0686       9.525929 106.5754       7.740008 104.2728 3.755000 93.34130 3.408485 10.93148       5.071272 
1 1 1 15  20 5  o 37.16968 2.881903 16.96712       2.590005 16.18299       3.913448 17.57827       3.454900 36.07572 4.552711 37.72906 3.809848 -1.653343      5.936507 
1 1 1 15  20 6  o 175.0675 2.983233 374.2499       12.72708 367.4920       19.15459 379.5917       17.02980 173.1731 4.542882 176.1655 3.966913 -2.992401      6.031101 
1 1 1 15  20 7  o 93.69676 4.029188 107.6125       9.178296 91.48280       13.38934 121.9106       12.60618 85.95776 6.438805 99.54454 5.214915 -13.58678      8.285744 
1 1 1 15  20 8  o 111.1662 3.961606 151.4124       10.71482 124.4225       15.23961 177.7977       15.06795 100.3242 6.264765 120.2524 5.153860 -19.92816      8.112309 
1 1 1 15  20 9  o 114.3316 3.985693 160.2047       11.08770 191.7774       18.52454 142.5794       13.84072 124.6302 6.118112 107.6064 5.294438 17.02374       8.090882 
1 1 1 15  20 10 f 64.30471 4.594867 50.96728       7.152872 54.09510       10.81797 48.53760       9.534531 65.81493 6.844927 62.41468 6.357333 3.400242       9.341772 
1 1 1 15  20 11 o 100.3831 5.065346 124.1361       12.35095 141.8516       16.39781 100.9078       18.77662 107.0101 6.316269 89.48576 8.721004 17.52438       10.76806 
1 1 1 15  20 12 o 103.8515 4.108978 132.4317       10.37827 143.0502       16.39306 125.3289       13.40724 107.3962 6.291311 100.7188 5.483194 6.677361       8.345419 
1 1 1 15  20 13 o 62.71982 5.306814 48.81501       8.034955 37.94786       10.33105 65.45212       12.78279 54.56628 8.007442 72.14587 7.374348 -17.57959      10.88578 
1 1 1 15  20 14 o 53.32248 5.299247 35.41635       6.794867 49.91545       10.04189 23.17134       9.228359 63.05156 6.634892 42.03487 9.259578 21.01669       11.39129 
1 1 1 15  20 15 o 72.07639 4.984909 64.39808       8.701671 58.97784       11.54791 71.51900       13.23616 68.37980 7.030138 75.26576 7.308428 -6.885963      10.14081 
1 1 1 15  20 16 o 61.58501 5.298640 47.30237       7.874750 37.97201       10.46116 59.50269       11.96235 54.24117 8.167485 68.47485 7.280317 -14.23368      10.94124 
1 1 1 15  20 17 o 12.27609 5.938167 -8.526104      5.426562 -8.119108      7.432405 -8.990767      7.941503 15.59898 7.380322 15.98049 7.580803 -0.3815088     10.58006 
1 1 1 15  20 18 o 117.8557 6.977431 176.4268       19.94960 0.000000       0.000000 176.4268       19.94960 ?        ?        117.8557 6.977431 0.000000       6.977431 
1 1 1 15  20 19 o 64.07523 5.252180 51.64510       8.129071 47.87385       10.73409 56.71667       12.44783 60.75008 7.403461 65.91853 7.906670 -5.168453      10.83174 
1 1 1 15  20 20 o 13.91190 6.437918 -3.796300      5.155371 -5.361127      6.711933 -1.544821      8.050972 15.55657 7.248949 19.31051 8.571903 -3.753940      11.22608 
1 1 1 15  20 21 o 22.62508 7.851814 6.338345       5.287942 5.309243       6.767765 7.951329       8.472878 22.62794 8.707716 26.05867 9.810216 -3.430729      13.11734 
1 1 1 15  20 22 o 14.34785 6.537338 -2.474288      5.040071 -3.329082      6.389320 -1.066234      8.200371 15.89704 7.287502 19.38556 8.625457 -3.488527      11.29186 
1 1 1 15  20 23 o 59.62735 5.404263 46.06195       7.767494 46.01857       10.26910 46.11996       11.87481 58.13549 7.417313 57.01544 8.832088 1.120045       11.53353 
1 1 1 15  20 24 o 31.77984 7.936751 14.58475       6.127777 11.44630       7.732487 19.88326       10.04704 27.79168 9.500848 35.14901 10.73946 -7.357327      14.33883 
1 1 1 15  20 25 o 22.65087 8.836199 6.583050       7.040921 6.583050       7.040921 0.000000       0.000000 22.65087 8.836199 ?        ?        0.000000       8.836199 
1 1 1 15  20 26 o 22.66564 8.919235 7.131336       7.226558 7.131336       7.226558 0.000000       0.000000 22.66564 8.919235 ?        ?        0.000000       8.919235 
1 1 1 15  20 27 o 18.28861 7.550259 3.596879       5.458375 3.838721       7.166744 3.262807       8.423190 19.59472 8.398520 19.98708 8.825047 -0.3923588     12.18264 
1 1 1 15  20 28 o 21.33257 7.851307 7.196512       5.368205 9.023091       7.380399 5.144573       7.822449 22.96833 9.021136 20.24371 8.726710 2.724615       12.55135 
1 1 1 15  20 29 o 13.98229 6.469102 -1.352523      5.201303 -7.186555      6.940520 6.121517       7.855707 13.47129 6.562106 20.29892 8.747833 -6.827624      10.93553 
1 1 1 15  20 30 o 34.32555 8.106121 20.83826       6.671505 19.38963       9.458299 22.27267       9.411740 28.21488 10.41508 30.72483 10.48236 -2.509951      14.77680 
1 1 1 15  20 31 o 18.48825 7.668672 5.918494       5.667402 9.143005       8.660474 3.503405       7.495080 20.45282 8.992715 17.35473 7.932078 3.098089       11.99111 
1 1 1 15  20 32 o 14.00841 6.525137 0.1710355      5.430497 -1.224362      8.555335 1.112624       7.027788 15.31400 7.419230 15.43069 7.262758 -0.1166945     10.38232 
1 1 1 15  20 33 o 16.72623 7.801252 4.709639       7.802742 0.000000       0.000000 4.709639       7.802742 ?        ?        16.72623 7.801252 0.000000       7.801252 
1 1 1 15  20 34 o 15.57272 7.027732 3.982194       5.657527 4.668208       8.989077 3.532204       7.280313 16.30788 7.825782 15.65550 7.375832 0.6523781      10.75387 
1 1 1 15  21 0  o 311.8912 4.953791 1191.547       37.65103 1196.640       74.66734 1189.810       43.59991 309.9711 9.897612 311.3802 5.745906 -1.409027      11.44457 
1 1 1 15  21 1  o 75.74670 2.618793 70.09853       4.826666 72.77041       7.412767 68.13198       6.359517 77.04678 3.961415 74.59435 3.508332 2.452423       5.291616 
1 1 1 15  21 2  o 31.96443 3.762727 12.66017       2.874851 13.82413       4.663345 11.94665       3.651197 33.04707 6.012074 30.83251 5.032952 2.214563       7.840640 
1 1 1 15  21 3  o 76.76363 2.798559 72.02661       5.226351 73.58752       9.753562 71.39792       6.190017 77.29483 5.208586 76.37669 3.333821 0.9181366      6.184152 
1 1 1 15  21 4  o 170.1444 2.971189 353.4957       12.31924 343.2383       18.74061 361.3007       16.34762 167.3424 4.599957 171.8774 3.903009 -4.535034      6.032667 
1 1 1 15  21 5  o 111.1001 2.538519 150.6451       6.872760 159.4102       10.52561 144.1308       9.074197 114.1082 3.790509 108.5430 3.434926 5.565247       5.115337 
1 1 1 15  21 6  o 120.0239 3.023650 176.0730       8.836688 144.1626       16.71819 188.4447       10.40968 107.9955 6.380980 124.1150 3.445065 -16.11945      7.251578 
1 1 1 15  21 7  o 197.6797 5.648411 480.8678       27.18184 0.000000       0.000000 480.8678       27.18184 ?        ?        197.6797 5.648411 0.000000       5.648411 
1 1 1 15  21 8  o 42.69017 5.686403 22.80435       5.768651 22.94431       8.325478 22.67511       8.000435 42.24538 8.383075 42.05115 8.101088 0.1942253      11.65777 
1 1 1 15  21 9  o 243.1781 5.027917 726.3658       29.79537 695.1160       48.56041 745.2338       37.73296 236.0229 8.456576 245.6734 6.307918 -9.650513      10.55005 
1 1 1 15  21 10 o 108.5895 3.989193 144.6615       10.53829 132.6099       15.62723 154.7129       14.27164 103.4492 6.227800 112.0303 5.242132 -8.581192      8.140359 
1 1 1 15  21 11 o 167.8397 4.281309 345.8663       17.49656 338.8900       28.40033 350.1337       22.21244 165.0552 7.077312 168.4894 5.416919 -3.434158      8.912428 
1 1 1 15  21 12 f 70.04633 5.688285 60.97560       9.626142 69.98943       11.64870 41.56466       17.09410 74.87746 6.446663 55.49978 12.88706 19.37767       14.40957 
1 1 1 15  21 13 o 69.00115 4.648689 58.85336       7.771073 68.77692       11.81365 51.28409       10.31756 74.10345 6.611348 63.87555 6.729355 10.22790       9.433671 
1 1 1 15  21 14 o 78.73856 4.869198 76.76257       9.297176 74.03010       12.54013 80.09775       13.85426 76.75014 6.774282 79.69771 7.211438 -2.947563      9.894227 
1 1 1 15  21 15 o 73.86959 7.368692 69.26019       13.08776 0.000000       0.000000 69.26019       13.08776 ?        ?        73.86959 7.368692 0.000000       7.368692 
1 1 1 15  21 16 o 59.73314 8.159368 46.18413       11.56689 0.000000       0.000000 46.18413       11.56689 ?        ?        59.73314 8.159368 0.000000       8.159368 
1 1 1 15  21 17 o 60.74921 5.113890 46.22339       7.500334 44.49539       10.32362 48.15512       10.91524 58.75039 7.372762 61.09866 7.487348 -2.348267      10.50800 
1 1 1 15  21 18 f 54.03651 5.482909 36.92890       7.120112 39.54599       9.813420 34.01979       10.34643 55.09987 7.503356 50.47928 8.726462 4.620586       11.50876 
1 1 1 15  21 19 o 94.14264 4.710198 110.9011       10.77159 109.9386       14.46452 112.0994       16.13940 92.68408 6.444306 93.06982 7.171373 -0.3857346     9.641456 
1 1 1 15  21 20 o 55.46197 5.590019 39.36702       7.452207 35.75854       9.861751 44.17057       11.37819 51.51085 8.125334 57.15443 8.421460 -5.643578      11.70222 
1 1 1 15  21 21 o 32.56330 7.727540 14.61574       6.039375 10.72702       8.139753 19.37833       9.008030 28.09190 9.742046 36.50115 9.885375 -8.409250      13.87905 
1 1 1 15  21 22 o 61.76336 5.252820 49.17435       7.831113 46.05468       10.38128 53.29362       11.92907 58.16861 7.497832 62.12774 8.069745 -3.959129      11.01537 
1 1 1 15  21 23 o 25.59410 9.102674 9.164766       7.137199 9.164766       7.137199 0.000000       0.000000 25.59410 9.102674 ?        ?        0.000000       9.102674 
1 1 1 15  21 24 o 66.70683 6.852031 61.48850       10.98029 61.48850       10.98029 0.000000       0.000000 66.70683 6.852031 ?        ?        0.000000       6.852031 
1 1 1 15  21 25 o 39.34811 6.763298 22.00915       6.251438 31.80861       8.986590 12.82049       8.702012 45.85425 8.349805 27.78404 10.03088 18.07020       13.05136 
1 1 1 15  21 26 o 14.22340 6.472259 -1.209240      4.920096 -1.944543      6.381060 -0.1311595     7.726543 15.59755 7.198282 17.83682 8.114277 -2.239272      10.84697 
1 1 1 15  21 27 o 26.91769 7.961816 11.90224       5.588259 8.342236       7.463469 16.44465       8.430594 22.60887 9.010766 29.34751 9.922117 -6.738640      13.40307 
1 1 1 15  21 28 o 15.71981 6.997731 0.9701370      5.403948 -3.713034      7.443389 6.189748       7.858140 15.29811 7.280581 20.56750 8.804432 -5.269386      11.42475 
1 1 1 15  21 29 o 20.43333 7.961737 7.115172       5.710894 14.96597       8.868180 1.552568       7.464773 25.79380 9.956782 17.21578 7.886414 8.578020       12.70169 
1 1 1 15  21 30 o 15.04806 6.875143 0.7511753      5.623638 -8.153158      8.016386 9.379453       7.891143 13.65931 6.734191 21.10043 8.919645 -7.441117      11.17629 
1 1 1 15  21 31 o 20.68606 8.113836 9.030622       5.963634 11.49793       9.204628 7.245649       7.829072 20.93206 9.234533 18.90827 8.419592 2.023798       12.49664 
1 1 1 15  21 32 o 20.03127 8.805014 10.81357       8.297626 0.000000       0.000000 10.81357       8.297626 ?        ?        20.03127 8.805014 0.000000       8.805014 
1 1 1 15  21 33 o 15.75741 7.151705 3.894507       5.959188 4.265759       9.070237 3.612543       7.904622 16.42188 7.875365 16.01307 7.586559 0.4088154      10.93514 
1 1 1 15  22 0  o 29.35841 4.510852 10.79434       3.124125 13.70106       4.791274 8.644463       4.120555 32.85540 6.211747 26.00114 6.516721 6.854263       9.002969 
1 1 1 15  22 1  o 204.8277 3.782255 512.9830       18.87885 480.4415       24.85161 557.3877       29.03024 197.8618 5.158543 212.9948 5.597861 -15.13301      7.612267 
1 1 1 15  22 2  o 123.4520 2.689356 186.0361       8.090634 192.8221       12.56474 181.2296       10.57466 125.4631 4.115185 121.7103 3.569212 3.752769       5.447387 
1 1 1 15  22 3  o 36.64370 3.331211 16.54288       2.942183 18.23312       4.669042 15.42967       3.789149 38.21463 5.144283 35.20738 4.520626 3.007248       6.848336 
1 1 1 15  22 4  o 103.1827 3.428624 130.2854       8.609133 0.000000       0.000000 130.2854       8.609133 ?        ?        103.1827 3.428624 0.000000       3.428624 
1 1 1 15  22 5  o 160.9617 2.882913 316.4320       11.30812 307.4297       17.07086 323.4709       15.09498 158.3401 4.428483 162.5986 3.809603 -4.258438      5.841621 
1 1 1 15  22 6  o 136.1381 3.141628 226.4862       10.42247 241.7687       21.66418 221.8838       11.88871 139.8791 6.372287 134.6339 3.626935 5.245224       7.332169 
1 1 1 15  22 7  o 108.8282 4.553029 145.4988       12.04807 156.4616       16.88097 134.1170       17.20061 112.4794 6.182469 103.9402 6.828678 8.539223       9.211610 
1 1 1 15  22 8  o 125.9355 4.002879 194.4853       12.26887 219.4833       20.25090 179.9891       15.42122 133.1915 6.256732 120.8662 5.248245 12.32529       8.166441 
1 1 1 15  22 9  o 35.39847 6.512563 15.97511       5.410929 13.15700       7.575099 18.91096       7.731724 31.97925 9.217194 38.16996 8.527505 -6.190708      12.55687 
1 1 1 15  22 10 o 101.4253 4.546247 126.6273       11.20805 113.1849       14.55526 146.2092       17.56741 95.42897 6.294125 108.3822 6.683926 -12.95322      9.181006 
1 1 1 15  22 11 o 28.55654 8.125661 10.49188       5.923843 15.14887       7.882027 4.446898       8.980134 34.05545 9.256994 24.82043 9.886699 9.235012       13.54396 
1 1 1 15  22 12 o 96.02352 6.968135 115.5579       16.19442 0.000000       0.000000 115.5579       16.19442 ?        ?        96.02352 6.968135 0.000000       6.968135 
1 1 1 15  22 13 o 52.42048 13.61699 38.18665       17.54907 0.000000       0.000000 38.18665       17.54907 ?        ?        52.42048 13.61699 0.000000       13.61699 
1 1 1 15  22 14 o 72.84657 4.512519 65.71607       7.971259 66.06332       11.62916 65.40833       10.94780 72.36034 6.669961 72.13364 6.290934 0.2266998      9.168654 
1 1 1 15  22 15 o 64.32048 5.190187 51.69292       8.066175 57.20874       11.56371 46.46577       11.25706 66.94851 7.201027 59.98801 7.891824 6.960503       10.68343 
1 1 1 15  22 16 o 19.54471 7.817495 2.743662       5.637836 -0.8182850E-01 7.785532 5.858852       8.174923 20.06752 8.678620 24.73116 9.556185 -4.663637      12.90888 
1 1 1 15  22 17 o 72.45872 4.836089 65.67162       8.490394 63.77534       11.35636 68.07487       12.78459 70.58142 6.682133 72.59496 7.326926 -2.013542      9.916389 
1 1 1 15  22 18 o 15.28342 6.790858 -1.365161      5.065223 -3.790817      6.718010 1.830383       7.710783 16.34421 7.485055 20.99654 8.843287 -4.652330      11.58576 
1 1 1 15  22 19 o 26.28963 7.828588 9.302732       5.388259 10.00595       7.187311 8.400301       8.141965 27.42435 9.160460 26.28098 9.669797 1.143377       13.31987 
1 1 1 15  22 20 f 31.63865 7.166079 13.61674       5.396389 16.59704       7.153533 9.681084       8.220525 34.36761 8.570950 27.16630 9.756893 7.201315       12.98685 
1 1 1 15  22 21 o 56.12656 6.866434 42.16561       9.196167 42.16561       9.196167 0.000000       0.000000 56.12656 6.866434 ?        ?        0.000000       6.866434 
1 1 1 15  22 22 f 21.29589 8.574224 4.512748       6.829212 4.512748       6.829212 0.000000       0.000000 21.29589 8.574224 ?        ?        0.000000       8.574224 
1 1 1 15  22 23 o 14.42454 6.549864 -1.730043      5.005676 -3.274325      6.406825 0.6897997      8.019977 15.49844 7.173790 19.40079 8.586588 -3.902348      11.18896 
1 1 1 15  22 24 o 18.50495 7.501786 3.431650       5.267809 3.340667       6.928990 3.556262       8.109023 19.77779 8.359251 20.77204 8.918898 -0.9942474     12.22390 
1 1 1 15  22 25 o 40.69664 6.527795 23.71556       6.255031 20.85933       8.310701 27.44778       9.500012 35.10748 9.489563 40.18489 9.792254 -5.077419      13.63598 
1 1 1 15  22 26 o 17.86873 7.445158 3.363275       5.376291 4.961860       7.354385 1.528414       7.879160 20.22210 8.582396 18.47226 8.318707 1.749846       11.95234 
1 1 1 15  22 27 f 15.74517 6.935278 1.201831       5.172386 5.685081       7.484414 -2.896980      7.156329 20.30216 8.638703 15.45844 7.292098 4.843720       11.30495 
1 1 1 15  22 28 o 18.98277 7.706398 5.379840       5.568198 7.504156       8.300580 3.641764       7.508155 21.01614 9.023665 18.50705 8.242812 2.509083       12.22172 
1 1 1 15  22 29 o 17.76385 7.604337 4.419370       5.862025 0.8006650      8.796249 7.310530       7.862435 17.18321 8.099236 20.06749 8.699893 -2.884275      11.88637 
1 1 1 15  22 30 o 16.03064 7.616193 0.2507355      8.076092 0.000000       0.000000 0.2507355      8.076092 ?        ?        16.03064 7.616193 0.000000       7.616193 
1 1 1 15  22 31 o 12.09813 5.929012 -5.419416      5.921966 -9.479251      9.072350 -2.405369      7.817010 13.49344 6.737695 14.50934 7.044024 -1.015897      9.747554 
1 1 1 15  22 32 o 18.19970 7.795696 7.324353       6.167701 4.250378       9.529104 9.540583       8.091134 16.72290 8.033406 18.96893 8.495060 -2.246025      11.69195 
1 1 1 15  23 0  o 296.5888 4.272136 1077.027       30.87706 1055.763       47.86730 1092.181       40.40781 292.6058 6.713050 298.1663 5.561228 -5.560455      8.717356 
1 1 1 15  23 1  o 37.14991 4.792284 17.19603       4.237504 19.26542       5.121857 12.70661       7.543996 39.22846 5.509481 31.60879 9.224277 7.619669       10.74438 
1 1 1 15  23 2  o 56.44236 2.870870 39.00635       3.935736 45.29902       6.071961 34.44697       5.168499 60.68975 4.130219 52.89751 4.040094 7.792244       5.777636 
1 1 1 15  23 3  o 162.8318 2.957889 323.8816       11.73700 344.6635       18.61498 310.1681       15.12153 167.6213 4.561433 159.1987 3.897804 8.422546       5.999962 
1 1 1 15  23 4  o 141.1098 2.781964 243.1855       9.566319 252.8375       14.90117 236.4185       12.47698 143.5945 4.263122 138.9614 3.687764 4.633072       5.636827 
1 1 1 15  23 5  o 176.7353 3.378491 381.9718       14.55064 362.6466       26.23306 390.5594       17.48724 171.3291 6.293909 178.5766 4.018469 -7.247437      7.467355 
1 1 1 15  23 6  o 118.4424 2.729092 171.3665       7.877009 174.7258       11.14419 168.0125       11.13536 119.3891 3.835406 117.0570 3.909134 2.332146       5.476465 
1 1 1 15  23 7  o 132.5354 6.892704 218.3061       22.18517 0.000000       0.000000 218.3061       22.18517 ?        ?        132.5354 6.892704 0.000000       6.892704 
1 1 1 15  23 8  o 172.6767 7.453329 371.8761       31.28931 0.000000       0.000000 371.8761       31.28931 ?        ?        172.6767 7.453329 0.000000       7.453329 
1 1 1 15  23 9  o 236.1948 8.731191 702.6629       50.16856 0.000000       0.000000 702.6629       50.16856 ?        ?        236.1948 8.731191 0.000000       8.731191 
1 1 1 15  23 10 o 21.87211 8.630407 3.606885       6.782464 0.000000       0.000000 3.606885       6.782464 ?        ?        21.87211 8.630407 0.000000       8.630407 
1 1 1 15  23 11 o 83.28138 4.250220 85.51241       8.597198 91.14225       13.03961 81.18331       11.43445 85.39587 6.310605 80.71462 5.853124 4.681252       8.607136 
1 1 1 15  23 12 o 115.1210 4.610715 163.7159       12.90860 168.0449       17.62105 158.7018       18.96387 115.9743 6.258142 112.3659 6.959744 3.608429       9.359614 
1 1 1 15  23 13 o 17.82149 7.195461 1.932270       4.824244 4.707743       6.696063 -1.063217      6.956405 22.59749 8.670326 18.50574 8.100303 4.091753       11.86547 
1 1 1 15  23 14 o 22.96145 8.230181 5.923377       5.845955 7.874910       6.564343 -1.557384      12.85216 25.51945 8.752973 24.72375 10.90940 0.7956944      13.98676 
1 1 1 15  23 15 o 30.35189 7.174883 12.15895       5.222527 10.21519       6.918720 14.73329       7.962273 28.07287 8.963520 33.04382 9.426463 -4.970947      13.00780 
1 1 1 15  23 16 o 58.75327 5.421052 43.60295       7.674136 44.99876       10.44237 41.96384       11.31592 58.80126 7.454766 56.22084 8.526752 2.580425       11.32603 
1 1 1 15  23 17 o 45.33860 5.788538 26.37218       6.249815 20.16033       7.892939 36.81341       10.23302 38.41198 8.641834 52.45902 8.279021 -14.04705      11.96760 
1 1 1 15  23 18 o 65.04730 5.163695 53.69372       8.118018 66.78714       11.54075 40.86969       11.42141 71.66357 6.685587 54.61037 8.887740 17.05320       11.12156 
1 1 1 15  23 19 f 22.72646 8.841080 5.412333       7.033144 5.412333       7.033144 0.000000       0.000000 22.72646 8.841080 ?        ?        0.000000       8.841080 
1 1 1 15  23 20 o 20.05864 8.180438 3.242932       6.308388 3.242932       6.308388 0.000000       0.000000 20.05864 8.180438 ?        ?        0.000000       8.180438 
1 1 1 15  23 21 o 33.71043 7.302218 15.91045       5.824855 21.10666       7.617760 8.595418       9.038407 38.21828 8.408166 25.77644 10.02394 12.44184       13.08345 
1 1 1 15  23 22 o 11.57591 5.614526 -7.151515      4.935139 -7.361259      6.000420 -6.713000      8.676178 13.13653 6.326963 16.72279 7.930240 -3.586258      10.14491 
1 1 1 15  23 23 o 19.22167 7.716455 3.963018       5.513897 14.46107       7.842892 -6.297179      7.753533 29.82965 9.545429 15.61245 7.430330 14.21719       12.09649 
1 1 1 15  23 24 o 22.03804 7.866818 7.163952       5.335457 1.096582       6.902434 16.17084       8.409871 17.94012 7.951696 30.40576 9.898011 -12.46564      12.69646 
1 1 1 15  23 25 o 24.98913 8.290068 10.26403       5.888462 12.11087       8.011656 8.094202       8.684007 26.01062 9.588342 22.86775 9.489600 3.142866       13.49032 
1 1 1 15  23 26 o 20.33863 7.979334 6.204533       5.768644 5.864109       8.079574 6.558519       8.238952 20.74283 8.904462 21.22775 9.049150 -0.4849243     12.69553 
1 1 1 15  23 27 o 20.13940 7.966981 6.479946       5.793215 8.656867       8.521118 4.608912       7.899801 21.94295 9.271982 19.36124 8.547692 2.581709       12.61082 
1 1 1 15  23 28 o 17.68163 7.574212 4.136379       5.822822 0.4544089      8.727472 7.090182       7.816983 17.18246 8.089195 20.14340 8.703752 -2.960939      11.88236 
1 1 1 15  23 29 o 16.97254 7.949644 1.955243       8.244441 0.000000       0.000000 1.955243       8.244441 ?        ?        16.97254 7.949644 0.000000       7.949644 
1 1 1 15  23 30 o 13.80573 6.516517 -0.8636968     5.731238 -7.701915      8.519064 4.790231       7.746321 13.65081 6.768231 17.46966 8.014266 -3.818850      10.48987 
1 1 1 15  23 31 o 12.07412 5.890996 -4.338153      5.657288 -2.217778      8.497864 -6.025902      7.581541 14.68367 7.176266 13.12078 6.483659 1.562885       9.671434 
1 1 1 15  24 0  f 35.65628 4.749730 15.86375       4.024505 15.35273       6.542276 16.17485       5.104601 34.50565 7.944774 35.76013 6.074797 -1.254482      10.00113 
1 1 1 15  24 1  o 125.5118 3.407888 192.7690       10.41367 217.6318       18.55478 181.3362       12.58216 132.8549 5.744730 121.5839 4.253168 11.27101       7.147821 
1 1 1 15  24 2  o 47.02113 5.313872 27.51934       5.982358 32.59756       7.579340 19.12780       9.743093 51.04520 6.221504 38.31208 10.23961 12.73312       11.98151 
1 1 1 15  24 3  o 119.8551 4.091159 176.2207       11.93169 0.000000       0.000000 176.2207       11.93169 ?        ?        119.8551 4.091159 0.000000       4.091159 
1 1 1 15  24 4  o 59.43453 3.121968 43.30740       4.505860 46.39886       7.561305 41.60509       5.610927 61.21912 5.115142 58.13738 3.984527 3.081734       6.483913 
1 1 1 15  24 5  o 102.6186 3.456061 129.0262       8.630252 0.000000       0.000000 129.0262       8.630252 ?        ?        102.6186 3.456061 0.000000       3.456061 
1 1 1 15  24 6  o 124.7665 2.929341 190.3179       8.906440 207.6098       16.00711 182.5641       10.71888 129.7762 5.071291 122.0390 3.608211 7.737198       6.223920 
1 1 1 15  24 7  o 94.14791 2.505641 108.3657       5.743537 78.92222       12.93128 115.6017       6.410568 79.44734 6.742858 97.21537 2.708625 -17.76803      7.266553 
1 1 1 15  24 8  o 87.74198 4.165063 94.76225       8.880216 118.2159       14.13750 79.47835       11.41259 97.52481 5.977407 79.91776 5.901735 17.60706       8.399993 
1 1 1 15  24 9  o 152.9104 4.879626 288.6001       18.15947 292.8206       24.98632 283.8750       26.43785 153.1540 6.711097 150.5033 7.229628 2.650742       9.864398 
1 1 1 15  24 10 o 169.4792 5.079880 355.3220       20.95634 356.6070       28.82531 353.8814       30.52080 168.6320 7.029938 167.6657 7.488811 0.9662933      10.27143 
1 1 1 15  24 11 o 69.82178 4.490638 60.38147       7.600221 54.92248       10.89297 65.55987       10.60932 65.84910 6.890165 72.29129 6.078592 -6.442192      9.188234 
1 1 1 15  24 12 o 75.03945 4.445274 69.79538       8.092339 80.52953       12.31889 61.64721       10.73292 79.93008 6.377338 69.87459 6.373302 10.05550       9.016065 
1 1 1 15  24 13 o 76.42801 4.841773 72.77127       8.971289 67.78694       11.75766 79.71673       13.87930 73.03172 6.680439 78.93832 7.297706 -5.906609      9.893673 
1 1 1 15  24 14 o 48.66619 5.369443 29.93296       6.262115 32.13840       8.932731 27.80173       8.781150 49.59059 7.636486 45.84174 8.159705 3.748856       11.17572 
1 1 1 15  24 15 o 83.24889 4.301029 86.26484       8.695848 86.45875       12.55915 86.08627       12.05209 82.35738 6.305759 82.32224 6.049967 0.3513336E-01  8.738689 
1 1 1 15  24 16 o 41.53992 6.292384 22.43243       6.170438 26.12787       8.085275 17.27803       9.548836 44.21803 7.787782 34.96104 10.42422 9.256985       13.01207 
1 1 1 15  24 17 o 37.09099 8.383875 18.97761       7.399153 18.97761       7.399153 0.000000       0.000000 37.09099 8.383875 ?        ?        0.000000       8.383875 
1 1 1 15  24 18 o 64.41251 7.266674 55.33710       11.20737 55.33710       11.20737 0.000000       0.000000 64.41251 7.266674 ?        ?        0.000000       7.266674 
1 1 1 15  24 19 o 30.10732 8.083023 12.82850       6.054461 9.922235       8.253775 16.21393       8.908232 27.00293 9.766391 32.91283 10.12311 -5.909899      14.06626 
1 1 1 15  24 20 o 32.71449 7.767665 15.25311       6.099607 18.66455       8.376551 11.40245       8.899472 35.08793 9.545191 27.98580 10.13853 7.102133       13.92482 
1 1 1 15  24 21 o 22.66635 8.129424 6.986878       5.704652 10.46923       7.628874 2.569842       8.591905 26.53415 9.413619 20.99894 9.099149 5.535215       13.09239 
1 1 1 15  24 22 o 14.74277 6.638807 -1.040437      5.017385 -5.743349      6.688171 5.013094       7.588018 14.56362 6.922565 21.48444 8.888976 -6.920818      11.26658 
1 1 1 15  24 23 o 12.15353 5.785140 -4.498214      4.704239 6.576203       6.599536 -15.93750      6.707372 21.79569 8.539509 11.33791 5.680849 10.45778       10.25647 
1 1 1 15  24 24 o 21.94722 8.176744 7.390130       5.854478 10.70210       7.870914 3.288528       8.759087 24.91930 9.438804 20.10175 8.931023 4.817549       12.99439 
1 1 1 15  24 25 o 12.57661 6.020465 -4.746177      5.248446 -7.193740      7.477468 -2.369380      7.368577 14.29734 6.928926 16.00965 7.504059 -1.712315      10.21376 
1 1 1 15  24 26 o 32.86910 8.254609 18.55089       6.601799 33.17983       9.839580 6.573791       8.903196 41.99835 9.794811 20.88388 9.151994 21.11447       13.40512 
1 1 1 15  24 27 o 13.30830 6.518200 -7.553773      7.124948 0.000000       0.000000 -7.553773      7.124948 ?        ?        13.30830 6.518200 0.000000       6.518200 
1 1 1 15  24 28 o 13.67358 6.421257 -1.445890      5.439539 -5.206966      7.945633 1.871641       7.462426 14.39544 7.014264 16.73694 7.745372 -2.341499      10.44944 
1 1 1 15  24 29 o 18.78066 7.789214 6.759504       5.846189 21.86606       9.624207 -2.074260      7.359615 27.30837 10.41519 14.59940 7.025284 12.70898       12.56307 
1 1 1 15  24 30 o 16.05691 7.264569 3.446044       6.090267 18.58199       10.11195 -5.169832      7.629219 23.35715 9.992822 13.49792 6.638030 9.859232       11.99666 
1 1 1 15  24 31 o 19.06859 7.913063 8.416114       6.038315 7.489670       8.642499 9.299659       8.440033 17.86175 8.289934 18.72150 8.502576 -0.8597507     11.87505 
1 1 1 15  25 0  o 138.4004 2.832712 234.0453       9.553792 232.9988       14.55383 234.8378       12.66453 137.7636 4.340591 138.4370 3.757532 -0.6733856     5.741061 
1 1 1 15  25 1  o 126.3673 2.771828 195.1109       8.535663 208.2085       13.27067 185.8690       11.14752 130.2428 4.186658 123.1464 3.718934 7.096420       5.599873 
1 1 1 15  25 2  o 231.4575 4.839046 658.4955       27.29399 631.5865       44.42616 674.8102       34.59226 224.7679 8.124250 233.6424 6.080797 -8.874451      10.14788 
1 1 1 15  25 3  o 79.51058 2.994569 77.40943       5.791867 70.58948       9.921164 80.93544       7.133673 75.48974 5.429367 81.21413 3.613552 -5.724396      6.521946 
1 1 1 15  25 4  o 89.70567 2.593220 98.40441       5.662906 99.08144       8.422805 97.84592       7.649977 89.81853 3.857164 89.31471 3.521706 0.5038147      5.223038 
1 1 1 15  25 5  o 106.5789 3.004127 139.0637       7.794573 149.7937       15.81499 135.6210       8.958158 109.8771 5.928393 105.1609 3.500531 4.716179       6.884734 
1 1 1 15  25 6  o 31.68038 3.050874 12.39480       2.326232 12.46237       3.499123 12.34128       3.114025 31.48253 4.705054 31.42957 4.168499 0.5295563E-01  6.286009 
1 1 1 15  25 7  o 15.01222 3.909385 2.869576       1.444068 3.194009       1.994574 2.512180       2.093453 15.99665 4.762924 14.72584 4.944224 1.270808       6.865188 
1 1 1 15  25 8  f 97.56826 4.089168 117.2704       9.700984 127.5430       15.17637 110.1731       12.61462 101.0605 6.192134 94.13972 5.523028 6.920776       8.297371 
1 1 1 15  25 9  o 84.62559 4.047939 88.32883       8.323590 93.11819       12.61253 84.63349       11.07873 86.26655 6.037740 82.39342 5.550120 3.873123       8.201105 
1 1 1 15  25 10 o 74.46426 4.716711 68.84999       8.515020 65.99102       11.23089 72.71540       13.05891 72.31403 6.440490 75.63162 7.171116 -3.317589      9.638715 
1 1 1 15  25 11 o 28.80930 7.019569 10.89191       4.882157 6.091512       6.686663 16.37282       7.144922 23.79029 8.761425 35.05225 8.461631 -11.26196      12.18038 
1 1 1 15  25 12 o 74.74004 4.788812 69.66081       8.676134 76.34890       11.63292 61.27692       13.02448 77.67372 6.197155 68.72098 7.922234 8.952744       10.05816 
1 1 1 15  25 13 o 35.22720 6.205970 16.08647       5.132956 18.47525       7.077822 13.43628       7.455050 37.17263 8.047117 31.53400 9.160371 5.638634       12.19297 
1 1 1 15  25 14 o 21.68024 8.286024 4.694965       6.099741 5.522482       6.886542 1.681608       13.14129 23.12637 8.812605 25.91852 11.24192 -2.792145      14.28436 
1 1 1 15  25 15 o 51.68705 6.264314 34.57056       7.729422 46.16784       9.425787 10.76191       13.50539 59.64450 6.595047 30.71337 12.15977 28.93113       13.83310 
1 1 1 15  25 16 o 85.04361 4.714534 91.19228       9.732259 107.8421       13.54014 73.39672       13.99828 91.48180 6.108689 74.07178 7.875663 17.41001       9.967053 
1 1 1 15  25 17 o 64.37040 4.960464 52.82332       7.721186 67.27342       10.68907 37.05692       11.16531 71.85339 6.164093 51.08813 9.311351 20.76525       11.16679 
1 1 1 15  25 18 o 39.67741 6.367047 21.06131       5.948096 16.81870       7.506344 28.22087       9.751138 34.00124 8.941856 43.97779 9.384854 -9.976547      12.96273 
1 1 1 15  25 19 o 19.71661 7.515734 4.397997       5.009859 5.271647       6.522070 3.140594       7.824450 21.67102 8.489662 21.03587 8.886592 0.6351452      12.29007 
1 1 1 15  25 20 o 42.57964 6.683294 25.04762       6.706596 25.51534       9.238236 24.52646       9.751698 40.62309 9.502259 39.18015 10.13709 1.442932       13.89437 
1 1 1 15  25 21 o 16.93659 7.024937 2.226223       4.755733 1.061289       6.189814 3.904740       7.430014 17.55858 7.664284 20.57689 8.674456 -3.018311      11.57529 
1 1 1 15  25 22 o 25.95893 8.080335 10.52237       5.656112 11.75668       7.776330 9.135851       8.241853 26.55246 9.495169 24.28949 9.535178 2.262966       13.45652 
1 1 1 15  25 23 o 20.06238 7.911361 5.465453       5.696178 6.069098       8.112425 4.878428       7.999976 21.48860 9.061713 20.67006 8.866634 0.8185368      12.67801 
1 1 1 15  25 24 o 17.39956 7.471914 2.629909       5.692789 7.670750       8.317106 -1.813352      7.808574 22.14718 9.246461 16.67367 7.785802 5.473505       12.08784 
1 1 1 15  25 25 o 15.84322 7.514886 -3.017341      7.799955 0.000000       0.000000 -3.017341      7.799955 ?        ?        15.84322 7.514886 0.000000       7.514886 
1 1 1 15  25 26 o 16.29215 7.177985 2.182203       5.543956 7.576031       8.122135 -2.523012      7.585974 20.75734 8.919553 15.48465 7.363848 5.272692       11.56653 
1 1 1 15  25 27 o 16.04834 7.117907 2.379273       5.539864 -1.952262      7.610106 7.262357       8.080103 15.32578 7.312694 19.85655 8.709753 -4.530774      11.37257 
1 1 1 15  25 28 o 17.80783 7.613375 5.344769       5.862261 0.9444939      8.231741 9.872941       8.350514 16.28826 7.724258 20.55260 8.937566 -4.264347      11.81289 
1 1 1 15  25 29 o 17.84939 7.676873 5.990925       6.026861 12.89997       9.246716 0.8879473      7.946762 21.16276 9.298910 15.73143 7.496899 5.431328       11.94459 
1 1 1 15  25 30 o 17.25291 7.620707 5.758477       6.286769 2.400193       9.511665 8.363686       8.377590 16.29748 7.878129 18.48145 8.423676 -2.183973      11.53357 
1 1 1 15  26 0  o 174.1087 3.493835 371.2284       14.82378 355.1695       28.14771 377.3918       17.43795 168.9640 6.850372 175.3874 4.080008 -6.423386      7.973335 
1 1 1 15  26 1  o 59.50089 2.930313 43.40049       4.235801 37.42259       5.991182 49.37497       5.989471 54.99971 4.509656 63.33297 3.899723 -8.333260      5.961950 
1 1 1 15  26 2  o 141.6240 2.861206 245.2886       9.874660 251.1207       15.09907 240.9300       13.05305 142.8925 4.341187 140.1062 3.826708 2.786255       5.787020 
1 1 1 15  26 3  o 222.4578 4.020712 607.5934       21.79650 573.9697       28.70853 653.3525       33.49095 215.4521 5.472373 229.5464 5.992283 -14.09430      8.115068 
1 1 1 15  26 4  o 82.01505 2.649825 82.33192       5.289034 82.92834       7.741106 81.80974       7.243331 82.09985 3.880210 81.58797 3.652401 0.5118866      5.328796 
1 1 1 15  26 5  o 121.9786 2.688063 181.9921       7.990226 190.2863       12.13172 175.6379       10.61862 124.3712 4.008057 119.5818 3.648171 4.789398       5.419748 
1 1 1 15  26 6  o 81.93101 2.521630 82.16687       5.028616 86.38544       7.380387 78.51150       6.870078 83.80835 3.622283 79.90794 3.536820 3.900406       5.062611 
1 1 1 15  26 7  f 78.84746 2.172956 76.03162       4.171194 77.51168       6.667509 75.07987       5.346698 79.38863 3.454699 78.25477 2.808300 1.133858       4.452134 
1 1 1 15  26 8  o 28.63131 7.571856 10.75201       5.363124 12.26670       7.864655 9.435367       7.332484 30.68439 9.524488 27.59595 9.253070 3.088434       13.27913 
1 1 1 15  26 9  o 31.16442 7.126059 12.74534       5.293766 20.07149       7.931419 6.859802       7.108958 38.82481 8.608953 24.85226 9.052944 13.97255       12.49279 
1 1 1 15  26 10 o 26.25216 8.568148 8.739657       6.299759 8.524008       7.335618 9.345595       12.29636 26.52486 9.245387 30.10161 11.69574 -3.576750      14.90864 
1 1 1 15  26 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 15  26 12 o 37.66222 7.779559 18.94476       6.903547 28.44921       8.211783 -3.962200      12.74846 46.49079 7.503709 23.18750 10.49858 23.30329       12.90449 
1 1 1 15  26 13 o 22.84955 7.337008 6.704598       4.630742 9.129161       6.236115 3.724338       6.913924 26.35428 8.519060 21.53191 8.641825 4.822365       12.13489 
1 1 1 15  26 14 o 32.83718 6.462506 14.27906       4.987110 20.88627       6.757138 6.373900       7.391100 39.52011 7.284630 24.04262 9.137336 15.47750       11.68575 
1 1 1 15  26 15 f 68.65653 4.818055 59.72648       8.009841 47.37932       10.00574 81.75719       13.36534 59.85217 6.991704 78.74779 7.038890 -18.89562      9.921184 
1 1 1 15  26 16 o 83.54185 4.710256 88.57433       9.550409 86.07128       12.63401 91.91171       14.58847 80.95230 6.457865 82.85335 7.300008 -1.901047      9.746493 
1 1 1 15  26 17 o 32.58907 7.267152 14.76367       5.624154 21.53678       7.141561 3.703661       9.125921 39.24512 7.742557 22.65909 9.585992 16.58603       12.32227 
1 1 1 15  26 18 o 23.10274 7.861058 7.316579       5.292599 12.89192       6.903771 -0.6310454     8.242693 29.42091 8.884660 19.11673 8.566769 10.30418       12.34207 
1 1 1 15  26 19 f 38.28755 6.534006 20.27978       5.877787 21.21856       7.707304 18.97482       9.086923 37.60632 8.597945 34.17772 10.16369 3.428593       13.31260 
1 1 1 15  26 20 o 19.98141 7.192818 5.343018       4.470524 0.7467797      5.420590 15.11809       7.905064 16.46136 7.179037 30.36832 9.567288 -13.90696      11.96125 
1 1 1 15  26 21 o 39.95145 6.362560 22.63424       5.986856 25.88832       8.141973 18.80378       8.833644 40.64849 8.493706 32.64253 10.08783 8.005966       13.18739 
1 1 1 15  26 22 o 15.67296 6.717667 1.475251       4.585221 -1.962592      5.520525 9.122156       8.233418 14.47542 6.685729 23.69485 9.457318 -9.219424      11.58188 
1 1 1 15  26 23 o 18.53656 8.387975 1.627187       8.123991 0.000000       0.000000 1.627187       8.123991 ?        ?        18.53656 8.387975 0.000000       8.387975 
1 1 1 15  26 24 f 22.03275 9.309240 8.308739       8.588704 0.000000       0.000000 8.308739       8.588704 ?        ?        22.03275 9.309240 0.000000       9.309240 
1 1 1 15  26 25 f 13.34247 6.347064 -3.348895      5.644388 -10.69670      8.924361 1.550008       7.286983 14.16008 7.004019 17.11800 7.822858 -2.957919      10.50016 
1 1 1 15  26 26 o 13.54332 6.403396 -2.210165      5.577219 -7.824950      8.665696 1.760152       7.287011 14.33859 7.055998 16.77078 7.722648 -2.432191      10.46071 
1 1 1 15  26 27 o 18.09537 7.715027 5.576730       5.990292 0.8660341      9.106931 9.169235       7.952949 16.72404 7.985311 20.38134 8.792710 -3.657295      11.87758 
1 1 1 15  26 28 o 13.25163 6.289566 -1.566531      5.480482 3.024966       7.844207 -5.945154      7.660210 16.66302 7.788279 13.48188 6.634336 3.181149       10.23092 
1 1 1 15  26 29 o 15.67875 7.535107 1.004035       8.404633 1.004035       8.404633 0.000000       0.000000 15.67875 7.535107 ?        ?        0.000000       7.535107 
1 1 1 15  27 0  o 63.11001 2.969617 48.85289       4.554232 46.61710       6.534525 50.96467       6.350719 61.40092 4.396292 64.27778 4.075378 -2.876854      5.994672 
1 1 1 15  27 1  o 142.5139 2.878851 248.5521       9.997990 227.7327       14.69111 266.5128       13.64532 135.9367 4.440838 147.2859 3.804963 -11.34918      5.847972 
1 1 1 15  27 2  o 13.91396 5.560137 1.220575       2.849301 1.080236       3.928866 1.376276       4.138330 15.64945 6.427445 16.29201 6.632659 -0.6425619     9.236028 
1 1 1 15  27 3  o 120.7422 2.731598 178.4077       8.037333 195.4223       12.41862 166.1440       10.54325 125.9782 4.050484 116.2431 3.726772 9.735046       5.504112 
1 1 1 15  27 4  o 140.4363 2.827338 241.5042       9.675940 223.8483       14.10851 257.1835       13.29535 134.6999 4.303635 144.5946 3.776449 -9.894699      5.725630 
1 1 1 15  27 5  o 39.93923 3.212696 19.69374       3.100480 21.70287       4.313748 17.54669       4.459357 41.73365 4.303250 37.31525 5.032135 4.418404       6.621205 
1 1 1 15  27 6  o 18.42928 5.805384 4.199864       2.910720 15.38228       6.849660 1.735582       3.215484 34.04622 8.326173 15.16159 5.954621 18.88464       10.23634 
1 1 1 15  27 7  o 48.30198 2.497786 28.64042       2.930074 31.44442       4.271650 26.14878       4.026692 50.44368 3.496625 45.95313 3.625155 4.490555       5.036679 
1 1 1 15  27 8  o 42.20874 2.900298 21.96240       2.965059 34.83125       7.872938 19.83542       3.200728 52.25626 6.310086 40.02995 3.310742 12.22631       7.125882 
1 1 1 15  27 9  o 53.27666 4.909455 35.63414       6.302281 41.95926       9.312600 30.28957       8.560382 57.11049 6.826475 48.11856 7.548491 8.991932       10.17745 
1 1 1 15  27 10 o 46.06545 5.267715 26.90719       5.807149 39.49236       9.124972 18.34056       7.528477 55.21417 6.934354 36.77215 8.561917 18.44202       11.01779 
1 1 1 15  27 11 o 15.98292 6.535618 1.428899       4.039742 7.092289       5.451147 -5.470721      6.016753 23.72503 7.978405 14.43862 6.771896 9.286412       10.46487 
1 1 1 15  27 12 o 14.60681 6.357527 -0.3620441     4.233007 -0.7236007E-01 5.743702 -0.7064404     6.262661 17.15128 7.435741 17.42990 7.655919 -0.2786255     10.67255 
1 1 1 15  27 13 o 23.28263 7.506211 7.098523       4.843465 4.982296       6.626857 9.525423       7.096636 22.13284 8.589793 26.77327 9.102868 -4.640430      12.51586 
1 1 1 15  27 14 o 29.23462 6.582654 11.53261       4.576337 12.96754       6.277980 9.905574       6.685016 30.42187 8.258290 26.88382 8.829329 3.538050       12.08952 
1 1 1 15  27 15 o 38.00904 5.920959 19.09474       5.305634 30.41470       7.757319 9.144963       7.272704 47.55011 6.895548 26.01443 9.194848 21.53568       11.49321 
1 1 1 15  27 16 o 16.99960 6.873343 2.295730       4.408935 -1.628331      5.927945 7.153681       6.595729 15.98449 7.205434 23.55774 8.697117 -7.573252      11.29416 
1 1 1 15  27 17 o 12.16125 5.742524 -4.187853      4.458598 -4.452187      5.682178 -3.764361      7.192195 13.98567 6.566266 16.33391 7.574493 -2.348241      10.02441 
1 1 1 15  27 18 o 28.61456 7.575864 11.99449       5.364995 16.00570       6.989876 6.243346       8.369680 32.34695 8.685335 23.03005 9.411098 9.316902       12.80640 
1 1 1 15  27 19 o 16.52411 6.920454 1.932438       4.680896 2.382268       6.068491 1.271655       7.355063 18.29074 7.780649 18.70769 8.253928 -0.4169521     11.34310 
1 1 1 15  27 20 o 11.21381 5.382285 -4.870181      4.256586 -3.606969      5.577613 -6.631947      6.586950 13.83301 6.498055 13.84441 6.657956 -0.1139545E-01 9.303391 
1 1 1 15  27 21 f 21.93237 8.878201 7.022568       7.365853 0.000000       0.000000 7.022568       7.365853 ?        ?        21.93237 8.878201 0.000000       8.878201 
1 1 1 15  27 22 o 21.80006 8.152297 7.561862       5.830342 12.80634       8.589325 3.080747       7.939642 25.95695 9.853621 19.18340 8.514122 6.773550       13.02245 
1 1 1 15  27 23 o 15.15344 6.788318 0.4640192      5.170652 0.5730839      6.786042 0.3130507      7.983946 16.68009 7.594418 17.42959 8.046623 -0.7495022     11.06451 
1 1 1 15  27 24 o 14.54853 6.686399 -0.5070406     5.425897 7.441710       7.313131 -10.24078      8.092707 20.72953 8.663679 13.57024 6.704451 7.159292       10.95486 
1 1 1 15  27 25 o 17.11196 7.435903 3.604516       5.771369 2.468031       8.204093 4.717945       8.120446 17.57701 8.129570 18.62266 8.410425 -1.045650      11.69723 
1 1 1 15  27 26 o 18.82752 7.930882 6.434952       6.203171 16.08776       9.754352 -0.1195998     8.037909 23.92048 10.00214 15.95877 7.586664 7.961707       12.55389 
1 1 1 15  27 27 o 15.52244 7.169102 1.710238       6.346954 -0.9895270     9.140225 4.224273       8.820223 15.81911 7.665060 17.50095 8.205287 -1.681839      11.22853 
1 1 1 15  27 28 o 22.39410 9.756597 16.72030       9.990376 16.72030       9.990376 0.000000       0.000000 22.39410 9.756597 ?        ?        0.000000       9.756597 
1 1 1 15  28 0  o 51.73586 3.485989 33.01155       4.369293 36.33213       5.683868 28.21479       6.831421 54.11235 4.346879 47.20667 6.079420 6.905678       7.473600 
1 1 1 15  28 1  o 55.79419 3.268932 38.32734       4.425112 41.28053       5.789596 34.17832       6.862389 57.73466 4.142588 52.17619 5.478816 5.558472       6.868658 
1 1 1 15  28 2  o 77.76759 3.049563 74.27711       5.768059 79.37748       7.776299 68.03851       8.600340 80.17422 3.992739 73.98944 4.795742 6.184776       6.240281 
1 1 1 15  28 3  o 36.29697 4.090023 16.44606       3.554786 17.54712       4.580015 14.77777       5.637630 37.24944 5.186010 33.62556 7.103008 3.623886       8.794739 
1 1 1 15  28 4  o 35.16630 4.886334 15.62197       4.074443 18.37108       4.353965 -3.749669      11.55773 38.21202 4.779999 22.45088 10.09580 15.76115       11.17021 
1 1 1 15  28 5  o 97.02190 2.647207 115.4421       6.252990 121.4796       9.337646 110.5335       8.419570 99.16656 3.871428 94.65672 3.656959 4.509842       5.325534 
1 1 1 15  28 6  o 46.97744 2.904643 27.19186       3.308941 26.72235       4.462539 27.76528       4.931645 46.34067 3.990527 47.15454 4.340393 -0.8138695     5.896042 
1 1 1 15  28 7  o 51.55262 3.007346 32.77272       3.761667 47.87236       9.221660 29.75868       4.120030 61.24933 6.266572 49.01741 3.471627 12.23193       7.163946 
1 1 1 15  28 8  o 61.76881 2.861628 46.98788       4.295728 74.34629       10.76678 41.80832       4.684752 76.56274 5.814219 58.14850 3.319865 18.41425       6.695270 
1 1 1 15  28 9  o 55.29780 2.440799 37.58701       3.280988 34.76995       9.072034 38.01091       3.519202 51.35690 7.467485 55.57555 2.605765 -4.218651      7.909067 
1 1 1 15  28 10 o 63.87388 4.452362 51.19275       6.886878 65.63587       10.73526 41.09164       8.977730 71.41928 6.230549 56.16722 6.690511 15.25206       9.142356 
1 1 1 15  28 11 o 33.61077 6.352045 14.95263       5.012103 18.91434       7.167964 11.16251       7.011010 37.08486 8.154091 28.50994 9.013733 8.574924       12.15469 
1 1 1 15  28 12 o 29.34363 6.464683 11.56265       4.497708 10.41141       6.058356 12.97629       6.713400 27.45479 8.329705 30.37574 8.652529 -2.920948      12.01042 
1 1 1 15  28 13 o 42.35338 5.281468 23.23056       5.332910 34.20536       8.238573 15.31554       6.996485 50.57423 6.861595 32.74704 8.642740 17.82719       11.03533 
1 1 1 15  28 14 f 26.38380 6.793116 9.601686       4.393649 11.02382       5.858661 7.773891       6.641900 27.83524 8.130524 24.29241 8.764366 3.542830       11.95490 
1 1 1 15  28 15 o 43.15259 5.866526 24.80047       6.009524 28.95362       8.023319 19.49290       9.070133 45.53968 7.489995 35.38958 10.04945 10.15010       12.53362 
1 1 1 15  28 16 o 18.06230 7.127748 3.296212       4.626624 5.536273       6.399252 0.8428746      6.696965 21.57481 8.421776 18.22593 7.963496 3.348885       11.59067 
1 1 1 15  28 17 o 27.69548 7.616573 11.34887       5.300164 16.67428       7.091808 4.610744       7.977193 32.83734 8.717716 21.51977 9.024940 11.31757       12.54783 
1 1 1 15  28 18 f 19.56612 7.417995 4.920310       4.864102 11.88813       6.524314 -3.798857      7.298339 27.34776 8.701199 15.97007 7.479944 11.37769       11.47434 
1 1 1 15  28 19 o 19.83175 8.593517 3.403433       7.663780 0.000000       0.000000 3.403433       7.663780 ?        ?        19.83175 8.593517 0.000000       8.593517 
1 1 1 15  28 20 o 17.13790 7.140543 2.798363       4.945244 3.819284       6.929644 1.738844       7.059424 19.35939 8.277134 18.11886 8.035702 1.240526       11.53618 
1 1 1 15  28 21 o 13.50961 6.239225 -1.730086      4.806585 -4.979219      6.544755 2.074445       7.082070 14.09581 6.741031 18.03072 8.019612 -3.934905      10.47643 
1 1 1 15  28 22 o 25.02650 8.265178 10.99509       5.855070 12.49450       7.904600 9.172352       8.715270 25.24310 9.481430 22.54294 9.442229 2.700161       13.38108 
1 1 1 15  28 23 o 23.55311 8.296104 10.22283       5.916503 13.54152       8.378719 6.922339       8.355726 25.03832 9.674648 20.47099 8.920691 4.567331       13.15969 
1 1 1 15  28 24 o 19.83293 8.040092 7.010736       6.050893 18.30896       8.891788 -2.733889      8.257844 27.49278 10.10702 15.57687 7.481700 11.91591       12.57489 
1 1 1 15  28 25 o 15.45718 7.006858 1.657834       5.698982 7.268018       8.054981 -3.965174      8.064182 19.42177 8.600121 14.70873 7.143995 4.713035       11.18028 
1 1 1 15  28 26 o 15.96733 7.493529 1.464298       7.387038 1.464298       7.387038 0.000000       0.000000 15.96733 7.493529 ?        ?        0.000000       7.493529 
1 1 1 15  28 27 o 21.01896 8.115368 9.820139       5.892243 12.18530       8.480719 7.612989       8.192533 21.03675 9.077641 18.60547 8.420816 2.431282       12.38199 
1 1 1 15  29 0  o 25.93490 5.375430 8.676793       3.285610 9.386598       4.440269 7.817842       4.884548 26.76438 6.796450 24.64906 7.479548 2.115322       10.10620 
1 1 1 15  29 1  f 27.82099 5.052145 9.908971       3.299072 16.23169       4.483549 2.443888       4.871778 35.72538 5.311367 18.30481 7.285099 17.42057       9.015724 
1 1 1 15  29 2  o 80.07983 2.795234 78.75849       5.446418 84.34505       8.005362 73.94427       7.431417 82.54064 3.991779 77.28213 3.959190 5.258514       5.622231 
1 1 1 15  29 3  o 69.01981 2.775850 58.54449       4.659281 59.66528       6.568832 57.40968       6.609796 69.39172 3.900281 68.03261 4.004607 1.359116       5.590087 
1 1 1 15  29 4  o 63.59726 2.793729 49.74904       4.319145 47.58632       5.939298 52.17654       6.292369 61.90325 3.957916 64.81744 4.003231 -2.914192      5.629472 
1 1 1 15  29 5  o 57.40241 3.330998 40.74295       4.639498 42.17067       5.486811 37.16125       8.690474 58.25085 3.887537 53.58421 6.808888 4.666637       7.840529 
1 1 1 15  29 6  o 47.15741 2.713134 27.40709       3.104704 29.94068       4.512175 25.12906       4.278562 49.03498 3.805880 44.85809 3.954446 4.176891       5.488385 
1 1 1 15  29 7  o 22.45937 4.253601 6.474698       2.242830 6.658609       2.780331 6.132052       3.795025 22.58928 5.163682 21.73169 6.592500 0.8575897      8.374048 
1 1 1 15  29 8  o 31.82739 3.661552 12.71598       2.788214 25.59197       7.248143 10.47968       3.020653 43.99879 6.993855 28.63829 4.474607 15.36049       8.302777 
1 1 1 15  29 9  o 75.10884 2.468142 69.41361       4.511356 75.81673       11.14920 68.15997       4.933257 76.70801 6.012412 74.34659 2.727554 2.361420       6.602170 
1 1 1 15  29 10 o 82.70620 4.553926 86.31647       9.142833 82.34489       12.31151 91.19997       13.65198 79.45147 6.413225 83.31583 6.782694 -3.864365      9.334580 
1 1 1 15  29 11 o 14.66563 6.327491 0.1015928      4.119319 7.247348       6.126878 -5.793190      5.564794 23.75927 8.435485 13.38199 6.347458 10.37729       10.55688 
1 1 1 15  29 12 o 15.20343 6.338209 1.127840       3.899644 1.455824       5.631965 0.8257697      5.404900 17.81417 7.533185 17.03942 7.298187 0.7747574      10.48868 
1 1 1 15  29 13 o 50.82368 4.820675 33.32789       5.899110 38.05404       8.957375 29.70806       7.839199 52.67460 7.163671 46.47551 7.150529 6.199097       10.12167 
1 1 1 15  29 14 o 40.67466 6.381144 22.53912       6.117045 14.31223       7.866716 35.12081       9.728479 30.47037 9.536284 49.20504 8.415568 -18.73468      12.71859 
1 1 1 15  29 15 o 34.60508 6.765943 16.83488       5.501090 15.95117       6.857329 18.43041       9.214126 32.40408 8.558308 33.41511 10.29864 -1.011032      13.39054 
1 1 1 15  29 16 o 25.62028 9.832060 10.08090       8.611837 0.000000       0.000000 10.08090       8.611837 ?        ?        25.62028 9.832060 0.000000       9.832060 
1 1 1 15  29 17 o 23.17844 9.352567 7.637542       8.144740 0.000000       0.000000 7.637542       8.144740 ?        ?        23.17844 9.352567 0.000000       9.352567 
1 1 1 15  29 18 o 32.53749 7.316494 16.00267       5.660060 13.66906       7.507569 19.07578       8.615358 28.16008 9.361249 32.71041 9.935043 -4.550337      13.65057 
1 1 1 15  29 19 o 34.39257 9.924815 21.57213       8.777867 21.57213       8.777867 0.000000       0.000000 34.39257 9.924815 ?        ?        0.000000       9.924815 
1 1 1 15  29 20 o 16.12594 7.044601 1.519987       5.238452 1.914031       6.880116 0.9764680      8.080366 17.74145 7.896879 18.07716 8.252244 -0.3357124     11.42192 
1 1 1 15  29 21 o 17.39825 7.352337 3.398634       5.358849 0.7647884      6.969770 7.207050       8.380994 16.82980 7.675674 21.16578 9.077229 -4.335981      11.88748 
1 1 1 15  29 22 o 29.29417 8.083391 15.21476       5.958455 13.47019       7.988065 17.40292       8.946148 25.17293 9.514683 27.66201 10.14309 -2.489086      13.90724 
1 1 1 15  29 23 o 20.70855 7.972603 7.923941       5.675076 11.05723       8.132844 4.950390       7.922816 22.41534 9.231252 18.65651 8.376681 3.758829       12.46534 
1 1 1 15  29 24 o 19.59549 8.563796 7.500328       7.748405 7.500328       7.748405 0.000000       0.000000 19.59549 8.563796 ?        ?        0.000000       8.563796 
1 1 1 15  29 25 o 13.95536 6.489475 -0.1104604     5.335815 -0.6818973     7.217587 0.5782576      7.923711 15.03103 7.157938 15.89232 7.548613 -0.8612871     10.40277 
1 1 1 15  30 0  o 46.77103 3.986688 27.26790       4.500591 21.52859       7.388341 30.65397       5.674992 40.22619 7.818781 49.37774 4.775806 -9.151546      9.161968 
1 1 1 15  30 1  o 38.72830 3.781995 18.71737       3.523887 27.75640       5.079809 10.33256       4.892523 47.03413 4.486268 27.86003 7.165927 19.17410       8.454413 
1 1 1 15  30 2  o 20.41832 5.623208 5.421936       2.886632 5.305352       3.950842 5.555440       4.227851 20.64882 6.787997 21.15951 7.024685 -0.5106964     9.768476 
1 1 1 15  30 3  o 45.54501 3.278800 25.71438       3.614727 34.90879       4.999488 15.64310       5.232459 52.92769 3.903673 34.52427 6.456657 18.40342       7.545004 
1 1 1 15  30 4  o 54.29856 2.882903 36.38805       3.800977 32.23324       5.090692 41.62241       5.713910 50.74210 4.153226 57.72345 4.088504 -6.981354      5.827963 
1 1 1 15  30 5  o 45.71696 3.096697 25.89809       3.429586 27.56698       4.610327 23.83031       5.131807 46.89470 4.074743 43.28192 4.954696 3.612785       6.415025 
1 1 1 15  30 6  o 31.24025 3.635535 12.26475       2.716050 18.33059       3.905500 6.583276       3.779736 38.07962 4.282873 22.32165 6.533492 15.75797       7.812139 
1 1 1 15  30 7  o 37.08275 3.076125 17.10582       2.754798 19.60093       3.927340 14.68910       3.865150 39.39778 4.153040 33.82906 4.825157 5.568718       6.366309 
1 1 1 15  30 8  o 12.86474 5.224133 0.9909939      2.559656 -0.1532283     5.788252 1.269146       2.853865 16.98213 7.412107 13.75375 5.540941 3.228377       9.254262 
1 1 1 15  30 9  o 43.02686 3.107881 23.06189       3.236708 41.90171       8.389105 19.76692       3.508349 56.45487 6.199764 39.64210 3.673482 16.81277       7.206355 
1 1 1 15  30 10 o 70.28811 4.530171 62.87212       7.718158 63.14965       10.36971 62.52742       11.55677 69.17200 6.218061 68.08390 7.068294 1.088104       9.414088 
1 1 1 15  30 11 o 43.99409 5.225343 25.26798       5.492726 24.85570       8.274094 25.59282       7.344503 41.53206 8.462818 43.02153 7.263895 -1.489464      11.15273 
1 1 1 15  30 12 o 100.9644 4.603792 130.8076       11.29733 135.1954       15.66204 126.0486       16.31139 100.2676 6.444023 95.97087 7.023165 4.296730       9.531542 
1 1 1 15  30 13 o 33.92496 10.15434 18.70885       9.047411 0.000000       0.000000 18.70885       9.047411 ?        ?        33.92496 10.15434 0.000000       10.15434 
1 1 1 15  30 14 o 23.04085 9.307727 6.744436       8.077096 0.000000       0.000000 6.744436       8.077096 ?        ?        23.04085 9.307727 0.000000       9.307727 
1 1 1 15  30 15 o 14.95870 6.530626 0.4052865      4.495875 -3.830500      6.364343 4.624568       6.351931 14.86782 6.970500 20.18310 8.217087 -5.315276      10.77536 
1 1 1 15  30 16 o 19.95380 6.977553 5.614835       4.180178 1.716186       5.442469 11.22337       6.527754 16.95024 7.292735 26.29993 8.728605 -9.349695      11.37421 
1 1 1 15  30 17 o 18.11493 7.289353 3.781914       4.932793 2.383401       6.540664 5.626533       7.511765 18.22771 7.918409 21.05507 8.788719 -2.827364      11.82974 
1 1 1 15  30 18 o 37.03113 7.253261 20.96121       6.311134 24.07407       8.516071 17.16876       9.399808 37.06820 9.411985 29.41128 10.44777 7.656918       14.06206 
1 1 1 15  30 19 o 16.46974 7.034905 2.331476       4.997084 -6.409473      6.091934 20.30959       8.736712 12.94516 6.268976 32.19976 10.04561 -19.25460      11.84122 
1 1 1 15  30 20 o 13.20642 6.417899 -6.629291      6.532520 -6.629291      6.532520 0.000000       0.000000 13.20642 6.417899 ?        ?        0.000000       6.417899 
1 1 1 15  30 21 o 22.04210 8.142346 8.846800       5.782581 14.37556       7.814222 2.154317       8.597370 25.97885 9.487080 17.99970 8.324039 7.979149       12.62118 
1 1 1 15  30 22 o 27.14870 9.938657 17.63066       8.583748 17.63066       8.583748 0.000000       0.000000 27.14870 9.938657 ?        ?        0.000000       9.938657 
1 1 1 15  30 23 o 13.55412 6.335667 -1.023468      5.192642 4.350724       7.108993 -7.170310      7.602869 17.69569 7.940879 13.45164 6.617496 4.244050       10.33677 
1 1 1 15  30 24 o 20.40933 7.949569 8.492587       5.691845 6.124917       7.937702 10.99849       8.166127 18.38687 8.308527 21.15635 9.013580 -2.769476      12.25872 
1 1 1 15  31 0  o 15.76027 5.703312 2.692847       2.815239 3.411987       3.591713 1.547164       4.533437 17.67178 6.435211 16.77619 6.898754 0.8955898      9.434233 
1 1 1 15  31 1  o 41.91095 3.665794 21.93999       3.706314 24.34775       5.027135 19.07273       5.485899 43.80514 4.787174 38.23205 6.092525 5.573093       7.748283 
1 1 1 15  31 2  o 44.14370 3.430313 24.26772       3.661161 23.37569       4.941137 25.35363       5.451769 42.87648 4.811967 44.55737 5.113459 -1.680885      7.021573 
1 1 1 15  31 3  o 61.30895 2.912918 46.46392       4.339546 42.37235       5.846364 51.48410       6.475896 58.10868 4.156099 64.07282 4.170191 -5.964142      5.887584 
1 1 1 15  31 4  o 85.04759 2.890324 89.36012       5.981541 87.96510       7.897890 91.23666       9.160117 83.92378 3.872238 85.15524 4.429442 -1.231453      5.883382 
1 1 1 15  31 5  o 32.86372 3.603185 13.58857       2.838364 17.61495       4.023202 9.598612       4.004966 37.15439 4.537537 26.73223 6.258888 10.42216       7.730649 
1 1 1 15  31 6  o 59.67266 2.925294 44.14168       4.240875 48.86182       5.680170 38.19659       6.374752 62.45251 3.749557 54.68856 4.833025 7.763943       6.116969 
1 1 1 15  31 7  o 56.75903 2.568756 39.82487       3.543781 42.29866       5.209670 37.69443       4.834642 58.05776 3.701533 54.82128 3.639529 3.236477       5.191099 
1 1 1 15  31 8  o 34.36034 4.396462 15.16847       3.597036 16.09696       6.686486 14.79034       4.267084 33.48099 8.249613 33.49513 5.412204 -0.1414108E-01 9.866512 
1 1 1 15  31 9  o 45.99438 3.078720 26.43269       3.430858 24.46824       8.357022 26.83089       3.762548 40.99795 8.637808 46.23129 3.362710 -5.233334      9.269279 
1 1 1 15  31 10 o 12.71622 4.796477 1.619383       2.027617 0.000000       0.000000 1.619383       2.027617 ?        ?        12.71622 4.796477 0.000000       4.796477 
1 1 1 15  31 11 o 21.21350 9.038385 3.555754       8.211860 0.000000       0.000000 3.555754       8.211860 ?        ?        21.21350 9.038385 0.000000       9.038385 
1 1 1 15  31 12 o 22.14255 7.125601 6.969912       4.366066 4.335556       5.811040 10.38475       6.616098 19.83323 7.935396 26.07220 8.789772 -6.238966      11.84190 
1 1 1 15  31 13 o 38.71379 5.923906 20.67523       5.411233 32.15233       8.518360 12.91049       7.006538 46.63772 7.768312 28.33643 9.017173 18.30129       11.90194 
1 1 1 15  31 14 f 27.06978 7.369600 11.05591       4.991014 12.66647       7.811257 9.944735       6.488182 27.43397 9.541761 25.06342 8.697410 2.370548       12.91085 
1 1 1 15  31 15 o 13.12994 5.962750 -1.189257      4.150078 -2.563658      6.205756 -0.7730533E-01 5.581885 15.09379 7.011932 15.77575 7.061138 -0.6819677     9.951223 
1 1 1 15  31 16 o 15.36291 6.576594 1.412537       4.384633 -1.042448      6.590519 3.362030       5.872946 16.13367 7.397979 18.31833 7.716673 -2.184666      10.69005 
1 1 1 15  31 17 o 14.26028 6.386331 -0.1251797     4.572758 1.179228       6.591519 -1.335372      6.349010 17.17177 7.680525 15.55642 7.179615 1.615347       10.51367 
1 1 1 15  31 18 o 14.91563 6.637718 0.5713637      4.858418 1.051669       6.213749 -0.1841267     7.793085 16.51463 7.416411 17.10054 7.914152 -0.5859051     10.84606 
1 1 1 15  31 19 o 27.77879 10.05846 16.77628       8.758024 16.77628       8.758024 0.000000       0.000000 27.77879 10.05846 ?        ?        0.000000       10.05846 
1 1 1 15  31 20 o 16.95046 7.578976 2.531238       6.412579 2.531238       6.412579 0.000000       0.000000 16.95046 7.578976 ?        ?        0.000000       7.578976 
1 1 1 15  31 21 o 15.08590 7.256258 -3.084509      7.831810 -3.084509      7.831810 0.000000       0.000000 15.08590 7.256258 ?        ?        0.000000       7.256258 
1 1 1 15  31 22 o 20.23947 7.996651 7.954121       5.829823 6.076613       8.006162 10.07324       8.505728 18.79137 8.430248 21.01241 9.079169 -2.221043      12.38953 
1 1 1 15  31 23 o 18.52322 7.709303 6.352918       5.755297 4.394076       7.668245 8.879681       8.709205 17.50565 8.009418 19.81981 8.849257 -2.314161      11.93567 
1 1 1 15  32 0  o 67.00728 3.003162 55.61259       4.891385 64.83057       6.985986 46.74761       6.850917 71.91444 4.002137 60.72009 4.665741 11.19435       6.147051 
1 1 1 15  32 1  o 45.28012 4.102013 25.87766       4.477218 25.56660       7.269330 26.06778       5.683044 43.58574 7.087325 44.94538 5.289898 -1.359650      8.843822 
1 1 1 15  32 2  o 43.52377 3.404306 23.68497       3.581990 25.64491       4.830870 21.29151       5.338479 44.89602 4.475056 40.40068 5.570518 4.495346       7.145404 
1 1 1 15  32 3  o 64.84226 2.866241 52.10321       4.517857 54.53334       6.356103 49.62177       6.422849 65.83449 3.980477 62.66074 4.231068 3.173744       5.809142 
1 1 1 15  32 4  o 22.03220 5.452032 6.488955       2.911131 4.209700       3.786383 9.784063       4.552636 18.66705 6.630977 26.62269 6.945580 -7.955645      9.602652 
1 1 1 15  32 5  o 35.16786 3.988027 15.73994       3.357482 19.14079       5.071551 13.08650       4.479727 38.08134 5.634896 31.15216 6.119436 6.929178       8.318626 
1 1 1 15  32 6  o 67.29823 3.211773 56.56002       5.252057 50.61652       7.588461 62.02476       7.276422 62.56820 5.019022 69.82158 4.297357 -7.253380      6.607409 
1 1 1 15  32 7  o 15.21142 5.519889 2.638935       2.639449 1.111302       3.293046 5.383656       4.414052 14.13145 5.852113 20.39718 7.167268 -6.265730      9.252943 
1 1 1 15  32 8  o 27.94618 4.501438 10.22194       2.961445 25.47067       7.624692 7.512902       3.213757 42.21313 7.695504 23.44357 5.684775 18.76957       9.567520 
1 1 1 15  32 9  f 50.48022 3.442739 32.20961       4.209732 49.07361       9.753706 28.34900       4.666780 59.43767 6.859684 46.98096 4.117829 12.45671       8.000736 
1 1 1 15  32 10 o 23.41809 4.296770 7.242650       2.361718 10.63313       6.841527 6.783961       2.516407 26.24927 8.937542 22.47339 4.744092 3.775885       10.11860 
1 1 1 15  32 11 o 17.85153 6.954935 3.618945       4.357464 0.9217982      6.249593 6.170627       6.078729 17.41561 7.648838 21.47077 8.255101 -4.055164      11.25395 
1 1 1 15  32 12 o 70.74530 4.760937 66.10256       8.159997 71.28123       11.42934 60.71840       11.65389 70.88964 6.695426 64.14459 7.603155 6.745049       10.13098 
1 1 1 15  32 13 o 12.06291 5.603889 -2.375365      3.963597 -4.570187      5.823151 -0.4807055     5.410333 13.69497 6.495105 15.35215 6.905200 -1.657181      9.479883 
1 1 1 15  32 14 f 19.78302 7.290091 5.540915       4.630595 3.900177       6.729223 7.016643       6.381876 19.36284 8.213283 21.73637 8.431292 -2.373528      11.77050 
1 1 1 15  32 15 o 17.09489 6.963535 3.206691       4.564663 -1.800117      6.370070 8.491087       6.544272 15.41691 7.142029 22.83542 8.616262 -7.418508      11.19145 
1 1 1 15  32 16 o 24.13498 7.674653 9.570585       5.076274 16.63978       7.937098 4.677541       6.603381 29.53834 9.615782 19.31249 8.161428 10.22585       12.61238 
1 1 1 15  32 17 o 18.50428 7.677286 4.548074       5.682178 5.166371       6.595706 2.768233       11.19060 19.34443 8.164873 19.87357 9.293286 -0.5291386     12.37054 
1 1 1 15  32 18 o 19.77201 7.993849 6.338789       5.963239 7.379080       7.967165 5.013612       8.992145 20.73446 8.870353 19.61435 8.855055 1.120111       12.53376 
1 1 1 15  32 19 o 23.64841 8.077736 10.44454       5.589273 6.590135       7.636439 14.89183       8.202765 19.75492 8.569118 25.65780 9.654026 -5.902880      12.90852 
1 1 1 15  32 20 o 20.53411 8.061899 7.956642       5.892313 6.382624       8.077468 9.746874       8.614400 19.31011 8.578055 21.22491 9.153807 -1.914799      12.54493 
1 1 1 15  32 21 o 23.25434 9.535386 13.75396       8.629113 13.75396       8.629113 0.000000       0.000000 23.25434 9.535386 ?        ?        0.000000       9.535386 
1 1 1 15  33 0  o 50.28464 4.207071 32.11858       5.108060 40.16158       8.291177 27.19820       6.484940 54.95303 6.305488 45.29118 6.024966 9.661850       8.721203 
1 1 1 15  33 1  o 23.19106 6.451552 7.362215       3.778549 4.780075       5.187096 10.28150       5.515347 20.33694 7.671537 26.90440 7.897031 -6.567461      11.00979 
1 1 1 15  33 2  o 12.95887 5.987007 -2.797351      4.431559 0.000000       0.000000 -2.797351      4.431559 ?        ?        12.95887 5.987007 0.000000       5.987007 
1 1 1 15  33 3  o 45.33863 3.596910 25.94428       3.941511 24.56006       5.071422 28.05592       6.263793 43.49014 4.868693 46.00623 5.709543 -2.516098      7.503536 
1 1 1 15  33 4  o 71.30552 2.817015 63.25063       4.885320 68.75483       7.064925 58.20720       6.762749 73.62635 3.952143 67.60963 4.124295 6.016724       5.712202 
1 1 1 15  33 5  o 38.25064 3.581124 18.56432       3.299250 18.29970       5.306728 18.73105       4.212274 36.62956 6.163734 37.91997 4.656012 -1.290409      7.724640 
1 1 1 15  33 6  o 11.68584 4.765023 0.8505679      2.139985 0.5562713      2.735815 1.314483       3.434895 12.46756 5.260199 14.47219 5.983487 -2.004623      7.966919 
1 1 1 15  33 7  o 24.07314 4.280180 7.629774       2.418894 8.439482       3.410095 6.809787       3.431672 24.69655 5.770691 22.05379 6.153167 2.642759       8.435778 
1 1 1 15  33 8  o 38.10704 4.606088 19.09203       4.190650 27.66526       8.056330 15.91185       4.906718 43.19007 7.947265 33.78743 6.187303 9.402645       10.07183 
1 1 1 15  33 9  o 11.99988 4.993042 0.7507631      2.413287 0.8823698      6.617146 0.7305729      2.591799 17.72823 7.825055 12.30574 5.151377 5.422483       9.368467 
1 1 1 15  33 10 o 31.13899 3.637452 12.51096       2.708248 31.35124       8.097697 10.13819       2.873733 46.10651 7.461937 27.63093 4.416553 18.47558       8.671012 
1 1 1 15  33 11 o 9.308060 4.140343 -0.4700827     1.888077 9.493110       7.010502 -1.249269      1.960517 24.35868 8.971022 8.695171 4.004593 15.66351       9.824256 
1 1 1 15  33 12 o 12.11195 5.694778 -3.137593      4.300959 9.210442       6.873502 -11.08342      5.513771 23.83256 8.863570 10.86270 5.395990 12.96986       10.37688 
1 1 1 15  33 13 o 30.22877 7.010133 13.90835       5.063466 16.72545       7.677543 11.73978       6.736107 30.58990 9.395900 26.08753 8.868645 4.502367       12.92036 
1 1 1 15  33 14 o 26.42638 8.225327 11.84434       5.861019 14.68027       7.024077 5.343737       10.63452 28.57706 9.020476 21.32379 9.628032 7.253265       13.19348 
1 1 1 15  33 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 15  33 16 o 28.00365 7.632102 13.23867       5.349514 18.91030       8.809278 9.925347       6.733150 29.63180 10.14052 23.06738 8.731660 6.564423       13.38178 
1 1 1 15  33 17 o 13.94810 6.329485 -0.3650799E-01 4.665370 -3.440658      7.372204 2.237438       6.025361 14.90655 7.135683 16.59486 7.388082 -1.688315      10.27140 
1 1 1 15  33 18 o 18.99753 7.378934 6.004115       4.893271 5.305931       7.123854 6.627777       6.732941 18.75648 8.203944 19.58926 8.257782 -0.8327732     11.64026 
1 1 1 15  33 19 o 28.55286 8.509513 16.04536       6.364319 13.39521       9.102278 18.58021       8.902074 23.16996 9.673242 27.16043 10.08978 -3.990473      13.97767 
1 1 1 15  33 20 o 17.62220 7.470429 4.941752       5.561349 8.285682       7.485219 0.8212946      8.308998 20.02201 8.582408 16.45231 7.789798 3.569693       11.59046 
1 1 1 15  34 0  o 13.77173 5.628598 1.257521       2.994406 3.747446       4.014616 -1.864677      4.495532 18.01190 6.758784 13.56139 6.177104 4.450508       9.156297 
1 1 1 15  34 1  o 18.74138 5.767131 4.726457       2.890810 4.219896       3.825703 5.400618       4.413445 18.42414 6.651065 20.27042 7.163006 -1.846277      9.774729 
1 1 1 15  34 2  o 30.57677 4.456440 12.22452       3.222988 8.873964       4.296012 16.53835       4.874602 24.95308 6.855168 34.81057 5.960588 -9.857496      9.084158 
1 1 1 15  34 3  o 33.03739 5.162474 14.58147       4.020319 20.89053       7.799004 12.29823       4.691729 36.90590 8.796754 29.44363 6.691326 7.462267       11.05245 
1 1 1 15  34 4  o 29.02217 4.478510 11.08755       3.065576 12.32330       4.283052 9.789521       4.389671 29.75172 6.112135 26.08230 6.827761 3.669420       9.163870 
1 1 1 15  34 5  o 28.65963 4.050148 10.69701       2.749895 12.87201       4.126486 8.959493       3.688198 30.57942 5.748491 25.24332 6.070368 5.336100       8.360294 
1 1 1 15  34 6  o 34.09751 3.466247 14.85875       2.840180 17.63851       4.293310 12.69557       3.787345 36.33858 4.979079 30.58550 5.271697 5.753082       7.251345 
1 1 1 15  34 7  o 23.72608 4.317085 7.483696       2.404122 11.32215       3.562450 4.273635       3.257821 28.79441 5.271156 17.89067 6.165180 10.90374       8.111382 
1 1 1 15  34 8  o 25.68061 4.824291 8.935119       2.908256 10.02954       7.104858 8.714835       3.187532 25.00178 9.058619 25.06592 5.379386 -0.6413841E-01 10.53548 
1 1 1 15  34 9  o 35.73749 3.604343 16.48545       3.096121 32.67471       8.666650 14.11705       3.314868 46.12864 7.999666 32.68718 4.263003 13.44146       9.064649 
1 1 1 15  34 10 o 12.13534 5.252673 0.2645608      2.856871 -2.382076      5.784682 1.118330       3.285509 14.58914 6.774886 13.70918 5.773183 0.8799582      8.901052 
1 1 1 15  34 11 o 17.93235 5.172442 4.522345       2.384672 23.96292       7.840251 2.540519       2.503273 38.01233 8.658087 14.47126 5.355170 23.54107       10.18039 
1 1 1 15  34 12 o 10.15730 4.216010 0.5673242      1.714614 -4.316225      6.470038 0.9361990      1.778192 14.25282 6.784459 10.86204 4.374543 3.390773       8.072515 
1 1 1 15  34 13 o 15.84649 6.754412 2.116962       4.589280 18.14000       7.671496 -6.813069      5.727091 31.09910 9.359981 12.28752 5.979950 18.81158       11.10716 
1 1 1 15  34 14 o 13.87132 6.313568 -0.4777570     4.685332 -9.096161      7.444096 5.176205       6.029412 13.38222 6.576336 19.04477 7.905554 -5.662543      10.28329 
1 1 1 15  34 15 o 17.98481 7.269250 4.658674       4.929622 12.71859       8.174685 0.5271026E-01  6.179681 24.45038 9.525971 15.52671 7.135886 8.923669       11.90231 
1 1 1 15  34 16 o 11.57521 5.555394 -3.932348      4.533177 -7.400380      6.605990 -0.8457835     6.232095 12.77432 6.260746 14.95190 6.973133 -2.177579      9.371313 
1 1 1 15  34 17 o 12.11409 5.747085 -2.723246      4.565851 -5.856628      6.730855 -0.5241723E-01 6.214220 13.26469 6.461636 15.16038 7.033885 -1.895689      9.551350 
1 1 1 15  34 18 o 22.28578 7.932054 9.586064       5.420479 4.151669       8.140621 13.91459       7.265274 18.00177 8.242431 24.89770 9.138824 -6.895929      12.30674 
1 1 1 15  35 0  o 19.67953 6.440362 5.324129       3.558216 7.046627       4.246137 1.262056       6.520614 22.19608 7.014380 18.02206 7.866508 4.174015       10.53961 
1 1 1 15  35 1  o 12.53043 5.310580 0.5561097      2.809238 1.080986       3.846470 -0.4390860E-01 4.112596 14.71901 6.225009 14.11990 6.202977 0.5991163      8.787927 
1 1 1 15  35 2  o 11.04271 4.953349 -0.8195315     2.762996 1.070376       3.544244 -3.747544      4.411535 14.24904 5.998111 12.13682 5.725256 2.112219       8.291917 
1 1 1 15  35 3  o 21.79762 5.394966 6.582962       2.850124 11.76329       4.002543 1.254348       4.059427 29.04729 5.856924 15.10981 6.392872 13.93748       8.670199 
1 1 1 15  35 4  o 44.41060 4.027400 25.57208       4.311264 39.73573       8.961284 21.30653       4.917793 52.27761 7.227393 39.72672 5.204926 12.55089       8.906541 
1 1 1 15  35 5  o 25.91618 4.525089 8.995483       2.753890 9.272141       4.200021 8.786843       3.647369 25.10225 6.729178 24.78229 6.084924 0.3199577      9.072383 
1 1 1 15  35 6  o 24.52884 4.782300 8.184877       2.755841 8.454177       3.871538 7.908276       3.923680 24.02480 6.469620 23.16791 6.619872 0.8568974      9.256278 
1 1 1 15  35 7  o 21.79727 4.977939 6.577876       2.585948 9.778459       3.611302 3.209692       3.704650 26.19839 5.808980 16.56280 6.424016 9.635592       8.660959 
1 1 1 15  35 8  o 25.28839 5.506177 9.061619       3.296771 30.08948       8.338750 5.165916       3.589189 43.59837 8.148164 18.98380 6.473321 24.61456       10.40656 
1 1 1 15  35 9  o 30.57833 5.627487 13.29287       4.038908 20.36215       8.481410 11.21957       4.593150 33.16645 9.808240 27.01599 6.940313 6.150465       12.01539 
1 1 1 15  35 10 f 10.51088 4.631179 -0.1701728     2.308148 -4.450739      5.325574 0.8198736      2.561201 12.77650 6.102103 12.10802 5.097981 0.6684790      7.951419 
1 1 1 15  35 11 o 9.481869 4.413131 -1.657989      2.476166 2.190095       6.116211 -2.412358      2.708022 17.13852 7.545551 9.442625 4.463781 7.695890       8.767023 
1 1 1 15  35 12 o 12.74475 4.829238 1.881070       2.060854 15.06735       7.460461 0.7917449      2.144289 27.64278 9.333824 11.24392 4.694693 16.39886       10.44799 
1 1 1 15  35 13 o 12.82471 4.446190 2.145432       1.695400 7.141257       7.608128 1.884386       1.739131 20.56603 8.728812 12.34398 4.480455 8.222042       9.811557 
1 1 1 15  35 14 o 31.90633 7.386743 17.02239       5.629908 33.06562       9.323521 7.815733       7.062934 41.44763 9.442413 20.76075 8.581442 20.68688       12.75932 
1 1 1 15  35 15 o 18.29984 7.425367 5.263205       5.166432 12.40531       7.737399 -0.4831541     6.940299 23.79323 9.268327 15.58277 7.297132 8.210462       11.79619 
1 1 1 15  35 16 o 19.63926 7.626962 6.855680       5.227105 7.689828       8.458626 6.340345       6.648498 20.05208 8.849107 19.14456 8.143926 0.9075241      12.02623 
1 1 1 15  36 0  o 11.08487 4.971643 -0.7598981     2.782495 2.098783       3.546089 -5.339893      4.488480 15.24545 6.164158 11.40757 5.488602 3.837888       8.253581 
1 1 1 15  36 1  o 37.83059 5.028186 19.30822       4.520758 21.43364       4.943406 8.448802       11.17397 39.72877 5.233181 24.30180 10.45253 15.42697       11.68938 
1 1 1 15  36 2  o 19.98314 5.997173 5.689550       3.152694 9.567565       4.117304 0.1930340      4.901759 25.51126 6.579911 15.16861 6.713211 10.34265       9.400129 
1 1 1 15  36 3  o 21.95291 5.988895 6.951110       3.292089 10.51114       4.478046 2.764143       4.856366 26.47940 6.878655 17.13012 7.101478 9.349276       9.886703 
1 1 1 15  36 4  o 25.11784 5.101177 8.746925       3.015702 11.22799       4.362681 6.476574       4.173311 27.51439 6.592969 20.88265 6.980400 6.631737       9.601730 
1 1 1 15  36 5  o 39.21271 3.460679 19.83977       3.273021 25.99482       4.718893 14.13355       4.543586 44.16047 4.445433 31.20668 6.193304 12.95379       7.623574 
1 1 1 15  36 6  o 13.28449 5.095707 1.923545       2.312485 4.527194       3.325826 -0.5133412     3.217554 17.92143 6.226542 11.97115 5.359412 5.950281       8.215420 
1 1 1 15  36 7  o 14.98009 5.112604 2.996010       2.238945 2.120756       3.081896 3.974233       3.258141 14.42520 5.776475 17.02676 6.139056 -2.601560      8.429453 
1 1 1 15  36 8  o 15.15885 5.724648 2.867243       2.890235 17.84609       7.332977 0.1123408      3.144809 31.38060 9.075994 12.30804 5.415031 19.07256       10.56864 
1 1 1 15  36 9  o 13.91673 5.501345 2.105346       2.760451 13.62467       7.850499 0.4801315      2.948758 26.19778 9.517788 12.28798 5.327556 13.90980       10.90739 
1 1 1 15  36 10 o 12.01800 5.400900 -0.3847625     3.301858 -5.015568      5.947794 1.678092       3.969739 13.10240 6.307640 14.69299 6.272928 -1.590591      8.895839 
1 1 1 15  36 11 o 12.02458 5.001829 1.073627       2.420755 13.16976       7.429013 -0.3633024     2.560505 25.46217 9.257560 10.69418 4.784843 14.76799       10.42100 
1 1 1 15  36 12 o 11.34294 4.744438 0.8593886      2.195769 5.857120       6.714675 0.2609588      2.323514 19.34473 8.204949 10.84873 4.716137 8.496001       9.463780 
1 1 1 15  36 13 o 13.61198 5.301301 2.228344       2.530978 -2.784194      6.339610 3.178760       2.760516 14.12656 6.721915 15.16391 5.621371 -1.037346      8.762645 
1 1 1 15  36 14 o 18.70480 7.481965 5.791976       5.164559 -0.1009792     7.874859 10.23956       6.841293 16.27231 7.667868 22.32821 8.710117 -6.055893      11.60441 
1 1 1 15  37 0  o 14.54741 5.649431 2.315320       2.867886 -1.192809      3.893020 6.478387       4.240876 12.61881 5.747965 20.79926 7.037227 -8.180453      9.086345 
1 1 1 15  37 1  o 11.41845 5.069026 -0.3380965     2.815964 1.322851       3.970348 -2.019320      3.994509 14.73443 6.281496 12.20606 5.654939 2.528371       8.451954 
1 1 1 15  37 2  o 38.02344 4.607979 19.51809       4.182684 23.64751       5.231268 12.19956       6.964250 41.24875 5.328651 26.27867 9.015578 14.97008       10.47259 
1 1 1 15  37 3  o 12.18674 5.205419 0.6074770      2.735930 -1.664220      3.705290 3.330852       4.056960 11.90582 5.491205 16.73620 6.652186 -4.830386      8.625829 
1 1 1 15  37 4  f 14.01033 5.497765 2.121262       2.739000 5.354823       3.818601 -1.305284      3.930900 19.02911 6.667889 12.47048 5.716466 6.558633       8.782866 
1 1 1 15  37 5  o 17.88129 6.133265 4.637317       3.223029 4.251996       6.805020 4.748749       3.659512 18.98594 8.161453 18.10773 6.509091 0.8782101      10.43923 
1 1 1 15  37 6  o 23.28433 5.441090 7.882413       3.031501 6.204576       4.894512 8.926641       3.861286 19.93756 7.466647 24.05197 6.454103 -4.114412      9.869461 
1 1 1 15  37 7  o 14.34399 5.181188 2.683181       2.322022 0.3554589      3.236292 5.152896       3.333539 12.58277 5.515893 18.51921 6.239197 -5.936436      8.327824 
1 1 1 15  37 8  o 20.58779 5.848400 6.409926       3.071302 16.75488       8.144508 4.694942       3.316124 28.36942 9.749069 17.76744 6.214594 10.60199       11.56138 
1 1 1 15  37 9  o 10.01019 4.637365 -1.443561      2.685724 1.734205       7.288439 -1.942852      2.889020 17.23022 7.854791 10.04890 4.706463 7.181316       9.156884 
1 1 1 15  37 10 o 10.43005 4.740246 -0.7532915     2.628973 6.615826       7.889814 -1.673671      2.788319 20.01040 8.694792 10.00947 4.666837 10.00092       9.868068 
1 1 1 15  37 11 o 10.86533 5.068295 -1.731042      3.294984 3.897045       7.917206 -2.910076      3.623720 18.32117 8.286492 10.69969 5.088660 7.621482       9.724218 
1 1 1 15  38 0  o 15.65442 5.894892 3.130928       3.059762 4.167044       4.339490 2.106508       4.314928 17.68642 6.926059 15.62065 6.599112 2.065773       9.566534 
1 1 1 15  38 1  o 39.20497 4.166092 20.57309       3.919342 24.72374       5.731199 16.92666       5.371812 41.33208 5.853731 33.11034 6.882489 8.221737       9.035199 
1 1 1 15  38 2  o 12.74921 5.489750 0.7061381      3.088866 2.555564       4.319368 -1.229563      4.418968 15.95935 6.663278 13.14127 6.037625 2.818080       8.991784 
1 1 1 15  38 3  o 21.44561 6.300394 7.064573       3.509255 2.814234       4.584038 13.08195       5.454314 16.36188 6.850219 27.90371 7.747002 -11.54183      10.34125 
1 1 1 15  38 4  o 23.58951 5.377821 8.098679       3.022533 5.064792       4.597797 10.40763       4.011042 18.53454 7.165362 25.99869 6.379562 -7.464148      9.593812 
1 1 1 15  38 5  o 13.50587 5.473081 1.807765       2.802672 1.310131       3.840252 2.374883       4.099601 14.19775 6.117387 15.44314 6.472712 -1.245388      8.906090 
1 1 1 15  38 6  o 11.96920 5.338449 -0.1160548     3.160804 4.300922       7.847743 -0.9713207     3.453287 18.90877 8.424103 11.75537 5.377120 7.153400       9.993944 
1 1 1 15  38 7  o 28.46367 4.226418 11.10705       2.842692 12.71470       4.280032 9.838091       3.802541 28.66079 6.300133 25.15022 6.235487 3.510572       8.864141 
1 1 1 15  38 8  o 16.44119 5.972533 3.918196       3.091196 5.785828       7.679919 3.557126       3.376812 19.45722 8.514095 16.05552 6.157934 3.401705       10.50762 
1 1 1 15  39 0  o 21.78646 5.996792 7.213015       3.283916 7.391209       4.939866 7.071904       4.395900 21.10248 7.565329 20.88091 7.162790 0.2215691      10.41824 
1 1 1 15  39 1  o 8.474097 4.127532 -4.111772      2.744285 -3.844928      3.981003 -4.353393      3.788184 10.91567 5.230177 10.34717 4.994394 0.5684967      7.231786 
1 1 1 15  39 2  o 16.81680 6.039467 4.074690       3.149680 4.164631       4.672218 3.999768       4.264316 17.50982 7.077044 17.15291 6.819336 0.3569012      9.827914 
1 1 1 15  39 3  o 12.17947 5.210208 0.7716621      2.748481 5.028567       4.240856 -2.311280      3.609020 18.24288 6.924121 11.11430 5.222851 7.128576       8.673040 
1 1 1 16  0  0  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  0  1  o 666.9646 13.77196 5474.782       223.6231 5474.782       223.6231 5474.782       223.6231 666.9646 13.77196 666.9646 13.77196 0.000000       0.000000 
1 1 1 16  0  2  f 22.57175 8.655726 8.462665       4.497702 8.462665       4.497702 8.462665       4.497702 22.57175 8.655726 22.57175 8.655726 0.000000       0.000000 
1 1 1 16  0  3  o 124.3031 3.339398 188.7786       10.09897 188.7786       10.09897 188.7786       10.09897 124.3031 3.339398 124.3031 3.339398 0.000000       0.000000 
1 1 1 16  0  4  o 196.1980 4.066634 470.0386       19.42426 470.0386       19.42426 470.0386       19.42426 196.1980 4.066634 196.1980 4.066634 0.000000       0.000000 
1 1 1 16  0  5  o 42.74530 4.701012 23.08492       4.746110 23.08492       4.746110 23.08492       4.746110 42.74530 4.701012 42.74530 4.701012 0.000000       0.000000 
1 1 1 16  0  6  o 160.0337 4.416988 313.1207       17.19591 313.1207       17.19591 313.1207       17.19591 160.0337 4.416988 160.0337 4.416988 0.000000       0.000000 
1 1 1 16  0  7  o 8.446458 5.807200 -2.813662      3.903375 -2.813662      3.903375 -2.813662      3.903375 8.446458 5.807200 8.446458 5.807200 0.000000       0.000000 
1 1 1 16  0  8  o 256.8467 5.958803 806.9899       37.25126 806.9899       37.25126 806.9899       37.25126 256.8467 5.958803 256.8467 5.958803 0.000000       0.000000 
1 1 1 16  0  9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  0  10 o 70.31378 4.219020 60.96902       7.168979 60.96902       7.168979 60.96902       7.168979 70.31378 4.219020 70.31378 4.219020 0.000000       0.000000 
1 1 1 16  0  11 o 59.99062 3.443778 44.32419       4.996208 44.32419       4.996208 44.32419       4.996208 59.99062 3.443778 59.99062 3.443778 0.000000       0.000000 
1 1 1 16  0  12 o 62.61604 3.451438 48.25630       5.229661 48.25630       5.229661 48.25630       5.229661 62.61604 3.451438 62.61604 3.451438 0.000000       0.000000 
1 1 1 16  0  13 o 114.1899 3.383248 159.4680       9.395792 159.4680       9.395792 159.4680       9.395792 114.1899 3.383248 114.1899 3.383248 0.000000       0.000000 
1 1 1 16  0  14 o 122.3828 4.128595 183.4340       12.28107 183.4340       12.28107 183.4340       12.28107 122.3828 4.128595 122.3828 4.128595 0.000000       0.000000 
1 1 1 16  0  15 o 69.39999 4.163292 59.42776       6.982374 59.42776       6.982374 59.42776       6.982374 69.39999 4.163292 69.39999 4.163292 0.000000       0.000000 
1 1 1 16  0  16 o 170.6680 4.713166 356.6646       19.56823 356.6646       19.56823 356.6646       19.56823 170.6680 4.713166 170.6680 4.713166 0.000000       0.000000 
1 1 1 16  0  17 o 6.383514 4.616473 -7.289985      3.763049 -7.289985      3.763049 -7.289985      3.763049 6.383514 4.616473 6.383514 4.616473 0.000000       0.000000 
1 1 1 16  0  18 o 26.34241 10.42626 11.77711       6.444611 11.77711       6.444611 11.77711       6.444611 26.34241 10.42626 26.34241 10.42626 0.000000       0.000000 
1 1 1 16  0  19 o 153.5088 4.897362 289.1180       18.27799 289.1180       18.27799 289.1180       18.27799 153.5088 4.897362 153.5088 4.897362 0.000000       0.000000 
1 1 1 16  0  20 o 26.00423 8.534010 10.60357       4.795852 10.60357       4.795852 10.60357       4.795852 26.00423 8.534010 26.00423 8.534010 0.000000       0.000000 
1 1 1 16  0  21 o 120.9478 4.425360 179.6634       13.00348 179.6634       13.00348 179.6634       13.00348 120.9478 4.425360 120.9478 4.425360 0.000000       0.000000 
1 1 1 16  0  22 o 82.24699 4.472196 83.54345       8.902516 83.54345       8.902516 83.54345       8.902516 82.24699 4.472196 82.24699 4.472196 0.000000       0.000000 
1 1 1 16  0  23 o 123.5006 4.440929 187.5948       13.32605 187.5948       13.32605 187.5948       13.32605 123.5006 4.440929 123.5006 4.440929 0.000000       0.000000 
1 1 1 16  0  24 o 11.77364 7.565812 0.2345720      4.957362 0.2345720      4.957362 0.2345720      4.957362 11.77364 7.565812 11.77364 7.565812 0.000000       0.000000 
1 1 1 16  0  25 o 113.3648 4.458196 158.6183       12.27275 158.6183       12.27275 158.6183       12.27275 113.3648 4.458196 113.3648 4.458196 0.000000       0.000000 
1 1 1 16  0  26 o 8.917231 6.196016 -4.022208      4.743854 -4.022208      4.743854 -4.022208      4.743854 8.917231 6.196016 8.917231 6.196016 0.000000       0.000000 
1 1 1 16  0  27 o 65.20023 6.552951 54.72634       10.15177 54.72634       10.15177 54.72634       10.15177 65.20023 6.552951 65.20023 6.552951 0.000000       0.000000 
1 1 1 16  0  28 o 32.83406 9.160176 16.52817       6.341168 16.52817       6.341168 16.52817       6.341168 32.83406 9.160176 32.83406 9.160176 0.000000       0.000000 
1 1 1 16  0  29 o 14.27513 8.597778 3.039913       5.427701 3.039913       5.427701 3.039913       5.427701 14.27513 8.597778 14.27513 8.597778 0.000000       0.000000 
1 1 1 16  0  30 o 58.98897 5.382625 44.97467       7.581695 44.97467       7.581695 44.97467       7.581695 58.98897 5.382625 58.98897 5.382625 0.000000       0.000000 
1 1 1 16  0  31 o 22.53898 9.760688 9.873090       5.530328 9.873090       5.530328 9.873090       5.530328 22.53898 9.760688 22.53898 9.760688 0.000000       0.000000 
1 1 1 16  0  32 o 7.528590 5.402940 -6.923865      4.718133 -6.923865      4.718133 -6.923865      4.718133 7.528590 5.402940 7.528590 5.402940 0.000000       0.000000 
1 1 1 16  0  33 o 45.19174 6.217118 28.48002       6.478684 28.48002       6.478684 28.48002       6.478684 45.19174 6.217118 45.19174 6.217118 0.000000       0.000000 
1 1 1 16  0  34 f 9.150158 6.305370 -2.200128      4.664063 -2.200128      4.664063 -2.200128      4.664063 9.150158 6.305370 9.150158 6.305370 0.000000       0.000000 
1 1 1 16  0  35 o 15.00363 9.152385 5.285448       6.318034 5.285448       6.318034 5.285448       6.318034 15.00363 9.152385 15.00363 9.152385 0.000000       0.000000 
1 1 1 16  0  36 o 16.66508 9.005384 7.090060       5.097175 7.090060       5.097175 7.090060       5.097175 16.66508 9.005384 16.66508 9.005384 0.000000       0.000000 
1 1 1 16  0  37 o 11.10071 7.258116 1.804794       4.840235 1.804794       4.840235 1.804794       4.840235 11.10071 7.258116 11.10071 7.258116 0.000000       0.000000 
1 1 1 16  0  38 o 16.60279 9.143375 8.067369       5.357980 8.067369       5.357980 8.067369       5.357980 16.60279 9.143375 16.60279 9.143375 0.000000       0.000000 
1 1 1 16  1  0  o 278.0816 3.975719 943.5546       26.94164 931.9453       42.56477 951.3146       34.79989 276.0656 6.327059 279.0928 5.116737 -3.027191      8.137117 
1 1 1 16  1  1  o 218.5506 3.038834 582.4841       16.18434 572.1566       22.64539 593.2667       23.13882 216.5118 4.292024 220.4685 4.306839 -3.956696      6.080323 
1 1 1 16  1  2  o 218.6364 3.048645 582.9664       16.24297 587.4865       22.99416 578.4644       22.94797 219.3843 4.301064 217.6910 4.325812 1.693314       6.100148 
1 1 1 16  1  3  o 194.9488 3.144686 463.5356       14.93943 458.3041       19.01109 471.9821       24.15638 193.7835 4.025819 196.4972 5.048931 -2.713715      6.457470 
1 1 1 16  1  4  o 180.1111 3.348177 395.7343       14.69552 401.4559       20.41260 389.5782       21.17350 181.2521 4.625239 178.5203 4.871639 2.731796       6.717566 
1 1 1 16  1  5  o 147.2096 3.466985 264.3979       12.43724 257.1742       14.82046 281.5989       22.86966 145.0795 4.196393 151.5750 6.204618 -6.495560      7.490460 
1 1 1 16  1  6  o 140.6704 3.412274 241.4373       11.69723 239.1801       14.05155 246.5318       21.11036 139.9069 4.125948 141.8020 6.123534 -1.895126      7.383842 
1 1 1 16  1  7  o 263.1021 4.946987 845.9991       31.71766 848.1580       38.62141 841.5269       55.58897 263.2462 6.020464 261.4275 8.737997 1.818634       10.61125 
1 1 1 16  1  8  o 100.6895 3.217138 123.8256       7.883736 123.8356       9.438771 123.8026       14.33745 100.6413 3.855737 100.4001 5.885873 0.2411728      7.036349 
1 1 1 16  1  9  f 125.9613 3.370420 193.7733       10.33634 208.6462       12.81253 166.0519       17.49222 130.6454 4.029249 116.2589 6.196611 14.38649       7.391403 
1 1 1 16  1  10 o 128.9928 2.922221 203.0038       9.185750 210.4810       10.60051 180.4655       18.40425 131.2806 3.316178 121.1806 6.253464 10.10004       7.078336 
1 1 1 16  1  11 o 193.9697 3.513933 459.3575       16.60976 462.8197       19.10667 448.6468       33.60575 194.6376 4.028302 190.9387 7.235523 3.698944       8.281305 
1 1 1 16  1  12 o 97.66280 2.494043 116.4197       5.930806 115.6863       7.710229 117.4825       9.281488 97.29428 3.256539 97.98488 3.894830 -0.6905975     5.076884 
1 1 1 16  1  13 o 166.5623 2.906686 338.5794       11.79807 342.0859       15.35037 333.5182       18.44176 167.3311 3.764489 165.0510 4.589547 2.280136       5.935935 
1 1 1 16  1  14 o 90.25649 2.636564 99.48407       5.792780 95.31678       9.240920 102.1817       7.434930 88.17349 4.313812 91.41042 3.343315 -3.236931      5.457722 
1 1 1 16  1  15 o 75.41060 2.755359 69.49999       5.054939 76.46677       8.405247 65.55244       6.327011 78.92950 4.387197 73.15896 3.559593 5.770538       5.649620 
1 1 1 16  1  16 o 142.4253 2.866719 247.6532       9.949663 223.5005       15.37307 265.0632       13.05202 134.9993 4.680048 147.2574 3.637177 -12.25812      5.927217 
1 1 1 16  1  17 o 159.5231 2.956146 310.7840       11.49173 319.3310       18.15935 305.0748       14.84159 161.3673 4.622706 157.9230 3.856550 3.444382       6.020165 
1 1 1 16  1  18 o 25.09730 5.389488 8.032451       3.197721 5.220119       4.775002 10.31927       4.305823 21.56606 7.462485 28.38394 6.380688 -6.817886      9.818444 
1 1 1 16  1  19 o 45.64249 3.567602 25.64202       3.936588 28.11080       5.934284 23.70185       5.260727 47.54611 5.206786 43.64232 5.038971 3.903786       7.245816 
1 1 1 16  1  20 o 173.8044 3.534728 369.7420       14.97107 371.5785       17.27876 364.2113       29.98559 174.1065 4.072505 171.1381 7.206141 2.968353       8.277304 
1 1 1 16  1  21 o 90.62818 4.558046 101.1782       10.03417 100.3778       13.78691 102.0797       14.63167 89.81387 6.339973 90.47169 6.683784 -0.6578293     9.212395 
1 1 1 16  1  22 o 44.66104 4.034425 24.68873       4.343530 27.44967       6.123024 21.89205       6.162524 46.82322 5.469109 41.55470 6.281432 5.268513       8.328717 
1 1 1 16  1  23 o 38.99229 4.437992 18.96539       4.142017 21.10662       5.932698 16.92912       5.785471 40.75492 6.166116 36.25347 6.798356 4.501457       9.178161 
1 1 1 16  1  24 f 82.41595 3.190413 83.46256       6.395482 86.38949       9.153437 80.67084       8.939512 83.50302 4.515068 80.66866 4.566146 2.834366       6.421489 
1 1 1 16  1  25 o 23.24725 6.711855 7.000203       4.013562 10.86128       5.267529 1.655990       6.197186 28.66051 7.467971 19.30092 8.013587 9.359592       10.95391 
1 1 1 16  1  26 o 78.63203 3.736911 76.61120       7.140092 71.69941       11.51122 79.68266       9.102772 74.88865 6.368013 79.81384 4.700963 -4.925194      7.915216 
1 1 1 16  1  27 o 55.62984 3.759899 38.56876       5.067121 42.03632       7.229728 35.22083       7.103910 57.51168 5.215216 52.41640 5.650708 5.095280       7.689537 
1 1 1 16  1  28 o 25.76797 7.639286 9.088427       5.139877 13.21184       7.379997 5.204316       7.162644 30.44614 9.184184 22.57574 8.880969 7.870392       12.77579 
1 1 1 16  1  29 o 25.29896 6.908350 8.861555       4.378088 4.723346       7.026731 11.48740       5.597343 21.72032 8.713898 28.43854 7.829664 -6.718220      11.71476 
1 1 1 16  1  30 o 43.35886 4.295512 24.20167       4.479079 19.11634       6.138566 29.99189       6.550200 36.84791 7.093643 47.32896 5.800367 -10.48105      9.163189 
1 1 1 16  1  31 o 42.15101 4.397346 23.22115       4.450489 13.89878       6.083767 33.95309       6.527521 30.08779 8.113397 50.21054 5.420604 -20.12275      9.757569 
1 1 1 16  1  32 o 17.03052 6.381442 3.690725       3.576180 10.16049       5.313251 -1.667684      4.835417 25.29761 7.824592 13.75379 6.317818 11.54382       10.05679 
1 1 1 16  1  33 o 14.32558 5.953803 1.768788       3.425656 -1.925196      4.884970 5.343160       4.805231 13.38064 6.217812 19.08514 7.339163 -5.704499      9.618966 
1 1 1 16  1  34 o 21.97496 6.995162 7.965771       4.216272 16.84733       7.300644 3.521059       5.164620 29.18533 9.194215 17.09431 7.220577 12.09102       11.69061 
1 1 1 16  1  35 o 18.26445 6.558129 5.435710       3.713695 4.296700       5.170148 6.649777       5.337777 17.22707 7.247645 19.35891 7.650806 -2.131845      10.53865 
1 1 1 16  1  36 o 9.491636 4.630972 -4.359055      3.495911 -2.055917      4.341632 -8.605584      5.895356 11.81006 5.603240 11.17690 5.556682 0.6331606      7.891325 
1 1 1 16  1  37 f 14.43619 6.022903 3.067045       3.525207 3.287227       5.071664 2.861233       4.903385 15.16894 6.764138 14.81625 6.625861 0.3526888      9.468664 
1 1 1 16  1  38 o 11.64991 5.355972 0.2338032      3.485435 5.572026       5.176555 -4.193288      4.714132 16.28321 7.059246 10.75861 5.276124 5.524599       8.813083 
1 1 1 16  2  0  o 472.6758 5.704663 2730.327       65.70969 2821.013       94.97627 2647.064       91.00591 479.7352 8.124142 464.7391 8.035711 14.99606       11.42691 
1 1 1 16  2  1  o 327.5520 4.130712 1309.377       32.97169 1288.507       46.14274 1331.150       47.13099 324.6722 5.832062 329.9957 5.860871 -5.323486      8.268178 
1 1 1 16  2  2  o 264.5631 3.492270 853.8548       22.51507 864.5428       32.00981 843.3892       31.67505 266.0551 4.937140 262.7789 4.946418 3.276215       6.988734 
1 1 1 16  2  3  o 209.9304 2.983888 537.4680       15.26490 528.3951       21.32117 547.0095       21.86474 208.0574 4.205249 211.6874 4.238510 -3.629990      5.970685 
1 1 1 16  2  4  o 182.2314 2.988027 405.0111       13.26917 382.0519       19.92060 423.3228       17.79044 176.8130 4.627278 186.2414 3.919893 -9.428482      6.064426 
1 1 1 16  2  5  o 139.1972 2.909314 236.3080       9.868634 224.2049       13.37512 250.7701       14.62061 135.4648 4.056249 143.2594 4.192506 -7.794632      5.833546 
1 1 1 16  2  6  o 186.1521 3.367811 422.7892       15.27749 424.8950       21.38752 420.5951       21.83054 186.4368 4.711301 185.4745 4.834088 0.9622650      6.750167 
1 1 1 16  2  7  o 133.2136 2.909739 216.4521       9.445803 222.0745       13.13388 210.4282       13.59481 134.8102 4.002351 131.1994 4.257755 3.610855       5.843568 
1 1 1 16  2  8  o 107.0781 2.792023 139.9439       7.279226 137.1344       9.875144 143.2870       10.77199 105.9161 3.832319 108.2450 4.091045 -2.328819      5.605651 
1 1 1 16  2  9  o 157.7585 3.173800 303.6838       12.20137 308.8869       16.96939 298.1147       17.55624 158.9396 4.385442 156.1111 4.619975 2.828522       6.369951 
1 1 1 16  2  10 o 90.55614 2.840044 100.1398       6.259531 110.7587       8.763453 89.07907       8.943933 95.16241 3.786532 85.27287 4.318149 9.889542       5.743190 
1 1 1 16  2  11 o 75.44270 2.938396 69.55266       5.391783 71.54392       7.347932 67.22975       7.936276 76.42688 3.958819 74.03135 4.419225 2.395531       5.933110 
1 1 1 16  2  12 o 95.09394 2.918279 110.4534       6.754628 110.0753       9.190941 110.8975       9.960355 94.83017 3.986089 95.14802 4.306916 -0.3178482     5.868427 
1 1 1 16  2  13 o 123.4875 2.385620 186.0063       7.178941 183.9281       10.05286 188.1691       10.25527 122.6835 3.365722 124.0878 3.394614 -1.404305      4.780323 
1 1 1 16  2  14 o 146.2583 2.550072 260.9953       9.088850 261.2882       12.74586 260.6924       12.96407 146.2450 3.576448 146.0710 3.642011 0.1739960      5.104432 
1 1 1 16  2  15 o 168.0761 2.713662 344.7770       11.11470 340.1600       15.52262 349.6346       15.92212 166.8116 3.818588 169.1122 3.863579 -2.300598      5.432205 
1 1 1 16  2  16 o 120.1556 2.472124 176.1734       7.238527 177.2819       10.17605 175.0381       10.29870 120.3963 3.472033 119.6229 3.536787 0.7734222      4.956196 
1 1 1 16  2  17 o 68.43428 2.618011 57.25042       4.357923 58.31654       6.165998 56.18634       6.160074 68.96004 3.682541 67.67710 3.749809 1.282936       5.255680 
1 1 1 16  2  18 o 109.7051 2.537635 146.9202       6.784094 150.1861       9.637007 143.7117       9.551874 110.7576 3.575213 108.3344 3.623244 2.423187       5.090191 
1 1 1 16  2  19 o 69.38225 2.759950 58.89405       4.657129 57.23393       6.521045 60.62219       6.653295 68.25106 3.937487 70.25385 3.901572 -2.002792      5.543110 
1 1 1 16  2  20 o 30.43854 5.133507 11.70147       3.672482 11.18539       5.463277 12.12692       4.960412 29.43972 7.572456 30.70458 6.808097 -1.264864      10.18294 
1 1 1 16  2  21 o 44.91913 3.898835 24.92233       4.225555 23.58141       6.104300 26.15603       5.855158 43.29112 5.942986 45.76091 5.351530 -2.469784      7.997372 
1 1 1 16  2  22 o 106.4899 3.545534 139.1714       9.187988 131.3709       15.60893 143.3073       11.36568 102.6759 6.268198 107.8729 4.332426 -5.196976      7.619725 
1 1 1 16  2  23 f 111.2646 4.442611 152.7867       12.02147 152.7867       12.02147 0.000000       0.000000 111.2646 4.442611 ?        ?        0.000000       4.442611 
1 1 1 16  2  24 o 42.32975 4.233685 22.31545       4.308636 23.22489       6.155156 21.44165       6.033332 42.71947 6.084365 40.97174 6.239511 1.747734       8.714987 
1 1 1 16  2  25 f 27.92872 6.361732 10.20124       4.232668 9.558160       6.748023 10.61836       5.434710 27.30390 8.864682 28.32787 7.681060 -1.023975      11.72950 
1 1 1 16  2  26 o 110.8851 3.167394 151.5385       8.549999 150.7978       12.04530 152.2906       12.13828 109.9771 4.504009 110.5139 4.516691 -0.5367889     6.378604 
1 1 1 16  2  27 o 55.29019 3.773773 38.11631       5.054156 43.07594       7.402974 33.78640       6.917055 58.18166 5.278758 51.32731 5.622020 6.854351       7.711834 
1 1 1 16  2  28 o 25.54090 6.354249 8.795091       3.938761 16.81036       5.909707 2.388984       5.283283 35.16118 7.141112 18.33865 7.483556 16.82253       10.34404 
1 1 1 16  2  29 o 36.89690 5.132905 17.77507       4.490396 26.51357       6.491265 9.756090       6.218284 44.60604 6.133976 26.23647 8.508969 18.36957       10.48943 
1 1 1 16  2  30 o 18.87325 6.801742 4.464197       3.998970 5.793138       6.364604 3.597345       5.140330 21.75572 8.425058 18.81692 7.485064 2.938801       11.26977 
1 1 1 16  2  31 o 51.83533 3.981700 34.62905       4.991055 40.25106       7.317759 29.73893       6.824830 54.52333 5.586471 46.27974 6.207953 8.243587       8.351487 
1 1 1 16  2  32 o 50.14429 4.599712 33.55323       5.558114 25.13725       9.471991 37.97291       6.864109 37.22046 10.16042 52.47955 5.446430 -15.25909      11.52813 
1 1 1 16  2  33 o 22.65004 6.592176 7.957112       3.857548 7.450665       5.572778 8.423028       5.345132 21.33680 7.971984 22.44517 7.887031 -1.108364      11.21418 
1 1 1 16  2  34 o 16.07693 6.248714 3.465802       3.510904 1.110368       4.998140 5.760092       4.932840 15.11888 6.730066 19.06890 7.408136 -3.950017      10.00871 
1 1 1 16  2  35 o 14.92426 6.117481 2.738125       3.550089 1.860533       4.893117 3.713515       5.158561 15.15404 6.707000 16.71869 7.144626 -1.564657      9.799465 
1 1 1 16  2  36 o 13.29707 5.687241 1.739735       3.273702 5.585225       4.783829 -1.647259      4.489594 17.63485 7.148938 12.18501 5.756371 5.449841       9.178405 
1 1 1 16  2  37 o 12.85213 5.670731 1.446117       3.472153 3.323410       4.787769 -0.6365718     5.042889 15.08843 6.658140 12.85431 6.080998 2.234120       9.017171 
1 1 1 16  2  38 o 10.91857 5.305578 -3.063887      4.461558 -3.063887      4.461558 0.000000       0.000000 10.91857 5.305578 ?        ?        0.000000       5.305578 
1 1 1 16  3  0  f 103.8522 2.201284 131.4715       5.570931 132.6790       7.791732 130.2086       7.968204 104.2609 3.070081 103.2789 3.169766 0.9819794      4.412801 
1 1 1 16  3  1  o 170.7034 2.623850 355.2850       10.91484 360.8548       15.46090 349.7512       15.41106 171.9809 3.689082 169.3115 3.735165 2.669403       5.249837 
1 1 1 16  3  2  o 32.90203 3.016903 13.31278       2.392013 10.76707       3.062643 17.29465       3.830316 29.37381 4.415040 37.39828 4.279873 -8.024471      6.148975 
1 1 1 16  3  3  o 205.8438 2.947951 516.7416       14.78748 531.3571       21.14971 502.7635       20.68338 208.6413 4.159759 202.9479 4.182162 5.693329       5.898650 
1 1 1 16  3  4  o 106.2931 2.443533 137.7516       6.329353 146.7993       9.550576 130.6659       8.451898 109.6296 3.579715 103.4393 3.357440 6.190269       4.907826 
1 1 1 16  3  5  o 73.41765 2.648243 65.81358       4.730230 64.96161       6.183937 67.01508       7.343679 72.88358 3.491921 73.97987 4.089375 -1.096291      5.377407 
1 1 1 16  3  6  o 44.93042 3.081917 24.74060       3.353971 23.78490       4.225951 26.36716       5.513127 43.96099 3.988114 46.18564 4.976881 -2.224648      6.377648 
1 1 1 16  3  7  o 95.69837 2.708909 111.7801       6.310996 110.8009       8.365388 113.0736       9.614634 95.21391 3.611917 96.14343 4.113219 -0.9295197     5.473985 
1 1 1 16  3  8  o 283.7629 4.054419 983.2992       28.03628 987.8826       36.02825 976.2628       44.64036 284.2191 5.201802 282.2552 6.490075 1.963898       8.317440 
1 1 1 16  3  9  o 46.15345 2.924320 26.09088       3.272097 31.17237       3.934508 14.69401       5.892336 50.44019 3.217719 33.95084 7.336448 16.48935       8.011065 
1 1 1 16  3  10 o 86.69718 2.487506 91.74684       5.249960 90.09232       6.440384 95.02368       9.063657 85.86990 3.082762 88.08662 4.234786 -2.216728      5.238018 
1 1 1 16  3  11 o 163.8006 2.882479 327.3709       11.50582 319.1758       14.35246 342.1094       19.24767 161.6705 3.643004 167.1851 4.729127 -5.514633      5.969600 
1 1 1 16  3  12 o 173.6918 2.984659 368.1816       12.63310 361.7101       15.86067 379.4122       20.89388 172.0748 3.782404 176.0188 4.875762 -3.943924      6.170870 
1 1 1 16  3  13 o 180.7420 2.773755 398.6340       12.21696 398.6580       17.12410 398.6091       17.43489 180.6169 3.890571 180.5960 3.961638 0.2084351E-01  5.552577 
1 1 1 16  3  14 o 144.9993 2.528305 256.5194       8.933699 243.3627       12.24664 271.4839       13.06095 141.0939 3.564682 149.0666 3.595492 -7.972733      5.063055 
1 1 1 16  3  15 o 181.1900 2.806200 400.7307       12.39050 398.4587       17.29355 403.1272       17.76145 180.5202 3.931174 181.5611 4.014390 -1.040833      5.618670 
1 1 1 16  3  16 o 136.2194 2.541620 226.4501       8.436953 215.5150       11.59526 238.7531       12.29914 132.7374 3.587977 139.7113 3.615531 -6.973938      5.093687 
1 1 1 16  3  17 o 188.7726 2.912425 435.1895       13.39769 437.5385       18.81553 432.7735       19.08165 189.0727 4.083679 188.0235 4.164547 1.049210       5.832657 
1 1 1 16  3  18 o 18.22324 5.744750 4.032038       2.849735 2.235942       4.157562 5.623651       3.913746 17.33247 6.781710 21.44414 6.728511 -4.111666      9.553243 
1 1 1 16  3  19 o 61.90257 2.852141 46.91536       4.290886 44.52973       6.079351 49.28361       6.057168 60.13654 4.174329 63.31329 3.945503 -3.176750      5.743868 
1 1 1 16  3  20 o 49.76109 3.599876 30.47134       4.335782 34.72376       5.587990 24.03827       6.873000 53.02214 4.363340 43.58148 6.684533 9.440659       7.982588 
1 1 1 16  3  21 o 106.1138 3.064957 137.8574       7.917298 142.2211       9.624643 128.7244       13.92394 107.6700 3.673589 101.9549 5.626065 5.715057       6.719216 
1 1 1 16  3  22 o 21.49918 6.359223 5.836033       3.564981 5.576111       5.312374 6.048985       4.808490 22.32458 7.861336 22.50573 7.492126 -0.1811581     10.85968 
1 1 1 16  3  23 o 47.17066 4.571574 27.68934       5.189210 18.61850       9.117051 32.03615       6.311253 37.36473 9.868060 50.62683 5.188970 -13.26211      11.14917 
1 1 1 16  3  24 o 57.07086 3.542046 40.18884       4.901837 34.64718       6.897609 45.84321       6.967407 52.50444 5.471133 60.67791 4.749819 -8.173470      7.245280 
1 1 1 16  3  25 o 73.73001 3.891095 67.29505       6.966458 63.57893       8.149074 77.38403       13.42724 71.39780 4.709990 77.67201 7.174977 -6.274216      8.582791 
1 1 1 16  3  26 o 14.87782 6.079079 1.190866       3.491771 2.306080       4.967915 0.1020191      4.908837 18.16703 7.313527 16.14522 6.935904 2.021807       10.07941 
1 1 1 16  3  27 o 59.72273 3.550798 44.34821       5.144426 38.76371       7.131134 50.40834       7.428614 55.10501 5.378851 63.14785 4.864875 -8.042835      7.252521 
1 1 1 16  3  28 o 14.80850 6.059583 1.304100       3.475681 2.018795       4.777713 0.5006741      5.065623 17.37052 7.105817 16.44490 7.054904 0.9256172      10.01321 
1 1 1 16  3  29 o 30.06390 5.796795 12.12305       4.092938 8.287824       5.451647 17.07730       6.196141 24.43287 7.970310 34.87422 7.512897 -10.44135      10.95306 
1 1 1 16  3  30 o 15.96429 6.314378 2.381289       3.638583 5.030565       5.196188 -0.1675310     5.096721 20.27512 7.671542 15.58875 6.874649 4.686373       10.30113 
1 1 1 16  3  31 o 23.15524 7.199701 7.876122       4.491787 6.734177       7.841839 8.433745       5.479815 22.60651 9.157132 23.70895 7.999446 -1.102434      12.15912 
1 1 1 16  3  32 o 46.42839 4.857265 29.11976       5.414327 28.07073       9.405569 29.63967       6.621448 40.04301 9.734709 45.60904 6.111176 -5.566032      11.49396 
1 1 1 16  3  33 o 9.102268 4.447157 -5.065111      3.256260 0.4942224      4.672688 -10.31380      4.540260 14.63262 6.510824 9.469131 4.734031 5.163492       8.049961 
1 1 1 16  3  34 o 13.27906 5.699466 1.117246       3.309064 2.677257       4.518034 -0.6879390     4.860115 15.91086 6.738631 13.78632 6.333192 2.124536       9.247620 
1 1 1 16  3  35 o 11.99292 5.378253 0.3889129E-01  3.255152 -2.346786      4.524172 2.599504       4.687112 12.15801 5.754029 15.53319 6.725708 -3.375177      8.851215 
1 1 1 16  3  36 o 14.27275 6.158904 2.270224       3.903880 -0.6564939     4.635734 9.407150       7.239085 12.85577 6.001689 19.98938 8.500430 -7.133609      10.40565 
1 1 1 16  3  37 o 14.49178 6.239555 2.971945       3.989598 0.7317445      4.731061 8.486457       7.422813 13.32470 6.166574 18.26705 8.161853 -4.942352      10.22949 
1 1 1 16  3  38 o 15.57228 6.185956 4.484167       3.506249 5.081365       4.978837 3.896589       4.938579 15.88511 6.904607 15.01761 6.687114 0.8674994      9.612028 
1 1 1 16  4  0  o 202.9846 2.893096 502.4308       14.31074 498.2507       20.04029 506.7804       20.44260 202.0602 4.069930 203.7788 4.116622 -1.718552      5.788861 
1 1 1 16  4  1  o 223.8954 3.378258 611.4778       18.43207 640.6389       24.42631 572.9138       28.08968 229.0855 4.375464 216.5414 5.323164 12.54410       6.890628 
1 1 1 16  4  2  o 45.88960 2.563914 25.75579       2.855772 28.38116       3.775224 22.24399       4.366286 48.12869 3.237702 42.47414 4.276594 5.654549       5.363951 
1 1 1 16  4  3  o 179.6259 2.943488 393.4964       12.88449 389.0350       19.61385 396.8831       17.08885 178.4378 4.514282 180.3358 3.888612 -1.897995      5.958191 
1 1 1 16  4  4  o 138.9322 2.614685 235.3631       8.852347 241.6893       13.43987 230.5155       11.76489 140.6663 3.924582 137.4075 3.516400 3.258835       5.269479 
1 1 1 16  4  5  o 160.3903 2.799089 313.7292       10.94034 307.2340       16.40228 318.9348       14.68390 158.5714 4.248493 161.6590 3.727396 -3.087616      5.651829 
1 1 1 16  4  6  o 211.5590 3.649282 546.2253       18.81374 555.8818       26.24551 536.0184       26.98310 213.2632 5.050135 209.3201 5.294117 3.943115       7.316525 
1 1 1 16  4  7  o 141.4097 3.457401 244.0249       11.91420 264.8001       19.52831 231.7070       15.03701 147.0370 5.459549 137.6491 4.488828 9.387848       7.067974 
1 1 1 16  4  8  o 161.2275 3.660135 317.3143       14.38044 321.5188       23.27829 314.7195       18.28723 161.9453 5.908474 160.4046 4.683391 1.540726       7.539511 
1 1 1 16  4  9  o 314.5997 4.926945 1210.272       37.77219 1145.609       50.88669 1289.619       56.36889 305.5744 6.833624 324.1111 7.136898 -18.53671      9.880979 
1 1 1 16  4  10 o 117.7745 2.858799 169.2272       8.204860 163.9094       10.75561 176.6295       12.68959 115.7883 3.817053 120.1438 4.341351 -4.355484      5.780763 
1 1 1 16  4  11 o 281.0493 4.532835 965.8096       31.04477 958.6985       43.00049 973.5513       44.86683 279.5544 6.312058 281.6425 6.537189 -2.088135      9.087184 
1 1 1 16  4  12 o 33.54032 4.403481 13.98904       3.512295 19.04030       4.328073 4.246493       6.010785 39.18605 4.621160 21.82065 8.252192 17.36540       9.458001 
1 1 1 16  4  13 o 40.69426 4.021821 20.43762       3.936244 22.38762       4.914260 16.94717       6.574807 42.49736 4.830900 36.41856 7.652011 6.078796       9.049357 
1 1 1 16  4  14 o 73.14363 2.580442 65.36030       4.592253 72.43638       7.143581 60.37646       5.995173 76.88951 3.824530 70.21338 3.515030 6.676132       5.194466 
1 1 1 16  4  15 o 82.85294 2.604952 83.85482       5.252956 80.12379       8.027125 86.64931       6.946995 80.83414 4.088288 84.14982 3.394689 -3.315674      5.313945 
1 1 1 16  4  16 o 226.0828 3.204115 624.3806       17.65273 618.1876       24.54992 631.0107       25.40130 224.6846 4.483743 226.9753 4.592416 -2.290649      6.418273 
1 1 1 16  4  17 o 94.77571 2.438018 109.6964       5.626124 110.1701       7.832575 109.1916       8.086585 94.87906 3.393110 94.44041 3.519912 0.4386520      4.889067 
1 1 1 16  4  18 o 157.6689 2.930680 303.6880       11.26032 299.9142       14.44916 309.5246       17.96926 156.5500 3.787505 158.7980 4.648544 -2.247925      5.996178 
1 1 1 16  4  19 o 149.7306 3.166872 274.1001       11.55519 276.4135       13.72067 268.4565       21.42998 150.2587 3.747137 147.4224 5.977558 2.836349       7.054944 
1 1 1 16  4  20 o 64.69154 2.913222 51.25694       4.580800 51.95626       6.159474 50.39146       6.852215 64.99918 3.906688 63.92528 4.426006 1.073906       5.903537 
1 1 1 16  4  21 o 123.1030 2.796918 185.2752       8.390435 181.2761       10.93903 190.9902       13.07685 121.5583 3.697117 124.6241 4.312408 -3.065811      5.680276 
1 1 1 16  4  22 o 48.88980 3.486294 29.44836       4.126284 23.96469       5.595994 35.98252       6.108528 43.71928 5.364850 53.84451 4.702563 -10.12522      7.134123 
1 1 1 16  4  23 o 129.9518 3.160381 206.9992       10.00824 203.4595       14.08841 210.6055       14.22009 128.3633 4.510873 130.6146 4.474208 -2.251312      6.353465 
1 1 1 16  4  24 o 71.41353 3.681090 62.91470       6.384472 50.92168       10.71888 69.50898       7.948201 63.14942 7.087546 74.88641 4.374465 -11.73700      8.328821 
1 1 1 16  4  25 o 32.77808 4.915540 13.65121       3.805443 9.416633       5.310369 18.12123       5.456004 26.74228 7.720243 37.47744 6.189952 -10.73516      9.895335 
1 1 1 16  4  26 o 36.75071 4.707431 17.11589       4.119176 17.65334       6.036543 16.64758       5.634959 36.53387 7.035648 35.55675 6.750094 0.9771194      9.750083 
1 1 1 16  4  27 o 64.67371 3.999358 52.28262       6.272263 46.42941       7.247959 69.73857       12.51672 60.52098 4.957854 72.83675 7.143646 -12.31578      8.695516 
1 1 1 16  4  28 o 46.18127 4.013646 26.89709       4.472091 23.01789       6.164148 31.20791       6.498036 41.70005 6.259000 49.05937 5.531634 -7.359322      8.353087 
1 1 1 16  4  29 o 59.76772 4.272338 45.46714       6.181512 51.59404       10.54393 42.25847       7.630354 61.41861 7.180095 56.76218 5.588729 4.656437       9.098772 
1 1 1 16  4  30 o 35.42797 5.416577 16.80698       4.528049 18.69741       5.929608 14.16253       7.013165 36.42451 6.933503 30.32254 8.906280 6.101978       11.28695 
1 1 1 16  4  31 o 18.32818 6.535022 4.439563       3.680821 1.343758       5.186996 7.579859       5.224135 16.51501 7.112648 22.65319 7.807063 -6.138178      10.56125 
1 1 1 16  4  32 o 24.89367 6.257961 9.133574       3.791598 1.980025       5.263839 16.84754       5.466139 16.69370 7.177078 33.48791 6.926891 -16.79420      9.974582 
1 1 1 16  4  33 o 12.12072 5.598413 -1.561724      3.871516 -5.969902      6.433879 0.9404408      4.847316 13.39535 6.476248 15.11551 6.683429 -1.720153      9.306450 
1 1 1 16  4  34 o 14.65558 5.945394 2.432271       3.311375 1.511402       4.498173 3.521735       4.892641 14.88724 6.515121 16.84415 7.066246 -1.956910      9.611381 
1 1 1 16  4  35 o 13.20854 5.880242 0.6998465      3.816497 3.965159       4.683527 -5.753730      6.584318 16.63188 6.940854 12.98373 6.339274 3.648150       9.400098 
1 1 1 16  4  36 o 14.75297 6.028191 3.065995       3.433645 -2.576730      4.766533 9.152701       4.950504 11.98977 5.738971 21.22994 7.577782 -9.240175      9.505713 
1 1 1 16  4  37 f 8.614388 4.246281 -4.767920      3.182820 -10.03844      4.462892 0.6874650      4.540485 8.861381 4.465714 13.12890 6.063634 -4.267515      7.530621 
1 1 1 16  4  38 o 12.88428 5.626517 1.970152       3.339184 2.058895       4.567036 1.868224       4.894600 13.63387 6.216259 13.67160 6.307633 -0.3772068E-01 8.855965 
1 1 1 16  5  0  o 289.4502 4.548628 1022.882       32.08414 1005.445       62.05198 1029.245       37.48351 286.0236 8.913495 290.2450 5.299554 -4.221405      10.36994 
1 1 1 16  5  1  o 55.77112 2.414060 37.99183       3.273135 40.05222       4.510671 35.70031       4.756966 57.21156 3.248702 53.97153 3.638095 3.240028       4.877479 
1 1 1 16  5  2  o 300.1532 3.855152 1099.416       28.19815 1080.690       39.35171 1119.180       40.42641 297.3604 5.430558 302.6006 5.482256 -5.240204      7.716611 
1 1 1 16  5  3  o 125.1971 2.492655 191.1110       7.604884 174.1668       10.89932 207.1862       10.61613 119.4091 3.750288 130.2784 3.346704 -10.86930      5.026438 
1 1 1 16  5  4  o 213.5449 3.666803 556.4697       19.08152 542.1443       35.72256 562.1890       22.57142 210.2477 6.981971 214.5770 4.316580 -4.329269      8.208580 
1 1 1 16  5  5  o 242.0713 4.004428 715.3430       23.62217 665.5027       43.49003 736.2007       28.13412 232.7743 7.677381 245.4870 4.702932 -12.71272      9.003319 
1 1 1 16  5  6  o 149.9341 3.491640 274.3240       12.75751 273.4772       20.18400 274.8873       16.46303 149.4282 5.552577 149.9450 4.510615 -0.5168304     7.153794 
1 1 1 16  5  7  o 127.0109 3.372794 196.9913       10.42995 189.8836       12.18542 216.4673       20.17090 124.6387 4.017160 132.8004 6.250433 -8.161713      7.430040 
1 1 1 16  5  8  o 90.01041 2.420022 98.87034       5.303395 100.8084       6.415523 94.68789       9.424646 90.85842 2.901268 87.92307 4.412824 2.935349       5.281133 
1 1 1 16  5  9  f 255.9210 4.200422 800.1599       26.19600 756.0978       35.03720 856.0116       39.44712 248.4779 5.786361 264.3059 6.124524 -15.82802      8.425662 
1 1 1 16  5  10 f 226.9941 3.458750 629.0313       19.13242 622.7622       24.08593 639.7504       31.49506 225.7292 4.378644 228.5522 5.654848 -2.822983      7.151911 
1 1 1 16  5  11 o 54.22394 2.841331 35.97367       3.741373 38.86394       4.382118 28.20098       7.186227 56.33573 3.205234 47.52825 6.364409 8.807476       7.125955 
1 1 1 16  5  12 o 297.3229 4.232331 1080.721       30.66508 1096.483       39.42844 1056.593       48.78420 299.1675 5.408279 293.2026 6.827713 5.964905       8.710175 
1 1 1 16  5  13 o 39.97625 3.426103 19.66007       3.305481 19.56826       3.814364 19.93692       6.623882 39.81456 3.984863 39.66536 7.114118 0.1492004      8.154128 
1 1 1 16  5  14 o 100.3048 2.864785 122.9071       6.995276 124.8065       7.734634 114.3726       16.39522 101.0509 3.144797 96.11733 7.048718 4.933525       7.718431 
1 1 1 16  5  15 o 110.6394 2.550070 149.3782       6.875399 153.0035       8.802272 143.7054       11.01096 111.8759 3.232045 108.2996 4.180021 3.576340       5.283814 
1 1 1 16  5  16 o 125.5914 2.638795 192.5278       8.076096 197.2007       10.42320 185.5083       12.77494 126.9912 3.371131 123.0323 4.267381 3.958839       5.438296 
1 1 1 16  5  17 o 146.8444 2.867270 263.3390       10.26035 272.9127       16.12608 256.8271       13.29963 149.1866 4.440650 144.8483 3.771027 4.338379       5.825806 
1 1 1 16  5  18 o 120.0182 2.771601 175.9266       8.106134 194.3535       12.97183 164.1206       10.38313 125.8780 4.234809 115.7579 3.685493 10.12017       5.613953 
1 1 1 16  5  19 o 153.9571 3.244503 289.8596       12.17262 271.5399       16.96138 309.3159       17.47968 148.6467 4.688278 158.7049 4.524290 -10.05827      6.515301 
1 1 1 16  5  20 o 76.49443 2.991662 71.64945       5.565963 65.59084       7.989436 77.36296       7.758561 72.94825 4.516482 79.33566 4.026233 -6.387413      6.050550 
1 1 1 16  5  21 o 21.93487 5.718168 6.166786       3.087315 6.636574       4.514445 5.754038       4.231520 23.12641 7.222065 21.75697 7.016171 1.369440       10.06901 
1 1 1 16  5  22 o 72.10281 3.091158 63.77536       5.418756 68.83825       7.986246 59.45597       7.376570 74.66074 4.409123 69.37317 4.385869 5.287575       6.219020 
1 1 1 16  5  23 o 43.78870 3.915037 23.76792       4.133642 25.33165       6.261585 22.56002       5.503261 44.75951 5.882955 42.30840 5.465295 2.451111       8.029858 
1 1 1 16  5  24 o 123.7347 3.126230 188.0415       9.418913 180.1848       13.25884 196.0458       13.38273 120.5987 4.519557 125.8687 4.369686 -5.269974      6.286538 
1 1 1 16  5  25 o 31.16732 5.054692 12.40559       3.707714 9.853175       5.573180 14.43228       4.966160 27.29672 7.917560 33.28973 6.353442 -5.993013      10.15155 
1 1 1 16  5  26 o 67.96530 3.276282 57.10855       5.410328 58.62651       7.716886 55.64106       7.587476 68.36623 4.659810 66.57576 4.707108 1.790466       6.623496 
1 1 1 16  5  27 o 13.96551 6.011875 0.1684657E-01  3.702461 -3.201677      6.399947 1.635872       4.539153 16.05006 7.333472 16.80037 6.905303 -0.7503071     10.07288 
1 1 1 16  5  28 o 67.18530 4.986380 57.73277       8.105663 55.18597       10.61657 61.29223       12.55101 64.34020 6.877757 67.01261 7.833359 -2.672409      10.42425 
1 1 1 16  5  29 f 14.88367 6.413510 0.3502163      4.221776 -0.3070964     4.774943 2.704301       9.036355 15.18681 6.677349 21.73481 9.374528 -6.548004      11.50951 
1 1 1 16  5  30 o 32.96933 5.212991 14.53123       4.049169 17.21466       5.766954 11.92199       5.686669 34.76716 7.048329 28.29923 7.930106 6.467930       10.60969 
1 1 1 16  5  31 o 19.33057 6.798449 5.132380       3.972069 5.474115       5.248913 4.674439       6.076150 20.24799 7.698991 19.93632 8.065969 0.3116665      11.15053 
1 1 1 16  5  32 o 27.00651 5.822517 10.50576       3.718985 7.912503       5.223637 13.17135       5.295988 22.36590 7.801383 28.93528 7.462293 -6.569384      10.79571 
1 1 1 16  5  33 o 11.04232 5.102973 -1.528740      3.222719 -4.186528      4.469545 1.349356       4.651102 11.56210 5.540414 15.18430 6.635489 -3.622199      8.644414 
1 1 1 16  5  34 o 9.235875 4.510142 -4.850564      3.336816 -2.766118      4.110833 -8.876671      5.713170 11.56068 5.475337 11.33088 5.604495 0.2297974      7.835156 
1 1 1 16  5  35 o 14.56811 6.216468 2.249724       3.895088 -3.827945      7.174629 4.789657       4.638120 14.07287 6.812266 17.31870 7.032456 -3.245834      9.790936 
1 1 1 16  5  36 o 20.48426 6.302723 7.333784       3.452802 6.796222       4.783584 7.918477       4.988883 18.64935 7.280954 19.70955 7.503111 -1.060196      10.45509 
1 1 1 16  5  37 o 13.19965 5.715673 1.986717       3.385475 2.337642       4.617646 1.578846       4.978232 14.20680 6.385574 13.91190 6.397767 0.2949009      9.039191 
1 1 1 16  5  38 o 7.661248 3.841478 -6.657649      3.094150 -7.696788      4.211687 -5.439150      4.560701 8.995578 4.506412 10.10781 5.000965 -1.112235      6.731820 
1 1 1 16  6  0  o 244.6989 4.031388 730.7651       24.03934 733.3419       34.29177 728.2751       33.70924 244.9243 5.745421 244.0877 5.667180 0.8366699      8.070117 
1 1 1 16  6  1  o 307.4999 4.754722 1154.803       35.62921 1148.760       49.85626 1161.110       50.93570 306.3477 6.678345 307.9669 6.787067 -1.619110      9.521795 
1 1 1 16  6  2  o 208.1548 3.540371 528.6392       17.95856 517.5559       24.65775 541.1595       26.20751 205.8338 4.915874 210.4532 5.110154 -4.619476      7.090803 
1 1 1 16  6  3  o 161.1526 3.523365 316.8677       13.83665 314.5422       22.45540 318.2910       17.56807 160.2740 5.758747 161.3850 4.471401 -1.110947      7.290857 
1 1 1 16  6  4  o 55.84216 2.828933 38.12785       3.837106 33.30787       5.532934 42.59396       5.325957 52.04103 4.404196 58.96056 3.725861 -6.919529      5.768794 
1 1 1 16  6  5  o 160.8922 3.109287 315.7799       12.19079 335.6110       16.91469 294.3445       17.58562 165.7354 4.191422 155.1534 4.656421 10.58203       6.265004 
1 1 1 16  6  6  o 138.9254 2.608870 235.3686       8.832224 238.3132       11.00862 230.0492       14.79632 139.7590 3.232340 137.1625 4.432542 2.596527       5.485932 
1 1 1 16  6  7  o 225.2281 3.418686 619.0793       18.76368 641.6586       24.15400 584.7161       29.79763 229.1887 4.324737 218.5234 5.600228 10.66528       7.075727 
1 1 1 16  6  8  o 282.0261 4.477448 971.9706       30.77201 964.0981       35.09967 998.1208       63.97097 280.7535 5.130288 284.3001 9.245869 -3.546631      10.57383 
1 1 1 16  6  9  o 64.83952 2.723655 51.37455       4.293976 49.61057       4.608199 63.00183       11.83107 63.69626 2.977037 71.32016 6.893118 -7.623898      7.508517 
1 1 1 16  6  10 o 198.5978 3.505227 481.5487       16.96394 470.5350       19.05264 523.6804       37.26422 196.2552 3.983803 206.2422 7.426564 -9.986954      8.427606 
1 1 1 16  6  11 o 132.9262 2.893286 215.6129       9.372125 213.3250       10.46549 224.8782       21.06056 132.1934 3.248732 135.2106 6.410047 -3.017273      7.186304 
1 1 1 16  6  12 o 226.0786 3.839878 624.5240       21.15500 620.3450       23.98528 639.1630       44.89113 225.2274 4.370061 227.4684 8.111465 -2.240967      9.213756 
1 1 1 16  6  13 o 59.04275 2.947579 42.65685       4.227588 43.31394       4.518476 38.04078       11.97611 59.48105 3.128287 54.66655 9.324193 4.814507       9.834976 
1 1 1 16  6  14 o 109.7224 2.606624 146.9102       6.969633 146.6459       8.379068 147.5037       12.55588 109.5416 3.142170 109.6573 4.709633 -0.1157684     5.661614 
1 1 1 16  6  15 f 109.2312 2.639974 145.6209       7.027204 146.1278       8.484357 144.5136       12.54068 109.3334 3.187823 108.5103 4.754114 0.8230972      5.723969 
1 1 1 16  6  16 o 59.55288 2.956028 43.41716       4.276495 42.30793       4.921017 46.83923       8.643479 58.73428 3.453407 61.45902 5.841354 -2.724747      6.785826 
1 1 1 16  6  17 o 208.4949 3.042565 531.0647       15.45865 543.2475       21.71223 518.5402       22.01456 210.6130 4.230416 205.7272 4.391189 4.885788       6.097456 
1 1 1 16  6  18 o 170.1962 2.754474 353.7976       11.42417 363.5079       15.97321 343.6291       16.34566 172.3277 3.803654 167.5078 4.004344 4.819855       5.522912 
1 1 1 16  6  19 o 88.47000 2.599253 95.67700       5.597700 94.85873       7.397981 96.77292       8.561564 87.98088 3.457284 88.78556 3.967097 -0.8046799     5.262193 
1 1 1 16  6  20 o 41.99670 3.475007 21.73797       3.524565 18.28681       4.889989 25.46941       5.084684 38.15490 5.410802 45.29074 4.674065 -7.135841      7.150082 
1 1 1 16  6  21 o 24.02552 5.785959 7.423570       3.346896 4.566361       5.878138 8.794215       4.071282 21.79508 8.178369 26.10796 6.439819 -4.312878      10.40947 
1 1 1 16  6  22 o 60.89423 3.210446 45.55704       4.747232 44.89616       7.046343 46.10633       6.423942 60.13276 4.849682 61.05357 4.346138 -0.9208183     6.512167 
1 1 1 16  6  23 o 67.27704 2.939746 55.56184       4.807985 52.78019       6.573994 58.76087       7.049967 65.32523 4.151113 68.92461 4.217557 -3.599380      5.917729 
1 1 1 16  6  24 o 67.31136 3.166291 55.76170       5.179123 55.93765       7.553940 55.60562       7.114564 67.03341 4.653184 66.91180 4.387449 0.1216125      6.395454 
1 1 1 16  6  25 o 56.17473 3.463187 39.04362       4.717768 36.36937       6.913088 41.37475       6.454370 53.63934 5.360468 57.49137 4.646525 -3.852032      7.093998 
1 1 1 16  6  26 o 28.32562 6.207558 10.58816       4.166278 19.83661       7.687374 6.741929       4.957483 38.08849 8.498254 23.02866 7.605304 15.05984       11.40443 
1 1 1 16  6  27 o 26.50688 5.477405 9.242143       3.421029 12.16709       5.205523 7.018430       4.538842 29.89345 7.226404 23.04800 7.247937 6.845453       10.23492 
1 1 1 16  6  28 o 13.06283 5.585876 0.2201093      3.156837 -3.188744      4.774392 2.868080       4.207949 13.39217 6.196728 17.46523 6.825885 -4.073058      9.219118 
1 1 1 16  6  29 o 29.08783 5.424443 11.30747       3.703646 10.66863       5.545042 11.82202       4.976461 27.19531 7.900303 28.95520 7.106515 -1.759888      10.62626 
1 1 1 16  6  30 o 23.32450 7.235190 7.843081       4.539176 8.194371       5.221064 6.755538       9.186483 23.71432 7.803641 23.58631 9.771579 0.1280117      12.50522 
1 1 1 16  6  31 o 17.14509 6.245925 3.763734       3.384010 4.331272       4.926912 3.256895       4.655996 18.82266 7.377316 17.54705 7.074476 1.275610       10.22120 
1 1 1 16  6  32 o 15.60446 6.253543 2.621474       3.614866 3.018285       4.824655 2.113619       5.458142 17.05106 7.074322 16.83655 7.273908 0.2145081      10.14671 
1 1 1 16  6  33 o 13.48264 5.784533 1.064077       3.406043 -1.598448      4.176419 6.351944       5.885693 12.50160 5.788516 20.03701 7.996503 -7.535407      9.871726 
1 1 1 16  6  34 o 12.82328 5.558129 0.8724893      3.207751 1.227946       4.326075 0.4383747      4.780827 14.40640 6.344196 14.29144 6.453906 0.1149645      9.049957 
1 1 1 16  6  35 o 11.30549 5.131972 -0.3579957     3.070092 -2.964762      4.198715 2.636977       4.500511 11.31590 5.408250 15.26260 6.599504 -3.946703      8.532446 
1 1 1 16  6  36 o 13.06605 5.900651 0.8603948      3.996536 -0.2274064     7.692587 1.262553       4.677310 14.96859 7.197687 13.89844 6.318982 1.070158       9.577903 
1 1 1 16  6  37 o 13.82814 5.753971 2.742939       3.205062 4.791791       4.396011 0.4179784      4.682859 16.07200 6.717091 13.00148 6.057191 3.070520       9.044826 
1 1 1 16  6  38 o 18.54910 6.301263 6.737799       3.400483 8.107795       4.609454 5.101904       5.036949 18.73870 7.192676 15.76523 6.896934 2.973476       9.965053 
1 1 1 16  7  0  o 226.6688 3.437359 626.7873       18.98685 647.9118       30.55995 613.5064       24.23108 230.2447 5.446618 224.1635 4.435798 6.081131       7.024383 
1 1 1 16  7  1  o 249.3843 3.682817 758.8755       22.38131 763.0749       35.51187 756.1084       28.82728 249.8020 5.833667 248.8098 4.754448 0.9921875      7.525719 
1 1 1 16  7  2  o 148.9138 2.976420 270.4578       10.80103 236.9073       18.78198 287.0359       13.20256 139.0940 5.552267 153.3793 3.532282 -14.28532      6.580629 
1 1 1 16  7  3  o 172.5956 3.217245 363.3961       13.53162 374.7397       18.55485 350.5093       19.77675 175.1831 4.346394 169.3176 4.797941 5.865570       6.473900 
1 1 1 16  7  4  f 147.7116 3.364569 266.2088       12.11100 276.5674       14.60507 243.4062       21.66924 150.4645 3.986724 140.8626 6.328817 9.601959       7.479833 
1 1 1 16  7  5  o 199.7478 3.474247 486.8875       16.91137 476.8911       23.01722 498.6141       24.92968 197.5529 4.781160 201.9032 5.070857 -4.350220      6.969439 
1 1 1 16  7  6  o 51.92484 2.691887 32.97145       3.394554 33.16450       3.640704 31.68689       9.391363 52.06335 2.880803 50.18782 7.942900 1.875523       8.449183 
1 1 1 16  7  7  o 112.7624 2.455778 155.0626       6.748227 150.0106       8.067015 166.8375       12.31575 110.8473 2.989152 116.7800 4.335216 -5.932663      5.265845 
1 1 1 16  7  8  o 272.8655 3.932008 909.3123       26.14563 910.8935       33.21300 906.7357       42.39714 272.9084 4.994074 271.9591 6.397302 0.9493713      8.115803 
1 1 1 16  7  9  o 174.1961 2.941955 370.2391       12.48850 373.6281       15.58724 364.1638       20.86996 174.9258 3.656616 172.4697 4.970796 2.456070       6.170871 
1 1 1 16  7  10 o 111.4140 2.498934 151.4089       6.784698 150.0784       8.130533 154.4602       12.31228 110.8557 3.012505 112.3058 4.507996 -1.450180      5.421920 
1 1 1 16  7  11 o 180.5777 3.011876 397.9747       13.25371 395.4784       16.43850 402.6120       22.40463 179.9284 3.749093 181.2800 5.076679 -1.351563      6.310972 
1 1 1 16  7  12 o 150.8123 2.771825 277.5461       10.18682 271.1983       12.38409 290.8282       17.91376 149.0200 3.410227 154.0771 4.776805 -5.057083      5.869200 
1 1 1 16  7  13 o 74.58104 2.551098 67.94652       4.629690 67.07898       5.318493 70.66016       9.406353 74.07075 2.952410 75.77173 5.124366 -1.700981      5.914039 
1 1 1 16  7  14 o 119.4991 2.619623 174.2666       7.628506 172.8837       9.162970 177.3900       13.77061 118.9396 3.164169 120.2653 4.707781 -1.325737      5.672316 
1 1 1 16  7  15 o 106.9683 2.620487 139.6516       6.830827 137.4734       8.091569 145.0541       12.74306 106.0465 3.134564 108.6952 4.822922 -2.648651      5.752049 
1 1 1 16  7  16 o 59.88123 2.853205 43.88474       4.151535 40.75713       4.726057 54.45362       8.687742 57.64971 3.378888 66.37473 5.418262 -8.725014      6.385487 
1 1 1 16  7  17 o 30.43496 4.484981 11.59241       3.226760 11.60034       3.654962 11.56437       6.870321 30.33066 5.127550 30.16079 8.803089 0.1698666      10.18755 
1 1 1 16  7  18 o 154.9643 2.810066 293.3609       10.61168 295.8788       13.76024 289.6661       16.66899 155.4922 3.631461 153.6189 4.457467 1.873322       5.749481 
1 1 1 16  7  19 o 88.73780 2.564252 96.25443       5.539236 97.17628       7.315879 95.01597       8.479656 89.05746 3.377129 87.96785 3.965851 1.089607       5.208933 
1 1 1 16  7  20 o 53.25505 2.936729 34.78406       3.796438 32.55550       5.212069 37.30274       5.540959 51.33470 4.203190 54.97910 4.166744 -3.644402      5.918493 
1 1 1 16  7  21 o 80.65819 2.917382 79.69733       5.724820 71.21125       8.098188 88.17475       8.094050 75.97247 4.392903 84.66355 3.933890 -8.691086      5.896871 
1 1 1 16  7  22 o 37.76171 3.588943 17.65503       3.262933 21.04817       4.685615 14.46038       4.546497 41.03333 4.775009 33.69296 5.743111 7.340370       7.468871 
1 1 1 16  7  23 o 17.99876 6.056379 3.812938       3.141077 -0.3279679     5.493120 5.824740       3.828812 16.88278 7.295538 21.52003 6.639819 -4.637251      9.864689 
1 1 1 16  7  24 o 54.93650 4.058768 37.47173       5.395274 26.81820       10.74343 41.06466       6.239074 44.27166 10.17216 57.40533 4.495811 -13.13367      11.12138 
1 1 1 16  7  25 o 95.72588 3.008112 112.8016       7.008419 101.9019       9.702479 124.6934       10.13443 90.44459 4.415486 100.1901 4.159911 -9.745544      6.066413 
1 1 1 16  7  26 o 47.28498 3.695988 27.87406       4.225012 18.57975       6.060487 36.66224       5.893164 37.43960 6.896676 53.98411 4.521164 -16.54451      8.246518 
1 1 1 16  7  27 o 22.44907 6.058349 6.721791       3.390538 10.74179       5.073177 3.476819       4.557983 27.99834 7.345332 18.64567 7.153564 9.352671       10.25316 
1 1 1 16  7  28 o 78.99818 3.127583 77.62950       6.009010 69.99084       8.495477 85.27732       8.500571 74.03115 4.733896 82.09226 4.263838 -8.061111      6.371035 
1 1 1 16  7  29 o 20.40495 6.253826 5.656473       3.403570 4.892612       5.073579 6.281524       4.589494 20.17305 7.592043 21.55627 7.320512 -1.383221      10.54652 
1 1 1 16  7  30 o 71.70973 3.234407 64.81762       5.637538 60.84513       7.983312 68.76902       7.962095 68.08388 4.843372 72.73651 4.514239 -4.652634      6.620922 
1 1 1 16  7  31 o 23.59389 6.412766 8.148212       3.782778 11.26642       4.882068 3.463810       5.983815 27.23827 7.233987 18.68135 7.824280 8.556917       10.65598 
1 1 1 16  7  32 o 10.03791 4.858479 -4.733174      3.646590 -0.9855395     4.164125 -17.06140      7.552583 13.05426 5.945704 11.81926 5.936807 1.235000       8.402206 
1 1 1 16  7  33 o 9.720392 4.604604 -2.546900      2.909913 -3.634037      3.974376 -1.290712      4.272225 11.01464 5.263593 12.79623 5.899899 -1.781590      7.906593 
1 1 1 16  7  34 o 9.972406 4.685572 -1.963292      2.902850 -1.273381      4.138331 -2.631576      4.072950 12.39050 5.745745 11.51180 5.451557 0.8786974      7.920420 
1 1 1 16  7  35 f 17.77356 6.034814 5.165975       3.118944 3.398915       4.173562 7.401061       4.693842 15.67695 6.547943 19.86883 7.336542 -4.191878      9.833636 
1 1 1 16  7  36 o 12.46550 5.479993 1.133736       3.214886 -0.9353636     4.240631 3.930114       4.929895 12.09705 5.677329 15.82443 6.874479 -3.727382      8.915747 
1 1 1 16  7  37 o 11.46923 5.168511 0.4753560      3.047490 -0.9716499     4.009916 2.453885       4.688904 11.56833 5.457494 14.21746 6.408658 -2.649132      8.417549 
1 1 1 16  7  38 o 15.36277 6.841278 4.601012       5.169826 0.000000       0.000000 4.601012       5.169826 ?        ?        15.36277 6.841278 0.000000       6.841278 
1 1 1 16  8  0  o 196.0219 3.147788 468.6808       15.03648 462.2153       23.69467 473.0399       19.45598 194.4436 5.004746 196.8624 4.055592 -2.418839      6.441685 
1 1 1 16  8  1  o 97.36494 2.475336 115.6606       5.868411 107.6198       9.011440 121.5816       7.732880 93.81802 3.950434 99.78549 3.184154 -5.967468      5.073930 
1 1 1 16  8  2  o 192.2828 3.415029 451.0927       16.00187 465.1774       22.12697 435.6500       23.16912 195.1503 4.652825 188.7479 5.041741 6.402405       6.860608 
1 1 1 16  8  3  f 202.3440 3.534847 499.6091       17.42999 514.1397       24.12944 483.7541       25.20518 205.1341 4.826956 198.8680 5.205498 6.266068       7.099064 
1 1 1 16  8  4  f 89.93678 2.352917 98.69073       5.152369 98.18770       7.256831 99.20210       7.316638 89.64557 3.327641 90.10733 3.337848 -0.4617615     4.713218 
1 1 1 16  8  5  o 131.8198 2.339416 211.8750       7.514917 218.2664       10.19850 204.2817       11.11609 133.7553 3.128881 129.3288 3.530424 4.426514       4.717392 
1 1 1 16  8  6  o 311.4379 4.354681 1184.937       33.04943 1141.929       41.15640 1263.023       55.45656 305.4876 5.528505 320.8378 7.093022 -15.35019      8.993072 
1 1 1 16  8  7  o 215.2207 3.311898 565.2930       17.36989 544.7098       21.39766 605.0646       29.74382 211.1681 4.158165 222.3505 5.489370 -11.18239      6.886474 
1 1 1 16  8  8  o 74.98485 2.422162 68.64368       4.420208 69.82333       5.175212 65.46225       8.498927 75.60155 2.813973 73.01109 4.803507 2.590454       5.567057 
1 1 1 16  8  9  o 236.0370 3.925017 680.5796       22.57656 686.6953       25.78740 660.5061       46.71917 237.0060 4.464903 231.3613 8.299894 5.644760       9.424627 
1 1 1 16  8  10 o 74.42569 2.448689 67.63647       4.435075 67.43982       5.107392 68.23937       8.942992 74.29091 2.826312 74.51270 4.953237 -0.2217941     5.702859 
1 1 1 16  8  11 o 98.49678 2.493912 118.4238       5.981222 125.3572       7.124134 101.8636       11.01010 101.3102 2.888594 91.08595 4.979187 10.22421       5.756413 
1 1 1 16  8  12 o 21.72416 4.428086 5.982171       2.264590 5.801566       2.447449 7.057106       5.970904 21.35112 4.818646 24.72869 8.350198 -3.377567      9.640806 
1 1 1 16  8  13 o 63.68658 2.584435 49.57299       4.002640 51.77795       4.577112 42.40578       8.252131 65.06488 2.893989 58.48812 5.869011 6.576763       6.543735 
1 1 1 16  8  14 o 127.0801 2.654982 197.0958       8.221958 196.8829       9.837942 197.5889       14.97281 126.9261 3.183170 126.9038 4.850573 0.2236176E-01  5.801778 
1 1 1 16  8  15 o 122.7688 2.649005 183.9739       7.925140 185.5391       9.479419 180.3400       14.44418 123.2034 3.159960 121.1920 4.900939 2.011353       5.831342 
1 1 1 16  8  16 o 54.41224 2.897613 36.26007       3.828284 35.21828       4.270749 40.52073       8.636782 53.58275 3.286529 57.01596 6.322255 -3.433212      7.125460 
1 1 1 16  8  17 o 35.23009 3.816726 15.36578       3.224457 14.56043       3.583340 18.79296       7.392043 34.19087 4.402815 38.18217 8.190079 -3.991299      9.298504 
1 1 1 16  8  18 o 20.06323 5.884851 5.048918       3.063705 4.493307       3.297512 8.555366       8.283895 19.30241 6.190719 27.71990 9.811823 -8.417494      11.60159 
1 1 1 16  8  19 o 100.4147 2.501612 123.1473       6.121438 124.8589       8.046409 120.7956       9.431734 100.9730 3.274429 99.20740 3.908970 1.765556       5.099209 
1 1 1 16  8  20 o 124.2269 2.943925 188.7475       8.912064 180.3323       12.51706 197.3995       12.69189 121.1061 4.247890 126.7489 4.114544 -5.642830      5.913886 
1 1 1 16  8  21 o 100.7366 2.576235 124.1415       6.319057 118.2250       8.146337 133.0794       10.01260 98.15681 3.410879 104.0240 3.957037 -5.867149      5.224197 
1 1 1 16  8  22 o 27.62362 4.769873 9.682069       3.094837 3.567450       4.641905 14.57509       4.152411 19.31893 7.263757 33.94519 5.183920 -14.62626      8.923855 
1 1 1 16  8  23 o 18.79146 5.544533 4.472439       2.712829 5.213017       3.936623 3.802675       3.743685 20.67763 6.774591 18.56143 6.593481 2.116194       9.453522 
1 1 1 16  8  24 o 65.52503 2.821899 52.78062       4.495371 45.19395       5.784968 64.34496       7.142263 60.35991 3.954712 72.02574 4.085988 -11.66583      5.686391 
1 1 1 16  8  25 o 14.79319 5.572922 2.088927       2.735287 2.843186       3.879346 1.343212       3.857309 17.35120 6.613712 15.63162 6.388488 1.719584       9.195323 
1 1 1 16  8  26 o 27.04973 6.027986 9.684641       3.871840 10.30086       7.152978 9.429270       4.604753 27.69335 9.134990 26.47396 7.023005 1.219393       11.52261 
1 1 1 16  8  27 o 42.86173 4.371921 23.31680       4.502573 13.20491       7.027821 30.35734       5.864180 30.46475 8.906684 48.67175 5.015926 -18.20700      10.22196 
1 1 1 16  8  28 o 14.03775 5.702248 1.314379       3.050728 6.254778       4.619124 -2.507934      4.062953 21.73727 7.344395 12.51196 5.763333 9.225307       9.335746 
1 1 1 16  8  29 o 13.35219 5.662446 0.5838258      3.197257 -1.623926      4.587927 2.668376       4.458077 13.85549 6.283206 17.23202 6.931248 -3.376524      9.355259 
1 1 1 16  8  30 f 13.74683 5.685948 1.220300       3.103530 4.368591       4.423075 -1.832957      4.355806 18.75193 7.081753 13.17514 6.031248 5.576788       9.301998 
1 1 1 16  8  31 o 38.58213 4.051550 19.52718       3.752520 19.48143       5.171922 19.57804       5.452951 37.13631 5.913101 36.91118 6.287460 0.2251320      8.631160 
1 1 1 16  8  32 o 23.41873 5.868170 8.109780       3.341744 5.244847       4.559380 11.43526       4.912197 18.95836 7.183187 26.65077 7.333797 -7.692404      10.26561 
1 1 1 16  8  33 o 16.95124 6.765729 3.856274       4.213785 3.856274       4.213785 0.000000       0.000000 16.95124 6.765729 ?        ?        0.000000       6.765729 
1 1 1 16  8  34 o 21.82202 6.145613 7.622086       3.406395 6.374520       4.566436 9.187275       5.114808 19.30967 7.216018 22.30143 7.723123 -2.991762      10.56965 
1 1 1 16  8  35 o 10.43877 4.845358 -1.144382      2.953779 -4.543052      3.825206 3.875220       4.648736 9.963928 4.857606 16.18831 6.844798 -6.224386      8.393306 
1 1 1 16  8  36 o 13.10242 5.537790 1.992151       3.040892 6.390453       4.030686 -3.818509      4.632861 18.25751 6.788000 11.10944 5.400195 7.148072       8.674045 
1 1 1 16  8  37 o 11.28784 5.204844 -0.1275180     3.325854 -3.228921      4.581112 3.328864       4.836183 11.05948 5.374541 14.78969 6.599453 -3.730212      8.511079 
1 1 1 16  9  0  o 106.7758 2.776776 139.1297       7.219070 135.5354       10.35606 142.5272       10.06862 105.2951 4.043507 107.9984 3.831823 -2.703331      5.570711 
1 1 1 16  9  1  o 96.37641 2.513857 113.3336       5.898973 116.3536       9.288690 111.2923       7.636664 97.55647 3.915122 95.45587 3.287863 2.100601       5.112556 
1 1 1 16  9  2  o 77.26685 2.620635 72.88628       4.927276 78.46892       6.263937 63.82572       7.980038 80.13663 3.214121 72.14356 4.562486 7.993065       5.580936 
1 1 1 16  9  3  o 171.6933 2.869062 359.5492       12.00410 362.1062       18.14520 357.5591       16.00772 172.1362 4.329107 171.1483 3.838140 0.9878845      5.785542 
1 1 1 16  9  4  o 277.5000 3.960151 940.2057       26.78002 951.5952       41.70782 932.2162       34.93202 278.7752 6.139419 276.1152 5.191552 2.659943       8.040192 
1 1 1 16  9  5  o 117.0899 2.267602 167.1680       6.470271 166.3745       8.577139 168.2158       9.856333 116.7410 3.017501 117.3511 3.450356 -0.6101532     4.583696 
1 1 1 16  9  6  o 116.6212 2.493531 165.8640       7.086443 168.9478       8.602631 159.3538       12.49926 117.6383 3.003321 114.1054 4.503976 3.532890       5.413477 
1 1 1 16  9  7  f 263.2856 3.831458 846.5107       24.58257 874.1526       31.67268 804.6307       38.98557 267.3675 4.861163 256.2162 6.243977 11.15131       7.913164 
1 1 1 16  9  8  o 86.82892 2.875281 92.08543       6.075492 92.30897       7.810006 91.74283       9.668591 86.86552 3.697964 86.50294 4.603230 0.3625717      5.904631 
1 1 1 16  9  9  o 177.4487 3.406314 384.4325       14.72969 382.7386       19.92022 386.4760       21.87917 176.8484 4.626258 177.6348 5.059521 -0.7863464     6.855729 
1 1 1 16  9  10 o 199.2287 4.153691 485.1593       20.16611 484.2888       24.06280 487.2134       36.96300 198.9153 4.964115 198.7594 7.645643 0.1558838      9.115827 
1 1 1 16  9  11 o 74.55834 2.443740 67.88448       4.434046 70.12698       5.117701 61.13276       8.880050 75.75687 2.776849 70.45671 5.208815 5.300156       5.902765 
1 1 1 16  9  12 o 153.0797 2.788010 285.9907       10.40035 281.0621       12.52444 296.9388       18.66670 151.6958 3.388039 155.6355 4.927997 -3.939697      5.980298 
1 1 1 16  9  13 o 48.25025 2.653646 28.49697       3.108159 29.55126       3.423812 23.55711       7.411159 49.11842 2.872960 43.13696 7.311008 5.981457       7.855237 
1 1 1 16  9  14 o 41.77427 2.801503 21.39840       2.835424 20.50132       3.065916 26.70059       7.453749 40.85504 3.102688 46.06908 6.847318 -5.214035      7.517476 
1 1 1 16  9  15 o 156.8123 2.876417 300.2710       10.99178 315.9395       13.56916 270.3663       18.74601 160.7728 3.463413 148.3452 5.193614 12.42761       6.242504 
1 1 1 16  9  16 o 52.83862 2.774879 34.18707       3.560465 38.31655       4.013625 18.93506       7.713517 55.92968 2.955306 38.30152 8.487531 17.62816       8.987325 
1 1 1 16  9  17 o 72.15527 3.384766 63.80905       5.935000 61.45193       6.699320 72.40703       12.79493 70.73849 3.901431 76.19272 6.968156 -5.454224      7.986011 
1 1 1 16  9  18 o 64.39542 3.529287 50.89875       5.517146 50.57217       6.295207 51.98037       11.45643 64.11356 4.049943 64.28429 7.451051 -0.1707230     8.480578 
1 1 1 16  9  19 o 47.85429 4.713343 28.41312       5.425230 29.27452       6.390783 26.19089       10.26476 48.42444 5.513784 44.73488 9.696315 3.689564       11.15439 
1 1 1 16  9  20 o 21.53296 6.353914 5.849443       3.562554 4.331272       3.820688 15.95947       9.859552 19.46390 6.677700 35.05858 10.62410 -15.59468      12.54843 
1 1 1 16  9  21 o 62.70821 3.120871 48.28035       4.754113 46.43103       5.142355 59.15882       12.47211 61.44042 3.448405 68.23996 7.630542 -6.799541      8.373569 
1 1 1 16  9  22 o 80.20636 2.546009 78.78587       4.969976 75.33383       6.387928 84.08038       7.911059 78.27930 3.356505 82.56995 3.943059 -4.290657      5.178208 
1 1 1 16  9  23 o 50.20333 2.888685 31.00721       3.519097 32.82188       4.726418 28.74974       5.271610 51.48123 3.794103 47.98539 4.562998 3.495834       5.934321 
1 1 1 16  9  24 o 41.71307 3.233953 21.53647       3.261660 21.57616       4.274565 21.48115       5.046255 41.50960 4.287410 41.17858 5.140414 0.3310204      6.693708 
1 1 1 16  9  25 o 39.19211 3.361119 19.09433       3.179134 18.08590       4.124330 20.57077       4.990418 37.81784 4.567706 40.15330 5.223830 -2.335464      6.939189 
1 1 1 16  9  26 o 73.21337 2.931915 66.22587       5.220339 66.23862       7.243681 66.21208       7.529988 72.74259 4.102972 72.64688 4.272309 0.9571075E-01  5.923428 
1 1 1 16  9  27 o 38.18539 4.204996 18.52772       3.848203 16.85708       4.918705 21.16383       6.178626 35.73372 5.850843 39.73603 6.613068 -4.002312      8.829781 
1 1 1 16  9  28 o 22.64028 7.727192 6.913600       5.114497 0.000000       0.000000 6.913600       5.114497 ?        ?        22.64028 7.727192 0.000000       7.727192 
1 1 1 16  9  29 o 14.79030 5.703212 2.196103       2.907388 0.5331381      4.135800 3.820811       4.087951 14.74729 6.351244 18.07136 6.811833 -3.324061      9.313397 
1 1 1 16  9  30 o 14.17332 5.614223 1.876625       2.880317 0.7815868      4.128404 2.915172       4.020507 14.74532 6.347927 16.71004 6.628539 -1.964719      9.177892 
1 1 1 16  9  31 o 16.81407 5.843952 3.834612       2.929806 1.610831       4.080996 6.199739       4.208695 15.16171 6.412094 20.42875 7.008583 -5.267037      9.499220 
1 1 1 16  9  32 o 27.44333 5.125402 10.65711       3.301665 11.31219       4.520841 9.908344       4.833325 26.81699 6.883524 24.55060 7.438256 2.266388       10.13462 
1 1 1 16  9  33 o 12.56420 5.350209 0.9873804      2.874593 1.628231       3.966082 0.2781436      4.172332 14.50205 6.232267 13.63202 6.102984 0.8700361      8.722819 
1 1 1 16  9  34 o 12.66913 5.538644 0.8254632      3.243444 2.487357       4.112576 -1.909093      5.275405 15.04493 6.402745 13.23883 6.249863 1.806103       8.947397 
1 1 1 16  9  35 o 36.63437 5.412544 20.62901       4.686692 23.07947       5.735743 15.70619       8.129677 37.02014 6.600002 24.02958 9.458880 12.99055       11.53388 
1 1 1 16  9  36 o 11.15035 5.159662 -0.5335041     3.310657 2.232101       4.616834 -3.460896      4.749955 14.27335 6.402692 11.33818 5.501318 2.935176       8.441503 
1 1 1 16  9  37 o 12.08837 5.349791 1.209004       3.112631 1.924202       4.106076 0.2427778      4.772578 13.40159 6.022746 12.79420 6.010319 0.6073875      8.508666 
1 1 1 16  10 0  o 123.5890 2.599087 186.2560       7.827748 190.3107       12.69983 183.7718       9.940506 124.7788 4.182493 122.6861 3.327962 2.092758       5.344959 
1 1 1 16  10 1  o 104.9735 3.241796 134.5648       8.282865 132.1135       12.58543 136.4377       11.00124 103.8534 4.987495 105.6153 4.283320 -1.761909      6.574339 
1 1 1 16  10 2  o 50.08600 3.017862 30.71181       3.666337 30.27012       6.060950 30.96671       4.604258 49.50286 5.097053 50.22572 3.789774 -0.7228661     6.351561 
1 1 1 16  10 3  o 157.4651 2.747448 302.4174       10.54265 294.4039       15.59638 309.1599       14.30616 155.2135 4.127090 159.1473 3.688821 -3.933853      5.535365 
1 1 1 16  10 4  o 120.1611 2.283157 176.0539       6.685527 173.3589       8.882304 179.5760       10.15440 119.1646 3.061273 121.2533 3.440041 -2.088715      4.604918 
1 1 1 16  10 5  o 253.8478 3.390950 786.4527       20.97640 810.7903       29.66838 762.1259       29.66183 257.5446 4.727213 249.6705 4.875226 7.874161       6.790756 
1 1 1 16  10 6  o 129.8295 2.586913 205.5853       8.184484 210.3745       10.01726 195.9686       14.19478 131.3022 3.130698 126.5343 4.611170 4.767868       5.573523 
1 1 1 16  10 7  o 76.44639 2.876191 71.40131       5.348544 70.40848       6.703685 73.14029       8.872037 75.84991 3.637391 77.19509 4.739100 -1.345184      5.974084 
1 1 1 16  10 8  o 48.40763 2.668156 28.67275       3.135294 30.18635       3.513776 22.76038       6.944630 49.65295 2.916822 42.51069 6.943150 7.142265       7.530948 
1 1 1 16  10 9  o 125.8567 2.561700 193.2284       7.856708 187.8500       9.334269 206.2988       14.55117 124.0597 3.087547 129.7920 4.607907 -5.732323      5.546689 
1 1 1 16  10 10 o 129.8979 2.600979 205.8599       8.233323 208.1259       9.927778 200.8684       14.73469 130.5739 3.120036 128.0366 4.730622 2.537308       5.666870 
1 1 1 16  10 11 o 77.00693 2.407921 72.41077       4.513091 69.55417       5.082213 83.06528       9.815100 75.44449 2.769024 82.21870 4.921304 -6.774208      5.646833 
1 1 1 16  10 12 o 131.4395 2.621636 210.8186       8.397194 210.0210       9.989670 212.7395       15.50226 131.1492 3.125716 131.7123 4.838059 -0.5631714     5.759941 
1 1 1 16  10 13 o 138.4822 2.681485 234.0571       9.049102 236.7464       10.88563 228.0420       16.28003 139.2252 3.208481 136.3365 4.908131 2.888702       5.863796 
1 1 1 16  10 14 o 131.4267 2.830798 210.8888       9.066269 207.6711       9.960428 226.4348       21.89361 130.3904 3.134702 135.4079 6.655334 -5.017502      7.356618 
1 1 1 16  10 15 o 66.80568 2.509014 54.54977       4.077370 52.69215       4.326749 69.28529       12.18612 65.63929 2.710799 74.64372 6.773063 -9.004433      7.295397 
1 1 1 16  10 16 o 94.36909 2.593190 108.8116       5.957833 106.7528       6.429554 121.3177       15.84662 93.44684 2.826700 98.91880 6.611843 -5.471962      7.190737 
1 1 1 16  10 17 o 30.03609 3.553214 11.19093       2.550462 12.49542       2.712148 1.218511       7.498848 31.75931 3.565862 20.97120 8.769438 10.78811       9.466700 
1 1 1 16  10 18 o 133.2328 6.837519 220.5646       22.12539 0.000000       0.000000 220.5646       22.12539 ?        ?        133.2328 6.837519 0.000000       6.837519 
1 1 1 16  10 19 o 130.1212 2.883676 207.0314       9.143884 207.7264       10.10478 203.8898       21.48418 130.2894 3.182598 127.8868 6.919547 2.402603       7.616368 
1 1 1 16  10 20 o 88.78340 2.712708 96.47858       5.862208 92.52181       6.276240 123.5347       16.41203 86.90318 2.968011 99.34914 6.820322 -12.44595      7.438137 
1 1 1 16  10 21 o 92.95641 2.703568 105.8143       6.117741 99.33990       8.394711 113.1473       8.934036 89.83391 3.843566 95.88742 3.831115 -6.053513      5.426826 
1 1 1 16  10 22 o 68.25509 2.732123 57.14571       4.535163 55.94025       6.374989 58.38090       6.453104 67.29628 3.904099 68.76211 3.866665 -1.465828      5.494824 
1 1 1 16  10 23 o 53.52360 3.251795 35.34132       4.221344 33.67968       4.508315 47.16087       12.02394 52.17963 3.566948 59.95895 8.464360 -7.779320      9.185233 
1 1 1 16  10 24 o 14.27049 5.101062 2.203160       2.244116 2.345321       3.025058 2.029176       3.346557 15.59614 5.863856 15.64794 6.095419 -0.5179787E-01 8.458070 
1 1 1 16  10 25 o 24.23853 4.441951 7.549349       2.527054 9.740388       3.280802 4.353123       3.962540 27.42904 5.095864 19.28505 6.789641 8.143986       8.489232 
1 1 1 16  10 26 o 36.15806 3.425029 16.35861       2.981927 14.94225       3.636442 19.26595       5.210007 34.22816 4.466121 38.43213 5.738513 -4.203972      7.271641 
1 1 1 16  10 27 o 38.66248 3.459823 18.77218       3.225297 20.12282       4.398588 17.20147       4.743424 39.58345 4.648470 36.16517 5.560021 3.418274       7.247214 
1 1 1 16  10 28 o 19.32214 5.442804 5.019279       2.671526 3.107309       3.615422 7.318791       3.964938 16.91418 6.399281 22.96920 6.682801 -6.055021      9.252601 
1 1 1 16  10 29 o 13.63032 5.424792 1.581890       2.701403 1.581764       3.700432 1.582033       3.952762 15.06720 6.218129 15.40330 6.398066 -0.3361044     8.921904 
1 1 1 16  10 30 o 17.06854 6.319912 3.658932       3.487341 7.006747       7.607887 2.768380       3.923855 22.39567 9.038239 16.36697 6.530057 6.028694       11.15040 
1 1 1 16  10 31 o 13.03091 5.313715 1.406921       2.661335 -1.691916      3.631813 5.000636       3.911074 11.78284 5.435203 18.69712 6.728074 -6.914284      8.649185 
1 1 1 16  10 32 f 22.57708 5.541383 7.491140       3.025718 8.437134       4.176444 6.446154       4.389528 22.96156 6.905152 20.17258 7.142164 2.788975       9.934365 
1 1 1 16  10 33 o 21.31521 5.817078 6.988440       3.105235 9.268263       4.311098 4.530323       4.476501 23.51090 7.002833 17.54829 6.983536 5.962618       9.889866 
1 1 1 16  10 34 o 21.33795 6.187321 7.482649       3.403966 12.50706       5.031821 3.243149       4.622105 26.14683 7.504783 15.90539 6.778989 10.24144       10.11318 
1 1 1 16  10 35 o 16.54215 5.997172 4.540870       3.114661 6.275782       4.099578 2.172176       4.790212 18.41306 6.845777 14.66894 6.555246 3.744123       9.478181 
1 1 1 16  10 36 o 12.65860 5.604180 1.313422       3.418700 1.093898       3.858247 2.115559       7.375202 12.86337 5.804450 15.24012 7.251329 -2.376751      9.288349 
1 1 1 16  10 37 o 14.65567 5.782902 3.655627       3.045201 5.998240       3.918412 0.8307653E-01  4.838927 17.16464 6.620406 12.70368 5.993731 4.460967       8.930542 
1 1 1 16  11 0  o 172.4523 3.419791 362.8932       14.37159 353.7668       19.81172 373.0297       20.87926 170.0845 4.784682 174.6405 4.910948 -4.556015      6.856427 
1 1 1 16  11 1  o 130.5210 3.454041 208.0360       10.97646 217.6806       17.64665 201.9497       14.01835 133.2968 5.444041 128.4971 4.483668 4.799683       7.052721 
1 1 1 16  11 2  o 60.67635 2.883648 45.00956       4.251608 51.99991       7.494321 41.69207       5.162827 65.05682 4.760140 58.33010 3.650408 6.726715       5.998701 
1 1 1 16  11 3  o 118.9567 2.832913 172.6108       8.212177 169.1302       14.80012 174.1591       9.871171 117.4850 5.182229 119.4120 3.395673 -1.926987      6.195651 
1 1 1 16  11 4  o 140.9426 2.408360 242.2450       8.271791 239.0226       11.14654 246.1947       12.34052 139.9526 3.268309 141.9710 3.569788 -2.018433      4.839962 
1 1 1 16  11 5  o 250.6668 3.359150 766.8994       20.51929 781.7953       28.79016 751.5210       29.25268 252.8889 4.671736 247.9139 4.842044 4.974991       6.728336 
1 1 1 16  11 6  o 126.5004 2.611953 195.1923       8.051809 184.3879       11.75000 204.7575       11.05565 122.8026 3.931465 129.4590 3.507648 -6.656479      5.268777 
1 1 1 16  11 7  o 190.5341 3.093751 443.0460       14.36462 443.7499       17.86114 441.7569       24.17040 190.6021 3.845434 189.9034 5.227914 0.6987305      6.489873 
1 1 1 16  11 8  o 172.0043 3.216984 361.1451       13.48418 358.8871       15.06325 370.2531       30.25231 171.4255 3.605846 173.3851 7.175470 -1.959549      8.030535 
1 1 1 16  11 9  o 268.4944 3.907906 880.8890       25.56911 884.6842       32.29923 874.5181       41.84810 268.8448 4.930085 266.8691 6.434893 1.975647       8.106392 
1 1 1 16  11 10 o 56.63730 2.519567 39.21186       3.468774 41.19619       3.860516 30.89607       7.902972 58.03902 2.737251 49.69860 6.695623 8.340420       7.233527 
1 1 1 16  11 11 o 105.9969 2.856337 137.2336       7.371276 137.2336       7.371276 0.000000       0.000000 105.9969 2.856337 ?        ?        0.000000       2.856337 
1 1 1 16  11 12 o 154.6208 3.570313 292.1437       13.45272 291.4895       15.75284 293.9061       25.85598 154.3069 4.193147 154.3320 6.892331 -0.2503967E-01 8.067634 
1 1 1 16  11 13 o 85.13464 4.626616 89.03097       9.562483 100.6604       13.64342 77.80200       13.40648 90.25430 6.241696 79.13314 7.025095 11.12115       9.397379 
1 1 1 16  11 14 o 42.33112 7.907407 22.87895       7.857112 0.000000       0.000000 22.87895       7.857112 ?        ?        42.33112 7.907407 0.000000       7.907407 
1 1 1 16  11 15 o 58.43315 6.470635 42.60087       9.059655 0.000000       0.000000 42.60087       9.059655 ?        ?        58.43315 6.470635 0.000000       6.470635 
1 1 1 16  11 16 o 21.72760 7.549046 5.284819       4.888670 0.9497361      6.711295 10.18515       7.135430 19.77109 8.283854 28.70470 9.095626 -8.933605      12.30255 
1 1 1 16  11 17 o 50.75481 5.056694 31.97294       6.171188 21.91982       9.010614 40.85440       8.469275 41.03520 9.234521 57.20663 6.172865 -16.17143      11.10768 
1 1 1 16  11 18 o 82.95873 3.115019 84.29296       6.286180 84.10004       6.999030 85.09797       14.29689 82.81097 3.476007 82.44307 7.188054 0.3679047      7.984406 
1 1 1 16  11 19 o 105.1079 3.224847 135.3716       8.250241 134.3723       9.348429 138.8908       17.54394 104.6317 3.672088 105.4336 6.865634 -0.8019028     7.785959 
1 1 1 16  11 20 o 17.70264 7.366518 1.055759       5.253576 -3.392830      6.661674 8.373820       8.544177 16.77069 7.591607 27.49564 9.937788 -10.72494      12.50568 
1 1 1 16  11 21 o 103.1618 2.674729 130.3337       6.718436 129.1416       7.242372 137.6901       17.99097 102.6431 2.898344 104.4573 7.110109 -1.814163      7.678154 
1 1 1 16  11 22 o 34.80567 3.365005 15.02015       2.818565 15.17607       2.939752 13.24510       9.918900 34.96353 3.497202 32.10209 10.76195 2.861435       11.31592 
1 1 1 16  11 23 o 51.71613 2.445124 32.83851       3.072779 36.12251       3.978712 27.98463       4.837104 54.13898 3.027820 47.35691 4.236157 6.782070       5.206988 
1 1 1 16  11 24 o 10.72079 4.469177 0.3419828      1.938704 2.546959       2.581999 -2.507793      2.935347 15.27847 5.470439 10.35378 4.814196 4.924692       7.287124 
1 1 1 16  11 25 o 19.84561 5.259788 5.156904       2.584344 5.681768       2.698241 -0.6693658     8.989849 20.80505 5.306108 20.63890 9.114771 0.1661530      10.54675 
1 1 1 16  11 26 o 36.03115 3.685460 16.33602       3.190444 14.87419       3.367657 29.13940       9.966486 34.22844 4.120184 45.09307 9.375870 -10.86462      10.24123 
1 1 1 16  11 27 o 47.97448 2.782520 28.58856       3.239045 26.41323       4.098940 32.20545       5.285393 45.76849 3.706794 50.25520 4.358851 -4.486706      5.721880 
1 1 1 16  11 28 o 16.85206 5.231754 3.736142       2.372856 2.823408       3.159276 4.917385       3.594060 15.99603 5.997093 19.28531 6.478302 -3.289287      8.827996 
1 1 1 16  11 29 o 22.16303 4.953235 6.672261       2.607792 9.633930       3.461367 2.784391       3.965841 26.44428 5.548579 16.60701 6.584715 9.837269       8.610761 
1 1 1 16  11 30 o 29.06586 4.136594 11.17072       2.847352 10.94935       3.887683 11.42687       4.181926 27.68696 5.940059 28.06974 6.271872 -0.3827763     8.638326 
1 1 1 16  11 31 o 14.83810 5.949780 2.319002       3.274136 -0.4171844     6.987523 3.088755       3.706176 16.49326 7.582987 16.12863 6.374840 0.3646297      9.906578 
1 1 1 16  11 32 o 17.65906 5.587815 4.584867       2.693847 3.210801       3.581510 6.374922       4.087856 15.92816 6.275661 20.02922 6.905890 -4.101061      9.331410 
1 1 1 16  11 33 o 15.79606 5.958997 3.533548       3.129835 5.197304       4.225655 1.511546       4.658435 18.10492 6.902220 14.88118 6.567101 3.223742       9.527196 
1 1 1 16  11 34 o 25.21419 5.358095 9.728926       3.190625 8.362239       4.157366 11.68751       4.976852 21.57664 6.954102 24.89998 7.548681 -3.323339      10.26363 
1 1 1 16  11 35 o 15.29149 6.005434 3.705373       3.270499 6.658276       3.974056 -2.491409      5.756950 18.79852 6.779775 12.83781 6.186664 5.960712       9.178245 
1 1 1 16  11 36 o 15.12830 5.800037 3.830268       2.994907 5.193197       3.788027 1.557873       4.891232 16.63919 6.484027 13.81609 6.349279 2.823102       9.075018 
1 1 1 16  12 0  o 35.78648 6.754299 16.20782       5.674388 16.20782       5.674388 0.000000       0.000000 35.78648 6.754299 ?        ?        0.000000       6.754299 
1 1 1 16  12 1  o 31.49736 4.300544 12.34151       3.214789 11.09501       5.430505 13.01403       3.988832 29.50166 7.529458 32.20831 5.263728 -2.706648      9.186923 
1 1 1 16  12 2  o 128.9039 3.267373 202.8945       10.25535 187.1076       16.54434 212.7456       13.06907 123.5345 5.509590 131.9212 4.070182 -8.386734      6.849960 
1 1 1 16  12 3  o 130.5181 2.858669 207.8101       9.092238 211.8427       12.69424 203.5620       13.02903 131.6470 3.961450 129.0259 4.149198 2.621109       5.736630 
1 1 1 16  12 4  o 217.1265 4.322519 576.0596       22.87103 579.1741       27.51013 569.0892       41.15544 217.5764 5.188536 214.9633 7.869742 2.613068       9.426227 
1 1 1 16  12 5  o 73.48463 2.654248 65.95600       4.745262 64.25214       6.283050 68.21828       7.239822 72.45598 3.569431 74.62340 3.995795 -2.167419      5.357912 
1 1 1 16  12 6  o 122.9579 2.469191 184.4009       7.398562 180.1138       9.165319 192.4198       12.53503 121.4452 3.099461 125.4233 4.106739 -3.978088      5.145092 
1 1 1 16  12 7  o 111.2989 2.695990 151.1279       7.312156 154.0132       8.146688 139.1702       16.58505 112.3011 2.979510 106.2959 6.432822 6.005173       7.089335 
1 1 1 16  12 8  f 198.0823 3.496978 479.1646       16.88009 472.0727       18.90148 507.1030       37.51592 196.5500 3.946270 202.7805 7.605428 -6.230545      8.568289 
1 1 1 16  12 9  o 101.6052 3.758407 126.3096       9.289807 133.2018       11.71887 114.6541       15.23961 104.2354 4.625057 96.38454 6.526785 7.850845       7.999380 
1 1 1 16  12 10 o 59.62293 6.032730 44.07924       8.644757 0.000000       0.000000 44.07924       8.644757 ?        ?        59.62293 6.032730 0.000000       6.032730 
1 1 1 16  12 11 o 120.7818 4.850175 178.9626       14.24659 0.000000       0.000000 178.9626       14.24659 ?        ?        120.7818 4.850175 0.000000       4.850175 
1 1 1 16  12 12 o 24.59480 8.871967 6.326115       6.805640 0.000000       0.000000 6.326115       6.805640 ?        ?        24.59480 8.871967 0.000000       8.871967 
1 1 1 16  12 13 o 116.9723 3.887352 167.5440       11.06545 171.1886       17.47288 165.1035       14.29808 117.8147 6.106801 115.9142 5.074095 1.900497       7.939739 
1 1 1 16  12 14 o 60.24063 4.598229 44.73173       6.699183 43.81523       10.04862 45.46498       8.988011 59.14262 7.114923 60.45707 6.187912 -1.314453      9.429336 
1 1 1 16  12 15 o 26.47464 7.649176 8.885480       5.211090 10.46894       7.442488 7.362572       7.298800 29.15473 9.295261 25.93394 9.207021 3.220787       13.08324 
1 1 1 16  12 16 o 61.88217 4.626884 47.25126       6.926836 42.56890       9.894381 51.75195       9.700545 58.20244 7.124454 64.45889 6.254076 -6.256447      9.480048 
1 1 1 16  12 17 o 98.94992 4.655113 120.5164       11.19341 127.7474       15.42871 112.4812       16.26406 101.4716 6.270112 94.95385 7.079741 6.517792       9.457116 
1 1 1 16  12 18 o 24.35407 8.078002 7.107171       5.591115 5.101328       7.103920 10.37212       9.063337 23.54347 8.955603 29.71485 10.28118 -6.171377      13.63472 
1 1 1 16  12 19 o 128.5255 4.722930 203.7306       14.76719 203.5070       20.16502 203.9891       21.68571 127.7709 6.497687 127.6946 6.995639 0.7637787E-01  9.547717 
1 1 1 16  12 20 o 59.74888 5.306499 44.52559       7.646062 38.64706       10.06287 52.55549       11.76096 54.90883 7.734477 64.19936 7.669049 -9.290531      10.89204 
1 1 1 16  12 21 o 93.79552 4.743204 109.0962       10.80632 101.4181       13.98357 120.4799       17.02682 89.76865 6.434989 97.48933 7.218252 -7.720673      9.670173 
1 1 1 16  12 22 o 78.42947 6.483374 78.01102       12.28069 78.01102       12.28069 0.000000       0.000000 78.42947 6.483374 ?        ?        0.000000       6.483374 
1 1 1 16  12 23 o 30.27077 4.265666 11.57758       3.059494 11.30956       3.207295 14.28611       10.19594 29.83916 4.554907 32.61913 10.91085 -2.779970      11.82344 
1 1 1 16  12 24 o 26.13810 2.891869 8.508106       1.811224 9.417850       2.288534 6.982981       2.963129 27.38470 3.509961 23.09944 5.366668 4.285259       6.412562 
1 1 1 16  12 25 o 10.53794 4.102845 0.8871124      1.515617 1.806800       1.968182 -0.4528263     2.375678 13.08642 4.763963 10.76884 4.723167 2.317587       6.708476 
1 1 1 16  12 26 o 30.55408 3.295973 11.72862       2.415296 16.61169       3.344152 6.403813       3.492141 36.24539 3.844713 21.83345 6.247377 14.41194       7.335635 
1 1 1 16  12 27 o 23.41500 3.894904 7.074562       2.144384 8.868320       2.752708 4.305730       3.420002 26.06450 4.496251 18.42477 6.317958 7.639729       7.754538 
1 1 1 16  12 28 f 13.18725 5.075219 1.682822       2.299193 1.513842       2.403415 3.505415       7.893253 13.09942 5.147067 20.84438 8.870543 -7.744967      10.25567 
1 1 1 16  12 29 o 20.83668 4.664392 5.883829       2.309285 10.02219       3.118714 0.8607960      3.435928 27.25061 4.875381 13.81922 5.865638 13.43139       7.627257 
1 1 1 16  12 30 o 17.85344 5.152154 4.461936       2.365471 2.756705       3.197727 6.522742       3.515348 15.46719 5.976684 21.02920 6.337575 -5.562009      8.711235 
1 1 1 16  12 31 o 11.14734 4.765615 0.4464797      2.296757 -0.3250904     3.188636 1.278420       3.311031 11.97002 5.348778 13.66388 5.776983 -1.693862      7.872926 
1 1 1 16  12 32 o 31.98878 4.012871 13.82858       3.059508 13.15634       4.094842 14.67811       4.603237 29.62218 5.880134 30.87352 6.331122 -1.251348      8.640549 
1 1 1 16  12 33 o 13.21982 5.752992 1.096082       3.465162 -3.434927      7.641073 2.269153       3.887934 14.74391 7.110804 14.72126 6.243656 0.2265549E-01  9.462915 
1 1 1 16  12 34 o 13.05039 5.393430 1.882938       2.789278 -0.2475595     3.559189 5.274153       4.490433 11.97417 5.470276 17.45710 6.978710 -5.482932      8.867147 
1 1 1 16  12 35 o 21.82701 5.727864 7.946454       3.084359 11.64101       3.993315 2.483108       4.856037 25.75884 6.392095 14.66614 6.573637 11.09270       9.169056 
1 1 1 16  12 36 o 20.90056 6.294177 8.109501       3.468292 12.40200       4.264559 -0.2762632     5.960608 25.55597 6.748883 13.42162 6.422543 12.13435       9.316463 
1 1 1 16  13 0  f 108.2155 3.434907 143.0673       9.046698 142.1438       14.01669 143.7266       11.84394 107.6601 5.359474 108.3626 4.494949 -0.7024612     6.994893 
1 1 1 16  13 1  o 209.2972 4.167580 535.0832       21.25609 542.0857       36.60651 531.5212       26.10854 210.0300 7.162702 208.4635 5.139447 1.566498       8.815794 
1 1 1 16  13 2  o 70.87284 2.859717 61.37627       4.928857 58.93073       8.978916 62.43101       5.896723 69.19124 5.367151 71.43894 3.396922 -2.247704      6.351802 
1 1 1 16  13 3  o 51.33128 3.336723 32.29573       4.151244 30.54621       6.678914 33.39706       5.299154 49.63527 5.620582 52.11388 4.208467 -2.478607      7.021548 
1 1 1 16  13 4  o 83.47971 2.688392 85.09890       5.461890 81.38647       8.905275 87.33755       6.915315 81.47175 4.502945 84.51982 3.364231 -3.048073      5.620904 
1 1 1 16  13 5  o 229.0579 3.816060 640.8598       21.30083 645.4157       29.53024 635.9182       30.75492 229.6139 5.277555 227.8641 5.538633 1.749741       7.650427 
1 1 1 16  13 6  o 179.9837 2.973589 395.3233       13.04218 392.3647       19.37713 397.7738       17.63463 179.1369 4.438827 180.4251 4.010820 -1.288193      5.982463 
1 1 1 16  13 7  o 81.65807 2.664863 81.43977       5.295758 82.69685       6.355888 78.58566       9.577035 82.24571 3.177199 79.97885 4.937904 2.266861       5.871754 
1 1 1 16  13 8  f 135.7801 3.052502 225.0471       10.10016 211.8280       12.76292 247.1981       16.52132 131.5875 3.984740 142.0378 4.779955 -10.45027      6.223032 
1 1 1 16  13 9  o 100.4976 3.749385 123.5895       9.166208 132.2098       14.62260 118.0097       11.76455 103.6442 5.812823 98.04314 4.939960 5.601097       7.628376 
1 1 1 16  13 10 o 106.0207 3.779245 137.5599       9.748469 125.3450       14.80568 146.9081       12.95229 100.8446 6.052613 109.4134 4.870009 -8.568771      7.768598 
1 1 1 16  13 11 o 37.05873 6.000690 17.29397       5.233963 18.88506       7.394557 15.69651       7.409347 38.36715 8.160136 34.90874 8.732550 3.458408       11.95179 
1 1 1 16  13 12 o 208.0619 5.580402 531.9715       28.26844 563.9543       39.44468 498.1998       40.53275 213.4645 7.594851 200.3048 8.321959 13.15970       11.26662 
1 1 1 16  13 13 o 92.91836 3.972358 105.8410       8.973931 123.9524       14.41046 94.36819       11.46930 100.2125 5.927394 87.49500 5.405592 12.71754       8.022121 
1 1 1 16  13 14 o 182.7569 4.349884 409.2555       19.37258 385.9303       30.82434 424.4837       24.90615 176.4817 7.182345 185.7327 5.508869 -9.250946      9.051724 
1 1 1 16  13 15 f 89.93565 4.601985 99.48648       10.05233 101.1743       13.46802 97.36357       15.10461 90.36700 6.152556 88.40621 7.070051 1.960793       9.372276 
1 1 1 16  13 16 o 42.97736 6.046797 23.22541       6.158003 41.07964       9.105400 8.175601       8.359761 57.25013 6.650198 27.41180 9.839897 29.83834       11.87639 
1 1 1 16  13 17 o 60.51513 5.290977 45.45779       7.724139 44.11974       10.12088 47.32433       11.95362 59.15861 7.166367 60.97965 8.256000 -1.821041      10.93244 
1 1 1 16  13 18 o 91.21290 4.683626 102.6584       10.37571 112.2620       14.35305 92.14657       15.01637 94.94524 6.238025 85.64294 7.263553 9.302307       9.574558 
1 1 1 16  13 19 o 28.68981 9.424687 10.20422       7.616766 10.20422       7.616766 0.000000       0.000000 28.68981 9.424687 ?        ?        0.000000       9.424687 
1 1 1 16  13 20 o 56.43362 7.358028 40.71913       9.878208 40.71913       9.878208 0.000000       0.000000 56.43362 7.358028 ?        ?        0.000000       7.358028 
1 1 1 16  13 21 o 163.4050 5.114495 332.0229       20.34085 312.2764       27.00110 357.9344       30.93018 157.0305 7.074207 167.6631 7.589909 -10.63252      10.37551 
1 1 1 16  13 22 o 74.70060 4.939126 69.78687       8.940589 83.76769       12.33092 54.29068       12.98199 81.25071 6.276388 64.22112 8.504018 17.02959       10.56936 
1 1 1 16  13 23 o 73.72289 4.937623 68.27430       8.819524 63.28699       11.55630 75.23099       13.64855 69.99878 6.862841 75.98580 7.467206 -5.987022      10.14188 
1 1 1 16  13 24 o 20.54368 7.678834 4.562218       5.171546 4.254151       6.600829 5.051888       8.322000 21.54779 8.510443 23.65811 9.485907 -2.110325      12.74402 
1 1 1 16  13 25 o 25.77324 7.754403 9.088517       5.266000 14.71740       7.001387 1.756294       7.990808 32.21089 8.711481 20.79509 8.889580 11.41581       12.44647 
1 1 1 16  13 26 o 11.50808 4.834843 0.3993948      2.295740 9.416932       6.418082 -0.9236680     2.458394 25.93296 8.656265 10.42482 4.674564 15.50813       9.837809 
1 1 1 16  13 27 o 26.89585 3.060411 9.128205       1.970226 10.79797       2.518112 6.492403       3.163759 29.08988 3.631046 21.77867 5.841274 7.311211       6.877861 
1 1 1 16  13 28 o 18.36858 4.160388 4.485676       1.818915 6.201540       2.281018 1.489338       3.014275 21.55129 4.489249 13.96658 5.670016 7.584707       7.232042 
1 1 1 16  13 29 o 8.243413 3.746775 -0.8186708     1.642901 -1.109926      1.994130 -0.2032691     2.898653 8.914116 4.080727 11.79932 5.194722 -2.885203      6.605866 
1 1 1 16  13 30 o 8.541020 3.895673 -0.8904083     1.795822 -0.3718512     2.367047 -1.593679      2.756577 10.44859 4.642449 10.19487 4.714226 0.2537117      6.616363 
1 1 1 16  13 31 o 12.45922 5.089555 1.319978       2.446782 -0.5036865     3.486088 3.090606       3.435022 12.25375 5.524469 15.76063 6.165010 -3.506882      8.278111 
1 1 1 16  13 32 o 13.26233 5.299821 1.906971       2.588789 2.202384       3.638249 1.604018       3.684386 14.66565 6.118677 14.12346 6.036881 0.5421867      8.595472 
1 1 1 16  13 33 f 16.93809 5.871668 4.493332       2.956749 4.509920       4.123587 4.475780       4.241870 16.97477 6.719527 16.95966 6.781814 0.1511192E-01  9.546991 
1 1 1 16  13 34 o 15.01439 5.682221 3.441257       2.851079 2.123835       3.943984 4.883266       4.126260 14.12243 6.141796 16.85613 6.705859 -2.733700      9.093415 
1 1 1 16  13 35 o 15.57266 6.690603 3.975911       4.568616 8.193431       8.844080 2.440844       5.335654 17.93269 8.344339 14.73952 6.719848 3.193168       10.71375 
1 1 1 16  13 36 o 10.98327 4.986484 0.1894334      2.899879 1.609216       3.500005 -2.919185      5.178946 12.77777 5.662996 11.72795 5.702844 1.049825       8.036912 
1 1 1 16  14 0  o 129.6199 3.574018 205.2643       11.27846 225.3855       18.57728 193.5186       14.19357 135.5669 5.635606 125.7367 4.640225 9.830154       7.300120 
1 1 1 16  14 1  o 109.7306 2.831358 146.9903       7.564771 151.5837       14.52141 145.2795       8.862260 111.1612 5.376618 109.0491 3.338860 2.112122       6.328981 
1 1 1 16  14 2  f 188.5473 3.918846 434.2192       18.00589 447.6688       31.14161 427.4649       22.06876 190.8810 6.705286 186.8917 4.849746 3.989380       8.275318 
1 1 1 16  14 3  o 182.6570 3.349585 407.2691       14.90951 395.4692       20.62765 420.1774       21.57469 179.7679 4.712769 185.2905 4.782096 -5.522644      6.714062 
1 1 1 16  14 4  o 68.80489 3.083731 57.89213       5.157353 53.38991       5.681791 78.95856       12.29045 66.02965 3.544087 79.97611 6.358561 -13.94646      7.279550 
1 1 1 16  14 5  o 47.82130 2.443495 27.96665       2.838094 28.26491       3.555308 27.44272       4.712091 48.02729 3.053570 47.20661 4.137943 0.8206787      5.142651 
1 1 1 16  14 6  o 126.7253 2.604103 195.9223       8.041880 196.3641       9.636821 194.9088       14.59466 126.8333 3.117917 126.1219 4.757146 0.7113724      5.687868 
1 1 1 16  14 7  o 79.66045 2.883841 77.54758       5.588984 76.29283       6.760836 80.25582       9.932687 78.95513 3.522726 80.79789 5.070206 -1.842758      6.173863 
1 1 1 16  14 8  o 49.18191 4.834780 29.89640       5.719709 23.59217       8.004519 36.47363       8.175987 43.06926 7.918315 54.13173 6.316585 -11.06247      10.12912 
1 1 1 16  14 9  o 146.6406 3.904394 263.0646       13.93983 279.6199       23.22742 253.7452       17.42716 150.6994 6.339052 143.8362 4.979412 6.863266       8.060901 
1 1 1 16  14 10 o 88.99531 3.944774 97.03915       8.533846 104.8887       13.11195 91.27051       11.24042 92.23258 5.864106 86.09518 5.384523 6.137398       7.961207 
1 1 1 16  14 11 f 64.44238 4.432820 51.08353       6.918852 60.20045       10.44946 43.96633       9.232607 69.68761 6.218480 59.41968 6.481082 10.26793       8.981866 
1 1 1 16  14 12 o 83.12886 4.091915 84.77913       8.263763 96.69174       12.90185 76.49220       10.76081 88.45494 6.021306 78.69994 5.648491 9.754997       8.256002 
1 1 1 16  14 13 o 123.2441 3.937154 186.0941       11.80938 186.9594       18.68008 185.5181       15.24160 123.0191 6.251673 122.8239 5.103390 0.1952133      8.070192 
1 1 1 16  14 14 o 63.27239 4.511986 49.33883       6.911284 56.62281       10.45903 43.69301       9.208102 67.43188 6.443132 59.14718 6.495261 8.284706       9.148900 
1 1 1 16  14 15 o 36.03855 6.620952 16.54914       5.600444 10.10697       7.788687 23.44565       8.058660 28.90260 9.532207 42.73750 8.032620 -13.83490      12.46539 
1 1 1 16  14 16 o 62.33635 4.665057 48.00633       7.035145 44.12529       9.942779 51.89741       9.955627 59.22346 7.026087 64.44521 6.424824 -5.221752      9.520728 
1 1 1 16  14 17 o 61.99744 6.725177 48.28968       9.997918 48.28968       9.997918 0.000000       0.000000 61.99744 6.725177 ?        ?        0.000000       6.725177 
1 1 1 16  14 18 o 40.25056 8.820877 21.24758       8.412627 21.24758       8.412627 0.000000       0.000000 40.25056 8.820877 ?        ?        0.000000       8.820877 
1 1 1 16  14 19 o 39.59447 6.896071 20.15454       6.412186 24.12017       8.630260 15.26769       9.580379 42.89699 8.556013 34.13188 10.49807 8.765114       13.54307 
1 1 1 16  14 20 o 77.94933 4.913210 75.56201       9.285360 72.61923       12.30182 79.45839       14.15538 75.74214 6.735093 78.93335 7.447127 -3.191208      10.04098 
1 1 1 16  14 21 o 21.44573 8.076140 4.613887       5.743241 6.545095       7.401180 1.690858       9.105483 24.69187 9.194732 22.63404 9.575315 2.057831       13.27516 
1 1 1 16  14 22 f 103.6872 4.820612 134.3481       12.14712 151.5604       17.13835 116.9730       17.21918 109.0662 6.477438 95.06757 7.493195 13.99859       9.904806 
1 1 1 16  14 23 o 28.88899 8.141617 11.33394       5.976214 7.080808       7.779277 17.45850       9.335162 25.03025 9.405018 35.10162 10.26598 -10.07137      13.92281 
1 1 1 16  14 24 o 15.96662 6.815595 0.4941936      4.684951 0.6659318      5.665740 0.1228877      8.330846 17.47999 7.479222 20.26948 8.868595 -2.789488      11.60132 
1 1 1 16  14 25 o 28.02037 7.838926 10.99617       5.561557 6.374656       7.064496 18.52917       9.019306 23.35521 8.919444 35.20940 10.02889 -11.85419      13.42144 
1 1 1 16  14 26 o 21.34940 7.578465 5.887065       4.944970 3.052527       6.163194 11.00907       8.284852 19.50758 8.035135 27.51970 9.805174 -8.012123      12.67694 
1 1 1 16  14 27 o 24.35104 4.093274 7.736030       2.342899 6.012603       7.061221 7.949233       2.483594 22.21065 8.792792 24.61368 4.296889 -2.403032      9.786544 
1 1 1 16  14 28 f 15.59857 5.344538 3.116315       2.447208 0.000000       0.000000 3.116315       2.447208 ?        ?        15.59857 5.344538 0.000000       5.344538 
1 1 1 16  14 29 o 14.50279 4.330273 2.821743       1.646871 4.355065       2.062638 0.1253309      2.735265 17.77800 4.693012 11.76200 5.115024 6.016006       6.941745 
1 1 1 16  14 30 o 8.645769 3.881206 -0.5353391     1.700010 -1.355184      2.224605 0.6154966      2.635686 9.169095 4.238161 11.97844 5.112600 -2.809346      6.640835 
1 1 1 16  14 31 o 20.70975 5.666546 6.425038       2.942174 6.682890       3.181440 4.901618       7.733003 20.94079 5.953560 19.30820 8.493216 1.632595       10.37206 
1 1 1 16  14 32 o 17.26554 5.294047 4.465464       2.438689 5.988932       3.305371 2.645480       3.612745 19.36218 6.196897 14.98105 6.159313 4.381123       8.737201 
1 1 1 16  14 33 o 18.06276 5.382555 5.094826       2.546474 7.428242       3.433611 2.242676       3.796131 21.05795 6.244072 14.37074 6.134757 6.687208       8.753495 
1 1 1 16  14 34 o 15.12837 5.682596 3.598070       2.839477 5.353222       3.495179 0.1911516      4.869596 17.42027 6.347460 13.37780 6.213596 4.042468       8.882512 
1 1 1 16  14 35 o 11.43623 5.017191 0.8573613      2.682238 0.3840550      3.507993 1.523523       4.161762 11.96897 5.453645 13.36766 6.030548 -1.398685      8.130790 
1 1 1 16  15 0  o 97.53851 3.467920 116.2890       8.229807 103.2612       12.33306 126.7468       11.04980 91.66817 5.546939 101.7323 4.468071 -10.06410      7.122654 
1 1 1 16  15 1  o 150.2049 3.110807 275.3376       11.38658 269.4538       21.68470 277.5775       13.37957 148.1485 6.019011 150.7702 3.641586 -2.621689      7.034888 
1 1 1 16  15 2  o 158.7791 2.836864 307.5998       10.97660 314.9597       17.21244 302.5551       14.25026 160.4529 4.406260 157.3949 3.715320 3.058014       5.763570 
1 1 1 16  15 3  o 110.4736 2.770965 148.9978       7.453888 155.5473       10.62804 142.6577       10.45682 112.7727 3.873096 107.9816 3.980687 4.791077       5.553984 
1 1 1 16  15 4  o 284.9933 4.103683 992.6726       28.49998 942.9412       43.11777 1031.258       37.97953 277.1613 6.383924 290.1630 5.371202 -13.00168      8.342918 
1 1 1 16  15 5  o 144.9054 2.623913 256.1795       9.265525 249.8607       11.57659 267.4415       15.45516 143.0508 3.320889 147.8321 4.294663 -4.781326      5.428852 
1 1 1 16  15 6  o 58.68320 2.501785 42.08809       3.569458 42.02295       3.954774 42.37437       8.290567 58.61698 2.776504 58.48019 5.898038 0.1367874      6.518882 
1 1 1 16  15 7  o 67.63698 4.089838 56.13696       6.709533 60.74089       10.15297 52.56754       8.939808 70.09261 6.001792 65.22295 5.681234 4.869659       8.264256 
1 1 1 16  15 8  o 132.7630 3.865528 215.6448       12.49279 218.5596       20.09690 213.8092       15.94865 133.2310 6.207017 132.0208 4.966156 1.210236       7.949199 
1 1 1 16  15 9  o 116.0644 3.838981 164.8769       10.84309 175.4958       17.31619 158.0275       13.90717 119.3740 5.971559 113.4390 5.043446 5.934982       7.816384 
1 1 1 16  15 10 o 121.7842 3.868577 181.5617       11.46639 165.4858       17.48028 193.7033       15.19142 115.8268 6.215797 125.6056 4.972932 -9.778732      7.960288 
1 1 1 16  15 11 o 60.46933 4.601435 45.05812       6.729633 38.12933       9.414601 52.29721       9.623101 55.11983 7.179485 64.90550 6.157773 -9.785671      9.458498 
1 1 1 16  15 12 o 85.18054 4.598316 89.19954       9.509602 81.43507       12.38172 100.3672       14.84930 81.05048 6.318770 89.90913 6.828513 -8.858658      9.303518 
1 1 1 16  15 13 o 42.28288 5.924822 22.43567       5.937552 24.08530       8.527915 20.88362       8.271872 43.29123 8.386603 40.18831 8.699069 3.102921       12.08342 
1 1 1 16  15 14 o 118.5981 4.923333 173.0731       14.19801 200.5492       18.91201 137.5868       21.49269 127.3523 6.111733 104.6755 8.498818 22.67672       10.46820 
1 1 1 16  15 15 o 41.28202 7.503731 21.82210       7.270761 22.25993       8.428159 20.54826       14.37594 41.44171 8.626535 40.07192 12.93299 1.369793       15.54604 
1 1 1 16  15 16 f 39.34730 6.214984 19.61763       5.761605 29.69933       8.420835 10.74375       7.900328 48.29630 7.389534 29.48814 9.593060 18.80816       12.10917 
1 1 1 16  15 17 o 35.51993 7.607610 16.37082       6.386613 10.41302       8.299929 25.01892       9.999814 29.27378 9.844859 43.54955 9.674143 -14.27577      13.80255 
1 1 1 16  15 18 o 49.79623 5.955019 31.22304       7.083194 30.18495       9.407061 32.58214       10.76376 48.24207 8.301224 49.85136 9.199166 -1.609287      12.39092 
1 1 1 16  15 19 o 26.88659 8.151808 9.298592       5.803694 3.916569       7.719703 16.29494       8.801636 22.94376 9.157531 34.93661 9.892437 -11.99285      13.48038 
1 1 1 16  15 20 o 11.51872 5.592000 -8.159259      4.925671 -6.259769      6.339345 -11.05318      7.824727 14.70791 6.914855 15.02266 7.232754 -0.3147526     10.00640 
1 1 1 16  15 21 o 84.07940 6.648446 90.21507       13.51136 90.21507       13.51136 0.000000       0.000000 84.07940 6.648446 ?        ?        0.000000       6.648446 
1 1 1 16  15 22 o 34.46352 7.670199 15.95874       6.275843 20.67700       8.424860 10.07642       9.406883 38.74671 9.081785 28.57866 10.41329 10.16805       13.81722 
1 1 1 16  15 23 o 49.89916 5.692182 32.04092       6.797979 38.56521       9.051440 23.59922       10.29594 54.08740 7.033735 40.36107 10.40259 13.72633       12.55736 
1 1 1 16  15 24 o 50.62360 5.702719 33.26484       6.912853 30.42311       9.094473 37.15348       10.63863 46.88548 8.261539 51.52969 8.787037 -4.644215      12.06089 
1 1 1 16  15 25 o 19.71634 7.656621 4.072300       5.267691 2.739350       6.994957 5.818568       8.006331 20.18820 8.457760 23.29015 9.315845 -3.101950      12.58247 
1 1 1 16  15 26 o 39.04597 10.08366 24.08356       9.661268 0.000000       0.000000 24.08356       9.661268 ?        ?        39.04597 10.08366 0.000000       10.08366 
1 1 1 16  15 27 o 32.15286 10.03760 17.25010       8.721252 0.000000       0.000000 17.25010       8.721252 ?        ?        32.15286 10.03760 0.000000       10.03760 
1 1 1 16  15 28 o 20.84336 7.836012 6.113016       5.401771 8.003489       7.280108 3.797297       8.057409 23.06668 8.988857 20.35705 8.816319 2.709633       12.59075 
1 1 1 16  15 29 o 12.10826 4.547318 1.615925       1.818076 6.905952       6.946501 1.226909       1.883739 21.39398 8.635569 11.54608 4.550642 9.847906       9.761218 
1 1 1 16  15 30 o 10.29698 4.241728 0.6858385      1.717758 -2.105373      2.647955 2.713927       2.257135 9.515285 4.472155 14.39332 5.118993 -4.878035      6.797371 
1 1 1 16  15 31 o 16.35895 5.602599 3.892401       2.689169 9.699901       7.956565 3.143450       2.857313 22.11607 9.121625 15.25527 5.706600 6.860802       10.75962 
1 1 1 16  15 32 o 15.02664 5.974125 3.008044       3.272818 5.858247       8.807564 2.551438       3.525238 18.93501 8.632998 14.67719 6.064325 4.257821       10.55010 
1 1 1 16  15 33 o 23.89568 6.156844 9.532701       3.607401 9.532701       3.607401 0.000000       0.000000 23.89568 6.156844 ?        ?        0.000000       6.156844 
1 1 1 16  15 34 o 10.83906 4.765844 0.5013027      2.432562 1.369029       3.271386 -0.5718554     3.638081 12.69663 5.556280 11.59134 5.379336 1.105291       7.733660 
1 1 1 16  15 35 o 11.06861 4.853884 0.7641571      2.508109 0.5178352      3.427716 1.048022       3.679675 11.91614 5.414469 12.55762 5.667322 -0.6414814     7.838049 
1 1 1 16  16 0  o 43.44381 4.772183 23.36058       4.969125 24.42392       7.300559 22.44272       6.782780 44.05238 7.037346 42.22686 6.824112 1.825520       9.802691 
1 1 1 16  16 1  o 193.9596 3.177041 459.1952       15.01655 436.3152       22.67553 477.0672       20.04090 188.7668 4.933647 197.5730 4.162494 -8.806168      6.455016 
1 1 1 16  16 2  o 122.0975 2.595070 181.8651       7.721325 198.8715       12.31171 170.8396       9.913164 127.5136 3.966930 118.2338 3.444274 9.279755       5.253528 
1 1 1 16  16 3  o 36.73024 5.706814 16.92304       4.942286 23.83499       7.264049 10.96569       6.743807 43.47738 7.101023 29.56420 8.746786 13.91318       11.26636 
1 1 1 16  16 4  o 166.7236 3.210021 339.3670       13.04191 331.9673       18.07937 347.3955       18.83171 164.6748 4.509508 168.4463 4.591954 -3.771530      6.435970 
1 1 1 16  16 5  o 148.0507 2.640277 267.4475       9.525684 275.1814       12.17939 255.2640       15.28673 150.1138 3.329423 144.4006 4.349154 5.713181       5.477243 
1 1 1 16  16 6  o 99.84237 2.639342 121.7235       6.416018 115.8132       8.677799 128.8501       9.529066 97.28745 3.666863 102.6069 3.817644 -5.319496      5.293419 
1 1 1 16  16 7  o 75.59167 3.981171 70.05869       7.307806 64.76472       10.89643 74.38637       9.851923 72.33366 6.242728 77.72707 5.231784 -5.393410      8.145135 
1 1 1 16  16 8  o 126.2645 4.525044 195.4335       13.90073 217.1289       19.57039 173.3426       19.74800 132.7856 6.064016 118.4279 6.872309 14.35767       9.165201 
1 1 1 16  16 9  o 48.19719 6.384986 29.07274       7.314950 25.97203       8.597983 37.19910       13.91919 45.14563 8.113508 53.53075 11.03710 -8.385120      13.69842 
1 1 1 16  16 10 o 110.1805 4.767150 149.0852       12.76941 168.4533       16.94143 123.6071       19.43079 116.8793 5.967827 99.54819 8.079169 17.33110       10.04430 
1 1 1 16  16 11 o 25.32235 8.599730 7.430983       6.333615 12.26238       7.278715 -7.633932      12.85291 31.04517 9.060881 22.84540 10.42083 8.199766       13.80917 
1 1 1 16  16 12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  16 13 o 85.79372 4.089725 90.38679       8.525765 89.37938       12.79893 91.19038       11.43118 84.87926 6.231222 85.90968 5.488964 -1.030426      8.304027 
1 1 1 16  16 14 o 98.69060 4.000366 119.5726       9.600871 139.8308       15.63556 107.3112       12.16417 106.2372 6.064690 93.19692 5.378906 13.04032       8.106361 
1 1 1 16  16 15 o 47.66488 5.370217 28.35644       6.129290 30.73744       8.848776 26.16042       8.498104 49.09083 7.645759 45.10825 8.025044 3.982578       11.08418 
1 1 1 16  16 16 o 28.32202 7.500593 10.38853       5.257945 5.184058       7.232193 16.22351       7.657756 23.69732 9.030847 35.17051 8.922341 -11.47318      12.69505 
1 1 1 16  16 17 o 76.34302 4.820193 72.18277       8.921686 64.68700       11.67657 82.69695       13.82914 71.68493 6.764208 81.00857 7.076287 -9.323639      9.789196 
1 1 1 16  16 18 o 52.75893 5.710434 34.99014       7.224889 39.77611       9.734859 29.12139       10.77995 55.76552 7.341705 46.73295 9.780284 9.032570       12.22925 
1 1 1 16  16 19 o 101.6434 4.701100 128.2192       11.61280 135.7941       16.00912 119.8070       16.87069 103.8361 6.357253 97.07227 7.182721 6.763840       9.591984 
1 1 1 16  16 20 o 75.42426 4.758878 70.98115       8.702260 69.40973       11.42650 73.15132       13.42809 73.88371 6.409770 75.34673 7.409030 -1.463020      9.796882 
1 1 1 16  16 21 o 48.46980 5.731908 29.98542       6.639431 25.15374       8.739675 36.57958       10.21000 43.14424 8.614410 52.42794 8.264888 -9.283703      11.93803 
1 1 1 16  16 22 o 41.41907 6.407815 22.42986       6.259031 25.56838       8.123915 17.84593       9.817993 43.54210 7.949133 35.28962 10.58145 8.252480       13.23464 
1 1 1 16  16 23 o 57.20343 5.362965 41.95760       7.388717 49.98085       10.13359 32.85063       10.79631 61.53566 6.875064 48.05995 9.554976 13.47572       11.77132 
1 1 1 16  16 24 o 43.28757 9.703767 27.60763       9.982613 0.000000       0.000000 27.60763       9.982613 ?        ?        43.28757 9.703767 0.000000       9.703767 
1 1 1 16  16 25 o 21.87523 8.986137 4.536442       7.681411 0.000000       0.000000 4.536442       7.681411 ?        ?        21.87523 8.986137 0.000000       8.986137 
1 1 1 16  16 26 o 16.26276 6.918982 1.264962       4.800024 -8.232791      5.946799 19.02113       8.131065 12.67389 6.150831 34.74672 9.384043 -22.07283      11.22020 
1 1 1 16  16 27 o 66.44471 5.231263 59.09832       8.402110 58.00605       11.16445 60.52496       12.75940 63.13100 7.397138 62.87754 8.548367 0.2534561      11.30452 
1 1 1 16  16 28 o 18.35884 7.376368 4.026005       5.043127 1.679111       6.296457 8.225826       8.422963 17.48699 7.678913 23.04294 9.431567 -5.555954      12.16224 
1 1 1 16  16 29 o 27.50167 8.093228 12.75900       5.786461 14.35052       7.815425 10.82807       8.608528 27.41660 9.543787 24.09771 9.652721 3.318893       13.57420 
1 1 1 16  16 30 o 21.60591 7.984249 8.033481       5.561126 10.14845       7.712064 5.742477       8.026604 22.97279 9.158348 19.96497 8.720913 3.007820       12.64633 
1 1 1 16  16 31 o 7.949064 3.624439 -0.6996773     1.552765 -4.340786      7.589335 -0.5405997     1.586322 14.58627 7.047567 8.222407 3.714987 6.363864       7.966764 
1 1 1 16  16 32 o 11.58063 4.541958 1.498940       1.868585 5.317332       2.855537 -1.360553      2.471109 18.25345 5.750103 9.442958 4.399585 8.810491       7.240168 
1 1 1 16  16 33 o 12.18696 5.379814 0.8332599      3.128592 0.000000       0.000000 0.8332599      3.128592 ?        ?        12.18696 5.379814 0.000000       5.379814 
1 1 1 16  16 34 o 9.020962 4.167893 -0.8127608     2.148066 0.6772436      2.898004 -2.629547      3.200052 11.57770 5.140883 9.676781 4.650322 1.900922       6.932112 
1 1 1 16  17 0  o 81.92599 4.424421 82.31047       8.800348 85.45212       11.35491 77.58492       13.92616 83.31705 5.625579 79.08351 7.308846 4.233536       9.223144 
1 1 1 16  17 1  o 231.0364 4.487123 652.8438       25.26298 659.7458       43.87008 649.4194       30.90087 231.2486 7.796052 230.2096 5.508220 1.039001       9.545623 
1 1 1 16  17 2  o 173.5997 3.901082 368.2834       16.50327 380.4976       19.93143 341.6499       29.43206 176.2867 4.643669 166.4463 7.273781 9.840347       8.629690 
1 1 1 16  17 3  o 185.9937 4.702127 423.6304       21.29513 393.0816       30.43168 452.9431       29.80968 178.6078 7.005393 191.9234 6.382601 -13.31567      9.476978 
1 1 1 16  17 4  o 186.4954 3.394030 424.7902       15.42482 428.8344       21.74679 420.6957       21.88180 187.1041 4.773431 185.3030 4.849959 1.801086       6.804979 
1 1 1 16  17 5  o 75.35159 2.257458 69.31950       4.140552 65.27422       4.971442 78.47977       7.481043 73.07796 2.796805 80.03675 3.846893 -6.958794      4.756123 
1 1 1 16  17 6  o 118.4773 4.605702 172.1095       13.27208 171.1753       17.32922 173.4348       20.64134 117.8871 6.052473 118.4051 7.187565 -0.5179749     9.396463 
1 1 1 16  17 7  o 52.07999 7.100650 34.03633       8.777205 34.03633       8.777205 0.000000       0.000000 52.07999 7.100650 ?        ?        0.000000       7.100650 
1 1 1 16  17 8  o 108.8099 4.713392 145.3360       12.46828 140.8816       15.95606 152.3209       19.98077 106.8463 6.154196 110.7966 7.443496 -3.950249      9.658145 
1 1 1 16  17 9  o 19.12863 7.280113 3.189777       4.695997 -0.1044511     6.698151 6.374194       6.585566 19.02791 8.136616 24.42615 8.737630 -5.398241      11.93946 
1 1 1 16  17 10 o 16.30529 6.881673 0.3439887      4.684951 4.321382       6.700038 -3.461253      6.553437 22.55359 8.667932 16.68452 7.543364 5.869076       11.49066 
1 1 1 16  17 11 o 60.04621 4.638027 44.48233       6.734076 47.58630       9.861122 41.76990       9.218195 61.72794 6.660882 57.78663 6.668257 3.941307       9.425126 
1 1 1 16  17 12 o 29.80358 6.921891 11.42663       4.930728 3.987815       6.597586 20.83819       7.421026 22.10841 8.573425 40.28922 7.840786 -18.18082      11.61816 
1 1 1 16  17 13 o 103.4909 4.590757 131.7732       11.54889 131.7990       15.57254 131.7416       17.21606 103.0850 6.228143 102.8550 6.908731 0.2299500      9.301630 
1 1 1 16  17 14 o 116.5909 4.611854 167.3432       13.07732 159.0450       17.39384 178.1326       19.83366 113.1446 6.333779 119.5751 6.835005 -6.430565      9.318480 
1 1 1 16  17 15 o 185.5309 5.265522 425.1436       23.78233 411.9975       32.41507 440.4699       35.00006 181.4848 7.344609 187.4355 7.678944 -5.950653      10.62589 
1 1 1 16  17 16 o 48.75787 5.404612 29.75668       6.313911 37.84805       9.079574 22.17993       8.786094 54.62500 6.980105 41.04839 9.029297 13.57662       11.41271 
1 1 1 16  17 17 o 51.31418 5.564900 33.05260       6.847479 28.11620       8.733785 40.92773       11.03128 46.55123 7.986449 56.25604 8.295403 -9.704815      11.51508 
1 1 1 16  17 18 o 85.56432 4.739796 90.91294       9.844376 107.2518       13.69102 73.42271       14.16519 92.39786 6.114876 75.64075 7.796312 16.75711       9.908289 
1 1 1 16  17 19 o 62.73911 5.140697 49.35199       7.790667 46.39827       10.07527 53.74418       12.28606 60.10024 7.010821 64.25184 8.020994 -4.151596      10.65307 
1 1 1 16  17 20 o 54.01862 5.681681 37.07648       7.367375 38.32819       9.863071 35.49654       11.08105 54.04247 7.707430 51.21623 9.217347 2.826237       12.01516 
1 1 1 16  17 21 o 49.58680 5.745896 31.51875       6.814843 26.76494       8.657339 39.26328       11.04997 44.48858 8.290399 53.83694 8.720635 -9.348362      12.03246 
1 1 1 16  17 22 o 23.19258 9.524515 4.229603       8.626161 0.000000       0.000000 4.229603       8.626161 ?        ?        23.19258 9.524515 0.000000       9.524515 
1 1 1 16  17 23 o 17.52220 8.039875 -3.585609      7.800881 0.000000       0.000000 -3.585609      7.800881 ?        ?        17.52220 8.039875 0.000000       8.039875 
1 1 1 16  17 24 o 25.31434 7.961909 9.005371       5.476887 3.489050       7.184209 16.66011       8.462905 20.84697 8.639420 33.10948 9.799109 -12.26251      13.06377 
1 1 1 16  17 25 o 44.89227 6.198467 27.35399       6.600208 22.95305       8.614066 33.61120       10.27131 38.69438 9.259257 47.08614 9.281623 -8.391758      13.11039 
1 1 1 16  17 26 o 57.86919 5.360793 44.77283       7.473914 45.26894       9.956925 44.13255       11.31162 55.96658 7.488376 53.50958 8.993445 2.456993       11.70290 
1 1 1 16  17 27 o 16.30966 7.045063 1.388911       5.118373 1.059773       6.899739 1.791676       7.632554 17.81348 7.919780 18.83637 8.354636 -1.022882      11.51186 
1 1 1 16  17 28 o 60.41597 5.573340 51.09837       8.113035 44.20851       10.81967 59.94819       12.26242 51.37597 8.968163 60.63516 8.534656 -9.259190      12.38016 
1 1 1 16  17 29 o 16.41177 7.461465 0.5114093      6.520956 0.5114093      6.520956 0.000000       0.000000 16.41177 7.461465 ?        ?        0.000000       7.461465 
1 1 1 16  17 30 o 27.37881 10.20279 17.37589       9.116230 17.37589       9.116230 0.000000       0.000000 27.37881 10.20279 ?        ?        0.000000       10.20279 
1 1 1 16  17 31 o 20.41550 7.804315 7.788245       5.411892 10.50650       8.052318 5.548831       7.308742 21.68952 9.079783 18.59211 8.214315 3.097412       12.24408 
1 1 1 16  17 32 o 11.70897 5.712307 -4.982332      5.315750 -2.699101      8.320822 -6.556746      6.909566 14.86451 7.228158 12.74702 6.278193 2.117484       9.574026 
1 1 1 16  17 33 o 11.79731 4.733733 1.622779       2.074025 6.254555       8.629390 1.338820       2.136655 17.53619 8.187315 11.46306 4.727286 6.073131       9.454065 
1 1 1 16  17 34 o 11.28250 4.979431 0.7190020      2.678811 0.8007198      2.885384 0.2088193      7.209551 11.61071 5.143979 14.37220 6.925401 -2.761487      8.626801 
1 1 1 16  18 0  o 133.2027 3.694687 216.9320       11.98139 203.0017       18.54527 226.9121       15.69713 128.4987 5.938465 136.0856 4.740628 -7.586823      7.598613 
1 1 1 16  18 1  o 136.7888 2.695847 228.3181       8.986324 233.0972       14.19222 225.1197       11.61025 138.0029 4.225109 135.7132 3.513571 2.289642       5.495154 
1 1 1 16  18 2  o 100.6399 2.541265 123.6517       6.227427 114.7150       9.467248 130.4675       8.267911 96.78611 4.022744 103.3109 3.288266 -6.524788      5.195687 
1 1 1 16  18 3  o 257.9988 4.308245 814.2724       27.08658 791.4075       53.05509 822.3331       31.50131 252.7045 8.628105 259.0973 4.989186 -6.392731      9.966753 
1 1 1 16  18 4  o 142.1475 2.737598 246.6105       9.482983 220.9148       13.86651 269.1866       12.99755 134.3148 4.241817 148.4217 3.593584 -14.10689      5.559394 
1 1 1 16  18 5  o 92.72734 2.726061 105.0376       6.153295 98.54388       10.32784 108.6112       7.661594 89.57311 4.748431 94.23247 3.341723 -4.659355      5.806437 
1 1 1 16  18 6  o 29.03874 4.894590 10.61352       3.340592 14.15190       7.254883 9.661433       3.763285 33.18198 8.821135 27.53829 5.791752 5.643688       10.55257 
1 1 1 16  18 7  o 94.06076 3.910607 108.4127       8.944179 106.0771       13.70858 110.1440       11.80234 92.66425 6.104781 94.61782 5.137971 -1.953568      7.979167 
1 1 1 16  18 8  o 103.7493 4.496164 132.1286       11.34047 121.7609       14.86655 146.5574       17.53825 99.25739 6.176874 108.8154 6.645624 -9.558006      9.072931 
1 1 1 16  18 9  o 121.1377 3.954031 179.8094       11.65664 196.3293       18.79246 169.4786       14.86099 126.0975 6.134033 117.3580 5.209340 8.739464       8.047583 
1 1 1 16  18 10 o 68.64213 4.413885 57.99306       7.344123 69.66480       11.29135 49.43485       9.668731 74.90988 6.242120 62.98600 6.387482 11.92389       8.931068 
1 1 1 16  18 11 o 50.82338 5.315593 32.10780       6.486170 38.95153       9.669755 26.50996       8.745400 55.59110 7.315313 45.48287 8.191570 10.10823       10.98251 
1 1 1 16  18 12 o 106.9962 4.031065 140.5362       10.49172 170.3595       17.37940 123.4352       13.16037 117.2750 6.102242 99.95794 5.423059 17.31710       8.163757 
1 1 1 16  18 13 o 77.62724 4.298736 74.20815       8.100128 76.74099       12.10780 72.15616       10.89809 78.45278 6.388412 76.18294 5.916598 2.269844       8.707350 
1 1 1 16  18 14 o 100.4514 4.044924 124.0763       9.881289 127.0813       15.36177 121.9554       12.90549 101.0249 6.270798 99.24841 5.355830 1.776535       8.246685 
1 1 1 16  18 15 o 48.94981 5.240789 29.93975       6.154307 28.54295       8.843747 31.25133       8.569728 47.02280 8.004259 49.46046 7.331711 -2.437660      10.85459 
1 1 1 16  18 16 o 30.86617 7.316773 12.44393       5.419098 6.505798       7.108154 20.68538       8.374020 24.66416 9.041709 39.54117 8.905341 -14.87701      12.69085 
1 1 1 16  18 17 o 45.94359 6.102013 26.81555       6.663020 27.45669       8.784554 25.94703       10.22435 45.80424 8.169749 43.91373 9.802823 1.890518       12.76088 
1 1 1 16  18 18 o 76.31071 4.903053 72.65922       9.069516 70.55900       12.02415 75.43112       13.81372 74.44656 6.699450 76.58768 7.497364 -2.141121      10.05451 
1 1 1 16  18 19 o 123.9600 4.750846 191.6346       14.32465 199.7866       19.89675 182.8622       20.63990 125.2988 6.538899 119.3857 7.126896 5.913094       9.672117 
1 1 1 16  18 20 o 53.25340 8.961209 38.51083       11.21670 0.000000       0.000000 38.51083       11.21670 ?        ?        53.25340 8.961209 0.000000       8.961209 
1 1 1 16  18 21 o 87.88177 7.089983 101.2324       15.05500 0.000000       0.000000 101.2324       15.05500 ?        ?        87.88177 7.089983 0.000000       7.089983 
1 1 1 16  18 22 o 33.98056 7.564382 15.90759       6.102710 26.99894       8.418809 3.625831       8.859083 44.20388 8.114388 22.75880 9.525344 21.44508       12.51301 
1 1 1 16  18 23 o 17.63932 7.364861 1.790791       5.277015 3.890598       6.937899 -1.091423      8.128331 21.03285 8.578461 18.99212 8.509316 2.040733       12.08298 
1 1 1 16  18 24 o 28.80856 7.988338 12.09656       5.803374 8.713401       7.427921 17.39746       9.297807 25.03659 9.231880 32.98418 10.37381 -7.947584      13.88681 
1 1 1 16  18 25 o 48.32306 5.970274 31.73923       6.881114 25.61750       8.968388 40.50109       10.72940 40.48112 9.288719 51.76374 8.821802 -11.28262      12.81033 
1 1 1 16  18 26 o 29.30092 7.922602 13.27406       5.791581 21.47705       7.933190 3.913092       8.474661 36.46635 8.986218 20.84364 9.034337 15.62271       12.74250 
1 1 1 16  18 27 o 62.64039 7.858372 60.75741       11.73234 60.75741       11.73234 0.000000       0.000000 62.64039 7.858372 ?        ?        0.000000       7.858372 
1 1 1 16  18 28 o 38.91335 9.942019 28.31474       9.461141 28.31474       9.461141 0.000000       0.000000 38.91335 9.942019 ?        ?        0.000000       9.942019 
1 1 1 16  18 29 o 11.20259 5.477405 -6.664983      4.966805 -5.169864      7.109971 -8.090012      6.941312 14.24799 6.868525 13.12238 6.428495 1.125609       9.407559 
1 1 1 16  18 30 o 13.05097 6.211856 -3.006185      5.421706 -4.644552      8.298248 -1.785903      7.161611 15.02176 7.284554 15.18289 7.201422 -0.1611338     10.24330 
1 1 1 16  18 31 o 15.49139 7.056982 1.713082       5.869493 -2.756579      8.842068 5.234230       7.847993 15.43106 7.491534 18.13506 8.221455 -2.703999      11.12274 
1 1 1 16  18 32 o 32.88493 8.521707 22.47766       6.884112 27.04699       10.74287 19.29402       8.967171 27.92542 10.90866 25.27026 9.938138 2.655157       14.75688 
1 1 1 16  18 33 o 10.60067 5.263365 -7.146819      5.222145 -5.765112      8.351079 -8.034044      6.691936 13.45881 6.677908 11.76805 5.861946 1.690752       8.885768 
1 1 1 16  19 0  o 147.1915 3.243684 264.5707       11.63476 268.9825       15.65214 259.1228       17.39333 148.2207 4.338066 145.3762 4.916757 2.844543       6.556929 
1 1 1 16  19 1  o 89.13303 2.806613 97.06365       6.088574 90.93302       11.59409 99.39814       7.154501 85.92248 5.567217 90.15733 3.261810 -4.234856      6.452388 
1 1 1 16  19 2  o 109.6274 2.560997 146.6504       6.841703 151.8435       10.66018 143.0130       8.921572 111.3716 3.934019 108.1469 3.389437 3.224686       5.192763 
1 1 1 16  19 3  o 144.7080 3.657609 256.1052       12.88777 0.000000       0.000000 256.1052       12.88777 ?        ?        144.7080 3.657609 0.000000       3.657609 
1 1 1 16  19 4  o 226.7527 3.501429 628.3541       19.34790 573.1186       28.55149 675.2569       26.30988 216.0403 5.427526 234.8104 4.597962 -18.77010      7.113318 
1 1 1 16  19 5  o 82.57099 2.496187 83.28076       5.016972 78.51089       7.259910 87.64075       6.940972 80.04362 3.732208 84.62140 3.372677 -4.577782      5.030341 
1 1 1 16  19 6  o 49.97421 3.258680 30.64528       3.946831 48.20010       9.578017 27.05473       4.331696 62.23479 6.406912 46.87513 3.825330 15.35966       7.462015 
1 1 1 16  19 7  o 53.31873 6.179415 35.46695       7.880542 45.27673       9.922196 18.70585       12.96968 60.17703 6.890234 38.55752 12.26810 21.61951       14.07060 
1 1 1 16  19 8  o 113.4370 3.928421 157.7010       10.84309 158.7447       17.05407 156.9928       14.04821 113.3273 6.198898 112.9548 5.116934 0.3725128      8.037994 
1 1 1 16  19 9  f 112.2850 4.585606 154.9038       12.52102 142.5478       16.52973 171.5379       19.17894 107.2936 6.350422 117.6245 6.718947 -10.33083      9.245112 
1 1 1 16  19 10 o 98.92634 3.985787 120.0923       9.588973 123.9467       14.97907 117.4159       12.48169 100.0145 6.176029 97.55753 5.269769 2.456993       8.118731 
1 1 1 16  19 11 o 56.74425 4.752289 39.84164       6.511140 40.85130       9.579832 38.97478       8.876610 56.95413 7.052927 55.70782 6.671262 1.246315       9.708220 
1 1 1 16  19 12 o 88.56849 4.638177 96.70203       9.975771 82.08327       13.02003 117.4833       15.52363 81.06921 6.648895 97.09531 6.600063 -16.02610      9.368492 
1 1 1 16  19 13 o 25.08239 7.927267 7.815946       5.423167 6.009557       7.384411 9.930986       7.990419 24.57295 9.177615 28.67483 9.659633 -4.101873      13.32431 
1 1 1 16  19 14 o 29.23316 7.496157 11.12338       5.365074 9.883933       7.420935 12.48061       7.765508 28.27697 9.303440 31.09148 9.430031 -2.814510      13.24687 
1 1 1 16  19 15 o 56.65069 4.921422 39.96322       6.726753 33.83525       9.470087 46.20370       9.556634 51.22999 7.834194 60.45691 6.593417 -9.226921      10.23952 
1 1 1 16  19 16 o 76.25685 4.789583 72.26667       8.855511 69.22714       11.79732 76.18987       13.40294 73.97830 6.613682 77.38406 7.189659 -3.405762      9.768929 
1 1 1 16  19 17 o 20.58890 8.019027 3.676374       5.791464 10.48679       8.089456 -3.484789      8.295151 28.79955 9.719336 18.79857 8.494148 10.00098       12.90798 
1 1 1 16  19 18 o 89.28870 7.079709 102.3645       15.27850 0.000000       0.000000 102.3645       15.27850 ?        ?        89.28870 7.079709 0.000000       7.079709 
1 1 1 16  19 19 o 65.35944 8.199442 56.67122       12.77293 0.000000       0.000000 56.67122       12.77293 ?        ?        65.35944 8.199442 0.000000       8.199442 
1 1 1 16  19 20 o 15.16741 6.712273 -1.031579      4.899669 -3.307284      6.575917 1.808537       7.346262 16.28402 7.437796 20.39851 8.613716 -4.114489      11.38055 
1 1 1 16  19 21 o 47.74756 5.982888 29.74912       6.809017 35.02797       9.398343 23.91723       9.878389 50.73448 7.855392 40.41253 10.06813 10.32195       12.77006 
1 1 1 16  19 22 o 53.86523 5.662339 37.86169       7.321584 51.08588       10.43422 25.03509       10.27616 61.55841 7.084666 40.60488 10.35459 20.95353       12.54631 
1 1 1 16  19 23 o 24.30000 8.100812 8.269997       5.621157 12.92152       7.551806 2.490906       8.417499 29.30855 9.365348 21.06309 9.065970 8.245466       13.03463 
1 1 1 16  19 24 o 56.30658 5.539894 42.22316       7.503122 41.07954       10.01914 43.68351       11.32193 53.26928 7.962177 53.90702 8.931084 -0.6377411     11.96497 
1 1 1 16  19 25 o 19.99642 7.425225 5.311927       4.820139 5.470077       6.391264 5.103326       7.340253 20.94066 8.340899 21.16150 8.747808 -0.2208405     12.08697 
1 1 1 16  19 26 o 18.33620 8.070266 1.998396       6.991220 1.998396       6.991220 0.000000       0.000000 18.33620 8.070266 ?        ?        0.000000       8.070266 
1 1 1 16  19 27 o 22.41203 7.907407 8.115217       5.376776 12.92017       7.322394 2.493093       7.920609 26.63158 9.239744 18.81813 8.417942 7.813448       12.49938 
1 1 1 16  19 28 o 17.46539 7.418192 3.356440       5.501750 0.8929296      8.109770 5.457018       7.488601 17.68253 8.144111 19.87108 8.551994 -2.188547      11.80945 
1 1 1 16  19 29 o 30.04555 8.543003 16.80107       6.550403 30.63780       10.08236 6.694835       8.616685 37.44865 10.58226 20.17272 8.915577 17.27593       13.83733 
1 1 1 16  19 30 o 16.13035 7.165416 2.626049       5.635907 0.4350942      8.545269 4.312801       7.497812 16.59669 7.870368 17.89622 8.082027 -1.299522      11.28104 
1 1 1 16  19 31 o 35.54385 8.163757 24.41445       6.921993 24.36547       10.05240 24.45863       9.545605 28.04741 10.65689 29.06679 10.50426 -1.019379      14.96358 
1 1 1 16  19 32 o 13.53697 6.377553 -0.3259893     5.442329 3.632116       8.573522 -2.997320      7.043352 16.57444 7.866659 13.62079 6.629448 2.953645       10.28756 
1 1 1 16  19 33 o 19.22921 8.108352 9.445884       6.494491 14.12098       10.03789 6.079805       8.517452 19.79852 9.097503 16.92982 7.976742 2.868690       12.09930 
1 1 1 16  20 0  o 68.65544 3.287355 57.70712       5.483956 54.85855       6.773023 63.12907       9.344309 66.83523 4.179461 71.53909 5.399904 -4.703857      6.828386 
1 1 1 16  20 1  o 134.6160 2.707953 221.1869       8.883289 206.8171       13.52858 232.0789       11.77824 129.9304 4.278564 137.7643 3.511251 -7.833862      5.534889 
1 1 1 16  20 2  o 66.16837 2.585813 53.51584       4.161469 44.55722       6.360849 60.21967       5.502449 60.17470 4.367483 70.13792 3.227997 -9.963226      5.430918 
1 1 1 16  20 3  o 135.1292 2.714108 222.9082       8.937423 228.2145       13.87846 219.1483       11.68223 136.4886 4.177538 133.8430 3.584968 2.645554       5.504890 
1 1 1 16  20 4  o 23.08173 4.306917 6.732554       2.333457 10.04538       3.777982 4.689263       2.967054 28.09164 5.713591 19.42739 5.815052 8.664248       8.152297 
1 1 1 16  20 5  o 261.6320 3.874336 837.5540       24.70155 833.9838       38.20133 840.1193       32.38204 260.3020 6.022334 261.6385 5.078862 -1.336517      7.878029 
1 1 1 16  20 6  o 58.34954 3.181574 41.72969       4.506810 41.96257       9.725107 41.66600       5.085897 57.85879 7.042342 58.25682 3.600075 -0.3980370     7.909180 
1 1 1 16  20 7  o 211.6077 4.636595 549.2272       23.90929 554.4713       39.81443 546.2693       29.90114 211.2330 7.747813 210.5536 5.833212 0.6793976      9.698195 
1 1 1 16  20 8  o 34.45517 8.546282 15.38756       7.140760 17.22484       8.443191 10.77190       13.38243 36.39030 9.441209 32.82023 12.33479 3.570072       15.53330 
1 1 1 16  20 9  o 33.56497 6.865848 14.45158       5.426336 16.77112       7.819534 12.29704       7.536296 35.89075 8.966922 31.05409 9.261135 4.836664       12.89086 
1 1 1 16  20 10 o 14.45316 6.455225 -1.854097      4.638314 0.1768302      6.128823 -4.576670      7.096100 18.34436 7.811886 16.85561 7.709294 1.488745       10.97537 
1 1 1 16  20 11 o 98.89288 4.629817 120.5249       11.12648 130.7344       15.29939 109.0632       16.21054 102.5708 6.149120 93.31337 7.184087 9.257385       9.456363 
1 1 1 16  20 12 o 56.70385 4.840155 39.89660       6.624296 46.43232       9.612356 33.98524       9.141694 60.76377 6.597312 51.63120 7.483622 9.132568       9.976429 
1 1 1 16  20 13 o 45.46256 6.023215 26.09646       6.508937 16.59373       8.232515 41.94165       10.63058 35.43047 9.386486 57.25273 7.823944 -21.82226      12.21966 
1 1 1 16  20 14 o 31.62624 7.825000 13.12779       5.997369 8.133484       7.492949 22.03138       10.00455 26.47667 9.335275 40.49238 10.15747 -14.01571      13.79571 
1 1 1 16  20 15 o 71.11964 7.298657 64.55627       12.47007 0.000000       0.000000 64.55627       12.47007 ?        ?        71.11964 7.298657 0.000000       7.298657 
1 1 1 16  20 16 o 33.10549 9.268003 14.74867       7.771309 0.000000       0.000000 14.74867       7.771309 ?        ?        33.10549 9.268003 0.000000       9.268003 
1 1 1 16  20 17 o 47.08281 5.968933 28.32510       6.694808 22.16804       8.492292 38.43413       10.88161 40.48127 8.855559 53.76693 8.594306 -13.28566      12.34030 
1 1 1 16  20 18 o 48.96387 5.907752 30.73661       6.906799 31.26890       9.225770 30.05787       10.41790 48.38797 8.110762 46.71288 9.476240 1.675091       12.47332 
1 1 1 16  20 19 o 63.47289 5.094787 51.07605       7.814305 51.43116       10.15650 50.56087       12.23318 62.80070 6.742000 61.17820 8.429334 1.622505       10.79390 
1 1 1 16  20 20 o 90.71980 4.836718 104.2302       10.65409 122.6540       14.88817 84.89302       15.25276 97.15399 6.322813 79.28796 8.003587 17.86604       10.19977 
1 1 1 16  20 21 o 51.87685 5.729213 35.13469       7.122253 33.63740       9.478904 37.07605       10.79341 49.11884 8.208515 50.97901 9.018103 -1.860168      12.19450 
1 1 1 16  20 22 o 44.59845 6.428314 26.84496       6.784922 22.12814       8.739811 33.99968       10.76400 38.34089 9.422381 47.67203 9.598062 -9.331142      13.45006 
1 1 1 16  20 23 o 23.98638 8.313497 8.201674       5.927208 14.67957       8.041215 0.4947582      8.770917 30.50227 9.654509 19.93047 8.890822 10.57179       13.12464 
1 1 1 16  20 24 o 18.47670 8.165961 1.014387       7.228548 1.014387       7.228548 0.000000       0.000000 18.47670 8.165961 ?        ?        0.000000       8.165961 
1 1 1 16  20 25 o 23.58586 7.834644 8.578314       5.258835 8.954305       6.858635 8.041926       8.191970 23.82688 8.855410 23.22601 9.376839 0.6008720      12.89742 
1 1 1 16  20 26 o 19.82797 7.774861 5.515382       5.474317 6.160470       7.418522 4.744143       8.111516 21.03365 8.753277 20.37060 8.833938 0.6630478      12.43617 
1 1 1 16  20 27 o 17.38504 7.320423 3.264180       5.281725 -2.685532      7.437155 9.318492       7.502245 15.76311 7.435203 22.91541 9.065929 -7.152295      11.72490 
1 1 1 16  20 28 o 16.57071 7.241331 2.435409       5.539169 0.3194728      7.951938 4.429883       7.720333 17.03381 7.921410 18.97402 8.409809 -1.940212      11.55308 
1 1 1 16  20 29 o 32.90700 8.229180 19.85852       6.581296 22.43696       9.800536 17.74082       8.881847 29.53649 10.64763 26.91164 10.06237 2.624851       14.65003 
1 1 1 16  20 30 o 13.46470 6.378690 -1.667285      5.585790 4.058930       8.514732 -5.993328      7.400866 17.61580 8.193710 13.45702 6.601775 4.158781       10.52237 
1 1 1 16  20 31 o 9.676919 4.870815 -11.30826      5.222907 -25.64257      7.924679 -0.3003139     6.944589 10.06312 5.152500 14.69120 7.003151 -4.628086      8.694388 
1 1 1 16  20 32 o 22.09246 9.331057 15.69470       8.623848 0.000000       0.000000 15.69470       8.623848 ?        ?        22.09246 9.331057 0.000000       9.331057 
1 1 1 16  21 0  o 135.0030 3.437156 222.8927       11.29862 229.2741       19.78017 219.8021       13.76530 136.4223 5.964299 133.9374 4.222705 2.484848       7.307811 
1 1 1 16  21 1  o 74.73869 2.625936 68.26894       4.775187 67.62405       7.398188 68.72948       6.251885 74.22070 4.106390 74.90993 3.433936 -0.6892319     5.352976 
1 1 1 16  21 2  o 121.5454 2.636997 180.3460       7.810599 189.6953       12.34508 174.1055       10.08592 124.4266 4.076913 119.2910 3.473238 5.135605       5.355801 
1 1 1 16  21 3  o 146.2967 2.797375 261.3565       9.972895 253.4872       15.08983 267.4595       13.28882 143.7961 4.311138 147.8747 3.687708 -4.078613      5.673191 
1 1 1 16  21 4  o 101.1686 2.537607 125.0223       6.251197 130.7319       9.586360 120.7984       8.245450 103.2932 3.814983 99.34257 3.411046 3.950653       5.117551 
1 1 1 16  21 5  o 134.5416 2.682965 221.0456       8.796458 204.7924       12.82301 235.4926       12.08951 129.2506 4.076284 138.7034 3.579716 -9.452774      5.424985 
1 1 1 16  21 6  o 49.34865 3.176636 29.89321       3.799845 29.93733       8.349655 29.88169       4.267352 48.64235 7.266404 49.29044 3.577050 -0.6480865     8.099130 
1 1 1 16  21 7  o 48.72987 4.961307 29.47909       5.809446 30.92458       8.316792 28.10175       8.118396 49.46253 7.103449 47.05534 7.317603 2.407188       10.19835 
1 1 1 16  21 8  o 70.20235 4.469640 60.74644       7.606749 51.00174       10.50686 71.48010       11.02712 63.77790 6.868464 75.84255 6.015656 -12.06466      9.130384 
1 1 1 16  21 9  o 21.46855 8.541387 3.199347       6.694729 8.588476       7.713245 -13.26004      13.47984 27.28619 9.482219 21.41287 10.07221 5.873314       13.83336 
1 1 1 16  21 10 o 154.0141 4.886769 292.4309       18.31759 282.8911       24.73683 304.0128       27.25599 150.6808 6.753907 155.9877 7.189606 -5.306870      9.864365 
1 1 1 16  21 11 o 55.28659 5.562954 38.18413       7.393047 40.54135       10.45700 35.82840       10.45369 56.33558 7.828301 52.71071 8.421615 3.624863       11.49808 
1 1 1 16  21 12 o 25.16472 9.748939 5.652167       8.524415 0.000000       0.000000 5.652167       8.524415 ?        ?        25.16472 9.748939 0.000000       9.748939 
1 1 1 16  21 13 o 52.50293 7.059730 35.20607       8.803801 0.000000       0.000000 35.20607       8.803801 ?        ?        52.50293 7.059730 0.000000       7.059730 
1 1 1 16  21 14 o 27.50866 7.637657 9.911993       5.301304 11.22142       7.752453 8.761883       7.265562 29.52616 9.494397 26.83365 9.208460 2.692501       13.22646 
1 1 1 16  21 15 o 39.09873 6.184151 19.64511       5.696465 29.32173       8.330840 11.14777       7.806715 47.47098 7.446265 29.33191 9.535608 18.13908       12.09854 
1 1 1 16  21 16 o 78.70241 4.726168 77.35733       9.022518 69.03073       11.69839 89.58237       14.17480 73.47929 6.603543 83.52161 7.029556 -10.04232      9.644762 
1 1 1 16  21 17 o 109.9213 4.652849 151.0686       12.43522 145.5021       16.76973 157.8683       18.53452 106.6051 6.485928 110.7043 6.904761 -4.099213      9.473278 
1 1 1 16  21 18 o 91.46256 4.671085 105.1286       10.37664 112.3117       14.36770 97.29689       15.00243 93.35663 6.353333 86.19670 7.208188 7.159927       9.608477 
1 1 1 16  21 19 o 46.62689 6.059863 28.38217       6.722764 25.94364       9.013001 31.44030       10.09330 42.97827 8.898867 47.29733 9.087250 -4.319061      12.71880 
1 1 1 16  21 20 o 17.04225 7.244986 0.9988280      5.255945 5.742089       7.010087 -5.091063      7.943094 22.76328 8.834618 16.96584 7.898976 5.797445       11.85092 
1 1 1 16  21 21 o 78.75385 4.976174 79.91221       9.501172 84.51105       12.84192 74.35038       14.12257 79.27893 6.710118 72.82798 8.094116 6.450951       10.51382 
1 1 1 16  21 22 o 27.84862 9.439856 11.82578       7.631234 11.82578       7.631234 0.000000       0.000000 27.84862 9.439856 ?        ?        0.000000       9.439856 
1 1 1 16  21 23 o 34.74249 7.358943 17.57579       6.036247 13.24807       7.829105 23.91911       9.478523 28.61849 9.560735 38.01093 10.07258 -9.392433      13.88757 
1 1 1 16  21 24 o 33.12212 7.196816 16.29708       5.642518 11.76519       7.102248 24.05277       9.291087 26.69521 9.105918 37.29368 10.01345 -10.59848      13.53465 
1 1 1 16  21 25 o 14.65316 6.625674 -0.6005201     5.057544 0.8397228E-01  6.775648 -1.461705      7.600020 16.87921 7.646946 16.84298 7.802128 0.3622437E-01  10.92470 
1 1 1 16  21 26 o 14.34141 6.534418 -0.7523682     5.035604 -5.338153      7.003218 4.156627       7.245813 14.39568 6.907980 19.29834 8.359156 -4.902658      10.84415 
1 1 1 16  21 27 o 16.01706 7.040180 1.752388       5.304128 4.332719       7.572147 -0.7334136     7.432152 19.04467 8.389839 16.34885 7.621411 2.695824       11.33469 
1 1 1 16  21 28 o 24.83891 8.639755 12.20943       6.404281 20.72982       9.618019 5.422629       8.583974 28.95597 10.53269 19.28168 8.683049 9.674294       13.65038 
1 1 1 16  21 29 o 25.11903 8.610979 13.26284       6.352868 28.59651       10.31786 3.900402       8.062340 32.60510 10.97664 17.71287 8.144311 14.89223       13.66808 
1 1 1 16  21 30 o 18.60055 7.728823 6.789153       5.770941 7.506767       8.600105 6.201342       7.783538 18.76702 8.546474 18.12443 8.205037 0.6425819      11.84757 
1 1 1 16  21 31 o 12.55855 6.199485 -6.055748      6.869523 0.000000       0.000000 -6.055748      6.869523 ?        ?        12.55855 6.199485 0.000000       6.199485 
1 1 1 16  22 0  o 57.78111 2.800506 40.86483       3.931545 37.57585       6.080162 43.22813       5.154006 55.18631 4.561850 59.34948 3.580273 -4.163170      5.799037 
1 1 1 16  22 1  o 97.86352 3.157718 117.1532       7.520755 114.6814       9.662833 120.9516       11.97819 96.69244 4.110245 99.15455 4.973146 -2.462105      6.451844 
1 1 1 16  22 2  o 142.9683 2.801646 249.6389       9.760883 261.6849       15.31057 241.3904       12.66941 146.0801 4.305648 140.4141 3.705864 5.666016       5.680848 
1 1 1 16  22 3  o 182.9512 3.528864 409.4412       15.73281 441.8184       32.46164 399.5011       17.98645 188.8043 7.067891 180.5953 4.086983 8.208939       8.164466 
1 1 1 16  22 4  o 39.16849 2.928353 18.85070       2.774863 24.70371       4.406790 15.00534       3.571917 44.71854 4.089089 34.72305 4.314066 9.995487       5.944057 
1 1 1 16  22 5  o 44.46847 2.749045 24.25050       2.964433 26.60712       4.343101 22.19489       4.056266 46.44746 3.872285 42.37801 3.974175 4.069450       5.548753 
1 1 1 16  22 6  o 108.0763 3.239589 143.0133       8.522477 135.7619       15.56914 146.1157       10.18370 104.6414 6.132431 109.1377 3.835043 -4.496307      7.232860 
1 1 1 16  22 7  o 18.76054 8.415514 -3.315425      7.975841 0.000000       0.000000 -3.315425      7.975841 ?        ?        18.76054 8.415514 0.000000       8.415514 
1 1 1 16  22 8  o 137.6039 6.978920 236.2185       23.32570 0.000000       0.000000 236.2185       23.32570 ?        ?        137.6039 6.978920 0.000000       6.978920 
1 1 1 16  22 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  22 10 o 24.20478 10.61195 -1.552724      11.98200 0.000000       0.000000 -1.552724      11.98200 ?        ?        24.20478 10.61195 0.000000       10.61195 
1 1 1 16  22 11 o 29.27068 7.493808 11.18984       5.367612 15.30329       7.815043 7.516552       7.385090 34.01003 9.206200 25.84036 9.251758 8.169661       13.05179 
1 1 1 16  22 12 o 17.69532 7.007983 2.281842       4.487137 0.9037517      5.805389 4.326855       7.071970 18.28881 7.686303 22.61724 8.846203 -4.328424      11.71898 
1 1 1 16  22 13 o 25.88221 7.403238 8.727053       4.904728 11.59237       6.838938 5.692500       7.038012 29.67626 8.815424 23.70358 8.937243 5.972681       12.55333 
1 1 1 16  22 14 o 53.90760 4.949075 36.44436       6.428959 49.21242       9.662784 26.30322       8.611587 62.13099 6.477012 44.57117 8.231702 17.55981       10.47438 
1 1 1 16  22 15 o 55.34290 4.958813 38.50970       6.616879 46.81215       10.01069 32.06807       8.817775 60.21866 6.949079 49.45343 7.556316 10.76524       10.26585 
1 1 1 16  22 16 o 67.91518 4.944547 58.06210       8.127261 54.94031       10.72163 62.27881       12.46081 65.10473 6.860938 68.94053 7.539938 -3.835800      10.19427 
1 1 1 16  22 17 o 19.82328 7.406098 4.200707       4.809570 0.8353874      6.621724 7.958634       6.997325 18.90395 8.086990 25.27102 9.010353 -6.367077      12.10727 
1 1 1 16  22 18 o 64.78802 5.056200 53.46850       7.919622 58.01954       10.83150 48.24069       11.60895 66.38244 6.791361 59.47083 8.230776 6.911606       10.67091 
1 1 1 16  22 19 o 27.58448 9.334714 10.66430       7.462002 10.66430       7.462002 0.000000       0.000000 27.58448 9.334714 ?        ?        0.000000       9.334714 
1 1 1 16  22 20 o 50.26742 7.837343 35.34855       9.287449 35.34855       9.287449 0.000000       0.000000 50.26742 7.837343 ?        ?        0.000000       7.837343 
1 1 1 16  22 21 o 17.34304 7.218863 2.055538       5.047079 0.5542482      6.979010 3.701534       7.307618 18.35900 8.072364 20.76657 8.668396 -2.407570      11.84501 
1 1 1 16  22 22 o 13.92028 6.371489 -1.996183      4.858925 -6.830766      6.366908 4.746374       7.519022 13.72699 6.586988 21.29302 8.832618 -7.566035      11.01833 
1 1 1 16  22 23 o 72.25960 5.056934 69.68832       8.848483 85.95760       12.60224 53.86865       12.42689 77.79042 6.713549 58.38689 9.024682 19.40353       11.24796 
1 1 1 16  22 24 o 21.29233 7.943226 6.771898       5.528430 4.693208       7.442111 9.331462       8.258176 20.26198 8.617669 23.82170 9.483556 -3.559723      12.81413 
1 1 1 16  22 25 o 25.44976 8.142862 10.86564       5.707550 6.365477       7.841386 15.93626       8.323565 21.10727 8.905413 28.77683 9.856745 -7.669565      13.28389 
1 1 1 16  22 26 f 13.49211 6.311913 -2.253677      5.171487 0.1560465      7.416582 -4.534042      7.214767 16.85914 7.773305 14.70511 7.044553 2.154037       10.49047 
1 1 1 16  22 27 o 28.08283 8.490542 14.77641       6.302239 12.19778       9.324753 16.94478       8.550872 23.36013 9.774435 27.44541 9.938650 -4.085274      13.93974 
1 1 1 16  22 28 o 21.08142 8.184828 8.691412       6.018487 7.953503       8.968626 9.295940       8.117701 20.08139 8.972096 20.92692 8.953250 -0.8455296     12.67514 
1 1 1 16  22 29 o 19.90106 8.754957 9.069877       8.219037 0.000000       0.000000 9.069877       8.219037 ?        ?        19.90106 8.754957 0.000000       8.754957 
1 1 1 16  22 30 o 16.49284 7.401789 4.168601       6.178103 9.124370       9.351180 0.3298541      8.230109 19.01979 8.754667 15.49310 7.448613 3.526694       11.49461 
1 1 1 16  22 31 o 21.31820 8.406981 11.51390       6.432500 8.767158       9.625361 13.73062       8.646951 18.21597 8.550406 20.92847 9.097982 -2.712500      12.48530 
1 1 1 16  23 0  o 45.17612 3.830737 25.16284       4.177507 28.24325       7.561782 23.80972       5.011730 47.34234 6.745034 43.78926 4.773815 3.553078       8.263461 
1 1 1 16  23 1  o 133.3662 4.495211 218.4427       14.58850 223.5434       19.52581 211.9978       21.94859 134.5130 5.971623 130.6781 6.916991 3.834946       9.138110 
1 1 1 16  23 2  o 150.2507 4.374686 277.1498       16.00062 0.000000       0.000000 277.1498       16.00062 ?        ?        150.2507 4.374686 0.000000       4.374686 
1 1 1 16  23 3  o 54.33331 3.161297 36.22276       4.167617 31.76538       6.935869 38.74153       5.213822 50.44039 5.744969 56.10725 3.836384 -5.666859      6.908148 
1 1 1 16  23 4  o 153.1330 3.796568 287.3199       14.16760 0.000000       0.000000 287.3199       14.16760 ?        ?        153.1330 3.796568 0.000000       3.796568 
1 1 1 16  23 5  o 70.77327 2.675967 61.29681       4.606841 52.37622       7.454683 66.80846       5.859672 65.09743 4.731559 73.81468 3.265659 -8.717255      5.749102 
1 1 1 16  23 6  o 53.30282 2.461533 34.78435       3.188730 36.71175       4.464766 32.77764       4.555700 54.65182 3.368789 51.58854 3.647327 3.063278       4.965051 
1 1 1 16  23 7  o 95.93847 4.006433 113.2001       9.346090 144.5527       15.15819 93.97098       11.87107 107.9135 5.785298 86.99001 5.630193 20.92352       8.072717 
1 1 1 16  23 8  o 37.08821 6.411199 17.57552       5.584891 19.91282       7.720425 15.00978       8.088912 39.02823 8.368763 33.80387 9.452581 5.224354       12.62488 
1 1 1 16  23 9  o 19.09089 7.292798 3.262307       4.723543 7.351672       6.261433 -2.138610      7.195807 24.93716 8.548781 18.23285 8.098124 6.704308       11.77545 
1 1 1 16  23 10 o 130.9577 4.710112 212.1815       15.00688 223.4673       20.67386 199.6116       21.81823 133.5684 6.369939 125.7770 7.147820 7.791351       9.574312 
1 1 1 16  23 11 o 39.74860 7.492722 20.60711       6.991556 23.07656       7.956194 12.23551       14.64904 41.92157 8.081067 33.47633 12.82930 8.445244       15.16227 
1 1 1 16  23 12 o 92.82912 4.544511 106.9857       10.24910 117.1577       14.17420 95.83969       14.83736 96.46687 6.060161 86.69871 7.084476 9.768158       9.322840 
1 1 1 16  23 13 o 78.25211 4.698321 76.35960       8.918054 76.44865       12.12095 76.25449       13.16808 77.51057 6.476252 77.09209 7.088631 0.4184799      9.601590 
1 1 1 16  23 14 o 34.91642 6.679436 15.99313       5.476353 23.95677       8.123160 9.358011       7.414700 42.30639 8.175088 27.16608 9.303113 15.14031       12.38467 
1 1 1 16  23 15 o 82.66699 4.647004 85.65828       9.323722 81.41505       12.42074 91.13577       14.11206 79.56184 6.461870 83.85036 6.969306 -4.288521      9.504051 
1 1 1 16  23 16 o 55.40291 5.245344 39.11122       6.997450 35.46371       9.152161 44.24367       10.85645 51.59045 7.499221 57.41088 7.974966 -5.820431      10.94707 
1 1 1 16  23 17 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  23 18 o 31.35821 9.439543 14.37220       7.801996 14.37220       7.801996 0.000000       0.000000 31.35821 9.439543 ?        ?        0.000000       9.439543 
1 1 1 16  23 19 o 15.84286 6.951309 -0.1959471     5.150310 5.944420       6.680529 -9.192822      8.086480 22.44405 8.647634 15.38696 7.393902 7.057089       11.37767 
1 1 1 16  23 20 o 19.13920 7.451997 3.997255       5.000115 6.470251       7.070184 1.522795       7.072278 22.80488 8.866368 19.07472 8.260382 3.730156       12.11802 
1 1 1 16  23 21 f 24.68913 7.935363 9.016569       5.415923 8.873799       7.616043 9.162627       7.703244 24.65221 9.296550 24.92015 9.359941 -0.2679310     13.19221 
1 1 1 16  23 22 o 50.21797 5.775786 34.61996       6.939604 42.04736       10.00491 27.73338       9.633776 52.84522 8.020737 40.71685 9.823212 12.12837       12.68179 
1 1 1 16  23 23 o 33.24035 7.599444 17.06461       6.021317 28.07602       8.398426 5.417460       8.637464 41.85144 8.524632 21.34875 9.186234 20.50269       12.53221 
1 1 1 16  23 24 o 23.92974 8.290448 9.546200       5.894120 6.851882       8.319690 12.26115       8.351489 21.66400 9.158300 25.65963 9.721895 -3.995626      13.35626 
1 1 1 16  23 25 o 21.15128 7.924135 7.302888       5.513735 6.570491       7.528346 8.150311       8.097975 20.73857 8.736530 21.90337 9.132663 -1.164806      12.63853 
1 1 1 16  23 26 o 16.92042 7.229512 3.227002       5.280137 5.215400       7.243839 0.9728900      7.712675 19.17521 8.331577 17.08808 7.895979 2.087126       11.47875 
1 1 1 16  23 27 o 20.36078 8.818873 8.021159       8.063807 0.000000       0.000000 8.021159       8.063807 ?        ?        20.36078 8.818873 0.000000       8.818873 
1 1 1 16  23 28 o 19.57549 8.691479 8.081553       8.281807 0.000000       0.000000 8.081553       8.281807 ?        ?        19.57549 8.691479 0.000000       8.691479 
1 1 1 16  23 29 o 10.48766 5.215340 -8.217343      5.206474 -0.9064361     7.558737 -14.81736      7.181844 14.90693 7.159423 11.04045 5.576216 3.866480       9.074774 
1 1 1 16  23 30 o 15.40586 7.009104 2.914292       5.766985 3.172002       8.236360 2.666430       8.077460 16.25520 7.713773 16.02618 7.614868 0.2290211      10.83921 
1 1 1 16  24 0  o 105.1512 3.018931 135.2963       7.727762 114.2691       14.59061 143.4946       9.110533 95.93224 6.275723 108.2216 3.459011 -12.28936      7.165854 
1 1 1 16  24 1  o 117.8445 2.686103 169.6893       7.713795 160.4515       11.56180 177.0999       10.35551 114.2926 4.158110 120.2141 3.538778 -5.921486      5.460112 
1 1 1 16  24 2  o 132.1071 2.764474 213.3141       8.899688 226.5563       13.80771 203.9030       11.64017 135.8108 4.177031 128.9466 3.708213 6.864212       5.585556 
1 1 1 16  24 3  o 66.27918 2.665881 53.77587       4.297016 57.11330       6.443134 51.10236       5.766763 68.13204 3.896951 64.46906 3.686026 3.662987       5.364048 
1 1 1 16  24 4  o 66.42137 2.648756 54.01319       4.278722 58.10418       6.477050 50.84565       5.699337 68.71110 3.884063 64.30053 3.652273 4.410568       5.331514 
1 1 1 16  24 5  f 131.4464 2.695616 211.2751       8.634611 207.8932       12.83269 214.0730       11.67203 130.0373 4.054568 132.0744 3.629976 -2.037109      5.442081 
1 1 1 16  24 6  o 15.68089 3.869087 3.138896       1.469261 1.956367       2.149140 4.176572       2.013212 13.78597 4.983910 18.06837 4.569942 -4.282399      6.761932 
1 1 1 16  24 7  f 86.82690 4.700459 93.28127       9.908510 81.97459       12.42348 113.0460       16.42561 80.86063 6.355836 94.68928 7.171762 -13.82864      9.582840 
1 1 1 16  24 8  o 35.05043 6.210366 15.75538       5.110373 17.09759       6.675194 13.85469       7.943446 36.12743 7.810086 32.42941 9.465784 3.698025       12.27186 
1 1 1 16  24 9  o 32.81291 6.776218 14.00040       5.238852 19.23024       7.277909 8.376480       7.547133 38.21392 8.068932 26.65182 9.371316 11.56211       12.36646 
1 1 1 16  24 10 o 112.3856 4.606461 156.6717       12.58904 151.1519       16.73957 163.8583       19.10027 109.5463 6.297157 113.6864 6.927251 -4.140152      9.361677 
1 1 1 16  24 11 o 16.96789 7.025961 1.239778       4.745892 7.315862       6.473780 -5.819554      6.977950 24.77996 8.681990 15.84691 7.386565 8.933047       11.39905 
1 1 1 16  24 12 o 32.82641 8.057497 14.46569       6.396945 18.15005       7.417203 3.768439       12.63850 36.68592 8.468252 26.79645 11.30584 9.889471       14.12562 
1 1 1 16  24 13 o 35.32519 6.293813 16.27855       5.219263 12.42820       7.142579 20.69002       7.645349 30.25949 9.013996 39.13497 8.275723 -8.875477      12.23682 
1 1 1 16  24 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  24 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  24 16 o 81.78278 4.795433 84.83253       9.515157 102.2188       13.57722 68.05132       13.33887 88.53376 6.334986 70.92501 7.848807 17.60875       10.08642 
1 1 1 16  24 17 o 35.02837 6.518807 16.54981       5.359748 14.16696       7.579494 18.93309       7.580163 31.13723 9.288051 36.29707 8.685977 -5.159845      12.71669 
1 1 1 16  24 18 o 16.81036 7.213483 0.8522858      5.298371 -2.549970      7.009033 5.388786       8.093476 16.82511 7.682612 22.85683 9.286616 -6.031715      12.05254 
1 1 1 16  24 19 o 17.67867 7.322843 2.301927       5.157936 0.9366031      6.757566 4.207632       7.983629 18.36767 8.012931 21.61895 9.044959 -3.251274      12.08381 
1 1 1 16  24 20 o 32.65910 7.579175 15.68105       5.915388 26.93542       8.589642 5.528703       8.158262 42.08619 8.664147 22.22761 9.208574 19.85859       12.64378 
1 1 1 16  24 21 o 14.26322 6.500744 -1.496741      4.988591 -0.4631152E-01 6.928560 -3.058036      7.188484 17.38920 7.818436 16.12663 7.510321 1.262577       10.84126 
1 1 1 16  24 22 o 26.18955 7.538043 10.67669       5.069795 6.346725       6.557991 17.10812       7.992499 21.25072 8.454040 31.14917 9.590139 -9.898457      12.78443 
1 1 1 16  24 23 o 18.77096 7.600213 4.440766       5.399307 2.359698       7.298660 6.956257       8.024376 18.46732 8.181499 21.73574 9.079046 -3.268415      12.22154 
1 1 1 16  24 24 o 13.37022 6.228267 -2.099634      4.948859 -3.083073      6.404170 -0.6418619     7.797118 14.58397 6.885254 16.92203 7.860734 -2.338064      10.44978 
1 1 1 16  24 25 o 23.32449 9.355918 10.99312       8.098896 0.000000       0.000000 10.99312       8.098896 ?        ?        23.32449 9.355918 0.000000       9.355918 
1 1 1 16  24 26 o 20.17490 8.799218 7.441751       8.144631 0.000000       0.000000 7.441751       8.144631 ?        ?        20.17490 8.799218 0.000000       8.799218 
1 1 1 16  24 27 o 14.88031 6.838569 0.7758457      5.674770 -4.444586      8.361096 5.234513       7.727029 14.70748 7.172718 18.19765 8.212646 -3.490162      10.90392 
1 1 1 16  24 28 o 13.25969 6.340781 -2.218941      5.788716 11.34496       9.154858 -11.25465      7.472062 20.65944 9.157291 12.06554 6.038188 8.593897       10.96885 
1 1 1 16  24 29 o 15.75874 7.154802 3.179867       5.970732 1.196773       8.987490 4.746539       7.988326 15.94452 7.695315 17.01072 7.920399 -1.066201      11.04312 
1 1 1 16  25 0  o 146.0824 2.859221 260.9790       10.17845 249.3394       15.32665 270.1628       13.61406 142.3557 4.423477 148.3822 3.768090 -6.026566      5.810822 
1 1 1 16  25 1  o 185.6009 3.169795 421.7139       14.33664 418.5927       22.05277 423.9986       18.86789 184.2405 4.916208 185.7843 4.167523 -1.543854      6.444948 
1 1 1 16  25 2  o 48.93103 3.837110 29.56108       4.538781 26.03743       5.380386 38.25644       8.452024 45.70272 4.907778 55.12875 6.410832 -9.426033      8.073726 
1 1 1 16  25 3  o 118.4522 2.676380 171.5984       7.725509 171.8792       11.65134 171.3780       10.32038 118.1978 4.051098 118.1474 3.588717 0.5033875E-01  5.412049 
1 1 1 16  25 4  o 29.52165 3.753470 10.86976       2.639318 12.61114       3.909168 9.410997       3.577911 31.52358 5.274990 27.07582 5.607325 4.447767       7.698546 
1 1 1 16  25 5  o 102.7009 2.818993 129.2203       7.048447 128.2783       12.06514 129.7083       8.684524 101.7742 4.878939 102.7500 3.473385 -0.9758072     5.989027 
1 1 1 16  25 6  o 160.2191 2.903326 314.4853       11.33564 320.4277       17.23268 309.9529       15.05011 161.1048 4.393535 158.7175 3.891158 2.387268       5.868924 
1 1 1 16  25 7  o 41.40642 5.664907 21.72794       5.566342 18.96216       7.946590 24.39226       7.799466 37.73230 8.804027 43.28385 7.675413 -5.551548      11.68002 
1 1 1 16  25 8  o 35.54754 6.174029 16.26204       5.154339 28.66556       7.461536 4.940933       7.128532 47.29086 6.658762 23.11272 8.925570 24.17814       11.13575 
1 1 1 16  25 9  o 70.29501 4.723183 61.59944       8.043914 59.55451       10.50706 64.49516       12.50317 68.48666 6.368608 70.83237 7.350294 -2.345711      9.725533 
1 1 1 16  25 10 o 22.00415 7.869138 5.527619       5.341092 1.122057       5.952561 23.72681       12.09844 18.51346 7.782064 40.92922 11.60107 -22.41576      13.96945 
1 1 1 16  25 11 o 24.77650 7.984994 7.898208       5.481369 9.975861       6.221840 0.6947979      11.58515 27.44505 8.463493 24.20775 10.52713 3.237293       13.50745 
1 1 1 16  25 12 o 37.67183 7.045568 18.79681       6.230265 19.07549       7.102982 17.86718       12.97306 37.56363 8.004583 35.52876 12.30005 2.034870       14.67530 
1 1 1 16  25 13 o 24.24576 8.456792 7.368519       6.138170 13.31538       7.048481 -11.29704      12.48740 30.98903 8.878353 20.03496 9.504705 10.95407       13.00633 
1 1 1 16  25 14 o 54.57681 5.376157 38.18917       7.057432 47.60695       9.729391 27.73129       10.25258 60.17285 6.751431 43.95094 9.820295 16.22191       11.91722 
1 1 1 16  25 15 o 29.14460 6.857161 11.57743       4.788260 9.323508       6.318940 14.61696       7.337996 26.10312 8.584758 31.90510 9.032038 -5.801971      12.46097 
1 1 1 16  25 16 o 20.06390 7.126806 4.977894       4.373755 5.899685       5.911160 3.862695       6.501786 22.07675 8.217937 20.65797 8.348819 1.418779       11.71483 
1 1 1 16  25 17 o 28.76185 6.988394 11.58688       4.849245 8.073471       6.972969 14.87751       6.748283 24.45748 8.957042 31.80183 8.531694 -7.344347      12.37006 
1 1 1 16  25 18 f 28.37530 8.076300 11.89368       5.851295 17.68052       8.188976 5.857183       8.363752 33.57076 9.554120 22.94321 9.395428 10.62755       13.39982 
1 1 1 16  25 19 o 17.80393 7.215207 3.019062       4.871168 2.102021       6.903419 3.928414       6.874415 18.95769 8.185342 20.22351 8.421955 -1.265821      11.74432 
1 1 1 16  25 20 o 14.94020 6.717145 -0.6830708     5.113747 3.392305       6.980537 -5.403379      7.512599 19.56720 8.334979 15.47278 7.349579 4.094421       11.11252 
1 1 1 16  25 21 o 32.37281 7.715971 16.27398       6.000515 18.87507       8.642679 13.85330       8.337564 32.32197 9.976366 27.77019 9.842225 4.551785       14.01418 
1 1 1 16  25 22 o 23.60053 7.862233 8.977471       5.295106 3.699114       7.423090 14.44580       7.555488 19.38743 8.428808 28.25087 9.391068 -8.863432      12.61891 
1 1 1 16  25 23 f 14.75893 7.195412 -8.148582      8.394304 0.000000       0.000000 -8.148582      8.394304 ?        ?        14.75893 7.195412 0.000000       7.195412 
1 1 1 16  25 24 o 20.23158 8.757758 6.329999       7.943012 0.000000       0.000000 6.329999       7.943012 ?        ?        20.23158 8.757758 0.000000       8.757758 
1 1 1 16  25 25 o 16.91308 7.382842 3.199959       5.744099 3.512065       8.176626 2.895853       8.071166 18.18425 8.301177 17.84849 8.185280 0.3357563      11.65797 
1 1 1 16  25 26 o 25.92639 8.416096 13.61593       6.082490 5.400490       8.089379 24.30261       9.226167 18.47231 8.363389 31.16238 10.37805 -12.69007      13.32855 
1 1 1 16  25 27 o 35.92683 8.194963 24.73408       7.015363 33.77062       10.01787 16.03803       9.827320 36.65140 10.61052 23.11757 9.869715 13.53384       14.49119 
1 1 1 16  25 28 o 18.57331 7.817768 7.158173       6.020098 6.733825       8.536666 7.577986       8.490926 18.08709 8.339540 18.47538 8.443643 -0.3882904     11.86773 
1 1 1 16  26 0  o 74.21600 2.718941 67.47586       4.909065 65.23968       7.265182 69.35459       6.659257 72.72005 4.116550 75.08267 3.650510 -2.362617      5.502019 
1 1 1 16  26 1  o 132.0034 2.787053 213.2667       8.965332 234.6369       14.20837 199.1295       11.55637 137.9947 4.230181 127.2750 3.730020 10.71971       5.639812 
1 1 1 16  26 2  o 148.0052 2.880171 268.2570       10.38798 281.7551       16.19726 258.8257       13.53915 151.1138 4.403162 145.0496 3.833715 6.064240       5.838253 
1 1 1 16  26 3  o 52.14543 2.962835 33.42479       3.749463 38.22015       5.583794 29.48704       5.059912 55.54800 4.155116 48.71994 4.306157 6.828060       5.983976 
1 1 1 16  26 4  f 54.81252 2.766789 36.89177       3.683707 38.10421       5.427263 35.85608       5.016095 55.46930 4.042818 53.84086 3.848496 1.628433       5.581693 
1 1 1 16  26 5  o 49.77047 3.581482 30.61914       4.314762 31.44440       8.341023 30.31762       5.041742 49.43808 7.129191 49.38489 4.230088 0.5318451E-01  8.289693 
1 1 1 16  26 6  o 44.93391 2.713092 24.83276       2.956969 23.51084       4.755256 25.66617       3.775734 43.34226 4.570972 45.56023 3.425881 -2.217972      5.712306 
1 1 1 16  26 7  o 97.90525 3.552147 118.2009       8.460822 124.7493       14.69759 114.9553       10.34724 99.45218 6.093767 96.23466 4.424052 3.217514       7.530354 
1 1 1 16  26 8  o 41.93523 6.336530 22.66871       6.273624 23.39550       7.253726 20.51114       12.49792 42.25596 7.308683 38.19358 12.02932 4.062382       14.07556 
1 1 1 16  26 9  f 25.73285 6.965161 8.760462       4.473536 9.457994       5.792137 7.729209       7.042701 26.76126 8.149815 25.37097 9.040218 1.390287       12.17148 
1 1 1 16  26 10 o 46.48703 4.871204 27.31887       5.436437 37.59022       7.916209 18.15082       7.478973 54.09409 6.112183 36.43427 8.568322 17.65982       10.52497 
1 1 1 16  26 11 o 42.40865 5.575109 23.11832       5.622206 36.39111       8.340679 12.06544       7.611286 52.85413 6.620537 29.69218 9.392213 23.16195       11.49109 
1 1 1 16  26 12 o 76.63314 4.668949 74.03659       8.677728 78.63506       11.65289 68.31175       13.00196 78.02285 6.179228 71.70141 7.554640 6.321442       9.759890 
1 1 1 16  26 13 o 21.92757 7.046052 6.296252       4.270207 13.26364       5.953786 -1.084727      6.127951 30.91063 7.881125 16.83334 7.475019 14.07729       10.86223 
1 1 1 16  26 14 o 24.33606 8.031189 7.999872       5.528584 6.476128       6.204416 13.87330       12.18122 22.95007 8.441700 31.05934 11.74726 -8.109268      14.46584 
1 1 1 16  26 15 o 37.96540 5.708386 19.07813       5.117941 17.20077       7.100792 21.10780       7.383187 34.45253 8.508684 38.52504 8.120757 -4.072510      11.76199 
1 1 1 16  26 16 o 11.51336 5.457685 -4.223730      4.101514 -7.364349      5.397870 0.6653804E-01  6.308947 12.28459 5.937457 17.41141 7.664690 -5.126822      9.695404 
1 1 1 16  26 17 o 15.05174 6.564724 0.1792652      4.533249 0.6407685      6.326704 -0.3076747     6.498720 17.61843 7.718109 17.20942 7.666547 0.4090157      10.87866 
1 1 1 16  26 18 o 41.66978 6.326978 24.14280       6.223039 23.86150       8.239915 24.51625       9.494173 39.19961 8.837708 38.45867 10.02845 0.7409363      13.36693 
1 1 1 16  26 19 o 48.34134 5.861812 32.29358       6.764446 47.63255       9.580020 17.04172       9.552781 57.45068 6.986269 30.57996 10.55633 26.87071       12.65876 
1 1 1 16  26 20 o 47.43288 6.337443 32.14635       7.142240 35.16941       10.28669 29.33250       9.924354 45.66401 9.551632 40.84200 10.04277 4.822014       13.85969 
1 1 1 16  26 21 o 15.44717 7.224961 -2.588330      6.769728 0.000000       0.000000 -2.588330      6.769728 ?        ?        15.44717 7.224961 0.000000       7.224961 
1 1 1 16  26 22 o 28.36990 9.893191 16.01989       8.400164 0.000000       0.000000 16.01989       8.400164 ?        ?        28.36990 9.893191 0.000000       9.893191 
1 1 1 16  26 23 o 18.14874 7.592753 4.350317       5.625445 2.564265       7.439403 6.735251       8.596647 17.90244 8.070791 20.63227 9.018562 -2.729826      12.10257 
1 1 1 16  26 24 o 14.76900 6.829894 -0.4113161     5.787660 1.016128       8.220589 -1.814297      8.149844 17.13481 7.996982 15.97781 7.608067 1.156993       11.03786 
1 1 1 16  26 25 o 13.20687 6.276067 -2.427829      5.490341 4.025899       8.761116 -6.601318      7.045369 18.07821 8.375232 13.17856 6.460255 4.899650       10.57731 
1 1 1 16  26 26 o 17.32726 7.638148 4.626509       6.285496 13.83422       9.842390 -1.714851      8.168004 22.08269 9.651288 15.26653 7.360116 6.816165       12.13749 
1 1 1 16  26 27 o 13.20837 6.326627 -2.152068      5.814574 1.206380       8.902918 -4.650197      7.678396 16.17635 7.769324 13.76143 6.745625 2.414920       10.28911 
1 1 1 16  27 0  o 128.1934 3.058983 201.5241       9.556055 199.9818       13.19595 203.2248       13.85686 127.2508 4.261450 128.2053 4.442008 -0.9545593     6.155599 
1 1 1 16  27 1  o 30.54438 4.573715 11.78001       3.299767 12.93097       4.309609 10.14913       5.130029 31.73740 5.785338 27.82624 7.426967 3.911163       9.414350 
1 1 1 16  27 2  o 59.26482 3.021035 43.19873       4.348642 43.15526       5.810719 43.25408       6.556398 59.01302 4.065444 58.94341 4.600934 0.6961060E-01  6.139741 
1 1 1 16  27 3  o 96.67313 3.495638 115.1182       8.221532 111.2553       9.105741 132.1605       19.12605 94.89415 3.946286 101.4821 7.793572 -6.587906      8.735728 
1 1 1 16  27 4  o 54.30793 2.749138 36.25494       3.626444 38.98377       5.280482 33.81900       4.989049 56.07956 3.888035 52.19934 3.951431 3.880222       5.543520 
1 1 1 16  27 5  o 80.60429 2.555500 79.70862       5.013269 85.00910       7.431714 75.28246       6.791172 82.94102 3.686123 78.07415 3.578970 4.866875       5.137755 
1 1 1 16  27 6  o 19.70827 4.184276 4.989641       1.947389 8.028749       2.761082 1.981414       2.747019 25.01653 4.701712 14.68122 5.572634 10.33531       7.291114 
1 1 1 16  27 7  o 79.42767 3.334137 77.90854       6.439090 0.000000       0.000000 77.90854       6.439090 ?        ?        79.42767 3.334137 0.000000       3.334137 
1 1 1 16  27 8  o 66.25214 4.771498 55.15216       7.651947 54.72756       10.26767 55.68256       11.47581 65.13634 6.557796 65.26041 7.343322 -0.1240692     9.845256 
1 1 1 16  27 9  o 48.56164 4.971144 29.91320       5.799895 42.16859       8.887494 20.82240       7.654497 57.00134 6.515090 39.05145 8.299544 17.94989       10.55125 
1 1 1 16  27 10 o 56.18646 4.621156 39.86276       6.271424 35.97401       8.830411 43.82048       8.908368 52.12129 7.139778 58.02641 6.406471 -5.905113      9.592669 
1 1 1 16  27 11 o 39.17319 5.783358 20.02186       5.355025 24.68967       7.730886 15.71648       7.424690 42.57140 7.736943 33.27664 8.958604 9.294762       11.83710 
1 1 1 16  27 12 o 43.81630 5.440558 24.90886       5.684444 23.86804       7.135766 26.71642       9.403711 41.93910 7.243926 43.14388 9.223760 -1.204784      11.72827 
1 1 1 16  27 13 o 28.18262 6.837343 10.94183       4.647242 10.64523       6.674179 11.22097       6.474743 27.35184 8.810724 28.00664 8.633282 -0.6548042     12.33541 
1 1 1 16  27 14 f 23.55295 7.059245 7.690700       4.370370 7.673897       5.709110 7.714484       6.792342 23.70011 8.161664 24.10022 8.837977 -0.4001122     12.03007 
1 1 1 16  27 15 o 38.25327 7.225924 20.59619       6.489135 24.98893       7.723942 10.05663       11.96416 41.71504 7.887069 27.25113 11.20685 14.46391       13.70399 
1 1 1 16  27 16 o 17.70050 7.046923 3.131943       4.559908 1.648483       6.241195 4.830492       6.678346 18.13456 7.806001 20.92854 8.460252 -2.793983      11.51128 
1 1 1 16  27 17 o 23.30642 7.544310 8.003299       4.889648 8.908954       7.012149 7.146147       6.821792 24.31264 8.968934 22.65877 8.736421 1.653866       12.52066 
1 1 1 16  27 18 o 22.33369 7.734403 7.448717       5.129767 7.397015       6.778852 7.517996       7.846964 22.50481 8.700391 22.87628 9.197785 -0.3714676     12.66081 
1 1 1 16  27 19 o 23.93530 9.185852 9.343987       7.517255 0.000000       0.000000 9.343987       7.517255 ?        ?        23.93530 9.185852 0.000000       9.185852 
1 1 1 16  27 20 o 35.05927 7.843064 19.56299       6.532852 24.64986       9.618608 15.20703       8.900785 35.88763 10.39917 27.97416 10.13859 7.913473       14.52355 
1 1 1 16  27 21 o 59.01859 5.691781 49.65475       8.084598 59.55334       11.57692 40.23240       11.29499 60.62723 8.033421 46.09732 10.31315 14.52991       13.07275 
1 1 1 16  27 22 o 16.29124 6.917512 2.713053       4.781813 2.608454       6.524241 2.834459       7.028936 17.39650 7.719687 17.82443 7.954699 -0.4279308     11.08471 
1 1 1 16  27 23 o 23.55551 8.668385 11.00691       6.543342 16.00779       9.310721 6.126732       9.197680 25.70130 10.12091 19.79742 8.945006 5.903881       13.50725 
1 1 1 16  27 24 o 11.62481 5.692202 -6.289988      5.423129 -12.88232      7.876839 -0.3489129     7.477647 12.38461 6.198119 15.73598 7.432408 -3.351367      9.677674 
1 1 1 16  27 25 o 16.49578 7.301092 3.480799       5.798837 12.46778       8.671871 -3.788036      7.798991 22.03972 9.335163 14.43252 7.013454 7.607203       11.67621 
1 1 1 16  27 26 o 17.23514 8.083004 4.099937       8.569859 4.099937       8.569859 0.000000       0.000000 17.23514 8.083004 ?        ?        0.000000       8.083004 
1 1 1 16  28 0  o 11.03786 4.904859 -0.8997146     2.642999 0.8265937E-02  3.580594 -1.986675      3.917633 13.88577 5.943644 12.87624 5.825910 1.009525       8.322747 
1 1 1 16  28 1  o 81.02312 2.677159 80.58349       5.278644 81.12600       7.748991 80.11378       7.210340 80.94891 3.940075 80.52122 3.684357 0.4276962      5.394319 
1 1 1 16  28 2  o 42.61189 3.346759 22.48889       3.447422 27.41522       4.871499 17.54678       4.879293 46.84001 4.316367 37.03780 5.579004 9.802216       7.053815 
1 1 1 16  28 3  o 12.53237 5.144027 0.7176313      2.514498 -2.013077      3.326825 4.356246       3.840258 11.61617 5.299835 19.29753 6.691557 -7.681369      8.536111 
1 1 1 16  28 4  f 58.07294 2.863893 41.54494       4.040406 50.95869       5.709379 32.10069       5.718626 64.11631 3.669456 50.54115 4.696876 13.57516       5.960331 
1 1 1 16  28 5  o 19.16308 4.923257 4.767711       2.311200 7.543202       3.143543 1.502299       3.409719 24.02460 5.489777 15.08537 6.063846 8.939230       8.179724 
1 1 1 16  28 6  o 28.22299 4.228093 10.11782       2.818514 17.41183       7.143550 8.772984       3.067360 35.68882 8.361116 26.03448 5.016730 9.654335       9.750685 
1 1 1 16  28 7  o 29.32634 2.726737 10.66963       1.926341 10.80218       2.716951 10.53564       2.731622 29.24000 3.911002 28.84975 3.992341 0.3902416      5.588803 
1 1 1 16  28 8  o 22.82640 8.444664 6.030704       6.224038 0.000000       0.000000 6.030704       6.224038 ?        ?        22.82640 8.444664 0.000000       8.444664 
1 1 1 16  28 9  o 35.86110 5.959469 16.90238       5.025240 16.17981       7.003957 17.66899       7.214233 33.95543 8.488146 35.52098 8.456552 -1.565548      11.98173 
1 1 1 16  28 10 o 34.26927 6.052238 15.57569       4.869492 22.47403       7.105996 9.468403       6.686165 40.56240 7.463898 26.32524 8.835960 14.23715       11.56650 
1 1 1 16  28 11 o 32.37767 6.191413 14.07982       4.707105 18.14175       7.067711 10.84193       6.310211 35.71081 8.282605 27.63226 8.523766 8.078547       11.88512 
1 1 1 16  28 12 o 30.80569 6.576759 13.01758       4.786912 17.66188       7.289577 9.496394       6.347258 34.77522 8.640240 25.90765 8.607356 8.867569       12.19591 
1 1 1 16  28 13 o 20.10493 7.270004 5.080464       4.573250 18.78102       7.026781 -4.987399      6.023598 35.91992 8.207584 14.24094 6.709296 21.67898       10.60090 
1 1 1 16  28 14 o 27.79910 7.214789 11.11656       4.929441 14.98721       6.945063 7.186911       6.997801 31.34827 8.756171 23.25804 8.878485 8.090235       12.46988 
1 1 1 16  28 15 o 23.62074 7.634026 8.146988       5.007841 9.644946       6.620546 6.143778       7.656091 25.24061 8.784124 22.37653 9.053801 2.864082       12.61476 
1 1 1 16  28 16 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  28 17 o 25.44945 8.837560 10.54499       6.699524 0.000000       0.000000 10.54499       6.699524 ?        ?        25.44945 8.837560 0.000000       8.837560 
1 1 1 16  28 18 o 14.42549 6.409853 0.1270089E-02  4.513142 -1.964708      6.492473 1.839518       6.278021 15.59921 7.220833 17.58706 7.696766 -1.987854      10.55370 
1 1 1 16  28 19 o 19.07806 7.431794 5.021742       4.974949 6.650126       6.467610 2.662080       7.785569 21.05321 8.388973 18.88906 8.404512 2.164150       11.87479 
1 1 1 16  28 20 o 28.64635 8.194892 14.08506       6.009412 11.99246       8.157672 16.56811       8.886170 24.84476 9.560318 28.24894 10.14441 -3.404184      13.93947 
1 1 1 16  28 21 o 23.73545 8.291647 10.23409       5.902085 15.24720       8.150244 4.706424       8.558319 26.90573 9.708475 19.46710 8.726092 7.438625       13.05370 
1 1 1 16  28 22 o 33.53503 7.901339 19.67394       6.350317 24.53832       9.063331 14.98299       8.900299 33.30328 10.20489 25.19493 9.903285 8.108347       14.22023 
1 1 1 16  28 23 o 20.60932 8.042777 8.135921       5.835005 17.25724       8.437028 -0.2267116     8.078528 26.60647 9.833989 16.15859 7.659627 10.44788       12.46504 
1 1 1 16  28 24 o 21.02261 8.987176 10.38999       8.167775 10.38999       8.167775 0.000000       0.000000 21.02261 8.987176 ?        ?        0.000000       8.987176 
1 1 1 16  28 25 o 16.40242 7.320398 3.653347       5.953331 10.51364       8.956927 -1.775852      7.968116 20.27490 9.018260 14.94683 7.221661 5.328065       11.55342 
1 1 1 16  29 0  o 34.97159 4.036053 15.35021       3.376573 18.32169       4.711640 12.21281       4.841393 37.89959 5.241720 30.39164 6.716101 7.507944       8.519485 
1 1 1 16  29 1  o 105.6725 2.723343 137.2685       7.007099 138.8657       10.33219 135.9083       9.534839 105.7415 4.016993 104.7392 3.741678 1.002319       5.489662 
1 1 1 16  29 2  o 23.66733 5.189867 7.295986       2.910621 9.218641       3.987448 5.103184       4.258377 26.40381 6.287701 20.54292 7.049759 5.860889       9.446390 
1 1 1 16  29 3  o 52.69194 2.902084 34.28068       3.712017 35.56305       5.128649 32.86980       5.379499 53.36970 3.971888 51.17245 4.355239 2.197254       5.894404 
1 1 1 16  29 4  o 29.97551 4.817729 11.53582       3.399990 9.383716       3.844316 19.26476       7.285299 26.62840 6.060922 37.53443 8.195226 -10.90603      10.19296 
1 1 1 16  29 5  o 112.9247 2.661899 156.9169       7.325152 168.0477       11.09676 148.3209       9.751745 116.1307 3.926794 109.2491 3.668128 6.881554       5.373535 
1 1 1 16  29 6  o 16.42845 4.896541 3.460382       2.107204 2.181194       2.676704 5.545213       3.417185 14.75342 5.522397 20.59718 6.257242 -5.843758      8.345654 
1 1 1 16  29 7  o 13.38110 4.265490 2.213586       1.567284 1.408075       2.064288 3.309842       2.408190 12.54746 4.814110 16.29670 5.296009 -3.749244      7.157050 
1 1 1 16  29 8  o 102.7562 4.479336 133.4552       11.18957 138.8142       15.37632 127.4225       16.31417 103.1929 6.142371 98.05907 6.870655 5.133835       9.215999 
1 1 1 16  29 9  o 27.56187 8.604880 10.80272       6.409173 0.000000       0.000000 10.80272       6.409173 ?        ?        27.56187 8.604880 0.000000       8.604880 
1 1 1 16  29 10 o 41.40831 5.537137 22.56534       5.447472 19.22750       7.759870 25.80856       7.649100 36.18023 8.870666 43.04492 7.568234 -6.864697      11.66048 
1 1 1 16  29 11 f 29.66269 6.705522 12.23392       4.732807 8.000018       6.579147 16.77468       6.813396 24.19010 8.723468 33.85999 8.318312 -9.669884      12.05376 
1 1 1 16  29 12 o 16.84629 6.969629 2.027351       4.664589 9.476090       6.438591 -6.200905      6.767113 25.45391 8.670292 14.64583 6.962119 10.80808       11.11958 
1 1 1 16  29 13 o 35.43550 9.845275 20.40238       8.805513 0.000000       0.000000 20.40238       8.805513 ?        ?        35.43550 9.845275 0.000000       9.845275 
1 1 1 16  29 14 o 16.73853 7.686391 -1.946294      7.149328 0.000000       0.000000 -1.946294      7.149328 ?        ?        16.73853 7.686391 0.000000       7.686391 
1 1 1 16  29 15 o 31.79195 7.127508 14.95092       5.385199 3.980451       7.890153 24.51808       7.368249 20.51817 8.803594 40.33888 7.777486 -19.82071      11.74702 
1 1 1 16  29 16 o 18.34833 7.174126 4.138867       4.649913 10.11843       7.248084 -0.4346009E-01 6.061739 24.81417 9.124673 16.30942 7.324621 8.504751       11.70084 
1 1 1 16  29 17 o 38.28658 6.385838 21.26772       5.748273 24.68475       8.635451 18.54892       7.702825 37.78644 9.413178 32.63416 9.259064 5.152283       13.20372 
1 1 1 16  29 18 o 28.88529 7.426973 13.24506       5.256760 14.30479       8.063543 12.46179       6.932384 27.44923 9.683674 26.39388 8.996507 1.055355       13.21782 
1 1 1 16  29 19 o 46.64815 6.563207 32.79027       7.254802 35.93112       10.27830 29.67189       10.24147 43.86612 9.856157 38.11720 10.62796 5.748924       14.49473 
1 1 1 16  29 20 o 13.53895 6.297845 -1.585838      5.031601 -0.8777071     6.677176 -2.516295      7.653930 15.54417 7.238808 15.63896 7.425593 -0.9478664E-01 10.37014 
1 1 1 16  29 21 o 17.20540 7.277467 3.917503       5.258139 6.067799       7.489014 1.826888       7.384353 19.37196 8.443513 16.99347 7.806497 2.378487       11.49932 
1 1 1 16  29 22 o 19.29618 8.461082 6.633528       7.619490 6.633528       7.619490 0.000000       0.000000 19.29618 8.461082 ?        ?        0.000000       8.461082 
1 1 1 16  29 23 o 17.63835 7.574088 5.022413       5.849012 8.853473       8.151130 0.9558836      8.397892 20.11060 8.786335 16.43763 7.797057 3.672968       11.74708 
1 1 1 16  29 24 o 19.34543 7.954724 7.611122       6.026939 4.199883       7.901285 12.35748       9.320127 17.30481 7.994642 21.23823 9.333788 -3.933424      12.28959 
1 1 1 16  30 0  o 61.88977 2.978695 47.33096       4.479238 48.45266       6.269233 46.16122       6.402054 62.21350 4.159061 60.63768 4.361660 1.575817       6.026762 
1 1 1 16  30 1  o 34.63623 3.995730 15.12545       3.310837 17.09500       4.541795 12.89197       4.836553 36.42815 5.269163 31.08443 6.589745 5.343716       8.437346 
1 1 1 16  30 2  o 48.19472 3.172911 28.83455       3.705705 34.70826       5.313950 23.27408       5.170318 52.55240 4.183952 42.64736 5.074340 9.905041       6.576806 
1 1 1 16  30 3  o 48.25489 3.026887 28.87818       3.541445 31.87704       4.921324 25.65739       5.100181 50.37176 4.043139 44.90193 4.732129 5.469826       6.224148 
1 1 1 16  30 4  o 60.95075 2.819053 45.94616       4.175808 49.90557       5.904591 41.98436       5.906378 63.12771 3.856658 57.72293 4.228245 5.404778       5.722925 
1 1 1 16  30 5  o 45.30353 3.284199 25.60389       3.601131 31.57342       4.764234 17.64751       5.500225 50.09005 3.934625 36.32741 6.449345 13.76264       7.554821 
1 1 1 16  30 6  o 45.02242 2.875738 25.17878       3.138615 23.69459       4.206305 27.04317       4.714359 43.27090 4.035577 46.16467 4.237848 -2.893768      5.851943 
1 1 1 16  30 7  o 27.26237 4.137415 9.556869       2.662490 14.80656       5.998449 8.268845       2.971215 32.40234 7.709185 25.01727 5.047967 7.385067       9.214852 
1 1 1 16  30 8  o 21.85083 4.247402 6.231828       2.180174 10.27402       6.716914 5.755827       2.304969 26.73207 8.853554 20.86828 4.651404 5.863792       10.00105 
1 1 1 16  30 9  o 63.11301 5.244636 52.00820       7.993407 58.59513       11.34226 45.50852       11.26688 65.09490 7.274391 56.13964 8.501450 8.955265       11.18890 
1 1 1 16  30 10 o 42.76077 9.833221 28.62242       10.03244 0.000000       0.000000 28.62242       10.03244 ?        ?        42.76077 9.833221 0.000000       9.833221 
1 1 1 16  30 11 o 23.76499 9.173846 7.753094       7.528471 0.000000       0.000000 7.753094       7.528471 ?        ?        23.76499 9.173846 0.000000       9.173846 
1 1 1 16  30 12 o 11.27959 5.404771 -4.923667      4.252205 -0.2343077     5.931003 -9.883409      6.099594 16.37593 7.307745 12.23360 5.999900 4.142339       9.455260 
1 1 1 16  30 13 o 16.35451 6.741171 2.247488       4.342079 2.870753       5.962827 1.543915       6.335344 18.44088 7.772297 17.81702 7.765871 0.6238575      10.98715 
1 1 1 16  30 14 o 13.31425 5.991090 -0.8203964     4.077527 -1.379246      5.483961 -0.1294501     6.097739 14.90941 6.803172 16.37115 7.349828 -1.461744      10.01514 
1 1 1 16  30 15 o 19.33016 7.925209 4.425029       5.959863 11.34032       7.135322 -11.53245      10.83903 25.83118 9.109591 16.42745 8.044584 9.403730       12.15319 
1 1 1 16  30 16 o 17.66386 7.159451 3.616124       4.796952 -0.7541006     7.166572 7.163415       6.456661 16.71651 7.683393 21.61803 8.453420 -4.901518      11.42343 
1 1 1 16  30 17 o 17.06815 7.001687 3.321589       4.655071 3.637745       6.792715 3.041627       6.392066 18.67525 8.091409 18.03443 7.831246 0.6408253      11.26052 
1 1 1 16  30 18 o 15.64620 6.731473 1.960985       4.636708 1.702642       6.284596 2.269598       6.868882 16.81824 7.512594 17.55667 7.847440 -0.7384338     10.86376 
1 1 1 16  30 19 o 16.59878 7.450767 1.838649       6.263464 0.5691271E-01  7.535898 5.819524       11.26426 16.54526 7.700022 20.40813 9.469145 -3.862877      12.20471 
1 1 1 16  30 20 o 29.38854 10.12881 20.14828       8.793426 20.14828       8.793426 0.000000       0.000000 29.38854 10.12881 ?        ?        0.000000       10.12881 
1 1 1 16  30 21 o 24.00097 8.567054 11.90971       6.327477 7.897272       8.730794 16.34869       9.183142 20.02290 8.905079 25.09322 9.997012 -5.070322      13.38808 
1 1 1 16  30 22 o 14.87641 6.784723 1.139696       5.445501 3.435636       7.503536 -1.415041      7.915142 17.15372 7.876106 15.34174 7.357224 1.811980       10.77784 
1 1 1 16  31 0  f 42.03063 4.158550 22.34800       4.203585 23.11322       7.060947 21.92790       5.231709 41.28423 7.284673 41.14965 5.343301 0.1345749      9.034231 
1 1 1 16  31 1  o 69.48791 2.875485 59.78617       4.858665 68.34888       7.025434 51.93623       6.726679 73.81030 3.919948 64.10710 4.331272 9.703201       5.841738 
1 1 1 16  31 2  o 21.42061 5.432775 6.111473       2.839651 6.315533       3.757687 5.839792       4.335821 21.72137 6.553746 21.22339 7.115333 0.4979839      9.673652 
1 1 1 16  31 3  o 23.60180 4.748544 7.307628       2.636431 5.328939       3.326401 10.65056       4.323639 20.07040 6.188227 27.95890 6.473642 -7.888496      8.955567 
1 1 1 16  31 4  f 49.51556 3.134434 30.58442       3.762723 28.57615       4.959949 33.30713       5.775196 47.35105 4.346908 50.96268 4.703303 -3.611629      6.404425 
1 1 1 16  31 5  o 54.19302 4.127717 37.29659       5.410155 33.69537       6.411737 46.19875       10.08088 50.86756 5.247712 58.02384 7.289957 -7.156281      8.982314 
1 1 1 16  31 6  o 11.94865 4.816656 0.9675946      2.157973 2.436094       3.084485 -0.4403314     3.020200 15.45745 5.896032 12.06750 5.308024 3.389956       7.933367 
1 1 1 16  31 7  o 28.95467 3.881753 10.76623       2.670003 13.12921       3.700022 8.198801       3.856763 31.54651 4.977893 24.26718 6.422584 7.279327       8.125823 
1 1 1 16  31 8  o 53.47930 3.227847 35.95202       4.187051 52.05400       9.852326 32.40284       4.625542 61.51044 6.679987 50.46917 3.788629 11.04127       7.679579 
1 1 1 16  31 9  o 12.74093 4.380408 1.955137       1.644307 4.502037       6.311809 1.769702       1.703114 20.35807 8.226542 12.43668 4.444048 7.921390       9.350163 
1 1 1 16  31 10 o 28.73564 6.653781 11.83948       4.567447 9.424212       6.438122 14.28686       6.480780 24.87708 8.661974 30.32680 8.453862 -5.449715      12.10362 
1 1 1 16  31 11 o 26.61317 8.561294 11.17677       6.303065 0.000000       0.000000 11.17677       6.303065 ?        ?        26.61317 8.561294 0.000000       8.561294 
1 1 1 16  31 12 o 23.74177 6.990930 8.374660       4.316486 14.63509       6.340918 2.968233       5.892577 30.38620 8.320653 18.35040 7.729836 12.03580       11.35710 
1 1 1 16  31 13 o 15.20375 6.481340 1.334892       4.226727 3.648863       6.212545 -0.6592526     5.767251 18.94257 7.955560 15.59148 7.060132 3.351089       10.63656 
1 1 1 16  31 14 o 14.67593 6.382511 0.7974607      4.259197 2.733053       6.542043 -0.6265684     5.611331 18.31328 7.937620 15.29909 6.942164 3.014185       10.54511 
1 1 1 16  31 15 o 23.54426 7.545997 8.914924       4.899950 8.135657       7.028792 9.651692       6.834445 22.29880 8.789761 23.66262 8.830915 -1.363827      12.45973 
1 1 1 16  31 16 o 12.78148 5.926189 -1.809122      4.399922 -3.880832      6.262696 0.2101498      6.182930 14.06989 6.690985 15.99638 7.269827 -1.926494      9.880266 
1 1 1 16  31 17 o 16.46215 7.142161 2.399288       5.306966 5.987905       6.373772 -5.711520      9.582195 19.74145 8.155297 16.11421 7.817493 3.627237       11.29699 
1 1 1 16  31 18 o 16.39418 7.487751 1.179018       6.663499 1.880068       8.096884 -0.2922553     11.72979 17.57677 8.110559 18.38069 8.851026 -0.8039207     12.00508 
1 1 1 16  31 19 o 11.79082 5.664292 -3.929492      4.738294 -3.369604      7.052654 -4.390136      6.397122 14.45835 6.936546 13.48601 6.504673 0.9723387      9.509282 
1 1 1 16  31 20 f 26.68478 8.603711 14.49759       6.363275 20.72601       9.184634 8.748360       8.824241 28.41102 10.29869 20.40948 9.021170 8.001543       13.69104 
1 1 1 16  31 21 o 18.65932 7.744830 6.310663       5.785982 18.62245       8.371448 -4.949691      8.006010 27.15836 9.833948 14.28132 6.976587 12.87704       12.05733 
1 1 1 16  32 0  o 70.87837 3.656647 63.08960       6.294514 60.68050       10.20160 64.57055       7.998583 67.61058 6.262991 71.06729 4.644007 -3.456711      7.796913 
1 1 1 16  32 1  o 29.80206 7.091459 12.41888       5.075141 0.000000       0.000000 12.41888       5.075141 ?        ?        29.80206 7.091459 0.000000       7.091459 
1 1 1 16  32 2  o 13.14593 5.518576 0.6705828      2.987291 0.9627036      4.018147 0.3096013      4.466701 15.11887 6.376634 15.20669 6.574997 -0.8782291E-01 9.159260 
1 1 1 16  32 3  o 9.870872 4.513398 -1.406023      2.429944 -1.626014      3.144328 -1.079827      3.828814 11.29198 5.152114 13.02890 5.838654 -1.736928      7.786794 
1 1 1 16  32 4  o 28.77782 3.994263 10.67284       2.725700 6.106835       3.665714 16.31911       4.076346 21.09208 6.494931 35.27562 4.871925 -14.18354      8.119100 
1 1 1 16  32 5  o 14.40523 5.113819 2.449346       2.251637 3.202789       3.253090 1.756430       3.119688 16.58326 6.110417 14.53566 5.814807 2.047600       8.434998 
1 1 1 16  32 6  o 46.11288 3.350217 26.87377       3.739031 33.34502       4.842960 17.32435       5.883088 51.06168 3.922089 34.76603 7.181853 16.29565       8.183019 
1 1 1 16  32 7  o 24.37004 3.725104 7.693137       2.142097 9.233625       3.042255 6.178449       3.016671 26.21342 4.943752 21.10228 5.722982 5.111134       7.562620 
1 1 1 16  32 8  o 14.61027 5.190986 2.586396       2.320542 7.589914       6.464692 1.846338       2.486239 22.98693 8.586720 13.63431 5.269584 9.352628       10.07473 
1 1 1 16  32 9  o 20.64098 4.409932 5.717944       2.150831 18.98971       7.333832 4.469015       2.249757 34.63149 8.701929 18.08831 4.957445 16.54318       10.01498 
1 1 1 16  32 10 o 48.50992 3.149619 29.82563       3.703143 50.06810       10.40796 26.89166       3.962435 58.16871 7.518095 45.79572 3.579001 12.37299       8.326524 
1 1 1 16  32 11 o 59.75299 5.338787 48.64173       7.692078 51.93431       10.66062 45.06587       11.10976 58.72832 7.629150 52.92587 8.931466 5.802452       11.74628 
1 1 1 16  32 12 o 20.99819 8.070711 6.446285       5.808860 0.000000       0.000000 6.446285       5.808860 ?        ?        20.99819 8.070711 0.000000       8.070711 
1 1 1 16  32 13 o 38.66291 6.007395 21.49774       5.476336 27.25282       8.375642 17.20014       7.237779 40.32174 8.773905 31.32992 9.003336 8.991825       12.57146 
1 1 1 16  32 14 o 12.18044 5.913754 -6.443886      5.511959 -2.352926      6.346253 -19.00703      11.12126 14.90361 6.978693 14.63346 7.329612 0.2701483      10.12054 
1 1 1 16  32 15 o 24.46085 8.737611 11.03426       6.583138 17.66839       8.056808 -2.292030      11.41894 29.76435 9.687930 18.33354 8.803715 11.43081       13.09051 
1 1 1 16  32 16 f 18.50184 7.198111 5.206909       4.662293 12.05404       6.954110 -0.3836586     6.283699 24.72865 8.961675 15.42098 7.126155 9.307671       11.44962 
1 1 1 16  32 17 o 21.41910 7.680298 8.129224       5.091411 4.211474       7.525473 11.43619       6.914011 18.40605 8.221434 23.74237 8.877851 -5.336325      12.09993 
1 1 1 16  32 18 o 17.30320 7.767555 3.230829       6.808828 0.000000       0.000000 3.230829       6.808828 ?        ?        17.30320 7.767555 0.000000       7.767555 
1 1 1 16  32 19 o 13.55063 6.369901 -1.453395      5.376314 6.153098       8.625810 -6.285583      6.875108 19.01144 8.618953 13.11537 6.419337 5.896075       10.74682 
1 1 1 16  33 0  o 33.29066 4.322680 14.36707       3.424080 18.88282       4.820687 9.769099       4.864369 37.64549 5.410047 26.05140 7.346510 11.59409       9.123585 
1 1 1 16  33 1  o 23.79617 6.280900 7.913969       3.694860 14.14250       6.935165 5.445309       4.366111 30.36585 8.839298 20.27344 7.127882 10.09241       11.35517 
1 1 1 16  33 2  o 31.76848 4.185758 13.09428       3.161695 12.05601       4.277133 14.34511       4.694592 29.47940 6.152969 32.19108 6.209488 -2.711679      8.741669 
1 1 1 16  33 3  o 11.94221 5.049401 0.4704374      2.529805 -1.873866      3.355142 3.559412       3.851333 11.44257 5.258547 17.49586 6.608033 -6.053283      8.445023 
1 1 1 16  33 4  o 12.75530 5.092540 1.319193       2.388047 1.779088       3.117787 0.6664318      3.714444 14.46775 5.804368 14.15898 6.056991 0.3087778      8.389149 
1 1 1 16  33 5  o 32.34048 3.464414 13.36687       2.687816 12.45360       3.937947 14.16341       3.677677 30.15015 5.564699 32.65979 4.760856 -2.509640      7.323361 
1 1 1 16  33 6  o 9.529528 4.222249 -0.4357495     1.944338 0.3780518      2.748242 -1.251291      2.751178 12.18989 5.212206 10.62783 4.837557 1.562054       7.111192 
1 1 1 16  33 7  o 34.77214 3.053757 15.32272       2.561375 22.08335       4.000942 10.62762       3.334194 41.23917 4.032703 27.95575 5.081338 13.28342       6.487117 
1 1 1 16  33 8  o 25.73571 5.157450 9.110913       3.121727 12.74761       6.842039 8.154832       3.508158 27.77488 8.918377 23.85872 6.031595 3.916159       10.76650 
1 1 1 16  33 9  o 16.16095 5.160020 3.536750       2.292835 3.937022       6.691767 3.483508       2.440566 19.46201 8.219801 16.11339 5.336767 3.348618       9.800317 
1 1 1 16  33 10 o 21.64536 8.317695 7.075411       6.168927 11.24289       7.694258 -0.4246547     10.32197 25.37954 9.389219 19.31399 8.996334 6.065552       13.00352 
1 1 1 16  33 11 o 18.31283 7.359595 4.210751       5.021462 5.910018       5.973943 0.1195089      9.269530 20.29481 8.070422 18.61580 8.620986 1.679003       11.80903 
1 1 1 16  33 12 o 17.34164 7.295368 3.160798       5.237916 7.647015       6.217299 -7.810079      9.722598 21.66958 8.344213 16.02124 7.795786 5.648342       11.41929 
1 1 1 16  33 13 o 29.50922 8.817697 15.84114       6.826706 0.000000       0.000000 15.84114       6.826706 ?        ?        29.50922 8.817697 0.000000       8.817697 
1 1 1 16  33 14 o 41.50330 6.613567 26.50748       6.464606 32.37593       9.169795 20.70881       9.115117 41.98496 9.215800 30.76107 10.31674 11.22389       13.83352 
1 1 1 16  33 15 f 27.17028 7.574826 12.70864       5.202778 13.99381       7.708717 11.63345       7.050889 25.71052 9.417451 24.05272 8.971017 1.657804       13.00644 
1 1 1 16  33 16 o 15.21659 6.730318 1.606129       4.919442 -1.758091      7.657564 3.970339       6.419356 15.61353 7.417503 17.74629 7.774259 -2.132761      10.74516 
1 1 1 16  33 17 o 21.14599 7.923552 8.425678       5.513430 4.886492       8.370388 11.13796       7.327589 18.58995 8.452475 22.66751 8.962321 -4.077562      12.31940 
1 1 1 16  34 0  o 42.98420 3.567545 23.54481       3.703291 24.76772       5.347843 22.41807       5.133236 43.07639 5.199584 40.91241 5.271081 2.163979       7.404051 
1 1 1 16  34 1  o 35.12073 3.910968 15.92698       3.290500 16.55304       4.760168 15.35407       4.553638 34.68838 5.838346 33.40569 5.804259 1.282692       8.232600 
1 1 1 16  34 2  o 20.22410 6.372383 5.739675       3.506841 17.91918       7.324624 2.117550       3.994406 33.63246 8.827241 15.89806 6.499635 17.73440       10.96200 
1 1 1 16  34 3  o 25.89129 4.687276 8.992388       2.848552 11.61184       4.095119 6.536810       3.964956 28.72056 6.042808 21.33627 6.782516 7.384291       9.083944 
1 1 1 16  34 4  o 45.38658 3.221505 26.14411       3.539896 30.65772       5.096220 21.93601       4.920729 48.38203 4.369475 40.35487 5.118772 8.027157       6.730092 
1 1 1 16  34 5  o 8.775023 4.064926 -1.465854      2.063156 -0.4263559     2.895916 -2.537293      2.940073 11.60068 5.145716 10.01955 4.710170 1.581123       6.975965 
1 1 1 16  34 6  o 8.402621 3.948456 -1.889753      2.062393 1.219237       2.870860 -5.205386      2.964733 13.25388 5.474073 8.565587 4.197236 4.688296       6.897990 
1 1 1 16  34 7  o 19.77459 5.308534 5.508652       2.611549 8.480089       3.088866 -1.939528      4.890359 24.61067 5.306696 13.66535 6.304806 10.94532       8.240849 
1 1 1 16  34 8  o 23.87759 5.170039 7.990027       2.920989 29.93733       7.791790 4.401317       3.150764 44.17160 7.507035 17.74272 6.064739 26.42888       9.650733 
1 1 1 16  34 9  o 11.10685 4.728426 0.4440376      2.244273 0.2874203      6.229608 0.4673961      2.405818 16.31206 7.366722 11.44535 4.884805 4.866714       8.839112 
1 1 1 16  34 10 o 23.42630 4.187644 7.434485       2.302863 15.19223       7.582517 6.646220       2.417030 28.38300 9.406977 21.85927 4.678695 6.523727       10.50626 
1 1 1 16  34 11 o 31.16773 3.553910 12.76607       2.651103 32.40083       7.997996 10.34245       2.809963 44.99055 7.563018 27.54745 4.328427 17.44310       8.714042 
1 1 1 16  34 12 o 33.66720 6.565266 17.47205       5.192809 28.19516       8.178192 10.22834       6.721678 40.04837 8.634305 23.35288 8.749138 16.69548       12.29222 
1 1 1 16  34 13 o 15.75583 6.728869 2.415307       4.570435 9.996638       7.077848 -3.006856      5.985698 22.70682 8.858961 13.85443 6.574917 8.852387       11.03226 
1 1 1 16  34 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 16  34 15 o 12.25107 5.807603 -2.689714      4.645169 -2.245148      7.627687 -2.951779      5.856390 15.30944 7.309375 13.51167 6.438143 1.797769       9.740464 
1 1 1 16  34 16 o 18.21508 7.461599 5.385426       5.277227 12.05795       8.227718 0.7218989      6.878466 22.81815 9.328486 15.90844 7.387587 6.909709       11.89946 
1 1 1 16  35 0  o 13.63003 5.588990 1.370581       2.964551 3.204716       3.970872 -0.9390349     4.455948 16.92916 6.626586 13.83003 6.239512 3.099129       9.101822 
1 1 1 16  35 1  o 15.77746 5.795850 3.046115       2.923112 2.151400       3.755555 4.421206       4.655834 15.51519 6.317701 18.73584 7.219132 -3.220654      9.593185 
1 1 1 16  35 2  o 37.87875 4.008957 18.73721       3.644428 22.06651       4.914743 14.67027       5.431983 40.33390 5.115158 31.17084 7.283039 9.163057       8.899859 
1 1 1 16  35 3  o 20.29880 6.729020 6.001278       3.879813 12.08864       7.447481 3.733814       4.545325 26.49320 9.309748 17.79502 7.051427 8.698183       11.67879 
1 1 1 16  35 4  o 10.10971 4.532733 -0.6403604     2.310736 -2.834259      3.372605 1.300715       3.172330 10.63921 5.014850 13.72519 5.718894 -3.085979      7.606212 
1 1 1 16  35 5  o 8.029385 3.799208 -2.008120      1.970223 -4.586587      2.633500 1.269719       2.969247 8.090558 3.962668 13.35746 5.546510 -5.266903      6.816635 
1 1 1 16  35 6  o 20.21770 4.768092 5.689300       2.310754 11.21637       3.396778 0.9281192      3.152659 28.38844 5.097415 13.20826 5.612960 15.18018       7.582148 
1 1 1 16  35 7  o 14.68978 4.890780 2.896255       2.049048 4.062592       2.875050 1.692271       2.921082 17.01409 5.793798 13.69382 5.573372 3.320268       8.039314 
1 1 1 16  35 8  o 36.28220 6.388811 19.65882       5.442478 0.000000       0.000000 19.65882       5.442478 ?        ?        36.28220 6.388811 0.000000       6.388811 
1 1 1 16  35 9  o 9.495351 4.390751 -1.376233      2.391246 -3.438931      6.561972 -1.060373      2.567812 14.47713 6.874402 10.14216 4.638286 4.334971       8.292833 
1 1 1 16  35 10 o 25.77312 4.513991 9.211134       2.731813 0.000000       0.000000 9.211134       2.731813 ?        ?        25.77312 4.513991 0.000000       4.513991 
1 1 1 16  35 11 o 16.79830 6.935866 3.529875       4.606957 1.616973       6.448775 5.523700       6.583765 16.62564 7.502977 19.22851 8.138729 -2.602875      11.06949 
1 1 1 16  35 12 o 24.77752 7.560858 10.72635       4.981922 10.40417       7.354884 10.99949       6.772140 22.70653 8.978604 23.52116 8.788079 -0.8146305     12.56366 
1 1 1 16  35 13 o 23.54190 7.920070 10.24105       5.371697 17.52708       8.663809 5.691046       6.846507 27.30131 9.986436 18.98554 8.174080 8.315767       12.90521 
1 1 1 16  36 0  o 21.54417 6.116632 6.798412       3.360438 7.689564       3.988515 4.618167       6.238611 22.57989 6.738210 19.49572 8.062465 3.084166       10.50746 
1 1 1 16  36 1  o 22.24909 5.677708 7.133711       3.088148 10.71683       4.393501 3.634799       4.341565 26.60135 6.763544 17.37981 6.890073 9.221540       9.654980 
1 1 1 16  36 2  o 17.46843 5.798791 4.293240       2.881000 6.349255       4.107708 2.302680       4.041791 20.52361 6.925908 15.70749 6.492062 4.816125       9.492896 
1 1 1 16  36 3  o 33.37894 4.102415 14.82220       3.266836 17.59843       4.693604 12.21353       4.549761 35.16159 5.670604 28.35472 6.692861 6.806879       8.772122 
1 1 1 16  36 4  o 20.74794 5.273748 6.174729       2.671711 12.93720       4.167738 1.457104       3.481044 29.74739 5.957209 14.12103 5.944321 15.62635       8.415657 
1 1 1 16  36 5  o 19.38369 5.097091 5.375574       2.439205 6.101412       3.500093 4.690193       3.401147 20.05730 6.372122 17.97137 6.293195 2.085932       8.955906 
1 1 1 16  36 6  o 7.212872 3.525339 -3.471857      2.051749 -0.6203430     2.859460 -6.497929      2.945683 11.10806 5.006072 7.875748 3.917537 3.232313       6.356717 
1 1 1 16  36 7  o 11.28004 4.730035 0.7504864      2.190831 4.573917       3.268070 -2.370228      2.952513 17.65112 6.169718 9.937488 4.686553 7.713637       7.747851 
1 1 1 16  36 8  f 13.34444 5.386864 1.780923       2.703313 8.638522       7.281272 0.6845384      2.911405 21.80112 8.826353 12.36550 5.327172 9.435623       10.30938 
1 1 1 16  36 9  o 11.17043 4.818469 0.4188441      2.387822 1.036977       7.545468 0.3500517      2.517189 17.01696 7.844088 11.32457 4.915993 5.692396       9.257252 
1 1 1 16  36 10 o 21.02039 5.729742 6.737548       3.014798 8.287230       8.317421 6.503150       3.234775 21.03801 9.032931 20.42207 6.061852 0.6159363      10.87841 
1 1 1 16  36 11 o 17.04814 7.134749 3.849199       4.969812 -2.417394      7.468478 8.829352       6.657907 15.24758 7.266731 21.45743 8.524074 -6.209850      11.20113 
1 1 1 16  37 0  o 23.55440 5.587574 8.065697       3.158526 10.78803       4.594240 5.625723       4.349465 26.14004 7.051287 19.38115 7.077912 6.758892       9.990870 
1 1 1 16  37 1  o 14.06862 5.885407 1.572033       3.379633 1.021469       4.089064 2.758873       6.003661 14.40621 6.259585 17.48728 7.591651 -3.081071      9.839491 
1 1 1 16  37 2  o 16.47989 5.741742 3.802839       2.829105 3.878542       3.975797 3.725188       4.026603 17.09765 6.648410 16.95244 6.661811 0.1452141      9.411753 
1 1 1 16  37 3  o 9.869345 4.595845 -1.733459      2.690919 -1.901167      3.717423 -1.548853      3.900223 11.64469 5.415541 12.16210 5.618093 -0.5174046     7.803272 
1 1 1 16  37 4  o 9.484476 4.529528 -3.036270      2.933356 -2.793583      6.167476 -3.107219      3.334676 14.31898 6.759142 10.22119 4.866865 4.097793       8.329008 
1 1 1 16  37 5  o 16.78212 5.439373 4.074898       2.541286 3.504578       3.766320 4.551563       3.443217 16.38082 6.441170 17.58489 6.314711 -1.204071      9.020213 
1 1 1 16  37 6  o 9.379514 4.307808 -1.078739      2.246860 -3.935920      3.117993 2.007630       3.240636 9.311553 4.503447 14.18790 5.833384 -4.876344      7.369491 
1 1 1 16  37 7  o 12.58843 4.989898 1.658795       2.276811 0.5868972      3.358915 2.569942       3.096823 12.85229 5.627117 14.67363 5.818531 -1.821342      8.094427 
1 1 1 16  38 0  f 13.21931 5.569420 1.254162       3.059898 -1.270953      4.287770 3.874710       4.368044 12.86199 5.923145 17.17705 6.877470 -4.315058      9.076521 
1 1 1 16  38 1  o 10.19280 4.724129 -1.533024      2.791966 -1.261905      4.131618 -1.760878      3.787640 12.62691 5.814671 11.79303 5.478367 0.8338871      7.988924 
1 1 1 16  38 2  o 10.81431 5.046757 -1.913560      3.272964 -1.929847      3.952398 -1.878020      5.838462 11.92107 5.557485 14.31956 6.701477 -2.398498      8.706058 
1 1 1 16  38 3  o 14.18631 5.521261 2.397403       2.743905 7.306926       4.232637 -1.161535      3.603725 21.13294 7.029044 11.86494 5.451629 9.268000       8.895376 
1 1 1 17  0  0  o 143.8758 3.438672 252.8184       12.04076 252.8184       12.04076 252.8184       12.04076 143.8758 3.438672 143.8758 3.438672 0.000000       0.000000 
1 1 1 17  0  1  o 181.4803 3.870563 402.1869       17.09990 402.1869       17.09990 402.1869       17.09990 181.4803 3.870563 181.4803 3.870563 0.000000       0.000000 
1 1 1 17  0  2  o 86.10909 3.172493 90.76604       6.636577 90.76604       6.636577 90.76604       6.636577 86.10909 3.172493 86.10909 3.172493 0.000000       0.000000 
1 1 1 17  0  3  o 117.6336 3.324878 169.1236       9.513886 169.1236       9.513886 169.1236       9.513886 117.6336 3.324878 117.6336 3.324878 0.000000       0.000000 
1 1 1 17  0  4  o 341.7944 6.109780 1428.264       50.85265 1428.264       50.85265 1428.264       50.85265 341.7944 6.109780 341.7944 6.109780 0.000000       0.000000 
1 1 1 17  0  5  o 148.6695 6.288105 271.4790       22.68834 271.4790       22.68834 271.4790       22.68834 148.6695 6.288105 148.6695 6.288105 0.000000       0.000000 
1 1 1 17  0  6  o 81.89240 5.730539 83.09785       11.30510 83.09785       11.30510 83.09785       11.30510 81.89240 5.730539 81.89240 5.730539 0.000000       0.000000 
1 1 1 17  0  7  o 10.84349 7.220522 -1.595429      5.147462 -1.595429      5.147462 -1.595429      5.147462 10.84349 7.220522 10.84349 7.220522 0.000000       0.000000 
1 1 1 17  0  8  o 101.2526 5.812104 126.4864       14.23188 126.4864       14.23188 126.4864       14.23188 101.2526 5.812104 101.2526 5.812104 0.000000       0.000000 
1 1 1 17  0  9  o 76.90000 6.054986 73.60770       11.18041 73.60770       11.18041 73.60770       11.18041 76.90000 6.054986 76.90000 6.054986 0.000000       0.000000 
1 1 1 17  0  10 o 143.4184 6.305962 252.9848       21.94181 252.9848       21.94181 252.9848       21.94181 143.4184 6.305962 143.4184 6.305962 0.000000       0.000000 
1 1 1 17  0  11 f 184.4324 7.073616 418.3168       31.68540 418.3168       31.68540 418.3168       31.68540 184.4324 7.073616 184.4324 7.073616 0.000000       0.000000 
1 1 1 17  0  12 o 77.01431 3.931180 72.94891       7.333757 72.94891       7.333757 72.94891       7.333757 77.01431 3.931180 77.01431 3.931180 0.000000       0.000000 
1 1 1 17  0  13 f 11.00697 6.834153 0.9916763      3.671588 0.9916763      3.671588 0.9916763      3.671588 11.00697 6.834153 11.00697 6.834153 0.000000       0.000000 
1 1 1 17  0  14 o 71.84949 4.577298 63.82152       7.938843 63.82152       7.938843 63.82152       7.938843 71.84949 4.577298 71.84949 4.577298 0.000000       0.000000 
1 1 1 17  0  15 o 192.2890 5.181337 453.1117       24.23924 453.1117       24.23924 453.1117       24.23924 192.2890 5.181337 192.2890 5.181337 0.000000       0.000000 
1 1 1 17  0  16 o 182.4344 5.074190 407.9984       22.51900 407.9984       22.51900 407.9984       22.51900 182.4344 5.074190 182.4344 5.074190 0.000000       0.000000 
1 1 1 17  0  17 o 214.7876 5.582381 566.1223       29.17435 566.1223       29.17435 566.1223       29.17435 214.7876 5.582381 214.7876 5.582381 0.000000       0.000000 
1 1 1 17  0  18 o 218.2994 5.678390 585.1804       30.16124 585.1804       30.16124 585.1804       30.16124 218.2994 5.678390 218.2994 5.678390 0.000000       0.000000 
1 1 1 17  0  19 o 250.3317 4.958543 768.3026       30.22188 768.3026       30.22188 768.3026       30.22188 250.3317 4.958543 250.3317 4.958543 0.000000       0.000000 
1 1 1 17  0  20 f 100.2103 3.701264 123.2542       9.010525 123.2542       9.010525 123.2542       9.010525 100.2103 3.701264 100.2103 3.701264 0.000000       0.000000 
1 1 1 17  0  21 o 42.40018 5.193470 23.02369       5.150988 23.02369       5.150988 23.02369       5.150988 42.40018 5.193470 42.40018 5.193470 0.000000       0.000000 
1 1 1 17  0  22 o 47.48974 4.846628 28.53184       5.463865 28.53184       5.463865 28.53184       5.463865 47.48974 4.846628 47.48974 4.846628 0.000000       0.000000 
1 1 1 17  0  23 o 76.84369 4.451638 73.24055       8.271558 73.24055       8.271558 73.24055       8.271558 76.84369 4.451638 76.84369 4.451638 0.000000       0.000000 
1 1 1 17  0  24 o 32.90901 8.121010 15.69902       5.637899 15.69902       5.637899 15.69902       5.637899 32.90901 8.121010 32.90901 8.121010 0.000000       0.000000 
1 1 1 17  0  25 o 104.4164 4.506205 135.2233       11.41740 135.2233       11.41740 135.2233       11.41740 104.4164 4.506205 104.4164 4.506205 0.000000       0.000000 
1 1 1 17  0  26 o 137.2243 6.461432 238.2255       21.49753 238.2255       21.49753 238.2255       21.49753 137.2243 6.461432 137.2243 6.461432 0.000000       0.000000 
1 1 1 17  0  27 o 57.67078 5.406111 42.66059       7.435285 42.66059       7.435285 42.66059       7.435285 57.67078 5.406111 57.67078 5.406111 0.000000       0.000000 
1 1 1 17  0  28 o 33.51800 7.915632 16.53347       5.614707 16.53347       5.614707 16.53347       5.614707 33.51800 7.915632 33.51800 7.915632 0.000000       0.000000 
1 1 1 17  0  29 o 8.612908 5.954833 -2.907768      4.244550 -2.907768      4.244550 -2.907768      4.244550 8.612908 5.954833 8.612908 5.954833 0.000000       0.000000 
1 1 1 17  0  30 o 40.91560 6.431134 23.18787       5.939408 23.18787       5.939408 23.18787       5.939408 40.91560 6.431134 40.91560 6.431134 0.000000       0.000000 
1 1 1 17  0  31 o 11.15033 7.192489 0.8882031      4.535476 0.8882031      4.535476 0.8882031      4.535476 11.15033 7.192489 11.15033 7.192489 0.000000       0.000000 
1 1 1 17  0  32 o 22.10918 9.451106 9.988494       5.193228 9.988494       5.193228 9.988494       5.193228 22.10918 9.451106 22.10918 9.451106 0.000000       0.000000 
1 1 1 17  0  33 o 11.75489 7.466733 1.916130       4.660527 1.916130       4.660527 1.916130       4.660527 11.75489 7.466733 11.75489 7.466733 0.000000       0.000000 
1 1 1 17  0  34 o 14.08177 8.364475 4.577846       5.001447 4.577846       5.001447 4.577846       5.001447 14.08177 8.364475 14.08177 8.364475 0.000000       0.000000 
1 1 1 17  0  35 o 11.04860 7.514594 0.4084002E-01  6.158939 0.4084002E-01  6.158939 0.4084002E-01  6.158939 11.04860 7.514594 11.04860 7.514594 0.000000       0.000000 
1 1 1 17  0  36 o 13.46745 8.205128 4.694005       5.064126 4.694005       5.064126 4.694005       5.064126 13.46745 8.205128 13.46745 8.205128 0.000000       0.000000 
1 1 1 17  0  37 o 7.519467 5.377832 -4.562640      4.510930 -4.562640      4.510930 -4.562640      4.510930 7.519467 5.377832 7.519467 5.377832 0.000000       0.000000 
1 1 1 17  1  0  o 439.3464 5.342392 2359.377       57.19775 2361.512       80.89738 2357.242       80.88230 438.8477 7.564575 438.4488 7.570046 0.3988953      10.70179 
1 1 1 17  1  1  o 110.5921 2.265453 149.1112       6.105418 141.7734       8.417483 157.2572       8.868924 107.7572 3.209106 113.4940 3.209952 -5.736763      4.538960 
1 1 1 17  1  2  o 355.8015 4.891430 1546.881       42.41112 1533.496       66.99796 1555.831       54.78520 353.4925 7.777593 356.4943 6.306299 -3.001801      10.01301 
1 1 1 17  1  3  o 182.1763 3.063091 404.8528       13.59840 392.6167       21.56531 412.9296       17.52069 179.1668 4.943989 183.9170 3.909248 -4.750229      6.302796 
1 1 1 17  1  4  o 151.6298 3.134255 280.5010       11.58124 246.2650       21.83224 293.9072       13.66184 141.6543 6.340660 155.1782 3.612788 -13.52388      7.297685 
1 1 1 17  1  5  o 164.4240 3.156298 329.8633       12.64676 318.0852       17.43938 342.9277       18.36711 161.2928 4.441131 167.4692 4.504685 -6.176437      6.325807 
1 1 1 17  1  6  o 221.2688 3.770700 597.7833       20.33191 591.2150       28.43216 604.6574       29.08634 219.8273 5.307525 222.3018 5.369205 -2.474457      7.549715 
1 1 1 17  1  7  o 164.7120 3.187802 331.0793       12.79537 341.2960       18.17682 321.0437       18.01503 167.0497 4.469165 162.0002 4.567907 5.049469       6.390556 
1 1 1 17  1  8  o 105.8782 2.805620 136.8618       7.232500 142.7414       10.18203 130.8740       10.27520 108.0344 3.873826 103.4178 4.085209 4.616570       5.629872 
1 1 1 17  1  9  o 145.9483 3.077793 259.9671       10.94648 257.9703       15.28345 262.0704       15.68572 145.2070 4.323962 146.3463 4.403327 -1.139282      6.171380 
1 1 1 17  1  10 o 156.7495 3.187263 299.9408       12.17475 301.3683       17.06259 298.4602       17.37711 156.9171 4.466637 156.1409 4.571859 0.7762299      6.391614 
1 1 1 17  1  11 o 159.1293 3.258225 309.1842       12.63477 290.2790       17.11673 331.8171       18.72835 153.9651 4.567121 164.6030 4.673752 -10.63783      6.534719 
1 1 1 17  1  12 o 140.7659 3.127342 241.9373       10.72776 238.2348       14.93582 245.8829       15.41837 139.4746 4.399886 141.6862 4.471145 -2.211609      6.272968 
1 1 1 17  1  13 o 75.05045 2.387855 68.78812       4.361585 65.94868       6.109545 71.73930       6.228602 73.39268 3.425467 76.56176 3.346516 -3.169083      4.788840 
1 1 1 17  1  14 o 168.1032 2.718539 344.9419       11.13647 319.6736       15.28715 373.5152       16.25618 161.6771 3.880091 174.7733 3.816869 -13.09621      5.442756 
1 1 1 17  1  15 o 169.5118 2.983972 350.9457       12.32625 363.6887       19.60872 342.6207       15.84920 172.2016 4.677119 167.3507 3.886365 4.850861       6.081059 
1 1 1 17  1  16 o 48.95868 3.177580 29.41463       3.770594 26.83397       5.594399 31.56278       5.104113 46.49296 5.017115 50.59671 4.176805 -4.103748      6.528181 
1 1 1 17  1  17 o 24.06719 6.342585 7.407905       3.771549 6.334121       4.769517 9.199860       6.161404 22.94396 7.452938 27.18207 8.429110 -4.238108      11.25150 
1 1 1 17  1  18 o 143.1322 2.678573 250.2664       9.342798 268.5770       13.53135 233.5843       12.91557 148.0452 3.753714 138.0386 3.843261 10.00655       5.372245 
1 1 1 17  1  19 o 179.1918 3.233239 392.9276       14.11861 396.4974       18.03655 387.2794       22.68775 179.7640 4.117320 177.1983 5.259891 2.565720       6.679729 
1 1 1 17  1  20 o 175.3046 3.222154 376.3047       13.76499 374.4698       17.42691 379.3486       22.44505 174.6119 4.095534 175.2176 5.262584 -0.6057434     6.668447 
1 1 1 17  1  21 o 145.0132 2.740842 257.3000       9.685628 261.3571       13.71153 253.2594       13.68361 145.8023 3.862497 143.5061 3.916519 2.296143       5.500728 
1 1 1 17  1  22 o 162.2156 3.070358 322.6430       12.13717 325.3602       15.96880 318.9261       18.67666 162.5286 4.031868 160.4958 4.780612 2.032761       6.253816 
1 1 1 17  1  23 o 22.17807 6.097021 6.370567       3.396990 5.208951       4.483891 7.935469       5.204356 21.02395 7.233334 24.89074 7.751418 -3.866783      10.60215 
1 1 1 17  1  24 o 50.75449 4.080738 32.10686       5.004681 33.62892       6.437219 29.78103       7.957425 51.60344 5.189363 47.83213 7.036917 3.771305       8.743437 
1 1 1 17  1  25 o 30.20507 5.579007 11.86683       3.955272 12.56948       5.611278 11.17296       5.576088 30.48903 7.583727 28.72908 7.776298 1.759954       10.86203 
1 1 1 17  1  26 f 76.87277 3.266155 73.30951       6.104563 65.71983       8.545900 81.21726       8.723139 71.97569 4.901568 80.30236 4.475379 -8.326668      6.637348 
1 1 1 17  1  27 o 11.98542 5.435925 -1.609310      3.435463 -2.546932      4.670719 -0.5041503     5.070868 13.59998 6.233110 15.60785 6.871136 -2.007874      9.277078 
1 1 1 17  1  28 o 24.57934 6.715609 8.425062       4.135856 4.186651       6.405525 11.45528       5.416142 20.57170 8.296458 28.23742 7.672716 -7.665730      11.30052 
1 1 1 17  1  29 o 13.64993 5.787709 0.7195569      3.339299 -1.949702      4.728477 3.375322       4.716510 13.76337 6.294278 18.05037 7.173203 -4.287000      9.543205 
1 1 1 17  1  30 o 14.11858 5.781137 1.552811       3.166243 5.602084       4.497334 -2.426671      4.458408 20.03334 7.213991 12.86030 5.963673 7.173043       9.359864 
1 1 1 17  1  31 o 16.35918 6.212516 3.373371       3.415088 3.742851       4.816654 2.999873       4.842778 17.73514 7.179294 17.06471 7.084454 0.6704235      10.08622 
1 1 1 17  1  32 o 12.90208 5.590603 0.6720973      3.243366 3.466038       4.616993 -2.049962      4.557214 16.95995 6.966862 12.78759 5.963490 4.172355       9.170626 
1 1 1 17  1  33 o 18.09776 6.621940 5.107765       3.809858 12.41113       6.810069 1.780654       4.596461 24.75222 8.881644 15.12681 6.603662 9.625404       11.06761 
1 1 1 17  1  34 o 9.968963 4.753250 -2.662411      3.203185 -4.645837      4.275798 -0.1255640     4.835667 10.68229 5.191497 13.65227 6.288212 -2.969980      8.154340 
1 1 1 17  1  35 o 14.90532 5.993208 3.289639       3.331771 4.796599       4.560915 1.565291       4.878805 16.70133 6.898988 14.30040 6.482721 2.400931       9.466875 
1 1 1 17  1  36 o 9.177459 4.514779 -4.779215      3.538578 -5.455712      4.162375 -3.015878      6.720104 9.808934 4.839057 13.08201 6.390944 -3.273075      8.016273 
1 1 1 17  1  37 o 10.64128 4.993908 -0.8642699     3.280554 -1.581295      4.868265 -0.2678358     4.440054 11.91470 5.728362 12.18948 5.748153 -0.2747784     8.115133 
1 1 1 17  2  0  o 116.2796 2.553653 164.8657       7.236048 163.3939       11.69847 165.7777       9.209119 115.6153 4.158968 116.5295 3.246156 -0.9141769     5.275845 
1 1 1 17  2  1  o 55.51336 2.781759 37.67685       3.751172 38.96361       6.253753 36.95369       4.688206 56.29441 4.598720 54.91977 3.521571 1.374649       5.792210 
1 1 1 17  2  2  o 145.1971 2.475245 257.0642       8.758149 257.2675       12.31293 256.8560       12.46017 145.2024 3.479778 145.0835 3.524273 0.1188965      4.952713 
1 1 1 17  2  3  o 192.3179 2.848230 451.1163       13.34845 456.9316       18.92457 445.3585       18.83091 193.4563 4.014274 190.9876 4.046039 2.468704       5.699546 
1 1 1 17  2  4  o 195.0931 3.121772 464.3547       14.84155 471.4622       23.11558 459.3697       19.35881 196.4043 4.829672 193.9530 4.095870 2.451294       6.332605 
1 1 1 17  2  5  o 248.6465 4.086840 755.0542       24.76316 779.5483       35.36138 731.4826       34.68910 252.3613 5.750033 244.4431 5.823436 7.918213       8.183843 
1 1 1 17  2  6  o 65.84425 2.802327 52.98143       4.486199 48.11396       5.864892 59.84588       6.964848 62.65315 3.860066 69.87717 4.108284 -7.224026      5.637208 
1 1 1 17  2  7  o 131.1821 2.910728 209.9532       9.304914 213.9005       12.93142 205.7151       13.39931 132.2711 4.016510 129.6871 4.245564 2.583954       5.844413 
1 1 1 17  2  8  o 76.75208 2.826973 71.96905       5.278437 70.41255       7.053804 73.94978       7.957261 75.83120 3.829547 77.67731 4.219559 -1.846115      5.698255 
1 1 1 17  2  9  o 207.1528 3.662788 524.0893       18.49008 509.2276       25.44481 540.7179       26.91490 203.9028 5.124888 210.0874 5.261365 -6.184662      7.344825 
1 1 1 17  2  10 o 226.6132 3.471757 627.1226       19.17214 648.0942       24.95634 596.9224       29.94818 230.2053 4.448662 220.6298 5.574658 9.575546       7.132139 
1 1 1 17  2  11 o 214.1905 3.356184 560.2475       17.51790 553.0807       22.15125 572.2133       28.62243 212.6681 4.274248 216.0050 5.441926 -3.336823      6.919809 
1 1 1 17  2  12 f 118.7072 2.632043 171.9503       7.613883 162.7680       9.370664 189.7903       13.06143 115.3946 3.335836 124.4846 4.312162 -9.090012      5.451839 
1 1 1 17  2  13 o 85.86676 2.656478 90.06796       5.551940 97.31278       6.965435 77.44651       9.193677 89.20556 3.209435 79.37754 4.774942 9.828018       5.753307 
1 1 1 17  2  14 o 29.71730 3.844383 10.97762       2.718847 13.30094       3.926816 8.838258       3.768151 32.54897 5.119578 26.29907 6.011177 6.249895       7.895843 
1 1 1 17  2  15 o 169.9782 2.738724 352.7518       11.34430 351.3451       15.92194 354.2022       16.16741 169.4713 3.855348 170.1512 3.899143 -0.6799011     5.483341 
1 1 1 17  2  16 o 97.69983 2.792617 116.6678       6.641949 118.5970       8.303810 113.2412       11.06666 98.42226 3.467585 95.96918 4.746773 2.453079       5.878435 
1 1 1 17  2  17 o 65.40347 2.678968 52.33120       4.260732 52.79126       6.075794 51.88604       5.976600 65.55528 3.819836 64.99305 3.790004 0.5622330      5.381011 
1 1 1 17  2  18 o 157.9662 2.748265 304.8763       10.57935 296.0779       14.82043 314.0179       15.10658 155.4027 3.916630 160.1014 3.871995 -4.698746      5.507480 
1 1 1 17  2  19 o 134.3786 2.853537 220.7699       9.344364 226.1292       14.57275 217.0276       12.17736 135.6100 4.415634 133.0168 3.760507 2.593155       5.799934 
1 1 1 17  2  20 f 129.0680 2.853671 203.7720       8.975499 205.8086       13.91602 202.3212       11.74492 129.2839 4.423586 128.3697 3.758541 0.9142303      5.804718 
1 1 1 17  2  21 o 14.44291 5.809394 1.235292       3.131752 1.117376       4.096424 1.401151       4.858343 15.95862 6.559680 17.40993 7.148620 -1.451307      9.702173 
1 1 1 17  2  22 o 55.70266 4.359605 38.51665       5.870672 38.51665       5.870672 0.000000       0.000000 55.70266 4.359605 ?        ?        0.000000       4.359605 
1 1 1 17  2  23 o 25.81280 6.039132 8.682930       3.730912 15.58704       5.800824 3.811980       4.872399 34.46889 7.140994 19.73002 7.436808 14.73887       10.31018 
1 1 1 17  2  24 o 13.00930 5.657798 -0.4023238     3.347001 2.933376       4.914725 -3.287406      4.570722 18.75459 7.362946 13.20922 6.094688 5.545376       9.558148 
1 1 1 17  2  25 o 47.58541 3.898737 28.28842       4.481389 35.52193       6.634172 22.21767       6.077620 52.87582 5.216531 41.32351 6.228673 11.55231       8.124566 
1 1 1 17  2  26 o 15.57746 6.397881 1.381365       3.892810 -3.120547      5.114846 7.579030       6.001338 14.09475 6.482987 24.21980 8.366759 -10.12505      10.58451 
1 1 1 17  2  27 o 42.59605 4.209678 23.06019       4.312652 23.22964       6.025149 22.88216       6.175657 41.85411 6.085515 41.40762 6.320158 0.4464836      8.773705 
1 1 1 17  2  28 o 15.18684 6.078104 1.891406       3.410213 2.625453       4.910226 1.207423       4.739826 17.78364 7.230422 16.30553 6.903748 1.478107       9.997036 
1 1 1 17  2  29 o 10.31895 4.875667 -3.140117      3.223498 -8.369814      4.555537 2.104196       4.561899 10.41106 5.121831 16.64467 6.889933 -6.233616      8.585123 
1 1 1 17  2  30 o 17.95086 6.531775 4.230591       3.699306 2.920095       6.242266 4.939975       4.592669 18.55359 7.891819 19.27370 7.229695 -0.7201118     10.70277 
1 1 1 17  2  31 o 19.77439 6.356443 5.783857       3.475029 4.958839       5.010919 6.548255       4.823316 19.01651 7.443883 20.70361 7.468848 -1.687099      10.54491 
1 1 1 17  2  32 o 17.27485 6.535007 4.187617       3.770167 3.534431       6.452605 4.526196       4.645649 18.08386 7.860338 18.00457 7.130616 0.7929611E-01  10.61276 
1 1 1 17  2  33 f 16.76776 6.153133 4.157094       3.293218 3.887012       4.856540 4.386998       4.480751 17.05085 7.087946 17.37626 6.962773 -0.3254147     9.935753 
1 1 1 17  2  34 o 11.86418 5.310951 0.1358101      3.158719 1.040407       4.355107 -0.8682142     4.588210 13.94723 6.240317 12.94575 6.019212 1.001487       8.670206 
1 1 1 17  2  35 o 10.99945 5.124066 -1.050189      3.350116 -1.252620      4.739836 -0.8481088     4.735726 12.53789 5.920524 12.74524 5.987238 -0.2073441     8.420192 
1 1 1 17  2  36 o 19.62171 6.585581 7.380773       3.714140 3.773559       5.165072 11.24326       5.344707 15.40867 6.851347 22.06337 7.873880 -6.654700      10.43738 
1 1 1 17  2  37 o 13.52234 6.191704 1.853153       4.594402 1.853153       4.594402 0.000000       0.000000 13.52234 6.191704 ?        ?        0.000000       6.191704 
1 1 1 17  3  0  o 109.3551 2.240755 145.7912       5.971308 146.7045       8.389458 144.8535       8.501058 109.6219 3.143758 108.9234 3.206186 0.6985703      4.490306 
1 1 1 17  3  1  o 157.8983 2.796801 304.0594       10.76156 312.1234       17.07211 298.7423       13.86256 159.8118 4.387866 156.4623 3.635780 3.349579       5.698444 
1 1 1 17  3  2  o 89.44257 2.242490 97.59626       4.883917 99.79800       6.801170 95.25208       7.017723 90.39658 3.091971 88.29903 3.267034 2.097542       4.498199 
1 1 1 17  3  3  o 90.21945 2.273101 99.30425       4.993546 100.4576       6.868820 98.01143       7.272321 90.69125 3.112611 89.56261 3.337880 1.128632       4.563966 
1 1 1 17  3  4  o 161.8619 2.823427 319.5655       11.13672 328.4102       17.19712 313.1770       14.61537 163.9140 4.309038 160.1709 3.744467 3.743134       5.708664 
1 1 1 17  3  5  o 250.2633 4.106544 764.9445       25.04436 751.5874       34.64848 779.5578       36.24132 247.7895 5.738062 252.3261 5.893940 -4.536606      8.225805 
1 1 1 17  3  6  o 131.0868 2.890613 209.6336       9.233896 211.9128       12.67711 207.0577       13.47696 131.6676 3.955468 130.1161 4.256078 1.551468       5.810329 
1 1 1 17  3  7  o 203.2171 3.592439 504.1982       17.79040 501.2459       24.58061 507.4459       25.78114 202.4332 4.982817 203.5806 5.200982 -1.147461      7.202685 
1 1 1 17  3  8  o 119.5957 2.867159 174.5148       8.356097 167.4557       11.11177 183.7025       12.67691 117.0192 3.902096 122.5300 4.252005 -5.510765      5.771126 
1 1 1 17  3  9  o 232.7076 3.948622 661.6398       22.39197 648.5184       30.85486 676.2397       32.54691 230.0911 5.502848 234.9152 5.685419 -4.824081      7.912353 
1 1 1 17  3  10 o 205.0535 3.251431 513.3398       16.24718 527.2489       20.89726 492.0829       25.83389 207.6865 4.129001 200.3654 5.295561 7.321091       6.715030 
1 1 1 17  3  11 o 139.5359 2.715578 237.5872       9.233880 232.8672       11.48553 246.2136       15.52732 138.0835 3.413289 141.7924 4.499429 -3.708984      5.647602 
1 1 1 17  3  12 o 65.25244 2.767086 52.05867       4.390040 51.72001       5.253001 52.84300       7.994169 64.98955 3.327947 65.48424 5.048520 -0.4946899     6.046717 
1 1 1 17  3  13 o 167.7041 2.993149 343.3934       12.23230 351.4422       15.50638 330.1326       19.90354 169.5578 3.752810 164.0594 4.984220 5.498489       6.239073 
1 1 1 17  3  14 o 60.06124 2.970826 44.15782       4.334687 41.46684       5.229553 50.06551       7.748508 58.12000 3.711748 63.70475 5.032099 -5.584755      6.252927 
1 1 1 17  3  15 o 83.58636 2.800879 85.40628       5.697075 90.94235       7.050490 74.99156       9.670348 86.19534 3.363052 78.00983 5.115160 8.185509       6.121681 
1 1 1 17  3  16 o 87.13109 2.442527 92.74074       5.181075 102.2000       7.433397 83.80358       7.225325 91.37040 3.344098 82.69543 3.594000 8.674973       4.909157 
1 1 1 17  3  17 o 50.73780 2.917539 31.55888       3.592107 26.72900       5.026166 36.60140       5.135614 46.46812 4.494641 54.53417 3.889992 -8.066051      5.944227 
1 1 1 17  3  18 o 50.21219 3.259834 30.96854       3.967227 34.16581       5.388663 27.18463       5.862215 52.61263 4.238807 46.71560 5.239680 5.897026       6.739564 
1 1 1 17  3  19 o 83.02853 2.820768 84.37634       5.699014 84.18699       7.467914 84.64038       8.818712 82.79935 3.710574 82.89622 4.381058 -0.9687805E-01 5.741257 
1 1 1 17  3  20 o 125.9223 3.466797 194.4827       10.62806 196.2213       13.50109 191.6497       17.23381 126.2327 4.395661 124.3050 5.704477 1.927704       7.201590 
1 1 1 17  3  21 o 97.30363 3.010394 116.0729       7.129609 115.0761       10.10686 117.0601       10.05889 96.57642 4.305288 97.42315 4.247139 -0.8467255     6.047619 
1 1 1 17  3  22 o 111.4443 3.495603 152.7528       9.481537 146.8929       16.13150 155.8457       11.71962 108.2367 6.141150 112.3043 4.290226 -4.067688      7.491313 
1 1 1 17  3  23 o 68.82962 3.196304 58.34464       5.346530 49.54947       7.444638 67.71272       7.683279 62.95834 4.890707 73.85687 4.287366 -10.89853      6.503884 
1 1 1 17  3  24 o 49.60881 4.144485 30.71963       4.964581 28.35043       5.554092 40.13666       11.07309 47.42553 4.875141 54.84482 8.564943 -7.419292      9.855214 
1 1 1 17  3  25 o 27.40500 6.824239 10.05118       4.539934 7.182139       5.183331 19.50363       9.408331 23.62764 7.775406 36.99038 10.13784 -13.36274      12.77626 
1 1 1 17  3  26 o 21.69028 6.229455 6.249079       3.465948 2.425262       4.849754 10.24086       4.955127 17.89817 7.218710 27.36443 7.297256 -9.466259      10.26449 
1 1 1 17  3  27 o 23.94322 6.427415 7.814766       3.828510 6.141520       4.850439 10.58000       6.235436 21.76959 7.521764 27.29771 8.481988 -5.528118      11.33671 
1 1 1 17  3  28 o 25.21160 5.934683 8.701398       3.585209 10.63626       5.141694 6.870462       5.001705 27.23640 7.506383 22.42652 7.641777 4.809879       10.71179 
1 1 1 17  3  29 o 46.90901 3.916366 28.23555       4.436067 25.19094       6.349993 31.13783       6.199795 42.66256 6.296918 48.25381 5.362898 -5.591248      8.271146 
1 1 1 17  3  30 o 16.60265 6.374787 3.235012       3.621546 5.347336       7.144364 2.504534       4.201332 20.88003 8.630760 16.33691 6.670881 4.543125       10.90829 
1 1 1 17  3  31 o 15.79228 6.261897 2.829162       3.586639 5.205122       6.448921 1.765117       4.315665 19.79163 8.192192 15.43222 6.562940 4.359406       10.49687 
1 1 1 17  3  32 o 10.64990 5.033537 -2.696172      3.440397 -3.126497      6.263565 -2.510252      4.117061 14.26162 6.755744 11.87160 5.578612 2.390015       8.761334 
1 1 1 17  3  33 f 13.59712 5.706464 1.651124       3.192851 0.1656081      4.463821 3.207302       4.568755 13.77352 6.226598 16.26068 6.825356 -2.487169      9.238832 
1 1 1 17  3  34 o 8.604383 4.232645 -5.018414      3.108857 -3.256602      4.386330 -6.796804      4.406918 11.42905 5.479822 10.03128 4.954429 1.397764       7.387477 
1 1 1 17  3  35 o 14.04453 5.856753 2.559982       3.331101 2.135431       4.662458 3.002641       4.760860 14.49578 6.473289 15.17994 6.671144 -0.6841516     9.295570 
1 1 1 17  3  36 o 9.159780 4.509079 -4.835320      3.548987 -5.905272      4.214184 -2.225659      6.581476 9.706599 4.803320 13.21933 6.428226 -3.512733      8.024586 
1 1 1 17  3  37 o 15.43631 6.266534 4.432316       3.681776 2.073864       5.121899 6.953928       5.296105 13.88452 6.422346 17.21451 7.293525 -3.329990      9.718129 
1 1 1 17  4  0  o 44.60305 2.839196 24.36066       3.069981 20.88606       3.830802 30.59793       5.132571 41.18731 3.861760 49.87921 4.263434 -8.691902      5.752396 
1 1 1 17  4  1  o 323.3197 4.471742 1276.755       35.23263 1330.774       56.60924 1242.601       45.01348 329.5052 7.049997 318.7075 5.795813 10.79776       9.126549 
1 1 1 17  4  2  o 253.8315 3.695049 786.3843       22.85608 770.4948       35.13925 798.0366       30.09142 250.9522 5.745997 255.5512 4.832018 -4.599060      7.507656 
1 1 1 17  4  3  o 230.2411 3.459600 646.9172       19.41087 627.8730       29.54164 661.3862       25.74962 226.5815 5.350250 232.6707 4.541434 -6.089218      7.017820 
1 1 1 17  4  4  o 218.7955 3.355948 584.1846       17.89327 607.8768       28.20460 568.2261       23.14792 222.9500 5.191303 215.6668 4.404458 7.283188       6.808001 
1 1 1 17  4  5  o 135.9696 2.903475 225.5346       9.620461 216.8074       12.85317 236.6525       14.50729 133.1850 3.964628 139.1166 4.284392 -5.931564      5.837319 
1 1 1 17  4  6  o 218.8939 3.746552 585.0438       19.98488 583.0247       27.61554 587.2639       28.95800 218.3047 5.191040 219.0563 5.424714 -0.7515717     7.508290 
1 1 1 17  4  7  o 148.3215 3.048966 268.4465       11.02029 264.9649       14.81017 272.7658       16.49582 147.2079 4.132595 149.3075 4.539008 -2.099533      6.138480 
1 1 1 17  4  8  o 49.43214 3.161196 29.94464       3.788043 31.52967       4.806110 27.34515       6.154868 50.65302 3.924194 46.94070 5.483833 3.712311       6.743272 
1 1 1 17  4  9  o 158.6892 2.832862 307.2739       10.95491 310.5130       13.77714 301.7046       18.06515 159.4585 3.545482 156.9728 4.727987 2.485657       5.909678 
1 1 1 17  4  10 o 223.1292 3.436652 607.9916       18.68651 614.8560       23.85258 597.0844       30.06692 224.2306 4.365204 220.6393 5.596552 3.591248       7.097633 
1 1 1 17  4  11 o 197.8474 3.191077 477.9381       15.38522 469.4255       19.24205 493.0257       25.61713 195.9563 4.029547 200.5232 5.246901 -4.566986      6.615680 
1 1 1 17  4  12 o 205.4398 3.686553 515.7813       18.45615 500.1548       24.95399 534.6517       27.42213 201.9734 5.074036 208.7426 5.395331 -6.769180      7.406446 
1 1 1 17  4  13 o 47.61995 3.153932 27.81499       3.639346 24.39618       4.231758 37.52596       7.132053 44.49302 3.943755 55.05253 5.384987 -10.55951      6.674675 
1 1 1 17  4  14 o 154.7349 2.920168 292.3648       11.01114 302.0105       13.84140 275.7384       18.17245 157.1761 3.613744 149.8793 4.982413 7.296814       6.154965 
1 1 1 17  4  15 o 143.3108 3.153053 250.9350       11.01150 259.1371       12.50314 222.5808       23.24686 145.5842 3.524266 134.0296 7.143302 11.55463       7.965376 
1 1 1 17  4  16 o 118.4189 2.648371 171.2305       7.642509 170.2103       9.827877 172.7912       12.15576 117.9316 3.423365 118.6898 4.209407 -0.7581329     5.425729 
1 1 1 17  4  17 o 37.82077 3.553076 17.65541       3.236341 19.36916       4.440449 15.71357       4.726707 39.44896 4.712157 35.28743 5.690206 4.161530       7.388022 
1 1 1 17  4  18 o 78.30540 2.534152 74.96955       4.829344 85.82395       6.944147 64.80222       6.720776 83.67574 3.412680 72.63189 3.810462 11.04385       5.115272 
1 1 1 17  4  19 o 40.73108 3.392255 20.45370       3.336518 17.86910       4.719545 23.03612       4.717555 37.71634 5.279332 43.05213 4.566159 -5.335793      6.980054 
1 1 1 17  4  20 o 44.92159 3.335774 24.85833       3.625579 23.76446       5.159580 25.92528       5.095702 43.62954 4.939656 45.65360 4.644901 -2.024067      6.780509 
1 1 1 17  4  21 o 70.22446 3.066567 60.53445       5.235144 60.91157       8.544445 60.30779       6.624090 70.00711 5.042255 69.93314 3.902411 0.7396698E-01  6.375982 
1 1 1 17  4  22 o 24.16486 5.848171 7.570519       3.406299 11.06851       5.331325 5.157536       4.427953 29.02808 7.487621 20.96987 7.188998 8.058212       10.38008 
1 1 1 17  4  23 o 38.60816 3.771451 18.55469       3.503131 24.25023       5.010100 13.10654       4.900083 43.94125 4.754478 31.67066 6.564855 12.27059       8.105700 
1 1 1 17  4  24 o 42.48207 3.910940 22.52629       4.003358 22.34219       5.729054 22.70198       5.596481 41.73027 5.789463 42.14103 5.587252 -0.4107666     8.045823 
1 1 1 17  4  25 o 22.79667 6.118003 6.871140       3.469342 5.977026       4.933365 7.745963       4.879855 22.00716 7.586591 24.22116 7.499873 -2.213999      10.66792 
1 1 1 17  4  26 o 53.79921 4.183012 36.46740       5.440982 33.29764       6.269110 46.14400       10.95354 50.98016 5.115290 58.27523 7.917810 -7.295071      9.426447 
1 1 1 17  4  27 o 45.69875 4.604918 26.76579       5.058311 26.16435       5.904849 28.42391       9.804450 44.69852 5.539464 43.94126 9.437919 0.7572632      10.94349 
1 1 1 17  4  28 o 39.93500 5.688547 21.31422       5.379599 19.07357       8.127778 23.06108       7.176517 35.24038 9.322141 40.26729 7.591855 -5.026913      12.02242 
1 1 1 17  4  29 o 24.17785 6.610767 8.381051       4.006026 9.587323       7.322519 7.865799       4.785725 25.10884 9.181486 23.22811 7.458797 1.880732       11.82934 
1 1 1 17  4  30 o 40.58665 4.129634 21.58285       4.027602 28.02205       5.898937 15.95975       5.512461 45.17033 5.470334 32.67440 7.124425 12.49593       8.982315 
1 1 1 17  4  31 o 10.64154 4.929093 -1.716272      3.032529 -7.064282      4.339557 3.387918       4.239481 10.25618 5.036308 16.89117 6.771242 -6.634990      8.438846 
1 1 1 17  4  32 o 21.17593 6.241264 6.920222       3.439022 3.360271       4.661237 11.17295       5.094631 16.81851 6.963462 25.69426 7.602579 -8.875748      10.30966 
1 1 1 17  4  33 o 9.880051 4.792905 -4.405907      3.600849 -4.381059      6.667336 -4.416139      4.278483 13.78832 6.648023 10.95386 5.292277 2.834457       8.497317 
1 1 1 17  4  34 o 18.42767 6.265380 5.657580       3.361947 5.895883       4.813677 5.430643       4.697475 18.27365 7.251629 17.81715 7.132664 0.4565010      10.17158 
1 1 1 17  4  35 o 12.29029 5.638123 0.2357488E-01  3.833660 -1.589024      4.635712 3.512566       6.818725 12.20549 5.790572 16.14306 7.446822 -3.937577      9.433233 
1 1 1 17  4  36 o 11.54587 5.275149 0.1374096      3.310896 -2.241540      4.405418 3.225158       5.018981 11.38878 5.468696 14.93830 6.690272 -3.549513      8.640970 
1 1 1 17  4  37 o 16.20508 6.246191 5.044390       3.486314 4.627294       4.837067 5.495304       5.029339 15.48338 6.766502 16.12793 6.975074 -0.6445436     9.717880 
1 1 1 17  5  0  o 86.73934 3.369716 91.93366       7.109165 77.87146       14.05604 96.76736       8.240919 79.35709 7.352015 88.95950 3.810258 -9.602402      8.280712 
1 1 1 17  5  1  o 152.6892 2.727164 284.3277       10.14742 287.3876       13.14357 279.8127       15.96589 153.4624 3.514597 151.3051 4.334622 2.157242       5.580443 
1 1 1 17  5  2  o 76.72761 2.779909 71.89623       5.189194 77.79362       7.260707 65.73870       7.419114 79.74504 3.746754 73.25314 4.173404 6.491898       5.608517 
1 1 1 17  5  3  f 175.2874 3.224464 374.8960       13.77350 375.5429       19.01133 374.1814       19.98227 175.2720 4.454674 174.9224 4.691975 0.3496246      6.469833 
1 1 1 17  5  4  o 173.4577 3.214500 367.1286       13.58761 359.5389       18.49832 376.0215       20.02377 171.4878 4.430236 175.3415 4.690458 -3.853760      6.451929 
1 1 1 17  5  5  o 167.3568 3.167400 341.7660       12.91762 331.0890       17.41491 354.8263       19.26078 164.5588 4.346548 170.3186 4.644953 -5.759811      6.361451 
1 1 1 17  5  6  o 78.26432 2.987102 74.84390       5.686592 76.25747       6.588900 70.71697       11.25818 78.96582 3.432228 75.71840 6.154437 3.247421       7.046792 
1 1 1 17  5  7  o 75.42173 3.042706 69.52774       5.580848 71.79047       6.472818 62.97289       11.01689 76.60520 3.476421 71.37165 6.402223 5.233551       7.285187 
1 1 1 17  5  8  o 21.53821 5.265028 5.905469       2.739806 6.225387       2.874761 2.736106       9.048339 22.11094 5.385879 23.99552 9.792965 -1.884584      11.17631 
1 1 1 17  5  9  o 108.4426 3.116576 143.6594       8.227408 140.4644       9.500363 153.2431       16.45393 107.1777 3.642766 111.6090 6.072583 -4.431274      7.081385 
1 1 1 17  5  10 o 140.2530 3.396080 240.2171       11.60717 234.4002       13.57460 256.0353       22.38515 138.4234 4.028503 144.2511 6.383840 -5.827621      7.548658 
1 1 1 17  5  11 o 111.2848 3.235074 151.3518       8.763851 155.7943       10.26250 139.3856       16.84304 112.8512 3.736888 106.2893 6.534302 6.561958       7.527379 
1 1 1 17  5  12 o 240.3885 4.649689 707.4847       27.23791 704.9102       32.75174 713.2592       49.05047 239.6903 5.607222 239.9306 8.402184 -0.2402802     10.10137 
1 1 1 17  5  13 o 40.21600 4.275042 20.01205       4.125505 17.03922       4.485376 36.33991       10.51183 36.93600 5.120826 53.57212 8.321954 -16.63612      9.771273 
1 1 1 17  5  14 o 57.58391 3.404574 40.66423       4.756171 43.18873       5.892205 35.94343       8.057459 59.26675 4.105089 53.68587 6.277242 5.580875       7.500368 
1 1 1 17  5  15 o 122.5911 3.105088 183.7329       9.268711 188.0105       12.23711 177.9764       14.19578 123.8640 4.059612 120.3619 4.849804 3.502090       6.324638 
1 1 1 17  5  16 o 86.03308 3.160138 90.58981       6.614074 92.05099       8.467998 88.30374       10.59189 86.60596 4.023326 84.62353 5.160789 1.982430       6.543768 
1 1 1 17  5  17 o 159.1803 2.945611 309.6591       11.42617 311.0247       17.69362 308.6822       14.96505 159.1335 4.567394 158.7573 3.868194 0.3761902      5.985316 
1 1 1 17  5  18 o 67.92676 2.671495 56.46037       4.413506 55.94719       5.926431 57.09937       6.613164 67.49705 3.616269 68.13152 4.000743 -0.6344681     5.392898 
1 1 1 17  5  19 o 104.5743 2.642519 133.7471       6.728700 122.6204       8.628023 151.0187       10.74964 99.97521 3.547085 110.8670 3.985315 -10.89177      5.335218 
1 1 1 17  5  20 o 120.8796 3.196365 179.0999       9.407287 177.5889       18.21545 179.6495       10.98571 119.3610 6.284551 120.9351 3.732158 -1.574081      7.309212 
1 1 1 17  5  21 o 66.63197 3.161881 54.54704       5.119453 43.96774       7.371260 64.40497       7.115510 59.38147 5.144656 72.23076 4.058807 -12.84929      6.552969 
1 1 1 17  5  22 o 103.5988 3.608951 132.1786       9.097207 99.93636       16.49349 146.2762       10.90618 88.34865 7.738909 108.8164 4.120290 -20.46772      8.767411 
1 1 1 17  5  23 o 111.8541 2.786837 153.5155       7.596253 146.6286       9.880146 163.4718       11.87952 108.9558 3.726631 114.8181 4.253080 -5.862274      5.654774 
1 1 1 17  5  24 o 9.161657 4.385651 -3.770814      2.784860 1.494917       3.947646 -8.987432      3.929193 15.92826 6.480481 9.300631 4.608756 6.627634       7.952186 
1 1 1 17  5  25 o 27.09510 5.167315 9.546476       3.287386 6.164751       4.551526 13.23446       4.753157 22.00578 7.288043 31.59541 6.393135 -9.589630      9.694727 
1 1 1 17  5  26 o 11.00236 5.148377 -3.089559      3.443999 -5.884915      6.625794 -2.054726      4.031388 14.95922 7.044296 12.85463 5.852993 2.104591       9.158583 
1 1 1 17  5  27 o 62.46758 3.778144 49.12552       5.724457 55.59177       10.31508 46.24774       6.881375 64.36980 6.672549 60.05398 4.740580 4.315819       8.185108 
1 1 1 17  5  28 o 21.38663 6.952709 6.286040       4.150297 4.922878       4.801880 10.31142       8.251659 19.95618 7.410984 26.44711 9.734071 -6.490931      12.23417 
1 1 1 17  5  29 o 42.64003 4.988807 24.16863       5.085950 20.17577       5.777176 37.92338       10.72260 37.86670 6.494369 49.06856 9.307732 -11.20186      11.34948 
1 1 1 17  5  30 o 21.97920 6.043785 6.990953       3.337478 11.09522       4.939456 3.543114       4.527252 26.86284 7.338918 17.58945 7.015392 9.273392       10.15261 
1 1 1 17  5  31 o 20.77003 6.020015 6.418538       3.223009 7.370645       4.738709 5.598964       4.396544 21.52702 7.434781 19.38837 7.110410 2.138643       10.28756 
1 1 1 17  5  32 o 11.99811 5.331131 -0.4892676E-01 3.121717 -1.458432      4.318674 1.493411       4.517590 12.74540 5.896094 15.05930 6.560928 -2.313906      8.820981 
1 1 1 17  5  33 o 11.06956 5.168301 -1.723771      3.439042 3.085355       4.370740 -9.540538      5.572313 15.94695 6.683567 10.89355 5.413545 5.053399       8.600962 
1 1 1 17  5  34 o 10.50129 4.925499 -1.652334      3.183757 -5.769852      4.309560 3.295086       4.723942 10.21808 5.017855 15.81955 6.800127 -5.601472      8.451071 
1 1 1 17  5  35 o 16.10834 6.552837 4.397888       4.035628 3.228058       7.692663 4.842092       4.740302 16.15696 7.602713 16.55476 6.950776 -0.3977966     10.30119 
1 1 1 17  5  36 o 13.50408 5.741252 2.410635       3.300976 6.313790       4.610395 -1.694903      4.728411 17.42994 7.035314 11.93832 5.714784 5.491619       9.063907 
1 1 1 17  6  0  o 110.5104 2.494519 148.9169       6.717787 152.4588       10.55168 146.5026       8.711407 111.6894 3.882709 109.5326 3.267341 2.156738       5.074539 
1 1 1 17  6  1  o 78.50267 2.235277 75.19714       4.271786 81.16495       5.911205 68.67381       6.180205 81.51690 2.980740 74.94340 3.392823 6.573502       4.516200 
1 1 1 17  6  2  o 72.33732 2.266624 63.86315       3.990632 57.97467       5.264810 71.81483       6.118019 68.86240 3.145669 76.64774 3.283088 -7.785339      4.546856 
1 1 1 17  6  3  f 83.74582 2.597327 85.61499       5.294201 87.09316       6.864738 83.44538       8.316730 84.41469 3.343720 82.55515 4.147300 1.859535       5.327341 
1 1 1 17  6  4  o 202.3671 3.176249 499.7032       15.66356 501.0104       23.98469 498.7310       20.68338 202.4358 4.861952 202.0611 4.200516 0.3746796      6.425178 
1 1 1 17  6  5  o 130.2482 2.907588 206.9652       9.228701 200.0602       16.00952 210.4016       11.29402 127.7822 5.151848 131.2382 3.534661 -3.455986      6.247828 
1 1 1 17  6  6  o 93.44296 3.115844 106.6709       7.085176 104.5296       10.22468 108.6490       9.827045 92.35963 4.556953 94.19583 4.292378 -1.836197      6.260219 
1 1 1 17  6  7  o 83.11945 3.127999 84.43649       6.324552 90.32145       9.178655 79.11648       8.726964 85.84763 4.402174 80.32320 4.476177 5.524429       6.278161 
1 1 1 17  6  8  o 116.2912 2.518338 164.9625       7.136691 167.0273       8.719879 160.7734       12.42042 116.9455 3.062419 114.5830 4.456656 2.362556       5.407420 
1 1 1 17  6  9  o 126.3720 2.588419 194.8282       7.971158 201.2826       9.837165 182.4867       13.60264 128.4100 3.143655 122.0562 4.581407 6.353821       5.556245 
1 1 1 17  6  10 o 178.0429 2.992543 386.9294       12.98378 386.2988       16.17189 388.0729       21.77879 177.8096 3.732239 177.9466 5.027400 -0.1370087     6.261339 
1 1 1 17  6  11 o 186.4073 3.092093 424.2437       14.04596 429.1946       17.61740 415.6061       23.26984 187.3859 3.858058 184.0880 5.192373 3.297867       6.468799 
1 1 1 17  6  12 o 51.74198 2.833648 32.77751       3.559296 29.49515       4.011209 44.93196       7.718795 49.02193 3.378413 60.30500 5.306492 -11.28307      6.290670 
1 1 1 17  6  13 o 238.4690 3.617041 695.1215       21.01946 698.1628       26.54378 690.0076       34.41988 238.7648 4.562011 236.8660 5.967831 1.898804       7.511787 
1 1 1 17  6  14 o 42.52087 3.302189 22.22543       3.394883 23.79547       3.840773 16.61683       7.259231 43.96889 3.616510 35.89024 8.442268 8.078648       9.184282 
1 1 1 17  6  15 o 228.1674 3.546513 636.6523       19.71929 651.9766       25.04279 611.6456       31.99042 230.6536 4.455396 222.8494 5.895954 7.804245       7.390049 
1 1 1 17  6  16 o 56.76077 3.050609 39.48649       4.204093 36.42622       4.771570 50.10563       8.888460 54.44328 3.617017 63.52544 5.805845 -9.082161      6.840369 
1 1 1 17  6  17 o 74.08599 2.863952 67.17007       5.160825 71.95440       6.111474 55.27882       9.634934 76.63200 3.280239 66.67627 5.993714 9.955734       6.832612 
1 1 1 17  6  18 o 197.6828 2.976868 477.8433       14.34051 509.9199       20.57577 447.5438       19.99767 203.8724 4.141537 190.9463 4.297660 12.92612       5.968434 
1 1 1 17  6  19 o 50.35877 3.131078 31.15793       3.823415 25.33581       6.087815 34.95023       4.913291 44.92437 5.688192 53.24574 3.811835 -8.321377      6.847307 
1 1 1 17  6  20 o 17.53937 5.928090 3.571352       3.009387 8.076733       6.664361 2.417346       3.372850 25.99479 8.821494 16.32670 6.180002 9.668091       10.77085 
1 1 1 17  6  21 o 131.4911 3.119885 211.9749       9.997029 225.1602       14.96196 201.3410       13.43660 134.9753 4.555342 127.7184 4.323411 7.256889       6.280368 
1 1 1 17  6  22 o 48.03399 3.247382 28.46640       3.778834 21.86062       5.125215 36.33475       5.593611 41.63570 5.161859 54.06708 4.280345 -12.43138      6.705680 
1 1 1 17  6  23 o 60.41117 3.333770 45.06585       4.888795 36.23532       7.225792 52.52044       6.639019 53.47118 5.629731 64.98136 4.215305 -11.51019      7.032970 
1 1 1 17  6  24 f 25.10091 5.850766 8.276880       3.512415 7.750961       5.814578 8.579051       4.407428 24.66429 8.239369 25.41576 6.927859 -0.7514763     10.76487 
1 1 1 17  6  25 o 50.94653 3.637511 32.37340       4.486300 32.19049       6.957422 32.50358       5.869564 49.92131 5.828635 50.61606 4.816613 -0.6947441     7.561266 
1 1 1 17  6  26 o 27.60822 5.014096 9.956519       3.249184 11.01556       4.458781 8.757349       4.744606 28.50638 6.555511 25.28008 7.297194 3.226301       9.809371 
1 1 1 17  6  27 o 16.01789 5.874052 2.877884       3.000472 3.758351       4.391138 2.106748       4.109468 18.52997 7.042778 16.41972 6.636915 2.110245       9.677260 
1 1 1 17  6  28 o 34.68095 4.479532 15.66098       3.697480 17.98825       5.407167 13.61699       5.067405 36.10747 6.378397 31.01646 6.884103 5.091009       9.384819 
1 1 1 17  6  29 o 23.57280 5.687701 7.762773       3.229440 6.778867       4.637342 8.689259       4.499991 21.70423 7.358709 24.27870 7.135035 -2.574469      10.24984 
1 1 1 17  6  30 o 11.38323 5.310365 -2.382985      3.618587 -4.511078      4.256110 3.167598       6.873641 11.30809 5.415445 18.91585 8.167475 -7.607759      9.799729 
1 1 1 17  6  31 o 11.66034 5.307326 -0.9868762     3.311045 3.850913       4.445957 -7.011382      4.961380 17.40451 6.948627 11.19136 5.472446 6.213157       8.844833 
1 1 1 17  6  32 o 15.17620 6.017927 2.793818       3.312770 3.711758       4.339857 1.512139       5.128117 16.86166 6.818669 15.57830 6.881799 1.283360       9.687797 
1 1 1 17  6  33 o 12.98689 5.512531 1.337154       3.034866 3.868788       4.193438 -1.447176      4.397746 16.54084 6.697698 12.56676 5.859744 3.974084       8.899200 
1 1 1 17  6  34 o 12.68122 5.512114 1.137947       3.173246 6.741968       4.326752 -5.384736      4.667940 19.18968 7.051053 10.81710 5.293400 8.372580       8.816883 
1 1 1 17  6  35 o 18.41327 6.393316 6.162680       3.506101 5.989855       4.750374 6.369477       5.196335 17.53793 7.118676 17.76129 7.352915 -0.2233677     10.23430 
1 1 1 17  6  36 o 15.02394 6.389092 3.766150       4.089818 -3.034495      7.685809 6.452455       4.830502 13.46754 6.630813 17.37620 7.130708 -3.908661      9.737283 
1 1 1 17  7  0  o 153.0817 2.781620 285.8118       10.37665 296.5339       16.67132 279.0309       13.25785 155.7503 4.396832 151.2048 3.598087 4.545502       5.681405 
1 1 1 17  7  1  o 86.59777 2.211453 91.49162       4.662996 87.22708       6.284419 96.71550       6.955465 84.50320 3.056835 88.97514 3.213181 -4.471939      4.434949 
1 1 1 17  7  2  o 104.2421 2.706977 132.6222       6.870620 136.6470       12.09296 130.7037       8.349028 105.6371 4.709480 103.4414 3.316399 2.195702       5.760010 
1 1 1 17  7  3  o 68.11414 2.413592 56.64758       3.999911 60.93412       5.577593 52.10884       5.739330 70.59036 3.251120 65.23566 3.624521 5.354706       4.868977 
1 1 1 17  7  4  o 71.39886 2.737343 62.27335       4.753914 52.77293       7.228793 69.51332       6.310485 65.55531 4.553332 75.38807 3.444076 -9.832756      5.709159 
1 1 1 17  7  5  o 307.5817 4.314317 1156.045       32.33766 1157.113       50.20543 1155.288       42.27502 307.0997 6.708652 307.1666 5.647727 -0.6695557E-01 8.769425 
1 1 1 17  7  6  o 120.3990 2.807204 176.8517       8.236319 179.6259       10.79921 172.9942       12.73438 121.2305 3.659666 118.8868 4.403104 2.343704       5.725424 
1 1 1 17  7  7  o 132.3827 2.597673 213.7814       8.380148 210.0270       10.17206 221.7124       14.78443 131.1772 3.182104 134.5843 4.514287 -3.407074      5.523095 
1 1 1 17  7  8  o 136.9406 2.887989 228.8379       9.637492 223.0573       10.67184 254.3966       22.44000 135.1736 3.239748 143.8181 6.419026 -8.644470      7.190262 
1 1 1 17  7  9  o 39.80276 2.898376 19.43643       2.792015 18.22323       3.064869 25.35437       6.769094 38.49272 3.299148 45.01091 6.347305 -6.518196      7.153507 
1 1 1 17  7  10 o 143.2460 2.710712 250.3943       9.462416 253.0842       11.64397 245.1636       16.23729 143.9593 3.319136 141.4489 4.717217 2.510468       5.767911 
1 1 1 17  7  11 o 143.6269 3.075696 251.8680       10.76503 257.9670       14.10421 243.3568       16.66146 145.1993 3.989883 140.8799 4.860476 4.319382       6.288354 
1 1 1 17  7  12 o 102.4978 2.534718 128.1985       6.331119 128.2110       7.509016 128.1679       11.77442 102.4275 3.011635 102.1875 4.741233 0.2400131      5.616871 
1 1 1 17  7  13 o 62.58046 2.691483 47.89325       4.094963 49.77894       4.715644 42.11100       8.257596 63.77095 3.043246 58.24385 5.899175 5.527100       6.637892 
1 1 1 17  7  14 o 125.9445 2.692478 193.6544       8.263568 197.8373       9.942277 184.3083       14.86142 127.2042 3.209928 122.4730 4.989928 4.731247       5.933213 
1 1 1 17  7  15 o 132.0399 2.748010 212.9139       8.842184 209.9648       10.58380 219.7292       16.08917 131.0126 3.317738 133.7074 4.946425 -2.694763      5.956048 
1 1 1 17  7  16 o 149.0637 2.888577 271.4877       10.49281 277.1944       12.84201 260.0261       18.19963 150.5248 3.500973 145.3592 5.145999 5.165588       6.223996 
1 1 1 17  7  17 o 74.52277 2.801834 67.95705       5.079177 69.35729       5.895370 63.92421       10.00494 75.23642 3.222955 71.77426 5.768726 3.462158       6.607998 
1 1 1 17  7  18 o 81.39639 3.269729 81.21793       6.472443 80.34007       8.080427 82.78951       10.81153 80.81157 4.116783 81.74464 5.458683 -0.9330673     6.837040 
1 1 1 17  7  19 o 124.2734 2.516947 188.7490       7.622341 192.3310       10.58273 184.8874       10.98792 125.2283 3.471188 122.7300 3.678061 2.498306       5.057399 
1 1 1 17  7  20 o 64.75306 2.667315 51.37910       4.199909 52.55798       5.679171 49.95618       6.239417 65.34654 3.580045 63.61416 4.045856 1.732384       5.402377 
1 1 1 17  7  21 o 23.47969 4.963738 7.077219       2.751164 6.181985       3.900186 7.963826       3.881350 22.08488 6.679760 24.76732 6.388875 -2.682446      9.243209 
1 1 1 17  7  22 o 22.86648 5.572590 6.784805       3.076410 6.988695       4.978834 6.658884       3.912720 23.59808 7.610603 22.73189 6.645729 0.8661900      10.10381 
1 1 1 17  7  23 o 19.55677 6.364485 4.729721       3.477255 -1.800835      8.337997 6.104641       3.825828 19.60887 8.712776 21.79549 6.620719 -2.186613      10.94287 
1 1 1 17  7  24 o 18.99431 6.444799 4.365560       3.557063 3.509673       8.456106 4.549566       3.920825 22.81314 9.405814 19.53507 6.762038 3.278074       11.58423 
1 1 1 17  7  25 o 53.19364 3.149657 35.10583       4.064532 34.24687       5.329734 36.29973       6.283547 52.16409 4.228975 53.43861 4.878942 -1.274517      6.456648 
1 1 1 17  7  26 o 25.10009 5.250323 8.331710       3.108036 6.359350       4.294482 10.50106       4.503840 21.90152 7.068650 27.71038 6.736145 -5.808859      9.764296 
1 1 1 17  7  27 o 27.41406 4.931693 9.908604       3.173496 9.661435       4.432205 10.16862       4.545959 26.30512 6.848338 26.97072 6.891925 -0.6655998     9.715882 
1 1 1 17  7  28 o 16.96804 6.011069 3.586028       3.109672 4.349514       4.555989 2.920115       4.254913 19.02007 7.186399 17.18970 6.818962 1.830370       9.906693 
1 1 1 17  7  29 o 42.62975 3.759965 23.39477       3.866010 22.56282       5.607786 24.14832       5.336988 40.38719 5.869555 42.24871 5.300108 -1.861519      7.908402 
1 1 1 17  7  30 o 20.56442 6.302328 6.220417       3.456633 4.225273       4.710943 8.547343       5.087589 18.26444 7.197069 23.24111 7.705568 -4.976669      10.54389 
1 1 1 17  7  31 o 14.35019 5.698964 2.235873       2.975155 0.5416989      4.130927 4.061764       4.288505 14.03582 6.189491 17.47789 6.873006 -3.442074      9.249216 
1 1 1 17  7  32 o 9.755223 4.690658 -3.594289      3.266366 0.3081177      3.695478 -17.53123      6.983740 13.06902 5.804058 10.85223 5.483250 2.216787       7.984555 
1 1 1 17  7  33 o 9.572203 4.554038 -2.507296      2.907418 0.1937969      4.060874 -5.348007      4.164504 13.15905 5.944804 10.29644 5.030313 2.862607       7.787474 
1 1 1 17  7  34 o 10.39815 4.827742 -1.123682      2.935214 -1.193472      4.042099 -1.045829      4.269248 11.93799 5.583375 12.29416 5.746088 -0.3561716     8.011967 
1 1 1 17  7  35 o 10.79073 4.986145 -0.6228000     3.075581 -0.9829484     4.071507 -0.1441920     4.693582 11.81544 5.550786 12.89777 6.027116 -1.082323      8.193739 
1 1 1 17  7  36 f 13.86471 5.746335 2.885045       3.178668 3.681562       4.296493 1.921901       4.724568 14.92404 6.450638 13.79800 6.303116 1.126033       9.018869 
1 1 1 17  8  0  o 45.47596 2.980861 25.33574       3.285178 29.82689       5.113722 22.17966       4.286788 49.22996 4.305869 42.40955 4.203175 6.820408       6.017241 
1 1 1 17  8  1  o 156.3924 3.024485 298.3856       11.52665 317.9918       16.37857 279.1459       16.22482 161.3050 4.170197 151.0967 4.411170 10.20824       6.070335 
1 1 1 17  8  2  o 236.7176 3.942667 684.2531       22.74347 689.9521       43.89230 682.1613       26.59183 236.8773 7.613657 236.2594 4.618734 0.6178131      8.905082 
1 1 1 17  8  3  o 108.9946 2.774411 145.0052       7.363066 148.1878       12.88762 143.4628       8.971457 109.9910 4.819867 108.3648 3.401551 1.626266       5.899294 
1 1 1 17  8  4  f 86.00322 2.648356 90.30476       5.543821 88.27979       6.959936 93.81953       9.169486 84.97929 3.367572 87.51976 4.312631 -2.540474      5.471684 
1 1 1 17  8  5  o 46.81470 2.940302 26.84565       3.337423 26.95237       3.916919 26.56289       6.375756 46.86099 3.454303 46.21273 5.788140 0.6482544      6.740532 
1 1 1 17  8  6  o 102.5605 2.438889 128.2921       6.095482 124.4142       7.181467 138.2848       11.52816 100.9345 2.922774 106.2628 4.461803 -5.328316      5.333882 
1 1 1 17  8  7  o 150.2095 2.738454 275.2819       10.02395 285.1173       12.50044 257.5652       16.77719 152.8183 3.356709 145.0249 4.753656 7.793457       5.819343 
1 1 1 17  8  8  o 191.2235 3.101092 446.3423       14.45081 441.3703       17.87465 455.7235       24.55277 190.0620 3.859278 192.8345 5.229748 -2.772446      6.499560 
1 1 1 17  8  9  o 120.6469 2.568529 177.5858       7.551565 185.8938       9.236977 160.8422       13.11316 123.4020 3.071648 114.5462 4.707788 8.855766       5.621235 
1 1 1 17  8  10 o 155.3285 2.800167 294.4599       10.59915 288.4395       12.89005 307.0285       18.62466 153.6676 3.442203 158.2776 4.834396 -4.610001      5.934656 
1 1 1 17  8  11 o 159.5429 2.849106 310.7069       11.07700 310.6743       13.58256 310.7717       19.14075 159.4614 3.495343 159.1944 4.939932 0.2669830      6.051476 
1 1 1 17  8  12 o 47.42291 2.822087 27.55124       3.246580 29.88775       3.632513 18.27489       7.237891 49.37994 3.033342 37.72942 8.113418 11.65052       8.661911 
1 1 1 17  8  13 o 82.68385 2.514160 83.51408       5.059935 82.30059       5.795577 87.40463       10.37727 82.04523 2.903303 84.26460 5.077163 -2.219376      5.848654 
1 1 1 17  8  14 o 86.06040 2.541928 90.48702       5.325085 90.85646       6.148839 89.37866       10.65037 86.19778 2.931524 85.17383 5.155381 1.023949       5.930580 
1 1 1 17  8  15 o 87.94453 2.583627 94.51646       5.530999 91.62457       6.355904 103.5387       11.22651 86.54053 3.018472 91.68061 5.044381 -5.140083      5.878516 
1 1 1 17  8  16 o 151.9598 2.882786 282.1604       10.67523 286.7956       12.98600 272.4992       18.74802 153.1036 3.480598 148.7792 5.178927 4.324371       6.239859 
1 1 1 17  8  17 o 69.32705 3.396352 58.95859       5.720417 57.35024       6.441965 64.95587       12.43954 68.30096 3.886436 71.97059 7.188808 -3.669624      8.172109 
1 1 1 17  8  18 o 52.85921 3.257106 34.33139       4.175171 34.06905       4.547417 35.73980       10.53663 52.61212 3.567958 52.72869 8.488169 -0.1165733     9.207569 
1 1 1 17  8  19 o 24.38739 5.513770 7.642974       3.199624 8.598476       3.474707 2.315053       8.205049 25.86747 5.669096 22.42204 9.256886 3.445431       10.85489 
1 1 1 17  8  20 o 93.66766 2.719129 107.4611       6.200057 106.1572       8.647325 108.8406       8.894300 92.85984 3.829576 94.01259 3.890713 -1.152748      5.459240 
1 1 1 17  8  21 o 37.20961 3.579015 17.17600       3.205317 13.40400       4.744320 20.34357       4.347621 32.20741 6.270432 40.33308 4.499948 -8.125675      7.718020 
1 1 1 17  8  22 o 50.82008 2.915301 31.80230       3.595247 26.02045       4.699825 39.95887       5.582159 45.66181 4.273337 56.72237 4.065381 -11.06056      5.898197 
1 1 1 17  8  23 o 73.72226 2.677565 66.80759       4.802338 61.47013       6.232594 74.60692       7.534072 70.44743 3.642883 77.50156 4.002738 -7.054123      5.412256 
1 1 1 17  8  24 o 61.36446 2.841039 46.45324       4.236917 39.28572       5.464316 57.25901       6.709334 56.06647 4.026222 67.71474 4.084928 -11.64827      5.735600 
1 1 1 17  8  25 o 48.07477 3.206575 28.73964       3.735122 22.26808       4.844931 38.22122       5.864396 41.72945 4.854957 55.00542 4.412007 -13.27597      6.560215 
1 1 1 17  8  26 o 30.48826 4.958451 12.12701       3.557487 6.112262       5.323819 16.97939       4.781807 21.97837 7.856805 35.87037 5.657707 -13.89199      9.681891 
1 1 1 17  8  27 o 10.51163 4.714646 -0.8936297     2.502416 -2.040044      3.592838 0.1864954      3.487417 11.88368 5.454023 13.50882 5.825140 -1.625144      7.979889 
1 1 1 17  8  28 o 14.77062 5.741189 2.163624       2.963832 4.002439       3.829613 -0.5826671     4.680144 18.01668 6.631313 14.59893 6.504663 3.417747       9.288970 
1 1 1 17  8  29 o 14.27350 5.644689 1.967038       2.907269 3.028571       4.315024 1.084564       3.934299 17.01684 6.827980 14.68393 6.256216 2.332910       9.260754 
1 1 1 17  8  30 o 28.20034 4.865929 10.94697       3.223130 6.465621       4.541506 15.49479       4.575068 20.64065 7.268599 32.80741 5.941232 -12.16676      9.387799 
1 1 1 17  8  31 o 10.42589 4.834349 -1.631480      2.928766 -2.624189      3.775444 -0.1313635     4.641087 11.29684 5.318988 14.11585 6.368196 -2.819007      8.297322 
1 1 1 17  8  32 o 16.82953 5.946901 4.189980       3.042047 6.555021       4.175075 1.513489       4.441481 19.96055 6.973752 14.81910 6.479884 5.141448       9.519565 
1 1 1 17  8  33 o 17.67993 6.059184 4.993989       3.145471 1.053836       4.027488 11.15581       5.036541 13.70718 6.074837 24.47870 7.625784 -10.77152      9.749679 
1 1 1 17  8  34 o 14.11333 5.892633 2.497683       3.378111 1.930164       3.740143 5.010769       7.870490 13.82503 5.996955 17.37617 8.010238 -3.551142      10.00637 
1 1 1 17  8  35 o 8.456622 4.131576 -3.700351      2.809850 -5.805387      3.484620 0.2126509      4.750954 8.731259 4.328995 13.08810 6.098725 -4.356839      7.478947 
1 1 1 17  8  36 o 11.25583 5.149711 0.1242582      3.169583 -0.2503565     4.264770 0.5864879      4.737314 12.13074 5.693243 12.96902 6.058680 -0.8382826     8.313881 
1 1 1 17  9  0  o 42.24080 3.170494 21.89264       3.239772 23.24572       5.120114 20.98916       4.183843 43.32872 4.937154 41.23996 4.222699 2.088757       6.496666 
1 1 1 17  9  1  o 121.5512 2.837175 180.2264       8.403913 189.6813       15.50316 176.2920       10.00075 124.4348 5.123561 120.1379 3.419468 4.296982       6.159841 
1 1 1 17  9  2  o 143.4394 3.369563 251.1092       11.77818 229.2355       18.44684 266.1639       15.30374 136.7454 5.547222 147.5425 4.260881 -10.79710      6.994768 
1 1 1 17  9  3  o 75.14586 2.666644 68.96552       4.875478 67.53331       6.030698 71.66763       8.283544 74.31069 3.338803 76.44801 4.465902 -2.137321      5.576010 
1 1 1 17  9  4  o 112.7415 2.752632 155.0591       7.562549 152.9645       9.764588 158.1987       11.95491 111.8734 3.586347 113.6955 4.322734 -1.822083      5.616753 
1 1 1 17  9  5  o 57.64716 2.563831 40.61537       3.592655 47.51923       4.829813 32.06356       5.375433 62.31599 3.191121 51.03320 4.364246 11.28279       5.406468 
1 1 1 17  9  6  f 85.78864 2.412922 89.83565       5.039385 88.69392       5.934019 92.78910       9.544064 85.20995 2.861799 86.99541 4.517427 -1.785461      5.347620 
1 1 1 17  9  7  o 88.73779 2.425679 96.12017       5.240474 100.2858       6.237158 86.11988       9.663898 90.61253 2.828098 83.76508 4.753786 6.847450       5.531421 
1 1 1 17  9  8  o 135.7953 2.640560 224.9902       8.738096 228.2520       10.66493 218.3284       15.24116 136.7327 3.200733 133.4937 4.692420 3.238983       5.680097 
1 1 1 17  9  9  o 229.0093 3.482342 640.6102       19.43394 615.9932       23.84188 689.3491       33.54753 224.4079 4.359797 237.0369 5.807758 -12.62906      7.262085 
1 1 1 17  9  10 o 82.07596 2.459974 82.26172       4.914645 83.45863       5.716193 78.86896       9.623888 82.64104 2.842641 80.09007 4.955277 2.550980       5.712739 
1 1 1 17  9  11 o 233.5376 4.028728 667.0385       22.92772 639.3044       30.66520 702.1969       34.52654 228.2580 5.512945 239.0923 5.925860 -10.83432      8.093724 
1 1 1 17  9  12 o 208.4478 3.773406 531.3084       19.16757 521.6951       25.78643 543.1784       28.65381 206.2427 5.130700 210.2428 5.597725 -4.000153      7.593327 
1 1 1 17  9  13 o 229.7764 4.026301 646.1351       22.54487 603.1946       29.59363 705.5221       34.80249 221.5966 5.480234 239.4786 5.963588 -17.88196      8.099218 
1 1 1 17  9  14 o 128.4203 3.484605 201.8148       10.89486 209.0904       12.91218 183.8331       20.29934 130.6159 4.061584 121.7957 6.867153 8.820213       7.978362 
1 1 1 17  9  15 o 167.0747 3.836228 341.7448       15.61892 363.6367       19.01763 296.3781       27.37684 172.1208 4.538017 154.4682 7.293507 17.65256       8.590043 
1 1 1 17  9  16 o 74.13583 4.643955 67.73943       8.347671 65.76212       11.12032 70.29208       12.63499 72.68289 6.341846 74.99529 6.994256 -2.312401      9.441326 
1 1 1 17  9  17 o 99.81919 4.061011 122.4167       9.857724 113.9478       12.11937 138.9739       16.94570 96.04285 5.197565 105.6660 6.614118 -9.623138      8.411969 
1 1 1 17  9  18 o 83.87271 3.705652 86.42384       7.555234 91.53631       10.41808 80.75232       10.97293 86.03982 4.990221 80.63398 5.619462 5.405838       7.515362 
1 1 1 17  9  19 o 53.37820 3.293630 35.04881       4.263385 33.56206       4.769732 40.95710       9.508357 52.15020 3.778834 56.83763 7.013493 -4.687424      7.966723 
1 1 1 17  9  20 o 100.6352 2.817371 124.1144       6.902434 118.1805       7.423237 162.0071       18.75864 98.13631 3.107960 113.4624 6.815851 -15.32609      7.491011 
1 1 1 17  9  21 o 16.79272 5.870342 3.168547       2.958660 1.168508       3.106809 22.65189       9.696771 14.27080 5.769862 40.87870 9.850863 -26.60790      11.41625 
1 1 1 17  9  22 o 41.58463 3.020790 21.35765       3.040312 19.83470       4.119768 23.17901       4.505361 39.78294 4.318725 43.03053 4.356473 -3.247593      6.134349 
1 1 1 17  9  23 o 20.38750 4.920322 5.402561       2.416353 4.848827       3.386770 5.976679       3.448546 19.63770 6.271433 21.43689 6.231131 -1.799189      8.840693 
1 1 1 17  9  24 o 54.56256 2.788572 36.75507       3.695473 34.28892       4.856304 40.14769       5.695911 52.39016 3.830287 56.58949 4.159454 -4.199326      5.654393 
1 1 1 17  9  25 o 41.93001 3.135495 21.89183       3.180614 23.73487       4.328675 19.72914       4.689039 43.33012 4.150150 39.13361 5.033399 4.196507       6.523715 
1 1 1 17  9  26 o 28.45095 4.420188 10.47338       2.965167 10.28325       3.813663 10.76402       4.715084 27.63704 5.845435 27.83626 6.967819 -0.1992188     9.095033 
1 1 1 17  9  27 o 17.96368 5.593350 4.286065       2.709984 5.880365       3.581065 2.149470       4.145608 20.72860 6.425810 16.36332 6.647092 4.365280       9.245262 
1 1 1 17  9  28 o 9.892915 4.608502 -2.091398      2.709676 -0.5347799     4.634741 -2.899776      3.339962 14.51435 6.469617 10.68475 5.022065 3.829594       8.190061 
1 1 1 17  9  29 o 29.17200 4.468066 11.37674       3.075307 15.56576       4.515595 7.753084       4.199832 33.31140 5.771717 22.76097 6.941387 10.55044       9.027489 
1 1 1 17  9  30 o 14.10343 5.466725 2.219210       2.681535 3.076398       3.899816 1.450468       3.693143 16.30311 6.508210 14.40803 6.096875 1.895088       8.917885 
1 1 1 17  9  31 o 13.96807 5.496342 2.187653       2.744128 1.838896       3.875465 2.538330       3.886121 14.77043 6.247672 15.46985 6.377059 -0.6994181     8.927502 
1 1 1 17  9  32 o 17.24669 5.855606 4.501339       2.936451 3.539553       4.028124 5.592117       4.289751 16.28254 6.574678 18.63932 6.988149 -2.356783      9.594822 
1 1 1 17  9  33 o 23.85942 5.522803 8.809922       3.147584 11.00493       4.296365 6.266897       4.624429 25.26302 6.820656 18.76929 7.204367 6.493729       9.920900 
1 1 1 17  9  34 o 12.26144 5.254788 1.297523       2.805010 -3.560935      3.655560 8.254111       4.374243 10.03926 4.860405 20.59646 7.141666 -10.55721      8.638688 
1 1 1 17  9  35 o 11.93727 5.508379 -0.5502876E-01 3.734980 -1.368845      4.238445 4.510559       7.901101 11.69921 5.546445 16.31070 7.684316 -4.611484      9.476907 
1 1 1 17  9  36 o 9.298428 4.458866 -2.209229      2.906316 0.2646300      3.771753 -5.824779      4.559770 11.96367 5.525852 10.03673 4.971978 1.926947       7.433411 
1 1 1 17  10 0  o 76.98328 2.580617 72.36007       4.834390 81.06966       8.017663 67.38460       6.059912 81.37307 4.056039 74.23097 3.358703 7.142097       5.266150 
1 1 1 17  10 1  o 282.1334 4.502061 972.7861       30.95294 918.8421       58.49676 993.7632       36.47811 272.9095 8.807367 285.0051 5.252228 -12.09555      10.25454 
1 1 1 17  10 2  o 60.89680 2.774907 45.33219       4.107109 49.36053       5.118874 38.05261       6.881205 63.50825 3.319083 55.53666 5.142915 7.971584       6.120938 
1 1 1 17  10 3  o 147.0181 3.024393 263.7421       10.83541 279.9120       14.76572 244.8747       15.94985 151.3222 4.007730 141.4485 4.633491 9.873672       6.126266 
1 1 1 17  10 4  o 151.4218 3.100254 279.8163       11.43989 293.4256       21.33794 274.3266       13.55218 154.6703 5.670814 149.8775 3.710535 4.792740       6.776886 
1 1 1 17  10 5  o 173.2545 2.917946 366.2818       12.31963 365.8216       18.39473 366.6562       16.58990 172.9330 4.368449 173.2392 3.929720 -0.3061981     5.875886 
1 1 1 17  10 6  o 86.81522 2.425051 92.00208       5.125392 95.21548       6.106268 84.33971       9.429180 88.28962 2.841818 82.90253 4.686430 5.387085       5.480744 
1 1 1 17  10 7  o 258.9579 3.791666 819.3281       23.92739 819.8972       30.19771 818.3680       39.22159 258.8369 4.787533 258.2036 6.233425 0.6332397      7.859775 
1 1 1 17  10 8  o 180.8134 3.461727 399.3150       15.25315 397.4135       20.57600 401.6346       22.72637 180.1407 4.691188 180.9996 5.157739 -0.8589783     6.972053 
1 1 1 17  10 9  o 213.5251 3.796495 557.2291       19.75458 506.8748       25.55561 631.9895       31.13892 203.3211 5.162014 226.9825 5.629568 -23.66148      7.637959 
1 1 1 17  10 10 o 164.7854 3.151203 331.5994       12.65410 332.3690       14.18076 328.5912       28.03565 164.9299 3.528287 163.1566 7.068077 1.773254       7.899780 
1 1 1 17  10 11 o 122.4602 2.776355 183.0664       8.285257 185.8451       9.213861 171.3278       18.93757 123.3609 3.064983 117.7733 6.625151 5.587555       7.299777 
1 1 1 17  10 12 o 77.46873 2.572969 73.33061       4.850585 72.76228       5.222274 76.90211       13.09144 77.14915 2.782301 78.66708 6.898780 -1.517929      7.438707 
1 1 1 17  10 13 o 245.6703 4.663694 739.9241       27.92022 732.4744       32.92495 758.9948       52.67936 244.1246 5.534490 246.7534 8.774715 -2.628876      10.37430 
1 1 1 17  10 14 o 255.4086 4.255325 799.3350       26.48527 822.7546       36.10382 772.0463       38.97207 258.5319 5.730638 250.0453 6.401119 8.486557       8.591538 
1 1 1 17  10 15 o 39.90243 8.488920 20.58731       8.000516 0.000000       0.000000 20.58731       8.000516 ?        ?        39.90243 8.488920 0.000000       8.488920 
1 1 1 17  10 16 o 70.17599 2.753771 60.26811       4.700117 64.42405       5.396585 47.21225       9.565048 72.52240 3.060470 61.43696 6.486645 11.08544       7.172380 
1 1 1 17  10 17 o 24.41902 3.716331 7.472366       2.141798 7.880927       2.248198 3.459892       7.045504 25.07724 3.797643 22.06736 8.767933 3.009876       9.555037 
1 1 1 17  10 18 o 23.93122 4.030218 7.221979       2.266908 8.098384       2.392025 -0.5043395     7.102312 25.38045 3.999763 19.16658 8.289036 6.213873       9.203598 
1 1 1 17  10 19 o 135.3550 2.915678 224.3254       9.617230 222.4975       10.59216 232.9063       22.94945 134.7288 3.226175 136.2189 6.936348 -1.490112      7.649910 
1 1 1 17  10 20 o 10.95620 4.667227 0.1587746E-01  2.188963 -0.7988582     2.269373 10.90546       8.296657 10.23461 4.546615 29.47453 9.841985 -19.23992      10.84142 
1 1 1 17  10 21 o 32.63991 4.922933 13.51739       3.794024 12.61255       4.136264 18.31639       9.525739 31.32475 5.625297 36.60897 10.26535 -5.284220      11.70561 
1 1 1 17  10 22 o 69.24547 3.426407 59.24767       5.763887 58.90872       6.379566 60.75385       13.44802 68.93289 3.812619 67.92027 8.297031 1.012627       9.131089 
1 1 1 17  10 23 o 34.15801 3.990839 14.67407       3.259418 14.23020       3.471353 17.97984       9.473390 33.53304 4.350501 35.61060 10.32080 -2.077557      11.20026 
1 1 1 17  10 24 o 39.98911 4.005717 20.13346       3.851039 20.13346       3.851039 0.000000       0.000000 39.98911 4.005717 ?        ?        0.000000       4.005717 
1 1 1 17  10 25 o 35.23770 3.396267 15.58001       2.880301 15.39814       3.692499 15.86264       4.603119 34.66899 4.474889 34.72554 5.632395 -0.5654907E-01 7.193644 
1 1 1 17  10 26 o 12.57137 4.888546 1.382689       2.149612 4.978526       3.008010 -2.370339      3.073055 19.32490 5.870667 10.61413 4.932045 8.710770       7.667450 
1 1 1 17  10 27 f 22.78081 4.475253 6.870903       2.395740 8.159535       3.296128 5.427714       3.488199 24.39091 5.655668 19.94846 6.363996 4.442450       8.513930 
1 1 1 17  10 28 f 19.77153 4.924208 5.341619       2.363532 7.639267       3.162154 2.433054       3.557793 23.39984 5.616838 15.70983 6.234270 7.690001       8.391364 
1 1 1 17  10 29 o 17.27999 5.252097 4.148495       2.407107 4.720316       3.205848 3.409480       3.644515 18.31149 6.117971 16.70715 6.400012 1.604342       8.853797 
1 1 1 17  10 30 o 25.94650 6.032021 9.984512       3.741424 15.06179       8.338614 8.704706       4.186493 27.56704 9.835319 23.56785 6.869843 3.999191       11.99701 
1 1 1 17  10 31 o 16.12714 5.565743 3.702185       2.655461 -3.239995      3.520107 12.86988       4.045182 10.44001 4.979239 29.39369 5.853165 -18.95367      7.684553 
1 1 1 17  10 32 o 20.66583 6.078326 6.794978       3.264637 9.563930       4.140189 2.243120       5.308318 23.90179 6.790398 15.84707 7.001048 8.054721       9.753162 
1 1 1 17  10 33 o 12.28149 5.349183 0.9014674      3.001155 -0.1731221     4.347744 1.879519       4.147855 13.00864 5.981114 14.30326 6.257994 -1.294616      8.656570 
1 1 1 17  10 34 o 20.25992 6.034477 7.065195       3.201257 11.40527       4.307005 1.707936       4.785180 24.88003 6.875263 14.21285 6.433907 10.66718       9.416178 
1 1 1 17  10 35 o 10.51185 4.826412 -0.3615975     2.817500 -3.640309      3.613395 4.723553       4.500034 9.750994 4.746503 16.02076 6.752117 -6.269768      8.253508 
1 1 1 17  11 0  o 217.8245 3.798137 579.3853       20.16106 609.7946       29.63707 553.1917       27.50613 223.2104 5.448598 212.6227 5.308645 10.58763       7.607163 
1 1 1 17  11 1  o 29.44172 4.812734 10.87257       3.333770 14.63669       5.243976 8.319397       4.318864 33.97876 6.570793 25.59158 6.807287 8.387182       9.461209 
1 1 1 17  11 2  o 234.4496 5.598077 673.1053       31.98339 656.1738       43.16041 693.7270       47.63219 230.8487 7.682941 237.1801 8.253697 -6.331406      11.27613 
1 1 1 17  11 3  o 154.1294 3.016916 289.8911       11.33143 289.2862       15.38586 290.6080       16.75119 153.8148 4.108435 154.1173 4.464948 -0.3024445     6.067536 
1 1 1 17  11 4  o 76.67258 2.589597 71.79330       4.831530 67.05797       6.114397 79.66531       7.883541 74.03452 3.398154 80.64702 4.024121 -6.612503      5.266973 
1 1 1 17  11 5  o 141.3692 2.624414 243.8121       9.041139 243.4525       11.30254 244.4512       15.06591 141.2152 3.284419 141.3306 4.379732 -0.1154175     5.474437 
1 1 1 17  11 6  f 142.7546 2.954331 248.7174       10.27745 250.1115       11.50842 243.2265       22.83970 143.1248 3.299625 140.5359 6.688289 2.588882       7.457931 
1 1 1 17  11 7  o 190.7995 4.045393 445.0164       18.80936 427.8543       22.01463 491.4188       36.19891 186.8919 4.837824 199.5894 7.455659 -12.69748      8.887711 
1 1 1 17  11 8  o 179.6410 3.786357 394.3852       16.57537 383.0294       19.15343 428.2566       33.07914 176.8802 4.447087 186.3013 7.300354 -9.421066      8.548202 
1 1 1 17  11 9  o 149.2885 3.434060 272.2640       12.49311 274.5710       14.50526 265.6359       24.58651 149.8011 3.977030 146.7261 6.895570 3.074997       7.960254 
1 1 1 17  11 10 o 129.6665 2.937433 205.2817       9.281792 200.3266       11.45123 214.7724       15.84815 127.9658 3.675975 132.2956 4.924428 -4.329803      6.145144 
1 1 1 17  11 11 o 38.12819 3.170028 17.88004       2.918789 18.75940       3.192170 13.39578       7.208580 39.03558 3.389306 32.32569 8.879687 6.709896       9.504538 
1 1 1 17  11 12 o 259.3391 4.282525 823.6187       27.06476 836.2928       36.73028 808.5624       40.03337 260.7903 5.779587 256.0802 6.420259 4.710022       8.638481 
1 1 1 17  11 13 o 128.6368 3.067730 202.1930       9.616530 204.1306       12.19197 199.0026       15.64422 129.0848 3.880215 127.2115 5.056588 1.873367       6.373786 
1 1 1 17  11 14 o 97.42075 3.930194 116.4080       9.311275 124.0799       14.58939 111.1353       12.09489 100.1530 6.005323 94.93826 5.248288 5.214722       7.975489 
1 1 1 17  11 15 o 34.55972 6.619301 15.25534       5.371750 16.78914       7.656201 13.76824       7.538763 35.93089 8.812225 32.65079 9.123771 3.280098       12.68458 
1 1 1 17  11 16 o 26.97281 7.707591 9.306204       5.318844 4.910585       7.125241 14.83815       7.993347 23.41308 8.953730 33.77567 9.378808 -10.36259      12.96655 
1 1 1 17  11 17 o 38.88106 6.212998 19.18707       5.688686 18.66732       7.850485 19.76174       8.254767 37.77130 8.707352 38.83596 8.911708 -1.064655      12.45939 
1 1 1 17  11 18 o 29.89503 6.973291 11.60091       4.986536 6.927080       6.545281 18.06634       7.698228 24.72143 8.724237 37.06879 8.676421 -12.34736      12.30417 
1 1 1 17  11 19 o 35.94640 3.299967 15.98143       2.858460 15.13513       3.062283 21.71152       7.968234 34.91362 3.653290 40.67344 8.320023 -5.759823      9.086765 
1 1 1 17  11 20 o 65.83669 5.087595 54.13041       8.099095 55.33869       10.69927 52.50891       12.39451 65.97491 6.749902 63.64048 8.181100 2.334427       10.60620 
1 1 1 17  11 21 o 84.36550 4.814173 88.80253       9.856350 98.51963       13.47027 77.60457       14.46030 88.14986 6.312524 77.40378 7.771204 10.74609       10.01197 
1 1 1 17  11 22 o 116.9614 3.017787 168.4300       8.594173 168.4300       8.594173 0.000000       0.000000 116.9614 3.017787 ?        ?        0.000000       3.017787 
1 1 1 17  11 23 o 11.69525 4.688019 0.8804202      2.032005 0.8804202      2.032005 0.000000       0.000000 11.69525 4.688019 ?        ?        0.000000       4.688019 
1 1 1 17  11 24 o 46.97955 2.458057 27.22452       2.804293 24.19537       3.532189 32.38926       4.612205 44.05755 3.314233 50.85992 3.747638 -6.802368      5.002892 
1 1 1 17  11 25 o 38.40673 2.918018 18.37427       2.710622 19.46983       3.772204 17.20462       3.897670 39.17362 4.007964 36.62876 4.458361 2.544861       5.995061 
1 1 1 17  11 26 o 11.74482 4.850394 0.6914571      2.253696 0.4400541      2.370034 3.065279       7.282717 11.66278 4.906900 20.39881 8.593081 -8.736034      9.895388 
1 1 1 17  11 27 o 24.88399 4.020916 8.077170       2.355156 8.626874       3.221317 7.445909       3.452026 25.12738 5.420221 23.06360 6.063147 2.063784       8.132684 
1 1 1 17  11 28 o 13.34484 4.868429 2.063538       2.057019 1.814840       2.688991 2.414387       3.193847 13.79033 5.436415 15.20159 5.945139 -1.411253      8.056009 
1 1 1 17  11 29 o 39.54366 3.135985 20.00325       2.997218 18.17610       3.807332 22.98085       4.860336 36.92091 4.312822 41.01465 4.963724 -4.093739      6.575636 
1 1 1 17  11 30 o 21.65190 4.797345 6.595204       2.464586 6.335820       3.117265 7.027672       4.025121 20.59728 5.905365 21.16105 6.844545 -0.5637760     9.039974 
1 1 1 17  11 31 o 18.18842 5.472977 4.927954       2.623092 3.591800       3.499644 6.640965       3.962559 16.21127 6.255597 20.24682 6.802319 -4.035551      9.241429 
1 1 1 17  11 32 o 12.73485 5.725839 0.1789578      3.716173 0.000000       0.000000 0.1789578      3.716173 ?        ?        12.73485 5.725839 0.000000       5.725839 
1 1 1 17  11 33 o 10.25271 4.733489 -0.9309905     2.763199 2.335432       3.363200 -7.715831      4.847148 14.01643 5.867852 10.22828 5.077168 3.788151       7.759467 
1 1 1 17  11 34 o 14.10348 5.524695 2.941134       2.761829 4.065593       3.525509 1.154814       4.443544 15.65730 6.208326 13.52345 6.152614 2.133854       8.740594 
1 1 1 17  11 35 o 22.43332 5.555893 8.444764       3.021250 7.417501       3.838521 10.11731       4.897929 19.32372 6.690598 21.20257 7.540706 -1.878851      10.08099 
1 1 1 17  12 0  f 79.55430 3.084796 77.34602       5.969011 67.87792       9.730171 83.05907       7.558288 74.27149 5.413203 82.38500 3.774807 -8.113510      6.599389 
1 1 1 17  12 1  o 77.87140 3.450520 74.17404       6.531588 72.50845       9.700614 75.55539       8.834183 76.79729 5.214354 78.47270 4.640395 -1.675415      6.980168 
1 1 1 17  12 2  o 89.84644 2.818077 98.58586       6.162436 96.16598       11.01443 99.68851       7.435023 88.49699 5.129354 90.30196 3.384686 -1.804970      6.145435 
1 1 1 17  12 3  o 68.45070 2.456682 57.22369       4.091269 52.05704       5.494525 63.65294       6.129226 65.20353 3.470485 72.11682 3.498085 -6.913292      4.927561 
1 1 1 17  12 4  o 70.05006 2.453857 59.92789       4.182372 61.58663       5.757617 58.07483       6.085531 70.94519 3.339676 68.86015 3.639481 2.085045       4.939560 
1 1 1 17  12 5  o 27.40130 4.083237 9.376847       2.643406 11.54759       3.271029 5.290602       4.487892 30.39347 4.556670 21.46374 7.239326 8.929733       8.554009 
1 1 1 17  12 6  o 181.4392 3.074443 401.8680       13.59357 408.3796       21.01067 397.1798       17.82756 182.6100 4.725464 180.2523 4.058588 2.357620       6.229136 
1 1 1 17  12 7  o 104.1216 2.517377 132.2697       6.387416 133.2935       7.535780 129.6570       12.03771 104.4555 2.963466 102.7968 4.818800 1.658752       5.657116 
1 1 1 17  12 8  o 102.9298 2.501889 129.2654       6.275456 129.9441       7.346085 127.4325       12.07171 103.1325 2.925926 101.8882 4.876085 1.244354       5.686585 
1 1 1 17  12 9  o 53.92611 2.584004 35.56907       3.385811 34.06748       3.727433 42.65279       8.095913 52.74497 2.911256 58.66751 5.736012 -5.922539      6.432515 
1 1 1 17  12 10 o 143.7673 2.733166 252.3092       9.575517 260.5573       11.55953 234.2737       17.09341 146.0424 3.248067 138.1264 5.086961 7.916016       6.035488 
1 1 1 17  12 11 o 214.7892 4.592180 565.3079       24.03629 508.7047       37.85010 603.5610       31.11573 202.5908 7.680660 221.5038 5.769426 -18.91302      9.606187 
1 1 1 17  12 12 o 153.2922 4.006600 287.8533       14.95408 251.8908       22.85838 314.7606       19.77225 142.7323 6.589623 160.0461 5.076033 -17.31384      8.318007 
1 1 1 17  12 13 o 77.34246 4.094402 73.47321       7.689437 79.06010       11.46269 68.90205       10.36847 79.89706 5.929618 74.59678 5.748020 5.300285       8.258335 
1 1 1 17  12 14 o 54.22811 4.806481 36.39053       6.285953 40.04612       9.078723 33.02431       8.711975 56.51384 6.723936 51.13776 7.189225 5.376083       9.843591 
1 1 1 17  12 15 o 180.2869 5.129404 400.3840       22.51259 381.3113       30.16362 424.3683       33.82529 175.0751 7.084692 184.4602 7.540835 -9.385101      10.34684 
1 1 1 17  12 16 o 68.88966 4.398750 58.54482       7.345893 66.85283       10.92937 51.69912       9.921006 73.21555 6.183452 64.25972 6.421405 8.955833       8.914568 
1 1 1 17  12 17 o 45.48388 5.563968 25.95687       6.038805 35.58303       8.807712 17.41757       8.295597 52.97603 6.993196 36.35004 9.321338 16.62599       11.65299 
1 1 1 17  12 18 o 45.40353 5.600968 25.93749       6.065879 36.57867       8.756027 16.11782       8.411252 53.66920 6.850908 34.87846 9.596205 18.79073       11.79076 
1 1 1 17  12 19 o 70.52948 4.570624 61.72161       7.813348 82.27076       11.96224 46.43162       10.31856 80.93194 6.110496 60.30635 7.160978 20.62558       9.413701 
1 1 1 17  12 20 o 39.09996 8.557652 20.41909       7.927048 20.41909       7.927048 0.000000       0.000000 39.09996 8.557652 ?        ?        0.000000       8.557652 
1 1 1 17  12 21 o 93.66360 6.260106 111.4495       14.20653 111.4495       14.20653 0.000000       0.000000 93.66360 6.260106 ?        ?        0.000000       6.260106 
1 1 1 17  12 22 o 22.03359 7.795512 5.770844       5.228576 5.105472       6.500309 6.990337       8.800169 22.34945 8.550805 25.67871 9.916883 -3.329254      13.09431 
1 1 1 17  12 23 o 20.90519 7.804476 4.823125       5.338907 11.03433       7.044997 -3.556426      8.182826 28.34361 9.044404 18.19678 8.305913 10.14683       12.27963 
1 1 1 17  12 24 o 26.32821 4.436462 8.950559       2.745308 8.486738       2.909611 12.71292       8.286861 25.48771 4.861913 29.75087 9.833198 -4.263161      10.96950 
1 1 1 17  12 25 o 21.68441 3.852373 6.070890       1.961112 6.402906       2.028862 1.347137       7.652730 22.27543 3.878411 19.81053 8.585811 2.464901       9.421159 
1 1 1 17  12 26 o 18.56914 3.828243 4.509509       1.674726 5.823179       2.159759 2.528461       2.652221 20.99122 4.364619 14.99490 5.518664 5.996327       7.036019 
1 1 1 17  12 27 o 19.70902 4.267112 5.179650       1.989944 7.820104       2.735790 2.213169       2.899775 24.08867 4.828806 14.70315 5.688742 9.385524       7.461846 
1 1 1 17  12 28 o 10.61663 4.555325 0.1965176      2.112640 -0.6330859     2.192667 10.94336       7.891834 9.869287 4.420902 25.40484 9.487821 -15.53555      10.46724 
1 1 1 17  12 29 o 18.26443 5.210506 4.742834       2.432719 4.834167       2.556019 3.864094       7.928277 18.38778 5.370157 19.53852 8.596969 -1.150742      10.13639 
1 1 1 17  12 30 o 14.70064 4.953646 2.949094       2.101346 3.116398       2.793387 2.731003       3.189319 15.34338 5.660722 15.10699 5.931196 0.2363911      8.198955 
1 1 1 17  12 31 o 22.74717 4.444958 7.271978       2.375566 7.987171       3.037607 6.145764       3.811804 23.09763 5.479810 19.49025 6.670441 3.607386       8.632676 
1 1 1 17  12 32 o 15.18262 5.439723 3.389348       2.553536 5.239625       3.469836 1.203380       3.771485 17.88367 6.348246 13.53212 5.942611 4.351548       8.695680 
1 1 1 17  12 33 o 18.22792 5.541210 5.389350       2.679246 8.023846       3.654816 2.328924       3.939198 21.30736 6.470771 14.29017 6.176632 7.017187       8.945483 
1 1 1 17  12 34 o 16.48838 6.773262 4.969252       4.364051 2.172446       9.485544 5.720197       4.915133 15.95341 7.748420 17.10179 7.121599 -1.148380      10.52403 
1 1 1 17  12 35 o 8.175531 3.947711 -2.508562      2.372376 -2.416404      2.930060 -2.683967      4.042296 9.254203 4.447912 10.68582 5.158184 -1.431620      6.811078 
1 1 1 17  13 0  o 233.5235 4.521133 666.7319       25.72847 669.5265       44.13121 665.2929       31.66688 233.1085 7.779659 233.0644 5.575621 0.4403687E-01  9.571344 
1 1 1 17  13 1  o 228.6876 4.581301 639.5206       25.53098 647.5253       42.64867 635.0498       31.87301 229.2573 7.644588 227.5801 5.751762 1.677200       9.566739 
1 1 1 17  13 2  o 165.8340 3.251749 335.7135       13.14095 329.4050       24.89750 338.1495       15.47145 163.7383 6.251266 166.3757 3.815970 -2.637466      7.323930 
1 1 1 17  13 3  o 44.16574 3.498446 23.96906       3.734540 26.56553       6.379617 22.61547       4.606251 46.19640 5.794072 42.77123 4.486039 3.425171       7.327743 
1 1 1 17  13 4  o 105.4651 2.505538 135.6890       6.439404 135.5210       7.676082 136.0883       11.83066 105.3304 2.993577 105.3687 4.618677 -0.3831482E-01 5.503969 
1 1 1 17  13 5  o 74.92236 2.544877 68.56274       4.639632 79.60242       6.690348 58.33480       6.439690 80.66251 3.411320 68.98493 3.845893 11.67758       5.140817 
1 1 1 17  13 6  o 70.54890 2.284060 60.77310       3.921581 61.28753       4.954936 59.91059       6.415836 70.80316 2.877764 69.91602 3.779707 0.8871384      4.750549 
1 1 1 17  13 7  o 86.56349 2.475666 91.49767       5.216949 89.72982       5.976834 97.15424       10.69117 85.69092 2.866236 88.92157 4.953380 -3.230652      5.722874 
1 1 1 17  13 8  o 88.42079 2.448163 95.46645       5.270024 96.55906       6.055524 92.05544       10.69945 88.89649 2.798804 86.51215 5.097739 2.384338       5.815517 
1 1 1 17  13 9  o 138.3827 3.850491 234.3612       12.97214 232.6289       20.72880 235.4764       16.63134 137.3876 6.207458 138.5164 4.934971 -1.128754      7.930100 
1 1 1 17  13 10 o 58.82217 4.296301 42.58699       6.115988 55.26371       9.583113 33.87543       7.944216 66.77732 5.951293 52.06924 6.394999 14.70808       8.735783 
1 1 1 17  13 11 o 87.37373 3.927284 93.61534       8.340609 87.42146       12.32273 98.85188       11.33045 84.05260 6.056778 89.57561 5.213174 -5.523018      7.991354 
1 1 1 17  13 12 o 171.3312 4.986969 360.7140       20.79921 375.8362       28.97472 344.6375       29.87498 174.2464 6.836963 166.6314 7.375510 7.614960       10.05695 
1 1 1 17  13 13 o 85.49432 4.047595 89.74334       8.408827 96.23549       12.76855 84.77139       11.17407 88.15242 5.979284 82.80186 5.570182 5.350563       8.171827 
1 1 1 17  13 14 o 226.5518 4.803282 630.7493       26.51806 593.6078       42.53390 654.3658       33.91674 217.9899 8.020543 230.1020 6.053896 -12.11211      10.04882 
1 1 1 17  13 15 o 134.3607 4.646331 222.2137       15.19023 207.9971       20.13135 241.0094       23.14754 129.3956 6.404256 139.1203 6.848812 -9.724640      9.376605 
1 1 1 17  13 16 o 104.3181 4.614579 134.1861       11.70177 143.7076       15.78376 122.5653       17.43709 107.5120 6.048848 98.80876 7.293132 8.703209       9.475143 
1 1 1 17  13 17 o 27.10258 8.527745 9.261686       6.282408 14.61934       6.967678 -14.02707      14.52693 33.35509 8.537212 22.09659 10.41305 11.25850       13.46535 
1 1 1 17  13 18 o 22.03072 8.442003 4.457781       6.342522 7.843156       7.137610 -8.248573      13.82802 25.94501 9.114260 23.15426 10.65346 2.790754       14.02020 
1 1 1 17  13 19 o 112.2178 4.624856 156.1781       12.62015 147.1580       16.70178 168.1818       19.26700 108.0758 6.369835 115.2431 6.892102 -7.167313      9.384874 
1 1 1 17  13 20 o 15.14527 6.666334 -0.9892569     4.771167 -2.836465      5.977633 2.253316       7.919838 15.86885 7.186539 21.69342 9.037331 -5.824571      11.54641 
1 1 1 17  13 21 o 69.46029 6.472770 61.89292       10.83016 61.89292       10.83016 0.000000       0.000000 69.46029 6.472770 ?        ?        0.000000       6.472770 
1 1 1 17  13 22 o 36.31668 7.027164 17.58882       5.994166 15.19079       7.823729 20.99701       9.327130 32.92581 9.327947 38.40687 9.902192 -5.481056      13.60382 
1 1 1 17  13 23 o 54.40976 5.386164 38.04136       7.047935 47.50181       9.815040 27.97029       10.12684 59.95369 6.840235 44.10343 9.687905 15.85027       11.85936 
1 1 1 17  13 24 o 17.49403 7.151281 2.186746       4.834805 3.599276       6.399621 0.3085465      7.379489 20.37867 8.265899 19.03649 8.337542 1.342184       11.74051 
1 1 1 17  13 25 o 25.58696 7.690416 9.337069       5.181415 8.990933       6.742321 9.836360       8.097730 25.22843 8.858620 26.29588 9.648827 -1.067448      13.09866 
1 1 1 17  13 26 f 15.71817 6.775243 0.7731744      4.714317 3.473703       6.363060 -2.513043      7.019236 19.60020 8.127430 16.50706 7.593288 3.093142       11.12264 
1 1 1 17  13 27 o 33.77069 4.001950 14.84827       3.229484 13.03362       3.434226 28.72019       9.495117 31.27325 4.647371 41.82772 9.528842 -10.55447      10.60174 
1 1 1 17  13 28 o 18.16704 5.638186 4.666421       2.756097 0.000000       0.000000 4.666421       2.756097 ?        ?        18.16704 5.638186 0.000000       5.638186 
1 1 1 17  13 29 o 13.91440 4.502411 2.595368       1.741621 4.744252       2.266552 -0.5025585     2.721415 18.29173 4.960650 10.99517 4.925212 7.296551       6.990405 
1 1 1 17  13 30 o 9.935017 4.248362 0.3059924      1.826041 0.2892529      2.455502 0.3267031      2.731282 11.17408 4.852989 11.69642 5.098552 -0.5223398     7.038944 
1 1 1 17  13 31 o 12.82959 5.073514 1.851748       2.348608 2.107564       2.501221 -0.5472885E-01 6.828166 13.35435 5.249689 15.60989 7.286285 -2.255541      8.980489 
1 1 1 17  13 32 o 13.50067 4.951784 2.514057       2.132388 1.393659       2.692348 4.399766       3.492870 12.43694 5.231110 16.61134 6.288712 -4.174398      8.180000 
1 1 1 17  13 33 o 27.13525 4.328555 10.67059       2.766185 11.11872       3.470916 9.890475       4.579543 26.37148 5.575589 22.36858 7.305566 4.002897       9.190130 
1 1 1 17  13 34 o 11.04401 4.973497 0.2414224      2.816364 -2.250756      3.642990 3.943609       4.440150 10.49865 5.023074 15.41500 6.608891 -4.916349      8.301126 
1 1 1 17  14 0  o 171.7285 3.301346 360.0235       13.81559 339.2144       26.16080 368.0715       16.26933 166.1124 6.475086 173.5774 3.846274 -7.465073      7.531306 
1 1 1 17  14 1  o 165.2966 4.663024 334.4979       18.76435 357.9393       26.07571 309.3220       27.02325 170.6706 6.280332 158.4713 7.015016 12.19937       9.415573 
1 1 1 17  14 2  o 271.6889 4.432725 902.7146       29.34801 931.1047       58.38159 893.1145       33.94934 274.3398 8.743915 270.0644 5.158553 4.275452       10.15218 
1 1 1 17  14 3  o 52.38816 3.404776 33.65627       4.323134 31.91343       5.261587 37.27755       7.584372 50.90978 4.280723 54.83992 5.761204 -3.930141      7.177468 
1 1 1 17  14 4  o 119.6578 2.531102 174.6819       7.380516 174.0070       10.63004 175.3099       10.25529 119.2869 3.661176 119.7496 3.518105 -0.4627457     5.077526 
1 1 1 17  14 5  o 91.86205 2.233407 102.9276       4.999655 105.3534       6.520457 99.46652       7.788493 92.86134 2.884923 90.16318 3.551719 2.698166       4.575750 
1 1 1 17  14 6  o 118.0826 2.565504 170.1408       7.382353 172.5901       8.830148 164.4540       13.45502 118.8549 3.051223 115.7883 4.778790 3.066628       5.669815 
1 1 1 17  14 7  o 65.23756 2.511110 52.00894       3.984629 53.88079       4.490378 45.07513       8.642379 66.38112 2.782058 60.28767 5.960512 6.093445       6.577807 
1 1 1 17  14 8  o 33.50095 6.228257 14.23806       4.897530 5.525358       6.628701 24.71126       7.267613 23.64613 8.720753 44.25408 6.969368 -20.60794      11.16350 
1 1 1 17  14 9  o 156.6038 4.035996 300.2989       15.38959 306.3654       24.98021 296.5879       19.53762 157.5587 6.520143 155.3884 5.166798 2.170334       8.319138 
1 1 1 17  14 10 o 24.77632 7.335444 7.708053       4.741720 8.017064       6.610724 7.380601       6.805111 26.14038 8.786078 25.60765 8.906091 0.5327358      12.51054 
1 1 1 17  14 11 o 35.21952 6.396346 15.75967       5.287599 12.51399       7.258360 19.42983       7.718415 31.29715 9.023001 38.80038 8.406520 -7.503233      12.33224 
1 1 1 17  14 12 f 140.3884 4.005106 241.5972       13.68792 264.0181       22.49801 228.4204       17.24731 146.1133 6.333608 136.2192 5.205313 9.894073       8.198163 
1 1 1 17  14 13 o 62.52747 5.548285 48.53343       8.366391 56.01216       10.04240 31.56654       15.12602 67.05798 6.216166 48.61320 12.64903 18.44478       14.09393 
1 1 1 17  14 14 o 42.01204 7.295156 22.56209       7.197889 31.67037       8.391331 -2.802112      14.00307 50.01011 7.083535 25.81962 11.39041 24.19049       13.41335 
1 1 1 17  14 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  14 16 o 141.4938 4.750326 247.0793       16.35613 242.3763       21.92025 252.9868       24.56758 139.3842 6.471168 142.0626 7.119225 -2.678375      9.620778 
1 1 1 17  14 17 o 44.45002 5.551016 24.87918       5.882148 23.44782       8.126756 26.45416       8.524734 42.37793 8.165505 45.11484 8.049294 -2.736904      11.46589 
1 1 1 17  14 18 o 104.6106 4.579111 135.5741       11.64500 131.4688       15.49411 140.9033       17.65341 102.2901 6.245566 105.5615 6.900401 -3.271324      9.307128 
1 1 1 17  14 19 f 15.01512 6.741004 -2.059151      5.129293 -2.637545      6.649325 -1.209206      8.060491 17.01228 7.653246 19.71148 8.670881 -2.699207      11.56531 
1 1 1 17  14 20 f 46.53300 5.990652 27.72911       6.635719 30.99659       9.075158 23.97508       9.727406 48.39864 7.971891 41.67808 9.751651 6.720558       12.59547 
1 1 1 17  14 21 o 65.03056 4.931831 53.31437       7.757317 53.54528       10.33400 53.01630       11.74125 64.28595 6.694499 63.32937 7.770720 0.9565773      10.25673 
1 1 1 17  14 22 o 65.34886 5.038123 54.24282       7.961212 50.81400       10.43453 59.01928       12.31554 62.07423 7.021149 66.41158 7.755644 -4.337353      10.46167 
1 1 1 17  14 23 o 63.87618 4.927298 52.10913       7.610555 45.86488       9.832494 61.44080       12.01995 58.54298 7.032761 67.51089 7.428856 -8.967911      10.22974 
1 1 1 17  14 24 o 40.10295 6.873881 21.98570       6.475986 24.59008       8.527506 18.43717       9.953915 41.13481 8.774745 34.23315 10.72894 6.901661       13.86024 
1 1 1 17  14 25 o 19.63762 7.480557 4.541851       4.960946 5.736698       6.526503 2.906735       7.634820 21.80769 8.507280 20.43038 8.710210 1.377304       12.17545 
1 1 1 17  14 26 f 42.22795 6.395930 24.87038       6.375894 19.64373       8.586164 31.29532       9.519670 34.46894 9.774188 44.84456 9.023970 -10.37562      13.30289 
1 1 1 17  14 27 o 23.12486 9.289998 8.017269       7.998006 0.000000       0.000000 8.017269       7.998006 ?        ?        23.12486 9.289998 0.000000       9.289998 
1 1 1 17  14 28 o 25.01501 7.983696 10.32722       5.489257 7.942879       7.437334 13.18023       8.135529 22.24683 8.951079 26.49422 9.679398 -4.247389      13.18380 
1 1 1 17  14 29 o 17.91539 4.969379 4.579271       2.245403 10.00677       8.529342 4.175114       2.327504 23.09037 9.475451 17.09055 5.158220 5.999826       10.78849 
1 1 1 17  14 30 o 14.55292 5.296553 2.844731       2.432644 -4.213340      7.637430 3.641638       2.566303 14.86969 7.155682 15.92297 5.472465 -1.053286      9.008422 
1 1 1 17  14 31 o 11.50814 4.342887 1.572207       1.662710 2.309996       2.153070 0.4821056      2.617133 13.28507 4.956872 11.44438 4.989742 1.840699       7.033357 
1 1 1 17  14 32 o 13.62451 4.953421 2.636982       2.126879 6.293037       2.954235 -1.297130      3.064517 19.59987 5.786732 10.48181 4.888876 9.118057       7.575445 
1 1 1 17  14 33 o 10.77358 4.788876 0.2901384      2.521413 0.2901384      2.521413 0.000000       0.000000 10.77358 4.788876 ?        ?        0.000000       4.788876 
1 1 1 17  14 34 o 16.38024 5.243899 4.432304       2.366786 7.218050       2.926398 -0.8358231     4.024303 20.56671 5.660915 11.68704 5.499227 8.879670       7.892240 
1 1 1 17  15 0  o 68.89121 4.544641 58.30106       7.586943 58.70822       9.346924 57.51468       12.98983 68.98683 5.608225 67.84372 8.011361 1.143112       9.779268 
1 1 1 17  15 1  f 166.2747 3.274908 337.5625       13.26971 358.2720       26.26684 330.4660       15.37609 170.7052 6.325234 164.4545 3.836756 6.250748       7.397924 
1 1 1 17  15 2  o 118.2886 4.190458 171.2936       12.06018 184.2615       16.32309 155.7050       17.89667 122.4890 5.482405 112.3781 6.563704 10.11087       8.552132 
1 1 1 17  15 3  o 203.7606 3.262799 506.9811       16.20118 528.8871       25.62930 492.4018       20.90857 207.7987 5.061250 200.6529 4.276049 7.145752       6.625771 
1 1 1 17  15 4  o 73.90958 2.490211 66.72272       4.478704 57.72028       6.086160 77.35587       6.614459 68.63326 3.652069 79.50637 3.421955 -10.87311      5.004736 
1 1 1 17  15 5  o 307.4660 3.957929 1155.907       29.65522 1129.351       40.72159 1185.894       43.27216 303.4169 5.507427 310.8401 5.712622 -7.423126      7.935100 
1 1 1 17  15 6  o 76.55640 2.229554 71.55537       4.155016 75.95596       5.300966 64.54430       6.691008 78.83590 2.763549 72.56137 3.797204 6.274529       4.696377 
1 1 1 17  15 7  o 44.75851 3.267580 24.60346       3.539448 22.56405       3.978161 32.35013       7.753325 42.78276 3.857104 50.88239 6.393765 -8.099628      7.467093 
1 1 1 17  15 8  o 48.97387 4.788713 29.67597       5.642092 28.90364       8.252259 30.35388       7.731429 47.84430 7.309496 49.20288 6.615600 -1.358582      9.858747 
1 1 1 17  15 9  o 94.00614 4.755862 108.6416       10.85946 126.7250       14.32197 84.18327       16.65619 101.3317 5.824448 81.87856 8.469893 19.45314       10.27927 
1 1 1 17  15 10 o 107.0259 4.760041 140.7961       12.38362 155.9419       16.17639 119.3537       19.24738 112.3827 5.927678 97.67331 8.161006 14.70938       10.08659 
1 1 1 17  15 11 o 83.02230 4.972643 84.95355       10.01436 93.73602       12.40439 68.51560       16.97037 87.03044 5.883399 73.28692 9.743479 13.74352       11.38199 
1 1 1 17  15 12 o 51.49953 6.279318 33.23402       7.717723 47.15863       9.332500 3.109612       13.72669 61.46412 6.320740 28.47845 11.88345 32.98567       13.45987 
1 1 1 17  15 13 o 28.29228 7.406080 10.32941       5.164877 16.62018       7.198733 3.655844       7.414524 35.74118 8.406890 22.65940 8.997384 13.08178       12.31376 
1 1 1 17  15 14 o 29.94217 7.361678 11.62076       5.333206 18.41279       7.532419 4.793004       7.552204 37.57954 8.432920 23.69350 9.176944 13.88605       12.46316 
1 1 1 17  15 15 f 91.71367 4.602944 103.8379       10.25452 117.5709       14.11577 88.49151       14.92195 97.17837 5.989832 83.77615 7.384706 13.40222       9.508521 
1 1 1 17  15 16 o 41.38922 5.747766 21.65378       5.641019 25.90335       7.893912 17.21909       8.064019 44.83688 7.488649 36.04442 9.162420 8.792454       11.83342 
1 1 1 17  15 17 o 28.52491 7.288150 10.65415       5.084136 10.31869       6.703689 11.10835       7.800394 28.31163 8.794326 29.49759 9.527183 -1.185959      12.96562 
1 1 1 17  15 18 o 24.33905 7.718999 7.514282       5.138007 7.512268       6.997835 7.516637       7.568102 25.35902 9.013952 25.73609 9.345764 -0.3770695     12.98440 
1 1 1 17  15 19 o 71.48344 4.910470 63.96560       8.501945 58.23590       11.34993 71.29099       12.83341 67.25916 7.028393 74.40310 7.166635 -7.143944      10.03788 
1 1 1 17  15 20 o 91.77096 4.696740 105.4213       10.46866 96.78786       14.06950 116.1297       15.66920 86.73279 6.708819 94.96410 6.816316 -8.231316      9.564016 
1 1 1 17  15 21 o 78.30381 4.680729 77.18182       8.890903 83.32025       12.32215 70.51540       12.84118 80.31303 6.347571 73.18740 7.297146 7.125633       9.671608 
1 1 1 17  15 22 o 38.68081 6.672715 19.98398       6.062591 15.52143       7.682477 27.35059       9.870605 32.89336 9.217143 43.61401 9.552161 -10.72065      13.27402 
1 1 1 17  15 23 o 55.53032 5.392889 40.02382       7.205938 44.80952       9.878053 34.58025       10.53513 57.46467 7.212443 48.90577 9.176801 8.558899       11.67189 
1 1 1 17  15 24 o 19.80892 7.695354 4.316056       5.322607 0.6171289      6.949308 9.565393       8.278582 18.47151 8.090466 26.06777 9.721073 -7.596252      12.64733 
1 1 1 17  15 25 o 17.70898 7.979795 -0.7245700     7.262729 0.000000       0.000000 -0.7245700     7.262729 ?        ?        17.70898 7.979795 0.000000       7.979795 
1 1 1 17  15 26 o 39.09003 6.737877 21.92401       6.186676 24.55382       8.154647 18.35759       9.496392 39.47482 8.710940 31.93627 10.52512 7.538546       13.66231 
1 1 1 17  15 27 f 26.04400 7.776885 10.82020       5.311623 8.269816       6.895379 14.54209       8.329842 22.81866 8.787260 28.10729 9.848207 -5.288626      13.19860 
1 1 1 17  15 28 o 37.95464 7.291817 22.44896       6.499262 18.90977       9.187004 25.99484       9.195690 30.39005 10.35669 37.14200 9.957138 -6.751945      14.36683 
1 1 1 17  15 29 o 30.11573 8.167788 15.85972       6.144425 19.50839       8.967441 12.63074       8.435952 29.99532 10.23198 24.63138 9.653535 5.363939       14.06713 
1 1 1 17  15 30 o 23.21687 9.330278 11.93173       8.070560 0.000000       0.000000 11.93173       8.070560 ?        ?        23.21687 9.330278 0.000000       9.330278 
1 1 1 17  15 31 o 15.52191 4.998231 3.590557       2.147994 15.61058       9.005502 2.865464       2.211833 24.02301 9.782696 14.18685 5.065016 9.836154       11.01615 
1 1 1 17  15 32 o 10.68428 4.390144 1.044534       1.833996 4.165545       2.694712 -1.648603      2.503190 16.10765 5.604219 9.178225 4.324416 6.929426       7.078690 
1 1 1 17  15 33 f 9.597328 4.467196 -1.031777      2.537938 -1.255935      8.230932 -1.008226      2.667930 14.55779 7.103431 9.843043 4.581096 4.714746       8.452525 
1 1 1 17  16 0  o 52.71585 5.263929 34.37915       6.671870 37.82798       8.193745 27.59330       11.49342 55.16972 6.201894 46.20581 10.45273 8.963909       12.15414 
1 1 1 17  16 1  o 38.58604 4.157522 18.41402       3.847692 17.96586       7.105088 18.60000       4.576908 37.45649 8.025553 38.66031 4.973215 -1.203819      9.441524 
1 1 1 17  16 2  o 125.9405 2.954163 193.6157       9.066423 183.4008       12.34519 205.5760       13.35838 122.3945 4.145024 129.5774 4.236162 -7.182915      5.926744 
1 1 1 17  16 3  o 97.97617 3.022068 117.3084       7.206778 105.2579       8.870111 140.7133       12.36174 92.70416 3.935345 107.0954 4.748474 -14.39120      6.167248 
1 1 1 17  16 4  o 222.8822 4.464910 608.0400       24.25069 566.0188       40.36470 631.7744       30.33584 213.9313 7.755516 226.9283 5.485689 -12.99706      9.499516 
1 1 1 17  16 5  o 166.6291 2.837872 338.9591       11.52338 333.8813       14.38570 348.0512       19.24976 165.2831 3.571631 168.5029 4.692506 -3.219833      5.897131 
1 1 1 17  16 6  o 219.8185 3.353824 590.4319       17.96555 566.8927       22.23026 634.7522       30.50353 215.2096 4.238838 227.3730 5.505225 -12.16339      6.948040 
1 1 1 17  16 7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  16 8  o 158.7686 4.065553 308.7927       15.71675 294.2361       24.87599 318.4638       20.27633 154.2918 6.631573 160.9713 5.175707 -6.679520      8.412235 
1 1 1 17  16 9  o 66.02986 4.339036 53.65302       6.943148 61.27588       10.38977 47.50174       9.333179 70.25879 6.129641 61.76164 6.288817 8.497150       8.781897 
1 1 1 17  16 10 o 149.5905 4.765390 274.9424       17.34938 298.5645       24.38895 250.7429       24.68520 155.3576 6.456127 142.1047 7.151387 13.25291       9.634517 
1 1 1 17  16 11 o 20.62565 7.475268 4.412882       4.838678 4.851316       6.652065 3.920255       7.051214 22.93251 8.679307 22.52158 8.826015 0.4109325      12.37857 
1 1 1 17  16 12 o 112.2577 3.946005 154.6834       10.77789 153.0084       16.50962 155.9274       14.22807 111.0751 6.123052 112.4036 5.208494 -1.328514      8.038668 
1 1 1 17  16 13 o 81.04619 4.640203 81.05000       9.126131 83.58911       12.22123 77.84936       13.72120 81.92231 6.167045 78.72091 7.233435 3.201401       9.505526 
1 1 1 17  16 14 o 85.15005 4.580136 89.51404       9.468871 94.71708       12.72054 83.04855       14.18004 87.18849 6.024049 81.21059 7.241078 5.977898       9.419256 
1 1 1 17  16 15 o 41.34540 5.846509 21.62547       5.726438 26.73121       8.047732 16.38906       8.150049 45.57322 7.507694 35.18343 9.347831 10.38979       11.98947 
1 1 1 17  16 16 o 93.10032 4.553263 107.2937       10.29890 104.4875       13.68776 110.9554       15.63548 91.26772 6.190948 93.74564 6.892407 -2.477913      9.264616 
1 1 1 17  16 17 o 33.61692 7.080739 14.79401       5.617098 21.08811       7.897384 8.349816       7.990996 39.86250 8.395500 26.80650 9.620687 13.05600       12.76879 
1 1 1 17  16 18 o 119.3137 4.674529 177.1551       13.56510 172.8001       18.05566 182.7986       20.55417 116.7996 6.367683 119.6051 7.083758 -2.805435      9.525073 
1 1 1 17  16 19 o 51.11276 5.691254 33.29180       6.968719 38.69308       9.308183 26.40345       10.51172 54.48054 7.186184 43.49319 10.11031 10.98735       12.40402 
1 1 1 17  16 20 o 58.21751 5.092716 42.95645       7.152346 49.96632       9.957446 35.48486       10.28016 61.98533 6.698359 51.12150 8.553988 10.86383       10.86456 
1 1 1 17  16 21 o 36.56068 7.105585 18.01371       6.102554 16.44791       8.004880 20.18653       9.429747 33.92376 9.372481 37.19924 10.13079 -3.275475      13.80132 
1 1 1 17  16 22 o 42.24057 6.269303 23.69141       6.257850 25.63779       8.155719 20.90503       9.758173 42.86475 8.104590 37.17698 10.37724 5.687771       13.16706 
1 1 1 17  16 23 o 34.89870 10.58487 19.23022       9.783931 0.000000       0.000000 19.23022       9.783931 ?        ?        34.89870 10.58487 0.000000       10.58487 
1 1 1 17  16 24 o 32.60638 7.647813 15.43925       5.971089 15.20769       7.991567 15.73189       8.984096 31.05430 9.594623 31.16224 10.23567 -0.1079464     14.02946 
1 1 1 17  16 25 o 16.47370 7.053316 1.372092       5.044918 -1.118142      6.816364 4.388492       7.502001 16.83429 7.643745 20.85275 8.749051 -4.018461      11.61778 
1 1 1 17  16 26 o 30.83536 7.820331 14.81346       5.884120 18.07623       7.593581 9.910336       9.308733 32.76778 9.157037 24.63733 9.977937 8.130442       13.54292 
1 1 1 17  16 27 o 50.96336 5.915462 37.01728       7.210217 46.37309       9.952687 26.68383       10.45977 54.53109 7.703971 36.40237 10.92336 18.12872       13.36679 
1 1 1 17  16 28 o 19.68117 7.533092 5.928522       5.046463 11.90031       7.265157 0.3609491      7.014969 25.07291 9.149029 16.72380 7.655067 8.349108       11.92916 
1 1 1 17  16 29 o 17.82588 7.480443 4.266338       5.485692 5.113187       8.133859 3.559759       7.429746 19.31962 8.593605 18.20967 8.148821 1.109951       11.84286 
1 1 1 17  16 30 o 21.67468 9.276694 10.77224       8.720849 10.77224       8.720849 0.000000       0.000000 21.67468 9.276694 ?        ?        0.000000       9.276694 
1 1 1 17  16 31 o 19.57536 7.958637 7.878943       5.948877 8.946386       9.073504 7.074162       7.878463 19.55200 8.854345 18.71077 8.380816 0.8412342      12.19170 
1 1 1 17  16 32 o 15.62502 7.083299 3.126150       5.824892 7.833212       9.242523 0.2472183E-01  7.502335 18.25636 8.506791 14.92656 7.159359 3.329800       11.11854 
1 1 1 17  16 33 o 19.19594 7.850728 8.845912       5.830247 16.73221       9.089527 3.333224       7.599522 21.78500 9.399158 15.75086 7.455343 6.034145       11.99693 
1 1 1 17  17 0  o 94.81839 3.626567 110.0129       8.364173 103.3507       12.78704 114.9951       11.05792 91.59669 5.757803 96.80688 4.701448 -5.210182      7.433432 
1 1 1 17  17 1  o 52.38258 3.220053 33.63529       4.090554 27.40424       7.987481 35.85046       4.762475 46.62042 7.267574 54.04322 3.637410 -7.422806      8.127015 
1 1 1 17  17 2  o 212.3176 4.254159 551.5285       22.01081 521.0682       36.60940 568.7729       27.54542 205.4176 7.325120 215.3803 5.248162 -9.962723      9.011137 
1 1 1 17  17 3  o 105.5995 2.560383 136.0833       6.588746 128.0185       9.807796 142.7164       8.894759 102.2385 3.943995 108.0274 3.382982 -5.788956      5.196120 
1 1 1 17  17 4  o 89.63187 2.566698 98.12822       5.600489 105.9669       8.483153 92.07224       7.456391 93.02031 3.750029 86.72263 3.535670 6.297676       5.153996 
1 1 1 17  17 5  o 288.4397 3.769154 1017.477       26.49323 989.2020       36.15729 1050.255       38.93038 283.9201 5.225931 292.4547 5.462532 -8.534576      7.559736 
1 1 1 17  17 6  o 72.93612 2.510411 65.00677       4.455287 65.42476       6.236728 64.57119       6.366737 73.06897 3.512868 72.57794 3.611124 0.4910278      5.037902 
1 1 1 17  17 7  o 29.34047 7.249513 11.06492       5.152889 7.717706       7.191878 14.59582       7.386593 26.22147 9.153397 33.62708 8.882975 -7.405607      12.75507 
1 1 1 17  17 8  o 76.67207 4.057743 72.18747       7.554553 66.62255       11.17109 76.87718       10.25509 73.23527 6.321307 78.90712 5.365101 -5.671852      8.291154 
1 1 1 17  17 9  o 89.18009 4.456857 97.77779       9.655043 94.36311       12.91533 102.1036       14.53659 87.26064 6.112321 90.65537 6.625863 -3.394737      9.014573 
1 1 1 17  17 10 f 114.5882 3.957998 161.0894       11.03568 172.5470       17.41391 153.3995       14.26616 118.0601 6.073221 111.5218 5.264278 6.538292       8.037204 
1 1 1 17  17 11 o 60.57350 4.687625 45.36080       6.865644 46.36960       9.953767 44.44529       9.482353 60.76328 6.840911 59.52288 6.650799 1.240402       9.541027 
1 1 1 17  17 12 o 40.25192 5.898060 20.44740       5.613778 22.46320       7.998821 18.49072       7.880660 41.65885 8.171275 37.60608 8.762517 4.052773       11.98130 
1 1 1 17  17 13 o 163.0993 4.940848 328.3339       19.61501 319.0040       26.53114 339.5814       29.13031 159.8344 6.827333 164.6473 7.278283 -4.812897      9.979272 
1 1 1 17  17 14 o 51.65733 4.892798 33.23363       6.085801 37.31680       8.868349 29.59926       8.366778 54.23116 6.864057 48.05350 7.380541 6.177658       10.07907 
1 1 1 17  17 15 o 49.95060 5.033251 31.19419       6.043226 32.77525       8.779239 29.77040       8.331178 50.52174 7.345928 48.10989 7.338083 2.411854       10.38317 
1 1 1 17  17 16 o 62.43380 4.623456 48.51351       6.984410 51.51407       10.05511 45.71603       9.708882 63.68401 6.573539 59.88229 6.771957 3.801727       9.437734 
1 1 1 17  17 17 o 46.71003 5.439982 27.61379       6.076433 30.82819       9.001549 24.92281       8.236123 48.46420 7.893239 43.39973 8.084930 5.064468       11.29908 
1 1 1 17  17 18 o 79.73492 4.822156 79.58368       9.325910 79.81260       12.22023 79.26442       14.43154 79.06164 6.397346 78.00915 7.691515 1.052490       10.00427 
1 1 1 17  17 19 o 71.77322 4.928642 64.91019       8.568040 63.73579       11.44485 66.40766       12.92354 70.10262 6.784142 71.04786 7.581393 -0.9452362     10.17360 
1 1 1 17  17 20 o 77.26884 7.471820 79.17678       13.89379 0.000000       0.000000 79.17678       13.89379 ?        ?        77.26884 7.471820 0.000000       7.471820 
1 1 1 17  17 21 o 58.35812 8.021234 46.67705       11.10573 0.000000       0.000000 46.67705       11.10573 ?        ?        58.35812 8.021234 0.000000       8.021234 
1 1 1 17  17 22 o 32.16485 7.395397 14.48104       5.675398 18.54635       7.652422 9.511502       8.460766 35.60722 8.855973 26.46243 9.835359 9.144787       13.23490 
1 1 1 17  17 23 o 31.07187 7.855447 14.04445       5.950363 12.00391       7.622894 17.22700       9.519938 28.13211 9.434549 32.62130 10.52407 -4.489193      14.13389 
1 1 1 17  17 24 o 20.34863 7.719973 5.235950       5.270362 17.42835       7.349478 -7.671422      7.561897 33.43163 8.874300 14.92365 7.165750 18.50799       11.40619 
1 1 1 17  17 25 o 24.22083 7.914998 9.007744       5.375101 7.702028       7.096875 10.76449       8.231860 22.90975 8.889781 25.60364 9.662945 -2.693893      13.13015 
1 1 1 17  17 26 o 31.79627 7.334066 15.58124       5.566877 13.87761       7.191744 18.12794       8.792959 28.11321 9.153246 30.99456 10.12304 -2.881355      13.64763 
1 1 1 17  17 27 o 23.54654 8.174988 9.375896       5.732475 13.05620       8.030513 5.552066       8.185601 26.08176 9.602205 20.51414 8.885261 5.567612       13.08244 
1 1 1 17  17 28 o 25.17064 9.291481 12.65544       7.527664 12.65544       7.527664 0.000000       0.000000 25.17064 9.291481 ?        ?        0.000000       9.291481 
1 1 1 17  17 29 o 21.03507 8.103961 8.205482       5.866521 2.237942       8.712041 13.15634       7.935282 17.76861 8.272650 24.30143 9.408335 -6.532814      12.52811 
1 1 1 17  17 30 o 20.87284 8.202036 8.932301       6.103520 15.38211       9.219603 3.900174       8.143562 23.76874 9.812658 17.60902 8.128460 6.159727       12.74206 
1 1 1 17  17 31 o 14.19531 6.605350 0.4543023      5.542138 -0.6515194     9.052135 1.117359       7.009446 15.63624 7.588553 15.36551 7.238626 0.2707300      10.48732 
1 1 1 17  17 32 o 12.57050 5.988790 -1.458879      5.063529 -0.7507613     7.385386 -2.087003      6.955736 14.41214 6.960683 13.72262 6.658016 0.6895199      9.632253 
1 1 1 17  18 0  o 131.7713 3.704931 212.4091       11.88518 205.6958       18.64088 217.0076       15.42772 129.2686 5.933310 133.0193 4.767094 -3.750778      7.611133 
1 1 1 17  18 1  o 94.82967 2.896599 109.8930       6.685889 112.2677       12.81691 109.0052       7.836598 95.48325 5.532020 94.39172 3.412502 1.091530       6.499877 
1 1 1 17  18 2  f 155.3695 2.860875 294.7280       10.83180 281.4510       16.44447 304.9034       14.39606 151.5453 4.457727 157.9149 3.740972 -6.369553      5.819468 
1 1 1 17  18 3  o 133.4705 2.949931 217.5501       9.594744 205.0503       13.26326 231.2728       13.89694 129.3600 4.213024 137.4012 4.155201 -8.041183      5.917370 
1 1 1 17  18 4  o 55.34672 2.798748 37.49844       3.762529 33.76183       5.473422 40.84602       5.180676 52.33012 4.330860 57.67412 3.705728 -5.343998      5.699892 
1 1 1 17  18 5  o 131.3126 2.708647 210.5328       8.667521 211.2103       12.90117 209.9753       11.70186 131.2966 4.036971 130.9746 3.669949 0.3220825      5.455791 
1 1 1 17  18 6  f 171.3536 3.448842 359.0222       14.40133 335.0675       27.57474 368.0067       16.88745 164.5372 6.892458 173.3799 3.996954 -8.842728      7.967535 
1 1 1 17  18 7  o 45.00539 5.226795 25.21677       5.625896 27.56050       7.946477 22.86153       7.965994 46.65879 7.221946 42.22543 8.035058 4.433361       10.80364 
1 1 1 17  18 8  o 29.77922 7.114138 11.42429       5.091728 10.94531       6.986616 11.96686       7.435953 29.45157 8.947089 30.69928 9.209638 -1.247711      12.84009 
1 1 1 17  18 9  o 36.69040 6.215227 17.07795       5.358893 12.35631       7.281381 22.65781       7.915510 31.04737 9.062827 41.96166 8.033359 -10.91429      12.11073 
1 1 1 17  18 10 o 41.02299 5.850646 21.18875       5.683272 24.76116       8.118834 17.75622       7.958293 43.91105 7.876627 36.86835 8.949249 7.042690       11.92184 
1 1 1 17  18 11 o 66.38229 4.496399 54.41920       7.230740 64.48846       10.81812 46.28837       9.721220 71.87105 6.238510 60.68760 6.683867 11.18344       9.142925 
1 1 1 17  18 12 o 61.53878 4.656547 46.90139       6.931288 56.86882       10.36586 38.84084       9.321715 67.34769 6.392609 55.35722 7.071353 11.99046       9.532549 
1 1 1 17  18 13 o 20.69518 7.521836 4.516978       4.903830 8.438513       6.939351 0.6051200      6.930784 26.50223 9.001557 19.64165 8.333623 6.860580       12.26692 
1 1 1 17  18 14 o 53.54741 4.863300 35.74735       6.276931 36.17019       8.889523 35.32691       8.864373 53.22911 7.024487 52.56976 7.100930 0.6593437      9.988324 
1 1 1 17  18 15 o 39.96495 5.833218 20.34119       5.513583 20.00543       7.625796 20.70897       7.981101 38.86093 8.304586 39.47620 8.544712 -0.6152649     11.91546 
1 1 1 17  18 16 o 42.02163 6.291346 22.68847       6.244571 26.46684       8.114511 17.20122       9.778852 44.93034 7.687319 35.45779 10.54335 9.472557       13.04826 
1 1 1 17  18 17 o 22.36982 7.894155 5.882246       5.358984 3.936788       7.149395 8.377028       8.096080 22.08062 8.812860 26.61639 9.666144 -4.535763      13.08055 
1 1 1 17  18 18 o 37.31535 9.005581 19.25158       8.094704 0.000000       0.000000 19.25158       8.094704 ?        ?        37.31535 9.005581 0.000000       9.005581 
1 1 1 17  18 19 o 32.35262 9.909050 14.85037       8.546700 0.000000       0.000000 14.85037       8.546700 ?        ?        32.35262 9.909050 0.000000       9.909050 
1 1 1 17  18 20 o 46.23462 6.024623 27.98914       6.626574 25.06968       8.969611 31.49734       9.832497 41.99355 9.033338 47.33560 8.849196 -5.342045      12.64553 
1 1 1 17  18 21 o 28.12753 7.422531 11.06459       5.160821 8.298007       6.788536 14.85302       7.943895 24.90741 8.875533 31.65591 9.524070 -6.748503      13.01856 
1 1 1 17  18 22 o 23.68175 7.695193 7.842210       5.084383 6.190257       6.519963 10.40567       8.121931 22.40906 8.566168 26.78836 9.688171 -4.379301      12.93213 
1 1 1 17  18 23 o 14.40898 6.420553 -0.6823146     4.560853 0.5134916E-01  5.656842 -2.045107      7.709752 16.40463 7.238169 17.53314 8.025407 -1.128502      10.80732 
1 1 1 17  18 24 f 13.41479 6.147897 -1.860016      4.543046 2.956509       5.884952 -8.964053      7.147080 18.48203 7.751324 13.83189 6.719819 4.650147       10.25861 
1 1 1 17  18 25 o 17.65892 7.377295 2.971696       5.299379 10.45594       7.255362 -5.587341      7.758856 24.96966 9.137900 15.42715 7.367326 9.542519       11.73792 
1 1 1 17  18 26 o 25.44116 9.557398 11.96728       8.032485 11.96728       8.032485 0.000000       0.000000 25.44116 9.557398 ?        ?        0.000000       9.557398 
1 1 1 17  18 27 o 13.00120 6.155168 -3.293430      5.185278 -3.230445      7.125319 -3.364338      7.560167 15.14648 7.183859 15.48505 7.360400 -0.3385744     10.28510 
1 1 1 17  18 28 o 14.87530 6.753369 0.3605911      5.318718 12.32559       7.805864 -10.00848      7.266655 24.16723 9.338065 12.77322 6.318414 11.39401       11.27483 
1 1 1 17  18 29 o 21.93160 8.134122 9.452959       5.781265 13.29913       8.486926 6.123052       7.896818 23.44161 9.515021 19.02104 8.463723 4.420570       12.73461 
1 1 1 17  18 30 o 13.33209 6.298597 -1.312287      5.376529 1.876712       7.679415 -4.378325      7.529909 16.22090 7.621321 13.90491 6.786898 2.315989       10.20522 
1 1 1 17  18 31 o 14.79715 6.699701 2.141358       5.191704 10.39458       8.190720 -3.401450      6.712359 19.81648 8.727978 13.31518 6.478689 6.501307       10.86973 
1 1 1 17  18 32 o 21.05725 9.115371 14.36510       8.605329 0.000000       0.000000 14.36510       8.605329 ?        ?        21.05725 9.115371 0.000000       9.115371 
1 1 1 17  19 0  f 204.5739 4.402616 512.4642       21.94811 531.4146       36.71542 501.9265       27.37857 207.3114 7.278863 202.0861 5.564829 5.225357       9.162378 
1 1 1 17  19 1  o 28.21246 4.050403 9.936252       2.704933 5.936318       4.182642 12.81173       3.546333 22.07272 6.959957 32.00189 4.686306 -9.929171      8.390617 
1 1 1 17  19 2  o 138.4655 2.741189 234.0855       9.249464 221.6252       14.02420 243.6783       12.30517 134.4651 4.285361 141.1277 3.580882 -6.662659      5.584535 
1 1 1 17  19 3  o 126.8896 2.681521 196.5782       8.291693 190.0047       12.50992 201.7289       11.07349 124.5104 4.128703 128.3963 3.542508 -3.885902      5.440179 
1 1 1 17  19 4  o 138.0078 3.170513 232.7515       10.66275 208.5844       19.87849 242.5137       12.63409 129.9383 6.296580 140.7518 3.686618 -10.81346      7.296443 
1 1 1 17  19 5  f 61.44960 2.206141 46.13738       3.298245 45.14736       4.082406 47.99822       5.596924 60.73722 2.765452 62.52515 3.689722 -1.787937      4.611049 
1 1 1 17  19 6  o 142.9739 3.203435 249.9193       11.16115 226.5633       21.30382 258.7552       13.10336 135.2707 6.481614 145.3499 3.702418 -10.07922      7.464530 
1 1 1 17  19 7  o 26.43392 7.372920 8.933106       4.927894 11.41767       6.947972 6.418096       6.990411 29.94751 8.882776 24.72670 8.981589 5.220812       12.63221 
1 1 1 17  19 8  o 29.87333 7.086725 11.51788       5.080666 6.850683       7.030974 16.61813       7.349927 25.15097 9.024569 35.73742 8.553692 -10.58645      12.43417 
1 1 1 17  19 9  o 104.4094 4.569104 134.2389       11.59722 134.1035       15.57153 134.4076       17.37879 103.9069 6.177543 103.7782 6.911293 0.1287003      9.269736 
1 1 1 17  19 10 o 39.74085 6.098122 19.99987       5.717385 14.41766       7.904379 26.12506       8.279891 33.24910 9.360888 45.07861 7.820764 -11.82951      12.19797 
1 1 1 17  19 11 o 13.65317 6.191579 -2.470990      4.455359 -3.727386      6.251880 -1.174460      6.350947 15.96042 7.275499 17.65803 7.734236 -1.697612      10.61844 
1 1 1 17  19 12 o 71.90372 4.389974 63.92522       7.655519 79.69640       11.66092 51.97871       10.14895 79.82486 6.039381 64.20631 6.579408 15.61855       8.930999 
1 1 1 17  19 13 o 20.65551 7.715702 4.239817       5.219643 -0.5282140     6.534390 12.64586       8.676235 18.26983 7.925811 31.31921 10.04155 -13.04938      12.79263 
1 1 1 17  19 14 o 14.73837 6.586163 -1.777671      4.835284 0.1992475      6.203678 -4.837473      7.717943 18.25929 7.819750 17.41243 7.992289 0.8468590      11.18147 
1 1 1 17  19 15 o 20.15556 8.489099 1.328993       7.105511 0.000000       0.000000 1.328993       7.105511 ?        ?        20.15556 8.489099 0.000000       8.489099 
1 1 1 17  19 16 o 38.95430 9.123027 20.72096       8.507145 0.000000       0.000000 20.72096       8.507145 ?        ?        38.95430 9.123027 0.000000       9.123027 
1 1 1 17  19 17 o 19.79230 7.472300 3.991545       4.923490 -0.6694003     6.947846 8.693012       6.977983 18.41716 8.077493 26.16280 9.022619 -7.745634      12.11006 
1 1 1 17  19 18 o 18.73881 7.212339 3.382847       4.643460 3.912030       6.447798 2.812695       6.692737 21.09014 8.385139 20.43096 8.389850 0.6591797      11.86171 
1 1 1 17  19 19 o 49.00320 5.928562 31.28682       6.935853 39.20597       9.414497 21.88661       10.25714 54.05654 7.335962 38.29037 10.62109 15.76617       12.90829 
1 1 1 17  19 20 o 26.40356 7.863016 9.745667       5.435620 9.610202       7.347649 9.909419       8.078473 26.42903 9.250175 26.89577 9.670676 -0.4667397     13.38237 
1 1 1 17  19 21 o 43.08833 6.300946 25.02952       6.420514 25.08320       8.668459 24.96428       9.556283 41.28257 8.880397 40.40583 9.805881 0.8767471      13.22939 
1 1 1 17  19 22 o 19.01833 7.557385 3.758881       5.234931 2.299224       6.496506 6.461646       8.840132 18.95564 8.056439 23.53815 9.651463 -4.582514      12.57207 
1 1 1 17  19 23 o 20.98764 7.777892 5.966185       5.284080 5.136352       7.226811 6.919482       7.745787 21.22694 8.717604 22.83831 9.153527 -1.611376      12.64056 
1 1 1 17  19 24 o 25.88128 8.894018 11.03658       6.778515 11.03658       6.778515 0.000000       0.000000 25.88128 8.894018 ?        ?        0.000000       8.894018 
1 1 1 17  19 25 o 24.89653 9.375646 10.95552       7.740182 10.95552       7.740182 0.000000       0.000000 24.89653 9.375646 ?        ?        0.000000       9.375646 
1 1 1 17  19 26 o 17.60874 7.379033 3.477149       5.326556 0.9816499      7.262028 6.383090       7.836507 17.34603 7.881439 20.82775 8.850114 -3.481720      11.85081 
1 1 1 17  19 27 o 10.96298 5.394091 -7.672909      5.058371 -1.360558      7.369961 -13.29488      6.955271 15.92812 7.478212 11.74803 5.871230 4.180087       9.507627 
1 1 1 17  19 28 o 33.77687 8.045135 20.42596       6.526912 22.97904       9.611554 18.24116       8.891354 30.43801 10.58450 27.43811 10.10339 2.999899       14.63250 
1 1 1 17  19 29 f 17.12478 7.426980 4.373864       5.734463 12.60922       8.648145 -2.088454      7.660830 22.21557 9.361538 14.93118 7.180500 7.284384       11.79822 
1 1 1 17  19 30 o 27.63345 8.867249 17.38570       6.764592 21.11284       10.01351 14.25690       9.174598 25.33358 10.31594 21.91963 9.450045 3.413948       13.99007 
1 1 1 17  19 31 o 14.60190 6.780200 1.553424       5.791767 5.904359       8.986288 -1.538163      7.574952 17.27886 8.157087 14.29132 6.937232 2.987541       10.70809 
1 1 1 17  20 0  o 52.00491 3.205821 33.17132       4.042997 36.29912       8.199861 32.16671       4.647139 53.91870 6.363091 51.14474 3.754794 2.773964       7.388329 
1 1 1 17  20 1  o 332.2794 4.666922 1353.686       37.78941 1290.807       57.66896 1401.003       50.02671 323.0053 7.326498 337.3040 6.086174 -14.29865      9.524656 
1 1 1 17  20 2  o 129.4077 2.695874 204.4866       8.501505 219.6029       13.42546 194.3674       10.98446 133.8502 4.120897 126.0111 3.580753 7.839142       5.459266 
1 1 1 17  20 3  o 39.24618 3.638535 19.00481       3.440227 15.74415       6.858291 20.10109       3.976724 34.90007 8.203432 40.30524 4.106092 -5.405174      9.173674 
1 1 1 17  20 4  o 178.5529 3.519754 390.0586       15.31494 373.1686       19.92061 414.4695       23.94864 174.3038 4.694132 183.4817 5.361893 -9.177917      7.126343 
1 1 1 17  20 5  o 163.0036 2.938512 324.7329       11.67242 294.9679       16.78691 352.5942       16.24120 154.9863 4.449295 169.6490 3.928535 -14.66272      5.935454 
1 1 1 17  20 6  o 40.40411 5.975242 20.57384       5.706056 19.30641       7.903611 21.95362       8.246468 38.54482 8.629716 41.17811 8.499856 -2.633297      12.11278 
1 1 1 17  20 7  o 129.7915 3.990925 206.7732       12.60780 212.1815       20.11985 203.2764       16.17810 130.7582 6.333054 128.3657 5.182464 2.392487       8.183245 
1 1 1 17  20 8  o 60.03183 5.193288 44.74973       7.522670 50.14635       9.951982 37.55566       11.49041 63.24031 6.552559 53.89573 9.070517 9.344582       11.18974 
1 1 1 17  20 9  f 42.18158 6.320009 22.55400       6.296665 14.28471       7.955571 36.42105       10.30219 33.08441 9.417399 53.25898 8.200555 -20.17457      12.48745 
1 1 1 17  20 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  20 11 o 46.77413 9.596703 29.01091       10.57155 0.000000       0.000000 29.01091       10.57155 ?        ?        46.77413 9.596703 0.000000       9.596703 
1 1 1 17  20 12 o 42.86047 9.134346 24.43385       9.248549 0.000000       0.000000 24.43385       9.248549 ?        ?        42.86047 9.134346 0.000000       9.134346 
1 1 1 17  20 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  20 14 o 44.97926 5.445849 25.63027       5.847758 36.39948       8.844601 17.26641       7.794530 53.12587 7.002129 35.73204 8.966945 17.39383       11.37699 
1 1 1 17  20 15 o 64.43797 5.036238 52.17598       7.845541 51.18655       10.33547 53.52131       12.05176 63.02975 6.838415 63.90134 7.907949 -0.8715820     10.45464 
1 1 1 17  20 16 f 26.91957 7.153042 9.689252       4.771869 9.731782       6.732142 9.646306       6.764861 27.16742 8.856671 27.08429 8.881179 0.8313560E-01  12.54257 
1 1 1 17  20 17 o 50.54856 5.199778 32.57785       6.313903 49.67508       9.548320 19.29285       8.416759 61.85696 6.427979 36.97894 9.339292 24.87802       11.33760 
1 1 1 17  20 18 o 77.21738 4.812858 75.59806       9.011345 92.31655       12.53113 57.69346       12.96803 84.35545 6.137940 64.89645 8.396685 19.45901       10.40090 
1 1 1 17  20 19 o 79.09746 4.788308 79.75262       9.186325 85.27316       12.70454 73.70367       13.29867 80.29107 6.550015 73.72218 7.507041 6.568886       9.962849 
1 1 1 17  20 20 o 37.85553 6.947550 19.74894       6.172989 28.66173       8.811278 11.15788       8.650784 44.68340 8.400306 27.72629 10.00247 16.95711       13.06195 
1 1 1 17  20 21 o 37.87106 6.729584 19.92536       5.983024 15.95758       8.251656 24.32359       8.687724 31.77974 9.737062 39.98819 9.118291 -8.208445      13.33993 
1 1 1 17  20 22 o 17.27288 7.777269 -0.5694169     6.883563 -0.5694169     6.883563 0.000000       0.000000 17.27288 7.777269 ?        ?        0.000000       7.777269 
1 1 1 17  20 23 o 28.80491 9.557677 14.19803       7.826822 14.19803       7.826822 0.000000       0.000000 28.80491 9.557677 ?        ?        0.000000       9.557677 
1 1 1 17  20 24 o 31.76073 7.766398 15.91802       5.960096 19.36133       8.244798 12.14911       8.625804 32.86486 9.657712 25.88399 9.863008 6.980875       13.80400 
1 1 1 17  20 25 o 19.61323 7.767511 5.491811       5.512458 5.609284       7.619940 5.362831       7.984411 20.44137 8.707883 20.41415 8.808494 0.2722549E-01  12.38615 
1 1 1 17  20 26 o 17.87785 7.484060 3.981084       5.470650 5.634158       7.893834 2.453406       7.588530 19.99222 8.691850 18.05217 8.143611 1.940044       11.91078 
1 1 1 17  20 27 o 18.63377 7.786017 5.303280       5.904494 7.231747       8.890883 3.781664       7.897532 20.35052 9.022125 18.31684 8.281167 2.033674       12.24649 
1 1 1 17  20 28 o 13.73843 6.470319 -1.482820      5.593485 7.199931       8.604591 -7.837107      7.360969 19.51341 8.748035 13.09384 6.454953 6.419571       10.87173 
1 1 1 17  20 29 o 25.42279 8.703540 14.47819       6.489649 26.17716       10.15654 6.406270       8.436463 29.39725 10.80282 18.37428 8.404655 11.02297       13.68719 
1 1 1 17  20 30 o 16.24802 7.264903 4.041995       5.892123 4.430944       8.926927 3.741742       7.843290 17.00915 8.059579 16.54469 7.750722 0.4644527      11.18170 
1 1 1 17  21 0  f 98.50520 2.914861 118.6499       6.989323 134.1495       14.19579 113.6904       8.030046 104.2642 5.607756 96.35700 3.425232 7.907227       6.571084 
1 1 1 17  21 1  o 113.8374 3.123508 158.5225       8.656717 157.4704       11.31752 160.0059       13.43887 113.2964 4.105991 114.0546 4.846238 -0.7582169     6.351786 
1 1 1 17  21 2  o 181.3972 3.111316 402.2604       13.75342 406.7977       21.34989 399.0419       17.98152 181.9340 4.819792 180.4529 4.089089 1.481140       6.320683 
1 1 1 17  21 3  o 55.29807 2.853142 37.46604       3.831762 44.19292       5.775273 32.17629       5.121331 59.92480 3.977357 51.06521 4.151266 8.859592       5.749120 
1 1 1 17  21 4  o 22.85489 4.491177 6.632336       2.412110 5.243195       3.620136 7.741474       3.234778 20.66357 6.469417 24.58736 5.532885 -3.923792      8.512707 
1 1 1 17  21 5  o 104.1500 2.678112 132.6366       6.791467 129.9591       9.367482 135.6035       9.860655 102.9192 3.741221 105.1109 3.856191 -2.191681      5.372797 
1 1 1 17  21 6  o 133.7161 7.142617 223.2558       23.18988 0.000000       0.000000 223.2558       23.18988 ?        ?        133.7161 7.142617 0.000000       7.142617 
1 1 1 17  21 7  o 105.1440 7.032828 138.3969       17.91621 0.000000       0.000000 138.3969       17.91621 ?        ?        105.1440 7.032828 0.000000       7.032828 
1 1 1 17  21 8  o 58.62964 8.356858 44.14529       11.60221 0.000000       0.000000 44.14529       11.60221 ?        ?        58.62964 8.356858 0.000000       8.356858 
1 1 1 17  21 9  o 56.09189 8.151896 40.49686       10.81687 0.000000       0.000000 40.49686       10.81687 ?        ?        56.09189 8.151896 0.000000       8.151896 
1 1 1 17  21 10 o 27.46554 7.780216 9.805798       5.443125 28.11899       8.558251 -2.634026      7.053589 46.59142 7.814180 17.71294 7.932209 28.87848       11.13469 
1 1 1 17  21 11 o 47.18987 5.114782 27.94178       5.787893 43.52813       9.261755 17.95451       7.413859 58.53079 6.608850 36.78479 8.448869 21.74600       10.72662 
1 1 1 17  21 12 o 39.88136 5.907561 20.31027       5.567975 30.86826       8.241571 11.44482       7.552134 48.90248 7.125138 29.61786 9.353976 19.28463       11.75859 
1 1 1 17  21 13 o 59.65001 4.660357 44.45544       6.720589 54.90447       10.27151 36.63371       8.886847 65.59917 6.511242 53.26686 7.016751 12.33230       9.572412 
1 1 1 17  21 14 o 40.40576 5.547090 20.86616       5.317897 25.45355       7.862052 16.99725       7.220167 43.88026 7.629243 35.40579 8.480125 8.474472       11.40692 
1 1 1 17  21 15 o 46.56380 5.245903 27.59175       5.849104 32.03391       8.489394 23.57738       8.070275 49.31099 7.283689 41.74800 8.225310 7.562996       10.98671 
1 1 1 17  21 16 o 29.38499 7.192879 11.67820       5.108353 26.44339       7.799792 0.5876766      6.759892 44.44588 7.465805 18.87836 8.125009 25.56753       11.03422 
1 1 1 17  21 17 o 15.75137 6.710223 0.5653234      4.525103 4.170836       5.972025 -4.295478      6.934132 20.71648 8.121395 16.15841 7.473617 4.558065       11.03685 
1 1 1 17  21 18 o 32.99289 6.768001 14.80683       5.258801 16.43742       7.608565 13.31541       7.276670 33.61846 9.076753 30.33229 9.112957 3.286165       12.86209 
1 1 1 17  21 19 o 23.57345 8.180376 7.529474       5.739709 5.592186       6.898079 11.88916       10.34806 22.25390 8.727113 28.62587 10.82721 -6.371969      13.90651 
1 1 1 17  21 20 o 66.91471 6.980796 61.78227       11.21594 61.78227       11.21594 0.000000       0.000000 66.91471 6.980796 ?        ?        0.000000       6.980796 
1 1 1 17  21 21 o 15.74408 6.796230 0.8006760      4.756954 -6.549849      5.962801 13.66833       7.889343 13.27856 6.372519 29.08135 9.593712 -15.80279      11.51731 
1 1 1 17  21 22 o 31.95771 7.214898 15.14957       5.485248 13.13777       7.241854 17.85711       8.401252 28.17269 9.185935 32.22454 9.815554 -4.051847      13.44346 
1 1 1 17  21 23 o 28.96521 8.221193 13.62266       6.071602 19.12146       8.525285 7.962928       8.649138 32.51252 9.884615 22.93402 9.489583 9.578505       13.70247 
1 1 1 17  21 24 o 20.26922 7.876136 6.046400       5.576704 13.87820       7.911186 -1.688986      7.862341 27.23569 9.593181 16.77817 7.827308 10.45752       12.38127 
1 1 1 17  21 25 o 21.70688 8.174481 7.940942       5.883958 15.69864       8.546274 0.9499471      8.112971 27.58288 9.943028 17.75343 8.165473 9.829456       12.86619 
1 1 1 17  21 26 o 20.33081 7.953509 7.072087       5.717629 16.26552       8.464449 -0.6429772     7.754069 27.08866 9.876751 16.34956 7.674345 10.73911       12.50783 
1 1 1 17  21 27 o 14.83698 6.837563 0.1837650      5.728391 11.42748       8.723161 -8.341290      7.595696 22.24579 9.389647 13.27643 6.547266 8.969360       11.44693 
1 1 1 17  21 28 o 13.33693 6.331733 -1.861373      5.561462 -4.771953      8.268517 0.5432056      7.515491 14.40758 7.049293 15.75148 7.443182 -1.343900      10.25151 
1 1 1 17  21 29 o 19.71243 8.799233 9.878498       8.605671 0.000000       0.000000 9.878498       8.605671 ?        ?        19.71243 8.799233 0.000000       8.799233 
1 1 1 17  21 30 o 12.84762 6.361724 -6.364198      7.435737 0.000000       0.000000 -6.364198      7.435737 ?        ?        12.84762 6.361724 0.000000       6.361724 
1 1 1 17  22 0  o 97.86408 3.858043 117.5035       9.182792 0.000000       0.000000 117.5035       9.182792 ?        ?        97.86408 3.858043 0.000000       3.858043 
1 1 1 17  22 1  o 108.7025 3.756189 144.9092       9.935049 155.9888       15.32504 136.8769       13.04849 112.3466 5.615448 105.3553 5.097515 6.991333       7.584057 
1 1 1 17  22 2  o 130.3783 3.053686 207.8775       9.702102 219.4120       18.61526 203.5758       11.36823 133.2098 5.748047 128.8761 3.623393 4.333649       6.794779 
1 1 1 17  22 3  o 40.81399 3.365501 20.52831       3.317581 10.88643       5.941129 24.89715       3.999179 29.06299 8.091523 44.92887 3.685013 -15.86588      8.891123 
1 1 1 17  22 4  o 30.78213 3.354969 11.73788       2.475971 14.01354       3.754486 9.986529       3.293693 33.42583 4.742226 28.06697 4.998906 5.358864       6.890411 
1 1 1 17  22 5  o 120.9496 2.608011 178.8163       7.686878 174.4097       11.31299 182.5956       10.47687 119.1518 3.901455 122.0093 3.527433 -2.857422      5.259670 
1 1 1 17  22 6  o 71.46454 4.244637 63.01430       7.358790 69.22522       11.05435 58.07164       9.861334 74.42233 6.150135 68.16574 5.997634 6.256592       8.590446 
1 1 1 17  22 7  o 91.42496 5.608224 103.9858       12.43459 0.000000       0.000000 103.9858       12.43459 ?        ?        91.42496 5.608224 0.000000       5.608224 
1 1 1 17  22 8  o 61.01334 4.468947 46.14568       6.598469 45.82123       9.968563 46.39870       8.803035 60.08847 6.934861 60.76386 6.024212 -0.6753883     9.186045 
1 1 1 17  22 9  o 47.17916 5.057023 27.88820       5.723469 35.28313       8.604498 22.01979       7.665118 52.57371 6.881163 41.01625 7.955919 11.55746       10.51889 
1 1 1 17  22 10 o 33.53874 6.868775 14.66543       5.424828 13.51432       7.093804 16.28679       8.419020 31.86492 8.830447 34.79135 9.611753 -2.926428      13.05230 
1 1 1 17  22 11 o 63.12148 4.422945 49.57409       6.760324 49.36696       9.884130 49.75616       9.266786 62.20423 6.622203 62.64257 6.149658 -0.4383430     9.037250 
1 1 1 17  22 12 o 88.79364 4.580012 98.20925       9.876760 99.17056       13.37997 97.05825       14.64072 88.40656 6.250919 87.04532 6.960033 1.361244       9.355001 
1 1 1 17  22 13 o 78.50690 4.652400 77.09494       8.860723 86.32202       12.14222 66.58378       12.95959 82.34176 6.094400 71.43541 7.559150 10.90635       9.709915 
1 1 1 17  22 14 o 61.33632 4.528067 47.23119       6.720380 55.67252       10.21348 40.78606       8.924501 65.65741 6.467297 56.01512 6.668745 9.642292       9.289676 
1 1 1 17  22 15 f 46.18241 5.235403 27.28934       5.788177 40.13575       8.889960 17.83604       7.626065 55.32877 6.731834 35.70839 8.817153 19.62038       11.09323 
1 1 1 17  22 16 o 71.87788 4.737310 65.49414       8.251542 66.67814       11.30795 64.14563       12.06798 71.26751 6.585583 69.37920 7.244512 1.888306       9.790447 
1 1 1 17  22 17 o 21.02577 7.809961 5.187532       5.333391 3.162396       6.067472 12.07055       11.18588 19.73978 8.033080 29.49175 11.23313 -9.751970      13.80991 
1 1 1 17  22 18 o 43.76182 7.148102 26.38337       7.360023 40.13003       9.038986 -0.6622385     12.67855 54.24415 7.001136 22.92053 10.41412 31.32362       12.54870 
1 1 1 17  22 19 o 27.08634 9.158108 10.97338       7.182261 0.000000       0.000000 10.97338       7.182261 ?        ?        27.08634 9.158108 0.000000       9.158108 
1 1 1 17  22 20 o 18.30706 7.282290 3.509612       4.865617 6.717813       6.589614 -0.3362803     7.214857 22.42254 8.601658 17.81052 7.995507 4.612024       11.74379 
1 1 1 17  22 21 o 18.12646 7.364548 3.384467       5.089816 8.142035       7.080056 -1.704125      7.322223 23.40193 8.931220 16.91105 7.770453 6.490877       11.83835 
1 1 1 17  22 22 o 38.09309 6.529422 21.02853       5.843170 14.84146       7.819224 28.85303       8.793248 28.98730 9.550450 42.09245 8.853627 -13.10516      13.02297 
1 1 1 17  22 23 o 33.11609 7.891133 17.58602       6.277299 21.80489       9.004072 13.59641       8.756007 33.98402 10.11998 26.69763 9.989111 7.286394       14.21958 
1 1 1 17  22 24 o 15.85908 7.034067 1.117795       5.410325 -1.490621      7.256916 4.381948       8.117998 16.09666 7.512857 19.63248 8.666294 -3.535822      11.46942 
1 1 1 17  22 25 o 14.47456 6.691132 -0.9034142     5.546975 -1.221001      7.915482 -0.5969527     7.775604 16.33694 7.695024 16.49793 7.725071 -0.1609840     10.90367 
1 1 1 17  22 26 o 18.94800 7.757160 5.961152       5.699274 8.991708       8.418861 3.397372       7.743417 21.05354 9.064334 17.84244 8.119287 3.211102       12.16902 
1 1 1 17  22 27 o 16.24688 7.253663 2.929300       5.850962 15.72063       9.254710 -5.587433      7.551642 23.95969 9.855244 13.77627 6.739641 10.18342       11.93937 
1 1 1 17  22 28 o 17.24730 7.942527 4.391497       7.709404 0.000000       0.000000 4.391497       7.709404 ?        ?        17.24730 7.942527 0.000000       7.942527 
1 1 1 17  22 29 o 28.35129 8.905140 18.75704       6.853667 19.30493       9.575978 18.18164       9.813483 24.00440 9.963493 23.05933 9.854290 0.9450703      14.01350 
1 1 1 17  23 0  o 158.7511 3.263299 308.4609       12.62437 309.1912       24.43649 308.1951       14.74439 157.8228 6.366860 158.5515 3.816106 -0.7286224     7.422909 
1 1 1 17  23 1  o 58.14012 3.485564 41.55424       4.915713 40.51520       6.056621 43.55988       8.414766 57.25984 4.373641 59.05196 5.927596 -1.792118      7.366487 
1 1 1 17  23 2  o 90.11991 2.546518 99.33405       5.586863 100.2534       8.615086 98.66683       7.339385 90.30205 3.924316 89.68985 3.363959 0.6121979      5.168798 
1 1 1 17  23 3  o 173.0189 3.041461 366.4089       12.82366 359.8258       19.41756 371.5009       17.07770 170.8720 4.667610 173.9196 4.029442 -3.047546      6.166278 
1 1 1 17  23 4  o 23.28953 3.985032 6.846725       2.180415 7.162775       3.265906 6.592566       2.928723 23.58178 5.738421 22.64416 5.386277 0.9376163      7.870289 
1 1 1 17  23 5  o 89.85621 2.474205 98.79161       5.412603 100.9525       7.915422 96.89379       7.417929 90.62627 3.591242 88.81635 3.433781 1.809914       4.968689 
1 1 1 17  23 6  o 43.72878 5.200044 23.99907       5.432887 25.02399       7.445639 22.83200       7.945191 44.11780 7.171586 41.82052 8.088677 2.297283       10.81010 
1 1 1 17  23 7  o 78.09032 4.522298 75.56174       8.569009 80.76112       11.54370 69.18057       12.78850 80.26434 5.944005 73.76392 7.206222 6.500412       9.341351 
1 1 1 17  23 8  o 49.44340 4.852562 30.57573       5.771534 32.97800       7.850028 27.74935       8.514803 50.87655 6.478394 46.13151 7.855516 4.745045       10.18227 
1 1 1 17  23 9  o 71.88467 4.224373 64.08051       7.367432 66.38472       10.77403 62.05674       10.09713 72.47227 6.158848 70.13293 5.964521 2.339333       8.573618 
1 1 1 17  23 10 o 78.12995 4.592980 76.02222       8.706193 76.50051       11.65722 75.41895       13.09216 77.69035 6.208958 76.69427 7.085124 0.9960709      9.420729 
1 1 1 17  23 11 f 118.6736 4.585458 175.4627       13.23594 176.5351       18.16389 174.2484       19.32711 117.8586 6.347708 116.7175 6.824860 1.141060       9.320520 
1 1 1 17  23 12 o 20.13702 7.226586 4.612525       4.508657 7.304880       6.638625 2.307451       6.142630 24.61984 8.776564 19.57871 8.038526 5.041128       11.90151 
1 1 1 17  23 13 o 37.24046 5.967210 18.04143       5.232501 14.39142       7.498277 21.50594       7.305245 32.16712 9.138234 39.93672 7.786145 -7.769604      12.00547 
1 1 1 17  23 14 o 54.50636 5.881740 38.39400       7.688923 45.55735       9.207719 21.89160       13.97551 59.05894 6.505425 37.73195 12.77485 21.32699       14.33588 
1 1 1 17  23 15 o 34.42593 7.996397 16.50779       6.579719 24.35773       8.001388 0.1135157      11.56321 41.93603 8.123116 23.08778 10.25938 18.84825       13.08586 
1 1 1 17  23 16 o 33.34367 6.463957 15.02129       5.062641 20.09078       7.007554 9.486457       7.322112 37.90298 7.845443 26.29209 9.231690 11.61089       12.11508 
1 1 1 17  23 17 f 33.46660 6.608003 15.36327       5.197794 20.54834       7.413580 10.35020       7.289569 37.73621 8.288958 26.80380 9.222748 10.93241       12.40024 
1 1 1 17  23 18 o 36.96909 6.126933 18.59451       5.326571 24.66792       8.398754 14.50795       6.889342 40.68434 8.732581 30.98811 8.744403 9.696226       12.35810 
1 1 1 17  23 19 o 17.11967 7.000165 2.522357       4.634201 4.934885       7.346498 0.9279382      5.972353 21.33499 8.778664 17.28284 7.536458 4.052155       11.56992 
1 1 1 17  23 20 o 15.26093 6.787344 -0.1609791     5.072218 -5.532187      7.133016 5.332991       7.214070 15.02096 7.142562 21.16160 8.702393 -6.140636      11.25823 
1 1 1 17  23 21 o 36.73676 7.124534 20.11378       6.147910 19.61474       8.687844 20.61435       8.701086 33.07116 9.962327 34.05457 9.897431 -0.9834175     14.04305 
1 1 1 17  23 22 o 18.54105 7.498851 4.234433       5.249698 5.564527       7.113076 2.643198       7.780067 20.52641 8.558973 18.99697 8.429932 1.529446       12.01332 
1 1 1 17  23 23 o 38.26934 7.674434 23.43939       6.907737 43.10396       10.47816 8.323310       9.186761 50.26707 8.878495 22.31074 9.534411 27.95633       13.02815 
1 1 1 17  23 24 o 18.55435 7.710410 4.800742       5.744308 10.02902       8.285857 -0.3734130E-01 7.970665 22.70309 9.330338 16.95717 7.900887 5.745920       12.22617 
1 1 1 17  23 25 o 30.97258 8.540093 18.02738       6.653578 32.72285       10.82415 9.102279       8.435459 37.06568 11.10960 21.30787 9.121760 15.75780       14.37462 
1 1 1 17  23 26 o 20.08778 8.805290 8.370223       8.245964 0.000000       0.000000 8.370223       8.245964 ?        ?        20.08778 8.805290 0.000000       8.805290 
1 1 1 17  23 27 o 13.36177 6.327055 -1.514274      5.483813 2.583066       7.871709 -5.377863      7.643874 16.64049 7.785615 13.72587 6.728658 2.914616       10.29032 
1 1 1 17  23 28 o 15.13519 6.974091 1.898832       5.956695 1.909520       8.773337 1.889691       8.113391 16.23492 7.774977 16.01936 7.617392 0.2155628      10.88462 
1 1 1 17  24 0  o 74.70728 2.663886 68.33469       4.841935 65.50791       7.339184 70.51331       6.443060 72.89041 4.148953 75.75856 3.499445 -2.868149      5.427700 
1 1 1 17  24 1  o 23.59065 5.476815 7.158577       3.087845 8.788339       6.127376 6.603795       3.574982 26.50952 8.432109 22.69399 6.260954 3.815533       10.50238 
1 1 1 17  24 2  o 59.64277 2.750677 43.61807       3.987149 47.13832       6.166430 41.08897       5.226730 61.77301 4.119917 57.72813 3.735463 4.044884       5.561240 
1 1 1 17  24 3  o 22.50187 4.389065 6.448862       2.320262 7.242656       3.741896 5.952992       2.957476 23.68925 6.352113 21.50796 5.591554 2.181286       8.462554 
1 1 1 17  24 4  o 109.2713 3.001734 146.4300       7.985514 153.8299       16.20149 144.0554       9.177772 110.9358 6.015542 108.2599 3.483366 2.675926       6.951301 
1 1 1 17  24 5  o 74.79713 2.428303 68.51414       4.420262 69.48039       6.437760 67.65230       6.079962 75.11370 3.526907 74.15028 3.373581 0.9634171      4.880586 
1 1 1 17  24 6  f 47.09689 5.149834 27.86302       5.814238 33.72190       8.365663 22.38851       8.086584 51.31712 6.861410 41.16194 8.347745 10.15518       10.80573 
1 1 1 17  24 7  o 68.00340 4.256721 57.37914       7.018725 67.92042       10.41146 48.59784       9.502634 73.43930 5.866377 61.85033 6.396938 11.58897       8.679585 
1 1 1 17  24 8  o 18.50038 6.952909 3.359279       4.252091 6.325137       5.815212 -0.4832909E-01 6.233260 23.27775 8.222537 18.05661 7.786982 5.221144       11.32463 
1 1 1 17  24 9  o 62.56135 5.131823 49.20926       7.755023 59.23776       10.21428 35.56135       11.91580 68.20836 6.213307 50.95203 9.953893 17.25632       11.73393 
1 1 1 17  24 10 o 20.70443 7.914406 4.204736       5.565491 9.401597       6.275738 -14.93526      12.04384 26.76456 8.535885 18.74231 9.010710 8.022251       12.41186 
1 1 1 17  24 11 o 27.95110 8.052751 10.55015       5.783174 10.80001       6.544709 9.660037       12.35286 28.28383 8.672741 29.58460 11.65535 -1.300772      14.52803 
1 1 1 17  24 12 o 99.33746 6.169504 126.8705       14.86109 126.8705       14.86109 0.000000       0.000000 99.33746 6.169504 ?        ?        0.000000       6.169504 
1 1 1 17  24 13 o 42.30745 5.560181 23.17206       5.593854 27.11961       7.922365 19.24726       7.899492 44.81523 7.520401 36.92037 8.887527 7.894855       11.64236 
1 1 1 17  24 14 o 29.22090 8.830164 12.11639       6.817720 0.000000       0.000000 12.11639       6.817720 ?        ?        29.22090 8.830164 0.000000       8.830164 
1 1 1 17  24 15 o 13.78719 6.175255 -1.246284      4.276972 0.8260679      6.152696 -3.184030      5.949523 17.94932 7.738575 15.18475 6.987123 2.764571       10.42619 
1 1 1 17  24 16 o 43.96695 5.520818 25.49824       5.785069 33.42078       8.761118 19.37343       7.703239 48.88553 7.601234 36.17297 8.819649 12.71257       11.64324 
1 1 1 17  24 17 o 24.79636 7.638786 8.852771       5.069946 7.727872       7.160487 9.983659       7.179524 23.87661 9.011984 26.00917 9.140647 -2.132563      12.83617 
1 1 1 17  24 18 o 17.19283 6.971111 2.707056       4.549821 2.193267       6.502719 3.199812       6.368226 18.67109 8.001262 19.29274 8.075421 -0.6216450     11.36805 
1 1 1 17  24 19 o 22.02639 7.391737 7.100188       4.679120 3.813366       6.904356 9.892021       6.363262 19.83802 8.362421 25.10565 8.617643 -5.267632      12.00807 
1 1 1 17  24 20 o 58.66656 5.648290 47.51826       7.975332 66.52945       11.66414 30.82695       10.92933 67.05112 7.253930 40.86575 10.80993 26.18538       13.01822 
1 1 1 17  24 21 o 15.09796 6.743464 0.1069393      5.062276 5.165036       7.851358 -3.491954      6.622709 20.59476 8.807999 14.92238 7.031788 5.672379       11.27062 
1 1 1 17  24 22 o 38.80999 6.877929 22.91922       6.266745 23.71846       8.624390 22.02518       9.121521 35.77281 9.665965 33.33708 10.24175 2.435730       14.08277 
1 1 1 17  24 23 o 24.77872 8.570447 11.33655       6.297876 17.17914       9.461260 6.688091       8.439193 27.59519 10.37135 20.65367 8.983169 6.941525       13.72087 
1 1 1 17  24 24 o 19.22055 8.565652 5.338408       8.120173 0.000000       0.000000 5.338408       8.120173 ?        ?        19.22055 8.565652 0.000000       8.565652 
1 1 1 17  24 25 o 25.83914 8.660338 13.81178       6.423235 16.10596       9.409636 11.80996       8.789674 24.63781 10.01215 22.20361 9.401186 2.434200       13.73410 
1 1 1 17  24 26 o 14.31321 6.715770 -0.4501482     5.927615 -6.959270      8.349559 6.164031       8.416670 13.88443 6.850388 18.51994 8.442021 -4.635509      10.87178 
1 1 1 17  24 27 o 18.05320 7.813791 6.318591       6.321377 3.426563       9.112887 9.000850       8.776171 16.99754 8.079795 19.29706 8.726489 -2.299515      11.89263 
1 1 1 17  25 0  o 71.23054 2.653107 62.17844       4.597244 58.97858       6.878369 64.76189       6.180457 69.09262 4.103728 72.54367 3.506494 -3.451050      5.397785 
1 1 1 17  25 1  o 19.25983 5.489162 4.724872       2.701166 5.219688       4.106138 4.347384       3.586437 20.83713 6.922993 19.20177 6.471546 1.635368       9.476748 
1 1 1 17  25 2  o 25.23967 6.922647 8.274403       4.385064 16.11784       5.938191 -1.132247      6.503069 35.16736 7.172462 17.80978 7.812781 17.35758       10.60584 
1 1 1 17  25 3  o 108.1858 2.593688 143.3050       6.837922 134.7466       10.08434 150.5892       9.303367 104.4935 3.967452 110.6410 3.454780 -6.147476      5.260815 
1 1 1 17  25 4  o 81.33115 3.935719 81.74361       7.777248 0.000000       0.000000 81.74361       7.777248 ?        ?        81.33115 3.935719 0.000000       3.935719 
1 1 1 17  25 5  o 38.54922 2.888287 18.33092       2.693538 18.38380       3.737451 18.27376       3.885328 38.37901 4.057549 38.22062 4.242920 0.1583862      5.870781 
1 1 1 17  25 6  o 28.86649 7.740022 11.06698       5.555860 12.23031       6.193695 6.275422       12.57003 30.26231 8.197481 28.26750 11.54017 1.994808       14.15536 
1 1 1 17  25 7  o 49.32655 6.065145 31.11587       7.137207 39.48084       8.395268 9.309750       13.55475 55.53687 6.315252 30.49837 12.14720 25.03850       13.69076 
1 1 1 17  25 8  f 29.13847 7.899436 11.41266       5.748736 12.33646       6.419099 7.669846       12.92066 30.19873 8.411823 28.96194 11.74592 1.236790       14.44733 
1 1 1 17  25 9  o 21.81330 7.311999 5.928649       4.578834 8.128036       6.139044 3.171124       6.874002 25.19931 8.466808 21.04821 8.555980 4.151100       12.03709 
1 1 1 17  25 10 o 39.73909 6.973430 20.94755       6.506878 21.73763       7.469618 18.46149       13.25005 40.05251 7.933686 35.65596 12.42571 4.396545       14.74251 
1 1 1 17  25 11 o 20.10023 7.233482 4.710721       4.520830 7.494152       6.209331 1.570870       6.594915 24.30031 8.503625 19.32087 8.160140 4.979441       11.78556 
1 1 1 17  25 12 f 49.72956 5.288259 31.80903       6.310443 42.37713       8.567750 19.27832       9.329454 56.88921 6.284826 36.16106 10.16592 20.72815       11.95178 
1 1 1 17  25 13 o 47.81384 5.546030 29.75326       6.342343 37.56594       8.527717 20.08248       9.487752 53.02456 6.752610 36.50342 10.24812 16.52114       12.27281 
1 1 1 17  25 14 o 44.59826 7.524998 27.58456       7.887513 0.000000       0.000000 27.58456       7.887513 ?        ?        44.59826 7.524998 0.000000       7.524998 
1 1 1 17  25 15 o 26.13754 7.408123 9.717377       4.933555 17.07713       7.657440 4.494205       6.450884 33.61914 9.118195 20.86189 8.356148 12.75725       12.36797 
1 1 1 17  25 16 o 29.09862 7.349366 12.23617       5.211994 19.96181       7.611408 5.415397       7.151788 36.32465 8.711125 21.82374 8.778713 14.50090       12.36728 
1 1 1 17  25 17 o 20.25848 7.343701 5.484898       4.670166 2.423634       6.828578 8.175075       6.401331 19.07311 8.186882 23.66501 8.594987 -4.591902      11.87008 
1 1 1 17  25 18 o 27.54212 7.694421 11.60976       5.362383 19.24821       8.347353 6.242518       6.997165 33.69253 9.664649 21.70709 8.700014 11.98543       13.00368 
1 1 1 17  25 19 o 22.01741 7.498314 7.313794       4.815570 10.62209       7.200214 4.636323       6.477468 25.23317 9.122414 19.86901 8.215958 5.364166       12.27682 
1 1 1 17  25 20 o 28.72450 8.049889 13.44036       5.859523 19.67200       8.528872 7.869679       8.063898 32.67699 9.876698 22.50465 9.221748 10.17234       13.51258 
1 1 1 17  25 21 o 23.87927 9.401510 10.40005       8.032710 0.000000       0.000000 10.40005       8.032710 ?        ?        23.87927 9.401510 0.000000       9.401510 
1 1 1 17  25 22 o 28.46685 10.14859 17.47901       8.876614 0.000000       0.000000 17.47901       8.876614 ?        ?        28.46685 10.14859 0.000000       10.14859 
1 1 1 17  25 23 o 20.12623 8.028826 6.985281       5.930950 9.736791       8.503942 4.379321       8.275964 21.92838 9.264069 18.83065 8.498747 3.097725       12.57186 
1 1 1 17  25 24 o 16.80749 7.354851 3.450150       5.731348 2.585021       8.340111 4.224292       7.889359 17.45496 8.115626 18.06102 8.209641 -0.6060619     11.54390 
1 1 1 17  25 25 o 17.73777 7.472260 5.231979       5.506985 11.04617       8.112867 0.2638872      7.499369 21.47435 9.059166 15.72340 7.431498 5.750948       11.71732 
1 1 1 17  25 26 o 12.67680 6.123294 -3.432456      5.719522 1.537920       8.371294 -7.783929      7.832784 16.23347 7.724405 13.12102 6.502806 3.112446       10.09717 
1 1 1 17  26 0  o 32.49385 4.104858 13.22732       3.177991 15.01710       4.303322 11.08025       4.713326 34.36594 5.309473 29.09915 6.774010 5.266796       8.606841 
1 1 1 17  26 1  o 13.44916 5.367945 1.182976       2.652524 3.960104       3.762445 -1.561301      3.740125 18.76665 6.615241 12.85898 5.765943 5.907673       8.775393 
1 1 1 17  26 2  o 81.99520 3.155277 82.71731       6.292898 93.03311       8.098288 66.99425       9.997931 86.76745 3.839521 72.97886 5.666183 13.78859       6.844527 
1 1 1 17  26 3  o 40.89049 3.494105 20.73757       3.448393 20.60408       5.911507 20.80643       4.245580 40.00306 6.270003 40.76654 4.340285 -0.7634811     7.625681 
1 1 1 17  26 4  o 67.03827 2.528504 55.16682       4.123286 54.90362       6.034271 55.39734       5.647353 66.58846 3.733642 66.95992 3.472806 -0.3714676     5.099065 
1 1 1 17  26 5  o 32.67385 2.919522 13.22215       2.300133 12.22653       3.348009 14.11214       3.165423 31.04231 4.561816 33.54806 3.947396 -2.505754      6.032586 
1 1 1 17  26 6  o 66.67849 2.367458 54.57356       3.840736 56.83002       5.490956 52.41206       5.374169 67.80252 3.333492 65.08836 3.400011 2.714165       4.761538 
1 1 1 17  26 7  o 13.19825 5.925512 -1.563872      3.963685 -5.142978      5.034579 4.271483       6.428498 12.96802 6.117005 21.52433 8.429621 -8.556302      10.41519 
1 1 1 17  26 8  o 66.31837 4.257673 55.06483       6.844503 67.84380       10.25167 44.78734       9.193700 72.82187 5.825469 58.71282 6.536405 14.10905       8.755609 
1 1 1 17  26 9  o 15.55005 6.532784 0.8465596      4.191161 -4.857370      5.381720 9.637780       6.681263 13.62868 6.396009 26.79027 8.828258 -13.16159      10.90170 
1 1 1 17  26 10 o 64.58904 4.771809 52.91796       7.457620 46.23909       9.518345 63.53613       12.00147 59.22724 6.713081 69.11933 7.232156 -9.892090      9.867600 
1 1 1 17  26 11 o 32.63090 7.711891 14.81832       6.034627 21.92315       6.834485 -10.31751      12.85510 40.13107 7.255576 20.23458 9.612184 19.89648       12.04315 
1 1 1 17  26 12 o 24.11178 7.111609 7.996930       4.463721 11.49586       6.214354 4.267509       6.415772 28.35426 8.398355 20.92033 8.348897 7.433929       11.84215 
1 1 1 17  26 13 o 27.10545 6.853027 10.23777       4.528462 10.98834       6.349537 9.460787       6.460325 27.51279 8.560909 25.80658 8.685632 1.706209       12.19547 
1 1 1 17  26 14 o 29.39343 7.354743 12.36287       5.254761 13.76134       6.960014 10.50899       8.013568 30.18134 8.874528 26.70741 9.628065 3.473930       13.09415 
1 1 1 17  26 15 o 24.56509 7.315979 8.732024       4.705492 14.52025       6.579001 2.670003       6.732804 30.88414 8.482811 19.33442 8.208923 11.54973       11.80443 
1 1 1 17  26 16 o 25.24072 7.482245 9.477020       4.930923 6.606957       6.968177 12.35567       6.978591 22.27495 8.760510 27.83264 9.013180 -5.557690      12.56917 
1 1 1 17  26 17 o 39.53152 6.044292 21.85953       5.638033 28.74022       8.815448 17.09697       7.334134 42.59241 8.785075 32.29442 8.989854 10.29799       12.56961 
1 1 1 17  26 18 o 21.40765 7.864834 6.782328       5.382780 10.61767       7.445976 2.583847       7.790506 25.15244 9.248511 19.29442 8.504506 5.858021       12.56430 
1 1 1 17  26 19 o 20.97364 8.964399 5.634421       8.123416 0.000000       0.000000 5.634421       8.123416 ?        ?        20.97364 8.964399 0.000000       8.964399 
1 1 1 17  26 20 o 19.82594 8.161473 5.474604       6.353620 0.000000       0.000000 5.474604       6.353620 ?        ?        19.82594 8.161473 0.000000       8.161473 
1 1 1 17  26 21 o 30.47754 8.652508 16.80593       6.724583 11.48362       9.538357 22.06542       9.481889 23.61768 9.884226 31.82425 10.51833 -8.206570      14.43375 
1 1 1 17  26 22 o 17.40764 7.407141 3.832183       5.502620 -1.746340      7.638592 9.849836       7.933546 15.75396 7.462034 22.15536 9.120116 -6.401401      11.78382 
1 1 1 17  26 23 o 27.60648 8.759356 15.47165       6.615658 23.26054       10.21679 9.847775       8.681496 29.27528 10.82140 21.26188 9.179674 8.013403       14.19046 
1 1 1 17  26 24 o 20.09828 8.112057 8.040854       6.129375 8.536860       9.290102 7.658503       8.156584 19.90883 8.993110 19.52280 8.649053 0.3860321      12.47726 
1 1 1 17  26 25 o 21.34245 8.330138 10.08559       6.260179 13.16657       9.264042 7.496341       8.492633 21.66796 9.418264 18.89791 8.561372 2.770050       12.72795 
1 1 1 17  27 0  o 64.10110 2.815844 50.53369       4.387825 53.53139       6.597814 48.15645       5.875457 65.62958 4.146582 62.30939 3.888863 3.320190       5.684839 
1 1 1 17  27 1  o 48.52456 2.993986 29.04990       3.523119 32.86103       5.316375 26.06563       4.704443 51.29988 4.291987 45.65360 4.278453 5.646278       6.060224 
1 1 1 17  27 2  o 41.56695 3.189032 21.39493       3.205631 22.21412       4.662317 20.66044       4.414704 41.99700 4.632497 40.50815 4.550837 1.488853       6.493855 
1 1 1 17  27 3  o 20.51916 5.043382 5.475541       2.503667 10.83586       3.556792 0.2110290      3.524864 28.98554 5.227776 13.91812 5.925563 15.06742       7.902021 
1 1 1 17  27 4  o 15.32143 5.184561 2.771590       2.301851 -0.3549146     3.489350 5.180451       3.062815 13.29965 5.780542 20.01869 5.887300 -6.719037      8.250756 
1 1 1 17  27 5  o 8.100971 3.731693 -1.276807      1.703644 -2.809236      2.578827 -0.9009563E-01 2.269365 9.261436 4.371443 10.95366 4.710916 -1.692227      6.426682 
1 1 1 17  27 6  f 94.94961 2.466438 110.8215       5.702058 115.4510       8.332253 106.7438       7.819960 96.46275 3.550654 92.78917 3.464451 3.673584       4.960804 
1 1 1 17  27 7  f 29.75961 6.799595 11.92171       4.822942 12.57809       6.761688 11.24191       6.881223 30.04502 8.722873 28.54447 8.916814 1.500551       12.47390 
1 1 1 17  27 8  o 65.40016 4.367953 53.90845       6.921435 63.03360       10.46393 46.81041       9.228780 69.58153 6.237229 59.77148 6.437365 9.810043       8.963408 
1 1 1 17  27 9  o 42.36535 5.398181 23.29101       5.446661 23.14981       7.464291 23.45182       7.965611 40.98345 7.757854 40.94681 8.268082 0.3664017E-01  11.33779 
1 1 1 17  27 10 o 76.59682 4.517678 74.54666       8.395165 76.42215       11.11960 72.06049       12.80261 76.36155 6.024322 72.96826 7.297738 3.393288       9.463057 
1 1 1 17  27 11 f 42.15212 5.652034 23.45098       5.659597 27.45274       7.955769 19.35093       8.052873 44.35872 7.635198 36.09325 9.145927 8.265465       11.91403 
1 1 1 17  27 12 o 30.33532 8.186756 13.46924       6.191265 17.22141       7.139768 2.094579       12.43118 34.09596 8.596443 23.63675 10.56162 10.45921       13.61788 
1 1 1 17  27 13 o 28.55557 7.150821 11.68788       4.964527 10.90675       7.096743 12.43649       6.947441 26.87040 9.103313 28.52061 8.966903 -1.650213      12.77794 
1 1 1 17  27 14 o 45.77966 5.329952 27.99074       5.835024 35.77782       8.623930 21.41584       7.924328 50.05652 7.283297 37.18253 8.870055 12.87400       11.47712 
1 1 1 17  27 15 o 36.30811 7.091762 19.17018       6.049559 23.99911       7.873107 12.20938       9.452575 39.43568 8.447008 26.99075 10.31510 12.44493       13.33241 
1 1 1 17  27 16 o 17.10564 7.653123 0.3051812      6.549556 0.000000       0.000000 0.3051812      6.549556 ?        ?        17.10564 7.653123 0.000000       7.653123 
1 1 1 17  27 17 o 16.41839 7.334836 0.3708391      5.992554 0.000000       0.000000 0.3708391      5.992554 ?        ?        16.41839 7.334836 0.000000       7.334836 
1 1 1 17  27 18 o 22.68435 7.534822 8.117558       4.864052 11.91230       7.547869 5.422386       6.361017 25.76645 9.336614 20.07329 8.203831 5.693153       12.42880 
1 1 1 17  27 19 o 30.90549 7.355026 15.19930       5.458815 15.59453       8.200740 14.88485       7.314847 28.15839 9.777737 28.26468 9.233171 -0.1062908     13.44826 
1 1 1 17  27 20 o 23.34785 7.962454 9.509939       5.430482 10.87927       8.821658 8.674421       6.890859 23.31524 9.609305 21.99421 8.692698 1.321028       12.95769 
1 1 1 17  27 21 o 24.65138 8.459605 11.60654       6.131907 16.24710       9.358608 8.115640       8.116982 26.06179 10.18134 20.93799 8.955297 5.123804       13.55939 
1 1 1 17  27 22 o 29.65510 8.633139 17.22997       6.615188 26.90082       10.61713 11.09327       8.457500 31.60328 11.11487 22.15646 9.292357 9.446814       14.48752 
1 1 1 17  27 23 o 19.45603 7.900810 7.139025       5.854656 8.369596       8.326757 5.935865       8.233497 19.98691 8.801709 18.68854 8.451739 1.298370       12.20254 
1 1 1 17  27 24 o 19.82784 8.922649 9.277217       9.045981 9.277217       9.045981 0.000000       0.000000 19.82784 8.922649 ?        ?        0.000000       8.922649 
1 1 1 17  28 0  o 65.31377 2.783664 52.53978       4.420390 50.85328       6.411638 54.06760       6.102559 63.84098 4.143679 65.95229 3.813307 -2.111309      5.631287 
1 1 1 17  28 1  o 65.54803 2.716851 52.90891       4.330311 55.62032       6.421305 50.64735       5.864475 66.81857 3.961352 63.81170 3.788364 3.006874       5.481242 
1 1 1 17  28 2  o 16.62770 5.303617 3.444420       2.422712 2.982776       3.390782 3.925887       3.462818 16.86963 6.234423 18.25745 6.352881 -1.387821      8.900963 
1 1 1 17  28 3  o 22.45153 6.085979 6.665998       3.412461 4.429786       3.729993 18.14789       8.451979 19.16279 6.597115 35.80487 9.522376 -16.64209      11.58437 
1 1 1 17  28 4  o 73.19322 2.599497 65.98779       4.629202 71.51175       6.899477 61.46500       6.243000 75.76367 3.748606 70.26431 3.658651 5.499367       5.238108 
1 1 1 17  28 5  o 74.54774 3.513810 69.13594       6.365389 0.000000       0.000000 69.13594       6.365389 ?        ?        74.54774 3.513810 0.000000       3.513810 
1 1 1 17  28 6  o 53.70475 2.440819 35.55938       3.186013 38.91646       4.636038 32.55496       4.385777 55.87838 3.421004 51.04603 3.547804 4.832355       4.928507 
1 1 1 17  28 7  o 20.95956 7.195343 5.584589       4.436183 12.18965       6.361154 -0.6693683     6.189776 29.31907 8.445174 17.08847 7.554261 12.23060       11.33084 
1 1 1 17  28 8  o 49.57506 4.953317 31.64636       5.904022 42.56976       8.930773 23.16636       7.868788 56.45130 6.617479 40.45853 8.260791 15.99277       10.58450 
1 1 1 17  28 9  o 31.83963 6.458531 13.82760       4.839574 12.82778       6.604312 14.98713       7.112264 29.65879 8.623684 31.90926 8.841622 -2.250475      12.35080 
1 1 1 17  28 10 o 56.47713 4.966671 41.37569       6.766007 44.97398       8.984233 36.66083       10.28411 57.69661 6.503058 50.16446 8.729581 7.532143       10.88556 
1 1 1 17  28 11 o 11.98311 5.616720 -3.384917      4.128110 1.231932       5.943865 -7.686975      5.737652 17.66669 7.611329 12.62143 6.105405 5.045261       9.757474 
1 1 1 17  28 12 o 33.43703 6.579381 15.68998       5.170016 14.32591       6.418410 18.21024       8.724314 30.72518 8.354126 33.35036 9.968801 -2.625179      13.00648 
1 1 1 17  28 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  28 14 o 25.38048 9.484332 10.35614       7.888377 0.000000       0.000000 10.35614       7.888377 ?        ?        25.38048 9.484332 0.000000       9.484332 
1 1 1 17  28 15 o 18.92303 7.129069 4.720331       4.476249 6.361417       7.304126 3.733278       5.664645 21.70148 8.820317 18.70724 7.704162 2.994244       11.71120 
1 1 1 17  28 16 o 20.26818 7.645168 5.880254       5.151334 7.015058       7.103619 4.621603       7.481213 21.84018 8.761628 20.22789 8.622955 1.612295       12.29315 
1 1 1 17  28 17 o 19.10792 7.397313 5.070918       4.905345 3.763077       7.625316 5.994245       6.407052 19.44673 8.497214 20.49165 8.285556 -1.044916      11.86815 
1 1 1 17  28 18 o 25.94938 7.653351 11.15915       5.169761 16.46466       8.026006 7.396985       6.758571 28.99971 9.680055 21.32183 8.548758 7.677881       12.91452 
1 1 1 17  28 19 o 46.23663 5.651573 31.02388       6.235625 38.34310       9.896873 26.20558       8.029947 46.08117 9.136168 38.30665 8.788990 7.774521       12.67738 
1 1 1 17  28 20 o 17.06590 7.123749 3.814010       4.935415 -1.560067      7.441373 8.034562       6.594560 15.62987 7.391903 20.91508 8.423969 -5.285216      11.20730 
1 1 1 17  28 21 o 15.95737 6.951535 2.667188       5.070497 -0.5277825     6.660327 7.071607       7.819994 15.23013 7.137281 19.73320 8.614038 -4.503071      11.18671 
1 1 1 17  28 22 o 22.19579 9.663072 12.99923       9.784490 12.99923       9.784490 0.000000       0.000000 22.19579 9.663072 ?        ?        0.000000       9.663072 
1 1 1 17  28 23 o 19.91831 8.221255 8.314084       6.469755 13.77701       9.217010 3.008072       9.083677 22.31778 9.544078 17.25146 8.161242 5.066319       12.55768 
1 1 1 17  29 0  o 41.99592 3.324507 21.96013       3.374546 25.05205       4.788000 18.90836       4.756811 44.50255 4.475740 38.33769 5.227637 6.164856       6.881892 
1 1 1 17  29 1  o 31.25662 4.098854 12.39421       3.046898 15.29619       4.360930 9.626554       4.258812 34.33263 5.389711 26.75098 6.579350 7.581657       8.505107 
1 1 1 17  29 2  o 25.35740 4.696590 8.339673       2.795322 9.007062       3.961977 7.678177       3.944446 25.89540 6.332093 23.89952 6.569855 1.995876       9.124603 
1 1 1 17  29 3  o 86.84975 2.598301 93.02346       5.492948 99.80808       8.220826 87.55135       7.382950 89.36887 3.783352 83.77860 3.624846 5.590263       5.239586 
1 1 1 17  29 4  o 62.05305 2.741848 47.63427       4.135891 51.00629       6.035251 44.64854       5.679052 63.73090 3.904803 59.59986 3.932129 4.131039       5.541581 
1 1 1 17  29 5  o 39.16779 3.004540 19.11843       2.845867 18.09476       3.935904 20.23994       4.119714 37.63424 4.372995 39.85209 4.310621 -2.217846      6.140403 
1 1 1 17  29 6  o 11.80528 4.288867 1.486498       1.594074 0.3112667E-01  2.223840 3.024600       2.286174 10.89365 4.673923 15.59577 5.165201 -4.702114      6.965979 
1 1 1 17  29 7  o 19.31509 7.223246 4.317907       4.577259 9.962165       6.612534 -0.8745472     6.342360 26.38427 8.785936 16.95164 7.561299 9.432638       11.59163 
1 1 1 17  29 8  o 42.18527 5.957896 23.85663       5.954463 32.83060       8.098169 13.29461       8.785528 48.79578 7.011425 29.38601 10.12442 19.40977       12.31519 
1 1 1 17  29 9  o 104.4731 7.173224 151.3670       18.15146 0.000000       0.000000 151.3670       18.15146 ?        ?        104.4731 7.173224 0.000000       7.173224 
1 1 1 17  29 10 o 19.42267 8.489214 1.639694       7.615874 0.000000       0.000000 1.639694       7.615874 ?        ?        19.42267 8.489214 0.000000       8.489214 
1 1 1 17  29 11 o 27.13669 8.724769 11.48910       6.546710 0.000000       0.000000 11.48910       6.546710 ?        ?        27.13669 8.724769 0.000000       8.724769 
1 1 1 17  29 12 o 13.71271 6.135101 -0.6719224     4.208958 -5.625850      6.061061 3.941917       5.849316 13.67439 6.525124 19.25788 7.868327 -5.583485      10.22193 
1 1 1 17  29 13 o 55.55509 4.857565 41.09238       6.510169 49.45533       10.48083 35.83872       8.307052 57.61900 7.653486 49.64085 7.066393 7.978157       10.41680 
1 1 1 17  29 14 o 19.51044 7.893832 4.663686       5.819712 3.700486       6.747200 7.462556       11.50156 19.32002 8.210828 23.51772 10.35097 -4.197699      13.21213 
1 1 1 17  29 15 o 26.92895 7.217115 11.23162       4.831916 5.808750       7.087454 15.94101       6.604773 20.77093 8.591995 30.94687 8.499159 -10.17594      12.08545 
1 1 1 17  29 16 o 28.91710 7.429941 13.32750       5.263487 15.10324       7.931109 11.92983       7.036348 28.18927 9.622453 25.69989 9.047647 2.489380       13.20801 
1 1 1 17  29 17 o 19.02110 7.782693 5.057151       5.732815 6.135872       7.814877 3.800295       8.435496 20.46292 8.770344 19.33342 8.664934 1.129509       12.32883 
1 1 1 17  29 18 o 28.55306 7.710271 13.90307       5.489621 22.66337       8.760895 8.239948       7.043963 33.08093 10.01257 21.44230 8.681239 11.63863       13.25200 
1 1 1 17  29 19 o 14.64320 6.446836 1.329285       4.464547 7.050344       6.691108 -3.261654      5.993915 20.05842 8.327343 13.62105 6.496679 6.437364       10.56179 
1 1 1 17  29 20 o 11.17426 5.562921 -10.19677      5.990448 -6.778666      7.225280 -17.71309      10.71432 13.39957 6.563116 13.75133 6.928662 -0.3517685     9.543629 
1 1 1 17  29 21 o 16.89667 7.246188 4.051297       5.340581 3.116282       6.990049 5.362489       8.277596 16.93734 7.710059 18.43533 8.391257 -1.497992      11.39553 
1 1 1 17  30 0  o 16.60191 5.681536 3.344054       2.765358 6.765387       3.707770 -0.9448152     4.151323 22.41909 6.444464 13.85106 6.151480 8.568029       8.909087 
1 1 1 17  30 1  o 13.86875 5.383147 1.704101       2.602889 0.2195638      3.568909 3.391060       3.804453 13.81018 5.923069 17.64799 6.588217 -3.837810      8.859308 
1 1 1 17  30 2  o 32.61046 3.917899 13.51801       3.051203 12.94132       4.241873 14.13629       4.392157 31.16772 5.798255 32.63755 5.731354 -1.469837      8.152802 
1 1 1 17  30 3  o 17.66950 5.233738 4.099743       2.413385 2.527126       3.085779 6.576916       3.872856 15.65278 5.914252 22.02329 6.655282 -6.370512      8.903436 
1 1 1 17  30 4  o 76.58779 3.997092 74.14951       7.434197 70.54774       8.993750 81.91917       13.20940 73.93454 5.021602 77.65076 7.057769 -3.716225      8.661904 
1 1 1 17  30 5  o 25.74896 4.103503 8.577334       2.488492 5.961836       3.774060 10.58912       3.309954 20.97592 6.610905 28.32205 4.977371 -7.346134      8.275161 
1 1 1 17  30 6  o 21.85300 5.189762 6.437002       2.722372 0.000000       0.000000 6.437002       2.722372 ?        ?        21.85300 5.189762 0.000000       5.189762 
1 1 1 17  30 7  o 31.90211 8.494059 15.34083       6.720311 0.000000       0.000000 15.34083       6.720311 ?        ?        31.90211 8.494059 0.000000       8.494059 
1 1 1 17  30 8  f 50.19297 4.676899 32.88459       5.654704 25.40023       8.151142 39.82828       7.851206 41.16774 8.409547 54.11192 6.057828 -12.94418      10.36425 
1 1 1 17  30 9  o 15.78600 6.643937 1.509544       4.347359 2.111455       6.267912 0.9515553      6.034896 18.33134 7.855567 17.28847 7.556630 1.042873       10.90012 
1 1 1 17  30 10 o 20.61360 6.972603 5.990635       4.163333 9.157398       5.704043 2.380069       6.090636 24.52210 8.159948 18.24241 7.778598 6.279686       11.27348 
1 1 1 17  30 11 o 24.40772 7.492143 9.009846       4.882533 21.14532       7.329767 -0.6701232     6.546344 36.81193 8.361887 16.60559 7.520366 20.20635       11.24620 
1 1 1 17  30 12 o 41.96722 5.642887 24.37002       5.624848 29.52214       8.501170 20.35812       7.501721 43.42820 8.335899 35.39201 8.748485 8.036190       12.08401 
1 1 1 17  30 13 o 22.51556 7.513768 7.823559       4.835752 15.57430       7.383144 2.000604       6.399434 29.91501 9.218586 17.77507 7.775136 12.13994       12.05965 
1 1 1 17  30 14 o 43.44971 5.689782 26.66613       5.879856 39.57742       9.097650 17.40412       7.705433 50.47912 7.633915 31.03059 9.389684 19.44852       12.10136 
1 1 1 17  30 15 o 19.38417 7.715318 5.381212       5.464617 2.917818       6.278039 13.08263       11.10050 17.83638 7.753019 24.99440 10.57305 -7.158020      13.11102 
1 1 1 17  30 16 o 18.22241 7.340118 4.592578       5.007280 14.96940       8.025723 -2.021059      6.407259 27.14313 9.652761 14.92926 6.997594 12.21387       11.92234 
1 1 1 17  30 17 o 23.02161 8.689370 10.15841       6.657039 9.715651       8.067843 11.10293       11.78363 22.22272 9.177324 22.55051 10.16265 -0.3277950     13.69316 
1 1 1 17  30 18 o 19.22991 8.417985 5.782628       7.514124 5.782628       7.514124 0.000000       0.000000 19.22991 8.417985 ?        ?        0.000000       8.417985 
1 1 1 17  30 19 o 14.49221 6.551907 0.7465125      4.943342 6.862596       7.695376 -3.550412      6.450183 19.55824 8.541247 13.76676 6.612296 5.791473       10.80164 
1 1 1 17  30 20 o 12.59820 5.969408 -2.246603      4.896728 -7.757591      7.088295 2.784322       6.772530 12.82522 6.324764 16.67332 7.589593 -3.848094      9.879502 
1 1 1 17  31 0  o 23.61873 5.887668 7.588996       3.376681 5.943231       5.293336 8.718231       4.384677 21.59374 7.819641 25.00056 6.947835 -3.406820      10.46036 
1 1 1 17  31 1  o 15.13702 5.620260 2.489910       2.761431 5.199414       3.785231 -0.5927308     4.037467 19.87960 6.647975 13.79131 6.098695 6.088289       9.021622 
1 1 1 17  31 2  f 36.16705 3.570968 16.57578       3.106254 16.99158       4.280858 16.11342       4.514240 35.97567 5.019460 34.77075 5.511219 1.204922       7.454429 
1 1 1 17  31 3  o 30.30163 3.834167 11.76855       2.767936 11.12504       3.694791 12.59162       4.178613 28.75052 5.473480 30.44374 5.844906 -1.693216      8.007615 
1 1 1 17  31 4  o 32.68269 3.473770 13.57419       2.724324 17.53988       3.887240 9.746093       3.819211 36.75654 4.428964 26.55356 6.039072 10.20297       7.489066 
1 1 1 17  31 5  o 32.10614 3.179857 13.03834       2.455245 15.80251       3.761283 10.98598       3.241001 34.75393 4.550347 28.78414 4.788685 5.969791       6.605843 
1 1 1 17  31 6  o 23.44243 3.883101 7.160869       2.140696 7.419742       2.966591 6.879627       3.092111 23.28152 5.342404 22.28241 5.678755 0.9991093      7.796765 
1 1 1 17  31 7  o 37.37097 3.054517 17.63140       2.757472 38.04934       8.278975 15.08370       2.924451 52.03378 6.683263 34.33836 3.545789 17.69543       7.565621 
1 1 1 17  31 8  o 20.68045 8.019240 5.544650       5.771980 0.000000       0.000000 5.544650       5.771980 ?        ?        20.68045 8.019240 0.000000       8.019240 
1 1 1 17  31 9  f 36.30698 5.759271 18.25007       4.925674 24.35712       7.496082 13.60943       6.534427 40.01860 7.966807 29.10216 8.609891 10.91644       11.73031 
1 1 1 17  31 10 o 26.40934 7.433856 10.69219       4.985444 4.182607       7.474969 15.90788       6.690964 20.20037 8.615541 31.34953 8.532059 -11.14916      12.12533 
1 1 1 17  31 11 o 15.09344 6.543221 0.9537799      4.447100 10.88053       6.813748 -6.412628      5.869627 25.44133 8.907529 12.89347 6.221819 12.54786       10.86532 
1 1 1 17  31 12 o 25.13456 7.141292 9.825948       4.578918 10.62074       6.470494 9.028662       6.480654 24.95549 8.684063 23.33936 8.620127 1.616135       12.23599 
1 1 1 17  31 13 o 42.36055 5.519565 25.33568       5.562362 32.80130       8.511560 19.77068       7.348673 45.10614 8.038293 33.71737 8.837952 11.38878       11.94670 
1 1 1 17  31 14 o 21.91250 7.961972 8.038088       5.493965 9.311171       6.580276 5.108446       9.982126 22.92476 8.642137 20.55993 9.301279 2.364834       12.69647 
1 1 1 17  31 15 f 15.71769 6.861448 1.828271       4.962072 -0.2638168     5.641347 8.980058       10.43038 14.97722 6.859047 21.95524 9.750693 -6.978013      11.92152 
1 1 1 17  31 16 o 25.44239 8.927058 12.93775       6.846037 15.21650       8.752301 9.345925       10.98831 25.83875 9.912930 21.63204 9.775188 4.206715       13.92194 
1 1 1 17  31 17 o 11.42419 5.503950 -4.228335      4.549202 -10.89476      6.882564 0.9437779      6.062306 12.04271 5.989915 15.66650 7.150275 -3.623796      9.327675 
1 1 1 17  31 18 o 25.79499 7.545799 11.99182       5.043006 16.76030       8.157907 9.042578       6.415701 26.60660 9.696979 21.25577 8.391766 5.350832       12.82393 
1 1 1 17  31 19 o 9.800352 4.922871 -11.47474      5.195250 -11.13278      7.129197 -11.86199      7.586492 12.02122 5.997921 12.27806 6.135474 -0.2568407     8.580158 
1 1 1 17  32 0  o 13.56243 5.700152 0.8172917      3.192977 9.485358       5.701673 -3.143089      3.853981 25.39252 8.140114 11.59719 5.433003 13.79533       9.786674 
1 1 1 17  32 1  o 53.62287 3.444059 36.35199       4.476662 33.65113       7.453214 37.87625       5.599164 49.55122 6.315728 54.22020 4.272150 -4.668972      7.624938 
1 1 1 17  32 2  o 11.33500 4.848795 0.2103229      2.380259 -1.351885      3.147516 2.297198       3.637866 11.42984 5.191515 15.78614 6.291140 -4.356306      8.156610 
1 1 1 17  32 3  o 28.24373 4.107558 10.39608       2.744308 6.871392       3.688458 14.76675       4.107318 22.04259 6.454757 33.13452 5.262507 -11.09192      8.328137 
1 1 1 17  32 4  o 22.17768 4.845667 6.650158       2.545437 6.458518       3.440919 6.881786       3.782918 21.40565 6.224870 21.98503 6.562615 -0.5793819     9.045271 
1 1 1 17  32 5  o 12.06432 4.899166 1.022723       2.251149 0.4586246      2.686605 2.352225       4.124495 12.17188 5.177348 16.28130 6.624072 -4.109419      8.407334 
1 1 1 17  32 6  o 15.35308 4.637952 3.141141       1.881072 5.717887       2.737092 0.8347723      2.589513 20.27699 5.430756 12.40533 5.167773 7.871667       7.496599 
1 1 1 17  32 7  o 40.22420 3.678935 20.84219       3.566280 43.35997       9.706117 17.32780       3.834492 53.99965 7.584751 36.20870 4.438402 17.79094       8.787938 
1 1 1 17  32 8  o 33.94163 6.502095 16.66452       5.182282 32.50063       8.626169 7.721246       6.482494 46.00446 7.983919 22.58369 8.563236 23.42077       11.70778 
1 1 1 17  32 9  o 15.03190 6.836183 -0.9051440     5.478962 0.000000       0.000000 -0.9051440     5.478962 ?        ?        15.03190 6.836183 0.000000       6.836183 
1 1 1 17  32 10 o 38.56507 7.766684 23.35209       7.046328 29.90651       9.025628 13.12199       11.27587 42.06662 9.071597 25.80354 10.76911 16.26308       14.08076 
1 1 1 17  32 11 o 36.92556 7.506946 21.44112       6.524580 27.89635       8.095121 9.472914       11.02255 41.16381 8.355737 23.36401 10.21236 17.79980       13.19510 
1 1 1 17  32 12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 17  32 13 o 29.51496 7.438100 14.33696       5.347003 15.13084       7.798872 13.63277       7.345120 27.36151 9.533112 26.32638 9.245991 1.035130       13.28038 
1 1 1 17  32 14 o 13.16265 6.069476 -1.112803      4.523025 -4.675804      6.422065 2.394073       6.371283 13.64708 6.565885 17.03170 7.588960 -3.384624      10.03510 
1 1 1 17  32 15 o 14.14756 6.250759 0.9556819      4.232392 1.173286       6.097549 0.7533682      5.879421 15.94089 7.234692 15.53172 7.070541 0.4091663      10.11599 
1 1 1 17  32 16 o 13.99830 6.403751 -0.7823839E-01 4.899511 1.366069       7.372658 -1.220575      6.556790 16.64655 7.701824 14.90402 7.014960 1.742533       10.41767 
1 1 1 17  32 17 o 21.85789 8.834805 10.26359       7.281720 24.92311       9.315312 -12.76636      11.67573 32.04634 10.41616 15.05806 7.537579 16.98827       12.85735 
1 1 1 17  33 0  o 28.81696 4.646867 11.02418       3.152238 11.12669       4.489748 10.92452       4.426794 27.82082 6.702303 27.58551 6.661175 0.2353077      9.449450 
1 1 1 17  33 1  o 17.63944 6.076936 4.097466       3.165154 6.486736       6.040019 3.192973       3.716280 21.77748 8.263906 16.81597 6.457387 4.961510       10.48761 
1 1 1 17  33 2  o 65.99277 2.980940 54.76494       4.781488 56.94876       6.631015 52.39955       6.901162 66.37392 4.119958 63.30824 4.502666 3.065689       6.103118 
1 1 1 17  33 3  o 10.07004 4.551013 -0.9299586     2.382545 0.4537514      3.414890 -2.242359      3.325734 13.38259 5.767428 11.03465 5.128588 2.347943       7.717878 
1 1 1 17  33 4  o 20.56186 5.131448 5.850704       2.562863 4.732699       3.448481 7.230060       3.830400 18.56517 6.344831 22.27144 6.592739 -3.706263      9.149922 
1 1 1 17  33 5  o 8.390676 3.885694 -1.348264      1.883077 -3.633260      2.478518 1.771614       2.896131 8.276200 4.005710 13.98141 5.599366 -5.705212      6.884665 
1 1 1 17  33 6  o 9.886988 4.287713 -0.1200311E-01 1.911031 1.651556       2.608709 -1.938665      2.807432 13.38011 5.329036 10.11739 4.705587 3.262719       7.109232 
1 1 1 17  33 7  o 17.77019 5.844300 4.426939       2.928550 6.739597       6.513762 3.841039       3.278596 21.38460 8.451583 17.00133 6.154467 4.383268       10.45499 
1 1 1 17  33 8  o 15.51782 5.129817 3.261617       2.255269 3.029356       7.134280 3.287403       2.377170 18.74089 8.203224 15.61299 5.268744 3.127904       9.749490 
1 1 1 17  33 9  o 33.43325 6.324838 16.53397       4.964350 26.37597       7.572878 9.117269       6.573927 40.45996 7.964344 23.10565 8.653284 17.35431       11.76053 
1 1 1 17  33 10 o 14.34297 6.707972 -2.237461      5.833657 0.000000       0.000000 -2.237461      5.833657 ?        ?        14.34297 6.707972 0.000000       6.707972 
1 1 1 17  33 11 o 32.05438 7.081413 16.33574       5.383809 11.76537       7.931157 20.24147       7.331822 24.33894 9.410480 33.40853 8.861542 -9.069590      12.92610 
1 1 1 17  33 12 o 13.97329 6.347495 -0.2387998     4.706927 9.256460       7.069154 -7.801197      6.308756 22.24663 8.800670 12.48048 6.117052 9.766149       10.71775 
1 1 1 17  33 13 o 79.08327 5.360493 90.04796       10.26955 102.6894       14.66080 77.86974       14.38966 78.16605 7.800739 64.24581 9.475247 13.92024       12.27322 
1 1 1 17  33 14 o 31.52623 7.436412 16.89335       5.619896 22.09685       8.824348 13.34273       7.289312 31.28163 10.13569 25.06419 9.161357 6.217443       13.66245 
1 1 1 17  33 15 o 30.90866 7.495886 16.56483       5.587166 19.86122       8.173641 13.67368       7.654750 29.77339 9.762187 24.68927 9.318023 5.084120       13.49540 
1 1 1 17  34 0  o 39.85376 3.919415 20.61713       3.757313 24.92965       5.174794 15.80858       5.464303 43.04731 5.027557 32.69485 7.064888 10.35247       8.671158 
1 1 1 17  34 1  o 26.63362 6.196042 10.22202       3.945431 16.28518       6.774549 7.109997       4.853470 31.71013 8.566268 21.84259 7.525114 9.867548       11.40212 
1 1 1 17  34 2  o 8.720025 4.197999 -3.482342      2.634856 -7.667373      3.590788 1.399699       3.878297 8.822193 4.377609 14.82696 6.259686 -6.004769      7.638529 
1 1 1 17  34 3  o 38.96742 3.643531 19.65835       3.419758 29.04917       4.951353 11.09257       4.728853 46.83656 4.389271 26.97977 7.098208 19.85679       8.345674 
1 1 1 17  34 4  o 11.24433 4.688027 0.6843289      2.133624 0.5703709E-01  3.166427 1.206014       2.887612 12.43535 5.453512 13.18116 5.471208 -0.7458086     7.724954 
1 1 1 17  34 5  o 17.00373 4.934330 4.025628       2.164135 3.234021       3.011616 4.870857       3.111948 15.91228 5.876429 18.43466 6.022349 -2.522387      8.414339 
1 1 1 17  34 6  o 6.176955 3.075712 -4.397757      1.835019 -4.744425      2.076992 -3.164573      3.917348 6.654693 3.306715 11.33969 5.363018 -4.684998      6.300502 
1 1 1 17  34 7  o 15.04871 5.350023 2.986447       2.465252 8.654562       6.652828 2.084263       2.654206 22.52972 8.642806 13.84463 5.418135 8.685090       10.20070 
1 1 1 17  34 8  o 14.58849 5.028677 2.852756       2.167474 8.144690       6.322869 2.148088       2.307275 21.86618 8.416102 13.50141 5.111211 8.364772       9.846586 
1 1 1 17  34 9  o 25.98641 3.515252 8.917153       2.169037 25.32153       8.182046 7.677170       2.249521 37.31956 9.083727 23.80849 4.020242 13.51107       9.933601 
1 1 1 17  34 10 o 42.52220 6.954479 28.42415       6.957490 28.37115       9.241128 28.49349       10.57122 37.86190 9.904268 35.35443 11.05314 2.507469       14.84137 
1 1 1 17  34 11 o 15.87872 7.227894 0.7995762      6.142387 0.000000       0.000000 0.7995762      6.142387 ?        ?        15.87872 7.227894 0.000000       7.227894 
1 1 1 17  34 12 f 53.14549 6.317929 43.45887       8.022378 45.23137       10.92237 41.38249       11.82163 48.24060 9.628626 42.50478 11.24210 5.735817       14.80187 
1 1 1 17  34 13 o 41.85122 6.409824 27.38388       6.329329 46.37935       10.55515 16.71873       7.909022 49.62448 9.062175 27.40932 9.596766 22.21516       13.19928 
1 1 1 17  35 0  o 17.32616 5.617502 4.190452       2.710329 2.786356       3.792350 5.656382       3.874954 16.04196 6.413231 19.67500 6.725688 -3.633047      9.293245 
1 1 1 17  35 1  o 33.39856 4.135561 14.80356       3.294027 17.64127       5.001433 12.62963       4.377567 34.96095 6.091797 29.28704 6.319379 5.673906       8.777502 
1 1 1 17  35 2  o 14.71969 5.883054 2.235772       3.190388 8.373918       6.858223 0.5406210      3.604103 22.56989 8.744217 13.48280 5.867317 9.087086       10.53028 
1 1 1 17  35 3  o 33.70301 3.946345 15.03734       3.179852 19.44959       4.737830 11.42062       4.289501 37.20155 5.382391 27.50022 6.503585 9.701338       8.441964 
1 1 1 17  35 4  o 12.91924 5.044127 1.748946       2.295984 1.310798       3.480311 2.086573       3.055106 13.95026 5.911572 14.29544 5.742106 -0.3451757     8.241266 
1 1 1 17  35 5  o 14.27520 4.942398 2.696934       2.094631 2.303370       3.133778 3.014755       2.816130 14.60021 5.832195 15.27879 5.675131 -0.6785784     8.137666 
1 1 1 17  35 6  o 12.32042 4.871853 1.508863       2.165489 3.028572       3.194986 0.2175116      2.945174 15.51825 5.980030 12.01660 5.264988 3.501647       7.967487 
1 1 1 17  35 7  o 21.22363 5.219818 6.540368       2.680642 19.53319       7.485458 4.628975       2.871056 32.29811 9.115149 17.72392 5.784203 14.57419       10.79551 
1 1 1 17  35 8  o 21.14728 5.566453 6.666411       2.907217 14.56196       7.550437 5.292104       3.150089 26.76946 9.376400 18.66531 6.056451 8.104156       11.16232 
1 1 1 17  35 9  o 24.04787 4.183293 7.955937       2.362520 22.11849       8.767131 6.846971       2.453272 32.11775 10.06950 21.92965 4.729882 10.18810       11.12504 
1 1 1 17  35 10 o 31.03624 7.672256 16.56751       5.769282 25.88224       9.419576 10.97558       7.298384 34.15550 10.39135 23.17729 9.009115 10.97821       13.75297 
1 1 1 17  36 0  o 33.73000 4.130604 15.21566       3.324430 20.38976       5.062274 11.29223       4.408204 37.72922 5.682100 27.06286 6.716097 10.66635       8.797284 
1 1 1 17  36 1  o 10.46223 4.750936 -0.8897908     2.634103 1.613887       3.951693 -2.891750      3.533634 14.76763 6.280193 10.76262 5.091141 4.005008       8.084586 
1 1 1 17  36 2  o 19.77815 6.144311 5.893029       3.272211 7.942995       4.610741 3.812795       4.644655 22.11532 7.335683 17.39889 7.047492 4.716434       10.17248 
1 1 1 17  36 3  o 13.17208 5.342072 1.621509       2.672549 3.002503       3.953312 0.4591729      3.626863 16.06242 6.503423 13.26362 5.826038 2.798794       8.731393 
1 1 1 17  36 4  o 23.35382 4.885570 7.728419       2.690925 9.668597       4.184330 6.360129       3.513940 24.68173 6.759422 20.28125 6.377258 4.400480       9.292966 
1 1 1 17  36 5  o 10.05284 4.426319 -0.1029867     2.105086 1.942207       3.117522 -1.817018      2.853985 14.01812 5.737839 10.09544 4.711742 3.922680       7.424507 
1 1 1 17  36 6  o 20.72121 4.773802 6.126603       2.360917 5.649747       3.487867 6.529857       3.207418 19.07818 6.381533 20.61140 6.014549 -1.533228      8.769194 
1 1 1 17  36 7  o 9.842027 4.748364 -3.943712      3.414532 -9.748335      6.369269 -1.602667      4.044897 11.91398 5.897346 12.19003 5.662303 -0.2760592     8.175596 
1 1 1 17  37 0  o 12.26465 5.475599 -0.1720639     3.333861 2.662118       4.135293 -5.434468      5.634879 15.80961 6.553482 12.59108 6.080888 3.218528       8.940097 
1 1 1 17  37 1  o 14.36553 5.596485 2.438189       2.821365 3.350991       4.095648 1.613841       3.892151 16.44175 6.632904 14.55332 6.212254 1.888434       9.087768 
1 1 1 17  37 2  o 14.02572 5.584035 2.167941       2.863268 4.926114       4.184189 -0.2611079     3.926618 18.18922 6.883676 13.01488 5.865781 5.174343       9.043914 
1 1 1 18  0  0  o 15.58022 7.157996 4.319538       2.974387 4.319538       2.974387 4.319538       2.974387 15.58022 7.157996 15.58022 7.157996 0.000000       0.000000 
1 1 1 18  0  1  o 250.0072 5.792294 764.6020       35.24621 764.6020       35.24621 764.6020       35.24621 250.0072 5.792294 250.0072 5.792294 0.000000       0.000000 
1 1 1 18  0  2  o 234.0768 4.573612 669.4008       26.06632 669.4008       26.06632 669.4008       26.06632 234.0768 4.573612 234.0768 4.573612 0.000000       0.000000 
1 1 1 18  0  3  o 30.48900 5.828730 12.51528       3.872087 12.51528       3.872087 12.51528       3.872087 30.48900 5.828730 30.48900 5.828730 0.000000       0.000000 
1 1 1 18  0  4  o 145.5461 4.236063 259.1363       14.99566 259.1363       14.99566 259.1363       14.99566 145.5461 4.236063 145.5461 4.236063 0.000000       0.000000 
1 1 1 18  0  5  o 208.6051 5.154301 532.3676       26.16564 532.3676       26.16564 532.3676       26.16564 208.6051 5.154301 208.6051 5.154301 0.000000       0.000000 
1 1 1 18  0  6  o 157.8520 4.451864 304.8550       17.09409 304.8550       17.09409 304.8550       17.09409 157.8520 4.451864 157.8520 4.451864 0.000000       0.000000 
1 1 1 18  0  7  o 80.47604 3.997329 79.60947       7.794889 79.60947       7.794889 79.60947       7.794889 80.47604 3.997329 80.47604 3.997329 0.000000       0.000000 
1 1 1 18  0  8  o 221.9162 5.410191 602.8367       29.21825 602.8367       29.21825 602.8367       29.21825 221.9162 5.410191 221.9162 5.410191 0.000000       0.000000 
1 1 1 18  0  9  o 150.0228 4.460963 275.5263       16.27615 275.5263       16.27615 275.5263       16.27615 150.0228 4.460963 150.0228 4.460963 0.000000       0.000000 
1 1 1 18  0  10 o 7.957871 5.603065 -4.901230      4.265188 -4.901230      4.265188 -4.901230      4.265188 7.957871 5.603065 7.957871 5.603065 0.000000       0.000000 
1 1 1 18  0  11 o 12.79765 7.861845 1.613051       4.736473 1.613051       4.736473 1.613051       4.736473 12.79765 7.861845 12.79765 7.861845 0.000000       0.000000 
1 1 1 18  0  12 o 87.77267 4.312388 94.76768       9.172865 94.76768       9.172865 94.76768       9.172865 87.77267 4.312388 87.77267 4.312388 0.000000       0.000000 
1 1 1 18  0  13 o 89.54311 4.425733 98.67167       9.603193 98.67167       9.603193 98.67167       9.603193 89.54311 4.425733 89.54311 4.425733 0.000000       0.000000 
1 1 1 18  0  14 o 86.32423 4.058549 91.62476       8.494525 91.62476       8.494525 91.62476       8.494525 86.32423 4.058549 86.32423 4.058549 0.000000       0.000000 
1 1 1 18  0  15 o 45.82921 6.419733 27.21228       6.766472 27.21228       6.766472 27.21228       6.766472 45.82921 6.419733 45.82921 6.419733 0.000000       0.000000 
1 1 1 18  0  16 o 126.8249 3.571044 196.9060       11.01682 196.9060       11.01682 196.9060       11.01682 126.8249 3.571044 126.8249 3.571044 0.000000       0.000000 
1 1 1 18  0  17 o 105.1342 3.514099 135.4789       8.980323 135.4789       8.980323 135.4789       8.980323 105.1342 3.514099 105.1342 3.514099 0.000000       0.000000 
1 1 1 18  0  18 o 102.3066 3.648473 128.4257       9.069736 128.4257       9.069736 128.4257       9.069736 102.3066 3.648473 102.3066 3.648473 0.000000       0.000000 
1 1 1 18  0  19 o 181.0663 4.148180 402.0404       18.28169 402.0404       18.28169 402.0404       18.28169 181.0663 4.148180 181.0663 4.148180 0.000000       0.000000 
1 1 1 18  0  20 o 189.0025 4.261243 438.5703       19.60385 438.5703       19.60385 438.5703       19.60385 189.0025 4.261243 189.0025 4.261243 0.000000       0.000000 
1 1 1 18  0  21 o 101.9697 3.758769 127.9325       9.311290 127.9325       9.311290 127.9325       9.311290 101.9697 3.758769 101.9697 3.758769 0.000000       0.000000 
1 1 1 18  0  22 o 31.09278 8.535757 14.45816       5.591500 14.45816       5.591500 14.45816       5.591500 31.09278 8.535757 31.09278 8.535757 0.000000       0.000000 
1 1 1 18  0  23 o 93.13470 4.367013 107.5789       9.861513 107.5789       9.861513 107.5789       9.861513 93.13470 4.367013 93.13470 4.367013 0.000000       0.000000 
1 1 1 18  0  24 o 19.31317 8.817446 6.915748       4.510630 6.915748       4.510630 6.915748       4.510630 19.31317 8.817446 19.31317 8.817446 0.000000       0.000000 
1 1 1 18  0  25 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  0  26 o 41.23568 8.992566 24.86967       7.916188 24.86967       7.916188 24.86967       7.916188 41.23568 8.992566 41.23568 8.992566 0.000000       0.000000 
1 1 1 18  0  27 o 45.06417 5.821095 27.01417       6.099378 27.01417       6.099378 27.01417       6.099378 45.06417 5.821095 45.06417 5.821095 0.000000       0.000000 
1 1 1 18  0  28 o 25.90217 8.912389 11.52698       5.061168 11.52698       5.061168 11.52698       5.061168 25.90217 8.912389 25.90217 8.912389 0.000000       0.000000 
1 1 1 18  0  29 o 28.99085 8.404540 13.65786       5.151728 13.65786       5.151728 13.65786       5.151728 28.99085 8.404540 28.99085 8.404540 0.000000       0.000000 
1 1 1 18  0  30 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  0  31 o 8.717997 6.004256 -2.095083      4.215370 -2.095083      4.215370 -2.095083      4.215370 8.717997 6.004256 8.717997 6.004256 0.000000       0.000000 
1 1 1 18  0  32 o 15.76018 8.633239 5.826638       4.749393 5.826638       4.749393 5.826638       4.749393 15.76018 8.633239 15.76018 8.633239 0.000000       0.000000 
1 1 1 18  0  33 o 9.765267 6.545175 -0.9545474E-01 4.352498 -0.9545474E-01 4.352498 -0.9545474E-01 4.352498 9.765267 6.545175 9.765267 6.545175 0.000000       0.000000 
1 1 1 18  0  34 o 8.926097 6.376254 -5.658840      6.267132 -5.658840      6.267132 -5.658840      6.267132 8.926097 6.376254 8.926097 6.376254 0.000000       0.000000 
1 1 1 18  0  35 o 7.313388 5.239941 -4.919015      4.362330 -4.919015      4.362330 -4.919015      4.362330 7.313388 5.239941 7.313388 5.239941 0.000000       0.000000 
1 1 1 18  1  0  o 135.6341 2.408229 224.3318       7.959812 227.1556       11.28931 221.5401       11.22471 136.4313 3.395607 134.6894 3.422611 1.741837       4.821246 
1 1 1 18  1  1  o 148.8538 2.505998 270.2172       9.090269 280.1047       13.02174 260.8187       12.69563 151.4866 3.527433 146.1757 3.564042 5.310822       5.014497 
1 1 1 18  1  2  o 257.3051 3.452519 808.1028       21.64814 793.1172       30.23576 823.8648       31.00909 254.6866 4.871680 259.5707 4.902269 -4.884186      6.911260 
1 1 1 18  1  3  o 97.25603 2.310744 115.3445       5.476517 122.6214       7.784808 108.2147       7.705726 100.1889 3.192618 94.09896 3.365834 6.089935       4.639143 
1 1 1 18  1  4  f 107.6229 2.502009 141.2704       6.561900 138.0705       9.818376 143.8535       8.821342 106.2602 3.797798 108.5087 3.340039 -2.248497      5.057581 
1 1 1 18  1  5  o 109.2605 2.760458 145.7350       7.343998 136.2794       10.02020 156.7094       10.79499 105.5512 3.902342 113.1949 3.919355 -7.643715      5.530788 
1 1 1 18  1  6  o 216.9219 3.739460 574.7557       19.76734 560.9764       27.46691 589.5604       28.47059 214.0470 5.265804 219.4205 5.324552 -5.373550      7.488627 
1 1 1 18  1  7  o 172.7303 4.814624 365.3778       20.24618 367.8068       28.37576 362.8588       28.89619 172.8845 6.748234 171.6720 6.921440 1.212555       9.666695 
1 1 1 18  1  8  o 45.97771 4.240530 26.06562       4.697706 26.04499       7.961570 26.07664       5.818542 45.41333 7.452419 45.83414 5.307386 -0.4208107     9.149147 
1 1 1 18  1  9  o 58.57996 3.783183 42.11020       5.371727 39.30462       9.176655 43.57267       6.625488 56.11869 6.852222 59.49332 4.605816 -3.374630      8.256300 
1 1 1 18  1  10 o 149.8168 3.698348 274.3069       13.50219 266.6314       23.15753 278.2603       16.61951 147.1107 6.475558 150.7119 4.530310 -3.601196      7.902946 
1 1 1 18  1  11 o 67.87823 3.724635 56.49192       6.137375 57.63031       10.40144 55.88388       7.601724 68.16470 6.334256 67.39202 4.657437 0.7726746      7.862221 
1 1 1 18  1  12 o 69.40722 3.745399 59.07670       6.311421 51.92552       10.40540 63.23900       7.938462 64.57559 6.710044 71.70890 4.566563 -7.133308      8.116538 
1 1 1 18  1  13 o 128.2810 3.057761 201.0297       9.558770 197.9356       13.02436 204.6420       14.07271 127.0733 4.211787 129.1604 4.477852 -2.087082      6.147383 
1 1 1 18  1  14 o 13.95371 5.605050 1.119110       2.911117 2.279619       3.499581 -1.487900      5.245212 16.40704 6.274848 15.80407 6.971655 0.6029720      9.379642 
1 1 1 18  1  15 o 164.9913 3.015901 332.6932       12.12591 319.4144       15.12538 356.5800       20.28639 161.5129 3.842934 170.3235 4.892654 -8.810547      6.221431 
1 1 1 18  1  16 o 39.28793 4.857932 19.25175       4.552021 23.61386       6.364927 14.68477       6.512674 43.29531 6.210338 33.66009 8.048739 9.635223       10.16615 
1 1 1 18  1  17 o 140.4157 2.929742 241.1133       10.02493 247.9745       12.81956 230.3125       16.08428 142.1979 3.702657 136.7238 4.835104 5.474106       6.089983 
1 1 1 18  1  18 o 171.9364 3.157573 361.9461       13.22992 351.5179       16.53152 380.5218       22.06384 169.1913 4.009576 175.5119 5.164294 -6.320587      6.538091 
1 1 1 18  1  19 o 137.7950 2.661156 232.2843       8.935932 239.2141       12.68353 225.4546       12.59160 139.5156 3.733980 135.4139 3.819580 4.101700       5.341516 
1 1 1 18  1  20 o 23.50556 5.262299 7.119887       2.939040 5.810771       4.143845 8.445030       4.169132 21.66859 6.938859 25.48210 6.645910 -3.813511      9.608115 
1 1 1 18  1  21 o 136.9152 3.240324 230.3707       10.81126 223.5399       15.48330 236.8697       15.10266 134.1390 4.744132 138.2233 4.489652 -4.084274      6.531750 
1 1 1 18  1  22 o 29.62182 5.013394 11.23540       3.489960 12.42401       4.830458 9.937429       5.047811 30.72501 6.645144 27.35426 7.396473 3.370745       9.943126 
1 1 1 18  1  23 o 29.12334 5.128335 10.94429       3.506714 15.01325       4.685007 5.760404       5.288061 33.97884 5.870247 22.05177 7.836035 11.92707       9.790978 
1 1 1 18  1  24 o 158.7145 3.396988 312.1918       13.13853 315.9661       18.52459 308.3714       18.63729 158.2728 4.808505 156.2549 4.900612 2.017899       6.865691 
1 1 1 18  1  25 o 67.59597 3.480309 57.04051       5.713603 51.13328       6.843163 70.63670       10.38182 63.50766 4.449915 73.70798 5.827313 -10.20033      7.332075 
1 1 1 18  1  26 o 17.20693 6.063523 3.595847       3.160845 2.213029       4.404019 5.064902       4.539268 16.87245 6.852154 20.14897 7.248573 -3.276522      9.974659 
1 1 1 18  1  27 o 33.81538 5.628069 15.45162       4.474836 15.53590       7.266062 15.40012       5.679736 31.66930 8.995221 32.71276 7.309217 -1.043455      11.59046 
1 1 1 18  1  28 o 19.33074 6.691000 5.117919       3.838860 -2.968956      6.011408 10.68680       4.988497 14.83189 6.894013 26.69739 7.407570 -11.86550      10.11926 
1 1 1 18  1  29 o 25.18081 5.506771 8.966510       3.284774 10.32456       4.599288 7.552638       4.692868 25.97646 7.075533 22.18816 7.401872 3.788307       10.23967 
1 1 1 18  1  30 o 18.33838 6.191900 4.925674       3.283177 8.110729       4.769676 2.057593       4.526120 22.37369 7.462164 15.77518 6.715355 6.598507       10.03892 
1 1 1 18  1  31 o 23.51732 6.047996 8.470222       3.485435 5.180244       4.882405 11.88928       4.977263 18.56238 7.323044 26.61660 7.404527 -8.054214      10.41412 
1 1 1 18  1  32 o 13.18435 5.624698 1.351420       3.187502 -3.984097      4.398792 7.250709       4.625354 11.26455 5.423276 20.30728 7.315521 -9.042732      9.106524 
1 1 1 18  1  33 o 13.58400 5.932239 1.500280       3.712130 3.265176       6.259529 0.5428638      4.610336 16.40363 7.398405 13.69841 6.245675 2.705216       9.682192 
1 1 1 18  1  34 o 8.821610 4.324829 -4.365179      3.159692 -8.099778      4.362384 -0.2438090     4.582713 9.332214 4.661744 12.82742 5.981425 -3.495203      7.583488 
1 1 1 18  1  35 o 8.822898 4.314666 -3.837358      3.086091 -2.941380      4.325156 -4.766601      4.404715 10.95709 5.300447 10.31786 5.068080 0.6392298      7.333497 
1 1 1 18  2  0  o 79.34397 2.354808 76.83325       4.548044 77.92730       6.743312 75.92030       6.160006 79.83068 3.474631 78.81447 3.214039 1.016212       4.733191 
1 1 1 18  2  1  o 237.3491 3.538564 687.6354       20.46684 685.0504       31.79512 689.4644       26.74462 236.6008 5.514526 237.5150 4.620717 -0.9142151     7.194513 
1 1 1 18  2  2  o 59.24453 2.435415 42.87631       3.508573 44.05991       4.843264 41.56923       5.089641 59.99273 3.325879 58.24237 3.603664 1.750355       4.903862 
1 1 1 18  2  3  o 81.13746 2.660465 80.38785       5.253242 76.20660       8.487069 82.98470       6.688495 78.84113 4.435305 82.38854 3.338303 -3.547409      5.551234 
1 1 1 18  2  4  o 53.91525 3.284716 35.61100       4.295166 37.04545       8.241989 35.07619       5.032556 54.60883 6.309355 53.44853 3.890457 1.160301       7.412396 
1 1 1 18  2  5  o 48.42146 3.807212 28.81362       4.456316 31.43996       7.844277 27.56209       5.414978 50.19705 6.570224 47.23318 4.769779 2.963863       8.119029 
1 1 1 18  2  6  o 191.7972 4.055154 449.5277       18.95334 433.6400       32.31586 457.8585       23.40070 187.6895 7.078130 193.3620 4.970291 -5.672531      8.648913 
1 1 1 18  2  7  o 181.8883 3.378152 403.9635       14.97338 388.4965       20.43869 421.8812       21.99835 178.1312 4.712578 185.6025 4.867940 -7.471344      6.775340 
1 1 1 18  2  8  o 152.3759 3.133205 283.4536       11.63432 299.5104       16.47198 267.4690       16.43492 156.4358 4.325042 147.7860 4.568989 8.649811       6.291395 
1 1 1 18  2  9  o 173.0344 3.341822 365.6676       14.09132 345.8842       19.04044 389.6247       20.95283 168.0407 4.654198 178.3225 4.826141 -10.28177      6.704715 
1 1 1 18  2  10 f 84.40459 2.927793 87.07288       6.012906 91.09630       8.166641 82.30957       8.885881 86.23407 3.896295 81.88888 4.469813 4.345192       5.929615 
1 1 1 18  2  11 o 90.16900 2.971526 99.38144       6.520475 103.7235       8.912937 94.38171       9.564156 92.00476 3.984790 87.68719 4.490795 4.317566       6.003815 
1 1 1 18  2  12 o 108.3321 2.624562 143.2485       6.928671 134.9246       8.459780 160.2085       12.07560 105.0310 3.309389 114.3087 4.342939 -9.277771      5.460144 
1 1 1 18  2  13 o 20.26293 5.784128 5.171518       2.996948 3.810132       3.485101 9.035830       5.871657 18.46744 6.376060 26.91208 8.207522 -8.444643      10.39315 
1 1 1 18  2  14 o 77.45660 2.752579 73.36428       5.187324 74.14900       6.392569 71.85135       8.876234 77.79976 3.379858 76.37340 4.793428 1.426361       5.865185 
1 1 1 18  2  15 o 10.33344 4.632847 -1.110381      2.413654 0.9382414      3.945276 -2.335777      3.051298 15.60266 6.427958 10.85665 4.998564 4.746011       8.142745 
1 1 1 18  2  16 o 132.7014 2.764884 215.1779       8.941051 223.1570       14.12880 209.8482       11.54734 134.7982 4.306679 130.8643 3.624459 3.933945       5.628871 
1 1 1 18  2  17 f 118.5740 3.117031 172.1433       8.998907 160.0669       17.33206 176.6004       10.52936 113.4899 6.291577 120.0028 3.604683 -6.512856      7.251047 
1 1 1 18  2  18 o 29.14862 4.530465 10.69650       3.113609 12.95072       4.792988 9.050669       4.095447 31.73867 6.417847 26.47103 6.416427 5.267647       9.075202 
1 1 1 18  2  19 o 68.66001 2.939027 57.82913       4.906114 61.03561       6.423011 53.33804       7.601511 70.39344 3.757917 65.56409 4.790773 4.829346       6.088797 
1 1 1 18  2  20 o 131.7786 3.910314 213.9825       12.54331 223.2705       14.90716 191.4621       23.21251 134.3418 4.560133 122.6079 7.809641 11.73397       9.043523 
1 1 1 18  2  21 o 85.95740 3.789160 91.26884       7.917603 98.82777       9.062467 66.89326       16.27397 89.32426 4.174881 70.90083 9.670853 18.42343       10.53352 
1 1 1 18  2  22 o 14.53626 5.555201 1.890164       2.741546 7.267605       4.062059 -2.608515      3.715360 23.57363 6.735528 12.00008 5.521646 11.57355       8.709530 
1 1 1 18  2  23 o 30.04957 4.702043 11.54451       3.330387 14.01017       4.749877 9.160193       4.670874 32.68142 6.190678 26.17343 7.130880 6.507994       9.443196 
1 1 1 18  2  24 o 29.81232 4.838589 11.46343       3.394796 9.418632       4.876647 13.38604       4.728704 26.32558 7.331440 31.71856 6.339584 -5.392975      9.692284 
1 1 1 18  2  25 o 16.60512 6.045728 3.095027       3.169908 3.399674       4.432888 2.776227       4.534698 18.31815 7.047824 17.76158 7.041583 0.5565739      9.962716 
1 1 1 18  2  26 o 29.67592 5.107567 11.62415       3.560426 8.081846       4.817410 15.88826       5.285482 24.05326 7.452378 34.02670 6.612541 -9.973440      9.963113 
1 1 1 18  2  27 o 21.69779 6.143276 6.546422       3.394503 11.25693       5.075019 2.732971       4.566285 27.82660 7.368767 17.33422 6.999830 10.49238       10.16348 
1 1 1 18  2  28 f 36.50628 4.527762 17.59160       3.941696 14.90713       5.545656 20.33245       5.603595 31.68035 7.329050 38.04514 6.261754 -6.364790      9.639737 
1 1 1 18  2  29 o 20.96620 6.579719 6.516363       3.742399 -0.1686048     6.215189 10.31877       4.687419 16.22698 7.340379 25.86461 7.182084 -9.637623      10.26954 
1 1 1 18  2  30 o 11.37393 5.232606 -1.419707      3.334507 -6.084706      5.788393 0.8973019      4.079397 12.65127 6.122851 14.29771 6.231786 -1.646440      8.736387 
1 1 1 18  2  31 o 13.97658 5.925602 1.541644       3.499708 7.256328       6.203104 -1.126743      4.238745 20.60905 8.214435 12.80133 5.893027 7.807718       10.10963 
1 1 1 18  2  32 f 10.46162 4.888972 -1.691155      3.088999 -8.385864      4.293060 5.495739       4.448071 9.446638 4.703902 18.30344 7.055248 -8.856804      8.479577 
1 1 1 18  2  33 o 10.72280 4.964745 -1.036529      3.071966 -0.8790732     4.276130 -1.204460      4.416083 12.46027 5.799373 12.43146 5.821223 0.2880573E-01  8.217017 
1 1 1 18  2  34 o 13.86879 5.812390 2.492995       3.305412 2.734617       4.633841 2.242690       4.716369 14.79666 6.538886 14.48447 6.486352 0.3121834      9.210310 
1 1 1 18  2  35 o 9.691117 4.661421 -2.559067      3.232140 -5.878355      4.335482 1.593872       4.849452 9.835638 4.868035 13.75995 6.322976 -3.924316      7.979836 
1 1 1 18  3  0  o 128.5312 2.576978 201.4779       8.071523 198.9429       10.31813 205.4754       12.95705 127.6380 3.320120 129.6428 4.106479 -2.004822      5.280754 
1 1 1 18  3  1  o 72.02562 2.955072 63.39527       5.175686 55.91789       7.528660 70.09590       7.126904 67.48504 4.605584 75.66673 3.878027 -8.181694      6.020839 
1 1 1 18  3  2  o 113.3221 3.286436 156.8579       9.066021 151.1297       15.37161 159.9134       11.22648 110.9540 5.704275 114.3504 4.035070 -3.396347      6.987170 
1 1 1 18  3  3  o 148.1786 3.117871 267.9399       11.25848 282.5410       22.68136 263.1661       12.96899 151.7078 6.147881 146.8134 3.624968 4.894394       7.137004 
1 1 1 18  3  4  o 198.6682 3.171669 481.6972       15.35508 511.7608       24.42491 462.0509       19.74482 204.5419 4.900209 194.4591 4.166667 10.08279       6.432198 
1 1 1 18  3  5  o 187.7125 3.409711 430.1849       15.59721 449.4171       22.11911 411.1646       21.99697 191.6862 4.735226 183.2523 4.930287 8.433914       6.835941 
1 1 1 18  3  6  o 210.7078 3.665879 542.2657       18.82326 540.2491       26.14100 544.4373       27.12658 210.0786 5.106277 210.7912 5.285048 -0.7126770     7.348863 
1 1 1 18  3  7  o 29.42949 4.506893 10.83522       3.129432 14.91634       3.954324 3.995310       5.119262 34.58427 4.823006 20.55909 7.648715 14.02518       9.042357 
1 1 1 18  3  8  o 253.2700 4.190845 784.3256       25.86554 791.0649       36.25936 777.3428       36.90806 253.9318 5.859586 251.6728 6.017953 2.259048       8.399435 
1 1 1 18  3  9  o 169.6557 3.308748 351.5172       13.67944 337.8169       18.45444 368.2255       20.37984 166.0819 4.564091 173.3488 4.829110 -7.266846      6.644639 
1 1 1 18  3  10 o 30.96220 4.706687 12.00171       3.439596 15.08918       4.395318 7.123593       5.524777 34.67923 5.374778 24.48368 8.025852 10.19554       9.659325 
1 1 1 18  3  11 o 81.23370 2.584081 80.61515       5.108881 81.21854       6.204566 79.34469       9.003196 81.48781 3.130337 80.35926 4.616965 1.128548       5.578115 
1 1 1 18  3  12 o 116.8357 2.657350 166.6312       7.565897 163.7738       9.282808 172.2855       13.05818 115.7260 3.294995 118.5090 4.529974 -2.782967      5.601576 
1 1 1 18  3  13 o 102.7803 2.673718 129.0622       6.691025 133.5403       8.316627 120.8444       11.26617 104.4801 3.270488 99.17317 4.674877 5.306969       5.705310 
1 1 1 18  3  14 o 56.20741 3.124077 38.72946       4.262256 39.89108       5.137427 36.16418       7.634522 56.97540 3.720526 53.87418 5.912227 3.101227       6.985467 
1 1 1 18  3  15 o 115.6631 3.050737 163.6300       8.591252 161.2182       9.529049 174.1056       19.85953 114.7519 3.411427 118.3900 6.913721 -3.638138      7.709564 
1 1 1 18  3  16 o 118.1436 3.134439 170.8252       9.016178 176.3763       10.15334 150.1243       19.60719 119.9885 3.476089 109.6343 7.381958 10.35423       8.159443 
1 1 1 18  3  17 o 52.01603 3.141990 33.22800       3.964135 33.73101       5.252713 32.56245       6.042067 52.25708 4.159086 51.20170 4.902249 1.055374       6.428844 
1 1 1 18  3  18 o 139.0539 2.904171 236.5916       9.841052 227.2609       15.22580 243.2864       12.89701 135.7769 4.608377 140.7579 3.763310 -4.981064      5.949759 
1 1 1 18  3  19 o 68.51678 3.023165 57.61657       5.035290 54.92364       7.901774 59.45771       6.533658 66.49802 4.910829 69.44548 3.876172 -2.947464      6.256273 
1 1 1 18  3  20 o 33.70879 4.110932 14.20721       3.307143 9.827528       4.874646 17.94221       4.501608 27.41187 7.204363 37.73089 5.020396 -10.31902      8.781072 
1 1 1 18  3  21 o 47.31112 3.366833 27.66952       3.856325 30.02989       5.838163 25.84253       5.136335 48.90106 4.968050 45.39959 4.711048 3.501476       6.846569 
1 1 1 18  3  22 o 78.07300 2.744746 74.93150       5.213903 74.32479       7.307563 75.56063       7.441405 77.41360 3.886067 78.04220 3.925419 -0.6286011     5.523625 
1 1 1 18  3  23 o 45.86572 6.320901 27.32275       6.877202 34.55836       8.084740 8.381447       13.08077 51.53786 6.587708 29.12778 11.81653 22.41008       13.52880 
1 1 1 18  3  24 f 27.23487 5.940866 9.852034       3.831636 9.320398       4.472919 11.31764       7.426636 26.23950 6.903456 28.59253 9.300973 -2.353025      11.58300 
1 1 1 18  3  25 o 15.31249 5.835323 2.304645       3.019510 -1.181098      4.128690 6.313031       4.427405 13.61199 6.084157 21.86647 7.185608 -8.254480      9.415409 
1 1 1 18  3  26 o 38.42278 3.867890 18.77297       3.572358 21.12452       4.926097 16.16448       5.188246 40.16443 5.151437 34.40663 6.424084 5.757805       8.234449 
1 1 1 18  3  27 o 30.67529 4.638308 12.38728       3.359090 13.03823       4.665157 11.68644       4.840642 30.48869 6.478983 28.52421 7.013750 1.964476       9.548294 
1 1 1 18  3  28 o 23.45591 5.828547 7.765664       3.316906 2.789094       4.683768 12.77229       4.697890 17.20209 7.036109 29.69858 6.656367 -12.49648      9.685765 
1 1 1 18  3  29 o 16.42094 6.335150 3.252205       3.588667 7.527491       6.463662 1.347062       4.314793 22.04667 8.503058 15.19473 6.514700 6.851939       10.71183 
1 1 1 18  3  30 o 11.32152 5.124536 -0.7824482     3.034779 -6.273470      4.217101 5.115772       4.370669 10.31169 5.042937 18.71933 7.046189 -8.407644      8.664871 
1 1 1 18  3  31 o 14.12339 6.019246 1.544562       3.643871 4.859883       6.736529 0.1733475      4.332376 18.80656 8.102697 13.78366 6.191119 5.022902       10.19724 
1 1 1 18  3  32 o 12.47564 5.670653 -0.2860846     3.763774 2.001872       6.984033 -1.222534      4.468116 16.59525 7.611865 12.75342 5.933219 3.841827       9.651092 
1 1 1 18  3  33 o 11.48554 5.214116 -0.2095466     3.169931 0.1591387E-02  4.419856 -0.4331882     4.548845 13.13101 6.034864 12.99592 6.025627 0.1350946      8.528058 
1 1 1 18  3  34 o 10.38000 4.897883 -1.619563      3.232729 -2.193883      4.543086 -1.030506      4.601004 11.74833 5.617845 12.38881 5.844975 -0.6404781     8.107028 
1 1 1 18  3  35 o 9.466599 4.567585 -2.759260      3.160941 -0.4901812     4.504230 -4.961125      4.437018 12.30673 5.799179 10.26999 5.052889 2.036737       7.691694 
1 1 1 18  4  0  o 135.6466 3.087066 224.4989       10.20448 231.3624       14.65042 218.0311       14.22177 137.5413 4.376571 133.5157 4.376958 4.025558       6.189680 
1 1 1 18  4  1  o 197.5463 3.209414 476.2179       15.45008 473.2755       24.72572 478.1026       19.78909 196.6303 5.164621 197.8411 4.104620 -1.210800      6.597061 
1 1 1 18  4  2  o 182.2003 3.015663 405.0506       13.38961 398.6146       17.14795 415.1043       21.43212 180.6629 3.894996 184.1927 4.778852 -3.529709      6.165097 
1 1 1 18  4  3  o 112.7057 2.736666 154.9580       7.516291 145.3529       9.926852 167.8633       11.50651 109.0367 3.741508 117.1543 4.036441 -8.117538      5.503793 
1 1 1 18  4  4  o 89.51813 2.713462 97.84869       5.912472 103.9574       7.866652 89.91816       8.963262 92.20842 3.507323 85.66658 4.307390 6.541840       5.554720 
1 1 1 18  4  5  o 31.04247 4.161427 11.98528       3.068775 12.27302       3.456779 10.91504       6.666686 31.34005 4.668483 29.49688 8.688770 1.843174       9.863542 
1 1 1 18  4  6  o 74.32306 3.086144 67.53799       5.577375 70.20734       6.537845 60.40203       10.68949 75.73863 3.552161 69.87158 6.347179 5.867050       7.273550 
1 1 1 18  4  7  o 131.0029 3.301441 209.6770       10.53112 210.0859       12.60276 208.7307       19.17160 131.0538 3.950718 130.2891 6.054850 0.7646942      7.229757 
1 1 1 18  4  8  o 19.45951 5.863018 4.681829       3.008878 2.618436       3.263357 16.38536       7.771986 16.54085 6.115574 35.69434 8.951988 -19.15349      10.84151 
1 1 1 18  4  9  o 118.4576 3.301219 171.5058       9.520280 171.4582       11.31264 171.6215       17.62487 118.3651 3.927408 118.0485 6.147925 0.3166351      7.295308 
1 1 1 18  4  10 o 182.7728 3.848845 408.4080       17.14265 408.4080       17.14265 0.000000       0.000000 182.7728 3.848845 ?        ?        0.000000       3.848845 
1 1 1 18  4  11 o 132.2460 2.967058 213.5544       9.561911 217.5753       10.81694 199.1805       20.45187 133.4482 3.326253 127.0048 6.631069 6.443382       7.418560 
1 1 1 18  4  12 o 131.7227 2.996287 211.9145       9.617901 209.6041       10.74334 221.2413       21.58520 130.9185 3.370261 133.8112 6.640279 -2.892685      7.446608 
1 1 1 18  4  13 o 56.31078 3.227151 38.87817       4.409855 38.92251       4.783661 38.62726       11.37945 56.31171 3.503338 55.05932 8.775469 1.252384       9.448927 
1 1 1 18  4  14 o 47.83753 3.305693 28.11169       3.829909 30.78438       4.536821 21.48337       7.144625 50.01496 3.749632 41.03499 7.417737 8.979973       8.311593 
1 1 1 18  4  15 o 49.51934 3.357740 30.13056       4.027930 34.21234       4.797723 20.38308       7.414070 52.72915 3.758417 39.80695 7.921676 12.92220       8.768047 
1 1 1 18  4  16 o 89.39656 2.799459 97.76854       6.091096 100.2489       7.429797 92.68438       10.63721 90.44233 3.377012 86.64051 5.060171 3.801819       6.083546 
1 1 1 18  4  17 o 174.2438 2.803091 371.2266       11.90230 364.4073       16.47492 378.6715       17.21418 172.3481 3.922662 175.6584 4.021438 -3.310272      5.617761 
1 1 1 18  4  18 o 78.02286 2.579166 74.50675       4.897112 69.48200       6.841302 79.78690       7.013013 75.15385 3.747344 80.57925 3.580397 -5.425400      5.182840 
1 1 1 18  4  19 o 48.91301 3.703853 29.55537       4.382020 21.91198       8.865479 32.02646       5.040840 40.65259 9.168346 50.85159 4.102624 -10.19900      10.04441 
1 1 1 18  4  20 o 56.88668 2.885205 39.76494       3.986601 40.74970       5.686873 38.81337       5.590182 57.34658 4.096372 55.95319 4.128907 1.393394       5.816195 
1 1 1 18  4  21 o 113.5818 2.753003 158.2290       7.619936 152.3462       9.995383 166.3921       11.77424 111.0984 3.697098 115.9092 4.175311 -4.810844      5.576895 
1 1 1 18  4  22 o 39.57948 3.686325 19.51877       3.514612 18.30225       5.050189 20.66135       4.894300 37.75338 5.663822 40.34248 5.091611 -2.589100      7.615995 
1 1 1 18  4  23 o 9.091708 4.322816 -3.177629      2.611704 -1.114563      3.977012 -4.741964      3.463101 13.54630 6.018266 10.13660 4.862501 3.409706       7.737147 
1 1 1 18  4  24 o 36.52470 4.243520 16.91587       3.706786 19.93633       5.369418 14.16565       5.123591 39.07209 5.816338 32.46841 6.697951 6.603683       8.870871 
1 1 1 18  4  25 o 56.46193 3.194965 39.72668       4.378064 43.79837       5.999454 35.08839       6.403291 58.82092 4.213373 52.15834 5.103047 6.662575       6.617673 
1 1 1 18  4  26 o 28.53466 5.693482 10.98323       3.820179 12.05774       4.429183 7.861928       7.548955 29.62601 6.327347 24.39526 9.242957 5.230747       11.20123 
1 1 1 18  4  27 o 29.59246 5.335620 11.82649       3.706185 7.370928       5.891320 14.74473       4.767838 22.88215 8.254473 32.58754 6.230921 -9.705387      10.34218 
1 1 1 18  4  28 o 14.60523 5.917349 1.828503       3.275363 11.24658       6.123506 -1.945860      3.876510 26.60314 8.425567 12.22848 5.631594 14.37466       10.13435 
1 1 1 18  4  29 o 27.51163 5.238404 10.57795       3.383741 15.87289       4.972763 6.012315       4.617614 32.85593 6.441149 20.16823 7.303487 12.68770       9.738034 
1 1 1 18  4  30 o 15.03757 5.781453 2.755506       2.981475 5.407122       4.268485 0.2293788      4.166257 19.01097 7.000345 13.83584 6.152590 5.175139       9.319828 
1 1 1 18  4  31 o 13.44674 5.654801 1.468788       3.145229 0.5895652      4.342813 2.438694       4.561275 14.07107 6.267895 15.75407 6.724952 -1.682998      9.193013 
1 1 1 18  4  32 o 10.32784 4.839008 -1.773686      3.059104 -0.2609023     4.329805 -3.281479      4.322657 13.15830 6.019652 11.44283 5.473951 1.715472       8.136359 
1 1 1 18  4  33 o 13.60169 5.971797 1.504488       3.806644 -3.323516      6.729961 3.775795       4.616008 13.60362 6.588146 16.03187 6.801510 -2.428252      9.469119 
1 1 1 18  4  34 o 12.65371 5.709201 0.7940701      3.731445 -2.182331      4.524742 7.121538       6.597252 11.71271 5.602349 17.96427 7.875181 -6.251558      9.664615 
1 1 1 18  4  35 o 11.05712 5.118651 -0.3775038     3.263274 -1.338203      4.511270 0.6768992      4.726160 11.86075 5.651250 13.10382 6.098229 -1.243073      8.314146 
1 1 1 18  5  0  o 63.73744 2.328734 49.60414       3.610937 51.14844       4.893923 47.75877       5.349739 64.67020 3.114551 62.45102 3.529624 2.219189       4.707300 
1 1 1 18  5  1  o 196.1282 2.883028 469.2796       13.77923 466.2394       19.32858 472.4215       19.64893 195.3714 4.059783 196.6575 4.100080 -1.286087      5.769965 
1 1 1 18  5  2  o 47.23606 2.620863 27.29912       3.005026 29.12499       3.933492 24.73975       4.657040 48.73573 3.332079 44.78918 4.320338 3.946545       5.456012 
1 1 1 18  5  3  o 184.7689 3.024050 416.5876       13.61613 426.3407       21.02929 409.5472       17.86710 186.7350 4.621285 183.0989 4.004350 3.636032       6.114826 
1 1 1 18  5  4  o 101.7626 2.457847 126.3064       6.095075 123.5499       8.766308 128.8861       8.480280 100.5248 3.584290 102.6933 3.393350 -2.168541      4.935783 
1 1 1 18  5  5  o 94.06342 2.466589 107.9969       5.649093 104.4217       7.990962 111.5686       7.987087 92.40377 3.555366 95.52936 3.436558 -3.125587      4.944750 
1 1 1 18  5  6  o 173.6156 3.278752 368.0016       13.87182 387.3203       19.43546 347.9409       19.80519 177.9039 4.486626 168.5532 4.826736 9.350784       6.589931 
1 1 1 18  5  7  o 122.8889 2.879048 184.3041       8.621797 187.6366       11.53033 180.0777       12.98501 123.8599 3.824686 121.2617 4.401527 2.598122       5.831094 
1 1 1 18  5  8  o 90.25028 2.788238 99.49728       6.124818 97.28949       7.857032 102.9169       9.778420 89.16359 3.623603 91.61910 4.392518 -2.455513      5.694270 
1 1 1 18  5  9  o 137.6047 3.021124 231.1718       10.13066 239.8824       13.72888 220.7590       15.01061 140.0080 4.028077 134.2176 4.596150 5.790466       6.111465 
1 1 1 18  5  10 o 144.7015 2.750101 255.5748       9.697457 247.3569       11.81382 272.5504       16.97931 142.2891 3.407083 149.1091 4.678616 -6.820053      5.787716 
1 1 1 18  5  11 o 123.3743 2.649399 185.7873       7.965413 196.0967       9.894521 166.8021       13.42718 126.6592 3.208275 116.5827 4.736087 10.07652       5.720450 
1 1 1 18  5  12 o 105.7644 2.595077 136.5457       6.688456 138.6597       8.084162 131.9588       11.90790 106.4917 3.118541 103.6483 4.726956 2.843361       5.662986 
1 1 1 18  5  13 o 108.2316 2.643980 143.0264       6.973463 142.6136       8.388877 143.9496       12.54532 107.9775 3.191622 108.2251 4.768538 -0.2476349     5.738066 
1 1 1 18  5  14 o 94.54043 2.650097 109.2352       6.099396 104.5900       7.187425 121.1893       11.53000 92.44249 3.195355 99.25295 4.781112 -6.810463      5.750593 
1 1 1 18  5  15 o 160.9373 2.971872 316.5728       11.65529 313.7870       14.36457 321.9412       19.94048 160.0943 3.681974 161.7402 5.065443 -1.645844      6.262239 
1 1 1 18  5  16 o 80.24857 2.829959 78.81640       5.525521 83.54048       6.583170 67.55415       10.16457 82.55967 3.278654 73.76694 5.698609 8.792725       6.574474 
1 1 1 18  5  17 o 69.08643 3.016902 58.50777       5.066892 57.90625       5.966537 60.06359       9.595627 68.64547 3.579126 69.46800 5.718898 -0.8225327     6.746550 
1 1 1 18  5  18 o 190.3938 3.553313 444.6348       16.48627 433.1895       23.14440 456.4242       23.48964 187.2152 5.077733 192.2048 5.019352 -4.989609      7.139836 
1 1 1 18  5  19 o 87.02235 2.543052 92.72104       5.387113 86.82151       7.460755 99.14740       7.786755 83.98743 3.654037 89.78262 3.566095 -5.795197      5.105783 
1 1 1 18  5  20 o 188.6832 3.202551 437.0929       14.72534 455.2795       19.55515 413.2750       22.37887 192.0587 4.178218 182.3881 5.039903 9.670578       6.546612 
1 1 1 18  5  21 o 19.99400 5.478904 5.163030       2.748179 0.8941411      4.084536 8.693958       3.714752 15.60472 6.494614 25.79999 6.019135 -10.19527      8.854942 
1 1 1 18  5  22 o 62.94668 2.950401 48.83731       4.513152 46.42422       6.158414 51.63676       6.633108 61.02080 4.166470 64.33907 4.254523 -3.318275      5.954867 
1 1 1 18  5  23 o 39.89511 3.689671 19.90175       3.546471 15.13853       4.844768 25.40088       5.205584 33.98317 6.073139 44.72713 4.853694 -10.74395      7.774405 
1 1 1 18  5  24 o 21.23425 5.615937 5.978950       2.950137 0.4529333      4.102435 11.89708       4.245490 14.99007 6.387635 29.91552 6.032119 -14.92545      8.785689 
1 1 1 18  5  25 o 16.30190 6.010444 2.928394       3.148330 5.302610       5.724812 1.899012       3.769547 21.34179 8.057425 15.80976 6.368516 5.532030       10.27035 
1 1 1 18  5  26 o 81.48076 4.128378 84.46764       8.170584 72.37599       12.29836 94.02154       10.93187 72.55702 7.044087 84.81586 5.315826 -12.25884      8.824804 
1 1 1 18  5  27 o 18.71164 5.957875 4.752202       3.058393 -0.8799729     4.142490 11.50073       4.534484 13.55974 6.075084 28.40026 6.666867 -14.84052      9.019632 
1 1 1 18  5  28 o 43.00988 4.156519 24.17130       4.302244 25.29510       4.875826 20.22005       9.142602 43.64056 4.656679 33.62095 10.23919 10.01960       11.24836 
1 1 1 18  5  29 o 19.41928 5.990172 5.490301       3.116464 5.956769       4.566920 5.083774       4.263408 20.02997 7.261900 18.91980 6.991004 1.110172       10.08015 
1 1 1 18  5  30 o 25.05305 5.594195 9.166504       3.328893 7.560967       4.646103 10.86020       4.771951 21.58398 7.364903 25.85721 7.271007 -4.273230      10.34936 
1 1 1 18  5  31 o 11.02024 5.046731 -0.9959234     3.053730 2.179343       4.294300 -4.244169      4.343369 15.26876 6.521687 11.20118 5.391810 4.067586       8.461916 
1 1 1 18  5  32 o 15.52597 6.279548 3.259996       3.681390 6.403442       4.643379 -2.059702      6.040525 19.12050 7.248036 13.89288 6.596578 5.227616       9.800453 
1 1 1 18  5  33 o 11.54996 5.367357 -0.9428169     3.640679 -0.1508771     4.568452 -2.321036      6.026734 13.09770 6.060872 13.35310 6.407845 -0.2554007     8.820127 
1 1 1 18  5  34 o 13.43282 5.710380 2.165372       3.265005 1.256595       4.509474 3.166684       4.733497 13.59651 6.190611 15.05911 6.633749 -1.462598      9.073604 
1 1 1 18  5  35 o 13.88389 6.112294 2.506537       4.012838 17.76184       7.884564 -2.826415      4.661772 23.41316 9.284133 11.31716 5.481390 12.09600       10.78150 
1 1 1 18  6  0  o 142.4443 2.697301 247.4973       9.362903 254.9032       12.12785 236.5712       14.73077 144.5101 3.443891 139.0755 4.351843 5.434555       5.549678 
1 1 1 18  6  1  o 59.60443 2.388358 43.39507       3.462053 40.13673       4.560899 47.82495       5.318005 57.25299 3.282771 62.49342 3.506092 -5.240437      4.803047 
1 1 1 18  6  2  f 72.14356 2.427811 63.54764       4.262156 59.65523       5.873828 67.87611       6.194116 69.81940 3.463113 74.48959 3.421441 -4.670197      4.868204 
1 1 1 18  6  3  o 67.74068 2.488997 56.04478       4.101766 56.23024       5.560841 55.82347       6.074709 67.78548 3.377049 67.50912 3.706780 0.2763596      5.014447 
1 1 1 18  6  4  o 108.2771 2.480633 143.0018       6.545387 136.2329       9.332474 149.5549       9.182499 105.5572 3.633464 110.6258 3.410259 -5.068581      4.983164 
1 1 1 18  6  5  o 138.2678 2.675285 233.2434       9.014200 249.5515       13.72650 220.8777       11.95277 142.8574 3.946729 134.4285 3.652108 8.428909       5.377226 
1 1 1 18  6  6  o 137.4639 2.958589 230.6249       9.910819 238.6940       13.40621 220.9001       14.71741 139.7030 3.941833 134.3131 4.502889 5.389938       5.984485 
1 1 1 18  6  7  o 35.85574 3.550516 15.85678       3.061625 17.67086       3.634758 11.42615       5.680405 37.81258 4.005435 29.88995 7.738546 7.922632       8.713702 
1 1 1 18  6  8  o 63.21223 3.335664 48.93518       5.120114 51.42324       6.850325 45.78589       7.707016 64.68903 4.371214 60.90317 5.243917 3.785862       6.826872 
1 1 1 18  6  9  o 229.3301 3.914587 642.9935       21.87677 633.2776       29.66042 654.5851       32.39728 227.2545 5.355853 230.9323 5.756888 -3.677780      7.863009 
1 1 1 18  6  10 o 172.9908 3.326817 365.5946       14.02452 353.8742       18.52561 381.3288       21.46473 169.9555 4.476921 176.3118 5.000885 -6.356247      6.712054 
1 1 1 18  6  11 o 62.18288 3.007147 47.33268       4.543307 46.20546       5.408494 50.03505       8.374187 61.37035 3.632694 63.61125 5.454835 -2.240894      6.553754 
1 1 1 18  6  12 o 32.12565 4.440681 12.87973       3.383591 13.84757       3.912592 10.00887       6.738552 33.23759 4.984054 28.39134 8.816854 4.846258       10.12807 
1 1 1 18  6  13 o 25.08931 4.799074 7.978361       2.827270 9.495665       3.139007 1.457359       6.507486 27.41518 4.877336 19.89791 8.232104 7.517271       9.568487 
1 1 1 18  6  14 o 27.59748 4.633908 9.594866       3.006054 10.24258       3.372314 7.089475       6.632470 28.46072 5.047138 25.13804 8.789173 3.322687       10.13524 
1 1 1 18  6  15 o 112.7169 2.701862 155.2180       7.421438 155.6091       8.884555 154.3154       13.49928 112.7475 3.236998 111.9288 4.961504 0.8187485      5.924077 
1 1 1 18  6  16 o 201.2867 3.738327 496.5534       18.33701 484.7469       24.47878 511.6501       27.68021 198.3344 5.068876 203.5226 5.586393 -5.188232      7.543294 
1 1 1 18  6  17 o 137.7813 3.882860 233.1442       13.02401 211.0905       19.91708 249.6191       17.21453 130.2589 6.293164 142.2135 4.974937 -11.95465      8.022089 
1 1 1 18  6  18 o 40.10644 4.673588 20.09256       4.482242 21.11591       5.515551 18.10246       7.691606 40.89674 5.688052 37.08261 8.667933 3.814137       10.36759 
1 1 1 18  6  19 o 110.5858 3.228582 150.1418       8.691245 154.9449       11.40372 143.4856       13.42462 112.0563 4.183478 107.4812 5.140364 4.575012       6.627582 
1 1 1 18  6  20 o 35.58830 3.636561 15.74799       3.109515 11.64756       4.451663 19.65483       4.345302 29.93157 6.302717 39.58819 4.589119 -9.656626      7.796426 
1 1 1 18  6  21 o 62.31681 2.800910 47.76036       4.242571 42.48785       5.707172 54.27282       6.342849 58.47352 4.029859 66.14249 3.953247 -7.668964      5.645168 
1 1 1 18  6  22 o 11.79469 4.982393 0.2361149      2.459352 1.190919       3.947927 -0.3693815     3.143893 15.60561 6.429743 12.60718 5.483175 2.998424       8.450254 
1 1 1 18  6  23 o 31.91570 4.604389 13.01196       3.477636 9.067328       5.795455 15.23154       4.347301 26.00242 8.191807 34.31485 5.375122 -8.312429      9.797838 
1 1 1 18  6  24 o 28.35489 5.300908 10.54824       3.528177 0.7822320      5.535987 17.22810       4.578468 17.30509 7.398458 36.41571 5.316044 -19.11062      9.110296 
1 1 1 18  6  25 o 32.93481 4.179125 13.88700       3.278692 11.78001       4.605368 16.05246       4.668823 29.29728 6.608505 34.77746 5.706774 -5.480185      8.731529 
1 1 1 18  6  26 o 39.44481 3.598969 19.73056       3.421360 20.77698       4.865970 18.70740       4.811555 39.70680 5.150056 37.50108 5.422310 2.205723       7.478270 
1 1 1 18  6  27 o 15.21524 5.779067 2.522094       2.955470 -0.6006169     3.850097 7.002102       4.611531 13.26934 5.906766 22.11378 7.336349 -8.844446      9.418700 
1 1 1 18  6  28 o 11.21369 4.988214 -0.4886853     2.740856 1.726542       3.963768 -2.518335      3.794107 15.27944 6.381531 11.66317 5.439854 3.616270       8.385460 
1 1 1 18  6  29 o 12.92309 5.349348 1.228471       2.749858 3.307311       3.745948 -1.200991      4.049545 16.48131 6.440587 12.76800 5.833697 3.713306       8.689832 
1 1 1 18  6  30 o 20.83206 7.330645 7.003998       4.618758 7.003998       4.618758 0.000000       0.000000 20.83206 7.330645 ?        ?        0.000000       7.330645 
1 1 1 18  6  31 o 14.97462 5.985197 2.736807       3.302276 -1.394883      4.091156 10.46177       5.594105 12.33168 5.716542 23.79434 8.082084 -11.46266      9.899441 
1 1 1 18  6  32 o 19.96898 6.224136 6.571163       3.354752 5.530438       4.630321 7.721100       4.867209 18.09257 7.133409 20.40660 7.481742 -2.314028      10.33741 
1 1 1 18  6  33 o 10.33657 4.847181 -1.483552      3.080451 -0.6043529     4.306870 -2.404406      4.407713 12.51027 5.821814 11.65343 5.561779 0.8568401      8.051516 
1 1 1 18  6  34 o 11.20836 5.140853 -0.2348620     3.185276 -1.353620      4.255689 1.190252       4.803156 11.78394 5.578087 13.71767 6.299563 -1.933726      8.414248 
1 1 1 18  6  35 o 13.71204 5.743590 2.733019       3.224964 -0.3118000     4.420939 6.196081       4.714807 12.26715 5.769596 17.09838 7.033761 -4.831227      9.097363 
1 1 1 18  7  0  o 220.7047 3.096884 594.3895       16.65608 592.8611       23.44191 595.9478       23.67025 220.2601 4.367382 220.8280 4.398579 -0.5679779     6.198510 
1 1 1 18  7  1  o 237.1119 3.265158 686.1951       18.86660 685.2292       26.57582 687.1765       26.78825 236.7469 4.606450 237.0777 4.636790 -0.3308716     6.535993 
1 1 1 18  7  2  f 220.9579 3.373145 595.9865       18.16271 568.1202       27.17353 618.4891       24.41865 215.4583 5.175434 224.9344 4.454816 -9.476089      6.828653 
1 1 1 18  7  3  o 272.4628 3.931243 906.9089       26.10196 952.0633       41.60900 877.6096       33.51711 278.6401 6.127841 267.7767 5.136386 10.86343       7.995805 
1 1 1 18  7  4  o 81.32519 2.464606 80.74603       4.878735 86.74479       6.951927 74.92464       6.848385 84.22198 3.394175 78.24461 3.601338 5.977364       4.948743 
1 1 1 18  7  5  o 93.84148 2.454546 107.4927       5.608274 97.22850       7.635068 119.5201       8.264917 89.15736 3.521069 98.87368 3.435437 -9.716316      4.919365 
1 1 1 18  7  6  o 113.2929 3.229319 156.8354       8.906489 145.3616       12.87862 167.3535       12.33060 108.8667 4.866734 116.9029 4.335868 -8.036217      6.518040 
1 1 1 18  7  7  o 147.4067 3.556862 265.4384       12.77675 290.0472       20.51948 249.8557       16.32834 153.7189 5.486560 142.8011 4.698576 10.91780       7.223501 
1 1 1 18  7  8  o 143.0894 2.706566 249.8651       9.437613 242.8637       11.41966 264.9500       16.76215 141.0141 3.323185 147.0411 4.683919 -6.027023      5.743054 
1 1 1 18  7  9  o 78.15512 2.482269 74.60566       4.721622 74.03890       5.504986 76.18287       9.183324 77.82230 2.907907 78.71887 4.810203 -0.8965759     5.620852 
1 1 1 18  7  10 o 77.25291 2.520346 72.90733       4.738375 74.10297       5.502450 69.47658       9.320734 77.85126 2.905473 75.09955 5.123724 2.751717       5.890189 
1 1 1 18  7  11 o 250.4313 3.737152 766.9881       22.80686 767.6757       28.70617 765.8112       37.55618 250.2731 4.706793 249.4429 6.178375 0.8301849      7.766995 
1 1 1 18  7  12 o 61.33529 2.714882 46.02495       4.047810 47.70514       4.635692 40.63218       8.305052 62.41360 3.057191 57.13631 6.056917 5.277294       6.784738 
1 1 1 18  7  13 o 129.3031 2.692655 204.1779       8.484487 201.2788       10.17086 210.8117       15.38524 128.2737 3.256382 130.9715 4.828758 -2.697815      5.824168 
1 1 1 18  7  14 o 24.55465 4.923234 7.666492       2.843274 7.359392       3.144556 9.042670       6.656671 23.98291 5.498145 27.22318 8.801773 -3.240273      10.37790 
1 1 1 18  7  15 o 133.0963 2.763638 216.4764       8.963615 211.6894       10.71474 227.6379       16.36110 131.4848 3.346749 135.9595 4.946424 -4.474716      5.972255 
1 1 1 18  7  16 o 100.0576 3.132188 122.6237       7.627788 132.0073       9.974877 109.4090       11.83728 103.6607 3.955989 94.07381 5.183572 9.586899       6.520680 
1 1 1 18  7  17 f 106.8933 2.869229 139.8903       7.467219 139.8954       8.287265 139.8682       17.21666 106.8357 3.186723 105.7650 6.714581 1.070724       7.432415 
1 1 1 18  7  18 o 32.67923 4.407316 13.38702       3.420406 14.80808       3.737495 6.062147       8.485448 34.36305 4.576981 25.44088 9.760550 8.922171       10.78040 
1 1 1 18  7  19 o 50.53672 3.491864 31.52370       4.273878 30.89192       4.653524 34.92861       10.80319 49.95553 3.852368 51.53190 8.925980 -1.576370      9.721824 
1 1 1 18  7  20 o 44.37455 4.203992 24.54951       4.491813 27.86252       5.364131 16.77465       8.217398 47.16296 4.731085 35.21153 9.400554 11.95142       10.52395 
1 1 1 18  7  21 o 59.12963 2.911096 43.05936       4.181775 44.47466       6.477241 42.04782       5.475916 59.66564 4.487705 58.18792 3.884022 1.477718       5.935075 
1 1 1 18  7  22 o 66.52689 3.272275 54.74264       5.288695 53.59039       10.32430 55.15257       6.158008 64.33575 6.682482 66.60057 3.810151 -2.264816      7.692387 
1 1 1 18  7  23 o 17.08790 5.935544 3.446872       3.022139 4.308757       5.181692 3.002550       3.720452 20.21617 7.658195 17.22003 6.496790 2.996143       10.04272 
1 1 1 18  7  24 o 60.35714 2.916859 45.16059       4.277526 37.70574       5.569020 55.88684       6.680104 54.62338 4.216347 66.60097 4.136332 -11.97758      5.906507 
1 1 1 18  7  25 o 23.14967 5.367460 7.186291       2.968931 3.829247       4.040370 11.12646       4.377239 18.29980 6.797591 28.47074 6.458024 -10.17094      9.376210 
1 1 1 18  7  26 o 13.32008 5.317827 1.419822       2.603911 1.388495       3.866707 1.445816       3.522312 15.19175 6.320601 14.76256 6.076893 0.4291973      8.768046 
1 1 1 18  7  27 o 40.85505 3.570662 21.32907       3.519236 20.87945       4.780927 21.86081       5.199249 39.51150 5.083001 40.18408 5.449794 -0.6725769     7.452326 
1 1 1 18  7  28 o 26.71011 4.926794 9.763225       3.088716 4.931249       4.086429 16.20261       4.717412 18.90732 6.867206 33.82620 5.939458 -14.91888      9.079409 
1 1 1 18  7  29 o 28.16183 4.979673 11.03614       3.292429 11.87755       4.129567 9.568162       5.454588 28.34580 6.155067 23.96664 7.979641 4.379160       10.07767 
1 1 1 18  7  30 o 18.28592 5.844743 4.974853       2.941108 4.035050       4.056756 6.016129       4.270153 17.17939 6.705620 19.57941 7.032070 -2.400013      9.716756 
1 1 1 18  7  31 o 13.02385 5.437768 1.472006       2.876722 -0.9886628     4.020845 4.052368       4.117476 12.45014 5.734327 16.85706 6.701164 -4.406921      8.819757 
1 1 1 18  7  32 o 12.21948 5.466501 0.2776355      3.340710 0.2939782      3.920210 0.2342887      6.384479 12.93870 5.843503 15.05789 7.034206 -2.119189      9.144758 
1 1 1 18  7  33 o 9.751906 4.626927 -2.035903      2.960998 0.6879792      4.048757 -5.167955      4.341522 13.03626 5.908026 10.33885 5.068839 2.697415       7.784465 
1 1 1 18  7  34 o 17.08819 6.095056 5.197215       3.202164 4.026484       4.213506 6.797861       4.926777 15.52517 6.537891 18.00210 7.270403 -2.476933      9.777668 
1 1 1 18  8  0  o 182.7023 3.057751 407.3242       13.61389 415.9845       21.79045 401.7797       17.43551 184.3629 4.854390 181.3650 3.944983 2.997940       6.255238 
1 1 1 18  8  1  o 153.8243 2.555735 288.6169       9.580253 292.1821       13.42952 284.9224       13.67074 154.6933 3.562484 152.7495 3.672623 1.943863       5.116586 
1 1 1 18  8  2  o 164.8904 2.846321 331.7360       11.43708 334.2183       17.31961 329.8165       15.23007 165.3050 4.303140 164.3241 3.803333 0.9808807      5.743027 
1 1 1 18  8  3  o 225.5641 3.425565 621.2131       18.82948 609.7104       28.58975 630.0248       25.02305 223.1549 5.257361 226.9845 4.523849 -3.829529      6.935781 
1 1 1 18  8  4  o 159.0562 3.169408 308.8220       12.28471 310.0270       22.38560 308.3027       14.69518 158.9210 5.789990 158.8588 3.796009 0.6216431E-01  6.923415 
1 1 1 18  8  5  o 35.35315 3.788962 15.44418       3.213397 15.99186       4.373684 14.80178       4.736872 35.77439 5.166432 34.26643 5.884584 1.507965       7.830731 
1 1 1 18  8  6  o 91.48245 2.714047 102.2123       6.043810 97.46452       7.500077 111.0052       10.20668 89.26447 3.454391 95.16151 4.413380 -5.897049      5.604529 
1 1 1 18  8  7  o 163.8734 3.203388 327.9132       12.79246 335.5862       17.20708 318.4319       19.12745 165.5871 4.267825 161.1861 4.875206 4.401031       6.479349 
1 1 1 18  8  8  o 90.59774 2.445265 100.2153       5.393641 101.2035       6.383393 97.74888       10.08446 91.00744 2.881950 89.23339 4.653636 1.774048       5.473752 
1 1 1 18  8  9  o 94.31298 2.476615 108.6124       5.687090 105.2230       6.645994 117.8821       10.99073 92.78738 2.942961 98.00585 4.614876 -5.218475      5.473399 
1 1 1 18  8  10 o 179.5584 3.022318 393.7552       13.22459 394.3435       16.35447 392.6440       22.47825 179.5824 3.737116 178.8344 5.163334 0.7479401      6.373857 
1 1 1 18  8  11 o 77.85367 2.534421 74.06068       4.801919 77.08592       5.567069 65.26830       9.490737 79.39725 2.882081 72.70401 5.395252 6.693237       6.116791 
1 1 1 18  8  12 o 57.89716 2.707055 41.02197       3.808785 39.14179       4.275935 48.24388       8.380251 56.51083 3.117086 62.39325 5.570190 -5.882416      6.383044 
1 1 1 18  8  13 o 179.1151 3.348761 392.3198       14.61680 391.9132       16.44949 393.8457       31.86514 178.9354 3.772420 178.0938 7.358128 0.8416290      8.268808 
1 1 1 18  8  14 o 94.00826 2.742424 108.0590       6.275846 106.4326       6.874656 116.1936       15.37475 93.26155 3.028926 96.70566 6.562973 -3.444107      7.228209 
1 1 1 18  8  15 f 193.7719 4.160443 460.6944       19.64566 451.5016       23.24205 483.6970       36.76555 191.4768 4.985306 196.7732 7.681999 -5.296402      9.157859 
1 1 1 18  8  16 o 122.9739 2.889132 184.9615       8.657979 184.0374       9.565287 189.1513       20.36687 122.5715 3.205126 123.1226 6.814716 -0.5510788     7.530816 
1 1 1 18  8  17 o 30.18927 4.689426 11.48855       3.338009 14.84682       3.793437 -0.3252321E-01 7.026218 34.41407 4.641587 19.35715 8.306583 15.05692       9.515444 
1 1 1 18  8  18 o 18.94638 5.880615 4.455985       2.998124 5.397197       3.383231 1.013331       6.470449 20.68424 6.213709 19.30574 8.114222 1.378498       10.22012 
1 1 1 18  8  19 f 46.41359 3.663641 26.66370       4.110175 25.40662       4.665214 31.02376       8.688342 45.16750 4.289909 48.96839 7.521007 -3.800892      8.658456 
1 1 1 18  8  20 o 62.72367 2.882228 48.38544       4.393732 50.03597       5.047139 43.22016       8.928553 63.70460 3.262021 58.21047 6.399685 5.494129       7.183088 
1 1 1 18  8  21 o 32.84702 4.282516 13.60957       3.346376 11.92807       3.728774 20.56932       7.586038 30.46745 5.209243 39.10047 8.222734 -8.633022      9.733939 
1 1 1 18  8  22 o 26.46935 4.404307 8.962398       2.741120 7.002159       4.257299 10.35048       3.582506 23.08839 6.977928 28.19775 5.410311 -5.109354      8.829662 
1 1 1 18  8  23 o 11.52869 4.799676 0.4726697      2.231792 1.330016       3.327297 -0.2285368     3.009099 14.64167 5.952323 12.39098 5.376946 2.250691       8.021328 
1 1 1 18  8  24 o 73.04836 2.913214 66.15856       5.175437 59.96507       7.296720 72.42889       7.341836 68.79637 4.375039 75.87510 3.984687 -7.078728      5.917660 
1 1 1 18  8  25 o 36.05992 3.617811 16.46741       3.136220 13.56912       4.327268 19.67431       4.551816 31.77037 5.803041 38.86263 4.916184 -7.092255      7.605534 
1 1 1 18  8  26 o 49.58729 3.464948 31.11493       4.160655 29.00615       6.509088 32.57180       5.410232 46.29525 5.903761 50.13255 4.475552 -3.837296      7.408438 
1 1 1 18  8  27 o 8.946080 4.236249 -2.547076      2.458641 -4.206166      3.433780 -0.8016592     3.521983 10.07604 4.835660 12.47653 5.594798 -2.400496      7.394956 
1 1 1 18  8  28 o 15.15499 5.458868 2.904456       2.575407 1.581010       3.621216 4.258993       3.663502 14.60601 6.099857 17.78075 6.495470 -3.174740      8.910633 
1 1 1 18  8  29 o 38.88716 3.515934 19.69882       3.295873 12.92230       4.217348 30.33139       5.282689 29.62269 6.047064 47.23356 4.649750 -17.61087      7.628051 
1 1 1 18  8  30 o 16.12009 5.469912 3.705518       2.562323 4.433902       3.518804 2.883337       3.738513 17.40788 6.364854 15.63622 6.326657 1.771656       8.974295 
1 1 1 18  8  31 o 17.95391 5.619822 4.938550       2.731897 2.141433       3.526262 9.137807       4.320614 14.37024 6.011664 23.07384 7.041218 -8.703609      9.258448 
1 1 1 18  8  32 o 20.60416 5.839898 6.861106       3.065847 6.568690       4.160410 7.208601       4.535336 19.19052 6.934815 19.75751 7.225642 -0.5669842     10.01507 
1 1 1 18  8  33 o 14.41778 5.776659 3.011679       3.083831 4.536122       4.125550 1.081296       4.642460 16.33858 6.633221 13.74833 6.268033 2.590256       9.126218 
1 1 1 18  8  34 o 13.24104 5.774862 1.921522       3.507830 1.365217       3.804712 5.074617       9.058035 13.00002 5.823391 16.55109 7.919326 -3.551068      9.829934 
1 1 1 18  9  0  o 35.87770 4.013601 15.92049       3.449032 18.36759       4.805412 13.32047       4.953285 38.38367 5.276971 32.38372 6.502781 5.999958       8.374520 
1 1 1 18  9  1  o 101.8115 2.665474 126.5375       6.607448 120.6812       8.604803 134.9522       10.31455 99.35139 3.559864 105.0194 4.037890 -5.668015      5.383046 
1 1 1 18  9  2  o 88.08483 2.417210 94.70654       5.183712 94.79976       7.360821 94.61483       7.301292 88.04848 3.437189 87.96468 3.412557 0.8380127E-01  4.843534 
1 1 1 18  9  3  o 32.64415 4.196341 13.23831       3.261075 13.14139       4.685993 13.32933       4.541132 32.19532 6.197617 32.46871 5.958880 -0.2733879     8.597599 
1 1 1 18  9  4  o 216.7815 3.352958 573.8212       17.71277 589.9343       27.44253 562.3147       23.19024 219.4908 5.130642 214.4254 4.438057 5.065399       6.783793 
1 1 1 18  9  5  o 198.1437 3.531699 479.5549       17.05297 475.2295       22.98276 484.8533       25.43658 197.0451 4.786307 198.8703 5.253313 -1.825180      7.106760 
1 1 1 18  9  6  o 137.4946 2.983299 230.7686       9.995823 233.1368       13.09760 227.4651       15.46895 138.0543 3.897090 136.2472 4.665934 1.807068       6.079329 
1 1 1 18  9  7  o 168.6826 2.915538 347.3367       11.98464 337.4587       14.58739 367.8513       21.02204 166.1858 3.602030 173.2142 4.985484 -7.028336      6.150583 
1 1 1 18  9  8  o 173.7205 3.250061 368.6129       13.75874 364.9418       15.39917 383.1422       30.63503 172.7971 3.656999 176.1465 7.151748 -3.349365      8.032506 
1 1 1 18  9  9  o 222.8369 3.801109 607.1914       20.64113 626.2628       23.76037 548.5235       41.67379 226.1945 4.310575 210.3101 8.146834 15.88434       9.216939 
1 1 1 18  9  10 o 128.3701 3.278563 201.4885       10.24773 208.0547       11.92081 182.8971       20.05889 130.3758 3.756001 121.5928 6.796647 8.782990       7.765433 
1 1 1 18  9  11 o 81.87098 2.666467 81.92432       5.312789 84.44575       5.804445 68.90364       13.19029 83.10242 2.870539 74.26978 7.385735 8.832634       7.923956 
1 1 1 18  9  12 o 107.6377 2.737094 141.5863       7.173612 141.4249       7.895300 142.3503       17.17476 107.5423 3.015658 107.1692 6.608488 0.3731003      7.264042 
1 1 1 18  9  13 o 14.80787 5.515529 2.060332       2.663484 2.717504       2.830735 -3.013130      7.865236 16.05355 5.730159 18.82085 8.405965 -2.767298      10.17325 
1 1 1 18  9  14 o 135.6168 3.764600 225.4668       12.42934 247.2706       19.40064 210.2865       16.18784 141.5008 5.637560 130.6360 5.094757 10.86481       7.598594 
1 1 1 18  9  15 o 122.3505 2.954175 183.0745       8.808014 187.6834       11.00769 174.8711       14.68555 123.7065 3.655477 119.0448 5.073887 4.661728       6.253546 
1 1 1 18  9  16 o 44.51828 3.209220 24.39201       3.458195 23.75624       3.833253 27.17226       8.016059 43.87127 3.617634 46.09112 7.386228 -2.219852      8.224575 
1 1 1 18  9  17 o 77.47460 2.677357 73.51422       5.047177 69.89159       5.407082 98.04097       14.06925 75.49805 2.944589 88.41351 6.577161 -12.91545      7.206223 
1 1 1 18  9  18 o 90.24108 2.702597 99.78637       5.936521 95.44675       6.391112 127.0771       16.02722 88.20173 2.977738 100.5121 6.579574 -12.31042      7.222030 
1 1 1 18  9  19 o 23.72184 4.825222 7.223634       2.694273 6.638245       2.889189 11.12823       7.461776 22.65045 5.324705 29.28395 9.303968 -6.633505      10.71990 
1 1 1 18  9  20 o 46.27429 3.086142 26.43675       3.460210 24.33681       3.809624 36.33469       8.270883 44.29238 3.559478 53.21476 6.513629 -8.922382      7.422751 
1 1 1 18  9  21 o 11.50892 4.955155 -0.1231513     2.516049 0.2224892      2.721169 -2.159972      6.605712 12.34611 5.229311 17.08783 7.662422 -4.741722      9.276767 
1 1 1 18  9  22 o 22.97431 5.253092 6.920894       2.876808 7.583606       3.189390 4.028448       6.663123 23.99665 5.562707 21.40356 8.519345 2.593088       10.17462 
1 1 1 18  9  23 f 50.80509 2.990500 32.01906       3.686058 29.21065       5.190712 34.87595       5.235322 47.98246 4.491436 52.62340 4.115227 -4.640942      6.091641 
1 1 1 18  9  24 o 54.57403 2.775621 36.94143       3.679203 32.07810       4.913806 43.14681       5.550541 50.34543 4.039038 58.49369 3.916517 -8.148258      5.626094 
1 1 1 18  9  25 o 16.01186 5.315641 3.247027       2.420905 4.120268       3.393620 2.342149       3.454546 18.07337 6.289070 15.76222 6.177530 2.311152       8.815570 
1 1 1 18  9  26 o 17.46422 5.267066 4.101692       2.427417 2.615184       3.465612 5.533348       3.401071 15.94722 6.205472 20.01529 6.271229 -4.068068      8.822482 
1 1 1 18  9  27 o 16.07501 5.293414 3.435667       2.402196 3.728304       3.286176 3.099839       3.520336 17.03909 6.162479 16.38591 6.286730 0.6531887      8.803359 
1 1 1 18  9  28 o 38.07057 3.881616 19.00647       3.550800 22.40409       5.674344 16.81975       4.552235 39.47588 6.094600 34.53786 5.600337 4.938011       8.276951 
1 1 1 18  9  29 f 15.12185 5.873173 2.735799       3.099815 1.881562       4.875471 3.315420       4.016056 15.90997 6.874150 16.51966 6.601198 -0.6096907     9.530465 
1 1 1 18  9  30 o 16.62474 5.377125 4.025280       2.484230 1.126188       3.230160 8.222652       3.886708 13.20930 5.649487 22.62434 6.626187 -9.415043      8.707644 
1 1 1 18  9  31 f 10.96880 4.775608 0.3640428      2.390110 0.9218688      3.095610 -0.4593440     3.760961 12.60875 5.462643 12.34295 5.632810 0.2658033      7.846592 
1 1 1 18  9  32 o 27.97622 4.594707 11.36803       3.023793 12.09149       3.867799 10.23078       4.849347 27.40021 5.962418 22.98336 7.518397 4.416845       9.595662 
1 1 1 18  9  33 f 10.55873 4.801825 -0.2670233     2.703139 -1.537241      3.469451 1.695171       4.312137 10.79493 5.087666 13.86082 6.204981 -3.065886      8.024096 
1 1 1 18  9  34 f 13.82843 5.744236 2.747917       3.186418 2.856530       4.396704 2.627760       4.624470 14.44277 6.376519 14.36860 6.429511 0.7417393E-01  9.055307 
1 1 1 18  10 0  o 52.81705 3.516709 34.21233       4.500551 37.90621       6.224444 30.16558       6.514973 55.48183 4.646406 49.32609 5.514244 6.155743       7.210823 
1 1 1 18  10 1  o 200.1245 3.579398 489.0935       17.45607 478.6613       32.85105 493.1981       20.60589 197.2703 6.843998 200.8753 4.209482 -3.605011      8.034927 
1 1 1 18  10 2  o 134.8119 3.368386 221.9028       11.06588 201.7799       17.17329 236.1902       14.47055 128.2156 5.509233 138.9307 4.279262 -10.71512      6.975939 
1 1 1 18  10 3  f 11.26486 4.852560 -0.2448760     2.415315 0.3630105E-01  2.832442 -0.9942278     4.623959 12.54116 5.324512 15.13474 6.614916 -2.593575      8.491616 
1 1 1 18  10 4  o 170.3290 3.689911 354.4420       15.31583 350.7887       18.00554 364.0039       29.12948 169.3026 4.367867 171.8859 6.968795 -2.583328      8.224498 
1 1 1 18  10 5  o 117.9510 3.195136 169.9937       9.175439 173.5911       10.66704 159.7611       17.99061 119.1392 3.678527 113.8325 6.512683 5.306763       7.479746 
1 1 1 18  10 6  o 292.8435 5.361891 1051.372       38.26394 1048.547       45.90018 1057.807       69.27885 292.0488 6.449452 291.5154 9.765996 0.5334167      11.70342 
1 1 1 18  10 7  o 69.88474 2.998732 59.73845       5.095003 58.21018       5.694700 65.86964       11.40629 68.94489 3.399964 72.89693 6.488688 -3.952049      7.325492 
1 1 1 18  10 8  o 163.4205 3.229406 326.2203       12.86072 328.2050       16.91884 323.5039       19.79311 163.7132 4.244410 162.3767 5.008106 1.336426       6.564765 
1 1 1 18  10 9  o 207.8133 3.685928 528.0513       18.66621 532.5421       25.04253 522.4370       28.00047 208.4072 4.930937 206.1668 5.578402 2.240372       7.445314 
1 1 1 18  10 10 o 32.83024 5.539077 13.59938       4.273937 14.22929       5.512792 12.65037       6.766603 33.33871 7.008415 31.39697 8.594597 1.941742       11.08986 
1 1 1 18  10 11 o 132.0724 3.680558 213.5633       11.83418 212.6530       17.66442 214.3046       15.94021 131.3940 5.529164 132.0424 4.962700 -0.6483917     7.429674 
1 1 1 18  10 12 o 157.5175 3.782020 303.7128       14.51739 280.8475       20.89767 325.0397       20.18240 150.9304 5.691988 162.5708 5.100724 -11.64043      7.643043 
1 1 1 18  10 13 o 137.8747 2.733685 232.2372       9.184788 237.2592       10.99713 220.6546       16.70117 139.2824 3.240015 133.8490 5.129798 5.433441       6.067333 
1 1 1 18  10 14 o 72.57402 2.503147 64.41306       4.420312 67.91908       5.002026 51.91473       9.444195 74.49609 2.760120 64.52405 6.077897 9.972038       6.675260 
1 1 1 18  10 15 o 55.24370 2.597119 37.38028       3.486529 36.51772       3.799953 41.97145       8.766909 54.56976 2.867589 57.84630 6.322015 -3.276546      6.941969 
1 1 1 18  10 16 o 35.75930 2.980603 15.75909       2.573745 14.95376       2.725437 22.39550       7.823764 34.78847 3.252586 41.54353 8.018604 -6.755058      8.653169 
1 1 1 18  10 17 o 111.5308 2.730316 152.2426       7.420681 152.9872       8.139325 148.5762       18.06219 111.7137 2.992520 108.7055 6.853281 3.008179       7.478144 
1 1 1 18  10 18 o 18.82601 4.568187 4.554589       2.074183 4.657399       2.161294 3.355765       7.380289 19.03224 4.690629 22.11047 8.909493 -3.078234      10.06882 
1 1 1 18  10 19 o 70.77056 2.575187 61.44853       4.433767 63.15726       4.953208 54.55951       9.945539 71.69594 2.840641 65.54951 6.303831 6.146431       6.914299 
1 1 1 18  10 20 o 44.61337 2.897191 24.55618       3.132731 23.82807       3.378186 29.02739       8.371435 43.88814 3.180214 46.98454 7.568613 -3.096397      8.209608 
1 1 1 18  10 21 o 32.33723 4.688222 13.32627       3.586808 14.30078       4.074010 9.967198       7.563765 33.36887 5.177783 27.62950 9.397630 5.739370       10.72963 
1 1 1 18  10 22 o 34.24450 5.096951 15.11363       4.123968 15.11363       4.123968 0.000000       0.000000 34.24450 5.096951 ?        ?        0.000000       5.096951 
1 1 1 18  10 23 o 12.35932 5.164182 0.5481871      2.597429 0.5481871      2.597429 0.000000       0.000000 12.35932 5.164182 ?        ?        0.000000       5.164182 
1 1 1 18  10 24 o 56.79521 3.393337 40.40820       4.675092 37.32532       5.118478 55.92540       11.48337 54.34454 3.890738 63.68178 7.546263 -9.337242      8.490225 
1 1 1 18  10 25 o 10.00912 4.300346 0.2390327E-01  1.887429 2.245370       2.788545 -1.854239      2.564023 14.74262 5.610205 9.795070 4.535395 4.947550       7.214167 
1 1 1 18  10 26 o 43.91414 2.848102 24.20211       3.031427 22.20625       3.978617 26.96437       4.680587 41.48420 3.984563 45.56566 4.264838 -4.081455      5.836573 
1 1 1 18  10 27 f 13.35363 4.855869 2.099216       2.044067 4.702176       2.782559 -0.9519629     3.012622 18.33323 5.661058 11.33283 5.120014 7.000406       7.632963 
1 1 1 18  10 28 o 21.46126 4.569784 6.346683       2.316614 5.062560       3.017240 8.190793       3.615763 18.69298 5.913557 23.43153 6.226688 -4.738550      8.587304 
1 1 1 18  10 29 o 29.84025 3.723751 11.80019       2.649048 15.55191       3.524102 6.926380       4.016683 33.81812 4.378954 20.94856 6.841905 12.86956       8.123233 
1 1 1 18  10 30 o 32.96545 3.935373 14.67641       3.099044 13.42790       3.769619 17.27973       5.443340 30.39532 5.280790 32.57589 7.061091 -2.180569      8.817355 
1 1 1 18  10 31 o 17.22169 5.998048 4.674630       3.087172 7.033240       5.145708 3.348250       3.858788 19.60841 7.580350 15.68488 6.397497 3.923531       9.919157 
1 1 1 18  10 32 o 23.20563 5.109159 8.244738       2.810853 9.645881       3.843822 6.634297       4.120923 23.57841 6.487070 18.98500 6.896025 4.593407       9.467694 
1 1 1 18  10 33 o 14.36554 5.458199 3.155526       2.636944 3.625247       3.483668 2.525289       4.035237 15.13507 6.113198 14.27319 6.209842 0.8618803      8.713973 
1 1 1 18  10 34 o 13.13338 5.347729 2.397157       2.690817 2.111604       3.508898 2.804808       4.192478 13.32381 5.793817 14.26631 6.265255 -0.9425011     8.533565 
1 1 1 18  11 0  o 150.5841 3.103431 276.7672       11.38826 293.6180       22.18282 270.7365       13.27055 154.6422 5.897246 148.8845 3.657660 5.757690       6.939452 
1 1 1 18  11 1  o 143.1478 3.060036 250.1069       10.67449 271.0414       20.64156 242.4647       12.47161 148.5924 5.711092 140.8471 3.636653 7.745285       6.770659 
1 1 1 18  11 2  o 224.2791 3.855538 614.6278       21.07220 612.4219       40.44997 615.4495       24.68655 222.8942 7.457534 224.3111 4.516204 -1.416840      8.718424 
1 1 1 18  11 3  o 169.2243 3.257915 349.6537       13.43503 346.4830       17.89948 353.7448       20.33215 168.2592 4.369112 169.9153 4.915541 -1.656158      6.576602 
1 1 1 18  11 4  o 29.79571 4.255263 11.07420       3.002040 12.22014       3.494860 7.848680       5.863391 31.24973 4.737689 25.56369 8.260303 5.686045       9.522515 
1 1 1 18  11 5  o 167.4029 2.905581 342.0724       11.85310 331.4091       17.35797 351.3891       16.22495 164.5347 4.332949 169.5405 3.927116 -5.005829      5.847793 
1 1 1 18  11 6  o 92.90440 2.495687 105.3904       5.645065 108.2772       6.699452 98.32286       10.48265 94.13220 2.924098 89.46749 4.825920 4.664711       5.642682 
1 1 1 18  11 7  o 74.85189 2.492360 68.44370       4.539872 68.17577       5.236888 69.25404       9.107474 74.67246 2.883325 75.00243 5.011708 -0.3299713     5.781936 
1 1 1 18  11 8  o 164.1542 3.329118 329.2552       13.31733 332.2532       17.85830 325.4993       19.98828 164.6578 4.454727 162.8428 5.043065 1.815018       6.728826 
1 1 1 18  11 9  o 53.29238 3.377892 34.85041       4.364217 35.59857       5.201310 33.07079       8.021914 53.78885 3.996675 51.39787 6.553525 2.390984       7.676074 
1 1 1 18  11 10 o 109.9804 2.559876 147.6627       6.860729 150.7903       8.093063 139.6742       12.93431 111.0599 2.993062 106.5630 4.994713 4.496834       5.822850 
1 1 1 18  11 11 f 36.14141 3.819773 16.16376       3.313334 16.39864       3.732874 15.29147       7.193563 36.33225 4.299350 34.36852 8.608445 1.963734       9.622356 
1 1 1 18  11 12 o 45.50885 2.756469 25.39208       3.042594 24.53153       3.280139 30.69620       8.143496 44.69885 3.029235 49.32431 6.968997 -4.625462      7.598893 
1 1 1 18  11 13 o 162.8379 2.913439 324.1401       11.56106 332.3434       14.02428 306.7426       20.42352 164.7683 3.492776 157.7225 5.321365 7.045807       6.365250 
1 1 1 18  11 14 o 91.94001 2.486629 103.3429       5.566122 105.3697       6.289922 96.02562       11.95140 92.79835 2.784585 88.01360 5.601343 4.784752       6.255314 
1 1 1 18  11 15 o 62.72980 2.459712 48.16023       3.752767 50.00333       4.123211 39.26355       9.058870 63.89771 2.653753 55.75846 6.807960 8.139248       7.306896 
1 1 1 18  11 16 o 113.6491 3.230545 158.4201       8.937931 157.2225       10.14274 162.5816       18.90757 113.1063 3.684788 113.8405 6.847229 -0.7342529     7.775744 
1 1 1 18  11 17 o 51.22614 3.017380 32.27264       3.749990 34.75316       4.177490 21.97988       8.509608 53.12785 3.242126 40.74014 8.826942 12.38770       9.403525 
1 1 1 18  11 18 o 46.80962 3.156590 27.02319       3.579667 29.64094       3.987739 16.16071       8.123205 48.99616 3.360205 34.65086 9.388621 14.34530       9.971820 
1 1 1 18  11 19 o 25.09690 3.815220 7.945932       2.259952 8.023410       2.369004 7.162042       7.535403 25.18240 3.993516 25.26867 9.301727 -0.8627510E-01 10.12276 
1 1 1 18  11 20 o 21.81604 8.147274 5.081159       5.819194 5.036947       6.549575 5.246887       12.68055 22.40503 8.580384 27.40448 11.42743 -4.999453      14.29018 
1 1 1 18  11 21 o 56.19154 5.825042 40.55673       7.860821 47.87140       9.454165 24.17355       14.14898 60.73235 6.488431 39.83758 12.82810 20.89477       14.37567 
1 1 1 18  11 22 o 53.55698 5.323569 36.82283       6.856035 33.22329       8.618274 43.02748       11.31502 49.75223 7.327606 55.82930 8.591896 -6.077072      11.29223 
1 1 1 18  11 23 o 11.63943 4.437634 1.246483       1.746776 0.7074140      1.788510 12.39443       8.133302 10.82036 4.376709 29.22138 9.744332 -18.40102      10.68212 
1 1 1 18  11 24 o 26.58587 3.701656 9.039577       2.333238 8.798432       2.429331 11.90815       8.378787 26.14460 3.934882 28.21587 9.877769 -2.071272      10.63267 
1 1 1 18  11 25 o 24.02508 5.037534 7.774746       2.854911 7.232597       3.046429 11.68445       8.180954 22.97336 5.512225 27.36395 9.744158 -4.390594      11.19523 
1 1 1 18  11 26 o 9.615984 4.075642 0.2189698      1.654784 -0.4945224     2.525942 0.7554122      2.190233 10.81802 4.801774 11.56068 4.778681 -0.7426682     6.774424 
1 1 1 18  11 27 o 33.64480 3.750220 14.75491       3.022546 15.04685       3.220370 12.59529       8.758830 33.84343 3.980811 26.30981 9.958915 7.533611       10.72506 
1 1 1 18  11 28 o 28.52043 3.495958 10.63358       2.378979 8.716541       3.027344 13.72880       3.846730 24.81948 5.173281 31.25739 5.235091 -6.437912      7.359960 
1 1 1 18  11 29 o 11.11550 4.558176 0.9296206      1.972001 3.075450       2.637239 -1.791849      2.969980 15.14811 5.514546 10.35084 4.822812 4.797273       7.325963 
1 1 1 18  11 30 o 17.97108 4.941844 4.742025       2.231354 6.282288       2.948399 2.677236       3.413711 20.18041 5.729357 14.90579 6.040335 5.274618       8.325334 
1 1 1 18  11 31 o 15.69347 5.310983 3.713445       2.415480 3.794544       3.245542 3.612747       3.616495 15.87645 6.049898 15.76358 6.275764 0.1128702      8.717023 
1 1 1 18  11 32 o 18.29177 5.166090 5.261358       2.403536 6.421216       3.069660 3.423509       3.864051 19.52587 5.930276 15.25799 6.330759 4.267879       8.674484 
1 1 1 18  11 33 o 10.80260 4.935048 -0.2355589     2.896757 -0.5000446E-01 4.714435 -0.3481039     3.671614 12.91716 6.037588 11.71694 5.425975 1.200219       8.117492 
1 1 1 18  12 0  o 85.71429 2.848575 89.75323       5.941735 83.52200       10.94156 92.35931       7.075980 82.38281 5.481299 86.90839 3.347353 -4.525581      6.422571 
1 1 1 18  12 1  o 202.9591 3.621470 503.1750       17.91140 509.2693       34.78230 500.9756       20.89485 203.3587 7.029314 202.4212 4.235916 0.9375305      8.206963 
1 1 1 18  12 2  o 54.73960 3.905286 36.80474       5.175216 35.41221       7.407009 38.13291       7.233786 53.42828 5.780967 55.52311 5.415066 -2.094830      7.921017 
1 1 1 18  12 3  f 45.54289 3.283790 25.45922       3.619981 27.41695       4.292887 20.64111       6.734597 47.21880 3.761849 40.37383 7.104341 6.844971       8.038854 
1 1 1 18  12 4  o 88.32423 2.496408 95.25654       5.367791 95.65862       7.486368 94.83112       7.700570 88.42163 3.481176 88.02537 3.597451 0.3962631      5.006021 
1 1 1 18  12 5  o 70.35839 2.352244 60.45931       4.027388 61.84548       5.026925 57.97499       6.729744 71.11759 2.906735 68.73577 4.035473 2.381821       4.973344 
1 1 1 18  12 6  o 106.4486 2.532369 138.2764       6.569058 134.3860       7.717361 148.5100       12.51647 104.8633 3.023173 110.0174 4.679263 -5.154144      5.570914 
1 1 1 18  12 7  f 216.1375 3.833363 571.3126       20.19046 557.8543       27.10701 588.0834       30.25967 213.2414 5.216436 218.7321 5.681767 -5.490677      7.713215 
1 1 1 18  12 8  o 142.2290 2.731161 246.9760       9.466107 242.9358       11.35094 256.2028       17.15368 140.9953 3.303627 144.4632 4.879640 -3.467865      5.892778 
1 1 1 18  12 9  o 37.83029 3.118580 17.60416       2.849455 17.29388       3.135744 19.07443       6.825916 37.44967 3.475689 38.61678 7.524083 -1.167114      8.288078 
1 1 1 18  12 10 o 120.1618 3.852173 176.9110       11.26541 181.9025       17.70467 173.5153       14.60299 121.3703 6.004682 118.7634 5.057298 2.606888       7.850635 
1 1 1 18  12 11 o 74.30729 2.457165 67.48558       4.443286 71.67150       5.036579 52.79200       9.436353 76.55520 2.704004 65.16730 6.009730 11.38789       6.590030 
1 1 1 18  12 12 o 201.1986 4.472198 496.9044       21.92715 451.8908       34.37254 527.7926       28.47322 190.5072 7.418142 206.8272 5.654582 -16.32001      9.327547 
1 1 1 18  12 13 o 84.84364 4.041342 88.49639       8.331642 83.42205       12.15658 92.99121       11.44136 81.89111 6.136326 86.66752 5.444842 -4.776413      8.203707 
1 1 1 18  12 14 o 185.9901 5.185680 427.0546       23.48051 411.2112       31.63879 446.4796       35.03292 181.4300 7.170190 188.7541 7.632035 -7.324066      10.47185 
1 1 1 18  12 15 o 67.71674 4.423614 56.68314       7.259810 63.71231       10.60976 50.49440       9.955303 71.34919 6.162459 63.34864 6.542871 8.000549       8.988051 
1 1 1 18  12 16 o 66.20309 4.408602 54.26745       7.071859 70.06056       10.54586 41.36251       9.532919 74.84256 5.828168 57.02615 7.006992 17.81641       9.114026 
1 1 1 18  12 17 o 32.40347 7.874108 13.86569       6.155799 16.07238       7.017613 6.500237       12.82088 34.79585 8.377173 28.92029 11.71086 5.875565       14.39866 
1 1 1 18  12 18 o 24.94277 8.239760 7.787395       5.818988 13.29557       6.531807 -13.39761      12.80984 31.54069 8.363195 20.19474 9.593828 11.34595       12.72732 
1 1 1 18  12 19 o 54.24184 6.164633 37.62859       8.004118 48.57556       9.563528 12.02820       14.62496 61.56723 6.470913 32.58974 12.72874 28.97749       14.27913 
1 1 1 18  12 20 o 44.29593 5.509812 25.10999       5.819337 30.01800       8.305455 20.37686       8.156148 47.65022 7.391911 38.45030 8.883265 9.199921       11.55650 
1 1 1 18  12 21 o 62.24847 4.471437 48.79942       6.737657 55.65393       9.859095 42.79300       9.229050 65.51800 6.250719 57.09301 6.764718 8.424988       9.210478 
1 1 1 18  12 22 o 18.21200 7.259186 2.825247       4.844398 2.200594       6.189414 3.813039       7.783286 19.16910 7.987771 21.92574 9.030264 -2.756641      12.05612 
1 1 1 18  12 23 o 25.50238 7.777510 9.126455       5.272532 3.459198       6.693683 18.39080       8.558270 20.42498 8.389250 34.88633 9.711084 -14.46135      12.83295 
1 1 1 18  12 24 o 35.83395 7.063014 18.04933       5.948288 21.15975       7.899305 13.97582       9.039889 37.56558 8.786482 29.73518 10.26884 7.830406       13.51486 
1 1 1 18  12 25 o 12.56766 4.759762 1.608205       2.001391 1.230485       2.074147 6.710748       7.623377 12.07973 4.770712 22.77071 9.096288 -10.69099      10.27142 
1 1 1 18  12 26 o 27.80793 3.180411 9.890754       2.116482 9.557668       2.180573 15.30855       8.794350 27.25948 3.353165 29.24978 10.12711 -1.990301      10.66780 
1 1 1 18  12 27 o 44.77946 2.849430 25.41819       3.093245 24.99710       3.267004 29.06383       9.612863 44.28402 3.045929 40.21938 9.880465 4.064648       10.33931 
1 1 1 18  12 28 o 14.54611 4.699328 2.877211       1.897762 4.974899       2.580539 0.4064414      2.800632 18.54344 5.390221 12.00908 5.199367 6.534356       7.489185 
1 1 1 18  12 29 o 21.31623 4.601501 6.415326       2.320135 8.605535       3.240914 4.112825       3.322956 24.01252 5.635866 16.86856 6.182374 7.143963       8.365687 
1 1 1 18  12 30 o 13.89444 5.181376 2.566550       2.351878 3.020201       2.506042 -0.7840123     6.810610 14.70295 5.372076 15.20264 7.153629 -0.4996872     8.946151 
1 1 1 18  12 31 o 14.26288 4.910754 2.966328       2.066807 3.777654       2.703244 1.824719       3.206609 15.67696 5.599201 13.41746 5.679559 2.259502       7.975490 
1 1 1 18  12 32 o 15.99287 5.123814 4.020894       2.259308 6.038921       2.873517 0.7534732      3.656392 19.03104 5.728665 12.65043 5.684427 6.380608       8.070335 
1 1 1 18  12 33 o 11.03630 4.698570 1.016489       2.216166 1.259184       2.733920 0.5514066      3.784602 11.93291 5.151660 12.39669 5.654709 -0.4637833     7.649532 
1 1 1 18  13 0  o 147.5757 3.098485 265.8601       11.14295 276.3546       21.79803 262.1476       12.96495 149.9605 5.976887 146.4902 3.631835 3.470352       6.993812 
1 1 1 18  13 1  o 324.4286 5.926127 1291.590       46.85179 1259.824       78.11659 1309.436       58.55197 318.1378 10.08884 326.0333 7.369592 -7.895508      12.49382 
1 1 1 18  13 2  o 212.1817 4.396029 550.7863       22.73027 591.5049       38.92506 529.7166       28.00019 218.9887 7.304316 207.7657 5.535261 11.22308       9.164722 
1 1 1 18  13 3  o 223.9881 3.430945 612.8740       18.72728 605.7416       28.41806 618.3490       24.89834 222.2999 5.245888 224.7687 4.545676 -2.468811      6.941362 
1 1 1 18  13 4  o 52.24723 2.846400 33.42035       3.610372 38.13901       4.837433 27.48685       5.424526 55.75267 3.579428 47.13479 4.789052 8.617886       5.978907 
1 1 1 18  13 5  o 287.5054 3.761197 1010.570       26.35167 1012.488       36.66540 1008.521       37.89899 287.3233 5.236601 286.6916 5.424710 0.6317139      7.539859 
1 1 1 18  13 6  o 74.48261 3.774982 68.01061       6.829476 58.05538       9.920643 76.97842       9.415797 68.45984 6.007416 79.09449 4.909315 -10.63465      7.758249 
1 1 1 18  13 7  o 161.6503 2.898139 319.1109       11.41647 330.9051       14.18159 297.3933       19.24403 164.5194 3.537299 155.6072 5.081745 8.912201       6.191657 
1 1 1 18  13 8  o 120.7800 2.598089 178.0879       7.646898 169.4780       8.890294 202.5729       14.99222 117.7355 3.101350 128.4297 4.798757 -10.69416      5.713706 
1 1 1 18  13 9  o 66.74693 4.655833 54.90058       7.525464 60.83593       10.01324 47.19682       11.40783 70.04696 5.921519 61.20295 7.827772 8.844013       9.815212 
1 1 1 18  13 10 o 22.96331 7.513525 6.310473       4.842939 6.014752       6.339607 6.724886       7.504786 23.80160 8.565788 25.47429 9.298194 -1.672695      12.64235 
1 1 1 18  13 11 o 66.09872 4.264664 53.80437       6.832664 57.32001       9.996994 50.72240       9.360108 67.86616 6.110126 63.81297 6.093051 4.053185       8.628958 
1 1 1 18  13 12 o 34.58315 6.387884 15.26062       5.185150 23.70603       7.356474 6.922567       7.309569 43.10284 7.261528 25.42284 9.191366 17.68000       11.71371 
1 1 1 18  13 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  13 14 o 96.75259 4.894278 115.7281       11.50203 135.7485       14.72944 84.44263       18.41289 104.5089 5.806410 80.93349 9.517648 23.57536       11.14899 
1 1 1 18  13 15 o 11.99597 5.782021 -7.571852      5.033938 -10.65926      5.461290 9.871569       12.98119 11.58245 5.679881 31.39724 12.06559 -19.81479      13.33565 
1 1 1 18  13 16 o 65.59939 4.513371 53.39365       7.171038 66.93746       10.57903 41.88017       9.753909 73.00997 5.998901 57.25388 7.146134 15.75609       9.330276 
1 1 1 18  13 17 o 37.69540 6.119284 18.24282       5.428561 20.12645       7.690326 16.37206       7.664031 38.90605 8.360486 34.90348 8.964240 4.002563       12.25787 
1 1 1 18  13 18 o 28.34012 7.050899 10.62609       4.849638 9.760023       6.434607 11.76495       7.378782 27.35088 8.633711 29.75408 9.223926 -2.403198      12.63415 
1 1 1 18  13 19 o 29.46812 6.941698 11.55443       4.902265 12.31036       6.728479 10.69914       7.157050 30.11845 8.688698 28.38260 9.122126 1.735844       12.59788 
1 1 1 18  13 20 o 28.45284 7.097619 10.90949       4.904669 7.878832       6.659993 14.50091       7.250008 25.03617 8.803311 32.27143 8.921030 -7.235258      12.53328 
1 1 1 18  13 21 f 18.74244 7.094719 3.663405       4.445302 1.512502       6.189559 5.954698       6.388364 18.72963 7.907649 22.74142 8.527504 -4.011787      11.62967 
1 1 1 18  13 22 o 61.16290 5.110137 48.12748       7.546978 44.43549       9.883139 53.29168       11.68871 57.27891 7.242106 62.23304 7.884094 -4.954124      10.70547 
1 1 1 18  13 23 o 18.65816 7.409299 3.366205       5.028558 4.584881       6.414214 1.422686       8.100162 20.96106 8.353606 20.15420 8.782920 0.8068562      12.12116 
1 1 1 18  13 24 o 19.73711 7.629420 4.553603       5.212198 12.56912       6.825613 -6.658314      8.072642 28.60763 8.871926 15.98090 7.598855 12.62673       11.68134 
1 1 1 18  13 25 o 12.54940 5.914459 -3.775305      4.688399 -7.330562      6.129559 1.237292       7.278219 13.10710 6.333064 18.54061 8.194098 -5.433510      10.35620 
1 1 1 18  13 26 o 19.03340 8.368758 2.566582       7.500633 0.000000       0.000000 2.566582       7.500633 ?        ?        19.03340 8.368758 0.000000       8.368758 
1 1 1 18  13 27 o 19.92993 8.479743 4.990117       7.210655 0.000000       0.000000 4.990117       7.210655 ?        ?        19.92993 8.479743 0.000000       8.479743 
1 1 1 18  13 28 o 36.83143 7.501072 21.89905       6.503543 21.23063       9.385459 22.51646       9.020210 31.40429 10.46747 33.13594 10.18559 -1.731659      14.60528 
1 1 1 18  13 29 o 16.61451 7.051916 3.261536       4.966001 4.688914       7.146058 1.928424       6.906061 18.59214 8.171861 16.89742 7.680840 1.694721       11.21493 
1 1 1 18  13 30 o 11.60865 4.810686 1.145876       2.227415 2.369415       8.016546 1.043514       2.318717 17.05756 7.939571 11.61093 4.867284 5.446633       9.312746 
1 1 1 18  13 31 o 11.97215 4.636410 1.755523       1.927511 2.907212       2.678524 0.5185686      2.775907 14.26640 5.481170 11.51688 5.076446 2.749519       7.470845 
1 1 1 18  13 32 f 28.91734 4.466969 12.28226       3.046482 12.28226       3.046482 0.000000       0.000000 28.91734 4.466969 ?        ?        0.000000       4.466969 
1 1 1 18  13 33 o 11.17232 4.872690 0.8347964      2.497497 0.8347964      2.497497 0.000000       0.000000 11.17232 4.872690 ?        ?        0.000000       4.872690 
1 1 1 18  14 0  o 140.9930 3.688165 243.0696       12.66108 256.5756       20.98073 235.3342       15.87813 144.4531 5.973043 138.5756 4.708771 5.877457       7.605903 
1 1 1 18  14 1  f 197.5501 3.596155 476.8359       17.31218 500.9058       34.40906 468.6778       20.03234 201.5725 7.015652 195.7540 4.199376 5.818481       8.176437 
1 1 1 18  14 2  o 156.1297 3.827673 297.9833       14.56319 315.8192       24.03447 287.6358       18.30654 160.2035 6.167916 153.1567 4.911293 7.046768       7.884414 
1 1 1 18  14 3  o 84.76186 2.472707 87.73867       5.102050 84.25570       7.033282 91.60727       7.412416 82.96692 3.486471 86.51280 3.523326 -3.545883      4.956743 
1 1 1 18  14 4  o 124.0632 2.386928 187.7989       7.216363 181.6593       9.424150 196.5016       11.22015 121.9125 3.174881 126.7378 3.636685 -4.825294      4.827561 
1 1 1 18  14 5  o 52.23371 2.918771 33.41934       3.700465 38.21777       4.970154 27.45086       5.543096 55.78918 3.676300 47.07058 4.904286 8.718601       6.129209 
1 1 1 18  14 6  o 12.79470 4.864303 1.404081       2.095101 -0.3950954E-01 2.405425 5.941150       4.264396 11.46697 4.888929 22.12612 7.034011 -10.65915      8.566151 
1 1 1 18  14 7  o 26.41780 4.013102 8.734137       2.502371 8.618268       2.681332 9.516253       6.966323 26.18030 4.355794 27.94782 9.001381 -1.767515      9.999889 
1 1 1 18  14 8  o 163.5885 3.780335 327.4805       15.07021 332.9186       17.57859 312.3994       29.27338 164.7623 4.382035 158.5714 7.597616 6.190887       8.770746 
1 1 1 18  14 9  o 79.29787 4.935174 77.51570       9.489472 89.51476       11.95266 57.05759       15.60716 85.05703 5.801307 66.72562 9.897898 18.33141       11.47273 
1 1 1 18  14 10 o 152.5149 4.934946 286.1978       18.31719 314.6784       24.97600 253.0501       26.94471 159.3931 6.443373 142.3619 7.796589 17.03117       10.11454 
1 1 1 18  14 11 o 48.61376 6.189463 29.67885       7.166400 39.31064       8.463417 5.277739       13.47091 56.02446 6.308691 29.36880 11.96282 26.65566       13.52437 
1 1 1 18  14 12 o 125.9361 4.796289 195.4668       14.69255 181.1883       18.13710 222.7237       25.05911 120.7862 6.182462 133.2500 7.750702 -12.46375      9.914445 
1 1 1 18  14 13 o 30.82341 6.858698 12.29039       5.018991 16.01245       6.908943 8.131292       7.303317 34.99972 8.238263 26.48984 9.225525 8.509882       12.36848 
1 1 1 18  14 14 o 44.57563 5.416133 24.95011       5.762740 23.89815       7.824476 26.19718       8.519272 42.97056 7.757592 44.93914 8.076168 -1.968578      11.19843 
1 1 1 18  14 15 o 42.91483 5.406014 23.20082       5.528366 16.41836       7.375791 31.89611       8.351357 35.19657 8.659692 49.92276 7.061628 -14.72620      11.17394 
1 1 1 18  14 16 o 14.95640 6.494271 -0.4749474     4.395296 5.422873       6.378924 -5.806108      6.064745 22.88887 8.533645 14.49502 6.798507 8.393851       10.91067 
1 1 1 18  14 17 o 52.53684 4.862379 34.60751       6.154519 45.75349       9.211282 25.61897       8.271907 59.89434 6.410593 44.04511 8.001388 15.84923       10.25270 
1 1 1 18  14 18 f 58.24472 4.673382 42.52076       6.577591 59.52559       10.07350 29.88204       8.684522 68.34471 6.112857 47.56165 7.760292 20.78307       9.878721 
1 1 1 18  14 19 o 13.50930 6.112611 -2.012985      4.313274 -4.278537      5.695162 1.034553       6.605316 14.49748 6.728868 19.09075 8.119105 -4.593268      10.54502 
1 1 1 18  14 20 o 24.34314 7.285127 7.939062       4.657173 6.140756       6.516733 9.816186       6.658013 23.10650 8.623243 26.95021 8.809199 -3.843718      12.32730 
1 1 1 18  14 21 o 79.10319 4.656629 79.39365       8.936683 78.42934       11.92567 80.62868       13.49633 77.29172 6.388609 77.61925 7.217978 -0.3275299     9.639167 
1 1 1 18  14 22 o 27.08966 7.908852 10.42386       5.544751 8.269828       7.153660 13.66528       8.775459 24.88249 9.078705 30.15397 10.12281 -5.271482      13.59758 
1 1 1 18  14 23 o 34.68497 7.224288 17.03463       5.907648 18.54449       7.650801 14.80506       9.297125 34.98083 8.942024 30.43184 10.41744 4.548986       13.72890 
1 1 1 18  14 24 o 12.87354 6.007195 -3.162826      4.635519 -4.237628      6.139548 -1.737714      7.069630 14.51493 6.818118 16.87062 7.708097 -2.355696      10.29085 
1 1 1 18  14 25 o 22.49014 9.061139 7.086459       7.632430 0.000000       0.000000 7.086459       7.632430 ?        ?        22.49014 9.061139 0.000000       9.061139 
1 1 1 18  14 26 o 34.19947 10.07031 21.73591       8.956648 0.000000       0.000000 21.73591       8.956648 ?        ?        34.19947 10.07031 0.000000       10.07031 
1 1 1 18  14 27 o 33.49397 9.691241 21.16993       8.359261 0.000000       0.000000 21.16993       8.359261 ?        ?        33.49397 9.691241 0.000000       9.691241 
1 1 1 18  14 28 o 24.68464 8.003413 10.78849       5.501549 12.47580       7.965212 9.249208       7.607817 24.64168 9.455932 22.20006 9.009604 2.441618       13.06092 
1 1 1 18  14 29 o 19.48645 7.800159 6.595697       5.617254 14.46279       8.661651 0.8852997      7.379495 24.63885 9.743339 16.43746 7.639620 8.201395       12.38129 
1 1 1 18  14 30 o 21.78834 8.237559 9.965101       5.988471 13.25896       9.097854 7.446965       7.954742 22.30239 9.508258 19.24989 8.534071 3.052502       12.77644 
1 1 1 18  14 31 o 21.01941 8.232759 10.11167       6.132293 9.961712       8.990380 10.24215       8.385885 19.54685 8.836581 19.87346 8.788777 -0.3266106     12.46306 
1 1 1 18  14 32 o 12.72447 6.313926 -6.560126      7.469801 -6.560126      7.469801 0.000000       0.000000 12.72447 6.313926 ?        ?        0.000000       6.313926 
1 1 1 18  15 0  o 127.6453 3.394899 199.1756       10.55072 181.1579       17.48602 209.4907       13.23051 121.3170 5.932699 130.8059 4.155895 -9.488976      7.243506 
1 1 1 18  15 1  o 23.01693 7.893133 6.002089       5.337938 4.266054       6.340915 10.22502       9.889627 22.16509 8.453876 30.38950 10.72397 -8.224409      13.65545 
1 1 1 18  15 2  o 37.71639 4.544482 17.66638       4.092793 11.02657       6.389706 22.28578       5.329615 29.48193 8.455404 42.30481 5.284704 -12.82289      9.971056 
1 1 1 18  15 3  o 98.67516 3.326218 119.0991       7.986810 137.7169       13.41764 108.8825       9.939497 105.8288 5.218886 94.21140 4.341039 11.61736       6.788328 
1 1 1 18  15 4  o 217.2759 3.335779 576.8974       17.66221 548.0106       21.84354 631.4500       30.01791 211.5771 4.236608 226.7711 5.431962 -15.19397      6.888763 
1 1 1 18  15 5  o 196.8271 3.531330 473.6538       16.93789 451.4053       22.80401 501.0330       25.29708 191.7895 4.883191 201.9855 5.143605 -10.19604      7.092407 
1 1 1 18  15 6  o 104.4559 3.018546 133.4047       7.675581 136.8459       9.748566 127.7920       12.45025 105.6913 3.791136 101.9193 5.028384 3.771980       6.297409 
1 1 1 18  15 7  o 188.6909 3.121936 435.1095       14.35526 434.3446       17.57862 436.6408       24.87229 188.3841 3.829167 188.3837 5.423612 0.3662109E-03  6.639133 
1 1 1 18  15 8  o 91.66715 3.842568 103.0605       8.564603 111.1731       13.18381 97.13698       11.26551 94.84105 5.731123 88.73757 5.232862 6.103477       7.760710 
1 1 1 18  15 9  o 149.6877 4.003057 274.7834       14.58894 270.4672       23.14546 277.6287       18.79197 147.7502 6.443877 150.1469 5.143535 -2.396637      8.244967 
1 1 1 18  15 10 o 57.73752 4.487290 41.18143       6.264084 33.63655       8.919353 48.52468       8.799371 51.52317 7.308722 62.42433 5.852698 -10.90116      9.363306 
1 1 1 18  15 11 o 85.85767 4.004421 90.63647       8.355201 109.0505       12.97891 77.60484       10.91849 93.77661 5.706480 79.05257 5.706146 14.72404       8.069945 
1 1 1 18  15 12 o 48.00859 4.988017 28.71610       5.750602 26.21833       7.904155 31.52503       8.382027 45.24203 7.426781 49.79522 7.109150 -4.553192      10.28091 
1 1 1 18  15 13 o 88.89722 4.492409 97.59830       9.700486 97.04122       12.78535 98.35400       14.89134 88.18788 5.984778 88.42016 6.967347 -0.2322769     9.184852 
1 1 1 18  15 14 o 53.69091 4.768473 35.89311       6.174191 46.26580       9.101140 27.04918       8.403746 60.58303 6.254460 45.67322 7.832290 14.90981       10.02312 
1 1 1 18  15 15 o 44.73572 5.353132 25.22561       5.720056 30.48394       8.058969 19.88716       8.120137 48.71540 6.988402 38.61150 8.823376 10.10390       11.25565 
1 1 1 18  15 16 o 33.99163 6.713622 15.07645       5.363782 15.23109       7.439116 14.90901       7.740951 33.62778 8.929124 33.24879 9.228432 0.3789902      12.84107 
1 1 1 18  15 17 o 47.09107 5.336999 28.09961       6.016659 38.74556       9.190048 20.11347       7.959650 54.67936 7.061703 38.55037 8.682230 16.12899       11.19146 
1 1 1 18  15 18 o 18.90928 7.090818 3.666118       4.417204 4.615659       6.234851 2.709219       6.258958 21.67368 8.353310 20.02043 8.154532 1.653244       11.67365 
1 1 1 18  15 19 o 22.39350 7.231162 6.489097       4.493847 7.667811       6.231265 5.211661       6.486963 24.56142 8.523458 22.27627 8.537213 2.285156       12.06372 
1 1 1 18  15 20 o 67.96191 4.766254 58.63281       7.843623 61.32999       10.54921 55.29827       11.72956 68.43967 6.399424 64.01707 7.671419 4.422592       9.990160 
1 1 1 18  15 21 o 15.11794 6.599853 -0.1761630     4.591256 -5.041687      5.932444 7.090492       7.249968 14.23335 6.690965 23.98370 9.064617 -9.750349      11.26660 
1 1 1 18  15 22 o 36.59277 7.045363 18.64425       6.054589 19.20256       8.148532 17.95608       9.046689 35.57719 9.297299 33.77340 10.16424 1.803787       13.77503 
1 1 1 18  15 23 o 22.33499 9.143728 5.603935       7.918782 0.000000       0.000000 5.603935       7.918782 ?        ?        22.33499 9.143728 0.000000       9.143728 
1 1 1 18  15 24 o 33.23659 9.859172 18.74344       8.559078 0.000000       0.000000 18.74344       8.559078 ?        ?        33.23659 9.859172 0.000000       9.859172 
1 1 1 18  15 25 o 21.48810 7.704172 6.918324       5.122955 3.129297       6.742334 12.09370       7.879838 18.87147 8.118157 26.31669 9.539200 -7.445221      12.52601 
1 1 1 18  15 26 o 15.88651 6.851569 1.669188       4.826277 -2.625627      6.682878 6.350925       6.977419 15.25618 7.149446 20.88581 8.570409 -5.629625      11.16094 
1 1 1 18  15 27 o 51.95717 5.713440 38.89824       7.114772 35.13878       9.867377 42.96933       10.26820 43.86011 9.506827 49.94472 8.755659 -6.084610      12.92445 
1 1 1 18  15 28 o 14.24023 6.529929 -0.3703498     5.135107 4.310529       7.617011 -4.270300      6.952651 18.60865 8.294295 14.23138 6.843088 4.377270       10.75282 
1 1 1 18  15 29 o 13.91614 6.455500 -0.5462428     5.230867 1.567235       7.813493 -2.262810      7.041687 16.72528 7.802742 14.67742 7.011836 2.047865       10.49041 
1 1 1 18  15 30 o 13.49680 6.579745 -4.403670      7.016688 -4.403670      7.016688 0.000000       0.000000 13.49680 6.579745 ?        ?        0.000000       6.579745 
1 1 1 18  15 31 o 17.64014 7.626885 6.138151       6.009786 10.77401       8.994780 2.399786       8.077298 19.65902 8.867514 16.05031 7.623012 3.608706       11.69372 
1 1 1 18  15 32 o 9.677867 4.874422 -10.82227      5.276082 -5.346806      8.064004 -14.92058      6.976580 13.31291 6.597939 10.55206 5.348283 2.760849       8.493346 
1 1 1 18  16 0  o 110.7269 2.957937 149.8081       7.974234 139.5652       15.01000 153.8359       9.412369 106.4384 5.808924 112.1504 3.448087 -5.712044      6.755212 
1 1 1 18  16 1  o 110.3171 3.659446 148.9413       9.824099 150.3742       15.15299 147.9023       12.90332 110.5122 5.645384 109.7503 4.836461 0.7619019      7.433822 
1 1 1 18  16 2  o 157.6003 3.671559 303.6967       14.10079 310.4753       24.10457 300.1703       17.38596 158.7065 6.244779 156.4681 4.564585 2.238388       7.735160 
1 1 1 18  16 3  o 103.2522 3.336384 130.4223       8.383798 142.3919       14.09916 123.8750       10.42763 107.5507 5.396766 100.4946 4.267727 7.056175       6.880303 
1 1 1 18  16 4  o 105.0953 2.559684 134.8248       6.555499 136.1866       9.471225 133.5723       9.082725 105.4567 3.691188 104.4548 3.573483 1.001877       5.137572 
1 1 1 18  16 5  o 38.24332 4.378540 18.15067       4.007091 36.63245       7.599353 11.03305       4.715982 54.25714 5.839383 29.32344 6.740889 24.93370       8.918406 
1 1 1 18  16 6  o 37.21588 2.773396 17.00925       2.497138 20.22443       2.994113 9.662700       4.525929 40.56909 3.050918 27.43047 6.803940 13.13862       7.456655 
1 1 1 18  16 7  o 159.8280 4.055359 313.1817       15.78220 310.8070       25.36025 314.6827       20.16217 158.4256 6.583238 159.9002 5.181148 -1.474655      8.377548 
1 1 1 18  16 8  o 216.5893 4.660840 576.1373       24.60012 643.1980       43.21710 543.9937       29.92046 227.0989 7.820836 209.9034 5.855138 17.19548       9.769755 
1 1 1 18  16 9  o 96.81464 3.868479 115.0650       9.108400 121.9091       14.07135 110.1292       11.94961 99.18938 5.847435 94.42304 5.213489 4.766335       7.834090 
1 1 1 18  16 10 o 107.9638 3.886231 143.1421       10.20784 135.2310       15.28875 149.5054       13.71178 104.3564 6.037752 110.0253 5.128159 -5.668961      7.921645 
1 1 1 18  16 11 f 63.29012 4.436138 49.50795       6.798578 50.95675       9.723502 48.12226       9.509357 63.75249 6.342830 61.92317 6.393589 1.829319       9.006080 
1 1 1 18  16 12 o 14.44064 6.320280 -0.8371435     4.234047 0.5425802      5.654278 -2.598397      6.388400 17.85535 7.549224 16.80478 7.535429 1.050568       10.66646 
1 1 1 18  16 13 f 21.70398 7.352640 5.574155       4.629630 7.375063       6.153162 3.224514       7.028348 24.85367 8.475733 21.69961 8.711692 3.154058       12.15449 
1 1 1 18  16 14 o 65.30864 4.371893 52.90798       6.917794 61.53127       10.18063 45.51095       9.429025 69.91512 6.034407 59.86979 6.570676 10.04533       8.921203 
1 1 1 18  16 15 o 37.62672 5.943532 18.14583       5.269003 27.32922       7.626878 9.761122       7.287681 45.96608 7.032055 27.75350 9.223054 18.21258       11.59804 
1 1 1 18  16 16 o 43.11864 5.547969 23.66416       5.694609 21.55762       7.863205 25.98759       8.258084 40.12061 8.315966 44.30738 7.939983 -4.186771      11.49777 
1 1 1 18  16 17 o 12.40926 5.800607 -3.914768      4.352890 -5.676827      5.845543 -1.721541      6.521633 14.07987 6.625973 17.22963 7.677513 -3.149753      10.14139 
1 1 1 18  16 18 f 41.01722 5.682460 21.72196       5.527494 25.32299       7.895471 18.26052       7.740934 43.38181 7.753087 36.22530 8.846584 7.156517       11.76318 
1 1 1 18  16 19 o 58.29338 5.016253 43.30702       7.056585 38.04160       9.159818 50.99445       11.06778 53.37930 7.227195 61.69671 7.516378 -8.317413      10.42729 
1 1 1 18  16 20 o 18.76053 7.412808 3.253715       5.009920 4.037886       6.782568 2.312163       7.432089 21.14310 8.533505 20.45330 8.651693 0.6898060      12.15206 
1 1 1 18  16 21 o 34.42844 8.617238 17.36567       7.212029 0.000000       0.000000 17.36567       7.212029 ?        ?        34.42844 8.617238 0.000000       8.617238 
1 1 1 18  16 22 o 41.22702 6.846520 23.64932       6.637239 20.23599       8.754335 28.26388       10.17885 35.77311 9.768996 42.27469 10.03219 -6.501575      14.00279 
1 1 1 18  16 23 o 46.57227 5.771195 29.48905       6.409773 29.76239       8.599139 29.14729       9.615322 44.57514 8.219110 42.77027 9.475084 1.804871       12.54317 
1 1 1 18  16 24 o 22.80032 7.730679 7.871478       5.118015 8.879270       6.852365 6.599940       7.696970 23.81737 8.851459 22.08158 9.024414 1.735790       12.64074 
1 1 1 18  16 25 o 14.29058 6.504632 -0.9602512     4.973767 -8.045114      6.599901 8.352433       7.566747 13.15148 6.404693 22.80016 9.077540 -9.648685      11.10954 
1 1 1 18  16 26 o 54.46584 5.700190 42.26912       7.453795 49.92541       10.82829 35.37404       10.27591 55.10838 8.322272 43.96405 9.837679 11.14433       12.88566 
1 1 1 18  16 27 o 19.03560 7.574467 5.503404       5.265488 1.943712       7.602888 8.784605       7.299428 17.65995 8.039753 21.92932 8.852020 -4.269373      11.95809 
1 1 1 18  16 28 o 18.32487 8.317364 4.084353       8.061212 4.084353       8.061212 0.000000       0.000000 18.32487 8.317364 ?        ?        0.000000       8.317364 
1 1 1 18  16 29 o 22.92518 9.719539 14.38653       9.415865 14.38653       9.415865 0.000000       0.000000 22.92518 9.719539 ?        ?        0.000000       9.719539 
1 1 1 18  16 30 o 22.12104 8.301037 11.03891       6.055931 15.70106       8.908919 7.034153       8.256951 23.03304 9.589403 18.38714 8.373770 4.645908       12.73093 
1 1 1 18  16 31 o 16.98832 7.398468 5.505575       5.739865 20.48233       9.002878 -4.751513      7.450485 25.11400 9.932722 13.26050 6.528806 11.85350       11.88631 
1 1 1 18  17 0  o 47.84265 3.501648 28.12668       4.054204 32.53806       8.449506 26.80734       4.620863 50.89497 6.997767 46.62462 4.108977 4.270351       8.114951 
1 1 1 18  17 1  o 87.27990 3.759858 93.34179       7.978147 100.0266       12.25056 88.41851       10.51326 90.05534 5.610126 84.73767 5.115071 5.317665       7.591934 
1 1 1 18  17 2  o 101.3664 3.208703 125.6793       7.916117 122.1488       13.62544 127.4782       9.725945 99.53088 5.640767 101.9941 3.920398 -2.463188      6.869336 
1 1 1 18  17 3  o 96.27908 2.927011 113.3295       6.859424 123.7345       12.98889 109.3054       8.077679 100.2218 5.337561 94.48145 3.514483 5.740334       6.390708 
1 1 1 18  17 4  o 94.14651 2.549309 108.2898       5.843363 118.5477       8.510261 99.13992       8.037516 98.38554 3.555414 89.94457 3.674737 8.440971       5.113184 
1 1 1 18  17 5  o 162.9293 2.633388 324.1802       10.45563 332.4414       14.22763 314.4802       15.41685 164.8418 3.541842 160.2477 3.947916 4.594055       5.303837 
1 1 1 18  17 6  f 81.98929 2.377424 82.13745       4.745052 86.54639       6.363702 76.61670       7.121010 84.08013 3.111215 79.02170 3.708277 5.058434       4.840555 
1 1 1 18  17 7  o 176.5761 4.248554 382.4780       18.28139 416.5938       30.87636 364.0625       22.68510 183.1370 6.931042 171.8259 5.424510 11.31111       8.801400 
1 1 1 18  17 8  o 57.81939 4.579750 41.33124       6.400177 49.45468       9.277653 33.95514       8.840591 62.94699 6.125599 51.78413 7.200144 11.16286       9.453308 
1 1 1 18  17 9  o 47.20984 5.203460 27.80267       5.887155 31.46161       8.487361 24.40981       8.172928 49.76496 7.208275 43.50992 8.003023 6.255039       10.77068 
1 1 1 18  17 10 o 21.20744 7.460868 5.012883       4.784098 5.386024       6.580972 4.594684       6.966990 23.25534 8.668238 22.90069 8.829115 0.3546448      12.37302 
1 1 1 18  17 11 o 96.65845 3.953286 115.0067       9.292161 111.4053       13.75062 118.0335       12.60606 94.50568 6.001747 97.52460 5.324510 -3.018929      8.023177 
1 1 1 18  17 12 o 37.33179 6.275189 17.83359       5.506444 33.28927       8.062237 4.320109       7.538676 51.18840 6.617930 23.11957 9.106158 28.06883       11.25696 
1 1 1 18  17 13 o 96.94878 4.463588 116.3894       10.51709 122.4135       14.25800 109.1999       15.57608 98.82478 5.948006 92.85357 6.933787 5.971214       9.135435 
1 1 1 18  17 14 o 103.7452 4.539505 133.5968       11.44880 131.4594       15.31678 136.3030       17.23443 102.1134 6.184282 103.5840 6.866357 -1.470581      9.240790 
1 1 1 18  17 15 o 19.94327 7.228070 4.358215       4.523975 6.651688       6.342105 1.982271       6.455126 23.93924 8.573304 19.81582 8.198604 4.123423       11.86249 
1 1 1 18  17 16 o 34.18237 7.276303 15.55656       5.874938 21.78532       7.596444 6.286395       9.267303 40.29902 8.017521 25.59080 10.09116 14.70822       12.88845 
1 1 1 18  17 17 o 81.69798 4.660753 83.84118       9.240554 92.05549       12.64002 74.41148       13.54288 84.68475 6.167277 75.19459 7.490267 9.490166       9.702547 
1 1 1 18  17 18 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  17 19 o 22.55874 8.455011 5.991942       6.278656 0.000000       0.000000 5.991942       6.278656 ?        ?        22.55874 8.455011 0.000000       8.455011 
1 1 1 18  17 20 o 24.32120 7.390473 8.204211       4.766604 19.21021       7.090463 -0.8710814     6.438580 36.69084 8.142838 17.12933 7.630922 19.56151       11.15960 
1 1 1 18  17 21 o 31.32898 7.027697 13.83707       5.232887 20.10494       8.088722 9.325648       6.862405 36.37793 9.137730 25.45741 8.937305 10.92052       12.78177 
1 1 1 18  17 22 o 28.86072 7.552220 12.27104       5.371959 11.96043       6.580224 12.89172       9.301832 27.84690 8.722687 28.17728 10.34099 -0.3303833     13.52854 
1 1 1 18  17 23 o 18.03071 7.102088 3.709516       4.585775 3.902245       5.851949 3.402844       7.381824 19.15960 7.853965 19.87076 8.520355 -0.7111588     11.58798 
1 1 1 18  17 24 o 20.59783 7.432333 6.232661       4.776591 4.015769       6.048209 9.907211       7.786757 18.99800 7.904662 24.31032 9.344121 -5.312317      12.23913 
1 1 1 18  17 25 o 46.20619 6.283968 31.11080       6.892519 37.90365       9.620386 23.94671       9.879776 47.99036 8.539272 34.52997 10.66799 13.46039       13.66474 
1 1 1 18  17 26 o 38.71413 10.28486 29.75838       9.866492 29.75838       9.866492 0.000000       0.000000 38.71413 10.28486 ?        ?        0.000000       10.28486 
1 1 1 18  17 27 o 13.00301 6.396851 -8.520828      7.104873 -8.520828      7.104873 0.000000       0.000000 13.00301 6.396851 ?        ?        0.000000       6.396851 
1 1 1 18  17 28 o 14.23054 6.675603 -1.068143      5.851734 7.998614       8.774981 -8.329350      7.852801 20.06871 8.926392 13.43582 6.631755 6.632893       11.12028 
1 1 1 18  17 29 o 14.78687 7.069930 -1.153387      7.190320 0.000000       0.000000 -1.153387      7.190320 ?        ?        14.78687 7.069930 0.000000       7.069930 
1 1 1 18  17 30 o 11.48405 5.642651 -5.671226      5.473534 -7.707388      8.062582 -3.930565      7.454610 13.10330 6.511700 13.68578 6.695546 -0.5824842     9.339838 
1 1 1 18  17 31 o 15.78420 7.097317 3.870223       5.710571 6.771401       8.878922 1.823495       7.457668 17.43997 8.194365 15.31100 7.286952 2.128970       10.96573 
1 1 1 18  18 0  o 106.6595 2.960644 139.0628       7.687791 132.8655       14.92250 141.3019       8.969734 103.7470 5.927079 107.4563 3.429794 -3.709290      6.847901 
1 1 1 18  18 1  o 84.09557 3.894491 86.73376       7.959377 103.8816       12.34143 74.52208       10.41475 91.76098 5.545017 77.66675 5.539083 14.09423       7.837643 
1 1 1 18  18 2  o 170.4078 3.784978 355.3798       15.71770 361.5810       27.09694 352.2353       19.29552 171.0359 6.513153 169.3932 4.678868 1.642700       8.019536 
1 1 1 18  18 3  o 112.9686 3.341148 156.1958       9.187808 155.7607       16.01401 156.4093       11.21777 112.2885 5.872744 112.9214 4.083287 -0.6328964     7.152786 
1 1 1 18  18 4  o 212.8526 3.401142 554.2278       17.64168 574.2509       27.63343 540.4523       22.92050 216.0732 5.248048 209.8849 4.481328 6.188278       6.901037 
1 1 1 18  18 5  o 11.81776 4.438563 1.263727       1.732224 1.159560       1.970103 1.618628       3.636448 12.12841 4.689948 15.80917 6.293335 -3.680761      7.848673 
1 1 1 18  18 6  o 91.15567 3.025733 101.7175       6.711942 100.0433       12.94271 102.3334       7.850005 89.80643 5.947512 91.35470 3.532827 -1.548264      6.917641 
1 1 1 18  18 7  o 147.9509 4.044063 268.7466       14.56680 287.4975       23.83779 257.5718       18.40244 152.1524 6.443705 144.4695 5.235785 7.682816       8.302696 
1 1 1 18  18 8  o 107.2377 3.954324 141.3172       10.31601 158.8419       16.30534 129.6205       13.32101 113.1144 5.936063 102.3315 5.360543 10.78291       7.998267 
1 1 1 18  18 9  o 67.22287 4.861106 56.00013       7.909421 51.84999       10.12577 62.49535       12.66758 64.22385 6.561992 70.25258 7.516035 -6.028732      9.977501 
1 1 1 18  18 10 o 13.00704 6.002542 -3.397072      4.436584 -5.084388      5.996984 -1.357096      6.593975 14.81103 6.884800 17.86423 7.850954 -3.053203      10.44212 
1 1 1 18  18 11 o 26.51801 7.282543 9.139494       4.849331 8.885819       6.751582 9.409816       6.969592 26.80557 8.876317 27.46464 9.015044 -0.6590652     12.65148 
1 1 1 18  18 12 o 134.8605 4.663599 225.3492       15.30340 210.5604       20.27194 244.9436       23.33429 129.3758 6.450270 139.2519 6.897807 -9.876114      9.443819 
1 1 1 18  18 13 o 54.63597 5.281355 37.52412       6.944137 43.58324       9.237599 29.65133       10.52977 58.44112 6.601851 46.90291 9.537845 11.53820       11.59978 
1 1 1 18  18 14 o 95.82441 4.621774 114.3583       10.76065 104.6897       14.04875 128.0822       16.73769 90.78082 6.391341 100.1208 6.902418 -9.339951      9.407051 
1 1 1 18  18 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  18 16 o 29.58200 8.808550 11.98499       6.821803 0.000000       0.000000 11.98499       6.821803 ?        ?        29.58200 8.808550 0.000000       8.808550 
1 1 1 18  18 17 o 41.49695 5.688743 22.31804       5.601398 32.57465       8.507384 14.46905       7.442192 49.41906 7.282279 32.02846 9.105711 17.39060       11.65957 
1 1 1 18  18 18 o 52.55338 4.880609 35.28626       6.179017 43.42876       9.284645 28.81283       8.278540 57.17517 6.796650 45.93019 7.666429 11.24498       10.24542 
1 1 1 18  18 19 o 26.16648 7.038837 9.492338       4.585736 5.678330       6.302821 13.78214       6.684408 22.08668 8.427359 30.85939 8.579443 -8.772711      12.02611 
1 1 1 18  18 20 o 67.79041 4.818768 59.34430       7.908604 61.49460       10.67602 56.72932       11.77321 67.41599 6.582210 63.54351 7.764112 3.872478       10.17875 
1 1 1 18  18 21 o 24.50678 7.245028 8.654105       4.628312 9.477811       6.863455 7.967156       6.267861 25.29761 8.933219 23.68434 8.517989 1.613274       12.34336 
1 1 1 18  18 22 o 59.53006 5.209907 47.36537       7.481823 57.57294       10.59733 37.22086       10.56454 63.57692 6.953331 48.42108 9.291059 15.15585       11.60485 
1 1 1 18  18 23 o 21.31826 7.608667 6.719529       4.990837 5.021311       6.772501 8.737821       7.383194 20.34039 8.404985 23.54024 9.085484 -3.199848      12.37699 
1 1 1 18  18 24 o 17.79522 7.949040 1.492336       7.036102 1.492336       7.036102 0.000000       0.000000 17.79522 7.949040 ?        ?        0.000000       7.949040 
1 1 1 18  18 25 o 25.15653 9.722710 12.42447       8.463695 12.42447       8.463695 0.000000       0.000000 25.15653 9.722710 ?        ?        0.000000       9.722710 
1 1 1 18  18 26 o 15.10450 6.770631 0.7737232      5.152507 4.480503       7.215816 -3.082472      7.359809 18.81160 8.241656 15.18728 7.231153 3.624319       10.96424 
1 1 1 18  18 27 o 16.41458 7.220809 2.754094       5.590291 8.818031       8.540702 -1.791269      7.394357 20.90781 9.065777 15.31653 7.279995 5.591278       11.62698 
1 1 1 18  18 28 o 12.90058 6.131231 -2.252715      5.242911 2.317644       8.002254 -5.690131      6.939901 16.80926 7.859802 13.21437 6.463927 3.594892       10.17639 
1 1 1 18  18 29 o 15.47608 6.960108 2.638560       5.494866 6.515108       8.504861 -0.1390674     7.199157 18.20470 8.368397 15.00752 7.147321 3.197179       11.00519 
1 1 1 18  18 30 o 19.42011 7.982747 8.690157       6.066831 11.10153       9.208371 6.840639       8.064546 19.51947 8.871338 17.76222 8.159082 1.757250       12.05285 
1 1 1 18  19 0  o 153.2732 3.235209 287.2047       12.08383 281.3695       23.20235 289.3765       14.15503 150.8716 6.324886 153.7583 3.777776 -2.886688      7.367210 
1 1 1 18  19 1  o 28.92262 7.082118 10.76811       4.950965 20.26693       7.272644 2.563693       6.758983 39.73256 7.789762 21.07986 8.514845 18.65270       11.54049 
1 1 1 18  19 2  o 104.7872 3.007713 134.3196       7.672398 119.3422       13.52907 141.4200       9.315166 98.26153 5.674131 107.4389 3.562820 -9.177406      6.699960 
1 1 1 18  19 3  o 77.67143 2.621559 73.77455       4.954893 68.16925       7.254135 78.67686       6.784018 74.47377 4.011920 80.10454 3.483641 -5.630768      5.313309 
1 1 1 18  19 4  o 45.27160 3.148611 25.18760       3.451962 25.22165       4.816817 25.15164       4.949512 45.11291 4.438937 45.02626 4.574295 0.8664322E-01  6.374036 
1 1 1 18  19 5  o 90.56133 2.204818 100.1295       4.865772 101.4485       6.209906 98.03172       7.831238 91.05722 2.801893 89.38709 3.602551 1.670128       4.563877 
1 1 1 18  19 6  o 70.68349 3.073107 61.24509       5.280715 63.10069       10.46599 60.61135       6.116350 71.13048 6.096675 70.23958 3.585199 0.8908997      7.072702 
1 1 1 18  19 7  o 88.64404 4.459001 96.89999       9.601217 103.5478       13.09483 89.17133       14.11931 91.23361 5.921911 84.30868 6.933569 6.924934       9.118301 
1 1 1 18  19 8  f 90.60868 4.605168 101.4118       10.13503 113.8095       13.75350 86.67936       14.99273 95.58288 5.933953 82.80325 7.511797 12.77962       9.572821 
1 1 1 18  19 9  o 108.2602 4.455964 144.7023       11.73052 129.2948       15.23534 167.1353       18.38356 101.7063 6.176185 115.5008 6.558385 -13.79456      9.008755 
1 1 1 18  19 10 o 39.65751 6.341487 20.11740       5.922110 17.13756       7.527227 24.95843       9.594175 35.93857 8.691018 43.28217 9.368474 -7.343601      12.77897 
1 1 1 18  19 11 o 47.64715 9.213441 30.22676       10.31083 0.000000       0.000000 30.22676       10.31083 ?        ?        47.64715 9.213441 0.000000       9.213441 
1 1 1 18  19 12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  19 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  19 14 o 37.78696 6.139107 18.51225       5.459204 18.58055       7.665277 18.44195       7.776893 36.90675 8.670979 36.71813 8.805202 0.1886139      12.35789 
1 1 1 18  19 15 o 37.90685 5.949691 18.66065       5.315232 30.52487       8.280709 10.34722       6.931670 48.03607 7.303723 27.79550 8.981314 20.24056       11.57620 
1 1 1 18  19 16 o 96.88693 4.638062 118.1930       10.91880 121.1920       14.94598 114.7604       15.98985 96.74303 6.375230 93.50403 7.069810 3.238998       9.519757 
1 1 1 18  19 17 o 67.32924 4.886269 57.72098       7.962541 66.44629       10.98925 48.07684       11.55339 71.19846 6.402045 59.15157 8.238300 12.04690       10.43340 
1 1 1 18  19 18 o 19.72869 7.151187 4.668625       4.428427 7.454372       6.454267 2.190637       6.087312 23.94115 8.639413 18.91168 7.904142 5.029470       11.70961 
1 1 1 18  19 19 o 48.00684 5.115997 30.05356       5.892971 39.31462       9.033253 23.19219       7.775336 53.45354 7.110998 40.09726 8.233243 13.35628       10.87900 
1 1 1 18  19 20 o 45.33205 5.271494 27.19772       5.714886 40.13455       9.008448 18.48465       7.393015 53.59904 7.069118 34.91335 8.716780 18.68570       11.22295 
1 1 1 18  19 21 o 24.56936 7.451817 8.937312       4.849189 8.296855       7.345800 9.431959       6.455682 23.86490 9.099864 24.87093 8.672894 -1.006033      12.57086 
1 1 1 18  19 22 o 25.96154 9.247936 11.21292       7.369542 11.21292       7.369542 0.000000       0.000000 25.96154 9.247936 ?        ?        0.000000       9.247936 
1 1 1 18  19 23 o 30.48083 9.716653 16.93684       8.132813 16.93684       8.132813 0.000000       0.000000 30.48083 9.716653 ?        ?        0.000000       9.716653 
1 1 1 18  19 24 o 15.30591 6.793468 0.6699759      5.055324 -0.8706042     6.601291 2.854764       7.861248 15.94034 7.343885 18.86327 8.415793 -2.922934      11.16952 
1 1 1 18  19 25 o 23.04902 8.091568 9.287571       5.625051 9.944658       7.893573 8.609616       8.017932 22.92416 9.222264 21.93976 9.112656 0.9843979      12.96498 
1 1 1 18  19 26 o 13.20658 6.188529 -1.871684      5.005740 -2.100275      6.813274 -1.603564      7.378877 14.89204 7.051890 15.54545 7.354609 -0.6534138     10.18918 
1 1 1 18  19 27 o 16.09539 7.082553 2.837651       5.382057 1.790469       7.921068 3.735701       7.335385 16.79805 7.843157 17.48732 7.935976 -0.6892643     11.15773 
1 1 1 18  19 28 o 15.93194 7.220498 2.679714       6.047820 9.174529       9.181285 -2.298404      8.038086 19.71087 8.918456 14.89467 7.210187 4.816201       11.46846 
1 1 1 18  19 29 o 19.30448 7.913345 8.145323       5.940763 15.32663       9.284691 3.167256       7.730295 22.07533 9.511784 16.34277 7.668431 5.732563       12.21797 
1 1 1 18  20 0  o 164.7733 4.577934 333.5670       18.36417 0.000000       0.000000 333.5670       18.36417 ?        ?        164.7733 4.577934 0.000000       4.577934 
1 1 1 18  20 1  o 134.6056 4.496679 222.6884       14.72927 213.4776       19.20264 235.8533       22.95728 131.3413 6.015591 137.7523 6.860476 -6.411072      9.124333 
1 1 1 18  20 2  o 134.2934 2.977683 220.5122       9.744720 213.9167       13.69706 227.2722       13.86674 131.9608 4.264979 136.0415 4.187784 -4.080750      5.977255 
1 1 1 18  20 3  o 124.2291 2.914914 188.7075       8.824402 170.4930       12.00663 210.1042       13.01323 117.7874 4.189659 130.7975 4.087739 -13.01012      5.853448 
1 1 1 18  20 4  o 44.26738 3.500975 24.15410       3.745940 19.59250       5.695046 27.63255       4.973151 39.32619 6.143459 47.22519 4.370963 -7.898998      7.539722 
1 1 1 18  20 5  o 70.14465 2.399324 60.18521       4.095243 54.87507       5.032235 70.59828       7.046891 66.88616 3.095765 75.75983 3.829422 -8.873665      4.924250 
1 1 1 18  20 6  o 65.56225 7.825350 54.71311       12.25586 0.000000       0.000000 54.71311       12.25586 ?        ?        65.56225 7.825350 0.000000       7.825350 
1 1 1 18  20 7  o 39.28850 8.110600 20.15709       7.507778 0.000000       0.000000 20.15709       7.507778 ?        ?        39.28850 8.110600 0.000000       8.110600 
1 1 1 18  20 8  o 60.60874 6.350130 46.33994       9.239873 0.000000       0.000000 46.33994       9.239873 ?        ?        60.60874 6.350130 0.000000       6.350130 
1 1 1 18  20 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  20 10 o 13.14767 6.004553 -2.642843      4.284146 -3.400929      5.862981 -1.774347      6.275422 15.42024 7.035529 17.02660 7.562433 -1.606364      10.32904 
1 1 1 18  20 11 o 86.65725 4.421878 93.26572       9.306998 95.23856       12.58980 90.88840       13.82025 86.89682 5.981864 84.48029 6.769735 2.416527       9.033937 
1 1 1 18  20 12 f 79.40386 4.706473 78.73197       9.066104 86.73403       12.29394 69.19238       13.42317 82.66327 6.146982 72.97311 7.662595 9.690155       9.823480 
1 1 1 18  20 13 o 64.23555 4.537742 51.66036       7.057441 60.19595       10.38496 44.33547       9.620302 68.55192 6.286471 58.46710 6.883914 10.08482       9.322445 
1 1 1 18  20 14 o 36.05966 6.113048 16.98182       5.180069 18.52736       7.333962 15.44321       7.317515 36.76276 8.374162 33.37320 8.853225 3.389561       12.18631 
1 1 1 18  20 15 o 76.75076 4.668031 74.29924       8.689486 75.71792       11.53190 72.43556       13.21739 76.47752 6.241968 73.89580 7.441110 2.581718       9.712481 
1 1 1 18  20 16 o 48.50903 5.168396 30.24610       6.015648 38.19882       9.029144 23.89829       8.066786 53.41952 7.112604 41.42075 8.281477 11.99877       10.91659 
1 1 1 18  20 17 o 69.70713 4.781403 62.09015       8.072917 63.95093       10.97841 59.89930       11.91235 69.35246 6.574438 66.28693 7.506478 3.065521       9.978499 
1 1 1 18  20 18 o 28.23599 7.043007 11.19131       4.829741 7.788259       7.030939 14.23184       6.645886 24.20947 8.971889 31.10931 8.518289 -6.899839      12.37158 
1 1 1 18  20 19 o 27.09657 7.419232 10.61236       5.041690 13.39800       7.164357 7.879486       7.096184 29.52871 9.077636 23.96457 8.987230 5.564140       12.77395 
1 1 1 18  20 20 o 20.44749 8.041965 5.059814       5.872094 9.432216       6.979327 -5.535552      10.86454 24.95438 8.986699 18.82118 8.910257 6.133204       12.65517 
1 1 1 18  20 21 o 12.25682 5.694632 -2.466865      4.094845 0.2876312E-01  5.619993 -5.291142      5.978601 15.98299 7.124211 13.62994 6.497424 2.353050       9.642141 
1 1 1 18  20 22 o 30.21078 7.794302 14.40570       5.776184 10.45864       7.727221 19.40428       8.695808 24.78077 9.359924 32.57555 9.998446 -7.794788      13.69588 
1 1 1 18  20 23 o 14.30360 6.530705 -0.9767372     5.063410 0.2263088      7.084157 -2.233250      7.239867 17.02900 7.755663 15.98014 7.473389 1.048862       10.77042 
1 1 1 18  20 24 o 21.86705 8.180661 8.094951       5.872195 9.581759       8.175966 6.510798       8.439373 22.84168 9.313881 20.84009 9.024197 2.001598       12.96860 
1 1 1 18  20 25 o 17.35490 7.358970 3.743720       5.398925 0.1611648      7.445692 7.715799       7.840028 16.49674 7.669429 20.82162 8.849979 -4.324886      11.71078 
1 1 1 18  20 26 o 16.57685 7.246075 3.153194       5.549873 8.119509       8.224829 -0.9982724     7.519873 20.33664 8.856512 15.62037 7.400249 4.716266       11.54130 
1 1 1 18  20 27 o 20.74503 8.158490 8.919632       6.043178 9.836350       9.329913 8.257049       7.931950 20.32093 9.109727 19.69725 8.635002 0.6236801      12.55191 
1 1 1 18  20 28 o 15.47229 6.993674 2.561474       5.629290 10.81764       8.691546 -3.404419      7.388319 20.28150 8.959363 13.95833 6.792859 6.323163       11.24336 
1 1 1 18  20 29 o 14.11925 6.631731 0.3863349      5.806469 5.437385       9.005486 -3.207654      7.596346 17.27171 8.157365 13.88585 6.786050 3.385868       10.61099 
1 1 1 18  21 0  o 156.3284 3.257617 299.0915       12.41006 289.2645       23.95659 302.6957       14.50847 152.6263 6.455672 157.1452 3.788650 -4.518875      7.485290 
1 1 1 18  21 1  o 99.61868 3.740903 121.8236       9.065278 139.3486       14.13014 109.5648       11.81796 106.1120 5.483039 94.14233 5.171218 11.96969       7.536923 
1 1 1 18  21 2  o 105.0075 2.602636 134.7711       6.659933 138.2913       10.25607 132.2045       8.757574 106.0783 3.974542 103.8214 3.466333 2.256905       5.273751 
1 1 1 18  21 3  o 112.6083 2.647444 155.0349       7.264963 152.0273       10.82976 157.4958       9.796227 111.1971 4.003119 113.2895 3.552795 -2.092453      5.352319 
1 1 1 18  21 4  f 103.3652 2.611006 130.7273       6.571589 128.9385       9.581316 132.3163       9.030394 102.4059 3.846243 103.8036 3.575255 -1.397713      5.251289 
1 1 1 18  21 5  o 38.27866 3.881678 18.18345       3.570859 31.03333       7.602137 14.54571       4.044848 49.50631 6.455010 33.95879 5.040524 15.54752       8.189874 
1 1 1 18  21 6  o 43.57722 5.785489 23.99503       5.992130 25.41102       7.900570 22.07743       9.194054 44.33693 7.584792 40.71826 9.448608 3.618671       12.11632 
1 1 1 18  21 7  o 94.02912 4.461013 109.4017       10.19276 108.5724       13.68895 110.4337       15.26974 93.07049 6.068722 93.56556 6.742198 -0.4950714     9.071197 
1 1 1 18  21 8  o 43.04089 5.405561 23.39214       5.544939 28.27432       7.976116 18.82568       7.713912 46.79900 7.226358 37.60814 8.603982 9.190861       11.23605 
1 1 1 18  21 9  o 22.61773 7.381702 6.346674       4.675896 4.949285       6.281541 8.083230       7.002479 22.30278 8.435671 25.92560 9.033236 -3.622820      12.35961 
1 1 1 18  21 10 o 59.40044 4.486236 44.00405       6.445931 40.58845       9.305264 47.15514       8.937690 56.14019 6.950008 60.92490 6.102007 -4.784702      9.248628 
1 1 1 18  21 11 o 37.97110 6.018766 18.60419       5.383722 31.23166       7.886930 7.586465       7.367091 49.10534 6.770902 25.45127 9.223884 23.65408       11.44225 
1 1 1 18  21 12 o 38.96303 6.043093 19.66346       5.552105 21.07532       8.032973 18.37212       7.682475 39.29333 8.626160 36.59715 8.735750 2.696178       12.27697 
1 1 1 18  21 13 o 51.43415 4.890826 33.50183       6.056448 40.50042       8.954572 27.60093       8.222410 55.70822 6.732533 45.38752 7.709579 10.32071       10.23546 
1 1 1 18  21 14 o 82.34657 4.530929 85.37379       9.057157 89.62655       12.34944 80.42374       13.32345 83.28625 6.127580 78.14246 7.073226 5.143784       9.358300 
1 1 1 18  21 15 o 22.68068 7.148278 6.848578       4.412540 7.440120       6.352431 6.297043       6.133856 24.10952 8.586301 22.82512 8.393931 1.284395       12.00761 
1 1 1 18  21 16 o 17.82036 6.989557 2.999376       4.425321 6.898625       6.302682 -0.7920586     6.214938 23.31234 8.519164 16.96021 7.529818 6.352131       11.36989 
1 1 1 18  21 17 f 23.66873 8.173570 7.674559       5.727204 10.68493       6.624179 -1.238138      11.39795 27.09506 8.781886 21.64840 9.850990 5.446659       13.19710 
1 1 1 18  21 18 o 19.74314 7.881665 4.065650       5.719628 2.978200       6.615069 7.286565       11.38464 19.60692 8.220273 25.28792 10.70285 -5.680994      13.49533 
1 1 1 18  21 19 o 21.02685 7.346068 6.115983       4.632754 9.084154       6.850205 3.614143       6.289106 24.65115 8.899819 19.52949 8.087453 5.121656       12.02554 
1 1 1 18  21 20 o 26.83673 7.387537 10.87008       4.983473 12.56286       7.455814 9.503093       6.700008 27.47999 9.330558 24.59798 8.811578 2.882006       12.83368 
1 1 1 18  21 21 o 39.72510 6.237350 22.54887       5.839400 28.15798       9.348351 18.95999       7.477698 40.54649 9.609031 33.64957 8.960203 6.896923       13.13844 
1 1 1 18  21 22 o 13.34126 6.177175 -1.983421      4.755739 1.398779       7.457690 -4.301457      6.173974 18.02773 8.108007 14.00771 6.656263 4.020020       10.49026 
1 1 1 18  21 23 o 40.97763 7.037164 25.90637       6.774097 30.69062       9.233397 20.32962       9.968860 41.33421 9.382197 30.47221 10.76562 10.86200       14.28020 
1 1 1 18  21 24 o 33.21759 8.165303 19.21811       6.562150 25.20685       9.567235 13.89759       9.017691 34.04906 10.49414 25.07150 9.932978 8.977556       14.44960 
1 1 1 18  21 25 o 14.79642 6.730400 0.5247877      5.313944 1.536740       7.441208 -0.5283551     7.591139 16.82329 7.767283 15.99953 7.535980 0.8237638      10.82228 
1 1 1 18  21 26 o 27.52824 8.754778 15.91275       6.605511 25.14819       10.12244 9.063155       8.717432 29.93732 10.81723 20.29196 8.967944 9.645361       14.05121 
1 1 1 18  21 27 o 13.31820 6.328725 -1.711508      5.581785 -10.87578      8.098669 6.580893       7.703797 12.67308 6.333830 18.44040 8.271419 -5.767319      10.41795 
1 1 1 18  21 28 o 13.28565 6.537830 -5.314818      7.439507 0.000000       0.000000 -5.314818      7.439507 ?        ?        13.28565 6.537830 0.000000       6.537830 
1 1 1 18  22 0  o 21.57271 5.469502 5.974213       2.878860 -2.164733      6.288229 8.132474       3.238145 16.94273 7.544952 25.18202 5.436261 -8.239290      9.299421 
1 1 1 18  22 1  o 28.23708 7.106715 10.34798       4.885762 17.51973       6.609921 1.710685       7.253915 36.73480 7.633394 20.87944 8.669540 15.85535       11.55118 
1 1 1 18  22 2  o 116.2930 2.647843 165.4115       7.503808 167.9888       11.38949 163.4347       9.974671 116.8431 4.005973 115.3674 3.552197 1.475639       5.354057 
1 1 1 18  22 3  o 84.04407 2.539280 86.46351       5.194639 83.28058       7.593290 89.26360       7.121995 82.24493 3.798914 85.23301 3.435966 -2.988083      5.122266 
1 1 1 18  22 4  o 124.8473 2.668386 190.7606       8.118280 184.0883       11.91103 196.5494       11.09439 122.2434 4.003815 126.4473 3.604133 -4.203918      5.387050 
1 1 1 18  22 5  o 10.80459 4.392686 0.5781611      1.812214 1.165090       2.281385 -0.4254561     2.983252 12.72661 5.010407 12.30042 5.345591 0.4261942      7.326631 
1 1 1 18  22 6  o 136.9408 4.029464 231.3823       13.43209 255.3364       21.82995 216.7877       17.03955 142.5926 6.297851 131.9408 5.310447 10.65176       8.237947 
1 1 1 18  22 7  o 23.09018 7.654329 6.555226       5.020206 10.12710       6.307127 0.3799113      8.293032 27.87866 8.507248 20.98535 9.015146 6.893305       12.39541 
1 1 1 18  22 8  o 29.99452 7.217880 11.88634       5.211597 17.19440       7.222275 6.119629       7.527840 35.82306 8.416900 24.38961 9.232482 11.43345       12.49331 
1 1 1 18  22 9  o 48.87146 4.989758 30.08211       5.859228 34.37851       8.417766 26.04420       8.160617 51.57272 6.868545 44.39714 7.828794 7.175587       10.41475 
1 1 1 18  22 10 o 32.61249 6.282166 13.91041       4.811547 17.55746       6.643714 9.887491       6.977672 36.20159 7.763823 27.50948 9.019745 8.692116       11.90096 
1 1 1 18  22 11 o 52.10778 4.733618 34.22838       5.945267 36.88677       8.536030 31.72385       8.285329 53.24126 6.729223 49.13493 7.127456 4.106327       9.802197 
1 1 1 18  22 12 o 22.01341 6.926317 6.296168       4.144426 1.175982       5.510196 12.96580       6.288906 17.74790 7.475367 30.68697 8.237767 -12.93906      11.12393 
1 1 1 18  22 13 o 39.26626 5.677577 20.05288       5.275209 32.76277       8.106855 10.71907       6.947220 49.71872 6.874858 27.90172 8.989258 21.81699       11.31682 
1 1 1 18  22 14 o 27.10913 8.094133 10.22528       5.754045 12.60417       6.611826 2.799886       11.68138 29.80783 8.617279 24.37957 10.58659 5.428263       13.65040 
1 1 1 18  22 15 o 27.36051 8.204044 10.62893       5.901824 16.04619       6.697246 -8.199563      12.48574 33.48182 8.260070 20.32266 9.600370 13.15916       12.66475 
1 1 1 18  22 16 o 17.64393 6.872907 3.135428       4.254720 4.749755       6.586485 1.979392       5.573700 21.23188 8.463883 17.99292 7.544702 3.238960       11.33842 
1 1 1 18  22 17 o 39.64085 5.928506 21.24251       5.551341 41.34430       8.840449 8.155596       7.133058 54.76696 6.767837 24.24055 9.026651 30.52641       11.28202 
1 1 1 18  22 18 o 27.11028 7.369962 10.82096       4.995745 17.50489       7.471745 5.417118       6.718269 33.32214 8.993921 21.28776 8.527282 12.03438       12.39375 
1 1 1 18  22 19 o 29.79033 7.127950 13.14950       5.105234 21.98369       8.014338 7.116705       6.622833 36.94886 8.988088 22.34543 8.610059 14.60343       12.44664 
1 1 1 18  22 20 o 34.37990 6.611536 17.23536       5.338024 19.13758       8.094324 15.77135       7.101039 33.21580 9.513602 30.62492 8.952806 2.590874       13.06374 
1 1 1 18  22 21 o 48.06280 5.347166 31.96655       6.156900 50.38461       10.55355 22.46361       7.580637 56.89557 7.818258 36.83521 8.601808 20.06036       11.62395 
1 1 1 18  22 22 o 18.21293 7.487393 4.143153       5.338059 14.22697       8.085565 -3.647669      7.107053 27.00860 9.679340 15.10411 7.166931 11.90449       12.04386 
1 1 1 18  22 23 o 43.71164 6.793542 29.62123       7.001610 40.54533       10.50399 20.88667       9.392519 46.67542 9.556812 30.66405 10.47142 16.01137       14.17686 
1 1 1 18  22 24 o 21.21825 8.188270 8.317857       5.996433 15.10135       8.950619 2.793957       8.076987 25.27122 9.931854 17.85563 8.188435 7.415588       12.87215 
1 1 1 18  22 25 o 18.41727 7.759986 5.719579       5.941057 3.073785       8.878220 7.865078       7.994882 17.69754 8.276345 19.89454 8.696617 -2.197008      12.00538 
1 1 1 18  22 26 o 18.85961 8.502607 6.997517       8.257624 0.000000       0.000000 6.997517       8.257624 ?        ?        18.85961 8.502607 0.000000       8.502607 
1 1 1 18  22 27 o 15.29408 6.966125 2.272942       5.716805 -3.663736      8.655894 6.865967       7.613593 14.59054 7.154119 18.26995 8.206667 -3.679417      10.88719 
1 1 1 18  23 0  o 43.08005 3.497840 22.92382       3.640517 21.50588       7.477880 23.36428       4.167772 40.65424 7.832132 43.40826 3.984401 -2.754017      8.787363 
1 1 1 18  23 1  o 39.61122 4.109048 19.51948       3.908841 22.85028       4.673487 11.76454       7.131095 42.79823 4.550732 30.07417 9.018132 12.72406       10.10128 
1 1 1 18  23 2  o 49.60316 2.845970 30.23657       3.425698 30.75349       5.283781 29.86172       4.499510 49.73603 4.405012 49.13290 3.787207 0.6031303      5.809223 
1 1 1 18  23 3  o 125.0418 2.679007 191.4625       8.163287 201.5497       12.50393 183.9693       10.77689 127.8353 4.018830 122.2671 3.620984 5.568207       5.409484 
1 1 1 18  23 4  o 57.52822 2.632935 40.61591       3.681325 38.72408       5.302374 42.37642       5.115037 55.92470 3.915464 58.58448 3.600251 -2.659786      5.319085 
1 1 1 18  23 5  o 12.58920 4.501777 1.680696       1.747970 2.445172       2.186745 0.3277626      2.909073 14.66510 5.051151 12.91202 5.434646 1.753078       7.419536 
1 1 1 18  23 6  o 44.37638 5.161685 24.85052       5.477813 23.01586       7.443756 27.01763       8.090144 41.88205 7.572006 45.45915 7.568976 -3.577103      10.70629 
1 1 1 18  23 7  o 109.2542 5.325415 149.6625       14.13570 0.000000       0.000000 149.6625       14.13570 ?        ?        109.2542 5.325415 0.000000       5.325415 
1 1 1 18  23 8  o 26.46207 7.541832 9.290505       5.099095 10.26492       6.472990 7.696963       8.277811 27.83114 8.641128 26.08921 9.722281 1.741928       13.00738 
1 1 1 18  23 9  o 37.00573 7.742272 18.39256       6.757238 22.83882       7.730901 4.000836       13.90877 41.23509 7.982075 27.49969 11.74119 13.73540       14.19750 
1 1 1 18  23 10 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 18  23 11 o 16.74487 7.141739 0.6070303      5.136304 -1.191766      5.685381 8.593505       11.97971 16.22669 7.203144 28.30279 11.36983 -12.07610      13.45951 
1 1 1 18  23 12 o 46.22208 6.408554 28.15399       7.024532 36.66220       8.367019 7.835996       12.92980 52.68262 6.666300 28.02876 11.60062 24.65386       13.37960 
1 1 1 18  23 13 o 13.89328 6.119271 -0.6144291     4.026360 -3.676682      5.233379 3.827313       6.302869 13.89316 6.449037 20.56783 8.252411 -6.674680      10.47341 
1 1 1 18  23 14 o 63.91571 4.808414 52.40833       7.434462 50.27764       10.02360 55.01369       11.08403 61.06338 6.854260 63.50661 7.294423 -2.443230      10.00947 
1 1 1 18  23 15 o 45.30779 5.720800 27.24692       6.175798 34.30110       8.436985 19.10430       9.064539 49.83006 7.152778 34.90756 10.08926 14.92249       12.36751 
1 1 1 18  23 16 o 17.37390 6.958115 2.820878       4.472291 5.179276       6.332307 0.4736654      6.317271 21.13810 8.339613 17.51744 7.691962 3.620659       11.34528 
1 1 1 18  23 17 o 29.51875 7.383511 12.82031       5.297294 24.41556       8.421502 5.228732       6.814212 39.63338 8.933855 21.16973 8.550129 18.46365       12.36602 
1 1 1 18  23 18 o 17.90844 7.077797 3.615984       4.568306 12.52932       7.625298 -1.374288      5.705567 27.41545 9.432756 15.26285 6.954751 12.15260       11.71945 
1 1 1 18  23 19 o 22.27184 7.414412 7.501588       4.709248 2.748236       7.128181 11.18306       6.273207 18.95976 8.251081 26.14007 8.551240 -7.180307      11.88293 
1 1 1 18  23 20 f 45.93056 6.192970 30.30352       6.755194 41.18270       9.882753 20.76312       9.254716 50.86529 8.255772 32.90836 10.34972 17.95693       13.23912 
1 1 1 18  23 21 o 15.62124 6.698988 1.774805       4.564157 -0.2839325     7.337946 3.073852       5.828899 16.84353 7.753770 17.69656 7.579334 -0.8530331     10.84284 
1 1 1 18  23 22 o 42.96351 6.716726 28.38083       6.802132 27.43993       9.430546 29.40119       9.820642 36.96113 10.15779 38.08356 10.32489 -1.122433      14.48392 
1 1 1 18  23 23 o 16.64935 7.272512 2.798586       5.581660 0.4758649      8.052055 4.947124       7.744257 16.90095 7.896636 18.95488 8.410922 -2.053928      11.53692 
1 1 1 18  23 24 o 20.62596 8.934525 8.862450       8.278188 0.000000       0.000000 8.862450       8.278188 ?        ?        20.62596 8.934525 0.000000       8.934525 
1 1 1 18  23 25 f 21.58500 8.444336 10.06374       6.445211 14.58417       9.518069 6.235592       8.758984 22.88983 9.740917 18.68614 8.553514 4.203686       12.96334 
1 1 1 18  23 26 o 16.61085 7.443693 3.962981       6.222913 9.369407       9.363096 -0.3146934     8.328528 19.51024 8.897506 15.54776 7.479543 3.962481       11.62365 
1 1 1 18  24 0  o 13.94080 5.544442 1.309851       2.819948 1.384494       6.071923 1.289324       3.184176 19.00476 7.914831 14.56329 5.857815 4.441478       9.846754 
1 1 1 18  24 1  o 80.01536 2.583180 78.47942       5.030309 74.25513       7.527671 81.88776       6.761681 77.50488 3.999140 81.55710 3.409697 -4.052216      5.255393 
1 1 1 18  24 2  o 73.19570 2.766922 65.76323       4.926473 75.21441       7.194122 57.41761       6.760269 78.04014 3.794261 68.08289 4.093554 9.957253       5.581541 
1 1 1 18  24 3  o 57.34332 2.859137 40.43672       3.982739 40.59489       5.592021 40.27390       5.673757 57.19669 4.037961 56.94897 4.116131 0.2477188      5.766079 
1 1 1 18  24 4  o 46.91057 2.898230 27.11490       3.296961 27.16863       4.504642 27.05292       4.838447 46.72546 3.994405 46.54473 4.314909 0.1807213      5.879941 
1 1 1 18  24 5  o 50.34813 2.664304 31.18355       3.257275 33.51649       4.304699 28.05851       4.982169 52.04778 3.412770 47.36433 4.365580 4.683449       5.541235 
1 1 1 18  24 6  o 21.66666 7.743140 5.411763       5.170511 2.437694       5.729996 18.44892       11.99693 19.25290 7.817009 36.23136 11.82380 -16.97846      14.17420 
1 1 1 18  24 7  o 32.33915 7.715027 14.09688       5.994706 18.44311       6.677528 -3.953554      13.60828 37.11110 7.638495 23.82628 10.81127 13.28482       13.23746 
1 1 1 18  24 8  o 67.39596 4.783242 57.18441       7.804786 62.98477       10.34797 49.53097       11.88655 70.04664 6.123740 60.83088 8.229424 9.215755       10.25786 
1 1 1 18  24 9  o 24.37224 7.484479 7.896769       4.871894 7.944042       6.073225 7.811434       8.159729 24.79867 8.421106 25.71711 9.638719 -0.9184399     12.79922 
1 1 1 18  24 10 o 48.88221 5.113997 30.56249       6.001783 28.31265       8.481046 32.81952       8.494576 45.58839 7.921445 49.55560 7.248537 -3.967201      10.73734 
1 1 1 18  24 11 o 27.75098 7.055097 10.54326       4.780797 16.31688       7.150442 5.875803       6.429080 33.89030 8.634799 22.60265 8.537507 11.28765       12.14285 
1 1 1 18  24 12 o 32.24437 6.426083 14.05455       4.872027 26.71813       7.266527 3.712799       6.566677 44.43771 6.936783 20.63501 8.371912 23.80270       10.87234 
1 1 1 18  24 13 o 30.35215 6.809068 12.74391       4.912061 19.62498       7.167405 6.649627       6.745210 37.00520 8.167162 23.13035 8.743089 13.87485       11.96429 
1 1 1 18  24 14 o 50.73548 5.494986 33.96952       6.685509 44.46429       9.329669 22.89252       9.584973 56.96122 6.859144 38.08741 10.14563 18.87381       12.24670 
1 1 1 18  24 15 o 36.57262 6.410883 18.51015       5.505423 30.07680       8.591066 10.45020       7.171489 45.38855 8.062572 26.30420 9.143027 19.08435       12.19016 
1 1 1 18  24 16 f 56.67564 4.797967 42.21957       6.564382 56.93869       10.50819 32.79947       8.406487 63.53262 6.897832 47.53470 7.506021 15.99792       10.19414 
1 1 1 18  24 17 o 26.56002 7.506270 10.71443       5.072554 9.771123       7.621755 11.46449       6.796340 24.80939 9.311996 26.58534 8.908285 -1.775949      12.88685 
1 1 1 18  24 18 o 11.88870 5.593481 -3.176151      4.161336 -3.019373      6.064266 -3.315673      5.720780 14.67138 6.854269 14.09707 6.609000 0.5743017      9.521548 
1 1 1 18  24 19 o 18.68521 7.127850 4.729849       4.508216 11.24784       7.480227 1.011846       5.649539 25.31049 9.275873 16.34661 7.222110 8.963877       11.75588 
1 1 1 18  24 20 o 15.29843 6.729301 0.9644858      4.854301 2.901133       6.742717 -1.119332      6.994225 18.20712 7.972121 16.17025 7.488485 2.036869       10.93765 
1 1 1 18  24 21 o 54.19106 6.196562 43.62966       8.036091 62.10011       12.94335 32.04363       10.25121 58.64491 9.372292 39.82829 10.43778 18.81662       14.02808 
1 1 1 18  24 22 o 20.42591 8.376426 7.293936       6.659807 0.000000       0.000000 7.293936       6.659807 ?        ?        20.42591 8.376426 0.000000       8.376426 
1 1 1 18  24 23 o 35.93014 8.359210 23.84575       7.180887 30.50638       10.50962 18.01327       9.834576 34.81622 11.03944 25.91031 10.33791 8.905910       15.12421 
1 1 1 18  24 24 o 14.99405 6.840447 1.150994       5.540699 8.513115       8.204350 -5.022179      7.512716 20.00986 8.776745 13.93219 6.795599 6.077663       11.10006 
1 1 1 18  24 25 o 12.18958 5.920578 -4.363582      5.539470 -3.687305      8.479142 -4.867148      7.316750 14.69293 7.178118 13.58521 6.643582 1.107719       9.780725 
1 1 1 18  25 0  o 23.79581 5.466280 7.348524       3.102987 13.56314       6.017267 5.097209       3.621680 31.92798 7.801283 20.24753 6.487285 11.68046       10.14618 
1 1 1 18  25 1  o 31.98566 3.686615 12.77993       2.821046 12.82917       4.363715 12.74458       3.697635 31.48432 5.904409 31.63569 4.959208 -0.1513672     7.710758 
1 1 1 18  25 2  o 8.373900 3.928455 -2.058426      2.027000 -3.538972      2.978630 -0.7813916     2.766349 9.780272 4.640472 11.42339 5.050039 -1.643118      6.858344 
1 1 1 18  25 3  o 22.41231 4.320799 6.437354       2.274316 4.104767       3.420219 8.286340       3.045101 18.57117 6.319362 25.31637 5.112166 -6.745209      8.128258 
1 1 1 18  25 4  o 36.75936 3.699694 16.86933       3.269103 24.14890       7.069378 14.88921       3.687006 42.92601 6.999036 34.30333 4.520558 8.622677       8.331984 
1 1 1 18  25 5  o 33.29590 2.882209 13.73724       2.315573 12.37024       3.132375 15.38439       3.438408 31.27744 4.217005 34.96455 4.114111 -3.687109      5.891438 
1 1 1 18  25 6  o 36.17114 5.555601 16.89552       4.740651 16.64067       6.087310 17.28830       7.557204 35.21861 7.331501 35.32665 8.809076 -0.1080437     11.46084 
1 1 1 18  25 7  o 25.13037 7.065879 8.474286       4.506745 12.62252       6.048501 3.296969       6.757230 30.31116 8.052769 20.87967 8.484652 9.431490       11.69771 
1 1 1 18  25 8  o 27.34609 6.702537 10.08182       4.431252 9.518702       5.700694 10.94152       7.043709 26.44027 8.091726 28.18593 9.048711 -1.745661      12.13900 
1 1 1 18  25 9  o 19.49382 6.840937 4.605697       4.020360 9.976058       5.186342 -3.480377      6.363972 26.92326 7.583436 15.75897 7.242218 11.16428       10.48610 
1 1 1 18  25 10 o 13.08910 5.993473 -2.386259      4.305260 2.067062       5.502511 -9.415799      6.913253 18.22644 7.557848 13.91431 6.723742 4.312124       10.11582 
1 1 1 18  25 11 o 18.27023 6.870094 3.677891       4.152609 5.120843       5.628947 1.954833       6.151079 21.05422 7.980441 18.74732 7.897329 2.306898       11.22743 
1 1 1 18  25 12 o 15.85537 6.485647 1.760369       3.979866 4.555845       5.455911 -1.418814      5.818314 20.21556 7.808060 15.90190 7.155935 4.313657       10.59119 
1 1 1 18  25 13 f 59.35158 5.234616 46.21664       7.493487 52.96761       10.44306 39.05131       10.75877 61.84902 7.054817 51.25721 8.938168 10.59181       11.38689 
1 1 1 18  25 14 o 38.14167 6.111880 19.96731       5.489043 26.82596       8.678648 15.39437       7.086483 42.03567 8.756888 31.48891 8.862673 10.54676       12.45914 
1 1 1 18  25 15 o 23.61202 7.633147 8.257175       5.006491 19.74360       7.803231 0.2208041      6.526976 35.17422 9.051269 17.27133 7.689343 17.90289       11.87651 
1 1 1 18  25 16 o 31.54323 7.061125 14.70065       5.292176 24.82288       8.708817 8.774307       6.663682 38.86760 9.316054 23.82668 8.751186 15.04092       12.78171 
1 1 1 18  25 17 o 16.80009 7.013479 2.461120       4.784493 10.38474       7.595664 -2.750612      6.160203 24.93718 9.309101 14.90762 6.945910 10.02956       11.61486 
1 1 1 18  25 18 o 17.12478 7.266945 2.554787       5.271559 16.53636       7.785692 -9.280911      7.163351 30.27206 9.488917 13.41533 6.563275 16.85673       11.53760 
1 1 1 18  25 19 o 15.77980 7.404284 -2.379756      7.206955 0.000000       0.000000 -2.379756      7.206955 ?        ?        15.77980 7.404284 0.000000       7.404284 
1 1 1 18  25 20 o 16.78718 7.338328 2.357172       5.692617 0.000000       0.000000 2.357172       5.692617 ?        ?        16.78718 7.338328 0.000000       7.338328 
1 1 1 18  25 21 o 34.42605 7.098629 19.20318       5.757310 21.27251       9.165728 17.85465       7.399146 30.59622 10.34567 29.92904 9.229571 0.6671810      13.86426 
1 1 1 18  25 22 o 19.31862 7.608534 6.469309       5.262593 5.016603       8.446886 7.390910       6.727899 18.75052 8.511919 19.99555 8.329746 -1.245026      11.90955 
1 1 1 18  25 23 o 16.94841 7.425676 3.852087       5.858264 10.47304       8.841519 -1.329429      7.821592 21.13364 9.193336 15.43618 7.378578 5.697464       11.78817 
1 1 1 18  25 24 o 14.53689 6.730826 0.5411811      5.646629 -0.9004675     7.804550 2.124769       8.179735 15.27477 7.319947 16.58336 7.814578 -1.308596      10.70744 
1 1 1 18  26 0  o 62.88665 3.262531 48.85497       4.982666 49.44961       8.778606 48.57236       6.051992 62.34513 5.846331 62.49155 3.995043 -0.1464157     7.080957 
1 1 1 18  26 1  o 20.62518 5.045405 5.534561       2.514653 6.654305       3.774718 4.641101       3.371806 22.56097 6.507676 19.31244 6.265931 3.248524       9.033921 
1 1 1 18  26 2  o 31.76115 4.844383 12.89027       3.630984 12.90316       4.216140 12.85326       7.144112 31.51507 5.699600 30.64566 8.985744 0.8694057      10.64091 
1 1 1 18  26 3  o 10.28145 4.365168 0.9548242E-01  1.903755 0.5672197      2.902344 -0.2607574     2.522145 13.08207 5.461990 11.35416 4.924883 1.727905       7.354442 
1 1 1 18  26 4  o 28.86510 4.188887 10.58647       2.860534 20.09792       6.232481 8.048111       3.219687 38.96671 6.811269 24.76222 5.480709 14.20449       8.742514 
1 1 1 18  26 5  o 17.79280 4.267613 4.110245       1.826558 3.633034       2.483402 4.672640       2.695957 16.98100 5.364078 18.95766 5.509102 -1.976660      7.689184 
1 1 1 18  26 6  o 59.88559 4.407746 45.21063       6.387358 48.40198       9.214168 42.25838       8.862282 60.94853 6.294227 56.77958 6.523335 4.168953       9.064833 
1 1 1 18  26 7  o 43.58386 5.280962 24.51507       5.494588 25.42124       7.449883 23.43418       8.136475 43.34843 7.312352 40.93533 8.437104 2.413109       11.16491 
1 1 1 18  26 8  o 61.62242 4.933138 48.58645       7.346127 51.01466       9.469111 44.91571       11.64240 62.21796 6.333560 56.51882 8.734352 5.699142       10.78902 
1 1 1 18  26 9  o 18.54366 6.915458 3.862756       4.189642 1.851472       5.246141 7.404199       6.961348 17.65704 7.355527 24.08217 8.926883 -6.425131      11.56689 
1 1 1 18  26 10 o 29.86220 6.549351 12.26299       4.634562 16.96900       6.122775 5.949044       7.092055 34.74265 7.455093 22.67350 8.861514 12.06915       11.58036 
1 1 1 18  26 11 o 25.21570 7.612404 9.084261       5.068696 8.294717       6.450525 10.35862       8.195068 24.37219 8.655184 26.66390 9.718861 -2.291714      13.01416 
1 1 1 18  26 12 o 16.43235 6.586670 2.424092       4.011104 -2.074866      5.099806 9.721503       6.495045 14.31547 6.542971 25.60915 8.708472 -11.29368      10.89256 
1 1 1 18  26 13 o 39.84089 5.904837 21.70251       5.559604 31.28161       8.759203 15.23987       7.194609 45.92205 8.124412 31.06136 8.991840 14.86068       12.11855 
1 1 1 18  26 14 o 11.86730 5.615463 -3.864436      4.305351 -8.017356      5.997774 0.5501801      6.183862 12.66803 6.154731 17.05407 7.544303 -4.386034      9.736386 
1 1 1 18  26 15 f 15.36862 6.660751 0.8759760      4.605812 3.243909       6.092873 -2.281373      7.035561 18.70093 7.867795 16.23227 7.514890 2.468662       10.88006 
1 1 1 18  26 16 o 36.06807 10.23640 23.62968       9.413371 0.000000       0.000000 23.62968       9.413371 ?        ?        36.06807 10.23640 0.000000       10.23640 
1 1 1 18  26 17 o 19.55688 8.089171 4.794435       6.281514 0.000000       0.000000 4.794435       6.281514 ?        ?        19.55688 8.089171 0.000000       8.089171 
1 1 1 18  26 18 o 19.92213 7.365480 6.041563       4.733539 12.74109       7.365595 1.327812       6.178301 26.11461 9.251216 16.74256 7.465793 9.372044       11.88794 
1 1 1 18  26 19 o 17.99513 7.257343 4.433776       4.901449 9.387067       7.940559 1.384733       6.229970 22.48614 9.175075 16.54389 7.428097 5.942244       11.80503 
1 1 1 18  26 20 o 14.24324 6.461996 0.7303401E-01  4.859499 3.141433       7.691172 -1.965814      6.269445 18.04270 8.163282 14.55335 6.852888 3.489346       10.65839 
1 1 1 18  26 21 o 17.54967 7.253577 4.560465       5.045717 4.614850       7.349257 4.511971       6.939780 18.29693 8.151803 18.11276 8.003333 0.1841679      11.42389 
1 1 1 18  26 22 o 15.34689 6.730990 2.299458       4.824646 3.440027       7.984612 1.643545       6.055027 17.53205 8.077051 15.72150 7.164062 1.810555       10.79641 
1 1 1 18  26 23 o 17.65372 7.639681 5.182627       6.040891 1.669294       8.665929 8.503612       8.425368 16.66915 7.910839 19.67359 8.748935 -3.004435      11.79514 
1 1 1 18  27 0  o 29.97303 4.854836 11.54009       3.424829 9.102704       5.925126 12.76302       4.196970 26.14248 8.288984 31.27475 5.717508 -5.132269      10.06962 
1 1 1 18  27 1  o 48.83683 3.295896 29.61637       3.899473 29.95608       7.060628 29.46728       4.677557 48.02582 6.175773 48.50216 3.992838 -0.4763412     7.354110 
1 1 1 18  27 2  o 83.08785 3.138342 85.41342       6.342969 90.57371       8.099613 77.23009       10.19982 85.21004 3.911084 77.84194 5.410712 7.368095       6.676256 
1 1 1 18  27 3  o 50.54211 2.798151 31.58504       3.432911 28.99364       5.034881 33.83633       4.692879 47.91898 4.359341 52.03115 3.725839 -4.112171      5.734608 
1 1 1 18  27 4  o 63.56406 2.566615 49.83109       3.967478 54.21312       5.968688 46.36219       5.310527 65.86861 3.733760 60.95524 3.591028 4.913376       5.180391 
1 1 1 18  27 5  o 21.81718 3.606421 6.075862       1.850461 5.487498       2.529670 6.753060       2.713929 20.37970 5.105021 22.63538 5.048664 -2.255676      7.179850 
1 1 1 18  27 6  o 21.72343 7.264372 6.175022       4.519706 7.213869       6.003963 4.816409       6.866099 23.57520 8.352371 21.83852 8.662485 1.736685       12.03332 
1 1 1 18  27 7  o 77.11482 4.240715 75.29197       7.938490 95.49077       12.35591 61.09302       10.35953 85.33051 5.979878 67.88450 6.335456 17.44601       8.711885 
1 1 1 18  27 8  o 36.00252 6.208769 17.49013       5.250511 9.937014       7.130566 26.43554       7.759989 26.40447 9.120075 43.48697 7.599065 -17.08250      11.87104 
1 1 1 18  27 9  o 14.37254 6.302495 -0.2223154     4.228184 9.051125       6.036222 -9.155520      5.924455 25.15499 8.394765 12.41661 6.051558 12.73839       10.34860 
1 1 1 18  27 10 o 26.51447 7.244924 10.10620       4.813285 15.60123       6.940058 5.013240       6.681338 32.08895 8.670996 21.24124 8.505456 10.84771       12.14615 
1 1 1 18  27 11 o 21.55021 7.299767 6.483753       4.563278 8.577905       6.681974 4.653445       6.246875 24.26539 8.785863 20.45041 8.212093 3.814985       12.02622 
1 1 1 18  27 12 o 29.84126 7.580516 13.30538       5.522460 13.17813       7.415824 13.46381       8.274400 28.50451 9.295716 28.46914 9.824767 0.3537560E-01  13.52540 
1 1 1 18  27 13 o 43.63990 9.400075 30.90884       9.701046 0.000000       0.000000 30.90884       9.701046 ?        ?        43.63990 9.400075 0.000000       9.400075 
1 1 1 18  27 14 f 27.20206 8.768795 12.15520       6.610019 0.000000       0.000000 12.15520       6.610019 ?        ?        27.20206 8.768795 0.000000       8.768795 
1 1 1 18  27 15 o 30.48416 7.297206 14.23547       5.348700 14.00852       8.237830 14.40088       7.032719 27.78428 9.788984 28.98406 9.008266 -1.199781      13.30312 
1 1 1 18  27 16 o 14.76575 6.446859 0.8243940      4.381970 -9.171073      6.477293 9.259502       5.950279 12.59841 6.179649 23.63457 8.320174 -11.03617      10.36404 
1 1 1 18  27 17 o 23.52688 7.729863 9.187634       5.123579 11.71488       8.197218 7.567272       6.563695 24.71155 9.563646 21.50355 8.488496 3.207994       12.78741 
1 1 1 18  27 18 o 29.86684 7.731333 15.00906       5.670427 28.82336       9.431792 7.189653       7.096053 38.26580 10.00396 20.81179 8.601944 17.45401       13.19366 
1 1 1 18  27 19 o 13.65006 6.235459 -0.4154612     4.623503 -0.7777042     6.836301 -0.1100934     6.276721 15.55804 7.271454 15.43297 7.128328 0.1250648      10.18269 
1 1 1 18  27 20 o 16.41599 7.043344 3.198668       5.050164 7.767811       8.527373 0.7303924      6.267507 20.26907 8.917230 15.62255 7.182305 4.646524       11.45000 
1 1 1 18  27 21 o 12.72665 6.018597 -2.150073      4.932171 5.630960       8.018578 -6.885569      6.255492 18.64684 8.395121 12.32159 6.049763 6.325251       10.34783 
1 1 1 18  27 22 o 15.64499 7.234041 1.436153       6.489744 5.870398       8.320371 -5.452216      10.37029 18.42284 8.396150 15.44879 7.624520 2.974052       11.34146 
1 1 1 18  28 0  o 80.29525 2.658394 79.52822       5.194530 90.20210       7.997500 71.73917       6.831803 84.94636 3.873628 75.81805 3.708912 9.128304       5.362930 
1 1 1 18  28 1  o 69.40417 3.048081 59.71286       5.142659 58.66375       9.373102 60.16469       6.151177 67.33387 5.767839 69.41112 3.649400 -2.077248      6.825400 
1 1 1 18  28 2  o 32.70246 3.712021 13.50340       2.905923 15.01198       4.327625 12.26466       3.921514 33.87809 5.424956 30.53817 5.470482 3.339920       7.704306 
1 1 1 18  28 3  o 25.15487 4.365161 8.186689       2.578845 9.473479       3.727014 7.004716       3.571998 26.57104 5.908745 22.77753 6.248239 3.793514       8.599638 
1 1 1 18  28 4  o 44.91512 2.761167 25.03865       3.007579 32.37497       4.481964 19.02904       4.056507 50.76615 3.647220 38.57355 4.393687 12.19260       5.710228 
1 1 1 18  28 5  o 39.15155 2.682376 19.04412       2.543741 19.53890       3.688986 18.59561       3.512300 39.24346 3.909431 38.31309 3.812449 0.9303703      5.460624 
1 1 1 18  28 6  o 76.78331 4.714263 75.69377       8.778454 72.02413       11.05352 81.96136       14.44571 73.52249 6.227956 76.60170 7.849532 -3.079208      10.02011 
1 1 1 18  28 7  o 37.61607 5.912093 19.04779       5.240811 29.82972       8.302314 11.90546       6.757265 45.87708 7.698661 28.23190 8.838661 17.64518       11.72141 
1 1 1 18  28 8  o 13.72561 6.302425 -2.346931      4.805472 -0.8905342     6.440263 -4.176302      7.217964 16.82430 7.553339 16.06194 7.495333 0.7623672      10.64110 
1 1 1 18  28 9  o 14.52871 6.897002 -5.682822      6.596303 0.000000       0.000000 -5.682822      6.596303 ?        ?        14.52871 6.897002 0.000000       6.897002 
1 1 1 18  28 10 o 19.52392 8.527880 2.091273       7.674470 0.000000       0.000000 2.091273       7.674470 ?        ?        19.52392 8.527880 0.000000       8.527880 
1 1 1 18  28 11 o 15.09635 7.009598 -2.899160      6.189637 0.000000       0.000000 -2.899160      6.189637 ?        ?        15.09635 7.009598 0.000000       7.009598 
1 1 1 18  28 12 o 45.25499 5.987906 28.50433       6.441663 29.31715       8.935689 27.62488       9.294688 42.96523 8.829825 40.83664 9.516898 2.128597       12.98219 
1 1 1 18  28 13 o 20.82308 7.651684 6.277489       5.095403 4.794599       7.099991 7.852360       7.316877 20.32906 8.519184 22.77318 8.970747 -2.444120      12.37137 
1 1 1 18  28 14 o 15.57703 6.689443 1.454542       4.563136 10.42070       7.267890 -4.379678      5.862686 24.68590 9.126675 13.66813 6.492424 11.01777       11.20035 
1 1 1 18  28 15 o 10.71901 5.156855 -4.491496      3.960254 -3.610077      5.249348 -5.655896      6.033449 13.09370 6.197215 13.21488 6.359523 -0.1211796     8.879696 
1 1 1 18  28 16 o 10.84834 5.274911 -5.754602      4.429660 -2.275231      6.662549 -8.511093      5.930185 15.16704 7.117516 11.95948 5.875664 3.207560       9.229435 
1 1 1 18  28 17 o 14.30641 6.394310 0.4392323      4.559923 5.142515       6.961642 -3.094897      6.034654 19.23404 8.261275 13.96833 6.621022 5.265711       10.58710 
1 1 1 18  28 18 o 37.18533 6.845157 22.05454       5.974353 23.98113       9.587899 20.83171       7.638558 32.10358 10.57550 32.50875 9.219305 -0.4051704     14.02985 
1 1 1 18  28 19 o 14.00075 6.369238 0.1606023      4.760720 0.1723431      7.028617 0.1506498      6.471219 15.87168 7.403172 15.47261 7.178442 0.3990669      10.31198 
1 1 1 18  28 20 o 27.42659 9.427159 17.14632       7.615659 21.81234       9.746698 9.832214       12.20296 28.30146 10.54909 20.54872 9.639678 7.752735       14.29009 
1 1 1 18  28 21 o 15.27801 6.824860 2.071015       5.187189 6.783564       8.565923 -0.6577436     6.518217 18.96825 8.595230 14.72669 6.950713 4.241553       11.05398 
1 1 1 18  29 0  o 16.33054 5.608856 3.239465       2.695688 2.704900       3.847247 3.755028       3.778246 16.83339 6.541615 18.05603 6.596348 -1.222647      9.290024 
1 1 1 18  29 1  o 38.31372 3.637904 18.52025       3.355879 19.99276       4.670698 16.94891       4.824917 39.25213 4.996007 35.75769 5.730607 3.494446       7.602627 
1 1 1 18  29 2  o 51.11136 3.433765 32.77068       4.252035 38.56373       7.117997 29.55650       5.301986 54.33290 5.449483 47.98986 4.589552 6.343033       7.124666 
1 1 1 18  29 3  o 16.50839 6.225126 2.926445       3.414832 3.602968       3.790674 0.1337136E-01  7.865948 17.75423 6.586215 19.13662 8.484951 -1.382389      10.74117 
1 1 1 18  29 4  o 24.41340 4.372163 7.794933       2.505596 9.348617       3.734731 6.523254       3.378834 26.13370 5.992426 21.81414 6.112660 4.319557       8.560011 
1 1 1 18  29 5  o 19.87431 3.994537 5.170080       1.867439 7.406156       2.914046 3.611844       2.432594 23.43502 5.234879 16.65334 5.314711 6.781683       7.459900 
1 1 1 18  29 6  o 9.475741 3.604418 0.8298013      1.150740 0.4143984      1.498740 1.426402       1.796112 9.569663 3.954078 11.95531 4.513278 -2.385651      6.000368 
1 1 1 18  29 7  f 31.50751 6.728745 14.08872       5.009266 21.55211       7.720100 8.661531       6.583279 37.60415 8.610564 24.31156 8.731408 13.29260       12.26292 
1 1 1 18  29 8  o 25.57665 7.320886 9.643863       4.794612 18.64439       7.317207 2.871847       6.347028 34.61161 8.689327 18.95541 8.005527 15.65620       11.81494 
1 1 1 18  29 9  o 24.45172 7.281892 8.863658       4.661827 15.23214       6.589516 2.482389       6.596126 31.18504 8.458716 18.76261 8.049841 12.42242       11.67689 
1 1 1 18  29 10 o 53.61691 5.524230 39.11974       7.114691 44.47179       10.05314 33.74944       10.07027 54.59064 7.776599 45.62103 9.371924 8.969612       12.17820 
1 1 1 18  29 11 o 43.30542 5.851032 26.13601       6.016802 33.39960       9.527487 21.31742       7.760019 45.59120 8.895026 36.13255 8.877842 9.458656       12.56732 
1 1 1 18  29 12 o 24.06587 7.411273 8.983002       4.772921 17.95518       6.887540 0.6936929      6.620250 33.14646 8.490169 17.17322 7.688032 15.97324       11.45377 
1 1 1 18  29 13 o 21.84438 7.279727 7.403605       4.539476 7.761665       6.486507 7.059907       6.355087 22.09258 8.518785 21.44348 8.386226 0.6491032      11.95401 
1 1 1 18  29 14 o 20.74144 7.671909 6.737875       5.136634 12.06870       6.730428 -0.6987578     7.949386 25.88955 8.863524 17.11267 7.945120 8.776882       11.90324 
1 1 1 18  29 15 o 16.15395 6.770805 2.665943       4.486072 0.4583342      6.371047 4.836815       6.317814 16.19804 7.368555 19.01339 8.006203 -2.815344      10.88094 
1 1 1 18  29 16 f 26.76484 7.686141 12.33496       5.276651 7.970583       7.543987 16.51532       7.383233 21.14278 8.815077 28.81910 9.265408 -7.676315      12.78880 
1 1 1 18  29 17 o 30.75594 8.697429 17.95335       6.808070 25.06428       8.386982 4.215632       11.65735 35.36849 9.521343 19.59350 9.262081 15.77499       13.28315 
1 1 1 18  29 18 o 22.84865 8.765841 10.84215       6.843952 12.37907       8.425133 7.860406       11.73509 23.17990 9.453628 20.39723 9.531136 2.782679       13.42437 
1 1 1 18  29 19 o 13.07578 6.070771 -0.8977314     4.640821 -3.390458      6.717091 1.378844       6.419259 13.94818 6.711838 15.82752 7.273680 -1.879346      9.897232 
1 1 1 18  30 0  o 25.10145 4.830186 8.339662       2.847362 12.87137       4.188239 4.445108       3.882658 30.88630 5.776856 18.86321 6.713296 12.02309       8.856659 
1 1 1 18  30 1  o 41.77908 3.215477 21.93764       3.248544 21.37728       4.654437 22.46989       4.536118 40.49345 4.810697 41.67146 4.540274 -1.178005      6.614899 
1 1 1 18  30 2  o 40.01297 3.193239 20.14751       3.087823 24.85749       4.610478 16.31637       4.158150 43.89418 4.368171 35.18008 4.990142 8.714100       6.631926 
1 1 1 18  30 3  o 12.86944 4.962205 1.570302       2.200865 2.098404       3.110598 1.040912       3.114392 14.93447 5.859312 13.67494 5.679580 1.259522       8.160218 
1 1 1 18  30 4  o 15.20999 4.884178 2.992271       2.052068 3.841652       2.913394 2.155977       2.890862 17.21366 5.832692 14.68768 5.680739 2.525972       8.141934 
1 1 1 18  30 5  o 11.76755 4.738006 1.007623       2.085372 -0.9888869     6.369168 1.247352       2.207023 16.49319 7.448626 12.34462 4.906516 4.148569       8.919413 
1 1 1 18  30 6  o 13.88425 3.969864 2.533934       1.410601 1.750087       1.991684 3.322850       1.998113 12.77838 4.767547 15.80756 4.781098 -3.029175      6.751918 
1 1 1 18  30 7  o 21.71790 7.336493 6.800167       4.609185 -0.7685621     6.516075 14.37958       6.520672 16.62708 7.519186 30.22699 8.499385 -13.59990      11.34803 
1 1 1 18  30 8  o 38.38024 5.941010 20.50568       5.377166 36.67028       8.442857 9.474178       6.974680 50.27854 7.087190 24.54461 8.963021 25.73393       11.42646 
1 1 1 18  30 9  o 13.06503 6.000415 -1.792501      4.359220 1.790098       6.714887 -4.402216      5.731076 18.11263 7.942513 13.63724 6.460629 4.475395       10.23832 
1 1 1 18  30 10 o 17.54402 6.994136 3.543562       4.497861 10.28487       6.759212 -1.813952      6.025671 24.89303 8.857833 15.18837 7.004257 9.704666       11.29251 
1 1 1 18  30 11 o 32.48023 7.187047 16.16899       5.537860 21.15050       8.440693 12.40403       7.338005 34.22142 9.686641 26.40400 9.243909 7.817417       13.38958 
1 1 1 18  30 12 o 23.45484 7.692555 8.953724       5.075162 12.24467       7.518818 6.199384       6.878568 25.77032 9.321315 20.65592 8.496367 5.114403       12.61250 
1 1 1 18  30 13 o 14.23646 6.334245 0.3269371      4.422129 1.756847       6.667252 -0.7961780     5.908873 17.27943 7.726899 15.17086 6.974332 2.108566       10.40895 
1 1 1 18  30 14 o 14.11668 6.632173 -2.320368      5.813520 2.653254       6.846860 -15.16912      11.00489 17.65995 7.868112 14.94074 7.454194 2.719211       10.83846 
1 1 1 18  30 15 o 17.15713 7.800680 1.890420       7.128323 1.890420       7.128323 0.000000       0.000000 17.15713 7.800680 ?        ?        0.000000       7.800680 
1 1 1 18  30 16 o 19.45658 7.601864 6.366868       5.217775 25.40797       8.600572 -4.723113      6.563669 35.12747 9.718779 13.61127 6.570963 21.51620       11.73168 
1 1 1 18  30 17 o 13.10633 6.000545 -0.4083883     4.313468 -2.321282      5.869133 1.838437       6.360821 13.74742 6.520190 16.22691 7.374228 -2.479484      9.843379 
1 1 1 18  30 18 o 17.15895 7.243594 4.316067       5.192589 14.59576       8.421666 -1.988795      6.595470 24.30223 9.608297 14.40326 6.854326 9.898969       11.80259 
1 1 1 18  31 0  o 30.30627 4.254783 11.96403       3.055863 13.81809       4.508967 10.38898       4.155881 31.64341 6.068045 27.17971 6.383921 4.463699       8.807702 
1 1 1 18  31 1  o 12.14608 5.051003 0.7388158      2.467628 -1.645391      3.586085 2.883001       3.400790 12.04692 5.498703 16.22100 6.190070 -4.174078      8.279655 
1 1 1 18  31 2  o 29.27372 4.022639 11.12987       2.793824 10.94425       3.978653 11.31042       3.924041 28.03619 6.004398 28.61243 5.826070 -0.5762386     8.366354 
1 1 1 18  31 3  o 21.84666 4.651588 6.415073       2.400418 6.446036       3.414141 6.384805       3.375595 21.38861 6.194950 21.29986 6.157083 0.8875084E-01  8.734247 
1 1 1 18  31 4  f 41.13506 3.812308 21.76748       3.778044 23.21531       4.570513 18.64385       6.713287 42.04633 4.532183 35.05013 8.032167 6.996201       9.222603 
1 1 1 18  31 5  o 35.25032 3.069067 15.74317       2.610109 19.53521       3.792364 12.33021       3.597818 38.75683 4.076325 30.18100 5.071489 8.575829       6.506645 
1 1 1 18  31 6  o 40.54556 2.634430 20.62119       2.588858 18.31452       3.628044 23.01415       3.695278 37.48669 4.035010 42.32138 3.617696 -4.834694      5.419321 
1 1 1 18  31 7  o 10.30630 5.033514 -6.511976      4.160079 -6.824319      6.296029 -6.269943      5.542272 13.36512 6.448032 12.56762 6.059902 0.7975035      8.848702 
1 1 1 18  31 8  o 15.55909 6.550316 1.793469       4.227630 6.092122       5.934201 -2.636798      6.024361 20.75016 8.107059 14.74038 6.868293 6.009780       10.62534 
1 1 1 18  31 9  o 25.00095 7.700631 10.01522       5.152611 11.90371       7.460256 8.292618       7.125080 25.87855 9.294724 22.69629 8.878704 3.182257       12.85392 
1 1 1 18  31 10 o 21.00908 8.209106 6.787577       6.085073 14.44970       7.457772 -8.473867      10.52525 28.01436 9.330627 16.55924 8.069566 11.45512       12.33607 
1 1 1 18  31 11 o 35.29673 8.473916 21.22894       7.196353 36.31442       9.281373 -1.510312      11.39517 46.58638 8.488189 18.83687 8.976955 27.74951       12.35456 
1 1 1 18  31 12 o 16.79832 7.192139 2.799598       5.245243 4.961136       5.991258 -4.294794      10.85411 18.91841 7.869107 17.41596 8.418050 1.502445       11.52330 
1 1 1 18  31 13 o 12.34772 5.876733 -3.469456      4.850836 -3.065820      5.434439 -5.051759      10.75981 13.26964 6.287870 16.91407 8.223597 -3.644434      10.35205 
1 1 1 18  31 14 o 13.84136 6.190639 0.4262288      4.281769 2.099072       5.813768 -1.556729      6.329754 16.36777 7.273857 14.78179 6.936965 1.585986       10.05139 
1 1 1 18  31 15 o 12.58488 5.909202 -2.014727      4.603935 -6.535789      7.048876 1.348837       6.079942 13.42052 6.553960 15.91039 7.222189 -2.489868      9.752662 
1 1 1 18  31 16 o 23.81985 8.312232 11.21112       5.930512 10.60779       8.106978 11.90567       8.698224 21.93587 9.141314 22.57636 9.442988 -0.6404896     13.14282 
1 1 1 18  32 0  o 23.87773 6.013781 8.050148       3.496802 13.29665       7.083396 6.359566       4.020912 28.71531 9.057748 21.13658 6.841322 7.578722       11.35106 
1 1 1 18  32 1  o 12.24188 5.093459 0.8073879      2.511136 1.896933       3.650801 -0.1709549     3.459482 15.21433 6.216201 12.90911 5.679484 2.305223       8.420076 
1 1 1 18  32 2  o 21.27272 5.191406 6.251836       2.667110 7.669230       3.780891 4.847901       3.762899 23.02209 6.471476 18.88811 6.619034 4.133986       9.256976 
1 1 1 18  32 3  o 13.41470 5.081823 1.934463       2.281731 0.9937902      3.126185 3.006874       3.337922 13.44267 5.644422 16.10913 6.136154 -2.666454      8.337379 
1 1 1 18  32 4  o 20.82871 5.666668 6.144990       2.952085 5.615746       3.321395 8.135729       6.441689 19.83634 6.194699 23.02338 8.577147 -3.187044      10.58025 
1 1 1 18  32 5  o 32.49859 3.520021 13.64807       2.743247 14.93670       4.303991 12.76639       3.560090 32.69001 5.604425 30.61065 4.940766 2.079353       7.471329 
1 1 1 18  32 6  o 23.43466 3.581177 7.190624       1.980315 6.914710       2.723422 7.500187       2.884711 22.22709 5.131794 23.11027 5.243044 -0.8831768     7.336541 
1 1 1 18  32 7  o 15.23667 6.798788 0.2571797      5.132516 3.509976       6.046058 -8.133601      9.710579 18.39431 7.793087 16.15720 7.845636 2.237116       11.05831 
1 1 1 18  32 8  o 22.67902 8.414261 8.557541       6.187327 11.95142       7.573569 1.746453       10.72904 25.49121 9.334951 19.90175 9.236685 5.589466       13.13231 
1 1 1 18  32 9  o 21.97545 7.411830 7.797206       4.704323 15.06123       6.792285 1.100221       6.521791 28.91541 8.829319 16.82469 7.573265 12.09072       11.63233 
1 1 1 18  32 10 o 12.79836 5.922627 -1.587265      4.363159 1.315359       6.266154 -4.319071      6.078979 16.58139 7.446905 13.59229 6.499283 2.989099       9.884183 
1 1 1 18  32 11 o 23.26671 7.545905 9.202666       4.890336 7.476660       7.071361 10.78488       6.770410 20.92732 8.612001 23.82763 8.808887 -2.900316      12.31921 
1 1 1 18  32 12 o 20.55108 7.556859 7.135280       4.971264 12.26179       7.601272 3.303720       6.571481 24.39349 9.267359 17.67790 7.800630 6.715595       12.11337 
1 1 1 18  32 13 o 17.91152 7.236578 4.786323       4.883111 7.180264       7.465622 2.996367       6.455506 20.20423 8.613452 17.22590 7.659443 2.978329       11.52643 
1 1 1 18  32 14 o 15.52816 7.040872 1.167177       5.758997 -0.4800122     6.847826 5.147072       10.64429 15.48670 7.250922 19.40353 9.070261 -3.916830      11.61230 
1 1 1 18  33 0  o 11.33433 5.231451 -1.857896      3.371887 -2.695671      5.944170 -1.460409      4.094387 14.71831 6.846012 12.85941 5.871823 1.858894       9.019212 
1 1 1 18  33 1  o 43.58321 3.640451 24.51008       3.831149 35.90602       5.592824 14.43500       5.258723 52.11980 4.445847 30.98115 7.115551 21.13865       8.390268 
1 1 1 18  33 2  o 19.62972 5.472215 5.454929       2.715390 4.470792       3.826844 6.452864       3.853579 18.17736 6.638953 20.90783 6.691029 -2.730469      9.425793 
1 1 1 18  33 3  o 26.46611 4.929162 9.641064       3.062117 11.18900       4.861982 8.623393       3.942214 26.87913 7.255219 24.01065 6.554992 2.868477       9.777838 
1 1 1 18  33 4  o 35.70214 3.371557 16.44446       2.898588 18.87004       4.203828 14.24614       4.002056 37.31700 4.728789 31.94282 5.328931 5.374174       7.124532 
1 1 1 18  33 5  o 20.01778 4.364132 5.487056       2.068687 8.626958       3.003092 2.651678       2.853750 24.77004 5.143559 14.91212 5.675249 9.857925       7.659285 
1 1 1 18  33 6  o 28.23101 4.368499 10.80330       2.908379 0.000000       0.000000 10.80330       2.908379 ?        ?        28.23101 4.368499 0.000000       4.368499 
1 1 1 18  33 7  f 10.77963 5.172218 -4.094072      3.923654 -7.329320      5.432984 -0.5672398     5.672533 11.70887 5.725744 15.04673 6.886031 -3.337866      8.955533 
1 1 1 18  33 8  f 12.81373 5.929277 -1.581310      4.371702 -5.899370      6.613744 1.769334       5.825955 13.57875 6.565214 16.52117 7.314949 -2.942421      9.829065 
1 1 1 18  33 9  o 14.05697 6.426413 -0.5776762     4.923712 8.027776       7.633182 -6.709538      6.443398 21.38452 8.887467 13.03347 6.342965 8.351042       10.91880 
1 1 1 18  33 10 o 19.77759 7.621543 6.394976       5.189845 14.16962       8.468136 1.718103       6.567880 25.51023 9.759757 16.76950 7.569551 8.740728       12.35115 
1 1 1 18  33 11 o 27.42469 8.024110 13.54283       5.702111 21.44454       8.941848 8.127502       7.402506 30.91647 10.21425 20.96908 8.736507 9.947393       13.44089 
1 1 1 18  33 12 o 12.24762 5.860466 -3.657845      4.961624 14.00646       8.132314 -14.13203      6.262186 24.96215 9.560733 10.63818 5.351874 14.32397       10.95674 
1 1 1 18  34 0  o 45.25790 3.404702 26.38475       3.727466 34.47733       5.560505 19.78052       5.023214 50.73473 4.545637 37.41292 5.688590 13.32181       7.281680 
1 1 1 18  34 1  o 27.01542 4.974906 10.12788       3.154516 9.410977       4.817924 10.66582       4.173475 24.29677 7.439474 26.64714 6.488525 -2.350370      9.871511 
1 1 1 18  34 2  o 28.80450 4.449347 11.25171       3.022629 14.54928       4.442095 8.408384       4.124804 31.63215 5.981737 23.30143 6.826579 8.330725       9.076528 
1 1 1 18  34 3  o 11.11485 4.806908 0.2429596      2.388517 0.1737952      3.382429 0.3117528      3.373337 12.75542 5.613726 12.86500 5.635762 -0.1095781     7.954605 
1 1 1 18  34 4  o 34.96822 3.296178 15.84757       2.775661 21.64912       4.507188 12.30315       3.522953 39.71857 4.750795 29.61530 5.063313 10.10328       6.943140 
1 1 1 18  34 5  o 17.57845 5.465921 4.470613       2.588881 5.652231       3.268848 2.482305       4.240314 19.37655 6.158284 15.80570 6.600788 3.570850       9.027451 
1 1 1 18  34 6  o 7.738019 3.638249 -1.564919      1.755483 -0.3550109     2.401591 -2.953123      2.572465 10.43903 4.654832 8.767488 4.201798 1.671541       6.270771 
1 1 1 18  34 7  o 18.58104 5.012385 4.985550       2.321444 19.47647       8.310896 3.759251       2.417676 30.80693 9.822665 16.21657 5.308862 14.59036       11.16552 
1 1 1 18  34 8  o 15.00797 6.679014 1.016896       4.919438 0.5211563E-02  7.685709 1.719052       6.402921 16.65763 7.760334 16.65575 7.499993 0.1884460E-02  10.79225 
1 1 1 18  34 9  f 18.03671 7.247437 4.811634       4.868728 6.167267       7.318401 3.735259       6.521192 19.68246 8.462327 17.84567 7.826237 1.836782       11.52653 
1 1 1 18  35 0  o 34.78638 3.983013 16.08976       3.315615 24.34608       5.117837 10.11802       4.352549 41.79112 5.133038 25.41581 6.866483 16.37531       8.573020 
1 1 1 18  35 1  o 27.59325 5.790109 11.14929       3.769004 27.41711       9.441538 8.065494       4.110744 37.65487 10.08703 22.61630 6.861329 15.03857       12.19942 
1 1 1 18  35 2  o 26.57257 4.805422 9.855521       2.997213 12.00633       4.530107 8.181026       3.997143 27.74285 6.762987 22.80820 6.730344 4.934645       9.541254 
1 1 1 18  35 3  o 15.03125 5.524488 2.964787       2.656335 4.022294       4.023529 2.147734       3.536641 17.19561 6.687723 14.75810 6.083600 2.437510       9.040787 
1 1 1 18  35 4  o 24.10659 4.371464 8.015710       2.473482 9.086711       3.794669 7.224477       3.261601 24.21419 6.352766 21.81489 5.965128 2.399298       8.714378 
1 1 1 18  35 5  o 14.35872 5.013117 2.781095       2.157264 0.8747465      3.183446 4.399864       2.933519 12.94099 5.572755 17.28586 5.852834 -4.344874      8.081538 
1 1 1 18  35 6  o 12.63965 4.792489 1.872707       2.030384 -1.761189      2.827016 5.744098       2.917935 10.05564 4.691929 19.48670 5.750482 -9.431055      7.421741 
1 1 1 18  36 0  o 16.85287 5.831306 4.078631       2.915654 6.194157       4.670160 2.727389       3.732409 19.80037 7.316805 15.54233 6.309513 4.258038       9.661552 
1 1 1 18  36 1  o 9.174768 4.346503 -2.378678      2.593876 -2.749741      4.044885 -2.119504      3.380467 11.60867 5.477960 10.88887 5.097020 0.7197933      7.482490 
1 1 1 19  0  0  o 102.5937 3.755211 128.9115       9.359811 128.9115       9.359811 128.9115       9.359811 102.5937 3.755211 102.5937 3.755211 0.000000       0.000000 
1 1 1 19  0  1  o 117.3331 4.195415 168.6392       11.96103 168.6392       11.96103 168.6392       11.96103 117.3331 4.195415 117.3331 4.195415 0.000000       0.000000 
1 1 1 19  0  2  o 120.1219 3.390084 176.4122       9.905715 176.4122       9.905715 176.4122       9.905715 120.1219 3.390084 120.1219 3.390084 0.000000       0.000000 
1 1 1 19  0  3  o 98.51372 3.353582 118.7825       8.029680 118.7825       8.029680 118.7825       8.029680 98.51372 3.353582 98.51372 3.353582 0.000000       0.000000 
1 1 1 19  0  4  o 237.0498 5.639234 687.9298       32.53421 687.9298       32.53421 687.9298       32.53421 237.0498 5.639234 237.0498 5.639234 0.000000       0.000000 
1 1 1 19  0  5  o 99.92567 3.928463 122.4139       9.532472 122.4139       9.532472 122.4139       9.532472 99.92567 3.928463 99.92567 3.928463 0.000000       0.000000 
1 1 1 19  0  6  o 53.84617 4.411478 36.10390       5.696225 36.10390       5.696225 36.10390       5.696225 53.84617 4.411478 53.84617 4.411478 0.000000       0.000000 
1 1 1 19  0  7  o 156.9299 4.490219 301.4770       17.13974 301.4770       17.13974 301.4770       17.13974 156.9299 4.490219 156.9299 4.490219 0.000000       0.000000 
1 1 1 19  0  8  o 289.3899 6.597182 1027.238       46.46950 1027.238       46.46950 1027.238       46.46950 289.3899 6.597182 289.3899 6.597182 0.000000       0.000000 
1 1 1 19  0  9  o 31.08994 7.873653 13.88404       5.157815 13.88404       5.157815 13.88404       5.157815 31.08994 7.873653 31.08994 7.873653 0.000000       0.000000 
1 1 1 19  0  10 o 53.63709 5.109114 36.11841       6.530190 36.11841       6.530190 36.11841       6.530190 53.63709 5.109114 53.63709 5.109114 0.000000       0.000000 
1 1 1 19  0  11 o 243.3663 5.865875 726.5820       34.74234 726.5820       34.74234 726.5820       34.74234 243.3663 5.865875 243.3663 5.865875 0.000000       0.000000 
1 1 1 19  0  12 o 189.1926 5.073789 438.8537       23.35426 438.8537       23.35426 438.8537       23.35426 189.1926 5.073789 189.1926 5.073789 0.000000       0.000000 
1 1 1 19  0  13 o 124.0730 4.478162 188.9590       13.49976 188.9590       13.49976 188.9590       13.49976 124.0730 4.478162 124.0730 4.478162 0.000000       0.000000 
1 1 1 19  0  14 o 13.50270 8.287016 1.871411       5.251012 1.871411       5.251012 1.871411       5.251012 13.50270 8.287016 13.50270 8.287016 0.000000       0.000000 
1 1 1 19  0  15 o 17.59442 7.785531 5.487074       3.513662 5.487074       3.513662 5.487074       3.513662 17.59442 7.785531 17.59442 7.785531 0.000000       0.000000 
1 1 1 19  0  16 o 188.7308 4.145656 436.5400       19.04578 436.5400       19.04578 436.5400       19.04578 188.7308 4.145656 188.7308 4.145656 0.000000       0.000000 
1 1 1 19  0  17 o 11.91639 7.080220 1.938963       3.585373 1.938963       3.585373 1.938963       3.585373 11.91639 7.080220 11.91639 7.080220 0.000000       0.000000 
1 1 1 19  0  18 o 84.63787 3.639224 88.17190       7.474366 88.17190       7.474366 88.17190       7.474366 84.63787 3.639224 84.63787 3.639224 0.000000       0.000000 
1 1 1 19  0  19 o 48.49301 4.693443 29.70504       5.419137 29.70504       5.419137 29.70504       5.419137 48.49301 4.693443 48.49301 4.693443 0.000000       0.000000 
1 1 1 19  0  20 o 42.42887 5.169929 23.16595       5.133900 23.16595       5.133900 23.16595       5.133900 42.42887 5.169929 42.42887 5.169929 0.000000       0.000000 
1 1 1 19  0  21 o 32.70439 6.604526 14.78781       4.663268 14.78781       4.663268 14.78781       4.663268 32.70439 6.604526 32.70439 6.604526 0.000000       0.000000 
1 1 1 19  0  22 o 41.30140 5.044781 22.05701       4.875275 22.05701       4.875275 22.05701       4.875275 41.30140 5.044781 41.30140 5.044781 0.000000       0.000000 
1 1 1 19  0  23 o 24.92620 9.330950 10.70581       5.285287 10.70581       5.285287 10.70581       5.285287 24.92620 9.330950 24.92620 9.330950 0.000000       0.000000 
1 1 1 19  0  24 o 37.08796 7.235230 19.30731       5.826459 19.30731       5.826459 19.30731       5.826459 37.08796 7.235230 37.08796 7.235230 0.000000       0.000000 
1 1 1 19  0  25 o 35.72689 6.037864 17.45819       4.806003 17.45819       4.806003 17.45819       4.806003 35.72689 6.037864 35.72689 6.037864 0.000000       0.000000 
1 1 1 19  0  26 o 17.75022 8.196112 6.107464       3.902014 6.107464       3.902014 6.107464       3.902014 17.75022 8.196112 17.75022 8.196112 0.000000       0.000000 
1 1 1 19  0  27 o 11.90638 7.195527 2.231772       3.828131 2.231772       3.828131 2.231772       3.828131 11.90638 7.195527 11.90638 7.195527 0.000000       0.000000 
1 1 1 19  0  28 o 13.13699 7.578397 3.350237       3.909524 3.350237       3.909524 3.350237       3.909524 13.13699 7.578397 13.13699 7.578397 0.000000       0.000000 
1 1 1 19  0  29 o 12.69147 7.696175 2.894763       4.410690 2.894763       4.410690 2.894763       4.410690 12.69147 7.696175 12.69147 7.696175 0.000000       0.000000 
1 1 1 19  0  30 o 11.32258 7.292294 1.397760       4.638724 1.397760       4.638724 1.397760       4.638724 11.32258 7.292294 11.32258 7.292294 0.000000       0.000000 
1 1 1 19  0  31 o 6.092048 4.443583 -8.010613      3.924711 -8.010613      3.924711 -8.010613      3.924711 6.092048 4.443583 6.092048 4.443583 0.000000       0.000000 
1 1 1 19  0  32 o 10.91702 7.134128 1.384789       4.667013 1.384789       4.667013 1.384789       4.667013 10.91702 7.134128 10.91702 7.134128 0.000000       0.000000 
1 1 1 19  0  33 o 6.947763 5.004982 -5.754778      4.221536 -5.754778      4.221536 -5.754778      4.221536 6.947763 5.004982 6.947763 5.004982 0.000000       0.000000 
1 1 1 19  0  34 o 11.40862 7.658015 1.650777       5.998801 1.650777       5.998801 1.650777       5.998801 11.40862 7.658015 11.40862 7.658015 0.000000       0.000000 
1 1 1 19  1  0  o 208.7648 3.280670 531.9860       16.68999 531.5106       21.57227 532.6949       26.34238 208.5456 4.244816 208.6246 5.181476 -0.7905579E-01 6.698220 
1 1 1 19  1  1  o 187.3286 3.067333 428.2709       14.00235 460.6362       22.48654 407.7730       17.89526 194.0575 4.755060 182.6844 4.019763 11.37305       6.226483 
1 1 1 19  1  2  o 42.97271 2.985540 22.64448       3.107011 20.22975       4.443252 24.95499       4.346306 40.41357 4.593059 45.01537 4.003812 -4.601799      6.093168 
1 1 1 19  1  3  o 164.1020 2.891894 328.6294       11.56464 321.4494       17.64685 334.0342       15.31060 162.0640 4.472599 165.3530 3.799652 -3.289032      5.868687 
1 1 1 19  1  4  o 103.7909 2.749197 131.5408       6.947341 136.8930       9.760279 126.0443       9.891076 105.7814 3.792452 101.4733 4.007844 4.308159       5.517745 
1 1 1 19  1  5  o 182.7183 3.370538 407.7203       15.00781 392.1402       20.65379 425.1489       21.84476 178.9317 4.740881 186.3002 4.815729 -7.368500      6.757751 
1 1 1 19  1  6  o 83.91208 2.786226 86.02812       5.689503 89.31288       7.939681 82.56104       8.157066 85.39952 3.824855 82.07064 4.091492 3.328880       5.600877 
1 1 1 19  1  7  o 173.3463 3.316459 367.0323       14.00958 366.1067       19.65267 367.9888       19.97638 172.8567 4.669788 173.2872 4.735017 -0.4304962     6.650362 
1 1 1 19  1  8  o 255.4996 4.232492 798.7835       26.35254 775.0535       36.49473 824.6373       38.09287 251.1528 5.962879 259.0358 6.034590 -7.882980      8.483643 
1 1 1 19  1  9  o 106.2325 2.932248 137.9110       7.583652 143.1621       10.62017 132.4477       10.83280 108.0966 4.038759 103.9303 4.286427 4.166306       5.889400 
1 1 1 19  1  10 o 49.93425 3.525641 30.63500       4.262571 30.15894       5.758490 31.21202       6.339708 49.35915 4.850020 50.15272 5.265708 -0.7935715     7.158937 
1 1 1 19  1  11 o 166.8470 3.346586 340.3193       13.60682 347.9939       19.23686 332.6349       19.24904 168.3842 4.692677 164.5946 4.804213 3.789520       6.715778 
1 1 1 19  1  12 o 121.8608 3.076901 181.6018       9.129903 187.2431       12.81522 175.7875       13.01025 123.5346 4.263367 119.6499 4.469937 3.884682       6.177106 
1 1 1 19  1  13 f 83.74627 3.170497 85.87985       6.458683 94.23977       9.164277 77.62967       9.103935 87.55505 4.308406 79.36957 4.728376 8.185486       6.396867 
1 1 1 19  1  14 o 74.73067 2.818219 68.35809       5.123076 69.02968       6.245795 66.97715       8.956214 75.01608 3.425666 73.60529 5.023311 1.410782       6.080201 
1 1 1 19  1  15 o 71.40798 2.860752 62.45722       4.968017 61.80944       6.020029 63.84032       8.796524 70.94480 3.492843 71.80032 5.059862 -0.8555145     6.148345 
1 1 1 19  1  16 o 119.2580 2.497355 173.8500       7.257782 176.9523       10.26279 170.7462       10.26532 120.0794 3.510973 117.9374 3.575911 2.142059       5.011394 
1 1 1 19  1  17 o 55.42092 2.759204 37.68709       3.714716 35.07119       5.223438 40.36389       5.283888 53.23819 4.056764 57.18354 3.813605 -3.945351      5.567847 
1 1 1 19  1  18 o 107.6300 2.570598 141.8085       6.742229 136.4269       9.277965 147.8305       9.814549 105.2659 3.622232 109.5635 3.681166 -4.297592      5.164451 
1 1 1 19  1  19 o 132.8654 2.649568 216.3806       8.578732 215.5780       12.12092 217.1863       12.14343 132.1666 3.767220 132.6623 3.760071 -0.4956818     5.322601 
1 1 1 19  1  20 o 82.39275 2.874954 83.50517       5.763548 83.32915       7.508626 83.75760       8.992324 82.02892 3.766326 81.95091 4.520303 0.7800293E-01  5.883736 
1 1 1 19  1  21 o 21.75274 5.744936 6.211100       3.090014 7.211088       4.174865 4.999617       4.595191 23.39750 6.871471 20.63513 7.307410 2.762373       10.03072 
1 1 1 19  1  22 o 55.28842 3.348052 37.99490       4.489751 34.64392       5.748747 43.23521       7.188945 52.34613 4.551849 58.25184 5.116219 -5.905708      6.847994 
1 1 1 19  1  23 o 40.67556 3.621214 20.78509       3.551930 22.53777       5.000086 18.99963       5.046611 41.81943 5.005731 38.09171 5.604015 3.727726       7.514142 
1 1 1 19  1  24 o 46.36427 3.281758 26.93126       3.683922 26.63404       5.260076 27.21739       5.161042 45.39705 4.828760 45.97891 4.670960 -0.5818596     6.718243 
1 1 1 19  1  25 o 65.46766 2.946649 53.54190       4.688963 63.99982       7.325030 46.28159       6.103295 70.64902 4.274683 60.10084 4.193542 10.54818       5.988214 
1 1 1 19  1  26 o 35.36884 4.275104 16.34083       3.610035 14.54051       5.816597 17.46881       4.604093 31.11637 7.710462 35.88244 5.435341 -4.766069      9.433671 
1 1 1 19  1  27 o 9.309157 4.434457 -3.029365      2.774384 -7.566696      4.372845 0.2762190E-01  3.589307 10.24516 5.035832 13.16281 5.788300 -2.917653      7.672289 
1 1 1 19  1  28 o 13.99368 5.508021 2.072149       2.756504 1.818621       3.885044 2.329164       3.911664 14.99913 6.294776 15.53514 6.400370 -0.5360136     8.977134 
1 1 1 19  1  29 o 9.698220 4.551998 -2.054884      2.727357 -3.097281      3.832496 -0.9853219     3.882113 11.10061 5.266006 12.48788 5.708030 -1.387269      7.766108 
1 1 1 19  1  30 o 11.05293 5.058105 -0.9272318     3.060274 -0.9487982     4.334499 -0.9057967     4.321293 12.91781 5.951195 12.92824 5.950969 -0.1042271E-01 8.416101 
1 1 1 19  1  31 o 12.83892 5.538319 1.176852       3.154713 5.547400       4.585353 -2.751230      4.347054 18.09526 7.109583 11.66388 5.554636 6.431379       9.022203 
1 1 1 19  1  32 o 13.31432 5.852496 1.430695       3.665870 -2.395010      5.908360 3.825284       4.674410 13.16432 6.324378 15.93977 6.806135 -2.775452      9.290921 
1 1 1 19  1  33 o 14.95188 5.909825 3.551270       3.185247 1.245231       4.308331 6.331316       4.730441 13.43041 6.089764 17.76937 7.142467 -4.338963      9.386164 
1 1 1 19  1  34 o 11.88434 5.352513 0.7105012      3.262995 4.441175       4.741787 -2.645045      4.497074 15.66101 6.772938 11.24370 5.430711 4.417307       8.681319 
1 1 1 19  2  0  o 175.4112 2.720590 375.3706       11.62938 354.1742       15.97744 399.2523       16.95930 170.2806 3.850399 180.7927 3.849381 -10.51205      5.444567 
1 1 1 19  2  1  o 168.2717 2.919888 345.5186       11.97329 344.3063       15.46153 347.3347       18.92394 167.8925 3.779073 168.4645 4.613985 -0.5720825     5.964079 
1 1 1 19  2  2  o 154.6974 2.832290 292.0105       10.67719 303.6144       13.98884 275.8157       16.52596 157.6671 3.640864 150.1117 4.522842 7.555405       5.806203 
1 1 1 19  2  3  o 209.1107 3.318960 533.8875       16.91275 523.7230       21.62632 549.8927       27.13760 206.9686 4.287874 211.8948 5.255513 -4.926147      6.782793 
1 1 1 19  2  4  o 105.0216 2.562131 134.5599       6.557162 148.6637       9.991780 123.8910       8.690293 110.2480 3.724433 100.6514 3.548614 9.596611       5.144323 
1 1 1 19  2  5  o 141.4426 2.990916 244.2034       10.30910 252.1067       14.42160 235.9449       14.74222 143.5373 4.127277 138.8213 4.363252 4.716064       6.006029 
1 1 1 19  2  6  o 31.22581 4.168111 12.13324       3.092536 9.968698       4.005774 15.32667       4.865549 27.96410 6.054057 34.86156 5.940050 -6.897461      8.481498 
1 1 1 19  2  7  o 107.2303 2.840478 140.4540       7.415877 141.8288       10.19223 138.9074       10.81030 107.6360 3.892165 106.4826 4.174123 1.153419       5.707211 
1 1 1 19  2  8  o 90.39467 2.877709 99.85909       6.330996 93.51482       8.465587 107.9101       9.536545 87.35087 3.987500 93.82040 4.181675 -6.469536      5.778111 
1 1 1 19  2  9  f 63.80806 3.742676 49.95610       5.794057 63.04837       10.24183 43.79376       7.026557 71.37115 5.942558 59.57390 4.882866 11.79725       7.691318 
1 1 1 19  2  10 o 171.6276 3.943127 360.4528       16.49164 326.0853       27.12706 380.6015       20.77079 162.3934 6.870378 176.1015 4.844697 -13.70811      8.406734 
1 1 1 19  2  11 o 51.07902 4.367422 32.20032       5.384193 30.22769       8.856367 33.35686       6.781284 48.81691 7.699620 51.81483 5.452197 -2.997913      9.434544 
1 1 1 19  2  12 o 51.86935 4.309101 33.20013       5.397560 31.28626       8.558943 34.46386       6.954898 49.75462 7.274064 52.64994 5.501835 -2.895321      9.120427 
1 1 1 19  2  13 o 51.56829 3.490885 32.68994       4.361011 29.85430       5.496710 37.50704       7.164240 49.09573 4.649750 54.93614 5.422125 -5.840405      7.142801 
1 1 1 19  2  14 o 29.17798 6.760359 10.97593       4.712555 17.36563       7.247185 6.294727       6.203083 36.55001 8.323580 23.91321 8.488018 12.63680       11.88816 
1 1 1 19  2  15 o 104.6398 2.770589 133.9716       7.058666 138.7739       8.706223 124.7595       12.05832 106.3960 3.362126 100.5165 4.937925 5.879456       5.973859 
1 1 1 19  2  16 o 131.4068 3.173480 211.5026       10.16224 215.3609       11.42219 196.8511       22.25836 132.4688 3.541516 125.1691 7.329332 7.299698       8.140114 
1 1 1 19  2  17 f 14.45419 6.007657 0.6832803      3.488242 0.9189883      3.700457 -1.196732      10.45078 15.07792 6.219915 22.68872 9.929948 -7.610796      11.71713 
1 1 1 19  2  18 o 117.5930 3.242170 169.8856       9.281939 177.4799       10.51117 142.9936       19.77954 120.0815 3.596073 105.8442 7.721663 14.23721       8.517971 
1 1 1 19  2  19 o 15.02191 5.974977 1.573461       3.275197 1.133337       3.761354 2.953570       6.660598 15.32966 6.291733 20.88543 8.446781 -5.555773      10.53252 
1 1 1 19  2  20 o 11.90149 5.067029 0.9009345E-01  2.577477 -0.7754585     3.834328 0.8036342      3.481385 13.62082 5.986399 14.45994 6.005193 -0.8391190     8.479346 
1 1 1 19  2  21 o 23.08720 5.513768 6.994314       3.059295 8.599130       4.172991 5.129544       4.498291 25.41479 6.659105 20.71503 7.238569 4.699759       9.835678 
1 1 1 19  2  22 o 22.35965 5.362788 6.593138       2.884407 6.033692       4.024534 7.184028       4.136089 21.53084 6.831971 23.21198 6.845493 -1.681135      9.671432 
1 1 1 19  2  23 o 29.87465 4.470573 11.48765       3.154734 10.21697       4.436456 12.78739       4.486907 27.35297 6.707827 30.88000 6.178456 -3.527033      9.119664 
1 1 1 19  2  24 o 50.39648 3.159973 31.74364       3.861253 33.78161       5.540506 29.81909       5.384125 51.36464 4.470884 48.14423 4.646854 3.220409       6.448415 
1 1 1 19  2  25 o 39.66221 3.675762 20.01985       3.512298 29.43222       5.290175 12.60034       4.696866 47.60396 4.618229 29.96231 6.610356 17.64164       8.063799 
1 1 1 19  2  26 o 11.48841 5.029793 -0.1766156     2.683447 -0.6726818     3.910617 0.2648205      3.689006 13.27037 5.927086 13.69472 5.948013 -0.4243546     8.396976 
1 1 1 19  2  27 o 12.05793 5.170970 0.4106795      2.719547 1.184319       3.955700 -0.2827342     3.744985 14.70647 6.269747 13.13848 5.838402 1.567990       8.567185 
1 1 1 19  2  28 o 29.54102 4.678959 11.94540       3.256199 10.68301       4.414279 13.45219       4.822702 26.31484 6.826291 29.65642 6.816235 -3.341572      9.646725 
1 1 1 19  2  29 o 13.97788 5.734043 1.858689       3.122102 2.412519       4.812271 1.456131       4.102757 16.14132 6.899343 14.66809 6.321554 1.473230       9.357509 
1 1 1 19  2  30 o 13.19729 5.768549 0.8347549      3.516975 6.867162       6.060610 -2.228043      4.318472 19.90009 8.054082 12.12904 5.703921 7.771046       9.869293 
1 1 1 19  2  31 o 17.09867 6.249627 4.664941       3.392109 1.830292       5.031234 7.027281       4.592995 15.07664 6.729110 19.70929 7.260864 -4.632648      9.899549 
1 1 1 19  2  32 o 11.07362 5.067436 -0.4345521     3.071305 5.129862       4.470314 -5.409403      4.226865 17.09101 6.917155 10.11930 4.969374 6.971710       8.517142 
1 1 1 19  2  33 o 13.74493 5.804497 2.445873       3.336284 -1.748453      4.684706 6.762400       4.752460 12.04138 5.743314 18.16542 7.206434 -6.124045      9.215116 
1 1 1 19  3  0  o 161.5464 2.613312 318.3501       10.28785 325.1433       14.61975 311.6864       14.47970 163.1683 3.676785 159.7518 3.719442 3.416519       5.230009 
1 1 1 19  3  1  o 68.82705 2.385358 57.84661       3.994771 56.84413       5.447238 59.01312       5.876013 68.15938 3.289263 69.43311 3.483933 -1.273735      4.791350 
1 1 1 19  3  2  o 52.13731 2.616642 33.24529       3.313894 36.05467       4.414480 29.61806       5.016050 54.23885 3.356339 49.04236 4.238715 5.196484       5.406636 
1 1 1 19  3  3  o 109.4811 2.519881 146.2188       6.722879 132.4252       9.645962 159.2484       9.375003 104.0402 3.811034 114.1515 3.373887 -10.11132      5.089901 
1 1 1 19  3  4  o 98.44045 3.364591 118.4722       8.059409 107.4784       12.98969 125.3532       10.27660 93.44810 5.731741 101.1718 4.177235 -7.723747      7.092401 
1 1 1 19  3  5  o 73.54336 4.034777 66.31676       7.203309 70.30624       10.46104 62.71954       9.933454 75.49657 5.728827 71.27639 5.768222 4.220184       8.129689 
1 1 1 19  3  6  o 127.9607 4.181652 200.4693       13.02197 204.1758       18.74245 197.0103       18.10575 128.8174 5.986946 126.5524 5.887103 2.264946       8.396517 
1 1 1 19  3  7  o 40.87374 5.509649 20.85858       5.348248 17.26423       7.079614 25.63671       8.162601 36.66636 8.135993 44.95448 7.729685 -8.288116      11.22241 
1 1 1 19  3  8  o 82.23753 3.209048 82.73381       6.418712 80.40230       7.526538 88.95158       12.29120 81.00021 3.823850 84.87064 5.981236 -3.870430      7.099085 
1 1 1 19  3  9  o 140.5468 3.493841 241.4471       11.96631 238.4242       14.34469 248.3641       21.69913 139.4995 4.224575 141.9096 6.290352 -2.410049      7.577306 
1 1 1 19  3  10 o 154.5948 3.652133 292.2961       13.75870 294.6385       16.60556 287.1665       24.57350 155.0208 4.400143 152.4405 6.630870 2.580307       7.957996 
1 1 1 19  3  11 o 70.76727 3.504571 61.39446       6.024906 62.16146       7.051568 59.32061       11.59516 71.13171 4.085233 68.92866 7.000031 2.203049       8.104911 
1 1 1 19  3  12 o 15.97211 5.767535 2.621531       2.877051 2.322773       3.053043 4.991051       8.598116 15.79046 5.900434 24.99542 9.760592 -9.204953      11.40545 
1 1 1 19  3  13 o 20.66350 6.092025 5.357594       3.276120 4.886429       3.488005 8.886033       9.545127 20.04010 6.360449 28.83800 10.49226 -8.797905      12.26959 
1 1 1 19  3  14 o 122.9518 3.056797 184.8990       9.158778 186.0135       10.28805 180.6420       20.10698 123.2141 3.429726 120.4137 6.880919 2.800362       7.688307 
1 1 1 19  3  15 o 112.6481 3.713202 155.7661       10.17923 143.4683       15.82742 164.4409       13.29316 107.4383 6.069950 115.4820 4.733687 -8.043716      7.697538 
1 1 1 19  3  16 o 71.89957 2.952712 63.38511       5.162480 61.14099       6.211867 68.39584       9.282172 70.49992 3.627943 74.22642 5.163825 -3.726494      6.310868 
1 1 1 19  3  17 o 116.6548 3.245105 167.0195       9.216063 170.5320       12.23506 162.4127       14.01183 117.5637 4.277812 114.4512 5.036201 3.112419       6.607798 
1 1 1 19  3  18 o 29.82536 4.141216 11.17589       2.928793 12.82589       4.651495 10.09206       3.769930 31.47272 6.285039 27.96307 5.725275 3.509649       8.501793 
1 1 1 19  3  19 o 65.09994 2.851780 52.10376       4.513127 60.11977       7.090804 46.64518       5.851353 69.58556 4.201147 61.33632 3.935502 8.249237       5.756545 
1 1 1 19  3  20 o 17.40294 5.527061 3.763050       2.633478 5.305430       3.929721 2.505722       3.548055 20.66082 6.768625 16.52520 6.318621 4.135614       9.259549 
1 1 1 19  3  21 o 10.25044 4.832209 -3.299729      3.133199 -3.100435      3.687167 -3.817549      5.943393 11.56814 5.384504 15.12053 6.966963 -3.552393      8.805195 
1 1 1 19  3  22 o 41.29274 4.625870 21.68998       4.574908 22.74590       4.907101 14.67370       12.64916 42.20742 4.859483 32.35592 12.02585 9.851501       12.97057 
1 1 1 19  3  23 o 20.03517 6.252352 5.278636       3.384140 5.204312       3.975735 5.474131       6.447899 20.18083 6.813740 22.11521 8.502285 -1.934383      10.89568 
1 1 1 19  3  24 o 17.78420 5.582932 4.137846       2.694173 5.574252       3.901139 2.828068       3.725218 20.48844 6.745656 16.73654 6.455176 3.751898       9.336657 
1 1 1 19  3  25 o 11.50687 4.946505 0.1196942      2.499783 3.319618       3.766805 -2.398729      3.341702 17.19707 6.526014 11.07819 5.146117 6.118880       8.310920 
1 1 1 19  3  26 f 33.81714 4.191447 14.93901       3.380230 12.82665       4.626878 17.35694       4.950221 29.93347 6.527372 35.36820 5.954808 -5.434729      8.835515 
1 1 1 19  3  27 o 39.74196 3.665666 20.45016       3.510102 16.56182       4.658345 25.55792       5.339061 34.29680 5.778888 43.27898 5.164115 -8.982182      7.750073 
1 1 1 19  3  28 o 13.53120 5.644819 1.353911       3.096098 -0.3337834     4.734782 2.614627       4.092246 14.25380 6.431135 15.96644 6.558908 -1.712644      9.185791 
1 1 1 19  3  29 o 8.472692 4.112767 -3.794172      2.662370 1.906682       3.846377 -9.037719      3.688880 14.79323 6.239046 8.406539 4.212210 6.386687       7.527842 
1 1 1 19  3  30 o 11.84181 5.229548 0.2226025      2.959085 2.710996       3.986803 -2.829735      4.415516 15.39621 6.412830 11.92051 5.654209 3.475696       8.549530 
1 1 1 19  3  31 o 12.72206 5.716986 0.3307453      3.699072 -8.824986      6.816667 4.152116       4.403876 12.23819 6.065465 16.60856 6.811322 -4.370370      9.120524 
1 1 1 19  3  32 o 14.91208 5.929784 3.303968       3.225046 4.497433       4.508736 2.053624       4.614925 16.45661 6.834199 14.49306 6.458229 1.963551       9.402925 
1 1 1 19  3  33 o 14.95963 5.935237 3.581410       3.223990 3.231664       4.464720 3.962483       4.660392 14.95419 6.518665 15.59623 6.729623 -0.6420422     9.369142 
1 1 1 19  4  0  f 99.59884 2.294292 120.9789       5.568511 122.2566       7.770726 119.6301       7.983721 100.0303 3.191908 98.93793 3.316046 1.092346       4.602655 
1 1 1 19  4  1  o 38.37966 2.961818 18.08217       2.748685 18.47905       3.610947 17.53536       4.238483 38.69928 3.881308 37.56839 4.734618 1.130894       6.122186 
1 1 1 19  4  2  o 167.6497 3.014079 343.0338       12.31384 333.8441       19.54578 349.0815       15.85618 165.0974 4.863517 169.0321 3.849403 -3.934662      6.202557 
1 1 1 19  4  3  o 155.8251 3.221205 296.4424       12.23185 303.1966       24.06584 294.0898       14.20326 157.0288 6.301858 155.1504 3.756635 1.878433       7.336602 
1 1 1 19  4  4  o 82.64553 2.976876 83.47702       5.985580 78.42123       11.16170 85.51783       7.091478 79.75675 5.782104 83.60406 3.488418 -3.847313      6.752909 
1 1 1 19  4  5  f 119.7383 2.821107 174.9790       8.231689 162.4612       10.85630 191.9100       12.62579 115.2280 3.871726 125.2110 4.143607 -9.982933      5.670956 
1 1 1 19  4  6  o 143.2145 3.026379 250.4088       10.56200 246.1026       14.25474 255.6508       15.72748 141.7962 4.129731 144.4665 4.472798 -2.670334      6.087741 
1 1 1 19  4  7  o 168.2619 3.265455 345.8170       13.38954 344.3544       18.24121 347.5257       19.71600 167.6674 4.468441 168.3677 4.810268 -0.7002869     6.565489 
1 1 1 19  4  8  o 50.05619 3.269681 30.73944       3.966575 32.26825       4.978131 28.08097       6.564534 51.20407 4.021824 47.46811 5.794996 3.735958       7.053868 
1 1 1 19  4  9  o 113.7260 2.937497 158.0526       8.134100 153.9733       10.78864 163.4259       12.38196 112.1135 3.955066 115.4340 4.409801 -3.320473      5.923588 
1 1 1 19  4  10 o 180.3246 3.963788 397.9872       17.41813 376.4909       27.55636 412.2906       22.47807 174.6149 6.487245 183.2155 5.039334 -8.600677      8.214575 
1 1 1 19  4  11 o 58.47440 3.270133 41.92760       4.641236 41.86781       5.898962 42.02476       7.519552 58.31583 4.178701 58.23341 5.358929 0.8241653E-01  6.795562 
1 1 1 19  4  12 o 117.2032 2.661326 167.7672       7.601052 162.3078       9.171011 179.7460       13.58481 115.1655 3.271138 120.9439 4.617768 -5.778366      5.658987 
1 1 1 19  4  13 o 156.7389 2.905220 300.2805       11.09665 290.2547       13.57127 320.5042       19.27490 153.9671 3.617066 161.3895 4.906655 -7.422440      6.095771 
1 1 1 19  4  14 o 156.7593 2.946691 300.5023       11.25652 306.1599       14.08069 290.4841       18.73713 158.0740 3.655336 153.5188 5.015204 4.555206       6.205945 
1 1 1 19  4  15 o 133.1480 2.833031 216.8309       9.192257 219.0674       11.34768 212.5623       15.67701 133.6582 3.486955 131.2460 4.910295 2.412277       6.022446 
1 1 1 19  4  16 f 176.6450 3.595487 382.8763       15.47730 374.8562       20.88921 392.6377       23.04576 174.1846 4.926203 178.0693 5.316828 -3.884659      7.248182 
1 1 1 19  4  17 o 12.39668 5.380688 -0.4033960     3.014750 -1.590906      3.466044 3.286823       6.110003 12.30599 5.531670 20.71124 8.185457 -8.405251      9.879326 
1 1 1 19  4  18 o 112.6282 2.851961 155.6110       7.821267 161.8094       9.642995 143.6932       13.37125 114.6709 3.454762 107.4189 5.122814 7.252007       6.178884 
1 1 1 19  4  19 o 50.68131 2.902605 31.63538       3.569866 31.04433       5.166054 32.17556       4.938722 49.88914 4.290942 50.86781 4.016724 -0.9786758     5.877606 
1 1 1 19  4  20 o 53.22558 2.908633 34.93116       3.758302 32.37041       5.418727 37.30487       5.217088 50.83595 4.417943 54.74629 3.936832 -3.910339      5.917506 
1 1 1 19  4  21 o 45.59552 3.309539 25.81960       3.652239 23.19162       5.565091 27.80778       4.840477 42.49054 5.503749 47.04035 4.269059 -4.549805      6.965351 
1 1 1 19  4  22 f 40.07012 3.570386 20.10083       3.449880 23.36994       5.355711 17.78239       4.510241 42.59927 5.271537 37.14512 5.118600 5.454151       7.347733 
1 1 1 19  4  23 o 42.22998 3.968215 22.55805       4.035832 23.66662       5.643712 21.39788       5.773560 42.53355 5.579388 40.15658 6.090877 2.376972       8.260045 
1 1 1 19  4  24 o 12.05843 5.064310 0.5044936      2.517473 2.565388       3.863873 -1.015700      3.318520 16.56622 6.521016 12.15139 5.441272 4.414835       8.493002 
1 1 1 19  4  25 o 14.04892 5.813674 1.202969       3.246653 1.972342       3.847627 -0.6991779     6.049877 15.72160 6.397315 16.39318 7.343316 -0.6715746     9.739093 
1 1 1 19  4  26 o 19.47646 6.752782 5.219843       3.910798 5.355398       5.232757 5.048324       5.886124 20.18384 7.684158 20.22869 8.021606 -0.4484749E-01 11.10822 
1 1 1 19  4  27 o 13.69752 5.493840 1.721783       2.792307 4.805041       3.926050 -1.434375      3.972192 18.61765 6.735454 12.60432 5.766024 6.013336       8.866418 
1 1 1 19  4  28 o 34.95417 4.036509 16.24288       3.375188 13.95661       4.558631 19.01679       5.021316 30.61592 6.319705 36.28603 5.879644 -5.670109      8.631853 
1 1 1 19  4  29 o 14.60158 5.604202 2.632505       2.798149 2.563176       3.878761 2.707739       4.040557 15.44650 6.369586 15.72619 6.494589 -0.2796879     9.096775 
1 1 1 19  4  30 o 19.15071 5.819995 5.692261       2.955920 2.835739       3.835789 9.868890       4.638193 15.37395 6.336384 23.79466 7.301957 -8.420718      9.667902 
1 1 1 19  4  31 o 15.22020 5.815756 3.365426       3.004474 2.305955       3.893922 4.924107       4.723038 14.55964 6.214272 17.37004 7.080420 -2.810406      9.420696 
1 1 1 19  4  32 o 8.179749 4.039602 -4.973278      2.927427 -10.36395      3.962286 1.506092       4.344009 8.199739 4.141501 13.88026 6.219707 -5.680517      7.472402 
1 1 1 19  4  33 o 16.12906 6.958662 4.631266       4.981801 8.174112       7.900566 2.292805       6.418700 18.04730 8.208121 15.06917 7.043914 2.978130       10.81619 
1 1 1 19  5  0  o 219.7626 3.107629 589.4555       16.64252 592.0102       23.50182 586.8859       23.57047 220.0537 4.382649 219.0939 4.414708 0.9598541      6.220713 
1 1 1 19  5  1  o 86.03741 2.669563 90.39763       5.590334 86.02374       8.996864 93.14843       7.134883 83.76077 4.423405 87.28136 3.360791 -3.520592      5.555306 
1 1 1 19  5  2  o 140.1371 2.831415 239.6425       9.669249 244.9501       15.73856 236.4247       12.25475 141.4371 4.572320 139.0803 3.618860 2.356812       5.831146 
1 1 1 19  5  3  o 176.5666 2.975251 380.5112       12.80172 363.5538       19.02767 394.5349       17.30361 172.3334 4.534795 179.6732 3.952004 -7.339859      6.015205 
1 1 1 19  5  4  o 188.1899 3.092469 432.3490       14.18201 428.0229       21.48663 435.6885       18.87835 186.9484 4.720173 188.7772 4.103726 -1.828781      6.254647 
1 1 1 19  5  5  o 103.2563 2.774860 130.2140       6.975895 130.6192       9.160348 129.6545       10.76315 103.3296 3.643607 102.8650 4.303243 0.4645386      5.638597 
1 1 1 19  5  6  o 198.0860 3.552229 479.4418       17.14711 484.8125       23.67736 473.5186       24.86560 198.9437 4.883901 196.4764 5.197974 2.467316       7.132421 
1 1 1 19  5  7  o 167.3063 3.263624 341.9166       13.30603 344.8132       18.14671 338.5482       19.56879 167.7764 4.442354 166.1619 4.837924 1.614487       6.568107 
1 1 1 19  5  8  o 35.07048 3.923876 15.22986       3.296044 13.94175       3.930383 18.28264       6.050697 33.36246 4.987204 37.96210 6.789897 -4.599640      8.424661 
1 1 1 19  5  9  o 162.0866 3.255646 321.0289       12.85939 326.7999       17.47742 314.2171       18.98822 163.2866 4.396286 160.0008 4.875655 3.285782       6.565009 
1 1 1 19  5  10 o 153.6322 3.198589 288.4461       11.97504 300.3528       16.34327 274.6432       17.59663 156.5277 4.288655 149.5493 4.834816 6.978333       6.462818 
1 1 1 19  5  11 o 90.14502 2.560034 99.29435       5.618023 95.17877       6.643833 109.6214       10.52424 88.19699 3.096014 94.43291 4.587037 -6.235916      5.534095 
1 1 1 19  5  12 o 55.82758 2.857355 38.18005       3.874378 37.58005       4.488372 39.93413       7.674222 55.33088 3.344395 56.67389 5.631085 -1.343018      6.549359 
1 1 1 19  5  13 o 52.49166 3.053627 33.80574       3.889226 35.31650       4.482831 29.20749       7.820792 53.60567 3.449988 48.06834 6.871930 5.537331       7.689332 
1 1 1 19  5  14 o 215.6373 3.440161 569.4533       18.07751 574.8878       22.82557 560.3086       29.60903 216.3442 4.329524 212.8805 5.712747 3.463715       7.168002 
1 1 1 19  5  15 o 84.74400 2.776963 87.92579       5.727014 90.03910       6.868423 83.10447       10.37428 85.67388 3.295970 81.88234 5.226424 3.791542       6.178910 
1 1 1 19  5  16 o 25.24613 5.612661 8.204933       3.363610 7.311211       3.871008 10.95948       6.795910 23.82421 6.492005 29.17252 8.816133 -5.348309      10.94853 
1 1 1 19  5  17 o 96.06009 3.220925 113.3258       7.529135 114.9106       9.719170 110.9475       11.90626 96.48251 4.143410 94.45266 5.192774 2.029854       6.643248 
1 1 1 19  5  18 o 114.4961 2.848294 160.7500       7.947157 169.0917       9.807600 144.8006       13.56154 117.2109 3.437383 107.7662 5.179209 9.444717       6.216093 
1 1 1 19  5  19 o 94.74572 3.060244 110.4448       7.056376 108.6775       7.945183 117.0447       15.35373 93.85091 3.480023 95.87336 6.612230 -2.022446      7.472091 
1 1 1 19  5  20 o 22.81650 4.935753 6.751537       2.664431 7.802885       4.036211 5.939541       3.547136 24.31124 6.630887 21.40549 6.346287 2.905746       9.178454 
1 1 1 19  5  21 o 18.98981 5.360987 4.692786       2.588867 8.663181       3.892984 1.544763       3.466447 25.50894 6.300285 15.16207 6.107288 10.34687       8.774540 
1 1 1 19  5  22 o 39.47563 3.479330 19.50069       3.312819 20.11308       4.681378 18.88639       4.688698 39.57468 4.963086 38.25363 5.161278 1.321045       7.160378 
1 1 1 19  5  23 o 13.04937 5.404419 0.8136575      2.808776 -0.2809267     5.387299 1.222265       3.291545 16.19445 7.107389 14.35330 5.887766 1.841152       9.229342 
1 1 1 19  5  24 o 28.67442 4.843581 10.81986       3.264095 14.88308       5.891154 9.019921       3.920966 32.23618 7.620371 25.53894 6.331827 6.697231       9.907679 
1 1 1 19  5  25 o 7.962776 3.885872 -4.258036      2.465224 -6.750344      3.914654 -2.620071      3.173546 9.898399 4.844605 10.56201 4.942248 -0.6636095     6.920695 
1 1 1 19  5  26 o 17.45746 5.813804 4.112498       2.895414 1.131837       4.252146 6.689308       3.953603 15.18502 6.487857 21.48790 6.765528 -6.302881      9.373615 
1 1 1 19  5  27 o 14.15306 5.862393 1.552487       3.305662 -0.2212546     3.778575 7.337887       6.824166 13.17213 5.858284 21.94252 8.657300 -8.770387      10.45315 
1 1 1 19  5  28 o 24.66783 6.000773 9.032267       3.572234 7.290449       3.979326 16.26252       8.107459 21.66599 6.782705 28.89457 9.730108 -7.228580      11.86086 
1 1 1 19  5  29 o 18.17953 5.896425 4.955686       2.985997 0.1783476E-01  3.957374 11.48336       4.550062 13.24919 5.936731 26.68161 6.935028 -13.43243      9.129041 
1 1 1 19  5  30 o 12.38670 5.214961 1.184027       2.679797 4.163094       3.572461 -2.649156      4.052352 16.71660 6.352688 11.45208 5.427533 5.264520       8.355522 
1 1 1 19  5  31 o 11.22110 5.104645 -0.4040413     3.057799 -2.091714      3.716498 3.132301       5.379811 11.07070 5.232183 16.04004 7.068760 -4.969340      8.794493 
1 1 1 19  5  32 o 13.64504 5.870580 2.016774       3.526638 2.789947       4.445085 0.7033873      5.793459 14.88439 6.495995 14.36218 6.706416 0.5222120      9.336699 
1 1 1 19  5  33 o 16.42330 6.128957 4.775253       3.291976 4.873992       4.706404 4.680668       4.606323 16.27501 6.884559 16.10883 6.812456 0.1661797      9.685386 
1 1 1 19  6  0  o 109.0614 2.638057 145.1080       7.011185 139.9743       11.17370 148.4418       9.004411 106.9190 4.297259 110.2138 3.356524 -3.294731      5.452769 
1 1 1 19  6  1  o 292.7778 3.820858 1047.260       27.26058 1015.502       37.78152 1081.748       39.37223 287.9220 5.384786 297.1494 5.437247 -9.227386      7.652423 
1 1 1 19  6  2  o 202.7666 3.213174 501.9422       15.87694 504.1327       24.38094 500.3293       20.92090 202.9387 4.930030 202.2926 4.243891 0.6460419      6.505060 
1 1 1 19  6  3  o 62.70985 2.590639 48.06075       3.950414 49.02682       5.381694 46.93202       5.817138 63.25973 3.504744 61.85049 3.879025 1.409241       5.227816 
1 1 1 19  6  4  o 116.4874 2.568298 165.5594       7.290552 158.7273       10.41077 172.1341       10.21287 113.9093 3.755621 118.6535 3.536030 -4.744240      5.158313 
1 1 1 19  6  5  o 208.2713 3.297882 529.7734       16.73789 517.5125       25.12505 539.5566       22.44323 205.5291 5.016463 209.9955 4.385705 -4.466370      6.663280 
1 1 1 19  6  6  o 218.9943 3.784851 586.2582       20.19843 599.5234       28.06179 571.9971       29.09606 221.1366 5.207375 215.8446 5.536250 5.292007       7.600448 
1 1 1 19  6  7  o 240.3397 4.041517 706.5989       23.67043 710.0925       32.68195 702.7444       34.32882 240.5049 5.576321 239.1538 5.890410 1.351181       8.111244 
1 1 1 19  6  8  o 137.8834 3.027883 232.1981       10.17389 230.7563       13.44649 234.1286       15.55989 137.2722 4.024012 138.1612 4.628048 -0.8889618     6.132822 
1 1 1 19  6  9  o 142.1671 3.074557 246.9165       10.65167 237.8075       13.87333 259.9968       16.62470 139.3197 4.090750 145.5551 4.693084 -6.235474      6.225695 
1 1 1 19  6  10 o 85.14389 2.528875 88.57686       5.241255 85.87476       6.105047 96.15057       10.22098 83.78677 2.994860 88.40901 4.761737 -4.622238      5.625241 
1 1 1 19  6  11 o 77.31995 2.555046 73.07487       4.807614 73.33392       5.662254 72.40572       9.100321 77.40986 3.007350 76.64037 4.898264 0.7694931      5.747795 
1 1 1 19  6  12 o 29.89182 4.008886 11.14145       2.846642 12.82205       3.167113 4.075042       6.494257 32.08027 4.148276 22.05731 8.518905 10.02295       9.475227 
1 1 1 19  6  13 f 234.0955 4.045471 672.0697       23.07800 692.2251       31.97509 650.1539       33.34228 236.9100 5.538501 229.2987 5.972105 7.611252       8.145000 
1 1 1 19  6  14 o 76.30200 3.081496 71.35296       5.717937 76.83635       7.083011 61.09340       9.688535 79.08734 3.685281 70.07666 5.723272 9.010681       6.807139 
1 1 1 19  6  15 o 72.48026 3.167779 64.45704       5.581625 63.83075       6.829332 65.71705       9.686789 71.99648 3.907161 72.68280 5.510103 -0.6863174     6.754787 
1 1 1 19  6  16 o 82.11348 3.102829 82.73649       6.197641 88.09731       7.798669 73.54739       10.21035 84.59090 3.792859 76.82886 5.489738 7.762047       6.672556 
1 1 1 19  6  17 o 74.38309 2.862219 67.89399       5.178477 71.97913       6.118005 57.57213       9.724905 76.50600 3.289228 67.67361 5.957745 8.832382       6.805421 
1 1 1 19  6  18 o 39.77503 4.721922 19.88845       4.487633 21.29221       5.177045 15.64557       9.000491 41.01493 5.303744 34.03137 10.11402 6.983562       11.42029 
1 1 1 19  6  19 o 29.41404 4.948727 11.06491       3.421383 11.86463       3.806967 7.706133       7.801920 30.37649 5.337565 25.87644 9.474859 4.500051       10.87486 
1 1 1 19  6  20 o 31.20408 4.730561 12.42312       3.484513 12.58496       4.063001 11.97307       6.775473 31.16362 5.553791 29.67454 8.764172 1.489080       10.37571 
1 1 1 19  6  21 o 14.80213 5.470526 2.261060       2.610788 1.290631       4.858865 2.654969       3.095642 16.94215 7.069904 16.02050 5.950208 0.9216480      9.240590 
1 1 1 19  6  22 o 13.51372 5.455466 1.200901       2.772755 1.928167       5.156054 0.9050112      3.288787 17.76346 7.336283 14.06493 5.838550 3.698532       9.376019 
1 1 1 19  6  23 o 61.48188 2.861580 46.92539       4.275591 41.43045       5.651533 54.27954       6.538088 57.21432 4.080235 65.50160 4.116848 -8.287277      5.796270 
1 1 1 19  6  24 o 17.36558 5.442605 3.966079       2.561486 3.465983       3.836195 4.368429       3.440930 17.53822 6.601380 18.44757 6.336875 -0.9093418     9.150640 
1 1 1 19  6  25 o 17.62477 5.509225 4.173306       2.626360 4.927158       3.831774 3.505345       3.606888 19.22790 6.683223 17.19481 6.415703 2.033091       9.264271 
1 1 1 19  6  26 o 31.64896 4.029556 13.10572       3.037423 11.34686       3.983423 15.54892       4.694848 28.31161 5.962409 33.22503 6.020164 -4.913410      8.473057 
1 1 1 19  6  27 o 20.95309 5.621764 6.322319       2.929831 9.034204       4.255043 3.877471       4.040120 24.28533 6.878757 17.43292 6.722817 6.852411       9.618397 
1 1 1 19  6  28 o 12.64408 5.292503 1.076643       2.735358 0.3806616E-01  3.809915 2.181510       3.929623 13.23230 5.883935 15.29041 6.367553 -2.058109      8.669857 
1 1 1 19  6  29 o 10.61222 4.832448 -0.8559315     2.748952 -3.982566      3.367610 5.387929       4.758936 9.755503 4.708851 18.71385 7.274652 -8.958344      8.665669 
1 1 1 19  6  30 o 15.75484 6.305860 3.373340       3.670830 3.373340       3.670830 0.000000       0.000000 15.75484 6.305860 ?        ?        0.000000       6.305860 
1 1 1 19  6  31 o 15.11293 5.658008 3.397928       2.810047 7.662217       3.850239 -1.462416      4.110531 20.83541 6.690168 11.92696 5.594977 8.908447       8.721360 
1 1 1 19  6  32 o 8.669237 4.204529 -3.250816      2.766740 -4.356874      3.693622 -1.836868      4.176189 9.713209 4.743653 11.57444 5.492611 -1.861234      7.257480 
1 1 1 19  6  33 o 18.23984 6.153641 6.039600       3.242727 8.333359       4.491217 3.541657       4.686853 19.90740 7.203693 15.14292 6.638063 4.764477       9.795769 
1 1 1 19  7  0  o 270.9031 3.603440 896.3389       23.78852 941.9696       34.50911 855.0226       32.83720 277.3797 5.105321 264.2698 5.098971 13.10986       7.215526 
1 1 1 19  7  1  o 119.1465 2.400594 173.1580       6.970053 181.6698       9.865914 164.6763       9.848396 121.9339 3.323395 116.0698 3.485802 5.864098       4.816199 
1 1 1 19  7  2  o 280.0826 4.017557 958.8403       27.42106 995.8951       43.54674 934.4940       35.29801 284.7994 6.274519 276.1983 5.244368 8.601135       8.177590 
1 1 1 19  7  3  o 149.2937 2.753076 271.9919       10.01604 263.9015       14.71631 278.9739       13.67101 146.8604 4.116107 151.1029 3.712715 -4.242432      5.543157 
1 1 1 19  7  4  o 66.31015 2.610949 53.73599       4.210801 54.18937       5.691967 53.18794       6.258165 66.50852 3.524539 65.84711 3.917798 0.6614151      5.269868 
1 1 1 19  7  5  o 12.62511 5.057503 0.9282926      2.363357 -0.1690843E-02 2.796632 3.251678       4.420368 12.41472 5.281531 18.87218 7.089896 -6.457460      8.840881 
1 1 1 19  7  6  o 92.21118 2.767804 103.8830       6.212454 107.1406       7.971732 98.84474       9.913942 93.57221 3.502167 89.73689 4.548392 3.835320       5.740474 
1 1 1 19  7  7  o 127.2490 2.941988 197.7217       9.122870 199.1421       11.92253 195.7153       14.16997 127.5513 3.840098 126.3205 4.610928 1.230782       6.000584 
1 1 1 19  7  8  o 185.4412 4.008052 420.8074       18.11239 431.2532       29.02696 414.1469       23.17833 187.0107 6.378746 183.6316 5.184817 3.379044       8.220141 
1 1 1 19  7  9  o 75.64502 3.303061 70.07179       6.074141 75.96918       8.333908 63.38896       8.871544 78.62747 4.366640 71.68164 5.112288 6.945831       6.723320 
1 1 1 19  7  10 o 196.2222 3.584524 470.9854       17.14020 471.6807       23.03419 470.1227       25.65720 196.0565 4.821205 195.4876 5.390995 0.5689545      7.232347 
1 1 1 19  7  11 o 26.57359 4.141723 8.855720       2.594653 8.764170       2.811803 9.380701       6.733300 26.36316 4.540576 27.63993 8.844432 -1.276772      9.941872 
1 1 1 19  7  12 o 165.9867 2.934296 336.7776       11.86898 336.3594       14.59482 337.5944       20.39557 165.7468 3.613411 165.5912 5.060256 0.1555939      6.217952 
1 1 1 19  7  13 o 54.42012 3.667993 36.44754       4.835928 38.30434       5.907035 32.67382       8.421140 55.67860 4.389034 50.82885 6.983054 4.849751       8.247828 
1 1 1 19  7  14 o 165.2465 3.253503 334.3556       13.10146 336.6604       14.78255 325.9160       28.28755 165.7068 3.660774 161.4568 7.207739 4.249969       8.084105 
1 1 1 19  7  15 o 45.02005 3.301417 24.97003       3.596765 25.51834       3.899284 21.84201       9.313314 45.47625 3.546580 40.59513 9.571393 4.881115       10.20734 
1 1 1 19  7  16 o 31.33727 4.135927 12.29409       3.081387 11.25016       3.273975 20.39232       9.118777 29.84663 4.653044 39.06438 9.639010 -9.217747      10.70333 
1 1 1 19  7  17 o 24.53668 5.622669 7.793009       3.289793 5.901643       3.754615 14.04447       6.826033 21.57965 6.559560 32.50743 8.516458 -10.92778      10.74979 
1 1 1 19  7  18 o 91.49324 3.045795 102.9265       6.781411 104.7278       8.407005 99.57157       11.47358 92.07613 3.754656 89.17332 5.303889 2.902802       6.498360 
1 1 1 19  7  19 o 17.88580 6.176687 3.730882       3.270629 2.483952       3.783496 7.417745       6.505798 16.82360 6.501015 24.76207 8.701298 -7.938473      10.86167 
1 1 1 19  7  20 o 37.21572 3.950619 17.37951       3.528172 16.90219       3.999609 19.05376       7.490695 36.51018 4.597077 37.30928 8.437319 -0.7990990     9.608406 
1 1 1 19  7  21 o 45.03158 4.178490 25.54189       4.533049 31.88025       5.670179 14.31628       7.545941 50.14665 4.694582 31.83363 9.206791 18.31302       10.33461 
1 1 1 19  7  22 o 48.96383 4.036776 30.24418       4.773912 29.53888       5.787230 31.74617       8.445336 47.94212 5.028291 48.34432 7.404016 -0.4022026     8.950037 
1 1 1 19  7  23 o 32.01583 4.141351 13.13646       3.155421 14.11634       5.222760 12.57318       3.959832 31.94152 6.910898 30.76668 5.482596 1.174843       8.821528 
1 1 1 19  7  24 o 34.28931 3.590310 14.95383       2.955615 9.303270       4.206221 20.46499       4.154010 25.70141 6.661622 39.80349 4.353549 -14.10208      7.958053 
1 1 1 19  7  25 f 27.10977 4.582715 9.758656       2.919716 5.445391       3.927561 15.08680       4.365236 19.91076 6.771910 33.25574 5.584208 -13.34498      8.777365 
1 1 1 19  7  26 o 13.51317 5.248369 1.851445       2.475358 3.775248       3.416215 -0.2751347     3.591748 17.13085 6.270139 12.94084 5.735924 4.190011       8.497969 
1 1 1 19  7  27 o 38.63947 3.762210 19.52418       3.497697 17.28953       4.351386 23.60415       5.879639 35.27922 5.218663 40.38033 6.170645 -5.101112      8.081541 
1 1 1 19  7  28 o 8.019848 3.904004 -3.767425      2.445233 -4.131902      3.147175 -3.212274      3.884106 9.335285 4.517230 11.16186 5.296890 -1.826578      6.961495 
1 1 1 19  7  29 o 17.23153 5.509881 4.391571       2.613559 8.269158       3.644396 0.2857152      3.750132 22.91239 6.321537 13.11357 5.833979 9.798819       8.602160 
1 1 1 19  7  30 o 10.24124 4.695427 -0.8912869     2.653688 0.9480073      3.896816 -2.481884      3.623802 13.55026 5.991840 10.82888 5.132279 2.721386       7.889388 
1 1 1 19  7  31 o 12.26130 5.177145 1.344236       2.653406 0.9153824      3.596381 1.856568       3.930853 12.91087 5.730217 14.01240 6.112187 -1.101522      8.378199 
1 1 1 19  7  32 o 11.37376 5.178436 -0.8119094E-01 3.155156 -2.174036      3.525801 8.332425       7.069367 10.51116 5.004783 18.79375 8.197313 -8.282593      9.604363 
1 1 1 19  7  33 o 10.60763 4.975283 -1.105042      3.248185 -0.6561993     3.605023 -3.041512      7.488009 11.35606 5.298587 13.49804 6.625684 -2.141980      8.483791 
1 1 1 19  8  0  o 90.09789 2.565694 99.11221       5.627470 105.2779       7.174400 89.25248       9.072493 92.81074 3.176815 85.32108 4.378132 7.489662       5.409270 
1 1 1 19  8  1  o 203.6659 3.270323 506.4610       16.23099 512.1793       20.91877 497.8107       25.72880 204.6754 4.194058 201.5234 5.243570 3.151962       6.714548 
1 1 1 19  8  2  o 124.4941 2.871356 189.1582       8.711079 201.1759       11.85004 175.0285       12.84918 128.2528 3.795728 119.5379 4.418568 8.714859       5.825058 
1 1 1 19  8  3  o 96.86361 2.755324 114.5963       6.497226 117.0535       8.482606 111.1086       10.10606 97.81902 3.564484 95.20282 4.367720 2.616203       5.637599 
1 1 1 19  8  4  o 93.88239 2.769302 107.6668       6.328716 110.7445       8.181204 103.0808       9.986715 95.14048 3.534855 91.66773 4.484251 3.472748       5.709966 
1 1 1 19  8  5  o 122.7015 2.908007 183.8029       8.695233 172.5536       10.96037 202.9063       14.28290 118.7464 3.792502 128.6576 4.562818 -9.911194      5.933159 
1 1 1 19  8  6  o 54.94872 3.882753 37.10674       5.165684 36.82066       6.056486 37.87037       9.895084 54.64221 4.590786 54.86552 7.605131 -0.2233124     8.883318 
1 1 1 19  8  7  o 184.5461 4.797503 417.7268       21.55697 394.3437       27.65081 453.9639       34.42175 178.8563 6.354159 191.5323 7.388737 -12.67593      9.745193 
1 1 1 19  8  8  o 79.89778 3.045098 78.09491       5.918021 81.91647       6.737802 65.19447       12.37942 81.79375 3.387686 72.30444 7.118053 9.489304       7.883089 
1 1 1 19  8  9  o 128.7193 3.184688 202.4863       9.989569 202.4863       9.989569 0.000000       0.000000 128.7193 3.184688 ?        ?        0.000000       3.184688 
1 1 1 19  8  10 o 72.18752 2.666606 63.72322       4.682847 63.77721       5.086854 63.42330       11.99015 72.19469 2.897283 71.27028 6.993622 0.9244156      7.570006 
1 1 1 19  8  11 o 26.80597 4.179461 9.015012       2.641147 9.974184       2.805221 1.527529       7.837665 28.22097 4.207436 21.58993 8.991962 6.631041       9.927633 
1 1 1 19  8  12 o 32.21028 5.258985 13.09773       3.985626 13.22489       4.495180 12.63031       8.618460 32.23283 5.941710 31.68232 9.990789 0.5505142      11.62410 
1 1 1 19  8  13 o 140.8409 3.118414 242.7149       10.70283 240.6236       13.62050 246.0907       17.30462 139.9877 3.996794 141.2531 5.035275 -1.265396      6.428714 
1 1 1 19  8  14 o 103.1171 3.140323 130.3062       7.881967 125.9634       8.897611 146.1378       16.98818 101.2888 3.610533 108.2257 6.470949 -6.936981      7.410069 
1 1 1 19  8  15 o 38.00761 3.670505 17.89631       3.357389 18.30407       3.786824 16.39816       7.258567 38.36227 4.114979 35.29146 8.534499 3.070805       9.474742 
1 1 1 19  8  16 o 12.61353 5.161339 0.7260420      2.521574 1.051583       2.763493 -0.8928930     6.162689 13.51466 5.449718 17.49368 7.641483 -3.979019      9.385717 
1 1 1 19  8  17 o 43.84620 3.209678 23.73540       3.405730 23.88227       3.785450 23.11153       7.801809 43.91506 3.567980 41.93723 7.924440 1.977825       8.690640 
1 1 1 19  8  18 o 61.86412 2.788203 47.05751       4.192584 49.02422       4.779762 40.49565       8.730718 63.07525 3.119325 56.24702 6.488411 6.828232       7.199282 
1 1 1 19  8  19 o 11.12765 4.898769 -0.6201751     2.577475 0.3605014      2.812699 -5.758615      6.438371 12.69810 5.344194 14.97737 7.018353 -2.279267      8.821434 
1 1 1 19  8  20 o 49.70635 3.188677 30.62313       3.842040 30.71086       4.340815 30.30581       8.255216 49.65969 3.611685 47.79924 7.319835 1.860458       8.162368 
1 1 1 19  8  21 o 17.75144 5.737093 3.970789       2.828313 4.204971       3.158372 3.022741       6.354795 18.34395 6.070895 20.11781 8.208242 -1.773857      10.20936 
1 1 1 19  8  22 o 31.98761 4.405302 13.13499       3.342854 12.43115       3.737278 15.95147       7.476027 30.82331 5.157609 33.11349 9.021448 -2.290176      10.39170 
1 1 1 19  8  23 o 49.96817 3.352417 31.33084       4.058517 35.50194       4.738454 19.84445       7.863275 53.04514 3.688663 36.56856 8.907536 16.47658       9.641081 
1 1 1 19  8  24 f 20.36612 4.859833 5.579606       2.378228 4.039327       3.464265 6.952584       3.270719 17.89828 6.344159 22.41851 5.905698 -4.520227      8.667504 
1 1 1 19  8  25 o 24.93657 5.135915 8.484742       3.017015 7.431860       4.702709 9.221211       3.933104 22.54147 7.405553 25.37745 6.370356 -2.835976      9.768502 
1 1 1 19  8  26 o 38.50968 4.209487 19.54855       3.886078 20.32026       5.513871 18.78690       5.477796 37.70066 6.218263 36.00050 6.482342 1.700169       8.982625 
1 1 1 19  8  27 o 7.487756 3.647233 -3.457723      2.143280 -1.188841      2.999251 -5.825460      3.063894 10.98700 5.020164 8.429672 4.157314 2.557325       6.518076 
1 1 1 19  8  28 o 28.29739 4.187120 10.85368       2.800301 8.476291       3.708360 14.00798       4.271533 23.45148 6.338973 30.79763 5.906371 -7.346148      8.664166 
1 1 1 19  8  29 f 20.05350 5.360245 6.009889       2.669750 1.225144       3.602337 11.84029       3.976529 13.67540 5.908761 27.75497 6.050433 -14.07957      8.457021 
1 1 1 19  8  30 o 16.09329 5.428504 3.913530       2.523518 3.679248       3.466648 4.177614       3.680535 15.88355 6.199059 16.54491 6.406909 -0.6613598     8.914977 
1 1 1 19  8  31 o 15.91275 5.543923 3.989440       2.637508 3.653052       3.460757 4.455552       4.073768 15.48380 6.147346 16.48372 6.627329 -0.9999180     9.039433 
1 1 1 19  8  32 o 13.36115 5.498230 2.300470       2.882209 0.9946298      3.997049 3.714917       4.159946 13.06392 5.900235 15.40416 6.492088 -2.340244      8.772683 
1 1 1 19  8  33 o 16.60905 6.018487 4.924440       3.136338 7.494754       4.271831 1.918805       4.619438 19.03645 7.004226 13.89052 6.301334 5.145926       9.421571 
1 1 1 19  9  0  o 137.0550 2.776261 229.2182       9.272381 233.0199       14.92719 226.8296       11.83195 137.9541 4.446056 136.2261 3.567253 1.727982       5.700237 
1 1 1 19  9  1  o 50.25722 2.818005 30.92121       3.437426 34.54161       4.720964 26.83603       5.014845 53.04514 3.674870 46.62553 4.468263 6.419605       5.785330 
1 1 1 19  9  2  o 97.36452 2.499458 115.7344       5.925478 114.7809       8.461923 116.6518       8.300200 96.86083 3.591181 97.65872 3.493346 -0.7978897     5.009995 
1 1 1 19  9  3  o 71.19708 2.589631 61.93513       4.485513 60.75142       6.061761 63.36766       6.668505 70.42666 3.543424 71.90104 3.819603 -1.474380      5.210108 
1 1 1 19  9  4  o 182.1915 3.048898 405.3066       13.53652 418.3393       20.66496 395.5115       17.91521 184.8502 4.587527 179.8246 4.088244 5.025620       6.144846 
1 1 1 19  9  5  o 200.1086 3.626398 489.4524       17.68388 483.5948       32.57296 491.9004       21.05732 198.0245 6.759885 200.4779 4.310230 -2.453415      8.017115 
1 1 1 19  9  6  o 226.8135 3.893409 629.2412       21.51964 643.2160       29.59471 613.5620       31.34760 228.9416 5.304607 223.3864 5.763342 5.555237       7.832942 
1 1 1 19  9  7  o 29.46346 4.328667 10.85451       3.015357 9.387328       3.393492 16.35921       6.573124 27.19361 5.311463 35.67885 7.779842 -8.485243      9.420063 
1 1 1 19  9  8  o 174.9426 3.387354 374.1369       14.44083 365.7225       18.75813 386.3795       22.62628 172.6987 4.460958 177.2990 5.242615 -4.600296      6.883687 
1 1 1 19  9  9  o 24.11959 4.915243 7.396857       2.790869 8.812862       3.144213 2.137662       6.059534 26.35368 5.080093 19.86307 8.048190 6.490610       9.517389 
1 1 1 19  9  10 o 76.39691 2.835624 71.40292       5.269947 72.80614       6.344506 68.28036       9.464320 77.07920 3.385989 74.33578 5.258570 2.743423       6.254396 
1 1 1 19  9  11 o 48.11568 4.457846 28.65439       5.167517 33.72482       7.101212 22.94721       7.533913 51.99823 5.697293 42.34578 7.579169 9.652454       9.481717 
1 1 1 19  9  12 o 29.46167 3.674271 10.79652       2.580761 10.70640       2.772666 11.38076       7.059697 29.28331 3.989061 29.87730 8.976022 -0.5939865     9.822503 
1 1 1 19  9  13 o 96.08501 2.551960 112.9072       5.970092 114.1802       6.911446 109.1653       11.84922 96.56745 2.940413 93.93330 5.196725 2.634148       5.970927 
1 1 1 19  9  14 o 72.84044 2.568913 64.95083       4.552791 67.47239       5.159359 56.07866       9.677782 74.20180 2.858633 66.96158 5.994144 7.240219       6.640899 
1 1 1 19  9  15 o 57.73812 2.656998 40.87765       3.728414 41.50947       4.113729 37.97100       8.823359 58.14676 2.912452 54.69355 6.764067 3.453217       7.364440 
1 1 1 19  9  16 o 104.9684 2.733703 135.0513       6.986769 135.2966       7.662402 133.8411       17.01685 105.0011 2.997642 102.9255 6.823053 2.075607       7.452511 
1 1 1 19  9  17 o 14.24834 5.047774 2.212000       2.192877 2.655988       2.325211 -1.358865      6.594220 15.20499 5.209620 17.71176 7.814906 -2.506772      9.392172 
1 1 1 19  9  18 o 31.00220 3.696387 12.02750       2.737641 13.54834       2.983207 3.913988       6.890425 32.90816 3.789088 21.83125 8.671945 11.07691       9.463605 
1 1 1 19  9  19 o 22.34867 4.838338 6.478597       2.558509 4.761551       2.733371 18.62504       7.269965 19.19657 5.537904 37.02154 8.267434 -17.82496      9.950821 
1 1 1 19  9  20 o 14.09895 5.205729 2.038159       2.363189 1.580262       2.571048 4.531467       5.999488 13.73459 5.344785 21.22070 8.190052 -7.486109      9.779758 
1 1 1 19  9  21 o 29.79244 4.142768 11.31645       2.926429 11.94016       3.224188 8.399837       6.972155 30.51074 4.468884 25.36887 8.999411 5.141876       10.04790 
1 1 1 19  9  22 o 115.0007 2.937946 164.0288       8.226679 161.6286       9.073327 175.1192       19.50368 113.9152 3.271892 114.1897 7.043236 -0.2744598     7.766109 
1 1 1 19  9  23 o 31.54243 4.501617 12.93273       3.362138 14.75244       3.535581 -4.261157      10.86790 33.76644 4.401401 19.86616 9.246008 13.90028       10.24017 
1 1 1 19  9  24 o 48.79776 3.560629 30.23206       4.204976 33.32501       4.493409 8.434007       11.92884 51.20763 3.624268 25.65796 10.91144 25.54966       11.49760 
1 1 1 19  9  25 o 42.06266 2.965864 22.33347       3.020583 20.27815       4.009602 25.03052       4.593106 39.36394 4.247053 43.68375 4.373446 -4.319805      6.096268 
1 1 1 19  9  26 o 16.93803 5.170533 3.977775       2.329556 1.952837       3.258896 6.093658       3.331276 14.55629 5.900658 20.43268 6.171959 -5.876390      8.538785 
1 1 1 19  9  27 o 55.32162 3.321451 39.43887       4.457119 38.35218       4.805044 46.13800       11.93034 54.24150 3.656577 50.11348 10.11825 4.128021       10.75870 
1 1 1 19  9  28 o 14.46316 5.159995 2.781646       2.295157 3.616634       3.088534 1.751864       3.429928 16.17708 5.955054 14.17264 5.928988 2.004448       8.403307 
1 1 1 19  9  29 o 19.24381 5.706172 5.699734       2.867506 5.732292       4.953295 5.683322       3.516719 18.73559 7.380749 18.85076 6.407993 -0.1151733     9.774345 
1 1 1 19  9  30 o 18.35407 5.232928 5.167662       2.454428 2.974816       3.230723 8.160891       3.774554 14.84220 5.924104 21.87159 6.561602 -7.029384      8.840228 
1 1 1 19  9  31 o 16.20199 5.469687 4.178062       2.561954 2.618834       3.278255 6.624465       4.106312 14.16127 5.849291 18.89268 6.880636 -4.731411      9.030911 
1 1 1 19  9  32 o 8.782038 4.148198 -1.599507      2.330001 -1.906110      2.919533 -1.061659      3.866831 9.665670 4.588448 11.52451 5.412646 -1.858841      7.095815 
1 1 1 19  10 0  o 308.2408 4.398779 1162.265       33.04140 1196.389       53.41019 1141.109       42.05460 311.7778 7.029799 305.0287 5.657658 6.749084       9.023701 
1 1 1 19  10 1  o 126.8366 2.615358 196.3009       8.083729 207.6294       12.17981 187.3819       10.80713 130.2804 3.840605 123.7916 3.586255 6.488831       5.254663 
1 1 1 19  10 2  o 139.1993 3.007523 236.5579       10.20193 234.8615       13.49042 238.8240       15.59213 138.5373 4.000162 139.6075 4.589352 -1.070190      6.087976 
1 1 1 19  10 3  o 262.5739 3.846052 842.8937       24.60950 805.5485       36.90729 872.7901       33.02209 256.1042 5.913701 266.8565 5.077977 -10.75232      7.794723 
1 1 1 19  10 4  o 164.8374 3.293324 331.9278       13.22898 325.7888       23.89092 334.6425       15.88684 162.7007 6.036163 165.4175 3.941123 -2.716812      7.208864 
1 1 1 19  10 5  o 200.6278 3.227967 491.7320       15.78179 474.6719       23.29470 506.2054       21.45613 196.7908 4.857540 203.3460 4.329919 -6.555191      6.507219 
1 1 1 19  10 6  o 53.04083 3.125486 34.48717       4.021933 38.44698       4.812251 25.31282       7.324853 55.96738 3.546637 44.78588 6.935554 11.18150       7.789772 
1 1 1 19  10 7  f 112.6573 2.899923 155.1111       7.954641 163.1927       10.24133 142.8209       12.62949 115.4566 3.644566 107.8068 4.819511 7.649849       6.042396 
1 1 1 19  10 8  o 37.41113 3.313476 17.24202       2.989586 17.06429       3.302257 18.04949       7.038650 37.16637 3.694952 37.45233 7.957831 -0.2859612     8.773810 
1 1 1 19  10 9  o 41.47628 3.499228 21.19123       3.503820 19.34322       3.986748 27.46303       7.344499 39.51214 4.205012 46.69874 6.640857 -7.186600      7.860223 
1 1 1 19  10 10 o 38.53138 4.075430 18.39667       3.768770 20.07362       4.478166 14.32532       6.977650 40.17035 4.661083 33.23447 8.562672 6.935875       9.749104 
1 1 1 19  10 11 o 59.22086 2.629578 42.93246       3.785406 42.54396       4.217620 44.54187       8.584270 58.91652 2.946967 59.75765 5.974894 -0.8411293     6.662130 
1 1 1 19  10 12 o 58.74688 2.611432 42.25899       3.729176 42.10155       4.115521 42.98144       8.815800 58.60464 2.890673 58.57384 6.273832 0.3079605E-01  6.907746 
1 1 1 19  10 13 o 67.14006 3.176095 55.31987       5.181772 55.92578       6.188281 53.89824       9.478904 67.40757 3.782429 65.67307 5.988724 1.734505       7.083190 
1 1 1 19  10 14 o 149.9180 3.652052 275.9098       13.34219 274.8417       15.64766 278.7545       25.53719 149.3512 4.303856 149.0271 7.051888 0.3241272      8.261495 
1 1 1 19  10 15 o 37.60875 4.205726 17.64108       3.788562 17.77586       4.359982 17.22560       7.654929 37.60814 4.871730 36.02035 8.797771 1.587791       10.05657 
1 1 1 19  10 16 o 70.35390 2.543963 60.68637       4.354312 62.43489       4.891013 54.00513       9.560735 71.31118 2.820086 65.40170 6.068024 5.909477       6.691322 
1 1 1 19  10 17 o 114.4831 2.764240 160.7881       7.711757 158.8945       8.409177 170.8042       19.34036 113.6872 3.038053 115.7847 6.885619 -2.097572      7.526055 
1 1 1 19  10 18 o 28.94847 3.426467 10.47494       2.370368 12.23725       2.532776 -1.959657      6.727769 31.33078 3.370274 17.41067 7.775391 13.92010       8.474400 
1 1 1 19  10 19 o 9.254593 4.080580 -0.4777019     1.794972 -0.2243327     1.862814 -3.767371      6.712257 9.755711 4.232015 16.28183 7.465945 -6.526117      8.581975 
1 1 1 19  10 20 o 23.57068 6.082165 7.403854       3.516859 5.814437       3.650377 27.94653       13.12343 21.08551 6.479238 42.60672 12.08453 -21.52121      13.71191 
1 1 1 19  10 21 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 19  10 22 o 37.58277 4.117289 18.02392       3.709178 17.59143       4.216550 19.50359       7.799233 36.82703 4.813552 36.42830 8.869846 0.3987312      10.09180 
1 1 1 19  10 23 o 17.86983 5.246955 4.269206       2.434430 4.003390       2.608476 6.064066       6.778159 17.42391 5.496652 22.24530 8.672109 -4.821390      10.26736 
1 1 1 19  10 24 o 35.11359 3.515424 15.74073       2.967672 19.03206       3.297470 1.711857       6.807804 38.62611 3.542606 18.56726 8.072084 20.05885       8.815248 
1 1 1 19  10 25 o 39.48938 3.409379 19.96483       3.248791 19.99189       3.502697 19.79826       8.691358 39.35266 3.695774 33.56663 9.929487 5.786034       10.59497 
1 1 1 19  10 26 o 11.42546 4.872419 0.4523339      2.390236 0.2910402      2.543016 1.674971       7.001473 11.53113 4.973316 17.87710 7.961182 -6.345967      9.386921 
1 1 1 19  10 27 o 11.79134 4.687064 1.286907       2.014201 -1.316386      2.683108 4.648262       3.048834 10.20728 4.695115 17.88864 5.966050 -7.681358      7.591959 
1 1 1 19  10 28 o 22.72417 4.315416 7.150059       2.302354 7.472191       3.012374 6.697551       3.570304 22.40971 5.546366 20.62465 6.419806 1.785059       8.483872 
1 1 1 19  10 29 o 37.00431 3.112937 17.91483       2.781103 16.52258       3.550647 20.12482       4.473486 34.47587 4.320905 37.28296 5.053800 -2.807087      6.649143 
1 1 1 19  10 30 o 11.60392 4.746247 1.309162       2.131198 1.390728       2.815038 1.199632       3.262069 12.56412 5.320064 12.87480 5.592559 -0.3106852     7.718795 
1 1 1 19  10 31 o 15.80255 5.340419 3.949909       2.442299 3.864026       3.254922 4.060560       3.694565 15.57263 6.026530 15.85331 6.332628 -0.2806816     8.741924 
1 1 1 19  10 32 o 10.54738 4.866133 -0.5789931     2.912891 0.8869781      5.017296 -1.324345      3.577565 13.64611 6.327505 10.97289 5.169934 2.673214       8.171018 
1 1 1 19  11 0  o 147.5683 3.114690 265.8840       11.20067 268.1597       21.31648 265.0161       13.16445 147.6803 5.935296 147.2682 3.668239 0.4120789      6.977372 
1 1 1 19  11 1  o 185.8894 4.045255 422.5582       18.32469 437.0066       30.55702 414.4442       22.89917 188.3432 6.668231 183.8271 5.116778 4.516098       8.405161 
1 1 1 19  11 2  o 178.0341 3.004869 387.0029       13.03662 406.0949       20.14155 373.2381       17.10219 182.1310 4.538087 174.6968 4.017266 7.434250       6.060747 
1 1 1 19  11 3  o 207.0307 3.709328 523.9720       18.71398 530.4877       35.67327 521.4980       21.98146 207.3005 7.072010 206.4096 4.370093 0.8909454      8.313305 
1 1 1 19  11 4  o 194.7474 4.021564 464.0017       19.08547 447.7626       22.25873 509.0883       37.08879 191.1491 4.778504 202.8308 7.516654 -11.68164      8.906974 
1 1 1 19  11 5  o 23.87607 5.289100 7.270006       2.996267 7.633579       3.466516 6.196002       5.957991 24.43390 5.891071 23.71728 8.327480 0.7166252      10.20057 
1 1 1 19  11 6  o 74.78387 2.901939 68.40580       5.278460 73.81479       6.573244 58.58487       8.857230 77.62473 3.483787 68.86858 5.318839 8.756157       6.358209 
1 1 1 19  11 7  o 136.1911 2.698812 226.4840       8.956892 219.9648       10.70059 241.7426       16.37065 134.1488 3.273291 140.2991 4.795275 -6.150330      5.805954 
1 1 1 19  11 8  o 51.54369 3.287394 32.61238       4.107656 31.92052       4.816407 34.45800       7.866634 50.91267 3.912023 52.49472 6.273516 -1.582043      7.393302 
1 1 1 19  11 9  o 86.04746 2.967638 90.59978       6.213475 85.93981       7.641867 99.69028       10.67337 83.69448 3.756425 89.94915 4.887686 -6.254669      6.164431 
1 1 1 19  11 10 o 74.97646 3.030911 68.84633       5.526346 67.84196       6.698231 70.98750       9.780000 74.33188 3.709569 75.73619 5.333164 -1.404312      6.496426 
1 1 1 19  11 11 o 56.71905 2.671700 39.40240       3.682396 41.45601       4.086812 30.53955       8.490099 58.15609 2.892803 49.01003 7.333822 9.146061       7.883734 
1 1 1 19  11 12 o 59.12080 2.597275 42.80494       3.732787 45.72645       4.180218 31.30735       8.292752 61.08230 2.815901 49.65297 7.051648 11.42933       7.593091 
1 1 1 19  11 13 o 112.9718 2.589533 156.0632       7.128985 161.7282       8.357697 140.9332       13.65872 114.8978 2.987496 106.6344 5.272612 8.263474       6.060162 
1 1 1 19  11 14 o 126.8801 2.816507 197.1051       8.708443 197.9635       9.578488 193.0133       20.91203 127.0929 3.092712 123.8613 6.956215 3.231621       7.612739 
1 1 1 19  11 15 o 13.17431 4.510368 1.971064       1.742826 1.455081       1.800236 9.676103       6.956635 12.26251 4.540693 27.65938 9.002169 -15.39687      10.08251 
1 1 1 19  11 16 o 56.65814 3.204447 39.57093       4.406334 40.43249       5.093473 37.00830       8.784393 57.17040 3.675477 53.68341 6.872237 3.486984       7.793380 
1 1 1 19  11 17 o 37.08590 7.707689 18.28765       6.738133 25.96424       7.849242 -3.216083      13.13713 44.44933 7.513993 23.94891 10.76698 20.50043       13.12966 
1 1 1 19  11 18 o 53.60220 3.294125 35.57218       4.282092 35.57218       4.282092 0.000000       0.000000 53.60220 3.294125 ?        ?        0.000000       3.294125 
1 1 1 19  11 19 o 48.46447 3.280773 29.16580       3.851841 32.24561       4.033158 -2.795286      12.99254 50.97443 3.263959 23.43057 10.60461 27.54386       11.09555 
1 1 1 19  11 20 o 25.39954 7.254656 8.784180       4.713159 9.117768       6.405684 8.390410       6.959537 25.98090 8.647315 25.39913 8.993087 0.5817776      12.47604 
1 1 1 19  11 21 o 92.83195 4.476372 109.3028       10.09666 108.1635       13.33323 110.8345       15.45916 90.88468 6.054694 90.92075 7.031903 -0.3606415E-01 9.279385 
1 1 1 19  11 22 o 50.98052 7.063787 35.77272       8.540125 0.000000       0.000000 35.77272       8.540125 ?        ?        50.98052 7.063787 0.000000       7.063787 
1 1 1 19  11 23 o 48.84912 5.150118 31.49035       6.038545 44.56253       9.356702 22.15934       7.905207 56.54197 6.935823 38.28391 8.674909 18.25807       11.10674 
1 1 1 19  11 24 f 28.74441 7.097058 12.16829       4.941117 12.05221       7.072529 12.27897       6.906034 27.31365 9.086149 27.61877 8.967941 -0.3051205     12.76644 
1 1 1 19  11 25 o 19.29828 4.554770 5.092463       2.107311 5.197232       2.197613 3.895643       7.427611 19.44671 4.691743 19.82452 8.524343 -0.3778095     9.730205 
1 1 1 19  11 26 o 20.04912 5.515401 5.794876       2.778753 5.057537       3.011791 10.01398       7.204461 18.68650 5.907798 23.94790 9.039454 -5.261395      10.79879 
1 1 1 19  11 27 o 17.71039 5.620068 4.569766       2.723332 3.561864       2.940905 10.63536       7.214538 16.11537 5.829572 23.83333 9.034564 -7.717958      10.75208 
1 1 1 19  11 28 o 37.16774 3.702109 18.41834       3.308593 18.41834       3.308593 0.000000       0.000000 37.16774 3.702109 ?        ?        0.000000       3.702109 
1 1 1 19  11 29 o 12.81012 4.726328 2.125744       1.947348 2.651911       2.686002 1.542737       2.827365 14.19490 5.479614 12.90554 5.389832 1.289363       7.686121 
1 1 1 19  11 30 o 13.74387 4.921755 2.701274       2.090113 1.649914       2.731429 4.186638       3.246614 12.70662 5.301488 16.20204 6.078360 -3.495423      8.065496 
1 1 1 19  11 31 o 10.40131 4.449069 0.6727313      2.003725 1.322942       2.550994 -0.3745611     3.237549 11.95934 5.064219 11.27742 5.176356 0.6819191      7.241614 
1 1 1 19  11 32 o 14.20105 5.045535 3.134644       2.192315 3.074471       2.745302 3.240563       3.642312 14.15398 5.518685 14.60580 6.109969 -0.4518223     8.233322 
1 1 1 19  12 0  o 118.3655 3.507970 171.3338       10.10736 178.6341       16.31570 166.7874       12.87550 120.5332 5.569785 116.6392 4.538506 3.894012       7.184744 
1 1 1 19  12 1  o 81.55640 2.951645 81.31520       5.856544 70.72164       10.17995 86.55591       7.160105 75.71339 5.556121 84.09115 3.501745 -8.377762      6.567549 
1 1 1 19  12 2  o 36.57560 4.319582 16.59862       3.775882 18.96896       6.413703 15.34129       4.671177 38.63708 7.072451 34.90760 5.686824 3.729473       9.075215 
1 1 1 19  12 3  o 93.88341 2.546430 107.6518       5.820435 116.1802       8.414137 99.82620       8.059957 97.42697 3.549940 90.28539 3.671012 7.141586       5.106702 
1 1 1 19  12 4  o 51.97444 3.204551 33.12896       4.039021 37.08734       4.897513 24.71182       7.141658 54.94997 3.678586 44.26123 6.841658 10.68873       7.767900 
1 1 1 19  12 5  o 153.4467 2.833146 287.5378       10.59406 273.2407       15.26812 300.8120       14.71189 149.3249 4.199995 156.8000 3.850226 -7.475128      5.697736 
1 1 1 19  12 6  o 61.76205 3.084308 46.72351       4.627422 55.55772       5.641416 28.55627       8.090007 67.32040 3.450297 47.53791 7.209391 19.78249       7.992488 
1 1 1 19  12 7  o 105.1926 2.967754 135.3071       7.600020 133.0818       9.613626 139.0152       12.41019 104.2060 3.792128 106.3228 4.802177 -2.116783      6.118917 
1 1 1 19  12 8  o 171.2389 3.412442 358.7168       14.23980 353.6737       18.73888 365.6088       21.90628 169.7119 4.535078 172.3374 5.222210 -2.625519      6.916532 
1 1 1 19  12 9  o 101.5539 2.535040 125.9642       6.273609 125.7666       7.329536 126.5054       12.13270 101.3858 2.969831 101.3167 4.928845 0.6906128E-01  5.754425 
1 1 1 19  12 10 o 57.70456 2.679229 40.77867       3.757241 44.70630       4.194398 24.82821       8.452619 60.40502 2.857548 43.87933 8.206492 16.52569       8.689770 
1 1 1 19  12 11 o 46.02125 2.799084 25.99305       3.124294 27.09690       3.416398 20.35339       7.722183 46.96714 3.000652 39.56787 8.275203 7.399261       8.802437 
1 1 1 19  12 12 o 54.02630 2.572595 35.76537       3.377250 35.96812       3.673893 34.65977       8.579126 54.15244 2.793462 52.28177 6.902189 1.870670       7.446048 
1 1 1 19  12 13 o 48.77033 6.184692 30.06619       7.185330 34.63938       8.427184 17.88837       13.75173 52.22137 6.782197 37.31267 12.67178 14.90870       14.37262 
1 1 1 19  12 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 19  12 15 f 56.26524 5.605075 39.88207       7.583120 52.11129       9.155068 13.15523       13.53431 64.27402 5.911232 33.36980 12.43238 30.90422       13.76615 
1 1 1 19  12 16 f 58.41509 4.584219 42.61581       6.473446 49.83269       9.372546 36.03260       8.951624 62.58154 6.228349 52.75954 7.146038 9.822002       9.479356 
1 1 1 19  12 17 o 32.25624 6.420386 13.64556       4.869222 14.33481       6.613279 12.82955       7.195780 32.52127 8.313812 30.74335 9.019214 1.777916       12.26645 
1 1 1 19  12 18 o 16.37761 6.647064 1.704427       4.141339 3.032807       5.495008 -0.4211327E-01 6.300813 19.39245 7.730768 17.93699 7.782134 1.455454       10.96934 
1 1 1 19  12 19 o 33.23790 6.399623 14.68013       4.995446 18.43025       7.164149 11.13138       6.969143 36.48008 8.252516 28.40052 8.987747 8.079561       12.20179 
1 1 1 19  12 20 o 73.70179 4.570714 68.86842       8.168755 71.08836       10.90543 66.03062       12.33002 73.76755 6.121628 70.08183 7.327937 3.685715       9.548455 
1 1 1 19  12 21 o 22.07798 7.159351 6.570367       4.402225 9.315589       6.494972 4.237496       5.987339 25.76148 8.708915 20.44918 8.096253 5.312298       11.89094 
1 1 1 19  12 22 o 75.14120 4.726477 72.93815       8.610851 78.85625       11.49603 65.37403       12.99677 76.59732 6.212098 67.65471 8.040249 8.942612       10.16050 
1 1 1 19  12 23 o 17.42195 7.619429 0.8894703      6.143482 0.000000       0.000000 0.8894703      6.143482 ?        ?        17.42195 7.619429 0.000000       7.619429 
1 1 1 19  12 24 o 22.96087 7.367766 7.885985       4.670212 12.41922       6.936272 4.126663       6.316502 27.47456 8.992057 19.58271 8.106860 7.891855       12.10695 
1 1 1 19  12 25 f 30.18223 7.734966 14.43252       5.714671 9.249872       7.445270 21.86414       8.915515 23.61141 9.120758 34.50504 10.01582 -10.89363      13.54639 
1 1 1 19  12 26 o 16.05478 4.824362 3.585837       2.039218 3.625878       2.130190 3.146855       7.053285 16.12997 4.948253 18.53569 8.133744 -2.405725      9.520662 
1 1 1 19  12 27 o 28.70665 9.800777 17.10306       8.227863 0.000000       0.000000 17.10306       8.227863 ?        ?        28.70665 9.800777 0.000000       9.800777 
1 1 1 19  12 28 o 20.29742 4.401895 5.826584       2.114476 6.439090       2.213179 -0.5844583     7.160215 21.36849 4.396912 15.72268 7.378358 5.645803       8.589121 
1 1 1 19  12 29 o 13.76346 4.956940 2.633536       2.123489 2.633536       2.123489 0.000000       0.000000 13.76346 4.956940 ?        ?        0.000000       4.956940 
1 1 1 19  12 30 o 23.39240 4.087465 7.775191       2.245282 8.998135       3.118951 6.459682       3.234836 23.89528 5.474040 19.48705 6.117529 4.408230       8.209098 
1 1 1 19  12 31 o 16.57619 5.187672 4.402864       2.328003 3.891865       2.452697 9.048576       7.395370 15.57108 5.350021 18.97862 8.328363 -3.407539      9.898705 
1 1 1 19  13 0  o 278.8151 5.185797 953.3408       35.23448 961.6780       60.88239 949.1422       43.20498 278.0995 8.995539 277.7394 6.383519 0.3600769      11.03037 
1 1 1 19  13 1  o 48.75593 4.079916 29.28572       4.803059 18.96607       7.608589 36.12259       6.192983 38.39878 8.368077 54.09174 4.746266 -15.69296      9.620383 
1 1 1 19  13 2  o 300.6069 4.742814 1107.478       34.74331 1099.767       48.32186 1115.730       49.98947 298.7275 6.637925 300.7932 6.819844 -2.065674      9.516949 
1 1 1 19  13 3  o 56.18806 3.465059 38.73705       4.721422 39.08576       5.163424 36.95784       11.66309 56.40448 3.778332 53.75173 9.236788 2.652752       9.979682 
1 1 1 19  13 4  o 183.3206 3.388255 410.7970       15.13643 402.8974       20.46958 420.3283       22.48426 181.2367 4.638567 185.0215 4.991341 -3.784866      6.813941 
1 1 1 19  13 5  f 44.24555 3.447257 24.08061       3.687574 25.37938       4.430302 21.15145       6.653312 45.35110 4.051375 40.83315 6.934093 4.517952       8.030896 
1 1 1 19  13 6  o 175.6139 4.969374 379.0125       21.24515 384.9518       28.81093 371.9340       31.45298 176.3656 6.715858 173.0333 7.476912 3.332336       10.05022 
1 1 1 19  13 7  o 31.17581 4.758427 12.20156       3.500710 10.09031       3.657147 35.30792       12.09868 28.15444 5.527789 52.17665 9.876960 -24.02221      11.31860 
1 1 1 19  13 8  o 55.79600 2.850656 38.14584       3.863155 38.31179       4.043024 36.40432       13.09745 55.90326 2.978541 52.72872 10.56152 3.174534       10.97349 
1 1 1 19  13 9  o 109.8709 2.779633 147.6417       7.436308 152.0227       8.068729 122.9355       19.16122 111.4600 2.973294 98.86199 8.022365 12.59805       8.555631 
1 1 1 19  13 10 o 155.8833 4.938813 299.6052       18.73742 323.5729       25.28140 270.3929       27.91071 161.3444 6.442960 146.7719 7.831901 14.57249       10.14152 
1 1 1 19  13 11 o 65.39707 5.221794 53.14283       8.252664 55.10703       9.844607 48.49947       15.13639 66.35516 6.158461 60.65372 10.62784 5.701435       12.28323 
1 1 1 19  13 12 o 24.15105 7.459341 7.345758       4.830797 9.836952       6.494628 4.260573       7.227551 27.81631 8.658613 22.81071 8.936768 5.005602       12.44337 
1 1 1 19  13 13 f 65.55091 4.311350 53.20412       6.848736 57.56068       9.902899 49.21006       9.481958 67.67976 6.068723 62.45807 6.316514 5.221684       8.759438 
1 1 1 19  13 14 f 16.87128 6.858383 1.602088       4.417085 0.2209424      5.785909 3.531548       6.838640 17.69250 7.563838 21.64143 8.625291 -3.948929      11.47202 
1 1 1 19  13 15 o 56.13981 4.456192 39.29158       6.046382 42.82380       8.735397 36.04282       8.377575 58.00134 6.280363 53.02931 6.627130 4.972031       9.130268 
1 1 1 19  13 16 o 23.81271 7.249514 7.355066       4.583617 10.59666       6.098487 3.146411       6.948874 28.20508 8.310785 21.24728 8.615106 6.957800       11.97035 
1 1 1 19  13 17 o 31.18930 6.676539 12.89507       4.921350 20.31197       6.989945 5.604591       6.930121 38.95065 7.637231 23.16171 8.836970 15.78894       11.67987 
1 1 1 19  13 18 o 40.94826 5.285105 21.52326       5.150949 20.61981       7.198103 22.47145       7.374172 38.94563 7.855784 40.77448 7.703688 -1.828850      11.00273 
1 1 1 19  13 19 o 19.24234 6.984516 4.277676       4.226342 8.737009       5.736196 -1.017671      6.250808 25.39299 8.167100 17.02710 7.555955 8.365891       11.12627 
1 1 1 19  13 20 o 21.87773 7.175270 6.349072       4.415555 9.481039       6.355194 3.426124       6.139469 26.08317 8.610803 19.98937 8.100469 6.093798       11.82216 
1 1 1 19  13 21 o 47.80651 4.794244 29.57799       5.509961 32.34709       8.188674 27.28696       7.448356 48.38376 7.161046 44.40932 7.123312 3.974445       10.10060 
1 1 1 19  13 22 o 23.02119 7.207233 7.527035       4.493002 5.229568       6.212676 10.04623       6.505568 21.05752 8.274919 25.93835 8.715900 -4.880835      12.01837 
1 1 1 19  13 23 o 38.02599 6.370135 20.31634       5.694308 25.11369       7.786046 14.79971       8.349369 40.76278 8.123520 29.59489 9.873008 11.16790       12.78545 
1 1 1 19  13 24 o 13.38874 6.152402 -1.775341      4.591352 1.564072       6.044352 -6.330670      7.059510 17.29770 7.561565 14.43945 6.930739 2.858254       10.25731 
1 1 1 19  13 25 o 18.78146 8.198407 3.149519       7.083244 0.000000       0.000000 3.149519       7.083244 ?        ?        18.78146 8.198407 0.000000       8.198407 
1 1 1 19  13 26 o 20.92789 8.702262 6.865034       7.323846 0.000000       0.000000 6.865034       7.323846 ?        ?        20.92789 8.702262 0.000000       8.702262 
1 1 1 19  13 27 o 15.69044 6.874700 1.860992       5.021461 2.742093       7.202589 1.027715       7.004393 17.69152 7.961496 16.66342 7.635613 1.028099       11.03123 
1 1 1 19  13 28 o 16.20192 7.027831 2.957834       5.136285 4.061388       7.389351 1.926217       7.144446 17.90365 8.059897 16.68905 7.671047 1.214605       11.12685 
1 1 1 19  13 29 f 13.83694 6.420692 -0.1154380     5.180548 -2.541592      7.916285 1.701873       6.851361 14.81829 7.168915 15.88007 7.373934 -1.061775      10.28437 
1 1 1 19  13 30 o 22.26515 8.337971 11.42981       6.103363 18.86119       9.075669 5.294020       8.246677 24.72397 9.908578 17.42421 8.090642 7.299765       12.79212 
1 1 1 19  13 31 o 14.92991 6.791624 2.610420       5.412316 -2.275277      8.162533 6.443880       7.230313 14.27227 6.987479 17.38065 7.884148 -3.108384      10.53493 
1 1 1 19  14 0  o 112.7593 2.946023 155.3722       8.088213 166.4738       15.89549 151.4936       9.395473 116.2829 5.626165 111.2793 3.468957 5.003601       6.609644 
1 1 1 19  14 1  o 138.5920 3.106658 234.6349       10.49223 226.8306       19.70093 237.7249       12.39655 135.6738 5.973385 139.3863 3.652743 -3.712479      7.001704 
1 1 1 19  14 2  o 76.57593 3.727332 71.88795       6.934576 76.59752       10.69313 68.46968       9.109963 78.75430 5.608487 74.53625 5.045216 4.218056       7.543828 
1 1 1 19  14 3  o 82.96133 2.569789 84.09921       5.189020 86.10895       7.253019 81.99200       7.426833 83.83963 3.558131 81.78427 3.736341 2.055359       5.159510 
1 1 1 19  14 4  o 93.12336 2.590436 105.9583       5.872804 110.3627       8.318076 101.5806       8.292778 94.91862 3.602669 91.03814 3.746013 3.880478       5.197292 
1 1 1 19  14 5  o 100.4479 2.974522 123.3985       7.273029 129.6262       12.39795 120.1307       8.980669 102.6154 4.972743 99.00179 3.729122 3.613586       6.215667 
1 1 1 19  14 6  f 64.13222 3.071748 50.39278       4.786670 57.54423       5.881942 36.37010       8.236434 68.48316 3.536506 53.89108 6.396321 14.59208       7.308885 
1 1 1 19  14 7  o 28.73610 3.767729 10.28507       2.574924 10.28373       2.782361 10.29306       6.796134 28.67808 4.097684 28.62906 8.848409 0.4901505E-01  9.751172 
1 1 1 19  14 8  o 82.36976 2.498195 82.95431       5.008734 83.55553       5.677301 80.84312       10.63872 82.62865 2.823668 80.79511 5.435032 1.833534       6.124760 
1 1 1 19  14 9  o 106.0623 2.949996 137.7033       7.617225 138.1227       9.392355 136.8973       13.01995 106.0962 3.638158 105.2712 5.090412 0.8250351      6.256875 
1 1 1 19  14 10 o 46.87087 4.970964 27.38695       5.591334 23.10615       7.368919 33.19610       8.584151 42.40868 7.399365 51.11756 7.081079 -8.708874      10.24169 
1 1 1 19  14 11 o 71.23166 4.166687 62.62734       7.201112 58.66032       10.11427 66.70554       10.25501 68.41663 6.131421 73.09122 5.805165 -4.674591      8.443593 
1 1 1 19  14 12 o 45.11459 5.233177 25.54545       5.646711 34.81347       8.256849 17.40238       7.739541 52.35505 6.619422 36.22161 8.845852 16.13344       11.04834 
1 1 1 19  14 13 f 33.81894 6.427942 14.78949       5.103872 12.41973       6.964752 17.53819       7.500969 30.66270 8.838173 36.29373 8.611470 -5.631029      12.33980 
1 1 1 19  14 14 o 34.92989 6.147032 15.74042       5.041387 20.21443       7.215874 11.47417       7.046344 39.13027 7.840704 29.50478 8.989706 9.625488       11.92860 
1 1 1 19  14 15 o 35.91342 5.949131 16.62880       5.024389 14.08835       6.969985 19.37699       7.249365 32.29259 8.673948 38.08690 8.062288 -5.794304      11.84221 
1 1 1 19  14 16 o 40.15955 5.583910 20.67752       5.317046 31.99659       7.948496 11.51043       7.153116 49.61561 6.748801 29.23840 9.084682 20.37721       11.31715 
1 1 1 19  14 17 o 36.65410 5.883557 17.47685       5.077549 21.89947       7.122704 12.90710       7.240217 40.40512 7.510271 30.53672 9.070197 9.868404       11.77593 
1 1 1 19  14 18 o 36.71730 5.954574 17.68536       5.145576 22.77392       7.304875 12.67388       7.249332 40.94755 7.600386 30.01453 9.112859 10.93302       11.86634 
1 1 1 19  14 19 o 18.39581 6.941319 3.621972       4.247322 2.707567       5.804594 4.675765       6.231323 19.11964 7.828092 21.25308 8.306379 -2.133440      11.41381 
1 1 1 19  14 20 o 13.88978 6.075725 -0.2628430     3.907825 -1.158383      5.248178 0.8515291      5.854383 15.31965 6.852641 17.52598 7.552290 -2.206336      10.19783 
1 1 1 19  14 21 f 39.21847 6.125311 20.88072       5.662724 27.41358       7.819735 13.67740       8.211202 43.93290 7.577758 29.59972 9.788404 14.33318       12.37882 
1 1 1 19  14 22 o 16.42915 6.797963 2.043127       4.438452 2.081389       6.576103 2.011114       6.015174 18.65685 8.021537 18.07670 7.719743 0.5801411      11.13281 
1 1 1 19  14 23 o 18.37815 7.786422 2.826955       6.035957 0.000000       0.000000 2.826955       6.035957 ?        ?        18.37815 7.786422 0.000000       7.786422 
1 1 1 19  14 24 o 21.63012 8.896331 6.657909       7.540590 0.000000       0.000000 6.657909       7.540590 ?        ?        21.63012 8.896331 0.000000       8.896331 
1 1 1 19  14 25 f 17.40324 7.275775 3.227158       5.160135 -2.659931      7.020347 10.14540       7.610378 15.51835 7.289884 23.85545 9.219643 -8.337094      11.75348 
1 1 1 19  14 26 o 16.67071 7.100302 2.819870       5.064543 1.760350       7.656028 3.644264       6.753302 17.72718 8.069366 18.29351 7.994891 -0.5663338     11.35927 
1 1 1 19  14 27 o 15.80574 6.922976 2.162108       5.088569 3.814823       7.128130 0.4446017      7.266511 18.01781 8.027788 16.34374 7.590888 1.674078       11.04839 
1 1 1 19  14 28 o 14.92751 6.798615 1.008755       5.443793 -4.258955      7.538796 6.748321       7.869201 14.28006 6.929175 19.19873 8.500913 -4.918669      10.96718 
1 1 1 19  14 29 o 44.75171 6.932584 34.35109       7.316017 31.45259       10.33194 37.26588       10.36094 33.22211 10.97967 38.38712 10.68478 -5.165009      15.32050 
1 1 1 19  14 30 o 17.04872 8.027581 4.831938       8.601458 4.831938       8.601458 0.000000       0.000000 17.04872 8.027581 ?        ?        0.000000       8.027581 
1 1 1 19  15 0  o 40.09948 4.001572 19.87091       3.858103 18.93777       7.239427 20.24107       4.559544 38.40327 7.995939 40.36489 4.724627 -1.961620      9.287472 
1 1 1 19  15 1  o 103.6958 3.630325 131.6663       9.159509 148.5292       14.79970 121.1972       11.66116 109.7933 5.549471 99.29005 4.834006 10.50329       7.359636 
1 1 1 19  15 2  o 108.5747 3.645449 144.3626       9.631622 171.5758       15.75336 128.1174       12.17158 118.0143 5.492819 102.0623 4.908176 15.95201       7.366224 
1 1 1 19  15 3  o 120.9367 3.060934 178.8451       9.013613 184.5320       16.85729 176.5683       10.66648 122.3191 5.670754 120.0733 3.649579 2.245811       6.743655 
1 1 1 19  15 4  o 66.22460 3.006101 53.70826       4.838661 48.76681       7.309921 57.56181       6.455292 62.84204 4.809939 68.45152 3.885833 -5.609474      6.183463 
1 1 1 19  15 5  o 140.3801 2.495336 240.6466       8.536322 241.4915       11.37195 239.5559       12.92005 140.5064 3.321258 139.8078 3.795760 0.6985931      5.043664 
1 1 1 19  15 6  o 108.9866 2.565901 145.0913       6.814737 145.5811       8.025174 143.8249       12.90378 109.0762 3.022089 108.0412 4.913940 1.034981       5.768867 
1 1 1 19  15 7  o 38.27105 3.014062 18.02269       2.788314 17.02408       3.017480 23.85806       7.294246 37.14183 3.370503 43.25627 7.170832 -6.114441      7.923454 
1 1 1 19  15 8  o 40.46112 3.383255 20.18776       3.305356 18.39137       3.668881 27.92892       7.616168 38.51578 3.965544 46.91903 6.864254 -8.403248      7.927391 
1 1 1 19  15 9  o 26.71518 7.081501 9.228539       4.684080 20.10676       6.603365 -1.788665      6.645414 39.56829 7.109597 17.70474 7.826997 21.86355       10.57394 
1 1 1 19  15 10 o 105.2696 3.917107 136.3580       10.03105 136.1523       15.04571 136.5226       13.45868 104.5340 5.930677 104.9159 5.281096 -0.3818588     7.941216 
1 1 1 19  15 11 o 84.20131 4.009073 87.44501       8.202564 89.92644       12.01723 85.28046       11.22373 84.81841 5.849873 82.67461 5.604069 2.143799       8.101025 
1 1 1 19  15 12 o 56.10415 4.633218 39.19281       6.278103 50.92892       9.224491 29.06567       8.568872 63.56885 6.026709 47.31973 7.695116 16.24912       9.774253 
1 1 1 19  15 13 o 83.94534 4.553262 87.55110       9.279543 100.9206       12.80533 72.76625       13.46611 89.57327 5.899301 75.28892 7.436663 14.28435       9.492403 
1 1 1 19  15 14 o 45.05959 5.332499 25.71171       5.742021 32.05660       8.336533 19.98455       7.920332 49.72676 7.079251 38.51196 8.651219 11.21481       11.17852 
1 1 1 19  15 15 o 13.64275 6.117550 -1.622801      4.210490 3.031081       5.971817 -6.223192      5.937398 20.03588 8.034895 13.98815 6.611680 6.047730       10.40547 
1 1 1 19  15 16 o 33.44303 6.295044 14.70676       4.942068 17.81017       6.802375 11.23747       7.192184 36.22417 7.926687 28.79137 9.132782 7.432804       12.09298 
1 1 1 19  15 17 o 62.58160 4.703275 49.51365       7.120227 55.73709       9.728936 42.33547       10.44858 65.59699 6.158206 56.06830 7.863053 9.528690       9.987547 
1 1 1 19  15 18 o 13.09227 5.931145 -1.818698      4.075818 1.595966       5.612797 -5.628021      5.928288 18.03170 7.566698 14.03403 6.625284 3.997673       10.05730 
1 1 1 19  15 19 o 18.59388 7.136708 3.628420       4.537836 4.176399       5.841417 2.794437       7.206343 20.33013 8.013239 20.44532 8.576304 -0.1151943     11.73733 
1 1 1 19  15 20 o 36.90260 6.583016 18.69876       5.702777 17.13140       7.574376 20.75005       8.665117 33.69166 9.038886 36.73361 9.581571 -3.041954      13.17224 
1 1 1 19  15 21 o 38.10498 8.228458 21.58231       7.416848 0.000000       0.000000 21.58231       7.416848 ?        ?        38.10498 8.228458 0.000000       8.228458 
1 1 1 19  15 22 o 19.30902 8.086474 3.478916       6.390742 0.000000       0.000000 3.478916       6.390742 ?        ?        19.30902 8.086474 0.000000       8.086474 
1 1 1 19  15 23 o 22.31492 7.401536 7.546466       4.693910 12.67191       7.121758 3.609868       6.241400 27.28113 9.118703 18.91614 7.961006 8.364988       12.10489 
1 1 1 19  15 24 o 22.80619 7.998709 8.378876       5.495812 6.420810       7.824909 10.28511       7.720644 21.31118 8.937983 24.25406 9.309009 -2.942884      12.90524 
1 1 1 19  15 25 o 16.50855 7.530063 0.3064307      6.710421 0.000000       0.000000 0.3064307      6.710421 ?        ?        16.50855 7.530063 0.000000       7.530063 
1 1 1 19  15 26 o 21.75725 7.988700 8.351639       5.552391 16.26925       8.649666 2.802533       7.241255 27.11861 9.968637 17.78174 7.994090 9.336874       12.77808 
1 1 1 19  15 27 o 12.02417 5.778642 -3.940182      4.942517 -9.081579      6.930974 1.379464       7.050097 12.50117 6.181460 16.43425 7.577906 -3.933078      9.779320 
1 1 1 19  15 28 o 19.47940 7.974336 7.464006       6.022509 10.25276       8.721306 4.921951       8.326623 20.67519 9.059350 17.97766 8.269951 2.697523       12.26637 
1 1 1 19  15 29 o 19.76687 8.868863 10.01646       8.863634 10.01646       8.863634 0.000000       0.000000 19.76687 8.868863 ?        ?        0.000000       8.868863 
1 1 1 19  15 30 o 24.49563 8.612144 14.55004       6.373741 16.43346       9.500068 13.00827       8.595346 21.97418 9.544552 20.72914 9.040205 1.245039       13.14625 
1 1 1 19  16 0  o 83.18170 3.020397 84.64919       6.112323 84.16118       11.64432 84.83481       7.181234 82.48841 5.830317 83.20894 3.549703 -0.7205276     6.825906 
1 1 1 19  16 1  o 131.0045 3.109314 209.7499       9.926287 199.1948       18.50122 214.0163       11.76258 127.0055 5.994723 132.2037 3.654599 -5.198143      7.020883 
1 1 1 19  16 2  o 113.4561 3.733847 157.7333       10.30929 174.7134       16.42381 146.6929       13.24331 118.9810 5.680893 109.1637 4.991522 9.817314       7.562264 
1 1 1 19  16 3  o 117.2359 2.618220 167.8661       7.480024 175.2825       10.89427 161.2516       10.28842 119.5916 3.742795 114.7108 3.685293 4.880821       5.252609 
1 1 1 19  16 4  o 118.7713 2.608589 172.3124       7.550112 164.9839       10.61305 179.8216       10.74308 116.0023 3.759338 121.1338 3.643521 -5.131584      5.235252 
1 1 1 19  16 5  o 94.40623 2.599151 108.9649       5.973857 109.6868       8.399353 108.2260       8.498134 94.56264 3.651802 93.91801 3.720478 0.6446381      5.213215 
1 1 1 19  16 6  o 213.0811 3.379642 555.8969       17.54897 559.0217       21.74163 550.0549       29.72724 213.4066 4.180693 210.9015 5.789618 2.505112       7.141280 
1 1 1 19  16 7  o 50.44916 4.705295 31.59050       5.717937 37.89011       8.172944 25.55089       8.002516 54.94690 6.212629 44.62010 7.633924 10.32680       9.842437 
1 1 1 19  16 8  o 55.41301 4.396111 38.00964       5.887694 39.23271       8.473397 36.86788       8.186907 55.84299 6.338632 54.11633 6.327348 1.726662       8.956204 
1 1 1 19  16 9  o 84.86688 3.944831 88.70999       8.136037 86.57458       11.81786 90.63405       11.21776 83.29971 5.859204 85.38179 5.419409 -2.082077      7.981244 
1 1 1 19  16 10 o 34.67524 6.224377 15.43022       5.066313 16.32160       6.757861 14.28630       7.655503 35.23069 8.048204 32.87008 9.197454 2.360603       12.22157 
1 1 1 19  16 11 o 135.5876 4.008381 226.7620       13.22964 237.3056       20.90483 219.7182       17.08651 137.5168 6.254507 132.8655 5.287778 4.651337       8.190206 
1 1 1 19  16 12 o 34.51296 6.269771 15.39274       5.078981 16.39138       6.797063 14.13019       7.642580 35.11149 8.107711 32.47398 9.225860 2.637508       12.28216 
1 1 1 19  16 13 o 22.35719 7.323550 6.222649       4.600547 16.76316       6.569390 -3.921569      6.444713 35.49517 7.807498 15.97217 7.320856 19.52300       10.70290 
1 1 1 19  16 14 o 64.73596 4.382446 52.31627       6.872755 51.80723       9.795005 52.80992       9.645799 63.56671 6.410714 64.26783 6.237317 -0.7011223     8.944348 
1 1 1 19  16 15 o 15.63059 6.604652 0.6286109      4.323611 0.8695294      5.596269 0.2718764      6.809826 17.68582 7.495470 18.82252 8.128335 -1.136700      11.05676 
1 1 1 19  16 16 o 24.16397 7.521206 7.749621       4.900504 8.757996       6.280102 6.179673       7.836073 25.74414 8.561955 24.10897 9.345097 1.635174       12.67430 
1 1 1 19  16 17 o 63.88132 4.899387 51.95373       7.568755 54.84356       10.24887 48.48701       11.22533 64.54212 6.609478 59.72501 7.906750 4.817112       10.30543 
1 1 1 19  16 18 o 37.82061 8.259723 20.27091       7.398830 0.000000       0.000000 20.27091       7.398830 ?        ?        37.82061 8.259723 0.000000       8.259723 
1 1 1 19  16 19 o 34.48568 8.346732 17.32693       6.938146 0.000000       0.000000 17.32693       6.938146 ?        ?        34.48568 8.346732 0.000000       8.346732 
1 1 1 19  16 20 o 17.89580 7.002358 3.348148       4.432624 4.428384       6.522389 2.421041       6.042440 20.64308 8.355106 18.62840 7.836099 2.014679       11.45479 
1 1 1 19  16 21 o 18.30152 7.003469 3.972215       4.361173 -1.751603      6.199106 9.581240       6.136628 15.80805 7.220836 25.09725 8.465289 -9.289202      11.12662 
1 1 1 19  16 22 o 54.37677 4.857981 39.43562       6.369592 49.85632       9.986159 32.28814       8.270402 58.40335 7.166609 46.50094 7.557690 11.90241       10.41532 
1 1 1 19  16 23 o 14.41428 6.365439 0.2650601      4.383901 3.035270       6.402287 -2.180406      6.015333 18.42641 7.918532 14.90516 6.917170 3.521255       10.51429 
1 1 1 19  16 24 o 32.17989 7.900549 16.90313       6.149145 20.17977       8.989020 14.02119       8.430258 31.92532 10.21944 26.81325 9.843904 5.112074       14.18941 
1 1 1 19  16 25 o 14.77537 6.695186 -0.9513202E-03 5.197156 5.178968       7.610670 -4.527105      7.114200 19.63150 8.534781 14.56262 6.981335 5.068877       11.02640 
1 1 1 19  16 26 o 22.20202 9.160522 10.14998       8.028606 0.000000       0.000000 10.14998       8.028606 ?        ?        22.20202 9.160522 0.000000       9.160522 
1 1 1 19  16 27 o 16.91335 7.949229 1.606097       8.366217 1.606097       8.366217 0.000000       0.000000 16.91335 7.949229 ?        ?        0.000000       7.949229 
1 1 1 19  16 28 o 15.13679 6.860102 1.880090       5.459098 3.815496       7.786327 0.8937581E-02  7.655984 17.11651 7.917743 15.47799 7.371162 1.638516       10.81779 
1 1 1 19  16 29 o 22.89262 8.449520 12.34521       6.224881 4.514499       9.052835 19.36838       8.573345 17.11427 8.111394 25.64831 9.818303 -8.534042      12.73553 
1 1 1 19  17 0  o 41.01814 3.836376 20.77863       3.790228 21.14561       7.721756 20.66214       4.350364 40.53362 8.100916 40.80803 4.446491 -0.2744026     9.241002 
1 1 1 19  17 1  f 72.27624 3.665792 64.11091       6.435450 0.000000       0.000000 64.11091       6.435450 ?        ?        72.27624 3.665792 0.000000       3.665792 
1 1 1 19  17 2  o 150.2862 3.691765 276.5729       13.52039 275.0075       22.43051 277.4662       16.94462 149.0683 6.188184 150.2444 4.633583 -1.176071      7.730699 
1 1 1 19  17 3  o 163.8062 3.752050 328.7216       14.97735 312.5028       24.57349 338.3075       18.89190 158.7870 6.363503 165.8639 4.678664 -7.076874      7.898358 
1 1 1 19  17 4  o 88.60494 2.414130 95.95863       5.207746 94.42001       6.349224 99.12175       9.103633 87.82027 2.971088 89.77828 4.172504 -1.958015      5.122222 
1 1 1 19  17 5  o 27.53113 3.590940 9.442529       2.351815 10.95000       2.744500 5.276195       4.562635 29.62969 3.895272 21.37063 7.298302 8.259058       8.272748 
1 1 1 19  17 6  o 74.25551 2.498303 67.46048       4.514307 69.76221       5.102897 59.17389       9.682265 75.47667 2.779138 68.89709 5.821290 6.579582       6.450661 
1 1 1 19  17 7  o 41.22636 5.301211 21.34215       5.202693 31.07388       7.705162 13.18715       7.053402 49.54941 6.540867 31.76075 8.806668 17.78866       10.96997 
1 1 1 19  17 8  o 43.10346 5.077314 23.27557       5.230937 23.66384       7.275714 22.86014       7.525952 42.89762 7.215829 42.02514 7.629718 0.8724861      10.50147 
1 1 1 19  17 9  o 70.07600 4.214023 60.72969       7.162936 67.41863       10.54046 54.99005       9.763895 73.32775 5.949756 66.12033 6.129486 7.207420       8.542259 
1 1 1 19  17 10 o 74.46815 4.171303 68.62489       7.539440 64.75323       10.80739 72.29551       10.52305 71.64494 6.252707 75.93199 5.729235 -4.287056      8.480594 
1 1 1 19  17 11 o 12.38285 5.759671 -3.602335      4.207275 -6.205609      5.411991 0.3741121      6.688747 13.20840 6.263539 19.00153 8.128254 -5.793136      10.26160 
1 1 1 19  17 12 o 117.8585 4.629688 172.8060       13.27098 175.8894       17.92684 169.0674       19.73988 117.9104 6.261459 115.0097 7.077547 2.900734       9.449738 
1 1 1 19  17 13 o 28.54836 7.469043 10.88701       5.254946 11.70090       6.739212 9.624536       8.393377 29.48980 8.748638 27.84068 9.874342 1.649120       13.19247 
1 1 1 19  17 14 o 21.81971 7.618691 5.742972       4.982574 5.975943       6.490328 5.408620       7.775327 23.14676 8.612113 23.64532 9.267616 -0.4985619     12.65137 
1 1 1 19  17 15 o 49.48202 7.051404 32.37260       8.262442 0.000000       0.000000 32.37260       8.262442 ?        ?        49.48202 7.051404 0.000000       7.051404 
1 1 1 19  17 16 o 25.12943 8.453154 8.399739       6.119158 0.000000       0.000000 8.399739       6.119158 ?        ?        25.12943 8.453154 0.000000       8.453154 
1 1 1 19  17 17 o 57.75007 4.923027 42.72530       6.862213 47.46114       9.381107 37.27475       10.06412 59.81012 6.543038 51.72605 8.262016 8.084068       10.53908 
1 1 1 19  17 18 o 43.30368 5.256663 24.51059       5.433698 40.28093       8.491308 13.57469       7.071009 54.75507 6.489810 30.29002 8.955165 24.46506       11.05950 
1 1 1 19  17 19 o 49.64449 4.789803 32.02234       5.722754 40.44087       8.907200 26.10441       7.468061 54.13642 6.908964 43.01546 7.390629 11.12096       10.11707 
1 1 1 19  17 20 o 15.08667 6.481017 0.7556001      4.285892 0.3302097      6.281091 1.126224       5.862836 17.21750 7.610610 17.29895 7.506043 -0.8145142E-01 10.68934 
1 1 1 19  17 21 o 30.93212 6.818436 13.93644       5.000978 21.83598       8.015476 8.901388       6.399270 36.80239 9.010970 24.04015 8.611571 12.76225       12.46422 
1 1 1 19  17 22 o 20.37432 7.242104 6.042497       4.517128 11.27006       6.611305 1.465543       6.186228 25.96017 8.786511 17.29753 7.603041 8.662634       11.61934 
1 1 1 19  17 23 o 18.34404 7.196684 4.418061       4.692443 6.015502       6.565588 2.750087       6.708969 20.57520 8.362528 18.26938 7.976796 2.305811       11.55687 
1 1 1 19  17 24 o 23.83316 8.365067 9.959813       6.011519 18.94245       8.404196 0.5484605      8.602412 30.88465 9.880901 17.93688 8.306015 12.94777       12.90822 
1 1 1 19  17 25 o 39.05624 10.60693 32.51659       10.35390 32.51659       10.35390 0.000000       0.000000 39.05624 10.60693 ?        ?        0.000000       10.60693 
1 1 1 19  17 26 o 17.54878 7.521005 4.296906       5.746506 14.19465       8.951709 -2.640930      7.494623 24.12319 9.779257 15.02356 7.192496 9.099629       12.13943 
1 1 1 19  17 27 o 17.78720 7.602348 5.265754       5.842234 9.159684       8.900065 2.317484       7.744310 20.10800 8.963940 16.68382 7.778317 3.424177       11.86821 
1 1 1 19  17 28 o 23.14816 8.372664 11.98522       6.066236 22.99704       9.657210 4.808316       7.796343 27.36848 10.43426 17.35871 7.991424 10.00977       13.14293 
1 1 1 19  17 29 o 12.65649 6.090097 -2.426656      5.529309 -8.267163      8.135338 2.587696       7.538027 12.93112 6.444821 15.88278 7.489756 -2.951657      9.880898 
1 1 1 19  18 0  o 212.8968 5.340736 558.5288       27.68620 0.000000       0.000000 558.5288       27.68620 ?        ?        212.8968 5.340736 0.000000       5.340736 
1 1 1 19  18 1  o 51.57417 4.574633 32.92580       5.689850 28.64611       8.065107 37.16656       8.028345 47.50595 7.191393 54.49549 6.152927 -6.989532      9.464388 
1 1 1 19  18 2  f 40.73499 3.984353 20.54125       3.904617 23.59047       7.186382 19.26403       4.651036 43.02245 7.102149 39.25856 4.973011 3.763889       8.670142 
1 1 1 19  18 3  o 91.92737 3.004549 103.4843       6.721658 103.7605       11.93208 103.3559       8.135293 91.55038 5.371955 91.76208 3.645347 -0.2117004     6.492031 
1 1 1 19  18 4  o 60.67056 2.651070 45.08319       3.910080 43.91606       5.130770 46.70008       6.038945 59.75690 3.539222 61.54241 4.049207 -1.785515      5.377934 
1 1 1 19  18 5  o 33.58190 2.989899 13.91091       2.421239 14.52718       2.825133 12.20591       4.699089 34.25911 3.430050 30.77374 6.471671 3.485378       7.324464 
1 1 1 19  18 6  o 22.72484 4.848766 6.610426       2.603277 7.000667       2.821929 4.380944       6.744995 23.36260 5.100080 22.43892 8.677634 0.9236736      10.06539 
1 1 1 19  18 7  o 31.11214 6.660414 12.54624       4.897346 7.853800       6.102815 21.03346       8.207550 25.36863 8.440328 39.94204 8.680749 -14.57341      12.10762 
1 1 1 19  18 8  o 33.47409 6.655549 14.51580       5.237889 21.26660       6.965790 5.732486       7.945512 40.49289 7.328940 24.60709 9.443830 15.88580       11.95405 
1 1 1 19  18 9  o 62.73129 4.852963 49.06234       7.361043 47.03234       9.639951 51.90140       11.40023 60.82722 6.609540 63.56546 7.504122 -2.738243      9.999894 
1 1 1 19  18 10 o 41.11894 9.642382 22.96321       9.493411 0.000000       0.000000 22.96321       9.493411 ?        ?        41.11894 9.642382 0.000000       9.642382 
1 1 1 19  18 11 o 13.44072 6.421288 -7.470517      5.906773 0.000000       0.000000 -7.470517      5.906773 ?        ?        13.44072 6.421288 0.000000       6.421288 
1 1 1 19  18 12 o 43.85461 7.657340 25.46593       7.885723 0.000000       0.000000 25.46593       7.885723 ?        ?        43.85461 7.657340 0.000000       7.657340 
1 1 1 19  18 13 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 19  18 14 o 34.69430 6.220344 15.83847       5.065871 16.37068       7.149864 15.30196       7.178668 34.33135 8.572674 33.12608 8.760077 1.205276       12.25682 
1 1 1 19  18 15 o 36.82202 5.874597 17.77595       5.094333 20.72212       7.204655 14.83007       7.204296 38.82467 7.884445 32.34544 8.873834 6.479229       11.87053 
1 1 1 19  18 16 o 50.23708 4.871418 32.33498       5.888936 42.18275       8.799508 24.34662       7.925344 56.41074 6.521119 41.78466 8.075564 14.62609       10.37978 
1 1 1 19  18 17 o 23.69678 7.214855 7.758118       4.539761 6.001515       6.234324 9.741019       6.623738 22.25961 8.407363 26.21449 8.794569 -3.954880      12.16668 
1 1 1 19  18 18 o 63.92257 4.957617 53.06298       7.662270 56.36772       10.31851 49.00064       11.44028 64.33155 6.679075 58.38605 8.271992 5.945503       10.63183 
1 1 1 19  18 19 o 48.99270 5.502036 32.09243       6.455484 32.18401       8.681904 31.97919       9.654167 47.05085 7.848303 45.79065 8.972729 1.260208       11.92081 
1 1 1 19  18 20 o 15.83088 6.583727 1.845493       4.192804 5.746399       6.671231 -0.7013813     5.390473 21.29624 8.508617 15.34336 6.897610 5.952882       10.95325 
1 1 1 19  18 21 o 25.85969 7.263710 10.20090       4.765120 18.61353       7.364378 4.142086       6.249766 33.58290 8.868808 19.37559 8.046302 14.20731       11.97492 
1 1 1 19  18 22 o 25.45183 8.753456 11.04818       6.566352 20.51751       8.019711 -8.211818      11.43740 34.19394 9.355172 17.50123 8.502067 16.69271       12.64138 
1 1 1 19  18 23 o 15.70221 7.065031 0.3841341      5.669075 1.385389       6.655996 -2.261301      10.81905 17.16451 7.694578 18.38355 8.757041 -1.219038      11.65729 
1 1 1 19  18 24 o 38.26674 7.669088 24.10028       6.902240 36.80597       10.18034 13.29084       9.389977 44.05650 9.741400 24.68453 10.01251 19.37196       13.96944 
1 1 1 19  18 25 o 14.80948 6.747335 0.3587581      5.368215 -5.684818      7.265601 7.624223       7.966292 13.93197 6.770021 20.43496 8.807848 -6.502994      11.10907 
1 1 1 19  18 26 o 22.05429 8.337961 10.01512       6.135276 17.68020       9.220469 3.924924       8.218840 25.68770 10.08500 17.80080 8.198624 7.886902       12.99710 
1 1 1 19  18 27 o 29.72827 8.720071 18.68072       6.726811 23.95679       10.51227 15.02227       8.753656 27.33020 10.75665 23.28948 9.582703 4.040726       14.40603 
1 1 1 19  18 28 o 15.94071 7.076278 3.606934       5.487032 14.55096       8.278007 -4.969744      7.328189 22.52643 9.298767 13.32777 6.544629 9.198661       11.37098 
1 1 1 19  19 0  o 131.2360 3.454021 211.0743       11.03663 207.5500       19.33058 212.7787       13.44306 129.3247 6.151401 131.5838 4.197738 -2.259140      7.447197 
1 1 1 19  19 1  o 202.4719 5.318557 506.2224       26.21914 530.1578       36.68252 481.2223       37.48958 205.9924 7.319181 195.8640 7.870551 10.12842       10.74784 
1 1 1 19  19 2  o 83.02125 3.191552 84.51305       6.444922 83.94164       11.03525 84.80885       7.939719 82.22263 5.539838 83.03133 3.935180 -0.8087082     6.795252 
1 1 1 19  19 3  o 58.16975 3.390608 41.60735       4.785464 43.11569       7.659442 40.64159       6.128916 58.81520 5.404435 57.30494 4.423106 1.510262       6.983680 
1 1 1 19  19 4  o 32.42136 3.813814 13.08218       2.955624 15.62723       3.819461 9.283367       4.666359 35.33587 4.540381 26.76211 7.056009 8.573753       8.390610 
1 1 1 19  19 5  o 41.44113 2.730002 21.10694       2.741606 21.30957       3.361321 20.70424       4.738597 41.55100 3.347972 40.65879 4.879947 0.8922157      5.918007 
1 1 1 19  19 6  o 23.16446 8.632039 5.477428       6.525265 0.000000       0.000000 5.477428       6.525265 ?        ?        23.16446 8.632039 0.000000       8.632039 
1 1 1 19  19 7  o 39.47649 8.137026 20.52090       7.567476 0.000000       0.000000 20.52090       7.567476 ?        ?        39.47649 8.137026 0.000000       8.137026 
1 1 1 19  19 8  o 72.34734 5.673248 65.73310       9.922132 0.000000       0.000000 65.73310       9.922132 ?        ?        72.34734 5.673248 0.000000       5.673248 
1 1 1 19  19 9  o 52.54573 4.803835 34.57066       6.083251 38.98846       8.426513 29.76230       8.791099 55.29299 6.370048 47.66263 7.841278 7.630356       10.10263 
1 1 1 19  19 10 o 72.12699 4.682839 64.97061       8.186327 67.11409       10.76351 62.02925       12.60863 72.68983 6.133549 69.11337 7.612259 3.576454       9.775833 
1 1 1 19  19 11 o 89.85149 4.507605 100.7606       9.838253 88.69791       12.59554 119.6360       15.75587 83.37947 6.244354 96.55020 6.738887 -13.17073      9.187195 
1 1 1 19  19 12 o 79.96935 4.580577 80.15214       8.889131 84.15525       11.87163 75.04366       13.41089 81.12316 6.048765 75.73460 7.359210 5.388557       9.526045 
1 1 1 19  19 13 o 77.35997 4.681178 75.38182       8.783557 80.27322       11.97255 69.68053       12.92580 78.82760 6.284644 72.61958 7.407741 6.208015       9.714494 
1 1 1 19  19 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 19  19 15 o 25.04483 7.157312 8.601054       4.586281 14.08649       6.660216 3.654304       6.324741 31.43233 8.494726 20.44237 8.244093 10.98996       11.83746 
1 1 1 19  19 16 o 25.37975 7.086308 8.962790       4.549649 10.06419       6.499074 7.904313       6.371181 26.58230 8.704296 24.24840 8.602728 2.333902       12.23812 
1 1 1 19  19 17 o 11.87472 5.524871 -2.858454      3.875482 -2.793572      5.751664 -2.912406      5.244848 14.95228 6.876436 14.14517 6.527300 0.8071165      9.481088 
1 1 1 19  19 18 o 38.90293 6.012544 20.63849       5.516423 39.20985       8.697769 8.140922       7.135081 53.01579 6.895582 24.05490 9.013755 28.96090       11.34887 
1 1 1 19  19 19 o 27.71889 7.280546 11.37607       4.980284 19.72452       7.627905 5.173014       6.575142 35.32079 8.874428 20.84420 8.405859 14.47659       12.22350 
1 1 1 19  19 20 o 38.40656 7.958474 22.70211       7.203537 28.70662       9.043549 12.27959       11.91479 41.98002 9.102921 26.35270 11.03924 15.62732       14.30832 
1 1 1 19  19 21 o 21.31366 8.294820 6.697908       6.192852 12.84176       7.599198 -5.450002      10.68558 26.92340 9.408313 17.86006 8.560523 9.063347       12.72002 
1 1 1 19  19 22 o 11.76511 5.578815 -3.488495      4.292267 5.998784       6.927477 -9.400256      5.468431 20.53015 8.493629 11.16623 5.515718 9.363911       10.12743 
1 1 1 19  19 23 o 17.48359 7.181890 3.822791       4.906329 5.470089       7.503181 2.592285       6.484868 19.85025 8.551844 17.53122 7.741907 2.319033       11.53565 
1 1 1 19  19 24 o 22.25674 8.049183 8.999414       5.606315 10.95831       7.874875 6.986209       7.983289 23.03708 9.230750 20.28685 8.780808 2.750227       12.74007 
1 1 1 19  19 25 o 40.54736 7.458726 28.05750       7.098435 35.56180       10.55739 21.86590       9.589652 39.11667 10.74649 29.01878 10.52270 10.09789       15.04042 
1 1 1 19  19 26 o 17.11234 7.350109 4.487717       5.510860 0.3424534      7.761665 8.701765       7.825798 15.85005 7.511768 19.99418 8.673796 -4.144135      11.47438 
1 1 1 19  19 27 o 23.28432 8.348035 12.07260       6.014994 8.866953       8.809420 14.87232       8.232799 19.27905 8.728254 23.19340 9.387056 -3.914351      12.81793 
1 1 1 19  20 0  o 30.68159 5.151044 11.92568       3.714968 12.79625       7.299388 11.62136       4.315712 31.37904 9.049033 30.08558 6.095618 1.293465       10.91062 
1 1 1 19  20 1  o 71.80964 4.000269 63.55074       6.972496 66.73789       10.00159 60.53717       9.725401 73.18938 5.651449 69.64997 5.782033 3.539406       8.085220 
1 1 1 19  20 2  o 148.9975 3.556641 272.4091       12.91384 254.0615       21.33113 283.0240       16.22499 142.7782 6.145168 151.5302 4.398547 -8.751923      7.557136 
1 1 1 19  20 3  o 131.9967 2.757645 213.2564       8.870287 205.2092       13.05845 220.1505       12.08678 129.0464 4.157929 133.8183 3.710037 -4.771942      5.572499 
1 1 1 19  20 4  o 32.81680 3.737245 13.40581       2.935518 16.47116       4.048848 10.00878       4.262267 36.22209 4.697455 27.76072 6.427375 8.461365       7.960982 
1 1 1 19  20 5  o 48.90438 2.832154 29.39908       3.360769 30.40267       4.439457 28.05188       5.143598 49.58340 3.700849 47.44609 4.502563 2.137310       5.828323 
1 1 1 19  20 6  o 25.91559 6.604821 8.767977       4.182776 12.43680       5.813029 4.829004       6.023247 30.68224 7.768284 21.99144 8.273037 8.690807       11.34854 
1 1 1 19  20 7  o 101.8843 3.860588 128.1953       9.567767 135.6963       14.90928 122.9434       12.47544 103.9046 5.912646 99.24388 5.176302 4.660736       7.858339 
1 1 1 19  20 8  o 94.97764 3.942826 111.6353       9.105830 132.6443       14.40961 97.66822       11.74904 102.6540 5.783627 88.18253 5.494740 14.47149       7.977625 
1 1 1 19  20 9  f 58.27633 4.411505 42.41351       6.218380 45.79301       9.225297 39.59943       8.418244 59.77509 6.434431 55.58949 6.326761 4.185600       9.023846 
1 1 1 19  20 10 f 46.25347 5.068792 27.10835       5.619805 32.04429       7.908300 22.07306       7.987501 49.66670 6.705156 40.37145 8.393055 9.295246       10.74256 
1 1 1 19  20 11 o 43.06217 5.431823 23.75120       5.573472 29.18617       8.068307 18.79059       7.708180 46.96634 7.285388 36.90294 8.712127 10.06341       11.35685 
1 1 1 19  20 12 o 37.26541 5.903090 18.11911       5.182263 26.37211       7.493612 10.55415       7.174455 44.49927 7.152721 27.88774 9.146174 16.61153       11.61094 
1 1 1 19  20 13 o 46.44604 5.132676 27.68122       5.712567 30.05668       8.202750 25.44411       7.960283 47.23763 7.366026 43.11009 7.867071 4.127537       10.77725 
1 1 1 19  20 14 o 54.06727 5.185009 37.65468       6.747936 38.95253       8.930670 35.92782       10.30151 53.87816 6.964767 50.48910 8.685904 3.389061       11.13341 
1 1 1 19  20 15 o 26.56566 7.103820 9.846891       4.687872 15.66886       6.906921 4.874196       6.383301 32.81286 8.552250 21.33376 8.386477 11.47910       11.97806 
1 1 1 19  20 16 o 14.10051 6.257969 -0.6972796     4.288926 3.375207       6.333493 -4.146589      5.828804 19.81646 8.152109 14.36030 6.712521 5.456164       10.56006 
1 1 1 19  20 17 o 30.54782 8.282063 14.03024       6.318881 15.08116       7.423351 11.26560       12.04022 31.06825 9.173063 27.50550 11.26932 3.562754       14.53075 
1 1 1 19  20 18 o 41.02391 7.396256 24.49988       7.122138 35.77926       8.793072 2.985224       12.14409 49.59972 7.509584 22.75388 10.27982 26.84584       12.73062 
1 1 1 19  20 19 o 25.55355 7.479086 9.963270       4.953103 17.14989       7.446708 4.261147       6.633158 32.14960 9.097823 19.84751 8.269705 12.30209       12.29465 
1 1 1 19  20 20 o 18.18982 7.073539 4.174958       4.500732 2.015690       6.664817 5.985125       6.102309 18.03502 7.910535 20.71785 8.182729 -2.682825      11.38128 
1 1 1 19  20 21 o 46.00109 5.554483 29.71286       6.100647 47.33819       9.996631 19.25316       7.700958 55.17154 7.640176 32.94762 9.226735 22.22392       11.97935 
1 1 1 19  20 22 o 19.62500 7.396085 5.876781       4.818768 9.022376       7.147148 3.255130       6.524826 22.60486 8.877721 18.10307 7.885991 4.501783       11.87446 
1 1 1 19  20 23 o 21.32881 7.758248 7.847168       5.218350 18.87548       8.701468 1.653132       6.521160 29.36915 10.07744 16.70723 7.541906 12.66192       12.58710 
1 1 1 19  20 24 o 19.83480 7.711920 6.927895       5.349055 10.49683       8.484859 4.573939       6.890880 21.95846 9.264022 18.17804 8.005967 3.780418       12.24408 
1 1 1 19  20 25 o 14.27769 6.623938 -0.1318273     5.509673 2.992808       7.653022 -3.493948      7.938528 17.10377 7.889730 14.74514 7.144379 2.358626       10.64378 
1 1 1 19  20 26 o 20.17178 8.038412 8.540576       5.938840 13.48760       8.869851 4.520690       7.995598 22.11735 9.407464 17.46498 8.059225 4.652367       12.38755 
1 1 1 19  20 27 o 14.49264 6.740875 0.8712800      5.762427 5.156595       8.816851 -2.324143      7.613534 17.43722 8.184411 14.33933 6.959219 3.097885       10.74315 
1 1 1 19  21 0  o 124.9121 3.470838 191.6254       10.55489 204.1351       18.46921 185.5582       12.86221 127.9674 5.938804 122.6550 4.309925 5.312340       7.337905 
1 1 1 19  21 1  o 50.66032 5.788020 32.31341       7.017442 40.92188       8.382574 12.14891       12.82946 56.97922 6.133538 32.73362 12.12152 24.24560       13.58498 
1 1 1 19  21 2  o 40.11115 3.760414 19.95525       3.632814 17.07834       6.457262 21.28749       4.394177 36.13652 7.575313 41.30254 4.435210 -5.166019      8.778180 
1 1 1 19  21 3  o 109.8041 2.802133 147.8128       7.491837 148.7012       10.48390 146.8857       10.70982 109.8116 3.924075 109.1010 4.035211 0.7106094      5.628614 
1 1 1 19  21 4  o 129.9867 2.726230 207.0264       8.635701 211.9342       12.84605 202.9798       11.66469 131.0287 4.027940 128.3456 3.733516 2.683121       5.492125 
1 1 1 19  21 5  o 49.59405 3.553667 30.42355       4.266328 34.92162       7.986007 28.62712       5.046866 52.33174 6.394916 47.91441 4.370406 4.417336       7.745670 
1 1 1 19  21 6  o 57.60069 4.483141 41.37490       6.243312 49.90787       9.067353 33.68244       8.609205 62.75460 6.002299 51.03060 7.116326 11.72400       9.309656 
1 1 1 19  21 7  o 42.84956 5.383218 23.32359       5.497391 33.97894       7.873168 13.18623       7.679420 51.44585 6.419344 31.26125 9.354788 20.18460       11.34548 
1 1 1 19  21 8  o 39.62371 5.313221 20.02029       5.001191 17.21749       6.686006 23.58050       7.535445 35.80929 7.876410 42.17138 7.612610 -6.362087      10.95398 
1 1 1 19  21 9  o 53.76702 4.757224 36.41667       6.168873 46.65991       9.136083 27.83308       8.363262 60.20329 6.321543 45.68760 7.790975 14.51570       10.03301 
1 1 1 19  21 10 o 32.24156 6.176072 13.68275       4.675875 17.33742       6.666562 10.14389       6.560095 35.69809 7.875065 27.44425 8.724230 8.253838       11.75282 
1 1 1 19  21 11 o 33.65908 6.004903 14.90135       4.744740 12.82564       6.536875 17.21261       6.897815 30.35613 8.500751 35.27933 8.182394 -4.923199      11.79891 
1 1 1 19  21 12 o 27.32612 6.940014 10.17502       4.629407 16.56445       6.569173 3.871242       6.524992 34.52055 7.970200 20.92693 8.396540 13.59361       11.57696 
1 1 1 19  21 13 o 55.53172 5.720562 40.21390       7.630704 49.62144       9.313078 20.99749       13.31041 61.30700 6.324377 36.01255 12.45937 25.29445       13.97260 
1 1 1 19  21 14 o 14.40988 6.587655 -2.431606      5.173640 -5.803238      5.781471 11.12132       11.59137 13.59846 6.455854 28.47326 11.26764 -14.87481      12.98606 
1 1 1 19  21 15 o 30.08774 8.390780 13.37486       6.382962 20.03868       7.433613 -5.328022      12.45354 36.92599 8.444989 20.78230 9.745711 16.14369       12.89561 
1 1 1 19  21 16 o 29.11303 7.350148 12.29159       5.214545 22.13890       8.196364 5.595668       6.758773 37.97351 8.996361 21.67757 8.595838 16.29594       12.44279 
1 1 1 19  21 17 o 30.19885 6.888383 13.17623       4.956690 20.26506       7.475842 7.615341       6.621324 36.16946 8.606933 23.08954 8.676633 13.07991       12.22143 
1 1 1 19  21 18 o 35.31009 7.286275 18.52174       6.061564 25.54601       8.450118 11.07584       8.700038 39.90105 8.915347 25.79140 9.886190 14.10965       13.31241 
1 1 1 19  21 19 o 16.07576 6.779303 1.952691       4.540653 15.75514       7.226187 -7.052696      5.836900 30.42460 9.067430 12.62674 6.119897 17.79786       10.93944 
1 1 1 19  21 20 o 19.16231 7.332119 5.128212       4.779765 3.167276       7.058161 6.789220       6.495994 18.80245 8.196131 21.24809 8.426585 -2.445641      11.75517 
1 1 1 19  21 21 o 10.27394 5.025906 -6.314325      4.197501 -13.53359      6.152060 -0.2644986E-01 5.741508 10.90335 5.459846 15.48440 7.024659 -4.581056      8.896952 
1 1 1 19  21 22 o 23.86615 7.433562 9.612710       4.786074 11.44186       7.715654 8.468689       6.101892 23.92547 9.273275 21.84121 8.301908 2.084255       12.44650 
1 1 1 19  21 23 o 15.63262 6.832853 2.134828       4.934177 1.583321       7.819354 2.499731       6.360396 17.13845 7.930217 16.81658 7.531465 0.3218651      10.93670 
1 1 1 19  21 24 o 12.39140 5.846718 -2.074075      4.605626 -7.028055      7.009384 1.689677       6.109608 13.01945 6.394726 15.81669 7.203122 -2.797247      9.632107 
1 1 1 19  21 25 o 16.81921 7.369365 4.063737       5.770271 -2.778570      8.316567 10.41518       8.012704 15.01721 7.284753 20.91709 8.920603 -5.899877      11.51715 
1 1 1 19  21 26 o 17.85802 8.181850 5.878686       8.038577 0.000000       0.000000 5.878686       8.038577 ?        ?        17.85802 8.181850 0.000000       8.181850 
1 1 1 19  22 0  o 61.85168 3.146565 47.05779       4.727103 45.00991       9.160547 47.80102       5.518632 59.60841 6.406796 62.23765 3.654751 -2.629234      7.375924 
1 1 1 19  22 1  o 46.16183 4.707903 26.64733       5.221930 26.80295       7.081983 26.46190       7.730393 45.77065 6.534683 45.23085 7.258920 0.5397987      9.766986 
1 1 1 19  22 2  o 61.65303 3.398733 46.86761       5.086558 55.64672       8.660968 42.24520       6.284575 66.63266 5.379576 58.27143 4.459608 8.361225       6.987700 
1 1 1 19  22 3  f 26.77378 4.116388 9.052944       2.599860 11.08460       3.750701 7.173968       3.607020 29.36582 5.441579 23.47282 6.210603 5.893005       8.257261 
1 1 1 19  22 4  o 82.00721 2.651126 82.54018       5.291117 79.89230       7.222571 85.60724       7.773281 80.40501 3.696033 83.18946 3.844820 -2.784447      5.333226 
1 1 1 19  22 5  o 110.5386 2.582808 149.8372       6.957325 147.5688       9.880111 152.0683       9.798682 109.2652 3.716006 110.9568 3.628794 -1.691605      5.193923 
1 1 1 19  22 6  o 62.81260 4.306351 49.22386       6.551743 51.19002       9.580061 47.49624       8.980135 63.23952 6.300196 60.97486 6.126541 2.264656       8.787888 
1 1 1 19  22 7  f 52.50077 4.711085 34.68651       5.963286 52.80528       9.218244 21.64766       7.819941 64.30640 5.949898 39.99451 8.295842 24.31189       10.20893 
1 1 1 19  22 8  o 36.65188 5.955470 17.47147       5.136795 17.40248       6.898130 17.55734       7.696282 35.72515 8.109694 35.57578 8.900385 0.1493759      12.04093 
1 1 1 19  22 9  o 24.27238 7.744208 7.771750       5.165196 7.737527       5.649716 7.945997       12.74813 24.38993 8.121130 28.40149 11.61144 -4.011559      14.16962 
1 1 1 19  22 10 o 26.79834 7.871788 9.835552       5.478395 14.05682       6.105988 -7.590518      12.40607 31.88274 7.899694 20.93006 9.786556 10.95269       12.57704 
1 1 1 19  22 11 f 35.20883 7.610470 17.11064       6.339101 23.85725       7.211311 -5.828008      13.29704 41.90210 7.328993 22.09697 10.26488 19.80513       12.61276 
1 1 1 19  22 12 o 29.74747 6.857241 12.16398       4.869044 13.33097       6.741574 10.89145       7.039842 30.38909 8.675355 27.65157 9.059468 2.737522       12.54335 
1 1 1 19  22 13 f 39.33648 5.604514 20.46224       5.220635 32.31753       7.790073 10.79685       7.033886 48.81452 6.727417 27.28568 9.060833 21.52884       11.28525 
1 1 1 19  22 14 o 35.69635 6.199532 17.35134       5.197301 20.02502       7.612507 15.01697       7.113072 36.69857 8.653889 31.53895 8.880172 5.159620       12.39949 
1 1 1 19  22 15 o 25.09258 7.420498 9.148650       4.854603 9.333540       7.039534 8.980983       6.703664 25.14390 9.029081 24.76085 8.820244 0.3830547      12.62224 
1 1 1 19  22 16 o 32.80187 6.591005 15.29925       5.085480 16.75399       7.553232 14.09299       6.878007 32.23515 9.176346 29.79634 8.837940 2.438816       12.74027 
1 1 1 19  22 17 o 20.59244 7.136300 6.050834       4.367400 5.019003       6.208355 7.061715       6.145005 20.26035 8.168879 22.09655 8.346664 -1.836193      11.67893 
1 1 1 19  22 18 o 28.79494 6.990500 12.45328       4.855319 12.68979       7.475162 12.28069       6.385734 27.10466 9.338892 27.27218 8.599808 -0.1675167     12.69534 
1 1 1 19  22 19 o 15.20817 6.556208 1.276050       4.415466 2.978989       6.617467 -0.9055706E-01 5.928080 18.43297 7.986392 15.89350 7.181155 2.539473       10.74018 
1 1 1 19  22 20 o 46.73726 5.600373 31.01835       6.251607 34.27917       9.970053 28.90557       8.025292 43.57660 9.644101 42.04814 8.126174 1.528458       12.61124 
1 1 1 19  22 21 o 12.94624 5.957108 -1.185512      4.324742 -9.939036      6.925630 4.409677       5.537008 12.59410 6.218471 18.20122 7.567366 -5.607125      9.794612 
1 1 1 19  22 22 o 16.39257 7.160203 2.615191       5.410355 8.353503       8.506251 -1.283475      7.011390 21.01298 9.079433 15.42433 7.258059 5.588656       11.62392 
1 1 1 19  22 23 o 21.38593 8.024159 8.801804       5.658299 10.90400       8.198316 6.889520       7.819224 21.98483 9.179548 19.50099 8.560460 2.483843       12.55172 
1 1 1 19  22 24 o 20.09802 8.446189 8.444007       7.009378 0.000000       0.000000 8.444007       7.009378 ?        ?        20.09802 8.446189 0.000000       8.446189 
1 1 1 19  22 25 o 14.18982 6.645578 -0.1011796     5.758939 -4.567136      8.475439 3.729281       7.849292 14.40581 7.066741 16.99394 7.891691 -2.588124      10.59328 
1 1 1 19  23 0  f 23.78019 5.553191 7.341231       3.159445 6.548260       6.260702 7.612178       3.659621 23.85715 8.521059 24.15527 6.189575 -0.2981186     10.53182 
1 1 1 19  23 1  o 52.73676 5.328367 35.06128       6.753858 41.70509       7.926419 17.45566       12.90310 57.41251 5.742426 35.97392 12.27357 21.43859       13.55049 
1 1 1 19  23 2  o 28.49928 5.258562 10.45024       3.517540 12.76923       5.549026 8.892415       4.548074 30.99427 7.441142 25.97641 7.019479 5.017864       10.22955 
1 1 1 19  23 3  o 38.81590 3.351949 18.69694       3.139578 16.81605       4.273852 20.90173       4.627240 36.40082 4.945880 40.70415 4.754394 -4.303333      6.860466 
1 1 1 19  23 4  o 13.33150 4.921176 1.778330       2.111679 0.1838159      2.590671 4.935083       3.645174 12.03118 5.099434 19.94147 6.518126 -7.910287      8.275880 
1 1 1 19  23 5  o 52.01494 4.784634 34.08935       5.996847 0.000000       0.000000 34.08935       5.996847 ?        ?        52.01494 4.784634 0.000000       4.784634 
1 1 1 19  23 6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 19  23 7  o 54.62596 4.626893 37.65816       6.101324 45.46830       9.133195 31.36358       8.199305 59.15345 6.439709 48.68019 7.122499 10.47326       9.602075 
1 1 1 19  23 8  o 94.12032 4.567464 111.5224       10.44470 132.4351       14.56521 89.38424       14.98586 101.5020 5.914136 81.94880 7.590421 19.55318       9.622448 
1 1 1 19  23 9  o 28.83723 6.914249 11.31496       4.795900 16.44845       6.755774 6.099655       6.809399 34.29967 8.194937 23.11850 8.774074 11.18117       12.00589 
1 1 1 19  23 10 o 74.37850 4.633166 70.28893       8.356018 62.43920       10.66871 82.74603       13.43981 68.79227 6.438909 78.64083 7.089108 -9.848557      9.576796 
1 1 1 19  23 11 f 11.20092 5.302572 -4.021562      3.847283 -6.948007      4.839243 1.005429       6.342513 11.60970 5.613833 18.26957 7.866663 -6.659876      9.664342 
1 1 1 19  23 12 o 39.47255 5.360126 20.51301       5.022825 24.82734       7.328787 16.69151       6.897508 42.17887 7.399920 33.79480 8.409320 8.384071       11.20158 
1 1 1 19  23 13 o 15.60143 6.587981 1.154174       4.297178 3.359236       6.577009 -0.4882600     5.676258 19.90378 8.258972 16.17935 7.188882 3.724430       10.94946 
1 1 1 19  23 14 o 31.38139 7.091821 14.15389       5.295233 21.42334       8.098823 8.725822       6.998318 37.16469 9.032095 24.48757 8.972459 12.67712       12.73121 
1 1 1 19  23 15 o 17.32951 7.015581 2.900454       4.599847 3.659308       6.738620 2.238350       6.294408 19.76432 8.292152 18.36890 7.871917 1.395420       11.43359 
1 1 1 19  23 16 o 19.14251 7.228678 4.777319       4.608297 10.56825       7.208413 0.7747357      5.992879 25.51224 9.139700 16.87881 7.448610 8.633425       11.79050 
1 1 1 19  23 17 o 12.38194 5.743597 -2.265836      4.140211 -2.175386      6.040449 -2.345980      5.685907 15.05218 6.966678 14.53325 6.737847 0.5189295      9.691914 
1 1 1 19  23 18 o 16.60892 6.865092 2.724550       4.520025 7.175541       6.947896 -0.5415425     5.951674 21.73275 8.683176 15.66281 7.123839 6.069941       11.23150 
1 1 1 19  23 19 o 14.74082 6.491458 0.7337397      4.529227 -4.020067      7.174332 3.883872       5.840165 15.04531 7.156723 18.30938 7.702974 -3.264067      10.51449 
1 1 1 19  23 20 o 21.44741 8.061470 7.836715       5.716454 7.640296       8.062389 8.035281       8.106364 21.25310 9.001521 21.51705 9.065170 -0.2639484     12.77516 
1 1 1 19  23 21 o 19.56529 7.636153 6.336244       5.260361 19.80389       8.892350 -0.9137681     6.524392 29.54973 10.18558 15.24625 7.118466 14.30348       12.42652 
1 1 1 19  23 22 o 19.26017 8.066430 6.466333       6.359597 0.000000       0.000000 6.466333       6.359597 ?        ?        19.26017 8.066430 0.000000       8.066430 
1 1 1 19  23 23 o 14.78867 6.608546 1.564457       4.868028 7.453519       8.747288 -1.077804      5.859199 19.47655 8.768512 14.10196 6.635540 5.374581       10.99623 
1 1 1 19  23 24 o 13.42359 6.283290 -0.7319006     5.136367 3.185504       7.883152 -3.621856      6.770897 16.89133 7.865911 13.60665 6.594018 3.284682       10.26419 
1 1 1 19  24 0  o 92.37763 2.906572 104.9706       6.534965 102.6638       12.34550 105.8686       7.702604 90.18436 5.645800 92.60480 3.419120 -2.420448      6.600411 
1 1 1 19  24 1  o 49.29272 3.487274 30.13077       4.161906 35.72578       7.278424 27.41260       5.073125 52.95819 5.731069 46.72750 4.511221 6.230694       7.293578 
1 1 1 19  24 2  o 56.09174 2.737018 38.74723       3.729921 48.27271       5.777078 31.93810       4.884392 62.32315 3.822229 50.59844 3.993654 11.72471       5.527993 
1 1 1 19  24 3  o 24.26650 4.473081 7.563005       2.547716 4.824880       3.613570 10.26937       3.592552 19.70845 6.492435 28.10288 5.442511 -8.394428      8.471873 
1 1 1 19  24 4  o 60.13712 2.704127 44.56371       3.952696 46.84065       5.259201 41.60789       5.992156 61.41900 3.528684 57.61116 4.299154 3.807842       5.561864 
1 1 1 19  24 5  o 13.59696 5.349305 1.445759       2.598841 3.753694       5.034544 0.6073774      3.034374 19.54360 7.513072 13.35262 5.580623 6.190980       9.358932 
1 1 1 19  24 6  o 16.28500 6.560475 1.883654       4.000560 0.5760844      4.947541 4.353297       6.799456 16.42796 7.008010 21.70538 8.616910 -5.277412      11.10690 
1 1 1 19  24 7  o 39.38596 5.451510 20.12139       5.092190 20.81610       7.018894 19.34940       7.399021 39.00286 7.658209 37.20003 8.365512 1.802834       11.34151 
1 1 1 19  24 8  o 41.71423 5.502284 22.65725       5.456979 27.72002       7.896854 18.03003       7.549526 45.10177 7.444461 35.48063 8.779803 9.621140       11.51108 
1 1 1 19  24 9  o 60.33397 5.068598 46.86112       7.383390 59.85993       10.11101 32.01093       10.80709 67.35164 6.231045 46.46422 9.850630 20.88742       11.65594 
1 1 1 19  24 10 o 23.07187 7.268877 7.307893       4.563083 12.96303       6.335416 1.211850       6.577751 29.88987 8.368211 18.60680 8.011539 11.28307       11.58498 
1 1 1 19  24 11 o 73.61095 4.858028 70.01766       8.665704 68.57890       11.61615 71.82317       13.01272 70.96022 6.800692 71.77352 7.552988 -0.8133011     10.16351 
1 1 1 19  24 12 o 20.23086 7.397649 5.235804       4.753565 8.040729       6.813942 2.576465       6.634752 23.98830 8.842670 19.28313 8.166395 4.705166       12.03673 
1 1 1 19  24 13 o 29.10238 7.122558 12.28870       5.009565 13.11639       8.026483 11.76055       6.411662 28.51248 9.681056 27.62105 8.603963 0.8914280      12.95187 
1 1 1 19  24 14 o 30.33456 7.327623 13.65155       5.355422 30.13129       8.535103 2.950270       6.877830 44.67720 8.139251 19.30490 8.249785 25.37230       11.58906 
1 1 1 19  24 15 o 42.48317 5.466484 24.66753       5.528263 30.54177       8.931746 21.01967       7.038481 44.08494 8.623020 36.93276 8.048364 7.152180       11.79545 
1 1 1 19  24 16 o 16.84230 6.932095 2.734012       4.582674 5.094411       6.882294 0.8538548      6.142395 20.39330 8.454079 16.89152 7.493272 3.501783       11.29693 
1 1 1 19  24 17 o 26.27078 8.186167 11.42271       5.803560 17.28887       8.321908 5.868473       8.097632 30.45422 9.840882 21.09938 8.982048 9.354839       13.32367 
1 1 1 19  24 18 o 14.84743 6.684521 0.5872821E-02  5.083657 -1.226161      7.275266 1.181397       7.106459 16.31808 7.584594 17.38805 7.858917 -1.069969      10.92193 
1 1 1 19  24 19 o 22.67549 9.192622 9.632219       7.910180 0.000000       0.000000 9.632219       7.910180 ?        ?        22.67549 9.192622 0.000000       9.192622 
1 1 1 19  24 20 o 16.64385 7.491510 1.905671       6.380890 0.000000       0.000000 1.905671       6.380890 ?        ?        16.64385 7.491510 0.000000       7.491510 
1 1 1 19  24 21 o 17.99744 7.290722 5.074055       4.971401 4.794394       8.698931 5.209695       6.058214 18.74534 8.559181 18.33813 7.786412 0.4072018      11.57099 
1 1 1 19  24 22 f 19.05610 7.558208 6.492236       5.226732 16.96961       8.861645 0.9029255      6.472427 25.57465 9.931029 15.58374 7.212275 9.990908       12.27364 
1 1 1 19  24 23 o 13.65575 6.356866 -0.4086474     5.141223 1.992533       7.967565 -2.121699      6.729743 16.52038 7.762333 14.18487 6.797543 2.335514       10.31796 
1 1 1 19  25 0  o 42.98944 3.475771 22.99344       3.610214 29.40348       7.104660 20.76213       4.191732 47.64052 6.271904 40.60997 4.300992 7.030548       7.604953 
1 1 1 19  25 1  o 27.68863 4.344865 9.779577       2.835257 10.89467       5.472119 9.370368       3.314915 28.34494 7.716567 26.83604 5.257081 1.508900       9.337147 
1 1 1 19  25 2  o 81.35751 3.079365 81.79672       6.094109 86.52695       10.57668 79.44590       7.456204 82.57386 5.283915 79.86704 3.842288 2.706818       6.533217 
1 1 1 19  25 3  o 33.55433 3.433938 14.08749       2.768313 11.91258       3.859592 16.39190       3.972834 30.22676 5.439795 35.85478 4.656832 -5.628019      7.160828 
1 1 1 19  25 4  o 22.91721 3.832798 6.706919       2.064962 8.151728       2.792518 4.963678       3.067393 25.06136 4.746240 19.53735 5.926914 5.524004       7.593096 
1 1 1 19  25 5  o 47.59710 3.588737 28.33963       4.131876 41.08579       7.769573 23.31334       4.879004 56.31146 5.742195 42.71264 4.768737 13.59882       7.464158 
1 1 1 19  25 6  o 22.54559 6.710668 6.839023       3.959949 7.787256       5.088502 5.382901       6.305671 24.00182 7.689527 21.97914 8.418646 2.022680       11.40186 
1 1 1 19  25 7  o 54.52350 4.720349 38.03347       6.210105 52.08068       8.849766 24.40588       8.716579 63.11766 5.819137 41.08538 8.959142 22.03228       10.68310 
1 1 1 19  25 8  o 40.00516 6.150075 21.41562       5.803932 29.78192       7.849517 11.32498       8.620557 46.63391 7.133661 28.01035 9.999468 18.62357       12.28326 
1 1 1 19  25 9  o 17.03712 6.738232 2.701308       4.143186 0.6652904      5.806086 4.813789       5.914107 17.24730 7.476698 20.77778 8.100381 -3.530476      11.02348 
1 1 1 19  25 10 o 51.28645 5.396727 34.74157       6.643839 37.59456       9.001546 31.32758       9.846870 51.76525 7.341499 45.54779 9.188782 6.217464       11.76143 
1 1 1 19  25 11 o 34.20809 6.532199 16.34851       5.246796 22.40637       8.036527 11.84824       6.926726 38.33497 8.790521 27.71929 8.979877 10.61568       12.56628 
1 1 1 19  25 12 o 19.85342 7.451280 5.061419       4.879941 9.909526       7.442829 1.405782       6.462990 25.38153 9.260443 18.02298 7.849854 7.358547       12.13985 
1 1 1 19  25 13 o 13.87978 6.267652 -1.054025      4.508124 0.7447292      6.706342 -2.536933      6.089153 17.67066 7.834798 15.13715 7.002036 2.533511       10.50774 
1 1 1 19  25 14 o 28.29363 7.104541 11.97755       4.890862 6.491658       7.058463 17.04390       6.783193 21.78751 8.736056 32.68201 8.453894 -10.89450      12.15677 
1 1 1 19  25 15 o 56.67042 5.459661 44.17318       7.446560 58.85639       10.93269 31.46564       10.17061 62.84757 7.272468 42.34977 10.01367 20.49780       12.37588 
1 1 1 19  25 16 o 20.57653 8.711430 5.444751       7.546002 0.000000       0.000000 5.444751       7.546002 ?        ?        20.57653 8.711430 0.000000       8.711430 
1 1 1 19  25 17 f 14.96485 6.823585 -0.5284879     5.504261 0.000000       0.000000 -0.5284879     5.504261 ?        ?        14.96485 6.823585 0.000000       6.823585 
1 1 1 19  25 18 o 21.05219 7.683078 7.350340       5.123777 9.701379       7.977288 5.699312       6.685016 22.70561 9.221732 19.67187 8.256603 3.033739       12.37788 
1 1 1 19  25 19 o 15.79947 6.821493 2.322900       4.794252 12.67860       7.593382 -4.541612      6.182304 24.61558 9.282715 13.38413 6.440084 11.23145       11.29794 
1 1 1 19  25 20 o 14.28300 6.393495 0.8297800      4.577203 5.094403       7.677167 -1.522197      5.701345 18.70064 8.331670 14.01415 6.578908 4.686482       10.61597 
1 1 1 19  25 21 o 9.114402 4.577055 -10.37956      4.475527 -10.33545      6.675093 -10.41558      6.032308 11.80357 5.875561 11.09533 5.533007 0.7082386      8.070711 
1 1 1 19  25 22 o 24.75980 8.131041 12.39239       5.669477 16.44737       9.007528 9.732008       7.295977 24.45048 9.846188 20.83572 8.676579 3.614758       13.12366 
1 1 1 19  26 0  o 40.88447 3.528446 20.88664       3.481060 25.32925       6.660257 19.21690       4.083162 43.90211 6.414802 38.94132 4.378570 4.960793       7.766695 
1 1 1 19  26 1  o 18.08021 5.457869 4.223076       2.605613 0.4002772      4.760882 5.857778       3.113265 15.98127 6.847379 21.03963 5.857264 -5.058360      9.010779 
1 1 1 19  26 2  o 33.23227 4.649514 14.17045       3.662433 13.22968       4.359912 16.42567       6.750428 31.63778 5.871148 34.27218 8.193845 -2.634396      10.08015 
1 1 1 19  26 3  o 37.80807 3.162297 17.83733       2.886891 19.04708       4.171470 16.72536       3.999330 38.62244 4.517374 36.11187 4.652659 2.510571       6.484899 
1 1 1 19  26 4  o 22.72844 3.957185 6.647555       2.112170 6.288260       2.860692 7.078180       3.131803 21.72195 5.421677 23.00064 5.633077 -1.278696      7.818320 
1 1 1 19  26 5  o 39.54611 2.594443 19.38872       2.486445 22.10843       3.336675 15.99255       3.728610 42.03006 3.283799 35.30597 4.431083 6.724091       5.515237 
1 1 1 19  26 6  o 32.35205 7.912121 14.94623       6.185190 14.26594       7.079848 17.13920       12.71143 31.10746 8.893550 32.65100 12.07023 -1.543537      14.99285 
1 1 1 19  26 7  o 37.33110 6.182459 18.84071       5.427610 27.56909       7.973523 11.30427       7.409116 44.23594 7.674860 27.65668 9.301557 16.57925       12.05912 
1 1 1 19  26 8  o 27.22955 6.985556 10.51183       4.657625 17.18973       6.809330 4.640466       6.384891 34.13339 8.273521 20.81287 8.321149 13.32052       11.73425 
1 1 1 19  26 9  o 15.18247 6.530119 0.6543398      4.361118 7.681091       6.428717 -5.336245      5.935833 23.46754 8.599430 13.83171 6.559281 9.635832       10.81547 
1 1 1 19  26 10 o 15.85295 6.613380 1.671486       4.249729 8.452316       6.506147 -3.374430      5.612449 24.01842 8.673164 14.22544 6.628680 9.792978       10.91619 
1 1 1 19  26 11 o 25.07015 7.193107 9.278352       4.623366 6.724895       5.887310 13.38688       7.467858 21.94142 8.194674 28.63264 9.327645 -6.691219      12.41602 
1 1 1 19  26 12 o 31.06668 7.692019 14.67511       5.792211 12.93209       7.980319 16.61558       8.420219 27.68108 9.643440 31.00488 9.887200 -3.323801      13.81132 
1 1 1 19  26 13 o 17.66413 8.041673 -0.3331846     7.606568 0.000000       0.000000 -0.3331846     7.606568 ?        ?        17.66413 8.041673 0.000000       8.041673 
1 1 1 19  26 14 o 16.48620 7.270624 1.020715       5.701133 0.000000       0.000000 1.020715       5.701133 ?        ?        16.48620 7.270624 0.000000       7.270624 
1 1 1 19  26 15 o 25.21605 7.576320 10.21792       5.029450 23.07507       8.121788 2.220832       6.405387 36.41232 9.161998 17.68332 7.755695 18.72900       12.00387 
1 1 1 19  26 16 f 19.96889 7.340871 6.136481       4.690652 9.290829       6.937228 3.479709       6.366611 22.97367 8.822423 18.23146 7.866158 4.742212       11.81997 
1 1 1 19  26 17 o 37.14446 6.389693 20.89549       5.575233 30.74676       8.807287 14.30823       7.201921 41.45118 8.979208 27.11686 9.170625 14.33432       12.83458 
1 1 1 19  26 18 o 23.40308 7.648019 9.641503       5.018585 2.970978       7.738045 14.48438       6.593305 17.94944 8.147743 27.35364 8.751920 -9.404196      11.95750 
1 1 1 19  26 19 o 20.50820 7.821512 7.599181       5.427588 24.69635       9.212225 -1.491122      6.717251 32.75068 10.32942 14.93710 7.051844 17.81358       12.50701 
1 1 1 19  26 20 o 11.76159 5.674304 -4.146182      4.875165 -4.238904      7.563098 -4.080267      6.376759 14.36003 6.961476 13.41446 6.476142 0.9455719      9.508027 
1 1 1 19  26 21 o 10.48305 5.160426 -6.463331      4.647932 -10.35225      7.697072 -4.231407      5.831107 12.63506 6.292685 12.68723 6.141490 -0.5216980E-01 8.792939 
1 1 1 19  27 0  o 42.07015 3.597865 22.21827       3.653171 23.07998       6.535562 21.82669       4.405715 41.47596 6.694086 41.38280 4.438029 0.9315872E-01  8.031618 
1 1 1 19  27 1  o 32.15992 4.014946 13.16408       3.078170 19.62099       5.827161 10.66496       3.625250 38.23611 6.485350 28.39758 5.436603 9.838535       8.462647 
1 1 1 19  27 2  o 43.06904 3.848292 23.43168       3.996449 25.39452       4.847616 19.26716       7.061051 44.55573 4.527467 36.89708 8.077619 7.658649       9.259907 
1 1 1 19  27 3  o 24.87552 3.883323 7.943733       2.277150 9.155005       3.411373 6.970254       3.058241 26.15753 5.525219 22.76459 5.561225 3.392939       7.839341 
1 1 1 19  27 4  o 18.80054 4.349276 4.655766       1.952993 7.188016       2.667477 1.730066       2.867228 23.29659 4.856265 14.23886 5.613555 9.057733       7.422621 
1 1 1 19  27 5  o 35.40283 2.724471 15.63030       2.332412 16.60588       3.099660 14.35687       3.541347 36.21209 3.558475 33.27929 4.480474 2.932804       5.721660 
1 1 1 19  27 6  o 58.54676 5.040880 44.75947       7.121969 46.64929       9.182726 41.90662       11.28241 58.47459 6.557002 52.98168 9.064161 5.492908       11.18719 
1 1 1 19  27 7  o 47.08746 8.033264 32.29877       8.887462 32.29877       8.887462 0.000000       0.000000 47.08746 8.033264 ?        ?        0.000000       8.033264 
1 1 1 19  27 8  o 15.78092 7.248742 -2.302176      6.364660 0.000000       0.000000 -2.302176      6.364660 ?        ?        15.78092 7.248742 0.000000       7.248742 
1 1 1 19  27 9  o 30.84084 9.658475 15.76276       8.068270 0.000000       0.000000 15.76276       8.068270 ?        ?        30.84084 9.658475 0.000000       9.658475 
1 1 1 19  27 10 o 15.81015 7.172462 -1.096505      5.985729 0.000000       0.000000 -1.096505      5.985729 ?        ?        15.81015 7.172462 0.000000       7.172462 
1 1 1 19  27 11 o 13.06929 5.956026 -1.426138      4.186346 2.014292       5.905739 -4.900913      5.935143 17.62679 7.590439 13.72685 6.523790 3.899948       10.00873 
1 1 1 19  27 12 o 25.14874 7.312788 9.706962       4.748930 9.022099       6.856596 10.33840       6.583713 23.73239 8.847535 25.07275 8.757464 -1.340359      12.44878 
1 1 1 19  27 13 o 26.96094 7.395172 11.37267       5.003962 15.17951       7.600331 8.459888       6.648200 29.12975 9.403855 22.91009 8.675428 6.219656       12.79436 
1 1 1 19  27 14 o 39.10322 6.028895 22.11253       5.560535 29.64406       8.738069 16.98707       7.208421 41.82263 8.850158 30.93456 9.013737 10.88806       12.63221 
1 1 1 19  27 15 o 16.12973 6.937733 2.128323       4.922816 5.114998       7.403224 -0.2390602     6.591149 19.73699 8.498788 16.09002 7.385509 3.646965       11.25945 
1 1 1 19  27 16 o 16.23329 6.917660 2.625475       4.811813 3.673234       7.509191 1.895529       6.267697 18.53476 8.249995 16.78210 7.499047 1.752665       11.14891 
1 1 1 19  27 17 f 12.20823 5.771606 -2.700723      4.528950 -7.413983      7.324881 0.2162419      5.762428 13.53470 6.624878 15.16877 6.941315 -1.634064      9.595357 
1 1 1 19  27 18 o 16.98461 7.076507 3.943731       4.856777 1.173015       7.420986 6.019675       6.423526 16.62055 7.702774 19.08093 8.055830 -2.460379      11.14581 
1 1 1 19  27 19 o 20.86757 7.684678 8.120877       5.144016 7.803367       8.257956 8.322196       6.575600 19.93351 8.772214 20.49920 8.354985 -0.5656834     12.11435 
1 1 1 19  28 0  o 15.97176 5.842453 2.876155       2.965406 0.1641496      5.015905 4.333375       3.676771 15.91269 6.923276 18.65954 6.542552 -2.746853      9.525583 
1 1 1 19  28 1  o 12.93331 5.309456 0.9637972      2.679384 3.245095       4.559061 -0.2399180     3.311664 18.07493 7.092900 12.82162 5.601134 5.253318       9.037806 
1 1 1 19  28 2  o 20.03473 6.698426 5.316722       3.842929 7.293773       4.546804 0.3724942      7.190293 22.90727 7.260905 18.55987 8.175940 4.347399       10.93466 
1 1 1 19  28 3  o 47.42990 3.080529 28.17949       3.541260 33.59540       5.952730 25.21290       4.405636 50.81278 4.866780 44.37611 4.121112 6.436668       6.377234 
1 1 1 19  28 4  o 11.33158 4.925054 -0.1123131     2.532872 0.000000       0.000000 -0.1123131     2.532872 ?        ?        11.33158 4.925054 0.000000       4.925054 
1 1 1 19  28 5  o 73.88226 3.401441 68.85144       6.107625 70.60970       7.657455 65.77702       10.12571 74.11510 4.257681 69.75568 6.015466 4.359428       7.369781 
1 1 1 19  28 6  o 18.33973 7.128356 3.802317       4.569023 1.199899       7.170942 5.580854       5.928150 18.63988 8.189684 21.02718 8.134274 -2.387299      11.54285 
1 1 1 19  28 7  o 11.64714 5.451929 -2.961875      3.867537 2.169364       5.512277 -7.936951      5.427748 17.61919 7.451816 11.92228 5.806548 5.696914       9.446987 
1 1 1 19  28 8  o 20.36076 8.204822 4.907380       6.259326 13.44368       7.604410 -13.02737      11.02245 28.51889 9.419337 16.62983 8.137094 11.88906       12.44734 
1 1 1 19  28 9  f 34.26815 6.384837 16.74078       5.135710 30.34869       8.255589 8.150016       6.559463 44.88248 7.832829 23.22395 8.654548 21.65853       11.67281 
1 1 1 19  28 10 o 15.41647 6.631371 1.175175       4.498196 8.905520       6.886651 -4.576991      5.940518 23.72173 8.862258 13.81275 6.553661 9.908978       11.02225 
1 1 1 19  28 11 o 31.67160 7.203612 15.25954       5.433832 22.73658       8.437935 9.961737       7.102628 36.24242 9.455960 24.40962 9.022714 11.83281       13.06999 
1 1 1 19  28 12 o 23.56217 7.518007 8.836679       4.867811 14.71662       7.467041 4.490958       6.419378 28.49356 9.330004 19.32663 8.099933 9.166927       12.35548 
1 1 1 19  28 13 o 15.54874 6.650179 1.810742       4.475986 0.7412580      6.151360 3.014154       6.525164 16.37323 7.363822 18.09152 7.883499 -1.718294      10.78774 
1 1 1 19  28 14 o 14.57254 6.377591 1.016226       4.310557 -6.674242      6.013618 9.143297       6.181963 12.63356 6.143672 22.77410 8.417742 -10.14054      10.42128 
1 1 1 19  28 15 o 16.48680 6.888084 3.143879       4.620305 3.797948       6.428518 2.445004       6.645055 18.01605 7.838092 17.27983 7.721474 0.7362137      11.00258 
1 1 1 19  28 16 o 13.14805 6.070719 -1.042615      4.546317 5.435998       6.806462 -6.261321      6.108883 18.99926 8.164680 12.64030 6.157114 6.358966       10.22605 
1 1 1 19  28 17 f 24.91845 8.837902 12.83035       6.723861 11.86364       8.062551 15.03829       12.18484 23.07871 9.307766 23.24151 10.41545 -0.1627979     13.96840 
1 1 1 19  28 18 o 15.27861 7.169392 -0.3313974     6.758084 8.129616       8.402191 -15.83499      11.37359 20.13600 8.855364 14.35770 7.221713 5.778294       11.42675 
1 1 1 19  29 0  o 44.62194 3.571575 25.22407       3.851288 32.68152       7.099093 22.11391       4.584576 49.19722 6.048586 41.22372 4.644423 7.973495       7.626012 
1 1 1 19  29 1  o 17.73079 5.546556 4.188747       2.661552 3.092527       4.671381 4.715651       3.238633 17.82120 7.120057 18.78851 6.144068 -0.9673061     9.404509 
1 1 1 19  29 2  o 42.98545 3.005098 23.19906       3.128038 19.03943       4.598973 26.77997       4.267075 37.87468 5.113328 45.77246 3.861499 -7.897785      6.407596 
1 1 1 19  29 3  o 39.18292 2.935466 19.28583       2.782541 23.47598       4.221282 16.06627       3.700216 42.66474 4.110962 35.07439 4.427600 7.590343       6.041825 
1 1 1 19  29 4  o 16.13984 5.382463 3.377554       2.481553 -0.2655237     5.567296 4.280832       2.772177 15.95958 7.103694 17.82969 5.671697 -1.870109      9.090138 
1 1 1 19  29 5  o 13.64142 4.149914 2.423959       1.502368 3.106849       2.038052 1.611241       2.223361 15.37321 4.859767 12.89232 4.983108 2.480895       6.960510 
1 1 1 19  29 6  o 62.29322 4.520034 50.80647       6.814816 58.64740       10.67116 45.40628       8.855903 64.07596 6.944995 56.83382 6.511698 7.242134       9.520251 
1 1 1 19  29 7  o 34.97165 6.218789 17.30161       5.105556 18.90763       7.660599 16.01817       6.848204 33.93700 9.083753 31.55210 8.649973 2.384905       12.54339 
1 1 1 19  29 8  o 21.52594 7.562829 6.857259       4.914598 9.872049       7.481079 4.568369       6.518508 24.61624 9.228551 19.91325 8.238820 4.702984       12.37111 
1 1 1 19  29 9  f 14.75233 6.455102 0.5910205      4.414203 3.200296       6.036697 -2.407367      6.471178 18.36745 7.784613 15.36259 7.144797 3.004863       10.56638 
1 1 1 19  29 10 o 24.79407 7.528902 9.768126       4.948018 2.027065       7.198766 16.70039       6.812324 18.24106 8.100890 31.45468 8.628892 -13.21362      11.83563 
1 1 1 19  29 11 o 27.53279 7.620575 12.28396       5.286688 16.47395       7.810541 8.741241       7.181961 29.66348 9.529078 22.73187 8.907751 6.931604       13.04421 
1 1 1 19  29 12 o 17.25577 6.970034 3.705386       4.528851 9.010602       6.969762 -0.1714858     5.958091 22.64691 8.803674 15.56536 7.098141 7.081543       11.30877 
1 1 1 19  29 13 o 12.16490 5.647323 -1.731680      4.014493 -1.733397      5.235756 -1.729231      6.253582 13.77385 6.412920 14.85955 6.948149 -1.085702      9.455279 
1 1 1 19  29 14 o 21.26908 8.376885 8.102827       6.379268 3.470610       7.623890 18.91883       11.64972 18.29890 8.216546 26.57144 11.00571 -8.272537      13.73453 
1 1 1 19  29 15 o 23.07822 8.800502 10.66508       6.870735 12.61734       8.427798 6.796178       11.86422 23.84552 9.551147 20.50137 9.580989 3.344151       13.52848 
1 1 1 19  29 16 o 19.31113 7.469548 6.395484       4.998413 4.034578       7.641385 8.161159       6.608272 18.07365 8.160891 20.66492 8.393112 -2.591267      11.70660 
1 1 1 19  30 0  o 34.25372 4.197103 15.24450       3.430310 14.10316       5.961503 15.80945       4.194226 30.66242 7.922203 34.36652 5.168036 -3.704098      9.458853 
1 1 1 19  30 1  o 47.24396 3.688081 28.50193       4.212406 28.27078       5.246907 28.92107       7.065424 46.39890 4.705439 45.46909 6.566558 0.9298134      8.078418 
1 1 1 19  30 2  o 18.01406 5.365250 4.424842       2.530641 6.936773       4.275362 3.070117       3.139746 21.96355 7.049595 16.13385 5.992418 5.829700       9.252344 
1 1 1 19  30 3  o 19.72490 5.747606 5.424404       2.930889 6.871551       3.322299 0.3454153      6.224019 22.03278 6.018615 16.97172 7.535100 5.061058       9.643726 
1 1 1 19  30 4  o 11.45561 4.529639 1.107922       1.871862 1.755109       2.672345 0.4845224      2.622775 13.71133 5.415125 12.04350 5.118841 1.667833       7.451585 
1 1 1 19  30 5  o 9.334262 3.847805 0.4455642      1.414816 1.056439       1.903406 -0.3086622     2.114979 11.41263 4.549827 10.05713 4.432128 1.355500       6.351746 
1 1 1 19  30 6  o 26.51970 7.266961 10.72954       4.834692 11.56008       7.256045 10.06642       6.483557 26.16257 9.189653 24.87904 8.690543 1.283524       12.64813 
1 1 1 19  30 7  o 49.13770 5.040654 32.78441       5.950366 39.05315       9.265436 28.38413       7.762754 50.37084 7.800267 42.97075 7.695854 7.400097       10.95766 
1 1 1 19  30 8  o 15.44709 6.698843 1.225728       4.664432 4.429976       6.863979 -1.523564      6.358042 19.58527 8.300836 15.54874 7.179154 4.036527       10.97470 
1 1 1 19  30 9  o 27.66423 7.274383 12.08277       4.968225 16.14539       7.097726 8.180034       6.956658 30.16345 8.985713 22.30966 8.759569 7.853785       12.54883 
1 1 1 19  30 10 o 17.22433 7.314605 3.008740       5.347673 5.777382       6.199963 -5.036075      10.56851 19.90965 8.113534 17.30768 8.351121 2.601967       11.64348 
1 1 1 19  30 11 o 12.51953 6.047242 -5.476980      5.577832 -10.58227      6.371343 11.27476       11.54120 11.83313 5.864585 23.37470 10.32504 -11.54157      11.87433 
1 1 1 19  30 12 o 21.24543 7.643230 7.636971       5.047057 5.229915       7.364492 9.768685       6.930494 19.37465 8.409590 22.77383 8.799107 -3.399178      12.17150 
1 1 1 19  30 13 o 15.77650 6.823330 2.249305       4.813236 2.144946       6.982663 2.343782       6.643856 17.17808 7.774546 17.09127 7.672610 0.8680534E-01  10.92303 
1 1 1 19  30 14 o 20.56187 7.616106 7.421613       5.065337 16.28484       7.909734 1.259798       6.595082 27.19784 9.591233 16.25757 7.434400 10.94028       12.13516 
1 1 1 19  30 15 o 12.91737 6.023412 -1.408489      4.647408 3.223820       7.356583 -4.484984      5.995225 17.52552 7.950984 13.01084 6.280826 4.514675       10.13247 
1 1 1 19  31 0  o 24.22913 5.398072 8.127769       3.105589 10.13992       5.318551 7.086773       3.825494 25.75080 7.802868 22.14257 6.596988 3.608229       10.21788 
1 1 1 19  31 1  o 12.76389 5.121480 1.339574       2.427665 -1.424378      3.606752 3.629001       3.282573 12.12460 5.526611 16.92726 6.153829 -4.802656      8.271217 
1 1 1 19  31 2  o 39.90266 3.257493 20.28956       3.139996 26.87481       4.866426 15.59232       4.110034 45.11923 4.485343 33.86319 5.142025 11.25604       6.823395 
1 1 1 19  31 3  o 29.53496 5.601315 12.20081       3.883989 14.07443       4.814731 8.709778       6.572154 31.05995 6.566785 23.50961 8.681167 7.550335       10.88510 
1 1 1 19  31 4  o 26.06661 4.099481 9.016145       2.518169 12.97524       3.506223 4.798482       3.618907 30.93337 4.807363 18.54903 6.491818 12.38434       8.078022 
1 1 1 19  31 5  o 20.27132 3.854679 5.473355       1.834601 6.589416       2.537862 4.251756       2.655145 21.79157 4.898532 17.44030 5.551014 4.351276       7.403335 
1 1 1 19  31 6  o 15.92382 7.097487 0.5874139      5.577199 2.011646       6.647259 -2.799277      10.25038 17.77981 7.845544 18.19257 8.625034 -0.4127617     11.65949 
1 1 1 19  31 7  o 20.83925 7.891862 6.723662       5.501749 8.058340       6.543139 3.502877       10.16433 22.16138 8.553088 20.35169 9.277064 1.809681       12.61821 
1 1 1 19  31 8  o 14.24169 6.405636 -0.8957064E-01 4.655628 4.303236       6.681930 -4.234099      6.490355 18.96424 8.118479 14.19268 6.766830 4.771557       10.56881 
1 1 1 19  31 9  f 35.53449 6.883257 19.59446       5.745128 32.45973       9.047205 10.90097       7.437076 42.96107 8.933377 23.96252 9.151567 18.99855       12.78892 
1 1 1 19  31 10 o 18.81836 7.056649 5.415726       4.374711 6.141365       6.297659 4.739035       6.081551 19.83817 8.141565 18.66762 7.857523 1.170546       11.31485 
1 1 1 19  31 11 o 13.18291 6.004664 -0.5462822     4.247934 -5.597194      5.535097 6.691713       6.625971 12.29811 5.960372 20.12553 8.314628 -7.827416      10.23030 
1 1 1 19  31 12 o 13.44959 6.119189 -0.2845974     4.395791 -2.071388      6.033638 1.736623       6.417254 14.23099 6.707766 16.50693 7.463680 -2.275940      10.03497 
1 1 1 19  31 13 o 11.54990 5.506732 -3.222230      4.297923 -5.675453      5.888433 -0.4251881     6.287539 12.52489 6.088210 15.13485 7.040169 -2.609959      9.307538 
1 1 1 19  32 0  o 17.09856 5.926735 3.946021       3.012436 8.764270       5.391304 1.758855       3.632370 23.61030 7.934453 14.85569 6.148597 8.754615       10.03797 
1 1 1 19  32 1  o 17.34832 5.454751 4.185654       2.570879 9.330106       3.810978 -0.1106885     3.482702 25.24668 6.232430 12.83049 5.669459 12.41618       8.425316 
1 1 1 19  32 2  o 11.40740 4.853333 0.4660408      2.361832 -3.489454      3.274756 4.753969       3.409591 10.04221 4.793125 18.34636 6.307742 -8.304148      7.922225 
1 1 1 19  32 3  o 60.44938 2.865422 46.27231       4.208996 47.76877       5.939640 44.76290       5.965281 60.28650 4.066799 58.17233 4.237077 2.114174       5.872961 
1 1 1 19  32 4  o 27.10907 4.323406 9.921500       2.760254 6.500648       4.040976 12.91370       3.779325 20.66015 6.867950 30.30511 5.311045 -9.644958      8.681931 
1 1 1 19  32 5  o 42.36151 3.614640 23.42224       3.695792 47.21574       9.638747 19.32120       4.001638 55.14220 7.356342 37.83714 4.423306 17.30506       8.583787 
1 1 1 19  32 6  o 21.44368 7.659949 7.477973       5.059419 16.86312       7.921912 1.012820       6.575047 29.46029 9.607690 16.78159 7.574467 12.67871       12.23439 
1 1 1 19  32 7  o 17.22978 6.919268 3.824473       4.435122 4.853158       6.293281 2.809451       6.251349 19.01034 7.996948 17.53510 7.677052 1.475243       11.08550 
1 1 1 19  32 8  o 17.95242 7.181379 4.491312       4.758172 2.241515       6.907626 6.522643       6.563684 17.47021 7.834599 20.22432 8.307168 -2.754103      11.41884 
1 1 1 19  32 9  o 17.58995 7.198531 4.181665       4.905706 -1.625518      7.446411 8.634874       6.520798 15.82246 7.456031 21.79535 8.503246 -5.972886      11.30918 
1 1 1 19  32 10 o 17.38734 7.154397 4.110423       4.879495 4.865848       7.550323 3.568634       6.394182 18.94368 8.360209 17.68682 7.753307 1.256857       11.40206 
1 1 1 19  32 11 o 13.63066 6.312171 -1.021715      4.968801 3.736235       7.792999 -4.280952      6.449895 18.25109 8.241192 13.68953 6.584720 4.561561       10.54873 
1 1 1 19  33 0  o 17.22428 5.934691 4.145087       3.018746 6.708771       5.395743 2.977038       3.642081 20.88430 7.835814 16.01987 6.323337 4.864431       10.06899 
1 1 1 19  33 1  o 27.75665 4.587110 10.52843       2.994434 11.88918       4.494210 9.442054       4.015626 27.91902 6.692699 24.91423 6.534466 3.004787       9.353687 
1 1 1 19  33 2  o 43.41840 3.260806 24.29897       3.424917 31.85863       5.385176 19.16435       4.438161 48.47635 4.614208 37.17944 5.027204 11.29691       6.823760 
1 1 1 19  33 3  o 25.41170 4.416148 8.828946       2.635523 8.943687       3.978372 8.739210       3.518276 24.06061 6.591634 24.22310 5.993359 -0.1624966     8.908983 
1 1 1 19  33 4  o 12.80237 5.175772 1.500489       2.499757 1.053213       3.012129 2.490147       4.480520 12.99668 5.503186 16.03525 6.746651 -3.038563      8.706454 
1 1 1 19  33 5  o 11.80690 5.104735 0.4372469      2.692126 0.000000       0.000000 0.4372469      2.692126 ?        ?        11.80690 5.104735 0.000000       5.104735 
1 1 1 19  33 6  o 10.64416 4.470528 0.6092640      1.961868 8.808022       7.366269 -0.1669399E-01 2.035383 21.99516 8.887504 10.00780 4.381072 11.98735       9.908658 
1 1 1 19  33 7  o 24.16434 7.898874 10.31049       5.353037 9.520569       8.197896 10.89765       7.067856 22.21609 9.219761 23.64158 8.946725 -1.425499      12.84710 
1 1 1 19  33 8  o 10.32264 5.043366 -5.780060      4.187681 -5.213058      6.432577 -6.197122      5.516873 13.42789 6.487978 12.02418 5.855697 1.403708       8.739739 
1 1 1 19  34 0  o 28.75407 6.365179 12.48379       4.342158 0.000000       0.000000 12.48379       4.342158 ?        ?        28.75407 6.365179 0.000000       6.365179 
1 1 1 19  34 1  o 17.81286 5.670564 4.621806       2.770645 8.739161       4.329507 1.766158       3.605634 23.34850 7.032564 14.48369 6.070390 8.864814       9.290134 
1 1 1 19  34 2  o 13.04488 5.238510 1.661812       2.542067 2.861298       3.906569 0.7809108      3.347815 15.85886 6.448744 13.15769 5.690650 2.701171       8.600570 
1 1 1 19  34 3  o 30.43032 4.006097 12.44852       2.898650 15.65446       4.439034 10.06532       3.827280 32.64949 5.791307 25.70129 6.185844 6.948198       8.473719 
1 1 1 19  34 4  o 21.17802 5.361117 6.585882       2.768924 7.955305       3.486507 4.246884       4.556556 22.74779 6.145437 17.57667 7.028760 5.171116       9.336481 
1 1 1 20  0  0  o 54.20027 4.520234 36.60613       5.871349 36.60613       5.871349 36.60613       5.871349 54.20027 4.520234 54.20027 4.520234 0.000000       0.000000 
1 1 1 20  0  1  o 73.76659 4.161741 67.05023       7.426312 67.05023       7.426312 67.05023       7.426312 73.76659 4.161741 73.76659 4.161741 0.000000       0.000000 
1 1 1 20  0  2  o 11.84713 6.994342 1.935264       3.458865 1.935264       3.458865 1.935264       3.458865 11.84713 6.994342 11.84713 6.994342 0.000000       0.000000 
1 1 1 20  0  3  o 138.9889 4.223044 236.4991       14.27358 236.4991       14.27358 236.4991       14.27358 138.9889 4.223044 138.9889 4.223044 0.000000       0.000000 
1 1 1 20  0  4  o 172.9942 4.651628 366.3627       19.57773 366.3627       19.57773 366.3627       19.57773 172.9942 4.651628 172.9942 4.651628 0.000000       0.000000 
1 1 1 20  0  5  o 116.4398 4.078681 166.1473       11.54107 166.1473       11.54107 166.1473       11.54107 116.4398 4.078681 116.4398 4.078681 0.000000       0.000000 
1 1 1 20  0  6  o 136.8358 4.253390 229.3491       14.15204 229.3491       14.15204 229.3491       14.15204 136.8358 4.253390 136.8358 4.253390 0.000000       0.000000 
1 1 1 20  0  7  o 26.41546 7.968113 10.58230       4.471540 10.58230       4.471540 10.58230       4.471540 26.41546 7.968113 26.41546 7.968113 0.000000       0.000000 
1 1 1 20  0  8  o 10.77538 6.984572 -0.2018978     4.347276 -0.2018978     4.347276 -0.2018978     4.347276 10.77538 6.984572 10.77538 6.984572 0.000000       0.000000 
1 1 1 20  0  9  o 41.19864 5.834169 21.99002       5.519005 21.99002       5.519005 21.99002       5.519005 41.19864 5.834169 41.19864 5.834169 0.000000       0.000000 
1 1 1 20  0  10 f 85.35966 4.247277 89.71989       8.784722 89.71989       8.784722 89.71989       8.784722 85.35966 4.247277 85.35966 4.247277 0.000000       0.000000 
1 1 1 20  0  11 o 106.2161 4.331986 138.6524       11.17030 138.6524       11.17030 138.6524       11.17030 106.2161 4.331986 106.2161 4.331986 0.000000       0.000000 
1 1 1 20  0  12 o 292.6013 6.766205 1055.295       48.18732 1055.295       48.18732 1055.295       48.18732 292.6013 6.766205 292.6013 6.766205 0.000000       0.000000 
1 1 1 20  0  13 o 82.06920 4.478840 83.20064       8.896011 83.20064       8.896011 83.20064       8.896011 82.06920 4.478840 82.06920 4.478840 0.000000       0.000000 
1 1 1 20  0  14 o 16.90025 9.105442 5.092996       5.196461 5.092996       5.196461 5.092996       5.196461 16.90025 9.105442 16.90025 9.105442 0.000000       0.000000 
1 1 1 20  0  15 o 11.61496 7.518541 -0.7132912E-01 5.014196 -0.7132912E-01 5.014196 -0.7132912E-01 5.014196 11.61496 7.518541 11.61496 7.518541 0.000000       0.000000 
1 1 1 20  0  16 f 42.24186 6.904397 23.75062       6.537501 23.75062       6.537501 23.75062       6.537501 42.24186 6.904397 42.24186 6.904397 0.000000       0.000000 
1 1 1 20  0  17 o 59.81522 4.638398 44.79015       6.665046 44.79015       6.665046 44.79015       6.665046 59.81522 4.638398 59.81522 4.638398 0.000000       0.000000 
1 1 1 20  0  18 o 157.6151 4.623475 306.9248       17.72375 306.9248       17.72375 306.9248       17.72375 157.6151 4.623475 157.6151 4.623475 0.000000       0.000000 
1 1 1 20  0  19 o 98.15907 3.643688 118.8772       8.688512 118.8772       8.688512 118.8772       8.688512 98.15907 3.643688 98.15907 3.643688 0.000000       0.000000 
1 1 1 20  0  20 o 18.29431 8.241728 6.148179       3.937709 6.148179       3.937709 6.148179       3.937709 18.29431 8.241728 18.29431 8.241728 0.000000       0.000000 
1 1 1 20  0  21 o 19.29117 8.883653 7.002776       4.582605 7.002776       4.582605 7.002776       4.582605 19.29117 8.883653 19.29117 8.883653 0.000000       0.000000 
1 1 1 20  0  22 o 21.24236 9.002274 8.296550       4.718010 8.296550       4.718010 8.296550       4.718010 21.24236 9.002274 21.24236 9.002274 0.000000       0.000000 
1 1 1 20  0  23 o 11.61741 7.275184 1.365779       4.253018 1.365779       4.253018 1.365779       4.253018 11.61741 7.275184 11.61741 7.275184 0.000000       0.000000 
1 1 1 20  0  24 f 12.40001 7.312332 2.576284       3.772864 2.576284       3.772864 2.576284       3.772864 12.40001 7.312332 12.40001 7.312332 0.000000       0.000000 
1 1 1 20  0  25 o 13.60729 7.577268 3.612791       3.726720 3.612791       3.726720 3.612791       3.726720 13.60729 7.577268 13.60729 7.577268 0.000000       0.000000 
1 1 1 20  0  26 o 8.924265 5.959941 -0.6472687     3.551548 -0.6472687     3.551548 -0.6472687     3.551548 8.924265 5.959941 8.924265 5.959941 0.000000       0.000000 
1 1 1 20  0  27 o 7.433055 5.184586 -2.672533      3.408356 -2.672533      3.408356 -2.672533      3.408356 7.433055 5.184586 7.433055 5.184586 0.000000       0.000000 
1 1 1 20  0  28 o 12.93549 7.564640 3.382097       3.980552 3.382097       3.980552 3.382097       3.980552 12.93549 7.564640 12.93549 7.564640 0.000000       0.000000 
1 1 1 20  0  29 o 6.857780 4.885464 -4.236207      3.584510 -4.236207      3.584510 -4.236207      3.584510 6.857780 4.885464 6.857780 4.885464 0.000000       0.000000 
1 1 1 20  0  30 o 11.76415 7.285954 2.633152       4.147332 2.633152       4.147332 2.633152       4.147332 11.76415 7.285954 11.76415 7.285954 0.000000       0.000000 
1 1 1 20  0  31 o 7.080250 5.087953 -5.527672      4.244608 -5.527672      4.244608 -5.527672      4.244608 7.080250 5.087953 7.080250 5.087953 0.000000       0.000000 
1 1 1 20  0  32 o 10.50055 6.966422 1.066677       4.718095 1.066677       4.718095 1.066677       4.718095 10.50055 6.966422 10.50055 6.966422 0.000000       0.000000 
1 1 1 20  1  0  o 141.9664 2.709962 245.9338       9.375294 246.3540       12.31091 245.3537       14.46550 141.9672 3.561305 141.5914 4.197011 0.3758545      5.504344 
1 1 1 20  1  1  o 105.1495 2.549517 134.8984       6.532827 137.1244       8.639831 131.9267       9.982583 105.9088 3.351846 103.8121 3.953240 2.096733       5.182951 
1 1 1 20  1  2  o 176.3336 3.346365 379.7706       14.37952 383.2919       16.95511 370.7487       27.13906 177.0687 3.929368 173.5507 6.428110 3.517929       7.533958 
1 1 1 20  1  3  o 130.2736 2.741680 207.1348       8.703806 201.1714       11.05142 216.8759       14.12450 128.2641 3.539095 133.0592 4.361938 -4.795105      5.617089 
1 1 1 20  1  4  o 191.5962 3.968948 448.9474       18.53098 439.7343       22.60636 467.8186       32.35391 189.3730 4.902774 194.7588 6.827565 -5.385864      8.405524 
1 1 1 20  1  5  o 138.4135 3.388081 234.1025       11.42795 230.7646       14.00171 240.7630       19.77856 137.2561 4.191045 139.8624 5.815756 -2.606323      7.168534 
1 1 1 20  1  6  o 106.7048 2.839633 139.1271       7.377273 140.9940       10.37546 137.2181       10.49159 107.2730 3.975878 105.8097 4.076552 1.463257       5.694373 
1 1 1 20  1  7  o 72.29506 2.930297 63.94061       5.151758 64.02428       7.120260 63.84870       7.463205 72.20867 4.062801 72.08056 4.267952 0.1281128      5.892518 
1 1 1 20  1  8  o 141.4793 3.082025 244.5798       10.62589 223.3763       14.30019 270.7200       15.87789 134.9491 4.354162 148.5686 4.390424 -13.61948      6.183409 
1 1 1 20  1  9  f 104.2452 2.941947 132.8837       7.466074 135.8725       10.47034 129.7920       10.64918 105.2377 4.090544 102.8226 4.259247 2.415138       5.905399 
1 1 1 20  1  10 o 124.2811 3.034537 188.8200       9.190384 189.9427       12.81514 187.6311       13.18717 124.3859 4.233989 123.5920 4.385448 0.7938690      6.095803 
1 1 1 20  1  11 o 118.2062 3.043965 170.9851       8.761014 175.2010       12.24460 166.5629       12.54059 119.4216 4.214121 116.3865 4.429683 3.035088       6.113993 
1 1 1 20  1  12 o 101.2698 3.069805 125.5902       7.567023 128.0518       10.53038 122.9619       10.88101 102.0259 4.244701 99.91963 4.480103 2.106262       6.171614 
1 1 1 20  1  13 o 166.0818 3.401608 338.0237       13.76710 333.9057       19.11951 342.4577       19.83969 164.5440 4.773292 166.5890 4.892415 -2.045044      6.835206 
1 1 1 20  1  14 o 54.50988 3.689082 36.64780       4.871511 45.57809       6.778466 27.10826       7.005875 60.62284 4.623249 46.22754 6.389758 14.39531       7.886916 
1 1 1 20  1  15 o 65.99878 3.449317 53.63281       5.528345 45.91734       7.413366 63.29877       8.297679 60.67760 5.059621 71.38219 4.798003 -10.70459      6.972847 
1 1 1 20  1  16 o 66.78464 3.743088 55.10506       6.067381 55.03932       6.896044 55.33033       12.76593 66.60665 4.271113 65.26588 8.207651 1.340767       9.252457 
1 1 1 20  1  17 o 97.09706 3.552998 116.3465       8.392748 123.4700       9.768123 96.25832       16.40350 99.85244 4.022593 86.16238 7.900214 13.69006       8.865361 
1 1 1 20  1  18 o 43.93148 3.346498 23.93113       3.555676 23.10535       4.649555 25.09431       5.518275 42.85693 4.519987 44.46868 5.189742 -1.611744      6.882129 
1 1 1 20  1  19 o 105.1483 3.006640 136.3886       7.696152 133.0983       9.201936 144.0478       14.03953 103.5695 3.651668 106.6086 5.421918 -3.039055      6.536962 
1 1 1 20  1  20 o 53.66865 3.051404 35.70612       3.974324 39.01826       5.574803 32.28300       5.667428 55.72130 4.135029 50.44553 4.663036 5.275768       6.232365 
1 1 1 20  1  21 o 63.38073 3.299461 50.05449       5.078535 52.69893       6.200133 44.66293       8.853027 64.73155 3.949304 58.15466 6.350062 6.576897       7.477987 
1 1 1 20  1  22 o 12.54113 5.170064 0.8246787      2.554467 -0.9322494     3.689731 2.441943       3.540040 12.93969 5.769801 16.06214 6.265607 -3.122452      8.517537 
1 1 1 20  1  23 o 9.819520 4.491588 -1.375392      2.409465 -1.601516      3.500901 -1.171887      3.321194 11.97361 5.452806 11.96079 5.392327 0.1282310E-01  7.668787 
1 1 1 20  1  24 o 15.02573 5.520030 2.634986       2.651578 0.9561094      3.760040 4.295869       3.739836 14.45772 6.136332 18.24936 6.577572 -3.791636      8.995501 
1 1 1 20  1  25 o 33.01200 4.377662 14.46049       3.434960 11.89301       5.531165 16.07229       4.382471 27.50634 7.859883 34.10428 5.457102 -6.597939      9.568581 
1 1 1 20  1  26 o 24.24481 5.410841 8.365205       3.115683 8.795115       5.169888 8.120007       3.904372 23.35534 7.768400 23.13979 6.600882 0.2155495      10.19410 
1 1 1 20  1  27 o 12.26467 5.116468 1.026305       2.543645 0.7034016      3.574257 1.357656       3.620706 13.43955 5.845800 14.10927 6.006216 -0.6697159     8.381409 
1 1 1 20  1  28 o 10.28704 4.686488 -0.8510282     2.589097 1.132270       3.658856 -2.840146      3.664221 13.72832 5.943285 10.86822 5.153822 2.860091       7.866671 
1 1 1 20  1  29 o 13.28469 5.479232 1.803575       2.870952 2.003563       3.836276 1.548986       4.328405 14.42542 6.162851 14.47153 6.360344 -0.4611015E-01 8.856338 
1 1 1 20  1  30 o 16.44427 5.823196 4.308748       2.918082 3.988706       4.210793 4.604467       4.047624 16.16036 6.647460 16.77262 6.651659 -0.6122570     9.403898 
1 1 1 20  1  31 o 9.426515 4.528858 -2.748724      3.030490 -0.4305540     4.949546 -4.138928      3.832939 13.11524 6.148276 10.01750 4.879000 3.097733       7.848945 
1 1 1 20  1  32 o 10.40329 4.942536 -1.842913      3.400835 3.255096       5.266957 -5.488126      4.453700 15.14824 6.813321 10.18671 5.021646 4.961531       8.463939 
1 1 1 20  2  0  o 67.25574 2.543226 55.26513       4.160708 53.92021       5.412994 57.20713       6.504489 66.36307 3.358063 68.30270 3.924382 -1.939636      5.165013 
1 1 1 20  2  1  o 252.8044 3.443434 780.6411       21.21351 793.9832       30.22348 767.6856       29.78225 254.6405 4.870583 250.3854 4.881041 4.255157       6.895443 
1 1 1 20  2  2  o 73.11616 2.474187 65.29855       4.402059 64.82222       6.077033 65.82442       6.385305 72.76526 3.436849 73.31161 3.585021 -0.5463562     4.966317 
1 1 1 20  2  3  o 128.2828 2.671029 200.8378       8.349938 183.1727       12.10869 216.8540       11.52976 122.3142 4.068076 133.1697 3.556047 -10.85553      5.403213 
1 1 1 20  2  4  o 184.6341 3.115390 416.3252       14.01717 415.1446       21.33842 417.2214       18.59093 184.0283 4.762190 184.6714 4.131098 -0.6430969     6.304318 
1 1 1 20  2  5  o 34.37203 3.968646 14.64202       3.263197 17.28108       4.292796 11.02979       5.022314 37.24312 4.844681 29.32433 7.103907 7.918787       8.598629 
1 1 1 20  2  6  o 91.60034 3.136190 102.6241       6.990279 103.7162       8.499148 100.3406       12.28928 92.00599 3.798905 90.19594 5.619086 1.810051       6.782759 
1 1 1 20  2  7  o 118.0752 3.272587 170.5167       9.407346 161.9358       11.27520 190.1740       17.06545 114.9503 4.031353 124.2470 5.651118 -9.296669      6.941681 
1 1 1 20  2  8  o 78.47632 3.266366 75.40803       6.232884 70.13826       7.415512 88.09156       11.50444 75.57910 4.040964 84.44648 5.622489 -8.867378      6.924000 
1 1 1 20  2  9  o 75.59265 3.383914 70.02350       6.217742 72.55740       7.509186 64.49754       11.08922 76.86176 4.023102 72.00726 6.385729 4.854492       7.547377 
1 1 1 20  2  10 o 70.01106 3.484798 60.13151       5.926702 59.17632       7.039944 62.45584       10.98180 69.34684 4.185359 70.78794 6.436477 -1.441101      7.677595 
1 1 1 20  2  11 o 112.7683 3.423645 155.8110       9.397416 155.4878       11.31208 156.5309       16.88186 112.5086 4.132942 112.3259 6.191378 0.1826630      7.444083 
1 1 1 20  2  12 o 79.28793 3.514807 77.16742       6.774293 76.84353       7.982571 78.00103       12.80638 79.00439 4.160920 78.95449 6.719791 0.4989624E-01  7.903724 
1 1 1 20  2  13 o 80.78880 3.623924 80.20939       7.116384 88.63683       8.487685 60.26394       13.05760 84.83222 4.118051 68.83656 7.928763 15.99566       8.934406 
1 1 1 20  2  14 o 106.5553 3.568256 139.5127       9.252396 134.4656       10.90276 152.5018       17.49072 104.4114 4.294178 110.3439 6.533893 -5.932442      7.818678 
1 1 1 20  2  15 f 52.43697 3.524874 33.92961       4.478031 38.66536       5.704054 26.32237       7.229411 55.84649 4.222615 45.34681 6.747386 10.49969       7.959755 
1 1 1 20  2  16 o 103.5425 3.095089 131.7327       7.800817 138.2151       10.36479 123.2633       11.84729 105.7567 4.029130 99.52795 4.899763 6.228775       6.343624 
1 1 1 20  2  17 o 103.5632 2.840352 131.7524       7.161489 136.5529       8.952091 123.2195       11.93527 105.2155 3.496330 99.33206 4.946238 5.883400       6.057193 
1 1 1 20  2  18 o 51.98613 3.435437 33.49166       4.327769 35.21467       5.192959 29.57394       7.830476 53.14448 4.040053 47.61012 6.954398 5.534363       8.042741 
1 1 1 20  2  19 o 58.53323 2.862273 42.28880       4.070341 39.40437       5.649543 45.40211       5.869412 56.09424 4.162604 60.28623 4.018154 -4.191990      5.785572 
1 1 1 20  2  20 o 45.25836 3.329835 25.51685       3.646753 24.15493       4.969645 27.10581       5.367929 43.53301 4.762183 46.10513 4.850292 -2.572121      6.797332 
1 1 1 20  2  21 o 35.23378 3.769360 15.68715       3.186177 15.19449       4.425790 16.21719       4.590599 33.99541 5.532439 35.13768 5.544851 -1.142265      7.832831 
1 1 1 20  2  22 o 35.95181 3.640191 16.36642       3.145294 16.78417       4.476256 15.95902       4.420504 35.69004 5.308077 34.74414 5.395993 0.9459038      7.569176 
1 1 1 20  2  23 o 15.96183 5.470126 3.190094       2.563603 0.9610280      3.608405 5.461863       3.642805 14.38188 6.052988 20.05571 6.513308 -5.673831      8.891673 
1 1 1 20  2  24 o 26.48809 4.629737 9.357101       2.879697 7.674769       4.058343 11.06312       4.086819 23.04132 6.777063 28.01563 6.154706 -4.974308      9.154725 
1 1 1 20  2  25 o 37.69013 3.580878 18.32368       3.249458 18.67661       4.652141 17.98744       4.540739 36.87996 5.330872 36.20389 5.304058 0.6760635      7.520055 
1 1 1 20  2  26 o 11.20846 4.969627 -0.2918507     2.698267 -1.640793      3.769112 1.126252       3.864527 12.04667 5.549732 14.36872 6.163077 -2.322059      8.293554 
1 1 1 20  2  27 o 10.96380 4.899766 -0.4043625     2.676650 -1.066782      3.724062 0.3035348      3.849776 12.23469 5.591667 13.46030 5.953647 -1.225608      8.167781 
1 1 1 20  2  28 o 12.44815 5.328808 0.8770631      2.878642 4.085477       4.690817 -1.061146      3.645890 17.29705 7.054133 11.94866 5.487644 5.348394       8.937284 
1 1 1 20  2  29 o 10.15282 4.863725 -3.163843      3.439028 -5.654993      8.390493 -2.660840      3.770273 14.57371 7.124298 10.96093 5.206489 3.612789       8.824010 
1 1 1 20  2  30 o 11.74848 5.215147 0.4204228      2.980093 -1.942374      4.873787 1.831309       3.766165 12.51520 5.937478 13.87406 6.018003 -1.358854      8.453993 
1 1 1 20  2  31 f 8.562930 4.165902 -3.474749      2.773020 -1.901186      3.788797 -5.290128      4.069518 11.05093 5.240532 9.884461 4.858437 1.166468       7.146159 
1 1 1 20  2  32 o 12.14563 5.328425 1.159762       3.025354 -0.6806424     4.099999 3.359616       4.482539 11.93059 5.593848 14.97204 6.528966 -3.041446      8.597589 
1 1 1 20  3  0  o 161.2669 2.644968 317.3353       10.39446 322.8616       14.75847 311.8956       14.64219 162.5507 3.725774 159.7621 3.760939 2.788666       5.293963 
1 1 1 20  3  1  o 153.5776 2.612702 287.7979       9.778089 286.2408       13.68987 289.4195       13.97102 153.0544 3.670434 153.8954 3.725346 -0.8409119     5.229750 
1 1 1 20  3  2  o 99.73064 2.393001 121.3414       5.815774 118.5779       7.988049 124.4585       8.483814 98.47435 3.333558 100.8760 3.456281 -2.401695      4.801925 
1 1 1 20  3  3  o 112.7733 2.591496 155.1986       7.121850 151.4004       10.41446 158.5350       9.760910 111.2158 3.848478 113.8508 3.522417 -2.635010      5.217107 
1 1 1 20  3  4  o 134.7173 2.719278 221.5268       8.927157 235.5050       13.67204 211.1381       11.78656 138.6942 4.049528 131.3717 3.685349 7.322464       5.475443 
1 1 1 20  3  5  o 153.7475 3.118510 288.7352       11.68399 297.3675       16.29228 279.5945       16.76519 155.7975 4.295363 151.0137 4.560939 4.783813       6.265166 
1 1 1 20  3  6  o 77.52034 2.818809 73.47512       5.316107 79.34205       7.162365 66.27825       7.932739 80.46702 3.662203 73.42370 4.454498 7.043320       5.766653 
1 1 1 20  3  7  f 97.37917 2.839414 115.9055       6.730803 113.0005       8.994115 119.6033       10.14750 96.02283 3.851500 98.73512 4.227245 -2.712288      5.718710 
1 1 1 20  3  8  o 150.8462 3.156637 278.0938       11.60367 283.1949       15.98172 272.4067       16.87480 151.9625 4.320081 148.9602 4.654418 3.002304       6.350331 
1 1 1 20  3  9  o 67.41158 3.069458 55.65748       5.029111 55.34974       6.598651 56.08396       7.768052 67.09562 4.054679 67.42753 4.758134 -0.3319092     6.251421 
1 1 1 20  3  10 o 177.7941 4.052674 387.4854       17.55882 385.9523       29.82729 388.2985       21.72142 176.2857 6.956876 177.6261 5.023213 -1.340424      8.580839 
1 1 1 20  3  11 o 15.05502 6.446103 -0.1168843     4.213931 2.893894       6.224230 -2.664706      5.725728 20.65778 8.230209 15.78587 7.101667 4.871911       10.87060 
1 1 1 20  3  12 o 81.59776 3.726817 81.80261       7.391019 72.44873       11.61786 88.16219       9.579532 76.17957 6.314921 84.52184 4.669065 -8.342262      7.853559 
1 1 1 20  3  13 o 124.1214 3.715259 189.2089       11.22490 182.1138       18.20467 193.5611       14.25781 120.9206 6.198662 125.2536 4.679407 -4.332962      7.766612 
1 1 1 20  3  14 o 50.94384 4.102776 32.13521       5.050331 31.57048       6.947233 32.76812       7.354662 50.09586 5.797702 50.98322 6.036684 -0.8873672     8.369880 
1 1 1 20  3  15 o 70.17910 3.262888 60.57405       5.564879 68.94960       7.184393 48.01217       8.798543 74.72409 3.959555 61.77598 5.916838 12.94811       7.119483 
1 1 1 20  3  16 o 51.98576 3.593916 33.42398       4.524879 34.19759       5.647215 32.03659       7.562664 52.37853 4.466887 50.11763 6.333421 2.260906       7.750181 
1 1 1 20  3  17 o 30.26795 4.757339 11.65585       3.393363 9.742016       3.885200 17.81185       6.968035 27.31867 6.000479 36.50316 8.049990 -9.184494      10.04032 
1 1 1 20  3  18 o 37.61509 4.169510 17.77349       3.757823 20.39190       4.473689 11.49870       6.925425 40.18068 4.654923 29.20724 8.914847 10.97344       10.05698 
1 1 1 20  3  19 o 63.52191 3.184450 49.94759       4.913680 52.81977       5.875074 43.26180       8.963624 65.14478 3.716234 57.69235 6.488058 7.452427       7.476984 
1 1 1 20  3  20 f 51.83199 3.554514 33.53622       4.462489 36.74263       5.324515 25.96782       8.180354 54.06697 4.071120 43.49950 8.012194 10.56747       8.987172 
1 1 1 20  3  21 o 13.02507 5.578635 0.1824229      3.157845 1.616683       3.488433 -6.327019      7.431701 15.12243 6.114048 15.76767 7.435864 -0.6452370     9.626715 
1 1 1 20  3  22 o 16.14631 5.398324 3.271339       2.495944 3.716554       3.652608 2.881343       3.418598 17.77329 6.486884 16.44910 6.222806 1.324183       8.989047 
1 1 1 20  3  23 o 10.91977 4.789926 -0.3102664     2.443951 -1.960655      3.545339 1.184094       3.373590 11.78520 5.412156 14.24366 5.913098 -2.458460      8.015994 
1 1 1 20  3  24 o 7.638294 3.753107 -4.632041      2.421787 -6.488954      3.458137 -2.844791      3.392650 9.077995 4.465322 10.79992 5.071571 -1.721923      6.757214 
1 1 1 20  3  25 o 12.60851 5.219041 1.036498       2.617457 3.415406       3.594676 -1.648250      3.818763 16.73540 6.369433 12.24754 5.621708 4.487860       8.495486 
1 1 1 20  3  26 o 27.43565 4.599621 10.26820       2.966459 11.83955       4.320003 8.866157       4.080637 28.15073 6.437687 24.07615 6.706990 4.074585       9.296640 
1 1 1 20  3  27 o 19.55555 5.933549 5.721969       3.074066 5.721536       5.175785 5.722204       3.821018 19.44472 7.578694 19.34580 6.676413 0.9891701E-01  10.10005 
1 1 1 20  3  28 o 13.66825 5.431037 2.100493       2.703368 -1.221908      3.954618 5.015070       3.703959 12.27498 5.665573 18.04515 6.540247 -5.770169      8.652950 
1 1 1 20  3  29 o 10.50394 4.740767 -0.4131110     2.575290 1.118375       3.771533 -1.750905      3.524975 13.54544 5.945739 11.10478 5.200262 2.440660       7.899022 
1 1 1 20  3  30 o 8.910172 4.333723 -3.774884      2.995695 -6.836902      4.908498 -1.957380      3.781659 10.58864 5.229536 11.16308 5.276443 -0.5744371     7.428923 
1 1 1 20  3  31 o 10.08133 4.799184 -2.186471      3.238830 -3.283047      5.193292 -1.488478      4.143324 12.00942 5.809166 11.70858 5.530885 0.3008471      8.021041 
1 1 1 20  3  32 o 12.02605 5.283261 1.086262       2.983619 2.676471       4.167568 -0.5857129     4.273371 14.29067 6.262138 12.15259 5.702063 2.138083       8.469233 
1 1 1 20  4  0  o 77.69347 2.355885 73.70094       4.455256 70.96261       5.984860 77.10459       6.672439 76.16467 3.231860 79.37623 3.457811 -3.211555      4.733009 
1 1 1 20  4  1  o 134.0974 2.493849 219.3945       8.149419 213.9656       11.24648 225.3967       11.82533 132.2977 3.491468 135.7771 3.577085 -3.479401      4.998589 
1 1 1 20  4  2  o 224.7965 3.190571 617.1227       17.47809 614.6331       24.53066 619.6898       24.90920 224.0930 4.492052 225.0014 4.542954 -0.9084473     6.388815 
1 1 1 20  4  3  o 61.25386 2.854516 45.90235       4.249189 44.95351       5.495183 47.31337       6.701212 60.52698 3.743933 62.01204 4.464344 -1.485054      5.826440 
1 1 1 20  4  4  o 95.92078 2.561942 112.3670       5.983139 115.6879       8.627639 109.2901       8.304482 97.21439 3.648351 94.48849 3.613255 2.725891       5.134790 
1 1 1 20  4  5  o 65.34384 2.847411 52.23365       4.523213 49.65958       5.855390 56.04267       7.122830 63.60973 3.794676 67.51520 4.352461 -3.905468      5.774382 
1 1 1 20  4  6  o 133.0266 3.558698 216.5190       11.52591 211.3975       19.37080 219.3260       14.34080 130.9174 6.088429 133.7388 4.406293 -2.821381      7.515609 
1 1 1 20  4  7  o 79.39954 3.533851 77.24302       6.820447 69.99232       10.97509 81.80508       8.705596 75.16055 6.043033 81.59412 4.394495 -6.433578      7.471936 
1 1 1 20  4  8  o 151.7112 3.782810 281.6862       13.98518 285.6471       23.66539 279.5607       17.33619 152.0193 6.402537 150.8797 4.720864 1.139633       7.954813 
1 1 1 20  4  9  o 33.92854 4.397679 14.34963       3.550550 15.32172       4.335954 12.37120       6.185736 34.91880 5.258540 30.95564 8.105872 3.963152       9.662164 
1 1 1 20  4  10 o 147.6047 3.178579 266.4725       11.43324 272.2416       15.58435 259.7483       16.82490 148.8998 4.299455 145.3142 4.757670 3.585632       6.412545 
1 1 1 20  4  11 o 95.71778 2.971986 112.1479       6.923871 112.2770       9.065965 111.9673       10.72560 95.61491 3.899099 95.32907 4.630858 0.2858429      6.053745 
1 1 1 20  4  12 o 162.7693 3.327826 324.4710       13.19986 320.3733       17.79283 329.4867       19.68511 161.3254 4.530400 163.4457 4.947988 -2.120331      6.708734 
1 1 1 20  4  13 o 33.16559 4.432081 13.77287       3.492464 13.35740       4.094037 14.88328       6.692968 32.45588 5.363511 33.70688 8.222592 -1.250996      9.817244 
1 1 1 20  4  14 o 48.17109 3.779091 28.68769       4.400696 29.55709       5.466053 27.08594       7.419262 48.72029 4.660670 46.05350 6.816504 2.666790       8.257517 
1 1 1 20  4  15 o 75.58562 2.808818 70.09462       5.164673 70.28439       6.123210 69.62679       9.614160 75.58228 3.332669 74.67406 5.318108 0.9082184      6.276062 
1 1 1 20  4  16 o 80.65250 2.847245 79.88605       5.587236 81.51102       6.727701 76.27425       10.03013 81.33372 3.401887 78.04980 5.305027 3.283920       6.302075 
1 1 1 20  4  17 o 54.65140 3.207717 36.87532       4.253238 36.76515       4.956544 37.18300       8.283267 54.43691 3.759456 53.84107 6.440873 0.5958405      7.457771 
1 1 1 20  4  18 o 46.31253 3.590219 26.67021       4.020248 26.08370       4.699929 28.26958       7.761203 45.60569 4.278965 46.41704 7.085643 -0.8113518     8.277431 
1 1 1 20  4  19 o 29.23863 5.465078 11.14967       3.750808 11.07051       4.428869 11.35047       7.053667 28.81667 6.466175 28.77871 9.033399 0.3795815E-01  11.10917 
1 1 1 20  4  20 o 13.52435 5.902266 -0.3574398     3.669439 -1.719770      3.849414 13.19814       12.14262 12.76464 5.775233 30.99330 11.72720 -18.22866      13.07213 
1 1 1 20  4  21 o 37.27808 3.756260 17.55619       3.365805 16.29887       4.836798 18.73668       4.686686 35.03696 5.872555 37.93155 5.207562 -2.894581      7.848924 
1 1 1 20  4  22 o 11.14514 4.830188 -0.1055978     2.421967 2.389287       3.558279 -2.259222      3.305976 15.98043 6.267647 11.16723 5.163441 4.813192       8.120623 
1 1 1 20  4  23 o 27.65700 5.269827 10.30928       3.422071 13.46183       4.097392 3.039130       6.222255 31.55788 5.529419 19.18942 8.003572 12.36846       9.727880 
1 1 1 20  4  24 o 12.45201 5.574634 -0.7554407     3.481073 -0.5910391     4.500963 -1.000158      5.491424 14.20430 6.350461 15.27043 6.904480 -1.066123      9.380842 
1 1 1 20  4  25 o 14.61760 6.121440 1.501666       3.661910 6.821698       4.787753 -5.997495      5.684351 21.33748 7.467010 12.81338 6.167959 8.524103       9.685038 
1 1 1 20  4  26 o 16.38435 5.593914 3.691811       2.680390 4.051341       3.710659 3.299521       3.876034 17.35870 6.501164 16.56191 6.527603 0.7967949      9.212749 
1 1 1 20  4  27 o 29.83420 4.390587 12.15636       3.096706 12.57027       4.331575 11.72364       4.428854 28.73785 6.354203 27.40468 6.690917 1.333174       9.227365 
1 1 1 20  4  28 o 23.65139 5.258276 8.231711       2.952186 8.405056       4.151729 8.054421       4.198709 22.47379 6.910600 21.93773 6.980265 0.5360603      9.822449 
1 1 1 20  4  29 o 14.99355 5.547746 3.211876       2.686398 -1.411899      3.801488 7.824248       3.796798 11.70898 5.455854 21.50395 6.607921 -9.794970      8.569187 
1 1 1 20  4  30 o 10.42315 4.791399 -0.7607908     2.788197 -2.255595      3.752074 1.082586       4.166642 10.93935 5.195570 13.57530 6.086590 -2.635946      8.002533 
1 1 1 20  4  31 o 16.45992 5.849246 4.540996       2.946509 5.234750       3.888834 3.605891       4.514883 17.05611 6.590885 15.46519 6.647881 1.590915       9.361307 
1 1 1 20  5  0  o 59.19405 2.551225 42.83135       3.671488 44.76266       4.960262 40.49112       5.460204 60.44465 3.380998 57.42079 3.925762 3.023861       5.180999 
1 1 1 20  5  1  o 179.4247 2.796225 392.9296       12.22617 382.7974       16.90276 404.0478       17.70603 176.9501 3.919861 181.7832 3.996974 -4.833084      5.598313 
1 1 1 20  5  2  o 39.90935 3.263959 19.58308       3.146652 23.93162       4.142280 13.65000       4.838465 44.07180 3.897054 32.78635 6.284542 11.28545       7.394762 
1 1 1 20  5  3  o 25.95825 5.793373 8.599066       3.571725 5.287683       5.889060 10.52592       4.492272 22.70964 8.244498 28.68224 6.568784 -5.972601      10.54138 
1 1 1 20  5  4  o 144.7839 3.198537 256.0728       11.28516 240.9946       21.23064 262.0109       13.32327 139.8169 6.246912 146.3369 3.739183 -6.519943      7.280480 
1 1 1 20  5  5  o 131.0213 3.543656 210.0159       11.30396 226.6605       19.50842 201.6028       13.86963 135.6351 5.916429 128.2183 4.445659 7.416794       7.400541 
1 1 1 20  5  6  o 79.72754 2.781394 77.71147       5.395618 70.98417       6.748343 89.63359       8.983662 76.09889 3.649644 85.43806 4.328960 -9.339165      5.662138 
1 1 1 20  5  7  o 179.8490 3.405626 395.4672       14.92592 395.1176       20.28086 395.8804       22.04636 179.4476 4.641704 179.5074 5.044863 -0.5973816E-01 6.855367 
1 1 1 20  5  8  o 58.25523 3.115649 41.59554       4.406938 42.96336       5.530666 39.21672       7.293615 59.11628 3.860258 56.22227 5.389428 2.894005       6.629293 
1 1 1 20  5  9  o 31.90462 4.317570 12.70633       3.270755 13.06578       3.927397 11.89278       5.908509 32.20092 5.180669 30.35235 7.909546 1.848572       9.455171 
1 1 1 20  5  10 o 54.28792 3.256627 36.18473       4.288507 34.62773       5.292872 39.16037       7.317080 52.97794 4.132446 56.12301 5.417336 -3.145073      6.813563 
1 1 1 20  5  11 o 177.0844 3.430601 384.0117       14.80425 395.8928       20.29773 370.5080       21.63936 179.3702 4.647583 173.3353 5.128606 6.034927       6.921172 
1 1 1 20  5  12 o 88.00903 2.941475 94.87174       6.299672 97.84655       8.014723 90.06285       10.19017 89.24642 3.693185 85.34367 4.920611 3.902748       6.152400 
1 1 1 20  5  13 o 64.95177 3.313582 51.84233       5.227420 53.96690       6.735161 48.62354       8.290095 66.10494 4.202741 62.42781 5.505722 3.677135       6.926471 
1 1 1 20  5  14 o 94.57039 2.715216 109.5641       6.250948 117.4006       7.675457 94.12888       10.77204 97.78945 3.225305 87.04593 5.100593 10.74352       6.034785 
1 1 1 20  5  15 o 53.84184 3.105549 35.68732       4.057399 34.56896       4.683846 39.04949       8.121221 52.88350 3.657037 55.55358 6.099101 -2.670082      7.111466 
1 1 1 20  5  16 o 17.76684 5.876349 3.800545       2.959323 3.755511       3.353397 3.959081       6.291880 18.05552 6.253428 21.35875 8.346944 -3.303230      10.42961 
1 1 1 20  5  17 o 35.44424 4.122494 15.76389       3.494384 15.28824       3.995369 17.31176       7.207447 34.70559 4.856923 35.80225 8.405717 -1.096657      9.708026 
1 1 1 20  5  18 o 24.99490 5.607252 8.186126       3.331103 7.278319       3.636720 12.91650       8.301582 23.48469 6.246492 30.74132 9.818844 -7.256634      11.63737 
1 1 1 20  5  19 o 42.56736 3.804044 22.69461       3.904467 21.87782       4.344090 26.12843       8.907000 41.61634 4.347559 43.45765 8.714217 -1.841312      9.738524 
1 1 1 20  5  20 o 44.05480 3.784954 24.38237       4.024056 27.48103       4.540084 13.02849       8.690592 46.69786 4.028975 30.17101 10.07290 16.52684       10.84877 
1 1 1 20  5  21 o 25.90756 7.144534 9.318802       4.656321 10.78162       5.089277 1.802183       11.53647 27.75565 7.392559 23.42575 10.33632 4.329901       12.70785 
1 1 1 20  5  22 o 19.66278 5.805712 5.218155       2.973561 0.5562416      5.066581 7.667675       3.672597 16.18670 7.000671 23.55196 6.283078 -7.365261      9.406725 
1 1 1 20  5  23 o 18.78055 5.414830 4.796180       2.613918 4.536399       3.904047 5.007260       3.519124 18.79124 6.726867 19.27028 6.409256 -0.4790440     9.291356 
1 1 1 20  5  24 o 9.480000 4.386066 -1.621666      2.390991 -1.693573      3.542736 -1.561515      3.240222 11.82738 5.423612 11.35501 5.199481 0.4723654      7.513332 
1 1 1 20  5  25 o 30.26349 4.404027 12.25722       3.152697 10.57232       4.566191 13.79215       4.358247 26.35416 6.994605 31.04471 5.977743 -4.690552      9.200974 
1 1 1 20  5  26 o 14.51674 5.412703 2.579916       2.566397 1.791247       3.517223 3.477921       3.753117 14.54234 6.037427 16.65134 6.463814 -2.109002      8.844852 
1 1 1 20  5  27 o 19.42764 6.221326 5.753067       3.331135 6.043996       3.909966 4.982845       6.361902 19.68793 6.755246 19.03733 8.026175 0.6506004      10.49061 
1 1 1 20  5  28 o 12.51710 5.379056 0.8999223      2.954300 -0.4499589E-01 3.494148 3.268984       5.532640 12.41969 5.570717 16.88368 7.308838 -4.463992      9.189776 
1 1 1 20  5  29 o 8.992552 4.257167 -2.034343      2.479963 2.278006       3.583719 -5.997076      3.435377 14.37478 6.040055 8.819789 4.359441 5.554991       7.448959 
1 1 1 20  5  30 o 13.39063 5.620713 1.983289       3.098391 1.395467       3.740222 3.268957       5.531451 13.40554 5.901388 15.91573 7.082689 -2.510187      9.219049 
1 1 1 20  5  31 o 12.51650 5.446082 1.329222       3.104301 0.5289609      3.722369 3.156962       5.625494 12.47275 5.657508 15.46117 6.989727 -2.988417      8.992423 
1 1 1 20  6  0  o 68.95355 2.698885 58.11224       4.526240 59.23705       5.516628 55.79544       7.917347 69.56940 3.263106 67.32518 4.858441 2.244225       5.852547 
1 1 1 20  6  1  o 48.74410 3.043181 29.12277       3.596780 27.90354       4.246904 32.21591       6.764384 47.64090 3.686776 50.95092 5.536973 -3.310020      6.652096 
1 1 1 20  6  2  o 77.82323 3.084013 74.07439       5.837148 64.79853       10.08406 78.74857       7.158326 72.42095 5.761389 80.18301 3.673231 -7.762054      6.832732 
1 1 1 20  6  3  o 51.64168 3.564368 32.74930       4.458067 31.03312       7.496102 33.68847       5.545311 49.83853 6.313578 52.27658 4.393557 -2.438053      7.691853 
1 1 1 20  6  4  o 150.8252 3.086396 277.8609       11.34388 271.9264       15.23776 285.2389       16.99029 148.9909 4.201062 152.5217 4.576409 -3.530792      6.212281 
1 1 1 20  6  5  o 97.24242 2.794964 115.5565       6.616331 124.9298       8.800102 103.3683       10.03482 101.0197 3.580412 91.74577 4.502104 9.273888       5.752243 
1 1 1 20  6  6  o 114.6495 2.882660 160.6396       8.047430 166.3391       10.69412 153.1984       12.21935 116.5440 3.770430 111.7193 4.497513 4.824715       5.868881 
1 1 1 20  6  7  o 20.66462 5.403791 5.441437       2.751534 5.283250       3.167960 5.927282       5.551922 20.51415 5.974956 23.05486 8.042720 -2.540703      10.01925 
1 1 1 20  6  8  o 123.3737 2.954595 185.9993       8.882940 192.9765       11.78909 176.8351       13.51097 125.4796 3.860004 119.9559 4.630683 5.523705       6.028503 
1 1 1 20  6  9  o 78.74114 2.927782 75.88549       5.608149 88.69843       7.212264 56.29026       8.919128 85.06193 3.486759 67.38667 5.478631 17.67525       6.494065 
1 1 1 20  6  10 f 14.56350 5.555021 1.820331       2.737997 2.518767       3.122322 -0.5043971     5.696402 16.14574 5.979692 17.19727 7.430364 -1.051523      9.537663 
1 1 1 20  6  11 o 86.38671 3.395912 91.53238       7.134977 95.73729       10.09587 87.33659       10.08490 88.08465 4.720593 84.06811 4.944544 4.016541       6.836119 
1 1 1 20  6  12 o 199.0392 3.267352 485.2817       15.84786 500.3494       20.06776 460.3125       25.83312 201.8062 4.080641 192.8390 5.502883 8.967178       6.850792 
1 1 1 20  6  13 o 90.41379 2.789564 100.1391       6.138853 99.05688       6.799162 104.9133       14.28023 89.86514 3.109445 91.50510 6.445265 -1.639961      7.156123 
1 1 1 20  6  14 o 23.45554 5.295372 7.089013       2.954825 4.900541       3.182559 20.75975       7.954300 19.77116 6.045053 39.66536 8.485744 -19.89420      10.41876 
1 1 1 20  6  15 o 38.00559 4.353471 18.07755       3.959303 16.34650       4.377976 25.85157       9.277743 35.92294 5.148058 44.04028 8.950326 -8.117344      10.32525 
1 1 1 20  6  16 o 55.24373 3.226184 37.65480       4.324283 37.34083       4.740779 39.20980       10.55049 54.93775 3.560312 54.63042 8.176056 0.3073311      8.917607 
1 1 1 20  6  17 o 45.65130 3.444564 25.84738       3.803712 26.46913       4.307113 23.64419       8.107820 46.09533 3.870064 41.99567 8.216907 4.099659       9.082673 
1 1 1 20  6  18 o 72.70949 3.288962 65.40697       5.812462 68.59795       7.315073 59.94167       9.573349 74.17320 4.062533 68.51685 5.787719 5.656357       7.071200 
1 1 1 20  6  19 o 32.00809 5.375438 13.31724       4.044374 17.62132       4.985756 5.035492       6.915956 36.77259 5.752154 22.39899 8.751798 14.37360       10.47288 
1 1 1 20  6  20 o 36.98541 4.786180 17.58564       4.212706 13.27817       5.135805 26.44401       7.365027 31.19529 6.935467 44.28238 7.062113 -13.08708      9.898190 
1 1 1 20  6  21 o 13.95453 5.645563 1.344504       2.976514 0.3020911E-01  3.337419 6.454437       6.580698 13.16595 5.687989 22.91844 8.641830 -9.752485      10.34575 
1 1 1 20  6  22 o 35.12934 4.857090 16.17313       4.046847 19.30513       4.305583 -7.561542      11.85259 38.51595 4.683432 19.48488 9.248450 19.03108       10.36670 
1 1 1 20  6  23 o 13.00504 5.026935 1.621552       2.262727 -3.169441      3.282654 5.958553       3.123253 10.42011 4.922481 20.71246 5.902245 -10.29235      7.685526 
1 1 1 20  6  24 o 12.33946 4.984185 1.174448       2.315816 0.1464170      3.309490 2.160782       3.241679 12.89244 5.616239 14.94762 5.944684 -2.055175      8.178105 
1 1 1 20  6  25 o 22.93641 4.796502 7.251763       2.594572 6.273666       3.620153 8.284815       3.720462 20.60853 6.471911 23.65145 6.330306 -3.042927      9.053088 
1 1 1 20  6  26 o 20.09766 5.204045 5.776409       2.568630 4.258267       3.485922 7.579947       3.799480 17.46406 6.342655 22.24169 6.561469 -4.777628      9.125905 
1 1 1 20  6  27 o 10.12796 4.600343 -0.8148454     2.471745 -0.7088190E-01 3.585003 -1.488944      3.412521 12.69592 5.672431 11.35925 5.250022 1.336662       7.729114 
1 1 1 20  6  28 o 33.15922 4.469736 15.34389       3.519893 9.477715       4.573346 23.86853       5.513086 23.36831 7.264583 39.77148 5.864106 -16.40318      9.336054 
1 1 1 20  6  29 o 10.44118 4.750689 -0.5715731     2.649917 0.6332607      3.315814 -2.701287      4.408463 12.49790 5.526784 11.73837 5.591128 0.7595243      7.861683 
1 1 1 20  6  30 o 24.08335 6.182746 9.760919       3.646838 5.767934       4.062834 26.31884       8.273385 17.91585 6.782459 33.36303 9.637724 -15.44717      11.78505 
1 1 1 20  6  31 o 15.11791 5.784785 3.664739       2.975302 1.791380       4.009758 5.959835       4.438212 13.65265 6.055491 17.56968 6.966022 -3.917026      9.230083 
1 1 1 20  7  0  o 53.98865 2.677872 35.65915       3.512132 38.11071       4.715434 32.60464       5.263439 55.74257 3.488846 51.45395 4.235194 4.288628       5.487159 
1 1 1 20  7  1  o 72.99530 3.174849 65.19678       5.633965 56.42429       7.764920 74.94910       8.187092 67.71127 4.735726 78.14310 4.316116 -10.43182      6.407492 
1 1 1 20  7  2  f 98.06010 2.819857 117.4855       6.731381 116.5492       8.592305 118.9733       10.83098 97.58141 3.619593 98.46795 4.525847 -0.8865356     5.795235 
1 1 1 20  7  3  o 203.2250 4.150532 505.4355       20.55497 506.8231       24.57459 502.2038       37.50422 203.3133 4.960032 201.3791 7.656344 1.934204       9.122583 
1 1 1 20  7  4  o 62.15134 2.956913 47.28138       4.465580 44.54938       5.403272 53.16857       7.931787 60.24524 3.698248 65.65440 4.995088 -5.409161      6.215138 
1 1 1 20  7  5  o 139.4675 3.432400 237.7812       11.66560 258.0107       14.19366 195.6701       20.47857 145.1365 4.016979 125.7655 6.706178 19.37102       7.817221 
1 1 1 20  7  6  o 71.26784 3.093597 62.17667       5.359913 62.16790       6.072564 62.20760       11.40306 71.21507 3.509977 70.68226 6.700262 0.5328140      7.563957 
1 1 1 20  7  7  o 109.6442 3.212436 147.0850       8.574086 152.6564       9.999415 131.6136       16.66318 111.6320 3.680814 102.9980 6.674800 8.634064       7.622424 
1 1 1 20  7  8  o 82.08763 3.531582 82.61039       7.048001 82.61039       7.048001 0.000000       0.000000 82.08763 3.531582 ?        ?        0.000000       3.531582 
1 1 1 20  7  9  o 45.54954 3.520056 25.54786       3.876941 27.63351       4.310764 16.72223       8.867597 47.34832 3.767093 35.81674 9.852581 11.53158       10.54819 
1 1 1 20  7  10 o 87.03394 3.775469 93.01618       7.988430 100.5151       9.989538 79.71434       13.30458 90.32499 4.553069 79.81345 6.908476 10.51154       8.273904 
1 1 1 20  7  11 o 240.3863 4.683176 711.2658       27.43383 733.5038       33.33725 664.6140       48.28539 243.5771 5.616390 229.4467 8.651201 14.13046       10.31441 
1 1 1 20  7  12 o 61.68277 3.609935 46.83226       5.402526 48.58443       6.916976 44.09120       8.651454 62.64411 4.562337 59.29222 6.073365 3.351891       7.596097 
1 1 1 20  7  13 o 19.90729 6.219695 4.915196       3.347852 5.900035       3.996188 2.596935       6.131187 21.75127 6.795228 20.15598 8.121073 1.595289       10.58900 
1 1 1 20  7  14 o 95.32656 3.475280 111.7953       8.059580 116.0540       11.33135 107.4350       11.46577 96.70183 4.823743 92.93935 5.081868 3.762482       7.006702 
1 1 1 20  7  15 o 21.85722 6.325494 6.146969       3.560886 5.731677       4.216755 7.179266       6.648197 21.53635 7.008641 24.79887 8.788761 -3.262516      11.24115 
1 1 1 20  7  16 o 35.75712 5.029441 16.23395       4.261513 12.81498       5.164613 23.52773       7.543396 31.16176 6.975335 42.26651 7.603293 -11.10475      10.31821 
1 1 1 20  7  17 o 14.72681 5.708831 1.834178       2.924492 2.141880       3.267674 0.5957645      6.555501 15.65270 6.043479 18.80308 8.045208 -3.150378      10.06226 
1 1 1 20  7  18 o 45.00292 3.770922 25.30097       4.097474 25.66523       4.786034 24.30116       7.929187 45.12716 4.408279 42.38861 7.968598 2.738541       9.106672 
1 1 1 20  7  19 o 64.96194 3.348945 52.44357       5.283658 52.00227       6.394965 53.39283       9.379076 64.37689 4.097624 64.15271 6.071667 0.2241821      7.325003 
1 1 1 20  7  20 o 25.27200 5.817563 8.560867       3.508508 7.352151       4.142242 11.62959       6.600126 23.27974 6.846641 28.58834 8.698390 -5.308609      11.06971 
1 1 1 20  7  21 o 44.85212 4.230941 25.67575       4.569767 28.43366       5.518724 19.65994       8.150725 46.86480 4.904882 36.27087 9.206985 10.59393       10.43199 
1 1 1 20  7  22 o 12.94384 5.679721 -0.2794102     3.438938 -1.619922      4.069722 3.067747       6.430838 12.99839 5.903689 19.50248 8.135568 -6.504093      10.05192 
1 1 1 20  7  23 o 16.77266 5.841900 3.602779       2.928544 3.342042       3.294503 4.584683       6.393276 16.66759 6.147843 20.32482 8.255277 -3.657228      10.29299 
1 1 1 20  7  24 o 10.06208 4.691785 -2.090039      2.819217 -2.081302      3.074213 -2.136246      7.069881 10.60285 4.928902 16.28522 7.537232 -5.682368      9.005773 
1 1 1 20  7  25 o 10.11598 4.500453 -0.4310469     2.231723 -2.513283      3.149667 1.668375       3.162638 10.37274 4.875878 14.06458 5.770548 -3.691838      7.554695 
1 1 1 20  7  26 o 22.84620 5.057291 7.399339       2.741111 6.909979       3.494826 8.181639       4.418734 21.34060 6.292199 22.63530 7.155819 -1.294697      9.528773 
1 1 1 20  7  27 o 10.82951 4.749378 0.6524857E-01  2.401665 -1.142759      3.155451 1.728651       3.702758 11.14118 5.112521 14.40082 6.099816 -3.259641      7.958996 
1 1 1 20  7  28 o 11.13048 4.801915 0.5065835      2.372095 -1.578087      3.316910 2.688905       3.393707 10.94967 5.100117 14.85025 6.020866 -3.900575      7.890629 
1 1 1 20  7  29 o 19.69629 5.623117 6.160590       2.832238 2.485627       3.815579 10.67010       4.226674 14.62919 6.194093 24.79220 6.795092 -10.16301      9.194567 
1 1 1 20  7  30 o 10.23203 4.702834 -0.7139554     2.684670 -0.2530273     3.896209 -1.130627      3.704440 12.26438 5.647314 11.46375 5.356179 0.8006306      7.783368 
1 1 1 20  7  31 f 13.55623 5.508734 2.518113       2.848441 1.538687       4.118261 3.416403       3.943996 13.50245 6.052752 14.99027 6.319695 -1.487824      8.750677 
1 1 1 20  8  0  o 69.12519 2.891511 58.43560       4.860011 59.12805       7.724445 57.98188       6.252704 69.34130 4.597252 68.77006 3.745196 0.5712433      5.929690 
1 1 1 20  8  1  o 85.00317 2.524225 88.25244       5.222975 89.29025       7.415237 87.23062       7.357902 85.39928 3.571035 84.40523 3.585411 0.9940491      5.060382 
1 1 1 20  8  2  o 74.98837 2.793924 68.74640       5.096647 67.66275       6.509960 70.46239       8.192022 74.31103 3.605680 75.72629 4.458972 -1.415260      5.734401 
1 1 1 20  8  3  o 55.14624 2.863175 37.23340       3.834512 36.44443       5.095840 38.26327       5.822070 54.44837 3.865701 55.73753 4.320112 -1.289162      5.797155 
1 1 1 20  8  4  o 56.62021 2.840935 39.24587       3.907322 41.86453       5.175820 35.77602       5.957929 58.39646 3.655446 53.84022 4.584576 4.556240       5.863499 
1 1 1 20  8  5  f 173.9488 3.017101 369.6483       12.78931 385.4986       19.39384 357.4510       17.01280 177.3007 4.492286 170.8681 4.085814 6.432541       6.072438 
1 1 1 20  8  6  o 227.7516 3.906358 634.9860       21.68051 619.6660       29.24961 653.6662       32.29834 224.5297 5.345768 230.4491 5.751342 -5.919357      7.852081 
1 1 1 20  8  7  o 124.3710 2.952756 189.0228       8.949169 182.8192       11.44674 198.7762       14.35271 122.1284 3.850991 127.1843 4.638657 -5.055969      6.028870 
1 1 1 20  8  8  f 151.6457 3.708424 281.6051       13.70426 311.1750       21.91709 262.6223       17.56051 158.7807 5.673454 146.0821 4.940026 12.69864       7.522761 
1 1 1 20  8  9  o 78.32050 4.964805 75.76617       9.426981 0.000000       0.000000 75.76617       9.426981 ?        ?        78.32050 4.964805 0.000000       4.964805 
1 1 1 20  8  10 o 27.34286 5.324389 9.529632       3.420086 11.02151       4.036494 5.732999       6.439278 29.35682 5.847837 23.51074 8.607910 5.846077       10.40641 
1 1 1 20  8  11 o 47.36414 2.938915 27.55436       3.375421 27.16809       3.733745 29.28203       7.896324 46.98315 3.281752 47.99570 6.953607 -1.012554      7.689118 
1 1 1 20  8  12 o 87.13057 2.547127 92.91398       5.402451 96.08086       6.264357 83.72214       10.67238 88.54517 2.907131 82.07033 5.365710 6.474846       6.102643 
1 1 1 20  8  13 o 105.2127 2.745750 135.6161       7.033864 137.7696       7.767766 125.8078       16.57740 105.9872 3.010556 99.91969 6.849582 6.067551       7.481993 
1 1 1 20  8  14 o 27.20269 3.938548 9.301590       2.534983 8.760483       2.742576 12.47545       6.642183 26.27757 4.440977 30.69505 8.559215 -4.417477      9.642739 
1 1 1 20  8  15 o 26.37589 4.160550 8.801146       2.585663 9.902243       2.807715 2.654282       6.633870 27.99106 4.249582 20.61690 8.396060 7.374155       9.410248 
1 1 1 20  8  16 o 19.64697 5.148201 5.001529       2.494059 4.267987       2.688420 9.531454       6.680830 18.34326 5.545353 27.11875 8.821606 -8.775492      10.41977 
1 1 1 20  8  17 o 47.60408 3.347264 28.10642       3.858274 29.11818       4.427056 24.91041       7.868286 48.33976 3.788397 43.18602 7.761846 5.153748       8.637025 
1 1 1 20  8  18 o 13.91105 5.286734 1.806934       2.474220 0.6282666      2.672831 8.865335       6.540774 12.67530 5.262741 25.97470 8.739531 -13.29941      10.20176 
1 1 1 20  8  19 o 9.001799 4.218637 -2.235912      2.327192 -2.606285      2.526256 -0.1597582     5.981187 9.236063 4.349391 17.23366 7.528006 -7.997599      8.694140 
1 1 1 20  8  20 o 83.53710 2.864671 86.47946       5.823006 84.80672       6.367070 95.03146       14.39655 82.56895 3.170256 84.09168 7.091398 -1.522736      7.767783 
1 1 1 20  8  21 o 19.36359 5.573009 5.034628       2.771183 4.710634       3.031995 6.678529       6.829628 18.85048 5.923316 23.04934 8.777824 -4.198858      10.58942 
1 1 1 20  8  22 f 20.30037 5.620138 5.642143       2.875039 7.610688       3.189730 -2.883637      6.638169 23.54805 5.634132 15.92178 7.345754 7.626268       9.257621 
1 1 1 20  8  23 o 39.52111 3.852596 20.13705       3.663333 21.51021       3.864219 7.950779       11.51162 40.80960 3.934359 24.64023 10.60382 16.16938       11.31018 
1 1 1 20  8  24 o 19.13625 5.955084 5.201113       3.072314 4.910110       3.197778 8.692789       11.07686 18.66848 6.105215 24.02932 10.37174 -5.360832      12.03522 
1 1 1 20  8  25 o 32.63189 5.388210 14.93909       4.135312 14.84478       4.810263 15.20620       8.095373 31.65009 6.455726 28.43990 9.721261 3.210190       11.66959 
1 1 1 20  8  26 f 29.86484 4.247989 12.06620       3.004492 9.864942       4.638271 13.65756       3.943712 24.66510 7.242547 30.88709 5.438063 -6.221987      9.056877 
1 1 1 20  8  27 f 12.38062 4.902305 1.591935       2.195395 1.995228       2.999393 1.126539       3.222066 13.87177 5.646919 13.18121 5.640057 0.6905546      7.981098 
1 1 1 20  8  28 o 11.08169 4.714268 0.6983406      2.228019 -1.238674      3.094059 2.784519       3.210983 10.77896 4.987884 14.77229 5.902706 -3.993328      7.727931 
1 1 1 20  8  29 o 11.28464 4.828170 0.8122843      2.360869 2.903208       3.167798 -1.800037      3.540802 14.60287 5.853423 10.94919 5.153985 3.653682       7.799110 
1 1 1 20  8  30 o 21.81641 5.434803 7.595718       2.878590 5.600953       3.872944 10.05783       4.302782 17.65725 6.635763 23.15103 7.018977 -5.493776      9.659161 
1 1 1 20  8  31 o 11.17230 4.864055 0.7889764      2.479297 2.605393       3.318161 -1.506876      3.730454 13.88646 5.821944 11.08109 5.238563 2.805367       7.831831 
1 1 1 20  9  0  o 66.64420 2.529361 54.27892       4.100345 54.46543       5.500312 54.04561       6.151745 66.67900 3.396213 66.37360 3.819484 0.3053970      5.111039 
1 1 1 20  9  1  o 110.4910 2.570199 148.9995       6.920375 149.4627       10.03845 148.5800       9.553336 110.4980 3.733363 110.1938 3.562320 0.3042526      5.160245 
1 1 1 20  9  2  o 32.42865 3.949276 13.05343       3.056634 17.51527       4.043039 7.100824       4.669866 37.54989 4.508436 23.94010 7.323129 13.60979       8.599664 
1 1 1 20  9  3  o 51.24922 2.987316 32.18803       3.714648 36.88766       4.888437 25.76625       5.714335 54.79899 3.682048 45.52138 5.247166 9.277611       6.410165 
1 1 1 20  9  4  o 161.4834 2.898391 318.4940       11.40567 311.2603       16.75122 324.7462       15.57323 159.3494 4.317778 162.8987 3.923059 -3.549255      5.833832 
1 1 1 20  9  5  o 53.53212 2.944417 35.11332       3.826257 35.05349       4.956211 35.20158       6.019843 53.38243 3.835480 53.37363 4.675478 0.8796692E-02  6.047396 
1 1 1 20  9  6  o 36.43153 4.584633 16.53435       3.980296 16.43620       4.979297 16.70808       6.624548 36.07820 5.864762 36.00937 7.777051 0.6883240E-01  9.740532 
1 1 1 20  9  7  o 27.00133 5.572837 9.304739       3.545256 9.353026       4.290338 9.200785       6.295079 26.97098 6.585715 27.21646 8.532526 -0.2454796     10.77848 
1 1 1 20  9  8  o 218.8256 4.544816 588.0787       24.23542 535.8740       38.24458 623.1102       31.32880 207.3071 7.583192 224.6595 5.727131 -17.35243      9.502885 
1 1 1 20  9  9  o 33.74105 3.978233 14.15318       3.208224 14.42656       3.636837 13.19410       6.811885 33.97656 4.503243 31.87075 8.581299 2.105812       9.691124 
1 1 1 20  9  10 o 70.10699 2.537809 60.14487       4.328517 62.25811       4.957591 53.36704       8.878554 71.28875 2.859537 65.46924 5.619351 5.819511       6.305082 
1 1 1 20  9  11 o 33.90810 3.392680 14.23179       2.765776 15.68581       3.038627 7.208844       6.678093 35.58924 3.551016 25.11177 8.816429 10.47747       9.504690 
1 1 1 20  9  12 o 49.91030 2.741829 30.57820       3.321965 31.65957       3.665043 25.59989       7.863801 50.75478 2.976297 44.54704 7.510837 6.207741       8.079048 
1 1 1 20  9  13 o 17.55572 4.901558 3.927392       2.176784 3.982660       2.313915 3.502131       6.418581 17.71574 5.090558 21.21223 8.387677 -3.496489      9.811570 
1 1 1 20  9  14 o 20.15870 4.683168 5.234098       2.256535 5.753284       2.386647 0.8581134      6.928900 21.13688 4.749602 19.66172 8.336907 1.475161       9.594934 
1 1 1 20  9  15 o 71.25131 2.660129 62.34103       4.610716 59.52451       4.917528 82.82259       13.26089 69.56819 2.907088 80.50501 6.823706 -10.93682      7.417150 
1 1 1 20  9  16 o 46.18160 2.921947 26.32395       3.271485 29.48140       3.613532 11.97452       7.703382 48.85582 3.050365 29.87259 9.448812 18.98323       9.928988 
1 1 1 20  9  17 o 59.49058 2.668859 43.59320       3.859249 46.79464       4.345663 31.64587       8.394961 61.58020 2.904050 48.94809 7.257460 12.63211       7.816920 
1 1 1 20  9  18 o 74.31074 3.075739 68.33429       5.557729 65.81355       6.163432 79.30138       12.85597 72.76584 3.485972 77.78606 6.852113 -5.020226      7.687877 
1 1 1 20  9  19 o 56.62836 2.797764 39.69955       3.848881 41.08176       4.342842 34.63927       8.309496 57.50173 3.110836 50.91704 6.872218 6.584690       7.543519 
1 1 1 20  9  20 o 8.915431 4.213405 -2.588526      2.409664 -2.194733      2.469277 -10.45022      11.03300 9.356832 4.372170 18.23508 8.729126 -8.878245      9.762864 
1 1 1 20  9  21 o 65.07851 3.099650 52.94669       4.901581 52.94669       4.901581 0.000000       0.000000 65.07851 3.099650 ?        ?        0.000000       3.099650 
1 1 1 20  9  22 o 29.14886 4.408227 11.14565       3.033579 11.48600       3.143269 6.522905       11.58434 29.55268 4.507054 24.49221 10.58920 5.060465       11.50846 
1 1 1 20  9  23 o 13.50442 5.237190 1.817706       2.462024 2.357964       2.694033 -0.9198527     6.064343 14.58911 5.523001 15.95716 7.231302 -1.368058      9.099190 
1 1 1 20  9  24 o 10.75665 4.799823 -0.5299356     2.558207 -0.4045059     2.625955 -2.867128      11.33534 11.01713 4.892711 19.13389 9.070930 -8.116758      10.30633 
1 1 1 20  9  25 o 21.43620 5.236413 6.544858       2.711547 8.828907       3.047951 -2.122656      5.937484 25.03039 5.168223 14.66887 6.829472 10.36153       8.564590 
1 1 1 20  9  26 o 31.68435 4.163116 13.55392       3.136705 13.24664       3.417432 15.19705       7.902667 30.93996 4.678511 27.48781 9.595091 3.452154       10.67493 
1 1 1 20  9  27 o 11.15506 4.859272 0.3015687      2.477361 -1.028149      2.728579 6.541626       5.910866 10.37844 4.759405 19.69498 7.960117 -9.316545      9.274448 
1 1 1 20  9  28 o 10.36207 4.478276 0.3676105      2.070271 -1.299486      2.817257 2.324714       3.052480 10.20905 4.736435 14.03418 5.702745 -3.825125      7.413172 
1 1 1 20  9  29 o 15.22760 5.649044 3.512881       2.788680 9.567520       4.646157 0.1033826      3.486543 22.36390 7.361582 12.14056 5.494246 10.22335       9.185839 
1 1 1 20  9  30 o 11.00771 5.013144 -0.2249511     2.959498 -1.637160      4.813796 0.6331738      3.752438 12.36618 5.876592 12.64487 5.713356 -0.2786961     8.196144 
1 1 1 20  10 0  o 62.04288 3.162894 47.14226       4.766256 47.09002       8.238136 47.16855       5.843579 61.68484 5.539351 61.97956 3.888556 -0.2947235     6.767960 
1 1 1 20  10 1  o 68.23172 2.649212 56.91520       4.396562 55.63058       6.007715 58.39653       6.451313 67.35163 3.674286 68.98885 3.852668 -1.637222      5.323855 
1 1 1 20  10 2  o 194.1934 3.175902 460.7495       15.02927 454.5651       22.59252 465.6588       20.12929 192.4837 4.820327 195.0176 4.235634 -2.533951      6.416864 
1 1 1 20  10 3  o 99.53097 2.580343 121.0139       6.253242 118.9217       8.776459 123.1711       8.911939 98.53819 3.661294 100.2868 3.652738 -1.748589      5.171805 
1 1 1 20  10 4  o 106.3522 2.591154 138.0948       6.715463 135.3271       9.477152 140.8860       9.517173 105.1057 3.705915 107.2543 3.646608 -2.148613      5.199188 
1 1 1 20  10 5  o 90.03481 2.977047 99.16196       6.522809 100.0206       10.61413 98.64095       8.268385 90.13170 4.850354 89.68763 3.791692 0.4440689      6.156530 
1 1 1 20  10 6  o 12.40496 5.451505 -0.8236141     3.179045 -1.808434      3.816752 1.407344       5.744619 12.92268 5.807171 18.79450 7.751076 -5.871818      9.685164 
1 1 1 20  10 7  o 140.8157 3.754298 243.0566       12.87148 238.0490       19.89888 246.6592       16.87792 138.7499 5.898642 141.5604 4.900003 -2.810501      7.668376 
1 1 1 20  10 8  o 69.35966 2.920854 58.92432       4.925833 61.62649       5.945207 53.00777       8.797198 70.86256 3.453215 65.31418 5.580558 5.548378       6.562570 
1 1 1 20  10 9  o 123.1634 2.639232 185.4091       7.921277 193.4147       9.591198 168.2326       14.04903 125.7141 3.130782 116.7595 4.948846 8.954613       5.856012 
1 1 1 20  10 10 o 60.42736 2.600041 44.72397       3.819729 46.33640       4.297464 38.65726       8.335820 61.47359 2.876694 55.44750 6.279639 6.026096       6.907187 
1 1 1 20  10 11 o 66.84557 2.520629 54.71645       4.098631 52.88694       4.579853 62.07557       9.185356 65.66830 2.868857 70.60730 5.378871 -4.939003      6.096113 
1 1 1 20  10 12 o 52.11134 2.694951 33.33014       3.410683 32.69191       3.746106 36.42287       8.246425 51.56460 2.994086 53.61079 6.440990 -2.046188      7.102880 
1 1 1 20  10 13 o 10.70007 4.460112 0.3133231      1.930578 0.7907441      2.029430 -4.232341      6.262128 11.62818 4.676775 15.60319 7.175532 -3.975012      8.565073 
1 1 1 20  10 14 o 71.23569 2.556349 62.25279       4.430464 64.74079       4.990951 53.00437       9.622583 72.59266 2.826737 64.64668 6.183414 7.945976       6.798901 
1 1 1 20  10 15 o 26.82490 5.114222 9.270408       3.221143 8.047677       3.653851 13.53506       6.823813 24.77741 6.094289 31.64987 8.617400 -6.872458      10.55462 
1 1 1 20  10 16 o 28.80780 4.979493 10.67053       3.369267 9.813135       3.835286 13.56949       7.052258 27.34511 5.926852 31.47227 8.835323 -4.127157      10.63910 
1 1 1 20  10 17 o 46.34884 4.070887 26.94864       4.551285 30.72778       4.887342 2.269087       12.48951 49.50811 4.087365 25.29321 10.96520 24.21490       11.70223 
1 1 1 20  10 18 o 44.17448 4.180026 24.63409       4.446207 25.26139       4.689981 19.06612       13.97284 44.66916 4.364115 35.36160 12.71798 9.307564       13.44591 
1 1 1 20  10 19 o 52.09794 3.868915 34.16688       4.876799 36.46004       5.218687 18.36551       13.69906 53.76234 4.012269 34.12670 12.54522 19.63564       13.17121 
1 1 1 20  10 20 o 40.44977 4.472976 21.04268       4.335515 19.94842       5.311369 23.22758       7.505181 38.69754 5.811713 40.46462 7.894703 -1.767078      9.803181 
1 1 1 20  10 21 o 38.65906 3.934140 19.12401       3.654692 22.54031       4.328839 10.64572       6.819418 41.80680 4.310748 26.66888 8.923203 15.13793       9.909899 
1 1 1 20  10 22 o 13.05786 5.368300 1.105734       2.744187 -0.4264233E-01 3.091177 5.376710       5.961359 12.42719 5.420469 20.76096 8.121414 -8.333769      9.764162 
1 1 1 20  10 23 o 65.17336 2.627596 53.18607       4.164603 53.49833       4.712557 52.07269       8.898585 65.11691 2.977677 61.09042 6.057063 4.026493       6.749413 
1 1 1 20  10 24 o 8.067673 3.802316 -1.852161      1.937878 -1.789218      2.066084 -2.312636      5.588245 8.459726 3.967900 14.29712 6.645954 -5.837395      7.740345 
1 1 1 20  10 25 o 31.87735 3.866317 13.45105       2.942096 13.77909       3.040995 8.652347       11.63088 32.20866 3.957514 22.82772 10.20694 9.380939       10.94731 
1 1 1 20  10 26 o 8.059933 3.834086 -2.166366      2.059512 -3.058284      2.224567 3.183799       5.448370 7.874360 3.807281 17.14417 7.334911 -9.269814      8.264158 
1 1 1 20  10 27 o 30.74630 3.886080 12.81637       2.846735 13.92798       3.144837 7.772745       6.698733 31.84808 4.150755 20.48121 8.400183 11.36687       9.369730 
1 1 1 20  10 28 f 10.90008 4.722872 0.4860483      2.314440 -0.6867322     2.434443 11.50962       7.463670 9.942851 4.535336 22.26873 8.964455 -12.32588      10.04643 
1 1 1 20  10 29 o 24.93698 4.151895 8.843096       2.434380 9.752321       3.121840 7.432438       3.888532 25.16374 5.260551 20.26850 6.737143 4.895235       8.547660 
1 1 1 20  10 30 o 23.78656 4.686536 8.501312       2.619897 9.437144       3.405068 7.143474       4.101576 23.72679 5.911077 19.24670 6.894355 4.480093       9.081462 
1 1 1 20  11 0  o 56.65388 3.351029 39.36032       4.605742 38.58630       8.151412 39.72331       5.582213 55.67627 6.108122 56.83111 4.057426 -1.154839      7.332930 
1 1 1 20  11 1  o 123.5983 2.640088 186.4933       7.951829 193.4118       11.82487 180.7820       10.74387 125.6738 3.865735 121.5336 3.631746 4.140213       5.304101 
1 1 1 20  11 2  o 106.2280 2.585891 137.7581       6.693996 144.9983       9.838284 131.5169       9.134341 108.8103 3.715789 103.6357 3.622429 5.174522       5.189323 
1 1 1 20  11 3  o 198.4830 3.221814 481.5300       15.58331 477.4366       23.49686 484.7442       20.82120 197.2331 4.888706 198.9007 4.295694 -1.667542      6.507875 
1 1 1 20  11 4  o 150.7609 3.213451 277.8694       11.80583 262.5774       20.94263 284.9926       14.29339 145.8594 5.904177 152.5224 3.848686 -6.662994      7.047815 
1 1 1 20  11 5  o 87.42036 3.032245 93.52615       6.449930 94.56570       10.62947 92.92031       8.114578 87.57878 5.001337 87.02235 3.835902 0.5564346      6.302977 
1 1 1 20  11 6  o 106.4247 3.585101 138.8186       9.284524 149.8322       14.25765 130.7096       12.23403 110.1873 5.325592 103.0043 4.887861 7.183022       7.228632 
1 1 1 20  11 7  o 118.9515 2.954090 173.0099       8.563077 174.0531       10.89659 171.3254       13.84675 119.1224 3.758417 117.9302 4.828431 1.192139       6.118777 
1 1 1 20  11 8  o 78.87463 2.898048 76.18421       5.560835 75.11424       6.660200 78.64684       10.10421 78.22751 3.502632 79.69619 5.231627 -1.468681      6.295900 
1 1 1 20  11 9  o 85.21812 2.559165 88.84711       5.308526 93.45428       6.158117 75.52000       10.47366 87.35212 2.896940 77.95567 5.549632 9.396454       6.260246 
1 1 1 20  11 10 o 117.8455 2.620831 169.8465       7.526415 174.5249       8.945926 158.5127       13.92408 119.3338 3.078850 113.1621 5.062092 6.171707       5.924871 
1 1 1 20  11 11 o 62.51344 3.189329 48.03585       4.842517 49.36172       5.746543 44.78792       8.994122 63.26916 3.743901 59.60302 6.286938 3.666138       7.317266 
1 1 1 20  11 12 o 87.38982 3.109040 93.80275       6.610445 104.1183       8.190896 74.53322       11.19492 91.93503 3.663403 77.01975 6.012224 14.91528       7.040409 
1 1 1 20  11 13 f 58.86824 2.801261 42.58554       4.007033 43.34677       4.159709 32.78296       14.92712 59.37836 2.883360 48.00850 12.60195 11.36986       12.92760 
1 1 1 20  11 14 o 29.98520 3.509670 11.22453       2.516075 11.71987       2.569694 -0.2746165     12.38124 30.64940 3.503376 24.63363 10.79399 6.015778       11.34829 
1 1 1 20  11 15 o 110.9115 2.976803 151.4116       8.038409 151.4116       8.038409 0.000000       0.000000 110.9115 2.976803 ?        ?        0.000000       2.976803 
1 1 1 20  11 16 o 54.67466 2.520491 36.78911       3.349171 36.30629       3.620069 39.65770       8.823856 54.26339 2.746556 55.18687 6.698219 -0.9234810     7.239455 
1 1 1 20  11 17 o 13.78268 4.298369 2.369168       1.599718 2.840089       1.657309 -4.055718      6.121559 14.89864 4.316458 15.18539 7.023046 -0.2867422     8.243481 
1 1 1 20  11 18 o 24.63560 7.054407 8.261463       4.451038 11.16314       5.952683 4.581729       6.703416 28.24556 8.179711 21.62970 8.565754 6.615862       11.84398 
1 1 1 20  11 19 o 43.64088 5.021525 24.65668       5.243073 27.14722       7.340131 22.06212       7.491845 44.67899 6.968956 39.52004 8.052846 5.158951       10.64963 
1 1 1 20  11 20 o 60.20547 4.948048 47.02848       7.195478 51.78425       9.683875 41.16621       10.75155 61.85599 6.522460 53.25928 8.575081 8.596710       10.77379 
1 1 1 20  11 21 o 22.74794 7.299414 7.364279       4.583963 13.07747       6.903400 2.858625       6.130596 29.06338 8.906380 18.94283 7.925747 10.12055       11.92229 
1 1 1 20  11 22 o 42.55663 5.656753 24.74801       5.721233 28.37468       8.880774 22.17495       7.480355 42.51633 8.859352 37.97028 8.315119 4.546047       12.15028 
1 1 1 20  11 23 o 33.64679 6.471699 16.43199       5.113725 18.41077       7.671553 14.84968       6.860091 32.87355 9.210225 29.78299 8.824515 3.090567       12.75540 
1 1 1 20  11 24 f 13.77724 6.198952 -0.4554700     4.364435 -3.612927      6.399535 2.290117       5.967566 14.55959 6.876472 17.42496 7.566665 -2.865366      10.22449 
1 1 1 20  11 25 f 24.21947 7.387247 9.593234       4.756463 13.49975       7.277447 6.679963       6.284559 26.67296 9.213495 20.61052 8.250350 6.062445       12.36757 
1 1 1 20  11 26 o 15.61814 6.907288 1.583378       5.180403 -0.3992950     7.304308 3.589996       7.348283 16.18353 7.548079 18.22885 8.134412 -2.045324      11.09694 
1 1 1 20  11 27 o 23.41008 5.084319 8.080215       2.817269 9.069153       3.167425 4.334603       6.164291 24.53536 5.440313 17.68043 7.683875 6.854927       9.414825 
1 1 1 20  11 28 o 14.67095 5.503928 3.097369       2.661964 3.608587       2.904433 0.4133815      6.655011 15.48561 5.761226 15.21339 7.131035 0.2722273      9.167519 
1 1 1 20  11 29 o 22.45559 4.765801 7.554393       2.527140 7.021997       2.672444 12.05478       7.769907 21.22254 5.207202 21.40307 8.936554 -0.1805382     10.34297 
1 1 1 20  11 30 o 25.30425 4.559919 9.528571       2.708405 10.51369       2.881230 2.048198       7.939557 26.53840 4.623121 15.65792 7.470658 10.88048       8.785441 
1 1 1 20  12 0  o 85.82610 3.365254 90.17517       7.024748 86.70773       11.37271 92.31425       8.932499 83.80677 5.600780 86.72137 4.239639 -2.914604      7.024477 
1 1 1 20  12 1  o 97.29124 2.817075 115.6995       6.671918 115.9178       8.761548 115.3982       10.29355 97.27116 3.703007 96.94915 4.368195 0.3220062      5.726551 
1 1 1 20  12 2  o 123.2247 2.908562 185.5012       8.733981 182.3155       11.60712 189.6594       13.26085 121.9708 3.910156 124.3143 4.384241 -2.343559      5.874598 
1 1 1 20  12 3  o 152.7126 3.691054 285.4323       13.73604 300.5675       22.90105 276.9276       17.16682 156.0141 6.034971 150.1406 4.697755 5.873520       7.647861 
1 1 1 20  12 4  o 135.8946 3.590202 226.1842       11.87892 230.6161       19.01230 223.3461       15.21410 136.6803 5.720764 134.8058 4.638194 1.874481       7.364780 
1 1 1 20  12 5  o 77.01857 3.313076 72.70475       6.203633 73.98678       6.877380 67.10653       14.37142 77.64815 3.644765 72.86967 8.237390 4.778481       9.007713 
1 1 1 20  12 6  o 115.5307 3.303852 163.4746       9.291967 164.8054       10.57566 158.9694       19.45860 115.9145 3.748912 112.8725 7.110494 3.041924       8.038251 
1 1 1 20  12 7  o 192.2188 4.066504 453.4481       19.04816 471.4466       22.73939 411.1104       34.87571 195.7336 4.767355 181.0578 7.923604 14.67577       9.247225 
1 1 1 20  12 8  o 99.87064 2.785512 122.0768       6.772587 123.9312       7.315385 110.9535       17.91629 100.5931 2.987543 93.72000 7.918795 6.873146       8.463612 
1 1 1 20  12 9  o 125.0854 2.934158 191.5189       8.943888 195.5885       9.778975 170.6982       22.11909 126.3178 3.179347 116.2232 7.855935 10.09466       8.474901 
1 1 1 20  12 10 o 18.90614 6.031240 4.373885       3.132983 4.504313       3.249404 2.650947       11.81011 19.19617 6.144255 26.11238 10.96796 -6.916214      12.57172 
1 1 1 20  12 11 o 51.23495 2.868958 32.26228       3.567701 31.70444       3.686666 40.48976       14.15835 50.76929 2.993145 54.64174 11.01376 -3.872440      11.41323 
1 1 1 20  12 12 o 33.63687 3.210040 14.01862       2.599376 14.26789       2.781672 12.30166       7.300516 33.90093 3.413543 30.51596 9.118571 3.384970       9.736561 
1 1 1 20  12 13 o 72.60039 4.086947 65.35889       7.201401 70.02799       10.35506 60.98552       10.02176 74.53812 5.745130 69.43389 5.981166 5.104233       8.293424 
1 1 1 20  12 14 o 59.14283 4.374155 43.66534       6.259618 45.62379       8.707613 41.57096       9.004736 59.82228 6.056452 56.83236 6.626036 2.989918       8.976912 
1 1 1 20  12 15 o 9.350161 4.606113 -7.725546      3.725637 -10.45832      4.686740 -3.034003      6.140829 10.20508 5.052769 15.88721 7.229898 -5.682121      8.820539 
1 1 1 20  12 16 o 42.49899 5.098982 23.07204       5.175464 28.84145       7.354269 17.41135       7.284651 46.89875 6.618699 35.44871 8.535529 11.45004       10.80104 
1 1 1 20  12 17 o 39.98449 5.409872 20.70095       5.136157 31.17425       7.398044 10.95571       7.136271 48.68691 6.389520 28.10477 9.115475 20.58214       11.13184 
1 1 1 20  12 18 o 43.57210 5.038200 24.49775       5.251145 22.24310       7.262732 26.96753       7.601315 40.06366 7.718909 44.49942 7.259746 -4.435753      10.59648 
1 1 1 20  12 19 o 23.19481 7.004463 7.430092       4.290962 14.26386       6.003234 0.2916315      6.135605 31.56781 7.839528 17.43939 7.621075 14.12843       10.93339 
1 1 1 20  12 20 o 42.05779 5.454160 23.50789       5.458459 26.03682       8.180188 21.47805       7.328672 42.20557 8.249310 38.35438 8.095709 3.851192       11.55818 
1 1 1 20  12 21 o 57.69700 4.989592 43.94325       6.946553 38.07732       9.197172 51.73384       10.59914 51.23491 7.596064 60.02428 7.402835 -8.789364      10.60670 
1 1 1 20  12 22 o 13.79682 6.168427 -0.5382987     4.246891 -2.082184      6.170849 0.8509760      5.853713 15.38219 7.091662 16.77210 7.383131 -1.389910      10.23730 
1 1 1 20  12 23 o 38.23851 6.212381 21.00818       5.590381 20.41159       8.050587 21.56376       7.768920 34.25211 9.374003 35.85732 8.925992 -1.605209      12.94393 
1 1 1 20  12 24 o 13.79699 6.280292 -0.8641429     4.637354 0.5790511      6.340142 -2.524500      6.800446 16.52632 7.450523 15.37316 7.206762 1.153155       10.36570 
1 1 1 20  12 25 o 19.12039 7.219598 5.569177       4.596463 5.166742       7.440857 5.817503       5.845034 19.59554 8.479422 19.60603 7.918707 -0.1049042E-01 11.60200 
1 1 1 20  12 26 f 15.16693 7.037770 -0.4570127     6.223937 0.000000       0.000000 -0.4570127     6.223937 ?        ?        15.16693 7.037770 0.000000       7.037770 
1 1 1 20  12 27 f 13.61043 6.196725 0.1729511      4.517870 9.256033       7.267425 -5.548388      5.767835 20.95852 8.687808 12.25440 5.972176 8.704114       10.54253 
1 1 1 20  12 28 o 9.672156 4.239823 0.1327098      1.911956 -0.4584418     1.976406 8.755817       7.548465 9.154151 4.140287 19.78891 8.551776 -10.63476      9.501308 
1 1 1 20  12 29 f 18.00957 7.636764 6.512342       5.814482 -0.4950545     8.585741 12.44887       7.902521 15.31382 7.422284 21.29690 8.960178 -5.983085      11.63508 
1 1 1 20  13 0  o 39.78026 4.264527 19.60792       4.069590 19.50441       7.428527 19.65231       4.864509 38.92767 8.095043 39.67500 5.152989 -0.7473373     9.595990 
1 1 1 20  13 1  o 125.8659 3.049474 193.6073       9.353393 199.6266       17.85944 191.3322       10.97959 127.1900 5.777157 124.9982 3.608287 2.191742       6.811408 
1 1 1 20  13 2  o 232.7896 4.019176 663.8917       22.80010 622.3179       42.62941 680.5493       26.98394 223.5605 7.837008 235.4561 4.702830 -11.89558      9.139765 
1 1 1 20  13 3  o 107.4108 2.640206 140.9220       6.910695 130.5693       9.791418 151.1980       9.755081 103.1665 3.901702 111.0810 3.608541 -7.914490      5.314589 
1 1 1 20  13 4  o 95.71372 2.914619 112.0852       6.790249 109.4407       8.498876 116.7526       11.29100 94.45750 3.699385 97.35485 4.773808 -2.897346      6.039428 
1 1 1 20  13 5  o 103.1846 2.651536 130.1841       6.661753 136.9349       9.354111 123.2362       9.489634 105.6666 3.638121 100.1872 3.894298 5.479416       5.329304 
1 1 1 20  13 6  o 114.6349 2.982984 160.8528       8.325971 171.2477       10.69023 144.8251       13.27433 118.1356 3.718014 108.3049 5.043391 9.830750       6.265734 
1 1 1 20  13 7  o 63.94166 2.691961 50.07771       4.185199 52.85360       4.776898 40.90870       8.681737 65.65324 2.993629 57.06211 6.350910 8.591137       7.021102 
1 1 1 20  13 8  o 99.05379 3.025434 120.2401       7.294331 129.1263       9.236284 105.5116       11.89101 102.5072 3.703574 92.22271 5.313581 10.28452       6.476929 
1 1 1 20  13 9  o 84.64664 2.543540 87.71307       5.240727 92.38231       6.060709 73.87446       10.43389 86.81771 2.868638 76.96520 5.601427 9.852509       6.293256 
1 1 1 20  13 10 o 77.00260 2.511990 72.62617       4.707365 77.16620       5.391663 58.06856       9.654686 79.32696 2.793471 68.01956 5.882384 11.30740       6.511983 
1 1 1 20  13 11 o 61.08979 4.314606 46.32677       6.381798 51.26719       9.051164 41.44258       8.999508 63.79052 5.888979 57.05526 6.593926 6.735268       8.840811 
1 1 1 20  13 12 o 34.73088 5.853066 15.49935       4.777830 18.25285       6.471513 12.20033       7.083647 37.27013 7.386545 30.29121 8.965127 6.978916       11.61613 
1 1 1 20  13 13 o 48.27724 4.752792 29.27863       5.519060 27.01209       7.468487 32.00547       8.191827 45.58938 6.941324 49.69092 6.955225 -4.101536      9.826349 
1 1 1 20  13 14 o 56.36827 4.490734 39.81951       6.117658 40.84544       8.608124 38.77254       8.695893 56.31963 6.384598 54.73013 6.656805 1.589504       9.223673 
1 1 1 20  13 15 o 80.00637 4.375305 80.13892       8.497924 84.87274       11.44094 74.31327       12.69194 81.53233 5.796113 75.49947 6.977293 6.032852       9.070697 
1 1 1 20  13 16 f 44.01764 5.035217 24.78492       5.304013 23.29223       7.495513 26.28200       7.506514 41.39790 7.713702 44.31337 7.198106 -2.915474      10.55054 
1 1 1 20  13 17 o 15.01826 6.303256 0.8774068      3.895949 -3.508733      5.170884 6.636646       5.925243 13.90427 6.439008 23.01648 8.281391 -9.112203      10.49010 
1 1 1 20  13 18 o 23.83636 6.985930 7.823984       4.318919 4.279734       5.749941 12.41224       6.542220 20.32288 7.968403 29.27433 8.603031 -8.951454      11.72636 
1 1 1 20  13 19 o 63.12157 4.790163 51.49173       7.313235 59.49205       9.880314 41.79730       10.87622 66.67487 6.150234 53.60832 8.617475 13.06655       10.58708 
1 1 1 20  13 20 o 16.43459 6.724429 2.161661       4.279782 4.628802       6.210228 -0.6987245E-01 5.906258 20.46353 8.198045 16.61087 7.359393 3.852661       11.01674 
1 1 1 20  13 21 o 19.05736 8.212836 2.536130       6.924303 0.000000       0.000000 2.536130       6.924303 ?        ?        19.05736 8.212836 0.000000       8.212836 
1 1 1 20  13 22 f 41.06683 7.117860 24.98792       6.865221 31.33265       8.914059 15.73822       10.76298 44.41146 8.546719 28.42604 10.97005 15.98542       13.90641 
1 1 1 20  13 23 o 14.57330 6.763319 -2.100981      5.751235 0.000000       0.000000 -2.100981      5.751235 ?        ?        14.57330 6.763319 0.000000       6.763319 
1 1 1 20  13 24 o 14.68038 6.870211 -2.290423      6.135693 0.000000       0.000000 -2.290423      6.135693 ?        ?        14.68038 6.870211 0.000000       6.870211 
1 1 1 20  13 25 o 18.66799 7.252945 5.308027       4.728615 4.020522       7.195778 6.286577       6.273280 18.52558 8.169215 19.83297 8.131092 -1.307388      11.52609 
1 1 1 20  13 26 o 15.55309 6.677260 2.492711       4.544104 1.630085       6.769326 3.200252       6.130697 16.46751 7.530996 17.02856 7.523388 -0.5610466     10.64506 
1 1 1 20  13 27 f 15.15897 7.253712 -1.450558      7.602116 -1.450558      7.602116 0.000000       0.000000 15.15897 7.253712 ?        ?        0.000000       7.253712 
1 1 1 20  13 28 o 13.25928 6.274734 -1.317069      5.378039 7.065674       7.927550 -8.464386      7.320107 18.55820 8.351952 12.54697 6.230041 6.011231       10.41962 
1 1 1 20  13 29 o 15.77436 7.073534 3.510220       5.629579 -3.317848      8.243899 9.476525       7.706133 14.23174 6.978928 19.32679 8.490698 -5.095055      10.99079 
1 1 1 20  14 0  o 182.3945 3.973903 407.4985       17.66302 374.3824       29.01393 426.9985       22.26410 173.7907 6.864343 186.3873 4.906033 -12.59663      8.437319 
1 1 1 20  14 1  o 134.0929 3.140060 219.8436       10.26077 218.3367       19.36598 220.4317       12.09852 132.8996 5.995141 134.1314 3.704946 -1.231766      7.047577 
1 1 1 20  14 2  o 64.57327 4.066245 51.31335       6.366074 0.000000       0.000000 51.31335       6.366074 ?        ?        64.57327 4.066245 0.000000       4.066245 
1 1 1 20  14 3  o 158.2825 3.242017 306.5123       12.50502 302.3531       16.49067 312.1401       19.18253 156.8997 4.317112 159.2226 4.949862 -2.322922      6.567997 
1 1 1 20  14 4  o 69.97379 2.740115 59.93642       4.663370 61.10656       6.237577 58.45353       7.021868 70.53070 3.641451 68.88501 4.203044 1.645691       5.561092 
1 1 1 20  14 5  o 100.4357 2.619172 123.3700       6.404976 122.8689       8.867061 123.9167       9.261839 100.0569 3.642689 100.4533 3.790326 -0.3964310     5.256971 
1 1 1 20  14 6  o 34.29200 3.916509 14.61835       3.214245 15.92372       3.669075 10.31068       6.665180 35.74034 4.298919 28.48691 8.755377 7.253428       9.753837 
1 1 1 20  14 7  o 63.07760 3.130848 48.85085       4.797488 55.60096       5.821083 34.55714       8.470724 67.23164 3.565741 52.20370 6.821640 15.02795       7.697355 
1 1 1 20  14 8  o 143.2798 2.781268 251.2790       9.710999 251.7321       11.64308 250.2432       17.60270 143.2664 3.334935 142.1400 5.090126 1.126404       6.085324 
1 1 1 20  14 9  o 59.46529 2.567005 43.35316       3.711096 45.85997       4.113782 32.39642       8.600450 61.13321 2.768577 50.24321 7.232463 10.89000       7.744259 
1 1 1 20  14 10 o 27.93340 7.058468 10.22935       4.805919 5.734298       6.181232 17.10006       7.642021 23.04293 8.434146 35.76905 8.822966 -12.72611      12.20572 
1 1 1 20  14 11 o 38.78005 5.693588 19.18123       5.220476 23.55022       7.312747 14.64054       7.455046 42.49908 7.325421 33.00193 9.016064 9.497150       11.61685 
1 1 1 20  14 12 o 62.12378 4.779132 48.29895       7.179504 49.09848       9.305689 47.12317       11.28484 62.07516 6.236083 60.02559 7.906861 2.049576       10.07011 
1 1 1 20  14 13 o 22.92501 7.076182 6.796556       4.348078 5.526797       5.666574 8.614588       6.780481 22.15806 8.080853 26.08722 8.897283 -3.929161      12.01923 
1 1 1 20  14 14 o 123.8000 4.537088 191.7596       13.66466 188.1448       18.14422 196.4964       20.77042 121.3015 6.158280 123.1873 6.947150 -1.885857      9.283712 
1 1 1 20  14 15 o 31.02930 6.443738 12.82443       4.712920 11.51891       6.276505 14.51202       7.136079 28.89287 8.408662 32.18315 8.832685 -3.290279      12.19516 
1 1 1 20  14 16 o 26.15408 6.954693 9.321709       4.508834 13.22849       6.294190 5.203791       6.462031 30.70064 8.241136 22.02891 8.500455 8.671732       11.83951 
1 1 1 20  14 17 o 22.95276 6.893384 7.158686       4.164250 9.028320       5.788947 5.153774       5.994720 25.50612 8.204669 21.42807 8.208229 4.078049       11.60567 
1 1 1 20  14 18 o 19.90420 7.183100 4.922304       4.461807 2.947526       5.571146 8.454516       7.450902 18.81901 7.682776 24.97555 9.239583 -6.156538      12.01645 
1 1 1 20  14 19 f 18.17136 7.071915 3.541147       4.501439 1.270637       5.852989 6.828663       7.042873 17.57003 7.561127 22.99832 8.874338 -5.428293      11.65867 
1 1 1 20  14 20 o 70.89779 4.844952 66.00797       8.320327 81.55016       12.23853 52.65104       11.34558 76.51184 6.629288 59.78601 7.986998 16.72583       10.37977 
1 1 1 20  14 21 o 22.93670 8.102944 7.970102       5.647405 0.000000       0.000000 7.970102       5.647405 ?        ?        22.93670 8.102944 0.000000       8.102944 
1 1 1 20  14 22 o 17.04201 7.301747 2.171211       5.413511 0.000000       0.000000 2.171211       5.413511 ?        ?        17.04201 7.301747 0.000000       7.301747 
1 1 1 20  14 23 o 21.12075 7.460038 6.949200       4.786623 20.28813       7.715889 -1.395745      6.102913 33.88879 9.136583 15.22719 7.031738 18.66160       11.52920 
1 1 1 20  14 24 o 18.39760 7.123182 4.882641       4.548926 0.9604312      6.830939 8.007955       6.097640 16.83997 7.648526 21.69025 8.285887 -4.850277      11.27634 
1 1 1 20  14 25 o 22.05548 7.512692 8.449194       4.834089 14.71294       7.550560 4.098341       6.292880 26.46724 9.367555 17.96723 7.786322 8.500008       12.18105 
1 1 1 20  14 26 o 22.25633 7.733828 9.277941       5.131012 15.57418       8.419237 5.557631       6.471746 25.26792 9.715167 18.48885 7.953577 6.779066       12.55563 
1 1 1 20  14 27 o 20.14182 7.863592 8.123199       5.579779 6.232930       7.946583 9.961489       7.836565 18.47379 8.333689 20.65853 8.816517 -2.184742      12.13183 
1 1 1 20  14 28 o 17.95108 8.343722 6.274195       8.804958 6.274195       8.804958 0.000000       0.000000 17.95108 8.343722 ?        ?        0.000000       8.343722 
1 1 1 20  15 0  o 48.87269 3.679580 29.41124       4.350101 39.35837       8.674219 26.06895       5.028095 56.05033 6.469185 45.85883 4.559633 10.19150       7.914582 
1 1 1 20  15 1  o 147.6422 3.748641 267.2096       13.47625 0.000000       0.000000 267.2096       13.47625 ?        ?        147.6422 3.748641 0.000000       3.748641 
1 1 1 20  15 2  o 154.3561 2.861266 291.2730       10.76262 299.8514       16.18674 284.4753       14.40916 156.2415 4.255313 152.2820 3.886055 3.959534       5.762735 
1 1 1 20  15 3  o 79.19059 2.937326 76.80053       5.658594 82.44477       7.090429 66.90014       9.390662 81.95741 3.558643 73.47344 5.280016 8.483971       6.367301 
1 1 1 20  15 4  o 100.1145 2.585303 122.5839       6.302039 117.8307       8.690209 127.8564       9.152617 97.97031 3.646348 102.0503 3.686458 -4.079948      5.185154 
1 1 1 20  15 5  o 37.65292 3.425931 17.51706       3.109113 21.20152       3.884600 10.95009       5.186108 41.37733 3.898490 29.03547 7.329810 12.34186       8.302068 
1 1 1 20  15 6  o 57.22633 3.731543 40.37189       5.175416 47.07330       6.860667 31.52262       7.883819 61.63574 4.600893 49.85814 6.654839 11.77760       8.090432 
1 1 1 20  15 7  o 84.76077 2.531309 87.95295       5.222630 90.43491       6.008443 80.28230       10.56284 85.89110 2.874684 80.28870 5.430666 5.602394       6.144586 
1 1 1 20  15 8  o 71.70461 2.458471 62.97354       4.289488 63.43909       4.798776 61.12285       9.567833 71.92397 2.742947 69.86461 5.668443 2.059364       6.297222 
1 1 1 20  15 9  o 118.5258 3.817441 173.1973       11.01171 182.3592       17.25116 166.8974       14.30512 120.6635 5.884614 115.8266 5.080482 4.836884       7.774315 
1 1 1 20  15 10 o 57.12177 4.453220 40.64045       6.149912 43.52272       8.512836 37.49409       8.894276 58.60398 6.047648 54.03004 6.913404 4.573936       9.185271 
1 1 1 20  15 11 o 44.29106 5.133350 24.78874       5.438075 22.78492       7.344666 27.22020       8.090519 41.61480 7.519160 45.56081 7.551270 -3.946007      10.65643 
1 1 1 20  15 12 o 28.00187 6.801899 10.39864       4.594831 7.773093       6.160901 13.68950       6.897446 24.91715 8.481371 31.72621 8.674286 -6.809059      12.13165 
1 1 1 20  15 13 o 51.71861 4.536227 33.63892       5.659294 44.62881       8.519762 24.96063       7.570900 58.97772 6.011906 43.33790 7.436420 15.63982       9.562603 
1 1 1 20  15 14 o 15.03491 6.355847 0.5933504      4.006990 1.791574       5.416494 -0.8550773     5.955219 18.12026 7.504801 16.85159 7.431359 1.268669       10.56159 
1 1 1 20  15 15 o 83.02693 4.443516 86.87307       8.957710 91.37846       12.29034 81.76778       13.08301 83.99573 6.044842 78.74856 6.886794 5.247169       9.163407 
1 1 1 20  15 16 o 27.09362 7.199326 10.14558       4.833807 8.987769       6.381769 11.70383       7.403542 25.62851 8.632692 28.61728 9.284828 -2.988773      12.67799 
1 1 1 20  15 17 o 19.12465 7.305560 4.011260       4.740032 1.149760       6.227832 7.951199       7.307768 18.16837 7.808803 24.57722 9.139519 -6.408855      12.02116 
1 1 1 20  15 18 o 34.56520 8.449402 17.70820       7.056243 0.000000       0.000000 17.70820       7.056243 ?        ?        34.56520 8.449402 0.000000       8.449402 
1 1 1 20  15 19 o 28.09066 9.104965 12.35953       7.120498 0.000000       0.000000 12.35953       7.120498 ?        ?        28.09066 9.104965 0.000000       9.104965 
1 1 1 20  15 20 o 17.82820 6.930480 3.687474       4.319339 11.31654       6.567254 -2.128658      5.734098 26.63787 8.751356 14.90664 6.859264 11.73123       11.11916 
1 1 1 20  15 21 o 17.34948 6.858355 3.469430       4.290262 3.288574       6.388428 3.618005       5.790271 18.78378 7.986485 18.61169 7.738300 0.1720886      11.12049 
1 1 1 20  15 22 o 9.721601 4.783621 -7.004000      3.980421 -5.541838      5.977281 -8.169054      5.335550 13.27844 6.374502 11.44066 5.611119 1.837789       8.492287 
1 1 1 20  15 23 o 12.99803 5.976996 -1.372213      4.343680 -1.659030      6.452862 -1.134571      5.873687 15.31727 7.127426 14.99621 6.915541 0.3210649      9.931007 
1 1 1 20  15 24 o 17.19613 7.074433 3.783234       4.769896 6.819165       7.265244 1.483237       6.323651 20.40616 8.588703 16.54269 7.450874 3.863466       11.37020 
1 1 1 20  15 25 o 28.51550 7.551727 14.16257       5.329926 8.424335       7.936270 18.87715       7.193637 20.83397 8.881330 30.81720 9.011541 -9.983232      12.65251 
1 1 1 20  15 26 o 16.06362 6.878741 3.316531       4.799564 6.221900       7.577138 1.369673       6.202570 18.76025 8.322382 15.58464 7.157575 3.175611       10.97693 
1 1 1 20  15 27 o 22.99534 9.541688 14.80965       8.778486 14.80965       8.778486 0.000000       0.000000 22.99534 9.541688 ?        ?        0.000000       9.541688 
1 1 1 20  15 28 o 14.84623 6.847564 1.665710       5.762361 -1.067602      8.235175 4.287796       8.065879 14.98550 7.264576 16.86807 7.888504 -1.882579      10.72392 
1 1 1 20  16 0  o 126.9512 3.094322 197.1490       9.572787 200.3445       18.75114 196.0225       11.13286 127.1265 6.070328 126.4461 3.616696 0.6804428      7.066072 
1 1 1 20  16 1  o 43.89586 3.938486 23.82102       4.168243 19.53259       7.449100 25.77586       5.029326 38.80360 8.137944 45.56236 4.592269 -6.758759      9.344254 
1 1 1 20  16 2  o 160.4797 5.042728 317.7533       19.69621 0.000000       0.000000 317.7533       19.69621 ?        ?        160.4797 5.042728 0.000000       5.042728 
1 1 1 20  16 3  o 113.6956 2.653041 158.0469       7.350617 171.6257       10.68797 145.8596       10.12550 118.2276 3.714321 108.9585 3.819369 9.269165       5.327641 
1 1 1 20  16 4  o 69.51868 2.664576 59.19051       4.505686 64.93856       6.059927 52.08445       6.737857 72.70100 3.430183 64.93262 4.282070 7.768372       5.486555 
1 1 1 20  16 5  o 106.5970 2.750910 139.1380       7.139936 141.6110       9.395243 135.7574       10.98488 107.3536 3.596406 104.9178 4.305597 2.435791       5.610018 
1 1 1 20  16 6  o 89.45443 2.522753 97.96513       5.493874 97.49380       6.319232 99.42416       11.11833 89.16868 2.912049 89.46398 5.121222 -0.2953033     5.891260 
1 1 1 20  16 7  o 47.78892 2.657381 28.04628       3.082503 27.74687       3.358860 29.64446       7.760175 47.49432 2.916172 48.13973 6.804528 -0.6454048     7.403085 
1 1 1 20  16 8  o 32.19104 6.164566 13.38875       4.659821 15.47463       6.207240 10.69532       7.053548 34.27019 7.628914 28.74318 9.034875 5.527010       11.82494 
1 1 1 20  16 9  o 83.72284 3.890516 86.66419       7.915862 93.39332       11.79160 81.14381       10.68017 86.24258 5.641648 80.43203 5.481715 5.810547       7.866219 
1 1 1 20  16 10 o 116.7826 4.506593 169.5696       12.80108 186.2596       17.63087 150.9619       18.61622 121.4940 5.973324 108.5965 7.073091 12.89758       9.257927 
1 1 1 20  16 11 o 65.01864 4.736784 52.98872       7.453636 48.30706       9.472501 60.60022       12.07815 61.34621 6.431893 68.25780 7.378397 -6.911598      9.788258 
1 1 1 20  16 12 o 85.35945 4.464118 91.12929       9.253614 95.73940       12.35118 85.23048       13.97123 86.68761 5.881587 80.92879 7.158006 5.758820       9.264454 
1 1 1 20  16 13 o 30.94530 6.812789 12.82921       4.998179 17.02917       6.496758 6.738303       7.823760 35.37236 7.751519 24.61269 9.389731 10.75967       12.17592 
1 1 1 20  16 14 o 54.98347 7.977065 41.06320       10.37663 0.000000       0.000000 41.06320       10.37663 ?        ?        54.98347 7.977065 0.000000       7.977065 
1 1 1 20  16 15 o 30.83574 8.890336 13.65412       7.046358 0.000000       0.000000 13.65412       7.046358 ?        ?        30.83574 8.890336 0.000000       8.890336 
1 1 1 20  16 16 o 13.52820 6.398944 -5.316616      5.580501 0.000000       0.000000 -5.316616      5.580501 ?        ?        13.52820 6.398944 0.000000       6.398944 
1 1 1 20  16 17 o 30.39412 6.813235 12.90300       4.921321 15.17997       7.171674 10.87655       6.765656 31.77120 8.906442 27.15841 8.880302 4.612789       12.57714 
1 1 1 20  16 18 o 18.14132 6.866438 3.832590       4.163577 0.6138147      5.860480 7.112961       5.916289 17.03487 7.446189 22.70851 8.260692 -5.673641      11.12136 
1 1 1 20  16 19 o 19.95051 7.164266 5.381495       4.432024 9.232956       6.237377 1.453894       6.298729 24.61482 8.528405 17.82958 7.757748 6.785242       11.52894 
1 1 1 20  16 20 o 68.58887 4.878597 62.74518       8.101035 74.89117       11.54710 50.97268       11.36818 72.43328 6.614746 57.30472 8.389212 15.12856       10.68334 
1 1 1 20  16 21 o 30.49277 6.741385 13.85606       4.876064 20.77086       7.811406 9.441521       6.241396 34.94822 9.088152 24.00981 8.514993 10.93841       12.45390 
1 1 1 20  16 22 o 19.75102 7.345006 5.803051       4.719849 12.20106       7.749611 2.030419       5.950861 25.61981 9.432663 17.10986 7.490591 8.509947       12.04508 
1 1 1 20  16 23 o 46.56932 5.514900 31.04281       6.137219 33.87703       9.995446 29.32774       7.775473 42.23094 9.887878 42.30747 7.830091 -0.7653046E-01 12.61271 
1 1 1 20  16 24 o 19.33335 7.395340 6.109847       4.861581 7.620864       7.818325 5.157281       6.207639 20.64335 8.808034 18.68978 7.906398 1.953571       11.83607 
1 1 1 20  16 25 o 15.77099 7.201271 1.402590       6.158229 2.559661       7.432414 -1.131368      10.99891 17.06130 7.835521 17.23536 8.364686 -0.1740646     11.46139 
1 1 1 20  16 26 o 10.73788 5.236814 -5.004827      4.457098 -10.55369      7.013007 -1.244757      5.772981 11.93417 5.953602 13.82701 6.530687 -1.892838      8.837152 
1 1 1 20  16 27 o 14.53115 6.674903 1.207481       5.397472 7.168872       8.418761 -2.953029      7.033113 18.45878 8.425236 13.85534 6.715945 4.603439       10.77444 
1 1 1 20  17 0  o 139.9269 3.558431 240.1349       12.12393 238.3686       21.06772 241.0095       14.82469 138.4687 6.259713 139.9555 4.351986 -1.486877      7.623896 
1 1 1 20  17 1  o 167.9189 4.553570 347.3159       18.61601 323.9492       26.00250 371.8866       26.66398 161.1908 6.633885 172.8922 6.339421 -11.70140      9.175876 
1 1 1 20  17 2  o 132.2639 4.405722 215.5387       14.18038 241.8219       19.80689 187.9012       20.31077 139.5289 5.838171 122.5261 6.829419 17.00279       8.984720 
1 1 1 20  17 3  o 65.32111 2.819437 52.31573       4.477423 52.58828       5.585317 51.82563       7.489777 65.37814 3.518700 64.63545 4.789149 0.7426910      5.942828 
1 1 1 20  17 4  o 41.40669 3.241148 21.14881       3.244391 23.13105       3.929520 16.90364       5.750539 43.22627 3.768023 36.20770 6.766079 7.018566       7.744535 
1 1 1 20  17 5  o 61.57981 3.240313 46.64779       4.845408 52.70644       7.064602 41.26596       6.658317 65.19702 4.473670 57.57552 4.788909 7.621498       6.553425 
1 1 1 20  17 6  o 39.93967 2.949031 19.66085       2.850007 18.43789       3.011875 30.12992       8.812177 38.62561 3.229348 48.17383 7.770828 -9.548225      8.415133 
1 1 1 20  17 7  o 36.16140 6.341945 16.86484       5.384936 22.38017       6.962666 8.655337       8.494709 41.52352 7.138143 27.38134 9.907271 14.14218       12.21094 
1 1 1 20  17 8  o 78.34824 4.455692 76.29312       8.472011 84.18806       11.40753 66.58286       12.65122 81.78724 5.760456 71.97862 7.314078 9.808617       9.310134 
1 1 1 20  17 9  o 51.82949 8.224624 35.51352       10.04139 0.000000       0.000000 35.51352       10.04139 ?        ?        51.82949 8.224624 0.000000       8.224624 
1 1 1 20  17 10 o 32.12823 8.665318 14.05571       6.938807 0.000000       0.000000 14.05571       6.938807 ?        ?        32.12823 8.665318 0.000000       8.665318 
1 1 1 20  17 11 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 20  17 12 o 14.20434 6.640990 -4.812845      5.710087 0.000000       0.000000 -4.812845      5.710087 ?        ?        14.20434 6.640990 0.000000       6.640990 
1 1 1 20  17 13 o 28.09388 6.833457 10.68552       4.632791 7.131815       6.368594 14.67961       6.751688 23.92879 8.588602 32.36415 8.465590 -8.435368      12.05945 
1 1 1 20  17 14 o 15.98213 6.522614 1.668347       4.014094 6.108921       5.739895 -2.582164      5.615715 22.34436 8.135362 15.12355 6.894553 7.220810       10.66391 
1 1 1 20  17 15 o 21.18179 7.109616 5.889215       4.328743 10.52735       6.148959 1.332225       6.094933 27.17630 8.419476 18.22247 7.776053 8.953833       11.46100 
1 1 1 20  17 16 o 41.62236 5.357374 22.81392       5.308060 26.80473       7.728181 19.24989       7.303287 43.69641 7.529391 36.27687 8.423415 7.419540       11.29804 
1 1 1 20  17 17 o 17.05190 6.765411 2.807249       4.188996 6.263162       5.981212 -0.5198268     5.868663 21.94270 8.246380 16.33809 7.281458 5.604614       11.00102 
1 1 1 20  17 18 o 25.59994 7.243438 9.631331       4.720711 4.362780       6.579647 15.22053       6.776911 20.28576 8.323174 31.23559 8.621324 -10.94983      11.98342 
1 1 1 20  17 19 o 42.10648 5.697161 24.43159       5.695955 33.96565       8.626365 17.06156       7.584439 47.65926 7.689158 32.00584 9.222266 15.65342       12.00722 
1 1 1 20  17 20 o 15.95115 6.625194 2.174573       4.237998 2.169721       6.021804 2.179335       5.965460 17.63734 7.630097 17.59609 7.603254 0.4124260E-01  10.77162 
1 1 1 20  17 21 f 26.47114 7.204019 10.95895       4.770267 10.24734       7.185031 11.51986       6.379017 24.27884 9.055833 25.88936 8.629614 -1.610521      12.50913 
1 1 1 20  17 22 o 18.45233 7.791992 4.093584       6.011607 4.751050       7.262468 2.662577       10.71441 19.49803 8.406932 19.90421 9.235267 -0.4061813     12.48866 
1 1 1 20  17 23 o 24.14367 8.695887 11.11533       6.535182 12.97232       7.826940 6.840425       11.87545 25.01941 9.426711 21.02863 9.745135 3.990774       13.55841 
1 1 1 20  17 24 o 13.56870 6.475545 -3.142342      5.973427 0.000000       0.000000 -3.142342      5.973427 ?        ?        13.56870 6.475545 0.000000       6.475545 
1 1 1 20  17 25 o 12.89242 6.021790 -1.195847      4.676287 -5.185529      7.103347 1.855757       6.212380 13.58941 6.623864 15.86936 7.241089 -2.279947      9.813712 
1 1 1 20  17 26 o 22.99472 8.027764 10.97211       5.531883 13.31971       8.681827 9.367529       7.177595 22.15401 9.359980 20.29634 8.539274 1.857676       12.66998 
1 1 1 20  17 27 o 15.51994 7.042184 2.727714       5.773707 -2.191831      8.294771 7.351562       8.041623 14.74691 7.181315 18.38611 8.330081 -3.639201      10.99825 
1 1 1 20  18 0  o 49.18462 3.534437 29.82398       4.208045 16.49435       7.764277 35.36781       5.007225 35.36409 8.991084 53.52553 3.864866 -18.16144      9.786561 
1 1 1 20  18 1  o 13.59996 5.627017 0.6634665      3.040876 6.513888       6.025559 -1.335703      3.522318 23.87239 8.375137 12.64385 5.637670 11.22853       10.09585 
1 1 1 20  18 2  o 142.0598 3.854977 248.2877       13.33298 281.5164       22.12674 229.3443       16.70667 150.2258 6.056588 136.0593 5.047532 14.16650       7.884151 
1 1 1 20  18 3  o 79.75733 2.666093 77.95019       5.174533 79.52181       6.745232 75.70254       8.066549 80.40537 3.450545 78.25680 4.245797 2.148575       5.471110 
1 1 1 20  18 4  o 50.96255 3.146410 31.98107       3.888478 36.79729       4.565507 19.25784       7.420518 54.62406 3.447385 38.20676 8.214387 16.41730       8.908457 
1 1 1 20  18 5  o 39.75798 3.040793 19.50400       2.923743 22.83658       3.649878 13.53588       4.884347 42.95414 3.517667 32.30637 6.430336 10.64777       7.329611 
1 1 1 20  18 6  o 40.30992 8.106408 21.49298       7.686716 0.000000       0.000000 21.49298       7.686716 ?        ?        40.30992 8.106408 0.000000       8.106408 
1 1 1 20  18 7  o 71.06667 5.626694 63.63332       9.664937 0.000000       0.000000 63.63332       9.664937 ?        ?        71.06667 5.626694 0.000000       5.626694 
1 1 1 20  18 8  o 15.86641 6.534286 1.204661       4.074955 1.905019       5.445214 0.3131661      6.143476 18.46615 7.573622 18.12942 7.773276 0.3367367      10.85281 
1 1 1 20  18 9  o 29.48082 6.399053 11.45301       4.464980 14.09106       6.485864 9.076527       6.155918 32.22723 8.230517 26.34369 8.459454 5.883539       11.80270 
1 1 1 20  18 10 o 19.91636 7.177210 4.506670       4.452573 6.664397       6.132494 2.100997       6.475257 23.58081 8.432115 19.74247 8.193681 3.838341       11.75742 
1 1 1 20  18 11 o 54.79913 4.593175 37.89060       6.077320 42.90553       8.873094 33.45927       8.340835 57.41951 6.452874 50.35930 6.984401 7.060207       9.509019 
1 1 1 20  18 12 o 37.30785 5.821529 18.20173       5.119909 20.77338       7.301345 15.71385       7.181434 38.85392 7.978694 33.37403 8.731392 5.479893       11.82780 
1 1 1 20  18 13 o 35.98892 5.912155 17.10132       5.005136 25.00349       7.247622 9.896647       6.920376 42.96965 7.174229 26.78905 8.989363 16.18060       11.50123 
1 1 1 20  18 14 o 36.90047 5.674381 17.99078       4.939357 32.64526       7.747485 7.955237       6.411298 49.30622 6.614685 24.38552 8.631851 24.92070       10.87488 
1 1 1 20  18 15 o 39.71856 5.543177 20.88395       5.219285 30.81251       7.981818 13.46759       6.898491 47.22983 7.159207 30.09948 8.831105 17.13035       11.36849 
1 1 1 20  18 16 o 11.70079 5.499815 -3.476754      4.006259 -1.702879      5.480701 -5.512136      5.870805 15.11632 6.859884 13.69876 6.504070 1.417561       9.453091 
1 1 1 20  18 17 o 51.88550 4.929200 35.48742       6.157679 51.19885       9.703279 24.89414       7.967570 60.58331 6.683424 40.66885 8.320198 19.91447       10.67211 
1 1 1 20  18 18 o 28.32836 7.055256 11.87408       4.851964 10.85962       6.955296 12.83573       6.771810 25.96983 9.005426 28.13887 8.853656 -2.169044      12.62873 
1 1 1 20  18 19 o 17.90283 6.950457 3.933046       4.339913 6.872658       6.849599 1.961433       5.609589 21.86094 8.658228 17.18523 7.398957 4.675709       11.38901 
1 1 1 20  18 20 o 28.35818 8.597078 13.61858       6.455266 18.53250       7.824085 3.142415       11.42406 32.32911 9.382318 21.11915 9.704712 11.20995       13.49849 
1 1 1 20  18 21 o 18.52334 7.762655 4.109026       5.895195 8.772922       7.112805 -6.124528      10.53610 22.64407 8.867296 17.07975 8.264795 5.564322       12.12171 
1 1 1 20  18 22 o 31.85839 7.208043 16.34104       5.464787 28.34516       9.053089 9.459510       6.854472 38.52725 9.661208 22.66929 8.752851 15.85796       13.03654 
1 1 1 20  18 23 o 11.49341 5.545690 -4.539363      4.660566 -3.478922      7.114851 -5.336371      6.168135 14.61667 7.000430 13.01741 6.304944 1.599257       9.421164 
1 1 1 20  18 24 o 18.98926 7.495653 6.299921       5.117862 6.681591       7.932076 6.027713       6.698732 19.30726 8.542580 18.79611 8.088875 0.5111504      11.76459 
1 1 1 20  18 25 o 18.13155 7.902699 5.700832       6.560086 0.000000       0.000000 5.700832       6.560086 ?        ?        18.13155 7.902699 0.000000       7.902699 
1 1 1 20  18 26 f 19.04838 7.541022 7.186365       5.193891 7.686665       8.135658 6.842180       6.747977 18.78915 8.457950 18.42505 8.023072 0.3640995      11.65790 
1 1 1 20  19 0  o 54.54795 3.333176 36.64130       4.409552 39.95524       8.720920 35.50305       5.111036 56.18204 6.488954 53.57747 3.942235 2.604572       7.592611 
1 1 1 20  19 1  o 72.11971 3.360057 63.98307       5.888997 58.09290       10.14267 66.97855       7.233061 67.93176 6.195034 73.63662 4.046361 -5.704865      7.399425 
1 1 1 20  19 2  o 45.86425 3.817780 26.06495       4.228329 30.38537       7.656727 24.16924       5.071842 48.79642 6.608728 43.93259 4.816288 4.863834       8.177526 
1 1 1 20  19 3  o 61.58955 3.267781 46.71392       4.886962 49.72099       8.546479 45.25305       5.956905 62.90755 5.634657 60.43970 4.068173 2.467850       6.949777 
1 1 1 20  19 4  o 12.00318 4.900293 0.6922150      2.266509 2.818756       2.698908 -4.395802      4.174702 15.93260 5.603920 11.86261 5.587781 4.069989       7.913736 
1 1 1 20  19 5  o 33.82814 2.827374 14.13529       2.309462 15.45317       2.684949 10.38714       4.528008 35.32462 3.152132 28.11851 6.703179 7.206110       7.407331 
1 1 1 20  19 6  f 18.19864 6.892690 3.181983       4.197107 5.913061       5.624209 -0.2505082     6.305203 22.63945 8.077395 17.97617 7.792056 4.663273       11.22321 
1 1 1 20  19 7  o 105.1028 4.364833 137.4796       11.15506 131.9449       14.72113 144.9432       17.09494 102.0526 5.945186 106.4942 6.620008 -4.441566      8.897738 
1 1 1 20  19 8  o 72.31701 4.089789 65.13000       7.178005 68.65829       10.44602 61.97367       9.880073 73.42258 5.887587 69.74644 5.867373 3.676140       8.312024 
1 1 1 20  19 9  o 22.29288 7.259456 6.354990       4.523582 10.78158       6.107898 0.9772637      6.732193 28.18109 8.320733 19.18317 8.178827 8.997917       11.66738 
1 1 1 20  19 10 o 26.56912 6.915708 9.513170       4.520427 12.46763       6.442268 6.647655       6.344550 30.01068 8.451504 23.53714 8.555580 6.473541       12.02605 
1 1 1 20  19 11 o 33.25687 6.290674 14.70555       4.911477 12.06572       6.495243 18.23045       7.505534 29.36664 8.556047 35.97275 8.665401 -6.606108      12.17765 
1 1 1 20  19 12 o 24.90472 7.166712 8.488714       4.583072 12.58881       6.377116 4.108893       6.591061 29.79882 8.414520 21.08351 8.445928 8.715303       11.92216 
1 1 1 20  19 13 o 25.30533 7.043045 8.871396       4.502007 13.62669       6.589184 4.707952       6.165512 30.69434 8.512295 21.07362 8.254721 9.620720       11.85747 
1 1 1 20  19 14 o 35.47059 5.908750 16.88801       4.927820 16.30407       7.295931 17.37787       6.682397 33.08669 8.868804 34.71084 8.055751 -1.624146      11.98127 
1 1 1 20  19 15 o 16.91780 6.743377 2.661313       4.180440 6.362092       6.390070 -0.1076793     5.527388 22.29449 8.490583 16.21744 7.155251 6.077051       11.10350 
1 1 1 20  19 16 o 26.94061 7.234691 10.60310       4.849534 11.18618       6.854927 10.01887       6.861630 26.85341 8.945604 25.64137 8.941432 1.212042       12.64804 
1 1 1 20  19 17 o 30.56424 8.489308 14.76056       6.548096 21.53001       7.957291 0.5607219      11.52472 36.65797 8.979777 21.17086 9.735387 15.48711       13.24440 
1 1 1 20  19 18 o 25.67892 8.514306 10.65977       6.211545 14.99713       7.483018 1.048745       11.13906 29.63367 9.304619 20.73105 9.546933 8.902613       13.33116 
1 1 1 20  19 19 o 22.36661 7.331968 7.698147       4.610765 8.974817       7.284082 6.844624       5.955841 23.43027 9.029244 21.38057 8.183683 2.049698       12.18605 
1 1 1 20  19 20 f 16.30024 6.704568 2.756952       4.283093 6.475470       6.606554 0.6085387E-01  5.625458 20.81385 8.414381 15.53760 7.010209 5.276258       10.95193 
1 1 1 20  19 21 o 20.84002 7.437488 7.037207       4.768718 17.94900       7.803871 0.5344998      6.024334 30.37875 9.496709 15.92861 7.213986 14.45014       11.92598 
1 1 1 20  19 22 o 13.04996 6.028992 -1.180386      4.493672 -7.538642      6.888660 3.529455       5.928829 13.11283 6.419687 17.45812 7.561740 -4.345286      9.919289 
1 1 1 20  19 23 o 17.94349 7.307997 5.052624       5.026432 15.87908       8.547947 -0.6694912     6.214366 25.64463 9.807014 14.82433 6.929933 10.82030       12.00839 
1 1 1 20  19 24 o 19.82329 7.692613 7.413855       5.314393 16.38792       8.858768 2.368516       6.642381 24.88951 9.850074 16.34297 7.468737 8.546547       12.36147 
1 1 1 20  19 25 o 13.72641 6.305749 0.3698037      4.818289 0.5672255      7.721523 0.2439088      6.166082 15.69633 7.454415 14.68446 6.876992 1.011871       10.14206 
1 1 1 20  20 0  f 157.1400 3.712883 303.8979       14.21785 307.5347       24.86302 302.1307       17.33124 156.3243 6.541116 156.2256 4.557281 0.9873962E-01  7.972140 
1 1 1 20  20 1  o 56.39936 3.343000 39.22225       4.573978 54.26999       8.940371 33.88717       5.323418 65.72060 5.636747 52.21913 4.219257 13.50147       7.040955 
1 1 1 20  20 2  o 47.36777 3.629821 27.78751       4.157984 25.01673       7.194328 29.17725       5.095131 43.98753 6.941520 48.37320 4.369354 -4.385666      8.202192 
1 1 1 20  20 3  o 40.34166 3.962571 20.28473       3.845320 25.12443       6.339490 17.46761       4.836679 44.35121 6.020947 37.00047 5.533904 7.350742       8.177769 
1 1 1 20  20 4  o 77.33033 2.608111 73.40885       4.907837 80.61324       6.343367 62.66484       7.746479 80.88369 3.224736 70.90843 4.506331 9.975258       5.541295 
1 1 1 20  20 5  f 44.10913 2.383185 23.91115       2.552151 26.06559       3.022279 18.55651       4.764668 46.00325 2.707915 38.16502 5.263047 7.838234       5.918823 
1 1 1 20  20 6  o 83.27354 4.395252 86.51030       8.887637 94.96524       12.07268 76.50638       13.13208 86.55035 5.756708 76.87291 7.089928 9.677437       9.132730 
1 1 1 20  20 7  o 37.89536 5.511896 18.46802       4.940960 21.33082       7.001390 15.62771       6.973836 39.99173 7.458489 33.75417 8.488009 6.237560       11.29935 
1 1 1 20  20 8  f 49.39110 4.613543 30.80352       5.488649 34.05499       7.944997 27.83509       7.591321 51.10090 6.529063 45.90405 7.008033 5.196854       9.578161 
1 1 1 20  20 9  o 36.07874 5.886850 17.02467       4.997409 15.89437       6.785377 18.36458       7.387799 33.83555 8.294506 36.31762 8.499058 -2.482071      11.87572 
1 1 1 20  20 10 o 20.75234 7.208701 5.342359       4.457687 5.321936       5.884682 5.369856       6.828280 21.73059 8.176804 22.48649 8.721481 -0.7558975     11.95510 
1 1 1 20  20 11 o 60.46963 4.538393 46.46338       6.638885 57.96591       10.01892 37.45918       8.864344 66.39275 6.266611 52.74170 7.075246 13.65105       9.451429 
1 1 1 20  20 12 o 12.53588 5.748177 -2.249607      3.978666 -6.101353      5.379969 2.399698       5.910781 12.86243 6.140408 18.82932 7.822723 -5.966883      9.944828 
1 1 1 20  20 13 o 29.79679 7.987355 12.85998       5.917567 9.934482       6.708408 23.11960       12.56277 26.23659 8.850884 36.68747 12.10638 -10.45087      14.99675 
1 1 1 20  20 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 20  20 15 o 15.81367 7.015240 -0.2007210     5.383902 4.887070       6.225457 -15.29570      10.72316 20.58804 8.221516 16.04533 7.886624 4.542702       11.39264 
1 1 1 20  20 16 o 22.04210 7.334148 7.074879       4.607965 16.15791       7.092478 0.4404224      6.061572 31.72983 8.843412 16.84193 7.458963 14.88791       11.56901 
1 1 1 20  20 17 o 39.18269 8.146207 23.82083       7.524321 0.000000       0.000000 23.82083       7.524321 ?        ?        39.18269 8.146207 0.000000       8.146207 
1 1 1 20  20 18 o 17.69787 7.234962 3.396673       4.948920 5.942297       7.671717 1.582333       6.476715 21.22552 8.872443 17.57387 7.749891 3.651653       11.78054 
1 1 1 20  20 19 o 53.77383 5.072157 39.69845       6.568082 49.24086       10.40598 33.37933       8.468023 55.89750 7.855794 45.97503 7.839230 9.922474       11.09806 
1 1 1 20  20 20 o 14.97519 6.570037 1.076845       4.599930 9.789510       7.181134 -4.985584      5.990193 23.20249 8.958920 13.27320 6.374434 9.929290       10.99526 
1 1 1 20  20 21 o 22.52588 7.722837 8.822004       5.110006 7.138701       8.003317 9.980508       6.639534 20.61494 8.856152 22.96769 8.675956 -2.352743      12.39773 
1 1 1 20  20 22 f 16.15367 6.887524 3.013446       4.774612 13.08319       8.212291 -2.128453      5.868362 23.99416 9.487601 13.91614 6.576288 10.07802       11.54392 
1 1 1 20  20 23 o 13.87016 6.419161 -0.3756205     5.127019 3.847614       7.377750 -4.319973      7.129995 17.55835 7.964506 13.95839 6.764982 3.599961       10.44980 
1 1 1 20  20 24 f 23.77467 7.881278 11.24686       5.322314 10.99694       8.312563 11.42050       6.928770 21.13095 9.050741 22.24869 8.740079 -1.117746      12.58193 
1 1 1 20  21 0  o 102.5943 3.030853 129.3731       7.569166 163.7941       15.53944 118.6659       8.666821 114.2862 5.596653 98.06624 3.632918 16.21993       6.672377 
1 1 1 20  21 1  o 98.52185 3.767238 119.9607       9.027985 133.9451       13.81503 109.5374       11.92703 103.3001 5.507920 93.51350 5.254999 9.786621       7.612634 
1 1 1 20  21 2  o 40.96313 3.905079 20.92415       3.851040 23.82094       6.515510 19.36880       4.774237 42.95776 6.420728 39.06802 5.139224 3.889732       8.224194 
1 1 1 20  21 3  o 93.43645 3.183522 107.6016       7.238114 102.6534       11.52024 110.8288       9.303787 90.37685 5.253450 94.49824 4.049562 -4.121391      6.633076 
1 1 1 20  21 4  o 19.79089 4.036650 5.026698       1.880764 5.156786       2.107961 4.518925       4.164649 19.98000 4.444212 19.74442 6.959854 0.2355824      8.257759 
1 1 1 20  21 5  f 50.68508 3.531994 31.91146       4.335211 38.37936       8.337039 29.51444       5.075350 54.49723 6.399510 48.49700 4.340364 6.000237       7.732560 
1 1 1 20  21 6  o 57.28683 4.237783 41.11863       5.874133 47.60088       8.843507 36.00051       7.858085 60.82998 6.045764 52.74152 6.234416 8.088467       8.684423 
1 1 1 20  21 7  o 15.41474 6.656954 0.3499178E-02  4.567879 4.098910       5.013827 -19.99512      11.07951 19.86859 7.531613 16.22032 7.981297 3.648270       10.97389 
1 1 1 20  21 8  o 15.44187 6.730080 -0.2754237     4.757252 2.028556       5.219954 -11.57027      11.55760 18.00658 7.403495 18.83753 8.994818 -0.8309517     11.64983 
1 1 1 20  21 9  o 40.86083 6.603745 22.28169       6.351395 24.34385       7.275810 15.67798       13.02008 42.35185 7.314084 32.66107 12.18887 9.690781       14.21493 
1 1 1 20  21 10 o 34.73871 7.426930 16.72783       6.096713 18.27851       6.855800 10.86553       13.33003 36.01863 8.017132 29.28962 11.91145 6.729013       14.35817 
1 1 1 20  21 11 o 17.96174 7.325553 2.506001       5.059023 5.096925       5.613181 -8.706448      11.67702 20.96869 7.964329 19.33377 9.177588 1.634914       12.15149 
1 1 1 20  21 12 f 41.81732 5.518369 23.14876       5.486332 27.84965       8.160246 19.27106       7.411393 44.26782 7.851986 36.16978 8.545239 8.098042       11.60495 
1 1 1 20  21 13 o 22.23971 7.265955 6.915264       4.529832 12.17730       6.797856 2.712558       6.075186 28.27582 8.867019 18.87172 7.892486 9.404100       11.87078 
1 1 1 20  21 14 o 24.07304 7.270109 8.435475       4.622508 11.88435       6.769947 5.423199       6.326942 27.60559 8.871966 21.09697 8.332129 6.508621       12.17112 
1 1 1 20  21 15 o 15.34403 6.602445 0.9461148      4.461914 9.172940       6.812713 -5.233437      5.904490 24.41288 8.866828 13.62770 6.485274 10.78518       10.98542 
1 1 1 20  21 16 o 64.90655 5.155790 56.70614       8.087961 62.63934       11.23823 50.33126       11.64903 65.49311 7.157930 56.52964 8.737736 8.963474       11.29531 
1 1 1 20  21 17 o 35.75713 6.302535 18.42765       5.291199 24.87027       8.014089 13.44895       7.045001 39.13353 8.635471 27.98034 9.055554 11.15320       12.51297 
1 1 1 20  21 18 o 17.89993 7.057888 4.079854       4.533045 15.41390       7.578738 -2.233655      5.656396 29.08199 9.390663 14.34584 6.674616 14.73615       11.52107 
1 1 1 20  21 19 f 10.38481 5.077003 -6.272603      4.263745 -0.7792767     6.643589 -10.11985      5.559815 15.88732 7.336588 11.00366 5.457831 4.883660       9.144038 
1 1 1 20  21 20 o 25.48232 7.552816 11.03021       5.024657 11.50634       7.730952 10.68198       6.611519 23.96316 9.283948 23.77757 8.719563 0.1855946      12.73666 
1 1 1 20  21 21 o 15.79215 6.815795 2.475396       4.782756 -3.682282      7.432524 6.827126       6.248256 14.75452 7.089644 19.84285 8.122687 -5.088324      10.78152 
1 1 1 20  21 22 o 30.13819 8.398962 17.44497       6.397835 22.89020       9.193054 12.33057       8.909422 30.44490 10.36038 22.59193 9.509982 7.852966       14.06333 
1 1 1 20  21 23 o 17.71249 8.137048 4.327320       8.023795 4.327320       8.023795 0.000000       0.000000 17.71249 8.137048 ?        ?        0.000000       8.137048 
1 1 1 20  21 24 o 15.39446 7.150993 1.361265       6.452189 0.000000       0.000000 1.361265       6.452189 ?        ?        15.39446 7.150993 0.000000       7.150993 
1 1 1 20  22 0  o 103.3483 3.398556 131.8098       8.547574 134.0326       14.38162 130.5958       10.62848 103.0150 5.751738 102.4992 4.264464 0.5158157      7.160178 
1 1 1 20  22 1  o 81.84131 4.783861 83.87172       9.499255 99.48893       11.62470 52.48417       16.48006 88.84030 5.394952 60.78433 11.54789 28.05597       12.74595 
1 1 1 20  22 2  o 37.35177 4.468667 17.61280       3.986858 20.12997       6.242162 15.87846       5.181389 39.15727 6.787495 34.84122 6.335952 4.316048       9.285170 
1 1 1 20  22 3  o 33.47964 4.734492 14.27894       3.755033 19.80756       5.549616 9.610399       5.099703 39.07892 6.020583 26.76549 7.513062 12.31343       9.627748 
1 1 1 20  22 4  o 29.08985 3.054950 10.54559       2.133341 12.43868       2.406224 3.590556       4.612120 31.59395 3.168031 18.96953 7.215933 12.62442       7.880743 
1 1 1 20  22 5  o 60.47944 4.589462 46.11556       6.713537 0.000000       0.000000 46.11556       6.713537 ?        ?        60.47944 4.589462 0.000000       4.589462 
1 1 1 20  22 6  o 15.24345 6.452942 0.6275958      4.139831 5.537868       5.463995 -5.989759      6.343073 21.72832 7.933401 14.56668 6.869551 7.161640       10.49426 
1 1 1 20  22 7  o 20.21344 7.079065 5.007918       4.303700 6.196393       5.757563 3.503050       6.478775 22.52575 8.155580 20.57108 8.326704 1.954668       11.65536 
1 1 1 20  22 8  o 46.51559 4.804352 27.72218       5.367624 39.46521       8.320705 19.35232       7.024724 54.64387 6.367785 37.19372 7.988847 17.45015       10.21618 
1 1 1 20  22 9  o 44.76556 5.144126 25.99107       5.509798 33.46044       8.141330 19.67891       7.484149 49.74393 6.901820 37.01905 8.478945 12.72488       10.93287 
1 1 1 20  22 10 o 37.84651 8.539835 20.84144       7.688315 0.000000       0.000000 20.84144       7.688315 ?        ?        37.84651 8.539835 0.000000       8.539835 
1 1 1 20  22 11 o 17.49684 6.935910 2.926305       4.399189 2.775613       6.507523 3.053129       5.969963 19.46044 8.155640 19.17901 7.904838 0.2814293      11.35786 
1 1 1 20  22 12 o 33.34771 6.573623 15.53799       5.152046 21.22299       7.711250 10.95411       6.924301 37.51139 8.617298 26.85001 8.991682 10.66138       12.45424 
1 1 1 20  22 13 o 26.47909 8.937897 10.91403       6.840957 0.000000       0.000000 10.91403       6.840957 ?        ?        26.47909 8.937897 0.000000       8.937897 
1 1 1 20  22 14 o 15.35574 7.093131 -2.426705      6.216395 0.000000       0.000000 -2.426705      6.216395 ?        ?        15.35574 7.093131 0.000000       7.093131 
1 1 1 20  22 15 o 37.25520 6.168190 19.61313       5.404124 29.69376       8.707945 13.29875       6.891876 43.49201 8.521083 28.34759 8.933488 15.14442       12.34569 
1 1 1 20  22 16 o 11.91572 5.574181 -2.696162      4.032456 -6.379161      6.146042 0.8763529E-01  5.343348 13.26470 6.392368 15.51203 6.928293 -2.247329      9.426749 
1 1 1 20  22 17 o 24.88762 7.568206 9.911799       4.997368 13.28213       7.450227 7.155049       6.738012 27.07607 9.323536 21.58503 8.575057 5.491047       12.66728 
1 1 1 20  22 18 o 16.90047 6.969111 3.222851       4.643249 7.084227       7.050356 0.2652325      6.170368 21.13298 8.636920 16.04663 7.280735 5.086349       11.29626 
1 1 1 20  22 19 o 17.75043 7.046127 4.402928       4.546022 5.586100       6.928847 3.508654       6.023827 19.56334 8.317664 17.72378 7.649315 1.839563       11.30025 
1 1 1 20  22 20 o 14.79778 6.674126 0.6699796      5.093936 -7.052537      6.803666 10.52095       7.684278 13.10058 6.406546 22.60688 9.097587 -9.506295      11.12699 
1 1 1 20  22 21 o 14.90930 6.768389 0.8471438      5.341405 4.765652       7.843830 -2.541164      7.293890 18.41991 8.297157 14.86462 7.110775 3.555297       10.92730 
1 1 1 20  22 22 f 16.97953 7.509254 3.812772       6.122442 0.000000       0.000000 3.812772       6.122442 ?        ?        16.97953 7.509254 0.000000       7.509254 
1 1 1 20  22 23 o 13.63833 6.346121 -0.3473736     5.115499 -9.326673      7.843216 6.300108       6.748412 12.88162 6.405039 18.40084 8.017773 -5.519228      10.26203 
1 1 1 20  23 0  o 66.98857 3.340324 55.55008       5.435672 57.04251       9.125884 54.72947       6.767039 66.92713 5.648142 66.18338 4.217735 0.7437515      7.049170 
1 1 1 20  23 1  o 36.37749 5.478058 17.06498       4.705656 17.61366       6.214034 16.32735       7.204991 36.26773 7.284191 34.38091 8.617392 1.886822       11.28357 
1 1 1 20  23 2  o 35.52401 4.088377 15.91338       3.474771 22.66861       6.160926 12.76217       4.207896 41.66064 6.262095 31.24596 5.737682 10.41467       8.493222 
1 1 1 20  23 3  o 52.23884 3.384202 33.92729       4.284917 29.33041       6.513689 37.43411       5.689220 47.67099 5.721258 54.55165 4.314769 -6.880661      7.165894 
1 1 1 20  23 4  o 36.92686 3.182478 16.99042       2.835893 17.56405       3.756343 16.23013       4.324528 37.24828 4.212128 35.46121 5.155248 1.787067       6.657222 
1 1 1 20  23 5  o 70.84305 3.608201 62.61761       6.208567 0.000000       0.000000 62.61761       6.208567 ?        ?        70.84305 3.608201 0.000000       3.608201 
1 1 1 20  23 6  o 32.07314 6.403245 13.84190       4.829325 24.90476       7.029828 3.954891       6.645740 42.97782 6.949235 20.99404 8.456306 21.98378       10.94536 
1 1 1 20  23 7  o 65.29321 4.323773 54.05059       6.840909 67.39317       10.39840 43.86927       9.083405 71.68588 6.007669 57.31318 6.625519 14.37270       8.943690 
1 1 1 20  23 8  o 20.16537 7.390003 4.918450       4.747755 4.539579       6.118512 5.491809       7.526857 20.81386 8.201961 22.63895 9.040237 -1.825090      12.20648 
1 1 1 20  23 9  o 29.07610 6.710476 11.76367       4.658253 8.954925       6.417980 14.89061       6.771779 25.14518 8.653766 31.73038 8.561415 -6.585205      12.17315 
1 1 1 20  23 10 o 27.03868 7.153705 10.45275       4.785835 26.28712       7.785844 0.8366149      6.067441 42.82571 7.745489 17.52738 7.620256 25.29834       10.86558 
1 1 1 20  23 11 o 25.73395 7.233776 9.607966       4.724082 12.12306       7.369924 7.853864       6.154793 27.85448 9.275462 23.48378 8.441442 4.370705       12.54162 
1 1 1 20  23 12 o 17.47287 6.827738 3.353098       4.209660 6.760090       6.589779 1.004194       5.471645 22.28928 8.588514 16.68641 7.245703 5.602873       11.23667 
1 1 1 20  23 13 o 34.95279 6.465889 17.37735       5.304594 28.68246       8.672982 10.62079       6.704919 42.96693 8.583728 25.83079 8.846615 17.13615       12.32652 
1 1 1 20  23 14 o 47.59883 5.202731 30.67137       5.936644 40.60096       9.917544 25.12653       7.411098 51.37769 8.196475 40.70312 7.754757 10.67456       11.28355 
1 1 1 20  23 15 o 38.91134 5.770458 21.25760       5.306163 31.70440       8.421698 14.38044       6.833016 45.21154 7.933071 29.14785 8.846828 16.06369       11.88276 
1 1 1 20  23 16 o 22.88957 7.538851 8.312380       4.872363 19.15059       7.752696 1.236823       6.264036 32.85503 9.277854 16.97078 7.545561 15.88425       11.95885 
1 1 1 20  23 17 o 19.22598 7.525353 5.370682       5.120907 2.972487       6.778143 8.559881       7.816444 18.14692 7.968010 22.31956 9.104605 -4.172636      12.09888 
1 1 1 20  23 18 o 25.37753 7.768573 11.06432       5.254006 11.48239       7.515903 10.66476       7.347531 24.18626 9.208888 23.55284 9.070580 0.6334248      12.92591 
1 1 1 20  23 19 o 15.51992 7.145130 0.1640623      6.233220 0.000000       0.000000 0.1640623      6.233220 ?        ?        15.51992 7.145130 0.000000       7.145130 
1 1 1 20  23 20 o 25.58674 8.778411 13.43544       6.602673 0.000000       0.000000 13.43544       6.602673 ?        ?        25.58674 8.778411 0.000000       8.778411 
1 1 1 20  23 21 o 18.53159 7.376455 5.934700       4.995458 4.797812       7.831304 6.714654       6.486487 18.13164 8.217038 19.13966 8.088654 -1.008022      11.53022 
1 1 1 20  23 22 o 15.33617 6.731001 2.544639       4.832288 -0.1283012     7.600801 4.357938       6.260360 15.55421 7.389507 17.18790 7.597759 -1.633693      10.59862 
1 1 1 20  24 0  o 56.08618 3.237144 39.03034       4.405598 46.10218       8.390654 36.33865       5.176570 59.82203 5.829571 53.86564 3.971540 5.956394       7.053866 
1 1 1 20  24 1  o 10.90637 4.978630 -1.727053      2.940809 -1.765337      4.910717 -1.705646      3.672076 14.62030 6.577112 12.45694 5.637873 2.163356       8.662795 
1 1 1 20  24 2  o 23.94666 5.228016 7.550811       2.965063 6.091887       4.924105 8.380710       3.713844 21.96013 7.579074 25.00896 6.139851 -3.048828      9.753980 
1 1 1 20  24 3  o 44.20694 3.503337 24.45388       3.743218 23.60347       5.484740 25.19533       5.121344 42.67649 5.394183 44.37285 4.813201 -1.696358      7.229393 
1 1 1 20  24 4  o 38.75838 2.943046 18.69487       2.758927 21.59083       3.699354 15.06550       4.141378 41.42614 3.703529 34.01972 5.156968 7.406422       6.349051 
1 1 1 20  24 5  o 25.08262 4.903909 8.267251       2.889983 12.50047       5.771837 6.850868       3.338634 29.73986 7.850408 22.53055 5.981493 7.209311       9.869507 
1 1 1 20  24 6  o 37.18024 5.880127 18.41017       5.150666 28.46099       7.684985 10.21329       6.940116 45.54993 7.159328 26.75380 9.002376 18.79614       11.50212 
1 1 1 20  24 7  o 41.68639 5.689989 23.06631       5.629469 39.12546       8.685883 11.43461       7.392210 53.58964 6.804348 27.81393 9.290107 25.77571       11.51544 
1 1 1 20  24 8  o 20.84731 7.145430 5.809399       4.374384 7.964871       6.106618 3.537615       6.269213 23.88255 8.426941 19.81240 8.126204 4.070152       11.70677 
1 1 1 20  24 9  o 26.85735 7.391157 10.46947       4.989143 26.16613       8.020764 0.5632100      6.371873 42.28345 8.078573 17.59890 7.726513 24.68455       11.17866 
1 1 1 20  24 10 o 28.91067 7.194092 12.17666       5.047978 23.22880       7.997814 4.858318       6.508106 38.97241 8.647387 20.72504 8.361093 18.24737       12.02851 
1 1 1 20  24 11 o 22.11591 7.477779 7.069201       4.788450 13.11141       7.328704 2.568211       6.325331 28.41961 9.239063 18.63061 7.935038 9.789005       12.17888 
1 1 1 20  24 12 o 42.18866 5.713092 24.46839       5.722780 27.21123       9.019155 22.61988       7.404187 40.98644 9.250304 38.37110 8.169148 2.615341       12.34111 
1 1 1 20  24 13 o 23.19076 7.451774 8.176392       4.776155 9.920220       7.960772 7.195685       5.969978 24.64953 9.454729 22.03010 8.247094 2.619432       12.54617 
1 1 1 20  24 14 o 25.28065 7.842151 10.19771       5.332672 11.33597       7.213731 8.826157       7.918518 25.67012 9.149059 23.39580 9.295444 2.274328       13.04264 
1 1 1 20  24 15 f 22.96237 7.835903 8.532064       5.259379 17.53415       8.044228 1.810951       6.950777 30.70341 9.648165 17.81955 7.934134 12.88385       12.49150 
1 1 1 20  24 16 o 24.01196 9.493423 10.90536       8.221409 0.000000       0.000000 10.90536       8.221409 ?        ?        24.01196 9.493423 0.000000       9.493423 
1 1 1 20  24 17 o 16.55659 7.390507 1.684887       6.070715 0.000000       0.000000 1.684887       6.070715 ?        ?        16.55659 7.390507 0.000000       7.390507 
1 1 1 20  24 18 o 28.49108 7.702084 14.09899       5.474320 10.67489       8.318645 16.71458       7.270501 22.63002 9.329556 28.80002 9.187793 -6.169994      13.09413 
1 1 1 20  24 19 o 20.02909 7.590367 7.063585       5.091521 13.32658       8.123302 3.011129       6.534323 24.16293 9.472061 17.08711 7.644571 7.075821       12.17208 
1 1 1 20  24 20 o 10.51844 5.181423 -6.819266      4.712815 -8.868616      7.380491 -5.408358      6.123879 12.84990 6.358397 12.68022 6.173894 0.1696758      8.862628 
1 1 1 20  24 21 o 16.18830 6.965720 3.471040       4.966409 4.858171       7.760751 2.509004       6.463097 17.92564 8.145888 16.25675 7.405480 1.668894       11.00893 
1 1 1 20  25 0  o 39.42712 3.698647 19.54769       3.512152 18.93677       6.508718 19.79865       4.171614 37.15560 7.448032 39.42608 4.417834 -2.270481      8.659701 
1 1 1 20  25 1  o 81.14848 3.135424 81.78693       6.188636 90.95766       10.75732 77.25025       7.566071 84.15620 5.271924 78.41347 3.972472 5.742737       6.601038 
1 1 1 20  25 2  f 11.91838 5.140936 -0.4079759E-01 2.717946 -2.353890      4.143720 1.705805       3.600733 12.80320 5.869056 15.38332 6.214493 -2.580120      8.547851 
1 1 1 20  25 3  o 28.65205 3.614755 10.41580       2.467830 12.58825       3.558227 8.402239       3.425628 31.09001 4.855161 24.98507 5.746260 6.104940       7.522771 
1 1 1 20  25 4  o 17.97439 4.551956 4.266943       1.995600 6.196684       2.566789 1.317949       3.173056 21.57992 4.981799 14.22273 5.801218 7.357188       7.646728 
1 1 1 20  25 5  o 15.83077 5.300789 3.136739       2.406450 3.346560       5.348358 3.083478       2.694618 18.92828 7.599372 15.98367 5.601212 2.944610       9.440553 
1 1 1 20  25 6  o 41.67812 5.589284 23.12751       5.533787 40.07975       8.390570 10.07723       7.361863 54.30439 6.467383 26.22839 9.252775 28.07600       11.28897 
1 1 1 20  25 7  o 17.05895 6.817417 2.721531       4.283909 2.529019       6.149568 2.903031       5.971098 18.78342 7.903515 18.91025 7.859964 -0.1268330     11.14651 
1 1 1 20  25 8  o 26.01268 7.339780 9.890724       4.854033 8.023304       7.467802 11.25689       6.387400 23.91116 9.160891 27.11433 8.607365 -3.203178      12.57015 
1 1 1 20  25 9  o 24.55762 7.473356 8.914555       4.871684 14.92171       7.451129 4.429262       6.438475 30.40594 9.240289 20.22733 8.258632 10.17861       12.39306 
1 1 1 20  25 10 o 18.21835 7.286596 3.588700       4.897827 9.395732       7.292341 -1.183669      6.610844 24.66565 9.137851 16.49071 7.503349 8.174940       11.82373 
1 1 1 20  25 11 o 19.85736 7.633554 5.165330       5.197247 -2.626789      6.684178 17.07893       8.264977 15.70924 7.290766 31.43588 9.764882 -15.72664      12.18639 
1 1 1 20  25 12 o 19.62820 8.519304 3.348203       7.557288 0.000000       0.000000 3.348203       7.557288 ?        ?        19.62820 8.519304 0.000000       8.519304 
1 1 1 20  25 13 o 27.33060 9.084931 13.01830       7.070930 0.000000       0.000000 13.01830       7.070930 ?        ?        27.33060 9.084931 0.000000       9.084931 
1 1 1 20  25 14 o 18.30409 7.839936 3.395270       6.237207 0.000000       0.000000 3.395270       6.237207 ?        ?        18.30409 7.839936 0.000000       7.839936 
1 1 1 20  25 15 o 15.88859 6.773530 2.151060       4.616706 17.39025       7.678315 -6.477684      5.777749 30.26241 9.413797 12.46537 6.052689 17.79704       11.19172 
1 1 1 20  25 16 o 13.33199 6.121397 -0.9728941     4.532639 -0.9593325     6.836167 -0.9835331     6.054936 15.70996 7.318852 15.00028 6.953915 0.7096815      10.09567 
1 1 1 20  25 17 o 22.57100 7.704195 9.016375       5.084120 16.62941       8.186918 4.237443       6.486450 27.55057 9.754002 18.13467 7.881688 9.415901       12.54040 
1 1 1 20  25 18 o 20.94719 7.501276 7.775472       4.855116 4.796046       7.793659 9.664990       6.206558 18.60739 8.334970 22.23924 8.391068 -3.631847      11.82716 
1 1 1 20  25 19 o 15.19608 6.764591 1.783378       5.049864 4.051369       8.165725 0.3788314      6.426022 17.98141 8.241337 15.37149 7.139008 2.609916       10.90344 
1 1 1 20  26 0  o 39.88851 3.761231 20.11626       3.612904 18.27691       6.522649 20.93035       4.339395 36.07223 7.657267 40.39443 4.483744 -4.322201      8.873425 
1 1 1 20  26 1  o 21.59583 5.269138 6.248833       2.748021 6.079505       5.026271 6.321028       3.281972 21.64928 7.644703 21.58577 6.015569 0.6350327E-01  9.727721 
1 1 1 20  26 2  o 19.21733 5.274280 4.945299       2.544469 6.363129       4.516777 4.286182       3.079624 21.73155 7.261925 18.19253 5.993632 3.539022       9.415900 
1 1 1 20  26 3  f 12.07810 4.746274 1.208525       2.043877 0.5532973      2.756378 2.008823       3.046270 12.56241 5.288945 14.81647 5.802743 -2.254065      7.851418 
1 1 1 20  26 4  o 16.33759 4.496053 3.532753       1.846151 3.189579       2.342419 4.095440       2.999446 15.82782 5.227817 17.76061 5.917391 -1.932787      7.895922 
1 1 1 20  26 5  o 21.56457 5.076033 6.286033       2.622885 4.084249       5.230888 7.025548       3.031527 19.29407 7.589633 22.65374 5.538550 -3.359669      9.395640 
1 1 1 20  26 6  o 36.46985 6.918496 18.87104       5.923784 33.32456       8.323377 4.035408       8.432684 48.35356 7.290136 21.45768 9.151284 26.89588       11.70009 
1 1 1 20  26 7  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 20  26 8  o 20.97898 8.776649 4.653499       7.516279 0.000000       0.000000 4.653499       7.516279 ?        ?        20.97898 8.776649 0.000000       8.776649 
1 1 1 20  26 9  o 16.32820 7.363695 -0.5491967     6.199256 0.000000       0.000000 -0.5491967     6.199256 ?        ?        16.32820 7.363695 0.000000       7.363695 
1 1 1 20  26 10 o 13.46027 6.425275 -5.296124      5.888153 0.000000       0.000000 -5.296124      5.888153 ?        ?        13.46027 6.425275 0.000000       6.425275 
1 1 1 20  26 11 o 20.55260 7.420387 6.160957       4.762108 6.984562       7.469529 5.596960       6.181192 22.00311 8.928198 20.43284 8.181203 1.570263       12.10970 
1 1 1 20  26 12 o 17.36702 7.061438 3.399808       4.683708 6.066800       7.371500 1.594170       6.065413 20.95850 8.724030 17.07271 7.515456 3.885790       11.51481 
1 1 1 20  26 13 o 13.39654 6.098421 -0.8996532     4.373591 4.664932       6.322618 -6.005426      6.056355 19.21067 8.044134 13.07302 6.311318 6.137650       10.22452 
1 1 1 20  26 14 o 16.45088 6.929730 2.739601       4.735887 -4.540676      6.843312 9.431043       6.560732 14.37014 6.877847 23.00980 8.638921 -8.639661      11.04245 
1 1 1 20  26 15 o 11.98967 5.724993 -3.759588      4.681980 2.651129       7.064118 -8.781917      6.252551 17.68480 7.927457 12.12458 5.971744 5.560225       9.925035 
1 1 1 20  26 16 o 19.66747 7.570877 6.444040       5.117131 6.360720       7.605579 6.512952       6.916792 19.80845 8.572158 19.81563 8.362370 -0.7177353E-02 11.97544 
1 1 1 20  26 17 o 22.70507 7.885318 9.549233       5.333627 15.87228       8.737823 5.794160       6.733629 25.75158 9.898266 18.97995 8.138018 6.771627       12.81417 
1 1 1 20  26 18 o 13.66580 6.299015 -0.3810209     4.864799 2.277783       7.907952 -1.999875      6.170563 17.11404 7.938399 14.09219 6.684237 3.021849       10.37773 
1 1 1 20  27 0  o 13.62969 5.347491 1.633601       2.590938 0.9298082      4.853477 1.914101       3.064056 16.17991 6.922645 14.70430 5.801184 1.475611       9.031985 
1 1 1 20  27 1  o 10.83231 4.703255 -0.1214403     2.305002 2.981326       4.234776 -1.427678      2.747686 17.33098 6.825367 10.57052 4.820355 6.760453       8.355924 
1 1 1 20  27 2  o 11.06791 4.760465 0.7304814E-01  2.317737 -0.1781275     3.795793 0.2223698      2.926680 13.62529 5.973276 12.46845 5.355937 1.156835       8.022847 
1 1 1 20  27 3  o 17.16018 5.047385 3.939585       2.251096 4.120863       3.486655 3.810008       2.947817 17.99636 6.365984 17.19942 5.866467 0.7969379      8.656858 
1 1 1 20  27 4  o 31.00708 3.578716 12.30354       2.654550 15.09287       3.670014 9.243076       3.844245 33.91298 4.555995 25.64391 6.216901 8.269068       7.707591 
1 1 1 20  27 5  o 33.33577 6.699091 15.80446       5.253042 30.72790       8.706115 7.261154       6.587230 45.36470 8.176058 22.80766 8.635803 22.55704       11.89223 
1 1 1 20  27 6  o 16.13737 6.642599 2.109637       4.208442 4.699165       6.360013 0.9268253E-01  5.613010 20.31434 8.240107 16.17077 7.168872 4.143574       10.92209 
1 1 1 20  27 7  o 18.48951 7.197340 4.083009       4.663347 7.337708       6.034647 -0.7417002     7.347373 22.44593 8.313129 17.42226 7.920600 5.023672       11.48234 
1 1 1 20  27 8  o 13.37121 6.076972 -1.273050      4.320816 -2.617216      6.519588 -0.2202199     5.769962 15.48967 7.192832 15.95874 7.158312 -0.4690723     10.14782 
1 1 1 20  27 9  o 16.67974 6.743800 2.867774       4.244156 2.960423       5.778008 2.759213       6.254563 18.07620 7.636431 18.30053 7.844876 -0.2243309     10.94793 
1 1 1 20  27 10 o 12.83388 5.910866 -1.752023      4.271708 -2.499778      5.908755 -0.9333063     6.182770 14.60482 6.804106 15.73569 7.196698 -1.130863      9.903955 
1 1 1 20  27 11 o 13.55020 6.121299 -0.6191967     4.305134 -3.314219      6.214382 1.867816       5.969743 14.44381 6.807898 17.07949 7.489190 -2.635685      10.12104 
1 1 1 20  27 12 o 11.29595 5.416914 -4.322234      4.290190 -0.5542545E-01 6.452723 -7.702661      5.743508 16.15394 7.374341 12.02897 5.883303 4.124968       9.433672 
1 1 1 20  27 13 o 10.23282 5.001471 -5.989880      4.130362 -0.8820737     6.062920 -10.41336      5.642176 15.15333 7.001544 10.96942 5.450597 4.183915       8.873028 
1 1 1 20  27 14 o 14.68713 6.528404 0.8552282      4.685780 6.031429       7.114936 -3.109478      6.226886 19.76495 8.416880 14.10658 6.697908 5.658369       10.75666 
1 1 1 20  27 15 o 15.17249 6.677312 1.570118       4.785228 3.147844       7.101788 0.2581588      6.476079 17.70582 7.941813 15.76017 7.265567 1.945653       10.76387 
1 1 1 20  27 16 o 11.51623 5.562203 -4.496363      4.716767 -3.791757      7.129453 -5.044836      6.290140 14.37161 6.915387 13.14265 6.365934 1.228957       9.399345 
1 1 1 20  27 17 f 12.43324 6.052844 -5.541009      5.880745 -3.718070      7.207663 -9.171006      10.17095 14.31967 6.906198 14.91057 7.393273 -0.5908918     10.11712 
1 1 1 20  28 0  o 26.96279 4.641928 9.622614       2.939977 10.42822       5.359985 9.275945       3.516098 26.54922 7.782895 25.97437 5.710785 0.5748482      9.653316 
1 1 1 20  28 1  o 39.58863 3.531221 19.94222       3.370958 10.80940       5.698214 24.85922       4.181058 26.81730 8.065866 44.01231 3.939937 -17.19501      8.976709 
1 1 1 20  28 2  o 13.32389 5.601831 0.8278718      3.085445 1.628428       3.784710 -0.7585515     5.327781 15.20356 6.282842 15.34181 6.880310 -0.1382561     9.317336 
1 1 1 20  28 3  o 20.69950 4.592401 5.763029       2.255914 8.570890       3.241727 3.126394       3.141330 24.94127 5.483289 16.22551 5.999936 8.715759       8.128080 
1 1 1 20  28 4  o 26.05682 3.577034 8.766707       2.211449 9.624100       3.020707 7.776411       3.246397 26.75920 4.809094 23.57830 5.711155 3.180902       7.466236 
1 1 1 20  28 5  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 20  28 6  o 15.56116 6.714796 1.076883       4.640293 -0.9171836     6.722680 2.891466       6.412997 16.58214 7.553329 18.66649 7.971256 -2.084354      10.98152 
1 1 1 20  28 7  o 14.23096 6.276738 0.1429272      4.250113 4.012421       6.230932 -3.223783      5.812043 19.22044 8.012259 14.24639 6.673385 4.974046       10.42739 
1 1 1 20  28 8  o 18.32780 7.520038 3.805855       5.371309 6.511817       7.284558 0.5816790      7.951548 21.43924 8.772649 18.14475 8.245438 3.294493       12.03938 
1 1 1 20  28 9  o 34.45391 6.580113 17.61782       5.323277 29.42096       8.273680 9.280384       6.953704 42.70160 8.249557 23.44508 8.873770 19.25652       12.11606 
1 1 1 20  28 10 o 15.12398 6.562556 1.258264       4.481916 2.284454       6.732339 0.4414552      6.006374 17.81264 7.876205 16.10077 7.255833 1.711874       10.70895 
1 1 1 20  28 11 o 27.20704 7.642396 12.29730       5.274837 16.77395       7.867833 8.642312       7.109213 29.29344 9.576230 22.23441 8.816115 7.059031       13.01645 
1 1 1 20  28 12 o 30.06366 7.477727 14.92442       5.455617 18.46919       8.357332 12.29212       7.201798 29.87078 9.875004 25.09164 9.116054 4.779142       13.43942 
1 1 1 20  28 13 o 17.52030 7.673656 3.275719       6.251382 12.94229       7.565464 -17.53049      11.09931 25.07140 9.303819 14.43156 7.241768 10.63984       11.79001 
1 1 1 20  28 14 o 17.59335 7.681710 3.715581       6.221929 5.528596       7.556835 -0.1002631     10.96313 19.19778 8.421837 18.04811 8.656033 1.149670       12.07701 
1 1 1 20  28 15 o 15.18381 7.069401 -0.3195168     6.362651 7.550389       7.923371 -14.60877      10.67653 20.18226 8.741645 14.32951 7.177976 5.852744       11.31104 
1 1 1 20  29 0  o 35.74944 3.922713 16.51801       3.361305 16.46179       6.042759 16.54321       4.044830 33.24695 7.621592 35.27494 4.832299 -2.027992      9.024399 
1 1 1 20  29 1  o 35.21578 3.774029 15.99025       3.188301 15.18792       5.483020 16.40013       3.918969 32.15575 7.179080 35.16373 4.690278 -3.007988      8.575423 
1 1 1 20  29 2  o 57.96152 4.172383 43.61709       5.853886 48.75471       7.558446 35.91632       9.253765 60.30201 5.194139 48.76051 8.069813 11.54151       9.596925 
1 1 1 20  29 3  o 43.61543 2.931164 24.00391       3.097329 32.56343       4.644917 17.15058       4.156273 50.24852 3.821983 35.73716 4.901524 14.51135       6.215504 
1 1 1 20  29 4  o 7.422774 3.482581 -1.482509      1.593632 -0.8729334     2.029605 -2.462558      2.573485 9.235765 4.184587 9.241090 4.363376 -0.5325317E-02 6.045644 
1 1 1 20  29 5  o 12.98965 5.950786 -1.559326      4.250958 -5.613082      5.760581 3.287549       6.298954 13.08176 6.274245 18.66860 7.933668 -5.586846      10.11480 
1 1 1 20  29 6  o 16.53725 7.031503 2.125569       4.952220 -0.9341782     5.676368 11.87508       10.13256 15.19124 6.927826 25.42120 10.36752 -10.22995      12.46917 
1 1 1 20  29 7  o 24.67139 7.503142 9.701138       4.911659 21.42751       7.350413 0.2411964      6.601978 35.91790 8.526133 16.68707 7.555260 19.23083       11.39197 
1 1 1 20  29 8  o 27.67010 7.201016 12.07483       4.901676 20.44417       7.025704 4.137487       6.841980 34.98266 8.356358 19.10871 8.198411 15.87395       11.70652 
1 1 1 20  29 9  o 10.84219 5.396693 -11.01326      5.628039 -11.01326      5.628039 0.000000       0.000000 10.84219 5.396693 ?        ?        0.000000       5.396693 
1 1 1 20  29 10 o 14.80580 6.831632 -0.9400878     5.743758 3.038296       6.837720 -10.47605      10.58621 17.98375 7.945389 15.69645 7.738551 2.287299       11.09119 
1 1 1 20  29 11 o 28.75540 8.834254 15.57059       6.786679 18.29248       8.401038 10.45739       11.51447 29.44666 9.904652 22.60094 10.12691 6.845720       14.16532 
1 1 1 20  29 12 o 15.25426 6.631660 1.815609       4.594792 2.606970       7.075556 1.238528       6.042154 17.49020 7.879187 16.04553 7.249877 1.444668       10.70711 
1 1 1 20  29 13 o 13.85775 6.292151 0.1204954E-01  4.618734 -0.1371104     7.266514 0.1131627      5.982792 16.05819 7.502442 15.21618 7.003418 0.8420048      10.26326 
1 1 1 20  30 0  o 48.33071 3.534683 29.93753       4.134245 33.25513       7.237780 28.33087       5.036797 48.54965 6.263421 46.29701 4.522007 2.252636       7.725218 
1 1 1 20  30 1  o 12.67976 5.266718 0.9948140      2.678398 -2.019594      4.062674 3.312214       3.562143 12.43203 5.739625 16.61983 6.336923 -4.187800      8.549848 
1 1 1 20  30 2  o 30.41663 4.689590 12.48022       3.364437 14.26099       4.791417 10.74824       4.725335 31.25401 6.503006 26.56240 7.145099 4.691618       9.661342 
1 1 1 20  30 3  o 20.35941 5.006531 5.781753       2.466323 8.589023       3.434487 2.792770       3.543900 24.42447 5.847892 15.86348 6.244936 8.560986       8.555530 
1 1 1 20  30 4  o 20.58319 4.436668 5.786449       2.159754 5.812866       2.804765 5.747969       3.385156 20.14685 5.540709 19.82282 6.262809 0.3240261      8.361952 
1 1 1 20  30 5  o 15.13725 6.613620 0.9789656      4.618502 -0.6285220     5.217240 6.801414       9.929329 14.71627 6.684109 22.01163 9.655076 -7.295364      11.74299 
1 1 1 20  30 6  o 23.08237 8.187300 8.947905       5.770437 13.33678       7.025232 -0.1540434     10.11699 27.04142 9.056996 18.76663 8.795205 8.274792       12.62477 
1 1 1 20  30 7  o 28.19109 8.716104 14.27027       6.593740 18.78700       8.139863 5.649712       11.24534 31.14869 9.693097 21.24582 9.712580 9.902863       13.72189 
1 1 1 20  30 8  f 24.25255 7.400334 9.721280       4.772695 10.34683       6.613942 9.041640       6.893986 23.78148 8.721132 22.48976 8.751998 1.291719       12.35539 
1 1 1 20  30 9  o 21.41644 7.409742 7.609389       4.707680 2.684680       6.661023 12.52418       6.654311 17.56221 7.796321 25.72479 8.813082 -8.162580      11.76661 
1 1 1 20  30 10 o 24.77703 8.189294 11.17369       5.747689 16.88068       7.977844 5.014409       8.287943 28.38679 9.651498 19.40731 8.650975 8.979483       12.96113 
1 1 1 20  30 11 o 23.03911 7.765849 9.462792       5.164459 4.055195       7.731622 13.81934       6.939687 18.49505 8.291883 26.19921 8.999280 -7.704155      12.23693 
1 1 1 20  31 0  o 14.36339 5.623822 2.182704       2.860683 9.018431       4.994681 -1.154356      3.489775 23.89695 7.614297 11.97955 5.451088 11.91740       9.364394 
1 1 1 20  31 1  o 51.78305 3.532808 34.63365       4.431338 37.25663       7.267641 33.08139       5.590854 51.21674 5.932570 49.56567 4.684290 1.651062       7.558966 
1 1 1 20  31 2  o 22.15903 4.714047 6.794930       2.467231 8.511074       3.541680 5.176879       3.438971 24.02826 6.052557 18.86357 6.336989 5.164686       8.763041 
1 1 1 20  31 3  o 25.53832 4.095224 8.751227       2.462518 10.20146       3.592685 7.466166       3.381917 26.54027 5.723440 22.41578 6.051190 4.124481       8.329146 
1 1 1 20  31 4  f 16.42989 5.772676 3.723323       2.863369 2.916702       7.403704 3.865193       3.104982 18.54189 8.225990 16.73865 5.998261 1.803242       10.18067 
1 1 1 20  31 5  o 28.37395 8.513962 14.22152       6.354459 23.93330       8.267859 0.2051863      9.932549 36.22861 9.313861 18.57537 8.708479 17.65324       12.75091 
1 1 1 20  31 6  o 13.53021 6.255404 -1.460115      4.850367 1.402822       7.167260 -3.879117      6.588178 17.31067 7.851330 14.33755 6.830792 2.973120       10.40688 
1 1 1 20  31 7  o 27.28263 7.763314 12.68886       5.407252 15.51636       8.577866 10.82444       6.965481 26.98092 9.925623 23.87356 8.914067 3.107357       13.34086 
1 1 1 20  31 8  o 13.90957 6.478692 -1.578811      5.352136 -0.4367910     6.227838 -4.804808      10.46724 15.37578 7.101416 16.80141 8.155464 -1.425635      10.81396 
1 1 1 20  31 9  f 13.40306 6.199230 -1.166741      4.771036 4.458098       6.929784 -6.235681      6.578444 18.53089 8.098656 13.21547 6.426438 5.315417       10.33863 
1 1 1 20  32 0  o 16.69246 5.797979 3.862284       2.883666 7.189926       4.983956 2.187714       3.535556 21.31206 7.603755 14.97403 6.117574 6.338029       9.759190 
1 1 1 20  32 1  o 12.35665 5.193186 0.9235677      2.650122 -0.7772900     4.348548 1.928502       3.342559 13.41491 6.096683 14.44345 5.929913 -1.028538      8.504905 
1 1 1 20  32 2  o 43.57932 3.162695 24.43915       3.335863 28.76469       5.037606 21.06116       4.451771 46.04089 4.549379 39.16396 4.762330 6.876930       6.586094 
1 1 1 20  32 3  o 14.65899 5.768843 2.451819       3.023262 3.243027       3.353289 -0.9846108     6.988424 15.94123 6.130720 16.03647 7.446823 -0.9523582E-01 9.645771 
1 1 1 20  32 4  o 17.35456 5.902848 4.379132       2.984177 22.34455       8.920333 2.115167       3.166630 33.09510 10.12083 14.34159 5.815468 18.75351       11.67265 
1 1 1 20  32 5  o 22.79643 3.460962 6.881802       1.862306 6.082835       2.310129 8.364782       3.147308 20.75537 4.679530 23.84284 5.525074 -3.087469      7.240473 
1 1 1 20  32 6  o 20.25180 7.520463 6.751639       4.944708 11.94977       8.158154 3.733140       6.216758 24.07588 9.475944 17.90422 7.749086 6.171661       12.24099 
1 1 1 20  33 0  o 12.98062 5.342742 1.403378       2.722236 2.793736       4.690761 0.6973144      3.342734 16.46025 6.912932 13.10040 5.676071 3.359846       8.944631 
1 1 1 20  33 1  o 27.68132 4.902236 10.75404       3.185856 8.555614       5.436316 11.90398       3.931758 22.39099 7.946273 28.36682 5.880981 -5.975836      9.885808 
1 1 1 20  33 2  o 7.961728 3.853583 -3.209199      2.294135 -2.769887      3.611700 -3.506337      2.970325 10.90668 5.155630 9.286094 4.467125 1.620588       6.821710 
1 1 1 21  0  0  o 106.4500 3.421830 138.6995       8.855678 138.6995       8.855678 138.6995       8.855678 106.4500 3.421830 106.4500 3.421830 0.000000       0.000000 
1 1 1 21  0  1  o 95.41112 3.385277 111.5014       7.848486 111.5014       7.848486 111.5014       7.848486 95.41112 3.385277 95.41112 3.385277 0.000000       0.000000 
1 1 1 21  0  2  o 6.347394 4.533814 -4.789602      3.166035 -4.789602      3.166035 -4.789602      3.166035 6.347394 4.533814 6.347394 4.533814 0.000000       0.000000 
1 1 1 21  0  3  o 15.41670 8.426280 4.098754       4.513831 4.098754       4.513831 4.098754       4.513831 15.41670 8.426280 15.41670 8.426280 0.000000       0.000000 
1 1 1 21  0  4  o 126.0254 5.537135 195.5252       16.93020 195.5252       16.93020 195.5252       16.93020 126.0254 5.537135 126.0254 5.537135 0.000000       0.000000 
1 1 1 21  0  5  o 9.541698 6.485240 -2.500836      4.570932 -2.500836      4.570932 -2.500836      4.570932 9.541698 6.485240 9.541698 6.485240 0.000000       0.000000 
1 1 1 21  0  6  o 95.39343 5.418693 112.5088       12.50277 112.5088       12.50277 112.5088       12.50277 95.39343 5.418693 95.39343 5.418693 0.000000       0.000000 
1 1 1 21  0  7  o 99.03678 4.200268 120.5477       10.09543 120.5477       10.09543 120.5477       10.09543 99.03678 4.200268 99.03678 4.200268 0.000000       0.000000 
1 1 1 21  0  8  o 21.63815 8.872721 8.069157       4.616039 8.069157       4.616039 8.069157       4.616039 21.63815 8.872721 21.63815 8.872721 0.000000       0.000000 
1 1 1 21  0  9  o 61.88823 4.633227 47.67150       6.895437 47.67150       6.895437 47.67150       6.895437 61.88823 4.633227 61.88823 4.633227 0.000000       0.000000 
1 1 1 21  0  10 o 43.06993 5.769468 23.96272       5.750994 23.96272       5.750994 23.96272       5.750994 43.06993 5.769468 43.06993 5.769468 0.000000       0.000000 
1 1 1 21  0  11 o 47.57844 5.393988 28.84547       6.046883 28.84547       6.046883 28.84547       6.046883 47.57844 5.393988 47.57844 5.393988 0.000000       0.000000 
1 1 1 21  0  12 o 50.89987 5.185104 32.80461       6.265893 32.80461       6.265893 32.80461       6.265893 50.89987 5.185104 50.89987 5.185104 0.000000       0.000000 
1 1 1 21  0  13 o 6.865132 4.967008 -8.462589      4.380860 -8.462589      4.380860 -8.462589      4.380860 6.865132 4.967008 6.865132 4.967008 0.000000       0.000000 
1 1 1 21  0  14 o 38.81734 10.77625 22.81230       8.817104 22.81230       8.817104 22.81230       8.817104 38.81734 10.77625 38.81734 10.77625 0.000000       0.000000 
1 1 1 21  0  15 o 29.38923 11.43281 15.03066       7.799947 15.03066       7.799947 15.03066       7.799947 29.38923 11.43281 29.38923 11.43281 0.000000       0.000000 
1 1 1 21  0  16 o 11.62190 7.582545 -0.2795284     5.241605 -0.2795284     5.241605 -0.2795284     5.241605 11.62190 7.582545 11.62190 7.582545 0.000000       0.000000 
1 1 1 21  0  17 o 41.72305 7.217000 23.65677       6.680200 23.65677       6.680200 23.65677       6.680200 41.72305 7.217000 41.72305 7.217000 0.000000       0.000000 
1 1 1 21  0  18 o 24.27950 8.483568 9.746152       4.540822 9.746152       4.540822 9.746152       4.540822 24.27950 8.483568 24.27950 8.483568 0.000000       0.000000 
1 1 1 21  0  19 o 26.58300 7.912210 11.00527       4.460217 11.00527       4.460217 11.00527       4.460217 26.58300 7.912210 26.58300 7.912210 0.000000       0.000000 
1 1 1 21  0  20 o 37.51451 6.418522 19.26471       5.352551 19.26471       5.352551 19.26471       5.352551 37.51451 6.418522 37.51451 6.418522 0.000000       0.000000 
1 1 1 21  0  21 o 25.47717 8.495276 10.78171       4.698083 10.78171       4.698083 10.78171       4.698083 25.47717 8.495276 25.47717 8.495276 0.000000       0.000000 
1 1 1 21  0  22 o 13.43814 7.543365 3.405410       3.729907 3.405410       3.729907 3.405410       3.729907 13.43814 7.543365 13.43814 7.543365 0.000000       0.000000 
1 1 1 21  0  23 o 22.05558 7.859662 8.415732       3.851067 8.415732       3.851067 8.415732       3.851067 22.05558 7.859662 22.05558 7.859662 0.000000       0.000000 
1 1 1 21  0  24 o 13.02575 7.411075 3.288530       3.664773 3.288530       3.664773 3.288530       3.664773 13.02575 7.411075 13.02575 7.411075 0.000000       0.000000 
1 1 1 21  0  25 o 11.11034 6.847830 1.810356       3.621232 1.810356       3.621232 1.810356       3.621232 11.11034 6.847830 11.11034 6.847830 0.000000       0.000000 
1 1 1 21  0  26 o 16.20938 8.100727 5.639136       3.902557 5.639136       3.902557 5.639136       3.902557 16.20938 8.100727 16.20938 8.100727 0.000000       0.000000 
1 1 1 21  0  27 o 11.85792 7.109259 2.689403       3.677322 2.689403       3.677322 2.689403       3.677322 11.85792 7.109259 11.85792 7.109259 0.000000       0.000000 
1 1 1 21  0  28 o 10.90175 6.819075 1.931855       3.725047 1.931855       3.725047 1.931855       3.725047 10.90175 6.819075 10.90175 6.819075 0.000000       0.000000 
1 1 1 21  0  29 o 13.62630 7.839075 4.412477       4.165868 4.412477       4.165868 4.412477       4.165868 13.62630 7.839075 13.62630 7.839075 0.000000       0.000000 
1 1 1 21  0  30 o 10.12004 6.709206 0.7410237      4.363363 0.7410237      4.363363 0.7410237      4.363363 10.12004 6.709206 10.12004 6.709206 0.000000       0.000000 
1 1 1 21  1  0  o 192.1608 2.910184 450.8813       13.62766 448.2424       19.21641 453.5512       19.32892 191.3928 4.120125 192.5229 4.119923 -1.130127      5.826594 
1 1 1 21  1  1  o 107.6991 2.661874 141.5898       6.986110 141.7626       10.95407 141.4713       9.070139 107.5382 4.188011 107.5298 3.465906 0.8422852E-02  5.436170 
1 1 1 21  1  2  o 51.39038 3.040281 32.37122       3.790414 35.31132       5.820553 30.20629       4.994642 53.50058 4.506321 49.49992 4.179625 4.000656       6.146234 
1 1 1 21  1  3  o 43.70907 3.502914 23.50760       3.699893 22.83524       5.962313 23.92865       4.718231 42.69167 5.887666 43.96888 4.465366 -1.277210      7.389459 
1 1 1 21  1  4  o 147.8105 3.074939 266.9684       11.07587 270.3919       15.62917 263.5145       15.69834 148.4861 4.323913 146.5671 4.400208 1.919006       6.169121 
1 1 1 21  1  5  o 82.22987 2.808602 82.69608       5.619762 80.15672       7.672839 85.63474       8.254037 80.81425 3.907699 83.51145 4.068112 -2.697205      5.640891 
1 1 1 21  1  6  o 69.46627 2.912011 59.07455       4.918570 63.31254       6.897034 54.68870       7.016315 71.77998 3.958289 66.63635 4.344464 5.143631       5.877280 
1 1 1 21  1  7  o 106.0300 2.911931 137.5252       7.516826 146.0141       10.66934 129.1591       10.59188 109.0630 4.021317 102.5211 4.248795 6.541832       5.850064 
1 1 1 21  1  8  o 69.37006 3.399368 59.05417       5.729040 64.96818       7.148950 48.43875       9.577886 72.66316 4.053372 62.21187 6.409335 10.45129       7.583496 
1 1 1 21  1  9  o 47.60225 4.031892 28.01001       4.633104 26.44781       5.576187 31.49285       8.326003 46.05495 5.051285 49.81526 7.055876 -3.760311      8.677608 
1 1 1 21  1  10 o 103.2322 3.337951 130.7235       8.386096 122.5232       10.08635 149.0850       15.09298 99.75277 4.158401 109.5761 5.671570 -9.823364      7.032710 
1 1 1 21  1  11 f 37.45809 4.910738 17.61643       4.374735 22.88939       5.327258 6.696432       7.666329 42.70387 5.228097 25.30917 9.370526 17.39470       10.73032 
1 1 1 21  1  12 o 60.26050 3.813879 44.84556       5.571882 47.62766       6.724415 38.75091       9.952741 61.95373 4.484359 54.87670 7.650163 7.077026       8.867607 
1 1 1 21  1  13 o 14.19623 6.425076 -2.405757      4.769160 -3.229514      6.310456 -1.308592      7.282783 16.21695 7.359953 18.72373 8.238976 -2.506788      11.04761 
1 1 1 21  1  14 o 25.39592 7.765670 8.355543       5.251932 1.344391       6.753400 19.08401       8.354038 19.73626 8.292120 37.51164 9.208178 -17.77539      12.39152 
1 1 1 21  1  15 o 63.85678 4.079874 50.71853       6.315565 50.41591       7.555055 51.42061       11.50748 63.37012 4.931132 62.72638 7.688857 0.6437416      9.134254 
1 1 1 21  1  16 o 23.76004 7.209784 7.407363       4.538561 18.52081       5.675136 -12.31250      7.559690 37.62421 6.419933 14.08553 6.858453 23.53868       9.394356 
1 1 1 21  1  17 o 21.56185 6.798794 6.029973       3.991190 4.884075       5.292857 7.540449       6.076788 20.96644 7.781679 24.34535 8.418761 -3.378910      11.46430 
1 1 1 21  1  18 o 14.77581 5.688145 2.006054       2.888623 4.470541       3.411951 -4.230638      5.427711 18.88402 6.311613 13.95854 6.509097 4.925486       9.066687 
1 1 1 21  1  19 o 23.04311 5.768308 7.141211       3.231298 8.121617       3.796339 4.563282       6.155982 24.43298 6.326643 20.99664 8.241260 3.436333       10.38965 
1 1 1 21  1  20 o 10.91665 4.735551 -0.1322558     2.332394 3.086339       3.368652 -3.096047      3.232561 16.65224 6.202771 10.45637 4.922789 6.195878       7.918852 
1 1 1 21  1  21 o 30.43121 4.068507 11.97546       2.941581 12.75954       4.153729 11.18660       4.166347 30.59196 5.783633 28.38559 6.197317 2.206364       8.476859 
1 1 1 21  1  22 o 11.72485 4.959894 0.4763689      2.442861 -1.635429      3.423762 2.666331       3.486548 11.68729 5.349032 15.93546 6.217544 -4.248168      8.201828 
1 1 1 21  1  23 o 36.68217 4.018747 17.60217       3.533643 17.87911       5.723969 17.43163       4.491755 34.73053 7.005150 35.61553 5.339750 -0.8850021     8.808238 
1 1 1 21  1  24 o 22.53800 5.553037 7.286340       3.029750 10.00081       4.948881 5.659046       3.831752 25.08031 7.510772 19.62241 6.688536 5.457903       10.05725 
1 1 1 21  1  25 o 15.63142 5.781855 3.197400       2.917481 -1.221379      4.563856 6.250986       3.793900 13.37759 6.142373 20.18919 6.652537 -6.811593      9.054557 
1 1 1 21  1  26 o 10.31759 4.603847 -0.3262579     2.353489 -2.154025      3.363508 1.427007       3.294244 10.79027 5.061549 13.61423 5.759457 -2.823952      7.667504 
1 1 1 21  1  27 o 16.40418 5.607957 4.025462       2.694040 5.714023       3.930273 2.528936       3.700038 18.68241 6.741741 14.90470 6.190488 3.777707       9.152771 
1 1 1 21  1  28 o 17.33364 5.853158 4.812731       2.933777 5.917470       4.095303 3.648105       4.204839 18.43618 6.844515 15.96037 6.611479 2.475817       9.516252 
1 1 1 21  1  29 o 11.23800 4.957042 0.4505697      2.651290 3.309736       3.836167 -2.164036      3.668435 15.18588 6.304967 10.82183 5.139057 4.364046       8.134035 
1 1 1 21  1  30 o 11.40616 5.159377 0.1507876      3.070042 0.8147810      5.174860 -0.2098345     3.813669 13.83420 6.418645 12.03334 5.557477 1.800856       8.490262 
1 1 1 21  2  0  o 210.3605 3.358106 540.7231       17.21451 534.6574       26.94290 544.9073       22.37778 208.6676 5.302802 210.9684 4.352747 -2.300827      6.860475 
1 1 1 21  2  1  o 65.95876 2.560320 53.17985       4.107496 51.15454       5.620693 55.50107       6.017324 64.58745 3.585197 67.27187 3.684642 -2.684418      5.141034 
1 1 1 21  2  2  o 65.69329 2.652365 52.76963       4.237372 54.76027       5.616899 50.14037       6.455290 66.84159 3.460148 63.86360 4.170700 2.977989       5.419166 
1 1 1 21  2  3  o 14.46795 5.468914 1.851913       2.639212 3.853285       3.479239 -0.8604125     4.050337 18.52143 6.371693 14.15396 6.188535 4.367470       8.882367 
1 1 1 21  2  4  o 186.5848 3.450292 425.7365       15.68802 422.9143       21.79436 428.7711       22.59998 185.5824 4.823247 186.8197 4.968610 -1.237320      6.924652 
1 1 1 21  2  5  o 192.4027 3.513390 452.8912       16.47304 436.3934       22.63389 471.4726       24.02070 188.4319 4.933354 195.8280 5.037737 -7.396103      7.051013 
1 1 1 21  2  6  o 117.2634 2.899861 168.0443       8.286592 164.4985       11.33376 172.1170       12.14642 115.7922 4.022711 118.4066 4.216288 -2.614372      5.827460 
1 1 1 21  2  7  o 73.70095 2.914343 66.50191       5.223875 68.98215       7.074048 63.52727       7.747093 74.92721 3.887587 71.80024 4.449549 3.126968       5.908622 
1 1 1 21  2  8  o 74.70446 2.937018 68.34837       5.336323 75.23695       7.301293 60.44899       7.818644 78.24619 3.840870 69.97690 4.610704 8.269287       6.000906 
1 1 1 21  2  9  o 133.9224 3.066377 219.4850       10.00725 202.9511       13.37782 240.4920       15.07923 128.4456 4.279933 139.7860 4.432295 -11.34039      6.161418 
1 1 1 21  2  10 f 43.40998 3.861377 23.31624       4.042189 25.16639       5.325460 20.80150       6.208678 44.90206 4.948910 40.39605 6.529672 4.506008       8.193188 
1 1 1 21  2  11 f 70.55212 3.124677 61.11291       5.358861 61.69083       7.162874 60.37821       8.076214 70.67601 4.177541 69.77304 4.778747 0.9029694      6.347304 
1 1 1 21  2  12 o 88.14872 3.503552 95.60260       7.510947 109.5653       12.40204 87.51503       9.438799 93.74720 5.452263 84.02583 4.627516 9.721367       7.151299 
1 1 1 21  2  13 o 105.0596 3.625178 136.0058       9.267233 136.7067       15.58828 135.6227       11.52504 104.2405 6.164087 104.5834 4.532900 -0.3429031     7.651350 
1 1 1 21  2  14 o 36.01262 4.735391 16.37319       4.055126 14.86140       5.368793 18.38129       6.187607 33.70295 6.772151 37.49044 7.030990 -3.787483      9.762010 
1 1 1 21  2  15 o 12.89214 5.674720 -0.7731279     3.457495 -1.026014      4.697721 -0.4742377     5.107174 14.95387 6.597146 16.02925 6.979829 -1.075380      9.604183 
1 1 1 21  2  16 o 91.33898 3.708946 103.5022       8.238319 107.8009       9.740067 92.69608       15.44283 92.92930 4.312799 84.05104 7.622384 8.878258       8.757909 
1 1 1 21  2  17 o 35.07814 4.259419 15.58187       3.566495 14.46268       3.919851 20.96338       8.595483 33.55993 4.940761 38.53575 9.267227 -4.975822      10.50203 
1 1 1 21  2  18 o 27.86675 5.156819 10.15520       3.372958 14.78179       4.010583 -1.025076      6.234526 33.80817 5.020192 16.98678 7.541639 16.82140       9.059727 
1 1 1 21  2  19 o 14.04126 5.628681 1.453695       2.929417 -0.5277582     3.273942 9.409760       6.560369 12.55462 5.524247 26.00764 8.752623 -13.45302      10.35015 
1 1 1 21  2  20 o 27.11099 5.320173 9.823813       3.389277 12.99711       3.990925 1.614378       6.419116 31.22586 5.442466 18.59858 7.959473 12.62728       9.642284 
1 1 1 21  2  21 o 32.39601 3.793336 13.45781       2.938027 12.87212       4.197802 14.02021       4.113478 30.69400 5.825214 32.28841 5.419732 -1.594416      7.956545 
1 1 1 21  2  22 o 24.46999 4.725940 8.052526       2.716079 8.954767       3.881023 7.186463       3.802417 25.01375 6.355212 22.36225 6.555184 2.651501       9.130124 
1 1 1 21  2  23 o 19.18287 5.360435 5.161686       2.602246 8.145158       3.819849 2.578022       3.554702 23.52943 6.464123 15.70141 6.231358 7.828020       8.978570 
1 1 1 21  2  24 o 33.62833 4.681603 15.34317       3.732630 19.66441       4.630757 7.327895       6.306771 37.72564 5.173183 21.70222 8.391472 16.02342       9.857922 
1 1 1 21  2  25 o 9.589277 4.446551 -1.531227      2.478008 -0.7357320     3.330664 -2.517489      3.708585 11.87037 5.371187 11.28337 5.299814 0.5869980      7.545706 
1 1 1 21  2  26 o 12.94314 5.234293 1.644966       2.557489 2.057714       3.621514 1.234344       3.612175 14.60458 6.099746 13.79182 5.937623 0.8127584      8.512477 
1 1 1 21  2  27 o 13.00518 5.391334 1.596870       2.798946 4.998418       4.787886 -0.1691003     3.449827 17.85945 7.183256 12.17127 5.490714 5.688185       9.041411 
1 1 1 21  2  28 o 10.89372 5.044829 -1.075714      3.174086 3.635782       8.721263 -1.795075      3.407795 17.46886 8.180236 10.78171 5.069257 6.687144       9.623597 
1 1 1 21  2  29 o 9.267296 4.398479 -2.035083      2.680235 -1.768937      3.932398 -2.265986      3.662797 11.39648 5.384904 10.75165 5.114130 0.6448250      7.426407 
1 1 1 21  2  30 o 9.424123 4.463947 -1.808718      2.733934 -2.182882      3.929802 -1.457775      3.805908 11.01159 5.254390 11.25071 5.310450 -0.2391148     7.470575 
1 1 1 21  3  0  o 68.21494 2.625447 56.88150       4.356194 57.42825       5.660012 56.08701       6.822831 68.46768 3.402975 67.57011 4.163786 0.8975677      5.377486 
1 1 1 21  3  1  o 193.7463 3.184959 458.6049       15.03742 463.8194       19.60741 451.1577       23.43241 194.6662 4.133268 191.7214 5.019771 2.944778       6.502461 
1 1 1 21  3  2  f 97.51887 2.441846 116.1368       5.798308 115.8295       7.941087 116.4877       8.486114 97.29185 3.354420 97.53986 3.576239 -0.2480087     4.903225 
1 1 1 21  3  3  o 80.23351 2.596552 78.67200       5.070101 71.61337       7.130753 85.88903       7.210320 76.40527 3.842129 83.73203 3.541675 -7.326767      5.225459 
1 1 1 21  3  4  o 120.0584 2.879689 176.0821       8.425087 175.8645       11.55731 176.3289       12.30782 119.7811 3.964890 119.8921 4.219216 -0.1110077     5.789831 
1 1 1 21  3  5  o 186.3610 3.447208 424.8565       15.65520 439.3269       22.12172 410.3387       22.15791 189.0954 4.804561 182.6892 4.981791 6.406250       6.921130 
1 1 1 21  3  6  o 82.65708 2.832922 83.58414       5.697815 89.95341       7.715452 75.94353       8.450472 85.63185 3.706120 78.54859 4.432742 7.083260       5.777934 
1 1 1 21  3  7  o 79.21297 2.882397 76.80183       5.554712 84.85480       7.542294 67.25670       8.211386 83.14388 3.732033 73.85513 4.585079 9.288750       5.911939 
1 1 1 21  3  8  o 70.28327 2.963115 60.51939       5.063621 64.91412       6.754718 54.88134       7.650782 72.66493 3.828080 66.63087 4.742889 6.034065       6.095014 
1 1 1 21  3  9  o 122.8538 2.993823 184.6797       8.962943 191.5221       12.26993 176.8514       13.12418 124.8295 4.038878 119.8213 4.502725 5.008286       6.048724 
1 1 1 21  3  10 o 55.78664 3.291651 38.26753       4.454978 35.95960       5.726279 41.80640       7.090763 53.87640 4.399800 57.97049 5.070365 -4.094082      6.713185 
1 1 1 21  3  11 o 104.0056 3.453402 132.8821       8.740520 153.4881       14.33257 120.6812       11.02867 111.1865 5.305061 98.79868 4.593314 12.38783       7.017279 
1 1 1 21  3  12 o 102.6460 3.637632 129.7012       9.084682 132.6972       15.23982 128.0497       11.31485 102.8835 6.105986 101.6876 4.577832 1.195930       7.631488 
1 1 1 21  3  13 o 38.21534 4.389598 18.28904       4.013745 19.93530       5.171453 15.79495       6.365296 39.63023 5.503177 34.56930 7.748139 5.060925       9.503611 
1 1 1 21  3  14 o 53.02312 3.750936 34.85611       4.815361 32.60378       6.258806 38.12333       7.538147 50.89445 5.115753 54.86246 5.722393 -3.968010      7.675722 
1 1 1 21  3  15 o 81.19407 3.229990 81.32825       6.378139 83.14862       8.483786 78.96186       9.672826 81.72372 4.274823 79.30945 5.030793 2.414276       6.601741 
1 1 1 21  3  16 o 27.73226 4.762070 9.880735       3.102337 9.513502       3.651149 10.83434       5.883598 26.93096 5.739070 28.27750 8.114789 -1.346540      9.939151 
1 1 1 21  3  17 o 25.95156 5.235383 8.805036       3.196573 7.870069       3.697555 11.57111       6.359870 24.29300 6.219839 28.94213 8.476001 -4.649136      10.51328 
1 1 1 21  3  18 o 72.50063 3.152683 65.24401       5.556724 63.40434       6.195639 72.80901       12.56379 71.28107 3.578218 73.98534 7.053763 -2.704277      7.909439 
1 1 1 21  3  19 o 59.28053 3.207673 43.82173       4.616549 46.47204       5.486628 37.39611       8.543089 60.81469 3.720006 52.68844 6.813047 8.126247       7.762478 
1 1 1 21  3  20 f 45.69850 3.685562 26.42605       4.069538 29.72460       4.797819 17.96701       7.683206 48.26600 4.118427 34.53064 9.029954 13.73537       9.924792 
1 1 1 21  3  21 o 13.11323 5.517210 0.7272422      2.996309 0.5781240      3.448770 1.186329       6.051266 13.71763 5.851394 17.63130 7.638078 -3.913671      9.621800 
1 1 1 21  3  22 o 21.26844 5.309979 6.255124       2.743472 9.666460       3.816977 2.609361       3.945949 26.11904 6.106760 16.32879 6.537110 9.790247       8.945744 
1 1 1 21  3  23 o 57.98817 3.169394 42.74497       4.461670 52.27196       6.664538 35.00722       6.006198 62.99743 4.368267 51.02618 4.890033 11.97125       6.556994 
1 1 1 21  3  24 o 11.67253 4.937611 0.6211839      2.420837 2.008051       3.550484 -0.5837203     3.309379 14.88120 6.110812 12.06970 5.416971 2.811498       8.166125 
1 1 1 21  3  25 o 9.375625 4.441973 -2.514748      2.710000 2.796798       4.759967 -5.062127      3.296403 16.55202 6.958358 9.182364 4.483737 7.369651       8.277841 
1 1 1 21  3  26 o 29.12971 4.822061 11.98253       3.303331 7.483521       5.212308 15.00250       4.270447 20.86832 7.726505 31.82222 5.717014 -10.95390      9.611614 
1 1 1 21  3  27 o 12.15549 5.076118 1.211183       2.507472 -0.1283516     3.636950 2.424761       3.461738 12.44555 5.623885 14.57395 6.014371 -2.128398      8.234120 
1 1 1 21  3  28 o 10.54501 4.696841 -0.7344830E-02 2.438076 -0.1715105     3.559903 0.1376813      3.345956 12.09607 5.504684 12.05606 5.425832 0.4000568E-01  7.729243 
1 1 1 21  3  29 o 9.714595 4.503887 -1.039133      2.540675 -0.1005060E-01 3.794827 -1.875155      3.420389 12.31639 5.634879 10.61045 5.016088 1.705943       7.544070 
1 1 1 21  3  30 o 10.41005 4.837335 -0.9165626     2.956457 2.884184       5.114969 -2.823372      3.622949 15.03792 6.742956 10.26198 4.935796 4.775941       8.356407 
1 1 1 21  4  0  o 134.4079 3.061171 220.6545       10.02648 214.1818       11.32955 244.0372       21.53362 132.3242 3.516594 140.6622 6.298053 -8.337967      7.213315 
1 1 1 21  4  1  o 65.73556 2.549490 52.82212       4.076294 48.93290       5.371660 58.10250       6.259059 63.17150 3.503121 68.82410 3.746042 -5.652599      5.128810 
1 1 1 21  4  2  o 12.49171 5.079438 0.7441097      2.423625 0.8984538      3.018276 0.4639488      4.066471 13.89404 5.661417 15.36417 6.443514 -1.470126      8.577326 
1 1 1 21  4  3  o 190.0345 3.157933 441.3304       14.62418 446.3704       22.37634 437.5726       19.32170 190.6808 4.819413 189.0091 4.194948 1.671677       6.389392 
1 1 1 21  4  4  o 75.07583 2.658196 68.91718       4.855538 63.07848       6.621746 75.70782       7.141170 71.68579 3.804180 78.56201 3.740848 -6.876221      5.335329 
1 1 1 21  4  5  o 36.85448 3.662366 16.78709       3.245708 14.53935       3.998787 21.12735       5.556655 34.05270 4.964848 41.03251 5.711730 -6.979813      7.567931 
1 1 1 21  4  6  o 21.39262 5.429980 5.852768       2.835147 7.451674       3.494024 2.770840       4.850940 24.10280 5.977985 18.83316 7.337960 5.269642       9.464775 
1 1 1 21  4  7  o 105.7453 2.854409 136.7887       7.348793 143.0812       9.938256 129.1973       10.91593 107.9920 3.782280 102.4900 4.380727 5.501961       5.787608 
1 1 1 21  4  8  o 91.37215 2.850485 102.1863       6.339240 105.7140       8.425488 97.58402       9.623577 92.78944 3.733776 88.99904 4.451393 3.790398       5.809990 
1 1 1 21  4  9  f 135.3013 3.058093 224.0669       10.08298 219.0164       13.49403 230.4515       15.17197 133.4501 4.154473 136.7647 4.558681 -3.314590      6.167756 
1 1 1 21  4  10 o 43.56760 6.040608 24.00506       6.240966 0.000000       0.000000 24.00506       6.240966 ?        ?        43.56760 6.040608 0.000000       6.040608 
1 1 1 21  4  11 o 86.23470 3.763139 91.56673       7.888992 90.85533       12.92698 91.98891       9.958448 85.11279 6.276713 86.16445 4.761230 -1.051666      7.878225 
1 1 1 21  4  12 o 92.98808 3.743551 106.5671       8.465614 116.3941       14.09865 101.0262       10.58654 96.33022 6.036255 90.19177 4.834381 6.138443       7.733538 
1 1 1 21  4  13 o 51.60413 4.525589 33.22239       5.633540 29.77963       8.503071 35.91586       7.521061 47.85254 7.541170 53.25438 5.893994 -5.401840      9.571228 
1 1 1 21  4  14 o 41.61813 5.229750 21.94697       5.187127 26.52198       8.198168 18.89274       6.698405 44.87801 7.778015 37.81374 7.533868 7.064274       10.82851 
1 1 1 21  4  15 o 65.80983 3.310050 53.52365       5.291329 60.46092       6.766066 42.60044       8.490181 69.73476 3.998297 57.68581 6.133574 12.04896       7.321688 
1 1 1 21  4  16 o 16.81232 6.029438 3.145161       3.138017 3.550962       3.669848 2.041492       6.052168 17.94316 6.509099 19.17472 7.936454 -1.231550      10.26429 
1 1 1 21  4  17 o 79.92783 3.260937 79.19177       6.338167 84.01876       8.091769 71.52861       10.19552 81.94839 4.064662 74.69306 5.643098 7.255333       6.954570 
1 1 1 21  4  18 o 34.34398 4.951482 15.24799       4.024466 16.70804       4.668555 11.02456       7.940214 35.73505 5.540317 28.11107 9.627135 7.623974       11.10751 
1 1 1 21  4  19 o 22.49839 5.847307 6.840950       3.234847 6.164137       3.617258 9.543799       7.228635 21.37600 6.425818 26.16907 9.173794 -4.793068      11.20043 
1 1 1 21  4  20 o 43.55765 3.912611 24.15591       4.108847 27.40805       4.612834 11.66517       9.040189 46.30561 4.131220 27.87056 10.20003 18.43505       11.00489 
1 1 1 21  4  21 o 11.58395 5.122548 -0.4823530     2.848408 2.167664       3.361820 -7.225778      5.362784 15.30421 6.064350 12.15916 5.886789 3.145050       8.451664 
1 1 1 21  4  22 o 10.07262 4.802411 -3.608273      3.268864 -3.129362      4.135633 -4.405625      5.336290 11.96897 5.613842 13.19101 6.244770 -1.222039      8.397163 
1 1 1 21  4  23 o 13.39916 5.776823 0.5875038      3.428613 3.488195       4.391977 -3.938437      5.486100 17.40251 6.919978 13.44347 6.354591 3.959044       9.395048 
1 1 1 21  4  24 o 28.36730 4.396466 10.86330       2.940914 6.270345       3.951644 16.56548       4.403037 20.40291 6.791869 34.32825 5.444913 -13.92534      8.704973 
1 1 1 21  4  25 o 17.49474 5.403499 4.416989       2.534937 4.237380       3.503399 4.614351       3.672458 17.30887 6.347315 17.85894 6.506573 -0.5500622     9.089769 
1 1 1 21  4  26 o 25.60411 4.805334 9.311530       2.888168 7.766673       4.006165 10.98339       4.167589 21.78626 6.803333 26.31476 6.530107 -4.528496      9.430145 
1 1 1 21  4  27 o 18.24273 5.479526 5.103461       2.631099 6.987793       3.763994 3.302951       3.679323 20.42454 6.619816 15.65070 6.296255 4.773837       9.135907 
1 1 1 21  4  28 o 11.87600 5.081494 1.003404       2.615397 3.419917       3.751246 -1.282370      3.648360 15.48456 6.310758 11.43612 5.334084 4.048437       8.263057 
1 1 1 21  4  29 o 10.54517 4.765061 -0.1868912     2.610837 0.2175629      3.608561 -0.6311843     3.782111 12.24695 5.561118 11.86204 5.497986 0.3849096      7.820095 
1 1 1 21  5  0  o 87.83011 2.688281 94.26033       5.747018 99.18196       7.159094 85.34082       9.637712 90.03586 3.268343 83.30569 4.767387 6.730171       5.780142 
1 1 1 21  5  1  o 93.42376 2.695361 106.6473       6.129939 113.4772       7.673944 94.60603       10.18943 96.30766 3.274566 87.71148 4.785259 8.596184       5.798404 
1 1 1 21  5  2  o 74.74883 3.167591 68.39861       5.756838 68.42937       6.579929 68.29819       11.88723 74.71178 3.624883 74.10885 6.652975 0.6029282      7.576401 
1 1 1 21  5  3  o 118.1510 2.965807 170.6596       8.532431 162.7191       10.89202 183.2723       13.72742 115.2294 3.884457 122.1558 4.619785 -6.926483      6.035845 
1 1 1 21  5  4  o 69.47971 3.006996 59.10422       5.079226 61.96781       6.288288 53.72906       8.615349 71.06752 3.643149 65.87206 5.414811 5.195457       6.526309 
1 1 1 21  5  5  f 35.24636 4.197575 15.44164       3.534606 14.47203       3.895672 19.95695       8.406735 33.99220 4.839451 39.16899 8.997099 -5.176788      10.21607 
1 1 1 21  5  6  o 13.00743 5.737428 -1.023882      3.551634 -4.595542      5.237764 2.016136       4.832245 13.83956 6.433569 18.04203 7.230318 -4.202467      9.678239 
1 1 1 21  5  7  o 103.3859 3.518344 131.0478       8.851210 132.3717       14.43750 130.2505       11.20367 103.3751 5.753827 102.8729 4.479872 0.5022202      7.292172 
1 1 1 21  5  8  o 50.68945 4.347904 31.80040       5.318905 38.63047       8.911152 28.02036       6.629331 55.35710 6.744861 47.23907 5.886145 8.118031       8.952087 
1 1 1 21  5  9  o 13.48974 6.300498 -4.782306      5.118217 0.000000       0.000000 -4.782306      5.118217 ?        ?        13.48974 6.300498 0.000000       6.300498 
1 1 1 21  5  10 o 100.6565 3.676728 124.5512       9.003454 136.6269       15.20434 118.0301       11.17306 104.6811 5.985178 97.70561 4.706475 6.975494       7.614018 
1 1 1 21  5  11 o 22.89253 5.754577 6.770742       3.206276 6.017844       3.776722 8.713779       6.067189 21.80343 6.568528 26.30186 8.393357 -4.498421      10.65805 
1 1 1 21  5  12 o 149.0098 3.648715 273.1818       13.24924 266.8351       15.48449 290.5282       25.59931 146.9185 4.329707 151.6157 6.947104 -4.697189      8.185880 
1 1 1 21  5  13 o 51.13767 3.749409 32.40403       4.639920 31.02443       5.196694 37.82716       10.30328 49.89534 4.316375 53.75692 8.117829 -3.861580      9.194034 
1 1 1 21  5  14 o 36.91061 3.846060 17.00895       3.408735 15.20645       3.676731 28.03864       9.095079 34.73402 4.445588 45.83094 8.454925 -11.09692      9.552434 
1 1 1 21  5  15 o 11.54967 5.024670 -0.3489072     2.641666 0.7345494      2.864189 -6.520076      6.835647 13.22592 5.465616 15.20953 7.159942 -1.983612      9.007648 
1 1 1 21  5  16 o 61.77976 3.097955 47.20087       4.649106 49.73862       5.204757 37.18291       10.34107 63.33340 3.384634 52.41885 8.377374 10.91454       9.035272 
1 1 1 21  5  17 o 70.90374 2.871839 62.12779       4.951829 64.99022       5.838387 54.79060       9.347382 72.35174 3.320222 65.08075 5.959981 7.270988       6.822408 
1 1 1 21  5  18 o 30.22752 5.506946 12.04626       3.907074 16.17279       4.826663 4.203018       6.654292 34.97396 5.871091 21.20444 8.489072 13.76952       10.32153 
1 1 1 21  5  19 o 33.50025 5.097034 14.69962       4.030019 18.49590       5.020218 7.819594       6.758314 37.35222 5.695204 24.27113 8.829007 13.08109       10.50651 
1 1 1 21  5  20 o 11.53812 5.320916 -2.179841      3.477405 -3.755096      3.956769 3.165348       7.288645 11.47322 5.415235 20.38719 8.592847 -8.913967      10.15686 
1 1 1 21  5  21 o 10.93923 4.936841 -1.045592      2.792084 0.1732689      3.238236 -4.577325      5.512206 12.92987 5.594434 13.49837 6.377281 -0.5685005     8.483360 
1 1 1 21  5  22 o 30.83134 5.196352 12.94517       3.765488 13.11136       4.638742 12.62410       6.447660 30.17860 6.499835 28.03899 8.610156 2.139608       10.78808 
1 1 1 21  5  23 o 35.74759 4.824209 17.29591       4.095343 22.55278       5.068078 7.404552       6.951965 40.52185 5.256090 22.14451 8.737679 18.37735       10.19674 
1 1 1 21  5  24 o 10.85546 4.775824 -0.1313220     2.446028 -2.439536      3.477529 2.128875       3.441168 11.00150 5.156152 14.84807 6.046950 -3.846569      7.946793 
1 1 1 21  5  25 o 13.68774 5.282404 2.153607       2.495655 -1.281977      3.415617 6.088373       3.655344 11.55829 5.309523 19.87762 6.528941 -8.319326      8.415349 
1 1 1 21  5  26 o 18.97618 6.004004 5.565791       3.110142 7.273287       3.734563 1.701339       5.618288 21.22170 6.559289 15.94302 7.113659 5.278689       9.676178 
1 1 1 21  5  27 o 12.30434 5.336027 0.8233887      2.959705 0.9851171      3.498714 0.4164198      5.550037 13.13221 5.746513 14.73114 6.767437 -1.598938      8.878098 
1 1 1 21  5  28 o 12.73518 5.233556 1.752248       2.606812 -1.008375      3.628772 4.696097       3.747260 11.56706 5.369576 16.90279 6.485898 -5.335726      8.420167 
1 1 1 21  5  29 o 15.59347 5.828183 3.889954       2.979083 4.163402       3.801374 3.454687       4.796021 15.97177 6.408692 15.56675 6.771329 0.4050264      9.323210 
1 1 1 21  6  0  o 205.2514 3.034003 514.6000       15.17533 511.8519       21.24852 517.4609       21.68032 204.4524 4.264816 205.5544 4.328156 -1.101959      6.076314 
1 1 1 21  6  1  o 48.43682 3.028607 28.77205       3.556934 26.66301       4.381759 32.84703       6.090723 46.51710 3.901357 51.51585 4.911031 -4.998749      6.272066 
1 1 1 21  6  2  o 159.6725 2.893974 311.4326       11.26058 303.6715       16.70075 317.9022       15.24796 157.3592 4.359396 161.1599 3.882566 -3.800613      5.837692 
1 1 1 21  6  3  o 52.84722 2.966107 34.23161       3.804510 36.01360       5.107541 32.01049       5.702224 54.09609 3.900640 50.87193 4.651109 3.224167       6.070239 
1 1 1 21  6  4  o 64.07571 3.358040 50.35414       5.225128 46.12011       9.017771 52.49411       6.411003 60.83094 6.168477 65.33224 4.046684 -4.501305      7.377381 
1 1 1 21  6  5  o 48.24218 4.255437 28.76077       4.951497 36.15018       7.797963 23.76866       6.409420 53.78644 6.054430 43.43912 6.233163 10.34732       8.689560 
1 1 1 21  6  6  o 20.75939 5.874642 5.461811       3.104915 4.643563       3.402736 9.531908       7.589064 19.59578 6.289104 28.16498 9.413100 -8.569197      11.32075 
1 1 1 21  6  7  o 81.85164 3.128457 82.09228       6.228644 80.14264       7.086741 88.71217       13.05855 80.79733 3.608366 84.36126 6.399826 -3.563934      7.346978 
1 1 1 21  6  8  o 87.47584 3.808666 94.04733       8.099441 90.77227       9.830409 100.9698       14.29202 85.73669 4.723350 89.89650 6.569365 -4.159813      8.091143 
1 1 1 21  6  9  o 83.14745 4.456885 85.35180       8.997598 87.88751       12.29511 82.42807       13.20232 83.92096 6.052761 81.02659 6.747496 2.894371       9.064469 
1 1 1 21  6  10 o 64.31710 3.283541 50.85212       5.129387 47.71453       5.783063 62.42503       11.10660 62.19484 3.834281 70.41529 6.547609 -8.220455      7.587681 
1 1 1 21  6  11 o 125.1381 3.061116 192.0031       9.334807 201.6992       12.36950 179.1756       14.22746 127.9260 3.972682 120.2196 4.866474 7.706398       6.282099 
1 1 1 21  6  12 o 82.40549 3.021728 83.42769       6.057753 89.46441       7.648037 73.26414       9.923664 85.16762 3.693799 76.53371 5.354659 8.633911       6.505116 
1 1 1 21  6  13 o 27.59674 4.993874 9.753890       3.234791 7.938188       3.713139 15.47049       6.588520 24.64675 6.191187 34.04663 8.065726 -9.399883      10.16793 
1 1 1 21  6  14 f 52.92641 3.447479 34.67932       4.422219 36.60023       5.284171 30.18931       8.078797 54.22506 4.027660 48.13784 7.099790 6.087219       8.162663 
1 1 1 21  6  15 o 24.39914 5.612349 7.802522       3.267418 8.434484       3.772105 5.903475       6.538915 25.26976 6.178133 23.14202 8.637627 2.127745       10.61970 
1 1 1 21  6  16 o 51.47385 3.592207 33.00013       4.477648 32.03236       5.393963 35.14518       8.030476 50.42471 4.434769 51.91016 6.489622 -1.485451      7.860176 
1 1 1 21  6  17 o 31.74584 4.037801 12.78409       3.053106 12.13224       3.459721 15.07853       6.490924 30.67421 4.784481 32.87785 8.144102 -2.203640      9.445510 
1 1 1 21  6  18 o 61.27018 2.959587 46.59358       4.405853 47.39841       5.139736 44.36342       8.555709 61.60306 3.437384 58.07263 6.138525 3.530430       7.035417 
1 1 1 21  6  19 o 31.45267 4.889950 12.94279       3.626266 13.02127       3.765026 11.93657       13.48138 31.46622 5.083284 29.27197 11.95083 2.194252       12.98700 
1 1 1 21  6  20 o 33.20857 4.229751 14.25783       3.345380 14.20924       3.832166 14.41345       6.858558 32.81849 4.945133 30.83741 8.732745 1.981087       10.03570 
1 1 1 21  6  21 o 29.61193 4.707263 11.64392       3.283247 12.01417       3.624122 9.948860       7.754473 29.84700 5.169899 25.45868 9.424541 4.388327       10.74941 
1 1 1 21  6  22 o 27.62440 5.004564 10.39095       3.244944 14.45362       3.759705 -1.473140      6.424884 32.77635 4.853637 15.97859 7.318484 16.79776       8.781686 
1 1 1 21  6  23 o 18.19529 5.809190 4.681959       2.906074 3.827513       3.324662 7.448720       5.982613 17.01303 6.191949 21.96937 8.249264 -4.956337      10.31458 
1 1 1 21  6  24 o 14.37336 5.630599 2.275359       2.868806 -0.7086914     3.292156 11.69123       5.848003 11.88515 5.362512 26.21967 8.224521 -14.33452      9.818313 
1 1 1 21  6  25 o 10.38842 4.758916 -1.117065      2.718265 -0.9957902     3.145969 -1.474338      5.399687 11.28592 5.150925 14.12959 6.556005 -2.843666      8.337460 
1 1 1 21  6  26 o 10.14600 4.565723 -0.4736730     2.368520 0.2291576      3.662963 -0.9786802     3.104960 12.87695 5.744866 11.08543 5.081179 1.791517       7.669541 
1 1 1 21  6  27 o 24.38088 5.471174 9.081762       3.170557 7.485240       4.264529 11.05488       4.740897 20.56416 7.054922 24.79215 7.333447 -4.227993      10.17602 
1 1 1 21  6  28 o 10.13337 4.599630 -0.4531438     2.465752 -2.760205      3.346773 2.285949       3.646701 10.06322 4.814685 14.20005 6.035679 -4.136825      7.720791 
1 1 1 21  6  29 o 12.16903 5.272349 1.147559       2.883929 1.774724       3.391817 -0.4889505     5.478989 13.28491 5.736750 13.52555 6.380382 -0.2406425     8.580185 
1 1 1 21  7  0  o 35.19007 3.810811 15.32583       3.215849 14.96126       3.962117 16.02967       5.505220 34.59989 4.830613 35.50027 6.606732 -0.9003792     8.184359 
1 1 1 21  7  1  o 100.9542 2.578705 124.5089       6.338792 128.4718       9.131760 120.8238       8.805927 102.4129 3.664918 99.31682 3.644630 3.096130       5.168651 
1 1 1 21  7  2  o 87.15173 2.596032 92.82498       5.507287 89.81067       7.679493 96.01669       7.902243 85.59148 3.690521 88.50723 3.671806 -2.915749      5.205968 
1 1 1 21  7  3  o 86.57607 3.085994 91.73343       6.500307 85.30819       11.46796 94.77501       7.890259 83.03519 5.702068 87.91862 3.690978 -4.883423      6.792415 
1 1 1 21  7  4  o 17.44771 5.676522 3.625128       2.766248 -0.4408047E-01 3.474679 9.975624       4.571222 13.75433 5.870375 27.84114 6.797688 -14.08680      8.981641 
1 1 1 21  7  5  o 83.18516 2.845611 84.67118       5.759933 92.31583       7.550334 74.02839       8.908716 86.75948 3.578875 77.47472 4.741371 9.284760       5.940450 
1 1 1 21  7  6  o 141.2328 3.067685 243.9800       10.55802 242.9512       14.00880 245.3328       16.06386 140.6656 4.091084 141.1891 4.675327 -0.5234833     6.212540 
1 1 1 21  7  7  o 75.00651 3.306114 69.01822       6.028157 66.34875       8.246855 72.08102       8.833557 73.29581 4.640973 76.38014 4.769712 -3.084335      6.654982 
1 1 1 21  7  8  o 96.38698 2.880305 113.7646       6.757802 116.1499       8.725239 110.1887       10.68327 97.23923 3.688824 94.47988 4.654444 2.759354       5.938962 
1 1 1 21  7  9  o 72.03791 2.927587 63.63309       5.128630 63.65809       6.303050 63.58411       8.822370 71.93463 3.607154 71.55539 5.092778 0.3792419      6.240829 
1 1 1 21  7  10 o 45.15252 3.382948 25.15478       3.695256 26.43649       4.356546 21.86781       6.976605 46.20121 3.906046 41.15630 7.219323 5.044914       8.208278 
1 1 1 21  7  11 o 48.30700 3.311693 28.78527       3.874904 27.97387       4.561499 30.88857       7.344116 47.48893 3.978186 49.31182 6.251880 -1.822895      7.410261 
1 1 1 21  7  12 o 126.4847 3.060678 196.3987       9.433908 204.5292       12.30959 184.8260       14.68589 128.7075 3.929274 121.8714 4.955290 6.836121       6.324089 
1 1 1 21  7  13 o 39.67295 3.241195 19.48640       3.106257 21.28044       3.474304 12.33913       6.934613 41.42339 3.473769 30.36310 8.839075 11.06029       9.497174 
1 1 1 21  7  14 o 41.38224 3.213789 21.21639       3.215526 19.53956       3.533110 29.30578       7.760170 39.59354 3.704843 47.43702 6.916458 -7.843479      7.846225 
1 1 1 21  7  15 o 39.96383 3.794623 19.97290       3.651206 23.34468       4.270730 10.81403       7.038716 43.14078 4.112039 28.34143 9.040005 14.79935       9.931292 
1 1 1 21  7  16 o 55.97335 2.860464 38.71959       3.888762 36.64846       4.382270 46.39278       8.434970 54.31643 3.326749 60.01061 5.841775 -5.694183      6.722618 
1 1 1 21  7  17 o 117.5415 3.380567 171.7048       9.673095 176.1619       11.41024 160.3179       18.23782 118.6339 3.952360 110.3185 6.817344 8.315376       7.880186 
1 1 1 21  7  18 o 19.03602 6.002865 4.736317       3.111339 5.726146       3.539114 1.368196       6.528422 20.72796 6.381608 18.77670 8.031118 1.951269       10.25786 
1 1 1 21  7  19 o 19.98500 5.573698 5.384779       2.816372 3.177359       3.095892 15.97975       6.782550 16.50465 5.979709 32.99102 8.411907 -16.48637      10.32071 
1 1 1 21  7  20 f 36.01348 4.195065 16.75592       3.612779 17.34616       3.779360 10.49960       12.30444 36.58706 4.322265 27.17882 11.28871 9.408232       12.08788 
1 1 1 21  7  21 o 13.50420 5.373346 1.587228       2.649809 2.028404       2.968057 -0.1453950     5.881912 14.53213 5.716840 16.33634 7.284591 -1.804214      9.259996 
1 1 1 21  7  22 o 22.14010 5.554780 6.919137       2.991619 7.402109       3.389127 5.214953       6.366271 22.68108 6.028901 20.34976 8.247925 2.331324       10.21645 
1 1 1 21  7  23 o 11.92305 5.139663 0.3503151      2.713224 0.6425235      3.077296 -0.6700572     5.750456 12.84353 5.504081 15.39138 7.001166 -2.547856      8.905685 
1 1 1 21  7  24 o 14.17079 5.668715 2.062681       2.964828 1.811296       3.074533 5.397838       11.19872 13.99371 5.709447 21.31284 9.723828 -7.319130      11.27611 
1 1 1 21  7  25 o 14.01178 5.666675 2.045162       2.997595 2.288868       3.112103 -1.084950      11.15323 14.42533 5.795026 18.31389 8.769456 -3.888559      10.51122 
1 1 1 21  7  26 o 18.42489 5.759107 5.223034       2.870040 7.080451       3.308043 -0.4309485     5.771564 21.16754 6.087948 14.67990 6.799778 6.487637       9.126887 
1 1 1 21  7  27 o 11.78279 4.914014 1.175371       2.345327 0.1693762      3.202810 2.338506       3.443882 11.96218 5.351862 14.29146 5.957038 -2.329282      8.008041 
1 1 1 21  7  28 o 13.56658 5.302482 2.455191       2.539397 5.749404       3.540416 -1.035251      3.644338 18.23845 6.418093 11.52056 5.359243 6.717894       8.361423 
1 1 1 21  7  29 o 13.06672 5.251974 2.205014       2.557577 2.522131       3.503354 1.843148       3.742386 14.06497 5.944274 13.59750 5.946851 0.4674740      8.408296 
1 1 1 21  8  0  o 100.2092 2.427303 122.5719       5.927447 121.0331       8.090475 124.3549       8.709011 99.44370 3.343325 100.7719 3.552001 -1.328171      4.877964 
1 1 1 21  8  1  o 43.58582 3.239051 23.35036       3.415731 23.80093       4.507879 22.74289       5.234240 43.86755 4.270905 42.72842 5.129323 1.139122       6.674623 
1 1 1 21  8  2  o 15.29248 5.976689 1.743296       3.226059 2.389324       4.926054 1.258144       4.268867 18.56445 7.345728 16.46167 6.723351 2.102776       9.958070 
1 1 1 21  8  3  o 80.73698 2.639165 79.70181       5.185507 75.16298       7.092618 84.91396       7.600527 78.26372 3.729593 83.19179 3.758810 -4.928070      5.295141 
1 1 1 21  8  4  o 48.02979 3.117467 28.32701       3.629074 31.56799       4.818783 24.08002       5.516195 50.60384 3.938666 43.92676 5.257469 6.677086       6.569176 
1 1 1 21  8  5  o 101.7372 2.867709 126.6291       7.102598 133.3716       9.313986 117.2598       10.97941 104.2789 3.670970 97.57575 4.630650 6.703186       5.909225 
1 1 1 21  8  6  o 63.18133 3.040855 48.94600       4.668139 47.86814       5.718114 51.09984       8.083091 62.37301 3.779751 64.17812 5.213235 -1.805107      6.439281 
1 1 1 21  8  7  o 128.1010 3.014979 200.8107       9.411807 209.9949       12.52546 188.9000       14.26396 130.7417 3.935848 123.7651 4.738150 6.976601       6.159624 
1 1 1 21  8  8  o 137.3544 3.091103 231.0304       10.34647 232.2664       13.55872 229.3075       16.00883 137.4161 4.053404 136.2691 4.828509 1.147003       6.304331 
1 1 1 21  8  9  o 52.52390 3.165754 33.93173       4.033198 37.01508       4.817689 26.70823       7.373960 54.78885 3.628813 45.74089 6.823903 9.047958       7.728773 
1 1 1 21  8  10 o 63.25216 2.945128 49.13294       4.527118 49.62687       5.399707 47.96427       8.305808 63.46713 3.504893 61.87378 5.568070 1.593353       6.579338 
1 1 1 21  8  11 o 41.45972 4.021708 21.38918       4.012267 23.28451       4.908589 17.57331       6.964839 43.10387 4.751851 36.44756 8.056211 6.656311       9.353215 
1 1 1 21  8  12 o 46.36246 3.211859 26.54260       3.606335 24.84806       4.106298 32.25793       7.541299 44.72962 3.803235 50.26467 6.294307 -5.535049      7.354108 
1 1 1 21  8  13 o 14.32525 5.066135 2.257577       2.208054 3.631890       2.380824 -6.193864      5.904047 17.01503 5.233373 13.98200 6.604047 3.033033       8.426247 
1 1 1 21  8  14 o 56.26288 3.095304 39.09986       4.227511 40.40165       4.947626 35.57864       8.137190 57.06673 3.575740 52.46074 6.504310 4.605995       7.422396 
1 1 1 21  8  15 o 12.27057 4.853004 1.099264       2.149118 0.8527145E-01  2.314168 7.456751       5.794555 11.26124 4.798065 24.19788 8.225520 -12.93665      9.522636 
1 1 1 21  8  16 o 84.07451 2.628645 87.11295       5.378962 91.76297       6.237335 73.61996       10.62492 86.15499 2.975328 75.62614 5.809734 10.52885       6.527295 
1 1 1 21  8  17 o 23.70122 4.577133 7.314462       2.547908 6.328407       2.773359 12.65028       6.451435 21.84459 5.270847 29.86468 8.473761 -8.020090      9.979300 
1 1 1 21  8  18 o 30.13724 3.869066 11.57932       2.776016 11.90222       3.068762 10.12503       6.512620 30.42460 4.255284 26.66301 8.712306 3.761591       9.695964 
1 1 1 21  8  19 o 66.71291 2.857017 55.41392       4.633958 54.02233       5.044697 62.93077       11.72457 65.71209 3.159571 67.39115 7.253408 -1.679062      7.911688 
1 1 1 21  8  20 o 23.64394 4.765674 7.477329       2.650919 9.009943       2.949956 1.046824       6.042570 25.97961 4.837543 17.48964 7.604227 8.489975       9.012551 
1 1 1 21  8  21 o 35.86152 3.948650 16.67413       3.393706 17.40259       3.544198 8.638607       11.77121 36.59277 4.041811 24.94323 10.72833 11.64954       11.46443 
1 1 1 21  8  22 o 27.11803 4.884072 10.03534       3.108887 10.85542       3.221439 -1.089344      11.86493 28.24459 4.855325 20.18838 9.481585 8.056210       10.65245 
1 1 1 21  8  23 o 7.221395 3.568995 -4.743991      2.300273 -4.513903      2.487666 -6.100903      6.041162 7.780515 3.819120 13.11958 6.326229 -5.339063      7.389645 
1 1 1 21  8  24 o 25.11098 4.863365 8.824673       2.868495 7.134793       3.200407 15.72756       6.468337 21.89744 5.875838 30.01661 8.473960 -8.119173      10.31181 
1 1 1 21  8  25 o 20.88814 6.273050 6.825164       3.448548 6.581086       4.264919 7.286127       5.861090 20.11894 7.047015 20.62104 8.056863 -0.5021076     10.70390 
1 1 1 21  8  26 o 10.76815 5.033278 -1.751551      3.276868 -3.962015      4.085054 2.237767       5.487891 10.83597 5.219310 15.96662 7.082901 -5.130645      8.798221 
1 1 1 21  8  27 o 7.699626 3.788323 -4.281238      2.494407 -3.801802      2.845528 -5.872244      5.183629 8.662848 4.215756 11.35803 5.562305 -2.695177      6.979387 
1 1 1 21  8  28 o 27.91556 4.885778 11.62299       3.202646 10.04411       3.667662 16.69200       6.571681 24.52843 6.148485 27.36355 8.735695 -2.835117      10.68252 
1 1 1 21  8  29 o 13.91161 5.302365 2.840325       2.493402 1.351734       3.343070 4.706532       3.743155 12.79667 5.608001 16.46708 6.437266 -3.670413      8.537451 
1 1 1 21  9  0  o 74.22516 2.649132 67.36354       4.784029 65.80889       6.570349 69.11781       6.979444 73.24137 3.693173 75.04584 3.829094 -1.804466      5.319914 
1 1 1 21  9  1  o 150.7730 3.228328 277.9420       11.86144 261.6360       21.71441 284.8767       14.16082 145.5044 6.137795 152.5391 3.809526 -7.034729      7.223920 
1 1 1 21  9  2  o 55.36370 2.906320 37.55926       3.907339 37.58211       5.247641 37.53083       5.853493 55.25273 3.922906 55.14346 4.392242 0.1092644      5.889056 
1 1 1 21  9  3  o 139.8778 2.766862 239.0737       9.431317 234.3604       13.73844 243.2747       12.97046 138.2032 4.083757 140.8790 3.781516 -2.675766      5.565692 
1 1 1 21  9  4  o 77.00831 2.674871 72.54797       5.012065 69.86088       6.805453 75.73300       7.409236 75.42555 3.713984 78.51080 3.884711 -3.085251      5.374445 
1 1 1 21  9  5  o 56.72325 4.040010 39.67177       5.547886 45.88529       8.563293 35.17725       7.283057 60.65356 5.866753 53.06846 5.722064 7.585098       8.195169 
1 1 1 21  9  6  o 86.44221 2.893020 91.49950       6.085567 95.78025       7.750721 84.61855       9.826664 88.32298 3.608675 82.73733 4.895694 5.585655       6.081970 
1 1 1 21  9  7  o 82.31788 2.887705 83.01575       5.783755 86.64471       7.306031 76.92352       9.466260 83.97929 3.578242 78.81553 4.953734 5.163757       6.110917 
1 1 1 21  9  8  o 92.92021 3.385066 106.0172       7.652212 110.3183       10.86598 101.7852       10.77827 94.44520 4.736322 90.66320 4.896623 3.781998       6.812464 
1 1 1 21  9  9  o 53.95748 3.626134 35.92547       4.740266 32.98792       5.932928 41.11083       7.882534 51.44908 4.787039 57.22852 5.729142 -5.779442      7.465843 
1 1 1 21  9  10 o 43.13735 3.381668 22.99407       3.526447 26.36653       4.075599 12.94798       7.034241 46.15955 3.652974 31.27768 8.839257 14.88187       9.564344 
1 1 1 21  9  11 o 77.83300 2.554162 74.27762       4.837933 71.77434       5.413236 84.21243       10.78405 76.43699 2.911468 82.00620 5.426862 -5.569214      6.158528 
1 1 1 21  9  12 o 24.59185 4.252580 7.692695       2.456291 6.959318       2.632957 12.61399       6.820557 23.24841 4.806321 30.68000 8.715388 -7.431599      9.952825 
1 1 1 21  9  13 o 84.07539 2.543173 86.78676       5.204528 88.64234       5.976500 80.96358       10.58734 84.87572 2.893763 80.11280 5.455667 4.762917       6.175611 
1 1 1 21  9  14 o 66.03380 2.585385 53.63825       4.152289 53.78371       4.656711 53.07384       9.172901 66.04272 2.900539 64.42005 5.908943 1.622665       6.582457 
1 1 1 21  9  15 o 71.15288 2.870663 62.49265       4.967276 61.65140       5.809778 64.77870       9.577283 70.49194 3.392035 71.20584 5.563520 -0.7138977     6.516031 
1 1 1 21  9  16 o 60.98352 2.674454 45.92386       3.964846 49.72411       4.487604 32.40368       8.464463 63.38365 2.913158 49.10344 7.295134 14.28022       7.855282 
1 1 1 21  9  17 o 66.58450 2.841534 54.93703       4.600047 57.87276       4.825839 25.74875       15.21667 68.31770 2.905335 38.90460 13.32715 29.41310       13.64016 
1 1 1 21  9  18 o 20.75154 4.981832 5.742081       2.487316 6.065338       2.537970 -2.114501      12.51207 21.33517 4.973660 22.19391 10.18298 -0.8587341     11.33272 
1 1 1 21  9  19 o 28.62169 4.091859 10.59642       2.772864 10.49082       2.850850 12.44767       11.93660 28.41456 4.247294 28.52983 11.38719 -0.1152725     12.15350 
1 1 1 21  9  20 o 12.38366 4.848935 1.368935       2.126759 0.6728964      2.311095 5.217389       5.434309 11.74101 4.885825 20.36492 7.811573 -8.623909      9.213682 
1 1 1 21  9  21 o 26.75685 4.008112 9.397209       2.533082 8.042326       2.775704 16.14676       6.195263 24.32305 4.853132 32.36386 7.920719 -8.040812      9.289277 
1 1 1 21  9  22 o 9.024969 4.184327 -1.518168      2.193259 -1.164397      2.339140 -4.091971      6.309318 9.685437 4.428478 14.38798 6.805133 -4.702540      8.119190 
1 1 1 21  9  23 o 16.21945 5.208109 3.644799       2.333309 3.451891       2.524945 4.772876       6.105847 15.92839 5.429480 19.30206 7.978709 -3.373666      9.650858 
1 1 1 21  9  24 o 21.59462 4.945148 6.627723       2.546165 5.780974       2.800054 10.67197       6.119387 19.81751 5.568619 24.42998 8.448208 -4.612469      10.11839 
1 1 1 21  9  25 o 30.36060 4.074957 12.54131       2.938818 15.07953       3.314438 3.208320       6.355588 33.23257 4.185322 17.42081 7.679952 15.81176       8.746346 
1 1 1 21  9  26 o 14.85690 5.388207 3.130033       2.514547 3.594222       2.794219 1.153201       5.766314 15.66231 5.680003 15.36288 6.996984 0.2994242      9.012226 
1 1 1 21  9  27 o 15.52297 5.542332 3.658450       2.648386 3.402344       2.923869 4.828640       6.249954 15.18474 5.752567 17.43920 7.654447 -2.254456      9.575103 
1 1 1 21  9  28 o 17.89520 5.674176 5.253718       2.776503 4.718105       2.987962 8.641068       7.514145 16.88067 5.899462 19.25514 8.423780 -2.374464      10.28415 
1 1 1 21  10 0  o 134.0722 3.499001 220.0712       11.42214 213.1468       18.28793 224.4999       14.62564 131.4183 5.724210 135.2182 4.444616 -3.799881      7.247151 
1 1 1 21  10 1  f 67.54434 3.005104 55.87452       4.933963 60.04863       6.325716 49.39016       7.884268 69.93329 3.725284 63.16593 5.167150 6.767357       6.370022 
1 1 1 21  10 2  o 54.83082 2.959400 36.85667       3.939600 38.94694       5.270196 34.20931       5.931038 56.25028 3.868283 52.57100 4.678473 3.679279       6.070563 
1 1 1 21  10 3  o 21.36309 6.248767 5.751436       3.458478 3.860996       4.968713 7.528100       4.816873 20.12479 7.525836 24.49525 7.426445 -4.370455      10.57309 
1 1 1 21  10 4  o 151.4133 3.306964 280.6357       12.20196 314.6064       23.97824 268.7647       14.17448 159.2844 6.189209 147.9834 3.934083 11.30104       7.333711 
1 1 1 21  10 5  o 37.38597 3.745871 17.30778       3.366777 20.05772       4.367930 13.28239       5.284671 40.13483 4.545949 32.07000 6.962205 8.064831       8.314923 
1 1 1 21  10 6  f 50.51720 3.279622 31.39087       4.015553 30.67124       4.800105 33.06859       7.329226 49.81936 3.987070 51.31433 5.972658 -1.494972      7.181181 
1 1 1 21  10 7  o 63.80261 3.610013 50.10981       5.589950 57.51794       7.646418 41.60561       8.192579 68.15621 4.631310 57.59980 5.920870 10.55641       7.517030 
1 1 1 21  10 8  o 65.74827 2.953042 53.05640       4.719328 55.22812       5.667480 48.14499       8.522950 66.98910 3.483731 62.00147 5.704856 4.987625       6.684442 
1 1 1 21  10 9  o 26.95122 4.557283 9.212437       2.886507 7.612636       3.239767 15.37158       6.356836 24.26808 5.593052 34.17666 7.804553 -9.908579      9.601733 
1 1 1 21  10 10 o 80.33108 2.873542 79.22302       5.616128 83.14077       6.780252 70.66021       10.02388 82.17523 3.393158 75.09546 5.516036 7.079773       6.476123 
1 1 1 21  10 11 o 52.56207 2.727432 33.96714       3.481564 34.01922       3.820250 33.71186       8.457703 52.55412 2.995374 51.13652 6.968218 1.417599       7.584743 
1 1 1 21  10 12 o 53.09768 2.858374 34.72507       3.684910 35.89403       3.837000 20.85032       13.21918 53.97230 2.928292 38.35731 12.40364 15.61499       12.74462 
1 1 1 21  10 13 o 32.23791 3.557768 12.99203       2.748558 13.62460       2.825463 1.844283       11.86125 33.01986 3.567982 24.91443 10.74310 8.105429       11.32010 
1 1 1 21  10 14 o 33.17577 3.416458 13.74910       2.722616 13.76671       2.789735 13.39636       12.48703 33.17636 3.503479 31.94988 11.93410 1.226475       12.43773 
1 1 1 21  10 15 o 60.52647 2.784642 45.24777       4.096242 47.32680       4.258007 19.43468       15.00361 61.89033 2.830733 35.90307 13.14035 25.98726       13.44179 
1 1 1 21  10 16 o 61.27032 3.952574 47.15888       5.870067 46.98448       7.530406 47.42898       9.371367 60.52891 5.154262 59.94430 6.520267 0.5846138      8.311456 
1 1 1 21  10 17 o 35.36240 3.046972 15.63194       2.600126 16.00101       2.812249 13.45869       6.824324 35.71363 3.267514 30.41396 8.743110 5.299671       9.333735 
1 1 1 21  10 18 f 22.77632 5.531959 7.027659       3.039510 8.898677       3.532259 1.689672       5.966262 25.57241 5.801827 18.15244 7.718072 7.419971       9.655560 
1 1 1 21  10 19 o 21.12142 5.441519 6.096780       2.818039 6.558597       3.174217 4.378458       6.122863 21.78846 5.854016 20.22548 8.127261 1.562981       10.01608 
1 1 1 21  10 20 o 19.16492 5.674788 5.078069       2.837663 7.708321       3.296778 -2.442011      5.574453 23.46001 5.799915 14.58558 6.730081 8.874430       8.884425 
1 1 1 21  10 21 o 9.185970 4.311229 -2.122971      2.445647 -2.614887      2.746392 -0.2387091     5.375115 9.530658 4.502357 15.44108 6.918894 -5.910424      8.254836 
1 1 1 21  10 22 o 28.86355 4.661068 11.30488       3.166800 11.93614       3.613638 9.215373       6.574481 29.28732 5.256391 23.64515 8.691090 5.642168       10.15700 
1 1 1 21  10 23 o 8.295007 3.821937 -1.098953      1.788466 -0.7905235     1.887216 -3.816910      5.602282 8.868466 4.024898 13.40436 6.361191 -4.535898      7.527586 
1 1 1 21  10 24 f 27.31719 3.863981 10.00319       2.500489 9.471120       2.638864 14.68108       7.824548 26.32201 4.259395 26.85324 9.532908 -0.5312347     10.44121 
1 1 1 21  10 25 o 14.57570 4.990459 2.968203       2.133598 3.113188       2.296905 2.056002       5.761377 14.88815 5.174397 16.18959 7.214978 -1.301440      8.878642 
1 1 1 21  10 26 o 17.10703 5.233809 4.442423       2.385193 3.941193       2.527308 8.526931       7.214557 16.14471 5.432539 20.36007 8.563372 -4.215357      10.14119 
1 1 1 21  10 27 o 9.410897 4.253816 -0.4327471     2.082527 0.3989953      2.194470 -7.966896      6.604689 10.52324 4.578874 12.12585 6.002783 -1.602611      7.549801 
1 1 1 21  10 28 o 30.86946 4.263155 13.67511       3.121456 12.78050       3.461419 17.57003       7.222502 28.94883 5.092525 26.53321 9.178010 2.415615       10.49617 
1 1 1 21  11 0  o 41.21564 3.442898 20.92949       3.426417 17.76563       4.461740 25.47777       5.349571 37.69921 4.978186 45.26936 4.928785 -7.570145      7.005374 
1 1 1 21  11 1  o 131.6790 2.713506 211.8596       8.707294 205.6283       12.71589 217.3610       11.94791 129.4483 4.035944 133.1713 3.685216 -3.722931      5.465314 
1 1 1 21  11 2  o 89.75868 3.461661 98.78091       7.557570 94.64838       11.43088 101.9902       10.07340 87.46883 5.388947 91.00173 4.556951 -3.532898      7.057376 
1 1 1 21  11 3  o 160.7391 3.832182 316.7851       15.01080 324.5189       24.86752 312.3518       18.82789 161.7069 6.322745 159.2379 4.857660 2.468918       7.973329 
1 1 1 21  11 4  o 25.06696 5.542929 8.060909       3.295910 7.680281       3.849757 9.105677       6.378113 24.43361 6.393082 27.04705 8.602882 -2.613440      10.71826 
1 1 1 21  11 5  o 20.77901 6.768687 5.214997       3.932464 8.446545       4.982828 -0.1216034     6.403288 25.70417 7.495426 18.46070 7.925991 7.243464       10.90884 
1 1 1 21  11 6  o 20.79211 5.992490 5.491975       3.201958 7.755186       3.380965 -14.19893      9.972660 24.53014 5.755672 16.97371 8.170381 7.556437       9.994142 
1 1 1 21  11 7  o 59.09785 3.306668 42.96454       4.743108 39.27416       5.088191 67.43616       13.10266 56.42112 3.721496 72.83822 7.488382 -16.41710      8.362141 
1 1 1 21  11 8  o 35.49174 4.139182 15.72603       3.512837 15.73434       3.722369 15.65842       10.62004 35.44561 4.404147 34.54225 11.11296 0.9033623      11.95384 
1 1 1 21  11 9  o 21.93332 5.453646 6.222028       2.902586 6.670305       3.018641 0.7261192      10.56959 22.70101 5.512481 23.67242 10.17366 -0.9714088     11.57112 
1 1 1 21  11 10 o 85.42830 2.718956 89.55495       5.653100 88.72697       6.011323 95.88743       16.62449 84.98918 2.906765 86.14070 8.011442 -1.151520      8.522470 
1 1 1 21  11 11 o 24.51329 4.157709 7.635567       2.395001 7.952746       2.581204 5.672068       6.422229 24.97341 4.402192 23.02310 8.566676 1.950317       9.631575 
1 1 1 21  11 12 o 51.26496 2.704145 32.35945       3.366264 32.33055       3.681590 32.50681       8.313334 51.18840 2.964075 49.94458 7.024301 1.243820       7.624077 
1 1 1 21  11 13 o 49.74258 3.405316 30.71138       4.102931 32.63853       4.794321 25.43756       7.931070 51.15094 3.875077 43.60197 7.748197 7.548962       8.663185 
1 1 1 21  11 14 o 54.21348 3.300156 36.48674       4.339260 38.58424       5.104429 31.02118       8.239735 55.59387 3.790441 48.30909 7.220401 7.284779       8.154853 
1 1 1 21  11 15 o 75.49217 2.481691 70.20671       4.559268 71.04499       5.111749 66.94540       10.08254 75.84035 2.770534 71.99400 5.795892 3.846344       6.424035 
1 1 1 21  11 16 o 34.09610 2.933260 14.49423       2.413535 14.95263       2.588172 11.43720       6.683733 34.58867 3.103556 28.32716 8.778288 6.261513       9.310768 
1 1 1 21  11 17 o 14.09758 4.543354 2.490128       1.774571 3.431551       1.863860 -6.635392      5.802964 16.17678 4.542481 13.25210 6.340243 2.924674       7.799540 
1 1 1 21  11 18 o 15.10690 6.320405 1.217803       3.898280 -3.600306      5.258321 7.097252       5.808675 13.74500 6.408590 22.84595 8.202073 -9.100950      10.40884 
1 1 1 21  11 19 o 34.77027 6.166698 16.74360       5.033812 27.47680       8.111232 10.02043       6.419621 43.13067 8.012155 25.68151 8.658275 17.44917       11.79662 
1 1 1 21  11 20 o 27.89936 6.876635 11.42887       4.644869 7.000425       6.835625 15.22765       6.331030 22.31583 8.706158 31.23393 8.211046 -8.918098      11.96739 
1 1 1 21  11 21 f 22.09177 7.205638 7.362107       4.455839 2.849670       6.636099 11.06682       6.012906 18.61829 8.031975 26.07020 8.359529 -7.451914      11.59286 
1 1 1 21  11 22 o 15.58859 6.573839 1.921536       4.269574 -0.7859073     6.275599 4.254663       5.825655 15.82123 7.241361 18.84149 7.791399 -3.020252      10.63688 
1 1 1 21  11 23 o 13.75067 6.432197 -2.360342      5.368108 1.487832       6.130151 -15.01602      11.11697 16.72421 7.448460 15.29570 7.608711 1.428502       10.64763 
1 1 1 21  11 24 o 20.43800 7.657234 6.999667       5.148674 0.8561954      6.675231 16.02224       8.089555 16.39139 7.489467 27.49604 9.699361 -11.10465      12.25438 
1 1 1 21  11 25 o 19.28968 7.503297 6.351457       5.065318 4.576945       6.989904 8.313821       7.350581 18.20575 8.038845 20.70516 8.671926 -2.499414      11.82478 
1 1 1 21  11 26 o 13.06637 6.245821 -2.762767      5.604506 0.000000       0.000000 -2.762767      5.604506 ?        ?        13.06637 6.245821 0.000000       6.245821 
1 1 1 21  11 27 o 20.16526 8.102387 8.750159       6.084900 0.000000       0.000000 8.750159       6.084900 ?        ?        20.16526 8.102387 0.000000       8.102387 
1 1 1 21  11 28 o 12.97504 6.018579 -0.5497532E-01 4.545742 4.287457       7.056946 -3.134628      5.942937 16.63521 7.638071 12.79263 6.194327 3.842587       9.834114 
1 1 1 21  12 0  o 67.06599 3.189461 55.14486       5.197678 46.20735       9.298644 59.20641       6.268404 60.78395 6.372222 69.42212 3.718869 -8.638165      7.378022 
1 1 1 21  12 1  o 20.55324 6.503555 5.166829       3.649147 6.293011       6.034882 4.517726       4.581641 23.76882 8.378125 20.46140 7.291472 3.307413       11.10669 
1 1 1 21  12 2  o 40.17482 3.585684 19.93069       3.473585 18.29437       4.651295 21.99401       5.223049 38.20140 5.125638 41.92552 5.225325 -3.724121      7.319575 
1 1 1 21  12 3  o 69.89761 2.780765 59.83729       4.727103 67.09710       6.737107 52.79726       6.634345 73.87181 3.754787 65.43021 4.182769 8.441597       5.620852 
1 1 1 21  12 4  o 129.1039 3.144549 204.0957       9.893134 201.9274       17.58410 205.0999       11.96677 127.5901 5.669610 129.2187 3.804422 -1.628662      6.827745 
1 1 1 21  12 5  o 62.91471 2.892398 48.54930       4.422654 51.80506       5.884151 44.32168       6.705107 64.85419 3.738991 59.79048 4.638152 5.063713       5.957559 
1 1 1 21  12 6  o 32.18212 4.224064 12.96444       3.232798 13.06980       3.730716 12.64685       6.477060 32.16834 4.914840 31.03976 8.372161 1.128582       9.708179 
1 1 1 21  12 7  o 78.89877 2.934487 76.38348       5.632239 81.97456       6.921089 65.42133       9.691142 81.62309 3.487607 72.34673 5.539049 9.276360       6.545568 
1 1 1 21  12 8  o 70.24438 2.927784 60.59993       5.000732 66.10683       6.106251 49.38458       8.714191 73.26644 3.429575 62.66217 5.771505 10.60427       6.713588 
1 1 1 21  12 9  o 33.37149 3.491304 13.84762       2.797256 14.98443       3.079690 8.488638       6.686592 34.68707 3.700449 26.17938 8.836481 8.507689       9.580016 
1 1 1 21  12 10 o 12.02809 4.814313 0.9127584      2.139695 0.8163242      2.297173 1.544645       5.880280 12.22364 4.954435 18.77138 7.800910 -6.547744      9.241246 
1 1 1 21  12 11 o 52.78787 3.276911 34.45517       4.194577 36.51445       4.975651 29.39671       7.798337 54.21740 3.789820 47.53405 6.936595 6.683350       7.904371 
1 1 1 21  12 12 o 10.93387 4.507154 0.4921073      1.941211 0.1800670      2.039186 3.507283       6.338810 10.74094 4.537043 20.78005 8.296751 -10.03911      9.456259 
1 1 1 21  12 13 o 21.39498 4.152009 5.888445       2.086646 5.694664       2.211128 7.465540       6.307952 20.96487 4.464896 24.42665 8.569179 -3.461782      9.662615 
1 1 1 21  12 14 o 34.83944 5.891675 15.93107       4.823885 19.18951       6.782492 12.59558       6.862214 37.47446 7.685210 29.97299 8.811605 7.501472       11.69217 
1 1 1 21  12 15 o 69.22163 4.121847 60.32041       6.921476 77.11401       10.76854 48.49860       9.034972 77.14870 5.769641 60.82959 6.180760 16.31912       8.455209 
1 1 1 21  12 16 o 10.66011 5.079099 -4.265629      3.643726 -4.688044      4.825261 -3.705159      5.558115 12.62013 5.963660 14.30614 6.642582 -1.686009      8.926878 
1 1 1 21  12 17 o 33.92971 5.977059 15.55223       4.761544 15.91302       6.513940 15.13825       6.977627 33.04681 8.142383 31.86243 8.729831 1.184383       11.93769 
1 1 1 21  12 18 f 16.07673 6.612638 1.912904       4.166444 -1.756918      5.927963 5.495583       5.857159 15.63304 7.110042 21.07952 8.103621 -5.446478      10.78060 
1 1 1 21  12 19 o 42.03413 5.412862 23.84573       5.415970 26.86695       8.219556 21.52754       7.199988 42.09507 8.307837 37.78241 8.065535 4.312656       11.57899 
1 1 1 21  12 20 o 51.51802 5.387285 36.14768       6.663534 34.24520       9.135983 38.31018       9.740346 47.03230 8.273106 49.70764 8.335932 -2.675343      11.74445 
1 1 1 21  12 21 o 14.50693 6.398256 0.3082400      4.415940 3.384918       6.397655 -2.491496      6.102929 18.70752 7.974434 14.87175 6.923943 3.835763       10.56090 
1 1 1 21  12 22 o 52.91526 7.815315 44.28959       9.774875 44.28959       9.774875 0.000000       0.000000 52.91526 7.815315 ?        ?        0.000000       7.815315 
1 1 1 21  12 23 o 20.09439 7.318955 6.406401       4.646297 8.224383       7.225662 5.124753       6.066902 21.74055 8.795926 19.10253 7.929861 2.638029       11.84276 
1 1 1 21  12 24 f 19.47054 9.108862 4.110332       10.77066 0.000000       0.000000 4.110332       10.77066 ?        ?        19.47054 9.108862 0.000000       9.108862 
1 1 1 21  12 25 o 19.12590 7.451809 6.382771       5.002521 11.53410       8.544503 3.696147       6.170645 22.23402 9.333430 17.14775 7.563162 5.086264       12.01309 
1 1 1 21  12 26 o 14.68822 6.570587 1.656846       4.825810 -7.897819      7.274646 9.166059       6.449133 12.82318 6.339254 20.71604 8.335205 -7.892860      10.47195 
1 1 1 21  12 27 o 13.28884 6.161175 -0.6562477E-01 4.755029 0.1798499      7.324938 -0.2444091     6.251228 15.15355 7.214786 14.35505 6.784817 0.7985039      9.903882 
1 1 1 21  13 0  o 75.28690 3.778174 69.65856       6.909509 0.000000       0.000000 69.65856       6.909509 ?        ?        75.28690 3.778174 0.000000       3.778174 
1 1 1 21  13 1  o 94.41376 2.633464 109.0370       6.053051 99.66936       8.429219 119.0109       8.697709 90.06103 3.849616 98.47086 3.630825 -8.409836      5.291732 
1 1 1 21  13 2  o 57.96289 2.961725 41.21470       4.169545 38.84676       5.634707 44.08052       6.198832 56.08242 4.152410 59.73470 4.286911 -3.652279      5.968259 
1 1 1 21  13 3  o 47.59814 3.802019 27.98267       4.373384 19.84243       7.068467 33.03165       5.566839 39.13764 7.685701 51.61564 4.469806 -12.47800      8.890961 
1 1 1 21  13 4  o 26.59591 4.716246 8.975866       2.944749 9.006559       3.627336 8.916537       5.043191 26.44693 5.789268 26.30044 7.501884 0.1464882      9.475964 
1 1 1 21  13 5  o 129.5610 3.412626 206.1123       10.76517 218.4558       12.76293 175.6788       20.04038 133.2189 3.935724 118.1499 6.991697 15.06905       8.023326 
1 1 1 21  13 6  o 112.6034 3.225086 155.6834       8.840590 151.7853       10.08838 168.5820       18.35134 111.0391 3.733599 115.8322 6.527750 -4.793060      7.520059 
1 1 1 21  13 7  o 32.40355 4.077642 13.14376       3.148730 11.86271       3.581617 17.50315       6.607067 30.55580 4.981512 36.50539 7.671188 -5.949596      9.146726 
1 1 1 21  13 8  o 10.91949 4.773151 -0.4684359     2.408198 1.564349       2.684470 -8.847475      5.450168 14.02514 5.460401 12.16450 5.900053 1.860646       8.039066 
1 1 1 21  13 9  o 39.37883 3.691393 19.28474       3.501035 23.11793       4.177179 10.23465       6.418446 43.06855 4.026714 27.93091 8.593121 15.13765       9.489792 
1 1 1 21  13 10 o 20.51804 4.620683 5.439357       2.254609 5.553218       2.427497 4.724345       6.083141 20.69896 4.890705 21.75836 8.284698 -1.059401      9.620563 
1 1 1 21  13 11 o 54.30452 2.590594 36.28646       3.418355 37.34599       3.767916 31.35789       8.126534 55.04443 2.818383 48.97110 7.009380 6.073334       7.554780 
1 1 1 21  13 12 o 34.28582 3.664391 14.72625       3.014213 14.55893       3.344928 15.44908       6.952394 33.96543 4.125739 33.46670 8.507669 0.4987335      9.455272 
1 1 1 21  13 13 o 53.12749 4.823721 35.82622       6.177068 34.91048       8.095987 37.10197       9.555761 51.56930 6.592909 52.53709 7.691677 -0.9677887     10.13056 
1 1 1 21  13 14 o 14.82394 6.230346 0.7888290      3.814576 3.425808       5.110030 -2.530026      5.732767 19.12381 7.507842 15.36124 6.988599 3.762568       10.25710 
1 1 1 21  13 15 o 18.29731 6.701926 3.849569       3.904008 4.246840       5.363543 3.401930       5.693414 20.03417 7.740697 19.53710 7.841758 0.4970722      11.01869 
1 1 1 21  13 16 o 16.05553 6.520677 1.933240       3.988435 -0.9445441     5.403668 5.377313       5.911473 15.64612 6.979139 21.36514 8.159221 -5.719013      10.73691 
1 1 1 21  13 17 o 13.38528 5.974483 -0.8689592     3.966547 -7.043154      5.179563 7.886977       6.168140 12.01551 5.809531 23.75355 8.460696 -11.73804      10.26324 
1 1 1 21  13 18 o 40.52058 6.120260 22.60132       5.855206 26.64639       8.009153 17.95749       8.581463 42.39990 8.045742 32.96936 9.894291 9.430546       12.75268 
1 1 1 21  13 19 o 31.08837 7.379204 14.45430       5.506177 21.10682       7.707011 7.518569       7.869347 36.39819 8.789190 23.04951 9.230309 13.34868       12.74553 
1 1 1 21  13 20 o 20.82960 7.478092 6.342637       4.828476 2.780158       6.491255 10.75531       7.224428 18.49008 7.959959 25.32707 9.140236 -6.836987      12.12043 
1 1 1 21  13 21 o 18.91429 7.831573 4.252415       5.896282 0.000000       0.000000 4.252415       5.896282 ?        ?        18.91429 7.831573 0.000000       7.831573 
1 1 1 21  13 22 o 14.73197 6.787838 -1.172720      5.641445 0.000000       0.000000 -1.172720      5.641445 ?        ?        14.73197 6.787838 0.000000       6.787838 
1 1 1 21  13 23 o 31.60507 7.087901 16.05251       5.324040 23.65450       8.111346 10.29844       7.056946 35.34251 9.295528 23.20119 8.901171 12.14132       12.87003 
1 1 1 21  13 24 o 20.15556 7.418350 7.013053       4.792537 5.288940       7.165409 8.408669       6.446754 18.80863 8.227270 21.08481 8.383992 -2.276178      11.74646 
1 1 1 21  13 25 o 21.40617 7.571537 8.592243       4.932178 4.286835       7.568077 11.77091       6.502802 17.77526 8.064358 23.43513 8.638482 -5.659874      11.81767 
1 1 1 21  13 26 o 12.92621 6.035127 -0.8505285     4.689281 -5.538829      6.997306 2.971552       6.317904 13.17578 6.454595 16.23549 7.366758 -3.059712      9.794434 
1 1 1 21  13 27 o 11.91204 5.696623 -2.453029      4.673578 -0.3388642     7.426835 -3.839119      6.013535 14.92191 7.148127 12.67501 6.159201 2.246899       9.435649 
1 1 1 21  14 0  o 53.76722 3.575696 35.59284       4.658428 31.87503       8.618706 37.12723       5.536897 50.03631 7.281906 54.81769 4.176292 -4.781376      8.394496 
1 1 1 21  14 1  f 94.94321 2.635561 110.3014       6.091900 110.2129       8.773891 110.3837       8.464910 94.68671 3.810263 94.79001 3.671518 -0.1032944     5.291328 
1 1 1 21  14 2  o 110.1756 2.637451 148.4548       7.081184 140.6441       10.07913 156.0676       9.950715 106.9399 3.874051 112.7216 3.627244 -5.781662      5.307087 
1 1 1 21  14 3  o 62.70824 3.355026 48.35940       5.108258 54.32785       8.791744 45.31758       6.276404 65.97879 5.518582 60.51990 4.283432 5.458889       6.985881 
1 1 1 21  14 4  o 78.14608 2.904897 74.90150       5.522268 70.36852       6.708962 84.42528       9.724524 75.59512 3.652689 82.49809 4.858648 -6.902969      6.078536 
1 1 1 21  14 5  o 70.99843 2.724525 61.81647       4.705101 64.05623       6.292371 58.97596       7.086169 72.10586 3.592340 69.03053 4.232797 3.075333       5.551709 
1 1 1 21  14 6  o 20.46382 5.522972 5.392684       2.817654 5.085030       3.137681 6.674262       6.403978 20.02622 5.976522 24.17927 8.620002 -4.153048      10.48920 
1 1 1 21  14 7  o 51.25702 3.152383 32.38628       3.918522 29.91858       4.508782 40.00368       7.921650 49.12792 3.795537 56.24809 5.865330 -7.120163      6.986286 
1 1 1 21  14 8  o 57.02513 3.201891 40.10662       4.431605 41.48161       5.244927 36.67546       8.285322 57.87194 3.739090 53.52453 6.484199 4.347404       7.485027 
1 1 1 21  14 9  o 46.83237 2.784446 27.02320       3.163414 28.22095       3.501453 21.70314       7.379475 47.81648 3.020365 40.42543 7.773176 7.391048       8.339356 
1 1 1 21  14 10 o 59.75418 4.344621 44.64341       6.283176 62.20596       9.302725 29.91106       8.520252 70.08450 5.490738 47.55058 7.609400 22.53393       9.383559 
1 1 1 21  14 11 o 22.29974 6.872188 6.472340       4.102955 8.738401       5.371740 3.299036       6.356750 25.62703 7.857056 20.56009 8.274297 5.066940       11.41040 
1 1 1 21  14 12 o 44.47105 4.835690 25.16147       5.156209 26.21718       7.244524 24.07765       7.340381 44.47886 6.907759 42.35738 7.379419 2.121475       10.10806 
1 1 1 21  14 13 o 40.64158 5.274045 21.33057       5.100299 29.01971       7.275663 13.90110       7.151756 46.84241 6.552816 31.27865 8.937346 15.56376       11.08222 
1 1 1 21  14 14 o 11.71203 5.465827 -3.179790      3.839438 -1.481000      5.098866 -5.404361      5.834813 14.98880 6.725737 13.94692 6.580721 1.041882       9.409645 
1 1 1 21  14 15 o 54.09659 4.767191 37.64000       6.220240 47.69824       8.858719 27.85837       8.736058 59.94034 6.152005 44.09831 8.436665 15.84203       10.44148 
1 1 1 21  14 16 o 31.71224 6.737047 14.01236       5.045514 11.82596       6.542270 17.22152       7.926075 28.19160 8.676026 33.47857 9.355252 -5.286972      12.75908 
1 1 1 21  14 17 o 39.50274 6.419987 21.60606       5.968126 23.32404       8.271401 19.74033       8.619784 39.00978 8.898537 35.00378 9.746721 4.006001       13.19782 
1 1 1 21  14 18 o 28.62945 8.786972 13.05294       6.716267 0.000000       0.000000 13.05294       6.716267 ?        ?        28.62945 8.786972 0.000000       8.786972 
1 1 1 21  14 19 o 15.90555 7.166648 -0.4267361     5.856807 0.000000       0.000000 -0.4267361     5.856807 ?        ?        15.90555 7.166648 0.000000       7.166648 
1 1 1 21  14 20 o 15.30220 6.510397 1.510457       4.249953 6.375339       6.661948 -1.828138      5.518830 21.17484 8.488249 14.52594 6.700364 6.648900       10.81412 
1 1 1 21  14 21 o 17.04382 6.798207 3.503342       4.251548 2.115127       6.284952 4.674542       5.772835 17.44812 7.666542 19.03172 7.801024 -1.583603      10.93763 
1 1 1 21  14 22 o 11.19909 5.332453 -3.455242      4.003042 -1.927312      6.200754 -4.547061      5.241654 14.79069 6.916859 12.48153 5.986000 2.309159       9.147411 
1 1 1 21  14 23 o 21.42288 7.386119 7.830555       4.676139 4.579370       6.774990 10.78848       6.462210 18.51970 8.051994 23.63952 8.628242 -5.119818      11.80174 
1 1 1 21  14 24 o 14.28222 6.390626 0.9513971      4.568261 -2.779414      6.685728 4.218643       6.256594 14.27027 6.821413 17.59335 7.691939 -3.323081      10.28093 
1 1 1 21  14 25 o 10.51032 5.170863 -6.368027      4.644648 2.755566       7.470735 -12.11645      5.930002 16.81328 7.769761 10.49052 5.268172 6.322762       9.387375 
1 1 1 21  14 26 o 18.69148 7.427786 6.701494       5.057109 7.112235       8.099401 6.439053       6.474175 18.58153 8.394964 18.24895 7.903075 0.3325863      11.52970 
1 1 1 21  15 0  o 126.2095 3.119143 195.1013       9.593198 177.4145       17.85608 202.2778       11.37413 119.3043 6.162660 128.3382 3.640536 -9.033867      7.157645 
1 1 1 21  15 1  o 38.33212 4.454586 18.34030       4.083668 16.17696       7.558903 19.23194       4.852804 35.00134 8.856466 39.09661 5.224141 -4.095272      10.28244 
1 1 1 21  15 2  o 86.19931 3.124717 91.18928       6.552868 91.90263       11.81073 90.87203       7.876344 85.83408 5.678440 85.90845 3.771485 -0.7437897E-01 6.816802 
1 1 1 21  15 3  o 78.10107 2.677260 74.75473       5.087929 78.67575       7.022035 70.42104       7.382313 79.93793 3.614088 75.52332 4.025753 4.414604       5.410021 
1 1 1 21  15 4  o 84.46931 2.903236 87.54929       5.967209 91.29397       7.459779 80.89588       9.943532 86.10799 3.562752 80.60531 5.088183 5.502686       6.211506 
1 1 1 21  15 5  o 37.69176 3.458251 17.60842       3.141057 21.58705       4.006177 11.25990       5.060565 41.65753 3.995312 29.27849 7.154507 12.37904       8.194479 
1 1 1 21  15 6  o 93.58467 3.110536 107.6743       7.083895 104.4156       7.981577 119.7659       15.37476 92.02684 3.565831 97.26562 6.524269 -5.238777      7.435135 
1 1 1 21  15 7  o 46.04243 3.993930 26.38964       4.436923 27.10897       5.568519 25.13892       7.342733 46.39618 5.004236 43.95198 7.097296 2.444202       8.684123 
1 1 1 21  15 8  o 34.59948 3.144058 14.84838       2.622000 15.80773       2.837533 9.243400       6.858664 35.67713 3.301163 26.85926 8.948054 8.817869       9.537576 
1 1 1 21  15 9  o 72.61806 3.070393 65.04252       5.421177 64.89310       6.067536 65.63387       12.07073 72.42013 3.447991 71.15154 7.054448 1.268593       7.851999 
1 1 1 21  15 10 o 42.86139 5.301320 23.47920       5.419235 31.44372       7.460387 14.58193       7.885153 49.22428 6.368473 32.35783 9.427043 16.86644       11.37658 
1 1 1 21  15 11 o 19.46293 7.017605 4.348431       4.257432 5.796208       5.713459 2.540864       6.384035 22.24844 8.114153 19.86139 8.179034 2.387047       11.52111 
1 1 1 21  15 12 o 73.05451 4.475639 67.32399       7.929554 66.78857       10.76513 67.95907       11.72434 71.63995 6.228180 71.85718 6.775467 -0.2172241     9.203108 
1 1 1 21  15 13 o 47.90672 5.113529 29.56737       5.877520 26.69979       7.654282 33.68758       9.175000 44.27054 7.352851 49.46719 7.874941 -5.196644      10.77400 
1 1 1 21  15 14 o 21.29956 8.212383 5.098802       6.027966 0.000000       0.000000 5.098802       6.027966 ?        ?        21.29956 8.212383 0.000000       8.212383 
1 1 1 21  15 15 o 23.60542 8.745590 7.378586       6.679883 0.000000       0.000000 7.378586       6.679883 ?        ?        23.60542 8.745590 0.000000       8.745590 
1 1 1 21  15 16 o 20.52616 8.161642 4.694278       6.109187 0.000000       0.000000 4.694278       6.109187 ?        ?        20.52616 8.161642 0.000000       8.161642 
1 1 1 21  15 17 o 46.41040 5.011097 28.56966       5.577652 35.96615       8.665974 23.33865       7.287814 49.98429 7.332458 39.71532 7.808594 10.26898       10.71163 
1 1 1 21  15 18 o 21.48896 7.243793 6.734023       4.493440 9.898348       6.920568 4.427763       5.908202 24.92096 8.952040 19.58313 7.942569 5.337830       11.96760 
1 1 1 21  15 19 o 18.78380 7.008763 4.752223       4.304596 3.849560       6.456815 5.474384       5.775279 19.21604 8.092795 20.19439 7.965273 -0.9783516     11.35513 
1 1 1 21  15 20 o 12.93168 6.155968 -4.326614      5.328510 0.000000       0.000000 -4.326614      5.328510 ?        ?        12.93168 6.155968 0.000000       6.155968 
1 1 1 21  15 21 o 12.32537 5.692794 -1.636179      4.002784 -8.686029      5.813938 4.716874       5.519143 11.78888 5.797000 18.76741 7.652453 -6.978530      9.600273 
1 1 1 21  15 22 o 22.28816 7.568912 8.458063       4.906236 14.90390       7.857504 4.339086       6.281157 26.85344 9.550927 18.38429 7.870749 8.469151       12.37614 
1 1 1 21  15 23 o 21.90231 7.672023 8.615466       5.055026 6.858649       7.999601 9.783314       6.522260 19.91713 8.702993 22.29923 8.556764 -2.382099      12.20493 
1 1 1 21  15 24 o 14.29132 6.435000 0.9293300      4.712976 1.504902       7.485430 0.5513027      6.066362 16.46394 7.666221 15.15121 7.001614 1.312726       10.38237 
1 1 1 21  15 25 o 15.17592 7.035667 0.9956914      6.199227 7.699029       7.409482 -14.64561      11.31823 19.29001 8.403315 14.14393 7.125809 5.146075       11.01784 
1 1 1 21  15 26 o 16.72933 7.571723 4.155385       6.623796 15.35722       8.295242 -15.55385      11.00321 23.39557 9.439149 13.57321 6.860954 9.822355       11.66920 
1 1 1 21  16 0  o 26.59634 6.309585 9.171695       4.027332 14.26152       7.259489 6.908750       4.840515 32.86141 8.863393 23.55429 7.494814 9.307123       11.60741 
1 1 1 21  16 1  o 113.3498 3.468799 157.9101       9.570275 148.7955       15.80169 163.1903       12.02701 109.1070 5.965827 114.9664 4.300479 -5.859383      7.354266 
1 1 1 21  16 2  o 88.43191 2.811345 95.89604       6.050721 98.07727       7.964291 92.91836       9.305405 89.23396 3.670361 86.63998 4.422009 2.593987       5.746800 
1 1 1 21  16 3  o 78.87774 3.174620 76.48675       6.089675 81.28741       7.012553 61.76360       12.28077 81.22984 3.551201 69.49290 7.363775 11.73694       8.175342 
1 1 1 21  16 4  o 86.64049 2.798306 92.11792       5.900410 91.04556       7.558688 93.79067       9.440432 85.92960 3.617764 86.94909 4.470449 -1.019493      5.750925 
1 1 1 21  16 5  o 54.82489 2.960589 37.00204       3.940742 41.80342       4.944312 28.63995       6.524993 58.16797 3.504327 47.50090 5.754092 10.66707       6.737201 
1 1 1 21  16 6  o 16.71309 5.846825 3.164284       2.935330 3.506322       3.262131 1.709191       6.728368 17.57391 6.162554 19.93642 8.319499 -2.362507      10.35332 
1 1 1 21  16 7  o 132.6178 3.309467 216.7061       10.69537 218.7297       12.33547 210.5778       21.46655 132.9423 3.811578 128.2084 6.896213 4.733902       7.879460 
1 1 1 21  16 8  o 26.39318 4.733689 8.946487       2.932727 8.812889       3.185488 9.689523       7.512413 26.07224 5.196219 27.42735 9.364955 -1.355108      10.70995 
1 1 1 21  16 9  o 20.19487 8.064072 3.325777       5.988976 0.000000       0.000000 3.325777       5.988976 ?        ?        20.19487 8.064072 0.000000       8.064072 
1 1 1 21  16 10 o 17.79124 7.584427 0.8010253      5.787946 0.000000       0.000000 0.8010253      5.787946 ?        ?        17.79124 7.584427 0.000000       7.584427 
1 1 1 21  16 11 o 19.86469 7.882468 3.526071       5.687246 0.000000       0.000000 3.526071       5.687246 ?        ?        19.86469 7.882468 0.000000       7.882468 
1 1 1 21  16 12 o 23.52017 8.289124 7.143733       5.907164 0.000000       0.000000 7.143733       5.907164 ?        ?        23.52017 8.289124 0.000000       8.289124 
1 1 1 21  16 13 o 28.79743 6.754119 11.42047       4.657280 11.99063       6.647761 10.87090       6.526687 28.78996 8.723551 27.54276 8.695395 1.247210       12.31707 
1 1 1 21  16 14 o 33.23264 6.070651 14.94192       4.735173 22.02052       7.074633 9.197313       6.373245 39.48944 7.627825 25.43883 8.626735 14.05061       11.51539 
1 1 1 21  16 15 o 25.05318 7.074709 8.952383       4.507906 11.34058       6.478264 6.710416       6.276793 27.47678 8.661567 22.55986 8.454104 4.916920       12.10350 
1 1 1 21  16 16 o 25.73067 6.936111 9.574520       4.447216 11.00423       6.510719 8.323998       6.089059 26.71436 8.709860 23.83963 8.414551 2.874727       12.11059 
1 1 1 21  16 17 o 23.92509 7.153915 8.489367       4.492381 8.238471       6.638693 8.701307       6.101606 23.43672 8.711910 23.87634 8.423594 -0.4396210     12.11835 
1 1 1 21  16 18 o 32.32969 7.200596 15.67913       5.527379 29.36493       7.982503 3.072949       7.661181 43.99455 7.727499 19.58685 8.538550 24.40770       11.51612 
1 1 1 21  16 19 o 17.58880 6.906734 3.796621       4.325344 6.666217       6.499109 1.515000       5.795156 21.30287 8.434880 16.85990 7.386268 4.442972       11.21179 
1 1 1 21  16 20 o 13.08210 5.964539 -1.031629      4.204331 -1.541062      6.327403 -0.6288958     5.625876 15.34988 7.113442 15.10649 6.892157 0.2433958      9.904691 
1 1 1 21  16 21 o 23.61895 8.638093 10.19600       6.481822 0.000000       0.000000 10.19600       6.481822 ?        ?        23.61895 8.638093 0.000000       8.638093 
1 1 1 21  16 22 o 23.26002 8.585152 10.41129       6.426337 21.33441       8.119061 -7.910263      10.51510 32.33025 9.605419 15.86323 7.799621 16.46702       12.37328 
1 1 1 21  16 23 o 14.44560 6.733606 -0.6660377     5.799549 -2.540222      6.981589 3.506488       10.41712 14.60886 6.979841 18.53553 8.760034 -3.926667      11.20073 
1 1 1 21  16 24 o 22.69558 7.893722 10.14170       5.345983 24.46582       8.683013 1.397177       6.784293 32.11195 10.01415 15.88856 7.364018 16.22339       12.43029 
1 1 1 21  16 25 o 13.96290 6.327302 1.010622       4.642310 -1.018758      7.088471 2.534743       6.143004 14.71149 7.030019 15.82734 7.213692 -1.115846      10.07266 
1 1 1 21  17 0  o 110.8865 3.111743 150.9446       8.400188 152.5018       16.33249 150.3845       9.795042 110.2993 6.100114 110.5283 3.641582 -0.2289734     7.104400 
1 1 1 21  17 1  o 36.98577 4.582398 17.16855       4.041856 17.92372       7.089556 16.80491       4.919700 36.81885 8.120093 36.28872 5.755126 0.5301323      9.952758 
1 1 1 21  17 2  o 60.33181 2.727789 44.69575       4.000078 44.96257       5.332708 44.35248       6.048613 60.33032 3.644231 59.79018 4.177639 0.5401382      5.543742 
1 1 1 21  17 3  o 36.85286 3.835212 16.92410       3.393940 18.71174       3.938973 11.77194       6.687091 38.67687 4.249120 29.79124 8.681982 8.885632       9.666015 
1 1 1 21  17 4  o 75.89587 2.663351 70.71687       4.918231 76.94188       6.673086 63.31427       7.276939 78.96409 3.476375 71.40439 4.200591 7.559700       5.452536 
1 1 1 21  17 5  o 90.01503 2.976043 99.68494       6.519179 113.0666       10.85854 92.14310       8.151829 95.20505 4.694798 86.24472 3.888705 8.960327       6.096159 
1 1 1 21  17 6  o 57.48903 2.892811 40.72760       4.039646 43.61378       4.666720 32.10070       8.068209 59.41366 3.235424 49.71268 6.841208 9.700981       7.567700 
1 1 1 21  17 7  o 49.82491 4.635049 31.24757       5.563234 36.62660       8.110666 26.46827       7.645157 53.26080 6.375554 44.79446 7.251345 8.466339       9.655552 
1 1 1 21  17 8  o 62.98534 4.152309 49.60817       6.337762 58.48687       9.510519 42.51561       8.500229 67.60283 5.829924 57.39908 6.173965 10.20375       8.491517 
1 1 1 21  17 9  o 38.35541 5.214553 18.91562       4.747829 25.08354       7.028760 13.73958       6.438844 43.51636 6.854649 31.49596 8.281018 12.02040       10.74995 
1 1 1 21  17 10 o 16.47587 6.596478 2.073190       4.018250 8.066169       5.561378 -4.472653      5.812245 24.59975 8.051724 14.45814 6.739957 10.14161       10.50035 
1 1 1 21  17 11 o 19.54494 6.972872 4.596041       4.191168 1.497820       5.601136 8.537786       6.317775 17.90054 7.538065 25.17670 8.588305 -7.276167      11.42722 
1 1 1 21  17 12 o 17.40101 6.628498 3.158066       3.895151 2.825859       5.413040 3.514807       5.609354 18.68851 7.594091 19.50951 7.799641 -0.8209934     10.88598 
1 1 1 21  17 13 o 38.49878 5.697896 19.70984       5.184410 22.38242       7.606837 17.39155       7.084703 39.45226 8.180868 34.45423 8.493084 4.998032       11.79233 
1 1 1 21  17 14 o 10.63706 5.105680 -4.858688      3.831253 -3.957108      5.444973 -5.742758      5.391836 13.82786 6.471476 12.89792 6.154541 0.9299364      8.930754 
1 1 1 21  17 15 o 39.47812 5.633680 21.06634       5.266261 26.39664       7.851092 16.70642       7.100571 42.42159 7.884794 32.87005 8.721579 9.551544       11.75738 
1 1 1 21  17 16 o 20.75142 7.256499 6.050681       4.521090 5.681981       6.241889 6.457588       6.557340 21.03070 8.285215 21.85858 8.527292 -0.8278866     11.88947 
1 1 1 21  17 17 o 20.97361 7.067821 6.397966       4.277781 1.647957       6.185400 10.75284       5.922547 17.59140 7.670378 25.99124 8.292538 -8.399837      11.29606 
1 1 1 21  17 18 o 18.71434 7.094952 4.685384       4.449636 6.932524       6.427456 2.617244       6.166148 21.64202 8.442530 18.03091 7.760130 3.611111       11.46717 
1 1 1 21  17 19 o 17.09559 6.881036 3.409692       4.396925 10.32454       7.211568 -0.6817991     5.547269 24.27057 9.068588 15.05926 6.860287 9.211308       11.37114 
1 1 1 21  17 20 o 15.37546 6.911233 0.4505593      5.410019 2.135901       6.228505 -4.727614      10.91762 17.15587 7.581241 17.50018 8.454816 -0.3443031     11.35602 
1 1 1 21  17 21 o 28.45031 8.999145 15.66293       6.987587 27.67659       8.557699 -8.369650      12.10374 38.42119 9.251389 16.82806 8.292273 21.59313       12.42377 
1 1 1 21  17 22 o 15.92746 6.713128 2.986950       4.448571 6.538048       7.239845 0.8329509      5.638592 19.55484 8.412240 15.25251 6.935940 4.302332       10.90289 
1 1 1 21  17 23 o 23.11887 7.590055 9.944698       4.940294 13.15557       7.894635 7.878013       6.333705 23.56006 9.306576 20.10864 8.198340 3.451422       12.40263 
1 1 1 21  17 24 f 21.87898 7.708159 9.439850       5.107827 16.53831       8.169088 4.883271       6.545020 25.26132 9.604862 17.52283 7.756099 7.738497       12.34546 
1 1 1 21  18 0  o 61.75388 3.345438 47.01449       5.015667 46.75257       9.800876 47.10743       5.838076 60.51600 6.761380 61.68564 3.903758 -1.169640      7.807406 
1 1 1 21  18 1  o 56.15712 3.499345 38.96706       4.765013 47.49713       8.821484 35.45287       5.662103 61.25261 5.986237 53.33720 4.395206 7.915409       7.426498 
1 1 1 21  18 2  o 30.62445 6.040608 12.17706       4.347790 14.57659       6.169465 9.809552       6.128151 33.08346 7.783361 27.36957 8.392166 5.713890       11.44592 
1 1 1 21  18 3  o 26.76190 4.369170 9.102753       2.751167 12.97919       3.353224 1.119379       4.812151 32.05742 4.409038 16.91425 7.045298 15.14317       8.311188 
1 1 1 21  18 4  o 36.47154 3.289267 16.51649       2.892025 16.93563       3.501012 15.61606       5.131423 36.78141 3.968730 34.61540 6.315849 2.166004       7.459274 
1 1 1 21  18 5  o 47.47947 2.795243 27.79940       3.219852 32.27115       4.119963 20.78213       5.161056 51.04551 3.330254 40.33333 5.385416 10.71218       6.331927 
1 1 1 21  18 6  o 26.77843 3.644051 9.032426       2.316325 10.07516       2.491149 2.375766       6.294201 28.29309 3.701829 19.75651 8.127045 8.536581       8.930420 
1 1 1 21  18 7  o 20.94447 6.930676 5.529496       4.116356 10.72795       5.814873 0.3076113      5.827963 28.06311 8.071633 17.51550 7.541380 10.54761       11.04643 
1 1 1 21  18 8  o 61.85429 4.240253 48.05002       6.352764 50.66612       9.361275 45.81675       8.649242 62.47487 6.231894 59.48948 6.050350 2.985397       8.685806 
1 1 1 21  18 9  o 19.27303 6.673390 4.541181       3.818824 2.234177       5.031490 7.675966       5.865113 17.92209 7.307020 24.22119 8.274629 -6.299101      11.03911 
1 1 1 21  18 10 o 14.27579 6.064167 0.4975610      3.677349 3.131699       5.050797 -2.473927      5.364480 18.69756 7.425431 14.78574 6.739788 3.911813       10.02805 
1 1 1 21  18 11 o 24.63646 7.049309 8.391665       4.446239 9.510931       6.063051 7.089438       6.539848 26.00156 8.399591 23.55282 8.666297 2.448732       12.06888 
1 1 1 21  18 12 o 19.32896 6.877999 4.663561       4.075363 1.059481       5.649216 8.574598       5.884871 17.36879 7.450716 24.70966 8.289557 -7.340866      11.14585 
1 1 1 21  18 13 o 27.89501 6.920131 11.02345       4.681347 20.79619       7.057898 3.346820       6.255364 37.88628 7.900843 19.60413 8.086974 18.28214       11.30586 
1 1 1 21  18 14 o 42.70007 5.236268 24.26492       5.334705 38.91497       8.787953 15.71592       6.713145 52.55873 7.038043 32.09197 8.464074 20.46675       11.00793 
1 1 1 21  18 15 o 21.77707 7.276858 6.828537       4.535379 7.896777       6.788571 5.967345       6.095283 23.28444 8.777825 21.26706 8.242400 2.017380       12.04107 
1 1 1 21  18 16 o 13.29898 6.271054 -3.906338      5.283448 -0.9907208     6.032360 -13.51026      10.94829 15.82091 7.186417 16.28304 7.996549 -0.4621334     10.75125 
1 1 1 21  18 17 f 27.66433 8.585980 12.65943       6.391332 23.57621       7.816833 -9.358278      11.10119 38.19997 8.604486 17.20256 8.361382 20.99741       11.99791 
1 1 1 21  18 18 o 20.03112 8.001518 5.582403       5.898521 12.46922       7.069843 -10.19166      10.69971 26.54372 9.084360 16.39548 8.021298 10.14824       12.11886 
1 1 1 21  18 19 o 18.38414 7.118104 4.739349       4.542506 4.930209       6.734883 4.580062       6.152670 19.45606 8.233162 18.94148 7.933615 0.5145760      11.43360 
1 1 1 21  18 20 o 26.68489 7.322104 11.77771       4.904553 22.82983       8.131487 5.457826       6.148959 34.58400 9.403041 19.24620 7.985866 15.33779       12.33658 
1 1 1 21  18 21 o 16.38963 6.959908 3.110560       4.841341 -0.1891283     6.967301 6.191258       6.732132 15.85320 7.386631 19.45382 8.231814 -3.600625      11.06007 
1 1 1 21  18 22 o 16.04481 7.282566 1.823906       6.180357 0.000000       0.000000 1.823906       6.180357 ?        ?        16.04481 7.282566 0.000000       7.282566 
1 1 1 21  18 23 o 26.74871 9.002963 15.83853       6.941004 11.44957       8.315693 25.92042       12.60342 21.71380 9.166549 26.68081 11.27527 -4.967005      14.53126 
1 1 1 21  18 24 o 14.44271 6.534900 1.362796       4.929707 11.34527       7.809033 -5.251187      6.356377 21.35453 8.940698 12.68081 6.199370 8.673721       10.87972 
1 1 1 21  19 0  o 52.60776 3.517695 34.25544       4.483749 40.13247       9.045897 32.34126       5.162559 55.85437 6.784966 50.94113 4.195894 4.913242       7.977549 
1 1 1 21  19 1  o 33.67178 4.540162 14.33003       3.630563 11.25907       6.573851 15.67776       4.354953 29.04165 8.646824 35.04294 5.262123 -6.001291      10.12213 
1 1 1 21  19 2  o 102.8059 4.206599 131.3412       10.51639 135.7499       14.14177 125.8870       15.72945 103.7367 5.615095 99.28751 6.537415 4.449196       8.617836 
1 1 1 21  19 3  f 50.33487 2.873188 31.25010       3.509630 34.43391       4.488754 26.24250       5.629468 52.68999 3.516041 45.47659 5.171515 7.213406       6.253568 
1 1 1 21  19 4  o 35.54008 3.306619 15.71905       2.830920 20.00285       3.452664 6.931533       4.945073 40.06255 3.574039 23.26943 7.590991 16.79312       8.390285 
1 1 1 21  19 5  o 23.46251 3.957778 7.018207       2.182454 10.07401       2.604665 -0.1830861     3.998477 28.23141 3.889257 14.35166 6.213070 13.87975       7.329977 
1 1 1 21  19 6  o 44.98194 4.890753 25.74339       5.274848 33.31168       7.539480 18.48694       7.382521 50.60761 6.245886 36.53823 8.458463 14.06938       10.51459 
1 1 1 21  19 7  o 27.61622 6.568173 10.26157       4.355433 10.85359       6.095586 9.644051       6.225493 28.03376 8.321318 26.62764 8.502677 1.406126       11.89705 
1 1 1 21  19 8  o 16.91985 6.633064 2.549965       3.983742 5.721685       5.825295 -0.2365832     5.460141 22.04935 8.167399 16.44836 7.188642 5.600996       10.88039 
1 1 1 21  19 9  o 21.12170 6.995440 5.823497       4.193383 6.716599       5.770557 4.824143       6.104172 22.93075 8.181759 21.24495 8.244391 1.685799       11.61513 
1 1 1 21  19 10 o 38.66586 5.605070 19.71637       5.127533 32.70155       7.863583 10.11143       6.763068 49.21907 6.732451 26.67560 8.885442 22.54347       11.14796 
1 1 1 21  19 11 o 29.45620 6.769803 12.07420       4.757464 23.87993       7.350808 3.564751       6.240788 41.16698 7.607564 19.94888 8.136182 21.21811       11.13878 
1 1 1 21  19 12 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 21  19 13 o 20.97563 7.959752 5.632560       5.603647 6.526102       6.541836 3.170199       10.85970 22.27644 8.564065 22.49930 9.973145 -0.2228642     13.14560 
1 1 1 21  19 14 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 21  19 15 o 19.61565 7.813210 4.668238       5.608210 7.698700       6.665464 -2.676959      10.37714 22.82095 8.676231 19.03893 8.917919 3.782015       12.44212 
1 1 1 21  19 16 o 18.78965 7.281765 4.525630       4.757057 6.523492       7.361473 3.093173       6.233370 21.72256 8.845199 18.53524 7.885182 3.187325       11.84963 
1 1 1 21  19 17 o 14.27736 6.371592 -0.8880354E-01 4.509377 9.047898       7.216687 -5.941184      5.775764 23.36549 8.991793 12.87463 6.202483 10.49086       10.92351 
1 1 1 21  19 18 o 16.22604 6.772405 2.581496       4.459846 6.343202       6.663856 -0.4703412     6.002248 20.60147 8.405514 15.54204 7.101581 5.059432       11.00387 
1 1 1 21  19 19 o 31.87234 7.113961 16.17961       5.385205 30.50755       8.637228 7.067649       6.887922 41.70187 8.777477 20.77164 8.518493 20.93022       12.23147 
1 1 1 21  19 20 o 17.95481 7.111474 4.795547       4.621079 8.129248       6.931539 2.128476       6.199885 21.08344 8.583743 16.66026 7.450508 4.423187       11.36621 
1 1 1 21  19 21 o 18.21207 7.285390 5.309585       4.897101 10.13203       7.740667 2.091394       6.323400 21.86035 9.004643 16.39522 7.411443 5.465134       11.66247 
1 1 1 21  19 22 o 15.89931 6.817304 3.096967       4.725604 -4.665531      7.043834 9.450336       6.372507 13.74374 6.675637 21.38538 8.387601 -7.641643      10.71989 
1 1 1 21  19 23 o 15.72218 7.259628 1.714395       6.502655 0.000000       0.000000 1.714395       6.502655 ?        ?        15.72218 7.259628 0.000000       7.259628 
1 1 1 21  20 0  o 67.87008 3.402238 56.96241       5.609086 64.72488       10.00740 53.40680       6.772962 71.39125 5.802258 65.43484 4.270839 5.956406       7.204600 
1 1 1 21  20 1  o 86.35609 3.305789 92.12162       6.943867 93.79715       11.73952 91.21995       8.611919 86.03854 5.630070 85.60077 4.140724 0.4377747      6.988797 
1 1 1 21  20 2  o 18.16203 6.611711 3.604954       3.791027 9.023294       5.512593 -1.256925      5.221856 26.04514 7.954473 15.57537 6.909228 10.46978       10.53618 
1 1 1 21  20 3  o 112.6083 2.827787 156.1897       7.753707 170.8224       10.43201 138.1281       11.58997 117.3490 3.652427 105.0001 4.540297 12.34888       5.827051 
1 1 1 21  20 4  f 75.99457 4.117253 72.20376       7.596286 0.000000       0.000000 72.20376       7.596286 ?        ?        75.99457 4.117253 0.000000       4.117253 
1 1 1 21  20 5  o 26.89883 7.404870 9.847616       5.006794 0.000000       0.000000 9.847616       5.006794 ?        ?        26.89883 7.404870 0.000000       7.404870 
1 1 1 21  20 6  o 40.49612 6.264459 21.64340       5.982677 23.55040       6.992338 16.43316       11.55783 41.83843 7.112543 33.30529 11.60523 8.533134       13.61138 
1 1 1 21  20 7  o 47.26268 5.823551 29.20086       6.565542 35.68374       7.942027 15.20683       11.66860 51.95134 6.409065 32.04457 11.60917 19.90678       13.26080 
1 1 1 21  20 8  o 37.72452 6.964152 19.41606       6.166389 24.14108       7.121834 5.264899       12.32498 42.00628 7.217319 25.72667 11.01997 16.27961       13.17306 
1 1 1 21  20 9  o 32.06395 7.760602 14.61486       5.997920 18.36884       7.043105 4.706822       11.44227 35.73303 8.254497 24.62920 10.58510 11.10383       13.42315 
1 1 1 21  20 10 o 27.04699 8.017690 10.59482       5.661907 14.87232       6.606723 -1.234827      10.98695 31.76876 8.405139 21.21270 9.660115 10.55606       12.80485 
1 1 1 21  20 11 o 9.419217 4.652447 -7.943142      3.888382 -5.732553      5.575879 -10.03589      5.425222 13.16533 6.275617 11.31202 5.569809 1.853313       8.390837 
1 1 1 21  20 12 o 22.23384 7.176103 7.030754       4.426018 10.66728       6.639986 4.123045       5.937440 26.38639 8.804573 19.74844 7.979328 6.637955       11.88235 
1 1 1 21  20 13 o 18.18014 6.944930 3.964772       4.283680 2.406701       6.280955 5.319740       5.857289 18.47050 7.888198 20.56487 8.048597 -2.094364      11.26959 
1 1 1 21  20 14 o 18.79095 7.178697 4.454140       4.577090 13.11169       7.292959 -1.172025      5.879122 28.08956 9.221896 15.57233 7.081751 12.51722       11.62732 
1 1 1 21  20 15 o 16.01210 6.703170 2.014120       4.388741 12.31373       6.814038 -5.287347      5.737191 27.12309 8.914452 13.22303 6.320326 13.90007       10.92767 
1 1 1 21  20 16 o 19.41698 7.337462 5.285222       4.749950 11.03424       7.433743 1.318391       6.174939 25.17069 9.243316 17.05841 7.542889 8.112286       11.93038 
1 1 1 21  20 17 o 18.51153 7.124633 4.765237       4.531110 4.322650       6.933318 5.095184       5.986380 19.27137 8.260284 19.42198 7.950554 -0.1506138     11.46489 
1 1 1 21  20 18 o 36.41848 6.531822 20.13381       5.583881 22.09674       8.570930 18.68626       7.360222 33.51474 9.846382 31.82767 9.057682 1.687069       13.37882 
1 1 1 21  20 19 o 17.80775 7.120054 4.560500       4.674947 1.745957       7.088437 6.727124       6.219254 17.08776 7.772924 20.08134 8.147379 -2.993576      11.26047 
1 1 1 21  20 20 o 20.28959 7.610264 7.247902       5.088732 24.04242       8.516830 -2.076413      6.346039 33.64443 9.796078 14.39831 6.814449 19.24612       11.93314 
1 1 1 21  20 21 o 36.58625 6.870443 22.05021       5.900580 29.39898       9.647795 17.65874       7.458062 35.40387 10.45864 28.35991 9.326481 7.043964       14.01308 
1 1 1 21  20 22 f 16.32976 7.171266 3.385323       5.492370 7.101063       7.804957 -0.2597193     7.730350 19.09624 8.460299 15.63103 7.433496 3.465216       11.26204 
1 1 1 21  21 0  o 103.5450 3.305446 132.5651       8.329880 157.5099       15.17457 121.8065       9.965592 111.3852 5.608576 98.83714 4.146797 12.54806       6.975102 
1 1 1 21  21 1  o 18.62208 6.078256 4.328207       3.170330 8.492831       5.359464 2.086526       3.932063 25.26757 7.865656 16.46480 6.547467 8.802767       10.23415 
1 1 1 21  21 2  o 90.33728 3.115848 100.9003       6.849024 106.6824       12.30068 98.30228       8.245416 91.47861 5.543921 88.84292 3.817405 2.635689       6.731095 
1 1 1 21  21 3  o 37.75621 3.115813 17.73503       2.841294 19.88754       3.437671 13.09449       5.047497 39.87095 3.576054 31.18376 6.831528 8.687191       7.710897 
1 1 1 21  21 4  o 29.62601 3.241512 10.99725       2.302069 11.29479       2.695063 10.19433       4.427245 29.88300 3.785740 27.44635 6.682730 2.436649       7.680541 
1 1 1 21  21 5  o 50.68118 3.966163 32.33246       4.859403 0.000000       0.000000 32.33246       4.859403 ?        ?        50.68118 3.966163 0.000000       3.966163 
1 1 1 21  21 6  f 24.06225 6.911456 7.913537       4.266168 16.03708       6.408121 1.446991       5.717342 33.75857 7.925926 17.95126 7.590560 15.80731       10.97437 
1 1 1 21  21 7  o 40.35525 5.131026 21.18429       4.931985 23.63589       7.492386 19.30967       6.551649 41.11640 7.762181 37.24289 7.478916 3.873516       10.77894 
1 1 1 21  21 8  o 39.66074 5.306394 20.66109       5.000002 34.38115       8.066800 12.10172       6.371538 50.29841 6.751650 28.77652 8.498899 21.52189       10.85431 
1 1 1 21  21 9  o 14.44229 6.278002 0.1000711      4.116892 0.8462177      5.837571 -0.6382505     5.806880 17.33382 7.505620 16.28658 7.251739 1.047239       10.43657 
1 1 1 21  21 10 o 21.71352 7.210585 6.543656       4.454506 9.917664       6.446155 3.459902       6.162651 25.82080 8.676007 19.51782 8.036596 6.302982       11.82624 
1 1 1 21  21 11 o 22.63026 7.273670 7.356656       4.550357 9.902261       6.802921 5.295630       6.121272 25.50210 8.902425 20.86415 8.209304 4.637943       12.10974 
1 1 1 21  21 12 o 19.61613 7.246215 5.064421       4.579791 14.15814       7.271579 -0.9145080     5.896165 29.51758 9.157676 15.85808 7.163794 13.65950       11.62682 
1 1 1 21  21 13 o 51.24347 5.509736 35.75785       6.772307 41.15162       9.482982 30.14359       9.674880 52.66798 7.608901 42.81280 9.519633 9.855183       12.18683 
1 1 1 21  21 14 o 30.05610 7.098228 13.57198       5.115406 23.73557       8.481197 7.760464       6.413255 37.59796 9.307001 22.58007 8.527435 15.01788       12.62289 
1 1 1 21  21 15 o 14.16888 6.343065 -0.2731865     4.506536 5.396663       6.761251 -4.805574      6.045118 20.35389 8.403062 13.71004 6.535012 6.643848       10.64509 
1 1 1 21  21 16 o 14.84110 6.530424 0.7331489      4.575313 16.09012       7.577199 -8.079103      5.739834 29.51479 9.375456 11.95063 5.852646 17.56416       11.05227 
1 1 1 21  21 17 o 17.61447 6.978802 4.159451       4.451535 9.690138       6.794929 0.9462095E-03  5.892017 23.16482 8.770926 15.54073 7.075989 7.624084       11.26937 
1 1 1 21  21 18 o 24.14300 7.383279 9.863195       4.747291 10.68842       7.380007 9.280699       6.200384 23.29140 9.057702 22.48562 8.407358 0.8057766      12.35822 
1 1 1 21  21 19 o 12.36114 5.825374 -2.346808      4.546964 2.462559       6.858593 -6.118154      6.073503 17.07557 7.718883 12.59913 6.137552 4.476441       9.861577 
1 1 1 21  21 20 o 21.21699 8.034596 8.605308       5.702428 12.77061       8.020077 4.346524       8.109570 23.50842 9.350091 18.23904 8.303367 5.269382       12.50480 
1 1 1 21  21 21 o 14.45045 6.609502 0.6344380      5.216563 4.565543       7.833642 -2.497763      6.992479 17.89104 8.151114 14.39729 6.907159 3.493750       10.68408 
1 1 1 21  22 0  o 19.68869 5.806509 5.059817       2.975831 4.381143       5.468832 5.345295       3.546913 20.54112 7.847002 20.34016 6.408652 0.2009602      10.13145 
1 1 1 21  22 1  o 18.47494 6.048237 4.296083       3.137996 5.467740       5.418444 3.704804       3.849199 21.58664 7.897333 18.21209 6.657268 3.374548       10.32894 
1 1 1 21  22 2  o 29.79472 5.213586 11.58561       3.647594 13.69849       6.139762 10.43309       4.534575 31.33040 8.011319 27.71557 6.772432 3.614824       10.49033 
1 1 1 21  22 3  o 23.06412 5.674577 7.102808       3.167196 8.203964       4.527975 6.047953       4.431757 24.52774 7.143070 21.57998 7.192867 2.947758       10.13710 
1 1 1 21  22 4  o 60.92516 2.749837 45.95934       4.072104 47.86890       4.635054 39.49945       8.525120 62.05785 3.074512 54.48541 6.552046 7.572445       7.237536 
1 1 1 21  22 5  o 58.36053 4.466382 43.39104       6.303747 50.27887       8.941648 36.58519       8.888281 61.79090 6.014239 51.78304 7.241300 10.00785       9.413156 
1 1 1 21  22 6  o 23.05006 7.189158 7.311227       4.474893 12.14531       6.695202 3.408132       6.016045 28.79775 8.760556 19.69658 8.005100 9.101170       11.86714 
1 1 1 21  22 7  o 33.82766 5.941860 15.44957       4.719494 23.16998       7.671010 10.74742       5.986610 40.07080 8.133946 27.14454 8.289254 12.92627       11.61348 
1 1 1 21  22 8  o 22.54795 7.146845 7.116556       4.405100 7.264671       6.737844 7.005984       5.821611 23.30966 8.754066 22.71624 8.204048 0.5934200      11.99750 
1 1 1 21  22 9  o 39.59984 5.749383 21.21540       5.386165 39.80297       8.776138 9.983535       6.822099 53.35456 6.912169 25.75669 8.919448 27.59786       11.28427 
1 1 1 21  22 10 o 37.61535 6.048475 19.51957       5.356379 31.56535       8.553273 11.74756       6.870389 46.31603 7.858793 27.33624 8.949397 18.97979       11.91018 
1 1 1 21  22 11 o 36.26312 6.229893 18.42941       5.306994 28.04077       8.577245 12.46758       6.755304 42.63612 8.553110 27.90999 8.850797 14.72614       12.30822 
1 1 1 21  22 12 o 21.75480 7.410488 6.942262       4.703460 14.70617       7.179084 1.103496       6.225718 29.81164 9.072139 17.33454 7.623013 12.47710       11.84964 
1 1 1 21  22 13 o 46.03685 5.446373 29.11846       5.991918 46.93298       9.985505 19.09458       7.490330 55.91844 7.518203 33.90491 8.939837 22.01353       11.68093 
1 1 1 21  22 14 o 31.47708 6.959811 14.95838       5.196630 22.56497       8.076843 9.585279       6.788266 36.36547 9.129005 23.97127 8.827798 12.39421       12.69916 
1 1 1 21  22 15 o 27.60159 7.106429 11.92564       4.808393 16.19633       7.547108 9.007600       6.238454 29.66118 9.348656 23.09968 8.470145 6.561502       12.61510 
1 1 1 21  22 16 o 16.31923 6.859363 2.685334       4.624294 -3.009195      7.048646 6.988348       6.127215 15.18602 7.185629 20.80711 8.205173 -5.621089      10.90679 
1 1 1 21  22 17 o 21.40492 7.830648 7.896323       5.327271 12.18549       7.504516 3.539314       7.563630 24.57452 9.236657 18.40382 8.229804 6.170692       12.37116 
1 1 1 21  22 18 o 13.77645 6.405992 -1.210569      5.198513 5.453785       7.589964 -7.099493      7.134749 19.14145 8.417279 13.40107 6.554999 5.740373       10.66858 
1 1 1 21  22 19 o 18.82006 8.034919 5.800033       6.513060 0.000000       0.000000 5.800033       6.513060 ?        ?        18.82006 8.034919 0.000000       8.034919 
1 1 1 21  22 20 o 17.26951 7.629400 4.056422       6.303807 0.000000       0.000000 4.056422       6.303807 ?        ?        17.26951 7.629400 0.000000       7.629400 
1 1 1 21  23 0  o 31.99922 4.521494 13.14624       3.427671 20.02024       6.021734 9.851481       4.168965 38.64874 6.632413 26.97848 6.432272 11.67026       9.239211 
1 1 1 21  23 1  o 26.18642 5.315191 9.062856       3.275793 13.30813       5.863456 7.136570       3.949672 30.81079 7.802494 22.96776 6.666306 7.843031       10.26248 
1 1 1 21  23 2  o 39.58985 3.930336 19.84201       3.741823 20.17220       6.292771 19.66141       4.653979 38.47702 6.967729 38.95974 5.018423 -0.4827156     8.586840 
1 1 1 21  23 3  o 17.98920 5.561413 4.227686       2.684530 7.400296       3.914464 1.410641       3.688593 23.25654 6.601228 15.14844 6.225402 8.108095       9.073689 
1 1 1 21  23 4  o 41.43463 2.602407 21.31069       2.614422 25.23455       3.243953 14.03841       4.416245 44.97858 2.976337 32.36655 5.812752 12.61203       6.530442 
1 1 1 21  23 5  o 46.40810 5.067857 28.10634       5.638273 35.38055       8.331261 21.95937       7.658587 50.77486 6.912608 38.84592 8.339676 11.92894       10.83210 
1 1 1 21  23 6  o 66.82254 4.949456 58.07190       8.002439 73.01662       11.26899 42.86891       11.36595 73.51402 6.352681 53.68634 9.006365 19.82767       11.02140 
1 1 1 21  23 7  o 11.61482 5.439024 -3.111958      3.855847 -7.301056      5.452775 1.077804       5.453207 12.29918 5.950100 16.91496 7.288962 -4.615780      9.409180 
1 1 1 21  23 8  o 25.12704 7.388567 9.246556       4.824306 16.28327       7.633235 4.566330       6.225252 31.95914 9.264895 20.31574 8.183946 11.64340       12.36185 
1 1 1 21  23 9  o 26.35289 7.345336 10.28356       4.892881 16.31364       7.820796 6.405425       6.271925 31.58436 9.437922 21.83313 8.387615 9.751234       12.62642 
1 1 1 21  23 10 o 54.25699 5.215436 39.47994       6.810924 40.42053       9.550044 38.50632       9.716310 52.23891 7.735433 50.46844 8.180114 1.770466       11.25838 
1 1 1 21  23 11 o 27.25669 7.543861 11.37259       5.180895 25.51333       8.670918 3.521188       6.461041 39.48652 9.184945 19.17514 8.086600 20.31137       12.23750 
1 1 1 21  23 12 o 19.64963 7.330664 5.360495       4.708713 15.37463       7.385384 -1.498323      6.112108 29.89826 9.221142 15.47799 7.107338 14.42027       11.64232 
1 1 1 21  23 13 o 31.77484 7.078383 15.38937       5.340453 22.69294       8.030197 9.597387       7.151094 36.43698 9.077475 23.84261 9.004536 12.59437       12.78602 
1 1 1 21  23 14 o 40.14521 6.827706 24.33267       6.440587 25.22039       8.763420 23.29000       9.497538 37.24667 9.595840 34.20671 10.43972 3.039963       14.17984 
1 1 1 21  23 15 o 32.43980 7.701012 17.27892       5.996261 16.23293       8.521344 18.30486       8.439240 28.09053 9.950651 30.10308 9.922050 -2.012554      14.05214 
1 1 1 21  23 16 o 14.69842 6.880611 -1.695414      6.161608 0.000000       0.000000 -1.695414      6.161608 ?        ?        14.69842 6.880611 0.000000       6.880611 
1 1 1 21  23 17 o 16.74883 7.555367 2.054176       6.531119 0.000000       0.000000 2.054176       6.531119 ?        ?        16.74883 7.555367 0.000000       7.555367 
1 1 1 21  23 18 o 14.23708 6.497488 0.1521816      5.004943 -5.095097      7.526342 4.312201       6.701385 14.23073 6.909474 17.92357 7.894458 -3.692832      10.49111 
1 1 1 21  23 19 o 19.41825 7.510016 6.765929       5.052238 8.377137       8.262657 5.803830       6.384896 20.20188 8.835782 18.54751 7.937936 1.654375       11.87779 
1 1 1 21  24 0  o 9.797194 4.561285 -2.191949      2.648398 -2.805459      4.592756 -1.886312      3.241638 13.26631 6.116845 11.35155 5.198916 1.914752       8.027735 
1 1 1 21  24 1  o 42.76677 3.684083 23.09527       3.802088 21.88518       6.060501 23.88063       4.882402 40.27004 6.388826 43.01470 4.736080 -2.744659      7.952833 
1 1 1 21  24 2  f 36.84208 3.870126 17.27275       3.422788 20.64102       5.880617 15.54702       4.209263 38.99081 6.411729 34.36377 5.187987 4.627045       8.247756 
1 1 1 21  24 3  o 38.05478 4.796637 18.86756       4.349565 0.000000       0.000000 18.86756       4.349565 ?        ?        38.05478 4.796637 0.000000       4.796637 
1 1 1 21  24 4  o 19.50388 6.573817 5.035064       3.700687 0.000000       0.000000 5.035064       3.700687 ?        ?        19.50388 6.573817 0.000000       6.573817 
1 1 1 21  24 5  f 16.72596 6.864337 2.193115       4.476742 6.395312       6.585123 -1.417849      6.104320 22.31001 8.588361 16.05960 7.268661 6.250408       11.25137 
1 1 1 21  24 6  o 26.39754 7.161247 10.11852       4.722610 11.41384       7.011755 9.043026       6.389140 27.13457 9.047551 24.70296 8.627169 2.431604       12.50145 
1 1 1 21  24 7  o 32.83345 6.583056 15.26720       5.083682 19.22337       7.647001 12.13407       6.805222 34.96414 8.940888 27.77575 8.891920 7.188385       12.60975 
1 1 1 21  24 8  o 39.75764 5.882940 21.76234       5.527869 46.08304       9.894142 10.72563       6.665151 56.38814 7.377098 26.10814 8.822285 30.27999       11.50019 
1 1 1 21  24 9  o 14.90181 6.572346 0.1211829      4.659399 5.135434       6.402163 -5.525730      6.794057 20.51863 8.287436 14.59452 6.948566 5.924111       10.81500 
1 1 1 21  24 10 o 15.38931 6.781618 0.4114792      4.950991 -2.738151      6.868625 3.817714       7.142946 15.77755 7.345595 19.76708 8.426114 -3.989531      11.17842 
1 1 1 21  24 11 o 27.86270 7.769872 12.27746       5.473400 12.47255       7.947706 12.10146       7.548802 26.55205 9.586260 26.35832 9.362802 0.1937294      13.39994 
1 1 1 21  24 12 o 22.81258 9.177074 8.487001       7.816129 0.000000       0.000000 8.487001       7.816129 ?        ?        22.81258 9.177074 0.000000       9.177074 
1 1 1 21  24 13 o 24.23594 8.526011 10.21359       6.247559 0.000000       0.000000 10.21359       6.247559 ?        ?        24.23594 8.526011 0.000000       8.526011 
1 1 1 21  24 14 o 19.97545 8.320926 5.929512       6.713134 0.000000       0.000000 5.929512       6.713134 ?        ?        19.97545 8.320926 0.000000       8.320926 
1 1 1 21  24 15 o 20.83584 7.288157 7.189870       4.560827 6.534962       6.765499 7.735420       6.174857 20.08669 8.359164 21.06732 8.258389 -0.9806328     11.75060 
1 1 1 21  24 16 o 15.49646 6.742428 2.031445       4.757641 5.279122       6.964349 -0.8104623     6.514770 18.94448 8.200553 15.25851 7.120565 3.685966       10.86055 
1 1 1 21  24 17 o 28.40894 7.610968 14.22164       5.374893 19.81401       8.963357 11.08164       6.716424 28.66988 10.20049 23.21764 8.735737 5.452242       13.42994 
1 1 1 21  24 18 o 15.91479 6.860702 2.925040       4.834960 -0.6972451E-02 7.535799 4.976469       6.303397 15.92331 7.502661 18.01941 7.800916 -2.096107      10.82332 
1 1 1 21  25 0  o 42.02125 3.644965 22.36140       3.695607 27.20281       6.572552 20.12309       4.468974 44.91134 6.168162 39.32890 4.759663 5.582447       7.791059 
1 1 1 21  25 1  o 32.97927 4.325769 14.08410       3.392756 27.43573       5.925085 7.570751       4.138371 45.50505 5.451543 23.23154 6.846360 22.27350       8.751683 
1 1 1 21  25 2  o 44.58567 3.482243 25.14633       3.753482 33.04446       6.249145 20.68882       4.694667 50.08181 5.195815 39.66793 4.965011 10.41388       7.186642 
1 1 1 21  25 3  o 24.39577 6.381840 8.369108       3.836760 0.000000       0.000000 8.369108       3.836760 ?        ?        24.39577 6.381840 0.000000       6.381840 
1 1 1 21  25 4  o 12.01176 5.361274 -0.7566337     3.193871 0.000000       0.000000 -0.7566337     3.193871 ?        ?        12.01176 5.361274 0.000000       5.361274 
1 1 1 21  25 5  o 17.21205 7.821921 -1.216700      7.156599 0.000000       0.000000 -1.216700      7.156599 ?        ?        17.21205 7.821921 0.000000       7.821921 
1 1 1 21  25 6  o 24.51436 9.577648 8.912053       8.282289 0.000000       0.000000 8.912053       8.282289 ?        ?        24.51436 9.577648 0.000000       9.577648 
1 1 1 21  25 7  o 14.68533 7.110320 -8.690037      7.827199 0.000000       0.000000 -8.690037      7.827199 ?        ?        14.68533 7.110320 0.000000       7.110320 
1 1 1 21  25 8  o 20.82852 8.190459 5.789703       6.090068 0.000000       0.000000 5.789703       6.090068 ?        ?        20.82852 8.190459 0.000000       8.190459 
1 1 1 21  25 9  o 24.15466 8.729635 9.410003       6.592852 0.000000       0.000000 9.410003       6.592852 ?        ?        24.15466 8.729635 0.000000       8.729635 
1 1 1 21  25 10 o 26.01472 7.531331 10.67218       5.047104 15.28305       8.106908 7.753978       6.449435 28.87668 9.729796 22.27358 8.518394 6.603104       12.93182 
1 1 1 21  25 11 o 11.27816 5.404382 -4.376450      4.252874 -3.266353      6.425272 -5.241997      5.673572 14.70195 6.927381 12.95229 6.215968 1.749660       9.307355 
1 1 1 21  25 12 o 22.23044 7.539315 8.017972       4.867793 17.66473       7.533473 1.103299       6.378086 30.93536 9.267381 16.74615 7.517637 14.18921       11.93311 
1 1 1 21  25 13 o 31.77878 7.017435 15.96956       5.288998 13.46341       7.943662 17.96527       7.088688 25.83057 9.543041 31.32564 8.880431 -5.495070      13.03579 
1 1 1 21  25 14 o 16.73905 6.974827 3.356995       4.718831 2.955507       7.105728 3.673749       6.311515 17.83151 7.975128 17.87135 7.770885 -0.3984070E-01 11.13505 
1 1 1 21  25 15 o 21.23444 7.593884 7.860742       4.973976 17.80248       8.155773 1.973108       6.276310 28.61676 9.758018 16.56429 7.444954 12.05247       12.27380 
1 1 1 21  25 16 o 26.20415 7.845516 12.51595       5.400312 16.85983       8.345848 9.387210       7.082987 26.92612 9.808858 21.59414 8.718699 5.331984       13.12362 
1 1 1 21  25 17 o 19.77539 7.597046 7.014040       5.145308 6.705085       8.075322 7.225193       6.675906 19.42884 8.606724 19.73833 8.265501 -0.3094864     11.93290 
1 1 1 21  26 0  o 52.25270 3.568576 34.59850       4.516742 44.82125       7.644908 29.11654       5.598302 58.07132 5.466551 47.08389 4.953299 10.98743       7.376879 
1 1 1 21  26 1  o 30.58175 4.300083 12.19826       3.116221 12.00618       5.073630 12.31461       3.948828 28.75966 7.244190 30.08615 5.591766 -1.326483      9.151292 
1 1 1 21  26 2  o 27.51674 4.371158 9.950015       2.833184 12.14769       4.567103 8.575226       3.612242 29.27603 6.564107 24.75950 6.041182 4.516531       8.920952 
1 1 1 21  26 3  o 16.07245 6.215305 2.755863       3.460109 0.000000       0.000000 2.755863       3.460109 ?        ?        16.07245 6.215305 0.000000       6.215305 
1 1 1 21  26 4  o 21.28745 5.654150 6.318914       2.982321 16.54425       6.681586 3.774907       3.332728 32.68791 8.356756 17.26003 6.210757 15.42788       10.41196 
1 1 1 21  26 5  o 21.15347 7.319913 6.399605       4.594304 6.079220       6.674999 6.688011       6.333126 21.50760 8.537912 21.91773 8.426296 -0.4101295     11.99577 
1 1 1 21  26 6  o 11.15704 5.282645 -3.518660      3.821322 -0.2981608     4.988875 -8.090470      5.944087 14.99225 6.695450 12.49746 6.084387 2.494795       9.047034 
1 1 1 21  26 7  o 36.47754 6.547338 19.24069       5.606185 28.00546       8.445940 12.33746       7.495558 41.98076 8.546711 26.85546 9.346567 15.12529       12.66509 
1 1 1 21  26 8  o 21.15864 7.275329 6.718943       4.535895 13.77319       6.677364 0.6748267      6.180820 28.54893 8.761343 16.72985 7.463244 11.81909       11.50918 
1 1 1 21  26 9  o 17.44073 7.000541 3.592892       4.537570 11.78523       7.254784 -1.671284      5.815481 25.77175 9.176147 14.85936 6.862686 10.91239       11.45854 
1 1 1 21  26 10 o 11.52805 5.499067 -3.949606      4.297124 -4.768569      6.507543 -3.316416      5.722054 14.09828 6.736664 13.81209 6.517020 0.2861881      9.373056 
1 1 1 21  26 11 o 53.82903 6.010428 42.22918       7.749823 52.39581       10.91231 31.88323       11.00813 56.38025 8.181109 38.83065 11.08586 17.54959       13.77777 
1 1 1 21  26 12 o 31.79983 7.376431 16.45656       5.605224 26.37675       8.913392 9.967323       7.209074 36.89621 9.763270 23.04057 8.954425 13.85564       13.24776 
1 1 1 21  26 13 o 15.42637 6.725448 1.780764       4.753909 7.711429       7.469626 -2.256840      6.163239 20.93700 8.753533 14.40153 6.785466 6.535469       11.07551 
1 1 1 21  26 14 o 12.48319 5.843699 -1.949590      4.444675 4.270373       7.252461 -5.690904      5.624755 18.38496 8.149739 12.28041 5.964990 6.104545       10.09947 
1 1 1 21  26 15 o 13.94263 6.345292 0.7523013E-01  4.730814 4.872861       7.599154 -2.960799      6.045118 18.58772 8.284793 13.71304 6.536042 4.874681       10.55261 
1 1 1 21  27 0  f 34.24952 4.023958 15.19170       3.294496 18.74772       5.797846 13.49602       4.003658 36.29273 6.805529 31.53428 5.404367 4.758450       8.690363 
1 1 1 21  27 1  o 32.17906 4.463861 13.63644       3.406278 16.60809       5.327748 11.58193       4.429958 34.15654 6.640013 28.45997 6.526782 5.696569       9.310674 
1 1 1 21  27 2  o 15.02049 5.377130 2.750049       2.494552 3.858501       3.987988 2.037572       3.197280 17.79929 6.723886 14.80932 5.899193 2.989963       8.944894 
1 1 1 21  27 3  o 26.10669 5.866575 9.600512       3.641068 0.000000       0.000000 9.600512       3.641068 ?        ?        26.10669 5.866575 0.000000       5.866575 
1 1 1 21  27 4  o 25.20701 3.573447 8.245351       2.133596 9.603519       2.654384 5.765845       3.586488 26.95735 4.175557 20.09470 6.457403 6.862646       7.689820 
1 1 1 21  27 5  o 14.36162 6.209081 0.7310035      3.982692 5.420470       5.649147 -3.903186      5.615754 20.13737 7.897484 13.67645 6.453988 6.460921       10.19923 
1 1 1 21  27 6  o 15.99098 6.613677 2.295079       4.198479 11.17982       6.523954 -3.985851      5.485301 25.81316 8.728316 13.39434 6.338159 12.41882       10.78683 
1 1 1 21  27 7  o 13.58710 6.086854 -0.3654767     4.157655 0.3740186      5.844231 -1.123259      5.916051 16.09971 7.214223 15.29498 7.011844 0.8047342      10.06037 
1 1 1 21  27 8  o 31.61869 6.941625 15.29712       5.201725 29.70255       8.213061 5.648208       6.721728 42.85715 8.162031 20.23368 8.368345 22.62347       11.68965 
1 1 1 21  27 9  o 16.80062 6.925578 3.147752       4.583346 -1.443186      6.730644 7.117462       6.258717 15.68468 7.291890 21.09391 8.300576 -5.409229      11.04858 
1 1 1 21  27 10 o 21.30605 7.540106 7.439533       4.891846 9.293941       7.630958 6.145815       6.373767 22.59941 9.075911 20.05300 8.205727 2.546406       12.23544 
1 1 1 21  27 11 o 23.15673 7.772913 9.259823       5.174122 8.487974       8.096805 9.792572       6.726806 21.69174 9.094396 22.94725 8.717988 -1.255508      12.59807 
1 1 1 21  27 12 o 16.04728 7.009360 2.174717       5.184767 19.96478       8.787259 -7.326375      6.421722 30.14958 10.12969 12.71124 6.217842 17.43834       11.88579 
1 1 1 21  27 13 o 20.86631 8.473175 8.032737       6.733341 16.62753       8.410227 -7.312187      11.23757 27.09712 9.850266 16.30064 8.024179 10.79647       12.70493 
1 1 1 21  28 0  o 21.90379 5.452608 6.695650       2.899022 5.640514       4.898144 7.264549       3.596624 20.27751 7.493243 22.46198 6.311021 -2.184473      9.796820 
1 1 1 21  28 1  o 17.32979 5.571748 4.100637       2.669919 6.193225       4.370688 2.854907       3.372252 20.72993 7.141076 15.92839 6.142207 4.801548       9.419219 
1 1 1 21  28 2  o 20.69658 5.458635 6.028529       2.792118 7.743281       4.080500 4.518790       3.828808 22.83136 6.815997 18.34019 6.649223 4.491173       9.522079 
1 1 1 21  28 3  o 26.65098 5.815785 10.11710       3.670715 0.000000       0.000000 10.11710       3.670715 ?        ?        26.65098 5.815785 0.000000       5.815785 
1 1 1 21  28 4  o 19.06164 4.228553 4.922861       1.912796 4.146488       2.364029 6.394784       3.255069 17.26446 5.195856 20.96332 6.042030 -3.698854      7.968880 
1 1 1 21  28 5  o 27.87328 8.192045 12.84805       5.931847 10.67228       7.565353 16.32045       9.557338 24.68620 9.275001 28.61490 10.48526 -3.928699      13.99879 
1 1 1 21  28 6  o 19.25236 7.102246 5.399656       4.397058 8.121526       6.301831 2.817340       6.138155 22.28085 8.444295 17.83027 7.708500 4.450577       11.43359 
1 1 1 21  28 7  o 21.08029 7.396327 7.034524       4.699512 6.506067       7.274975 7.412969       6.156420 20.81285 8.665331 21.39773 8.286204 -0.5848789     11.98954 
1 1 1 21  28 8  o 32.90305 8.212871 18.40794       6.564118 27.65825       8.133752 1.131419       11.11580 40.20192 8.564837 19.40052 9.132105 20.80140       12.52005 
1 1 1 21  28 9  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 21  28 10 o 30.08542 8.812344 16.90452       6.874114 26.07747       9.140841 4.964150       10.42894 35.77396 10.06459 20.09532 9.248159 15.67865       13.66837 
1 1 1 21  28 11 f 19.86546 8.156578 6.560362       6.324692 13.68673       8.067793 -4.802518      10.18744 25.18364 9.552170 16.47676 8.008896 8.706873       12.46541 
1 1 1 21  28 12 o 13.05948 6.080655 -1.487017      4.708288 4.375379       7.791353 -4.859276      5.909297 18.57990 8.327353 12.89962 6.229233 5.680283       10.39943 
1 1 1 21  29 0  o 21.76685 5.954301 6.844000       3.249044 8.559467       5.271998 5.793455       4.125641 23.37811 7.846075 20.00354 6.935773 3.374569       10.47215 
1 1 1 21  29 1  o 14.06212 5.533206 2.014316       2.780997 -0.9240970     4.179221 4.349463       3.725598 13.27158 6.009791 17.93550 6.550554 -4.663915      8.889732 
1 1 1 21  29 2  f 20.15667 5.796384 5.872914       2.998976 10.71228       4.304574 1.308433       4.180532 26.70250 6.642504 14.98275 6.417948 11.71975       9.236499 
1 1 1 21  29 3  o 21.73705 6.749731 7.196939       3.949335 0.000000       0.000000 7.196939       3.949335 ?        ?        21.73705 6.749731 0.000000       6.749731 
1 1 1 21  29 4  o 40.01610 3.151833 20.55640       3.048711 24.05366       4.166338 16.52529       4.473040 42.61369 4.061126 34.09659 5.575938 8.517105       6.898104 
1 1 1 21  29 5  o 16.46721 7.075986 2.242678       5.111517 2.749308       6.252843 1.222126       8.874623 17.70410 7.715919 18.53348 8.530040 -0.8293819     11.50204 
1 1 1 21  29 6  o 17.95219 7.616553 3.662380       5.789040 3.072990       7.414595 4.582663       9.265019 18.48653 8.215008 20.10866 9.041128 -1.622133      12.21591 
1 1 1 21  29 7  o 23.21713 7.559166 9.026670       4.904917 16.76136       7.165376 2.206558       6.728424 29.93961 9.053610 17.43684 7.782189 12.50277       11.93861 
1 1 1 21  29 8  o 39.84733 6.127865 23.72030       5.760066 32.26018       9.327374 18.45589       7.323332 41.64272 9.413404 31.24195 9.080120 10.40077       13.07902 
1 1 1 21  29 9  f 13.03365 6.035601 -1.372234      4.542630 4.961771       7.007315 -5.963704      5.966070 18.96683 8.217983 12.67428 6.153293 6.292550       10.26637 
1 1 1 21  29 10 o 24.92933 7.886375 11.12971       5.366212 26.92773       9.114642 2.748724       6.638741 36.02958 10.01895 17.29120 7.722785 18.73838       12.64993 
1 1 1 21  30 0  o 28.76559 4.902049 11.41593       3.313175 15.25294       5.672079 9.428739       4.081937 30.99244 7.575139 24.91938 6.613092 6.073067       10.05563 
1 1 1 21  30 1  o 49.53036 3.545055 31.82327       4.250591 35.00187       6.868522 29.85037       5.411262 49.57785 5.794261 46.79889 4.813455 2.778965       7.532782 
1 1 1 21  30 2  o 13.36803 5.711884 0.9489192      3.296182 3.351030       3.752681 -7.161742      6.895620 16.46595 6.442930 13.62381 6.614523 2.842141       9.233810 
1 1 1 21  30 3  f 12.79486 5.541712 0.5674649      3.184060 0.000000       0.000000 0.5674649      3.184060 ?        ?        12.79486 5.541712 0.000000       5.541712 
1 1 1 21  30 4  o 27.28490 3.547508 9.798191       2.302957 9.999001       2.766324 9.344788       4.156740 27.09628 4.335554 24.40850 6.757845 2.687784       8.029041 
1 1 1 21  30 5  o 22.67575 7.790020 8.728629       5.200027 11.41663       7.912180 6.684772       6.899327 24.15760 9.383056 20.53003 8.483331 3.627573       12.64945 
1 1 1 21  30 6  o 14.00544 6.267903 0.2514542      4.396599 6.301925       6.400243 -5.154913      6.049990 19.99524 8.206990 13.15845 6.341429 6.836794       10.37152 
1 1 1 21  30 7  o 20.28450 7.857983 6.845385       5.538066 10.52477       7.414697 2.202898       8.328773 23.19613 9.062275 18.09417 8.304219 5.101963       12.29166 
1 1 1 21  31 0  o 29.87739 4.683422 12.27521       3.297927 16.20366       5.764728 10.36398       4.020916 31.69305 7.568647 26.16329 6.367671 5.529755       9.890988 
1 1 1 21  31 1  f 11.66447 5.012886 0.4714265      2.566004 -0.6896061     4.158772 1.185147       3.260672 13.15910 5.973232 13.49407 5.720287 -0.3349638     8.270501 
1 1 1 21  31 2  o 15.46179 6.141551 2.805991       3.455816 5.743198       4.002316 -5.800289      6.850966 19.36275 6.823072 13.89858 6.710546 5.464166       9.570045 
1 1 1 21  31 3  o 18.01823 5.282983 4.711768       2.469485 2.142675       3.492546 7.280370       3.492212 14.70440 6.051870 21.76240 6.253901 -7.058008      8.702667 
1 1 1 21  31 4  f 21.79432 4.620149 6.666859       2.377510 5.309441       2.510051 18.51139       7.414547 19.08502 5.238695 31.26398 9.150718 -12.17896      10.54417 
1 1 1 22  0  0  f 44.00479 4.199923 24.30001       4.403652 24.30001       4.403652 24.30001       4.403652 44.00479 4.199923 44.00479 4.199923 0.000000       0.000000 
1 1 1 22  0  1  o 26.62678 6.825073 10.21998       3.827641 10.21998       3.827641 10.21998       3.827641 26.62678 6.825073 26.62678 6.825073 0.000000       0.000000 
1 1 1 22  0  2  o 35.98182 5.143185 16.78314       4.243242 16.78314       4.243242 16.78314       4.243242 35.98182 5.143185 35.98182 5.143185 0.000000       0.000000 
1 1 1 22  0  3  o 107.4772 3.992719 141.7765       10.42454 141.7765       10.42454 141.7765       10.42454 107.4772 3.992719 107.4772 3.992719 0.000000       0.000000 
1 1 1 22  0  4  o 144.8780 4.353330 257.4820       15.33809 257.4820       15.33809 257.4820       15.33809 144.8780 4.353330 144.8780 4.353330 0.000000       0.000000 
1 1 1 22  0  5  o 10.42557 6.672471 0.2399025      3.807097 0.2399025      3.807097 0.2399025      3.807097 10.42557 6.672471 10.42557 6.672471 0.000000       0.000000 
1 1 1 22  0  6  o 15.73133 8.100016 4.486175       3.968073 4.486175       3.968073 4.486175       3.968073 15.73133 8.100016 15.73133 8.100016 0.000000       0.000000 
1 1 1 22  0  7  o 81.08747 4.100713 81.10381       8.055537 81.10381       8.055537 81.10381       8.055537 81.08747 4.100713 81.08747 4.100713 0.000000       0.000000 
1 1 1 22  0  8  o 67.98728 4.246923 57.29157       6.972538 57.29157       6.972538 57.29157       6.972538 67.98728 4.246923 67.98728 4.246923 0.000000       0.000000 
1 1 1 22  0  9  o 21.15253 10.30320 8.301151       6.245529 8.301151       6.245529 8.301151       6.245529 21.15253 10.30320 21.15253 10.30320 0.000000       0.000000 
1 1 1 22  0  10 o 93.27834 5.778522 108.6092       13.01832 108.6092       13.01832 108.6092       13.01832 93.27834 5.778522 93.27834 5.778522 0.000000       0.000000 
1 1 1 22  0  11 o 54.31764 6.990405 38.41088       8.832591 38.41088       8.832591 38.41088       8.832591 54.31764 6.990405 54.31764 6.990405 0.000000       0.000000 
1 1 1 22  0  12 o 9.880586 6.991586 -8.300441      6.914965 -8.300441      6.914965 -8.300441      6.914965 9.880586 6.991586 9.880586 6.991586 0.000000       0.000000 
1 1 1 22  0  13 o 79.21247 6.423776 79.75000       12.20632 79.75000       12.20632 79.75000       12.20632 79.21247 6.423776 79.21247 6.423776 0.000000       0.000000 
1 1 1 22  0  14 o 18.68377 10.79986 6.102119       7.964073 6.102119       7.964073 6.102119       7.964073 18.68377 10.79986 18.68377 10.79986 0.000000       0.000000 
1 1 1 22  0  15 f 62.11882 7.546848 50.99858       10.97544 50.99858       10.97544 50.99858       10.97544 62.11882 7.546848 62.11882 7.546848 0.000000       0.000000 
1 1 1 22  0  16 o 35.78502 12.02954 21.73913       9.366786 21.73913       9.366786 21.73913       9.366786 35.78502 12.02954 35.78502 12.02954 0.000000       0.000000 
1 1 1 22  0  17 o 42.22103 11.50367 28.31596       10.23021 28.31596       10.23021 28.31596       10.23021 42.22103 11.50367 42.22103 11.50367 0.000000       0.000000 
1 1 1 22  0  18 o 13.02234 7.997345 2.234132       4.897570 2.234132       4.897570 2.234132       4.897570 13.02234 7.997345 13.02234 7.997345 0.000000       0.000000 
1 1 1 22  0  19 o 15.53432 8.862473 4.602887       5.260706 4.602887       5.260706 4.602887       5.260706 15.53432 8.862473 15.53432 8.862473 0.000000       0.000000 
1 1 1 22  0  20 o 66.46361 3.805913 55.68195       6.117609 55.68195       6.117609 55.68195       6.117609 66.46361 3.805913 66.46361 3.805913 0.000000       0.000000 
1 1 1 22  0  21 o 29.44677 6.603516 12.72877       4.136867 12.72877       4.136867 12.72877       4.136867 29.44677 6.603516 29.44677 6.603516 0.000000       0.000000 
1 1 1 22  0  22 o 17.86045 7.796787 6.143166       3.526289 6.143166       3.526289 6.143166       3.526289 17.86045 7.796787 17.86045 7.796787 0.000000       0.000000 
1 1 1 22  0  23 o 5.621749 4.082011 -6.074649      3.101392 -6.074649      3.101392 -6.074649      3.101392 5.621749 4.082011 5.621749 4.082011 0.000000       0.000000 
1 1 1 22  0  24 o 5.819326 4.196253 -4.959564      3.001880 -4.959564      3.001880 -4.959564      3.001880 5.819326 4.196253 5.819326 4.196253 0.000000       0.000000 
1 1 1 22  0  25 o 9.335532 6.112909 0.3107219      3.451817 0.3107219      3.451817 0.3107219      3.451817 9.335532 6.112909 9.335532 6.112909 0.000000       0.000000 
1 1 1 22  0  26 o 14.89138 7.846270 5.041180       3.785291 5.041180       3.785291 5.041180       3.785291 14.89138 7.846270 14.89138 7.846270 0.000000       0.000000 
1 1 1 22  0  27 f 10.81261 6.751254 1.977447       3.634394 1.977447       3.634394 1.977447       3.634394 10.81261 6.751254 10.81261 6.751254 0.000000       0.000000 
1 1 1 22  0  28 o 8.339214 5.734394 -1.377324      3.809698 -1.377324      3.809698 -1.377324      3.809698 8.339214 5.734394 8.339214 5.734394 0.000000       0.000000 
1 1 1 22  1  0  o 23.31762 4.524466 6.895469       2.478155 6.276150       3.394935 7.601851       3.625717 22.20698 6.091283 24.35362 6.118048 -2.146645      8.633321 
1 1 1 22  1  1  o 47.44347 2.872419 27.60643       3.305377 23.30632       4.558400 32.37438       4.799968 43.37242 4.372454 51.26571 3.870754 -7.893288      5.839614 
1 1 1 22  1  2  o 58.25895 2.673076 41.55346       3.784872 42.09485       5.285664 40.98373       5.422181 58.50755 3.726617 57.70491 3.878418 0.8026352      5.378644 
1 1 1 22  1  3  o 37.87295 3.474590 17.70716       3.171075 17.27410       4.496767 18.13555       4.472488 37.12178 5.106030 38.08588 4.934815 -0.9640961     7.100982 
1 1 1 22  1  4  o 31.02540 4.175549 12.02445       3.076872 11.80031       4.256438 12.26977       4.452917 30.38130 5.962157 30.96370 6.118448 -0.5824032     8.542993 
1 1 1 22  1  5  o 55.58618 3.364504 37.98411       4.536132 32.03350       7.018480 42.25299       5.944560 50.56112 5.801222 58.49955 4.197860 -7.938427      7.160741 
1 1 1 22  1  6  o 78.54472 3.210205 75.69105       6.131541 78.87826       9.836235 73.66545       7.841517 79.77541 5.086177 77.29945 4.178351 2.475952       6.582387 
1 1 1 22  1  7  o 52.08184 3.619227 33.45255       4.564866 30.34876       6.983163 35.76851       6.032140 49.07866 5.960867 53.65760 4.659364 -4.578938      7.565818 
1 1 1 22  1  8  o 24.99193 5.496182 8.047980       3.256078 11.24116       4.470854 4.441286       4.751530 29.45061 6.411851 20.41992 7.406661 9.030689       9.796452 
1 1 1 22  1  9  o 75.09881 2.980538 69.25780       5.443777 65.97297       7.442678 73.03690       7.983019 73.01170 4.200858 76.81024 4.281878 -3.798546      5.998474 
1 1 1 22  1  10 o 31.91244 5.493081 13.03968       4.117736 12.91718       6.380935 13.12709       5.390317 31.16456 8.267239 31.59774 7.165887 -0.4331760     10.94062 
1 1 1 22  1  11 o 47.76014 4.380960 28.49443       5.042087 29.39760       8.790113 28.05154       6.155422 47.27988 7.908340 47.06555 5.468538 0.2143288      9.614923 
1 1 1 22  1  12 o 35.96270 5.281509 16.52083       4.490756 21.16675       5.515810 7.386465       7.734153 40.64331 5.727729 25.48542 9.416206 15.15789       11.02143 
1 1 1 22  1  13 o 19.32880 6.528581 4.542436       3.649930 3.202795       4.883928 6.237155       5.493182 18.91132 7.364444 22.74264 7.995195 -3.831322      10.87006 
1 1 1 22  1  14 o 95.41099 3.194910 112.5776       7.417884 123.8129       10.52219 101.4767       10.45904 99.44403 4.352559 89.74905 4.799634 9.694984       6.479294 
1 1 1 22  1  15 o 39.90716 4.514056 20.25377       4.312911 19.18260       5.826702 21.55188       6.414305 37.99036 6.529058 40.18795 6.791376 -2.197598      9.420795 
1 1 1 22  1  16 f 43.38646 4.252140 23.89330       4.438035 18.84446       6.115403 29.51090       6.450670 37.23166 6.997078 47.56025 5.677775 -10.32859      9.010896 
1 1 1 22  1  17 o 19.38770 6.618488 4.809901       3.752161 0.4020527      5.165814 9.732339       5.459031 16.31799 7.063171 26.20050 7.897977 -9.882513      10.59559 
1 1 1 22  1  18 o 15.96486 6.292606 2.369315       3.602142 -1.783017      5.025706 6.755976       5.165568 14.46525 6.566219 22.29806 7.759146 -7.832817      10.16462 
1 1 1 22  1  19 o 38.50817 3.912719 19.05106       3.620776 18.94209       4.440434 19.26727       6.254759 37.84204 4.932481 36.58862 7.271267 1.253426       8.786393 
1 1 1 22  1  20 o 15.20886 5.961285 2.357055       3.217212 2.028486       4.153890 2.849618       5.085966 15.93284 6.582981 17.65450 7.288275 -1.721665      9.821130 
1 1 1 22  1  21 o 43.24453 4.210780 24.58207       4.381282 35.88279       6.068199 12.27596       6.332379 51.69575 4.874457 27.30884 8.557231 24.38691       9.848174 
1 1 1 22  1  22 o 14.21817 5.538740 2.186651       2.763309 -1.999028      4.343583 5.032508       3.581555 12.74943 5.903249 18.72386 6.463731 -5.974430      8.753752 
1 1 1 22  1  23 o 22.29160 5.409640 7.190769       2.908469 5.915261       4.703250 7.980569       3.700968 19.71094 7.331698 22.84684 6.395744 -3.135900      9.729303 
1 1 1 22  1  24 o 8.380267 3.997089 -2.424453      2.269042 -3.130558      3.205964 -1.715747      3.211865 9.920568 4.737116 10.82119 5.032994 -0.9006262     6.911679 
1 1 1 22  1  25 o 12.77886 5.120302 1.741728       2.423005 -2.510632      3.357899 6.361070       3.499796 10.44462 4.947289 19.82969 6.379510 -9.385067      8.073030 
1 1 1 22  1  26 o 12.06392 5.111815 1.121355       2.601991 0.6304086      3.474989 1.747888       3.925624 12.69881 5.634575 14.12234 6.134756 -1.423532      8.329685 
1 1 1 22  1  27 o 14.59458 5.575623 3.096112       2.761139 1.252252       3.787389 5.187853       4.033944 13.36651 5.909010 17.36084 6.711627 -3.994330      8.942166 
1 1 1 22  1  28 o 9.075061 4.291795 -1.769655      2.508211 -1.994930      3.673986 -1.573010      3.432597 10.85382 5.150973 10.76015 5.067974 0.9366989E-01  7.226125 
1 1 1 22  2  0  o 56.69922 2.655064 39.35089       3.658309 42.95283       5.113892 35.57559       5.235513 59.13855 3.565054 53.73701 4.027360 5.401535       5.378592 
1 1 1 22  2  1  o 80.09140 2.452357 78.40140       4.780725 75.28480       6.579778 81.88660       6.957997 78.36137 3.454153 81.72441 3.501904 -3.363037      4.918791 
1 1 1 22  2  2  o 102.6488 2.718827 128.8369       6.794995 126.2210       10.64266 130.6370       8.828696 101.3295 4.319923 103.2430 3.514255 -1.913567      5.568817 
1 1 1 22  2  3  o 60.89129 3.233303 45.49549       4.780553 43.05986       7.306136 47.31897       6.321664 58.91453 5.140388 61.95456 4.212233 -3.040035      6.645787 
1 1 1 22  2  4  o 37.46373 4.047909 17.41988       3.636926 15.58927       5.286599 19.06475       5.011222 34.92553 6.449027 38.94640 5.427297 -4.020874      8.428849 
1 1 1 22  2  5  o 54.49600 3.052744 36.45831       4.037863 39.36507       5.484014 33.01657       5.967356 56.48523 4.010151 51.55684 4.804951 4.928394       6.258503 
1 1 1 22  2  6  o 81.45609 2.816115 81.27399       5.581569 85.62580       7.676122 76.39172       8.130525 83.43586 3.785172 78.69952 4.255285 4.736336       5.695171 
1 1 1 22  2  7  o 40.27489 3.616047 20.06861       3.511251 23.23054       4.599359 15.65138       5.436213 43.20273 4.431418 34.86024 6.641700 8.342484       7.984337 
1 1 1 22  2  8  o 71.59037 2.941373 62.89852       5.120529 64.10674       6.885102 61.40313       7.659719 72.07353 3.935040 70.39785 4.488334 1.675682       5.969060 
1 1 1 22  2  9  o 101.3040 3.343656 126.1803       8.243069 125.8689       13.02973 126.3881       10.64378 100.4813 5.340436 101.0799 4.331145 -0.5986557     6.875978 
1 1 1 22  2  10 o 48.12580 4.417277 28.89080       5.122731 25.30395       8.381441 31.02976       6.472370 43.81305 8.150047 49.60183 5.443990 -5.788773      9.801036 
1 1 1 22  2  11 o 39.46568 4.105853 19.46500       3.891086 13.51220       4.998545 28.61987       6.198817 32.13468 6.604056 47.54475 5.448514 -15.41007      8.561534 
1 1 1 22  2  12 o 16.54941 6.172927 2.737472       3.338553 4.035312       4.431837 1.034678       5.076382 19.41816 7.135970 17.18724 7.203118 2.230921       10.13938 
1 1 1 22  2  13 o 42.36715 4.712962 22.70183       4.783596 24.72007       5.620547 17.39816       9.111290 44.00809 5.350780 35.13385 10.10321 8.874241       11.43266 
1 1 1 22  2  14 o 33.64170 5.160388 14.58391       4.095735 15.89200       5.352299 12.73560       6.362227 34.60927 6.586731 30.37821 8.341108 4.231058       10.62822 
1 1 1 22  2  15 o 20.63755 6.469554 5.552264       3.619113 2.129006       4.623536 10.96804       5.815470 17.32747 7.026753 28.13874 8.065366 -10.81127      10.69698 
1 1 1 22  2  16 o 66.02816 3.480668 54.44748       5.580732 55.24063       7.493314 53.45959       8.362768 65.85700 4.700023 64.35264 5.381948 1.504364       7.145319 
1 1 1 22  2  17 o 38.74543 4.638325 19.37485       4.292510 20.66396       5.780838 17.79054       6.408641 39.18125 6.265459 35.51156 7.632895 3.669689       9.875072 
1 1 1 22  2  18 o 65.92874 3.539789 54.78205       5.666215 52.18410       7.662639 57.91657       8.416832 63.30354 5.008003 66.51138 5.235154 -3.207840      7.244786 
1 1 1 22  2  19 o 41.02055 3.696228 21.48960       3.655256 25.52916       4.460878 13.23511       6.376729 44.46999 4.164855 29.37404 8.453813 15.09595       9.424064 
1 1 1 22  2  20 o 20.73937 6.060508 6.094552       3.254589 9.493777       3.977261 -0.7948580     5.662198 25.67900 6.383275 15.57295 7.028977 10.10604       9.494879 
1 1 1 22  2  21 o 41.11814 3.783337 21.93865       3.748451 25.94083       4.606535 14.09490       6.448938 44.34068 4.317830 29.29519 8.522702 15.04549       9.554062 
1 1 1 22  2  22 o 14.11235 5.720170 1.830001       3.062256 2.563502       3.545735 -0.3229619     6.074695 15.50802 6.200720 15.88180 7.213097 -0.3737803     9.511977 
1 1 1 22  2  23 o 13.32775 5.269915 1.835499       2.533698 -0.9404409     3.405654 5.276514       3.791742 11.84264 5.387308 18.82692 6.640560 -6.984278      8.551030 
1 1 1 22  2  24 o 15.17358 5.436087 3.156853       2.550072 2.492100       3.521027 3.890183       3.698186 14.98975 6.112181 16.72626 6.436820 -1.736516      8.876451 
1 1 1 22  2  25 o 13.35494 5.336957 2.008105       2.625258 0.6224047E-01  4.167923 3.287816       3.380021 13.29499 6.012858 15.56642 6.107631 -2.271432      8.570743 
1 1 1 22  2  26 o 13.41992 5.715386 1.652142       3.281183 3.267576       8.186051 1.342925       3.581475 17.32663 8.050633 13.43069 5.846701 3.895935       9.949704 
1 1 1 22  2  27 o 15.47041 6.050648 3.640833       3.308384 4.528623       8.462749 3.480675       3.594436 17.42880 8.127461 15.36684 6.208619 2.061957       10.22754 
1 1 1 22  2  28 f 11.25635 4.950340 0.5722840      2.625789 -4.179490      3.721119 5.284969       3.705782 9.837648 4.794939 17.26106 6.490102 -7.423412      8.069255 
1 1 1 22  3  0  o 117.4053 3.134932 168.6466       8.961136 157.7395       11.92492 182.7959       13.58210 113.3291 4.325896 121.9540 4.578327 -8.624855      6.298766 
1 1 1 22  3  1  o 93.65526 3.106030 107.3687       7.079013 101.1431       9.301151 115.9398       10.91352 90.71772 4.218903 97.05840 4.627520 -6.340683      6.262035 
1 1 1 22  3  2  o 187.3035 3.578529 429.5910       16.33377 430.8951       18.80005 425.5756       32.98845 187.4377 4.115910 184.8278 7.338761 2.609924       8.414163 
1 1 1 22  3  3  o 120.6395 2.881399 177.9436       8.470891 170.6124       11.44645 186.8199       12.59505 117.8761 3.990575 123.3042 4.197783 -5.428047      5.791897 
1 1 1 22  3  4  o 159.1291 3.182415 309.9329       12.34078 300.2378       16.83643 321.1893       18.14155 156.2307 4.426757 161.5285 4.613539 -5.297882      6.393819 
1 1 1 22  3  5  o 17.30924 5.569821 3.614367       2.667688 4.057359       3.414590 2.920406       4.273745 18.68588 6.314591 18.18700 6.939478 0.4988785      9.382452 
1 1 1 22  3  6  o 60.12900 2.945055 44.35977       4.302197 44.37313       5.681730 44.34181       6.586493 59.98085 3.908442 59.83132 4.551565 0.1495323      5.999388 
1 1 1 22  3  7  o 36.69642 3.729872 16.70772       3.289147 15.33004       4.220880 18.83775       5.248314 34.85019 5.122819 38.54792 5.763741 -3.697723      7.711289 
1 1 1 22  3  8  o 59.27985 4.143228 43.50303       5.947565 45.75474       7.518847 39.73871       9.721593 60.54927 5.144386 55.70642 7.339774 4.842842       8.963090 
1 1 1 22  3  9  o 107.4877 3.541635 142.2150       9.264143 133.5351       15.59562 146.9479       11.51614 103.0583 6.239109 108.9866 4.344793 -5.928276      7.602874 
1 1 1 22  3  10 o 110.1708 2.969331 149.0625       7.964616 146.3863       10.65592 152.4501       11.98887 108.8187 4.025319 110.8784 4.446074 -2.059700      5.997563 
1 1 1 22  3  11 o 62.12151 3.217238 47.59507       4.853769 42.64469       6.230023 55.24065       7.742393 58.48021 4.404002 66.46011 4.813165 -7.979893      6.523940 
1 1 1 22  3  12 o 37.83116 4.307046 17.99545       3.900057 21.58633       5.108696 12.97917       6.038101 41.20630 5.203372 31.03658 7.949223 10.16972       9.500801 
1 1 1 22  3  13 o 43.14220 3.966692 23.29392       4.123648 23.70175       5.190906 22.59630       6.789053 43.18402 5.026536 41.38871 6.979165 1.795307       8.600862 
1 1 1 22  3  14 o 39.18996 4.845653 19.58928       4.529200 19.58516       5.067035 19.60569       10.10183 38.94615 5.491136 36.65481 10.66764 2.291340       11.99796 
1 1 1 22  3  15 f 14.77062 6.141230 0.9896283      3.646819 -1.513203      4.339305 7.008476       6.729164 13.80420 6.198555 23.93943 8.793831 -10.13523      10.75888 
1 1 1 22  3  16 o 24.73087 6.180108 8.279271       3.713783 10.19722       4.832382 5.512174       5.804366 27.14181 7.191868 21.68377 8.128913 5.458038       10.85367 
1 1 1 22  3  17 o 20.93132 6.771360 5.864701       3.939405 6.108033       5.123576 5.512837       6.161139 21.71088 7.713376 21.68746 8.317905 0.2341461E-01  11.34388 
1 1 1 22  3  18 o 43.17638 3.840189 23.73978       3.998386 25.97142       4.523281 15.76356       8.551454 45.00304 4.172037 31.51307 9.953770 13.48997       10.79275 
1 1 1 22  3  19 o 42.13869 3.933807 22.82047       3.992847 25.39087       4.582645 14.71822       8.136127 44.24512 4.304605 30.00468 9.733240 14.24044       10.64263 
1 1 1 22  3  20 o 7.038738 3.537732 -7.703579      2.703023 -8.508384      3.017438 -4.434272      6.081647 7.443666 3.740790 14.16952 6.695637 -6.725858      7.669750 
1 1 1 22  3  21 o 15.34395 5.854817 2.723772       3.042205 3.546529       3.439394 -0.2340338     6.521250 16.77266 6.263617 16.59005 7.510367 0.1826115      9.779494 
1 1 1 22  3  22 o 34.19512 4.390295 15.68713       3.574118 15.70334       4.312971 15.65161       6.385692 33.39714 5.490055 30.63428 8.334220 2.762859       9.979976 
1 1 1 22  3  23 o 15.82220 6.165002 3.088231       3.424151 3.999450       4.534700 1.879469       5.222850 17.54962 7.013923 16.20965 7.058405 1.339975       9.950688 
1 1 1 22  3  24 o 8.895110 4.243482 -2.639484      2.560017 -3.840712      4.226902 -1.943606      3.217184 11.25391 5.391453 10.66022 4.984266 0.5936852      7.342389 
1 1 1 22  3  25 o 13.19588 5.266540 1.956882       2.553099 0.1685286      3.643630 3.681877       3.578505 12.70946 5.695588 16.11217 6.295384 -3.402706      8.489498 
1 1 1 22  3  26 o 10.71087 4.776374 -0.3520051E-01 2.529098 0.7894337      3.572984 -0.8632601     3.580397 12.92768 5.725976 11.68161 5.391396 1.246076       7.864728 
1 1 1 22  3  27 o 10.51883 4.733671 -0.1575466     2.546237 -2.007183      3.537426 1.831120       3.667965 10.75635 5.089867 13.73221 5.947814 -2.975867      7.828361 
1 1 1 22  4  0  o 46.17421 3.254311 26.20422       3.638346 29.28684       5.434213 23.69970       4.898225 48.62377 4.642483 43.68956 4.673212 4.934208       6.587227 
1 1 1 22  4  1  o 65.05676 2.709573 51.80061       4.286251 54.52692       5.616664 47.99889       6.632562 66.65649 3.469745 62.38746 4.390664 4.269035       5.596165 
1 1 1 22  4  2  o 124.8747 2.937684 190.6552       8.939551 196.2929       12.23158 184.1907       13.09769 126.4665 3.973838 122.4019 4.398220 4.064590       5.927540 
1 1 1 22  4  3  o 147.3249 3.227667 265.6339       11.58780 259.3046       14.96609 275.1079       18.31036 145.2682 4.232189 149.3736 5.037426 -4.105423      6.579293 
1 1 1 22  4  4  o 73.96422 3.196132 67.09318       5.747200 67.83503       6.661094 64.93233       11.36836 74.29277 3.690837 72.01596 6.549455 2.276810       7.517821 
1 1 1 22  4  5  o 123.3232 3.346146 186.4780       10.04672 187.4410       11.88797 184.0711       18.79358 123.4879 3.955557 121.5312 6.368010 1.956749       7.496531 
1 1 1 22  4  6  f 80.61151 3.177022 79.73412       6.228767 80.20442       7.270797 78.43701       12.07492 80.74819 3.704861 79.14402 6.313094 1.604172       7.319915 
1 1 1 22  4  7  o 18.12581 6.308839 3.702889       3.415094 1.191630       3.942607 11.24898       6.834375 15.76925 6.453375 29.46186 8.827133 -13.69261      10.93455 
1 1 1 22  4  8  o 21.08998 7.241154 5.197013       4.492897 5.291526       6.145366 5.088487       6.585248 22.61985 8.386917 22.82513 8.636300 -0.2052784     12.03852 
1 1 1 22  4  9  o 85.94971 3.295192 90.87472       6.888998 95.49529       8.123242 79.03992       13.00056 87.97479 3.798039 78.90822 6.828012 9.066574       7.813248 
1 1 1 22  4  10 o 122.5701 3.433737 185.0034       10.24613 181.0968       11.98258 195.6285       19.76155 121.0104 4.069208 124.3423 6.544826 -3.331856      7.706697 
1 1 1 22  4  11 o 13.85321 5.729885 0.7767755      3.151633 0.5354670      3.529562 1.726022       7.000421 14.28536 5.997849 20.25538 8.471752 -5.970024      10.38002 
1 1 1 22  4  12 o 81.34450 3.339869 81.73675       6.606464 82.84715       7.767657 78.83318       12.56077 81.68984 3.913369 78.33225 6.642791 3.357590       7.709807 
1 1 1 22  4  13 o 61.90065 3.645347 47.61427       5.474485 46.33949       6.339198 51.35421       10.85798 60.83108 4.304137 62.57019 7.255411 -1.739109      8.436028 
1 1 1 22  4  14 o 43.40902 4.273415 23.77041       4.461998 21.09832       5.144816 31.88047       8.963072 40.48323 5.345556 48.59639 7.835005 -8.113159      9.484844 
1 1 1 22  4  15 o 31.93431 6.278344 13.61747       4.711596 13.61747       4.711596 0.000000       0.000000 31.93431 6.278344 ?        ?        0.000000       6.278344 
1 1 1 22  4  16 o 38.26334 4.688986 18.83597       4.280904 19.23838       5.174518 17.96319       7.620615 38.19599 5.736314 35.16349 8.889831 3.032494       10.57990 
1 1 1 22  4  17 o 25.97709 5.082442 8.955709       3.102083 8.651894       3.615239 9.803855       6.040424 25.18952 5.979532 26.14219 8.378237 -0.9526672     10.29319 
1 1 1 22  4  18 o 46.57719 3.425091 27.38470       3.860412 31.60877       4.655210 18.08380       6.907744 49.82752 3.864017 34.96132 8.243138 14.86620       9.103843 
1 1 1 22  4  19 f 13.27101 5.632126 0.6570108      3.167019 -1.933181      4.026930 4.856650       5.127600 12.60204 5.780155 19.80513 7.590183 -7.203096      9.540497 
1 1 1 22  4  20 o 19.03508 6.362370 5.041178       3.467043 3.534032       4.323971 7.754714       5.801936 17.58790 6.905860 22.74525 8.193367 -5.157343      10.71551 
1 1 1 22  4  21 o 24.16763 6.229519 8.543818       3.692017 9.891590       4.757232 6.502604       5.854506 25.31410 7.306861 21.12989 8.107206 4.184210       10.91407 
1 1 1 22  4  22 f 19.32916 5.940075 5.445749       3.068044 5.000674       3.626420 6.566512       5.754647 18.62372 6.499893 20.81324 8.024261 -2.189518      10.32654 
1 1 1 22  4  23 o 13.34015 5.508924 1.489528       2.906976 1.657988       3.466103 1.090026       5.337691 14.21895 5.955085 15.71668 6.977933 -1.497737      9.173581 
1 1 1 22  4  24 o 13.23578 5.506966 1.513368       2.935399 5.024456       3.545119 -6.143227      5.235133 18.11115 6.417945 11.68239 5.692584 6.428764       8.578784 
1 1 1 22  4  25 f 10.24471 4.590414 -0.3028319     2.365918 -5.143724      3.334274 4.606252       3.357676 9.037837 4.433268 17.22503 6.229237 -8.187190      7.645734 
1 1 1 22  4  26 o 22.10606 5.420573 7.560332       2.897314 5.263974       3.967283 10.18482       4.241268 17.71111 6.702847 24.11729 6.879790 -6.406174      9.605189 
1 1 1 22  4  27 o 8.183488 3.979568 -3.342060      2.523020 -6.145770      3.370971 0.2289748      3.804394 8.545736 4.240614 12.54862 5.702785 -4.002883      7.106657 
1 1 1 22  5  0  o 139.9824 2.780999 239.4369       9.486593 236.7578       12.25541 243.4421       14.98446 139.0131 3.620813 140.7871 4.372894 -1.773987      5.677366 
1 1 1 22  5  1  o 123.1116 2.726265 185.2071       8.179054 194.2688       10.74224 172.7078       12.61632 125.9211 3.504148 118.5372 4.375098 7.383987       5.605402 
1 1 1 22  5  2  o 112.7304 2.636005 155.2863       7.241413 152.1560       10.38699 158.2465       10.10081 111.3460 3.833781 113.5924 3.653729 -2.246330      5.295999 
1 1 1 22  5  3  o 59.71458 2.810283 43.69456       4.077992 49.28183       5.591953 37.34779       5.959921 63.30997 3.639903 54.94205 4.490568 8.367920       5.780493 
1 1 1 22  5  4  o 41.70330 3.258987 21.42568       3.285707 20.84805       4.242056 22.29189       5.194742 40.96332 4.314277 42.20559 5.157812 -1.242271      6.724285 
1 1 1 22  5  5  o 91.87624 2.805103 103.3649       6.273056 104.4989       8.262126 101.8215       9.639081 92.21417 3.684114 90.86686 4.365827 1.347313       5.712543 
1 1 1 22  5  6  o 34.18434 4.411226 14.62484       3.589128 14.76792       4.703493 14.42539       5.553284 34.02346 5.885859 33.34849 7.054020 0.6749687      9.187085 
1 1 1 22  5  7  o 45.43683 4.497216 25.71305       4.914272 29.54436       7.687956 23.06600       6.390251 48.13482 6.738491 42.54157 6.358917 5.593250       9.265155 
1 1 1 22  5  8  o 88.65909 2.863353 96.42195       6.178232 99.36208       8.052052 92.21320       9.633853 89.80523 3.687172 86.24261 4.600620 3.562622       5.895841 
1 1 1 22  5  9  o 132.6289 3.077030 215.9091       9.945024 213.6137       13.18183 218.9419       15.15183 131.4798 4.119236 132.8385 4.687986 -1.358704      6.240619 
1 1 1 22  5  10 o 64.38867 4.016999 51.41377       6.271602 71.63802       10.83806 41.23235       7.689881 75.31300 5.953748 57.15031 5.593128 18.16270       8.168856 
1 1 1 22  5  11 o 52.81342 4.378150 34.85232       5.584113 36.77816       8.816032 33.56198       7.216285 53.29795 6.953398 51.31453 5.876705 1.983421       9.104142 
1 1 1 22  5  12 o 44.21866 4.960632 24.76602       5.253326 23.11852       8.278018 25.87691       6.797508 41.27121 8.513517 44.65936 6.431146 -3.388149      10.66957 
1 1 1 22  5  13 o 63.19419 4.122045 49.92073       6.313195 48.02507       9.590965 51.37007       8.386232 60.81467 6.576177 63.50830 5.472077 -2.693630      8.555099 
1 1 1 22  5  14 o 75.70741 3.862398 71.56165       7.102217 73.72119       11.10121 70.06526       9.240863 75.52460 6.083204 74.22617 5.140562 1.298431       7.964342 
1 1 1 22  5  15 o 54.53264 4.514043 37.72599       5.945024 39.47041       9.212384 36.48108       7.782421 54.25378 7.141188 52.73613 6.172424 1.517654       9.439035 
1 1 1 22  5  16 o 16.33891 6.721026 1.711543       4.304609 -1.796639      6.072442 5.255057       6.102946 16.13801 7.282036 21.55432 8.275556 -5.416311      11.02329 
1 1 1 22  5  17 o 11.59036 5.270887 -1.555754      3.256857 0.8153116      3.807055 -8.026834      6.289350 14.64709 6.193737 13.37586 6.451071 1.271233       8.943081 
1 1 1 22  5  18 o 44.61246 3.956314 25.45640       4.256584 32.37457       5.423203 14.35651       6.869413 50.01548 4.497522 30.65148 8.759478 19.36399       9.846631 
1 1 1 22  5  19 o 14.61234 5.839491 1.894170       3.142955 4.994512       3.868697 -4.124263      5.390160 19.26353 6.714139 13.48268 6.350414 5.780853       9.241613 
1 1 1 22  5  20 o 32.99860 4.761504 14.60604       3.718289 15.09107       4.654795 13.75086       6.180816 32.66858 6.070414 29.40090 8.277687 3.267687       10.26499 
1 1 1 22  5  21 o 30.36252 5.346163 12.82191       3.811215 15.12519       4.796490 8.877080       6.277179 32.27623 6.324516 23.46034 8.512587 8.815893       10.60489 
1 1 1 22  5  22 o 21.70824 6.265772 7.058760       3.498247 11.38519       4.345921 -0.9038359     5.895823 27.42680 6.585624 15.27157 7.000641 12.15523       9.611422 
1 1 1 22  5  23 o 14.09794 5.608189 2.149745       2.885790 0.8227156      3.354327 5.929576       5.661108 13.21236 5.705188 19.70277 7.849294 -6.490409      9.703638 
1 1 1 22  5  24 o 10.61127 4.799686 -0.6111460     2.656673 -1.807387      3.080755 2.858842       5.247009 10.47327 4.890481 16.52120 7.134730 -6.047934      8.649924 
1 1 1 22  5  25 f 12.27939 5.272074 0.9475631      2.833072 1.690642       3.280913 -1.230656      5.617307 13.59387 5.749174 13.95702 6.545133 -0.3631439     8.711588 
1 1 1 22  5  26 o 9.419727 4.483714 -2.372057      2.825375 -1.044711      3.345868 -5.670806      5.274621 11.18446 5.179495 11.51371 5.632725 -0.3292551     7.652108 
1 1 1 22  5  27 o 7.364439 3.659035 -5.130472      2.540744 -3.260625      3.215395 -8.238734      4.145626 9.526620 4.599072 9.071930 4.533661 0.4546900      6.457983 
1 1 1 22  6  0  o 76.29932 2.522530 71.18336       4.683772 78.05059       6.445200 63.49819       6.818239 79.79874 3.321658 71.87531 3.907443 7.923431       5.128501 
1 1 1 22  6  1  o 24.72221 4.624156 7.749794       2.683452 5.073654       3.365149 12.42338       4.447081 20.23819 6.221338 31.18523 6.070268 -10.94704      8.692134 
1 1 1 22  6  2  o 99.26891 2.604978 120.5022       6.296192 115.8629       8.882776 125.1864       8.925698 97.14816 3.759226 101.0116 3.631970 -3.863449      5.227139 
1 1 1 22  6  3  o 85.87331 2.649402 90.22620       5.537610 94.92708       7.771549 85.37775       7.892579 87.92490 3.634939 83.32832 3.897581 4.596573       5.329533 
1 1 1 22  6  4  o 133.1436 2.760941 216.8139       8.958048 215.4662       12.99875 218.0329       12.36238 132.3864 4.033937 133.2368 3.811433 -0.8504333     5.549745 
1 1 1 22  6  5  o 112.1473 3.311617 154.2824       9.040433 146.8811       13.39936 160.4666       12.24825 108.9315 5.061546 114.0790 4.414206 -5.147469      6.715985 
1 1 1 22  6  6  o 70.82243 3.609877 61.74469       6.209611 64.13818       9.939088 60.21228       7.952765 71.63768 5.741392 69.68605 4.710816 1.951630       7.426666 
1 1 1 22  6  7  o 51.69100 4.224019 33.14983       5.274443 35.36432       8.508755 31.76787       6.721663 52.68914 6.784145 50.25897 5.582214 2.430164       8.785542 
1 1 1 22  6  8  f 40.73689 4.873414 20.84526       4.742023 19.34382       7.463914 21.86150       6.140581 38.24303 8.251508 41.33817 6.294072 -3.095142      10.37799 
1 1 1 22  6  9  o 75.09392 3.749632 69.65752       6.839958 62.28867       10.60831 74.90079       8.948449 70.13862 6.272735 77.55952 4.757417 -7.420906      7.872752 
1 1 1 22  6  10 o 142.5643 3.154699 249.8895       10.95985 254.4890       14.55566 243.8678       16.65467 143.3313 4.171738 139.8753 4.893600 3.456039       6.430452 
1 1 1 22  6  11 o 77.13029 2.996346 73.26730       5.621162 76.68239       6.997813 67.05567       9.437665 78.70613 3.658538 72.93432 5.347188 5.771812       6.478991 
1 1 1 22  6  12 o 82.83252 2.975721 84.57835       5.996847 89.71850       7.630819 76.27687       9.697527 85.05353 3.690434 77.76206 5.146445 7.291466       6.332867 
1 1 1 22  6  13 o 31.92287 4.356296 12.94926       3.300550 12.69206       3.837147 13.68079       6.471301 31.33330 5.208104 31.49463 8.311955 -0.1613293     9.808820 
1 1 1 22  6  14 o 16.31797 5.700088 3.114224       2.789221 1.757441       3.140033 8.188823       6.072672 14.85359 5.868746 24.92467 8.421048 -10.07108      10.26432 
1 1 1 22  6  15 o 46.52137 3.135513 26.94790       3.533890 29.46842       4.098622 19.64515       6.976474 48.53646 3.488512 37.58366 7.869997 10.95280       8.608517 
1 1 1 22  6  16 o 36.16833 3.572200 16.50925       3.107408 14.05043       3.481881 26.13119       6.887830 33.02683 4.438501 43.97619 6.633457 -10.94936      7.981418 
1 1 1 22  6  17 o 19.40426 5.636261 5.070127       2.822440 4.952529       3.194050 5.489133       6.029083 19.26424 6.083088 21.42936 8.225899 -2.165112      10.23081 
1 1 1 22  6  18 o 20.23842 5.606147 5.615284       2.859850 5.064184       3.113554 8.589477       7.233118 19.28841 5.993719 24.46957 9.094010 -5.181154      10.89154 
1 1 1 22  6  19 o 19.95367 5.557228 5.525692       2.801857 5.059999       3.211725 7.008941       5.731864 19.13455 6.106831 22.17678 8.121035 -3.042231      10.16093 
1 1 1 22  6  20 o 16.78056 5.760362 3.752015       2.843179 2.688200       3.248225 7.237424       5.879494 15.56273 6.020969 22.07132 8.199733 -6.508594      10.17289 
1 1 1 22  6  21 o 33.64727 4.283579 15.06051       3.432790 15.65462       3.994527 13.38249       6.713212 33.82580 4.996140 27.98416 8.816661 5.841642       10.13385 
1 1 1 22  6  22 o 14.28376 5.651364 2.171941       2.915394 2.337418       3.337599 1.639193       5.988602 14.93680 6.001023 16.84285 7.438767 -1.906051      9.557590 
1 1 1 22  6  23 o 13.56171 5.479263 1.833177       2.799509 -0.3877892     3.177094 9.546411       5.920758 11.82354 5.306957 23.14642 8.284290 -11.32288      9.838356 
1 1 1 22  6  24 f 9.703169 4.563713 -2.023744      2.766137 -3.122438      3.170227 1.480759       5.661937 9.799861 4.687950 15.79605 7.087718 -5.996194      8.497801 
1 1 1 22  6  25 o 12.75316 5.659252 0.5510001      3.506365 0.8651263      3.756963 -1.570810      9.764231 13.30939 5.884426 16.49394 7.975270 -3.184549      9.911176 
1 1 1 22  6  26 o 13.08739 5.785272 0.9848823      3.629903 -1.216294      3.864476 17.48285       10.57982 11.78235 5.493652 23.53181 10.14655 -11.74946      11.53832 
1 1 1 22  6  27 o 9.849017 4.696036 -2.380982      3.126455 -4.939141      3.724774 3.719036       5.751773 9.571276 4.693035 16.17938 7.209789 -6.608105      8.602653 
1 1 1 22  7  0  o 40.99640 3.250268 20.69312       3.220584 20.51563       4.136849 20.96619       5.131337 40.67156 4.235905 40.92846 5.266750 -0.2568970     6.758812 
1 1 1 22  7  1  o 99.69642 2.605290 121.5379       6.324109 112.9083       8.812231 130.7021       9.081109 95.89916 3.778206 103.2219 3.615780 -7.322769      5.229599 
1 1 1 22  7  2  o 92.40313 2.625172 104.4425       5.905276 107.0956       8.358464 101.7985       8.344198 93.39587 3.679709 91.03602 3.769431 2.359848       5.267720 
1 1 1 22  7  3  o 65.39155 2.726308 52.37887       4.334898 50.66501       5.811416 54.52860       6.508597 64.16123 3.732955 66.51619 4.034324 -2.354958      5.496428 
1 1 1 22  7  4  o 91.83904 2.650076 103.2304       5.924715 101.1473       8.260756 105.4369       8.502077 90.70451 3.745330 92.60439 3.775452 -1.899887      5.318038 
1 1 1 22  7  5  o 120.2352 3.560685 177.5713       10.42132 205.3116       18.18778 164.0123       12.71566 128.4459 5.825798 115.2596 4.536016 13.18630       7.383451 
1 1 1 22  7  6  o 35.42137 5.262347 15.87211       4.404530 14.33676       6.626647 17.08723       5.895205 32.97508 8.263886 36.35178 6.907290 -3.376701      10.77044 
1 1 1 22  7  7  o 48.52622 3.272300 29.03267       3.846971 30.09883       4.687461 26.83302       6.732909 49.28641 3.935451 45.95025 6.168500 3.336163       7.316978 
1 1 1 22  7  8  o 81.21252 2.902707 80.98209       5.735394 88.32642       7.359066 69.61909       9.153625 84.65485 3.575310 74.69979 5.058322 9.955063       6.194309 
1 1 1 22  7  9  o 53.21569 3.242794 34.93885       4.185318 36.03866       5.068909 32.58282       7.419034 53.90636 3.884731 50.57284 6.145987 3.333519       7.270783 
1 1 1 22  7  10 o 16.86946 5.469590 3.476231       2.569468 4.172477       2.976917 1.442158       5.088252 18.35663 5.881553 17.59464 7.279249 0.7619896      9.358426 
1 1 1 22  7  11 o 50.89957 3.205084 32.04294       3.955297 33.63708       4.751238 28.44414       7.138759 52.00842 3.774529 46.90118 6.413864 5.107243       7.442091 
1 1 1 22  7  12 o 42.78399 3.463126 22.77432       3.579814 27.15058       4.319013 13.16925       6.398573 46.63451 3.834340 31.02397 8.300892 15.61054       9.143684 
1 1 1 22  7  13 o 43.77966 3.513807 23.90629       3.717295 28.77516       4.421036 12.15910       6.867156 47.96215 3.813979 29.60652 8.843072 18.35563       9.630491 
1 1 1 22  7  14 o 37.82781 3.285248 17.86691       2.998414 15.62358       3.330425 27.46534       6.888954 35.15994 3.955552 45.64832 6.365787 -10.48838      7.494640 
1 1 1 22  7  15 o 39.63326 3.263574 19.64660       3.124118 18.84632       3.525702 22.57151       6.740308 38.63804 3.793349 40.74965 7.042288 -2.111607      7.998957 
1 1 1 22  7  16 o 38.81365 3.375356 18.94400       3.160852 19.05244       3.581309 18.56179       6.723347 38.74997 3.843158 36.13281 7.859844 2.617161       8.749115 
1 1 1 22  7  17 o 14.84102 5.415737 2.493460       2.545768 2.613562       2.798825 1.917948       6.126724 15.31465 5.663352 18.40742 7.823629 -3.092770      9.658298 
1 1 1 22  7  18 o 10.88620 4.756927 -0.2025521     2.390023 0.6786308      2.651379 -4.022749      5.520541 12.41593 5.204736 13.78916 6.473431 -1.373230      8.306298 
1 1 1 22  7  19 o 21.27295 5.343691 6.275867       2.766155 5.663855       3.035334 9.274558       6.718808 20.08853 5.847849 24.47027 8.816733 -4.381739      10.57980 
1 1 1 22  7  20 o 26.97035 4.677609 9.832581       2.962910 11.17910       3.379039 5.353393       6.162923 28.58499 5.034704 20.31211 8.156668 8.272875       9.585378 
1 1 1 22  7  21 o 34.31901 4.334980 15.72329       3.544681 17.17495       3.701970 -0.2790512     12.29116 35.89633 4.318655 20.27349 9.561374 15.62284       10.49146 
1 1 1 22  7  22 o 14.12996 5.624713 2.086193       2.904720 2.283629       3.015475 -0.4544127     10.81709 14.50226 5.744462 18.95162 8.947605 -4.449364      10.63290 
1 1 1 22  7  23 o 9.978261 4.622505 -1.473072      2.668391 -1.007979      2.765768 -7.731326      10.14548 10.54441 4.819026 15.91097 7.789837 -5.366560      9.159944 
1 1 1 22  7  24 o 14.03610 5.465487 2.427809       2.689793 0.1777617      3.004629 11.50803       6.035914 11.87384 5.255442 24.40207 8.392453 -12.52822      9.902168 
1 1 1 22  7  25 o 16.35942 5.722617 4.094836       2.811904 2.354487       3.177466 10.37969       6.038238 14.14629 5.791801 22.48722 8.317940 -8.340931      10.13573 
1 1 1 22  7  26 o 7.923145 3.880193 -3.902377      2.522664 -4.083617      2.864651 -3.276351      5.324022 8.529748 4.168242 12.43010 5.979835 -3.900351      7.289216 
1 1 1 22  7  27 o 11.69549 5.081922 0.8633378      2.695359 1.306181       3.066022 -0.6431943     5.655090 12.58417 5.444249 13.67961 6.461850 -1.095437      8.449576 
1 1 1 22  8  0  o 87.96003 2.618607 94.62981       5.606709 97.71281       7.974644 91.61626       7.884295 89.22001 3.675733 86.37301 3.754806 2.847000       5.254482 
1 1 1 22  8  1  o 55.10094 2.912341 37.23732       3.896658 35.79195       5.181984 39.11806       5.911138 53.86367 3.975905 56.25882 4.345313 -2.395149      5.889785 
1 1 1 22  8  2  o 117.0461 2.666601 167.4941       7.605908 166.2043       10.94200 168.6999       10.57989 116.3142 3.865734 117.2233 3.708326 -0.9091034     5.356825 
1 1 1 22  8  3  o 35.90768 3.874448 16.01035       3.336653 12.88493       4.340059 20.52766       5.217719 31.76966 5.820342 40.39449 5.438622 -8.624828      7.965864 
1 1 1 22  8  4  o 147.9338 3.292853 268.2596       11.87069 236.0760       21.29347 282.7719       14.29875 137.5115 6.371675 151.6604 3.872088 -14.14896      7.455958 
1 1 1 22  8  5  o 10.39727 4.728330 -1.575988      2.620907 -1.742531      3.126872 -1.182611      4.805643 11.45108 5.190578 15.16501 6.682109 -3.713929      8.461246 
1 1 1 22  8  6  o 33.60723 4.073506 14.10992       3.268066 15.20040       3.973070 11.82851       5.746694 34.73657 4.823543 30.00236 7.791606 4.734217       9.163825 
1 1 1 22  8  7  o 84.52431 2.885377 87.68154       5.934486 87.05206       7.463068 88.76405       9.786860 84.03799 3.652954 84.52197 4.770947 -0.4839783     6.008827 
1 1 1 22  8  8  o 30.86217 4.444249 12.01912       3.246190 14.06122       3.917897 7.547311       5.797713 33.29533 4.981605 24.68949 8.226961 8.605837       9.617655 
1 1 1 22  8  9  f 38.99963 3.744371 18.93270       3.514899 24.01232       4.295900 8.645177       6.113551 43.88704 4.062932 26.00871 8.437155 17.87832       9.364453 
1 1 1 22  8  10 o 34.40185 3.917381 14.82521       3.225641 15.23684       3.745437 13.64325       6.346763 34.72551 4.534266 31.80854 8.151409 2.916965       9.327649 
1 1 1 22  8  11 o 18.63610 5.502056 4.459777       2.670746 5.864481       3.022472 -0.5438734     5.704445 21.18040 5.721827 16.81988 7.349428 4.360519       9.314151 
1 1 1 22  8  12 o 35.52728 3.754243 15.82735       3.201174 17.15214       3.679091 11.69870       6.494878 36.88323 4.166151 29.20770 8.568707 7.675528       9.527831 
1 1 1 22  8  13 o 63.84822 3.540823 50.75207       5.487632 56.92555       7.183185 42.09872       8.504406 67.24601 4.407732 56.86146 6.239867 10.38455       7.639636 
1 1 1 22  8  14 o 37.79671 3.620581 17.94838       3.294066 17.30121       3.761294 20.07865       6.824100 36.89035 4.262266 38.22948 7.592832 -1.339130      8.707354 
1 1 1 22  8  15 o 27.52947 4.393447 9.797405       2.848388 7.774547       3.232321 16.82739       6.025720 24.07292 5.613660 34.82715 7.332181 -10.75423      9.234396 
1 1 1 22  8  16 o 39.38009 3.637412 19.62086       3.451213 20.52896       3.969134 16.80642       6.987533 40.08269 4.122222 33.83198 8.490045 6.250710       9.437880 
1 1 1 22  8  17 o 18.63634 5.253434 4.683257       2.487926 4.439995       2.562240 8.695343       10.40564 18.18439 5.394365 25.68309 10.49416 -7.498697      11.79943 
1 1 1 22  8  18 o 7.702349 3.725301 -3.216115      2.134044 -3.150956      2.178051 -4.779893      10.67012 7.859821 3.792121 18.92037 8.918735 -11.06055      9.691440 
1 1 1 22  8  19 o 16.02560 5.518686 3.336331       2.610248 3.386663       2.690214 2.527248       10.78599 16.15797 5.600793 21.38492 9.672106 -5.226957      11.17669 
1 1 1 22  8  20 o 13.70620 5.353488 1.910357       2.587079 1.910357       2.587079 0.000000       0.000000 13.70620 5.353488 ?        ?        0.000000       5.353488 
1 1 1 22  8  21 o 31.83044 3.941700 13.37956       2.992193 14.69375       3.396515 8.824458       6.323434 33.13631 4.308129 23.08523 8.516932 10.05108       9.544533 
1 1 1 22  8  22 o 11.69401 4.938109 0.7243145      2.414431 1.518942       2.675849 -2.756785      5.600643 13.08553 5.331117 13.81965 6.497951 -0.7341185     8.405008 
1 1 1 22  8  23 o 18.89613 5.475557 5.311005       2.666680 4.586159       2.982955 8.195711       5.950791 17.54119 5.901968 21.48412 8.190764 -3.942924      10.09564 
1 1 1 22  8  24 f 18.57575 6.122285 5.452418       3.213140 5.685672       3.859016 4.925203       5.801706 18.69286 6.688388 18.08738 7.647153 0.6054783      10.15940 
1 1 1 22  8  25 o 12.90060 5.545769 1.263178       3.142312 -0.3802042     3.803698 4.795390       5.576479 12.34567 5.645700 17.49882 7.451682 -5.153155      9.348876 
1 1 1 22  8  26 o 18.64883 6.388231 5.989116       3.496277 5.256603       4.320262 7.379366       5.951811 17.43984 6.885973 19.12116 7.888087 -1.681320      10.47084 
1 1 1 22  9  0  o 79.28640 2.890962 76.98879       5.576344 77.45084       7.165736 76.27934       8.879216 79.39295 3.714053 78.60065 4.656536 0.7923050      5.956301 
1 1 1 22  9  1  o 153.9493 3.701312 290.6826       13.88575 291.9554       22.27776 289.8740       17.75713 153.3718 5.972011 153.3362 4.757929 0.3565979E-01  7.635627 
1 1 1 22  9  2  o 75.81089 3.682594 70.67692       6.782979 87.70856       10.83207 59.69049       8.699841 84.07641 5.314087 69.32997 5.186969 14.74644       7.425912 
1 1 1 22  9  3  o 100.7887 3.524856 124.7723       8.644106 118.0633       13.52939 129.4000       11.23663 97.39928 5.725403 102.3829 4.514835 -4.983627      7.291363 
1 1 1 22  9  4  o 59.01023 3.161332 42.80297       4.529449 36.56912       5.458061 56.59271       8.117794 54.35044 4.152407 67.47894 4.971571 -13.12851      6.477577 
1 1 1 22  9  5  o 116.6258 3.335801 167.0641       9.470755 173.0683       11.10322 151.0293       18.14482 118.5486 3.848505 109.4845 6.834957 9.064171       7.843955 
1 1 1 22  9  6  o 25.95768 5.107703 8.639352       3.115809 7.782903       3.583267 11.29448       6.309155 24.48406 6.042886 29.32294 8.399446 -4.838873      10.34733 
1 1 1 22  9  7  o 74.94131 2.962970 69.00455       5.400424 68.79956       6.683558 69.39011       9.166311 74.66050 3.684891 74.55693 5.075369 0.1035690      6.271985 
1 1 1 22  9  8  o 23.49812 5.309716 7.153535       2.968605 8.878434       3.418123 1.858822       5.988626 26.18308 5.530739 19.19035 7.914119 6.992727       9.655172 
1 1 1 22  9  9  o 101.8351 2.941935 127.5238       7.293081 127.0435       9.087873 128.3927       12.22353 101.3801 3.684654 101.3320 4.965217 0.4804993E-01  6.183045 
1 1 1 22  9  10 o 83.94760 4.000602 87.55898       8.160525 96.85398       9.795399 66.47299       14.75348 88.03912 4.581494 70.54750 8.770597 17.49162       9.895123 
1 1 1 22  9  11 o 19.13264 6.164104 4.594589       3.266653 6.298990       3.444063 -10.68213      10.31099 21.90796 6.182877 18.02774 8.576632 3.880217       10.57292 
1 1 1 22  9  12 o 54.94538 3.339788 37.49083       4.450719 39.48817       4.750566 23.15025       12.72923 56.35134 3.476357 39.07835 12.11512 17.27298       12.60401 
1 1 1 22  9  13 o 30.10989 3.885917 11.48436       2.784855 11.76609       2.878077 7.345556       11.03127 30.45708 3.972297 26.72860 10.84841 3.728487       11.55280 
1 1 1 22  9  14 o 34.91264 3.528609 15.33382       2.960918 16.18944       3.079607 4.870925       10.76909 35.86919 3.570573 24.72617 10.43451 11.14302       11.02851 
1 1 1 22  9  15 o 9.559392 4.278459 -0.7570284     2.048955 -0.6283761     2.084566 -4.426234      11.13251 9.789852 4.352801 20.32267 9.424005 -10.53281      10.38069 
1 1 1 22  9  16 o 8.850022 4.045759 -1.167798      1.951128 -1.875171      2.085073 3.813269       5.532969 8.580719 4.012176 19.46703 7.758442 -10.88631      8.734470 
1 1 1 22  9  17 o 35.70528 3.199524 16.10290       2.754422 15.56749       3.035592 18.59808       6.553149 34.93193 3.618362 35.63946 7.765446 -0.7075310     8.567070 
1 1 1 22  9  18 o 46.13984 2.852271 26.73079       3.191351 27.37898       3.581124 24.22993       7.034194 46.53382 3.177075 40.75907 7.352421 5.774746       8.009489 
1 1 1 22  9  19 o 16.19297 5.121717 3.536429       2.263402 3.640313       2.319797 1.477444       10.32771 16.40398 5.184708 20.52198 9.353393 -4.118002      10.69426 
1 1 1 22  9  20 f 29.70341 3.807256 11.55545       2.692558 14.31769       3.014118 0.6424143      5.991046 33.10477 3.805355 16.52011 7.360141 16.58466       8.285675 
1 1 1 22  9  21 o 17.17003 5.098503 4.149187       2.287980 4.424016       2.525499 2.890812       5.404075 17.64358 5.383140 17.33335 7.356677 0.3102303      9.115859 
1 1 1 22  9  22 o 17.90097 5.082862 4.605269       2.320402 7.528088       2.540793 -10.08365      5.695913 23.21645 4.653151 11.14265 5.526330 12.07380       7.224413 
1 1 1 22  9  23 o 12.55984 4.913792 1.728341       2.182507 0.6745876      2.346787 8.474188       5.937756 11.37507 4.838652 21.59640 8.194007 -10.22133      9.516003 
1 1 1 22  9  24 o 20.50275 5.041772 6.240202       2.501169 5.990740       2.766070 7.358674       5.856973 19.73143 5.531262 19.97460 7.975177 -0.2431717     9.705582 
1 1 1 22  9  25 o 19.75615 5.456772 6.089717       2.713830 4.618532       2.967895 13.59568       6.703755 17.05526 5.884152 24.72576 8.818947 -7.670498      10.60175 
1 1 1 22  9  26 o 10.42289 4.648680 0.8926735E-02  2.396649 -0.7943141     2.550495 6.070923       7.006633 9.969410 4.582743 17.99187 7.991037 -8.022461      9.211851 
1 1 1 22  10 0  o 123.0135 3.081271 185.3529       9.229468 194.6181       16.86431 181.3913       11.02749 125.3269 5.535553 121.5428 3.727564 3.784073       6.673611 
1 1 1 22  10 1  o 121.1635 3.105009 179.8888       9.160365 180.1601       16.66104 179.7712       10.96667 120.4589 5.691903 120.9746 3.724450 -0.5157242     6.802153 
1 1 1 22  10 2  o 50.63570 3.687201 31.63975       4.518595 36.96787       7.389246 28.45725       5.710798 54.32021 5.665338 47.75065 4.980887 6.569565       7.543560 
1 1 1 22  10 3  o 58.79247 2.927869 42.43598       4.181584 49.33638       5.788952 34.90725       6.046775 63.25367 3.772731 52.96732 4.734549 10.28636       6.053879 
1 1 1 22  10 4  o 135.4369 2.770444 224.6117       9.143712 215.4758       13.16998 233.1137       12.70488 132.2070 4.092774 137.6291 3.791739 -5.422043      5.579255 
1 1 1 22  10 5  o 145.1629 3.132412 258.5218       11.08079 257.3965       14.67856 260.0126       16.89545 144.4056 4.175606 144.8428 4.793308 -0.4372101     6.357003 
1 1 1 22  10 6  o 44.16922 3.458487 24.13054       3.692898 21.79361       4.427509 29.47306       6.694360 41.75992 4.417644 48.24385 5.811063 -6.483932      7.299591 
1 1 1 22  10 7  o 17.66536 5.714554 3.811685       2.805733 3.524621       3.221710 4.712983       5.708628 17.58897 6.127264 21.51483 8.062422 -3.925858      10.12650 
1 1 1 22  10 8  o 39.91217 4.305282 19.96177       4.121214 22.01213       5.146240 16.29584       6.881253 41.68983 5.176685 34.83765 8.236230 6.852180       9.727978 
1 1 1 22  10 9  o 44.20065 4.080826 24.41443       4.345944 28.04729       5.421525 17.88325       7.269306 47.19202 4.780151 36.34614 8.378874 10.84588       9.646522 
1 1 1 22  10 10 o 74.35552 2.851279 68.10289       5.156839 69.45841       6.229448 65.15134       9.192240 74.91547 3.421289 71.78032 5.292301 3.135155       6.301878 
1 1 1 22  10 11 o 96.71264 2.870464 115.3098       6.757569 117.3562       8.321236 111.3466       11.58038 97.28535 3.515759 93.87612 5.081047 3.409225       6.178802 
1 1 1 22  10 12 o 46.04638 2.853212 26.24727       3.185862 26.96934       3.519412 22.97043       7.497359 46.60777 3.116583 41.06834 7.776081 5.539429       8.377382 
1 1 1 22  10 13 o 38.10882 3.558273 18.22429       3.266264 18.68208       3.745645 16.77133       6.672974 38.42301 4.061774 34.63541 8.058279 3.787601       9.024072 
1 1 1 22  10 14 o 30.61645 3.496419 11.83643       2.561927 12.46304       2.805653 8.692677       6.284353 31.34691 3.746977 25.17264 8.565966 6.174269       9.349631 
1 1 1 22  10 15 o 11.37272 4.603515 0.8172894      1.980322 1.611171       2.124279 -4.451673      5.472631 12.88736 4.898405 13.72465 6.443821 -0.8372841     8.094270 
1 1 1 22  10 16 o 21.99656 4.277922 6.361556       2.210518 6.436901       2.366189 5.844809       6.196732 22.03415 4.557242 21.71912 8.338881 0.3150234      9.502915 
1 1 1 22  10 17 o 14.05731 4.881378 2.408829       2.043913 1.724208       2.166967 7.928394       6.152894 13.01903 4.947629 23.43711 8.438186 -10.41808      9.781718 
1 1 1 22  10 18 o 18.10616 4.561985 4.442851       2.011686 4.579603       2.142101 3.421250       5.854823 18.33316 4.755010 18.77014 7.790793 -0.4369793     9.127244 
1 1 1 22  10 19 o 26.59355 3.619842 9.199360       2.285021 9.202016       2.454932 9.182139       6.250745 26.45487 3.927001 23.99764 8.520307 2.457232       9.381736 
1 1 1 22  10 20 o 32.45294 3.490797 13.65128       2.717314 15.21947       2.795419 -13.24095      11.57608 34.34271 3.384154 16.40310 8.087955 17.93960       8.767411 
1 1 1 22  10 21 o 46.35113 3.436313 27.84003       3.853800 34.75037       4.612166 11.85469       7.014816 51.57372 3.694252 25.49349 9.028521 26.08023       9.755085 
1 1 1 22  10 22 o 10.22766 4.372951 0.3386784      1.934274 1.039757       2.054899 -5.112422      5.729929 11.41934 4.664417 12.79899 6.169004 -1.379652      7.733912 
1 1 1 22  10 23 o 28.53006 3.577368 10.86209       2.432621 10.93520       2.615301 10.39295       6.625111 28.41976 3.877295 22.92051 8.664649 5.499250       9.492605 
1 1 1 22  10 24 o 8.902933 4.033968 -0.5796907     1.886385 -1.225817      1.959464 7.601036       6.972278 8.459381 3.933356 19.85577 8.388423 -11.39639      9.264822 
1 1 1 22  10 25 f 17.97490 5.003760 4.905541       2.272134 4.362230       2.381930 10.39457       7.570990 16.83343 5.244269 21.10702 8.817805 -4.273582      10.25944 
1 1 1 22  10 26 o 14.68947 5.088623 3.248425       2.220539 3.851209       2.390817 -0.5368060     5.991169 15.73398 5.283729 14.06063 6.644619 1.673357       8.489332 
1 1 1 22  11 0  o 72.81943 3.142723 65.07188       5.563727 66.35468       9.357099 64.37030       6.919870 73.06573 5.291070 72.27786 3.943711 0.7878723      6.599112 
1 1 1 22  11 1  o 73.83298 3.142051 66.91394       5.640344 74.95555       9.788718 62.91692       6.901170 77.66994 5.201728 71.42902 3.980458 6.240929       6.549963 
1 1 1 22  11 2  o 27.28771 4.869714 9.469344       3.119414 9.771883       4.090396 9.048820       4.822485 27.46903 6.251634 26.40913 7.266211 1.059896       9.585444 
1 1 1 22  11 3  o 57.98306 2.901878 41.29057       4.087275 43.12767       5.650003 39.27370       5.920003 59.06727 3.947901 56.26600 4.351364 2.801270       5.875397 
1 1 1 22  11 4  o 73.65939 2.744471 66.54929       4.917709 68.77172       6.807120 64.12312       7.112294 74.66840 3.753057 72.01637 4.069236 2.652031       5.535713 
1 1 1 22  11 5  o 69.27290 3.000698 58.97729       5.053479 66.39988       6.422781 46.91480       8.187737 73.37479 3.603049 61.10488 5.559401 12.26991       6.624870 
1 1 1 22  11 6  o 42.38389 3.431140 22.24162       3.513576 23.44843       4.264554 19.69107       6.199716 43.38658 4.081441 38.96561 6.774939 4.420971       7.909359 
1 1 1 22  11 7  o 26.32975 5.866506 9.035580       3.667736 11.74636       4.732219 4.957316       5.804368 29.89884 6.665127 21.79854 8.137658 8.100302       10.51881 
1 1 1 22  11 8  f 31.21033 4.089913 12.26501       3.035855 12.60364       3.486907 11.20423       6.171522 31.49234 4.686147 28.91483 8.315134 2.577517       9.544707 
1 1 1 22  11 9  o 88.36838 3.067130 96.27503       6.594871 98.50038       7.571495 89.27944       13.42440 89.23237 3.488677 83.29810 6.669052 5.934265       7.526428 
1 1 1 22  11 10 o 74.48488 3.057608 68.51665       5.538112 63.88952       6.142341 88.62488       12.80457 71.76353 3.523088 82.94795 6.383732 -11.18443      7.291378 
1 1 1 22  11 11 o 33.13450 3.848792 13.83223       3.049955 14.24407       3.422903 12.24525       6.719171 33.50031 4.291271 29.69385 8.716516 3.806454       9.715589 
1 1 1 22  11 12 o 51.45389 2.721297 32.73350       3.400034 35.57759       3.830328 22.16566       7.383403 53.58316 2.944722 40.18034 7.822097 13.40282       8.358026 
1 1 1 22  11 13 o 56.25016 2.631733 39.13087       3.597460 41.34014       4.018864 30.22256       8.070074 57.74135 2.865094 47.16512 7.253338 10.57623       7.798697 
1 1 1 22  11 14 o 21.22952 5.948812 6.090211       3.200133 6.179470       3.859519 5.893846       5.724530 21.40335 6.676724 21.84912 8.095858 -0.4457684     10.49388 
1 1 1 22  11 15 o 34.22118 3.986117 14.99601       3.261995 15.34978       3.803196 14.01152       6.344405 34.33036 4.666768 30.85109 8.270598 3.479277       9.496395 
1 1 1 22  11 16 o 37.41786 2.873824 17.55264       2.600388 16.25756       2.804981 25.47135       6.936002 35.86460 3.244488 42.59638 6.919124 -6.731785      7.642053 
1 1 1 22  11 17 o 30.49657 3.144589 11.80802       2.303491 11.52904       2.465020 13.72988       6.469794 30.01707 3.431480 29.62352 8.512069 0.3935490      9.177711 
1 1 1 22  11 18 o 14.68129 4.398047 2.868404       1.696694 2.742576       1.777472 4.159138       5.692891 14.43127 4.535338 19.16647 7.788065 -4.735195      9.012395 
1 1 1 22  11 19 f 32.51070 6.296970 15.27526       4.808531 22.07382       7.681319 10.89418       6.166203 36.71009 8.717093 25.73608 8.481160 10.97401       12.16215 
1 1 1 22  11 20 o 58.47793 5.110841 46.93793       7.210050 45.36665       9.996607 48.64153       10.40899 53.66916 7.877843 55.52106 7.917367 -1.851906      11.16893 
1 1 1 22  11 21 o 14.60874 6.379171 1.031697       4.291695 0.5537891      6.155582 1.483739       5.986689 16.13377 7.300982 16.55637 7.368044 -0.4225979     10.37268 
1 1 1 22  11 22 o 25.26542 7.667568 11.05013       5.132982 9.963743       6.497131 12.85431       8.372758 22.99224 8.604278 24.54321 9.617804 -1.550968      12.90487 
1 1 1 22  11 23 o 14.13368 4.904116 2.770365       2.062812 2.346045       2.201899 5.814312       5.897513 13.47010 5.015343 18.82825 7.817393 -5.358147      9.287911 
1 1 1 22  11 24 o 20.31359 4.996409 6.167687       2.455939 6.718348       2.678100 3.255689       6.158578 21.03017 5.243955 16.68181 7.445273 4.348362       9.106654 
1 1 1 22  11 25 o 11.46270 5.652716 -6.960736      5.660957 0.000000       0.000000 -6.960736      5.660957 ?        ?        11.46270 5.652716 0.000000       5.652716 
1 1 1 22  12 0  o 170.5688 3.405852 356.9293       14.15668 372.5456       27.12294 351.0821       16.59675 172.6244 6.458999 168.9345 4.031517 3.689835       7.613921 
1 1 1 22  12 1  o 29.54437 4.562501 11.01523       3.179151 12.97607       4.238776 8.493897       4.806559 31.86604 5.666186 25.64247 7.326880 6.223572       9.262226 
1 1 1 22  12 2  o 77.43088 2.742476 73.50819       5.166624 73.97663       7.223863 73.01763       7.392474 77.44822 3.839530 76.91451 3.957383 0.5337067      5.513880 
1 1 1 22  12 3  f 68.92368 2.824813 58.30655       4.734487 60.21786       6.608617 56.29122       6.786060 69.81852 3.899717 67.43514 4.149576 2.383377       5.694451 
1 1 1 22  12 4  o 55.21596 3.051817 37.52341       4.090409 34.61872       5.463702 41.22747       6.169885 52.76833 4.285774 57.57658 4.431462 -4.808250      6.164877 
1 1 1 22  12 5  o 37.98332 4.842800 18.19174       4.380752 23.23989       6.177011 13.08330       6.213790 42.62236 6.122602 31.34593 8.082618 11.27643       10.13977 
1 1 1 22  12 6  o 39.70210 3.660910 19.59877       3.502056 20.78661       4.175496 16.78116       6.430879 40.75525 4.267443 35.56381 7.647752 5.191444       8.757807 
1 1 1 22  12 7  o 91.66376 3.153761 103.5215       7.034207 108.4465       8.185888 89.61901       13.75327 93.66818 3.592887 83.59232 6.810517 10.07586       7.700129 
1 1 1 22  12 8  o 60.49607 3.066419 45.17056       4.505843 50.59032       5.505786 34.17917       7.840709 63.89541 3.549966 51.46999 6.388283 12.42542       7.308380 
1 1 1 22  12 9  o 12.73304 5.149536 0.9631118      2.475446 1.202843       2.760268 -0.2199022E-01 5.595385 13.58487 5.457548 16.99701 7.354036 -3.412142      9.157875 
1 1 1 22  12 10 o 41.71511 3.375015 21.67239       3.401604 20.02057       3.911394 26.79913       6.890832 39.88186 4.082104 45.24295 6.430990 -5.361088      7.617166 
1 1 1 22  12 11 o 54.24686 3.058493 36.48962       4.026759 37.36672       4.641291 33.81971       8.097695 54.75225 3.496846 50.57391 6.738001 4.178341       7.591350 
1 1 1 22  12 12 o 42.62215 3.589942 22.78974       3.694083 21.85292       4.289817 25.47756       7.266273 41.47113 4.307470 43.39923 7.117061 -1.928104      8.319065 
1 1 1 22  12 13 o 13.23504 4.707682 1.974487       1.909045 2.063230       2.023217 1.254103       5.764445 13.55387 4.843658 17.78413 7.574803 -4.230255      8.991034 
1 1 1 22  12 14 f 29.38211 6.667557 11.96914       4.664228 13.47815       6.601392 10.46485       6.591051 30.23584 8.569182 26.82956 8.764476 3.406284       12.25752 
1 1 1 22  12 15 o 21.06648 8.262916 5.171898       6.184706 0.000000       0.000000 5.171898       6.184706 ?        ?        21.06648 8.262916 0.000000       8.262916 
1 1 1 22  12 16 o 27.73735 6.800595 11.05244       4.560769 13.70658       6.882253 8.974204       6.089975 29.56086 8.858276 24.53799 8.430290 5.022871       12.22861 
1 1 1 22  12 17 o 40.58438 5.612180 22.55019       5.402040 37.09362       8.663936 13.30017       6.909602 50.48742 7.249678 28.60564 8.935070 21.88178       11.50623 
1 1 1 22  12 18 o 24.23457 7.645578 9.074600       5.046681 8.338908       7.058837 9.843843       7.217993 23.22728 8.904593 24.58877 9.094475 -1.361496      12.72797 
1 1 1 22  12 19 o 15.58219 6.691345 1.468490       4.565329 2.181443       6.736366 0.8628781      6.208581 18.07699 7.940165 16.80734 7.490056 1.269653       10.91545 
1 1 1 22  12 20 o 13.64350 6.063483 0.6668049E-01  4.040419 -2.361976      6.106879 1.957463       5.388365 14.70281 6.872019 16.56192 7.191008 -1.859108      9.946620 
1 1 1 22  12 21 o 34.75341 8.787603 21.62644       7.445489 0.000000       0.000000 21.62644       7.445489 ?        ?        34.75341 8.787603 0.000000       8.787603 
1 1 1 22  12 22 o 15.61933 6.972442 1.443121       5.403960 0.000000       0.000000 1.443121       5.403960 ?        ?        15.61933 6.972442 0.000000       6.972442 
1 1 1 22  12 23 o 21.24020 7.645706 8.303405       5.051162 9.923848       6.906110 6.439376       7.407008 21.83975 8.679705 19.24351 8.392180 2.596247       12.07336 
1 1 1 22  12 24 o 16.22329 6.823726 3.686261       4.581317 0.8301752      6.988752 5.838356       6.066591 15.71599 7.347502 18.29795 7.781418 -2.581958      10.70216 
1 1 1 22  12 25 o 24.40386 7.976548 12.18594       5.458884 28.30478       9.018628 2.865670       6.857850 33.79583 10.14338 16.27835 7.494405 17.51748       12.61167 
1 1 1 22  13 0  o 70.95985 2.752589 61.74672       4.750788 64.17766       6.742317 59.34965       6.695189 72.12786 3.849872 69.32433 3.979881 2.803528       5.537234 
1 1 1 22  13 1  o 80.70724 2.709157 79.85522       5.320677 80.98684       7.536126 78.73052       7.513074 81.03186 3.827237 79.88146 3.871065 1.150398       5.443610 
1 1 1 22  13 2  o 39.77760 3.635612 19.62194       3.485210 17.19556       4.534309 23.12503       5.448258 36.86729 5.190507 42.81308 5.337718 -5.945786      7.445307 
1 1 1 22  13 3  o 86.61246 3.155354 92.23441       6.648723 92.86608       11.61332 91.92643       8.109200 86.10024 5.564781 86.27331 3.866969 -0.1730652     6.776447 
1 1 1 22  13 4  o 98.26693 3.080577 118.7160       7.367817 114.9606       12.68775 120.6267       9.050089 95.79060 5.457913 98.83911 3.764284 -3.048515      6.630133 
1 1 1 22  13 5  o 35.91547 3.580882 16.05425       3.092340 15.28224       3.897978 17.36512       5.079350 34.76204 4.723578 36.76063 5.867200 -1.998589      7.532346 
1 1 1 22  13 6  o 48.06239 3.315691 28.58918       3.859632 33.65362       4.637306 17.17188       6.962764 52.07544 3.677896 35.71310 8.177154 16.36234       8.966201 
1 1 1 22  13 7  o 68.84538 3.027765 58.44484       5.067217 63.66319       6.172585 47.66019       8.873682 71.70383 3.543530 61.06060 6.042734 10.64322       7.005086 
1 1 1 22  13 8  o 74.90172 2.948683 69.19186       5.371636 71.64644       6.534627 64.07693       9.433037 76.02129 3.537053 71.02477 5.492767 4.996521       6.533088 
1 1 1 22  13 9  o 15.88555 5.507230 2.940051       2.601128 1.954171       2.912226 6.829012       5.784023 14.80710 5.708414 23.43879 8.206864 -8.631688      9.996930 
1 1 1 22  13 10 o 54.45116 3.802622 37.08954       5.014046 42.46529       6.585240 29.67380       7.734448 57.89280 4.708401 47.26670 6.919824 10.62610       8.369767 
1 1 1 22  13 11 o 22.77182 4.214247 6.700097       2.252478 7.949686       2.428351 -1.001219      6.028516 24.87202 4.152814 16.70059 7.415208 8.171427       8.498893 
1 1 1 22  13 12 o 39.14432 2.776120 19.04160       2.630971 18.29354       2.841180 23.54307       6.969633 38.28013 3.071470 41.50966 7.147965 -3.229530      7.779932 
1 1 1 22  13 13 o 41.90089 5.193090 22.93926       5.189143 34.40538       7.709784 13.44319       7.016259 50.61683 6.392771 30.14237 8.922715 20.47445       10.97645 
1 1 1 22  13 14 o 20.65105 7.255017 5.604665       4.522638 6.443719       5.809657 4.314065       7.205290 22.18650 8.167383 21.16630 8.699941 1.020197       11.93294 
1 1 1 22  13 15 o 16.71286 6.887874 2.164716       4.532242 5.996987       6.029343 -2.813824      6.872155 21.57612 8.240072 16.18564 7.469851 5.390474       11.12194 
1 1 1 22  13 16 o 53.91767 5.369576 39.06789       6.961477 38.04514       9.476151 40.26699       10.26060 50.58885 7.948540 51.45159 8.478546 -0.8627396     11.62175 
1 1 1 22  13 17 o 40.82704 5.776669 23.08949       5.586920 27.60050       9.037611 20.29933       7.107749 41.08074 9.251004 36.03010 8.270528 5.050644       12.40898 
1 1 1 22  13 18 o 15.92358 7.049468 0.5689960      5.409078 0.000000       0.000000 0.5689960      5.409078 ?        ?        15.92358 7.049468 0.000000       7.049468 
1 1 1 22  13 19 o 16.55708 7.247573 1.559588       5.569273 0.000000       0.000000 1.559588       5.569273 ?        ?        16.55708 7.247573 0.000000       7.247573 
1 1 1 22  13 20 o 23.20338 7.405865 8.796384       4.723380 7.609621       7.194501 9.695419       6.261913 21.48589 8.745997 23.46858 8.504121 -1.982691      12.19887 
1 1 1 22  13 21 o 13.18184 5.925226 -0.8995085E-01 3.976497 0.5638599      5.919858 -0.6275080     5.367815 15.66943 7.118193 14.46012 6.647507 1.209311       9.739508 
1 1 1 22  13 22 o 14.33246 6.638474 -0.6150975     5.499840 -2.206830      6.423830 3.755018       10.64402 14.42163 6.834506 18.98951 8.937881 -4.567879      11.25150 
1 1 1 22  13 23 o 20.10200 7.521855 7.387037       4.964992 15.20208       7.480124 1.232314       6.638155 25.78685 9.301317 15.89316 7.337258 9.893692       11.84693 
1 1 1 22  13 24 o 20.15585 7.664457 7.928811       5.202140 -0.2027030     6.634553 20.90768       8.381936 14.91164 7.030207 28.83290 9.890772 -13.92126      12.13471 
1 1 1 22  14 0  o 105.2315 3.507874 136.2702       8.982941 142.5318       15.25955 132.9496       11.11243 106.6791 5.892732 103.6439 4.409841 3.035248       7.360095 
1 1 1 22  14 1  o 51.10015 3.360867 32.22500       4.161904 28.37144       5.193958 39.13788       6.956604 47.68003 4.524327 55.88633 5.166523 -8.206299      6.867495 
1 1 1 22  14 2  o 74.15902 2.804023 67.53245       5.058231 63.11591       6.914865 72.61577       7.418498 71.40410 3.989836 76.60505 3.987679 -5.200951      5.640955 
1 1 1 22  14 3  o 59.78658 2.900808 43.97358       4.213673 47.71519       5.713628 39.51218       6.239043 62.07742 3.795095 56.25343 4.591168 5.823986       5.956641 
1 1 1 22  14 4  o 41.80576 3.347467 21.65324       3.381795 22.28720       4.354292 20.68952       5.368587 42.19656 4.294290 40.25773 5.625764 1.938835       7.077439 
1 1 1 22  14 5  f 85.94942 2.943041 90.91425       6.155087 96.44572       7.685441 81.02039       10.27852 88.32047 3.578256 80.24220 5.285881 8.078270       6.383139 
1 1 1 22  14 6  o 75.31525 3.152449 69.99944       5.773056 68.71716       6.527203 74.60648       12.37223 74.47574 3.607195 76.09120 6.742032 -1.615463      7.646362 
1 1 1 22  14 7  f 62.52852 3.201329 48.36089       4.861794 50.84724       5.547390 40.12576       10.09585 64.00452 3.570813 54.97401 7.751013 9.030506       8.533985 
1 1 1 22  14 8  o 34.53676 3.874932 15.00328       3.205055 14.03073       3.475348 20.53608       8.289246 33.23461 4.399054 38.32135 9.026206 -5.086739      10.04112 
1 1 1 22  14 9  o 21.51516 4.966328 6.069125       2.551093 5.663946       2.741700 8.682955       6.963615 20.72983 5.380937 25.80948 9.007138 -5.079649      10.49205 
1 1 1 22  14 10 o 15.32358 6.483290 0.7190895      4.175043 0.2368003      5.055554 1.753433       7.403674 16.22769 7.005643 20.16720 8.586999 -3.939518      11.08222 
1 1 1 22  14 11 o 82.20053 4.418914 85.61541       8.819155 105.8911       12.33860 64.43742       12.61017 90.38428 5.629872 68.69006 7.663806 21.69422       9.509437 
1 1 1 22  14 12 o 30.61130 6.937742 12.99956       5.055284 10.68190       6.478675 16.60731       8.083146 27.23078 8.671481 33.19754 9.506604 -5.966764      12.86740 
1 1 1 22  14 13 o 35.35414 8.224551 18.25712       6.951846 0.000000       0.000000 18.25712       6.951846 ?        ?        35.35414 8.224551 0.000000       8.224551 
1 1 1 22  14 14 o 32.89918 8.500990 16.37501       6.863924 0.000000       0.000000 16.37501       6.863924 ?        ?        32.89918 8.500990 0.000000       8.500990 
1 1 1 22  14 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 22  14 16 o 31.04501 8.315374 15.15001       6.416704 0.000000       0.000000 15.15001       6.416704 ?        ?        31.04501 8.315374 0.000000       8.315374 
1 1 1 22  14 17 o 20.44512 7.190434 6.034784       4.443316 12.85538       7.152691 1.748711       5.670063 27.54319 9.136731 17.10547 7.401954 10.43772       11.75877 
1 1 1 22  14 18 o 22.30595 7.266966 7.672878       4.532684 7.220087       7.308740 7.955871       5.778058 21.90991 8.852848 22.42641 8.162792 -0.5165043     12.04176 
1 1 1 22  14 19 o 19.85531 7.167590 5.956570       4.442965 9.828222       6.816876 3.097364       5.858142 23.68999 8.823802 17.75724 7.601669 5.932747       11.64667 
1 1 1 22  14 20 o 14.51347 6.353846 1.031314       4.281657 0.1756132      6.303423 1.764342       5.834127 15.92527 7.277025 16.48877 7.309339 -0.5635014     10.31414 
1 1 1 22  14 21 o 21.17786 7.274660 7.599000       4.534720 6.701914       6.837996 8.303246       6.058626 19.97597 8.365144 21.37049 8.234950 -1.394516      11.73840 
1 1 1 22  14 22 o 17.84363 7.160627 5.007532       4.746333 1.467654       7.147618 7.799655       6.347966 16.48672 7.612111 20.33127 8.237650 -3.844553      11.21620 
1 1 1 22  14 23 o 13.76487 6.283294 0.2711719      4.683553 6.421167       7.081499 -4.510639      6.244304 18.84698 8.212696 13.03973 6.322380 5.807244       10.36440 
1 1 1 22  14 24 o 16.27424 6.935480 3.881298       4.837090 -1.272996      7.070501 8.415961       6.631902 14.66563 7.011640 19.82978 8.266138 -5.164156      10.83938 
1 1 1 22  15 0  o 45.30840 4.131465 25.55985       4.511487 26.76892       8.209357 25.03671       5.400017 45.24661 7.722311 44.60241 5.057378 0.6442070      9.230989 
1 1 1 22  15 1  o 58.86087 2.942541 42.63245       4.207325 40.98037       5.702511 44.60615       6.232915 57.44018 4.100914 59.88407 4.299760 -2.443886      5.941837 
1 1 1 22  15 2  o 149.2025 2.885300 273.3119       10.49067 280.5265       15.70475 267.4987       14.09720 150.4140 4.288943 147.0781 3.936765 3.335876       5.821782 
1 1 1 22  15 3  o 108.2437 3.121828 144.2471       8.226100 152.4843       14.80630 140.5693       9.893534 110.0937 5.536611 106.5832 3.815293 3.510544       6.723877 
1 1 1 22  15 4  o 99.47645 2.869053 121.7166       6.947699 126.5351       9.134418 115.1028       10.70172 101.1090 3.713586 96.03288 4.586217 5.076096       5.901196 
1 1 1 22  15 5  o 60.77548 2.830674 45.51392       4.180802 49.57400       5.488848 39.90318       6.452442 63.22722 3.576976 56.32092 4.745406 6.906296       5.942527 
1 1 1 22  15 6  o 56.53191 3.102599 39.52293       4.257818 39.43299       4.978092 39.76805       8.217910 56.30956 3.647435 55.52696 6.177723 0.7826004      7.174123 
1 1 1 22  15 7  o 60.97855 3.024670 45.98392       4.480573 48.58924       5.322610 39.64772       8.300592 62.52963 3.507087 55.27378 6.273277 7.255844       7.187048 
1 1 1 22  15 8  o 19.06288 5.051661 4.760974       2.384070 3.488440       2.631321 10.59363       5.633420 16.80695 5.540377 27.76392 7.931789 -10.95697      9.675178 
1 1 1 22  15 9  o 31.95055 3.182188 12.76875       2.444743 11.74053       2.664454 18.24331       6.148088 30.49607 3.658254 36.65208 7.140229 -6.156017      8.022823 
1 1 1 22  15 10 o 16.45135 7.101304 0.3838792      5.193272 0.000000       0.000000 0.3838792      5.193272 ?        ?        16.45135 7.101304 0.000000       7.101304 
1 1 1 22  15 11 o 11.39645 5.609290 -10.40608      5.485437 0.000000       0.000000 -10.40608      5.485437 ?        ?        11.39645 5.609290 0.000000       5.609290 
1 1 1 22  15 12 o 32.99746 6.139916 14.79968       4.755529 20.60122       7.015867 9.868618       6.468142 37.94825 7.846014 26.10947 8.689351 11.83878       11.70747 
1 1 1 22  15 13 o 37.52011 5.564406 18.87685       4.933735 19.70867       7.092110 18.09678       6.867997 36.54290 8.169558 34.94391 8.206195 1.598991       11.57944 
1 1 1 22  15 14 o 22.74804 7.169273 7.444448       4.438533 3.959407       6.320641 10.83494       6.234316 19.84343 8.151447 26.58810 8.510672 -6.744669      11.78464 
1 1 1 22  15 15 o 21.24774 7.226115 6.465609       4.472077 15.12936       6.830104 -0.3588810E-01 5.916721 30.78645 8.713350 16.37717 7.304240 14.40928       11.36989 
1 1 1 22  15 16 o 14.66765 6.340823 0.7557791      4.152752 3.395213       6.391159 -1.172821      5.463177 19.00045 8.029367 14.99880 6.823157 4.001645       10.53690 
1 1 1 22  15 17 o 32.35931 6.807359 15.56577       5.197649 35.85699       9.289456 6.318253       6.271174 47.61797 8.307380 21.03823 8.299553 26.57974       11.74288 
1 1 1 22  15 18 o 26.18005 7.050512 10.65399       4.597783 11.78597       7.281890 9.903513       5.929121 25.61979 9.185222 24.28513 8.319031 1.334660       12.39252 
1 1 1 22  15 19 o 15.86563 6.696067 2.333420       4.435594 7.357121       6.733469 -1.517673      5.895478 21.20484 8.522160 14.74897 6.845797 6.455869       10.93125 
1 1 1 22  15 20 f 27.30478 7.135469 12.21721       4.799674 15.58584       7.161596 9.470366       6.466959 28.19285 9.130656 22.60164 8.556875 5.591204       12.51355 
1 1 1 22  15 21 o 26.24992 7.395199 11.95270       4.931575 16.02579       7.713858 9.137174       6.413422 27.07611 9.477799 21.71482 8.443975 5.361284       12.69368 
1 1 1 22  15 22 o 20.00126 7.604930 7.304607       5.121338 3.323054       7.421331 10.92456       7.076314 17.37569 7.923019 22.43130 8.826331 -5.055613      11.86079 
1 1 1 22  15 23 o 27.30442 8.876933 16.25498       6.765415 16.04068       8.220389 16.70485       11.91020 24.96792 9.599771 22.57345 10.19100 2.394464       14.00043 
1 1 1 22  16 0  o 80.27205 3.194546 79.37221       6.236507 76.20229       11.62024 80.65468       7.391178 77.49724 6.204879 80.74920 3.766496 -3.251961      7.258583 
1 1 1 22  16 1  f 99.55864 2.863278 121.8333       6.939484 114.2474       9.101724 132.3656       10.72458 96.04935 3.896688 103.2310 4.272418 -7.181664      5.782537 
1 1 1 22  16 2  o 146.5150 3.283256 264.4637       11.72257 280.6771       22.42864 258.3699       13.75017 148.7436 6.201291 144.4356 3.910185 4.307999       7.331136 
1 1 1 22  16 3  o 16.30380 5.339469 3.234766       2.445529 2.202123       2.926353 5.625792       4.452907 15.23470 5.758738 21.38626 7.211051 -6.151561      9.228343 
1 1 1 22  16 4  f 106.5027 3.243235 140.0625       8.407537 129.6446       9.462609 179.1200       18.32206 102.2058 3.805911 118.2641 6.381116 -16.05833      7.429913 
1 1 1 22  16 5  f 52.01703 3.259558 33.54586       4.111041 37.56200       4.894670 23.92790       7.574619 54.92837 3.677905 42.23399 7.640947 12.69438       8.480040 
1 1 1 22  16 6  o 59.64153 2.971838 43.98336       4.305660 45.76783       5.107410 39.59989       8.004891 60.68377 3.468202 55.33595 6.033884 5.347820       6.959610 
1 1 1 22  16 7  o 60.75920 2.866737 45.64642       4.232623 49.31485       4.994531 36.29820       7.972955 63.02479 3.263086 52.67177 6.338889 10.35302       7.129463 
1 1 1 22  16 8  o 21.71666 8.120473 5.434906       5.784679 0.000000       0.000000 5.434906       5.784679 ?        ?        21.71666 8.120473 0.000000       8.120473 
1 1 1 22  16 9  o 48.40000 4.522663 29.87277       5.272513 30.52599       7.738087 29.30668       7.203500 47.61779 6.866678 46.88179 6.478214 0.7360001      9.440261 
1 1 1 22  16 10 o 19.83924 6.976846 4.940545       4.183211 7.593306       5.705783 1.857445       6.151203 23.70669 8.159470 18.64498 7.878076 5.061707       11.34200 
1 1 1 22  16 11 o 21.06163 6.943492 5.966052       4.132834 4.745187       5.704727 7.314559       5.995532 20.54136 7.970431 23.29908 8.336727 -2.757719      11.53381 
1 1 1 22  16 12 o 79.35978 4.548158 81.17976       8.758899 92.47083       12.25407 69.38530       12.52426 82.93869 6.105793 70.25854 7.427349 12.68015       9.614896 
1 1 1 22  16 13 o 21.91201 7.089181 6.801052       4.317831 6.062000       5.938684 7.629877       6.289037 21.52550 8.188186 23.19936 8.504788 -1.673859      11.80584 
1 1 1 22  16 14 o 26.42316 6.901597 10.20662       4.491691 13.44981       6.692729 7.548648       6.058885 29.06905 8.741068 22.78856 8.348772 6.280491       12.08753 
1 1 1 22  16 15 o 27.09421 7.208294 11.02412       4.842134 26.86483       7.716545 0.7355385      6.218896 42.18785 7.792838 17.07526 7.559076 25.11259       10.85670 
1 1 1 22  16 16 o 13.84623 6.204136 -0.4807065     4.321671 1.204600       6.996309 -1.520503      5.495456 17.86421 7.956669 14.73468 6.756103 3.129535       10.43808 
1 1 1 22  16 17 o 17.18161 6.836749 3.499124       4.289767 6.727051       6.785622 1.350241       5.536486 21.30282 8.557330 16.43016 7.208155 4.872654       11.18863 
1 1 1 22  16 18 o 15.88167 7.010133 1.215600       5.310888 0.000000       0.000000 1.215600       5.310888 ?        ?        15.88167 7.010133 0.000000       7.010133 
1 1 1 22  16 19 o 11.44360 5.468145 -3.782361      4.287459 -4.083885      6.125080 -3.492687      6.003514 13.68243 6.537338 13.79863 6.558866 -0.1162052     9.260427 
1 1 1 22  16 20 o 16.83415 7.316230 3.054663       5.588757 3.383544       6.456562 2.071944       11.16083 17.52031 7.731563 18.83549 8.950096 -1.315187      11.82714 
1 1 1 22  16 21 o 18.96411 7.919963 6.089556       6.104715 5.823178       7.182533 6.782738       11.58651 18.91234 8.255600 19.92115 9.360363 -1.008808      12.48084 
1 1 1 22  16 22 o 22.89513 7.780566 10.09251       5.184565 9.788203       7.876895 10.32512       6.886639 20.94083 8.884515 21.76213 8.661390 -0.8213081     12.40783 
1 1 1 22  16 23 o 15.80584 6.829538 3.251555       4.812924 -0.2718711     7.551836 5.661568       6.245678 15.39126 7.327317 17.95920 7.769988 -2.567943      10.67999 
1 1 1 22  17 0  o 37.41417 4.593004 17.67237       4.099883 18.62894       7.448073 17.25652       4.910862 37.09885 8.430586 36.63474 5.684989 0.4641190      10.16828 
1 1 1 22  17 1  o 11.90126 5.352263 -1.415376      3.249160 -10.27730      5.750614 2.740341       3.937977 12.07663 5.902409 17.29827 6.646024 -5.221638      8.888648 
1 1 1 22  17 2  o 64.86261 3.312822 52.05169       5.219006 54.51876       9.144746 50.85998       6.355720 65.38744 5.799144 63.85498 4.106217 1.532452       7.105708 
1 1 1 22  17 3  o 76.79693 3.170248 72.88657       5.920227 72.59052       6.758287 73.86312       12.27448 76.47107 3.637055 75.48522 6.743703 0.9858475      7.661964 
1 1 1 22  17 4  o 53.51252 2.959355 35.40693       3.844095 41.71971       5.054068 26.74263       5.921030 57.90544 3.599468 45.67014 5.426154 12.23530       6.511476 
1 1 1 22  17 5  o 79.00735 3.061548 77.20491       5.883311 75.26256       6.634382 84.35593       12.72975 77.82535 3.507201 80.51934 6.543955 -2.693993      7.424541 
1 1 1 22  17 6  f 45.39100 3.078302 25.59395       3.384857 25.27070       3.821408 26.77124       7.292740 44.97221 3.514830 44.80624 6.900209 0.1659698      7.743831 
1 1 1 22  17 7  o 39.85544 6.957293 21.44239       6.511459 0.000000       0.000000 21.44239       6.511459 ?        ?        39.85544 6.957293 0.000000       6.957293 
1 1 1 22  17 8  o 21.42081 8.018584 5.390627       5.643578 0.000000       0.000000 5.390627       5.643578 ?        ?        21.42081 8.018584 0.000000       8.018584 
1 1 1 22  17 9  o 16.01227 7.092680 -0.6405722     5.483062 0.000000       0.000000 -0.6405722     5.483062 ?        ?        16.01227 7.092680 0.000000       7.092680 
1 1 1 22  17 10 o 23.51114 7.046589 7.714292       4.354743 11.23069       6.198444 4.287016       6.119391 27.69220 8.430314 20.42976 8.153558 7.262436       11.72820 
1 1 1 22  17 11 f 49.53275 4.780000 31.93896       5.698156 43.94339       8.933706 23.70588       7.398474 56.62788 6.597304 40.56725 7.766711 16.06062       10.19050 
1 1 1 22  17 12 o 14.18749 6.200060 0.6262779E-01  4.060954 -0.7081192     5.847459 0.7806862      5.644054 16.08233 7.210572 16.83193 7.333321 -0.7495956     10.28445 
1 1 1 22  17 13 o 17.83858 6.922289 3.642990       4.303271 0.5106624      5.932974 7.120073       6.250957 16.81569 7.416415 22.44966 8.431684 -5.633970      11.22927 
1 1 1 22  17 14 o 25.91103 7.102410 10.00833       4.617386 11.13375       6.993566 9.138652       6.147823 26.18161 9.032533 24.26146 8.463363 1.920151       12.37801 
1 1 1 22  17 15 o 28.17599 7.118436 11.98745       4.888577 5.366647       7.287437 17.40454       6.591774 20.85625 8.677208 33.10296 8.211372 -12.24671      11.94657 
1 1 1 22  17 16 o 18.06688 7.563982 3.371543       5.589000 1.084140       6.515969 9.739235       10.87173 17.20947 7.670992 24.09126 10.33527 -6.881794      12.87097 
1 1 1 22  17 17 o 19.69173 7.869296 5.530930       5.707640 7.307144       6.703012 0.8468046      10.88520 21.45880 8.543667 19.56124 9.153204 1.897551       12.52100 
1 1 1 22  17 18 o 14.05775 6.499601 -1.337652      5.237351 -0.4811884     5.963345 -4.226696      10.95249 15.29891 7.023337 17.54300 8.473739 -2.244096      11.00598 
1 1 1 22  17 19 o 23.30409 8.588322 10.34438       6.426916 0.000000       0.000000 10.34438       6.426916 ?        ?        23.30409 8.588322 0.000000       8.588322 
1 1 1 22  17 20 o 26.55255 7.412117 12.26083       4.978222 17.55137       7.914927 8.798016       6.403413 28.20503 9.612953 21.37143 8.400167 6.833593       12.76604 
1 1 1 22  17 21 o 35.38578 6.828825 20.61961       5.675267 40.13652       9.629949 10.23399       7.024813 45.57225 8.990844 21.87403 8.733959 23.69822       12.53464 
1 1 1 22  17 22 o 17.27180 7.129869 4.818302       4.866904 9.023723       7.704266 2.025600       6.278253 20.25546 8.695217 15.86501 7.254411 4.390454       11.32401 
1 1 1 22  18 0  o 44.13379 3.991495 24.36982       4.246462 32.81433       8.414126 21.48391       4.918844 50.00232 7.105068 41.10135 5.014715 8.900967       8.696513 
1 1 1 22  18 1  o 66.59456 3.272694 54.89214       5.294781 67.66541       10.15676 50.12549       6.204557 72.80782 5.771736 63.37037 4.038821 9.437454       7.044502 
1 1 1 22  18 2  o 16.42374 5.228129 3.366755       2.355184 1.031127       2.805369 8.943315       4.334822 13.43116 5.463581 25.83658 6.795383 -12.40542      8.719401 
1 1 1 22  18 3  o 44.80952 3.459957 25.02152       3.748889 27.56816       4.457489 18.86662       6.929733 46.89812 3.936604 37.15440 7.897259 9.743717       8.824033 
1 1 1 22  18 4  o 54.41001 2.828271 36.60966       3.737167 36.60243       4.754491 36.62136       6.045339 54.15116 3.623825 53.75127 4.661289 0.3998871      5.904212 
1 1 1 22  18 5  o 15.95524 5.355262 3.102915       2.456016 4.984962       3.018639 -0.5827695     4.224303 19.51388 5.870991 14.29683 6.283484 5.217052       8.599460 
1 1 1 22  18 6  o 31.18280 3.370772 12.22290       2.520753 11.28934       2.740225 17.36052       6.428273 29.81083 3.862768 35.35124 7.681932 -5.540409      8.598433 
1 1 1 22  18 7  o 17.40233 7.234330 1.801924       5.059484 0.000000       0.000000 1.801924       5.059484 ?        ?        17.40233 7.234330 0.000000       7.234330 
1 1 1 22  18 8  o 29.68913 6.407480 12.05956       4.499636 25.06229       6.904332 2.459518       5.932544 42.85476 6.841193 18.83875 7.832756 24.01601       10.39971 
1 1 1 22  18 9  o 46.91022 4.871299 28.59230       5.487646 37.43975       8.542297 22.37542       7.160642 52.24134 6.876866 39.67540 7.683826 12.56595       10.31176 
1 1 1 22  18 10 o 25.67474 6.885669 9.365718       4.396455 19.63377       7.035858 2.788329       5.631186 36.54831 8.111588 18.52567 7.660475 18.02264       11.15709 
1 1 1 22  18 11 o 22.07124 7.945117 6.752097       5.454577 1.538382       6.119384 26.91216       12.03317 17.88199 7.713627 38.49915 11.75119 -20.61716      14.05669 
1 1 1 22  18 12 o 29.11437 8.281269 13.11739       6.154055 19.22350       7.531565 0.8506869      10.67497 34.90409 8.845129 20.97459 9.540114 13.92950       13.00961 
1 1 1 22  18 13 o 19.51096 7.669734 4.675991       5.338725 2.369452       6.210416 11.20615       10.44966 18.24270 7.818556 26.06710 10.56637 -7.824400      13.14451 
1 1 1 22  18 14 o 47.86456 6.637704 32.97734       7.534163 42.06490       9.648852 18.78116       12.05973 52.75882 7.734499 30.18068 11.62134 22.57814       13.95987 
1 1 1 22  18 15 o 14.45122 6.350461 0.4188201      4.313482 4.525861       6.311931 -3.179883      5.908412 19.49690 8.090542 14.29317 6.705895 5.203730       10.50837 
1 1 1 22  18 16 o 22.07488 7.325161 7.682186       4.597407 5.352390       6.836941 9.605165       6.211410 20.03554 8.375483 23.76373 8.487476 -3.728199      11.92418 
1 1 1 22  18 17 o 29.36682 7.162723 13.73983       5.079371 23.83259       7.814778 6.357124       6.683736 36.81494 8.825472 20.37349 8.377154 16.44145       12.16822 
1 1 1 22  18 18 o 15.41575 6.593534 2.108823       4.400346 4.405028       6.480347 0.1442678      5.994115 18.47223 7.952782 15.49041 7.085099 2.981823       10.65107 
1 1 1 22  18 19 o 19.14241 7.311776 6.036471       4.747861 8.038995       7.563738 4.734367       6.099165 20.74075 8.748316 18.21107 7.775186 2.529684       11.70413 
1 1 1 22  18 20 o 15.90869 6.919516 2.681901       5.007398 -1.272619      7.699984 5.579860       6.591573 15.61895 7.425218 18.61352 8.017245 -2.994571      10.92749 
1 1 1 22  18 21 o 15.24501 6.557941 2.610876       4.399543 3.659741       7.010708 1.929471       5.650732 17.19966 7.786653 15.55741 7.021918 1.642253       10.48519 
1 1 1 22  19 0  o 73.66885 3.672744 67.50255       6.572627 86.42500       11.26875 57.74621       8.091531 82.27208 5.655056 67.55804 4.949276 14.71404       7.514985 
1 1 1 22  19 1  f 26.63434 6.399847 9.491292       4.101934 6.478694       5.994653 12.14381       5.624999 23.12486 8.328560 29.77156 7.697066 -6.646706      11.34062 
1 1 1 22  19 2  o 76.10567 3.077525 71.71323       5.695845 75.34392       6.649287 61.70594       11.03921 77.82455 3.515159 68.58356 6.690093 9.240990       7.557359 
1 1 1 22  19 3  o 33.72490 3.960848 14.39380       3.193204 19.08072       3.699736 0.7061408      6.322546 38.88904 3.959125 18.26502 7.859373 20.62402       8.800251 
1 1 1 22  19 4  o 67.35265 2.848799 56.16153       4.665204 63.96323       5.734866 40.89827       8.021443 71.69971 3.291013 55.94059 5.976716 15.75912       6.822895 
1 1 1 22  19 5  o 22.85398 4.018631 6.733693       2.156419 7.144065       2.457959 5.362222       4.493441 23.42127 4.469549 20.65732 7.233511 2.763952       8.502974 
1 1 1 22  19 6  o 14.91647 5.288434 2.576212       2.407345 1.842319       2.467862 16.99200       10.93764 13.82493 5.273735 32.86797 11.29766 -19.04304      12.46794 
1 1 1 22  19 7  o 16.09328 7.873930 -15.16867      10.31487 0.000000       0.000000 -15.16867      10.31487 ?        ?        16.09328 7.873930 0.000000       7.873930 
1 1 1 22  19 8  o 19.15973 7.622468 3.696500       5.331489 10.12538       6.276269 -12.96650      10.10440 26.30026 8.549973 16.32482 7.944380 9.975443       11.67113 
1 1 1 22  19 9  o 16.00621 6.987579 0.3379893      5.146470 1.536785       5.968062 -3.139102      10.16410 17.85448 7.658558 19.43750 9.010506 -1.583025      11.82551 
1 1 1 22  19 10 o 34.24904 8.753995 18.16462       7.332986 0.000000       0.000000 18.16462       7.332986 ?        ?        34.24904 8.753995 0.000000       8.753995 
1 1 1 22  19 11 o 38.25034 5.824735 20.08989       5.258176 29.91092       8.213387 13.26932       6.844695 45.00376 7.770014 28.86170 8.872851 16.14206       11.79409 
1 1 1 22  19 12 o 26.76243 7.149887 10.66508       4.751562 8.893938       7.116519 12.08978       6.382666 24.06663 9.005335 27.52049 8.586321 -3.453857      12.44271 
1 1 1 22  19 13 o 15.05511 6.411035 1.263266       4.127675 2.885422       6.532328 0.1850805      5.325600 18.68605 8.013791 15.66748 6.962261 3.018572       10.61574 
1 1 1 22  19 14 o 12.36522 5.728116 -2.104962      4.097050 -0.8705900     6.203617 -3.059840      5.456270 15.84426 7.232063 13.79870 6.464392 2.045558       9.700057 
1 1 1 22  19 15 o 22.25364 7.491829 7.842095       4.806469 12.79702       7.284442 4.021478       6.396533 26.56372 9.215793 18.89439 8.010835 7.669333       12.21083 
1 1 1 22  19 16 o 17.55299 7.025118 3.979684       4.555693 7.759510       6.747078 0.8124746      6.176156 21.60216 8.581161 16.34077 7.361388 5.261391       11.30603 
1 1 1 22  19 17 o 17.82332 7.127534 4.434340       4.685615 6.993576       7.064723 2.424419       6.260796 20.57854 8.551115 17.11876 7.581109 3.459772       11.42781 
1 1 1 22  19 18 o 24.34754 8.988932 12.07641       7.045849 0.000000       0.000000 12.07641       7.045849 ?        ?        24.34754 8.988932 0.000000       8.988932 
1 1 1 22  19 19 o 12.74300 5.945724 -1.506275      4.539421 1.976995       7.166494 -3.840327      5.866355 16.82205 7.713947 13.14118 6.310292 3.680874       9.966181 
1 1 1 22  19 20 o 15.46073 6.771914 2.397573       4.869005 1.702868       7.983353 2.809036       6.143991 16.77939 7.847361 16.46624 7.386259 0.3131542      10.77673 
1 1 1 22  20 0  o 33.96655 4.618496 14.77002       3.723920 16.11240       6.725934 14.17661       4.471893 33.97709 8.214624 32.82799 5.802157 1.149097       10.05709 
1 1 1 22  20 1  o 41.25822 3.942945 21.45835       3.916140 28.81802       7.096906 18.23628       4.695779 46.71169 6.402905 37.50469 5.284197 9.207001       8.301804 
1 1 1 22  20 2  o 13.26919 4.989555 1.732441       2.190376 1.640897       2.388599 2.216326       5.491617 13.44803 5.173637 18.37334 7.578035 -4.925308      9.175681 
1 1 1 22  20 3  f 57.98181 3.009997 41.76745       4.238425 45.28539       5.011915 32.93491       7.941494 60.20975 3.430055 49.57426 6.748770 10.63549       7.570414 
1 1 1 22  20 4  o 16.94173 5.135967 3.731853       2.303879 4.181665       2.823647 2.836011       3.984841 17.97691 5.724746 17.12185 6.656487 0.8550568      8.779610 
1 1 1 22  20 5  o 50.73716 4.131699 32.72483       5.064287 0.000000       0.000000 32.72483       5.064287 ?        ?        50.73716 4.131699 0.000000       4.131699 
1 1 1 22  20 6  o 44.71581 6.938006 27.55190       7.315327 0.000000       0.000000 27.55190       7.315327 ?        ?        44.71581 6.938006 0.000000       6.938006 
1 1 1 22  20 7  o 24.74167 6.849100 8.645588       4.270100 17.30264       6.484914 2.018882       5.673724 34.48726 7.888048 17.98785 7.581458 16.49942       10.94074 
1 1 1 22  20 8  o 21.43215 7.042898 6.387189       4.253289 10.24703       6.567036 3.598098       5.582339 26.09480 8.756872 19.09749 7.729576 6.997309       11.68029 
1 1 1 22  20 9  o 69.36565 4.791148 62.97775       8.049033 70.24902       11.27267 55.41454       11.49674 71.18190 6.572816 61.68574 7.823850 9.496159       10.21834 
1 1 1 22  20 10 o 27.17072 6.991682 10.80088       4.656096 12.44706       7.049833 9.527262       6.200968 27.84591 9.062226 24.93158 8.508458 2.914322       12.43052 
1 1 1 22  20 11 o 21.84720 7.243711 6.971138       4.495975 16.55701       7.663621 1.940497       5.551750 31.54055 9.322359 17.31645 7.406288 14.22410       11.90628 
1 1 1 22  20 12 o 28.05283 7.005687 11.77528       4.774537 22.31786       7.989626 5.918972       5.954771 36.89706 8.973437 20.79438 8.122037 16.10268       12.10331 
1 1 1 22  20 13 o 31.08643 6.836016 14.42772       5.037374 22.98914       8.224315 9.287495       6.372612 36.80144 9.197015 23.87211 8.588450 12.92933       12.58358 
1 1 1 22  20 14 o 30.80207 6.691673 14.28861       4.878894 27.30665       7.992784 6.557357       6.159567 40.96995 8.290611 20.88974 8.230179 20.08021       11.68204 
1 1 1 22  20 15 o 26.97360 7.192661 11.61734       4.814254 26.87504       8.103469 3.294541       5.984955 39.69897 8.623627 17.86386 7.666106 21.83512       11.53846 
1 1 1 22  20 16 o 16.06446 6.702979 2.772719       4.366969 -0.1615135     6.499997 5.186789       5.895774 15.85908 7.299517 18.98509 7.843256 -3.126010      10.71446 
1 1 1 22  20 17 o 15.73097 6.805226 2.234076       4.789959 0.9715505      7.381583 3.152380       6.295390 16.79821 7.748699 17.36845 7.650706 -0.5702362     10.88924 
1 1 1 22  20 18 o 25.61563 7.667933 11.73372       5.158957 18.28755       8.471922 7.871138       6.503895 28.16120 9.926641 20.57675 8.337810 7.584450       12.96369 
1 1 1 22  20 19 o 20.46143 7.896903 7.891363       5.577634 11.66953       8.303114 4.784473       7.529448 22.39070 9.284292 18.21054 8.172091 4.180157       12.36856 
1 1 1 22  21 0  o 20.05336 6.228785 5.289340       3.362957 8.512134       5.681664 3.551383       4.172331 24.96366 8.136263 18.22958 6.879510 6.734074       10.65488 
1 1 1 22  21 1  o 62.39972 3.300370 48.56926       5.000738 56.34515       8.841974 44.91225       6.063694 65.86713 5.560531 59.56889 4.204171 6.298248       6.970980 
1 1 1 22  21 2  o 37.27284 5.201814 18.14433       4.596278 14.27079       6.060145 23.39009       7.052332 31.69558 7.879701 41.19694 7.291537 -9.501354      10.73574 
1 1 1 22  21 3  o 24.93212 4.026950 8.018228       2.363294 13.45352       2.942929 -1.851792      3.965769 32.52556 3.783488 12.75881 5.807734 19.76674       6.931418 
1 1 1 22  21 4  o 25.28098 3.418611 8.132143       2.052181 7.808153       2.434709 8.927121       3.813805 24.49846 4.231165 25.47750 6.201970 -0.9790363     7.507808 
1 1 1 22  21 5  o 25.22542 4.654343 8.392898       2.755720 8.621176       3.095849 7.521899       6.047234 25.36389 5.183947 23.40812 8.372957 1.955774       9.847828 
1 1 1 22  21 6  o 51.43835 6.664917 36.49533       8.158234 0.000000       0.000000 36.49533       8.158234 ?        ?        51.43835 6.664917 0.000000       6.664917 
1 1 1 22  21 7  o 28.17579 6.832085 11.35825       4.641972 20.41827       7.346607 5.337401       5.988955 36.80967 8.378860 20.90592 8.151154 15.90374       11.68959 
1 1 1 22  21 8  o 18.61970 6.950495 4.306352       4.234216 9.409587       6.769972 1.027468       5.426592 24.92575 8.865359 16.68830 7.231320 8.237452       11.44057 
1 1 1 22  21 9  o 59.35538 5.206104 47.06601       7.454070 53.73202       10.34744 39.87498       10.74721 61.30000 7.055383 50.44390 9.076516 10.85610       11.49615 
1 1 1 22  21 10 o 24.14585 7.385732 8.772950       4.750118 10.19118       7.084797 7.614800       6.402295 25.21890 9.057812 22.71594 8.532834 2.502962       12.44400 
1 1 1 22  21 11 o 23.03284 7.496734 8.082046       4.824436 7.338120       7.399915 8.632014       6.362552 22.44065 8.962801 23.46510 8.561935 -1.024454      12.39510 
1 1 1 22  21 12 o 24.87186 7.247762 9.568989       4.660395 12.45064       7.202367 7.493455       6.112510 26.74163 9.168602 22.05453 8.325950 4.687109       12.38486 
1 1 1 22  21 13 o 18.03420 7.125225 4.181476       4.628387 3.144921       7.035411 4.972394       6.145525 18.69387 8.165217 19.52039 8.030260 -0.8265209     11.45233 
1 1 1 22  21 14 o 19.30844 7.256522 5.557910       4.631526 7.595072       6.966737 3.944464       6.200032 21.54354 8.664955 18.47782 7.862527 3.065725       11.70046 
1 1 1 22  21 15 o 28.63757 7.385492 13.48570       5.187549 16.99815       8.080976 11.02363       6.765632 28.85246 9.714196 24.18951 8.828558 4.662947       13.12665 
1 1 1 22  21 16 o 21.86687 7.983700 8.526460       5.533425 7.209253       7.629179 9.988502       8.037682 20.49580 8.721501 22.38771 9.193926 -1.891907      12.67252 
1 1 1 22  21 17 o 30.08911 7.999277 16.23064       5.965829 24.18692       8.702930 9.177741       8.193967 33.60681 9.934740 21.38629 9.067034 12.22052       13.45028 
1 1 1 22  21 18 o 22.83711 8.021413 10.01866       5.528430 11.23404       8.136555 8.976388       7.534832 22.31042 9.215202 20.92271 8.772619 1.387718       12.72316 
1 1 1 22  22 0  o 27.11240 5.373825 9.790690       3.424968 13.65687       6.085805 7.998593       4.143407 30.84537 8.022038 24.06381 6.778259 6.781553       10.50228 
1 1 1 22  22 1  o 22.56082 5.736116 6.904214       3.160118 6.959472       5.283871 6.873442       3.943026 22.73334 7.850834 22.37510 6.705005 0.3582420      10.32437 
1 1 1 22  22 2  o 44.62358 3.730362 25.22106       4.019417 30.18899       6.804010 22.55803       4.981553 47.49728 6.012948 41.55372 5.021171 5.943558       7.833754 
1 1 1 22  22 3  o 8.074336 3.697850 -1.039093      1.639787 -0.6361778     1.839817 -2.595644      3.616174 9.094467 4.063451 11.52881 5.354705 -2.434344      6.721942 
1 1 1 22  22 4  o 34.27269 2.857438 14.72107       2.364804 17.27118       2.915663 9.818356       4.042745 36.98892 3.268257 26.51713 6.341863 10.47179       7.134475 
1 1 1 22  22 5  o 17.64495 7.444698 2.026768       5.480075 0.000000       0.000000 2.026768       5.480075 ?        ?        17.64495 7.444698 0.000000       7.444698 
1 1 1 22  22 6  o 16.24454 7.272137 -0.5476816     5.923033 0.000000       0.000000 -0.5476816     5.923033 ?        ?        16.24454 7.272137 0.000000       7.272137 
1 1 1 22  22 7  f 16.29362 6.649608 2.275236       4.171822 1.231009       6.379108 3.055600       5.514561 17.80043 7.775009 18.35261 7.584044 -0.5521851     10.86133 
1 1 1 22  22 8  o 30.96009 6.774834 13.87584       4.969031 32.89064       8.602133 4.353573       6.087381 47.04158 7.775315 19.76409 8.045026 27.27748       11.18830 
1 1 1 22  22 9  o 17.32942 6.980176 3.136837       4.528061 0.1191099E-01  6.661325 5.821027       6.173728 17.06672 7.670414 20.91486 8.239769 -3.848131      11.25740 
1 1 1 22  22 10 o 23.47880 7.560257 8.480879       4.914454 13.68225       7.672185 4.861728       6.399758 28.04782 9.465345 20.01783 8.210410 8.029993       12.53011 
1 1 1 22  22 11 o 24.47005 7.428589 9.388538       4.817470 18.44646       7.501876 3.031854       6.284503 32.72952 9.084998 18.31920 7.858455 14.41032       12.01218 
1 1 1 22  22 12 o 24.17303 7.538582 9.399668       4.920605 21.55950       7.555779 0.4446506      6.484085 35.56111 8.773848 16.62206 7.510356 18.93905       11.54928 
1 1 1 22  22 13 o 29.75947 7.562595 14.39406       5.494923 15.72460       7.809470 13.08941       7.733082 28.53019 9.549048 26.07759 9.450315 2.452599       13.43476 
1 1 1 22  22 14 o 53.54932 5.748019 41.65561       7.383544 56.59063       10.82046 28.64196       10.10049 58.92483 7.721058 36.79934 10.65444 22.12549       13.15796 
1 1 1 22  22 15 o 17.65616 8.058830 2.182274       7.702240 0.000000       0.000000 2.182274       7.702240 ?        ?        17.65616 8.058830 0.000000       8.058830 
1 1 1 22  22 16 o 19.62160 8.106695 6.506912       6.298985 0.000000       0.000000 6.506912       6.298985 ?        ?        19.62160 8.106695 0.000000       8.106695 
1 1 1 22  22 17 o 14.63874 6.835915 -0.7290636     6.020658 0.000000       0.000000 -0.7290636     6.020658 ?        ?        14.63874 6.835915 0.000000       6.835915 
1 1 1 22  23 0  o 21.33883 5.897103 6.227935       3.168529 13.29569       6.033456 3.536389       3.723284 30.11770 8.061548 17.52699 6.522555 12.59072       10.36978 
1 1 1 22  23 1  o 20.39494 5.616726 5.667118       2.879994 7.559288       4.788166 4.594525       3.605011 23.15155 7.463174 18.82374 6.485435 4.327814       9.887358 
1 1 1 22  23 2  o 16.84865 5.708257 3.631001       2.790406 5.590795       4.303838 2.209732       3.665124 20.43588 7.084067 15.78599 6.306807 4.649893       9.484715 
1 1 1 22  23 3  o 22.16868 4.122373 6.451735       2.145069 8.979589       2.558125 0.4644123      3.936970 26.24164 4.137202 14.37375 6.193588 11.86789       7.448287 
1 1 1 22  23 4  o 31.28454 3.144135 12.38942       2.364528 13.81004       2.559166 4.101462       6.181358 33.01490 3.221867 19.90005 8.104451 13.11485       8.721385 
1 1 1 22  23 5  o 18.40333 7.693102 2.803968       5.768185 0.000000       0.000000 2.803968       5.768185 ?        ?        18.40333 7.693102 0.000000       7.693102 
1 1 1 22  23 6  o 34.92292 8.826418 19.31273       7.513851 0.000000       0.000000 19.31273       7.513851 ?        ?        34.92292 8.826418 0.000000       8.826418 
1 1 1 22  23 7  o 56.74039 5.329103 43.45061       7.282303 53.35924       10.50795 34.29362       10.10154 60.53071 7.268959 46.10101 9.312643 14.42970       11.81368 
1 1 1 22  23 8  o 39.39396 7.062673 22.81156       6.531012 23.12222       8.631113 22.39541       9.989579 37.00110 9.518247 34.71702 10.72733 2.284081       14.34129 
1 1 1 22  23 9  f 20.05778 7.348986 5.756607       4.694803 8.911960       6.543984 2.410161       6.739229 23.54803 8.668265 18.36161 8.006309 5.186419       11.79999 
1 1 1 22  23 10 o 17.82282 7.278628 3.614516       5.002566 4.499275       6.865724 2.613196       7.303991 19.65860 8.315522 18.68607 8.235582 0.9725323      11.70353 
1 1 1 22  23 11 o 29.03997 10.01899 16.56532       8.604567 0.000000       0.000000 16.56532       8.604567 ?        ?        29.03997 10.01899 0.000000       10.01899 
1 1 1 22  23 12 o 18.97762 7.945013 4.716097       6.165956 0.000000       0.000000 4.716097       6.165956 ?        ?        18.97762 7.945013 0.000000       7.945013 
1 1 1 22  23 13 o 16.65154 7.531903 1.233118       6.542400 0.000000       0.000000 1.233118       6.542400 ?        ?        16.65154 7.531903 0.000000       7.531903 
1 1 1 22  23 14 o 27.67561 7.522336 13.00217       5.204988 21.48491       8.603031 8.104206       6.537191 31.92227 9.969899 21.24939 8.444818 10.67289       13.06575 
1 1 1 22  23 15 o 16.24947 6.957904 2.894166       4.910122 9.407297       7.984630 -1.066659      6.226626 21.67305 9.054967 14.84371 6.938264 6.829336       11.40754 
1 1 1 22  23 16 o 27.09695 7.612601 13.06107       5.233381 19.03828       8.782341 9.769927       6.516800 28.16145 10.08834 22.07935 8.532001 6.082096       13.21248 
1 1 1 22  24 0  o 60.67514 3.390332 46.43275       4.992965 48.41348       8.340912 45.32662       6.233107 60.09364 5.766404 59.30861 4.342820 0.7850227      7.218829 
1 1 1 22  24 1  o 37.72287 3.999988 18.31526       3.621080 18.45403       5.747445 18.22391       4.662926 36.19762 6.764320 36.89124 5.342092 -0.6936188     8.619395 
1 1 1 22  24 2  o 13.90446 5.449448 1.801435       2.688235 1.195297       3.816005 2.398593       3.787631 14.83191 6.232470 16.05279 6.412031 -1.220875      8.941914 
1 1 1 22  24 3  o 27.62795 4.082826 9.962621       2.666126 11.00799       3.434225 8.376779       4.229834 28.56148 5.122332 24.05910 6.872889 4.502378       8.571749 
1 1 1 22  24 4  o 9.852569 4.690020 -3.388520      3.092290 0.000000       0.000000 -3.388520      3.092290 ?        ?        9.852569 4.690020 0.000000       4.690020 
1 1 1 22  24 5  o 14.02540 6.805744 -8.728485      7.273599 0.000000       0.000000 -8.728485      7.273599 ?        ?        14.02540 6.805744 0.000000       6.805744 
1 1 1 22  24 6  o 19.61209 8.115479 4.199174       6.326144 0.000000       0.000000 4.199174       6.326144 ?        ?        19.61209 8.115479 0.000000       8.115479 
1 1 1 22  24 7  o 32.58829 8.403627 17.13246       6.716805 0.000000       0.000000 17.13246       6.716805 ?        ?        32.58829 8.403627 0.000000       8.403627 
1 1 1 22  24 8  o 21.63645 8.457544 7.004806       6.461026 0.000000       0.000000 7.004806       6.461026 ?        ?        21.63645 8.457544 0.000000       8.457544 
1 1 1 22  24 9  f 13.96180 6.186467 0.1431403      4.174847 1.514559       6.503180 -0.8182837     5.445005 17.34218 7.700754 14.89152 6.788844 2.450656       10.26596 
1 1 1 22  24 10 o 22.92562 7.406049 8.448603       4.713537 13.57364       7.051183 4.308320       6.337656 27.26456 9.072500 18.92785 7.997039 8.336704       12.09392 
1 1 1 22  24 11 o 15.28816 6.624034 1.553365       4.552601 4.267627       7.285392 -0.1855819     5.831366 19.08469 8.322959 15.38189 7.017459 3.702797       10.88652 
1 1 1 22  24 12 o 18.92550 7.248375 5.464412       4.674148 3.956919       7.606589 6.378960       5.924688 18.79890 8.339088 19.99783 8.008760 -1.198923      11.56203 
1 1 1 22  24 13 o 16.40185 6.957795 2.937494       4.829783 8.438183       7.816140 -0.4601670     6.142905 21.39627 8.950530 15.23754 7.042972 6.158726       11.38927 
1 1 1 22  24 14 o 17.21333 7.030786 4.132529       4.668552 4.220371       6.943895 4.060070       6.306669 18.19491 8.024117 17.84239 7.762986 0.3525219      11.16469 
1 1 1 22  24 15 o 28.91163 7.697922 14.80060       5.519537 24.72261       8.988372 8.794167       6.993419 33.19854 10.16067 21.14630 8.617237 12.05224       13.32276 
1 1 1 22  25 0  o 56.59642 3.224427 40.41298       4.428706 33.18810       7.538243 44.22106       5.472773 48.81239 6.498605 58.79569 3.840694 -9.983303      7.548695 
1 1 1 22  25 1  f 30.35355 4.344656 12.10389       3.122127 12.23964       5.123533 12.02370       3.937673 28.78940 7.295224 29.53699 5.676832 -0.7475872     9.243739 
1 1 1 22  25 2  o 10.55932 4.695360 -0.5455331     2.426156 -0.1648609     3.481775 -0.9048236     3.382580 12.96024 5.700017 12.16239 5.466094 0.7978554      7.897366 
1 1 1 22  25 3  o 11.86511 4.625610 1.294716       1.928453 3.361228       2.376068 -2.693941      3.301059 15.96345 5.264913 10.68659 5.013368 5.276855       7.270018 
1 1 1 22  25 4  o 9.903884 4.651452 -2.439769      2.855585 0.000000       0.000000 -2.439769      2.855585 ?        ?        9.903884 4.651452 0.000000       4.651452 
1 1 1 22  25 5  o 24.51447 8.579896 9.695754       6.321367 0.000000       0.000000 9.695754       6.321367 ?        ?        24.51447 8.579896 0.000000       8.579896 
1 1 1 22  25 6  o 31.65089 6.772121 14.88947       5.065440 25.13201       7.841364 7.554207       6.635836 39.59189 8.388488 22.21251 8.602501 17.37938       12.01540 
1 1 1 22  25 7  o 58.19820 5.416353 46.91647       7.593436 46.40355       10.03785 47.60268       11.61047 54.68138 7.749823 52.99607 9.330873 1.685307       12.12951 
1 1 1 22  25 8  o 11.63829 5.528140 -3.615841      4.250130 -2.101584      6.122746 -5.024014      5.904383 14.88795 6.932724 13.31082 6.375594 1.577127       9.418644 
1 1 1 22  25 9  o 28.06227 7.419741 12.72904       5.150523 24.57841       8.647450 6.214316       6.411924 36.38706 9.610888 20.32597 8.263032 16.06109       12.67465 
1 1 1 22  25 10 o 10.52627 5.114686 -5.369636      4.144834 -1.920397      6.174312 -8.199134      5.592186 14.77510 6.907129 11.58457 5.694319 3.190531       8.951743 
1 1 1 22  25 11 o 11.95640 5.684372 -3.385731      4.513982 -7.145692      6.844898 -0.4921142     6.004762 13.31601 6.493171 15.21354 7.007295 -1.897530      9.553190 
1 1 1 22  25 12 o 24.94406 7.895594 11.07038       5.378071 27.96945       9.198070 2.292086       6.629342 37.11663 9.962002 17.09030 7.668832 20.02633       12.57189 
1 1 1 22  25 13 o 14.87176 6.634645 1.083653       4.885141 12.28147       7.871853 -5.930025      6.229931 23.87534 9.334601 12.86340 6.254929 11.01193       11.23650 
1 1 1 22  26 0  o 23.28866 5.705308 7.618383       3.211915 11.52737       5.053000 4.968174       4.160613 27.70620 7.360123 19.21554 6.936172 8.490664       10.11345 
1 1 1 22  26 1  o 34.51332 4.029157 15.54604       3.325054 14.61625       5.234815 16.17488       4.305038 31.47228 7.005777 34.42329 5.301973 -2.951008      8.785888 
1 1 1 22  26 2  o 24.45205 5.126737 8.247709       2.957085 6.689713       4.397572 9.533652       3.995220 21.32807 7.165983 25.56942 6.421540 -4.241346      9.622239 
1 1 1 22  26 3  o 9.936953 4.450277 -0.6272997     2.220639 0.5417024      2.899231 -2.286519      3.454037 12.52067 5.353554 11.17346 5.204392 1.347213       7.466341 
1 1 1 22  26 4  o 11.18736 5.006775 -0.6039243     2.805447 0.000000       0.000000 -0.6039243     2.805447 ?        ?        11.18736 5.006775 0.000000       5.006775 
1 1 1 22  26 5  o 17.30580 7.681822 1.375353       6.465389 0.000000       0.000000 1.375353       6.465389 ?        ?        17.30580 7.681822 0.000000       7.681822 
1 1 1 22  26 6  o 22.02480 7.382801 7.637932       4.667937 7.052262       6.627157 8.214604       6.576060 21.36592 8.498951 22.38705 8.591596 -1.021128      12.08502 
1 1 1 22  26 7  o 22.70561 7.674934 8.435547       5.044268 5.293277       7.181900 11.49481       7.086402 19.95140 8.474872 25.07388 9.052018 -5.122482      12.40010 
1 1 1 22  26 8  o 25.15168 9.047868 11.83579       7.072412 0.000000       0.000000 11.83579       7.072412 ?        ?        25.15168 9.047868 0.000000       9.047868 
1 1 1 22  26 9  o 20.33547 7.538149 6.663144       4.963933 11.86963       8.049641 3.468333       6.305604 24.41177 9.469078 17.95085 7.786635 6.460920       12.25949 
1 1 1 22  26 10 o 19.52344 7.507764 6.063200       5.028572 15.05086       8.409208 1.060440       6.273888 26.48985 9.812869 16.26363 7.364182 10.22622       12.26880 
1 1 1 22  26 11 o 12.59254 5.854769 -1.607804      4.340303 0.2957810E-01  7.497000 -2.433280      5.323102 16.46382 7.668175 13.36829 6.300921 3.095529       9.924843 
1 1 1 22  26 12 o 17.37324 7.660977 3.300255       6.328099 9.349442       7.916147 -7.408535      10.53260 21.68858 9.035264 15.89410 7.813072 5.794488       11.94488 
1 1 1 22  27 0  o 21.77170 5.646290 6.740263       3.020594 9.646317       4.894922 4.953102       3.838625 24.98476 7.466794 18.87209 6.679220 6.112671       10.01823 
1 1 1 22  27 1  o 36.27697 4.275936 17.42696       3.707522 24.32582       5.854304 12.80723       4.790652 41.49575 5.960255 29.26195 6.841362 12.23381       9.073526 
1 1 1 22  27 2  o 10.92849 4.800816 -0.1482171     2.463284 0.5711146      3.531455 -0.8298453     3.437659 13.48870 5.839224 12.14177 5.478883 1.346938       8.007166 
1 1 1 22  27 3  o 23.07039 4.781142 7.355244       2.599567 8.198561       3.547182 6.376846       3.820724 23.58205 6.120158 20.63478 6.668009 2.947273       9.050894 
1 1 1 22  27 4  o 13.67371 5.526196 1.731498       2.848642 0.000000       0.000000 1.731498       2.848642 ?        ?        13.67371 5.526196 0.000000       5.526196 
1 1 1 22  27 5  o 16.23390 7.375513 0.1597747      6.357984 0.000000       0.000000 0.1597747      6.357984 ?        ?        16.23390 7.375513 0.000000       7.375513 
1 1 1 22  27 6  o 28.20177 7.030755 12.54186       4.814807 15.35700       7.242132 10.31192       6.445593 28.68189 9.171976 24.04830 8.639279 4.633585       12.60009 
1 1 1 22  27 7  o 17.28933 7.554961 2.647521       6.028671 2.589503       7.289139 2.773135       10.72545 18.04551 8.073646 19.74044 9.186726 -1.694927      12.23028 
1 1 1 22  27 8  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 22  27 9  o 23.21969 8.676601 10.21970       6.601864 16.17001       8.227833 -0.5357375     11.06190 27.50532 9.774369 18.31016 8.758454 9.195162       13.12436 
1 1 1 22  27 10 o 15.32892 7.026472 0.1472749      5.938107 0.3094474      7.147607 -0.2140269     10.66859 16.34484 7.569621 18.06730 8.631127 -1.722462      11.48022 
1 1 1 22  28 0  o 30.29279 5.140447 12.73585       3.659184 17.27028       5.691623 9.541185       4.777351 33.57340 7.174441 24.58463 7.383407 8.988773       10.29501 
1 1 1 22  28 1  o 15.89123 5.820227 3.276159       2.944284 5.700322       4.372060 1.264441       3.982802 19.65279 7.108049 14.63194 6.265933 5.020844       9.475562 
1 1 1 22  28 2  o 30.47262 4.756150 12.73937       3.416530 17.80139       4.802817 7.553709       4.861117 35.22943 5.795781 21.81168 7.530327 13.41775       9.502468 
1 1 1 22  28 3  o 16.89761 5.283635 4.037621       2.415474 3.270571       3.123554 5.178691       3.809723 15.91587 5.963911 18.77127 6.653026 -2.855394      8.934818 
1 1 1 22  28 4  o 19.22624 5.979841 5.484329       3.098373 0.000000       0.000000 5.484329       3.098373 ?        ?        19.22624 5.979841 0.000000       5.979841 
1 1 1 22  28 5  o 24.21043 8.242997 10.28590       5.819511 15.86442       7.858915 3.513331       8.659232 28.33716 9.579806 19.26001 8.692847 9.077150       12.93593 
1 1 1 22  28 6  o 32.46294 9.161776 19.75044       7.562189 0.000000       0.000000 19.75044       7.562189 ?        ?        32.46294 9.161776 0.000000       9.161776 
1 1 1 22  28 7  o 16.57608 6.899669 3.194194       4.610660 10.31870       6.643654 -3.425314      6.403870 23.41871 8.713255 14.19908 6.756274 9.219633       11.02579 
1 1 1 22  29 0  o 11.72747 5.176326 -0.8646280E-01 2.895528 1.077247       4.414341 -0.9652550     3.836071 14.89896 6.488377 12.56556 5.716733 2.333405       8.647547 
1 1 1 22  29 1  o 18.53535 5.671117 5.000054       2.800381 5.069958       4.266721 4.947154       3.711703 18.69210 6.977201 18.41808 6.562886 0.2740173      9.578769 
1 1 1 22  29 2  o 11.17589 4.829690 0.2921875      2.407631 -0.3060520     3.476686 0.8434502      3.337393 12.44625 5.571658 13.25956 5.707882 -0.8133059     7.976421 
1 1 1 22  29 3  o 25.45283 4.443906 8.905438       2.656133 9.760739       3.590096 7.871079       3.948046 25.64221 5.872039 22.36685 6.710825 3.275366       8.917175 
1 1 1 22  29 4  o 18.17165 7.956949 3.470736       6.717752 0.000000       0.000000 3.470736       6.717752 ?        ?        18.17165 7.956949 0.000000       7.956949 
1 1 1 22  29 5  o 53.55706 5.099706 40.32609       6.575525 54.78114       10.41581 30.74777       8.478674 58.29034 7.506728 42.05241 8.564992 16.23793       11.38903 
1 1 1 22  30 0  o 11.67246 5.074670 0.2830213      2.690711 -4.677530      4.289777 3.500472       3.454822 11.08931 5.343140 16.33951 6.238135 -5.250200      8.213615 
1 1 1 22  30 1  o 17.41392 5.858743 4.397013       2.939424 1.247078       4.172217 7.501328       4.141894 14.61989 6.337851 21.70910 6.935697 -7.089212      9.395331 
1 1 1 23  0  0  o 182.2566 4.073189 407.0450       18.07024 407.0450       18.07024 407.0450       18.07024 182.2566 4.073189 182.2566 4.073189 0.000000       0.000000 
1 1 1 23  0  1  o 95.27507 3.456515 111.3941       8.001166 111.3941       8.001166 111.3941       8.001166 95.27507 3.456515 95.27507 3.456515 0.000000       0.000000 
1 1 1 23  0  2  o 11.65118 6.966003 1.778287       3.511694 1.778287       3.511694 1.778287       3.511694 11.65118 6.966003 11.65118 6.966003 0.000000       0.000000 
1 1 1 23  0  3  o 34.34782 5.732392 15.64559       4.396791 15.64559       4.396791 15.64559       4.396791 34.34782 5.732392 34.34782 5.732392 0.000000       0.000000 
1 1 1 23  0  4  f 81.09275 3.947388 81.10905       7.758270 81.10905       7.758270 81.10905       7.758270 81.09275 3.947388 81.09275 3.947388 0.000000       0.000000 
1 1 1 23  0  5  o 42.71480 4.934737 23.29129       4.958540 23.29129       4.958540 23.29129       4.958540 42.71480 4.934737 42.71480 4.934737 0.000000       0.000000 
1 1 1 23  0  6  o 44.88350 4.824646 25.60008       5.123140 25.60008       5.123140 25.60008       5.123140 44.88350 4.824646 44.88350 4.824646 0.000000       0.000000 
1 1 1 23  0  7  o 99.56183 4.095307 122.2799       9.897786 122.2799       9.897786 122.2799       9.897786 99.56183 4.095307 99.56183 4.095307 0.000000       0.000000 
1 1 1 23  0  8  f 66.74521 6.082756 56.57223       9.694963 56.57223       9.694963 56.57223       9.694963 66.74521 6.082756 66.74521 6.082756 0.000000       0.000000 
1 1 1 23  0  9  o 9.390811 6.361170 -2.029703      4.322993 -2.029703      4.322993 -2.029703      4.322993 9.390811 6.361170 9.390811 6.361170 0.000000       0.000000 
1 1 1 23  0  10 o 12.89952 7.791428 2.179195       4.483336 2.179195       4.483336 2.179195       4.483336 12.89952 7.791428 12.89952 7.791428 0.000000       0.000000 
1 1 1 23  0  11 o 58.36091 4.949438 43.07788       6.918089 43.07788       6.918089 43.07788       6.918089 58.36091 4.949438 58.36091 4.949438 0.000000       0.000000 
1 1 1 23  0  12 o 45.38358 5.817486 26.92168       6.144491 26.92168       6.144491 26.92168       6.144491 45.38358 5.817486 45.38358 5.817486 0.000000       0.000000 
1 1 1 23  0  13 o 6.971275 4.999506 -6.296577      4.010219 -6.296577      4.010219 -6.296577      4.010219 6.971275 4.999506 6.971275 4.999506 0.000000       0.000000 
1 1 1 23  0  14 o 10.91543 7.063019 0.2219119      4.419313 0.2219119      4.419313 0.2219119      4.419313 10.91543 7.063019 10.91543 7.063019 0.000000       0.000000 
1 1 1 23  0  15 o 27.68966 8.707621 12.39350       5.159131 12.39350       5.159131 12.39350       5.159131 27.68966 8.707621 27.68966 8.707621 0.000000       0.000000 
1 1 1 23  0  16 o 16.04834 8.651320 5.079388       4.693532 5.079388       4.693532 5.079388       4.693532 16.04834 8.651320 16.04834 8.651320 0.000000       0.000000 
1 1 1 23  0  17 o 14.65470 8.322327 4.097481       4.609592 4.097481       4.609592 4.097481       4.609592 14.65470 8.322327 14.65470 8.322327 0.000000       0.000000 
1 1 1 23  0  18 o 20.80197 9.575961 8.752286       5.324465 8.752286       5.324465 8.752286       5.324465 20.80197 9.575961 20.80197 9.575961 0.000000       0.000000 
1 1 1 23  0  19 o 40.25552 7.049321 23.12801       6.281311 23.12801       6.281311 23.12801       6.281311 40.25552 7.049321 40.25552 7.049321 0.000000       0.000000 
1 1 1 23  0  20 o 39.96227 7.123906 23.08637       6.281002 23.08637       6.281002 23.08637       6.281002 39.96227 7.123906 39.96227 7.123906 0.000000       0.000000 
1 1 1 23  0  21 o 15.89604 8.752705 5.552952       4.909002 5.552952       4.909002 5.552952       4.909002 15.89604 8.752705 15.89604 8.752705 0.000000       0.000000 
1 1 1 23  0  22 o 10.69908 7.047386 0.3831474      4.691857 0.3831474      4.691857 0.3831474      4.691857 10.69908 7.047386 10.69908 7.047386 0.000000       0.000000 
1 1 1 23  0  23 o 17.93673 7.969475 6.601029       3.681333 6.601029       3.681333 6.601029       3.681333 17.93673 7.969475 17.93673 7.969475 0.000000       0.000000 
1 1 1 23  0  24 o 10.13659 6.474486 1.203659       3.562475 1.203659       3.562475 1.203659       3.562475 10.13659 6.474486 10.13659 6.474486 0.000000       0.000000 
1 1 1 23  0  25 o 9.440289 6.162713 0.6076515      3.469542 0.6076515      3.469542 0.6076515      3.469542 9.440289 6.162713 9.440289 6.162713 0.000000       0.000000 
1 1 1 23  1  0  o 73.55141 2.813970 66.27747       5.034367 68.37455       6.196628 62.20570       8.634542 74.61196 3.417161 70.82302 5.035830 3.788940       6.085768 
1 1 1 23  1  1  o 53.76880 2.895033 35.48777       3.779336 36.06276       5.004154 34.72438       5.766032 54.05724 3.823419 52.90611 4.515463 1.151134       5.916750 
1 1 1 23  1  2  f 105.4239 2.460006 135.8979       6.319921 127.8103       8.689954 144.9785       9.207957 101.9965 3.501391 108.6432 3.482458 -6.646751      4.938345 
1 1 1 23  1  3  o 28.68570 4.368126 10.36808       2.957227 14.77524       4.088164 5.530984       4.282932 34.20057 5.057533 21.39750 7.069076 12.80306       8.691978 
1 1 1 23  1  4  f 115.4222 2.850632 163.2156       8.018009 169.7155       11.35764 156.7578       11.32080 117.3300 3.978063 112.7058 4.128854 4.624191       5.733448 
1 1 1 23  1  5  o 76.65742 2.787626 72.10155       5.198775 70.30573       7.129819 74.14028       7.596729 75.44671 3.891094 77.44190 4.039415 -1.995193      5.608697 
1 1 1 23  1  6  o 34.07007 3.973411 14.50778       3.237073 17.32023       4.455087 11.36227       4.711493 37.00129 5.074394 29.45749 6.713359 7.543791       8.415382 
1 1 1 23  1  7  o 93.64189 3.261641 107.9790       7.431540 112.5923       11.98842 105.0998       9.470717 94.86117 5.206017 92.05263 4.233259 2.808540       6.709925 
1 1 1 23  1  8  o 46.04551 3.648294 26.33055       4.060238 37.39278       5.909687 16.44020       5.587903 54.68664 4.473587 35.43206 6.717432 19.25458       8.070743 
1 1 1 23  1  9  o 12.55754 5.554377 -0.8908916     3.350782 -4.370732      4.034153 6.851037       6.017239 11.53957 5.453003 23.80002 8.367807 -12.26044      9.987765 
1 1 1 23  1  10 o 14.34658 5.933387 0.9182109      3.379036 1.873047       5.359830 0.2883864      4.353079 18.19466 7.493639 15.36860 6.565299 2.826060       9.962820 
1 1 1 23  1  11 o 24.63503 6.599228 8.120296       4.041141 7.567679       6.197541 8.529046       5.330115 24.41833 8.498816 25.24567 7.841736 -0.8273449     11.56385 
1 1 1 23  1  12 o 34.71602 5.430713 15.68397       4.443878 17.70781       7.182325 14.42864       5.656607 35.54949 8.421093 32.49822 7.319177 3.051270       11.15729 
1 1 1 23  1  13 o 27.46057 6.508890 10.25019       4.288774 9.655816       7.270877 10.56734       5.311121 26.54331 9.207290 27.53716 7.644408 -0.9938469     11.96709 
1 1 1 23  1  14 o 50.52952 4.402490 32.58905       5.366934 37.50955       9.394735 30.20531       6.538965 52.03883 7.635317 47.90532 5.713808 4.133518       9.536544 
1 1 1 23  1  15 o 13.65798 5.988173 -0.2742535     3.815557 -1.256380      6.810593 0.1750145      4.606318 17.18302 7.736449 15.26158 6.637351 1.921439       10.19348 
1 1 1 23  1  16 o 16.08362 6.525070 2.139415       3.988826 -5.783560      6.994009 5.958796       4.855999 15.03707 7.127693 21.06836 7.506736 -6.031287      10.35157 
1 1 1 23  1  17 o 27.73817 6.531005 11.00715       4.341053 11.72180       7.757929 10.68139       5.237835 26.97408 9.499909 26.66991 7.657486 0.3041706      12.20186 
1 1 1 23  1  18 o 28.39537 6.582550 11.73066       4.465956 26.12135       8.644400 6.491261       5.215966 40.18832 9.045644 21.26026 7.752984 18.92806       11.91354 
1 1 1 23  1  19 o 49.61334 4.910381 33.17691       5.858976 29.11559       10.38775 35.07171       7.095287 39.83825 10.53895 49.95063 5.945528 -10.11238      12.10036 
1 1 1 23  1  20 o 15.53088 6.179414 2.641529       3.504255 6.581574       4.611084 -2.744950      5.391442 20.76178 7.322968 13.74948 6.436345 7.012299       9.749482 
1 1 1 23  1  21 o 11.99543 5.370455 -0.3609785     3.231113 -1.170324      4.378031 0.6072323      4.788472 13.12783 6.023378 14.83731 6.597096 -1.709473      8.933239 
1 1 1 23  1  22 o 25.14168 5.200644 9.158162       3.081106 10.46588       3.771582 6.534438       5.342266 26.21870 6.029056 19.92478 7.718042 6.293922       9.793757 
1 1 1 23  1  23 o 11.95915 5.232728 0.4776411      2.900486 -1.130923      3.284491 6.175413       6.181607 11.21844 5.172677 19.13630 7.979091 -7.917865      9.509073 
1 1 1 23  1  24 o 14.53630 5.525881 2.921702       2.703588 2.362046       3.669926 3.585895       3.998009 14.52469 6.108216 15.96210 6.511387 -1.437408      8.927959 
1 1 1 23  1  25 f 12.65207 5.264709 1.624085       2.683261 -3.331025      3.585674 7.930469       4.045147 10.15958 4.892600 20.96102 6.867332 -10.80143      8.431950 
1 1 1 23  2  0  o 36.30127 3.470746 16.30081       3.032959 15.72692       3.974357 17.10108       4.693220 35.42249 4.721661 36.81742 5.390647 -1.394939      7.166111 
1 1 1 23  2  1  o 155.2754 2.995343 295.2238       11.33405 286.4567       14.10213 311.2192       19.04823 152.7273 3.789064 158.6871 4.931787 -5.959793      6.219287 
1 1 1 23  2  2  o 86.15316 2.776031 90.94144       5.820553 90.91233       7.086497 91.00182       10.20411 86.02314 3.387115 85.68060 4.907691 0.3425446      5.963051 
1 1 1 23  2  3  o 93.64925 3.003878 107.5785       6.846372 110.1577       8.797277 103.6174       10.90238 94.57123 3.825166 91.39605 4.913118 3.175179       6.226606 
1 1 1 23  2  4  o 16.69934 5.916964 3.051971       3.013186 0.5931733      3.363687 13.03995       6.779426 14.11059 5.884893 31.40807 8.604794 -17.29749      10.42470 
1 1 1 23  2  5  o 91.08176 2.799431 101.7621       6.206138 107.3999       8.569301 95.54316       9.000152 93.31982 3.776010 87.87791 4.215044 5.441910       5.659050 
1 1 1 23  2  6  o 68.17667 3.237192 57.24044       5.362879 60.73182       8.322091 54.76089       7.013268 69.75298 4.927628 66.39378 4.358786 3.359192       6.578794 
1 1 1 23  2  7  o 25.14923 7.215444 8.276626       4.652235 0.000000       0.000000 8.276626       4.652235 ?        ?        25.14923 7.215444 0.000000       7.215444 
1 1 1 23  2  8  o 37.49723 4.503756 17.71336       4.033113 22.43023       6.247436 14.34298       5.280969 41.65494 6.355542 33.01157 6.791378 8.643364       9.301383 
1 1 1 23  2  9  o 20.36062 5.929510 5.366219       3.120123 2.048774       3.977138 10.67589       5.031560 16.55936 6.584947 28.25275 7.267085 -11.69339      9.806735 
1 1 1 23  2  10 o 63.31453 3.584538 49.78569       5.508014 50.17983       6.492898 48.77402       10.40241 63.33184 4.231350 61.01112 7.130970 2.320728       8.291867 
1 1 1 23  2  11 o 12.23771 5.364750 -0.5208018     3.061518 1.677870       4.085449 -3.336858      4.623600 16.21137 6.593751 13.16863 6.094973 3.042745       8.979212 
1 1 1 23  2  12 o 18.31454 6.218155 4.126523       3.311329 5.366155       4.250174 2.211844       5.282119 20.66694 7.044272 18.21029 7.462960 2.456659       10.26243 
1 1 1 23  2  13 o 30.81434 4.851696 12.32236       3.522865 13.04757       4.560154 11.24890       5.548029 31.16712 6.222125 28.33229 7.793004 2.834833       9.972249 
1 1 1 23  2  14 o 23.95776 6.046739 7.810063       3.529895 9.219598       4.693954 5.975430       5.355198 25.68778 7.207070 21.73320 7.865886 3.954582       10.66837 
1 1 1 23  2  15 o 46.44283 3.933739 27.44355       4.410216 26.14927       5.875917 29.11329       6.674010 44.42387 5.548432 46.58501 6.019597 -2.161140      8.186614 
1 1 1 23  2  16 o 21.59790 6.388196 6.511801       3.597592 4.947722       4.853449 8.419161       5.359661 19.89252 7.438222 24.08421 7.905570 -4.191698      10.85473 
1 1 1 23  2  17 o 56.80790 3.617559 41.14645       4.981938 40.44142       6.629311 42.06127       7.551465 55.24675 4.977400 55.73236 5.637606 -0.4856071     7.520446 
1 1 1 23  2  18 o 40.79213 4.288904 21.84373       4.199722 17.70596       5.636784 27.00662       6.296421 34.80766 6.889331 43.95575 6.037513 -9.148083      9.160482 
1 1 1 23  2  19 o 11.87858 5.387037 -1.066774      3.373130 -4.295048      4.325890 3.940690       5.387647 11.54003 5.508280 18.53786 7.560031 -6.997827      9.353888 
1 1 1 23  2  20 o 28.17926 6.461113 11.86969       4.341989 10.22487       5.239818 15.47429       7.756831 25.05513 7.773804 28.91967 9.511500 -3.864546      12.28416 
1 1 1 23  2  21 o 9.812112 4.600567 -2.062521      2.773232 -3.077704      3.091851 2.115499       6.272367 9.803999 4.673290 17.15852 7.593937 -7.354525      8.916699 
1 1 1 23  2  22 o 16.89641 5.780512 4.187696       2.862495 6.023211       3.493174 0.4355664      4.994362 19.61181 6.378796 14.68108 6.616190 4.930726       9.190376 
1 1 1 23  2  23 o 14.84587 5.986453 2.716827       3.334602 5.361390       4.524090 -0.4289767     4.934238 18.24094 7.092305 13.81195 6.358214 4.428990       9.525107 
1 1 1 23  2  24 o 24.73897 7.118088 10.81758       4.521371 4.490253       7.591814 14.29535       5.628415 17.83974 8.087010 27.41909 7.957768 -9.579346      11.34574 
1 1 1 23  2  25 o 15.77267 6.105336 3.823443       3.341171 11.09130       8.190985 2.372774       3.659461 21.01767 8.992860 14.31186 6.063175 6.705810       10.84590 
1 1 1 23  3  0  o 64.70080 2.579980 51.26636       4.059667 50.08094       5.561362 52.61858       5.939772 63.79495 3.591836 65.36873 3.744418 -1.573780      5.188637 
1 1 1 23  3  1  o 120.7280 2.518016 178.2250       7.408029 178.0244       10.34240 178.4363       10.61603 120.4035 3.528703 120.5186 3.618797 -0.1150894     5.054447 
1 1 1 23  3  2  o 10.76657 4.712029 -0.5076927     2.353185 -0.9879167E-01 3.034590 -1.124453      3.726911 12.75294 5.465518 13.22588 5.853532 -0.4729347     8.008478 
1 1 1 23  3  3  o 16.52215 5.601892 3.164532       2.687421 4.147578       3.781116 2.160973       3.820362 19.09835 6.638857 16.62642 6.502218 2.471935       9.292645 
1 1 1 23  3  4  o 148.8385 3.572921 272.3220       12.95909 265.4063       20.57482 276.8697       16.68448 145.7804 5.803226 149.5845 4.582500 -3.804108      7.394372 
1 1 1 23  3  5  o 17.22241 6.271467 3.100004       3.411236 2.358355       3.982483 5.143317       6.610316 17.04559 6.646663 22.83244 8.649614 -5.786850      10.90843 
1 1 1 23  3  6  o 13.20420 5.926396 -1.667090      3.961554 -1.286337      5.431352 -2.099920      5.790883 16.03560 7.083144 16.06263 7.190639 -0.2702904E-01 10.09338 
1 1 1 23  3  7  o 33.61209 4.557208 14.26702       3.636697 15.94627       4.189082 9.129432       7.327252 35.45238 4.986447 27.03101 9.248338 8.421377       10.50697 
1 1 1 23  3  8  o 54.93384 3.593064 37.40746       4.783556 37.91159       5.553543 35.95815       9.416287 55.14482 4.163411 52.35342 7.602825 2.791405       8.668157 
1 1 1 23  3  9  o 60.84570 3.566797 45.91145       5.265451 47.10357       6.153743 42.65309       10.17371 61.45115 4.133394 56.97419 7.510384 4.476959       8.572679 
1 1 1 23  3  10 o 12.90184 5.516616 0.8928119E-01  3.078615 2.092414       3.582344 -5.569031      6.020823 15.99225 6.283846 14.35186 6.744774 1.640388       9.218390 
1 1 1 23  3  11 f 18.30362 6.571027 3.830509       3.728132 3.830509       3.728132 0.000000       0.000000 18.30362 6.571027 ?        ?        0.000000       6.571027 
1 1 1 23  3  12 o 14.89863 5.903220 1.755720       3.185336 2.539607       3.668035 -0.6485532     6.423896 16.52770 6.397167 17.48862 7.715016 -0.9609261     10.02224 
1 1 1 23  3  13 o 22.80412 6.215411 7.026775       3.547725 9.014222       4.195254 2.037611       6.646981 25.67474 6.652034 19.43986 8.200395 6.234886       10.55917 
1 1 1 23  3  14 o 13.88254 5.790762 0.8885135      3.257746 2.126245       3.919670 -1.876423      5.858398 16.20115 6.505260 15.72901 7.119720 0.4721451      9.644109 
1 1 1 23  3  15 o 12.91925 5.624879 -0.1016491     3.315891 0.8758932      3.979821 -2.320590      5.996097 14.92362 6.322704 15.52832 7.096312 -0.6046982     9.504432 
1 1 1 23  3  16 o 27.93544 6.016020 10.81115       3.974280 10.09159       4.742130 12.50926       7.284919 26.39292 7.182745 28.28301 9.212616 -1.890089      11.68179 
1 1 1 23  3  17 o 14.36296 5.954328 1.374240       3.414130 -1.540334      3.979521 9.501187       6.645183 12.74366 5.807399 24.83917 8.788313 -12.09551      10.53377 
1 1 1 23  3  18 o 14.88218 5.946808 2.110300       3.259251 5.018800       4.216257 -2.208360      5.137681 19.19658 6.974978 13.97167 6.451880 5.224909       9.501426 
1 1 1 23  3  19 o 12.96516 5.589566 0.5067362      3.209779 -2.484490      4.274863 4.372581       4.859816 12.42715 5.788848 18.59332 7.315026 -6.166166      9.328470 
1 1 1 23  3  20 o 10.26950 4.850387 -2.733085      3.184339 -5.570856      4.109835 1.529424       5.036958 10.49135 5.096641 15.98305 6.946007 -5.491703      8.615263 
1 1 1 23  3  21 o 10.66066 4.993703 -2.188693      3.254400 -2.584493      4.215964 -1.605116      5.119268 12.02182 5.647949 13.79381 6.394432 -1.771990      8.531593 
1 1 1 23  3  22 o 11.40984 5.206149 -0.8709751     3.211137 0.5948960      4.246815 -2.827876      4.906817 13.97407 6.213058 12.68704 6.000834 1.287030       8.637830 
1 1 1 23  3  23 o 8.889068 4.276304 -3.084301      2.722606 -5.279882      3.216213 2.467557       5.114336 8.771795 4.313045 15.86080 6.943958 -7.089005      8.174406 
1 1 1 23  3  24 o 10.74009 4.892420 -0.5904102     2.820785 -0.8148988     3.355799 -0.4987915E-01 5.207258 11.42140 5.252563 14.05308 6.491586 -2.631680      8.350455 
1 1 1 23  3  25 o 10.87969 4.967577 -0.5100446     2.929919 -1.166825      3.585250 0.8104755      5.083722 11.38337 5.302218 14.20908 6.508751 -2.825710      8.395080 
1 1 1 23  4  0  o 137.4265 2.588336 230.9566       8.668166 230.9119       12.08845 231.0040       12.43623 137.1280 3.620665 137.1242 3.725125 0.3784180E-02  5.194783 
1 1 1 23  4  1  o 100.1130 2.704557 122.7261       6.592113 113.9804       9.886930 129.7259       8.845134 96.13132 4.230829 102.7518 3.537750 -6.620499      5.515033 
1 1 1 23  4  2  f 45.64618 3.412660 25.70922       3.768589 24.82824       5.686688 26.39910       5.032288 44.44487 5.358516 46.03925 4.544607 -1.594376      7.026176 
1 1 1 23  4  3  o 99.22417 2.617008 120.5882       6.322361 126.1813       9.246126 115.6767       8.664525 101.2246 3.754837 96.93560 3.674620 4.288986       5.253726 
1 1 1 23  4  4  o 35.02668 4.268629 15.35751       3.568377 16.58289       4.910190 13.98601       5.194714 36.04359 5.786022 32.79766 6.725479 3.245930       8.871872 
1 1 1 23  4  5  o 90.65437 3.441518 101.1935       7.589017 102.8124       12.82314 100.3208       9.414851 90.49580 5.846013 89.99684 4.305380 0.4989624      7.260314 
1 1 1 23  4  6  o 44.04710 3.340193 23.99734       3.558569 24.56627       4.515508 23.06487       5.780872 44.37372 4.226847 42.57187 5.716654 1.801846       7.109597 
1 1 1 23  4  7  o 48.64219 3.268923 29.24733       3.852342 32.95631       4.929577 23.42891       6.174255 51.48210 3.959720 42.72147 6.103967 8.760628       7.275836 
1 1 1 23  4  8  o 56.33833 3.154052 39.19683       4.312922 39.95311       5.442580 37.92030       7.070952 56.66340 3.966595 54.72330 5.371499 1.940102       6.677341 
1 1 1 23  4  9  o 15.90299 5.689787 2.786214       2.792661 3.804110       3.374116 0.5722771      4.976122 18.03971 6.271353 16.59742 7.052444 1.442286       9.437522 
1 1 1 23  4  10 o 45.03351 3.463973 25.24156       3.772234 23.93509       4.675390 27.67824       6.385102 43.54158 4.469729 46.34320 5.779108 -2.801620      7.305927 
1 1 1 23  4  11 f 24.31533 5.378523 7.782486       3.102389 7.915184       3.740911 7.490194       5.552045 24.33396 6.269726 23.99117 8.051768 0.3427887      10.20492 
1 1 1 23  4  12 o 63.71106 3.609639 50.69384       5.581287 52.48611       6.318557 44.33020       11.90607 64.63802 4.031451 56.18352 8.999764 8.454494       9.861458 
1 1 1 23  4  13 o 27.36204 5.183855 9.866360       3.330010 15.30015       4.180818 0.4371596      5.507409 34.23781 5.172036 16.89173 7.302225 17.34608       8.948320 
1 1 1 23  4  14 o 40.40564 4.028801 20.78562       3.914107 26.41107       5.041728 12.25161       6.209798 45.29299 4.633059 29.04015 8.337667 16.25284       9.538445 
1 1 1 23  4  15 o 21.04799 5.996984 6.069981       3.224555 6.105554       4.105004 6.012664       5.210655 21.15460 6.917190 21.43462 7.758841 -0.2800274     10.39457 
1 1 1 23  4  16 o 15.99874 5.951309 2.939495       3.099045 3.947873       3.894838 1.199449       5.116323 18.01836 6.677600 16.53952 7.092709 1.478836       9.741502 
1 1 1 23  4  17 o 33.12250 4.875278 14.67037       3.817527 18.76030       4.878712 8.211476       6.130925 37.05119 5.576079 23.44378 8.425307 13.60741       10.10339 
1 1 1 23  4  18 o 11.95460 5.325810 -0.5225659     3.136488 -1.896843      3.940347 1.853963       5.181659 12.32930 5.677932 16.75717 7.160823 -4.427873      9.138725 
1 1 1 23  4  19 o 16.81994 5.710358 3.855365       2.792577 2.554698       3.268333 7.373032       5.374903 15.30322 6.005422 21.89680 7.886294 -6.593579      9.912554 
1 1 1 23  4  20 o 12.43626 5.281336 0.7628642      2.787919 -0.5342366     3.305742 3.957894       5.188233 12.06711 5.415044 18.09035 7.403069 -6.023239      9.172138 
1 1 1 23  4  21 o 10.83960 4.885935 -0.6220258     2.725227 -3.258208      3.178382 6.696382       5.295740 9.851138 4.707447 20.40771 7.739427 -10.55657      9.058630 
1 1 1 23  4  22 o 15.78985 5.672827 3.520208       2.779169 2.379040       3.229421 6.778214       5.456645 14.54442 5.881850 20.04898 7.790799 -5.504560      9.761799 
1 1 1 23  4  23 o 12.66154 5.345973 1.277436       2.829139 1.410395       3.338979 0.9390289      5.326902 13.40912 5.739612 14.95430 6.777051 -1.545179      8.880966 
1 1 1 23  4  24 o 17.78927 6.049896 5.106581       3.134695 5.606582       3.697708 3.829348       5.909926 18.28691 6.546647 16.87385 7.423552 1.413063       9.897864 
1 1 1 23  4  25 o 13.23408 5.608092 1.761470       3.132158 2.484090       3.749927 0.9402592E-01  5.696306 14.45264 6.130873 14.25899 6.655496 0.1936522      9.048935 
1 1 1 23  5  0  o 96.09800 2.737859 113.0895       6.404994 117.4932       9.941745 109.9648       8.374588 97.62701 4.188591 94.57718 3.640430 3.049828       5.549507 
1 1 1 23  5  1  o 90.16092 2.731972 99.58134       5.995556 102.3249       9.231118 97.57952       7.885085 91.07359 4.170422 89.06389 3.640701 2.009697       5.535984 
1 1 1 23  5  2  o 21.54826 5.450948 5.985428       2.863941 8.806801       3.629169 1.328016       4.662827 26.10442 5.850187 17.01859 6.997268 9.085833       9.120661 
1 1 1 23  5  3  o 60.06860 3.321568 44.42916       4.843204 43.49976       6.945171 45.30898       6.757339 59.08185 4.866960 60.36877 4.628630 -1.286926      6.716510 
1 1 1 23  5  4  o 98.55406 3.417112 119.5067       8.194308 110.8461       13.69966 124.3313       10.22509 93.95552 6.015038 100.2817 4.193426 -6.326180      7.332497 
1 1 1 23  5  5  o 60.96481 2.958354 45.70942       4.381946 51.14433       5.680944 37.72589       6.885284 64.34737 3.637692 54.81638 5.217203 9.530994       6.360189 
1 1 1 23  5  6  o 18.21540 5.475335 4.198312       2.626365 3.763872       3.119773 5.255270       4.866164 17.83968 6.035807 21.34307 7.523242 -3.503389      9.645212 
1 1 1 23  5  7  f 93.62088 2.876804 107.7596       6.555464 114.1574       8.612535 98.94804       10.10754 96.08942 3.684894 89.05330 4.673934 7.036118       5.951815 
1 1 1 23  5  8  f 51.16337 3.157051 32.35892       3.917025 33.54989       4.834713 30.08370       6.682402 51.92190 3.848420 48.51842 5.764380 3.403484       6.930975 
1 1 1 23  5  9  o 37.24389 3.753147 17.35396       3.359922 17.38334       4.107690 17.29457       5.840534 37.02078 4.655926 36.13752 6.883499 0.8832550      8.310247 
1 1 1 23  5  10 o 31.79450 4.275034 12.83127       3.228427 14.46204       3.893079 9.240343       5.776986 33.58926 4.900455 26.22379 8.166759 7.365471       9.524201 
1 1 1 23  5  11 o 48.81690 3.358397 29.67162       3.970855 30.84832       4.925734 27.48758       6.710719 49.51741 4.119309 45.84169 6.163209 3.675728       7.413086 
1 1 1 23  5  12 o 20.20687 5.674792 5.412838       2.908714 6.838971       3.453565 1.932099       5.395398 22.57211 6.124148 18.03195 7.481155 4.540161       9.668137 
1 1 1 23  5  13 o 51.18667 3.810345 33.01617       4.718791 35.41507       5.233917 22.59731       10.90764 52.89077 4.092609 37.82663 11.10634 15.06414       11.83640 
1 1 1 23  5  14 o 11.06590 4.942533 -0.8446331     2.719402 -1.558976      3.202077 1.003649       5.150658 11.48613 5.224613 16.71340 7.140672 -5.227275      8.847925 
1 1 1 23  5  15 o 10.08187 4.655544 -1.821643      2.674878 -2.622774      3.160882 0.1993958      5.020465 10.57253 4.942350 15.77614 6.894032 -5.203610      8.482600 
1 1 1 23  5  16 o 21.86778 5.842276 6.654747       3.172487 3.773690       3.735924 14.10427       6.007396 17.64414 6.539762 30.63286 7.971896 -12.98873      10.31114 
1 1 1 23  5  17 f 18.35921 6.079350 4.607849       3.167047 2.984000       3.858118 7.962716       5.545496 16.62930 6.525114 23.07875 8.038895 -6.449442      10.35379 
1 1 1 23  5  18 o 46.44401 3.816938 27.91986       4.281884 27.02549       5.318303 29.56792       7.219388 44.81819 4.951963 45.17508 6.765859 -0.3568916     8.384437 
1 1 1 23  5  19 o 11.08418 4.890656 -0.2291916     2.582584 -1.495692      2.976830 3.624870       5.192909 10.76623 4.949738 18.01456 7.393092 -7.248329      8.897062 
1 1 1 23  5  20 o 12.88032 5.278041 1.345514       2.641621 2.911264       3.059597 -3.239542      5.235707 15.40707 5.873312 13.22891 6.239431 2.178159       8.568914 
1 1 1 23  5  21 o 11.57548 4.998804 0.4222946      2.575561 2.676349       3.014960 -5.664612      4.954476 14.87826 5.788399 11.60228 5.626894 3.275977       8.072639 
1 1 1 23  5  22 o 26.98520 4.889600 10.39356       3.097040 7.741965       3.547945 18.88186       6.347955 22.12056 6.286534 32.81870 8.009038 -10.69814      10.18161 
1 1 1 23  5  23 o 14.06930 5.621557 2.398840       2.912256 2.579313       3.373454 1.870846       5.770102 14.65009 5.979307 15.81588 7.120948 -1.165796      9.298388 
1 1 1 23  5  24 o 12.64966 5.373006 1.335186       2.886497 1.433650       3.402595 1.082430       5.451564 13.32172 5.749218 14.85242 6.779417 -1.530698      8.888983 
1 1 1 23  5  25 o 10.82546 5.016112 -1.003849      3.144839 0.4767469E-01  3.316046 -10.40545      9.915437 11.86431 5.364795 13.93592 6.971472 -2.071611      8.796729 
1 1 1 23  6  0  o 117.6411 2.662740 169.3340       7.633506 181.3952       11.48618 159.7930       10.21593 121.4114 3.887229 114.0038 3.682076 7.407669       5.354272 
1 1 1 23  6  1  o 50.13879 3.172682 30.94448       3.856591 28.21204       4.956972 35.13495       6.138646 47.65339 4.315341 53.11132 4.794533 -5.457928      6.450560 
1 1 1 23  6  2  o 68.86348 2.908786 58.20880       4.870321 63.32359       6.462722 51.48610       7.409239 71.66832 3.713091 64.35224 4.758356 7.316078       6.035644 
1 1 1 23  6  3  o 26.84008 5.780373 9.314858       3.668894 8.072778       6.128934 10.00852       4.580196 25.53385 8.457191 27.67073 6.833523 -2.136885      10.87295 
1 1 1 23  6  4  o 108.0086 2.864735 143.1384       7.533476 142.1958       10.08165 144.3303       11.33626 107.3481 3.860188 107.9826 4.316740 -0.6344986     5.790966 
1 1 1 23  6  5  o 68.71317 2.866977 58.02565       4.790106 62.97439       6.203327 50.71692       7.538729 71.42162 3.575545 63.70131 4.893874 7.720310       6.060902 
1 1 1 23  6  6  o 38.86002 3.552791 18.76410       3.327229 20.19831       4.051929 15.79508       5.829908 40.18015 4.200199 34.62314 7.146702 5.557007       8.289574 
1 1 1 23  6  7  o 87.06316 2.861028 93.23146       6.061812 105.3455       8.065506 77.50599       9.189429 92.30701 3.592450 78.68896 4.815298 13.61806       6.007728 
1 1 1 23  6  8  o 43.66713 3.446910 23.68520       3.638202 25.30693       4.441771 20.37907       6.342003 44.97390 4.097799 39.38117 6.857506 5.592728       7.988576 
1 1 1 23  6  9  o 11.87808 5.011181 0.2800972      2.482671 -0.7990924     2.874677 3.447433       4.924784 11.60226 5.137623 19.16629 7.414111 -7.564035      9.020211 
1 1 1 23  6  10 o 19.29596 6.789844 4.414913       3.962392 3.922721       6.022922 4.790497       5.261316 20.65829 8.138565 20.82227 7.752662 -0.1639843     11.24011 
1 1 1 23  6  11 o 42.38982 4.938633 23.01294       5.006139 30.82893       7.854688 17.66610       6.496591 48.13494 6.892751 35.87247 7.664411 12.26247       10.30792 
1 1 1 23  6  12 o 52.08747 4.385218 34.43059       5.514577 44.15979       8.201116 26.40106       7.450402 58.16523 5.865986 44.11220 7.177342 14.05303       9.269522 
1 1 1 23  6  13 o 14.43982 6.132334 0.6027979      3.758900 5.090054       5.345341 -3.786902      5.286916 20.80020 7.800202 13.83575 6.442559 6.964445       10.11680 
1 1 1 23  6  14 o 38.46260 4.272586 19.00319       3.937167 19.33549       4.235210 16.88835       10.68429 38.65410 4.585401 32.21892 11.16199 6.435177       12.06715 
1 1 1 23  6  15 o 12.20498 5.238770 0.2098112      2.796038 -0.5236278     3.052168 4.037769       6.972846 11.98151 5.300277 20.61690 8.524693 -8.635387      10.03809 
1 1 1 23  6  16 o 16.60694 5.806662 3.505153       2.894912 5.282597       3.304437 -2.362183      6.003714 19.55957 6.188716 15.24586 7.016562 4.313706       9.355872 
1 1 1 23  6  17 o 40.57764 3.927063 21.32951       3.834731 25.64522       4.637554 11.99909       6.818891 44.22879 4.359377 27.16513 8.917064 17.06366       9.925633 
1 1 1 23  6  18 o 7.898531 3.851526 -3.990828      2.408489 -1.983922      2.760763 -10.38386      4.927414 9.995568 4.654785 10.21770 5.079853 -0.2221308     6.889987 
1 1 1 23  6  19 o 18.95814 5.634466 5.143936       2.793310 6.535629       3.220078 0.9126734      5.614741 21.14673 5.982032 16.22147 7.181746 4.925261       9.346774 
1 1 1 23  6  20 o 14.88439 5.469607 2.824737       2.603647 2.327262       2.966125 4.495123       5.435158 14.50808 5.712660 18.57550 7.586508 -4.067418      9.496820 
1 1 1 23  6  21 o 18.09491 5.647393 4.845867       2.760875 3.462358       3.109835 9.993509       5.998610 15.96813 5.957408 23.49756 8.346300 -7.529429      10.25434 
1 1 1 23  6  22 o 13.62855 5.625494 1.824784       3.029469 3.839099       3.197321 -15.86291      9.474541 16.30763 6.048964 13.36470 6.704225 2.942928       9.029761 
1 1 1 23  6  23 o 21.96235 6.772916 8.220648       3.984443 8.725726       4.317868 5.323987       10.34043 22.31203 7.076175 19.02453 8.908257 3.287500       11.37670 
1 1 1 23  6  24 o 14.05662 6.048842 1.913740       3.745468 5.026729       4.018044 -18.72311      10.34541 17.41033 6.706971 13.02998 6.593986 4.380351       9.405537 
1 1 1 23  6  25 o 13.78821 5.796392 2.177797       3.302908 3.379465       3.972845 -0.5116673     5.943501 15.40163 6.407246 14.10262 6.650385 1.299006       9.234740 
1 1 1 23  7  0  o 51.02835 3.390514 32.09169       4.192210 32.07706       4.817123 32.13737       8.510885 50.92131 3.911929 50.10438 7.175035 0.8169250      8.172167 
1 1 1 23  7  1  f 11.77107 5.167110 -0.6641279     2.848693 0.7012045E-01  3.348121 -2.589402      5.421582 13.54721 5.771619 15.23114 6.876045 -1.683928      8.977281 
1 1 1 23  7  2  o 18.19544 5.577226 4.135792       2.706856 3.201126       3.519546 5.489188       4.235169 17.50797 6.371028 21.27088 7.029644 -3.762913      9.487144 
1 1 1 23  7  3  o 57.12675 2.890184 40.11237       4.010402 37.93113       5.352135 42.90505       6.055990 55.32623 3.996658 58.79585 4.255507 -3.469624      5.838032 
1 1 1 23  7  4  o 58.38834 2.877777 41.91821       4.082059 44.22358       5.516919 39.12911       6.068183 59.77732 3.807034 56.04362 4.480493 3.733704       5.879483 
1 1 1 23  7  5  o 71.65858 2.885899 63.12904       5.029167 67.65837       6.543996 56.59457       7.860159 73.99685 3.640229 67.29876 4.824802 6.698090       6.044003 
1 1 1 23  7  6  o 34.96776 3.855999 15.28875       3.231303 17.87009       3.978335 10.28441       5.539273 37.69795 4.414080 27.80936 7.838682 9.888592       8.996057 
1 1 1 23  7  7  o 45.94271 4.432024 26.48711       4.900458 19.12790       7.324739 32.45013       6.593401 37.64656 8.215535 50.54678 5.438238 -12.90021      9.852383 
1 1 1 23  7  8  o 83.41525 3.664857 86.29556       7.431514 87.36806       11.91433 85.61256       9.507748 82.76505 5.946909 82.59757 4.743563 0.1674728      7.607044 
1 1 1 23  7  9  f 39.55673 5.095353 20.01061       4.797728 29.97033       7.560800 13.29695       6.207602 47.82446 6.668670 31.12754 8.105145 16.69692       10.49593 
1 1 1 23  7  10 f 38.87290 3.593918 18.91582       3.365951 18.60930       4.025677 19.62799       6.136135 38.30585 4.391919 38.36865 6.812216 -0.6280518E-01 8.105260 
1 1 1 23  7  11 o 26.06874 4.736726 8.828387       2.898282 10.91581       3.406459 3.355603       5.515723 28.96378 5.007367 19.47133 7.750884 9.492453       9.227672 
1 1 1 23  7  12 o 25.81157 4.596074 8.668349       2.784937 7.496081       3.147265 12.89833       5.978461 23.67545 5.551870 30.17909 8.000625 -6.503639      9.738237 
1 1 1 23  7  13 o 74.14426 2.980269 68.37836       5.373821 72.95494       6.648437 59.75369       9.126834 76.24242 3.588452 67.58691 5.591412 8.655510       6.643859 
1 1 1 23  7  14 o 47.11873 3.372407 27.94547       3.846701 25.50135       4.518201 34.38406       7.333321 44.60643 4.206199 50.59521 6.068747 -5.988785      7.383888 
1 1 1 23  7  15 o 35.16778 4.133976 15.98710       3.475237 15.29557       4.061726 17.87651       6.713780 33.91681 5.069603 34.65905 8.096053 -0.7422485     9.552327 
1 1 1 23  7  16 o 20.92871 5.198856 6.017892       2.639568 7.042566       2.861179 0.1613792      6.840246 22.62825 5.284832 17.55253 7.839336 5.075712       9.454346 
1 1 1 23  7  17 o 24.53613 5.283223 8.329574       3.065436 8.742884       3.186369 3.192547       11.23347 25.10574 5.370626 21.85635 9.879417 3.249395       11.24484 
1 1 1 23  7  18 o 33.66598 4.123018 14.93579       3.312017 14.68140       3.456611 17.78702       11.57225 33.22156 4.375975 29.34539 11.36149 3.876169       12.17508 
1 1 1 23  7  19 o 15.07919 5.546654 2.849909       2.678589 1.269279       2.757746 29.20388       11.26062 13.01107 5.368620 37.54270 11.34901 -24.53163      12.55477 
1 1 1 23  7  20 o 16.18030 5.641328 3.625131       2.731279 4.314839       2.836262 -5.177486      10.13257 17.32606 5.753657 16.92819 8.170259 0.3978691      9.992883 
1 1 1 23  7  21 o 16.70250 5.623342 4.049488       2.707941 4.830857       2.987601 0.4522454      6.410313 17.96432 5.902660 16.01349 7.325329 1.950829       9.407542 
1 1 1 23  7  22 o 11.88005 5.062819 0.8445254      2.577584 1.412356       2.930014 -1.099091      5.420824 13.00523 5.462832 13.99466 6.518931 -0.9894333     8.505233 
1 1 1 23  7  23 o 16.36459 5.696757 4.077558       2.784636 3.303476       3.168042 6.707542       5.839478 15.32887 5.941908 19.23167 7.860149 -3.902802      9.853335 
1 1 1 23  7  24 o 9.148643 4.308880 -1.749936      2.481105 -1.927202      2.787750 -1.074529      5.441555 9.627498 4.544482 13.58579 6.393289 -3.958297      7.843880 
1 1 1 23  8  0  o 53.68332 3.565764 35.56044       4.638307 33.72268       7.613370 36.64516       5.849120 51.62561 6.173944 54.31072 4.458680 -2.685104      7.615603 
1 1 1 23  8  1  f 56.17210 2.925366 38.77751       3.990597 42.36278       5.545783 34.92778       5.746689 58.52712 3.910830 52.98743 4.492813 5.539688       5.956506 
1 1 1 23  8  2  o 74.52441 2.967631 68.21739       5.378675 66.89510       6.822888 70.38824       8.742188 73.60474 3.816915 75.22453 4.793914 -1.619781      6.127842 
1 1 1 23  8  3  o 54.45348 3.293087 36.57089       4.349409 39.61457       5.366644 30.74520       7.424677 56.54370 3.919026 49.08080 6.356863 7.462898       7.467829 
1 1 1 23  8  4  o 154.1607 3.231501 292.1855       12.13987 294.5097       16.28181 289.2757       18.21754 154.1622 4.338312 152.4265 4.910892 1.735672       6.552694 
1 1 1 23  8  5  o 31.56216 4.880485 12.67945       3.632758 13.78576       4.010446 7.621884       8.574814 32.85548 5.180391 26.33755 9.878844 6.517925       11.15473 
1 1 1 23  8  6  o 27.05334 7.315494 9.731082       4.937728 11.80227       5.953812 5.168026       8.837167 29.63342 8.041410 24.51033 9.792872 5.123089       12.67141 
1 1 1 23  8  7  o 59.80490 3.413242 44.29296       4.953736 43.00524       5.493206 49.89997       11.46253 58.79584 3.855188 61.50604 7.824499 -2.710197      8.722687 
1 1 1 23  8  8  o 32.46860 4.716258 13.45424       3.622558 14.20940       3.921991 9.067500       9.452696 33.29940 4.986411 27.58828 10.36711 5.711113       11.50396 
1 1 1 23  8  9  o 83.78870 3.684215 87.33480       7.504184 87.33480       7.504184 0.000000       0.000000 83.78870 3.684215 ?        ?        0.000000       3.684215 
1 1 1 23  8  10 o 10.35636 4.769204 -1.944438      2.779706 -1.716563      2.930680 -3.986767      8.773703 10.88458 4.969205 18.60276 8.532262 -7.718179      9.873829 
1 1 1 23  8  11 o 38.34795 4.099843 18.64353       3.771919 19.81281       4.015453 9.871636       10.99820 39.49276 4.238599 28.06085 11.01507 11.43191       11.80244 
1 1 1 23  8  12 o 33.85085 4.230679 14.66380       3.413933 14.67413       3.611224 14.57692       10.47196 33.75904 4.501739 31.01706 11.02658 2.741974       11.91013 
1 1 1 23  8  13 o 31.96588 4.613909 13.28086       3.490216 16.04949       3.713926 -7.645859      10.21061 35.27709 4.416736 18.16891 8.612196 17.10818       9.678713 
1 1 1 23  8  14 o 36.43175 4.111558 17.07230       3.586557 18.61434       3.792720 4.033840       11.02850 38.03540 4.159661 23.39324 10.22034 14.64216       11.03441 
1 1 1 23  8  15 o 53.68024 3.006636 36.16647       3.917351 37.00238       4.118303 28.22259       12.69561 54.23330 3.129424 38.90401 12.10529 15.32929       12.50325 
1 1 1 23  8  16 o 16.93890 5.613653 3.821758       2.700266 3.685831       3.038961 4.331625       5.885735 16.90016 5.946302 19.61179 7.937166 -2.711630      9.917516 
1 1 1 23  8  17 o 20.52546 5.771700 5.974792       3.006875 5.208820       3.340485 9.245264       6.902532 19.21791 6.236876 24.13946 8.899693 -4.921545      10.86753 
1 1 1 23  8  18 o 29.35083 4.706741 11.67977       3.252741 12.16342       3.773045 10.27992       6.418977 29.47795 5.453213 24.86552 8.649624 4.612432       10.22514 
1 1 1 23  8  19 o 13.76497 5.543379 1.794459       2.855214 2.491664       3.331795 -0.1331600     5.539983 15.15742 6.027194 15.35741 6.940223 -0.1999969     9.192049 
1 1 1 23  8  20 o 15.87898 5.731285 3.432303       2.840599 3.362550       3.378902 3.600417       5.245588 16.08630 6.162333 17.51683 7.330403 -1.430529      9.576490 
1 1 1 23  8  21 o 16.94714 5.911428 4.222310       2.999274 1.584073       3.556949 10.71330       5.579257 14.05189 5.966366 24.33757 8.069324 -10.28568      10.03551 
1 1 1 23  8  22 o 10.02075 4.680925 -1.667315      2.826689 -1.508979      3.264049 -2.142245      5.653023 10.91310 5.075054 13.65331 6.452811 -2.740212      8.209442 
1 1 1 23  8  23 o 12.11285 5.320539 0.5781460      3.024762 -0.4853259     3.640424 2.949270       5.435832 12.08677 5.525750 16.15399 7.112741 -4.067226      9.006942 
1 1 1 23  8  24 o 25.33991 5.911989 10.31820       3.583583 9.641906       4.330667 11.78711       6.382380 23.03242 7.053429 22.97903 8.542020 0.5339050E-01  11.07777 
1 1 1 23  9  0  o 101.0971 2.664276 125.2386       6.558060 124.3414       9.385786 126.0945       9.167075 100.4293 3.842165 101.1712 3.724603 -0.7418900     5.351159 
1 1 1 23  9  1  o 34.08921 3.865469 14.49278       3.154496 13.42527       4.116415 16.01161       4.910045 32.43986 5.396725 35.35654 5.906993 -2.916679      8.001075 
1 1 1 23  9  2  o 110.1772 2.664527 148.7421       7.153986 155.5098       10.42996 142.7292       9.831109 112.2620 3.818088 107.5665 3.756267 4.695541       5.356056 
1 1 1 23  9  3  o 22.27423 5.332517 6.432591       2.856030 7.527915       3.699691 4.817195       4.492973 24.01624 6.259083 20.51790 7.229293 3.498346       9.562364 
1 1 1 23  9  4  o 27.15801 5.891847 9.609723       3.786943 12.48036       6.310151 7.993851       4.734279 30.52209 8.276869 24.76033 7.329425 5.761755       11.05563 
1 1 1 23  9  5  o 118.5578 3.595692 173.6554       10.37640 193.0319       17.32063 162.8084       12.95930 123.6870 5.762341 114.2553 4.664262 9.431694       7.413496 
1 1 1 23  9  6  o 92.99229 2.919542 106.4557       6.607837 112.0343       8.484318 97.85455       10.53486 95.12105 3.667064 88.32486 4.913883 6.796188       6.131362 
1 1 1 23  9  7  o 30.90130 4.403740 12.12889       3.222426 12.02624       3.756083 12.41509       6.271996 30.52297 5.238349 30.16824 8.281070 0.3547363      9.798798 
1 1 1 23  9  8  o 101.5752 2.949234 127.2906       7.292439 132.9688       9.410553 118.7554       11.53762 103.4307 3.739771 97.05795 4.893872 6.372772       6.159210 
1 1 1 23  9  9  o 21.04500 5.428753 5.841421       2.802401 5.467197       3.255588 6.911921       5.506263 20.43107 6.085472 23.29435 8.015618 -2.863283      10.06395 
1 1 1 23  9  10 o 32.15065 4.153840 13.15336       3.178453 12.32805       3.729354 15.34434       6.076348 30.76628 5.156483 33.31668 7.646439 -2.550402      9.222654 
1 1 1 23  9  11 o 68.32147 2.911174 57.89164       4.835762 54.96234       5.758140 64.90182       8.907679 66.27027 3.578835 71.03075 5.181790 -4.760483      6.297540 
1 1 1 23  9  12 o 35.14070 4.417171 15.88456       3.699231 12.11664       4.438231 24.45871       6.695063 29.82584 6.303921 42.44753 6.693962 -12.62169      9.195028 
1 1 1 23  9  13 o 12.49124 5.292055 0.4376523      2.787981 -0.4063092     3.225137 2.933206       5.545877 12.47871 5.487162 18.69480 7.652612 -6.216085      9.416551 
1 1 1 23  9  14 o 56.84226 3.026312 40.47850       4.176890 42.24194       4.948279 36.10778       7.790225 57.78757 3.530705 51.36133 6.359881 6.426243       7.274199 
1 1 1 23  9  15 o 26.36555 4.033078 9.076458       2.509011 8.966336       2.780375 9.559431       5.822735 25.97252 4.559146 25.11939 8.239723 0.8531303      9.416945 
1 1 1 23  9  16 o 27.55372 4.105793 9.976691       2.672799 10.83082       2.762110 -2.593992      10.59639 28.75296 4.054471 19.28088 9.024912 9.472078       9.893825 
1 1 1 23  9  17 o 17.62101 4.907459 4.276291       2.184983 3.195888       2.378391 10.12045       5.531610 15.58527 5.270073 25.29479 8.007619 -9.709518      9.586221 
1 1 1 23  9  18 o 9.063649 4.144539 -1.054743      2.049388 -2.630938      2.158319 13.38836       6.533428 8.069805 3.862429 28.04528 8.677023 -19.97548      9.497847 
1 1 1 23  9  19 o 26.07043 4.151938 9.149311       2.549372 9.077047       2.795414 9.506461       6.214558 25.67649 4.638259 23.50564 8.478093 2.170851       9.663928 
1 1 1 23  9  20 o 8.100585 3.830514 -1.910532      1.996970 -1.782451      2.167891 -2.628046      5.131102 8.631641 4.053587 13.19748 6.209833 -4.565840      7.415767 
1 1 1 23  9  21 o 10.59559 4.559765 0.3709480      2.128609 -1.200006      2.300897 9.698034       5.606456 9.359198 4.320413 22.96091 8.076778 -13.60171      9.159712 
1 1 1 23  9  22 o 16.80208 5.241838 4.226403       2.378829 4.498844       2.594304 2.787691       5.961716 17.20575 5.488247 16.53951 7.357075 0.6662426      9.178638 
1 1 1 23  9  23 o 12.29118 4.957895 1.612253       2.287984 2.626726       2.495607 -3.734824      5.729468 13.95636 5.308218 12.80450 6.170929 1.151863       8.139874 
1 1 1 23  9  24 o 20.42872 5.162029 6.419932       2.570405 5.542880       2.729991 13.27047       7.629763 18.61866 5.579057 22.95143 9.122603 -4.332771      10.69335 
1 1 1 23  10 0  f 15.93942 5.531016 2.871693       2.623923 2.979961       3.433198 2.719625       4.068822 17.08536 6.280392 17.57719 6.754931 -0.4918251     9.223471 
1 1 1 23  10 1  o 54.07342 3.026309 35.99827       3.971887 36.98065       5.370242 34.81192       5.901455 54.58483 4.066468 52.80607 4.632947 1.778759       6.164443 
1 1 1 23  10 2  o 95.28445 2.656001 111.3801       6.161160 104.3751       8.587955 118.8093       8.844079 91.89473 3.843465 98.10125 3.706156 -6.206520      5.339271 
1 1 1 23  10 3  o 127.7027 3.166727 200.5451       9.854777 219.0034       18.79112 193.5425       11.57413 131.8719 5.862073 125.1459 3.799610 6.725990       6.985766 
1 1 1 23  10 4  o 107.3941 2.650776 141.5167       6.937282 137.8296       9.868684 145.1186       9.753920 105.5136 3.844512 108.3339 3.700127 -2.820267      5.335843 
1 1 1 23  10 5  o 35.40993 4.029488 15.73431       3.415268 17.60406       4.171402 11.93258       5.948153 37.29746 4.693185 29.75258 8.022222 7.544876       9.294193 
1 1 1 23  10 6  o 26.13949 4.993321 8.834353       3.064755 11.06520       3.593556 2.883158       5.869374 29.26210 5.231484 19.72038 7.945710 9.541716       9.513292 
1 1 1 23  10 7  o 29.97529 4.410662 11.44537       3.125602 11.88235       3.746287 10.44449       5.669712 30.29240 5.265998 27.73960 7.967651 2.552809       9.550612 
1 1 1 23  10 8  o 69.56139 3.162124 59.92722       5.346210 54.71741       5.988127 80.39347       11.86859 66.25433 3.723849 78.84470 6.227724 -12.59036      7.256142 
1 1 1 23  10 9  o 110.9889 2.970164 152.3268       8.026114 150.9239       10.17819 154.6336       13.05149 109.9622 3.804044 110.4822 4.859542 -0.5200348     6.171378 
1 1 1 23  10 10 o 40.80018 4.195879 21.12579       4.112378 22.90257       5.243979 18.28775       6.627562 42.05322 5.229795 36.28294 7.732378 5.770271       9.334905 
1 1 1 23  10 11 o 34.39826 3.677429 14.96683       3.034829 13.25964       3.415357 21.37289       6.615932 32.06458 4.494164 39.44196 7.146355 -7.377380      8.442032 
1 1 1 23  10 12 o 53.90977 3.017239 36.25585       3.947997 37.34467       4.618843 33.30282       7.606562 54.50048 3.496176 49.68280 6.433617 4.817688       7.322204 
1 1 1 23  10 13 o 33.18832 3.651674 14.03587       2.904596 13.55075       3.262002 15.89291       6.382145 32.36289 4.237918 32.88784 8.033427 -0.5249557     9.082726 
1 1 1 23  10 14 o 26.05797 3.909512 8.810250       2.406046 9.123082       2.643947 7.302844       5.803805 26.38317 4.257227 22.76512 8.195436 3.618055       9.235212 
1 1 1 23  10 15 o 21.17156 4.506296 6.021297       2.253507 7.013013       2.456844 0.7631038      5.657208 22.86248 4.569678 16.65111 7.296232 6.211369       8.609120 
1 1 1 23  10 16 o 26.99687 3.754897 9.490942       2.403520 10.38888       2.644825 5.232738       5.759530 28.16618 3.962717 20.17362 7.955232 7.992565       8.887566 
1 1 1 23  10 17 o 31.77577 3.602096 13.09473       2.740104 14.72976       2.840022 -8.923008      10.42186 33.77483 3.501313 16.75470 8.133945 17.02013       8.855522 
1 1 1 23  10 18 o 14.26237 4.879714 2.651674       2.039871 1.837127       2.173601 8.666861       5.906718 12.96963 4.948889 23.00611 8.269592 -10.03649      9.637305 
1 1 1 23  10 19 o 10.93797 4.517665 0.7874200      1.955386 -0.1469768E-01 2.033853 10.58513       7.108252 10.05869 4.391904 24.03278 8.998579 -13.97409      10.01315 
1 1 1 23  10 20 o 11.33781 4.535182 1.172944       1.897556 2.330323       2.033370 -6.632996      5.280695 13.46437 4.850436 11.62519 5.676224 1.839177       7.466341 
1 1 1 23  10 21 o 8.576237 3.891242 -0.6491392     1.762531 -0.2700154     1.831719 -5.385193      6.474060 9.169281 4.078380 13.26379 6.432574 -4.094513      7.616508 
1 1 1 23  10 22 o 13.15746 4.770082 2.302566       1.970466 2.808447       2.060473 -3.111251      6.740536 14.13377 4.901489 14.12753 6.778748 0.6240845E-02  8.365167 
1 1 1 23  10 23 o 9.445396 4.157866 0.1037148E-01  1.856457 0.6698608      1.954720 -6.058782      5.929863 10.47569 4.434359 12.12324 5.939586 -1.647552      7.412302 
1 1 1 23  11 0  o 32.69552 4.056329 13.39481       3.162622 13.36532       4.186769 13.43400       4.826358 32.29802 5.517444 32.14843 6.385788 0.1495819      8.439223 
1 1 1 23  11 1  o 86.12761 2.697229 91.04708       5.654063 91.86795       7.974174 90.21715       8.018113 86.20609 3.805249 85.40801 3.862449 0.7980728      5.422033 
1 1 1 23  11 2  o 16.86524 6.099157 3.049720       3.218915 3.561886       4.783096 2.625743       4.351866 19.30251 7.347072 17.76749 6.942325 1.535015       10.10818 
1 1 1 23  11 3  o 38.77226 3.602005 18.70770       3.364391 21.73947       4.518702 14.93642       5.039767 41.58341 4.532483 33.84525 6.343511 7.738155       7.796380 
1 1 1 23  11 4  o 84.96931 2.908144 88.87249       6.012754 95.04929       7.876496 80.24577       9.308383 87.60410 3.697859 80.03441 4.794652 7.569687       6.054985 
1 1 1 23  11 5  o 41.87803 3.605228 21.84773       3.643435 20.82559       4.404337 24.06351       6.484692 40.62339 4.525827 43.02659 6.377449 -2.403194      7.820164 
1 1 1 23  11 6  o 26.70245 4.848757 9.202644       3.038960 8.557264       3.584970 10.85062       5.728656 25.46091 5.894426 28.25905 7.973683 -2.798140      9.915840 
1 1 1 23  11 7  o 53.63876 3.202543 35.68439       4.167042 34.42808       5.019987 38.46831       7.472785 52.44007 3.957494 54.69870 5.689239 -2.258629      6.930310 
1 1 1 23  11 8  o 48.30151 3.918506 29.28315       4.572721 31.39753       6.102570 26.57604       6.905154 49.52470 5.130793 44.87654 6.503509 4.648155       8.283759 
1 1 1 23  11 9  o 27.91339 4.515739 10.05225       2.966853 10.81725       3.412141 7.681636       6.006567 28.79474 5.046562 24.18069 8.369576 4.614054       9.773311 
1 1 1 23  11 10 o 23.84097 4.827051 7.471236       2.708103 5.197126       2.996653 17.60299       6.325182 19.77910 5.825105 35.56348 7.533149 -15.78438      9.522614 
1 1 1 23  11 11 o 32.93416 3.840666 13.80613       3.024617 16.57837       3.503981 5.702358       5.990866 36.04053 4.060217 21.77946 8.238080 14.26108       9.184298 
1 1 1 23  11 12 o 26.63988 4.293870 9.235157       2.692772 8.513337       2.995916 12.27022       6.143259 25.26908 5.042043 28.84244 8.296617 -3.573353      9.708555 
1 1 1 23  11 13 o 16.85160 4.990103 3.781621       2.194169 2.780543       2.336630 11.24848       6.381533 15.04951 5.219597 27.25787 8.597201 -12.20835      10.05764 
1 1 1 23  11 14 o 35.96143 3.127181 16.35624       2.713254 17.66747       2.997134 10.40156       6.386998 37.29394 3.332950 25.96019 8.634536 11.33376       9.255472 
1 1 1 23  11 15 o 20.16301 4.419765 5.470630       2.111616 5.587377       2.276409 4.750735       5.652774 20.27815 4.698761 19.78197 7.855674 0.4961834      9.153686 
1 1 1 23  11 16 o 8.812251 4.143381 -2.073069      2.276907 -1.217635      2.561892 -5.289090      4.967375 10.18000 4.646965 12.14197 5.824239 -1.961973      7.450909 
1 1 1 23  11 17 o 25.12634 3.677721 8.279018       2.185203 7.777229       2.295121 13.14452       7.146752 24.16895 4.039274 27.41424 9.134073 -3.245285      9.987344 
1 1 1 23  11 18 o 27.89695 3.497206 10.16923       2.325362 10.16923       2.325362 0.000000       0.000000 27.89695 3.497206 ?        ?        0.000000       3.497206 
1 1 1 23  11 19 o 15.86276 6.665685 2.470586       4.364986 11.63577       6.406520 -5.470391      5.963326 25.20878 8.647089 13.00721 6.275359 12.20157       10.68421 
1 1 1 23  11 20 o 9.987366 4.852327 -4.794754      3.727923 -2.115114      5.312168 -7.395003      5.232884 13.52350 6.349149 11.23860 5.521080 2.284897       8.413918 
1 1 1 23  11 21 o 16.75735 7.307756 3.229324       5.616113 0.000000       0.000000 3.229324       5.616113 ?        ?        16.75735 7.307756 0.000000       7.307756 
1 1 1 23  11 22 o 17.99143 4.565496 4.712099       2.004628 3.490918       2.115023 15.50260       6.287034 15.40579 4.959619 27.83392 8.493703 -12.42813      9.835690 
1 1 1 23  11 23 o 15.85214 6.850828 3.244658       4.844772 10.96033       7.653819 -1.913567      6.258085 21.43706 8.903553 13.90899 6.635202 7.528067       11.10402 
1 1 1 23  12 0  o 28.06887 4.638340 10.02945       3.061945 10.08073       4.050231 9.961066       4.677725 27.78080 6.145761 27.47477 6.975255 0.3060322      9.296481 
1 1 1 23  12 1  o 36.40638 4.378263 16.66841       3.806461 16.56293       5.668889 16.75501       5.136674 35.56546 6.788400 36.01060 6.069053 -0.4451408     9.105810 
1 1 1 23  12 2  o 53.74508 3.053123 35.63993       3.982255 37.84790       5.511725 33.22857       5.759994 55.10978 4.134283 51.46567 4.642564 3.644115       6.216566 
1 1 1 23  12 3  o 60.71920 2.946666 45.45223       4.347048 46.14945       6.058120 44.71222       6.241279 60.85238 4.109402 59.82654 4.309868 1.025837       5.955010 
1 1 1 23  12 4  o 15.20365 5.587851 2.395092       2.717618 2.315398       3.534210 2.510382       4.250840 16.22507 6.279562 17.40972 6.843799 -1.184649      9.288190 
1 1 1 23  12 5  o 12.78845 5.310499 0.6266925      2.722122 0.7016048      3.160672 0.4115302      5.356556 13.71094 5.710302 16.96686 7.266259 -3.255923      9.241540 
1 1 1 23  12 6  o 40.60281 4.545134 20.90041       4.420084 21.56197       6.180769 20.20792       6.323563 40.47581 6.485191 38.96917 6.912020 1.506638       9.478065 
1 1 1 23  12 7  o 43.12337 4.341551 23.52686       4.500372 21.41224       6.066436 26.11493       6.711282 40.27352 6.394762 44.57063 6.359141 -4.297108      9.018406 
1 1 1 23  12 8  o 47.72575 3.406703 28.43775       3.936026 33.21603       4.735240 17.75603       7.079897 51.45001 3.803667 35.52438 8.324591 15.92563       9.152414 
1 1 1 23  12 9  o 33.36428 4.082278 14.17833       3.250041 13.74922       3.797164 15.35387       6.284883 32.52851 4.945832 33.01004 7.915385 -0.4815292     9.333519 
1 1 1 23  12 10 o 56.38137 3.029594 39.58921       4.147232 39.42596       4.895295 40.00429       7.805903 56.01431 3.605425 55.06153 5.909913 0.9527740      6.922872 
1 1 1 23  12 11 o 32.36957 3.843520 13.37745       2.972696 11.66871       3.311462 20.47042       6.746774 29.86701 4.705329 38.03546 7.545468 -8.168455      8.892368 
1 1 1 23  12 12 o 7.167109 3.476877 -3.057442      1.895057 -4.123832      2.020879 4.715240       5.455915 6.898591 3.397245 20.12986 7.799098 -13.23127      8.506891 
1 1 1 23  12 13 f 32.91704 4.305122 14.13290       3.370682 13.23641       3.708231 18.39555       8.085979 31.49200 4.998861 33.83098 9.447475 -2.338978      10.68847 
1 1 1 23  12 14 o 19.82435 4.443942 5.282508       2.093663 5.552195       2.204111 2.792089       6.697915 20.28946 4.568223 19.05712 8.142463 1.232346       9.336399 
1 1 1 23  12 15 o 59.34368 5.130126 47.31916       7.346101 60.93737       10.57985 34.64133       10.20804 65.26593 6.749342 46.01281 9.421283 19.25312       11.58940 
1 1 1 23  12 16 o 31.22536 3.678736 12.67797       2.745595 12.12923       2.947961 16.26817       7.540446 30.31262 4.095500 30.65104 9.291525 -0.3384247     10.15409 
1 1 1 23  12 17 o 30.92570 8.601970 16.19004       6.717813 0.000000       0.000000 16.19004       6.717813 ?        ?        30.92570 8.601970 0.000000       8.601970 
1 1 1 23  12 18 o 14.34352 6.573601 -0.9409481     5.194180 0.000000       0.000000 -0.9409481     5.194180 ?        ?        14.34352 6.573601 0.000000       6.573601 
1 1 1 23  12 19 o 10.83800 5.375538 -9.584273      5.392211 0.000000       0.000000 -9.584273      5.392211 ?        ?        10.83800 5.375538 0.000000       5.375538 
1 1 1 23  12 20 o 14.39694 6.333368 1.201083       4.300827 12.15761       6.890887 -5.790417      5.504575 24.44086 8.911502 12.08299 5.876375 12.35787       10.67458 
1 1 1 23  12 21 o 14.19055 6.256811 1.267007       4.219827 2.834011       6.490945 0.1199133      5.553571 16.83601 7.568790 14.65313 6.745448 2.182882       10.13842 
1 1 1 23  12 22 f 14.37646 6.402341 1.401798       4.528223 1.352829       6.898679 1.438868       6.002243 15.95085 7.404245 15.47187 7.081622 0.4789753      10.24559 
1 1 1 23  13 0  o 38.15239 4.504550 18.32679       4.107367 18.02445       5.446183 18.72557       6.254792 37.31232 6.207703 37.74826 7.058992 -0.4359398     9.400263 
1 1 1 23  13 1  o 25.77126 5.496837 8.645271       3.346739 7.270828       4.117879 11.31969       5.744138 23.56110 6.797320 29.03992 7.906149 -5.478815      10.42645 
1 1 1 23  13 2  o 18.11084 5.879156 4.056227       2.968171 3.809076       3.655933 4.534171       5.083988 18.32885 6.515249 20.56583 7.627790 -2.236979      10.03153 
1 1 1 23  13 3  o 13.19363 5.426154 0.8168154      2.805023 -1.090076      3.516382 4.153356       4.651375 12.70117 5.649949 19.68865 7.297230 -6.987480      9.228840 
1 1 1 23  13 4  o 70.55900 2.941266 61.44609       5.046258 65.94144       6.633794 55.27256       7.774048 72.81129 3.751404 66.18462 4.853834 6.626678       6.134552 
1 1 1 23  13 5  o 53.34286 4.503929 35.88832       5.800036 30.47816       7.325332 44.97922       9.495662 48.30865 6.378204 58.58389 6.776144 -10.27525      9.305783 
1 1 1 23  13 6  o 38.24371 3.918704 18.41681       3.600474 19.24193       4.087506 15.56008       7.605597 38.94555 4.382903 33.08162 9.134166 5.863926       10.13128 
1 1 1 23  13 7  o 47.43707 3.531880 28.14289       4.053518 26.23992       4.542581 35.58046       8.980532 45.57906 4.134733 51.33477 7.391610 -5.755707      8.469469 
1 1 1 23  13 8  o 76.45918 3.156935 72.67660       5.869433 70.74754       6.657932 79.40443       12.43384 75.18771 3.644617 77.36003 6.660352 -2.172325      7.592333 
1 1 1 23  13 9  o 29.90967 4.392565 11.54226       3.106268 10.68065       3.424881 15.53743       7.374926 28.47558 5.123952 32.48006 9.004786 -4.004480      10.36055 
1 1 1 23  13 10 o 8.600517 4.041308 -2.114316      2.160203 -2.282885      2.297596 -0.8299742     6.341982 8.832542 4.155803 16.92197 7.553698 -8.089424      8.621429 
1 1 1 23  13 11 o 28.34524 5.194134 10.73630       3.455634 9.623123       3.968124 14.23019       7.030050 26.32139 6.275301 30.56824 8.899948 -4.246847      10.88983 
1 1 1 23  13 12 f 35.39827 3.337935 15.88766       2.845365 15.89486       3.119581 15.85206       6.940407 35.25846 3.685106 32.09720 8.670353 3.161266       9.420989 
1 1 1 23  13 13 o 21.58725 8.128257 6.355894       5.817136 0.000000       0.000000 6.355894       5.817136 ?        ?        21.58725 8.128257 0.000000       8.128257 
1 1 1 23  13 14 o 38.95662 7.606475 22.66697       6.961868 0.000000       0.000000 22.66697       6.961868 ?        ?        38.95662 7.606475 0.000000       7.606475 
1 1 1 23  13 15 o 16.24730 7.153346 0.7817178      5.497219 0.000000       0.000000 0.7817178      5.497219 ?        ?        16.24730 7.153346 0.000000       7.153346 
1 1 1 23  13 16 o 12.16199 5.651517 -2.236038      4.035675 -6.303156      5.947728 1.234051       5.493865 12.98504 6.265277 16.37888 7.183161 -3.393839      9.531606 
1 1 1 23  13 17 o 17.21246 6.880302 3.620529       4.364294 1.800177       6.430433 5.175107       5.942492 17.31824 7.675587 19.48564 7.942327 -2.167398      11.04514 
1 1 1 23  13 18 o 26.11241 7.178886 11.03556       4.709382 11.31950       7.132370 10.81608       6.270674 24.47528 9.042553 24.45546 8.546397 0.1982689E-01  12.44221 
1 1 1 23  13 19 o 13.45977 6.078049 -0.1021985     4.239622 -6.297090      5.943650 6.314678       6.049204 12.51324 6.090288 19.70898 8.020816 -7.195745      10.07100 
1 1 1 23  13 20 o 24.69343 7.670255 10.96156       5.099539 32.46519       8.728199 -0.1833509     6.283576 41.65874 8.869891 15.22744 7.067761 26.43130       11.34144 
1 1 1 23  13 21 o 20.61137 7.819383 8.004582       5.406856 7.009932       7.463852 9.102891       7.843138 19.46787 8.457962 20.77317 8.841359 -1.305296      12.23547 
1 1 1 23  13 22 o 14.49700 6.432318 1.648860       4.528397 5.757174       7.521652 -0.6868578     5.671416 18.32191 8.199055 14.04161 6.582172 4.280298       10.51425 
1 1 1 23  14 0  o 29.22632 4.681327 10.90512       3.221609 11.10601       4.700729 10.72719       4.423944 28.92169 6.787103 28.48308 6.515381 0.4386024      9.408238 
1 1 1 23  14 1  f 25.18939 4.959671 8.209426       2.936028 6.816708       3.790637 10.29784       4.641824 22.78187 6.505735 27.78468 6.889747 -5.002813      9.475928 
1 1 1 23  14 2  o 18.48183 5.581422 4.375170       2.724514 4.335310       3.545981 4.432610       4.256765 18.92725 6.434589 19.64329 7.025064 -0.7160397     9.526566 
1 1 1 23  14 3  o 65.67645 2.838206 53.21592       4.531723 60.25069       6.355360 45.93935       6.463660 69.57088 3.762666 60.47386 4.416511 9.097023       5.802002 
1 1 1 23  14 4  o 56.27598 3.522945 39.41822       4.807075 49.84060       8.289686 34.13790       5.900441 62.40556 5.507495 51.91886 4.714988 10.48669       7.250077 
1 1 1 23  14 5  o 41.86326 3.550145 21.92009       3.587602 24.45324       4.396951 16.87483       6.205298 44.03214 4.146569 35.16055 7.472760 8.871593       8.546121 
1 1 1 23  14 6  o 12.23725 5.050689 0.6944367      2.441672 -0.3244103     2.744235 4.565612       5.349193 11.71116 5.107707 20.48560 7.776203 -8.774445      9.303656 
1 1 1 23  14 7  o 38.35339 3.616446 18.51118       3.340137 17.40244       3.895051 21.59210       6.492915 36.89000 4.420735 39.91301 6.926648 -3.023006      8.217137 
1 1 1 23  14 8  o 13.77741 5.216518 1.873785       2.403552 3.040859       2.688171 -2.778614      5.367179 15.97690 5.594827 14.52934 6.667452 1.447565       8.703850 
1 1 1 23  14 9  o 61.37349 3.607072 47.40448       5.370971 47.44635       7.018731 47.34531       8.343225 60.67786 4.785415 59.87230 5.790553 0.8055611      7.512037 
1 1 1 23  14 10 o 20.63324 4.694240 5.673982       2.306944 5.503884       2.471078 6.828298       6.437246 20.23065 5.032940 22.82670 8.559945 -2.596052      9.929912 
1 1 1 23  14 11 o 16.73858 7.260863 0.8297164      5.482935 0.000000       0.000000 0.8297164      5.482935 ?        ?        16.73858 7.260863 0.000000       7.260863 
1 1 1 23  14 12 o 24.87863 7.056281 9.028112       4.474462 13.35174       6.807752 5.739848       5.936945 29.08787 8.830836 21.09807 8.146046 7.989798       12.01423 
1 1 1 23  14 13 o 30.92399 6.185453 13.50065       4.498323 12.16750       7.046114 14.41781       5.844294 27.38491 9.067851 30.79020 7.785603 -3.405289      11.95163 
1 1 1 23  14 14 o 18.69561 7.496988 4.041761       5.198689 0.000000       0.000000 4.041761       5.198689 ?        ?        18.69561 7.496988 0.000000       7.496988 
1 1 1 23  14 15 o 34.93356 6.062123 17.41246       4.973593 18.68917       7.837430 16.55166       6.435434 32.82484 9.348433 32.07324 8.202313 0.7515945      12.43669 
1 1 1 23  14 16 o 26.94176 7.152475 11.32238       4.773830 22.64230       7.581486 3.885690       6.145009 36.81203 8.606327 18.68735 7.883909 18.12469       11.67154 
1 1 1 23  14 17 o 18.60515 7.037673 5.014496       4.372258 3.393495       6.240085 6.577812       6.128050 18.07268 7.792560 20.55037 8.173265 -2.477686      11.29275 
1 1 1 23  14 18 o 29.63352 7.194254 14.25630       5.142388 17.73495       7.884300 11.68084       6.783976 29.67014 9.577887 24.71317 8.864978 4.956974       13.05081 
1 1 1 23  14 19 o 15.11086 6.536813 1.931588       4.419345 -3.362934      6.896202 5.621077       5.756781 14.47162 6.920457 18.88245 7.770429 -4.410831      10.40540 
1 1 1 23  14 20 o 15.89418 7.174322 1.743964       5.899639 4.501817       7.047086 -4.717477      10.78670 18.09154 8.025855 16.36881 8.017801 1.722727       11.34458 
1 1 1 23  14 21 o 14.03954 6.293733 0.9736068      4.453135 -2.433017      6.881378 3.428096       5.841089 14.37716 6.885423 16.65100 7.350633 -2.273838      10.07178 
1 1 1 23  15 0  o 53.44708 3.020592 35.30627       3.918149 31.35963       5.285779 40.11962       5.837393 49.96386 4.385722 56.60061 4.263500 -6.636745      6.116534 
1 1 1 23  15 1  o 66.58504 2.827392 54.67854       4.577297 53.31826       6.299967 56.19953       6.661722 65.36810 3.973678 67.06848 4.095505 -1.700378      5.706424 
1 1 1 23  15 2  o 53.02636 3.037488 34.80603       3.908604 39.54862       5.392302 29.55568       5.673625 56.23557 3.960161 48.23672 4.894341 7.998852       6.295827 
1 1 1 23  15 3  o 13.66210 5.274692 1.637261       2.489119 2.872299       3.091112 -0.6406058     4.197965 16.30127 5.964681 14.25912 6.265487 2.042156       8.650650 
1 1 1 23  15 4  o 34.70927 3.628018 15.14070       3.023407 11.39767       3.933623 20.54387       4.726122 29.39228 5.697637 40.01429 4.952394 -10.62201      7.549124 
1 1 1 23  15 5  o 51.21126 3.305786 32.68999       4.103458 33.59588       4.956152 30.71544       7.317170 51.66689 3.966712 48.19844 6.386845 3.468456       7.518417 
1 1 1 23  15 6  o 41.43134 3.473830 21.53131       3.475044 21.50111       4.035818 21.61791       6.833650 41.18394 4.074658 39.68523 7.336396 1.498711       8.391994 
1 1 1 23  15 7  o 37.36833 3.658472 17.63648       3.288859 18.52251       3.802742 15.00665       6.551453 38.11139 4.162126 32.28610 8.286018 5.825291       9.272615 
1 1 1 23  15 8  o 11.79397 5.055441 0.1303736      2.597165 0.7957911      2.977449 -1.986872      5.311080 13.27113 5.535907 14.83717 6.740961 -1.566045      8.722775 
1 1 1 23  15 9  o 29.28416 3.549888 10.92207       2.481619 11.57855       2.716335 7.608368       6.102825 30.07468 3.790359 23.50369 8.410870 6.570982       9.225483 
1 1 1 23  15 10 o 39.69548 7.866445 22.97998       7.340425 0.000000       0.000000 22.97998       7.340425 ?        ?        39.69548 7.866445 0.000000       7.866445 
1 1 1 23  15 11 o 14.99315 6.356024 1.083926       4.025984 7.999226       6.053242 -4.401610      5.391282 23.44768 8.378253 13.37997 6.316989 10.06771       10.49283 
1 1 1 23  15 12 o 21.29832 7.111523 6.487944       4.331753 2.595232       6.503841 9.591426       5.807223 18.75876 8.019530 25.00757 8.230083 -6.248804      11.49118 
1 1 1 23  15 13 o 48.02429 4.949118 30.84969       5.709106 53.91920       9.959542 19.55929       6.967469 61.38005 6.770871 35.42746 8.228373 25.95260       10.65602 
1 1 1 23  15 14 o 34.04835 6.346374 16.71231       5.072044 26.82735       8.210732 10.47069       6.449802 41.00273 8.496834 25.23594 8.675563 15.76679       12.14338 
1 1 1 23  15 15 o 32.55312 6.447148 15.59139       4.933454 15.72422       7.748077 15.50082       6.398071 29.44694 9.493813 30.58662 8.350984 -1.139681      12.64403 
1 1 1 23  15 16 o 30.44580 6.736234 14.15296       4.865322 13.38754       7.114954 14.82524       6.667983 26.99041 9.115126 28.97148 8.727833 -1.981070      12.61985 
1 1 1 23  15 17 o 19.74045 7.255137 6.107201       4.581279 11.85541       6.787175 1.296377       6.209157 25.12583 8.882452 16.51356 7.414983 8.612268       11.57065 
1 1 1 23  15 18 o 13.15833 5.975649 -0.3804605     4.168066 -2.403363      6.179115 1.308421       5.645967 14.29660 6.753695 15.78672 7.081081 -1.490122      9.785402 
1 1 1 23  15 19 o 23.60629 8.546236 11.06879       6.322220 11.01657       7.882475 11.16297       10.58567 22.64591 9.178012 22.01287 9.796876 0.6330395      13.42441 
1 1 1 23  15 20 o 11.30423 5.550533 -6.687362      5.267799 -9.508381      6.034966 2.340597       10.79609 11.35848 5.642771 18.10599 8.658570 -6.747515      10.33498 
1 1 1 23  15 21 o 13.96566 6.526564 -0.6397285     5.505152 -1.381409      6.474336 1.296297       10.46026 14.41607 6.840458 17.34356 8.353308 -2.927488      10.79674 
1 1 1 23  16 0  o 16.84034 6.340193 2.851095       3.539099 -1.825683      6.281423 5.026193       4.283750 16.69979 7.481453 20.35587 7.066905 -3.656078      10.29142 
1 1 1 23  16 1  o 31.07528 4.107886 12.24862       3.034664 14.00498       3.966532 9.769452       4.712574 32.93679 5.107154 26.85371 7.095918 6.083078       8.742716 
1 1 1 23  16 2  o 65.79960 2.805143 53.49555       4.487627 56.18814       6.157854 50.44581       6.553535 67.06205 3.783392 63.31551 4.272479 3.746544       5.706850 
1 1 1 23  16 3  o 11.70270 5.264401 -1.271496      3.145769 0.5334862      5.277090 -2.266484      3.918024 16.77570 7.198802 12.49650 5.720415 4.279201       9.194884 
1 1 1 23  16 4  o 30.81278 3.992544 12.07850       2.927483 13.31777       3.753814 10.15478       4.676917 32.03101 4.970099 27.18885 7.012950 4.842161       8.595543 
1 1 1 23  16 5  o 39.39103 3.512872 19.49841       3.336719 21.42632       3.970527 14.86380       6.156191 41.12206 4.013221 32.46508 7.865227 8.656986       8.829934 
1 1 1 23  16 6  o 28.40760 5.944836 10.89012       3.983042 9.065158       4.978982 14.13385       6.637977 25.43620 7.513109 31.18236 8.503024 -5.746151      11.34673 
1 1 1 23  16 7  f 21.66532 5.715512 6.370024       3.060615 8.339941       3.616095 1.394549       5.746893 24.67964 6.058216 17.72117 7.556109 6.958471       9.684874 
1 1 1 23  16 8  o 9.006722 3.962004 -0.3418042     1.682962 -0.3540891     1.768199 -0.2235189     5.486688 9.228514 4.060277 16.12613 7.121311 -6.897617      8.197495 
1 1 1 23  16 9  o 21.99412 7.954528 6.570433       5.475306 0.000000       0.000000 6.570433       5.475306 ?        ?        21.99412 7.954528 0.000000       7.954528 
1 1 1 23  16 10 o 41.01692 7.581682 24.51144       7.299101 0.000000       0.000000 24.51144       7.299101 ?        ?        41.01692 7.581682 0.000000       7.581682 
1 1 1 23  16 11 o 30.66419 6.418424 13.35669       4.642028 11.18561       6.799005 15.25245       6.353277 26.56672 8.910133 31.45767 8.203952 -4.890944      12.11178 
1 1 1 23  16 12 o 17.29600 6.748135 3.410717       4.106884 -1.453027      5.805240 8.283760       5.810787 15.32485 6.995370 23.35646 8.222088 -8.031614      10.79527 
1 1 1 23  16 13 o 27.73419 6.796299 11.42686       4.556787 10.82075       6.936249 11.88706       6.044030 25.53295 8.983542 27.10979 8.338396 -1.576843      12.25695 
1 1 1 23  16 14 o 26.25012 7.150636 10.62418       4.697228 14.85850       7.281283 7.605875       6.147482 29.10492 9.183761 22.11315 8.349368 6.991764       12.41183 
1 1 1 23  16 15 o 13.54949 6.124714 -0.5987700     4.317671 -2.654550      6.377722 1.140636       5.866483 14.88138 6.977164 16.45131 7.309114 -1.569936      10.10465 
1 1 1 23  16 16 o 19.48451 7.794600 5.618816       5.605729 7.847748       6.575416 -0.3110042     10.72496 21.58251 8.503356 18.72239 8.860330 2.860119       12.28057 
1 1 1 23  16 17 o 28.97233 8.799677 15.81682       6.758766 23.17319       8.534269 3.440744       11.06946 33.92435 9.785047 19.64639 9.205072 14.27795       13.43430 
1 1 1 23  16 18 o 19.18536 7.910053 5.974432       5.980450 11.07079       7.199045 -5.374882      10.74310 23.24042 8.971012 16.48553 8.059429 6.754892       12.05958 
1 1 1 23  16 19 f 21.52019 7.511171 8.357693       4.842661 16.41781       7.748419 3.191304       6.203488 27.04438 9.496570 16.95283 7.524911 10.09156       12.11648 
1 1 1 23  16 20 o 17.96449 7.191888 5.366772       4.775970 1.264786       7.103437 8.750840       6.451950 16.11141 7.490559 20.73592 8.339180 -4.624510      11.20939 
1 1 1 23  17 0  o 54.24849 3.710250 36.79313       4.875336 42.19692       9.341736 34.77038       5.715422 56.42429 6.940031 52.40843 4.519289 4.015858       8.281788 
1 1 1 23  17 1  o 11.17119 4.834173 -0.1586988     2.418591 -0.9034369     2.977131 1.286824       4.147713 11.66582 5.193480 15.82823 6.562449 -4.162408      8.368869 
1 1 1 23  17 2  o 22.94537 6.423059 7.095869       3.732729 9.086798       6.350958 6.045161       4.613731 25.80893 8.610794 21.65692 7.339976 4.152010       11.31464 
1 1 1 23  17 3  o 53.85463 2.900684 35.99365       3.792748 39.13883       5.028523 31.84332       5.776425 55.84538 3.716165 49.85092 4.814843 5.994461       6.082154 
1 1 1 23  17 4  o 45.58632 3.280115 25.99355       3.619482 27.93100       4.372617 21.77668       6.450912 47.03874 3.848212 40.00722 6.863811 7.031521       7.868967 
1 1 1 23  17 5  o 69.02060 2.856462 59.17392       4.794062 63.40031       5.874019 50.74281       8.296458 71.16860 3.396771 62.29746 5.522092 8.871140       6.483175 
1 1 1 23  17 6  o 9.417280 4.350403 -1.676511      2.339140 -0.5889031     2.611716 -6.086295      5.258943 11.05825 4.896854 12.59656 6.029068 -1.538312      7.767164 
1 1 1 23  17 7  o 13.53318 6.390759 -4.808603      5.523651 0.000000       0.000000 -4.808603      5.523651 ?        ?        13.53318 6.390759 0.000000       6.390759 
1 1 1 23  17 8  o 14.60298 6.650673 -1.816637      5.209108 0.000000       0.000000 -1.816637      5.209108 ?        ?        14.60298 6.650673 0.000000       6.650673 
1 1 1 23  17 9  o 26.01777 8.612415 10.35534       6.356248 0.000000       0.000000 10.35534       6.356248 ?        ?        26.01777 8.612415 0.000000       8.612415 
1 1 1 23  17 10 o 43.17682 6.798269 26.50272       6.916688 39.13397       8.876734 6.981807       11.03520 52.18590 7.169430 24.06309 10.36902 28.12281       12.60624 
1 1 1 23  17 11 o 15.34800 6.824054 -0.9209571E-01 5.123403 0.7148513      6.058186 -2.118602      9.600505 16.95356 7.485016 18.72137 8.705408 -1.767811      11.48084 
1 1 1 23  17 12 o 23.76616 8.135817 8.834116       5.670610 7.131330       6.633139 13.45759       10.93008 22.09152 8.588256 26.99410 10.85468 -4.902584      13.84133 
1 1 1 23  17 13 o 17.69902 7.442627 2.978485       5.447952 9.078108       6.502937 -11.38047      9.977448 23.60536 8.649092 15.67118 7.683341 7.934180       11.56895 
1 1 1 23  17 14 o 29.40867 8.144405 14.36815       6.036573 12.42303       7.131202 19.28571       11.33871 26.27533 9.118199 29.34803 11.27689 -3.072697      14.50206 
1 1 1 23  17 15 o 18.47311 7.033263 4.900789       4.383963 2.771032       6.253129 6.959489       6.147930 17.64556 7.702795 20.88452 8.224154 -3.238960      11.26809 
1 1 1 23  17 16 o 12.38235 5.993147 -5.586552      5.548359 0.000000       0.000000 -5.586552      5.548359 ?        ?        12.38235 5.993147 0.000000       5.993147 
1 1 1 23  17 17 f 17.38360 7.120483 4.158839       4.805315 -1.132849      7.340233 8.127616       6.356838 15.80071 7.432410 21.14222 8.351233 -5.341516      11.17962 
1 1 1 23  17 18 o 17.49602 7.158481 4.494166       4.849911 7.183137       7.469816 2.534567       6.376765 19.99180 8.571596 16.76008 7.520935 3.231724       11.40337 
1 1 1 23  17 19 o 14.80107 6.561095 1.602424       4.700626 8.858912       7.615994 -2.862899      5.974338 20.67222 8.751831 13.52559 6.460757 7.146638       10.87823 
1 1 1 23  18 0  f 22.56023 6.939585 6.823336       4.186183 3.642796       6.147148 9.573935       5.716587 20.29185 8.147019 26.28795 8.113608 -5.996105      11.49802 
1 1 1 23  18 1  o 43.59818 3.501904 23.83302       3.689295 27.72360       4.448412 15.26086       6.603025 46.87674 3.930291 32.75742 8.271457 14.11932       9.157740 
1 1 1 23  18 2  f 17.62017 6.557518 3.434693       3.763387 2.495150       5.213514 4.456907       5.438049 18.19229 7.430130 20.27883 7.805072 -2.086544      10.77618 
1 1 1 23  18 3  o 31.31446 4.095268 12.55830       3.050284 16.56995       3.595944 2.266183       5.759758 36.00195 4.176127 18.52416 7.711203 17.47778       8.769418 
1 1 1 23  18 4  o 18.85604 5.234990 4.749665       2.490623 7.548034       2.896789 -3.183348      4.877344 23.77262 5.149594 13.45518 6.238858 10.31744       8.089602 
1 1 1 23  18 5  o 36.48035 3.719550 16.92065       3.260419 16.92065       3.260419 0.000000       0.000000 36.48035 3.719550 ?        ?        0.000000       3.719550 
1 1 1 23  18 6  o 20.03270 4.758038 5.373998       2.288058 5.630906       2.348008 0.5347741      10.19057 20.50323 4.786786 21.09641 9.483874 -0.5931759     10.62343 
1 1 1 23  18 7  o 25.17677 10.77076 7.508908       11.74660 0.000000       0.000000 7.508908       11.74660 ?        ?        25.17677 10.77076 0.000000       10.77076 
1 1 1 23  18 8  o 12.03092 5.861732 -8.205611      5.546352 0.000000       0.000000 -8.205611      5.546352 ?        ?        12.03092 5.861732 0.000000       5.861732 
1 1 1 23  18 9  o 16.35872 7.070454 1.090411       5.161393 0.000000       0.000000 1.090411       5.161393 ?        ?        16.35872 7.070454 0.000000       7.070454 
1 1 1 23  18 10 o 25.17719 7.223099 9.484089       4.662224 18.24162       7.734213 4.485455       5.843204 33.25349 9.222401 19.63699 7.922360 13.61651       12.15798 
1 1 1 23  18 11 o 13.94855 6.206626 -0.2682575     4.246572 4.274736       6.120641 -4.484945      5.896734 19.44571 8.008263 13.80976 6.545584 5.635945       10.34297 
1 1 1 23  18 12 o 21.36878 7.223817 6.881373       4.468714 10.26041       6.733135 4.221195       5.974155 24.76077 8.837502 19.09456 7.892497 5.666206       11.84875 
1 1 1 23  18 13 o 16.09047 6.721068 2.362614       4.397571 -0.8654320     6.199137 5.632587       6.239266 15.66212 7.179220 20.12427 8.162058 -4.462150      10.87016 
1 1 1 23  18 14 o 12.72758 5.824640 -1.159188      4.058502 -1.831373      5.800443 -0.5144897     5.680611 14.55255 6.766819 15.14093 6.914643 -0.5883751     9.674819 
1 1 1 23  18 15 o 22.90883 7.513155 8.815672       4.841226 17.71869       7.592863 2.716897       6.284321 30.22250 9.354711 17.39632 7.654186 12.82618       12.08707 
1 1 1 23  18 16 o 31.07248 7.418011 16.08751       5.538977 30.82820       8.892811 6.743878       7.080074 40.62033 9.198290 20.14073 8.477857 20.47961       12.50930 
1 1 1 23  18 17 o 19.05286 8.000813 5.834064       6.282120 0.000000       0.000000 5.834064       6.282120 ?        ?        19.05286 8.000813 0.000000       8.000813 
1 1 1 23  18 18 o 18.59835 7.345807 5.789832       4.917986 9.666059       7.424105 2.758781       6.565021 21.46318 8.827476 16.81924 7.582137 4.643944       11.63671 
1 1 1 23  19 0  o 63.87160 3.297369 50.92966       5.114919 48.85455       9.138039 51.87644       6.172452 60.70295 6.267430 64.12172 3.969641 -3.418766      7.418809 
1 1 1 23  19 1  o 24.58496 4.309983 7.853727       2.488060 6.093012       3.023446 11.54752       4.379196 21.25442 5.714507 29.07431 6.358362 -7.819891      8.548939 
1 1 1 23  19 2  o 37.55635 3.281770 17.72903       2.973357 19.09781       3.884188 15.79162       4.621088 38.62798 4.193517 34.38950 5.714682 4.238483       7.088243 
1 1 1 23  19 3  o 30.18218 4.029935 11.71036       2.890042 10.11082       3.306732 16.88433       5.947217 27.58543 5.107115 34.59258 7.285498 -7.007141      8.897252 
1 1 1 23  19 4  o 11.89139 4.618604 1.251397       1.916988 0.1025847      2.230562 4.497451       3.749451 10.92756 4.684586 18.78067 6.605179 -7.853108      8.097761 
1 1 1 23  19 5  o 13.13977 4.765923 1.937505       1.967340 1.583118       2.107354 4.341697       5.488880 12.73893 4.869941 19.73844 7.771460 -6.999516      9.171255 
1 1 1 23  19 6  x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 23  19 7  o 22.45799 8.313611 7.059675       6.034049 0.000000       0.000000 7.059675       6.034049 ?        ?        22.45799 8.313611 0.000000       8.313611 
1 1 1 23  19 8  o 20.90148 8.096843 5.684018       5.879785 0.000000       0.000000 5.684018       5.879785 ?        ?        20.90148 8.096843 0.000000       8.096843 
1 1 1 23  19 9  o 45.36155 5.342320 27.89089       5.792346 34.45383       8.290818 21.63292       8.095890 48.58434 7.222025 36.42834 9.136935 12.15599       11.64651 
1 1 1 23  19 10 o 28.67901 7.232829 12.44108       5.053258 31.97208       8.214108 0.5484255      6.409699 46.13359 7.568696 17.04419 7.602041 29.08940       10.72736 
1 1 1 23  19 11 o 20.31322 7.359169 6.030575       4.688948 12.49452       7.143579 1.137466       6.215261 26.83042 9.132754 17.03907 7.549263 9.791351       11.84899 
1 1 1 23  19 12 o 31.62849 7.011621 15.29737       5.262291 27.48161       8.116192 6.460417       6.912010 40.99787 8.406174 21.02013 8.566517 19.97774       12.00204 
1 1 1 23  19 13 o 16.51325 6.812019 2.934079       4.438524 -7.408547      6.289652 13.19404       6.264466 12.81688 6.244112 27.45906 8.496694 -14.64218      10.54432 
1 1 1 23  19 14 o 14.08026 6.277790 0.3367274      4.366969 7.229870       6.447924 -5.504342      5.935502 20.88363 8.357837 12.93799 6.246597 7.945633       10.43424 
1 1 1 23  19 15 o 14.54795 6.530288 0.4942691      4.811635 7.495574       7.406425 -4.618542      6.329203 20.78736 8.705473 13.58472 6.531352 7.202637       10.88319 
1 1 1 23  19 16 o 15.53461 6.651207 2.374671       4.486061 8.534093       7.427386 -1.162777      5.628737 21.18215 8.781919 14.25600 6.641373 6.926144       11.01045 
1 1 1 23  19 17 o 13.89867 6.255251 0.5085115      4.447407 -4.503556      7.093699 3.754488       5.708697 14.04682 6.793400 17.14111 7.422241 -3.094292      10.06181 
1 1 1 23  20 0  o 28.87161 5.170110 11.05003       3.503947 15.83685       6.157472 8.757588       4.261160 33.27222 7.740517 25.04951 6.805262 8.222712       10.30666 
1 1 1 23  20 1  o 65.05909 3.251947 53.02560       5.139354 59.71740       9.106912 49.89855       6.225403 67.29458 5.604170 62.60199 4.103402 4.692593       6.945835 
1 1 1 23  20 2  o 80.78490 3.125626 81.63244       6.141623 82.13253       6.999892 79.96002       12.80089 80.71754 3.567479 76.17393 6.973281 4.543610       7.832851 
1 1 1 23  20 3  o 24.11814 4.239823 7.619062       2.400969 10.20931       3.003185 3.030942       3.996950 27.85818 4.583007 17.09734 6.661042 10.76084       8.085383 
1 1 1 23  20 4  o 27.37338 3.526499 9.591516       2.297789 7.889406       2.756683 13.46605       4.159132 24.28764 4.827730 31.48973 5.626482 -7.202095      7.413790 
1 1 1 23  20 5  o 53.16100 2.781740 35.32702       3.591138 37.51379       4.102082 28.15263       7.430118 54.62376 3.094328 44.50571 7.088380 10.11806       7.734339 
1 1 1 23  20 6  o 22.40657 8.281715 7.070793       5.983726 0.000000       0.000000 7.070793       5.983726 ?        ?        22.40657 8.281715 0.000000       8.281715 
1 1 1 23  20 7  o 10.59495 5.269842 -11.48467      5.327519 0.000000       0.000000 -11.48467      5.327519 ?        ?        10.59495 5.269842 0.000000       5.269842 
1 1 1 23  20 8  o 23.27010 8.499031 8.233261       6.271641 0.000000       0.000000 8.233261       6.271641 ?        ?        23.27010 8.499031 0.000000       8.499031 
1 1 1 23  20 9  o 19.99544 7.070370 5.699284       4.300586 7.514270       6.735704 4.450217       5.587776 22.42225 8.671529 19.23331 7.751595 3.188942       11.63111 
1 1 1 23  20 10 o 11.78326 5.514349 -2.650508      3.952721 -4.420220      5.601778 -0.8956129     5.578278 13.32748 6.335114 15.11673 6.883743 -1.789256      9.355190 
1 1 1 23  20 11 o 24.16252 7.205040 9.170144       4.561652 5.377588       6.554703 12.73216       6.352356 20.03634 8.273009 27.22090 8.576459 -7.184561      11.91630 
1 1 1 23  20 12 o 19.17065 7.108801 5.439427       4.415269 5.180416       6.423540 5.671396       6.078966 19.56488 8.143848 19.84256 8.053327 -0.2776737     11.45331 
1 1 1 23  20 13 o 15.34197 6.624900 1.723935       4.523153 11.62191       7.082646 -5.093170      5.877901 24.70765 9.030628 13.03847 6.275236 11.66918       10.99686 
1 1 1 23  20 14 o 34.88712 6.905627 19.24954       5.663034 32.72979       9.725368 12.33397       6.965795 40.93357 9.866197 25.07312 8.984315 15.86045       13.34390 
1 1 1 23  20 15 o 13.85650 6.307581 -0.1797868     4.678219 7.177008       7.011393 -6.083190      6.280746 20.29332 8.482341 12.90357 6.275810 7.389748       10.55158 
1 1 1 23  20 16 o 13.45886 6.258040 -1.144686      4.960308 -1.503284      6.877617 -0.7559481     7.160820 15.06406 7.118937 15.59315 7.336720 -0.5290956     10.22285 
1 1 1 23  21 0  o 17.83706 6.057154 4.101777       3.142089 3.597925       5.460474 4.351194       3.841865 19.10361 7.675550 18.62647 6.672472 0.4771461      10.17035 
1 1 1 23  21 1  o 25.11139 5.543297 8.597439       3.301250 11.24148       5.627983 7.210478       4.076156 27.58194 7.943221 22.63145 6.825268 4.950493       10.47278 
1 1 1 23  21 2  o 50.46377 4.276234 32.83569       5.209222 33.73612       6.988102 31.70958       7.814954 50.00680 5.844579 47.56029 6.947926 2.446510       9.079250 
1 1 1 23  21 3  o 36.51677 3.420885 16.94168       3.008718 17.35846       3.377299 15.33878       6.623224 36.78311 3.823501 31.69129 8.429995 5.091820       9.256564 
1 1 1 23  21 4  o 11.25405 4.622097 0.7327142      2.031687 2.818929       2.520985 -3.133032      3.431685 15.21716 5.410134 10.73106 5.058278 4.486102       7.406466 
1 1 1 23  21 5  o 33.87696 3.904075 14.84823       3.164114 14.27394       3.621447 16.70100       6.504665 32.81607 4.659370 33.03871 8.134320 -0.2226334     9.374268 
1 1 1 23  21 6  o 24.73235 8.370975 9.486975       6.000760 0.000000       0.000000 9.486975       6.000760 ?        ?        24.73235 8.370975 0.000000       8.370975 
1 1 1 23  21 7  o 12.17848 5.904802 -7.010769      5.446735 0.000000       0.000000 -7.010769      5.446735 ?        ?        12.17848 5.904802 0.000000       5.904802 
1 1 1 23  21 8  o 12.67327 6.108171 -6.161485      5.616173 0.000000       0.000000 -6.161485      5.616173 ?        ?        12.67327 6.108171 0.000000       6.108171 
1 1 1 23  21 9  o 15.60137 6.535351 1.968349       4.175745 3.151343       5.821613 0.7147160      5.992901 18.06936 7.650866 16.51107 7.358367 1.558287       10.61514 
1 1 1 23  21 10 o 30.34681 6.758268 13.94907       4.869581 21.62895       7.619334 8.646088       6.331396 35.58398 8.829044 22.83654 8.504208 12.74744       12.25861 
1 1 1 23  21 11 o 21.17265 7.606028 7.173302       4.995980 3.595355       6.477460 12.42725       7.849298 18.39816 7.936189 25.47436 9.472300 -7.076199      12.35749 
1 1 1 23  21 12 o 29.37204 7.790802 14.51142       5.667090 16.04579       8.163289 13.08404       7.873517 28.03659 9.754220 25.57874 9.491486 2.457857       13.61004 
1 1 1 23  21 13 o 20.34484 7.819751 6.882083       5.453298 10.12630       8.009271 4.078306       7.445778 22.74126 9.238729 18.68409 8.271239 4.057167       12.40030 
1 1 1 23  21 14 o 26.83499 8.514563 13.62575       6.251057 25.48014       9.495286 4.558107       8.304545 33.84037 10.45893 18.98494 8.545753 14.85543       13.50626 
1 1 1 23  21 15 o 17.79909 7.863997 3.928765       6.698741 0.000000       0.000000 3.928765       6.698741 ?        ?        17.79909 7.863997 0.000000       7.863997 
1 1 1 23  22 0  o 64.30943 3.311174 52.10421       5.171636 59.74748       8.932205 48.24992       6.342948 66.98085 5.521313 61.20998 4.279344 5.770874       6.985534 
1 1 1 23  22 1  o 22.85062 5.721633 7.231636       3.178610 5.847538       4.833037 8.286684       4.219614 20.82468 7.480972 24.02499 6.865044 -3.200308      10.15351 
1 1 1 23  22 2  o 14.57550 5.182929 2.555346       2.313783 1.656019       2.504702 7.788979       6.042253 13.41075 5.258892 23.20788 8.361161 -9.797132      9.877498 
1 1 1 23  22 3  o 26.26916 3.710120 8.933611       2.308992 9.787627       2.823415 7.209087       4.012142 27.20770 4.409182 22.37344 6.776635 4.834259       8.084780 
1 1 1 23  22 4  o 11.66564 5.281180 -1.141290      3.224752 0.000000       0.000000 -1.141290      3.224752 ?        ?        11.66564 5.281180 0.000000       5.281180 
1 1 1 23  22 5  o 21.74658 8.879129 6.130434       7.442515 0.000000       0.000000 6.130434       7.442515 ?        ?        21.74658 8.879129 0.000000       8.879129 
1 1 1 23  22 6  o 56.08663 7.985082 48.12094       10.60585 0.000000       0.000000 48.12094       10.60585 ?        ?        56.08663 7.985082 0.000000       7.985082 
1 1 1 23  22 7  o 24.87358 9.514594 10.59216       8.047154 0.000000       0.000000 10.59216       8.047154 ?        ?        24.87358 9.514594 0.000000       9.514594 
1 1 1 23  22 8  o 29.63504 7.142100 13.51080       5.096792 18.57567       7.246425 8.552084       7.170085 33.04811 8.829844 22.90695 8.922365 10.14116       12.55288 
1 1 1 23  22 9  o 18.61522 8.189607 2.982579       7.192479 0.000000       0.000000 2.982579       7.192479 ?        ?        18.61522 8.189607 0.000000       8.189607 
1 1 1 23  22 10 o 20.05956 8.006586 6.074168       5.901342 0.000000       0.000000 6.074168       5.901342 ?        ?        20.05956 8.006586 0.000000       8.006586 
1 1 1 23  22 11 o 10.88808 5.395016 -9.494339      5.380721 0.000000       0.000000 -9.494339      5.380721 ?        ?        10.88808 5.395016 0.000000       5.395016 
1 1 1 23  22 12 o 16.37079 7.343068 1.503564       6.071493 0.000000       0.000000 1.503564       6.071493 ?        ?        16.37079 7.343068 0.000000       7.343068 
1 1 1 23  22 13 o 16.29191 6.947190 2.873564       4.858593 -7.571713      7.817858 9.446503       6.201655 13.96169 6.836040 22.43336 8.404043 -8.471667      10.83325 
1 1 1 23  22 14 o 20.48415 7.683568 7.387911       5.187353 11.96775       8.416340 4.582358       6.587301 23.22188 9.456971 18.22762 7.932169 4.994261       12.34316 
1 1 1 23  23 0  o 44.57788 3.769081 25.46341       4.056073 22.38291       6.576310 27.35471       5.152905 39.45512 7.100873 45.60918 4.703599 -6.154060      8.517408 
1 1 1 23  23 1  o 11.43611 5.055238 -0.4091431     2.771484 2.512500       4.340041 -2.420962      3.601428 16.67580 6.791081 11.47798 5.335415 5.197826       8.636287 
1 1 1 23  23 2  o 55.67869 3.147237 39.17556       4.252876 38.31511       4.651464 43.56054       10.50048 54.83170 3.499406 53.53215 8.319342 1.299549       9.025370 
1 1 1 23  23 3  o 25.86370 4.362156 8.901757       2.651631 11.78997       3.497838 4.999271       4.065891 29.45827 5.054473 19.15936 6.864153 10.29892       8.524336 
1 1 1 23  23 4  o 14.00095 5.813347 1.360702       3.261527 0.000000       0.000000 1.360702       3.261527 ?        ?        14.00095 5.813347 0.000000       5.813347 
1 1 1 23  23 5  o 15.65539 6.959725 0.2935449      5.327204 0.000000       0.000000 0.2935449      5.327204 ?        ?        15.65539 6.959725 0.000000       6.959725 
1 1 1 23  23 6  o 14.30927 6.719956 -3.235040      5.958038 0.000000       0.000000 -3.235040      5.958038 ?        ?        14.30927 6.719956 0.000000       6.719956 
1 1 1 23  23 7  o 17.85853 7.843929 2.264736       6.573534 0.000000       0.000000 2.264736       6.573534 ?        ?        17.85853 7.843929 0.000000       7.843929 
1 1 1 23  23 8  o 22.36322 8.276299 8.316633       5.979288 12.47730       7.346575 0.1525664      10.29098 25.95197 9.234677 18.96781 8.883387 6.984154       12.81381 
1 1 1 23  23 9  f 17.41862 7.058729 3.804868       4.661927 13.80455       7.801513 -1.749142      5.814188 26.56598 9.509316 14.55337 6.769785 12.01262       11.67292 
1 1 1 23  23 10 o 13.42293 6.220420 -1.561135      4.838349 -7.082870      7.518860 2.341266       6.320918 14.08217 6.853005 17.21573 7.621067 -3.133567      10.24911 
1 1 1 23  23 11 o 26.53584 7.738081 12.13031       5.310634 19.11351       8.853612 8.205797       6.637216 29.58587 10.16470 21.46402 8.515933 8.121853       13.26056 
1 1 1 23  23 12 o 28.85105 7.479963 14.11428       5.302174 28.35344       9.003409 6.553959       6.560468 37.72318 9.730332 19.86400 8.246054 17.85918       12.75448 
1 1 1 23  23 13 o 38.24876 6.645344 23.09671       5.969344 35.44394       10.01527 16.29367       7.434114 41.71613 9.985024 27.91379 9.316256 13.80234       13.65626 
1 1 1 23  24 0  o 21.60510 5.905068 6.619145       3.197095 7.994386       5.069671 5.711083       4.119532 23.07764 7.693171 20.13375 6.932979 2.943895       10.35621 
1 1 1 23  24 1  o 8.554803 4.137725 -3.801375      2.633224 -3.756741      3.764244 -3.844148      3.684906 10.91408 5.189415 10.71947 5.107477 0.1946068      7.281233 
1 1 1 23  24 2  o 34.34979 4.696460 15.81425       3.828411 26.27060       5.565000 6.419245       5.275013 43.87452 5.313062 21.07006 7.777944 22.80446       9.419396 
1 1 1 23  24 3  o 23.00418 6.854036 7.946283       4.129337 0.000000       0.000000 7.946283       4.129337 ?        ?        23.00418 6.854036 0.000000       6.854036 
1 1 1 23  24 4  o 20.02246 6.202402 5.834421       3.337077 0.000000       0.000000 5.834421       3.337077 ?        ?        20.02246 6.202402 0.000000       6.202402 
1 1 1 23  24 5  o 17.13141 7.537303 1.673367       6.093248 0.000000       0.000000 1.673367       6.093248 ?        ?        17.13141 7.537303 0.000000       7.537303 
1 1 1 23  24 6  f 20.35525 8.242857 6.008316       6.352030 0.000000       0.000000 6.008316       6.352030 ?        ?        20.35525 8.242857 0.000000       8.242857 
1 1 1 23  24 7  o 21.99832 8.405951 8.081011       6.276787 0.000000       0.000000 8.081011       6.276787 ?        ?        21.99832 8.405951 0.000000       8.405951 
1 1 1 23  24 8  o 12.63675 5.881388 -1.993573      4.397564 -0.8056356     6.837556 -2.831589      5.742885 15.98007 7.401710 13.91032 6.552781 2.069749       9.885557 
1 1 1 23  24 9  o 31.38970 7.060209 15.67747       5.269326 30.41256       9.498328 9.126381       6.333262 39.77107 9.851839 22.57373 8.485158 17.19734       13.00218 
1 1 1 23  24 10 o 26.08285 7.646529 11.68209       5.173702 22.93982       9.109585 6.321856       6.285862 32.68309 10.26677 19.84587 8.138132 12.83722       13.10098 
1 1 1 23  24 11 o 19.95111 7.428105 6.630137       4.829955 10.61698       7.548079 3.865775       6.285200 22.93740 9.087572 17.84434 7.756949 5.093069       11.94798 
1 1 1 23  25 0  o 40.20426 3.946446 21.08156       3.816701 23.44727       6.214782 19.64901       4.836147 40.27234 6.558064 37.75998 5.410089 2.512363       8.501603 
1 1 1 23  25 1  o 38.33108 4.037199 19.27737       3.714530 17.55467       5.794197 20.47936       4.839931 34.08208 7.202238 38.58776 5.285764 -4.505688      8.933730 
1 1 1 23  25 2  o 19.10303 5.844296 5.235396       2.974106 9.800536       4.296999 1.037403       4.120587 25.43365 6.801265 14.69576 6.334391 10.73789       9.294176 
1 1 1 23  25 3  o 16.48295 4.392702 3.727777       1.796270 3.518176       2.056162 4.403253       3.691177 15.98220 4.853441 17.87419 6.521454 -1.891994      8.129284 
1 1 1 23  25 4  o 8.718289 4.212679 -3.678621      2.712942 0.000000       0.000000 -3.678621      2.712942 ?        ?        8.718289 4.212679 0.000000       4.212679 
1 1 1 23  25 5  o 21.41106 8.588320 7.313927       6.824410 0.000000       0.000000 7.313927       6.824410 ?        ?        21.41106 8.588320 0.000000       8.588320 
1 1 1 23  25 6  o 12.75165 6.198031 -6.807764      6.100089 0.000000       0.000000 -6.807764      6.100089 ?        ?        12.75165 6.198031 0.000000       6.198031 
1 1 1 23  25 7  o 21.63144 8.586432 8.010833       6.750601 0.000000       0.000000 8.010833       6.750601 ?        ?        21.63144 8.586432 0.000000       8.586432 
1 1 1 23  25 8  o 31.99204 7.274518 16.57605       5.542599 22.73758       8.766914 12.47351       7.153672 33.40118 9.995257 25.26970 9.098507 8.131477       13.51621 
1 1 1 23  25 9  o 15.42674 6.711078 1.811323       4.712010 -2.908952      7.204887 5.339220       6.228757 15.09903 7.179333 19.03462 7.978238 -3.935586      10.73290 
1 1 1 23  26 0  o 24.47339 5.656499 8.598767       3.305874 7.123871       5.296921 9.539817       4.231060 21.46781 7.815300 25.03779 6.772380 -3.569979      10.34138 
1 1 1 23  26 1  o 12.49272 5.564421 -0.2908773     3.422049 1.715126       3.990377 -5.867152      6.653041 15.06900 6.355026 13.91562 6.691964 1.153388       9.228691 
1 1 1 23  26 2  o 18.71525 5.747970 5.070198       2.873342 8.373813       4.165884 2.072452       3.968349 23.24360 6.874080 15.34061 6.394475 7.902987       9.388412 
1 1 1 23  26 3  o 13.71881 5.905084 0.9229872      3.571412 0.000000       0.000000 0.9229872      3.571412 ?        ?        13.71881 5.905084 0.000000       5.905084 
1 1 1 23  26 4  o 23.76192 10.46270 11.04187       11.76227 0.000000       0.000000 11.04187       11.76227 ?        ?        23.76192 10.46270 0.000000       10.46270 
1 1 1 23  26 5  o 16.91504 8.240798 -6.848042      10.95666 0.000000       0.000000 -6.848042      10.95666 ?        ?        16.91504 8.240798 0.000000       8.240798 
1 1 1 23  26 6  o 16.62309 8.097269 -6.493023      10.56658 0.000000       0.000000 -6.493023      10.56658 ?        ?        16.62309 8.097269 0.000000       8.097269 
1 1 1 23  26 7  o 16.12300 7.182012 1.516474       5.702095 2.466608       6.464211 -1.815287      12.10487 17.26643 7.671783 18.52932 8.939819 -1.262886      11.78035 
1 1 1 23  27 0  o 17.70001 5.878077 4.475860       2.960247 3.966116       4.498858 4.865077       3.931175 17.66132 7.009891 18.44296 6.729948 -0.7816467     9.717549 
1 1 1 23  27 1  o 50.97859 4.738190 35.40323       5.818838 34.51335       6.788857 37.86695       11.29601 49.11314 5.783075 44.24044 10.61392 4.872696       12.08715 
1 1 1 23  27 2  o 13.21536 5.276448 1.723757       2.563753 1.300121       3.562525 2.178832       3.692346 14.01633 5.961895 15.05021 6.211245 -1.033876      8.609516 
1 1 1 23  27 3  o 10.31764 4.940289 -3.663561      3.538757 0.000000       0.000000 -3.663561      3.538757 ?        ?        10.31764 4.940289 0.000000       4.940289 
1 1 1 23  27 4  o 18.58006 8.035552 4.065090       6.674855 0.000000       0.000000 4.065090       6.674855 ?        ?        18.58006 8.035552 0.000000       8.035552 
1 1 1 23  28 0  o 29.41752 5.112342 12.18004       3.531957 15.64100       5.715568 10.04194       4.492358 30.97660 7.623998 25.11174 7.052447 5.864862       10.38568 
1 1 1 23  28 1  o 13.41087 5.733514 1.034281       3.324670 2.294710       3.922515 -2.181283      6.265187 15.34851 6.374271 14.79493 6.929794 0.5535736      9.415592 
1 1 1 24  0  0  o 61.31809 5.460686 47.41753       8.003861 47.41753       8.003861 47.41753       8.003861 61.31809 5.460686 61.31809 5.460686 0.000000       0.000000 
1 1 1 24  0  1  o 14.41432 8.571654 2.948617       5.263224 2.948617       5.263224 2.948617       5.263224 14.41432 8.571654 14.41432 8.571654 0.000000       0.000000 
1 1 1 24  0  2  o 40.19012 7.562050 22.05800       6.640453 22.05800       6.640453 22.05800       6.640453 40.19012 7.562050 40.19012 7.562050 0.000000       0.000000 
1 1 1 24  0  3  o 88.78700 3.931738 97.33539       8.468804 97.33539       8.468804 97.33539       8.468804 88.78700 3.931738 88.78700 3.931738 0.000000       0.000000 
1 1 1 24  0  4  o 110.7462 4.068565 151.3394       10.94642 151.3394       10.94642 151.3394       10.94642 110.7462 4.068565 110.7462 4.068565 0.000000       0.000000 
1 1 1 24  0  5  o 76.73466 5.343722 73.93770       9.879185 73.93770       9.879185 73.93770       9.879185 76.73466 5.343722 76.73466 5.343722 0.000000       0.000000 
1 1 1 24  0  6  o 53.73225 4.666280 36.43488       5.999537 36.43488       5.999537 36.43488       5.999537 53.73225 4.666280 53.73225 4.666280 0.000000       0.000000 
1 1 1 24  0  7  o 8.329089 5.733463 -2.643329      3.832055 -2.643329      3.832055 -2.643329      3.832055 8.329089 5.733463 8.329089 5.733463 0.000000       0.000000 
1 1 1 24  0  8  o 40.70125 5.598788 21.73607       5.254684 21.73607       5.254684 21.73607       5.254684 40.70125 5.598788 40.70125 5.598788 0.000000       0.000000 
1 1 1 24  0  9  o 31.77940 7.233351 14.47661       4.882207 14.47661       4.882207 14.47661       4.882207 31.77940 7.233351 31.77940 7.233351 0.000000       0.000000 
1 1 1 24  0  10 o 16.76332 8.464415 5.390514       4.283336 5.390514       4.283336 5.390514       4.283336 16.76332 8.464415 16.76332 8.464415 0.000000       0.000000 
1 1 1 24  0  11 o 15.09820 8.282181 4.281886       4.377501 4.281886       4.377501 4.281886       4.377501 15.09820 8.282181 15.09820 8.282181 0.000000       0.000000 
1 1 1 24  0  12 o 27.39371 8.378791 11.97707       4.886549 11.97707       4.886549 11.97707       4.886549 27.39371 8.378791 27.39371 8.378791 0.000000       0.000000 
1 1 1 24  0  13 o 6.175645 4.489263 -7.871502      3.810316 -7.871502      3.810316 -7.871502      3.810316 6.175645 4.489263 6.175645 4.489263 0.000000       0.000000 
1 1 1 24  0  14 o 9.163590 6.242216 -1.941431      4.284568 -1.941431      4.284568 -1.941431      4.284568 9.163590 6.242216 9.163590 6.242216 0.000000       0.000000 
1 1 1 24  0  15 o 38.85094 6.660234 21.12766       5.749915 21.12766       5.749915 21.12766       5.749915 38.85094 6.660234 38.85094 6.660234 0.000000       0.000000 
1 1 1 24  0  16 o 15.95270 8.503131 5.241029       4.488154 5.241029       4.488154 5.241029       4.488154 15.95270 8.503131 15.95270 8.503131 0.000000       0.000000 
1 1 1 24  0  17 o 12.73636 7.752519 2.637967       4.511735 2.637967       4.511735 2.637967       4.511735 12.73636 7.752519 12.73636 7.752519 0.000000       0.000000 
1 1 1 24  0  18 o 6.502455 4.707056 -7.086067      3.960345 -7.086067      3.960345 -7.086067      3.960345 6.502455 4.707056 6.502455 4.707056 0.000000       0.000000 
1 1 1 24  0  19 o 17.37355 9.094506 6.772651       5.060061 6.772651       5.060061 6.772651       5.060061 17.37355 9.094506 17.37355 9.094506 0.000000       0.000000 
1 1 1 24  0  20 o 9.220917 6.356892 -2.216142      4.752941 -2.216142      4.752941 -2.216142      4.752941 9.220917 6.356892 9.220917 6.356892 0.000000       0.000000 
1 1 1 24  0  21 o 14.75745 8.441673 4.988675       4.791031 4.988675       4.791031 4.988675       4.791031 14.75745 8.441673 14.75745 8.441673 0.000000       0.000000 
1 1 1 24  0  22 o 10.08483 6.765126 -0.1910147     4.667940 -0.1910147     4.667940 -0.1910147     4.667940 10.08483 6.765126 10.08483 6.765126 0.000000       0.000000 
1 1 1 24  0  23 o 12.19672 7.731637 2.643183       4.967662 2.643183       4.967662 2.643183       4.967662 12.19672 7.731637 12.19672 7.731637 0.000000       0.000000 
1 1 1 24  1  0  o 60.11120 3.282717 44.53544       4.790419 39.65180       9.256879 46.32166       5.598349 55.58668 6.987770 61.19782 3.772279 -5.611137      7.940970 
1 1 1 24  1  1  o 112.7797 2.508972 155.8099       6.895455 153.2210       9.651332 158.5092       9.855154 111.4837 3.557099 113.3879 3.571104 -1.904182      5.040411 
1 1 1 24  1  2  o 21.24677 5.096096 5.849660       2.604566 6.034482       3.631526 5.653883       3.737590 21.65868 6.421331 21.12132 6.567544 0.5373688      9.185104 
1 1 1 24  1  3  o 126.2429 3.460577 196.6111       10.63608 213.4336       13.14198 164.6726       18.10808 131.2040 4.115430 113.7099 6.562765 17.49405       7.746396 
1 1 1 24  1  4  o 34.30275 5.371243 15.09259       4.342703 9.739902       5.359201 25.32854       7.411029 27.04616 7.739422 43.93957 7.168185 -16.89341      10.54901 
1 1 1 24  1  5  o 40.96409 4.252326 21.08196       4.183200 22.19396       5.021914 18.56151       7.560604 41.79785 5.031432 36.83956 8.581928 4.958286       9.948105 
1 1 1 24  1  6  o 37.49036 5.337552 18.05557       4.738800 18.05557       4.738800 0.000000       0.000000 37.49036 5.337552 ?        ?        0.000000       5.337552 
1 1 1 24  1  7  o 13.97187 5.517820 1.502791       2.774573 1.625892       3.725655 1.349503       4.157436 15.63655 6.319733 15.99588 6.595111 -0.3593216     9.134250 
1 1 1 24  1  8  o 40.82337 3.832111 20.93470       3.767690 21.85596       5.068045 19.79647       5.633306 41.23605 5.155805 38.79313 6.165027 2.442913       8.036783 
1 1 1 24  1  9  o 16.00422 5.815809 2.841133       2.931439 3.572408       3.887006 1.876647       4.463987 18.01288 6.671747 16.81552 6.872463 1.197359       9.578254 
1 1 1 24  1  10 o 18.72289 5.960373 4.551095       3.061073 3.880037       4.026242 5.470321       4.712278 18.44441 6.797576 20.89670 7.399933 -2.452291      10.04819 
1 1 1 24  1  11 o 43.65512 3.923716 24.17060       4.129672 21.40415       5.589747 27.49519       6.127735 40.09476 5.896956 45.68650 5.622417 -5.591740      8.147740 
1 1 1 24  1  12 f 25.89732 5.865688 9.162086       3.615577 10.89325       4.939574 7.164161       5.306521 27.65020 7.245049 22.83583 7.868449 4.814373       10.69594 
1 1 1 24  1  13 o 22.38173 5.954482 6.945269       3.304178 4.483130       4.344309 10.32417       5.089234 19.05087 7.053833 26.59143 7.519788 -7.540564      10.31037 
1 1 1 24  1  14 o 19.84159 6.165965 5.468410       3.295026 4.467762       4.467489 6.662115       4.879456 18.93752 7.124777 21.69624 7.541709 -2.758715      10.37496 
1 1 1 24  1  15 o 9.799125 4.644330 -3.004779      2.967788 -4.767683      4.212942 -1.268168      4.181406 11.22859 5.380181 13.21472 5.994908 -1.986128      8.055140 
1 1 1 24  1  16 o 22.10606 6.131762 7.059553       3.418706 5.805225       4.546082 8.692197       5.186537 20.20286 7.255747 23.71441 7.776438 -3.511543      10.63573 
1 1 1 24  1  17 o 11.93414 5.288585 -0.2702819     3.051753 -0.7052379     4.076826 0.2840710      4.602489 13.25300 5.974671 14.69806 6.505002 -1.445061      8.832425 
1 1 1 24  1  18 o 10.94216 5.020527 -1.328544      3.041550 -3.652311      4.015968 1.797429       4.657862 11.21639 5.340794 15.75524 6.762124 -4.538850      8.616867 
1 1 1 24  1  19 o 16.28863 6.299374 3.463580       3.554542 0.9224679      4.722891 6.783463       5.398306 14.92342 6.597859 20.47647 7.802560 -5.553058      10.21820 
1 1 1 24  1  20 o 12.50112 5.614215 -0.1476875     3.561117 -1.245258      4.527588 1.632791       5.766591 13.04682 6.036056 16.06749 7.185431 -3.020674      9.384263 
1 1 1 24  1  21 o 11.39841 5.301959 -1.511214      3.565632 -1.828624      4.460485 -0.9493446     5.934579 12.46242 5.840444 14.49673 6.775266 -2.034309      8.945111 
1 1 1 24  1  22 o 12.13605 5.524157 -0.3284154     3.587747 0.4001612      4.513120 -1.579453      5.913908 13.72372 6.226746 13.96059 6.598632 -0.2368727     9.072723 
1 1 1 24  1  23 o 18.33823 6.674628 5.806677       3.863272 6.254816       4.836010 5.016282       6.422482 18.56205 7.298798 17.59247 7.739272 0.9695835      10.63808 
1 1 1 24  2  0  o 119.9487 2.509456 176.2016       7.335188 175.5415       10.21240 176.9050       10.54252 119.3826 3.514176 119.8083 3.615085 -0.4257355     5.041654 
1 1 1 24  2  1  o 31.77504 3.818295 12.62827       2.897429 12.54541       4.040443 12.71599       4.157218 31.25564 5.505798 31.43813 5.633291 -0.1824951     7.877041 
1 1 1 24  2  2  o 34.56148 3.600582 14.88175       2.988090 12.09401       4.099455 18.04175       4.364590 30.59373 5.708587 37.78267 4.852278 -7.188938      7.492167 
1 1 1 24  2  3  o 47.53135 3.489532 28.00391       4.013708 36.16952       6.317447 22.47680       5.197523 53.64624 4.885997 42.10476 5.174253 11.54148       7.116590 
1 1 1 24  2  4  o 109.4570 3.427057 147.9544       9.129889 147.2690       16.37416 148.2636       10.99823 107.5351 6.275727 109.2383 4.139022 -1.703209      7.517729 
1 1 1 24  2  5  o 24.16028 5.003221 7.572302       2.848669 9.835307       3.871006 4.899129       4.207215 27.35596 5.974497 20.23672 7.004660 7.119238       9.206512 
1 1 1 24  2  6  o 29.98532 4.392801 11.44390       3.114686 12.08578       4.058885 10.52454       4.857599 30.43314 5.681891 27.97372 7.111441 2.459415       9.102553 
1 1 1 24  2  7  o 21.92003 6.666496 6.305408       3.877349 6.305408       3.877349 0.000000       0.000000 21.92003 6.666496 ?        ?        0.000000       6.666496 
1 1 1 24  2  8  o 12.34932 5.374726 -0.3003494     3.025129 -0.4989935E-01 3.441832 -1.150863      6.342638 13.40124 5.782897 17.10612 7.599998 -3.704882      9.549967 
1 1 1 24  2  9  o 30.64937 5.047826 12.22487       3.639043 13.66860       4.344994 8.832804       6.660054 32.16486 5.754622 25.62246 8.815557 6.542397       10.52757 
1 1 1 24  2  10 o 33.33488 5.970561 14.83198       4.671969 14.13557       6.102992 15.81782       7.261252 31.58814 7.938734 32.96711 8.852541 -1.378977      11.89079 
1 1 1 24  2  11 o 27.79124 6.708244 10.70125       4.490925 7.537929       5.674040 16.00622       7.347877 23.55708 8.135520 32.84391 8.942052 -9.286827      12.08913 
1 1 1 24  2  12 o 21.92175 7.116645 6.614956       4.349170 4.239569       5.785563 9.701423       6.594915 20.03654 7.950421 25.81811 8.775233 -5.781570      11.84120 
1 1 1 24  2  13 o 32.75099 6.560622 15.02067       5.053409 8.121580       6.637706 24.53259       7.793922 23.90833 8.741755 40.80107 8.124413 -16.89274      11.93417 
1 1 1 24  2  14 o 20.85533 7.280859 6.050757       4.550392 9.866788       6.781251 2.925078       6.137283 25.30968 8.884392 18.78836 7.900012 6.521315       11.88876 
1 1 1 24  2  15 o 14.12172 6.203266 0.8778558E-01  4.112206 5.512389       6.096870 -4.439564      5.569869 20.70181 8.178243 13.48804 6.383781 7.213776       10.37479 
1 1 1 24  2  16 o 19.31680 7.130227 5.105289       4.432893 5.649517       6.478058 4.626037       6.079063 20.74180 8.350965 19.68352 8.029270 1.058283       11.58481 
1 1 1 24  2  17 o 11.17941 5.355424 -4.413058      4.169137 -9.622658      6.086896 0.1908112      5.722097 12.02082 5.915077 15.90225 7.131112 -3.881433      9.265036 
1 1 1 24  2  18 o 15.04962 6.268026 1.992634       3.808398 4.055813       6.411918 0.8680372      4.733886 18.78925 7.995422 15.09101 6.641427 3.698236       10.39400 
1 1 1 24  2  19 o 12.83167 5.821692 -0.6266067     3.944408 4.325902       6.638027 -3.329738      4.904107 18.71417 8.052859 12.57543 5.963094 6.138747       10.02033 
1 1 1 24  2  20 o 10.53909 5.069829 -3.942636      3.825654 -6.898938      6.482939 -2.363125      4.738697 12.87103 6.285560 12.67721 5.965847 0.1938238      8.666002 
1 1 1 24  2  21 o 14.81938 6.332561 2.135352       4.052083 6.905347       6.935600 -0.3366341     4.992846 19.67812 8.342275 13.92156 6.404011 5.756560       10.51689 
1 1 1 24  2  22 o 16.94687 6.780741 4.439638       4.243105 4.857710       7.195587 4.216766       5.253735 17.99115 8.037449 17.02376 7.240525 0.9673939      10.81785 
1 1 1 24  2  23 o 13.70515 6.128788 1.056216       4.194937 12.04126       7.654160 -3.659947      5.015233 22.19584 9.026245 11.96382 5.767714 10.23202       10.71166 
1 1 1 24  3  0  o 55.83727 2.713869 38.30907       3.681685 40.05428       5.052514 36.33330       5.375897 56.90574 3.662925 54.08042 4.109975 2.825321       5.505353 
1 1 1 24  3  1  o 87.71337 2.468080 94.31873       5.270225 93.33031       7.275487 95.41001       7.644656 87.00278 3.438340 87.92635 3.575276 -0.9235611     4.960321 
1 1 1 24  3  2  o 34.39276 4.030729 14.82312       3.314190 13.81840       5.040401 15.58833       4.398786 32.48516 6.592687 34.93567 5.335838 -2.450508      8.481431 
1 1 1 24  3  3  o 141.0958 3.669058 246.0222       12.60480 245.7360       22.37573 246.1552       15.25569 138.8278 6.633198 140.6664 4.456089 -1.838623      7.990998 
1 1 1 24  3  4  o 28.57501 4.389894 10.37725       2.959242 10.55960       3.903754 10.13089       4.537350 28.43878 5.828935 27.62292 6.789477 0.8158569      8.948379 
1 1 1 24  3  5  o 26.73880 4.565644 9.158132       2.868233 11.55293       3.718002 5.637988       4.507700 29.89335 5.297785 21.38910 7.255087 8.504248       8.983475 
1 1 1 24  3  6  o 14.44534 5.643412 1.718410       2.875386 5.138365       4.049658 -1.758725      4.083372 20.38261 6.876796 13.24984 5.975795 7.132771       9.110458 
1 1 1 24  3  7  o 11.06833 4.997323 -1.339917      2.864613 -1.505409      3.898761 -1.145756      4.222985 13.06135 5.869377 13.92331 6.192741 -0.8619576     8.532269 
1 1 1 24  3  8  o 16.47602 6.327111 2.589369       3.567944 1.306505       4.225637 5.775447       6.659323 15.98387 6.625108 22.75434 8.667162 -6.770470      10.90925 
1 1 1 24  3  9  o 20.77176 5.807796 5.745449       3.053771 7.952083       3.830844 1.898980       5.057785 24.23577 6.394728 17.57251 7.262558 6.663261       9.676637 
1 1 1 24  3  10 o 19.74553 6.007725 5.168545       3.148455 1.859368       3.869102 11.65499       5.416935 15.90258 6.435565 28.77977 7.609104 -12.87719      9.965690 
1 1 1 24  3  11 f 28.09353 4.963094 10.39609       3.273554 7.861178       4.122906 14.72013       5.384769 23.81917 6.779298 32.52234 7.001728 -8.703169      9.745926 
1 1 1 24  3  12 o 12.63825 5.395013 0.3346080      2.935683 1.216747       3.859087 -0.8770744     4.522832 15.05478 6.292858 14.29553 6.380303 0.7592516      8.961491 
1 1 1 24  3  13 o 15.25983 5.707110 2.586284       2.857518 1.288449       3.657468 4.619678       4.578059 14.74043 6.141172 19.32764 7.224699 -4.587207      9.482103 
1 1 1 24  3  14 o 17.25313 5.963502 3.879850       3.049021 5.980937       3.894228 0.5514205      4.901388 20.62075 6.736930 15.64975 6.825799 4.971001       9.590504 
1 1 1 24  3  15 o 35.72498 4.523997 16.88934       3.850319 23.68789       5.181932 8.509498       5.753093 41.89583 5.186209 23.61853 8.190241 18.27730       9.694163 
1 1 1 24  3  16 f 20.04562 6.136648 5.768002       3.278416 7.491553       4.307263 3.394405       5.054670 22.35524 7.064689 17.89013 7.312504 4.465113       10.16772 
1 1 1 24  3  17 f 20.14756 6.188430 5.940391       3.330483 9.818650       4.413069 0.8088405      5.076292 25.32295 6.944407 15.60890 6.873081 9.714055       9.770570 
1 1 1 24  3  18 o 11.20725 5.102625 -1.025753      3.063447 -0.6191344     3.942627 -1.645275      4.866537 12.96290 5.856767 13.57113 6.271317 -0.6082363     8.580859 
1 1 1 24  3  19 o 15.60483 6.006733 3.113481       3.221054 3.932306       4.304432 2.071470       4.855752 17.20824 6.848071 15.89587 6.864119 1.312367       9.695990 
1 1 1 24  3  20 o 11.76408 5.306290 -0.4006455     3.220682 -0.8960847     4.200613 0.3060148      5.016755 12.81756 5.888042 14.52934 6.581407 -1.711777      8.830853 
1 1 1 24  3  21 o 8.972230 4.376193 -4.408613      3.114926 -3.168530      4.065192 -6.172088      4.847751 11.18579 5.339339 11.00285 5.386421 0.1829376      7.584331 
1 1 1 24  3  22 o 8.711955 4.219569 -3.444386      2.762497 -3.030549      3.273852 -4.467527      5.147688 9.897338 4.742439 11.90573 5.764911 -2.008389      7.464913 
1 1 1 24  3  23 f 20.94164 5.913421 7.144344       3.149520 8.446903       3.869182 4.586342       5.422141 22.01518 6.651973 17.07604 7.311758 4.939138       9.884864 
1 1 1 24  4  0  o 36.91963 3.539824 16.93382       3.145780 11.28085       4.309131 23.38412       4.603005 29.43312 6.203722 43.23350 4.431685 -13.80038      7.624041 
1 1 1 24  4  1  o 29.40858 3.931394 10.86610       2.746940 11.43649       3.680536 10.14884       4.127248 29.85895 5.249798 27.85715 6.235538 2.001793       8.151216 
1 1 1 24  4  2  o 20.45676 6.127863 5.359162       3.293900 9.343086       6.679479 4.079024       3.786304 26.93694 8.824504 18.88078 6.637790 8.056160       11.04229 
1 1 1 24  4  3  o 50.28217 2.972091 31.19296       3.625524 31.18797       5.075701 31.19815       5.180432 49.97005 4.207258 49.95198 4.297495 0.1807404E-01  6.014107 
1 1 1 24  4  4  o 88.49619 3.220281 96.66110       6.933135 103.4104       10.77174 91.88742       9.059044 90.79121 4.886626 85.82989 4.345333 4.961319       6.539192 
1 1 1 24  4  5  o 44.32254 3.754054 24.51384       4.016622 30.81865       5.886371 19.02040       5.494570 49.32696 4.964415 38.23859 6.101445 11.08838       7.865942 
1 1 1 24  4  6  o 42.13809 3.379001 22.09980       3.440700 23.52562       4.394973 19.84239       5.530041 43.23561 4.225235 39.03677 6.005414 4.198837       7.342861 
1 1 1 24  4  7  o 32.16327 4.172516 13.12418       3.193347 17.21149       4.023126 6.163643       5.250082 36.76158 4.590681 22.31346 7.818449 14.44812       9.066559 
1 1 1 24  4  8  o 11.99570 5.053277 0.3621209      2.518531 2.468741       3.024077 -4.406636      4.549906 15.60603 5.863900 12.38293 5.833061 3.223104       8.271029 
1 1 1 24  4  9  o 28.21540 5.315050 10.48598       3.520481 10.75668       3.888307 9.254893       8.292157 28.39846 5.814512 26.47745 9.755737 1.921013       11.35707 
1 1 1 24  4  10 o 54.19084 3.373554 36.74256       4.432925 46.95506       5.860116 23.08143       6.777719 60.99190 3.964217 41.09706 7.019495 19.89484       8.061533 
1 1 1 24  4  11 o 45.89013 3.667149 26.60305       4.066848 32.14766       5.167678 17.58210       6.591527 50.16827 4.267445 35.01139 7.912579 15.15688       8.989994 
1 1 1 24  4  12 o 15.61593 5.863923 2.658230       3.023077 3.503109       3.751759 1.094160       5.104649 17.46907 6.538183 16.58563 7.097949 0.8834381      9.650322 
1 1 1 24  4  13 o 27.73305 5.199739 10.37141       3.385040 15.17694       4.343771 2.940194       5.401643 33.50042 5.512408 18.28863 7.526589 15.21178       9.329319 
1 1 1 24  4  14 f 13.17312 5.524974 0.8759719      2.990031 -1.588833      3.677765 5.681387       5.135210 12.18998 5.565736 20.57692 7.659600 -8.386946      9.468204 
1 1 1 24  4  15 o 11.05794 4.976432 -0.8639253     2.814333 -1.195247      3.482161 -0.2398493     4.779064 12.06709 5.472876 14.77542 6.578815 -2.708332      8.557638 
1 1 1 24  4  16 o 22.84923 6.053432 7.555267       3.423949 8.561090       4.322468 5.861133       5.609768 23.81354 6.991410 20.50848 7.918406 3.305052       10.56319 
1 1 1 24  4  17 o 12.00756 5.311772 -0.1889694     3.065384 1.272406       3.904830 -2.535862      4.948434 14.59967 6.226916 13.31849 6.212110 1.281180       8.795726 
1 1 1 24  4  18 o 12.27443 5.368681 0.2356541      3.050661 2.848839       3.928900 -3.731846      4.841104 16.00521 6.482205 12.40578 5.894787 3.599427       8.761706 
1 1 1 24  4  19 o 10.77975 5.005295 -1.684454      3.156009 -4.813251      3.872446 4.504480       5.446339 10.28673 4.985517 18.24744 7.538437 -7.960709      9.037888 
1 1 1 24  4  20 o 13.50833 5.630398 1.653257       3.076395 2.043373       3.979847 1.074096       4.849190 14.82445 6.303374 14.85191 6.619000 -0.2745247E-01 9.140224 
1 1 1 24  4  21 o 10.45489 4.780314 -0.8338231     2.725621 -0.6682804     3.248881 -1.227212      5.008293 11.47579 5.236400 13.39869 6.249533 -1.922898      8.153316 
1 1 1 24  4  22 o 15.31024 5.714050 3.425548       2.861471 1.069895       3.399470 9.151788       5.300176 13.01331 5.680084 21.67349 7.827942 -8.660174      9.671610 
1 1 1 24  5  0  o 11.26677 4.880557 -0.2760193     2.470339 -0.4408844     3.254796 -0.5199941E-01 3.794048 12.81503 5.576245 14.21614 6.102280 -1.401112      8.266336 
1 1 1 24  5  1  o 37.05295 4.382344 17.25243       3.880496 22.36363       7.385127 15.30303       4.560856 41.16419 7.643430 34.52904 5.612923 6.635151       9.482982 
1 1 1 24  5  2  o 15.02184 5.659178 2.143567       2.820647 2.016597       4.273407 2.241586       3.754732 16.98771 6.802255 16.50535 6.448670 0.4823627      9.373155 
1 1 1 24  5  3  o 72.48663 3.003843 64.74926       5.294552 72.90884       8.866127 60.22673       6.600719 76.27879 4.793977 69.63317 3.905557 6.645615       6.183493 
1 1 1 24  5  4  o 35.46989 3.691583 15.73173       3.144234 17.02981       3.969270 13.54509       5.151662 36.69075 4.535824 31.94328 6.825274 4.747461       8.195003 
1 1 1 24  5  5  o 22.63524 5.080844 6.686144       2.733655 7.880921       3.427298 4.596895       4.532142 24.44508 5.834631 20.07074 7.239984 4.374332       9.298402 
1 1 1 24  5  6  o 78.65952 2.858211 76.33927       5.469643 84.76895       7.309899 65.61579       8.244677 82.57838 3.641482 72.14117 4.715650 10.43721       5.957998 
1 1 1 24  5  7  o 71.72406 2.916813 63.59398       5.087479 67.96109       6.638643 57.37975       7.919099 73.83012 3.701666 67.26562 4.863958 6.564499       6.112317 
1 1 1 24  5  8  o 19.26751 5.646503 4.874578       2.821621 7.442295       3.377615 -1.056538      5.133397 23.58430 5.893867 15.38953 6.837297 8.194777       9.026976 
1 1 1 24  5  9  o 24.04345 5.024645 7.623977       2.849014 8.900760       3.450249 4.887621       5.051009 25.81552 5.642352 20.48227 7.601846 5.333248       9.467007 
1 1 1 24  5  10 o 58.43744 3.573802 42.87425       5.064958 43.17389       5.682299 41.71565       11.17348 58.41763 4.016007 53.89567 8.811642 4.521961       9.683664 
1 1 1 24  5  11 o 58.29519 3.240492 42.55971       4.585296 50.32425       5.839881 30.07822       7.404224 63.08073 3.816876 46.95926 6.656610 16.12148       7.673265 
1 1 1 24  5  12 o 11.46226 5.020696 -0.2804463     2.676534 0.4814367      3.150445 -2.256932      5.074282 13.15272 5.600935 14.18693 6.500136 -1.034212      8.580340 
1 1 1 24  5  13 o 14.82528 5.657738 2.320599       2.841112 3.843752       3.381925 -1.332583      5.237545 17.47815 6.260428 14.87222 6.731895 2.605933       9.193007 
1 1 1 24  5  14 o 9.226691 4.372381 -2.740038      2.628549 -2.985466      3.077127 -2.077498      5.055788 10.06215 4.757134 14.05028 6.456279 -3.988135      8.019592 
1 1 1 24  5  15 o 31.55820 4.655786 13.31287       3.473071 12.45020       4.240455 15.07082       6.053313 29.61962 6.078749 31.16184 7.947553 -1.542219      10.00574 
1 1 1 24  5  16 o 24.62607 5.549794 8.575660       3.250478 12.06654       4.059371 2.337879       5.426332 29.07357 5.930742 17.23562 7.345500 11.83795       9.440872 
1 1 1 24  5  17 o 25.32554 5.465950 9.124533       3.274303 11.65584       4.092510 4.622177       5.458048 28.22280 6.126614 18.94939 7.652585 9.273411       9.802931 
1 1 1 24  5  18 o 15.35651 5.850416 2.943487       3.034598 2.608096       3.696247 3.637004       5.315124 15.51024 6.285311 17.70034 7.390953 -2.190108      9.702129 
1 1 1 24  5  19 o 13.13378 5.484729 1.369771       2.927470 -0.5367871     3.624834 4.945638       4.964250 12.37750 5.601746 18.41639 7.345856 -6.038896      9.238028 
1 1 1 24  5  20 o 11.24507 4.955750 0.1199013      2.644369 -0.5151380     3.063073 1.978118       5.239686 11.38172 5.150412 15.77580 6.963209 -4.394080      8.661005 
1 1 1 24  5  21 o 27.09015 5.055231 10.73970       3.214532 13.52779       3.823178 4.013867       5.938051 30.12502 5.406544 17.32731 7.535863 12.79770       9.274693 
1 1 1 24  5  22 o 9.192930 4.384397 -2.479884      2.729090 -2.830854      3.171729 -1.479091      5.355905 9.811440 4.692290 13.41443 6.321942 -3.602993      7.873026 
1 1 1 24  6  0  o 77.97897 2.828213 74.73371       5.365447 74.02232       6.793118 75.91353       8.748219 77.39683 3.611679 78.03768 4.620913 -0.6408539     5.864901 
1 1 1 24  6  1  o 98.07070 3.398960 118.6465       8.110813 122.0748       12.33387 116.0344       10.76614 98.70361 5.145556 96.49648 4.591559 2.207130       6.896316 
1 1 1 24  6  2  o 48.00580 3.449985 28.56814       4.009048 28.77033       4.991316 28.20055       6.729939 47.94694 4.318086 46.89112 6.028926 1.055820       7.415781 
1 1 1 24  6  3  o 58.53066 3.391381 42.41655       4.816507 38.93402       5.552244 53.00688       9.682248 55.85899 4.107592 64.29582 6.258674 -8.436832      7.486207 
1 1 1 24  6  4  o 63.45910 2.948211 49.68916       4.546740 60.81073       6.196884 36.72056       6.691710 69.99231 3.645747 53.80835 5.166723 16.18396       6.323488 
1 1 1 24  6  5  o 25.73576 4.827065 8.564778       2.916127 11.29840       3.752327 4.395931       4.633821 29.46739 5.425290 19.89479 7.299163 9.572598       9.094589 
1 1 1 24  6  6  o 36.71821 3.651762 16.89708       3.224269 14.60046       3.908969 21.78546       5.702958 33.72547 4.899514 40.92268 5.888002 -7.197208      7.659883 
1 1 1 24  6  7  o 30.66781 4.230176 11.98684       3.077271 9.971279       3.730461 16.27908       5.443865 27.43148 5.764035 34.86576 6.649860 -7.434282      8.800269 
1 1 1 24  6  8  o 53.58049 3.148541 35.70989       4.092926 40.78937       5.186587 27.32535       6.663640 57.03769 3.752343 45.52192 6.165295 11.51578       7.217405 
1 1 1 24  6  9  o 39.94195 3.612996 20.08569       3.478688 19.89241       4.237133 20.48537       6.093047 39.40817 4.492270 38.93015 6.661973 0.4780235      8.035071 
1 1 1 24  6  10 o 24.01617 5.073316 7.667360       2.875952 8.046187       3.424814 6.761318       5.296519 24.35342 5.845288 22.55066 7.856273 1.802769       9.792263 
1 1 1 24  6  11 o 29.56575 4.747636 11.47456       3.304844 10.90965       3.578850 14.74565       8.611996 28.55538 5.339280 30.65756 10.01867 -2.102179      11.35261 
1 1 1 24  6  12 o 22.75266 5.303756 7.038070       2.886188 7.296678       3.373826 6.332372       5.573279 22.93616 5.976831 21.78879 8.003140 1.147373       9.988632 
1 1 1 24  6  13 o 14.44906 5.539247 2.167138       2.731512 5.550204       3.162695 -7.764679      5.418967 19.99081 6.008316 11.98891 5.830594 8.001900       8.372316 
1 1 1 24  6  14 o 11.77466 5.454403 -2.247417      3.714502 -1.544893      5.318568 -2.916384      5.189989 14.70329 6.705543 13.74280 6.393863 0.9604940      9.265300 
1 1 1 24  6  15 o 10.26031 4.872962 -3.325596      3.300242 -4.055448      4.435413 -2.420346      4.939701 11.90608 5.653034 13.56194 6.284980 -1.655868      8.453269 
1 1 1 24  6  16 o 37.17490 5.470296 19.19947       4.807575 19.66967       7.028058 18.78595       6.590858 34.85128 8.378886 34.43089 8.007055 0.4203873      11.58959 
1 1 1 24  6  17 o 12.05011 5.537348 -1.491324      3.719415 5.612805       5.231999 -8.749859      5.288551 19.72135 7.638321 11.13360 5.485291 8.587746       9.403849 
1 1 1 24  6  18 o 16.43588 6.833876 2.896107       4.516089 3.274020       5.113737 1.556884       9.626513 17.19971 7.220331 18.88706 8.760059 -1.687355      11.35217 
1 1 1 24  6  19 o 25.91458 6.304301 10.40749       3.942636 11.78843       4.260673 2.179705       10.39995 27.48136 6.470072 18.95469 8.894184 8.526663       10.99856 
1 1 1 24  6  20 o 20.90767 6.641169 7.180490       3.802033 7.121754       4.152108 7.485404       9.460357 20.58857 6.963201 20.37884 9.151457 0.2097263      11.49936 
1 1 1 24  6  21 o 16.23204 6.353287 3.833743       3.649884 4.329402       3.985447 1.256598       9.087722 16.90015 6.631756 17.21779 8.150581 -0.3176384     10.50772 
1 1 1 24  6  22 o 12.45647 5.405636 0.9682867      3.041611 0.8006775      3.680666 1.329239       5.401355 13.05960 5.796559 14.95891 6.796954 -1.899310      8.933010 
1 1 1 24  7  0  o 38.70687 4.064950 18.73935       3.777095 15.56806       5.925982 20.90919       4.901812 34.28376 7.316072 40.63702 5.059177 -6.353268      8.894953 
1 1 1 24  7  1  f 17.52007 5.607247 3.798577       2.706278 4.187060       3.567713 3.272134       4.153162 18.81423 6.452907 18.21974 6.866346 0.5944920      9.422670 
1 1 1 24  7  2  o 69.52109 2.919803 59.54279       4.935581 55.98175       6.345604 64.99625       7.852732 67.11803 3.896449 72.11160 4.490974 -4.993576      5.945684 
1 1 1 24  7  3  o 43.48668 3.423613 23.49843       3.598841 26.13083       4.627707 19.47033       5.724535 45.65452 4.206821 38.65395 6.293621 7.000568       7.570139 
1 1 1 24  7  4  o 42.26477 3.862090 22.35193       3.933835 24.67952       4.476492 14.45970       8.242992 44.32679 4.194026 32.16647 9.707026 12.16032       10.57432 
1 1 1 24  7  5  o 25.07393 5.464747 8.258734       3.244576 9.443404       3.554981 2.349852       7.939464 26.80407 5.622294 21.36082 8.983730 5.443253       10.59800 
1 1 1 24  7  6  o 23.09521 5.807289 7.084866       3.264571 4.502090       3.520278 22.95048       8.724934 19.05164 6.411543 40.30491 9.099419 -21.25327      11.13137 
1 1 1 24  7  7  o 74.72587 3.792239 69.84297       6.883044 69.84297       6.883044 0.000000       0.000000 74.72587 3.792239 ?        ?        0.000000       3.792239 
1 1 1 24  7  8  o 35.86009 4.435786 16.45587       3.793742 17.26227       4.167583 12.55633       9.164655 36.60082 4.787219 29.52742 10.33107 7.073399       11.38633 
1 1 1 24  7  9  o 21.69255 5.723454 6.335772       3.068866 7.138266       3.290373 0.9703292      8.507988 22.98108 5.858609 20.47625 8.960645 2.504831       10.70591 
1 1 1 24  7  10 o 78.72474 4.593374 79.40266       8.773814 79.45285       11.35504 79.32830       13.82148 77.36134 6.071841 75.58535 7.607145 1.775993       9.733237 
1 1 1 24  7  11 o 15.58906 6.627717 0.9902642      4.399077 3.077468       5.175632 -4.442121      8.349802 18.38146 7.441624 17.27023 8.059988 1.111231       10.97001 
1 1 1 24  7  12 o 17.44756 6.956347 3.002117       4.449811 3.053937       5.147574 2.848897       8.851436 18.17205 7.397612 21.07279 9.182240 -2.900740      11.79144 
1 1 1 24  7  13 o 14.87498 5.706315 2.340321       2.900069 2.938373       3.027541 -4.316400      10.10069 15.84770 5.884703 18.53243 8.717775 -2.684731      10.51805 
1 1 1 24  7  14 o 18.50099 6.021325 4.717360       3.112361 5.761729       3.258880 -6.119832      10.49783 20.18467 6.106133 18.01774 8.594845 2.166922       10.54307 
1 1 1 24  7  15 o 17.76539 6.009124 4.326224       3.092243 4.080987       3.235906 6.905578       10.49443 17.45061 6.136287 23.06559 10.02500 -5.614975      11.75392 
1 1 1 24  7  16 o 9.368427 4.402821 -2.195149      2.565697 -1.484576      2.975999 -4.252329      5.063661 10.77426 4.951824 12.64789 6.015236 -1.873626      7.791253 
1 1 1 24  7  17 o 27.35885 5.001686 10.43945       3.211807 11.10299       3.810903 8.812530       5.967288 27.62097 5.844392 22.92676 8.302508 4.694202       10.15325 
1 1 1 24  7  18 o 17.62129 5.502680 4.512843       2.620804 5.878326       2.953912 -0.5377966     5.681038 19.86792 5.764605 14.99195 6.872265 4.875978       8.969877 
1 1 1 24  7  19 o 10.49565 4.659297 -0.1848203     2.379049 2.531357       2.672861 -10.54194      5.219356 14.26763 5.476976 10.27248 5.126432 3.995144       7.501838 
1 1 1 24  7  20 o 12.35744 5.067824 1.407983       2.437852 2.031055       2.767426 -0.7505375     5.150925 13.55012 5.457269 13.89251 6.431116 -0.3423948     8.434515 
1 1 1 24  7  21 o 10.28053 4.621246 -0.3365809     2.419082 0.2854632E-01  2.758096 -1.553986      5.036222 11.22536 4.998001 13.16396 6.180887 -1.938600      7.948797 
1 1 1 24  7  22 o 12.28929 5.146878 1.350602       2.589097 0.5702492      2.911215 4.303060       5.662665 11.88165 5.219328 17.03627 7.384502 -5.154620      9.042801 
1 1 1 24  8  0  o 28.80519 4.399192 10.53080       2.990242 10.72186       3.971764 10.28080       4.543313 28.67767 5.880887 27.87223 6.759473 0.8054409      8.959649 
1 1 1 24  8  1  o 130.9799 3.025377 211.1177       9.656516 215.9624       13.22947 205.5930       14.12747 131.8574 4.122263 128.4009 4.522086 3.456421       6.119012 
1 1 1 24  8  2  o 71.12673 2.752657 62.27495       4.762122 64.69132       6.640162 59.71595       6.833306 72.17062 3.788837 69.23126 4.068281 2.939362       5.559334 
1 1 1 24  8  3  o 34.25200 3.759244 14.71104       3.086278 14.82925       4.013498 14.54000       4.827744 34.03716 4.986626 33.29555 6.177460 0.7416115      7.938983 
1 1 1 24  8  4  o 31.82160 4.225101 12.83733       3.195501 14.54060       4.085662 10.15390       5.128222 33.60512 5.153226 27.38334 7.476497 6.221783       9.080404 
1 1 1 24  8  5  o 16.90361 5.653748 3.488154       2.737688 0.7501705      3.250187 10.17517       5.079362 13.88507 5.787325 27.33783 7.431201 -13.45276      9.418911 
1 1 1 24  8  6  o 31.42982 4.244830 12.58599       3.168124 10.22860       3.781411 18.13754       5.802913 27.78321 5.773874 36.80916 6.716663 -9.025953      8.857267 
1 1 1 24  8  7  o 27.67582 4.767212 9.948608       3.099133 8.470260       3.726091 13.26680       5.582332 25.07144 6.146822 30.93991 7.485896 -5.868467      9.686178 
1 1 1 24  8  8  o 41.14497 4.830107 21.81463       4.750834 24.24672       7.143070 19.88537       6.361952 42.09595 7.223185 38.10344 7.113112 3.992512       10.13759 
1 1 1 24  8  9  o 38.36768 3.828526 18.66951       3.531851 19.78183       4.299627 16.36192       6.192896 39.17946 4.590287 34.01101 7.657086 5.168453       8.927581 
1 1 1 24  8  10 o 43.99125 3.487101 24.41341       3.707677 25.81446       4.534751 21.58816       6.439549 44.90995 4.191997 39.44423 6.953393 5.465721       8.119268 
1 1 1 24  8  11 o 52.61106 3.235060 34.80266       4.127530 37.69955       5.083409 29.19727       7.071178 54.41491 3.858578 46.10748 6.471275 8.307430       7.534323 
1 1 1 24  8  12 o 28.98434 4.484614 11.06506       3.065369 11.78296       3.610201 9.210348       5.802817 29.56855 5.200071 24.82592 8.229342 4.742632       9.734619 
1 1 1 24  8  13 o 25.53865 4.878086 8.802714       2.925201 6.369327       3.306901 17.55589       6.271890 21.23258 6.080695 34.23461 7.704530 -13.00203      9.815021 
1 1 1 24  8  14 o 12.40336 5.174410 0.8386336      2.601645 2.932636       2.906834 -7.592247      5.832678 15.61968 5.772415 12.52791 6.082667 3.091769       8.385679 
1 1 1 24  8  15 f 11.51223 4.933911 0.3348703      2.473092 0.6841268      2.824615 -0.8121819     5.118923 12.54103 5.320507 14.69048 6.651874 -2.149448      8.517936 
1 1 1 24  8  16 o 14.86510 5.494316 2.720598       2.633654 1.547573       2.933113 7.601306       5.982968 13.61524 5.568381 21.97656 8.250026 -8.361315      9.953381 
1 1 1 24  8  17 o 11.70207 4.798813 1.019937       2.185767 -0.5056372E-01 2.415680 5.854270       5.133507 10.84081 4.758506 19.76154 7.589199 -8.920726      8.957641 
1 1 1 24  8  18 o 14.53109 5.206973 2.795226       2.339776 3.519206       2.622355 -0.3139606E-01 5.181575 15.87107 5.528064 14.71344 6.674282 1.157638       8.666345 
1 1 1 24  8  19 o 17.17654 5.876261 4.412955       2.958107 7.210568       3.586911 -1.535289      5.230235 21.25559 6.400864 13.67898 6.382338 7.576610       9.039098 
1 1 1 24  8  20 o 23.42193 5.865300 8.524611       3.339987 4.640040       3.983150 17.72517       6.130025 17.37480 6.681816 31.32156 8.002794 -13.94676      10.42552 
1 1 1 24  8  21 o 10.77886 4.904503 -0.5785969     2.824598 1.790590       3.395227 -5.904344      5.090487 13.73769 5.830904 11.31244 5.534104 2.425253       8.039014 
1 1 1 24  9  0  o 87.10368 2.858777 93.36983       6.059881 91.13999       7.969532 96.42623       9.330398 85.72117 3.824756 87.94347 4.367384 -2.222305      5.805411 
1 1 1 24  9  1  o 89.13035 2.675789 97.68797       5.805258 93.06396       8.100505 102.5704       8.323796 86.57082 3.849390 90.92951 3.764617 -4.358696      5.384250 
1 1 1 24  9  2  o 54.31905 3.009140 36.46178       3.967621 37.23619       5.308019 35.48126       5.972743 54.59918 4.017558 53.06363 4.666405 1.535557       6.157606 
1 1 1 24  9  3  o 59.82000 2.853050 44.16921       4.147040 47.36768       5.729421 40.64950       6.010255 61.63943 3.833281 56.88829 4.368883 4.751141       5.812158 
1 1 1 24  9  4  o 33.40417 4.067452 14.10641       3.242823 12.49727       3.998442 17.19900       5.543136 30.95570 5.502074 36.01164 6.558035 -5.055939      8.560411 
1 1 1 24  9  5  o 35.73116 3.957168 16.11540       3.387936 14.98696       4.100587 18.54243       6.013744 34.05858 5.097118 37.17579 6.891891 -3.117207      8.571977 
1 1 1 24  9  6  o 19.78839 6.496768 5.016736       3.619569 6.510899       5.199307 3.611616       5.042003 22.53193 7.787457 19.22185 7.483438 3.310087       10.80029 
1 1 1 24  9  7  o 49.09889 3.348282 30.12215       3.982201 28.20890       4.839131 34.13577       7.008915 47.14657 4.257770 51.11850 5.724689 -3.971935      7.134470 
1 1 1 24  9  8  o 32.00391 4.119791 13.10503       3.138579 14.65706       3.758024 9.526322       5.706550 33.63874 4.713596 25.98935 8.120371 7.649389       9.389271 
1 1 1 24  9  9  o 17.35851 5.540833 3.914911       2.643893 3.543635       3.064563 4.995659       5.228563 17.02880 5.972902 20.48504 7.707631 -3.456242      9.751059 
1 1 1 24  9  10 o 33.26714 4.013659 14.21750       3.188128 13.98617       3.754706 14.81526       6.035501 32.60750 4.874610 31.89548 7.825085 0.7120152      9.219207 
1 1 1 24  9  11 o 17.32530 5.494446 3.985860       2.603296 3.431227       2.973840 5.804728       5.385372 16.62497 5.879375 21.08468 7.844851 -4.459707      9.803506 
1 1 1 24  9  12 o 18.82941 5.418829 4.860676       2.620073 3.107752       2.929881 11.85920       5.854258 16.01954 5.815295 27.85477 8.124997 -11.83523      9.991658 
1 1 1 24  9  13 o 13.15482 5.135015 1.651670       2.379061 1.189341       2.628695 3.744884       5.593348 12.91631 5.275708 18.87017 7.700186 -5.953858      9.334129 
1 1 1 24  9  14 o 11.25274 4.985023 -0.3929634     2.709329 -0.4306324     3.132846 -0.2812096     5.396080 12.02904 5.342991 15.45976 6.929427 -3.430718      8.750115 
1 1 1 24  9  15 o 19.17109 6.174606 5.271213       3.277960 4.032560       3.723811 9.534640       6.908636 17.53903 6.523791 24.03430 8.895985 -6.495266      11.03170 
1 1 1 24  9  16 o 9.225655 4.266126 -1.413619      2.257596 -2.299312      2.477862 2.914187       5.477336 9.057182 4.278051 17.44338 7.404997 -8.386200      8.551942 
1 1 1 24  9  17 o 20.13226 4.921299 5.754326       2.393762 5.794109       2.611956 5.545610       5.982633 20.01879 5.279455 19.56952 7.971887 0.4492702      9.561570 
1 1 1 24  9  18 o 10.67958 4.540786 0.4949530      2.065151 2.158799       2.250880 -8.357284      5.191851 13.36746 5.051094 10.91758 5.389449 2.449879       7.386454 
1 1 1 24  9  19 f 26.11429 4.179348 9.397156       2.569990 9.613052       2.847189 8.447549       5.971250 26.07286 4.651831 21.37668 8.191240 4.696180       9.419976 
1 1 1 24  9  20 o 10.54576 4.549938 0.3922735      2.129938 0.7834361      2.335416 -1.541785      5.193026 11.37731 4.832783 13.42559 6.295020 -2.048280      7.936187 
1 1 1 24  9  21 o 25.63055 4.461360 9.369019       2.685347 7.815134       2.832247 23.19344       8.447831 22.74274 5.220938 31.55931 9.882986 -8.816576      11.17728 
1 1 1 24  10 0  o 49.53143 3.159524 30.36265       3.793748 30.43775       5.096410 30.26932       5.681491 49.27618 4.286774 48.95813 4.824766 0.3180504      6.454053 
1 1 1 24  10 1  o 118.2597 2.739520 171.9997       7.894913 177.4644       11.53850 167.1892       10.82574 119.4543 3.969309 116.0197 3.834305 3.434593       5.518814 
1 1 1 24  10 2  o 165.4609 3.022187 337.6204       12.18576 337.3440       18.17587 337.8460       16.42359 164.0961 4.549673 164.6964 4.092116 -0.6002960     6.119227 
1 1 1 24  10 3  o 52.46019 3.033347 34.08020       3.861287 37.34533       5.237388 30.19212       5.715215 54.62170 3.961641 48.74232 4.877036 5.879383       6.283318 
1 1 1 24  10 4  o 26.33647 5.779644 9.195962       3.607280 14.61681       5.893807 5.949001       4.561429 32.65307 7.556669 21.62860 7.298396 11.02447       10.50570 
1 1 1 24  10 5  o 11.90561 5.325796 -1.090539      3.170482 0.9213196      4.254640 -3.602726      4.754337 15.63274 6.575673 13.17475 6.126207 2.457984       8.987206 
1 1 1 24  10 6  o 57.32650 3.060904 40.83998       4.260533 40.47627       5.206430 41.57726       7.412706 56.77889 3.784455 56.68283 5.432904 0.9606552E-01  6.621068 
1 1 1 24  10 7  o 43.53095 3.475293 23.78653       3.656006 24.34386       4.435749 22.60586       6.456200 43.74568 4.213026 40.87100 6.715264 2.874683       7.927444 
1 1 1 24  10 8  o 47.39225 3.310725 28.15734       3.799502 29.10392       4.657433 26.27392       6.569624 47.86777 4.030100 44.22660 6.271324 3.641178       7.454610 
1 1 1 24  10 9  o 21.91013 5.361436 6.491986       2.838862 8.008802       3.362197 2.725159       5.298398 24.21922 5.777801 18.24578 7.475632 5.973440       9.448178 
1 1 1 24  10 10 f 10.79524 4.745688 -0.3602446     2.410995 -0.3055022     2.756083 -0.5387051     4.976239 11.59430 5.086184 15.14129 6.729138 -3.546994      8.435080 
1 1 1 24  10 11 o 18.52649 5.921129 4.649134       3.018536 4.286938       3.675431 5.399644       5.290722 18.27294 6.528585 20.50406 7.744860 -2.231123      10.12943 
1 1 1 24  10 12 o 15.00351 5.693594 2.473341       2.867149 1.484502       3.418132 4.820610       5.266323 14.48882 5.977521 19.73884 7.658323 -5.250020      9.714972 
1 1 1 24  10 13 o 17.56584 5.256979 4.229484       2.425035 4.676285       2.701903 2.378431       5.499484 18.37857 5.559928 17.57739 7.439075 0.8011780      9.287230 
1 1 1 24  10 14 o 16.04332 5.470033 3.409717       2.562831 4.532770       2.658991 -11.28024      9.616720 18.02631 5.528128 15.51320 7.592787 2.513113       9.392050 
1 1 1 24  10 15 o 13.41230 5.024212 2.058890       2.216419 2.592706       2.445888 -0.3922672     5.241147 14.51743 5.306750 14.98539 6.763290 -0.4679604     8.596725 
1 1 1 24  10 16 o 11.07440 4.595056 0.7517276      2.035777 -0.1583901     2.155803 8.249017       6.187460 10.19319 4.484039 22.28763 8.384927 -12.09444      9.508607 
1 1 1 24  10 17 o 12.63012 4.796552 1.815916       2.035798 1.725627       2.142359 2.656381       6.536329 12.61856 4.887644 17.60194 7.772878 -4.983379      9.181868 
1 1 1 24  10 18 o 25.34444 4.107841 8.781524       2.450297 8.786186       2.590544 8.741922       7.549384 25.16943 4.382742 21.57950 8.891205 3.589924       9.912717 
1 1 1 24  10 19 o 12.17200 4.706681 1.677736       1.984148 1.157213       2.081067 6.878866       6.578319 11.51000 4.696837 19.81314 8.243809 -8.303134      9.487922 
1 1 1 24  10 20 o 23.46643 4.270773 7.743397       2.352303 6.683108       2.526507 14.64642       6.446559 21.26513 4.965909 26.79096 8.661726 -5.525822      9.984275 
1 1 1 24  10 21 o 16.11681 5.051139 3.900335       2.206271 2.323462       2.353874 15.30391       6.330023 13.39539 5.140380 27.25334 8.557897 -13.85795      9.983041 
1 1 1 24  11 0  f 95.77827 3.011846 113.1716       7.020947 114.3696       9.097048 111.4069       11.04121 95.88499 3.901411 94.12096 4.830019 1.764023       6.208872 
1 1 1 24  11 1  o 41.05779 3.894314 21.13341       3.849809 18.58054       4.715824 26.23401       6.665832 38.04488 5.224396 44.87106 6.266796 -6.826187      8.158863 
1 1 1 24  11 2  o 43.76031 3.687905 23.94660       3.896181 25.59911       4.926648 21.18742       6.366047 44.95970 4.559666 39.95296 6.780764 5.006737       8.171249 
1 1 1 24  11 3  o 81.95869 3.158699 83.22646       6.296882 89.18596       11.02123 80.33833       7.672457 83.50698 5.445610 80.15337 3.940121 3.353615       6.721549 
1 1 1 24  11 4  o 44.28152 3.346209 24.46945       3.584147 28.31228       4.891854 20.01574       5.266335 47.30536 4.290131 39.14687 5.686676 8.158485       7.123447 
1 1 1 24  11 5  o 62.02065 3.050400 47.76786       4.596156 52.12468       5.808558 40.47188       7.516658 64.50687 3.710760 55.83599 5.599766 8.670879       6.717672 
1 1 1 24  11 6  o 33.12374 4.070459 13.98873       3.216628 16.25582       3.864599 8.876554       5.803276 35.54930 4.566388 25.30215 8.221197 10.24715       9.404253 
1 1 1 24  11 7  o 32.19490 4.266606 13.32405       3.265061 11.21501       3.879330 18.44728       6.046248 28.91648 5.707935 36.54098 7.045379 -7.624498      9.067409 
1 1 1 24  11 8  o 20.58743 5.597955 5.739758       2.881855 6.097972       3.378437 4.782780       5.521980 21.13583 6.174288 20.41916 7.863510 0.7166710      9.997830 
1 1 1 24  11 9  o 29.35835 5.450498 11.60502       3.755931 13.76932       5.005666 8.816648       5.681706 31.31447 6.758110 24.69481 8.141294 6.619652       10.58077 
1 1 1 24  11 10 f 11.74211 4.973749 0.4110239      2.461918 -0.4562628     2.738702 4.062871       5.619786 11.38130 5.028392 19.48458 7.801066 -8.103273      9.281238 
1 1 1 24  11 11 o 9.662159 4.417401 -1.267847      2.326702 -1.215878      2.500114 -1.603957      6.358131 10.11881 4.608067 16.06994 7.329901 -5.951138      8.658044 
1 1 1 24  11 12 o 18.21772 5.365366 4.562846       2.542285 4.073252       2.749636 7.446634       6.673275 17.37459 5.659925 22.73080 8.671884 -5.356211      10.35550 
1 1 1 24  11 13 o 21.01984 5.129958 6.127930       2.604243 4.756753       2.795808 15.11757       7.158657 18.46571 5.669623 30.09831 9.037873 -11.63260      10.66901 
1 1 1 24  11 14 o 13.05541 4.966038 1.840820       2.184367 1.862919       2.321020 1.669551       6.461435 13.27163 5.101436 17.63377 7.759883 -4.362144      9.286573 
1 1 1 24  11 15 o 15.12672 5.027811 3.078289       2.165675 3.078289       2.165675 0.000000       0.000000 15.12672 5.027811 ?        ?        0.000000       5.027811 
1 1 1 24  11 16 f 21.84088 4.141589 6.483585       2.123673 6.224000       2.270890 8.293180       5.995791 21.18200 4.536122 22.17329 8.272108 -0.9912910     9.434202 
1 1 1 24  11 17 o 16.26006 5.868448 3.709699       2.978132 3.035005       3.331428 6.394167       6.645164 15.53761 6.073213 20.08041 8.314200 -4.542805      10.29611 
1 1 1 24  11 18 o 11.67639 4.458676 1.529115       1.765146 1.236763       1.869056 3.941258       5.368723 11.33710 4.512247 17.41683 7.359594 -6.079721      8.632729 
1 1 1 24  11 19 o 11.93522 4.365449 1.770446       1.655522 1.693332       1.730049 2.608080       5.701915 11.87101 4.440494 16.37208 7.243397 -4.501074      8.496163 
1 1 1 24  11 20 o 14.45305 6.385921 1.511230       4.417719 6.221991       7.319213 -1.188441      5.540824 18.89119 8.287823 13.83304 6.491268 5.058149       10.52732 
1 1 1 24  12 0  o 25.48019 4.898826 8.423586       2.931336 8.019232       3.970616 8.907969       4.345815 24.50330 6.531292 25.75639 6.818066 -1.253092      9.441600 
1 1 1 24  12 1  o 51.64436 3.159426 33.09264       3.957162 35.44371       5.456823 30.48489       5.746989 53.07494 4.254654 48.95063 4.882840 4.124306       6.476435 
1 1 1 24  12 2  o 25.72247 5.643239 8.760505       3.439906 3.392605       4.931419 13.84768       4.800737 18.95946 7.395316 32.23503 6.337449 -13.27557      9.739300 
1 1 1 24  12 3  o 26.19758 4.943574 8.958371       3.040332 7.926757       3.989180 10.38805       4.696168 24.21622 6.586845 27.57565 6.982534 -3.359436      9.599079 
1 1 1 24  12 4  o 73.81264 2.970863 67.54977       5.332872 65.96725       6.917459 69.86826       8.372898 72.47447 3.931466 74.15226 4.657083 -1.677788      6.094657 
1 1 1 24  12 5  o 21.45794 5.834937 6.186350       3.130930 5.725278       3.573410 7.709931       6.495782 20.73837 6.417282 24.22004 8.676237 -3.481665      10.79160 
1 1 1 24  12 6  o 42.77716 3.673832 23.09252       3.792667 21.46676       4.256956 29.34972       8.351458 40.96009 4.330320 45.81575 7.756660 -4.855663      8.883550 
1 1 1 24  12 7  o 15.04593 5.613305 2.432571       2.760947 3.206273       3.098405 -0.5502079     6.083616 16.54463 5.983804 16.75535 7.443731 -0.2107239     9.550656 
1 1 1 24  12 8  o 46.35279 4.463764 27.73502       4.979843 25.01586       6.021688 33.61816       8.857388 43.14019 5.880926 48.57371 7.742592 -5.433521      9.722809 
1 1 1 24  12 9  o 19.72632 5.474449 5.313406       2.724275 4.775283       3.090652 7.188016       5.768525 18.81180 5.989150 22.72109 8.171639 -3.909298      10.13142 
1 1 1 24  12 10 o 12.35408 5.055101 0.9870258      2.418796 0.3473243E-01  2.667749 5.386784       5.734215 11.70749 5.071642 20.69442 8.001582 -8.986929      9.473482 
1 1 1 24  12 11 o 14.56197 5.204648 2.559261       2.336113 3.084928       2.556154 -0.1056637     5.755385 15.63630 5.457096 16.18654 7.212576 -0.5502424     9.044398 
1 1 1 24  12 12 f 15.64448 5.225871 3.209239       2.339100 3.106056       2.600687 3.646142       5.351485 15.63623 5.500896 18.50092 7.538508 -2.864690      9.332146 
1 1 1 24  12 13 o 24.91630 4.265030 8.289892       2.496595 9.202367       2.752959 4.063799       5.924598 26.16959 4.477707 19.06587 7.868126 7.103716       9.053026 
1 1 1 24  12 14 o 31.36905 4.836390 13.43577       3.578403 10.69198       4.207942 20.60337       6.801124 26.76743 6.513690 35.97714 7.967699 -9.209705      10.29138 
1 1 1 24  12 15 x ?        ?        ?              ?        ?              ?        ?              ?        ?        ?        ?        ?        ?              ?        
1 1 1 24  12 16 o 26.27001 7.909167 11.80728       5.476959 12.06756       6.558251 11.20730       9.957015 25.58504 8.749687 23.60022 9.999866 1.984825       13.28738 
1 1 1 24  12 17 o 17.39853 6.916950 4.248845       4.387251 -3.762180      6.278533 11.89290       6.133044 13.85851 6.620720 25.21678 8.462576 -11.35827      10.74473 
1 1 1 24  12 18 o 16.20633 6.731678 3.256323       4.375783 7.974568       6.861868 0.2261703E-01  5.680707 20.73656 8.503040 14.90053 6.845762 5.836027       10.91632 
1 1 1 24  12 19 o 15.17136 6.617806 2.100026       4.608218 10.70880       7.554701 -3.001095      5.815398 22.19128 8.988288 13.37021 6.383159 8.821065       11.02425 
1 1 1 24  12 20 o 17.02801 6.964529 4.445857       4.588647 4.492023       7.080851 4.412433       6.024933 17.74830 7.947823 17.40188 7.579250 0.3464241      10.98239 
1 1 1 24  13 0  o 61.39104 2.950817 46.63536       4.401592 46.37044       6.124618 46.91836       6.330046 60.76026 4.161533 61.06704 4.280786 -0.3067818     5.970217 
1 1 1 24  13 1  o 59.74722 3.073334 44.27090       4.459659 49.54962       6.374422 39.21003       6.241499 62.75576 4.192268 55.58976 4.649986 7.166000       6.260789 
1 1 1 24  13 2  o 9.252867 4.390037 -3.069818      2.665225 -2.900786      3.612160 -3.271810      3.948675 11.46332 5.333602 11.89440 5.548315 -0.4310732     7.696175 
1 1 1 24  13 3  o 47.64917 3.196128 28.30050       3.689748 27.58170       4.986673 29.17015       5.485039 46.55255 4.449825 47.73213 4.779789 -1.179581      6.530492 
1 1 1 24  13 4  o 14.68445 5.491888 2.232671       2.646053 -0.1703808E-01 3.400126 5.687517       4.213531 13.26136 5.735213 20.89566 7.014373 -7.634296      9.060579 
1 1 1 24  13 5  o 23.95785 5.175533 7.644144       2.933190 7.058584       3.466617 9.119885       5.503327 22.76593 6.118171 25.44070 7.978223 -2.674768      10.05406 
1 1 1 24  13 6  o 35.98930 5.054085 16.98513       4.310558 12.32407       5.934966 22.18895       6.271005 29.11473 8.080356 40.28814 6.616908 -11.17341      10.44393 
1 1 1 24  13 7  o 16.25165 5.518016 3.320040       2.607628 3.872489       3.031312 1.747709       5.113953 17.43742 5.948941 17.15760 7.212669 0.2798195      9.349464 
1 1 1 24  13 8  o 16.18897 5.448205 3.344107       2.541902 2.479172       2.869208 6.499554       5.480257 15.13808 5.706656 21.91882 7.953800 -6.780734      9.789222 
1 1 1 24  13 9  o 21.25311 5.115120 6.152575       2.617052 6.917455       2.964553 3.451714       5.570749 22.41896 5.474519 18.83774 7.685500 3.581221       9.435956 
1 1 1 24  13 10 o 32.07825 3.747613 13.26334       2.874418 12.27219       3.175728 17.75553       6.760885 30.53681 4.393926 34.04224 8.239428 -3.505430      9.337813 
1 1 1 24  13 11 o 14.66510 4.941698 2.753549       2.091222 1.459436       2.252542 10.82994       5.627239 12.66277 4.980655 26.41916 8.030409 -13.75640      9.449571 
1 1 1 24  13 12 f 19.97568 4.472220 5.413292       2.122690 5.843863       2.284775 2.697567       5.738042 20.70065 4.643806 17.90657 7.589457 2.794081       8.897459 
1 1 1 24  13 13 o 20.13419 4.241666 5.480584       2.015363 5.473183       2.143940 5.536797       5.908444 20.00864 4.505765 20.17607 8.025128 -0.1674309     9.203510 
1 1 1 24  13 14 o 13.92556 6.102045 0.4980164      3.957052 7.291878       5.685939 -5.882881      5.510421 21.51293 8.049532 12.47463 6.021865 9.038301       10.05275 
1 1 1 24  13 15 o 15.94495 6.507748 2.777796       3.996047 0.7264189      5.675068 4.795113       5.627759 15.84859 7.104807 18.84110 7.710282 -2.992513      10.48460 
1 1 1 24  13 16 o 32.78520 6.589095 16.61941       5.081481 20.62511       7.713635 13.54824       6.754163 32.95440 9.236380 26.66378 8.879541 6.290627       12.81238 
1 1 1 24  13 17 o 13.55679 6.111740 0.5518613E-01  4.266261 0.1839839      6.629745 -0.3584354E-01 5.573579 15.87405 7.329921 14.87196 6.813415 1.002095       10.00751 
1 1 1 24  13 18 o 15.85841 6.741653 2.840679       4.550948 3.790344       7.093897 2.176474       5.932681 17.81866 7.968998 16.27235 7.281801 1.546312       10.79489 
1 1 1 24  13 19 o 17.12210 6.927620 4.455919       4.482298 -0.7358604     6.854131 8.335256       5.924790 15.16438 7.148208 20.73343 8.100597 -5.569049      10.80354 
1 1 1 24  14 0  o 11.31095 4.980665 -0.5542527     2.665870 -0.7243757     3.460742 -0.3059828     4.180705 12.80049 5.654088 14.44316 6.301706 -1.642672      8.466416 
1 1 1 24  14 1  f 57.02417 3.436336 40.58620       4.753032 47.95969       7.809399 36.24774       5.990303 61.04115 5.302551 53.34950 4.654229 7.691647       7.055416 
1 1 1 24  14 2  o 24.95674 4.843490 8.162354       2.839394 10.48056       3.794211 5.211597       4.280674 28.02513 5.748693 20.34718 7.064341 7.677946       9.107821 
1 1 1 24  14 3  o 14.84853 5.516320 2.334969       2.660951 6.666014       3.512777 -3.496366      4.076038 22.18008 6.238868 11.94221 5.592280 10.23787       8.378369 
1 1 1 24  14 4  o 27.09754 4.452835 9.543347       2.838331 10.45843       3.647971 8.139580       4.518243 27.95877 5.550089 24.19232 7.159977 3.766451       9.059181 
1 1 1 24  14 5  f 29.40326 6.239734 11.84531       4.332383 7.065849       5.913901 17.38125       6.364738 23.00282 8.273842 34.89326 7.692570 -11.89044      11.29744 
1 1 1 24  14 6  o 32.11017 4.092114 13.28091       3.129387 11.79138       3.643283 17.47202       6.111310 29.74011 5.217226 35.01958 7.393643 -5.279467      9.049055 
1 1 1 24  14 7  o 12.16590 5.085564 0.6489992      2.520573 0.7646255      2.854913 0.2402568      5.367714 12.91899 5.407205 16.19406 7.101214 -3.275071      8.925531 
1 1 1 24  14 8  o 16.29024 5.316185 3.465673       2.425249 4.000446       2.753040 1.612573       5.124803 17.37454 5.663667 16.85810 7.159879 0.5164375      9.129129 
1 1 1 24  14 9  o 9.320796 4.215520 -0.8932506     2.048684 -1.202944      2.220984 0.8736144      5.304946 9.459402 4.321352 16.39723 7.127174 -6.937826      8.334908 
1 1 1 24  14 10 o 24.33732 5.546721 8.242630       3.216141 9.491265       3.761182 4.846474       6.202979 25.87077 6.070996 20.23037 8.162308 5.640400       10.17252 
1 1 1 24  14 11 o 25.08226 8.550063 10.05884       6.261448 0.000000       0.000000 10.05884       6.261448 ?        ?        25.08226 8.550063 0.000000       8.550063 
1 1 1 24  14 12 f 29.39668 8.585753 14.31366       6.533369 0.000000       0.000000 14.31366       6.533369 ?        ?        29.39668 8.585753 0.000000       8.585753 
1 1 1 24  14 13 o 15.71483 6.618688 2.000663       4.319256 -1.120782      6.162755 5.014269       6.055364 15.52735 7.132477 19.59405 8.005699 -4.066702      10.72210 
1 1 1 24  14 14 o 32.15047 6.426908 15.46610       4.859154 13.21466       7.037828 17.51704       6.717145 26.83907 9.065585 31.96585 8.483371 -5.126785      12.41581 
1 1 1 24  14 15 o 11.27082 5.367896 -3.477759      4.061414 -1.924463      5.735101 -5.040412      5.752350 14.28367 6.670676 12.90537 6.210331 1.378294       9.114062 
1 1 1 24  14 16 o 18.80855 7.197382 5.512659       4.605974 12.63251       7.244052 0.6808805      5.967597 25.03555 9.135679 15.72063 7.143566 9.314924       11.59703 
1 1 1 24  14 17 o 26.17790 7.531703 11.94696       5.062219 11.27847       7.755316 12.44323       6.682086 23.09940 9.192157 24.87000 8.811406 -1.770603      12.73329 
1 1 1 24  14 18 o 19.13076 7.283224 6.250678       4.700939 5.885394       7.362540 6.502088       6.108077 18.96504 8.316501 19.28005 7.975886 -0.3150101     11.52297 
1 1 1 24  15 0  o 27.95474 4.854581 10.18594       3.187156 14.11001       4.703205 6.853721       4.334032 32.45664 6.171901 22.58246 7.079848 9.874178       9.392370 
1 1 1 24  15 1  o 10.15371 4.601028 -1.211262      2.454528 -3.206961      3.120872 2.025094       3.974262 10.19169 4.810051 16.23069 6.538777 -6.039006      8.117401 
1 1 1 24  15 2  o 44.85740 3.232636 25.17546       3.509979 32.28093       4.968458 18.09624       4.959273 50.45257 4.075791 36.96389 5.687652 13.48869       6.997246 
1 1 1 24  15 3  f 17.66463 5.482306 4.088322       2.605801 2.271381       3.350516 6.869669       4.145423 15.60557 6.093251 22.38194 6.909444 -6.776376      9.212390 
1 1 1 24  15 4  o 17.43781 6.107831 3.764541       3.203860 5.020017       5.085298 2.938208       4.125625 20.35650 7.613386 17.24850 6.753626 3.108004       10.17719 
1 1 1 24  15 5  o 33.40552 3.883186 14.29342       3.102284 15.67178       3.618007 10.46585       6.029045 34.78434 4.364046 26.62769 8.350621 8.156651       9.422195 
1 1 1 24  15 6  o 32.66759 4.023442 13.76459       3.135363 14.29766       3.643212 12.24234       6.156528 33.00422 4.659256 28.50245 8.337232 4.501768       9.550817 
1 1 1 24  15 7  o 27.16277 4.437243 9.716896       2.835820 10.74193       3.255615 6.493317       5.773420 28.37823 4.883862 21.89446 8.127054 6.483774       9.481620 
1 1 1 24  15 8  o 11.54694 4.736689 0.8039573      2.130394 0.5495309      2.310889 2.244442       5.498601 11.57130 4.855412 17.68048 7.458351 -6.109179      8.899552 
1 1 1 24  15 9  o 6.759917 3.278823 -2.685783      1.683568 -2.613970      1.782886 -3.277005      5.115616 7.104906 3.428646 13.45002 6.287497 -6.345116      7.161581 
1 1 1 24  15 10 o 19.02033 7.768574 3.987127       5.699513 0.000000       0.000000 3.987127       5.699513 ?        ?        19.02033 7.768574 0.000000       7.768574 
1 1 1 24  15 11 o 39.10547 7.745205 23.48106       7.119706 0.000000       0.000000 23.48106       7.119706 ?        ?        39.10547 7.745205 0.000000       7.745205 
1 1 1 24  15 12 o 29.61858 8.303770 14.51473       6.233634 0.000000       0.000000 14.51473       6.233634 ?        ?        29.61858 8.303770 0.000000       8.303770 
1 1 1 24  15 13 o 21.28405 7.114268 7.050625       4.334922 4.047305       6.115921 10.08276       6.145195 18.66118 7.868637 24.22463 8.460816 -5.563450      11.55426 
1 1 1 24  15 14 o 12.72461 5.834878 -1.169217      4.099977 -3.159100      5.873766 0.7215166      5.725560 13.90670 6.574072 15.82632 7.112241 -1.919626      9.685163 
1 1 1 24  15 15 o 22.39920 8.381883 9.078978       6.165435 9.713134       7.647780 7.901699       10.42022 22.54308 9.074539 21.40425 9.608816 1.138830       13.21653 
1 1 1 24  15 16 o 16.78415 7.371083 2.744083       5.803194 3.949816       7.045752 0.2007616      10.23298 18.18240 8.047720 17.94465 8.539093 0.2377510      11.73379 
1 1 1 24  15 17 o 19.13100 7.881282 6.148431       5.930684 1.833378       7.090164 16.20136       10.82205 16.75422 7.679086 24.44303 10.39379 -7.688810      12.92281 
1 1 1 24  15 18 o 16.70338 7.492428 2.860296       6.321401 14.79692       7.954444 -17.59986      10.41414 25.10621 9.493476 13.50758 6.809009 11.59863       11.68284 
1 1 1 24  16 0  o 28.03780 5.494839 10.47309       3.620050 11.63095       4.637407 8.666874       5.792018 29.06861 6.686050 24.96405 8.219474 4.104563       10.59542 
1 1 1 24  16 1  o 17.02082 5.900731 3.559879       2.986113 3.140229       3.534073 4.607224       5.583124 16.93686 6.344297 20.41371 7.894809 -3.476847      10.12809 
1 1 1 24  16 2  o 25.67818 5.004887 8.747721       3.019219 11.14021       3.641165 3.482864       5.401434 28.90208 5.367360 19.10967 7.649014 9.792418       9.344301 
1 1 1 24  16 3  o 26.94600 4.957742 9.630097       3.135550 9.575875       3.724158 9.762128       5.811337 26.45649 5.924123 25.92525 8.207638 0.5312462      10.12228 
1 1 1 24  16 4  o 25.41492 4.882196 8.600242       2.913844 11.75664       3.472529 1.089156       5.356752 29.78232 4.958955 16.86555 7.245395 12.91677       8.779919 
1 1 1 24  16 5  o 43.86940 3.618268 24.46036       3.833746 27.19965       4.141753 8.070804       10.13091 46.22777 3.707653 24.99628 10.29948 21.23149       10.94651 
1 1 1 24  16 6  f 12.00671 4.948709 0.8227273      2.339759 1.251665       2.406958 -6.539072      9.971562 12.70790 5.099392 17.81991 8.465305 -5.112011      9.882570 
1 1 1 24  16 7  o 35.29011 3.817371 16.03334       3.230671 17.34597       3.387100 2.799086       10.75491 36.70660 3.843502 21.98588 9.823876 14.72072       10.54898 
1 1 1 24  16 8  o 18.72171 4.873697 4.782393       2.244852 5.169337       2.307344 -2.072175      9.711322 19.46076 4.875925 18.93697 8.788496 0.5237923      10.05049 
1 1 1 24  16 9  o 19.76803 5.378590 5.449619       2.659420 6.197212       2.752319 -5.067266      10.32310 21.08117 5.349613 18.12414 8.610806 2.957031       10.13727 
1 1 1 24  16 10 o 23.55858 10.04790 8.127619       10.16715 0.000000       0.000000 8.127619       10.16715 ?        ?        23.55858 10.04790 0.000000       10.04790 
1 1 1 24  16 11 f 20.50259 9.387783 2.420084       10.56137 0.000000       0.000000 2.420084       10.56137 ?        ?        20.50259 9.387783 0.000000       9.387783 
1 1 1 24  16 12 o 25.33079 8.321449 10.90446       5.937909 16.94476       7.091020 -3.271285      10.86307 31.07871 8.905440 18.27749 8.725466 12.80123       12.46758 
1 1 1 24  16 13 o 33.58926 7.837548 18.54236       6.297512 26.12595       7.949312 5.762170       10.31955 39.11097 8.577207 21.04190 9.494074 18.06907       12.79476 
1 1 1 24  16 14 o 18.37995 7.203404 4.941953       4.697139 6.635966       6.820848 3.413993       6.477926 20.33624 8.422056 17.92891 7.832983 2.407333       11.50159 
1 1 1 24  16 15 o 17.54984 7.138760 4.269751       4.789207 19.06528       8.067998 -3.780281      5.951128 30.28587 9.680399 13.47965 6.441379 16.80622       11.62762 
1 1 1 24  16 16 o 15.45389 6.667900 2.256605       4.574886 3.037259       7.322968 1.756892       5.858930 17.61398 7.967772 16.04905 7.204905 1.564930       10.74226 
1 1 1 24  16 17 o 34.92435 6.854240 19.92524       5.625038 17.22367       8.789425 21.79928       7.320519 26.48072 9.986842 33.43016 8.848874 -6.949448      13.34315 
1 1 1 24  17 0  o 27.72120 4.364381 9.979380       2.850923 7.374157       3.638060 14.12499       4.589251 23.14998 6.287561 32.28982 6.054679 -9.139839      8.728835 
1 1 1 24  17 1  o 20.26231 5.260856 5.534473       2.620273 7.047255       3.467482 3.520648       4.000708 22.62632 6.135473 17.77714 6.730299 4.849180       9.107193 
1 1 1 24  17 2  o 23.93140 4.527164 7.553723       2.543481 8.330005       3.272452 6.369191       4.042380 24.74807 5.562003 21.49197 6.850294 3.256105       8.823967 
1 1 1 24  17 3  o 23.90107 5.618151 7.820750       3.216667 7.878420       4.935532 7.778165       4.241132 23.49314 7.577496 23.42526 6.937951 0.6787872E-01  10.27393 
1 1 1 24  17 4  o 23.36262 6.288322 7.663402       3.658646 10.90675       5.032743 4.028207       5.328094 27.34439 7.381838 19.25897 7.633552 8.085421       10.61898 
1 1 1 24  17 5  o 20.66761 4.999975 5.799214       2.490578 7.350603       2.785224 -0.3913597     5.563722 23.29432 5.052241 15.90839 7.089867 7.385932       8.705823 
1 1 1 24  17 6  o 36.54150 3.513782 17.04950       3.090415 17.44533       3.471614 15.53817       6.783487 36.75713 3.936991 31.53534 8.594250 5.221794       9.453096 
1 1 1 24  17 7  o 32.86231 8.351363 16.83560       6.700776 0.000000       0.000000 16.83560       6.700776 ?        ?        32.86231 8.351363 0.000000       8.351363 
1 1 1 24  17 8  o 10.54919 4.384194 0.5447533      1.857453 1.039722       1.967525 -3.511338      5.632293 11.51297 4.613692 13.97689 6.554261 -2.463917      8.015266 
1 1 1 24  17 9  o 17.94613 7.629903 2.735486       5.830138 0.000000       0.000000 2.735486       5.830138 ?        ?        17.94613 7.629903 0.000000       7.629903 
1 1 1 24  17 10 o 20.15440 8.177866 5.407161       6.266634 0.000000       0.000000 5.407161       6.266634 ?        ?        20.15440 8.177866 0.000000       8.177866 
1 1 1 24  17 11 o 19.03586 8.042760 4.206960       6.410444 0.000000       0.000000 4.206960       6.410444 ?        ?        19.03586 8.042760 0.000000       8.042760 
1 1 1 24  17 12 o 41.42754 5.653985 24.55373       5.559147 36.06609       8.614112 16.33689       7.277475 47.54775 7.697285 29.75282 9.149470 17.79493       11.95663 
1 1 1 24  17 13 o 21.47513 8.374865 7.925365       6.323283 0.000000       0.000000 7.925365       6.323283 ?        ?        21.47513 8.374865 0.000000       8.374865 
1 1 1 24  17 14 o 21.31265 7.433197 7.658563       4.742140 13.91944       7.731828 3.883243       6.004009 25.90580 9.440536 17.85497 7.670550 8.050835       12.16392 
1 1 1 24  17 15 f 20.43072 7.418990 7.128701       4.769174 10.61284       7.454835 4.714815       6.205100 22.79159 9.030800 18.30079 7.828697 4.490793       11.95173 
1 1 1 24  17 16 o 25.26770 7.508878 11.31419       4.961154 6.896113       7.866797 14.23161       6.392650 19.78269 8.637628 26.81992 8.621365 -7.037235      12.20396 
1 1 1 24  18 0  o 14.32899 5.275494 2.269196       2.424003 3.159393       3.017863 0.6506683      4.069270 16.33625 5.905916 14.81977 6.339681 1.516483       8.664375 
1 1 1 24  18 1  o 17.69297 5.275817 4.184563       2.445856 3.654209       3.144518 4.996869       3.891626 17.14237 6.047231 19.49328 6.737335 -2.350910      9.053214 
1 1 1 24  18 2  o 13.33949 5.503025 1.068028       2.896776 -2.136899      4.497701 3.339826       3.786748 13.32868 6.111674 17.22647 6.541847 -3.897795      8.952560 
1 1 1 24  18 3  o 19.63154 5.047347 5.229032       2.427945 8.523623       3.041070 -0.5628647     4.032145 25.11273 5.142519 13.64713 6.061632 11.46560       7.949143 
1 1 1 24  18 4  o 19.07138 5.265863 4.969800       2.527736 6.008788       2.815119 0.6462587      5.742635 20.88022 5.468651 16.79287 7.354924 4.087349       9.165209 
1 1 1 24  18 5  o 22.57382 4.711953 6.865544       2.508175 7.723335       2.759489 2.789292       6.015457 23.89049 4.904301 18.53898 7.809686 5.351511       9.221896 
1 1 1 24  18 6  o 19.12765 4.811271 4.991563       2.240237 6.862001       2.436747 -5.222087      5.694153 22.57717 4.585667 13.32602 6.349306 9.251151       7.832115 
1 1 1 24  18 7  o 19.62380 5.143737 5.336006       2.489228 5.605709       2.729662 4.004202       6.065780 20.01376 5.450696 19.28154 7.959637 0.7322197      9.647067 
1 1 1 24  18 8  o 24.19843 8.464767 9.416531       6.152354 0.000000       0.000000 9.416531       6.152354 ?        ?        24.19843 8.464767 0.000000       8.464767 
1 1 1 24  18 9  o 15.68439 7.040785 0.4609943E-01  5.594145 0.000000       0.000000 0.4609943E-01  5.594145 ?        ?        15.68439 7.040785 0.000000       7.040785 
1 1 1 24  18 10 o 27.07151 9.240365 13.30910       7.313740 0.000000       0.000000 13.30910       7.313740 ?        ?        27.07151 9.240365 0.000000       9.240365 
1 1 1 24  18 11 o 21.05717 8.324802 7.065447       6.321627 0.000000       0.000000 7.065447       6.321627 ?        ?        21.05717 8.324802 0.000000       8.324802 
1 1 1 24  18 12 o 11.36228 5.444836 -4.109462      4.317410 -8.215521      6.188892 -0.2168969     6.025850 12.31373 6.040113 15.48967 7.091936 -3.175946      9.315499 
1 1 1 24  18 13 o 12.83168 5.950111 -1.545923      4.437329 6.692044       7.751019 -5.562041      5.411928 20.38288 8.735205 12.19161 5.905170 8.191274       10.54395 
1 1 1 24  18 14 o 17.02205 7.431435 3.065750       5.821697 0.000000       0.000000 3.065750       5.821697 ?        ?        17.02205 7.431435 0.000000       7.431435 
1 1 1 24  18 15 o 22.26970 7.737301 8.993165       5.135527 13.57403       8.276171 6.124925       6.548822 24.42754 9.565213 19.25003 8.130967 5.177513       12.55412 
1 1 1 24  19 0  o 69.37470 3.915786 61.32014       6.593098 70.47348       10.08718 54.49326       8.711460 72.61011 5.747666 63.90178 5.652483 8.708328       8.061403 
1 1 1 24  19 1  o 11.21410 4.738199 0.3777972      2.225006 0.9371061      2.696434 -0.8156588     3.938829 12.82104 5.301181 13.30609 5.945361 -0.4850559     7.965540 
1 1 1 24  19 2  o 23.65897 5.621898 7.731514       3.193152 3.361774       4.796935 11.20846       4.278928 18.08098 7.218028 28.18572 6.379019 -10.10474      9.632850 
1 1 1 24  19 3  o 7.535140 3.638867 -2.976929      2.016992 -3.031137      2.196120 -2.684711      5.098907 7.979928 3.839376 13.81764 6.397192 -5.837711      7.460889 
1 1 1 24  19 4  o 32.51459 3.390740 13.50589       2.647203 16.24746       3.417152 9.391308       4.186279 35.36830 4.036941 25.44967 6.670404 9.918633       7.796870 
1 1 1 24  19 5  o 33.16858 4.394126 14.51538       3.464405 14.13709       4.092820 15.47142       6.506490 32.11607 5.422415 31.33847 8.364126 0.7776051      9.968009 
1 1 1 24  19 6  o 20.69805 8.243125 5.650652       6.241457 0.000000       0.000000 5.650652       6.241457 ?        ?        20.69805 8.243125 0.000000       8.243125 
1 1 1 24  19 7  o 21.84421 8.364340 7.126702       6.223277 0.000000       0.000000 7.126702       6.223277 ?        ?        21.84421 8.364340 0.000000       8.364340 
1 1 1 24  19 8  o 15.40712 7.013599 -0.7236835     5.784530 0.000000       0.000000 -0.7236835     5.784530 ?        ?        15.40712 7.013599 0.000000       7.013599 
1 1 1 24  19 9  o 23.34296 9.053061 9.342394       7.356978 0.000000       0.000000 9.342394       7.356978 ?        ?        23.34296 9.053061 0.000000       9.053061 
1 1 1 24  19 10 o 18.58244 7.718910 4.365737       5.753621 0.000000       0.000000 4.365737       5.753621 ?        ?        18.58244 7.718910 0.000000       7.718910 
1 1 1 24  19 11 f 21.48681 7.393468 7.542757       4.684665 21.43691       7.800664 -0.2949999     5.858838 34.08595 9.185298 15.30598 7.002234 18.77997       11.54993 
1 1 1 24  19 12 o 32.63945 6.954792 16.89668       5.362392 29.83110       8.736837 9.079198       6.792254 40.47556 9.081642 22.25369 8.679477 18.22186       12.56223 
1 1 1 24  19 13 o 17.50993 7.108994 4.284017       4.738762 10.06461       7.561757 0.5457663      6.080942 22.51819 9.037642 15.67207 7.156038 6.846125       11.52770 
1 1 1 24  19 14 o 16.67186 6.913491 3.616636       4.604508 -1.268177      6.734401 7.904940       6.309832 15.15394 7.125339 20.76141 8.281607 -5.607466      10.92499 
1 1 1 24  20 0  o 18.28520 6.101742 4.465353       3.189019 5.519294       5.083649 3.781503       4.094941 20.52417 7.624673 17.92809 6.804118 2.596077       10.21918 
1 1 1 24  20 1  o 18.68123 6.206382 4.724910       3.300077 8.761338       5.425056 2.353980       4.157814 24.24139 7.953462 16.36898 6.654105 7.872402       10.36989 
1 1 1 24  20 2  o 13.27638 4.990703 1.888323       2.191012 4.282022       2.733423 -2.413714      3.664454 17.76583 5.629597 11.59878 5.388272 6.167053       7.792678 
1 1 1 24  20 3  o 20.75267 5.160152 5.938441       2.598554 6.022177       2.854366 5.533091       6.280098 20.77015 5.538283 20.85230 8.280303 -0.8215141E-01 9.961727 
1 1 1 24  20 4  o 30.88322 3.376668 12.23655       2.499883 13.94057       3.106021 9.102553       4.212265 32.67902 3.982462 24.82733 6.774906 7.851686       7.858712 
1 1 1 24  20 5  o 15.94601 4.705184 3.450013       1.953608 3.223025       2.091029 5.008650       5.479379 15.50695 4.925052 19.68453 7.760276 -4.177575      9.191192 
1 1 1 24  20 6  f 11.36561 5.604774 -9.574841      5.564828 0.000000       0.000000 -9.574841      5.564828 ?        ?        11.36561 5.604774 0.000000       5.604774 
1 1 1 24  20 7  o 25.59007 8.810934 11.25882       6.653472 0.000000       0.000000 11.25882       6.653472 ?        ?        25.59007 8.810934 0.000000       8.810934 
1 1 1 24  20 8  o 16.37699 7.203491 1.430145       5.562122 0.000000       0.000000 1.430145       5.562122 ?        ?        16.37699 7.203491 0.000000       7.203491 
1 1 1 24  20 9  o 13.27073 6.371218 -5.071345      5.973354 0.000000       0.000000 -5.071345      5.973354 ?        ?        13.27073 6.371218 0.000000       6.371218 
1 1 1 24  20 10 o 18.07734 8.061288 2.752120       7.203893 0.000000       0.000000 2.752120       7.203893 ?        ?        18.07734 8.061288 0.000000       8.061288 
1 1 1 24  20 11 o 20.16822 7.800253 6.626831       5.450386 7.693280       7.438252 5.390312       8.009419 21.13120 8.776962 19.73673 8.663947 1.394468       12.33284 
1 1 1 24  20 12 o 33.06824 7.655359 18.45666       6.047061 25.48118       9.004389 12.68598       8.161306 35.03384 10.03413 24.39066 9.513749 10.64318       13.82734 
1 1 1 24  20 13 o 12.71937 6.070201 -3.481990      5.248965 3.213325       7.330994 -10.52491      7.518888 17.79709 8.018557 12.83558 6.363064 4.961513       10.23650 
1 1 1 24  21 0  o 21.06271 6.300461 6.290212       3.483932 9.076283       5.533071 4.460015       4.484552 24.47609 8.032348 18.86010 7.128968 5.615990       10.73968 
1 1 1 24  21 1  o 25.55582 5.870498 9.201818       3.578915 14.44821       5.356007 4.969651       4.810523 31.25170 7.183471 19.53295 7.383469 11.71875       10.30135 
1 1 1 24  21 2  o 10.67713 4.549495 0.2742969      2.080844 2.850753       2.419783 -7.038911      4.076796 15.06572 5.305631 9.979404 4.896552 5.086315       7.219830 
1 1 1 24  21 3  o 25.73696 4.045585 8.744809       2.453691 12.32013       2.939370 0.5267283      4.456376 30.63672 4.035099 14.84905 6.491910 15.78767       7.643751 
1 1 1 24  21 4  o 19.50959 5.242392 5.338060       2.545394 8.094035       3.303858 1.313210       3.992626 23.79913 5.759498 14.86202 6.316197 8.937113       8.547874 
1 1 1 24  21 5  o 35.10605 4.066339 16.24871       3.414480 13.66378       3.709821 30.57165       8.732626 31.57721 4.986384 43.46933 8.548541 -11.89212      9.896544 
1 1 1 24  21 6  o 27.30562 9.754265 14.03391       8.204309 0.000000       0.000000 14.03391       8.204309 ?        ?        27.30562 9.754265 0.000000       9.754265 
1 1 1 24  21 7  o 13.83137 6.713017 -7.212386      7.086608 0.000000       0.000000 -7.212386      7.086608 ?        ?        13.83137 6.713017 0.000000       6.713017 
1 1 1 24  21 8  f 16.14625 7.261877 0.7410425      5.982539 0.000000       0.000000 0.7410425      5.982539 ?        ?        16.14625 7.261877 0.000000       7.261877 
1 1 1 24  21 9  o 15.62263 7.121783 0.4058622E-01  5.991192 0.000000       0.000000 0.4058622E-01  5.991192 ?        ?        15.62263 7.121783 0.000000       7.121783 
1 1 1 24  21 10 o 27.68250 9.267642 15.13667       7.355911 0.000000       0.000000 15.13667       7.355911 ?        ?        27.68250 9.267642 0.000000       9.267642 
1 1 1 24  21 11 o 17.83168 7.790959 3.650524       6.409415 0.000000       0.000000 3.650524       6.409415 ?        ?        17.83168 7.790959 0.000000       7.790959 
1 1 1 24  22 0  o 16.32386 5.955147 3.335397       3.077821 -1.394995      4.712019 6.855460       4.064749 13.87180 6.320655 21.63598 6.866103 -7.764180      9.332419 
1 1 1 24  22 1  o 11.96167 4.700524 1.301535       2.004667 1.914413       2.335948 -0.4112800     3.905095 13.41824 5.127855 13.32365 5.938742 0.9458733E-01  7.846244 
1 1 1 24  22 2  o 11.70959 4.819571 0.8888333      2.215192 0.8225749      2.357528 1.388376       6.473253 11.88338 4.939001 17.52427 7.737074 -5.640891      9.179109 
1 1 1 24  22 3  o 8.653888 3.933260 -0.8495525     1.810394 -2.333636      2.055559 4.282472       3.822480 8.021049 3.819775 17.89013 6.617990 -9.869078      7.641235 
1 1 1 24  22 4  o 17.08575 6.408558 3.811053       3.608533 0.000000       0.000000 3.811053       3.608533 ?        ?        17.08575 6.408558 0.000000       6.408558 
1 1 1 24  22 5  o 15.39037 7.094030 -1.232658      6.170624 0.000000       0.000000 -1.232658      6.170624 ?        ?        15.39037 7.094030 0.000000       7.094030 
1 1 1 24  22 6  o 28.89627 9.122802 15.27647       7.184054 0.000000       0.000000 15.27647       7.184054 ?        ?        28.89627 9.122802 0.000000       9.122802 
1 1 1 24  22 7  o 22.21811 8.571511 8.473608       6.569435 0.000000       0.000000 8.473608       6.569435 ?        ?        22.21811 8.571511 0.000000       8.571511 
1 1 1 24  22 8  o 24.95029 9.011714 11.80801       7.024476 0.000000       0.000000 11.80801       7.024476 ?        ?        24.95029 9.011714 0.000000       9.011714 
1 1 1 24  22 9  o 13.98100 6.542356 -1.979272      5.562111 0.000000       0.000000 -1.979272      5.562111 ?        ?        13.98100 6.542356 0.000000       6.542356 
1 1 1 24  22 10 o 15.91711 6.778552 2.542408       4.615014 7.218034       7.376853 -0.4643646     5.915637 20.55540 8.653137 15.03592 6.936125 5.519483       11.08993 
1 1 1 24  23 0  o 35.13554 4.609159 16.55630       3.851358 26.79185       6.361711 10.63459       4.838851 43.35172 6.198066 26.26881 7.298248 17.08291       9.574990 
1 1 1 24  23 1  o 18.25452 6.000825 4.714733       3.087656 -0.2222809     4.500868 9.103652       4.243682 14.20560 6.350763 24.49097 6.845979 -10.28537      9.338075 
1 1 1 24  23 2  o 9.731861 4.289328 -0.2496174     1.981480 -1.433999      2.295081 3.217749       3.926920 9.317179 4.305958 16.59978 6.561665 -7.282606      7.848358 
1 1 1 24  23 3  o 42.57086 4.050035 23.93573       4.150970 25.76857       5.045105 20.09498       7.303268 43.48405 4.843163 34.39440 8.706804 9.089649       9.963165 
1 1 1 24  23 4  o 11.22977 5.136765 -1.225590      3.151594 0.000000       0.000000 -1.225590      3.151594 ?        ?        11.22977 5.136765 0.000000       5.136765 
1 1 1 24  23 5  o 22.22391 8.575109 8.349771       6.575704 0.000000       0.000000 8.349771       6.575704 ?        ?        22.22391 8.575109 0.000000       8.575109 
1 1 1 24  23 6  o 16.00053 7.292386 0.1440814      6.277091 0.000000       0.000000 0.1440814      6.277091 ?        ?        16.00053 7.292386 0.000000       7.292386 
1 1 1 24  23 7  o 23.27263 8.726525 9.955174       6.689969 0.000000       0.000000 9.955174       6.689969 ?        ?        23.27263 8.726525 0.000000       8.726525 
1 1 1 24  23 8  o 15.11790 7.058119 -1.400751      6.412674 0.000000       0.000000 -1.400751      6.412674 ?        ?        15.11790 7.058119 0.000000       7.058119 
1 1 1 24  24 0  o 28.43624 5.362545 11.36987       3.579792 13.16115       5.714355 10.21280       4.592677 28.43021 7.943075 25.64670 7.104414 2.783506       10.65669 
1 1 1 24  24 1  o 14.98934 5.810287 2.581019       3.029238 3.379868       4.529222 1.934455       4.074714 17.15954 6.956153 15.35343 6.445235 1.806112       9.483097 
1 1 1 24  24 2  f 31.30318 3.505405 12.77389       2.628139 14.20980       3.258115 10.09926       4.446653 32.59208 4.199728 25.44897 6.967493 7.143106       8.135335 
1 1 1 24  24 3  o 34.79995 3.343076 15.69605       2.800217 17.23075       3.065146 7.951719       6.885427 36.37073 3.501526 21.93228 8.682631 14.43845       9.362092 
1 1 1 24  24 4  o 26.45289 8.911106 12.86871       6.800041 0.000000       0.000000 12.86871       6.800041 ?        ?        26.45289 8.911106 0.000000       8.911106 
1 1 1 24  24 5  o 20.04825 8.136634 6.171013       6.205228 0.000000       0.000000 6.171013       6.205228 ?        ?        20.04825 8.136634 0.000000       8.136634 
1 1 1 24  24 6  o 16.95795 7.446670 2.409449       5.921483 0.000000       0.000000 2.409449       5.921483 ?        ?        16.95795 7.446670 0.000000       7.446670 
1 1 1 24  25 0  o 12.18024 5.396656 -0.1328030     3.176323 0.3160736      4.435065 -0.6054925     4.551185 14.35174 6.366895 13.84546 6.270411 0.5062819      8.936185 
1 1 1 24  25 1  o 17.90603 6.010376 4.631969       3.093659 3.646959       4.217071 5.779823       4.552329 17.08389 6.784838 19.60319 7.227453 -2.519308      9.913128 
1 1 1 24  25 2  o 17.25169 6.135299 4.213592       3.242316 9.754803       4.385793 -2.464791      4.814835 24.82714 6.966794 12.99035 6.081453 11.83679       9.247718 
1 1 1 24  25 3  f 16.47335 4.465836 3.783866       1.837345 4.212888       2.053341 2.060453       4.115436 17.28062 4.736105 15.30331 6.453840 1.977306       8.005170 
1 1 1 24  25 4  o 16.53614 8.028471 -6.074736      10.15860 0.000000       0.000000 -6.074736      10.15860 ?        ?        16.53614 8.028471 0.000000       8.028471 
1 1 1 24  26 0  o 11.57227 5.128384 -0.1639840     2.869889 1.614400       4.281773 -1.614591      3.867103 15.12930 6.488244 12.12093 5.597339 3.008373       8.568986 
1 1 1 25  0  0  o 58.15842 3.880682 42.14188       5.442880 42.14188       5.442880 42.14188       5.442880 58.15842 3.880682 58.15842 3.880682 0.000000       0.000000 
1 1 1 25  0  1  o 29.36463 6.305476 12.06105       3.960974 12.06105       3.960974 12.06105       3.960974 29.36463 6.305476 29.36463 6.305476 0.000000       0.000000 
1 1 1 25  0  2  o 33.07975 8.639242 16.30284       6.017174 16.30284       6.017174 16.30284       6.017174 33.07975 8.639242 33.07975 8.639242 0.000000       0.000000 
1 1 1 25  0  3  f 36.68736 9.144152 19.94390       7.073340 19.94390       7.073340 19.94390       7.073340 36.68736 9.144152 36.68736 9.144152 0.000000       0.000000 
1 1 1 25  0  4  o 25.16138 7.758550 9.918830       4.161753 9.918830       4.161753 9.918830       4.161753 25.16138 7.758550 25.16138 7.758550 0.000000       0.000000 
1 1 1 25  0  5  o 42.60221 8.199795 25.48844       7.602461 25.48844       7.602461 25.48844       7.602461 42.60221 8.199795 42.60221 8.199795 0.000000       0.000000 
1 1 1 25  0  6  o 28.08099 10.42548 13.77631       6.625120 13.77631       6.625120 13.77631       6.625120 28.08099 10.42548 28.08099 10.42548 0.000000       0.000000 
1 1 1 25  0  7  o 19.82196 10.23794 7.880596       6.352072 7.880596       6.352072 7.880596       6.352072 19.82196 10.23794 19.82196 10.23794 0.000000       0.000000 
1 1 1 25  0  8  o 18.59463 8.773481 6.668509       4.487710 6.668509       4.487710 6.668509       4.487710 18.59463 8.773481 18.59463 8.773481 0.000000       0.000000 
1 1 1 25  0  9  o 18.00655 8.363117 6.218746       4.065959 6.218746       4.065959 6.218746       4.065959 18.00655 8.363117 18.00655 8.363117 0.000000       0.000000 
1 1 1 25  0  10 o 11.94402 7.261723 2.016335       3.948561 2.016335       3.948561 2.016335       3.948561 11.94402 7.261723 11.94402 7.261723 0.000000       0.000000 
1 1 1 25  0  11 o 10.04462 6.644406 -0.4647465     4.241017 -0.4647465     4.241017 -0.4647465     4.241017 10.04462 6.644406 10.04462 6.644406 0.000000       0.000000 
1 1 1 25  0  12 o 9.809873 6.584180 -1.101976      4.432315 -1.101976      4.432315 -1.101976      4.432315 9.809873 6.584180 9.809873 6.584180 0.000000       0.000000 
1 1 1 25  0  13 o 13.99180 8.043639 3.736525       4.381515 3.736525       4.381515 3.736525       4.381515 13.99180 8.043639 13.99180 8.043639 0.000000       0.000000 
1 1 1 25  0  14 f 7.829063 5.527021 -4.390924      4.238942 -4.390924      4.238942 -4.390924      4.238942 7.829063 5.527021 7.829063 5.527021 0.000000       0.000000 
1 1 1 25  0  15 o 9.024299 6.180598 -1.990038      4.325295 -1.990038      4.325295 -1.990038      4.325295 9.024299 6.180598 9.024299 6.180598 0.000000       0.000000 
1 1 1 25  0  16 o 11.74292 7.459433 1.632612       4.651979 1.632612       4.651979 1.632612       4.651979 11.74292 7.459433 11.74292 7.459433 0.000000       0.000000 
1 1 1 25  0  17 o 10.01014 6.632429 -0.4942514E-01 4.253777 -0.4942514E-01 4.253777 -0.4942514E-01 4.253777 10.01014 6.632429 10.01014 6.632429 0.000000       0.000000 
1 1 1 25  0  18 f 12.13962 7.540692 2.466483       4.474847 2.466483       4.474847 2.466483       4.474847 12.13962 7.540692 12.13962 7.540692 0.000000       0.000000 
1 1 1 25  0  19 o 12.42279 7.743214 2.729189       4.759633 2.729189       4.759633 2.729189       4.759633 12.42279 7.743214 12.42279 7.743214 0.000000       0.000000 
1 1 1 25  0  20 o 8.634313 6.024430 -2.868473      4.612401 -2.868473      4.612401 -2.868473      4.612401 8.634313 6.024430 8.634313 6.024430 0.000000       0.000000 
1 1 1 25  1  0  o 78.07358 2.511551 74.93508       4.772179 78.13369       6.765172 71.76711       6.732705 79.39325 3.505348 76.03095 3.644428 3.362297       5.056612 
1 1 1 25  1  1  o 86.23542 2.750634 91.61446       5.772964 98.82437       9.221135 86.96697       7.403355 88.89036 4.269384 83.67312 3.639540 5.217239       5.610160 
1 1 1 25  1  2  o 48.06004 3.546695 28.79611       4.124522 29.86148       8.024510 28.41359       4.808279 47.37844 7.174573 47.52511 4.194759 -0.1466675     8.310866 
1 1 1 25  1  3  o 58.12268 4.224319 42.49817       5.942427 45.80275       9.001740 39.94577       7.911202 59.23101 6.334754 55.50135 5.941636 3.729668       8.685168 
1 1 1 25  1  4  o 13.73627 5.433916 1.469510       2.694977 -0.1854393     3.786987 3.167603       3.836032 13.87552 6.026513 17.48093 6.596555 -3.605408      8.934954 
1 1 1 25  1  5  o 60.55072 2.968674 45.48901       4.367089 49.05825       6.133844 41.81995       6.219030 62.41084 4.055032 57.39511 4.481946 5.015736       6.044099 
1 1 1 25  1  6  o 45.58219 3.305538 25.98821       3.646805 32.02961       5.265743 20.41980       5.055406 50.17549 4.349493 39.52140 5.389405 10.65409       6.925588 
1 1 1 25  1  7  f 17.76272 5.748858 4.074944       2.839309 4.741393       4.012877 3.406823       4.017906 19.43883 6.833546 17.76676 6.740527 1.672071       9.598545 
1 1 1 25  1  8  o 17.18665 5.733473 3.775037       2.815726 3.680052       3.823297 3.887616       4.162350 17.82960 6.614435 18.37665 6.884855 -0.5470505     9.547355 
1 1 1 25  1  9  o 16.80139 6.074363 3.387851       3.192515 3.665509       3.748029 2.653865       6.093846 17.65191 6.548913 18.86504 7.898187 -1.213131      10.26010 
1 1 1 25  1  10 o 30.31598 5.177868 12.33781       3.687992 13.59138       4.431925 9.515243       6.650276 31.37684 6.015077 25.19782 8.801591 6.179020       10.66064 
1 1 1 25  1  11 o 10.67213 4.962348 -2.233980      3.119110 -3.108681      3.657053 0.1005589      5.974505 11.16916 5.251409 16.63414 7.384019 -5.464979      9.060963 
1 1 1 25  1  12 o 23.52497 6.187586 7.909212       3.593993 9.523663       4.423393 4.773166       6.165020 25.42594 6.944402 20.13774 8.132891 5.288198       10.69433 
1 1 1 25  1  13 o 13.28020 5.657007 0.7380431      3.215612 3.424683       3.936595 -4.649265      5.574448 17.08400 6.623192 13.31569 6.326681 3.768306       9.159344 
1 1 1 25  1  14 o 27.95893 5.974985 11.23572       3.947411 10.26581       4.754672 13.38712       7.081322 25.78468 7.260376 27.83354 9.084094 -2.048861      11.62901 
1 1 1 25  1  15 o 21.20929 6.244757 6.707466       3.444333 6.779670       4.266232 6.572300       5.837102 21.01739 7.058131 20.81310 8.066090 0.2042866      10.71816 
1 1 1 25  1  16 o 13.92708 5.880925 1.399552       3.424254 3.343492       4.320438 -1.884525      5.615559 16.75582 6.793407 14.27336 6.644124 2.482463       9.502356 
1 1 1 25  1  17 o 14.35641 5.953591 1.967211       3.414869 1.561557       4.233234 2.723004       5.778247 14.81623 6.403506 16.97029 7.406341 -2.154054      9.790750 
1 1 1 25  1  18 o 14.52391 6.021622 2.187198       3.492197 0.6595055E-01  4.308142 6.251764       5.963504 13.58353 6.131097 19.46535 7.947926 -5.881824      10.03792 
1 1 1 25  1  19 f 11.66447 5.261058 -0.2887072     3.165486 2.211931       4.491567 -2.756452      4.461928 15.23285 6.589795 11.95952 5.675946 3.273329       8.697227 
1 1 1 25  1  20 o 12.54078 5.508315 0.7112494      3.241779 3.818053       4.516237 -2.590957      4.656096 16.45242 6.836802 12.17521 5.784029 4.277206       8.955270 
1 1 1 25  2  0  o 43.31764 3.552314 23.37726       3.716923 21.30860       6.203527 24.53582       4.642515 40.30682 6.539660 44.14104 4.373366 -3.834213      7.867241 
1 1 1 25  2  1  o 26.44582 5.089160 9.087857       3.160704 4.731640       5.184440 11.66471       3.987419 20.73748 7.700651 29.85530 5.688311 -9.117819      9.573761 
1 1 1 25  2  2  o 34.71769 3.615030 15.11559       3.013689 16.42991       4.275663 13.81793       4.248466 35.75553 5.047313 32.56072 5.553340 3.194805       7.504329 
1 1 1 25  2  3  o 52.45546 3.090252 34.13818       3.932714 27.78799       5.164741 42.90074       6.066957 46.79142 4.588387 58.35859 4.296205 -11.56717      6.285752 
1 1 1 25  2  4  o 26.58608 5.205345 9.278003       3.251660 9.237617       3.831529 9.381966       6.147493 26.24137 6.106750 26.17083 8.458189 0.7054329E-01  10.43232 
1 1 1 25  2  5  o 67.14137 2.922806 55.88457       4.770728 59.74252       6.519030 51.43594       7.000308 68.97267 3.894374 63.63954 4.543816 5.333130       5.984348 
1 1 1 25  2  6  o 26.67896 4.869343 9.325998       3.049129 8.463734       4.008000 10.51069       4.697960 24.86264 6.531788 27.54924 6.988243 -2.686604      9.565553 
1 1 1 25  2  7  o 13.98090 5.429107 1.778757       2.648434 1.237609       3.471135 2.532689       4.097125 14.59484 6.022714 16.84908 6.688921 -2.254236      9.000820 
1 1 1 25  2  8  o 13.13660 5.367956 1.085037       2.722840 3.626988       3.598389 -2.320059      4.164753 17.55677 6.433676 12.74201 5.856828 4.814757       8.700266 
1 1 1 25  2  9  o 27.45622 4.950498 10.03051       3.190441 12.66734       4.343688 6.941426       4.701449 30.34849 6.085348 22.29980 7.407831 8.048685       9.586836 
1 1 1 25  2  10 o 21.57910 5.741019 6.448588       3.071496 9.058661       4.110401 3.148409       4.621966 25.21177 6.610463 17.73515 7.083429 7.476622       9.688818 
1 1 1 25  2  11 f 19.94862 5.916812 5.538412       3.082772 4.252136       4.124063 7.167335       4.640966 18.43923 6.864130 22.27671 7.358579 -3.837475      10.06305 
1 1 1 25  2  12 o 14.20855 5.642998 1.868726       2.917148 1.363465       3.735275 2.658736       4.670688 14.74754 6.179603 17.07691 7.010249 -2.329375      9.345110 
1 1 1 25  2  13 o 17.11605 5.821238 3.946940       2.902224 3.896658       3.707566 4.026501       4.663754 17.48272 6.508251 18.26974 7.172521 -0.7870255     9.685163 
1 1 1 25  2  14 f 13.05697 5.469507 1.033557       2.924770 -1.167846      3.750632 4.449404       4.672010 12.42750 5.653451 18.53707 7.207353 -6.109565      9.160101 
1 1 1 25  2  15 o 11.67665 5.247655 -0.6203332     3.117405 1.888768       4.178503 -3.770038      4.681624 15.40049 6.499402 12.22987 5.807074 3.170614       8.715752 
1 1 1 25  2  16 o 9.665787 4.590637 -2.778751      2.929017 -5.861388      3.801588 1.724347       4.594726 9.764894 4.778181 15.50136 6.685322 -5.736465      8.217333 
1 1 1 25  2  17 o 13.64881 5.647511 1.688464       3.063278 3.312305       4.077163 -0.4162952     4.641812 16.32178 6.605929 13.79257 6.280231 2.529217       9.114800 
1 1 1 25  2  18 o 13.77210 5.735512 1.779927       3.188431 1.641394       4.224157 1.963368       4.860822 14.69619 6.374023 15.50900 6.780277 -0.8128071     9.305929 
1 1 1 25  2  19 o 13.73332 5.742315 1.833585       3.214916 2.788314       4.394723 0.7344657      4.715348 15.64257 6.636420 14.31172 6.441055 1.330847       9.248203 
1 1 1 25  2  20 o 12.15237 5.427374 0.2175612      3.278419 2.057887       4.485025 -1.894001      4.804183 14.91738 6.517458 12.69926 5.985689 2.218122       8.849052 
1 1 1 25  3  0  o 40.12003 3.948511 20.18796       3.810415 8.018658       6.535604 26.45468       4.690003 25.15325 8.729105 45.88276 4.242603 -20.72951      9.705511 
1 1 1 25  3  1  o 10.42177 4.644567 -0.8309268     2.387587 -2.550060      3.314008 1.024411       3.442788 11.13419 5.155714 14.53662 5.998319 -3.402428      7.909565 
1 1 1 25  3  2  o 49.45508 2.980642 30.29630       3.575496 31.89218       5.122070 28.77959       4.993414 50.34351 4.213710 47.76181 4.337487 2.581707       6.047243 
1 1 1 25  3  3  o 56.35331 3.003906 39.35572       4.110266 39.86408       5.489796 38.70724       6.200454 56.34493 4.024710 55.24610 4.648679 1.098831       6.148862 
1 1 1 25  3  4  o 15.10229 5.398995 2.570947       2.513983 3.416422       3.218550 1.247957       4.026134 17.15313 6.111451 15.59079 6.464917 1.562336       8.896346 
1 1 1 25  3  5  o 17.85847 5.851012 4.045427       2.936427 4.107075       3.335960 3.833309       6.187955 18.22031 6.240091 20.43896 8.184988 -2.218643      10.29237 
1 1 1 25  3  6  o 48.37993 3.283304 29.26775       3.847971 30.02524       4.966814 28.13049       6.085823 48.59917 4.236140 46.38836 5.489894 2.210808       6.934249 
1 1 1 25  3  7  o 31.19293 4.443325 12.58983       3.282154 16.55867       4.227913 6.570379       5.206821 35.58858 5.013841 22.26380 7.787247 13.32479       9.261740 
1 1 1 25  3  8  o 22.29693 5.607572 6.764425       3.043497 8.965838       3.880103 3.244007       4.906701 25.44484 6.293039 18.33750 7.306870 7.107336       9.643271 
1 1 1 25  3  9  o 9.259645 4.381088 -2.749500      2.619288 -0.4810776     3.309302 -6.553859      4.285635 12.51135 5.527566 10.68354 5.193333 1.827808       7.584503 
1 1 1 25  3  10 o 15.04147 6.072355 1.884351       3.435368 6.576038       4.872468 -2.753327      4.844343 21.69242 7.536543 13.44979 6.229877 8.242627       9.778080 
1 1 1 25  3  11 o 40.49030 4.665368 21.60774       4.519282 26.04209       6.626271 17.75114       6.179549 43.06043 6.518411 34.64529 7.534499 8.415142       9.962849 
1 1 1 25  3  12 o 18.37276 6.338422 4.568640       3.443827 9.209848       5.131994 0.7665502      4.644959 24.61100 7.702377 15.38936 6.679261 9.221639       10.19505 
1 1 1 25  3  13 o 14.13589 5.905290 1.321829       3.395399 1.720383       4.805916 0.9246314      4.797734 16.22229 6.913211 15.57190 6.773066 0.6503906      9.678166 
1 1 1 25  3  14 o 16.68456 6.345984 3.464231       3.566824 0.5575458      5.110496 6.224940       4.980517 15.50770 6.859387 20.55280 7.562800 -5.045095      10.21015 
1 1 1 25  3  15 o 15.46802 5.964300 2.864931       3.179583 3.157282       4.080150 2.412857       5.073737 16.54774 6.639621 16.68054 7.105690 -0.1328011     9.724988 
1 1 1 25  3  16 o 8.670747 4.234785 -4.643014      2.944887 -3.700890      3.829778 -6.005927      4.606313 10.80997 5.166105 11.00986 5.359243 -0.1998882     7.443798 
1 1 1 25  3  17 o 10.76315 4.983893 -1.505827      3.096783 0.5448049      4.038068 -4.434044      4.825379 13.73922 6.086243 11.86703 5.704831 1.872190       8.341909 
1 1 1 25  3  18 o 13.83426 5.700014 1.927001       3.102724 4.606833       4.285596 -1.024956      4.497929 17.57282 6.882519 13.07820 6.038415 4.494623       9.155956 
1 1 1 25  3  19 f 16.15285 6.143892 3.801431       3.343313 5.493381       4.441122 1.588398       5.079173 18.32915 7.053767 15.19246 6.772239 3.136693       9.778489 
1 1 1 25  3  20 o 9.726587 4.666750 -3.105191      3.193450 -0.5656182     4.191869 -6.617546      4.929770 12.74052 5.863333 10.85848 5.339202 1.882045       7.930054 
1 1 1 25  4  0  o 20.52196 5.813512 5.512418       3.039023 6.708943       3.898102 3.658131       4.852672 22.56235 6.643451 19.27948 7.385111 3.282867       9.933544 
1 1 1 25  4  1  o 19.75629 5.840323 5.083025       3.007637 5.267662       3.792624 4.770141       4.937089 20.36551 6.648137 20.53253 7.534050 -0.1670227     10.04787 
1 1 1 25  4  2  o 65.31570 2.716187 52.64997       4.313845 52.07052       6.151309 53.21074       6.051315 64.50859 3.931709 65.26031 3.821814 -0.7517242     5.483119 
1 1 1 25  4  3  o 41.12941 3.315220 21.10894       3.294645 19.45660       4.284273 23.50025       5.154020 39.05569 4.588946 42.78219 5.040257 -3.726494      6.816349 
1 1 1 25  4  4  o 23.86507 4.816132 7.454960       2.704219 5.134024       3.418623 11.33513       4.420229 19.85744 6.296195 28.96697 6.429709 -9.109526      8.999068 
1 1 1 25  4  5  o 28.59597 4.370693 10.53352       2.949181 11.66242       3.752571 8.709861       4.769499 29.74217 5.375292 25.11754 7.335726 4.624630       9.094318 
1 1 1 25  4  6  o 68.50372 3.290726 58.59340       5.477344 61.30534       6.424533 51.37622       10.48058 69.80137 3.791183 61.48432 7.126803 8.317047       8.072447 
1 1 1 25  4  7  o 9.715749 4.571776 -2.706399      2.781689 -0.3526738     3.734380 -5.640228      4.169251 13.48079 5.916899 10.94592 5.272407 2.534866       7.925148 
1 1 1 25  4  8  o 13.17143 5.566656 0.5984747      3.072399 5.224695       4.139289 -5.077300      4.584850 19.98631 6.946261 11.91166 5.681535 8.074652       8.973872 
1 1 1 25  4  9  o 28.11160 4.848236 10.49258       3.201341 12.08854       3.985402 7.589860       5.374808 29.79004 5.697459 23.12527 7.920650 6.664772       9.756932 
1 1 1 25  4  10 o 24.05200 5.324506 7.906309       3.038285 7.337350       3.691988 9.100090       5.347883 22.76180 6.393744 24.75759 7.877834 -1.995789      10.14595 
1 1 1 25  4  11 o 21.42038 5.752694 6.418549       3.066078 6.817329       3.740322 5.601653       5.353343 21.84010 6.527041 20.58871 7.787480 1.251387       10.16106 
1 1 1 25  4  12 o 36.54827 4.157856 17.46594       3.637400 17.96360       4.566922 16.60255       6.015386 36.32531 5.316539 33.14327 7.608944 3.182041       9.282329 
1 1 1 25  4  13 o 23.36773 5.567726 7.715938       3.125220 8.612770       3.807290 5.863461       5.471881 24.26367 6.362149 20.50287 7.845038 3.760801       10.10057 
1 1 1 25  4  14 o 13.29595 5.513462 1.265027       2.928366 -0.8735731     3.635362 5.216993       4.941849 12.42428 5.617662 19.39580 7.446835 -6.971517      9.328101 
1 1 1 25  4  15 o 13.06785 5.484300 1.122123       2.949051 1.627572       3.689225 0.2274764      4.908205 14.56714 6.125053 14.84411 6.634370 -0.2769699     9.029460 
1 1 1 25  4  16 o 12.33952 5.333126 0.5506006      2.936344 2.059190       3.689354 -2.056467      4.849992 14.85414 6.176530 13.20051 6.154726 1.653629       8.719528 
1 1 1 25  4  17 o 21.60446 6.104460 7.220148       3.355211 8.452943       4.319952 5.345877       5.326595 22.59845 7.065921 18.78289 7.568901 3.815561       10.35449 
1 1 1 25  4  18 o 10.03213 4.734322 -2.261067      3.022134 -1.818389      3.938406 -2.895006      4.713032 11.83052 5.525964 12.30807 5.839073 -0.4775553     8.039344 
1 1 1 25  4  19 o 14.03623 5.739663 2.214206       3.115730 2.266821       3.975444 2.130424       5.016599 14.82471 6.301552 15.50252 6.829154 -0.6778078     9.292303 
1 1 1 25  5  0  o 49.49490 2.913748 30.29857       3.498831 31.80220       4.750781 28.51633       5.172229 50.42299 3.896553 47.51664 4.521214 2.906342       5.968627 
1 1 1 25  5  1  o 35.18616 3.703527 15.54671       3.128021 13.16749       4.224574 18.43409       4.653902 31.71739 5.674065 37.85081 5.181380 -6.133413      7.683861 
1 1 1 25  5  2  o 46.31168 3.698141 26.85172       4.138945 25.36996       4.831035 30.94058       8.025146 44.72386 4.493488 48.16359 7.045934 -3.439735      8.356831 
1 1 1 25  5  3  o 49.29686 3.626393 30.41762       4.325935 30.60713       5.079325 29.91711       8.254498 49.19825 4.279153 46.98316 7.458558 2.215092       8.598909 
1 1 1 25  5  4  o 19.56173 5.851513 5.041468       3.005110 6.484288       3.377317 -0.4433497     6.584864 21.98205 6.093455 17.72777 7.816183 4.254280       9.910748 
1 1 1 25  5  5  o 49.45750 4.369081 31.13427       5.211630 31.72684       6.451890 30.02165       8.840755 49.35604 5.455201 46.27399 8.136909 3.082054       9.796351 
1 1 1 25  5  6  o 61.36302 3.535137 47.25685       5.263893 58.22198       7.925134 38.60058       7.041499 67.28158 4.866530 54.39803 5.382328 12.88354       7.256209 
1 1 1 25  5  7  o 52.94002 3.636600 35.36768       4.663045 40.51698       5.355527 19.22881       9.481229 56.52857 3.911875 34.75380 10.39318 21.77477       11.10500 
1 1 1 25  5  8  o 69.49850 2.992044 60.32637       5.055463 71.51019       6.723320 45.77671       7.668582 75.21413 3.679325 58.90548 5.402341 16.30865       6.536262 
1 1 1 25  5  9  o 21.09019 5.504010 6.101451       2.858318 7.112445       3.421122 3.764272       5.201639 22.58112 6.081994 18.90247 7.526140 3.678644       9.676436 
1 1 1 25  5  10 f 22.27015 5.611021 6.871778       3.043283 5.698653       3.694186 9.349289       5.368519 20.24917 6.557758 25.01599 7.884737 -4.766811      10.25540 
1 1 1 25  5  11 o 30.36309 4.784028 12.31742       3.422752 16.25857       4.182044 4.321315       5.956841 34.77707 5.084973 19.68799 7.978808 15.08908       9.461412 
1 1 1 25  5  12 o 15.01651 5.722005 2.516790       2.903207 4.459630       3.430107 -2.390408      5.451374 18.16037 6.322578 14.31701 6.623554 3.843364       9.156772 
1 1 1 25  5  13 o 8.727740 4.190516 -3.271768      2.585376 -1.827546      3.108102 -6.515389      4.657934 10.82266 5.004971 11.11049 5.403915 -0.2878284     7.365598 
1 1 1 25  5  14 o 15.03664 5.730418 2.664875       2.911988 2.060843       3.562594 3.880809       5.054652 14.97785 6.132570 18.08146 7.341717 -3.103610      9.566045 
1 1 1 25  5  15 o 10.17671 4.689545 -1.408013      2.693858 -0.2686828     3.312575 -3.632809      4.628988 12.26459 5.467988 12.16750 5.776557 0.9708595E-01  7.954087 
1 1 1 25  5  16 o 19.28973 5.979710 5.593842       3.101113 11.58876       3.986035 -3.598839      4.935948 27.80664 6.054459 12.49195 5.940455 15.31469       8.482068 
1 1 1 25  5  17 f 10.89387 4.962737 -0.8470590     2.902943 -1.725146      3.522841 1.010613       5.123994 11.32281 5.267893 15.17205 6.779952 -3.849244      8.585944 
1 1 1 25  5  18 o 12.02531 5.364405 0.2143924E-01  3.193057 0.5435506E-01  3.456190 -0.1703699     8.343147 12.43535 5.561836 16.67929 7.869701 -4.243936      9.636712 
1 1 1 25  5  19 o 18.77759 6.489949 5.774795       3.611080 7.733647       3.962236 -3.830045      8.773736 21.33287 6.780044 15.40401 7.474702 5.928861       10.09159 
1 1 1 25  6  0  o 55.50406 2.891610 38.08712       3.897628 42.90727       5.551824 33.40258       5.473175 58.57881 3.911603 51.47233 4.405772 7.106476       5.891644 
1 1 1 25  6  1  o 33.47036 3.740648 14.10268       2.998899 13.37428       4.078906 14.95966       4.424284 32.03682 5.417603 33.87104 5.552383 -1.834221      7.757537 
1 1 1 25  6  2  o 50.29908 2.983384 31.37915       3.640407 29.96029       5.061531 32.89966       5.239719 48.68117 4.311151 51.05459 4.250011 -2.373421      6.053810 
1 1 1 25  6  3  o 25.38694 5.308486 8.511281       3.178292 13.77435       5.266572 5.496572       3.985943 31.76461 6.993430 20.63920 6.819621 11.12541       9.768075 
1 1 1 25  6  4  o 33.27907 4.640024 14.27359       3.660766 9.388712       5.331470 18.63101       5.035415 25.97975 7.799281 37.64127 5.664966 -11.66152      9.639534 
1 1 1 25  6  5  o 20.08960 5.531031 5.395317       2.793241 5.301276       3.566814 5.544449       4.491668 20.05866 6.439073 20.80950 7.235684 -0.7508392     9.685906 
1 1 1 25  6  6  o 44.22519 3.431617 24.59487       3.669403 28.63416       4.694054 18.24837       5.883863 47.43353 4.101188 36.37079 6.890733 11.06274       8.018849 
1 1 1 25  6  7  o 11.78190 5.123450 -0.1397199     2.744029 0.3252051      2.967067 -2.888012      7.213852 12.70431 5.423509 16.77430 7.709494 -4.069991      9.426067 
1 1 1 25  6  8  o 37.41699 4.317111 18.11364       3.864299 19.79256       4.268548 10.48795       9.097144 38.99401 4.579231 26.58949 10.12960 12.40451       11.11657 
1 1 1 25  6  9  o 14.96852 5.781601 2.276235       2.991479 3.854642       3.199110 -8.712960      8.441170 17.39712 6.102571 15.59066 7.507752 1.806454       9.675109 
1 1 1 25  6  10 o 34.20241 4.683601 15.46548       3.801240 14.23927       4.080163 23.52534       10.46066 32.42418 5.350281 36.48005 10.91854 -4.055874      12.15895 
1 1 1 25  6  11 o 15.76244 5.888953 2.908777       3.040911 2.520278       3.207146 6.367616       9.569492 15.41204 5.977279 22.97063 9.770961 -7.558587      11.45424 
1 1 1 25  6  12 o 12.48759 5.347987 0.4661294      2.901677 0.2440710      3.044419 2.668964       9.588745 12.50923 5.418413 20.64824 9.247449 -8.139004      10.71795 
1 1 1 25  6  13 o 9.660871 4.555968 -2.520758      2.789902 -1.925249      2.941954 -7.839149      8.791883 10.40137 4.830622 15.64853 7.566799 -5.247159      8.977268 
1 1 1 25  6  14 o 13.30380 5.563345 1.195178       3.018151 0.2357926      3.193872 9.201205       9.226342 12.59318 5.500996 23.34572 9.742203 -10.75253      11.18801 
1 1 1 25  6  15 o 16.74317 6.046493 3.864209       3.162174 4.340851       3.359924 0.1688257      9.355414 17.49162 6.242904 18.33990 8.550011 -0.8482838     10.58662 
1 1 1 25  6  16 o 9.790423 4.563186 -1.721680      2.662284 1.286270       3.183239 -8.722604      4.856369 13.40245 5.665327 10.36348 5.133364 3.038969       7.645087 
1 1 1 25  6  17 o 19.23702 6.075669 5.721865       3.186121 4.302672       3.924130 8.467352       5.457986 17.22893 6.630466 21.79856 7.933601 -4.569626      10.33949 
1 1 1 25  6  18 o 15.42431 5.912031 3.252480       3.111151 3.822056       3.762828 2.021775       5.531145 16.43156 6.445072 15.94183 7.089107 0.4897261      9.580938 
1 1 1 25  6  19 o 12.18457 5.267917 0.8169563      2.866878 -1.126509      3.542257 4.507138       4.881076 11.55775 5.344276 17.30293 7.141237 -5.745186      8.919560 
1 1 1 25  7  0  o 28.89428 4.101277 10.62093       2.806766 6.977010       3.658581 15.83340       4.375728 22.87285 6.342771 34.97019 5.300674 -12.09734      8.266069 
1 1 1 25  7  1  o 54.07832 3.358648 36.40909       4.404280 33.53538       7.322853 38.03774       5.512824 50.70387 6.045510 54.97746 4.145381 -4.273590      7.330238 
1 1 1 25  7  2  o 15.31375 5.784492 2.340974       2.951372 2.898881       4.805974 2.003185       3.739585 18.25428 7.245219 15.97508 6.374490 2.279197       9.650249 
1 1 1 25  7  3  o 47.35283 3.126389 27.92226       3.587470 35.01299       5.133879 21.15583       5.015103 52.69082 4.028847 40.39576 5.216220 12.29506       6.590945 
1 1 1 25  7  4  f 12.30988 5.124144 0.6233773      2.543195 2.055122       3.257944 -1.609983      4.069023 15.28811 5.996952 13.16715 5.949397 2.120962       8.447411 
1 1 1 25  7  5  o 24.56314 4.986439 7.985645       2.882701 7.588439       3.543978 8.762329       4.955707 23.59100 6.114833 25.01391 7.521696 -1.422909      9.693663 
1 1 1 25  7  6  o 39.36129 3.673515 19.62566       3.482913 19.89856       4.379359 19.15595       5.745359 39.18537 4.678495 37.42762 6.537010 1.757751       8.038708 
1 1 1 25  7  7  o 26.80975 4.890088 9.530510       3.077134 11.52320       3.802615 5.750134       5.237568 29.23875 5.539607 21.14713 7.759871 8.091619       9.534299 
1 1 1 25  7  8  o 12.67775 5.254446 0.8628658      2.657807 1.043953       3.220587 0.4761984      4.706085 13.83893 5.763936 15.49873 6.724921 -1.659795      8.857060 
1 1 1 25  7  9  o 56.55727 3.243257 40.33952       4.451241 36.93518       5.409055 47.48160       7.834604 53.51623 4.180784 59.60479 5.454252 -6.088562      6.872250 
1 1 1 25  7  10 o 35.33041 4.111633 16.22554       3.473902 17.73648       4.169803 12.79762       6.280690 36.56333 4.795337 28.64694 8.432178 7.916391       9.700355 
1 1 1 25  7  11 o 25.27108 5.145244 8.750679       3.060769 8.745491       3.579319 8.764793       5.904030 24.82040 5.987353 23.90465 8.296574 0.9157486      10.23140 
1 1 1 25  7  12 o 27.38139 4.887850 10.20005       3.141771 10.77540       3.665074 8.605705       6.101096 27.72030 5.618239 23.45981 8.407974 4.260498       10.11230 
1 1 1 25  7  13 o 25.32947 6.494353 9.547396       4.027233 7.777437       5.424721 11.72063       6.011034 22.31025 7.935742 26.61967 8.336699 -4.309422      11.50985 
1 1 1 25  7  14 o 18.42692 6.595648 4.858630       3.753102 7.495415       5.303947 2.214395       5.311435 21.71305 7.832253 16.74657 7.204751 4.966475       10.64202 
1 1 1 25  7  15 o 15.98712 6.341288 3.066914       3.679329 9.021937       5.157492 -3.104748      5.250467 23.21923 7.759927 13.21430 6.237311 10.00492       9.955929 
1 1 1 25  7  16 o 13.93514 5.492321 2.197649       2.744057 1.254989       3.321642 4.223672       4.869648 13.51158 5.752338 17.67336 7.194936 -4.161776      9.211759 
1 1 1 25  7  17 o 18.33471 5.903581 5.136654       2.996653 6.004365       3.533052 2.911977       5.657126 19.46344 6.420059 16.80113 7.330487 2.662310       9.744393 
1 1 1 25  7  18 o 12.23511 5.254836 0.8668026      2.816360 -1.272913      3.275202 6.938933       5.517351 11.10437 5.136128 19.81876 7.795090 -8.714388      9.335055 
1 1 1 25  7  19 o 14.88382 5.693485 3.055766       2.881549 0.8808029      3.339922 9.388512       5.699102 12.84996 5.618996 21.88150 8.083299 -9.031535      9.844432 
1 1 1 25  8  0  o 65.62576 3.228326 53.47065       5.146985 64.33741       8.988505 48.16924       6.278174 70.96143 5.234764 61.88505 4.187712 9.076385       6.703707 
1 1 1 25  8  1  o 44.59240 3.793270 24.98256       4.082938 38.81112       6.969255 17.75603       5.038055 54.94688 5.269341 36.76590 5.816467 18.18098       7.848392 
1 1 1 25  8  2  f 17.08389 5.635933 3.653193       2.722692 4.746412       3.680743 2.332194       4.046069 19.39929 6.556070 16.71790 6.643790 2.681393       9.333917 
1 1 1 25  8  3  o 16.02122 5.616997 3.036265       2.710032 0.3329562      3.457669 7.341829       4.363658 13.71204 5.854261 23.22904 7.073753 -9.516997      9.182068 
1 1 1 25  8  4  o 25.80576 4.880879 8.757194       2.956976 7.553292       3.704191 10.87210       4.909567 23.51685 6.326254 27.89552 7.180131 -4.378668      9.569523 
1 1 1 25  8  5  o 28.79109 4.529072 10.78505       3.072798 13.33434       3.776068 5.787605       5.286931 31.86006 5.030337 21.39877 7.805231 10.46129       9.285791 
1 1 1 25  8  6  o 25.12337 4.942334 8.389853       2.918001 6.376871       3.520288 12.81000       5.216467 21.54630 6.304916 30.03617 7.217020 -8.489870      9.583180 
1 1 1 25  8  7  o 12.37030 5.193881 0.6052887      2.646826 -1.116527      3.141058 4.822123       4.915593 11.65026 5.248925 19.86981 7.473983 -8.219557      9.132997 
1 1 1 25  8  8  o 43.13157 3.526057 23.62662       3.673813 21.59259       4.456216 27.94250       6.491152 40.66495 4.576217 45.27659 6.033201 -4.611645      7.572402 
1 1 1 25  8  9  o 45.06343 3.473166 25.81214       3.784637 22.99031       4.536031 32.27692       6.865742 41.92624 4.510571 48.63155 5.914894 -6.705311      7.438496 
1 1 1 25  8  10 o 9.364722 4.563362 -5.387013      3.364835 -5.240162      4.696945 -5.541837      4.822740 11.84472 5.676844 11.91114 5.720132 -0.6642056E-01 8.058937 
1 1 1 25  8  11 o 26.75578 6.287547 10.30463       4.029696 8.543380       5.372833 12.56928       6.092467 23.62506 7.920659 28.11326 8.312677 -4.488197      11.48205 
1 1 1 25  8  12 o 14.38841 5.493317 2.300387       2.679103 1.618559       3.060973 4.533037       5.539011 13.97852 5.699258 19.22662 7.728614 -5.248101      9.602761 
1 1 1 25  8  13 o 18.03143 5.764213 4.611658       2.860543 3.762490       3.329159 7.007196       5.591643 16.87533 6.187604 21.37882 7.985911 -4.503492      10.10254 
1 1 1 25  8  14 o 9.647126 4.470080 -1.549593      2.497361 -3.959710      2.834579 6.810383       5.279247 8.818173 4.271789 20.86279 7.766227 -12.04462      8.863547 
1 1 1 25  8  15 o 9.826861 4.541655 -1.410112      2.553509 -1.821102      2.925510 -0.9531735E-01 5.232571 10.27851 4.788260 14.79579 6.709816 -4.517282      8.243123 
1 1 1 25  8  16 o 16.51127 5.698617 3.939155       2.783778 2.271002       3.156859 9.771862       5.902992 14.40690 5.819281 23.13843 8.272954 -8.731535      10.11463 
1 1 1 25  8  17 o 7.477845 3.684847 -4.440618      2.390239 -2.215719      2.682196 -13.02400      5.268227 9.400071 4.443299 9.680317 4.875030 -0.2802458     6.596122 
1 1 1 25  8  18 o 22.28276 5.319870 7.454175       2.848660 7.067298       3.259533 8.705108       5.861192 21.09976 6.035177 21.33734 8.130297 -0.2375717     10.12547 
1 1 1 25  9  0  o 56.94135 2.966916 40.19759       4.102688 41.42264       5.676806 38.85810       5.936025 57.36798 4.087453 55.39925 4.433980 1.968727       6.030543 
1 1 1 25  9  1  o 80.53779 2.892530 80.31548       5.667713 74.78783       7.330287 88.53219       8.937170 77.20459 3.908925 83.69969 4.397097 -6.495102      5.883379 
1 1 1 25  9  2  o 55.08848 3.175871 37.80581       4.245365 40.06670       5.563103 34.65313       6.569269 56.32194 4.080930 51.74296 5.283999 4.578976       6.676424 
1 1 1 25  9  3  o 15.75439 5.534626 2.937111       2.632024 4.201328       3.560720 1.414307       3.907952 18.44869 6.440616 15.47579 6.388759 2.972896       9.071812 
1 1 1 25  9  4  o 24.69676 5.082544 8.104589       2.956792 9.165801       3.677108 6.163023       4.973719 25.97356 5.939078 21.70234 7.609469 4.271219       9.652806 
1 1 1 25  9  5  o 24.21471 5.030168 7.816586       2.871127 7.617920       3.483386 8.237514       5.070433 23.56054 6.039500 24.16610 7.668546 -0.6055527     9.761258 
1 1 1 25  9  6  o 29.01521 4.554284 11.02500       3.114263 12.80692       3.754180 7.092972       5.576723 31.04024 5.143047 22.73727 8.050263 8.302965       9.552888 
1 1 1 25  9  7  o 27.67828 4.691740 10.13366       3.051620 11.34923       3.667032 7.395900       5.503274 28.98833 5.389369 22.90390 8.006233 6.084429       9.651170 
1 1 1 25  9  8  o 22.23376 6.668661 7.018587       3.899077 10.02846       5.512223 4.004551       5.516035 25.88091 7.963593 19.29331 7.727281 6.587606       11.09638 
1 1 1 25  9  9  o 12.50272 5.244571 0.7242804      2.694840 0.4850500      3.163249 1.357423       5.146072 13.06043 5.588358 16.56960 7.109591 -3.509161      9.043011 
1 1 1 25  9  10 o 14.65445 5.448811 2.469767       2.597251 1.704099       3.020865 4.640002       5.085863 14.13909 5.699143 19.33609 7.519300 -5.197000      9.435046 
1 1 1 25  9  11 o 12.35288 5.130183 0.9080037      2.540796 1.383145       2.871256 -0.8070656     5.455082 13.46712 5.508759 15.19102 6.873819 -1.723895      8.808848 
1 1 1 25  9  12 o 12.10409 5.156627 0.5542357      2.672465 0.3826841      2.911565 1.471917       6.734031 12.33824 5.321465 17.70879 7.851370 -5.370548      9.484830 
1 1 1 25  9  13 o 11.30591 4.877282 0.2699546      2.446830 0.2812189      2.758161 0.2283380      5.301541 11.89381 5.154597 15.36793 6.879850 -3.474121      8.596640 
1 1 1 25  9  14 o 19.06974 5.517413 5.286270       2.709507 5.056797       3.066440 6.103419       5.786545 18.56036 5.971529 20.11432 7.960709 -1.553961      9.951486 
1 1 1 25  9  15 o 11.76511 4.934177 0.8738433      2.384566 3.513433       2.704516 -8.344074      5.054029 15.88768 5.607895 10.77065 5.317015 5.117033       7.727816 
1 1 1 25  9  16 o 15.17073 5.911057 2.925363       3.147825 5.757565       3.692029 -4.614037      6.023813 19.12788 6.564242 13.22249 6.360950 5.905396       9.140621 
1 1 1 25  9  17 o 27.50295 6.105920 11.73026       3.985583 10.68799       4.578063 14.99337       8.100422 25.08867 7.144732 25.82449 9.618735 -0.7358170     11.98196 
1 1 1 25  9  18 o 16.48374 5.532403 4.089905       2.621185 2.093242       2.790332 19.07693       7.644714 13.58502 5.476815 29.74459 9.413322 -16.15957      10.89065 
1 1 1 25  10 0  o 87.36686 3.285694 94.94595       6.982893 99.82157       8.363071 83.72134       12.68927 89.24406 3.854568 79.60416 6.600601 9.639893       7.643666 
1 1 1 25  10 1  o 24.53711 5.648168 8.061793       3.307271 6.793783       3.849404 11.63654       6.463309 22.41368 6.602392 28.54038 8.591702 -6.126709      10.83554 
1 1 1 25  10 2  f 23.99186 5.407303 7.693866       3.085497 7.135574       3.828410 8.728653       5.212101 22.87058 6.540329 25.02779 7.751211 -2.157204      10.14185 
1 1 1 25  10 3  o 30.67434 4.384179 12.15460       3.184065 13.50948       4.036291 9.922316       5.180930 31.94390 5.375819 26.46023 7.621531 5.483673       9.326691 
1 1 1 25  10 4  o 11.09537 4.921418 -0.6375026     2.648748 -1.008005      3.062517 0.4624687      5.276841 11.63796 5.218064 16.42237 7.123399 -4.784409      8.830119 
1 1 1 25  10 5  o 20.03092 5.819694 5.454893       3.008813 5.837068       3.384080 4.012725       6.573812 20.65974 6.216323 20.43078 8.343732 0.2289619      10.40483 
1 1 1 25  10 6  o 36.60749 5.387632 17.90944       4.662619 15.60037       5.787219 22.18103       7.871291 32.88766 7.400450 38.39083 8.624681 -5.503166      11.36450 
1 1 1 25  10 7  o 36.45550 4.103490 17.17447       3.582217 17.43100       4.032243 16.21382       7.802973 36.44632 4.645446 31.84944 9.404943 4.596880       10.48967 
1 1 1 25  10 8  o 14.79133 5.692950 2.269404       2.893087 0.6010805      3.200835 9.715185       6.762049 13.26360 5.646763 25.21762 8.870229 -11.95403      10.51508 
1 1 1 25  10 9  o 27.77160 4.915990 10.39421       3.205236 8.714405       3.547915 17.85155       7.475431 24.86451 5.937495 33.29824 8.999863 -8.433729      10.78199 
1 1 1 25  10 10 o 18.76063 5.632330 4.906539       2.780393 7.484763       3.141479 -4.414485      5.973182 23.06042 5.638168 14.00048 6.621712 9.059944       8.696897 
1 1 1 25  10 11 o 14.42336 5.416412 2.396703       2.579345 3.466891       2.824754 -2.971951      6.326788 16.27719 5.732421 14.99046 7.002591 1.286727       9.049692 
1 1 1 25  10 12 o 13.18308 5.594072 0.9011498      3.123667 -0.7519763     3.527368 6.908552       6.724208 12.33619 5.559766 21.50292 8.558499 -9.166727      10.20583 
1 1 1 25  10 13 o 10.99215 4.967311 -0.7953240     2.837635 -1.231684      3.211933 0.7564071      6.056923 11.34092 5.186887 16.37094 7.339384 -5.030023      8.987233 
1 1 1 25  10 14 o 18.50004 5.449357 4.984015       2.622333 5.611019       2.864989 1.745884       6.510813 19.49354 5.683315 17.09620 7.640993 2.397341       9.522859 
1 1 1 25  10 15 o 17.00422 5.292296 4.196692       2.426401 5.873490       2.690065 -3.121173      5.619720 19.94872 5.401841 13.48444 6.390977 6.464282       8.368063 
1 1 1 25  10 16 o 13.39258 5.003856 2.246908       2.195585 3.259509       2.387875 -3.291560      5.584537 15.22252 5.276687 13.23803 6.301892 1.984492       8.219323 
1 1 1 25  10 17 o 7.958248 3.752516 -1.655729      1.891488 -1.188468      2.014822 -5.125609      5.490529 8.669271 4.016317 12.24315 5.934346 -3.573877      7.165701 
1 1 1 25  11 0  o 15.60044 5.677077 2.712924       2.794615 1.816349       3.481180 4.338026       4.686768 15.32388 6.138278 19.55067 7.309588 -4.226797      9.545079 
1 1 1 25  11 1  o 40.32116 4.170080 20.71503       4.038385 20.74951       6.996043 20.69780       4.945513 38.45525 7.733841 39.82608 5.221379 -1.370834      9.331404 
1 1 1 25  11 2  o 15.75526 5.594664 2.920446       2.695151 2.502001       3.703236 3.391680       3.929891 16.33974 6.398342 17.65077 6.673174 -1.311029      9.245001 
1 1 1 25  11 3  o 16.78280 5.564604 3.585793       2.653199 3.534528       3.627280 3.644783       3.890962 17.48917 6.450873 17.86792 6.664213 -0.3787498     9.274993 
1 1 1 25  11 4  o 11.88033 5.069378 0.2543898      2.590082 -0.7785890     3.129223 2.501754       4.615593 11.94265 5.320116 17.28096 7.016009 -5.338311      8.804999 
1 1 1 25  11 5  o 41.33272 4.356633 22.08851       4.322219 19.91946       5.997748 24.43193       6.234187 37.77249 6.764351 42.29450 6.235520 -4.522011      9.199900 
1 1 1 25  11 6  o 40.94050 3.724427 21.39301       3.675139 22.06035       4.456708 19.97482       6.496949 41.15100 4.518481 37.20810 7.425653 3.942902       8.692353 
1 1 1 25  11 7  o 15.86983 5.698747 3.063214       2.804235 4.295255       3.326944 0.4012764E-01  5.211443 18.08258 6.230286 15.73720 6.945371 2.345377       9.330308 
1 1 1 25  11 8  o 13.81905 5.443784 1.773733       2.694549 1.232792       3.110455 3.400499       5.394004 13.76615 5.692957 18.50286 7.557393 -4.736709      9.461710 
1 1 1 25  11 9  o 9.994704 4.571334 -1.297704      2.495089 -1.859950      2.833106 0.6457766      5.267322 10.29319 4.766528 16.03972 7.033988 -5.746534      8.496868 
1 1 1 25  11 10 o 13.64103 5.670000 1.234820       3.107400 -1.505307      3.749467 7.244606       5.552822 12.26549 5.607626 22.03428 8.004756 -9.768790      9.773515 
1 1 1 25  11 11 o 17.20954 5.490141 4.110002       2.596031 5.749066       2.934181 -1.796968      5.570206 20.02950 5.725096 14.60653 6.735365 5.422964       8.839789 
1 1 1 25  11 12 o 12.41567 5.144029 1.058141       2.546046 0.2973013      2.629251 12.51173       10.20132 11.67892 5.047077 25.38814 10.38414 -13.70922      11.54570 
1 1 1 25  11 13 o 21.64076 5.097502 6.663753       2.643644 6.139765       2.933909 8.925727       6.095788 20.45318 5.683066 22.86376 8.374509 -2.410576      10.12075 
1 1 1 25  11 14 o 17.77491 5.406929 4.604050       2.550421 5.185933       2.698416 -0.2683875     7.808440 18.76361 5.528069 16.86314 7.844605 1.900463       9.596738 
1 1 1 25  11 15 o 12.80196 4.873365 1.918723       2.104606 2.147860       2.269732 0.5136098      5.620598 13.34586 5.065513 15.33463 6.954167 -1.988769      8.603479 
1 1 1 25  11 16 o 7.987612 3.726296 -1.306363      1.781772 -1.499690      1.876889 0.4573032      5.668924 8.069786 3.784003 15.16772 6.919474 -7.097939      7.886558 
1 1 1 25  11 17 o 23.39730 5.260931 8.152268       2.926571 8.646224       3.364650 6.617233       5.931374 23.57426 5.877508 19.44392 7.931287 4.130339       9.871697 
1 1 1 25  12 0  o 36.52748 3.779734 16.90976       3.315920 18.20301       4.646775 15.56793       4.733258 37.27325 5.262070 34.11919 5.906580 3.154057       7.910567 
1 1 1 25  12 1  o 32.37934 4.036086 13.41802       3.115718 15.86118       4.335617 10.80881       4.480537 34.68848 5.296618 27.92846 6.674500 6.760023       8.520745 
1 1 1 25  12 2  o 19.35292 5.496459 5.034613       2.713063 3.227424       3.613148 7.370736       4.108015 17.06985 6.410540 23.03732 6.829506 -5.967468      9.366813 
1 1 1 25  12 3  o 9.957301 4.526903 -1.213783      2.400142 -0.4046610     3.166145 -2.306963      3.680187 12.34861 5.433107 11.84333 5.466028 0.5052757      7.706887 
1 1 1 25  12 4  o 16.01470 6.049353 2.802513       3.227863 3.753010       4.400720 1.695654       4.748914 18.29930 7.026933 16.61828 6.965940 1.681028       9.894549 
1 1 1 25  12 5  o 8.791327 4.190175 -2.945004      2.484402 -3.368783      2.893470 -1.756014      4.846608 9.482442 4.520255 14.09983 6.419027 -4.617389      7.850899 
1 1 1 25  12 6  f 13.11890 5.331540 1.233316       2.668447 0.7067967      3.149744 2.572164       5.022658 13.31372 5.631997 17.55665 7.244823 -4.242935      9.176430 
1 1 1 25  12 7  o 23.70122 5.276620 7.701560       2.969279 7.371387       3.468666 8.607001       5.744092 22.83622 6.112443 23.99289 8.188997 -1.156668      10.21869 
1 1 1 25  12 8  o 12.49561 5.175395 0.9272016      2.575981 0.5303097      2.907478 2.376050       5.555099 12.62076 5.377720 17.68961 7.481109 -5.068857      9.213407 
1 1 1 25  12 9  o 22.17453 6.344300 7.125577       3.601522 8.256584       4.383724 4.776866       6.317213 23.50581 7.075686 20.04951 8.182589 3.456303       10.81758 
1 1 1 25  12 10 o 11.74175 4.875058 0.8088688      2.293493 -0.9291635E-01 2.496083 5.697440       5.811637 11.08175 4.851402 20.37560 8.004458 -9.293859      9.359885 
1 1 1 25  12 11 o 16.54372 5.253022 3.785936       2.378920 3.794606       2.600351 3.741435       5.891289 16.60327 5.509034 18.51398 7.759498 -1.910709      9.516263 
1 1 1 25  12 12 o 35.42721 3.579938 16.37584       3.048281 16.93501       3.400279 14.08681       6.879682 35.76965 3.967540 28.04202 8.936495 7.727631       9.777643 
1 1 1 25  12 13 o 13.79799 5.130247 2.339431       2.302408 2.003517       2.364683 8.466200       10.09891 13.33688 5.143270 22.16944 9.730344 -8.832556      11.00603 
1 1 1 25  12 14 o 11.47917 5.011874 0.2388784      2.648299 -0.8637006     2.963015 4.617735       5.904856 11.03416 5.021667 18.47459 7.757348 -7.440436      9.240865 
1 1 1 25  12 15 o 23.33992 9.292406 11.29347       7.929172 0.000000       0.000000 11.29347       7.929172 ?        ?        23.33992 9.292406 0.000000       9.292406 
1 1 1 25  12 16 o 24.99619 8.748429 12.61061       6.572137 0.000000       0.000000 12.61061       6.572137 ?        ?        24.99619 8.748429 0.000000       8.748429 
1 1 1 25  13 0  o 42.84029 3.402777 23.08904       3.523236 31.24647       5.183437 16.08380       4.803446 49.41102 4.349188 34.59655 5.909542 14.81446       7.337447 
1 1 1 25  13 1  o 24.51176 4.945460 7.990917       2.852045 6.412131       3.993650 9.634163       4.074364 21.62494 6.798480 26.35998 6.406343 -4.735035      9.341335 
1 1 1 25  13 2  o 23.55737 5.281064 7.492411       2.956592 5.487427       3.880189 10.26803       4.565381 20.21920 6.730168 26.92435 6.920619 -6.705149      9.653504 
1 1 1 25  13 3  o 14.27523 5.619171 1.834214       2.869026 4.215512       4.197286 -0.2541523     3.930657 18.67080 6.929666 13.79059 6.061066 4.880211       9.206346 
1 1 1 25  13 4  o 16.23634 5.698115 3.270004       2.789333 1.586624       3.255468 7.918253       5.409625 14.49233 5.889163 23.47538 7.947958 -8.983042      9.892031 
1 1 1 25  13 5  o 13.21909 5.275713 1.438842       2.561959 0.9293032      3.022518 2.739172       4.828443 13.34741 5.573434 17.52270 7.152818 -4.175289      9.067854 
1 1 1 25  13 6  o 50.60369 3.275865 32.39384       4.017947 33.34895       4.814206 30.20134       7.294045 50.95707 3.906689 46.34150 6.649171 4.615566       7.711919 
1 1 1 25  13 7  o 32.37228 5.208673 14.20276       3.969627 11.42853       5.088861 18.51463       6.344275 27.60880 7.409709 35.19400 7.618652 -7.585209      10.62768 
1 1 1 25  13 8  o 27.62745 4.640494 10.24002       3.013565 8.830411       3.404555 15.34136       6.476701 25.05449 5.704500 31.09048 8.365900 -6.035997      10.12569 
1 1 1 25  13 9  o 9.665026 4.371439 -0.8599189     2.203384 -0.9537039     2.426940 -0.4200566     5.255941 10.09624 4.575031 15.12514 6.804283 -5.028895      8.199340 
1 1 1 25  13 10 o 12.30153 4.923202 1.313323       2.237320 1.664512       2.428922 -0.6528793     5.747219 13.09491 5.165423 15.42290 7.009119 -2.327995      8.706857 
1 1 1 25  13 11 o 41.18789 3.333045 21.87099       3.316835 21.74921       3.698212 22.37176       7.499335 40.76908 3.764923 36.53893 8.571230 4.230156       9.361657 
1 1 1 25  13 12 o 13.11143 5.370076 1.469656       2.732841 1.296417       3.130383 2.024738       5.603405 13.45228 5.648318 16.66225 7.282224 -3.209968      9.215980 
1 1 1 25  13 13 o 12.18126 4.580573 1.703125       1.846035 1.927453       1.954142 -0.1577004     5.628170 12.70819 4.726094 15.10651 6.892703 -2.398325      8.357351 
1 1 1 25  13 14 f 16.20021 7.891231 -5.945117      10.03523 0.000000       0.000000 -5.945117      10.03523 ?        ?        16.20021 7.891231 0.000000       7.891231 
1 1 1 25  13 15 o 15.77853 7.047371 1.613236       5.528699 0.000000       0.000000 1.613236       5.528699 ?        ?        15.77853 7.047371 0.000000       7.047371 
1 1 1 25  13 16 o 11.08078 5.364310 -4.648539      4.451059 -9.392580      6.155823 0.5493023      6.443524 11.62400 5.761572 15.68080 7.235533 -4.056796      9.249252 
1 1 1 25  14 0  o 22.94227 5.273198 7.099612       2.886288 6.150777       3.905424 8.241593       4.284522 21.20211 6.730406 24.19771 6.918690 -2.995604      9.652286 
1 1 1 25  14 1  o 23.61727 5.099690 7.494749       2.848985 8.627402       3.771530 5.989537       4.347784 24.92071 6.228212 21.03106 7.125310 3.889656       9.463650 
1 1 1 25  14 2  o 18.01851 5.950487 4.272796       3.034829 1.346621       4.505135 6.703834       4.106327 15.99304 6.749020 21.90355 6.894769 -5.910505      9.648167 
1 1 1 25  14 3  o 22.07569 5.178460 6.618178       2.737402 8.288792       3.602053 4.334366       4.211554 24.37759 6.083354 18.75531 6.945069 5.622274       9.232615 
1 1 1 25  14 4  o 12.73334 5.212988 1.054855       2.573911 2.945559       2.954318 -4.901450      5.243651 15.84830 5.825891 12.94721 6.147131 2.901083       8.469252 
1 1 1 25  14 5  f 8.494615 4.055217 -2.834387      2.346360 -2.130630      2.628627 -5.593451      5.204731 9.674985 4.517613 12.52552 5.995830 -2.850536      7.507250 
1 1 1 25  14 6  o 21.51213 6.099629 6.562316       3.343961 7.493388       4.318652 5.168321       5.284298 22.64400 7.062543 20.04597 7.699490 2.598032       10.44805 
1 1 1 25  14 7  o 21.09381 5.214319 6.167550       2.664890 4.127639       2.990652 14.03068       5.871620 17.50009 5.909621 30.11989 7.902400 -12.61979      9.867702 
1 1 1 25  14 8  o 11.59846 4.831832 0.7254958      2.263907 1.457685       2.515425 -2.396301      5.194003 13.00253 5.214604 13.88213 6.437298 -0.8795986     8.284377 
1 1 1 25  14 9  o 27.94223 4.197739 10.39769       2.770057 9.534739       3.069920 14.17890       6.426122 26.30344 4.971483 29.18491 8.512480 -2.881466      9.857887 
1 1 1 25  14 10 o 11.46650 4.683507 0.9561228      2.071660 1.929801       2.225126 -5.381048      5.676682 13.17881 5.012351 12.91853 6.204437 0.2602797      7.976133 
1 1 1 25  14 11 o 14.04820 6.511870 -1.750513      5.307527 0.000000       0.000000 -1.750513      5.307527 ?        ?        14.04820 6.511870 0.000000       6.511870 
1 1 1 25  14 12 o 18.87932 7.868807 4.826375       6.008414 0.000000       0.000000 4.826375       6.008414 ?        ?        18.87932 7.868807 0.000000       7.868807 
1 1 1 25  14 13 o 12.61820 6.094028 -5.292750      5.659489 0.000000       0.000000 -5.292750      5.659489 ?        ?        12.61820 6.094028 0.000000       6.094028 
1 1 1 25  14 14 o 18.45906 8.622471 2.257671       9.590478 0.000000       0.000000 2.257671       9.590478 ?        ?        18.45906 8.622471 0.000000       8.622471 
1 1 1 25  14 15 o 15.81979 7.021038 1.932973       5.398703 2.310867       6.379738 0.9797907      10.13225 16.69872 7.505655 17.93148 8.522591 -1.232758      11.35647 
1 1 1 25  15 0  o 26.18720 5.282526 9.238342       3.254630 12.31921       3.958426 2.809828       5.717959 30.18843 5.586494 18.62756 7.712489 11.56087       9.523203 
1 1 1 25  15 1  o 23.36077 6.524799 7.682881       3.856498 14.63515       5.312189 -0.6417312E-01 5.607619 32.07714 6.993504 16.28705 7.195556 15.79009       10.03420 
1 1 1 25  15 2  o 16.77856 5.678689 3.625168       2.761533 3.382131       3.223776 4.295076       5.352249 16.74955 6.097096 19.51943 7.677508 -2.769880      9.804015 
1 1 1 25  15 3  o 14.93637 5.588477 2.483115       2.740541 4.052870       3.265939 -1.252789      5.038370 17.69928 6.168959 14.63934 6.616871 3.059937       9.046493 
1 1 1 25  15 4  o 27.34347 5.112659 10.12021       3.281506 10.97523       3.472532 2.983969       10.03208 28.45551 5.199293 21.60179 9.579906 6.853722       10.89987 
1 1 1 25  15 5  o 14.39800 6.117187 0.9700972      3.743092 1.310585       4.051708 -1.012981      9.778160 15.13963 6.395221 19.42153 8.944195 -4.281900      10.99534 
1 1 1 25  15 6  o 15.04929 5.654846 2.601175       2.812335 2.213109       2.928574 7.200667       10.08226 14.64061 5.702342 23.41533 9.996882 -8.774729      11.50888 
1 1 1 25  15 7  o 10.08254 4.553638 -0.8652143     2.380659 -1.533415      2.454187 9.787648       9.799129 9.662409 4.460962 24.57424 10.12789 -14.91183      11.06682 
1 1 1 25  15 8  o 31.61982 4.095335 13.21025       3.081570 13.06148       3.219922 14.83068       10.62679 31.29527 4.338675 27.42468 10.80857 3.870586       11.64686 
1 1 1 25  15 9  o 9.703382 4.529602 -1.933825      2.639583 -0.9681780     2.744792 -13.81062      9.626091 10.69894 4.854991 14.64941 7.251120 -3.950467      8.726378 
1 1 1 25  15 10 o 32.39357 11.63570 24.54417       11.69167 0.000000       0.000000 24.54417       11.69167 ?        ?        32.39357 11.63570 0.000000       11.63570 
1 1 1 25  15 11 o 19.84922 9.195200 2.986543       10.55843 0.000000       0.000000 2.986543       10.55843 ?        ?        19.84922 9.195200 0.000000       9.195200 
1 1 1 25  15 12 o 27.79042 9.051491 14.80139       7.032395 0.000000       0.000000 14.80139       7.032395 ?        ?        27.79042 9.051491 0.000000       9.051491 
1 1 1 25  15 13 o 16.53338 7.317753 2.185001       5.825366 0.000000       0.000000 2.185001       5.825366 ?        ?        16.53338 7.317753 0.000000       7.317753 
1 1 1 25  15 14 o 16.81791 7.394227 2.852960       5.854726 0.000000       0.000000 2.852960       5.854726 ?        ?        16.81791 7.394227 0.000000       7.394227 
1 1 1 25  16 0  o 16.19769 5.575589 3.304569       2.664261 1.772869       3.419991 5.669148       4.249275 14.93833 6.048659 20.46312 7.041507 -5.524786      9.282731 
1 1 1 25  16 1  o 17.90206 5.447094 4.323452       2.588215 3.816847       3.335898 5.089629       4.102442 17.42749 6.220485 19.58924 6.907461 -2.161747      9.295561 
1 1 1 25  16 2  o 24.28783 4.811080 7.924171       2.746789 8.007267       3.538763 7.798226       4.356619 23.86319 6.071557 23.21946 7.067485 0.6437263      9.317357 
1 1 1 25  16 3  o 15.48396 5.365044 3.025087       2.468398 3.727347       3.092866 1.792991       4.096701 17.04064 5.998554 15.70275 6.517210 1.337895       8.857576 
1 1 1 25  16 4  o 16.95685 5.979858 3.713000       3.074652 5.168729       4.416934 2.344469       4.282605 19.60449 7.136696 16.39601 6.719702 3.208479       9.802389 
1 1 1 25  16 5  o 18.14731 5.400563 4.557463       2.564878 4.077470       2.835093 6.721510       6.019818 17.34526 5.752224 21.69206 8.245728 -4.346807      10.05386 
1 1 1 25  16 6  o 14.10742 5.222216 2.324152       2.380859 2.875163       2.623468 -0.2484785     5.668705 15.21680 5.505774 15.74221 7.075442 -0.5254154     8.965235 
1 1 1 25  16 7  o 10.58029 4.558385 0.1553910      2.131994 -0.2669708     2.330026 2.328043       5.284617 10.53356 4.646638 17.04696 7.256482 -6.513391      8.616714 
1 1 1 25  16 8  o 14.20829 5.468333 2.257037       2.669223 0.5610898      2.959226 9.659741       6.182542 12.54727 5.387649 24.03716 8.479370 -11.48989      10.04622 
1 1 1 25  16 9  o 19.96774 8.059156 5.719276       6.049516 0.000000       0.000000 5.719276       6.049516 ?        ?        19.96774 8.059156 0.000000       8.059156 
1 1 1 25  16 10 o 12.28244 5.976659 -6.758129      5.715423 0.000000       0.000000 -6.758129      5.715423 ?        ?        12.28244 5.976659 0.000000       5.976659 
1 1 1 25  16 11 o 35.33689 8.308080 21.47880       7.033040 0.000000       0.000000 21.47880       7.033040 ?        ?        35.33689 8.308080 0.000000       8.308080 
1 1 1 25  16 12 o 13.42563 6.408278 -3.792718      5.854815 0.000000       0.000000 -3.792718      5.854815 ?        ?        13.42563 6.408278 0.000000       6.408278 
1 1 1 25  16 13 o 13.27030 6.339798 -3.650543      5.757464 0.000000       0.000000 -3.650543      5.757464 ?        ?        13.27030 6.339798 0.000000       6.339798 
1 1 1 25  17 0  f 34.32685 4.387804 15.40414       3.586627 19.66428       5.434674 12.11703       4.773848 37.73797 6.118982 29.02147 6.859342 8.716503       9.191980 
1 1 1 25  17 1  o 22.18104 5.033361 6.700013       2.658085 6.394636       3.481264 7.126944       4.116209 21.28367 6.281174 22.27044 6.886785 -0.9867649     9.320995 
1 1 1 25  17 2  o 16.27852 5.301448 3.504662       2.412448 5.387388       3.015971 0.1601233      4.019774 19.66273 5.857393 14.09934 6.164885 5.563391       8.503815 
1 1 1 25  17 3  o 14.26905 5.667116 1.899373       2.942183 0.4123937      4.249928 3.267935       4.077195 14.57872 6.357382 17.12589 6.711429 -2.547164      9.244435 
1 1 1 25  17 4  o 15.12390 5.141226 2.958861       2.263743 5.460977       2.718292 -2.703205      4.089119 19.74299 5.464388 12.08229 5.639325 7.660693       7.852485 
1 1 1 25  17 5  o 16.06744 5.418068 3.439820       2.513827 3.650989       2.786601 2.516855       5.825767 16.55122 5.701970 17.77538 7.594312 -1.224155      9.496633 
1 1 1 25  17 6  o 20.07346 5.113831 5.647893       2.508176 5.302713       2.738364 7.445964       6.249874 19.31555 5.533881 22.02394 8.394674 -2.708384      10.05457 
1 1 1 25  17 7  o 9.525465 4.400939 -1.459091      2.394905 -2.070546      2.663137 1.125838       5.475647 9.655154 4.520977 16.19178 7.133701 -6.536628      8.445645 
1 1 1 25  17 8  o 18.37852 7.878446 3.533476       6.308409 0.000000       0.000000 3.533476       6.308409 ?        ?        18.37852 7.878446 0.000000       7.878446 
1 1 1 25  17 9  o 9.777695 4.886602 -10.76076      4.818851 0.000000       0.000000 -10.76076      4.818851 ?        ?        9.777695 4.886602 0.000000       4.886602 
1 1 1 25  17 10 o 37.44420 8.277895 23.84684       7.352341 0.000000       0.000000 23.84684       7.352341 ?        ?        37.44420 8.277895 0.000000       8.277895 
1 1 1 25  17 11 o 19.40013 8.005242 5.726942       6.132042 0.000000       0.000000 5.726942       6.132042 ?        ?        19.40013 8.005242 0.000000       8.005242 
1 1 1 25  17 12 o 15.50962 7.045196 0.6543350      5.798047 0.000000       0.000000 0.6543350      5.798047 ?        ?        15.50962 7.045196 0.000000       7.045196 
1 1 1 25  18 0  o 36.09092 3.644406 16.71734       3.161379 24.52138       4.284853 7.393976       4.683416 43.50368 4.089762 22.50569 7.390164 20.99799       8.446342 
1 1 1 25  18 1  o 11.87642 4.908211 0.8234937      2.309950 0.2419889      2.826347 1.993329       4.008771 12.16479 5.244806 15.71961 6.478150 -3.554824      8.335132 
1 1 1 25  18 2  o 18.39620 5.268894 4.681008       2.482755 6.731896       3.067348 0.7846839      4.227851 21.83516 5.703331 14.82391 6.403106 7.011256       8.574833 
1 1 1 25  18 3  o 16.74092 5.313146 3.816400       2.433931 6.890199       3.010243 -1.987270      4.136330 22.08082 5.589964 12.58198 5.802619 9.498839       8.057176 
1 1 1 25  18 4  o 25.58474 4.652585 8.878022       2.793934 9.491914       3.131921 6.485402       6.183036 26.23045 5.083278 21.24469 8.282479 4.985760       9.717982 
1 1 1 25  18 5  o 20.49674 5.095179 5.890762       2.534015 5.068462       2.784901 9.847611       6.108988 18.86658 5.630545 24.43335 8.441422 -5.566771      10.14695 
1 1 1 25  18 6  o 14.60421 5.591744 2.466474       2.781205 5.045344       3.220443 -5.100544      5.516496 18.68238 6.127810 12.82495 6.148117 5.857429       8.680403 
1 1 1 25  18 7  o 21.27353 8.531859 7.083946       6.733908 0.000000       0.000000 7.083946       6.733908 ?        ?        21.27353 8.531859 0.000000       8.531859 
1 1 1 25  18 8  o 24.18118 8.530034 10.33450       6.256623 0.000000       0.000000 10.33450       6.256623 ?        ?        24.18118 8.530034 0.000000       8.530034 
1 1 1 25  18 9  o 16.81122 7.467251 1.839853       6.119443 0.000000       0.000000 1.839853       6.119443 ?        ?        16.81122 7.467251 0.000000       7.467251 
1 1 1 25  18 10 o 18.33078 7.776491 4.359966       6.033814 0.000000       0.000000 4.359966       6.033814 ?        ?        18.33078 7.776491 0.000000       7.776491 
1 1 1 25  18 11 o 14.35683 6.698547 -1.465064      5.761118 0.000000       0.000000 -1.465064      5.761118 ?        ?        14.35683 6.698547 0.000000       6.698547 
1 1 1 25  19 0  o 8.093054 3.856408 -2.456180      2.101705 -3.090768      2.555306 -1.129230      3.695084 8.800920 4.209742 12.48486 5.652514 -3.683941      7.047897 
1 1 1 25  19 1  o 11.39201 4.807365 0.5155602      2.285788 0.8626440      2.758004 -0.2458332     4.084907 12.67234 5.310032 13.74230 6.102689 -1.069965      8.089454 
1 1 1 25  19 2  o 16.89609 5.984271 3.774578       3.081864 3.972370       4.531224 3.604324       4.203979 18.06104 7.076039 17.43141 6.819744 0.6296349      9.827473 
1 1 1 25  19 3  o 13.06270 4.998525 1.816833       2.221515 0.2809943E-01  2.634849 6.214592       4.131413 11.47075 5.003830 20.52280 6.945801 -9.052050      8.560517 
1 1 1 25  19 4  o 28.29882 4.285419 10.72572       2.862879 10.21558       3.158973 13.07067       6.772808 27.21513 4.945308 27.46447 8.878091 -0.2493382     10.16251 
1 1 1 25  19 5  o 53.37934 3.135653 36.42563       4.060882 33.86724       4.388488 51.66726       10.71142 51.13492 3.543693 57.19776 7.895130 -6.062840      8.653950 
1 1 1 25  19 6  o 14.07004 6.643367 -3.331512      5.965169 0.000000       0.000000 -3.331512      5.965169 ?        ?        14.07004 6.643367 0.000000       6.643367 
1 1 1 25  19 7  o 32.98733 10.44772 22.41402       9.415503 0.000000       0.000000 22.41402       9.415503 ?        ?        32.98733 10.44772 0.000000       10.44772 
1 1 1 25  19 8  o 25.39524 9.651862 13.02814       8.247169 0.000000       0.000000 13.02814       8.247169 ?        ?        25.39524 9.651862 0.000000       9.651862 
1 1 1 25  19 9  o 22.99429 8.916927 9.985880       7.136833 0.000000       0.000000 9.985880       7.136833 ?        ?        22.99429 8.916927 0.000000       8.916927 
1 1 1 25  19 10 o 11.38532 5.687466 -12.50661      6.494913 0.000000       0.000000 -12.50661      6.494913 ?        ?        11.38532 5.687466 0.000000       5.687466 
1 1 1 25  20 0  o 11.28770 4.743950 0.5676485      2.211466 2.315812       2.625261 -3.704102      4.103783 14.35600 5.448072 11.49770 5.452873 2.858296       7.708133 
1 1 1 25  20 1  o 22.46111 4.904052 6.970124       2.608808 7.376727       3.232689 6.210797       4.417666 22.64059 5.825652 20.53760 7.173622 2.102993       9.241161 
1 1 1 25  20 2  o 31.22867 3.803509 12.77913       2.834870 13.15006       3.545053 12.12121       4.721314 31.04350 4.844267 28.26321 6.913044 2.780289       8.441392 
1 1 1 25  20 3  f 37.06329 4.727549 18.64162       4.172823 20.38437       5.290660 15.77305       6.787739 37.72054 5.952879 30.33385 8.719507 7.386686       10.55777 
1 1 1 25  20 4  o 15.33183 5.252186 3.152988       2.363338 3.037408       2.552272 3.848089       6.259069 15.24425 5.441052 18.64879 7.916222 -3.404539      9.605811 
1 1 1 25  20 5  o 20.61298 4.587525 5.896935       2.245038 6.256743       2.436830 3.877306       5.773309 21.11447 4.839681 18.26905 7.670711 2.845417       9.069858 
1 1 1 25  20 6  o 20.37333 8.147851 6.390985       6.123575 0.000000       0.000000 6.390985       6.123575 ?        ?        20.37333 8.147851 0.000000       8.147851 
1 1 1 25  20 7  o 16.93486 7.406230 2.394632       5.804195 0.000000       0.000000 2.394632       5.804195 ?        ?        16.93486 7.406230 0.000000       7.406230 
1 1 1 25  20 8  o 16.82988 7.311424 2.634652       5.576753 0.000000       0.000000 2.634652       5.576753 ?        ?        16.82988 7.311424 0.000000       7.311424 
1 1 1 25  21 0  o 28.92769 4.205522 11.15208       2.877854 10.57210       3.617052 12.15258       4.750688 27.27328 5.628997 28.27435 6.945858 -1.001068      8.940389 
1 1 1 25  21 1  o 18.21317 6.042809 4.727320       3.128676 5.628678       4.700552 4.010382       4.192188 19.70840 7.329818 17.66611 6.838659 2.042288       10.02464 
1 1 1 25  21 2  o 13.35464 5.030216 2.042912       2.228298 1.412958       2.653138 3.551190       4.105314 13.01914 5.306801 17.03575 6.716805 -4.016616      8.560235 
1 1 1 25  21 3  o 12.85049 4.895288 1.827304       2.124523 4.193253       2.560382 -3.402461      3.806651 17.20704 5.447991 11.00254 5.227778 6.204494       7.550515 
1 1 1 25  21 4  o 24.75191 5.488217 8.834586       3.223508 11.25606       3.865086 3.301991       5.842294 27.70570 5.905348 17.83163 7.611342 9.874069       9.633570 
1 1 1 25  21 5  o 13.00323 4.927017 1.945195       2.145109 0.7813691      2.282536 10.74640       6.276895 11.52473 4.830022 24.51388 8.551723 -12.98915      9.821460 
1 1 1 25  21 6  o 22.13195 8.548664 8.605494       6.540229 0.000000       0.000000 8.605494       6.540229 ?        ?        22.13195 8.548664 0.000000       8.548664 
1 1 1 25  21 7  o 17.33125 7.444126 3.225950       5.652736 0.000000       0.000000 3.225950       5.652736 ?        ?        17.33125 7.444126 0.000000       7.444126 
1 1 1 25  22 0  o 23.89959 4.984831 7.973721       2.809094 8.323519       3.523365 7.363463       4.653782 23.75449 6.066068 21.72102 7.371665 2.033466       9.546656 
1 1 1 25  22 1  o 22.60024 5.916131 7.518489       3.295763 12.15592       5.037274 4.047448       4.357996 27.67719 7.346932 17.68982 6.936832 9.987373       10.10431 
1 1 1 25  22 2  o 14.47845 5.350577 2.610972       2.497487 2.057003       2.723961 5.532987       6.256038 13.90011 5.474120 19.83097 8.123919 -5.930863      9.796124 
1 1 1 25  22 3  o 17.21832 4.887971 4.188301       2.146105 3.366043       2.533123 6.279544       4.039749 15.69250 5.435051 20.17742 6.867859 -4.484923      8.758269 
1 1 1 25  22 4  o 24.19271 8.868116 10.76452       6.837605 0.000000       0.000000 10.76452       6.837605 ?        ?        24.19271 8.868116 0.000000       8.868116 
1 1 1 25  22 5  o 25.04938 8.784984 11.65170       6.629338 0.000000       0.000000 11.65170       6.629338 ?        ?        25.04938 8.784984 0.000000       8.784984 
1 1 1 25  23 0  o 21.16385 6.098892 6.689523       3.316863 4.695976       5.172360 8.081888       4.322670 18.68076 7.482435 22.64270 7.066394 -3.961943      10.29178 
1 1 1 25  23 1  o 15.63410 5.301506 3.351416       2.406942 3.362502       2.913420 3.327580       4.271872 15.89221 5.794494 16.76012 6.769551 -0.8679104     8.910835 
1 1 1 25  23 2  o 14.19694 5.230694 2.525438       2.383734 4.677845       2.607396 -8.430482      5.882597 17.98094 5.466460 11.93487 5.861255 6.046074       8.014768 
1 1 1 26  0  0  o 70.65455 5.203130 63.38215       8.844476 63.38215       8.844476 63.38215       8.844476 70.65455 5.203130 70.65455 5.203130 0.000000       0.000000 
1 1 1 26  0  1  o 9.245553 6.075830 -0.3818493     3.456408 -0.3818493     3.456408 -0.3818493     3.456408 9.245553 6.075830 9.245553 6.075830 0.000000       0.000000 
1 1 1 26  0  2  o 67.29971 4.052251 56.77051       6.590047 56.77051       6.590047 56.77051       6.590047 67.29971 4.052251 67.29971 4.052251 0.000000       0.000000 
1 1 1 26  0  3  o 22.18015 8.169495 8.421042       4.084793 8.421042       4.084793 8.421042       4.084793 22.18015 8.169495 22.18015 8.169495 0.000000       0.000000 
1 1 1 26  0  4  o 19.85813 8.342147 7.216470       4.057897 7.216470       4.057897 7.216470       4.057897 19.85813 8.342147 19.85813 8.342147 0.000000       0.000000 
1 1 1 26  0  5  o 36.79788 5.575532 18.20273       4.660300 18.20273       4.660300 18.20273       4.660300 36.79788 5.575532 36.79788 5.575532 0.000000       0.000000 
1 1 1 26  0  6  o 30.55948 7.110470 13.69426       4.604653 13.69426       4.604653 13.69426       4.604653 30.55948 7.110470 30.55948 7.110470 0.000000       0.000000 
1 1 1 26  0  7  o 19.33536 8.449898 7.073892       4.141474 7.073892       4.141474 7.073892       4.141474 19.33536 8.449898 19.33536 8.449898 0.000000       0.000000 
1 1 1 26  0  8  o 8.759453 5.965678 -1.783015      3.909066 -1.783015      3.909066 -1.783015      3.909066 8.759453 5.965678 8.759453 5.965678 0.000000       0.000000 
1 1 1 26  0  9  o 25.63400 8.289672 10.93670       4.575109 10.93670       4.575109 10.93670       4.575109 25.63400 8.289672 25.63400 8.289672 0.000000       0.000000 
1 1 1 26  0  10 o 22.23882 9.079385 9.353226       4.839262 9.353226       4.839262 9.353226       4.839262 22.23882 9.079385 22.23882 9.079385 0.000000       0.000000 
1 1 1 26  0  11 o 18.61701 10.07563 7.759200       6.390175 7.759200       6.390175 7.759200       6.390175 18.61701 10.07563 18.61701 10.07563 0.000000       0.000000 
1 1 1 26  0  12 o 15.12585 9.052847 4.552790       5.942801 4.552790       5.942801 4.552790       5.942801 15.12585 9.052847 15.12585 9.052847 0.000000       0.000000 
1 1 1 26  0  13 o 10.55866 7.155523 -1.282316      5.482614 -1.282316      5.482614 -1.282316      5.482614 10.55866 7.155523 10.55866 7.155523 0.000000       0.000000 
1 1 1 26  0  14 o 8.576731 6.083984 -5.482020      5.348281 -5.482020      5.348281 -5.482020      5.348281 8.576731 6.083984 8.576731 6.083984 0.000000       0.000000 
1 1 1 26  0  15 o 10.83700 7.307344 -0.6413592     5.578884 -0.6413592     5.578884 -0.6413592     5.578884 10.83700 7.307344 10.83700 7.307344 0.000000       0.000000 
1 1 1 26  0  16 o 19.52166 10.15403 9.394606       6.278613 9.394606       6.278613 9.394606       6.278613 19.52166 10.15403 19.52166 10.15403 0.000000       0.000000 
1 1 1 26  0  17 o 10.68141 7.299933 -1.274607      5.963159 -1.274607      5.963159 -1.274607      5.963159 10.68141 7.299933 10.68141 7.299933 0.000000       0.000000 
1 1 1 26  1  0  o 19.12115 5.451724 4.846715       2.663942 4.064464       3.811676 5.593635       3.724600 18.48741 6.643353 20.58000 6.577260 -2.092596      9.348502 
1 1 1 26  1  1  o 20.39791 5.712008 5.582505       2.951463 5.207439       3.685529 6.253123       4.928149 19.94864 6.556030 21.86772 7.580475 -1.919079      10.02223 
1 1 1 26  1  2  o 29.13853 4.202758 10.94163       2.898111 11.31189       3.949939 10.50989       4.265302 28.98280 5.795264 27.63451 6.451580 1.348286       8.672253 
1 1 1 26  1  3  o 16.87295 5.534053 3.651883       2.626599 5.532997       3.562888 1.412449       3.887440 20.27624 6.427510 15.34133 6.356232 4.934917       9.039611 
1 1 1 26  1  4  o 41.16264 3.407763 21.38850       3.387684 21.32889       4.648089 21.45605       4.947758 40.42677 4.812482 40.36174 5.147364 0.6502914E-01  7.046654 
1 1 1 26  1  5  o 49.06883 3.260598 30.30874       3.876755 23.41465       5.208345 38.87349       5.805212 42.07171 5.190017 54.92102 4.373642 -12.84930      6.787122 
1 1 1 26  1  6  o 39.94404 4.396901 20.73336       4.209207 16.07324       7.027219 23.34087       5.256519 32.29044 8.725205 41.86385 5.269005 -9.573418      10.19272 
1 1 1 26  1  7  o 20.46196 6.218585 5.840490       3.374647 6.726670       5.675031 5.355710       4.197394 22.02568 8.078234 19.91731 6.989902 2.108372       10.68254 
1 1 1 26  1  8  o 22.67656 6.413162 7.363492       3.701432 16.05898       6.599874 3.373458       4.470714 32.16501 8.348351 17.67103 6.996167 14.49398       10.89226 
1 1 1 26  1  9  o 23.16595 5.901879 7.616878       3.340678 8.037707       4.771187 7.212150       4.679025 23.16848 7.448209 22.11681 7.391213 1.051668       10.49313 
1 1 1 26  1  10 o 10.71791 4.904759 -1.374211      2.877468 0.9597789      4.041917 -3.772670      4.097359 14.65344 6.294362 11.46224 5.439702 3.191207       8.319215 
1 1 1 26  1  11 o 12.93895 5.504187 0.7749122      3.037052 -0.4901618     3.997110 2.502780       4.671360 13.30149 5.962833 16.60456 6.930822 -3.303062      9.142848 
1 1 1 26  1  12 o 13.37794 5.512562 1.421015       2.902396 1.399744       3.872590 1.448276       4.384043 14.61221 6.215662 15.24254 6.551489 -0.6303253     9.030862 
1 1 1 26  1  13 o 19.61185 6.117349 5.755653       3.239982 5.326825       4.351857 6.288946       4.853060 18.96262 7.052661 20.12608 7.454789 -1.163456      10.26226 
1 1 1 26  1  14 o 10.80565 4.955371 -1.163822      2.958008 -2.302411      4.027222 0.1700673      4.358952 11.84530 5.550693 13.92264 6.235171 -2.077334      8.347907 
1 1 1 26  1  15 o 13.74981 5.684114 1.778168       3.099249 5.650663       4.274824 -2.512706      4.499826 18.93841 6.999913 12.32334 5.803717 6.615074       9.092959 
1 1 1 26  1  16 o 9.575909 4.577821 -2.969221      3.012407 -3.540427      4.089201 -2.291376      4.454586 11.10662 5.316071 12.27553 5.779119 -1.168909      7.852313 
1 1 1 26  1  17 o 12.22642 5.379073 0.4632173      3.103113 3.115023       4.299934 -2.418804      4.482698 15.88808 6.641974 12.15926 5.746536 3.728817       8.782853 
1 1 1 26  2  0  o 25.42553 4.518664 8.410844       2.697146 8.349659       3.658111 8.483725       3.992464 24.81548 6.094362 24.90127 6.508078 -0.8579636E-01 8.916072 
1 1 1 26  2  1  f 28.19879 4.250163 10.25324       2.829945 6.293754       3.875724 14.77505       4.141807 21.58424 6.683934 33.53535 5.239467 -11.95111      8.492761 
1 1 1 26  2  2  o 21.98936 5.763790 6.556154       3.125529 4.117954       3.602839 13.97278       6.283671 18.29299 6.471155 31.03402 8.190654 -12.74103      10.43852 
1 1 1 26  2  3  o 30.29431 5.030732 12.11587       3.583675 3.870151       5.566144 17.95391       4.683532 19.57338 7.787958 36.82373 5.377897 -17.25034      9.464357 
1 1 1 26  2  4  o 61.30972 3.578620 47.45686       5.323397 48.30366       9.055794 47.00972       6.580429 59.73274 6.316844 60.41256 4.502199 -0.6798248     7.757082 
1 1 1 26  2  5  o 52.16433 3.789512 34.62196       4.784332 25.75933       7.642855 40.33267       6.135073 42.28017 7.701589 55.81358 4.550144 -13.53341      8.945293 
1 1 1 26  2  6  o 12.98069 5.314284 1.100195       2.674935 -0.5222198     3.533478 3.278133       4.093966 12.84192 5.690793 17.39600 6.751484 -4.554073      8.829930 
1 1 1 26  2  7  o 16.98636 5.806542 3.742813       2.888205 3.758147       3.794306 3.721688       4.453509 17.63925 6.580524 18.12417 7.039596 -0.4849148     9.636349 
1 1 1 26  2  8  o 27.32637 5.180817 10.16328       3.323758 8.819720       4.299752 12.15814       5.239283 24.55625 6.900732 28.50667 7.457790 -3.950422      10.16065 
1 1 1 26  2  9  o 14.45868 5.642952 2.124927       2.872570 -1.464031      3.663652 7.852380       4.628185 12.19047 5.561783 22.94389 7.331699 -10.75342      9.202567 
1 1 1 26  2  10 o 11.48450 5.097374 -0.4098182     2.846193 -3.349997      3.658689 4.096704       4.529595 10.90968 5.166554 18.20727 7.091700 -7.297585      8.774137 
1 1 1 26  2  11 o 9.476175 4.475034 -2.500730      2.708715 -4.965954      3.475377 1.314343       4.323398 9.672905 4.696200 15.18430 6.515909 -5.511393      8.031897 
1 1 1 26  2  12 o 12.17111 5.275400 0.3447852      2.889654 0.6772463      3.722050 -0.1596318     4.584653 13.75281 5.973906 14.22993 6.382002 -0.4771261     8.741710 
1 1 1 26  2  13 o 11.22928 5.065598 -0.6715522     2.936029 2.061938       3.951782 -4.039527      4.386505 15.17936 6.358065 11.55548 5.524149 3.623881       8.422661 
1 1 1 26  2  14 o 9.320968 4.451526 -2.949268      2.833481 -0.8739213     3.764991 -5.660085      4.302975 12.36529 5.640251 10.62352 5.173118 1.741764       7.653337 
1 1 1 26  2  15 o 11.03834 4.996315 -0.6343726     2.884740 -1.657320      3.833178 0.7016782      4.380703 11.85662 5.509032 14.20995 6.314532 -2.353328      8.379901 
1 1 1 26  2  16 o 10.43968 4.871388 -1.714859      3.048082 -1.978776      4.064296 -1.375610      4.607996 11.90761 5.578700 12.97806 6.033535 -1.070444      8.217386 
1 1 1 26  3  0  o 17.12616 5.680610 3.696644       2.764906 4.835359       3.389752 1.433047       4.779252 19.28995 6.284332 16.70154 6.993639 2.588406       9.402330 
1 1 1 26  3  1  o 43.35720 4.576814 24.15811       4.762826 20.12723       7.278516 27.17665       6.298564 37.49002 8.196053 45.31170 5.839855 -7.821671      10.06376 
1 1 1 26  3  2  o 15.88712 6.221135 2.352160       3.500962 2.045197       4.869632 2.680563       5.036816 17.25291 7.127920 18.02514 7.325098 -0.7722244     10.22078 
1 1 1 26  3  3  o 12.22271 5.124710 0.5689830      2.571217 2.284339       3.247921 -2.310898      4.208385 15.43465 6.007020 12.82166 5.891234 2.612990       8.413734 
1 1 1 26  3  4  o 51.32244 3.185325 33.06178       3.964161 33.46975       5.195443 32.49331       6.132773 51.08973 4.210380 49.74516 5.132670 1.344574       6.638645 
1 1 1 26  3  5  o 37.37123 3.755433 17.83862       3.373746 10.91841       4.227990 29.96830       5.597562 27.94629 6.352754 47.84375 4.868825 -19.89746      8.003933 
1 1 1 26  3  6  o 16.30263 5.678568 3.338768       2.767100 1.979249       3.474073 5.697976       4.576457 15.21567 6.119208 20.56352 7.291491 -5.347852      9.518957 
1 1 1 26  3  7  o 12.02414 5.181487 0.1781817      2.755756 1.477913       3.519006 -1.882788      4.431277 14.66639 6.059326 13.29387 6.084726 1.372519       8.587160 
1 1 1 26  3  8  o 19.37912 5.827959 5.226597       2.975015 7.992475       3.766987 0.6418797      4.849913 23.58942 6.394258 15.60042 6.797303 7.989001       9.332195 
1 1 1 26  3  9  o 11.08354 4.944013 -0.5980954     2.711811 -3.425905      3.366757 4.625409       4.575807 10.35047 4.917519 18.94955 7.192359 -8.599078      8.712750 
1 1 1 26  3  10 o 8.494059 4.123745 -4.061491      2.679204 -3.254655      3.329290 -5.544214      4.513247 10.32925 4.902420 11.28607 5.448538 -0.9568262     7.329412 
1 1 1 26  3  11 o 16.34044 5.772867 3.555292       2.866482 4.526915       3.643173 1.976262       4.644362 18.08611 6.495383 16.08314 6.822778 2.002968       9.420207 
1 1 1 26  3  12 o 12.93601 5.426323 1.073973       2.884856 0.5501873      3.641039 1.957327       4.728418 13.51592 5.889298 15.99687 6.838320 -2.480953      9.024769 
1 1 1 26  3  13 o 12.76501 5.430273 0.9060069      2.956106 -2.044435      3.675588 6.309601       4.974216 11.50984 5.363629 20.10342 7.527517 -8.593573      9.242945 
1 1 1 26  3  14 o 11.03879 5.018148 -0.8385606     2.948524 1.385417       3.729485 -4.545911      4.815212 14.15488 6.062553 11.85077 5.697480 2.304110       8.319606 
1 1 1 26  3  15 o 11.95525 5.437500 -0.6932213     3.467349 -3.430321      5.034836 1.775948       4.782065 12.55592 5.979018 15.40480 6.730129 -2.848883      9.002404 
1 1 1 26  3  16 o 21.10859 6.762906 7.384933       3.935990 11.23899       5.957369 4.399312       5.243396 24.18708 8.336907 17.61563 7.347133 6.571451       11.11235 
1 1 1 26  4  0  o 34.10077 4.267544 14.90296       3.468889 10.38585       5.680404 17.58931       4.380573 27.03776 8.034736 36.76137 5.021024 -9.723606      9.474580 
1 1 1 26  4  1  o 21.87253 5.149300 6.392525       2.698821 4.586618       3.882645 8.080764       3.754023 19.14304 6.722366 24.27271 6.294389 -5.129667      9.209209 
1 1 1 26  4  2  o 34.08244 3.654852 14.74409       2.988188 15.41659       4.194321 14.05093       4.258277 34.19694 5.196443 32.43161 5.589801 1.765324       7.632096 
1 1 1 26  4  3  o 16.94084 5.843773 3.590516       2.927260 2.990309       3.319027 5.692233       6.210793 16.42205 6.148905 21.67646 8.341673 -5.254414      10.36304 
1 1 1 26  4  4  o 10.90907 4.929021 -1.138779      2.792812 -2.577931      3.072389 5.706735       6.700789 10.41026 4.868509 21.84944 8.591504 -11.43918      9.875035 
1 1 1 26  4  5  o 17.13598 6.060957 3.669059       3.160461 4.794385       3.486332 -1.520392      7.486699 18.97841 6.380516 17.56195 7.988496 1.416462       10.22385 
1 1 1 26  4  6  o 42.01244 4.107134 22.77082       4.151226 23.56480       4.698603 19.94630       8.862053 42.44201 4.617274 34.82401 9.948254 7.618000       10.96754 
1 1 1 26  4  7  o 10.66125 4.918077 -1.832559      2.974120 -2.490049      3.215341 2.062721       7.826215 10.69436 4.994524 19.60381 8.586100 -8.909447      9.933095 
1 1 1 26  4  8  o 13.13326 5.366280 1.240717       2.720945 3.207027       3.326058 -2.737741      4.731091 16.42764 6.154505 13.16350 6.117655 3.264132       8.677767 
1 1 1 26  4  9  o 22.98070 5.564646 7.419678       3.082721 9.891556       3.837108 2.919749       5.177181 26.29825 6.105109 17.68198 7.331457 8.616270       9.540577 
1 1 1 26  4  10 o 12.74597 5.586409 0.6781706E-01  3.318208 4.542759       4.615513 -4.719316      4.773798 18.68116 7.190485 12.05717 5.763677 6.623996       9.215370 
1 1 1 26  4  11 o 16.42627 6.292441 3.323855       3.523041 2.773053       4.909638 3.908531       5.058354 16.98974 7.099511 18.12656 7.350132 -1.136822      10.21898 
1 1 1 26  4  12 o 14.63364 6.040001 1.909468       3.492078 3.320889       4.824803 0.3566400      5.060727 17.23874 7.105869 15.10784 6.745526 2.130906       9.797729 
1 1 1 26  4  13 o 17.89469 6.161617 4.686980       3.253835 7.058648       4.170421 0.9970410      5.201906 21.10756 6.975702 15.51331 6.888068 5.594254       9.803362 
1 1 1 26  4  14 o 18.89628 6.111683 5.425338       3.209334 8.431517       4.210141 1.255483       4.958494 22.78492 6.950138 15.30602 6.764020 7.478904       9.698268 
1 1 1 26  4  15 o 15.70343 5.939989 3.358087       3.114698 0.1830946      3.900440 8.946115       5.174538 13.22173 5.911382 22.49686 7.769185 -9.275125      9.762411 
1 1 1 26  4  16 o 16.49653 5.960627 4.021980       3.073512 5.412362       3.954718 1.901274       4.884148 18.40878 6.744897 15.39324 6.761189 3.015532       9.550252 
1 1 1 26  5  0  o 34.40911 3.786788 15.02806       3.122839 17.50145       4.426305 12.57677       4.406486 36.60686 5.100128 30.47676 6.145556 6.130093       7.986186 
1 1 1 26  5  1  o 66.21515 2.732396 54.41008       4.399497 54.80333       6.387280 54.05508       6.068603 65.77690 4.003762 65.43476 3.822428 0.3421402      5.535437 
1 1 1 26  5  2  o 18.62941 5.372604 4.643595       2.573007 3.245554       3.502028 6.283531       3.792916 16.97379 6.324016 21.42801 6.608129 -4.454224      9.146613 
1 1 1 26  5  3  o 59.41321 3.005957 44.11142       4.337989 43.34994       5.756981 45.11177       6.598434 58.29168 4.078504 59.10065 4.618196 -0.8089638     6.161325 
1 1 1 26  5  4  o 31.54240 4.283056 12.91859       3.207209 12.94627       4.141418 12.87711       5.069340 30.87847 5.714136 30.04652 7.046237 0.8319454      9.071979 
1 1 1 26  5  5  o 21.21562 5.530358 6.179149       2.887950 5.185058       3.586365 8.012723       4.870691 19.56833 6.468895 23.57315 7.520089 -4.004824      9.919594 
1 1 1 26  5  6  o 9.237082 4.333364 -2.221851      2.466295 1.122373       2.991278 -9.321556      4.358422 13.50708 5.584041 9.744787 4.833235 3.762292       7.385233 
1 1 1 26  5  7  o 15.18513 5.956976 2.297474       3.214848 1.146013       4.226899 3.877602       4.951577 15.26401 6.493382 18.60584 7.363904 -3.341836      9.817896 
1 1 1 26  5  8  o 16.41807 6.136263 3.230963       3.302325 4.576721       4.372494 1.444123       5.038354 18.84531 7.057322 16.40038 7.035849 2.444931       9.965388 
1 1 1 26  5  9  o 24.11834 5.833369 8.273065       3.390663 7.220027       3.702243 13.75104       8.444091 22.24771 6.453184 27.93151 9.904366 -5.683802      11.82117 
1 1 1 26  5  10 o 35.71008 4.848952 17.26893       4.110718 18.76236       4.599794 11.34511       9.161064 36.92968 5.259748 25.33727 10.02005 11.59240       11.31664 
1 1 1 26  5  11 o 15.55086 6.032824 2.816980       3.267731 0.8254657      3.542686 14.17339       8.459829 13.68708 5.886235 27.34558 9.887927 -13.65851      11.50734 
1 1 1 26  5  12 o 10.91444 5.019188 -1.405925      3.063736 0.9654675E-01  3.319871 -10.03123      7.954361 12.59564 5.551786 13.85851 6.807914 -1.262870      8.784647 
1 1 1 26  5  13 o 11.60458 5.239549 -0.6336412     3.149243 -1.537888      3.416958 4.468038       8.116199 11.38152 5.257874 19.48705 8.630699 -8.105536      10.10615 
1 1 1 26  5  14 o 16.61213 6.224129 3.863516       3.401881 6.270184       3.745024 -7.493435      8.135371 19.94911 6.611030 14.41410 7.039565 5.535008       9.657183 
1 1 1 26  5  15 o 19.88533 6.455605 6.293643       3.578730 7.353326       3.933522 1.201621       8.622611 21.21401 6.756948 17.56691 8.195848 3.647102       10.62206 
1 1 1 26  5  16 o 15.10557 5.753796 3.089971       2.934865 4.382572       3.643508 0.7016374      4.952620 17.07072 6.431711 14.59446 6.581800 2.476258       9.202554 
1 1 1 26  6  0  o 26.63610 4.559150 9.258433       2.852973 11.10888       3.960688 7.262881       4.113050 28.68918 5.863407 22.96363 6.840155 5.725546       9.009288 
1 1 1 26  6  1  o 27.12881 4.416405 9.581864       2.819344 10.62710       3.954753 8.501660       4.020365 27.93473 5.989336 24.74407 6.561389 3.190664       8.883917 
1 1 1 26  6  2  o 24.51638 4.643389 7.931501       2.672598 7.758609       3.668868 8.126968       3.901058 23.67256 6.263701 24.15407 6.489791 -0.4815102     9.019498 
1 1 1 26  6  3  o 20.80875 5.293945 5.870556       2.690524 5.486008       3.461618 6.457358       4.276114 20.08674 6.331436 21.62789 7.059119 -1.541153      9.482523 
1 1 1 26  6  4  o 51.47361 3.208686 33.32400       4.004817 31.81944       5.106787 35.72731       6.454286 49.71110 4.256514 52.06235 5.154916 -2.351250      6.685138 
1 1 1 26  6  5  o 40.21421 4.454053 21.05689       4.291777 25.12996       6.166121 17.22952       5.977262 42.86758 6.072425 34.52047 7.332049 8.347115       9.520151 
1 1 1 26  6  6  o 23.59723 6.161394 7.858368       3.580679 11.16718       4.992141 4.352384       5.138729 27.53871 7.315682 19.29210 7.542182 8.246614       10.50732 
1 1 1 26  6  7  o 45.93753 3.555645 26.94282       3.949394 26.92693       4.896651 26.97240       6.680688 45.32050 4.492796 43.81370 6.449934 1.506805       7.860462 
1 1 1 26  6  8  o 28.10729 4.953608 10.70328       3.269019 13.47801       4.136988 6.090446       5.334057 31.17541 5.653612 20.90764 7.801818 10.26777       9.634921 
1 1 1 26  6  9  o 23.24810 5.523191 7.620085       3.082484 6.731517       3.787313 9.363758       5.305402 21.42175 6.602725 24.46002 7.853233 -3.038271      10.26008 
1 1 1 26  6  10 o 13.81746 5.520992 1.806813       2.809025 3.405160       3.447382 -1.351053      4.845636 16.53106 6.250043 13.92413 6.369299 2.606936       8.923621 
1 1 1 26  6  11 o 32.39167 4.456626 14.14541       3.424692 11.68070       4.145165 19.44576       6.078698 28.15487 6.208767 35.49502 7.272305 -7.340143      9.562176 
1 1 1 26  6  12 o 10.69602 4.836193 -0.7709176     2.694233 1.511680       3.222294 -6.074254      4.911623 13.82025 5.761538 11.47386 5.573413 2.346384       8.016125 
1 1 1 26  6  13 f 13.67334 5.466538 1.945239       2.755483 1.821471       3.306350 2.226658       4.985643 14.15691 5.863404 16.15261 6.965034 -1.995704      9.104461 
1 1 1 26  6  14 o 16.83597 5.868155 4.124271       2.955210 5.292608       3.541078 1.443376       5.364033 18.56925 6.426310 15.73775 6.990765 2.831506       9.495696 
1 1 1 26  6  15 o 9.365864 4.437792 -2.349674      2.706198 -4.466638      3.226056 2.677545       4.971405 9.212151 4.484364 16.15718 6.960944 -6.945026      8.280354 
1 1 1 26  6  16 o 7.178750 3.578367 -5.713372      2.511710 -4.577663      2.909752 -9.033547      4.975112 8.508834 4.167074 10.27133 5.106160 -1.762498      6.590703 
1 1 1 26  7  0  o 21.50767 5.193753 6.206986       2.691140 3.811002       3.624291 9.151420       4.017740 17.86674 6.470376 25.73144 6.426843 -7.864695      9.119762 
1 1 1 26  7  1  o 16.68797 5.512099 3.561207       2.604095 2.948917       3.448814 4.373278       3.971809 16.52171 6.250252 18.81880 6.779058 -2.297083      9.220698 
1 1 1 26  7  2  o 25.48880 4.731133 8.594318       2.830504 9.102210       3.786659 7.951189       4.261083 25.65705 6.138718 23.74921 6.933060 1.907839       9.260194 
1 1 1 26  7  3  o 31.57693 5.023457 13.22715       3.736171 16.85209       5.595520 10.31084       5.018877 34.60741 6.877295 26.66854 7.441522 7.938869       10.13279 
1 1 1 26  7  4  o 27.48346 5.632113 10.32099       3.645188 14.24704       5.359042 6.940530       4.972753 31.48681 7.148243 22.24693 7.618680 9.239882       10.44709 
1 1 1 26  7  5  o 35.75459 3.883599 16.44723       3.329491 18.86099       4.203101 12.38104       5.455274 37.90144 4.647875 28.89471 7.634337 9.006721       8.937888 
1 1 1 26  7  6  o 31.86510 4.354674 13.32109       3.293104 13.58730       4.063457 12.81168       5.621070 31.56619 5.481211 29.15346 7.771172 2.412731       9.509721 
1 1 1 26  7  7  o 39.13478 3.910370 19.80915       3.679329 20.47983       4.516748 18.48631       6.343371 39.22445 4.827023 35.13412 7.628069 4.090336       9.027047 
1 1 1 26  7  8  o 12.49358 5.249810 0.7686347      2.707484 3.347508       3.374463 -3.891587      4.536209 16.57236 6.201097 12.16689 5.759254 4.405469       8.463014 
1 1 1 26  7  9  o 19.01862 5.836752 5.132165       2.963485 5.637808       3.613652 4.093710       5.178667 19.77571 6.491393 18.57778 7.471183 1.197931       9.897310 
1 1 1 26  7  10 o 11.64221 5.084216 0.5738015E-01  2.726646 0.2839653      3.312550 -0.4187042     4.801629 12.86794 5.611986 14.42751 6.495876 -1.559570      8.584334 
1 1 1 26  7  11 o 21.49258 5.755829 6.750870       3.074735 5.869409       3.642184 8.937228       5.736156 19.82315 6.517495 23.18914 8.168618 -3.365988      10.45008 
1 1 1 26  7  12 o 16.42649 5.803480 3.748909       2.896986 4.665639       3.460509 1.601391       5.296484 17.92168 6.341837 16.06589 7.049212 1.855791       9.482104 
1 1 1 26  7  13 o 16.84251 5.823582 4.081923       2.907724 2.649975       3.374344 8.212098       5.730728 15.13773 6.050234 21.80934 8.096669 -6.671609      10.10749 
1 1 1 26  7  14 o 14.34264 5.621740 2.451064       2.861148 0.9302412      3.383907 6.264541       5.358457 13.22860 5.721282 19.64766 7.695705 -6.419053      9.589418 
1 1 1 26  7  15 o 10.14791 4.690739 -1.300261      2.725402 -2.036109      3.205765 0.6181386      5.176154 10.51962 4.936763 14.82610 6.703487 -4.306483      8.325165 
1 1 1 26  8  0  o 72.59027 4.115101 67.02322       7.249577 70.82010       9.855373 62.54619       10.70174 73.38400 5.552260 67.99438 6.539246 5.389626       8.578423 
1 1 1 26  8  1  o 58.48614 3.691300 43.27187       5.234164 45.59474       5.908765 34.80599       11.28030 59.80062 4.079086 47.18713 10.11382 12.61349       10.90543 
1 1 1 26  8  2  o 31.70865 5.437517 13.49452       4.050428 15.60417       5.801051 11.48765       5.657969 32.96091 7.403593 27.93253 7.938937 5.028379       10.85541 
1 1 1 26  8  3  o 21.95694 5.720579 6.639560       3.091115 6.945761       3.540134 5.656960       6.341685 22.30642 6.259109 21.49770 8.386073 0.8087215      10.46435 
1 1 1 26  8  4  o 33.05120 4.260589 14.20947       3.351827 11.23303       4.151545 19.78218       5.680607 28.37269 6.179810 37.73458 6.406446 -9.361891      8.901270 
1 1 1 26  8  5  o 60.29136 3.440796 46.06530       5.034347 42.57360       5.737552 57.74815       10.49500 57.47459 4.123927 64.12177 6.821022 -6.647179      7.970766 
1 1 1 26  8  6  o 9.133168 4.325366 -2.660519      2.564652 -1.337411      3.073949 -5.690988      4.652153 11.23056 5.112509 11.57633 5.574368 -0.3457680     7.563818 
1 1 1 26  8  7  o 20.22335 5.615905 5.730302       2.865896 4.956011       3.494613 7.320597       5.008248 18.94325 6.388169 22.26661 7.645175 -3.323360      9.962801 
1 1 1 26  8  8  o 36.81076 4.010423 17.70635       3.539400 19.93148       4.365359 13.43695       6.046804 38.58086 4.742829 29.00967 8.194399 9.571182       9.467978 
1 1 1 26  8  9  o 12.04956 5.196685 0.3307434      2.776342 -0.5706150     3.270351 2.656639       5.253404 12.08343 5.406915 17.29760 7.293139 -5.214170      9.078800 
1 1 1 26  8  10 o 23.44704 5.404174 7.823615       3.024487 8.542079       3.562902 5.970607       5.721898 24.10317 6.070239 20.31334 7.953597 3.789837       10.00537 
1 1 1 26  8  11 o 14.33749 5.578279 2.317617       2.800151 2.580482       3.269140 1.593524       5.425811 15.14108 5.986349 16.29142 7.141850 -1.150339      9.318927 
1 1 1 26  8  12 o 19.80668 6.804187 6.070162       3.967164 8.536986       5.434106 3.255026       5.805085 22.43149 7.946216 17.59709 7.550800 4.834396       10.96161 
1 1 1 26  8  13 o 19.21538 6.906955 5.759870       4.120504 3.405939       5.717531 8.303617       5.943586 17.46473 7.493816 21.76474 8.211523 -4.300013      11.11694 
1 1 1 26  8  14 o 16.40627 5.960016 3.866501       3.078282 4.094838       3.616197 3.265655       5.866046 16.88186 6.397024 17.23859 7.493731 -0.3567333     9.852813 
1 1 1 26  8  15 o 19.36905 5.837315 5.798093       2.982268 6.084296       3.316658 4.589585       6.815347 19.60968 6.199590 18.32550 8.019672 1.284178       10.13657 
1 1 1 26  9  0  o 39.55361 3.475780 19.77958       3.316194 17.54860       4.477631 22.48996       4.935317 36.44466 5.188062 41.44067 4.987236 -4.996010      7.196423 
1 1 1 26  9  1  o 17.35637 6.123653 3.748175       3.224591 2.316954       5.275253 4.601965       4.074417 17.78129 7.389012 19.09564 6.867682 -1.314346      10.08774 
1 1 1 26  9  2  o 43.14349 3.336183 23.50051       3.480298 25.32529       4.798178 21.47461       5.055681 44.17192 4.521245 40.19794 5.289282 3.973976       6.958316 
1 1 1 26  9  3  o 41.64779 3.787625 22.16741       3.802096 25.27126       4.827914 17.09908       6.169384 44.04151 4.564534 34.22722 7.595145 9.814285       8.861218 
1 1 1 26  9  4  o 36.10255 4.328960 16.98594       3.732674 14.60157       4.290464 24.40925       7.570362 32.76124 5.573534 40.62219 7.932158 -7.860954      9.694505 
1 1 1 26  9  5  o 55.23979 3.511309 38.80967       4.702225 37.64594       5.439946 42.24869       9.351608 53.94232 4.170738 54.17152 7.267160 -0.2291985     8.378942 
1 1 1 26  9  6  o 36.34403 4.346829 17.33850       3.773574 13.58773       4.242975 31.53215       8.253871 31.28306 5.778584 46.18939 7.596838 -14.90633      9.544840 
1 1 1 26  9  7  o 32.78196 4.680043 14.37337       3.632698 14.92735       4.098120 12.34157       7.848339 33.04541 5.265618 26.94212 9.549068 6.103287       10.90465 
1 1 1 26  9  8  o 12.78908 5.378505 0.8735594      2.845608 0.4076315      3.181317 2.738262       6.364326 12.85005 5.552449 18.34405 7.889238 -5.493993      9.647267 
1 1 1 26  9  9  o 26.55970 7.288815 10.97949       4.859655 3.916969       6.285855 21.47226       7.661778 18.95349 7.983734 35.76758 8.841321 -16.81409      11.91255 
1 1 1 26  9  10 o 15.13245 6.297361 1.983488       3.839581 3.154390       4.978928 0.2654326      6.031067 17.25999 7.175946 16.09895 7.261456 1.161047       10.20896 
1 1 1 26  9  11 o 11.91668 5.153953 0.4035571      2.746149 -0.7838583E-01 2.996920 2.927168       6.857859 11.87287 5.252159 18.14868 7.990136 -6.275811      9.561769 
1 1 1 26  9  12 o 16.46893 5.787624 3.826998       2.878324 1.754319       3.099591 16.80905       7.757292 13.84531 5.700087 29.20431 9.506183 -15.35900      11.08416 
1 1 1 26  9  13 o 12.75133 5.262329 1.376034       2.650225 -0.9412637     2.830081 17.88864       7.554676 10.71057 4.887239 30.13799 9.331594 -19.42742      10.53393 
1 1 1 26  9  14 o 10.15807 4.564894 -0.4625725     2.358558 -0.9652473     2.626093 1.634268       5.363512 10.24327 4.686827 15.71414 6.984766 -5.470869      8.411498 
1 1 1 26  10 0  o 64.13243 3.275338 51.65153       5.101869 60.60098       9.160118 47.62680       6.142866 67.60197 5.610899 61.02621 4.155441 6.575760       6.982111 
1 1 1 26  10 1  o 39.46083 3.569762 19.77657       3.395654 17.75062       4.577212 22.25632       5.063955 36.50037 5.300842 41.00576 5.183277 -4.505386      7.413858 
1 1 1 26  10 2  o 89.51195 3.325668 100.8455       7.241696 99.50504       8.537666 104.2830       13.67216 88.31145 3.977426 87.26123 6.475692 1.050224       7.599639 
1 1 1 26  10 3  o 33.25048 4.067999 14.31966       3.227640 19.06590       4.421331 8.904329       4.722702 37.96335 4.892823 24.68929 7.323515 13.27406       8.807588 
1 1 1 26  10 4  o 31.35943 4.618319 13.01089       3.423729 11.11265       4.157294 17.01203       6.035693 28.06263 6.240566 33.97122 7.492474 -5.908590      9.750991 
1 1 1 26  10 5  o 35.44333 4.084138 16.34599       3.463110 16.38878       4.253864 16.26188       5.963562 34.85797 5.163730 32.97420 7.580348 1.883770       9.172011 
1 1 1 26  10 6  o 17.43788 5.826544 4.108582       2.907695 2.155586       3.485708 8.576750       5.272360 15.23629 6.128767 23.71710 7.843540 -8.480816      9.954040 
1 1 1 26  10 7  o 14.64080 5.551608 2.426112       2.724648 1.271788       3.193490 5.514535       5.223603 13.79096 5.741448 20.07715 7.669223 -6.286195      9.580251 
1 1 1 26  10 8  f 30.86136 6.933197 14.31169       5.086564 15.82711       6.037937 10.60700       9.440548 31.62066 7.867666 24.72953 10.03626 6.891125       12.75251 
1 1 1 26  10 9  o 17.52014 5.781530 4.320441       2.865113 3.015934       3.305055 8.265364       5.747442 15.83642 6.087485 22.63395 8.154603 -6.797525      10.17620 
1 1 1 26  10 10 o 14.85426 5.659556 2.659107       2.839984 1.719737       3.081780 7.950478       7.314210 13.91250 5.700898 21.99192 8.866765 -8.079427      10.54134 
1 1 1 26  10 11 o 40.93184 3.616304 21.96289       3.570068 20.35413       4.129518 26.72299       7.103320 38.70444 4.459707 41.11255 7.360363 -2.408108      8.606041 
1 1 1 26  10 12 o 18.56531 5.552821 5.089966       2.706264 4.445444       3.046902 7.498636       5.890174 17.41712 5.963658 21.05489 8.117996 -3.637768      10.07309 
1 1 1 26  10 13 o 11.24517 4.802800 0.5733671      2.328690 2.223546       2.611969 -5.820368      5.141382 13.78983 5.381193 11.69852 5.687069 2.091309       7.829432 
1 1 1 26  10 14 o 13.21067 5.386261 1.740332       2.734034 1.684996       3.125678 1.920568       5.641107 13.59598 5.671773 16.06682 7.151078 -2.470838      9.127263 
1 1 1 26  11 0  o 29.30033 4.408763 11.21968       3.050474 10.44191       4.089229 12.19553       4.580492 27.37542 6.265530 29.48423 6.545772 -2.108807      9.061125 
1 1 1 26  11 1  o 62.63346 4.368634 50.61402       6.626086 45.08611       8.755074 58.02564       10.13762 57.35575 6.371306 64.99278 6.487383 -7.637035      9.092836 
1 1 1 26  11 2  o 16.87629 5.594176 3.728022       2.681519 2.356249       3.697204 5.250500       3.895004 15.90200 6.340610 19.70386 6.742865 -3.801853      9.255785 
1 1 1 26  11 3  o 22.29628 5.280937 6.822523       2.824849 6.111192       3.859101 7.643636       4.146212 20.83913 6.698488 23.02031 6.870243 -2.181175      9.595310 
1 1 1 26  11 4  o 33.70134 4.336242 14.90061       3.478770 12.74990       4.260239 19.20425       6.026441 30.19122 6.001950 36.40788 7.047235 -6.216661      9.256723 
1 1 1 26  11 5  o 27.70666 4.995754 10.41764       3.248974 8.582805       3.905953 14.53799       5.853221 24.32405 6.475338 30.81415 7.791485 -6.490099      10.13100 
1 1 1 26  11 6  o 24.62087 6.435163 8.858272       3.903356 9.730435       5.425588 7.922519       5.619897 24.93397 7.934964 22.78246 8.079908 2.151506       11.32469 
1 1 1 26  11 7  o 18.86160 6.394096 5.037056       3.501251 7.825526       3.755504 -13.48984      9.680251 23.01597 6.442552 14.95950 7.379922 8.056468       9.796414 
1 1 1 26  11 8  o 12.02916 5.168409 0.4285088      2.726494 0.6721667      3.196652 -0.2219099     5.222780 13.05849 5.603258 15.06612 6.779829 -2.007631      8.795600 
1 1 1 26  11 9  o 8.425857 4.095677 -4.015205      2.664676 -3.797975      2.789086 -6.288506      9.022575 8.818271 4.263523 16.00627 7.721443 -7.188001      8.820335 
1 1 1 26  11 10 o 22.61694 5.429936 7.405788       2.954779 7.532050       3.288554 6.876796       6.731228 22.49847 5.919405 20.91637 8.479779 1.582102       10.34147 
1 1 1 26  11 11 o 14.12080 5.833471 1.824233       3.261222 0.2409949      3.592181 9.248027       7.778539 13.01798 5.754835 22.50422 9.118498 -9.486238      10.78263 
1 1 1 26  11 12 o 14.99330 5.357725 3.049699       2.475424 2.395179       2.718556 6.225692       5.988481 14.17864 5.502002 19.78999 8.007279 -5.611350      9.715377 
1 1 1 26  11 13 o 10.71749 4.648912 0.2663488      2.247585 -0.6373861     2.462599 4.774182       5.499929 10.21571 4.620879 18.21863 7.555472 -8.002921      8.856505 
1 1 1 26  12 0  o 40.69733 3.846257 21.20632       3.769271 16.32583       4.753119 29.47599       6.187160 34.59004 5.847030 46.92345 5.516081 -12.33341      8.038341 
1 1 1 26  12 1  o 10.74433 4.797537 -0.7056289     2.560266 -2.311079      3.433733 1.304407       3.842113 11.27843 5.231349 14.97194 6.270068 -3.693504      8.165829 
1 1 1 26  12 2  o 19.09966 5.632279 5.019795       2.800032 8.554888       3.750982 0.5708185      4.207990 24.56647 6.251213 14.76809 6.383545 9.798389       8.934612 
1 1 1 26  12 3  o 15.03584 5.513855 2.660440       2.643764 5.033334       3.532204 -0.3622269     3.986592 19.15381 6.422188 13.62761 6.041516 5.526203       8.817280 
1 1 1 26  12 4  o 9.178364 4.344056 -2.614802      2.579195 -4.998642      2.971220 4.673165       5.195165 8.706175 4.252431 19.41203 7.585109 -10.70586      8.695807 
1 1 1 26  12 5  o 35.98750 5.416944 17.78369       4.603375 20.23297       6.526347 15.35857       6.494084 36.58587 7.569952 30.97573 8.395260 5.610138       11.30418 
1 1 1 26  12 6  f 13.80518 5.492304 1.803464       2.768041 1.683362       3.259187 2.114326       5.243455 14.30830 5.862844 16.91699 7.215521 -2.608691      9.297133 
1 1 1 26  12 7  o 10.73736 4.760187 -0.3565347     2.474905 -2.742421      2.790241 8.445494       5.359302 9.494879 4.501050 23.06645 7.908950 -13.57157      9.100052 
1 1 1 26  12 8  o 21.61624 5.377381 6.681520       2.820982 6.923481       3.200642 5.839280       5.971490 21.73029 5.895585 20.19312 8.055984 1.537165       9.982825 
1 1 1 26  12 9  f 12.31396 5.341302 0.4076075      2.966812 2.252192       3.544541 -3.908413      5.421913 15.02029 6.129564 13.11639 6.234148 1.903895       8.742778 
1 1 1 26  12 10 o 17.79246 5.747123 4.613791       2.838460 6.307842       2.979178 -12.05851      9.346109 20.63140 5.724539 14.48125 7.163737 6.150149       9.170032 
1 1 1 26  12 11 o 16.42882 5.313855 3.860950       2.426106 3.233664       2.676216 6.754198       5.747526 15.43216 5.563906 20.36515 7.972123 -4.932990      9.721718 
1 1 1 26  12 12 o 9.082875 4.181152 -1.110690      2.133610 -0.4072275     2.242367 -7.839500      6.935141 10.00074 4.475927 13.11408 6.424680 -3.113340      7.830098 
1 1 1 26  12 13 o 12.85740 4.973468 1.904754       2.216035 2.136712       2.403352 0.5883073      5.725501 13.40853 5.181355 15.34825 6.983267 -1.939719      8.695542 
1 1 1 26  13 0  o 25.28509 5.676080 8.833982       3.411462 12.02300       4.167975 2.361284       5.937984 29.41249 6.018101 18.25651 7.728388 11.15597       9.795178 
1 1 1 26  13 1  o 23.70757 5.868123 7.867424       3.371791 11.91485       4.132250 -0.1961731     5.832592 29.22788 6.002739 16.28403 7.258099 12.94385       9.418752 
1 1 1 26  13 2  f 23.40905 5.740052 7.673408       3.248914 7.131074       3.904623 8.893833       5.857350 22.24318 6.673841 24.20625 8.269159 -1.963066      10.62634 
1 1 1 26  13 3  o 10.90105 4.805797 -0.3195748     2.488776 -1.595999      3.120068 1.913294       4.126655 11.08639 5.086043 15.75566 6.540239 -4.669266      8.285080 
1 1 1 26  13 4  o 16.63933 6.312177 3.320454       3.523262 6.778585       4.765112 -0.8500912     5.232976 21.47459 7.453495 14.90526 6.739645 6.569328       10.04875 
1 1 1 26  13 5  o 16.75950 5.802700 3.755508       2.887313 3.807200       3.344578 3.604283       5.720596 17.08236 6.211462 18.53567 7.697868 -1.453308      9.891381 
1 1 1 26  13 6  o 24.54893 5.128739 8.392482       2.969103 8.344530       3.444153 8.531236       5.858666 24.00986 5.923580 23.10660 8.244041 0.9032555      10.15150 
1 1 1 26  13 7  o 20.63928 5.578086 6.140396       2.871767 6.605190       3.300571 4.692122       5.826183 21.16554 6.079104 19.18283 7.846985 1.982710       9.926263 
1 1 1 26  13 8  o 37.31224 4.820209 19.09278       4.280512 14.66014       5.321585 27.21745       7.204651 30.51630 7.261715 41.86768 7.328344 -11.35138      10.31684 
1 1 1 26  13 9  o 14.21939 5.263410 2.519600       2.418517 1.747870       2.742674 5.217703       5.128269 13.46757 5.429710 19.03354 7.506326 -5.565971      9.264269 
1 1 1 26  13 10 o 10.77398 4.670915 0.2095815      2.266436 0.4536716      2.495813 -0.9382391     5.412203 11.48116 4.939105 14.46560 6.659091 -2.984436      8.290854 
1 1 1 26  13 11 o 24.97573 4.865603 8.843208       2.854856 9.322237       2.980729 3.528064       9.928858 25.59187 4.958628 19.37116 8.953739 6.220711       10.23511 
1 1 1 26  13 12 o 15.32727 5.196746 3.317255       2.312752 2.519850       2.376279 17.63581       10.06949 14.00505 5.211000 26.73134 10.52563 -12.72629      11.74493 
1 1 1 26  14 0  o 14.95401 5.483297 2.616963       2.614439 2.526240       3.318615 2.765389       4.244782 15.59427 6.071222 16.85304 6.768754 -1.258774      9.092622 
1 1 1 26  14 1  o 34.20256 4.504001 15.44782       3.662845 18.14841       4.504866 10.17949       6.292003 36.67553 5.184885 25.49739 8.571674 11.17815       10.01782 
1 1 1 26  14 2  o 21.32129 5.455781 6.350803       2.846074 6.613312       3.672797 5.956253       4.502739 21.41645 6.483077 20.51838 7.236484 0.8980751      9.715811 
1 1 1 26  14 3  o 21.46332 6.235456 6.650325       3.454174 11.76999       5.337770 2.961765       4.530724 27.59250 7.664991 17.11041 6.949571 10.48210       10.34643 
1 1 1 26  14 4  o 9.188019 4.375561 -2.947075      2.697421 -3.380578      2.835659 1.176684       8.745910 9.229340 4.420038 19.19064 8.691632 -9.961296      9.750959 
1 1 1 26  14 5  o 21.45332 5.934331 6.674700       3.206979 7.492296       3.409455 0.3979878      9.446735 22.66402 6.057230 19.11030 8.797399 3.553726       10.68102 
1 1 1 26  14 6  o 9.763316 4.564046 -2.016527      2.695466 -2.242661      2.827603 0.2347368      8.921726 9.885648 4.638360 18.47726 8.521631 -8.591609      9.702195 
1 1 1 26  14 7  o 12.70030 5.416963 0.7709302      2.955213 2.084696       3.113743 -11.15439      9.381209 14.40795 5.793596 14.93268 7.347010 -0.5247240     9.356512 
1 1 1 26  14 8  o 15.92965 5.653643 3.447711       2.751957 3.752108       2.884977 0.3732872      9.168615 16.46067 5.793527 18.29569 8.507427 -1.835018      10.29278 
1 1 1 26  14 9  o 23.53101 5.265207 7.974133       2.943630 9.499117       3.087010 -7.307817      9.772258 25.87833 5.076579 15.97298 7.782021 9.905345       9.291474 
1 1 1 26  14 10 o 15.87690 5.215398 3.570682       2.332455 2.394553       2.525518 10.39294       6.082568 14.02026 5.338171 23.87456 8.411523 -9.854300      9.962419 
1 1 1 26  14 11 o 14.71874 5.649953 2.736867       2.844292 2.303422       3.215905 4.293922       6.095208 14.48729 5.865634 18.17099 7.765760 -3.683696      9.732044 
1 1 1 26  15 0  o 14.91970 5.443614 2.657064       2.571899 5.152050       3.329184 -1.035984      4.050385 19.22740 6.225246 13.17264 5.945318 6.054761       8.608165 
1 1 1 26  15 1  o 9.763724 4.470961 -1.285150      2.396072 -2.381907      2.983875 0.7059872      4.020460 10.22487 4.787014 14.47343 6.247870 -4.248560      7.870921 
1 1 1 26  15 2  o 32.47621 4.837775 14.22436       3.711991 22.18858       5.892232 8.983647       4.779730 39.44637 6.344799 24.25551 7.406677 15.19086       9.752708 
1 1 1 26  15 3  o 35.01167 3.811687 15.96427       3.199675 13.83636       4.154463 19.06688       5.016507 31.42689 5.631573 36.88282 5.770379 -5.455935      8.062994 
1 1 1 26  15 4  o 20.71903 5.717258 6.171573       2.980703 7.317404       3.435155 2.680049       5.996440 22.35087 6.125857 17.87555 7.672332 4.475321       9.817882 
1 1 1 26  15 5  o 20.75476 5.679639 6.231225       2.955553 3.519369       3.356733 15.58568       6.234369 16.53005 6.184882 30.77712 8.175101 -14.24707      10.25110 
1 1 1 26  15 6  o 9.572814 4.423912 -1.446036      2.422164 -2.509191      2.684660 3.206949       5.616382 9.369448 4.433748 17.72633 7.510619 -8.356880      8.721669 
1 1 1 26  15 7  o 10.24803 4.598035 -0.5652053     2.382460 -1.330071      2.612010 3.221564       5.811882 10.05776 4.628576 17.73986 7.582357 -7.682102      8.883460 
1 1 1 26  15 8  o 32.94548 3.839899 14.40246       3.025121 14.65893       3.416071 13.47043       6.512169 32.85680 4.375074 27.26309 8.695222 5.593708       9.733867 
1 1 1 26  15 9  o 20.59774 4.833617 6.035302       2.384226 5.038812       2.585796 11.68964       6.159546 18.54318 5.397317 25.31485 8.480659 -6.771669      10.05249 
1 1 1 26  15 10 o 16.45159 7.299670 1.946202       5.832183 0.000000       0.000000 1.946202       5.832183 ?        ?        16.45159 7.299670 0.000000       7.299670 
1 1 1 26  16 0  o 12.72276 5.208590 1.156130       2.569528 1.847653       3.217416 -0.6163859E-01 4.269590 14.51301 5.870274 14.16449 6.267263 0.3485260      8.587125 
1 1 1 26  16 1  o 13.59066 5.614562 1.318926       3.021124 5.289499       4.383537 -2.273403      4.169520 19.50640 7.108357 12.44033 5.768336 7.066066       9.154367 
1 1 1 26  16 2  o 11.36769 4.888888 0.2679793      2.443987 0.3488402      3.030015 0.1174181      4.134585 12.52211 5.414789 14.01307 6.185304 -1.490961      8.220579 
1 1 1 26  16 3  o 16.05094 5.465301 3.466329       2.558264 5.569636       3.209774 -0.1967277     4.235893 19.60094 6.084785 13.84962 6.178386 5.751323       8.671624 
1 1 1 26  16 4  o 7.736547 3.776985 -3.891891      2.335713 -4.766483      2.572660 0.2106753      5.571954 7.852969 3.860511 15.66678 7.030327 -7.813813      8.020538 
1 1 1 26  16 5  o 10.71173 4.738791 -0.2526459     2.440041 -1.544688      2.695925 5.600720       5.738155 10.09438 4.665751 19.82485 7.901009 -9.730468      9.175794 
1 1 1 26  16 6  o 28.43901 4.480034 11.02412       3.002170 13.83748       3.435708 1.939089       6.174000 31.86179 4.554388 17.12344 7.558285 14.73835       8.824405 
1 1 1 26  16 7  o 19.93816 5.279172 5.750850       2.605038 5.324627       2.849440 7.920585       6.429017 19.01893 5.699990 21.68794 8.448378 -2.669006      10.19142 
1 1 1 26  16 8  o 17.62673 5.914832 4.559777       2.996103 1.582195       3.404104 14.79555       6.311482 14.00758 5.886316 28.78030 8.447828 -14.77272      10.29634 
1 1 1 26  16 9  o 14.51060 6.805728 -1.996296      6.077298 0.000000       0.000000 -1.996296      6.077298 ?        ?        14.51060 6.805728 0.000000       6.805728 
1 1 1 26  17 0  o 10.63401 4.750764 -0.5781133     2.514056 1.283876       3.157543 -3.802759      4.155293 13.71799 5.709892 11.51707 5.469281 2.200916       7.906700 
1 1 1 26  17 1  o 18.95864 5.496866 5.094416       2.686763 7.169051       3.384429 1.558688       4.418288 22.16109 6.083112 15.52973 6.623638 6.631351       8.993155 
1 1 1 26  17 2  o 11.96999 5.002777 0.8204582      2.438526 0.7791214      2.993038 0.9020705      4.205538 12.84768 5.464715 14.65941 6.359006 -1.811733      8.384514 
1 1 1 26  17 3  o 16.29777 5.476201 3.642778       2.568146 3.989895       3.181141 2.993181       4.351780 17.07632 6.076705 16.66387 6.794986 0.4124508      9.115820 
1 1 1 26  17 4  o 15.46251 6.115974 2.698930       3.413553 1.102268       4.096872 6.324184       6.173270 14.58381 6.301281 20.58283 8.197732 -5.999023      10.33968 
1 1 1 26  17 5  o 19.68203 5.477610 5.618514       2.723217 5.713990       3.038147 5.228286       6.142167 19.67968 5.882836 19.51047 8.027321 0.1692085      9.952168 
1 1 1 26  17 6  o 36.52659 3.713893 17.57370       3.259866 16.48929       3.661414 21.72005       7.159565 34.85547 4.409129 35.72161 8.371627 -0.8661423     9.461741 
1 1 1 26  17 7  o 14.77669 5.683712 2.670622       2.882423 4.112203       3.295324 -2.024844      5.947275 17.01764 6.168779 14.46714 6.768301 2.550503       9.157715 
1 1 1 26  17 8  o 14.79890 6.790346 -0.5065877     5.564611 0.000000       0.000000 -0.5065877     5.564611 ?        ?        14.79890 6.790346 0.000000       6.790346 
1 1 1 26  18 0  o 11.01607 5.049140 -1.394207      3.065422 -1.279911      4.004992 -1.555880      4.763266 12.73142 5.811082 13.66292 6.274027 -0.9315033     8.551730 
1 1 1 26  18 1  o 14.07852 5.406955 2.213130       2.605804 1.510998       3.066944 4.035664       4.941226 13.75137 5.666579 18.15031 7.298376 -4.398936      9.239936 
1 1 1 26  18 2  o 16.77215 5.577461 3.912941       2.664995 5.551059       3.175149 0.8013842E-02  4.902279 19.47467 6.052896 14.75541 6.609923 4.719253       8.962625 
1 1 1 26  18 3  o 17.43400 6.113240 4.273727       3.210109 5.377061       4.613030 3.237792       4.469913 19.23816 7.239469 16.90922 6.889767 2.328938       9.993937 
1 1 1 26  18 4  o 21.74232 5.510971 6.869823       2.923253 6.302528       3.102226 11.36517       8.732740 20.62359 5.884118 24.35601 9.733624 -3.732426      11.37393 
1 1 1 26  18 5  o 14.05563 5.331639 2.365912       2.513554 2.254033       2.693425 3.120620       6.995530 14.07444 5.472344 18.27807 8.057622 -4.203626      9.740217 
1 1 1 26  18 6  o 15.17898 7.051942 -1.287279      6.278260 0.000000       0.000000 -1.287279      6.278260 ?        ?        15.17898 7.051942 0.000000       7.051942 
1 1 1 26  19 0  o 11.43556 4.949706 0.2258205      2.536739 2.296403       3.212154 -3.205721      4.135184 14.83685 5.911995 11.70667 5.528615 3.130175       8.094275 
1 1 1 26  19 1  o 29.62448 4.320417 11.80983       3.027200 11.87278       3.854079 11.70844       4.891094 28.75116 5.702280 27.27232 7.239584 1.478842       9.215615 
1 1 1 26  19 2  o 13.16276 5.181177 1.772070       2.439159 5.249511       3.067953 -4.202521      4.021359 18.92722 5.959836 10.94094 5.246085 7.986275       7.939840 
1 1 1 26  19 3  o 13.48295 5.160110 2.068580       2.367699 1.956198       2.902450 2.292131       4.093588 13.94818 5.598815 15.57567 6.493692 -1.627490      8.574076 
1 1 1 26  19 4  o 32.59309 4.077784 14.23149       3.168134 13.82070       3.552216 15.82890       7.004790 31.62143 4.757022 29.37215 8.965901 2.249281       10.14971 
1 1 1 26  20 0  o 18.95159 5.613777 5.199610       2.776541 5.871468       3.478657 4.020278       4.608832 19.83650 6.358134 17.77769 7.082333 2.058809       9.517632 
1 1 1 26  20 1  o 11.41520 4.841195 0.5822284      2.337242 -0.2979822     2.867877 2.323104       4.033212 11.46941 5.102198 15.58538 6.467332 -4.115971      8.237646 
1 1 1 26  20 2  o 12.17428 5.326139 0.2234096      3.004070 2.010490       4.224257 -1.605113      4.272956 15.43007 6.524536 12.74385 5.884550 2.686221       8.786211 
1 1 1 27  0  0  o 60.65480 3.985625 46.36881       5.831931 46.36881       5.831931 46.36881       5.831931 60.65480 3.985625 60.65480 3.985625 0.000000       0.000000 
1 1 1 27  0  1  o 12.93302 7.605372 2.813042       4.061547 2.813042       4.061547 2.813042       4.061547 12.93302 7.605372 12.93302 7.605372 0.000000       0.000000 
1 1 1 27  0  2  o 97.29712 4.181357 119.0301       9.872338 119.0301       9.872338 119.0301       9.872338 97.29712 4.181357 97.29712 4.181357 0.000000       0.000000 
1 1 1 27  0  3  o 28.73330 7.410693 12.52096       4.484205 12.52096       4.484205 12.52096       4.484205 28.73330 7.410693 28.73330 7.410693 0.000000       0.000000 
1 1 1 27  0  4  f 34.64626 6.582018 16.97631       4.974153 16.97631       4.974153 16.97631       4.974153 34.64626 6.582018 34.64626 6.582018 0.000000       0.000000 
1 1 1 27  0  5  o 6.546879 4.697897 -5.453580      3.562979 -5.453580      3.562979 -5.453580      3.562979 6.546879 4.697897 6.546879 4.697897 0.000000       0.000000 
1 1 1 27  0  6  o 66.42196 4.519876 56.59720       7.236984 56.59720       7.236984 56.59720       7.236984 66.42196 4.519876 66.42196 4.519876 0.000000       0.000000 
1 1 1 27  0  7  f 6.652856 4.783375 -5.918254      3.773717 -5.918254      3.773717 -5.918254      3.773717 6.652856 4.783375 6.652856 4.783375 0.000000       0.000000 
1 1 1 27  0  8  o 7.409786 5.235111 -4.054605      3.827331 -4.054605      3.827331 -4.054605      3.827331 7.409786 5.235111 7.409786 5.235111 0.000000       0.000000 
1 1 1 27  0  9  o 14.25933 8.057816 4.175312       4.292664 4.175312       4.292664 4.175312       4.292664 14.25933 8.057816 14.25933 8.057816 0.000000       0.000000 
1 1 1 27  0  10 o 11.36909 7.125194 1.704404       4.087829 1.704404       4.087829 1.704404       4.087829 11.36909 7.125194 11.36909 7.125194 0.000000       0.000000 
1 1 1 27  0  11 o 11.48886 7.222229 1.769090       4.234407 1.769090       4.234407 1.769090       4.234407 11.48886 7.222229 11.48886 7.222229 0.000000       0.000000 
1 1 1 27  0  12 o 9.334039 6.276467 -0.7398508     4.062383 -0.7398508     4.062383 -0.7398508     4.062383 9.334039 6.276467 9.334039 6.276467 0.000000       0.000000 
1 1 1 27  0  13 o 12.01232 7.391791 2.468730       4.203377 2.468730       4.203377 2.468730       4.203377 12.01232 7.391791 12.01232 7.391791 0.000000       0.000000 
1 1 1 27  1  0  o 27.50847 5.253462 10.18423       3.393274 9.638700       3.949039 11.72356       6.633581 26.27628 6.257354 27.75183 8.766950 -1.475548      10.77097 
1 1 1 27  1  1  o 71.30477 3.142232 63.83723       5.446596 71.05471       7.411789 55.36411       8.030681 74.47337 4.099820 64.82556 5.125257 9.647804       6.563291 
1 1 1 27  1  2  o 28.42847 4.734463 10.73992       3.164599 11.76793       4.396340 9.634459       4.558925 28.86904 6.415629 25.75177 7.056722 3.117273       9.537170 
1 1 1 27  1  3  o 39.99477 3.756541 20.52595       3.618371 18.30750       4.932206 23.11143       5.324592 36.58678 5.719090 41.40142 5.406631 -4.814636      7.870175 
1 1 1 27  1  4  o 22.63425 5.654716 7.165297       3.109764 6.374660       4.386185 7.964414       4.409650 21.13318 7.156733 23.27586 7.115449 -2.142677      10.09200 
1 1 1 27  1  5  o 62.03614 3.228439 48.79583       4.863810 49.15407       6.854240 48.43249       6.902950 61.01582 4.644686 60.48859 4.720362 0.5272369      6.622305 
1 1 1 27  1  6  o 8.441364 4.104728 -4.193105      2.683138 -3.847039      3.586127 -4.633200      4.044075 10.50449 5.014337 10.93369 5.247409 -0.4292002     7.258022 
1 1 1 27  1  7  o 20.89555 5.844605 6.291001       3.091982 3.432708       4.203663 9.660280       4.563973 17.16289 6.787467 25.10201 7.128822 -7.939119      9.843262 
1 1 1 27  1  8  o 25.38322 5.335325 9.094263       3.195256 11.90816       4.533480 6.316582       4.504212 28.09018 6.714250 20.49600 7.236867 7.594177       9.871848 
1 1 1 27  1  9  o 13.31594 5.449653 1.503951       2.811729 1.420950       3.776727 1.607160       4.211474 14.46620 6.145327 15.13248 6.460844 -0.6662750     8.916700 
1 1 1 27  1  10 o 13.97710 5.738607 1.774895       3.130479 -0.3233482     4.189478 4.427504       4.710518 13.46778 6.065383 18.08323 7.174328 -4.615459      9.394671 
1 1 1 27  1  11 o 20.82378 6.628245 6.794201       3.785615 4.710105       6.249316 8.002260       4.757926 18.82792 7.947260 21.98441 7.453767 -3.156494      10.89576 
1 1 1 27  1  12 o 18.46666 6.630396 5.224865       3.795936 10.55786       6.406490 2.339684       4.712171 23.69801 8.599678 15.87209 6.806656 7.825921       10.96745 
1 1 1 27  1  13 o 9.792705 4.715773 -3.723167      3.330557 -4.956849      5.318834 -2.927422      4.271712 12.22719 5.905823 11.74590 5.568459 0.4812927      8.117048 
1 1 1 27  2  0  o 28.57167 4.397076 10.68142       2.963491 7.772864       3.983685 14.28550       4.434484 23.45032 6.660380 32.37008 5.836307 -8.919764      8.855683 
1 1 1 27  2  1  o 14.22680 5.543211 1.939324       2.768214 0.3293327      3.807352 3.744905       4.031991 14.03719 6.069842 17.88665 6.759988 -3.849463      9.085176 
1 1 1 27  2  2  o 39.87432 4.410604 20.72958       4.214198 20.03313       4.960751 22.53532       7.987854 38.56813 5.428142 38.21700 8.764140 0.3511238      10.30897 
1 1 1 27  2  3  o 9.843108 4.662731 -3.042462      2.983830 -4.702572      3.464590 1.725180       5.871313 9.911563 4.782194 17.62651 7.579037 -7.714946      8.961650 
1 1 1 27  2  4  o 18.17957 6.317339 4.415883       3.423605 4.783829       4.068214 3.522850       6.337902 18.97623 6.857522 19.26753 8.059910 -0.2913017     10.58243 
1 1 1 27  2  5  o 41.99865 3.816960 22.79838       3.863883 24.11973       5.291599 21.28919       5.655219 42.16760 5.263909 38.87601 6.175707 3.291592       8.114684 
1 1 1 27  2  6  o 17.73809 6.030228 4.309700       3.114311 0.6088513      4.153026 9.064735       4.707506 14.49390 6.302911 24.34901 7.332966 -9.855112      9.669493 
1 1 1 27  2  7  o 20.89042 6.506938 6.435390       3.667201 1.501140       5.720155 9.878636       4.778387 16.83213 7.357058 25.22888 7.335244 -8.396751      10.38904 
1 1 1 27  2  8  o 18.23798 6.388155 4.711627       3.504703 1.895104       5.910931 6.238592       4.352251 17.11703 7.480223 20.37846 7.120156 -3.261425      10.32717 
1 1 1 27  2  9  o 19.15081 6.549274 5.438410       3.674425 15.01175       6.441142 0.8200558      4.473781 29.50154 8.498220 14.76483 6.478486 14.73671       10.68600 
1 1 1 27  2  10 o 14.19169 5.652821 2.141654       2.935622 -1.576391      3.812665 7.555430       4.600675 12.04378 5.560321 21.65618 7.329658 -9.612403      9.200057 
1 1 1 27  2  11 o 10.07725 4.716104 -1.990149      2.891526 -0.5503893     3.774416 -4.035536      4.498758 12.63848 5.718372 11.66032 5.579706 0.9781628      7.989550 
1 1 1 27  2  12 o 15.93214 5.979081 3.465106       3.141977 0.7872030      4.152386 7.051982       4.805720 14.06425 6.203641 20.58888 7.451463 -6.524639      9.695848 
1 1 1 27  2  13 o 18.03144 6.035765 4.958058       3.120071 6.255301       4.150813 3.273005       4.730741 19.62278 6.945457 16.55018 6.945984 3.072607       9.822732 
1 1 1 27  3  0  o 11.81535 5.204612 -0.3920006     2.913396 -1.751207      3.753784 1.667029       4.620168 12.30845 5.621024 16.38697 6.870049 -4.078517      8.876570 
1 1 1 27  3  1  o 33.51288 3.870416 14.45103       3.102850 12.73386       4.351934 16.22647       4.425169 30.29269 6.106463 34.71983 5.406109 -4.427145      8.155667 
1 1 1 27  3  2  o 20.20915 5.764174 5.659042       2.977473 3.034246       3.889680 9.373721       4.627291 16.85254 6.569514 25.32074 7.173783 -8.468193      9.727367 
1 1 1 27  3  3  o 30.41653 4.682055 12.29353       3.359275 10.04213       4.295935 15.83680       5.389318 26.37210 6.678685 33.14497 6.897136 -6.772873      9.600798 
1 1 1 27  3  4  o 14.63097 6.018893 1.613540       3.452518 3.693428       5.526577 0.2822946      4.421455 18.76285 7.654959 14.72994 6.452466 4.032904       10.01163 
1 1 1 27  3  5  o 44.00090 5.472651 26.47584       5.741613 30.79553       8.027472 21.95139       8.215528 45.47636 7.505224 36.42171 9.242557 9.054653       11.90602 
1 1 1 27  3  6  o 14.71768 6.316361 1.022420       4.063473 -0.9872531     5.253164 4.016249       6.411679 14.77188 6.708467 19.34565 8.100618 -4.573771      10.51777 
1 1 1 27  3  7  f 12.10791 5.374041 -0.3106699     3.163488 -2.823901      3.644064 7.377305       6.373466 11.14238 5.239834 21.96483 8.450842 -10.82245      9.943470 
1 1 1 27  3  8  o 12.10228 5.337022 -0.7153593E-01 3.071638 3.634309       3.579268 -10.42771      5.983430 16.80611 6.365202 11.59173 5.733883 5.214379       8.566984 
1 1 1 27  3  9  o 21.54686 6.318196 7.015793       3.531963 8.039292       4.090303 4.015687       7.002934 22.72558 6.833432 19.05359 8.235491 3.671988       10.70136 
1 1 1 27  3  10 o 10.89112 4.958660 -0.9689380     2.892964 -1.237191      3.676480 -0.5327698     4.687994 12.05093 5.525722 13.94698 6.335219 -1.896045      8.406462 
1 1 1 27  3  11 o 12.76702 5.458241 0.8876197      3.013083 -0.1878780     3.820860 2.656378       4.899938 12.96953 5.820705 16.40622 6.985683 -3.436685      9.092875 
1 1 1 27  3  12 o 10.01925 4.672377 -1.738891      2.797293 -0.5135162     3.613744 -3.570729      4.418413 12.34242 5.588796 11.68490 5.574510 0.6575136      7.893656 
1 1 1 27  3  13 o 9.776120 4.598835 -2.076276      2.811067 -2.661111      3.632808 -1.203517      4.437851 10.90081 5.158168 12.94489 5.984333 -2.044084      7.900565 
1 1 1 27  4  0  o 29.17906 4.288622 11.11174       2.958563 5.845690       4.069820 17.01343       4.308449 20.63569 6.893218 35.78988 5.082735 -15.15419      8.564499 
1 1 1 27  4  1  o 24.15779 5.397048 7.985295       3.097034 6.387043       3.863735 10.85775       5.179782 21.31668 6.684936 27.10196 7.558913 -5.785278      10.09086 
1 1 1 27  4  2  o 43.90876 4.353872 25.09042       4.597394 18.57756       7.159290 29.66077       5.997337 34.70262 8.527759 47.06290 5.322606 -12.36028      10.05250 
1 1 1 27  4  3  o 17.67679 6.250887 4.060905       3.361492 1.743647       4.953152 6.039444       4.576851 16.63480 7.050909 20.78715 7.298721 -4.152351      10.14823 
1 1 1 27  4  4  o 12.30291 5.187891 0.6543995      2.658769 0.3752535      3.439023 1.069147       4.191903 13.33943 5.768450 15.05761 6.437793 -1.718185      8.644084 
1 1 1 27  4  5  o 18.65168 5.796031 4.865080       2.911531 6.337435       3.732314 2.576279       4.653458 20.91296 6.571949 16.86413 6.967663 4.048830       9.578039 
1 1 1 27  4  6  o 12.39842 5.272534 0.6160728      2.785224 -5.147365      3.458171 11.25751       4.699004 9.586671 4.661273 27.29381 7.024066 -17.70714      8.430004 
1 1 1 27  4  7  o 13.03410 5.412040 1.160338       2.826872 2.371884       3.617805 -0.7390386     4.529819 15.42489 6.229950 13.87529 6.272548 1.549601       8.840652 
1 1 1 27  4  8  o 11.32556 5.039147 -0.3648099     2.798768 1.039818       3.557706 -2.645533      4.533418 13.87806 5.932095 12.61417 5.903955 1.263893       8.369374 
1 1 1 27  4  9  o 20.58194 5.909856 6.274639       3.119757 4.375795       3.858505 9.859624       5.301735 17.73892 6.632301 24.31570 7.854518 -6.576782      10.28012 
1 1 1 27  4  10 o 13.35967 5.443047 1.632964       2.789542 0.3263860      3.457374 4.070033       4.721856 12.93327 5.684361 17.68098 7.125798 -4.747713      9.115314 
1 1 1 27  4  11 o 13.37148 5.724224 1.076822       3.321863 4.652736       3.767783 -11.40474      7.039256 17.81597 6.574058 12.33873 6.123680 5.477238       8.984303 
1 1 1 27  4  12 o 16.40967 6.330064 3.682999       3.582606 5.577381       4.078838 -2.712436      7.494417 18.87580 6.860087 15.39843 7.321827 3.477370       10.03344 
1 1 1 27  5  0  o 38.25732 4.141487 18.91106       3.799569 16.51271       4.821092 22.84288       6.172846 34.73791 5.906381 40.56649 6.460773 -5.828579      8.753680 
1 1 1 27  5  1  o 15.48276 5.963064 2.521703       3.175638 2.615404       5.655265 2.478549       3.837852 18.19190 7.611976 16.18313 6.457636 2.008772       9.982146 
1 1 1 27  5  2  o 18.67824 5.865968 4.776891       2.973971 4.074210       3.674822 6.110606       5.062776 17.92533 6.511940 21.07821 7.645403 -3.152872      10.04279 
1 1 1 27  5  3  o 24.60272 5.460085 8.379018       3.188037 4.106244       3.958514 16.26581       5.378083 18.07661 6.725760 33.58176 6.805233 -15.50515      9.568022 
1 1 1 27  5  4  o 15.49820 5.752026 2.854546       2.891885 1.544047       3.543627 5.467548       5.003795 14.63999 6.067420 20.10241 7.545137 -5.462420      9.682080 
1 1 1 27  5  5  o 18.78656 5.830899 4.959879       2.947661 8.673554       3.779188 -0.8087257     4.710120 24.41961 6.306823 14.21305 6.413411 10.20656       8.994879 
1 1 1 27  5  6  o 20.33972 5.933167 5.955822       3.121695 8.780686       4.029254 1.714120       4.937373 24.26928 6.627518 16.26195 6.970504 8.007324       9.618312 
1 1 1 27  5  7  o 20.23201 5.818243 5.924744       3.021590 3.328164       3.766120 10.61577       5.062058 16.62479 6.468981 25.85996 7.558711 -9.235172      9.948961 
1 1 1 27  5  8  o 20.49443 5.788423 6.141098       3.017434 5.425766       3.671361 7.630139       5.296957 19.18855 6.546920 21.84926 7.833886 -2.660715      10.20940 
1 1 1 27  5  9  o 30.30779 4.705030 12.63505       3.362357 12.15138       4.220386 13.47550       5.563293 28.51578 6.246564 28.55426 7.783495 -0.3847885E-01 9.980099 
1 1 1 27  5  10 o 16.50675 6.103167 3.729504       3.250176 3.390913       4.534186 4.087351       4.661336 16.88496 6.916514 17.63931 7.090134 -0.7543411     9.904957 
1 1 1 27  5  11 o 12.56227 5.507457 0.3855353      3.227124 3.125507       4.444407 -2.670117      4.693457 16.43200 6.801146 12.57809 5.924799 3.853909       9.019913 
1 1 1 27  5  12 o 17.59069 5.959734 4.632023       3.041685 7.324389       3.734535 -0.6735989     5.242489 21.41716 6.548323 14.24948 6.557514 7.167685       9.267228 
1 1 1 27  6  0  o 22.83620 6.304885 7.355384       3.623815 7.117694       5.370931 7.554008       4.909761 22.43630 7.904217 22.90495 7.568783 -0.4686489     10.94363 
1 1 1 27  6  1  o 15.00011 5.813092 2.297637       3.031625 3.098440       3.648007 0.5100219      5.450421 16.68419 6.400084 16.33636 7.159886 0.3478241      9.603388 
1 1 1 27  6  2  o 30.51735 4.156077 12.17198       3.010531 9.045435       4.069657 15.95081       4.474089 25.04817 6.582466 34.16756 5.564802 -9.119396      8.619506 
1 1 1 27  6  3  o 30.07012 5.158373 12.28817       3.643902 14.31287       4.251056 6.679700       7.075207 32.20793 5.620578 22.14284 8.790121 10.06508       10.43346 
1 1 1 27  6  4  o 9.587101 4.480392 -2.069690      2.594510 -3.842782      3.225736 1.179057       4.366375 9.822572 4.706839 15.32093 6.560848 -5.498354      8.074594 
1 1 1 27  6  5  o 25.00798 5.363113 8.733186       3.170314 7.082224       3.905563 11.92272       5.428485 21.89135 6.697221 27.58738 7.754205 -5.696037      10.24600 
1 1 1 27  6  6  o 21.82968 5.731868 6.843886       3.087515 5.821691       3.791882 8.854841       5.318501 19.97190 6.653280 23.63547 7.879722 -3.663568      10.31291 
1 1 1 27  6  7  f 21.21049 6.451349 6.726693       3.630999 8.165393       5.036882 5.170152       5.239102 22.67449 7.669293 19.38119 7.604111 3.293293       10.80003 
1 1 1 27  6  8  o 25.37466 6.206899 9.605609       3.805866 10.23355       5.323490 8.949125       5.443120 24.86378 7.853551 23.25272 7.970628 1.611063       11.18969 
1 1 1 27  6  9  o 9.672457 4.561699 -2.365187      2.797671 -4.964616      3.476410 2.412507       4.713040 9.579785 4.661470 16.22239 6.877069 -6.642604      8.308032 
1 1 1 27  6  10 o 21.52163 5.842869 6.932934       3.142420 6.139826       3.835926 8.551232       5.479403 19.89670 6.692802 22.37659 7.973916 -2.479885      10.41042 
1 1 1 27  6  11 o 15.20053 5.704969 3.035957       2.860611 2.511335       3.412600 4.275738       5.246072 14.96099 6.047783 17.89245 7.395809 -2.931463      9.553725 
1 1 1 27  6  12 o 18.33237 5.905881 5.098497       2.998729 4.918356       3.572671 5.527995       5.516545 17.97806 6.435133 18.93230 7.676189 -0.9542465     10.01673 
1 1 1 27  7  0  o 27.47611 4.525447 9.984144       2.924672 7.938628       3.909004 12.58527       4.408036 23.58089 6.562717 29.96816 6.239095 -6.387276      9.055140 
1 1 1 27  7  1  f 27.88684 4.573767 10.32235       3.000545 11.00185       4.001710 9.449678       4.534966 28.02136 6.038546 25.39564 7.069002 2.625719       9.297033 
1 1 1 27  7  2  o 17.30421 6.190937 3.847983       3.306249 3.352788       3.603573 6.482807       8.312295 16.86149 6.386640 22.55142 9.314414 -5.689930      11.29369 
1 1 1 27  7  3  o 13.10298 5.521869 0.8422170      3.009142 0.9771472      3.384178 0.3326567      6.576523 13.82957 5.843416 17.20646 7.685616 -3.376887      9.654750 
1 1 1 27  7  4  o 13.83430 5.621362 1.575758       2.965878 3.111415       3.490117 -2.415489      5.626614 16.32730 6.260844 14.47784 6.708848 1.849463       9.176427 
1 1 1 27  7  5  o 30.25975 6.050273 13.10829       4.305425 9.796806       5.289469 19.60958       7.411409 24.90424 7.823327 34.44260 8.799202 -9.538363      11.77414 
1 1 1 27  7  6  o 25.53737 6.520142 9.734392       4.071115 8.858850       5.015477 11.42547       6.970366 23.66549 7.639104 25.71043 9.008763 -2.044941      11.81159 
1 1 1 27  7  7  o 13.27061 5.588610 1.098257       3.078889 2.165705       3.503876 -2.518768      6.449871 14.97618 6.100797 15.07504 7.051332 -0.9885788E-01 9.324216 
1 1 1 27  7  8  o 37.28356 4.201065 18.58365       3.750547 17.14691       4.551944 21.62111       6.618561 34.69593 5.572328 36.85208 7.621696 -2.156147      9.441456 
1 1 1 27  7  9  o 9.027972 4.327123 -3.136508      2.729912 -1.235851      3.344227 -6.932501      4.726140 11.50411 5.273175 10.84585 5.311418 0.6582584      7.484487 
1 1 1 27  7  10 o 16.58514 5.862143 3.897719       2.956112 5.802435       3.596670 -0.6768335E-01 5.189545 19.42749 6.479945 14.71966 6.678020 4.707824       9.305140 
1 1 1 27  7  11 o 17.89793 5.931263 4.792922       3.014469 4.898446       3.551862 4.521179       5.699803 18.02680 6.420386 18.25064 7.639593 -0.2238369     9.979216 
1 1 1 27  8  0  o 24.02042 5.674506 8.017238       3.268378 7.760622       3.955770 8.569261       5.801863 23.24025 6.648930 23.97159 8.228709 -0.7313442     10.57922 
1 1 1 27  8  1  o 25.69674 4.821685 8.896543       2.908473 10.43841       3.928185 7.025616       4.327093 27.19120 6.080921 22.01520 7.094561 5.175995       9.344004 
1 1 1 27  8  2  o 15.45615 5.563368 2.942945       2.674392 4.969912       3.468220 -0.3021097E-01 4.200414 18.96490 6.363811 14.15400 6.241479 4.810900       8.913706 
1 1 1 27  8  3  o 35.16150 4.631402 16.47886       3.872006 19.16639       4.355005 6.338882       8.459230 37.81320 4.836761 22.20217 9.301201 15.61103       10.48363 
1 1 1 27  8  4  o 14.83058 6.005759 1.998956       3.372114 5.688716       4.709008 -1.884642      4.831116 20.06184 7.358521 13.66858 6.291926 6.393262       9.681744 
1 1 1 27  8  5  o 18.42025 6.139932 4.792288       3.229224 3.022239       3.620094 11.68678       7.144607 16.21236 6.332635 26.04200 9.120981 -9.829645      11.10381 
1 1 1 27  8  6  o 12.73346 5.328090 1.006683       2.770831 2.497420       3.412695 -1.876966      4.746442 15.30542 6.095383 13.40205 6.193279 1.903372       8.689672 
1 1 1 27  8  7  f 12.04857 5.145685 0.5882643      2.672832 0.7648848      3.164958 0.1490674      4.990880 13.02471 5.581831 14.91095 6.675255 -1.886241      8.701486 
1 1 1 27  8  8  o 10.41197 4.742660 -0.9997725     2.650217 -2.006781      3.035151 2.232079       5.437375 10.40921 4.858451 16.72003 7.241802 -6.310818      8.720565 
1 1 1 27  8  9  f 21.42017 5.658889 6.776684       2.997539 4.356677       3.452202 14.19173       6.042893 17.45407 6.315730 28.60481 8.228658 -11.15074      10.37301 
1 1 1 27  8  10 f 9.609006 4.491007 -1.807238      2.607722 -1.185916      2.959103 -3.967233      5.517321 10.78352 4.949322 13.02405 6.217764 -2.240534      7.947098 
1 1 1 27  8  11 o 12.16907 5.186851 0.8215771      2.706218 2.649951       3.160330 -4.204679      5.239890 14.86948 5.883701 12.50511 5.994050 2.364366       8.399200 
1 1 1 27  9  0  o 33.36875 4.056818 14.48717       3.231143 12.74729       4.255087 16.85688       4.965867 30.19005 5.995208 34.76334 6.083358 -4.573292      8.541063 
1 1 1 27  9  1  o 25.37781 5.074818 8.789592       3.028677 5.902735       3.950372 12.90628       4.717364 20.39991 6.790773 29.86767 6.651984 -9.467754      9.505971 
1 1 1 27  9  2  o 16.88140 6.262915 3.542022       3.427782 5.071198       4.995797 2.181713       4.711884 19.63902 7.500554 16.60130 6.947400 3.037722       10.22373 
1 1 1 27  9  3  o 27.04711 7.156792 11.06485       4.789601 16.32326       5.696400 -1.621360      8.847885 32.92278 7.292452 18.08971 8.393023 14.83307       11.11857 
1 1 1 27  9  4  o 17.11676 6.249118 3.835520       3.390125 4.179874       3.725448 2.176835       8.176316 17.76034 6.539896 19.24298 8.584152 -1.482645      10.79157 
1 1 1 27  9  5  o 24.12102 5.462852 8.260526       3.136265 7.704340       3.804803 9.439468       5.539479 22.67667 6.531264 24.12469 8.041728 -1.448025      10.35987 
1 1 1 27  9  6  o 24.12542 5.855363 8.488880       3.407184 5.269447       3.719704 25.26894       8.492105 19.01266 6.586062 38.06284 9.247823 -19.05018      11.35334 
1 1 1 27  9  7  o 22.97791 5.662006 7.691816       3.149584 5.950506       3.694543 12.32309       6.025220 19.87905 6.565492 26.77493 8.340684 -6.895889      10.61474 
1 1 1 27  9  8  o 24.50792 5.218600 8.570218       3.021093 9.137286       3.601865 7.224648       5.548335 24.73938 6.030186 21.12263 7.941477 3.616756       9.971469 
1 1 1 27  9  9  o 13.29138 5.350543 1.737006       2.658887 1.766640       3.076001 1.649425       5.288064 13.83629 5.685454 15.98900 7.028622 -2.152711      9.040239 
1 1 1 27  9  10 o 14.01332 5.510244 2.241322       2.756323 2.662197       3.107733 0.6896486      5.967154 14.88673 5.851789 15.83036 7.173552 -0.9436312     9.257607 
1 1 1 27  10 0  o 47.49837 3.282427 28.64701       3.775989 31.47947       5.205815 25.50232       5.485245 49.03125 4.403782 43.44289 5.290283 5.588356       6.883342 
1 1 1 27  10 1  o 27.34156 5.747653 10.49040       3.707802 6.919331       5.785721 12.97912       4.829987 21.85054 8.130944 29.75235 6.809328 -7.901804      10.60562 
1 1 1 27  10 2  o 30.75597 4.550517 12.64122       3.307768 12.58388       4.448954 12.71210       4.946246 29.50358 6.374404 29.15788 7.041344 0.3457012      9.498082 
1 1 1 27  10 3  o 22.19382 5.998334 7.120050       3.320744 7.149349       4.072463 7.061915       5.736516 21.89276 6.862774 21.71833 8.093464 0.1744213      10.61140 
1 1 1 27  10 4  o 41.14014 3.941160 22.16027       3.902914 23.20334       4.856229 20.25748       6.559020 41.33773 4.917011 36.05533 7.699234 5.282398       9.135383 
1 1 1 27  10 5  o 22.34900 6.275701 7.436275       3.557542 11.80655       3.921479 -12.88445      8.455998 28.64930 5.815824 13.76485 6.810195 14.88445       8.955589 
1 1 1 27  10 6  o 19.61530 5.790777 5.616056       2.958476 6.009481       3.517343 4.664587       5.469923 20.05479 6.389705 18.86757 7.645965 1.187216       9.964392 
1 1 1 27  10 7  o 17.33243 5.979136 4.272244       3.064455 4.050001       3.427962 5.156576       6.838009 17.12532 6.278835 19.69804 8.313778 -2.572721      10.41838 
1 1 1 27  10 8  o 12.89850 5.325686 1.340335       2.716221 -0.7320864     3.097881 8.230810       5.648723 11.45110 5.180918 22.06082 8.064576 -10.60972      9.585369 
1 1 1 27  10 9  o 12.96400 5.787445 -0.1107934E-01 3.723763 -0.5620753E-01 4.927378 0.4901739E-01  5.686137 14.42668 6.529940 15.26941 6.951992 -0.8427362     9.537835 
1 1 1 27  10 10 o 9.894493 4.544236 -1.134339      2.500089 0.3250791      2.848981 -6.022232      5.213875 11.89263 5.195229 11.75960 5.719101 0.1330347      7.726482 
1 1 1 27  11 0  o 16.78636 6.090486 3.580836       3.213176 2.550097       4.852064 4.385938       4.288228 17.07571 7.090322 18.50464 6.976362 -1.428932      9.946974 
1 1 1 27  11 1  o 25.08019 5.077268 8.650822       2.996518 9.294050       3.916691 7.742896       4.653307 25.26847 6.364919 22.66928 7.361422 2.599194       9.731533 
1 1 1 27  11 2  o 34.00721 4.579501 15.47992       3.698747 20.17047       4.592913 6.824792       6.238970 38.56049 5.005785 21.60018 8.347797 16.96031       9.733633 
1 1 1 27  11 3  o 42.03508 4.866035 23.91575       4.892567 24.47601       7.219143 23.43983       6.653666 39.74160 7.732637 39.45327 7.185205 0.2883301      10.55561 
1 1 1 27  11 4  o 31.24638 4.868369 13.36771       3.586227 9.899405       4.283470 21.49699       6.557868 25.50581 6.776982 37.26313 7.481997 -11.75732      10.09494 
1 1 1 27  11 5  o 8.500423 4.121336 -3.838006      2.652811 -3.741572      3.089409 -4.108704      5.176081 9.488623 4.562304 12.77658 6.077920 -3.287952      7.599719 
1 1 1 27  11 6  o 17.34299 6.187871 4.215641       3.300686 4.980232       3.579951 -0.1193840     8.524298 18.48727 6.457721 17.79718 8.250667 0.6900902      10.47739 
1 1 1 27  11 7  o 13.35768 5.864821 0.4346589      3.671706 -0.8464988E-01 5.126718 0.9815364      5.261040 14.76883 6.675088 15.61498 6.930499 -0.8461533     9.622298 
1 1 1 27  11 8  o 10.72821 4.873663 -0.8585356     2.775361 -0.2966710     3.062650 -3.438932      6.563337 11.73317 5.242557 14.47412 6.873590 -2.740951      8.644688 
1 1 1 27  11 9  o 14.93998 5.641464 2.865493       2.806701 0.3152632      3.206228 11.22805       5.805964 12.46792 5.477114 25.01555 8.229017 -12.54763      9.885116 
1 1 1 27  12 0  o 21.42014 5.908216 6.564726       3.183898 7.268404       3.843162 5.024943       5.685012 22.23671 6.609065 19.84210 7.878530 2.394609       10.28353 
1 1 1 27  12 1  o 21.78532 7.001527 7.099417       4.216286 15.71238       5.807677 -2.498922      6.130900 31.90180 7.582662 14.97196 6.960166 16.92984       10.29275 
1 1 1 27  12 2  o 19.74773 6.310312 5.663154       3.428498 4.780503       3.736270 10.36822       8.626342 18.50541 6.585569 24.54145 9.717568 -6.036039      11.73886 
1 1 1 27  12 3  o 21.16231 6.525937 6.687734       3.699193 7.690446       4.087180 2.145833       8.698700 22.46907 6.846725 19.30126 8.711942 3.167814       11.08041 
1 1 1 27  12 4  o 18.76744 6.356420 5.109272       3.460058 6.909415       3.801361 -3.586563      8.354902 21.36600 6.620028 16.43880 7.791603 4.927198       10.22418 
1 1 1 27  12 5  o 12.35760 5.389965 0.2765786      3.056298 1.387910       3.271821 -7.334887      8.562524 13.80456 5.783944 15.24863 7.395762 -1.444072      9.388893 
1 1 1 27  12 6  o 12.62682 5.844940 -1.755465      4.254032 -2.335142      4.888633 0.5260123E-01  8.633785 13.17596 6.155135 17.83901 8.281571 -4.663050      10.31844 
1 1 1 27  12 7  o 11.66348 5.174055 -0.1382996     2.928574 1.589038       3.103222 -14.20132      8.854492 13.69443 5.676922 13.55976 6.752574 0.1346645      8.821832 
1 1 1 27  12 8  o 15.11963 5.754574 2.905966       2.934195 2.370023       3.085913 7.957884       9.474419 14.54575 5.795101 21.58096 9.449683 -7.035211      11.08511 
1 1 1 27  13 0  o 23.39516 5.392729 7.702147       3.011451 7.260620       3.908070 8.347541       4.724941 22.09069 6.687569 23.28477 7.404308 -1.194082      9.977342 
1 1 1 27  13 1  o 14.64437 5.817613 2.175817       3.101255 3.278558       3.773577 -0.1187937     5.443408 16.62454 6.473544 15.43869 6.936682 1.185847       9.488114 
1 1 1 27  13 2  o 11.72388 5.120470 0.7069334E-01  2.766361 -1.626287      3.568810 2.625267       4.378691 11.75459 5.409764 16.39354 6.764620 -4.638952      8.661734 
1 1 1 27  13 3  o 17.86896 6.077509 4.525761       3.163384 1.029938       3.706553 13.90063       6.069853 14.08020 6.037493 28.87601 8.228036 -14.79581      10.20548 
1 1 1 27  13 4  o 18.97543 6.042103 5.268681       3.145455 3.170335       3.669979 11.07612       6.105447 16.23492 6.365918 25.36877 8.442196 -9.133842      10.57334 
1 1 1 27  13 5  o 17.25802 6.631267 3.968235       3.920797 5.942263       5.291326 1.564681       5.838682 19.88270 7.686733 16.59654 7.336838 3.286154       10.62615 
1 1 1 27  13 6  o 10.29911 4.720521 -1.174108      2.679374 -0.9417345     3.105798 -1.850338      5.298186 11.30333 5.143024 13.90241 6.465426 -2.599080      8.261503 
1 1 1 27  13 7  o 23.33887 5.305618 7.884283       2.948944 6.781524       3.390434 11.31075       5.976379 21.05798 6.194503 25.15318 8.351959 -4.095203      10.39842 
1 1 1 27  14 0  o 16.01366 5.902508 3.250235       3.035908 1.188531       3.640290 7.959609       5.501795 14.22921 6.038525 22.50602 7.993295 -8.276804      10.01781 
1 1 1 27  14 1  o 20.29498 5.684069 5.937056       2.922419 7.483200       3.887103 3.926882       4.432184 22.27041 6.653461 17.74685 6.984629 4.523561       9.646428 
1 1 1 27  14 2  f 13.76795 5.536839 1.788249       2.844199 2.664754       3.648262 0.4300140      4.541468 15.69767 6.285269 14.64127 6.471655 1.056399       9.021471 
1 1 1 27  14 3  o 14.25342 5.569169 2.227143       2.800530 4.007922       3.620642 -0.4250350     4.418572 17.24462 6.429181 13.81206 6.223969 3.432555       8.948305 
1 1 1 27  14 4  o 10.10236 4.843424 -3.754678      3.425511 -4.608376      4.438167 -2.496718      5.387473 11.40303 5.479029 13.75429 6.437101 -2.351262      8.453167 
1 1 1 27  14 5  o 15.10483 5.716706 2.855664       2.885865 0.4907456      3.297022 10.60330       5.967584 12.86712 5.605423 24.58957 8.347575 -11.72245      10.05499 
1 1 1 27  14 6  o 9.621724 4.483778 -1.716618      2.568650 -1.792282      2.897993 -1.439330      5.547762 10.24763 4.771126 14.36869 6.659450 -4.121058      8.192186 
1 1 1 27  15 0  o 8.438962 4.089895 -3.788340      2.605715 -4.557838      3.391508 -2.679670      4.070899 9.690286 4.689080 11.92107 5.584435 -2.230788      7.292008 
1 1 1 27  15 1  o 8.112368 3.957646 -4.143034      2.551476 -4.666203      3.175669 -3.190306      4.285469 9.194792 4.469839 11.94839 5.638346 -2.753602      7.195165 
1 1 1 27  15 2  o 17.44002 5.764291 4.317219       2.847685 3.495466       3.682217 5.540074       4.491862 16.63349 6.417181 19.41087 7.175254 -2.777376      9.626239 
1 1 1 27  15 3  o 19.00921 6.462712 5.361302       3.577049 7.452334       5.673837 3.981957       4.608217 21.47319 8.039671 17.67240 7.068004 3.800793       10.70481 
1 1 1 27  15 4  o 21.64715 5.906486 6.980594       3.201795 7.100313       3.719925 6.638380       6.289287 21.46866 6.529871 20.62538 8.254416 0.8432846      10.52495 
1 1 1 27  16 0  o 12.78651 5.416822 0.8732103      2.920699 3.798007       3.618442 -4.595097      4.947664 17.01116 6.409488 12.23899 5.855225 4.772171       8.681314 
1 1 1 27  16 1  o 28.01267 4.805779 10.82623       3.162542 10.98994       3.901922 10.51275       5.399351 27.35623 6.017008 25.17181 7.903718 2.184425       9.933435 
1 1 1 27  16 2  o 16.99940 6.174720 3.982037       3.303921 -0.1388771E-02 5.066613 6.929080       4.357954 14.82830 6.674830 21.04887 7.133620 -6.220572      9.769437 
1 1 1 27  16 3  o 20.18896 5.633475 5.978723       2.876312 10.16011       3.735529 -0.1105636     4.507910 26.18255 5.985501 14.04808 6.312150 12.13447       8.698820 
1 1 1 27  17 0  o 15.33991 5.702301 2.980654       2.844206 3.912208       3.677484 1.593962       4.486800 17.12852 6.459847 15.42302 6.628427 1.705502       9.255575 
1 1 1 27  17 1  o 19.82610 6.329886 5.890792       3.450380 7.933435       5.151619 4.229058       4.646525 22.09381 7.744540 17.95444 7.124723 4.139362       10.52329 
1 1 1 28  0  0  o 15.30964 7.910922 4.716360       3.793808 4.716360       3.793808 4.716360       3.793808 15.30964 7.910922 15.30964 7.910922 0.000000       0.000000 
1 1 1 28  0  1  o 18.18196 9.540313 7.081756       5.578275 7.081756       5.578275 7.081756       5.578275 18.18196 9.540313 18.18196 9.540313 0.000000       0.000000 
1 1 1 28  0  2  o 16.46706 9.265230 5.732013       5.643739 5.732013       5.643739 5.732013       5.643739 16.46706 9.265230 16.46706 9.265230 0.000000       0.000000 
1 1 1 28  0  3  o 18.79997 8.735589 7.165617       4.436505 7.165617       4.436505 7.165617       4.436505 18.79997 8.735589 18.79997 8.735589 0.000000       0.000000 
1 1 1 28  0  4  o 13.77431 7.883347 3.748291       4.181326 3.748291       4.181326 3.748291       4.181326 13.77431 7.883347 13.77431 7.883347 0.000000       0.000000 
1 1 1 28  0  5  o 29.39782 7.914456 13.74049       4.899305 13.74049       4.899305 13.74049       4.899305 29.39782 7.914456 29.39782 7.914456 0.000000       0.000000 
1 1 1 28  0  6  f 19.11681 8.797147 7.521183       4.493424 7.521183       4.493424 7.521183       4.493424 19.11681 8.797147 19.11681 8.797147 0.000000       0.000000 
1 1 1 28  0  7  o 7.140191 5.084552 -4.742547      3.867679 -4.742547      3.867679 -4.742547      3.867679 7.140191 5.084552 7.140191 5.084552 0.000000       0.000000 
1 1 1 28  0  8  o 32.14688 8.005483 16.36735       5.426375 16.36735       5.426375 16.36735       5.426375 32.14688 8.005483 32.14688 8.005483 0.000000       0.000000 
1 1 1 28  1  0  o 35.89950 4.128991 16.87612       3.546473 21.34167       5.593206 13.87367       4.586288 38.96111 6.090315 31.16431 6.256635 7.796791       8.731404 
1 1 1 28  1  1  o 42.12455 3.736835 22.95249       3.796212 24.70778       5.262557 21.04815       5.481439 42.63726 5.170431 38.64063 6.017064 3.996635       7.933373 
1 1 1 28  1  2  o 15.98208 5.872402 3.215319       3.001125 2.704377       4.125169 3.789822       4.374237 16.34909 6.634593 17.69613 6.946625 -1.347038      9.605906 
1 1 1 28  1  3  o 18.81061 6.376627 5.060666       3.482144 5.005399       4.248236 5.173823       6.078754 18.92566 6.981144 19.86419 8.056454 -0.9385262     10.66034 
1 1 1 28  1  4  o 11.15329 5.144363 -1.647043      3.252538 2.555328       4.081209 -8.962326      5.384646 16.01004 6.560463 11.23419 5.534860 4.775847       8.583376 
1 1 1 28  1  5  o 27.24812 6.021850 10.88572       3.891968 7.381745       4.685134 18.68751       6.990995 21.66954 7.395737 33.16665 8.584011 -11.49711      11.33059 
1 1 1 28  1  6  f 23.06333 5.812847 7.828432       3.265357 11.29506       4.685146 4.553899       4.553491 26.76868 7.076078 18.23827 7.108500 8.530411       10.03004 
1 1 1 28  1  7  o 21.01744 5.981121 6.626700       3.209420 8.839648       4.469589 4.271162       4.611340 23.41223 7.164894 17.84654 7.092590 5.565691       10.08169 
1 1 1 28  1  8  o 11.87897 5.215565 0.1593281      2.903744 -0.1041492     3.925053 0.4778643      4.315720 13.19602 5.912709 14.13505 6.275161 -0.9390326     8.621936 
1 1 1 28  2  0  o 45.78319 3.563842 26.89795       3.944832 21.90476       5.305941 33.06908       5.898688 39.84565 5.620358 49.68748 4.936840 -9.841824      7.480696 
1 1 1 28  2  1  o 25.92310 5.213418 9.303933       3.179149 8.677994       4.311920 10.04947       4.705857 24.02175 6.963269 25.68126 7.220107 -1.659506      10.03081 
1 1 1 28  2  2  o 12.39740 5.305929 0.5262224      2.852843 1.199382       3.880612 -0.2654409     4.208345 14.59066 6.214828 13.81286 6.160371 0.7777977      8.750672 
1 1 1 28  2  3  o 12.65218 5.327650 0.8750303      2.797630 -0.5554469E-01 3.727558 2.075329       4.233440 13.22268 5.852984 15.75580 6.588816 -2.533124      8.813053 
1 1 1 28  2  4  o 48.72268 3.537675 30.70934       4.171734 28.13811       5.599709 33.91632       6.253780 45.17925 5.179716 49.54670 5.259811 -4.367447      7.382077 
1 1 1 28  2  5  o 20.05331 6.001574 5.925626       3.160613 5.210553       4.162473 6.899251       4.857045 18.95796 6.923980 21.04574 7.506584 -2.087784      10.21226 
1 1 1 28  2  6  o 16.17550 6.152487 3.358897       3.352666 3.222044       3.964343 3.702596       6.282518 16.44656 6.563045 18.40223 7.874859 -1.955669      10.25119 
1 1 1 28  2  7  o 12.03871 5.427840 -0.5763966     3.365766 0.8100169      4.040579 -3.718883      6.083225 14.12998 6.179493 13.91039 6.609199 0.2195902      9.048074 
1 1 1 28  2  8  o 17.22339 6.306561 4.229568       3.456553 3.637864       4.096294 5.692673       6.441350 16.80515 6.682806 19.64818 8.164883 -2.843029      10.55108 
1 1 1 28  3  0  f 40.08191 3.734100 20.76215       3.605332 17.01121       5.012300 24.78338       5.189749 34.62030 6.167293 42.84097 5.069177 -8.220665      7.983236 
1 1 1 28  3  1  o 17.80831 5.762900 4.403875       2.853249 3.951633       3.992665 4.875870       4.078926 17.67703 6.716328 18.85366 6.858963 -1.176630      9.599710 
1 1 1 28  3  2  o 9.165330 4.387263 -3.275809      2.786402 -1.644193      3.710849 -5.384893      4.219017 12.03118 5.529498 10.83646 5.240378 1.194715       7.618196 
1 1 1 28  3  3  o 16.50608 5.895582 3.621741       2.997030 4.886446       3.938740 1.882498       4.618943 18.65215 6.746551 15.96959 6.790481 2.682564       9.572177 
1 1 1 28  3  4  o 11.08400 4.955822 -0.5192003     2.741681 0.9425825      3.538030 -2.716419      4.337673 13.77740 5.902969 12.29699 5.761810 1.480412       8.248849 
1 1 1 28  3  5  o 23.84908 5.588225 8.216783       3.190632 6.046584       4.168965 11.28518       4.957179 20.00756 6.970058 26.57882 7.387908 -6.571264      10.15691 
1 1 1 28  3  6  o 16.79396 5.860258 3.944428       2.947734 1.538763       3.753193 7.817306       4.762118 14.50157 6.141797 22.02186 7.457128 -7.520284      9.660768 
1 1 1 28  3  7  o 8.042336 3.956380 -4.948024      2.717478 -4.111249      3.575777 -6.092026      4.180995 10.15367 4.888762 10.30429 5.035464 -0.1506176     7.018254 
1 1 1 28  3  8  f 10.58328 4.982477 -2.435887      3.311244 -5.861090      5.111930 0.4013611E-01  4.346295 11.75071 5.702789 13.83995 6.209957 -2.089235      8.431213 
1 1 1 28  4  0  o 11.89368 5.179837 0.6192657E-01  2.813637 -1.249333      3.902455 1.481483       4.060411 12.69619 5.772186 15.16529 6.403870 -2.469095      8.621350 
1 1 1 28  4  1  o 20.09399 5.649729 5.744345       2.881303 7.525386       4.069510 3.954051       4.080068 22.42998 6.831329 17.71133 6.774899 4.718653       9.621139 
1 1 1 28  4  2  o 24.08180 5.509524 8.225541       3.162989 11.64232       4.146983 3.473235       4.890754 28.29576 6.187002 17.69598 7.208130 10.59978       9.499270 
1 1 1 28  4  3  o 17.55836 5.783536 4.326428       2.867560 5.730440       3.750856 2.351572       4.448490 19.75013 6.617924 16.19982 6.762794 3.550310       9.462151 
1 1 1 28  4  4  o 42.72995 3.846546 23.92597       3.962512 21.31977       5.148420 27.71330       6.206371 38.87168 5.596099 44.01810 5.937135 -5.146423      8.158792 
1 1 1 28  4  5  o 13.09899 5.777199 0.1587602      3.600137 7.183665       5.727046 -4.430884      4.629136 21.29590 8.054766 11.80799 5.652954 9.487906       9.840485 
1 1 1 28  4  6  o 17.19441 6.596589 3.956728       3.875771 14.13051       6.511870 -1.624371      4.823080 28.19908 8.651740 13.48721 6.236319 14.71187       10.66510 
1 1 1 28  4  7  o 12.60300 5.361794 0.8741120      2.882431 2.616328       3.694631 -1.835611      4.607682 15.45905 6.276840 13.01554 6.044944 2.443513       8.714360 
1 1 1 28  5  0  o 27.14077 5.410017 10.26486       3.452503 10.60597       4.326704 9.666980       5.728197 26.77762 6.658613 24.64692 8.176473 2.130701       10.54475 
1 1 1 28  5  1  o 15.66199 5.944828 2.914452       3.126191 2.588986       3.865530 3.529782       5.315092 15.97354 6.443923 18.11538 7.461778 -2.141844      9.859121 
1 1 1 28  5  2  o 17.18484 6.272120 3.922976       3.414757 2.006931       3.873755 10.60144       7.232151 15.31833 6.345716 24.86352 9.119339 -9.545197      11.10993 
1 1 1 28  5  3  o 22.79581 7.306875 8.116681       4.594237 9.482203       6.137118 6.375922       6.929222 23.87433 8.445791 21.04453 8.576907 2.829796       12.03722 
1 1 1 28  5  4  o 45.70078 4.567406 28.13446       5.018552 28.14592       8.139968 28.12743       6.374142 41.50720 8.337296 44.15378 6.085722 -2.646580      10.32214 
1 1 1 28  5  5  o 19.16247 5.950578 5.393897       3.069469 3.218245       3.897183 8.948666       4.981519 16.42632 6.522837 23.42904 7.617238 -7.002716      10.02845 
1 1 1 28  5  6  f 12.32406 5.303248 0.5861252      2.878984 -2.485206      3.654660 5.609198       4.673781 11.21533 5.265734 19.34370 7.285296 -8.128375      8.989077 
1 1 1 28  5  7  o 15.03411 5.766726 2.792279       2.961578 5.322056       3.909234 -0.6154912     4.537176 18.80294 6.731302 13.66712 6.217636 5.135818       9.163483 
1 1 1 28  6  0  o 16.75135 5.931712 3.710171       3.027828 1.505891       3.671499 8.396513       5.353368 14.64969 6.131789 23.19687 7.905825 -8.547185      10.00504 
1 1 1 28  6  1  o 19.31278 6.397313 5.369417       3.506913 10.64589       6.338903 3.042129       4.209857 25.29086 8.603114 16.74252 6.735115 8.548342       10.92590 
1 1 1 28  6  2  o 12.13787 5.528906 -1.182973      3.601974 -2.886581      5.640871 -0.1010272E-01 4.680435 14.06709 6.584544 14.56220 6.495502 -0.4951105     9.249204 
1 1 1 28  6  3  o 16.85870 5.800615 3.914206       2.883554 3.088456       3.526100 5.581321       5.010180 16.09925 6.260868 19.70444 7.514795 -3.605181      9.781136 
1 1 1 28  6  4  o 16.27999 5.867107 3.545771       2.975466 0.5757616      3.629498 9.632689       5.195968 13.52522 5.886837 24.26563 7.769919 -10.74041      9.748154 
1 1 1 28  6  5  o 32.93491 4.925300 15.01927       3.831776 14.64336       4.350846 16.31870       8.089370 31.78065 5.832791 29.00363 9.718831 2.777027       11.33477 
1 1 1 28  6  6  o 19.91494 6.238873 5.992049       3.366192 4.330855       3.798555 12.06847       7.264946 17.57212 6.578407 25.29941 9.160994 -7.727291      11.27826 
1 1 1 28  6  7  o 26.76936 5.526493 10.41171       3.485637 11.90775       3.983615 5.524971       7.199725 28.31118 5.962751 19.80772 8.451971 8.503460       10.34361 
1 1 1 28  7  0  o 26.70527 5.911154 10.22946       3.745074 8.514372       6.423307 11.11276       4.609661 23.13654 8.575226 27.11481 6.946021 -3.978271      11.03547 
1 1 1 28  7  1  o 14.09083 5.671859 1.846527       2.987533 2.008331       3.673314 1.530374       5.134677 15.09896 6.209571 16.24574 7.036858 -1.146784      9.384889 
1 1 1 28  7  2  o 28.68629 4.780198 11.25300       3.224084 10.10601       4.069774 13.18589       5.283145 26.02886 6.449439 28.97616 7.443119 -2.947298      9.848619 
1 1 1 28  7  3  o 14.68383 5.614010 2.516676       2.800688 2.674602       3.424218 2.197527       4.867782 15.48711 6.125580 16.37723 6.967662 -0.8901110     9.277449 
1 1 1 28  7  4  o 36.65631 4.072363 17.85243       3.576414 19.17360       4.464113 15.48485       5.975964 37.21161 5.053357 30.69963 7.931799 6.511982       9.404778 
1 1 1 28  7  5  o 14.60342 5.641876 2.497021       2.849114 5.880175       3.564427 -3.489126      4.741355 19.73432 6.445219 12.37481 5.866603 7.359513       8.715383 
1 1 1 28  7  6  o 11.28545 5.060806 -0.4772010     2.881951 -0.4400179     3.473430 -0.5593567     5.163031 12.31866 5.537447 14.47968 6.604794 -2.161022      8.618969 
1 1 1 28  8  0  o 14.77689 5.777431 2.350372       3.015500 2.940977       3.656000 1.093553       5.333275 16.13773 6.345968 16.14972 7.080181 -0.1198959E-01 9.507906 
1 1 1 28  8  1  o 32.44181 4.182740 13.97994       3.229884 12.19699       4.302080 16.28312       4.889608 28.82885 6.300118 33.50783 6.216981 -4.678982      8.851121 
1 1 1 28  8  2  o 13.00604 5.499951 0.9386100      3.002076 1.219705       3.366993 -0.1513874     6.630232 13.82689 5.834715 16.49957 7.510090 -2.672686      9.510277 
1 1 1 28  8  3  f 29.53811 4.737854 11.95920       3.295104 13.41461       4.140668 9.445859       5.441307 30.53907 5.775403 23.91191 7.970135 6.627161       9.842679 
1 1 1 28  8  4  o 11.74446 5.117334 0.2048047      2.748973 0.8217210      3.324512 -1.128883      4.888120 13.27593 5.705662 13.90743 6.374954 -0.6315041     8.555385 
1 1 1 28  8  5  o 11.23608 5.132033 -1.106618      3.130554 0.3392351      4.028945 -3.309638      4.973229 13.76491 6.089388 12.76713 6.039487 0.9977798      8.576483 
1 1 1 28  9  0  o 11.61614 5.089338 -0.2325410E-01 2.751710 -2.243462      3.577343 3.193911       4.306262 11.37024 5.296192 16.92988 6.811338 -5.559635      8.628093 
1 1 1 28  9  1  o 13.45684 5.543935 1.414395       2.934731 3.090682       3.531376 -2.327801      5.276342 16.12953 6.267536 13.85952 6.447719 2.270007       8.991945 
1 1 1 28  9  2  o 11.22543 4.950780 -0.1607201     2.643691 -3.040324      3.396418 4.265893       4.211051 10.49445 4.972271 17.89785 6.873565 -7.403408      8.483477 
1 1 1 28  9  3  o 18.28424 6.348980 4.831495       3.457673 1.457312       3.848814 18.94694       7.872087 14.58792 6.200618 32.09391 9.438438 -17.50599      11.29300 
1 1 1 28  9  4  o 22.15972 6.393151 7.486939       3.642706 2.058079       4.706918 15.59396       5.751923 15.95282 6.821204 30.97326 7.663069 -15.02044      10.25921 
1 1 1 28  9  5  o 27.60925 5.034381 10.72281       3.262406 13.95781       4.067821 4.890857       5.461745 31.14761 5.563381 18.82842 7.636541 12.31919       9.448173 
1 1 1 28  10 0  o 14.83365 5.838983 2.366408       3.097879 2.859164       3.770870 1.343414       5.433286 16.07723 6.405783 16.33800 7.154932 -0.2607708     9.603495 
1 1 1 28  10 1  o 11.83223 5.214013 -0.8390252E-01 2.926503 1.861240       3.529980 -4.359465      5.233511 14.68705 6.068401 12.76124 6.082129 1.925817       8.591728 
1 1 1 28  10 2  o 27.33497 6.420805 11.21729       4.203822 16.37786       5.840947 5.671489       6.055034 32.03438 7.597891 19.98145 8.063493 12.05293       11.07916 
1 1 1 28  10 3  o 23.06532 6.550594 8.159516       3.853567 7.423575       5.113616 9.126737       5.862317 21.50956 7.698880 23.21024 8.250257 -1.700682      11.28448 
1 1 1 28  10 4  o 14.13711 5.799414 1.836283       3.193731 0.6806166      3.509927 7.397390       7.699500 13.36570 5.803504 21.45277 8.921760 -8.087067      10.64324 
1 1 1 28  11 0  o 10.49262 4.768203 -0.9942576     2.659247 -0.3294193     3.416274 -2.016463      4.236077 12.45414 5.552677 12.55217 5.818115 -0.9803867E-01 8.042555 
1 1 1 28  11 1  o 12.52763 5.463612 0.2916190      3.139760 -2.409142      4.464406 2.934802       4.416561 12.62668 5.893086 16.60183 6.816228 -3.975154      9.010518 
1 1 1 28  11 2  o 18.98075 5.975522 5.283417       3.084267 1.299941       4.005290 11.08674       4.834385 14.61759 6.272149 26.37310 7.282564 -11.75551      9.611222 
1 1 1 28  11 3  o 32.73368 5.364907 15.16762       4.131382 18.94439       4.676404 1.739084       8.817931 36.60234 5.405260 18.73068 8.577034 17.87166       10.13816 
1 1 1 28  12 0  o 38.27100 5.960400 21.08256       5.377842 0.000000       0.000000 21.08256       5.377842 ?        ?        38.27100 5.960400 0.000000       5.960400 
1 1 1 28  12 1  o 26.38961 5.284682 9.863640       3.279896 10.86776       4.360001 8.554608       4.978173 26.61812 6.721344 22.97531 7.622420 3.642811       10.16257 
1 1 1 29  0  0  o 11.53477 7.222150 1.695221       4.189274 1.695221       4.189274 1.695221       4.189274 11.53477 7.222150 11.53477 7.222150 0.000000       0.000000 
1 1 1 29  0  1  o 19.52153 8.841708 7.739994       4.532974 7.739994       4.532974 7.739994       4.532974 19.52153 8.841708 19.52153 8.841708 0.000000       0.000000 
1 1 1 29  1  0  o 40.11021 4.215711 21.38726       4.059091 26.56216       5.575324 15.55054       5.921113 43.68793 5.348287 31.05987 7.827127 12.62806       9.479878 
1 1 1 29  1  1  o 19.01622 6.047893 5.285157       3.152257 4.935348       4.335609 5.677444       4.591300 18.68244 7.020961 19.61014 7.253279 -0.9277039     10.09475 
1 1 1 29  2  0  o 11.29738 5.151925 -1.152866      3.138901 -7.124475      5.327201 2.022956       3.884915 11.76115 5.733503 15.24457 6.338432 -3.483421      8.546858 
1 1 1 29  2  1  o 27.42830 5.961447 10.99436       3.870612 4.345197       5.928279 15.93490       5.110135 18.83780 7.830949 32.53440 6.669634 -13.69659      10.28629 
1 1 1 29  3  0  o 40.82799 5.039501 22.92837       4.907662 26.46424       5.483518 8.696330       11.00132 43.67833 5.257362 23.17368 10.16391 20.50465       11.44311 
1 1 1 29  3  1  o 14.68531 5.971707 2.085059       3.350090 -2.141687      3.777499 17.65663       7.250492 11.70356 5.448387 31.62410 8.986646 -19.92054      10.50927 
1 1 1 29  4  0  o 17.53143 5.942891 4.337889       3.024544 5.538324       3.996432 2.728557       4.627279 19.38928 6.819252 16.61081 6.912944 2.778471       9.710356 
1 1 1 29  5  0  o 11.76003 5.091440 0.2900845      2.685467 -1.729525      3.569491 2.924101       4.076447 11.63505 5.374627 16.32572 6.606134 -4.690666      8.516315 
# 
#END OF REFLECTIONS
